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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 A0A059R5S6, Species HUMAN (Homo sapiens, Human), Gene COX1, Length 512 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
1F91.8Very high95.4Very high187 Ų18772.9 Ų72.982%0.8235%0.354SS*.  0-60.40-179.4-93.3000110.6D3 R4 W5F1-D3 PolarHBondContact O-N 3.38Å; F1-R4 PolarHBondContact O-N 3.23Å; F1-W5 AromaticContact CD2-CD1 3.51Å; F1-W5 AromaticContact CE2-CD1 3.46Å; F1-W5 VanDerWaalsContact CE2-CD1 3.46Å; F1-W5 HydrophobicContact CE2-CG 4.31Å; F1-W5 AromaticContact CE2-NE1 3.96Å; F1-W5 PolarHBondContact O-N 2.92Å; F1-W5 VanDerWaalsContact O-N 3.13Å
2A93.6Very high95.7Very high39 Ų3967.3 Ų67.332%0.32233%0.327SS..Hα-helixtrans-54.2-47.7-179.200000113.4R4 W5 L6 F7A2-R4 VanDerWaalsContact C-N 3.28Å; A2-R4 PolarHBondContact O-N 3.45Å; A2-W5 PolarHBondContact O-N 2.83Å; A2-L6 HydrophobicContact CB-CD1 4.13Å; A2-L6 WeakPolarHBondContact O-CA 3.25Å; A2-L6 WeakPolarHBondContact O-CB 3.48Å; A2-L6 PolarHBondContact O-N 3.25Å; A2-F7 PolarHBondContact O-N 2.85Å
3D93.2Very high95.9Very high126 Ų12662.8 Ų62.867%0.67431%0.306SS*.Hα-helixtrans-59.6-38.9-179.2-54.7-40000113.1F1 F7 S8F1-D3 PolarHBondContact O-N 3.38Å; D3-F7 CarbonylContact O-C 3.59Å; D3-F7 VanDerWaalsContact O-C 3.22Å; D3-S8 PolarHBondContact O-N 3.13Å
4R93Very high96.1Very high97 Ų9758.4 Ų58.437%0.36628%0.284SS..Hα-helixtrans-75.4-41.1-177.4-177.1177172.3-169-2.6112.8F1 A2 S8 D13 Y501F1-R4 PolarHBondContact O-N 3.23Å; A2-R4 VanDerWaalsContact C-N 3.28Å; A2-R4 PolarHBondContact O-N 3.45Å; R4-S8 WeakPolarHBondContact O-CB 3.23Å; R4-S8 PolarHBondContact O-OG 3.21Å; R4-D13 VanDerWaalsContact CG-OD2 3.27Å; R4-D13 WeakPolarHBondContact CG-OD2 3.35Å; R4-D13 IonicContact CZ-OD1 2.61Å; R4-D13 IonicContact NE-OD1 3.94Å; R4-D13 PolarHBondContact NE-OD1 3.48Å; R4-D13 IonicContact NE-OD2 2.67Å; R4-D13 PolarHBondContact NE-OD2 2.87Å; R4-D13 IonicContact NH2-OD1 2.7Å; R4-D13 PolarHBondContact NH2-OD1 3.28Å; R4-Y501 PolarHBondContact NH1-OH 2.82Å; R4-Y501 PolarHBondContact NH2-OH 3.42Å
5W95.8Very high96.2Very high56 Ų5654.5 Ų54.521%0.21227%0.265CS..Hα-helixtrans-107-37.1-168.8-62.7114.1000113.8F1 A2 D13 T16 L17F1-W5 AromaticContact CD2-CD1 3.51Å; F1-W5 AromaticContact CE2-CD1 3.46Å; F1-W5 VanDerWaalsContact CE2-CD1 3.46Å; F1-W5 HydrophobicContact CE2-CG 4.31Å; F1-W5 AromaticContact CE2-NE1 3.96Å; F1-W5 PolarHBondContact O-N 2.92Å; F1-W5 VanDerWaalsContact O-N 3.13Å; A2-W5 PolarHBondContact O-N 2.83Å; W5-D13 HydrophobicContact CE3-CB 4.27Å; W5-D13 HydrophobicContact CZ3-CB 4.02Å; W5-T16 HydrophobicContact CH2-CG2 4.41Å; W5-T16 HydrophobicContact CZ3-CG2 4.34Å; W5-L17 HydrophobicContact CE3-CD1 4.5Å; W5-L17 HydrophobicContact CE3-CD2 3.95Å; W5-L17 HydrophobicContact CE3-CG 4.1Å; W5-L17 HydrophobicContact CZ3-CD2 4.5Å; W5-L17 HydrophobicContact CZ3-CG 4.48Å; W5-L17 WeakPolarHBondContact O-CD1 3.29Å
6L95.3Very high96.4Very high71 Ų7153.3 Ų53.337%0.37226%0.262SS..THydrogen-bonded Turntrans-88-44.4179.4-56.7179.5000111A2 N98 W102A2-L6 HydrophobicContact CB-CD1 4.13Å; A2-L6 WeakPolarHBondContact O-CA 3.25Å; A2-L6 WeakPolarHBondContact O-CB 3.48Å; A2-L6 PolarHBondContact O-N 3.25Å; L6-N98 PolarHBondContact O-ND2 3.43Å; L6-N98 VanDerWaalsContact O-ND2 3.11Å; L6-W102 HydrophobicContact CD2-CH2 3.44Å; L6-W102 VanDerWaalsContact CD2-CH2 3.44Å; L6-W102 HydrophobicContact CD2-CZ2 3.46Å; L6-W102 VanDerWaalsContact CD2-CZ2 3.46Å; L6-W102 HydrophobicContact CD2-CZ3 4.5Å; L6-W102 PolarHBondContact O-NE1 3.48Å
7F97Very high96.5Very high143 Ų14351.5 Ų51.563%0.62725%0.254SS*.SBendtrans-103.326-179.1-51.2-40.1000112.7A2 D3A2-F7 PolarHBondContact O-N 2.85Å; D3-F7 CarbonylContact O-C 3.59Å; D3-F7 VanDerWaalsContact O-C 3.22Å
8S96.8Very high96.6Very high5 Ų549.1 Ų49.14%0.03524%0.241CC..  trans-59.5143.8-178.1-152.40000111.7D3 R4 N10 D13 N98D3-S8 PolarHBondContact O-N 3.13Å; R4-S8 WeakPolarHBondContact O-CB 3.23Å; R4-S8 PolarHBondContact O-OG 3.21Å; S8-N10 PolarHBondContact OG-N 2.99Å; S8-D13 WeakPolarHBondContact OG-CB 3.3Å; S8-N98 VanDerWaalsContact O-CB 3.29Å; S8-N98 WeakPolarHBondContact O-CB 3.26Å; S8-N98 VanDerWaalsContact O-CG 3.22Å; S8-N98 PolarHBondContact O-ND2 2.9Å
9T97.1Very high96.7Very high68 Ų6847.9 Ų47.942%0.41724%0.236SC..  trans-117.7-5163.255.40000111.8D90 P94 R95T9-D90 VanDerWaalsContact O-OD2 3.1Å; T9-P94 HydrophobicContact CG2-CB 4.23Å; T9-P94 WeakPolarHBondContact O-CB 3.41Å; T9-R95 HydrophobicContact CG2-CG 4.1Å
10N97.9Very high96.8Very high10 Ų1051.2 Ų51.25%0.05325%0.254CS..  trans-83.4127.2-174.6-172.6-75.6000110.9S8 K12 D13 I14 Y501S8-N10 PolarHBondContact OG-N 2.99Å; N10-K12 PolarHBondContact O-N 3.37Å; N10-K12 WeakPolarHBondContact OD1-CA 3.2Å; N10-K12 WeakPolarHBondContact OD1-CB 3.25Å; N10-K12 PolarHBondContact OD1-N 2.78Å; N10-D13 HydrophobicContact CB-CB 4.4Å; N10-D13 PolarHBondContact O-N 3.41Å; N10-I14 WeakPolarHBondContact O-CG1 3.35Å; N10-I14 PolarHBondContact O-N 3.21Å; N10-Y501 PolarHBondContact ND2-O 3.35Å
11H98.1Very high96.9Very high0 Ų049.9 Ų49.90%025%0.247CC..Hα-helixtrans-56.7-29.7178.870.8103000114.9G15 N79 P83 D90 M91H11-G15 WeakPolarHBondContact O-CA 3.42Å; H11-G15 PolarHBondContact O-N 2.87Å; H11-N79 PolarHBondContact ND1-O 3.22Å; H11-P83 HydrophobicContact CB-CG 4.24Å; H11-D90 VanDerWaalsContact CB-OD1 3.26Å; H11-D90 WeakPolarHBondContact CB-OD1 3.23Å; H11-D90 IonicContact CD2-OD1 3.44Å; H11-D90 PolarHBondContact CD2-OD1 2.67Å; H11-D90 VanDerWaalsContact CD2-OD1 3.31Å; H11-D90 IonicContact CG-OD1 3.36Å; H11-D90 PolarHBondContact N-OD1 3.31Å; H11-M91 HydrophobicContact CB-CG 3.8Å
12K98.3Very high97.2Very high6 Ų641 Ų413%0.02621%0.208CC..Hα-helixtrans-74.9-41.9179.9-56.3166-177.6145.90111.5N10 T16 W80 P499 P500 Y501 T503N10-K12 PolarHBondContact O-N 3.37Å; N10-K12 WeakPolarHBondContact OD1-CA 3.2Å; N10-K12 WeakPolarHBondContact OD1-CB 3.25Å; N10-K12 PolarHBondContact OD1-N 2.78Å; K12-T16 WeakPolarHBondContact O-CB 3.35Å; K12-T16 PolarHBondContact O-N 3.47Å; K12-T16 PolarHBondContact O-OG1 3.29Å; K12-W80 HydrophobicContact CB-CD2 4.21Å; K12-W80 HydrophobicContact CB-CE3 4.06Å; K12-W80 HydrophobicContact CB-CH2 3.73Å; K12-W80 HydrophobicContact CB-CZ2 3.86Å; K12-W80 HydrophobicContact CB-CZ3 3.83Å; K12-W80 HydrophobicContact CD-CH2 4.48Å; K12-W80 HydrophobicContact CD-CZ3 4.07Å; K12-W80 HydrophobicContact CG-CD2 4.41Å; K12-W80 HydrophobicContact CG-CE3 3.88Å; K12-W80 HydrophobicContact CG-CH2 4.16Å; K12-W80 HydrophobicContact CG-CZ3 3.74Å; K12-W80 PolarHBondContact O-NE1 3.41Å; K12-W80 VanDerWaalsContact O-NE1 3.17Å; K12-P499 HydrophobicContact CD-CG 4.32Å; K12-P500 PolarHBondContact NZ-O 3.39Å; K12-Y501 PolarHBondContact NZ-O 3.47Å; K12-T503 PolarHBondContact NZ-OG1 2.79Å
13D98.3Very high97.5Very high9 Ų941.7 Ų41.75%0.04821%0.214CC..Hα-helixtrans-66.1-46.6175.6-73.6-30.6000110R4 W5 S8 N10 T16 L17R4-D13 VanDerWaalsContact CG-OD2 3.27Å; R4-D13 WeakPolarHBondContact CG-OD2 3.35Å; R4-D13 IonicContact CZ-OD1 2.61Å; R4-D13 IonicContact NE-OD1 3.94Å; R4-D13 PolarHBondContact NE-OD1 3.48Å; R4-D13 IonicContact NE-OD2 2.67Å; R4-D13 PolarHBondContact NE-OD2 2.87Å; R4-D13 IonicContact NH2-OD1 2.7Å; R4-D13 PolarHBondContact NH2-OD1 3.28Å; W5-D13 HydrophobicContact CE3-CB 4.27Å; W5-D13 HydrophobicContact CZ3-CB 4.02Å; S8-D13 WeakPolarHBondContact OG-CB 3.3Å; N10-D13 HydrophobicContact CB-CB 4.4Å; N10-D13 PolarHBondContact O-N 3.41Å; D13-T16 WeakPolarHBondContact O-CB 3.43Å; D13-T16 PolarHBondContact O-N 3.36Å; D13-T16 VanDerWaalsContact O-N 3.17Å; D13-L17 WeakPolarHBondContact O-CG 3.13Å; D13-L17 PolarHBondContact O-N 3.47Å
14I98.7Very high97.7Very high0 Ų042.9 Ų42.90%021%0.209CC..Hα-helixtrans-62.6-45.1176.5-64.4165.8000111N10 T16 L17 Y18 N97 N98 F101N10-I14 WeakPolarHBondContact O-CG1 3.35Å; N10-I14 PolarHBondContact O-N 3.21Å; I14-T16 VanDerWaalsContact C-N 3.26Å; I14-T16 PolarHBondContact O-N 2.98Å; I14-L17 WeakPolarHBondContact O-CB 3.27Å; I14-L17 PolarHBondContact O-N 3.07Å; I14-L17 VanDerWaalsContact O-N 3.1Å; I14-Y18 HydrophobicContact CG2-CD2 3.84Å; I14-Y18 HydrophobicContact CG2-CE2 3.59Å; I14-Y18 VanDerWaalsContact O-CD2 3.26Å; I14-Y18 WeakPolarHBondContact O-CD2 3.22Å; I14-Y18 PolarHBondContact O-N 2.82Å; I14-N97 HydrophobicContact CD1-CB 4.05Å; I14-N98 HydrophobicContact CD1-CB 3.91Å; I14-F101 HydrophobicContact CG2-CB 4.18Å
15G98.4Very high98Very high0 Ų038.2 Ų38.20%019%0.191CC..Hα-helixtrans-58.8-37.3174.400000112.5H11 Y18 L19 G76H11-G15 WeakPolarHBondContact O-CA 3.42Å; H11-G15 PolarHBondContact O-N 2.87Å; G15-Y18 PolarHBondContact O-N 2.98Å; G15-L19 WeakPolarHBondContact O-CG 3.44Å; G15-L19 PolarHBondContact O-N 3.34Å; G15-G76 WeakPolarHBondContact O-CA 3.49Å
16T98.6Very high98.1Very high36 Ų3635.8 Ų35.822%0.22118%0.184CC..Hα-helixtrans-65.3-41.8174-57.40000111.7W5 K12 D13 I14 Y18 L19 L20 W80W5-T16 HydrophobicContact CH2-CG2 4.41Å; W5-T16 HydrophobicContact CZ3-CG2 4.34Å; K12-T16 WeakPolarHBondContact O-CB 3.35Å; K12-T16 PolarHBondContact O-N 3.47Å; K12-T16 PolarHBondContact O-OG1 3.29Å; D13-T16 WeakPolarHBondContact O-CB 3.43Å; D13-T16 PolarHBondContact O-N 3.36Å; D13-T16 VanDerWaalsContact O-N 3.17Å; I14-T16 VanDerWaalsContact C-N 3.26Å; I14-T16 PolarHBondContact O-N 2.98Å; T16-Y18 VanDerWaalsContact C-N 3.34Å; T16-Y18 PolarHBondContact O-N 3.41Å; T16-L19 PolarHBondContact O-N 2.71Å; T16-L20 HydrophobicContact CG2-CD1 4.16Å; T16-L20 HydrophobicContact CG2-CG 4.41Å; T16-L20 WeakPolarHBondContact O-CG 3.3Å; T16-L20 PolarHBondContact O-N 3.43Å; T16-W80 VanDerWaalsContact OG1-CZ2 3.3Å; T16-W80 WeakPolarHBondContact OG1-CZ2 3.4Å; T16-W80 PolarHBondContact OG1-NE1 3.35Å; T16-W80 VanDerWaalsContact OG1-NE1 3.1Å
17L98.7Very high98.2Very high23 Ų2335.9 Ų35.912%0.1219%0.187CC..Hα-helixtrans-60.5-42.9176-68.9173.4000111.7W5 D13 I14 L20 F21 F101W5-L17 HydrophobicContact CE3-CD1 4.5Å; W5-L17 HydrophobicContact CE3-CD2 3.95Å; W5-L17 HydrophobicContact CE3-CG 4.1Å; W5-L17 HydrophobicContact CZ3-CD2 4.5Å; W5-L17 HydrophobicContact CZ3-CG 4.48Å; W5-L17 WeakPolarHBondContact O-CD1 3.29Å; D13-L17 WeakPolarHBondContact O-CG 3.13Å; D13-L17 PolarHBondContact O-N 3.47Å; I14-L17 WeakPolarHBondContact O-CB 3.27Å; I14-L17 PolarHBondContact O-N 3.07Å; I14-L17 VanDerWaalsContact O-N 3.1Å; L17-L20 PolarHBondContact O-N 2.85Å; L17-F21 VanDerWaalsContact O-CB 3.27Å; L17-F21 WeakPolarHBondContact O-CB 3.27Å; L17-F21 PolarHBondContact O-N 3.06Å; L17-F101 VanDerWaalsContact C-CE2 3.48Å; L17-F101 HydrophobicContact CB-CD1 4.1Å; L17-F101 HydrophobicContact CB-CD2 4Å; L17-F101 HydrophobicContact CB-CE1 3.77Å; L17-F101 HydrophobicContact CB-CE2 3.66Å; L17-F101 HydrophobicContact CB-CG 4.22Å; L17-F101 HydrophobicContact CB-CZ 3.55Å; L17-F101 HydrophobicContact CD1-CD1 3.93Å; L17-F101 HydrophobicContact CD1-CE1 3.81Å; L17-F101 HydrophobicContact CD1-CZ 4.44Å; L17-F101 HydrophobicContact CD2-CE1 4.47Å; L17-F101 HydrophobicContact CD2-CZ 4.5Å; L17-F101 HydrophobicContact CG-CE1 4.23Å; L17-F101 HydrophobicContact CG-CZ 4.38Å; L17-F101 WeakPolarHBondContact O-CE2 2.96Å
18Y98.8Very high98.2Very high8 Ų831 Ų313%0.03117%0.167CC..Hα-helixtrans-60.8-44.4173.6-82.9-73000112.9I14 G15 T16 G22 P71 G75 S100 F101 L104I14-Y18 HydrophobicContact CG2-CD2 3.84Å; I14-Y18 HydrophobicContact CG2-CE2 3.59Å; I14-Y18 VanDerWaalsContact O-CD2 3.26Å; I14-Y18 WeakPolarHBondContact O-CD2 3.22Å; I14-Y18 PolarHBondContact O-N 2.82Å; G15-Y18 PolarHBondContact O-N 2.98Å; T16-Y18 VanDerWaalsContact C-N 3.34Å; T16-Y18 PolarHBondContact O-N 3.41Å; Y18-G22 PolarHBondContact O-N 2.83Å; Y18-P71 HydrophobicContact CD1-CB 4.07Å; Y18-G75 VanDerWaalsContact CB-C 3.41Å; Y18-G75 VanDerWaalsContact CD2-C 3.49Å; Y18-G75 VanDerWaalsContact CD2-O 3.23Å; Y18-G75 WeakPolarHBondContact CD2-O 3.48Å; Y18-G75 VanDerWaalsContact CG-C 3.43Å; Y18-G75 VanDerWaalsContact CG-CA 3.43Å; Y18-S100 VanDerWaalsContact OH-C 3.24Å; Y18-S100 WeakPolarHBondContact OH-CB 3.34Å; Y18-S100 PolarHBondContact OH-OG 3.02Å; Y18-F101 AromaticContact CD1-CD2 3.86Å; Y18-F101 HydrophobicContact CD1-CD2 3.86Å; Y18-F101 HydrophobicContact CD2-CB 4.33Å; Y18-F101 HydrophobicContact CD2-CD2 4.11Å; Y18-F101 HydrophobicContact CE1-CB 4.27Å; Y18-F101 HydrophobicContact CE1-CD2 4.03Å; Y18-F101 HydrophobicContact CE2-CB 3.71Å; Y18-F101 HydrophobicContact CE2-CD2 4.25Å; Y18-F101 HydrophobicContact CE2-CG 4.43Å; Y18-F101 AromaticContact CG-CD2 3.91Å; Y18-F101 HydrophobicContact CG-CD2 3.91Å; Y18-F101 WeakPolarHBondContact OH-CA 3.32Å; Y18-F101 PolarHBondContact OH-N 3.34Å; Y18-L104 HydrophobicContact CD1-CD1 3.87Å; Y18-L104 HydrophobicContact CE1-CD1 3.46Å; Y18-L104 VanDerWaalsContact CE1-CD1 3.46Å
19L98.7Very high98.3Very high26 Ų2630.8 Ų30.814%0.13617%0.165CC..Hα-helixtrans-62.1-43.7177.9-70.7175.2000111.7G15 T16 A23 I72 F77 F399G15-L19 WeakPolarHBondContact O-CG 3.44Å; G15-L19 PolarHBondContact O-N 3.34Å; T16-L19 PolarHBondContact O-N 2.71Å; L19-A23 VanDerWaalsContact O-CB 3.22Å; L19-A23 WeakPolarHBondContact O-CB 3.44Å; L19-A23 PolarHBondContact O-N 3.38Å; L19-I72 HydrophobicContact CD2-CG2 3.96Å; L19-F77 HydrophobicContact CD2-CE2 4.48Å; L19-F399 HydrophobicContact CD1-CD2 4.11Å; L19-F399 HydrophobicContact CD1-CE2 4.08Å
20L98.6Very high98.3Very high113 Ų11328.9 Ų28.959%0.59215%0.154SC*.Hα-helixtrans-67.1-46.2178.5-69.1175.6000112T16 L17 A23 W24T16-L20 HydrophobicContact CG2-CD1 4.16Å; T16-L20 HydrophobicContact CG2-CG 4.41Å; T16-L20 WeakPolarHBondContact O-CG 3.3Å; T16-L20 PolarHBondContact O-N 3.43Å; L17-L20 PolarHBondContact O-N 2.85Å; L20-A23 PolarHBondContact O-N 3.27Å; L20-W24 PolarHBondContact O-N 2.79Å
