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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 A0A059QXN6, 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
1M80.4Confident92.9Very high197 Ų19784 Ų8497%0.9741%0.41SS*.  0-58.60-158.4176.3-89.600112.9D4 R5M1-D4 WeakPolarHBondContact CA-OD2 3.29Å; M1-D4 PolarHBondContact N-OD2 3.31Å; M1-R5 WeakPolarHBondContact O-CB 3.38Å; M1-R5 PolarHBondContact O-N 3.01Å
2F90.3Very high93.3Very high152 Ų15277 Ų7767%0.66738%0.376SS*.Hα-helixtrans-66.4-50.9177.3-179.5-90.5000113D4 R5 W6F2-D4 PolarHBondContact O-N 3.34Å; F2-R5 PolarHBondContact O-N 2.83Å; F2-W6 AromaticContact CD2-CD1 3.47Å; F2-W6 VanDerWaalsContact CD2-CD1 3.47Å; F2-W6 AromaticContact CD2-NE1 3.9Å; F2-W6 AromaticContact CE2-CD1 3.36Å; F2-W6 HydrophobicContact CE2-CG 4.26Å; F2-W6 AromaticContact CE2-NE1 3.76Å; F2-W6 AromaticContact CZ-CD1 3.83Å; F2-W6 HydrophobicContact CZ-CG 4.36Å; F2-W6 PolarHBondContact O-N 2.71Å
3A92Very high93.7Very high37 Ų3771.5 Ų71.531%0.30635%0.349SS..Hα-helixtrans-60-44.3178.900000111.9R5 W6 L7 F8A3-R5 VanDerWaalsContact C-N 3.31Å; A3-R5 PolarHBondContact O-N 2.97Å; A3-W6 PolarHBondContact O-N 3.19Å; A3-L7 HydrophobicContact CB-CD1 4.01Å; A3-L7 WeakPolarHBondContact O-CA 3.41Å; A3-L7 VanDerWaalsContact O-CB 3.29Å; A3-L7 WeakPolarHBondContact O-CB 3.23Å; A3-L7 PolarHBondContact O-N 3.01Å; A3-F8 HydrophobicContact CB-CE2 4.46Å; A3-F8 PolarHBondContact O-N 2.9Å
4D91.1Very high94Very high98 Ų9867.1 Ų67.152%0.52433%0.328SS..Hα-helixtrans-60.9-40.9178.7-47.6-50.5000112M1 F2 F8 S9M1-D4 WeakPolarHBondContact CA-OD2 3.29Å; M1-D4 PolarHBondContact N-OD2 3.31Å; F2-D4 PolarHBondContact O-N 3.34Å; D4-F8 CarbonylContact O-C 3.27Å; D4-F8 VanDerWaalsContact O-C 3.27Å; D4-S9 PolarHBondContact O-N 3.04Å
5R92.3Very high94.3Very high92 Ų9262.6 Ų62.635%0.34731%0.306SS..Hα-helixtrans-73.1-42.5-178.7-176.2177173.6-169.2-4.4113.1M1 F2 A3 S9 D14 Y502M1-R5 WeakPolarHBondContact O-CB 3.38Å; M1-R5 PolarHBondContact O-N 3.01Å; F2-R5 PolarHBondContact O-N 2.83Å; A3-R5 VanDerWaalsContact C-N 3.31Å; A3-R5 PolarHBondContact O-N 2.97Å; R5-S9 WeakPolarHBondContact O-CB 3.25Å; R5-S9 PolarHBondContact O-OG 3.45Å; R5-D14 VanDerWaalsContact CG-OD2 3.25Å; R5-D14 WeakPolarHBondContact CG-OD2 3.39Å; R5-D14 IonicContact CZ-OD1 3.38Å; R5-D14 IonicContact NE-OD1 3.04Å; R5-D14 PolarHBondContact NE-OD1 3.48Å; R5-D14 IonicContact NE-OD2 3.31Å; R5-D14 PolarHBondContact NE-OD2 3.38Å; R5-D14 IonicContact NH2-OD1 3.87Å; R5-D14 PolarHBondContact NH2-OD1 3.25Å; R5-Y502 PolarHBondContact NH1-OH 3.05Å; R5-Y502 PolarHBondContact NH2-OH 3.25Å
6W95Very high94.5Very high50 Ų5058.7 Ų58.719%0.18929%0.287CS..Hα-helixtrans-106-38-169.1-63.5111.6000113.9F2 A3 D14 T17 L18F2-W6 AromaticContact CD2-CD1 3.47Å; F2-W6 VanDerWaalsContact CD2-CD1 3.47Å; F2-W6 AromaticContact CD2-NE1 3.9Å; F2-W6 AromaticContact CE2-CD1 3.36Å; F2-W6 HydrophobicContact CE2-CG 4.26Å; F2-W6 AromaticContact CE2-NE1 3.76Å; F2-W6 AromaticContact CZ-CD1 3.83Å; F2-W6 HydrophobicContact CZ-CG 4.36Å; F2-W6 PolarHBondContact O-N 2.71Å; A3-W6 PolarHBondContact O-N 3.19Å; W6-D14 HydrophobicContact CE3-CB 4.23Å; W6-D14 HydrophobicContact CZ3-CB 3.96Å; W6-T17 HydrophobicContact CH2-CG2 4.26Å; W6-T17 HydrophobicContact CZ3-CG2 4.29Å; W6-L18 HydrophobicContact CE3-CD1 4.38Å; W6-L18 HydrophobicContact CE3-CD2 3.8Å; W6-L18 HydrophobicContact CE3-CG 3.95Å; W6-L18 HydrophobicContact CZ3-CD2 4.34Å; W6-L18 HydrophobicContact CZ3-CG 4.31Å; W6-L18 WeakPolarHBondContact O-CD1 3.37Å
7L94.5Very high94.8Very high71 Ų7157.3 Ų57.337%0.37228%0.282SS..THydrogen-bonded Turntrans-85-44.6179.1-56.6179000111.1A3 N99 W103A3-L7 HydrophobicContact CB-CD1 4.01Å; A3-L7 WeakPolarHBondContact O-CA 3.41Å; A3-L7 VanDerWaalsContact O-CB 3.29Å; A3-L7 WeakPolarHBondContact O-CB 3.23Å; A3-L7 PolarHBondContact O-N 3.01Å; L7-N99 PolarHBondContact O-ND2 3.28Å; L7-W103 HydrophobicContact CB-CZ2 4.49Å; L7-W103 HydrophobicContact CD2-CH2 3.39Å; L7-W103 HydrophobicContact CD2-CZ2 3.41Å; L7-W103 VanDerWaalsContact CD2-CZ2 3.41Å; L7-W103 HydrophobicContact CD2-CZ3 4.42Å; L7-W103 PolarHBondContact O-NE1 3.19Å
8F96.3Very high95Very high143 Ų14355.4 Ų55.463%0.62727%0.274SS*.SBendtrans-10325-178.4-53.3-61.2000112.9A3 D4A3-F8 HydrophobicContact CB-CE2 4.46Å; A3-F8 PolarHBondContact O-N 2.9Å; D4-F8 CarbonylContact O-C 3.27Å; D4-F8 VanDerWaalsContact O-C 3.27Å
9S96.1Very high95.2Very high4 Ų453.1 Ų53.13%0.02826%0.261CS..  trans-59142.5-178.2-154.50000111.7D4 R5 N11 D14 N99D4-S9 PolarHBondContact O-N 3.04Å; R5-S9 WeakPolarHBondContact O-CB 3.25Å; R5-S9 PolarHBondContact O-OG 3.45Å; S9-N11 PolarHBondContact OG-N 3.01Å; S9-D14 WeakPolarHBondContact OG-CB 3.24Å; S9-N99 VanDerWaalsContact O-CB 3.31Å; S9-N99 WeakPolarHBondContact O-CB 3.34Å; S9-N99 VanDerWaalsContact O-CG 3.24Å; S9-N99 PolarHBondContact O-ND2 3.39Å
10T96.6Very high95.3Very high68 Ų6851.8 Ų51.842%0.41726%0.255SS..  trans-116.7-2.5162.255.60000111.8D91 P95 R96T10-D91 VanDerWaalsContact O-OD2 3.09Å; T10-P95 HydrophobicContact CG2-CB 4.21Å; T10-P95 WeakPolarHBondContact O-CB 3.48Å; T10-R96 HydrophobicContact CG2-CG 4.14Å
11N97.4Very high95.5Very high12 Ų1254.6 Ų54.66%0.06427%0.271CS..  trans-84.2126.2-175.7-172.9-78.3000110.7S9 K13 D14 I15 Y502S9-N11 PolarHBondContact OG-N 3.01Å; N11-K13 PolarHBondContact O-N 2.66Å; N11-K13 WeakPolarHBondContact OD1-CA 3.41Å; N11-K13 WeakPolarHBondContact OD1-CB 3.44Å; N11-K13 PolarHBondContact OD1-N 3.36Å; N11-D14 HydrophobicContact CB-CB 4.36Å; N11-D14 PolarHBondContact O-N 3.43Å; N11-D14 PolarHBondContact OD1-N 3.27Å; N11-I15 WeakPolarHBondContact O-CG1 3.33Å; N11-I15 PolarHBondContact O-N 3.21Å; N11-Y502 PolarHBondContact ND2-O 3.47Å
12H97.8Very high96.3Very high0 Ų046.4 Ų46.40%023%0.23CC..Hα-helixtrans-57.4-29.8178.970.1101.7000114.8G16 N80 P84 D91 M92H12-G16 PolarHBondContact O-N 2.99Å; H12-N80 PolarHBondContact ND1-O 3.12Å; H12-P84 HydrophobicContact CB-CG 4.27Å; H12-D91 VanDerWaalsContact CB-OD1 3.27Å; H12-D91 WeakPolarHBondContact CB-OD1 3.19Å; H12-D91 IonicContact CD2-OD1 2.83Å; H12-D91 PolarHBondContact CD2-OD1 2.85Å; H12-D91 VanDerWaalsContact CD2-OD1 3.31Å; H12-D91 IonicContact CG-OD1 2.67Å; H12-D91 PolarHBondContact N-OD1 2.75Å; H12-M92 HydrophobicContact CB-CG 3.78Å
13K98Very high96.7Very high6 Ų639.1 Ų39.13%0.02620%0.198CC..Hα-helixtrans-75-41.2179.9-55.9166.9-177.1144.10111.4N11 T17 W81 P500 P501 Y502 T504N11-K13 PolarHBondContact O-N 2.66Å; N11-K13 WeakPolarHBondContact OD1-CA 3.41Å; N11-K13 WeakPolarHBondContact OD1-CB 3.44Å; N11-K13 PolarHBondContact OD1-N 3.36Å; K13-T17 WeakPolarHBondContact O-CB 3.37Å; K13-T17 PolarHBondContact O-N 3.41Å; K13-T17 PolarHBondContact O-OG1 3.41Å; K13-W81 HydrophobicContact CB-CD2 4.19Å; K13-W81 HydrophobicContact CB-CE3 4.04Å; K13-W81 HydrophobicContact CB-CH2 3.75Å; K13-W81 HydrophobicContact CB-CZ2 3.88Å; K13-W81 HydrophobicContact CB-CZ3 3.83Å; K13-W81 HydrophobicContact CD-CH2 4.49Å; K13-W81 HydrophobicContact CD-CZ3 4.04Å; K13-W81 HydrophobicContact CG-CD2 4.41Å; K13-W81 HydrophobicContact CG-CE3 3.88Å; K13-W81 HydrophobicContact CG-CH2 4.21Å; K13-W81 HydrophobicContact CG-CZ3 3.77Å; K13-W81 PolarHBondContact O-NE1 2.85Å; K13-P500 HydrophobicContact CD-CG 4.28Å; K13-P501 PolarHBondContact NZ-O 3.38Å; K13-Y502 PolarHBondContact NZ-O 2.87Å; K13-T504 PolarHBondContact NZ-OG1 3.28Å
14D97.9Very high97Very high9 Ų940 Ų405%0.04821%0.205CC..Hα-helixtrans-65.4-47.1174.8-74.8-26.5000110R5 W6 S9 N11 G16 T17 L18R5-D14 VanDerWaalsContact CG-OD2 3.25Å; R5-D14 WeakPolarHBondContact CG-OD2 3.39Å; R5-D14 IonicContact CZ-OD1 3.38Å; R5-D14 IonicContact NE-OD1 3.04Å; R5-D14 PolarHBondContact NE-OD1 3.48Å; R5-D14 IonicContact NE-OD2 3.31Å; R5-D14 PolarHBondContact NE-OD2 3.38Å; R5-D14 IonicContact NH2-OD1 3.87Å; R5-D14 PolarHBondContact NH2-OD1 3.25Å; W6-D14 HydrophobicContact CE3-CB 4.23Å; W6-D14 HydrophobicContact CZ3-CB 3.96Å; S9-D14 WeakPolarHBondContact OG-CB 3.24Å; N11-D14 HydrophobicContact CB-CB 4.36Å; N11-D14 PolarHBondContact O-N 3.43Å; N11-D14 PolarHBondContact OD1-N 3.27Å; D14-G16 PolarHBondContact O-N 3.44Å; D14-T17 WeakPolarHBondContact O-CB 3.25Å; D14-T17 PolarHBondContact O-N 2.87Å; D14-T17 VanDerWaalsContact O-N 3.15Å; D14-L18 WeakPolarHBondContact O-CG 3.31Å; D14-L18 PolarHBondContact O-N 2.87Å
15I98.5Very high97.3Very high0 Ų042.5 Ų42.50%021%0.207CC..Hα-helixtrans-62.3-44.6176.7-65166000111.2N11 T17 L18 Y19 N98 N99 F102N11-I15 WeakPolarHBondContact O-CG1 3.33Å; N11-I15 PolarHBondContact O-N 3.21Å; I15-T17 VanDerWaalsContact C-N 3.26Å; I15-T17 PolarHBondContact O-N 3.42Å; I15-L18 WeakPolarHBondContact O-CB 3.48Å; I15-L18 PolarHBondContact O-N 3.45Å; I15-L18 VanDerWaalsContact O-N 3.11Å; I15-Y19 HydrophobicContact CG2-CD2 3.83Å; I15-Y19 HydrophobicContact CG2-CE2 3.66Å; I15-Y19 VanDerWaalsContact O-CD2 3.3Å; I15-Y19 WeakPolarHBondContact O-CD2 3.29Å; I15-Y19 PolarHBondContact O-N 3.31Å; I15-N98 HydrophobicContact CD1-CB 4.04Å; I15-N99 HydrophobicContact CD1-CB 3.96Å; I15-F102 HydrophobicContact CG2-CB 4.21Å
16G98.3Very high97.6Very high0 Ų038.1 Ų38.10%019%0.191CC..Hα-helixtrans-59.1-37.2174.500000112.4H12 D14 Y19 L20 G77 W81H12-G16 PolarHBondContact O-N 2.99Å; D14-G16 PolarHBondContact O-N 3.44Å; G16-Y19 PolarHBondContact O-N 3.08Å; G16-L20 WeakPolarHBondContact O-CG 3.47Å; G16-L20 PolarHBondContact O-N 3.44Å; G16-G77 WeakPolarHBondContact O-CA 3.44Å; G16-W81 VanDerWaalsContact C-CD1 3.5Å
17T98.4Very high97.7Very high35 Ų3536 Ų3622%0.21519%0.185CC..Hα-helixtrans-65.5-41.5174.2-56.60000111.8W6 K13 D14 I15 Y19 L20 L21 W81W6-T17 HydrophobicContact CH2-CG2 4.26Å; W6-T17 HydrophobicContact CZ3-CG2 4.29Å; K13-T17 WeakPolarHBondContact O-CB 3.37Å; K13-T17 PolarHBondContact O-N 3.41Å; K13-T17 PolarHBondContact O-OG1 3.41Å; D14-T17 WeakPolarHBondContact O-CB 3.25Å; D14-T17 PolarHBondContact O-N 2.87Å; D14-T17 VanDerWaalsContact O-N 3.15Å; I15-T17 VanDerWaalsContact C-N 3.26Å; I15-T17 PolarHBondContact O-N 3.42Å; T17-Y19 VanDerWaalsContact C-N 3.34Å; T17-Y19 PolarHBondContact O-N 3.45Å; T17-L20 PolarHBondContact O-N 3.37Å; T17-L21 HydrophobicContact CG2-CD1 4.18Å; T17-L21 HydrophobicContact CG2-CG 4.41Å; T17-L21 WeakPolarHBondContact O-CG 3.22Å; T17-L21 PolarHBondContact O-N 2.83Å; T17-W81 VanDerWaalsContact OG1-CZ2 3.27Å; T17-W81 WeakPolarHBondContact OG1-CZ2 3.44Å; T17-W81 PolarHBondContact OG1-NE1 3.41Å; T17-W81 VanDerWaalsContact OG1-NE1 3.08Å
18L98.6Very high97.9Very high24 Ų2436.1 Ų36.113%0.12619%0.188CC..Hα-helixtrans-60.2-43.4175.7-68.8174000111.7W6 D14 I15 L21 F22 F102W6-L18 HydrophobicContact CE3-CD1 4.38Å; W6-L18 HydrophobicContact CE3-CD2 3.8Å; W6-L18 HydrophobicContact CE3-CG 3.95Å; W6-L18 HydrophobicContact CZ3-CD2 4.34Å; W6-L18 HydrophobicContact CZ3-CG 4.31Å; W6-L18 WeakPolarHBondContact O-CD1 3.37Å; D14-L18 WeakPolarHBondContact O-CG 3.31Å; D14-L18 PolarHBondContact O-N 2.87Å; I15-L18 WeakPolarHBondContact O-CB 3.48Å; I15-L18 PolarHBondContact O-N 3.45Å; I15-L18 VanDerWaalsContact O-N 3.11Å; L18-L21 PolarHBondContact O-N 3.49Å; L18-F22 VanDerWaalsContact O-CB 3.28Å; L18-F22 WeakPolarHBondContact O-CB 3.35Å; L18-F22 PolarHBondContact O-N 3.22Å; L18-F102 VanDerWaalsContact C-CE2 3.46Å; L18-F102 HydrophobicContact CB-CD1 4.09Å; L18-F102 HydrophobicContact CB-CD2 4Å; L18-F102 HydrophobicContact CB-CE1 3.76Å; L18-F102 HydrophobicContact CB-CE2 3.66Å; L18-F102 HydrophobicContact CB-CG 4.21Å; L18-F102 HydrophobicContact CB-CZ 3.56Å; L18-F102 HydrophobicContact CD1-CD1 3.91Å; L18-F102 HydrophobicContact CD1-CE1 3.83Å; L18-F102 HydrophobicContact CD1-CZ 4.47Å; L18-F102 HydrophobicContact CD2-CE1 4.47Å; L18-F102 HydrophobicContact CG-CE1 4.24Å; L18-F102 HydrophobicContact CG-CZ 4.4Å; L18-F102 WeakPolarHBondContact O-CE2 2.97Å
19Y98.8Very high98Very high10 Ų1031.3 Ų31.34%0.03917%0.169CC..Hα-helixtrans-60.3-44.3173.8-85.3-74.2000112.8I15 G16 T17 G23 P72 G76 S101 F102 L105I15-Y19 HydrophobicContact CG2-CD2 3.83Å; I15-Y19 HydrophobicContact CG2-CE2 3.66Å; I15-Y19 VanDerWaalsContact O-CD2 3.3Å; I15-Y19 WeakPolarHBondContact O-CD2 3.29Å; I15-Y19 PolarHBondContact O-N 3.31Å; G16-Y19 PolarHBondContact O-N 3.08Å; T17-Y19 VanDerWaalsContact C-N 3.34Å; T17-Y19 PolarHBondContact O-N 3.45Å; Y19-G23 PolarHBondContact O-N 2.93Å; Y19-P72 HydrophobicContact CD1-CB 4.02Å; Y19-G76 VanDerWaalsContact CD2-O 3.31Å; Y19-G76 WeakPolarHBondContact CD2-O 3.32Å; Y19-G76 VanDerWaalsContact CG-C 3.43Å; Y19-G76 VanDerWaalsContact CG-CA 3.44Å; Y19-S101 WeakPolarHBondContact OH-CB 3.24Å; Y19-S101 PolarHBondContact OH-O 3.35Å; Y19-S101 PolarHBondContact OH-OG 2.85Å; Y19-F102 AromaticContact CD1-CD2 3.92Å; Y19-F102 HydrophobicContact CD1-CD2 3.92Å; Y19-F102 HydrophobicContact CD2-CB 4.26Å; Y19-F102 HydrophobicContact CD2-CD2 4.01Å; Y19-F102 HydrophobicContact CE1-CB 4.42Å; Y19-F102 HydrophobicContact CE1-CD2 4.1Å; Y19-F102 HydrophobicContact CE2-CB 3.67Å; Y19-F102 HydrophobicContact CE2-CD2 4.16Å; Y19-F102 HydrophobicContact CE2-CG 4.37Å; Y19-F102 AromaticContact CG-CD2 3.88Å; Y19-F102 HydrophobicContact CG-CD2 3.88Å; Y19-F102 WeakPolarHBondContact OH-CA 3.48Å; Y19-F102 PolarHBondContact OH-N 3.24Å; Y19-L105 HydrophobicContact CD1-CD1 3.86Å; Y19-L105 HydrophobicContact CE1-CD1 3.42Å; Y19-L105 VanDerWaalsContact CE1-CD1 3.42Å
20L98.6Very high98Very high27 Ų2731.1 Ų31.114%0.14117%0.168CC..Hα-helixtrans-62.5-43.6177.6-70.1175.2000111.9G16 T17 A24 I73 F78 F400G16-L20 WeakPolarHBondContact O-CG 3.47Å; G16-L20 PolarHBondContact O-N 3.44Å; T17-L20 PolarHBondContact O-N 3.37Å; L20-A24 VanDerWaalsContact O-CB 3.25Å; L20-A24 WeakPolarHBondContact O-CB 3.47Å; L20-A24 PolarHBondContact O-N 3.33Å; L20-I73 HydrophobicContact CD2-CG2 3.96Å; L20-F78 HydrophobicContact CD2-CD2 4.5Å; L20-F78 HydrophobicContact CD2-CE2 4.42Å; L20-F400 HydrophobicContact CD1-CD2 4.16Å; L20-F400 HydrophobicContact CD1-CE2 4.12Å
21L98.4Very high98Very high111 Ų11129.5 Ų29.558%0.58116%0.157SC*.Hα-helixtrans-67.3-45.9178.7-69.4176000112.1T17 L18 A24 W25T17-L21 HydrophobicContact CG2-CD1 4.18Å; T17-L21 HydrophobicContact CG2-CG 4.41Å; T17-L21 WeakPolarHBondContact O-CG 3.22Å; T17-L21 PolarHBondContact O-N 2.83Å; L18-L21 PolarHBondContact O-N 3.49Å; L21-A24 PolarHBondContact O-N 3.37Å; L21-W25 PolarHBondContact O-N 2.87Å
22F98.7Very high98.1Very high25 Ų2531.2 Ų31.211%0.1117%0.173CC..Hα-helixtrans-59.7-49.3176.5175.5-94.6000111.2L18 A24 W25 A26 F68 P72 F102 L105 P106 L109L18-F22 VanDerWaalsContact O-CB 3.28Å; L18-F22 WeakPolarHBondContact O-CB 3.35Å; L18-F22 PolarHBondContact O-N 3.22Å; F22-A24 VanDerWaalsContact C-N 3.34Å; F22-A24 PolarHBondContact O-N 3.03Å; F22-W25 PolarHBondContact O-N 3.44Å; F22-A26 WeakPolarHBondContact O-CB 3.39Å; F22-A26 PolarHBondContact O-N 3.29Å; F22-F68 HydrophobicContact CE1-CB 4.15Å; F22-F68 AromaticContact CE1-CD1 3.94Å; F22-F68 HydrophobicContact CE1-CD1 3.94Å; F22-F68 HydrophobicContact CZ-CB 4.47Å; F22-F68 AromaticContact CZ-CD1 3.79Å; F22-F68 HydrophobicContact CZ-CD1 3.79Å; F22-P72 HydrophobicContact CD1-CB 4.19Å; F22-P72 HydrophobicContact CD1-CG 4.34Å; F22-P72 HydrophobicContact CE1-CG 4.28Å; F22-F102 HydrophobicContact CB-CE2 3.87Å; F22-F102 HydrophobicContact CB-CZ 4.36Å; F22-F102 HydrophobicContact CG-CE2 4.35Å; F22-L105 HydrophobicContact CD1-CB 4.44Å; F22-L105 HydrophobicContact CD1-CD1 4.26Å; F22-L105 HydrophobicContact CE1-CB 3.85Å; F22-L105 HydrophobicContact CE1-CD1 4.1Å; F22-L105 HydrophobicContact CE2-CB 4.45Å; F22-L105 HydrophobicContact CZ-CB 3.84Å; F22-P106 HydrophobicContact CD2-CG 4.34Å; F22-P106 HydrophobicContact CE2-CB 4.45Å; F22-P106 HydrophobicContact CE2-CG 4.21Å; F22-L109 HydrophobicContact CE2-CB 4.31Å; F22-L109 HydrophobicContact CE2-CD2 3.73Å; F22-L109 HydrophobicContact CZ-CB 3.94Å; F22-L109 HydrophobicContact CZ-CD2 3.61Å; F22-L109 HydrophobicContact CZ-CG 4.43Å
23G98.4Very high98.1Very high0 Ų032.5 Ų32.50%018%0.18CC..Hα-helixtrans-65.2-35.8179.700000113.3Y19 G27 F68Y19-G23 PolarHBondContact O-N 2.93Å; G23-G27 PolarHBondContact O-N 3.46Å; G23-F68 WeakPolarHBondContact CA-O 3.24Å
24A97.7Very high98.1Very high54 Ų5433.4 Ų33.445%0.44619%0.187SC..Hα-helixtrans-64.3-44173.200000111.8L20 L21 F22 G27 V28L20-A24 VanDerWaalsContact O-CB 3.25Å; L20-A24 WeakPolarHBondContact O-CB 3.47Å; L20-A24 PolarHBondContact O-N 3.33Å; L21-A24 PolarHBondContact O-N 3.37Å; F22-A24 VanDerWaalsContact C-N 3.34Å; F22-A24 PolarHBondContact O-N 3.03Å; A24-G27 PolarHBondContact O-N 2.93Å; A24-V28 PolarHBondContact O-N 3.05Å; A24-V28 VanDerWaalsContact O-N 3.09Å
25W98.1Very high98.1Very high151 Ų15134.2 Ų34.257%0.57219%0.191SC*.Hα-helixtrans-62.8-47.9176.4-174.790.3000111.7L21 F22 G27 V28 L29 L109 L113L21-W25 PolarHBondContact O-N 2.87Å; F22-W25 PolarHBondContact O-N 3.44Å; W25-G27 VanDerWaalsContact C-N 3.28Å; W25-G27 PolarHBondContact O-N 2.71Å; W25-V28 PolarHBondContact O-N 3Å; W25-L29 HydrophobicContact CH2-CD2 4.02Å; W25-L29 HydrophobicContact CZ3-CD2 3.81Å; W25-L29 PolarHBondContact O-N 3.4Å; W25-L29 VanDerWaalsContact O-N 3.13Å; W25-L109 HydrophobicContact CE3-CD2 4.06Å; W25-L109 HydrophobicContact CZ3-CD2 3.66Å; W25-L113 HydrophobicContact CH2-CD1 4.43Å
26A98.4Very high98Very high0 Ų038 Ų380%021%0.212CC..Hα-helixtrans-61.5-36.3175.500000111.9F22 L29 G30 V64 F68 L109F22-A26 WeakPolarHBondContact O-CB 3.39Å; F22-A26 PolarHBondContact O-N 3.29Å; A26-L29 WeakPolarHBondContact O-CB 3.29Å; A26-L29 PolarHBondContact O-N 3.29Å; A26-G30 PolarHBondContact O-N 2.84Å; A26-V64 HydrophobicContact CB-CG1 4.28Å; A26-V64 WeakPolarHBondContact O-CG1 3.33Å; A26-F68 HydrophobicContact CB-CB 3.86Å; A26-F68 VanDerWaalsContact CB-O 3.28Å; A26-F68 WeakPolarHBondContact CB-O 3.46Å; A26-L109 HydrophobicContact CB-CD2 4.34Å
27G97.2Very high98Very high7 Ų738.9 Ų38.97%0.07222%0.216CC..Hα-helixtrans-63.9-38.9175.600000113.3G23 A24 W25 G30 T31G23-G27 PolarHBondContact O-N 3.46Å; A24-G27 PolarHBondContact O-N 2.93Å; W25-G27 VanDerWaalsContact C-N 3.28Å; W25-G27 PolarHBondContact O-N 2.71Å; G27-G30 PolarHBondContact O-N 3.2Å; G27-T31 WeakPolarHBondContact O-CB 3.45Å; G27-T31 PolarHBondContact O-N 3.35Å; G27-T31 PolarHBondContact O-OG1 3.27Å
28V97.5Very high98Very high73 Ų7337.7 Ų37.744%0.44221%0.207SC..Hα-helixtrans-64.2-43.6173.3174.10000110.5A24 W25 T31 A32A24-V28 PolarHBondContact O-N 3.05Å; A24-V28 VanDerWaalsContact O-N 3.09Å; W25-V28 PolarHBondContact O-N 3Å; V28-T31 PolarHBondContact O-N 3.06Å; V28-A32 PolarHBondContact O-N 3.41Å
29L98.2Very high97.9Very high42 Ų4238 Ų3822%0.2221%0.214CC..Hα-helixtrans-60.9-48175.2176.560.8000112.1W25 A26 T31 A32 L33 L113W25-L29 HydrophobicContact CH2-CD2 4.02Å; W25-L29 HydrophobicContact CZ3-CD2 3.81Å; W25-L29 PolarHBondContact O-N 3.4Å; W25-L29 VanDerWaalsContact O-N 3.13Å; A26-L29 WeakPolarHBondContact O-CB 3.29Å; A26-L29 PolarHBondContact O-N 3.29Å; L29-T31 VanDerWaalsContact C-N 3.3Å; L29-T31 PolarHBondContact O-N 3.41Å; L29-A32 WeakPolarHBondContact O-CB 3.38Å; L29-A32 PolarHBondContact O-N 2.8Å; L29-L33 WeakPolarHBondContact O-CG 3.26Å; L29-L33 PolarHBondContact O-N 2.67Å; L29-L113 HydrophobicContact CD2-CD1 3.99Å; L29-L113 HydrophobicContact CD2-CD2 3.74Å; L29-L113 HydrophobicContact CD2-CG 4.46Å
30G97.7Very high97.8Very high0 Ų037.7 Ų37.70%021%0.213CC..Hα-helixtrans-61.8-37.5177.100000112.6A26 G27 L33 S34 H61A26-G30 PolarHBondContact O-N 2.84Å; G27-G30 PolarHBondContact O-N 3.2Å; G30-L33 PolarHBondContact O-N 3.01Å; G30-S34 PolarHBondContact O-N 2.74Å; G30-H61 PolarHBondContact O-ND1 2.72Å
31T96.5Very high97.8Very high33 Ų3336.5 Ų36.520%0.20221%0.206CC..Hα-helixtrans-65.8-41.5173.8-570000111.5G27 V28 L29 L33 S34 L35 V465G27-T31 WeakPolarHBondContact O-CB 3.45Å; G27-T31 PolarHBondContact O-N 3.35Å; G27-T31 PolarHBondContact O-OG1 3.27Å; V28-T31 PolarHBondContact O-N 3.06Å; L29-T31 VanDerWaalsContact C-N 3.3Å; L29-T31 PolarHBondContact O-N 3.41Å; T31-L33 VanDerWaalsContact C-N 3.34Å; T31-L33 PolarHBondContact O-N 3.06Å; T31-S34 WeakPolarHBondContact O-CB 3.19Å; T31-S34 PolarHBondContact O-N 3.41Å; T31-S34 VanDerWaalsContact O-N 3.16Å; T31-L35 HydrophobicContact CG2-CD1 4.25Å; T31-L35 WeakPolarHBondContact O-CG 3.23Å; T31-L35 PolarHBondContact O-N 3.33Å; T31-V465 HydrophobicContact CG2-CG2 4.4Å
32A97.9Very high97.6Very high48 Ų4832.1 Ų32.140%0.39719%0.188SC..Hα-helixtrans-60.3-43.3175.500000111.8V28 L29 S34 L35 L36V28-A32 PolarHBondContact O-N 3.41Å; L29-A32 WeakPolarHBondContact O-CB 3.38Å; L29-A32 PolarHBondContact O-N 2.8Å; A32-S34 VanDerWaalsContact C-N 3.34Å; A32-S34 PolarHBondContact O-N 2.98Å; A32-L35 PolarHBondContact O-N 3.44Å; A32-L36 PolarHBondContact O-N 3.11Å; A32-L36 VanDerWaalsContact O-N 3.14Å
33L98.3Very high97.4Very high27 Ų2737.1 Ų37.114%0.14121%0.212CC..Hα-helixtrans-62.8-40.7174-63.3171000111.7L29 G30 T31 L35 L36 I37 I57 A60 H61 V64L29-L33 WeakPolarHBondContact O-CG 3.26Å; L29-L33 PolarHBondContact O-N 2.67Å; G30-L33 PolarHBondContact O-N 3.01Å; T31-L33 VanDerWaalsContact C-N 3.34Å; T31-L33 PolarHBondContact O-N 3.06Å; L33-L35 VanDerWaalsContact C-N 3.31Å; L33-L35 PolarHBondContact O-N 3.4Å; L33-L36 PolarHBondContact O-N 2.98Å; L33-I37 WeakPolarHBondContact O-CG1 3.37Å; L33-I37 PolarHBondContact O-N 3.04Å; L33-I37 VanDerWaalsContact O-N 3.11Å; L33-I57 HydrophobicContact CB-CG2 4.06Å; L33-I57 HydrophobicContact CD2-CG2 4.01Å; L33-A60 HydrophobicContact CD1-CB 3.86Å; L33-H61 HydrophobicContact CB-CB 3.86Å; L33-H61 HydrophobicContact CD1-CB 4.45Å; L33-V64 HydrophobicContact CD1-CG2 4.43Å
34S97.7Very high97.2Very high26 Ų2638.9 Ų38.918%0.18222%0.223CC..Hα-helixtrans-59.8-41.3175.1-162.30000112.4G30 T31 A32 L36 I37 R38 H61G30-S34 PolarHBondContact O-N 2.74Å; T31-S34 WeakPolarHBondContact O-CB 3.19Å; T31-S34 PolarHBondContact O-N 3.41Å; T31-S34 VanDerWaalsContact O-N 3.16Å; A32-S34 VanDerWaalsContact C-N 3.34Å; A32-S34 PolarHBondContact O-N 2.98Å; S34-L36 VanDerWaalsContact C-N 3.34Å; S34-L36 PolarHBondContact O-N 3.24Å; S34-I37 WeakPolarHBondContact O-CB 3.41Å; S34-I37 PolarHBondContact O-N 3.02Å; S34-R38 WeakPolarHBondContact O-CG 3.45Å; S34-R38 PolarHBondContact O-N 3.33Å; S34-H61 VanDerWaalsContact CB-CE1 3.47Å; S34-H61 WeakPolarHBondContact CB-CE1 3.48Å
35L97.7Very high96.9Very high25 Ų2537.8 Ų37.813%0.13122%0.217CC..Hα-helixtrans-66.3-36.7178.3-71.7164.3000112.1T31 A32 L33 R38 A39 F459 L462T31-L35 HydrophobicContact CG2-CD1 4.25Å; T31-L35 WeakPolarHBondContact O-CG 3.23Å; T31-L35 PolarHBondContact O-N 3.33Å; A32-L35 PolarHBondContact O-N 3.44Å; L33-L35 VanDerWaalsContact C-N 3.31Å; L33-L35 PolarHBondContact O-N 3.4Å; L35-R38 PolarHBondContact O-N 3.01Å; L35-A39 VanDerWaalsContact O-CB 3.23Å; L35-A39 WeakPolarHBondContact O-CB 3.42Å; L35-A39 PolarHBondContact O-N 2.9Å; L35-F459 HydrophobicContact CD2-CD1 4.16Å; L35-F459 HydrophobicContact CD2-CE1 4.29Å; L35-L462 HydrophobicContact CD1-CB 4.15Å; L35-L462 HydrophobicContact CD1-CD1 3.86Å; L35-L462 HydrophobicContact CD1-CD2 3.76Å; L35-L462 HydrophobicContact CD1-CG 4.11Å; L35-L462 HydrophobicContact CD2-CB 4.16Å; L35-L462 HydrophobicContact CD2-CD2 4.4Å
36L97.8Very high96.3Very high81 Ų8134.7 Ų34.742%0.42421%0.211SC..Hα-helixtrans-62.9-43.3172.9-67.2174.9000111.3A32 L33 S34 R38 A39 E40 I57A32-L36 PolarHBondContact O-N 3.11Å; A32-L36 VanDerWaalsContact O-N 3.14Å; L33-L36 PolarHBondContact O-N 2.98Å; S34-L36 VanDerWaalsContact C-N 3.34Å; S34-L36 PolarHBondContact O-N 3.24Å; L36-R38 VanDerWaalsContact C-N 3.34Å; L36-R38 PolarHBondContact O-N 3.46Å; L36-A39 PolarHBondContact O-N 3.08Å; L36-E40 PolarHBondContact O-N 2.94Å; L36-I57 HydrophobicContact CB-CD1 4.46Å; L36-I57 HydrophobicContact CB-CG2 4.29Å; L36-I57 HydrophobicContact CD1-CD1 4.21Å
37I98.2Very high96.1Very high18 Ų1840 Ų409%0.09224%0.239CC..Hα-helixtrans-59.8-45.4175.3-63.4162.4000110.5L33 S34 E40 L41 Y54 I57 V58 H61L33-I37 WeakPolarHBondContact O-CG1 3.37Å; L33-I37 PolarHBondContact O-N 3.04Å; L33-I37 VanDerWaalsContact O-N 3.11Å; S34-I37 WeakPolarHBondContact O-CB 3.41Å; S34-I37 PolarHBondContact O-N 3.02Å; I37-E40 PolarHBondContact O-N 2.82Å; I37-L41 HydrophobicContact CG2-CD1 3.99Å; I37-L41 WeakPolarHBondContact O-CB 3.37Å; I37-L41 WeakPolarHBondContact O-CG 3.42Å; I37-L41 PolarHBondContact O-N 3.26Å; I37-Y54 HydrophobicContact CB-CE2 4.42Å; I37-Y54 HydrophobicContact CG1-CE2 4.5Å; I37-Y54 HydrophobicContact CG2-CE2 3.9Å; I37-I57 HydrophobicContact CD1-CG2 4.12Å; I37-I57 HydrophobicContact CG1-CG2 3.72Å; I37-V58 HydrophobicContact CD1-CB 4.34Å; I37-V58 HydrophobicContact CD1-CG2 3.79Å; I37-V58 HydrophobicContact CG1-CG2 3.88Å; I37-V58 HydrophobicContact CG2-CG2 4.39Å; I37-H61 HydrophobicContact CD1-CB 3.91Å
38R97.5Very high95.9Very high9 Ų942.5 Ų42.53%0.03425%0.251CS..Hα-helixtrans-73.8-28.2-179.7-67.1-48.8-47.5168.511.6113.4S34 L35 L36 G42 N451 S454 S455S34-R38 WeakPolarHBondContact O-CG 3.45Å; S34-R38 PolarHBondContact O-N 3.33Å; L35-R38 PolarHBondContact O-N 3.01Å; L36-R38 VanDerWaalsContact C-N 3.34Å; L36-R38 PolarHBondContact O-N 3.46Å; R38-G42 PolarHBondContact O-N 3.15Å; R38-G42 VanDerWaalsContact O-N 3.1Å; R38-N451 PolarHBondContact NH2-O 2.72Å; R38-N451 PolarHBondContact NH2-OD1 2.93Å; R38-N451 VanDerWaalsContact NH2-OD1 3.11Å; R38-S454 PolarHBondContact NH1-OG 3.3Å; R38-S454 VanDerWaalsContact NH2-CB 3.34Å; R38-S454 PolarHBondContact NH2-OG 3.49Å; R38-S455 PolarHBondContact NE-OG 3.12Å; R38-S455 PolarHBondContact NH2-OG 2.67Å; R38-S455 WeakPolarHBondContact O-CB 3.47Å; R38-S455 PolarHBondContact O-OG 3.1Å
39A96.9Very high95.7Very high32 Ų3241.9 Ų41.926%0.26426%0.259SS..Hα-helixtrans-68.8-44.6172.200000110.7L35 L36 L41 G42 L47L35-A39 VanDerWaalsContact O-CB 3.23Å; L35-A39 WeakPolarHBondContact O-CB 3.42Å; L35-A39 PolarHBondContact O-N 2.9Å; L36-A39 PolarHBondContact O-N 3.08Å; A39-L41 VanDerWaalsContact C-N 3.34Å; A39-L41 PolarHBondContact O-N 3.17Å; A39-G42 PolarHBondContact O-N 2.74Å; A39-G42 VanDerWaalsContact O-N 3.16Å; A39-L47 HydrophobicContact CB-CD2 3.97Å
40E97.3Very high95.5Very high3 Ų343.3 Ų43.31%0.01427%0.267CS..Hα-helixtrans-56-50.9173.7-171.366-163.900110.5L36 I37 G42 N46 L47 L48 Y54L36-E40 PolarHBondContact O-N 2.94Å; I37-E40 PolarHBondContact O-N 2.82Å; E40-G42 PolarHBondContact O-N 3.45Å; E40-G42 VanDerWaalsContact O-N 3.17Å; E40-N46 WeakPolarHBondContact OE1-CA 3.28Å; E40-L47 PolarHBondContact OE1-N 3.05Å; E40-L47 WeakPolarHBondContact OE2-CA 3.28Å; E40-L47 VanDerWaalsContact OE2-CB 3.23Å; E40-L47 WeakPolarHBondContact OE2-CB 3.45Å; E40-L47 PolarHBondContact OE2-N 3.19Å; E40-L48 HydrophobicContact CB-CD1 4.41Å; E40-L48 HydrophobicContact CG-CD1 4.38Å; E40-L48 PolarHBondContact OE1-N 3.21Å; E40-L48 VanDerWaalsContact OE2-CB 3.31Å; E40-L48 WeakPolarHBondContact OE2-CB 3.39Å; E40-L48 WeakPolarHBondContact OE2-CG 3.3Å; E40-L48 PolarHBondContact OE2-N 2.74Å; E40-Y54 HydrophobicContact CB-CD2 4.15Å; E40-Y54 HydrophobicContact CB-CE2 4.29Å; E40-Y54 HydrophobicContact CG-CD2 3.89Å; E40-Y54 HydrophobicContact CG-CE2 4.25Å
41L97.3Very high95.3Very high1 Ų147 Ų471%0.00529%0.286CS..THydrogen-bonded Turntrans-78.84.7-177.8-62.5171.5000114I37 A39 Q43 Y54 Y371 Y443 N451I37-L41 HydrophobicContact CG2-CD1 3.99Å; I37-L41 WeakPolarHBondContact O-CB 3.37Å; I37-L41 WeakPolarHBondContact O-CG 3.42Å; I37-L41 PolarHBondContact O-N 3.26Å; A39-L41 VanDerWaalsContact C-N 3.34Å; A39-L41 PolarHBondContact O-N 3.17Å; L41-Q43 PolarHBondContact O-N 3.37Å; L41-Y54 WeakPolarHBondContact CD1-OH 3.37Å; L41-Y54 HydrophobicContact CG-CE2 4.3Å; L41-Y371 WeakPolarHBondContact CD1-OH 3.46Å; L41-Y443 HydrophobicContact CB-CE1 4.19Å; L41-Y443 HydrophobicContact CD2-CD1 3.91Å; L41-Y443 HydrophobicContact CD2-CE1 4.08Å; L41-Y443 VanDerWaalsContact O-CE1 3.24Å; L41-Y443 WeakPolarHBondContact O-CE1 3.27Å; L41-Y443 PolarHBondContact O-OH 2.84Å; L41-N451 WeakPolarHBondContact O-CB 3.43Å
42G95.2Very high95.3Very high19 Ų1948 Ų4820%0.19629%0.289CS..THydrogen-bonded Turntrans-66.5-26.2-175.100000113.6R38 A39 E40 I452R38-G42 PolarHBondContact O-N 3.15Å; R38-G42 VanDerWaalsContact O-N 3.1Å; A39-G42 PolarHBondContact O-N 2.74Å; A39-G42 VanDerWaalsContact O-N 3.16Å; E40-G42 PolarHBondContact O-N 3.45Å; E40-G42 VanDerWaalsContact O-N 3.17Å; G42-I452 WeakPolarHBondContact O-CG1 3.2Å
43Q93.8Very high95.2Very high130 Ų13049.4 Ų49.461%0.60729%0.289SS*.SBendtrans-151.5158.8176.662-172.6-200109L41 Y443L41-Q43 PolarHBondContact O-N 3.37Å; Q43-Y443 VanDerWaalsContact C-OH 3.28Å; Q43-Y443 VanDerWaalsContact CA-OH 3.28Å; Q43-Y443 WeakPolarHBondContact CA-OH 3.29Å; Q43-Y443 PolarHBondContact N-OH 3.14Å
44P94.1Very high95.2Very high38 Ų3848.3 Ų48.325%0.24728%0.283CS..SBendtrans-59.4148.4170.7-22.432.6000112.5Y443 D445 T448P44-Y443 HydrophobicContact CG-CD2 4.32Å; P44-Y443 HydrophobicContact CG-CE2 3.75Å; P44-D445 WeakPolarHBondContact CB-OD1 3.33Å; P44-D445 VanDerWaalsContact CG-OD1 3.32Å; P44-D445 WeakPolarHBondContact CG-OD1 3.49Å; P44-T448 HydrophobicContact CG-CG2 4.41Å; P44-T448 WeakPolarHBondContact CG-OG1 3.36Å
45G91.8Very high95.2Very high30 Ų3049 Ų4931%0.30928%0.284SS..SBendtrans93.3167.3-176.900000113.9D442G45-D442 PolarHBondContact N-OD1 2.97Å
46N86.4Confident95.3Very high86 Ų8648.3 Ų48.346%0.4628%0.281SS..  trans-90122.3-170-65.8-8.7000112.5E40E40-N46 WeakPolarHBondContact OE1-CA 3.28Å
47L92.6Very high95.3Very high112 Ų11245.4 Ų45.459%0.58627%0.266SS*.SBendtrans-91.9-45.1171.2167.675.1000111.1A39 E40 G49A39-L47 HydrophobicContact CB-CD2 3.97Å; E40-L47 PolarHBondContact OE1-N 3.05Å; E40-L47 WeakPolarHBondContact OE2-CA 3.28Å; E40-L47 VanDerWaalsContact OE2-CB 3.23Å; E40-L47 WeakPolarHBondContact OE2-CB 3.45Å; E40-L47 PolarHBondContact OE2-N 3.19Å; L47-G49 VanDerWaalsContact C-N 3.31Å
48L93.1Very high95.3Very high60 Ų6045.8 Ų45.831%0.31427%0.269SS..SBendtrans-73.9-23.3177.4-73.9170000112.3E40 N50 I57E40-L48 HydrophobicContact CB-CD1 4.41Å; E40-L48 HydrophobicContact CG-CD1 4.38Å; E40-L48 PolarHBondContact OE1-N 3.21Å; E40-L48 VanDerWaalsContact OE2-CB 3.31Å; E40-L48 WeakPolarHBondContact OE2-CB 3.39Å; E40-L48 WeakPolarHBondContact OE2-CG 3.3Å; E40-L48 PolarHBondContact OE2-N 2.74Å; L48-N50 PolarHBondContact O-N 3.31Å; L48-I57 HydrophobicContact CD1-CD1 3.85Å; L48-I57 HydrophobicContact CD2-CD1 4.43Å
49G92.9Very high95.3Very high59 Ų5945.5 Ų45.561%0.60827%0.269SS*.SBendtrans72.14.5178.500000115.2L47L47-G49 VanDerWaalsContact C-N 3.31Å
50N94.4Very high95.4Very high72 Ų7244.4 Ų44.439%0.38526%0.26SS..  trans-149113.4178.2-175-35.2000111.7L48 H52 I53 Y54L48-N50 PolarHBondContact O-N 3.31Å; N50-H52 VanDerWaalsContact C-N 3.3Å; N50-H52 PolarHBondContact O-N 3.3Å; N50-H52 WeakPolarHBondContact OD1-CA 3.34Å; N50-H52 VanDerWaalsContact OD1-CB 3.3Å; N50-H52 WeakPolarHBondContact OD1-CB 3.47Å; N50-H52 PolarHBondContact OD1-N 3.29Å; N50-I53 HydrophobicContact CB-CB 4.2Å; N50-I53 HydrophobicContact CB-CD1 3.88Å; N50-I53 HydrophobicContact CB-CG1 3.99Å; N50-I53 PolarHBondContact O-N 2.97Å; N50-I53 PolarHBondContact OD1-N 3.39Å; N50-Y54 PolarHBondContact O-N 3.42Å
51D94.7Very high95.4Very high77 Ų7745.4 Ų45.441%0.41226%0.264SS..Hα-helixtrans-65.3-31-177.7-57.6-23.9000113.3Y54 N55 S441D51-Y54 WeakPolarHBondContact O-CB 3.28Å; D51-Y54 PolarHBondContact O-N 3.44Å; D51-N55 PolarHBondContact O-N 2.9Å; D51-N55 VanDerWaalsContact O-N 3.1Å; D51-N55 PolarHBondContact O-ND2 3.32Å; D51-S441 WeakPolarHBondContact OD1-CB 3.27Å; D51-S441 PolarHBondContact OD1-OG 3.1Å
52H96Very high95.5Very high55 Ų5546.3 Ų46.326%0.25527%0.271SS..Hα-helixtrans-68-42.7177-174.769000111N50 Y54 N55 V56 A120 G121 H138N50-H52 VanDerWaalsContact C-N 3.3Å; N50-H52 PolarHBondContact O-N 3.3Å; N50-H52 WeakPolarHBondContact OD1-CA 3.34Å; N50-H52 VanDerWaalsContact OD1-CB 3.3Å; N50-H52 WeakPolarHBondContact OD1-CB 3.47Å; N50-H52 PolarHBondContact OD1-N 3.29Å; H52-Y54 VanDerWaalsContact C-N 3.27Å; H52-Y54 PolarHBondContact O-N 3.25Å; H52-N55 PolarHBondContact O-N 3.24Å; H52-V56 WeakPolarHBondContact O-CG2 3.44Å; H52-V56 PolarHBondContact O-N 2.99Å; H52-A120 PolarHBondContact CD2-O 3.17Å; H52-A120 PolarHBondContact NE2-O 2.92Å; H52-G121 PolarHBondContact NE2-O 3.37Å; H52-G121 VanDerWaalsContact NE2-O 3.15Å; H52-H138 AromaticContact CE1-CD2 3.96Å; H52-H138 AromaticContact CE1-NE2 3.48Å; H52-H138 PolarHBondContact CE1-NE2 3.42Å
53I96.7Very high95.6Very high77 Ų7745.5 Ų45.540%0.39526%0.262SS..Hα-helixtrans-59.7-41.3175.2-66.2179.8000110.4N50 N55 V56 I57N50-I53 HydrophobicContact CB-CB 4.2Å; N50-I53 HydrophobicContact CB-CD1 3.88Å; N50-I53 HydrophobicContact CB-CG1 3.99Å; N50-I53 PolarHBondContact O-N 2.97Å; N50-I53 PolarHBondContact OD1-N 3.39Å; I53-N55 VanDerWaalsContact C-N 3.33Å; I53-N55 PolarHBondContact O-N 3.15Å; I53-V56 PolarHBondContact O-N 3.27Å; 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 3.41Å; I53-I57 PolarHBondContact O-N 2.82Å
54Y97.6Very high95.8Very high4 Ų439.3 Ų39.32%0.01623%0.234CC..Hα-helixtrans-56.6-46.7173.5171.3-94.6000111.7I37 E40 L41 N50 D51 H52 V56 I57 V58 Y440I37-Y54 HydrophobicContact CB-CE2 4.42Å; I37-Y54 HydrophobicContact CG1-CE2 4.5Å; I37-Y54 HydrophobicContact CG2-CE2 3.9Å; E40-Y54 HydrophobicContact CB-CD2 4.15Å; E40-Y54 HydrophobicContact CB-CE2 4.29Å; E40-Y54 HydrophobicContact CG-CD2 3.89Å; E40-Y54 HydrophobicContact CG-CE2 4.25Å; L41-Y54 WeakPolarHBondContact CD1-OH 3.37Å; L41-Y54 HydrophobicContact CG-CE2 4.3Å; N50-Y54 PolarHBondContact O-N 3.42Å; D51-Y54 WeakPolarHBondContact O-CB 3.28Å; D51-Y54 PolarHBondContact O-N 3.44Å; H52-Y54 VanDerWaalsContact C-N 3.27Å; H52-Y54 PolarHBondContact O-N 3.25Å; Y54-V56 PolarHBondContact O-N 3.39Å; Y54-I57 PolarHBondContact O-N 3Å; Y54-V58 HydrophobicContact CD1-CG2 4.14Å; Y54-V58 HydrophobicContact CD2-CG2 4.45Å; Y54-V58 HydrophobicContact CE1-CG2 3.76Å; Y54-V58 HydrophobicContact CE2-CG2 4.1Å; Y54-V58 HydrophobicContact CG-CG2 4.48Å; Y54-V58 VanDerWaalsContact O-CG2 3.31Å; Y54-V58 WeakPolarHBondContact O-CG2 3.38Å; Y54-V58 PolarHBondContact O-N 3.48Å; Y54-Y440 VanDerWaalsContact CE1-C 3.42Å; Y54-Y440 VanDerWaalsContact CE1-O 3.23Å; Y54-Y440 WeakPolarHBondContact CE1-O 3.46Å; Y54-Y440 VanDerWaalsContact CZ-O 3.22Å; Y54-Y440 PolarHBondContact OH-O 3.5Å
55N97.9Very high96Very high40 Ų4038.9 Ų38.921%0.21423%0.229CC..Hα-helixtrans-65.8-34.6177.7-76-44.7000113.5D51 H52 I53 V58 T59 R439D51-N55 PolarHBondContact O-N 2.9Å; D51-N55 VanDerWaalsContact O-N 3.1Å; D51-N55 PolarHBondContact O-ND2 3.32Å; H52-N55 PolarHBondContact O-N 3.24Å; I53-N55 VanDerWaalsContact C-N 3.33Å; I53-N55 PolarHBondContact O-N 3.15Å; N55-V58 PolarHBondContact O-N 3.41Å; N55-T59 VanDerWaalsContact O-CB 3.31Å; N55-T59 WeakPolarHBondContact O-CB 3.35Å; N55-T59 PolarHBondContact O-N 2.98Å; N55-T59 PolarHBondContact O-OG1 3.48Å; N55-R439 PolarHBondContact OD1-O 3.41Å
56V98.3Very high96.2Very high12 Ų1237.7 Ų37.77%0.07322%0.215CC..Hα-helixtrans-63.2-45.2171.9174.80000110.5H52 I53 Y54 T59 A60 A116 A120H52-V56 WeakPolarHBondContact O-CG2 3.44Å; H52-V56 PolarHBondContact O-N 2.99Å; I53-V56 PolarHBondContact O-N 3.27Å; Y54-V56 PolarHBondContact O-N 3.39Å; V56-T59 PolarHBondContact O-N 3.36Å; V56-A60 WeakPolarHBondContact O-CB 3.47Å; V56-A60 PolarHBondContact O-N 3.22Å; V56-A116 HydrophobicContact CG1-CB 3.85Å; V56-A120 WeakPolarHBondContact CG2-O 3.31Å
57I98.4Very high96.8Very high19 Ų1934.1 Ų34.110%0.09720%0.196CC..Hα-helixtrans-62.9-45177.3-67.1167.9000110.8L33 L36 I37 L48 I53 Y54 T59 A60 H61L33-I57 HydrophobicContact CB-CG2 4.06Å; L33-I57 HydrophobicContact CD2-CG2 4.01Å; L36-I57 HydrophobicContact CB-CD1 4.46Å; L36-I57 HydrophobicContact CB-CG2 4.29Å; L36-I57 HydrophobicContact CD1-CD1 4.21Å; I37-I57 HydrophobicContact CD1-CG2 4.12Å; I37-I57 HydrophobicContact CG1-CG2 3.72Å; L48-I57 HydrophobicContact CD1-CD1 3.85Å; L48-I57 HydrophobicContact CD2-CD1 4.43Å; 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 3.41Å; I53-I57 PolarHBondContact O-N 2.82Å; Y54-I57 PolarHBondContact O-N 3Å; I57-T59 VanDerWaalsContact C-N 3.32Å; I57-T59 PolarHBondContact O-N 3.01Å; I57-A60 PolarHBondContact O-N 3.26Å; I57-H61 VanDerWaalsContact O-CB 3.28Å; I57-H61 WeakPolarHBondContact O-CB 3.44Å; I57-H61 PolarHBondContact O-N 2.8Å
58V98.4Very high97.1Very high26 Ų2628.8 Ų28.816%0.15817%0.168CC..Hα-helixtrans-59.7-43.6176.2171.20000111.2I37 Y54 N55 A62 R439I37-V58 HydrophobicContact CD1-CB 4.34Å; I37-V58 HydrophobicContact CD1-CG2 3.79Å; I37-V58 HydrophobicContact CG1-CG2 3.88Å; I37-V58 HydrophobicContact CG2-CG2 4.39Å; Y54-V58 HydrophobicContact CD1-CG2 4.14Å; Y54-V58 HydrophobicContact CD2-CG2 4.45Å; Y54-V58 HydrophobicContact CE1-CG2 3.76Å; Y54-V58 HydrophobicContact CE2-CG2 4.1Å; Y54-V58 HydrophobicContact CG-CG2 4.48Å; Y54-V58 VanDerWaalsContact O-CG2 3.31Å; Y54-V58 WeakPolarHBondContact O-CG2 3.38Å; Y54-V58 PolarHBondContact O-N 3.48Å; N55-V58 PolarHBondContact O-N 3.41Å; V58-A62 PolarHBondContact O-N 3.08Å; V58-R439 HydrophobicContact CG1-CG 4.49Å
59T98.3Very high97.3Very high4 Ų426.7 Ų26.73%0.02516%0.156CC..Hα-helixtrans-65.1-48.6178.8-57.50000111.1N55 V56 I57 A62 F63 A122 G125N55-T59 VanDerWaalsContact O-CB 3.31Å; N55-T59 WeakPolarHBondContact O-CB 3.35Å; N55-T59 PolarHBondContact O-N 2.98Å; N55-T59 PolarHBondContact O-OG1 3.48Å; V56-T59 PolarHBondContact O-N 3.36Å; I57-T59 VanDerWaalsContact C-N 3.32Å; I57-T59 PolarHBondContact O-N 3.01Å; T59-A62 PolarHBondContact O-N 3.21Å; T59-F63 HydrophobicContact CG2-CD2 3.77Å; T59-F63 HydrophobicContact CG2-CE2 3.53Å; T59-F63 VanDerWaalsContact O-CD2 3.31Å; T59-F63 WeakPolarHBondContact O-CD2 3.14Å; T59-F63 PolarHBondContact O-N 2.64Å; T59-F63 VanDerWaalsContact O-N 3.13Å; T59-A122 WeakPolarHBondContact CB-O 3.33Å; T59-A122 WeakPolarHBondContact CG2-O 3.48Å; T59-A122 PolarHBondContact OG1-O 3.03Å; T59-G125 WeakPolarHBondContact OG1-CA 3.44Å; T59-G125 PolarHBondContact OG1-N 2.76Å
60A98.4Very high97.5Very high9 Ų924 Ų247%0.07413%0.128CC..Hα-helixtrans-63-43.5178.200000112L33 V56 I57 A62 F63 V64L33-A60 HydrophobicContact CD1-CB 3.86Å; V56-A60 WeakPolarHBondContact O-CB 3.47Å; V56-A60 PolarHBondContact O-N 3.22Å; I57-A60 PolarHBondContact O-N 3.26Å; A60-A62 VanDerWaalsContact C-N 3.35Å; A60-A62 PolarHBondContact O-N 3.38Å; A60-F63 PolarHBondContact O-N 3.13Å; A60-V64 VanDerWaalsContact O-CB 3.32Å; A60-V64 WeakPolarHBondContact O-CB 3.46Å; A60-V64 WeakPolarHBondContact O-CG2 3.06Å; A60-V64 PolarHBondContact O-N 2.72Å
61H98.3Very high97.6Very high24 Ų2421.1 Ų21.111%0.11111%0.113CC..Hα-helixtrans-54.5-51.3176.516969.6000111.1G30 L33 S34 I37 I57 F63 V64 M65G30-H61 PolarHBondContact O-ND1 2.72Å; L33-H61 HydrophobicContact CB-CB 3.86Å; L33-H61 HydrophobicContact CD1-CB 4.45Å; S34-H61 VanDerWaalsContact CB-CE1 3.47Å; S34-H61 WeakPolarHBondContact CB-CE1 3.48Å; I37-H61 HydrophobicContact CD1-CB 3.91Å; I57-H61 VanDerWaalsContact O-CB 3.28Å; I57-H61 WeakPolarHBondContact O-CB 3.44Å; I57-H61 PolarHBondContact O-N 2.8Å; H61-F63 PolarHBondContact O-N 3.09Å; H61-V64 PolarHBondContact O-N 3.4Å; H61-M65 VanDerWaalsContact CE1-CG 3.44Å; H61-M65 WeakPolarHBondContact CE1-CG 3.42Å; H61-M65 WeakPolarHBondContact O-CB 3.43Å; H61-M65 WeakPolarHBondContact O-CG 3.44Å; H61-M65 PolarHBondContact O-N 3.29Å
62A97.7Very high97.8Very high19 Ų1917.7 Ų17.716%0.15710%0.095CC..Hα-helixtrans-61.6-46.8-178.800000112.1V58 T59 A60 M65 I66 W126V58-A62 PolarHBondContact O-N 3.08Å; T59-A62 PolarHBondContact O-N 3.21Å; A60-A62 VanDerWaalsContact C-N 3.35Å; A60-A62 PolarHBondContact O-N 3.38Å; A62-M65 PolarHBondContact O-N 3.24Å; A62-I66 WeakPolarHBondContact O-CB 3.28Å; A62-I66 WeakPolarHBondContact O-CG1 3.34Å; A62-I66 PolarHBondContact O-N 2.89Å; A62-W126 HydrophobicContact CB-CB 3.58Å; A62-W126 HydrophobicContact CB-CG 3.99Å
63F98.3Very high97.9Very high2 Ų215.7 Ų15.71%0.0099%0.085CC..Hα-helixtrans-64.4-45.1178.2-75.7-51.4000112.8T59 A60 H61 M65 I66 F67 F68 L112 W126 V128 T146 L150T59-F63 HydrophobicContact CG2-CD2 3.77Å; T59-F63 HydrophobicContact CG2-CE2 3.53Å; T59-F63 VanDerWaalsContact O-CD2 3.31Å; T59-F63 WeakPolarHBondContact O-CD2 3.14Å; T59-F63 PolarHBondContact O-N 2.64Å; T59-F63 VanDerWaalsContact O-N 3.13Å; A60-F63 PolarHBondContact O-N 3.13Å; H61-F63 PolarHBondContact O-N 3.09Å; F63-M65 PolarHBondContact O-N 3.37Å; F63-I66 PolarHBondContact O-N 3.47Å; F63-F67 AromaticContact CD1-CD2 3.74Å; F63-F67 HydrophobicContact CD1-CD2 3.74Å; F63-F67 AromaticContact CD1-CE2 3.67Å; F63-F67 HydrophobicContact CD1-CE2 3.67Å; F63-F67 HydrophobicContact CE1-CE2 4.03Å; F63-F67 PolarHBondContact O-N 2.83Å; F63-F68 WeakPolarHBondContact O-CD2 3.31Å; F63-L112 HydrophobicContact CB-CD1 4.04Å; F63-L112 HydrophobicContact CB-CD2 3.63Å; F63-L112 HydrophobicContact CD2-CD1 3.91Å; F63-L112 HydrophobicContact CG-CD1 4.24Å; F63-W126 HydrophobicContact CD1-CB 4.44Å; F63-W126 HydrophobicContact CE1-CB 4.15Å; F63-W126 WeakPolarHBondContact CE1-O 3.33Å; F63-W126 HydrophobicContact CE2-CB 4.43Å; F63-W126 HydrophobicContact CZ-CB 4.16Å; F63-W126 WeakPolarHBondContact CZ-O 3.2Å; F63-V128 HydrophobicContact CE2-CG2 4.18Å; F63-V128 HydrophobicContact CZ-CG2 3.63Å; F63-T146 HydrophobicContact CD2-CG2 4.2Å; F63-T146 HydrophobicContact CE2-CG2 3.62Å; F63-T146 HydrophobicContact CZ-CG2 4.13Å; F63-L150 HydrophobicContact CD1-CD2 3.76Å; F63-L150 HydrophobicContact CE1-CD1 3.74Å; F63-L150 HydrophobicContact CE1-CD2 3.72Å; F63-L150 HydrophobicContact CE1-CG 4.26Å; F63-L150 HydrophobicContact CZ-CD1 3.88Å
64V98.6Very high98Very high0 Ų012.1 Ų12.10%07%0.067CC..Iπ-helixtrans-59.4-48177.9171.90000110.8A26 L33 A60 H61 F68 M69 L109 L112A26-V64 HydrophobicContact CB-CG1 4.28Å; A26-V64 WeakPolarHBondContact O-CG1 3.33Å; L33-V64 HydrophobicContact CD1-CG2 4.43Å; A60-V64 VanDerWaalsContact O-CB 3.32Å; A60-V64 WeakPolarHBondContact O-CB 3.46Å; A60-V64 WeakPolarHBondContact O-CG2 3.06Å; A60-V64 PolarHBondContact O-N 2.72Å; H61-V64 PolarHBondContact O-N 3.4Å; V64-F68 CarbonylContact O-C 3.6Å; V64-F68 WeakPolarHBondContact O-CA 3.46Å; V64-F68 WeakPolarHBondContact O-CB 3.25Å; V64-F68 PolarHBondContact O-N 2.91Å; V64-F68 VanDerWaalsContact O-N 3.09Å; V64-M69 PolarHBondContact O-N 2.9Å; V64-L109 HydrophobicContact CG2-CD1 4.22Å; V64-L112 HydrophobicContact CG2-CD2 3.77Å
65M98.1Very high97.9Very high29 Ų2912.9 Ų12.914%0.1437%0.071CC..Iπ-helixtrans-66.3-43.2-178.1-67-61.9-72.300112.3H61 A62 F63 M69 V70H61-M65 VanDerWaalsContact CE1-CG 3.44Å; H61-M65 WeakPolarHBondContact CE1-CG 3.42Å; H61-M65 WeakPolarHBondContact O-CB 3.43Å; H61-M65 WeakPolarHBondContact O-CG 3.44Å; H61-M65 PolarHBondContact O-N 3.29Å; A62-M65 PolarHBondContact O-N 3.24Å; F63-M65 PolarHBondContact O-N 3.37Å; M65-M69 HydrophobicContact CE-CE 4.46Å; M65-M69 HydrophobicContact CE-SD 3.39Å; M65-M69 WeakPolarHBondContact CE-SD 3.38Å; M65-M69 WeakPolarHBondContact O-CB 3.34Å; M65-M69 HydrophobicContact SD-SD 3.72Å; M65-V70 WeakPolarHBondContact O-CB 3.33Å; M65-V70 VanDerWaalsContact O-CG2 3.24Å; M65-V70 WeakPolarHBondContact O-CG2 3.42Å; M65-V70 PolarHBondContact O-N 3.01Å
66I96.1Very high97.9Very high6 Ų611.1 Ų11.13%0.0316%0.063CC..Iπ-helixtrans-75.8-58.9-176.5-66.5169.8000111.1A62 F63 M71 W126 L246 L381A62-I66 WeakPolarHBondContact O-CB 3.28Å; A62-I66 WeakPolarHBondContact O-CG1 3.34Å; A62-I66 PolarHBondContact O-N 2.89Å; F63-I66 PolarHBondContact O-N 3.47Å; I66-M71 HydrophobicContact CG2-CE 3.84Å; I66-M71 PolarHBondContact O-N 3.44Å; I66-M71 VanDerWaalsContact O-N 3.17Å; I66-W126 HydrophobicContact CD1-CD2 4.49Å; I66-W126 HydrophobicContact CD1-CE3 4.16Å; I66-W126 HydrophobicContact CD1-CZ3 4.23Å; I66-L246 HydrophobicContact CG1-CD1 4.41Å; I66-L246 HydrophobicContact CG2-CD1 3.88Å; I66-L246 HydrophobicContact CG2-CD2 4.19Å; I66-L381 HydrophobicContact CG1-CD2 4.1Å
67F97.7Very high97.9Very high11 Ų1110.6 Ų10.65%0.0486%0.06CC..Iπ-helixtrans-88-22.3-168.5-64-88.8000114.5F63 M71 P72 L150 F238F63-F67 AromaticContact CD1-CD2 3.74Å; F63-F67 HydrophobicContact CD1-CD2 3.74Å; F63-F67 AromaticContact CD1-CE2 3.67Å; F63-F67 HydrophobicContact CD1-CE2 3.67Å; F63-F67 HydrophobicContact CE1-CE2 4.03Å; F63-F67 PolarHBondContact O-N 2.83Å; F67-M71 HydrophobicContact CB-CE 4.23Å; F67-M71 HydrophobicContact CD1-CE 3.13Å; F67-M71 HydrophobicContact CD1-SD 4.47Å; F67-M71 HydrophobicContact CE1-CE 3.46Å; F67-M71 VanDerWaalsContact CE1-CE 3.46Å; F67-M71 HydrophobicContact CG-CE 3.74Å; F67-M71 HydrophobicContact CZ-CE 4.32Å; F67-P72 VanDerWaalsContact O-CD 3.23Å; F67-P72 WeakPolarHBondContact O-CD 3.29Å; F67-P72 WeakPolarHBondContact O-CG 3.47Å; F67-L150 HydrophobicContact CD1-CD2 4.44Å; F67-L150 HydrophobicContact CD2-CD2 4.05Å; F67-L150 HydrophobicContact CE1-CD2 4.42Å; F67-L150 HydrophobicContact CE2-CD2 4Å; F67-L150 HydrophobicContact CG-CD2 4.29Å; F67-L150 HydrophobicContact CZ-CD2 4.2Å; F67-F238 HydrophobicContact CE1-CZ 4.06Å; F67-F238 HydrophobicContact CZ-CE1 4.25Å; F67-F238 AromaticContact CZ-CZ 3.94Å; F67-F238 HydrophobicContact CZ-CZ 3.94Å
68F98.6Very high97.9Very high0 Ų09.7 Ų9.70%06%0.055CC..Iπ-helixtrans-116.2-18.6-173.1-59.3-78.9000114.1F22 G23 A26 F63 V64 P72 S108 L109 L112 A153F22-F68 HydrophobicContact CE1-CB 4.15Å; F22-F68 AromaticContact CE1-CD1 3.94Å; F22-F68 HydrophobicContact CE1-CD1 3.94Å; F22-F68 HydrophobicContact CZ-CB 4.47Å; F22-F68 AromaticContact CZ-CD1 3.79Å; F22-F68 HydrophobicContact CZ-CD1 3.79Å; G23-F68 WeakPolarHBondContact CA-O 3.24Å; A26-F68 HydrophobicContact CB-CB 3.86Å; A26-F68 VanDerWaalsContact CB-O 3.28Å; A26-F68 WeakPolarHBondContact CB-O 3.46Å; F63-F68 WeakPolarHBondContact O-CD2 3.31Å; V64-F68 CarbonylContact O-C 3.6Å; V64-F68 WeakPolarHBondContact O-CA 3.46Å; V64-F68 WeakPolarHBondContact O-CB 3.25Å; V64-F68 PolarHBondContact O-N 2.91Å; V64-F68 VanDerWaalsContact O-N 3.09Å; F68-P72 WeakPolarHBondContact O-CG 3.37Å; F68-S108 VanDerWaalsContact CE1-OG 3.29Å; F68-S108 WeakPolarHBondContact CE1-OG 3.45Å; F68-S108 WeakPolarHBondContact CZ-OG 3.33Å; F68-L109 HydrophobicContact CB-CD1 4.24Å; F68-L109 HydrophobicContact CD1-CB 3.73Å; F68-L109 HydrophobicContact CD1-CD1 4.11Å; F68-L109 HydrophobicContact CD1-CG 4.34Å; F68-L109 HydrophobicContact CD2-CD1 4.07Å; F68-L109 HydrophobicContact CE1-CB 3.72Å; F68-L109 HydrophobicContact CE1-CD1 4.47Å; F68-L109 HydrophobicContact CE2-CD1 4.46Å; F68-L109 HydrophobicContact CG-CB 4.36Å; F68-L109 HydrophobicContact CG-CD1 3.85Å; F68-L109 HydrophobicContact CZ-CB 4.38Å; F68-L112 HydrophobicContact CD2-CD2 3.97Å; F68-L112 HydrophobicContact CE2-CB 4.47Å; F68-L112 HydrophobicContact CE2-CD2 3.62Å; F68-A153 HydrophobicContact CZ-CB 4.43Å
69M97.9Very high97.9Very high15 Ų158.5 Ų8.57%0.0745%0.048CC..Iπ-helixtrans-105-69.3171.3179.4-159.417100111.7V64 M65 P72 I73 V386V64-M69 PolarHBondContact O-N 2.9Å; M65-M69 HydrophobicContact CE-CE 4.46Å; M65-M69 HydrophobicContact CE-SD 3.39Å; M65-M69 WeakPolarHBondContact CE-SD 3.38Å; M65-M69 WeakPolarHBondContact O-CB 3.34Å; M65-M69 HydrophobicContact SD-SD 3.72Å; M69-P72 WeakPolarHBondContact O-CD 3.22Å; M69-I73 HydrophobicContact CE-CD1 4.39Å; M69-I73 HydrophobicContact CG-CD1 3.83Å; M69-I73 WeakPolarHBondContact O-CB 3.2Å; M69-I73 VanDerWaalsContact O-CG1 3.24Å; M69-I73 WeakPolarHBondContact O-CG1 3.31Å; M69-I73 PolarHBondContact O-N 3.39Å; M69-V386 HydrophobicContact CE-CG2 4.23Å
