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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 A0A059S7W0, 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
1M81.5Confident93.7Very high195 Ų19584.8 Ų84.896%0.96141%0.414SS*.  0-58.60-158.8176.3-92.100112.9D4 R5M1-D4 WeakPolarHBondContact CA-OD2 3.36Å; M1-D4 PolarHBondContact N-OD2 2.97Å; M1-R5 WeakPolarHBondContact O-CB 3.23Å; M1-R5 PolarHBondContact O-N 2.71Å
2F91.9Very high94.1Very high150 Ų15077.8 Ų77.866%0.65838%0.379SS*.Hα-helixtrans-66.5-52177.2-179.9-89.7000112.9D4 R5 W6F2-D4 VanDerWaalsContact C-N 3.33Å; F2-D4 PolarHBondContact O-N 3.2Å; F2-R5 PolarHBondContact O-N 2.66Å; F2-W6 AromaticContact CD2-CD1 3.41Å; F2-W6 VanDerWaalsContact CD2-CD1 3.41Å; F2-W6 AromaticContact CD2-NE1 3.83Å; F2-W6 AromaticContact CE2-CD1 3.33Å; F2-W6 HydrophobicContact CE2-CG 4.22Å; F2-W6 AromaticContact CE2-NE1 3.72Å; F2-W6 AromaticContact CG-CD1 3.95Å; F2-W6 HydrophobicContact CZ-CB 4.47Å; F2-W6 AromaticContact CZ-CD1 3.81Å; F2-W6 HydrophobicContact CZ-CG 4.32Å; F2-W6 PolarHBondContact O-N 2.85Å
3A92.8Very high94.4Very high38 Ų3872.3 Ų72.331%0.31435%0.352SS..Hα-helixtrans-59.6-43.6179.600000111.9R5 W6 L7 F8A3-R5 VanDerWaalsContact C-N 3.34Å; A3-R5 PolarHBondContact O-N 3.19Å; A3-W6 PolarHBondContact O-N 3.4Å; A3-L7 HydrophobicContact CB-CD1 4.08Å; A3-L7 WeakPolarHBondContact O-CA 3.2Å; A3-L7 VanDerWaalsContact O-CB 3.31Å; A3-L7 WeakPolarHBondContact O-CB 3.26Å; A3-L7 PolarHBondContact O-N 2.87Å; A3-F8 PolarHBondContact O-N 2.98Å
4D92.6Very high94.7Very high100 Ų10067.8 Ų67.854%0.53533%0.331SS..Hα-helixtrans-61.5-42178.7-47.5-51.1000112M1 F2 F8 S9M1-D4 WeakPolarHBondContact CA-OD2 3.36Å; M1-D4 PolarHBondContact N-OD2 2.97Å; F2-D4 VanDerWaalsContact C-N 3.33Å; F2-D4 PolarHBondContact O-N 3.2Å; D4-F8 CarbonylContact O-C 3.24Å; D4-F8 VanDerWaalsContact O-C 3.24Å; D4-S9 PolarHBondContact O-N 3.44Å
5R93.1Very high94.9Very high97 Ų9763.3 Ų63.337%0.36631%0.309SS..Hα-helixtrans-71.5-43-179.2-175.7-179.3174.1-174.2-5.3112.9M1 F2 A3 S9 D14 Y502M1-R5 WeakPolarHBondContact O-CB 3.23Å; M1-R5 PolarHBondContact O-N 2.71Å; F2-R5 PolarHBondContact O-N 2.66Å; A3-R5 VanDerWaalsContact C-N 3.34Å; A3-R5 PolarHBondContact O-N 3.19Å; R5-S9 WeakPolarHBondContact O-CB 3.43Å; R5-S9 PolarHBondContact O-OG 3.32Å; R5-D14 VanDerWaalsContact CG-OD2 3.23Å; R5-D14 WeakPolarHBondContact CG-OD2 3.41Å; R5-D14 IonicContact CZ-OD1 3.43Å; R5-D14 IonicContact NE-OD1 2.79Å; R5-D14 PolarHBondContact NE-OD1 3.49Å; R5-D14 IonicContact NE-OD2 3.32Å; R5-D14 PolarHBondContact NE-OD2 3.48Å; R5-D14 IonicContact NH2-OD1 2.67Å; R5-D14 PolarHBondContact NH2-OD1 2.79Å; R5-Y502 WeakPolarHBondContact CD-OH 3.45Å; R5-Y502 PolarHBondContact NE-OH 3.5Å; R5-Y502 PolarHBondContact NH1-OH 2.81Å; R5-Y502 PolarHBondContact NH2-OH 2.9Å
6W95.7Very high95.2Very high53 Ų5359.3 Ų59.320%0.20129%0.289CS..Hα-helixtrans-105.8-38.1-168-62.2111.9000114.1F2 A3 D14 T17 L18F2-W6 AromaticContact CD2-CD1 3.41Å; F2-W6 VanDerWaalsContact CD2-CD1 3.41Å; F2-W6 AromaticContact CD2-NE1 3.83Å; F2-W6 AromaticContact CE2-CD1 3.33Å; F2-W6 HydrophobicContact CE2-CG 4.22Å; F2-W6 AromaticContact CE2-NE1 3.72Å; F2-W6 AromaticContact CG-CD1 3.95Å; F2-W6 HydrophobicContact CZ-CB 4.47Å; F2-W6 AromaticContact CZ-CD1 3.81Å; F2-W6 HydrophobicContact CZ-CG 4.32Å; F2-W6 PolarHBondContact O-N 2.85Å; A3-W6 PolarHBondContact O-N 3.4Å; W6-D14 HydrophobicContact CE3-CB 4.26Å; W6-D14 HydrophobicContact CZ3-CB 4.02Å; W6-T17 HydrophobicContact CH2-CG2 4.38Å; W6-T17 HydrophobicContact CZ3-CG2 4.33Å; W6-L18 HydrophobicContact CE3-CD1 4.49Å; W6-L18 HydrophobicContact CE3-CD2 3.92Å; W6-L18 HydrophobicContact CE3-CG 4.08Å; W6-L18 HydrophobicContact CZ3-CD2 4.47Å; W6-L18 HydrophobicContact CZ3-CG 4.46Å; W6-L18 WeakPolarHBondContact O-CD1 3.48Å
7L94.9Very high95.4Very high72 Ų7257.8 Ų57.838%0.37729%0.285SS..THydrogen-bonded Turntrans-86.7-44.5179.6-56.3179.4000111.1A3 N99 W103A3-L7 HydrophobicContact CB-CD1 4.08Å; A3-L7 WeakPolarHBondContact O-CA 3.2Å; A3-L7 VanDerWaalsContact O-CB 3.31Å; A3-L7 WeakPolarHBondContact O-CB 3.26Å; A3-L7 PolarHBondContact O-N 2.87Å; L7-N99 PolarHBondContact O-ND2 3.25Å; L7-N99 VanDerWaalsContact O-ND2 3.1Å; L7-W103 HydrophobicContact CD2-CH2 3.44Å; L7-W103 VanDerWaalsContact CD2-CH2 3.44Å; L7-W103 HydrophobicContact CD2-CZ2 3.46Å; L7-W103 VanDerWaalsContact CD2-CZ2 3.46Å; L7-W103 HydrophobicContact CD2-CZ3 4.5Å; L7-W103 PolarHBondContact O-NE1 3.28Å
8F96.8Very high95.5Very high145 Ų14555.9 Ų55.964%0.63628%0.276SS*.SBendtrans-102.226.1-179.8-52.3-48.4000112.7A3 D4A3-F8 PolarHBondContact O-N 2.98Å; D4-F8 CarbonylContact O-C 3.24Å; D4-F8 VanDerWaalsContact O-C 3.24Å
9S96.8Very high95.7Very high4 Ų453.6 Ų53.63%0.02826%0.263CS..  trans-58.9143.7-178.8-154.60000111.7D4 R5 N11 D14 N99D4-S9 PolarHBondContact O-N 3.44Å; R5-S9 WeakPolarHBondContact O-CB 3.43Å; R5-S9 PolarHBondContact O-OG 3.32Å; S9-N11 PolarHBondContact OG-N 3.48Å; S9-D14 WeakPolarHBondContact OG-CB 3.37Å; S9-N99 VanDerWaalsContact O-CB 3.3Å; S9-N99 WeakPolarHBondContact O-CB 3.37Å; S9-N99 VanDerWaalsContact O-CG 3.22Å; S9-N99 PolarHBondContact O-ND2 2.9Å
10T97Very high95.9Very high67 Ų6752.3 Ų52.341%0.41126%0.258SS..  trans-118.9-5.7162.755.20000111.9D91 P95 R96T10-D91 VanDerWaalsContact O-OD2 3.11Å; T10-P95 HydrophobicContact CG2-CB 4.25Å; T10-P95 WeakPolarHBondContact O-CB 3.44Å; T10-R96 HydrophobicContact CG2-CG 4.07Å
11N97.8Very high96Very high12 Ų1255.1 Ų55.16%0.06427%0.273CS..  trans-82.4126.9-174.9-172.6-74.8000110.8S9 K13 D14 I15 Y502S9-N11 PolarHBondContact OG-N 3.48Å; N11-K13 PolarHBondContact O-N 2.78Å; N11-K13 WeakPolarHBondContact OD1-CA 3.24Å; N11-K13 WeakPolarHBondContact OD1-CB 3.31Å; N11-K13 PolarHBondContact OD1-N 3.27Å; N11-D14 HydrophobicContact CB-CB 4.39Å; N11-D14 PolarHBondContact O-N 3.31Å; N11-I15 WeakPolarHBondContact O-CG1 3.48Å; N11-I15 PolarHBondContact O-N 3.49Å; N11-Y502 PolarHBondContact ND2-O 3.47Å
12H98.1Very high96.8Very high0 Ų047 Ų470%023%0.233CC..Hα-helixtrans-56.7-29.6178.970.7101.9000114.8G16 N80 P84 D91 M92H12-G16 WeakPolarHBondContact O-CA 3.2Å; H12-G16 PolarHBondContact O-N 3.34Å; H12-N80 PolarHBondContact ND1-O 3.05Å; H12-P84 HydrophobicContact CB-CG 4.24Å; H12-D91 VanDerWaalsContact CB-OD1 3.27Å; H12-D91 WeakPolarHBondContact CB-OD1 3.24Å; H12-D91 IonicContact CD2-OD1 4Å; H12-D91 PolarHBondContact CD2-OD1 3.37Å; H12-D91 VanDerWaalsContact CD2-OD1 3.29Å; H12-D91 IonicContact CG-OD1 2.61Å; H12-D91 PolarHBondContact N-OD1 2.67Å; H12-M92 HydrophobicContact CB-CG 3.8Å
13K98.3Very high97.1Very high7 Ų739.9 Ų39.93%0.0320%0.201CC..Hα-helixtrans-74.4-42.1179.6-55.9166-177.2148.50111.5N11 T17 W81 P500 P501 Y502 T504N11-K13 PolarHBondContact O-N 2.78Å; N11-K13 WeakPolarHBondContact OD1-CA 3.24Å; N11-K13 WeakPolarHBondContact OD1-CB 3.31Å; N11-K13 PolarHBondContact OD1-N 3.27Å; K13-T17 WeakPolarHBondContact O-CB 3.46Å; K13-T17 PolarHBondContact O-N 2.86Å; K13-T17 PolarHBondContact O-OG1 3.45Å; K13-W81 HydrophobicContact CB-CD2 4.2Å; K13-W81 HydrophobicContact CB-CE3 4.03Å; K13-W81 HydrophobicContact CB-CH2 3.73Å; K13-W81 HydrophobicContact CB-CZ2 3.88Å; K13-W81 HydrophobicContact CB-CZ3 3.8Å; K13-W81 HydrophobicContact CD-CZ3 4.09Å; K13-W81 HydrophobicContact CG-CD2 4.44Å; K13-W81 HydrophobicContact CG-CE3 3.88Å; K13-W81 HydrophobicContact CG-CH2 4.19Å; K13-W81 HydrophobicContact CG-CZ3 3.75Å; K13-W81 VanDerWaalsContact O-CE2 3.31Å; K13-W81 PolarHBondContact O-NE1 2.96Å; K13-W81 VanDerWaalsContact O-NE1 3.16Å; K13-P500 HydrophobicContact CD-CG 4.29Å; K13-P501 PolarHBondContact NZ-O 3.38Å; K13-Y502 PolarHBondContact NZ-O 3Å; K13-T504 PolarHBondContact NZ-OG1 2.86Å
14D98.3Very high97.4Very high9 Ų940.7 Ų40.75%0.04821%0.208CC..Hα-helixtrans-66-46.8175.7-74.6-28.2000110R5 W6 S9 N11 T17 L18R5-D14 VanDerWaalsContact CG-OD2 3.23Å; R5-D14 WeakPolarHBondContact CG-OD2 3.41Å; R5-D14 IonicContact CZ-OD1 3.43Å; R5-D14 IonicContact NE-OD1 2.79Å; R5-D14 PolarHBondContact NE-OD1 3.49Å; R5-D14 IonicContact NE-OD2 3.32Å; R5-D14 PolarHBondContact NE-OD2 3.48Å; R5-D14 IonicContact NH2-OD1 2.67Å; R5-D14 PolarHBondContact NH2-OD1 2.79Å; W6-D14 HydrophobicContact CE3-CB 4.26Å; W6-D14 HydrophobicContact CZ3-CB 4.02Å; S9-D14 WeakPolarHBondContact OG-CB 3.37Å; N11-D14 HydrophobicContact CB-CB 4.39Å; N11-D14 PolarHBondContact O-N 3.31Å; D14-T17 WeakPolarHBondContact O-CB 3.37Å; D14-T17 PolarHBondContact O-N 3.45Å; D14-T17 VanDerWaalsContact O-N 3.16Å; D14-L18 WeakPolarHBondContact O-CG 3.36Å; D14-L18 PolarHBondContact O-N 2.86Å
15I98.6Very high97.6Very high0 Ų043.2 Ų43.20%021%0.21CC..Hα-helixtrans-62.6-44.7176.6-64.2165.6000111.1N11 T17 L18 Y19 N98 N99 F102N11-I15 WeakPolarHBondContact O-CG1 3.48Å; N11-I15 PolarHBondContact O-N 3.49Å; I15-T17 VanDerWaalsContact C-N 3.26Å; I15-T17 PolarHBondContact O-N 3.08Å; I15-L18 WeakPolarHBondContact O-CB 3.28Å; I15-L18 PolarHBondContact O-N 2.99Å; I15-L18 VanDerWaalsContact O-N 3.11Å; I15-Y19 HydrophobicContact CG2-CD2 3.84Å; I15-Y19 HydrophobicContact CG2-CE2 3.66Å; I15-Y19 VanDerWaalsContact O-CD2 3.3Å; I15-Y19 WeakPolarHBondContact O-CD2 3.13Å; I15-Y19 PolarHBondContact O-N 2.79Å; I15-N98 HydrophobicContact CD1-CB 4.07Å; I15-N99 HydrophobicContact CD1-CB 3.95Å; I15-F102 HydrophobicContact CG2-CB 4.13Å
16G98.4Very high97.9Very high0 Ų038.6 Ų38.60%019%0.193CC..Hα-helixtrans-59.1-37174.400000112.5H12 Y19 L20 G77 W81H12-G16 WeakPolarHBondContact O-CA 3.2Å; H12-G16 PolarHBondContact O-N 3.34Å; G16-Y19 PolarHBondContact O-N 3.48Å; G16-L20 WeakPolarHBondContact O-CG 3.27Å; G16-L20 PolarHBondContact O-N 3.2Å; G16-G77 WeakPolarHBondContact O-CA 3.33Å; G16-W81 VanDerWaalsContact C-CD1 3.47Å
17T98.5Very high98Very high34 Ų3436.5 Ų36.521%0.20919%0.187CC..Hα-helixtrans-65.6-41.8174.1-56.70000111.8W6 K13 D14 I15 Y19 L20 L21 W81W6-T17 HydrophobicContact CH2-CG2 4.38Å; W6-T17 HydrophobicContact CZ3-CG2 4.33Å; K13-T17 WeakPolarHBondContact O-CB 3.46Å; K13-T17 PolarHBondContact O-N 2.86Å; K13-T17 PolarHBondContact O-OG1 3.45Å; D14-T17 WeakPolarHBondContact O-CB 3.37Å; D14-T17 PolarHBondContact O-N 3.45Å; D14-T17 VanDerWaalsContact O-N 3.16Å; I15-T17 VanDerWaalsContact C-N 3.26Å; I15-T17 PolarHBondContact O-N 3.08Å; T17-Y19 VanDerWaalsContact C-N 3.33Å; T17-Y19 PolarHBondContact O-N 3.3Å; T17-L20 PolarHBondContact O-N 3.39Å; T17-L21 HydrophobicContact CG2-CD1 4.17Å; T17-L21 HydrophobicContact CG2-CG 4.41Å; T17-L21 WeakPolarHBondContact O-CG 3.23Å; T17-L21 PolarHBondContact O-N 3.41Å; T17-W81 VanDerWaalsContact OG1-CZ2 3.25Å; T17-W81 WeakPolarHBondContact OG1-CZ2 3.32Å; T17-W81 PolarHBondContact OG1-NE1 3.02Å; T17-W81 VanDerWaalsContact OG1-NE1 3.08Å
18L98.7Very high98.1Very high24 Ų2436.6 Ų36.613%0.12619%0.19CC..Hα-helixtrans-60.4-42.9175.8-68.6174000111.7W6 D14 I15 L21 F22 F102W6-L18 HydrophobicContact CE3-CD1 4.49Å; W6-L18 HydrophobicContact CE3-CD2 3.92Å; W6-L18 HydrophobicContact CE3-CG 4.08Å; W6-L18 HydrophobicContact CZ3-CD2 4.47Å; W6-L18 HydrophobicContact CZ3-CG 4.46Å; W6-L18 WeakPolarHBondContact O-CD1 3.48Å; D14-L18 WeakPolarHBondContact O-CG 3.36Å; D14-L18 PolarHBondContact O-N 2.86Å; I15-L18 WeakPolarHBondContact O-CB 3.28Å; I15-L18 PolarHBondContact O-N 2.99Å; I15-L18 VanDerWaalsContact O-N 3.11Å; L18-L21 PolarHBondContact O-N 3Å; L18-F22 VanDerWaalsContact O-CB 3.27Å; L18-F22 WeakPolarHBondContact O-CB 3.21Å; L18-F22 PolarHBondContact O-N 3.49Å; L18-F102 VanDerWaalsContact C-CE2 3.46Å; L18-F102 HydrophobicContact CB-CD1 4.08Å; L18-F102 HydrophobicContact CB-CD2 3.98Å; L18-F102 HydrophobicContact CB-CE1 3.76Å; L18-F102 HydrophobicContact CB-CE2 3.65Å; L18-F102 HydrophobicContact CB-CG 4.19Å; L18-F102 HydrophobicContact CB-CZ 3.56Å; L18-F102 HydrophobicContact CD1-CD1 3.9Å; L18-F102 HydrophobicContact CD1-CE1 3.82Å; L18-F102 HydrophobicContact CD1-CZ 4.46Å; L18-F102 HydrophobicContact CD2-CE1 4.48Å; L18-F102 HydrophobicContact CG-CE1 4.24Å; L18-F102 HydrophobicContact CG-CZ 4.4Å; L18-F102 WeakPolarHBondContact O-CE2 3.43Å
19Y98.8Very high98.2Very high11 Ų1131.6 Ų31.64%0.04317%0.17CC..Hα-helixtrans-60.2-44.6173.5-85.5-73.3000112.8I15 G16 T17 G23 P72 G76 S101 F102 L105I15-Y19 HydrophobicContact CG2-CD2 3.84Å; I15-Y19 HydrophobicContact CG2-CE2 3.66Å; I15-Y19 VanDerWaalsContact O-CD2 3.3Å; I15-Y19 WeakPolarHBondContact O-CD2 3.13Å; I15-Y19 PolarHBondContact O-N 2.79Å; G16-Y19 PolarHBondContact O-N 3.48Å; T17-Y19 VanDerWaalsContact C-N 3.33Å; T17-Y19 PolarHBondContact O-N 3.3Å; Y19-G23 PolarHBondContact O-N 2.8Å; Y19-P72 HydrophobicContact CD1-CB 4.04Å; Y19-G76 VanDerWaalsContact CB-C 3.41Å; Y19-G76 VanDerWaalsContact CD2-O 3.28Å; Y19-G76 WeakPolarHBondContact CD2-O 3.35Å; Y19-G76 VanDerWaalsContact CG-C 3.42Å; Y19-G76 VanDerWaalsContact CG-CA 3.45Å; Y19-S101 WeakPolarHBondContact OH-CB 3.5Å; Y19-S101 PolarHBondContact OH-O 3.34Å; Y19-S101 PolarHBondContact OH-OG 2.96Å; Y19-F102 AromaticContact CD1-CD2 3.93Å; Y19-F102 HydrophobicContact CD1-CD2 3.93Å; Y19-F102 HydrophobicContact CD2-CB 4.26Å; Y19-F102 HydrophobicContact CD2-CD2 4.04Å; Y19-F102 HydrophobicContact CE1-CB 4.43Å; Y19-F102 HydrophobicContact CE1-CD2 4.13Å; Y19-F102 HydrophobicContact CE2-CB 3.68Å; Y19-F102 HydrophobicContact CE2-CD2 4.21Å; Y19-F102 HydrophobicContact CE2-CG 4.4Å; Y19-F102 AromaticContact CG-CD2 3.9Å; Y19-F102 HydrophobicContact CG-CD2 3.9Å; Y19-F102 WeakPolarHBondContact OH-CA 3.41Å; Y19-F102 PolarHBondContact OH-N 3.27Å; Y19-F102 VanDerWaalsContact OH-N 3.07Å; Y19-L105 HydrophobicContact CD1-CD1 3.9Å; Y19-L105 HydrophobicContact CE1-CD1 3.44Å; Y19-L105 VanDerWaalsContact CE1-CD1 3.44Å
20L98.6Very high98.3Very high28 Ų2831.4 Ų31.415%0.14717%0.169CC..Hα-helixtrans-62.7-43.9177.8-70.1175000111.9G16 T17 A24 I73 F78 F400G16-L20 WeakPolarHBondContact O-CG 3.27Å; G16-L20 PolarHBondContact O-N 3.2Å; T17-L20 PolarHBondContact O-N 3.39Å; L20-A24 VanDerWaalsContact O-CB 3.25Å; L20-A24 WeakPolarHBondContact O-CB 3.38Å; L20-A24 PolarHBondContact O-N 3.19Å; L20-I73 HydrophobicContact CD2-CG2 3.95Å; L20-F78 HydrophobicContact CD2-CE2 4.45Å; L20-F400 HydrophobicContact CD1-CD2 4.08Å; L20-F400 HydrophobicContact CD1-CE2 4.06Å
21L98.5Very high98.3Very high111 Ų11129.5 Ų29.558%0.58116%0.157SC*.Hα-helixtrans-66.4-46178.4-69.5175.3000111.9T17 L18 A24 W25T17-L21 HydrophobicContact CG2-CD1 4.17Å; T17-L21 HydrophobicContact CG2-CG 4.41Å; T17-L21 WeakPolarHBondContact O-CG 3.23Å; T17-L21 PolarHBondContact O-N 3.41Å; L18-L21 PolarHBondContact O-N 3Å; L21-A24 PolarHBondContact O-N 3.42Å; L21-W25 PolarHBondContact O-N 2.97Å
22F98.8Very high98.3Very high26 Ų2631.2 Ų31.211%0.11417%0.173CC..Hα-helixtrans-59.6-49.8176.7174.9-96.3000111.4L18 A24 W25 A26 F68 P72 F102 L105 P106 L109L18-F22 VanDerWaalsContact O-CB 3.27Å; L18-F22 WeakPolarHBondContact O-CB 3.21Å; L18-F22 PolarHBondContact O-N 3.49Å; F22-A24 VanDerWaalsContact C-N 3.34Å; F22-A24 PolarHBondContact O-N 3.4Å; F22-W25 PolarHBondContact O-N 3.49Å; F22-A26 WeakPolarHBondContact O-CB 2.97Å; F22-A26 PolarHBondContact O-N 3.34Å; F22-F68 HydrophobicContact CE1-CB 4.18Å; F22-F68 AromaticContact CE1-CD1 3.94Å; F22-F68 HydrophobicContact CE1-CD1 3.94Å; F22-F68 HydrophobicContact CZ-CB 4.44Å; F22-F68 AromaticContact CZ-CD1 3.75Å; F22-F68 HydrophobicContact CZ-CD1 3.75Å; F22-P72 HydrophobicContact CD1-CB 4.13Å; F22-P72 HydrophobicContact CD1-CG 4.31Å; F22-P72 HydrophobicContact CE1-CG 4.22Å; F22-F102 HydrophobicContact CB-CE2 3.89Å; F22-F102 HydrophobicContact CB-CZ 4.41Å; F22-F102 HydrophobicContact CG-CE2 4.37Å; F22-L105 HydrophobicContact CD1-CB 4.45Å; F22-L105 HydrophobicContact CD1-CD1 4.29Å; F22-L105 HydrophobicContact CE1-CB 3.84Å; F22-L105 HydrophobicContact CE1-CD1 4.09Å; F22-L105 HydrophobicContact CE2-CB 4.49Å; F22-L105 HydrophobicContact CZ-CB 3.84Å; F22-P106 HydrophobicContact CD2-CG 4.33Å; F22-P106 HydrophobicContact CE2-CB 4.46Å; F22-P106 HydrophobicContact CE2-CG 4.23Å; F22-L109 HydrophobicContact CE2-CB 4.28Å; F22-L109 HydrophobicContact CE2-CD2 3.69Å; F22-L109 HydrophobicContact CZ-CB 3.95Å; F22-L109 HydrophobicContact CZ-CD2 3.64Å; F22-L109 HydrophobicContact CZ-CG 4.45Å
23G98.5Very high98.3Very high0 Ų032.4 Ų32.40%018%0.179CC..Hα-helixtrans-65.5-35.2-18000000113.2Y19 G27 F68 M69Y19-G23 PolarHBondContact O-N 2.8Å; G23-G27 PolarHBondContact O-N 3.03Å; G23-F68 WeakPolarHBondContact CA-O 3.33Å; G23-M69 WeakPolarHBondContact O-CG 3.31Å
24A97.9Very high98.3Very high54 Ų5433.3 Ų33.345%0.44619%0.187SC..Hα-helixtrans-64.5-44173.100000111.8L20 L21 F22 G27 V28L20-A24 VanDerWaalsContact O-CB 3.25Å; L20-A24 WeakPolarHBondContact O-CB 3.38Å; L20-A24 PolarHBondContact O-N 3.19Å; L21-A24 PolarHBondContact O-N 3.42Å; F22-A24 VanDerWaalsContact C-N 3.34Å; F22-A24 PolarHBondContact O-N 3.4Å; A24-G27 PolarHBondContact O-N 3.41Å; A24-V28 PolarHBondContact O-N 3.4Å; A24-V28 VanDerWaalsContact O-N 3.1Å
25W98.3Very high98.3Very high154 Ų15434 Ų3458%0.58319%0.19SC*.Hα-helixtrans-62.7-48.1176.3-174.490.7000111.7L21 F22 G27 V28 L29 L109 L113L21-W25 PolarHBondContact O-N 2.97Å; F22-W25 PolarHBondContact O-N 3.49Å; W25-G27 VanDerWaalsContact C-N 3.27Å; W25-G27 PolarHBondContact O-N 2.98Å; W25-V28 PolarHBondContact O-N 3.04Å; W25-L29 HydrophobicContact CH2-CD2 4.23Å; W25-L29 HydrophobicContact CZ3-CD2 3.88Å; W25-L29 PolarHBondContact O-N 3.38Å; W25-L29 VanDerWaalsContact O-N 3.16Å; W25-L109 HydrophobicContact CE3-CD2 4.06Å; W25-L109 HydrophobicContact CZ3-CD2 3.68Å; W25-L113 HydrophobicContact CH2-CD1 4.44Å
26A98.6Very high98.3Very high0 Ų038 Ų380%021%0.211CC..Hα-helixtrans-61.2-36.2175.400000111.8F22 L29 G30 V64 F68 L109F22-A26 WeakPolarHBondContact O-CB 2.97Å; F22-A26 PolarHBondContact O-N 3.34Å; A26-L29 WeakPolarHBondContact O-CB 3.29Å; A26-L29 PolarHBondContact O-N 2.73Å; A26-G30 PolarHBondContact O-N 3.35Å; A26-V64 HydrophobicContact CB-CG1 4.27Å; A26-V64 WeakPolarHBondContact O-CG1 3.46Å; A26-F68 HydrophobicContact CB-CB 3.88Å; A26-F68 VanDerWaalsContact CB-O 3.3Å; A26-F68 WeakPolarHBondContact CB-O 3.33Å; A26-L109 HydrophobicContact CB-CD2 4.32Å
27G97.7Very high98.3Very high8 Ų838.9 Ų38.98%0.08222%0.215CC..Hα-helixtrans-63-39.7175.200000113.7G23 A24 W25 G30 T31G23-G27 PolarHBondContact O-N 3.03Å; A24-G27 PolarHBondContact O-N 3.41Å; W25-G27 VanDerWaalsContact C-N 3.27Å; W25-G27 PolarHBondContact O-N 2.98Å; G27-G30 PolarHBondContact O-N 3.26Å; G27-T31 WeakPolarHBondContact O-CB 3.2Å; G27-T31 PolarHBondContact O-N 3.05Å; G27-T31 PolarHBondContact O-OG1 3.4Å
28V97.9Very high98.2Very high74 Ų7437.9 Ų37.945%0.44821%0.208SC..Hα-helixtrans-64.3-44.3174174.10000110.4A24 W25 T31 A32A24-V28 PolarHBondContact O-N 3.4Å; A24-V28 VanDerWaalsContact O-N 3.1Å; W25-V28 PolarHBondContact O-N 3.04Å; V28-T31 PolarHBondContact O-N 3.19Å; V28-A32 PolarHBondContact O-N 3.44Å
29L98.4Very high98.2Very high40 Ų4038.2 Ų38.221%0.20921%0.214CC..Hα-helixtrans-59.5-48.6174.3168.965.5000111.8W25 A26 T31 A32 L33 V64 L113W25-L29 HydrophobicContact CH2-CD2 4.23Å; W25-L29 HydrophobicContact CZ3-CD2 3.88Å; W25-L29 PolarHBondContact O-N 3.38Å; W25-L29 VanDerWaalsContact O-N 3.16Å; A26-L29 WeakPolarHBondContact O-CB 3.29Å; A26-L29 PolarHBondContact O-N 2.73Å; L29-T31 VanDerWaalsContact C-N 3.29Å; L29-T31 PolarHBondContact O-N 3.45Å; L29-A32 WeakPolarHBondContact O-CB 3.44Å; L29-A32 PolarHBondContact O-N 2.84Å; L29-A32 VanDerWaalsContact O-N 3.15Å; L29-L33 WeakPolarHBondContact O-CG 3.07Å; L29-L33 PolarHBondContact O-N 2.98Å; L29-V64 HydrophobicContact CD2-CG1 4.27Å; L29-V64 HydrophobicContact CD2-CG2 4.19Å; L29-V64 HydrophobicContact CG-CG1 4.3Å; L29-L113 HydrophobicContact CD2-CD1 4.15Å; L29-L113 HydrophobicContact CD2-CD2 3.87Å; L29-L113 HydrophobicContact CD2-CG 4.48Å
30G98.1Very high98.1Very high0 Ų037.8 Ų37.80%021%0.213CC..Hα-helixtrans-62.5-35.6178.300000112.8A26 G27 L33 S34 H61A26-G30 PolarHBondContact O-N 3.35Å; G27-G30 PolarHBondContact O-N 3.26Å; G30-L33 PolarHBondContact O-N 3.37Å; G30-S34 PolarHBondContact O-N 3.49Å; G30-H61 PolarHBondContact O-ND1 3.49Å
31T97.1Very high98.1Very high28 Ų2836.5 Ų36.517%0.17221%0.206CC..Hα-helixtrans-68.8-39.1173.4-56.10000111.6G27 V28 L29 L33 S34 L35 V465G27-T31 WeakPolarHBondContact O-CB 3.2Å; G27-T31 PolarHBondContact O-N 3.05Å; G27-T31 PolarHBondContact O-OG1 3.4Å; V28-T31 PolarHBondContact O-N 3.19Å; L29-T31 VanDerWaalsContact C-N 3.29Å; L29-T31 PolarHBondContact O-N 3.45Å; T31-L33 VanDerWaalsContact C-N 3.31Å; T31-L33 PolarHBondContact O-N 2.72Å; T31-S34 PolarHBondContact O-N 2.9Å; T31-S34 PolarHBondContact O-OG 3.39Å; T31-L35 HydrophobicContact CG2-CD1 4.24Å; T31-L35 VanDerWaalsContact O-CG 3.29Å; T31-L35 WeakPolarHBondContact O-CG 3.46Å; T31-L35 PolarHBondContact O-N 2.97Å; T31-V465 HydrophobicContact CG2-CG2 4.33Å
32A98.3Very high97.9Very high48 Ų4832.1 Ų32.140%0.39719%0.187SC..Hα-helixtrans-61-42.3174.400000111.3V28 L29 L35 L36V28-A32 PolarHBondContact O-N 3.44Å; L29-A32 WeakPolarHBondContact O-CB 3.44Å; L29-A32 PolarHBondContact O-N 2.84Å; L29-A32 VanDerWaalsContact O-N 3.15Å; A32-L35 PolarHBondContact O-N 3.01Å; A32-L36 WeakPolarHBondContact O-CG 3.39Å; A32-L36 PolarHBondContact O-N 3.4Å; A32-L36 VanDerWaalsContact O-N 3.14Å
33L98.4Very high97.7Very high25 Ų2536.8 Ų36.813%0.13121%0.21CC..Hα-helixtrans-64-40.7174.9-63.1170.4000112L29 G30 T31 L35 L36 I37 I57 A60 H61 V64L29-L33 WeakPolarHBondContact O-CG 3.07Å; L29-L33 PolarHBondContact O-N 2.98Å; G30-L33 PolarHBondContact O-N 3.37Å; T31-L33 VanDerWaalsContact C-N 3.31Å; T31-L33 PolarHBondContact O-N 2.72Å; L33-L35 VanDerWaalsContact C-N 3.31Å; L33-L35 PolarHBondContact O-N 3.27Å; L33-L36 PolarHBondContact O-N 2.82Å; L33-I37 WeakPolarHBondContact O-CG1 3.47Å; L33-I37 PolarHBondContact O-N 2.84Å; L33-I37 VanDerWaalsContact O-N 3.11Å; L33-I57 HydrophobicContact CB-CG2 4.07Å; L33-I57 HydrophobicContact CD2-CG2 4Å; L33-I57 WeakPolarHBondContact O-CG2 3.41Å; L33-A60 HydrophobicContact CD1-CB 3.85Å; L33-H61 HydrophobicContact CB-CB 3.86Å; L33-H61 HydrophobicContact CD1-CB 4.46Å; L33-V64 HydrophobicContact CD1-CG2 4.37Å
34S98.1Very high97.5Very high26 Ų2638.7 Ų38.718%0.18222%0.222CC..Hα-helixtrans-65.5-34.4177.276.90000113G30 T31 I37 R38 H61G30-S34 PolarHBondContact O-N 3.49Å; T31-S34 PolarHBondContact O-N 2.9Å; T31-S34 PolarHBondContact O-OG 3.39Å; S34-I37 WeakPolarHBondContact O-CB 3.35Å; S34-I37 PolarHBondContact O-N 2.99Å; S34-R38 WeakPolarHBondContact O-CG 3.32Å; S34-R38 PolarHBondContact O-N 3.15Å; S34-H61 VanDerWaalsContact CB-CE1 3.45Å; S34-H61 WeakPolarHBondContact CB-CE1 3.49Å
35L97.9Very high97.2Very high24 Ų2437.6 Ų37.613%0.12622%0.216CC..Hα-helixtrans-66.7-38.3174.8-71.8164.7000112T31 A32 L33 I37 R38 A39 F459 L462T31-L35 HydrophobicContact CG2-CD1 4.24Å; T31-L35 VanDerWaalsContact O-CG 3.29Å; T31-L35 WeakPolarHBondContact O-CG 3.46Å; T31-L35 PolarHBondContact O-N 2.97Å; A32-L35 PolarHBondContact O-N 3.01Å; L33-L35 VanDerWaalsContact C-N 3.31Å; L33-L35 PolarHBondContact O-N 3.27Å; L35-I37 VanDerWaalsContact C-N 3.34Å; L35-R38 PolarHBondContact O-N 3.25Å; L35-A39 WeakPolarHBondContact O-CB 3.4Å; L35-A39 PolarHBondContact O-N 3.41Å; L35-F459 HydrophobicContact CD2-CD1 4.24Å; L35-F459 HydrophobicContact CD2-CE1 4.4Å; L35-L462 HydrophobicContact CD1-CB 4.16Å; L35-L462 HydrophobicContact CD1-CD1 3.82Å; L35-L462 HydrophobicContact CD1-CD2 3.74Å; L35-L462 HydrophobicContact CD1-CG 4.09Å; L35-L462 HydrophobicContact CD2-CB 4.1Å; L35-L462 HydrophobicContact CD2-CD2 4.32Å
36L98.1Very high96.7Very high82 Ų8234.2 Ų34.243%0.42921%0.209SC..Hα-helixtrans-62.6-42.9173.3-67.2175.1000111.2A32 L33 R38 A39 E40 I57A32-L36 WeakPolarHBondContact O-CG 3.39Å; A32-L36 PolarHBondContact O-N 3.4Å; A32-L36 VanDerWaalsContact O-N 3.14Å; L33-L36 PolarHBondContact O-N 2.82Å; L36-R38 PolarHBondContact O-N 2.98Å; L36-A39 PolarHBondContact O-N 3.04Å; L36-E40 PolarHBondContact O-N 3.26Å; L36-I57 HydrophobicContact CB-CD1 4.42Å; L36-I57 HydrophobicContact CB-CG2 4.26Å; L36-I57 HydrophobicContact CD1-CD1 4.2Å
37I98.4Very high96.4Very high19 Ų1939.4 Ų39.410%0.09724%0.236CC..Hα-helixtrans-59.6-46175.2-64164.1000110.7L33 S34 L35 E40 L41 Y54 I57 V58 H61L33-I37 WeakPolarHBondContact O-CG1 3.47Å; L33-I37 PolarHBondContact O-N 2.84Å; L33-I37 VanDerWaalsContact O-N 3.11Å; S34-I37 WeakPolarHBondContact O-CB 3.35Å; S34-I37 PolarHBondContact O-N 2.99Å; L35-I37 VanDerWaalsContact C-N 3.34Å; I37-E40 PolarHBondContact O-N 2.89Å; I37-L41 HydrophobicContact CG2-CD1 4.02Å; I37-L41 WeakPolarHBondContact O-CG 3.08Å; I37-L41 PolarHBondContact O-N 3.3Å; I37-Y54 HydrophobicContact CB-CE2 4.41Å; I37-Y54 HydrophobicContact CG1-CE2 4.49Å; I37-Y54 HydrophobicContact CG2-CE2 3.89Å; I37-I57 HydrophobicContact CD1-CG2 4.13Å; I37-I57 HydrophobicContact CG1-CG2 3.71Å; I37-V58 HydrophobicContact CD1-CB 4.31Å; I37-V58 HydrophobicContact CD1-CG2 3.78Å; I37-V58 HydrophobicContact CG1-CG2 3.89Å; I37-V58 HydrophobicContact CG2-CG2 4.4Å; I37-H61 HydrophobicContact CD1-CB 3.91Å
38R97.9Very high96.2Very high13 Ų1342 Ų425%0.04925%0.248CC..Hα-helixtrans-74.8-27.4-179.5-68-47.1-491698.8113.5S34 L35 L36 G42 N451 S454 S455S34-R38 WeakPolarHBondContact O-CG 3.32Å; S34-R38 PolarHBondContact O-N 3.15Å; L35-R38 PolarHBondContact O-N 3.25Å; L36-R38 PolarHBondContact O-N 2.98Å; R38-G42 PolarHBondContact O-N 3.09Å; R38-G42 VanDerWaalsContact O-N 3.09Å; R38-N451 PolarHBondContact NH2-O 3.05Å; R38-N451 PolarHBondContact NH2-OD1 3.45Å; R38-N451 VanDerWaalsContact NH2-OD1 3.08Å; R38-S454 VanDerWaalsContact CZ-OG 3.3Å; R38-S454 PolarHBondContact NH2-OG 3.47Å; R38-S455 PolarHBondContact NE-OG 3Å; R38-S455 PolarHBondContact NH2-OG 3.46Å; R38-S455 WeakPolarHBondContact O-CB 3.37Å; R38-S455 PolarHBondContact O-OG 2.93Å
39A97.1Very high96Very high31 Ų3141.2 Ų41.226%0.25626%0.255SS..Hα-helixtrans-68.2-45171.800000110.6L35 L36 L41 G42 L47 F459L35-A39 WeakPolarHBondContact O-CB 3.4Å; L35-A39 PolarHBondContact O-N 3.41Å; L36-A39 PolarHBondContact O-N 3.04Å; A39-L41 VanDerWaalsContact C-N 3.33Å; A39-L41 PolarHBondContact O-N 2.82Å; A39-G42 PolarHBondContact O-N 2.61Å; A39-G42 VanDerWaalsContact O-N 3.15Å; A39-L47 HydrophobicContact CB-CD2 4Å; A39-F459 HydrophobicContact CB-CZ 4.49Å
40E97.6Very high95.8Very high3 Ų342.7 Ų42.71%0.01426%0.263CS..Hα-helixtrans-56.1-50.2173.7-171.165-16500110.5L36 I37 G42 N46 L47 L48 Y54L36-E40 PolarHBondContact O-N 3.26Å; I37-E40 PolarHBondContact O-N 2.89Å; E40-G42 PolarHBondContact O-N 2.64Å; E40-G42 VanDerWaalsContact O-N 3.17Å; E40-N46 WeakPolarHBondContact OE1-CA 3.42Å; E40-L47 PolarHBondContact OE1-N 3.46Å; E40-L47 WeakPolarHBondContact OE2-CA 3.16Å; E40-L47 VanDerWaalsContact OE2-CB 3.23Å; E40-L47 WeakPolarHBondContact OE2-CB 3.37Å; E40-L47 PolarHBondContact OE2-N 3.36Å; E40-L48 HydrophobicContact CB-CD1 4.36Å; E40-L48 HydrophobicContact CG-CD1 4.33Å; E40-L48 PolarHBondContact OE1-N 3.49Å; E40-L48 VanDerWaalsContact OE2-CB 3.28Å; E40-L48 WeakPolarHBondContact OE2-CB 3.41Å; E40-L48 WeakPolarHBondContact OE2-CG 3.3Å; E40-L48 PolarHBondContact OE2-N 2.83Å; E40-Y54 HydrophobicContact CB-CD2 4.13Å; E40-Y54 HydrophobicContact CB-CE2 4.32Å; E40-Y54 HydrophobicContact CG-CD2 3.9Å; E40-Y54 HydrophobicContact CG-CE2 4.31Å
41L97.6Very high95.7Very high0 Ų046.4 Ų46.40%028%0.282CS..THydrogen-bonded Turntrans-79.56.1-177.9-62.4171.7000114I37 A39 Q43 Y54 Y371 Y443 N451I37-L41 HydrophobicContact CG2-CD1 4.02Å; I37-L41 WeakPolarHBondContact O-CG 3.08Å; I37-L41 PolarHBondContact O-N 3.3Å; A39-L41 VanDerWaalsContact C-N 3.33Å; A39-L41 PolarHBondContact O-N 2.82Å; L41-Q43 PolarHBondContact O-N 3.31Å; L41-Y54 HydrophobicContact CD1-CE2 4.47Å; L41-Y54 WeakPolarHBondContact CD1-OH 3.36Å; L41-Y54 HydrophobicContact CG-CE2 4.25Å; L41-Y371 WeakPolarHBondContact CD1-OH 3.41Å; L41-Y443 HydrophobicContact CB-CE1 4.13Å; L41-Y443 HydrophobicContact CD2-CD1 3.85Å; L41-Y443 HydrophobicContact CD2-CE1 4Å; L41-Y443 VanDerWaalsContact O-CE1 3.27Å; L41-Y443 WeakPolarHBondContact O-CE1 3.25Å; L41-Y443 PolarHBondContact O-OH 3.4Å; L41-N451 WeakPolarHBondContact O-CB 3.43Å
42G95.7Very high95.6Very high19 Ų1947.6 Ų47.620%0.19629%0.286CS..THydrogen-bonded Turntrans-67-26-176.200000113.5R38 A39 E40 I452R38-G42 PolarHBondContact O-N 3.09Å; R38-G42 VanDerWaalsContact O-N 3.09Å; A39-G42 PolarHBondContact O-N 2.61Å; A39-G42 VanDerWaalsContact O-N 3.15Å; E40-G42 PolarHBondContact O-N 2.64Å; E40-G42 VanDerWaalsContact O-N 3.17Å; G42-I452 WeakPolarHBondContact O-CG1 3.37Å
43Q94.2Very high95.6Very high125 Ų12549 Ų4958%0.58429%0.286SS*.SBendtrans-151158.117761.3-172.9-5.900109.1L41 Y443L41-Q43 PolarHBondContact O-N 3.31Å; Q43-Y443 VanDerWaalsContact C-OH 3.26Å; Q43-Y443 VanDerWaalsContact CA-OH 3.29Å; Q43-Y443 WeakPolarHBondContact CA-OH 3.25Å; Q43-Y443 PolarHBondContact N-OH 3.19Å
44P94.2Very high95.5Very high40 Ų4048 Ų4826%0.2628%0.281SS..SBendtrans-59.9148.9169.9-21.331.6000112.2Y443 T448P44-Y443 HydrophobicContact CB-CE2 4.48Å; P44-Y443 HydrophobicContact CG-CD2 4.32Å; P44-Y443 HydrophobicContact CG-CE2 3.74Å; P44-T448 HydrophobicContact CG-CG2 4.35Å; P44-T448 WeakPolarHBondContact CG-OG1 3.25Å
45G92.1Very high95.5Very high30 Ų3048.7 Ų48.731%0.30928%0.282SS..SBendtrans92.1162.9-177.200000114D442G45-D442 PolarHBondContact N-OD1 3.49Å; G45-D442 PolarHBondContact N-OD2 3.24Å
46N87.2Confident95.6Very high83 Ų8348.2 Ų48.244%0.44428%0.28SS..  trans-84120.5-170.7-68-7.8000112.7E40E40-N46 WeakPolarHBondContact OE1-CA 3.42Å
47L92.8Very high95.6Very high110 Ų11045.2 Ų45.258%0.57626%0.264SS*.SBendtrans-89.9-44.6170.5167.275000111A39 E40 G49A39-L47 HydrophobicContact CB-CD2 4Å; E40-L47 PolarHBondContact OE1-N 3.46Å; E40-L47 WeakPolarHBondContact OE2-CA 3.16Å; E40-L47 VanDerWaalsContact OE2-CB 3.23Å; E40-L47 WeakPolarHBondContact OE2-CB 3.37Å; E40-L47 PolarHBondContact OE2-N 3.36Å; L47-G49 VanDerWaalsContact C-N 3.32Å
48L93.3Very high95.6Very high63 Ų6345.5 Ų45.533%0.3327%0.267SS..SBendtrans-74.5-23.8177.4-75.2169.6000112.3E40 N50 I57E40-L48 HydrophobicContact CB-CD1 4.36Å; E40-L48 HydrophobicContact CG-CD1 4.33Å; E40-L48 PolarHBondContact OE1-N 3.49Å; E40-L48 VanDerWaalsContact OE2-CB 3.28Å; E40-L48 WeakPolarHBondContact OE2-CB 3.41Å; E40-L48 WeakPolarHBondContact OE2-CG 3.3Å; E40-L48 PolarHBondContact OE2-N 2.83Å; L48-N50 PolarHBondContact O-N 2.72Å; L48-I57 HydrophobicContact CD1-CD1 3.89Å
49G93.3Very high95.6Very high57 Ų5745 Ų4559%0.58827%0.265SS*.SBendtrans73.16.3178.900000115L47L47-G49 VanDerWaalsContact C-N 3.32Å
50N94.8Very high95.7Very high71 Ų7144 Ų4438%0.3826%0.257SS..  trans-151113.4178.3-174.5-34.9000111.9L48 H52 I53 Y54L48-N50 PolarHBondContact O-N 2.72Å; N50-H52 VanDerWaalsContact C-N 3.31Å; N50-H52 PolarHBondContact O-N 2.71Å; N50-H52 WeakPolarHBondContact OD1-CA 3.27Å; N50-H52 VanDerWaalsContact OD1-CB 3.3Å; N50-H52 WeakPolarHBondContact OD1-CB 3.42Å; N50-H52 PolarHBondContact OD1-N 3.43Å; N50-I53 HydrophobicContact CB-CB 4.21Å; N50-I53 HydrophobicContact CB-CD1 3.87Å; N50-I53 HydrophobicContact CB-CG1 3.98Å; N50-I53 PolarHBondContact O-N 3.34Å; N50-I53 PolarHBondContact OD1-N 3.01Å; N50-Y54 PolarHBondContact O-N 2.91Å
51D95.1Very high95.7Very high77 Ų7745.3 Ų45.341%0.41226%0.263SS..Hα-helixtrans-65.2-31.6-177.7-56.6-26000113.3Y54 N55 S441D51-Y54 WeakPolarHBondContact O-CB 3.37Å; D51-Y54 PolarHBondContact O-N 3.41Å; D51-N55 PolarHBondContact O-N 3.23Å; D51-N55 VanDerWaalsContact O-N 3.11Å; D51-N55 PolarHBondContact O-ND2 2.99Å; D51-S441 WeakPolarHBondContact CB-OG 3.45Å; D51-S441 WeakPolarHBondContact OD1-CB 3.46Å; D51-S441 PolarHBondContact OD1-OG 3.17Å
52H96.4Very high95.7Very high54 Ų5446.1 Ų46.125%0.2527%0.27CS..Hα-helixtrans-67.8-42.5177.3-175.367.7000111.2N50 Y54 N55 V56 A120 G121 H138N50-H52 VanDerWaalsContact C-N 3.31Å; N50-H52 PolarHBondContact O-N 2.71Å; N50-H52 WeakPolarHBondContact OD1-CA 3.27Å; N50-H52 VanDerWaalsContact OD1-CB 3.3Å; N50-H52 WeakPolarHBondContact OD1-CB 3.42Å; N50-H52 PolarHBondContact OD1-N 3.43Å; H52-Y54 VanDerWaalsContact C-N 3.26Å; H52-Y54 PolarHBondContact O-N 2.96Å; H52-N55 PolarHBondContact O-N 3.41Å; H52-V56 WeakPolarHBondContact O-CG2 3.48Å; H52-V56 PolarHBondContact O-N 2.94Å; H52-A120 PolarHBondContact CD2-O 2.83Å; H52-A120 PolarHBondContact NE2-O 3.03Å; H52-G121 PolarHBondContact CE1-O 3.01Å; H52-G121 PolarHBondContact NE2-O 3.33Å; H52-H138 AromaticContact CE1-NE2 3.48Å; H52-H138 PolarHBondContact CE1-NE2 2.91Å
53I97.1Very high95.9Very high77 Ų7745.3 Ų45.340%0.39526%0.261SS..Hα-helixtrans-59.6-41.3175.5-66.3179.6000110.4N50 N55 V56 I57N50-I53 HydrophobicContact CB-CB 4.21Å; N50-I53 HydrophobicContact CB-CD1 3.87Å; N50-I53 HydrophobicContact CB-CG1 3.98Å; N50-I53 PolarHBondContact O-N 3.34Å; N50-I53 PolarHBondContact OD1-N 3.01Å; I53-N55 VanDerWaalsContact C-N 3.34Å; I53-N55 PolarHBondContact O-N 3.28Å; I53-V56 PolarHBondContact O-N 3.32Å; I53-I57 HydrophobicContact CG2-CD1 3.86Å; I53-I57 HydrophobicContact CG2-CG1 4.38Å; I53-I57 VanDerWaalsContact O-CG1 3.3Å; I53-I57 WeakPolarHBondContact O-CG1 3.29Å; I53-I57 PolarHBondContact O-N 3.05Å
54Y97.8Very high96.1Very high4 Ų439.3 Ų39.32%0.01623%0.233CC..Hα-helixtrans-57.1-46.4173.5171-93.8000111.8I37 E40 L41 N50 D51 H52 V56 I57 V58 Y440I37-Y54 HydrophobicContact CB-CE2 4.41Å; I37-Y54 HydrophobicContact CG1-CE2 4.49Å; I37-Y54 HydrophobicContact CG2-CE2 3.89Å; E40-Y54 HydrophobicContact CB-CD2 4.13Å; E40-Y54 HydrophobicContact CB-CE2 4.32Å; E40-Y54 HydrophobicContact CG-CD2 3.9Å; E40-Y54 HydrophobicContact CG-CE2 4.31Å; L41-Y54 HydrophobicContact CD1-CE2 4.47Å; L41-Y54 WeakPolarHBondContact CD1-OH 3.36Å; L41-Y54 HydrophobicContact CG-CE2 4.25Å; N50-Y54 PolarHBondContact O-N 2.91Å; D51-Y54 WeakPolarHBondContact O-CB 3.37Å; D51-Y54 PolarHBondContact O-N 3.41Å; H52-Y54 VanDerWaalsContact C-N 3.26Å; H52-Y54 PolarHBondContact O-N 2.96Å; Y54-V56 VanDerWaalsContact C-N 3.35Å; Y54-V56 PolarHBondContact O-N 3.11Å; Y54-I57 PolarHBondContact O-N 3.41Å; Y54-V58 HydrophobicContact CD1-CG2 4.12Å; Y54-V58 HydrophobicContact CD2-CG2 4.45Å; Y54-V58 HydrophobicContact CE1-CG2 3.73Å; Y54-V58 HydrophobicContact CE2-CG2 4.08Å; Y54-V58 HydrophobicContact CG-CG2 4.47Å; Y54-V58 VanDerWaalsContact O-CG2 3.3Å; Y54-V58 WeakPolarHBondContact O-CG2 3.25Å; Y54-V58 PolarHBondContact O-N 2.93Å; Y54-Y440 VanDerWaalsContact CE1-C 3.41Å; Y54-Y440 VanDerWaalsContact CE1-O 3.22Å; Y54-Y440 WeakPolarHBondContact CE1-O 3.14Å; Y54-Y440 PolarHBondContact OH-O 3.08Å
55N98Very high96.3Very high41 Ų4138.9 Ų38.922%0.21923%0.228CC..Hα-helixtrans-65.3-35.3177.6-73.4-40000113.3D51 H52 I53 V58 T59 R439D51-N55 PolarHBondContact O-N 3.23Å; D51-N55 VanDerWaalsContact O-N 3.11Å; D51-N55 PolarHBondContact O-ND2 2.99Å; H52-N55 PolarHBondContact O-N 3.41Å; I53-N55 VanDerWaalsContact C-N 3.34Å; I53-N55 PolarHBondContact O-N 3.28Å; N55-V58 PolarHBondContact O-N 3.33Å; N55-T59 VanDerWaalsContact O-CB 3.31Å; N55-T59 WeakPolarHBondContact O-CB 3.43Å; N55-T59 PolarHBondContact O-N 3.15Å; N55-T59 PolarHBondContact O-OG1 3.05Å; N55-R439 PolarHBondContact OD1-O 3.29Å
56V98.4Very high96.5Very high14 Ų1437.8 Ų37.89%0.08522%0.215CC..Hα-helixtrans-63.3-44.7172.7174.70000110.5H52 I53 Y54 T59 A60 A116H52-V56 WeakPolarHBondContact O-CG2 3.48Å; H52-V56 PolarHBondContact O-N 2.94Å; I53-V56 PolarHBondContact O-N 3.32Å; Y54-V56 VanDerWaalsContact C-N 3.35Å; Y54-V56 PolarHBondContact O-N 3.11Å; V56-T59 PolarHBondContact O-N 3.24Å; V56-A60 WeakPolarHBondContact O-CB 3.36Å; V56-A60 PolarHBondContact O-N 3.46Å; V56-A116 HydrophobicContact CG1-CB 3.81Å
57I98.5Very high97.1Very high18 Ų1834.3 Ų34.39%0.09220%0.196CC..Hα-helixtrans-63.2-45.1177-66.8167.8000110.9L33 L36 I37 L48 I53 Y54 T59 A60 H61L33-I57 HydrophobicContact CB-CG2 4.07Å; L33-I57 HydrophobicContact CD2-CG2 4Å; L33-I57 WeakPolarHBondContact O-CG2 3.41Å; L36-I57 HydrophobicContact CB-CD1 4.42Å; L36-I57 HydrophobicContact CB-CG2 4.26Å; L36-I57 HydrophobicContact CD1-CD1 4.2Å; I37-I57 HydrophobicContact CD1-CG2 4.13Å; I37-I57 HydrophobicContact CG1-CG2 3.71Å; L48-I57 HydrophobicContact CD1-CD1 3.89Å; I53-I57 HydrophobicContact CG2-CD1 3.86Å; I53-I57 HydrophobicContact CG2-CG1 4.38Å; I53-I57 VanDerWaalsContact O-CG1 3.3Å; I53-I57 WeakPolarHBondContact O-CG1 3.29Å; I53-I57 PolarHBondContact O-N 3.05Å; Y54-I57 PolarHBondContact O-N 3.41Å; I57-T59 VanDerWaalsContact C-N 3.32Å; I57-T59 PolarHBondContact O-N 3.08Å; I57-A60 PolarHBondContact O-N 3.16Å; I57-H61 VanDerWaalsContact O-CB 3.3Å; I57-H61 WeakPolarHBondContact O-CB 3.45Å; I57-H61 PolarHBondContact O-N 2.73Å
58V98.5Very high97.3Very high26 Ų2629.1 Ų29.116%0.15817%0.169CC..Hα-helixtrans-59.1-44.2175.9171.10000111.2I37 Y54 N55 A62 R439I37-V58 HydrophobicContact CD1-CB 4.31Å; I37-V58 HydrophobicContact CD1-CG2 3.78Å; I37-V58 HydrophobicContact CG1-CG2 3.89Å; I37-V58 HydrophobicContact CG2-CG2 4.4Å; Y54-V58 HydrophobicContact CD1-CG2 4.12Å; Y54-V58 HydrophobicContact CD2-CG2 4.45Å; Y54-V58 HydrophobicContact CE1-CG2 3.73Å; Y54-V58 HydrophobicContact CE2-CG2 4.08Å; Y54-V58 HydrophobicContact CG-CG2 4.47Å; Y54-V58 VanDerWaalsContact O-CG2 3.3Å; Y54-V58 WeakPolarHBondContact O-CG2 3.25Å; Y54-V58 PolarHBondContact O-N 2.93Å; N55-V58 PolarHBondContact O-N 3.33Å; V58-A62 PolarHBondContact O-N 3.16Å; V58-R439 HydrophobicContact CG1-CG 4.47Å
59T98.4Very high97.6Very high2 Ų226.7 Ų26.71%0.01216%0.156CC..Hα-helixtrans-64.4-48.7178.7-57.40000111N55 V56 I57 A62 F63 A122 G125 I146N55-T59 VanDerWaalsContact O-CB 3.31Å; N55-T59 WeakPolarHBondContact O-CB 3.43Å; N55-T59 PolarHBondContact O-N 3.15Å; N55-T59 PolarHBondContact O-OG1 3.05Å; V56-T59 PolarHBondContact O-N 3.24Å; I57-T59 VanDerWaalsContact C-N 3.32Å; I57-T59 PolarHBondContact O-N 3.08Å; T59-A62 PolarHBondContact O-N 3.18Å; T59-F63 HydrophobicContact CG2-CD2 3.84Å; T59-F63 HydrophobicContact CG2-CE2 3.57Å; T59-F63 VanDerWaalsContact O-CD2 3.28Å; T59-F63 WeakPolarHBondContact O-CD2 3.28Å; T59-F63 PolarHBondContact O-N 2.82Å; T59-A122 WeakPolarHBondContact CB-O 3.33Å; T59-G125 VanDerWaalsContact OG1-CA 3.24Å; T59-G125 WeakPolarHBondContact OG1-CA 3.42Å; T59-G125 PolarHBondContact OG1-N 3.07Å; T59-I146 HydrophobicContact CG2-CD1 4.06Å
60A98.5Very high97.8Very high10 Ų1024 Ų248%0.08313%0.128CC..Hα-helixtrans-63.3-43.5178.600000112.2L33 V56 I57 A62 F63 V64L33-A60 HydrophobicContact CD1-CB 3.85Å; V56-A60 WeakPolarHBondContact O-CB 3.36Å; V56-A60 PolarHBondContact O-N 3.46Å; I57-A60 PolarHBondContact O-N 3.16Å; A60-A62 VanDerWaalsContact C-N 3.33Å; A60-A62 PolarHBondContact O-N 3.24Å; A60-F63 PolarHBondContact O-N 3.17Å; A60-V64 WeakPolarHBondContact O-CB 3.49Å; A60-V64 WeakPolarHBondContact O-CG2 3.32Å; A60-V64 PolarHBondContact O-N 2.86Å
61H98.5Very high97.9Very high30 Ų3021.3 Ų21.314%0.13911%0.113CC..Hα-helixtrans-54.2-50.4177167.767000111.3G30 L33 S34 I37 I57 V64 M65G30-H61 PolarHBondContact O-ND1 3.49Å; L33-H61 HydrophobicContact CB-CB 3.86Å; L33-H61 HydrophobicContact CD1-CB 4.46Å; S34-H61 VanDerWaalsContact CB-CE1 3.45Å; S34-H61 WeakPolarHBondContact CB-CE1 3.49Å; I37-H61 HydrophobicContact CD1-CB 3.91Å; I57-H61 VanDerWaalsContact O-CB 3.3Å; I57-H61 WeakPolarHBondContact O-CB 3.45Å; I57-H61 PolarHBondContact O-N 2.73Å; H61-V64 PolarHBondContact O-N 3.06Å; H61-M65 WeakPolarHBondContact CE1-CG 3.35Å; H61-M65 WeakPolarHBondContact O-CB 3.44Å; H61-M65 VanDerWaalsContact O-CG 3.27Å; H61-M65 WeakPolarHBondContact O-CG 3.44Å; H61-M65 PolarHBondContact O-N 3Å
62A98.1Very high98.1Very high18 Ų1817.8 Ų17.815%0.14910%0.095CC..Hα-helixtrans-61.7-47.5-178.800000112V58 T59 A60 M65 I66 W126V58-A62 PolarHBondContact O-N 3.16Å; T59-A62 PolarHBondContact O-N 3.18Å; A60-A62 VanDerWaalsContact C-N 3.33Å; A60-A62 PolarHBondContact O-N 3.24Å; A62-M65 PolarHBondContact O-N 3.1Å; A62-I66 WeakPolarHBondContact O-CB 3.4Å; A62-I66 WeakPolarHBondContact O-CG1 3.3Å; A62-I66 PolarHBondContact O-N 2.73Å; A62-W126 HydrophobicContact CB-CB 3.56Å; A62-W126 HydrophobicContact CB-CG 4.04Å
63F98.5Very high98.2Very high1 Ų115.8 Ų15.80%0.0049%0.086CC..Hα-helixtrans-64-45.7178.2-75.9-55000112.7T59 A60 M65 I66 F67 F68 L112 W126 I128 I146 L150T59-F63 HydrophobicContact CG2-CD2 3.84Å; T59-F63 HydrophobicContact CG2-CE2 3.57Å; T59-F63 VanDerWaalsContact O-CD2 3.28Å; T59-F63 WeakPolarHBondContact O-CD2 3.28Å; T59-F63 PolarHBondContact O-N 2.82Å; A60-F63 PolarHBondContact O-N 3.17Å; F63-M65 PolarHBondContact O-N 3.19Å; F63-I66 PolarHBondContact O-N 3.29Å; F63-F67 AromaticContact CD1-CD2 3.72Å; F63-F67 HydrophobicContact CD1-CD2 3.72Å; F63-F67 AromaticContact CD1-CE2 3.71Å; F63-F67 HydrophobicContact CD1-CE2 3.71Å; F63-F67 HydrophobicContact CE1-CD2 4.46Å; F63-F67 HydrophobicContact CE1-CE2 4.02Å; F63-F67 PolarHBondContact O-N 2.98Å; F63-F68 WeakPolarHBondContact O-CD2 3.36Å; F63-L112 HydrophobicContact CB-CD1 3.95Å; F63-L112 HydrophobicContact CB-CD2 3.61Å; F63-L112 HydrophobicContact CB-CG 4.46Å; F63-L112 HydrophobicContact CD2-CD1 3.94Å; F63-L112 HydrophobicContact CG-CD1 4.19Å; F63-W126 HydrophobicContact CE1-CB 4.26Å; F63-W126 WeakPolarHBondContact CE1-O 3.11Å; F63-W126 HydrophobicContact CE2-CB 4.32Å; F63-W126 HydrophobicContact CZ-CB 4.08Å; F63-W126 WeakPolarHBondContact CZ-O 3.46Å; F63-I128 HydrophobicContact CE2-CD1 4.29Å; F63-I128 HydrophobicContact CE2-CG1 4.28Å; F63-I128 HydrophobicContact CZ-CD1 3.65Å; F63-I128 HydrophobicContact CZ-CG1 3.76Å; F63-I146 HydrophobicContact CD2-CD1 4.34Å; F63-I146 HydrophobicContact CD2-CG2 4.33Å; F63-I146 HydrophobicContact CE2-CD1 4.01Å; F63-I146 HydrophobicContact CE2-CG2 3.75Å; F63-I146 HydrophobicContact CZ-CG2 3.98Å; F63-L150 HydrophobicContact CD1-CD2 3.83Å; F63-L150 HydrophobicContact CE1-CD1 3.77Å; F63-L150 HydrophobicContact CE1-CD2 3.84Å; F63-L150 HydrophobicContact CE1-CG 4.31Å; F63-L150 HydrophobicContact CZ-CD1 4.07Å
64V98.8Very high98.2Very high0 Ų012.2 Ų12.20%07%0.067CC..Iπ-helixtrans-58.9-48178.41720000110.7A26 L29 L33 A60 H61 F68 M69 L109 L112A26-V64 HydrophobicContact CB-CG1 4.27Å; A26-V64 WeakPolarHBondContact O-CG1 3.46Å; L29-V64 HydrophobicContact CD2-CG1 4.27Å; L29-V64 HydrophobicContact CD2-CG2 4.19Å; L29-V64 HydrophobicContact CG-CG1 4.3Å; L33-V64 HydrophobicContact CD1-CG2 4.37Å; A60-V64 WeakPolarHBondContact O-CB 3.49Å; A60-V64 WeakPolarHBondContact O-CG2 3.32Å; A60-V64 PolarHBondContact O-N 2.86Å; H61-V64 PolarHBondContact O-N 3.06Å; V64-F68 CarbonylContact O-C 3.58Å; V64-F68 WeakPolarHBondContact O-CA 3.18Å; V64-F68 WeakPolarHBondContact O-CB 3.47Å; V64-F68 PolarHBondContact O-N 3.37Å; V64-F68 VanDerWaalsContact O-N 3.11Å; V64-M69 PolarHBondContact O-N 3.25Å; V64-L109 HydrophobicContact CG2-CD1 4.23Å; V64-L112 HydrophobicContact CG2-CD2 3.74Å
65M98.4Very high98.1Very high31 Ų3112.8 Ų12.815%0.1537%0.071CC..Iπ-helixtrans-66.8-43.9-177.8-68.8-60-70.800112.4H61 A62 F63 M69 V70H61-M65 WeakPolarHBondContact CE1-CG 3.35Å; H61-M65 WeakPolarHBondContact O-CB 3.44Å; H61-M65 VanDerWaalsContact O-CG 3.27Å; H61-M65 WeakPolarHBondContact O-CG 3.44Å; H61-M65 PolarHBondContact O-N 3Å; A62-M65 PolarHBondContact O-N 3.1Å; F63-M65 PolarHBondContact O-N 3.19Å; M65-M69 HydrophobicContact CE-SD 3.44Å; M65-M69 WeakPolarHBondContact CE-SD 3.48Å; M65-M69 WeakPolarHBondContact O-CB 3.41Å; M65-M69 HydrophobicContact SD-SD 4.03Å; M65-V70 WeakPolarHBondContact O-CB 3.3Å; M65-V70 VanDerWaalsContact O-CG2 3.23Å; M65-V70 WeakPolarHBondContact O-CG2 3.5Å; M65-V70 PolarHBondContact O-N 3.43Å
66I97.1Very high98.1Very high6 Ų611 Ų113%0.0316%0.062CC..Iπ-helixtrans-75.2-59.4-176.4-65.8170000110.9A62 F63 M71 W126 L246 L381A62-I66 WeakPolarHBondContact O-CB 3.4Å; A62-I66 WeakPolarHBondContact O-CG1 3.3Å; A62-I66 PolarHBondContact O-N 2.73Å; F63-I66 PolarHBondContact O-N 3.29Å; I66-M71 HydrophobicContact CG2-CE 4.2Å; I66-M71 PolarHBondContact O-N 3.42Å; I66-M71 VanDerWaalsContact O-N 3.15Å; I66-W126 HydrophobicContact CD1-CE3 4.17Å; I66-W126 HydrophobicContact CD1-CZ3 4.21Å; I66-L246 HydrophobicContact CG1-CD1 4.43Å; I66-L246 HydrophobicContact CG2-CD1 3.89Å; I66-L246 HydrophobicContact CG2-CD2 4.17Å; I66-L381 HydrophobicContact CG1-CD2 4.43Å
67F98.1Very high98.1Very high11 Ų1110.4 Ų10.45%0.0486%0.058CC..Iπ-helixtrans-87.5-22.5-167.6-65-91.6000114.1F63 M71 P72 L150 F238F63-F67 AromaticContact CD1-CD2 3.72Å; F63-F67 HydrophobicContact CD1-CD2 3.72Å; F63-F67 AromaticContact CD1-CE2 3.71Å; F63-F67 HydrophobicContact CD1-CE2 3.71Å; F63-F67 HydrophobicContact CE1-CD2 4.46Å; F63-F67 HydrophobicContact CE1-CE2 4.02Å; F63-F67 PolarHBondContact O-N 2.98Å; F67-M71 HydrophobicContact CB-CE 4.04Å; F67-M71 HydrophobicContact CD1-CE 3.07Å; F67-M71 HydrophobicContact CE1-CE 3.53Å; F67-M71 HydrophobicContact CG-CE 3.66Å; F67-M71 HydrophobicContact CZ-CE 4.45Å; F67-P72 VanDerWaalsContact O-CD 3.25Å; F67-P72 WeakPolarHBondContact O-CD 3.44Å; F67-P72 WeakPolarHBondContact O-CG 3.41Å; F67-L150 HydrophobicContact CD1-CD2 4.24Å; F67-L150 HydrophobicContact CD2-CD2 4.13Å; F67-L150 HydrophobicContact CE1-CD2 4.27Å; F67-L150 HydrophobicContact CE2-CD2 4.13Å; F67-L150 HydrophobicContact CG-CD2 4.2Å; F67-L150 HydrophobicContact CZ-CD2 4.21Å; F67-F238 AromaticContact CE1-CZ 3.99Å; F67-F238 HydrophobicContact CE1-CZ 3.99Å; F67-F238 HydrophobicContact CZ-CE1 4.18Å; F67-F238 AromaticContact CZ-CZ 3.89Å; F67-F238 HydrophobicContact CZ-CZ 3.89Å
68F98.6Very high98.1Very high0 Ų09.5 Ų9.50%05%0.054CC..Iπ-helixtrans-116.1-18-173.1-60.2-78.7000114.2F22 G23 A26 F63 V64 P72 S108 L109 L112F22-F68 HydrophobicContact CE1-CB 4.18Å; F22-F68 AromaticContact CE1-CD1 3.94Å; F22-F68 HydrophobicContact CE1-CD1 3.94Å; F22-F68 HydrophobicContact CZ-CB 4.44Å; F22-F68 AromaticContact CZ-CD1 3.75Å; F22-F68 HydrophobicContact CZ-CD1 3.75Å; G23-F68 WeakPolarHBondContact CA-O 3.33Å; A26-F68 HydrophobicContact CB-CB 3.88Å; A26-F68 VanDerWaalsContact CB-O 3.3Å; A26-F68 WeakPolarHBondContact CB-O 3.33Å; F63-F68 WeakPolarHBondContact O-CD2 3.36Å; V64-F68 CarbonylContact O-C 3.58Å; V64-F68 WeakPolarHBondContact O-CA 3.18Å; V64-F68 WeakPolarHBondContact O-CB 3.47Å; V64-F68 PolarHBondContact O-N 3.37Å; V64-F68 VanDerWaalsContact O-N 3.11Å; F68-P72 WeakPolarHBondContact O-CG 3.47Å; F68-S108 VanDerWaalsContact CE1-OG 3.3Å; F68-S108 WeakPolarHBondContact CE1-OG 3.26Å; F68-S108 WeakPolarHBondContact CZ-OG 3.43Å; F68-L109 HydrophobicContact CB-CD1 4.23Å; F68-L109 HydrophobicContact CD1-CB 3.74Å; F68-L109 HydrophobicContact CD1-CD1 4.11Å; F68-L109 HydrophobicContact CD1-CG 4.35Å; 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 4.47Å; F68-L109 HydrophobicContact CG-CB 4.36Å; F68-L109 HydrophobicContact CG-CD1 3.85Å; F68-L109 HydrophobicContact CZ-CB 4.37Å; F68-L112 HydrophobicContact CD2-CD2 3.87Å; F68-L112 HydrophobicContact CE2-CB 4.41Å; F68-L112 HydrophobicContact CE2-CD2 3.57Å; F68-L112 HydrophobicContact CZ-CD2 4.48Å
69M98.2Very high98.1Very high13 Ų138.3 Ų8.36%0.0645%0.046CC..Iπ-helixtrans-107.2-68.4172.5179.9-129.617500111.9G23 V64 M65 I73 V386 I389G23-M69 WeakPolarHBondContact O-CG 3.31Å; V64-M69 PolarHBondContact O-N 3.25Å; M65-M69 HydrophobicContact CE-SD 3.44Å; M65-M69 WeakPolarHBondContact CE-SD 3.48Å; M65-M69 WeakPolarHBondContact O-CB 3.41Å; M65-M69 HydrophobicContact SD-SD 4.03Å; M69-I73 HydrophobicContact CE-CD1 4.17Å; M69-I73 HydrophobicContact CG-CD1 3.9Å; M69-I73 WeakPolarHBondContact O-CB 3.17Å; M69-I73 VanDerWaalsContact O-CG1 3.24Å; M69-I73 WeakPolarHBondContact O-CG1 3.42Å; M69-I73 PolarHBondContact O-N 3.34Å; M69-V386 HydrophobicContact CE-CG1 4.2Å; M69-V386 HydrophobicContact CE-CG2 4.15Å; M69-I389 HydrophobicContact CE-CD1 4.45Å