21F98.8Very high98.3Very high25 Ų2530.7 Ų30.711%0.1117%0.17CC..Hα-helixtrans-59.5-49.8176.7174.9-95.6000111.3L17 A23 W24 A25 F67 P71 F101 L104 P105 L108L17-F21 VanDerWaalsContact O-CB 3.27Å; L17-F21 WeakPolarHBondContact O-CB 3.27Å; L17-F21 PolarHBondContact O-N 3.06Å; F21-A23 VanDerWaalsContact C-N 3.35Å; F21-A23 PolarHBondContact O-N 2.84Å; F21-W24 PolarHBondContact O-N 3.19Å; F21-A25 WeakPolarHBondContact O-CB 3.36Å; F21-A25 PolarHBondContact O-N 3.41Å; F21-F67 HydrophobicContact CE1-CB 4.17Å; F21-F67 AromaticContact CE1-CD1 3.94Å; F21-F67 HydrophobicContact CE1-CD1 3.94Å; F21-F67 HydrophobicContact CZ-CB 4.46Å; F21-F67 AromaticContact CZ-CD1 3.77Å; F21-F67 HydrophobicContact CZ-CD1 3.77Å; F21-P71 HydrophobicContact CD1-CB 4.15Å; F21-P71 HydrophobicContact CD1-CG 4.31Å; F21-P71 HydrophobicContact CE1-CG 4.23Å; F21-F101 HydrophobicContact CB-CE2 3.9Å; F21-F101 HydrophobicContact CB-CZ 4.44Å; F21-F101 HydrophobicContact CG-CE2 4.36Å; F21-L104 HydrophobicContact CD1-CB 4.45Å; F21-L104 HydrophobicContact CD1-CD1 4.28Å; F21-L104 HydrophobicContact CE1-CB 3.84Å; F21-L104 HydrophobicContact CE1-CD1 4.08Å; F21-L104 HydrophobicContact CE2-CB 4.47Å; F21-L104 HydrophobicContact CZ-CB 3.83Å; F21-P105 HydrophobicContact CD2-CG 4.36Å; F21-P105 HydrophobicContact CE2-CB 4.47Å; F21-P105 HydrophobicContact CE2-CG 4.25Å; F21-L108 HydrophobicContact CE2-CB 4.27Å; F21-L108 HydrophobicContact CE2-CD2 3.69Å; F21-L108 HydrophobicContact CZ-CB 3.93Å; F21-L108 HydrophobicContact CZ-CD2 3.62Å; F21-L108 HydrophobicContact CZ-CG 4.43Å
22G98.5Very high98.3Very high0 Ų032 Ų320%018%0.177CC..Hα-helixtrans-65.9-35.6-18000000113.1Y18 G26 F67Y18-G22 PolarHBondContact O-N 2.83Å; G22-G26 PolarHBondContact O-N 3.3Å; G22-F67 WeakPolarHBondContact CA-O 3.23Å
23A98.1Very high98.3Very high54 Ų5432.9 Ų32.945%0.44618%0.184SC..Hα-helixtrans-64.2-43.9173.100000111.7L19 L20 F21 G26 V27L19-A23 VanDerWaalsContact O-CB 3.22Å; L19-A23 WeakPolarHBondContact O-CB 3.44Å; L19-A23 PolarHBondContact O-N 3.38Å; L20-A23 PolarHBondContact O-N 3.27Å; F21-A23 VanDerWaalsContact C-N 3.35Å; F21-A23 PolarHBondContact O-N 2.84Å; A23-G26 PolarHBondContact O-N 3.34Å; A23-V27 PolarHBondContact O-N 2.99Å; A23-V27 VanDerWaalsContact O-N 3.09Å
24W98.4Very high98.3Very high150 Ų15033.8 Ų33.857%0.56819%0.189SC*.Hα-helixtrans-62.8-48.1176.2-17590.5000111.8L20 F21 G26 V27 L28 L108 L112L20-W24 PolarHBondContact O-N 2.79Å; F21-W24 PolarHBondContact O-N 3.19Å; W24-G26 VanDerWaalsContact C-N 3.27Å; W24-G26 PolarHBondContact O-N 2.84Å; W24-V27 PolarHBondContact O-N 3.26Å; W24-L28 HydrophobicContact CH2-CD2 4.21Å; W24-L28 HydrophobicContact CZ3-CD2 3.89Å; W24-L28 PolarHBondContact O-N 3.41Å; W24-L28 VanDerWaalsContact O-N 3.13Å; W24-L108 HydrophobicContact CE3-CD2 4.07Å; W24-L108 HydrophobicContact CZ3-CD2 3.67Å; W24-L112 HydrophobicContact CH2-CD1 4.37Å
25A98.5Very high98.2Very high0 Ų037.6 Ų37.60%021%0.209CC..Hα-helixtrans-61.3-36.4175.700000111.8F21 L28 G29 V63 F67 L108F21-A25 WeakPolarHBondContact O-CB 3.36Å; F21-A25 PolarHBondContact O-N 3.41Å; A25-L28 WeakPolarHBondContact O-CB 3.36Å; A25-L28 PolarHBondContact O-N 2.67Å; A25-G29 PolarHBondContact O-N 3.43Å; A25-V63 HydrophobicContact CB-CG1 4.28Å; A25-V63 WeakPolarHBondContact O-CG1 3.37Å; A25-F67 HydrophobicContact CB-CB 3.87Å; A25-F67 VanDerWaalsContact CB-O 3.31Å; A25-F67 WeakPolarHBondContact CB-O 3.36Å; A25-L108 HydrophobicContact CB-CD2 4.29Å
26G97.6Very high98.2Very high5 Ų538.6 Ų38.65%0.05221%0.214CC..Hα-helixtrans-63.8-38.8175.400000113.5G22 A23 W24 G29 T30G22-G26 PolarHBondContact O-N 3.3Å; A23-G26 PolarHBondContact O-N 3.34Å; W24-G26 VanDerWaalsContact C-N 3.27Å; W24-G26 PolarHBondContact O-N 2.84Å; G26-G29 PolarHBondContact O-N 3.04Å; G26-T30 WeakPolarHBondContact O-CB 3.3Å; G26-T30 PolarHBondContact O-N 3.05Å; G26-T30 PolarHBondContact O-OG1 2.73Å
27V97.9Very high98.2Very high72 Ų7237.5 Ų37.544%0.43621%0.206SC..Hα-helixtrans-64.6-44.2173.4173.80000110.5A23 W24 T30 A31A23-V27 PolarHBondContact O-N 2.99Å; A23-V27 VanDerWaalsContact O-N 3.09Å; W24-V27 PolarHBondContact O-N 3.26Å; V27-T30 PolarHBondContact O-N 3.41Å; V27-A31 PolarHBondContact O-N 2.98Å
28L98.4Very high98.1Very high41 Ų4137.9 Ų37.922%0.21521%0.212CC..Hα-helixtrans-59.5-49.2174.6169.166.7000111.8W24 A25 T30 A31 L32 V63 L112W24-L28 HydrophobicContact CH2-CD2 4.21Å; W24-L28 HydrophobicContact CZ3-CD2 3.89Å; W24-L28 PolarHBondContact O-N 3.41Å; W24-L28 VanDerWaalsContact O-N 3.13Å; A25-L28 WeakPolarHBondContact O-CB 3.36Å; A25-L28 PolarHBondContact O-N 2.67Å; L28-T30 VanDerWaalsContact C-N 3.29Å; L28-T30 PolarHBondContact O-N 3.15Å; L28-A31 WeakPolarHBondContact O-CB 3.46Å; L28-A31 PolarHBondContact O-N 3.43Å; L28-A31 VanDerWaalsContact O-N 3.14Å; L28-L32 WeakPolarHBondContact O-CG 3.42Å; L28-L32 PolarHBondContact O-N 3.34Å; L28-V63 HydrophobicContact CD2-CG1 4.25Å; L28-V63 HydrophobicContact CD2-CG2 4.22Å; L28-V63 HydrophobicContact CG-CG1 4.32Å; L28-L112 HydrophobicContact CD2-CD1 4.18Å; L28-L112 HydrophobicContact CD2-CD2 3.86Å; L28-L112 HydrophobicContact CD2-CG 4.47Å
29G97.9Very high98Very high0 Ų037.6 Ų37.60%021%0.211CC..Hα-helixtrans-61.6-37.317800000112.4A25 G26 L32 S33 H60A25-G29 PolarHBondContact O-N 3.43Å; G26-G29 PolarHBondContact O-N 3.04Å; G29-L32 PolarHBondContact O-N 3.33Å; G29-S33 PolarHBondContact O-N 2.74Å; G29-H60 PolarHBondContact O-ND1 2.9Å
30T96.9Very high98Very high29 Ų2936.4 Ų36.418%0.17821%0.205CC..Hα-helixtrans-64.8-42.8173.4-57.40000111.3G26 V27 L28 L32 S33 L34 V464G26-T30 WeakPolarHBondContact O-CB 3.3Å; G26-T30 PolarHBondContact O-N 3.05Å; G26-T30 PolarHBondContact O-OG1 2.73Å; V27-T30 PolarHBondContact O-N 3.41Å; L28-T30 VanDerWaalsContact C-N 3.29Å; L28-T30 PolarHBondContact O-N 3.15Å; T30-L32 VanDerWaalsContact C-N 3.33Å; T30-L32 PolarHBondContact O-N 3.1Å; T30-S33 WeakPolarHBondContact O-CB 3.39Å; T30-S33 PolarHBondContact O-N 3.4Å; T30-S33 VanDerWaalsContact O-N 3.12Å; T30-S33 PolarHBondContact O-OG 2.98Å; T30-L34 HydrophobicContact CG2-CD1 4.18Å; T30-L34 WeakPolarHBondContact O-CG 3.34Å; T30-L34 PolarHBondContact O-N 3.1Å; T30-V464 HydrophobicContact CG2-CG2 4.34Å
31A98.1Very high97.8Very high48 Ų4832 Ų3240%0.39719%0.186SC..Hα-helixtrans-59.7-43.3176.100000111.8V27 L28 S33 L34 L35V27-A31 PolarHBondContact O-N 2.98Å; L28-A31 WeakPolarHBondContact O-CB 3.46Å; L28-A31 PolarHBondContact O-N 3.43Å; L28-A31 VanDerWaalsContact O-N 3.14Å; A31-S33 VanDerWaalsContact C-N 3.33Å; A31-S33 PolarHBondContact O-N 2.89Å; A31-L34 PolarHBondContact O-N 3.05Å; A31-L35 PolarHBondContact O-N 3.17Å; A31-L35 VanDerWaalsContact O-N 3.14Å
32L98.3Very high97.6Very high26 Ų2636.6 Ų36.614%0.13621%0.208CC..Hα-helixtrans-62.1-40.7173.9-62.7170.9000111.7L28 G29 T30 L34 L35 I36 I56 A59 H60 V63L28-L32 WeakPolarHBondContact O-CG 3.42Å; L28-L32 PolarHBondContact O-N 3.34Å; G29-L32 PolarHBondContact O-N 3.33Å; T30-L32 VanDerWaalsContact C-N 3.33Å; T30-L32 PolarHBondContact O-N 3.1Å; L32-L34 VanDerWaalsContact C-N 3.29Å; L32-L34 PolarHBondContact O-N 3.17Å; L32-L35 PolarHBondContact O-N 2.93Å; L32-I36 WeakPolarHBondContact O-CG1 3.17Å; L32-I36 PolarHBondContact O-N 3.16Å; L32-I36 VanDerWaalsContact O-N 3.1Å; L32-I56 HydrophobicContact CB-CG2 4.04Å; L32-I56 HydrophobicContact CD2-CG2 4Å; L32-I56 WeakPolarHBondContact O-CG2 3.31Å; L32-A59 HydrophobicContact CD1-CB 3.85Å; L32-H60 HydrophobicContact CB-CB 3.87Å; L32-H60 HydrophobicContact CD1-CB 4.45Å; L32-V63 HydrophobicContact CD1-CG2 4.41Å
33S97.9Very high97.4Very high26 Ų2638.5 Ų38.518%0.18222%0.221CC..Hα-helixtrans-62.5-35.9176.784.70000112.9G29 T30 A31 I36 R37 H60G29-S33 PolarHBondContact O-N 2.74Å; T30-S33 WeakPolarHBondContact O-CB 3.39Å; T30-S33 PolarHBondContact O-N 3.4Å; T30-S33 VanDerWaalsContact O-N 3.12Å; T30-S33 PolarHBondContact O-OG 2.98Å; A31-S33 VanDerWaalsContact C-N 3.33Å; A31-S33 PolarHBondContact O-N 2.89Å; S33-I36 WeakPolarHBondContact O-CB 3.39Å; S33-I36 PolarHBondContact O-N 3.5Å; S33-R37 PolarHBondContact O-N 3.38Å; S33-H60 VanDerWaalsContact CB-CE1 3.41Å; S33-H60 WeakPolarHBondContact CB-CE1 3.44Å
34L97.9Very high97.1Very high27 Ų2737.4 Ų37.414%0.14121%0.214CC..Hα-helixtrans-70.2-37178-71.9163.3000111.3T30 A31 L32 I36 R37 A38 S457 F458 L461T30-L34 HydrophobicContact CG2-CD1 4.18Å; T30-L34 WeakPolarHBondContact O-CG 3.34Å; T30-L34 PolarHBondContact O-N 3.1Å; A31-L34 PolarHBondContact O-N 3.05Å; L32-L34 VanDerWaalsContact C-N 3.29Å; L32-L34 PolarHBondContact O-N 3.17Å; L34-I36 VanDerWaalsContact C-N 3.34Å; L34-R37 PolarHBondContact O-N 3.25Å; L34-A38 WeakPolarHBondContact O-CB 3.29Å; L34-A38 PolarHBondContact O-N 3.11Å; L34-S457 WeakPolarHBondContact CD2-OG 3.46Å; L34-F458 HydrophobicContact CD2-CD1 4.21Å; L34-F458 HydrophobicContact CD2-CE1 4.36Å; L34-L461 HydrophobicContact CD1-CB 4.14Å; L34-L461 HydrophobicContact CD1-CD1 3.83Å; L34-L461 HydrophobicContact CD1-CD2 3.87Å; L34-L461 HydrophobicContact CD1-CG 4.14Å; L34-L461 HydrophobicContact CD2-CB 4.12Å; L34-L461 HydrophobicContact CD2-CD2 4.44Å
35L97.9Very high96.5Very high81 Ų8134.3 Ų34.342%0.42421%0.209SC..Hα-helixtrans-62.5-43.2172.5-66.4175.2000111.1A31 L32 R37 A38 E39 I56A31-L35 PolarHBondContact O-N 3.17Å; A31-L35 VanDerWaalsContact O-N 3.14Å; L32-L35 PolarHBondContact O-N 2.93Å; L35-R37 PolarHBondContact O-N 3.03Å; L35-A38 PolarHBondContact O-N 3.41Å; L35-E39 PolarHBondContact O-N 2.86Å; L35-I56 HydrophobicContact CB-CD1 4.47Å; L35-I56 HydrophobicContact CB-CG2 4.3Å; L35-I56 HydrophobicContact CD1-CD1 4.23Å
36I98.3Very high96.2Very high20 Ų2039.6 Ų39.610%0.10324%0.237CC..Hα-helixtrans-59.8-46.3175.5-65163.4000110.7L32 S33 L34 E39 L40 Y53 I56 V57 H60L32-I36 WeakPolarHBondContact O-CG1 3.17Å; L32-I36 PolarHBondContact O-N 3.16Å; L32-I36 VanDerWaalsContact O-N 3.1Å; S33-I36 WeakPolarHBondContact O-CB 3.39Å; S33-I36 PolarHBondContact O-N 3.5Å; L34-I36 VanDerWaalsContact C-N 3.34Å; I36-E39 PolarHBondContact O-N 3.18Å; I36-L40 HydrophobicContact CG2-CD1 4.04Å; I36-L40 WeakPolarHBondContact O-CG 3.19Å; I36-L40 PolarHBondContact O-N 3Å; I36-Y53 HydrophobicContact CB-CE2 4.43Å; I36-Y53 HydrophobicContact CG1-CE2 4.48Å; I36-Y53 HydrophobicContact CG2-CE2 3.92Å; I36-I56 HydrophobicContact CD1-CG2 4.09Å; I36-I56 HydrophobicContact CG1-CG2 3.72Å; I36-V57 HydrophobicContact CD1-CB 4.31Å; I36-V57 HydrophobicContact CD1-CG2 3.77Å; I36-V57 HydrophobicContact CG1-CG2 3.89Å; I36-V57 HydrophobicContact CG2-CG2 4.42Å; I36-H60 HydrophobicContact CD1-CB 3.92Å
37R97.7Very high95.9Very high14 Ų1442.2 Ų42.25%0.05325%0.249CC..Hα-helixtrans-74-27.9-179.9-68.3-46.9-49168.38.5113.5S33 L34 L35 G41 N450 S454S33-R37 PolarHBondContact O-N 3.38Å; L34-R37 PolarHBondContact O-N 3.25Å; L35-R37 PolarHBondContact O-N 3.03Å; R37-G41 PolarHBondContact O-N 2.99Å; R37-G41 VanDerWaalsContact O-N 3.07Å; R37-N450 PolarHBondContact NH2-O 2.88Å; R37-N450 PolarHBondContact NH2-OD1 2.72Å; R37-S454 PolarHBondContact NE-OG 3.3Å; R37-S454 PolarHBondContact NH2-OG 3.4Å; R37-S454 WeakPolarHBondContact O-CB 3.47Å; R37-S454 PolarHBondContact O-OG 3.23Å
38A97Very high95.7Very high31 Ų3141.6 Ų41.626%0.25626%0.257SS..Hα-helixtrans-68-44.8171.900000110.8L34 L35 L40 G41 L46 F458L34-A38 WeakPolarHBondContact O-CB 3.29Å; L34-A38 PolarHBondContact O-N 3.11Å; L35-A38 PolarHBondContact O-N 3.41Å; A38-L40 VanDerWaalsContact C-N 3.33Å; A38-L40 PolarHBondContact O-N 2.95Å; A38-G41 PolarHBondContact O-N 3.34Å; A38-G41 VanDerWaalsContact O-N 3.13Å; A38-L46 HydrophobicContact CB-CD2 4.04Å; A38-F458 HydrophobicContact CB-CZ 4.46Å
39E97.4Very high95.5Very high2 Ų243 Ų431%0.00927%0.265CS..Hα-helixtrans-56.2-50.1173.9-171.164.9-165.500110.6L35 I36 G41 N45 L46 L47 Y53L35-E39 PolarHBondContact O-N 2.86Å; I36-E39 PolarHBondContact O-N 3.18Å; E39-G41 PolarHBondContact O-N 3.17Å; E39-N45 WeakPolarHBondContact OE1-CA 3.47Å; E39-L46 PolarHBondContact OE1-N 3.34Å; E39-L46 WeakPolarHBondContact OE2-CA 3.29Å; E39-L46 WeakPolarHBondContact OE2-CB 3.35Å; E39-L46 PolarHBondContact OE2-N 3.42Å; E39-L47 HydrophobicContact CB-CD1 4.36Å; E39-L47 HydrophobicContact CG-CD1 4.31Å; E39-L47 PolarHBondContact OE1-N 2.83Å; E39-L47 VanDerWaalsContact OE2-CB 3.3Å; E39-L47 WeakPolarHBondContact OE2-CB 3.41Å; E39-L47 WeakPolarHBondContact OE2-CG 3.48Å; E39-L47 PolarHBondContact OE2-N 3.28Å; E39-Y53 HydrophobicContact CB-CD2 4.18Å; E39-Y53 HydrophobicContact CB-CE2 4.36Å; E39-Y53 HydrophobicContact CG-CD2 3.94Å; E39-Y53 HydrophobicContact CG-CE2 4.34Å
40L97.5Very high95.3Very high0 Ų046.8 Ų46.80%029%0.285CS..THydrogen-bonded Turntrans-79.55.7-178.4-62.3171.6000113.9I36 A38 Q42 Y53 Y370 Y442 N450I36-L40 HydrophobicContact CG2-CD1 4.04Å; I36-L40 WeakPolarHBondContact O-CG 3.19Å; I36-L40 PolarHBondContact O-N 3Å; A38-L40 VanDerWaalsContact C-N 3.33Å; A38-L40 PolarHBondContact O-N 2.95Å; L40-Q42 PolarHBondContact O-N 3.49Å; L40-Y53 HydrophobicContact CD1-CE2 4.46Å; L40-Y53 WeakPolarHBondContact CD1-OH 3.43Å; L40-Y53 HydrophobicContact CG-CE2 4.27Å; L40-Y370 WeakPolarHBondContact CD1-OH 3Å; L40-Y442 HydrophobicContact CB-CE1 4.14Å; L40-Y442 HydrophobicContact CD2-CD1 3.84Å; L40-Y442 HydrophobicContact CD2-CE1 4Å; L40-Y442 VanDerWaalsContact O-CE1 3.27Å; L40-Y442 WeakPolarHBondContact O-CE1 3.42Å; L40-Y442 PolarHBondContact O-OH 3.45Å; L40-N450 WeakPolarHBondContact O-CB 3.44Å
41G95.4Very high95.3Very high20 Ų2048.1 Ų48.121%0.20629%0.289CS..THydrogen-bonded Turntrans-67.8-23.7-176.500000113.6R37 A38 E39 I451R37-G41 PolarHBondContact O-N 2.99Å; R37-G41 VanDerWaalsContact O-N 3.07Å; A38-G41 PolarHBondContact O-N 3.34Å; A38-G41 VanDerWaalsContact O-N 3.13Å; E39-G41 PolarHBondContact O-N 3.17Å; G41-I451 WeakPolarHBondContact O-CG1 3.45Å
42Q93.6Very high95.2Very high123 Ų12349.4 Ų49.458%0.57529%0.289SS*.SBendtrans-151.9158.9176.962-173.80.600109.3L40 Y442L40-Q42 PolarHBondContact O-N 3.49Å; Q42-Y442 VanDerWaalsContact C-OH 3.27Å; Q42-Y442 VanDerWaalsContact CA-OH 3.31Å; Q42-Y442 WeakPolarHBondContact CA-OH 3.4Å; Q42-Y442 PolarHBondContact N-OH 2.82Å
43P93.9Very high95.2Very high40 Ų4048.4 Ų48.426%0.2628%0.283SS..SBendtrans-61149.1169.5-21.332000112.4Y442 T447P43-Y442 HydrophobicContact CB-CE2 4.5Å; P43-Y442 HydrophobicContact CG-CD2 4.36Å; P43-Y442 HydrophobicContact CG-CE2 3.77Å; P43-T447 HydrophobicContact CG-CG2 4.35Å; P43-T447 WeakPolarHBondContact CG-OG1 3.25Å
44G91.6Very high95.2Very high30 Ų3049.1 Ų49.131%0.30929%0.285SS..SBendtrans91166-177.100000114.1D441G44-D441 PolarHBondContact N-OD1 3.46Å