70V97.9Very high97.9Very high3 Ų38.3 Ų8.32%0.0185%0.047CC..Iπ-helixtrans-65.3-52.4-165.9174.10000111.8M65 I73 M74 L246 A385M65-V70 WeakPolarHBondContact O-CB 3.33Å; M65-V70 VanDerWaalsContact O-CG2 3.24Å; M65-V70 WeakPolarHBondContact O-CG2 3.42Å; M65-V70 PolarHBondContact O-N 3.01Å; V70-I73 PolarHBondContact O-N 2.96Å; V70-M74 HydrophobicContact CG1-CE 3.3Å; V70-M74 WeakPolarHBondContact O-CB 3.43Å; V70-M74 PolarHBondContact O-N 3.41Å; V70-L246 HydrophobicContact CB-CD2 4.12Å; V70-L246 HydrophobicContact CG1-CB 4.29Å; V70-L246 HydrophobicContact CG1-CD2 3.6Å; V70-L246 HydrophobicContact CG1-CG 4.49Å; V70-A385 HydrophobicContact CG1-CB 3.84Å; V70-A385 HydrophobicContact CG2-CB 4.37Å
71M96.8Very high97.9Very high12 Ų128.6 Ų8.66%0.0595%0.046CC..Hα-helixtrans-59.3-52.2177.4-93.7-168.7-94.600112.7I66 F67 I73 M74 I75 G76 L195 E242 I245 L246I66-M71 HydrophobicContact CG2-CE 3.84Å; I66-M71 PolarHBondContact O-N 3.44Å; I66-M71 VanDerWaalsContact O-N 3.17Å; F67-M71 HydrophobicContact CB-CE 4.23Å; F67-M71 HydrophobicContact CD1-CE 3.13Å; F67-M71 HydrophobicContact CD1-SD 4.47Å; F67-M71 HydrophobicContact CE1-CE 3.46Å; F67-M71 VanDerWaalsContact CE1-CE 3.46Å; F67-M71 HydrophobicContact CG-CE 3.74Å; F67-M71 HydrophobicContact CZ-CE 4.32Å; M71-I73 VanDerWaalsContact C-N 3.34Å; M71-I73 PolarHBondContact O-N 3.27Å; M71-M74 PolarHBondContact O-N 2.93Å; M71-I75 PolarHBondContact O-N 3.39Å; M71-G76 PolarHBondContact O-N 3.35Å; M71-L195 HydrophobicContact SD-CD2 4.42Å; M71-E242 WeakPolarHBondContact CE-OE1 3.46Å; M71-I245 HydrophobicContact CG-CG2 4.47Å; M71-L246 HydrophobicContact CG-CD2 3.71Å
72P98.4Very high97.9Very high5 Ų57.4 Ų7.43%0.0324%0.04CC..Iπ-helixtrans-57.7-40.9177.2-3442.6000113.7Y19 F22 F67 F68 M69 G76 G77 L105Y19-P72 HydrophobicContact CD1-CB 4.02Å; F22-P72 HydrophobicContact CD1-CB 4.19Å; F22-P72 HydrophobicContact CD1-CG 4.34Å; F22-P72 HydrophobicContact CE1-CG 4.28Å; F67-P72 VanDerWaalsContact O-CD 3.23Å; F67-P72 WeakPolarHBondContact O-CD 3.29Å; F67-P72 WeakPolarHBondContact O-CG 3.47Å; F68-P72 WeakPolarHBondContact O-CG 3.37Å; M69-P72 WeakPolarHBondContact O-CD 3.22Å; P72-G76 CarbonylContact O-C 3.57Å; P72-G76 VanDerWaalsContact O-C 3.29Å; P72-G76 WeakPolarHBondContact O-CA 3.24Å; P72-G76 PolarHBondContact O-N 3Å; P72-G76 VanDerWaalsContact O-N 3.13Å; P72-G77 PolarHBondContact O-N 3.42Å; P72-L105 HydrophobicContact CB-CD1 4.13Å; P72-L105 HydrophobicContact CG-CD1 3.75Å
73I98.6Very high97.9Very high12 Ų126.5 Ų6.56%0.0623%0.033CC..Iπ-helixtrans-70.5-49.8-179.9-68172.9000111.2L20 M69 V70 M71 G77 F78 I389L20-I73 HydrophobicContact CD2-CG2 3.96Å; M69-I73 HydrophobicContact CE-CD1 4.39Å; M69-I73 HydrophobicContact CG-CD1 3.83Å; M69-I73 WeakPolarHBondContact O-CB 3.2Å; M69-I73 VanDerWaalsContact O-CG1 3.24Å; M69-I73 WeakPolarHBondContact O-CG1 3.31Å; M69-I73 PolarHBondContact O-N 3.39Å; V70-I73 PolarHBondContact O-N 2.96Å; M71-I73 VanDerWaalsContact C-N 3.34Å; M71-I73 PolarHBondContact O-N 3.27Å; I73-G77 CarbonylContact O-C 3.6Å; I73-G77 VanDerWaalsContact O-CA 3.29Å; I73-G77 WeakPolarHBondContact O-CA 3.08Å; I73-G77 PolarHBondContact O-N 2.88Å; I73-F78 HydrophobicContact CG2-CD2 4Å; I73-F78 HydrophobicContact CG2-CE2 3.76Å; I73-F78 WeakPolarHBondContact O-CD2 3.47Å; I73-F78 PolarHBondContact O-N 3.48Å; I73-I389 HydrophobicContact CB-CD1 4.17Å; I73-I389 HydrophobicContact CG2-CB 4.37Å; I73-I389 HydrophobicContact CG2-CD1 3.91Å; I73-I389 HydrophobicContact CG2-CG1 3.81Å; I73-I389 HydrophobicContact CG2-CG2 3.69Å
74M97.1Very high97.9Very high3 Ų36.4 Ų6.42%0.0153%0.033CC..Iπ-helixtrans-74.7-49.6-172.3-78.4-153.8-104.300113.7V70 M71 G79 L246 P249 M253 A385 I389V70-M74 HydrophobicContact CG1-CE 3.3Å; V70-M74 WeakPolarHBondContact O-CB 3.43Å; V70-M74 PolarHBondContact O-N 3.41Å; M71-M74 PolarHBondContact O-N 2.93Å; M74-G79 PolarHBondContact O-N 3.48Å; M74-L246 WeakPolarHBondContact CE-O 3.38Å; M74-P249 HydrophobicContact CB-CB 4.15Å; M74-P249 HydrophobicContact CB-CG 4.49Å; M74-P249 HydrophobicContact SD-CB 4.09Å; M74-M253 HydrophobicContact CG-CE 3.83Å; M74-M253 HydrophobicContact SD-CE 3.59Å; M74-M253 VanDerWaalsContact SD-CE 3.59Å; M74-A385 HydrophobicContact CE-CB 3.3Å; M74-I389 HydrophobicContact CE-CD1 4.11Å; M74-I389 HydrophobicContact CE-CG1 4.28Å; M74-I389 HydrophobicContact CG-CD1 3.95Å; M74-I389 HydrophobicContact CG-CG1 3.64Å; M74-I389 HydrophobicContact SD-CG1 4.27Å
75I96.5Very high97.7Very high19 Ų196.5 Ų6.510%0.0973%0.033CC..Iπ-helixtrans-89.2-49.8-178.2-66.5-61.7000110.2M71 G79 F164 V188 T191 P249M71-I75 PolarHBondContact O-N 3.39Å; I75-G79 WeakPolarHBondContact O-CA 3.21Å; I75-G79 PolarHBondContact O-N 3.05Å; I75-F164 HydrophobicContact CG2-CD2 4.11Å; I75-F164 HydrophobicContact CG2-CE2 3.6Å; I75-F164 HydrophobicContact CG2-CZ 4.44Å; I75-F164 VanDerWaalsContact O-CZ 3.29Å; I75-F164 WeakPolarHBondContact O-CZ 3.5Å; I75-V188 HydrophobicContact CD1-CG1 4.37Å; I75-V188 HydrophobicContact CD1-CG2 4.37Å; I75-T191 HydrophobicContact CD1-CG2 3.45Å; I75-T191 VanDerWaalsContact CD1-CG2 3.45Å; I75-T191 HydrophobicContact CG1-CG2 3.82Å; I75-P249 HydrophobicContact CD1-CB 4.3Å; I75-P249 HydrophobicContact CD1-CG 3.43Å; I75-P249 VanDerWaalsContact CD1-CG 3.43Å; I75-P249 HydrophobicContact CG1-CG 4.16Å
76G97.4Very high97.6Very high4 Ų45.2 Ų5.24%0.0413%0.026CC..Iπ-helixtrans-67-48-179.700000113.1Y19 M71 P72 N80Y19-G76 VanDerWaalsContact CD2-O 3.31Å; Y19-G76 WeakPolarHBondContact CD2-O 3.32Å; Y19-G76 VanDerWaalsContact CG-C 3.43Å; Y19-G76 VanDerWaalsContact CG-CA 3.44Å; M71-G76 PolarHBondContact O-N 3.35Å; P72-G76 CarbonylContact O-C 3.57Å; P72-G76 VanDerWaalsContact O-C 3.29Å; P72-G76 WeakPolarHBondContact O-CA 3.24Å; P72-G76 PolarHBondContact O-N 3Å; P72-G76 VanDerWaalsContact O-N 3.13Å; G76-N80 WeakPolarHBondContact O-CB 3.36Å; G76-N80 PolarHBondContact O-ND2 3.32Å
77G98.4Very high97.5Very high0 Ų04.9 Ų4.90%03%0.025CC..Iπ-helixtrans-81-71.8-173.600000112.4G16 P72 I73 G79 N80 W81G16-G77 WeakPolarHBondContact O-CA 3.44Å; P72-G77 PolarHBondContact O-N 3.42Å; I73-G77 CarbonylContact O-C 3.6Å; I73-G77 VanDerWaalsContact O-CA 3.29Å; I73-G77 WeakPolarHBondContact O-CA 3.08Å; I73-G77 PolarHBondContact O-N 2.88Å; G77-G79 PolarHBondContact O-N 3.25Å; G77-N80 PolarHBondContact O-N 3.05Å; G77-W81 WeakPolarHBondContact O-CB 3.38Å; G77-W81 PolarHBondContact O-N 3.41Å
78F98.8Very high97.4Very high1 Ų14.6 Ų4.60%0.0043%0.025CC..Iπ-helixtrans-62.7-41.1-180-72.8-73.1000112.2L20 I73 W81 L82 F184 M253 I389 F393 W396 F400L20-F78 HydrophobicContact CD2-CD2 4.5Å; L20-F78 HydrophobicContact CD2-CE2 4.42Å; I73-F78 HydrophobicContact CG2-CD2 4Å; I73-F78 HydrophobicContact CG2-CE2 3.76Å; I73-F78 WeakPolarHBondContact O-CD2 3.47Å; I73-F78 PolarHBondContact O-N 3.48Å; F78-W81 PolarHBondContact O-N 2.73Å; F78-L82 HydrophobicContact CB-CD1 4.27Å; F78-L82 HydrophobicContact CD1-CD1 3.9Å; F78-L82 VanDerWaalsContact O-CB 3.24Å; F78-L82 WeakPolarHBondContact O-CB 3.4Å; F78-L82 WeakPolarHBondContact O-CG 3.21Å; F78-L82 PolarHBondContact O-N 3.47Å; F78-F184 HydrophobicContact CB-CE2 4.36Å; F78-F184 HydrophobicContact CB-CZ 3.78Å; F78-M253 HydrophobicContact CB-SD 4.42Å; F78-M253 HydrophobicContact CD1-SD 4.15Å; F78-M253 HydrophobicContact CD2-CE 4.42Å; F78-M253 HydrophobicContact CD2-SD 3.7Å; F78-M253 HydrophobicContact CE1-SD 4.36Å; F78-M253 HydrophobicContact CE2-SD 3.92Å; F78-M253 HydrophobicContact CG-SD 3.84Å; F78-M253 HydrophobicContact CZ-SD 4.25Å; F78-I389 HydrophobicContact CE2-CG2 4.44Å; F78-F393 HydrophobicContact CZ-CB 4.28Å; F78-W396 AromaticContact CD1-CE3 3.91Å; F78-W396 HydrophobicContact CD1-CE3 3.91Å; F78-W396 HydrophobicContact CD1-CZ3 4.4Å; F78-W396 AromaticContact CE1-CE3 3.67Å; F78-W396 HydrophobicContact CE1-CE3 3.67Å; F78-W396 HydrophobicContact CE1-CZ3 4.35Å; F78-F400 HydrophobicContact CD1-CE2 4.22Å; F78-F400 AromaticContact CD1-CZ 3.81Å; F78-F400 HydrophobicContact CD1-CZ 3.81Å; F78-F400 AromaticContact CE1-CE2 3.7Å; F78-F400 HydrophobicContact CE1-CE2 3.7Å; F78-F400 AromaticContact CE1-CZ 3.73Å; F78-F400 HydrophobicContact CE1-CZ 3.73Å; F78-F400 HydrophobicContact CZ-CE2 4.49Å
79G98.5Very high97.2Very high0 Ų04.6 Ų4.60%03%0.025CC..Iπ-helixtrans-57.8-52.8177.500000112.2M74 I75 G77 W81 V83 F164M74-G79 PolarHBondContact O-N 3.48Å; I75-G79 WeakPolarHBondContact O-CA 3.21Å; I75-G79 PolarHBondContact O-N 3.05Å; G77-G79 PolarHBondContact O-N 3.25Å; G79-W81 PolarHBondContact O-N 2.78Å; G79-V83 WeakPolarHBondContact O-CB 3.35Å; G79-V83 VanDerWaalsContact O-CG2 3.3Å; G79-V83 WeakPolarHBondContact O-CG2 3.19Å; G79-V83 PolarHBondContact O-N 3.18Å; G79-F164 VanDerWaalsContact C-CE1 3.46Å
80N98.5Very high97Very high1 Ų16.7 Ų6.71%0.0054%0.04CC..Hα-helixtrans-65.9-38.1179.6-81.2-67.5000113.1H12 G76 G77 P84 N98H12-N80 PolarHBondContact ND1-O 3.12Å; G76-N80 WeakPolarHBondContact O-CB 3.36Å; G76-N80 PolarHBondContact O-ND2 3.32Å; G77-N80 PolarHBondContact O-N 3.05Å; N80-P84 WeakPolarHBondContact O-CD 3.24Å; N80-N98 PolarHBondContact OD1-ND2 2.96Å; N80-N98 PolarHBondContact OD1-OD1 3.2Å
81W98Very high96.9Very high14 Ų147.6 Ų7.65%0.0535%0.045CC..Hα-helixtrans-66.1-49.5177-97.5101.1000112.5K13 G16 T17 G77 F78 G79 L85 F400 P500K13-W81 HydrophobicContact CB-CD2 4.19Å; K13-W81 HydrophobicContact CB-CE3 4.04Å; K13-W81 HydrophobicContact CB-CH2 3.75Å; K13-W81 HydrophobicContact CB-CZ2 3.88Å; K13-W81 HydrophobicContact CB-CZ3 3.83Å; K13-W81 HydrophobicContact CD-CH2 4.49Å; K13-W81 HydrophobicContact CD-CZ3 4.04Å; K13-W81 HydrophobicContact CG-CD2 4.41Å; K13-W81 HydrophobicContact CG-CE3 3.88Å; K13-W81 HydrophobicContact CG-CH2 4.21Å; K13-W81 HydrophobicContact CG-CZ3 3.77Å; K13-W81 PolarHBondContact O-NE1 2.85Å; G16-W81 VanDerWaalsContact C-CD1 3.5Å; T17-W81 VanDerWaalsContact OG1-CZ2 3.27Å; T17-W81 WeakPolarHBondContact OG1-CZ2 3.44Å; T17-W81 PolarHBondContact OG1-NE1 3.41Å; T17-W81 VanDerWaalsContact OG1-NE1 3.08Å; G77-W81 WeakPolarHBondContact O-CB 3.38Å; G77-W81 PolarHBondContact O-N 3.41Å; F78-W81 PolarHBondContact O-N 2.73Å; G79-W81 PolarHBondContact O-N 2.78Å; W81-L85 HydrophobicContact CE3-CD1 4.46Å; W81-L85 VanDerWaalsContact O-CD1 3.29Å; W81-L85 WeakPolarHBondContact O-CD1 3.39Å; W81-L85 WeakPolarHBondContact O-CG 3.43Å; W81-F400 HydrophobicContact CB-CD1 4.47Å; W81-F400 HydrophobicContact CB-CE1 3.78Å; W81-F400 HydrophobicContact CB-CZ 4.38Å; W81-F400 AromaticContact CD2-CD1 3.58Å; W81-F400 HydrophobicContact CD2-CD1 3.58Å; W81-F400 AromaticContact CD2-CE1 3.81Å; W81-F400 HydrophobicContact CD2-CE1 3.81Å; W81-F400 AromaticContact CE2-CD1 3.92Å; W81-F400 AromaticContact CE3-CD1 3.69Å; W81-F400 HydrophobicContact CE3-CD1 3.69Å; W81-F400 HydrophobicContact CE3-CE1 4.02Å; W81-F400 AromaticContact CG-CD1 3.95Å; W81-F400 HydrophobicContact CG-CD1 3.95Å; W81-F400 AromaticContact CG-CE1 3.72Å; W81-F400 HydrophobicContact CG-CE1 3.72Å; W81-F400 HydrophobicContact CG-CZ 4.44Å; W81-F400 HydrophobicContact CH2-CD1 4.4Å; W81-F400 HydrophobicContact CZ2-CB 4.42Å; W81-F400 HydrophobicContact CZ2-CD1 4.32Å; W81-F400 HydrophobicContact CZ3-CD1 4.1Å; W81-P500 HydrophobicContact CZ3-CG 4.22Å
82L98.3Very high96.9Very high0 Ų07.2 Ų7.20%04%0.043CC..Hα-helixtrans-95.8-32.6-163.6-59.3177.4000113.2F78 L85 M86 F184 W396 L399 F400F78-L82 HydrophobicContact CB-CD1 4.27Å; F78-L82 HydrophobicContact CD1-CD1 3.9Å; F78-L82 VanDerWaalsContact O-CB 3.24Å; F78-L82 WeakPolarHBondContact O-CB 3.4Å; F78-L82 WeakPolarHBondContact O-CG 3.21Å; F78-L82 PolarHBondContact O-N 3.47Å; L82-L85 PolarHBondContact O-N 3.31Å; L82-M86 HydrophobicContact CB-CE 4.01Å; L82-M86 HydrophobicContact CB-CG 4.44Å; L82-M86 HydrophobicContact CB-SD 4.05Å; L82-M86 HydrophobicContact CD1-CE 3.99Å; L82-M86 HydrophobicContact CD2-CE 4.3Å; L82-M86 HydrophobicContact CG-CE 4.33Å; L82-M86 VanDerWaalsContact O-CB 3.24Å; L82-M86 WeakPolarHBondContact O-CB 3.3Å; L82-M86 VanDerWaalsContact O-CG 3.26Å; L82-M86 WeakPolarHBondContact O-CG 3.38Å; L82-M86 PolarHBondContact O-N 2.95Å; L82-F184 HydrophobicContact CB-CD1 4.07Å; L82-F184 HydrophobicContact CB-CE1 3.74Å; L82-F184 HydrophobicContact CD1-CD1 4.31Å; L82-F184 HydrophobicContact CD1-CE1 4.01Å; L82-F184 HydrophobicContact CD1-CZ 4.3Å; L82-F184 HydrophobicContact CG-CE1 4.46Å; L82-W396 HydrophobicContact CD1-CD2 3.76Å; L82-W396 HydrophobicContact CD1-CE3 3.91Å; L82-W396 HydrophobicContact CD1-CG 4.36Å; L82-W396 HydrophobicContact CD1-CH2 4.16Å; L82-W396 HydrophobicContact CD1-CZ2 3.94Å; L82-W396 HydrophobicContact CD1-CZ3 4.13Å; L82-W396 HydrophobicContact CD2-CD2 4.32Å; L82-W396 HydrophobicContact CD2-CG 4.12Å; L82-L399 HydrophobicContact CD2-CD2 3.76Å; L82-F400 HydrophobicContact CD2-CE1 4.17Å
83V98.3Very high96.9Very high0 Ų08.4 Ų8.40%05%0.053CC..Hα-helixtrans-60.2-53.4-174168.30000111.9G79 L85 M86 I87 F164 I168 F184 V188G79-V83 WeakPolarHBondContact O-CB 3.35Å; G79-V83 VanDerWaalsContact O-CG2 3.3Å; G79-V83 WeakPolarHBondContact O-CG2 3.19Å; G79-V83 PolarHBondContact O-N 3.18Å; V83-L85 VanDerWaalsContact C-N 3.29Å; V83-L85 PolarHBondContact O-N 3.24Å; V83-M86 PolarHBondContact O-N 3.09Å; V83-I87 HydrophobicContact CG1-CD1 4.44Å; V83-I87 WeakPolarHBondContact O-CG1 3.36Å; V83-I87 PolarHBondContact O-N 3.26Å; V83-I87 VanDerWaalsContact O-N 3.12Å; V83-F164 HydrophobicContact CB-CD1 4.41Å; V83-F164 HydrophobicContact CB-CE1 4.3Å; V83-F164 HydrophobicContact CG1-CD1 4.41Å; V83-F164 HydrophobicContact CG2-CD1 4.23Å; V83-F164 HydrophobicContact CG2-CE1 4.15Å; V83-I168 HydrophobicContact CG1-CD1 4.01Å; V83-I168 HydrophobicContact CG1-CG1 3.53Å; V83-F184 HydrophobicContact CG2-CE1 4.21Å; V83-V188 HydrophobicContact CG2-CB 4.14Å; V83-V188 HydrophobicContact CG2-CG1 4.01Å; V83-V188 HydrophobicContact CG2-CG2 4.14Å
84P97Very high96.9Very high0 Ų011.6 Ų11.60%07%0.066CC..Hα-helixtrans-60.5-39.8177.6-2637.9000112.3H12 N80 I87 G88 A89 M92H12-P84 HydrophobicContact CB-CG 4.27Å; N80-P84 WeakPolarHBondContact O-CD 3.24Å; P84-I87 PolarHBondContact O-N 3.28Å; P84-G88 PolarHBondContact O-N 3.21Å; P84-A89 HydrophobicContact CB-CB 4.29Å; P84-A89 PolarHBondContact O-N 3.17Å; P84-M92 HydrophobicContact CG-CG 4.01Å; P84-M92 HydrophobicContact CG-SD 3.53Å; P84-M92 VanDerWaalsContact CG-SD 3.53Å
85L95.8Very high96.9Very high2 Ų213.2 Ų13.21%0.018%0.077CC..Hα-helixtrans-63.8-44.7179.1-68.9-177.2000113W81 L82 V83 I87 G88 L399 L492 E493 P500 F505W81-L85 HydrophobicContact CE3-CD1 4.46Å; W81-L85 VanDerWaalsContact O-CD1 3.29Å; W81-L85 WeakPolarHBondContact O-CD1 3.39Å; W81-L85 WeakPolarHBondContact O-CG 3.43Å; L82-L85 PolarHBondContact O-N 3.31Å; V83-L85 VanDerWaalsContact C-N 3.29Å; V83-L85 PolarHBondContact O-N 3.24Å; L85-I87 VanDerWaalsContact C-N 3.33Å; L85-I87 PolarHBondContact O-N 3.09Å; L85-G88 PolarHBondContact O-N 3.37Å; L85-L399 HydrophobicContact CD1-CD2 4.19Å; L85-L492 WeakPolarHBondContact O-CB 3.36Å; L85-E493 HydrophobicContact CB-CB 3.85Å; L85-E493 HydrophobicContact CD1-CB 4.28Å; L85-P500 HydrophobicContact CD1-CG 4.39Å; L85-F505 HydrophobicContact CD2-CE2 3.89Å; L85-F505 WeakPolarHBondContact O-CZ 3.4Å
86M95.3Very high97Very high1 Ų122.2 Ų22.21%0.00511%0.11CC..Hα-helixtrans-75-20.9-176.8-74.9-178.617500113.4L82 V83 P182 F184 V185 W396 E493L82-M86 HydrophobicContact CB-CE 4.01Å; L82-M86 HydrophobicContact CB-CG 4.44Å; L82-M86 HydrophobicContact CB-SD 4.05Å; L82-M86 HydrophobicContact CD1-CE 3.99Å; L82-M86 HydrophobicContact CD2-CE 4.3Å; L82-M86 HydrophobicContact CG-CE 4.33Å; L82-M86 VanDerWaalsContact O-CB 3.24Å; L82-M86 WeakPolarHBondContact O-CB 3.3Å; L82-M86 VanDerWaalsContact O-CG 3.26Å; L82-M86 WeakPolarHBondContact O-CG 3.38Å; L82-M86 PolarHBondContact O-N 2.95Å; V83-M86 PolarHBondContact O-N 3.09Å; M86-P182 HydrophobicContact CB-CG 4.2Å; M86-F184 HydrophobicContact CE-CD1 4.44Å; M86-F184 HydrophobicContact SD-CB 4Å; M86-F184 HydrophobicContact SD-CD1 3.74Å; M86-F184 HydrophobicContact SD-CG 4.27Å; M86-V185 HydrophobicContact CB-CG2 3.74Å; M86-V185 HydrophobicContact SD-CG2 4.36Å; M86-W396 HydrophobicContact CE-CZ2 3.89Å; M86-E493 HydrophobicContact CE-CG 4.3Å; M86-E493 HydrophobicContact CG-CB 4.3Å
87I95.1Very high97Very high0 Ų024.8 Ų24.80%012%0.121CC..Hα-helixtrans-99.4-2.9172.473.9-177.8000113V83 P84 L85 A89 T167 K172 P173 V185V83-I87 HydrophobicContact CG1-CD1 4.44Å; V83-I87 WeakPolarHBondContact O-CG1 3.36Å; V83-I87 PolarHBondContact O-N 3.26Å; V83-I87 VanDerWaalsContact O-N 3.12Å; P84-I87 PolarHBondContact O-N 3.28Å; L85-I87 VanDerWaalsContact C-N 3.33Å; L85-I87 PolarHBondContact O-N 3.09Å; I87-A89 HydrophobicContact CD1-CB 3.91Å; I87-A89 HydrophobicContact CG1-CB 3.71Å; I87-T167 HydrophobicContact CD1-CG2 4Å; I87-K172 HydrophobicContact CB-CG 4.18Å; I87-K172 HydrophobicContact CD1-CG 4.38Å; I87-K172 HydrophobicContact CG2-CG 4.45Å; I87-P173 WeakPolarHBondContact O-CD 3.11Å; I87-V185 HydrophobicContact CG2-CB 4.41Å; I87-V185 HydrophobicContact CG2-CG1 3.73Å; I87-V185 HydrophobicContact CG2-CG2 3.88Å
88G93.6Very high97Very high5 Ų524.8 Ų24.85%0.05212%0.121CC..THydrogen-bonded Turntrans71.728.5-177.700000114.6P84 L85 F505P84-G88 PolarHBondContact O-N 3.21Å; L85-G88 PolarHBondContact O-N 3.37Å; G88-F505 WeakPolarHBondContact O-CB 3.48Å; G88-F505 WeakPolarHBondContact O-CG 3.49Å
89A94.4Very high96.9Very high0 Ų025.8 Ų25.80%013%0.127CC..  trans-91.5145.4175.800000111.3P84 I87 M171 F505P84-A89 HydrophobicContact CB-CB 4.29Å; P84-A89 PolarHBondContact O-N 3.17Å; I87-A89 HydrophobicContact CD1-CB 3.91Å; I87-A89 HydrophobicContact CG1-CB 3.71Å; A89-M171 HydrophobicContact CB-CB 4.01Å; A89-M171 HydrophobicContact CB-CE 4.45Å; A89-F505 WeakPolarHBondContact O-CD2 3.44Å
90P94Very high96.9Very high59 Ų5930.8 Ų30.838%0.38315%0.152SC..SBendtrans-71.5-29.5-179.927.4-34.9000114T504P90-T504 VanDerWaalsContact CA-O 3.24Å; P90-T504 WeakPolarHBondContact CA-O 3.27Å; P90-T504 WeakPolarHBondContact CB-O 3.22Å
91D95.7Very high96.9Very high22 Ų2230.8 Ų30.812%0.11815%0.151CC..SBendtrans-161.2-176176.8-147.1-32.8000110T10 H12 M171T10-D91 VanDerWaalsContact O-OD2 3.09Å; H12-D91 VanDerWaalsContact CB-OD1 3.27Å; H12-D91 WeakPolarHBondContact CB-OD1 3.19Å; H12-D91 IonicContact CD2-OD1 2.83Å; H12-D91 PolarHBondContact CD2-OD1 2.85Å; H12-D91 VanDerWaalsContact CD2-OD1 3.31Å; H12-D91 IonicContact CG-OD1 2.67Å; H12-D91 PolarHBondContact N-OD1 2.75Å; D91-M171 WeakPolarHBondContact O-CE 3.29Å
92M97.3Very high96.9Very high4 Ų430.5 Ų30.52%0.0215%0.151CC..  trans-74.1156169.4-62.1-70.8-71.500111.9H12 P84 F94 P95 N163 F164 T167H12-M92 HydrophobicContact CB-CG 3.78Å; P84-M92 HydrophobicContact CG-CG 4.01Å; P84-M92 HydrophobicContact CG-SD 3.53Å; P84-M92 VanDerWaalsContact CG-SD 3.53Å; M92-F94 PolarHBondContact O-N 3.21Å; M92-P95 WeakPolarHBondContact O-CD 3.34Å; M92-P95 WeakPolarHBondContact O-CG 3.18Å; M92-N163 HydrophobicContact CE-CB 4.29Å; M92-N163 WeakPolarHBondContact CE-ND2 3.33Å; M92-F164 HydrophobicContact CE-CD1 3.48Å; M92-F164 VanDerWaalsContact CE-CD1 3.48Å; M92-F164 HydrophobicContact CE-CE1 3.54Å; M92-F164 HydrophobicContact CE-CG 4.04Å; M92-F164 HydrophobicContact CE-CZ 4.18Å; M92-F164 HydrophobicContact SD-CD1 4.37Å; M92-F164 HydrophobicContact SD-CE1 4.18Å; M92-T167 HydrophobicContact SD-CG2 3.91Å
93A98Very high96.9Very high29 Ų2934.9 Ų34.924%0.2417%0.167CC..SBendtrans-64.1-36.6-177.500000113.5P95 N163 T166 T167 M171A93-P95 WeakPolarHBondContact O-CD 2.9Å; A93-N163 PolarHBondContact N-OD1 3.46Å; A93-T166 HydrophobicContact CB-CG2 3.74Å; A93-T167 WeakPolarHBondContact CB-OG1 3.37Å; A93-T167 PolarHBondContact N-OG1 3.36Å; A93-M171 WeakPolarHBondContact CA-SD 3.33Å; A93-M171 HydrophobicContact CB-CG 4.45Å; A93-M171 HydrophobicContact CB-SD 3.61Å; A93-M171 PolarHBondContact N-SD 3.34Å
94F98.4Very high97Very high80 Ų8036.2 Ų36.235%0.35117%0.174SC..  trans-12375.4179.4-51.8-55.3000111.6M92 R96 M97 N98 I162 N163 T166M92-F94 PolarHBondContact O-N 3.21Å; F94-R96 VanDerWaalsContact C-N 3.31Å; F94-R96 PolarHBondContact O-N 3.37Å; F94-M97 HydrophobicContact CB-CB 3.67Å; F94-M97 HydrophobicContact CB-SD 4.32Å; F94-M97 HydrophobicContact CD2-CE 4.35Å; F94-M97 HydrophobicContact CD2-SD 4.13Å; F94-M97 WeakPolarHBondContact O-CB 3.4Å; F94-M97 PolarHBondContact O-N 3.05Å; F94-M97 VanDerWaalsContact O-N 3.11Å; F94-N98 PolarHBondContact O-N 3.44Å; F94-I162 HydrophobicContact CD2-CG2 4.47Å; F94-I162 HydrophobicContact CE2-CG2 4.1Å; F94-N163 HydrophobicContact CD2-CB 4.29Å; F94-N163 PolarHBondContact N-OD1 3.2Å; F94-T166 HydrophobicContact CE2-CG2 3.75Å; F94-T166 WeakPolarHBondContact CE2-OG1 3.23Å; F94-T166 HydrophobicContact CZ-CG2 3.73Å
95P97.6Very high97Very high37 Ų3736.4 Ų36.424%0.2418%0.175CC..Hα-helixtrans-57.2-37.2-173.8-29.437.6000115.1T10 M92 A93 N98 N99T10-P95 HydrophobicContact CG2-CB 4.21Å; T10-P95 WeakPolarHBondContact O-CB 3.48Å; M92-P95 WeakPolarHBondContact O-CD 3.34Å; M92-P95 WeakPolarHBondContact O-CG 3.18Å; A93-P95 WeakPolarHBondContact O-CD 2.9Å; P95-N98 VanDerWaalsContact O-CB 3.28Å; P95-N98 WeakPolarHBondContact O-CB 3.47Å; P95-N98 PolarHBondContact O-N 2.89Å; P95-N99 PolarHBondContact O-N 2.74Å; P95-N99 VanDerWaalsContact O-N 3.1Å
96R98.1Very high97.2Very high208 Ų20837.9 Ų37.979%0.78519%0.185SC*.Hα-helixtrans-74.5-36.3178.6-64-177.2-178.1-152.90.1112.8T10 F94 N98 N99 M100T10-R96 HydrophobicContact CG2-CG 4.14Å; F94-R96 VanDerWaalsContact C-N 3.31Å; F94-R96 PolarHBondContact O-N 3.37Å; R96-N98 VanDerWaalsContact C-N 3.26Å; R96-N99 PolarHBondContact O-N 2.93Å; R96-M100 PolarHBondContact O-N 3.48Å
97M97.8Very high97.3Very high57 Ų5740.3 Ų40.328%0.28120%0.201SC..Hα-helixtrans-64.3-37.4172.8-176.3-176.9-68.600110.2F94 M100 S101 L159 I162F94-M97 HydrophobicContact CB-CB 3.67Å; F94-M97 HydrophobicContact CB-SD 4.32Å; F94-M97 HydrophobicContact CD2-CE 4.35Å; F94-M97 HydrophobicContact CD2-SD 4.13Å; F94-M97 WeakPolarHBondContact O-CB 3.4Å; F94-M97 PolarHBondContact O-N 3.05Å; F94-M97 VanDerWaalsContact O-N 3.11Å; M97-M100 PolarHBondContact O-N 3.12Å; M97-S101 PolarHBondContact O-N 3.49Å; M97-L159 HydrophobicContact CE-CD2 4.37Å; M97-L159 HydrophobicContact CG-CB 3.86Å; M97-L159 HydrophobicContact CG-CD2 3.96Å; M97-L159 HydrophobicContact CG-CG 4.35Å; M97-L159 HydrophobicContact SD-CB 4.31Å; M97-L159 HydrophobicContact SD-CD2 4.05Å; M97-I162 HydrophobicContact SD-CB 4.42Å; M97-I162 HydrophobicContact SD-CG2 4.3Å
98N98.2Very high97.5Very high0 Ų040.3 Ų40.30%020%0.201CC..Hα-helixtrans-62.2-40.4173.8-155.237.8000113.2I15 N80 F94 P95 R96 S101 F102 N163I15-N98 HydrophobicContact CD1-CB 4.04Å; N80-N98 PolarHBondContact OD1-ND2 2.96Å; N80-N98 PolarHBondContact OD1-OD1 3.2Å; F94-N98 PolarHBondContact O-N 3.44Å; P95-N98 VanDerWaalsContact O-CB 3.28Å; P95-N98 WeakPolarHBondContact O-CB 3.47Å; P95-N98 PolarHBondContact O-N 2.89Å; R96-N98 VanDerWaalsContact C-N 3.26Å; N98-S101 PolarHBondContact O-OG 3.36Å; N98-F102 PolarHBondContact O-N 2.83Å; N98-N163 VanDerWaalsContact CB-ND2 3.34Å; N98-N163 WeakPolarHBondContact CB-ND2 3.39Å; N98-N163 PolarHBondContact OD1-ND2 2.91Å
99N98.4Very high97.7Very high22 Ų2240.4 Ų40.412%0.11820%0.2CC..Hα-helixtrans-66.8-44.9175.1-169.626.5000110.6L7 S9 I15 P95 R96 S101 F102 W103L7-N99 PolarHBondContact O-ND2 3.28Å; S9-N99 VanDerWaalsContact O-CB 3.31Å; S9-N99 WeakPolarHBondContact O-CB 3.34Å; S9-N99 VanDerWaalsContact O-CG 3.24Å; S9-N99 PolarHBondContact O-ND2 3.39Å; I15-N99 HydrophobicContact CD1-CB 3.96Å; P95-N99 PolarHBondContact O-N 2.74Å; P95-N99 VanDerWaalsContact O-N 3.1Å; R96-N99 PolarHBondContact O-N 2.93Å; N99-S101 VanDerWaalsContact C-N 3.33Å; N99-S101 PolarHBondContact O-N 2.94Å; N99-F102 PolarHBondContact O-N 3.02Å; N99-W103 VanDerWaalsContact O-CD1 3.25Å; N99-W103 PolarHBondContact O-N 2.84Å; N99-W103 VanDerWaalsContact O-N 3.09Å; N99-W103 PolarHBondContact OD1-NE1 2.95Å
100M97.8Very high97.9Very high106 Ų10646 Ų4652%0.52223%0.229SC..Hα-helixtrans-61.3-39.9177.2-175.9175.1178.300112.2R96 M97 F102 W103 L104 L159R96-M100 PolarHBondContact O-N 3.48Å; M97-M100 PolarHBondContact O-N 3.12Å; M100-F102 VanDerWaalsContact C-N 3.28Å; M100-F102 PolarHBondContact O-N 3.32Å; M100-W103 PolarHBondContact O-N 2.79Å; M100-L104 HydrophobicContact CE-CD1 4.44Å; M100-L104 HydrophobicContact CG-CD1 4.4Å; M100-L104 WeakPolarHBondContact O-CG 3.33Å; M100-L104 PolarHBondContact O-N 2.86Å; M100-L159 HydrophobicContact CE-CD1 4.43Å; M100-L159 HydrophobicContact CG-CD1 4.14Å; M100-L159 HydrophobicContact SD-CD1 4.17Å
101S98.1Very high98.2Very high0 Ų045.4 Ų45.40%022%0.223CC..Hα-helixtrans-59.7-40.217762.40000111.3Y19 M97 N98 N99 S156Y19-S101 WeakPolarHBondContact OH-CB 3.24Å; Y19-S101 PolarHBondContact OH-O 3.35Å; Y19-S101 PolarHBondContact OH-OG 2.85Å; M97-S101 PolarHBondContact O-N 3.49Å; N98-S101 PolarHBondContact O-OG 3.36Å; N99-S101 VanDerWaalsContact C-N 3.33Å; N99-S101 PolarHBondContact O-N 2.94Å; S101-S156 VanDerWaalsContact CB-O 3.29Å; S101-S156 WeakPolarHBondContact CB-O 3.34Å; S101-S156 WeakPolarHBondContact O-CB 3.18Å; S101-S156 PolarHBondContact O-OG 2.79Å
102F98.7Very high98.3Very high9 Ų944.5 Ų44.54%0.03922%0.218CC..Hα-helixtrans-65.4-50.6175.2172.1-101.8000112I15 L18 Y19 F22 N98 N99 M100 L104 L105 P106I15-F102 HydrophobicContact CG2-CB 4.21Å; L18-F102 VanDerWaalsContact C-CE2 3.46Å; L18-F102 HydrophobicContact CB-CD1 4.09Å; L18-F102 HydrophobicContact CB-CD2 4Å; L18-F102 HydrophobicContact CB-CE1 3.76Å; L18-F102 HydrophobicContact CB-CE2 3.66Å; L18-F102 HydrophobicContact CB-CG 4.21Å; L18-F102 HydrophobicContact CB-CZ 3.56Å; L18-F102 HydrophobicContact CD1-CD1 3.91Å; L18-F102 HydrophobicContact CD1-CE1 3.83Å; L18-F102 HydrophobicContact CD1-CZ 4.47Å; L18-F102 HydrophobicContact CD2-CE1 4.47Å; L18-F102 HydrophobicContact CG-CE1 4.24Å; L18-F102 HydrophobicContact CG-CZ 4.4Å; L18-F102 WeakPolarHBondContact O-CE2 2.97Å; Y19-F102 AromaticContact CD1-CD2 3.92Å; Y19-F102 HydrophobicContact CD1-CD2 3.92Å; Y19-F102 HydrophobicContact CD2-CB 4.26Å; Y19-F102 HydrophobicContact CD2-CD2 4.01Å; Y19-F102 HydrophobicContact CE1-CB 4.42Å; Y19-F102 HydrophobicContact CE1-CD2 4.1Å; Y19-F102 HydrophobicContact CE2-CB 3.67Å; Y19-F102 HydrophobicContact CE2-CD2 4.16Å; Y19-F102 HydrophobicContact CE2-CG 4.37Å; Y19-F102 AromaticContact CG-CD2 3.88Å; Y19-F102 HydrophobicContact CG-CD2 3.88Å; Y19-F102 WeakPolarHBondContact OH-CA 3.48Å; Y19-F102 PolarHBondContact OH-N 3.24Å; F22-F102 HydrophobicContact CB-CE2 3.87Å; F22-F102 HydrophobicContact CB-CZ 4.36Å; F22-F102 HydrophobicContact CG-CE2 4.35Å; N98-F102 PolarHBondContact O-N 2.83Å; N99-F102 PolarHBondContact O-N 3.02Å; M100-F102 VanDerWaalsContact C-N 3.28Å; M100-F102 PolarHBondContact O-N 3.32Å; F102-L104 PolarHBondContact O-N 3.43Å; F102-L104 VanDerWaalsContact O-N 3.09Å; F102-L105 WeakPolarHBondContact O-CB 3.41Å; F102-L105 PolarHBondContact O-N 3.49Å; F102-P106 HydrophobicContact CZ-CG 4.43Å; F102-P106 VanDerWaalsContact O-CD 3.22Å; F102-P106 WeakPolarHBondContact O-CD 3.39Å
103W98.4Very high98.3Very high91 Ų9146.2 Ų46.235%0.34523%0.227SC..Hα-helixtrans-68.2-11.5-171.8-78.3110.6000115L7 N99 M100 P106 P107L7-W103 HydrophobicContact CB-CZ2 4.49Å; L7-W103 HydrophobicContact CD2-CH2 3.39Å; L7-W103 HydrophobicContact CD2-CZ2 3.41Å; L7-W103 VanDerWaalsContact CD2-CZ2 3.41Å; L7-W103 HydrophobicContact CD2-CZ3 4.42Å; L7-W103 PolarHBondContact O-NE1 3.19Å; N99-W103 VanDerWaalsContact O-CD1 3.25Å; N99-W103 PolarHBondContact O-N 2.84Å; N99-W103 VanDerWaalsContact O-N 3.09Å; N99-W103 PolarHBondContact OD1-NE1 2.95Å; M100-W103 PolarHBondContact O-N 2.79Å; W103-P106 HydrophobicContact CE3-CG 4.34Å; W103-P107 WeakPolarHBondContact O-CD 3.36Å; W103-P107 WeakPolarHBondContact O-CG 3.01Å
104L98.6Very high98.3Very high28 Ų2846.2 Ų46.215%0.14723%0.227CC..THydrogen-bonded Turntrans-77-20.6170.3-69.9171.4000113.2M100 F102 P107 S108 L152 V155 L159M100-L104 HydrophobicContact CE-CD1 4.44Å; M100-L104 HydrophobicContact CG-CD1 4.4Å; M100-L104 WeakPolarHBondContact O-CG 3.33Å; M100-L104 PolarHBondContact O-N 2.86Å; F102-L104 PolarHBondContact O-N 3.43Å; F102-L104 VanDerWaalsContact O-N 3.09Å; L104-P107 WeakPolarHBondContact O-CD 3.19Å; L104-P107 WeakPolarHBondContact O-CG 3.45Å; L104-S108 WeakPolarHBondContact O-CB 3.35Å; L104-S108 PolarHBondContact O-N 2.69Å; L104-L152 HydrophobicContact CD2-CD2 4.27Å; L104-V155 HydrophobicContact CD1-CB 4.2Å; L104-V155 HydrophobicContact CD1-CG1 3.66Å; L104-L159 HydrophobicContact CD1-CD1 4.05Å
105L98.6Very high98.3Very high5 Ų542.6 Ų42.63%0.02621%0.211CC..Hα-helixtrans-73-44.5-178.7-67.9-179.8000114.4Y19 F22 P72 F102 S108 L109 A153Y19-L105 HydrophobicContact CD1-CD1 3.86Å; Y19-L105 HydrophobicContact CE1-CD1 3.42Å; Y19-L105 VanDerWaalsContact CE1-CD1 3.42Å; F22-L105 HydrophobicContact CD1-CB 4.44Å; F22-L105 HydrophobicContact CD1-CD1 4.26Å; F22-L105 HydrophobicContact CE1-CB 3.85Å; F22-L105 HydrophobicContact CE1-CD1 4.1Å; F22-L105 HydrophobicContact CE2-CB 4.45Å; F22-L105 HydrophobicContact CZ-CB 3.84Å; P72-L105 HydrophobicContact CB-CD1 4.13Å; P72-L105 HydrophobicContact CG-CD1 3.75Å; F102-L105 WeakPolarHBondContact O-CB 3.41Å; F102-L105 PolarHBondContact O-N 3.49Å; L105-S108 WeakPolarHBondContact O-CB 3.38Å; L105-S108 PolarHBondContact O-N 3.39Å; L105-L109 PolarHBondContact O-N 3.11Å; L105-A153 HydrophobicContact CD2-CB 4.41Å
106P98.6Very high98.2Very high33 Ų3342.5 Ų42.521%0.21421%0.214CC..Hα-helixtrans-55.9-50.4175.5-25.133.9000114.6F22 F102 W103 S108 L109 L110F22-P106 HydrophobicContact CD2-CG 4.34Å; F22-P106 HydrophobicContact CE2-CB 4.45Å; F22-P106 HydrophobicContact CE2-CG 4.21Å; F102-P106 HydrophobicContact CZ-CG 4.43Å; F102-P106 VanDerWaalsContact O-CD 3.22Å; F102-P106 WeakPolarHBondContact O-CD 3.39Å; W103-P106 HydrophobicContact CE3-CG 4.34Å; P106-S108 VanDerWaalsContact C-N 3.3Å; P106-S108 PolarHBondContact O-N 3.19Å; P106-L109 PolarHBondContact O-N 2.89Å; P106-L110 WeakPolarHBondContact O-CG 3.35Å; P106-L110 PolarHBondContact O-N 2.61Å
107P98.6Very high98Very high52 Ų5239.7 Ų39.734%0.33821%0.212SC..Hα-helixtrans-65.6-33.9176.725.3-32.4000112.3W103 L104 L110 L111 L152W103-P107 WeakPolarHBondContact O-CD 3.36Å; W103-P107 WeakPolarHBondContact O-CG 3.01Å; L104-P107 WeakPolarHBondContact O-CD 3.19Å; L104-P107 WeakPolarHBondContact O-CG 3.45Å; P107-L110 PolarHBondContact O-N 3.3Å; P107-L111 WeakPolarHBondContact O-CG 3.47Å; P107-L111 PolarHBondContact O-N 3.03Å; P107-L152 HydrophobicContact CB-CD1 4.36Å; P107-L152 HydrophobicContact CG-CD1 4.48Å
108S98.8Very high97.9Very high0 Ų039.5 Ų39.50%021%0.213CC..Hα-helixtrans-59.4-49173.1175.40000111.8F68 L104 L105 P106 L110 L111 L112 S149 A153F68-S108 VanDerWaalsContact CE1-OG 3.29Å; F68-S108 WeakPolarHBondContact CE1-OG 3.45Å; F68-S108 WeakPolarHBondContact CZ-OG 3.33Å; L104-S108 WeakPolarHBondContact O-CB 3.35Å; L104-S108 PolarHBondContact O-N 2.69Å; L105-S108 WeakPolarHBondContact O-CB 3.38Å; L105-S108 PolarHBondContact O-N 3.39Å; P106-S108 VanDerWaalsContact C-N 3.3Å; P106-S108 PolarHBondContact O-N 3.19Å; S108-L110 VanDerWaalsContact C-N 3.33Å; S108-L110 PolarHBondContact O-N 3.43Å; S108-L111 WeakPolarHBondContact O-CB 3.49Å; S108-L111 PolarHBondContact O-N 2.96Å; S108-L112 PolarHBondContact O-N 3.31Å; S108-S149 WeakPolarHBondContact O-CB 3.45Å; S108-S149 PolarHBondContact O-OG 3.31Å; S108-S149 PolarHBondContact OG-O 3.27Å; S108-S149 PolarHBondContact OG-OG 3.13Å; S108-A153 PolarHBondContact OG-N 2.93Å
109L98.6Very high97.6Very high6 Ų645.2 Ų45.23%0.03124%0.24CC..Hα-helixtrans-63.4-39.6177-178.455.2000112F22 W25 A26 V64 F68 L105 P106 L111 L112 L113F22-L109 HydrophobicContact CE2-CB 4.31Å; F22-L109 HydrophobicContact CE2-CD2 3.73Å; F22-L109 HydrophobicContact CZ-CB 3.94Å; F22-L109 HydrophobicContact CZ-CD2 3.61Å; F22-L109 HydrophobicContact CZ-CG 4.43Å; W25-L109 HydrophobicContact CE3-CD2 4.06Å; W25-L109 HydrophobicContact CZ3-CD2 3.66Å; A26-L109 HydrophobicContact CB-CD2 4.34Å; V64-L109 HydrophobicContact CG2-CD1 4.22Å; F68-L109 HydrophobicContact CB-CD1 4.24Å; F68-L109 HydrophobicContact CD1-CB 3.73Å; F68-L109 HydrophobicContact CD1-CD1 4.11Å; F68-L109 HydrophobicContact CD1-CG 4.34Å; F68-L109 HydrophobicContact CD2-CD1 4.07Å; F68-L109 HydrophobicContact CE1-CB 3.72Å; F68-L109 HydrophobicContact CE1-CD1 4.47Å; F68-L109 HydrophobicContact CE2-CD1 4.46Å; F68-L109 HydrophobicContact CG-CB 4.36Å; F68-L109 HydrophobicContact CG-CD1 3.85Å; F68-L109 HydrophobicContact CZ-CB 4.38Å; L105-L109 PolarHBondContact O-N 3.11Å; P106-L109 PolarHBondContact O-N 2.89Å; L109-L111 VanDerWaalsContact C-N 3.31Å; L109-L111 PolarHBondContact O-N 3.1Å; L109-L112 HydrophobicContact CD1-CD2 4.38Å; L109-L112 WeakPolarHBondContact O-CB 3.48Å; L109-L112 PolarHBondContact O-N 3.4Å; L109-L113 HydrophobicContact CD1-CD1 4.34Å; L109-L113 HydrophobicContact CD1-CG 4.18Å; L109-L113 HydrophobicContact CG-CD1 4.19Å; L109-L113 HydrophobicContact CG-CG 4.44Å; L109-L113 WeakPolarHBondContact O-CG 3.49Å; L109-L113 PolarHBondContact O-N 3.48Å
110L98.5Very high97.4Very high117 Ų11747.2 Ų47.261%0.61326%0.26SS*.Hα-helixtrans-61.6-39.1175.5-70.5174.3000112P106 P107 S108 L113 A114P106-L110 WeakPolarHBondContact O-CG 3.35Å; P106-L110 PolarHBondContact O-N 2.61Å; P107-L110 PolarHBondContact O-N 3.3Å; S108-L110 VanDerWaalsContact C-N 3.33Å; S108-L110 PolarHBondContact O-N 3.43Å; L110-L113 PolarHBondContact O-N 3.07Å; L110-A114 VanDerWaalsContact O-CB 3.25Å; L110-A114 WeakPolarHBondContact O-CB 3.47Å; L110-A114 PolarHBondContact O-N 3.05Å
111L98.7Very high97.3Very high47 Ų4742.1 Ų42.125%0.24624%0.235CC..Hα-helixtrans-64-40.5173.7-71171.5000111.8P107 S108 L109 A114 S115 L145 F148 L152P107-L111 WeakPolarHBondContact O-CG 3.47Å; P107-L111 PolarHBondContact O-N 3.03Å; S108-L111 WeakPolarHBondContact O-CB 3.49Å; S108-L111 PolarHBondContact O-N 2.96Å; L109-L111 VanDerWaalsContact C-N 3.31Å; L109-L111 PolarHBondContact O-N 3.1Å; L111-A114 PolarHBondContact O-N 3.14Å; L111-S115 WeakPolarHBondContact O-CB 3.41Å; L111-S115 PolarHBondContact O-N 3.32Å; L111-L145 HydrophobicContact CD2-CD2 3.82Å; L111-F148 HydrophobicContact CD1-CB 3.96Å; L111-L152 HydrophobicContact CD1-CD1 3.65Å; L111-L152 HydrophobicContact CD1-CG 4.49Å
112L98.5Very high97.3Very high4 Ų442.2 Ų42.22%0.02124%0.235CC..Hα-helixtrans-62.6-44.3175.4-176.667.2000111.9F63 V64 F68 S108 L109 S115 A116 T146F63-L112 HydrophobicContact CB-CD1 4.04Å; F63-L112 HydrophobicContact CB-CD2 3.63Å; F63-L112 HydrophobicContact CD2-CD1 3.91Å; F63-L112 HydrophobicContact CG-CD1 4.24Å; V64-L112 HydrophobicContact CG2-CD2 3.77Å; F68-L112 HydrophobicContact CD2-CD2 3.97Å; F68-L112 HydrophobicContact CE2-CB 4.47Å; F68-L112 HydrophobicContact CE2-CD2 3.62Å; S108-L112 PolarHBondContact O-N 3.31Å; L109-L112 HydrophobicContact CD1-CD2 4.38Å; L109-L112 WeakPolarHBondContact O-CB 3.48Å; L109-L112 PolarHBondContact O-N 3.4Å; L112-S115 VanDerWaalsContact O-CB 3.23Å; L112-S115 WeakPolarHBondContact O-CB 3.15Å; L112-S115 PolarHBondContact O-N 3.01Å; L112-A116 PolarHBondContact O-N 3.5Å; L112-T146 HydrophobicContact CD1-CG2 4.21Å
113L97.8Very high97.2Very high39 Ų3942.1 Ų42.120%0.20424%0.237CC..Hα-helixtrans-70.1-37.5179.3-62.1176.9000111.6W25 L29 L109 L110 S115 A116 M117W25-L113 HydrophobicContact CH2-CD1 4.43Å; L29-L113 HydrophobicContact CD2-CD1 3.99Å; L29-L113 HydrophobicContact CD2-CD2 3.74Å; L29-L113 HydrophobicContact CD2-CG 4.46Å; L109-L113 HydrophobicContact CD1-CD1 4.34Å; L109-L113 HydrophobicContact CD1-CG 4.18Å; L109-L113 HydrophobicContact CG-CD1 4.19Å; L109-L113 HydrophobicContact CG-CG 4.44Å; L109-L113 WeakPolarHBondContact O-CG 3.49Å; L109-L113 PolarHBondContact O-N 3.48Å; L110-L113 PolarHBondContact O-N 3.07Å; L113-S115 VanDerWaalsContact C-N 3.31Å; L113-A116 PolarHBondContact O-N 3.25Å; L113-M117 WeakPolarHBondContact O-CE 3.2Å; L113-M117 WeakPolarHBondContact O-CG 3.09Å; L113-M117 PolarHBondContact O-N 2.93Å
114A98Very high97.2Very high29 Ų2938 Ų3824%0.2422%0.221CC..Hα-helixtrans-61.5-41.317100000111.2L110 L111 A116 M117 V118 L145L110-A114 VanDerWaalsContact O-CB 3.25Å; L110-A114 WeakPolarHBondContact O-CB 3.47Å; L110-A114 PolarHBondContact O-N 3.05Å; L111-A114 PolarHBondContact O-N 3.14Å; A114-A116 VanDerWaalsContact C-N 3.26Å; A114-A116 PolarHBondContact O-N 3.46Å; A114-M117 PolarHBondContact O-N 3.15Å; A114-V118 WeakPolarHBondContact O-CB 3.22Å; A114-V118 VanDerWaalsContact O-CG2 3.29Å; A114-V118 WeakPolarHBondContact O-CG2 3.48Å; A114-V118 PolarHBondContact O-N 3.28Å; A114-L145 HydrophobicContact CB-CD1 4.22Å
115S97.9Very high97.1Very high4 Ų436.8 Ų36.83%0.02822%0.216CC..Hα-helixtrans-52.2-44.2173.4141.30000111.8L111 L112 L113 M117 G121 S142 T146L111-S115 WeakPolarHBondContact O-CB 3.41Å; L111-S115 PolarHBondContact O-N 3.32Å; L112-S115 VanDerWaalsContact O-CB 3.23Å; L112-S115 WeakPolarHBondContact O-CB 3.15Å; L112-S115 PolarHBondContact O-N 3.01Å; L113-S115 VanDerWaalsContact C-N 3.31Å; S115-M117 VanDerWaalsContact C-N 3.26Å; S115-M117 PolarHBondContact O-N 3.44Å; S115-G121 VanDerWaalsContact O-CA 3.29Å; S115-G121 WeakPolarHBondContact O-CA 3.47Å; S115-S142 VanDerWaalsContact CB-O 3.26Å; S115-S142 WeakPolarHBondContact CB-O 3.25Å; S115-S142 WeakPolarHBondContact O-CB 3.45Å; S115-S142 PolarHBondContact OG-O 2.84Å; S115-T146 WeakPolarHBondContact CB-OG1 3.18Å; S115-T146 PolarHBondContact OG-OG1 2.97Å
116A94.7Very high97Very high36 Ų3638 Ų3830%0.29822%0.22SC..Hα-helixtrans-70.5-19.3-18000000114V56 L112 L113 A114V56-A116 HydrophobicContact CG1-CB 3.85Å; L112-A116 PolarHBondContact O-N 3.5Å; L113-A116 PolarHBondContact O-N 3.25Å; A114-A116 VanDerWaalsContact C-N 3.26Å; A114-A116 PolarHBondContact O-N 3.46Å
117M94.2Very high96.9Very high149 Ų14936.4 Ų36.473%0.73421%0.21SC*.Hα-helixtrans-103-21.8-177.5-65.3-174.2-69.300113.8L113 A114 S115L113-M117 WeakPolarHBondContact O-CE 3.2Å; L113-M117 WeakPolarHBondContact O-CG 3.09Å; L113-M117 PolarHBondContact O-N 2.93Å; A114-M117 PolarHBondContact O-N 3.15Å; S115-M117 VanDerWaalsContact C-N 3.26Å; S115-M117 PolarHBondContact O-N 3.44Å
118V95.6Very high96.8Very high52 Ų5234 Ų3432%0.31520%0.195SC..SBendtrans-82.3130-178.8169.40000109.8A114 A120 G121 A141 L145A114-V118 WeakPolarHBondContact O-CB 3.22Å; A114-V118 VanDerWaalsContact O-CG2 3.29Å; A114-V118 WeakPolarHBondContact O-CG2 3.48Å; A114-V118 PolarHBondContact O-N 3.28Å; V118-A120 PolarHBondContact O-N 2.82Å; V118-G121 PolarHBondContact O-N 2.76Å; V118-A141 HydrophobicContact CG1-CB 4.32Å; V118-L145 HydrophobicContact CB-CD1 4.14Å; V118-L145 HydrophobicContact CG1-CD1 4.45Å; V118-L145 HydrophobicContact CG2-CD1 3.9Å
119E93.4Very high96.8Very high120 Ų12036.1 Ų36.156%0.56120%0.203SC*.THydrogen-bonded Turntrans53.8-121.7-179-60.3162.5173.600111.5G140 A141E119-G140 VanDerWaalsContact OE1-CA 3.26Å; E119-G140 WeakPolarHBondContact OE1-CA 3.47Å; E119-G140 WeakPolarHBondContact OE2-CA 3.3Å; E119-A141 VanDerWaalsContact CD-N 3.34Å; E119-A141 PolarHBondContact OE1-N 3.13Å; E119-A141 PolarHBondContact OE2-N 2.98Å
120A93Very high96.7Very high64 Ų6436.4 Ų36.453%0.52921%0.205SC..THydrogen-bonded Turntrans-91.4-9.6177.300000112.9H52 V56 V118H52-A120 PolarHBondContact CD2-O 3.17Å; H52-A120 PolarHBondContact NE2-O 2.92Å; V56-A120 WeakPolarHBondContact CG2-O 3.31Å; V118-A120 PolarHBondContact O-N 2.82Å
121G96.8Very high96.6Very high0 Ų035 Ų350%020%0.202CC..  trans78.4161.4-172.100000115H52 S115 V118 G123 S142H52-G121 PolarHBondContact NE2-O 3.37Å; H52-G121 VanDerWaalsContact NE2-O 3.15Å; S115-G121 VanDerWaalsContact O-CA 3.29Å; S115-G121 WeakPolarHBondContact O-CA 3.47Å; V118-G121 PolarHBondContact O-N 2.76Å; G121-G123 PolarHBondContact O-N 3.08Å; G121-S142 PolarHBondContact O-OG 3.34Å
122A97.4Very high96.5Very high2 Ų236.4 Ų36.42%0.01721%0.21CC..  trans-81.193.1-179.600000111.9T59 V143 T146T59-A122 WeakPolarHBondContact CB-O 3.33Å; T59-A122 WeakPolarHBondContact CG2-O 3.48Å; T59-A122 PolarHBondContact OG1-O 3.03Å; A122-V143 HydrophobicContact CB-CG2 4.34Å; A122-T146 WeakPolarHBondContact CB-OG1 3.29Å
123G96.9Very high96.5Very high6 Ų636.2 Ų36.26%0.06221%0.209CC..  trans-93.828.3179.400000114.4G121 H138G121-G123 PolarHBondContact O-N 3.08Å; G123-H138 WeakPolarHBondContact CA-NE2 3.28Å; G123-H138 PolarHBondContact N-NE2 3.26Å
124T96.9Very high96.4Very high4 Ų435.1 Ų35.13%0.02521%0.207CC..SBendtrans-86.6-6.2-169.958.20000114.2L132 A133 V143T124-L132 HydrophobicContact CG2-CG 4.49Å; T124-A133 HydrophobicContact CG2-CB 3.76Å; T124-V143 HydrophobicContact CG2-CG2 4.08Å
125G96.6Very high96.2Very high3 Ų337.1 Ų37.13%0.03121%0.214CC..THydrogen-bonded Turntrans73.6162-159.800000111.9T59 T127 V128T59-G125 WeakPolarHBondContact OG1-CA 3.44Å; T59-G125 PolarHBondContact OG1-N 2.76Å; G125-T127 PolarHBondContact O-N 3.25Å; G125-T127 VanDerWaalsContact O-N 3.08Å; G125-V128 PolarHBondContact O-N 2.8Å
126W96.8Very high95.9Very high30 Ų3047.7 Ų47.711%0.11426%0.255CS..THydrogen-bonded Turntrans-64.7-14.7-176.781.5-82.9000114.7A62 F63 I66 F235 W236A62-W126 HydrophobicContact CB-CB 3.58Å; A62-W126 HydrophobicContact CB-CG 3.99Å; F63-W126 HydrophobicContact CD1-CB 4.44Å; F63-W126 HydrophobicContact CE1-CB 4.15Å; F63-W126 WeakPolarHBondContact CE1-O 3.33Å; F63-W126 HydrophobicContact CE2-CB 4.43Å; F63-W126 HydrophobicContact CZ-CB 4.16Å; F63-W126 WeakPolarHBondContact CZ-O 3.2Å; I66-W126 HydrophobicContact CD1-CD2 4.49Å; I66-W126 HydrophobicContact CD1-CE3 4.16Å; I66-W126 HydrophobicContact CD1-CZ3 4.23Å; W126-F235 HydrophobicContact CD2-CZ 4.29Å; W126-F235 HydrophobicContact CE3-CE1 4.49Å; W126-F235 AromaticContact CE3-CZ 3.7Å; W126-F235 HydrophobicContact CE3-CZ 3.7Å; W126-F235 AromaticContact CH2-CE1 3.92Å; W126-F235 HydrophobicContact CH2-CE1 3.92Å; W126-F235 AromaticContact CH2-CZ 3.88Å; W126-F235 HydrophobicContact CH2-CZ 3.88Å; W126-F235 HydrophobicContact CZ2-CE1 4.33Å; W126-F235 HydrophobicContact CZ2-CZ 4.44Å; W126-F235 HydrophobicContact CZ3-CE1 4.02Å; W126-F235 AromaticContact CZ3-CZ 3.48Å; W126-F235 HydrophobicContact CZ3-CZ 3.48Å; W126-F235 VanDerWaalsContact CZ3-CZ 3.48Å; W126-W236 HydrophobicContact CH2-CH2 4.37Å; W126-W236 HydrophobicContact CH2-CZ3 4.12Å; W126-W236 AromaticContact CZ2-CH2 3.85Å; W126-W236 HydrophobicContact CZ2-CH2 3.85Å; W126-W236 HydrophobicContact CZ2-CZ3 4.02Å
127T96.8Very high95.9Very high0 Ų048.7 Ų48.70%026%0.259CS..THydrogen-bonded Turntrans-80.4-22.4175.9560000112.6G125 Y129 Y231 F235 W236G125-T127 PolarHBondContact O-N 3.25Å; G125-T127 VanDerWaalsContact O-N 3.08Å; T127-Y129 VanDerWaalsContact C-N 3.33Å; T127-Y129 HydrophobicContact CG2-CE1 4.23Å; T127-Y129 HydrophobicContact CG2-CE2 4.39Å; T127-Y129 PolarHBondContact O-N 3.46Å; T127-Y231 WeakPolarHBondContact O-CE1 3.39Å; T127-Y231 PolarHBondContact O-OH 3.39Å; T127-F235 HydrophobicContact CG2-CD1 4.33Å; T127-F235 HydrophobicContact CG2-CE1 3.69Å; T127-F235 HydrophobicContact CG2-CZ 4Å; T127-W236 HydrophobicContact CG2-CH2 4.27Å; T127-W236 HydrophobicContact CG2-CZ2 4.05Å
128V97.7Very high96Very high3 Ų342.1 Ų42.12%0.01823%0.227CC..THydrogen-bonded Turntrans55.345.4175.8-159.50000112.4F63 G125 A133 V143 L209 Y231F63-V128 HydrophobicContact CE2-CG2 4.18Å; F63-V128 HydrophobicContact CZ-CG2 3.63Å; G125-V128 PolarHBondContact O-N 2.8Å; V128-A133 HydrophobicContact CG1-CB 3.61Å; V128-A133 WeakPolarHBondContact O-CB 3.5Å; V128-V143 HydrophobicContact CG1-CG1 4.06Å; V128-L209 HydrophobicContact CG1-CD2 3.81Å; V128-Y231 VanDerWaalsContact O-CZ 3.31Å; V128-Y231 PolarHBondContact O-OH 3Å
129Y97.7Very high95.9Very high43 Ų4344 Ų4417%0.16924%0.24CC..  trans-70.7129.9-175.3-69.3-25.2000113T127 L132 A133 Y231 Q232 F235 W236T127-Y129 VanDerWaalsContact C-N 3.33Å; T127-Y129 HydrophobicContact CG2-CE1 4.23Å; T127-Y129 HydrophobicContact CG2-CE2 4.39Å; T127-Y129 PolarHBondContact O-N 3.46Å; Y129-L132 WeakPolarHBondContact O-CB 3.4Å; Y129-L132 PolarHBondContact O-N 3.4Å; Y129-A133 WeakPolarHBondContact O-CB 3.36Å; Y129-A133 PolarHBondContact O-N 3.34Å; Y129-Y231 AromaticContact CD1-CD1 3.57Å; Y129-Y231 HydrophobicContact CD1-CD1 3.57Å; Y129-Y231 AromaticContact CD1-CE1 3.61Å; Y129-Y231 HydrophobicContact CD1-CE1 3.61Å; Y129-Y231 HydrophobicContact CE1-CD1 4.1Å; Y129-Y231 HydrophobicContact CE1-CE1 4.12Å; Y129-Q232 HydrophobicContact CD1-CG 4.21Å; Y129-Q232 HydrophobicContact CE1-CB 4.47Å; Y129-Q232 HydrophobicContact CE1-CG 3.84Å; Y129-Q232 HydrophobicContact CE2-CG 4.39Å; Y129-F235 HydrophobicContact CE1-CD1 4.41Å; Y129-F235 HydrophobicContact CE1-CG 4.49Å; Y129-W236 AromaticContact CZ-NE1 3.96Å; Y129-W236 VanDerWaalsContact OH-CZ2 3.31Å; Y129-W236 WeakPolarHBondContact OH-CZ2 3.37Å; Y129-W236 PolarHBondContact OH-NE1 3.21Å
130P96.8Very high95.9Very high12 Ų1239.6 Ų39.68%0.07823%0.227CC..THydrogen-bonded Turntrans-67.6154157.229.6-31.2000110.3L132 L209 F220 Y231P130-L132 VanDerWaalsContact C-N 3.33Å; P130-L209 HydrophobicContact CB-CD1 4.15Å; P130-L209 HydrophobicContact CG-CD1 4.45Å; P130-F220 HydrophobicContact CB-CB 3.85Å; 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 4.44Å; P130-Y231 HydrophobicContact CG-CD2 4.05Å; P130-Y231 HydrophobicContact CG-CG 3.8Å
131P96.3Very high96.1Very high87 Ų8738.3 Ų38.357%0.56522%0.217SC*.THydrogen-bonded Turncis-79.2-8.40.933.2-36.2000113.8A133 G134P131-A133 VanDerWaalsContact C-N 3.28Å; P131-A133 PolarHBondContact O-N 2.89Å; P131-G134 WeakPolarHBondContact O-CA 3.24Å; P131-G134 PolarHBondContact O-N 2.81Å
132L97.2Very high96.2Very high77 Ų7738.4 Ų38.440%0.40322%0.217SC..THydrogen-bonded Turntrans-58.3-41.2-178.7-178.465.1000111.6T124 Y129 P130 G134 S137 H138T124-L132 HydrophobicContact CG2-CG 4.49Å; Y129-L132 WeakPolarHBondContact O-CB 3.4Å; Y129-L132 PolarHBondContact O-N 3.4Å; P130-L132 VanDerWaalsContact C-N 3.33Å; L132-G134 PolarHBondContact O-N 3.27Å; L132-S137 VanDerWaalsContact O-CB 3.25Å; L132-S137 WeakPolarHBondContact O-CB 3.24Å; L132-H138 PolarHBondContact O-ND1 3.41Å
133A97.5Very high96.2Very high0 Ų038.3 Ų38.30%022%0.217CC..THydrogen-bonded Turntrans-78.94.2175.800000114.3T124 V128 Y129 P131 V143 L209 R213T124-A133 HydrophobicContact CG2-CB 3.76Å; V128-A133 HydrophobicContact CG1-CB 3.61Å; V128-A133 WeakPolarHBondContact O-CB 3.5Å; Y129-A133 WeakPolarHBondContact O-CB 3.36Å; Y129-A133 PolarHBondContact O-N 3.34Å; P131-A133 VanDerWaalsContact C-N 3.28Å; P131-A133 PolarHBondContact O-N 2.89Å; A133-V143 HydrophobicContact CB-CG1 4.37Å; A133-L209 HydrophobicContact CB-CD1 4.42Å; A133-L209 HydrophobicContact CB-CD2 3.9Å; A133-R213 WeakPolarHBondContact O-CD 3.44Å; A133-R213 PolarHBondContact O-NH1 3.11Å