70V98.3Very high98.1Very high1 Ų18.2 Ų8.21%0.0065%0.046CC..Iπ-helixtrans-64.7-51.8-167.7173.80000111.7M65 I73 M74 L246 A385M65-V70 WeakPolarHBondContact O-CB 3.3Å; M65-V70 VanDerWaalsContact O-CG2 3.23Å; M65-V70 WeakPolarHBondContact O-CG2 3.5Å; M65-V70 PolarHBondContact O-N 3.43Å; V70-I73 PolarHBondContact O-N 3.39Å; V70-M74 HydrophobicContact CB-CE 4.46Å; V70-M74 HydrophobicContact CG1-CE 3.12Å; V70-M74 HydrophobicContact CG1-SD 4.49Å; V70-M74 PolarHBondContact O-N 2.61Å; V70-L246 HydrophobicContact CB-CD2 4.21Å; V70-L246 HydrophobicContact CG1-CB 4.33Å; V70-L246 HydrophobicContact CG1-CD2 3.64Å; V70-A385 HydrophobicContact CG1-CB 3.85Å
71M97.2Very high98.1Very high13 Ų138.4 Ų8.46%0.0644%0.044CC..Hα-helixtrans-60.8-51.7177.4-92.4-163.5-8200113.1I66 F67 I73 M74 I75 G76 L195 E242 I245 L246I66-M71 HydrophobicContact CG2-CE 4.2Å; I66-M71 PolarHBondContact O-N 3.42Å; I66-M71 VanDerWaalsContact O-N 3.15Å; F67-M71 HydrophobicContact CB-CE 4.04Å; F67-M71 HydrophobicContact CD1-CE 3.07Å; F67-M71 HydrophobicContact CE1-CE 3.53Å; F67-M71 HydrophobicContact CG-CE 3.66Å; F67-M71 HydrophobicContact CZ-CE 4.45Å; M71-I73 VanDerWaalsContact C-N 3.33Å; M71-I73 PolarHBondContact O-N 3.3Å; M71-M74 PolarHBondContact O-N 3.34Å; M71-I75 PolarHBondContact O-N 3.33Å; M71-G76 PolarHBondContact O-N 3.03Å; M71-L195 HydrophobicContact SD-CD2 4.38Å; M71-E242 WeakPolarHBondContact CE-OE1 3.37Å; M71-I245 HydrophobicContact SD-CG2 4.45Å; M71-L246 HydrophobicContact CG-CD2 3.67Å
72P98.5Very high98.1Very high4 Ų47 Ų73%0.0264%0.038CC..Iπ-helixtrans-58.5-39.3177.7-33.742.7000113.6Y19 F22 F67 F68 G76 G77 L105Y19-P72 HydrophobicContact CD1-CB 4.04Å; F22-P72 HydrophobicContact CD1-CB 4.13Å; F22-P72 HydrophobicContact CD1-CG 4.31Å; F22-P72 HydrophobicContact CE1-CG 4.22Å; F67-P72 VanDerWaalsContact O-CD 3.25Å; F67-P72 WeakPolarHBondContact O-CD 3.44Å; F67-P72 WeakPolarHBondContact O-CG 3.41Å; F68-P72 WeakPolarHBondContact O-CG 3.47Å; P72-G76 CarbonylContact O-C 3.57Å; P72-G76 VanDerWaalsContact O-C 3.28Å; P72-G76 WeakPolarHBondContact O-CA 3.38Å; P72-G76 PolarHBondContact O-N 3.35Å; P72-G76 VanDerWaalsContact O-N 3.17Å; P72-G77 PolarHBondContact O-N 2.93Å; P72-L105 HydrophobicContact CB-CD1 4.13Å; P72-L105 HydrophobicContact CG-CD1 3.75Å
73I98.7Very high98.1Very high12 Ų126.1 Ų6.16%0.0623%0.031CC..Iπ-helixtrans-70.6-49.5179.1-68.1174.6000111.4L20 M69 V70 M71 G77 F78 I389L20-I73 HydrophobicContact CD2-CG2 3.95Å; M69-I73 HydrophobicContact CE-CD1 4.17Å; M69-I73 HydrophobicContact CG-CD1 3.9Å; M69-I73 WeakPolarHBondContact O-CB 3.17Å; M69-I73 VanDerWaalsContact O-CG1 3.24Å; M69-I73 WeakPolarHBondContact O-CG1 3.42Å; M69-I73 PolarHBondContact O-N 3.34Å; V70-I73 PolarHBondContact O-N 3.39Å; M71-I73 VanDerWaalsContact C-N 3.33Å; M71-I73 PolarHBondContact O-N 3.3Å; I73-G77 CarbonylContact O-C 3.48Å; I73-G77 VanDerWaalsContact O-CA 3.29Å; I73-G77 WeakPolarHBondContact O-CA 3.04Å; I73-G77 PolarHBondContact O-N 3.47Å; I73-F78 HydrophobicContact CG2-CD2 3.99Å; I73-F78 HydrophobicContact CG2-CE2 3.74Å; I73-F78 WeakPolarHBondContact O-CD2 3.46Å; I73-F78 PolarHBondContact O-N 3.01Å; I73-I389 HydrophobicContact CB-CD1 4.2Å; I73-I389 HydrophobicContact CG2-CB 4.39Å; I73-I389 HydrophobicContact CG2-CD1 3.96Å; I73-I389 HydrophobicContact CG2-CG1 3.88Å; I73-I389 HydrophobicContact CG2-CG2 3.66Å
74M97.2Very high98.1Very high1 Ų16 Ų61%0.0053%0.031CC..Iπ-helixtrans-75.4-50.6-172.5-72.8-166.6-6200113.6V70 M71 F78 G79 L246 P249 M253 A385 I389V70-M74 HydrophobicContact CB-CE 4.46Å; V70-M74 HydrophobicContact CG1-CE 3.12Å; V70-M74 HydrophobicContact CG1-SD 4.49Å; V70-M74 PolarHBondContact O-N 2.61Å; M71-M74 PolarHBondContact O-N 3.34Å; M74-F78 WeakPolarHBondContact O-CB 3.37Å; M74-G79 PolarHBondContact O-N 3.44Å; M74-G79 VanDerWaalsContact O-N 3.14Å; M74-L246 WeakPolarHBondContact CE-O 3.25Å; M74-P249 HydrophobicContact CB-CB 4.14Å; M74-P249 HydrophobicContact SD-CB 4.4Å; M74-M253 HydrophobicContact CG-CE 3.89Å; M74-M253 HydrophobicContact SD-CE 3.89Å; M74-A385 HydrophobicContact CE-CB 3.96Å; M74-A385 HydrophobicContact SD-CB 4.22Å; M74-I389 HydrophobicContact CG-CD1 3.78Å; M74-I389 HydrophobicContact CG-CG1 3.52Å; M74-I389 HydrophobicContact SD-CD1 4.27Å; M74-I389 HydrophobicContact SD-CG1 4.04Å
75I96.3Very high97.9Very high17 Ų176.1 Ų6.19%0.0873%0.031CC..Iπ-helixtrans-88.2-48.9-178-66.3-61.8000110.2M71 G79 F164 V188 T191 P249M71-I75 PolarHBondContact O-N 3.33Å; I75-G79 WeakPolarHBondContact O-CA 3.22Å; I75-G79 PolarHBondContact O-N 3.45Å; I75-F164 HydrophobicContact CG2-CD2 4.15Å; I75-F164 HydrophobicContact CG2-CE2 3.61Å; I75-F164 HydrophobicContact CG2-CZ 4.46Å; I75-F164 VanDerWaalsContact O-CZ 3.31Å; I75-F164 WeakPolarHBondContact O-CZ 3.22Å; I75-V188 HydrophobicContact CD1-CG1 4.36Å; I75-V188 HydrophobicContact CD1-CG2 4.39Å; I75-T191 HydrophobicContact CD1-CG2 3.52Å; I75-T191 HydrophobicContact CG1-CG2 3.93Å; I75-P249 HydrophobicContact CD1-CB 4.32Å; I75-P249 HydrophobicContact CD1-CG 3.43Å; I75-P249 VanDerWaalsContact CD1-CG 3.43Å; I75-P249 HydrophobicContact CG1-CG 4.16Å
76G97.4Very high97.8Very high4 Ų44.7 Ų4.74%0.0412%0.024CC..Iπ-helixtrans-67.4-48.5-18000000113.1Y19 M71 P72 N80Y19-G76 VanDerWaalsContact CB-C 3.41Å; Y19-G76 VanDerWaalsContact CD2-O 3.28Å; Y19-G76 WeakPolarHBondContact CD2-O 3.35Å; Y19-G76 VanDerWaalsContact CG-C 3.42Å; Y19-G76 VanDerWaalsContact CG-CA 3.45Å; M71-G76 PolarHBondContact O-N 3.03Å; P72-G76 CarbonylContact O-C 3.57Å; P72-G76 VanDerWaalsContact O-C 3.28Å; P72-G76 WeakPolarHBondContact O-CA 3.38Å; P72-G76 PolarHBondContact O-N 3.35Å; P72-G76 VanDerWaalsContact O-N 3.17Å; G76-N80 WeakPolarHBondContact O-CB 3.27Å; G76-N80 PolarHBondContact O-ND2 2.97Å
77G98.4Very high97.7Very high0 Ų04.4 Ų4.40%02%0.022CC..Iπ-helixtrans-81.2-71.9-173.900000112.4G16 P72 I73 G79 N80 W81G16-G77 WeakPolarHBondContact O-CA 3.33Å; P72-G77 PolarHBondContact O-N 2.93Å; I73-G77 CarbonylContact O-C 3.48Å; I73-G77 VanDerWaalsContact O-CA 3.29Å; I73-G77 WeakPolarHBondContact O-CA 3.04Å; I73-G77 PolarHBondContact O-N 3.47Å; G77-G79 PolarHBondContact O-N 3.43Å; G77-N80 PolarHBondContact O-N 3.08Å; G77-W81 WeakPolarHBondContact O-CB 3.44Å; G77-W81 PolarHBondContact O-N 2.81Å
78F98.8Very high97.5Very high0 Ų04.1 Ų4.10%02%0.023CC..Iπ-helixtrans-62.5-41.5-180-72.5-72.7000112.1L20 I73 M74 W81 L82 F184 M253 I389 F393 W396 F400L20-F78 HydrophobicContact CD2-CE2 4.45Å; I73-F78 HydrophobicContact CG2-CD2 3.99Å; I73-F78 HydrophobicContact CG2-CE2 3.74Å; I73-F78 WeakPolarHBondContact O-CD2 3.46Å; I73-F78 PolarHBondContact O-N 3.01Å; M74-F78 WeakPolarHBondContact O-CB 3.37Å; F78-W81 PolarHBondContact O-N 3.14Å; F78-L82 HydrophobicContact CB-CD1 4.25Å; F78-L82 HydrophobicContact CD1-CD1 3.88Å; F78-L82 VanDerWaalsContact O-CB 3.23Å; F78-L82 WeakPolarHBondContact O-CB 3.44Å; F78-L82 WeakPolarHBondContact O-CG 3.34Å; F78-L82 PolarHBondContact O-N 3.36Å; F78-F184 HydrophobicContact CB-CE2 4.37Å; F78-F184 HydrophobicContact CB-CZ 3.79Å; F78-M253 HydrophobicContact CB-SD 4.48Å; F78-M253 HydrophobicContact CD1-SD 4.25Å; F78-M253 HydrophobicContact CD2-CE 4.49Å; F78-M253 HydrophobicContact CD2-SD 3.74Å; F78-M253 HydrophobicContact CE1-SD 4.45Å; F78-M253 HydrophobicContact CE2-SD 3.95Å; F78-M253 HydrophobicContact CG-SD 3.91Å; F78-M253 HydrophobicContact CZ-SD 4.31Å; F78-I389 HydrophobicContact CE2-CG2 4.43Å; F78-F393 HydrophobicContact CZ-CB 4.28Å; F78-W396 AromaticContact CD1-CE3 3.88Å; F78-W396 HydrophobicContact CD1-CE3 3.88Å; F78-W396 HydrophobicContact CD1-CZ3 4.35Å; F78-W396 AromaticContact CE1-CE3 3.65Å; F78-W396 HydrophobicContact CE1-CE3 3.65Å; F78-W396 HydrophobicContact CE1-CZ3 4.33Å; F78-F400 HydrophobicContact CD1-CE2 4.16Å; F78-F400 AromaticContact CD1-CZ 3.77Å; F78-F400 HydrophobicContact CD1-CZ 3.77Å; F78-F400 AromaticContact CE1-CE2 3.65Å; F78-F400 HydrophobicContact CE1-CE2 3.65Å; F78-F400 AromaticContact CE1-CZ 3.71Å; F78-F400 HydrophobicContact CE1-CZ 3.71Å; F78-F400 HydrophobicContact CZ-CE2 4.44Å
79G98.5Very high97.3Very high0 Ų04.1 Ų4.10%02%0.023CC..Iπ-helixtrans-57.7-53177.500000112.2M74 I75 G77 W81 V83 F164M74-G79 PolarHBondContact O-N 3.44Å; M74-G79 VanDerWaalsContact O-N 3.14Å; I75-G79 WeakPolarHBondContact O-CA 3.22Å; I75-G79 PolarHBondContact O-N 3.45Å; G77-G79 PolarHBondContact O-N 3.43Å; G79-W81 PolarHBondContact O-N 3.43Å; G79-V83 WeakPolarHBondContact O-CB 3.25Å; G79-V83 VanDerWaalsContact O-CG2 3.3Å; G79-V83 WeakPolarHBondContact O-CG2 3.44Å; G79-V83 PolarHBondContact O-N 3.06Å; G79-F164 VanDerWaalsContact C-CE1 3.46Å
80N98.6Very high97.1Very high1 Ų16.4 Ų6.41%0.0054%0.039CC..Hα-helixtrans-66-38179.7-80.6-67.5000113H12 G76 G77 P84 N98H12-N80 PolarHBondContact ND1-O 3.05Å; G76-N80 WeakPolarHBondContact O-CB 3.27Å; G76-N80 PolarHBondContact O-ND2 2.97Å; G77-N80 PolarHBondContact O-N 3.08Å; N80-P84 WeakPolarHBondContact O-CD 3.3Å; N80-N98 PolarHBondContact ND2-OD1 3.1Å; N80-N98 PolarHBondContact OD1-ND2 3.08Å; N80-N98 PolarHBondContact OD1-OD1 3.31Å
81W98.1Very high97Very high13 Ų137.6 Ų7.65%0.0495%0.045CC..Hα-helixtrans-66.2-49.6177-97.6101.5000112.6K13 G16 T17 G77 F78 G79 L85 F400 P500K13-W81 HydrophobicContact CB-CD2 4.2Å; K13-W81 HydrophobicContact CB-CE3 4.03Å; K13-W81 HydrophobicContact CB-CH2 3.73Å; K13-W81 HydrophobicContact CB-CZ2 3.88Å; K13-W81 HydrophobicContact CB-CZ3 3.8Å; K13-W81 HydrophobicContact CD-CZ3 4.09Å; K13-W81 HydrophobicContact CG-CD2 4.44Å; K13-W81 HydrophobicContact CG-CE3 3.88Å; K13-W81 HydrophobicContact CG-CH2 4.19Å; K13-W81 HydrophobicContact CG-CZ3 3.75Å; K13-W81 VanDerWaalsContact O-CE2 3.31Å; K13-W81 PolarHBondContact O-NE1 2.96Å; K13-W81 VanDerWaalsContact O-NE1 3.16Å; G16-W81 VanDerWaalsContact C-CD1 3.47Å; T17-W81 VanDerWaalsContact OG1-CZ2 3.25Å; T17-W81 WeakPolarHBondContact OG1-CZ2 3.32Å; T17-W81 PolarHBondContact OG1-NE1 3.02Å; T17-W81 VanDerWaalsContact OG1-NE1 3.08Å; G77-W81 WeakPolarHBondContact O-CB 3.44Å; G77-W81 PolarHBondContact O-N 2.81Å; F78-W81 PolarHBondContact O-N 3.14Å; G79-W81 PolarHBondContact O-N 3.43Å; W81-L85 HydrophobicContact CE3-CD1 4.42Å; W81-L85 VanDerWaalsContact O-CD1 3.29Å; W81-L85 WeakPolarHBondContact O-CD1 3.46Å; W81-L85 VanDerWaalsContact O-CG 3.31Å; W81-L85 WeakPolarHBondContact O-CG 3.36Å; W81-F400 HydrophobicContact CB-CD1 4.45Å; W81-F400 HydrophobicContact CB-CE1 3.76Å; W81-F400 HydrophobicContact CB-CZ 4.35Å; 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 3.91Å; W81-F400 AromaticContact CE3-CD1 3.72Å; W81-F400 HydrophobicContact CE3-CD1 3.72Å; W81-F400 HydrophobicContact CE3-CE1 4.04Å; W81-F400 AromaticContact CG-CD1 3.92Å; W81-F400 HydrophobicContact CG-CD1 3.92Å; W81-F400 AromaticContact CG-CE1 3.69Å; W81-F400 HydrophobicContact CG-CE1 3.69Å; W81-F400 HydrophobicContact CG-CZ 4.43Å; W81-F400 HydrophobicContact CH2-CD1 4.42Å; W81-F400 HydrophobicContact CZ2-CB 4.45Å; W81-F400 HydrophobicContact CZ2-CD1 4.32Å; W81-F400 HydrophobicContact CZ3-CD1 4.15Å; W81-P500 HydrophobicContact CZ3-CG 4.17Å
82L98.4Very high97Very high0 Ų07.2 Ų7.20%04%0.043CC..Hα-helixtrans-95.9-32.2-163.3-59.2177.1000113.3F78 L85 M86 F184 W396 L399 F400F78-L82 HydrophobicContact CB-CD1 4.25Å; F78-L82 HydrophobicContact CD1-CD1 3.88Å; F78-L82 VanDerWaalsContact O-CB 3.23Å; F78-L82 WeakPolarHBondContact O-CB 3.44Å; F78-L82 WeakPolarHBondContact O-CG 3.34Å; F78-L82 PolarHBondContact O-N 3.36Å; L82-L85 PolarHBondContact O-N 3.1Å; L82-M86 HydrophobicContact CB-CE 4.04Å; L82-M86 HydrophobicContact CB-CG 4.46Å; L82-M86 HydrophobicContact CB-SD 4.09Å; L82-M86 HydrophobicContact CD1-CE 4.03Å; L82-M86 HydrophobicContact CD2-CE 4.34Å; L82-M86 HydrophobicContact CG-CE 4.37Å; L82-M86 VanDerWaalsContact O-CB 3.25Å; L82-M86 WeakPolarHBondContact O-CB 3.45Å; L82-M86 VanDerWaalsContact O-CG 3.27Å; L82-M86 WeakPolarHBondContact O-CG 3.2Å; L82-M86 PolarHBondContact O-N 2.81Å; L82-F184 HydrophobicContact CB-CD1 4.1Å; L82-F184 HydrophobicContact CB-CE1 3.74Å; L82-F184 HydrophobicContact CD1-CD1 4.34Å; L82-F184 HydrophobicContact CD1-CE1 4.02Å; L82-F184 HydrophobicContact CD1-CZ 4.28Å; L82-F184 HydrophobicContact CG-CE1 4.47Å; L82-W396 HydrophobicContact CD1-CD2 3.72Å; L82-W396 HydrophobicContact CD1-CE3 3.85Å; L82-W396 HydrophobicContact CD1-CG 4.34Å; L82-W396 HydrophobicContact CD1-CH2 4.02Å; L82-W396 HydrophobicContact CD1-CZ2 3.86Å; L82-W396 HydrophobicContact CD1-CZ3 4.02Å; L82-W396 HydrophobicContact CD2-CD2 4.29Å; L82-W396 HydrophobicContact CD2-CG 4.1Å; L82-L399 HydrophobicContact CD2-CD2 3.72Å; L82-F400 HydrophobicContact CD2-CE1 4.15Å; L82-F400 HydrophobicContact CD2-CZ 4.47Å
83V98.4Very high97Very high0 Ų08.5 Ų8.50%05%0.054CC..Hα-helixtrans-60.3-53.2-174.4168.50000112G79 L85 M86 I87 F164 I168 F184 V188G79-V83 WeakPolarHBondContact O-CB 3.25Å; G79-V83 VanDerWaalsContact O-CG2 3.3Å; G79-V83 WeakPolarHBondContact O-CG2 3.44Å; G79-V83 PolarHBondContact O-N 3.06Å; V83-L85 VanDerWaalsContact C-N 3.29Å; V83-L85 PolarHBondContact O-N 3.26Å; V83-M86 PolarHBondContact O-N 2.96Å; V83-I87 HydrophobicContact CG1-CD1 4.49Å; V83-I87 WeakPolarHBondContact O-CG1 3.43Å; V83-I87 PolarHBondContact O-N 3.43Å; V83-I87 VanDerWaalsContact O-N 3.13Å; V83-F164 HydrophobicContact CB-CD1 4.38Å; V83-F164 HydrophobicContact CB-CE1 4.26Å; V83-F164 HydrophobicContact CG1-CD1 4.36Å; V83-F164 HydrophobicContact CG2-CD1 4.23Å; V83-F164 HydrophobicContact CG2-CE1 4.14Å; V83-I168 HydrophobicContact CG1-CD1 3.97Å; V83-I168 HydrophobicContact CG1-CG1 3.52Å; V83-F184 HydrophobicContact CG2-CE1 4.19Å; V83-V188 HydrophobicContact CG2-CB 4.11Å; V83-V188 HydrophobicContact CG2-CG1 3.99Å; V83-V188 HydrophobicContact CG2-CG2 4.11Å
84P97.3Very high97Very high0 Ų011.7 Ų11.70%07%0.067CC..Hα-helixtrans-60-40.3177.1-26.738.2000112.3H12 N80 I87 G88 A89 M92H12-P84 HydrophobicContact CB-CG 4.24Å; N80-P84 WeakPolarHBondContact O-CD 3.3Å; P84-I87 PolarHBondContact O-N 3.09Å; P84-G88 PolarHBondContact O-N 3.35Å; P84-A89 HydrophobicContact CB-CB 4.3Å; P84-A89 PolarHBondContact O-N 3.31Å; P84-M92 HydrophobicContact CG-CG 3.93Å; P84-M92 HydrophobicContact CG-SD 3.45Å; P84-M92 WeakPolarHBondContact CG-SD 3.07Å
85L96Very high97Very high1 Ų113.4 Ų13.41%0.0058%0.079CC..Hα-helixtrans-64-44.9179.6-67.5-177.4000112.9W81 L82 V83 I87 G88 L399 L492 E493 P500 F505W81-L85 HydrophobicContact CE3-CD1 4.42Å; W81-L85 VanDerWaalsContact O-CD1 3.29Å; W81-L85 WeakPolarHBondContact O-CD1 3.46Å; W81-L85 VanDerWaalsContact O-CG 3.31Å; W81-L85 WeakPolarHBondContact O-CG 3.36Å; L82-L85 PolarHBondContact O-N 3.1Å; V83-L85 VanDerWaalsContact C-N 3.29Å; V83-L85 PolarHBondContact O-N 3.26Å; L85-I87 VanDerWaalsContact C-N 3.32Å; L85-I87 PolarHBondContact O-N 3.36Å; L85-G88 PolarHBondContact O-N 3.38Å; L85-L399 HydrophobicContact CD1-CD2 4.2Å; L85-L492 WeakPolarHBondContact O-CB 3.32Å; L85-E493 HydrophobicContact CB-CB 3.85Å; L85-E493 HydrophobicContact CD1-CB 4.28Å; L85-P500 HydrophobicContact CD1-CG 4.44Å; L85-F505 HydrophobicContact CD2-CE2 3.85Å; L85-F505 WeakPolarHBondContact O-CZ 3.24Å
86M95.4Very high97.1Very high1 Ų122.5 Ų22.51%0.00511%0.112CC..Hα-helixtrans-74.5-19.8-177.1-74.6-178.3175.300113.6L82 V83 P182 F184 V185 W396 E493L82-M86 HydrophobicContact CB-CE 4.04Å; L82-M86 HydrophobicContact CB-CG 4.46Å; L82-M86 HydrophobicContact CB-SD 4.09Å; L82-M86 HydrophobicContact CD1-CE 4.03Å; L82-M86 HydrophobicContact CD2-CE 4.34Å; L82-M86 HydrophobicContact CG-CE 4.37Å; L82-M86 VanDerWaalsContact O-CB 3.25Å; L82-M86 WeakPolarHBondContact O-CB 3.45Å; L82-M86 VanDerWaalsContact O-CG 3.27Å; L82-M86 WeakPolarHBondContact O-CG 3.2Å; L82-M86 PolarHBondContact O-N 2.81Å; V83-M86 PolarHBondContact O-N 2.96Å; M86-P182 HydrophobicContact CB-CG 4.21Å; M86-F184 HydrophobicContact CE-CD1 4.41Å; M86-F184 HydrophobicContact SD-CB 4.01Å; M86-F184 HydrophobicContact SD-CD1 3.73Å; M86-F184 HydrophobicContact SD-CG 4.26Å; M86-V185 HydrophobicContact CB-CG2 3.73Å; M86-V185 HydrophobicContact SD-CG2 4.34Å; M86-W396 HydrophobicContact CE-CZ2 3.77Å; M86-E493 HydrophobicContact CE-CG 4.3Å; M86-E493 HydrophobicContact CG-CB 4.31Å
87I95.1Very high97.2Very high0 Ų025 Ų250%012%0.123CC..Hα-helixtrans-100.3-1.8172.273.9-178.8000113V83 P84 L85 A89 T167 K172 P173 V185V83-I87 HydrophobicContact CG1-CD1 4.49Å; V83-I87 WeakPolarHBondContact O-CG1 3.43Å; V83-I87 PolarHBondContact O-N 3.43Å; V83-I87 VanDerWaalsContact O-N 3.13Å; P84-I87 PolarHBondContact O-N 3.09Å; L85-I87 VanDerWaalsContact C-N 3.32Å; L85-I87 PolarHBondContact O-N 3.36Å; I87-A89 HydrophobicContact CD1-CB 3.92Å; I87-A89 HydrophobicContact CG1-CB 3.72Å; I87-T167 HydrophobicContact CD1-CG2 3.96Å; I87-K172 HydrophobicContact CB-CG 4.2Å; I87-K172 HydrophobicContact CD1-CG 4.42Å; I87-K172 HydrophobicContact CG2-CG 4.47Å; I87-P173 WeakPolarHBondContact O-CD 3.47Å; I87-V185 HydrophobicContact CG2-CB 4.43Å; I87-V185 HydrophobicContact CG2-CG1 3.74Å; I87-V185 HydrophobicContact CG2-CG2 3.9Å
88G93.7Very high97.2Very high6 Ų625 Ų256%0.06212%0.123CC..THydrogen-bonded Turntrans70.628.9-177.800000114.5P84 L85 F505P84-G88 PolarHBondContact O-N 3.35Å; L85-G88 PolarHBondContact O-N 3.38Å; G88-F505 WeakPolarHBondContact O-CB 3.33Å; G88-F505 WeakPolarHBondContact O-CG 3.38Å
89A94.8Very high97.1Very high0 Ų026 Ų260%013%0.129CC..  trans-92.1143.917600000111.2P84 I87 D91 M171 F505P84-A89 HydrophobicContact CB-CB 4.3Å; P84-A89 PolarHBondContact O-N 3.31Å; I87-A89 HydrophobicContact CD1-CB 3.92Å; I87-A89 HydrophobicContact CG1-CB 3.72Å; A89-D91 VanDerWaalsContact C-N 3.34Å; A89-D91 PolarHBondContact O-N 3.14Å; A89-M171 HydrophobicContact CB-CB 4Å; A89-M171 HydrophobicContact CB-CE 4.48Å; A89-F505 WeakPolarHBondContact O-CD2 3.5Å
90P94.3Very high97.1Very high61 Ų6131 Ų3140%0.39615%0.153SC..SBendtrans-70.7-28.6-179.827.2-34.9000113.9T504P90-T504 VanDerWaalsContact CA-O 3.26Å; P90-T504 WeakPolarHBondContact CA-O 3.37Å; P90-T504 WeakPolarHBondContact CB-O 3.31Å
91D96.3Very high97.1Very high26 Ų2630.9 Ų30.914%0.13915%0.153CC..SBendtrans-161.6-175.2176-148.9-26.6000109.8T10 H12 A89 M171T10-D91 VanDerWaalsContact O-OD2 3.11Å; H12-D91 VanDerWaalsContact CB-OD1 3.27Å; H12-D91 WeakPolarHBondContact CB-OD1 3.24Å; H12-D91 IonicContact CD2-OD1 4Å; H12-D91 PolarHBondContact CD2-OD1 3.37Å; H12-D91 VanDerWaalsContact CD2-OD1 3.29Å; H12-D91 IonicContact CG-OD1 2.61Å; H12-D91 PolarHBondContact N-OD1 2.67Å; A89-D91 VanDerWaalsContact C-N 3.34Å; A89-D91 PolarHBondContact O-N 3.14Å; D91-M171 WeakPolarHBondContact O-CE 3.24Å
92M97.4Very high97.1Very high4 Ų430.7 Ų30.72%0.0215%0.153CC..  trans-76.3157.4169.9-61.9-71.5-70.300112.1H12 P84 F94 P95 N163 F164 T167H12-M92 HydrophobicContact CB-CG 3.8Å; P84-M92 HydrophobicContact CG-CG 3.93Å; P84-M92 HydrophobicContact CG-SD 3.45Å; P84-M92 WeakPolarHBondContact CG-SD 3.07Å; M92-F94 PolarHBondContact O-N 3.04Å; M92-P95 WeakPolarHBondContact O-CD 3.37Å; M92-P95 WeakPolarHBondContact O-CG 3.29Å; M92-N163 HydrophobicContact CE-CB 4.33Å; M92-N163 WeakPolarHBondContact CE-ND2 3.32Å; M92-F164 HydrophobicContact CE-CD1 3.43Å; M92-F164 VanDerWaalsContact CE-CD1 3.43Å; M92-F164 HydrophobicContact CE-CE1 3.55Å; M92-F164 HydrophobicContact CE-CG 4.02Å; M92-F164 HydrophobicContact CE-CZ 4.24Å; M92-F164 HydrophobicContact SD-CD1 4.35Å; M92-F164 HydrophobicContact SD-CE1 4.19Å; M92-T167 HydrophobicContact CE-CG2 4.46Å; M92-T167 HydrophobicContact SD-CG2 3.82Å
93A98.1Very high97.1Very high31 Ų3135.2 Ų35.226%0.25617%0.169SC..SBendtrans-64.6-36.6-177.100000113.5P95 N163 T166 T167 M171A93-P95 VanDerWaalsContact C-CD 3.5Å; A93-P95 WeakPolarHBondContact O-CD 3.23Å; A93-N163 PolarHBondContact N-OD1 2.99Å; A93-T166 HydrophobicContact CB-CG2 3.72Å; A93-T167 WeakPolarHBondContact CB-OG1 3.4Å; A93-T167 PolarHBondContact N-OG1 2.81Å; A93-M171 WeakPolarHBondContact CA-SD 3.5Å; A93-M171 HydrophobicContact CB-CG 4.45Å; A93-M171 HydrophobicContact CB-SD 3.63Å; A93-M171 PolarHBondContact N-SD 3.38Å
94F98.5Very high97.2Very high79 Ų7936.6 Ų36.635%0.34618%0.177SC..  trans-12374.9179.7-51.8-52.6000111.7M92 R96 M97 N98 I162 N163 T166M92-F94 PolarHBondContact O-N 3.04Å; F94-R96 VanDerWaalsContact C-N 3.33Å; F94-R96 PolarHBondContact O-N 3.15Å; F94-M97 HydrophobicContact CB-CB 3.67Å; F94-M97 HydrophobicContact CB-SD 4.29Å; F94-M97 HydrophobicContact CD2-CE 4.3Å; F94-M97 HydrophobicContact CD2-SD 4.1Å; F94-M97 HydrophobicContact CG-CE 4.46Å; F94-M97 WeakPolarHBondContact O-CB 3.37Å; F94-M97 PolarHBondContact O-N 2.91Å; F94-M97 VanDerWaalsContact O-N 3.12Å; F94-N98 PolarHBondContact O-N 3.3Å; F94-I162 HydrophobicContact CD2-CG2 4.49Å; F94-I162 HydrophobicContact CE2-CG2 4.13Å; F94-N163 HydrophobicContact CD2-CB 4.28Å; F94-N163 PolarHBondContact N-OD1 2.88Å; F94-T166 HydrophobicContact CE2-CG2 3.8Å; F94-T166 WeakPolarHBondContact CE2-OG1 3.44Å; F94-T166 HydrophobicContact CZ-CG2 3.75Å
95P97.9Very high97.2Very high38 Ų3836.8 Ų36.825%0.24718%0.178CC..Hα-helixtrans-57.3-38.2-173.7-29.237.6000115T10 M92 A93 N98 N99T10-P95 HydrophobicContact CG2-CB 4.25Å; T10-P95 WeakPolarHBondContact O-CB 3.44Å; M92-P95 WeakPolarHBondContact O-CD 3.37Å; M92-P95 WeakPolarHBondContact O-CG 3.29Å; A93-P95 VanDerWaalsContact C-CD 3.5Å; A93-P95 WeakPolarHBondContact O-CD 3.23Å; P95-N98 VanDerWaalsContact O-CB 3.28Å; P95-N98 WeakPolarHBondContact O-CB 3.27Å; P95-N98 PolarHBondContact O-N 3.16Å; P95-N99 PolarHBondContact O-N 3.1Å; P95-N99 VanDerWaalsContact O-N 3.09Å
96R98.4Very high97.4Very high207 Ų20738.2 Ų38.278%0.78119%0.187SC*.Hα-helixtrans-74.1-35.9178.5-64.7-179.2-174.6171.61.8112.7T10 F94 N98 N99 M100T10-R96 HydrophobicContact CG2-CG 4.07Å; F94-R96 VanDerWaalsContact C-N 3.33Å; F94-R96 PolarHBondContact O-N 3.15Å; R96-N98 PolarHBondContact O-N 3.33Å; R96-N99 PolarHBondContact O-N 2.76Å; R96-M100 PolarHBondContact O-N 3.43Å
97M98Very high97.5Very high57 Ų5740.7 Ų40.728%0.28120%0.203SC..Hα-helixtrans-64.1-37.1173.1-176.2-176.6-68.200110.1F94 M100 S101 L159 I162F94-M97 HydrophobicContact CB-CB 3.67Å; F94-M97 HydrophobicContact CB-SD 4.29Å; F94-M97 HydrophobicContact CD2-CE 4.3Å; F94-M97 HydrophobicContact CD2-SD 4.1Å; F94-M97 HydrophobicContact CG-CE 4.46Å; F94-M97 WeakPolarHBondContact O-CB 3.37Å; F94-M97 PolarHBondContact O-N 2.91Å; F94-M97 VanDerWaalsContact O-N 3.12Å; M97-M100 PolarHBondContact O-N 3.47Å; M97-S101 PolarHBondContact O-N 2.75Å; M97-L159 HydrophobicContact CE-CD2 4.36Å; M97-L159 HydrophobicContact CG-CB 3.83Å; M97-L159 HydrophobicContact CG-CD2 3.94Å; M97-L159 HydrophobicContact CG-CG 4.31Å; M97-L159 HydrophobicContact SD-CB 4.27Å; M97-L159 HydrophobicContact SD-CD2 4Å; M97-I162 HydrophobicContact SD-CG2 4.41Å
98N98.5Very high97.7Very high0 Ų040.7 Ų40.70%020%0.203CC..Hα-helixtrans-63.3-40.5173.5-157.333.7000113.2I15 N80 F94 P95 R96 S101 F102 N163I15-N98 HydrophobicContact CD1-CB 4.07Å; N80-N98 PolarHBondContact ND2-OD1 3.1Å; N80-N98 PolarHBondContact OD1-ND2 3.08Å; N80-N98 PolarHBondContact OD1-OD1 3.31Å; F94-N98 PolarHBondContact O-N 3.3Å; P95-N98 VanDerWaalsContact O-CB 3.28Å; P95-N98 WeakPolarHBondContact O-CB 3.27Å; P95-N98 PolarHBondContact O-N 3.16Å; R96-N98 PolarHBondContact O-N 3.33Å; N98-S101 WeakPolarHBondContact CA-OG 3.31Å; N98-S101 PolarHBondContact O-N 3.44Å; N98-S101 PolarHBondContact O-OG 3.22Å; N98-F102 PolarHBondContact O-N 3.23Å; N98-N163 WeakPolarHBondContact CB-ND2 3.25Å
99N98.6Very high97.9Very high22 Ų2240.7 Ų40.712%0.11820%0.202CC..Hα-helixtrans-66.1-44.6175-169.834.4000110.6L7 S9 I15 P95 R96 S101 F102 W103L7-N99 PolarHBondContact O-ND2 3.25Å; L7-N99 VanDerWaalsContact O-ND2 3.1Å; S9-N99 VanDerWaalsContact O-CB 3.3Å; S9-N99 WeakPolarHBondContact O-CB 3.37Å; S9-N99 VanDerWaalsContact O-CG 3.22Å; S9-N99 PolarHBondContact O-ND2 2.9Å; I15-N99 HydrophobicContact CD1-CB 3.95Å; P95-N99 PolarHBondContact O-N 3.1Å; P95-N99 VanDerWaalsContact O-N 3.09Å; R96-N99 PolarHBondContact O-N 2.76Å; N99-S101 VanDerWaalsContact C-N 3.33Å; N99-S101 PolarHBondContact O-N 2.84Å; N99-F102 PolarHBondContact O-N 2.99Å; N99-W103 VanDerWaalsContact O-CD1 3.23Å; N99-W103 PolarHBondContact O-N 2.9Å; N99-W103 PolarHBondContact OD1-NE1 2.84Å
100M98Very high98.1Very high103 Ų10346.2 Ų46.251%0.50723%0.231SC..Hα-helixtrans-61.1-40.3176.8-176.4175.417800112R96 M97 F102 W103 L104 L159R96-M100 PolarHBondContact O-N 3.43Å; M97-M100 PolarHBondContact O-N 3.47Å; M100-F102 VanDerWaalsContact C-N 3.29Å; M100-F102 PolarHBondContact O-N 3.48Å; M100-W103 PolarHBondContact O-N 3.37Å; M100-L104 HydrophobicContact CE-CD1 4.41Å; M100-L104 HydrophobicContact CG-CD1 4.36Å; M100-L104 WeakPolarHBondContact O-CG 3.36Å; M100-L104 PolarHBondContact O-N 3.44Å; M100-L159 HydrophobicContact CE-CD1 4.4Å; M100-L159 HydrophobicContact CG-CD1 4.17Å; M100-L159 HydrophobicContact SD-CD1 4.14Å
101S98.3Very high98.3Very high0 Ų045.6 Ų45.60%022%0.224CC..Hα-helixtrans-59.3-42.2176.561.40000110.9Y19 M97 N98 N99 S156Y19-S101 WeakPolarHBondContact OH-CB 3.5Å; Y19-S101 PolarHBondContact OH-O 3.34Å; Y19-S101 PolarHBondContact OH-OG 2.96Å; M97-S101 PolarHBondContact O-N 2.75Å; N98-S101 WeakPolarHBondContact CA-OG 3.31Å; N98-S101 PolarHBondContact O-N 3.44Å; N98-S101 PolarHBondContact O-OG 3.22Å; N99-S101 VanDerWaalsContact C-N 3.33Å; N99-S101 PolarHBondContact O-N 2.84Å; S101-S156 VanDerWaalsContact CB-O 3.28Å; S101-S156 WeakPolarHBondContact CB-O 3.47Å; S101-S156 VanDerWaalsContact O-CB 3.28Å; S101-S156 WeakPolarHBondContact O-CB 3.36Å; S101-S156 PolarHBondContact O-OG 3.25Å
102F98.8Very high98.4Very high9 Ų944.5 Ų44.54%0.03922%0.218CC..Hα-helixtrans-63.3-51.1175.4171.8-102.2000112.1I15 L18 Y19 F22 N98 N99 M100 L104 L105 P106I15-F102 HydrophobicContact CG2-CB 4.13Å; L18-F102 VanDerWaalsContact C-CE2 3.46Å; L18-F102 HydrophobicContact CB-CD1 4.08Å; L18-F102 HydrophobicContact CB-CD2 3.98Å; L18-F102 HydrophobicContact CB-CE1 3.76Å; L18-F102 HydrophobicContact CB-CE2 3.65Å; L18-F102 HydrophobicContact CB-CG 4.19Å; L18-F102 HydrophobicContact CB-CZ 3.56Å; L18-F102 HydrophobicContact CD1-CD1 3.9Å; L18-F102 HydrophobicContact CD1-CE1 3.82Å; L18-F102 HydrophobicContact CD1-CZ 4.46Å; L18-F102 HydrophobicContact CD2-CE1 4.48Å; L18-F102 HydrophobicContact CG-CE1 4.24Å; L18-F102 HydrophobicContact CG-CZ 4.4Å; L18-F102 WeakPolarHBondContact O-CE2 3.43Å; Y19-F102 AromaticContact CD1-CD2 3.93Å; Y19-F102 HydrophobicContact CD1-CD2 3.93Å; Y19-F102 HydrophobicContact CD2-CB 4.26Å; Y19-F102 HydrophobicContact CD2-CD2 4.04Å; Y19-F102 HydrophobicContact CE1-CB 4.43Å; Y19-F102 HydrophobicContact CE1-CD2 4.13Å; Y19-F102 HydrophobicContact CE2-CB 3.68Å; Y19-F102 HydrophobicContact CE2-CD2 4.21Å; Y19-F102 HydrophobicContact CE2-CG 4.4Å; Y19-F102 AromaticContact CG-CD2 3.9Å; Y19-F102 HydrophobicContact CG-CD2 3.9Å; Y19-F102 WeakPolarHBondContact OH-CA 3.41Å; Y19-F102 PolarHBondContact OH-N 3.27Å; Y19-F102 VanDerWaalsContact OH-N 3.07Å; F22-F102 HydrophobicContact CB-CE2 3.89Å; F22-F102 HydrophobicContact CB-CZ 4.41Å; F22-F102 HydrophobicContact CG-CE2 4.37Å; N98-F102 PolarHBondContact O-N 3.23Å; N99-F102 PolarHBondContact O-N 2.99Å; M100-F102 VanDerWaalsContact C-N 3.29Å; M100-F102 PolarHBondContact O-N 3.48Å; F102-L104 PolarHBondContact O-N 2.83Å; F102-L104 VanDerWaalsContact O-N 3.09Å; F102-L105 WeakPolarHBondContact O-CB 3.23Å; F102-L105 PolarHBondContact O-N 3.15Å; F102-P106 HydrophobicContact CZ-CG 4.36Å; F102-P106 WeakPolarHBondContact O-CD 3.37Å
103W98.6Very high98.5Very high94 Ų9446.3 Ų46.336%0.35623%0.227SC..Hα-helixtrans-67.9-11.9-171.9-77.6111000115.1L7 N99 M100 P106 P107L7-W103 HydrophobicContact CD2-CH2 3.44Å; L7-W103 VanDerWaalsContact CD2-CH2 3.44Å; L7-W103 HydrophobicContact CD2-CZ2 3.46Å; L7-W103 VanDerWaalsContact CD2-CZ2 3.46Å; L7-W103 HydrophobicContact CD2-CZ3 4.5Å; L7-W103 PolarHBondContact O-NE1 3.28Å; N99-W103 VanDerWaalsContact O-CD1 3.23Å; N99-W103 PolarHBondContact O-N 2.9Å; N99-W103 PolarHBondContact OD1-NE1 2.84Å; M100-W103 PolarHBondContact O-N 3.37Å; W103-P106 HydrophobicContact CE3-CG 4.38Å; W103-P107 WeakPolarHBondContact O-CD 3.39Å; W103-P107 WeakPolarHBondContact O-CG 3.28Å
104L98.6Very high98.5Very high29 Ų2946.1 Ų46.115%0.15223%0.226CC..THydrogen-bonded Turntrans-76.3-21.1170.3-70.3170.5000113.3M100 F102 P107 S108 L152 V155 L159M100-L104 HydrophobicContact CE-CD1 4.41Å; M100-L104 HydrophobicContact CG-CD1 4.36Å; M100-L104 WeakPolarHBondContact O-CG 3.36Å; M100-L104 PolarHBondContact O-N 3.44Å; F102-L104 PolarHBondContact O-N 2.83Å; F102-L104 VanDerWaalsContact O-N 3.09Å; L104-P107 WeakPolarHBondContact O-CD 3.45Å; L104-P107 WeakPolarHBondContact O-CG 3.19Å; L104-S108 WeakPolarHBondContact O-CB 3.27Å; L104-S108 PolarHBondContact O-N 3.48Å; L104-L152 HydrophobicContact CD2-CD2 4.22Å; L104-V155 HydrophobicContact CD1-CB 4.19Å; L104-V155 HydrophobicContact CD1-CG1 3.68Å; L104-L159 HydrophobicContact CD1-CD1 4.13Å
105L98.8Very high98.4Very high4 Ų442.4 Ų42.42%0.02121%0.21CC..Hα-helixtrans-74.4-44-177.5-65.6-178000114.5Y19 F22 P72 F102 S108 L109 A153Y19-L105 HydrophobicContact CD1-CD1 3.9Å; Y19-L105 HydrophobicContact CE1-CD1 3.44Å; Y19-L105 VanDerWaalsContact CE1-CD1 3.44Å; F22-L105 HydrophobicContact CD1-CB 4.45Å; F22-L105 HydrophobicContact CD1-CD1 4.29Å; F22-L105 HydrophobicContact CE1-CB 3.84Å; F22-L105 HydrophobicContact CE1-CD1 4.09Å; F22-L105 HydrophobicContact CE2-CB 4.49Å; 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 3.23Å; F102-L105 PolarHBondContact O-N 3.15Å; L105-S108 WeakPolarHBondContact O-CB 3.21Å; L105-S108 PolarHBondContact O-N 3.19Å; L105-L109 PolarHBondContact O-N 2.89Å; L105-A153 HydrophobicContact CD2-CB 4.31Å
106P98.7Very high98.3Very high31 Ų3142.4 Ų42.420%0.20121%0.213CC..Hα-helixtrans-56-50.3175.4-25.234.1000114.5F22 F102 W103 S108 L109 L110F22-P106 HydrophobicContact CD2-CG 4.33Å; F22-P106 HydrophobicContact CE2-CB 4.46Å; F22-P106 HydrophobicContact CE2-CG 4.23Å; F102-P106 HydrophobicContact CZ-CG 4.36Å; F102-P106 WeakPolarHBondContact O-CD 3.37Å; W103-P106 HydrophobicContact CE3-CG 4.38Å; P106-S108 VanDerWaalsContact C-N 3.3Å; P106-S108 PolarHBondContact O-N 3.01Å; P106-L109 PolarHBondContact O-N 2.91Å; P106-L110 WeakPolarHBondContact O-CG 3.46Å; P106-L110 PolarHBondContact O-N 3.41Å
107P98.7Very high98.1Very high54 Ų5439.6 Ų39.635%0.35121%0.211SC..Hα-helixtrans-65.6-33.6176.525.3-32.5000112.3W103 L104 L110 L111 L152W103-P107 WeakPolarHBondContact O-CD 3.39Å; W103-P107 WeakPolarHBondContact O-CG 3.28Å; L104-P107 WeakPolarHBondContact O-CD 3.45Å; L104-P107 WeakPolarHBondContact O-CG 3.19Å; P107-L110 PolarHBondContact O-N 3.47Å; P107-L111 WeakPolarHBondContact O-CG 3.46Å; P107-L111 PolarHBondContact O-N 3.36Å; P107-L152 HydrophobicContact CB-CD1 4.38Å; P107-L152 HydrophobicContact CG-CD1 4.48Å
108S98.8Very high98Very high0 Ų039.5 Ų39.50%021%0.213CC..Hα-helixtrans-59.7-48.4173.11750000111.7F68 L104 L105 P106 L110 L111 L112 S149F68-S108 VanDerWaalsContact CE1-OG 3.3Å; F68-S108 WeakPolarHBondContact CE1-OG 3.26Å; F68-S108 WeakPolarHBondContact CZ-OG 3.43Å; L104-S108 WeakPolarHBondContact O-CB 3.27Å; L104-S108 PolarHBondContact O-N 3.48Å; L105-S108 WeakPolarHBondContact O-CB 3.21Å; L105-S108 PolarHBondContact O-N 3.19Å; P106-S108 VanDerWaalsContact C-N 3.3Å; P106-S108 PolarHBondContact O-N 3.01Å; S108-L110 VanDerWaalsContact C-N 3.32Å; S108-L110 PolarHBondContact O-N 2.79Å; S108-L111 WeakPolarHBondContact O-CB 3.4Å; S108-L111 PolarHBondContact O-N 3.24Å; S108-L111 VanDerWaalsContact O-N 3.15Å; S108-L112 PolarHBondContact O-N 3.39Å; S108-S149 WeakPolarHBondContact O-CB 3.09Å; S108-S149 PolarHBondContact O-OG 3.47Å; S108-S149 VanDerWaalsContact O-OG 3.04Å; S108-S149 PolarHBondContact OG-O 3.03Å; S108-S149 PolarHBondContact OG-OG 3.21Å
109L98.7Very high97.8Very high5 Ų545 Ų453%0.02624%0.239CC..Hα-helixtrans-63.4-37.8176.6-178.355.7000112.2F22 W25 A26 V64 F68 L105 P106 L111 L112 L113F22-L109 HydrophobicContact CE2-CB 4.28Å; F22-L109 HydrophobicContact CE2-CD2 3.69Å; F22-L109 HydrophobicContact CZ-CB 3.95Å; F22-L109 HydrophobicContact CZ-CD2 3.64Å; F22-L109 HydrophobicContact CZ-CG 4.45Å; W25-L109 HydrophobicContact CE3-CD2 4.06Å; W25-L109 HydrophobicContact CZ3-CD2 3.68Å; A26-L109 HydrophobicContact CB-CD2 4.32Å; V64-L109 HydrophobicContact CG2-CD1 4.23Å; F68-L109 HydrophobicContact CB-CD1 4.23Å; F68-L109 HydrophobicContact CD1-CB 3.74Å; F68-L109 HydrophobicContact CD1-CD1 4.11Å; F68-L109 HydrophobicContact CD1-CG 4.35Å; 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 4.47Å; F68-L109 HydrophobicContact CG-CB 4.36Å; F68-L109 HydrophobicContact CG-CD1 3.85Å; F68-L109 HydrophobicContact CZ-CB 4.37Å; L105-L109 PolarHBondContact O-N 2.89Å; P106-L109 PolarHBondContact O-N 2.91Å; L109-L111 VanDerWaalsContact C-N 3.33Å; L109-L111 PolarHBondContact O-N 2.72Å; L109-L112 HydrophobicContact CD1-CD2 4.28Å; L109-L112 PolarHBondContact O-N 2.84Å; L109-L113 HydrophobicContact CD1-CD1 4.49Å; L109-L113 HydrophobicContact CD1-CG 4.29Å; L109-L113 HydrophobicContact CG-CD1 4.31Å; L109-L113 WeakPolarHBondContact O-CG 3.47Å; L109-L113 PolarHBondContact O-N 3.32Å
110L98.6Very high97.5Very high117 Ų11747 Ų4761%0.61326%0.259SS*.Hα-helixtrans-62.9-38.9175-70.1174.7000112P106 P107 S108 L113 A114P106-L110 WeakPolarHBondContact O-CG 3.46Å; P106-L110 PolarHBondContact O-N 3.41Å; P107-L110 PolarHBondContact O-N 3.47Å; S108-L110 VanDerWaalsContact C-N 3.32Å; S108-L110 PolarHBondContact O-N 2.79Å; L110-L113 PolarHBondContact O-N 3.02Å; L110-A114 VanDerWaalsContact O-CB 3.23Å; L110-A114 WeakPolarHBondContact O-CB 3.46Å; L110-A114 PolarHBondContact O-N 3.31Å
111L98.7Very high97.5Very high48 Ų4842.1 Ų42.125%0.25123%0.234SC..Hα-helixtrans-64.5-41.7173.8-69.8170.6000111.7P107 S108 L109 A114 S115 L145 F148 L152P107-L111 WeakPolarHBondContact O-CG 3.46Å; P107-L111 PolarHBondContact O-N 3.36Å; S108-L111 WeakPolarHBondContact O-CB 3.4Å; S108-L111 PolarHBondContact O-N 3.24Å; S108-L111 VanDerWaalsContact O-N 3.15Å; L109-L111 VanDerWaalsContact C-N 3.33Å; L109-L111 PolarHBondContact O-N 2.72Å; L111-A114 PolarHBondContact O-N 3.42Å; L111-S115 PolarHBondContact O-N 2.88Å; L111-L145 HydrophobicContact CD2-CD2 3.79Å; L111-F148 HydrophobicContact CD1-CB 3.94Å; L111-L152 HydrophobicContact CD1-CD1 3.67Å
112L98.6Very high97.4Very high3 Ų342.2 Ų42.22%0.01624%0.235CC..Hα-helixtrans-61.3-44.4174.7179.666.7000111.8F63 V64 F68 S108 L109 S115 A116 I146F63-L112 HydrophobicContact CB-CD1 3.95Å; F63-L112 HydrophobicContact CB-CD2 3.61Å; F63-L112 HydrophobicContact CB-CG 4.46Å; F63-L112 HydrophobicContact CD2-CD1 3.94Å; F63-L112 HydrophobicContact CG-CD1 4.19Å; V64-L112 HydrophobicContact CG2-CD2 3.74Å; F68-L112 HydrophobicContact CD2-CD2 3.87Å; F68-L112 HydrophobicContact CE2-CB 4.41Å; F68-L112 HydrophobicContact CE2-CD2 3.57Å; F68-L112 HydrophobicContact CZ-CD2 4.48Å; S108-L112 PolarHBondContact O-N 3.39Å; L109-L112 HydrophobicContact CD1-CD2 4.28Å; L109-L112 PolarHBondContact O-N 2.84Å; L112-S115 VanDerWaalsContact O-CB 3.29Å; L112-S115 WeakPolarHBondContact O-CB 3.36Å; L112-S115 PolarHBondContact O-N 3.23Å; L112-A116 PolarHBondContact O-N 2.91Å; L112-I146 HydrophobicContact CD1-CD1 4.3Å; L112-I146 HydrophobicContact CD1-CG1 4.17Å
113L98.1Very high97.3Very high41 Ų4142.1 Ų42.122%0.21524%0.237CC..Hα-helixtrans-68.6-39.4178.5-69.8179.3000111.9W25 L29 L109 L110 S115 A116 M117W25-L113 HydrophobicContact CH2-CD1 4.44Å; L29-L113 HydrophobicContact CD2-CD1 4.15Å; L29-L113 HydrophobicContact CD2-CD2 3.87Å; L29-L113 HydrophobicContact CD2-CG 4.48Å; L109-L113 HydrophobicContact CD1-CD1 4.49Å; L109-L113 HydrophobicContact CD1-CG 4.29Å; L109-L113 HydrophobicContact CG-CD1 4.31Å; L109-L113 WeakPolarHBondContact O-CG 3.47Å; L109-L113 PolarHBondContact O-N 3.32Å; L110-L113 PolarHBondContact O-N 3.02Å; L113-S115 VanDerWaalsContact C-N 3.29Å; L113-S115 PolarHBondContact O-N 2.96Å; L113-A116 PolarHBondContact O-N 2.73Å; L113-M117 PolarHBondContact O-N 3.48Å
114A98.2Very high97.2Very high27 Ų2737.8 Ų37.822%0.22322%0.221CC..Hα-helixtrans-61.2-39.6173.200000111.3L110 L111 A116 M117 V118 L145L110-A114 VanDerWaalsContact O-CB 3.23Å; L110-A114 WeakPolarHBondContact O-CB 3.46Å; L110-A114 PolarHBondContact O-N 3.31Å; L111-A114 PolarHBondContact O-N 3.42Å; A114-A116 VanDerWaalsContact C-N 3.26Å; A114-A116 PolarHBondContact O-N 2.78Å; A114-M117 PolarHBondContact O-N 2.94Å; A114-V118 WeakPolarHBondContact O-CB 3.39Å; A114-V118 VanDerWaalsContact O-CG2 3.3Å; A114-V118 WeakPolarHBondContact O-CG2 3.28Å; A114-V118 PolarHBondContact O-N 3.28Å; A114-L145 HydrophobicContact CB-CD1 4.16Å
115S98.1Very high97.2Very high2 Ų236.6 Ų36.61%0.01422%0.216CC..Hα-helixtrans-54.1-42.3174.11720000112.3L111 L112 L113 M117 G121 S142 I146L111-S115 PolarHBondContact O-N 2.88Å; L112-S115 VanDerWaalsContact O-CB 3.29Å; L112-S115 WeakPolarHBondContact O-CB 3.36Å; L112-S115 PolarHBondContact O-N 3.23Å; L113-S115 VanDerWaalsContact C-N 3.29Å; L113-S115 PolarHBondContact O-N 2.96Å; S115-M117 VanDerWaalsContact C-N 3.25Å; S115-M117 PolarHBondContact O-N 3.45Å; S115-G121 VanDerWaalsContact O-CA 3.29Å; S115-G121 WeakPolarHBondContact O-CA 3.38Å; S115-S142 VanDerWaalsContact CB-O 3.28Å; S115-S142 WeakPolarHBondContact CB-O 3.19Å; S115-S142 PolarHBondContact OG-O 3.09Å; S115-I146 WeakPolarHBondContact OG-CG1 3.4Å
116A95.2Very high97.1Very high38 Ų3838 Ų3831%0.31422%0.221SC..Hα-helixtrans-71.1-18.6179.500000113.8V56 L112 L113 A114V56-A116 HydrophobicContact CG1-CB 3.81Å; L112-A116 PolarHBondContact O-N 2.91Å; L113-A116 PolarHBondContact O-N 2.73Å; A114-A116 VanDerWaalsContact C-N 3.26Å; A114-A116 PolarHBondContact O-N 2.78Å
117M94.7Very high97Very high148 Ų14836.5 Ų36.573%0.72921%0.211SC*.Hα-helixtrans-103.4-22.2-177.1-64.6-174-68.700113.8L113 A114 S115L113-M117 PolarHBondContact O-N 3.48Å; A114-M117 PolarHBondContact O-N 2.94Å; S115-M117 VanDerWaalsContact C-N 3.25Å; S115-M117 PolarHBondContact O-N 3.45Å
118V95.4Very high97Very high55 Ų5534 Ų3433%0.33319%0.194SC..SBendtrans-83.2133.2-179.4170.40000109.8A114 A120 G121 A141 L145A114-V118 WeakPolarHBondContact O-CB 3.39Å; A114-V118 VanDerWaalsContact O-CG2 3.3Å; A114-V118 WeakPolarHBondContact O-CG2 3.28Å; A114-V118 PolarHBondContact O-N 3.28Å; V118-A120 PolarHBondContact O-N 3.46Å; V118-G121 PolarHBondContact O-N 3.37Å; V118-A141 HydrophobicContact CG1-CB 4.44Å; V118-L145 HydrophobicContact CB-CD1 4.21Å; V118-L145 HydrophobicContact CG2-CD1 4Å
119E93.4Very high97Very high114 Ų11436.1 Ų36.153%0.53320%0.203SC..THydrogen-bonded Turntrans55.2-123.5-178.6-60.2154.8174.200111.3G140 A141 S142E119-G140 VanDerWaalsContact CD-CA 3.47Å; E119-G140 WeakPolarHBondContact OE1-CA 3.36Å; E119-G140 WeakPolarHBondContact OE2-CA 3.46Å; E119-A141 VanDerWaalsContact CD-N 3.27Å; E119-A141 PolarHBondContact OE1-N 3.36Å; E119-A141 PolarHBondContact OE2-N 3.22Å; E119-S142 PolarHBondContact OE2-N 2.98Å
120A93.3Very high96.9Very high65 Ų6536.4 Ų36.454%0.53721%0.205SC..THydrogen-bonded Turntrans-93.7-5.4175.500000112.8H52 V118H52-A120 PolarHBondContact CD2-O 2.83Å; H52-A120 PolarHBondContact NE2-O 3.03Å; V118-A120 PolarHBondContact O-N 3.46Å
121G96.6Very high96.8Very high0 Ų035 Ų350%020%0.203CC..  trans74.1164-16900000114.4H52 S115 V118 G123H52-G121 PolarHBondContact CE1-O 3.01Å; H52-G121 PolarHBondContact NE2-O 3.33Å; S115-G121 VanDerWaalsContact O-CA 3.29Å; S115-G121 WeakPolarHBondContact O-CA 3.38Å; V118-G121 PolarHBondContact O-N 3.37Å; G121-G123 PolarHBondContact O-N 3.22Å
122A96.9Very high96.8Very high2 Ų236.5 Ų36.52%0.01721%0.211CC..  trans-90.8101.2-178.300000112.1T59 T124 V143 I146T59-A122 WeakPolarHBondContact CB-O 3.33Å; A122-T124 VanDerWaalsContact C-N 3.34Å; A122-T124 PolarHBondContact O-N 3.29Å; A122-V143 HydrophobicContact CB-CG2 3.93Å; A122-I146 HydrophobicContact CB-CD1 3.47Å; A122-I146 VanDerWaalsContact CB-CD1 3.47Å; A122-I146 HydrophobicContact CB-CG1 4.14Å
123G96.9Very high96.7Very high7 Ų736.4 Ų36.47%0.07221%0.21CC..  trans-9534.8177.700000113.4G121 H138G121-G123 PolarHBondContact O-N 3.22Å; G123-H138 PolarHBondContact N-NE2 3.23Å
124T97.2Very high96.6Very high4 Ų435.2 Ų35.23%0.02521%0.208CC..SBendtrans-86.6-8.2-17156.80000113.9A122 L132 A133 V143A122-T124 VanDerWaalsContact C-N 3.34Å; A122-T124 PolarHBondContact O-N 3.29Å; T124-L132 HydrophobicContact CG2-CG 4.45Å; T124-A133 HydrophobicContact CG2-CB 3.87Å; T124-V143 HydrophobicContact CG2-CG2 4.04Å
125G97Very high96.5Very high4 Ų437 Ų374%0.04121%0.214CC..THydrogen-bonded Turntrans76.1160.1-163.800000111.8T59 T127 I128T59-G125 VanDerWaalsContact OG1-CA 3.24Å; T59-G125 WeakPolarHBondContact OG1-CA 3.42Å; T59-G125 PolarHBondContact OG1-N 3.07Å; G125-T127 PolarHBondContact O-N 3.38Å; G125-I128 PolarHBondContact O-N 3.2Å
126W97.3Very high96.2Very high33 Ų3347.9 Ų47.913%0.12526%0.256CS..THydrogen-bonded Turntrans-63.3-14-176.183.8-80.5000114.8A62 F63 I66 F235 W236A62-W126 HydrophobicContact CB-CB 3.56Å; A62-W126 HydrophobicContact CB-CG 4.04Å; F63-W126 HydrophobicContact CE1-CB 4.26Å; F63-W126 WeakPolarHBondContact CE1-O 3.11Å; F63-W126 HydrophobicContact CE2-CB 4.32Å; F63-W126 HydrophobicContact CZ-CB 4.08Å; F63-W126 WeakPolarHBondContact CZ-O 3.46Å; I66-W126 HydrophobicContact CD1-CE3 4.17Å; I66-W126 HydrophobicContact CD1-CZ3 4.21Å; W126-F235 HydrophobicContact CD2-CZ 4.32Å; W126-F235 AromaticContact CE3-CZ 3.77Å; W126-F235 HydrophobicContact CE3-CZ 3.77Å; W126-F235 AromaticContact CH2-CE1 3.94Å; W126-F235 HydrophobicContact CH2-CE1 3.94Å; W126-F235 AromaticContact CH2-CZ 3.94Å; W126-F235 HydrophobicContact CH2-CZ 3.94Å; W126-F235 HydrophobicContact CZ2-CE1 4.28Å; W126-F235 HydrophobicContact CZ2-CZ 4.46Å; W126-F235 HydrophobicContact CZ3-CE1 4.06Å; W126-F235 AromaticContact CZ3-CZ 3.57Å; W126-F235 HydrophobicContact CZ3-CZ 3.57Å; W126-W236 HydrophobicContact CH2-CH2 4.46Å; W126-W236 HydrophobicContact CH2-CZ3 4.15Å; W126-W236 AromaticContact CZ2-CH2 3.82Å; W126-W236 HydrophobicContact CZ2-CH2 3.82Å; W126-W236 AromaticContact CZ2-CZ3 3.93Å; W126-W236 HydrophobicContact CZ2-CZ3 3.93Å
127T97.3Very high96.2Very high0 Ų048.7 Ų48.70%026%0.26CS..THydrogen-bonded Turntrans-82.3-20.6176.757.40000112.7G125 Y129 Y231 F235 W236G125-T127 PolarHBondContact O-N 3.38Å; T127-Y129 VanDerWaalsContact C-N 3.34Å; T127-Y129 VanDerWaalsContact CB-CE1 3.48Å; T127-Y129 HydrophobicContact CG2-CE1 4.23Å; T127-Y129 HydrophobicContact CG2-CE2 4.46Å; T127-Y129 PolarHBondContact O-N 3.48Å; T127-Y231 WeakPolarHBondContact O-CE1 3.35Å; T127-Y231 PolarHBondContact O-OH 3.3Å; T127-F235 HydrophobicContact CG2-CD1 4.33Å; T127-F235 HydrophobicContact CG2-CE1 3.71Å; T127-F235 HydrophobicContact CG2-CZ 4.08Å; T127-W236 HydrophobicContact CG2-CH2 4.16Å; T127-W236 HydrophobicContact CG2-CZ2 3.99Å
128I97.9Very high96.3Very high0 Ų042.3 Ų42.30%023%0.228CC..THydrogen-bonded Turntrans54.146.9177.2-39.1172.1000111.8F63 G125 P130 A133 V143 I146 L150 L209 Y231F63-I128 HydrophobicContact CE2-CD1 4.29Å; F63-I128 HydrophobicContact CE2-CG1 4.28Å; F63-I128 HydrophobicContact CZ-CD1 3.65Å; F63-I128 HydrophobicContact CZ-CG1 3.76Å; G125-I128 PolarHBondContact O-N 3.2Å; I128-P130 WeakPolarHBondContact O-CD 3.46Å; I128-A133 HydrophobicContact CG2-CB 3.5Å; I128-A133 VanDerWaalsContact CG2-CB 3.5Å; I128-A133 WeakPolarHBondContact O-CB 3.38Å; I128-V143 HydrophobicContact CG2-CG1 4Å; I128-I146 HydrophobicContact CD1-CG2 3.51Å; I128-I146 HydrophobicContact CG1-CG2 4.49Å; I128-L150 HydrophobicContact CD1-CD1 3.72Å; I128-L209 HydrophobicContact CG2-CD2 3.69Å; I128-Y231 WeakPolarHBondContact O-CE1 3.35Å; I128-Y231 VanDerWaalsContact O-CZ 3.31Å; I128-Y231 PolarHBondContact O-OH 3.43Å
129Y98.3Very high96.2Very high45 Ų4543.9 Ų43.918%0.17624%0.24CC..  trans-70.9129.7-176.4-69.5-24000112.9T127 L132 A133 Y231 Q232 F235 W236T127-Y129 VanDerWaalsContact C-N 3.34Å; T127-Y129 VanDerWaalsContact CB-CE1 3.48Å; T127-Y129 HydrophobicContact CG2-CE1 4.23Å; T127-Y129 HydrophobicContact CG2-CE2 4.46Å; T127-Y129 PolarHBondContact O-N 3.48Å; Y129-L132 WeakPolarHBondContact O-CB 3.39Å; Y129-L132 PolarHBondContact O-N 3.28Å; Y129-A133 WeakPolarHBondContact O-CB 3.38Å; Y129-A133 PolarHBondContact O-N 2.77Å; Y129-Y231 AromaticContact CD1-CD1 3.61Å; Y129-Y231 HydrophobicContact CD1-CD1 3.61Å; Y129-Y231 AromaticContact CD1-CE1 3.62Å; Y129-Y231 HydrophobicContact CD1-CE1 3.62Å; Y129-Y231 HydrophobicContact CE1-CD1 4.15Å; Y129-Y231 HydrophobicContact CE1-CE1 4.14Å; Y129-Q232 HydrophobicContact CD1-CG 4.14Å; Y129-Q232 HydrophobicContact CE1-CB 4.44Å; Y129-Q232 HydrophobicContact CE1-CG 3.8Å; Y129-Q232 HydrophobicContact CE2-CG 4.34Å; Y129-F235 HydrophobicContact CE1-CD1 4.45Å; Y129-W236 AromaticContact CZ-NE1 3.93Å; Y129-W236 VanDerWaalsContact OH-CZ2 3.24Å; Y129-W236 WeakPolarHBondContact OH-CZ2 3.2Å; Y129-W236 PolarHBondContact OH-NE1 3.46Å
130P97.3Very high96.2Very high12 Ų1239.9 Ų39.98%0.07823%0.228CC..THydrogen-bonded Turntrans-67.1153.5157.629.4-31.2000110.1I128 L132 L209 F220 Y231I128-P130 WeakPolarHBondContact O-CD 3.46Å; P130-L132 VanDerWaalsContact C-N 3.34Å; P130-L209 HydrophobicContact CB-CD1 4.12Å; P130-L209 HydrophobicContact CG-CD1 4.41Å; P130-F220 HydrophobicContact CB-CB 3.87Å; P130-F220 HydrophobicContact CG-CB 3.55Å; P130-F220 HydrophobicContact CG-CD2 4Å; P130-F220 HydrophobicContact CG-CG 3.82Å; P130-Y231 VanDerWaalsContact CD-CG 3.4Å; P130-Y231 HydrophobicContact CG-CD1 4.4Å; P130-Y231 HydrophobicContact CG-CD2 4.18Å; P130-Y231 HydrophobicContact CG-CG 3.83Å
131P97Very high96.4Very high87 Ų8738.6 Ų38.657%0.56522%0.218SC*.THydrogen-bonded Turncis-81.2-50.834-36.4000113.9A133 G134 S137P131-A133 VanDerWaalsContact C-N 3.29Å; P131-A133 PolarHBondContact O-N 3.48Å; P131-G134 PolarHBondContact O-N 2.85Å; P131-S137 PolarHBondContact O-OG 3.5Å
132L97.6Very high96.5Very high80 Ų8038.7 Ų38.742%0.41922%0.219SC..THydrogen-bonded Turntrans-61-39.2180-178.663.7000111.6T124 Y129 P130 G134 S137 H138T124-L132 HydrophobicContact CG2-CG 4.45Å; Y129-L132 WeakPolarHBondContact O-CB 3.39Å; Y129-L132 PolarHBondContact O-N 3.28Å; P130-L132 VanDerWaalsContact C-N 3.34Å; L132-G134 PolarHBondContact O-N 3.09Å; L132-S137 VanDerWaalsContact O-CB 3.27Å; L132-S137 WeakPolarHBondContact O-CB 3.34Å; L132-H138 PolarHBondContact O-ND1 3.12Å
133A97.7Very high96.6Very high0 Ų038.6 Ų38.60%022%0.218CC..THydrogen-bonded Turntrans-80.33.7174.500000114.3T124 I128 Y129 P131 V143 L209 R213T124-A133 HydrophobicContact CG2-CB 3.87Å; I128-A133 HydrophobicContact CG2-CB 3.5Å; I128-A133 VanDerWaalsContact CG2-CB 3.5Å; I128-A133 WeakPolarHBondContact O-CB 3.38Å; Y129-A133 WeakPolarHBondContact O-CB 3.38Å; Y129-A133 PolarHBondContact O-N 2.77Å; P131-A133 VanDerWaalsContact C-N 3.29Å; P131-A133 PolarHBondContact O-N 3.48Å; A133-V143 HydrophobicContact CB-CG1 4.34Å; A133-L209 HydrophobicContact CB-CD1 4.45Å; A133-L209 HydrophobicContact CB-CD2 3.94Å; A133-R213 WeakPolarHBondContact O-CD 3.15Å; A133-R213 PolarHBondContact O-NH1 3.4Å