45N86.1Confident95.2Very high86 Ų8648.4 Ų48.446%0.4628%0.282SS..  trans-87.1120.3-169.5-64.5-10.1000112.4E39E39-N45 WeakPolarHBondContact OE1-CA 3.47Å
46L92.1Very high95.2Very high110 Ų11045.4 Ų45.458%0.57627%0.266SS*.SBendtrans-90.4-44.4170.4167.375.2000111A38 E39 G48A38-L46 HydrophobicContact CB-CD2 4.04Å; E39-L46 PolarHBondContact OE1-N 3.34Å; E39-L46 WeakPolarHBondContact OE2-CA 3.29Å; E39-L46 WeakPolarHBondContact OE2-CB 3.35Å; E39-L46 PolarHBondContact OE2-N 3.42Å; L46-G48 VanDerWaalsContact C-N 3.32Å
47L92.7Very high95.2Very high61 Ų6145.8 Ų45.832%0.31927%0.269SS..SBendtrans-74-24.5176.8-75.5170.1000112.1E39 N49 I56E39-L47 HydrophobicContact CB-CD1 4.36Å; E39-L47 HydrophobicContact CG-CD1 4.31Å; E39-L47 PolarHBondContact OE1-N 2.83Å; E39-L47 VanDerWaalsContact OE2-CB 3.3Å; E39-L47 WeakPolarHBondContact OE2-CB 3.41Å; E39-L47 WeakPolarHBondContact OE2-CG 3.48Å; E39-L47 PolarHBondContact OE2-N 3.28Å; L47-N49 PolarHBondContact O-N 3.41Å; L47-I56 HydrophobicContact CD1-CD1 3.89Å; L47-I56 HydrophobicContact CD2-CD1 4.45Å
48G92.6Very high95.3Very high58 Ų5845.3 Ų45.360%0.59827%0.268SS*.SBendtrans72.37.4179.100000114.9L46L46-G48 VanDerWaalsContact C-N 3.32Å
49N94.4Very high95.3Very high70 Ų7044.2 Ų44.237%0.37426%0.259SS..  trans-151.5112.4179.2-174.1-39.6000111.9L47 H51 I52 Y53L47-N49 PolarHBondContact O-N 3.41Å; N49-H51 VanDerWaalsContact C-N 3.3Å; N49-H51 PolarHBondContact O-N 3Å; N49-H51 WeakPolarHBondContact OD1-CA 3.34Å; N49-H51 VanDerWaalsContact OD1-CB 3.3Å; N49-H51 WeakPolarHBondContact OD1-CB 3.19Å; N49-H51 PolarHBondContact OD1-N 3.4Å; N49-I52 HydrophobicContact CB-CB 4.15Å; N49-I52 HydrophobicContact CB-CD1 3.86Å; N49-I52 HydrophobicContact CB-CG1 3.97Å; N49-I52 PolarHBondContact O-N 3.21Å; N49-I52 PolarHBondContact OD1-N 3.26Å; N49-I52 VanDerWaalsContact OD1-N 3.13Å; N49-Y53 PolarHBondContact O-N 3.25Å
50D94.9Very high95.4Very high80 Ų8045.6 Ų45.643%0.42827%0.265SS..Hα-helixtrans-64.9-31.7-177.9-57.1-25.6000113.3Y53 N54 S440D50-Y53 WeakPolarHBondContact O-CB 3.48Å; D50-Y53 PolarHBondContact O-N 3.03Å; D50-N54 PolarHBondContact O-N 2.59Å; D50-N54 VanDerWaalsContact O-N 3.12Å; D50-N54 PolarHBondContact O-ND2 3.4Å; D50-S440 WeakPolarHBondContact CB-OG 3.45Å; D50-S440 WeakPolarHBondContact OD1-CB 3.42Å; D50-S440 PolarHBondContact OD1-OG 2.9Å
51H96.1Very high95.4Very high57 Ų5746.4 Ų46.426%0.26427%0.272SS..Hα-helixtrans-68.6-42.7177.5-175.367.9000111.1N49 Y53 N54 V55 A119 G120 H137N49-H51 VanDerWaalsContact C-N 3.3Å; N49-H51 PolarHBondContact O-N 3Å; N49-H51 WeakPolarHBondContact OD1-CA 3.34Å; N49-H51 VanDerWaalsContact OD1-CB 3.3Å; N49-H51 WeakPolarHBondContact OD1-CB 3.19Å; N49-H51 PolarHBondContact OD1-N 3.4Å; H51-Y53 VanDerWaalsContact C-N 3.27Å; H51-Y53 PolarHBondContact O-N 3.49Å; H51-N54 PolarHBondContact O-N 2.7Å; H51-V55 WeakPolarHBondContact O-CG2 3.27Å; H51-V55 PolarHBondContact O-N 3.06Å; H51-A119 PolarHBondContact CD2-O 2.83Å; H51-A119 WeakPolarHBondContact NE2-CB 3.45Å; H51-A119 PolarHBondContact NE2-O 2.75Å; H51-G120 PolarHBondContact NE2-O 3.41Å; H51-H137 AromaticContact CE1-NE2 3.48Å; H51-H137 PolarHBondContact CE1-NE2 2.98Å
52I96.7Very high95.6Very high76 Ų7645.5 Ų45.539%0.3926%0.262SS..Hα-helixtrans-59.1-41.5174.8-67.1179.3000110.5N49 N54 V55 I56N49-I52 HydrophobicContact CB-CB 4.15Å; N49-I52 HydrophobicContact CB-CD1 3.86Å; N49-I52 HydrophobicContact CB-CG1 3.97Å; N49-I52 PolarHBondContact O-N 3.21Å; N49-I52 PolarHBondContact OD1-N 3.26Å; N49-I52 VanDerWaalsContact OD1-N 3.13Å; I52-N54 VanDerWaalsContact C-N 3.34Å; I52-N54 PolarHBondContact O-N 3.13Å; I52-V55 PolarHBondContact O-N 3.48Å; I52-I56 HydrophobicContact CG2-CD1 3.85Å; I52-I56 HydrophobicContact CG2-CG1 4.37Å; I52-I56 VanDerWaalsContact O-CG1 3.3Å; I52-I56 WeakPolarHBondContact O-CG1 3.5Å; I52-I56 PolarHBondContact O-N 3.31Å
53Y97.6Very high95.8Very high4 Ų439.7 Ų39.72%0.01624%0.235CC..Hα-helixtrans-56.7-46.8173.6171-94000111.8I36 E39 L40 N49 D50 H51 V55 I56 V57 Y439I36-Y53 HydrophobicContact CB-CE2 4.43Å; I36-Y53 HydrophobicContact CG1-CE2 4.48Å; I36-Y53 HydrophobicContact CG2-CE2 3.92Å; E39-Y53 HydrophobicContact CB-CD2 4.18Å; E39-Y53 HydrophobicContact CB-CE2 4.36Å; E39-Y53 HydrophobicContact CG-CD2 3.94Å; E39-Y53 HydrophobicContact CG-CE2 4.34Å; L40-Y53 HydrophobicContact CD1-CE2 4.46Å; L40-Y53 WeakPolarHBondContact CD1-OH 3.43Å; L40-Y53 HydrophobicContact CG-CE2 4.27Å; N49-Y53 PolarHBondContact O-N 3.25Å; D50-Y53 WeakPolarHBondContact O-CB 3.48Å; D50-Y53 PolarHBondContact O-N 3.03Å; H51-Y53 VanDerWaalsContact C-N 3.27Å; H51-Y53 PolarHBondContact O-N 3.49Å; Y53-V55 VanDerWaalsContact C-N 3.35Å; Y53-V55 PolarHBondContact O-N 2.9Å; Y53-I56 PolarHBondContact O-N 3.16Å; Y53-V57 HydrophobicContact CD1-CG2 4.12Å; Y53-V57 HydrophobicContact CD2-CG2 4.44Å; Y53-V57 HydrophobicContact CE1-CG2 3.73Å; Y53-V57 HydrophobicContact CE2-CG2 4.07Å; Y53-V57 HydrophobicContact CG-CG2 4.47Å; Y53-V57 VanDerWaalsContact O-CG2 3.32Å; Y53-V57 WeakPolarHBondContact O-CG2 3.4Å; Y53-V57 PolarHBondContact O-N 2.97Å; Y53-Y439 VanDerWaalsContact CE1-C 3.41Å; Y53-Y439 VanDerWaalsContact CE1-O 3.22Å; Y53-Y439 WeakPolarHBondContact CE1-O 3.26Å; Y53-Y439 PolarHBondContact OH-O 3.06Å
54N97.9Very high96Very high41 Ų4139.1 Ų39.122%0.21923%0.229CC..Hα-helixtrans-65.6-34.6177.9-75-41.2000113.4D50 H51 I52 V57 T58 R438D50-N54 PolarHBondContact O-N 2.59Å; D50-N54 VanDerWaalsContact O-N 3.12Å; D50-N54 PolarHBondContact O-ND2 3.4Å; H51-N54 PolarHBondContact O-N 2.7Å; I52-N54 VanDerWaalsContact C-N 3.34Å; I52-N54 PolarHBondContact O-N 3.13Å; N54-V57 PolarHBondContact O-N 3.22Å; N54-T58 VanDerWaalsContact O-CB 3.32Å; N54-T58 WeakPolarHBondContact O-CB 3.5Å; N54-T58 PolarHBondContact O-N 3.37Å; N54-T58 PolarHBondContact O-OG1 3.41Å; N54-R438 PolarHBondContact OD1-O 3.42Å
55V98.3Very high96.3Very high12 Ų1238 Ų387%0.07322%0.216CC..Hα-helixtrans-63.4-45.3172.1174.80000110.4H51 I52 Y53 T58 A59 A115 A119H51-V55 WeakPolarHBondContact O-CG2 3.27Å; H51-V55 PolarHBondContact O-N 3.06Å; I52-V55 PolarHBondContact O-N 3.48Å; Y53-V55 VanDerWaalsContact C-N 3.35Å; Y53-V55 PolarHBondContact O-N 2.9Å; V55-T58 PolarHBondContact O-N 3.24Å; V55-A59 WeakPolarHBondContact O-CB 3.48Å; V55-A59 PolarHBondContact O-N 3Å; V55-A115 HydrophobicContact CG1-CB 3.83Å; V55-A119 WeakPolarHBondContact CG2-O 3.44Å
56I98.4Very high96.8Very high19 Ų1934.3 Ų34.310%0.09720%0.196CC..Hα-helixtrans-63.1-44.8177.3-66.2168000110.8L32 L35 I36 L47 I52 Y53 T58 A59 H60L32-I56 HydrophobicContact CB-CG2 4.04Å; L32-I56 HydrophobicContact CD2-CG2 4Å; L32-I56 WeakPolarHBondContact O-CG2 3.31Å; L35-I56 HydrophobicContact CB-CD1 4.47Å; L35-I56 HydrophobicContact CB-CG2 4.3Å; L35-I56 HydrophobicContact CD1-CD1 4.23Å; I36-I56 HydrophobicContact CD1-CG2 4.09Å; I36-I56 HydrophobicContact CG1-CG2 3.72Å; L47-I56 HydrophobicContact CD1-CD1 3.89Å; L47-I56 HydrophobicContact CD2-CD1 4.45Å; I52-I56 HydrophobicContact CG2-CD1 3.85Å; I52-I56 HydrophobicContact CG2-CG1 4.37Å; I52-I56 VanDerWaalsContact O-CG1 3.3Å; I52-I56 WeakPolarHBondContact O-CG1 3.5Å; I52-I56 PolarHBondContact O-N 3.31Å; Y53-I56 PolarHBondContact O-N 3.16Å; I56-T58 VanDerWaalsContact C-N 3.33Å; I56-T58 PolarHBondContact O-N 3.31Å; I56-A59 PolarHBondContact O-N 3.01Å; I56-H60 VanDerWaalsContact O-CB 3.29Å; I56-H60 WeakPolarHBondContact O-CB 3.36Å; I56-H60 PolarHBondContact O-N 2.8Å
57V98.4Very high97.1Very high28 Ų2829.1 Ų29.117%0.1717%0.169CC..Hα-helixtrans-59.5-44176170.70000111.2I36 Y53 N54 A61 R438I36-V57 HydrophobicContact CD1-CB 4.31Å; I36-V57 HydrophobicContact CD1-CG2 3.77Å; I36-V57 HydrophobicContact CG1-CG2 3.89Å; I36-V57 HydrophobicContact CG2-CG2 4.42Å; Y53-V57 HydrophobicContact CD1-CG2 4.12Å; Y53-V57 HydrophobicContact CD2-CG2 4.44Å; Y53-V57 HydrophobicContact CE1-CG2 3.73Å; Y53-V57 HydrophobicContact CE2-CG2 4.07Å; Y53-V57 HydrophobicContact CG-CG2 4.47Å; Y53-V57 VanDerWaalsContact O-CG2 3.32Å; Y53-V57 WeakPolarHBondContact O-CG2 3.4Å; Y53-V57 PolarHBondContact O-N 2.97Å; N54-V57 PolarHBondContact O-N 3.22Å; V57-A61 PolarHBondContact O-N 3.09Å; V57-R438 HydrophobicContact CG1-CG 4.47Å
58T98.3Very high97.4Very high4 Ų426.9 Ų26.93%0.02516%0.157CC..Hα-helixtrans-65.2-48.1178.9-57.80000111.1N54 V55 I56 A61 F62 A121 G124N54-T58 VanDerWaalsContact O-CB 3.32Å; N54-T58 WeakPolarHBondContact O-CB 3.5Å; N54-T58 PolarHBondContact O-N 3.37Å; N54-T58 PolarHBondContact O-OG1 3.41Å; V55-T58 PolarHBondContact O-N 3.24Å; I56-T58 VanDerWaalsContact C-N 3.33Å; I56-T58 PolarHBondContact O-N 3.31Å; T58-A61 PolarHBondContact O-N 3.41Å; T58-F62 HydrophobicContact CG2-CD2 3.78Å; T58-F62 HydrophobicContact CG2-CE2 3.51Å; T58-F62 VanDerWaalsContact O-CD2 3.32Å; T58-F62 WeakPolarHBondContact O-CD2 3.45Å; T58-F62 PolarHBondContact O-N 3.45Å; T58-F62 VanDerWaalsContact O-N 3.14Å; T58-A121 WeakPolarHBondContact CB-O 3.47Å; T58-A121 WeakPolarHBondContact CG2-O 3.28Å; T58-A121 PolarHBondContact OG1-O 2.93Å; T58-G124 WeakPolarHBondContact OG1-CA 3.22Å; T58-G124 PolarHBondContact OG1-N 2.72Å
59A98.4Very high97.7Very high8 Ų824.2 Ų24.27%0.06613%0.129CC..Hα-helixtrans-63.1-43.4178.200000112L32 V55 I56 A61 F62 V63L32-A59 HydrophobicContact CD1-CB 3.85Å; V55-A59 WeakPolarHBondContact O-CB 3.48Å; V55-A59 PolarHBondContact O-N 3Å; I56-A59 PolarHBondContact O-N 3.01Å; A59-A61 VanDerWaalsContact C-N 3.35Å; A59-A61 PolarHBondContact O-N 3.44Å; A59-F62 PolarHBondContact O-N 2.84Å; A59-V63 VanDerWaalsContact O-CB 3.31Å; A59-V63 WeakPolarHBondContact O-CB 3.06Å; A59-V63 WeakPolarHBondContact O-CG2 3.33Å; A59-V63 PolarHBondContact O-N 3.35Å
60H98.4Very high97.8Very high30 Ų3021.4 Ų21.414%0.13911%0.114CC..Hα-helixtrans-54.6-51.2176.3168.368.6000111.1G29 L32 S33 I36 I56 F62 V63 M64G29-H60 PolarHBondContact O-ND1 2.9Å; L32-H60 HydrophobicContact CB-CB 3.87Å; L32-H60 HydrophobicContact CD1-CB 4.45Å; S33-H60 VanDerWaalsContact CB-CE1 3.41Å; S33-H60 WeakPolarHBondContact CB-CE1 3.44Å; I36-H60 HydrophobicContact CD1-CB 3.92Å; I56-H60 VanDerWaalsContact O-CB 3.29Å; I56-H60 WeakPolarHBondContact O-CB 3.36Å; I56-H60 PolarHBondContact O-N 2.8Å; H60-F62 PolarHBondContact O-N 3.41Å; H60-V63 PolarHBondContact O-N 2.87Å; H60-M64 VanDerWaalsContact CE1-CG 3.41Å; H60-M64 WeakPolarHBondContact CE1-CG 3.4Å; H60-M64 WeakPolarHBondContact O-CB 3.23Å; H60-M64 VanDerWaalsContact O-CG 3.23Å; H60-M64 WeakPolarHBondContact O-CG 3.34Å; H60-M64 PolarHBondContact O-N 3.21Å
61A98Very high98Very high18 Ų1817.8 Ų17.815%0.14910%0.095CC..Hα-helixtrans-61.1-47.7-178.700000112V57 T58 A59 M64 I65 W125V57-A61 PolarHBondContact O-N 3.09Å; T58-A61 PolarHBondContact O-N 3.41Å; A59-A61 VanDerWaalsContact C-N 3.35Å; A59-A61 PolarHBondContact O-N 3.44Å; A61-M64 PolarHBondContact O-N 3.18Å; A61-I65 WeakPolarHBondContact O-CB 3.42Å; A61-I65 WeakPolarHBondContact O-CG1 3.38Å; A61-I65 PolarHBondContact O-N 3.23Å; A61-W125 HydrophobicContact CB-CB 3.58Å; A61-W125 HydrophobicContact CB-CG 4.04Å
62F98.4Very high98.1Very high1 Ų115.6 Ų15.60%0.0049%0.085CC..Hα-helixtrans-64.5-45.1178.7-74.9-50.3000112.7T58 A59 H60 M64 I65 F66 F67 L111 W125 V127 T145 L149T58-F62 HydrophobicContact CG2-CD2 3.78Å; T58-F62 HydrophobicContact CG2-CE2 3.51Å; T58-F62 VanDerWaalsContact O-CD2 3.32Å; T58-F62 WeakPolarHBondContact O-CD2 3.45Å; T58-F62 PolarHBondContact O-N 3.45Å; T58-F62 VanDerWaalsContact O-N 3.14Å; A59-F62 PolarHBondContact O-N 2.84Å; H60-F62 PolarHBondContact O-N 3.41Å; F62-M64 PolarHBondContact O-N 3.16Å; F62-I65 PolarHBondContact O-N 2.97Å; F62-F66 AromaticContact CD1-CD2 3.77Å; F62-F66 HydrophobicContact CD1-CD2 3.77Å; F62-F66 AromaticContact CD1-CE2 3.73Å; F62-F66 HydrophobicContact CD1-CE2 3.73Å; F62-F66 HydrophobicContact CE1-CE2 4.1Å; F62-F66 WeakPolarHBondContact O-CB 3.32Å; F62-F66 PolarHBondContact O-N 3.25Å; F62-F67 WeakPolarHBondContact O-CD2 3.19Å; F62-L111 HydrophobicContact CB-CD1 4.09Å; F62-L111 HydrophobicContact CB-CD2 3.64Å; F62-L111 HydrophobicContact CD2-CD1 3.92Å; F62-L111 HydrophobicContact CG-CD1 4.3Å; F62-W125 HydrophobicContact CD1-CB 4.49Å; F62-W125 HydrophobicContact CE1-CB 4.17Å; F62-W125 WeakPolarHBondContact CE1-O 3.27Å; F62-W125 HydrophobicContact CE2-CB 4.49Å; F62-W125 HydrophobicContact CZ-CB 4.18Å; F62-W125 WeakPolarHBondContact CZ-O 3.44Å; F62-V127 HydrophobicContact CE2-CG2 4.2Å; F62-V127 HydrophobicContact CZ-CG2 3.64Å; F62-T145 HydrophobicContact CD2-CG2 4.19Å; F62-T145 HydrophobicContact CE2-CG2 3.62Å; F62-T145 HydrophobicContact CZ-CG2 4.18Å; F62-L149 HydrophobicContact CD1-CD2 3.79Å; F62-L149 HydrophobicContact CE1-CD1 3.76Å; F62-L149 HydrophobicContact CE1-CD2 3.78Å; F62-L149 HydrophobicContact CE1-CG 4.3Å; F62-L149 HydrophobicContact CZ-CD1 3.88Å
63V98.7Very high98.1Very high0 Ų012 Ų120%07%0.067CC..Iπ-helixtrans-59.2-47.8178171.70000110.8A25 L28 L32 A59 H60 F67 M68 L108 L111A25-V63 HydrophobicContact CB-CG1 4.28Å; A25-V63 WeakPolarHBondContact O-CG1 3.37Å; L28-V63 HydrophobicContact CD2-CG1 4.25Å; L28-V63 HydrophobicContact CD2-CG2 4.22Å; L28-V63 HydrophobicContact CG-CG1 4.32Å; L32-V63 HydrophobicContact CD1-CG2 4.41Å; A59-V63 VanDerWaalsContact O-CB 3.31Å; A59-V63 WeakPolarHBondContact O-CB 3.06Å; A59-V63 WeakPolarHBondContact O-CG2 3.33Å; A59-V63 PolarHBondContact O-N 3.35Å; H60-V63 PolarHBondContact O-N 2.87Å; V63-F67 CarbonylContact O-C 3.56Å; V63-F67 WeakPolarHBondContact O-CA 3.18Å; V63-F67 WeakPolarHBondContact O-CB 3.26Å; V63-F67 PolarHBondContact O-N 3.05Å; V63-F67 VanDerWaalsContact O-N 3.11Å; V63-M68 PolarHBondContact O-N 3.47Å; V63-L108 HydrophobicContact CG2-CD1 4.21Å; V63-L111 HydrophobicContact CG2-CD2 3.8Å
64M98.3Very high98.1Very high29 Ų2912.7 Ų12.714%0.1437%0.07CC..Iπ-helixtrans-66.7-43.4-178-67.5-61.5-72.200112.3H60 A61 F62 M68 V69H60-M64 VanDerWaalsContact CE1-CG 3.41Å; H60-M64 WeakPolarHBondContact CE1-CG 3.4Å; H60-M64 WeakPolarHBondContact O-CB 3.23Å; H60-M64 VanDerWaalsContact O-CG 3.23Å; H60-M64 WeakPolarHBondContact O-CG 3.34Å; H60-M64 PolarHBondContact O-N 3.21Å; A61-M64 PolarHBondContact O-N 3.18Å; F62-M64 PolarHBondContact O-N 3.16Å; M64-M68 HydrophobicContact CE-CE 4.44Å; M64-M68 HydrophobicContact CE-SD 3.36Å; M64-M68 WeakPolarHBondContact CE-SD 3.32Å; M64-M68 WeakPolarHBondContact O-CB 3.43Å; M64-M68 HydrophobicContact SD-SD 3.7Å; M64-V69 WeakPolarHBondContact O-CB 3.38Å; M64-V69 VanDerWaalsContact O-CG2 3.25Å; M64-V69 WeakPolarHBondContact O-CG2 3.38Å; M64-V69 PolarHBondContact O-N 3Å