134G96.1Very high96.3Very high16 Ų1638.9 Ų38.917%0.16522%0.218CC..SBendtrans-83.9170.9174.700000112.9P131 L132 Y136 S137 H138 R213P131-G134 WeakPolarHBondContact O-CA 3.24Å; P131-G134 PolarHBondContact O-N 2.81Å; L132-G134 PolarHBondContact O-N 3.27Å; G134-Y136 PolarHBondContact O-N 2.83Å; G134-S137 PolarHBondContact O-N 2.75Å; G134-H138 PolarHBondContact O-N 3.5Å; G134-R213 VanDerWaalsContact C-NH1 3.26Å; G134-R213 PolarHBondContact O-NH1 2.82Å
135N93.9Very high96.4Very high72 Ų7240.4 Ų40.439%0.38523%0.226SC..THydrogen-bonded Turntrans-65.6-23.3-177.6-83.4-18.3000114.6S137 R213N135-S137 VanDerWaalsContact C-N 3.31Å; N135-S137 PolarHBondContact O-N 3.45Å; N135-R213 PolarHBondContact ND2-O 3.37Å; N135-R213 PolarHBondContact OD1-NH2 3.37Å
136Y92.1Very high96.5Very high226 Ų22640.3 Ų40.389%0.88623%0.225SC*.THydrogen-bonded Turntrans-65.2-37.4177.9-172.9-94.3000111.9G134G134-Y136 PolarHBondContact O-N 2.83Å
137S94.6Very high96.6Very high56 Ų5638.9 Ų38.939%0.39222%0.22SC..THydrogen-bonded Turntrans-103.8-35.8-176.5-62.50000113.6L132 G134 N135 P139L132-S137 VanDerWaalsContact O-CB 3.25Å; L132-S137 WeakPolarHBondContact O-CB 3.24Å; G134-S137 PolarHBondContact O-N 2.75Å; N135-S137 VanDerWaalsContact C-N 3.31Å; N135-S137 PolarHBondContact O-N 3.45Å; S137-P139 WeakPolarHBondContact O-CD 3.29Å
138H96.5Very high96.7Very high12 Ų1243.6 Ų43.66%0.05624%0.24CC..SBendtrans-122.879.8175-75.177.4000109.4H52 G123 L132 G134 V143 R213H52-H138 AromaticContact CE1-CD2 3.96Å; H52-H138 AromaticContact CE1-NE2 3.48Å; H52-H138 PolarHBondContact CE1-NE2 3.42Å; G123-H138 WeakPolarHBondContact CA-NE2 3.28Å; G123-H138 PolarHBondContact N-NE2 3.26Å; L132-H138 PolarHBondContact O-ND1 3.41Å; G134-H138 PolarHBondContact O-N 3.5Å; H138-V143 HydrophobicContact CB-CG2 3.72Å; H138-R213 PolarHBondContact O-NH1 2.93Å; H138-R213 PolarHBondContact O-NH2 3.46Å
139P92.1Very high96.7Very high90 Ų9043.4 Ų43.458%0.58424%0.239SC*.  trans-66.6147.717529.1-34.5000110.5S137S137-P139 WeakPolarHBondContact O-CD 3.29Å
140G94.8Very high96.8Very high29 Ų2941.8 Ų41.830%0.29923%0.233SC..SBendtrans86.7-162.817100000115.7E119 R213E119-G140 VanDerWaalsContact OE1-CA 3.26Å; E119-G140 WeakPolarHBondContact OE1-CA 3.47Å; E119-G140 WeakPolarHBondContact OE2-CA 3.3Å; G140-R213 PolarHBondContact O-NH2 2.86Å
141A97.1Very high96.9Very high37 Ų3743.4 Ų43.431%0.30624%0.24SC..SBendtrans-88.5-7.1-158.400000115.8V118 E119 V143 D144 L145V118-A141 HydrophobicContact CG1-CB 4.32Å; E119-A141 VanDerWaalsContact CD-N 3.34Å; E119-A141 PolarHBondContact OE1-N 3.13Å; E119-A141 PolarHBondContact OE2-N 2.98Å; A141-V143 PolarHBondContact O-N 3.24Å; A141-D144 WeakPolarHBondContact O-CB 3.46Å; A141-D144 PolarHBondContact O-N 2.84Å; A141-L145 WeakPolarHBondContact O-CG 3.23Å; A141-L145 PolarHBondContact O-N 2.99Å
142S98Very high97Very high2 Ų241.7 Ų41.71%0.01423%0.226CC..Hα-helixtrans-61.7-43.9-173.362.20000113.7S115 G121 T146S115-S142 VanDerWaalsContact CB-O 3.26Å; S115-S142 WeakPolarHBondContact CB-O 3.25Å; S115-S142 WeakPolarHBondContact O-CB 3.45Å; S115-S142 PolarHBondContact OG-O 2.84Å; G121-S142 PolarHBondContact O-OG 3.34Å; S142-T146 PolarHBondContact O-N 3Å; S142-T146 PolarHBondContact O-OG1 2.84Å
143V98.5Very high97Very high0 Ų038.1 Ų38.10%021%0.207CC..Hα-helixtrans-68.6-36.9175.51780000110.7A122 T124 V128 A133 H138 A141 L145 T146 I147A122-V143 HydrophobicContact CB-CG2 4.34Å; T124-V143 HydrophobicContact CG2-CG2 4.08Å; V128-V143 HydrophobicContact CG1-CG1 4.06Å; A133-V143 HydrophobicContact CB-CG1 4.37Å; H138-V143 HydrophobicContact CB-CG2 3.72Å; A141-V143 PolarHBondContact O-N 3.24Å; V143-L145 PolarHBondContact O-N 3.35Å; V143-T146 WeakPolarHBondContact O-CA 3.47Å; V143-T146 VanDerWaalsContact O-CB 3.27Å; V143-T146 WeakPolarHBondContact O-CB 3.35Å; V143-T146 PolarHBondContact O-N 3.24Å; V143-T146 VanDerWaalsContact O-N 3.13Å; V143-I147 HydrophobicContact CG1-CD1 4.07Å; V143-I147 HydrophobicContact CG1-CG1 4.46Å; V143-I147 WeakPolarHBondContact O-CG1 3.23Å; V143-I147 PolarHBondContact O-N 3.28Å
144D98.4Very high97.1Very high17 Ų1738.8 Ų38.89%0.09121%0.214CC..Hα-helixtrans-64.6-43.8179.7-60-9.9000111.4A141 T146 I147 F148 L210 R213 N214A141-D144 WeakPolarHBondContact O-CB 3.46Å; A141-D144 PolarHBondContact O-N 2.84Å; D144-T146 VanDerWaalsContact C-N 3.28Å; D144-T146 PolarHBondContact O-N 2.91Å; D144-I147 WeakPolarHBondContact O-CB 3.41Å; D144-I147 PolarHBondContact O-N 3.04Å; D144-I147 VanDerWaalsContact O-N 3.15Å; D144-F148 HydrophobicContact CB-CE2 4.39Å; D144-F148 WeakPolarHBondContact O-CD2 3.26Å; D144-F148 PolarHBondContact O-N 3.17Å; D144-L210 HydrophobicContact CB-CD1 3.95Å; D144-R213 IonicContact OD1-CZ 3.61Å; D144-R213 IonicContact OD1-NE 2.76Å; D144-R213 PolarHBondContact OD1-NE 3.3Å; D144-R213 IonicContact OD1-NH2 2.64Å; D144-N214 VanDerWaalsContact CG-ND2 3.33Å; D144-N214 PolarHBondContact OD1-ND2 3.39Å; D144-N214 PolarHBondContact OD2-ND2 2.88Å; D144-N214 PolarHBondContact OD2-OD1 3.36Å
145L98.6Very high97.2Very high36 Ų3641.2 Ų41.219%0.18823%0.225CC..Hα-helixtrans-61.3-37.1173.2-70.5175.3000112L111 A114 V118 A141 V143 F148 S149L111-L145 HydrophobicContact CD2-CD2 3.82Å; A114-L145 HydrophobicContact CB-CD1 4.22Å; V118-L145 HydrophobicContact CB-CD1 4.14Å; V118-L145 HydrophobicContact CG1-CD1 4.45Å; V118-L145 HydrophobicContact CG2-CD1 3.9Å; A141-L145 WeakPolarHBondContact O-CG 3.23Å; A141-L145 PolarHBondContact O-N 2.99Å; V143-L145 PolarHBondContact O-N 3.35Å; L145-F148 PolarHBondContact O-N 3.4Å; L145-S149 WeakPolarHBondContact O-CB 3.36Å; L145-S149 PolarHBondContact O-N 3.43Å
146T98.6Very high97.4Very high1 Ų138 Ų381%0.00621%0.208CC..Hα-helixtrans-62.8-45.2173.1-52.90000110.9F63 L112 S115 A122 S142 V143 D144 S149 L150F63-T146 HydrophobicContact CD2-CG2 4.2Å; F63-T146 HydrophobicContact CE2-CG2 3.62Å; F63-T146 HydrophobicContact CZ-CG2 4.13Å; L112-T146 HydrophobicContact CD1-CG2 4.21Å; S115-T146 WeakPolarHBondContact CB-OG1 3.18Å; S115-T146 PolarHBondContact OG-OG1 2.97Å; A122-T146 WeakPolarHBondContact CB-OG1 3.29Å; S142-T146 PolarHBondContact O-N 3Å; S142-T146 PolarHBondContact O-OG1 2.84Å; V143-T146 WeakPolarHBondContact O-CA 3.47Å; V143-T146 VanDerWaalsContact O-CB 3.27Å; V143-T146 WeakPolarHBondContact O-CB 3.35Å; V143-T146 PolarHBondContact O-N 3.24Å; V143-T146 VanDerWaalsContact O-N 3.13Å; D144-T146 VanDerWaalsContact C-N 3.28Å; D144-T146 PolarHBondContact O-N 2.91Å; T146-S149 WeakPolarHBondContact O-CB 3.4Å; T146-S149 PolarHBondContact O-N 3.17Å; T146-L150 HydrophobicContact CG2-CD1 4.49Å; T146-L150 WeakPolarHBondContact O-CG 3.45Å; T146-L150 PolarHBondContact O-N 3.4Å
147I98.8Very high97.7Very high1 Ų128.3 Ų28.31%0.00517%0.173CC..Hα-helixtrans-62-45.4177-68.5168.7000110.7V143 D144 S149 L150 H151 I206 L209 L210V143-I147 HydrophobicContact CG1-CD1 4.07Å; V143-I147 HydrophobicContact CG1-CG1 4.46Å; V143-I147 WeakPolarHBondContact O-CG1 3.23Å; V143-I147 PolarHBondContact O-N 3.28Å; D144-I147 WeakPolarHBondContact O-CB 3.41Å; D144-I147 PolarHBondContact O-N 3.04Å; D144-I147 VanDerWaalsContact O-N 3.15Å; I147-S149 PolarHBondContact O-N 2.98Å; I147-L150 PolarHBondContact O-N 3.37Å; I147-H151 WeakPolarHBondContact CG2-CE1 3.12Å; I147-H151 WeakPolarHBondContact CG2-ND1 3.33Å; I147-H151 PolarHBondContact O-N 3.44Å; I147-H151 PolarHBondContact O-ND1 2.84Å; I147-I206 HydrophobicContact CG1-CB 4.35Å; I147-I206 HydrophobicContact CG2-CB 4.09Å; I147-I206 HydrophobicContact CG2-CD1 4.2Å; I147-I206 HydrophobicContact CG2-CG1 4.17Å; I147-L209 HydrophobicContact CD1-CD2 4.16Å; I147-L209 HydrophobicContact CD1-CG 4.21Å; I147-L210 HydrophobicContact CD1-CB 4.1Å; I147-L210 HydrophobicContact CD1-CD1 4.19Å; I147-L210 HydrophobicContact CG2-CB 4.22Å; I147-L210 HydrophobicContact CG2-CD1 4.48Å; I147-L210 HydrophobicContact CG2-CD2 4.31Å
148F98.8Very high97.9Very high98 Ų9827.8 Ų27.843%0.4317%0.166SC..Hα-helixtrans-64.1-39.1176.8-69.9-54000112.7L111 D144 L145 L150 H151 L152 L210L111-F148 HydrophobicContact CD1-CB 3.96Å; D144-F148 HydrophobicContact CB-CE2 4.39Å; D144-F148 WeakPolarHBondContact O-CD2 3.26Å; D144-F148 PolarHBondContact O-N 3.17Å; L145-F148 PolarHBondContact O-N 3.4Å; F148-L150 PolarHBondContact O-N 2.93Å; F148-H151 PolarHBondContact O-N 3.18Å; F148-L152 PolarHBondContact O-N 3.05Å; F148-L210 HydrophobicContact CE1-CD2 3.92Å; F148-L210 HydrophobicContact CZ-CD2 3.97Å
149S98.8Very high98Very high0 Ų028.7 Ų28.70%017%0.171CC..Hα-helixtrans-54.7-52.5171.6164.80000110.9S108 L145 T146 I147 H151 L152 A153S108-S149 WeakPolarHBondContact O-CB 3.45Å; S108-S149 PolarHBondContact O-OG 3.31Å; S108-S149 PolarHBondContact OG-O 3.27Å; S108-S149 PolarHBondContact OG-OG 3.13Å; L145-S149 WeakPolarHBondContact O-CB 3.36Å; L145-S149 PolarHBondContact O-N 3.43Å; T146-S149 WeakPolarHBondContact O-CB 3.4Å; T146-S149 PolarHBondContact O-N 3.17Å; I147-S149 PolarHBondContact O-N 2.98Å; S149-H151 VanDerWaalsContact C-N 3.34Å; S149-H151 PolarHBondContact O-N 3.41Å; S149-L152 PolarHBondContact O-N 3.04Å; S149-A153 PolarHBondContact O-N 2.98Å
150L98.4Very high98.3Very high8 Ų824.7 Ų24.74%0.04215%0.146CC..Hα-helixtrans-64.3-35.5-178.7-66.9176.8000112.9F63 F67 T146 I147 F148 G154 I206F63-L150 HydrophobicContact CD1-CD2 3.76Å; F63-L150 HydrophobicContact CE1-CD1 3.74Å; F63-L150 HydrophobicContact CE1-CD2 3.72Å; F63-L150 HydrophobicContact CE1-CG 4.26Å; F63-L150 HydrophobicContact CZ-CD1 3.88Å; F67-L150 HydrophobicContact CD1-CD2 4.44Å; F67-L150 HydrophobicContact CD2-CD2 4.05Å; F67-L150 HydrophobicContact CE1-CD2 4.42Å; F67-L150 HydrophobicContact CE2-CD2 4Å; F67-L150 HydrophobicContact CG-CD2 4.29Å; F67-L150 HydrophobicContact CZ-CD2 4.2Å; T146-L150 HydrophobicContact CG2-CD1 4.49Å; T146-L150 WeakPolarHBondContact O-CG 3.45Å; T146-L150 PolarHBondContact O-N 3.4Å; I147-L150 PolarHBondContact O-N 3.37Å; F148-L150 PolarHBondContact O-N 2.93Å; L150-G154 PolarHBondContact O-N 3.06Å; L150-I206 HydrophobicContact CB-CD1 3.82Å
151H98.8Very high98.5Very high46 Ų4623.3 Ų23.321%0.21313%0.132CC..Hα-helixtrans-61.4-48.3172.6-79.395.9000112.1I147 F148 S149 A153 G154 V155 I206 T207I147-H151 WeakPolarHBondContact CG2-CE1 3.12Å; I147-H151 WeakPolarHBondContact CG2-ND1 3.33Å; I147-H151 PolarHBondContact O-N 3.44Å; I147-H151 PolarHBondContact O-ND1 2.84Å; F148-H151 PolarHBondContact O-N 3.18Å; S149-H151 VanDerWaalsContact C-N 3.34Å; S149-H151 PolarHBondContact O-N 3.41Å; H151-A153 PolarHBondContact O-N 3.5Å; H151-G154 PolarHBondContact O-N 3.42Å; H151-V155 WeakPolarHBondContact O-CG2 3.29Å; H151-V155 PolarHBondContact O-N 2.99Å; H151-I206 VanDerWaalsContact CE1-CD1 3.48Å; H151-I206 WeakPolarHBondContact CE1-CD1 3.3Å; H151-I206 VanDerWaalsContact CE1-CG1 3.41Å; H151-I206 WeakPolarHBondContact CE1-CG1 3.32Å; H151-T207 PolarHBondContact NE2-OG1 3.46Å
152L98.6Very high98.5Very high52 Ų5224.3 Ų24.327%0.27213%0.132SC..Hα-helixtrans-63.6-41.7179.3-70.9-174.5000112.1L104 P107 L111 F148 S149 G154 V155 S156L104-L152 HydrophobicContact CD2-CD2 4.27Å; P107-L152 HydrophobicContact CB-CD1 4.36Å; P107-L152 HydrophobicContact CG-CD1 4.48Å; L111-L152 HydrophobicContact CD1-CD1 3.65Å; L111-L152 HydrophobicContact CD1-CG 4.49Å; F148-L152 PolarHBondContact O-N 3.05Å; S149-L152 PolarHBondContact O-N 3.04Å; L152-G154 VanDerWaalsContact C-N 3.34Å; L152-V155 PolarHBondContact O-N 3.22Å; L152-S156 PolarHBondContact O-N 3.28Å
153A98.5Very high98.6Very high2 Ų224.2 Ų24.22%0.01713%0.131CC..Hα-helixtrans-62.2-41.6173.800000111.6F68 L105 S108 S149 H151 S156 S157F68-A153 HydrophobicContact CZ-CB 4.43Å; L105-A153 HydrophobicContact CD2-CB 4.41Å; S108-A153 PolarHBondContact OG-N 2.93Å; S149-A153 PolarHBondContact O-N 2.98Å; H151-A153 PolarHBondContact O-N 3.5Å; A153-S156 VanDerWaalsContact O-CB 3.32Å; A153-S156 WeakPolarHBondContact O-CB 3.14Å; A153-S156 PolarHBondContact O-N 3.36Å; A153-S157 PolarHBondContact O-N 3.02Å; A153-S157 PolarHBondContact O-OG 3.23Å
154G98.2Very high98.6Very high13 Ų1324.3 Ų24.313%0.13413%0.131CC..Hα-helixtrans-62.1-44.8176.100000112.8L150 H151 L152 S156 S157 I158L150-G154 PolarHBondContact O-N 3.06Å; H151-G154 PolarHBondContact O-N 3.42Å; L152-G154 VanDerWaalsContact C-N 3.34Å; G154-S156 PolarHBondContact O-N 3.42Å; G154-S157 PolarHBondContact O-N 2.66Å; G154-I158 WeakPolarHBondContact O-CG1 3.37Å; G154-I158 PolarHBondContact O-N 3.39Å
155V98.6Very high98.6Very high68 Ų6824.9 Ų24.941%0.41213%0.134SC..Hα-helixtrans-61.9-43.9175.4175.60000110.8L104 H151 L152 S157 I158 L159L104-V155 HydrophobicContact CD1-CB 4.2Å; L104-V155 HydrophobicContact CD1-CG1 3.66Å; H151-V155 WeakPolarHBondContact O-CG2 3.29Å; H151-V155 PolarHBondContact O-N 2.99Å; L152-V155 PolarHBondContact O-N 3.22Å; V155-S157 VanDerWaalsContact C-N 3.33Å; V155-S157 PolarHBondContact O-N 3.03Å; V155-I158 PolarHBondContact O-N 3Å; 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 3.49Å; V155-L159 PolarHBondContact O-N 3.48Å
156S98.6Very high98.6Very high4 Ų424.7 Ų24.73%0.02814%0.135CC..Hα-helixtrans-51.1-52.3172.6153.90000111.4S101 L152 A153 G154 L159 G160S101-S156 VanDerWaalsContact CB-O 3.29Å; S101-S156 WeakPolarHBondContact CB-O 3.34Å; S101-S156 WeakPolarHBondContact O-CB 3.18Å; S101-S156 PolarHBondContact O-OG 2.79Å; L152-S156 PolarHBondContact O-N 3.28Å; A153-S156 VanDerWaalsContact O-CB 3.32Å; A153-S156 WeakPolarHBondContact O-CB 3.14Å; A153-S156 PolarHBondContact O-N 3.36Å; G154-S156 PolarHBondContact O-N 3.42Å; S156-L159 PolarHBondContact O-N 3.36Å; S156-G160 PolarHBondContact O-N 3.24Å
157S98.2Very high98.6Very high22 Ų2224.7 Ų24.715%0.15413%0.134CC..Hα-helixtrans-68.6-36.1-176.3-65.10000113.5A153 G154 V155 G160 A161A153-S157 PolarHBondContact O-N 3.02Å; A153-S157 PolarHBondContact O-OG 3.23Å; G154-S157 PolarHBondContact O-N 2.66Å; V155-S157 VanDerWaalsContact C-N 3.33Å; V155-S157 PolarHBondContact O-N 3.03Å; S157-G160 PolarHBondContact O-N 2.85Å; S157-A161 VanDerWaalsContact O-CB 3.3Å; S157-A161 WeakPolarHBondContact O-CB 3.37Å; S157-A161 PolarHBondContact O-N 3.02Å
158I98.5Very high98.6Very high45 Ų4524.6 Ų24.623%0.23113%0.134CC..Hα-helixtrans-65.3-45.5175.4-69.4168.5000111G154 V155 G160 A161 I162 L196 L199G154-I158 WeakPolarHBondContact O-CG1 3.37Å; G154-I158 PolarHBondContact O-N 3.39Å; V155-I158 PolarHBondContact O-N 3Å; I158-G160 VanDerWaalsContact C-N 3.33Å; I158-G160 PolarHBondContact O-N 3.47Å; I158-A161 PolarHBondContact O-N 3.45Å; I158-I162 HydrophobicContact CG2-CD1 3.96Å; I158-I162 WeakPolarHBondContact O-CG1 3.2Å; I158-I162 PolarHBondContact O-N 3.49Å; I158-L196 HydrophobicContact CG2-CD1 4.15Å; I158-L199 HydrophobicContact CD1-CB 4.06Å; I158-L199 HydrophobicContact CG1-CB 4.09Å; I158-L199 HydrophobicContact CG1-CD1 3.86Å
159L98.6Very high98.5Very high31 Ų3124.1 Ų24.116%0.16214%0.135CC..Hα-helixtrans-61.1-44176.8-68.6178.5000111.2M97 M100 L104 V155 S156 N163M97-L159 HydrophobicContact CE-CD2 4.37Å; M97-L159 HydrophobicContact CG-CB 3.86Å; M97-L159 HydrophobicContact CG-CD2 3.96Å; M97-L159 HydrophobicContact CG-CG 4.35Å; M97-L159 HydrophobicContact SD-CB 4.31Å; M97-L159 HydrophobicContact SD-CD2 4.05Å; M100-L159 HydrophobicContact CE-CD1 4.43Å; M100-L159 HydrophobicContact CG-CD1 4.14Å; M100-L159 HydrophobicContact SD-CD1 4.17Å; L104-L159 HydrophobicContact CD1-CD1 4.05Å; 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 3.49Å; V155-L159 PolarHBondContact O-N 3.48Å; S156-L159 PolarHBondContact O-N 3.36Å; L159-N163 WeakPolarHBondContact O-CB 3.31Å; L159-N163 PolarHBondContact O-N 3.04Å; L159-N163 VanDerWaalsContact O-N 3.17Å
160G98.4Very high98.3Very high6 Ų629.6 Ų29.66%0.06216%0.164CC..Hα-helixtrans-59.7-45.8173.500000112.5S156 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 3.47Å; G160-I162 PolarHBondContact O-N 3.17Å; G160-N163 WeakPolarHBondContact O-CB 3.23Å; G160-N163 PolarHBondContact O-N 3Å; G160-F164 WeakPolarHBondContact O-CD2 3.39Å; G160-F164 PolarHBondContact O-N 3.5Å
161A98.7Very high98.2Very high1 Ų132 Ų321%0.00818%0.176CC..Hα-helixtrans-60.4-46.7179.700000112.8S157 I158 N163 F164 I165 A192 L195S157-A161 VanDerWaalsContact O-CB 3.3Å; S157-A161 WeakPolarHBondContact O-CB 3.37Å; S157-A161 PolarHBondContact O-N 3.02Å; I158-A161 PolarHBondContact O-N 3.45Å; A161-N163 VanDerWaalsContact C-N 3.26Å; A161-N163 PolarHBondContact O-N 2.94Å; A161-F164 PolarHBondContact O-N 2.89Å; A161-I165 WeakPolarHBondContact O-CB 3.48Å; A161-I165 WeakPolarHBondContact O-CD1 3.23Å; A161-I165 VanDerWaalsContact O-CG1 3.26Å; A161-I165 WeakPolarHBondContact O-CG1 3.41Å; A161-I165 PolarHBondContact O-N 3.42Å; A161-A192 HydrophobicContact CB-CB 4.07Å; A161-A192 WeakPolarHBondContact CB-O 3.27Å; A161-L195 HydrophobicContact CB-CB 4.05Å
162I98.8Very high97.9Very high58 Ų5831.2 Ų31.230%0.29717%0.172SC..Hα-helixtrans-57.7-43.7176-67.8166.1000110.3F94 M97 I158 G160 T166 L196F94-I162 HydrophobicContact CD2-CG2 4.47Å; F94-I162 HydrophobicContact CE2-CG2 4.1Å; M97-I162 HydrophobicContact SD-CB 4.42Å; M97-I162 HydrophobicContact SD-CG2 4.3Å; I158-I162 HydrophobicContact CG2-CD1 3.96Å; I158-I162 WeakPolarHBondContact O-CG1 3.2Å; I158-I162 PolarHBondContact O-N 3.49Å; G160-I162 PolarHBondContact O-N 3.17Å; I162-T166 WeakPolarHBondContact O-CB 3.38Å; I162-T166 PolarHBondContact O-N 3.43Å; I162-T166 PolarHBondContact O-OG1 2.9Å; I162-L196 HydrophobicContact CD1-CD1 4.44Å; I162-L196 HydrophobicContact CG1-CD1 4.06Å
163N98.7Very high97.4Very high0 Ų029.3 Ų29.30%016%0.162CC..Hα-helixtrans-66.2-45.1179.3-168.522.9000112.5M92 A93 F94 N98 L159 G160 A161 T166 T167M92-N163 HydrophobicContact CE-CB 4.29Å; M92-N163 WeakPolarHBondContact CE-ND2 3.33Å; A93-N163 PolarHBondContact N-OD1 3.46Å; F94-N163 HydrophobicContact CD2-CB 4.29Å; F94-N163 PolarHBondContact N-OD1 3.2Å; N98-N163 VanDerWaalsContact CB-ND2 3.34Å; N98-N163 WeakPolarHBondContact CB-ND2 3.39Å; N98-N163 PolarHBondContact OD1-ND2 2.91Å; L159-N163 WeakPolarHBondContact O-CB 3.31Å; L159-N163 PolarHBondContact O-N 3.04Å; L159-N163 VanDerWaalsContact O-N 3.17Å; G160-N163 WeakPolarHBondContact O-CB 3.23Å; G160-N163 PolarHBondContact O-N 3Å; A161-N163 VanDerWaalsContact C-N 3.26Å; A161-N163 PolarHBondContact O-N 2.94Å; N163-T166 PolarHBondContact O-N 2.86Å; N163-T167 VanDerWaalsContact O-CB 3.27Å; N163-T167 WeakPolarHBondContact O-CB 3.34Å; N163-T167 PolarHBondContact O-N 3.31Å; N163-T167 PolarHBondContact O-OG1 2.99Å; N163-T167 PolarHBondContact OD1-OG1 3.36Å
164F98.8Very high96.7Very high2 Ų235.6 Ų35.61%0.00920%0.203CC..Hα-helixtrans-61.5-48.1175.8-79.5-61000112.3I75 G79 V83 M92 G160 A161 T166 T167 I168 V188 A192I75-F164 HydrophobicContact CG2-CD2 4.11Å; I75-F164 HydrophobicContact CG2-CE2 3.6Å; I75-F164 HydrophobicContact CG2-CZ 4.44Å; I75-F164 VanDerWaalsContact O-CZ 3.29Å; I75-F164 WeakPolarHBondContact O-CZ 3.5Å; G79-F164 VanDerWaalsContact C-CE1 3.46Å; V83-F164 HydrophobicContact CB-CD1 4.41Å; V83-F164 HydrophobicContact CB-CE1 4.3Å; V83-F164 HydrophobicContact CG1-CD1 4.41Å; V83-F164 HydrophobicContact CG2-CD1 4.23Å; V83-F164 HydrophobicContact CG2-CE1 4.15Å; M92-F164 HydrophobicContact CE-CD1 3.48Å; M92-F164 VanDerWaalsContact CE-CD1 3.48Å; M92-F164 HydrophobicContact CE-CE1 3.54Å; M92-F164 HydrophobicContact CE-CG 4.04Å; M92-F164 HydrophobicContact CE-CZ 4.18Å; M92-F164 HydrophobicContact SD-CD1 4.37Å; M92-F164 HydrophobicContact SD-CE1 4.18Å; G160-F164 WeakPolarHBondContact O-CD2 3.39Å; G160-F164 PolarHBondContact O-N 3.5Å; A161-F164 PolarHBondContact O-N 2.89Å; F164-T166 VanDerWaalsContact C-N 3.33Å; F164-T166 PolarHBondContact O-N 3.48Å; F164-T167 PolarHBondContact O-N 3.33Å; F164-I168 WeakPolarHBondContact O-CB 3.21Å; F164-I168 VanDerWaalsContact O-CG1 3.23Å; F164-I168 WeakPolarHBondContact O-CG1 3.37Å; F164-I168 PolarHBondContact O-N 3Å; F164-V188 HydrophobicContact CB-CG1 4.26Å; F164-V188 HydrophobicContact CD1-CG1 3.73Å; F164-V188 HydrophobicContact CD2-CG1 4.31Å; F164-V188 HydrophobicContact CE1-CG1 4.18Å; F164-V188 HydrophobicContact CG-CG1 3.84Å; F164-A192 HydrophobicContact CB-CB 4.03Å
165I98.8Very high96.2Very high29 Ų2938 Ų3815%0.14922%0.222CC..Hα-helixtrans-57.1-50.1178.7-68.7164.2000110A161 T167 I168 I169 L189 A192 V193 L196A161-I165 WeakPolarHBondContact O-CB 3.48Å; A161-I165 WeakPolarHBondContact O-CD1 3.23Å; A161-I165 VanDerWaalsContact O-CG1 3.26Å; A161-I165 WeakPolarHBondContact O-CG1 3.41Å; A161-I165 PolarHBondContact O-N 3.42Å; I165-T167 PolarHBondContact O-N 2.77Å; I165-I168 PolarHBondContact O-N 3.06Å; I165-I169 HydrophobicContact CG2-CD1 3.71Å; I165-I169 WeakPolarHBondContact O-CB 3.28Å; I165-I169 VanDerWaalsContact O-CG1 3.29Å; I165-I169 WeakPolarHBondContact O-CG1 3.29Å; I165-I169 PolarHBondContact O-N 2.73Å; I165-L189 HydrophobicContact CG1-CD1 4.21Å; I165-A192 HydrophobicContact CD1-CB 4.18Å; I165-A192 HydrophobicContact CG1-CB 3.75Å; I165-V193 HydrophobicContact CD1-CG2 4.08Å; I165-V193 HydrophobicContact CG1-CG2 4.29Å; I165-L196 HydrophobicContact CD1-CD2 3.96Å
166T98.6Very high95.7Very high32 Ų3235.3 Ų35.320%0.19621%0.205CC..Hα-helixtrans-63.8-43.5-177.9-53.10000111.6A93 F94 I162 N163 F164 N170A93-T166 HydrophobicContact CB-CG2 3.74Å; F94-T166 HydrophobicContact CE2-CG2 3.75Å; F94-T166 WeakPolarHBondContact CE2-OG1 3.23Å; F94-T166 HydrophobicContact CZ-CG2 3.73Å; I162-T166 WeakPolarHBondContact O-CB 3.38Å; I162-T166 PolarHBondContact O-N 3.43Å; I162-T166 PolarHBondContact O-OG1 2.9Å; N163-T166 PolarHBondContact O-N 2.86Å; F164-T166 VanDerWaalsContact C-N 3.33Å; F164-T166 PolarHBondContact O-N 3.48Å; T166-N170 WeakPolarHBondContact CG2-ND2 3.38Å; T166-N170 VanDerWaalsContact O-CB 3.28Å; T166-N170 WeakPolarHBondContact O-CB 3.14Å; T166-N170 PolarHBondContact O-N 2.96Å; T166-N170 PolarHBondContact O-ND2 3.41Å
167T98.3Very high95.4Very high0 Ų038.7 Ų38.70%023%0.226CC..Hα-helixtrans-62.8-51.4179.1-56.90000110.9I87 M92 A93 N163 F164 I165 I169 M171I87-T167 HydrophobicContact CD1-CG2 4Å; M92-T167 HydrophobicContact SD-CG2 3.91Å; A93-T167 WeakPolarHBondContact CB-OG1 3.37Å; A93-T167 PolarHBondContact N-OG1 3.36Å; N163-T167 VanDerWaalsContact O-CB 3.27Å; N163-T167 WeakPolarHBondContact O-CB 3.34Å; N163-T167 PolarHBondContact O-N 3.31Å; N163-T167 PolarHBondContact O-OG1 2.99Å; N163-T167 PolarHBondContact OD1-OG1 3.36Å; F164-T167 PolarHBondContact O-N 3.33Å; I165-T167 PolarHBondContact O-N 2.77Å; T167-I169 VanDerWaalsContact C-N 3.35Å; T167-I169 PolarHBondContact O-N 3.06Å; T167-M171 HydrophobicContact CG2-CB 4.37Å; T167-M171 HydrophobicContact CG2-SD 4Å; T167-M171 WeakPolarHBondContact O-CB 3.4Å; T167-M171 PolarHBondContact O-N 3.47Å
168I98.3Very high95.2Very high0 Ų039.8 Ų39.80%023%0.228CC..Hα-helixtrans-65.3-38.7-176.4-66.5170000111.3V83 F164 I165 K172 V185 V188 L189V83-I168 HydrophobicContact CG1-CD1 4.01Å; V83-I168 HydrophobicContact CG1-CG1 3.53Å; F164-I168 WeakPolarHBondContact O-CB 3.21Å; F164-I168 VanDerWaalsContact O-CG1 3.23Å; F164-I168 WeakPolarHBondContact O-CG1 3.37Å; F164-I168 PolarHBondContact O-N 3Å; I165-I168 PolarHBondContact O-N 3.06Å; I168-K172 WeakPolarHBondContact O-CD 3.36Å; I168-K172 VanDerWaalsContact O-CG 3.23Å; I168-K172 WeakPolarHBondContact O-CG 3.47Å; I168-K172 PolarHBondContact O-NZ 2.99Å; I168-V185 HydrophobicContact CB-CG1 4.37Å; I168-V185 HydrophobicContact CD1-CG1 3.94Å; I168-V185 HydrophobicContact CG1-CG1 3.85Å; I168-V185 HydrophobicContact CG2-CG1 3.65Å; I168-V188 HydrophobicContact CD1-CB 4.42Å; I168-V188 HydrophobicContact CD1-CG1 4.24Å; I168-L189 HydrophobicContact CB-CD1 4.4Å; I168-L189 HydrophobicContact CD1-CB 3.91Å; I168-L189 HydrophobicContact CG2-CB 4.29Å; I168-L189 HydrophobicContact CG2-CD1 4.29Å; I168-L189 HydrophobicContact CG2-CD2 4.09Å; I168-L189 HydrophobicContact CG2-CG 4.46Å
169I96.7Very high94.8Very high87 Ų8742.7 Ų42.745%0.44624%0.237SC..Hα-helixtrans-75.7-45.6-178.1-64.9175.4000110.8I165 T167 K172 L189I165-I169 HydrophobicContact CG2-CD1 3.71Å; I165-I169 WeakPolarHBondContact O-CB 3.28Å; I165-I169 VanDerWaalsContact O-CG1 3.29Å; I165-I169 WeakPolarHBondContact O-CG1 3.29Å; I165-I169 PolarHBondContact O-N 2.73Å; T167-I169 VanDerWaalsContact C-N 3.35Å; T167-I169 PolarHBondContact O-N 3.06Å; I169-K172 PolarHBondContact O-NZ 3.14Å; I169-L189 HydrophobicContact CG1-CD1 4.49Å
170N96.3Very high94.4Very high115 Ų11545 Ų4562%0.61525%0.247SC*.Hα-helixtrans-103-21.5-164.1-60.5-41.7000115.6T166T166-N170 WeakPolarHBondContact CG2-ND2 3.38Å; T166-N170 VanDerWaalsContact O-CB 3.28Å; T166-N170 WeakPolarHBondContact O-CB 3.14Å; T166-N170 PolarHBondContact O-N 2.96Å; T166-N170 PolarHBondContact O-ND2 3.41Å
171M95.1Very high94.2Very high58 Ų5844.7 Ų44.729%0.28624%0.244SC..SBendtrans-101.58.7-171.7-60.5-173.369.300114.5A89 D91 A93 T167A89-M171 HydrophobicContact CB-CB 4.01Å; A89-M171 HydrophobicContact CB-CE 4.45Å; D91-M171 WeakPolarHBondContact O-CE 3.29Å; A93-M171 WeakPolarHBondContact CA-SD 3.33Å; A93-M171 HydrophobicContact CB-CG 4.45Å; A93-M171 HydrophobicContact CB-SD 3.61Å; A93-M171 PolarHBondContact N-SD 3.34Å; T167-M171 HydrophobicContact CG2-CB 4.37Å; T167-M171 HydrophobicContact CG2-SD 4Å; T167-M171 WeakPolarHBondContact O-CB 3.4Å; T167-M171 PolarHBondContact O-N 3.47Å
172K91.9Very high94Very high31 Ų3146.3 Ų46.314%0.13525%0.254CS..SBendtrans-70.4150.2173.2-56.5-171.9-64.2-79.40110.6I87 I168 I169 M176 T181I87-K172 HydrophobicContact CB-CG 4.18Å; I87-K172 HydrophobicContact CD1-CG 4.38Å; I87-K172 HydrophobicContact CG2-CG 4.45Å; I168-K172 WeakPolarHBondContact O-CD 3.36Å; I168-K172 VanDerWaalsContact O-CG 3.23Å; I168-K172 WeakPolarHBondContact O-CG 3.47Å; I168-K172 PolarHBondContact O-NZ 2.99Å; I169-K172 PolarHBondContact O-NZ 3.14Å; K172-M176 HydrophobicContact CB-CB 4.49Å; K172-M176 HydrophobicContact CB-SD 4.44Å; K172-M176 HydrophobicContact CD-CG 4.4Å; K172-M176 HydrophobicContact CD-SD 4.07Å; K172-M176 HydrophobicContact CG-SD 4.45Å; K172-T181 HydrophobicContact CD-CG2 3.39Å
173P88.9Confident93.9Very high11 Ų1143.8 Ų43.87%0.07124%0.241CC..  trans-52.5140167.3-27.132.7000110.8I87 A175 M176 V509I87-P173 WeakPolarHBondContact O-CD 3.11Å; P173-A175 PolarHBondContact O-N 2.79Å; P173-M176 PolarHBondContact O-N 3.34Å; P173-V509 HydrophobicContact CG-CB 4.46Å
174P85.1Confident93.9Very high134 Ų13443.8 Ų43.887%0.8724%0.241SC*.THydrogen-bonded Turntrans-55.7-25.3-177.4-28.334.9000115
175A86.3Confident93.9Very high64 Ų6443.7 Ų43.753%0.52924%0.241SC..THydrogen-bonded Turntrans-79.5-16.7178.200000114P173P173-A175 PolarHBondContact O-N 2.79Å
176M89.5Confident93.8Very high12 Ų1243 Ų436%0.05924%0.237CC..  trans-90.5111.5-178-177.9-175.9-79.300110.5K172 P173 Q180 T181 L492 M511K172-M176 HydrophobicContact CB-CB 4.49Å; K172-M176 HydrophobicContact CB-SD 4.44Å; K172-M176 HydrophobicContact CD-CG 4.4Å; K172-M176 HydrophobicContact CD-SD 4.07Å; K172-M176 HydrophobicContact CG-SD 4.45Å; P173-M176 PolarHBondContact O-N 3.34Å; M176-Q180 HydrophobicContact CG-CB 4.25Å; M176-T181 HydrophobicContact CG-CG2 4.42Å; M176-T181 HydrophobicContact SD-CG2 3.94Å; M176-L492 HydrophobicContact CE-CD1 4.21Å; M176-M511 HydrophobicContact CE-CE 3.63Å; M176-M511 HydrophobicContact CE-SD 4.17Å
177T91.8Very high93.8Very high75 Ų7541.5 Ų41.546%0.4623%0.227SC..  trans-73.6160.7170.6690000111.1Y179 Q180T177-Y179 PolarHBondContact O-N 2.97Å; T177-Q180 PolarHBondContact O-N 3.48Å; T177-Q180 WeakPolarHBondContact OG1-CG 3.1Å; T177-Q180 PolarHBondContact OG1-OE1 3.07Å
178Q92.6Very high93.9Very high45 Ų4541.5 Ų41.521%0.2123%0.227CC..G310 helixtrans-60.2-35.6178.6-173.657.736.700112.5Q180 T181 W186Q178-Q180 PolarHBondContact O-N 3.3Å; Q178-T181 PolarHBondContact NE2-OG1 3.36Å; Q178-T181 PolarHBondContact O-N 3.13Å; Q178-T181 PolarHBondContact O-OG1 2.85Å; Q178-W186 HydrophobicContact CB-CZ2 4.44Å; Q178-W186 HydrophobicContact CG-CH2 3.5Å; Q178-W186 HydrophobicContact CG-CZ2 3.53Å; Q178-W186 HydrophobicContact CG-CZ3 4.29Å; Q178-W186 WeakPolarHBondContact O-CZ2 3.38Å; Q178-W186 PolarHBondContact O-NE1 3.05Å
179Y91.1Very high93.9Very high105 Ų10542.4 Ų42.441%0.41223%0.232SC..G310 helixtrans-73-6.7176.4-68.3-66.9000114T177 W186 Y270 M271T177-Y179 PolarHBondContact O-N 2.97Å; Y179-W186 AromaticContact CD1-CZ2 3.94Å; Y179-W186 HydrophobicContact CD1-CZ2 3.94Å; Y179-W186 HydrophobicContact CE1-CH2 4.48Å; Y179-W186 HydrophobicContact CE1-CZ2 4.23Å; Y179-Y270 WeakPolarHBondContact O-CE1 3.32Å; Y179-Y270 PolarHBondContact O-OH 2.93Å; Y179-M271 HydrophobicContact CD1-CE 3.5Å; Y179-M271 VanDerWaalsContact CD1-CE 3.5Å; Y179-M271 HydrophobicContact CD1-SD 3.72Å; Y179-M271 HydrophobicContact CE1-CE 3.66Å; Y179-M271 HydrophobicContact CE1-SD 4.43Å; Y179-M271 HydrophobicContact CG-CE 4.07Å; Y179-M271 HydrophobicContact CG-SD 4.21Å
180Q90.2Very high94Very high80 Ų8039 Ų3937%0.37422%0.215SC..G310 helixtrans-98.53.6172.9-69.6163.7-51.600112.6M176 T177 Q178M176-Q180 HydrophobicContact CG-CB 4.25Å; T177-Q180 PolarHBondContact O-N 3.48Å; T177-Q180 WeakPolarHBondContact OG1-CG 3.1Å; T177-Q180 PolarHBondContact OG1-OE1 3.07Å; Q178-Q180 PolarHBondContact O-N 3.3Å
181T93.8Very high94.1Very high0 Ų033.5 Ų33.50%019%0.185CC..SBendtrans-76.7144.2178.559.60000111.9K172 M176 Q178 W186 Y270K172-T181 HydrophobicContact CD-CG2 3.39Å; M176-T181 HydrophobicContact CG-CG2 4.42Å; M176-T181 HydrophobicContact SD-CG2 3.94Å; Q178-T181 PolarHBondContact NE2-OG1 3.36Å; Q178-T181 PolarHBondContact O-N 3.13Å; Q178-T181 PolarHBondContact O-OG1 2.85Å; T181-W186 VanDerWaalsContact OG1-CD1 3.25Å; T181-W186 PolarHBondContact OG1-NE1 3.25Å; T181-W186 VanDerWaalsContact OG1-NE1 3.08Å; T181-Y270 PolarHBondContact O-OH 3.32Å
182P95.1Very high94.3Very high34 Ų3430.8 Ų30.822%0.22117%0.172CC..  trans-61.9153.7-178.9-24.535.1000113.7M86 F184 V185 W186 H256M86-P182 HydrophobicContact CB-CG 4.2Å; P182-F184 PolarHBondContact O-N 3.48Å; P182-V185 HydrophobicContact CB-CG2 4.41Å; P182-V185 HydrophobicContact CG-CG2 4.46Å; P182-V185 WeakPolarHBondContact O-CA 3.39Å; P182-V185 WeakPolarHBondContact O-CB 3.44Å; P182-V185 PolarHBondContact O-N 3.46Å; P182-W186 PolarHBondContact O-N 3.46Å; P182-W186 VanDerWaalsContact O-N 3.09Å; P182-H256 WeakPolarHBondContact CB-CE1 3.3Å; P182-H256 VanDerWaalsContact CB-NE2 3.28Å; P182-H256 WeakPolarHBondContact CB-NE2 3.46Å
183L97Very high94.6Very high5 Ų532.2 Ų32.23%0.02618%0.183CC..Hα-helixtrans-61.9-28.8-176-71.3-177000113.4S187 P267 Y270 M273 V274 M277L183-S187 WeakPolarHBondContact O-CB 3.31Å; L183-S187 PolarHBondContact O-N 2.92Å; L183-S187 PolarHBondContact O-OG 3.5Å; L183-P267 HydrophobicContact CD1-CB 4.37Å; L183-P267 HydrophobicContact CD1-CG 3.49Å; L183-P267 VanDerWaalsContact CD1-CG 3.49Å; L183-P267 HydrophobicContact CG-CG 4.33Å; L183-Y270 HydrophobicContact CD1-CD2 4.38Å; 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 3.81Å; L183-Y270 HydrophobicContact CG-CE2 3.82Å; L183-M273 HydrophobicContact CD1-CB 3.96Å; L183-M273 HydrophobicContact CD1-CE 3.69Å; L183-M273 HydrophobicContact CD1-CG 4.43Å; L183-M273 HydrophobicContact CD1-SD 3.57Å; L183-M273 VanDerWaalsContact CD1-SD 3.57Å; L183-M273 HydrophobicContact CD2-CB 4.14Å; L183-V274 HydrophobicContact CD2-CG2 3.59Å; L183-M277 HydrophobicContact CB-CE 4.49Å; L183-M277 HydrophobicContact CD2-CE 3.78Å
184F97.9Very high95Very high0 Ų031.9 Ų31.90%018%0.181CC..Hα-helixtrans-63.4-44.1171.6-179-103.2000111.7F78 L82 V83 M86 P182 W186 S187 V188 P249 M253 H256F78-F184 HydrophobicContact CB-CE2 4.36Å; F78-F184 HydrophobicContact CB-CZ 3.78Å; L82-F184 HydrophobicContact CB-CD1 4.07Å; L82-F184 HydrophobicContact CB-CE1 3.74Å; L82-F184 HydrophobicContact CD1-CD1 4.31Å; L82-F184 HydrophobicContact CD1-CE1 4.01Å; L82-F184 HydrophobicContact CD1-CZ 4.3Å; L82-F184 HydrophobicContact CG-CE1 4.46Å; V83-F184 HydrophobicContact CG2-CE1 4.21Å; M86-F184 HydrophobicContact CE-CD1 4.44Å; M86-F184 HydrophobicContact SD-CB 4Å; M86-F184 HydrophobicContact SD-CD1 3.74Å; M86-F184 HydrophobicContact SD-CG 4.27Å; P182-F184 PolarHBondContact O-N 3.48Å; F184-W186 PolarHBondContact O-N 2.82Å; F184-S187 WeakPolarHBondContact CA-OG 3.27Å; F184-S187 PolarHBondContact O-N 3.35Å; F184-S187 VanDerWaalsContact O-N 3.14Å; F184-S187 PolarHBondContact O-OG 3.14Å; F184-V188 HydrophobicContact CD1-CG2 4.29Å; F184-V188 HydrophobicContact CE1-CG2 3.79Å; F184-V188 HydrophobicContact CE2-CG2 4.09Å; F184-V188 HydrophobicContact CZ-CG2 3.68Å; F184-V188 WeakPolarHBondContact O-CG2 3.48Å; F184-V188 PolarHBondContact O-N 3.11Å; F184-P249 HydrophobicContact CE2-CB 4.27Å; F184-M253 HydrophobicContact CD2-CG 3.72Å; F184-M253 HydrophobicContact CE2-CG 3.62Å; F184-M253 HydrophobicContact CE2-SD 4.45Å; F184-H256 WeakPolarHBondContact CB-NE2 3.31Å; F184-H256 PolarHBondContact N-NE2 3.12Å
185V98.3Very high95.7Very high0 Ų025.7 Ų25.70%014%0.14CC..Hα-helixtrans-62.2-43.9177.2-179.60000111.1M86 I87 I168 P182 S187 V188 L189M86-V185 HydrophobicContact CB-CG2 3.74Å; M86-V185 HydrophobicContact SD-CG2 4.36Å; I87-V185 HydrophobicContact CG2-CB 4.41Å; I87-V185 HydrophobicContact CG2-CG1 3.73Å; I87-V185 HydrophobicContact CG2-CG2 3.88Å; I168-V185 HydrophobicContact CB-CG1 4.37Å; I168-V185 HydrophobicContact CD1-CG1 3.94Å; I168-V185 HydrophobicContact CG1-CG1 3.85Å; I168-V185 HydrophobicContact CG2-CG1 3.65Å; P182-V185 HydrophobicContact CB-CG2 4.41Å; P182-V185 HydrophobicContact CG-CG2 4.46Å; P182-V185 WeakPolarHBondContact O-CA 3.39Å; P182-V185 WeakPolarHBondContact O-CB 3.44Å; P182-V185 PolarHBondContact O-N 3.46Å; V185-S187 VanDerWaalsContact C-N 3.33Å; V185-S187 PolarHBondContact O-N 2.91Å; V185-V188 PolarHBondContact O-N 3.42Å; V185-L189 WeakPolarHBondContact O-CB 3.21Å; V185-L189 PolarHBondContact O-N 3.49Å
186W98.3Very high96.2Very high16 Ų1625.6 Ų25.66%0.06113%0.13CC..Hα-helixtrans-57.8-44.5172.3-88.6110.2000112.8Q178 Y179 T181 P182 F184 V188 L189 I190 Y270 V274 M277 M278Q178-W186 HydrophobicContact CB-CZ2 4.44Å; Q178-W186 HydrophobicContact CG-CH2 3.5Å; Q178-W186 HydrophobicContact CG-CZ2 3.53Å; Q178-W186 HydrophobicContact CG-CZ3 4.29Å; Q178-W186 WeakPolarHBondContact O-CZ2 3.38Å; Q178-W186 PolarHBondContact O-NE1 3.05Å; Y179-W186 AromaticContact CD1-CZ2 3.94Å; Y179-W186 HydrophobicContact CD1-CZ2 3.94Å; Y179-W186 HydrophobicContact CE1-CH2 4.48Å; Y179-W186 HydrophobicContact CE1-CZ2 4.23Å; T181-W186 VanDerWaalsContact OG1-CD1 3.25Å; T181-W186 PolarHBondContact OG1-NE1 3.25Å; T181-W186 VanDerWaalsContact OG1-NE1 3.08Å; P182-W186 PolarHBondContact O-N 3.46Å; P182-W186 VanDerWaalsContact O-N 3.09Å; F184-W186 PolarHBondContact O-N 2.82Å; W186-V188 PolarHBondContact O-N 3.27Å; W186-L189 HydrophobicContact CE3-CD2 4.18Å; W186-L189 HydrophobicContact CZ3-CD2 4.17Å; W186-L189 PolarHBondContact O-N 3.16Å; W186-I190 WeakPolarHBondContact O-CG1 3.33Å; W186-I190 PolarHBondContact O-N 2.97Å; W186-Y270 PolarHBondContact NE1-OH 3.43Å; W186-Y270 VanDerWaalsContact NE1-OH 3.07Å; W186-V274 HydrophobicContact CD2-CG1 3.81Å; W186-V274 HydrophobicContact CD2-CG2 4.39Å; W186-V274 HydrophobicContact CE3-CG1 4.11Å; W186-V274 HydrophobicContact CG-CG1 4.33Å; W186-V274 HydrophobicContact CG-CG2 4.13Å; W186-V274 HydrophobicContact CH2-CG1 4.06Å; W186-V274 HydrophobicContact CZ2-CG1 3.75Å; W186-V274 HydrophobicContact CZ3-CG1 4.24Å; W186-M277 HydrophobicContact CB-CE 3.7Å; W186-M278 HydrophobicContact CH2-SD 4.45Å; W186-M278 HydrophobicContact CZ3-SD 4.05Å
187S98.4Very high96.6Very high0 Ų029.7 Ų29.70%015%0.152CC..Hα-helixtrans-63.5-41.5179.971.20000112.4L183 F184 V185 I190 T191 L248 P249L183-S187 WeakPolarHBondContact O-CB 3.31Å; L183-S187 PolarHBondContact O-N 2.92Å; L183-S187 PolarHBondContact O-OG 3.5Å; F184-S187 WeakPolarHBondContact CA-OG 3.27Å; F184-S187 PolarHBondContact O-N 3.35Å; F184-S187 VanDerWaalsContact O-N 3.14Å; F184-S187 PolarHBondContact O-OG 3.14Å; V185-S187 VanDerWaalsContact C-N 3.33Å; V185-S187 PolarHBondContact O-N 2.91Å; S187-I190 PolarHBondContact O-N 3.45Å; S187-T191 WeakPolarHBondContact O-CB 3.2Å; S187-T191 PolarHBondContact O-N 3.41Å; S187-T191 PolarHBondContact O-OG1 2.82Å; S187-T191 VanDerWaalsContact O-OG1 3.08Å; S187-L248 WeakPolarHBondContact CB-O 3.32Å; S187-P249 WeakPolarHBondContact OG-CA 3.47Å
188V98.8Very high96.9Very high0 Ų026.1 Ų26.10%013%0.13CC..Hα-helixtrans-66.7-39.6175.7175.70000111.1I75 V83 F164 I168 F184 V185 W186 T191 A192I75-V188 HydrophobicContact CD1-CG1 4.37Å; I75-V188 HydrophobicContact CD1-CG2 4.37Å; V83-V188 HydrophobicContact CG2-CB 4.14Å; V83-V188 HydrophobicContact CG2-CG1 4.01Å; V83-V188 HydrophobicContact CG2-CG2 4.14Å; F164-V188 HydrophobicContact CB-CG1 4.26Å; F164-V188 HydrophobicContact CD1-CG1 3.73Å; F164-V188 HydrophobicContact CD2-CG1 4.31Å; F164-V188 HydrophobicContact CE1-CG1 4.18Å; F164-V188 HydrophobicContact CG-CG1 3.84Å; I168-V188 HydrophobicContact CD1-CB 4.42Å; I168-V188 HydrophobicContact CD1-CG1 4.24Å; F184-V188 HydrophobicContact CD1-CG2 4.29Å; F184-V188 HydrophobicContact CE1-CG2 3.79Å; F184-V188 HydrophobicContact CE2-CG2 4.09Å; F184-V188 HydrophobicContact CZ-CG2 3.68Å; F184-V188 WeakPolarHBondContact O-CG2 3.48Å; F184-V188 PolarHBondContact O-N 3.11Å; V185-V188 PolarHBondContact O-N 3.42Å; W186-V188 PolarHBondContact O-N 3.27Å; V188-T191 PolarHBondContact O-N 2.93Å; V188-A192 VanDerWaalsContact O-CB 3.3Å; V188-A192 WeakPolarHBondContact O-CB 3.08Å; V188-A192 PolarHBondContact O-N 3.37Å
189L98.8Very high97.1Very high18 Ų1824.2 Ų24.29%0.09412%0.121CC..Hα-helixtrans-59.8-47.8176.1178.761.2000111.6I165 I168 I169 V185 W186 A192 V193I165-L189 HydrophobicContact CG1-CD1 4.21Å; I168-L189 HydrophobicContact CB-CD1 4.4Å; I168-L189 HydrophobicContact CD1-CB 3.91Å; I168-L189 HydrophobicContact CG2-CB 4.29Å; I168-L189 HydrophobicContact CG2-CD1 4.29Å; I168-L189 HydrophobicContact CG2-CD2 4.09Å; I168-L189 HydrophobicContact CG2-CG 4.46Å; I169-L189 HydrophobicContact CG1-CD1 4.49Å; V185-L189 WeakPolarHBondContact O-CB 3.21Å; V185-L189 PolarHBondContact O-N 3.49Å; W186-L189 HydrophobicContact CE3-CD2 4.18Å; W186-L189 HydrophobicContact CZ3-CD2 4.17Å; W186-L189 PolarHBondContact O-N 3.16Å; L189-A192 PolarHBondContact O-N 3.47Å; L189-V193 WeakPolarHBondContact O-CG2 3.43Å; L189-V193 PolarHBondContact O-N 2.82Å
190I98.8Very high97.4Very high16 Ų1622.1 Ų22.18%0.08212%0.121CC..Hα-helixtrans-65.2-45.7179.8-64162.7000109.6W186 S187 A192 V193 L194 L248 M277 M278W186-I190 WeakPolarHBondContact O-CG1 3.33Å; W186-I190 PolarHBondContact O-N 2.97Å; S187-I190 PolarHBondContact O-N 3.45Å; I190-A192 VanDerWaalsContact C-N 3.31Å; I190-A192 PolarHBondContact O-N 2.87Å; I190-V193 PolarHBondContact O-N 3.27Å; I190-L194 HydrophobicContact CG2-CG 4.5Å; I190-L194 WeakPolarHBondContact O-CG 3.32Å; I190-L194 PolarHBondContact O-N 2.9Å; I190-L248 HydrophobicContact CB-CD1 4.33Å; I190-L248 HydrophobicContact CG2-CD1 3.67Å; I190-M277 HydrophobicContact CD1-CB 3.38Å; I190-M278 HydrophobicContact CD1-CG 3.82Å; I190-M278 HydrophobicContact CG1-CG 4.37Å
191T98.6Very high97.8Very high0 Ų020 Ų200%011%0.113CC..Hα-helixtrans-57.9-41.9175.1-66.70000112.5I75 S187 V188 V193 L194 L195 I245 L248 P249I75-T191 HydrophobicContact CD1-CG2 3.45Å; I75-T191 VanDerWaalsContact CD1-CG2 3.45Å; I75-T191 HydrophobicContact CG1-CG2 3.82Å; S187-T191 WeakPolarHBondContact O-CB 3.2Å; S187-T191 PolarHBondContact O-N 3.41Å; S187-T191 PolarHBondContact O-OG1 2.82Å; S187-T191 VanDerWaalsContact O-OG1 3.08Å; V188-T191 PolarHBondContact O-N 2.93Å; T191-V193 VanDerWaalsContact C-N 3.34Å; T191-V193 PolarHBondContact O-N 3.05Å; T191-L194 WeakPolarHBondContact O-CB 3.33Å; T191-L194 PolarHBondContact O-N 3.4Å; T191-L195 HydrophobicContact CG2-CD1 4.04Å; T191-L195 HydrophobicContact CG2-CG 4.42Å; T191-L195 WeakPolarHBondContact O-CB 3.48Å; T191-L195 WeakPolarHBondContact O-CG 3.46Å; T191-L195 PolarHBondContact O-N 3.48Å; T191-I245 HydrophobicContact CG2-CB 3.98Å; T191-I245 HydrophobicContact CG2-CG1 4.04Å; T191-I245 HydrophobicContact CG2-CG2 3.6Å; T191-L248 WeakPolarHBondContact OG1-CB 3.48Å; T191-P249 HydrophobicContact CG2-CG 4.38Å; T191-P249 WeakPolarHBondContact OG1-CD 3.43Å
192A98.7Very high98Very high1 Ų120.4 Ų20.41%0.00812%0.115CC..Hα-helixtrans-64-39.4177.600000111.9A161 F164 I165 V188 L189 I190 L195 L196A161-A192 HydrophobicContact CB-CB 4.07Å; A161-A192 WeakPolarHBondContact CB-O 3.27Å; F164-A192 HydrophobicContact CB-CB 4.03Å; I165-A192 HydrophobicContact CD1-CB 4.18Å; I165-A192 HydrophobicContact CG1-CB 3.75Å; V188-A192 VanDerWaalsContact O-CB 3.3Å; V188-A192 WeakPolarHBondContact O-CB 3.08Å; V188-A192 PolarHBondContact O-N 3.37Å; L189-A192 PolarHBondContact O-N 3.47Å; I190-A192 VanDerWaalsContact C-N 3.31Å; I190-A192 PolarHBondContact O-N 2.87Å; A192-L195 PolarHBondContact O-N 3.21Å; A192-L196 WeakPolarHBondContact O-CB 3.29Å; A192-L196 PolarHBondContact O-N 3.3Å
193V98.8Very high98.2Very high61 Ų6120.3 Ų20.337%0.3712%0.118SC..Hα-helixtrans-64.5-43.9173.7172.60000111.1I165 L189 I190 T191 L195 L196 L197I165-V193 HydrophobicContact CD1-CG2 4.08Å; I165-V193 HydrophobicContact CG1-CG2 4.29Å; L189-V193 WeakPolarHBondContact O-CG2 3.43Å; L189-V193 PolarHBondContact O-N 2.82Å; I190-V193 PolarHBondContact O-N 3.27Å; T191-V193 VanDerWaalsContact C-N 3.34Å; T191-V193 PolarHBondContact O-N 3.05Å; V193-L195 PolarHBondContact O-N 3.48Å; V193-L196 PolarHBondContact O-N 3.05Å; V193-L197 HydrophobicContact CG1-CD1 3.91Å; V193-L197 WeakPolarHBondContact O-CG 3.44Å; V193-L197 PolarHBondContact O-N 3.47Å
194L98.4Very high98.3Very high4 Ų422.3 Ų22.32%0.02113%0.134CC..Hα-helixtrans-57.7-49.9175.6-67.7-178.8000111.1I190 T191 L196 L197 S198 I245 L248 G281 F285I190-L194 HydrophobicContact CG2-CG 4.5Å; I190-L194 WeakPolarHBondContact O-CG 3.32Å; I190-L194 PolarHBondContact O-N 2.9Å; T191-L194 WeakPolarHBondContact O-CB 3.33Å; T191-L194 PolarHBondContact O-N 3.4Å; L194-L196 VanDerWaalsContact C-N 3.34Å; L194-L196 PolarHBondContact O-N 3.34Å; L194-L197 PolarHBondContact O-N 3.15Å; L194-S198 VanDerWaalsContact O-CB 3.3Å; L194-S198 WeakPolarHBondContact O-CB 3.21Å; L194-S198 PolarHBondContact O-N 2.63Å; L194-S198 PolarHBondContact O-OG 3.1Å; L194-I245 HydrophobicContact CB-CD1 3.74Å; L194-I245 HydrophobicContact CB-CG1 3.52Å; L194-I245 HydrophobicContact CD1-CG1 3.96Å; L194-I245 HydrophobicContact CG-CG1 4.4Å; L194-L248 HydrophobicContact CD1-CD1 3.69Å; L194-G281 WeakPolarHBondContact CD2-O 3.43Å; L194-F285 HydrophobicContact CD2-CD2 4.1Å; L194-F285 HydrophobicContact CD2-CE2 3.33Å; L194-F285 HydrophobicContact CD2-CZ 3.8Å
195L97.9Very high98.3Very high3 Ų322.4 Ų22.42%0.01614%0.136CC..Hα-helixtrans-57-45.9179.4-80.5167.9000112.1M71 A161 T191 A192 V193 L197 L199 I245M71-L195 HydrophobicContact SD-CD2 4.42Å; A161-L195 HydrophobicContact CB-CB 4.05Å; T191-L195 HydrophobicContact CG2-CD1 4.04Å; T191-L195 HydrophobicContact CG2-CG 4.42Å; T191-L195 WeakPolarHBondContact O-CB 3.48Å; T191-L195 WeakPolarHBondContact O-CG 3.46Å; T191-L195 PolarHBondContact O-N 3.48Å; A192-L195 PolarHBondContact O-N 3.21Å; V193-L195 PolarHBondContact O-N 3.48Å; L195-L197 VanDerWaalsContact C-N 3.27Å; L195-L197 PolarHBondContact O-N 2.98Å; L195-L199 HydrophobicContact CB-CD1 4.33Å; L195-L199 HydrophobicContact CD2-CD1 3.66Å; L195-L199 HydrophobicContact CD2-CG 4.18Å; L195-L199 WeakPolarHBondContact O-CB 3.41Å; L195-L199 WeakPolarHBondContact O-CG 3.24Å; L195-L199 PolarHBondContact O-N 3.44Å; L195-I245 HydrophobicContact CB-CD1 4.45Å; L195-I245 HydrophobicContact CD1-CG2 4.32Å; L195-I245 HydrophobicContact CD2-CD1 3.76Å; L195-I245 HydrophobicContact CD2-CG1 4.39Å; L195-I245 HydrophobicContact CD2-CG2 3.91Å; L195-I245 HydrophobicContact CG-CD1 3.79Å; L195-I245 HydrophobicContact CG-CG1 4.08Å; L195-I245 HydrophobicContact CG-CG2 3.98Å
196L98.1Very high98.3Very high62 Ų6222.5 Ų22.533%0.32514%0.136SC..Hα-helixtrans-62.8-35.3-179.1-177.362.4000112.3I158 I162 I165 A192 V193 L194 P200I158-L196 HydrophobicContact CG2-CD1 4.15Å; I162-L196 HydrophobicContact CD1-CD1 4.44Å; I162-L196 HydrophobicContact CG1-CD1 4.06Å; I165-L196 HydrophobicContact CD1-CD2 3.96Å; A192-L196 WeakPolarHBondContact O-CB 3.29Å; A192-L196 PolarHBondContact O-N 3.3Å; V193-L196 PolarHBondContact O-N 3.05Å; L194-L196 VanDerWaalsContact C-N 3.34Å; L194-L196 PolarHBondContact O-N 3.34Å; L196-P200 WeakPolarHBondContact O-CD 3.39Å; L196-P200 WeakPolarHBondContact O-CG 3.38Å
197L98Very high98.3Very high98 Ų9824.6 Ų24.651%0.51315%0.151SC..Hα-helixtrans-90.3-32.2-176.4-64.6178000113.4V193 L194 L195 F285V193-L197 HydrophobicContact CG1-CD1 3.91Å; V193-L197 WeakPolarHBondContact O-CG 3.44Å; V193-L197 PolarHBondContact O-N 3.47Å; L194-L197 PolarHBondContact O-N 3.15Å; L195-L197 VanDerWaalsContact C-N 3.27Å; L195-L197 PolarHBondContact O-N 2.98Å; L197-F285 HydrophobicContact CB-CE1 4.25Å; L197-F285 HydrophobicContact CB-CE2 4.37Å; L197-F285 HydrophobicContact CB-CZ 3.66Å; L197-F285 HydrophobicContact CD1-CE2 4.21Å; L197-F285 HydrophobicContact CD1-CZ 4.33Å
198S97.4Very high98.3Very high0 Ų026.3 Ų26.30%016%0.159CC..Hα-helixtrans-88.3-40.8-17470.60000113.4L194 P200 V201L194-S198 VanDerWaalsContact O-CB 3.3Å; L194-S198 WeakPolarHBondContact O-CB 3.21Å; L194-S198 PolarHBondContact O-N 2.63Å; L194-S198 PolarHBondContact O-OG 3.1Å; S198-P200 VanDerWaalsContact C-CD 3.49Å; S198-V201 PolarHBondContact O-N 3.44Å; S198-V201 VanDerWaalsContact O-N 3.14Å
199L96.9Very high98.3Very high5 Ų526.4 Ų26.43%0.02616%0.16CC..Hα-helixtrans-61.9-36.4-174.5-76173000114.9I158 L195 V201 L202 A203 F238I158-L199 HydrophobicContact CD1-CB 4.06Å; I158-L199 HydrophobicContact CG1-CB 4.09Å; I158-L199 HydrophobicContact CG1-CD1 3.86Å; L195-L199 HydrophobicContact CB-CD1 4.33Å; L195-L199 HydrophobicContact CD2-CD1 3.66Å; L195-L199 HydrophobicContact CD2-CG 4.18Å; L195-L199 WeakPolarHBondContact O-CB 3.41Å; L195-L199 WeakPolarHBondContact O-CG 3.24Å; L195-L199 PolarHBondContact O-N 3.44Å; L199-V201 PolarHBondContact O-N 2.88Å; L199-L202 HydrophobicContact CD2-CD2 4.46Å; L199-L202 PolarHBondContact O-N 3.4Å; L199-A203 PolarHBondContact O-N 3.27Å; L199-F238 HydrophobicContact CD2-CD2 4.07Å; L199-F238 HydrophobicContact CD2-CE2 3.49Å; L199-F238 VanDerWaalsContact CD2-CE2 3.49Å; L199-F238 HydrophobicContact CD2-CZ 4.27Å; L199-F238 HydrophobicContact CG-CE2 4.33Å
200P98.3Very high98.3Very high62 Ų6226.9 Ų26.940%0.40316%0.163SC..Hα-helixtrans-57.6-31.8175.5-27.836.9000113.5L196 S198 A203 A204L196-P200 WeakPolarHBondContact O-CD 3.39Å; L196-P200 WeakPolarHBondContact O-CG 3.38Å; S198-P200 VanDerWaalsContact C-CD 3.49Å; P200-A203 PolarHBondContact O-N 3Å; P200-A204 WeakPolarHBondContact O-CB 3.38Å; P200-A204 PolarHBondContact O-N 2.82Å
201V98.5Very high98.3Very high34 Ų3427.5 Ų27.521%0.20617%0.167CC..Hα-helixtrans-72.6-41.1178.9-1760000111.3S198 L199 A204 G205 L234 F237S198-V201 PolarHBondContact O-N 3.44Å; S198-V201 VanDerWaalsContact O-N 3.14Å; L199-V201 PolarHBondContact O-N 2.88Å; V201-A204 PolarHBondContact O-N 3.03Å; V201-G205 PolarHBondContact O-N 3.29Å; V201-L234 HydrophobicContact CG1-CB 4.33Å; V201-L234 HydrophobicContact CG1-CD2 3.87Å; V201-F237 HydrophobicContact CB-CD1 3.84Å; V201-F237 HydrophobicContact CB-CE1 4.35Å; V201-F237 HydrophobicContact CG1-CB 4.3Å; V201-F237 HydrophobicContact CG1-CD1 3.77Å; V201-F237 HydrophobicContact CG1-CG 4.34Å; V201-F237 HydrophobicContact CG2-CD1 3.61Å; V201-F237 HydrophobicContact CG2-CE1 3.63Å