134G96.5Very high96.6Very high16 Ų1639.1 Ų39.117%0.16522%0.219CC..SBendtrans-82.9168.4175.400000112.9P131 L132 Y136 S137 H138 R213P131-G134 PolarHBondContact O-N 2.85Å; L132-G134 PolarHBondContact O-N 3.09Å; G134-Y136 PolarHBondContact O-N 2.96Å; G134-S137 PolarHBondContact O-N 3.33Å; G134-H138 PolarHBondContact O-N 3.4Å; G134-R213 PolarHBondContact O-NH1 2.94Å
135N94.4Very high96.7Very high66 Ų6640.5 Ų40.535%0.35323%0.226SC..THydrogen-bonded Turntrans-67.4-19.6-175.9-96.8-29.7000114.6R213N135-R213 PolarHBondContact ND2-O 2.85Å; N135-R213 PolarHBondContact OD1-NH2 3.27Å
136Y92.6Very high96.8Very high229 Ų22940.5 Ų40.590%0.89823%0.225SC*.THydrogen-bonded Turntrans-67.4-36.9174.5-171.2-92000112.5G134G134-Y136 PolarHBondContact O-N 2.96Å
137S95.2Very high96.9Very high55 Ų5538.9 Ų38.939%0.38522%0.219SC..THydrogen-bonded Turntrans-102.5-37.9-174.8-52.30000112.8P131 L132 G134P131-S137 PolarHBondContact O-OG 3.5Å; L132-S137 VanDerWaalsContact O-CB 3.27Å; L132-S137 WeakPolarHBondContact O-CB 3.34Å; G134-S137 PolarHBondContact O-N 3.33Å
138H96.9Very high96.9Very high14 Ų1443.7 Ų43.77%0.06524%0.24CC..SBendtrans-122.182.7174.5-76.379000108.9H52 G123 L132 G134 V143 R213H52-H138 AromaticContact CE1-NE2 3.48Å; H52-H138 PolarHBondContact CE1-NE2 2.91Å; G123-H138 PolarHBondContact N-NE2 3.23Å; L132-H138 PolarHBondContact O-ND1 3.12Å; G134-H138 PolarHBondContact O-N 3.4Å; H138-V143 HydrophobicContact CB-CG2 3.75Å; H138-R213 PolarHBondContact O-NH1 2.96Å; H138-R213 PolarHBondContact O-NH2 3.12Å
139P92.7Very high97Very high89 Ų8943.7 Ų43.758%0.57824%0.24SC*.  trans-67.4148174.529.5-34.4000110.2
140G94.5Very high97Very high29 Ų2941.8 Ų41.830%0.29923%0.233SC..SBendtrans94.4-166169.400000115.7E119 R213E119-G140 VanDerWaalsContact CD-CA 3.47Å; E119-G140 WeakPolarHBondContact OE1-CA 3.36Å; E119-G140 WeakPolarHBondContact OE2-CA 3.46Å; G140-R213 PolarHBondContact O-NH2 2.93Å
141A97.1Very high97.1Very high38 Ų3843.4 Ų43.431%0.31424%0.239SC..SBendtrans-86.8-9.5-165.100000114.9V118 E119 V143 D144 L145V118-A141 HydrophobicContact CG1-CB 4.44Å; E119-A141 VanDerWaalsContact CD-N 3.27Å; E119-A141 PolarHBondContact OE1-N 3.36Å; E119-A141 PolarHBondContact OE2-N 3.22Å; A141-V143 PolarHBondContact O-N 3.4Å; A141-D144 WeakPolarHBondContact O-CB 3.2Å; A141-D144 PolarHBondContact O-N 3.33Å; A141-D144 VanDerWaalsContact O-N 3.15Å; A141-L145 WeakPolarHBondContact O-CG 3.42Å; A141-L145 PolarHBondContact O-N 2.93Å
142S98Very high97.1Very high3 Ų341.8 Ų41.82%0.02123%0.225CC..Hα-helixtrans-56.7-48.5-174.759.50000113.3S115 E119 D144 L145 I146S115-S142 VanDerWaalsContact CB-O 3.28Å; S115-S142 WeakPolarHBondContact CB-O 3.19Å; S115-S142 PolarHBondContact OG-O 3.09Å; E119-S142 PolarHBondContact OE2-N 2.98Å; S142-D144 VanDerWaalsContact C-N 3.35Å; S142-L145 PolarHBondContact O-N 3.43Å; S142-I146 PolarHBondContact O-N 2.95Å
143V98.6Very high97.2Very high0 Ų038.1 Ų38.10%021%0.207CC..Hα-helixtrans-67.2-36.7177.5177.10000111.4A122 T124 I128 A133 H138 A141 L145 I146 I147A122-V143 HydrophobicContact CB-CG2 3.93Å; T124-V143 HydrophobicContact CG2-CG2 4.04Å; I128-V143 HydrophobicContact CG2-CG1 4Å; A133-V143 HydrophobicContact CB-CG1 4.34Å; H138-V143 HydrophobicContact CB-CG2 3.75Å; A141-V143 PolarHBondContact O-N 3.4Å; V143-L145 VanDerWaalsContact C-N 3.31Å; V143-L145 PolarHBondContact O-N 3.38Å; V143-I146 WeakPolarHBondContact O-CB 3.49Å; V143-I146 PolarHBondContact O-N 3.25Å; V143-I146 VanDerWaalsContact O-N 3.12Å; V143-I147 HydrophobicContact CG1-CD1 4.13Å; V143-I147 WeakPolarHBondContact O-CG1 3.23Å; V143-I147 PolarHBondContact O-N 3.48Å
144D98.5Very high97.2Very high18 Ų1838.7 Ų38.710%0.09621%0.213CC..Hα-helixtrans-63.3-39.3179.7-59.6-11.7000111.2A141 S142 I146 I147 F148 L210 R213 N214A141-D144 WeakPolarHBondContact O-CB 3.2Å; A141-D144 PolarHBondContact O-N 3.33Å; A141-D144 VanDerWaalsContact O-N 3.15Å; S142-D144 VanDerWaalsContact C-N 3.35Å; D144-I146 VanDerWaalsContact C-N 3.35Å; D144-I146 PolarHBondContact O-N 3.34Å; D144-I147 WeakPolarHBondContact O-CB 3.21Å; D144-I147 PolarHBondContact O-N 3.08Å; D144-I147 VanDerWaalsContact O-N 3.15Å; D144-F148 HydrophobicContact CB-CE2 4.39Å; D144-F148 WeakPolarHBondContact O-CD2 3.33Å; D144-F148 PolarHBondContact O-N 3.29Å; D144-L210 HydrophobicContact CB-CD1 3.89Å; D144-R213 WeakPolarHBondContact OD1-CD 3.41Å; D144-R213 IonicContact OD1-CZ 2.64Å; D144-R213 IonicContact OD1-NE 3.29Å; D144-R213 PolarHBondContact OD1-NE 3.46Å; D144-R213 IonicContact OD1-NH2 3.6Å; D144-N214 VanDerWaalsContact CG-ND2 3.31Å; D144-N214 PolarHBondContact OD1-ND2 3.25Å; D144-N214 PolarHBondContact OD2-ND2 2.88Å; D144-N214 PolarHBondContact OD2-OD1 2.94Å
145L98.7Very high97.3Very high32 Ų3241.1 Ų41.117%0.16822%0.224CC..Hα-helixtrans-64-36.4174.5-69.3174.2000112.4L111 A114 V118 A141 S142 V143 S149L111-L145 HydrophobicContact CD2-CD2 3.79Å; A114-L145 HydrophobicContact CB-CD1 4.16Å; V118-L145 HydrophobicContact CB-CD1 4.21Å; V118-L145 HydrophobicContact CG2-CD1 4Å; A141-L145 WeakPolarHBondContact O-CG 3.42Å; A141-L145 PolarHBondContact O-N 2.93Å; S142-L145 PolarHBondContact O-N 3.43Å; V143-L145 VanDerWaalsContact C-N 3.31Å; V143-L145 PolarHBondContact O-N 3.38Å; L145-S149 VanDerWaalsContact O-CB 3.3Å; L145-S149 WeakPolarHBondContact O-CB 3.33Å; L145-S149 PolarHBondContact O-N 3.07Å
146I98.4Very high97.5Very high4 Ų438.1 Ų38.12%0.02121%0.208CC..Hα-helixtrans-62.7-46170.5-63.1-162.8000110.1T59 F63 L112 S115 A122 I128 S142 V143 D144 F148 S149 L150T59-I146 HydrophobicContact CG2-CD1 4.06Å; F63-I146 HydrophobicContact CD2-CD1 4.34Å; F63-I146 HydrophobicContact CD2-CG2 4.33Å; F63-I146 HydrophobicContact CE2-CD1 4.01Å; F63-I146 HydrophobicContact CE2-CG2 3.75Å; F63-I146 HydrophobicContact CZ-CG2 3.98Å; L112-I146 HydrophobicContact CD1-CD1 4.3Å; L112-I146 HydrophobicContact CD1-CG1 4.17Å; S115-I146 WeakPolarHBondContact OG-CG1 3.4Å; A122-I146 HydrophobicContact CB-CD1 3.47Å; A122-I146 VanDerWaalsContact CB-CD1 3.47Å; A122-I146 HydrophobicContact CB-CG1 4.14Å; I128-I146 HydrophobicContact CD1-CG2 3.51Å; I128-I146 HydrophobicContact CG1-CG2 4.49Å; S142-I146 PolarHBondContact O-N 2.95Å; V143-I146 WeakPolarHBondContact O-CB 3.49Å; V143-I146 PolarHBondContact O-N 3.25Å; V143-I146 VanDerWaalsContact O-N 3.12Å; D144-I146 VanDerWaalsContact C-N 3.35Å; D144-I146 PolarHBondContact O-N 3.34Å; I146-F148 VanDerWaalsContact C-N 3.35Å; I146-F148 PolarHBondContact O-N 3.35Å; I146-S149 WeakPolarHBondContact O-CB 3.14Å; I146-S149 PolarHBondContact O-N 3.38Å; I146-L150 HydrophobicContact CG2-CD1 3.98Å; I146-L150 HydrophobicContact CG2-CG 4.21Å; I146-L150 WeakPolarHBondContact O-CG 3.46Å; I146-L150 PolarHBondContact O-N 2.88Å
147I98.8Very high97.8Very high0 Ų028.3 Ų28.30%017%0.173CC..Hα-helixtrans-60-46.2-179.8-66.6169.1000110.2V143 D144 L150 H151 I206 L209 L210V143-I147 HydrophobicContact CG1-CD1 4.13Å; V143-I147 WeakPolarHBondContact O-CG1 3.23Å; V143-I147 PolarHBondContact O-N 3.48Å; D144-I147 WeakPolarHBondContact O-CB 3.21Å; D144-I147 PolarHBondContact O-N 3.08Å; D144-I147 VanDerWaalsContact O-N 3.15Å; I147-L150 PolarHBondContact O-N 2.78Å; I147-H151 WeakPolarHBondContact CG2-CE1 3.1Å; I147-H151 WeakPolarHBondContact CG2-ND1 3.41Å; I147-H151 PolarHBondContact O-N 3.09Å; I147-H151 PolarHBondContact O-ND1 3.2Å; I147-I206 HydrophobicContact CG1-CB 4.36Å; I147-I206 HydrophobicContact CG2-CB 4.06Å; I147-I206 HydrophobicContact CG2-CD1 4.22Å; I147-I206 HydrophobicContact CG2-CG1 4.11Å; I147-L209 HydrophobicContact CD1-CB 4.49Å; I147-L209 HydrophobicContact CD1-CD2 4.19Å; I147-L209 HydrophobicContact CD1-CG 4.22Å; I147-L210 HydrophobicContact CB-CD1 4.47Å; I147-L210 HydrophobicContact CD1-CB 4.08Å; I147-L210 HydrophobicContact CD1-CD1 4.06Å; I147-L210 HydrophobicContact CG2-CB 4.17Å; I147-L210 HydrophobicContact CG2-CD1 4.36Å; I147-L210 HydrophobicContact CG2-CD2 4.28Å
148F98.8Very high98Very high101 Ų10127.8 Ų27.844%0.44317%0.166SC..Hα-helixtrans-64.9-39176-69.9-55.8000112.9L111 D144 I146 H151 L152 L210L111-F148 HydrophobicContact CD1-CB 3.94Å; D144-F148 HydrophobicContact CB-CE2 4.39Å; D144-F148 WeakPolarHBondContact O-CD2 3.33Å; D144-F148 PolarHBondContact O-N 3.29Å; I146-F148 VanDerWaalsContact C-N 3.35Å; I146-F148 PolarHBondContact O-N 3.35Å; F148-H151 PolarHBondContact O-N 2.9Å; F148-L152 PolarHBondContact O-N 3.44Å; F148-L210 HydrophobicContact CE1-CD2 3.96Å; F148-L210 HydrophobicContact CZ-CD2 3.93Å
149S98.8Very high98Very high0 Ų028.6 Ų28.60%017%0.171CC..Hα-helixtrans-55-52.5172.1165.90000110.9S108 L145 I146 H151 L152 A153S108-S149 WeakPolarHBondContact O-CB 3.09Å; S108-S149 PolarHBondContact O-OG 3.47Å; S108-S149 VanDerWaalsContact O-OG 3.04Å; S108-S149 PolarHBondContact OG-O 3.03Å; S108-S149 PolarHBondContact OG-OG 3.21Å; L145-S149 VanDerWaalsContact O-CB 3.3Å; L145-S149 WeakPolarHBondContact O-CB 3.33Å; L145-S149 PolarHBondContact O-N 3.07Å; I146-S149 WeakPolarHBondContact O-CB 3.14Å; I146-S149 PolarHBondContact O-N 3.38Å; S149-H151 VanDerWaalsContact C-N 3.34Å; S149-H151 PolarHBondContact O-N 3.5Å; S149-L152 PolarHBondContact O-N 3.47Å; S149-A153 PolarHBondContact O-N 3.48Å
150L98.6Very high98.3Very high5 Ų524.7 Ų24.73%0.02615%0.146CC..Hα-helixtrans-65.7-34-179.1-67.3179.2000112.9F63 F67 I128 I146 I147 G154 I206F63-L150 HydrophobicContact CD1-CD2 3.83Å; F63-L150 HydrophobicContact CE1-CD1 3.77Å; F63-L150 HydrophobicContact CE1-CD2 3.84Å; F63-L150 HydrophobicContact CE1-CG 4.31Å; F63-L150 HydrophobicContact CZ-CD1 4.07Å; F67-L150 HydrophobicContact CD1-CD2 4.24Å; F67-L150 HydrophobicContact CD2-CD2 4.13Å; F67-L150 HydrophobicContact CE1-CD2 4.27Å; F67-L150 HydrophobicContact CE2-CD2 4.13Å; F67-L150 HydrophobicContact CG-CD2 4.2Å; F67-L150 HydrophobicContact CZ-CD2 4.21Å; I128-L150 HydrophobicContact CD1-CD1 3.72Å; I146-L150 HydrophobicContact CG2-CD1 3.98Å; I146-L150 HydrophobicContact CG2-CG 4.21Å; I146-L150 WeakPolarHBondContact O-CG 3.46Å; I146-L150 PolarHBondContact O-N 2.88Å; I147-L150 PolarHBondContact O-N 2.78Å; L150-G154 PolarHBondContact O-N 3.34Å; L150-I206 HydrophobicContact CB-CD1 3.81Å
151H98.8Very high98.5Very high46 Ų4623.3 Ų23.321%0.21313%0.132CC..Hα-helixtrans-61.2-48.7171.5-79.999.9000112I147 F148 S149 A153 G154 V155 I206 T207I147-H151 WeakPolarHBondContact CG2-CE1 3.1Å; I147-H151 WeakPolarHBondContact CG2-ND1 3.41Å; I147-H151 PolarHBondContact O-N 3.09Å; I147-H151 PolarHBondContact O-ND1 3.2Å; F148-H151 PolarHBondContact O-N 2.9Å; S149-H151 VanDerWaalsContact C-N 3.34Å; S149-H151 PolarHBondContact O-N 3.5Å; H151-A153 PolarHBondContact O-N 3.39Å; H151-G154 PolarHBondContact O-N 3.33Å; H151-V155 WeakPolarHBondContact O-CG2 3.37Å; H151-V155 PolarHBondContact O-N 3.14Å; H151-I206 VanDerWaalsContact CE1-CG1 3.47Å; H151-I206 WeakPolarHBondContact CE1-CG1 3.44Å; H151-T207 PolarHBondContact CE1-OG1 2.98Å; H151-T207 PolarHBondContact NE2-OG1 3.32Å
152L98.7Very high98.6Very high52 Ų5224.3 Ų24.327%0.27213%0.131SC..Hα-helixtrans-63.8-42.1179.5-70.2-174.7000112L104 P107 L111 F148 S149 G154 V155 S156L104-L152 HydrophobicContact CD2-CD2 4.22Å; P107-L152 HydrophobicContact CB-CD1 4.38Å; P107-L152 HydrophobicContact CG-CD1 4.48Å; L111-L152 HydrophobicContact CD1-CD1 3.67Å; F148-L152 PolarHBondContact O-N 3.44Å; S149-L152 PolarHBondContact O-N 3.47Å; L152-G154 VanDerWaalsContact C-N 3.34Å; L152-V155 PolarHBondContact O-N 2.81Å; L152-S156 PolarHBondContact O-N 2.9Å
153A98.6Very high98.6Very high3 Ų324.1 Ų24.13%0.02513%0.13CC..Hα-helixtrans-63.6-39.8173.900000111.8L105 S149 H151 S156 S157L105-A153 HydrophobicContact CD2-CB 4.31Å; S149-A153 PolarHBondContact O-N 3.48Å; H151-A153 PolarHBondContact O-N 3.39Å; A153-S156 VanDerWaalsContact O-CB 3.31Å; A153-S156 WeakPolarHBondContact O-CB 3.49Å; A153-S156 PolarHBondContact O-N 2.83Å; A153-S157 PolarHBondContact O-N 3.36Å; A153-S157 PolarHBondContact O-OG 3.47Å
154G98.4Very high98.6Very high12 Ų1224.3 Ų24.312%0.12413%0.131CC..Hα-helixtrans-62.8-44.5175.800000112.7L150 H151 L152 S156 S157 I158L150-G154 PolarHBondContact O-N 3.34Å; H151-G154 PolarHBondContact O-N 3.33Å; L152-G154 VanDerWaalsContact C-N 3.34Å; G154-S156 VanDerWaalsContact C-N 3.35Å; G154-S156 PolarHBondContact O-N 2.7Å; G154-S157 PolarHBondContact O-N 3.14Å; G154-I158 WeakPolarHBondContact O-CG1 3.29Å; G154-I158 PolarHBondContact O-N 2.87Å
155V98.7Very high98.7Very high67 Ų6724.9 Ų24.941%0.40613%0.134SC..Hα-helixtrans-62.4-43.1175.2175.80000110.8L104 H151 L152 S157 I158 L159L104-V155 HydrophobicContact CD1-CB 4.19Å; L104-V155 HydrophobicContact CD1-CG1 3.68Å; H151-V155 WeakPolarHBondContact O-CG2 3.37Å; H151-V155 PolarHBondContact O-N 3.14Å; L152-V155 PolarHBondContact O-N 2.81Å; V155-S157 VanDerWaalsContact C-N 3.34Å; V155-S157 PolarHBondContact O-N 3.43Å; V155-I158 PolarHBondContact O-N 3.2Å; V155-L159 HydrophobicContact CG1-CD1 4.01Å; V155-L159 HydrophobicContact CG1-CG 4.28Å; V155-L159 VanDerWaalsContact O-CG 3.29Å; V155-L159 WeakPolarHBondContact O-CG 3.48Å; V155-L159 PolarHBondContact O-N 3.26Å
156S98.7Very high98.7Very high3 Ų324.8 Ų24.82%0.02114%0.135CC..Hα-helixtrans-52.1-52.4173.5174.40000111.6S101 L152 A153 G154 L159 G160S101-S156 VanDerWaalsContact CB-O 3.28Å; S101-S156 WeakPolarHBondContact CB-O 3.47Å; S101-S156 VanDerWaalsContact O-CB 3.28Å; S101-S156 WeakPolarHBondContact O-CB 3.36Å; S101-S156 PolarHBondContact O-OG 3.25Å; L152-S156 PolarHBondContact O-N 2.9Å; A153-S156 VanDerWaalsContact O-CB 3.31Å; A153-S156 WeakPolarHBondContact O-CB 3.49Å; A153-S156 PolarHBondContact O-N 2.83Å; G154-S156 VanDerWaalsContact C-N 3.35Å; G154-S156 PolarHBondContact O-N 2.7Å; S156-L159 PolarHBondContact O-N 3.28Å; S156-G160 PolarHBondContact O-N 3.24Å
157S98.3Very high98.6Very high24 Ų2424.6 Ų24.617%0.16813%0.134CC..Hα-helixtrans-68-37.1-177.5-67.10000113.6A153 G154 V155 G160 A161A153-S157 PolarHBondContact O-N 3.36Å; A153-S157 PolarHBondContact O-OG 3.47Å; G154-S157 PolarHBondContact O-N 3.14Å; V155-S157 VanDerWaalsContact C-N 3.34Å; V155-S157 PolarHBondContact O-N 3.43Å; S157-G160 PolarHBondContact O-N 3.11Å; S157-A161 VanDerWaalsContact O-CB 3.29Å; S157-A161 WeakPolarHBondContact O-CB 3.45Å; S157-A161 PolarHBondContact O-N 3.34Å
158I98.6Very high98.6Very high44 Ų4424.6 Ų24.623%0.22613%0.134CC..Hα-helixtrans-64.9-45.8175.9-70168.2000110.9G154 V155 G160 A161 I162 L196 L199G154-I158 WeakPolarHBondContact O-CG1 3.29Å; G154-I158 PolarHBondContact O-N 2.87Å; V155-I158 PolarHBondContact O-N 3.2Å; I158-G160 VanDerWaalsContact C-N 3.34Å; I158-G160 PolarHBondContact O-N 2.91Å; I158-A161 PolarHBondContact O-N 2.97Å; I158-I162 HydrophobicContact CG2-CD1 3.95Å; I158-I162 WeakPolarHBondContact O-CG1 3.32Å; I158-I162 PolarHBondContact O-N 3.32Å; I158-L196 HydrophobicContact CG2-CD1 4.19Å; I158-L199 HydrophobicContact CD1-CB 4.01Å; I158-L199 HydrophobicContact CG1-CB 4.02Å; I158-L199 HydrophobicContact CG1-CD1 3.82Å
159L98.6Very high98.5Very high31 Ų3124 Ų2416%0.16213%0.134CC..Hα-helixtrans-61.2-44.2177-68.7179.1000111.2M97 M100 L104 V155 S156 N163M97-L159 HydrophobicContact CE-CD2 4.36Å; M97-L159 HydrophobicContact CG-CB 3.83Å; M97-L159 HydrophobicContact CG-CD2 3.94Å; M97-L159 HydrophobicContact CG-CG 4.31Å; M97-L159 HydrophobicContact SD-CB 4.27Å; M97-L159 HydrophobicContact SD-CD2 4Å; M100-L159 HydrophobicContact CE-CD1 4.4Å; M100-L159 HydrophobicContact CG-CD1 4.17Å; M100-L159 HydrophobicContact SD-CD1 4.14Å; L104-L159 HydrophobicContact CD1-CD1 4.13Å; V155-L159 HydrophobicContact CG1-CD1 4.01Å; V155-L159 HydrophobicContact CG1-CG 4.28Å; V155-L159 VanDerWaalsContact O-CG 3.29Å; V155-L159 WeakPolarHBondContact O-CG 3.48Å; V155-L159 PolarHBondContact O-N 3.26Å; S156-L159 PolarHBondContact O-N 3.28Å; L159-N163 WeakPolarHBondContact O-CB 3.3Å; L159-N163 PolarHBondContact O-N 3.01Å; L159-N163 VanDerWaalsContact O-N 3.16Å
160G98.4Very high98.4Very high6 Ų629.5 Ų29.56%0.06216%0.164CC..Hα-helixtrans-59.8-45.7173.900000112.4S156 S157 I158 N163 F164S156-G160 PolarHBondContact O-N 3.24Å; S157-G160 PolarHBondContact O-N 3.11Å; I158-G160 VanDerWaalsContact C-N 3.34Å; I158-G160 PolarHBondContact O-N 2.91Å; G160-N163 WeakPolarHBondContact O-CB 3.42Å; G160-N163 PolarHBondContact O-N 3.45Å; G160-F164 WeakPolarHBondContact O-CD2 3.28Å; G160-F164 PolarHBondContact O-N 3.46Å
161A98.8Very high98.2Very high1 Ų132 Ų321%0.00818%0.176CC..Hα-helixtrans-60.5-46.9179.600000112.7S157 I158 N163 F164 I165 A192 L195S157-A161 VanDerWaalsContact O-CB 3.29Å; S157-A161 WeakPolarHBondContact O-CB 3.45Å; S157-A161 PolarHBondContact O-N 3.34Å; I158-A161 PolarHBondContact O-N 2.97Å; A161-N163 VanDerWaalsContact C-N 3.27Å; A161-N163 PolarHBondContact O-N 2.87Å; A161-F164 PolarHBondContact O-N 3.42Å; A161-I165 VanDerWaalsContact O-CG1 3.28Å; A161-I165 WeakPolarHBondContact O-CG1 3.3Å; A161-I165 PolarHBondContact O-N 3.44Å; A161-A192 HydrophobicContact CB-CB 4.03Å; A161-A192 WeakPolarHBondContact CB-O 3.18Å; A161-L195 HydrophobicContact CB-CB 4.03Å
162I98.8Very high97.9Very high58 Ų5831.5 Ų31.530%0.29717%0.173SC..Hα-helixtrans-58.4-43.2176.2-67.7166.4000110.3F94 M97 I158 T166 L196F94-I162 HydrophobicContact CD2-CG2 4.49Å; F94-I162 HydrophobicContact CE2-CG2 4.13Å; M97-I162 HydrophobicContact SD-CG2 4.41Å; I158-I162 HydrophobicContact CG2-CD1 3.95Å; I158-I162 WeakPolarHBondContact O-CG1 3.32Å; I158-I162 PolarHBondContact O-N 3.32Å; I162-T166 WeakPolarHBondContact O-CB 3.44Å; I162-T166 PolarHBondContact O-N 2.63Å; I162-T166 PolarHBondContact O-OG1 3.47Å; I162-L196 HydrophobicContact CD1-CD1 4.39Å; I162-L196 HydrophobicContact CG1-CD1 4.04Å
163N98.8Very high97.4Very high0 Ų029.5 Ų29.50%016%0.163CC..Hα-helixtrans-66.2-44.4179-17023.8000112.3M92 A93 F94 N98 L159 G160 A161 T166 T167M92-N163 HydrophobicContact CE-CB 4.33Å; M92-N163 WeakPolarHBondContact CE-ND2 3.32Å; A93-N163 PolarHBondContact N-OD1 2.99Å; F94-N163 HydrophobicContact CD2-CB 4.28Å; F94-N163 PolarHBondContact N-OD1 2.88Å; N98-N163 WeakPolarHBondContact CB-ND2 3.25Å; L159-N163 WeakPolarHBondContact O-CB 3.3Å; L159-N163 PolarHBondContact O-N 3.01Å; L159-N163 VanDerWaalsContact O-N 3.16Å; G160-N163 WeakPolarHBondContact O-CB 3.42Å; G160-N163 PolarHBondContact O-N 3.45Å; A161-N163 VanDerWaalsContact C-N 3.27Å; A161-N163 PolarHBondContact O-N 2.87Å; N163-T166 PolarHBondContact O-N 3.31Å; N163-T167 VanDerWaalsContact O-CB 3.26Å; N163-T167 WeakPolarHBondContact O-CB 3.34Å; N163-T167 PolarHBondContact O-N 3.14Å; N163-T167 PolarHBondContact O-OG1 2.87Å; N163-T167 PolarHBondContact OD1-OG1 3.26Å
164F98.8Very high96.7Very high3 Ų335.9 Ų35.91%0.01320%0.204CC..Hα-helixtrans-61.5-48.5175.4-79.6-60.2000112.3I75 G79 V83 M92 G160 A161 T166 T167 I168 V188 A192I75-F164 HydrophobicContact CG2-CD2 4.15Å; I75-F164 HydrophobicContact CG2-CE2 3.61Å; I75-F164 HydrophobicContact CG2-CZ 4.46Å; I75-F164 VanDerWaalsContact O-CZ 3.31Å; I75-F164 WeakPolarHBondContact O-CZ 3.22Å; G79-F164 VanDerWaalsContact C-CE1 3.46Å; V83-F164 HydrophobicContact CB-CD1 4.38Å; V83-F164 HydrophobicContact CB-CE1 4.26Å; V83-F164 HydrophobicContact CG1-CD1 4.36Å; V83-F164 HydrophobicContact CG2-CD1 4.23Å; V83-F164 HydrophobicContact CG2-CE1 4.14Å; M92-F164 HydrophobicContact CE-CD1 3.43Å; M92-F164 VanDerWaalsContact CE-CD1 3.43Å; M92-F164 HydrophobicContact CE-CE1 3.55Å; M92-F164 HydrophobicContact CE-CG 4.02Å; M92-F164 HydrophobicContact CE-CZ 4.24Å; M92-F164 HydrophobicContact SD-CD1 4.35Å; M92-F164 HydrophobicContact SD-CE1 4.19Å; G160-F164 WeakPolarHBondContact O-CD2 3.28Å; G160-F164 PolarHBondContact O-N 3.46Å; A161-F164 PolarHBondContact O-N 3.42Å; F164-T166 VanDerWaalsContact C-N 3.34Å; F164-T166 PolarHBondContact O-N 3.29Å; F164-T167 PolarHBondContact O-N 3.3Å; F164-I168 WeakPolarHBondContact O-CB 3.15Å; F164-I168 VanDerWaalsContact O-CG1 3.24Å; F164-I168 WeakPolarHBondContact O-CG1 3.35Å; F164-I168 PolarHBondContact O-N 3.4Å; F164-V188 HydrophobicContact CB-CG1 4.31Å; F164-V188 HydrophobicContact CD1-CG1 3.78Å; F164-V188 HydrophobicContact CD2-CG1 4.31Å; F164-V188 HydrophobicContact CE1-CG1 4.21Å; F164-V188 HydrophobicContact CG-CG1 3.88Å; F164-A192 HydrophobicContact CB-CB 4.05Å
165I98.8Very high96.1Very high31 Ų3137.9 Ų37.916%0.15922%0.22CC..Hα-helixtrans-57-50.5178.6-68.6164.5000109.9A161 T167 I168 I169 L189 A192 V193 L196A161-I165 VanDerWaalsContact O-CG1 3.28Å; A161-I165 WeakPolarHBondContact O-CG1 3.3Å; A161-I165 PolarHBondContact O-N 3.44Å; I165-T167 PolarHBondContact O-N 3.3Å; I165-I168 PolarHBondContact O-N 3.04Å; I165-I169 HydrophobicContact CG2-CD1 3.68Å; I165-I169 WeakPolarHBondContact O-CB 3.37Å; I165-I169 VanDerWaalsContact O-CG1 3.28Å; I165-I169 WeakPolarHBondContact O-CG1 3.38Å; I165-I169 PolarHBondContact O-N 3.28Å; I165-L189 HydrophobicContact CG1-CD1 4.2Å; I165-A192 HydrophobicContact CD1-CB 4.16Å; I165-A192 HydrophobicContact CG1-CB 3.74Å; I165-V193 HydrophobicContact CD1-CG2 4.07Å; I165-V193 HydrophobicContact CG1-CG2 4.32Å; I165-L196 HydrophobicContact CD1-CD2 4.02Å
166T98.6Very high95.6Very high30 Ų3035.4 Ų35.418%0.18420%0.204CC..Hα-helixtrans-62.9-44.2-178.5-52.30000111.6A93 F94 I162 N163 F164 N170A93-T166 HydrophobicContact CB-CG2 3.72Å; F94-T166 HydrophobicContact CE2-CG2 3.8Å; F94-T166 WeakPolarHBondContact CE2-OG1 3.44Å; F94-T166 HydrophobicContact CZ-CG2 3.75Å; I162-T166 WeakPolarHBondContact O-CB 3.44Å; I162-T166 PolarHBondContact O-N 2.63Å; I162-T166 PolarHBondContact O-OG1 3.47Å; N163-T166 PolarHBondContact O-N 3.31Å; F164-T166 VanDerWaalsContact C-N 3.34Å; F164-T166 PolarHBondContact O-N 3.29Å; T166-N170 VanDerWaalsContact O-CB 3.29Å; T166-N170 WeakPolarHBondContact O-CB 3.46Å; T166-N170 PolarHBondContact O-N 3.01Å
167T98.4Very high95.3Very high0 Ų038.9 Ų38.90%023%0.225CC..Hα-helixtrans-62.6-51.5179.2-57.40000111I87 M92 A93 N163 F164 I165 I169 M171I87-T167 HydrophobicContact CD1-CG2 3.96Å; M92-T167 HydrophobicContact CE-CG2 4.46Å; M92-T167 HydrophobicContact SD-CG2 3.82Å; A93-T167 WeakPolarHBondContact CB-OG1 3.4Å; A93-T167 PolarHBondContact N-OG1 2.81Å; N163-T167 VanDerWaalsContact O-CB 3.26Å; N163-T167 WeakPolarHBondContact O-CB 3.34Å; N163-T167 PolarHBondContact O-N 3.14Å; N163-T167 PolarHBondContact O-OG1 2.87Å; N163-T167 PolarHBondContact OD1-OG1 3.26Å; F164-T167 PolarHBondContact O-N 3.3Å; I165-T167 PolarHBondContact O-N 3.3Å; T167-I169 VanDerWaalsContact C-N 3.34Å; T167-I169 PolarHBondContact O-N 3.44Å; T167-M171 HydrophobicContact CG2-CB 4.35Å; T167-M171 HydrophobicContact CG2-SD 3.99Å; T167-M171 WeakPolarHBondContact O-CB 3.41Å; T167-M171 PolarHBondContact O-N 2.85Å
168I98.3Very high95.1Very high0 Ų039.7 Ų39.70%023%0.226CC..Hα-helixtrans-64.7-39.4-176.9-66.4170.1000110.9V83 F164 I165 K172 V185 V188 L189V83-I168 HydrophobicContact CG1-CD1 3.97Å; V83-I168 HydrophobicContact CG1-CG1 3.52Å; F164-I168 WeakPolarHBondContact O-CB 3.15Å; F164-I168 VanDerWaalsContact O-CG1 3.24Å; F164-I168 WeakPolarHBondContact O-CG1 3.35Å; F164-I168 PolarHBondContact O-N 3.4Å; I165-I168 PolarHBondContact O-N 3.04Å; I168-K172 WeakPolarHBondContact O-CD 3.49Å; I168-K172 VanDerWaalsContact O-CG 3.25Å; I168-K172 WeakPolarHBondContact O-CG 3.34Å; I168-K172 PolarHBondContact O-NZ 3.49Å; I168-V185 HydrophobicContact CB-CG1 4.41Å; I168-V185 HydrophobicContact CD1-CG1 3.94Å; I168-V185 HydrophobicContact CG1-CG1 3.87Å; I168-V185 HydrophobicContact CG2-CG1 3.69Å; I168-V188 HydrophobicContact CD1-CB 4.47Å; I168-V188 HydrophobicContact CD1-CG1 4.31Å; I168-L189 HydrophobicContact CB-CD1 4.4Å; I168-L189 HydrophobicContact CD1-CB 3.9Å; I168-L189 HydrophobicContact CD1-CD1 4.49Å; I168-L189 HydrophobicContact CG2-CB 4.31Å; I168-L189 HydrophobicContact CG2-CD1 4.29Å; I168-L189 HydrophobicContact CG2-CD2 4.11Å; I168-L189 HydrophobicContact CG2-CG 4.47Å
169I96.6Very high94.7Very high87 Ų8742.8 Ų42.845%0.44624%0.236SC..Hα-helixtrans-75.6-44.9-177.8-64.3175.4000111I165 T167 K172I165-I169 HydrophobicContact CG2-CD1 3.68Å; I165-I169 WeakPolarHBondContact O-CB 3.37Å; I165-I169 VanDerWaalsContact O-CG1 3.28Å; I165-I169 WeakPolarHBondContact O-CG1 3.38Å; I165-I169 PolarHBondContact O-N 3.28Å; T167-I169 VanDerWaalsContact C-N 3.34Å; T167-I169 PolarHBondContact O-N 3.44Å; I169-K172 PolarHBondContact O-NZ 2.89Å
170N96.1Very high94.3Very high117 Ų11745.4 Ų45.463%0.62625%0.247SC*.Hα-helixtrans-103.6-21.5-165-64.2-29.3000115.8T166T166-N170 VanDerWaalsContact O-CB 3.29Å; T166-N170 WeakPolarHBondContact O-CB 3.46Å; T166-N170 PolarHBondContact O-N 3.01Å
171M95.2Very high94.1Very high58 Ų5845.1 Ų45.129%0.28624%0.244SC..SBendtrans-100.97.1-171.5-60.5-172.770.100114.5A89 D91 A93 T167A89-M171 HydrophobicContact CB-CB 4Å; A89-M171 HydrophobicContact CB-CE 4.48Å; D91-M171 WeakPolarHBondContact O-CE 3.24Å; A93-M171 WeakPolarHBondContact CA-SD 3.5Å; A93-M171 HydrophobicContact CB-CG 4.45Å; A93-M171 HydrophobicContact CB-SD 3.63Å; A93-M171 PolarHBondContact N-SD 3.38Å; T167-M171 HydrophobicContact CG2-CB 4.35Å; T167-M171 HydrophobicContact CG2-SD 3.99Å; T167-M171 WeakPolarHBondContact O-CB 3.41Å; T167-M171 PolarHBondContact O-N 2.85Å
172K91.7Very high93.9Very high34 Ų3446.7 Ų46.715%0.14825%0.254CS..SBendtrans-68.3149.5173.1-58.1-174.3-63.4-77.60110.6I87 I168 I169 M176 T181I87-K172 HydrophobicContact CB-CG 4.2Å; I87-K172 HydrophobicContact CD1-CG 4.42Å; I87-K172 HydrophobicContact CG2-CG 4.47Å; I168-K172 WeakPolarHBondContact O-CD 3.49Å; I168-K172 VanDerWaalsContact O-CG 3.25Å; I168-K172 WeakPolarHBondContact O-CG 3.34Å; I168-K172 PolarHBondContact O-NZ 3.49Å; I169-K172 PolarHBondContact O-NZ 2.89Å; K172-M176 HydrophobicContact CB-CB 4.49Å; K172-M176 HydrophobicContact CB-SD 4.48Å; K172-M176 HydrophobicContact CD-SD 4.22Å; K172-M176 HydrophobicContact CG-SD 4.5Å; K172-T181 HydrophobicContact CD-CG2 3.46Å; K172-T181 VanDerWaalsContact CD-CG2 3.46Å
173P88.3Confident93.8Very high11 Ų1144.2 Ų44.27%0.07124%0.242CC..  trans-52.7140.6167.5-27.232.8000111I87 A175 M176I87-P173 WeakPolarHBondContact O-CD 3.47Å; P173-A175 PolarHBondContact O-N 3.28Å; P173-M176 PolarHBondContact O-N 3.38Å
174P84.5Confident93.8Very high136 Ų13644.2 Ų44.288%0.88324%0.242SC*.THydrogen-bonded Turntrans-55.8-24.8-176.8-28.535000115.2
175A85.3Confident93.8Very high54 Ų5444 Ų4445%0.44624%0.241SC..THydrogen-bonded Turntrans-79.6-15.9178.300000113.9P173P173-A175 PolarHBondContact O-N 3.28Å
176M88.8Confident93.8Very high15 Ų1543.3 Ų43.37%0.07424%0.236CC..  trans-93.4113.8-175.9-170.4-171.9-137.600110.9K172 P173 Q180 T181 M511K172-M176 HydrophobicContact CB-CB 4.49Å; K172-M176 HydrophobicContact CB-SD 4.48Å; K172-M176 HydrophobicContact CD-SD 4.22Å; K172-M176 HydrophobicContact CG-SD 4.5Å; P173-M176 PolarHBondContact O-N 3.38Å; M176-Q180 WeakPolarHBondContact CE-O 3.26Å; M176-Q180 HydrophobicContact CG-CB 4.21Å; M176-T181 HydrophobicContact CE-CG2 4.34Å; M176-T181 HydrophobicContact SD-CG2 3.98Å; M176-M511 HydrophobicContact CE-CE 4.07Å
177T91.9Very high93.8Very high76 Ų7641.9 Ų41.947%0.46623%0.228SC..  trans-75.6160.4170.568.90000111.2Y179 Q180T177-Y179 VanDerWaalsContact C-N 3.25Å; T177-Y179 PolarHBondContact O-N 2.96Å; T177-Q180 PolarHBondContact O-N 3.39Å; T177-Q180 WeakPolarHBondContact OG1-CG 3.34Å; T177-Q180 PolarHBondContact OG1-OE1 3.28Å
178Q93Very high93.8Very high41 Ų4141.9 Ų41.919%0.19223%0.228CC..G310 helixtrans-60.1-36.2178-171.659.736.500112.3Q180 T181 W186Q178-Q180 PolarHBondContact O-N 2.86Å; Q178-T181 PolarHBondContact NE2-OG1 3.19Å; Q178-T181 PolarHBondContact O-N 3.45Å; Q178-T181 VanDerWaalsContact O-N 3.17Å; Q178-T181 PolarHBondContact O-OG1 3.06Å; Q178-W186 HydrophobicContact CB-CZ2 4.38Å; Q178-W186 HydrophobicContact CG-CH2 3.56Å; Q178-W186 HydrophobicContact CG-CZ2 3.52Å; Q178-W186 HydrophobicContact CG-CZ3 4.3Å; Q178-W186 WeakPolarHBondContact O-CZ2 3.48Å; Q178-W186 PolarHBondContact O-NE1 3.25Å; Q178-W186 VanDerWaalsContact O-NE1 3.17Å
179Y91.8Very high93.8Very high109 Ų10942.8 Ų42.843%0.42723%0.232SC..G310 helixtrans-70.6-9.2177.2-67.8-66.2000113.8T177 W186 Y270 M271T177-Y179 VanDerWaalsContact C-N 3.25Å; T177-Y179 PolarHBondContact O-N 2.96Å; Y179-W186 AromaticContact CD1-CZ2 3.86Å; Y179-W186 HydrophobicContact CD1-CZ2 3.86Å; Y179-W186 HydrophobicContact CE1-CH2 4.38Å; Y179-W186 HydrophobicContact CE1-CZ2 4.15Å; Y179-Y270 WeakPolarHBondContact O-CE1 3.23Å; Y179-Y270 PolarHBondContact O-OH 3.33Å; Y179-M271 HydrophobicContact CD1-CE 3.49Å; Y179-M271 VanDerWaalsContact CD1-CE 3.49Å; Y179-M271 HydrophobicContact CD1-SD 3.85Å; Y179-M271 HydrophobicContact CE1-CE 3.7Å; Y179-M271 HydrophobicContact CG-CE 4.15Å; Y179-M271 HydrophobicContact CG-SD 4.33Å
180Q90.3Very high93.9Very high86 Ų8639.4 Ų39.440%0.40222%0.215SC..G310 helixtrans-96.1-1.4173.8-69.4164.3-54.600112.8M176 T177 Q178M176-Q180 WeakPolarHBondContact CE-O 3.26Å; M176-Q180 HydrophobicContact CG-CB 4.21Å; T177-Q180 PolarHBondContact O-N 3.39Å; T177-Q180 WeakPolarHBondContact OG1-CG 3.34Å; T177-Q180 PolarHBondContact OG1-OE1 3.28Å; Q178-Q180 PolarHBondContact O-N 2.86Å
181T93.8Very high94Very high0 Ų033.8 Ų33.80%019%0.185CC..SBendtrans-73.9145.2179.360.40000112.1K172 M176 Q178 W186 Y270K172-T181 HydrophobicContact CD-CG2 3.46Å; K172-T181 VanDerWaalsContact CD-CG2 3.46Å; M176-T181 HydrophobicContact CE-CG2 4.34Å; M176-T181 HydrophobicContact SD-CG2 3.98Å; Q178-T181 PolarHBondContact NE2-OG1 3.19Å; Q178-T181 PolarHBondContact O-N 3.45Å; Q178-T181 VanDerWaalsContact O-N 3.17Å; Q178-T181 PolarHBondContact O-OG1 3.06Å; T181-W186 VanDerWaalsContact OG1-CD1 3.3Å; T181-W186 PolarHBondContact OG1-NE1 3.33Å; T181-Y270 PolarHBondContact O-OH 3.09Å
182P94.9Very high94.2Very high34 Ų3431.1 Ų31.122%0.22117%0.172CC..  trans-61.5154.7-178.8-24.134.6000113.8M86 F184 V185 W186 H256M86-P182 HydrophobicContact CB-CG 4.21Å; P182-F184 PolarHBondContact O-N 3.11Å; P182-V185 HydrophobicContact CB-CG2 4.47Å; P182-V185 HydrophobicContact CG-CG2 4.49Å; P182-V185 WeakPolarHBondContact O-CB 3.44Å; P182-V185 PolarHBondContact O-N 2.88Å; P182-W186 PolarHBondContact O-N 2.99Å; P182-W186 VanDerWaalsContact O-N 3.12Å; P182-H256 WeakPolarHBondContact CB-CE1 3.43Å; P182-H256 VanDerWaalsContact CB-NE2 3.26Å; P182-H256 WeakPolarHBondContact CB-NE2 3.26Å
183L97Very high94.5Very high6 Ų632.4 Ų32.43%0.03118%0.183CC..Hα-helixtrans-61.6-28.5-176.6-70.2-174.1000113.4W186 S187 P267 Y270 M273 V274 M277L183-W186 PolarHBondContact O-N 3.02Å; L183-S187 WeakPolarHBondContact O-CB 3.29Å; L183-S187 PolarHBondContact O-N 2.89Å; L183-P267 HydrophobicContact CD1-CB 4.4Å; L183-P267 HydrophobicContact CD1-CG 3.46Å; L183-P267 VanDerWaalsContact CD1-CG 3.46Å; L183-P267 HydrophobicContact CG-CG 4.26Å; L183-Y270 HydrophobicContact CD1-CD2 4.39Å; L183-Y270 HydrophobicContact CD2-CD2 3.59Å; L183-Y270 HydrophobicContact CD2-CE2 3.41Å; L183-Y270 VanDerWaalsContact CD2-CE2 3.41Å; L183-Y270 HydrophobicContact CG-CD2 3.79Å; L183-Y270 HydrophobicContact CG-CE2 3.78Å; L183-M273 HydrophobicContact CD1-CB 3.87Å; L183-M273 HydrophobicContact CD1-CE 3.69Å; L183-M273 HydrophobicContact CD1-CG 4.36Å; L183-M273 HydrophobicContact CD1-SD 3.55Å; L183-M273 VanDerWaalsContact CD1-SD 3.55Å; L183-M273 HydrophobicContact CD2-CB 4.19Å; L183-V274 HydrophobicContact CD2-CG2 3.54Å; L183-M277 HydrophobicContact CB-CE 4.4Å; L183-M277 HydrophobicContact CD2-CE 3.74Å
184F98Very high95Very high0 Ų032.1 Ų32.10%018%0.18CC..Hα-helixtrans-63-44.4171.7-179.2-102.9000111.7F78 L82 V83 M86 P182 W186 S187 V188 P249 M253 H256F78-F184 HydrophobicContact CB-CE2 4.37Å; F78-F184 HydrophobicContact CB-CZ 3.79Å; L82-F184 HydrophobicContact CB-CD1 4.1Å; L82-F184 HydrophobicContact CB-CE1 3.74Å; L82-F184 HydrophobicContact CD1-CD1 4.34Å; L82-F184 HydrophobicContact CD1-CE1 4.02Å; L82-F184 HydrophobicContact CD1-CZ 4.28Å; L82-F184 HydrophobicContact CG-CE1 4.47Å; V83-F184 HydrophobicContact CG2-CE1 4.19Å; M86-F184 HydrophobicContact CE-CD1 4.41Å; M86-F184 HydrophobicContact SD-CB 4.01Å; M86-F184 HydrophobicContact SD-CD1 3.73Å; M86-F184 HydrophobicContact SD-CG 4.26Å; P182-F184 PolarHBondContact O-N 3.11Å; F184-W186 PolarHBondContact O-N 2.91Å; F184-S187 WeakPolarHBondContact CA-OG 3.18Å; F184-S187 PolarHBondContact O-N 3.36Å; F184-S187 VanDerWaalsContact O-N 3.13Å; F184-S187 PolarHBondContact O-OG 3.29Å; F184-V188 HydrophobicContact CD1-CG2 4.3Å; F184-V188 HydrophobicContact CE1-CG2 3.79Å; F184-V188 HydrophobicContact CE2-CG2 4.1Å; F184-V188 HydrophobicContact CZ-CG2 3.69Å; F184-V188 WeakPolarHBondContact O-CG2 3.3Å; F184-V188 PolarHBondContact O-N 3.2Å; F184-P249 HydrophobicContact CE2-CB 4.34Å; F184-M253 HydrophobicContact CD2-CG 3.74Å; F184-M253 HydrophobicContact CE2-CG 3.64Å; F184-M253 HydrophobicContact CE2-SD 4.45Å; F184-H256 VanDerWaalsContact CB-CD2 3.44Å; F184-H256 WeakPolarHBondContact CB-CD2 3.43Å; F184-H256 VanDerWaalsContact CB-NE2 3.34Å; F184-H256 WeakPolarHBondContact CB-NE2 3.2Å; F184-H256 PolarHBondContact N-NE2 2.92Å
185V98.3Very high95.7Very high0 Ų025.7 Ų25.70%014%0.139CC..Hα-helixtrans-61.8-44.1177.31800000111.1M86 I87 I168 P182 S187 V188 L189M86-V185 HydrophobicContact CB-CG2 3.73Å; M86-V185 HydrophobicContact SD-CG2 4.34Å; I87-V185 HydrophobicContact CG2-CB 4.43Å; I87-V185 HydrophobicContact CG2-CG1 3.74Å; I87-V185 HydrophobicContact CG2-CG2 3.9Å; I168-V185 HydrophobicContact CB-CG1 4.41Å; I168-V185 HydrophobicContact CD1-CG1 3.94Å; I168-V185 HydrophobicContact CG1-CG1 3.87Å; I168-V185 HydrophobicContact CG2-CG1 3.69Å; P182-V185 HydrophobicContact CB-CG2 4.47Å; P182-V185 HydrophobicContact CG-CG2 4.49Å; P182-V185 WeakPolarHBondContact O-CB 3.44Å; P182-V185 PolarHBondContact O-N 2.88Å; V185-S187 VanDerWaalsContact C-N 3.32Å; V185-S187 PolarHBondContact O-N 3.01Å; V185-V188 PolarHBondContact O-N 3.36Å; V185-L189 WeakPolarHBondContact O-CB 3.3Å; V185-L189 PolarHBondContact O-N 2.83Å
186W98.4Very high96.3Very high16 Ų1626.2 Ų26.26%0.06113%0.134CC..Hα-helixtrans-58.1-44172.5-88.7109000112.7Q178 Y179 T181 P182 L183 F184 V188 L189 I190 Y270 V274 M277 M278Q178-W186 HydrophobicContact CB-CZ2 4.38Å; Q178-W186 HydrophobicContact CG-CH2 3.56Å; Q178-W186 HydrophobicContact CG-CZ2 3.52Å; Q178-W186 HydrophobicContact CG-CZ3 4.3Å; Q178-W186 WeakPolarHBondContact O-CZ2 3.48Å; Q178-W186 PolarHBondContact O-NE1 3.25Å; Q178-W186 VanDerWaalsContact O-NE1 3.17Å; Y179-W186 AromaticContact CD1-CZ2 3.86Å; Y179-W186 HydrophobicContact CD1-CZ2 3.86Å; Y179-W186 HydrophobicContact CE1-CH2 4.38Å; Y179-W186 HydrophobicContact CE1-CZ2 4.15Å; T181-W186 VanDerWaalsContact OG1-CD1 3.3Å; T181-W186 PolarHBondContact OG1-NE1 3.33Å; P182-W186 PolarHBondContact O-N 2.99Å; P182-W186 VanDerWaalsContact O-N 3.12Å; L183-W186 PolarHBondContact O-N 3.02Å; F184-W186 PolarHBondContact O-N 2.91Å; W186-V188 VanDerWaalsContact C-N 3.34Å; W186-V188 PolarHBondContact O-N 3.45Å; W186-L189 HydrophobicContact CE3-CD2 4.19Å; W186-L189 HydrophobicContact CZ3-CD2 4.17Å; W186-L189 PolarHBondContact O-N 3.43Å; W186-I190 WeakPolarHBondContact O-CG1 3.38Å; W186-I190 PolarHBondContact O-N 3.46Å; W186-Y270 PolarHBondContact NE1-OH 2.65Å; W186-Y270 VanDerWaalsContact NE1-OH 3.13Å; W186-V274 HydrophobicContact CD2-CG1 3.81Å; W186-V274 HydrophobicContact CD2-CG2 4.4Å; 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 4.09Å; W186-V274 HydrophobicContact CZ2-CG1 3.78Å; W186-V274 HydrophobicContact CZ3-CG1 4.25Å; W186-M277 HydrophobicContact CB-CE 3.72Å; W186-M278 HydrophobicContact CH2-SD 4.41Å; W186-M278 HydrophobicContact CZ3-SD 3.99Å
187S98.4Very high96.7Very high0 Ų030.2 Ų30.20%016%0.155CC..Hα-helixtrans-64.3-39.3-179.874.30000112.5L183 F184 V185 T191 L248 P249L183-S187 WeakPolarHBondContact O-CB 3.29Å; L183-S187 PolarHBondContact O-N 2.89Å; F184-S187 WeakPolarHBondContact CA-OG 3.18Å; F184-S187 PolarHBondContact O-N 3.36Å; F184-S187 VanDerWaalsContact O-N 3.13Å; F184-S187 PolarHBondContact O-OG 3.29Å; V185-S187 VanDerWaalsContact C-N 3.32Å; V185-S187 PolarHBondContact O-N 3.01Å; S187-T191 WeakPolarHBondContact O-CB 3.34Å; S187-T191 PolarHBondContact O-N 3.39Å; S187-T191 PolarHBondContact O-OG1 3.4Å; S187-L248 WeakPolarHBondContact CB-O 3.3Å; S187-P249 WeakPolarHBondContact OG-CA 3.3Å
188V98.8Very high97Very high0 Ų026.6 Ų26.60%013%0.133CC..Hα-helixtrans-69-40.1175176.10000110.9I75 V83 F164 I168 F184 V185 W186 I190 T191 A192I75-V188 HydrophobicContact CD1-CG1 4.36Å; I75-V188 HydrophobicContact CD1-CG2 4.39Å; V83-V188 HydrophobicContact CG2-CB 4.11Å; V83-V188 HydrophobicContact CG2-CG1 3.99Å; V83-V188 HydrophobicContact CG2-CG2 4.11Å; F164-V188 HydrophobicContact CB-CG1 4.31Å; F164-V188 HydrophobicContact CD1-CG1 3.78Å; F164-V188 HydrophobicContact CD2-CG1 4.31Å; F164-V188 HydrophobicContact CE1-CG1 4.21Å; F164-V188 HydrophobicContact CG-CG1 3.88Å; I168-V188 HydrophobicContact CD1-CB 4.47Å; I168-V188 HydrophobicContact CD1-CG1 4.31Å; F184-V188 HydrophobicContact CD1-CG2 4.3Å; F184-V188 HydrophobicContact CE1-CG2 3.79Å; F184-V188 HydrophobicContact CE2-CG2 4.1Å; F184-V188 HydrophobicContact CZ-CG2 3.69Å; F184-V188 WeakPolarHBondContact O-CG2 3.3Å; F184-V188 PolarHBondContact O-N 3.2Å; V185-V188 PolarHBondContact O-N 3.36Å; W186-V188 VanDerWaalsContact C-N 3.34Å; W186-V188 PolarHBondContact O-N 3.45Å; V188-I190 PolarHBondContact O-N 3.32Å; V188-T191 PolarHBondContact O-N 2.87Å; V188-A192 WeakPolarHBondContact O-CB 3.12Å; V188-A192 PolarHBondContact O-N 3.39Å
189L98.8Very high97.2Very high18 Ų1825 Ų259%0.09413%0.125CC..Hα-helixtrans-59.1-49.3176.4178.361.1000111.7I165 I168 V185 W186 T191 A192 V193I165-L189 HydrophobicContact CG1-CD1 4.2Å; I168-L189 HydrophobicContact CB-CD1 4.4Å; I168-L189 HydrophobicContact CD1-CB 3.9Å; I168-L189 HydrophobicContact CD1-CD1 4.49Å; I168-L189 HydrophobicContact CG2-CB 4.31Å; I168-L189 HydrophobicContact CG2-CD1 4.29Å; I168-L189 HydrophobicContact CG2-CD2 4.11Å; I168-L189 HydrophobicContact CG2-CG 4.47Å; V185-L189 WeakPolarHBondContact O-CB 3.3Å; V185-L189 PolarHBondContact O-N 2.83Å; W186-L189 HydrophobicContact CE3-CD2 4.19Å; W186-L189 HydrophobicContact CZ3-CD2 4.17Å; W186-L189 PolarHBondContact O-N 3.43Å; L189-T191 VanDerWaalsContact C-N 3.33Å; L189-T191 PolarHBondContact O-N 2.91Å; L189-A192 PolarHBondContact O-N 3.26Å; L189-V193 WeakPolarHBondContact O-CG2 3.45Å; L189-V193 PolarHBondContact O-N 3.17Å; L189-V193 VanDerWaalsContact O-N 3.08Å
190I98.8Very high97.5Very high16 Ų1622.9 Ų22.98%0.08213%0.125CC..Hα-helixtrans-63.3-44.8179.2-64.3162.8000109.5W186 V188 A192 V193 L194 L248 M277 M278W186-I190 WeakPolarHBondContact O-CG1 3.38Å; W186-I190 PolarHBondContact O-N 3.46Å; V188-I190 PolarHBondContact O-N 3.32Å; I190-A192 VanDerWaalsContact C-N 3.33Å; I190-A192 PolarHBondContact O-N 3.48Å; I190-V193 PolarHBondContact O-N 3.4Å; I190-V193 VanDerWaalsContact O-N 3.14Å; I190-L194 HydrophobicContact CG2-CG 4.47Å; I190-L194 WeakPolarHBondContact O-CG 3.25Å; I190-L194 PolarHBondContact O-N 2.99Å; I190-L248 HydrophobicContact CG2-CD1 3.81Å; I190-M277 HydrophobicContact CD1-CB 3.38Å; I190-M278 HydrophobicContact CD1-CG 3.79Å; I190-M278 HydrophobicContact CG1-CG 4.33Å
191T98.7Very high97.9Very high0 Ų020.4 Ų20.40%012%0.115CC..Hα-helixtrans-58.5-42.9177.1-57.10000112.4I75 S187 V188 L189 V193 L194 L195 I245 L248 P249I75-T191 HydrophobicContact CD1-CG2 3.52Å; I75-T191 HydrophobicContact CG1-CG2 3.93Å; S187-T191 WeakPolarHBondContact O-CB 3.34Å; S187-T191 PolarHBondContact O-N 3.39Å; S187-T191 PolarHBondContact O-OG1 3.4Å; V188-T191 PolarHBondContact O-N 2.87Å; L189-T191 VanDerWaalsContact C-N 3.33Å; L189-T191 PolarHBondContact O-N 2.91Å; T191-V193 VanDerWaalsContact C-N 3.34Å; T191-V193 PolarHBondContact O-N 3.35Å; T191-L194 PolarHBondContact O-N 3.14Å; T191-L195 HydrophobicContact CG2-CD1 4.2Å; T191-L195 WeakPolarHBondContact O-CG 3.2Å; T191-L195 PolarHBondContact O-N 3.15Å; T191-I245 HydrophobicContact CG2-CB 3.89Å; T191-I245 HydrophobicContact CG2-CG1 3.98Å; T191-I245 HydrophobicContact CG2-CG2 3.57Å; T191-L248 WeakPolarHBondContact OG1-CB 3.28Å; T191-P249 HydrophobicContact CG2-CG 4.3Å; T191-P249 WeakPolarHBondContact OG1-CD 3.47Å
192A98.8Very high98.1Very high2 Ų220.7 Ų20.72%0.01712%0.117CC..Hα-helixtrans-63.3-39176.700000112.1A161 F164 I165 V188 L189 I190 L195 L196A161-A192 HydrophobicContact CB-CB 4.03Å; A161-A192 WeakPolarHBondContact CB-O 3.18Å; F164-A192 HydrophobicContact CB-CB 4.05Å; I165-A192 HydrophobicContact CD1-CB 4.16Å; I165-A192 HydrophobicContact CG1-CB 3.74Å; V188-A192 WeakPolarHBondContact O-CB 3.12Å; V188-A192 PolarHBondContact O-N 3.39Å; L189-A192 PolarHBondContact O-N 3.26Å; I190-A192 VanDerWaalsContact C-N 3.33Å; I190-A192 PolarHBondContact O-N 3.48Å; A192-L195 PolarHBondContact O-N 2.99Å; A192-L196 WeakPolarHBondContact O-CB 3.45Å; A192-L196 PolarHBondContact O-N 3.41Å
193V98.8Very high98.3Very high61 Ų6120.6 Ų20.637%0.3712%0.119SC..Hα-helixtrans-64.4-43.9173.5172.70000111.2I165 L189 I190 T191 L195 L196 L197I165-V193 HydrophobicContact CD1-CG2 4.07Å; I165-V193 HydrophobicContact CG1-CG2 4.32Å; L189-V193 WeakPolarHBondContact O-CG2 3.45Å; L189-V193 PolarHBondContact O-N 3.17Å; L189-V193 VanDerWaalsContact O-N 3.08Å; I190-V193 PolarHBondContact O-N 3.4Å; I190-V193 VanDerWaalsContact O-N 3.14Å; T191-V193 VanDerWaalsContact C-N 3.34Å; T191-V193 PolarHBondContact O-N 3.35Å; V193-L195 PolarHBondContact O-N 3.04Å; V193-L196 PolarHBondContact O-N 3.26Å; V193-L197 HydrophobicContact CG1-CD1 3.91Å; V193-L197 WeakPolarHBondContact O-CG 3.37Å; V193-L197 PolarHBondContact O-N 2.54Å; V193-L197 VanDerWaalsContact O-N 3.14Å
194L98.5Very high98.4Very high4 Ų422.4 Ų22.42%0.02114%0.135CC..Hα-helixtrans-59.6-46.2176-63.3-174.8000111.4I190 T191 L196 L197 S198 I245 L248 G281 F285I190-L194 HydrophobicContact CG2-CG 4.47Å; I190-L194 WeakPolarHBondContact O-CG 3.25Å; I190-L194 PolarHBondContact O-N 2.99Å; T191-L194 PolarHBondContact O-N 3.14Å; L194-L196 PolarHBondContact O-N 3.3Å; L194-L197 PolarHBondContact O-N 3.04Å; L194-S198 VanDerWaalsContact O-CB 3.24Å; L194-S198 WeakPolarHBondContact O-CB 3.38Å; L194-S198 PolarHBondContact O-N 2.98Å; L194-S198 PolarHBondContact O-OG 3.49Å; L194-I245 HydrophobicContact CB-CD1 3.75Å; L194-I245 HydrophobicContact CB-CG1 3.56Å; L194-I245 HydrophobicContact CD1-CG1 4.02Å; L194-I245 HydrophobicContact CG-CG1 4.43Å; L194-L248 HydrophobicContact CD1-CD1 3.62Å; L194-G281 WeakPolarHBondContact CD2-O 3.33Å; L194-F285 HydrophobicContact CD2-CD2 4.06Å; L194-F285 HydrophobicContact CD2-CE2 3.36Å; L194-F285 HydrophobicContact CD2-CZ 4.07Å
195L98.2Very high98.4Very high2 Ų222.6 Ų22.61%0.0114%0.137CC..Hα-helixtrans-58.5-47.2178.5-78.5167.4000111.4M71 A161 T191 A192 V193 L197 L199 I245M71-L195 HydrophobicContact SD-CD2 4.38Å; A161-L195 HydrophobicContact CB-CB 4.03Å; T191-L195 HydrophobicContact CG2-CD1 4.2Å; T191-L195 WeakPolarHBondContact O-CG 3.2Å; T191-L195 PolarHBondContact O-N 3.15Å; A192-L195 PolarHBondContact O-N 2.99Å; V193-L195 PolarHBondContact O-N 3.04Å; L195-L197 VanDerWaalsContact C-N 3.29Å; L195-L197 PolarHBondContact O-N 2.65Å; L195-L199 HydrophobicContact CB-CD1 4.27Å; L195-L199 HydrophobicContact CD2-CD1 3.74Å; L195-L199 HydrophobicContact CD2-CG 4.26Å; L195-L199 WeakPolarHBondContact O-CB 3.22Å; L195-L199 WeakPolarHBondContact O-CG 3.41Å; L195-L199 PolarHBondContact O-N 3.13Å; L195-L199 VanDerWaalsContact O-N 3.15Å; L195-I245 HydrophobicContact CB-CD1 4.46Å; L195-I245 HydrophobicContact CD1-CG2 4.31Å; L195-I245 HydrophobicContact CD2-CD1 3.7Å; L195-I245 HydrophobicContact CD2-CG1 4.35Å; L195-I245 HydrophobicContact CD2-CG2 3.81Å; L195-I245 HydrophobicContact CG-CD1 3.79Å; L195-I245 HydrophobicContact CG-CG1 4.1Å; L195-I245 HydrophobicContact CG-CG2 3.96Å
196L98.1Very high98.4Very high65 Ų6522.7 Ų22.734%0.3414%0.137SC..Hα-helixtrans-61.9-36.4-178.9-17662.4000112.5I158 I162 I165 A192 V193 L194 P200I158-L196 HydrophobicContact CG2-CD1 4.19Å; I162-L196 HydrophobicContact CD1-CD1 4.39Å; I162-L196 HydrophobicContact CG1-CD1 4.04Å; I165-L196 HydrophobicContact CD1-CD2 4.02Å; A192-L196 WeakPolarHBondContact O-CB 3.45Å; A192-L196 PolarHBondContact O-N 3.41Å; V193-L196 PolarHBondContact O-N 3.26Å; L194-L196 PolarHBondContact O-N 3.3Å; L196-P200 WeakPolarHBondContact O-CD 3.31Å; L196-P200 WeakPolarHBondContact O-CG 3.4Å
197L98.1Very high98.5Very high99 Ų9924.7 Ų24.752%0.51815%0.151SC..Hα-helixtrans-88-30.3-176.9-65.3177.9000113.7V193 L194 L195 F285V193-L197 HydrophobicContact CG1-CD1 3.91Å; V193-L197 WeakPolarHBondContact O-CG 3.37Å; V193-L197 PolarHBondContact O-N 2.54Å; V193-L197 VanDerWaalsContact O-N 3.14Å; L194-L197 PolarHBondContact O-N 3.04Å; L195-L197 VanDerWaalsContact C-N 3.29Å; L195-L197 PolarHBondContact O-N 2.65Å; L197-F285 HydrophobicContact CB-CE1 4.24Å; L197-F285 HydrophobicContact CB-CE2 4.22Å; L197-F285 HydrophobicContact CB-CZ 3.59Å; L197-F285 HydrophobicContact CD1-CE2 4.19Å; L197-F285 HydrophobicContact CD1-CZ 4.39Å
198S97.8Very high98.5Very high0 Ų026.5 Ų26.50%016%0.16CC..Hα-helixtrans-91.4-40.6-173.960.60000113.9L194 P200 V201L194-S198 VanDerWaalsContact O-CB 3.24Å; L194-S198 WeakPolarHBondContact O-CB 3.38Å; L194-S198 PolarHBondContact O-N 2.98Å; L194-S198 PolarHBondContact O-OG 3.49Å; S198-P200 VanDerWaalsContact C-CD 3.47Å; S198-V201 PolarHBondContact O-N 3.07Å; S198-V201 VanDerWaalsContact O-N 3.12Å
199L97.4Very high98.5Very high7 Ų726.6 Ų26.64%0.03716%0.161CC..Hα-helixtrans-61.4-35.4-175.5-74.9172.2000115I158 L195 V201 L202 A203 F238I158-L199 HydrophobicContact CD1-CB 4.01Å; I158-L199 HydrophobicContact CG1-CB 4.02Å; I158-L199 HydrophobicContact CG1-CD1 3.82Å; L195-L199 HydrophobicContact CB-CD1 4.27Å; L195-L199 HydrophobicContact CD2-CD1 3.74Å; L195-L199 HydrophobicContact CD2-CG 4.26Å; L195-L199 WeakPolarHBondContact O-CB 3.22Å; L195-L199 WeakPolarHBondContact O-CG 3.41Å; L195-L199 PolarHBondContact O-N 3.13Å; L195-L199 VanDerWaalsContact O-N 3.15Å; L199-V201 PolarHBondContact O-N 3.01Å; L199-L202 HydrophobicContact CD2-CD2 4.44Å; L199-L202 PolarHBondContact O-N 3.43Å; L199-A203 PolarHBondContact O-N 3.02Å; L199-F238 HydrophobicContact CD2-CD2 4.11Å; L199-F238 HydrophobicContact CD2-CE2 3.54Å; L199-F238 HydrophobicContact CD2-CZ 4.34Å; L199-F238 HydrophobicContact CG-CE2 4.39Å
200P98.4Very high98.5Very high65 Ų6527.1 Ų27.142%0.42216%0.163SC..Hα-helixtrans-58.1-32.4175-27.436.8000113.4L196 S198 A204L196-P200 WeakPolarHBondContact O-CD 3.31Å; L196-P200 WeakPolarHBondContact O-CG 3.4Å; S198-P200 VanDerWaalsContact C-CD 3.47Å; P200-A204 WeakPolarHBondContact O-CB 3.3Å; P200-A204 PolarHBondContact O-N 3.45Å
201V98.6Very high98.4Very high33 Ų3327.5 Ų27.520%0.217%0.167CC..Hα-helixtrans-72.4-41.4179.2-175.20000111.1S198 L199 A204 G205 L234 F237S198-V201 PolarHBondContact O-N 3.07Å; S198-V201 VanDerWaalsContact O-N 3.12Å; L199-V201 PolarHBondContact O-N 3.01Å; V201-A204 PolarHBondContact O-N 3.45Å; V201-G205 PolarHBondContact O-N 2.87Å; V201-L234 HydrophobicContact CG1-CB 4.31Å; V201-L234 HydrophobicContact CG1-CD2 3.85Å; V201-F237 HydrophobicContact CB-CD1 3.96Å; V201-F237 HydrophobicContact CG1-CB 4.32Å; V201-F237 HydrophobicContact CG1-CD1 3.86Å; V201-F237 HydrophobicContact CG1-CG 4.42Å; V201-F237 HydrophobicContact CG2-CD1 3.67Å; V201-F237 HydrophobicContact CG2-CE1 3.77Å