65I96.8Very high98.1Very high5 Ų510.9 Ų10.93%0.0266%0.061CC..Iπ-helixtrans-75.5-60-176.5-66.5169.7000110.9A61 F62 M70 W125 L245 L380A61-I65 WeakPolarHBondContact O-CB 3.42Å; A61-I65 WeakPolarHBondContact O-CG1 3.38Å; A61-I65 PolarHBondContact O-N 3.23Å; F62-I65 PolarHBondContact O-N 2.97Å; I65-M70 HydrophobicContact CG2-CE 4.29Å; I65-M70 PolarHBondContact O-N 3.49Å; I65-M70 VanDerWaalsContact O-N 3.17Å; I65-W125 HydrophobicContact CD1-CE3 4.2Å; I65-W125 HydrophobicContact CD1-CZ3 4.26Å; I65-L245 HydrophobicContact CG1-CD1 4.31Å; I65-L245 HydrophobicContact CG2-CD1 3.8Å; I65-L245 HydrophobicContact CG2-CD2 4.29Å; I65-L380 HydrophobicContact CG1-CD2 4.43Å
66F98.1Very high98.1Very high10 Ų1010.3 Ų10.34%0.0446%0.058CC..Iπ-helixtrans-87.1-22.6-167.6-65.6-90.7000114F62 M70 P71 L149 F237F62-F66 AromaticContact CD1-CD2 3.77Å; F62-F66 HydrophobicContact CD1-CD2 3.77Å; F62-F66 AromaticContact CD1-CE2 3.73Å; F62-F66 HydrophobicContact CD1-CE2 3.73Å; F62-F66 HydrophobicContact CE1-CE2 4.1Å; F62-F66 WeakPolarHBondContact O-CB 3.32Å; F62-F66 PolarHBondContact O-N 3.25Å; F66-M70 HydrophobicContact CB-CE 4.05Å; F66-M70 HydrophobicContact CD1-CE 3.06Å; F66-M70 HydrophobicContact CE1-CE 3.53Å; F66-M70 HydrophobicContact CG-CE 3.68Å; F66-M70 HydrophobicContact CZ-CE 4.47Å; F66-P71 VanDerWaalsContact O-CD 3.24Å; F66-P71 WeakPolarHBondContact O-CD 3.48Å; F66-P71 WeakPolarHBondContact O-CG 3.38Å; F66-L149 HydrophobicContact CD1-CD2 4.36Å; F66-L149 HydrophobicContact CD2-CD2 4.1Å; F66-L149 HydrophobicContact CE1-CD2 4.38Å; F66-L149 HydrophobicContact CE2-CD2 4.09Å; F66-L149 HydrophobicContact CG-CD2 4.26Å; F66-L149 HydrophobicContact CZ-CD2 4.25Å; F66-F237 HydrophobicContact CE1-CZ 4.02Å; F66-F237 HydrophobicContact CZ-CE1 4.2Å; F66-F237 AromaticContact CZ-CZ 3.9Å; F66-F237 HydrophobicContact CZ-CZ 3.9Å
67F98.6Very high98.1Very high0 Ų09.4 Ų9.40%05%0.053CC..Iπ-helixtrans-116.4-18.6-172.8-59.9-79000114.2F21 G22 A25 F62 V63 P71 S107 L108 L111 A152F21-F67 HydrophobicContact CE1-CB 4.17Å; F21-F67 AromaticContact CE1-CD1 3.94Å; F21-F67 HydrophobicContact CE1-CD1 3.94Å; F21-F67 HydrophobicContact CZ-CB 4.46Å; F21-F67 AromaticContact CZ-CD1 3.77Å; F21-F67 HydrophobicContact CZ-CD1 3.77Å; G22-F67 WeakPolarHBondContact CA-O 3.23Å; A25-F67 HydrophobicContact CB-CB 3.87Å; A25-F67 VanDerWaalsContact CB-O 3.31Å; A25-F67 WeakPolarHBondContact CB-O 3.36Å; F62-F67 WeakPolarHBondContact O-CD2 3.19Å; V63-F67 CarbonylContact O-C 3.56Å; V63-F67 WeakPolarHBondContact O-CA 3.18Å; V63-F67 WeakPolarHBondContact O-CB 3.26Å; V63-F67 PolarHBondContact O-N 3.05Å; V63-F67 VanDerWaalsContact O-N 3.11Å; F67-P71 WeakPolarHBondContact O-CG 3.48Å; F67-S107 VanDerWaalsContact CE1-OG 3.28Å; F67-S107 WeakPolarHBondContact CE1-OG 3.46Å; F67-S107 WeakPolarHBondContact CZ-OG 3.38Å; F67-L108 HydrophobicContact CB-CD1 4.24Å; F67-L108 HydrophobicContact CD1-CB 3.74Å; F67-L108 HydrophobicContact CD1-CD1 4.11Å; F67-L108 HydrophobicContact CD1-CG 4.34Å; F67-L108 HydrophobicContact CD2-CD1 4.07Å; F67-L108 HydrophobicContact CE1-CB 3.72Å; F67-L108 HydrophobicContact CE1-CD1 4.47Å; F67-L108 HydrophobicContact CE2-CD1 4.47Å; F67-L108 HydrophobicContact CG-CB 4.37Å; F67-L108 HydrophobicContact CG-CD1 3.86Å; F67-L108 HydrophobicContact CZ-CB 4.38Å; F67-L111 HydrophobicContact CD2-CD2 3.96Å; F67-L111 HydrophobicContact CE2-CB 4.49Å; F67-L111 HydrophobicContact CE2-CD2 3.61Å; F67-A152 HydrophobicContact CZ-CB 4.41Å
68M98.2Very high98.1Very high14 Ų148.1 Ų8.17%0.0695%0.045CC..Iπ-helixtrans-105-69.2171.6179.2-158.2170.300111.6V63 M64 I72 V385V63-M68 PolarHBondContact O-N 3.47Å; M64-M68 HydrophobicContact CE-CE 4.44Å; M64-M68 HydrophobicContact CE-SD 3.36Å; M64-M68 WeakPolarHBondContact CE-SD 3.32Å; M64-M68 WeakPolarHBondContact O-CB 3.43Å; M64-M68 HydrophobicContact SD-SD 3.7Å; M68-I72 HydrophobicContact CE-CD1 4.36Å; M68-I72 HydrophobicContact CG-CD1 3.84Å; M68-I72 WeakPolarHBondContact O-CB 3.49Å; M68-I72 VanDerWaalsContact O-CG1 3.23Å; M68-I72 WeakPolarHBondContact O-CG1 3.29Å; M68-I72 PolarHBondContact O-N 3.44Å; M68-V385 HydrophobicContact CE-CG1 4.31Å; M68-V385 HydrophobicContact CE-CG2 4.23Å
69V98.3Very high98.1Very high2 Ų28 Ų81%0.0124%0.044CC..Iπ-helixtrans-66.1-50.8-165.9174.30000111.7M64 I72 M73 L245 A384 I388M64-V69 WeakPolarHBondContact O-CB 3.38Å; M64-V69 VanDerWaalsContact O-CG2 3.25Å; M64-V69 WeakPolarHBondContact O-CG2 3.38Å; M64-V69 PolarHBondContact O-N 3Å; V69-I72 PolarHBondContact O-N 3.42Å; V69-M73 HydrophobicContact CG1-CE 3.2Å; V69-M73 HydrophobicContact CG1-SD 4.49Å; V69-M73 WeakPolarHBondContact O-CB 3.39Å; V69-M73 PolarHBondContact O-N 3.33Å; V69-L245 HydrophobicContact CB-CD2 4.32Å; V69-L245 HydrophobicContact CG1-CB 4.39Å; V69-L245 HydrophobicContact CG1-CD2 3.79Å; V69-A384 HydrophobicContact CG1-CB 3.8Å; V69-I388 HydrophobicContact CG1-CD1 4.48Å
70M97.2Very high98.1Very high11 Ų118.1 Ų8.15%0.0544%0.043CC..Hα-helixtrans-60.4-52177.1-90.7-161.1-8200112.8I65 F66 I72 M73 I74 G75 L194 E241 I244 L245I65-M70 HydrophobicContact CG2-CE 4.29Å; I65-M70 PolarHBondContact O-N 3.49Å; I65-M70 VanDerWaalsContact O-N 3.17Å; F66-M70 HydrophobicContact CB-CE 4.05Å; F66-M70 HydrophobicContact CD1-CE 3.06Å; F66-M70 HydrophobicContact CE1-CE 3.53Å; F66-M70 HydrophobicContact CG-CE 3.68Å; F66-M70 HydrophobicContact CZ-CE 4.47Å; M70-I72 VanDerWaalsContact C-N 3.33Å; M70-I72 PolarHBondContact O-N 3.41Å; M70-M73 PolarHBondContact O-N 3.03Å; M70-I74 PolarHBondContact O-N 3.31Å; M70-G75 PolarHBondContact O-N 3.46Å; M70-L194 HydrophobicContact SD-CD2 4.31Å; M70-E241 WeakPolarHBondContact CE-OE1 3.4Å; M70-I244 HydrophobicContact CG-CG2 4.49Å; M70-I244 HydrophobicContact SD-CG2 4.42Å; M70-L245 HydrophobicContact CG-CD2 3.57Å
71P98.5Very high98.1Very high4 Ų46.7 Ų6.73%0.0264%0.037CC..Iπ-helixtrans-57.9-40176.9-33.742.6000113.6Y18 F21 F66 F67 G75 G76 L104Y18-P71 HydrophobicContact CD1-CB 4.07Å; F21-P71 HydrophobicContact CD1-CB 4.15Å; F21-P71 HydrophobicContact CD1-CG 4.31Å; F21-P71 HydrophobicContact CE1-CG 4.23Å; F66-P71 VanDerWaalsContact O-CD 3.24Å; F66-P71 WeakPolarHBondContact O-CD 3.48Å; F66-P71 WeakPolarHBondContact O-CG 3.38Å; F67-P71 WeakPolarHBondContact O-CG 3.48Å; P71-G75 CarbonylContact O-C 3.57Å; P71-G75 VanDerWaalsContact O-C 3.28Å; P71-G75 WeakPolarHBondContact O-CA 3.42Å; P71-G75 PolarHBondContact O-N 3.42Å; P71-G75 VanDerWaalsContact O-N 3.13Å; P71-G76 PolarHBondContact O-N 3.48Å; P71-L104 HydrophobicContact CB-CD1 4.13Å; P71-L104 HydrophobicContact CG-CD1 3.74Å
72I98.8Very high98.1Very high12 Ų125.9 Ų5.96%0.0623%0.03CC..Iπ-helixtrans-70.4-49.5179.7-68.4172.4000111.4L19 M68 V69 M70 G76 F77 I388L19-I72 HydrophobicContact CD2-CG2 3.96Å; M68-I72 HydrophobicContact CE-CD1 4.36Å; M68-I72 HydrophobicContact CG-CD1 3.84Å; M68-I72 WeakPolarHBondContact O-CB 3.49Å; M68-I72 VanDerWaalsContact O-CG1 3.23Å; M68-I72 WeakPolarHBondContact O-CG1 3.29Å; M68-I72 PolarHBondContact O-N 3.44Å; V69-I72 PolarHBondContact O-N 3.42Å; M70-I72 VanDerWaalsContact C-N 3.33Å; M70-I72 PolarHBondContact O-N 3.41Å; I72-G76 CarbonylContact O-C 3.6Å; I72-G76 VanDerWaalsContact O-CA 3.28Å; I72-G76 WeakPolarHBondContact O-CA 3.11Å; I72-G76 PolarHBondContact O-N 3.02Å; I72-F77 HydrophobicContact CG2-CD2 3.99Å; I72-F77 HydrophobicContact CG2-CE2 3.73Å; I72-F77 WeakPolarHBondContact O-CD2 3.36Å; I72-F77 PolarHBondContact O-N 2.73Å; I72-I388 HydrophobicContact CB-CD1 4.19Å; I72-I388 HydrophobicContact CD1-CG2 4.5Å; I72-I388 HydrophobicContact CG2-CB 4.37Å; I72-I388 HydrophobicContact CG2-CD1 3.94Å; I72-I388 HydrophobicContact CG2-CG1 3.83Å; I72-I388 HydrophobicContact CG2-CG2 3.67Å
73M97.4Very high98.1Very high1 Ų15.8 Ų5.81%0.0053%0.029CC..Iπ-helixtrans-75.3-49.8-172.5-71.7-161.8-6400113.4V69 M70 F77 G78 L245 P248 M252 A384 I388V69-M73 HydrophobicContact CG1-CE 3.2Å; V69-M73 HydrophobicContact CG1-SD 4.49Å; V69-M73 WeakPolarHBondContact O-CB 3.39Å; V69-M73 PolarHBondContact O-N 3.33Å; M70-M73 PolarHBondContact O-N 3.03Å; M73-F77 WeakPolarHBondContact O-CB 3.4Å; M73-G78 PolarHBondContact O-N 3.47Å; M73-G78 VanDerWaalsContact O-N 3.13Å; M73-L245 VanDerWaalsContact CE-C 3.5Å; M73-L245 WeakPolarHBondContact CE-O 3.44Å; M73-P248 HydrophobicContact CB-CB 4.08Å; M73-P248 HydrophobicContact CB-CG 4.44Å; M73-P248 HydrophobicContact SD-CB 4.23Å; M73-M252 HydrophobicContact CG-CE 3.92Å; M73-M252 HydrophobicContact SD-CE 3.85Å; M73-A384 HydrophobicContact CE-CB 4.04Å; M73-A384 HydrophobicContact SD-CB 4.36Å; M73-I388 HydrophobicContact CG-CD1 3.83Å; M73-I388 HydrophobicContact CG-CG1 3.58Å; M73-I388 HydrophobicContact SD-CD1 4.41Å; M73-I388 HydrophobicContact SD-CG1 4.15Å
74I96.6Very high98Very high17 Ų175.9 Ų5.99%0.0873%0.03CC..Iπ-helixtrans-89.1-48.7-177.7-64.8-61.1000110.3M70 G78 F163 V187 T190 P248M70-I74 PolarHBondContact O-N 3.31Å; I74-G78 WeakPolarHBondContact O-CA 3.25Å; I74-G78 PolarHBondContact O-N 3.3Å; I74-F163 HydrophobicContact CG2-CD2 4.11Å; I74-F163 HydrophobicContact CG2-CE2 3.6Å; I74-F163 HydrophobicContact CG2-CZ 4.46Å; I74-F163 VanDerWaalsContact O-CZ 3.29Å; I74-F163 WeakPolarHBondContact O-CZ 3.34Å; I74-V187 HydrophobicContact CD1-CG1 4.41Å; I74-V187 HydrophobicContact CD1-CG2 4.41Å; I74-T190 HydrophobicContact CD1-CG2 3.52Å; I74-T190 HydrophobicContact CG1-CG2 3.95Å; I74-P248 HydrophobicContact CD1-CB 4.34Å; I74-P248 HydrophobicContact CD1-CG 3.45Å; I74-P248 VanDerWaalsContact CD1-CG 3.45Å; I74-P248 HydrophobicContact CG1-CG 4.21Å
75G97.5Very high97.8Very high4 Ų44.5 Ų4.54%0.0412%0.023CC..Iπ-helixtrans-67.5-48.7179.500000113Y18 M70 P71 N79Y18-G75 VanDerWaalsContact CB-C 3.41Å; Y18-G75 VanDerWaalsContact CD2-C 3.49Å; Y18-G75 VanDerWaalsContact CD2-O 3.23Å; Y18-G75 WeakPolarHBondContact CD2-O 3.48Å; Y18-G75 VanDerWaalsContact CG-C 3.43Å; Y18-G75 VanDerWaalsContact CG-CA 3.43Å; M70-G75 PolarHBondContact O-N 3.46Å; P71-G75 CarbonylContact O-C 3.57Å; P71-G75 VanDerWaalsContact O-C 3.28Å; P71-G75 WeakPolarHBondContact O-CA 3.42Å; P71-G75 PolarHBondContact O-N 3.42Å; P71-G75 VanDerWaalsContact O-N 3.13Å; G75-N79 WeakPolarHBondContact O-CB 3.38Å; G75-N79 PolarHBondContact O-ND2 3.49Å
76G98.5Very high97.8Very high0 Ų04.3 Ų4.30%02%0.022CC..Iπ-helixtrans-81.1-72.3-173.700000112.4G15 P71 I72 G78 N79 W80G15-G76 WeakPolarHBondContact O-CA 3.49Å; P71-G76 PolarHBondContact O-N 3.48Å; I72-G76 CarbonylContact O-C 3.6Å; I72-G76 VanDerWaalsContact O-CA 3.28Å; I72-G76 WeakPolarHBondContact O-CA 3.11Å; I72-G76 PolarHBondContact O-N 3.02Å; G76-G78 PolarHBondContact O-N 2.82Å; G76-N79 PolarHBondContact O-N 2.84Å; G76-W80 WeakPolarHBondContact O-CB 3.26Å; G76-W80 PolarHBondContact O-N 3.09Å
77F98.8Very high97.6Very high0 Ų04 Ų40%02%0.022CC..Iπ-helixtrans-62.5-41.5-179.8-72-72000112L19 I72 M73 W80 L81 F183 M252 I388 F392 W395 F399L19-F77 HydrophobicContact CD2-CE2 4.48Å; I72-F77 HydrophobicContact CG2-CD2 3.99Å; I72-F77 HydrophobicContact CG2-CE2 3.73Å; I72-F77 WeakPolarHBondContact O-CD2 3.36Å; I72-F77 PolarHBondContact O-N 2.73Å; M73-F77 WeakPolarHBondContact O-CB 3.4Å; F77-W80 PolarHBondContact O-N 3.06Å; F77-L81 HydrophobicContact CB-CD1 4.25Å; F77-L81 HydrophobicContact CD1-CD1 3.91Å; F77-L81 VanDerWaalsContact O-CB 3.24Å; F77-L81 WeakPolarHBondContact O-CB 3.33Å; F77-L81 WeakPolarHBondContact O-CG 3.41Å; F77-L81 PolarHBondContact O-N 2.96Å; F77-F183 HydrophobicContact CB-CE2 4.37Å; F77-F183 HydrophobicContact CB-CZ 3.76Å; F77-M252 HydrophobicContact CB-SD 4.48Å; F77-M252 HydrophobicContact CD1-SD 4.21Å; F77-M252 HydrophobicContact CD2-CE 4.38Å; F77-M252 HydrophobicContact CD2-SD 3.7Å; F77-M252 HydrophobicContact CE1-SD 4.39Å; F77-M252 HydrophobicContact CE2-SD 3.89Å; F77-M252 HydrophobicContact CG-SD 3.88Å; F77-M252 HydrophobicContact CZ-SD 4.24Å; F77-I388 HydrophobicContact CE2-CG2 4.44Å; F77-F392 HydrophobicContact CZ-CB 4.23Å; F77-W395 AromaticContact CD1-CE3 3.91Å; F77-W395 HydrophobicContact CD1-CE3 3.91Å; F77-W395 HydrophobicContact CD1-CZ3 4.39Å; F77-W395 AromaticContact CE1-CE3 3.71Å; F77-W395 HydrophobicContact CE1-CE3 3.71Å; F77-W395 HydrophobicContact CE1-CZ3 4.39Å; F77-F399 HydrophobicContact CD1-CE2 4.21Å; F77-F399 AromaticContact CD1-CZ 3.79Å; F77-F399 HydrophobicContact CD1-CZ 3.79Å; F77-F399 AromaticContact CE1-CE2 3.71Å; F77-F399 HydrophobicContact CE1-CE2 3.71Å; F77-F399 AromaticContact CE1-CZ 3.72Å; F77-F399 HydrophobicContact CE1-CZ 3.72Å
78G98.6Very high97.4Very high0 Ų04 Ų40%02%0.022CC..Iπ-helixtrans-57.5-53.8177.400000112.3M73 I74 G76 W80 V82 F163M73-G78 PolarHBondContact O-N 3.47Å; M73-G78 VanDerWaalsContact O-N 3.13Å; I74-G78 WeakPolarHBondContact O-CA 3.25Å; I74-G78 PolarHBondContact O-N 3.3Å; G76-G78 PolarHBondContact O-N 2.82Å; G78-W80 PolarHBondContact O-N 3.26Å; G78-V82 VanDerWaalsContact O-CB 3.22Å; G78-V82 WeakPolarHBondContact O-CB 3.37Å; G78-V82 VanDerWaalsContact O-CG2 3.31Å; G78-V82 WeakPolarHBondContact O-CG2 3.48Å; G78-V82 PolarHBondContact O-N 2.99Å; G78-F163 VanDerWaalsContact C-CE1 3.46Å
79N98.6Very high97.2Very high1 Ų16.2 Ų6.21%0.0054%0.038CC..Hα-helixtrans-66.2-37.1179.9-79.2-67.5000113H11 G75 G76 P83 N97H11-N79 PolarHBondContact ND1-O 3.22Å; G75-N79 WeakPolarHBondContact O-CB 3.38Å; G75-N79 PolarHBondContact O-ND2 3.49Å; G76-N79 PolarHBondContact O-N 2.84Å; N79-P83 WeakPolarHBondContact O-CD 3.35Å; N79-N97 PolarHBondContact OD1-ND2 3.14Å; N79-N97 PolarHBondContact OD1-OD1 3.23Å