202L97.9Very high98.3Very high9 Ų928.9 Ų28.95%0.04717%0.174CC..Hα-helixtrans-58.3-51.8170.9177.267.2000110.4L199 A204 G205 I206 F235 F238L199-L202 HydrophobicContact CD2-CD2 4.46Å; L199-L202 PolarHBondContact O-N 3.4Å; L202-A204 VanDerWaalsContact C-N 3.27Å; L202-A204 PolarHBondContact O-N 3.3Å; L202-G205 WeakPolarHBondContact O-CA 3.26Å; L202-G205 PolarHBondContact O-N 3.28Å; L202-I206 HydrophobicContact CD1-CG2 3.91Å; L202-I206 HydrophobicContact CG-CD1 4.46Å; L202-I206 HydrophobicContact CG-CG2 4.43Å; L202-I206 WeakPolarHBondContact O-CG1 3.29Å; L202-I206 PolarHBondContact O-N 3.29Å; L202-F235 HydrophobicContact CD1-CD2 3.93Å; L202-F235 HydrophobicContact CD1-CE2 4.15Å; L202-F238 HydrophobicContact CB-CB 3.86Å; L202-F238 HydrophobicContact CB-CD1 3.87Å; L202-F238 HydrophobicContact CB-CD2 3.97Å; L202-F238 HydrophobicContact CB-CE1 4.46Å; L202-F238 HydrophobicContact CB-CG 3.59Å; L202-F238 HydrophobicContact CD1-CD1 3.79Å; L202-F238 HydrophobicContact CD1-CE1 4.15Å; L202-F238 HydrophobicContact CD1-CG 4.39Å; L202-F238 HydrophobicContact CD2-CD1 3.89Å; L202-F238 HydrophobicContact CD2-CD2 4.36Å; L202-F238 HydrophobicContact CD2-CE1 3.64Å; L202-F238 HydrophobicContact CD2-CE2 4.13Å; L202-F238 HydrophobicContact CD2-CG 4.25Å; L202-F238 HydrophobicContact CD2-CZ 3.76Å; L202-F238 HydrophobicContact CG-CD1 4.05Å; L202-F238 HydrophobicContact CG-CE1 4.29Å; L202-F238 HydrophobicContact CG-CG 4.28Å
203A98.4Very high98.2Very high33 Ų3329.1 Ų29.127%0.27318%0.175SC..Hα-helixtrans-56.1-42.3-178.200000111.7L199 P200 T207L199-A203 PolarHBondContact O-N 3.27Å; P200-A203 PolarHBondContact O-N 3Å; A203-T207 WeakPolarHBondContact O-CB 3.47Å; A203-T207 PolarHBondContact O-N 3.43Å; A203-T207 PolarHBondContact O-OG1 3.47Å
204A98.6Very high98.2Very high46 Ų4630.2 Ų30.238%0.3818%0.179SC..Hα-helixtrans-61.5-48.7173.100000111.9P200 V201 L202 T207 M208P200-A204 WeakPolarHBondContact O-CB 3.38Å; P200-A204 PolarHBondContact O-N 2.82Å; V201-A204 PolarHBondContact O-N 3.03Å; L202-A204 VanDerWaalsContact C-N 3.27Å; L202-A204 PolarHBondContact O-N 3.3Å; A204-T207 PolarHBondContact O-N 2.86Å; A204-M208 HydrophobicContact CB-CE 4.31Å; A204-M208 WeakPolarHBondContact O-CE 3.42Å; A204-M208 WeakPolarHBondContact O-CG 2.84Å; A204-M208 PolarHBondContact O-N 3.49Å
205G98.6Very high98.2Very high3 Ų335.8 Ų35.83%0.03121%0.208CC..Hα-helixtrans-56.8-50.5178.500000113.6V201 L202 M208 L209V201-G205 PolarHBondContact O-N 3.29Å; L202-G205 WeakPolarHBondContact O-CA 3.26Å; L202-G205 PolarHBondContact O-N 3.28Å; G205-M208 PolarHBondContact O-N 3.49Å; G205-L209 PolarHBondContact O-N 3.34Å
206I98.6Very high98.1Very high2 Ų243 Ų431%0.0125%0.246CC..Hα-helixtrans-74.9-25.5-179.764.8175000112.6I147 L150 H151 L202 L209 L210I147-I206 HydrophobicContact CG1-CB 4.35Å; I147-I206 HydrophobicContact CG2-CB 4.09Å; I147-I206 HydrophobicContact CG2-CD1 4.2Å; I147-I206 HydrophobicContact CG2-CG1 4.17Å; L150-I206 HydrophobicContact CB-CD1 3.82Å; H151-I206 VanDerWaalsContact CE1-CD1 3.48Å; H151-I206 WeakPolarHBondContact CE1-CD1 3.3Å; H151-I206 VanDerWaalsContact CE1-CG1 3.41Å; H151-I206 WeakPolarHBondContact CE1-CG1 3.32Å; L202-I206 HydrophobicContact CD1-CG2 3.91Å; L202-I206 HydrophobicContact CG-CD1 4.46Å; L202-I206 HydrophobicContact CG-CG2 4.43Å; L202-I206 WeakPolarHBondContact O-CG1 3.29Å; L202-I206 PolarHBondContact O-N 3.29Å; I206-L209 PolarHBondContact O-N 3.23Å; I206-L210 WeakPolarHBondContact O-CB 3.07Å; I206-L210 PolarHBondContact O-N 3.41Å
207T98.7Very high98Very high60 Ų6042.2 Ų42.237%0.36824%0.244SC..Hα-helixtrans-68.3-45.6170-64.40000110.9H151 A203 A204 L209 L210 T211H151-T207 PolarHBondContact NE2-OG1 3.46Å; A203-T207 WeakPolarHBondContact O-CB 3.47Å; A203-T207 PolarHBondContact O-N 3.43Å; A203-T207 PolarHBondContact O-OG1 3.47Å; A204-T207 PolarHBondContact O-N 2.86Å; T207-L209 PolarHBondContact O-N 2.91Å; T207-L210 WeakPolarHBondContact O-CB 3.26Å; T207-L210 PolarHBondContact O-N 3.04Å; T207-L210 VanDerWaalsContact O-N 3.08Å; T207-T211 WeakPolarHBondContact O-CG2 3.14Å; T207-T211 PolarHBondContact O-N 3.49Å
208M98.6Very high98Very high35 Ų3540.4 Ų40.417%0.17224%0.238CC..Hα-helixtrans-58.5-39.3174.4-75-177.1-76.800111.3A204 G205 T211 D212 F219 F220 L234A204-M208 HydrophobicContact CB-CE 4.31Å; A204-M208 WeakPolarHBondContact O-CE 3.42Å; A204-M208 WeakPolarHBondContact O-CG 2.84Å; A204-M208 PolarHBondContact O-N 3.49Å; G205-M208 PolarHBondContact O-N 3.49Å; M208-T211 PolarHBondContact O-N 3.09Å; M208-T211 PolarHBondContact O-OG1 2.94Å; M208-D212 PolarHBondContact O-N 3.18Å; M208-F219 HydrophobicContact CB-CB 4.19Å; M208-F219 HydrophobicContact CB-CD2 3.69Å; M208-F219 HydrophobicContact CB-CE2 4.18Å; M208-F219 HydrophobicContact CB-CG 3.89Å; M208-F219 HydrophobicContact CG-CD1 4.07Å; M208-F219 HydrophobicContact CG-CD2 3.77Å; M208-F219 HydrophobicContact CG-CE1 4.11Å; M208-F219 HydrophobicContact CG-CE2 3.82Å; M208-F219 HydrophobicContact CG-CG 3.9Å; M208-F219 HydrophobicContact CG-CZ 3.99Å; M208-F219 HydrophobicContact SD-CD1 3.58Å; M208-F219 VanDerWaalsContact SD-CD1 3.58Å; M208-F219 HydrophobicContact SD-CD2 4.37Å; M208-F219 HydrophobicContact SD-CE1 3.76Å; M208-F219 HydrophobicContact SD-CG 3.91Å; M208-F219 HydrophobicContact SD-CZ 4.25Å; M208-F220 HydrophobicContact CB-CE2 3.65Å; M208-F220 HydrophobicContact CB-CZ 3.74Å; M208-F220 HydrophobicContact CE-CZ 4.31Å; M208-F220 HydrophobicContact SD-CZ 4.49Å; M208-L234 HydrophobicContact CE-CD1 3.3Å
209L98.6Very high98.1Very high2 Ų244.7 Ų44.71%0.0126%0.256CS..Hα-helixtrans-65.8-41.2175.1178.762.3000111.3V128 P130 A133 I147 G205 I206 T207 T211 D212 R213 F220 Y231V128-L209 HydrophobicContact CG1-CD2 3.81Å; P130-L209 HydrophobicContact CB-CD1 4.15Å; P130-L209 HydrophobicContact CG-CD1 4.45Å; A133-L209 HydrophobicContact CB-CD1 4.42Å; A133-L209 HydrophobicContact CB-CD2 3.9Å; I147-L209 HydrophobicContact CD1-CD2 4.16Å; I147-L209 HydrophobicContact CD1-CG 4.21Å; G205-L209 PolarHBondContact O-N 3.34Å; I206-L209 PolarHBondContact O-N 3.23Å; T207-L209 PolarHBondContact O-N 2.91Å; L209-T211 VanDerWaalsContact C-N 3.31Å; L209-T211 PolarHBondContact O-N 3.22Å; L209-D212 PolarHBondContact O-N 3.11Å; L209-R213 HydrophobicContact CD1-CG 4.47Å; L209-R213 VanDerWaalsContact O-CG 3.26Å; L209-R213 WeakPolarHBondContact O-CG 3.48Å; L209-R213 PolarHBondContact O-N 2.85Å; L209-F220 HydrophobicContact CB-CD2 4.33Å; L209-F220 HydrophobicContact CB-CE2 4.03Å; L209-F220 HydrophobicContact CD1-CD2 4.37Å; L209-Y231 HydrophobicContact CB-CE2 4.18Å; L209-Y231 HydrophobicContact CD2-CE2 3.98Å
210L98.5Very high98.1Very high29 Ų2944.5 Ų44.515%0.15226%0.255CS..Hα-helixtrans-61.8-39.4176.4-173.367.5000111.8D144 I147 F148 I206 T207 R213 N214D144-L210 HydrophobicContact CB-CD1 3.95Å; I147-L210 HydrophobicContact CD1-CB 4.1Å; I147-L210 HydrophobicContact CD1-CD1 4.19Å; I147-L210 HydrophobicContact CG2-CB 4.22Å; I147-L210 HydrophobicContact CG2-CD1 4.48Å; I147-L210 HydrophobicContact CG2-CD2 4.31Å; F148-L210 HydrophobicContact CE1-CD2 3.92Å; F148-L210 HydrophobicContact CZ-CD2 3.97Å; I206-L210 WeakPolarHBondContact O-CB 3.07Å; I206-L210 PolarHBondContact O-N 3.41Å; T207-L210 WeakPolarHBondContact O-CB 3.26Å; T207-L210 PolarHBondContact O-N 3.04Å; T207-L210 VanDerWaalsContact O-N 3.08Å; L210-R213 PolarHBondContact O-N 2.9Å; L210-N214 WeakPolarHBondContact CD1-ND2 3.48Å; L210-N214 WeakPolarHBondContact O-CB 3.47Å; L210-N214 PolarHBondContact O-N 3.17Å; L210-N214 PolarHBondContact O-ND2 2.69Å
211T98.3Very high98Very high28 Ų2845.2 Ų45.217%0.17226%0.256CS..Hα-helixtrans-72.9-34.4176.862.90000112.2T207 M208 L209 R213 N214 L215 N216 T217T207-T211 WeakPolarHBondContact O-CG2 3.14Å; T207-T211 PolarHBondContact O-N 3.49Å; M208-T211 PolarHBondContact O-N 3.09Å; M208-T211 PolarHBondContact O-OG1 2.94Å; L209-T211 VanDerWaalsContact C-N 3.31Å; L209-T211 PolarHBondContact O-N 3.22Å; T211-R213 PolarHBondContact O-N 2.71Å; T211-N214 PolarHBondContact O-N 2.9Å; T211-L215 HydrophobicContact CG2-CD1 3.85Å; T211-L215 CarbonylContact O-C 3.6Å; T211-L215 WeakPolarHBondContact O-CA 3.35Å; T211-L215 PolarHBondContact O-N 2.87Å; T211-N216 PolarHBondContact O-N 3.39Å; T211-T217 VanDerWaalsContact CB-OG1 3.31Å; T211-T217 WeakPolarHBondContact CB-OG1 3.34Å; T211-T217 PolarHBondContact O-N 2.97Å; T211-T217 PolarHBondContact O-OG1 3.45Å; T211-T217 PolarHBondContact OG1-OG1 3.13Å
212D98.1Very high97.9Very high29 Ų2947.4 Ų47.416%0.15527%0.271CS..Hα-helixtrans-63.2-36.6172.9-83.214000110.7M208 L209 T217 T218 F219 F220M208-D212 PolarHBondContact O-N 3.18Å; L209-D212 PolarHBondContact O-N 3.11Å; D212-T217 WeakPolarHBondContact CA-O 3.26Å; D212-T217 WeakPolarHBondContact CA-OG1 3.27Å; D212-T217 PolarHBondContact N-OG1 3.37Å; D212-T217 WeakPolarHBondContact OD1-CB 3.48Å; D212-T217 VanDerWaalsContact OD1-O 3.11Å; D212-T217 PolarHBondContact OD1-OG1 3.04Å; D212-T218 PolarHBondContact OD1-N 3.19Å; D212-T218 VanDerWaalsContact OD1-N 3.13Å; D212-F219 VanDerWaalsContact CG-N 3.32Å; D212-F219 WeakPolarHBondContact OD1-CD2 2.89Å; D212-F219 PolarHBondContact OD1-N 3.44Å; D212-F219 PolarHBondContact OD2-N 2.93Å; D212-F220 PolarHBondContact OD2-N 3.48Å
213R97.6Very high97.7Very high7 Ų751.5 Ų51.53%0.02631%0.306CS..Hα-helixtrans-72.7-42.2175.1-67.6172.663.468.412.3112.8A133 G134 N135 H138 G140 D144 L209 L210 T211A133-R213 WeakPolarHBondContact O-CD 3.44Å; A133-R213 PolarHBondContact O-NH1 3.11Å; G134-R213 VanDerWaalsContact C-NH1 3.26Å; G134-R213 PolarHBondContact O-NH1 2.82Å; N135-R213 PolarHBondContact ND2-O 3.37Å; N135-R213 PolarHBondContact OD1-NH2 3.37Å; H138-R213 PolarHBondContact O-NH1 2.93Å; H138-R213 PolarHBondContact O-NH2 3.46Å; G140-R213 PolarHBondContact O-NH2 2.86Å; D144-R213 IonicContact OD1-CZ 3.61Å; D144-R213 IonicContact OD1-NE 2.76Å; D144-R213 PolarHBondContact OD1-NE 3.3Å; D144-R213 IonicContact OD1-NH2 2.64Å; L209-R213 HydrophobicContact CD1-CG 4.47Å; L209-R213 VanDerWaalsContact O-CG 3.26Å; L209-R213 WeakPolarHBondContact O-CG 3.48Å; L209-R213 PolarHBondContact O-N 2.85Å; L210-R213 PolarHBondContact O-N 2.9Å; T211-R213 PolarHBondContact O-N 2.71Å
214N98.1Very high97.5Very high83 Ų8351.9 Ų51.944%0.44431%0.313SS..Hα-helixtrans-114.6-18.7-164.2-72.1-73.5000115.5D144 L210 T211D144-N214 VanDerWaalsContact CG-ND2 3.33Å; D144-N214 PolarHBondContact OD1-ND2 3.39Å; D144-N214 PolarHBondContact OD2-ND2 2.88Å; D144-N214 PolarHBondContact OD2-OD1 3.36Å; L210-N214 WeakPolarHBondContact CD1-ND2 3.48Å; L210-N214 WeakPolarHBondContact O-CB 3.47Å; L210-N214 PolarHBondContact O-N 3.17Å; L210-N214 PolarHBondContact O-ND2 2.69Å; T211-N214 PolarHBondContact O-N 2.9Å
215L97.6Very high97.4Very high121 Ų12153.2 Ų53.263%0.63433%0.331SS*.SBendtrans-122.814.2-172.2-58-177.9000113.4T211 T217T211-L215 HydrophobicContact CG2-CD1 3.85Å; T211-L215 CarbonylContact O-C 3.6Å; T211-L215 WeakPolarHBondContact O-CA 3.35Å; T211-L215 PolarHBondContact O-N 2.87Å; L215-T217 PolarHBondContact O-N 3.17Å
216N95.8Very high97.3Very high154 Ų15453.8 Ų53.882%0.82434%0.337SS*.  trans5531.3-179.4-55.1-55.5000113.7T211T211-N216 PolarHBondContact O-N 3.39Å
217T97.9Very high97.3Very high46 Ų4657 Ų5728%0.28235%0.354SS..  trans-77166.5164.864.70000109.9T211 D212 L215 F219T211-T217 VanDerWaalsContact CB-OG1 3.31Å; T211-T217 WeakPolarHBondContact CB-OG1 3.34Å; T211-T217 PolarHBondContact O-N 2.97Å; T211-T217 PolarHBondContact O-OG1 3.45Å; T211-T217 PolarHBondContact OG1-OG1 3.13Å; D212-T217 WeakPolarHBondContact CA-O 3.26Å; D212-T217 WeakPolarHBondContact CA-OG1 3.27Å; D212-T217 PolarHBondContact N-OG1 3.37Å; D212-T217 WeakPolarHBondContact OD1-CB 3.48Å; D212-T217 VanDerWaalsContact OD1-O 3.11Å; D212-T217 PolarHBondContact OD1-OG1 3.04Å; L215-T217 PolarHBondContact O-N 3.17Å; T217-F219 HydrophobicContact CG2-CE2 4.29Å
218T97.3Very high97.2Very high61 Ų6155.5 Ų55.537%0.37435%0.345SS..  trans-138.749.5-175.858.50000111.4D212 F220 D221 G224 G226D212-T218 PolarHBondContact OD1-N 3.19Å; D212-T218 VanDerWaalsContact OD1-N 3.13Å; T218-F220 VanDerWaalsContact C-N 3.35Å; T218-D221 HydrophobicContact CG2-CB 4.46Å; T218-G224 PolarHBondContact OG1-O 3.4Å; T218-G226 VanDerWaalsContact O-CA 3.24Å; T218-G226 WeakPolarHBondContact O-CA 3.48Å; T218-G226 PolarHBondContact O-N 3.35Å
219F98.3Very high97.2Very high89 Ų8956.5 Ų56.539%0.3935%0.351SS..SBendtrans-64.1-40.5176.7-72.5-76.6000112.1M208 D212 T217 G226 D227M208-F219 HydrophobicContact CB-CB 4.19Å; M208-F219 HydrophobicContact CB-CD2 3.69Å; M208-F219 HydrophobicContact CB-CE2 4.18Å; M208-F219 HydrophobicContact CB-CG 3.89Å; M208-F219 HydrophobicContact CG-CD1 4.07Å; M208-F219 HydrophobicContact CG-CD2 3.77Å; M208-F219 HydrophobicContact CG-CE1 4.11Å; M208-F219 HydrophobicContact CG-CE2 3.82Å; M208-F219 HydrophobicContact CG-CG 3.9Å; M208-F219 HydrophobicContact CG-CZ 3.99Å; M208-F219 HydrophobicContact SD-CD1 3.58Å; M208-F219 VanDerWaalsContact SD-CD1 3.58Å; M208-F219 HydrophobicContact SD-CD2 4.37Å; M208-F219 HydrophobicContact SD-CE1 3.76Å; M208-F219 HydrophobicContact SD-CG 3.91Å; M208-F219 HydrophobicContact SD-CZ 4.25Å; D212-F219 VanDerWaalsContact CG-N 3.32Å; D212-F219 WeakPolarHBondContact OD1-CD2 2.89Å; D212-F219 PolarHBondContact OD1-N 3.44Å; D212-F219 PolarHBondContact OD2-N 2.93Å; T217-F219 HydrophobicContact CG2-CE2 4.29Å; F219-G226 CarbonylContact O-C 3.42Å; F219-G226 WeakPolarHBondContact O-CA 3.42Å; F219-D227 PolarHBondContact O-N 3.16Å
220F98.1Very high97.1Very high2 Ų259.7 Ų59.71%0.00937%0.367CS..SBendtrans-118.2-3.9-173.9-49-56.1000113.6P130 M208 L209 D212 T218 P222 P228 L230 Y231 L234P130-F220 HydrophobicContact CB-CB 3.85Å; 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 3.65Å; M208-F220 HydrophobicContact CB-CZ 3.74Å; M208-F220 HydrophobicContact CE-CZ 4.31Å; M208-F220 HydrophobicContact SD-CZ 4.49Å; L209-F220 HydrophobicContact CB-CD2 4.33Å; L209-F220 HydrophobicContact CB-CE2 4.03Å; L209-F220 HydrophobicContact CD1-CD2 4.37Å; D212-F220 PolarHBondContact OD2-N 3.48Å; T218-F220 VanDerWaalsContact C-N 3.35Å; F220-P222 VanDerWaalsContact O-CD 3.32Å; F220-P222 WeakPolarHBondContact O-CD 3.5Å; F220-P228 VanDerWaalsContact O-CD 3.28Å; F220-P228 WeakPolarHBondContact O-CD 3.37Å; F220-P228 VanDerWaalsContact O-CG 3.3Å; F220-P228 WeakPolarHBondContact O-CG 3.36Å; F220-L230 HydrophobicContact CD1-CB 4.44Å; F220-L230 HydrophobicContact CE1-CB 4.33Å; F220-L230 HydrophobicContact CE1-CD2 4.2Å; F220-L230 HydrophobicContact CE1-CG 4.13Å; 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 3.69Å; F220-Y231 HydrophobicContact CZ-CD2 3.69Å; F220-Y231 HydrophobicContact CZ-CG 4.35Å; F220-L234 HydrophobicContact CE1-CD1 4.24Å; F220-L234 HydrophobicContact CZ-CD1 4.21Å
221D96Very high97.1Very high76 Ų7658.5 Ų58.541%0.40636%0.361SS..  trans-87112.3177.4-177.31.8000111.5T218 A223 G224 G225 G226T218-D221 HydrophobicContact CG2-CB 4.46Å; D221-A223 PolarHBondContact O-N 3.11Å; D221-A223 WeakPolarHBondContact OD1-CB 3.12Å; D221-A223 PolarHBondContact OD1-N 2.64Å; D221-G224 PolarHBondContact O-N 3.48Å; D221-G225 PolarHBondContact O-N 3.17Å; D221-G226 WeakPolarHBondContact O-CA 3.28Å; D221-G226 PolarHBondContact O-N 3.32Å
222P95.4Very high97.1Very high81 Ų8158.9 Ų58.953%0.52636%0.361SS..G310 helixtrans-58.8-27.5177.5-23.735.3000114.3F220 G224 G225 G226 P228F220-P222 VanDerWaalsContact O-CD 3.32Å; F220-P222 WeakPolarHBondContact O-CD 3.5Å; P222-G224 PolarHBondContact O-N 3.28Å; P222-G225 PolarHBondContact O-N 2.97Å; P222-G225 VanDerWaalsContact O-N 3.08Å; P222-G226 WeakPolarHBondContact CA-O 3.46Å; P222-P228 HydrophobicContact CG-CG 4.02Å
223A94.1Very high97.1Very high94 Ų9460.5 Ų60.578%0.77737%0.367SS*.G310 helixtrans-65.5-27.6178.200000112.3D221D221-A223 PolarHBondContact O-N 3.11Å; D221-A223 WeakPolarHBondContact OD1-CB 3.12Å; D221-A223 PolarHBondContact OD1-N 2.64Å
224G94.3Very high97.2Very high42 Ų4261.9 Ų61.943%0.43338%0.375SS..G310 helixtrans-99.29.9172.700000114.6T218 D221 P222T218-G224 PolarHBondContact OG1-O 3.4Å; D221-G224 PolarHBondContact O-N 3.48Å; P222-G224 PolarHBondContact O-N 3.28Å
225G96Very high97.2Very high73 Ų7358.3 Ų58.375%0.75336%0.355SS*.THydrogen-bonded Turntrans84.79.7-17800000115.5D221 P222D221-G225 PolarHBondContact O-N 3.17Å; P222-G225 PolarHBondContact O-N 2.97Å; P222-G225 VanDerWaalsContact O-N 3.08Å
226G97.4Very high97.3Very high15 Ų1553.1 Ų53.116%0.15533%0.328CS..  trans-77170173.400000113.6T218 F219 D221 P222T218-G226 VanDerWaalsContact O-CA 3.24Å; T218-G226 WeakPolarHBondContact O-CA 3.48Å; T218-G226 PolarHBondContact O-N 3.35Å; F219-G226 CarbonylContact O-C 3.42Å; F219-G226 WeakPolarHBondContact O-CA 3.42Å; D221-G226 WeakPolarHBondContact O-CA 3.28Å; D221-G226 PolarHBondContact O-N 3.32Å; P222-G226 WeakPolarHBondContact CA-O 3.46Å
227D97.7Very high97.4Very high71 Ų7148.7 Ų48.738%0.3830%0.301SS..  trans-131.9112.8-178.1179.415.3000112.1F219 I229 L230F219-D227 PolarHBondContact O-N 3.16Å; D227-I229 PolarHBondContact O-N 2.96Å; D227-I229 WeakPolarHBondContact OD1-CB 3.39Å; D227-I229 PolarHBondContact OD1-N 3.44Å; D227-L230 HydrophobicContact CB-CB 4.26Å; D227-L230 VanDerWaalsContact O-CB 3.25Å; D227-L230 WeakPolarHBondContact O-CB 3.46Å; D227-L230 PolarHBondContact O-N 3.5Å; D227-L230 VanDerWaalsContact O-N 3.1Å; D227-L230 PolarHBondContact OD2-N 2.87Å
228P97.2Very high97.4Very high27 Ų2746.5 Ų46.518%0.17529%0.287CS..Hα-helixtrans-58.2-26.2172.8-23.832.2000114.3F220 P222 L230 Y231 Q232F220-P228 VanDerWaalsContact O-CD 3.28Å; F220-P228 WeakPolarHBondContact O-CD 3.37Å; F220-P228 VanDerWaalsContact O-CG 3.3Å; F220-P228 WeakPolarHBondContact O-CG 3.36Å; P222-P228 HydrophobicContact CG-CG 4.02Å; P228-L230 VanDerWaalsContact C-N 3.32Å; P228-Y231 WeakPolarHBondContact O-CB 3.3Å; P228-Y231 PolarHBondContact O-N 3.19Å; P228-Q232 PolarHBondContact O-N 3.48Å
229I98.1Very high97.3Very high56 Ų5643.6 Ų43.629%0.28727%0.27SS..Hα-helixtrans-70.8-30.6178-58.3176.6000110.6D227 Y231 Q232 H233 M292 V295D227-I229 PolarHBondContact O-N 2.96Å; D227-I229 WeakPolarHBondContact OD1-CB 3.39Å; D227-I229 PolarHBondContact OD1-N 3.44Å; I229-Y231 VanDerWaalsContact C-N 3.27Å; I229-Y231 PolarHBondContact O-N 2.97Å; I229-Q232 WeakPolarHBondContact O-CB 3.41Å; I229-Q232 PolarHBondContact O-N 3.31Å; I229-H233 PolarHBondContact O-CD2 3.17Å; I229-H233 PolarHBondContact O-N 2.94Å; I229-M292 HydrophobicContact CG2-CE 3.7Å; I229-V295 HydrophobicContact CD1-CB 4.4Å; I229-V295 HydrophobicContact CG2-CG2 4.19Å
230L98.2Very high97.2Very high69 Ų6939.8 Ų39.836%0.36125%0.253SS..Hα-helixtrans-56.4-43.3170.4177.962.2000111.2F220 D227 P228 Q232 H233 L234F220-L230 HydrophobicContact CD1-CB 4.44Å; F220-L230 HydrophobicContact CE1-CB 4.33Å; F220-L230 HydrophobicContact CE1-CD2 4.2Å; F220-L230 HydrophobicContact CE1-CG 4.13Å; D227-L230 HydrophobicContact CB-CB 4.26Å; D227-L230 VanDerWaalsContact O-CB 3.25Å; D227-L230 WeakPolarHBondContact O-CB 3.46Å; D227-L230 PolarHBondContact O-N 3.5Å; D227-L230 VanDerWaalsContact O-N 3.1Å; D227-L230 PolarHBondContact OD2-N 2.87Å; P228-L230 VanDerWaalsContact C-N 3.32Å; L230-Q232 VanDerWaalsContact C-N 3.29Å; L230-Q232 PolarHBondContact O-N 2.89Å; L230-H233 PolarHBondContact O-N 3.44Å; L230-L234 HydrophobicContact CD1-CD1 4.41Å; L230-L234 HydrophobicContact CD1-CG 4.37Å; L230-L234 HydrophobicContact CG-CD1 4.15Å; L230-L234 WeakPolarHBondContact O-CG 3.5Å; L230-L234 PolarHBondContact O-N 2.81Å
231Y98.5Very high97.2Very high4 Ų439.7 Ų39.72%0.01625%0.253CS..Hα-helixtrans-59.5-42.9175.6-175.7-80.6000111T127 V128 Y129 P130 L209 F220 P228 I229 H233 L234 F235T127-Y231 WeakPolarHBondContact O-CE1 3.39Å; T127-Y231 PolarHBondContact O-OH 3.39Å; V128-Y231 VanDerWaalsContact O-CZ 3.31Å; V128-Y231 PolarHBondContact O-OH 3Å; Y129-Y231 AromaticContact CD1-CD1 3.57Å; Y129-Y231 HydrophobicContact CD1-CD1 3.57Å; Y129-Y231 AromaticContact CD1-CE1 3.61Å; Y129-Y231 HydrophobicContact CD1-CE1 3.61Å; Y129-Y231 HydrophobicContact CE1-CD1 4.1Å; Y129-Y231 HydrophobicContact CE1-CE1 4.12Å; P130-Y231 HydrophobicContact CG-CD1 4.44Å; P130-Y231 HydrophobicContact CG-CD2 4.05Å; P130-Y231 HydrophobicContact CG-CG 3.8Å; L209-Y231 HydrophobicContact CB-CE2 4.18Å; 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 3.69Å; F220-Y231 HydrophobicContact CZ-CD2 3.69Å; F220-Y231 HydrophobicContact CZ-CG 4.35Å; P228-Y231 WeakPolarHBondContact O-CB 3.3Å; P228-Y231 PolarHBondContact O-N 3.19Å; I229-Y231 VanDerWaalsContact C-N 3.27Å; I229-Y231 PolarHBondContact O-N 2.97Å; Y231-H233 VanDerWaalsContact C-N 3.34Å; Y231-H233 PolarHBondContact O-N 3.15Å; Y231-L234 PolarHBondContact O-N 3.27Å; Y231-F235 HydrophobicContact CD1-CB 4.16Å; Y231-F235 HydrophobicContact CE1-CB 3.82Å; Y231-F235 HydrophobicContact CE1-CD2 4.09Å; Y231-F235 HydrophobicContact CE1-CG 4.18Å; Y231-F235 VanDerWaalsContact O-CB 3.27Å; Y231-F235 WeakPolarHBondContact O-CB 3.41Å; Y231-F235 PolarHBondContact O-N 2.98Å
232Q98.2Very high97.3Very high36 Ų3636.1 Ų36.117%0.16823%0.234CC..Hα-helixtrans-61.1-42.2177.8-63.3-166.939.600112Y129 P228 I229 L230 F235 W236 M292Y129-Q232 HydrophobicContact CD1-CG 4.21Å; Y129-Q232 HydrophobicContact CE1-CB 4.47Å; Y129-Q232 HydrophobicContact CE1-CG 3.84Å; Y129-Q232 HydrophobicContact CE2-CG 4.39Å; P228-Q232 PolarHBondContact O-N 3.48Å; I229-Q232 WeakPolarHBondContact O-CB 3.41Å; I229-Q232 PolarHBondContact O-N 3.31Å; L230-Q232 VanDerWaalsContact C-N 3.29Å; L230-Q232 PolarHBondContact O-N 2.89Å; Q232-F235 PolarHBondContact O-N 2.89Å; Q232-W236 WeakPolarHBondContact O-CB 3.47Å; Q232-W236 PolarHBondContact O-N 2.85Å; Q232-M292 HydrophobicContact CB-CE 3.57Å; Q232-M292 HydrophobicContact CB-CG 4.36Å; Q232-M292 HydrophobicContact CB-SD 4Å
233H98.3Very high97.2Very high64 Ų6433.5 Ų33.530%0.29622%0.216SC..Hα-helixtrans-61.1-47.1175.6-77.4-62.1000111.9I229 L230 Y231 F237 W288 M292I229-H233 PolarHBondContact O-CD2 3.17Å; I229-H233 PolarHBondContact O-N 2.94Å; L230-H233 PolarHBondContact O-N 3.44Å; Y231-H233 VanDerWaalsContact C-N 3.34Å; Y231-H233 PolarHBondContact O-N 3.15Å; H233-F237 WeakPolarHBondContact O-CB 3.39Å; H233-F237 PolarHBondContact O-N 3.41Å; H233-W288 AromaticContact ND1-NE1 3.55Å; H233-M292 WeakPolarHBondContact CE1-CE 3.48Å; H233-M292 WeakPolarHBondContact ND1-CE 3.49Å; H233-M292 PolarHBondContact ND1-SD 2.93Å; H233-M292 WeakPolarHBondContact NE2-CE 3.23Å
234L98.5Very high97.3Very high35 Ų3530.5 Ų30.518%0.18319%0.185CC..Hα-helixtrans-63.6-46.3179-65.8170.1000111.7V201 M208 F220 L230 Y231 F238V201-L234 HydrophobicContact CG1-CB 4.33Å; V201-L234 HydrophobicContact CG1-CD2 3.87Å; M208-L234 HydrophobicContact CE-CD1 3.3Å; F220-L234 HydrophobicContact CE1-CD1 4.24Å; F220-L234 HydrophobicContact CZ-CD1 4.21Å; L230-L234 HydrophobicContact CD1-CD1 4.41Å; L230-L234 HydrophobicContact CD1-CG 4.37Å; L230-L234 HydrophobicContact CG-CD1 4.15Å; L230-L234 WeakPolarHBondContact O-CG 3.5Å; L230-L234 PolarHBondContact O-N 2.81Å; Y231-L234 PolarHBondContact O-N 3.27Å; L234-F238 PolarHBondContact O-N 3.22Å
235F98.6Very high97.4Very high8 Ų828.6 Ų28.64%0.03517%0.165CC..Hα-helixtrans-62.2-47.2179.3-176.9-87.9000111.1W126 T127 Y129 L202 Y231 Q232 F238 G239W126-F235 HydrophobicContact CD2-CZ 4.29Å; W126-F235 HydrophobicContact CE3-CE1 4.49Å; W126-F235 AromaticContact CE3-CZ 3.7Å; W126-F235 HydrophobicContact CE3-CZ 3.7Å; W126-F235 AromaticContact CH2-CE1 3.92Å; W126-F235 HydrophobicContact CH2-CE1 3.92Å; W126-F235 AromaticContact CH2-CZ 3.88Å; W126-F235 HydrophobicContact CH2-CZ 3.88Å; W126-F235 HydrophobicContact CZ2-CE1 4.33Å; W126-F235 HydrophobicContact CZ2-CZ 4.44Å; W126-F235 HydrophobicContact CZ3-CE1 4.02Å; W126-F235 AromaticContact CZ3-CZ 3.48Å; W126-F235 HydrophobicContact CZ3-CZ 3.48Å; W126-F235 VanDerWaalsContact CZ3-CZ 3.48Å; T127-F235 HydrophobicContact CG2-CD1 4.33Å; T127-F235 HydrophobicContact CG2-CE1 3.69Å; T127-F235 HydrophobicContact CG2-CZ 4Å; Y129-F235 HydrophobicContact CE1-CD1 4.41Å; Y129-F235 HydrophobicContact CE1-CG 4.49Å; L202-F235 HydrophobicContact CD1-CD2 3.93Å; L202-F235 HydrophobicContact CD1-CE2 4.15Å; Y231-F235 HydrophobicContact CD1-CB 4.16Å; Y231-F235 HydrophobicContact CE1-CB 3.82Å; Y231-F235 HydrophobicContact CE1-CD2 4.09Å; Y231-F235 HydrophobicContact CE1-CG 4.18Å; Y231-F235 VanDerWaalsContact O-CB 3.27Å; Y231-F235 WeakPolarHBondContact O-CB 3.41Å; Y231-F235 PolarHBondContact O-N 2.98Å; Q232-F235 PolarHBondContact O-N 2.89Å; F235-F238 CarbonylContact O-C 3.54Å; F235-F238 WeakPolarHBondContact O-CB 3.3Å; F235-F238 PolarHBondContact O-N 3.32Å; F235-G239 WeakPolarHBondContact O-CA 3.26Å; F235-G239 PolarHBondContact O-N 2.83Å
236W98.4Very high97.3Very high13 Ų1325.3 Ų25.35%0.04913%0.13CC..Hα-helixtrans-77.3-28.3-177.4-72.6126.6000113.8W126 T127 Y129 Q232 F238 G239 H240 W288 H291W126-W236 HydrophobicContact CH2-CH2 4.37Å; W126-W236 HydrophobicContact CH2-CZ3 4.12Å; W126-W236 AromaticContact CZ2-CH2 3.85Å; W126-W236 HydrophobicContact CZ2-CH2 3.85Å; W126-W236 HydrophobicContact CZ2-CZ3 4.02Å; T127-W236 HydrophobicContact CG2-CH2 4.27Å; T127-W236 HydrophobicContact CG2-CZ2 4.05Å; Y129-W236 AromaticContact CZ-NE1 3.96Å; Y129-W236 VanDerWaalsContact OH-CZ2 3.31Å; Y129-W236 WeakPolarHBondContact OH-CZ2 3.37Å; Y129-W236 PolarHBondContact OH-NE1 3.21Å; Q232-W236 WeakPolarHBondContact O-CB 3.47Å; Q232-W236 PolarHBondContact O-N 2.85Å; W236-F238 PolarHBondContact O-N 3.33Å; W236-G239 PolarHBondContact O-N 2.92Å; W236-G239 VanDerWaalsContact O-N 3.1Å; W236-H240 PolarHBondContact O-N 3.34Å; W236-W288 HydrophobicContact CB-CB 4.16Å; W236-W288 VanDerWaalsContact O-CB 3.24Å; W236-W288 WeakPolarHBondContact O-CB 3.31Å; W236-H291 HydrophobicContact CD2-CB 3.4Å; W236-H291 VanDerWaalsContact CD2-CB 3.4Å; W236-H291 AromaticContact CD2-CD2 3.59Å; W236-H291 AromaticContact CD2-CG 3.57Å; W236-H291 AromaticContact CE2-CG 3.77Å; W236-H291 HydrophobicContact CE3-CB 3.96Å; W236-H291 AromaticContact CE3-CD2 3.26Å; W236-H291 AromaticContact CE3-CG 3.55Å; W236-H291 AromaticContact CE3-NE2 3.67Å; W236-H291 HydrophobicContact CG-CB 3.67Å; W236-H291 HydrophobicContact CH2-CB 4.31Å; W236-H291 AromaticContact CH2-CG 3.99Å; W236-H291 AromaticContact CH2-ND1 3.87Å; W236-H291 HydrophobicContact CZ2-CB 3.79Å; W236-H291 AromaticContact CZ2-CG 3.99Å; W236-H291 HydrophobicContact CZ3-CB 4.38Å; W236-H291 AromaticContact CZ3-CD2 3.73Å; W236-H291 AromaticContact CZ3-CE1 3.81Å; W236-H291 AromaticContact CZ3-CG 3.78Å; W236-H291 AromaticContact CZ3-ND1 3.84Å; W236-H291 AromaticContact CZ3-NE2 3.72Å
237F98.1Very high97.3Very high60 Ų6024.9 Ų24.926%0.26312%0.124SC..Hα-helixtrans-56.6-36.2169.1-177.2-85.7000111.1V201 H233 P241 F285 W288V201-F237 HydrophobicContact CB-CD1 3.84Å; V201-F237 HydrophobicContact CB-CE1 4.35Å; V201-F237 HydrophobicContact CG1-CB 4.3Å; V201-F237 HydrophobicContact CG1-CD1 3.77Å; V201-F237 HydrophobicContact CG1-CG 4.34Å; V201-F237 HydrophobicContact CG2-CD1 3.61Å; V201-F237 HydrophobicContact CG2-CE1 3.63Å; H233-F237 WeakPolarHBondContact O-CB 3.39Å; H233-F237 PolarHBondContact O-N 3.41Å; F237-P241 WeakPolarHBondContact O-CD 3.23Å; F237-P241 WeakPolarHBondContact O-CG 3.33Å; F237-F285 HydrophobicContact CE1-CD1 4.06Å; F237-F285 HydrophobicContact CE1-CE1 4.23Å; F237-F285 HydrophobicContact CE2-CD1 4.35Å; F237-F285 AromaticContact CZ-CD1 3.79Å; F237-F285 HydrophobicContact CZ-CD1 3.79Å; F237-F285 HydrophobicContact CZ-CE1 4.34Å; F237-W288 HydrophobicContact CB-CG 4.43Å; F237-W288 HydrophobicContact CD2-CD2 4.24Å; F237-W288 HydrophobicContact CD2-CE3 4.17Å; F237-W288 HydrophobicContact CD2-CZ3 4.39Å
238F97.8Very high97.3Very high0 Ų021.5 Ų21.50%011%0.106CC..Hα-helixtrans-76.2-50166.6154.2-101.5000112.5F67 L199 L202 L234 F235 W236 H240 P241 E242F67-F238 HydrophobicContact CE1-CZ 4.06Å; F67-F238 HydrophobicContact CZ-CE1 4.25Å; F67-F238 AromaticContact CZ-CZ 3.94Å; F67-F238 HydrophobicContact CZ-CZ 3.94Å; L199-F238 HydrophobicContact CD2-CD2 4.07Å; L199-F238 HydrophobicContact CD2-CE2 3.49Å; L199-F238 VanDerWaalsContact CD2-CE2 3.49Å; L199-F238 HydrophobicContact CD2-CZ 4.27Å; L199-F238 HydrophobicContact CG-CE2 4.33Å; L202-F238 HydrophobicContact CB-CB 3.86Å; L202-F238 HydrophobicContact CB-CD1 3.87Å; L202-F238 HydrophobicContact CB-CD2 3.97Å; L202-F238 HydrophobicContact CB-CE1 4.46Å; L202-F238 HydrophobicContact CB-CG 3.59Å; L202-F238 HydrophobicContact CD1-CD1 3.79Å; L202-F238 HydrophobicContact CD1-CE1 4.15Å; L202-F238 HydrophobicContact CD1-CG 4.39Å; L202-F238 HydrophobicContact CD2-CD1 3.89Å; L202-F238 HydrophobicContact CD2-CD2 4.36Å; L202-F238 HydrophobicContact CD2-CE1 3.64Å; L202-F238 HydrophobicContact CD2-CE2 4.13Å; L202-F238 HydrophobicContact CD2-CG 4.25Å; L202-F238 HydrophobicContact CD2-CZ 3.76Å; L202-F238 HydrophobicContact CG-CD1 4.05Å; L202-F238 HydrophobicContact CG-CE1 4.29Å; L202-F238 HydrophobicContact CG-CG 4.28Å; L234-F238 PolarHBondContact O-N 3.22Å; F235-F238 CarbonylContact O-C 3.54Å; F235-F238 WeakPolarHBondContact O-CB 3.3Å; F235-F238 PolarHBondContact O-N 3.32Å; W236-F238 PolarHBondContact O-N 3.33Å; F238-H240 VanDerWaalsContact C-N 3.33Å; F238-H240 PolarHBondContact O-N 3.37Å; F238-P241 VanDerWaalsContact O-CD 3.25Å; F238-P241 WeakPolarHBondContact O-CD 3.37Å; F238-E242 HydrophobicContact CD2-CB 4.37Å; F238-E242 HydrophobicContact CE1-CB 4.14Å; F238-E242 HydrophobicContact CE1-CG 4.22Å; F238-E242 HydrophobicContact CE2-CB 3.78Å; F238-E242 HydrophobicContact CE2-CG 3.96Å; F238-E242 VanDerWaalsContact CE2-OE2 3.26Å; F238-E242 WeakPolarHBondContact CE2-OE2 3.45Å; F238-E242 HydrophobicContact CZ-CB 3.66Å; F238-E242 HydrophobicContact CZ-CG 3.52Å; F238-E242 WeakPolarHBondContact O-CB 3.12Å; F238-E242 PolarHBondContact O-N 3.32Å
239G96.3Very high97.4Very high0 Ų020.2 Ų20.20%010%0.098CC..Hα-helixtrans-67.2-30.8-163.800000113.6F235 W236 E242 V243F235-G239 WeakPolarHBondContact O-CA 3.26Å; F235-G239 PolarHBondContact O-N 2.83Å; W236-G239 PolarHBondContact O-N 2.92Å; W236-G239 VanDerWaalsContact O-N 3.1Å; G239-E242 WeakPolarHBondContact O-CB 3.5Å; G239-E242 PolarHBondContact O-N 3.3Å; G239-V243 WeakPolarHBondContact O-CG1 3.5Å; G239-V243 PolarHBondContact O-N 3.4Å
240H97Very high97.4Very high9 Ų917.6 Ų17.64%0.0428%0.084CC..Hα-helixtrans-74.6-47.5175.7-165.980.6000113W236 F238 E242 V243 Y244 G284 V287 W288 H290 H291W236-H240 PolarHBondContact O-N 3.34Å; F238-H240 VanDerWaalsContact C-N 3.33Å; F238-H240 PolarHBondContact O-N 3.37Å; H240-E242 PolarHBondContact O-N 2.97Å; H240-V243 WeakPolarHBondContact O-CG2 3.35Å; H240-V243 PolarHBondContact O-N 2.95Å; H240-Y244 AromaticContact CD2-CE2 3.5Å; H240-Y244 VanDerWaalsContact CD2-CE2 3.5Å; H240-Y244 WeakPolarHBondContact CD2-CE2 3.36Å; H240-Y244 AromaticContact CE1-CZ 3.89Å; H240-Y244 PolarHBondContact CE1-OH 3.14Å; H240-Y244 AromaticContact NE2-CE2 3.02Å; H240-Y244 WeakPolarHBondContact NE2-CE2 3.42Å; H240-Y244 AromaticContact NE2-CZ 3.17Å; H240-Y244 PolarHBondContact NE2-OH 2.96Å; H240-G284 PolarHBondContact CD2-O 3.44Å; H240-V287 WeakPolarHBondContact CD2-CG2 3.36Å; H240-V287 WeakPolarHBondContact NE2-CG2 3.32Å; H240-W288 HydrophobicContact CB-CB 4.08Å; H240-H290 AromaticContact CE1-CE1 3.03Å; H240-H290 PolarHBondContact CE1-CE1 3.46Å; H240-H290 AromaticContact CE1-NE2 3.29Å; H240-H290 PolarHBondContact CE1-NE2 3.09Å; H240-H290 VanDerWaalsContact CE1-NE2 3.29Å; H240-H290 AromaticContact CG-CE1 3.81Å; H240-H290 AromaticContact CG-NE2 3.99Å; H240-H290 AromaticContact ND1-CE1 2.99Å; H240-H290 PolarHBondContact ND1-CE1 3.49Å; H240-H290 AromaticContact ND1-NE2 2.93Å; H240-H290 PolarHBondContact ND1-NE2 3.43Å; H240-H290 AromaticContact NE2-CE1 3.75Å; H240-H291 AromaticContact ND1-NE2 3.32Å; H240-H291 PolarHBondContact ND1-NE2 3.21Å
241P97.8Very high97.4Very high0 Ų014.5 Ų14.50%07%0.068CC..Hα-helixtrans-53.4-37.6165.5-30.336.3000113.7F237 F238 V243 Y244 I245 G284 F285F237-P241 WeakPolarHBondContact O-CD 3.23Å; F237-P241 WeakPolarHBondContact O-CG 3.33Å; F238-P241 VanDerWaalsContact O-CD 3.25Å; F238-P241 WeakPolarHBondContact O-CD 3.37Å; P241-V243 PolarHBondContact O-N 2.88Å; P241-Y244 WeakPolarHBondContact O-CA 3.37Å; P241-Y244 WeakPolarHBondContact O-CB 3.44Å; P241-Y244 PolarHBondContact O-N 2.95Å; P241-I245 WeakPolarHBondContact O-CG1 3.35Å; P241-I245 PolarHBondContact O-N 3.04Å; P241-G284 WeakPolarHBondContact CD-O 3.49Å; P241-F285 HydrophobicContact CB-CE1 4.09Å; P241-F285 HydrophobicContact CB-CZ 4.34Å; P241-F285 HydrophobicContact CG-CD1 3.65Å; P241-F285 HydrophobicContact CG-CE1 3.64Å; P241-F285 HydrophobicContact CG-CG 4.3Å; P241-F285 HydrophobicContact CG-CZ 4.3Å
242E96.5Very high97.4Very high2 Ų214.3 Ų14.31%0.0097%0.067CC..Hα-helixtrans-58.8-43.8178.4-175.156.1-143.200112.2M71 F238 G239 H240 Y244 I245 L246M71-E242 WeakPolarHBondContact CE-OE1 3.46Å; F238-E242 HydrophobicContact CD2-CB 4.37Å; F238-E242 HydrophobicContact CE1-CB 4.14Å; F238-E242 HydrophobicContact CE1-CG 4.22Å; F238-E242 HydrophobicContact CE2-CB 3.78Å; F238-E242 HydrophobicContact CE2-CG 3.96Å; F238-E242 VanDerWaalsContact CE2-OE2 3.26Å; F238-E242 WeakPolarHBondContact CE2-OE2 3.45Å; F238-E242 HydrophobicContact CZ-CB 3.66Å; F238-E242 HydrophobicContact CZ-CG 3.52Å; F238-E242 WeakPolarHBondContact O-CB 3.12Å; F238-E242 PolarHBondContact O-N 3.32Å; G239-E242 WeakPolarHBondContact O-CB 3.5Å; G239-E242 PolarHBondContact O-N 3.3Å; H240-E242 PolarHBondContact O-N 2.97Å; E242-Y244 PolarHBondContact O-N 2.73Å; E242-Y244 VanDerWaalsContact O-N 3.15Å; E242-I245 VanDerWaalsContact O-CB 3.31Å; E242-I245 WeakPolarHBondContact O-CB 3.31Å; E242-I245 PolarHBondContact O-N 3.22Å; E242-I245 WeakPolarHBondContact OE2-CD1 3.49Å; E242-L246 HydrophobicContact CG-CD1 4.4Å; E242-L246 VanDerWaalsContact O-CG 3.28Å; E242-L246 WeakPolarHBondContact O-CG 3.47Å; E242-L246 PolarHBondContact O-N 3.46Å
243V95.3Very high97.4Very high25 Ų2512.6 Ų12.615%0.1526%0.059CC..Hα-helixtrans-64.2-24.3177.7-57.40000112.8G239 H240 P241 F377G239-V243 WeakPolarHBondContact O-CG1 3.5Å; G239-V243 PolarHBondContact O-N 3.4Å; H240-V243 WeakPolarHBondContact O-CG2 3.35Å; H240-V243 PolarHBondContact O-N 2.95Å; P241-V243 PolarHBondContact O-N 2.88Å; V243-F377 HydrophobicContact CB-CE2 4.25Å; V243-F377 HydrophobicContact CG1-CE2 3.49Å; V243-F377 VanDerWaalsContact CG1-CE2 3.49Å; V243-F377 HydrophobicContact CG1-CZ 3.95Å
244Y96Very high97.4Very high32 Ų329.5 Ų9.513%0.1255%0.045CC..Hα-helixtrans-79.7-37.8170.3-65.8-40.9000113.7H240 P241 E242 L246 I247 L248 I280 I312H240-Y244 AromaticContact CD2-CE2 3.5Å; H240-Y244 VanDerWaalsContact CD2-CE2 3.5Å; H240-Y244 WeakPolarHBondContact CD2-CE2 3.36Å; H240-Y244 AromaticContact CE1-CZ 3.89Å; H240-Y244 PolarHBondContact CE1-OH 3.14Å; H240-Y244 AromaticContact NE2-CE2 3.02Å; H240-Y244 WeakPolarHBondContact NE2-CE2 3.42Å; H240-Y244 AromaticContact NE2-CZ 3.17Å; H240-Y244 PolarHBondContact NE2-OH 2.96Å; P241-Y244 WeakPolarHBondContact O-CA 3.37Å; P241-Y244 WeakPolarHBondContact O-CB 3.44Å; P241-Y244 PolarHBondContact O-N 2.95Å; E242-Y244 PolarHBondContact O-N 2.73Å; E242-Y244 VanDerWaalsContact O-N 3.15Å; Y244-L246 PolarHBondContact O-N 3.44Å; Y244-I247 HydrophobicContact CD1-CG2 4.21Å; Y244-I247 PolarHBondContact O-N 2.75Å; Y244-L248 WeakPolarHBondContact O-CB 3.38Å; Y244-L248 VanDerWaalsContact O-CG 3.27Å; Y244-L248 WeakPolarHBondContact O-CG 3.48Å; Y244-L248 PolarHBondContact O-N 3Å; Y244-I280 HydrophobicContact CD1-CG2 3.68Å; Y244-I280 HydrophobicContact CD2-CG2 4.03Å; Y244-I280 HydrophobicContact CE1-CG2 3.98Å; Y244-I280 HydrophobicContact CE2-CG2 4.27Å; Y244-I280 HydrophobicContact CG-CG2 3.75Å; Y244-I312 HydrophobicContact CE1-CG2 4.5Å; Y244-I312 HydrophobicContact CE2-CD1 4.36Å; Y244-I312 WeakPolarHBondContact OH-CD1 3.47Å
245I96.1Very high97.3Very high2 Ų28 Ų81%0.014%0.037CC..Hα-helixtrans-51.8-41.2170.3-74.3157.7000110.2M71 T191 L194 L195 P241 E242 I247 P249M71-I245 HydrophobicContact CG-CG2 4.47Å; T191-I245 HydrophobicContact CG2-CB 3.98Å; T191-I245 HydrophobicContact CG2-CG1 4.04Å; T191-I245 HydrophobicContact CG2-CG2 3.6Å; L194-I245 HydrophobicContact CB-CD1 3.74Å; L194-I245 HydrophobicContact CB-CG1 3.52Å; L194-I245 HydrophobicContact CD1-CG1 3.96Å; L194-I245 HydrophobicContact CG-CG1 4.4Å; L195-I245 HydrophobicContact CB-CD1 4.45Å; L195-I245 HydrophobicContact CD1-CG2 4.32Å; L195-I245 HydrophobicContact CD2-CD1 3.76Å; L195-I245 HydrophobicContact CD2-CG1 4.39Å; L195-I245 HydrophobicContact CD2-CG2 3.91Å; L195-I245 HydrophobicContact CG-CD1 3.79Å; L195-I245 HydrophobicContact CG-CG1 4.08Å; L195-I245 HydrophobicContact CG-CG2 3.98Å; P241-I245 WeakPolarHBondContact O-CG1 3.35Å; P241-I245 PolarHBondContact O-N 3.04Å; E242-I245 VanDerWaalsContact O-CB 3.31Å; E242-I245 WeakPolarHBondContact O-CB 3.31Å; E242-I245 PolarHBondContact O-N 3.22Å; E242-I245 WeakPolarHBondContact OE2-CD1 3.49Å; I245-I247 PolarHBondContact O-N 3.27Å; I245-P249 WeakPolarHBondContact O-CD 3.33Å
246L94.3Very high97.2Very high4 Ų48.3 Ų8.32%0.0214%0.038CC..THydrogen-bonded Turntrans-72-19.6179.6-60.9169.3000114.3I66 V70 M71 M74 E242 Y244 L381I66-L246 HydrophobicContact CG1-CD1 4.41Å; I66-L246 HydrophobicContact CG2-CD1 3.88Å; I66-L246 HydrophobicContact CG2-CD2 4.19Å; V70-L246 HydrophobicContact CB-CD2 4.12Å; V70-L246 HydrophobicContact CG1-CB 4.29Å; V70-L246 HydrophobicContact CG1-CD2 3.6Å; V70-L246 HydrophobicContact CG1-CG 4.49Å; M71-L246 HydrophobicContact CG-CD2 3.71Å; M74-L246 WeakPolarHBondContact CE-O 3.38Å; E242-L246 HydrophobicContact CG-CD1 4.4Å; E242-L246 VanDerWaalsContact O-CG 3.28Å; E242-L246 WeakPolarHBondContact O-CG 3.47Å; E242-L246 PolarHBondContact O-N 3.46Å; Y244-L246 PolarHBondContact O-N 3.44Å; L246-L381 HydrophobicContact CB-CD1 3.68Å; L246-L381 HydrophobicContact CD1-CD1 3.5Å; L246-L381 VanDerWaalsContact CD1-CD1 3.5Å; L246-L381 HydrophobicContact CG-CD1 4.13Å
247I97.1Very high97Very high6 Ų67.7 Ų7.73%0.0314%0.036CC..THydrogen-bonded Turntrans-115-28.2-174.4-162.463.1000114.4Y244 I245 G250 F251 F344 F348Y244-I247 HydrophobicContact CD1-CG2 4.21Å; Y244-I247 PolarHBondContact O-N 2.75Å; I245-I247 PolarHBondContact O-N 3.27Å; I247-G250 CarbonylContact O-C 3.49Å; I247-G250 VanDerWaalsContact O-CA 3.29Å; I247-G250 WeakPolarHBondContact O-CA 3.43Å; I247-G250 PolarHBondContact O-N 2.77Å; I247-F251 HydrophobicContact CB-CZ 4.49Å; I247-F251 HydrophobicContact CD1-CE1 4.39Å; I247-F251 HydrophobicContact CG1-CD1 4.14Å; I247-F251 HydrophobicContact CG1-CE1 3.56Å; I247-F251 HydrophobicContact CG1-CE2 4.48Å; I247-F251 HydrophobicContact CG1-CZ 3.75Å; I247-F251 HydrophobicContact CG2-CE2 4.03Å; I247-F251 HydrophobicContact CG2-CZ 3.91Å; I247-F251 PolarHBondContact O-N 3.41Å; I247-F344 HydrophobicContact CD1-CE2 3.87Å; I247-F344 HydrophobicContact CD1-CZ 4.18Å; I247-F348 HydrophobicContact CD1-CD2 4.2Å; I247-F348 HydrophobicContact CD1-CE2 4.1Å; I247-F348 HydrophobicContact CG1-CD2 4.31Å; I247-F348 HydrophobicContact CG1-CE2 3.72Å; I247-F348 HydrophobicContact CG1-CZ 4.46Å
248L98Very high96.9Very high0 Ų05 Ų50%02%0.024CC..Hα-helixtrans-56.2-46.5-178-75.6172.7000112.6S187 I190 T191 L194 Y244 G250 F251 G252 M277 I280S187-L248 WeakPolarHBondContact CB-O 3.32Å; I190-L248 HydrophobicContact CB-CD1 4.33Å; I190-L248 HydrophobicContact CG2-CD1 3.67Å; T191-L248 WeakPolarHBondContact OG1-CB 3.48Å; L194-L248 HydrophobicContact CD1-CD1 3.69Å; Y244-L248 WeakPolarHBondContact O-CB 3.38Å; Y244-L248 VanDerWaalsContact O-CG 3.27Å; Y244-L248 WeakPolarHBondContact O-CG 3.48Å; Y244-L248 PolarHBondContact O-N 3Å; L248-G250 PolarHBondContact O-N 2.95Å; L248-F251 HydrophobicContact CD2-CD2 3.85Å; L248-F251 HydrophobicContact CD2-CE2 4.12Å; L248-F251 WeakPolarHBondContact O-CA 3.3Å; L248-F251 VanDerWaalsContact O-CB 3.29Å; L248-F251 WeakPolarHBondContact O-CB 3.44Å; L248-F251 PolarHBondContact O-N 3.34Å; L248-G252 PolarHBondContact O-N 3.26Å; L248-M277 HydrophobicContact CD2-CB 4.33Å; L248-M277 HydrophobicContact CD2-CG 4.25Å; L248-I280 HydrophobicContact CD2-CB 4.49Å; L248-I280 HydrophobicContact CD2-CG2 4.14Å
249P98.3Very high96.7Very high0 Ų05.7 Ų5.70%03%0.029CC..Hα-helixtrans-61.6-34.9175.1-22.435.7000112.1M74 I75 F184 S187 T191 I245 F251 G252 M253M74-P249 HydrophobicContact CB-CB 4.15Å; M74-P249 HydrophobicContact CB-CG 4.49Å; M74-P249 HydrophobicContact SD-CB 4.09Å; I75-P249 HydrophobicContact CD1-CB 4.3Å; I75-P249 HydrophobicContact CD1-CG 3.43Å; I75-P249 VanDerWaalsContact CD1-CG 3.43Å; I75-P249 HydrophobicContact CG1-CG 4.16Å; F184-P249 HydrophobicContact CE2-CB 4.27Å; S187-P249 WeakPolarHBondContact OG-CA 3.47Å; T191-P249 HydrophobicContact CG2-CG 4.38Å; T191-P249 WeakPolarHBondContact OG1-CD 3.43Å; I245-P249 WeakPolarHBondContact O-CD 3.33Å; P249-F251 VanDerWaalsContact C-N 3.33Å; P249-F251 PolarHBondContact O-N 2.97Å; P249-G252 WeakPolarHBondContact O-CA 3.34Å; P249-G252 PolarHBondContact O-N 3.28Å; P249-G252 VanDerWaalsContact O-N 3.11Å; P249-M253 WeakPolarHBondContact O-CG 3.37Å; P249-M253 PolarHBondContact O-N 3.38Å
250G97.8Very high96.5Very high0 Ų07.6 Ų7.60%04%0.036CC..Hα-helixtrans-57.1-45.8171.400000112I247 L248 G252 M253 I254 A388I247-G250 CarbonylContact O-C 3.49Å; I247-G250 VanDerWaalsContact O-CA 3.29Å; I247-G250 WeakPolarHBondContact O-CA 3.43Å; I247-G250 PolarHBondContact O-N 2.77Å; L248-G250 PolarHBondContact O-N 2.95Å; G250-G252 VanDerWaalsContact C-N 3.29Å; G250-G252 PolarHBondContact O-N 3.42Å; G250-M253 PolarHBondContact O-N 2.87Å; G250-I254 WeakPolarHBondContact O-CB 3.47Å; G250-I254 WeakPolarHBondContact O-CG1 3.23Å; G250-I254 PolarHBondContact O-N 2.72Å; G250-A388 VanDerWaalsContact CA-CB 3.47Å
251F98.2Very high96.3Very high4 Ų49.4 Ų9.42%0.0184%0.043CC..Hα-helixtrans-60.5-39.2173.5-59.3-26000113.1I247 L248 P249 S255 I280 K319 W323 F344 F348I247-F251 HydrophobicContact CB-CZ 4.49Å; I247-F251 HydrophobicContact CD1-CE1 4.39Å; I247-F251 HydrophobicContact CG1-CD1 4.14Å; I247-F251 HydrophobicContact CG1-CE1 3.56Å; I247-F251 HydrophobicContact CG1-CE2 4.48Å; I247-F251 HydrophobicContact CG1-CZ 3.75Å; I247-F251 HydrophobicContact CG2-CE2 4.03Å; I247-F251 HydrophobicContact CG2-CZ 3.91Å; I247-F251 PolarHBondContact O-N 3.41Å; L248-F251 HydrophobicContact CD2-CD2 3.85Å; L248-F251 HydrophobicContact CD2-CE2 4.12Å; L248-F251 WeakPolarHBondContact O-CA 3.3Å; L248-F251 VanDerWaalsContact O-CB 3.29Å; L248-F251 WeakPolarHBondContact O-CB 3.44Å; L248-F251 PolarHBondContact O-N 3.34Å; P249-F251 VanDerWaalsContact C-N 3.33Å; P249-F251 PolarHBondContact O-N 2.97Å; F251-S255 WeakPolarHBondContact O-CB 3.34Å; F251-S255 PolarHBondContact O-N 3.37Å; F251-S255 PolarHBondContact O-OG 2.93Å; F251-I280 HydrophobicContact CE2-CD1 4.11Å; F251-K319 VanDerWaalsContact CB-CE 3.43Å; F251-K319 VanDerWaalsContact CB-NZ 3.34Å; F251-K319 HydrophobicContact CD2-CD 4.02Å; F251-K319 HydrophobicContact CE2-CD 4.32Å; F251-K319 VanDerWaalsContact CG-CE 3.43Å; F251-W323 HydrophobicContact CB-CH2 4.17Å; F251-W323 HydrophobicContact CB-CZ2 3.9Å; F251-W323 AromaticContact CD1-CH2 3.47Å; F251-W323 HydrophobicContact CD1-CH2 3.47Å; F251-W323 VanDerWaalsContact CD1-CH2 3.47Å; F251-W323 HydrophobicContact CD1-CZ2 4.08Å; F251-W323 HydrophobicContact CE1-CH2 4.03Å; F251-W323 AromaticContact CG-CH2 4Å; F251-W323 HydrophobicContact CG-CH2 4Å; F251-W323 HydrophobicContact CG-CZ2 4.24Å; F251-F344 HydrophobicContact CD1-CE1 4.13Å; F251-F344 AromaticContact CD1-CZ 3.63Å; F251-F344 HydrophobicContact CD1-CZ 3.63Å; F251-F344 HydrophobicContact CE1-CE1 4.37Å; F251-F344 AromaticContact CE1-CZ 3.78Å; F251-F344 HydrophobicContact CE1-CZ 3.78Å; F251-F348 HydrophobicContact CE1-CD1 4.32Å; F251-F348 HydrophobicContact CE1-CD2 4.39Å; F251-F348 AromaticContact CE1-CE1 3.76Å; F251-F348 HydrophobicContact CE1-CE1 3.76Å; F251-F348 AromaticContact CE1-CE2 3.84Å; F251-F348 HydrophobicContact CE1-CE2 3.84Å; F251-F348 AromaticContact CE1-CZ 3.52Å; F251-F348 HydrophobicContact CE1-CZ 3.52Å; F251-F348 AromaticContact CZ-CE1 3.9Å; F251-F348 HydrophobicContact CZ-CE1 3.9Å; F251-F348 AromaticContact CZ-CE2 4Å; F251-F348 HydrophobicContact CZ-CE2 4Å; F251-F348 AromaticContact CZ-CZ 3.42Å; F251-F348 HydrophobicContact CZ-CZ 3.42Å; F251-F348 VanDerWaalsContact CZ-CZ 3.42Å
252G98Very high96Very high0 Ų010 Ų100%05%0.047CC..Hα-helixtrans-58.3-52.4173.300000111.4L248 P249 G250 I254 S255 H256L248-G252 PolarHBondContact O-N 3.26Å; P249-G252 WeakPolarHBondContact O-CA 3.34Å; P249-G252 PolarHBondContact O-N 3.28Å; P249-G252 VanDerWaalsContact O-N 3.11Å; G250-G252 VanDerWaalsContact C-N 3.29Å; G250-G252 PolarHBondContact O-N 3.42Å; G252-I254 PolarHBondContact O-N 3.41Å; G252-S255 WeakPolarHBondContact O-CB 3.42Å; G252-S255 PolarHBondContact O-N 2.89Å; G252-H256 PolarHBondContact O-CD2 2.64Å; G252-H256 PolarHBondContact O-N 3.16Å; G252-H256 VanDerWaalsContact O-N 3.11Å
253M98.3Very high95.6Very high0 Ų013 Ų130%08%0.078CC..Hα-helixtrans-59.7-47.2-179.4-69.3-172.2-75.700112.3M74 F78 F184 P249 G250 S255 H256 I257 A388 W396M74-M253 HydrophobicContact CG-CE 3.83Å; M74-M253 HydrophobicContact SD-CE 3.59Å; M74-M253 VanDerWaalsContact SD-CE 3.59Å; F78-M253 HydrophobicContact CB-SD 4.42Å; F78-M253 HydrophobicContact CD1-SD 4.15Å; F78-M253 HydrophobicContact CD2-CE 4.42Å; F78-M253 HydrophobicContact CD2-SD 3.7Å; F78-M253 HydrophobicContact CE1-SD 4.36Å; F78-M253 HydrophobicContact CE2-SD 3.92Å; F78-M253 HydrophobicContact CG-SD 3.84Å; F78-M253 HydrophobicContact CZ-SD 4.25Å; F184-M253 HydrophobicContact CD2-CG 3.72Å; F184-M253 HydrophobicContact CE2-CG 3.62Å; F184-M253 HydrophobicContact CE2-SD 4.45Å; P249-M253 WeakPolarHBondContact O-CG 3.37Å; P249-M253 PolarHBondContact O-N 3.38Å; G250-M253 PolarHBondContact O-N 2.87Å; M253-S255 VanDerWaalsContact C-N 3.28Å; M253-S255 PolarHBondContact O-N 3.47Å; M253-H256 PolarHBondContact O-N 3.47Å; M253-I257 WeakPolarHBondContact O-CG1 3.39Å; M253-I257 PolarHBondContact O-N 2.91Å; M253-A388 HydrophobicContact CE-CB 3.96Å; M253-W396 HydrophobicContact CB-CH2 4.02Å; M253-W396 HydrophobicContact CB-CZ3 3.91Å; M253-W396 HydrophobicContact CG-CH2 3.95Å; M253-W396 HydrophobicContact CG-CZ3 3.66Å; M253-W396 HydrophobicContact SD-CZ3 4.01Å