202L98.1Very high98.4Very high7 Ų728.9 Ų28.94%0.03717%0.174CC..Hα-helixtrans-58.5-51.6171.1177.467.1000110.6L199 A204 G205 I206 F235 F238L199-L202 HydrophobicContact CD2-CD2 4.44Å; L199-L202 PolarHBondContact O-N 3.43Å; L202-A204 VanDerWaalsContact C-N 3.27Å; L202-A204 PolarHBondContact O-N 3.3Å; L202-G205 WeakPolarHBondContact O-CA 3.28Å; L202-G205 PolarHBondContact O-N 3.16Å; L202-I206 HydrophobicContact CD1-CG2 3.85Å; L202-I206 HydrophobicContact CG-CD1 4.45Å; L202-I206 HydrophobicContact CG-CG2 4.38Å; L202-I206 WeakPolarHBondContact O-CG1 3.28Å; L202-I206 PolarHBondContact O-N 2.69Å; L202-F235 HydrophobicContact CD1-CD2 3.96Å; L202-F235 HydrophobicContact CD1-CE2 4.13Å; L202-F238 HydrophobicContact CB-CB 3.87Å; L202-F238 HydrophobicContact CB-CD1 3.89Å; L202-F238 HydrophobicContact CB-CD2 3.94Å; L202-F238 HydrophobicContact CB-CE1 4.47Å; L202-F238 HydrophobicContact CB-CG 3.59Å; L202-F238 HydrophobicContact CD1-CD1 3.76Å; L202-F238 HydrophobicContact CD1-CE1 4.11Å; L202-F238 HydrophobicContact CD1-CG 4.35Å; L202-F238 HydrophobicContact CD2-CD1 3.91Å; L202-F238 HydrophobicContact CD2-CD2 4.32Å; L202-F238 HydrophobicContact CD2-CE1 3.64Å; L202-F238 HydrophobicContact CD2-CE2 4.08Å; L202-F238 HydrophobicContact CD2-CG 4.24Å; L202-F238 HydrophobicContact CD2-CZ 3.73Å; L202-F238 HydrophobicContact CG-CD1 4.05Å; L202-F238 HydrophobicContact CG-CE1 4.28Å; L202-F238 HydrophobicContact CG-CG 4.26Å
203A98.6Very high98.4Very high32 Ų3229.2 Ų29.226%0.26418%0.175SC..Hα-helixtrans-56.2-42.5-178.300000111.5L199 T207L199-A203 PolarHBondContact O-N 3.02Å; A203-T207 WeakPolarHBondContact O-CB 3.14Å; A203-T207 PolarHBondContact O-N 2.89Å; A203-T207 PolarHBondContact O-OG1 3.48Å
204A98.7Very high98.4Very high44 Ų4430.1 Ų30.136%0.36418%0.178SC..Hα-helixtrans-61.8-48.8173.500000111.9P200 V201 L202 T207 M208P200-A204 WeakPolarHBondContact O-CB 3.3Å; P200-A204 PolarHBondContact O-N 3.45Å; V201-A204 PolarHBondContact O-N 3.45Å; L202-A204 VanDerWaalsContact C-N 3.27Å; L202-A204 PolarHBondContact O-N 3.3Å; A204-T207 PolarHBondContact O-N 3.47Å; A204-M208 VanDerWaalsContact C-CE 3.45Å; A204-M208 HydrophobicContact CB-CE 3.98Å; A204-M208 WeakPolarHBondContact O-CB 3.22Å; A204-M208 VanDerWaalsContact O-CE 3.25Å; A204-M208 WeakPolarHBondContact O-CE 2.91Å; A204-M208 WeakPolarHBondContact O-CG 3.36Å; A204-M208 PolarHBondContact O-N 3.46Å
205G98.7Very high98.3Very high3 Ų335.8 Ų35.83%0.03121%0.207CC..Hα-helixtrans-56.7-50.5178.300000113.6V201 L202 M208 L209V201-G205 PolarHBondContact O-N 2.87Å; L202-G205 WeakPolarHBondContact O-CA 3.28Å; L202-G205 PolarHBondContact O-N 3.16Å; G205-M208 PolarHBondContact O-N 3.33Å; G205-L209 PolarHBondContact O-N 2.95Å
206I98.7Very high98.2Very high2 Ų242.9 Ų42.91%0.0125%0.245CC..Hα-helixtrans-74.8-26.3-179.366.6177.2000112.5I147 L150 H151 L202 L209 L210I147-I206 HydrophobicContact CG1-CB 4.36Å; I147-I206 HydrophobicContact CG2-CB 4.06Å; I147-I206 HydrophobicContact CG2-CD1 4.22Å; I147-I206 HydrophobicContact CG2-CG1 4.11Å; L150-I206 HydrophobicContact CB-CD1 3.81Å; H151-I206 VanDerWaalsContact CE1-CG1 3.47Å; H151-I206 WeakPolarHBondContact CE1-CG1 3.44Å; L202-I206 HydrophobicContact CD1-CG2 3.85Å; L202-I206 HydrophobicContact CG-CD1 4.45Å; L202-I206 HydrophobicContact CG-CG2 4.38Å; L202-I206 WeakPolarHBondContact O-CG1 3.28Å; L202-I206 PolarHBondContact O-N 2.69Å; I206-L209 PolarHBondContact O-N 2.9Å; I206-L210 WeakPolarHBondContact O-CB 3.49Å; I206-L210 PolarHBondContact O-N 3.42Å
207T98.8Very high98.2Very high59 Ų5942 Ų4236%0.36224%0.243SC..Hα-helixtrans-68.4-45.8170.3-62.20000110.9H151 A203 A204 L209 L210 T211H151-T207 PolarHBondContact CE1-OG1 2.98Å; H151-T207 PolarHBondContact NE2-OG1 3.32Å; A203-T207 WeakPolarHBondContact O-CB 3.14Å; A203-T207 PolarHBondContact O-N 2.89Å; A203-T207 PolarHBondContact O-OG1 3.48Å; A204-T207 PolarHBondContact O-N 3.47Å; T207-L209 PolarHBondContact O-N 2.99Å; T207-L210 WeakPolarHBondContact O-CB 3.49Å; T207-L210 PolarHBondContact O-N 3.23Å; T207-L210 VanDerWaalsContact O-N 3.07Å; T207-T211 HydrophobicContact CG2-CG2 4.49Å; T207-T211 WeakPolarHBondContact O-CG2 3.46Å; T207-T211 PolarHBondContact O-N 2.9Å
208M98.8Very high98.2Very high38 Ų3840.1 Ų40.119%0.18724%0.235CC..Hα-helixtrans-57.2-39.8173.8-75.9-178.6-91.500111.2A204 G205 T211 D212 F219 F220 L234A204-M208 VanDerWaalsContact C-CE 3.45Å; A204-M208 HydrophobicContact CB-CE 3.98Å; A204-M208 WeakPolarHBondContact O-CB 3.22Å; A204-M208 VanDerWaalsContact O-CE 3.25Å; A204-M208 WeakPolarHBondContact O-CE 2.91Å; A204-M208 WeakPolarHBondContact O-CG 3.36Å; A204-M208 PolarHBondContact O-N 3.46Å; G205-M208 PolarHBondContact O-N 3.33Å; M208-T211 PolarHBondContact O-N 3.47Å; M208-T211 PolarHBondContact O-OG1 3.41Å; M208-D212 WeakPolarHBondContact O-CB 3.48Å; M208-D212 PolarHBondContact O-N 3.34Å; M208-F219 HydrophobicContact CB-CB 4.22Å; M208-F219 HydrophobicContact CB-CD2 3.72Å; M208-F219 HydrophobicContact CB-CE2 4.2Å; M208-F219 HydrophobicContact CB-CG 3.93Å; M208-F219 HydrophobicContact CG-CD1 4.05Å; M208-F219 HydrophobicContact CG-CD2 3.76Å; M208-F219 HydrophobicContact CG-CE1 4.1Å; M208-F219 HydrophobicContact CG-CE2 3.82Å; M208-F219 HydrophobicContact CG-CG 3.89Å; M208-F219 HydrophobicContact CG-CZ 4Å; M208-F219 HydrophobicContact SD-CD1 3.64Å; M208-F219 HydrophobicContact SD-CD2 4.42Å; M208-F219 HydrophobicContact SD-CE1 3.85Å; M208-F219 HydrophobicContact SD-CG 3.95Å; M208-F219 HydrophobicContact SD-CZ 4.34Å; M208-F220 HydrophobicContact CB-CE2 3.64Å; M208-F220 HydrophobicContact CB-CZ 3.65Å; M208-F220 HydrophobicContact SD-CZ 4.33Å; M208-L234 HydrophobicContact CE-CD1 3.41Å; M208-L234 VanDerWaalsContact CE-CD1 3.41Å; M208-L234 HydrophobicContact SD-CD1 4.42Å
209L98.7Very high98.3Very high2 Ų244.3 Ų44.31%0.0125%0.254CS..Hα-helixtrans-66.3-40.9175.8-179.962.6000111.3I128 P130 A133 I147 G205 I206 T207 T211 D212 R213 F220 Y231I128-L209 HydrophobicContact CG2-CD2 3.69Å; P130-L209 HydrophobicContact CB-CD1 4.12Å; P130-L209 HydrophobicContact CG-CD1 4.41Å; A133-L209 HydrophobicContact CB-CD1 4.45Å; A133-L209 HydrophobicContact CB-CD2 3.94Å; I147-L209 HydrophobicContact CD1-CB 4.49Å; I147-L209 HydrophobicContact CD1-CD2 4.19Å; I147-L209 HydrophobicContact CD1-CG 4.22Å; G205-L209 PolarHBondContact O-N 2.95Å; I206-L209 PolarHBondContact O-N 2.9Å; T207-L209 PolarHBondContact O-N 2.99Å; L209-T211 VanDerWaalsContact C-N 3.32Å; L209-T211 PolarHBondContact O-N 2.86Å; L209-D212 PolarHBondContact O-N 3.32Å; L209-R213 VanDerWaalsContact O-CG 3.29Å; L209-R213 WeakPolarHBondContact O-CG 3.4Å; L209-R213 PolarHBondContact O-N 3.2Å; L209-F220 HydrophobicContact CB-CD2 4.32Å; L209-F220 HydrophobicContact CB-CE2 3.99Å; L209-F220 HydrophobicContact CD1-CD2 4.27Å; L209-Y231 HydrophobicContact CB-CE2 4.18Å; L209-Y231 HydrophobicContact CD2-CE2 3.97Å
210L98.6Very high98.3Very high28 Ų2844.1 Ų44.115%0.14725%0.252CS..Hα-helixtrans-62.3-39176.3-170.868.3000111.9D144 I147 F148 I206 T207 R213 N214D144-L210 HydrophobicContact CB-CD1 3.89Å; I147-L210 HydrophobicContact CB-CD1 4.47Å; I147-L210 HydrophobicContact CD1-CB 4.08Å; I147-L210 HydrophobicContact CD1-CD1 4.06Å; I147-L210 HydrophobicContact CG2-CB 4.17Å; I147-L210 HydrophobicContact CG2-CD1 4.36Å; I147-L210 HydrophobicContact CG2-CD2 4.28Å; F148-L210 HydrophobicContact CE1-CD2 3.96Å; F148-L210 HydrophobicContact CZ-CD2 3.93Å; I206-L210 WeakPolarHBondContact O-CB 3.49Å; I206-L210 PolarHBondContact O-N 3.42Å; T207-L210 WeakPolarHBondContact O-CB 3.49Å; T207-L210 PolarHBondContact O-N 3.23Å; T207-L210 VanDerWaalsContact O-N 3.07Å; L210-R213 PolarHBondContact O-N 2.64Å; L210-N214 WeakPolarHBondContact CD1-ND2 3.29Å; L210-N214 WeakPolarHBondContact O-CB 3.26Å; L210-N214 PolarHBondContact O-N 2.89Å; L210-N214 PolarHBondContact O-ND2 3.38Å
211T98.5Very high98.2Very high25 Ų2544.7 Ų44.715%0.15325%0.252CS..Hα-helixtrans-73.2-34.4176.5630000112.1T207 M208 L209 R213 N214 L215 N216 T217T207-T211 HydrophobicContact CG2-CG2 4.49Å; T207-T211 WeakPolarHBondContact O-CG2 3.46Å; T207-T211 PolarHBondContact O-N 2.9Å; M208-T211 PolarHBondContact O-N 3.47Å; M208-T211 PolarHBondContact O-OG1 3.41Å; L209-T211 VanDerWaalsContact C-N 3.32Å; L209-T211 PolarHBondContact O-N 2.86Å; T211-R213 VanDerWaalsContact C-N 3.27Å; T211-R213 PolarHBondContact O-N 3.23Å; T211-N214 PolarHBondContact O-N 3.31Å; T211-L215 HydrophobicContact CG2-CD1 3.84Å; T211-L215 CarbonylContact O-C 3.59Å; T211-L215 WeakPolarHBondContact O-CA 3.27Å; T211-L215 PolarHBondContact O-N 3.47Å; T211-N216 PolarHBondContact O-N 3.4Å; T211-T217 VanDerWaalsContact CB-OG1 3.31Å; T211-T217 WeakPolarHBondContact CB-OG1 3.33Å; T211-T217 PolarHBondContact O-N 3.19Å; T211-T217 PolarHBondContact O-OG1 3.47Å; T211-T217 PolarHBondContact OG1-OG1 3.48Å
212D98.3Very high98.1Very high29 Ų2947 Ų4716%0.15527%0.267CS..Hα-helixtrans-63.8-37.2173.2-85.817.4000110.9M208 L209 T217 T218 F219 F220M208-D212 WeakPolarHBondContact O-CB 3.48Å; M208-D212 PolarHBondContact O-N 3.34Å; L209-D212 PolarHBondContact O-N 3.32Å; D212-T217 WeakPolarHBondContact CA-O 3.41Å; D212-T217 WeakPolarHBondContact CA-OG1 3.25Å; D212-T217 PolarHBondContact N-OG1 3.17Å; D212-T217 WeakPolarHBondContact OD1-CB 3.39Å; D212-T217 VanDerWaalsContact OD1-O 3.11Å; D212-T217 PolarHBondContact OD1-OG1 3.15Å; D212-T218 PolarHBondContact OD1-N 3.09Å; D212-T218 VanDerWaalsContact OD1-N 3.14Å; D212-F219 VanDerWaalsContact CG-N 3.32Å; D212-F219 WeakPolarHBondContact OD1-CD2 3.34Å; D212-F219 PolarHBondContact OD1-N 2.79Å; D212-F219 PolarHBondContact OD2-N 3.11Å; D212-F220 PolarHBondContact OD2-N 2.94Å
213R97.9Very high98Very high9 Ų951.2 Ų51.23%0.03430%0.303CS..Hα-helixtrans-68.7-50.3173.8-68.6176.164.669.89.2111.7A133 G134 N135 H138 G140 D144 L209 L210 T211A133-R213 WeakPolarHBondContact O-CD 3.15Å; A133-R213 PolarHBondContact O-NH1 3.4Å; G134-R213 PolarHBondContact O-NH1 2.94Å; N135-R213 PolarHBondContact ND2-O 2.85Å; N135-R213 PolarHBondContact OD1-NH2 3.27Å; H138-R213 PolarHBondContact O-NH1 2.96Å; H138-R213 PolarHBondContact O-NH2 3.12Å; G140-R213 PolarHBondContact O-NH2 2.93Å; D144-R213 WeakPolarHBondContact OD1-CD 3.41Å; D144-R213 IonicContact OD1-CZ 2.64Å; D144-R213 IonicContact OD1-NE 3.29Å; D144-R213 PolarHBondContact OD1-NE 3.46Å; D144-R213 IonicContact OD1-NH2 3.6Å; L209-R213 VanDerWaalsContact O-CG 3.29Å; L209-R213 WeakPolarHBondContact O-CG 3.4Å; L209-R213 PolarHBondContact O-N 3.2Å; L210-R213 PolarHBondContact O-N 2.64Å; T211-R213 VanDerWaalsContact C-N 3.27Å; T211-R213 PolarHBondContact O-N 3.23Å
214N98.3Very high97.8Very high80 Ų8051.6 Ų51.643%0.42831%0.311SS..Hα-helixtrans-110.9-17.7-160.7-68.2-61.2000115.9D144 L210 T211D144-N214 VanDerWaalsContact CG-ND2 3.31Å; D144-N214 PolarHBondContact OD1-ND2 3.25Å; D144-N214 PolarHBondContact OD2-ND2 2.88Å; D144-N214 PolarHBondContact OD2-OD1 2.94Å; L210-N214 WeakPolarHBondContact CD1-ND2 3.29Å; L210-N214 WeakPolarHBondContact O-CB 3.26Å; L210-N214 PolarHBondContact O-N 2.89Å; L210-N214 PolarHBondContact O-ND2 3.38Å; T211-N214 PolarHBondContact O-N 3.31Å
215L97.9Very high97.7Very high123 Ų12353 Ų5364%0.64433%0.329SS*.SBendtrans-12214.8-173.3-58.1-177.3000113.4T211 T217T211-L215 HydrophobicContact CG2-CD1 3.84Å; T211-L215 CarbonylContact O-C 3.59Å; T211-L215 WeakPolarHBondContact O-CA 3.27Å; T211-L215 PolarHBondContact O-N 3.47Å; L215-T217 PolarHBondContact O-N 3.37Å
216N96.3Very high97.7Very high151 Ų15153.6 Ų53.681%0.80734%0.335SS*.  trans5531.2-180-57.2-47.9000113.8T211T211-N216 PolarHBondContact O-N 3.4Å
217T98.1Very high97.6Very high46 Ų4657 Ų5728%0.28235%0.354SS..  trans-77.2165.8164.463.40000109.9T211 D212 L215 F219T211-T217 VanDerWaalsContact CB-OG1 3.31Å; T211-T217 WeakPolarHBondContact CB-OG1 3.33Å; T211-T217 PolarHBondContact O-N 3.19Å; T211-T217 PolarHBondContact O-OG1 3.47Å; T211-T217 PolarHBondContact OG1-OG1 3.48Å; D212-T217 WeakPolarHBondContact CA-O 3.41Å; D212-T217 WeakPolarHBondContact CA-OG1 3.25Å; D212-T217 PolarHBondContact N-OG1 3.17Å; D212-T217 WeakPolarHBondContact OD1-CB 3.39Å; D212-T217 VanDerWaalsContact OD1-O 3.11Å; D212-T217 PolarHBondContact OD1-OG1 3.15Å; L215-T217 PolarHBondContact O-N 3.37Å; T217-F219 HydrophobicContact CG2-CE2 4.26Å
218T97.6Very high97.6Very high60 Ų6055.5 Ų55.537%0.36835%0.345SS..  trans-13850.4-176.658.10000111.2D212 F220 D221 G224 G226D212-T218 PolarHBondContact OD1-N 3.09Å; D212-T218 VanDerWaalsContact OD1-N 3.14Å; T218-F220 VanDerWaalsContact C-N 3.35Å; T218-D221 HydrophobicContact CG2-CB 4.47Å; T218-G224 PolarHBondContact OG1-O 3.46Å; T218-G226 VanDerWaalsContact O-CA 3.24Å; T218-G226 WeakPolarHBondContact O-CA 3.41Å; T218-G226 PolarHBondContact O-N 2.71Å
219F98.5Very high97.6Very high88 Ų8856.3 Ų56.339%0.38635%0.35SS..SBendtrans-64.2-40.4176.3-73.2-76000112.1M208 D212 T217 G226 D227M208-F219 HydrophobicContact CB-CB 4.22Å; M208-F219 HydrophobicContact CB-CD2 3.72Å; M208-F219 HydrophobicContact CB-CE2 4.2Å; M208-F219 HydrophobicContact CB-CG 3.93Å; M208-F219 HydrophobicContact CG-CD1 4.05Å; M208-F219 HydrophobicContact CG-CD2 3.76Å; M208-F219 HydrophobicContact CG-CE1 4.1Å; M208-F219 HydrophobicContact CG-CE2 3.82Å; M208-F219 HydrophobicContact CG-CG 3.89Å; M208-F219 HydrophobicContact CG-CZ 4Å; M208-F219 HydrophobicContact SD-CD1 3.64Å; M208-F219 HydrophobicContact SD-CD2 4.42Å; M208-F219 HydrophobicContact SD-CE1 3.85Å; M208-F219 HydrophobicContact SD-CG 3.95Å; M208-F219 HydrophobicContact SD-CZ 4.34Å; D212-F219 VanDerWaalsContact CG-N 3.32Å; D212-F219 WeakPolarHBondContact OD1-CD2 3.34Å; D212-F219 PolarHBondContact OD1-N 2.79Å; D212-F219 PolarHBondContact OD2-N 3.11Å; T217-F219 HydrophobicContact CG2-CE2 4.26Å; F219-G226 CarbonylContact O-C 3.59Å; F219-G226 WeakPolarHBondContact O-CA 3.25Å; F219-D227 PolarHBondContact O-N 2.94Å
220F98.4Very high97.6Very high2 Ų259.7 Ų59.71%0.00937%0.367CS..SBendtrans-118.6-4.6-173.5-48.2-53.9000113.6P130 M208 L209 D212 T218 P222 P228 L230 Y231 L234P130-F220 HydrophobicContact CB-CB 3.87Å; P130-F220 HydrophobicContact CG-CB 3.55Å; P130-F220 HydrophobicContact CG-CD2 4Å; P130-F220 HydrophobicContact CG-CG 3.82Å; M208-F220 HydrophobicContact CB-CE2 3.64Å; M208-F220 HydrophobicContact CB-CZ 3.65Å; M208-F220 HydrophobicContact SD-CZ 4.33Å; L209-F220 HydrophobicContact CB-CD2 4.32Å; L209-F220 HydrophobicContact CB-CE2 3.99Å; L209-F220 HydrophobicContact CD1-CD2 4.27Å; D212-F220 PolarHBondContact OD2-N 2.94Å; T218-F220 VanDerWaalsContact C-N 3.35Å; F220-P222 VanDerWaalsContact O-CD 3.32Å; F220-P222 WeakPolarHBondContact O-CD 3.47Å; F220-P228 VanDerWaalsContact O-CD 3.24Å; F220-P228 WeakPolarHBondContact O-CD 3.42Å; F220-P228 VanDerWaalsContact O-CG 3.3Å; F220-P228 WeakPolarHBondContact O-CG 3.47Å; F220-L230 HydrophobicContact CD1-CB 4.39Å; F220-L230 HydrophobicContact CE1-CB 4.32Å; F220-L230 HydrophobicContact CE1-CD2 4.14Å; F220-L230 HydrophobicContact CE1-CG 4.09Å; F220-Y231 HydrophobicContact CD2-CD2 4.1Å; F220-Y231 HydrophobicContact CE1-CD2 4.26Å; F220-Y231 HydrophobicContact CE1-CG 4.48Å; F220-Y231 AromaticContact CE2-CD2 3.61Å; F220-Y231 HydrophobicContact CE2-CD2 3.61Å; F220-Y231 HydrophobicContact CE2-CE2 4.48Å; F220-Y231 HydrophobicContact CE2-CG 4.45Å; F220-Y231 AromaticContact CZ-CD2 3.71Å; F220-Y231 HydrophobicContact CZ-CD2 3.71Å; F220-Y231 HydrophobicContact CZ-CG 4.35Å; F220-L234 HydrophobicContact CE1-CD1 4.25Å; F220-L234 HydrophobicContact CZ-CD1 4.24Å
221D96.6Very high97.6Very high78 Ų7858.5 Ų58.542%0.41736%0.361SS..  trans-87112.5177-176.40.4000111.5T218 A223 G224 G225 G226T218-D221 HydrophobicContact CG2-CB 4.47Å; D221-A223 PolarHBondContact O-N 2.88Å; D221-A223 WeakPolarHBondContact OD1-CB 3.45Å; D221-A223 PolarHBondContact OD1-N 3.41Å; D221-G224 PolarHBondContact O-N 2.71Å; D221-G225 PolarHBondContact O-N 3.49Å; D221-G226 WeakPolarHBondContact O-CA 3.17Å; D221-G226 PolarHBondContact O-N 2.83Å
222P96.2Very high97.6Very high80 Ų8059 Ų5952%0.51936%0.361SS..G310 helixtrans-58.5-27.3177-2435.6000114.4F220 G224 G225 G226 P228F220-P222 VanDerWaalsContact O-CD 3.32Å; F220-P222 WeakPolarHBondContact O-CD 3.47Å; P222-G224 PolarHBondContact O-N 3.33Å; P222-G225 PolarHBondContact O-N 3.07Å; P222-G225 VanDerWaalsContact O-N 3.07Å; P222-G226 WeakPolarHBondContact CA-O 3.35Å; P222-P228 HydrophobicContact CG-CG 4.08Å
223A95.1Very high97.6Very high96 Ų9660.7 Ų60.779%0.79337%0.368SS*.G310 helixtrans-65.1-27.3178.200000112.5D221D221-A223 PolarHBondContact O-N 2.88Å; D221-A223 WeakPolarHBondContact OD1-CB 3.45Å; D221-A223 PolarHBondContact OD1-N 3.41Å
224G95.1Very high97.6Very high41 Ų4161.8 Ų61.842%0.42338%0.375SS..G310 helixtrans-100.310172.700000114.5T218 D221 P222T218-G224 PolarHBondContact OG1-O 3.46Å; D221-G224 PolarHBondContact O-N 2.71Å; P222-G224 PolarHBondContact O-N 3.33Å
225G96.6Very high97.6Very high73 Ų7358.3 Ų58.375%0.75336%0.356SS*.THydrogen-bonded Turntrans85.69.1-178.200000115.5D221 P222D221-G225 PolarHBondContact O-N 3.49Å; P222-G225 PolarHBondContact O-N 3.07Å; P222-G225 VanDerWaalsContact O-N 3.07Å
226G97.9Very high97.7Very high15 Ų1553 Ų5316%0.15533%0.327CS..  trans-77.1171173.400000113.5T218 F219 D221 P222T218-G226 VanDerWaalsContact O-CA 3.24Å; T218-G226 WeakPolarHBondContact O-CA 3.41Å; T218-G226 PolarHBondContact O-N 2.71Å; F219-G226 CarbonylContact O-C 3.59Å; F219-G226 WeakPolarHBondContact O-CA 3.25Å; D221-G226 WeakPolarHBondContact O-CA 3.17Å; D221-G226 PolarHBondContact O-N 2.83Å; P222-G226 WeakPolarHBondContact CA-O 3.35Å
227D98.1Very high97.8Very high74 Ų7448.7 Ų48.740%0.39630%0.301SS..  trans-133.8114.5-178.9-176.13.9000111.9F219 I229 L230F219-D227 PolarHBondContact O-N 2.94Å; D227-I229 PolarHBondContact O-N 3.5Å; D227-I229 VanDerWaalsContact OD1-CB 3.31Å; D227-I229 WeakPolarHBondContact OD1-CB 3.5Å; D227-I229 PolarHBondContact OD1-N 2.94Å; D227-L230 HydrophobicContact CB-CB 4.3Å; D227-L230 VanDerWaalsContact O-CB 3.24Å; D227-L230 WeakPolarHBondContact O-CB 3.37Å; D227-L230 PolarHBondContact O-N 3.46Å
228P97.8Very high97.8Very high27 Ų2746.5 Ų46.518%0.17529%0.288CS..Hα-helixtrans-57.7-26.3172.7-24.433000114.2F220 P222 L230 Y231 Q232F220-P228 VanDerWaalsContact O-CD 3.24Å; F220-P228 WeakPolarHBondContact O-CD 3.42Å; F220-P228 VanDerWaalsContact O-CG 3.3Å; F220-P228 WeakPolarHBondContact O-CG 3.47Å; P222-P228 HydrophobicContact CG-CG 4.08Å; P228-L230 VanDerWaalsContact C-N 3.3Å; P228-Y231 WeakPolarHBondContact O-CB 3.46Å; P228-Y231 PolarHBondContact O-N 3.49Å; P228-Q232 PolarHBondContact O-N 2.84Å
229I98.4Very high97.7Very high56 Ų5643.6 Ų43.629%0.28727%0.27SS..Hα-helixtrans-70.1-30.2177.6-57.5177000110.5D227 Y231 Q232 H233 M292 V295D227-I229 PolarHBondContact O-N 3.5Å; D227-I229 VanDerWaalsContact OD1-CB 3.31Å; D227-I229 WeakPolarHBondContact OD1-CB 3.5Å; D227-I229 PolarHBondContact OD1-N 2.94Å; I229-Y231 VanDerWaalsContact C-N 3.29Å; I229-Y231 PolarHBondContact O-N 2.91Å; I229-Q232 WeakPolarHBondContact O-CB 3.28Å; I229-Q232 PolarHBondContact O-N 3.45Å; I229-H233 PolarHBondContact O-CD2 2.93Å; I229-H233 VanDerWaalsContact O-CD2 3.29Å; I229-H233 PolarHBondContact O-N 3.45Å; I229-M292 HydrophobicContact CG2-CE 3.75Å; I229-V295 HydrophobicContact CD1-CB 4.4Å; I229-V295 HydrophobicContact CG2-CG2 4.2Å
230L98.5Very high97.7Very high73 Ų7339.9 Ų39.938%0.38225%0.254SS..Hα-helixtrans-57.5-43.8170.9177.362.5000111F220 D227 P228 Q232 H233 L234F220-L230 HydrophobicContact CD1-CB 4.39Å; F220-L230 HydrophobicContact CE1-CB 4.32Å; F220-L230 HydrophobicContact CE1-CD2 4.14Å; F220-L230 HydrophobicContact CE1-CG 4.09Å; D227-L230 HydrophobicContact CB-CB 4.3Å; D227-L230 VanDerWaalsContact O-CB 3.24Å; D227-L230 WeakPolarHBondContact O-CB 3.37Å; D227-L230 PolarHBondContact O-N 3.46Å; P228-L230 VanDerWaalsContact C-N 3.3Å; L230-Q232 VanDerWaalsContact C-N 3.29Å; L230-Q232 PolarHBondContact O-N 3.48Å; L230-H233 PolarHBondContact O-N 2.99Å; L230-L234 HydrophobicContact CD1-CD1 4.43Å; L230-L234 HydrophobicContact CD1-CG 4.39Å; L230-L234 HydrophobicContact CG-CD1 4.18Å; L230-L234 WeakPolarHBondContact O-CG 3.49Å; L230-L234 PolarHBondContact O-N 3.4Å
231Y98.7Very high97.7Very high2 Ų239.8 Ų39.81%0.00825%0.254CS..Hα-helixtrans-59.8-42.3175.3-177.1-82.3000111.1T127 I128 Y129 P130 L209 F220 P228 I229 H233 L234 F235T127-Y231 WeakPolarHBondContact O-CE1 3.35Å; T127-Y231 PolarHBondContact O-OH 3.3Å; I128-Y231 WeakPolarHBondContact O-CE1 3.35Å; I128-Y231 VanDerWaalsContact O-CZ 3.31Å; I128-Y231 PolarHBondContact O-OH 3.43Å; Y129-Y231 AromaticContact CD1-CD1 3.61Å; Y129-Y231 HydrophobicContact CD1-CD1 3.61Å; Y129-Y231 AromaticContact CD1-CE1 3.62Å; Y129-Y231 HydrophobicContact CD1-CE1 3.62Å; Y129-Y231 HydrophobicContact CE1-CD1 4.15Å; Y129-Y231 HydrophobicContact CE1-CE1 4.14Å; P130-Y231 VanDerWaalsContact CD-CG 3.4Å; P130-Y231 HydrophobicContact CG-CD1 4.4Å; P130-Y231 HydrophobicContact CG-CD2 4.18Å; P130-Y231 HydrophobicContact CG-CG 3.83Å; L209-Y231 HydrophobicContact CB-CE2 4.18Å; L209-Y231 HydrophobicContact CD2-CE2 3.97Å; F220-Y231 HydrophobicContact CD2-CD2 4.1Å; F220-Y231 HydrophobicContact CE1-CD2 4.26Å; F220-Y231 HydrophobicContact CE1-CG 4.48Å; F220-Y231 AromaticContact CE2-CD2 3.61Å; F220-Y231 HydrophobicContact CE2-CD2 3.61Å; F220-Y231 HydrophobicContact CE2-CE2 4.48Å; F220-Y231 HydrophobicContact CE2-CG 4.45Å; F220-Y231 AromaticContact CZ-CD2 3.71Å; F220-Y231 HydrophobicContact CZ-CD2 3.71Å; F220-Y231 HydrophobicContact CZ-CG 4.35Å; P228-Y231 WeakPolarHBondContact O-CB 3.46Å; P228-Y231 PolarHBondContact O-N 3.49Å; I229-Y231 VanDerWaalsContact C-N 3.29Å; I229-Y231 PolarHBondContact O-N 2.91Å; Y231-H233 VanDerWaalsContact C-N 3.35Å; Y231-H233 PolarHBondContact O-N 3.28Å; Y231-L234 PolarHBondContact O-N 3.24Å; Y231-F235 HydrophobicContact CD1-CB 4.19Å; Y231-F235 HydrophobicContact CE1-CB 3.82Å; Y231-F235 HydrophobicContact CE1-CD2 4.07Å; Y231-F235 HydrophobicContact CE1-CG 4.17Å; Y231-F235 VanDerWaalsContact O-CB 3.27Å; Y231-F235 WeakPolarHBondContact O-CB 3.33Å; Y231-F235 PolarHBondContact O-N 3.44Å
232Q98.6Very high97.7Very high36 Ų3636.1 Ų36.117%0.16823%0.234CC..Hα-helixtrans-61.5-41.8177.4-62.2-165.935.400112.2Y129 P228 I229 L230 F235 W236 M292Y129-Q232 HydrophobicContact CD1-CG 4.14Å; Y129-Q232 HydrophobicContact CE1-CB 4.44Å; Y129-Q232 HydrophobicContact CE1-CG 3.8Å; Y129-Q232 HydrophobicContact CE2-CG 4.34Å; P228-Q232 PolarHBondContact O-N 2.84Å; I229-Q232 WeakPolarHBondContact O-CB 3.28Å; I229-Q232 PolarHBondContact O-N 3.45Å; L230-Q232 VanDerWaalsContact C-N 3.29Å; L230-Q232 PolarHBondContact O-N 3.48Å; Q232-F235 PolarHBondContact O-N 2.96Å; Q232-W236 WeakPolarHBondContact O-CB 3.09Å; Q232-W236 PolarHBondContact O-N 2.89Å; Q232-M292 HydrophobicContact CB-CE 3.57Å; Q232-M292 HydrophobicContact CB-CG 4.43Å; Q232-M292 HydrophobicContact CB-SD 4.05Å
233H98.6Very high97.7Very high64 Ų6433.8 Ų33.830%0.29622%0.218SC..Hα-helixtrans-60.1-49.2174.6-80.5-77.1000111.6I229 L230 Y231 W236 F237 W288 M292I229-H233 PolarHBondContact O-CD2 2.93Å; I229-H233 VanDerWaalsContact O-CD2 3.29Å; I229-H233 PolarHBondContact O-N 3.45Å; L230-H233 PolarHBondContact O-N 2.99Å; Y231-H233 VanDerWaalsContact C-N 3.35Å; Y231-H233 PolarHBondContact O-N 3.28Å; H233-W236 PolarHBondContact O-N 3.28Å; H233-F237 WeakPolarHBondContact O-CB 3.38Å; H233-F237 PolarHBondContact O-N 3.12Å; H233-W288 AromaticContact ND1-NE1 3.52Å; H233-M292 VanDerWaalsContact CD2-CE 3.46Å; H233-M292 WeakPolarHBondContact CD2-CE 3.13Å; H233-M292 WeakPolarHBondContact NE2-CE 3.19Å
234L98.6Very high97.8Very high33 Ų3330.7 Ų30.717%0.17319%0.186CC..Hα-helixtrans-62.6-45.7179.8-66171.1000111.6V201 M208 F220 L230 Y231 F238V201-L234 HydrophobicContact CG1-CB 4.31Å; V201-L234 HydrophobicContact CG1-CD2 3.85Å; M208-L234 HydrophobicContact CE-CD1 3.41Å; M208-L234 VanDerWaalsContact CE-CD1 3.41Å; M208-L234 HydrophobicContact SD-CD1 4.42Å; F220-L234 HydrophobicContact CE1-CD1 4.25Å; F220-L234 HydrophobicContact CZ-CD1 4.24Å; L230-L234 HydrophobicContact CD1-CD1 4.43Å; L230-L234 HydrophobicContact CD1-CG 4.39Å; L230-L234 HydrophobicContact CG-CD1 4.18Å; L230-L234 WeakPolarHBondContact O-CG 3.49Å; L230-L234 PolarHBondContact O-N 3.4Å; Y231-L234 PolarHBondContact O-N 3.24Å; L234-F238 PolarHBondContact O-N 2.82Å
235F98.8Very high97.9Very high6 Ų628.8 Ų28.83%0.02617%0.166CC..Hα-helixtrans-63.5-47.5179.8-175.7-87.5000111.1W126 T127 Y129 L202 Y231 Q232 F238 G239W126-F235 HydrophobicContact CD2-CZ 4.32Å; W126-F235 AromaticContact CE3-CZ 3.77Å; W126-F235 HydrophobicContact CE3-CZ 3.77Å; W126-F235 AromaticContact CH2-CE1 3.94Å; W126-F235 HydrophobicContact CH2-CE1 3.94Å; W126-F235 AromaticContact CH2-CZ 3.94Å; W126-F235 HydrophobicContact CH2-CZ 3.94Å; W126-F235 HydrophobicContact CZ2-CE1 4.28Å; W126-F235 HydrophobicContact CZ2-CZ 4.46Å; W126-F235 HydrophobicContact CZ3-CE1 4.06Å; W126-F235 AromaticContact CZ3-CZ 3.57Å; W126-F235 HydrophobicContact CZ3-CZ 3.57Å; T127-F235 HydrophobicContact CG2-CD1 4.33Å; T127-F235 HydrophobicContact CG2-CE1 3.71Å; T127-F235 HydrophobicContact CG2-CZ 4.08Å; Y129-F235 HydrophobicContact CE1-CD1 4.45Å; L202-F235 HydrophobicContact CD1-CD2 3.96Å; L202-F235 HydrophobicContact CD1-CE2 4.13Å; Y231-F235 HydrophobicContact CD1-CB 4.19Å; Y231-F235 HydrophobicContact CE1-CB 3.82Å; Y231-F235 HydrophobicContact CE1-CD2 4.07Å; Y231-F235 HydrophobicContact CE1-CG 4.17Å; Y231-F235 VanDerWaalsContact O-CB 3.27Å; Y231-F235 WeakPolarHBondContact O-CB 3.33Å; Y231-F235 PolarHBondContact O-N 3.44Å; Q232-F235 PolarHBondContact O-N 2.96Å; F235-F238 CarbonylContact O-C 3.54Å; F235-F238 WeakPolarHBondContact O-CB 3.48Å; F235-F238 PolarHBondContact O-N 3.29Å; F235-G239 WeakPolarHBondContact O-CA 3.26Å; F235-G239 PolarHBondContact O-N 2.96Å
236W98.7Very high97.9Very high12 Ų1225.4 Ų25.45%0.04513%0.131CC..Hα-helixtrans-76.7-28.9-177.3-72.9126.6000113.8W126 T127 Y129 Q232 H233 F238 G239 H240 W288 H291 M292W126-W236 HydrophobicContact CH2-CH2 4.46Å; W126-W236 HydrophobicContact CH2-CZ3 4.15Å; W126-W236 AromaticContact CZ2-CH2 3.82Å; W126-W236 HydrophobicContact CZ2-CH2 3.82Å; W126-W236 AromaticContact CZ2-CZ3 3.93Å; W126-W236 HydrophobicContact CZ2-CZ3 3.93Å; T127-W236 HydrophobicContact CG2-CH2 4.16Å; T127-W236 HydrophobicContact CG2-CZ2 3.99Å; Y129-W236 AromaticContact CZ-NE1 3.93Å; Y129-W236 VanDerWaalsContact OH-CZ2 3.24Å; Y129-W236 WeakPolarHBondContact OH-CZ2 3.2Å; Y129-W236 PolarHBondContact OH-NE1 3.46Å; Q232-W236 WeakPolarHBondContact O-CB 3.09Å; Q232-W236 PolarHBondContact O-N 2.89Å; H233-W236 PolarHBondContact O-N 3.28Å; W236-F238 PolarHBondContact O-N 3.39Å; W236-G239 PolarHBondContact O-N 2.7Å; W236-H240 PolarHBondContact O-N 3.21Å; W236-W288 HydrophobicContact CB-CB 4.26Å; W236-W288 VanDerWaalsContact O-CB 3.27Å; W236-W288 WeakPolarHBondContact O-CB 3.04Å; W236-H291 HydrophobicContact CD2-CB 3.41Å; W236-H291 VanDerWaalsContact CD2-CB 3.41Å; W236-H291 AromaticContact CD2-CD2 3.57Å; W236-H291 AromaticContact CD2-CG 3.56Å; W236-H291 AromaticContact CE2-CG 3.76Å; W236-H291 HydrophobicContact CE3-CB 3.96Å; W236-H291 AromaticContact CE3-CD2 3.25Å; W236-H291 AromaticContact CE3-CG 3.55Å; W236-H291 AromaticContact CE3-NE2 3.65Å; W236-H291 HydrophobicContact CG-CB 3.68Å; W236-H291 HydrophobicContact CH2-CB 4.3Å; W236-H291 AromaticContact CH2-CG 3.99Å; W236-H291 AromaticContact CH2-ND1 3.88Å; W236-H291 HydrophobicContact CZ2-CB 3.78Å; 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 3.77Å; W236-H291 AromaticContact CZ3-ND1 3.84Å; W236-H291 AromaticContact CZ3-NE2 3.72Å; W236-M292 HydrophobicContact CG-CG 4.5Å
237F98.5Very high97.9Very high60 Ų6025.1 Ų25.126%0.26313%0.126SC..Hα-helixtrans-57.5-34169.8-174-87000111.2V201 H233 P241 F285 W288V201-F237 HydrophobicContact CB-CD1 3.96Å; V201-F237 HydrophobicContact CG1-CB 4.32Å; V201-F237 HydrophobicContact CG1-CD1 3.86Å; V201-F237 HydrophobicContact CG1-CG 4.42Å; V201-F237 HydrophobicContact CG2-CD1 3.67Å; V201-F237 HydrophobicContact CG2-CE1 3.77Å; H233-F237 WeakPolarHBondContact O-CB 3.38Å; H233-F237 PolarHBondContact O-N 3.12Å; F237-P241 WeakPolarHBondContact O-CD 3.42Å; F237-P241 WeakPolarHBondContact O-CG 3.32Å; F237-F285 AromaticContact CE1-CD1 3.95Å; F237-F285 HydrophobicContact CE1-CD1 3.95Å; F237-F285 HydrophobicContact CE1-CE1 4.1Å; F237-F285 HydrophobicContact CE2-CD1 4.35Å; F237-F285 AromaticContact CZ-CD1 3.75Å; F237-F285 HydrophobicContact CZ-CD1 3.75Å; F237-F285 HydrophobicContact CZ-CE1 4.32Å; F237-W288 HydrophobicContact CB-CG 4.38Å; F237-W288 HydrophobicContact CD2-CD2 4.03Å; F237-W288 AromaticContact CD2-CE3 3.98Å; F237-W288 HydrophobicContact CD2-CE3 3.98Å; F237-W288 HydrophobicContact CD2-CZ3 4.26Å; F237-W288 HydrophobicContact CE2-CE3 4.41Å; F237-W288 HydrophobicContact CE2-CZ3 4.38Å
238F98.1Very high97.9Very high0 Ų021.6 Ų21.60%011%0.107CC..Hα-helixtrans-77.2-50165.2154.5-101.5000112.5F67 L199 L202 L234 F235 W236 H240 P241 E242F67-F238 AromaticContact CE1-CZ 3.99Å; F67-F238 HydrophobicContact CE1-CZ 3.99Å; F67-F238 HydrophobicContact CZ-CE1 4.18Å; F67-F238 AromaticContact CZ-CZ 3.89Å; F67-F238 HydrophobicContact CZ-CZ 3.89Å; L199-F238 HydrophobicContact CD2-CD2 4.11Å; L199-F238 HydrophobicContact CD2-CE2 3.54Å; L199-F238 HydrophobicContact CD2-CZ 4.34Å; L199-F238 HydrophobicContact CG-CE2 4.39Å; L202-F238 HydrophobicContact CB-CB 3.87Å; L202-F238 HydrophobicContact CB-CD1 3.89Å; L202-F238 HydrophobicContact CB-CD2 3.94Å; L202-F238 HydrophobicContact CB-CE1 4.47Å; L202-F238 HydrophobicContact CB-CG 3.59Å; L202-F238 HydrophobicContact CD1-CD1 3.76Å; L202-F238 HydrophobicContact CD1-CE1 4.11Å; L202-F238 HydrophobicContact CD1-CG 4.35Å; L202-F238 HydrophobicContact CD2-CD1 3.91Å; L202-F238 HydrophobicContact CD2-CD2 4.32Å; L202-F238 HydrophobicContact CD2-CE1 3.64Å; L202-F238 HydrophobicContact CD2-CE2 4.08Å; L202-F238 HydrophobicContact CD2-CG 4.24Å; L202-F238 HydrophobicContact CD2-CZ 3.73Å; L202-F238 HydrophobicContact CG-CD1 4.05Å; L202-F238 HydrophobicContact CG-CE1 4.28Å; L202-F238 HydrophobicContact CG-CG 4.26Å; L234-F238 PolarHBondContact O-N 2.82Å; F235-F238 CarbonylContact O-C 3.54Å; F235-F238 WeakPolarHBondContact O-CB 3.48Å; F235-F238 PolarHBondContact O-N 3.29Å; W236-F238 PolarHBondContact O-N 3.39Å; F238-H240 VanDerWaalsContact C-N 3.34Å; F238-H240 PolarHBondContact O-N 2.9Å; F238-P241 VanDerWaalsContact O-CD 3.25Å; F238-P241 WeakPolarHBondContact O-CD 3.42Å; F238-E242 HydrophobicContact CD2-CB 4.35Å; F238-E242 HydrophobicContact CE1-CB 4.15Å; F238-E242 HydrophobicContact CE1-CG 4.23Å; F238-E242 HydrophobicContact CE2-CB 3.76Å; F238-E242 HydrophobicContact CE2-CG 3.98Å; F238-E242 WeakPolarHBondContact CE2-OE2 3.2Å; F238-E242 HydrophobicContact CZ-CB 3.65Å; F238-E242 HydrophobicContact CZ-CG 3.54Å; F238-E242 WeakPolarHBondContact O-CB 3.38Å; F238-E242 PolarHBondContact O-N 2.96Å
239G97.1Very high97.9Very high0 Ų020.3 Ų20.30%010%0.099CC..Hα-helixtrans-66.6-30.8-163.800000113.9F235 W236 E242 V243F235-G239 WeakPolarHBondContact O-CA 3.26Å; F235-G239 PolarHBondContact O-N 2.96Å; W236-G239 PolarHBondContact O-N 2.7Å; G239-E242 WeakPolarHBondContact O-CB 3.43Å; G239-V243 PolarHBondContact O-N 3.29Å
240H97.6Very high97.9Very high10 Ų1017.7 Ų17.75%0.0469%0.085CC..Hα-helixtrans-76.1-46175.8-162.978.5000113.2W236 F238 E242 V243 Y244 V287 W288 H290 H291W236-H240 PolarHBondContact O-N 3.21Å; F238-H240 VanDerWaalsContact C-N 3.34Å; F238-H240 PolarHBondContact O-N 2.9Å; H240-E242 PolarHBondContact O-N 3.36Å; H240-V243 WeakPolarHBondContact O-CG2 3.3Å; H240-V243 PolarHBondContact O-N 3.37Å; H240-Y244 AromaticContact CD2-CD2 3.99Å; H240-Y244 AromaticContact CD2-CE2 3.36Å; H240-Y244 WeakPolarHBondContact CD2-CE2 3.27Å; H240-Y244 AromaticContact NE2-CD2 3.96Å; H240-Y244 AromaticContact NE2-CE2 2.98Å; H240-Y244 WeakPolarHBondContact NE2-CE2 3.25Å; H240-Y244 AromaticContact NE2-CZ 3.27Å; H240-Y244 VanDerWaalsContact NE2-CZ 3.27Å; H240-Y244 PolarHBondContact NE2-OH 3.25Å; H240-Y244 PolarHBondContact O-N 3.06Å; H240-V287 WeakPolarHBondContact CD2-CG2 3.1Å; H240-V287 WeakPolarHBondContact NE2-CG2 3.28Å; H240-W288 HydrophobicContact CB-CB 4.12Å; H240-H290 AromaticContact CE1-CE1 3.01Å; H240-H290 PolarHBondContact CE1-CE1 2.75Å; H240-H290 AromaticContact CE1-NE2 3.2Å; H240-H290 PolarHBondContact CE1-NE2 3.29Å; H240-H290 AromaticContact CG-CE1 3.77Å; H240-H290 AromaticContact CG-NE2 3.84Å; H240-H290 AromaticContact ND1-CE1 3.05Å; H240-H290 PolarHBondContact ND1-CE1 3.37Å; H240-H290 AromaticContact ND1-NE2 2.88Å; H240-H290 PolarHBondContact ND1-NE2 3.23Å; H240-H290 AromaticContact NE2-CE1 3.59Å; H240-H291 AromaticContact ND1-NE2 3.29Å; H240-H291 PolarHBondContact ND1-NE2 3.35Å
241P98.3Very high97.9Very high0 Ų014.3 Ų14.30%07%0.067CC..Hα-helixtrans-53.3-38.6164.9-30.636.8000113.6F237 F238 V243 Y244 I245 F285F237-P241 WeakPolarHBondContact O-CD 3.42Å; F237-P241 WeakPolarHBondContact O-CG 3.32Å; F238-P241 VanDerWaalsContact O-CD 3.25Å; F238-P241 WeakPolarHBondContact O-CD 3.42Å; P241-V243 PolarHBondContact O-N 3.27Å; P241-Y244 WeakPolarHBondContact O-CA 3.06Å; P241-Y244 WeakPolarHBondContact O-CB 3.47Å; P241-Y244 PolarHBondContact O-N 2.91Å; P241-I245 WeakPolarHBondContact O-CG1 3.16Å; P241-I245 PolarHBondContact O-N 2.88Å; P241-F285 HydrophobicContact CB-CE1 4.08Å; P241-F285 HydrophobicContact CB-CZ 4.2Å; P241-F285 HydrophobicContact CG-CD1 3.65Å; P241-F285 HydrophobicContact CG-CE1 3.61Å; P241-F285 HydrophobicContact CG-CG 4.23Å; P241-F285 HydrophobicContact CG-CZ 4.17Å
242E97.4Very high97.8Very high1 Ų114.2 Ų14.21%0.0057%0.067CC..Hα-helixtrans-58.7-44.4177.4-176.858.6-151.700112.1M71 F238 G239 H240 Y244 I245 L246M71-E242 WeakPolarHBondContact CE-OE1 3.37Å; F238-E242 HydrophobicContact CD2-CB 4.35Å; F238-E242 HydrophobicContact CE1-CB 4.15Å; F238-E242 HydrophobicContact CE1-CG 4.23Å; F238-E242 HydrophobicContact CE2-CB 3.76Å; F238-E242 HydrophobicContact CE2-CG 3.98Å; F238-E242 WeakPolarHBondContact CE2-OE2 3.2Å; F238-E242 HydrophobicContact CZ-CB 3.65Å; F238-E242 HydrophobicContact CZ-CG 3.54Å; F238-E242 WeakPolarHBondContact O-CB 3.38Å; F238-E242 PolarHBondContact O-N 2.96Å; G239-E242 WeakPolarHBondContact O-CB 3.43Å; H240-E242 PolarHBondContact O-N 3.36Å; E242-Y244 PolarHBondContact O-N 3.37Å; E242-Y244 VanDerWaalsContact O-N 3.17Å; E242-I245 WeakPolarHBondContact O-CA 3.28Å; E242-I245 VanDerWaalsContact O-CB 3.3Å; E242-I245 WeakPolarHBondContact O-CB 3.35Å; E242-I245 PolarHBondContact O-N 3.48Å; E242-I245 WeakPolarHBondContact OE2-CD1 3.43Å; E242-L246 VanDerWaalsContact O-CG 3.31Å; E242-L246 WeakPolarHBondContact O-CG 3.25Å; E242-L246 PolarHBondContact O-N 3.21Å
243V96.3Very high97.8Very high31 Ų3112.5 Ų12.519%0.1886%0.059CC..Hα-helixtrans-64.3-24.8177.1-58.70000112.9G239 H240 P241 F377G239-V243 PolarHBondContact O-N 3.29Å; H240-V243 WeakPolarHBondContact O-CG2 3.3Å; H240-V243 PolarHBondContact O-N 3.37Å; P241-V243 PolarHBondContact O-N 3.27Å; V243-F377 HydrophobicContact CB-CE2 4.38Å; V243-F377 HydrophobicContact CG1-CE2 3.62Å; V243-F377 HydrophobicContact CG1-CZ 4.22Å
244Y97.1Very high97.8Very high30 Ų309.5 Ų9.512%0.1185%0.045CC..Hα-helixtrans-77.4-37.3170.3-69.8-52.3000113.5H240 P241 E242 L246 I247 L248 I280 I312H240-Y244 AromaticContact CD2-CD2 3.99Å; H240-Y244 AromaticContact CD2-CE2 3.36Å; H240-Y244 WeakPolarHBondContact CD2-CE2 3.27Å; H240-Y244 AromaticContact NE2-CD2 3.96Å; H240-Y244 AromaticContact NE2-CE2 2.98Å; H240-Y244 WeakPolarHBondContact NE2-CE2 3.25Å; H240-Y244 AromaticContact NE2-CZ 3.27Å; H240-Y244 VanDerWaalsContact NE2-CZ 3.27Å; H240-Y244 PolarHBondContact NE2-OH 3.25Å; H240-Y244 PolarHBondContact O-N 3.06Å; P241-Y244 WeakPolarHBondContact O-CA 3.06Å; P241-Y244 WeakPolarHBondContact O-CB 3.47Å; P241-Y244 PolarHBondContact O-N 2.91Å; E242-Y244 PolarHBondContact O-N 3.37Å; E242-Y244 VanDerWaalsContact O-N 3.17Å; Y244-L246 PolarHBondContact O-N 2.93Å; Y244-I247 HydrophobicContact CD1-CG2 4.14Å; Y244-I247 PolarHBondContact O-N 3.43Å; Y244-L248 WeakPolarHBondContact O-CB 3.1Å; Y244-L248 VanDerWaalsContact O-CG 3.3Å; Y244-L248 WeakPolarHBondContact O-CG 3.41Å; Y244-L248 PolarHBondContact O-N 3.23Å; Y244-I280 HydrophobicContact CD1-CG2 3.42Å; Y244-I280 VanDerWaalsContact CD1-CG2 3.42Å; Y244-I280 HydrophobicContact CD2-CG2 4.32Å; Y244-I280 HydrophobicContact CE1-CG2 3.68Å; Y244-I280 HydrophobicContact CE2-CG2 4.48Å; Y244-I280 HydrophobicContact CG-CG2 3.82Å; Y244-I312 HydrophobicContact CE1-CG2 4.32Å; Y244-I312 HydrophobicContact CE2-CD1 4.16Å; Y244-I312 WeakPolarHBondContact OH-CD1 3.28Å; Y244-I312 WeakPolarHBondContact OH-CG2 3.29Å
245I97.1Very high97.8Very high1 Ų18 Ų81%0.0054%0.037CC..Hα-helixtrans-53.7-39.5170.7-72.5157.9000110M71 T191 L194 L195 P241 E242 I247 P249M71-I245 HydrophobicContact SD-CG2 4.45Å; T191-I245 HydrophobicContact CG2-CB 3.89Å; T191-I245 HydrophobicContact CG2-CG1 3.98Å; T191-I245 HydrophobicContact CG2-CG2 3.57Å; L194-I245 HydrophobicContact CB-CD1 3.75Å; L194-I245 HydrophobicContact CB-CG1 3.56Å; L194-I245 HydrophobicContact CD1-CG1 4.02Å; L194-I245 HydrophobicContact CG-CG1 4.43Å; L195-I245 HydrophobicContact CB-CD1 4.46Å; L195-I245 HydrophobicContact CD1-CG2 4.31Å; L195-I245 HydrophobicContact CD2-CD1 3.7Å; L195-I245 HydrophobicContact CD2-CG1 4.35Å; L195-I245 HydrophobicContact CD2-CG2 3.81Å; L195-I245 HydrophobicContact CG-CD1 3.79Å; L195-I245 HydrophobicContact CG-CG1 4.1Å; L195-I245 HydrophobicContact CG-CG2 3.96Å; P241-I245 WeakPolarHBondContact O-CG1 3.16Å; P241-I245 PolarHBondContact O-N 2.88Å; E242-I245 WeakPolarHBondContact O-CA 3.28Å; E242-I245 VanDerWaalsContact O-CB 3.3Å; E242-I245 WeakPolarHBondContact O-CB 3.35Å; E242-I245 PolarHBondContact O-N 3.48Å; E242-I245 WeakPolarHBondContact OE2-CD1 3.43Å; I245-I247 VanDerWaalsContact C-N 3.34Å; I245-I247 PolarHBondContact O-N 3.43Å; I245-P249 WeakPolarHBondContact O-CD 3.39Å
246L95.1Very high97.6Very high2 Ų28.5 Ų8.51%0.014%0.04CC..THydrogen-bonded Turntrans-73-16.6178.3-58.8170.7000114.3I66 V70 M71 M74 E242 Y244 L381 A385I66-L246 HydrophobicContact CG1-CD1 4.43Å; I66-L246 HydrophobicContact CG2-CD1 3.89Å; I66-L246 HydrophobicContact CG2-CD2 4.17Å; V70-L246 HydrophobicContact CB-CD2 4.21Å; V70-L246 HydrophobicContact CG1-CB 4.33Å; V70-L246 HydrophobicContact CG1-CD2 3.64Å; M71-L246 HydrophobicContact CG-CD2 3.67Å; M74-L246 WeakPolarHBondContact CE-O 3.25Å; E242-L246 VanDerWaalsContact O-CG 3.31Å; E242-L246 WeakPolarHBondContact O-CG 3.25Å; E242-L246 PolarHBondContact O-N 3.21Å; Y244-L246 PolarHBondContact O-N 2.93Å; L246-L381 HydrophobicContact CB-CD1 4.04Å; L246-L381 HydrophobicContact CD1-CD1 3.59Å; L246-L381 HydrophobicContact CG-CD1 4.36Å; L246-A385 WeakPolarHBondContact O-CB 3.45Å
247I97.8Very high97.4Very high10 Ų108 Ų85%0.0514%0.038CC..THydrogen-bonded Turntrans-116.8-27.2-175.2-161.962.7000114.1Y244 I245 G250 F251 F344 F348Y244-I247 HydrophobicContact CD1-CG2 4.14Å; Y244-I247 PolarHBondContact O-N 3.43Å; I245-I247 VanDerWaalsContact C-N 3.34Å; I245-I247 PolarHBondContact O-N 3.43Å; I247-G250 CarbonylContact O-C 3.59Å; I247-G250 WeakPolarHBondContact O-CA 3.3Å; I247-G250 PolarHBondContact O-N 3.23Å; I247-F251 HydrophobicContact CB-CZ 4.45Å; I247-F251 HydrophobicContact CD1-CE1 4.36Å; I247-F251 HydrophobicContact CG1-CD1 4.16Å; I247-F251 HydrophobicContact CG1-CE1 3.59Å; I247-F251 HydrophobicContact CG1-CE2 4.25Å; I247-F251 HydrophobicContact CG1-CZ 3.65Å; I247-F251 HydrophobicContact CG2-CE2 3.89Å; I247-F251 HydrophobicContact CG2-CZ 3.94Å; I247-F251 PolarHBondContact O-N 3.26Å; I247-F344 HydrophobicContact CD1-CE2 3.93Å; I247-F344 HydrophobicContact CD1-CZ 4.25Å; I247-F348 HydrophobicContact CD1-CD2 4.16Å; I247-F348 HydrophobicContact CD1-CE2 3.95Å; I247-F348 HydrophobicContact CG1-CD2 4.39Å; I247-F348 HydrophobicContact CG1-CE2 3.7Å; I247-F348 HydrophobicContact CG1-CZ 4.23Å
248L98.3Very high97.3Very high0 Ų05.2 Ų5.20%03%0.026CC..Hα-helixtrans-56.9-48.5-178.5-77.6164.7000112.4S187 I190 T191 L194 Y244 G250 F251 G252 M277 I280S187-L248 WeakPolarHBondContact CB-O 3.3Å; I190-L248 HydrophobicContact CG2-CD1 3.81Å; T191-L248 WeakPolarHBondContact OG1-CB 3.28Å; L194-L248 HydrophobicContact CD1-CD1 3.62Å; Y244-L248 WeakPolarHBondContact O-CB 3.1Å; Y244-L248 VanDerWaalsContact O-CG 3.3Å; Y244-L248 WeakPolarHBondContact O-CG 3.41Å; Y244-L248 PolarHBondContact O-N 3.23Å; L248-G250 PolarHBondContact O-N 2.84Å; L248-F251 HydrophobicContact CD2-CD2 4.09Å; L248-F251 HydrophobicContact CD2-CE2 4.45Å; L248-F251 WeakPolarHBondContact O-CB 3.4Å; L248-F251 PolarHBondContact O-N 3.47Å; L248-F251 VanDerWaalsContact O-N 3.07Å; L248-G252 PolarHBondContact O-N 2.64Å; L248-G252 VanDerWaalsContact O-N 3.08Å; L248-M277 HydrophobicContact CD2-CB 4.24Å; L248-M277 HydrophobicContact CD2-CG 4.17Å; L248-I280 HydrophobicContact CD2-CG2 4.3Å
249P98.4Very high97.1Very high0 Ų05.9 Ų5.90%03%0.03CC..Hα-helixtrans-60.4-36.6174.6-23.736.1000112.3M74 I75 F184 S187 T191 I245 F251 G252 M253M74-P249 HydrophobicContact CB-CB 4.14Å; M74-P249 HydrophobicContact SD-CB 4.4Å; I75-P249 HydrophobicContact CD1-CB 4.32Å; 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 4.34Å; S187-P249 WeakPolarHBondContact OG-CA 3.3Å; T191-P249 HydrophobicContact CG2-CG 4.3Å; T191-P249 WeakPolarHBondContact OG1-CD 3.47Å; I245-P249 WeakPolarHBondContact O-CD 3.39Å; P249-F251 VanDerWaalsContact C-N 3.33Å; P249-F251 PolarHBondContact O-N 2.84Å; P249-G252 WeakPolarHBondContact O-CA 3.38Å; P249-G252 PolarHBondContact O-N 3.05Å; P249-G252 VanDerWaalsContact O-N 3.08Å; P249-M253 WeakPolarHBondContact O-CG 3.27Å; P249-M253 PolarHBondContact O-N 3.2Å
250G98.1Very high96.8Very high0 Ų07.9 Ų7.90%04%0.038CC..Hα-helixtrans-55.6-47.6172.500000111.8I247 L248 G252 M253 I254 A388I247-G250 CarbonylContact O-C 3.59Å; I247-G250 WeakPolarHBondContact O-CA 3.3Å; I247-G250 PolarHBondContact O-N 3.23Å; L248-G250 PolarHBondContact O-N 2.84Å; G250-G252 VanDerWaalsContact C-N 3.29Å; G250-G252 PolarHBondContact O-N 3.39Å; G250-M253 PolarHBondContact O-N 3.45Å; G250-I254 VanDerWaalsContact O-CG1 3.29Å; G250-I254 WeakPolarHBondContact O-CG1 3.42Å; G250-I254 PolarHBondContact O-N 3.19Å; G250-A388 VanDerWaalsContact CA-CB 3.48Å
251F98.4Very high96.6Very high3 Ų39.3 Ų9.31%0.0134%0.043CC..Hα-helixtrans-60.9-37.7174.3-58.9-32.5000113.6I247 L248 P249 S255 I280 K319 W323 F344 F348I247-F251 HydrophobicContact CB-CZ 4.45Å; I247-F251 HydrophobicContact CD1-CE1 4.36Å; I247-F251 HydrophobicContact CG1-CD1 4.16Å; I247-F251 HydrophobicContact CG1-CE1 3.59Å; I247-F251 HydrophobicContact CG1-CE2 4.25Å; I247-F251 HydrophobicContact CG1-CZ 3.65Å; I247-F251 HydrophobicContact CG2-CE2 3.89Å; I247-F251 HydrophobicContact CG2-CZ 3.94Å; I247-F251 PolarHBondContact O-N 3.26Å; L248-F251 HydrophobicContact CD2-CD2 4.09Å; L248-F251 HydrophobicContact CD2-CE2 4.45Å; L248-F251 WeakPolarHBondContact O-CB 3.4Å; L248-F251 PolarHBondContact O-N 3.47Å; L248-F251 VanDerWaalsContact O-N 3.07Å; P249-F251 VanDerWaalsContact C-N 3.33Å; P249-F251 PolarHBondContact O-N 2.84Å; F251-S255 WeakPolarHBondContact O-CB 3.3Å; F251-S255 PolarHBondContact O-N 2.93Å; F251-S255 PolarHBondContact O-OG 3.45Å; F251-I280 HydrophobicContact CE2-CD1 4.22Å; F251-K319 HydrophobicContact CD2-CD 4.29Å; F251-W323 HydrophobicContact CB-CH2 4.07Å; F251-W323 HydrophobicContact CB-CZ2 3.87Å; F251-W323 AromaticContact CD1-CH2 3.41Å; F251-W323 HydrophobicContact CD1-CH2 3.41Å; F251-W323 VanDerWaalsContact CD1-CH2 3.41Å; F251-W323 HydrophobicContact CD1-CZ2 4.08Å; F251-W323 HydrophobicContact CD1-CZ3 4.4Å; F251-W323 AromaticContact CE1-CH2 3.99Å; F251-W323 HydrophobicContact CE1-CH2 3.99Å; F251-W323 AromaticContact CG-CH2 3.94Å; F251-W323 HydrophobicContact CG-CH2 3.94Å; F251-W323 HydrophobicContact CG-CZ2 4.27Å; F251-F344 HydrophobicContact CD1-CE1 4.14Å; F251-F344 AromaticContact CD1-CZ 3.62Å; F251-F344 HydrophobicContact CD1-CZ 3.62Å; F251-F344 HydrophobicContact CE1-CE1 4.38Å; F251-F344 AromaticContact CE1-CZ 3.77Å; F251-F344 HydrophobicContact CE1-CZ 3.77Å; F251-F348 HydrophobicContact CE1-CD1 4.19Å; F251-F348 AromaticContact CE1-CE1 3.62Å; F251-F348 HydrophobicContact CE1-CE1 3.62Å; F251-F348 HydrophobicContact CE1-CE2 4.08Å; F251-F348 AromaticContact CE1-CZ 3.58Å; F251-F348 HydrophobicContact CE1-CZ 3.58Å; F251-F348 AromaticContact CZ-CE1 3.77Å; F251-F348 HydrophobicContact CZ-CE1 3.77Å; F251-F348 HydrophobicContact CZ-CE2 4.21Å; F251-F348 AromaticContact CZ-CZ 3.47Å; F251-F348 HydrophobicContact CZ-CZ 3.47Å; F251-F348 VanDerWaalsContact CZ-CZ 3.47Å
252G98.1Very high96.3Very high0 Ų09.9 Ų9.90%05%0.047CC..Hα-helixtrans-58.8-52.3172.700000111.4L248 P249 G250 I254 S255 H256L248-G252 PolarHBondContact O-N 2.64Å; L248-G252 VanDerWaalsContact O-N 3.08Å; P249-G252 WeakPolarHBondContact O-CA 3.38Å; P249-G252 PolarHBondContact O-N 3.05Å; P249-G252 VanDerWaalsContact O-N 3.08Å; G250-G252 VanDerWaalsContact C-N 3.29Å; G250-G252 PolarHBondContact O-N 3.39Å; G252-I254 PolarHBondContact O-N 3.06Å; G252-S255 WeakPolarHBondContact O-CB 3.29Å; G252-S255 PolarHBondContact O-N 2.87Å; G252-H256 PolarHBondContact O-CD2 3.41Å; G252-H256 PolarHBondContact O-N 2.87Å; G252-H256 VanDerWaalsContact O-N 3.09Å
253M98.4Very high95.8Very high0 Ų012.6 Ų12.60%08%0.076CC..Hα-helixtrans-59.3-46.9179.6-67.6-172-76.100112.4M74 F78 F184 P249 G250 S255 H256 I257 A388 I389 W396M74-M253 HydrophobicContact CG-CE 3.89Å; M74-M253 HydrophobicContact SD-CE 3.89Å; F78-M253 HydrophobicContact CB-SD 4.48Å; F78-M253 HydrophobicContact CD1-SD 4.25Å; F78-M253 HydrophobicContact CD2-CE 4.49Å; F78-M253 HydrophobicContact CD2-SD 3.74Å; F78-M253 HydrophobicContact CE1-SD 4.45Å; F78-M253 HydrophobicContact CE2-SD 3.95Å; F78-M253 HydrophobicContact CG-SD 3.91Å; F78-M253 HydrophobicContact CZ-SD 4.31Å; F184-M253 HydrophobicContact CD2-CG 3.74Å; F184-M253 HydrophobicContact CE2-CG 3.64Å; F184-M253 HydrophobicContact CE2-SD 4.45Å; P249-M253 WeakPolarHBondContact O-CG 3.27Å; P249-M253 PolarHBondContact O-N 3.2Å; G250-M253 PolarHBondContact O-N 3.45Å; M253-S255 VanDerWaalsContact C-N 3.29Å; M253-S255 PolarHBondContact O-N 3.36Å; M253-H256 PolarHBondContact O-N 2.88Å; M253-I257 WeakPolarHBondContact O-CG1 3.29Å; M253-I257 PolarHBondContact O-N 2.68Å; M253-A388 HydrophobicContact CE-CB 3.95Å; M253-I389 HydrophobicContact CE-CG1 4.47Å; M253-W396 HydrophobicContact CB-CH2 4.13Å; M253-W396 HydrophobicContact CB-CZ3 3.98Å; M253-W396 HydrophobicContact CG-CH2 4Å; M253-W396 HydrophobicContact CG-CZ3 3.69Å; M253-W396 HydrophobicContact SD-CZ3 4.06Å