80W98.1Very high97.1Very high12 Ų127.2 Ų7.25%0.0454%0.043CC..Hα-helixtrans-66.3-50.6176.4-97.7101.2000112.6K12 T16 G76 F77 G78 L84 F399 P499K12-W80 HydrophobicContact CB-CD2 4.21Å; K12-W80 HydrophobicContact CB-CE3 4.06Å; K12-W80 HydrophobicContact CB-CH2 3.73Å; K12-W80 HydrophobicContact CB-CZ2 3.86Å; K12-W80 HydrophobicContact CB-CZ3 3.83Å; K12-W80 HydrophobicContact CD-CH2 4.48Å; K12-W80 HydrophobicContact CD-CZ3 4.07Å; K12-W80 HydrophobicContact CG-CD2 4.41Å; K12-W80 HydrophobicContact CG-CE3 3.88Å; K12-W80 HydrophobicContact CG-CH2 4.16Å; K12-W80 HydrophobicContact CG-CZ3 3.74Å; K12-W80 PolarHBondContact O-NE1 3.41Å; K12-W80 VanDerWaalsContact O-NE1 3.17Å; T16-W80 VanDerWaalsContact OG1-CZ2 3.3Å; T16-W80 WeakPolarHBondContact OG1-CZ2 3.4Å; T16-W80 PolarHBondContact OG1-NE1 3.35Å; T16-W80 VanDerWaalsContact OG1-NE1 3.1Å; G76-W80 WeakPolarHBondContact O-CB 3.26Å; G76-W80 PolarHBondContact O-N 3.09Å; F77-W80 PolarHBondContact O-N 3.06Å; G78-W80 PolarHBondContact O-N 3.26Å; W80-L84 HydrophobicContact CE3-CD1 4.4Å; W80-L84 VanDerWaalsContact O-CD1 3.29Å; W80-L84 WeakPolarHBondContact O-CD1 3.37Å; W80-L84 VanDerWaalsContact O-CG 3.32Å; W80-L84 WeakPolarHBondContact O-CG 3.22Å; W80-F399 HydrophobicContact CB-CD1 4.46Å; W80-F399 HydrophobicContact CB-CE1 3.78Å; W80-F399 HydrophobicContact CB-CZ 4.42Å; W80-F399 AromaticContact CD2-CD1 3.58Å; W80-F399 HydrophobicContact CD2-CD1 3.58Å; W80-F399 AromaticContact CD2-CE1 3.82Å; W80-F399 HydrophobicContact CD2-CE1 3.82Å; W80-F399 AromaticContact CE2-CD1 3.89Å; W80-F399 AromaticContact CE3-CD1 3.75Å; W80-F399 HydrophobicContact CE3-CD1 3.75Å; W80-F399 HydrophobicContact CE3-CE1 4.07Å; W80-F399 AromaticContact CG-CD1 3.92Å; W80-F399 HydrophobicContact CG-CD1 3.92Å; W80-F399 AromaticContact CG-CE1 3.7Å; W80-F399 HydrophobicContact CG-CE1 3.7Å; W80-F399 HydrophobicContact CG-CZ 4.48Å; W80-F399 HydrophobicContact CH2-CD1 4.43Å; W80-F399 HydrophobicContact CZ2-CB 4.46Å; W80-F399 HydrophobicContact CZ2-CD1 4.31Å; W80-F399 HydrophobicContact CZ3-CD1 4.17Å; W80-P499 HydrophobicContact CZ3-CG 4.13Å
81L98.4Very high97.1Very high0 Ų06.9 Ų6.90%04%0.041CC..Hα-helixtrans-95-32.3-163.4-59176.8000113.2F77 L84 M85 F183 W395 L398 F399F77-L81 HydrophobicContact CB-CD1 4.25Å; F77-L81 HydrophobicContact CD1-CD1 3.91Å; F77-L81 VanDerWaalsContact O-CB 3.24Å; F77-L81 WeakPolarHBondContact O-CB 3.33Å; F77-L81 WeakPolarHBondContact O-CG 3.41Å; F77-L81 PolarHBondContact O-N 2.96Å; L81-L84 PolarHBondContact O-N 3.24Å; L81-M85 HydrophobicContact CB-CE 4.06Å; L81-M85 HydrophobicContact CB-CG 4.44Å; L81-M85 HydrophobicContact CB-SD 4.07Å; L81-M85 HydrophobicContact CD1-CE 4.04Å; L81-M85 HydrophobicContact CD2-CE 4.35Å; L81-M85 HydrophobicContact CG-CE 4.38Å; L81-M85 VanDerWaalsContact O-CB 3.24Å; L81-M85 WeakPolarHBondContact O-CB 3.17Å; L81-M85 VanDerWaalsContact O-CG 3.28Å; L81-M85 WeakPolarHBondContact O-CG 3.48Å; L81-M85 PolarHBondContact O-N 3.4Å; L81-F183 HydrophobicContact CB-CD1 4.07Å; L81-F183 HydrophobicContact CB-CE1 3.76Å; L81-F183 HydrophobicContact CD1-CD1 4.27Å; L81-F183 HydrophobicContact CD1-CE1 3.98Å; L81-F183 HydrophobicContact CD1-CZ 4.3Å; L81-F183 HydrophobicContact CG-CE1 4.45Å; L81-W395 HydrophobicContact CD1-CD2 3.71Å; L81-W395 HydrophobicContact CD1-CE3 3.83Å; L81-W395 HydrophobicContact CD1-CG 4.35Å; L81-W395 HydrophobicContact CD1-CH2 4.02Å; L81-W395 HydrophobicContact CD1-CZ2 3.87Å; L81-W395 HydrophobicContact CD1-CZ3 4Å; L81-W395 HydrophobicContact CD2-CD2 4.26Å; L81-W395 HydrophobicContact CD2-CG 4.08Å; L81-L398 HydrophobicContact CD2-CD2 3.72Å; L81-F399 HydrophobicContact CD2-CE1 4.22Å
82V98.4Very high97.1Very high0 Ų08.1 Ų8.10%05%0.052CC..Hα-helixtrans-60-53.4-174.5168.30000111.9G78 L84 M85 I86 F163 I167 F183 V187G78-V82 VanDerWaalsContact O-CB 3.22Å; G78-V82 WeakPolarHBondContact O-CB 3.37Å; G78-V82 VanDerWaalsContact O-CG2 3.31Å; G78-V82 WeakPolarHBondContact O-CG2 3.48Å; G78-V82 PolarHBondContact O-N 2.99Å; V82-L84 VanDerWaalsContact C-N 3.28Å; V82-L84 PolarHBondContact O-N 3.44Å; V82-M85 PolarHBondContact O-N 2.74Å; V82-I86 HydrophobicContact CG1-CD1 4.43Å; V82-I86 WeakPolarHBondContact O-CG1 3.22Å; V82-I86 PolarHBondContact O-N 3.31Å; V82-I86 VanDerWaalsContact O-N 3.12Å; V82-F163 HydrophobicContact CB-CD1 4.38Å; V82-F163 HydrophobicContact CB-CE1 4.25Å; V82-F163 HydrophobicContact CG1-CD1 4.37Å; V82-F163 HydrophobicContact CG2-CD1 4.22Å; V82-F163 HydrophobicContact CG2-CE1 4.13Å; V82-I167 HydrophobicContact CG1-CD1 3.99Å; V82-I167 HydrophobicContact CG1-CG1 3.53Å; V82-F183 HydrophobicContact CG2-CE1 4.28Å; V82-V187 HydrophobicContact CG2-CB 4.13Å; V82-V187 HydrophobicContact CG2-CG1 3.99Å; V82-V187 HydrophobicContact CG2-CG2 4.14Å
83P97.3Very high97.1Very high0 Ų011.5 Ų11.50%07%0.066CC..Hα-helixtrans-60-40177.5-26.438000112.3H11 N79 I86 G87 A88 M91H11-P83 HydrophobicContact CB-CG 4.24Å; N79-P83 WeakPolarHBondContact O-CD 3.35Å; P83-I86 PolarHBondContact O-N 3.24Å; P83-G87 PolarHBondContact O-N 2.83Å; P83-A88 HydrophobicContact CB-CB 4.28Å; P83-A88 PolarHBondContact O-N 3Å; P83-M91 HydrophobicContact CG-CG 4.02Å; P83-M91 HydrophobicContact CG-SD 3.51Å; P83-M91 VanDerWaalsContact CG-SD 3.51Å
84L96.3Very high97.1Very high1 Ų113.2 Ų13.21%0.0058%0.077CC..Hα-helixtrans-64.7-44.6179.7-67.3-178.1000112.9W80 L81 V82 I86 G87 L398 L491 E492 P499 F504W80-L84 HydrophobicContact CE3-CD1 4.4Å; W80-L84 VanDerWaalsContact O-CD1 3.29Å; W80-L84 WeakPolarHBondContact O-CD1 3.37Å; W80-L84 VanDerWaalsContact O-CG 3.32Å; W80-L84 WeakPolarHBondContact O-CG 3.22Å; L81-L84 PolarHBondContact O-N 3.24Å; V82-L84 VanDerWaalsContact C-N 3.28Å; V82-L84 PolarHBondContact O-N 3.44Å; L84-I86 VanDerWaalsContact C-N 3.32Å; L84-I86 PolarHBondContact O-N 2.92Å; L84-G87 PolarHBondContact O-N 3.32Å; L84-L398 HydrophobicContact CD1-CD2 4.17Å; L84-L491 WeakPolarHBondContact O-CB 3.35Å; L84-E492 HydrophobicContact CB-CB 3.89Å; L84-E492 HydrophobicContact CD1-CB 4.35Å; L84-P499 HydrophobicContact CD1-CG 4.42Å; L84-F504 HydrophobicContact CD2-CE2 3.93Å
85M95.6Very high97.2Very high1 Ų122.2 Ų22.21%0.00511%0.11CC..Hα-helixtrans-74.8-19.9-177.2-74.7-178.1174.600113.5L81 V82 P181 F183 V184 W395 E492L81-M85 HydrophobicContact CB-CE 4.06Å; L81-M85 HydrophobicContact CB-CG 4.44Å; L81-M85 HydrophobicContact CB-SD 4.07Å; L81-M85 HydrophobicContact CD1-CE 4.04Å; L81-M85 HydrophobicContact CD2-CE 4.35Å; L81-M85 HydrophobicContact CG-CE 4.38Å; L81-M85 VanDerWaalsContact O-CB 3.24Å; L81-M85 WeakPolarHBondContact O-CB 3.17Å; L81-M85 VanDerWaalsContact O-CG 3.28Å; L81-M85 WeakPolarHBondContact O-CG 3.48Å; L81-M85 PolarHBondContact O-N 3.4Å; V82-M85 PolarHBondContact O-N 2.74Å; M85-P181 HydrophobicContact CB-CG 4.21Å; M85-F183 HydrophobicContact CE-CD1 4.44Å; M85-F183 HydrophobicContact SD-CB 4.01Å; M85-F183 HydrophobicContact SD-CD1 3.76Å; M85-F183 HydrophobicContact SD-CG 4.29Å; M85-V184 HydrophobicContact CB-CG2 3.7Å; M85-V184 HydrophobicContact SD-CG2 4.29Å; M85-W395 HydrophobicContact CE-CZ2 3.73Å; M85-E492 HydrophobicContact CE-CG 4.24Å; M85-E492 HydrophobicContact CG-CB 4.25Å
86I95.3Very high97.2Very high0 Ų024.7 Ų24.70%012%0.122CC..Hα-helixtrans-100.8-2.6172.174.4-177.7000113V82 P83 L84 A88 T166 K171 P172 V184V82-I86 HydrophobicContact CG1-CD1 4.43Å; V82-I86 WeakPolarHBondContact O-CG1 3.22Å; V82-I86 PolarHBondContact O-N 3.31Å; V82-I86 VanDerWaalsContact O-N 3.12Å; P83-I86 PolarHBondContact O-N 3.24Å; L84-I86 VanDerWaalsContact C-N 3.32Å; L84-I86 PolarHBondContact O-N 2.92Å; I86-A88 HydrophobicContact CD1-CB 3.94Å; I86-A88 HydrophobicContact CG1-CB 3.72Å; I86-T166 HydrophobicContact CD1-CG2 4Å; I86-K171 HydrophobicContact CB-CG 4.21Å; I86-K171 HydrophobicContact CD1-CG 4.43Å; I86-K171 HydrophobicContact CG2-CG 4.48Å; I86-P172 WeakPolarHBondContact O-CD 3.47Å; I86-V184 HydrophobicContact CG2-CB 4.4Å; I86-V184 HydrophobicContact CG2-CG1 3.72Å; I86-V184 HydrophobicContact CG2-CG2 3.9Å
87G93.8Very high97.2Very high5 Ų524.7 Ų24.75%0.05212%0.122CC..THydrogen-bonded Turntrans71.428.3-177.900000114.6P83 L84 F504P83-G87 PolarHBondContact O-N 2.83Å; L84-G87 PolarHBondContact O-N 3.32Å; G87-F504 WeakPolarHBondContact O-CB 3.3Å; G87-F504 WeakPolarHBondContact O-CG 3.5Å
88A94.9Very high97.2Very high0 Ų025.8 Ų25.80%013%0.127CC..  trans-90.5145.3175.200000111.1P83 I86 M170 F504P83-A88 HydrophobicContact CB-CB 4.28Å; P83-A88 PolarHBondContact O-N 3Å; I86-A88 HydrophobicContact CD1-CB 3.94Å; I86-A88 HydrophobicContact CG1-CB 3.72Å; A88-M170 HydrophobicContact CB-CB 4.01Å; A88-M170 HydrophobicContact CB-CE 4.44Å; A88-F504 WeakPolarHBondContact O-CD2 3.39Å
89P94.4Very high97.2Very high60 Ų6030.7 Ų30.739%0.3915%0.152SC..SBendtrans-71.8-29.1-179.927.2-34.7000113.9T503P89-T503 VanDerWaalsContact CA-O 3.25Å; P89-T503 WeakPolarHBondContact CA-O 3.28Å; P89-T503 WeakPolarHBondContact CB-O 3.47Å
90D96.4Very high97.2Very high23 Ų2330.8 Ų30.812%0.12315%0.152CC..SBendtrans-161.9-174.7176.4-148.9-27.2000109.7T9 H11 M170T9-D90 VanDerWaalsContact O-OD2 3.1Å; H11-D90 VanDerWaalsContact CB-OD1 3.26Å; H11-D90 WeakPolarHBondContact CB-OD1 3.23Å; H11-D90 IonicContact CD2-OD1 3.44Å; H11-D90 PolarHBondContact CD2-OD1 2.67Å; H11-D90 VanDerWaalsContact CD2-OD1 3.31Å; H11-D90 IonicContact CG-OD1 3.36Å; H11-D90 PolarHBondContact N-OD1 3.31Å; D90-M170 WeakPolarHBondContact O-CE 3.39Å
91M97.4Very high97.2Very high3 Ų330.7 Ų30.72%0.01515%0.152CC..  trans-75.2155.8169.7-61.7-70.3-71.100112H11 P83 F93 P94 N162 F163 T166H11-M91 HydrophobicContact CB-CG 3.8Å; P83-M91 HydrophobicContact CG-CG 4.02Å; P83-M91 HydrophobicContact CG-SD 3.51Å; P83-M91 VanDerWaalsContact CG-SD 3.51Å; M91-F93 VanDerWaalsContact C-N 3.35Å; M91-F93 PolarHBondContact O-N 3.35Å; M91-P94 WeakPolarHBondContact O-CD 3.4Å; M91-P94 WeakPolarHBondContact O-CG 3.41Å; M91-N162 HydrophobicContact CE-CB 4.3Å; M91-N162 WeakPolarHBondContact CE-ND2 3.44Å; M91-F163 HydrophobicContact CE-CD1 3.46Å; M91-F163 VanDerWaalsContact CE-CD1 3.46Å; M91-F163 HydrophobicContact CE-CE1 3.54Å; M91-F163 HydrophobicContact CE-CG 4.03Å; M91-F163 HydrophobicContact CE-CZ 4.2Å; M91-F163 HydrophobicContact SD-CD1 4.37Å; M91-F163 HydrophobicContact SD-CE1 4.17Å; M91-T166 HydrophobicContact SD-CG2 3.88Å
92A98.1Very high97.2Very high31 Ų3135.1 Ų35.126%0.25617%0.169SC..SBendtrans-63.6-36.7-17800000113.4P94 N162 T165 T166 M170A92-P94 WeakPolarHBondContact O-CD 3.46Å; A92-N162 PolarHBondContact N-OD1 3.48Å; A92-T165 HydrophobicContact CB-CG2 3.76Å; A92-T166 WeakPolarHBondContact CB-OG1 3.38Å; A92-T166 PolarHBondContact N-OG1 2.86Å; A92-M170 WeakPolarHBondContact CA-SD 3.12Å; A92-M170 HydrophobicContact CB-CG 4.48Å; A92-M170 HydrophobicContact CB-SD 3.62Å; A92-M170 PolarHBondContact N-SD 2.96Å
93F98.4Very high97.2Very high82 Ų8236.5 Ų36.536%0.3618%0.176SC..  trans-122.875.6179.4-52.3-53.2000111.7M91 R95 M96 N97 I161 N162 T165M91-F93 VanDerWaalsContact C-N 3.35Å; M91-F93 PolarHBondContact O-N 3.35Å; F93-R95 VanDerWaalsContact C-N 3.34Å; F93-R95 PolarHBondContact O-N 2.95Å; F93-M96 HydrophobicContact CB-CB 3.68Å; F93-M96 HydrophobicContact CB-CE 4.48Å; F93-M96 HydrophobicContact CB-SD 4.29Å; F93-M96 HydrophobicContact CD2-CE 4.24Å; F93-M96 HydrophobicContact CD2-SD 4.11Å; F93-M96 HydrophobicContact CG-CE 4.41Å; F93-M96 WeakPolarHBondContact O-CB 3.47Å; F93-M96 PolarHBondContact O-N 3.31Å; F93-M96 VanDerWaalsContact O-N 3.14Å; F93-N97 PolarHBondContact O-N 3.1Å; F93-I161 HydrophobicContact CE2-CG2 4.16Å; F93-N162 HydrophobicContact CD2-CB 4.34Å; F93-N162 PolarHBondContact N-OD1 2.92Å; F93-N162 PolarHBondContact O-ND2 3.38Å; F93-T165 HydrophobicContact CE2-CG2 3.78Å; F93-T165 WeakPolarHBondContact CE2-OG1 3.42Å; F93-T165 HydrophobicContact CZ-CG2 3.78Å
94P97.9Very high97.3Very high37 Ų3736.8 Ų36.824%0.2418%0.178CC..Hα-helixtrans-57.3-38.8-173.8-29.137.4000115T9 M91 A92 N97 N98T9-P94 HydrophobicContact CG2-CB 4.23Å; T9-P94 WeakPolarHBondContact O-CB 3.41Å; M91-P94 WeakPolarHBondContact O-CD 3.4Å; M91-P94 WeakPolarHBondContact O-CG 3.41Å; A92-P94 WeakPolarHBondContact O-CD 3.46Å; P94-N97 VanDerWaalsContact O-CB 3.25Å; P94-N97 WeakPolarHBondContact O-CB 3.43Å; P94-N97 PolarHBondContact O-N 3.39Å; P94-N98 PolarHBondContact O-N 3.48Å; P94-N98 VanDerWaalsContact O-N 3.1Å
95R98.4Very high97.4Very high206 Ų20638.3 Ų38.378%0.77719%0.187SC*.Hα-helixtrans-73.7-36.2178.8-64.7-179.5-174.8170.51.7112.7T9 F93 N97 N98 M99T9-R95 HydrophobicContact CG2-CG 4.1Å; F93-R95 VanDerWaalsContact C-N 3.34Å; F93-R95 PolarHBondContact O-N 2.95Å; R95-N97 VanDerWaalsContact C-N 3.25Å; R95-N98 PolarHBondContact O-N 3.38Å; R95-M99 PolarHBondContact O-N 3.44Å
96M98Very high97.5Very high57 Ų5740.8 Ų40.828%0.28120%0.204SC..Hα-helixtrans-64.7-36.6173.2-175.9-175.2-67.300110.2F93 M99 S100 L158 I161F93-M96 HydrophobicContact CB-CB 3.68Å; F93-M96 HydrophobicContact CB-CE 4.48Å; F93-M96 HydrophobicContact CB-SD 4.29Å; F93-M96 HydrophobicContact CD2-CE 4.24Å; F93-M96 HydrophobicContact CD2-SD 4.11Å; F93-M96 HydrophobicContact CG-CE 4.41Å; F93-M96 WeakPolarHBondContact O-CB 3.47Å; F93-M96 PolarHBondContact O-N 3.31Å; F93-M96 VanDerWaalsContact O-N 3.14Å; M96-M99 PolarHBondContact O-N 3.27Å; M96-S100 WeakPolarHBondContact O-CB 3.49Å; M96-S100 PolarHBondContact O-N 2.62Å; M96-L158 HydrophobicContact CE-CD2 4.45Å; M96-L158 HydrophobicContact CG-CB 3.86Å; M96-L158 HydrophobicContact CG-CD2 3.96Å; M96-L158 HydrophobicContact CG-CG 4.34Å; M96-L158 HydrophobicContact SD-CB 4.3Å; M96-L158 HydrophobicContact SD-CD2 4.04Å; M96-I161 HydrophobicContact SD-CB 4.48Å; M96-I161 HydrophobicContact SD-CG2 4.35Å
97N98.4Very high97.7Very high0 Ų040.8 Ų40.80%020%0.204CC..Hα-helixtrans-60.7-46.5173.1-15632000112.3I14 N79 F93 P94 R95 S100 F101 N162I14-N97 HydrophobicContact CD1-CB 4.05Å; N79-N97 PolarHBondContact OD1-ND2 3.14Å; N79-N97 PolarHBondContact OD1-OD1 3.23Å; F93-N97 PolarHBondContact O-N 3.1Å; P94-N97 VanDerWaalsContact O-CB 3.25Å; P94-N97 WeakPolarHBondContact O-CB 3.43Å; P94-N97 PolarHBondContact O-N 3.39Å; R95-N97 VanDerWaalsContact C-N 3.25Å; N97-S100 WeakPolarHBondContact O-CB 3.48Å; N97-S100 PolarHBondContact O-N 2.94Å; N97-F101 PolarHBondContact O-N 3.42Å; N97-N162 WeakPolarHBondContact CB-ND2 3.36Å