254I98.3Very high95.3Very high0 Ų015.1 Ų15.10%09%0.085CC..Hα-helixtrans-62.2-38.7178.9-63.7-72.1000111G250 G252 H256 I257 V258 W323 A341 F344 I345 A388G250-I254 WeakPolarHBondContact O-CB 3.47Å; G250-I254 WeakPolarHBondContact O-CG1 3.23Å; G250-I254 PolarHBondContact O-N 2.72Å; G252-I254 PolarHBondContact O-N 3.41Å; I254-H256 VanDerWaalsContact C-N 3.33Å; I254-H256 PolarHBondContact O-N 3.32Å; I254-I257 PolarHBondContact O-N 3.23Å; I254-V258 HydrophobicContact CG2-CG2 4.12Å; I254-V258 VanDerWaalsContact O-CB 3.28Å; I254-V258 WeakPolarHBondContact O-CB 3.28Å; I254-V258 VanDerWaalsContact O-CG2 3.25Å; I254-V258 WeakPolarHBondContact O-CG2 3.28Å; I254-V258 PolarHBondContact O-N 3.13Å; I254-W323 HydrophobicContact CB-CZ2 4.42Å; I254-W323 HydrophobicContact CG2-CD2 4.08Å; I254-W323 HydrophobicContact CG2-CG 4.42Å; I254-W323 HydrophobicContact CG2-CZ2 4.23Å; I254-A341 HydrophobicContact CD1-CB 4.1Å; I254-F344 HydrophobicContact CB-CD1 4.2Å; I254-F344 HydrophobicContact CB-CE1 4.33Å; I254-F344 HydrophobicContact CD1-CB 3.6Å; I254-F344 HydrophobicContact CD1-CD1 3.77Å; I254-F344 HydrophobicContact CD1-CD2 4.13Å; I254-F344 HydrophobicContact CD1-CG 3.55Å; I254-F344 HydrophobicContact CG1-CB 4.31Å; I254-F344 HydrophobicContact CG1-CD1 3.55Å; I254-F344 HydrophobicContact CG1-CD2 4.09Å; I254-F344 HydrophobicContact CG1-CE1 3.84Å; I254-F344 HydrophobicContact CG1-CE2 4.31Å; I254-F344 HydrophobicContact CG1-CG 3.7Å; I254-F344 HydrophobicContact CG1-CZ 4.22Å; I254-F344 HydrophobicContact CG2-CD1 3.89Å; I254-F344 HydrophobicContact CG2-CE1 4.25Å; I254-I345 HydrophobicContact CG2-CG1 4.32Å; I254-A388 HydrophobicContact CD1-CB 4.3Å; I254-A388 HydrophobicContact CG1-CB 4.1Å
255S97.4Very high94.8Very high2 Ų221.7 Ų21.71%0.01411%0.114CC..Hα-helixtrans-64.1-38.1177.1-53.30000112.6F251 G252 M253 T259 M273 W323F251-S255 WeakPolarHBondContact O-CB 3.34Å; F251-S255 PolarHBondContact O-N 3.37Å; F251-S255 PolarHBondContact O-OG 2.93Å; G252-S255 WeakPolarHBondContact O-CB 3.42Å; G252-S255 PolarHBondContact O-N 2.89Å; M253-S255 VanDerWaalsContact C-N 3.28Å; M253-S255 PolarHBondContact O-N 3.47Å; S255-T259 VanDerWaalsContact O-CB 3.3Å; S255-T259 WeakPolarHBondContact O-CB 3.06Å; S255-T259 PolarHBondContact O-N 3.47Å; S255-T259 VanDerWaalsContact O-N 3.11Å; S255-T259 PolarHBondContact O-OG1 3.38Å; S255-M273 VanDerWaalsContact OG-CE 3.23Å; S255-M273 WeakPolarHBondContact OG-CE 3.4Å; S255-W323 PolarHBondContact OG-NE1 3.01Å
256H95.3Very high94.5Very high16 Ų1627.4 Ų27.47%0.07414%0.141CC..Hα-helixtrans-67-49.6174.4-86-103.4000111.5P182 F184 G252 M253 I254 V258 T259 Y260 W396P182-H256 WeakPolarHBondContact CB-CE1 3.3Å; P182-H256 VanDerWaalsContact CB-NE2 3.28Å; P182-H256 WeakPolarHBondContact CB-NE2 3.46Å; F184-H256 WeakPolarHBondContact CB-NE2 3.31Å; F184-H256 PolarHBondContact N-NE2 3.12Å; G252-H256 PolarHBondContact O-CD2 2.64Å; G252-H256 PolarHBondContact O-N 3.16Å; G252-H256 VanDerWaalsContact O-N 3.11Å; M253-H256 PolarHBondContact O-N 3.47Å; I254-H256 VanDerWaalsContact C-N 3.33Å; I254-H256 PolarHBondContact O-N 3.32Å; H256-V258 PolarHBondContact O-N 2.98Å; H256-T259 PolarHBondContact O-N 3.41Å; H256-Y260 VanDerWaalsContact O-CB 3.24Å; H256-Y260 WeakPolarHBondContact O-CB 3.42Å; H256-Y260 PolarHBondContact O-N 3.49Å; H256-W396 HydrophobicContact CB-CH2 4.08Å; H256-W396 HydrophobicContact CB-CZ2 3.94Å
257I95.6Very high94.5Very high0 Ų028 Ų280%015%0.145CC..Hα-helixtrans-59.6-48.7-179.7-64.7164.1000110.5M253 I254 T259 Y260 Y261 A337 A341 H395M253-I257 WeakPolarHBondContact O-CG1 3.39Å; M253-I257 PolarHBondContact O-N 2.91Å; I254-I257 PolarHBondContact O-N 3.23Å; I257-T259 PolarHBondContact O-N 3.1Å; I257-Y260 PolarHBondContact O-N 3.09Å; I257-Y261 HydrophobicContact CG2-CD2 3.79Å; I257-Y261 HydrophobicContact CG2-CE2 4.04Å; I257-Y261 VanDerWaalsContact O-CD2 3.31Å; I257-Y261 WeakPolarHBondContact O-CD2 3.22Å; I257-Y261 PolarHBondContact O-N 2.94Å; I257-A337 HydrophobicContact CG2-CB 4.11Å; I257-A341 HydrophobicContact CG2-CB 3.9Å; I257-H395 HydrophobicContact CD1-CB 4.41Å; I257-H395 HydrophobicContact CG1-CB 4.06Å
258V95.8Very high94.5Very high3 Ų333 Ų332%0.01817%0.167CC..Hα-helixtrans-59.6-46.2179.5164.40000111.1I254 H256 S262 T326 L327 A341 I345I254-V258 HydrophobicContact CG2-CG2 4.12Å; I254-V258 VanDerWaalsContact O-CB 3.28Å; I254-V258 WeakPolarHBondContact O-CB 3.28Å; I254-V258 VanDerWaalsContact O-CG2 3.25Å; I254-V258 WeakPolarHBondContact O-CG2 3.28Å; I254-V258 PolarHBondContact O-N 3.13Å; H256-V258 PolarHBondContact O-N 2.98Å; V258-S262 WeakPolarHBondContact O-CB 3.11Å; V258-S262 PolarHBondContact O-N 3.32Å; V258-S262 VanDerWaalsContact O-N 3.1Å; V258-S262 PolarHBondContact O-OG 2.72Å; V258-T326 HydrophobicContact CG1-CG2 3.72Å; V258-L327 HydrophobicContact CB-CD2 4.49Å; V258-L327 HydrophobicContact CG1-CD1 4.46Å; V258-L327 HydrophobicContact CG1-CD2 3.82Å; V258-L327 HydrophobicContact CG1-CG 3.78Å; V258-L327 HydrophobicContact CG2-CD2 4.4Å; V258-A341 HydrophobicContact CG2-CB 4.15Å; V258-I345 HydrophobicContact CG2-CD1 4.24Å
259T93.6Very high94.3Very high15 Ų1534.8 Ų34.89%0.09219%0.186CC..Hα-helixtrans-65-47.7179.5-56.60000111.5S255 H256 I257 S262 G263 K264S255-T259 VanDerWaalsContact O-CB 3.3Å; S255-T259 WeakPolarHBondContact O-CB 3.06Å; S255-T259 PolarHBondContact O-N 3.47Å; S255-T259 VanDerWaalsContact O-N 3.11Å; S255-T259 PolarHBondContact O-OG1 3.38Å; H256-T259 PolarHBondContact O-N 3.41Å; I257-T259 PolarHBondContact O-N 3.1Å; T259-S262 PolarHBondContact O-N 3.37Å; T259-G263 PolarHBondContact O-N 3.37Å; T259-K264 WeakPolarHBondContact CG2-O 3.14Å; T259-K264 PolarHBondContact O-N 3.26Å
260Y92.3Very high94.2Very high40 Ų4035.9 Ų35.916%0.15719%0.19CC..Hα-helixtrans-56.7-54.3-179.2-175.9-90.6000111.7H256 I257 S262 G263 H395 E486H256-Y260 VanDerWaalsContact O-CB 3.24Å; H256-Y260 WeakPolarHBondContact O-CB 3.42Å; H256-Y260 PolarHBondContact O-N 3.49Å; I257-Y260 PolarHBondContact O-N 3.09Å; Y260-S262 VanDerWaalsContact C-N 3.3Å; Y260-S262 PolarHBondContact O-N 2.9Å; Y260-G263 PolarHBondContact O-N 2.88Å; Y260-G263 VanDerWaalsContact O-N 3.17Å; Y260-H395 AromaticContact CD1-CE1 3.65Å; Y260-H395 AromaticContact CD2-CE1 3.98Å; Y260-H395 AromaticContact CE1-CE1 3.98Å; Y260-H395 AromaticContact CG-CE1 3.66Å; Y260-E486 WeakPolarHBondContact CE2-O 3.22Å; Y260-E486 PolarHBondContact OH-N 3.37Å; Y260-E486 PolarHBondContact OH-O 3.18Å
261Y92.1Very high94.2Very high47 Ų4739.8 Ų39.818%0.18421%0.209CC..Hα-helixtrans-77.8-13.3-177.1-72.9-77.6000114.1I257 G263 S335 A337 V338 H395I257-Y261 HydrophobicContact CG2-CD2 3.79Å; I257-Y261 HydrophobicContact CG2-CE2 4.04Å; I257-Y261 VanDerWaalsContact O-CD2 3.31Å; I257-Y261 WeakPolarHBondContact O-CD2 3.22Å; I257-Y261 PolarHBondContact O-N 2.94Å; Y261-G263 VanDerWaalsContact C-N 3.3Å; Y261-S335 WeakPolarHBondContact CD1-OG 3.3Å; Y261-S335 WeakPolarHBondContact CE1-OG 3.43Å; Y261-A337 HydrophobicContact CD2-CB 4.4Å; Y261-A337 HydrophobicContact CE2-CB 3.53Å; Y261-V338 HydrophobicContact CD1-CG2 3.92Å; Y261-V338 HydrophobicContact CD2-CG2 3.73Å; Y261-V338 HydrophobicContact CG-CG2 3.37Å; Y261-H395 AromaticContact CE2-ND1 3.73Å
262S91.8Very high94.1Very high13 Ų1341.1 Ų41.19%0.09122%0.224CC..Hα-helixtrans-81.6-10.3170-59.30000112.8V258 T259 Y260 K264 S330V258-S262 WeakPolarHBondContact O-CB 3.11Å; V258-S262 PolarHBondContact O-N 3.32Å; V258-S262 VanDerWaalsContact O-N 3.1Å; V258-S262 PolarHBondContact O-OG 2.72Å; T259-S262 PolarHBondContact O-N 3.37Å; Y260-S262 VanDerWaalsContact C-N 3.3Å; Y260-S262 PolarHBondContact O-N 2.9Å; S262-K264 PolarHBondContact O-N 2.8Å; S262-S330 WeakPolarHBondContact O-CB 3.39Å
263G88.5Confident94.1Very high63 Ų6341.1 Ų41.165%0.64922%0.224SC*.THydrogen-bonded Turntrans64.820.5-175.100000113.7T259 Y260 Y261T259-G263 PolarHBondContact O-N 3.37Å; Y260-G263 PolarHBondContact O-N 2.88Å; Y260-G263 VanDerWaalsContact O-N 3.17Å; Y261-G263 VanDerWaalsContact C-N 3.3Å
264K88.7Confident94.1Very high71 Ų7141.1 Ų41.131%0.30922%0.224SC..  trans-92.8148.5178.8-68.5-175.5179.21740109.3T259 S262 A325 T326 H328T259-K264 WeakPolarHBondContact CG2-O 3.14Å; T259-K264 PolarHBondContact O-N 3.26Å; S262-K264 PolarHBondContact O-N 2.8Å; K264-A325 PolarHBondContact NZ-O 3.25Å; K264-T326 HydrophobicContact CD-CG2 4.09Å; K264-T326 VanDerWaalsContact CD-O 3.31Å; K264-T326 WeakPolarHBondContact CD-O 3.36Å; K264-T326 WeakPolarHBondContact CE-O 3.2Å; K264-T326 PolarHBondContact NZ-O 3.19Å; K264-H328 PolarHBondContact NZ-O 3.05Å
265K86.4Confident94.1Very high169 Ų16947.4 Ų47.474%0.73525%0.248SC*.SBendtrans-68.9-38.3178.5-56.2-164.8173179.80112.4M490K265-M490 HydrophobicContact CB-SD 3.99Å; K265-M490 HydrophobicContact CD-CE 4.26Å; K265-M490 HydrophobicContact CD-SD 4.44Å; K265-M490 HydrophobicContact CG-CE 3.82Å; K265-M490 HydrophobicContact CG-SD 3.67Å
266E89.6Confident94.1Very high123 Ų12347.5 Ų47.558%0.57525%0.249SC*.SBendtrans-141.7154.1-177.5-71.2-172.6165.300109.8
267P93.3Very high94.2Very high16 Ų1646.8 Ų46.810%0.10425%0.245CC..  trans-67.2150.5171.527.8-32.4000110.9L183 G269 Y270 M273 T326L183-P267 HydrophobicContact CD1-CB 4.37Å; L183-P267 HydrophobicContact CD1-CG 3.49Å; L183-P267 VanDerWaalsContact CD1-CG 3.49Å; L183-P267 HydrophobicContact CG-CG 4.33Å; P267-G269 PolarHBondContact O-N 3.22Å; P267-Y270 HydrophobicContact CG-CD2 4.35Å; P267-Y270 PolarHBondContact O-N 3.24Å; P267-M273 HydrophobicContact CB-SD 3.69Å; P267-M273 HydrophobicContact CG-SD 3.96Å; P267-T326 HydrophobicContact CB-CG2 4.48Å
268F96.4Very high94.4Very high111 Ų11149.2 Ų49.249%0.48726%0.257SS..THydrogen-bonded Turntrans-57.8122.6175.8177.5-89.7000110.9F321 S322 A325 T326F268-F321 HydrophobicContact CD1-CE1 4.38Å; F268-F321 HydrophobicContact CE1-CD1 4.32Å; F268-F321 AromaticContact CE1-CE1 3.73Å; F268-F321 HydrophobicContact CE1-CE1 3.73Å; F268-F321 HydrophobicContact CZ-CE1 4.41Å; F268-S322 VanDerWaalsContact O-CB 3.27Å; F268-S322 WeakPolarHBondContact O-CB 3.49Å; F268-S322 PolarHBondContact O-OG 3.42Å; F268-A325 HydrophobicContact CB-CB 3.83Å; F268-A325 HydrophobicContact CD1-CB 3.58Å; F268-A325 HydrophobicContact CD2-CB 4.14Å; F268-A325 HydrophobicContact CE1-CB 4.18Å; F268-A325 HydrophobicContact CG-CB 3.55Å; F268-T326 PolarHBondContact N-OG1 3.18Å
269G95.6Very high94.5Very high38 Ų3851.4 Ų51.439%0.39227%0.273SS..THydrogen-bonded Turntrans66.644178.400000112.9P267 M271 G272 M273P267-G269 PolarHBondContact O-N 3.22Å; G269-M271 VanDerWaalsContact C-N 3.27Å; G269-M271 PolarHBondContact O-N 3.45Å; G269-M271 VanDerWaalsContact O-N 3.16Å; G269-G272 CarbonylContact O-C 3.59Å; G269-G272 VanDerWaalsContact O-CA 3.32Å; G269-G272 WeakPolarHBondContact O-CA 3.18Å; G269-G272 PolarHBondContact O-N 2.93Å; G269-M273 PolarHBondContact O-N 3.49Å
270Y95.8Very high94.7Very high23 Ų2350.7 Ų50.79%0.0927%0.269CS..Hα-helixtrans-41.6-50.7178.1167.2-90.9000113.4Y179 T181 L183 W186 P267 G272 M273 V274Y179-Y270 WeakPolarHBondContact O-CE1 3.32Å; Y179-Y270 PolarHBondContact O-OH 2.93Å; T181-Y270 PolarHBondContact O-OH 3.32Å; L183-Y270 HydrophobicContact CD1-CD2 4.38Å; 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 3.81Å; L183-Y270 HydrophobicContact CG-CE2 3.82Å; W186-Y270 PolarHBondContact NE1-OH 3.43Å; W186-Y270 VanDerWaalsContact NE1-OH 3.07Å; P267-Y270 HydrophobicContact CG-CD2 4.35Å; P267-Y270 PolarHBondContact O-N 3.24Å; Y270-G272 VanDerWaalsContact C-N 3.34Å; Y270-G272 PolarHBondContact O-N 2.94Å; Y270-M273 WeakPolarHBondContact O-CB 3.43Å; Y270-M273 PolarHBondContact O-N 3.37Å; Y270-M273 VanDerWaalsContact O-N 3.08Å; Y270-V274 HydrophobicContact CE1-CG2 3.94Å; Y270-V274 HydrophobicContact CE2-CG2 4.11Å; Y270-V274 PolarHBondContact O-N 3.23Å
271M96.6Very high94.9Very high81 Ų8149 Ų4940%0.39926%0.264SS..Hα-helixtrans-61.1-41.2177.3-70.3-62.3-71.700112.4Y179 G269 M273 V274 W275Y179-M271 HydrophobicContact CD1-CE 3.5Å; Y179-M271 VanDerWaalsContact CD1-CE 3.5Å; Y179-M271 HydrophobicContact CD1-SD 3.72Å; Y179-M271 HydrophobicContact CE1-CE 3.66Å; Y179-M271 HydrophobicContact CE1-SD 4.43Å; Y179-M271 HydrophobicContact CG-CE 4.07Å; Y179-M271 HydrophobicContact CG-SD 4.21Å; G269-M271 VanDerWaalsContact C-N 3.27Å; G269-M271 PolarHBondContact O-N 3.45Å; G269-M271 VanDerWaalsContact O-N 3.16Å; M271-M273 VanDerWaalsContact C-N 3.28Å; M271-M273 PolarHBondContact O-N 3.18Å; M271-V274 PolarHBondContact O-N 2.89Å; M271-W275 PolarHBondContact O-N 3.2Å
272G97.2Very high95.2Very high32 Ų3253.4 Ų53.433%0.3328%0.284SS..Hα-helixtrans-60.8-36.9174.700000112.4G269 Y270 A276G269-G272 CarbonylContact O-C 3.59Å; G269-G272 VanDerWaalsContact O-CA 3.32Å; G269-G272 WeakPolarHBondContact O-CA 3.18Å; G269-G272 PolarHBondContact O-N 2.93Å; Y270-G272 VanDerWaalsContact C-N 3.34Å; Y270-G272 PolarHBondContact O-N 2.94Å; G272-A276 WeakPolarHBondContact O-CB 3.36Å; G272-A276 PolarHBondContact O-N 3.28Å
273M97.6Very high95.4Very high0 Ų054 Ų540%029%0.286CS..Hα-helixtrans-69.5-37.4175.3-62.7-176.376.400112.8L183 S255 P267 G269 Y270 M271 M277 W323L183-M273 HydrophobicContact CD1-CB 3.96Å; L183-M273 HydrophobicContact CD1-CE 3.69Å; L183-M273 HydrophobicContact CD1-CG 4.43Å; L183-M273 HydrophobicContact CD1-SD 3.57Å; L183-M273 VanDerWaalsContact CD1-SD 3.57Å; L183-M273 HydrophobicContact CD2-CB 4.14Å; S255-M273 VanDerWaalsContact OG-CE 3.23Å; S255-M273 WeakPolarHBondContact OG-CE 3.4Å; P267-M273 HydrophobicContact CB-SD 3.69Å; P267-M273 HydrophobicContact CG-SD 3.96Å; G269-M273 PolarHBondContact O-N 3.49Å; Y270-M273 WeakPolarHBondContact O-CB 3.43Å; Y270-M273 PolarHBondContact O-N 3.37Å; Y270-M273 VanDerWaalsContact O-N 3.08Å; M271-M273 VanDerWaalsContact C-N 3.28Å; M271-M273 PolarHBondContact O-N 3.18Å; M273-M277 WeakPolarHBondContact O-CG 3.25Å; M273-M277 PolarHBondContact O-N 3.39Å; M273-M277 VanDerWaalsContact O-N 3.1Å; M273-W323 VanDerWaalsContact CE-NE1 3.35Å
274V98.1Very high95.7Very high0 Ų051 Ų510%026%0.255CS..Hα-helixtrans-63.3-52174.1173.70000110.3L183 W186 Y270 M271 A276 M277 M278L183-V274 HydrophobicContact CD2-CG2 3.59Å; W186-V274 HydrophobicContact CD2-CG1 3.81Å; W186-V274 HydrophobicContact CD2-CG2 4.39Å; W186-V274 HydrophobicContact CE3-CG1 4.11Å; W186-V274 HydrophobicContact CG-CG1 4.33Å; W186-V274 HydrophobicContact CG-CG2 4.13Å; W186-V274 HydrophobicContact CH2-CG1 4.06Å; W186-V274 HydrophobicContact CZ2-CG1 3.75Å; W186-V274 HydrophobicContact CZ3-CG1 4.24Å; Y270-V274 HydrophobicContact CE1-CG2 3.94Å; Y270-V274 HydrophobicContact CE2-CG2 4.11Å; Y270-V274 PolarHBondContact O-N 3.23Å; M271-V274 PolarHBondContact O-N 2.89Å; V274-A276 VanDerWaalsContact C-N 3.32Å; V274-A276 PolarHBondContact O-N 2.92Å; V274-M277 PolarHBondContact O-N 2.91Å; V274-M277 VanDerWaalsContact O-N 3.16Å; V274-M278 HydrophobicContact CG1-CE 4.02Å; V274-M278 PolarHBondContact O-N 2.88Å
275W98.1Very high96.1Very high132 Ų13249.2 Ų49.250%0.525%0.247SC..Hα-helixtrans-60.7-40.6177.4-74.2110.9000112.2M271 M277 M278 S279M271-W275 PolarHBondContact O-N 3.2Å; W275-M277 VanDerWaalsContact C-N 3.34Å; W275-M277 PolarHBondContact O-N 3.43Å; W275-M278 HydrophobicContact CD2-CE 3.48Å; W275-M278 VanDerWaalsContact CD2-CE 3.48Å; W275-M278 HydrophobicContact CE3-CE 3.13Å; W275-M278 HydrophobicContact CG-CE 4.19Å; W275-M278 HydrophobicContact CH2-CE 3.81Å; W275-M278 HydrophobicContact CZ2-CE 4.14Å; W275-M278 HydrophobicContact CZ3-CE 3.31Å; W275-M278 PolarHBondContact O-N 3.36Å; W275-S279 WeakPolarHBondContact O-CB 3.38Å; W275-S279 PolarHBondContact O-N 3.49Å; W275-S279 PolarHBondContact O-OG 3.45Å; W275-S279 VanDerWaalsContact O-OG 3.06Å
276A98.1Very high96.7Very high5 Ų543.6 Ų43.64%0.04123%0.225CC..Hα-helixtrans-59.4-42.3175.100000112.6G272 V274 S279 I280 P315 V318 K319G272-A276 WeakPolarHBondContact O-CB 3.36Å; G272-A276 PolarHBondContact O-N 3.28Å; V274-A276 VanDerWaalsContact C-N 3.32Å; V274-A276 PolarHBondContact O-N 2.92Å; A276-S279 PolarHBondContact O-N 3.44Å; A276-I280 VanDerWaalsContact O-CG1 3.28Å; A276-I280 WeakPolarHBondContact O-CG1 3.28Å; A276-I280 PolarHBondContact O-N 3.23Å; A276-P315 HydrophobicContact CB-CB 3.85Å; A276-P315 WeakPolarHBondContact CB-O 3.26Å; A276-V318 HydrophobicContact CB-CB 4.49Å; A276-V318 HydrophobicContact CB-CG1 4.38Å; A276-K319 HydrophobicContact CB-CD 4.24Å; A276-K319 HydrophobicContact CB-CG 3.86Å
277M98.1Very high97.1Very high0 Ų037.7 Ų37.70%020%0.197CC..Hα-helixtrans-66.3-42176.2-69.4-175.2-65.600112.4L183 W186 I190 L248 M273 V274 W275 S279 I280 G281 K319L183-M277 HydrophobicContact CB-CE 4.49Å; L183-M277 HydrophobicContact CD2-CE 3.78Å; W186-M277 HydrophobicContact CB-CE 3.7Å; I190-M277 HydrophobicContact CD1-CB 3.38Å; L248-M277 HydrophobicContact CD2-CB 4.33Å; L248-M277 HydrophobicContact CD2-CG 4.25Å; M273-M277 WeakPolarHBondContact O-CG 3.25Å; M273-M277 PolarHBondContact O-N 3.39Å; M273-M277 VanDerWaalsContact O-N 3.1Å; V274-M277 PolarHBondContact O-N 2.91Å; V274-M277 VanDerWaalsContact O-N 3.16Å; W275-M277 VanDerWaalsContact C-N 3.34Å; W275-M277 PolarHBondContact O-N 3.43Å; M277-S279 VanDerWaalsContact C-N 3.33Å; M277-I280 PolarHBondContact O-N 3.07Å; M277-G281 PolarHBondContact O-N 2.84Å; M277-K319 HydrophobicContact CG-CD 4.22Å; M277-K319 PolarHBondContact SD-NZ 3.1Å
278M98.2Very high97.3Very high51 Ų5139.8 Ų39.825%0.25120%0.203SC..Hα-helixtrans-64.1-40.2177-68.4-170.5-59.800111.3W186 I190 V274 W275 G281 F282W186-M278 HydrophobicContact CH2-SD 4.45Å; W186-M278 HydrophobicContact CZ3-SD 4.05Å; I190-M278 HydrophobicContact CD1-CG 3.82Å; I190-M278 HydrophobicContact CG1-CG 4.37Å; V274-M278 HydrophobicContact CG1-CE 4.02Å; V274-M278 PolarHBondContact O-N 2.88Å; W275-M278 HydrophobicContact CD2-CE 3.48Å; W275-M278 VanDerWaalsContact CD2-CE 3.48Å; W275-M278 HydrophobicContact CE3-CE 3.13Å; W275-M278 HydrophobicContact CG-CE 4.19Å; W275-M278 HydrophobicContact CH2-CE 3.81Å; W275-M278 HydrophobicContact CZ2-CE 4.14Å; W275-M278 HydrophobicContact CZ3-CE 3.31Å; W275-M278 PolarHBondContact O-N 3.36Å; M278-G281 PolarHBondContact O-N 2.95Å; M278-F282 PolarHBondContact O-N 3.38Å
279S98.2Very high97.3Very high50 Ų5034.5 Ų34.535%0.3518%0.18SC..Hα-helixtrans-61.7-44.9173.7-63.50000112W275 A276 M277 G281 F282 L283W275-S279 WeakPolarHBondContact O-CB 3.38Å; W275-S279 PolarHBondContact O-N 3.49Å; W275-S279 PolarHBondContact O-OG 3.45Å; W275-S279 VanDerWaalsContact O-OG 3.06Å; A276-S279 PolarHBondContact O-N 3.44Å; M277-S279 VanDerWaalsContact C-N 3.33Å; S279-G281 VanDerWaalsContact C-N 3.33Å; S279-G281 PolarHBondContact O-N 2.77Å; S279-F282 PolarHBondContact O-N 3.41Å; S279-L283 VanDerWaalsContact O-CB 3.26Å; S279-L283 WeakPolarHBondContact O-CB 3.31Å; S279-L283 WeakPolarHBondContact O-CG 3.25Å; S279-L283 PolarHBondContact O-N 3.46Å
280I98Very high97.4Very high0 Ų033.8 Ų33.80%017%0.166CC..Hα-helixtrans-60.2-45.4175.6-69.4163.6000110.5Y244 L248 F251 A276 M277 F282 L283 G284 I312 P315 K319Y244-I280 HydrophobicContact CD1-CG2 3.68Å; Y244-I280 HydrophobicContact CD2-CG2 4.03Å; Y244-I280 HydrophobicContact CE1-CG2 3.98Å; Y244-I280 HydrophobicContact CE2-CG2 4.27Å; Y244-I280 HydrophobicContact CG-CG2 3.75Å; L248-I280 HydrophobicContact CD2-CB 4.49Å; L248-I280 HydrophobicContact CD2-CG2 4.14Å; F251-I280 HydrophobicContact CE2-CD1 4.11Å; A276-I280 VanDerWaalsContact O-CG1 3.28Å; A276-I280 WeakPolarHBondContact O-CG1 3.28Å; A276-I280 PolarHBondContact O-N 3.23Å; M277-I280 PolarHBondContact O-N 3.07Å; I280-F282 PolarHBondContact O-N 2.83Å; I280-L283 PolarHBondContact O-N 3.33Å; I280-G284 PolarHBondContact O-N 2.98Å; I280-I312 HydrophobicContact CG1-CG2 4.42Å; I280-P315 HydrophobicContact CD1-CB 4.33Å; I280-P315 HydrophobicContact CG1-CB 3.98Å; I280-P315 HydrophobicContact CG1-CG 3.83Å; I280-K319 HydrophobicContact CD1-CD 4.13Å
281G97.4Very high97.5Very high5 Ų534.9 Ų34.95%0.05217%0.172CC..Hα-helixtrans-59.6-46.3177.500000112.8L194 M277 M278 S279L194-G281 WeakPolarHBondContact CD2-O 3.43Å; M277-G281 PolarHBondContact O-N 2.84Å; M278-G281 PolarHBondContact O-N 2.95Å; S279-G281 VanDerWaalsContact C-N 3.33Å; S279-G281 PolarHBondContact O-N 2.77Å
282F97.8Very high97.5Very high139 Ų13931 Ų3161%0.6115%0.153SC*.Hα-helixtrans-66.6-50177.6176.8-99.1000112.5M278 S279 I280 G284 F285 I286M278-F282 PolarHBondContact O-N 3.38Å; S279-F282 PolarHBondContact O-N 3.41Å; I280-F282 PolarHBondContact O-N 2.83Å; F282-G284 PolarHBondContact O-N 2.85Å; F282-F285 PolarHBondContact O-N 2.69Å; F282-I286 HydrophobicContact CE1-CD1 4.36Å
283L96.3Very high97.5Very high24 Ų2429.6 Ų29.613%0.12614%0.138CC..Hα-helixtrans-60.3-29.6-179.3-69.8174.3000111.8S279 I280 F285 I286 V287 I311 I312 P315S279-L283 VanDerWaalsContact O-CB 3.26Å; S279-L283 WeakPolarHBondContact O-CB 3.31Å; S279-L283 WeakPolarHBondContact O-CG 3.25Å; S279-L283 PolarHBondContact O-N 3.46Å; I280-L283 PolarHBondContact O-N 3.33Å; L283-F285 PolarHBondContact O-N 2.88Å; L283-F285 VanDerWaalsContact O-N 3.16Å; L283-I286 HydrophobicContact CD2-CD1 3.87Å; L283-I286 HydrophobicContact CD2-CG1 4.3Å; L283-I286 VanDerWaalsContact O-CG1 3.3Å; L283-I286 WeakPolarHBondContact O-CG1 3.13Å; L283-I286 PolarHBondContact O-N 3.22Å; L283-V287 WeakPolarHBondContact O-CG1 3.49Å; L283-V287 WeakPolarHBondContact O-CG2 3.41Å; L283-I311 HydrophobicContact CD1-CG2 4Å; L283-I312 HydrophobicContact CB-CD1 4.49Å; L283-I312 HydrophobicContact CB-CG1 3.96Å; L283-I312 HydrophobicContact CD1-CG1 3.97Å; L283-P315 HydrophobicContact CD1-CG 4.37Å
284G94.7Very high97.4Very high0 Ų032.8 Ų32.80%016%0.157CC..THydrogen-bonded Turntrans-57.3-27.2177.400000115.2H240 P241 I280 F282H240-G284 PolarHBondContact CD2-O 3.44Å; P241-G284 WeakPolarHBondContact CD-O 3.49Å; I280-G284 PolarHBondContact O-N 2.98Å; F282-G284 PolarHBondContact O-N 2.85Å
285F97.4Very high97.3Very high35 Ų3534.6 Ų34.615%0.15417%0.168CC..THydrogen-bonded Turntrans-84.2-7.4176.5-74-68000114.6L194 L197 F237 P241 F282 L283 W288L194-F285 HydrophobicContact CD2-CD2 4.1Å; L194-F285 HydrophobicContact CD2-CE2 3.33Å; L194-F285 HydrophobicContact CD2-CZ 3.8Å; L197-F285 HydrophobicContact CB-CE1 4.25Å; L197-F285 HydrophobicContact CB-CE2 4.37Å; L197-F285 HydrophobicContact CB-CZ 3.66Å; L197-F285 HydrophobicContact CD1-CE2 4.21Å; L197-F285 HydrophobicContact CD1-CZ 4.33Å; F237-F285 HydrophobicContact CE1-CD1 4.06Å; F237-F285 HydrophobicContact CE1-CE1 4.23Å; F237-F285 HydrophobicContact CE2-CD1 4.35Å; F237-F285 AromaticContact CZ-CD1 3.79Å; F237-F285 HydrophobicContact CZ-CD1 3.79Å; F237-F285 HydrophobicContact CZ-CE1 4.34Å; P241-F285 HydrophobicContact CB-CE1 4.09Å; P241-F285 HydrophobicContact CB-CZ 4.34Å; P241-F285 HydrophobicContact CG-CD1 3.65Å; P241-F285 HydrophobicContact CG-CE1 3.64Å; P241-F285 HydrophobicContact CG-CG 4.3Å; P241-F285 HydrophobicContact CG-CZ 4.3Å; F282-F285 PolarHBondContact O-N 2.69Å; L283-F285 PolarHBondContact O-N 2.88Å; L283-F285 VanDerWaalsContact O-N 3.16Å; F285-W288 WeakPolarHBondContact O-CZ3 3.32Å
286I97.2Very high97.2Very high50 Ų5031.6 Ų31.626%0.25618%0.179SC..SBendtrans-120.114.3-173.861.1156.4000114F282 L283 F305F282-I286 HydrophobicContact CE1-CD1 4.36Å; L283-I286 HydrophobicContact CD2-CD1 3.87Å; L283-I286 HydrophobicContact CD2-CG1 4.3Å; L283-I286 VanDerWaalsContact O-CG1 3.3Å; L283-I286 WeakPolarHBondContact O-CG1 3.13Å; L283-I286 PolarHBondContact O-N 3.22Å; I286-F305 WeakPolarHBondContact O-CE1 3.31Å
287V98Very high97Very high0 Ų032.5 Ų32.50%018%0.182CC..  trans-127.5-1.3-174.2-62.10000113.5H240 L283 A289 H290 A308 I312H240-V287 WeakPolarHBondContact CD2-CG2 3.36Å; H240-V287 WeakPolarHBondContact NE2-CG2 3.32Å; L283-V287 WeakPolarHBondContact O-CG1 3.49Å; L283-V287 WeakPolarHBondContact O-CG2 3.41Å; V287-A289 PolarHBondContact O-N 3.25Å; V287-H290 PolarHBondContact O-CE1 3.15Å; V287-H290 VanDerWaalsContact O-CE1 3.32Å; V287-H290 PolarHBondContact O-N 2.98Å; V287-H290 PolarHBondContact O-ND1 3.24Å; V287-A308 HydrophobicContact CG1-CB 3.86Å; V287-I312 HydrophobicContact CB-CD1 4.17Å; V287-I312 HydrophobicContact CG1-CD1 3.82Å; V287-I312 HydrophobicContact CG1-CG1 4.44Å; V287-I312 HydrophobicContact CG2-CD1 3.77Å
288W98Very high96.9Very high60 Ų6036.6 Ų36.623%0.22720%0.204CC..G310 helixtrans-55.3-32.2-167.472.197.5000115.4H233 W236 F237 H240 F285 H290 H291 F305H233-W288 AromaticContact ND1-NE1 3.55Å; W236-W288 HydrophobicContact CB-CB 4.16Å; W236-W288 VanDerWaalsContact O-CB 3.24Å; W236-W288 WeakPolarHBondContact O-CB 3.31Å; F237-W288 HydrophobicContact CB-CG 4.43Å; F237-W288 HydrophobicContact CD2-CD2 4.24Å; F237-W288 HydrophobicContact CD2-CE3 4.17Å; F237-W288 HydrophobicContact CD2-CZ3 4.39Å; H240-W288 HydrophobicContact CB-CB 4.08Å; F285-W288 WeakPolarHBondContact O-CZ3 3.32Å; W288-H290 PolarHBondContact O-N 2.7Å; W288-H291 PolarHBondContact O-CD2 3.48Å; W288-H291 PolarHBondContact O-N 3.5Å; W288-F305 HydrophobicContact CD2-CE1 4.28Å; W288-F305 HydrophobicContact CD2-CZ 4.41Å; W288-F305 HydrophobicContact CE3-CE1 4.14Å; W288-F305 HydrophobicContact CE3-CZ 4.41Å; W288-F305 HydrophobicContact CH2-CZ 4.14Å; W288-F305 HydrophobicContact CZ2-CZ 4.14Å; W288-F305 HydrophobicContact CZ3-CE1 4.33Å; W288-F305 HydrophobicContact CZ3-CZ 4.28Å
289A97.1Very high96.8Very high0 Ų038.9 Ų38.90%022%0.221CC..G310 helixtrans-75.2-1.7-173.400000114V287 H291 M292 M297 F305V287-A289 PolarHBondContact O-N 3.25Å; A289-H291 PolarHBondContact O-N 3.18Å; A289-M292 HydrophobicContact CB-SD 4.48Å; A289-M292 WeakPolarHBondContact O-CA 3.44Å; A289-M292 WeakPolarHBondContact O-CB 3.37Å; A289-M292 PolarHBondContact O-N 3.41Å; A289-M297 HydrophobicContact CB-CE 4.08Å; A289-M297 HydrophobicContact CB-SD 3.95Å; A289-M297 VanDerWaalsContact O-CE 3.26Å; A289-M297 WeakPolarHBondContact O-CE 3.16Å; A289-F305 HydrophobicContact CB-CD1 3.81Å; A289-F305 HydrophobicContact CB-CD2 3.63Å; A289-F305 HydrophobicContact CB-CE1 3.63Å; A289-F305 HydrophobicContact CB-CE2 3.43Å; A289-F305 VanDerWaalsContact CB-CE2 3.43Å; A289-F305 HydrophobicContact CB-CG 3.83Å; A289-F305 HydrophobicContact CB-CZ 3.43Å; A289-F305 VanDerWaalsContact CB-CZ 3.43Å
290H97.7Very high96.7Very high23 Ų2342.6 Ų42.611%0.10624%0.237CC..G310 helixtrans-62.6-21.5167.961.4-120.8000113H240 V287 W288 M292 F293 T309H240-H290 AromaticContact CE1-CE1 3.03Å; H240-H290 PolarHBondContact CE1-CE1 3.46Å; H240-H290 AromaticContact CE1-NE2 3.29Å; H240-H290 PolarHBondContact CE1-NE2 3.09Å; H240-H290 VanDerWaalsContact CE1-NE2 3.29Å; H240-H290 AromaticContact CG-CE1 3.81Å; H240-H290 AromaticContact CG-NE2 3.99Å; H240-H290 AromaticContact ND1-CE1 2.99Å; H240-H290 PolarHBondContact ND1-CE1 3.49Å; H240-H290 AromaticContact ND1-NE2 2.93Å; H240-H290 PolarHBondContact ND1-NE2 3.43Å; H240-H290 AromaticContact NE2-CE1 3.75Å; V287-H290 PolarHBondContact O-CE1 3.15Å; V287-H290 VanDerWaalsContact O-CE1 3.32Å; V287-H290 PolarHBondContact O-N 2.98Å; V287-H290 PolarHBondContact O-ND1 3.24Å; W288-H290 PolarHBondContact O-N 2.7Å; H290-M292 PolarHBondContact O-N 2.7Å; H290-F293 HydrophobicContact CB-CD2 4.18Å; H290-F293 HydrophobicContact CB-CE1 4.18Å; H290-F293 HydrophobicContact CB-CE2 3.46Å; H290-F293 VanDerWaalsContact CB-CE2 3.46Å; H290-F293 HydrophobicContact CB-CZ 3.46Å; H290-F293 VanDerWaalsContact CB-CZ 3.46Å; H290-F293 WeakPolarHBondContact O-CD2 3.31Å; H290-T309 WeakPolarHBondContact ND1-CG2 3.29Å; H290-T309 PolarHBondContact ND1-OG1 3.32Å
291H97.6Very high96.6Very high45 Ų4544.6 Ų44.621%0.20825%0.249CC..G310 helixtrans-74.61.7172-63.6-70000113.4W236 H240 W288 A289 H368W236-H291 HydrophobicContact CD2-CB 3.4Å; W236-H291 VanDerWaalsContact CD2-CB 3.4Å; W236-H291 AromaticContact CD2-CD2 3.59Å; W236-H291 AromaticContact CD2-CG 3.57Å; W236-H291 AromaticContact CE2-CG 3.77Å; W236-H291 HydrophobicContact CE3-CB 3.96Å; W236-H291 AromaticContact CE3-CD2 3.26Å; W236-H291 AromaticContact CE3-CG 3.55Å; W236-H291 AromaticContact CE3-NE2 3.67Å; W236-H291 HydrophobicContact CG-CB 3.67Å; W236-H291 HydrophobicContact CH2-CB 4.31Å; W236-H291 AromaticContact CH2-CG 3.99Å; W236-H291 AromaticContact CH2-ND1 3.87Å; W236-H291 HydrophobicContact CZ2-CB 3.79Å; W236-H291 AromaticContact CZ2-CG 3.99Å; W236-H291 HydrophobicContact CZ3-CB 4.38Å; W236-H291 AromaticContact CZ3-CD2 3.73Å; W236-H291 AromaticContact CZ3-CE1 3.81Å; W236-H291 AromaticContact CZ3-CG 3.78Å; W236-H291 AromaticContact CZ3-ND1 3.84Å; W236-H291 AromaticContact CZ3-NE2 3.72Å; H240-H291 AromaticContact ND1-NE2 3.32Å; H240-H291 PolarHBondContact ND1-NE2 3.21Å; W288-H291 PolarHBondContact O-CD2 3.48Å; W288-H291 PolarHBondContact O-N 3.5Å; A289-H291 PolarHBondContact O-N 3.18Å; H291-H368 PolarHBondContact O-CE1 3.04Å
292M97.3Very high96.6Very high0 Ų047.2 Ų47.20%026%0.257CS..G310 helixtrans-127.815-172-56.4174.360.600111.8I229 Q232 H233 A289 H290 T294 V295 M297I229-M292 HydrophobicContact CG2-CE 3.7Å; Q232-M292 HydrophobicContact CB-CE 3.57Å; Q232-M292 HydrophobicContact CB-CG 4.36Å; Q232-M292 HydrophobicContact CB-SD 4Å; H233-M292 WeakPolarHBondContact CE1-CE 3.48Å; H233-M292 WeakPolarHBondContact ND1-CE 3.49Å; H233-M292 PolarHBondContact ND1-SD 2.93Å; H233-M292 WeakPolarHBondContact NE2-CE 3.23Å; A289-M292 HydrophobicContact CB-SD 4.48Å; A289-M292 WeakPolarHBondContact O-CA 3.44Å; A289-M292 WeakPolarHBondContact O-CB 3.37Å; A289-M292 PolarHBondContact O-N 3.41Å; H290-M292 PolarHBondContact O-N 2.7Å; M292-T294 PolarHBondContact O-N 2.85Å; M292-V295 HydrophobicContact CB-CG1 3.98Å; M292-V295 HydrophobicContact CB-CG2 4.04Å; M292-V295 HydrophobicContact CE-CG2 4.15Å; M292-V295 VanDerWaalsContact O-CG2 3.24Å; M292-V295 WeakPolarHBondContact O-CG2 3.17Å; M292-V295 PolarHBondContact O-N 3.13Å; M292-M297 HydrophobicContact CB-CE 4.17Å
293F97.1Very high96.5Very high3 Ų342.9 Ų42.91%0.01325%0.247CC..THydrogen-bonded Turntrans-58.4-21.8-174-72.6-40000114.6H290 M297 R302 F305 D364H290-F293 HydrophobicContact CB-CD2 4.18Å; H290-F293 HydrophobicContact CB-CE1 4.18Å; H290-F293 HydrophobicContact CB-CE2 3.46Å; H290-F293 VanDerWaalsContact CB-CE2 3.46Å; H290-F293 HydrophobicContact CB-CZ 3.46Å; H290-F293 VanDerWaalsContact CB-CZ 3.46Å; H290-F293 WeakPolarHBondContact O-CD2 3.31Å; F293-M297 HydrophobicContact CD1-CE 3.8Å; F293-M297 HydrophobicContact CE1-CE 4.44Å; F293-R302 HydrophobicContact CD1-CB 4.49Å; F293-R302 HydrophobicContact CD1-CG 4.1Å; F293-F305 HydrophobicContact CE1-CB 3.74Å; F293-F305 HydrophobicContact CZ-CB 4.15Å; F293-D364 HydrophobicContact CB-CB 4.4Å; F293-D364 HydrophobicContact CD2-CB 3.75Å
294T95.9Very high96.6Very high66 Ų6647.5 Ų47.541%0.40526%0.264SS..THydrogen-bonded Turntrans-90.7-4.6179.554.30000114.5M292 G296 H368M292-T294 PolarHBondContact O-N 2.85Å; T294-G296 PolarHBondContact O-N 2.94Å; T294-H368 HydrophobicContact CG2-CB 3.49Å; T294-H368 VanDerWaalsContact CG2-CB 3.49Å; T294-H368 VanDerWaalsContact CG2-CG 3.46Å; T294-H368 PolarHBondContact OG1-CD2 3.48Å; T294-H368 VanDerWaalsContact OG1-CD2 3.31Å; T294-H368 PolarHBondContact OG1-NE2 3.26Å
295V95.9Very high96.7Very high38 Ų3848.3 Ų48.323%0.2327%0.267CS..SBendtrans-79.91.9-177.6-48.10000114.1I229 M292 M297I229-V295 HydrophobicContact CD1-CB 4.4Å; I229-V295 HydrophobicContact CG2-CG2 4.19Å; M292-V295 HydrophobicContact CB-CG1 3.98Å; M292-V295 HydrophobicContact CB-CG2 4.04Å; M292-V295 HydrophobicContact CE-CG2 4.15Å; M292-V295 VanDerWaalsContact O-CG2 3.24Å; M292-V295 WeakPolarHBondContact O-CG2 3.17Å; M292-V295 PolarHBondContact O-N 3.13Å; V295-M297 HydrophobicContact CG2-CG 3.88Å
296G94.4Very high96.8Very high70 Ų7047.4 Ų47.472%0.72227%0.265SS*.  trans8826.517900000115T294T294-G296 PolarHBondContact O-N 2.94Å
297M94.8Very high96.8Very high23 Ų2348.3 Ų48.311%0.11328%0.275CS..  trans-58.2148.5171-65.6-170.3-68.800111.7A289 M292 F293 V295 T301 R302A289-M297 HydrophobicContact CB-CE 4.08Å; A289-M297 HydrophobicContact CB-SD 3.95Å; A289-M297 VanDerWaalsContact O-CE 3.26Å; A289-M297 WeakPolarHBondContact O-CE 3.16Å; M292-M297 HydrophobicContact CB-CE 4.17Å; F293-M297 HydrophobicContact CD1-CE 3.8Å; F293-M297 HydrophobicContact CE1-CE 4.44Å; V295-M297 HydrophobicContact CG2-CG 3.88Å; M297-T301 HydrophobicContact CB-CG2 4.23Å; M297-T301 HydrophobicContact CG-CG2 4.41Å; M297-T301 HydrophobicContact SD-CG2 3.66Å; M297-R302 HydrophobicContact CB-CG 3.97Å; M297-R302 HydrophobicContact CE-CG 4.28Å; M297-R302 PolarHBondContact O-NE 2.62Å; M297-R302 VanDerWaalsContact O-NE 3.16Å
298D95.8Very high96.8Very high86 Ų8648.6 Ų48.646%0.4628%0.278SS..  trans-61.4163.7176.769.4-84.6000112.2D300 T301 R302D298-D300 VanDerWaalsContact C-N 3.33Å; D298-D300 PolarHBondContact O-N 3.4Å; D298-D300 WeakPolarHBondContact OD2-CB 3.39Å; D298-D300 PolarHBondContact OD2-N 3.3Å; D298-T301 VanDerWaalsContact CG-OG1 3.28Å; D298-T301 VanDerWaalsContact OD1-CB 3.22Å; D298-T301 WeakPolarHBondContact OD1-CB 3.47Å; D298-T301 PolarHBondContact OD1-OG1 3.47Å; D298-T301 PolarHBondContact OD2-N 3.03Å; D298-T301 PolarHBondContact OD2-OG1 3.2Å; D298-R302 WeakPolarHBondContact O-CG 3.38Å; D298-R302 PolarHBondContact O-N 2.97Å; D298-R302 VanDerWaalsContact O-N 3.09Å
299V95.3Very high96.7Very high99 Ų9946.6 Ų46.660%0.627%0.273SS*.Hα-helixtrans-63.6-39.6-174178.20000111.6R302 A303V299-R302 PolarHBondContact O-N 3.37Å; V299-A303 WeakPolarHBondContact O-CB 3.49Å; V299-A303 PolarHBondContact O-N 2.66Å
300D97Very high96.7Very high128 Ų12849.7 Ų49.768%0.68429%0.288SS*.Hα-helixtrans-71.1-42.2-175.8-65.7-21.2000110.6D298 R302 A303 Y304D298-D300 VanDerWaalsContact C-N 3.33Å; D298-D300 PolarHBondContact O-N 3.4Å; D298-D300 WeakPolarHBondContact OD2-CB 3.39Å; D298-D300 PolarHBondContact OD2-N 3.3Å; D300-R302 PolarHBondContact O-N 2.9Å; D300-A303 PolarHBondContact O-N 2.86Å; D300-Y304 WeakPolarHBondContact O-CB 3.36Å; D300-Y304 PolarHBondContact O-N 2.91Å
301T96.3Very high96.7Very high43 Ų4352.6 Ų52.626%0.26430%0.303SS..Hα-helixtrans-59.3-45.8173.1-64.20000111.2M297 D298 A303 Y304 F305M297-T301 HydrophobicContact CB-CG2 4.23Å; M297-T301 HydrophobicContact CG-CG2 4.41Å; M297-T301 HydrophobicContact SD-CG2 3.66Å; D298-T301 VanDerWaalsContact CG-OG1 3.28Å; D298-T301 VanDerWaalsContact OD1-CB 3.22Å; D298-T301 WeakPolarHBondContact OD1-CB 3.47Å; D298-T301 PolarHBondContact OD1-OG1 3.47Å; D298-T301 PolarHBondContact OD2-N 3.03Å; D298-T301 PolarHBondContact OD2-OG1 3.2Å; T301-A303 PolarHBondContact O-N 3.04Å; T301-Y304 PolarHBondContact O-N 3.43Å; T301-F305 HydrophobicContact CG2-CD2 3.71Å; T301-F305 HydrophobicContact CG2-CE2 3.79Å; T301-F305 VanDerWaalsContact O-CD2 3.3Å; T301-F305 WeakPolarHBondContact O-CD2 3.28Å; T301-F305 PolarHBondContact O-N 3Å
302R96.3Very high96.7Very high60 Ų6050.9 Ų50.923%0.22630%0.295CS..Hα-helixtrans-63.6-39.6176.4-72.5-172.2-69.6159.41.1112.6F293 M297 D298 V299 D300 T306F293-R302 HydrophobicContact CD1-CB 4.49Å; F293-R302 HydrophobicContact CD1-CG 4.1Å; M297-R302 HydrophobicContact CB-CG 3.97Å; M297-R302 HydrophobicContact CE-CG 4.28Å; M297-R302 PolarHBondContact O-NE 2.62Å; M297-R302 VanDerWaalsContact O-NE 3.16Å; D298-R302 WeakPolarHBondContact O-CG 3.38Å; D298-R302 PolarHBondContact O-N 2.97Å; D298-R302 VanDerWaalsContact O-N 3.09Å; V299-R302 PolarHBondContact O-N 3.37Å; D300-R302 PolarHBondContact O-N 2.9Å; R302-T306 VanDerWaalsContact O-CB 3.27Å; R302-T306 WeakPolarHBondContact O-CB 3.18Å; R302-T306 PolarHBondContact O-N 3.15Å; R302-T306 PolarHBondContact O-OG1 2.91Å
303A96.9Very high96.7Very high48 Ų4852.6 Ų52.640%0.39731%0.309SS..Hα-helixtrans-65.3-40.8176.600000112.1V299 D300 T301 S307V299-A303 WeakPolarHBondContact O-CB 3.49Å; V299-A303 PolarHBondContact O-N 2.66Å; D300-A303 PolarHBondContact O-N 2.86Å; T301-A303 PolarHBondContact O-N 3.04Å; A303-S307 WeakPolarHBondContact O-CB 3.18Å; A303-S307 PolarHBondContact O-N 3.45Å; A303-S307 PolarHBondContact O-OG 3.07Å
304Y97.9Very high96.7Very high121 Ų12157.9 Ų57.948%0.47534%0.337SS..Hα-helixtrans-59.6-56.5173.6172.2-95.3000111.2D300 T301 T306 S307 A308D300-Y304 WeakPolarHBondContact O-CB 3.36Å; D300-Y304 PolarHBondContact O-N 2.91Å; T301-Y304 PolarHBondContact O-N 3.43Å; Y304-T306 VanDerWaalsContact C-N 3.28Å; Y304-T306 PolarHBondContact O-N 3.06Å; Y304-S307 PolarHBondContact O-N 3.03Å; Y304-S307 VanDerWaalsContact O-N 3.13Å; Y304-A308 HydrophobicContact CE1-CB 4.37Å; Y304-A308 WeakPolarHBondContact O-CB 3.27Å; Y304-A308 PolarHBondContact O-N 3.17Å
305F97.9Very high96.8Very high16 Ų1655.3 Ų55.37%0.0732%0.321CS..Hα-helixtrans-66.1-31-176.8-82.1-72.9000112.6I286 W288 A289 F293 T301 T309I286-F305 WeakPolarHBondContact O-CE1 3.31Å; W288-F305 HydrophobicContact CD2-CE1 4.28Å; W288-F305 HydrophobicContact CD2-CZ 4.41Å; W288-F305 HydrophobicContact CE3-CE1 4.14Å; W288-F305 HydrophobicContact CE3-CZ 4.41Å; W288-F305 HydrophobicContact CH2-CZ 4.14Å; W288-F305 HydrophobicContact CZ2-CZ 4.14Å; W288-F305 HydrophobicContact CZ3-CE1 4.33Å; W288-F305 HydrophobicContact CZ3-CZ 4.28Å; A289-F305 HydrophobicContact CB-CD1 3.81Å; A289-F305 HydrophobicContact CB-CD2 3.63Å; A289-F305 HydrophobicContact CB-CE1 3.63Å; A289-F305 HydrophobicContact CB-CE2 3.43Å; A289-F305 VanDerWaalsContact CB-CE2 3.43Å; A289-F305 HydrophobicContact CB-CG 3.83Å; A289-F305 HydrophobicContact CB-CZ 3.43Å; A289-F305 VanDerWaalsContact CB-CZ 3.43Å; F293-F305 HydrophobicContact CE1-CB 3.74Å; F293-F305 HydrophobicContact CZ-CB 4.15Å; T301-F305 HydrophobicContact CG2-CD2 3.71Å; T301-F305 HydrophobicContact CG2-CE2 3.79Å; T301-F305 VanDerWaalsContact O-CD2 3.3Å; T301-F305 WeakPolarHBondContact O-CD2 3.28Å; T301-F305 PolarHBondContact O-N 3Å; F305-T309 WeakPolarHBondContact O-CB 3.42Å; F305-T309 PolarHBondContact O-N 3.24Å; F305-T309 PolarHBondContact O-OG1 2.71Å
306T97.9Very high96.9Very high16 Ų1654.7 Ų54.710%0.09832%0.317CS..Hα-helixtrans-60.3-53.8170.2-63.40000110.7R302 Y304 T309 M310 A359 S361R302-T306 VanDerWaalsContact O-CB 3.27Å; R302-T306 WeakPolarHBondContact O-CB 3.18Å; R302-T306 PolarHBondContact O-N 3.15Å; R302-T306 PolarHBondContact O-OG1 2.91Å; Y304-T306 VanDerWaalsContact C-N 3.28Å; Y304-T306 PolarHBondContact O-N 3.06Å; T306-T309 PolarHBondContact O-N 3.28Å; T306-M310 HydrophobicContact CG2-CE 3.82Å; T306-M310 HydrophobicContact CG2-SD 4.15Å; T306-M310 WeakPolarHBondContact O-CG 3.17Å; T306-M310 PolarHBondContact O-N 2.75Å; T306-A359 WeakPolarHBondContact CA-O 3.21Å; T306-A359 WeakPolarHBondContact CG2-O 3.17Å; T306-S361 WeakPolarHBondContact OG1-CB 3.02Å; T306-S361 PolarHBondContact OG1-N 3.5Å; T306-S361 PolarHBondContact OG1-OG 2.7Å
307S97.4Very high97Very high69 Ų6953 Ų5348%0.48330%0.301SS..Hα-helixtrans-64.4-47-177.2-55.50000111.8A303 Y304 T309 M310 I311A303-S307 WeakPolarHBondContact O-CB 3.18Å; A303-S307 PolarHBondContact O-N 3.45Å; A303-S307 PolarHBondContact O-OG 3.07Å; Y304-S307 PolarHBondContact O-N 3.03Å; Y304-S307 VanDerWaalsContact O-N 3.13Å; S307-T309 VanDerWaalsContact C-N 3.34Å; S307-T309 PolarHBondContact O-N 3.19Å; S307-M310 PolarHBondContact O-N 3.29Å; S307-I311 WeakPolarHBondContact O-CG1 3.47Å; S307-I311 PolarHBondContact O-N 2.9Å; S307-I311 VanDerWaalsContact O-N 3.13Å
308A97.6Very high97.1Very high7 Ų754.6 Ų54.66%0.05831%0.311CS..Hα-helixtrans-61.1-41.8179.300000111.8V287 Y304 I311V287-A308 HydrophobicContact CG1-CB 3.86Å; Y304-A308 HydrophobicContact CE1-CB 4.37Å; Y304-A308 WeakPolarHBondContact O-CB 3.27Å; Y304-A308 PolarHBondContact O-N 3.17Å; A308-I311 PolarHBondContact O-N 3.08Å
309T97.5Very high97.2Very high18 Ų1850.6 Ų50.611%0.1129%0.29CS..Hα-helixtrans-67.9-41.4179.4-55.50000111.3H290 F305 T306 S307 I311 I312 A359H290-T309 WeakPolarHBondContact ND1-CG2 3.29Å; H290-T309 PolarHBondContact ND1-OG1 3.32Å; F305-T309 WeakPolarHBondContact O-CB 3.42Å; F305-T309 PolarHBondContact O-N 3.24Å; F305-T309 PolarHBondContact O-OG1 2.71Å; T306-T309 PolarHBondContact O-N 3.28Å; S307-T309 VanDerWaalsContact C-N 3.34Å; S307-T309 PolarHBondContact O-N 3.19Å; T309-I311 VanDerWaalsContact C-N 3.28Å; T309-I311 PolarHBondContact O-N 2.63Å; T309-I312 WeakPolarHBondContact O-CB 3.33Å; T309-I312 WeakPolarHBondContact O-CG1 3.48Å; T309-I312 PolarHBondContact O-N 2.71Å; T309-A359 HydrophobicContact CG2-CB 3.58Å
310M97.4Very high97.3Very high65 Ų6546.9 Ų46.932%0.3227%0.267SS..Hα-helixtrans-63.3-31.8176.8-72.4-179.5178.100112.9T306 S307 I312 A313 A359 N360T306-M310 HydrophobicContact CG2-CE 3.82Å; T306-M310 HydrophobicContact CG2-SD 4.15Å; T306-M310 WeakPolarHBondContact O-CG 3.17Å; T306-M310 PolarHBondContact O-N 2.75Å; S307-M310 PolarHBondContact O-N 3.29Å; M310-I312 PolarHBondContact O-N 3.27Å; M310-A313 VanDerWaalsContact O-CB 3.24Å; M310-A313 WeakPolarHBondContact O-CB 3.38Å; M310-A313 PolarHBondContact O-N 2.9Å; M310-A313 VanDerWaalsContact O-N 3.09Å; M310-A359 HydrophobicContact CE-CB 4.44Å; M310-A359 HydrophobicContact CG-CB 3.91Å; M310-N360 HydrophobicContact CE-CB 3.75Å
311I97.6Very high97.4Very high84 Ų8447 Ų4743%0.43126%0.262SS..Hα-helixtrans-59.8-29.8177.1-72.3166.5000111.9L283 S307 A308 T309 A313 I314 P315L283-I311 HydrophobicContact CD1-CG2 4Å; S307-I311 WeakPolarHBondContact O-CG1 3.47Å; S307-I311 PolarHBondContact O-N 2.9Å; S307-I311 VanDerWaalsContact O-N 3.13Å; A308-I311 PolarHBondContact O-N 3.08Å; T309-I311 VanDerWaalsContact C-N 3.28Å; T309-I311 PolarHBondContact O-N 2.63Å; I311-A313 PolarHBondContact O-N 2.96Å; I311-A313 VanDerWaalsContact O-N 3.17Å; I311-I314 WeakPolarHBondContact O-CB 3.44Å; I311-I314 PolarHBondContact O-N 3.44Å; I311-P315 VanDerWaalsContact O-CD 3.24Å; I311-P315 WeakPolarHBondContact O-CD 3.45Å
312I97Very high97.4Very high8 Ų845.1 Ų45.14%0.04125%0.251CS..THydrogen-bonded Turntrans-62.6-24.3179-53.9170.2000112.2Y244 I280 L283 V287 T309 M310 I314 P315 T316Y244-I312 HydrophobicContact CE1-CG2 4.5Å; Y244-I312 HydrophobicContact CE2-CD1 4.36Å; Y244-I312 WeakPolarHBondContact OH-CD1 3.47Å; I280-I312 HydrophobicContact CG1-CG2 4.42Å; L283-I312 HydrophobicContact CB-CD1 4.49Å; L283-I312 HydrophobicContact CB-CG1 3.96Å; L283-I312 HydrophobicContact CD1-CG1 3.97Å; V287-I312 HydrophobicContact CB-CD1 4.17Å; V287-I312 HydrophobicContact CG1-CD1 3.82Å; V287-I312 HydrophobicContact CG1-CG1 4.44Å; V287-I312 HydrophobicContact CG2-CD1 3.77Å; T309-I312 WeakPolarHBondContact O-CB 3.33Å; T309-I312 WeakPolarHBondContact O-CG1 3.48Å; T309-I312 PolarHBondContact O-N 2.71Å; M310-I312 PolarHBondContact O-N 3.27Å; I312-I314 PolarHBondContact O-N 3.48Å; I312-P315 VanDerWaalsContact O-CD 3.26Å; I312-P315 WeakPolarHBondContact O-CD 3.38Å; I312-P315 WeakPolarHBondContact O-CG 3.45Å; I312-T316 WeakPolarHBondContact O-CB 3.5Å; I312-T316 PolarHBondContact O-N 3Å; I312-T316 PolarHBondContact O-OG1 2.67Å
313A96.8Very high97.5Very high36 Ų3642.3 Ų42.330%0.29824%0.24SC..Hα-helixtrans-61.1-26.8174.800000112.3M310 I311 G317 I356M310-A313 VanDerWaalsContact O-CB 3.24Å; M310-A313 WeakPolarHBondContact O-CB 3.38Å; M310-A313 PolarHBondContact O-N 2.9Å; M310-A313 VanDerWaalsContact O-N 3.09Å; I311-A313 PolarHBondContact O-N 2.96Å; I311-A313 VanDerWaalsContact O-N 3.17Å; A313-G317 WeakPolarHBondContact O-CA 3.48Å; A313-G317 PolarHBondContact O-N 3.08Å; A313-I356 HydrophobicContact CB-CD1 3.78Å; A313-I356 HydrophobicContact CB-CG1 4.07Å
314I97.9Very high97.5Very high115 Ų11544.2 Ų44.259%0.5924%0.243SC*.Hα-helixtrans-67.1-62.3-179.9-59.7173000111.7I311 I312 T316 G317 V318I311-I314 WeakPolarHBondContact O-CB 3.44Å; I311-I314 PolarHBondContact O-N 3.44Å; I312-I314 PolarHBondContact O-N 3.48Å; I314-T316 PolarHBondContact O-N 3.07Å; I314-G317 PolarHBondContact O-N 3.22Å; I314-G317 VanDerWaalsContact O-N 3.11Å; I314-V318 WeakPolarHBondContact O-CG2 3.4Å; I314-V318 PolarHBondContact O-N 2.91Å
315P97.9Very high97.5Very high11 Ų1139.4 Ų39.47%0.07123%0.228CC..Hα-helixtrans-62.3-32.117924.9-34.5000112.2A276 I280 L283 I311 I312 V318 K319A276-P315 HydrophobicContact CB-CB 3.85Å; A276-P315 WeakPolarHBondContact CB-O 3.26Å; I280-P315 HydrophobicContact CD1-CB 4.33Å; I280-P315 HydrophobicContact CG1-CB 3.98Å; I280-P315 HydrophobicContact CG1-CG 3.83Å; L283-P315 HydrophobicContact CD1-CG 4.37Å; I311-P315 VanDerWaalsContact O-CD 3.24Å; I311-P315 WeakPolarHBondContact O-CD 3.45Å; I312-P315 VanDerWaalsContact O-CD 3.26Å; I312-P315 WeakPolarHBondContact O-CD 3.38Å; I312-P315 WeakPolarHBondContact O-CG 3.45Å; P315-V318 PolarHBondContact O-N 3.36Å; P315-K319 PolarHBondContact O-N 2.91Å
316T96.8Very high97.4Very high25 Ų2538.6 Ų38.615%0.15323%0.225CC..Hα-helixtrans-64.1-45.3173.7-55.70000111.6I312 I314 V318 K319 V320 F348I312-T316 WeakPolarHBondContact O-CB 3.5Å; I312-T316 PolarHBondContact O-N 3Å; I312-T316 PolarHBondContact O-OG1 2.67Å; I314-T316 PolarHBondContact O-N 3.07Å; T316-V318 PolarHBondContact O-N 3.41Å; T316-K319 WeakPolarHBondContact O-CB 3.32Å; T316-K319 PolarHBondContact O-N 3.44Å; T316-V320 PolarHBondContact O-N 2.76Å; T316-V320 VanDerWaalsContact O-N 3.11Å; T316-F348 HydrophobicContact CG2-CE1 3.51Å; T316-F348 HydrophobicContact CG2-CZ 3.96Å
317G97.2Very high97.3Very high36 Ų3638.8 Ų38.837%0.37123%0.225SC..Hα-helixtrans-63-38.7176.100000113A313 I314 K319 V320 F321A313-G317 WeakPolarHBondContact O-CA 3.48Å; A313-G317 PolarHBondContact O-N 3.08Å; I314-G317 PolarHBondContact O-N 3.22Å; I314-G317 VanDerWaalsContact O-N 3.11Å; G317-K319 VanDerWaalsContact C-N 3.27Å; G317-K319 PolarHBondContact O-N 3.35Å; G317-V320 PolarHBondContact O-N 2.93Å; G317-F321 WeakPolarHBondContact O-CB 3.42Å; G317-F321 PolarHBondContact O-N 3.28Å
318V97.7Very high97.1Very high56 Ų5642.8 Ų42.834%0.33924%0.236SC..Hα-helixtrans-55.8-43.6172.9170.20000110.7A276 I314 P315 T316 F321 S322A276-V318 HydrophobicContact CB-CB 4.49Å; A276-V318 HydrophobicContact CB-CG1 4.38Å; I314-V318 WeakPolarHBondContact O-CG2 3.4Å; I314-V318 PolarHBondContact O-N 2.91Å; P315-V318 PolarHBondContact O-N 3.36Å; T316-V318 PolarHBondContact O-N 3.41Å; V318-F321 PolarHBondContact O-N 3.5Å; V318-S322 WeakPolarHBondContact O-CB 3.39Å; V318-S322 PolarHBondContact O-N 3.31Å; V318-S322 PolarHBondContact O-OG 2.99Å
319K97Very high96.8Very high1 Ų146.1 Ų46.10%0.00427%0.271CS..Hα-helixtrans-67.6-45.5179-68.1178.466.9101.50112.8F251 A276 M277 I280 P315 T316 G317 F321 S322 W323F251-K319 VanDerWaalsContact CB-CE 3.43Å; F251-K319 VanDerWaalsContact CB-NZ 3.34Å; F251-K319 HydrophobicContact CD2-CD 4.02Å; F251-K319 HydrophobicContact CE2-CD 4.32Å; F251-K319 VanDerWaalsContact CG-CE 3.43Å; A276-K319 HydrophobicContact CB-CD 4.24Å; A276-K319 HydrophobicContact CB-CG 3.86Å; M277-K319 HydrophobicContact CG-CD 4.22Å; M277-K319 PolarHBondContact SD-NZ 3.1Å; I280-K319 HydrophobicContact CD1-CD 4.13Å; P315-K319 PolarHBondContact O-N 2.91Å; T316-K319 WeakPolarHBondContact O-CB 3.32Å; T316-K319 PolarHBondContact O-N 3.44Å; G317-K319 VanDerWaalsContact C-N 3.27Å; G317-K319 PolarHBondContact O-N 3.35Å; K319-F321 VanDerWaalsContact C-N 3.3Å; K319-F321 PolarHBondContact O-N 3.08Å; K319-S322 PolarHBondContact O-N 2.94Å; K319-W323 HydrophobicContact CB-CH2 4.09Å; K319-W323 HydrophobicContact CB-CZ2 4.32Å; K319-W323 HydrophobicContact CB-CZ3 4.32Å; K319-W323 PolarHBondContact O-N 3.35Å
320V97.7Very high96.4Very high22 Ų2246.5 Ų46.513%0.13327%0.274CS..Hα-helixtrans-57.7-46.9176172.70000110.4T316 G317 W323 L324 I345T316-V320 PolarHBondContact O-N 2.76Å; T316-V320 VanDerWaalsContact O-N 3.11Å; G317-V320 PolarHBondContact O-N 2.93Å; V320-W323 HydrophobicContact CG2-CE3 4.32Å; V320-W323 HydrophobicContact CG2-CZ3 4.05Å; V320-W323 PolarHBondContact O-N 3.32Å; V320-L324 HydrophobicContact CG1-CD1 4.29Å; V320-L324 WeakPolarHBondContact O-CG 3.42Å; V320-L324 PolarHBondContact O-N 2.91Å; V320-L324 VanDerWaalsContact O-N 3.14Å; V320-I345 HydrophobicContact CG1-CG2 4.23Å