254I98.4Very high95.5Very high0 Ų014.4 Ų14.40%08%0.081CC..Hα-helixtrans-62.1-39.1178.3-64.7-55.6000111.4G250 G252 H256 I257 V258 W323 A341 F344 I345 A388G250-I254 VanDerWaalsContact O-CG1 3.29Å; G250-I254 WeakPolarHBondContact O-CG1 3.42Å; G250-I254 PolarHBondContact O-N 3.19Å; G252-I254 PolarHBondContact O-N 3.06Å; I254-H256 VanDerWaalsContact C-N 3.34Å; I254-H256 PolarHBondContact O-N 3.32Å; I254-I257 HydrophobicContact CD1-CD1 4.45Å; I254-I257 PolarHBondContact O-N 3.49Å; I254-V258 HydrophobicContact CG2-CG2 4.08Å; I254-V258 VanDerWaalsContact O-CB 3.28Å; I254-V258 WeakPolarHBondContact O-CB 3.41Å; I254-V258 VanDerWaalsContact O-CG2 3.25Å; I254-V258 WeakPolarHBondContact O-CG2 3.25Å; I254-V258 PolarHBondContact O-N 3.05Å; I254-W323 HydrophobicContact CG2-CD2 4.09Å; I254-W323 HydrophobicContact CG2-CG 4.39Å; I254-W323 HydrophobicContact CG2-CZ2 4.36Å; I254-A341 HydrophobicContact CD1-CB 4.06Å; I254-A341 HydrophobicContact CG2-CB 4.47Å; I254-F344 HydrophobicContact CB-CD1 4.23Å; I254-F344 HydrophobicContact CB-CE1 4.32Å; I254-F344 HydrophobicContact CD1-CB 3.94Å; I254-F344 HydrophobicContact CD1-CD1 4.12Å; I254-F344 HydrophobicContact CD1-CD2 4.35Å; I254-F344 HydrophobicContact CD1-CG 3.88Å; I254-F344 HydrophobicContact CG1-CB 4.32Å; I254-F344 HydrophobicContact CG1-CD1 3.56Å; I254-F344 HydrophobicContact CG1-CD2 4.05Å; I254-F344 HydrophobicContact CG1-CE1 3.83Å; I254-F344 HydrophobicContact CG1-CE2 4.27Å; I254-F344 HydrophobicContact CG1-CG 3.7Å; I254-F344 HydrophobicContact CG1-CZ 4.19Å; I254-F344 HydrophobicContact CG2-CD1 3.93Å; I254-F344 HydrophobicContact CG2-CE1 4.24Å; I254-I345 HydrophobicContact CG2-CG1 4.33Å; I254-A388 HydrophobicContact CD1-CB 4.18Å; I254-A388 HydrophobicContact CG1-CB 4.09Å
255S97.4Very high94.9Very high2 Ų221.1 Ų21.11%0.01411%0.111CC..Hα-helixtrans-62.6-41.2176.7-53.70000112.2F251 G252 M253 T259 M273 W323F251-S255 WeakPolarHBondContact O-CB 3.3Å; F251-S255 PolarHBondContact O-N 2.93Å; F251-S255 PolarHBondContact O-OG 3.45Å; G252-S255 WeakPolarHBondContact O-CB 3.29Å; G252-S255 PolarHBondContact O-N 2.87Å; M253-S255 VanDerWaalsContact C-N 3.29Å; M253-S255 PolarHBondContact O-N 3.36Å; S255-T259 VanDerWaalsContact O-CB 3.28Å; S255-T259 WeakPolarHBondContact O-CB 3.44Å; S255-T259 PolarHBondContact O-N 3.02Å; S255-T259 PolarHBondContact O-OG1 2.87Å; S255-M273 VanDerWaalsContact OG-CE 3.25Å; S255-M273 WeakPolarHBondContact OG-CE 3.42Å; S255-W323 PolarHBondContact OG-NE1 3.32Å
256H95.1Very high94.5Very high17 Ų1726.9 Ų26.98%0.07914%0.138CC..Hα-helixtrans-64.4-49.8175.1-86.2-100.9000111.8P182 F184 G252 M253 I254 V258 T259 Y260 W396P182-H256 WeakPolarHBondContact CB-CE1 3.43Å; P182-H256 VanDerWaalsContact CB-NE2 3.26Å; P182-H256 WeakPolarHBondContact CB-NE2 3.26Å; F184-H256 VanDerWaalsContact CB-CD2 3.44Å; F184-H256 WeakPolarHBondContact CB-CD2 3.43Å; F184-H256 VanDerWaalsContact CB-NE2 3.34Å; F184-H256 WeakPolarHBondContact CB-NE2 3.2Å; F184-H256 PolarHBondContact N-NE2 2.92Å; G252-H256 PolarHBondContact O-CD2 3.41Å; G252-H256 PolarHBondContact O-N 2.87Å; G252-H256 VanDerWaalsContact O-N 3.09Å; M253-H256 PolarHBondContact O-N 2.88Å; I254-H256 VanDerWaalsContact C-N 3.34Å; I254-H256 PolarHBondContact O-N 3.32Å; H256-V258 PolarHBondContact O-N 3.48Å; H256-T259 PolarHBondContact O-N 3.38Å; H256-Y260 VanDerWaalsContact O-CB 3.25Å; H256-Y260 WeakPolarHBondContact O-CB 3.28Å; H256-Y260 PolarHBondContact O-N 3.18Å; H256-W396 HydrophobicContact CB-CH2 4.07Å; H256-W396 HydrophobicContact CB-CZ2 3.98Å
257I95.5Very high94.4Very high0 Ų027.3 Ų27.30%014%0.14CC..Hα-helixtrans-60.1-49.2-179.6-65.3164.1000110.5M253 I254 T259 Y260 Y261 A337 A341 H395M253-I257 WeakPolarHBondContact O-CG1 3.29Å; M253-I257 PolarHBondContact O-N 2.68Å; I254-I257 HydrophobicContact CD1-CD1 4.45Å; I254-I257 PolarHBondContact O-N 3.49Å; I257-T259 VanDerWaalsContact C-N 3.32Å; I257-T259 PolarHBondContact O-N 2.95Å; I257-Y260 PolarHBondContact O-N 3.47Å; I257-Y261 HydrophobicContact CG2-CD2 3.81Å; I257-Y261 HydrophobicContact CG2-CE2 4.09Å; I257-Y261 VanDerWaalsContact O-CD2 3.32Å; I257-Y261 WeakPolarHBondContact O-CD2 3.38Å; I257-Y261 PolarHBondContact O-N 3.45Å; I257-A337 HydrophobicContact CG2-CB 4.07Å; I257-A341 HydrophobicContact CG2-CB 3.95Å; I257-H395 HydrophobicContact CD1-CB 4.47Å; I257-H395 HydrophobicContact CG1-CB 4.09Å
258V95.6Very high94.4Very high3 Ų333.1 Ų33.12%0.01817%0.166CC..Hα-helixtrans-59.5-44.2179.61650000110.9I254 H256 S262 T326 L327 A341 I345I254-V258 HydrophobicContact CG2-CG2 4.08Å; I254-V258 VanDerWaalsContact O-CB 3.28Å; I254-V258 WeakPolarHBondContact O-CB 3.41Å; I254-V258 VanDerWaalsContact O-CG2 3.25Å; I254-V258 WeakPolarHBondContact O-CG2 3.25Å; I254-V258 PolarHBondContact O-N 3.05Å; H256-V258 PolarHBondContact O-N 3.48Å; V258-S262 WeakPolarHBondContact O-CB 3.45Å; V258-S262 PolarHBondContact O-N 3.08Å; V258-S262 VanDerWaalsContact O-N 3.14Å; V258-S262 PolarHBondContact O-OG 3.07Å; V258-T326 HydrophobicContact CG1-CG2 3.72Å; V258-L327 HydrophobicContact CB-CD2 4.47Å; V258-L327 HydrophobicContact CG1-CD1 4.47Å; V258-L327 HydrophobicContact CG1-CD2 3.78Å; V258-L327 HydrophobicContact CG1-CG 3.75Å; V258-L327 HydrophobicContact CG2-CD2 4.35Å; V258-A341 HydrophobicContact CG2-CB 4.12Å; V258-I345 HydrophobicContact CG2-CD1 4.28Å
259T93.3Very high94.3Very high14 Ų1434.9 Ų34.99%0.08618%0.184CC..Hα-helixtrans-67.1-48.2-179.5-56.40000111.3S255 H256 I257 S262 G263 K264S255-T259 VanDerWaalsContact O-CB 3.28Å; S255-T259 WeakPolarHBondContact O-CB 3.44Å; S255-T259 PolarHBondContact O-N 3.02Å; S255-T259 PolarHBondContact O-OG1 2.87Å; H256-T259 PolarHBondContact O-N 3.38Å; I257-T259 VanDerWaalsContact C-N 3.32Å; I257-T259 PolarHBondContact O-N 2.95Å; T259-S262 PolarHBondContact O-N 3.45Å; T259-G263 PolarHBondContact O-N 2.94Å; T259-K264 HydrophobicContact CG2-CB 4.46Å; T259-K264 WeakPolarHBondContact CG2-O 3.35Å; T259-K264 PolarHBondContact O-N 3.33Å
260Y92.3Very high94.1Very high41 Ų4136.3 Ų36.316%0.16119%0.19CC..Hα-helixtrans-56.6-54.5-179.7-176.7-91.7000111.7H256 I257 S262 G263 H395 E486H256-Y260 VanDerWaalsContact O-CB 3.25Å; H256-Y260 WeakPolarHBondContact O-CB 3.28Å; H256-Y260 PolarHBondContact O-N 3.18Å; I257-Y260 PolarHBondContact O-N 3.47Å; Y260-S262 VanDerWaalsContact C-N 3.29Å; Y260-S262 PolarHBondContact O-N 2.88Å; Y260-G263 PolarHBondContact O-N 3.08Å; Y260-G263 VanDerWaalsContact O-N 3.14Å; Y260-H395 AromaticContact CD1-CE1 3.68Å; Y260-H395 AromaticContact CD2-CE1 3.98Å; Y260-H395 AromaticContact CG-CE1 3.68Å; Y260-E486 VanDerWaalsContact CE2-O 3.3Å; Y260-E486 WeakPolarHBondContact CE2-O 3.29Å; Y260-E486 PolarHBondContact OH-N 3Å; Y260-E486 PolarHBondContact OH-O 3.33Å
261Y92.1Very high94.1Very high41 Ų4140 Ų4016%0.16121%0.208CC..Hα-helixtrans-77.8-12.5-176.4-73.4-79.2000114.2I257 G263 S335 A337 V338 H395I257-Y261 HydrophobicContact CG2-CD2 3.81Å; I257-Y261 HydrophobicContact CG2-CE2 4.09Å; I257-Y261 VanDerWaalsContact O-CD2 3.32Å; I257-Y261 WeakPolarHBondContact O-CD2 3.38Å; I257-Y261 PolarHBondContact O-N 3.45Å; Y261-G263 VanDerWaalsContact C-N 3.33Å; Y261-S335 WeakPolarHBondContact CD1-OG 3.46Å; Y261-S335 WeakPolarHBondContact CE1-OG 3.36Å; Y261-A337 HydrophobicContact CD2-CB 4.44Å; Y261-A337 HydrophobicContact CE2-CB 3.6Å; Y261-V338 HydrophobicContact CD1-CG2 3.94Å; Y261-V338 HydrophobicContact CD2-CG2 3.76Å; Y261-V338 HydrophobicContact CG-CG2 3.39Å; Y261-H395 AromaticContact CE2-ND1 3.84Å
262S91.6Very high94Very high11 Ų1141.4 Ų41.48%0.07722%0.223CC..THydrogen-bonded Turntrans-84-8.4169.8-58.80000112.8V258 T259 Y260 K264V258-S262 WeakPolarHBondContact O-CB 3.45Å; V258-S262 PolarHBondContact O-N 3.08Å; V258-S262 VanDerWaalsContact O-N 3.14Å; V258-S262 PolarHBondContact O-OG 3.07Å; T259-S262 PolarHBondContact O-N 3.45Å; Y260-S262 VanDerWaalsContact C-N 3.29Å; Y260-S262 PolarHBondContact O-N 2.88Å; S262-K264 PolarHBondContact O-N 3.18Å
263G88.4Confident94Very high59 Ų5941.4 Ų41.461%0.60822%0.223SC*.THydrogen-bonded Turntrans64.322.6-175.600000113.6T259 Y260 Y261T259-G263 PolarHBondContact O-N 2.94Å; Y260-G263 PolarHBondContact O-N 3.08Å; Y260-G263 VanDerWaalsContact O-N 3.14Å; Y261-G263 VanDerWaalsContact C-N 3.33Å
264K88.4Confident94Very high68 Ų6841.4 Ų41.430%0.29622%0.223SC..  trans-94.1149.3178.9-68.1-174.3178.6175.10109.5T259 S262 A325 T326 H328T259-K264 HydrophobicContact CG2-CB 4.46Å; T259-K264 WeakPolarHBondContact CG2-O 3.35Å; T259-K264 PolarHBondContact O-N 3.33Å; S262-K264 PolarHBondContact O-N 3.18Å; K264-A325 PolarHBondContact NZ-O 3.33Å; K264-T326 HydrophobicContact CD-CG2 4.02Å; K264-T326 VanDerWaalsContact CD-O 3.3Å; K264-T326 WeakPolarHBondContact CD-O 3.5Å; K264-T326 WeakPolarHBondContact CE-O 3.48Å; K264-T326 PolarHBondContact NZ-O 2.95Å; K264-H328 PolarHBondContact NZ-O 3.29Å
265K85.3Confident94Very high171 Ų17147.7 Ų47.774%0.74325%0.247SC*.SBendtrans-69.3-37178.5-59.7-167.5172-1780112.5M490K265-M490 HydrophobicContact CB-SD 4.06Å; K265-M490 HydrophobicContact CD-CE 4.37Å; K265-M490 HydrophobicContact CG-CE 3.81Å; K265-M490 HydrophobicContact CG-SD 3.68Å
266E89.6Confident94.1Very high122 Ų12247.9 Ų47.957%0.5725%0.249SC*.SBendtrans-146.2155.9-177.362.1178.5173.600109.6
267P92.9Very high94.2Very high11 Ų1147 Ų477%0.07125%0.245CC..  trans-68.4150.5172.227.5-32.3000111L183 G269 Y270 M273 T326L183-P267 HydrophobicContact CD1-CB 4.4Å; L183-P267 HydrophobicContact CD1-CG 3.46Å; L183-P267 VanDerWaalsContact CD1-CG 3.46Å; L183-P267 HydrophobicContact CG-CG 4.26Å; P267-G269 PolarHBondContact O-N 2.91Å; P267-Y270 HydrophobicContact CG-CD2 4.4Å; P267-Y270 PolarHBondContact O-N 2.98Å; P267-M273 HydrophobicContact CB-SD 3.68Å; P267-M273 HydrophobicContact CG-SD 3.91Å; P267-T326 WeakPolarHBondContact CA-OG1 3.24Å; P267-T326 HydrophobicContact CB-CG2 4.42Å
268F96.4Very high94.3Very high132 Ų13249.5 Ų49.558%0.57926%0.257SS*.THydrogen-bonded Turntrans-58.4122.1177.7179.7-92.7000111.1S322 A325 T326F268-S322 VanDerWaalsContact O-CB 3.27Å; F268-S322 WeakPolarHBondContact O-CB 3.24Å; F268-S322 PolarHBondContact O-OG 2.59Å; F268-A325 HydrophobicContact CB-CB 3.84Å; F268-A325 HydrophobicContact CD1-CB 3.53Å; F268-A325 HydrophobicContact CD2-CB 4.25Å; F268-A325 HydrophobicContact CE1-CB 4.14Å; F268-A325 HydrophobicContact CG-CB 3.59Å; F268-T326 PolarHBondContact N-OG1 3.49Å
269G95.8Very high94.5Very high38 Ų3851.8 Ų51.839%0.39227%0.273SS..THydrogen-bonded Turntrans67.644.2-179.900000112.7P267 M271 G272 M273P267-G269 PolarHBondContact O-N 2.91Å; G269-M271 VanDerWaalsContact C-N 3.27Å; G269-M271 PolarHBondContact O-N 3.13Å; G269-M271 VanDerWaalsContact O-N 3.15Å; G269-G272 CarbonylContact O-C 3.48Å; G269-G272 VanDerWaalsContact O-CA 3.32Å; G269-G272 WeakPolarHBondContact O-CA 3.35Å; G269-G272 PolarHBondContact O-N 2.95Å; G269-M273 PolarHBondContact O-N 3.45Å
270Y95.9Very high94.7Very high30 Ų3051.1 Ų51.112%0.11827%0.269CS..Hα-helixtrans-41.7-50.4178.7166.7-90.7000113.3Y179 T181 L183 W186 P267 G272 M273 V274Y179-Y270 WeakPolarHBondContact O-CE1 3.23Å; Y179-Y270 PolarHBondContact O-OH 3.33Å; T181-Y270 PolarHBondContact O-OH 3.09Å; L183-Y270 HydrophobicContact CD1-CD2 4.39Å; L183-Y270 HydrophobicContact CD2-CD2 3.59Å; L183-Y270 HydrophobicContact CD2-CE2 3.41Å; L183-Y270 VanDerWaalsContact CD2-CE2 3.41Å; L183-Y270 HydrophobicContact CG-CD2 3.79Å; L183-Y270 HydrophobicContact CG-CE2 3.78Å; W186-Y270 PolarHBondContact NE1-OH 2.65Å; W186-Y270 VanDerWaalsContact NE1-OH 3.13Å; P267-Y270 HydrophobicContact CG-CD2 4.4Å; P267-Y270 PolarHBondContact O-N 2.98Å; Y270-G272 VanDerWaalsContact C-N 3.34Å; Y270-G272 PolarHBondContact O-N 3.15Å; Y270-M273 WeakPolarHBondContact O-CB 2.82Å; Y270-M273 PolarHBondContact O-N 2.96Å; Y270-M273 VanDerWaalsContact O-N 3.09Å; Y270-V274 HydrophobicContact CE1-CG2 3.94Å; Y270-V274 HydrophobicContact CE2-CG2 4.13Å; Y270-V274 PolarHBondContact O-N 3.47Å
271M96.9Very high95Very high77 Ų7749.3 Ų49.338%0.37926%0.263SS..Hα-helixtrans-61.9-40.5177.5-71.2-60.7-65.200112.5Y179 G269 M273 V274 W275Y179-M271 HydrophobicContact CD1-CE 3.49Å; Y179-M271 VanDerWaalsContact CD1-CE 3.49Å; Y179-M271 HydrophobicContact CD1-SD 3.85Å; Y179-M271 HydrophobicContact CE1-CE 3.7Å; Y179-M271 HydrophobicContact CG-CE 4.15Å; Y179-M271 HydrophobicContact CG-SD 4.33Å; G269-M271 VanDerWaalsContact C-N 3.27Å; G269-M271 PolarHBondContact O-N 3.13Å; G269-M271 VanDerWaalsContact O-N 3.15Å; M271-M273 VanDerWaalsContact C-N 3.27Å; M271-M273 PolarHBondContact O-N 3.5Å; M271-V274 PolarHBondContact O-N 3.12Å; M271-W275 PolarHBondContact O-N 3.43Å
272G97.5Very high95.2Very high33 Ų3354.3 Ų54.334%0.3429%0.286SS..Hα-helixtrans-60.4-37.1174.400000112.3G269 Y270 A276G269-G272 CarbonylContact O-C 3.48Å; G269-G272 VanDerWaalsContact O-CA 3.32Å; G269-G272 WeakPolarHBondContact O-CA 3.35Å; G269-G272 PolarHBondContact O-N 2.95Å; Y270-G272 VanDerWaalsContact C-N 3.34Å; Y270-G272 PolarHBondContact O-N 3.15Å; G272-A276 VanDerWaalsContact O-CB 3.23Å; G272-A276 WeakPolarHBondContact O-CB 3.32Å; G272-A276 PolarHBondContact O-N 3.17Å
273M97.9Very high95.5Very high0 Ų055 Ų550%029%0.289CS..Hα-helixtrans-69.4-38.2174.9-62.3-17575.300112.8L183 S255 P267 G269 Y270 M271 A276 M277 W323L183-M273 HydrophobicContact CD1-CB 3.87Å; L183-M273 HydrophobicContact CD1-CE 3.69Å; L183-M273 HydrophobicContact CD1-CG 4.36Å; L183-M273 HydrophobicContact CD1-SD 3.55Å; L183-M273 VanDerWaalsContact CD1-SD 3.55Å; L183-M273 HydrophobicContact CD2-CB 4.19Å; S255-M273 VanDerWaalsContact OG-CE 3.25Å; S255-M273 WeakPolarHBondContact OG-CE 3.42Å; P267-M273 HydrophobicContact CB-SD 3.68Å; P267-M273 HydrophobicContact CG-SD 3.91Å; G269-M273 PolarHBondContact O-N 3.45Å; Y270-M273 WeakPolarHBondContact O-CB 2.82Å; Y270-M273 PolarHBondContact O-N 2.96Å; Y270-M273 VanDerWaalsContact O-N 3.09Å; M271-M273 VanDerWaalsContact C-N 3.27Å; M271-M273 PolarHBondContact O-N 3.5Å; M273-A276 PolarHBondContact O-N 2.94Å; M273-M277 WeakPolarHBondContact O-CG 3.16Å; M273-M277 PolarHBondContact O-N 3.12Å; M273-W323 HydrophobicContact CE-CZ2 4.3Å; M273-W323 VanDerWaalsContact CE-NE1 3.33Å
274V98.3Very high95.8Very high0 Ų052.2 Ų52.20%026%0.26CS..Hα-helixtrans-61.9-51.3173.8173.30000110.5L183 W186 Y270 M271 A276 M277 M278L183-V274 HydrophobicContact CD2-CG2 3.54Å; W186-V274 HydrophobicContact CD2-CG1 3.81Å; W186-V274 HydrophobicContact CD2-CG2 4.4Å; 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 4.09Å; W186-V274 HydrophobicContact CZ2-CG1 3.78Å; W186-V274 HydrophobicContact CZ3-CG1 4.25Å; Y270-V274 HydrophobicContact CE1-CG2 3.94Å; Y270-V274 HydrophobicContact CE2-CG2 4.13Å; Y270-V274 PolarHBondContact O-N 3.47Å; M271-V274 PolarHBondContact O-N 3.12Å; V274-A276 VanDerWaalsContact C-N 3.33Å; V274-A276 PolarHBondContact O-N 3.35Å; V274-M277 PolarHBondContact O-N 3.48Å; V274-M278 HydrophobicContact CG1-CE 3.98Å; V274-M278 PolarHBondContact O-N 2.98Å
275W98.3Very high96.2Very high132 Ų13250.5 Ų50.550%0.525%0.252SS..Hα-helixtrans-61.1-41.3177.1-73.2112.6000112.2M271 M277 M278 S279M271-W275 PolarHBondContact O-N 3.43Å; W275-M277 VanDerWaalsContact C-N 3.33Å; W275-M277 PolarHBondContact O-N 3.44Å; W275-M278 HydrophobicContact CD2-CE 3.52Å; W275-M278 HydrophobicContact CE3-CE 3.12Å; W275-M278 HydrophobicContact CG-CE 4.24Å; W275-M278 HydrophobicContact CH2-CE 3.82Å; W275-M278 HydrophobicContact CZ2-CE 4.21Å; W275-M278 HydrophobicContact CZ3-CE 3.28Å; W275-M278 PolarHBondContact O-N 3.4Å; W275-S279 WeakPolarHBondContact O-CB 3.48Å; W275-S279 PolarHBondContact O-N 2.96Å; W275-S279 PolarHBondContact O-OG 2.71Å; W275-S279 VanDerWaalsContact O-OG 3.06Å
276A98.3Very high96.8Very high5 Ų544.6 Ų44.64%0.04123%0.228CC..Hα-helixtrans-59.3-41.5175.200000112.5G272 M273 V274 S279 I280 P315 V318 K319G272-A276 VanDerWaalsContact O-CB 3.23Å; G272-A276 WeakPolarHBondContact O-CB 3.32Å; G272-A276 PolarHBondContact O-N 3.17Å; M273-A276 PolarHBondContact O-N 2.94Å; V274-A276 VanDerWaalsContact C-N 3.33Å; V274-A276 PolarHBondContact O-N 3.35Å; A276-S279 PolarHBondContact O-N 2.87Å; A276-I280 VanDerWaalsContact O-CG1 3.28Å; A276-I280 WeakPolarHBondContact O-CG1 3.44Å; A276-I280 PolarHBondContact O-N 3.37Å; A276-P315 HydrophobicContact CB-CB 3.88Å; A276-P315 WeakPolarHBondContact CB-O 3.4Å; A276-V318 HydrophobicContact CB-CB 4.42Å; A276-V318 HydrophobicContact CB-CG1 4.32Å; A276-K319 HydrophobicContact CB-CD 4.11Å; A276-K319 HydrophobicContact CB-CG 3.78Å
277M98.4Very high97.2Very high0 Ų038.8 Ų38.80%020%0.201CC..Hα-helixtrans-65.4-43175.7-71.6-173.9-66.300112.6L183 W186 I190 L248 M273 V274 W275 S279 I280 G281 K319L183-M277 HydrophobicContact CB-CE 4.4Å; L183-M277 HydrophobicContact CD2-CE 3.74Å; W186-M277 HydrophobicContact CB-CE 3.72Å; I190-M277 HydrophobicContact CD1-CB 3.38Å; L248-M277 HydrophobicContact CD2-CB 4.24Å; L248-M277 HydrophobicContact CD2-CG 4.17Å; M273-M277 WeakPolarHBondContact O-CG 3.16Å; M273-M277 PolarHBondContact O-N 3.12Å; V274-M277 PolarHBondContact O-N 3.48Å; W275-M277 VanDerWaalsContact C-N 3.33Å; W275-M277 PolarHBondContact O-N 3.44Å; M277-S279 VanDerWaalsContact C-N 3.33Å; M277-I280 PolarHBondContact O-N 3.15Å; M277-G281 PolarHBondContact O-N 3.2Å; M277-K319 HydrophobicContact CG-CD 4.13Å; M277-K319 PolarHBondContact SD-NZ 3.28Å
278M98.3Very high97.5Very high52 Ų5241 Ų4126%0.25621%0.208SC..Hα-helixtrans-64.9-40.1177.5-68.4-171.7-60.500111.2W186 I190 V274 W275 G281 F282W186-M278 HydrophobicContact CH2-SD 4.41Å; W186-M278 HydrophobicContact CZ3-SD 3.99Å; I190-M278 HydrophobicContact CD1-CG 3.79Å; I190-M278 HydrophobicContact CG1-CG 4.33Å; V274-M278 HydrophobicContact CG1-CE 3.98Å; V274-M278 PolarHBondContact O-N 2.98Å; W275-M278 HydrophobicContact CD2-CE 3.52Å; W275-M278 HydrophobicContact CE3-CE 3.12Å; W275-M278 HydrophobicContact CG-CE 4.24Å; W275-M278 HydrophobicContact CH2-CE 3.82Å; W275-M278 HydrophobicContact CZ2-CE 4.21Å; W275-M278 HydrophobicContact CZ3-CE 3.28Å; W275-M278 PolarHBondContact O-N 3.4Å; M278-G281 PolarHBondContact O-N 2.89Å; M278-F282 PolarHBondContact O-N 2.88Å
279S98.3Very high97.5Very high50 Ų5034.7 Ų34.735%0.3518%0.18SC..Hα-helixtrans-61.1-45.1173.7-63.60000111.9W275 A276 M277 G281 F282 L283W275-S279 WeakPolarHBondContact O-CB 3.48Å; W275-S279 PolarHBondContact O-N 2.96Å; W275-S279 PolarHBondContact O-OG 2.71Å; W275-S279 VanDerWaalsContact O-OG 3.06Å; A276-S279 PolarHBondContact O-N 2.87Å; M277-S279 VanDerWaalsContact C-N 3.33Å; S279-G281 PolarHBondContact O-N 3.43Å; S279-F282 PolarHBondContact O-N 2.99Å; S279-L283 VanDerWaalsContact O-CB 3.25Å; S279-L283 WeakPolarHBondContact O-CB 3.19Å; S279-L283 WeakPolarHBondContact O-CG 3.47Å; S279-L283 PolarHBondContact O-N 3.49Å
280I98.1Very high97.7Very high0 Ų033.9 Ų33.90%017%0.167CC..Hα-helixtrans-60.3-46.2175.6-69.7163.2000110.6Y244 L248 F251 A276 M277 F282 L283 G284 I312 P315 K319Y244-I280 HydrophobicContact CD1-CG2 3.42Å; Y244-I280 VanDerWaalsContact CD1-CG2 3.42Å; Y244-I280 HydrophobicContact CD2-CG2 4.32Å; Y244-I280 HydrophobicContact CE1-CG2 3.68Å; Y244-I280 HydrophobicContact CE2-CG2 4.48Å; Y244-I280 HydrophobicContact CG-CG2 3.82Å; L248-I280 HydrophobicContact CD2-CG2 4.3Å; F251-I280 HydrophobicContact CE2-CD1 4.22Å; A276-I280 VanDerWaalsContact O-CG1 3.28Å; A276-I280 WeakPolarHBondContact O-CG1 3.44Å; A276-I280 PolarHBondContact O-N 3.37Å; M277-I280 PolarHBondContact O-N 3.15Å; I280-F282 PolarHBondContact O-N 3.38Å; I280-L283 PolarHBondContact O-N 2.81Å; I280-G284 PolarHBondContact O-N 3.23Å; I280-I312 HydrophobicContact CG1-CG2 4.39Å; I280-P315 HydrophobicContact CD1-CB 4.33Å; I280-P315 HydrophobicContact CG1-CB 3.97Å; I280-P315 HydrophobicContact CG1-CG 3.82Å; I280-K319 HydrophobicContact CD1-CD 4.15Å
281G97.6Very high97.8Very high4 Ų434.5 Ų34.54%0.04117%0.17CC..Hα-helixtrans-60-45.4178.600000112.8L194 M277 M278 S279L194-G281 WeakPolarHBondContact CD2-O 3.33Å; M277-G281 PolarHBondContact O-N 3.2Å; M278-G281 PolarHBondContact O-N 2.89Å; S279-G281 PolarHBondContact O-N 3.43Å
282F98Very high97.8Very high145 Ų14530.8 Ų30.864%0.63615%0.152SC*.Hα-helixtrans-66.7-50176.9176.5-99000112.3M278 S279 I280 G284 F285 I286M278-F282 PolarHBondContact O-N 2.88Å; S279-F282 PolarHBondContact O-N 2.99Å; I280-F282 PolarHBondContact O-N 3.38Å; F282-G284 PolarHBondContact O-N 3.43Å; F282-F285 PolarHBondContact O-N 3.03Å; F282-I286 HydrophobicContact CE1-CD1 4.41Å
283L96.4Very high97.8Very high27 Ų2729.4 Ų29.414%0.14114%0.137CC..Hα-helixtrans-62.2-28-178.5-68.9173.9000111.9S279 I280 F285 I286 I311 I312 P315S279-L283 VanDerWaalsContact O-CB 3.25Å; S279-L283 WeakPolarHBondContact O-CB 3.19Å; S279-L283 WeakPolarHBondContact O-CG 3.47Å; S279-L283 PolarHBondContact O-N 3.49Å; I280-L283 PolarHBondContact O-N 2.81Å; L283-F285 PolarHBondContact O-N 3.33Å; L283-F285 VanDerWaalsContact O-N 3.16Å; L283-I286 HydrophobicContact CD2-CD1 3.7Å; L283-I286 HydrophobicContact CD2-CG1 4.22Å; L283-I286 VanDerWaalsContact O-CG1 3.3Å; L283-I286 WeakPolarHBondContact O-CG1 3.29Å; L283-I286 PolarHBondContact O-N 3.33Å; L283-I311 HydrophobicContact CD1-CG2 3.99Å; L283-I312 HydrophobicContact CB-CD1 3.95Å; L283-I312 HydrophobicContact CB-CG1 3.78Å; L283-I312 HydrophobicContact CD1-CG1 3.92Å; L283-I312 HydrophobicContact CG-CG1 4.47Å; L283-P315 HydrophobicContact CD1-CG 4.44Å
284G95.1Very high97.8Very high0 Ų032.4 Ų32.40%016%0.155CC..G310 helixtrans-58-26.6177.300000115I280 F282I280-G284 PolarHBondContact O-N 3.23Å; F282-G284 PolarHBondContact O-N 3.43Å
285F97.6Very high97.7Very high32 Ų3234.2 Ų34.214%0.1417%0.166CC..G310 helixtrans-84.3-7176.1-77.7-70.1000114.7L194 L197 F237 P241 F282 L283 W288L194-F285 HydrophobicContact CD2-CD2 4.06Å; L194-F285 HydrophobicContact CD2-CE2 3.36Å; L194-F285 HydrophobicContact CD2-CZ 4.07Å; L197-F285 HydrophobicContact CB-CE1 4.24Å; L197-F285 HydrophobicContact CB-CE2 4.22Å; L197-F285 HydrophobicContact CB-CZ 3.59Å; L197-F285 HydrophobicContact CD1-CE2 4.19Å; L197-F285 HydrophobicContact CD1-CZ 4.39Å; F237-F285 AromaticContact CE1-CD1 3.95Å; F237-F285 HydrophobicContact CE1-CD1 3.95Å; F237-F285 HydrophobicContact CE1-CE1 4.1Å; F237-F285 HydrophobicContact CE2-CD1 4.35Å; F237-F285 AromaticContact CZ-CD1 3.75Å; F237-F285 HydrophobicContact CZ-CD1 3.75Å; F237-F285 HydrophobicContact CZ-CE1 4.32Å; P241-F285 HydrophobicContact CB-CE1 4.08Å; P241-F285 HydrophobicContact CB-CZ 4.2Å; P241-F285 HydrophobicContact CG-CD1 3.65Å; P241-F285 HydrophobicContact CG-CE1 3.61Å; P241-F285 HydrophobicContact CG-CG 4.23Å; P241-F285 HydrophobicContact CG-CZ 4.17Å; F282-F285 PolarHBondContact O-N 3.03Å; L283-F285 PolarHBondContact O-N 3.33Å; L283-F285 VanDerWaalsContact O-N 3.16Å; F285-W288 WeakPolarHBondContact O-CZ3 3.47Å
286I97.4Very high97.6Very high47 Ų4731.3 Ų31.324%0.24118%0.177CC..G310 helixtrans-118.512.5-175.768.4169000113.6F282 L283 F305F282-I286 HydrophobicContact CE1-CD1 4.41Å; L283-I286 HydrophobicContact CD2-CD1 3.7Å; L283-I286 HydrophobicContact CD2-CG1 4.22Å; L283-I286 VanDerWaalsContact O-CG1 3.3Å; L283-I286 WeakPolarHBondContact O-CG1 3.29Å; L283-I286 PolarHBondContact O-N 3.33Å; I286-F305 VanDerWaalsContact O-CE1 3.32Å; I286-F305 WeakPolarHBondContact O-CE1 3.47Å
287V98.2Very high97.4Very high0 Ų032.2 Ų32.20%018%0.18CC..  trans-124.21.1-177.4-60.80000114.4H240 A289 H290 A308 I312H240-V287 WeakPolarHBondContact CD2-CG2 3.1Å; H240-V287 WeakPolarHBondContact NE2-CG2 3.28Å; V287-A289 PolarHBondContact O-N 3.35Å; V287-H290 PolarHBondContact O-CE1 3.02Å; V287-H290 PolarHBondContact O-N 2.91Å; V287-H290 PolarHBondContact O-ND1 3.32Å; V287-A308 HydrophobicContact CG1-CB 3.85Å; V287-I312 HydrophobicContact CB-CD1 4.21Å; V287-I312 HydrophobicContact CG1-CD1 3.74Å; V287-I312 HydrophobicContact CG1-CG1 4.46Å; V287-I312 HydrophobicContact CG2-CD1 3.63Å
288W98.4Very high97.3Very high56 Ų5636.3 Ų36.321%0.21220%0.203CC..G310 helixtrans-55.5-32.3-16873.292.6000115.1H233 W236 F237 H240 F285 H290 H291 F305H233-W288 AromaticContact ND1-NE1 3.52Å; W236-W288 HydrophobicContact CB-CB 4.26Å; W236-W288 VanDerWaalsContact O-CB 3.27Å; W236-W288 WeakPolarHBondContact O-CB 3.04Å; F237-W288 HydrophobicContact CB-CG 4.38Å; F237-W288 HydrophobicContact CD2-CD2 4.03Å; F237-W288 AromaticContact CD2-CE3 3.98Å; F237-W288 HydrophobicContact CD2-CE3 3.98Å; F237-W288 HydrophobicContact CD2-CZ3 4.26Å; F237-W288 HydrophobicContact CE2-CE3 4.41Å; F237-W288 HydrophobicContact CE2-CZ3 4.38Å; H240-W288 HydrophobicContact CB-CB 4.12Å; F285-W288 WeakPolarHBondContact O-CZ3 3.47Å; W288-H290 PolarHBondContact O-N 3.5Å; W288-H291 PolarHBondContact O-CD2 3.06Å; W288-H291 PolarHBondContact O-N 2.77Å; W288-F305 HydrophobicContact CD2-CE1 4.22Å; W288-F305 HydrophobicContact CD2-CZ 4.32Å; W288-F305 HydrophobicContact CE3-CE1 4.09Å; W288-F305 HydrophobicContact CE3-CZ 4.32Å; W288-F305 AromaticContact CH2-CZ 3.96Å; W288-F305 HydrophobicContact CH2-CZ 3.96Å; W288-F305 AromaticContact CZ2-CZ 3.94Å; W288-F305 HydrophobicContact CZ2-CZ 3.94Å; W288-F305 HydrophobicContact CZ3-CE1 4.25Å; W288-F305 HydrophobicContact CZ3-CZ 4.15Å
289A97.6Very high97.2Very high0 Ų038.5 Ų38.50%022%0.219CC..G310 helixtrans-75.3-2.2-173.200000113.9V287 H291 M292 M297 F305V287-A289 PolarHBondContact O-N 3.35Å; A289-H291 PolarHBondContact O-N 2.87Å; A289-M292 WeakPolarHBondContact O-CA 3.42Å; A289-M292 WeakPolarHBondContact O-CB 3.4Å; A289-M292 PolarHBondContact O-N 2.79Å; A289-M297 HydrophobicContact CB-CE 4.09Å; A289-M297 HydrophobicContact CB-SD 3.99Å; A289-M297 WeakPolarHBondContact O-CE 3.49Å; A289-F305 HydrophobicContact CB-CD1 3.81Å; A289-F305 HydrophobicContact CB-CD2 3.65Å; A289-F305 HydrophobicContact CB-CE1 3.64Å; A289-F305 HydrophobicContact CB-CE2 3.46Å; A289-F305 VanDerWaalsContact CB-CE2 3.46Å; A289-F305 HydrophobicContact CB-CG 3.83Å; A289-F305 HydrophobicContact CB-CZ 3.46Å; A289-F305 VanDerWaalsContact CB-CZ 3.46Å
290H98.3Very high97.2Very high22 Ų2242.2 Ų42.210%0.10224%0.235CC..G310 helixtrans-62.8-20.3169.660.9-127.3000113.1H240 V287 W288 M292 F293 T309H240-H290 AromaticContact CE1-CE1 3.01Å; H240-H290 PolarHBondContact CE1-CE1 2.75Å; H240-H290 AromaticContact CE1-NE2 3.2Å; H240-H290 PolarHBondContact CE1-NE2 3.29Å; H240-H290 AromaticContact CG-CE1 3.77Å; H240-H290 AromaticContact CG-NE2 3.84Å; H240-H290 AromaticContact ND1-CE1 3.05Å; H240-H290 PolarHBondContact ND1-CE1 3.37Å; H240-H290 AromaticContact ND1-NE2 2.88Å; H240-H290 PolarHBondContact ND1-NE2 3.23Å; H240-H290 AromaticContact NE2-CE1 3.59Å; V287-H290 PolarHBondContact O-CE1 3.02Å; V287-H290 PolarHBondContact O-N 2.91Å; V287-H290 PolarHBondContact O-ND1 3.32Å; W288-H290 PolarHBondContact O-N 3.5Å; H290-M292 PolarHBondContact O-N 2.83Å; H290-F293 HydrophobicContact CB-CD2 4.17Å; H290-F293 HydrophobicContact CB-CE1 4.2Å; H290-F293 HydrophobicContact CB-CE2 3.45Å; H290-F293 VanDerWaalsContact CB-CE2 3.45Å; H290-F293 HydrophobicContact CB-CZ 3.47Å; H290-F293 VanDerWaalsContact CB-CZ 3.47Å; H290-F293 VanDerWaalsContact O-CD2 3.23Å; H290-F293 WeakPolarHBondContact O-CD2 3.4Å; H290-T309 VanDerWaalsContact ND1-CG2 3.32Å; H290-T309 WeakPolarHBondContact ND1-CG2 3.29Å; H290-T309 PolarHBondContact ND1-OG1 2.87Å
291H98.1Very high97.1Very high42 Ų4244.3 Ų44.319%0.19425%0.248CC..G310 helixtrans-75.40.4172.4-63.7-71.2000113.1W236 H240 W288 A289 H368W236-H291 HydrophobicContact CD2-CB 3.41Å; W236-H291 VanDerWaalsContact CD2-CB 3.41Å; W236-H291 AromaticContact CD2-CD2 3.57Å; W236-H291 AromaticContact CD2-CG 3.56Å; W236-H291 AromaticContact CE2-CG 3.76Å; W236-H291 HydrophobicContact CE3-CB 3.96Å; W236-H291 AromaticContact CE3-CD2 3.25Å; W236-H291 AromaticContact CE3-CG 3.55Å; W236-H291 AromaticContact CE3-NE2 3.65Å; W236-H291 HydrophobicContact CG-CB 3.68Å; W236-H291 HydrophobicContact CH2-CB 4.3Å; W236-H291 AromaticContact CH2-CG 3.99Å; W236-H291 AromaticContact CH2-ND1 3.88Å; W236-H291 HydrophobicContact CZ2-CB 3.78Å; 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 3.77Å; W236-H291 AromaticContact CZ3-ND1 3.84Å; W236-H291 AromaticContact CZ3-NE2 3.72Å; H240-H291 AromaticContact ND1-NE2 3.29Å; H240-H291 PolarHBondContact ND1-NE2 3.35Å; W288-H291 PolarHBondContact O-CD2 3.06Å; W288-H291 PolarHBondContact O-N 2.77Å; A289-H291 PolarHBondContact O-N 2.87Å; H291-H368 PolarHBondContact O-CE1 3.19Å
292M97.9Very high97.1Very high0 Ų046.8 Ų46.80%026%0.256CS..G310 helixtrans-126.815-171.3-55.7174.261.200111.7I229 Q232 H233 W236 A289 H290 T294 V295 M297I229-M292 HydrophobicContact CG2-CE 3.75Å; Q232-M292 HydrophobicContact CB-CE 3.57Å; Q232-M292 HydrophobicContact CB-CG 4.43Å; Q232-M292 HydrophobicContact CB-SD 4.05Å; H233-M292 VanDerWaalsContact CD2-CE 3.46Å; H233-M292 WeakPolarHBondContact CD2-CE 3.13Å; H233-M292 WeakPolarHBondContact NE2-CE 3.19Å; W236-M292 HydrophobicContact CG-CG 4.5Å; A289-M292 WeakPolarHBondContact O-CA 3.42Å; A289-M292 WeakPolarHBondContact O-CB 3.4Å; A289-M292 PolarHBondContact O-N 2.79Å; H290-M292 PolarHBondContact O-N 2.83Å; M292-T294 PolarHBondContact O-N 2.97Å; M292-V295 HydrophobicContact CB-CG1 3.95Å; M292-V295 HydrophobicContact CB-CG2 4.04Å; M292-V295 HydrophobicContact CE-CG2 4.19Å; M292-V295 VanDerWaalsContact O-CG2 3.24Å; M292-V295 WeakPolarHBondContact O-CG2 3.48Å; M292-V295 PolarHBondContact O-N 3.22Å; M292-M297 HydrophobicContact CB-CE 4.16Å; M292-M297 WeakPolarHBondContact O-CE 3.47Å
293F97.8Very high97.1Very high3 Ų342.2 Ų42.21%0.01324%0.244CC..THydrogen-bonded Turntrans-58.8-20.2-174.8-73-38000114.7H290 M297 R302 F305 D364H290-F293 HydrophobicContact CB-CD2 4.17Å; H290-F293 HydrophobicContact CB-CE1 4.2Å; H290-F293 HydrophobicContact CB-CE2 3.45Å; H290-F293 VanDerWaalsContact CB-CE2 3.45Å; H290-F293 HydrophobicContact CB-CZ 3.47Å; H290-F293 VanDerWaalsContact CB-CZ 3.47Å; H290-F293 VanDerWaalsContact O-CD2 3.23Å; H290-F293 WeakPolarHBondContact O-CD2 3.4Å; F293-M297 HydrophobicContact CD1-CE 3.94Å; F293-R302 HydrophobicContact CD1-CB 4.4Å; F293-R302 HydrophobicContact CD1-CG 4.04Å; F293-F305 HydrophobicContact CE1-CB 3.7Å; F293-F305 HydrophobicContact CZ-CB 4.09Å; F293-D364 HydrophobicContact CB-CB 4.38Å; F293-D364 HydrophobicContact CD2-CB 3.83Å
294T96.8Very high97.2Very high64 Ų6446.5 Ų46.539%0.39326%0.259SS..THydrogen-bonded Turntrans-93.2-4.5179.353.90000114.5M292 G296 H368M292-T294 PolarHBondContact O-N 2.97Å; T294-G296 PolarHBondContact O-N 2.9Å; T294-H368 HydrophobicContact CG2-CB 3.49Å; T294-H368 VanDerWaalsContact CG2-CB 3.49Å; T294-H368 VanDerWaalsContact CG2-CG 3.49Å; T294-H368 PolarHBondContact OG1-CD2 3.38Å; T294-H368 VanDerWaalsContact OG1-CD2 3.3Å; T294-H368 PolarHBondContact OG1-NE2 3.5Å
295V96.4Very high97.3Very high38 Ų3847.1 Ų47.123%0.2326%0.262CS..SBendtrans-790.2-177.8-48.40000114I229 M292 M297I229-V295 HydrophobicContact CD1-CB 4.4Å; I229-V295 HydrophobicContact CG2-CG2 4.2Å; M292-V295 HydrophobicContact CB-CG1 3.95Å; M292-V295 HydrophobicContact CB-CG2 4.04Å; M292-V295 HydrophobicContact CE-CG2 4.19Å; M292-V295 VanDerWaalsContact O-CG2 3.24Å; M292-V295 WeakPolarHBondContact O-CG2 3.48Å; M292-V295 PolarHBondContact O-N 3.22Å; V295-M297 HydrophobicContact CG2-CG 3.87Å
296G95.8Very high97.3Very high70 Ų7046.4 Ų46.472%0.72226%0.26SS*.  trans8925179.300000115.1T294T294-G296 PolarHBondContact O-N 2.9Å
297M95.8Very high97.3Very high24 Ų2447.5 Ų47.512%0.11827%0.272CS..  trans-58.2149.4170.4-67.3-174.1-6100111.7A289 M292 F293 V295 T301 R302A289-M297 HydrophobicContact CB-CE 4.09Å; A289-M297 HydrophobicContact CB-SD 3.99Å; A289-M297 WeakPolarHBondContact O-CE 3.49Å; M292-M297 HydrophobicContact CB-CE 4.16Å; M292-M297 WeakPolarHBondContact O-CE 3.47Å; F293-M297 HydrophobicContact CD1-CE 3.94Å; V295-M297 HydrophobicContact CG2-CG 3.87Å; M297-T301 HydrophobicContact CB-CG2 4.23Å; M297-T301 HydrophobicContact CG-CG2 4.44Å; M297-T301 HydrophobicContact SD-CG2 3.76Å; M297-R302 HydrophobicContact CB-CG 4.01Å; M297-R302 HydrophobicContact CE-CG 4.23Å; M297-R302 PolarHBondContact O-NE 3.42Å
298D96.2Very high97.3Very high87 Ų8747.8 Ų47.847%0.46528%0.275SS..  trans-60.6161.4177.468.6-86.1000112.3D300 T301 R302D298-D300 VanDerWaalsContact C-N 3.31Å; D298-D300 PolarHBondContact O-N 3.42Å; D298-D300 PolarHBondContact OD2-N 3.49Å; D298-D300 VanDerWaalsContact OD2-N 3.1Å; D298-T301 VanDerWaalsContact CG-OG1 3.24Å; D298-T301 PolarHBondContact O-N 3.04Å; D298-T301 VanDerWaalsContact OD1-CB 3.24Å; D298-T301 WeakPolarHBondContact OD1-CB 3.3Å; D298-T301 PolarHBondContact OD1-OG1 3.26Å; D298-T301 PolarHBondContact OD2-N 3.38Å; D298-T301 PolarHBondContact OD2-OG1 2.85Å; D298-R302 WeakPolarHBondContact O-CG 3.44Å; D298-R302 PolarHBondContact O-N 3.37Å; D298-R302 VanDerWaalsContact O-N 3.08Å
299V95.9Very high97.3Very high98 Ų9846 Ų4659%0.59427%0.27SS*.Hα-helixtrans-62.9-38.8-174177.50000111.6R302 A303V299-R302 PolarHBondContact O-N 3.21Å; V299-A303 WeakPolarHBondContact O-CB 3.33Å; V299-A303 PolarHBondContact O-N 3.29Å
300D97.6Very high97.3Very high128 Ų12849.2 Ų49.268%0.68429%0.286SS*.Hα-helixtrans-71.8-41.8-176-65.5-22000110.8D298 R302 A303 Y304D298-D300 VanDerWaalsContact C-N 3.31Å; D298-D300 PolarHBondContact O-N 3.42Å; D298-D300 PolarHBondContact OD2-N 3.49Å; D298-D300 VanDerWaalsContact OD2-N 3.1Å; D300-R302 PolarHBondContact O-N 2.94Å; D300-A303 PolarHBondContact O-N 3.04Å; D300-Y304 WeakPolarHBondContact O-CB 3.31Å; D300-Y304 PolarHBondContact O-N 2.98Å
301T96.9Very high97.3Very high44 Ų4452.2 Ų52.227%0.2730%0.302SS..Hα-helixtrans-59-45.9172.4-65.20000110.9M297 D298 A303 Y304 F305M297-T301 HydrophobicContact CB-CG2 4.23Å; M297-T301 HydrophobicContact CG-CG2 4.44Å; M297-T301 HydrophobicContact SD-CG2 3.76Å; D298-T301 VanDerWaalsContact CG-OG1 3.24Å; D298-T301 PolarHBondContact O-N 3.04Å; D298-T301 VanDerWaalsContact OD1-CB 3.24Å; D298-T301 WeakPolarHBondContact OD1-CB 3.3Å; D298-T301 PolarHBondContact OD1-OG1 3.26Å; D298-T301 PolarHBondContact OD2-N 3.38Å; D298-T301 PolarHBondContact OD2-OG1 2.85Å; T301-A303 PolarHBondContact O-N 2.95Å; T301-Y304 PolarHBondContact O-N 3.01Å; T301-F305 HydrophobicContact CG2-CD2 3.73Å; T301-F305 HydrophobicContact CG2-CE2 3.84Å; T301-F305 VanDerWaalsContact O-CD2 3.31Å; T301-F305 WeakPolarHBondContact O-CD2 3.4Å; T301-F305 PolarHBondContact O-N 2.88Å
302R97.1Very high97.2Very high56 Ų5650.5 Ų50.521%0.21129%0.294CS..Hα-helixtrans-64.3-38.7176.5-71.1-171.2-68152.81.9112.6F293 M297 D298 V299 D300 T306F293-R302 HydrophobicContact CD1-CB 4.4Å; F293-R302 HydrophobicContact CD1-CG 4.04Å; M297-R302 HydrophobicContact CB-CG 4.01Å; M297-R302 HydrophobicContact CE-CG 4.23Å; M297-R302 PolarHBondContact O-NE 3.42Å; D298-R302 WeakPolarHBondContact O-CG 3.44Å; D298-R302 PolarHBondContact O-N 3.37Å; D298-R302 VanDerWaalsContact O-N 3.08Å; V299-R302 PolarHBondContact O-N 3.21Å; D300-R302 PolarHBondContact O-N 2.94Å; R302-T306 VanDerWaalsContact O-CB 3.28Å; R302-T306 WeakPolarHBondContact O-CB 3.24Å; R302-T306 PolarHBondContact O-N 2.68Å; R302-T306 PolarHBondContact O-OG1 2.7Å
303A97.2Very high97.2Very high48 Ų4852.3 Ų52.340%0.39731%0.309SS..Hα-helixtrans-65.5-41.2176.200000112.1V299 D300 T301 S307V299-A303 WeakPolarHBondContact O-CB 3.33Å; V299-A303 PolarHBondContact O-N 3.29Å; D300-A303 PolarHBondContact O-N 3.04Å; T301-A303 PolarHBondContact O-N 2.95Å; A303-S307 WeakPolarHBondContact O-CB 3.41Å; A303-S307 PolarHBondContact O-N 3.3Å; A303-S307 PolarHBondContact O-OG 3.16Å
304Y98.2Very high97.2Very high117 Ų11757.6 Ų57.646%0.45934%0.336SS..Hα-helixtrans-59.2-56.4173.3169.4-96.6000111.1D300 T301 T306 S307 A308D300-Y304 WeakPolarHBondContact O-CB 3.31Å; D300-Y304 PolarHBondContact O-N 2.98Å; T301-Y304 PolarHBondContact O-N 3.01Å; Y304-T306 VanDerWaalsContact C-N 3.28Å; Y304-T306 PolarHBondContact O-N 2.76Å; Y304-S307 PolarHBondContact O-N 3.47Å; Y304-S307 VanDerWaalsContact O-N 3.12Å; Y304-A308 HydrophobicContact CE1-CB 4.42Å; Y304-A308 WeakPolarHBondContact O-CB 3.36Å; Y304-A308 PolarHBondContact O-N 3.47Å
305F98.1Very high97.3Very high14 Ų1455.1 Ų55.16%0.06132%0.321CS..Hα-helixtrans-65.9-31.1-176.7-83.6-73.1000112.5I286 W288 A289 F293 T301 T309I286-F305 VanDerWaalsContact O-CE1 3.32Å; I286-F305 WeakPolarHBondContact O-CE1 3.47Å; W288-F305 HydrophobicContact CD2-CE1 4.22Å; W288-F305 HydrophobicContact CD2-CZ 4.32Å; W288-F305 HydrophobicContact CE3-CE1 4.09Å; W288-F305 HydrophobicContact CE3-CZ 4.32Å; W288-F305 AromaticContact CH2-CZ 3.96Å; W288-F305 HydrophobicContact CH2-CZ 3.96Å; W288-F305 AromaticContact CZ2-CZ 3.94Å; W288-F305 HydrophobicContact CZ2-CZ 3.94Å; W288-F305 HydrophobicContact CZ3-CE1 4.25Å; W288-F305 HydrophobicContact CZ3-CZ 4.15Å; A289-F305 HydrophobicContact CB-CD1 3.81Å; A289-F305 HydrophobicContact CB-CD2 3.65Å; A289-F305 HydrophobicContact CB-CE1 3.64Å; A289-F305 HydrophobicContact CB-CE2 3.46Å; A289-F305 VanDerWaalsContact CB-CE2 3.46Å; A289-F305 HydrophobicContact CB-CG 3.83Å; A289-F305 HydrophobicContact CB-CZ 3.46Å; A289-F305 VanDerWaalsContact CB-CZ 3.46Å; F293-F305 HydrophobicContact CE1-CB 3.7Å; F293-F305 HydrophobicContact CZ-CB 4.09Å; T301-F305 HydrophobicContact CG2-CD2 3.73Å; T301-F305 HydrophobicContact CG2-CE2 3.84Å; T301-F305 VanDerWaalsContact O-CD2 3.31Å; T301-F305 WeakPolarHBondContact O-CD2 3.4Å; T301-F305 PolarHBondContact O-N 2.88Å; F305-T309 WeakPolarHBondContact O-CB 3.47Å; F305-T309 PolarHBondContact O-N 2.92Å; F305-T309 PolarHBondContact O-OG1 3.5Å
306T98.1Very high97.3Very high16 Ų1654.5 Ų54.510%0.09832%0.317CS..Hα-helixtrans-60.3-53.5170.1-640000110.6R302 Y304 T309 M310 A359 S361R302-T306 VanDerWaalsContact O-CB 3.28Å; R302-T306 WeakPolarHBondContact O-CB 3.24Å; R302-T306 PolarHBondContact O-N 2.68Å; R302-T306 PolarHBondContact O-OG1 2.7Å; Y304-T306 VanDerWaalsContact C-N 3.28Å; Y304-T306 PolarHBondContact O-N 2.76Å; T306-T309 PolarHBondContact O-N 2.96Å; T306-M310 HydrophobicContact CG2-CE 3.74Å; T306-M310 HydrophobicContact CG2-SD 4.12Å; T306-M310 WeakPolarHBondContact O-CG 3.36Å; T306-M310 PolarHBondContact O-N 2.79Å; T306-A359 WeakPolarHBondContact CA-O 3.1Å; T306-A359 WeakPolarHBondContact CG2-O 3.44Å; T306-A359 PolarHBondContact OG1-O 2.89Å; T306-S361 VanDerWaalsContact OG1-CB 3.29Å; T306-S361 WeakPolarHBondContact OG1-CB 3.45Å; T306-S361 PolarHBondContact OG1-N 3.34Å; T306-S361 PolarHBondContact OG1-OG 3.31Å
307S97.6Very high97.4Very high70 Ų7052.1 Ų52.149%0.4929%0.293SS..Hα-helixtrans-63.9-47.3-177.1-55.60000111.7A303 Y304 T309 M310 I311A303-S307 WeakPolarHBondContact O-CB 3.41Å; A303-S307 PolarHBondContact O-N 3.3Å; A303-S307 PolarHBondContact O-OG 3.16Å; Y304-S307 PolarHBondContact O-N 3.47Å; Y304-S307 VanDerWaalsContact O-N 3.12Å; S307-T309 PolarHBondContact O-N 3.4Å; S307-M310 PolarHBondContact O-N 3.08Å; S307-I311 WeakPolarHBondContact O-CG1 3.12Å; S307-I311 PolarHBondContact O-N 3.14Å; S307-I311 VanDerWaalsContact O-N 3.09Å
308A97.8Very high97.5Very high7 Ų753.7 Ų53.76%0.05830%0.304CS..Hα-helixtrans-61.9-41.5179.500000112V287 Y304 I311V287-A308 HydrophobicContact CG1-CB 3.85Å; Y304-A308 HydrophobicContact CE1-CB 4.42Å; Y304-A308 WeakPolarHBondContact O-CB 3.36Å; Y304-A308 PolarHBondContact O-N 3.47Å; A308-I311 PolarHBondContact O-N 3.43Å
309T97.9Very high97.6Very high19 Ų1949.6 Ų49.612%0.11728%0.282CS..Hα-helixtrans-66.4-42.9177.5-55.50000111.5H290 F305 T306 S307 I311 I312 A359H290-T309 VanDerWaalsContact ND1-CG2 3.32Å; H290-T309 WeakPolarHBondContact ND1-CG2 3.29Å; H290-T309 PolarHBondContact ND1-OG1 2.87Å; F305-T309 WeakPolarHBondContact O-CB 3.47Å; F305-T309 PolarHBondContact O-N 2.92Å; F305-T309 PolarHBondContact O-OG1 3.5Å; T306-T309 PolarHBondContact O-N 2.96Å; S307-T309 PolarHBondContact O-N 3.4Å; T309-I311 VanDerWaalsContact C-N 3.28Å; T309-I311 PolarHBondContact O-N 3.18Å; T309-I312 WeakPolarHBondContact O-CB 3.36Å; T309-I312 PolarHBondContact O-N 3.16Å; T309-A359 HydrophobicContact CG2-CB 3.56Å
310M97.7Very high97.7Very high66 Ų6645.8 Ų45.833%0.32526%0.259SS..Hα-helixtrans-63.5-32.3177.5-72.5179.2-179.500112.9T306 S307 I312 A313 A359 N360T306-M310 HydrophobicContact CG2-CE 3.74Å; T306-M310 HydrophobicContact CG2-SD 4.12Å; T306-M310 WeakPolarHBondContact O-CG 3.36Å; T306-M310 PolarHBondContact O-N 2.79Å; S307-M310 PolarHBondContact O-N 3.08Å; M310-I312 PolarHBondContact O-N 3.21Å; M310-A313 VanDerWaalsContact O-CB 3.23Å; M310-A313 WeakPolarHBondContact O-CB 3.39Å; M310-A313 PolarHBondContact O-N 2.89Å; M310-A313 VanDerWaalsContact O-N 3.08Å; M310-A359 HydrophobicContact CE-CB 4.4Å; M310-A359 HydrophobicContact CG-CB 3.91Å; M310-N360 HydrophobicContact CE-CB 3.73Å
311I97.7Very high97.7Very high85 Ų8546.7 Ų46.744%0.43626%0.257SS..Hα-helixtrans-59.8-30176.8-72.4166.1000111.8L283 S307 A308 T309 A313 I314 P315L283-I311 HydrophobicContact CD1-CG2 3.99Å; S307-I311 WeakPolarHBondContact O-CG1 3.12Å; S307-I311 PolarHBondContact O-N 3.14Å; S307-I311 VanDerWaalsContact O-N 3.09Å; A308-I311 PolarHBondContact O-N 3.43Å; T309-I311 VanDerWaalsContact C-N 3.28Å; T309-I311 PolarHBondContact O-N 3.18Å; I311-A313 PolarHBondContact O-N 3.49Å; I311-A313 VanDerWaalsContact O-N 3.17Å; I311-I314 WeakPolarHBondContact O-CB 3.28Å; I311-I314 PolarHBondContact O-N 2.76Å; I311-P315 VanDerWaalsContact O-CD 3.24Å; I311-P315 WeakPolarHBondContact O-CD 3.36Å
312I97.2Very high97.8Very high7 Ų745 Ų454%0.03625%0.247CC..THydrogen-bonded Turntrans-62.8-23.5178.5-58.4-179000112.4Y244 I280 L283 V287 T309 M310 I314 P315 T316Y244-I312 HydrophobicContact CE1-CG2 4.32Å; Y244-I312 HydrophobicContact CE2-CD1 4.16Å; Y244-I312 WeakPolarHBondContact OH-CD1 3.28Å; Y244-I312 WeakPolarHBondContact OH-CG2 3.29Å; I280-I312 HydrophobicContact CG1-CG2 4.39Å; L283-I312 HydrophobicContact CB-CD1 3.95Å; L283-I312 HydrophobicContact CB-CG1 3.78Å; L283-I312 HydrophobicContact CD1-CG1 3.92Å; L283-I312 HydrophobicContact CG-CG1 4.47Å; V287-I312 HydrophobicContact CB-CD1 4.21Å; V287-I312 HydrophobicContact CG1-CD1 3.74Å; V287-I312 HydrophobicContact CG1-CG1 4.46Å; V287-I312 HydrophobicContact CG2-CD1 3.63Å; T309-I312 WeakPolarHBondContact O-CB 3.36Å; T309-I312 PolarHBondContact O-N 3.16Å; M310-I312 PolarHBondContact O-N 3.21Å; I312-I314 PolarHBondContact O-N 3.02Å; I312-P315 VanDerWaalsContact O-CD 3.27Å; I312-P315 WeakPolarHBondContact O-CD 3.4Å; I312-P315 WeakPolarHBondContact O-CG 3.38Å; I312-T316 WeakPolarHBondContact O-CB 3.29Å; I312-T316 PolarHBondContact O-N 3.39Å; I312-T316 PolarHBondContact O-OG1 3.14Å
313A97.2Very high97.8Very high38 Ų3842.4 Ų42.431%0.31424%0.237SC..Hα-helixtrans-60.9-26.917400000112.5M310 I311 G317 I356M310-A313 VanDerWaalsContact O-CB 3.23Å; M310-A313 WeakPolarHBondContact O-CB 3.39Å; M310-A313 PolarHBondContact O-N 2.89Å; M310-A313 VanDerWaalsContact O-N 3.08Å; I311-A313 PolarHBondContact O-N 3.49Å; I311-A313 VanDerWaalsContact O-N 3.17Å; A313-G317 PolarHBondContact O-N 3.48Å; A313-I356 HydrophobicContact CB-CD1 3.81Å; A313-I356 HydrophobicContact CB-CG1 4.13Å
314I98.2Very high97.8Very high113 Ų11344 Ų4458%0.57924%0.238SC*.Hα-helixtrans-67.3-62.3-179.5-59.4172.9000111.8I311 I312 T316 G317 V318I311-I314 WeakPolarHBondContact O-CB 3.28Å; I311-I314 PolarHBondContact O-N 2.76Å; I312-I314 PolarHBondContact O-N 3.02Å; I314-T316 PolarHBondContact O-N 2.88Å; I314-G317 PolarHBondContact O-N 3.26Å; I314-G317 VanDerWaalsContact O-N 3.11Å; I314-V318 WeakPolarHBondContact O-CG2 3.25Å; I314-V318 PolarHBondContact O-N 3.23Å
315P98.2Very high97.8Very high12 Ų1240 Ų408%0.07823%0.229CC..Hα-helixtrans-62.7-32.2178.825.4-34.8000112A276 I280 L283 I311 I312 V318 K319A276-P315 HydrophobicContact CB-CB 3.88Å; A276-P315 WeakPolarHBondContact CB-O 3.4Å; I280-P315 HydrophobicContact CD1-CB 4.33Å; I280-P315 HydrophobicContact CG1-CB 3.97Å; I280-P315 HydrophobicContact CG1-CG 3.82Å; L283-P315 HydrophobicContact CD1-CG 4.44Å; I311-P315 VanDerWaalsContact O-CD 3.24Å; I311-P315 WeakPolarHBondContact O-CD 3.36Å; I312-P315 VanDerWaalsContact O-CD 3.27Å; I312-P315 WeakPolarHBondContact O-CD 3.4Å; I312-P315 WeakPolarHBondContact O-CG 3.38Å; P315-V318 PolarHBondContact O-N 2.6Å; P315-K319 WeakPolarHBondContact O-CG 3.38Å; P315-K319 PolarHBondContact O-N 3.25Å
316T97.4Very high97.7Very high25 Ų2539.3 Ų39.315%0.15323%0.226CC..Hα-helixtrans-63.2-45.5173.5-54.90000111.3I312 I314 V318 K319 V320 F348I312-T316 WeakPolarHBondContact O-CB 3.29Å; I312-T316 PolarHBondContact O-N 3.39Å; I312-T316 PolarHBondContact O-OG1 3.14Å; I314-T316 PolarHBondContact O-N 2.88Å; T316-V318 PolarHBondContact O-N 3.41Å; T316-K319 WeakPolarHBondContact O-CB 3.4Å; T316-K319 PolarHBondContact O-N 3.06Å; T316-V320 PolarHBondContact O-N 2.64Å; T316-V320 VanDerWaalsContact O-N 3.14Å; T316-F348 HydrophobicContact CG2-CE1 3.61Å; T316-F348 HydrophobicContact CG2-CZ 4.17Å
317G97.4Very high97.5Very high20 Ų2039.6 Ų39.621%0.20623%0.227CC..Hα-helixtrans-61-43175.700000112.7A313 I314 K319 V320 F321A313-G317 PolarHBondContact O-N 3.48Å; I314-G317 PolarHBondContact O-N 3.26Å; I314-G317 VanDerWaalsContact O-N 3.11Å; G317-K319 PolarHBondContact O-N 2.73Å; G317-V320 PolarHBondContact O-N 2.84Å; G317-V320 VanDerWaalsContact O-N 3.13Å; G317-F321 WeakPolarHBondContact O-CD2 3.19Å; G317-F321 PolarHBondContact O-N 2.93Å
318V98.1Very high97.4Very high58 Ų5843.6 Ų43.635%0.35224%0.238SC..Hα-helixtrans-52-44.8174.5170.30000110.8A276 I314 P315 T316 S322A276-V318 HydrophobicContact CB-CB 4.42Å; A276-V318 HydrophobicContact CB-CG1 4.32Å; I314-V318 WeakPolarHBondContact O-CG2 3.25Å; I314-V318 PolarHBondContact O-N 3.23Å; P315-V318 PolarHBondContact O-N 2.6Å; T316-V318 PolarHBondContact O-N 3.41Å; V318-S322 WeakPolarHBondContact O-CB 3.39Å; V318-S322 PolarHBondContact O-N 3.16Å; V318-S322 PolarHBondContact O-OG 3.48Å
319K98.1Very high97Very high1 Ų146.9 Ų46.90%0.00427%0.273CS..Hα-helixtrans-66.9-44.1179-65.1-17960.9145.30112.8F251 A276 M277 I280 P315 T316 G317 F321 S322 W323F251-K319 HydrophobicContact CD2-CD 4.29Å; A276-K319 HydrophobicContact CB-CD 4.11Å; A276-K319 HydrophobicContact CB-CG 3.78Å; M277-K319 HydrophobicContact CG-CD 4.13Å; M277-K319 PolarHBondContact SD-NZ 3.28Å; I280-K319 HydrophobicContact CD1-CD 4.15Å; P315-K319 WeakPolarHBondContact O-CG 3.38Å; P315-K319 PolarHBondContact O-N 3.25Å; T316-K319 WeakPolarHBondContact O-CB 3.4Å; T316-K319 PolarHBondContact O-N 3.06Å; G317-K319 PolarHBondContact O-N 2.73Å; K319-F321 PolarHBondContact O-N 3.48Å; K319-S322 PolarHBondContact O-N 3.22Å; K319-W323 HydrophobicContact CB-CH2 3.9Å; K319-W323 HydrophobicContact CB-CZ2 4.2Å; K319-W323 HydrophobicContact CB-CZ3 4.18Å; K319-W323 VanDerWaalsContact O-CD2 3.28Å; K319-W323 PolarHBondContact O-N 2.97Å
320V98.1Very high96.6Very high17 Ų1747.3 Ų47.310%0.10328%0.277CS..Hα-helixtrans-58.2-48.7176.2172.60000110.9T316 G317 S322 W323 L324 I345T316-V320 PolarHBondContact O-N 2.64Å; T316-V320 VanDerWaalsContact O-N 3.14Å; G317-V320 PolarHBondContact O-N 2.84Å; G317-V320 VanDerWaalsContact O-N 3.13Å; V320-S322 PolarHBondContact O-N 2.77Å; V320-W323 HydrophobicContact CG2-CE3 4.29Å; V320-W323 HydrophobicContact CG2-CZ3 3.99Å; V320-W323 PolarHBondContact O-N 3.42Å; V320-L324 HydrophobicContact CG1-CD1 4.34Å; V320-L324 WeakPolarHBondContact O-CG 3.25Å; V320-L324 PolarHBondContact O-N 3.28Å; V320-L324 VanDerWaalsContact O-N 3.1Å; V320-I345 HydrophobicContact CG1-CG2 4.23Å
321F98.2Very high96Very high148 Ų14851.9 Ų51.965%0.64930%0.302SS*.Hα-helixtrans-66-37.4177.7-69.2-60.2000112.6G317 K319 W323 L324 A325G317-F321 WeakPolarHBondContact O-CD2 3.19Å; G317-F321 PolarHBondContact O-N 2.93Å; K319-F321 PolarHBondContact O-N 3.48Å; F321-W323 PolarHBondContact O-N 3.37Å; F321-L324 PolarHBondContact O-N 2.82Å; F321-A325 VanDerWaalsContact O-CB 3.31Å; F321-A325 WeakPolarHBondContact O-CB 3.25Å; F321-A325 PolarHBondContact O-N 3.12Å