98N98.6Very high97.9Very high22 Ų2240.8 Ų40.812%0.11820%0.203CC..Hα-helixtrans-62.9-44.7176.7-169.839000111.3L6 S8 I14 P94 R95 S100 F101 W102L6-N98 PolarHBondContact O-ND2 3.43Å; L6-N98 VanDerWaalsContact O-ND2 3.11Å; S8-N98 VanDerWaalsContact O-CB 3.29Å; S8-N98 WeakPolarHBondContact O-CB 3.26Å; S8-N98 VanDerWaalsContact O-CG 3.22Å; S8-N98 PolarHBondContact O-ND2 2.9Å; I14-N98 HydrophobicContact CD1-CB 3.91Å; P94-N98 PolarHBondContact O-N 3.48Å; P94-N98 VanDerWaalsContact O-N 3.1Å; R95-N98 PolarHBondContact O-N 3.38Å; N98-S100 VanDerWaalsContact C-N 3.33Å; N98-S100 PolarHBondContact O-N 3.28Å; N98-F101 PolarHBondContact O-N 3.34Å; N98-W102 PolarHBondContact O-N 2.97Å; N98-W102 PolarHBondContact OD1-NE1 2.93Å
99M98.1Very high98.1Very high104 Ų10446.4 Ų46.451%0.51223%0.232SC..Hα-helixtrans-60.6-41.5176.4-177.9176.7177.400112R95 M96 F101 W102 L103 L158R95-M99 PolarHBondContact O-N 3.44Å; M96-M99 PolarHBondContact O-N 3.27Å; M99-F101 VanDerWaalsContact C-N 3.31Å; M99-F101 PolarHBondContact O-N 3.32Å; M99-W102 PolarHBondContact O-N 3.48Å; M99-L103 HydrophobicContact CE-CD1 4.4Å; M99-L103 HydrophobicContact CG-CD1 4.38Å; M99-L103 WeakPolarHBondContact O-CG 3.25Å; M99-L103 PolarHBondContact O-N 3.14Å; M99-L158 HydrophobicContact CE-CD1 4.32Å; M99-L158 HydrophobicContact CG-CD1 4.17Å; M99-L158 HydrophobicContact SD-CD1 4.12Å
100S98.4Very high98.3Very high3 Ų345.8 Ų45.82%0.02123%0.225CC..Hα-helixtrans-54.3-48.1175.3177.40000110.6Y18 M96 N97 N98 S155Y18-S100 VanDerWaalsContact OH-C 3.24Å; Y18-S100 WeakPolarHBondContact OH-CB 3.34Å; Y18-S100 PolarHBondContact OH-OG 3.02Å; M96-S100 WeakPolarHBondContact O-CB 3.49Å; M96-S100 PolarHBondContact O-N 2.62Å; N97-S100 WeakPolarHBondContact O-CB 3.48Å; N97-S100 PolarHBondContact O-N 2.94Å; N98-S100 VanDerWaalsContact C-N 3.33Å; N98-S100 PolarHBondContact O-N 3.28Å; S100-S155 VanDerWaalsContact O-CB 3.23Å; S100-S155 WeakPolarHBondContact O-CB 3.49Å; S100-S155 PolarHBondContact O-OG 3.47Å; S100-S155 PolarHBondContact OG-O 2.7Å; S100-S155 PolarHBondContact OG-OG 3.32Å
101F98.8Very high98.4Very high9 Ų944.9 Ų44.94%0.03922%0.22CC..Hα-helixtrans-62.1-50.2176.6171.2-102.2000112.4I14 L17 Y18 F21 N97 N98 M99 L103 L104 P105I14-F101 HydrophobicContact CG2-CB 4.18Å; L17-F101 VanDerWaalsContact C-CE2 3.48Å; L17-F101 HydrophobicContact CB-CD1 4.1Å; L17-F101 HydrophobicContact CB-CD2 4Å; L17-F101 HydrophobicContact CB-CE1 3.77Å; L17-F101 HydrophobicContact CB-CE2 3.66Å; L17-F101 HydrophobicContact CB-CG 4.22Å; L17-F101 HydrophobicContact CB-CZ 3.55Å; L17-F101 HydrophobicContact CD1-CD1 3.93Å; L17-F101 HydrophobicContact CD1-CE1 3.81Å; L17-F101 HydrophobicContact CD1-CZ 4.44Å; L17-F101 HydrophobicContact CD2-CE1 4.47Å; L17-F101 HydrophobicContact CD2-CZ 4.5Å; L17-F101 HydrophobicContact CG-CE1 4.23Å; L17-F101 HydrophobicContact CG-CZ 4.38Å; L17-F101 WeakPolarHBondContact O-CE2 2.96Å; Y18-F101 AromaticContact CD1-CD2 3.86Å; Y18-F101 HydrophobicContact CD1-CD2 3.86Å; Y18-F101 HydrophobicContact CD2-CB 4.33Å; Y18-F101 HydrophobicContact CD2-CD2 4.11Å; Y18-F101 HydrophobicContact CE1-CB 4.27Å; Y18-F101 HydrophobicContact CE1-CD2 4.03Å; Y18-F101 HydrophobicContact CE2-CB 3.71Å; Y18-F101 HydrophobicContact CE2-CD2 4.25Å; Y18-F101 HydrophobicContact CE2-CG 4.43Å; Y18-F101 AromaticContact CG-CD2 3.91Å; Y18-F101 HydrophobicContact CG-CD2 3.91Å; Y18-F101 WeakPolarHBondContact OH-CA 3.32Å; Y18-F101 PolarHBondContact OH-N 3.34Å; F21-F101 HydrophobicContact CB-CE2 3.9Å; F21-F101 HydrophobicContact CB-CZ 4.44Å; F21-F101 HydrophobicContact CG-CE2 4.36Å; N97-F101 PolarHBondContact O-N 3.42Å; N98-F101 PolarHBondContact O-N 3.34Å; M99-F101 VanDerWaalsContact C-N 3.31Å; M99-F101 PolarHBondContact O-N 3.32Å; F101-L103 PolarHBondContact O-N 3.42Å; F101-L103 VanDerWaalsContact O-N 3.09Å; F101-L104 WeakPolarHBondContact O-CB 3.02Å; F101-L104 PolarHBondContact O-N 3.14Å; F101-P105 HydrophobicContact CZ-CG 4.37Å; F101-P105 WeakPolarHBondContact O-CD 3.42Å
102W98.6Very high98.4Very high94 Ų9446.7 Ų46.736%0.35623%0.23SC..Hα-helixtrans-68.5-10.7-172.1-78.4110.9000114.9L6 N98 M99 P105 P106L6-W102 HydrophobicContact CD2-CH2 3.44Å; L6-W102 VanDerWaalsContact CD2-CH2 3.44Å; L6-W102 HydrophobicContact CD2-CZ2 3.46Å; L6-W102 VanDerWaalsContact CD2-CZ2 3.46Å; L6-W102 HydrophobicContact CD2-CZ3 4.5Å; L6-W102 PolarHBondContact O-NE1 3.48Å; N98-W102 PolarHBondContact O-N 2.97Å; N98-W102 PolarHBondContact OD1-NE1 2.93Å; M99-W102 PolarHBondContact O-N 3.48Å; W102-P105 HydrophobicContact CE3-CG 4.35Å; W102-P106 WeakPolarHBondContact O-CD 3.07Å; W102-P106 WeakPolarHBondContact O-CG 3.49Å
103L98.6Very high98.4Very high29 Ų2946.6 Ų46.615%0.15223%0.229CC..THydrogen-bonded Turntrans-77.8-21.2170.1-70.1170.3000113.1M99 F101 P106 S107 L151 V154 L158M99-L103 HydrophobicContact CE-CD1 4.4Å; M99-L103 HydrophobicContact CG-CD1 4.38Å; M99-L103 WeakPolarHBondContact O-CG 3.25Å; M99-L103 PolarHBondContact O-N 3.14Å; F101-L103 PolarHBondContact O-N 3.42Å; F101-L103 VanDerWaalsContact O-N 3.09Å; L103-P106 WeakPolarHBondContact O-CD 3.19Å; L103-P106 WeakPolarHBondContact O-CG 3.44Å; L103-S107 WeakPolarHBondContact O-CB 3.24Å; L103-S107 PolarHBondContact O-N 2.87Å; L103-L151 HydrophobicContact CD2-CD2 4.25Å; L103-V154 HydrophobicContact CD1-CB 4.22Å; L103-V154 HydrophobicContact CD1-CG1 3.68Å; L103-L158 HydrophobicContact CD1-CD1 4.11Å
104L98.8Very high98.4Very high5 Ų542.9 Ų42.93%0.02621%0.213CC..Hα-helixtrans-73.1-44.1-178.2-66.6-178.6000114.5Y18 F21 P71 F101 S107 L108 A152Y18-L104 HydrophobicContact CD1-CD1 3.87Å; Y18-L104 HydrophobicContact CE1-CD1 3.46Å; Y18-L104 VanDerWaalsContact CE1-CD1 3.46Å; F21-L104 HydrophobicContact CD1-CB 4.45Å; F21-L104 HydrophobicContact CD1-CD1 4.28Å; F21-L104 HydrophobicContact CE1-CB 3.84Å; F21-L104 HydrophobicContact CE1-CD1 4.08Å; F21-L104 HydrophobicContact CE2-CB 4.47Å; F21-L104 HydrophobicContact CZ-CB 3.83Å; P71-L104 HydrophobicContact CB-CD1 4.13Å; P71-L104 HydrophobicContact CG-CD1 3.74Å; F101-L104 WeakPolarHBondContact O-CB 3.02Å; F101-L104 PolarHBondContact O-N 3.14Å; L104-S107 WeakPolarHBondContact O-CB 3.47Å; L104-S107 PolarHBondContact O-N 3.11Å; L104-L108 PolarHBondContact O-N 3.08Å; L104-A152 HydrophobicContact CD2-CB 4.34Å
105P98.7Very high98.2Very high33 Ų3342.8 Ų42.821%0.21422%0.216CC..Hα-helixtrans-56.3-50.4175.6-2533.8000114.5F21 F101 W102 S107 L108 L109F21-P105 HydrophobicContact CD2-CG 4.36Å; F21-P105 HydrophobicContact CE2-CB 4.47Å; F21-P105 HydrophobicContact CE2-CG 4.25Å; F101-P105 HydrophobicContact CZ-CG 4.37Å; F101-P105 WeakPolarHBondContact O-CD 3.42Å; W102-P105 HydrophobicContact CE3-CG 4.35Å; P105-S107 VanDerWaalsContact C-N 3.3Å; P105-S107 PolarHBondContact O-N 3.14Å; P105-L108 PolarHBondContact O-N 2.99Å; P105-L109 WeakPolarHBondContact O-CG 3.38Å; P105-L109 PolarHBondContact O-N 3.3Å
106P98.7Very high98Very high54 Ų5440 Ų4035%0.35121%0.213SC..Hα-helixtrans-65.7-33.4176.525.3-32.4000112.3W102 L103 L109 L110 L151W102-P106 WeakPolarHBondContact O-CD 3.07Å; W102-P106 WeakPolarHBondContact O-CG 3.49Å; L103-P106 WeakPolarHBondContact O-CD 3.19Å; L103-P106 WeakPolarHBondContact O-CG 3.44Å; P106-L109 PolarHBondContact O-N 3.39Å; P106-L110 WeakPolarHBondContact O-CG 3.29Å; P106-L110 PolarHBondContact O-N 3.4Å; P106-L151 HydrophobicContact CB-CD1 4.39Å; P106-L151 HydrophobicContact CG-CD1 4.47Å
107S98.8Very high97.9Very high0 Ų039.8 Ų39.80%022%0.215CC..Hα-helixtrans-59.7-48.41731750000111.9F67 L103 L104 P105 L109 L110 L111 S148 A152F67-S107 VanDerWaalsContact CE1-OG 3.28Å; F67-S107 WeakPolarHBondContact CE1-OG 3.46Å; F67-S107 WeakPolarHBondContact CZ-OG 3.38Å; L103-S107 WeakPolarHBondContact O-CB 3.24Å; L103-S107 PolarHBondContact O-N 2.87Å; L104-S107 WeakPolarHBondContact O-CB 3.47Å; L104-S107 PolarHBondContact O-N 3.11Å; P105-S107 VanDerWaalsContact C-N 3.3Å; P105-S107 PolarHBondContact O-N 3.14Å; S107-L109 VanDerWaalsContact C-N 3.33Å; S107-L109 PolarHBondContact O-N 3.3Å; S107-L110 WeakPolarHBondContact O-CB 3.31Å; S107-L110 PolarHBondContact O-N 2.86Å; S107-L111 PolarHBondContact O-N 3.3Å; S107-S148 WeakPolarHBondContact O-CB 3.31Å; S107-S148 PolarHBondContact O-OG 3.07Å; S107-S148 VanDerWaalsContact O-OG 3.07Å; S107-S148 PolarHBondContact OG-O 3.27Å; S107-S148 PolarHBondContact OG-OG 3.04Å; S107-A152 PolarHBondContact OG-N 3.13Å
108L98.7Very high97.6Very high5 Ų545.7 Ų45.73%0.02624%0.243CC..Hα-helixtrans-64.4-38176.9-178.355.5000112.2F21 W24 A25 V63 F67 L104 P105 L110 L111 L112F21-L108 HydrophobicContact CE2-CB 4.27Å; F21-L108 HydrophobicContact CE2-CD2 3.69Å; F21-L108 HydrophobicContact CZ-CB 3.93Å; F21-L108 HydrophobicContact CZ-CD2 3.62Å; F21-L108 HydrophobicContact CZ-CG 4.43Å; W24-L108 HydrophobicContact CE3-CD2 4.07Å; W24-L108 HydrophobicContact CZ3-CD2 3.67Å; A25-L108 HydrophobicContact CB-CD2 4.29Å; V63-L108 HydrophobicContact CG2-CD1 4.21Å; F67-L108 HydrophobicContact CB-CD1 4.24Å; F67-L108 HydrophobicContact CD1-CB 3.74Å; F67-L108 HydrophobicContact CD1-CD1 4.11Å; F67-L108 HydrophobicContact CD1-CG 4.34Å; F67-L108 HydrophobicContact CD2-CD1 4.07Å; F67-L108 HydrophobicContact CE1-CB 3.72Å; F67-L108 HydrophobicContact CE1-CD1 4.47Å; F67-L108 HydrophobicContact CE2-CD1 4.47Å; F67-L108 HydrophobicContact CG-CB 4.37Å; F67-L108 HydrophobicContact CG-CD1 3.86Å; F67-L108 HydrophobicContact CZ-CB 4.38Å; L104-L108 PolarHBondContact O-N 3.08Å; P105-L108 PolarHBondContact O-N 2.99Å; L108-L110 VanDerWaalsContact C-N 3.32Å; L108-L110 PolarHBondContact O-N 3.04Å; L108-L111 HydrophobicContact CD1-CD2 4.38Å; L108-L111 PolarHBondContact O-N 3.33Å; L108-L112 HydrophobicContact CD1-CD1 4.49Å; L108-L112 HydrophobicContact CD1-CG 4.28Å; L108-L112 HydrophobicContact CG-CD1 4.29Å; L108-L112 HydrophobicContact CG-CG 4.5Å; L108-L112 WeakPolarHBondContact O-CG 3.4Å; L108-L112 PolarHBondContact O-N 3.14Å
109L98.5Very high97.3Very high117 Ų11747.6 Ų47.661%0.61326%0.261SS*.Hα-helixtrans-62.8-39.4174.8-70.7174.3000111.9P105 P106 S107 L112 A113P105-L109 WeakPolarHBondContact O-CG 3.38Å; P105-L109 PolarHBondContact O-N 3.3Å; P106-L109 PolarHBondContact O-N 3.39Å; S107-L109 VanDerWaalsContact C-N 3.33Å; S107-L109 PolarHBondContact O-N 3.3Å; L109-L112 PolarHBondContact O-N 2.92Å; L109-A113 VanDerWaalsContact O-CB 3.24Å; L109-A113 WeakPolarHBondContact O-CB 3.37Å; L109-A113 PolarHBondContact O-N 3.33Å
110L98.7Very high97.3Very high47 Ų4742.7 Ų42.725%0.24624%0.237CC..Hα-helixtrans-63.1-42.4173.7-71.7169.9000111.4P106 S107 L108 A113 S114 L144 F147 L151P106-L110 WeakPolarHBondContact O-CG 3.29Å; P106-L110 PolarHBondContact O-N 3.4Å; S107-L110 WeakPolarHBondContact O-CB 3.31Å; S107-L110 PolarHBondContact O-N 2.86Å; L108-L110 VanDerWaalsContact C-N 3.32Å; L108-L110 PolarHBondContact O-N 3.04Å; L110-A113 PolarHBondContact O-N 2.75Å; L110-S114 WeakPolarHBondContact O-CB 3.23Å; L110-S114 PolarHBondContact O-N 3.47Å; L110-L144 HydrophobicContact CD2-CD2 3.81Å; L110-F147 HydrophobicContact CD1-CB 3.97Å; L110-L151 HydrophobicContact CD1-CD1 3.67Å; L110-L151 HydrophobicContact CD1-CG 4.5Å
111L98.6Very high97.2Very high4 Ų442.7 Ų42.72%0.02124%0.237CC..Hα-helixtrans-62.8-43.6175.4-176.867.3000112F62 V63 F67 S107 L108 S114 A115 T145F62-L111 HydrophobicContact CB-CD1 4.09Å; F62-L111 HydrophobicContact CB-CD2 3.64Å; F62-L111 HydrophobicContact CD2-CD1 3.92Å; F62-L111 HydrophobicContact CG-CD1 4.3Å; V63-L111 HydrophobicContact CG2-CD2 3.8Å; F67-L111 HydrophobicContact CD2-CD2 3.96Å; F67-L111 HydrophobicContact CE2-CB 4.49Å; F67-L111 HydrophobicContact CE2-CD2 3.61Å; S107-L111 PolarHBondContact O-N 3.3Å; L108-L111 HydrophobicContact CD1-CD2 4.38Å; L108-L111 PolarHBondContact O-N 3.33Å; L111-S114 WeakPolarHBondContact O-CB 3.39Å; L111-S114 PolarHBondContact O-N 2.85Å; L111-S114 PolarHBondContact O-OG 3.42Å; L111-A115 PolarHBondContact O-N 3.5Å; L111-T145 HydrophobicContact CD1-CG2 4.19Å
112L97.9Very high97.1Very high42 Ų4242.6 Ų42.622%0.2224%0.239CC..Hα-helixtrans-67.7-40.9178.6-72.1179.4000111.7W24 L28 L108 L109 S114 A115 M116W24-L112 HydrophobicContact CH2-CD1 4.37Å; L28-L112 HydrophobicContact CD2-CD1 4.18Å; L28-L112 HydrophobicContact CD2-CD2 3.86Å; L28-L112 HydrophobicContact CD2-CG 4.47Å; L108-L112 HydrophobicContact CD1-CD1 4.49Å; L108-L112 HydrophobicContact CD1-CG 4.28Å; L108-L112 HydrophobicContact CG-CD1 4.29Å; L108-L112 HydrophobicContact CG-CG 4.5Å; L108-L112 WeakPolarHBondContact O-CG 3.4Å; L108-L112 PolarHBondContact O-N 3.14Å; L109-L112 PolarHBondContact O-N 2.92Å; L112-S114 PolarHBondContact O-N 3.39Å; L112-A115 PolarHBondContact O-N 3.04Å; L112-M116 WeakPolarHBondContact O-CE 3.38Å; L112-M116 WeakPolarHBondContact O-CG 3.28Å; L112-M116 PolarHBondContact O-N 3.48Å
113A98Very high97.1Very high29 Ų2938.3 Ų38.324%0.2422%0.223CC..Hα-helixtrans-60.8-38.4171.900000110.9L109 L110 A115 M116 V117 L144L109-A113 VanDerWaalsContact O-CB 3.24Å; L109-A113 WeakPolarHBondContact O-CB 3.37Å; L109-A113 PolarHBondContact O-N 3.33Å; L110-A113 PolarHBondContact O-N 2.75Å; A113-A115 PolarHBondContact O-N 2.89Å; A113-M116 PolarHBondContact O-N 2.98Å; A113-V117 WeakPolarHBondContact O-CB 3.39Å; A113-V117 VanDerWaalsContact O-CG2 3.31Å; A113-V117 WeakPolarHBondContact O-CG2 3.35Å; A113-V117 PolarHBondContact O-N 3.45Å; A113-L144 HydrophobicContact CB-CD1 4.25Å
114S97.9Very high97Very high3 Ų337.1 Ų37.12%0.02122%0.218CC..Hα-helixtrans-60.6-33178.198.20000112.9L110 L111 L112 G120 S141 T145L110-S114 WeakPolarHBondContact O-CB 3.23Å; L110-S114 PolarHBondContact O-N 3.47Å; L111-S114 WeakPolarHBondContact O-CB 3.39Å; L111-S114 PolarHBondContact O-N 2.85Å; L111-S114 PolarHBondContact O-OG 3.42Å; L112-S114 PolarHBondContact O-N 3.39Å; S114-G120 VanDerWaalsContact O-CA 3.27Å; S114-G120 WeakPolarHBondContact O-CA 3.33Å; S114-S141 VanDerWaalsContact CB-O 3.3Å; S114-S141 WeakPolarHBondContact CB-O 3.31Å; S114-S141 VanDerWaalsContact O-CB 3.3Å; S114-S141 WeakPolarHBondContact O-CB 3.24Å; S114-T145 VanDerWaalsContact CB-OG1 3.28Å; S114-T145 WeakPolarHBondContact CB-OG1 3.48Å; S114-T145 PolarHBondContact OG-OG1 2.94Å