321F98.1Very high95.8Very high129 Ų12951.1 Ų51.157%0.56630%0.3SS*.Hα-helixtrans-60.3-46.8175.4178-99.1000112.1F268 G317 V318 K319 W323 L324 A325F268-F321 HydrophobicContact CD1-CE1 4.38Å; F268-F321 HydrophobicContact CE1-CD1 4.32Å; F268-F321 AromaticContact CE1-CE1 3.73Å; F268-F321 HydrophobicContact CE1-CE1 3.73Å; F268-F321 HydrophobicContact CZ-CE1 4.41Å; G317-F321 WeakPolarHBondContact O-CB 3.42Å; G317-F321 PolarHBondContact O-N 3.28Å; V318-F321 PolarHBondContact O-N 3.5Å; K319-F321 VanDerWaalsContact C-N 3.3Å; K319-F321 PolarHBondContact O-N 3.08Å; F321-W323 VanDerWaalsContact C-N 3.33Å; F321-W323 PolarHBondContact O-N 3.49Å; F321-L324 PolarHBondContact O-N 3.22Å; F321-A325 HydrophobicContact CE1-CB 4.4Å; F321-A325 WeakPolarHBondContact O-CB 2.97Å; F321-A325 PolarHBondContact O-N 3.21Å
322S98Very high95.1Very high4 Ų449 Ų493%0.02829%0.289CS..Hα-helixtrans-58.9-40.4177.8-83.60000112.9F268 V318 K319 A325 T326F268-S322 VanDerWaalsContact O-CB 3.27Å; F268-S322 WeakPolarHBondContact O-CB 3.49Å; F268-S322 PolarHBondContact O-OG 3.42Å; V318-S322 WeakPolarHBondContact O-CB 3.39Å; V318-S322 PolarHBondContact O-N 3.31Å; V318-S322 PolarHBondContact O-OG 2.99Å; K319-S322 PolarHBondContact O-N 2.94Å; S322-A325 PolarHBondContact O-N 3.22Å; S322-T326 WeakPolarHBondContact O-CB 3.43Å; S322-T326 PolarHBondContact O-N 2.83Å; S322-T326 PolarHBondContact O-OG1 3.4Å
323W97.9Very high94.5Very high1 Ų154.2 Ų54.20%0.00431%0.312CS..Hα-helixtrans-64-46.4174.7-66.1-43.8000111.8F251 I254 S255 M273 K319 V320 F321 A325 T326 L327 F344 I345F251-W323 HydrophobicContact CB-CH2 4.17Å; F251-W323 HydrophobicContact CB-CZ2 3.9Å; F251-W323 AromaticContact CD1-CH2 3.47Å; F251-W323 HydrophobicContact CD1-CH2 3.47Å; F251-W323 VanDerWaalsContact CD1-CH2 3.47Å; F251-W323 HydrophobicContact CD1-CZ2 4.08Å; F251-W323 HydrophobicContact CE1-CH2 4.03Å; F251-W323 AromaticContact CG-CH2 4Å; F251-W323 HydrophobicContact CG-CH2 4Å; F251-W323 HydrophobicContact CG-CZ2 4.24Å; I254-W323 HydrophobicContact CB-CZ2 4.42Å; I254-W323 HydrophobicContact CG2-CD2 4.08Å; I254-W323 HydrophobicContact CG2-CG 4.42Å; I254-W323 HydrophobicContact CG2-CZ2 4.23Å; S255-W323 PolarHBondContact OG-NE1 3.01Å; M273-W323 VanDerWaalsContact CE-NE1 3.35Å; K319-W323 HydrophobicContact CB-CH2 4.09Å; K319-W323 HydrophobicContact CB-CZ2 4.32Å; K319-W323 HydrophobicContact CB-CZ3 4.32Å; K319-W323 PolarHBondContact O-N 3.35Å; V320-W323 HydrophobicContact CG2-CE3 4.32Å; V320-W323 HydrophobicContact CG2-CZ3 4.05Å; V320-W323 PolarHBondContact O-N 3.32Å; F321-W323 VanDerWaalsContact C-N 3.33Å; F321-W323 PolarHBondContact O-N 3.49Å; W323-A325 VanDerWaalsContact C-N 3.35Å; W323-A325 PolarHBondContact O-N 2.97Å; W323-T326 WeakPolarHBondContact O-CB 3.37Å; W323-T326 PolarHBondContact O-N 2.97Å; W323-T326 VanDerWaalsContact O-N 3.14Å; W323-L327 WeakPolarHBondContact O-CG 3.47Å; W323-L327 PolarHBondContact O-N 3.38Å; W323-F344 AromaticContact CH2-CE1 3.81Å; W323-F344 HydrophobicContact CH2-CE1 3.81Å; W323-F344 AromaticContact CZ3-CE1 3.84Å; W323-F344 HydrophobicContact CZ3-CE1 3.84Å; W323-I345 HydrophobicContact CB-CD1 3.7Å; W323-I345 HydrophobicContact CB-CG1 4.38Å; W323-I345 HydrophobicContact CD2-CG1 4.35Å; W323-I345 HydrophobicContact CE3-CD1 4.42Å; W323-I345 HydrophobicContact CE3-CG1 3.85Å; W323-I345 HydrophobicContact CG-CD1 4.25Å
324L97.4Very high94.2Very high89 Ų8959.6 Ų59.647%0.46632%0.324SS..Hα-helixtrans-62.4-41.6177.9-65.6175.7000112V320 F321 T326 L327 H328 I345V320-L324 HydrophobicContact CG1-CD1 4.29Å; V320-L324 WeakPolarHBondContact O-CG 3.42Å; V320-L324 PolarHBondContact O-N 2.91Å; V320-L324 VanDerWaalsContact O-N 3.14Å; F321-L324 PolarHBondContact O-N 3.22Å; L324-T326 VanDerWaalsContact C-N 3.3Å; L324-T326 PolarHBondContact O-N 3.38Å; L324-L327 PolarHBondContact O-N 3.49Å; L324-H328 PolarHBondContact O-N 2.92Å; L324-I345 HydrophobicContact CD2-CG2 4.26Å
325A97.3Very high94Very high19 Ų1954.7 Ų54.716%0.15730%0.3CS..Hα-helixtrans-65.9-32.7174.900000112.5K264 F268 F321 S322 W323 H328K264-A325 PolarHBondContact NZ-O 3.25Å; F268-A325 HydrophobicContact CB-CB 3.83Å; F268-A325 HydrophobicContact CD1-CB 3.58Å; F268-A325 HydrophobicContact CD2-CB 4.14Å; F268-A325 HydrophobicContact CE1-CB 4.18Å; F268-A325 HydrophobicContact CG-CB 3.55Å; F321-A325 HydrophobicContact CE1-CB 4.4Å; F321-A325 WeakPolarHBondContact O-CB 2.97Å; F321-A325 PolarHBondContact O-N 3.21Å; S322-A325 PolarHBondContact O-N 3.22Å; W323-A325 VanDerWaalsContact C-N 3.35Å; W323-A325 PolarHBondContact O-N 2.97Å; A325-H328 PolarHBondContact O-N 3.17Å
326T96.1Very high93.9Very high0 Ų054.2 Ų54.20%030%0.297CS..Hα-helixtrans-67.5-39.8173.4-54.60000111.1V258 K264 P267 F268 S322 W323 L324V258-T326 HydrophobicContact CG1-CG2 3.72Å; K264-T326 HydrophobicContact CD-CG2 4.09Å; K264-T326 VanDerWaalsContact CD-O 3.31Å; K264-T326 WeakPolarHBondContact CD-O 3.36Å; K264-T326 WeakPolarHBondContact CE-O 3.2Å; K264-T326 PolarHBondContact NZ-O 3.19Å; P267-T326 HydrophobicContact CB-CG2 4.48Å; F268-T326 PolarHBondContact N-OG1 3.18Å; S322-T326 WeakPolarHBondContact O-CB 3.43Å; S322-T326 PolarHBondContact O-N 2.83Å; S322-T326 PolarHBondContact O-OG1 3.4Å; W323-T326 WeakPolarHBondContact O-CB 3.37Å; W323-T326 PolarHBondContact O-N 2.97Å; W323-T326 VanDerWaalsContact O-N 3.14Å; L324-T326 VanDerWaalsContact C-N 3.3Å; L324-T326 PolarHBondContact O-N 3.38Å
327L94.8Very high93.9Very high20 Ų2053 Ų5311%0.10529%0.29CS..Hα-helixtrans-72-31.1176.1-63.6163000112.2V258 W323 L324 G329 S330 M332 L342 I345V258-L327 HydrophobicContact CB-CD2 4.49Å; V258-L327 HydrophobicContact CG1-CD1 4.46Å; V258-L327 HydrophobicContact CG1-CD2 3.82Å; V258-L327 HydrophobicContact CG1-CG 3.78Å; V258-L327 HydrophobicContact CG2-CD2 4.4Å; W323-L327 WeakPolarHBondContact O-CG 3.47Å; W323-L327 PolarHBondContact O-N 3.38Å; L324-L327 PolarHBondContact O-N 3.49Å; L327-G329 PolarHBondContact O-N 3.33Å; L327-S330 WeakPolarHBondContact O-CB 3.36Å; L327-S330 PolarHBondContact O-N 3.32Å; L327-S330 PolarHBondContact O-OG 3.41Å; L327-M332 HydrophobicContact CB-SD 4.26Å; L327-M332 HydrophobicContact CD2-SD 3.4Å; L327-M332 WeakPolarHBondContact CD2-SD 3.33Å; L327-M332 HydrophobicContact CG-SD 4.36Å; L327-L342 HydrophobicContact CD1-CD2 3.68Å; L327-I345 HydrophobicContact CD1-CD1 4.26Å
328H94.5Very high93.8Very high152 Ų15251.5 Ų51.570%0.70427%0.273SS*.THydrogen-bonded Turntrans-59.1131.5-178-176.1-93.1000112.5K264 L324 A325 S330K264-H328 PolarHBondContact NZ-O 3.05Å; L324-H328 PolarHBondContact O-N 2.92Å; A325-H328 PolarHBondContact O-N 3.17Å; H328-S330 PolarHBondContact O-N 3.22Å
329G90Very high93.9Very high77 Ų7750.5 Ų50.579%0.79427%0.266SS*.THydrogen-bonded Turntrans72.78.8179.700000115.1L327L327-G329 PolarHBondContact O-N 3.33Å
330S89.3Confident93.9Very high26 Ų2650.5 Ų50.518%0.18227%0.266CS..  trans-90.4148.7175.370.10000112S262 L327 H328 M332S262-S330 WeakPolarHBondContact O-CB 3.39Å; L327-S330 WeakPolarHBondContact O-CB 3.36Å; L327-S330 PolarHBondContact O-N 3.32Å; L327-S330 PolarHBondContact O-OG 3.41Å; H328-S330 PolarHBondContact O-N 3.22Å; S330-M332 PolarHBondContact O-N 2.87Å; S330-M332 WeakPolarHBondContact OG-CG 3.44Å
331N85.6Confident93.9Very high163 Ų16349.5 Ų49.587%0.87226%0.26SS*.  trans-89.581.2171.1-172.911.6000109.4
332M83.1Confident93.9Very high40 Ų4045.7 Ų45.720%0.19725%0.245CC..  trans-73131.3-171.6-63.3-167.5-61.500113L327 S330 W334 V338L327-M332 HydrophobicContact CB-SD 4.26Å; L327-M332 HydrophobicContact CD2-SD 3.4Å; L327-M332 WeakPolarHBondContact CD2-SD 3.33Å; L327-M332 HydrophobicContact CG-SD 4.36Å; S330-M332 PolarHBondContact O-N 2.87Å; S330-M332 WeakPolarHBondContact OG-CG 3.44Å; M332-W334 HydrophobicContact CE-CH2 3.79Å; M332-W334 HydrophobicContact CE-CZ2 3.96Å; M332-W334 HydrophobicContact CE-CZ3 4.33Å; M332-V338 HydrophobicContact SD-CG1 4.42Å
333K83.2Confident93.9Very high117 Ų11745.7 Ų45.751%0.50925%0.246SC..  trans-80121160.5-66.9176.8-176.1164.50108.9S335 E486K333-S335 PolarHBondContact O-N 3.21Å; K333-E486 IonicContact NZ-OE1 3.63Å; K333-E486 PolarHBondContact NZ-OE1 2.83Å; K333-E486 IonicContact NZ-OE2 3.31Å; K333-E486 PolarHBondContact NZ-OE2 3.46Å
334W90.6Very high93.9Very high148 Ų14845.6 Ų45.656%0.56125%0.245SC*.  trans-73.170.4177.1-63.9101.1000112M332 L339 L342 K411M332-W334 HydrophobicContact CE-CH2 3.79Å; M332-W334 HydrophobicContact CE-CZ2 3.96Å; M332-W334 HydrophobicContact CE-CZ3 4.33Å; W334-L339 HydrophobicContact CE3-CD2 4.09Å; W334-L339 HydrophobicContact CZ3-CD2 4.49Å; W334-L342 HydrophobicContact CE3-CD1 4.47Å; W334-L342 HydrophobicContact CH2-CD1 4.21Å; W334-L342 HydrophobicContact CZ3-CD1 3.53Å; W334-K411 WeakPolarHBondContact O-CE 3.31Å; W334-K411 PolarHBondContact O-NZ 2.9Å
335S93.8Very high93.9Very high13 Ų1341.8 Ų41.89%0.09123%0.225CC..  trans-80.5161172.173.90000110.8Y261 K333 A337 V338 L339Y261-S335 WeakPolarHBondContact CD1-OG 3.3Å; Y261-S335 WeakPolarHBondContact CE1-OG 3.43Å; K333-S335 PolarHBondContact O-N 3.21Å; S335-A337 VanDerWaalsContact C-N 3.28Å; S335-A337 PolarHBondContact O-N 3.11Å; S335-V338 PolarHBondContact O-N 3.48Å; S335-V338 WeakPolarHBondContact OG-CG2 3.36Å; S335-V338 PolarHBondContact OG-N 2.8Å; S335-L339 PolarHBondContact O-N 2.79Å
336A96.7Very high93.9Very high0 Ų046.3 Ų46.30%024%0.242CC..Hα-helixtrans-59-39.5175.800000112.3V338 L339 W340 I394 Q407 A410 K411A336-V338 VanDerWaalsContact C-N 3.31Å; A336-V338 PolarHBondContact O-N 3.17Å; A336-L339 WeakPolarHBondContact O-CB 3.31Å; A336-L339 PolarHBondContact O-N 3.05Å; A336-L339 VanDerWaalsContact O-N 3.08Å; A336-W340 PolarHBondContact O-N 2.84Å; A336-I394 HydrophobicContact CB-CD1 4.45Å; A336-I394 HydrophobicContact CB-CG2 4.14Å; A336-Q407 VanDerWaalsContact N-OE1 3.1Å; A336-A410 HydrophobicContact CB-CB 3.48Å; A336-A410 VanDerWaalsContact CB-CB 3.48Å; A336-K411 HydrophobicContact CB-CG 4.27Å
337A96.2Very high94Very high0 Ų046.3 Ų46.30%024%0.242CC..Hα-helixtrans-59.6-38.5178.200000112.8I257 Y261 S335 W340 A341 I394 H395I257-A337 HydrophobicContact CG2-CB 4.11Å; Y261-A337 HydrophobicContact CD2-CB 4.4Å; Y261-A337 HydrophobicContact CE2-CB 3.53Å; S335-A337 VanDerWaalsContact C-N 3.28Å; S335-A337 PolarHBondContact O-N 3.11Å; A337-W340 PolarHBondContact O-N 3.47Å; A337-A341 PolarHBondContact O-N 2.9Å; A337-I394 HydrophobicContact CB-CG2 4.22Å; A337-H395 HydrophobicContact CB-CB 4.22Å
338V95.9Very high94.1Very high5 Ų546 Ų463%0.0324%0.239CC..Hα-helixtrans-65.3-40.2174.2174.30000111.4Y261 M332 S335 A336 W340 A341 L342Y261-V338 HydrophobicContact CD1-CG2 3.92Å; Y261-V338 HydrophobicContact CD2-CG2 3.73Å; Y261-V338 HydrophobicContact CG-CG2 3.37Å; M332-V338 HydrophobicContact SD-CG1 4.42Å; S335-V338 PolarHBondContact O-N 3.48Å; S335-V338 WeakPolarHBondContact OG-CG2 3.36Å; S335-V338 PolarHBondContact OG-N 2.8Å; A336-V338 VanDerWaalsContact C-N 3.31Å; A336-V338 PolarHBondContact O-N 3.17Å; V338-W340 PolarHBondContact O-N 2.93Å; V338-A341 PolarHBondContact O-N 2.97Å; V338-L342 HydrophobicContact CG1-CD1 3.92Å; V338-L342 HydrophobicContact CG1-CG 4.27Å; V338-L342 WeakPolarHBondContact O-CG 3.47Å; V338-L342 PolarHBondContact O-N 3.27Å
339L97.8Very high94.2Very high35 Ų3541.1 Ų41.118%0.18322%0.221CC..Hα-helixtrans-61.6-43.9176.4-63.7178.8000111.6W334 S335 A336 A341 L342 G343 K411 F414W334-L339 HydrophobicContact CE3-CD2 4.09Å; W334-L339 HydrophobicContact CZ3-CD2 4.49Å; S335-L339 PolarHBondContact O-N 2.79Å; A336-L339 WeakPolarHBondContact O-CB 3.31Å; A336-L339 PolarHBondContact O-N 3.05Å; A336-L339 VanDerWaalsContact O-N 3.08Å; L339-A341 VanDerWaalsContact C-N 3.33Å; L339-A341 PolarHBondContact O-N 3.42Å; L339-L342 PolarHBondContact O-N 2.6Å; L339-G343 PolarHBondContact O-N 3.02Å; L339-K411 HydrophobicContact CD1-CB 4.41Å; L339-K411 HydrophobicContact CD1-CG 3.9Å; L339-F414 VanDerWaalsContact C-CE2 3.48Å; L339-F414 HydrophobicContact CB-CD1 3.71Å; L339-F414 HydrophobicContact CB-CD2 4.09Å; L339-F414 HydrophobicContact CB-CE1 3.8Å; L339-F414 HydrophobicContact CB-CE2 4.17Å; L339-F414 HydrophobicContact CB-CG 3.85Å; L339-F414 HydrophobicContact CB-CZ 4.03Å; L339-F414 HydrophobicContact CD1-CD1 3.91Å; L339-F414 HydrophobicContact CD1-CE1 4.39Å; L339-F414 HydrophobicContact CD1-CG 4.47Å; L339-F414 HydrophobicContact CG-CD1 4.36Å; L339-F414 HydrophobicContact CG-CE1 4.49Å; L339-F414 WeakPolarHBondContact O-CE2 3.4Å; L339-F414 WeakPolarHBondContact O-CZ 3.35Å
340W98.3Very high94.6Very high0 Ų039.1 Ų39.10%019%0.193CC..Hα-helixtrans-61.5-40.9173.7-74.7101.6000112.3A336 A337 V338 G343 F344 F387 M390 I394 H413 F414 M417A336-W340 PolarHBondContact O-N 2.84Å; A337-W340 PolarHBondContact O-N 3.47Å; V338-W340 PolarHBondContact O-N 2.93Å; W340-G343 PolarHBondContact O-N 2.8Å; W340-F344 WeakPolarHBondContact O-CB 3.4Å; W340-F344 PolarHBondContact O-N 2.86Å; W340-F387 HydrophobicContact CE3-CB 4.03Å; 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 4.33Å; W340-F387 AromaticContact CE3-CE1 3.86Å; W340-F387 HydrophobicContact CE3-CE1 3.86Å; W340-F387 AromaticContact CE3-CG 3.72Å; W340-F387 HydrophobicContact CE3-CG 3.72Å; W340-F387 HydrophobicContact CE3-CZ 4.45Å; W340-F387 HydrophobicContact CZ3-CB 4.42Å; W340-F387 AromaticContact CZ3-CD1 3.74Å; W340-F387 HydrophobicContact CZ3-CD1 3.74Å; W340-F387 AromaticContact CZ3-CD2 3.93Å; W340-F387 HydrophobicContact CZ3-CD2 3.93Å; W340-F387 AromaticContact CZ3-CE1 3.79Å; W340-F387 HydrophobicContact CZ3-CE1 3.79Å; W340-F387 AromaticContact CZ3-CE2 3.99Å; W340-F387 HydrophobicContact CZ3-CE2 3.99Å; W340-F387 AromaticContact CZ3-CG 3.8Å; W340-F387 HydrophobicContact CZ3-CG 3.8Å; W340-F387 AromaticContact CZ3-CZ 3.92Å; W340-F387 HydrophobicContact CZ3-CZ 3.92Å; W340-M390 HydrophobicContact CD2-CB 3.68Å; W340-M390 HydrophobicContact CE3-CB 3.58Å; W340-M390 HydrophobicContact CE3-CG 4.34Å; W340-M390 HydrophobicContact CG-CB 4.4Å; W340-M390 HydrophobicContact CH2-CB 3.83Å; W340-M390 HydrophobicContact CH2-CG 3.88Å; W340-M390 HydrophobicContact CZ2-CB 3.95Å; W340-M390 HydrophobicContact CZ2-CG 4.32Å; W340-M390 HydrophobicContact CZ3-CB 3.65Å; W340-M390 HydrophobicContact CZ3-CG 3.9Å; W340-I394 HydrophobicContact CG-CD1 4.43Å; W340-H413 AromaticContact CH2-CE1 3.92Å; W340-H413 AromaticContact CZ2-CE1 3.49Å; W340-H413 VanDerWaalsContact CZ2-CE1 3.49Å; W340-H413 WeakPolarHBondContact CZ2-CE1 3.37Å; W340-H413 AromaticContact CZ2-ND1 3.45Å; W340-H413 WeakPolarHBondContact CZ2-ND1 3.34Å; W340-F414 AromaticContact CD2-CD2 3.69Å; W340-F414 HydrophobicContact CD2-CD2 3.69Å; W340-F414 AromaticContact CE2-CD2 3.82Å; W340-F414 HydrophobicContact CE3-CD2 4.03Å; W340-F414 AromaticContact CG-CD2 3.97Å; W340-F414 HydrophobicContact CG-CD2 3.97Å; W340-F414 HydrophobicContact CZ2-CB 4.02Å; W340-F414 HydrophobicContact CZ2-CD2 4.29Å; W340-F414 HydrophobicContact CZ3-CD2 4.49Å; W340-M417 HydrophobicContact CH2-CB 3.69Å; W340-M417 HydrophobicContact CH2-CG 3.73Å; W340-M417 HydrophobicContact CZ2-CB 4.44Å; W340-M417 HydrophobicContact CZ3-CB 4.47Å; W340-M417 HydrophobicContact CZ3-CG 4.17Å
341A97.7Very high94.9Very high2 Ų237.9 Ų37.92%0.01718%0.184CC..Hα-helixtrans-65.1-42.117700000112.8I254 I257 V258 A337 V338 L339 F344 I345I254-A341 HydrophobicContact CD1-CB 4.1Å; I257-A341 HydrophobicContact CG2-CB 3.9Å; V258-A341 HydrophobicContact CG2-CB 4.15Å; A337-A341 PolarHBondContact O-N 2.9Å; V338-A341 PolarHBondContact O-N 2.97Å; L339-A341 VanDerWaalsContact C-N 3.33Å; L339-A341 PolarHBondContact O-N 3.42Å; A341-F344 WeakPolarHBondContact O-CB 3.46Å; A341-F344 PolarHBondContact O-N 3.38Å; A341-I345 VanDerWaalsContact O-CG1 3.25Å; A341-I345 WeakPolarHBondContact O-CG1 3.44Å; A341-I345 PolarHBondContact O-N 3.07Å
342L97.6Very high95.4Very high49 Ų4931.3 Ų31.326%0.25716%0.155SC..Hα-helixtrans-68.5-40.6175.5-69.8173000112L327 W334 V338 L339 F344 I345 F346L327-L342 HydrophobicContact CD1-CD2 3.68Å; W334-L342 HydrophobicContact CE3-CD1 4.47Å; W334-L342 HydrophobicContact CH2-CD1 4.21Å; W334-L342 HydrophobicContact CZ3-CD1 3.53Å; V338-L342 HydrophobicContact CG1-CD1 3.92Å; V338-L342 HydrophobicContact CG1-CG 4.27Å; V338-L342 WeakPolarHBondContact O-CG 3.47Å; V338-L342 PolarHBondContact O-N 3.27Å; L339-L342 PolarHBondContact O-N 2.6Å; L342-F344 VanDerWaalsContact C-N 3.32Å; L342-F344 PolarHBondContact O-N 2.9Å; L342-I345 PolarHBondContact O-N 3.31Å; L342-F346 WeakPolarHBondContact O-CB 3.43Å; L342-F346 PolarHBondContact O-N 3.23Å
343G97.8Very high96.1Very high3 Ų334.5 Ų34.53%0.03117%0.172CC..Hα-helixtrans-59.5-44.1173.700000111.6L339 W340 L347L339-G343 PolarHBondContact O-N 3.02Å; W340-G343 PolarHBondContact O-N 2.8Å; G343-L347 WeakPolarHBondContact O-CB 3.28Å; G343-L347 VanDerWaalsContact O-CG 3.23Å; G343-L347 WeakPolarHBondContact O-CG 3.16Å; G343-L347 PolarHBondContact O-N 2.62Å
344F98.2Very high96.8Very high0 Ų029.7 Ų29.70%015%0.153CC..Hα-helixtrans-56.7-55.8171.5172.9-87.2000111.2I247 F251 I254 W323 W340 A341 L342 F346 L347 F348 G384 F387 A388I247-F344 HydrophobicContact CD1-CE2 3.87Å; I247-F344 HydrophobicContact CD1-CZ 4.18Å; F251-F344 HydrophobicContact CD1-CE1 4.13Å; F251-F344 AromaticContact CD1-CZ 3.63Å; F251-F344 HydrophobicContact CD1-CZ 3.63Å; F251-F344 HydrophobicContact CE1-CE1 4.37Å; F251-F344 AromaticContact CE1-CZ 3.78Å; F251-F344 HydrophobicContact CE1-CZ 3.78Å; I254-F344 HydrophobicContact CB-CD1 4.2Å; I254-F344 HydrophobicContact CB-CE1 4.33Å; I254-F344 HydrophobicContact CD1-CB 3.6Å; I254-F344 HydrophobicContact CD1-CD1 3.77Å; I254-F344 HydrophobicContact CD1-CD2 4.13Å; I254-F344 HydrophobicContact CD1-CG 3.55Å; I254-F344 HydrophobicContact CG1-CB 4.31Å; I254-F344 HydrophobicContact CG1-CD1 3.55Å; I254-F344 HydrophobicContact CG1-CD2 4.09Å; I254-F344 HydrophobicContact CG1-CE1 3.84Å; I254-F344 HydrophobicContact CG1-CE2 4.31Å; I254-F344 HydrophobicContact CG1-CG 3.7Å; I254-F344 HydrophobicContact CG1-CZ 4.22Å; I254-F344 HydrophobicContact CG2-CD1 3.89Å; I254-F344 HydrophobicContact CG2-CE1 4.25Å; W323-F344 AromaticContact CH2-CE1 3.81Å; W323-F344 HydrophobicContact CH2-CE1 3.81Å; W323-F344 AromaticContact CZ3-CE1 3.84Å; W323-F344 HydrophobicContact CZ3-CE1 3.84Å; W340-F344 WeakPolarHBondContact O-CB 3.4Å; W340-F344 PolarHBondContact O-N 2.86Å; A341-F344 WeakPolarHBondContact O-CB 3.46Å; A341-F344 PolarHBondContact O-N 3.38Å; L342-F344 VanDerWaalsContact C-N 3.32Å; L342-F344 PolarHBondContact O-N 2.9Å; F344-F346 VanDerWaalsContact C-N 3.28Å; F344-F346 PolarHBondContact O-N 3.48Å; F344-L347 PolarHBondContact O-N 2.76Å; F344-F348 HydrophobicContact CE1-CB 4.31Å; F344-F348 HydrophobicContact CE1-CG 4.36Å; F344-F348 HydrophobicContact CE2-CD2 4.5Å; F344-F348 HydrophobicContact CZ-CB 4.29Å; F344-F348 HydrophobicContact CZ-CD2 4.22Å; F344-F348 HydrophobicContact CZ-CG 4.11Å; F344-F348 WeakPolarHBondContact O-CB 3.24Å; F344-F348 PolarHBondContact O-N 3.01Å; F344-G384 WeakPolarHBondContact CD2-O 3.49Å; F344-G384 VanDerWaalsContact CE2-CA 3.48Å; F344-G384 WeakPolarHBondContact CE2-O 3.05Å; F344-F387 HydrophobicContact CB-CB 4.09Å; F344-F387 HydrophobicContact CD2-CB 4.41Å; F344-A388 HydrophobicContact CD2-CB 4.07Å; F344-A388 HydrophobicContact CE2-CB 4.12Å
345I98.1Very high97.1Very high8 Ų823.5 Ų23.54%0.04113%0.134CC..Hα-helixtrans-57.3-44.1-176.1-67.8165.2000110.7I254 V258 V320 W323 L324 L327 A341 L342 T349I254-I345 HydrophobicContact CG2-CG1 4.32Å; V258-I345 HydrophobicContact CG2-CD1 4.24Å; V320-I345 HydrophobicContact CG1-CG2 4.23Å; W323-I345 HydrophobicContact CB-CD1 3.7Å; W323-I345 HydrophobicContact CB-CG1 4.38Å; W323-I345 HydrophobicContact CD2-CG1 4.35Å; W323-I345 HydrophobicContact CE3-CD1 4.42Å; W323-I345 HydrophobicContact CE3-CG1 3.85Å; W323-I345 HydrophobicContact CG-CD1 4.25Å; L324-I345 HydrophobicContact CD2-CG2 4.26Å; L327-I345 HydrophobicContact CD1-CD1 4.26Å; A341-I345 VanDerWaalsContact O-CG1 3.25Å; A341-I345 WeakPolarHBondContact O-CG1 3.44Å; A341-I345 PolarHBondContact O-N 3.07Å; L342-I345 PolarHBondContact O-N 3.31Å; I345-T349 WeakPolarHBondContact O-CB 3.4Å; I345-T349 PolarHBondContact O-N 3.13Å; I345-T349 PolarHBondContact O-OG1 3.16Å
346F97.7Very high97.2Very high115 Ų11526.3 Ų26.350%0.50415%0.148SC..Hα-helixtrans-65.3-57.1178.8176.4-107.5000112.4L342 F344 F348 T349 V350 F418L342-F346 WeakPolarHBondContact O-CB 3.43Å; L342-F346 PolarHBondContact O-N 3.23Å; F344-F346 VanDerWaalsContact C-N 3.28Å; F344-F346 PolarHBondContact O-N 3.48Å; F346-F348 PolarHBondContact O-N 3.28Å; F346-T349 WeakPolarHBondContact O-CB 3.22Å; F346-T349 PolarHBondContact O-N 3.39Å; F346-T349 VanDerWaalsContact O-N 3.16Å; F346-V350 HydrophobicContact CE1-CG2 4.4Å; F346-V350 HydrophobicContact CE2-CG2 4.3Å; F346-V350 HydrophobicContact CZ-CG2 4.13Å; F346-V350 PolarHBondContact O-N 3.25Å; F346-F418 HydrophobicContact CD1-CE2 4.26Å; F346-F418 AromaticContact CD1-CZ 4Å; F346-F418 HydrophobicContact CD1-CZ 4Å; F346-F418 HydrophobicContact CE1-CZ 4.21Å
347L97.3Very high97.3Very high0 Ų028.5 Ų28.50%016%0.161CC..Hα-helixtrans-68.9-37.9-173.3-62.4167.8000111.6G343 F344 T349 V350 G351 Y379 M383 F387 F418 N422G343-L347 WeakPolarHBondContact O-CB 3.28Å; G343-L347 VanDerWaalsContact O-CG 3.23Å; G343-L347 WeakPolarHBondContact O-CG 3.16Å; G343-L347 PolarHBondContact O-N 2.62Å; F344-L347 PolarHBondContact O-N 2.76Å; L347-T349 VanDerWaalsContact C-N 3.28Å; L347-T349 PolarHBondContact O-N 3.41Å; L347-V350 PolarHBondContact O-N 2.94Å; L347-G351 PolarHBondContact O-N 3.39Å; L347-Y379 HydrophobicContact CB-CD1 4.35Å; L347-Y379 HydrophobicContact CD2-CD1 4.4Å; L347-Y379 HydrophobicContact CD2-CE1 3.77Å; L347-Y379 WeakPolarHBondContact O-CD1 3.37Å; L347-M383 HydrophobicContact CB-CB 3.81Å; L347-M383 HydrophobicContact CB-CG 4.39Å; L347-M383 HydrophobicContact CB-SD 4.04Å; L347-M383 HydrophobicContact CD1-CB 4.05Å; L347-M383 HydrophobicContact CD1-CG 3.89Å; L347-M383 HydrophobicContact CD1-SD 3.59Å; L347-M383 VanDerWaalsContact CD1-SD 3.59Å; L347-M383 HydrophobicContact CD2-SD 3.8Å; L347-M383 HydrophobicContact CG-SD 3.99Å; L347-F387 HydrophobicContact CD1-CD1 4.25Å; L347-F387 HydrophobicContact CD1-CE1 3.68Å; L347-F387 HydrophobicContact CD1-CE2 4.22Å; L347-F387 HydrophobicContact CD1-CZ 3.66Å; L347-F418 HydrophobicContact CD1-CD2 3.75Å; L347-F418 HydrophobicContact CD1-CE2 3.57Å; L347-F418 HydrophobicContact CD2-CE2 4.02Å; L347-F418 HydrophobicContact CD2-CZ 4.32Å; L347-F418 HydrophobicContact CG-CE2 3.84Å; L347-N422 WeakPolarHBondContact CD2-ND2 3.5Å; L347-N422 VanDerWaalsContact CD2-OD1 3.23Å; L347-N422 WeakPolarHBondContact CD2-OD1 3.4Å
348F97.1Very high97.3Very high12 Ų1229.4 Ų29.45%0.05317%0.166CC..Hα-helixtrans-62.5-36.8173.9-177-95.9000111.7I247 F251 T316 F344 F346 G351 G352 V380I247-F348 HydrophobicContact CD1-CD2 4.2Å; I247-F348 HydrophobicContact CD1-CE2 4.1Å; I247-F348 HydrophobicContact CG1-CD2 4.31Å; I247-F348 HydrophobicContact CG1-CE2 3.72Å; I247-F348 HydrophobicContact CG1-CZ 4.46Å; F251-F348 HydrophobicContact CE1-CD1 4.32Å; F251-F348 HydrophobicContact CE1-CD2 4.39Å; F251-F348 AromaticContact CE1-CE1 3.76Å; F251-F348 HydrophobicContact CE1-CE1 3.76Å; F251-F348 AromaticContact CE1-CE2 3.84Å; F251-F348 HydrophobicContact CE1-CE2 3.84Å; F251-F348 AromaticContact CE1-CZ 3.52Å; F251-F348 HydrophobicContact CE1-CZ 3.52Å; F251-F348 AromaticContact CZ-CE1 3.9Å; F251-F348 HydrophobicContact CZ-CE1 3.9Å; F251-F348 AromaticContact CZ-CE2 4Å; F251-F348 HydrophobicContact CZ-CE2 4Å; F251-F348 AromaticContact CZ-CZ 3.42Å; F251-F348 HydrophobicContact CZ-CZ 3.42Å; F251-F348 VanDerWaalsContact CZ-CZ 3.42Å; T316-F348 HydrophobicContact CG2-CE1 3.51Å; T316-F348 HydrophobicContact CG2-CZ 3.96Å; F344-F348 HydrophobicContact CE1-CB 4.31Å; F344-F348 HydrophobicContact CE1-CG 4.36Å; F344-F348 HydrophobicContact CE2-CD2 4.5Å; F344-F348 HydrophobicContact CZ-CB 4.29Å; F344-F348 HydrophobicContact CZ-CD2 4.22Å; F344-F348 HydrophobicContact CZ-CG 4.11Å; F344-F348 WeakPolarHBondContact O-CB 3.24Å; F344-F348 PolarHBondContact O-N 3.01Å; F346-F348 PolarHBondContact O-N 3.28Å; F348-G351 PolarHBondContact O-N 2.72Å; F348-G352 PolarHBondContact O-N 2.67Å; F348-V380 HydrophobicContact CD2-CG1 4.43Å; F348-V380 HydrophobicContact CE2-CG1 3.87Å
349T97.3Very high97.4Very high51 Ų5129.3 Ų29.331%0.31317%0.166SC..Hα-helixtrans-66.2-43.6174.7-590000111.4I345 F346 L347 G351 G352 L353I345-T349 WeakPolarHBondContact O-CB 3.4Å; I345-T349 PolarHBondContact O-N 3.13Å; I345-T349 PolarHBondContact O-OG1 3.16Å; F346-T349 WeakPolarHBondContact O-CB 3.22Å; F346-T349 PolarHBondContact O-N 3.39Å; F346-T349 VanDerWaalsContact O-N 3.16Å; L347-T349 VanDerWaalsContact C-N 3.28Å; L347-T349 PolarHBondContact O-N 3.41Å; T349-G351 VanDerWaalsContact C-N 3.34Å; T349-G351 PolarHBondContact O-N 2.89Å; T349-G352 PolarHBondContact O-N 3.45Å; T349-L353 WeakPolarHBondContact O-CG 3.38Å; T349-L353 PolarHBondContact O-N 2.88Å
350V97Very high97.4Very high35 Ų3530 Ų3021%0.21217%0.169CC..Hα-helixtrans-60-44.6174.8174.80000111F346 L347 L353 T354 Y379F346-V350 HydrophobicContact CE1-CG2 4.4Å; F346-V350 HydrophobicContact CE2-CG2 4.3Å; F346-V350 HydrophobicContact CZ-CG2 4.13Å; F346-V350 PolarHBondContact O-N 3.25Å; L347-V350 PolarHBondContact O-N 2.94Å; V350-L353 PolarHBondContact O-N 3.41Å; V350-T354 PolarHBondContact O-N 3.16Å; V350-T354 PolarHBondContact O-OG1 3.36Å; V350-Y379 HydrophobicContact CB-CD1 4.09Å; V350-Y379 HydrophobicContact CB-CE1 4.23Å; V350-Y379 HydrophobicContact CG1-CD1 3.93Å; V350-Y379 HydrophobicContact CG1-CE1 3.86Å
351G96.6Very high97.3Very high0 Ų030.5 Ų30.50%017%0.173CC..Hα-helixtrans-60.5-43.417300000112.9L347 F348 T349 L353 T354 G355 H376L347-G351 PolarHBondContact O-N 3.39Å; F348-G351 PolarHBondContact O-N 2.72Å; T349-G351 VanDerWaalsContact C-N 3.34Å; T349-G351 PolarHBondContact O-N 2.89Å; G351-L353 VanDerWaalsContact C-N 3.35Å; G351-L353 PolarHBondContact O-N 3.24Å; G351-T354 PolarHBondContact O-N 3.41Å; G351-T354 PolarHBondContact O-OG1 3.44Å; G351-G355 PolarHBondContact O-N 3.18Å; G351-H376 PolarHBondContact O-CE1 2.84Å; G351-H376 PolarHBondContact O-ND1 2.93Å
352G96.1Very high97.3Very high25 Ų2534.5 Ų34.526%0.25820%0.201SC..Hα-helixtrans-60.8-41.817700000112.7F348 T349 G355 I356F348-G352 PolarHBondContact O-N 2.67Å; T349-G352 PolarHBondContact O-N 3.45Å; G352-G355 WeakPolarHBondContact O-CA 3.5Å; G352-G355 PolarHBondContact O-N 2.92Å; G352-G355 VanDerWaalsContact O-N 3.15Å; G352-I356 WeakPolarHBondContact O-CG1 3.25Å; G352-I356 PolarHBondContact O-N 3.49Å
353L96.8Very high97.2Very high106 Ų10636 Ų3656%0.55521%0.209SC*.Hα-helixtrans-63.8-42.1177.9-69174.4000112.3T349 V350 G351 G355 I356 V357T349-L353 WeakPolarHBondContact O-CG 3.38Å; T349-L353 PolarHBondContact O-N 2.88Å; V350-L353 PolarHBondContact O-N 3.41Å; G351-L353 VanDerWaalsContact C-N 3.35Å; G351-L353 PolarHBondContact O-N 3.24Å; L353-G355 VanDerWaalsContact C-N 3.26Å; L353-G355 PolarHBondContact O-N 3.46Å; L353-I356 HydrophobicContact CD2-CD1 4.44Å; L353-I356 PolarHBondContact O-N 2.83Å; L353-V357 PolarHBondContact O-N 3.14Å
354T97.6Very high97.2Very high17 Ų1736.2 Ų36.210%0.10421%0.209CC..Hα-helixtrans-68.8-27.9174.657.80000111.9V350 G351 V357 L358 H376V350-T354 PolarHBondContact O-N 3.16Å; V350-T354 PolarHBondContact O-OG1 3.36Å; G351-T354 PolarHBondContact O-N 3.41Å; G351-T354 PolarHBondContact O-OG1 3.44Å; T354-V357 WeakPolarHBondContact O-CB 3.25Å; T354-V357 PolarHBondContact O-N 3.19Å; T354-L358 PolarHBondContact O-N 3.14Å; T354-L358 VanDerWaalsContact O-N 3.13Å; T354-H376 PolarHBondContact OG1-ND1 3.29Å; T354-H376 VanDerWaalsContact OG1-ND1 3.13Å
355G96.8Very high97Very high17 Ų1740.6 Ų40.618%0.17523%0.232CC..Hα-helixtrans-67.1-36.8171.700000113.4G351 G352 L353 V357 L358 A359 H376G351-G355 PolarHBondContact O-N 3.18Å; G352-G355 WeakPolarHBondContact O-CA 3.5Å; G352-G355 PolarHBondContact O-N 2.92Å; G352-G355 VanDerWaalsContact O-N 3.15Å; L353-G355 VanDerWaalsContact C-N 3.26Å; L353-G355 PolarHBondContact O-N 3.46Å; G355-V357 VanDerWaalsContact C-N 3.25Å; G355-V357 PolarHBondContact O-N 3.11Å; G355-L358 CarbonylContact O-C 3.49Å; G355-L358 PolarHBondContact O-N 3.44Å; G355-A359 WeakPolarHBondContact O-CB 3.38Å; G355-A359 PolarHBondContact O-N 3.3Å; G355-H376 WeakPolarHBondContact CA-CE1 3.41Å; G355-H376 VanDerWaalsContact CA-ND1 3.34Å; G355-H376 WeakPolarHBondContact CA-ND1 3.35Å; G355-H376 PolarHBondContact N-CE1 2.89Å; G355-H376 PolarHBondContact N-ND1 3.29Å
356I96.9Very high97Very high72 Ų7245.1 Ų45.137%0.36926%0.259SS..Hα-helixtrans-64.1-34.5174.1-65.7167.9000110.8A313 G352 L353 A359A313-I356 HydrophobicContact CB-CD1 3.78Å; A313-I356 HydrophobicContact CB-CG1 4.07Å; G352-I356 WeakPolarHBondContact O-CG1 3.25Å; G352-I356 PolarHBondContact O-N 3.49Å; L353-I356 HydrophobicContact CD2-CD1 4.44Å; L353-I356 PolarHBondContact O-N 2.83Å; I356-A359 PolarHBondContact O-N 2.96Å
357V97.9Very high97Very high47 Ų4740.1 Ų40.129%0.28524%0.238SC..Hα-helixtrans-63.4-48.4172.9179.10000110.4L353 T354 G355 A359 N360 L363 L367 Y372L353-V357 PolarHBondContact O-N 3.14Å; T354-V357 WeakPolarHBondContact O-CB 3.25Å; T354-V357 PolarHBondContact O-N 3.19Å; G355-V357 VanDerWaalsContact C-N 3.25Å; G355-V357 PolarHBondContact O-N 3.11Å; V357-A359 VanDerWaalsContact C-N 3.29Å; V357-A359 PolarHBondContact O-N 3.21Å; V357-N360 WeakPolarHBondContact O-CB 3.45Å; V357-N360 PolarHBondContact O-N 3.38Å; V357-L363 HydrophobicContact CG1-CD1 3.88Å; V357-L367 HydrophobicContact CG1-CD1 3.84Å; V357-Y372 HydrophobicContact CB-CE1 4.44Å; V357-Y372 HydrophobicContact CG1-CE1 4.37Å
358L97.8Very high97Very high18 Ų1841.9 Ų41.99%0.09425%0.246CC..Hα-helixtrans-68.5-24.4178.3-69.9173.2000113.8T354 G355 N360 L367 Y372 V373 H376T354-L358 PolarHBondContact O-N 3.14Å; T354-L358 VanDerWaalsContact O-N 3.13Å; G355-L358 CarbonylContact O-C 3.49Å; G355-L358 PolarHBondContact O-N 3.44Å; L358-N360 PolarHBondContact O-N 3.31Å; L358-L367 HydrophobicContact CD2-CB 3.78Å; L358-L367 HydrophobicContact CD2-CD1 4.06Å; L358-Y372 HydrophobicContact CD1-CD1 4Å; 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 3.86Å; L358-Y372 HydrophobicContact CG-CE1 3.86Å; L358-V373 HydrophobicContact CD1-CB 4.38Å; L358-V373 HydrophobicContact CD1-CG2 4Å; L358-V373 HydrophobicContact CD2-CG2 3.75Å; L358-H376 HydrophobicContact CD1-CB 3.6Å
359A97.3Very high97Very high4 Ų444.7 Ų44.73%0.03326%0.262CS..THydrogen-bonded Turntrans-65.3-18174.100000112.4T306 T309 M310 G355 I356 V357 S361T306-A359 WeakPolarHBondContact CA-O 3.21Å; T306-A359 WeakPolarHBondContact CG2-O 3.17Å; T309-A359 HydrophobicContact CG2-CB 3.58Å; M310-A359 HydrophobicContact CE-CB 4.44Å; M310-A359 HydrophobicContact CG-CB 3.91Å; G355-A359 WeakPolarHBondContact O-CB 3.38Å; G355-A359 PolarHBondContact O-N 3.3Å; I356-A359 PolarHBondContact O-N 2.96Å; V357-A359 VanDerWaalsContact C-N 3.29Å; V357-A359 PolarHBondContact O-N 3.21Å; A359-S361 PolarHBondContact O-N 3.28Å
360N97.9Very high97Very high48 Ų4842.7 Ų42.726%0.25725%0.249SC..  trans-83.7110.7176.8-172.4-60.5000111M310 V357 L358 S362 L363 D364M310-N360 HydrophobicContact CE-CB 3.75Å; V357-N360 WeakPolarHBondContact O-CB 3.45Å; V357-N360 PolarHBondContact O-N 3.38Å; L358-N360 PolarHBondContact O-N 3.31Å; N360-S362 PolarHBondContact O-N 2.85Å; N360-S362 VanDerWaalsContact O-N 3.13Å; N360-S362 WeakPolarHBondContact OD1-CA 3.49Å; N360-S362 VanDerWaalsContact OD1-CB 3.3Å; N360-S362 WeakPolarHBondContact OD1-CB 3.23Å; N360-S362 PolarHBondContact OD1-N 2.9Å; N360-L363 HydrophobicContact CB-CB 4.18Å; N360-L363 HydrophobicContact CB-CD1 4.07Å; N360-L363 HydrophobicContact CB-CG 4.13Å; N360-L363 PolarHBondContact O-N 2.86Å; N360-L363 PolarHBondContact OD1-N 3.37Å; N360-D364 PolarHBondContact O-N 3.34Å
361S96.6Very high97.1Very high12 Ų1241.5 Ų41.58%0.08424%0.241CC..Hα-helixtrans-57-29.1-179.756.40000115.3T306 A359 I365T306-S361 WeakPolarHBondContact OG1-CB 3.02Å; T306-S361 PolarHBondContact OG1-N 3.5Å; T306-S361 PolarHBondContact OG1-OG 2.7Å; A359-S361 PolarHBondContact O-N 3.28Å; S361-I365 WeakPolarHBondContact O-CG1 3.46Å; S361-I365 PolarHBondContact O-N 2.86Å
362S96.1Very high97.2Very high85 Ų8542.4 Ų42.459%0.59425%0.245SC*.Hα-helixtrans-74.1-36.3177-58.10000112.4N360N360-S362 PolarHBondContact O-N 2.85Å; N360-S362 VanDerWaalsContact O-N 3.13Å; N360-S362 WeakPolarHBondContact OD1-CA 3.49Å; N360-S362 VanDerWaalsContact OD1-CB 3.3Å; N360-S362 WeakPolarHBondContact OD1-CB 3.23Å; N360-S362 PolarHBondContact OD1-N 2.9Å
363L97.1Very high97.3Very high82 Ų8242.7 Ų42.743%0.42924%0.242SC..Hα-helixtrans-77.9-35.6175.7-62.7179.3000111.2V357 N360 I365 V366 L367V357-L363 HydrophobicContact CG1-CD1 3.88Å; N360-L363 HydrophobicContact CB-CB 4.18Å; N360-L363 HydrophobicContact CB-CD1 4.07Å; N360-L363 HydrophobicContact CB-CG 4.13Å; N360-L363 PolarHBondContact O-N 2.86Å; N360-L363 PolarHBondContact OD1-N 3.37Å; L363-I365 PolarHBondContact O-N 3.26Å; L363-V366 VanDerWaalsContact O-CG2 3.22Å; L363-V366 WeakPolarHBondContact O-CG2 3.36Å; L363-V366 PolarHBondContact O-N 3.3Å; L363-V366 VanDerWaalsContact O-N 3.16Å; L363-L367 PolarHBondContact O-N 3.02Å
364D96.6Very high97.3Very high6 Ų639 Ų393%0.03222%0.224CC..Hα-helixtrans-60.9-32.8179.2-166.160.4000111.3F293 N360 V366 L367 H368F293-D364 HydrophobicContact CB-CB 4.4Å; F293-D364 HydrophobicContact CD2-CB 3.75Å; N360-D364 PolarHBondContact O-N 3.34Å; D364-V366 PolarHBondContact O-N 3.37Å; D364-L367 CarbonylContact O-C 3.59Å; D364-L367 PolarHBondContact O-N 3.02Å; D364-H368 WeakPolarHBondContact O-CA 3.23Å; D364-H368 WeakPolarHBondContact O-CB 3.49Å; D364-H368 PolarHBondContact O-N 3.08Å; D364-H368 IonicContact OD1-ND1 2.72Å; D364-H368 IonicContact OD2-CE1 3.03Å; D364-H368 IonicContact OD2-CG 3.85Å; D364-H368 IonicContact OD2-ND1 2.63Å; D364-H368 PolarHBondContact OD2-ND1 3.22Å
365I94.8Very high97.4Very high92 Ų9238.2 Ų38.247%0.47222%0.219SC..Hα-helixtrans-49.5-36.9175.8-69.3163.2000113.2S361 L363S361-I365 WeakPolarHBondContact O-CG1 3.46Å; S361-I365 PolarHBondContact O-N 2.86Å; L363-I365 PolarHBondContact O-N 3.26Å
366V96.8Very high97.4Very high103 Ų10339.1 Ų39.162%0.62422%0.218SC*.Hα-helixtrans-95.8-17-179.9-59.20000113.7L363 D364L363-V366 VanDerWaalsContact O-CG2 3.22Å; L363-V366 WeakPolarHBondContact O-CG2 3.36Å; L363-V366 PolarHBondContact O-N 3.3Å; L363-V366 VanDerWaalsContact O-N 3.16Å; D364-V366 PolarHBondContact O-N 3.37Å
367L97.9Very high97.3Very high11 Ų1138.1 Ų38.16%0.05821%0.211CC..Hα-helixtrans-102.9-17.5-177.8-60.8178.8000113.3V357 L358 L363 D364 T370 Y372 V373 L433V357-L367 HydrophobicContact CG1-CD1 3.84Å; L358-L367 HydrophobicContact CD2-CB 3.78Å; L358-L367 HydrophobicContact CD2-CD1 4.06Å; L363-L367 PolarHBondContact O-N 3.02Å; D364-L367 CarbonylContact O-C 3.59Å; D364-L367 PolarHBondContact O-N 3.02Å; L367-T370 WeakPolarHBondContact O-CB 3.1Å; L367-T370 WeakPolarHBondContact O-CG2 3.17Å; L367-T370 PolarHBondContact O-N 3.43Å; L367-T370 VanDerWaalsContact O-N 3.13Å; L367-T370 PolarHBondContact O-OG1 2.96Å; L367-Y372 HydrophobicContact CD1-CD1 3.95Å; L367-Y372 HydrophobicContact CD1-CE1 4.04Å; L367-Y372 HydrophobicContact CD1-CG 4.23Å; L367-Y372 HydrophobicContact CD2-CD2 4.31Å; L367-Y372 HydrophobicContact CD2-CG 4.13Å; L367-V373 WeakPolarHBondContact O-CG2 3.16Å; L367-L433 HydrophobicContact CD2-CD2 4.01Å
368H98Very high97.3Very high37 Ų3737.9 Ų37.917%0.17121%0.207CC..THydrogen-bonded Turntrans-58.2139-178.6-160.989000110.2H291 T294 D364 T370H291-H368 PolarHBondContact O-CE1 3.04Å; T294-H368 HydrophobicContact CG2-CB 3.49Å; T294-H368 VanDerWaalsContact CG2-CB 3.49Å; T294-H368 VanDerWaalsContact CG2-CG 3.46Å; T294-H368 PolarHBondContact OG1-CD2 3.48Å; T294-H368 VanDerWaalsContact OG1-CD2 3.31Å; T294-H368 PolarHBondContact OG1-NE2 3.26Å; D364-H368 WeakPolarHBondContact O-CA 3.23Å; D364-H368 WeakPolarHBondContact O-CB 3.49Å; D364-H368 PolarHBondContact O-N 3.08Å; D364-H368 IonicContact OD1-ND1 2.72Å; D364-H368 IonicContact OD2-CE1 3.03Å; D364-H368 IonicContact OD2-CG 3.85Å; D364-H368 IonicContact OD2-ND1 2.63Å; D364-H368 PolarHBondContact OD2-ND1 3.22Å; H368-T370 PolarHBondContact O-N 3.29Å
369D96.8Very high97.2Very high70 Ų7037 Ų3737%0.37420%0.202SC..THydrogen-bonded Turntrans54.818.7-177.1-71.3-31.6000115.7P437 R438D369-P437 CarbonylContact O-C 3.58Å; D369-P437 WeakPolarHBondContact O-CA 3.49Å; D369-R438 HydrophobicContact CB-CG 4.42Å; D369-R438 VanDerWaalsContact O-CG 3.31Å; D369-R438 WeakPolarHBondContact O-CG 3.29Å; D369-R438 PolarHBondContact O-N 3.17Å; D369-R438 IonicContact OD1-CZ 3.58Å; D369-R438 IonicContact OD1-NE 2.75Å; D369-R438 PolarHBondContact OD1-NE 2.97Å; D369-R438 IonicContact OD1-NH2 3.58Å; D369-R438 PolarHBondContact OD1-NH2 3.2Å
370T98.4Very high97Very high9 Ų938.2 Ų38.26%0.05521%0.209CC..BIsolated β-bridgetrans-96.6172.5170.575.50000112L367 H368 Y372 V373 M436L367-T370 WeakPolarHBondContact O-CB 3.1Å; L367-T370 WeakPolarHBondContact O-CG2 3.17Å; L367-T370 PolarHBondContact O-N 3.43Å; L367-T370 VanDerWaalsContact O-N 3.13Å; L367-T370 PolarHBondContact O-OG1 2.96Å; H368-T370 PolarHBondContact O-N 3.29Å; T370-Y372 PolarHBondContact O-N 2.89Å; T370-Y372 VanDerWaalsContact O-N 3.12Å; T370-Y372 WeakPolarHBondContact OG1-CB 3.22Å; T370-Y372 PolarHBondContact OG1-N 2.84Å; T370-Y372 VanDerWaalsContact OG1-N 3.1Å; T370-V373 PolarHBondContact O-N 3.1Å; T370-M436 CarbonylContact C-O 3.47Å; T370-M436 VanDerWaalsContact CA-O 3.25Å; T370-M436 WeakPolarHBondContact CA-O 3.49Å; T370-M436 WeakPolarHBondContact CB-O 3.15Å
371Y98.3Very high96.3Very high10 Ų1037 Ų374%0.03920%0.203CC..Hα-helixtrans-62-11.2169.7-88.1-100.6000114.2L41 V374 A375 Q428 L431 M436 P437L41-Y371 WeakPolarHBondContact CD1-OH 3.46Å; Y371-V374 HydrophobicContact CD1-CB 4.45Å; Y371-V374 PolarHBondContact O-N 3.4Å; Y371-A375 WeakPolarHBondContact O-CB 3.42Å; Y371-A375 PolarHBondContact O-N 3.08Å; Y371-Q428 CarbonylContact C-O 3.29Å; Y371-Q428 WeakPolarHBondContact CB-O 3.36Å; Y371-Q428 HydrophobicContact CD1-CB 4.16Å; Y371-Q428 HydrophobicContact CD1-CG 3.94Å; Y371-L431 HydrophobicContact CD1-CD1 4.33Å; Y371-L431 HydrophobicContact CG-CB 4.27Å; Y371-M436 HydrophobicContact CD2-CB 4.1Å; Y371-M436 HydrophobicContact CD2-CE 4.16Å; Y371-M436 HydrophobicContact CD2-CG 3.67Å; Y371-M436 HydrophobicContact CD2-SD 3.79Å; Y371-M436 HydrophobicContact CE2-CE 3.49Å; Y371-M436 VanDerWaalsContact CE2-CE 3.49Å; Y371-M436 HydrophobicContact CE2-CG 3.88Å; Y371-M436 HydrophobicContact CE2-SD 3.75Å; Y371-M436 HydrophobicContact CG-SD 4.38Å; Y371-M436 PolarHBondContact N-O 3.16Å; Y371-P437 WeakPolarHBondContact CE2-O 3.39Å
372Y98.6Very high95.3Very high19 Ų1937.8 Ų37.88%0.07521%0.208CC..Hα-helixtrans-66.5-44.6175.6-166.9-84.6000110.6V357 L358 L367 T370 V374 A375 H376 H429 G432 L433V357-Y372 HydrophobicContact CB-CE1 4.44Å; V357-Y372 HydrophobicContact CG1-CE1 4.37Å; L358-Y372 HydrophobicContact CD1-CD1 4Å; 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 3.86Å; L358-Y372 HydrophobicContact CG-CE1 3.86Å; L367-Y372 HydrophobicContact CD1-CD1 3.95Å; L367-Y372 HydrophobicContact CD1-CE1 4.04Å; L367-Y372 HydrophobicContact CD1-CG 4.23Å; L367-Y372 HydrophobicContact CD2-CD2 4.31Å; L367-Y372 HydrophobicContact CD2-CG 4.13Å; T370-Y372 PolarHBondContact O-N 2.89Å; T370-Y372 VanDerWaalsContact O-N 3.12Å; T370-Y372 WeakPolarHBondContact OG1-CB 3.22Å; T370-Y372 PolarHBondContact OG1-N 2.84Å; T370-Y372 VanDerWaalsContact OG1-N 3.1Å; Y372-V374 VanDerWaalsContact C-N 3.32Å; Y372-A375 PolarHBondContact O-N 3.3Å; Y372-H376 WeakPolarHBondContact O-CB 3.49Å; Y372-H376 PolarHBondContact O-N 3.16Å; Y372-H429 HydrophobicContact CD2-CB 4.29Å; Y372-H429 HydrophobicContact CE2-CB 4.38Å; Y372-H429 AromaticContact CE2-CD2 3.92Å; Y372-G432 VanDerWaalsContact N-CA 3.32Å; Y372-L433 HydrophobicContact CD2-CD2 4.01Å; Y372-L433 HydrophobicContact CD2-CG 3.89Å; Y372-L433 HydrophobicContact CE2-CD1 4.45Å; Y372-L433 HydrophobicContact CE2-CD2 3.97Å; Y372-L433 HydrophobicContact CE2-CG 4.06Å
373V98Very high94.6Very high32 Ų3233.7 Ų33.719%0.19418%0.18CC..Hα-helixtrans-65.4-38.9175.8-179.70000110.6L358 L367 T370 F377L358-V373 HydrophobicContact CD1-CB 4.38Å; L358-V373 HydrophobicContact CD1-CG2 4Å; L358-V373 HydrophobicContact CD2-CG2 3.75Å; L367-V373 WeakPolarHBondContact O-CG2 3.16Å; T370-V373 PolarHBondContact O-N 3.1Å; V373-F377 VanDerWaalsContact O-CB 3.29Å; V373-F377 WeakPolarHBondContact O-CB 3.47Å; V373-F377 PolarHBondContact O-N 3.29Å
374V97.9Very high94.1Very high29 Ų2929.8 Ų29.818%0.17616%0.159CC..Hα-helixtrans-60.9-48.1175.3-177.90000110.3Y371 Y372 F377 H378 R438Y371-V374 HydrophobicContact CD1-CB 4.45Å; Y371-V374 PolarHBondContact O-N 3.4Å; Y372-V374 VanDerWaalsContact C-N 3.32Å; V374-F377 PolarHBondContact O-N 2.72Å; V374-H378 PolarHBondContact O-N 3.1Å; V374-H378 PolarHBondContact O-ND1 2.92Å; V374-R438 HydrophobicContact CG2-CB 3.82Å
375A98.1Very high94Very high0 Ų029.5 Ų29.50%016%0.158CC..Hα-helixtrans-62.1-51.3178.800000111.6Y371 Y372 F377 H378 Y379 Q428 H429Y371-A375 WeakPolarHBondContact O-CB 3.42Å; Y371-A375 PolarHBondContact O-N 3.08Å; Y372-A375 PolarHBondContact O-N 3.3Å; A375-F377 VanDerWaalsContact C-N 3.31Å; A375-F377 PolarHBondContact O-N 3.33Å; A375-H378 PolarHBondContact O-N 2.94Å; A375-H378 VanDerWaalsContact O-N 3.16Å; A375-Y379 WeakPolarHBondContact O-CD2 3.27Å; A375-Y379 PolarHBondContact O-N 3.26Å; A375-Q428 HydrophobicContact CB-CB 3.74Å; A375-H429 WeakPolarHBondContact CB-NE2 3Å
376H97.8Very high94Very high36 Ų3626 Ų2617%0.16714%0.14CC..Hα-helixtrans-50.7-52.3175.2165.862.4000111.4G351 T354 G355 L358 Y372 H378 Y379 V380G351-H376 PolarHBondContact O-CE1 2.84Å; G351-H376 PolarHBondContact O-ND1 2.93Å; T354-H376 PolarHBondContact OG1-ND1 3.29Å; T354-H376 VanDerWaalsContact OG1-ND1 3.13Å; G355-H376 WeakPolarHBondContact CA-CE1 3.41Å; G355-H376 VanDerWaalsContact CA-ND1 3.34Å; G355-H376 WeakPolarHBondContact CA-ND1 3.35Å; G355-H376 PolarHBondContact N-CE1 2.89Å; G355-H376 PolarHBondContact N-ND1 3.29Å; L358-H376 HydrophobicContact CD1-CB 3.6Å; Y372-H376 WeakPolarHBondContact O-CB 3.49Å; Y372-H376 PolarHBondContact O-N 3.16Å; H376-H378 VanDerWaalsContact C-N 3.34Å; H376-H378 PolarHBondContact O-N 3.47Å; H376-Y379 PolarHBondContact O-N 3.04Å; H376-Y379 VanDerWaalsContact O-N 3.13Å; H376-V380 PolarHBondContact O-N 3.32Å
377F94.9Very high94Very high50 Ų5021.1 Ų21.122%0.21911%0.111CC..Hα-helixtrans-65.8-36.1-177.4-169.8-114.9000112.2V243 V373 V374 A375 V380 L381V243-F377 HydrophobicContact CB-CE2 4.25Å; V243-F377 HydrophobicContact CG1-CE2 3.49Å; V243-F377 VanDerWaalsContact CG1-CE2 3.49Å; V243-F377 HydrophobicContact CG1-CZ 3.95Å; V373-F377 VanDerWaalsContact O-CB 3.29Å; V373-F377 WeakPolarHBondContact O-CB 3.47Å; V373-F377 PolarHBondContact O-N 3.29Å; V374-F377 PolarHBondContact O-N 2.72Å; A375-F377 VanDerWaalsContact C-N 3.31Å; A375-F377 PolarHBondContact O-N 3.33Å; F377-V380 PolarHBondContact O-N 2.97Å; F377-L381 HydrophobicContact CD1-CB 4.36Å; F377-L381 HydrophobicContact CD1-CD2 4.27Å; F377-L381 HydrophobicContact CD2-CB 4.46Å; F377-L381 HydrophobicContact CE1-CB 4.08Å; F377-L381 HydrophobicContact CE1-CD2 3.39Å; F377-L381 HydrophobicContact CE1-CG 4.31Å; F377-L381 HydrophobicContact CE2-CB 4.15Å; F377-L381 HydrophobicContact CE2-CD2 4.49Å; F377-L381 HydrophobicContact CZ-CB 3.98Å; F377-L381 HydrophobicContact CZ-CD2 3.53Å; F377-L381 HydrophobicContact CZ-CG 4.21Å; F377-L381 WeakPolarHBondContact O-CA 3.42Å; F377-L381 WeakPolarHBondContact O-CB 3.48Å; F377-L381 PolarHBondContact O-N 3.33Å
378H97.2Very high94Very high42 Ų4220.6 Ų20.619%0.19411%0.108CC..Iπ-helixtrans-73-27.8174.3-73.282.9000112.8V374 A375 H376 S382 M383 F425V374-H378 PolarHBondContact O-N 3.1Å; V374-H378 PolarHBondContact O-ND1 2.92Å; A375-H378 PolarHBondContact O-N 2.94Å; A375-H378 VanDerWaalsContact O-N 3.16Å; H376-H378 VanDerWaalsContact C-N 3.34Å; H376-H378 PolarHBondContact O-N 3.47Å; H378-S382 CarbonylContact O-C 3.59Å; H378-S382 VanDerWaalsContact O-CA 3.28Å; H378-S382 WeakPolarHBondContact O-CA 3.47Å; H378-S382 WeakPolarHBondContact O-CB 3.43Å; H378-S382 PolarHBondContact O-N 3.41Å; H378-M383 PolarHBondContact O-N 3.4Å; H378-F425 HydrophobicContact CB-CB 4.43Å; H378-F425 HydrophobicContact CB-CD1 3.37Å; H378-F425 HydrophobicContact CB-CD2 4Å; H378-F425 HydrophobicContact CB-CE1 3.47Å; H378-F425 VanDerWaalsContact CB-CE1 3.47Å; H378-F425 HydrophobicContact CB-CE2 4.07Å; H378-F425 HydrophobicContact CB-CG 3.67Å; H378-F425 HydrophobicContact CB-CZ 3.82Å; H378-F425 AromaticContact CD2-CE1 3.17Å; H378-F425 WeakPolarHBondContact CD2-CE1 3.24Å; H378-F425 AromaticContact CD2-CZ 3.3Å; H378-F425 WeakPolarHBondContact CD2-CZ 3.11Å; H378-F425 AromaticContact CG-CD1 3.63Å; H378-F425 AromaticContact CG-CE1 3.25Å; H378-F425 AromaticContact CG-CZ 3.73Å; H378-F425 AromaticContact ND1-CE1 3.97Å; H378-F425 AromaticContact NE2-CE1 3.86Å
379Y96Very high94Very high1 Ų119.1 Ų19.10%0.00410%0.101CC..Iπ-helixtrans-66.7-40169.5-91.2-94.8000112.8L347 V350 A375 H376 M383 G384 N422 F425 F426 H429L347-Y379 HydrophobicContact CB-CD1 4.35Å; L347-Y379 HydrophobicContact CD2-CD1 4.4Å; L347-Y379 HydrophobicContact CD2-CE1 3.77Å; L347-Y379 WeakPolarHBondContact O-CD1 3.37Å; V350-Y379 HydrophobicContact CB-CD1 4.09Å; V350-Y379 HydrophobicContact CB-CE1 4.23Å; V350-Y379 HydrophobicContact CG1-CD1 3.93Å; V350-Y379 HydrophobicContact CG1-CE1 3.86Å; A375-Y379 WeakPolarHBondContact O-CD2 3.27Å; A375-Y379 PolarHBondContact O-N 3.26Å; H376-Y379 PolarHBondContact O-N 3.04Å; H376-Y379 VanDerWaalsContact O-N 3.13Å; Y379-M383 HydrophobicContact CD1-CE 3.43Å; Y379-M383 VanDerWaalsContact CD1-CE 3.43Å; Y379-M383 HydrophobicContact CD1-SD 3.94Å; Y379-M383 HydrophobicContact CD2-CE 3.25Å; Y379-M383 HydrophobicContact CE1-CE 3.48Å; Y379-M383 VanDerWaalsContact CE1-CE 3.48Å; Y379-M383 HydrophobicContact CE1-SD 3.77Å; Y379-M383 HydrophobicContact CE2-CE 3.31Å; Y379-M383 HydrophobicContact CG-CE 3.32Å; Y379-M383 HydrophobicContact CG-SD 4.39Å; Y379-M383 VanDerWaalsContact CZ-CE 3.4Å; Y379-M383 WeakPolarHBondContact O-CB 3.17Å; Y379-G384 PolarHBondContact O-N 2.96Å; Y379-N422 PolarHBondContact OH-OD1 2.81Å; Y379-F425 HydrophobicContact CD2-CB 4.01Å; Y379-F425 HydrophobicContact CE2-CB 3.65Å; Y379-F426 WeakPolarHBondContact OH-CB 3.39Å; Y379-H429 AromaticContact CD2-CE1 3.52Å; Y379-H429 AromaticContact CE2-CE1 3.51Å
380V92.7Very high94.1Very high29 Ų2917.2 Ų17.218%0.1769%0.09CC..Iπ-helixtrans-82.1-45.6-179.5176.90000111.9F348 H376 F377 G384F348-V380 HydrophobicContact CD2-CG1 4.43Å; F348-V380 HydrophobicContact CE2-CG1 3.87Å; H376-V380 PolarHBondContact O-N 3.32Å; F377-V380 PolarHBondContact O-N 2.97Å; V380-G384 WeakPolarHBondContact O-CA 3.46Å; V380-G384 PolarHBondContact O-N 3.23Å