322S98.2Very high95.3Very high8 Ų849.6 Ų49.66%0.05629%0.29CS..Hα-helixtrans-60.8-41.6173.2-83.20000112.5F268 V318 K319 V320 A325 T326F268-S322 VanDerWaalsContact O-CB 3.27Å; F268-S322 WeakPolarHBondContact O-CB 3.24Å; F268-S322 PolarHBondContact O-OG 2.59Å; V318-S322 WeakPolarHBondContact O-CB 3.39Å; V318-S322 PolarHBondContact O-N 3.16Å; V318-S322 PolarHBondContact O-OG 3.48Å; K319-S322 PolarHBondContact O-N 3.22Å; V320-S322 PolarHBondContact O-N 2.77Å; S322-A325 PolarHBondContact O-N 3.43Å; S322-T326 WeakPolarHBondContact O-CB 3.03Å; S322-T326 PolarHBondContact O-N 3.29Å; S322-T326 PolarHBondContact O-OG1 3.49Å
323W98.1Very high94.5Very high1 Ų154.6 Ų54.60%0.00431%0.312CS..Hα-helixtrans-63.8-45.9174.6-66.6-45.8000111.7F251 I254 S255 M273 K319 V320 F321 A325 T326 L327 F344 I345F251-W323 HydrophobicContact CB-CH2 4.07Å; F251-W323 HydrophobicContact CB-CZ2 3.87Å; F251-W323 AromaticContact CD1-CH2 3.41Å; F251-W323 HydrophobicContact CD1-CH2 3.41Å; F251-W323 VanDerWaalsContact CD1-CH2 3.41Å; F251-W323 HydrophobicContact CD1-CZ2 4.08Å; F251-W323 HydrophobicContact CD1-CZ3 4.4Å; F251-W323 AromaticContact CE1-CH2 3.99Å; F251-W323 HydrophobicContact CE1-CH2 3.99Å; F251-W323 AromaticContact CG-CH2 3.94Å; F251-W323 HydrophobicContact CG-CH2 3.94Å; F251-W323 HydrophobicContact CG-CZ2 4.27Å; I254-W323 HydrophobicContact CG2-CD2 4.09Å; I254-W323 HydrophobicContact CG2-CG 4.39Å; I254-W323 HydrophobicContact CG2-CZ2 4.36Å; S255-W323 PolarHBondContact OG-NE1 3.32Å; M273-W323 HydrophobicContact CE-CZ2 4.3Å; M273-W323 VanDerWaalsContact CE-NE1 3.33Å; K319-W323 HydrophobicContact CB-CH2 3.9Å; K319-W323 HydrophobicContact CB-CZ2 4.2Å; K319-W323 HydrophobicContact CB-CZ3 4.18Å; K319-W323 VanDerWaalsContact O-CD2 3.28Å; K319-W323 PolarHBondContact O-N 2.97Å; V320-W323 HydrophobicContact CG2-CE3 4.29Å; V320-W323 HydrophobicContact CG2-CZ3 3.99Å; V320-W323 PolarHBondContact O-N 3.42Å; F321-W323 PolarHBondContact O-N 3.37Å; W323-A325 VanDerWaalsContact C-N 3.34Å; W323-A325 PolarHBondContact O-N 3.42Å; W323-T326 WeakPolarHBondContact O-CB 3.37Å; W323-T326 PolarHBondContact O-N 3.1Å; W323-T326 VanDerWaalsContact O-N 3.12Å; W323-L327 WeakPolarHBondContact O-CG 3.07Å; W323-L327 PolarHBondContact O-N 2.68Å; W323-F344 HydrophobicContact CH2-CE1 4.03Å; W323-F344 AromaticContact CZ3-CE1 3.92Å; W323-F344 HydrophobicContact CZ3-CE1 3.92Å; W323-I345 HydrophobicContact CB-CD1 3.71Å; W323-I345 HydrophobicContact CB-CG1 4.39Å; W323-I345 HydrophobicContact CD2-CG1 4.44Å; W323-I345 HydrophobicContact CE3-CG1 3.96Å; W323-I345 HydrophobicContact CG-CD1 4.28Å
324L97.4Very high94.2Very high81 Ų8159.7 Ų59.742%0.42432%0.323SS..Hα-helixtrans-61.3-41.8177.6-66175.8000112V320 F321 T326 L327 H328 I345V320-L324 HydrophobicContact CG1-CD1 4.34Å; V320-L324 WeakPolarHBondContact O-CG 3.25Å; V320-L324 PolarHBondContact O-N 3.28Å; V320-L324 VanDerWaalsContact O-N 3.1Å; F321-L324 PolarHBondContact O-N 2.82Å; L324-T326 VanDerWaalsContact C-N 3.32Å; L324-T326 PolarHBondContact O-N 3.1Å; L324-L327 PolarHBondContact O-N 3.32Å; L324-H328 WeakPolarHBondContact O-CB 3.46Å; L324-H328 PolarHBondContact O-N 3.46Å; L324-I345 HydrophobicContact CD2-CG2 4.21Å
325A97.3Very high93.9Very high33 Ų3355 Ų5527%0.27330%0.3SS..Hα-helixtrans-66.5-33.1174.800000112.5K264 F268 F321 S322 W323 H328K264-A325 PolarHBondContact NZ-O 3.33Å; F268-A325 HydrophobicContact CB-CB 3.84Å; F268-A325 HydrophobicContact CD1-CB 3.53Å; F268-A325 HydrophobicContact CD2-CB 4.25Å; F268-A325 HydrophobicContact CE1-CB 4.14Å; F268-A325 HydrophobicContact CG-CB 3.59Å; F321-A325 VanDerWaalsContact O-CB 3.31Å; F321-A325 WeakPolarHBondContact O-CB 3.25Å; F321-A325 PolarHBondContact O-N 3.12Å; S322-A325 PolarHBondContact O-N 3.43Å; W323-A325 VanDerWaalsContact C-N 3.34Å; W323-A325 PolarHBondContact O-N 3.42Å; A325-H328 PolarHBondContact O-N 2.84Å
326T95.9Very high93.9Very high0 Ų054.4 Ų54.40%030%0.296CS..Hα-helixtrans-66.9-39.4173.7-54.20000111.1V258 K264 P267 F268 S322 W323 L324V258-T326 HydrophobicContact CG1-CG2 3.72Å; K264-T326 HydrophobicContact CD-CG2 4.02Å; K264-T326 VanDerWaalsContact CD-O 3.3Å; K264-T326 WeakPolarHBondContact CD-O 3.5Å; K264-T326 WeakPolarHBondContact CE-O 3.48Å; K264-T326 PolarHBondContact NZ-O 2.95Å; P267-T326 WeakPolarHBondContact CA-OG1 3.24Å; P267-T326 HydrophobicContact CB-CG2 4.42Å; F268-T326 PolarHBondContact N-OG1 3.49Å; S322-T326 WeakPolarHBondContact O-CB 3.03Å; S322-T326 PolarHBondContact O-N 3.29Å; S322-T326 PolarHBondContact O-OG1 3.49Å; W323-T326 WeakPolarHBondContact O-CB 3.37Å; W323-T326 PolarHBondContact O-N 3.1Å; W323-T326 VanDerWaalsContact O-N 3.12Å; L324-T326 VanDerWaalsContact C-N 3.32Å; L324-T326 PolarHBondContact O-N 3.1Å
327L94.9Very high93.8Very high23 Ų2353.2 Ų53.212%0.1229%0.289CS..Hα-helixtrans-71.7-31.9175.5-64163000112.2V258 W323 L324 G329 S330 M332 L342 I345V258-L327 HydrophobicContact CB-CD2 4.47Å; V258-L327 HydrophobicContact CG1-CD1 4.47Å; V258-L327 HydrophobicContact CG1-CD2 3.78Å; V258-L327 HydrophobicContact CG1-CG 3.75Å; V258-L327 HydrophobicContact CG2-CD2 4.35Å; W323-L327 WeakPolarHBondContact O-CG 3.07Å; W323-L327 PolarHBondContact O-N 2.68Å; L324-L327 PolarHBondContact O-N 3.32Å; L327-G329 PolarHBondContact O-N 2.85Å; L327-S330 WeakPolarHBondContact O-CB 3.42Å; L327-S330 PolarHBondContact O-N 2.88Å; L327-S330 PolarHBondContact O-OG 2.76Å; L327-M332 HydrophobicContact CB-SD 4.32Å; L327-M332 HydrophobicContact CD2-SD 3.41Å; L327-M332 WeakPolarHBondContact CD2-SD 3.48Å; L327-M332 HydrophobicContact CG-SD 4.41Å; L327-L342 HydrophobicContact CD1-CD2 3.67Å; L327-I345 HydrophobicContact CD1-CD1 4.17Å
328H94.6Very high93.8Very high153 Ų15352.5 Ų52.571%0.70828%0.28SS*.THydrogen-bonded Turntrans-60.1133.9-177.6-170.375.1000112.6K264 L324 A325 S330K264-H328 PolarHBondContact NZ-O 3.29Å; L324-H328 WeakPolarHBondContact O-CB 3.46Å; L324-H328 PolarHBondContact O-N 3.46Å; A325-H328 PolarHBondContact O-N 2.84Å; H328-S330 PolarHBondContact O-N 3.11Å
329G89.5Confident93.8Very high77 Ų7751.5 Ų51.579%0.79427%0.273SS*.THydrogen-bonded Turntrans70.48.8179.500000115.1L327L327-G329 PolarHBondContact O-N 2.85Å
330S88.9Confident93.8Very high28 Ų2851.5 Ų51.520%0.19627%0.273CS..  trans-90.3148.9176.870.50000112.2L327 H328 M332L327-S330 WeakPolarHBondContact O-CB 3.42Å; L327-S330 PolarHBondContact O-N 2.88Å; L327-S330 PolarHBondContact O-OG 2.76Å; H328-S330 PolarHBondContact O-N 3.11Å; S330-M332 PolarHBondContact O-N 3.2Å; S330-M332 WeakPolarHBondContact OG-CG 3.38Å
331N84.9Confident93.8Very high161 Ų16150.7 Ų50.786%0.86127%0.268SS*.  trans-88.181.4169.7-173.112.8000109.2
332M83.1Confident93.7Very high38 Ų3846.1 Ų46.119%0.18725%0.25CS..  trans-70.3134-170.9-65.2-161.6-54.400113.3L327 S330 W334 V338L327-M332 HydrophobicContact CB-SD 4.32Å; L327-M332 HydrophobicContact CD2-SD 3.41Å; L327-M332 WeakPolarHBondContact CD2-SD 3.48Å; L327-M332 HydrophobicContact CG-SD 4.41Å; S330-M332 PolarHBondContact O-N 3.2Å; S330-M332 WeakPolarHBondContact OG-CG 3.38Å; M332-W334 HydrophobicContact CE-CE3 4.45Å; M332-W334 HydrophobicContact CE-CH2 3.36Å; M332-W334 HydrophobicContact CE-CZ2 3.52Å; M332-W334 HydrophobicContact CE-CZ3 3.87Å; M332-V338 HydrophobicContact SD-CG1 4.39Å
333K81Confident93.7Very high111 Ų11145.9 Ų45.948%0.48325%0.249SC..  trans-82.4116.1162.1-68.1-179.7-178.6172.10109.3S335 E486K333-S335 PolarHBondContact O-N 2.96Å; K333-E486 IonicContact NZ-OE1 2.96Å; K333-E486 PolarHBondContact NZ-OE1 2.87Å; K333-E486 IonicContact NZ-OE2 3.34Å; K333-E486 PolarHBondContact NZ-OE2 3.22Å
334W90.2Very high93.7Very high146 Ų14645.9 Ų45.955%0.55325%0.249SC*.  trans-7469178.4-64.9101.9000112.3M332 V338 L339 L342 K411M332-W334 HydrophobicContact CE-CE3 4.45Å; M332-W334 HydrophobicContact CE-CH2 3.36Å; M332-W334 HydrophobicContact CE-CZ2 3.52Å; M332-W334 HydrophobicContact CE-CZ3 3.87Å; W334-V338 HydrophobicContact CE3-CG1 4.45Å; W334-L339 HydrophobicContact CE3-CD2 4.18Å; W334-L342 HydrophobicContact CH2-CD1 4.2Å; W334-L342 HydrophobicContact CZ3-CD1 3.55Å; W334-K411 WeakPolarHBondContact O-CE 3.2Å; W334-K411 PolarHBondContact O-NZ 3.3Å
335S93.6Very high93.8Very high13 Ų1342.4 Ų42.49%0.09123%0.231CC..  trans-81.1162.3171.5740000111.1Y261 K333 A337 V338 L339Y261-S335 WeakPolarHBondContact CD1-OG 3.46Å; Y261-S335 WeakPolarHBondContact CE1-OG 3.36Å; K333-S335 PolarHBondContact O-N 2.96Å; S335-A337 VanDerWaalsContact C-N 3.26Å; S335-A337 PolarHBondContact O-N 3.48Å; S335-V338 PolarHBondContact O-N 3.45Å; S335-V338 PolarHBondContact OG-N 3.48Å; S335-L339 PolarHBondContact O-N 2.98Å
336A96.8Very high93.8Very high0 Ų046.6 Ų46.60%024%0.243CC..Hα-helixtrans-59.1-37.8174.400000112.3V338 L339 W340 I394 A410 K411A336-V338 VanDerWaalsContact C-N 3.3Å; A336-V338 PolarHBondContact O-N 3.08Å; A336-L339 WeakPolarHBondContact O-CB 3.42Å; A336-L339 PolarHBondContact O-N 3.46Å; A336-L339 VanDerWaalsContact O-N 3.09Å; A336-W340 PolarHBondContact O-N 2.71Å; A336-I394 HydrophobicContact CB-CD1 4.36Å; A336-I394 HydrophobicContact CB-CG2 4.18Å; A336-A410 HydrophobicContact CB-CB 3.47Å; A336-A410 VanDerWaalsContact CB-CB 3.47Å; A336-K411 HydrophobicContact CB-CG 4.2Å
337A96.4Very high93.9Very high0 Ų046.6 Ų46.60%024%0.243CC..Hα-helixtrans-60.3-37.8178.300000112.7I257 Y261 S335 W340 A341 I394 H395I257-A337 HydrophobicContact CG2-CB 4.07Å; Y261-A337 HydrophobicContact CD2-CB 4.44Å; Y261-A337 HydrophobicContact CE2-CB 3.6Å; S335-A337 VanDerWaalsContact C-N 3.26Å; S335-A337 PolarHBondContact O-N 3.48Å; A337-W340 PolarHBondContact O-N 3.03Å; A337-A341 PolarHBondContact O-N 3.21Å; A337-I394 HydrophobicContact CB-CG2 4.19Å; A337-H395 HydrophobicContact CB-CB 4.27Å
338V96.1Very high94.1Very high5 Ų546.2 Ų46.23%0.0324%0.241CC..Hα-helixtrans-65.7-39.5174.21750000111.4Y261 M332 W334 S335 A336 W340 A341 L342Y261-V338 HydrophobicContact CD1-CG2 3.94Å; Y261-V338 HydrophobicContact CD2-CG2 3.76Å; Y261-V338 HydrophobicContact CG-CG2 3.39Å; M332-V338 HydrophobicContact SD-CG1 4.39Å; W334-V338 HydrophobicContact CE3-CG1 4.45Å; S335-V338 PolarHBondContact O-N 3.45Å; S335-V338 PolarHBondContact OG-N 3.48Å; A336-V338 VanDerWaalsContact C-N 3.3Å; A336-V338 PolarHBondContact O-N 3.08Å; V338-W340 VanDerWaalsContact C-N 3.35Å; V338-W340 PolarHBondContact O-N 3.43Å; V338-A341 PolarHBondContact O-N 2.99Å; V338-L342 HydrophobicContact CG1-CD1 3.94Å; V338-L342 HydrophobicContact CG1-CG 4.25Å; V338-L342 WeakPolarHBondContact O-CG 3.5Å; V338-L342 PolarHBondContact O-N 2.99Å
339L97.9Very high94.2Very high38 Ų3841.3 Ų41.320%0.19922%0.222CC..Hα-helixtrans-61.7-43.5176-62.2-179000111.6W334 S335 A336 A341 L342 G343 K411 F414W334-L339 HydrophobicContact CE3-CD2 4.18Å; S335-L339 PolarHBondContact O-N 2.98Å; A336-L339 WeakPolarHBondContact O-CB 3.42Å; A336-L339 PolarHBondContact O-N 3.46Å; A336-L339 VanDerWaalsContact O-N 3.09Å; L339-A341 VanDerWaalsContact C-N 3.34Å; L339-A341 PolarHBondContact O-N 3.01Å; L339-L342 PolarHBondContact O-N 3.28Å; L339-G343 PolarHBondContact O-N 2.9Å; L339-K411 HydrophobicContact CD1-CB 4.35Å; L339-K411 HydrophobicContact CD1-CG 3.88Å; L339-F414 VanDerWaalsContact C-CE2 3.5Å; L339-F414 HydrophobicContact CB-CD1 3.67Å; L339-F414 HydrophobicContact CB-CD2 4.11Å; L339-F414 HydrophobicContact CB-CE1 3.77Å; L339-F414 HydrophobicContact CB-CE2 4.19Å; L339-F414 HydrophobicContact CB-CG 3.84Å; L339-F414 HydrophobicContact CB-CZ 4.03Å; L339-F414 HydrophobicContact CD1-CD1 3.86Å; L339-F414 HydrophobicContact CD1-CE1 4.35Å; L339-F414 HydrophobicContact CD1-CG 4.46Å; L339-F414 HydrophobicContact CG-CD1 4.35Å; L339-F414 HydrophobicContact CG-CE1 4.49Å; L339-F414 WeakPolarHBondContact O-CE2 3.29Å; L339-F414 WeakPolarHBondContact O-CZ 3.38Å
340W98.4Very high94.6Very high0 Ų039.3 Ų39.30%019%0.194CC..Hα-helixtrans-60.9-41.4173.3-74.1102.3000112.4A336 A337 V338 G343 F344 F387 M390 I394 H413 F414 M417A336-W340 PolarHBondContact O-N 2.71Å; A337-W340 PolarHBondContact O-N 3.03Å; V338-W340 VanDerWaalsContact C-N 3.35Å; V338-W340 PolarHBondContact O-N 3.43Å; W340-G343 PolarHBondContact O-N 3.4Å; W340-F344 VanDerWaalsContact O-CB 3.32Å; W340-F344 WeakPolarHBondContact O-CB 3.48Å; W340-F344 PolarHBondContact O-N 3.06Å; W340-F387 HydrophobicContact CE3-CB 4.11Å; W340-F387 AromaticContact CE3-CD1 3.6Å; W340-F387 HydrophobicContact CE3-CD1 3.6Å; W340-F387 HydrophobicContact CE3-CD2 4.2Å; W340-F387 AromaticContact CE3-CE1 3.98Å; W340-F387 HydrophobicContact CE3-CE1 3.98Å; W340-F387 AromaticContact CE3-CG 3.72Å; W340-F387 HydrophobicContact CE3-CG 3.72Å; W340-F387 HydrophobicContact CE3-CZ 4.43Å; W340-F387 HydrophobicContact CZ3-CB 4.48Å; W340-F387 AromaticContact CZ3-CD1 3.87Å; W340-F387 HydrophobicContact CZ3-CD1 3.87Å; W340-F387 AromaticContact CZ3-CD2 3.77Å; W340-F387 HydrophobicContact CZ3-CD2 3.77Å; W340-F387 AromaticContact CZ3-CE1 3.92Å; W340-F387 HydrophobicContact CZ3-CE1 3.92Å; W340-F387 AromaticContact CZ3-CE2 3.83Å; W340-F387 HydrophobicContact CZ3-CE2 3.83Å; W340-F387 AromaticContact CZ3-CG 3.79Å; W340-F387 HydrophobicContact CZ3-CG 3.79Å; W340-F387 AromaticContact CZ3-CZ 3.91Å; W340-F387 HydrophobicContact CZ3-CZ 3.91Å; W340-M390 HydrophobicContact CD2-CB 3.68Å; W340-M390 HydrophobicContact CE3-CB 3.63Å; W340-M390 HydrophobicContact CE3-CG 4.35Å; W340-M390 HydrophobicContact CG-CB 4.37Å; W340-M390 HydrophobicContact CH2-CB 3.88Å; W340-M390 HydrophobicContact CH2-CG 3.91Å; W340-M390 HydrophobicContact CZ2-CB 3.96Å; W340-M390 HydrophobicContact CZ2-CG 4.32Å; W340-M390 HydrophobicContact CZ3-CB 3.72Å; W340-M390 HydrophobicContact CZ3-CG 3.94Å; W340-I394 HydrophobicContact CG-CD1 4.49Å; W340-H413 AromaticContact CH2-CE1 3.91Å; W340-H413 AromaticContact CZ2-CE1 3.47Å; W340-H413 VanDerWaalsContact CZ2-CE1 3.47Å; W340-H413 WeakPolarHBondContact CZ2-CE1 3.22Å; W340-H413 AromaticContact CZ2-ND1 3.44Å; W340-H413 WeakPolarHBondContact CZ2-ND1 3.48Å; W340-F414 AromaticContact CD2-CD2 3.67Å; W340-F414 HydrophobicContact CD2-CD2 3.67Å; W340-F414 HydrophobicContact CD2-CE2 4.49Å; W340-F414 AromaticContact CE2-CD2 3.82Å; W340-F414 AromaticContact CE3-CD2 3.98Å; W340-F414 HydrophobicContact CE3-CD2 3.98Å; W340-F414 AromaticContact CG-CD2 3.98Å; W340-F414 HydrophobicContact CG-CD2 3.98Å; W340-F414 VanDerWaalsContact CZ2-CA 3.5Å; W340-F414 HydrophobicContact CZ2-CB 3.99Å; W340-F414 HydrophobicContact CZ2-CD2 4.25Å; W340-F414 HydrophobicContact CZ3-CD2 4.42Å; W340-M417 HydrophobicContact CH2-CB 3.69Å; W340-M417 HydrophobicContact CH2-CG 3.73Å; W340-M417 HydrophobicContact CZ2-CB 4.47Å; W340-M417 HydrophobicContact CZ3-CB 4.45Å; W340-M417 HydrophobicContact CZ3-CG 4.15Å
341A97.8Very high95Very high1 Ų138 Ų381%0.00819%0.185CC..Hα-helixtrans-66.1-40.6177.200000113I254 I257 V258 A337 V338 L339 F344 I345I254-A341 HydrophobicContact CD1-CB 4.06Å; I254-A341 HydrophobicContact CG2-CB 4.47Å; I257-A341 HydrophobicContact CG2-CB 3.95Å; V258-A341 HydrophobicContact CG2-CB 4.12Å; A337-A341 PolarHBondContact O-N 3.21Å; V338-A341 PolarHBondContact O-N 2.99Å; L339-A341 VanDerWaalsContact C-N 3.34Å; L339-A341 PolarHBondContact O-N 3.01Å; A341-F344 WeakPolarHBondContact O-CB 3.5Å; A341-F344 PolarHBondContact O-N 2.91Å; A341-I345 VanDerWaalsContact O-CG1 3.25Å; A341-I345 WeakPolarHBondContact O-CG1 3.36Å; A341-I345 PolarHBondContact O-N 3.01Å
342L97.8Very high95.6Very high51 Ų5131.5 Ų31.527%0.26716%0.156SC..Hα-helixtrans-68.7-41.7175.1-69.5173.5000111.9L327 W334 V338 L339 F344 I345 F346L327-L342 HydrophobicContact CD1-CD2 3.67Å; W334-L342 HydrophobicContact CH2-CD1 4.2Å; W334-L342 HydrophobicContact CZ3-CD1 3.55Å; V338-L342 HydrophobicContact CG1-CD1 3.94Å; V338-L342 HydrophobicContact CG1-CG 4.25Å; V338-L342 WeakPolarHBondContact O-CG 3.5Å; V338-L342 PolarHBondContact O-N 2.99Å; L339-L342 PolarHBondContact O-N 3.28Å; L342-F344 VanDerWaalsContact C-N 3.31Å; L342-F344 PolarHBondContact O-N 2.67Å; L342-I345 PolarHBondContact O-N 3.15Å; L342-F346 WeakPolarHBondContact O-CB 2.98Å; L342-F346 PolarHBondContact O-N 3.09Å
343G98Very high96.3Very high4 Ų434.8 Ų34.84%0.04117%0.174CC..Hα-helixtrans-59.2-43.7173.500000111.7L339 W340 L347L339-G343 PolarHBondContact O-N 2.9Å; W340-G343 PolarHBondContact O-N 3.4Å; G343-L347 WeakPolarHBondContact O-CB 3.48Å; G343-L347 VanDerWaalsContact O-CG 3.26Å; G343-L347 WeakPolarHBondContact O-CG 3.33Å; G343-L347 PolarHBondContact O-N 3Å
344F98.4Very high97.1Very high0 Ų030.3 Ų30.30%016%0.156CC..Hα-helixtrans-56.5-56.8171.5172.2-86.1000111.1I247 F251 I254 W323 W340 A341 L342 F346 L347 F348 G384 F387 A388I247-F344 HydrophobicContact CD1-CE2 3.93Å; I247-F344 HydrophobicContact CD1-CZ 4.25Å; F251-F344 HydrophobicContact CD1-CE1 4.14Å; F251-F344 AromaticContact CD1-CZ 3.62Å; F251-F344 HydrophobicContact CD1-CZ 3.62Å; F251-F344 HydrophobicContact CE1-CE1 4.38Å; F251-F344 AromaticContact CE1-CZ 3.77Å; F251-F344 HydrophobicContact CE1-CZ 3.77Å; I254-F344 HydrophobicContact CB-CD1 4.23Å; I254-F344 HydrophobicContact CB-CE1 4.32Å; I254-F344 HydrophobicContact CD1-CB 3.94Å; I254-F344 HydrophobicContact CD1-CD1 4.12Å; I254-F344 HydrophobicContact CD1-CD2 4.35Å; I254-F344 HydrophobicContact CD1-CG 3.88Å; I254-F344 HydrophobicContact CG1-CB 4.32Å; I254-F344 HydrophobicContact CG1-CD1 3.56Å; I254-F344 HydrophobicContact CG1-CD2 4.05Å; I254-F344 HydrophobicContact CG1-CE1 3.83Å; I254-F344 HydrophobicContact CG1-CE2 4.27Å; I254-F344 HydrophobicContact CG1-CG 3.7Å; I254-F344 HydrophobicContact CG1-CZ 4.19Å; I254-F344 HydrophobicContact CG2-CD1 3.93Å; I254-F344 HydrophobicContact CG2-CE1 4.24Å; W323-F344 HydrophobicContact CH2-CE1 4.03Å; W323-F344 AromaticContact CZ3-CE1 3.92Å; W323-F344 HydrophobicContact CZ3-CE1 3.92Å; W340-F344 VanDerWaalsContact O-CB 3.32Å; W340-F344 WeakPolarHBondContact O-CB 3.48Å; W340-F344 PolarHBondContact O-N 3.06Å; A341-F344 WeakPolarHBondContact O-CB 3.5Å; A341-F344 PolarHBondContact O-N 2.91Å; L342-F344 VanDerWaalsContact C-N 3.31Å; L342-F344 PolarHBondContact O-N 2.67Å; F344-F346 VanDerWaalsContact C-N 3.28Å; F344-F346 PolarHBondContact O-N 3.13Å; F344-L347 PolarHBondContact O-N 2.72Å; F344-F348 HydrophobicContact CE1-CB 4.32Å; F344-F348 HydrophobicContact CE1-CG 4.39Å; F344-F348 HydrophobicContact CZ-CB 4.29Å; F344-F348 HydrophobicContact CZ-CD2 4.32Å; F344-F348 HydrophobicContact CZ-CG 4.1Å; F344-F348 WeakPolarHBondContact O-CA 3.49Å; F344-F348 WeakPolarHBondContact O-CB 3.24Å; F344-F348 PolarHBondContact O-N 2.88Å; F344-G384 WeakPolarHBondContact CD2-O 3.31Å; F344-G384 VanDerWaalsContact CE2-CA 3.45Å; F344-G384 VanDerWaalsContact CE2-O 3.26Å; F344-G384 WeakPolarHBondContact CE2-O 3.49Å; F344-F387 HydrophobicContact CB-CB 4.22Å; F344-F387 HydrophobicContact CD2-CB 4.45Å; F344-A388 HydrophobicContact CD2-CB 4.13Å; F344-A388 HydrophobicContact CE2-CB 4.18Å
345I98.4Very high97.4Very high8 Ų824 Ų244%0.04114%0.137CC..Hα-helixtrans-57.1-45.1-174.7-69.5165.3000110.6I254 V258 V320 W323 L324 L327 A341 L342 T349I254-I345 HydrophobicContact CG2-CG1 4.33Å; V258-I345 HydrophobicContact CG2-CD1 4.28Å; V320-I345 HydrophobicContact CG1-CG2 4.23Å; W323-I345 HydrophobicContact CB-CD1 3.71Å; W323-I345 HydrophobicContact CB-CG1 4.39Å; W323-I345 HydrophobicContact CD2-CG1 4.44Å; W323-I345 HydrophobicContact CE3-CG1 3.96Å; W323-I345 HydrophobicContact CG-CD1 4.28Å; L324-I345 HydrophobicContact CD2-CG2 4.21Å; L327-I345 HydrophobicContact CD1-CD1 4.17Å; A341-I345 VanDerWaalsContact O-CG1 3.25Å; A341-I345 WeakPolarHBondContact O-CG1 3.36Å; A341-I345 PolarHBondContact O-N 3.01Å; L342-I345 PolarHBondContact O-N 3.15Å; I345-T349 WeakPolarHBondContact O-CB 3.19Å; I345-T349 PolarHBondContact O-N 3Å; I345-T349 PolarHBondContact O-OG1 3.3Å
346F98.2Very high97.6Very high121 Ų12126.5 Ų26.553%0.53115%0.148SC..Hα-helixtrans-65-58.5179.6175.5-112.9000112.3L342 F344 F348 T349 V350 F418L342-F346 WeakPolarHBondContact O-CB 2.98Å; L342-F346 PolarHBondContact O-N 3.09Å; F344-F346 VanDerWaalsContact C-N 3.28Å; F344-F346 PolarHBondContact O-N 3.13Å; F346-F348 PolarHBondContact O-N 2.68Å; F346-T349 WeakPolarHBondContact O-CB 3.27Å; F346-T349 PolarHBondContact O-N 3.17Å; F346-T349 VanDerWaalsContact O-N 3.14Å; F346-V350 HydrophobicContact CE2-CG2 4.23Å; F346-V350 HydrophobicContact CZ-CG2 4.15Å; F346-V350 PolarHBondContact O-N 3.18Å; F346-F418 HydrophobicContact CD1-CE2 4.42Å; F346-F418 HydrophobicContact CD1-CZ 4.19Å; F346-F418 HydrophobicContact CE1-CZ 4.37Å
347L97.8Very high97.7Very high0 Ų028.9 Ų28.90%016%0.163CC..Hα-helixtrans-70.7-35.1-172.9-61.5171000111.8G343 F344 T349 V350 G351 Y379 M383 F387 F418 N422G343-L347 WeakPolarHBondContact O-CB 3.48Å; G343-L347 VanDerWaalsContact O-CG 3.26Å; G343-L347 WeakPolarHBondContact O-CG 3.33Å; G343-L347 PolarHBondContact O-N 3Å; F344-L347 PolarHBondContact O-N 2.72Å; L347-T349 VanDerWaalsContact C-N 3.26Å; L347-T349 PolarHBondContact O-N 2.85Å; L347-V350 PolarHBondContact O-N 3.06Å; L347-G351 PolarHBondContact O-N 2.78Å; L347-Y379 HydrophobicContact CB-CD1 4.27Å; L347-Y379 HydrophobicContact CB-CE1 4.43Å; L347-Y379 HydrophobicContact CD2-CD1 4.47Å; L347-Y379 HydrophobicContact CD2-CE1 3.8Å; L347-Y379 WeakPolarHBondContact O-CD1 3.47Å; L347-M383 HydrophobicContact CB-CB 3.59Å; L347-M383 HydrophobicContact CB-CG 4.15Å; L347-M383 HydrophobicContact CB-SD 3.85Å; L347-M383 HydrophobicContact CD1-CB 3.92Å; L347-M383 HydrophobicContact CD1-CG 3.74Å; L347-M383 HydrophobicContact CD1-SD 3.64Å; L347-M383 HydrophobicContact CD2-SD 3.98Å; L347-M383 HydrophobicContact CG-CB 4.37Å; L347-M383 HydrophobicContact CG-CG 4.49Å; L347-M383 HydrophobicContact CG-SD 4.01Å; L347-F387 HydrophobicContact CD1-CD1 4.45Å; L347-F387 HydrophobicContact CD1-CE1 3.75Å; L347-F387 HydrophobicContact CD1-CZ 3.9Å; L347-F418 HydrophobicContact CD1-CD2 3.8Å; L347-F418 HydrophobicContact CD1-CE2 3.57Å; L347-F418 HydrophobicContact CD1-CZ 4.46Å; L347-F418 HydrophobicContact CD2-CE2 4.17Å; L347-F418 HydrophobicContact CD2-CZ 4.34Å; L347-F418 HydrophobicContact CG-CE2 3.94Å; L347-N422 WeakPolarHBondContact CD2-ND2 3.21Å; L347-N422 VanDerWaalsContact CD2-OD1 3.24Å; L347-N422 WeakPolarHBondContact CD2-OD1 3.32Å
348F97.8Very high97.7Very high16 Ų1629.8 Ų29.87%0.0717%0.167CC..Hα-helixtrans-62.1-36172.7-176.1-99.6000111.6I247 F251 T316 F344 F346 G351 G352 V380I247-F348 HydrophobicContact CD1-CD2 4.16Å; I247-F348 HydrophobicContact CD1-CE2 3.95Å; I247-F348 HydrophobicContact CG1-CD2 4.39Å; I247-F348 HydrophobicContact CG1-CE2 3.7Å; I247-F348 HydrophobicContact CG1-CZ 4.23Å; F251-F348 HydrophobicContact CE1-CD1 4.19Å; F251-F348 AromaticContact CE1-CE1 3.62Å; F251-F348 HydrophobicContact CE1-CE1 3.62Å; F251-F348 HydrophobicContact CE1-CE2 4.08Å; F251-F348 AromaticContact CE1-CZ 3.58Å; F251-F348 HydrophobicContact CE1-CZ 3.58Å; F251-F348 AromaticContact CZ-CE1 3.77Å; F251-F348 HydrophobicContact CZ-CE1 3.77Å; F251-F348 HydrophobicContact CZ-CE2 4.21Å; F251-F348 AromaticContact CZ-CZ 3.47Å; F251-F348 HydrophobicContact CZ-CZ 3.47Å; F251-F348 VanDerWaalsContact CZ-CZ 3.47Å; T316-F348 HydrophobicContact CG2-CE1 3.61Å; T316-F348 HydrophobicContact CG2-CZ 4.17Å; F344-F348 HydrophobicContact CE1-CB 4.32Å; F344-F348 HydrophobicContact CE1-CG 4.39Å; F344-F348 HydrophobicContact CZ-CB 4.29Å; F344-F348 HydrophobicContact CZ-CD2 4.32Å; F344-F348 HydrophobicContact CZ-CG 4.1Å; F344-F348 WeakPolarHBondContact O-CA 3.49Å; F344-F348 WeakPolarHBondContact O-CB 3.24Å; F344-F348 PolarHBondContact O-N 2.88Å; F346-F348 PolarHBondContact O-N 2.68Å; F348-G351 PolarHBondContact O-N 2.9Å; F348-G352 PolarHBondContact O-N 3.14Å; F348-V380 HydrophobicContact CD2-CB 4.38Å; F348-V380 HydrophobicContact CD2-CG1 4.37Å; F348-V380 HydrophobicContact CE2-CB 4.12Å; F348-V380 HydrophobicContact CE2-CG1 4.15Å
349T97.9Very high97.8Very high49 Ų4929.8 Ų29.830%0.30117%0.168SC..Hα-helixtrans-69.7-41.3175.6-60.30000111.3I345 F346 L347 G351 G352 L353I345-T349 WeakPolarHBondContact O-CB 3.19Å; I345-T349 PolarHBondContact O-N 3Å; I345-T349 PolarHBondContact O-OG1 3.3Å; F346-T349 WeakPolarHBondContact O-CB 3.27Å; F346-T349 PolarHBondContact O-N 3.17Å; F346-T349 VanDerWaalsContact O-N 3.14Å; L347-T349 VanDerWaalsContact C-N 3.26Å; L347-T349 PolarHBondContact O-N 2.85Å; T349-G351 VanDerWaalsContact C-N 3.33Å; T349-G351 PolarHBondContact O-N 3.24Å; T349-G352 PolarHBondContact O-N 3Å; T349-L353 HydrophobicContact CG2-CD1 4.46Å; T349-L353 WeakPolarHBondContact O-CG 3.31Å; T349-L353 PolarHBondContact O-N 3.15Å
350V97.8Very high97.8Very high35 Ų3530.2 Ų30.221%0.21217%0.17CC..Hα-helixtrans-59-45.5172.5175.20000111F346 L347 L353 T354 Y379F346-V350 HydrophobicContact CE2-CG2 4.23Å; F346-V350 HydrophobicContact CZ-CG2 4.15Å; F346-V350 PolarHBondContact O-N 3.18Å; L347-V350 PolarHBondContact O-N 3.06Å; V350-L353 PolarHBondContact O-N 3.48Å; V350-T354 WeakPolarHBondContact O-CG2 3.31Å; V350-T354 PolarHBondContact O-N 3.44Å; V350-T354 VanDerWaalsContact O-N 3.17Å; V350-T354 PolarHBondContact O-OG1 3.28Å; V350-Y379 HydrophobicContact CB-CD1 4.15Å; V350-Y379 HydrophobicContact CB-CE1 4.24Å; V350-Y379 HydrophobicContact CG1-CD1 4.01Å; V350-Y379 HydrophobicContact CG1-CE1 3.88Å
351G97.3Very high97.8Very high0 Ų030.8 Ų30.80%017%0.174CC..Hα-helixtrans-60.1-43.4172.800000112.9L347 F348 T349 L353 T354 G355 H376L347-G351 PolarHBondContact O-N 2.78Å; F348-G351 PolarHBondContact O-N 2.9Å; T349-G351 VanDerWaalsContact C-N 3.33Å; T349-G351 PolarHBondContact O-N 3.24Å; G351-L353 PolarHBondContact O-N 2.94Å; G351-T354 PolarHBondContact O-N 3.49Å; G351-T354 PolarHBondContact O-OG1 3.28Å; G351-G355 PolarHBondContact O-N 3.46Å; G351-H376 PolarHBondContact O-CE1 3.13Å; G351-H376 PolarHBondContact O-ND1 2.89Å
352G96.8Very high97.7Very high26 Ų2634.7 Ų34.727%0.26820%0.202SC..Hα-helixtrans-61.3-42.5176.900000112.8F348 T349 G355 I356F348-G352 PolarHBondContact O-N 3.14Å; T349-G352 PolarHBondContact O-N 3Å; G352-G355 WeakPolarHBondContact O-CA 3.3Å; G352-G355 PolarHBondContact O-N 2.93Å; G352-G355 VanDerWaalsContact O-N 3.13Å; G352-I356 WeakPolarHBondContact O-CG1 3.42Å; G352-I356 PolarHBondContact O-N 3.09Å
353L97.5Very high97.7Very high107 Ų10736 Ų3656%0.5621%0.209SC*.Hα-helixtrans-63.9-41.7177.8-69.1175000112.1T349 V350 G351 G355 I356 V357T349-L353 HydrophobicContact CG2-CD1 4.46Å; T349-L353 WeakPolarHBondContact O-CG 3.31Å; T349-L353 PolarHBondContact O-N 3.15Å; V350-L353 PolarHBondContact O-N 3.48Å; G351-L353 PolarHBondContact O-N 2.94Å; L353-G355 VanDerWaalsContact C-N 3.25Å; L353-G355 PolarHBondContact O-N 3.08Å; L353-I356 HydrophobicContact CD2-CD1 4.36Å; L353-I356 PolarHBondContact O-N 3.38Å; L353-V357 PolarHBondContact O-N 3.32Å
354T98Very high97.6Very high16 Ų1636.2 Ų36.210%0.09821%0.209CC..Hα-helixtrans-67.5-29.6174.457.90000111.7V350 G351 V357 L358 H376V350-T354 WeakPolarHBondContact O-CG2 3.31Å; V350-T354 PolarHBondContact O-N 3.44Å; V350-T354 VanDerWaalsContact O-N 3.17Å; V350-T354 PolarHBondContact O-OG1 3.28Å; G351-T354 PolarHBondContact O-N 3.49Å; G351-T354 PolarHBondContact O-OG1 3.28Å; T354-V357 WeakPolarHBondContact O-CB 3.39Å; T354-V357 PolarHBondContact O-N 3.45Å; T354-L358 PolarHBondContact O-N 2.96Å; T354-H376 PolarHBondContact OG1-ND1 3.48Å
355G97.3Very high97.5Very high15 Ų1540.7 Ų40.716%0.15523%0.232CC..Hα-helixtrans-66.9-3617200000113.6G351 G352 L353 V357 L358 A359 H376G351-G355 PolarHBondContact O-N 3.46Å; G352-G355 WeakPolarHBondContact O-CA 3.3Å; G352-G355 PolarHBondContact O-N 2.93Å; G352-G355 VanDerWaalsContact O-N 3.13Å; L353-G355 VanDerWaalsContact C-N 3.25Å; L353-G355 PolarHBondContact O-N 3.08Å; G355-V357 VanDerWaalsContact C-N 3.26Å; G355-V357 PolarHBondContact O-N 3.37Å; G355-L358 CarbonylContact O-C 3.38Å; G355-L358 PolarHBondContact O-N 3.04Å; G355-A359 WeakPolarHBondContact O-CB 3.41Å; G355-A359 PolarHBondContact O-N 3.36Å; G355-H376 WeakPolarHBondContact CA-CE1 3.44Å; G355-H376 WeakPolarHBondContact CA-ND1 3.37Å; G355-H376 PolarHBondContact N-CE1 3.14Å; G355-H376 PolarHBondContact N-ND1 3.49Å; G355-H376 VanDerWaalsContact N-ND1 3.13Å
356I97.2Very high97.4Very high65 Ų6545.2 Ų45.233%0.33326%0.259SS..Hα-helixtrans-64-34.8173.8-65.7168.5000110.8A313 G352 L353 A359A313-I356 HydrophobicContact CB-CD1 3.81Å; A313-I356 HydrophobicContact CB-CG1 4.13Å; G352-I356 WeakPolarHBondContact O-CG1 3.42Å; G352-I356 PolarHBondContact O-N 3.09Å; L353-I356 HydrophobicContact CD2-CD1 4.36Å; L353-I356 PolarHBondContact O-N 3.38Å; I356-A359 PolarHBondContact O-N 3.14Å
357V98.1Very high97.4Very high50 Ų5040 Ų4030%0.30324%0.237SC..Hα-helixtrans-62.9-47.6172.7179.60000110.4L353 T354 G355 A359 N360 L363 L367 Y372L353-V357 PolarHBondContact O-N 3.32Å; T354-V357 WeakPolarHBondContact O-CB 3.39Å; T354-V357 PolarHBondContact O-N 3.45Å; G355-V357 VanDerWaalsContact C-N 3.26Å; G355-V357 PolarHBondContact O-N 3.37Å; V357-A359 VanDerWaalsContact C-N 3.3Å; V357-A359 PolarHBondContact O-N 2.92Å; V357-N360 WeakPolarHBondContact O-CB 3.42Å; V357-N360 PolarHBondContact O-N 3.41Å; V357-L363 HydrophobicContact CG1-CD1 3.83Å; V357-L367 HydrophobicContact CG1-CD1 3.84Å; V357-Y372 HydrophobicContact CB-CE1 4.43Å; V357-Y372 HydrophobicContact CG1-CE1 4.37Å
358L98.3Very high97.4Very high18 Ų1841.8 Ų41.89%0.09425%0.245CC..Hα-helixtrans-69.1-25.2178.4-69.7173.9000113.7T354 G355 N360 L367 Y372 V373 H376T354-L358 PolarHBondContact O-N 2.96Å; G355-L358 CarbonylContact O-C 3.38Å; G355-L358 PolarHBondContact O-N 3.04Å; L358-N360 PolarHBondContact O-N 3.04Å; L358-L367 HydrophobicContact CD2-CB 3.77Å; L358-L367 HydrophobicContact CD2-CD1 4.02Å; L358-Y372 HydrophobicContact CD1-CD1 4.06Å; L358-Y372 HydrophobicContact CD1-CE1 4.31Å; L358-Y372 HydrophobicContact CD2-CD1 3.76Å; L358-Y372 HydrophobicContact CD2-CE1 4.17Å; L358-Y372 HydrophobicContact CG-CD1 3.9Å; L358-Y372 HydrophobicContact CG-CE1 3.94Å; L358-V373 HydrophobicContact CD1-CB 4.38Å; L358-V373 HydrophobicContact CD1-CG2 4.02Å; L358-V373 HydrophobicContact CD2-CG2 3.77Å; L358-H376 HydrophobicContact CD1-CB 3.61Å
359A97.7Very high97.4Very high5 Ų544.5 Ų44.54%0.04126%0.26CS..THydrogen-bonded Turntrans-65-17.5174.300000112.4T306 T309 M310 G355 I356 V357 S361T306-A359 WeakPolarHBondContact CA-O 3.1Å; T306-A359 WeakPolarHBondContact CG2-O 3.44Å; T306-A359 PolarHBondContact OG1-O 2.89Å; T309-A359 HydrophobicContact CG2-CB 3.56Å; M310-A359 HydrophobicContact CE-CB 4.4Å; M310-A359 HydrophobicContact CG-CB 3.91Å; G355-A359 WeakPolarHBondContact O-CB 3.41Å; G355-A359 PolarHBondContact O-N 3.36Å; I356-A359 PolarHBondContact O-N 3.14Å; V357-A359 VanDerWaalsContact C-N 3.3Å; V357-A359 PolarHBondContact O-N 2.92Å; A359-S361 PolarHBondContact O-N 3.05Å
360N98.1Very high97.4Very high47 Ų4742.6 Ų42.625%0.25125%0.249SC..  trans-83.3109.8176.1-171.6-54.1000111M310 V357 L358 S362 L363 D364M310-N360 HydrophobicContact CE-CB 3.73Å; V357-N360 WeakPolarHBondContact O-CB 3.42Å; V357-N360 PolarHBondContact O-N 3.41Å; L358-N360 PolarHBondContact O-N 3.04Å; N360-S362 PolarHBondContact O-N 3.17Å; N360-S362 VanDerWaalsContact O-N 3.08Å; N360-S362 WeakPolarHBondContact OD1-CA 3.5Å; N360-S362 VanDerWaalsContact OD1-CB 3.27Å; N360-S362 WeakPolarHBondContact OD1-CB 3.48Å; N360-S362 PolarHBondContact OD1-N 2.9Å; N360-L363 HydrophobicContact CB-CB 4.2Å; N360-L363 HydrophobicContact CB-CD1 4.09Å; N360-L363 HydrophobicContact CB-CG 4.15Å; N360-L363 PolarHBondContact O-N 3.35Å; N360-L363 PolarHBondContact OD1-N 2.87Å; N360-D364 PolarHBondContact O-N 3.18Å
361S96.9Very high97.4Very high12 Ų1241.5 Ų41.58%0.08424%0.241CC..Hα-helixtrans-57.4-23.8179.357.50000115.5T306 A359 I365T306-S361 VanDerWaalsContact OG1-CB 3.29Å; T306-S361 WeakPolarHBondContact OG1-CB 3.45Å; T306-S361 PolarHBondContact OG1-N 3.34Å; T306-S361 PolarHBondContact OG1-OG 3.31Å; A359-S361 PolarHBondContact O-N 3.05Å; S361-I365 WeakPolarHBondContact O-CG1 3.3Å
362S96.4Very high97.5Very high84 Ų8442.4 Ų42.459%0.58725%0.245SC*.Hα-helixtrans-78.5-36176.3-57.10000112.1N360N360-S362 PolarHBondContact O-N 3.17Å; N360-S362 VanDerWaalsContact O-N 3.08Å; N360-S362 WeakPolarHBondContact OD1-CA 3.5Å; N360-S362 VanDerWaalsContact OD1-CB 3.27Å; N360-S362 WeakPolarHBondContact OD1-CB 3.48Å; N360-S362 PolarHBondContact OD1-N 2.9Å
363L97.3Very high97.5Very high79 Ų7942.5 Ų42.541%0.41424%0.24SC..Hα-helixtrans-77.7-35175.1-63179000111.3V357 N360 I365 V366 L367V357-L363 HydrophobicContact CG1-CD1 3.83Å; N360-L363 HydrophobicContact CB-CB 4.2Å; N360-L363 HydrophobicContact CB-CD1 4.09Å; N360-L363 HydrophobicContact CB-CG 4.15Å; N360-L363 PolarHBondContact O-N 3.35Å; N360-L363 PolarHBondContact OD1-N 2.87Å; L363-I365 PolarHBondContact O-N 2.99Å; L363-V366 WeakPolarHBondContact O-CG2 3.49Å; L363-V366 PolarHBondContact O-N 3.41Å; L363-V366 VanDerWaalsContact O-N 3.14Å; L363-L367 PolarHBondContact O-N 3.44Å
364D96.9Very high97.6Very high7 Ų738.9 Ų38.94%0.03722%0.222CC..Hα-helixtrans-62.1-29.5179.6-162.352.8000111.5F293 N360 V366 L367 H368F293-D364 HydrophobicContact CB-CB 4.38Å; F293-D364 HydrophobicContact CD2-CB 3.83Å; N360-D364 PolarHBondContact O-N 3.18Å; D364-V366 PolarHBondContact O-N 2.8Å; D364-L367 PolarHBondContact O-N 3.46Å; D364-H368 WeakPolarHBondContact O-CA 3.36Å; D364-H368 WeakPolarHBondContact O-CB 3.41Å; D364-H368 PolarHBondContact O-N 3.17Å; D364-H368 IonicContact OD1-ND1 3.77Å; D364-H368 IonicContact OD2-CG 2.7Å; D364-H368 IonicContact OD2-ND1 2.78Å; D364-H368 PolarHBondContact OD2-ND1 2.91Å
365I94.9Very high97.6Very high94 Ų9438.1 Ų38.148%0.48222%0.217SC..Hα-helixtrans-51.2-36.8175-68.2163.8000112.9S361 L363S361-I365 WeakPolarHBondContact O-CG1 3.3Å; L363-I365 PolarHBondContact O-N 2.99Å
366V96.8Very high97.6Very high103 Ų10339.1 Ų39.162%0.62422%0.218SC*.Hα-helixtrans-97.4-17.7-179.5-60.70000113.6L363 D364L363-V366 WeakPolarHBondContact O-CG2 3.49Å; L363-V366 PolarHBondContact O-N 3.41Å; L363-V366 VanDerWaalsContact O-N 3.14Å; D364-V366 PolarHBondContact O-N 2.8Å
367L98Very high97.6Very high12 Ų1238.3 Ų38.36%0.06321%0.212CC..Hα-helixtrans-101.4-18.1-178.3-62.1178.3000113.2V357 L358 L363 D364 T370 Y372 V373 L433V357-L367 HydrophobicContact CG1-CD1 3.84Å; L358-L367 HydrophobicContact CD2-CB 3.77Å; L358-L367 HydrophobicContact CD2-CD1 4.02Å; L363-L367 PolarHBondContact O-N 3.44Å; D364-L367 PolarHBondContact O-N 3.46Å; L367-T370 WeakPolarHBondContact O-CB 3.32Å; L367-T370 WeakPolarHBondContact O-CG2 3.33Å; L367-T370 PolarHBondContact O-N 2.8Å; L367-T370 VanDerWaalsContact O-N 3.12Å; L367-T370 PolarHBondContact O-OG1 2.9Å; L367-Y372 HydrophobicContact CD1-CD1 4.01Å; L367-Y372 HydrophobicContact CD1-CE1 4.1Å; L367-Y372 HydrophobicContact CD1-CG 4.34Å; L367-Y372 HydrophobicContact CD2-CD2 4.4Å; L367-Y372 HydrophobicContact CD2-CG 4.16Å; L367-V373 WeakPolarHBondContact O-CG2 3.46Å; L367-L433 HydrophobicContact CD2-CD2 4.07Å
368H98.1Very high97.6Very high38 Ų3837.8 Ų37.818%0.17621%0.206CC..THydrogen-bonded Turntrans-57.6140.5-179.4-16387000110.4H291 T294 D364 T370H291-H368 PolarHBondContact O-CE1 3.19Å; T294-H368 HydrophobicContact CG2-CB 3.49Å; T294-H368 VanDerWaalsContact CG2-CB 3.49Å; T294-H368 VanDerWaalsContact CG2-CG 3.49Å; T294-H368 PolarHBondContact OG1-CD2 3.38Å; T294-H368 VanDerWaalsContact OG1-CD2 3.3Å; T294-H368 PolarHBondContact OG1-NE2 3.5Å; D364-H368 WeakPolarHBondContact O-CA 3.36Å; D364-H368 WeakPolarHBondContact O-CB 3.41Å; D364-H368 PolarHBondContact O-N 3.17Å; D364-H368 IonicContact OD1-ND1 3.77Å; D364-H368 IonicContact OD2-CG 2.7Å; D364-H368 IonicContact OD2-ND1 2.78Å; D364-H368 PolarHBondContact OD2-ND1 2.91Å; H368-T370 PolarHBondContact O-N 2.97Å
369D97.3Very high97.6Very high72 Ų7237 Ų3739%0.38520%0.202SC..THydrogen-bonded Turntrans55.116.9-176.7-72.7-34.5000115.7P437 R438D369-P437 CarbonylContact O-C 3.59Å; D369-P437 WeakPolarHBondContact O-CA 3.46Å; D369-R438 HydrophobicContact CB-CG 4.4Å; D369-R438 VanDerWaalsContact O-CG 3.29Å; D369-R438 WeakPolarHBondContact O-CG 3.23Å; D369-R438 PolarHBondContact O-N 3.13Å; D369-R438 IonicContact OD1-CZ 3.87Å; D369-R438 IonicContact OD1-NE 3.73Å; D369-R438 PolarHBondContact OD1-NE 3.17Å; D369-R438 IonicContact OD1-NH2 2.96Å; D369-R438 PolarHBondContact OD1-NH2 3.41Å
370T98.5Very high97.4Very high9 Ų938.1 Ų38.16%0.05521%0.208CC..BIsolated β-bridgetrans-95.9171.1171.575.20000112.2L367 H368 Y372 V373 M436L367-T370 WeakPolarHBondContact O-CB 3.32Å; L367-T370 WeakPolarHBondContact O-CG2 3.33Å; L367-T370 PolarHBondContact O-N 2.8Å; L367-T370 VanDerWaalsContact O-N 3.12Å; L367-T370 PolarHBondContact O-OG1 2.9Å; H368-T370 PolarHBondContact O-N 2.97Å; T370-Y372 PolarHBondContact O-N 2.81Å; T370-Y372 VanDerWaalsContact O-N 3.12Å; T370-Y372 WeakPolarHBondContact OG1-CB 3.38Å; T370-Y372 PolarHBondContact OG1-N 3.13Å; T370-Y372 VanDerWaalsContact OG1-N 3.15Å; T370-V373 PolarHBondContact O-N 2.97Å; T370-M436 CarbonylContact C-O 3.45Å; T370-M436 VanDerWaalsContact CA-O 3.27Å; T370-M436 WeakPolarHBondContact CA-O 3.24Å; T370-M436 WeakPolarHBondContact CB-O 3.42Å
371Y98.4Very high96.9Very high12 Ų1236.8 Ų36.85%0.04720%0.201CC..Hα-helixtrans-61.5-11.9170.3-91.4-102000114.2L41 V374 A375 Q428 L431 M436 P437L41-Y371 WeakPolarHBondContact CD1-OH 3.41Å; Y371-V374 HydrophobicContact CD1-CB 4.47Å; Y371-V374 PolarHBondContact O-N 3.14Å; Y371-A375 WeakPolarHBondContact O-CB 3.01Å; Y371-A375 PolarHBondContact O-N 3.42Å; Y371-Q428 CarbonylContact C-O 3.28Å; Y371-Q428 WeakPolarHBondContact CB-O 3.41Å; Y371-Q428 HydrophobicContact CD1-CB 4.04Å; Y371-Q428 HydrophobicContact CD1-CG 3.83Å; Y371-Q428 HydrophobicContact CE1-CG 4.42Å; Y371-L431 HydrophobicContact CD1-CD1 4.36Å; Y371-L431 HydrophobicContact CG-CB 4.33Å; Y371-M436 HydrophobicContact CD2-CB 4.24Å; Y371-M436 HydrophobicContact CD2-CE 4.1Å; Y371-M436 HydrophobicContact CD2-CG 3.76Å; Y371-M436 HydrophobicContact CD2-SD 3.72Å; Y371-M436 HydrophobicContact CE2-CE 3.52Å; Y371-M436 HydrophobicContact CE2-CG 4.06Å; Y371-M436 HydrophobicContact CE2-SD 3.79Å; Y371-M436 HydrophobicContact CG-SD 4.2Å; Y371-M436 PolarHBondContact N-O 3.36Å; Y371-P437 WeakPolarHBondContact CD2-O 3.44Å; Y371-P437 VanDerWaalsContact CE2-O 3.24Å; Y371-P437 WeakPolarHBondContact CE2-O 3.43Å
372Y98.7Very high96Very high20 Ų2037.4 Ų37.48%0.07821%0.206CC..Hα-helixtrans-66.6-43175.6-166-86000110.8V357 L358 L367 T370 V374 A375 H376 H429 L433V357-Y372 HydrophobicContact CB-CE1 4.43Å; V357-Y372 HydrophobicContact CG1-CE1 4.37Å; L358-Y372 HydrophobicContact CD1-CD1 4.06Å; L358-Y372 HydrophobicContact CD1-CE1 4.31Å; L358-Y372 HydrophobicContact CD2-CD1 3.76Å; L358-Y372 HydrophobicContact CD2-CE1 4.17Å; L358-Y372 HydrophobicContact CG-CD1 3.9Å; L358-Y372 HydrophobicContact CG-CE1 3.94Å; L367-Y372 HydrophobicContact CD1-CD1 4.01Å; L367-Y372 HydrophobicContact CD1-CE1 4.1Å; L367-Y372 HydrophobicContact CD1-CG 4.34Å; L367-Y372 HydrophobicContact CD2-CD2 4.4Å; L367-Y372 HydrophobicContact CD2-CG 4.16Å; T370-Y372 PolarHBondContact O-N 2.81Å; T370-Y372 VanDerWaalsContact O-N 3.12Å; T370-Y372 WeakPolarHBondContact OG1-CB 3.38Å; T370-Y372 PolarHBondContact OG1-N 3.13Å; T370-Y372 VanDerWaalsContact OG1-N 3.15Å; Y372-V374 VanDerWaalsContact C-N 3.33Å; Y372-A375 PolarHBondContact O-N 2.79Å; Y372-H376 WeakPolarHBondContact O-CB 3.46Å; Y372-H376 PolarHBondContact O-N 3.27Å; Y372-H429 HydrophobicContact CD2-CB 4.17Å; Y372-H429 AromaticContact CD2-CD2 3.97Å; Y372-H429 HydrophobicContact CE2-CB 4.25Å; Y372-H429 AromaticContact CE2-CD2 3.83Å; Y372-L433 HydrophobicContact CD2-CD2 4.06Å; Y372-L433 HydrophobicContact CD2-CG 3.85Å; Y372-L433 HydrophobicContact CE2-CD1 4.34Å; Y372-L433 HydrophobicContact CE2-CD2 3.99Å; Y372-L433 HydrophobicContact CE2-CG 4Å
373V98.3Very high95.4Very high28 Ų2833.4 Ų33.417%0.1718%0.178CC..Hα-helixtrans-66-39.2175.7-179.50000110.6L358 L367 T370 F377L358-V373 HydrophobicContact CD1-CB 4.38Å; L358-V373 HydrophobicContact CD1-CG2 4.02Å; L358-V373 HydrophobicContact CD2-CG2 3.77Å; L367-V373 WeakPolarHBondContact O-CG2 3.46Å; T370-V373 PolarHBondContact O-N 2.97Å; V373-F377 WeakPolarHBondContact O-CB 3.46Å; V373-F377 PolarHBondContact O-N 3.24Å
374V98.3Very high94.9Very high30 Ų3029.7 Ų29.718%0.18216%0.158CC..Hα-helixtrans-61.2-48175.7-1780000110.1Y371 Y372 F377 H378 R438Y371-V374 HydrophobicContact CD1-CB 4.47Å; Y371-V374 PolarHBondContact O-N 3.14Å; Y372-V374 VanDerWaalsContact C-N 3.33Å; V374-F377 PolarHBondContact O-N 3.46Å; V374-H378 PolarHBondContact O-N 2.83Å; V374-H378 PolarHBondContact O-ND1 3.29Å; V374-R438 HydrophobicContact CG2-CB 3.85Å
375A98.4Very high94.7Very high0 Ų029.3 Ų29.30%016%0.156CC..Hα-helixtrans-62.1-50.1178.900000111.8Y371 Y372 F377 H378 Y379 Q428 H429Y371-A375 WeakPolarHBondContact O-CB 3.01Å; Y371-A375 PolarHBondContact O-N 3.42Å; Y372-A375 PolarHBondContact O-N 2.79Å; A375-F377 VanDerWaalsContact C-N 3.34Å; A375-F377 PolarHBondContact O-N 2.87Å; A375-H378 PolarHBondContact O-N 3.2Å; A375-Y379 WeakPolarHBondContact O-CD2 3.41Å; A375-Y379 PolarHBondContact O-N 3.43Å; A375-Q428 HydrophobicContact CB-CB 3.71Å; A375-H429 VanDerWaalsContact CB-CE1 3.48Å; A375-H429 WeakPolarHBondContact CB-CE1 3.35Å; A375-H429 WeakPolarHBondContact CB-NE2 3.45Å
376H98.3Very high94.8Very high37 Ų3725.7 Ų25.717%0.17114%0.138CC..Hα-helixtrans-51.2-53.6175.4165.261000111.2G351 T354 G355 L358 Y372 H378 Y379 V380G351-H376 PolarHBondContact O-CE1 3.13Å; G351-H376 PolarHBondContact O-ND1 2.89Å; T354-H376 PolarHBondContact OG1-ND1 3.48Å; G355-H376 WeakPolarHBondContact CA-CE1 3.44Å; G355-H376 WeakPolarHBondContact CA-ND1 3.37Å; G355-H376 PolarHBondContact N-CE1 3.14Å; G355-H376 PolarHBondContact N-ND1 3.49Å; G355-H376 VanDerWaalsContact N-ND1 3.13Å; L358-H376 HydrophobicContact CD1-CB 3.61Å; Y372-H376 WeakPolarHBondContact O-CB 3.46Å; Y372-H376 PolarHBondContact O-N 3.27Å; H376-H378 PolarHBondContact O-N 3.5Å; H376-Y379 PolarHBondContact O-N 3.26Å; H376-Y379 VanDerWaalsContact O-N 3.16Å; H376-V380 PolarHBondContact O-N 3.04Å; H376-V380 VanDerWaalsContact O-N 3.1Å
377F96.1Very high94.9Very high47 Ų4721 Ų2121%0.20611%0.109CC..Hα-helixtrans-64.2-39.1-177.2-174.7-115.5000112.2V243 V373 V374 A375 Y379 V380 L381V243-F377 HydrophobicContact CB-CE2 4.38Å; V243-F377 HydrophobicContact CG1-CE2 3.62Å; V243-F377 HydrophobicContact CG1-CZ 4.22Å; V373-F377 WeakPolarHBondContact O-CB 3.46Å; V373-F377 PolarHBondContact O-N 3.24Å; V374-F377 PolarHBondContact O-N 3.46Å; A375-F377 VanDerWaalsContact C-N 3.34Å; A375-F377 PolarHBondContact O-N 2.87Å; F377-Y379 VanDerWaalsContact C-N 3.34Å; F377-Y379 PolarHBondContact O-N 2.95Å; F377-V380 HydrophobicContact CD2-CG2 4.14Å; F377-V380 WeakPolarHBondContact O-CG2 3.38Å; F377-V380 PolarHBondContact O-N 3.48Å; F377-L381 HydrophobicContact CD1-CB 4.48Å; F377-L381 HydrophobicContact CD1-CD2 4.45Å; F377-L381 HydrophobicContact CE1-CB 4.18Å; F377-L381 HydrophobicContact CE1-CD2 3.61Å; F377-L381 HydrophobicContact CE1-CG 4.36Å; F377-L381 HydrophobicContact CE2-CB 4.23Å; F377-L381 HydrophobicContact CZ-CB 4.05Å; F377-L381 HydrophobicContact CZ-CD1 4.11Å; F377-L381 HydrophobicContact CZ-CD2 3.78Å; F377-L381 HydrophobicContact CZ-CG 4.19Å; F377-L381 WeakPolarHBondContact O-CB 3.36Å; F377-L381 PolarHBondContact O-N 2.7Å
378H98.1Very high94.9Very high40 Ų4020.4 Ų20.419%0.18511%0.106CC..Hα-helixtrans-70.4-28.6176.2-73.882.7000112.9V374 A375 H376 S382 M383 F425V374-H378 PolarHBondContact O-N 2.83Å; V374-H378 PolarHBondContact O-ND1 3.29Å; A375-H378 PolarHBondContact O-N 3.2Å; H376-H378 PolarHBondContact O-N 3.5Å; H378-S382 VanDerWaalsContact O-CA 3.28Å; H378-S382 WeakPolarHBondContact O-CA 3.34Å; H378-S382 WeakPolarHBondContact O-CB 3.45Å; H378-S382 PolarHBondContact O-N 3.17Å; H378-M383 PolarHBondContact O-N 3.44Å; H378-M383 VanDerWaalsContact O-N 3.12Å; H378-F425 HydrophobicContact CB-CB 4.45Å; H378-F425 HydrophobicContact CB-CD1 3.42Å; H378-F425 VanDerWaalsContact CB-CD1 3.42Å; H378-F425 HydrophobicContact CB-CD2 4.01Å; H378-F425 HydrophobicContact CB-CE1 3.5Å; H378-F425 VanDerWaalsContact CB-CE1 3.5Å; H378-F425 HydrophobicContact CB-CE2 4.06Å; H378-F425 HydrophobicContact CB-CG 3.7Å; H378-F425 HydrophobicContact CB-CZ 3.82Å; H378-F425 AromaticContact CD2-CE1 3.2Å; H378-F425 WeakPolarHBondContact CD2-CE1 3.31Å; H378-F425 AromaticContact CD2-CZ 3.3Å; H378-F425 WeakPolarHBondContact CD2-CZ 3.43Å; H378-F425 AromaticContact CG-CD1 3.67Å; H378-F425 AromaticContact CG-CE1 3.29Å; H378-F425 AromaticContact CG-CZ 3.74Å; H378-F425 AromaticContact NE2-CE1 3.9Å
379Y97.4Very high94.9Very high1 Ų118.9 Ų18.90%0.00410%0.099CC..Hα-helixtrans-66.4-39.9169.1-92.2-98.4000112.6L347 V350 A375 H376 F377 M383 G384 N422 F425 F426 H429L347-Y379 HydrophobicContact CB-CD1 4.27Å; L347-Y379 HydrophobicContact CB-CE1 4.43Å; L347-Y379 HydrophobicContact CD2-CD1 4.47Å; L347-Y379 HydrophobicContact CD2-CE1 3.8Å; L347-Y379 WeakPolarHBondContact O-CD1 3.47Å; V350-Y379 HydrophobicContact CB-CD1 4.15Å; V350-Y379 HydrophobicContact CB-CE1 4.24Å; V350-Y379 HydrophobicContact CG1-CD1 4.01Å; V350-Y379 HydrophobicContact CG1-CE1 3.88Å; A375-Y379 WeakPolarHBondContact O-CD2 3.41Å; A375-Y379 PolarHBondContact O-N 3.43Å; H376-Y379 PolarHBondContact O-N 3.26Å; H376-Y379 VanDerWaalsContact O-N 3.16Å; F377-Y379 VanDerWaalsContact C-N 3.34Å; F377-Y379 PolarHBondContact O-N 2.95Å; Y379-M383 HydrophobicContact CD1-CE 3.63Å; Y379-M383 HydrophobicContact CD1-SD 3.42Å; Y379-M383 WeakPolarHBondContact CD1-SD 3.46Å; Y379-M383 HydrophobicContact CD2-CE 3.26Å; Y379-M383 HydrophobicContact CD2-SD 4.21Å; Y379-M383 HydrophobicContact CE1-CE 3.73Å; Y379-M383 HydrophobicContact CE1-SD 3.38Å; Y379-M383 WeakPolarHBondContact CE1-SD 3.24Å; Y379-M383 HydrophobicContact CE2-CE 3.37Å; Y379-M383 HydrophobicContact CE2-SD 4.18Å; Y379-M383 HydrophobicContact CG-CE 3.39Å; Y379-M383 HydrophobicContact CG-SD 3.84Å; Y379-M383 CarbonylContact O-C 3.57Å; Y379-M383 VanDerWaalsContact O-CB 3.27Å; Y379-M383 WeakPolarHBondContact O-CB 3.45Å; Y379-M383 PolarHBondContact O-N 3.26Å; Y379-G384 PolarHBondContact O-N 3.2Å; Y379-N422 PolarHBondContact OH-OD1 3.45Å; Y379-F425 HydrophobicContact CD2-CB 4Å; Y379-F425 HydrophobicContact CE2-CB 3.69Å; Y379-F426 WeakPolarHBondContact OH-CB 3.29Å; Y379-F426 WeakPolarHBondContact OH-CD2 3.4Å; Y379-H429 AromaticContact CD2-CE1 3.6Å; Y379-H429 AromaticContact CE2-CE1 3.59Å
380V94.1Very high94.9Very high28 Ų2816.9 Ų16.917%0.179%0.088CC..Hα-helixtrans-83.6-28.5178.6-60.80000113.6F348 H376 F377 G384F348-V380 HydrophobicContact CD2-CB 4.38Å; F348-V380 HydrophobicContact CD2-CG1 4.37Å; F348-V380 HydrophobicContact CE2-CB 4.12Å; F348-V380 HydrophobicContact CE2-CG1 4.15Å; H376-V380 PolarHBondContact O-N 3.04Å; H376-V380 VanDerWaalsContact O-N 3.1Å; F377-V380 HydrophobicContact CD2-CG2 4.14Å; F377-V380 WeakPolarHBondContact O-CG2 3.38Å; F377-V380 PolarHBondContact O-N 3.48Å; V380-G384 WeakPolarHBondContact O-CA 3.44Å; V380-G384 PolarHBondContact O-N 2.96Å
381L87.9Confident94.9Very high19 Ų1916.4 Ų16.410%0.0999%0.085CC..Iπ-helixtrans-91.4-60.6178.2-171.580.2000112I66 L246 F377 A385 V386I66-L381 HydrophobicContact CG1-CD2 4.43Å; L246-L381 HydrophobicContact CB-CD1 4.04Å; L246-L381 HydrophobicContact CD1-CD1 3.59Å; L246-L381 HydrophobicContact CG-CD1 4.36Å; F377-L381 HydrophobicContact CD1-CB 4.48Å; F377-L381 HydrophobicContact CD1-CD2 4.45Å; F377-L381 HydrophobicContact CE1-CB 4.18Å; F377-L381 HydrophobicContact CE1-CD2 3.61Å; F377-L381 HydrophobicContact CE1-CG 4.36Å; F377-L381 HydrophobicContact CE2-CB 4.23Å; F377-L381 HydrophobicContact CZ-CB 4.05Å; F377-L381 HydrophobicContact CZ-CD1 4.11Å; F377-L381 HydrophobicContact CZ-CD2 3.78Å; F377-L381 HydrophobicContact CZ-CG 4.19Å; F377-L381 WeakPolarHBondContact O-CB 3.36Å; F377-L381 PolarHBondContact O-N 2.7Å; L381-A385 HydrophobicContact CD1-CB 4.38Å; L381-A385 WeakPolarHBondContact O-CA 3.34Å; L381-A385 VanDerWaalsContact O-CB 3.29Å; L381-A385 WeakPolarHBondContact O-CB 3.48Å; L381-A385 PolarHBondContact O-N 3.45Å; L381-V386 PolarHBondContact O-N 3.04Å