115A94.3Very high96.9Very high36 Ų3638.4 Ų38.430%0.29822%0.223SC..Hα-helixtrans-76.6-20.6175.300000113.8V55 L111 L112 A113V55-A115 HydrophobicContact CG1-CB 3.83Å; L111-A115 PolarHBondContact O-N 3.5Å; L112-A115 PolarHBondContact O-N 3.04Å; A113-A115 PolarHBondContact O-N 2.89Å
116M93.8Very high96.8Very high148 Ų14836.9 Ų36.973%0.72921%0.212SC*.Hα-helixtrans-101.5-23.4-176.7-65.7-174-69.700113.8L112 A113L112-M116 WeakPolarHBondContact O-CE 3.38Å; L112-M116 WeakPolarHBondContact O-CG 3.28Å; L112-M116 PolarHBondContact O-N 3.48Å; A113-M116 PolarHBondContact O-N 2.98Å
117V95.2Very high96.8Very high51 Ų5134.4 Ų34.431%0.30920%0.196SC..SBendtrans-80.7132180170.30000109.8A113 A119 G120 A140 L144A113-V117 WeakPolarHBondContact O-CB 3.39Å; A113-V117 VanDerWaalsContact O-CG2 3.31Å; A113-V117 WeakPolarHBondContact O-CG2 3.35Å; A113-V117 PolarHBondContact O-N 3.45Å; V117-A119 PolarHBondContact O-N 2.9Å; V117-G120 PolarHBondContact O-N 3.45Å; V117-A140 HydrophobicContact CG1-CB 4.42Å; V117-L144 HydrophobicContact CB-CD1 4.21Å; V117-L144 HydrophobicContact CG2-CD1 4.01Å
118E93.1Very high96.7Very high125 Ų12536.5 Ų36.558%0.58420%0.204SC*.THydrogen-bonded Turntrans53.5-121.9-179.1-60.4164.2-171.700111.8G139 A140E118-G139 VanDerWaalsContact CD-CA 3.45Å; E118-G139 VanDerWaalsContact OE1-CA 3.27Å; E118-G139 WeakPolarHBondContact OE1-CA 3.24Å; E118-G139 WeakPolarHBondContact OE2-CA 3.34Å; E118-G139 PolarHBondContact OE2-N 2.81Å; E118-A140 VanDerWaalsContact CD-N 3.26Å; E118-A140 PolarHBondContact OE1-N 3.37Å; E118-A140 PolarHBondContact OE2-N 3.29Å
119A92.5Very high96.7Very high62 Ų6236.8 Ų36.851%0.51221%0.207SC..THydrogen-bonded Turntrans-92.9-7.9177.500000112.8H51 V55 V117H51-A119 PolarHBondContact CD2-O 2.83Å; H51-A119 WeakPolarHBondContact NE2-CB 3.45Å; H51-A119 PolarHBondContact NE2-O 2.75Å; V55-A119 WeakPolarHBondContact CG2-O 3.44Å; V117-A119 PolarHBondContact O-N 2.9Å
120G96.5Very high96.6Very high0 Ų035.6 Ų35.60%021%0.206CC..  trans81.2166.2-172.100000114.5H51 S114 V117 G122 S141H51-G120 PolarHBondContact NE2-O 3.41Å; S114-G120 VanDerWaalsContact O-CA 3.27Å; S114-G120 WeakPolarHBondContact O-CA 3.33Å; V117-G120 PolarHBondContact O-N 3.45Å; G120-G122 PolarHBondContact O-N 3.24Å; G120-S141 VanDerWaalsContact C-CB 3.42Å; G120-S141 VanDerWaalsContact C-OG 3.28Å; G120-S141 PolarHBondContact O-OG 2.88Å; G120-S141 VanDerWaalsContact O-OG 3.13Å
121A97.3Very high96.5Very high3 Ų337.1 Ų37.13%0.02521%0.214CC..  trans-86.993.6178.700000111.4T58 T123 V142 T145T58-A121 WeakPolarHBondContact CB-O 3.47Å; T58-A121 WeakPolarHBondContact CG2-O 3.28Å; T58-A121 PolarHBondContact OG1-O 2.93Å; A121-T123 VanDerWaalsContact C-N 3.35Å; A121-T123 PolarHBondContact O-N 2.82Å; A121-V142 HydrophobicContact CB-CG2 4.41Å; A121-T145 WeakPolarHBondContact CB-OG1 3.36Å
122G96.9Very high96.5Very high7 Ų737 Ų377%0.07221%0.213CC..  trans-94.128.8-178.800000114.2G120 H137G120-G122 PolarHBondContact O-N 3.24Å; G122-H137 PolarHBondContact N-NE2 2.87Å
123T97Very high96.4Very high5 Ų535.7 Ų35.73%0.03121%0.21CC..SBendtrans-87.2-7.4-168.758.80000114.3A121 A132 V142A121-T123 VanDerWaalsContact C-N 3.35Å; A121-T123 PolarHBondContact O-N 2.82Å; T123-A132 HydrophobicContact CG2-CB 3.81Å; T123-V142 HydrophobicContact CG2-CG2 4.02Å
124G96.7Very high96.2Very high4 Ų437.4 Ų37.44%0.04122%0.215CC..THydrogen-bonded Turntrans74.6161.1-159.100000111.8T58 T126 V127T58-G124 WeakPolarHBondContact OG1-CA 3.22Å; T58-G124 PolarHBondContact OG1-N 2.72Å; G124-T126 PolarHBondContact O-N 3.01Å; G124-T126 VanDerWaalsContact O-N 3.09Å; G124-V127 PolarHBondContact O-N 3.28Å
125W97.1Very high95.9Very high32 Ų3247.6 Ų47.612%0.12126%0.255CS..THydrogen-bonded Turntrans-64.4-15.6-176.782.8-82.1000114.5A61 F62 I65 F234 W235A61-W125 HydrophobicContact CB-CB 3.58Å; A61-W125 HydrophobicContact CB-CG 4.04Å; F62-W125 HydrophobicContact CD1-CB 4.49Å; F62-W125 HydrophobicContact CE1-CB 4.17Å; F62-W125 WeakPolarHBondContact CE1-O 3.27Å; F62-W125 HydrophobicContact CE2-CB 4.49Å; F62-W125 HydrophobicContact CZ-CB 4.18Å; F62-W125 WeakPolarHBondContact CZ-O 3.44Å; I65-W125 HydrophobicContact CD1-CE3 4.2Å; I65-W125 HydrophobicContact CD1-CZ3 4.26Å; W125-F234 HydrophobicContact CD2-CZ 4.34Å; W125-F234 HydrophobicContact CE3-CE1 4.45Å; W125-F234 AromaticContact CE3-CZ 3.75Å; W125-F234 HydrophobicContact CE3-CZ 3.75Å; W125-F234 AromaticContact CH2-CE1 3.93Å; W125-F234 HydrophobicContact CH2-CE1 3.93Å; W125-F234 AromaticContact CH2-CZ 3.97Å; W125-F234 HydrophobicContact CH2-CZ 3.97Å; W125-F234 HydrophobicContact CZ2-CE1 4.33Å; W125-F234 HydrophobicContact CZ3-CE1 4.01Å; W125-F234 AromaticContact CZ3-CZ 3.55Å; W125-F234 HydrophobicContact CZ3-CZ 3.55Å; W125-W235 HydrophobicContact CH2-CH2 4.35Å; W125-W235 HydrophobicContact CH2-CZ3 4.07Å; W125-W235 AromaticContact CZ2-CH2 3.77Å; W125-W235 HydrophobicContact CZ2-CH2 3.77Å; W125-W235 AromaticContact CZ2-CZ3 3.92Å; W125-W235 HydrophobicContact CZ2-CZ3 3.92Å
126T97.1Very high96Very high0 Ų049 Ų490%026%0.262CS..THydrogen-bonded Turntrans-81.3-20.3176.557.40000112.6G124 Y128 Y230 F234 W235G124-T126 PolarHBondContact O-N 3.01Å; G124-T126 VanDerWaalsContact O-N 3.09Å; T126-Y128 VanDerWaalsContact C-N 3.33Å; T126-Y128 VanDerWaalsContact CB-CE1 3.5Å; T126-Y128 HydrophobicContact CG2-CE1 4.27Å; T126-Y128 PolarHBondContact O-N 3.38Å; T126-Y230 WeakPolarHBondContact O-CE1 3.18Å; T126-Y230 PolarHBondContact O-OH 3.4Å; T126-F234 HydrophobicContact CG2-CD1 4.33Å; T126-F234 HydrophobicContact CG2-CE1 3.71Å; T126-F234 HydrophobicContact CG2-CZ 4.09Å; T126-W235 HydrophobicContact CG2-CH2 4.15Å; T126-W235 HydrophobicContact CG2-CZ2 3.96Å
127V97.9Very high96.1Very high2 Ų242.6 Ų42.61%0.01223%0.23CC..THydrogen-bonded Turntrans54.845.7175-159.10000112.5F62 G124 A132 V142 L208 Y230F62-V127 HydrophobicContact CE2-CG2 4.2Å; F62-V127 HydrophobicContact CZ-CG2 3.64Å; G124-V127 PolarHBondContact O-N 3.28Å; V127-A132 HydrophobicContact CG1-CB 3.63Å; V127-A132 WeakPolarHBondContact O-CB 3.44Å; V127-V142 HydrophobicContact CG1-CG1 4.08Å; V127-L208 HydrophobicContact CG1-CD2 3.84Å; V127-Y230 PolarHBondContact O-OH 3.44Å
128Y98.1Very high95.9Very high44 Ų4445.1 Ų45.117%0.17325%0.248CC..  trans-70.8130.5-175.5-70.1-22000113T126 L131 A132 Y230 Q231 F234 W235T126-Y128 VanDerWaalsContact C-N 3.33Å; T126-Y128 VanDerWaalsContact CB-CE1 3.5Å; T126-Y128 HydrophobicContact CG2-CE1 4.27Å; T126-Y128 PolarHBondContact O-N 3.38Å; Y128-L131 WeakPolarHBondContact O-CB 3.37Å; Y128-L131 PolarHBondContact O-N 3.25Å; Y128-A132 WeakPolarHBondContact O-CB 3.35Å; Y128-A132 PolarHBondContact O-N 2.89Å; Y128-Y230 AromaticContact CD1-CD1 3.59Å; Y128-Y230 HydrophobicContact CD1-CD1 3.59Å; Y128-Y230 AromaticContact CD1-CE1 3.61Å; Y128-Y230 HydrophobicContact CD1-CE1 3.61Å; Y128-Y230 HydrophobicContact CE1-CD1 4.11Å; Y128-Y230 HydrophobicContact CE1-CE1 4.12Å; Y128-Q231 HydrophobicContact CD1-CG 4.2Å; Y128-Q231 HydrophobicContact CE1-CB 4.46Å; Y128-Q231 HydrophobicContact CE1-CG 3.82Å; Y128-Q231 HydrophobicContact CE2-CG 4.29Å; Y128-F234 HydrophobicContact CE1-CD1 4.47Å; Y128-W235 AromaticContact CZ-NE1 3.95Å; Y128-W235 WeakPolarHBondContact OH-CZ2 3.44Å; Y128-W235 PolarHBondContact OH-NE1 2.84Å
129P97.1Very high96Very high12 Ų1239.9 Ų39.98%0.07823%0.227CC..THydrogen-bonded Turntrans-67.7153.6157.329.5-31.2000110.2L131 L208 F219 Y230P129-L131 VanDerWaalsContact C-N 3.34Å; P129-L208 HydrophobicContact CB-CD1 4.09Å; P129-L208 HydrophobicContact CG-CD1 4.38Å; P129-F219 HydrophobicContact CB-CB 3.88Å; P129-F219 HydrophobicContact CG-CB 3.56Å; P129-F219 HydrophobicContact CG-CD2 4Å; P129-F219 HydrophobicContact CG-CG 3.81Å; P129-Y230 VanDerWaalsContact CD-CG 3.41Å; P129-Y230 HydrophobicContact CG-CD1 4.44Å; P129-Y230 HydrophobicContact CG-CD2 4.15Å; P129-Y230 HydrophobicContact CG-CG 3.84Å
130P96.8Very high96.2Very high91 Ų9138.7 Ų38.759%0.59122%0.217SC*.THydrogen-bonded Turncis-80.3-7.71.333.4-36.3000113.9A132 G133P130-A132 VanDerWaalsContact C-N 3.28Å; P130-A132 PolarHBondContact O-N 3.39Å; P130-G133 WeakPolarHBondContact O-CA 3.21Å; P130-G133 PolarHBondContact O-N 3.25Å
131L97.5Very high96.3Very high80 Ų8038.8 Ų38.842%0.41922%0.218SC..THydrogen-bonded Turntrans-59.4-38.9-178.9-179.265.5000111.9Y128 P129 G133 S136 H137Y128-L131 WeakPolarHBondContact O-CB 3.37Å; Y128-L131 PolarHBondContact O-N 3.25Å; P129-L131 VanDerWaalsContact C-N 3.34Å; L131-G133 PolarHBondContact O-N 3.43Å; L131-S136 WeakPolarHBondContact O-CB 3.21Å; L131-H137 PolarHBondContact O-ND1 2.91Å
132A97.6Very high96.3Very high0 Ų038.7 Ų38.70%022%0.217CC..THydrogen-bonded Turntrans-79.71.7175.100000114.2T123 V127 Y128 P130 V142 L208 R212T123-A132 HydrophobicContact CG2-CB 3.81Å; V127-A132 HydrophobicContact CG1-CB 3.63Å; V127-A132 WeakPolarHBondContact O-CB 3.44Å; Y128-A132 WeakPolarHBondContact O-CB 3.35Å; Y128-A132 PolarHBondContact O-N 2.89Å; P130-A132 VanDerWaalsContact C-N 3.28Å; P130-A132 PolarHBondContact O-N 3.39Å; A132-V142 HydrophobicContact CB-CG1 4.3Å; A132-L208 HydrophobicContact CB-CD1 4.44Å; A132-L208 HydrophobicContact CB-CD2 3.9Å; A132-R212 WeakPolarHBondContact O-CD 3.1Å; A132-R212 PolarHBondContact O-NH1 3.4Å
133G96.3Very high96.4Very high15 Ų1539.1 Ų39.116%0.15522%0.218CC..SBendtrans-84.9170.6176.100000113.2P130 L131 Y135 S136 H137 R212P130-G133 WeakPolarHBondContact O-CA 3.21Å; P130-G133 PolarHBondContact O-N 3.25Å; L131-G133 PolarHBondContact O-N 3.43Å; G133-Y135 VanDerWaalsContact C-N 3.27Å; G133-Y135 PolarHBondContact O-N 3.49Å; G133-S136 PolarHBondContact O-N 2.97Å; G133-H137 PolarHBondContact O-N 3.36Å; G133-R212 VanDerWaalsContact C-NH1 3.32Å; G133-R212 PolarHBondContact O-NH1 3.18Å
134N93.9Very high96.5Very high65 Ų6540.6 Ų40.635%0.34823%0.225SC..THydrogen-bonded Turntrans-65.5-25-175.8-80.1-9.8000114.7S136 P138 R212N134-S136 PolarHBondContact O-N 3.42Å; N134-P138 VanDerWaalsContact O-CA 3.23Å; N134-P138 WeakPolarHBondContact O-CA 3.29Å; N134-P138 WeakPolarHBondContact O-CB 3.28Å; N134-R212 PolarHBondContact ND2-O 2.91Å; N134-R212 PolarHBondContact OD1-NH1 2.91Å; N134-R212 PolarHBondContact OD1-NH2 3.19Å; N134-R212 VanDerWaalsContact OD1-NH2 3.11Å
135Y92.1Very high96.6Very high218 Ų21840.5 Ų40.586%0.85522%0.224SC*.THydrogen-bonded Turntrans-63.6-31.4175.9-73.2-71.9000112.8G133G133-Y135 VanDerWaalsContact C-N 3.27Å; G133-Y135 PolarHBondContact O-N 3.49Å
136S95Very high96.6Very high65 Ų6539 Ų3946%0.45522%0.219SC..THydrogen-bonded Turntrans-104.9-36.2-178.3-65.70000112.8L131 G133 N134L131-S136 WeakPolarHBondContact O-CB 3.21Å; G133-S136 PolarHBondContact O-N 2.97Å; N134-S136 PolarHBondContact O-N 3.42Å
137H96.8Very high96.7Very high13 Ų1343.8 Ų43.86%0.0624%0.239CC..SBendtrans-128.283.2177.3-73.378.7000109.7H51 G122 L131 G133 G139 V142 R212H51-H137 AromaticContact CE1-NE2 3.48Å; H51-H137 PolarHBondContact CE1-NE2 2.98Å; G122-H137 PolarHBondContact N-NE2 2.87Å; L131-H137 PolarHBondContact O-ND1 2.91Å; G133-H137 PolarHBondContact O-N 3.36Å; H137-G139 VanDerWaalsContact C-N 3.34Å; H137-G139 PolarHBondContact O-N 3.2Å; H137-V142 HydrophobicContact CB-CG2 3.7Å; H137-R212 PolarHBondContact O-NH1 3.18Å; H137-R212 PolarHBondContact O-NH2 3.41Å
138P91.3Very high96.8Very high105 Ų10543.7 Ų43.768%0.68224%0.239SC*.  trans-74.7-8-166.126.3-35.1000116.8N134N134-P138 VanDerWaalsContact O-CA 3.23Å; N134-P138 WeakPolarHBondContact O-CA 3.29Å; N134-P138 WeakPolarHBondContact O-CB 3.28Å
139G93.9Very high96.8Very high14 Ų1441.9 Ų41.914%0.14423%0.232CC..SBendtrans-132.2-162.2-178.800000115.1E118 H137 S141 R212E118-G139 VanDerWaalsContact CD-CA 3.45Å; E118-G139 VanDerWaalsContact OE1-CA 3.27Å; E118-G139 WeakPolarHBondContact OE1-CA 3.24Å; E118-G139 WeakPolarHBondContact OE2-CA 3.34Å; E118-G139 PolarHBondContact OE2-N 2.81Å; H137-G139 VanDerWaalsContact C-N 3.34Å; H137-G139 PolarHBondContact O-N 3.2Å; G139-S141 PolarHBondContact O-N 3.42Å; G139-S141 VanDerWaalsContact O-N 3.08Å; G139-R212 PolarHBondContact O-NH2 2.9Å
140A97.1Very high96.9Very high37 Ų3743.4 Ų43.431%0.30624%0.238SC..THydrogen-bonded Turntrans-74.7-5.9-151.700000115.1V117 E118 V142 D143 L144V117-A140 HydrophobicContact CG1-CB 4.42Å; E118-A140 VanDerWaalsContact CD-N 3.26Å; E118-A140 PolarHBondContact OE1-N 3.37Å; E118-A140 PolarHBondContact OE2-N 3.29Å; A140-V142 PolarHBondContact O-N 3.05Å; A140-D143 PolarHBondContact O-N 3.18Å; A140-L144 WeakPolarHBondContact O-CG 3.24Å; A140-L144 PolarHBondContact O-N 2.96Å
141S97.9Very high97Very high3 Ų341.6 Ų41.62%0.02122%0.223CC..Hα-helixtrans-61-41.6-176.465.30000112.8S114 G120 G139 T145S114-S141 VanDerWaalsContact CB-O 3.3Å; S114-S141 WeakPolarHBondContact CB-O 3.31Å; S114-S141 VanDerWaalsContact O-CB 3.3Å; S114-S141 WeakPolarHBondContact O-CB 3.24Å; G120-S141 VanDerWaalsContact C-CB 3.42Å; G120-S141 VanDerWaalsContact C-OG 3.28Å; G120-S141 PolarHBondContact O-OG 2.88Å; G120-S141 VanDerWaalsContact O-OG 3.13Å; G139-S141 PolarHBondContact O-N 3.42Å; G139-S141 VanDerWaalsContact O-N 3.08Å; S141-T145 PolarHBondContact O-N 3.44Å; S141-T145 PolarHBondContact O-OG1 3.35Å
142V98.6Very high97Very high0 Ų037.9 Ų37.90%020%0.204CC..Hα-helixtrans-70.9-36.9176.7178.30000110.6A121 T123 V127 A132 H137 A140 T145 I146A121-V142 HydrophobicContact CB-CG2 4.41Å; T123-V142 HydrophobicContact CG2-CG2 4.02Å; V127-V142 HydrophobicContact CG1-CG1 4.08Å; A132-V142 HydrophobicContact CB-CG1 4.3Å; H137-V142 HydrophobicContact CB-CG2 3.7Å; A140-V142 PolarHBondContact O-N 3.05Å; V142-T145 WeakPolarHBondContact O-CB 3.43Å; V142-T145 PolarHBondContact O-N 3.47Å; V142-I146 HydrophobicContact CG1-CD1 4.05Å; V142-I146 HydrophobicContact CG1-CG1 4.48Å; V142-I146 WeakPolarHBondContact O-CG1 3.22Å; V142-I146 PolarHBondContact O-N 3.4Å