381L83.1Confident94.1Very high22 Ų2216.8 Ų16.812%0.1159%0.088CC..Iπ-helixtrans-83.8-64.9179.8-173.871.7000111.6I66 L246 F377 G384 A385I66-L381 HydrophobicContact CG1-CD2 4.1Å; L246-L381 HydrophobicContact CB-CD1 3.68Å; L246-L381 HydrophobicContact CD1-CD1 3.5Å; L246-L381 VanDerWaalsContact CD1-CD1 3.5Å; L246-L381 HydrophobicContact CG-CD1 4.13Å; F377-L381 HydrophobicContact CD1-CB 4.36Å; F377-L381 HydrophobicContact CD1-CD2 4.27Å; F377-L381 HydrophobicContact CD2-CB 4.46Å; F377-L381 HydrophobicContact CE1-CB 4.08Å; F377-L381 HydrophobicContact CE1-CD2 3.39Å; F377-L381 HydrophobicContact CE1-CG 4.31Å; F377-L381 HydrophobicContact CE2-CB 4.15Å; F377-L381 HydrophobicContact CE2-CD2 4.49Å; F377-L381 HydrophobicContact CZ-CB 3.98Å; F377-L381 HydrophobicContact CZ-CD2 3.53Å; F377-L381 HydrophobicContact CZ-CG 4.21Å; F377-L381 WeakPolarHBondContact O-CA 3.42Å; F377-L381 WeakPolarHBondContact O-CB 3.48Å; F377-L381 PolarHBondContact O-N 3.33Å; L381-G384 PolarHBondContact O-N 3.45Å; L381-A385 HydrophobicContact CD1-CB 4.22Å; L381-A385 WeakPolarHBondContact O-CA 3.36Å; L381-A385 WeakPolarHBondContact O-CB 3.25Å; L381-A385 PolarHBondContact O-N 3.16Å
382S75.4Confident94Very high28 Ų2816.3 Ų16.320%0.1969%0.086CC..Iπ-helixtrans-62.1-51.2-176.2-170.60000111.2H378 V386H378-S382 CarbonylContact O-C 3.59Å; H378-S382 VanDerWaalsContact O-CA 3.28Å; H378-S382 WeakPolarHBondContact O-CA 3.47Å; H378-S382 WeakPolarHBondContact O-CB 3.43Å; H378-S382 PolarHBondContact O-N 3.41Å; S382-V386 WeakPolarHBondContact O-CB 3.48Å; S382-V386 VanDerWaalsContact O-CG2 3.27Å; S382-V386 WeakPolarHBondContact O-CG2 3.43Å; S382-V386 PolarHBondContact O-N 3Å; S382-V386 VanDerWaalsContact O-N 3.15Å
383M82.7Confident94Very high0 Ų017.3 Ų17.30%09%0.091CC..Iπ-helixtrans-82-16.5-178.9-74.4176.6-89.100114.2L347 H378 Y379 F387 V421 F425L347-M383 HydrophobicContact CB-CB 3.81Å; L347-M383 HydrophobicContact CB-CG 4.39Å; L347-M383 HydrophobicContact CB-SD 4.04Å; L347-M383 HydrophobicContact CD1-CB 4.05Å; L347-M383 HydrophobicContact CD1-CG 3.89Å; L347-M383 HydrophobicContact CD1-SD 3.59Å; L347-M383 VanDerWaalsContact CD1-SD 3.59Å; L347-M383 HydrophobicContact CD2-SD 3.8Å; L347-M383 HydrophobicContact CG-SD 3.99Å; H378-M383 PolarHBondContact O-N 3.4Å; Y379-M383 HydrophobicContact CD1-CE 3.43Å; Y379-M383 VanDerWaalsContact CD1-CE 3.43Å; Y379-M383 HydrophobicContact CD1-SD 3.94Å; Y379-M383 HydrophobicContact CD2-CE 3.25Å; Y379-M383 HydrophobicContact CE1-CE 3.48Å; Y379-M383 VanDerWaalsContact CE1-CE 3.48Å; Y379-M383 HydrophobicContact CE1-SD 3.77Å; Y379-M383 HydrophobicContact CE2-CE 3.31Å; Y379-M383 HydrophobicContact CG-CE 3.32Å; Y379-M383 HydrophobicContact CG-SD 4.39Å; Y379-M383 VanDerWaalsContact CZ-CE 3.4Å; Y379-M383 WeakPolarHBondContact O-CB 3.17Å; M383-F387 HydrophobicContact CB-CD2 4.34Å; M383-F387 HydrophobicContact CB-CE2 4.42Å; M383-F387 HydrophobicContact CG-CD2 4.37Å; M383-F387 HydrophobicContact CG-CE2 3.98Å; M383-F387 WeakPolarHBondContact O-CB 3.21Å; M383-F387 WeakPolarHBondContact O-CD2 3.26Å; M383-F387 WeakPolarHBondContact O-CG 3.32Å; M383-V421 HydrophobicContact CG-CB 4.1Å; M383-V421 HydrophobicContact CG-CG2 3.76Å; M383-V421 HydrophobicContact SD-CB 4.03Å; M383-V421 HydrophobicContact SD-CG2 3.53Å; M383-V421 VanDerWaalsContact SD-CG2 3.53Å; M383-F425 HydrophobicContact CE-CB 3.85Å; M383-F425 HydrophobicContact CE-CD2 3.72Å; M383-F425 HydrophobicContact CE-CG 4.16Å
384G86.9Confident94Very high0 Ų016.2 Ų16.20%08%0.084CC..Iπ-helixtrans-82.9-67.5168.300000111.9F344 Y379 V380 L381 A388F344-G384 WeakPolarHBondContact CD2-O 3.49Å; F344-G384 VanDerWaalsContact CE2-CA 3.48Å; F344-G384 WeakPolarHBondContact CE2-O 3.05Å; Y379-G384 PolarHBondContact O-N 2.96Å; V380-G384 WeakPolarHBondContact O-CA 3.46Å; V380-G384 PolarHBondContact O-N 3.23Å; L381-G384 PolarHBondContact O-N 3.45Å; G384-A388 WeakPolarHBondContact O-CB 3.49Å; G384-A388 PolarHBondContact O-N 3.41Å
385A93Very high93.9Very high0 Ų015.1 Ų15.10%08%0.077CC..Iπ-helixtrans-59.2-51.7-175.800000112.8V70 M74 L381 F387 A388 I389V70-A385 HydrophobicContact CG1-CB 3.84Å; V70-A385 HydrophobicContact CG2-CB 4.37Å; M74-A385 HydrophobicContact CE-CB 3.3Å; L381-A385 HydrophobicContact CD1-CB 4.22Å; L381-A385 WeakPolarHBondContact O-CA 3.36Å; L381-A385 WeakPolarHBondContact O-CB 3.25Å; L381-A385 PolarHBondContact O-N 3.16Å; A385-F387 PolarHBondContact O-N 3.39Å; A385-A388 PolarHBondContact O-N 2.99Å; A385-I389 WeakPolarHBondContact O-CB 3.46Å; A385-I389 VanDerWaalsContact O-CG1 3.26Å; A385-I389 WeakPolarHBondContact O-CG1 3.47Å; A385-I389 PolarHBondContact O-N 3.3Å
386V95.1Very high93.9Very high17 Ų1715.1 Ų15.110%0.1038%0.077CC..Iπ-helixtrans-68.3-38.9-175-174.70000111M69 S382 A388 I389 M390M69-V386 HydrophobicContact CE-CG2 4.23Å; S382-V386 WeakPolarHBondContact O-CB 3.48Å; S382-V386 VanDerWaalsContact O-CG2 3.27Å; S382-V386 WeakPolarHBondContact O-CG2 3.43Å; S382-V386 PolarHBondContact O-N 3Å; S382-V386 VanDerWaalsContact O-N 3.15Å; V386-A388 VanDerWaalsContact C-N 3.35Å; V386-A388 PolarHBondContact O-N 2.95Å; V386-I389 WeakPolarHBondContact O-CB 3.39Å; V386-I389 PolarHBondContact O-N 2.92Å; V386-M390 HydrophobicContact CG1-CE 3.98Å; V386-M390 HydrophobicContact CG1-CG 4.13Å; V386-M390 WeakPolarHBondContact O-CB 3.25Å; V386-M390 VanDerWaalsContact O-CG 3.22Å; V386-M390 WeakPolarHBondContact O-CG 3.44Å; V386-M390 PolarHBondContact O-N 3.41Å
387F97.6Very high93.8Very high2 Ų213.8 Ų13.81%0.0097%0.07CC..Hα-helixtrans-67.1-38.2177.8-82.2-121.7000111.9W340 F344 L347 M383 A385 M390 G391 F414 M417 F418 V421W340-F387 HydrophobicContact CE3-CB 4.03Å; 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 4.33Å; W340-F387 AromaticContact CE3-CE1 3.86Å; W340-F387 HydrophobicContact CE3-CE1 3.86Å; W340-F387 AromaticContact CE3-CG 3.72Å; W340-F387 HydrophobicContact CE3-CG 3.72Å; W340-F387 HydrophobicContact CE3-CZ 4.45Å; W340-F387 HydrophobicContact CZ3-CB 4.42Å; W340-F387 AromaticContact CZ3-CD1 3.74Å; W340-F387 HydrophobicContact CZ3-CD1 3.74Å; W340-F387 AromaticContact CZ3-CD2 3.93Å; W340-F387 HydrophobicContact CZ3-CD2 3.93Å; W340-F387 AromaticContact CZ3-CE1 3.79Å; W340-F387 HydrophobicContact CZ3-CE1 3.79Å; W340-F387 AromaticContact CZ3-CE2 3.99Å; W340-F387 HydrophobicContact CZ3-CE2 3.99Å; W340-F387 AromaticContact CZ3-CG 3.8Å; W340-F387 HydrophobicContact CZ3-CG 3.8Å; W340-F387 AromaticContact CZ3-CZ 3.92Å; W340-F387 HydrophobicContact CZ3-CZ 3.92Å; F344-F387 HydrophobicContact CB-CB 4.09Å; F344-F387 HydrophobicContact CD2-CB 4.41Å; L347-F387 HydrophobicContact CD1-CD1 4.25Å; L347-F387 HydrophobicContact CD1-CE1 3.68Å; L347-F387 HydrophobicContact CD1-CE2 4.22Å; L347-F387 HydrophobicContact CD1-CZ 3.66Å; M383-F387 HydrophobicContact CB-CD2 4.34Å; M383-F387 HydrophobicContact CB-CE2 4.42Å; M383-F387 HydrophobicContact CG-CD2 4.37Å; M383-F387 HydrophobicContact CG-CE2 3.98Å; M383-F387 WeakPolarHBondContact O-CB 3.21Å; M383-F387 WeakPolarHBondContact O-CD2 3.26Å; M383-F387 WeakPolarHBondContact O-CG 3.32Å; A385-F387 PolarHBondContact O-N 3.39Å; F387-M390 PolarHBondContact O-N 2.79Å; F387-G391 PolarHBondContact O-N 2.87Å; F387-F414 HydrophobicContact CE1-CE2 4.02Å; F387-M417 HydrophobicContact CE2-CG 4.28Å; F387-M417 HydrophobicContact CZ-CG 4.36Å; F387-F418 AromaticContact CE1-CD2 3.95Å; F387-F418 HydrophobicContact CE1-CD2 3.95Å; F387-F418 HydrophobicContact CZ-CD2 4.27Å; F387-V421 HydrophobicContact CE2-CG1 4.49Å; F387-V421 HydrophobicContact CE2-CG2 3.97Å; F387-V421 HydrophobicContact CZ-CG2 3.91Å
388A98Very high93.9Very high0 Ų012.5 Ų12.50%07%0.067CC..Hα-helixtrans-65.7-40.917400000111.4G250 M253 I254 F344 G384 A385 V386 G392G250-A388 VanDerWaalsContact CA-CB 3.47Å; M253-A388 HydrophobicContact CE-CB 3.96Å; I254-A388 HydrophobicContact CD1-CB 4.3Å; I254-A388 HydrophobicContact CG1-CB 4.1Å; F344-A388 HydrophobicContact CD2-CB 4.07Å; F344-A388 HydrophobicContact CE2-CB 4.12Å; G384-A388 WeakPolarHBondContact O-CB 3.49Å; G384-A388 PolarHBondContact O-N 3.41Å; A385-A388 PolarHBondContact O-N 2.99Å; V386-A388 VanDerWaalsContact C-N 3.35Å; V386-A388 PolarHBondContact O-N 2.95Å; A388-G392 PolarHBondContact O-N 2.58Å
389I98.1Very high93.8Very high6 Ų610.5 Ų10.53%0.0316%0.058CC..Hα-helixtrans-59-47.3172.3-72.9167.1000110.9I73 M74 F78 A385 V386 G392 F393I73-I389 HydrophobicContact CB-CD1 4.17Å; I73-I389 HydrophobicContact CG2-CB 4.37Å; I73-I389 HydrophobicContact CG2-CD1 3.91Å; I73-I389 HydrophobicContact CG2-CG1 3.81Å; I73-I389 HydrophobicContact CG2-CG2 3.69Å; M74-I389 HydrophobicContact CE-CD1 4.11Å; M74-I389 HydrophobicContact CE-CG1 4.28Å; M74-I389 HydrophobicContact CG-CD1 3.95Å; M74-I389 HydrophobicContact CG-CG1 3.64Å; M74-I389 HydrophobicContact SD-CG1 4.27Å; F78-I389 HydrophobicContact CE2-CG2 4.44Å; A385-I389 WeakPolarHBondContact O-CB 3.46Å; A385-I389 VanDerWaalsContact O-CG1 3.26Å; A385-I389 WeakPolarHBondContact O-CG1 3.47Å; A385-I389 PolarHBondContact O-N 3.3Å; V386-I389 WeakPolarHBondContact O-CB 3.39Å; V386-I389 PolarHBondContact O-N 2.92Å; I389-G392 PolarHBondContact O-N 3.22Å; I389-F393 WeakPolarHBondContact O-CB 3.07Å; I389-F393 PolarHBondContact O-N 3.46Å
390M98Very high93.8Very high30 Ų3011.8 Ų11.815%0.1486%0.064CC..Hα-helixtrans-69.6-41.9-177.8-66.7-58.5149.500112W340 V386 F387 F393 I394 M468W340-M390 HydrophobicContact CD2-CB 3.68Å; W340-M390 HydrophobicContact CE3-CB 3.58Å; W340-M390 HydrophobicContact CE3-CG 4.34Å; W340-M390 HydrophobicContact CG-CB 4.4Å; W340-M390 HydrophobicContact CH2-CB 3.83Å; W340-M390 HydrophobicContact CH2-CG 3.88Å; W340-M390 HydrophobicContact CZ2-CB 3.95Å; W340-M390 HydrophobicContact CZ2-CG 4.32Å; W340-M390 HydrophobicContact CZ3-CB 3.65Å; W340-M390 HydrophobicContact CZ3-CG 3.9Å; V386-M390 HydrophobicContact CG1-CE 3.98Å; V386-M390 HydrophobicContact CG1-CG 4.13Å; V386-M390 WeakPolarHBondContact O-CB 3.25Å; V386-M390 VanDerWaalsContact O-CG 3.22Å; V386-M390 WeakPolarHBondContact O-CG 3.44Å; V386-M390 PolarHBondContact O-N 3.41Å; F387-M390 PolarHBondContact O-N 2.79Å; M390-F393 PolarHBondContact O-N 3.06Å; M390-I394 WeakPolarHBondContact O-CB 3.19Å; M390-I394 WeakPolarHBondContact O-CG1 3.36Å; M390-I394 PolarHBondContact O-N 2.91Å; M390-M468 HydrophobicContact CE-CE 4.49Å; M390-M468 HydrophobicContact SD-CE 3.19Å; M390-M468 WeakPolarHBondContact SD-CE 3.4Å
391G98Very high94Very high0 Ų011.5 Ų11.50%06%0.062CC..Hα-helixtrans-61-46173.300000111.7F387 I394 H395F387-G391 PolarHBondContact O-N 2.87Å; G391-I394 PolarHBondContact O-N 3Å; G391-H395 VanDerWaalsContact O-CB 3.3Å; G391-H395 WeakPolarHBondContact O-CB 3.43Å; G391-H395 PolarHBondContact O-N 3.13Å
392G97.8Very high94.5Very high0 Ų010.8 Ų10.80%06%0.06CC..Hα-helixtrans-63.4-45.2175.600000112.1A388 I389 I394 H395 W396A388-G392 PolarHBondContact O-N 2.58Å; I389-G392 PolarHBondContact O-N 3.22Å; G392-I394 PolarHBondContact O-N 3.14Å; G392-H395 PolarHBondContact O-N 2.82Å; G392-W396 VanDerWaalsContact CA-CE3 3.42Å; G392-W396 VanDerWaalsContact CA-CZ3 3.42Å; G392-W396 PolarHBondContact O-N 3.22Å
393F98.1Very high95.5Very high40 Ų4011.8 Ų11.818%0.1756%0.06CC..Hα-helixtrans-59.9-49.6178.3-179.1-99.1000110.2F78 I389 M390 H395 W396 F397 L405 M468 I472F78-F393 HydrophobicContact CZ-CB 4.28Å; I389-F393 WeakPolarHBondContact O-CB 3.07Å; I389-F393 PolarHBondContact O-N 3.46Å; M390-F393 PolarHBondContact O-N 3.06Å; F393-H395 VanDerWaalsContact C-N 3.31Å; F393-H395 PolarHBondContact O-N 2.94Å; F393-W396 PolarHBondContact O-N 3.41Å; F393-F397 AromaticContact CE1-CD2 3.72Å; F393-F397 HydrophobicContact CE1-CD2 3.72Å; F393-F397 HydrophobicContact CE1-CE2 4.26Å; F393-F397 HydrophobicContact CE1-CG 4.45Å; F393-F397 AromaticContact CE2-CD2 3.85Å; F393-F397 HydrophobicContact CE2-CD2 3.85Å; F393-F397 HydrophobicContact CE2-CE2 4.44Å; F393-F397 AromaticContact CZ-CD2 3.32Å; F393-F397 HydrophobicContact CZ-CD2 3.32Å; F393-F397 AromaticContact CZ-CE2 3.7Å; F393-F397 HydrophobicContact CZ-CE2 3.7Å; F393-F397 HydrophobicContact CZ-CG 4.4Å; F393-F397 WeakPolarHBondContact O-CA 3.44Å; F393-F397 WeakPolarHBondContact O-CB 3.33Å; F393-F397 PolarHBondContact O-N 2.71Å; F393-L405 HydrophobicContact CE1-CD1 4.29Å; F393-M468 HydrophobicContact CD1-CE 3.91Å; F393-M468 HydrophobicContact CD1-SD 4.24Å; F393-M468 HydrophobicContact CE1-CE 4.23Å; F393-M468 HydrophobicContact CE1-SD 3.94Å; F393-I472 HydrophobicContact CE1-CD1 4.07Å; F393-I472 HydrophobicContact CE1-CG1 4.02Å; F393-I472 HydrophobicContact CZ-CD1 3.7Å; F393-I472 HydrophobicContact CZ-CG1 3.86Å
394I97.6Very high96.1Very high9 Ų913.9 Ų13.95%0.0467%0.073CC..Hα-helixtrans-63.6-37.9179.4-70.4163.8000111.8A336 A337 W340 M390 G391 G392 L405A336-I394 HydrophobicContact CB-CD1 4.45Å; A336-I394 HydrophobicContact CB-CG2 4.14Å; A337-I394 HydrophobicContact CB-CG2 4.22Å; W340-I394 HydrophobicContact CG-CD1 4.43Å; M390-I394 WeakPolarHBondContact O-CB 3.19Å; M390-I394 WeakPolarHBondContact O-CG1 3.36Å; M390-I394 PolarHBondContact O-N 2.91Å; G391-I394 PolarHBondContact O-N 3Å; G392-I394 PolarHBondContact O-N 3.14Å; I394-L405 HydrophobicContact CB-CD1 4.41Å; I394-L405 HydrophobicContact CG1-CD1 3.91Å
395H96.3Very high96.6Very high6 Ų614.4 Ų14.43%0.0288%0.076CC..Hα-helixtrans-68.7-48179177.854.1000112.4I257 Y260 Y261 A337 G391 G392 F393 P398 W494I257-H395 HydrophobicContact CD1-CB 4.41Å; I257-H395 HydrophobicContact CG1-CB 4.06Å; Y260-H395 AromaticContact CD1-CE1 3.65Å; Y260-H395 AromaticContact CD2-CE1 3.98Å; Y260-H395 AromaticContact CE1-CE1 3.98Å; Y260-H395 AromaticContact CG-CE1 3.66Å; Y261-H395 AromaticContact CE2-ND1 3.73Å; A337-H395 HydrophobicContact CB-CB 4.22Å; G391-H395 VanDerWaalsContact O-CB 3.3Å; G391-H395 WeakPolarHBondContact O-CB 3.43Å; G391-H395 PolarHBondContact O-N 3.13Å; G392-H395 PolarHBondContact O-N 2.82Å; F393-H395 VanDerWaalsContact C-N 3.31Å; F393-H395 PolarHBondContact O-N 2.94Å; H395-P398 WeakPolarHBondContact O-CD 3.34Å; H395-W494 AromaticContact CE1-CZ2 3.91Å; H395-W494 AromaticContact NE2-CZ2 3.92Å; H395-W494 WeakPolarHBondContact O-CH2 3.39Å
396W97.1Very high96.7Very high0 Ų016.8 Ų16.80%09%0.088CC..Hα-helixtrans-95.8-1.3-176.4-67.1-67.8000114.6F78 L82 M86 M253 H256 G392 F393 P398 L399 F400 W494F78-W396 AromaticContact CD1-CE3 3.91Å; F78-W396 HydrophobicContact CD1-CE3 3.91Å; F78-W396 HydrophobicContact CD1-CZ3 4.4Å; F78-W396 AromaticContact CE1-CE3 3.67Å; F78-W396 HydrophobicContact CE1-CE3 3.67Å; F78-W396 HydrophobicContact CE1-CZ3 4.35Å; L82-W396 HydrophobicContact CD1-CD2 3.76Å; L82-W396 HydrophobicContact CD1-CE3 3.91Å; L82-W396 HydrophobicContact CD1-CG 4.36Å; L82-W396 HydrophobicContact CD1-CH2 4.16Å; L82-W396 HydrophobicContact CD1-CZ2 3.94Å; L82-W396 HydrophobicContact CD1-CZ3 4.13Å; L82-W396 HydrophobicContact CD2-CD2 4.32Å; L82-W396 HydrophobicContact CD2-CG 4.12Å; M86-W396 HydrophobicContact CE-CZ2 3.89Å; M253-W396 HydrophobicContact CB-CH2 4.02Å; M253-W396 HydrophobicContact CB-CZ3 3.91Å; M253-W396 HydrophobicContact CG-CH2 3.95Å; M253-W396 HydrophobicContact CG-CZ3 3.66Å; M253-W396 HydrophobicContact SD-CZ3 4.01Å; H256-W396 HydrophobicContact CB-CH2 4.08Å; H256-W396 HydrophobicContact CB-CZ2 3.94Å; G392-W396 VanDerWaalsContact CA-CE3 3.42Å; G392-W396 VanDerWaalsContact CA-CZ3 3.42Å; G392-W396 PolarHBondContact O-N 3.22Å; F393-W396 PolarHBondContact O-N 3.41Å; W396-P398 VanDerWaalsContact C-CD 3.42Å; W396-P398 VanDerWaalsContact C-N 3.29Å; W396-L399 HydrophobicContact CB-CB 4.42Å; W396-L399 WeakPolarHBondContact O-CA 3.36Å; W396-L399 VanDerWaalsContact O-CB 3.23Å; W396-L399 WeakPolarHBondContact O-CB 3.36Å; W396-L399 PolarHBondContact O-N 3.35Å; W396-F400 HydrophobicContact CB-CD2 4.37Å; W396-F400 HydrophobicContact CB-CE1 3.87Å; W396-F400 HydrophobicContact CB-CE2 3.69Å; W396-F400 HydrophobicContact CB-CZ 3.4Å; W396-F400 HydrophobicContact CG-CZ 4.24Å; W396-F400 WeakPolarHBondContact O-CD2 3.2Å; W396-F400 WeakPolarHBondContact O-CG 3.32Å; W396-F400 PolarHBondContact O-N 3.17Å; W396-W494 AromaticContact CD1-CH2 4Å; W396-W494 AromaticContact CD1-CZ2 3.47Å; W396-W494 VanDerWaalsContact CD1-CZ2 3.47Å; W396-W494 HydrophobicContact CG-CZ2 4.44Å; W396-W494 AromaticContact NE1-CZ2 3.92Å
397F97.2Very high96.7Very high7 Ų719.6 Ų19.63%0.03110%0.101CC..Hα-helixtrans-53.1-41.7175.1-178-95.9000113F393 L399 F400 S401 Y403 L405 A475 F476F393-F397 AromaticContact CE1-CD2 3.72Å; F393-F397 HydrophobicContact CE1-CD2 3.72Å; F393-F397 HydrophobicContact CE1-CE2 4.26Å; F393-F397 HydrophobicContact CE1-CG 4.45Å; F393-F397 AromaticContact CE2-CD2 3.85Å; F393-F397 HydrophobicContact CE2-CD2 3.85Å; F393-F397 HydrophobicContact CE2-CE2 4.44Å; F393-F397 AromaticContact CZ-CD2 3.32Å; F393-F397 HydrophobicContact CZ-CD2 3.32Å; F393-F397 AromaticContact CZ-CE2 3.7Å; F393-F397 HydrophobicContact CZ-CE2 3.7Å; F393-F397 HydrophobicContact CZ-CG 4.4Å; F393-F397 WeakPolarHBondContact O-CA 3.44Å; F393-F397 WeakPolarHBondContact O-CB 3.33Å; F393-F397 PolarHBondContact O-N 2.71Å; F397-L399 VanDerWaalsContact C-N 3.32Å; F397-L399 PolarHBondContact O-N 3.11Å; F397-F400 PolarHBondContact O-N 3.32Å; F397-S401 WeakPolarHBondContact CE1-OG 3.26Å; F397-S401 WeakPolarHBondContact O-CB 3.38Å; F397-S401 PolarHBondContact O-N 3.41Å; F397-S401 PolarHBondContact O-OG 3.32Å; F397-Y403 VanDerWaalsContact CD1-O 3.29Å; F397-Y403 WeakPolarHBondContact CD1-O 3.37Å; F397-L405 HydrophobicContact CB-CD1 4.14Å; F397-L405 HydrophobicContact CB-CG 4.38Å; F397-L405 HydrophobicContact CD1-CD1 4.23Å; F397-L405 HydrophobicContact CD1-CD2 3.85Å; F397-L405 HydrophobicContact CD1-CG 3.57Å; F397-L405 HydrophobicContact CD2-CD2 4.47Å; F397-L405 HydrophobicContact CE1-CD2 3.67Å; F397-L405 HydrophobicContact CE1-CG 3.91Å; F397-L405 HydrophobicContact CE2-CD2 4.32Å; F397-L405 HydrophobicContact CG-CD1 4.09Å; F397-L405 HydrophobicContact CG-CD2 4.23Å; F397-L405 HydrophobicContact CG-CG 3.94Å; F397-L405 HydrophobicContact CZ-CD2 3.92Å; F397-A475 HydrophobicContact CE1-CB 3.75Å; F397-A475 HydrophobicContact CZ-CB 3.87Å; F397-F476 HydrophobicContact CE2-CE2 4.32Å; F397-F476 HydrophobicContact CZ-CE2 4.09Å; F397-F476 HydrophobicContact CZ-CZ 4.43Å
398P95.6Very high96.7Very high23 Ų2323.7 Ų23.715%0.14913%0.126CC..Hα-helixtrans-59.9-39.4172.1-2436.4000113.5H395 W396 G402 Y403 V482 W494 C498H395-P398 WeakPolarHBondContact O-CD 3.34Å; W396-P398 VanDerWaalsContact C-CD 3.42Å; W396-P398 VanDerWaalsContact C-N 3.29Å; P398-G402 VanDerWaalsContact O-CA 3.25Å; P398-G402 WeakPolarHBondContact O-CA 3.45Å; P398-G402 PolarHBondContact O-N 3.44Å; P398-Y403 VanDerWaalsContact CA-O 3.26Å; P398-Y403 WeakPolarHBondContact CA-O 3.46Å; P398-V482 HydrophobicContact CB-CG2 3.59Å; P398-W494 HydrophobicContact CB-CZ3 4.42Å; P398-C498 WeakPolarHBondContact O-CB 3.47Å
399L95.5Very high96.7Very high0 Ų028 Ų280%014%0.143CC..Hα-helixtrans-63.2-43.6177.4-174.265.1000111.5L82 L85 W396 F397 E493 W494 P499 P500L82-L399 HydrophobicContact CD2-CD2 3.76Å; L85-L399 HydrophobicContact CD1-CD2 4.19Å; W396-L399 HydrophobicContact CB-CB 4.42Å; W396-L399 WeakPolarHBondContact O-CA 3.36Å; W396-L399 VanDerWaalsContact O-CB 3.23Å; W396-L399 WeakPolarHBondContact O-CB 3.36Å; W396-L399 PolarHBondContact O-N 3.35Å; F397-L399 VanDerWaalsContact C-N 3.32Å; F397-L399 PolarHBondContact O-N 3.11Å; L399-E493 WeakPolarHBondContact CD1-O 3.41Å; L399-E493 HydrophobicContact CD2-CB 4.13Å; L399-E493 HydrophobicContact CD2-CG 4.13Å; L399-W494 HydrophobicContact CB-CE3 4.21Å; L399-W494 HydrophobicContact CB-CH2 3.76Å; L399-W494 HydrophobicContact CB-CZ3 3.55Å; L399-W494 HydrophobicContact CD1-CE3 3.97Å; L399-W494 HydrophobicContact CD1-CZ3 4.18Å; L399-W494 HydrophobicContact CG-CZ3 4.38Å; L399-P499 WeakPolarHBondContact O-CA 3.3Å; L399-P500 HydrophobicContact CD1-CG 4.45Å; L399-P500 WeakPolarHBondContact O-CD 3.39Å
400F96.4Very high96.7Very high29 Ų2927.8 Ų27.813%0.12714%0.142CC..Hα-helixtrans-75.7-37.4-175.7-53.9-29000112.8L20 F78 W81 L82 W396 F397L20-F400 HydrophobicContact CD1-CD2 4.16Å; L20-F400 HydrophobicContact CD1-CE2 4.12Å; F78-F400 HydrophobicContact CD1-CE2 4.22Å; F78-F400 AromaticContact CD1-CZ 3.81Å; F78-F400 HydrophobicContact CD1-CZ 3.81Å; F78-F400 AromaticContact CE1-CE2 3.7Å; F78-F400 HydrophobicContact CE1-CE2 3.7Å; F78-F400 AromaticContact CE1-CZ 3.73Å; F78-F400 HydrophobicContact CE1-CZ 3.73Å; F78-F400 HydrophobicContact CZ-CE2 4.49Å; W81-F400 HydrophobicContact CB-CD1 4.47Å; W81-F400 HydrophobicContact CB-CE1 3.78Å; W81-F400 HydrophobicContact CB-CZ 4.38Å; W81-F400 AromaticContact CD2-CD1 3.58Å; W81-F400 HydrophobicContact CD2-CD1 3.58Å; W81-F400 AromaticContact CD2-CE1 3.81Å; W81-F400 HydrophobicContact CD2-CE1 3.81Å; W81-F400 AromaticContact CE2-CD1 3.92Å; W81-F400 AromaticContact CE3-CD1 3.69Å; W81-F400 HydrophobicContact CE3-CD1 3.69Å; W81-F400 HydrophobicContact CE3-CE1 4.02Å; W81-F400 AromaticContact CG-CD1 3.95Å; W81-F400 HydrophobicContact CG-CD1 3.95Å; W81-F400 AromaticContact CG-CE1 3.72Å; W81-F400 HydrophobicContact CG-CE1 3.72Å; W81-F400 HydrophobicContact CG-CZ 4.44Å; W81-F400 HydrophobicContact CH2-CD1 4.4Å; W81-F400 HydrophobicContact CZ2-CB 4.42Å; W81-F400 HydrophobicContact CZ2-CD1 4.32Å; W81-F400 HydrophobicContact CZ3-CD1 4.1Å; L82-F400 HydrophobicContact CD2-CE1 4.17Å; W396-F400 HydrophobicContact CB-CD2 4.37Å; W396-F400 HydrophobicContact CB-CE1 3.87Å; W396-F400 HydrophobicContact CB-CE2 3.69Å; W396-F400 HydrophobicContact CB-CZ 3.4Å; W396-F400 HydrophobicContact CG-CZ 4.24Å; W396-F400 WeakPolarHBondContact O-CD2 3.2Å; W396-F400 WeakPolarHBondContact O-CG 3.32Å; W396-F400 PolarHBondContact O-N 3.17Å; F397-F400 PolarHBondContact O-N 3.32Å
401S96.1Very high96.7Very high22 Ų2230.2 Ų30.215%0.15415%0.151CC..Hα-helixtrans-110.5-21.5-168.670.30000114.8F397 Y403F397-S401 WeakPolarHBondContact CE1-OG 3.26Å; F397-S401 WeakPolarHBondContact O-CB 3.38Å; F397-S401 PolarHBondContact O-N 3.41Å; F397-S401 PolarHBondContact O-OG 3.32Å; S401-Y403 PolarHBondContact O-N 3.22Å; S401-Y403 PolarHBondContact OG-N 3.15Å; S401-Y403 VanDerWaalsContact OG-N 3.08Å; S401-Y403 PolarHBondContact OG-O 3.18Å
402G95Very high96.7Very high7 Ų733.8 Ų33.87%0.07217%0.17CC..SBendtrans75.12.4-167.400000115P398 V482 C498P398-G402 VanDerWaalsContact O-CA 3.25Å; P398-G402 WeakPolarHBondContact O-CA 3.45Å; P398-G402 PolarHBondContact O-N 3.44Å; G402-V482 PolarHBondContact O-N 2.99Å; G402-C498 VanDerWaalsContact CA-O 3.29Å; G402-C498 WeakPolarHBondContact CA-O 3.5Å
403Y95.9Very high96.7Very high50 Ų5033.8 Ų33.820%0.19617%0.17CC..BIsolated β-bridgetrans-115.6159.2-179.5-57.8-58.4000112.7F397 P398 S401 F476 K479 R480 K481F397-Y403 VanDerWaalsContact CD1-O 3.29Å; F397-Y403 WeakPolarHBondContact CD1-O 3.37Å; P398-Y403 VanDerWaalsContact CA-O 3.26Å; P398-Y403 WeakPolarHBondContact CA-O 3.46Å; S401-Y403 PolarHBondContact O-N 3.22Å; S401-Y403 PolarHBondContact OG-N 3.15Å; S401-Y403 VanDerWaalsContact OG-N 3.08Å; S401-Y403 PolarHBondContact OG-O 3.18Å; Y403-F476 AromaticContact CD2-CD1 3.63Å; Y403-F476 HydrophobicContact CD2-CD1 3.63Å; Y403-F476 AromaticContact CD2-CE1 3.69Å; Y403-F476 HydrophobicContact CD2-CE1 3.69Å; Y403-F476 AromaticContact CE2-CD1 3.62Å; Y403-F476 HydrophobicContact CE2-CD1 3.62Å; Y403-F476 AromaticContact CE2-CE1 3.82Å; Y403-F476 HydrophobicContact CE2-CE1 3.82Å; Y403-K479 HydrophobicContact CD1-CB 4.25Å; Y403-K479 HydrophobicContact CE1-CB 3.65Å; Y403-K479 HydrophobicContact CE1-CG 4.11Å; Y403-R480 CarbonylContact C-O 3.47Å; Y403-R480 WeakPolarHBondContact CA-O 3.3Å; Y403-K481 HydrophobicContact CD1-CG 4.44Å; Y403-K481 HydrophobicContact CE1-CG 4.3Å
404T95.4Very high96.8Very high43 Ų4333 Ų3326%0.26417%0.166SC..  trans-107.2137.7178.361.50000112.3R480 V482T404-R480 PolarHBondContact N-O 3.04Å; T404-R480 PolarHBondContact O-NE 3.06Å; T404-R480 PolarHBondContact O-NH2 3.13Å; T404-R480 WeakPolarHBondContact OG1-CB 3.34Å; T404-R480 PolarHBondContact OG1-O 3.33Å; T404-V482 HydrophobicContact CG2-CG2 4Å
405L96Very high96.8Very high12 Ų1236 Ų366%0.06319%0.185CC..  trans-74141.5168.8-62.4172.7000109.8F393 I394 F397 Q407 M471 A475F393-L405 HydrophobicContact CE1-CD1 4.29Å; I394-L405 HydrophobicContact CB-CD1 4.41Å; I394-L405 HydrophobicContact CG1-CD1 3.91Å; F397-L405 HydrophobicContact CB-CD1 4.14Å; F397-L405 HydrophobicContact CB-CG 4.38Å; F397-L405 HydrophobicContact CD1-CD1 4.23Å; F397-L405 HydrophobicContact CD1-CD2 3.85Å; F397-L405 HydrophobicContact CD1-CG 3.57Å; F397-L405 HydrophobicContact CD2-CD2 4.47Å; F397-L405 HydrophobicContact CE1-CD2 3.67Å; F397-L405 HydrophobicContact CE1-CG 3.91Å; F397-L405 HydrophobicContact CE2-CD2 4.32Å; F397-L405 HydrophobicContact CG-CD1 4.09Å; F397-L405 HydrophobicContact CG-CD2 4.23Å; F397-L405 HydrophobicContact CG-CG 3.94Å; F397-L405 HydrophobicContact CZ-CD2 3.92Å; L405-Q407 PolarHBondContact O-N 3.32Å; L405-M471 HydrophobicContact CB-CE 4.37Å; L405-M471 HydrophobicContact CD1-CE 4.07Å; L405-M471 HydrophobicContact CD2-CB 4.43Å; L405-M471 HydrophobicContact CD2-CE 4.38Å; L405-A475 HydrophobicContact CD2-CB 3.95Å
406D96.3Very high96.9Very high49 Ų4937.9 Ų37.926%0.26220%0.195SC..  trans-64126.2171.1-177.6-85000110.4T408 Y409 A410D406-T408 VanDerWaalsContact C-N 3.3Å; D406-T408 PolarHBondContact O-N 3.12Å; D406-T408 VanDerWaalsContact OD1-CA 3.31Å; D406-T408 WeakPolarHBondContact OD1-CA 3.2Å; D406-T408 WeakPolarHBondContact OD1-CB 3.35Å; D406-T408 PolarHBondContact OD1-N 3.04Å; D406-Y409 HydrophobicContact CB-CD2 3.73Å; D406-Y409 HydrophobicContact CB-CE2 4.44Å; D406-Y409 HydrophobicContact CB-CG 4.46Å; D406-Y409 PolarHBondContact OD1-N 2.86Å; D406-A410 WeakPolarHBondContact O-CB 3.35Å; D406-A410 PolarHBondContact O-N 3.31Å
407Q94.9Very high96.9Very high77 Ų7738.6 Ų38.636%0.3620%0.198SC..Hα-helixtrans-70.2-26.2-175.4-74-64.5-45.600113.1A336 L405 K411A336-Q407 VanDerWaalsContact N-OE1 3.1Å; L405-Q407 PolarHBondContact O-N 3.32Å; Q407-K411 WeakPolarHBondContact O-CB 3.48Å; Q407-K411 WeakPolarHBondContact O-CG 3.46Å; Q407-K411 PolarHBondContact O-N 3.37Å; Q407-K411 VanDerWaalsContact O-N 3.08Å
408T97.1Very high97Very high88 Ų8840.9 Ų40.954%0.5421%0.208SC..Hα-helixtrans-69.9-51.4177.5-51.70000109.4D406 A410 K411 I412D406-T408 VanDerWaalsContact C-N 3.3Å; D406-T408 PolarHBondContact O-N 3.12Å; D406-T408 VanDerWaalsContact OD1-CA 3.31Å; D406-T408 WeakPolarHBondContact OD1-CA 3.2Å; D406-T408 WeakPolarHBondContact OD1-CB 3.35Å; D406-T408 PolarHBondContact OD1-N 3.04Å; T408-A410 VanDerWaalsContact C-N 3.32Å; T408-A410 PolarHBondContact O-N 3.33Å; T408-K411 PolarHBondContact O-N 3.2Å; T408-I412 HydrophobicContact CG2-CD1 4.07Å; T408-I412 WeakPolarHBondContact O-CG1 3.29Å; T408-I412 PolarHBondContact O-N 2.91Å
409Y97.9Very high97.1Very high91 Ų9143.8 Ų43.836%0.35722%0.222SC..Hα-helixtrans-62.3-39.4176.2-63.4-45.5000112.1D406 K411 I412 H413 F470D406-Y409 HydrophobicContact CB-CD2 3.73Å; D406-Y409 HydrophobicContact CB-CE2 4.44Å; D406-Y409 HydrophobicContact CB-CG 4.46Å; D406-Y409 PolarHBondContact OD1-N 2.86Å; Y409-K411 VanDerWaalsContact C-N 3.33Å; Y409-K411 PolarHBondContact O-N 3.36Å; Y409-I412 HydrophobicContact CD1-CD1 4.48Å; Y409-I412 PolarHBondContact O-N 3.47Å; Y409-H413 WeakPolarHBondContact O-CB 3.44Å; Y409-H413 PolarHBondContact O-N 2.82Å; Y409-F470 HydrophobicContact CD2-CE1 4.2Å; Y409-F470 HydrophobicContact CE1-CE1 4.47Å; Y409-F470 HydrophobicContact CE2-CE1 4.02Å
410A97.9Very high97.2Very high0 Ų043.8 Ų43.80%022%0.222CC..Hα-helixtrans-63.8-35.5177.900000113.5A336 D406 T408 F414 M471A336-A410 HydrophobicContact CB-CB 3.48Å; A336-A410 VanDerWaalsContact CB-CB 3.48Å; D406-A410 WeakPolarHBondContact O-CB 3.35Å; D406-A410 PolarHBondContact O-N 3.31Å; T408-A410 VanDerWaalsContact C-N 3.32Å; T408-A410 PolarHBondContact O-N 3.33Å; A410-F414 PolarHBondContact O-N 2.8Å; A410-F414 VanDerWaalsContact O-N 3.13Å; A410-M471 VanDerWaalsContact CA-CE 3.49Å; A410-M471 HydrophobicContact CB-CE 3.62Å
411K98.5Very high97.3Very high81 Ų8142.7 Ų42.735%0.35222%0.217SC..Hα-helixtrans-71.4-42.4173.9-72.9173.9-179.3-173.70111.8W334 A336 L339 Q407 T408 Y409 H413 F414 T415W334-K411 WeakPolarHBondContact O-CE 3.31Å; W334-K411 PolarHBondContact O-NZ 2.9Å; A336-K411 HydrophobicContact CB-CG 4.27Å; L339-K411 HydrophobicContact CD1-CB 4.41Å; L339-K411 HydrophobicContact CD1-CG 3.9Å; Q407-K411 WeakPolarHBondContact O-CB 3.48Å; Q407-K411 WeakPolarHBondContact O-CG 3.46Å; Q407-K411 PolarHBondContact O-N 3.37Å; Q407-K411 VanDerWaalsContact O-N 3.08Å; T408-K411 PolarHBondContact O-N 3.2Å; Y409-K411 VanDerWaalsContact C-N 3.33Å; Y409-K411 PolarHBondContact O-N 3.36Å; K411-H413 VanDerWaalsContact C-N 3.3Å; K411-H413 PolarHBondContact O-N 2.83Å; K411-F414 WeakPolarHBondContact O-CB 3.31Å; K411-F414 PolarHBondContact O-N 3.19Å; K411-T415 PolarHBondContact O-N 2.93Å; K411-T415 PolarHBondContact O-OG1 3.35Å
412I98.4Very high97.3Very high75 Ų7543 Ų4339%0.38522%0.218SC..Hα-helixtrans-59.8-44.9174.8-67.1167000110T408 Y409 F414 T415 I416 L467T408-I412 HydrophobicContact CG2-CD1 4.07Å; T408-I412 WeakPolarHBondContact O-CG1 3.29Å; T408-I412 PolarHBondContact O-N 2.91Å; Y409-I412 HydrophobicContact CD1-CD1 4.48Å; Y409-I412 PolarHBondContact O-N 3.47Å; I412-F414 PolarHBondContact O-N 3.33Å; I412-T415 PolarHBondContact O-N 3.13Å; I412-T415 VanDerWaalsContact O-N 3.15Å; I412-I416 HydrophobicContact CG2-CD1 3.64Å; I412-I416 HydrophobicContact CG2-CG1 4.21Å; I412-I416 WeakPolarHBondContact O-CG1 3.5Å; I412-I416 PolarHBondContact O-N 3.09Å; I412-L467 HydrophobicContact CB-CD2 4.32Å; I412-L467 HydrophobicContact CG2-CD2 3.77Å
413H98.6Very high97.5Very high1 Ų145.9 Ų45.91%0.00523%0.231CC..Hα-helixtrans-57-47.2176.4176-118.1000112.2W340 Y409 K411 T415 M417 A464 L467 M471W340-H413 AromaticContact CH2-CE1 3.92Å; W340-H413 AromaticContact CZ2-CE1 3.49Å; W340-H413 VanDerWaalsContact CZ2-CE1 3.49Å; W340-H413 WeakPolarHBondContact CZ2-CE1 3.37Å; W340-H413 AromaticContact CZ2-ND1 3.45Å; W340-H413 WeakPolarHBondContact CZ2-ND1 3.34Å; Y409-H413 WeakPolarHBondContact O-CB 3.44Å; Y409-H413 PolarHBondContact O-N 2.82Å; K411-H413 VanDerWaalsContact C-N 3.3Å; K411-H413 PolarHBondContact O-N 2.83Å; H413-T415 PolarHBondContact O-N 2.84Å; H413-M417 WeakPolarHBondContact O-CB 3.42Å; H413-M417 PolarHBondContact O-N 3.45Å; H413-A464 PolarHBondContact CD2-O 3.36Å; H413-A464 PolarHBondContact NE2-O 3.4Å; H413-L467 HydrophobicContact CB-CD2 3.8Å; H413-L467 HydrophobicContact CB-CG 4.2Å; H413-M471 HydrophobicContact CB-SD 3.64Å
414F98.4Very high97.6Very high24 Ų2443.7 Ų43.711%0.10522%0.223CC..Hα-helixtrans-56.4-50.7172.6169.6-98.9000112.1L339 W340 F387 A410 K411 I412 I416 M417 F418L339-F414 VanDerWaalsContact C-CE2 3.48Å; L339-F414 HydrophobicContact CB-CD1 3.71Å; L339-F414 HydrophobicContact CB-CD2 4.09Å; L339-F414 HydrophobicContact CB-CE1 3.8Å; L339-F414 HydrophobicContact CB-CE2 4.17Å; L339-F414 HydrophobicContact CB-CG 3.85Å; L339-F414 HydrophobicContact CB-CZ 4.03Å; L339-F414 HydrophobicContact CD1-CD1 3.91Å; L339-F414 HydrophobicContact CD1-CE1 4.39Å; L339-F414 HydrophobicContact CD1-CG 4.47Å; L339-F414 HydrophobicContact CG-CD1 4.36Å; L339-F414 HydrophobicContact CG-CE1 4.49Å; L339-F414 WeakPolarHBondContact O-CE2 3.4Å; L339-F414 WeakPolarHBondContact O-CZ 3.35Å; W340-F414 AromaticContact CD2-CD2 3.69Å; W340-F414 HydrophobicContact CD2-CD2 3.69Å; W340-F414 AromaticContact CE2-CD2 3.82Å; W340-F414 HydrophobicContact CE3-CD2 4.03Å; W340-F414 AromaticContact CG-CD2 3.97Å; W340-F414 HydrophobicContact CG-CD2 3.97Å; W340-F414 HydrophobicContact CZ2-CB 4.02Å; W340-F414 HydrophobicContact CZ2-CD2 4.29Å; W340-F414 HydrophobicContact CZ3-CD2 4.49Å; F387-F414 HydrophobicContact CE1-CE2 4.02Å; A410-F414 PolarHBondContact O-N 2.8Å; A410-F414 VanDerWaalsContact O-N 3.13Å; K411-F414 WeakPolarHBondContact O-CB 3.31Å; K411-F414 PolarHBondContact O-N 3.19Å; I412-F414 PolarHBondContact O-N 3.33Å; F414-I416 PolarHBondContact O-N 3.44Å; F414-M417 PolarHBondContact O-N 3.46Å; F414-F418 HydrophobicContact CE1-CB 4.42Å; F414-F418 HydrophobicContact CE2-CB 4.36Å; F414-F418 HydrophobicContact CE2-CD2 4.18Å; F414-F418 HydrophobicContact CZ-CB 4.2Å; F414-F418 AromaticContact CZ-CD2 3.89Å; F414-F418 HydrophobicContact CZ-CD2 3.89Å; F414-F418 HydrophobicContact CZ-CG 4.15Å; F414-F418 WeakPolarHBondContact O-CB 3.09Å; F414-F418 PolarHBondContact O-N 3.22Å
415T98.5Very high97.7Very high70 Ų7042.6 Ų42.643%0.42921%0.214SC..Hα-helixtrans-61.6-45.8-176.1-59.80000112.1K411 I412 H413 F418 I419K411-T415 PolarHBondContact O-N 2.93Å; K411-T415 PolarHBondContact O-OG1 3.35Å; I412-T415 PolarHBondContact O-N 3.13Å; I412-T415 VanDerWaalsContact O-N 3.15Å; H413-T415 PolarHBondContact O-N 2.84Å; T415-F418 PolarHBondContact O-N 3.38Å; T415-I419 HydrophobicContact CG2-CD1 3.9Å; T415-I419 WeakPolarHBondContact O-CG1 3.31Å; T415-I419 PolarHBondContact O-N 2.96Å
416I98.5Very high97.8Very high47 Ų4746.8 Ų46.824%0.24123%0.232CC..Hα-helixtrans-63.6-47.5178.8-63.7173.4000110.1I412 F414 I419 G420 I460 T463 A464 L467I412-I416 HydrophobicContact CG2-CD1 3.64Å; I412-I416 HydrophobicContact CG2-CG1 4.21Å; I412-I416 WeakPolarHBondContact O-CG1 3.5Å; I412-I416 PolarHBondContact O-N 3.09Å; F414-I416 PolarHBondContact O-N 3.44Å; I416-I419 PolarHBondContact O-N 3.13Å; I416-G420 PolarHBondContact O-N 3.42Å; I416-I460 HydrophobicContact CG2-CG2 3.87Å; I416-T463 WeakPolarHBondContact CG2-OG1 3.38Å; I416-A464 HydrophobicContact CB-CB 4.22Å; I416-A464 HydrophobicContact CG2-CB 3.84Å; I416-L467 HydrophobicContact CD1-CD2 4.1Å
417M97.9Very high97.9Very high15 Ų1544.8 Ų44.87%0.07422%0.222CC..Hα-helixtrans-61.4-48.4178.8-174.364.979.400110.9W340 F387 H413 F414 I419 G420 V421 A464 V465W340-M417 HydrophobicContact CH2-CB 3.69Å; W340-M417 HydrophobicContact CH2-CG 3.73Å; W340-M417 HydrophobicContact CZ2-CB 4.44Å; W340-M417 HydrophobicContact CZ3-CB 4.47Å; W340-M417 HydrophobicContact CZ3-CG 4.17Å; F387-M417 HydrophobicContact CE2-CG 4.28Å; F387-M417 HydrophobicContact CZ-CG 4.36Å; H413-M417 WeakPolarHBondContact O-CB 3.42Å; H413-M417 PolarHBondContact O-N 3.45Å; F414-M417 PolarHBondContact O-N 3.46Å; M417-I419 VanDerWaalsContact C-N 3.33Å; M417-I419 PolarHBondContact O-N 2.63Å; M417-G420 PolarHBondContact O-N 3.35Å; M417-V421 HydrophobicContact CG-CG1 4.08Å; M417-V421 WeakPolarHBondContact O-CG1 3.48Å; M417-V421 VanDerWaalsContact O-CG2 3.32Å; M417-V421 WeakPolarHBondContact O-CG2 3.44Å; M417-V421 PolarHBondContact O-N 3.48Å; M417-V421 HydrophobicContact SD-CG1 3.68Å; M417-A464 HydrophobicContact CB-CB 3.83Å; M417-A464 HydrophobicContact CE-CB 3.72Å; M417-A464 HydrophobicContact SD-CB 4.18Å; M417-V465 HydrophobicContact CE-CG2 4.16Å
418F98.1Very high98.1Very high54 Ų5441.3 Ų41.324%0.23721%0.206CC..Hα-helixtrans-58-44-178.5-174.8-91.5000112.1F346 L347 F387 F414 T415 N422F346-F418 HydrophobicContact CD1-CE2 4.26Å; F346-F418 AromaticContact CD1-CZ 4Å; F346-F418 HydrophobicContact CD1-CZ 4Å; F346-F418 HydrophobicContact CE1-CZ 4.21Å; L347-F418 HydrophobicContact CD1-CD2 3.75Å; L347-F418 HydrophobicContact CD1-CE2 3.57Å; L347-F418 HydrophobicContact CD2-CE2 4.02Å; L347-F418 HydrophobicContact CD2-CZ 4.32Å; L347-F418 HydrophobicContact CG-CE2 3.84Å; F387-F418 AromaticContact CE1-CD2 3.95Å; F387-F418 HydrophobicContact CE1-CD2 3.95Å; F387-F418 HydrophobicContact CZ-CD2 4.27Å; F414-F418 HydrophobicContact CE1-CB 4.42Å; F414-F418 HydrophobicContact CE2-CB 4.36Å; F414-F418 HydrophobicContact CE2-CD2 4.18Å; F414-F418 HydrophobicContact CZ-CB 4.2Å; F414-F418 AromaticContact CZ-CD2 3.89Å; F414-F418 HydrophobicContact CZ-CD2 3.89Å; F414-F418 HydrophobicContact CZ-CG 4.15Å; F414-F418 WeakPolarHBondContact O-CB 3.09Å; F414-F418 PolarHBondContact O-N 3.22Å; T415-F418 PolarHBondContact O-N 3.38Å; F418-N422 PolarHBondContact O-N 2.94Å; F418-N422 PolarHBondContact O-ND2 2.96Å
419I98.3Very high98.1Very high84 Ų8437.8 Ų37.843%0.43118%0.183SC..Hα-helixtrans-66.7-47.8175.6-67.6169.7000110.5T415 I416 M417 V421 N422 L423T415-I419 HydrophobicContact CG2-CD1 3.9Å; T415-I419 WeakPolarHBondContact O-CG1 3.31Å; T415-I419 PolarHBondContact O-N 2.96Å; I416-I419 PolarHBondContact O-N 3.13Å; M417-I419 VanDerWaalsContact C-N 3.33Å; M417-I419 PolarHBondContact O-N 2.63Å; I419-V421 PolarHBondContact O-N 3.45Å; I419-N422 PolarHBondContact O-N 2.89Å; I419-L423 HydrophobicContact CG2-CD1 3.74Å; I419-L423 HydrophobicContact CG2-CG 4.3Å; I419-L423 WeakPolarHBondContact O-CB 3.26Å; I419-L423 WeakPolarHBondContact O-CG 3.44Å; I419-L423 PolarHBondContact O-N 2.72Å
420G98Very high98.2Very high0 Ų037.3 Ų37.30%018%0.183CC..Hα-helixtrans-58.8-49.2-177.700000113.3I416 M417 N422 L423 T424 G457 S461I416-G420 PolarHBondContact O-N 3.42Å; M417-G420 PolarHBondContact O-N 3.35Å; G420-N422 PolarHBondContact O-N 3.11Å; G420-L423 PolarHBondContact O-N 3.18Å; G420-T424 WeakPolarHBondContact O-CB 3.41Å; G420-T424 PolarHBondContact O-N 3.26Å; G420-T424 PolarHBondContact O-OG1 3.23Å; G420-G457 CarbonylContact C-O 3.59Å; G420-G457 WeakPolarHBondContact CA-O 3.38Å; G420-G457 CarbonylContact O-C 3.51Å; G420-G457 WeakPolarHBondContact O-CA 3.36Å; G420-S461 WeakPolarHBondContact CA-OG 3.3Å
421V97.1Very high98.2Very high6 Ų637.3 Ų37.34%0.03618%0.183CC..Hα-helixtrans-67.4-37.2-178.3-610000112.3M383 F387 M417 I419 T424 F425 S461M383-V421 HydrophobicContact CG-CB 4.1Å; M383-V421 HydrophobicContact CG-CG2 3.76Å; M383-V421 HydrophobicContact SD-CB 4.03Å; M383-V421 HydrophobicContact SD-CG2 3.53Å; M383-V421 VanDerWaalsContact SD-CG2 3.53Å; F387-V421 HydrophobicContact CE2-CG1 4.49Å; F387-V421 HydrophobicContact CE2-CG2 3.97Å; F387-V421 HydrophobicContact CZ-CG2 3.91Å; M417-V421 HydrophobicContact CG-CG1 4.08Å; M417-V421 WeakPolarHBondContact O-CG1 3.48Å; M417-V421 VanDerWaalsContact O-CG2 3.32Å; M417-V421 WeakPolarHBondContact O-CG2 3.44Å; M417-V421 PolarHBondContact O-N 3.48Å; M417-V421 HydrophobicContact SD-CG1 3.68Å; I419-V421 PolarHBondContact O-N 3.45Å; V421-T424 WeakPolarHBondContact O-CB 3.27Å; V421-T424 PolarHBondContact O-N 3.49Å; V421-F425 HydrophobicContact CB-CD2 4.27Å; V421-F425 HydrophobicContact CB-CE2 4.41Å; V421-F425 WeakPolarHBondContact O-CD2 3.35Å; V421-F425 PolarHBondContact O-N 2.72Å; V421-S461 PolarHBondContact N-OG 3.23Å
422N97.8Very high98.1Very high30 Ų3033.5 Ų33.516%0.1617%0.166CC..Hα-helixtrans-69.5-42.5176.5-80.8-79.2000111.1L347 Y379 F418 I419 G420 T424 F426 P427L347-N422 WeakPolarHBondContact CD2-ND2 3.5Å; L347-N422 VanDerWaalsContact CD2-OD1 3.23Å; L347-N422 WeakPolarHBondContact CD2-OD1 3.4Å; Y379-N422 PolarHBondContact OH-OD1 2.81Å; F418-N422 PolarHBondContact O-N 2.94Å; F418-N422 PolarHBondContact O-ND2 2.96Å; I419-N422 PolarHBondContact O-N 2.89Å; G420-N422 PolarHBondContact O-N 3.11Å; N422-T424 PolarHBondContact O-N 2.89Å; N422-F426 WeakPolarHBondContact O-CA 3.16Å; N422-F426 WeakPolarHBondContact O-CB 3.02Å; N422-F426 PolarHBondContact O-N 3.32Å; N422-P427 WeakPolarHBondContact O-CD 3.07Å
423L97.8Very high98.1Very high66 Ų6635.1 Ų35.135%0.34618%0.175SC..Hα-helixtrans-62.9-28.9172.6-73177.3000112.2I419 G420 P427 L453 S454 I460I419-L423 HydrophobicContact CG2-CD1 3.74Å; I419-L423 HydrophobicContact CG2-CG 4.3Å; I419-L423 WeakPolarHBondContact O-CB 3.26Å; I419-L423 WeakPolarHBondContact O-CG 3.44Å; I419-L423 PolarHBondContact O-N 2.72Å; G420-L423 PolarHBondContact O-N 3.18Å; L423-P427 WeakPolarHBondContact O-CD 3.44Å; L423-P427 WeakPolarHBondContact O-CG 3.28Å; L423-L453 CarbonylContact O-C 3.58Å; L423-S454 WeakPolarHBondContact O-CA 3.44Å; L423-I460 HydrophobicContact CD1-CD1 3.73Å
424T98Very high98Very high5 Ų537.9 Ų37.93%0.03120%0.195CC..Hα-helixtrans-72.1-57.1175.6-51.80000111.6G420 V421 N422 S454 G457 S458G420-T424 WeakPolarHBondContact O-CB 3.41Å; G420-T424 PolarHBondContact O-N 3.26Å; G420-T424 PolarHBondContact O-OG1 3.23Å; V421-T424 WeakPolarHBondContact O-CB 3.27Å; V421-T424 PolarHBondContact O-N 3.49Å; N422-T424 PolarHBondContact O-N 2.89Å; T424-S454 WeakPolarHBondContact CA-O 3.41Å; T424-S454 VanDerWaalsContact O-CB 3.25Å; T424-S454 WeakPolarHBondContact O-CB 3.43Å; T424-S454 PolarHBondContact O-OG 3.25Å; T424-G457 WeakPolarHBondContact OG1-CA 3.46Å; T424-G457 PolarHBondContact OG1-O 3Å; T424-S458 WeakPolarHBondContact OG1-CA 3.2Å; T424-S458 PolarHBondContact OG1-N 3.26Å
425F98.3Very high98Very high19 Ų1938.6 Ų38.68%0.08321%0.209CC..Hα-helixtrans-99.4-23.9-164.2-59.6-63.4000113.9H378 Y379 M383 V421 Q428H378-F425 HydrophobicContact CB-CB 4.43Å; H378-F425 HydrophobicContact CB-CD1 3.37Å; H378-F425 HydrophobicContact CB-CD2 4Å; H378-F425 HydrophobicContact CB-CE1 3.47Å; H378-F425 VanDerWaalsContact CB-CE1 3.47Å; H378-F425 HydrophobicContact CB-CE2 4.07Å; H378-F425 HydrophobicContact CB-CG 3.67Å; H378-F425 HydrophobicContact CB-CZ 3.82Å; H378-F425 AromaticContact CD2-CE1 3.17Å; H378-F425 WeakPolarHBondContact CD2-CE1 3.24Å; H378-F425 AromaticContact CD2-CZ 3.3Å; H378-F425 WeakPolarHBondContact CD2-CZ 3.11Å; H378-F425 AromaticContact CG-CD1 3.63Å; H378-F425 AromaticContact CG-CE1 3.25Å; H378-F425 AromaticContact CG-CZ 3.73Å; H378-F425 AromaticContact ND1-CE1 3.97Å; H378-F425 AromaticContact NE2-CE1 3.86Å; Y379-F425 HydrophobicContact CD2-CB 4.01Å; Y379-F425 HydrophobicContact CE2-CB 3.65Å; M383-F425 HydrophobicContact CE-CB 3.85Å; M383-F425 HydrophobicContact CE-CD2 3.72Å; M383-F425 HydrophobicContact CE-CG 4.16Å; V421-F425 HydrophobicContact CB-CD2 4.27Å; V421-F425 HydrophobicContact CB-CE2 4.41Å; V421-F425 WeakPolarHBondContact O-CD2 3.35Å; V421-F425 PolarHBondContact O-N 2.72Å; F425-Q428 WeakPolarHBondContact O-CB 3.37Å; F425-Q428 PolarHBondContact O-N 2.93Å
426F97.9Very high97.9Very high100 Ų10035.4 Ų35.444%0.43919%0.189SC..Hα-helixtrans-62.4-46.6177.1-165.9-105.2000111.9Y379 N422 Q428 H429 F430Y379-F426 WeakPolarHBondContact OH-CB 3.39Å; N422-F426 WeakPolarHBondContact O-CA 3.16Å; N422-F426 WeakPolarHBondContact O-CB 3.02Å; N422-F426 PolarHBondContact O-N 3.32Å; F426-Q428 PolarHBondContact O-N 2.99Å; F426-Q428 VanDerWaalsContact O-N 3.15Å; F426-H429 PolarHBondContact O-N 3.33Å; F426-H429 PolarHBondContact O-ND1 2.83Å; F426-F430 AromaticContact CD1-CE2 3.9Å; F426-F430 HydrophobicContact CD1-CE2 3.9Å; F426-F430 AromaticContact CE1-CE2 3.58Å; F426-F430 HydrophobicContact CE1-CE2 3.58Å; F426-F430 AromaticContact CE1-CZ 4Å; F426-F430 HydrophobicContact CE1-CZ 4Å; F426-F430 HydrophobicContact CZ-CE2 4.3Å; F426-F430 HydrophobicContact CZ-CZ 4.43Å
427P98.2Very high97.9Very high7 Ų735.6 Ų35.65%0.04519%0.193CC..Hα-helixtrans-56-29.6174.2-31.141.4000114.7N422 L423 H429 F430 L431 W450 L453N422-P427 WeakPolarHBondContact O-CD 3.07Å; L423-P427 WeakPolarHBondContact O-CD 3.44Å; L423-P427 WeakPolarHBondContact O-CG 3.28Å; P427-H429 VanDerWaalsContact C-N 3.26Å; P427-H429 PolarHBondContact O-N 3.29Å; P427-F430 WeakPolarHBondContact O-CB 3.3Å; P427-F430 PolarHBondContact O-N 3.03Å; P427-L431 PolarHBondContact O-N 3.38Å; P427-L431 VanDerWaalsContact O-N 3.12Å; P427-W450 HydrophobicContact CB-CB 4.15Å; P427-W450 HydrophobicContact CB-CD2 4.46Å; P427-W450 HydrophobicContact CB-CE3 3.85Å; P427-W450 HydrophobicContact CG-CE3 4.36Å; P427-L453 HydrophobicContact CG-CB 4.14Å
428Q98.4Very high97.9Very high5 Ų537.1 Ų37.12%0.02320%0.198CC..Hα-helixtrans-68.2-24.2-177-65.8-178.57.900112.9Y371 A375 F425 F426 F430 L431 G432 S454Y371-Q428 CarbonylContact C-O 3.29Å; Y371-Q428 WeakPolarHBondContact CB-O 3.36Å; Y371-Q428 HydrophobicContact CD1-CB 4.16Å; Y371-Q428 HydrophobicContact CD1-CG 3.94Å; A375-Q428 HydrophobicContact CB-CB 3.74Å; F425-Q428 WeakPolarHBondContact O-CB 3.37Å; F425-Q428 PolarHBondContact O-N 2.93Å; F426-Q428 PolarHBondContact O-N 2.99Å; F426-Q428 VanDerWaalsContact O-N 3.15Å; Q428-F430 VanDerWaalsContact C-N 3.32Å; Q428-F430 PolarHBondContact O-N 3.28Å; Q428-L431 HydrophobicContact CG-CD1 4.27Å; Q428-L431 WeakPolarHBondContact O-CB 3.15Å; Q428-L431 PolarHBondContact O-N 3.39Å; Q428-G432 PolarHBondContact O-N 2.86Å; Q428-S454 PolarHBondContact NE2-OG 2.87Å
429H98.4Very high97.7Very high13 Ų1337.5 Ų37.56%0.0620%0.198CC..Hα-helixtrans-62.4-41.2169.4-65101.7000111.3Y372 A375 Y379 F426 P427 G432 L433Y372-H429 HydrophobicContact CD2-CB 4.29Å; Y372-H429 HydrophobicContact CE2-CB 4.38Å; Y372-H429 AromaticContact CE2-CD2 3.92Å; A375-H429 WeakPolarHBondContact CB-NE2 3Å; Y379-H429 AromaticContact CD2-CE1 3.52Å; Y379-H429 AromaticContact CE2-CE1 3.51Å; F426-H429 PolarHBondContact O-N 3.33Å; F426-H429 PolarHBondContact O-ND1 2.83Å; P427-H429 VanDerWaalsContact C-N 3.26Å; P427-H429 PolarHBondContact O-N 3.29Å; H429-G432 PolarHBondContact O-N 3.49Å; H429-L433 WeakPolarHBondContact O-CB 3.26Å; H429-L433 VanDerWaalsContact O-CG 3.26Å; H429-L433 WeakPolarHBondContact O-CG 3.17Å; H429-L433 PolarHBondContact O-N 3.29Å
430F98.3Very high97.6Very high81 Ų8140.2 Ų40.236%0.35520%0.204SC..Hα-helixtrans-68.5-40.3177.3-60.7-75.7000111.5F426 P427 Q428 G432 L433 S434 W450F426-F430 AromaticContact CD1-CE2 3.9Å; F426-F430 HydrophobicContact CD1-CE2 3.9Å; F426-F430 AromaticContact CE1-CE2 3.58Å; F426-F430 HydrophobicContact CE1-CE2 3.58Å; F426-F430 AromaticContact CE1-CZ 4Å; F426-F430 HydrophobicContact CE1-CZ 4Å; F426-F430 HydrophobicContact CZ-CE2 4.3Å; F426-F430 HydrophobicContact CZ-CZ 4.43Å; P427-F430 WeakPolarHBondContact O-CB 3.3Å; P427-F430 PolarHBondContact O-N 3.03Å; Q428-F430 VanDerWaalsContact C-N 3.32Å; Q428-F430 PolarHBondContact O-N 3.28Å; F430-G432 VanDerWaalsContact C-N 3.3Å; F430-G432 PolarHBondContact O-N 3.28Å; F430-L433 PolarHBondContact O-N 3.22Å; F430-S434 WeakPolarHBondContact O-CB 3.45Å; F430-S434 PolarHBondContact O-N 3.05Å; F430-S434 PolarHBondContact O-OG 2.9Å; F430-W450 HydrophobicContact CB-CD2 4.21Å; F430-W450 HydrophobicContact CB-CG 4.37Å; F430-W450 HydrophobicContact CB-CZ2 4.25Å; F430-W450 HydrophobicContact CD2-CH2 4.25Å; F430-W450 HydrophobicContact CD2-CZ2 4.27Å; F430-W450 HydrophobicContact CD2-CZ3 4.4Å; F430-W450 HydrophobicContact CG-CZ2 4.13Å
431L98.1Very high97.4Very high0 Ų040.8 Ų40.80%021%0.208CC..Hα-helixtrans-54.6-48.6171.3-70.7175.8000111.1Y371 P427 Q428 S434 G435 M436 Y447 W450Y371-L431 HydrophobicContact CD1-CD1 4.33Å; Y371-L431 HydrophobicContact CG-CB 4.27Å; P427-L431 PolarHBondContact O-N 3.38Å; P427-L431 VanDerWaalsContact O-N 3.12Å; Q428-L431 HydrophobicContact CG-CD1 4.27Å; Q428-L431 WeakPolarHBondContact O-CB 3.15Å; Q428-L431 PolarHBondContact O-N 3.39Å; L431-S434 WeakPolarHBondContact CA-OG 3.21Å; L431-S434 CarbonylContact O-C 3.38Å; L431-S434 PolarHBondContact O-N 3.4Å; L431-S434 PolarHBondContact O-OG 2.88Å; L431-G435 PolarHBondContact O-N 2.88Å; L431-M436 HydrophobicContact CB-CB 4.14Å; L431-M436 HydrophobicContact CB-SD 4.09Å; L431-M436 HydrophobicContact CD1-SD 3.91Å; L431-M436 HydrophobicContact CD2-SD 3.71Å; L431-M436 HydrophobicContact CG-SD 4.12Å; L431-M436 WeakPolarHBondContact O-CB 3.14Å; L431-M436 PolarHBondContact O-N 3.47Å; L431-Y447 HydrophobicContact CD2-CD1 3.94Å; L431-Y447 HydrophobicContact CD2-CG 4.17Å; L431-W450 HydrophobicContact CD1-CB 4.13Å; L431-W450 HydrophobicContact CD2-CB 3.54Å; L431-W450 HydrophobicContact CD2-CG 4.25Å; L431-W450 HydrophobicContact CG-CB 3.62Å; L431-W450 HydrophobicContact CG-CG 4.39Å