382S78.3Confident94.9Very high26 Ų2615.9 Ų15.918%0.1828%0.083CC..Iπ-helixtrans-67.7-47-178.7-169.20000111H378 V386 F387H378-S382 VanDerWaalsContact O-CA 3.28Å; H378-S382 WeakPolarHBondContact O-CA 3.34Å; H378-S382 WeakPolarHBondContact O-CB 3.45Å; H378-S382 PolarHBondContact O-N 3.17Å; S382-V386 VanDerWaalsContact O-CB 3.25Å; S382-V386 WeakPolarHBondContact O-CB 3.41Å; S382-F387 WeakPolarHBondContact O-CD2 3.33Å
383M83Confident94.9Very high0 Ų016.8 Ų16.80%09%0.088CC..Iπ-helixtrans-89.2-8.1-179.9-61.4164.5-112.600113.6L347 H378 Y379 F387 V421 F425L347-M383 HydrophobicContact CB-CB 3.59Å; L347-M383 HydrophobicContact CB-CG 4.15Å; L347-M383 HydrophobicContact CB-SD 3.85Å; L347-M383 HydrophobicContact CD1-CB 3.92Å; L347-M383 HydrophobicContact CD1-CG 3.74Å; L347-M383 HydrophobicContact CD1-SD 3.64Å; L347-M383 HydrophobicContact CD2-SD 3.98Å; L347-M383 HydrophobicContact CG-CB 4.37Å; L347-M383 HydrophobicContact CG-CG 4.49Å; L347-M383 HydrophobicContact CG-SD 4.01Å; H378-M383 PolarHBondContact O-N 3.44Å; H378-M383 VanDerWaalsContact O-N 3.12Å; Y379-M383 HydrophobicContact CD1-CE 3.63Å; Y379-M383 HydrophobicContact CD1-SD 3.42Å; Y379-M383 WeakPolarHBondContact CD1-SD 3.46Å; Y379-M383 HydrophobicContact CD2-CE 3.26Å; Y379-M383 HydrophobicContact CD2-SD 4.21Å; Y379-M383 HydrophobicContact CE1-CE 3.73Å; Y379-M383 HydrophobicContact CE1-SD 3.38Å; Y379-M383 WeakPolarHBondContact CE1-SD 3.24Å; Y379-M383 HydrophobicContact CE2-CE 3.37Å; Y379-M383 HydrophobicContact CE2-SD 4.18Å; Y379-M383 HydrophobicContact CG-CE 3.39Å; Y379-M383 HydrophobicContact CG-SD 3.84Å; Y379-M383 CarbonylContact O-C 3.57Å; Y379-M383 VanDerWaalsContact O-CB 3.27Å; Y379-M383 WeakPolarHBondContact O-CB 3.45Å; Y379-M383 PolarHBondContact O-N 3.26Å; M383-F387 HydrophobicContact CB-CD2 4.39Å; M383-F387 HydrophobicContact CB-CE2 4.47Å; M383-F387 HydrophobicContact CG-CD2 4.48Å; M383-F387 HydrophobicContact CG-CE2 4.1Å; M383-F387 HydrophobicContact CG-CZ 4.46Å; M383-F387 WeakPolarHBondContact O-CB 3.49Å; M383-V421 HydrophobicContact CE-CB 4.47Å; M383-V421 HydrophobicContact CG-CB 4.33Å; M383-V421 HydrophobicContact CG-CG2 3.78Å; M383-V421 HydrophobicContact SD-CG2 3.94Å; M383-F425 HydrophobicContact CE-CB 3.81Å; M383-F425 HydrophobicContact CE-CD2 3.55Å; M383-F425 HydrophobicContact CE-CG 4.06Å
384G88.1Confident94.8Very high0 Ų015.9 Ų15.90%08%0.082CC..Iπ-helixtrans-92.6-80.716700000111.8F344 Y379 V380 V386 F387 A388F344-G384 WeakPolarHBondContact CD2-O 3.31Å; F344-G384 VanDerWaalsContact CE2-CA 3.45Å; F344-G384 VanDerWaalsContact CE2-O 3.26Å; F344-G384 WeakPolarHBondContact CE2-O 3.49Å; Y379-G384 PolarHBondContact O-N 3.2Å; V380-G384 WeakPolarHBondContact O-CA 3.44Å; V380-G384 PolarHBondContact O-N 2.96Å; G384-V386 PolarHBondContact O-N 3.39Å; G384-F387 PolarHBondContact O-N 3.42Å; G384-A388 WeakPolarHBondContact O-CB 3.23Å; G384-A388 PolarHBondContact O-N 2.98Å
385A93Very high94.7Very high0 Ų014.8 Ų14.80%08%0.075CC..Iπ-helixtrans-58.3-50.4-174.500000113.3V70 M74 L246 L381 F387 A388 I389V70-A385 HydrophobicContact CG1-CB 3.85Å; M74-A385 HydrophobicContact CE-CB 3.96Å; M74-A385 HydrophobicContact SD-CB 4.22Å; L246-A385 WeakPolarHBondContact O-CB 3.45Å; L381-A385 HydrophobicContact CD1-CB 4.38Å; L381-A385 WeakPolarHBondContact O-CA 3.34Å; L381-A385 VanDerWaalsContact O-CB 3.29Å; L381-A385 WeakPolarHBondContact O-CB 3.48Å; L381-A385 PolarHBondContact O-N 3.45Å; A385-F387 PolarHBondContact O-N 3.22Å; A385-A388 PolarHBondContact O-N 2.83Å; A385-I389 VanDerWaalsContact O-CG1 3.3Å; A385-I389 WeakPolarHBondContact O-CG1 3.4Å; A385-I389 PolarHBondContact O-N 2.95Å
386V95.9Very high94.7Very high18 Ų1814.8 Ų14.811%0.1098%0.075CC..Iπ-helixtrans-68.7-37.4-176.2-174.70000111.6M69 L381 S382 G384 A388 I389 M390M69-V386 HydrophobicContact CE-CG1 4.2Å; M69-V386 HydrophobicContact CE-CG2 4.15Å; L381-V386 PolarHBondContact O-N 3.04Å; S382-V386 VanDerWaalsContact O-CB 3.25Å; S382-V386 WeakPolarHBondContact O-CB 3.41Å; G384-V386 PolarHBondContact O-N 3.39Å; V386-A388 PolarHBondContact O-N 3.17Å; V386-I389 WeakPolarHBondContact O-CB 3.29Å; V386-I389 PolarHBondContact O-N 3.49Å; V386-M390 HydrophobicContact CG1-CE 3.95Å; V386-M390 HydrophobicContact CG1-CG 4.32Å; V386-M390 VanDerWaalsContact O-CG 3.27Å; V386-M390 WeakPolarHBondContact O-CG 3.38Å; V386-M390 PolarHBondContact O-N 2.89Å
387F98Very high94.6Very high3 Ų313.3 Ų13.31%0.0137%0.068CC..Hα-helixtrans-65.2-39.4174.9-87.8-128.3000112.1W340 F344 L347 S382 M383 G384 A385 M390 G391 F414 M417 F418 V421W340-F387 HydrophobicContact CE3-CB 4.11Å; W340-F387 AromaticContact CE3-CD1 3.6Å; W340-F387 HydrophobicContact CE3-CD1 3.6Å; W340-F387 HydrophobicContact CE3-CD2 4.2Å; W340-F387 AromaticContact CE3-CE1 3.98Å; W340-F387 HydrophobicContact CE3-CE1 3.98Å; W340-F387 AromaticContact CE3-CG 3.72Å; W340-F387 HydrophobicContact CE3-CG 3.72Å; W340-F387 HydrophobicContact CE3-CZ 4.43Å; W340-F387 HydrophobicContact CZ3-CB 4.48Å; W340-F387 AromaticContact CZ3-CD1 3.87Å; W340-F387 HydrophobicContact CZ3-CD1 3.87Å; W340-F387 AromaticContact CZ3-CD2 3.77Å; W340-F387 HydrophobicContact CZ3-CD2 3.77Å; W340-F387 AromaticContact CZ3-CE1 3.92Å; W340-F387 HydrophobicContact CZ3-CE1 3.92Å; W340-F387 AromaticContact CZ3-CE2 3.83Å; W340-F387 HydrophobicContact CZ3-CE2 3.83Å; W340-F387 AromaticContact CZ3-CG 3.79Å; W340-F387 HydrophobicContact CZ3-CG 3.79Å; W340-F387 AromaticContact CZ3-CZ 3.91Å; W340-F387 HydrophobicContact CZ3-CZ 3.91Å; F344-F387 HydrophobicContact CB-CB 4.22Å; F344-F387 HydrophobicContact CD2-CB 4.45Å; L347-F387 HydrophobicContact CD1-CD1 4.45Å; L347-F387 HydrophobicContact CD1-CE1 3.75Å; L347-F387 HydrophobicContact CD1-CZ 3.9Å; S382-F387 WeakPolarHBondContact O-CD2 3.33Å; M383-F387 HydrophobicContact CB-CD2 4.39Å; M383-F387 HydrophobicContact CB-CE2 4.47Å; M383-F387 HydrophobicContact CG-CD2 4.48Å; M383-F387 HydrophobicContact CG-CE2 4.1Å; M383-F387 HydrophobicContact CG-CZ 4.46Å; M383-F387 WeakPolarHBondContact O-CB 3.49Å; G384-F387 PolarHBondContact O-N 3.42Å; A385-F387 PolarHBondContact O-N 3.22Å; F387-M390 PolarHBondContact O-N 3.4Å; F387-G391 PolarHBondContact O-N 3.38Å; F387-F414 HydrophobicContact CE1-CE2 4.17Å; F387-M417 HydrophobicContact CE2-CG 4.16Å; F387-M417 HydrophobicContact CZ-CG 4.41Å; F387-F418 HydrophobicContact CE1-CD2 4.1Å; F387-F418 HydrophobicContact CZ-CD2 4.47Å; F387-V421 HydrophobicContact CE2-CG1 4.49Å; F387-V421 HydrophobicContact CE2-CG2 4Å; F387-V421 HydrophobicContact CZ-CG2 3.9Å
388A98.3Very high94.6Very high0 Ų012.1 Ų12.10%07%0.065CC..Hα-helixtrans-65-39.917400000111.6G250 M253 I254 F344 G384 A385 V386 G392G250-A388 VanDerWaalsContact CA-CB 3.48Å; M253-A388 HydrophobicContact CE-CB 3.95Å; I254-A388 HydrophobicContact CD1-CB 4.18Å; I254-A388 HydrophobicContact CG1-CB 4.09Å; F344-A388 HydrophobicContact CD2-CB 4.13Å; F344-A388 HydrophobicContact CE2-CB 4.18Å; G384-A388 WeakPolarHBondContact O-CB 3.23Å; G384-A388 PolarHBondContact O-N 2.98Å; A385-A388 PolarHBondContact O-N 2.83Å; V386-A388 PolarHBondContact O-N 3.17Å; A388-G392 PolarHBondContact O-N 2.87Å
389I98.4Very high94.4Very high6 Ų610.2 Ų10.23%0.0316%0.056CC..Hα-helixtrans-58.7-47.2171.6-72.4167.3000110.8M69 I73 M74 F78 M253 A385 V386 G392 F393M69-I389 HydrophobicContact CE-CD1 4.45Å; I73-I389 HydrophobicContact CB-CD1 4.2Å; I73-I389 HydrophobicContact CG2-CB 4.39Å; I73-I389 HydrophobicContact CG2-CD1 3.96Å; I73-I389 HydrophobicContact CG2-CG1 3.88Å; I73-I389 HydrophobicContact CG2-CG2 3.66Å; M74-I389 HydrophobicContact CG-CD1 3.78Å; M74-I389 HydrophobicContact CG-CG1 3.52Å; M74-I389 HydrophobicContact SD-CD1 4.27Å; M74-I389 HydrophobicContact SD-CG1 4.04Å; F78-I389 HydrophobicContact CE2-CG2 4.43Å; M253-I389 HydrophobicContact CE-CG1 4.47Å; A385-I389 VanDerWaalsContact O-CG1 3.3Å; A385-I389 WeakPolarHBondContact O-CG1 3.4Å; A385-I389 PolarHBondContact O-N 2.95Å; V386-I389 WeakPolarHBondContact O-CB 3.29Å; V386-I389 PolarHBondContact O-N 3.49Å; I389-G392 PolarHBondContact O-N 2.74Å; I389-F393 WeakPolarHBondContact O-CB 3.14Å; I389-F393 PolarHBondContact O-N 3.36Å
390M98.3Very high94.4Very high30 Ų3011.6 Ų11.615%0.1486%0.062CC..Hα-helixtrans-68.2-42.3-178.4-66.4-58.9157.100112.1W340 V386 F387 F393 I394 M468W340-M390 HydrophobicContact CD2-CB 3.68Å; W340-M390 HydrophobicContact CE3-CB 3.63Å; W340-M390 HydrophobicContact CE3-CG 4.35Å; W340-M390 HydrophobicContact CG-CB 4.37Å; W340-M390 HydrophobicContact CH2-CB 3.88Å; W340-M390 HydrophobicContact CH2-CG 3.91Å; W340-M390 HydrophobicContact CZ2-CB 3.96Å; W340-M390 HydrophobicContact CZ2-CG 4.32Å; W340-M390 HydrophobicContact CZ3-CB 3.72Å; W340-M390 HydrophobicContact CZ3-CG 3.94Å; V386-M390 HydrophobicContact CG1-CE 3.95Å; V386-M390 HydrophobicContact CG1-CG 4.32Å; V386-M390 VanDerWaalsContact O-CG 3.27Å; V386-M390 WeakPolarHBondContact O-CG 3.38Å; V386-M390 PolarHBondContact O-N 2.89Å; F387-M390 PolarHBondContact O-N 3.4Å; M390-F393 PolarHBondContact O-N 2.94Å; M390-I394 WeakPolarHBondContact O-CG1 3.05Å; M390-I394 PolarHBondContact O-N 3.21Å; M390-M468 HydrophobicContact CE-CE 4.48Å; M390-M468 HydrophobicContact SD-CE 3.22Å; M390-M468 WeakPolarHBondContact SD-CE 3.24Å
391G98.1Very high94.5Very high0 Ų011.3 Ų11.30%06%0.061CC..Hα-helixtrans-61.3-46.1173.600000111.9F387 I394 H395F387-G391 PolarHBondContact O-N 3.38Å; G391-I394 PolarHBondContact O-N 3.28Å; G391-H395 WeakPolarHBondContact O-CB 3.5Å; G391-H395 PolarHBondContact O-N 2.72Å
392G97.9Very high94.8Very high0 Ų010.7 Ų10.70%06%0.06CC..Hα-helixtrans-63.4-44.217600000112A388 I389 I394 H395 W396A388-G392 PolarHBondContact O-N 2.87Å; I389-G392 PolarHBondContact O-N 2.74Å; G392-I394 PolarHBondContact O-N 2.91Å; G392-H395 PolarHBondContact O-N 3.07Å; G392-W396 VanDerWaalsContact CA-CE3 3.49Å; G392-W396 PolarHBondContact O-N 2.92Å
393F98.1Very high95.6Very high39 Ų3911.9 Ų11.917%0.1716%0.061CC..Hα-helixtrans-60.2-49.7178-180-100.7000110.2F78 I389 M390 H395 W396 F397 L405 M468 I472F78-F393 HydrophobicContact CZ-CB 4.28Å; I389-F393 WeakPolarHBondContact O-CB 3.14Å; I389-F393 PolarHBondContact O-N 3.36Å; M390-F393 PolarHBondContact O-N 2.94Å; F393-H395 VanDerWaalsContact C-N 3.3Å; F393-H395 PolarHBondContact O-N 3.38Å; F393-W396 PolarHBondContact O-N 3.33Å; F393-F397 AromaticContact CE1-CD2 3.77Å; F393-F397 HydrophobicContact CE1-CD2 3.77Å; F393-F397 HydrophobicContact CE1-CE2 4.3Å; F393-F397 HydrophobicContact CE1-CG 4.49Å; F393-F397 AromaticContact CE2-CD2 3.8Å; F393-F397 HydrophobicContact CE2-CD2 3.8Å; F393-F397 HydrophobicContact CE2-CE2 4.39Å; 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 4.39Å; F393-F397 VanDerWaalsContact O-CA 3.32Å; F393-F397 WeakPolarHBondContact O-CA 3.35Å; F393-F397 WeakPolarHBondContact O-CB 3.43Å; F393-F397 PolarHBondContact O-N 3Å; F393-L405 HydrophobicContact CD1-CD1 4.49Å; F393-L405 HydrophobicContact CE1-CD1 4.26Å; F393-M468 HydrophobicContact CD1-CE 3.97Å; F393-M468 HydrophobicContact CD1-SD 4.23Å; F393-M468 HydrophobicContact CE1-CE 4.28Å; F393-M468 HydrophobicContact CE1-SD 3.92Å; F393-I472 HydrophobicContact CE1-CD1 4.12Å; F393-I472 HydrophobicContact CE1-CG1 4.06Å; F393-I472 HydrophobicContact CZ-CD1 3.74Å; F393-I472 HydrophobicContact CZ-CG1 3.88Å
394I97.4Very high96.2Very high9 Ų914 Ų145%0.0467%0.074CC..Hα-helixtrans-63.2-37.8178.9-69.8163.8000111.8A336 A337 W340 M390 G391 G392 L405A336-I394 HydrophobicContact CB-CD1 4.36Å; A336-I394 HydrophobicContact CB-CG2 4.18Å; A337-I394 HydrophobicContact CB-CG2 4.19Å; W340-I394 HydrophobicContact CG-CD1 4.49Å; M390-I394 WeakPolarHBondContact O-CG1 3.05Å; M390-I394 PolarHBondContact O-N 3.21Å; G391-I394 PolarHBondContact O-N 3.28Å; G392-I394 PolarHBondContact O-N 2.91Å; I394-L405 HydrophobicContact CB-CD1 4.41Å; I394-L405 HydrophobicContact CG1-CD1 3.89Å
395H96.1Very high96.6Very high7 Ų714.5 Ų14.53%0.0328%0.076CC..Hα-helixtrans-68.2-48.2178.9177.349.4000112.6I257 Y260 Y261 A337 G391 G392 F393 P398 W494I257-H395 HydrophobicContact CD1-CB 4.47Å; I257-H395 HydrophobicContact CG1-CB 4.09Å; Y260-H395 AromaticContact CD1-CE1 3.68Å; Y260-H395 AromaticContact CD2-CE1 3.98Å; Y260-H395 AromaticContact CG-CE1 3.68Å; Y261-H395 AromaticContact CE2-ND1 3.84Å; A337-H395 HydrophobicContact CB-CB 4.27Å; G391-H395 WeakPolarHBondContact O-CB 3.5Å; G391-H395 PolarHBondContact O-N 2.72Å; G392-H395 PolarHBondContact O-N 3.07Å; F393-H395 VanDerWaalsContact C-N 3.3Å; F393-H395 PolarHBondContact O-N 3.38Å; H395-P398 WeakPolarHBondContact O-CD 2.98Å; H395-W494 AromaticContact CE1-CZ2 3.83Å; H395-W494 AromaticContact NE2-CZ2 3.98Å; H395-W494 WeakPolarHBondContact O-CH2 3.39Å
396W97Very high96.7Very high0 Ų016.8 Ų16.80%09%0.088CC..Hα-helixtrans-96.8-1.3-175.9-67.7-67.5000114.5F78 L82 M86 M253 H256 G392 F393 P398 L399 F400 W494F78-W396 AromaticContact CD1-CE3 3.88Å; F78-W396 HydrophobicContact CD1-CE3 3.88Å; F78-W396 HydrophobicContact CD1-CZ3 4.35Å; F78-W396 AromaticContact CE1-CE3 3.65Å; F78-W396 HydrophobicContact CE1-CE3 3.65Å; F78-W396 HydrophobicContact CE1-CZ3 4.33Å; L82-W396 HydrophobicContact CD1-CD2 3.72Å; L82-W396 HydrophobicContact CD1-CE3 3.85Å; L82-W396 HydrophobicContact CD1-CG 4.34Å; L82-W396 HydrophobicContact CD1-CH2 4.02Å; L82-W396 HydrophobicContact CD1-CZ2 3.86Å; L82-W396 HydrophobicContact CD1-CZ3 4.02Å; L82-W396 HydrophobicContact CD2-CD2 4.29Å; L82-W396 HydrophobicContact CD2-CG 4.1Å; M86-W396 HydrophobicContact CE-CZ2 3.77Å; M253-W396 HydrophobicContact CB-CH2 4.13Å; M253-W396 HydrophobicContact CB-CZ3 3.98Å; M253-W396 HydrophobicContact CG-CH2 4Å; M253-W396 HydrophobicContact CG-CZ3 3.69Å; M253-W396 HydrophobicContact SD-CZ3 4.06Å; H256-W396 HydrophobicContact CB-CH2 4.07Å; H256-W396 HydrophobicContact CB-CZ2 3.98Å; G392-W396 VanDerWaalsContact CA-CE3 3.49Å; G392-W396 PolarHBondContact O-N 2.92Å; F393-W396 PolarHBondContact O-N 3.33Å; W396-P398 VanDerWaalsContact C-N 3.26Å; W396-L399 HydrophobicContact CB-CB 4.41Å; W396-L399 WeakPolarHBondContact O-CA 3.36Å; W396-L399 VanDerWaalsContact O-CB 3.25Å; W396-L399 WeakPolarHBondContact O-CB 3.47Å; W396-L399 PolarHBondContact O-N 2.94Å; W396-F400 HydrophobicContact CB-CD2 4.35Å; W396-F400 HydrophobicContact CB-CE1 3.9Å; W396-F400 HydrophobicContact CB-CE2 3.68Å; W396-F400 HydrophobicContact CB-CZ 3.42Å; W396-F400 VanDerWaalsContact CB-CZ 3.42Å; W396-F400 HydrophobicContact CG-CZ 4.25Å; W396-F400 WeakPolarHBondContact O-CD2 3.27Å; W396-F400 WeakPolarHBondContact O-CG 3.32Å; W396-F400 PolarHBondContact O-N 3.49Å; W396-W494 AromaticContact CD1-CH2 3.97Å; W396-W494 AromaticContact CD1-CZ2 3.44Å; W396-W494 VanDerWaalsContact CD1-CZ2 3.44Å; W396-W494 HydrophobicContact CG-CZ2 4.41Å; W396-W494 AromaticContact NE1-CZ2 3.89Å
397F97Very high96.7Very high7 Ų719.5 Ų19.53%0.03110%0.1CC..Hα-helixtrans-51-41.7174.1-177.3-99.1000112.9F393 L399 F400 S401 Y403 L405 A475 F476F393-F397 AromaticContact CE1-CD2 3.77Å; F393-F397 HydrophobicContact CE1-CD2 3.77Å; F393-F397 HydrophobicContact CE1-CE2 4.3Å; F393-F397 HydrophobicContact CE1-CG 4.49Å; F393-F397 AromaticContact CE2-CD2 3.8Å; F393-F397 HydrophobicContact CE2-CD2 3.8Å; F393-F397 HydrophobicContact CE2-CE2 4.39Å; 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 4.39Å; F393-F397 VanDerWaalsContact O-CA 3.32Å; F393-F397 WeakPolarHBondContact O-CA 3.35Å; F393-F397 WeakPolarHBondContact O-CB 3.43Å; F393-F397 PolarHBondContact O-N 3Å; F397-L399 VanDerWaalsContact C-N 3.34Å; F397-L399 PolarHBondContact O-N 3.28Å; F397-F400 PolarHBondContact O-N 3.31Å; F397-S401 WeakPolarHBondContact CE1-OG 3.48Å; F397-S401 WeakPolarHBondContact O-CB 3.49Å; F397-S401 PolarHBondContact O-N 3.32Å; F397-S401 PolarHBondContact O-OG 3.24Å; F397-Y403 VanDerWaalsContact CD1-O 3.28Å; F397-Y403 WeakPolarHBondContact CD1-O 3.5Å; F397-L405 HydrophobicContact CB-CD1 4.18Å; F397-L405 HydrophobicContact CB-CG 4.39Å; F397-L405 HydrophobicContact CD1-CD1 4.25Å; F397-L405 HydrophobicContact CD1-CD2 3.83Å; F397-L405 HydrophobicContact CD1-CG 3.57Å; F397-L405 HydrophobicContact CD2-CD2 4.47Å; F397-L405 HydrophobicContact CE1-CD2 3.65Å; F397-L405 HydrophobicContact CE1-CG 3.91Å; F397-L405 HydrophobicContact CE2-CD2 4.32Å; F397-L405 HydrophobicContact CG-CD1 4.12Å; F397-L405 HydrophobicContact CG-CD2 4.23Å; F397-L405 HydrophobicContact CG-CG 3.95Å; F397-L405 HydrophobicContact CZ-CD2 3.91Å; F397-A475 HydrophobicContact CE1-CB 3.77Å; F397-A475 HydrophobicContact CZ-CB 3.9Å; F397-F476 HydrophobicContact CE2-CE2 4.34Å; F397-F476 HydrophobicContact CZ-CE2 4.09Å; F397-F476 HydrophobicContact CZ-CZ 4.48Å
398P95.4Very high96.6Very high22 Ų2223.7 Ų23.714%0.14313%0.126CC..Hα-helixtrans-65.9-35.5175.2-15.830.6000113.1H395 W396 G402 Y403 V482 C498H395-P398 WeakPolarHBondContact O-CD 2.98Å; W396-P398 VanDerWaalsContact C-N 3.26Å; P398-G402 VanDerWaalsContact O-CA 3.24Å; P398-G402 WeakPolarHBondContact O-CA 3.46Å; P398-G402 PolarHBondContact O-N 3.06Å; P398-Y403 WeakPolarHBondContact CA-O 3.5Å; P398-V482 HydrophobicContact CB-CG2 3.41Å; P398-V482 VanDerWaalsContact CB-CG2 3.41Å; P398-C498 WeakPolarHBondContact O-CB 3.07Å
399L95.4Very high96.6Very high0 Ų028 Ų280%014%0.143CC..Hα-helixtrans-62.4-43.4175-174.464.1000111.5L82 L85 W396 F397 E493 W494 P499 P500L82-L399 HydrophobicContact CD2-CD2 3.72Å; L85-L399 HydrophobicContact CD1-CD2 4.2Å; W396-L399 HydrophobicContact CB-CB 4.41Å; W396-L399 WeakPolarHBondContact O-CA 3.36Å; W396-L399 VanDerWaalsContact O-CB 3.25Å; W396-L399 WeakPolarHBondContact O-CB 3.47Å; W396-L399 PolarHBondContact O-N 2.94Å; F397-L399 VanDerWaalsContact C-N 3.34Å; F397-L399 PolarHBondContact O-N 3.28Å; L399-E493 WeakPolarHBondContact CD1-O 3.23Å; L399-E493 HydrophobicContact CD2-CB 4.09Å; L399-E493 HydrophobicContact CD2-CG 4.1Å; L399-W494 HydrophobicContact CB-CE3 4.19Å; L399-W494 HydrophobicContact CB-CH2 3.76Å; L399-W494 HydrophobicContact CB-CZ3 3.54Å; L399-W494 HydrophobicContact CD1-CE3 3.98Å; L399-W494 HydrophobicContact CD1-CZ3 4.2Å; L399-W494 HydrophobicContact CG-CZ3 4.38Å; L399-P499 WeakPolarHBondContact O-CA 3.48Å; L399-P500 HydrophobicContact CD1-CG 4.44Å; L399-P500 WeakPolarHBondContact O-CD 3.28Å
400F96.3Very high96.6Very high30 Ų3027.7 Ų27.713%0.13214%0.141CC..Hα-helixtrans-76.2-36.9-175.8-54-29.1000112.9L20 F78 W81 L82 W396 F397L20-F400 HydrophobicContact CD1-CD2 4.08Å; L20-F400 HydrophobicContact CD1-CE2 4.06Å; F78-F400 HydrophobicContact CD1-CE2 4.16Å; F78-F400 AromaticContact CD1-CZ 3.77Å; F78-F400 HydrophobicContact CD1-CZ 3.77Å; F78-F400 AromaticContact CE1-CE2 3.65Å; F78-F400 HydrophobicContact CE1-CE2 3.65Å; F78-F400 AromaticContact CE1-CZ 3.71Å; F78-F400 HydrophobicContact CE1-CZ 3.71Å; F78-F400 HydrophobicContact CZ-CE2 4.44Å; W81-F400 HydrophobicContact CB-CD1 4.45Å; W81-F400 HydrophobicContact CB-CE1 3.76Å; W81-F400 HydrophobicContact CB-CZ 4.35Å; 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 3.91Å; W81-F400 AromaticContact CE3-CD1 3.72Å; W81-F400 HydrophobicContact CE3-CD1 3.72Å; W81-F400 HydrophobicContact CE3-CE1 4.04Å; W81-F400 AromaticContact CG-CD1 3.92Å; W81-F400 HydrophobicContact CG-CD1 3.92Å; W81-F400 AromaticContact CG-CE1 3.69Å; W81-F400 HydrophobicContact CG-CE1 3.69Å; W81-F400 HydrophobicContact CG-CZ 4.43Å; W81-F400 HydrophobicContact CH2-CD1 4.42Å; W81-F400 HydrophobicContact CZ2-CB 4.45Å; W81-F400 HydrophobicContact CZ2-CD1 4.32Å; W81-F400 HydrophobicContact CZ3-CD1 4.15Å; L82-F400 HydrophobicContact CD2-CE1 4.15Å; L82-F400 HydrophobicContact CD2-CZ 4.47Å; W396-F400 HydrophobicContact CB-CD2 4.35Å; W396-F400 HydrophobicContact CB-CE1 3.9Å; W396-F400 HydrophobicContact CB-CE2 3.68Å; W396-F400 HydrophobicContact CB-CZ 3.42Å; W396-F400 VanDerWaalsContact CB-CZ 3.42Å; W396-F400 HydrophobicContact CG-CZ 4.25Å; W396-F400 WeakPolarHBondContact O-CD2 3.27Å; W396-F400 WeakPolarHBondContact O-CG 3.32Å; W396-F400 PolarHBondContact O-N 3.49Å; F397-F400 PolarHBondContact O-N 3.31Å
401S95.9Very high96.6Very high21 Ų2130 Ų3015%0.14715%0.15CC..Hα-helixtrans-111.4-21.2-16970.20000114.9F397 Y403F397-S401 WeakPolarHBondContact CE1-OG 3.48Å; F397-S401 WeakPolarHBondContact O-CB 3.49Å; F397-S401 PolarHBondContact O-N 3.32Å; F397-S401 PolarHBondContact O-OG 3.24Å; S401-Y403 PolarHBondContact O-N 3.24Å; S401-Y403 PolarHBondContact OG-N 3.29Å; S401-Y403 VanDerWaalsContact OG-N 3.08Å; S401-Y403 PolarHBondContact OG-O 3.05Å
402G94.6Very high96.6Very high7 Ų733.5 Ų33.57%0.07217%0.168CC..SBendtrans75.41.5-167.300000115.1P398 V482 C498P398-G402 VanDerWaalsContact O-CA 3.24Å; P398-G402 WeakPolarHBondContact O-CA 3.46Å; P398-G402 PolarHBondContact O-N 3.06Å; G402-V482 PolarHBondContact O-N 2.84Å; G402-C498 VanDerWaalsContact CA-O 3.31Å; G402-C498 WeakPolarHBondContact CA-O 3.46Å
403Y95.4Very high96.7Very high50 Ų5033.6 Ų33.620%0.19617%0.169CC..BIsolated β-bridgetrans-114.5160.1-179.1-57.9-57.7000112.7F397 P398 S401 F476 K479 R480 K481F397-Y403 VanDerWaalsContact CD1-O 3.28Å; F397-Y403 WeakPolarHBondContact CD1-O 3.5Å; P398-Y403 WeakPolarHBondContact CA-O 3.5Å; S401-Y403 PolarHBondContact O-N 3.24Å; S401-Y403 PolarHBondContact OG-N 3.29Å; S401-Y403 VanDerWaalsContact OG-N 3.08Å; S401-Y403 PolarHBondContact OG-O 3.05Å; Y403-F476 AromaticContact CD2-CD1 3.64Å; Y403-F476 HydrophobicContact CD2-CD1 3.64Å; Y403-F476 AromaticContact CD2-CE1 3.67Å; Y403-F476 HydrophobicContact CD2-CE1 3.67Å; Y403-F476 AromaticContact CE2-CD1 3.6Å; Y403-F476 HydrophobicContact CE2-CD1 3.6Å; Y403-F476 AromaticContact CE2-CE1 3.77Å; Y403-F476 HydrophobicContact CE2-CE1 3.77Å; Y403-K479 HydrophobicContact CD1-CB 4.31Å; Y403-K479 HydrophobicContact CE1-CB 3.71Å; Y403-K479 HydrophobicContact CE1-CG 4.18Å; Y403-R480 CarbonylContact C-O 3.47Å; Y403-R480 WeakPolarHBondContact CA-O 3.27Å; Y403-K481 HydrophobicContact CD1-CG 4.37Å; Y403-K481 HydrophobicContact CE1-CG 4.21Å
404T95.1Very high96.7Very high45 Ų4532.9 Ų32.928%0.27617%0.166SC..  trans-108.8138.1178.360.50000112.2R480 V482T404-R480 PolarHBondContact N-O 2.96Å; T404-R480 PolarHBondContact O-NE 2.93Å; T404-R480 PolarHBondContact O-NH2 2.84Å; T404-R480 WeakPolarHBondContact OG1-CB 3.44Å; T404-R480 PolarHBondContact OG1-O 2.7Å; T404-V482 HydrophobicContact CG2-CG2 3.91Å
405L95.8Very high96.7Very high11 Ų1135.7 Ų35.76%0.05818%0.184CC..  trans-74.5141.8169.1-61.8173000109.9F393 I394 F397 Q407 M471 A475F393-L405 HydrophobicContact CD1-CD1 4.49Å; F393-L405 HydrophobicContact CE1-CD1 4.26Å; I394-L405 HydrophobicContact CB-CD1 4.41Å; I394-L405 HydrophobicContact CG1-CD1 3.89Å; F397-L405 HydrophobicContact CB-CD1 4.18Å; F397-L405 HydrophobicContact CB-CG 4.39Å; F397-L405 HydrophobicContact CD1-CD1 4.25Å; F397-L405 HydrophobicContact CD1-CD2 3.83Å; F397-L405 HydrophobicContact CD1-CG 3.57Å; F397-L405 HydrophobicContact CD2-CD2 4.47Å; F397-L405 HydrophobicContact CE1-CD2 3.65Å; F397-L405 HydrophobicContact CE1-CG 3.91Å; F397-L405 HydrophobicContact CE2-CD2 4.32Å; F397-L405 HydrophobicContact CG-CD1 4.12Å; F397-L405 HydrophobicContact CG-CD2 4.23Å; F397-L405 HydrophobicContact CG-CG 3.95Å; F397-L405 HydrophobicContact CZ-CD2 3.91Å; L405-Q407 PolarHBondContact O-N 3.12Å; L405-M471 HydrophobicContact CB-CE 4.36Å; L405-M471 HydrophobicContact CD1-CE 4.04Å; L405-M471 HydrophobicContact CD2-CB 4.43Å; L405-M471 HydrophobicContact CD2-CE 4.39Å; L405-M471 HydrophobicContact CG-CE 4.5Å; L405-A475 HydrophobicContact CD2-CB 3.97Å
406D96.4Very high96.8Very high47 Ų4737.5 Ų37.525%0.25119%0.193SC..  trans-63.9125.6170.9-177.6-84.9000110.3T408 Y409 A410D406-T408 VanDerWaalsContact C-N 3.3Å; D406-T408 PolarHBondContact O-N 2.65Å; D406-T408 VanDerWaalsContact OD1-CA 3.29Å; D406-T408 WeakPolarHBondContact OD1-CA 3.49Å; D406-T408 WeakPolarHBondContact OD1-CB 3.25Å; D406-T408 PolarHBondContact OD1-N 2.88Å; D406-T408 PolarHBondContact OD1-OG1 3.38Å; D406-Y409 HydrophobicContact CB-CD2 3.69Å; D406-Y409 HydrophobicContact CB-CE2 4.4Å; D406-Y409 HydrophobicContact CB-CG 4.4Å; D406-Y409 PolarHBondContact O-N 2.93Å; D406-Y409 PolarHBondContact OD1-N 2.68Å; D406-A410 WeakPolarHBondContact O-CB 3.17Å; D406-A410 PolarHBondContact O-N 3.15Å
407Q94.9Very high96.9Very high76 Ų7638.3 Ų38.336%0.35520%0.197SC..Hα-helixtrans-69.7-26.6-175.6-74.2-64.5-46.100113L405 K411L405-Q407 PolarHBondContact O-N 3.12Å; Q407-K411 WeakPolarHBondContact O-CB 3.43Å; Q407-K411 WeakPolarHBondContact O-CG 3.12Å; Q407-K411 PolarHBondContact O-N 3.46Å; Q407-K411 VanDerWaalsContact O-N 3.09Å
408T97.1Very high96.9Very high90 Ų9040.7 Ų40.755%0.55221%0.207SC*.Hα-helixtrans-69.6-51.7177.3-49.60000109.3D406 A410 K411 I412D406-T408 VanDerWaalsContact C-N 3.3Å; D406-T408 PolarHBondContact O-N 2.65Å; D406-T408 VanDerWaalsContact OD1-CA 3.29Å; D406-T408 WeakPolarHBondContact OD1-CA 3.49Å; D406-T408 WeakPolarHBondContact OD1-CB 3.25Å; D406-T408 PolarHBondContact OD1-N 2.88Å; D406-T408 PolarHBondContact OD1-OG1 3.38Å; T408-A410 VanDerWaalsContact C-N 3.32Å; T408-A410 PolarHBondContact O-N 3.3Å; T408-K411 PolarHBondContact O-N 3.46Å; T408-I412 HydrophobicContact CG2-CD1 4.1Å; T408-I412 WeakPolarHBondContact O-CG1 3.36Å; T408-I412 PolarHBondContact O-N 2.91Å
409Y97.9Very high97.1Very high90 Ų9043.5 Ų43.535%0.35322%0.22SC..Hα-helixtrans-61.9-39.6176.4-63-43.1000112.1D406 K411 I412 H413 F470 E474D406-Y409 HydrophobicContact CB-CD2 3.69Å; D406-Y409 HydrophobicContact CB-CE2 4.4Å; D406-Y409 HydrophobicContact CB-CG 4.4Å; D406-Y409 PolarHBondContact O-N 2.93Å; D406-Y409 PolarHBondContact OD1-N 2.68Å; Y409-K411 VanDerWaalsContact C-N 3.34Å; Y409-K411 PolarHBondContact O-N 2.97Å; Y409-I412 HydrophobicContact CD1-CD1 4.48Å; Y409-I412 PolarHBondContact O-N 2.95Å; Y409-H413 WeakPolarHBondContact O-CB 3.47Å; Y409-H413 PolarHBondContact O-N 3.46Å; Y409-F470 HydrophobicContact CD2-CE1 4.11Å; Y409-F470 HydrophobicContact CE1-CE1 4.5Å; Y409-F470 AromaticContact CE2-CE1 3.98Å; Y409-F470 HydrophobicContact CE2-CE1 3.98Å; Y409-F470 HydrophobicContact CG-CE1 4.46Å; Y409-E474 HydrophobicContact CE2-CG 4.49Å
410A98Very high97.2Very high0 Ų043.5 Ų43.50%022%0.22CC..Hα-helixtrans-63.6-35.9177.800000113.6A336 D406 T408 F414 M471A336-A410 HydrophobicContact CB-CB 3.47Å; A336-A410 VanDerWaalsContact CB-CB 3.47Å; D406-A410 WeakPolarHBondContact O-CB 3.17Å; D406-A410 PolarHBondContact O-N 3.15Å; T408-A410 VanDerWaalsContact C-N 3.32Å; T408-A410 PolarHBondContact O-N 3.3Å; A410-F414 PolarHBondContact O-N 2.95Å; A410-F414 VanDerWaalsContact O-N 3.1Å; A410-M471 HydrophobicContact CB-CE 3.62Å
411K98.5Very high97.3Very high79 Ų7942.2 Ų42.234%0.34322%0.215SC..Hα-helixtrans-72.7-38.3174.5-72.2173.8-179.4-174.80112.4W334 A336 L339 Q407 T408 Y409 H413 F414 T415W334-K411 WeakPolarHBondContact O-CE 3.2Å; W334-K411 PolarHBondContact O-NZ 3.3Å; A336-K411 HydrophobicContact CB-CG 4.2Å; L339-K411 HydrophobicContact CD1-CB 4.35Å; L339-K411 HydrophobicContact CD1-CG 3.88Å; Q407-K411 WeakPolarHBondContact O-CB 3.43Å; Q407-K411 WeakPolarHBondContact O-CG 3.12Å; Q407-K411 PolarHBondContact O-N 3.46Å; Q407-K411 VanDerWaalsContact O-N 3.09Å; T408-K411 PolarHBondContact O-N 3.46Å; Y409-K411 VanDerWaalsContact C-N 3.34Å; Y409-K411 PolarHBondContact O-N 2.97Å; K411-H413 VanDerWaalsContact C-N 3.35Å; K411-F414 PolarHBondContact O-N 3.44Å; K411-T415 PolarHBondContact O-N 3.36Å; K411-T415 PolarHBondContact O-OG1 3.04Å
412I98.5Very high97.4Very high74 Ų7442.8 Ų42.838%0.37922%0.216SC..Hα-helixtrans-62.4-45.9173.3-67.2167.1000109.6T408 Y409 F414 T415 I416 L467T408-I412 HydrophobicContact CG2-CD1 4.1Å; T408-I412 WeakPolarHBondContact O-CG1 3.36Å; T408-I412 PolarHBondContact O-N 2.91Å; Y409-I412 HydrophobicContact CD1-CD1 4.48Å; Y409-I412 PolarHBondContact O-N 2.95Å; I412-F414 PolarHBondContact O-N 3.07Å; I412-T415 PolarHBondContact O-N 2.94Å; I412-T415 VanDerWaalsContact O-N 3.08Å; 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 3.42Å; I412-L467 HydrophobicContact CB-CD2 4.32Å; I412-L467 HydrophobicContact CG2-CD2 3.78Å
413H98.6Very high97.5Very high1 Ų145.1 Ų45.11%0.00523%0.227CC..Hα-helixtrans-56.2-48.4176.5175.2-116.3000112.3W340 Y409 K411 T415 M417 A464 L467 M468 M471W340-H413 AromaticContact CH2-CE1 3.91Å; W340-H413 AromaticContact CZ2-CE1 3.47Å; W340-H413 VanDerWaalsContact CZ2-CE1 3.47Å; W340-H413 WeakPolarHBondContact CZ2-CE1 3.22Å; W340-H413 AromaticContact CZ2-ND1 3.44Å; W340-H413 WeakPolarHBondContact CZ2-ND1 3.48Å; Y409-H413 WeakPolarHBondContact O-CB 3.47Å; Y409-H413 PolarHBondContact O-N 3.46Å; K411-H413 VanDerWaalsContact C-N 3.35Å; H413-T415 VanDerWaalsContact C-N 3.34Å; H413-T415 PolarHBondContact O-N 3.33Å; H413-M417 WeakPolarHBondContact O-CB 3.24Å; H413-M417 PolarHBondContact O-N 3.33Å; H413-A464 PolarHBondContact CD2-O 3.23Å; H413-A464 PolarHBondContact NE2-O 3.49Å; H413-L467 HydrophobicContact CB-CD2 3.79Å; H413-L467 HydrophobicContact CB-CG 4.18Å; H413-M468 VanDerWaalsContact CE1-CE 3.46Å; H413-M468 WeakPolarHBondContact CE1-CE 3.3Å; H413-M471 HydrophobicContact CB-SD 3.62Å
414F98.5Very high97.7Very high24 Ų2442.9 Ų42.911%0.10522%0.218CC..Hα-helixtrans-55.1-49.4172.5169.1-100.1000112.1L339 W340 F387 A410 K411 I412 I416 M417 F418L339-F414 VanDerWaalsContact C-CE2 3.5Å; L339-F414 HydrophobicContact CB-CD1 3.67Å; L339-F414 HydrophobicContact CB-CD2 4.11Å; L339-F414 HydrophobicContact CB-CE1 3.77Å; L339-F414 HydrophobicContact CB-CE2 4.19Å; L339-F414 HydrophobicContact CB-CG 3.84Å; L339-F414 HydrophobicContact CB-CZ 4.03Å; L339-F414 HydrophobicContact CD1-CD1 3.86Å; L339-F414 HydrophobicContact CD1-CE1 4.35Å; L339-F414 HydrophobicContact CD1-CG 4.46Å; L339-F414 HydrophobicContact CG-CD1 4.35Å; L339-F414 HydrophobicContact CG-CE1 4.49Å; L339-F414 WeakPolarHBondContact O-CE2 3.29Å; L339-F414 WeakPolarHBondContact O-CZ 3.38Å; W340-F414 AromaticContact CD2-CD2 3.67Å; W340-F414 HydrophobicContact CD2-CD2 3.67Å; W340-F414 HydrophobicContact CD2-CE2 4.49Å; W340-F414 AromaticContact CE2-CD2 3.82Å; W340-F414 AromaticContact CE3-CD2 3.98Å; W340-F414 HydrophobicContact CE3-CD2 3.98Å; W340-F414 AromaticContact CG-CD2 3.98Å; W340-F414 HydrophobicContact CG-CD2 3.98Å; W340-F414 VanDerWaalsContact CZ2-CA 3.5Å; W340-F414 HydrophobicContact CZ2-CB 3.99Å; W340-F414 HydrophobicContact CZ2-CD2 4.25Å; W340-F414 HydrophobicContact CZ3-CD2 4.42Å; F387-F414 HydrophobicContact CE1-CE2 4.17Å; A410-F414 PolarHBondContact O-N 2.95Å; A410-F414 VanDerWaalsContact O-N 3.1Å; K411-F414 PolarHBondContact O-N 3.44Å; I412-F414 PolarHBondContact O-N 3.07Å; F414-I416 PolarHBondContact O-N 2.9Å; F414-M417 PolarHBondContact O-N 2.93Å; F414-F418 HydrophobicContact CE1-CB 4.41Å; F414-F418 HydrophobicContact CE2-CB 4.34Å; F414-F418 HydrophobicContact CE2-CD2 4.08Å; F414-F418 HydrophobicContact CZ-CB 4.18Å; F414-F418 AromaticContact CZ-CD2 3.75Å; F414-F418 HydrophobicContact CZ-CD2 3.75Å; F414-F418 HydrophobicContact CZ-CE2 4.47Å; F414-F418 HydrophobicContact CZ-CG 4.13Å; F414-F418 WeakPolarHBondContact O-CB 3.49Å; F414-F418 PolarHBondContact O-N 3.04Å
415T98.6Very high97.8Very high69 Ų6941.9 Ų41.942%0.42321%0.21SC..Hα-helixtrans-63-46-174.4-54.80000111.6K411 I412 H413 F418 I419K411-T415 PolarHBondContact O-N 3.36Å; K411-T415 PolarHBondContact O-OG1 3.04Å; I412-T415 PolarHBondContact O-N 2.94Å; I412-T415 VanDerWaalsContact O-N 3.08Å; H413-T415 VanDerWaalsContact C-N 3.34Å; H413-T415 PolarHBondContact O-N 3.33Å; T415-F418 PolarHBondContact O-N 3.47Å; T415-I419 HydrophobicContact CG2-CD1 4.02Å; T415-I419 WeakPolarHBondContact O-CG1 3.25Å; T415-I419 PolarHBondContact O-N 2.99Å
416I98.5Very high97.9Very high45 Ų4546.2 Ų46.223%0.23123%0.229CC..Hα-helixtrans-63.8-47.4178.4-63.7173.9000110.1I412 F414 F418 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 3.42Å; F414-I416 PolarHBondContact O-N 2.9Å; I416-F418 PolarHBondContact O-N 2.9Å; I416-I419 PolarHBondContact O-N 3.31Å; I416-G420 PolarHBondContact O-N 2.73Å; I416-I460 HydrophobicContact CG2-CG2 3.87Å; I416-I460 WeakPolarHBondContact CG2-O 3.4Å; I416-T463 WeakPolarHBondContact CG2-OG1 3.31Å; I416-A464 HydrophobicContact CB-CB 4.22Å; I416-A464 HydrophobicContact CG2-CB 3.85Å; I416-L467 HydrophobicContact CD1-CD2 4.11Å
417M98.1Very high98Very high17 Ų1744.1 Ų44.18%0.08422%0.218CC..Hα-helixtrans-61.6-47178.6-173.964.98000111.1W340 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 4.47Å; W340-M417 HydrophobicContact CZ3-CB 4.45Å; W340-M417 HydrophobicContact CZ3-CG 4.15Å; F387-M417 HydrophobicContact CE2-CG 4.16Å; F387-M417 HydrophobicContact CZ-CG 4.41Å; H413-M417 WeakPolarHBondContact O-CB 3.24Å; H413-M417 PolarHBondContact O-N 3.33Å; F414-M417 PolarHBondContact O-N 2.93Å; M417-I419 VanDerWaalsContact C-N 3.33Å; M417-I419 PolarHBondContact O-N 3.43Å; M417-G420 PolarHBondContact O-N 2.97Å; M417-V421 HydrophobicContact CG-CG1 4.07Å; M417-V421 WeakPolarHBondContact O-CG1 3.44Å; M417-V421 WeakPolarHBondContact O-CG2 3.43Å; M417-V421 PolarHBondContact O-N 2.9Å; M417-V421 HydrophobicContact SD-CG1 3.66Å; M417-A464 HydrophobicContact CB-CB 3.82Å; M417-A464 HydrophobicContact CE-CB 3.72Å; M417-A464 HydrophobicContact SD-CB 4.18Å; M417-V465 HydrophobicContact CE-CG2 4.13Å
418F98.3Very high98.2Very high57 Ų5740.7 Ų40.725%0.2520%0.202CC..Hα-helixtrans-57.3-45.4-179.3-176-87.7000111.9F346 L347 F387 F414 T415 I416 N422F346-F418 HydrophobicContact CD1-CE2 4.42Å; F346-F418 HydrophobicContact CD1-CZ 4.19Å; F346-F418 HydrophobicContact CE1-CZ 4.37Å; L347-F418 HydrophobicContact CD1-CD2 3.8Å; L347-F418 HydrophobicContact CD1-CE2 3.57Å; L347-F418 HydrophobicContact CD1-CZ 4.46Å; L347-F418 HydrophobicContact CD2-CE2 4.17Å; L347-F418 HydrophobicContact CD2-CZ 4.34Å; L347-F418 HydrophobicContact CG-CE2 3.94Å; F387-F418 HydrophobicContact CE1-CD2 4.1Å; F387-F418 HydrophobicContact CZ-CD2 4.47Å; F414-F418 HydrophobicContact CE1-CB 4.41Å; F414-F418 HydrophobicContact CE2-CB 4.34Å; F414-F418 HydrophobicContact CE2-CD2 4.08Å; F414-F418 HydrophobicContact CZ-CB 4.18Å; F414-F418 AromaticContact CZ-CD2 3.75Å; F414-F418 HydrophobicContact CZ-CD2 3.75Å; F414-F418 HydrophobicContact CZ-CE2 4.47Å; F414-F418 HydrophobicContact CZ-CG 4.13Å; F414-F418 WeakPolarHBondContact O-CB 3.49Å; F414-F418 PolarHBondContact O-N 3.04Å; T415-F418 PolarHBondContact O-N 3.47Å; I416-F418 PolarHBondContact O-N 2.9Å; F418-N422 PolarHBondContact O-N 3.14Å; F418-N422 PolarHBondContact O-ND2 3.21Å
419I98.4Very high98.3Very high81 Ų8137 Ų3742%0.41518%0.178SC..Hα-helixtrans-66.5-48.2176.1-67.5169.1000110.5T415 I416 M417 V421 N422 L423T415-I419 HydrophobicContact CG2-CD1 4.02Å; T415-I419 WeakPolarHBondContact O-CG1 3.25Å; T415-I419 PolarHBondContact O-N 2.99Å; I416-I419 PolarHBondContact O-N 3.31Å; M417-I419 VanDerWaalsContact C-N 3.33Å; M417-I419 PolarHBondContact O-N 3.43Å; I419-V421 PolarHBondContact O-N 3Å; I419-N422 PolarHBondContact O-N 3.39Å; I419-L423 HydrophobicContact CG2-CD1 3.74Å; I419-L423 HydrophobicContact CG2-CG 4.31Å; I419-L423 WeakPolarHBondContact O-CB 3.42Å; I419-L423 WeakPolarHBondContact O-CG 3.31Å; I419-L423 PolarHBondContact O-N 2.87Å
420G98.2Very high98.3Very high0 Ų036.6 Ų36.60%018%0.178CC..Hα-helixtrans-58.8-49.4-177.200000113.2I416 M417 N422 L423 T424 G457 S461I416-G420 PolarHBondContact O-N 2.73Å; M417-G420 PolarHBondContact O-N 2.97Å; G420-N422 PolarHBondContact O-N 2.79Å; G420-L423 PolarHBondContact O-N 3.28Å; G420-T424 WeakPolarHBondContact O-CB 3.5Å; G420-T424 PolarHBondContact O-N 2.92Å; G420-T424 PolarHBondContact O-OG1 3.24Å; G420-G457 CarbonylContact C-O 3.58Å; G420-G457 WeakPolarHBondContact CA-O 3.32Å; G420-G457 CarbonylContact O-C 3.45Å; G420-G457 WeakPolarHBondContact O-CA 3.41Å; G420-S461 WeakPolarHBondContact CA-OG 3.37Å
421V97.3Very high98.3Very high3 Ų336.6 Ų36.62%0.01818%0.178CC..Hα-helixtrans-67.7-36.9-178.3-59.80000112.2M383 F387 M417 I419 T424 F425 S461M383-V421 HydrophobicContact CE-CB 4.47Å; M383-V421 HydrophobicContact CG-CB 4.33Å; M383-V421 HydrophobicContact CG-CG2 3.78Å; M383-V421 HydrophobicContact SD-CG2 3.94Å; F387-V421 HydrophobicContact CE2-CG1 4.49Å; F387-V421 HydrophobicContact CE2-CG2 4Å; F387-V421 HydrophobicContact CZ-CG2 3.9Å; M417-V421 HydrophobicContact CG-CG1 4.07Å; M417-V421 WeakPolarHBondContact O-CG1 3.44Å; M417-V421 WeakPolarHBondContact O-CG2 3.43Å; M417-V421 PolarHBondContact O-N 2.9Å; M417-V421 HydrophobicContact SD-CG1 3.66Å; I419-V421 PolarHBondContact O-N 3Å; V421-T424 WeakPolarHBondContact O-CB 3.14Å; V421-T424 PolarHBondContact O-N 2.72Å; V421-F425 HydrophobicContact CB-CD2 4.23Å; V421-F425 HydrophobicContact CB-CE2 4.36Å; V421-F425 WeakPolarHBondContact O-CD2 3.39Å; V421-F425 PolarHBondContact O-N 3.24Å; V421-S461 PolarHBondContact N-OG 3.21Å
422N97.9Very high98.3Very high32 Ų3232.9 Ų32.917%0.17116%0.162CC..Hα-helixtrans-68.6-43.4176.3-82.4-82000111.2L347 Y379 F418 I419 G420 T424 F425 F426L347-N422 WeakPolarHBondContact CD2-ND2 3.21Å; L347-N422 VanDerWaalsContact CD2-OD1 3.24Å; L347-N422 WeakPolarHBondContact CD2-OD1 3.32Å; Y379-N422 PolarHBondContact OH-OD1 3.45Å; F418-N422 PolarHBondContact O-N 3.14Å; F418-N422 PolarHBondContact O-ND2 3.21Å; I419-N422 PolarHBondContact O-N 3.39Å; G420-N422 PolarHBondContact O-N 2.79Å; N422-T424 PolarHBondContact O-N 2.98Å; N422-F425 PolarHBondContact O-N 2.83Å; N422-F426 WeakPolarHBondContact O-CA 3.25Å; N422-F426 WeakPolarHBondContact O-CB 3.27Å; N422-F426 PolarHBondContact O-N 2.96Å
423L97.9Very high98.3Very high56 Ų5634.6 Ų34.629%0.29317%0.172SC..Hα-helixtrans-63-29.8173.3-72.8177.1000112.2I419 G420 P427 L453 S454 I460I419-L423 HydrophobicContact CG2-CD1 3.74Å; I419-L423 HydrophobicContact CG2-CG 4.31Å; I419-L423 WeakPolarHBondContact O-CB 3.42Å; I419-L423 WeakPolarHBondContact O-CG 3.31Å; I419-L423 PolarHBondContact O-N 2.87Å; G420-L423 PolarHBondContact O-N 3.28Å; L423-P427 WeakPolarHBondContact O-CD 3.36Å; L423-P427 VanDerWaalsContact O-CG 3.25Å; L423-P427 WeakPolarHBondContact O-CG 3.37Å; L423-L453 HydrophobicContact CD2-CD1 4.37Å; L423-L453 HydrophobicContact CD2-CD2 4.14Å; L423-L453 HydrophobicContact CD2-CG 4.25Å; L423-S454 WeakPolarHBondContact O-CA 3.44Å; L423-I460 HydrophobicContact CD1-CD1 3.74Å
424T98.3Very high98.2Very high4 Ų437.3 Ų37.33%0.02519%0.191CC..Hα-helixtrans-70.5-56.8175.8-52.30000111.5G420 V421 N422 S454 G457 S458G420-T424 WeakPolarHBondContact O-CB 3.5Å; G420-T424 PolarHBondContact O-N 2.92Å; G420-T424 PolarHBondContact O-OG1 3.24Å; V421-T424 WeakPolarHBondContact O-CB 3.14Å; V421-T424 PolarHBondContact O-N 2.72Å; N422-T424 PolarHBondContact O-N 2.98Å; T424-S454 WeakPolarHBondContact CA-O 3.33Å; T424-S454 VanDerWaalsContact O-CB 3.25Å; T424-S454 WeakPolarHBondContact O-CB 3.35Å; T424-S454 PolarHBondContact O-OG 3.07Å; T424-G457 WeakPolarHBondContact OG1-CA 3.33Å; T424-G457 PolarHBondContact OG1-O 2.8Å; T424-S458 WeakPolarHBondContact OG1-CA 3.2Å; T424-S458 PolarHBondContact OG1-N 3.14Å
425F98.4Very high98.2Very high24 Ų2438 Ų3811%0.10521%0.205CC..Hα-helixtrans-100.4-23.8-163.9-59.2-63.8000113.9H378 Y379 M383 V421 N422 Q428H378-F425 HydrophobicContact CB-CB 4.45Å; H378-F425 HydrophobicContact CB-CD1 3.42Å; H378-F425 VanDerWaalsContact CB-CD1 3.42Å; H378-F425 HydrophobicContact CB-CD2 4.01Å; H378-F425 HydrophobicContact CB-CE1 3.5Å; H378-F425 VanDerWaalsContact CB-CE1 3.5Å; H378-F425 HydrophobicContact CB-CE2 4.06Å; H378-F425 HydrophobicContact CB-CG 3.7Å; H378-F425 HydrophobicContact CB-CZ 3.82Å; H378-F425 AromaticContact CD2-CE1 3.2Å; H378-F425 WeakPolarHBondContact CD2-CE1 3.31Å; H378-F425 AromaticContact CD2-CZ 3.3Å; H378-F425 WeakPolarHBondContact CD2-CZ 3.43Å; H378-F425 AromaticContact CG-CD1 3.67Å; H378-F425 AromaticContact CG-CE1 3.29Å; H378-F425 AromaticContact CG-CZ 3.74Å; H378-F425 AromaticContact NE2-CE1 3.9Å; Y379-F425 HydrophobicContact CD2-CB 4Å; Y379-F425 HydrophobicContact CE2-CB 3.69Å; M383-F425 HydrophobicContact CE-CB 3.81Å; M383-F425 HydrophobicContact CE-CD2 3.55Å; M383-F425 HydrophobicContact CE-CG 4.06Å; V421-F425 HydrophobicContact CB-CD2 4.23Å; V421-F425 HydrophobicContact CB-CE2 4.36Å; V421-F425 WeakPolarHBondContact O-CD2 3.39Å; V421-F425 PolarHBondContact O-N 3.24Å; N422-F425 PolarHBondContact O-N 2.83Å; F425-Q428 WeakPolarHBondContact O-CB 3.49Å; F425-Q428 PolarHBondContact O-N 3.37Å
426F98.3Very high98.1Very high101 Ų10134.8 Ų34.844%0.44319%0.185SC..Hα-helixtrans-61.2-45.9177.3-164.8-106.1000112Y379 N422 Q428 H429 F430Y379-F426 WeakPolarHBondContact OH-CB 3.29Å; Y379-F426 WeakPolarHBondContact OH-CD2 3.4Å; N422-F426 WeakPolarHBondContact O-CA 3.25Å; N422-F426 WeakPolarHBondContact O-CB 3.27Å; N422-F426 PolarHBondContact O-N 2.96Å; F426-Q428 PolarHBondContact O-N 2.87Å; F426-Q428 VanDerWaalsContact O-N 3.16Å; F426-H429 PolarHBondContact O-N 3.24Å; F426-H429 VanDerWaalsContact O-N 3.17Å; F426-H429 PolarHBondContact O-ND1 2.94Å; F426-F430 AromaticContact CD1-CE2 3.92Å; F426-F430 HydrophobicContact CD1-CE2 3.92Å; F426-F430 HydrophobicContact CD1-CZ 4.44Å; F426-F430 AromaticContact CE1-CE2 3.69Å; F426-F430 HydrophobicContact CE1-CE2 3.69Å; F426-F430 AromaticContact CE1-CZ 3.76Å; F426-F430 HydrophobicContact CE1-CZ 3.76Å; F426-F430 HydrophobicContact CZ-CZ 4.32Å
427P98.4Very high98.1Very high3 Ų334.9 Ų34.92%0.01919%0.189CC..Hα-helixtrans-60.6-25.7176.7-27.339.4000114.3L423 H429 F430 L431 W450 L453L423-P427 WeakPolarHBondContact O-CD 3.36Å; L423-P427 VanDerWaalsContact O-CG 3.25Å; L423-P427 WeakPolarHBondContact O-CG 3.37Å; P427-H429 PolarHBondContact O-N 3.28Å; P427-F430 WeakPolarHBondContact O-CB 3.44Å; P427-F430 PolarHBondContact O-N 3.15Å; P427-L431 PolarHBondContact O-N 2.67Å; P427-W450 HydrophobicContact CB-CB 4.07Å; P427-W450 HydrophobicContact CB-CD2 4.37Å; P427-W450 HydrophobicContact CB-CE3 3.89Å; P427-W450 HydrophobicContact CB-CG 4.49Å; P427-W450 HydrophobicContact CG-CE3 4.43Å; P427-L453 HydrophobicContact CB-CD2 4.39Å; P427-L453 HydrophobicContact CG-CB 4.23Å; P427-L453 HydrophobicContact CG-CD2 3.41Å; P427-L453 VanDerWaalsContact CG-CD2 3.41Å; P427-L453 HydrophobicContact CG-CG 4.14Å
428Q98.6Very high98.1Very high5 Ų536.2 Ų36.22%0.02319%0.193CC..Hα-helixtrans-67.9-24.2-179.2-64.9-177.45.800112.6Y371 A375 F425 F426 F430 L431 G432 S454Y371-Q428 CarbonylContact C-O 3.28Å; Y371-Q428 WeakPolarHBondContact CB-O 3.41Å; Y371-Q428 HydrophobicContact CD1-CB 4.04Å; Y371-Q428 HydrophobicContact CD1-CG 3.83Å; Y371-Q428 HydrophobicContact CE1-CG 4.42Å; A375-Q428 HydrophobicContact CB-CB 3.71Å; F425-Q428 WeakPolarHBondContact O-CB 3.49Å; F425-Q428 PolarHBondContact O-N 3.37Å; F426-Q428 PolarHBondContact O-N 2.87Å; F426-Q428 VanDerWaalsContact O-N 3.16Å; Q428-F430 VanDerWaalsContact C-N 3.34Å; Q428-L431 HydrophobicContact CG-CD1 4.28Å; Q428-L431 PolarHBondContact O-N 3.36Å; Q428-G432 PolarHBondContact O-N 3.44Å; Q428-S454 PolarHBondContact NE2-OG 3.33Å
429H98.6Very high97.9Very high13 Ų1336.7 Ų36.76%0.0619%0.193CC..Hα-helixtrans-62.9-42.1168.6-6499.4000111.2Y372 A375 Y379 F426 P427 G432 L433Y372-H429 HydrophobicContact CD2-CB 4.17Å; Y372-H429 AromaticContact CD2-CD2 3.97Å; Y372-H429 HydrophobicContact CE2-CB 4.25Å; Y372-H429 AromaticContact CE2-CD2 3.83Å; A375-H429 VanDerWaalsContact CB-CE1 3.48Å; A375-H429 WeakPolarHBondContact CB-CE1 3.35Å; A375-H429 WeakPolarHBondContact CB-NE2 3.45Å; Y379-H429 AromaticContact CD2-CE1 3.6Å; Y379-H429 AromaticContact CE2-CE1 3.59Å; F426-H429 PolarHBondContact O-N 3.24Å; F426-H429 VanDerWaalsContact O-N 3.17Å; F426-H429 PolarHBondContact O-ND1 2.94Å; P427-H429 PolarHBondContact O-N 3.28Å; H429-G432 PolarHBondContact O-N 3.34Å; H429-L433 WeakPolarHBondContact O-CB 3.47Å; H429-L433 VanDerWaalsContact O-CG 3.25Å; H429-L433 WeakPolarHBondContact O-CG 3.36Å; H429-L433 PolarHBondContact O-N 3.44Å
430F98.4Very high97.8Very high80 Ų8039.5 Ų39.535%0.35120%0.199SC..Hα-helixtrans-67.4-40.9176.8-57.6-56.6000111.6F426 P427 Q428 G432 L433 S434 W450F426-F430 AromaticContact CD1-CE2 3.92Å; F426-F430 HydrophobicContact CD1-CE2 3.92Å; F426-F430 HydrophobicContact CD1-CZ 4.44Å; F426-F430 AromaticContact CE1-CE2 3.69Å; F426-F430 HydrophobicContact CE1-CE2 3.69Å; F426-F430 AromaticContact CE1-CZ 3.76Å; F426-F430 HydrophobicContact CE1-CZ 3.76Å; F426-F430 HydrophobicContact CZ-CZ 4.32Å; P427-F430 WeakPolarHBondContact O-CB 3.44Å; P427-F430 PolarHBondContact O-N 3.15Å; Q428-F430 VanDerWaalsContact C-N 3.34Å; F430-G432 VanDerWaalsContact C-N 3.32Å; F430-G432 PolarHBondContact O-N 3.12Å; F430-L433 PolarHBondContact O-N 3.28Å; F430-S434 WeakPolarHBondContact O-CB 3.23Å; F430-S434 PolarHBondContact O-N 3.12Å; F430-S434 PolarHBondContact O-OG 2.99Å; F430-W450 HydrophobicContact CB-CD2 4.38Å; F430-W450 HydrophobicContact CB-CG 4.42Å; F430-W450 HydrophobicContact CB-CZ2 4.46Å; F430-W450 HydrophobicContact CD2-CD2 4.37Å; F430-W450 HydrophobicContact CD2-CE3 4.46Å; F430-W450 HydrophobicContact CD2-CH2 4.14Å; F430-W450 HydrophobicContact CD2-CZ2 4.03Å; F430-W450 HydrophobicContact CD2-CZ3 4.36Å; F430-W450 HydrophobicContact CE2-CH2 4.45Å; F430-W450 HydrophobicContact CG-CZ2 4.34Å
431L98.4Very high97.7Very high0 Ų040 Ų400%020%0.203CC..Hα-helixtrans-55.2-48.9172-71.1174.5000111.2Y371 P427 Q428 S434 G435 M436 Y447 W450Y371-L431 HydrophobicContact CD1-CD1 4.36Å; Y371-L431 HydrophobicContact CG-CB 4.33Å; P427-L431 PolarHBondContact O-N 2.67Å; Q428-L431 HydrophobicContact CG-CD1 4.28Å; Q428-L431 PolarHBondContact O-N 3.36Å; L431-S434 WeakPolarHBondContact CA-OG 3.44Å; L431-S434 CarbonylContact O-C 3.57Å; L431-S434 PolarHBondContact O-N 3.36Å; L431-S434 PolarHBondContact O-OG 2.8Å; L431-G435 PolarHBondContact O-N 3.2Å; L431-M436 HydrophobicContact CB-CB 4.07Å; L431-M436 HydrophobicContact CB-SD 3.95Å; L431-M436 HydrophobicContact CD1-SD 3.78Å; L431-M436 HydrophobicContact CD2-SD 3.66Å; L431-M436 HydrophobicContact CG-SD 4Å; L431-M436 VanDerWaalsContact O-CB 3.31Å; L431-M436 WeakPolarHBondContact O-CB 3.45Å; L431-M436 PolarHBondContact O-N 3.25Å; L431-Y447 HydrophobicContact CD2-CD1 3.95Å; L431-Y447 HydrophobicContact CD2-CG 4.11Å; L431-W450 HydrophobicContact CD1-CB 4.06Å; L431-W450 HydrophobicContact CD2-CB 3.56Å; L431-W450 HydrophobicContact CD2-CG 4.26Å; L431-W450 HydrophobicContact CG-CB 3.61Å; L431-W450 HydrophobicContact CG-CG 4.38Å
432G98.2Very high97.6Very high1 Ų142.9 Ų42.91%0.0122%0.218CC..Hα-helixtrans-64.2-44.5178.300000114.2Q428 H429 F430 S434 G435Q428-G432 PolarHBondContact O-N 3.44Å; H429-G432 PolarHBondContact O-N 3.34Å; F430-G432 VanDerWaalsContact C-N 3.32Å; F430-G432 PolarHBondContact O-N 3.12Å; G432-S434 PolarHBondContact O-N 3Å; G432-G435 WeakPolarHBondContact O-CA 3.27Å; G432-G435 PolarHBondContact O-N 3.41Å