432G97.9Very high97.4Very high1 Ų143.6 Ų43.61%0.0122%0.223CC..Hα-helixtrans-63.4-46177.900000114.2Y372 Q428 H429 F430 S434 G435Y372-G432 VanDerWaalsContact N-CA 3.32Å; Q428-G432 PolarHBondContact O-N 2.86Å; H429-G432 PolarHBondContact O-N 3.49Å; F430-G432 VanDerWaalsContact C-N 3.3Å; F430-G432 PolarHBondContact O-N 3.28Å; G432-S434 PolarHBondContact O-N 2.83Å; G432-G435 WeakPolarHBondContact O-CA 3.36Å; G432-G435 PolarHBondContact O-N 3.43Å
433L97.6Very high97.3Very high109 Ų10942.8 Ų42.857%0.57122%0.218SC*.Hα-helixtrans-61.7-29.2175.7-71.7171.5000112.5L367 Y372 H429 F430 G435L367-L433 HydrophobicContact CD2-CD2 4.01Å; Y372-L433 HydrophobicContact CD2-CD2 4.01Å; Y372-L433 HydrophobicContact CD2-CG 3.89Å; Y372-L433 HydrophobicContact CE2-CD1 4.45Å; Y372-L433 HydrophobicContact CE2-CD2 3.97Å; Y372-L433 HydrophobicContact CE2-CG 4.06Å; H429-L433 WeakPolarHBondContact O-CB 3.26Å; H429-L433 VanDerWaalsContact O-CG 3.26Å; H429-L433 WeakPolarHBondContact O-CG 3.17Å; H429-L433 PolarHBondContact O-N 3.29Å; F430-L433 PolarHBondContact O-N 3.22Å; L433-G435 VanDerWaalsContact C-N 3.25Å
434S97.3Very high97.2Very high59 Ų5943.8 Ų43.841%0.41323%0.228SC..THydrogen-bonded Turntrans-84.16.3173.363.20000114.2F430 L431 G432 Y447F430-S434 WeakPolarHBondContact O-CB 3.45Å; F430-S434 PolarHBondContact O-N 3.05Å; F430-S434 PolarHBondContact O-OG 2.9Å; L431-S434 WeakPolarHBondContact CA-OG 3.21Å; L431-S434 CarbonylContact O-C 3.38Å; L431-S434 PolarHBondContact O-N 3.4Å; L431-S434 PolarHBondContact O-OG 2.88Å; G432-S434 PolarHBondContact O-N 2.83Å; S434-Y447 PolarHBondContact O-OH 3.05Å; S434-Y447 WeakPolarHBondContact OG-CD1 3.26Å; S434-Y447 WeakPolarHBondContact OG-CE1 3.33Å
435G97.1Very high97.1Very high39 Ų3949.3 Ų49.340%0.40226%0.258SS..THydrogen-bonded Turntrans82.515.6174.100000115.4L431 G432 L433 P437L431-G435 PolarHBondContact O-N 2.88Å; G432-G435 WeakPolarHBondContact O-CA 3.36Å; G432-G435 PolarHBondContact O-N 3.43Å; L433-G435 VanDerWaalsContact C-N 3.25Å; G435-P437 VanDerWaalsContact O-CD 3.29Å; G435-P437 WeakPolarHBondContact O-CD 3.39Å
436M97.9Very high97.1Very high3 Ų352.6 Ų52.62%0.01529%0.288CS..PPolyproline II helixtrans-66.6118.9177.5-173.4-179.6176.100110.1T370 Y371 L431 Y443 Y447 N451T370-M436 CarbonylContact C-O 3.47Å; T370-M436 VanDerWaalsContact CA-O 3.25Å; T370-M436 WeakPolarHBondContact CA-O 3.49Å; T370-M436 WeakPolarHBondContact CB-O 3.15Å; Y371-M436 HydrophobicContact CD2-CB 4.1Å; Y371-M436 HydrophobicContact CD2-CE 4.16Å; Y371-M436 HydrophobicContact CD2-CG 3.67Å; Y371-M436 HydrophobicContact CD2-SD 3.79Å; Y371-M436 HydrophobicContact CE2-CE 3.49Å; Y371-M436 VanDerWaalsContact CE2-CE 3.49Å; Y371-M436 HydrophobicContact CE2-CG 3.88Å; Y371-M436 HydrophobicContact CE2-SD 3.75Å; Y371-M436 HydrophobicContact CG-SD 4.38Å; Y371-M436 PolarHBondContact N-O 3.16Å; L431-M436 HydrophobicContact CB-CB 4.14Å; L431-M436 HydrophobicContact CB-SD 4.09Å; L431-M436 HydrophobicContact CD1-SD 3.91Å; L431-M436 HydrophobicContact CD2-SD 3.71Å; L431-M436 HydrophobicContact CG-SD 4.12Å; L431-M436 WeakPolarHBondContact O-CB 3.14Å; L431-M436 PolarHBondContact O-N 3.47Å; M436-Y443 HydrophobicContact CE-CD1 3.72Å; M436-Y443 HydrophobicContact CE-CG 3.75Å; M436-Y447 HydrophobicContact CB-CD1 4.07Å; M436-Y447 HydrophobicContact CB-CD2 4.33Å; M436-Y447 HydrophobicContact CB-CE1 3.96Å; M436-Y447 HydrophobicContact CB-CE2 4.19Å; M436-Y447 HydrophobicContact CB-CG 4.25Å; M436-Y447 HydrophobicContact CG-CD2 4.14Å; M436-Y447 HydrophobicContact CG-CE2 4.3Å; M436-Y447 HydrophobicContact CG-CG 4.26Å; M436-Y447 HydrophobicContact SD-CD2 4.4Å; M436-Y447 HydrophobicContact SD-CG 4.12Å; M436-N451 WeakPolarHBondContact CE-ND2 3.39Å; M436-N451 PolarHBondContact SD-ND2 3.38Å; M436-N451 VanDerWaalsContact SD-ND2 3.44Å
437P97.6Very high97Very high51 Ų5149.7 Ų49.733%0.33128%0.275SS..BIsolated β-bridgetrans-75.5149.7-179.932-35.6000111.6D369 Y371 G435 Y440D369-P437 CarbonylContact O-C 3.58Å; D369-P437 WeakPolarHBondContact O-CA 3.49Å; Y371-P437 WeakPolarHBondContact CE2-O 3.39Å; G435-P437 VanDerWaalsContact O-CD 3.29Å; G435-P437 WeakPolarHBondContact O-CD 3.39Å; P437-Y440 HydrophobicContact CB-CD2 3.76Å; P437-Y440 HydrophobicContact CB-CE2 3.6Å; P437-Y440 HydrophobicContact CG-CD2 3.56Å; P437-Y440 HydrophobicContact CG-CE2 3.64Å; P437-Y440 HydrophobicContact CG-CG 4.21Å
438R96.9Very high97Very high47 Ų4750.7 Ų50.718%0.17728%0.281CS..SBendtrans-80.8159.3175.873.6-176.3-179149.6-4.5111.6D369 V374 Y440D369-R438 HydrophobicContact CB-CG 4.42Å; D369-R438 VanDerWaalsContact O-CG 3.31Å; D369-R438 WeakPolarHBondContact O-CG 3.29Å; D369-R438 PolarHBondContact O-N 3.17Å; D369-R438 IonicContact OD1-CZ 3.58Å; D369-R438 IonicContact OD1-NE 2.75Å; D369-R438 PolarHBondContact OD1-NE 2.97Å; D369-R438 IonicContact OD1-NH2 3.58Å; D369-R438 PolarHBondContact OD1-NH2 3.2Å; V374-R438 HydrophobicContact CG2-CB 3.82Å; R438-Y440 VanDerWaalsContact C-N 3.32Å; R438-Y440 VanDerWaalsContact O-CD2 3.31Å; R438-Y440 WeakPolarHBondContact O-CD2 3.38Å; R438-Y440 PolarHBondContact O-N 3Å
439R95Very high96.9Very high63 Ų6355.1 Ų55.124%0.23831%0.308CS..SBendtrans64.229.1176.4-54.6173.4-174.5-176.82.4114.9N55 V58N55-R439 PolarHBondContact OD1-O 3.41Å; V58-R439 HydrophobicContact CG1-CG 4.49Å
440Y95.1Very high96.9Very high140 Ų14059 Ų5955%0.54932%0.322SS..  trans-102.4139.7165.4-73.6-102.1000109.1Y54 P437 R438Y54-Y440 VanDerWaalsContact CE1-C 3.42Å; Y54-Y440 VanDerWaalsContact CE1-O 3.23Å; Y54-Y440 WeakPolarHBondContact CE1-O 3.46Å; Y54-Y440 VanDerWaalsContact CZ-O 3.22Å; Y54-Y440 PolarHBondContact OH-O 3.5Å; P437-Y440 HydrophobicContact CB-CD2 3.76Å; P437-Y440 HydrophobicContact CB-CE2 3.6Å; P437-Y440 HydrophobicContact CG-CD2 3.56Å; P437-Y440 HydrophobicContact CG-CE2 3.64Å; P437-Y440 HydrophobicContact CG-CG 4.21Å; R438-Y440 VanDerWaalsContact C-N 3.32Å; R438-Y440 VanDerWaalsContact O-CD2 3.31Å; R438-Y440 WeakPolarHBondContact O-CD2 3.38Å; R438-Y440 PolarHBondContact O-N 3Å
441S95.3Very high96.9Very high12 Ų1255.1 Ų55.18%0.08431%0.305CS..SBendtrans-77.1-27.5175.641.90000112.4D51D51-S441 WeakPolarHBondContact OD1-CB 3.27Å; D51-S441 PolarHBondContact OD1-OG 3.1Å
442D96Very high96.9Very high66 Ų6658.9 Ų58.935%0.35333%0.325SS..  trans-129.9162.5-179.8-16512.6000111.6G45G45-D442 PolarHBondContact N-OD1 2.97Å
443Y96.3Very high96.9Very high12 Ų1262.2 Ų62.25%0.04734%0.342CS..  trans-151.7152.8-176.558.8-96.1000113.3L41 Q43 P44 M436 N451L41-Y443 HydrophobicContact CB-CE1 4.19Å; L41-Y443 HydrophobicContact CD2-CD1 3.91Å; L41-Y443 HydrophobicContact CD2-CE1 4.08Å; L41-Y443 VanDerWaalsContact O-CE1 3.24Å; L41-Y443 WeakPolarHBondContact O-CE1 3.27Å; L41-Y443 PolarHBondContact O-OH 2.84Å; Q43-Y443 VanDerWaalsContact C-OH 3.28Å; Q43-Y443 VanDerWaalsContact CA-OH 3.28Å; Q43-Y443 WeakPolarHBondContact CA-OH 3.29Å; Q43-Y443 PolarHBondContact N-OH 3.14Å; P44-Y443 HydrophobicContact CG-CD2 4.32Å; P44-Y443 HydrophobicContact CG-CE2 3.75Å; M436-Y443 HydrophobicContact CE-CD1 3.72Å; M436-Y443 HydrophobicContact CE-CG 3.75Å; Y443-N451 HydrophobicContact CE1-CB 4.08Å; Y443-N451 HydrophobicContact CE2-CB 4.18Å; Y443-N451 VanDerWaalsContact OH-CB 3.22Å; Y443-N451 WeakPolarHBondContact OH-CB 3.25Å
444P96.6Very high96.9Very high87 Ų8757 Ų5757%0.56532%0.315SS*.  trans-59.2143.4173.8-25.432.5000114A446 Y447P444-A446 PolarHBondContact O-N 3.48Å; P444-Y447 HydrophobicContact CB-CD2 4.22Å; P444-Y447 HydrophobicContact CB-CE2 4.26Å; P444-Y447 HydrophobicContact CG-CD2 4.29Å; P444-Y447 HydrophobicContact CG-CE2 4.02Å; P444-Y447 WeakPolarHBondContact O-CD2 3.45Å; P444-Y447 PolarHBondContact O-N 3.36Å
445D95.4Very high97Very high122 Ų12254.5 Ų54.565%0.65230%0.297SS*.G310 helixtrans-51-25.1-177.3-65.8-0.5000115P44 Y447 T448P44-D445 WeakPolarHBondContact CB-OD1 3.33Å; P44-D445 VanDerWaalsContact CG-OD1 3.32Å; P44-D445 WeakPolarHBondContact CG-OD1 3.49Å; D445-Y447 PolarHBondContact O-N 2.85Å; D445-Y447 VanDerWaalsContact O-N 3.15Å; D445-T448 WeakPolarHBondContact CA-OG1 3.45Å; D445-T448 VanDerWaalsContact O-CB 3.26Å; D445-T448 WeakPolarHBondContact O-CB 3.41Å; D445-T448 PolarHBondContact O-N 3.02Å; D445-T448 VanDerWaalsContact O-N 3.11Å; D445-T448 PolarHBondContact O-OG1 3.25Å
446A96.8Very high97Very high88 Ų8856 Ų5673%0.72730%0.298SS*.G310 helixtrans-57.1-25.5175.300000113.7P444P444-A446 PolarHBondContact O-N 3.48Å
447Y97.4Very high97Very high39 Ų3955.8 Ų55.815%0.15330%0.297CS..G310 helixtrans-93.3-3.8-179.1-57.3-56.2000113.8L431 S434 M436 P444 D445 T449 W450 N451L431-Y447 HydrophobicContact CD2-CD1 3.94Å; L431-Y447 HydrophobicContact CD2-CG 4.17Å; S434-Y447 PolarHBondContact O-OH 3.05Å; S434-Y447 WeakPolarHBondContact OG-CD1 3.26Å; S434-Y447 WeakPolarHBondContact OG-CE1 3.33Å; M436-Y447 HydrophobicContact CB-CD1 4.07Å; M436-Y447 HydrophobicContact CB-CD2 4.33Å; M436-Y447 HydrophobicContact CB-CE1 3.96Å; M436-Y447 HydrophobicContact CB-CE2 4.19Å; M436-Y447 HydrophobicContact CB-CG 4.25Å; M436-Y447 HydrophobicContact CG-CD2 4.14Å; M436-Y447 HydrophobicContact CG-CE2 4.3Å; M436-Y447 HydrophobicContact CG-CG 4.26Å; M436-Y447 HydrophobicContact SD-CD2 4.4Å; M436-Y447 HydrophobicContact SD-CG 4.12Å; P444-Y447 HydrophobicContact CB-CD2 4.22Å; P444-Y447 HydrophobicContact CB-CE2 4.26Å; P444-Y447 HydrophobicContact CG-CD2 4.29Å; P444-Y447 HydrophobicContact CG-CE2 4.02Å; P444-Y447 WeakPolarHBondContact O-CD2 3.45Å; P444-Y447 PolarHBondContact O-N 3.36Å; D445-Y447 PolarHBondContact O-N 2.85Å; D445-Y447 VanDerWaalsContact O-N 3.15Å; Y447-T449 PolarHBondContact O-N 3.15Å; Y447-W450 PolarHBondContact O-N 2.94Å; Y447-N451 PolarHBondContact O-N 3.06Å; Y447-N451 PolarHBondContact O-ND2 2.81Å
448T97.1Very high97Very high28 Ų2853.9 Ų53.917%0.17229%0.285CS..Hα-helixtrans-57.5-46.7-170.9-55.30000113.2P44 D445 W450 N451 I452P44-T448 HydrophobicContact CG-CG2 4.41Å; P44-T448 WeakPolarHBondContact CG-OG1 3.36Å; D445-T448 WeakPolarHBondContact CA-OG1 3.45Å; D445-T448 VanDerWaalsContact O-CB 3.26Å; D445-T448 WeakPolarHBondContact O-CB 3.41Å; D445-T448 PolarHBondContact O-N 3.02Å; D445-T448 VanDerWaalsContact O-N 3.11Å; D445-T448 PolarHBondContact O-OG1 3.25Å; T448-W450 VanDerWaalsContact C-N 3.35Å; T448-W450 PolarHBondContact O-N 2.86Å; T448-N451 PolarHBondContact O-N 3.03Å; T448-N451 VanDerWaalsContact O-N 3.17Å; T448-I452 HydrophobicContact CG2-CD1 3.58Å; T448-I452 HydrophobicContact CG2-CG1 4.1Å; T448-I452 WeakPolarHBondContact O-CG1 3.46Å; T448-I452 PolarHBondContact O-N 3.35Å
449T97.1Very high97.1Very high97 Ų9756.6 Ų56.660%0.59530%0.298SS*.Hα-helixtrans-56.9-47.4-175.8-550000112.3Y447 L453Y447-T449 PolarHBondContact O-N 3.15Å; T449-L453 WeakPolarHBondContact O-CG 3.48Å; T449-L453 PolarHBondContact O-N 3.02Å
450W98Very high97.2Very high94 Ų9455.9 Ų55.936%0.35630%0.299SS..Hα-helixtrans-73.5-32.3-179.1-63.8126.8000112.4P427 F430 L431 Y447 T448 L453 S454P427-W450 HydrophobicContact CB-CB 4.15Å; P427-W450 HydrophobicContact CB-CD2 4.46Å; P427-W450 HydrophobicContact CB-CE3 3.85Å; P427-W450 HydrophobicContact CG-CE3 4.36Å; F430-W450 HydrophobicContact CB-CD2 4.21Å; F430-W450 HydrophobicContact CB-CG 4.37Å; F430-W450 HydrophobicContact CB-CZ2 4.25Å; F430-W450 HydrophobicContact CD2-CH2 4.25Å; F430-W450 HydrophobicContact CD2-CZ2 4.27Å; F430-W450 HydrophobicContact CD2-CZ3 4.4Å; F430-W450 HydrophobicContact CG-CZ2 4.13Å; L431-W450 HydrophobicContact CD1-CB 4.13Å; L431-W450 HydrophobicContact CD2-CB 3.54Å; L431-W450 HydrophobicContact CD2-CG 4.25Å; L431-W450 HydrophobicContact CG-CB 3.62Å; L431-W450 HydrophobicContact CG-CG 4.39Å; Y447-W450 PolarHBondContact O-N 2.94Å; T448-W450 VanDerWaalsContact C-N 3.35Å; T448-W450 PolarHBondContact O-N 2.86Å; W450-L453 HydrophobicContact CE3-CD1 3.78Å; W450-L453 HydrophobicContact CZ3-CD1 3.85Å; W450-S454 VanDerWaalsContact O-CB 3.25Å; W450-S454 WeakPolarHBondContact O-CB 3.24Å; W450-S454 PolarHBondContact O-N 3.27Å
451N98.1Very high97.4Very high0 Ų050 Ų500%028%0.278CS..Hα-helixtrans-68.7-41.8175-91.7-56000112.9R38 L41 M436 Y443 Y447 T448 L453 S454 S455R38-N451 PolarHBondContact NH2-O 2.72Å; R38-N451 PolarHBondContact NH2-OD1 2.93Å; R38-N451 VanDerWaalsContact NH2-OD1 3.11Å; L41-N451 WeakPolarHBondContact O-CB 3.43Å; M436-N451 WeakPolarHBondContact CE-ND2 3.39Å; M436-N451 PolarHBondContact SD-ND2 3.38Å; M436-N451 VanDerWaalsContact SD-ND2 3.44Å; Y443-N451 HydrophobicContact CE1-CB 4.08Å; Y443-N451 HydrophobicContact CE2-CB 4.18Å; Y443-N451 VanDerWaalsContact OH-CB 3.22Å; Y443-N451 WeakPolarHBondContact OH-CB 3.25Å; Y447-N451 PolarHBondContact O-N 3.06Å; Y447-N451 PolarHBondContact O-ND2 2.81Å; T448-N451 PolarHBondContact O-N 3.03Å; T448-N451 VanDerWaalsContact O-N 3.17Å; N451-L453 PolarHBondContact O-N 2.99Å; N451-S454 PolarHBondContact O-N 2.94Å; N451-S455 WeakPolarHBondContact O-CB 3.21Å; N451-S455 PolarHBondContact O-N 3.33Å; N451-S455 PolarHBondContact O-OG 3Å; N451-S455 VanDerWaalsContact O-OG 3.12Å
452I97.9Very high97.4Very high80 Ų8052 Ų5241%0.4129%0.288SS..Hα-helixtrans-58.4-49.5173.4-69.9170.8000110G42 T448 S454 S455 V456G42-I452 WeakPolarHBondContact O-CG1 3.2Å; T448-I452 HydrophobicContact CG2-CD1 3.58Å; T448-I452 HydrophobicContact CG2-CG1 4.1Å; T448-I452 WeakPolarHBondContact O-CG1 3.46Å; T448-I452 PolarHBondContact O-N 3.35Å; I452-S454 VanDerWaalsContact C-N 3.32Å; I452-S454 PolarHBondContact O-N 3.42Å; I452-S455 PolarHBondContact O-N 3.49Å; I452-V456 HydrophobicContact CG2-CG2 4.36Å; I452-V456 WeakPolarHBondContact O-CG2 3.26Å; I452-V456 PolarHBondContact O-N 3.13Å
453L98Very high97.5Very high70 Ų7052.4 Ų52.437%0.36629%0.292SS..Hα-helixtrans-59.9-44178.3-72.5174.9000111.9L423 P427 T449 W450 N451 S455 V456 G457L423-L453 CarbonylContact O-C 3.58Å; P427-L453 HydrophobicContact CG-CB 4.14Å; T449-L453 WeakPolarHBondContact O-CG 3.48Å; T449-L453 PolarHBondContact O-N 3.02Å; W450-L453 HydrophobicContact CE3-CD1 3.78Å; W450-L453 HydrophobicContact CZ3-CD1 3.85Å; N451-L453 PolarHBondContact O-N 2.99Å; L453-S455 VanDerWaalsContact C-N 3.34Å; L453-S455 PolarHBondContact O-N 2.91Å; L453-V456 PolarHBondContact O-N 3.13Å; L453-G457 PolarHBondContact O-N 3.35Å
454S98.3Very high97.6Very high0 Ų051.8 Ų51.80%029%0.29CS..Hα-helixtrans-61.5-41.6177.3-176.10000111.9R38 L423 T424 Q428 W450 N451 I452 G457 S458R38-S454 PolarHBondContact NH1-OG 3.3Å; R38-S454 VanDerWaalsContact NH2-CB 3.34Å; R38-S454 PolarHBondContact NH2-OG 3.49Å; L423-S454 WeakPolarHBondContact O-CA 3.44Å; T424-S454 WeakPolarHBondContact CA-O 3.41Å; T424-S454 VanDerWaalsContact O-CB 3.25Å; T424-S454 WeakPolarHBondContact O-CB 3.43Å; T424-S454 PolarHBondContact O-OG 3.25Å; Q428-S454 PolarHBondContact NE2-OG 2.87Å; W450-S454 VanDerWaalsContact O-CB 3.25Å; W450-S454 WeakPolarHBondContact O-CB 3.24Å; W450-S454 PolarHBondContact O-N 3.27Å; N451-S454 PolarHBondContact O-N 2.94Å; I452-S454 VanDerWaalsContact C-N 3.32Å; I452-S454 PolarHBondContact O-N 3.42Å; S454-G457 PolarHBondContact O-N 3.36Å; S454-S458 PolarHBondContact O-N 3.39Å; S454-S458 VanDerWaalsContact O-N 3.13Å
455S98.2Very high97.6Very high6 Ų649.1 Ų49.14%0.04227%0.272CS..Hα-helixtrans-70.4-40.4177.5-63.40000112.6R38 N451 I452 L453 G457 S458 F459R38-S455 PolarHBondContact NE-OG 3.12Å; R38-S455 PolarHBondContact NH2-OG 2.67Å; R38-S455 WeakPolarHBondContact O-CB 3.47Å; R38-S455 PolarHBondContact O-OG 3.1Å; N451-S455 WeakPolarHBondContact O-CB 3.21Å; N451-S455 PolarHBondContact O-N 3.33Å; N451-S455 PolarHBondContact O-OG 3Å; N451-S455 VanDerWaalsContact O-OG 3.12Å; I452-S455 PolarHBondContact O-N 3.49Å; L453-S455 VanDerWaalsContact C-N 3.34Å; L453-S455 PolarHBondContact O-N 2.91Å; S455-G457 VanDerWaalsContact C-N 3.31Å; S455-G457 PolarHBondContact O-N 3.27Å; S455-S458 WeakPolarHBondContact O-CB 3.24Å; S455-S458 PolarHBondContact O-N 2.81Å; S455-S458 VanDerWaalsContact O-N 3.09Å; S455-F459 WeakPolarHBondContact O-CD2 3.32Å; S455-F459 PolarHBondContact O-N 3.22Å; S455-F459 VanDerWaalsContact O-N 3.07Å
456V98.4Very high97.7Very high70 Ų7048.6 Ų48.642%0.42427%0.267SS..Hα-helixtrans-58.3-44172.1170.10000110.9I452 L453 S458 F459 I460I452-V456 HydrophobicContact CG2-CG2 4.36Å; I452-V456 WeakPolarHBondContact O-CG2 3.26Å; I452-V456 PolarHBondContact O-N 3.13Å; L453-V456 PolarHBondContact O-N 3.13Å; V456-S458 VanDerWaalsContact C-N 3.27Å; V456-S458 PolarHBondContact O-N 3.29Å; V456-F459 PolarHBondContact O-N 3.45Å; V456-I460 HydrophobicContact CG1-CD1 4Å; V456-I460 WeakPolarHBondContact O-CG1 3.28Å; V456-I460 PolarHBondContact O-N 3.15Å
457G98.3Very high97.8Very high0 Ų045.9 Ų45.90%024%0.24CC..Hα-helixtrans-57.7-39.3174.500000113G420 T424 L453 S454 S455 I460 S461G420-G457 CarbonylContact C-O 3.59Å; G420-G457 WeakPolarHBondContact CA-O 3.38Å; G420-G457 CarbonylContact O-C 3.51Å; G420-G457 WeakPolarHBondContact O-CA 3.36Å; T424-G457 WeakPolarHBondContact OG1-CA 3.46Å; T424-G457 PolarHBondContact OG1-O 3Å; L453-G457 PolarHBondContact O-N 3.35Å; S454-G457 PolarHBondContact O-N 3.36Å; S455-G457 VanDerWaalsContact C-N 3.31Å; S455-G457 PolarHBondContact O-N 3.27Å; G457-I460 PolarHBondContact O-N 2.81Å; G457-S461 PolarHBondContact O-N 2.93Å; G457-S461 PolarHBondContact O-OG 3.3Å
458S97.8Very high97.8Very high11 Ų1144.9 Ų44.98%0.07724%0.237CC..Hα-helixtrans-66.4-42.4178.9-174.40000111.7T424 S454 S455 V456 I460 S461 L462T424-S458 WeakPolarHBondContact OG1-CA 3.2Å; T424-S458 PolarHBondContact OG1-N 3.26Å; S454-S458 PolarHBondContact O-N 3.39Å; S454-S458 VanDerWaalsContact O-N 3.13Å; S455-S458 WeakPolarHBondContact O-CB 3.24Å; S455-S458 PolarHBondContact O-N 2.81Å; S455-S458 VanDerWaalsContact O-N 3.09Å; V456-S458 VanDerWaalsContact C-N 3.27Å; V456-S458 PolarHBondContact O-N 3.29Å; S458-I460 PolarHBondContact O-N 3.2Å; S458-S461 WeakPolarHBondContact O-CB 3.38Å; S458-S461 PolarHBondContact O-N 3.31Å; S458-S461 VanDerWaalsContact O-N 3.13Å; S458-L462 PolarHBondContact O-N 3.18Å
459F97.7Very high97.8Very high103 Ų10347.6 Ų47.645%0.45225%0.25SC..Hα-helixtrans-65.4-35.4173.5-73.9-70.4000112.9L35 S455 V456 S461 L462 T463L35-F459 HydrophobicContact CD2-CD1 4.16Å; L35-F459 HydrophobicContact CD2-CE1 4.29Å; S455-F459 WeakPolarHBondContact O-CD2 3.32Å; S455-F459 PolarHBondContact O-N 3.22Å; S455-F459 VanDerWaalsContact O-N 3.07Å; V456-F459 PolarHBondContact O-N 3.45Å; F459-S461 VanDerWaalsContact C-N 3.32Å; F459-L462 WeakPolarHBondContact O-CB 3.4Å; F459-L462 PolarHBondContact O-N 3.21Å; F459-T463 PolarHBondContact O-N 3.34Å
460I98.4Very high97.8Very high48 Ų4846.8 Ų46.825%0.24624%0.238CC..Hα-helixtrans-62.9-42.5171.1-66.9166.3000110I416 L423 V456 G457 S458 L462 T463 A464I416-I460 HydrophobicContact CG2-CG2 3.87Å; L423-I460 HydrophobicContact CD1-CD1 3.73Å; V456-I460 HydrophobicContact CG1-CD1 4Å; V456-I460 WeakPolarHBondContact O-CG1 3.28Å; V456-I460 PolarHBondContact O-N 3.15Å; G457-I460 PolarHBondContact O-N 2.81Å; S458-I460 PolarHBondContact O-N 3.2Å; I460-L462 VanDerWaalsContact C-N 3.29Å; I460-L462 PolarHBondContact O-N 2.9Å; I460-T463 WeakPolarHBondContact O-CB 3.34Å; I460-T463 PolarHBondContact O-N 3.19Å; I460-T463 PolarHBondContact O-OG1 3.17Å; I460-A464 PolarHBondContact O-N 3.09Å
461S97.4Very high97.8Very high17 Ų1742.4 Ų42.412%0.11922%0.222CC..Hα-helixtrans-63.7-34.5178.6-52.90000112G420 V421 G457 S458 F459 T463 A464 V465G420-S461 WeakPolarHBondContact CA-OG 3.3Å; V421-S461 PolarHBondContact N-OG 3.23Å; G457-S461 PolarHBondContact O-N 2.93Å; G457-S461 PolarHBondContact O-OG 3.3Å; S458-S461 WeakPolarHBondContact O-CB 3.38Å; S458-S461 PolarHBondContact O-N 3.31Å; 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 3.01Å; S461-A464 WeakPolarHBondContact O-CB 3.48Å; S461-A464 PolarHBondContact O-N 3.22Å; S461-A464 VanDerWaalsContact O-N 3.14Å; S461-V465 PolarHBondContact O-N 3Å; S461-V465 VanDerWaalsContact O-N 3.07Å
462L97.3Very high97.8Very high54 Ų5445 Ų4528%0.28324%0.235SC..Hα-helixtrans-58.6-41.6170.5170.862.5000111.9L35 S458 F459 I460 A464 V465 M466L35-L462 HydrophobicContact CD1-CB 4.15Å; L35-L462 HydrophobicContact CD1-CD1 3.86Å; L35-L462 HydrophobicContact CD1-CD2 3.76Å; L35-L462 HydrophobicContact CD1-CG 4.11Å; L35-L462 HydrophobicContact CD2-CB 4.16Å; L35-L462 HydrophobicContact CD2-CD2 4.4Å; S458-L462 PolarHBondContact O-N 3.18Å; F459-L462 WeakPolarHBondContact O-CB 3.4Å; F459-L462 PolarHBondContact O-N 3.21Å; I460-L462 VanDerWaalsContact C-N 3.29Å; I460-L462 PolarHBondContact O-N 2.9Å; L462-A464 PolarHBondContact O-N 2.64Å; L462-V465 PolarHBondContact O-N 3.32Å; L462-V465 VanDerWaalsContact O-N 3.1Å; L462-M466 HydrophobicContact CD1-CG 4.17Å; L462-M466 WeakPolarHBondContact O-CG 3.48Å; L462-M466 PolarHBondContact O-N 2.77Å
463T97.9Very high97.8Very high74 Ų7448.9 Ų48.945%0.45424%0.244SC..Hα-helixtrans-61.9-33.9177.169.60000112.1I416 F459 I460 S461 M466 L467I416-T463 WeakPolarHBondContact CG2-OG1 3.38Å; F459-T463 PolarHBondContact O-N 3.34Å; I460-T463 WeakPolarHBondContact O-CB 3.34Å; I460-T463 PolarHBondContact O-N 3.19Å; I460-T463 PolarHBondContact O-OG1 3.17Å; S461-T463 VanDerWaalsContact C-N 3.32Å; S461-T463 PolarHBondContact O-N 3.01Å; T463-M466 PolarHBondContact O-N 2.85Å; T463-L467 WeakPolarHBondContact O-CB 3.43Å; T463-L467 PolarHBondContact O-N 3.49Å
464A97.8Very high97.8Very high0 Ų047.1 Ų47.10%023%0.234CC..Hα-helixtrans-66.5-43.1172.400000112H413 I416 M417 I460 S461 L462 M466 L467 M468H413-A464 PolarHBondContact CD2-O 3.36Å; H413-A464 PolarHBondContact NE2-O 3.4Å; I416-A464 HydrophobicContact CB-CB 4.22Å; I416-A464 HydrophobicContact CG2-CB 3.84Å; M417-A464 HydrophobicContact CB-CB 3.83Å; M417-A464 HydrophobicContact CE-CB 3.72Å; M417-A464 HydrophobicContact SD-CB 4.18Å; I460-A464 PolarHBondContact O-N 3.09Å; S461-A464 WeakPolarHBondContact O-CB 3.48Å; S461-A464 PolarHBondContact O-N 3.22Å; S461-A464 VanDerWaalsContact O-N 3.14Å; L462-A464 PolarHBondContact O-N 2.64Å; A464-M466 VanDerWaalsContact C-N 3.32Å; A464-M466 PolarHBondContact O-N 3.2Å; A464-L467 WeakPolarHBondContact O-CB 3.37Å; A464-L467 PolarHBondContact O-N 3.23Å; A464-L467 VanDerWaalsContact O-N 3.15Å; A464-M468 PolarHBondContact O-N 3.33Å
465V96.9Very high97.7Very high30 Ų3047.1 Ų47.118%0.18223%0.234CC..Hα-helixtrans-59.1-43.6175.4175.50000111.4T31 M417 S461 L462 L467 M468 I469T31-V465 HydrophobicContact CG2-CG2 4.4Å; M417-V465 HydrophobicContact CE-CG2 4.16Å; S461-V465 PolarHBondContact O-N 3Å; S461-V465 VanDerWaalsContact O-N 3.07Å; L462-V465 PolarHBondContact O-N 3.32Å; L462-V465 VanDerWaalsContact O-N 3.1Å; V465-L467 VanDerWaalsContact C-N 3.34Å; V465-L467 PolarHBondContact O-N 3.03Å; V465-M468 WeakPolarHBondContact O-CB 3.36Å; V465-M468 PolarHBondContact O-N 3.06Å; V465-I469 PolarHBondContact O-N 3.18Å
466M97.5Very high97.7Very high112 Ų11251.5 Ų51.555%0.55225%0.253SS*.Hα-helixtrans-64-39.7176-64.8-56.8-6800112.1L462 T463 A464 M468 I469 F470L462-M466 HydrophobicContact CD1-CG 4.17Å; L462-M466 WeakPolarHBondContact O-CG 3.48Å; L462-M466 PolarHBondContact O-N 2.77Å; T463-M466 PolarHBondContact O-N 2.85Å; A464-M466 VanDerWaalsContact C-N 3.32Å; A464-M466 PolarHBondContact O-N 3.2Å; M466-M468 VanDerWaalsContact C-N 3.33Å; M466-M468 PolarHBondContact O-N 2.93Å; M466-I469 PolarHBondContact O-N 3.25Å; M466-I469 HydrophobicContact SD-CD1 4.4Å; M466-F470 PolarHBondContact O-N 2.86Å
467L98.1Very high97.6Very high31 Ų3151 Ų5116%0.16226%0.256CS..Hα-helixtrans-64.1-36.9175.3-179.559.2000112I412 H413 I416 T463 A464 V465 F470 M471I412-L467 HydrophobicContact CB-CD2 4.32Å; I412-L467 HydrophobicContact CG2-CD2 3.77Å; H413-L467 HydrophobicContact CB-CD2 3.8Å; H413-L467 HydrophobicContact CB-CG 4.2Å; I416-L467 HydrophobicContact CD1-CD2 4.1Å; T463-L467 WeakPolarHBondContact O-CB 3.43Å; T463-L467 PolarHBondContact O-N 3.49Å; A464-L467 WeakPolarHBondContact O-CB 3.37Å; A464-L467 PolarHBondContact O-N 3.23Å; A464-L467 VanDerWaalsContact O-N 3.15Å; V465-L467 VanDerWaalsContact C-N 3.34Å; V465-L467 PolarHBondContact O-N 3.03Å; L467-F470 HydrophobicContact CD1-CD1 3.98Å; L467-F470 WeakPolarHBondContact O-CB 3.24Å; L467-F470 PolarHBondContact O-N 3.43Å; L467-M471 HydrophobicContact CD1-CG 4.41Å; L467-M471 HydrophobicContact CG-CG 4.45Å; L467-M471 HydrophobicContact CG-SD 4.34Å; L467-M471 VanDerWaalsContact O-CG 3.28Å; L467-M471 WeakPolarHBondContact O-CG 3.22Å; L467-M471 PolarHBondContact O-N 2.99Å
468M97.5Very high97.5Very high17 Ų1753.2 Ų53.28%0.08427%0.271CS..Hα-helixtrans-60.9-46174.4178.658.997.500111.7M390 F393 A464 V465 M466 F470 M471 I472M390-M468 HydrophobicContact CE-CE 4.49Å; M390-M468 HydrophobicContact SD-CE 3.19Å; M390-M468 WeakPolarHBondContact SD-CE 3.4Å; F393-M468 HydrophobicContact CD1-CE 3.91Å; F393-M468 HydrophobicContact CD1-SD 4.24Å; F393-M468 HydrophobicContact CE1-CE 4.23Å; F393-M468 HydrophobicContact CE1-SD 3.94Å; A464-M468 PolarHBondContact O-N 3.33Å; V465-M468 WeakPolarHBondContact O-CB 3.36Å; V465-M468 PolarHBondContact O-N 3.06Å; M466-M468 VanDerWaalsContact C-N 3.33Å; M466-M468 PolarHBondContact O-N 2.93Å; M468-F470 VanDerWaalsContact C-N 3.29Å; M468-F470 PolarHBondContact O-N 3.47Å; M468-M471 PolarHBondContact O-N 3.16Å; M468-I472 HydrophobicContact CG-CD1 4.16Å; M468-I472 WeakPolarHBondContact O-CG1 3.41Å; M468-I472 PolarHBondContact O-N 3.3Å; M468-I472 HydrophobicContact SD-CD1 4.22Å; M468-I472 HydrophobicContact SD-CG1 4.27Å
469I97.1Very high97.3Very high86 Ų8658.9 Ų58.944%0.44130%0.295SS..Hα-helixtrans-59.6-44.6177-63.2169.4000110.1V465 M466 I472 W473V465-I469 PolarHBondContact O-N 3.18Å; M466-I469 PolarHBondContact O-N 3.25Å; M466-I469 HydrophobicContact SD-CD1 4.4Å; I469-I472 PolarHBondContact O-N 3.08Å; I469-W473 PolarHBondContact O-N 3.35Å
470F98.2Very high97.1Very high80 Ų8057.4 Ų57.435%0.35129%0.286SS..Hα-helixtrans-60-45.4175.3171.7-96.9000112.3Y409 M466 L467 M468 I472 W473 E474Y409-F470 HydrophobicContact CD2-CE1 4.2Å; Y409-F470 HydrophobicContact CE1-CE1 4.47Å; Y409-F470 HydrophobicContact CE2-CE1 4.02Å; M466-F470 PolarHBondContact O-N 2.86Å; L467-F470 HydrophobicContact CD1-CD1 3.98Å; L467-F470 WeakPolarHBondContact O-CB 3.24Å; L467-F470 PolarHBondContact O-N 3.43Å; M468-F470 VanDerWaalsContact C-N 3.29Å; M468-F470 PolarHBondContact O-N 3.47Å; F470-I472 VanDerWaalsContact C-N 3.33Å; F470-I472 PolarHBondContact O-N 3.1Å; F470-W473 AromaticContact CD2-CE3 3.84Å; F470-W473 HydrophobicContact CD2-CE3 3.84Å; F470-W473 HydrophobicContact CD2-CZ3 4.05Å; F470-W473 AromaticContact CE2-CE3 3.82Å; F470-W473 HydrophobicContact CE2-CE3 3.82Å; F470-W473 AromaticContact CE2-CZ3 3.56Å; F470-W473 HydrophobicContact CE2-CZ3 3.56Å; F470-W473 HydrophobicContact CZ-CZ3 4.35Å; F470-W473 PolarHBondContact O-N 2.92Å; F470-E474 HydrophobicContact CE1-CB 4.34Å; F470-E474 HydrophobicContact CE1-CG 4.4Å; F470-E474 HydrophobicContact CZ-CB 4.39Å; F470-E474 HydrophobicContact CZ-CG 4.31Å; F470-E474 WeakPolarHBondContact O-CB 3.24Å; F470-E474 PolarHBondContact O-N 2.7Å
471M98.1Very high96.8Very high2 Ų262.6 Ų62.61%0.0131%0.307CS..Hα-helixtrans-60.2-41.8179.1-76.2172.951.700112.5L405 A410 H413 L467 M468 E474 A475L405-M471 HydrophobicContact CB-CE 4.37Å; L405-M471 HydrophobicContact CD1-CE 4.07Å; L405-M471 HydrophobicContact CD2-CB 4.43Å; L405-M471 HydrophobicContact CD2-CE 4.38Å; A410-M471 VanDerWaalsContact CA-CE 3.49Å; A410-M471 HydrophobicContact CB-CE 3.62Å; H413-M471 HydrophobicContact CB-SD 3.64Å; L467-M471 HydrophobicContact CD1-CG 4.41Å; L467-M471 HydrophobicContact CG-CG 4.45Å; L467-M471 HydrophobicContact CG-SD 4.34Å; L467-M471 VanDerWaalsContact O-CG 3.28Å; L467-M471 WeakPolarHBondContact O-CG 3.22Å; L467-M471 PolarHBondContact O-N 2.99Å; M468-M471 PolarHBondContact O-N 3.16Å; M471-E474 PolarHBondContact O-N 2.97Å; M471-A475 WeakPolarHBondContact O-CB 3.25Å; M471-A475 PolarHBondContact O-N 3.06Å
472I97.4Very high96.4Very high53 Ų5363.7 Ų63.727%0.27231%0.313SS..Hα-helixtrans-64-49.4177.2-65.9170.3000109.6F393 M468 I469 F470 E474 A475 F476F393-I472 HydrophobicContact CE1-CD1 4.07Å; F393-I472 HydrophobicContact CE1-CG1 4.02Å; F393-I472 HydrophobicContact CZ-CD1 3.7Å; F393-I472 HydrophobicContact CZ-CG1 3.86Å; M468-I472 HydrophobicContact CG-CD1 4.16Å; M468-I472 WeakPolarHBondContact O-CG1 3.41Å; M468-I472 PolarHBondContact O-N 3.3Å; M468-I472 HydrophobicContact SD-CD1 4.22Å; M468-I472 HydrophobicContact SD-CG1 4.27Å; I469-I472 PolarHBondContact O-N 3.08Å; F470-I472 VanDerWaalsContact C-N 3.33Å; F470-I472 PolarHBondContact O-N 3.1Å; I472-E474 VanDerWaalsContact C-N 3.32Å; I472-E474 PolarHBondContact O-N 3.26Å; I472-A475 PolarHBondContact O-N 3.13Å; I472-F476 HydrophobicContact CG2-CD2 3.92Å; I472-F476 HydrophobicContact CG2-CE2 3.84Å; I472-F476 VanDerWaalsContact O-CD2 3.24Å; I472-F476 WeakPolarHBondContact O-CD2 3.15Å; I472-F476 PolarHBondContact O-N 3.18Å
473W97.6Very high95.6Very high163 Ų16369.6 Ų69.662%0.61734%0.344SS*.Hα-helixtrans-56.5-46.7176.2168.681.3000111.9I469 F470 A475 F476 A477I469-W473 PolarHBondContact O-N 3.35Å; F470-W473 AromaticContact CD2-CE3 3.84Å; F470-W473 HydrophobicContact CD2-CE3 3.84Å; F470-W473 HydrophobicContact CD2-CZ3 4.05Å; F470-W473 AromaticContact CE2-CE3 3.82Å; F470-W473 HydrophobicContact CE2-CE3 3.82Å; F470-W473 AromaticContact CE2-CZ3 3.56Å; F470-W473 HydrophobicContact CE2-CZ3 3.56Å; F470-W473 HydrophobicContact CZ-CZ3 4.35Å; F470-W473 PolarHBondContact O-N 2.92Å; W473-A475 VanDerWaalsContact C-N 3.34Å; W473-A475 PolarHBondContact O-N 3.21Å; W473-F476 PolarHBondContact O-N 3.41Å; W473-A477 HydrophobicContact CZ2-CB 4.48Å; W473-A477 WeakPolarHBondContact O-CB 3.34Å; W473-A477 PolarHBondContact O-N 3.45Å
474E97.9Very high94.7Very high32 Ų3273.9 Ų73.915%0.1536%0.36CS..Hα-helixtrans-62.8-39.5-178.5-170.1-73.1144.800111.5F470 M471 I472 A477 S478 R480F470-E474 HydrophobicContact CE1-CB 4.34Å; F470-E474 HydrophobicContact CE1-CG 4.4Å; F470-E474 HydrophobicContact CZ-CB 4.39Å; F470-E474 HydrophobicContact CZ-CG 4.31Å; F470-E474 WeakPolarHBondContact O-CB 3.24Å; F470-E474 PolarHBondContact O-N 2.7Å; M471-E474 PolarHBondContact O-N 2.97Å; I472-E474 VanDerWaalsContact C-N 3.32Å; I472-E474 PolarHBondContact O-N 3.26Å; E474-A477 PolarHBondContact O-N 3.41Å; E474-S478 VanDerWaalsContact O-CB 3.24Å; E474-S478 WeakPolarHBondContact O-CB 3.33Å; E474-S478 PolarHBondContact O-N 3.45Å; E474-S478 PolarHBondContact O-OG 2.85Å; E474-R480 IonicContact OE1-CZ 3.55Å; E474-R480 IonicContact OE1-NH1 2.66Å; E474-R480 PolarHBondContact OE1-NH1 3.43Å; E474-R480 IonicContact OE1-NH2 2.81Å; E474-R480 IonicContact OE2-CZ 3.4Å; E474-R480 IonicContact OE2-NH1 3.28Å; E474-R480 PolarHBondContact OE2-NH1 3.42Å; E474-R480 IonicContact OE2-NH2 3.6Å; E474-R480 PolarHBondContact OE2-NH2 3.04Å
475A97.1Very high93.8Very high0 Ų075.2 Ų75.20%037%0.368CS..Hα-helixtrans-64.4-41.6175.900000112.8F397 L405 M471 I472 W473 S478 K479F397-A475 HydrophobicContact CE1-CB 3.75Å; F397-A475 HydrophobicContact CZ-CB 3.87Å; L405-A475 HydrophobicContact CD2-CB 3.95Å; M471-A475 WeakPolarHBondContact O-CB 3.25Å; M471-A475 PolarHBondContact O-N 3.06Å; I472-A475 PolarHBondContact O-N 3.13Å; W473-A475 VanDerWaalsContact C-N 3.34Å; W473-A475 PolarHBondContact O-N 3.21Å; A475-S478 PolarHBondContact O-OG 3Å; A475-K479 PolarHBondContact O-N 2.92Å
476F96.8Very high92.5Very high99 Ų9978.3 Ų78.343%0.43438%0.381SS..Hα-helixtrans-74-28.5176.4-76.4-69.6000113.3F397 Y403 I472 W473 K479F397-F476 HydrophobicContact CE2-CE2 4.32Å; F397-F476 HydrophobicContact CZ-CE2 4.09Å; F397-F476 HydrophobicContact CZ-CZ 4.43Å; Y403-F476 AromaticContact CD2-CD1 3.63Å; Y403-F476 HydrophobicContact CD2-CD1 3.63Å; Y403-F476 AromaticContact CD2-CE1 3.69Å; Y403-F476 HydrophobicContact CD2-CE1 3.69Å; Y403-F476 AromaticContact CE2-CD1 3.62Å; Y403-F476 HydrophobicContact CE2-CD1 3.62Å; Y403-F476 AromaticContact CE2-CE1 3.82Å; Y403-F476 HydrophobicContact CE2-CE1 3.82Å; I472-F476 HydrophobicContact CG2-CD2 3.92Å; I472-F476 HydrophobicContact CG2-CE2 3.84Å; I472-F476 VanDerWaalsContact O-CD2 3.24Å; I472-F476 WeakPolarHBondContact O-CD2 3.15Å; I472-F476 PolarHBondContact O-N 3.18Å; W473-F476 PolarHBondContact O-N 3.41Å; F476-K479 VanDerWaalsContact O-CG 3.23Å; F476-K479 WeakPolarHBondContact O-CG 3.44Å
477A97.6Very high91Very high59 Ų5978.1 Ų78.149%0.48838%0.379SS..Hα-helixtrans-73.8-45.6174.900000111.8W473 E474W473-A477 HydrophobicContact CZ2-CB 4.48Å; W473-A477 WeakPolarHBondContact O-CB 3.34Å; W473-A477 PolarHBondContact O-N 3.45Å; E474-A477 PolarHBondContact O-N 3.41Å
478S95.7Very high89.2Confident47 Ų4779.6 Ų79.633%0.32939%0.39SS..Hα-helixtrans-75.7-25.9-179.563.10000113.4E474 A475 R480E474-S478 VanDerWaalsContact O-CB 3.24Å; E474-S478 WeakPolarHBondContact O-CB 3.33Å; E474-S478 PolarHBondContact O-N 3.45Å; E474-S478 PolarHBondContact O-OG 2.85Å; A475-S478 PolarHBondContact O-OG 3Å; S478-R480 PolarHBondContact O-N 3.26Å; S478-R480 VanDerWaalsContact OG-CZ 3.24Å; S478-R480 PolarHBondContact OG-NH1 3.13Å; S478-R480 VanDerWaalsContact OG-NH1 3.12Å; S478-R480 PolarHBondContact OG-NH2 2.97Å
479K94.3Very high87.5Confident130 Ų13083.5 Ų83.557%0.56542%0.419SS*.THydrogen-bonded Turntrans5335.6178.9-59.8-179.5-179.5174.60113.5Y403 A475 F476 K481Y403-K479 HydrophobicContact CD1-CB 4.25Å; Y403-K479 HydrophobicContact CE1-CB 3.65Å; Y403-K479 HydrophobicContact CE1-CG 4.11Å; A475-K479 PolarHBondContact O-N 2.92Å; F476-K479 VanDerWaalsContact O-CG 3.23Å; F476-K479 WeakPolarHBondContact O-CG 3.44Å; K479-K481 PolarHBondContact O-N 3.33Å
480R93.4Very high86.4Confident72 Ų7283.2 Ų83.227%0.27242%0.417SS..  trans-65.2103.9176.3-70.7-175.5-61.4-87.7-13.2110.1Y403 T404 E474 S478Y403-R480 CarbonylContact C-O 3.47Å; Y403-R480 WeakPolarHBondContact CA-O 3.3Å; T404-R480 PolarHBondContact N-O 3.04Å; T404-R480 PolarHBondContact O-NE 3.06Å; T404-R480 PolarHBondContact O-NH2 3.13Å; T404-R480 WeakPolarHBondContact OG1-CB 3.34Å; T404-R480 PolarHBondContact OG1-O 3.33Å; E474-R480 IonicContact OE1-CZ 3.55Å; E474-R480 IonicContact OE1-NH1 2.66Å; E474-R480 PolarHBondContact OE1-NH1 3.43Å; E474-R480 IonicContact OE1-NH2 2.81Å; E474-R480 IonicContact OE2-CZ 3.4Å; E474-R480 IonicContact OE2-NH1 3.28Å; E474-R480 PolarHBondContact OE2-NH1 3.42Å; E474-R480 IonicContact OE2-NH2 3.6Å; E474-R480 PolarHBondContact OE2-NH2 3.04Å; S478-R480 PolarHBondContact O-N 3.26Å; S478-R480 VanDerWaalsContact OG-CZ 3.24Å; S478-R480 PolarHBondContact OG-NH1 3.13Å; S478-R480 VanDerWaalsContact OG-NH1 3.12Å; S478-R480 PolarHBondContact OG-NH2 2.97Å
481K92Very high85.8Confident157 Ų15780.9 Ų80.968%0.68341%0.408SS*.BIsolated β-bridgetrans-74.2153.4-179.5-65.3-173179.4-177.30112Y403 K479 L483Y403-K481 HydrophobicContact CD1-CG 4.44Å; Y403-K481 HydrophobicContact CE1-CG 4.3Å; K479-K481 PolarHBondContact O-N 3.33Å; K481-L483 PolarHBondContact O-N 3.36Å
482V88.1Confident85.4Confident39 Ų3982.2 Ų82.224%0.23642%0.415CS..  trans-66.1122.2169.5-172.40000109.2P398 G402 T404 V485 C498P398-V482 HydrophobicContact CB-CG2 3.59Å; G402-V482 PolarHBondContact O-N 2.99Å; T404-V482 HydrophobicContact CG2-CG2 4Å; V482-V485 HydrophobicContact CG1-CG2 4.04Å; V482-C498 HydrophobicContact CB-CB 4.33Å; V482-C498 HydrophobicContact CG2-CB 3.95Å
483L80.9Confident85.2Confident179 Ų17979.9 Ų79.994%0.93740%0.403SS*.  trans-85.6-45177.8-67.5174.3000111.9K481K481-L483 PolarHBondContact O-N 3.36Å
484M78.3Confident84.9Confident163 Ų16372.8 Ų72.880%0.80338%0.376SS*.  trans-152.2139.6-179.9-172.5174179.200109
485V79.4Confident84.5Confident28 Ų2875.6 Ų75.617%0.1739%0.392CS..  trans-93.1127.7168-177.50000107.8V482 W494V482-V485 HydrophobicContact CG1-CG2 4.04Å; V485-W494 HydrophobicContact CG1-CB 3.91Å; V485-W494 HydrophobicContact CG1-CD2 3.88Å; V485-W494 HydrophobicContact CG1-CE3 3.99Å; V485-W494 HydrophobicContact CG1-CG 3.84Å; V485-W494 HydrophobicContact CG2-CE3 4.08Å
486E69.1Low84.1Confident96 Ų9679.8 Ų79.845%0.44941%0.408SS..SBendtrans-72.9130.1175.1-62.8-175177.400108.8Y260 K333Y260-E486 WeakPolarHBondContact CE2-O 3.22Å; Y260-E486 PolarHBondContact OH-N 3.37Å; Y260-E486 PolarHBondContact OH-O 3.18Å; K333-E486 IonicContact NZ-OE1 3.63Å; K333-E486 PolarHBondContact NZ-OE1 2.83Å; K333-E486 IonicContact NZ-OE2 3.31Å; K333-E486 PolarHBondContact NZ-OE2 3.46Å
487E66.1Low83.7Confident108 Ų10876.5 Ų76.551%0.50540%0.403SS..  trans5759174.9-60.1-63.6159.700117.1S489E487-S489 PolarHBondContact O-N 3.21Å
488P61.2Low83.4Confident61 Ų6175.2 Ų75.240%0.39639%0.389SS..THydrogen-bonded Turntrans-70.1-17.7179.429.7-34.9000113.7M490P488-M490 VanDerWaalsContact C-N 3.27Å; P488-M490 PolarHBondContact O-N 2.93Å
489S62.4Low83.3Confident99 Ų9976.3 Ų76.369%0.69240%0.395SS*.THydrogen-bonded Turntrans-71.5-19-17368.30000114.4E487E487-S489 PolarHBondContact O-N 3.21Å
490M73.3Confident83.3Confident80 Ų8070.7 Ų70.739%0.39437%0.372SS..THydrogen-bonded Turntrans-103.4-19.4-175.5-57.3-174.9-165.200113.3K265 P488K265-M490 HydrophobicContact CB-SD 3.99Å; K265-M490 HydrophobicContact CD-CE 4.26Å; K265-M490 HydrophobicContact CD-SD 4.44Å; K265-M490 HydrophobicContact CG-CE 3.82Å; K265-M490 HydrophobicContact CG-SD 3.67Å; P488-M490 VanDerWaalsContact C-N 3.27Å; P488-M490 PolarHBondContact O-N 2.93Å
491N85.8Confident83.2Confident31 Ų3170.6 Ų70.617%0.16638%0.381CS..  trans-123.4103.2-173.2-66.5-58.7000109.5E493 W494N491-E493 PolarHBondContact O-N 3.24Å; N491-E493 VanDerWaalsContact O-N 3.17Å; N491-W494 PolarHBondContact O-N 3.47Å
492L89.6Confident83.1Confident30 Ų3068.7 Ų68.716%0.15737%0.37CS..G310 helixtrans-59.4-28.8-172.5-68.2179000113.3L85 M176 W494 L495 V509 M511L85-L492 WeakPolarHBondContact O-CB 3.36Å; M176-L492 HydrophobicContact CE-CD1 4.21Å; L492-W494 PolarHBondContact O-N 3.16Å; L492-L495 VanDerWaalsContact O-CB 3.28Å; L492-L495 WeakPolarHBondContact O-CB 3.39Å; L492-L495 PolarHBondContact O-N 2.95Å; L492-L495 VanDerWaalsContact O-N 3.14Å; L492-V509 HydrophobicContact CD2-CG1 3.89Å; L492-M511 HydrophobicContact CD1-SD 4.38Å
493E92.2Very high83.1Confident4 Ų472.9 Ų72.92%0.01939%0.387CS..G310 helixtrans-64.1-22.3-177.870.8-83.9-162.100113.6L85 M86 L399 N491L85-E493 HydrophobicContact CB-CB 3.85Å; L85-E493 HydrophobicContact CD1-CB 4.28Å; M86-E493 HydrophobicContact CE-CG 4.3Å; M86-E493 HydrophobicContact CG-CB 4.3Å; L399-E493 WeakPolarHBondContact CD1-O 3.41Å; L399-E493 HydrophobicContact CD2-CB 4.13Å; L399-E493 HydrophobicContact CD2-CG 4.13Å; N491-E493 PolarHBondContact O-N 3.24Å; N491-E493 VanDerWaalsContact O-N 3.17Å
494W91.6Very high83.5Confident14 Ų1464.4 Ų64.45%0.05334%0.343CS..G310 helixtrans-92.8-5179.4-56.898.4000114H395 W396 P398 L399 V485 N491 L492 Y496 G497 C498H395-W494 AromaticContact CE1-CZ2 3.91Å; H395-W494 AromaticContact NE2-CZ2 3.92Å; H395-W494 WeakPolarHBondContact O-CH2 3.39Å; W396-W494 AromaticContact CD1-CH2 4Å; W396-W494 AromaticContact CD1-CZ2 3.47Å; W396-W494 VanDerWaalsContact CD1-CZ2 3.47Å; W396-W494 HydrophobicContact CG-CZ2 4.44Å; W396-W494 AromaticContact NE1-CZ2 3.92Å; P398-W494 HydrophobicContact CB-CZ3 4.42Å; L399-W494 HydrophobicContact CB-CE3 4.21Å; L399-W494 HydrophobicContact CB-CH2 3.76Å; L399-W494 HydrophobicContact CB-CZ3 3.55Å; L399-W494 HydrophobicContact CD1-CE3 3.97Å; L399-W494 HydrophobicContact CD1-CZ3 4.18Å; L399-W494 HydrophobicContact CG-CZ3 4.38Å; V485-W494 HydrophobicContact CG1-CB 3.91Å; V485-W494 HydrophobicContact CG1-CD2 3.88Å; V485-W494 HydrophobicContact CG1-CE3 3.99Å; V485-W494 HydrophobicContact CG1-CG 3.84Å; V485-W494 HydrophobicContact CG2-CE3 4.08Å; N491-W494 PolarHBondContact O-N 3.47Å; L492-W494 PolarHBondContact O-N 3.16Å; W494-Y496 PolarHBondContact O-N 2.74Å; W494-G497 PolarHBondContact O-N 2.85Å; W494-C498 VanDerWaalsContact CE3-SG 3.56Å
495L89.1Confident84Confident92 Ų9257.1 Ų57.148%0.48231%0.306SS..THydrogen-bonded Turntrans-63.3-38.2-170.5-17664000113.3L492 G497 F505L492-L495 VanDerWaalsContact O-CB 3.28Å; L492-L495 WeakPolarHBondContact O-CB 3.39Å; L492-L495 PolarHBondContact O-N 2.95Å; L492-L495 VanDerWaalsContact O-N 3.14Å; L495-G497 VanDerWaalsContact C-N 3.35Å; L495-G497 PolarHBondContact O-N 3.09Å; L495-F505 HydrophobicContact CD2-CE1 4.44Å
496Y88.8Confident84.2Confident87 Ų8764 Ų6434%0.34134%0.337SS..THydrogen-bonded Turntrans-95.420.2-175.2-70.8-85.4000113.8W494 P500 P501 T504 F505W494-Y496 PolarHBondContact O-N 2.74Å; Y496-P500 WeakPolarHBondContact O-CA 3.33Å; Y496-P501 WeakPolarHBondContact O-CD 3.45Å; Y496-T504 HydrophobicContact CD1-CG2 4.16Å; Y496-T504 HydrophobicContact CD2-CG2 3.82Å; Y496-T504 HydrophobicContact CE2-CG2 4.47Å; Y496-T504 HydrophobicContact CG-CG2 3.64Å; Y496-F505 HydrophobicContact CD2-CE1 4.18Å; Y496-F505 HydrophobicContact CD2-CE2 4.37Å; Y496-F505 HydrophobicContact CD2-CZ 4.05Å; Y496-F505 AromaticContact CE2-CD1 3.55Å; Y496-F505 HydrophobicContact CE2-CD1 3.55Å; Y496-F505 HydrophobicContact CE2-CD2 4.32Å; Y496-F505 AromaticContact CE2-CE1 3.45Å; Y496-F505 HydrophobicContact CE2-CE1 3.45Å; Y496-F505 VanDerWaalsContact CE2-CE1 3.45Å; Y496-F505 HydrophobicContact CE2-CE2 4.18Å; Y496-F505 HydrophobicContact CE2-CG 4.03Å; Y496-F505 AromaticContact CE2-CZ 3.77Å; Y496-F505 HydrophobicContact CE2-CZ 3.77Å; Y496-F505 PolarHBondContact OH-N 2.87Å
497G88.4Confident84.8Confident31 Ų3166.9 Ų66.932%0.3235%0.35SS..  trans80.8-171.4176.700000114.4W494 L495W494-G497 PolarHBondContact O-N 2.85Å; L495-G497 VanDerWaalsContact C-N 3.35Å; L495-G497 PolarHBondContact O-N 3.09Å
498C92.4Very high85.3Confident31 Ų3166.7 Ų66.721%0.20936%0.358CS..SBendtrans-134.7104.7-170.7-67.70000110.6P398 G402 V482 W494P398-C498 WeakPolarHBondContact O-CB 3.47Å; G402-C498 VanDerWaalsContact CA-O 3.29Å; G402-C498 WeakPolarHBondContact CA-O 3.5Å; V482-C498 HydrophobicContact CB-CB 4.33Å; V482-C498 HydrophobicContact CG2-CB 3.95Å; W494-C498 VanDerWaalsContact CE3-SG 3.56Å
499P93.8Very high86Confident70 Ų7064.9 Ų64.946%0.45535%0.346SS..SBendcis-77.4155.9-5.534.6-35.2000112.4L399L399-P499 WeakPolarHBondContact O-CA 3.3Å
500P93.1Very high86.5Confident12 Ų1268.3 Ų68.38%0.07835%0.349CS..PPolyproline II helixtrans-66.9154.6173.827.9-34.1000111.7K13 W81 L85 L399 Y496 T504K13-P500 HydrophobicContact CD-CG 4.28Å; W81-P500 HydrophobicContact CZ3-CG 4.22Å; L85-P500 HydrophobicContact CD1-CG 4.39Å; L399-P500 HydrophobicContact CD1-CG 4.45Å; L399-P500 WeakPolarHBondContact O-CD 3.39Å; Y496-P500 WeakPolarHBondContact O-CA 3.33Å; P500-T504 HydrophobicContact CB-CG2 3.99Å
501P92.8Very high86.2Confident70 Ų7067.3 Ų67.346%0.45534%0.344SS..PPolyproline II helixtrans-59163.6172.4-20.131.9000112K13 Y496 H503K13-P501 PolarHBondContact NZ-O 3.38Å; Y496-P501 WeakPolarHBondContact O-CD 3.45Å; P501-H503 PolarHBondContact O-N 3.43Å
502Y88.8Confident85Confident117 Ų11774.5 Ų74.546%0.45937%0.374SS..SBendtrans-56.6-51179.1-67.9-72.4000112.1R5 N11 K13R5-Y502 PolarHBondContact NH1-OH 3.05Å; R5-Y502 PolarHBondContact NH2-OH 3.25Å; N11-Y502 PolarHBondContact ND2-O 3.47Å; K13-Y502 PolarHBondContact NZ-O 2.87Å
503H88.1Confident83.1Confident128 Ų12880.9 Ų80.959%0.59342%0.421SS*.SBendtrans-97.1128.3173.2-61.5-68.2000109.6P501P501-H503 PolarHBondContact O-N 3.43Å
504T89.7Confident82.7Confident1 Ų184.8 Ų84.81%0.00644%0.441CS..  trans-127.9158.3176.639.30000108.2K13 P90 Y496 P500 E506K13-T504 PolarHBondContact NZ-OG1 3.28Å; P90-T504 VanDerWaalsContact CA-O 3.24Å; P90-T504 WeakPolarHBondContact CA-O 3.27Å; P90-T504 WeakPolarHBondContact CB-O 3.22Å; Y496-T504 HydrophobicContact CD1-CG2 4.16Å; Y496-T504 HydrophobicContact CD2-CG2 3.82Å; Y496-T504 HydrophobicContact CE2-CG2 4.47Å; Y496-T504 HydrophobicContact CG-CG2 3.64Å; P500-T504 HydrophobicContact CB-CG2 3.99Å; T504-E506 PolarHBondContact O-N 3.34Å
505F89.1Confident82.2Confident9 Ų988.5 Ų88.54%0.03946%0.462CS..  trans58.644.8177.5-47.7-76.3000113.9L85 G88 A89 L495 Y496 E507 V509L85-F505 HydrophobicContact CD2-CE2 3.89Å; L85-F505 WeakPolarHBondContact O-CZ 3.4Å; G88-F505 WeakPolarHBondContact O-CB 3.48Å; G88-F505 WeakPolarHBondContact O-CG 3.49Å; A89-F505 WeakPolarHBondContact O-CD2 3.44Å; L495-F505 HydrophobicContact CD2-CE1 4.44Å; Y496-F505 HydrophobicContact CD2-CE1 4.18Å; Y496-F505 HydrophobicContact CD2-CE2 4.37Å; Y496-F505 HydrophobicContact CD2-CZ 4.05Å; Y496-F505 AromaticContact CE2-CD1 3.55Å; Y496-F505 HydrophobicContact CE2-CD1 3.55Å; Y496-F505 HydrophobicContact CE2-CD2 4.32Å; Y496-F505 AromaticContact CE2-CE1 3.45Å; Y496-F505 HydrophobicContact CE2-CE1 3.45Å; Y496-F505 VanDerWaalsContact CE2-CE1 3.45Å; Y496-F505 HydrophobicContact CE2-CE2 4.18Å; Y496-F505 HydrophobicContact CE2-CG 4.03Å; Y496-F505 AromaticContact CE2-CZ 3.77Å; Y496-F505 HydrophobicContact CE2-CZ 3.77Å; Y496-F505 PolarHBondContact OH-N 2.87Å; F505-E507 CarbonylContact C-O 3.57Å; F505-E507 PolarHBondContact O-N 3.46Å; F505-V509 HydrophobicContact CD1-CG2 3.15Å; F505-V509 HydrophobicContact CE1-CG2 3.27Å; F505-V509 HydrophobicContact CG-CG2 4.33Å
506E83.6Confident81.8Confident173 Ų17388.3 Ų88.381%0.80846%0.461SS*.SBendtrans-59.8-32.6170.9-66.5-174.2177.700111.5T504T504-E506 PolarHBondContact O-N 3.34Å
507E80.9Confident81.4Confident157 Ų15788.4 Ų88.473%0.73447%0.468SS*.SBendtrans-107.8141167.2-64.2-175.7174.300110.2F505 V509F505-E507 CarbonylContact C-O 3.57Å; F505-E507 PolarHBondContact O-N 3.46Å; E507-V509 PolarHBondContact O-N 3.25Å
508P77.3Confident81Confident103 Ų10391.9 Ų91.967%0.66948%0.477SS*.  trans-58.5135.4177.4-23.132.8000111.9F510P508-F510 PolarHBondContact O-N 2.92Å
509V76.1Confident80.2Confident24 Ų2496 Ų9615%0.14550%0.495CS..  trans-61.6125.3176.3-173.50000110P173 L492 F505 E507 M511P173-V509 HydrophobicContact CG-CB 4.46Å; L492-V509 HydrophobicContact CD2-CG1 3.89Å; F505-V509 HydrophobicContact CD1-CG2 3.15Å; F505-V509 HydrophobicContact CE1-CG2 3.27Å; F505-V509 HydrophobicContact CG-CG2 4.33Å; E507-V509 PolarHBondContact O-N 3.25Å; V509-M511 HydrophobicContact CG1-CG 4.48Å; V509-M511 HydrophobicContact CG1-SD 4.27Å; V509-M511 PolarHBondContact O-N 2.62Å
510F71.3Confident79.3Confident171 Ų17197.9 Ų97.975%0.7550%0.498SS*.  trans-75.8111.5169.2-173.9-98.9000110P508 K512P508-F510 PolarHBondContact O-N 2.92Å; F510-K512 HydrophobicContact CD1-CG 4.32Å; F510-K512 HydrophobicContact CE1-CG 3.66Å
511M67.3Low78.2Confident59 Ų59104.5 Ų104.529%0.29153%0.53SS..  trans-97.2121174.9-65.6-74.8-71.700109.1M176 L492 V509M176-M511 HydrophobicContact CE-CE 3.63Å; M176-M511 HydrophobicContact CE-SD 4.17Å; L492-M511 HydrophobicContact CD1-SD 4.38Å; V509-M511 HydrophobicContact CG1-CG 4.48Å; V509-M511 HydrophobicContact CG1-SD 4.27Å; V509-M511 PolarHBondContact O-N 2.62Å
512K61.7Low77Confident181 Ų181107.3 Ų107.379%0.78754%0.536SS*.  trans-77.5125.7164.2-77.8-173.2177.9178.60108F510F510-K512 HydrophobicContact CD1-CG 4.32Å; F510-K512 HydrophobicContact CE1-CG 3.66Å
513S50Low75.9Confident165 Ų165106.5 Ų106.5100%1.15454%0.543SS*.  trans-50.70-179.758.60000113.9

Retrieved 513 of 513 residues in 379.4 ms (Link to these results)