433L97.8Very high97.6Very high110 Ų11041.9 Ų41.958%0.57621%0.212SC*.Hα-helixtrans-62-29.3175.2-72.4170.3000112.4L367 Y372 H429 F430 G435L367-L433 HydrophobicContact CD2-CD2 4.07Å; Y372-L433 HydrophobicContact CD2-CD2 4.06Å; Y372-L433 HydrophobicContact CD2-CG 3.85Å; Y372-L433 HydrophobicContact CE2-CD1 4.34Å; Y372-L433 HydrophobicContact CE2-CD2 3.99Å; Y372-L433 HydrophobicContact CE2-CG 4Å; H429-L433 WeakPolarHBondContact O-CB 3.47Å; H429-L433 VanDerWaalsContact O-CG 3.25Å; H429-L433 WeakPolarHBondContact O-CG 3.36Å; H429-L433 PolarHBondContact O-N 3.44Å; F430-L433 PolarHBondContact O-N 3.28Å; L433-G435 VanDerWaalsContact C-N 3.26Å
434S97.4Very high97.5Very high59 Ų5943.3 Ų43.341%0.41323%0.225SC..THydrogen-bonded Turntrans-84.35.6173.3650000114.2F430 L431 G432 Y447F430-S434 WeakPolarHBondContact O-CB 3.23Å; F430-S434 PolarHBondContact O-N 3.12Å; F430-S434 PolarHBondContact O-OG 2.99Å; L431-S434 WeakPolarHBondContact CA-OG 3.44Å; L431-S434 CarbonylContact O-C 3.57Å; L431-S434 PolarHBondContact O-N 3.36Å; L431-S434 PolarHBondContact O-OG 2.8Å; G432-S434 PolarHBondContact O-N 3Å; S434-Y447 PolarHBondContact O-OH 3.3Å; S434-Y447 WeakPolarHBondContact OG-CE1 3.27Å
435G97.4Very high97.4Very high38 Ų3849 Ų4939%0.39226%0.255SS..THydrogen-bonded Turntrans8414.8174.700000115.6L431 G432 L433 P437L431-G435 PolarHBondContact O-N 3.2Å; G432-G435 WeakPolarHBondContact O-CA 3.27Å; G432-G435 PolarHBondContact O-N 3.41Å; L433-G435 VanDerWaalsContact C-N 3.26Å; G435-P437 VanDerWaalsContact O-CD 3.29Å; G435-P437 WeakPolarHBondContact O-CD 3.24Å
436M98.2Very high97.4Very high1 Ų152 Ų521%0.00529%0.285CS..PPolyproline II helixtrans-66.1118.7177.6-173.6-174.6177.500110.1T370 Y371 L431 Y443 Y447 N451T370-M436 CarbonylContact C-O 3.45Å; T370-M436 VanDerWaalsContact CA-O 3.27Å; T370-M436 WeakPolarHBondContact CA-O 3.24Å; T370-M436 WeakPolarHBondContact CB-O 3.42Å; Y371-M436 HydrophobicContact CD2-CB 4.24Å; Y371-M436 HydrophobicContact CD2-CE 4.1Å; Y371-M436 HydrophobicContact CD2-CG 3.76Å; Y371-M436 HydrophobicContact CD2-SD 3.72Å; Y371-M436 HydrophobicContact CE2-CE 3.52Å; Y371-M436 HydrophobicContact CE2-CG 4.06Å; Y371-M436 HydrophobicContact CE2-SD 3.79Å; Y371-M436 HydrophobicContact CG-SD 4.2Å; Y371-M436 PolarHBondContact N-O 3.36Å; L431-M436 HydrophobicContact CB-CB 4.07Å; L431-M436 HydrophobicContact CB-SD 3.95Å; L431-M436 HydrophobicContact CD1-SD 3.78Å; L431-M436 HydrophobicContact CD2-SD 3.66Å; L431-M436 HydrophobicContact CG-SD 4Å; L431-M436 VanDerWaalsContact O-CB 3.31Å; L431-M436 WeakPolarHBondContact O-CB 3.45Å; L431-M436 PolarHBondContact O-N 3.25Å; M436-Y443 HydrophobicContact CE-CD1 3.79Å; M436-Y443 HydrophobicContact CE-CG 3.85Å; M436-Y447 HydrophobicContact CB-CD1 4.11Å; M436-Y447 HydrophobicContact CB-CD2 4.12Å; M436-Y447 HydrophobicContact CB-CE1 4.02Å; M436-Y447 HydrophobicContact CB-CE2 3.98Å; M436-Y447 HydrophobicContact CB-CG 4.17Å; M436-Y447 HydrophobicContact CG-CD2 3.92Å; M436-Y447 HydrophobicContact CG-CE2 4.11Å; M436-Y447 HydrophobicContact CG-CG 4.17Å; M436-Y447 HydrophobicContact SD-CD2 4.4Å; M436-Y447 HydrophobicContact SD-CG 4.22Å; M436-N451 WeakPolarHBondContact CE-ND2 3.17Å; M436-N451 PolarHBondContact SD-ND2 2.93Å; M436-N451 VanDerWaalsContact SD-ND2 3.43Å
437P97.8Very high97.3Very high48 Ų4849 Ų4931%0.31227%0.27SS..BIsolated β-bridgetrans-77.1152.4-17933.4-36.4000111.7D369 Y371 G435 Y440D369-P437 CarbonylContact O-C 3.59Å; D369-P437 WeakPolarHBondContact O-CA 3.46Å; Y371-P437 WeakPolarHBondContact CD2-O 3.44Å; Y371-P437 VanDerWaalsContact CE2-O 3.24Å; Y371-P437 WeakPolarHBondContact CE2-O 3.43Å; G435-P437 VanDerWaalsContact O-CD 3.29Å; G435-P437 WeakPolarHBondContact O-CD 3.24Å; P437-Y440 HydrophobicContact CB-CD2 3.77Å; P437-Y440 HydrophobicContact CB-CE2 3.52Å; P437-Y440 HydrophobicContact CG-CD2 3.55Å; P437-Y440 HydrophobicContact CG-CE2 3.56Å; P437-Y440 HydrophobicContact CG-CG 4.21Å
438R97.2Very high97.3Very high44 Ų4450.2 Ų50.217%0.16628%0.278CS..SBendtrans-83.6158.2177.774.4-175-179.1171.1-4111.9D369 V374 Y440D369-R438 HydrophobicContact CB-CG 4.4Å; D369-R438 VanDerWaalsContact O-CG 3.29Å; D369-R438 WeakPolarHBondContact O-CG 3.23Å; D369-R438 PolarHBondContact O-N 3.13Å; D369-R438 IonicContact OD1-CZ 3.87Å; D369-R438 IonicContact OD1-NE 3.73Å; D369-R438 PolarHBondContact OD1-NE 3.17Å; D369-R438 IonicContact OD1-NH2 2.96Å; D369-R438 PolarHBondContact OD1-NH2 3.41Å; V374-R438 HydrophobicContact CG2-CB 3.85Å; R438-Y440 VanDerWaalsContact C-N 3.34Å; R438-Y440 VanDerWaalsContact O-CD2 3.23Å; R438-Y440 WeakPolarHBondContact O-CD2 3.19Å; R438-Y440 PolarHBondContact O-N 2.61Å
439R95.4Very high97.3Very high68 Ų6854.9 Ų54.926%0.25731%0.307SS..SBendtrans64.231.4176.4-54.6171.3-175.2178.11.5114.6N55 V58N55-R439 PolarHBondContact OD1-O 3.29Å; V58-R439 HydrophobicContact CG1-CG 4.47Å
440Y95.7Very high97.2Very high139 Ų13959 Ų5955%0.54532%0.322SS..  trans-103.5139.5166.3-71.8-102.6000109Y54 P437 R438 D442Y54-Y440 VanDerWaalsContact CE1-C 3.41Å; Y54-Y440 VanDerWaalsContact CE1-O 3.22Å; Y54-Y440 WeakPolarHBondContact CE1-O 3.14Å; Y54-Y440 PolarHBondContact OH-O 3.08Å; P437-Y440 HydrophobicContact CB-CD2 3.77Å; P437-Y440 HydrophobicContact CB-CE2 3.52Å; P437-Y440 HydrophobicContact CG-CD2 3.55Å; P437-Y440 HydrophobicContact CG-CE2 3.56Å; P437-Y440 HydrophobicContact CG-CG 4.21Å; R438-Y440 VanDerWaalsContact C-N 3.34Å; R438-Y440 VanDerWaalsContact O-CD2 3.23Å; R438-Y440 WeakPolarHBondContact O-CD2 3.19Å; R438-Y440 PolarHBondContact O-N 2.61Å; Y440-D442 WeakPolarHBondContact CB-O 3.27Å
441S95.8Very high97.2Very high12 Ų1255.1 Ų55.18%0.08431%0.305CS..SBendtrans-77.6-27175.642.60000112.4D51D51-S441 WeakPolarHBondContact CB-OG 3.45Å; D51-S441 WeakPolarHBondContact OD1-CB 3.46Å; D51-S441 PolarHBondContact OD1-OG 3.17Å
442D96.6Very high97.2Very high62 Ų6259 Ų5933%0.33233%0.325SS..  trans-130.8163.1179.2-1649.1000111.2G45 Y440G45-D442 PolarHBondContact N-OD1 3.49Å; G45-D442 PolarHBondContact N-OD2 3.24Å; Y440-D442 WeakPolarHBondContact CB-O 3.27Å
443Y96.6Very high97.2Very high12 Ų1262.1 Ų62.15%0.04734%0.341CS..  trans-151.4153.2-175.657.5-98.5000113.6L41 Q43 P44 M436 N451L41-Y443 HydrophobicContact CB-CE1 4.13Å; L41-Y443 HydrophobicContact CD2-CD1 3.85Å; L41-Y443 HydrophobicContact CD2-CE1 4Å; L41-Y443 VanDerWaalsContact O-CE1 3.27Å; L41-Y443 WeakPolarHBondContact O-CE1 3.25Å; L41-Y443 PolarHBondContact O-OH 3.4Å; Q43-Y443 VanDerWaalsContact C-OH 3.26Å; Q43-Y443 VanDerWaalsContact CA-OH 3.29Å; Q43-Y443 WeakPolarHBondContact CA-OH 3.25Å; Q43-Y443 PolarHBondContact N-OH 3.19Å; P44-Y443 HydrophobicContact CB-CE2 4.48Å; P44-Y443 HydrophobicContact CG-CD2 4.32Å; P44-Y443 HydrophobicContact CG-CE2 3.74Å; M436-Y443 HydrophobicContact CE-CD1 3.79Å; M436-Y443 HydrophobicContact CE-CG 3.85Å; Y443-N451 HydrophobicContact CE1-CB 4.01Å; Y443-N451 HydrophobicContact CE2-CB 4.13Å; Y443-N451 VanDerWaalsContact OH-CB 3.24Å; Y443-N451 WeakPolarHBondContact OH-CB 3.36Å
444P97Very high97.2Very high85 Ų8556.9 Ų56.955%0.55231%0.313SS*.  trans-58.2142.4174.2-25.732.8000113.8A446 Y447P444-A446 PolarHBondContact O-N 2.82Å; P444-Y447 HydrophobicContact CB-CD2 4.25Å; P444-Y447 HydrophobicContact CB-CE2 4.33Å; P444-Y447 HydrophobicContact CG-CD2 4.28Å; P444-Y447 HydrophobicContact CG-CE2 4.06Å; P444-Y447 PolarHBondContact O-N 3.11Å
445D96.1Very high97.3Very high124 Ų12454.3 Ų54.366%0.66330%0.295SS*.G310 helixtrans-50.9-26.7-177.3-63.2-1.9000114.7Y447 T448D445-Y447 PolarHBondContact O-N 3.27Å; D445-Y447 VanDerWaalsContact O-N 3.14Å; D445-T448 WeakPolarHBondContact CA-OG1 3.32Å; D445-T448 VanDerWaalsContact O-CB 3.25Å; D445-T448 WeakPolarHBondContact O-CB 3.3Å; D445-T448 PolarHBondContact O-N 3.21Å; D445-T448 VanDerWaalsContact O-N 3.09Å; D445-T448 PolarHBondContact O-OG1 3.29Å
446A97.2Very high97.3Very high88 Ų8855.8 Ų55.873%0.72730%0.297SS*.G310 helixtrans-57.5-25.2175.700000113.7P444P444-A446 PolarHBondContact O-N 2.82Å
447Y97.7Very high97.3Very high37 Ų3755.8 Ų55.815%0.14530%0.297CS..G310 helixtrans-93.3-2.1-179.5-58-48.9000113.9L431 S434 M436 P444 D445 T449 W450 N451L431-Y447 HydrophobicContact CD2-CD1 3.95Å; L431-Y447 HydrophobicContact CD2-CG 4.11Å; S434-Y447 PolarHBondContact O-OH 3.3Å; S434-Y447 WeakPolarHBondContact OG-CE1 3.27Å; M436-Y447 HydrophobicContact CB-CD1 4.11Å; M436-Y447 HydrophobicContact CB-CD2 4.12Å; M436-Y447 HydrophobicContact CB-CE1 4.02Å; M436-Y447 HydrophobicContact CB-CE2 3.98Å; M436-Y447 HydrophobicContact CB-CG 4.17Å; M436-Y447 HydrophobicContact CG-CD2 3.92Å; M436-Y447 HydrophobicContact CG-CE2 4.11Å; M436-Y447 HydrophobicContact CG-CG 4.17Å; M436-Y447 HydrophobicContact SD-CD2 4.4Å; M436-Y447 HydrophobicContact SD-CG 4.22Å; P444-Y447 HydrophobicContact CB-CD2 4.25Å; P444-Y447 HydrophobicContact CB-CE2 4.33Å; P444-Y447 HydrophobicContact CG-CD2 4.28Å; P444-Y447 HydrophobicContact CG-CE2 4.06Å; P444-Y447 PolarHBondContact O-N 3.11Å; D445-Y447 PolarHBondContact O-N 3.27Å; D445-Y447 VanDerWaalsContact O-N 3.14Å; Y447-T449 PolarHBondContact O-N 3.34Å; Y447-W450 PolarHBondContact O-N 3.2Å; Y447-N451 PolarHBondContact O-N 3.01Å; Y447-N451 PolarHBondContact O-ND2 3.34Å; Y447-N451 VanDerWaalsContact O-ND2 3.14Å
448T97.5Very high97.4Very high28 Ų2854 Ų5417%0.17229%0.285CS..Hα-helixtrans-58.6-47.8-171.5-56.10000113.2P44 D445 W450 N451 I452P44-T448 HydrophobicContact CG-CG2 4.35Å; P44-T448 WeakPolarHBondContact CG-OG1 3.25Å; D445-T448 WeakPolarHBondContact CA-OG1 3.32Å; D445-T448 VanDerWaalsContact O-CB 3.25Å; D445-T448 WeakPolarHBondContact O-CB 3.3Å; D445-T448 PolarHBondContact O-N 3.21Å; D445-T448 VanDerWaalsContact O-N 3.09Å; D445-T448 PolarHBondContact O-OG1 3.29Å; T448-W450 VanDerWaalsContact C-N 3.34Å; T448-W450 PolarHBondContact O-N 2.88Å; T448-N451 PolarHBondContact O-N 3Å; T448-N451 VanDerWaalsContact O-N 3.16Å; T448-I452 HydrophobicContact CG2-CD1 3.58Å; T448-I452 HydrophobicContact CG2-CG1 4.12Å; T448-I452 WeakPolarHBondContact O-CG1 3.18Å; T448-I452 PolarHBondContact O-N 2.7Å
449T97.6Very high97.4Very high103 Ų10356.8 Ų56.863%0.63230%0.299SS*.Hα-helixtrans-57.3-46.3-174.9-54.10000112.3Y447 L453Y447-T449 PolarHBondContact O-N 3.34Å; T449-L453 PolarHBondContact O-N 3.21Å
450W98.3Very high97.5Very high99 Ų9955.9 Ų55.938%0.37530%0.298SS..Hα-helixtrans-74.2-32.3-179.5-63.8131.7000112.6P427 F430 L431 Y447 T448 L453 S454P427-W450 HydrophobicContact CB-CB 4.07Å; P427-W450 HydrophobicContact CB-CD2 4.37Å; P427-W450 HydrophobicContact CB-CE3 3.89Å; P427-W450 HydrophobicContact CB-CG 4.49Å; P427-W450 HydrophobicContact CG-CE3 4.43Å; F430-W450 HydrophobicContact CB-CD2 4.38Å; F430-W450 HydrophobicContact CB-CG 4.42Å; F430-W450 HydrophobicContact CB-CZ2 4.46Å; F430-W450 HydrophobicContact CD2-CD2 4.37Å; F430-W450 HydrophobicContact CD2-CE3 4.46Å; F430-W450 HydrophobicContact CD2-CH2 4.14Å; F430-W450 HydrophobicContact CD2-CZ2 4.03Å; F430-W450 HydrophobicContact CD2-CZ3 4.36Å; F430-W450 HydrophobicContact CE2-CH2 4.45Å; F430-W450 HydrophobicContact CG-CZ2 4.34Å; L431-W450 HydrophobicContact CD1-CB 4.06Å; L431-W450 HydrophobicContact CD2-CB 3.56Å; L431-W450 HydrophobicContact CD2-CG 4.26Å; L431-W450 HydrophobicContact CG-CB 3.61Å; L431-W450 HydrophobicContact CG-CG 4.38Å; Y447-W450 PolarHBondContact O-N 3.2Å; T448-W450 VanDerWaalsContact C-N 3.34Å; T448-W450 PolarHBondContact O-N 2.88Å; W450-L453 HydrophobicContact CE3-CD2 4.35Å; W450-L453 HydrophobicContact CZ3-CD2 4.3Å; W450-L453 PolarHBondContact O-N 2.89Å; W450-S454 VanDerWaalsContact O-CB 3.25Å; W450-S454 WeakPolarHBondContact O-CB 3.34Å; W450-S454 PolarHBondContact O-N 3.5Å
451N98.3Very high97.6Very high0 Ų050 Ų500%028%0.278CS..Hα-helixtrans-68-41.9174.3-89.6-61000112.7R38 L41 M436 Y443 Y447 T448 L453 S454 S455R38-N451 PolarHBondContact NH2-O 3.05Å; R38-N451 PolarHBondContact NH2-OD1 3.45Å; R38-N451 VanDerWaalsContact NH2-OD1 3.08Å; L41-N451 WeakPolarHBondContact O-CB 3.43Å; M436-N451 WeakPolarHBondContact CE-ND2 3.17Å; M436-N451 PolarHBondContact SD-ND2 2.93Å; M436-N451 VanDerWaalsContact SD-ND2 3.43Å; Y443-N451 HydrophobicContact CE1-CB 4.01Å; Y443-N451 HydrophobicContact CE2-CB 4.13Å; Y443-N451 VanDerWaalsContact OH-CB 3.24Å; Y443-N451 WeakPolarHBondContact OH-CB 3.36Å; Y447-N451 PolarHBondContact O-N 3.01Å; Y447-N451 PolarHBondContact O-ND2 3.34Å; Y447-N451 VanDerWaalsContact O-ND2 3.14Å; T448-N451 PolarHBondContact O-N 3Å; T448-N451 VanDerWaalsContact O-N 3.16Å; N451-L453 PolarHBondContact O-N 3.49Å; N451-S454 PolarHBondContact O-N 3.33Å; N451-S455 WeakPolarHBondContact O-CB 3.44Å; N451-S455 PolarHBondContact O-N 2.88Å; N451-S455 PolarHBondContact O-OG 2.85Å; N451-S455 VanDerWaalsContact O-OG 3.11Å
452I98.1Very high97.7Very high81 Ų8152 Ų5242%0.41529%0.287SS..Hα-helixtrans-58-49.2173.1-69.9170000109.9G42 T448 S454 S455 V456G42-I452 WeakPolarHBondContact O-CG1 3.37Å; T448-I452 HydrophobicContact CG2-CD1 3.58Å; T448-I452 HydrophobicContact CG2-CG1 4.12Å; T448-I452 WeakPolarHBondContact O-CG1 3.18Å; T448-I452 PolarHBondContact O-N 2.7Å; I452-S454 VanDerWaalsContact C-N 3.32Å; I452-S454 PolarHBondContact O-N 2.95Å; I452-S455 PolarHBondContact O-N 3.28Å; I452-V456 HydrophobicContact CG2-CG2 4.38Å; I452-V456 WeakPolarHBondContact O-CG2 3.23Å; I452-V456 PolarHBondContact O-N 3.46Å
453L98.1Very high97.8Very high66 Ų6652.5 Ų52.535%0.34629%0.293SS..Hα-helixtrans-60.7-43.6179.4-162.278.9000111.6L423 P427 T449 W450 N451 S455 V456 G457L423-L453 HydrophobicContact CD2-CD1 4.37Å; L423-L453 HydrophobicContact CD2-CD2 4.14Å; L423-L453 HydrophobicContact CD2-CG 4.25Å; P427-L453 HydrophobicContact CB-CD2 4.39Å; P427-L453 HydrophobicContact CG-CB 4.23Å; P427-L453 HydrophobicContact CG-CD2 3.41Å; P427-L453 VanDerWaalsContact CG-CD2 3.41Å; P427-L453 HydrophobicContact CG-CG 4.14Å; T449-L453 PolarHBondContact O-N 3.21Å; W450-L453 HydrophobicContact CE3-CD2 4.35Å; W450-L453 HydrophobicContact CZ3-CD2 4.3Å; W450-L453 PolarHBondContact O-N 2.89Å; N451-L453 PolarHBondContact O-N 3.49Å; L453-S455 VanDerWaalsContact C-N 3.34Å; L453-S455 PolarHBondContact O-N 3.16Å; L453-V456 PolarHBondContact O-N 3.41Å; L453-G457 PolarHBondContact O-N 3.3Å
454S98.4Very high97.8Very high0 Ų052 Ų520%029%0.291CS..Hα-helixtrans-61.1-42.3177.7-176.50000111.7R38 L423 T424 Q428 W450 N451 I452 G457 S458R38-S454 VanDerWaalsContact CZ-OG 3.3Å; R38-S454 PolarHBondContact NH2-OG 3.47Å; L423-S454 WeakPolarHBondContact O-CA 3.44Å; T424-S454 WeakPolarHBondContact CA-O 3.33Å; T424-S454 VanDerWaalsContact O-CB 3.25Å; T424-S454 WeakPolarHBondContact O-CB 3.35Å; T424-S454 PolarHBondContact O-OG 3.07Å; Q428-S454 PolarHBondContact NE2-OG 3.33Å; W450-S454 VanDerWaalsContact O-CB 3.25Å; W450-S454 WeakPolarHBondContact O-CB 3.34Å; W450-S454 PolarHBondContact O-N 3.5Å; N451-S454 PolarHBondContact O-N 3.33Å; I452-S454 VanDerWaalsContact C-N 3.32Å; I452-S454 PolarHBondContact O-N 2.95Å; S454-G457 PolarHBondContact O-N 3.03Å; S454-S458 PolarHBondContact O-N 3.4Å; S454-S458 VanDerWaalsContact O-N 3.12Å
455S98.3Very high97.8Very high5 Ų549.3 Ų49.34%0.03527%0.273CS..Hα-helixtrans-70.1-39.8177.5-62.80000112.5R38 N451 I452 L453 G457 S458 F459R38-S455 PolarHBondContact NE-OG 3Å; R38-S455 PolarHBondContact NH2-OG 3.46Å; R38-S455 WeakPolarHBondContact O-CB 3.37Å; R38-S455 PolarHBondContact O-OG 2.93Å; N451-S455 WeakPolarHBondContact O-CB 3.44Å; N451-S455 PolarHBondContact O-N 2.88Å; N451-S455 PolarHBondContact O-OG 2.85Å; N451-S455 VanDerWaalsContact O-OG 3.11Å; I452-S455 PolarHBondContact O-N 3.28Å; L453-S455 VanDerWaalsContact C-N 3.34Å; L453-S455 PolarHBondContact O-N 3.16Å; S455-G457 VanDerWaalsContact C-N 3.32Å; S455-G457 PolarHBondContact O-N 3.35Å; S455-S458 WeakPolarHBondContact O-CB 3.1Å; S455-S458 PolarHBondContact O-N 3.2Å; S455-S458 VanDerWaalsContact O-N 3.09Å; S455-F459 WeakPolarHBondContact O-CD2 3.38Å; S455-F459 PolarHBondContact O-N 3.21Å; S455-F459 VanDerWaalsContact O-N 3.08Å
456V98.4Very high97.9Very high70 Ų7048.8 Ų48.842%0.42427%0.268SS..Hα-helixtrans-58.2-44.4171.71700000111I452 L453 S458 F459 I460I452-V456 HydrophobicContact CG2-CG2 4.38Å; I452-V456 WeakPolarHBondContact O-CG2 3.23Å; I452-V456 PolarHBondContact O-N 3.46Å; L453-V456 PolarHBondContact O-N 3.41Å; V456-S458 VanDerWaalsContact C-N 3.26Å; V456-S458 PolarHBondContact O-N 2.92Å; V456-F459 PolarHBondContact O-N 2.82Å; V456-I460 HydrophobicContact CG1-CD1 4.04Å; V456-I460 WeakPolarHBondContact O-CG1 3.42Å; V456-I460 PolarHBondContact O-N 3.06Å
457G98.4Very high98Very high0 Ų046 Ų460%024%0.241CC..Hα-helixtrans-57.7-38.5174.400000113.1G420 T424 L453 S454 S455 I460 S461G420-G457 CarbonylContact C-O 3.58Å; G420-G457 WeakPolarHBondContact CA-O 3.32Å; G420-G457 CarbonylContact O-C 3.45Å; G420-G457 WeakPolarHBondContact O-CA 3.41Å; T424-G457 WeakPolarHBondContact OG1-CA 3.33Å; T424-G457 PolarHBondContact OG1-O 2.8Å; L453-G457 PolarHBondContact O-N 3.3Å; S454-G457 PolarHBondContact O-N 3.03Å; S455-G457 VanDerWaalsContact C-N 3.32Å; S455-G457 PolarHBondContact O-N 3.35Å; G457-I460 PolarHBondContact O-N 3.24Å; G457-S461 PolarHBondContact O-N 3.01Å; G457-S461 PolarHBondContact O-OG 2.86Å
458S97.9Very high98Very high10 Ų1045 Ų457%0.0724%0.238CC..Hα-helixtrans-66.9-42.2178.5-175.50000111.7T424 S454 S455 V456 I460 S461 L462T424-S458 WeakPolarHBondContact OG1-CA 3.2Å; T424-S458 PolarHBondContact OG1-N 3.14Å; S454-S458 PolarHBondContact O-N 3.4Å; S454-S458 VanDerWaalsContact O-N 3.12Å; S455-S458 WeakPolarHBondContact O-CB 3.1Å; S455-S458 PolarHBondContact O-N 3.2Å; S455-S458 VanDerWaalsContact O-N 3.09Å; V456-S458 VanDerWaalsContact C-N 3.26Å; V456-S458 PolarHBondContact O-N 2.92Å; S458-I460 PolarHBondContact O-N 3.03Å; S458-S461 WeakPolarHBondContact O-CB 3.35Å; S458-S461 PolarHBondContact O-N 2.59Å; S458-S461 VanDerWaalsContact O-N 3.14Å; S458-L462 PolarHBondContact O-N 3.19Å
459F97.8Very high98Very high104 Ų10447.7 Ų47.746%0.45625%0.25SC..Hα-helixtrans-65.3-35.9173.7-72.8-69.2000112.8L35 A39 S455 V456 S461 L462 T463L35-F459 HydrophobicContact CD2-CD1 4.24Å; L35-F459 HydrophobicContact CD2-CE1 4.4Å; A39-F459 HydrophobicContact CB-CZ 4.49Å; S455-F459 WeakPolarHBondContact O-CD2 3.38Å; S455-F459 PolarHBondContact O-N 3.21Å; S455-F459 VanDerWaalsContact O-N 3.08Å; V456-F459 PolarHBondContact O-N 2.82Å; F459-S461 VanDerWaalsContact C-N 3.33Å; F459-L462 WeakPolarHBondContact O-CB 3.43Å; F459-L462 PolarHBondContact O-N 3.21Å; F459-T463 PolarHBondContact O-N 2.72Å
460I98.4Very high98Very high48 Ų4846.5 Ų46.525%0.24624%0.236CC..Hα-helixtrans-62.5-43.4171.1-66.5166.3000110I416 L423 V456 G457 S458 L462 T463 A464I416-I460 HydrophobicContact CG2-CG2 3.87Å; I416-I460 WeakPolarHBondContact CG2-O 3.4Å; L423-I460 HydrophobicContact CD1-CD1 3.74Å; V456-I460 HydrophobicContact CG1-CD1 4.04Å; V456-I460 WeakPolarHBondContact O-CG1 3.42Å; V456-I460 PolarHBondContact O-N 3.06Å; G457-I460 PolarHBondContact O-N 3.24Å; S458-I460 PolarHBondContact O-N 3.03Å; I460-L462 VanDerWaalsContact C-N 3.29Å; I460-L462 PolarHBondContact O-N 2.86Å; I460-T463 WeakPolarHBondContact O-CB 3.46Å; I460-T463 PolarHBondContact O-N 3.14Å; I460-T463 PolarHBondContact O-OG1 3.38Å; I460-A464 PolarHBondContact O-N 3.23Å
461S97.5Very high98Very high17 Ų1741.9 Ų41.912%0.11922%0.219CC..Hα-helixtrans-62.8-34.6178.1-53.40000112.3G420 V421 G457 S458 F459 T463 A464 V465G420-S461 WeakPolarHBondContact CA-OG 3.37Å; V421-S461 PolarHBondContact N-OG 3.21Å; G457-S461 PolarHBondContact O-N 3.01Å; G457-S461 PolarHBondContact O-OG 2.86Å; S458-S461 WeakPolarHBondContact O-CB 3.35Å; S458-S461 PolarHBondContact O-N 2.59Å; S458-S461 VanDerWaalsContact O-N 3.14Å; F459-S461 VanDerWaalsContact C-N 3.33Å; S461-T463 VanDerWaalsContact C-N 3.31Å; S461-T463 PolarHBondContact O-N 3.43Å; S461-A464 WeakPolarHBondContact O-CB 3.43Å; S461-A464 PolarHBondContact O-N 2.96Å; S461-A464 VanDerWaalsContact O-N 3.14Å; S461-V465 PolarHBondContact O-N 3.17Å; S461-V465 VanDerWaalsContact O-N 3.08Å
462L97.4Very high98Very high53 Ų5344.4 Ų44.428%0.27723%0.232SC..Hα-helixtrans-58.7-41.6171.1171.560.3000111.9L35 S458 F459 I460 A464 V465 M466L35-L462 HydrophobicContact CD1-CB 4.16Å; L35-L462 HydrophobicContact CD1-CD1 3.82Å; L35-L462 HydrophobicContact CD1-CD2 3.74Å; L35-L462 HydrophobicContact CD1-CG 4.09Å; L35-L462 HydrophobicContact CD2-CB 4.1Å; L35-L462 HydrophobicContact CD2-CD2 4.32Å; S458-L462 PolarHBondContact O-N 3.19Å; F459-L462 WeakPolarHBondContact O-CB 3.43Å; F459-L462 PolarHBondContact O-N 3.21Å; I460-L462 VanDerWaalsContact C-N 3.29Å; I460-L462 PolarHBondContact O-N 2.86Å; L462-A464 PolarHBondContact O-N 3.3Å; L462-V465 PolarHBondContact O-N 3.35Å; L462-V465 VanDerWaalsContact O-N 3.1Å; L462-M466 HydrophobicContact CD1-CG 4.15Å; L462-M466 HydrophobicContact CD1-SD 4.49Å; L462-M466 WeakPolarHBondContact O-CG 3.42Å; L462-M466 PolarHBondContact O-N 3.44Å
463T98Very high98Very high73 Ų7348.3 Ų48.345%0.44824%0.241SC..Hα-helixtrans-61.9-33.7177.169.50000112.1I416 F459 I460 S461 M466 L467I416-T463 WeakPolarHBondContact CG2-OG1 3.31Å; F459-T463 PolarHBondContact O-N 2.72Å; I460-T463 WeakPolarHBondContact O-CB 3.46Å; I460-T463 PolarHBondContact O-N 3.14Å; I460-T463 PolarHBondContact O-OG1 3.38Å; S461-T463 VanDerWaalsContact C-N 3.31Å; S461-T463 PolarHBondContact O-N 3.43Å; T463-M466 PolarHBondContact O-N 3.28Å; T463-L467 WeakPolarHBondContact O-CB 3.41Å; T463-L467 PolarHBondContact O-N 3.32Å
464A97.9Very high97.9Very high0 Ų046.6 Ų46.60%023%0.231CC..Hα-helixtrans-66.4-43.3172.400000111.9H413 I416 M417 I460 S461 L462 M466 L467 M468H413-A464 PolarHBondContact CD2-O 3.23Å; H413-A464 PolarHBondContact NE2-O 3.49Å; I416-A464 HydrophobicContact CB-CB 4.22Å; I416-A464 HydrophobicContact CG2-CB 3.85Å; M417-A464 HydrophobicContact CB-CB 3.82Å; M417-A464 HydrophobicContact CE-CB 3.72Å; M417-A464 HydrophobicContact SD-CB 4.18Å; I460-A464 PolarHBondContact O-N 3.23Å; S461-A464 WeakPolarHBondContact O-CB 3.43Å; S461-A464 PolarHBondContact O-N 2.96Å; S461-A464 VanDerWaalsContact O-N 3.14Å; L462-A464 PolarHBondContact O-N 3.3Å; A464-M466 VanDerWaalsContact C-N 3.33Å; A464-M466 PolarHBondContact O-N 3.45Å; A464-L467 WeakPolarHBondContact O-CB 3.4Å; A464-L467 PolarHBondContact O-N 3.04Å; A464-L467 VanDerWaalsContact O-N 3.15Å; A464-M468 PolarHBondContact O-N 3.22Å
465V97.4Very high97.9Very high30 Ų3046.6 Ų46.618%0.18223%0.231CC..Hα-helixtrans-59.5-43.5175.6175.50000111.5T31 M417 S461 L462 L467 M468 I469T31-V465 HydrophobicContact CG2-CG2 4.33Å; M417-V465 HydrophobicContact CE-CG2 4.13Å; S461-V465 PolarHBondContact O-N 3.17Å; S461-V465 VanDerWaalsContact O-N 3.08Å; L462-V465 PolarHBondContact O-N 3.35Å; L462-V465 VanDerWaalsContact O-N 3.1Å; V465-L467 VanDerWaalsContact C-N 3.33Å; V465-L467 PolarHBondContact O-N 2.92Å; V465-M468 WeakPolarHBondContact O-CB 3.46Å; V465-M468 PolarHBondContact O-N 3.09Å; V465-I469 PolarHBondContact O-N 3.19Å
466M97.9Very high97.8Very high112 Ų11251 Ų5155%0.55225%0.25SS*.Hα-helixtrans-63.8-39.6175.7-64.8-56.6-68.100112L462 T463 A464 M468 I469 F470L462-M466 HydrophobicContact CD1-CG 4.15Å; L462-M466 HydrophobicContact CD1-SD 4.49Å; L462-M466 WeakPolarHBondContact O-CG 3.42Å; L462-M466 PolarHBondContact O-N 3.44Å; T463-M466 PolarHBondContact O-N 3.28Å; A464-M466 VanDerWaalsContact C-N 3.33Å; A464-M466 PolarHBondContact O-N 3.45Å; M466-M468 VanDerWaalsContact C-N 3.33Å; M466-M468 PolarHBondContact O-N 3.37Å; M466-I469 PolarHBondContact O-N 3.2Å; M466-I469 HydrophobicContact SD-CD1 4.39Å; M466-F470 PolarHBondContact O-N 2.64Å
467L98.3Very high97.7Very high30 Ų3050.5 Ų50.516%0.15725%0.254CS..Hα-helixtrans-64.2-36.9175.2-179.659.1000111.9I412 H413 I416 T463 A464 V465 F470 M471I412-L467 HydrophobicContact CB-CD2 4.32Å; I412-L467 HydrophobicContact CG2-CD2 3.78Å; H413-L467 HydrophobicContact CB-CD2 3.79Å; H413-L467 HydrophobicContact CB-CG 4.18Å; I416-L467 HydrophobicContact CD1-CD2 4.11Å; T463-L467 WeakPolarHBondContact O-CB 3.41Å; T463-L467 PolarHBondContact O-N 3.32Å; A464-L467 WeakPolarHBondContact O-CB 3.4Å; A464-L467 PolarHBondContact O-N 3.04Å; A464-L467 VanDerWaalsContact O-N 3.15Å; V465-L467 VanDerWaalsContact C-N 3.33Å; V465-L467 PolarHBondContact O-N 2.92Å; L467-F470 HydrophobicContact CD1-CD1 3.92Å; L467-F470 WeakPolarHBondContact O-CB 3.32Å; L467-F470 PolarHBondContact O-N 3.19Å; L467-M471 HydrophobicContact CD1-CG 4.39Å; L467-M471 HydrophobicContact CG-CG 4.44Å; L467-M471 HydrophobicContact CG-SD 4.33Å; L467-M471 WeakPolarHBondContact O-CB 3.32Å; L467-M471 VanDerWaalsContact O-CG 3.27Å; L467-M471 WeakPolarHBondContact O-CG 3.16Å; L467-M471 PolarHBondContact O-N 3.37Å
468M97.8Very high97.6Very high17 Ų1752.8 Ų52.88%0.08427%0.27CS..Hα-helixtrans-60.7-46.4174178.559.894.800111.6M390 F393 H413 A464 V465 M466 F470 M471 I472M390-M468 HydrophobicContact CE-CE 4.48Å; M390-M468 HydrophobicContact SD-CE 3.22Å; M390-M468 WeakPolarHBondContact SD-CE 3.24Å; F393-M468 HydrophobicContact CD1-CE 3.97Å; F393-M468 HydrophobicContact CD1-SD 4.23Å; F393-M468 HydrophobicContact CE1-CE 4.28Å; F393-M468 HydrophobicContact CE1-SD 3.92Å; H413-M468 VanDerWaalsContact CE1-CE 3.46Å; H413-M468 WeakPolarHBondContact CE1-CE 3.3Å; A464-M468 PolarHBondContact O-N 3.22Å; V465-M468 WeakPolarHBondContact O-CB 3.46Å; V465-M468 PolarHBondContact O-N 3.09Å; M466-M468 VanDerWaalsContact C-N 3.33Å; M466-M468 PolarHBondContact O-N 3.37Å; M468-F470 VanDerWaalsContact C-N 3.29Å; M468-F470 PolarHBondContact O-N 2.91Å; M468-M471 PolarHBondContact O-N 3.03Å; M468-I472 HydrophobicContact CG-CD1 4.17Å; M468-I472 WeakPolarHBondContact O-CG1 3.37Å; M468-I472 PolarHBondContact O-N 2.83Å; M468-I472 HydrophobicContact SD-CD1 4.24Å; M468-I472 HydrophobicContact SD-CG1 4.3Å
469I97.7Very high97.4Very high84 Ų8458.6 Ų58.643%0.43129%0.294SS..Hα-helixtrans-59.6-44.5177.1-63.2169.3000110.2V465 M466 I472 W473V465-I469 PolarHBondContact O-N 3.19Å; M466-I469 PolarHBondContact O-N 3.2Å; M466-I469 HydrophobicContact SD-CD1 4.39Å; I469-I472 PolarHBondContact O-N 3.03Å; I469-W473 PolarHBondContact O-N 3.19Å
470F98.3Very high97.2Very high77 Ų7757.2 Ų57.234%0.33829%0.285SS..Hα-helixtrans-59.7-45.7174.9170.2-95.8000112.2Y409 M466 L467 M468 I472 W473 E474Y409-F470 HydrophobicContact CD2-CE1 4.11Å; Y409-F470 HydrophobicContact CE1-CE1 4.5Å; Y409-F470 AromaticContact CE2-CE1 3.98Å; Y409-F470 HydrophobicContact CE2-CE1 3.98Å; Y409-F470 HydrophobicContact CG-CE1 4.46Å; M466-F470 PolarHBondContact O-N 2.64Å; L467-F470 HydrophobicContact CD1-CD1 3.92Å; L467-F470 WeakPolarHBondContact O-CB 3.32Å; L467-F470 PolarHBondContact O-N 3.19Å; M468-F470 VanDerWaalsContact C-N 3.29Å; M468-F470 PolarHBondContact O-N 2.91Å; F470-I472 VanDerWaalsContact C-N 3.32Å; F470-I472 PolarHBondContact O-N 2.83Å; F470-W473 AromaticContact CD2-CE3 3.83Å; F470-W473 HydrophobicContact CD2-CE3 3.83Å; F470-W473 HydrophobicContact CD2-CZ3 4.01Å; F470-W473 AromaticContact CE2-CE3 3.85Å; F470-W473 HydrophobicContact CE2-CE3 3.85Å; F470-W473 AromaticContact CE2-CZ3 3.57Å; F470-W473 HydrophobicContact CE2-CZ3 3.57Å; F470-W473 HydrophobicContact CZ-CZ3 4.4Å; F470-W473 PolarHBondContact O-N 3.25Å; F470-E474 HydrophobicContact CE1-CB 4.31Å; F470-E474 HydrophobicContact CE1-CG 4.36Å; F470-E474 HydrophobicContact CZ-CB 4.34Å; F470-E474 HydrophobicContact CZ-CG 4.24Å; F470-E474 WeakPolarHBondContact O-CB 3.41Å; F470-E474 PolarHBondContact O-N 2.93Å
471M98.2Very high96.8Very high2 Ų262.2 Ų62.21%0.0131%0.305CS..Hα-helixtrans-60.3-41.4179.5-76.4172.551.400112.4L405 A410 H413 L467 M468 E474 A475L405-M471 HydrophobicContact CB-CE 4.36Å; L405-M471 HydrophobicContact CD1-CE 4.04Å; L405-M471 HydrophobicContact CD2-CB 4.43Å; L405-M471 HydrophobicContact CD2-CE 4.39Å; L405-M471 HydrophobicContact CG-CE 4.5Å; A410-M471 HydrophobicContact CB-CE 3.62Å; H413-M471 HydrophobicContact CB-SD 3.62Å; L467-M471 HydrophobicContact CD1-CG 4.39Å; L467-M471 HydrophobicContact CG-CG 4.44Å; L467-M471 HydrophobicContact CG-SD 4.33Å; L467-M471 WeakPolarHBondContact O-CB 3.32Å; L467-M471 VanDerWaalsContact O-CG 3.27Å; L467-M471 WeakPolarHBondContact O-CG 3.16Å; L467-M471 PolarHBondContact O-N 3.37Å; M468-M471 PolarHBondContact O-N 3.03Å; M471-E474 PolarHBondContact O-N 3.07Å; M471-A475 WeakPolarHBondContact O-CB 3.24Å; M471-A475 PolarHBondContact O-N 3.06Å
472I97.5Very high96.3Very high54 Ų5463.2 Ų63.228%0.27731%0.31SS..Hα-helixtrans-64.2-50176.9-65.5170.4000109.6F393 M468 I469 F470 E474 A475 F476F393-I472 HydrophobicContact CE1-CD1 4.12Å; F393-I472 HydrophobicContact CE1-CG1 4.06Å; F393-I472 HydrophobicContact CZ-CD1 3.74Å; F393-I472 HydrophobicContact CZ-CG1 3.88Å; M468-I472 HydrophobicContact CG-CD1 4.17Å; M468-I472 WeakPolarHBondContact O-CG1 3.37Å; M468-I472 PolarHBondContact O-N 2.83Å; M468-I472 HydrophobicContact SD-CD1 4.24Å; M468-I472 HydrophobicContact SD-CG1 4.3Å; I469-I472 PolarHBondContact O-N 3.03Å; F470-I472 VanDerWaalsContact C-N 3.32Å; F470-I472 PolarHBondContact O-N 2.83Å; I472-E474 VanDerWaalsContact C-N 3.31Å; I472-E474 PolarHBondContact O-N 3.39Å; I472-A475 PolarHBondContact O-N 2.86Å; I472-F476 HydrophobicContact CG2-CD2 3.93Å; I472-F476 HydrophobicContact CG2-CE2 3.87Å; I472-F476 VanDerWaalsContact O-CD2 3.24Å; I472-F476 WeakPolarHBondContact O-CD2 3.24Å; I472-F476 PolarHBondContact O-N 3.36Å
473W97.6Very high95.4Very high163 Ų16369 Ų6962%0.61734%0.341SS*.Hα-helixtrans-56.1-46.6176.4168.481.1000111.9I469 F470 A475 F476 A477I469-W473 PolarHBondContact O-N 3.19Å; F470-W473 AromaticContact CD2-CE3 3.83Å; F470-W473 HydrophobicContact CD2-CE3 3.83Å; F470-W473 HydrophobicContact CD2-CZ3 4.01Å; F470-W473 AromaticContact CE2-CE3 3.85Å; F470-W473 HydrophobicContact CE2-CE3 3.85Å; F470-W473 AromaticContact CE2-CZ3 3.57Å; F470-W473 HydrophobicContact CE2-CZ3 3.57Å; F470-W473 HydrophobicContact CZ-CZ3 4.4Å; F470-W473 PolarHBondContact O-N 3.25Å; W473-A475 PolarHBondContact O-N 3.23Å; W473-F476 PolarHBondContact O-N 2.98Å; W473-A477 WeakPolarHBondContact O-CB 3.14Å; W473-A477 PolarHBondContact O-N 3.45Å
474E97.8Very high94.4Very high29 Ų2973 Ų7314%0.13636%0.356CS..Hα-helixtrans-62.9-40.5-178.3-170.9-73141.500111.5Y409 F470 M471 I472 F476 A477 S478 R480Y409-E474 HydrophobicContact CE2-CG 4.49Å; F470-E474 HydrophobicContact CE1-CB 4.31Å; F470-E474 HydrophobicContact CE1-CG 4.36Å; F470-E474 HydrophobicContact CZ-CB 4.34Å; F470-E474 HydrophobicContact CZ-CG 4.24Å; F470-E474 WeakPolarHBondContact O-CB 3.41Å; F470-E474 PolarHBondContact O-N 2.93Å; M471-E474 PolarHBondContact O-N 3.07Å; I472-E474 VanDerWaalsContact C-N 3.31Å; I472-E474 PolarHBondContact O-N 3.39Å; E474-F476 PolarHBondContact O-N 3.06Å; E474-A477 PolarHBondContact O-N 3.29Å; E474-S478 VanDerWaalsContact O-CB 3.26Å; E474-S478 WeakPolarHBondContact O-CB 3.21Å; E474-S478 PolarHBondContact O-N 3.42Å; E474-S478 PolarHBondContact O-OG 3.29Å; E474-S478 PolarHBondContact OE1-OG 3.31Å; E474-R480 IonicContact OE1-CZ 2.95Å; E474-R480 IonicContact OE1-NH1 2.66Å; E474-R480 PolarHBondContact OE1-NH1 3.22Å; E474-R480 IonicContact OE1-NH2 2.61Å; E474-R480 IonicContact OE2-CZ 3.52Å; E474-R480 IonicContact OE2-NH1 3.32Å; E474-R480 PolarHBondContact OE2-NH1 2.75Å; E474-R480 IonicContact OE2-NH2 3.54Å; E474-R480 PolarHBondContact OE2-NH2 3.45Å
475A96.9Very high93.4Very high0 Ų074.3 Ų74.30%036%0.364CS..Hα-helixtrans-63.7-41.1175.900000112.7F397 L405 M471 I472 W473 S478 K479F397-A475 HydrophobicContact CE1-CB 3.77Å; F397-A475 HydrophobicContact CZ-CB 3.9Å; L405-A475 HydrophobicContact CD2-CB 3.97Å; M471-A475 WeakPolarHBondContact O-CB 3.24Å; M471-A475 PolarHBondContact O-N 3.06Å; I472-A475 PolarHBondContact O-N 2.86Å; W473-A475 PolarHBondContact O-N 3.23Å; A475-S478 PolarHBondContact O-OG 3.08Å; A475-K479 PolarHBondContact O-N 2.86Å
476F96.4Very high92Very high98 Ų9877.3 Ų77.343%0.4338%0.376SS..Hα-helixtrans-74.2-29.2176.6-77.3-71.4000113.3F397 Y403 I472 W473 E474 K479F397-F476 HydrophobicContact CE2-CE2 4.34Å; F397-F476 HydrophobicContact CZ-CE2 4.09Å; F397-F476 HydrophobicContact CZ-CZ 4.48Å; Y403-F476 AromaticContact CD2-CD1 3.64Å; Y403-F476 HydrophobicContact CD2-CD1 3.64Å; Y403-F476 AromaticContact CD2-CE1 3.67Å; Y403-F476 HydrophobicContact CD2-CE1 3.67Å; Y403-F476 AromaticContact CE2-CD1 3.6Å; Y403-F476 HydrophobicContact CE2-CD1 3.6Å; Y403-F476 AromaticContact CE2-CE1 3.77Å; Y403-F476 HydrophobicContact CE2-CE1 3.77Å; I472-F476 HydrophobicContact CG2-CD2 3.93Å; I472-F476 HydrophobicContact CG2-CE2 3.87Å; I472-F476 VanDerWaalsContact O-CD2 3.24Å; I472-F476 WeakPolarHBondContact O-CD2 3.24Å; I472-F476 PolarHBondContact O-N 3.36Å; W473-F476 PolarHBondContact O-N 2.98Å; E474-F476 PolarHBondContact O-N 3.06Å; F476-K479 VanDerWaalsContact O-CG 3.23Å; F476-K479 WeakPolarHBondContact O-CG 3.4Å
477A97.4Very high90.5Very high60 Ų6077.1 Ų77.150%0.49637%0.374SS..Hα-helixtrans-73.5-45.4174.900000111.7W473 E474W473-A477 WeakPolarHBondContact O-CB 3.14Å; W473-A477 PolarHBondContact O-N 3.45Å; E474-A477 PolarHBondContact O-N 3.29Å
478S95.5Very high88.7Confident48 Ų4878.5 Ų78.534%0.33639%0.385SS..Hα-helixtrans-75.2-25.7-18063.30000113.4E474 A475 R480E474-S478 VanDerWaalsContact O-CB 3.26Å; E474-S478 WeakPolarHBondContact O-CB 3.21Å; E474-S478 PolarHBondContact O-N 3.42Å; E474-S478 PolarHBondContact O-OG 3.29Å; E474-S478 PolarHBondContact OE1-OG 3.31Å; A475-S478 PolarHBondContact O-OG 3.08Å; S478-R480 PolarHBondContact O-N 3.04Å; S478-R480 VanDerWaalsContact OG-CZ 3.29Å; S478-R480 PolarHBondContact OG-NH1 3.42Å; S478-R480 PolarHBondContact OG-NH2 3.04Å
479K94Very high87Confident132 Ų13282.3 Ų82.357%0.57441%0.413SS*.THydrogen-bonded Turntrans52.835.9179.7-59.7-178-179.2175.90113.2Y403 A475 F476 K481Y403-K479 HydrophobicContact CD1-CB 4.31Å; Y403-K479 HydrophobicContact CE1-CB 3.71Å; Y403-K479 HydrophobicContact CE1-CG 4.18Å; A475-K479 PolarHBondContact O-N 2.86Å; F476-K479 VanDerWaalsContact O-CG 3.23Å; F476-K479 WeakPolarHBondContact O-CG 3.4Å; K479-K481 PolarHBondContact O-N 3.25Å
480R92.4Very high85.6Confident74 Ų7482.1 Ų82.128%0.27941%0.411SS..  trans-65.5101.1176.5-71.3-174-60.8-88.2-14.2110.2Y403 T404 E474 S478Y403-R480 CarbonylContact C-O 3.47Å; Y403-R480 WeakPolarHBondContact CA-O 3.27Å; T404-R480 PolarHBondContact N-O 2.96Å; T404-R480 PolarHBondContact O-NE 2.93Å; T404-R480 PolarHBondContact O-NH2 2.84Å; T404-R480 WeakPolarHBondContact OG1-CB 3.44Å; T404-R480 PolarHBondContact OG1-O 2.7Å; E474-R480 IonicContact OE1-CZ 2.95Å; E474-R480 IonicContact OE1-NH1 2.66Å; E474-R480 PolarHBondContact OE1-NH1 3.22Å; E474-R480 IonicContact OE1-NH2 2.61Å; E474-R480 IonicContact OE2-CZ 3.52Å; E474-R480 IonicContact OE2-NH1 3.32Å; E474-R480 PolarHBondContact OE2-NH1 2.75Å; E474-R480 IonicContact OE2-NH2 3.54Å; E474-R480 PolarHBondContact OE2-NH2 3.45Å; S478-R480 PolarHBondContact O-N 3.04Å; S478-R480 VanDerWaalsContact OG-CZ 3.29Å; S478-R480 PolarHBondContact OG-NH1 3.42Å; S478-R480 PolarHBondContact OG-NH2 3.04Å
481K90.6Very high85Confident153 Ų15380 Ų8067%0.66540%0.404SS*.BIsolated β-bridgetrans-72.4151.9-179.2-65.9-174.4179.1-177.70112Y403 K479 L483Y403-K481 HydrophobicContact CD1-CG 4.37Å; Y403-K481 HydrophobicContact CE1-CG 4.21Å; K479-K481 PolarHBondContact O-N 3.25Å; K481-L483 PolarHBondContact O-N 3.12Å
482V87.1Confident84.6Confident38 Ų3881.1 Ų81.123%0.2341%0.409CS..  trans-65.8123.4168.1-174.70000109.3P398 G402 T404 V485 C498P398-V482 HydrophobicContact CB-CG2 3.41Å; P398-V482 VanDerWaalsContact CB-CG2 3.41Å; G402-V482 PolarHBondContact O-N 2.84Å; T404-V482 HydrophobicContact CG2-CG2 3.91Å; V482-V485 HydrophobicContact CG1-CG2 4.06Å; V482-C498 HydrophobicContact CB-CB 4.28Å; V482-C498 HydrophobicContact CG2-CB 4.03Å
483L78.5Confident84.4Confident175 Ų17578.8 Ų78.892%0.91640%0.397SS*.  trans-86.8-43.6176.7-66.6174.6000111.7K481K481-L483 PolarHBondContact O-N 3.12Å
484M76.6Confident84.1Confident157 Ų15771.7 Ų71.777%0.77337%0.37SS*.  trans-154.9141.5179.5-172.5174.1178.200109.1
485V78.3Confident83.7Confident27 Ų2774.5 Ų74.516%0.16439%0.386CS..  trans-93.8128.7167-178.40000107.5V482 W494V482-V485 HydrophobicContact CG1-CG2 4.06Å; V485-W494 HydrophobicContact CG1-CB 3.94Å; V485-W494 HydrophobicContact CG1-CD2 3.8Å; V485-W494 HydrophobicContact CG1-CE3 3.95Å; V485-W494 HydrophobicContact CG1-CG 3.79Å; V485-W494 HydrophobicContact CG2-CD2 4.48Å; V485-W494 HydrophobicContact CG2-CE3 3.82Å; V485-W494 HydrophobicContact CG2-CZ3 4.4Å
486E67.9Low83.3Confident94 Ų9478.6 Ų78.644%0.43940%0.402SS..SBendtrans-74.3131.5175.4-62.8-178.116200109Y260 K333Y260-E486 VanDerWaalsContact CE2-O 3.3Å; Y260-E486 WeakPolarHBondContact CE2-O 3.29Å; Y260-E486 PolarHBondContact OH-N 3Å; Y260-E486 PolarHBondContact OH-O 3.33Å; K333-E486 IonicContact NZ-OE1 2.96Å; K333-E486 PolarHBondContact NZ-OE1 2.87Å; K333-E486 IonicContact NZ-OE2 3.34Å; K333-E486 PolarHBondContact NZ-OE2 3.22Å
487E65.1Low82.9Confident108 Ų10875.5 Ų75.551%0.50540%0.397SS..  trans60.157.1176.8-57-62.2156.900117S489E487-S489 PolarHBondContact O-N 2.99Å
488P60.3Low82.7Confident59 Ų5974.1 Ų74.138%0.38338%0.384SS..THydrogen-bonded Turntrans-69.8-16.9177.928.8-33.8000113.7M490P488-M490 VanDerWaalsContact C-N 3.27Å; P488-M490 PolarHBondContact O-N 2.92Å
489S61.9Low82.6Confident97 Ų9775.2 Ų75.268%0.67839%0.39SS*.THydrogen-bonded Turntrans-71.3-19.6-173.762.80000114.1E487E487-S489 PolarHBondContact O-N 2.99Å
490M70.2Confident82.5Confident79 Ų7969.6 Ų69.639%0.38937%0.367SS..THydrogen-bonded Turntrans-104.2-16.7-174.8-57.4-174.8-166.900113.7K265 P488K265-M490 HydrophobicContact CB-SD 4.06Å; K265-M490 HydrophobicContact CD-CE 4.37Å; K265-M490 HydrophobicContact CG-CE 3.81Å; K265-M490 HydrophobicContact CG-SD 3.68Å; P488-M490 VanDerWaalsContact C-N 3.27Å; P488-M490 PolarHBondContact O-N 2.92Å
491N85.1Confident82.6Confident33 Ų3369.4 Ų69.418%0.17638%0.375CS..  trans-127103.3-173.3-68.4-56.7000109.6E493 W494N491-E493 WeakPolarHBondContact CB-OE2 3.28Å; N491-E493 PolarHBondContact O-N 2.83Å; N491-E493 VanDerWaalsContact O-N 3.15Å; N491-W494 PolarHBondContact O-N 3.34Å
492L89.6Confident82.5Confident25 Ų2567.5 Ų67.513%0.13137%0.365CS..G310 helixtrans-59.2-27.9-173.1-68.3179.2000113.2L85 W494 L495 V509 M511L85-L492 WeakPolarHBondContact O-CB 3.32Å; L492-W494 PolarHBondContact O-N 3.46Å; L492-L495 VanDerWaalsContact O-CB 3.28Å; L492-L495 WeakPolarHBondContact O-CB 3.45Å; L492-L495 PolarHBondContact O-N 3.25Å; L492-L495 VanDerWaalsContact O-N 3.15Å; L492-V509 HydrophobicContact CD2-CG1 3.95Å; L492-M511 HydrophobicContact CD1-SD 4.21Å; L492-M511 HydrophobicContact CD2-SD 4.1Å; L492-M511 HydrophobicContact CG-SD 4.41Å
493E92.3Very high82.7Confident5 Ų571.8 Ų71.82%0.02338%0.382CS..G310 helixtrans-64.2-21.8-178.371.2-84.4-161.700113.8L85 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 4.31Å; L399-E493 WeakPolarHBondContact CD1-O 3.23Å; L399-E493 HydrophobicContact CD2-CB 4.09Å; L399-E493 HydrophobicContact CD2-CG 4.1Å; N491-E493 WeakPolarHBondContact CB-OE2 3.28Å; N491-E493 PolarHBondContact O-N 2.83Å; N491-E493 VanDerWaalsContact O-N 3.15Å
494W91.4Very high83.3Confident14 Ų1463.5 Ų63.55%0.05334%0.339CS..G310 helixtrans-93.8-4.9179.3-56.199.4000113.9H395 W396 L399 V485 N491 L492 Y496 G497 C498H395-W494 AromaticContact CE1-CZ2 3.83Å; H395-W494 AromaticContact NE2-CZ2 3.98Å; H395-W494 WeakPolarHBondContact O-CH2 3.39Å; W396-W494 AromaticContact CD1-CH2 3.97Å; W396-W494 AromaticContact CD1-CZ2 3.44Å; W396-W494 VanDerWaalsContact CD1-CZ2 3.44Å; W396-W494 HydrophobicContact CG-CZ2 4.41Å; W396-W494 AromaticContact NE1-CZ2 3.89Å; L399-W494 HydrophobicContact CB-CE3 4.19Å; L399-W494 HydrophobicContact CB-CH2 3.76Å; L399-W494 HydrophobicContact CB-CZ3 3.54Å; L399-W494 HydrophobicContact CD1-CE3 3.98Å; L399-W494 HydrophobicContact CD1-CZ3 4.2Å; L399-W494 HydrophobicContact CG-CZ3 4.38Å; V485-W494 HydrophobicContact CG1-CB 3.94Å; V485-W494 HydrophobicContact CG1-CD2 3.8Å; V485-W494 HydrophobicContact CG1-CE3 3.95Å; V485-W494 HydrophobicContact CG1-CG 3.79Å; V485-W494 HydrophobicContact CG2-CD2 4.48Å; V485-W494 HydrophobicContact CG2-CE3 3.82Å; V485-W494 HydrophobicContact CG2-CZ3 4.4Å; N491-W494 PolarHBondContact O-N 3.34Å; L492-W494 PolarHBondContact O-N 3.46Å; W494-Y496 PolarHBondContact O-N 3.17Å; W494-G497 PolarHBondContact O-N 3.07Å; W494-C498 VanDerWaalsContact CE3-SG 3.52Å
495L89.3Confident84Confident89 Ų8956.4 Ų56.447%0.46630%0.304SS..THydrogen-bonded Turntrans-62-38.9-170.5-176.963.8000113.3L492 F505L492-L495 VanDerWaalsContact O-CB 3.28Å; L492-L495 WeakPolarHBondContact O-CB 3.45Å; L492-L495 PolarHBondContact O-N 3.25Å; L492-L495 VanDerWaalsContact O-N 3.15Å; L495-F505 HydrophobicContact CD2-CE1 4.33Å
496Y89Confident84.3Confident86 Ų8663.1 Ų63.134%0.33733%0.333SS..THydrogen-bonded Turntrans-96.321.2-175.5-69.9-79000113.8W494 P500 P501 T504 F505W494-Y496 PolarHBondContact O-N 3.17Å; Y496-P500 WeakPolarHBondContact O-CA 3.49Å; Y496-P501 WeakPolarHBondContact O-CD 3.24Å; Y496-T504 HydrophobicContact CD1-CG2 4.35Å; Y496-T504 HydrophobicContact CD2-CG2 3.64Å; Y496-T504 HydrophobicContact CE2-CG2 4.29Å; Y496-T504 HydrophobicContact CG-CG2 3.67Å; Y496-F505 HydrophobicContact CD2-CE1 4.17Å; Y496-F505 HydrophobicContact CD2-CE2 4.39Å; Y496-F505 HydrophobicContact CD2-CZ 4.08Å; Y496-F505 AromaticContact CE2-CD1 3.53Å; Y496-F505 HydrophobicContact CE2-CD1 3.53Å; Y496-F505 HydrophobicContact CE2-CD2 4.3Å; Y496-F505 AromaticContact CE2-CE1 3.48Å; Y496-F505 HydrophobicContact CE2-CE1 3.48Å; Y496-F505 VanDerWaalsContact CE2-CE1 3.48Å; Y496-F505 HydrophobicContact CE2-CE2 4.2Å; Y496-F505 AromaticContact CE2-CG 3.98Å; Y496-F505 HydrophobicContact CE2-CG 3.98Å; Y496-F505 AromaticContact CE2-CZ 3.83Å; Y496-F505 HydrophobicContact CE2-CZ 3.83Å; Y496-F505 PolarHBondContact OH-N 3.19Å
497G88.4Confident84.9Confident32 Ų3266.3 Ų66.333%0.3335%0.348SS..  trans79.6-170.8176.500000114.3W494W494-G497 PolarHBondContact O-N 3.07Å
498C92.2Very high85.4Confident31 Ų3166 Ų6621%0.20936%0.355CS..SBendtrans-135.4105.8-169.9-67.80000110.8P398 G402 V482 W494P398-C498 WeakPolarHBondContact O-CB 3.07Å; G402-C498 VanDerWaalsContact CA-O 3.31Å; G402-C498 WeakPolarHBondContact CA-O 3.46Å; V482-C498 HydrophobicContact CB-CB 4.28Å; V482-C498 HydrophobicContact CG2-CB 4.03Å; W494-C498 VanDerWaalsContact CE3-SG 3.52Å
499P93.8Very high86Confident72 Ų7264.5 Ų64.547%0.46835%0.345SS..SBendcis-76.3155.9-5.934.2-35.2000112.3L399L399-P499 WeakPolarHBondContact O-CA 3.48Å
500P93.3Very high86.1Confident13 Ų1368.7 Ų68.78%0.08435%0.347CS..PPolyproline II helixtrans-66.8154.8174.527.7-34.1000111.7K13 W81 L85 L399 Y496 T504K13-P500 HydrophobicContact CD-CG 4.29Å; W81-P500 HydrophobicContact CZ3-CG 4.17Å; L85-P500 HydrophobicContact CD1-CG 4.44Å; L399-P500 HydrophobicContact CD1-CG 4.44Å; L399-P500 WeakPolarHBondContact O-CD 3.28Å; Y496-P500 WeakPolarHBondContact O-CA 3.49Å; P500-T504 HydrophobicContact CB-CG2 3.99Å
501P93.4Very high85.6Confident71 Ų7168.8 Ų68.846%0.46135%0.348SS..PPolyproline II helixtrans-58.7163.9172.3-20.131.9000111.9K13 Y496 H503K13-P501 PolarHBondContact NZ-O 3.38Å; Y496-P501 WeakPolarHBondContact O-CD 3.24Å; P501-H503 PolarHBondContact O-N 3.08Å
502Y89.5Confident84.1Confident113 Ų11375.9 Ų75.944%0.44338%0.377SS..SBendtrans-55.2-52.6178-78-79.9000112.3R5 N11 K13R5-Y502 WeakPolarHBondContact CD-OH 3.45Å; R5-Y502 PolarHBondContact NE-OH 3.5Å; R5-Y502 PolarHBondContact NH1-OH 2.81Å; R5-Y502 PolarHBondContact NH2-OH 2.9Å; N11-Y502 PolarHBondContact ND2-O 3.47Å; K13-Y502 PolarHBondContact NZ-O 3Å
503H90.9Very high82.2Confident127 Ų12782.9 Ų82.959%0.58843%0.428SS*.SBendtrans-98127.8174.3-59.2-66.2000109.3P501P501-H503 PolarHBondContact O-N 3.08Å
504T91.8Very high81.7Confident2 Ų286.8 Ų86.81%0.01245%0.448CS..  trans-127.2158176.5400000108K13 P90 Y496 P500 E506K13-T504 PolarHBondContact NZ-OG1 2.86Å; P90-T504 VanDerWaalsContact CA-O 3.26Å; P90-T504 WeakPolarHBondContact CA-O 3.37Å; P90-T504 WeakPolarHBondContact CB-O 3.31Å; Y496-T504 HydrophobicContact CD1-CG2 4.35Å; Y496-T504 HydrophobicContact CD2-CG2 3.64Å; Y496-T504 HydrophobicContact CE2-CG2 4.29Å; Y496-T504 HydrophobicContact CG-CG2 3.67Å; P500-T504 HydrophobicContact CB-CG2 3.99Å; T504-E506 PolarHBondContact O-N 3.4Å
505F90.1Very high81.1Confident8 Ų890.6 Ų90.64%0.03547%0.469CS..  trans57.643.3178.2-46.7-73.9000114L85 G88 A89 L495 Y496 E507 V509L85-F505 HydrophobicContact CD2-CE2 3.85Å; L85-F505 WeakPolarHBondContact O-CZ 3.24Å; G88-F505 WeakPolarHBondContact O-CB 3.33Å; G88-F505 WeakPolarHBondContact O-CG 3.38Å; A89-F505 WeakPolarHBondContact O-CD2 3.5Å; L495-F505 HydrophobicContact CD2-CE1 4.33Å; Y496-F505 HydrophobicContact CD2-CE1 4.17Å; Y496-F505 HydrophobicContact CD2-CE2 4.39Å; Y496-F505 HydrophobicContact CD2-CZ 4.08Å; Y496-F505 AromaticContact CE2-CD1 3.53Å; Y496-F505 HydrophobicContact CE2-CD1 3.53Å; Y496-F505 HydrophobicContact CE2-CD2 4.3Å; Y496-F505 AromaticContact CE2-CE1 3.48Å; Y496-F505 HydrophobicContact CE2-CE1 3.48Å; Y496-F505 VanDerWaalsContact CE2-CE1 3.48Å; Y496-F505 HydrophobicContact CE2-CE2 4.2Å; Y496-F505 AromaticContact CE2-CG 3.98Å; Y496-F505 HydrophobicContact CE2-CG 3.98Å; Y496-F505 AromaticContact CE2-CZ 3.83Å; Y496-F505 HydrophobicContact CE2-CZ 3.83Å; Y496-F505 PolarHBondContact OH-N 3.19Å; F505-E507 CarbonylContact C-O 3.41Å; F505-E507 PolarHBondContact O-N 3.24Å; F505-V509 HydrophobicContact CD1-CG2 3.16Å; F505-V509 HydrophobicContact CE1-CG2 3.32Å; F505-V509 HydrophobicContact CG-CG2 4.34Å
506E84.7Confident80.7Confident168 Ų16890.7 Ų90.779%0.78547%0.469SS*.SBendtrans-59.3-32.5170.7-66.6-175.217900111.4T504T504-E506 PolarHBondContact O-N 3.4Å
507E81.2Confident80.2Confident160 Ų16090.9 Ų90.975%0.74848%0.477SS*.SBendtrans-107.7139.5167-64.4-175.6173.700110F505 V509F505-E507 CarbonylContact C-O 3.41Å; F505-E507 PolarHBondContact O-N 3.24Å; E507-V509 PolarHBondContact O-N 3.17Å
508P75.8Confident79.7Confident102 Ų10294.6 Ų94.666%0.66249%0.486SS*.  trans-60.8133.8178.8-21.431.7000111.9Y510P508-Y510 PolarHBondContact O-N 2.63Å
509V72.9Confident78.9Confident27 Ų2798.9 Ų98.916%0.16450%0.504CS..  trans-64.7121.6174.8-169.90000109.8L492 F505 E507 M511L492-V509 HydrophobicContact CD2-CG1 3.95Å; F505-V509 HydrophobicContact CD1-CG2 3.16Å; F505-V509 HydrophobicContact CE1-CG2 3.32Å; F505-V509 HydrophobicContact CG-CG2 4.34Å; E507-V509 PolarHBondContact O-N 3.17Å; V509-M511 HydrophobicContact CG1-CG 4.18Å; V509-M511 PolarHBondContact O-N 3.1Å
510Y64.1Low77.8Confident185 Ų185100.8 Ų100.873%0.72551%0.507SS*.  trans-86.699.1169.5-161.6-91.2000109.9P508 K512P508-Y510 PolarHBondContact O-N 2.63Å; Y510-K512 HydrophobicContact CD1-CG 4.23Å; Y510-K512 HydrophobicContact CE1-CG 4.03Å
511M58.6Low76.6Confident81 Ų81107.5 Ų107.540%0.39954%0.54SS..  trans-82114.7172.5-66.4-99.9-73.500108.7M176 L492 V509M176-M511 HydrophobicContact CE-CE 4.07Å; L492-M511 HydrophobicContact CD1-SD 4.21Å; L492-M511 HydrophobicContact CD2-SD 4.1Å; L492-M511 HydrophobicContact CG-SD 4.41Å; V509-M511 HydrophobicContact CG1-CG 4.18Å; V509-M511 PolarHBondContact O-N 3.1Å
512K54Low75.2Confident183 Ų183110.6 Ų110.680%0.79655%0.546SS*.  trans-75.2124.4163.3-80.9-176.6177.4178.30107.6Y510Y510-K512 HydrophobicContact CD1-CG 4.23Å; Y510-K512 HydrophobicContact CE1-CG 4.03Å
513S48.7Very low73.9Confident171 Ų171110.4 Ų110.4100%1.19656%0.555SS**  trans-42.50-177.4590000114.9

Retrieved 513 of 513 residues in 419.1 ms (Link to these results)