143D98.5Very high97Very high17 Ų1738.4 Ų38.49%0.09121%0.21CC..Hα-helixtrans-65.6-43.8179.9-53.1-39.8000111.5A140 T145 I146 F147 L209 R212 N213A140-D143 PolarHBondContact O-N 3.18Å; D143-T145 VanDerWaalsContact C-N 3.28Å; D143-T145 PolarHBondContact O-N 2.66Å; D143-I146 WeakPolarHBondContact O-CB 3.23Å; D143-I146 PolarHBondContact O-N 3.33Å; D143-I146 VanDerWaalsContact O-N 3.16Å; D143-F147 HydrophobicContact CB-CE2 4.42Å; D143-F147 WeakPolarHBondContact O-CD2 3.31Å; D143-F147 PolarHBondContact O-N 3.07Å; D143-L209 HydrophobicContact CB-CD1 3.9Å; D143-L209 WeakPolarHBondContact OD1-CD1 3.33Å; D143-R212 IonicContact OD1-CZ 3.35Å; D143-R212 IonicContact OD1-NE 3.34Å; D143-R212 PolarHBondContact OD1-NE 3.08Å; D143-R212 IonicContact OD1-NH2 2.98Å; D143-R212 IonicContact OD2-NH2 2.82Å; D143-N213 PolarHBondContact OD1-ND2 3.04Å
144L98.6Very high97.2Very high35 Ų3540.9 Ų40.918%0.18322%0.222CC..Hα-helixtrans-61.4-37.6173.6-69.5175.6000112L110 A113 V117 A140 F147 S148L110-L144 HydrophobicContact CD2-CD2 3.81Å; A113-L144 HydrophobicContact CB-CD1 4.25Å; V117-L144 HydrophobicContact CB-CD1 4.21Å; V117-L144 HydrophobicContact CG2-CD1 4.01Å; A140-L144 WeakPolarHBondContact O-CG 3.24Å; A140-L144 PolarHBondContact O-N 2.96Å; L144-F147 PolarHBondContact O-N 3.24Å; L144-S148 WeakPolarHBondContact O-CB 3.38Å; L144-S148 PolarHBondContact O-N 3.24Å
145T98.6Very high97.4Very high2 Ų238 Ų381%0.01221%0.206CC..Hα-helixtrans-63.4-44173.9-560000110.8F62 L111 S114 A121 S141 V142 D143 S148 L149F62-T145 HydrophobicContact CD2-CG2 4.19Å; F62-T145 HydrophobicContact CE2-CG2 3.62Å; F62-T145 HydrophobicContact CZ-CG2 4.18Å; L111-T145 HydrophobicContact CD1-CG2 4.19Å; S114-T145 VanDerWaalsContact CB-OG1 3.28Å; S114-T145 WeakPolarHBondContact CB-OG1 3.48Å; S114-T145 PolarHBondContact OG-OG1 2.94Å; A121-T145 WeakPolarHBondContact CB-OG1 3.36Å; S141-T145 PolarHBondContact O-N 3.44Å; S141-T145 PolarHBondContact O-OG1 3.35Å; V142-T145 WeakPolarHBondContact O-CB 3.43Å; V142-T145 PolarHBondContact O-N 3.47Å; D143-T145 VanDerWaalsContact C-N 3.28Å; D143-T145 PolarHBondContact O-N 2.66Å; T145-S148 WeakPolarHBondContact O-CB 3.48Å; T145-S148 PolarHBondContact O-N 2.72Å; T145-L149 WeakPolarHBondContact O-CG 3.44Å; T145-L149 PolarHBondContact O-N 3.13Å
146I98.8Very high97.7Very high1 Ų128.6 Ų28.61%0.00517%0.172CC..Hα-helixtrans-62.5-44.9175.8-68.9167.9000111V142 D143 S148 L149 H150 I205 L208 L209V142-I146 HydrophobicContact CG1-CD1 4.05Å; V142-I146 HydrophobicContact CG1-CG1 4.48Å; V142-I146 WeakPolarHBondContact O-CG1 3.22Å; V142-I146 PolarHBondContact O-N 3.4Å; D143-I146 WeakPolarHBondContact O-CB 3.23Å; D143-I146 PolarHBondContact O-N 3.33Å; D143-I146 VanDerWaalsContact O-N 3.16Å; I146-S148 VanDerWaalsContact C-N 3.35Å; I146-S148 PolarHBondContact O-N 2.78Å; I146-L149 PolarHBondContact O-N 2.79Å; I146-H150 WeakPolarHBondContact CG2-CE1 2.86Å; I146-H150 WeakPolarHBondContact CG2-ND1 3.35Å; I146-H150 PolarHBondContact O-N 3.36Å; I146-H150 PolarHBondContact O-ND1 3.39Å; I146-I205 HydrophobicContact CG1-CB 4.35Å; I146-I205 HydrophobicContact CG2-CB 4.07Å; I146-I205 HydrophobicContact CG2-CD1 4.22Å; I146-I205 HydrophobicContact CG2-CG1 4.14Å; I146-L208 HydrophobicContact CD1-CD2 4.17Å; I146-L208 HydrophobicContact CD1-CG 4.22Å; I146-L209 HydrophobicContact CB-CD1 4.48Å; I146-L209 HydrophobicContact CD1-CB 4.15Å; I146-L209 HydrophobicContact CD1-CD1 4.11Å; I146-L209 HydrophobicContact CG2-CB 4.22Å; I146-L209 HydrophobicContact CG2-CD1 4.33Å; I146-L209 HydrophobicContact CG2-CD2 4.33Å
147F98.8Very high97.9Very high100 Ų10027.5 Ų27.544%0.43916%0.161SC..Hα-helixtrans-64.5-38.5177-71.3-54.6000112.7L110 D143 L144 H150 L151 L209L110-F147 HydrophobicContact CD1-CB 3.97Å; D143-F147 HydrophobicContact CB-CE2 4.42Å; D143-F147 WeakPolarHBondContact O-CD2 3.31Å; D143-F147 PolarHBondContact O-N 3.07Å; L144-F147 PolarHBondContact O-N 3.24Å; F147-H150 PolarHBondContact O-N 2.92Å; F147-L151 PolarHBondContact O-N 3.13Å; F147-L151 VanDerWaalsContact O-N 3.07Å; F147-L209 HydrophobicContact CE1-CD2 3.91Å; F147-L209 HydrophobicContact CZ-CD2 3.93Å
148S98.8Very high97.9Very high0 Ų028.4 Ų28.40%017%0.166CC..Hα-helixtrans-54.7-52.9171.2163.40000110.9S107 L144 T145 I146 H150 L151 A152S107-S148 WeakPolarHBondContact O-CB 3.31Å; S107-S148 PolarHBondContact O-OG 3.07Å; S107-S148 VanDerWaalsContact O-OG 3.07Å; S107-S148 PolarHBondContact OG-O 3.27Å; S107-S148 PolarHBondContact OG-OG 3.04Å; L144-S148 WeakPolarHBondContact O-CB 3.38Å; L144-S148 PolarHBondContact O-N 3.24Å; T145-S148 WeakPolarHBondContact O-CB 3.48Å; T145-S148 PolarHBondContact O-N 2.72Å; I146-S148 VanDerWaalsContact C-N 3.35Å; I146-S148 PolarHBondContact O-N 2.78Å; S148-H150 VanDerWaalsContact C-N 3.33Å; S148-H150 PolarHBondContact O-N 3.4Å; S148-L151 PolarHBondContact O-N 2.95Å; S148-A152 PolarHBondContact O-N 3.23Å
149L98.6Very high98.3Very high6 Ų623.6 Ų23.63%0.03114%0.136CC..Hα-helixtrans-64.1-35.2-178.9-66.7177.2000112.8F62 F66 T145 I146 G153 I205F62-L149 HydrophobicContact CD1-CD2 3.79Å; F62-L149 HydrophobicContact CE1-CD1 3.76Å; F62-L149 HydrophobicContact CE1-CD2 3.78Å; F62-L149 HydrophobicContact CE1-CG 4.3Å; F62-L149 HydrophobicContact CZ-CD1 3.88Å; F66-L149 HydrophobicContact CD1-CD2 4.36Å; F66-L149 HydrophobicContact CD2-CD2 4.1Å; F66-L149 HydrophobicContact CE1-CD2 4.38Å; F66-L149 HydrophobicContact CE2-CD2 4.09Å; F66-L149 HydrophobicContact CG-CD2 4.26Å; F66-L149 HydrophobicContact CZ-CD2 4.25Å; T145-L149 WeakPolarHBondContact O-CG 3.44Å; T145-L149 PolarHBondContact O-N 3.13Å; I146-L149 PolarHBondContact O-N 2.79Å; L149-G153 PolarHBondContact O-N 3.12Å; L149-I205 HydrophobicContact CB-CD1 3.82Å
150H98.8Very high98.5Very high45 Ų4523 Ų2321%0.20813%0.13CC..Hα-helixtrans-60.8-49.1172.3-79.5102.3000112.2I146 F147 S148 A152 G153 V154 I205 T206I146-H150 WeakPolarHBondContact CG2-CE1 2.86Å; I146-H150 WeakPolarHBondContact CG2-ND1 3.35Å; I146-H150 PolarHBondContact O-N 3.36Å; I146-H150 PolarHBondContact O-ND1 3.39Å; F147-H150 PolarHBondContact O-N 2.92Å; S148-H150 VanDerWaalsContact C-N 3.33Å; S148-H150 PolarHBondContact O-N 3.4Å; H150-A152 PolarHBondContact O-N 2.85Å; H150-G153 PolarHBondContact O-N 3.43Å; H150-V154 WeakPolarHBondContact O-CG2 3.28Å; H150-V154 PolarHBondContact O-N 3.49Å; H150-I205 VanDerWaalsContact CE1-CG1 3.47Å; H150-I205 WeakPolarHBondContact CE1-CG1 3.38Å; H150-T206 PolarHBondContact NE2-OG1 2.81Å
151L98.7Very high98.6Very high53 Ų5324 Ų2428%0.27713%0.129SC..Hα-helixtrans-64.2-41.8179.9-70.2-173.8000112L103 P106 L110 F147 S148 G153 V154 S155L103-L151 HydrophobicContact CD2-CD2 4.25Å; P106-L151 HydrophobicContact CB-CD1 4.39Å; P106-L151 HydrophobicContact CG-CD1 4.47Å; L110-L151 HydrophobicContact CD1-CD1 3.67Å; L110-L151 HydrophobicContact CD1-CG 4.5Å; F147-L151 PolarHBondContact O-N 3.13Å; F147-L151 VanDerWaalsContact O-N 3.07Å; S148-L151 PolarHBondContact O-N 2.95Å; L151-G153 VanDerWaalsContact C-N 3.33Å; L151-G153 PolarHBondContact O-N 3.46Å; L151-V154 PolarHBondContact O-N 3.02Å; L151-S155 PolarHBondContact O-N 2.63Å
152A98.6Very high98.6Very high2 Ų223.8 Ų23.82%0.01713%0.128CC..Hα-helixtrans-62.1-41.2173.700000111.6F67 L104 S107 S148 H150 S155 S156F67-A152 HydrophobicContact CZ-CB 4.41Å; L104-A152 HydrophobicContact CD2-CB 4.34Å; S107-A152 PolarHBondContact OG-N 3.13Å; S148-A152 PolarHBondContact O-N 3.23Å; H150-A152 PolarHBondContact O-N 2.85Å; A152-S155 WeakPolarHBondContact O-CB 3.32Å; A152-S155 PolarHBondContact O-N 3.48Å; A152-S156 PolarHBondContact O-N 2.9Å; A152-S156 PolarHBondContact O-OG 3.27Å
153G98.4Very high98.6Very high11 Ų1123.9 Ų23.911%0.11313%0.128CC..Hα-helixtrans-62.3-45.2175.700000112.8L149 H150 L151 S155 S156 I157L149-G153 PolarHBondContact O-N 3.12Å; H150-G153 PolarHBondContact O-N 3.43Å; L151-G153 VanDerWaalsContact C-N 3.33Å; L151-G153 PolarHBondContact O-N 3.46Å; G153-S155 PolarHBondContact O-N 3.46Å; G153-S156 PolarHBondContact O-N 2.97Å; G153-I157 WeakPolarHBondContact O-CG1 3.49Å; G153-I157 PolarHBondContact O-N 3.16Å
154V98.7Very high98.7Very high67 Ų6724.5 Ų24.541%0.40613%0.131SC..Hα-helixtrans-62-44.1175.5175.50000110.7L103 H150 L151 S156 I157 L158L103-V154 HydrophobicContact CD1-CB 4.22Å; L103-V154 HydrophobicContact CD1-CG1 3.68Å; H150-V154 WeakPolarHBondContact O-CG2 3.28Å; H150-V154 PolarHBondContact O-N 3.49Å; L151-V154 PolarHBondContact O-N 3.02Å; V154-S156 VanDerWaalsContact C-N 3.33Å; V154-S156 PolarHBondContact O-N 2.98Å; V154-I157 PolarHBondContact O-N 3.22Å; V154-L158 HydrophobicContact CG1-CD1 4.05Å; V154-L158 HydrophobicContact CG1-CG 4.32Å; V154-L158 VanDerWaalsContact O-CG 3.31Å; V154-L158 WeakPolarHBondContact O-CG 3.22Å; V154-L158 PolarHBondContact O-N 2.87Å
155S98.7Very high98.7Very high3 Ų324.4 Ų24.42%0.02113%0.132CC..Hα-helixtrans-50.7-54172.5158.30000111S100 L151 A152 G153 I157 L158 G159S100-S155 VanDerWaalsContact O-CB 3.23Å; S100-S155 WeakPolarHBondContact O-CB 3.49Å; S100-S155 PolarHBondContact O-OG 3.47Å; S100-S155 PolarHBondContact OG-O 2.7Å; S100-S155 PolarHBondContact OG-OG 3.32Å; L151-S155 PolarHBondContact O-N 2.63Å; A152-S155 WeakPolarHBondContact O-CB 3.32Å; A152-S155 PolarHBondContact O-N 3.48Å; G153-S155 PolarHBondContact O-N 3.46Å; S155-I157 PolarHBondContact O-N 2.91Å; S155-L158 PolarHBondContact O-N 3.42Å; S155-G159 PolarHBondContact O-N 2.96Å
156S98.3Very high98.6Very high21 Ų2124.3 Ų24.315%0.14713%0.131CC..Hα-helixtrans-67.5-36.1-176-65.40000113.7A152 G153 V154 G159 A160A152-S156 PolarHBondContact O-N 2.9Å; A152-S156 PolarHBondContact O-OG 3.27Å; G153-S156 PolarHBondContact O-N 2.97Å; V154-S156 VanDerWaalsContact C-N 3.33Å; V154-S156 PolarHBondContact O-N 2.98Å; S156-G159 PolarHBondContact O-N 3.1Å; S156-A160 VanDerWaalsContact O-CB 3.31Å; S156-A160 WeakPolarHBondContact O-CB 3.41Å; S156-A160 PolarHBondContact O-N 3.5Å
157I98.6Very high98.6Very high42 Ų4224.2 Ų24.222%0.21513%0.131CC..Hα-helixtrans-64.8-45.9175.2-69.5168.7000110.9G153 V154 S155 G159 A160 I161 L195 L198G153-I157 WeakPolarHBondContact O-CG1 3.49Å; G153-I157 PolarHBondContact O-N 3.16Å; V154-I157 PolarHBondContact O-N 3.22Å; S155-I157 PolarHBondContact O-N 2.91Å; I157-G159 VanDerWaalsContact C-N 3.33Å; I157-G159 PolarHBondContact O-N 3.32Å; I157-A160 PolarHBondContact O-N 3.49Å; I157-I161 HydrophobicContact CG2-CD1 3.95Å; I157-I161 WeakPolarHBondContact O-CG1 3.28Å; I157-I161 PolarHBondContact O-N 3.18Å; I157-L195 HydrophobicContact CG2-CD1 4.2Å; I157-L198 HydrophobicContact CD1-CB 3.98Å; I157-L198 HydrophobicContact CG1-CB 3.99Å; I157-L198 HydrophobicContact CG1-CD1 3.81Å
158L98.6Very high98.5Very high32 Ų3223.7 Ų23.717%0.16813%0.132CC..Hα-helixtrans-61.3-43177.2-68.4178.7000111.3M96 M99 L103 V154 S155 N162M96-L158 HydrophobicContact CE-CD2 4.45Å; M96-L158 HydrophobicContact CG-CB 3.86Å; M96-L158 HydrophobicContact CG-CD2 3.96Å; M96-L158 HydrophobicContact CG-CG 4.34Å; M96-L158 HydrophobicContact SD-CB 4.3Å; M96-L158 HydrophobicContact SD-CD2 4.04Å; M99-L158 HydrophobicContact CE-CD1 4.32Å; M99-L158 HydrophobicContact CG-CD1 4.17Å; M99-L158 HydrophobicContact SD-CD1 4.12Å; L103-L158 HydrophobicContact CD1-CD1 4.11Å; V154-L158 HydrophobicContact CG1-CD1 4.05Å; V154-L158 HydrophobicContact CG1-CG 4.32Å; V154-L158 VanDerWaalsContact O-CG 3.31Å; V154-L158 WeakPolarHBondContact O-CG 3.22Å; V154-L158 PolarHBondContact O-N 2.87Å; S155-L158 PolarHBondContact O-N 3.42Å; L158-N162 WeakPolarHBondContact O-CB 3.4Å; L158-N162 PolarHBondContact O-N 2.93Å; L158-N162 VanDerWaalsContact O-N 3.16Å
159G98.5Very high98.4Very high5 Ų529.3 Ų29.35%0.05216%0.162CC..Hα-helixtrans-60.4-45.8173.900000112.2S155 S156 I157 I161 N162 F163S155-G159 PolarHBondContact O-N 2.96Å; S156-G159 PolarHBondContact O-N 3.1Å; I157-G159 VanDerWaalsContact C-N 3.33Å; I157-G159 PolarHBondContact O-N 3.32Å; G159-I161 PolarHBondContact O-N 3.01Å; G159-N162 WeakPolarHBondContact O-CB 3.48Å; G159-N162 PolarHBondContact O-N 3.42Å; G159-F163 WeakPolarHBondContact O-CD2 3.21Å; G159-F163 PolarHBondContact O-N 3.49Å
160A98.7Very high98.2Very high1 Ų131.6 Ų31.61%0.00817%0.173CC..Hα-helixtrans-60.3-46.8179.200000112.8S156 I157 N162 F163 I164 A191 L194S156-A160 VanDerWaalsContact O-CB 3.31Å; S156-A160 WeakPolarHBondContact O-CB 3.41Å; S156-A160 PolarHBondContact O-N 3.5Å; I157-A160 PolarHBondContact O-N 3.49Å; A160-N162 VanDerWaalsContact C-N 3.27Å; A160-N162 PolarHBondContact O-N 3.47Å; A160-F163 PolarHBondContact O-N 3.47Å; A160-I164 VanDerWaalsContact O-CG1 3.28Å; A160-I164 WeakPolarHBondContact O-CG1 3.44Å; A160-I164 PolarHBondContact O-N 2.82Å; A160-A191 HydrophobicContact CB-CB 4.04Å; A160-A191 WeakPolarHBondContact CB-O 3.13Å; A160-L194 HydrophobicContact CB-CB 4Å
161I98.8Very high97.9Very high57 Ų5731.1 Ų31.129%0.29217%0.17SC..Hα-helixtrans-58.4-43.4176.2-67.5166.6000110.4F93 M96 I157 G159 T165 L195F93-I161 HydrophobicContact CE2-CG2 4.16Å; M96-I161 HydrophobicContact SD-CB 4.48Å; M96-I161 HydrophobicContact SD-CG2 4.35Å; I157-I161 HydrophobicContact CG2-CD1 3.95Å; I157-I161 WeakPolarHBondContact O-CG1 3.28Å; I157-I161 PolarHBondContact O-N 3.18Å; G159-I161 PolarHBondContact O-N 3.01Å; I161-T165 WeakPolarHBondContact O-CB 3.47Å; I161-T165 PolarHBondContact O-N 3.34Å; I161-T165 PolarHBondContact O-OG1 2.98Å; I161-L195 HydrophobicContact CD1-CD1 4.4Å; I161-L195 HydrophobicContact CG1-CD1 4.02Å
162N98.8Very high97.4Very high0 Ų029 Ų290%016%0.16CC..Hα-helixtrans-65.8-44.8178.7-16922.3000112.4M91 A92 F93 N97 L158 G159 A160 T165 T166M91-N162 HydrophobicContact CE-CB 4.3Å; M91-N162 WeakPolarHBondContact CE-ND2 3.44Å; A92-N162 PolarHBondContact N-OD1 3.48Å; F93-N162 HydrophobicContact CD2-CB 4.34Å; F93-N162 PolarHBondContact N-OD1 2.92Å; F93-N162 PolarHBondContact O-ND2 3.38Å; N97-N162 WeakPolarHBondContact CB-ND2 3.36Å; L158-N162 WeakPolarHBondContact O-CB 3.4Å; L158-N162 PolarHBondContact O-N 2.93Å; L158-N162 VanDerWaalsContact O-N 3.16Å; G159-N162 WeakPolarHBondContact O-CB 3.48Å; G159-N162 PolarHBondContact O-N 3.42Å; A160-N162 VanDerWaalsContact C-N 3.27Å; A160-N162 PolarHBondContact O-N 3.47Å; N162-T165 PolarHBondContact O-N 3.36Å; N162-T166 VanDerWaalsContact O-CB 3.28Å; N162-T166 WeakPolarHBondContact O-CB 3.38Å; N162-T166 PolarHBondContact O-N 3.03Å; N162-T166 PolarHBondContact O-OG1 3.32Å; N162-T166 PolarHBondContact OD1-OG1 3.45Å
163F98.8Very high96.7Very high2 Ų235.3 Ų35.31%0.00920%0.201CC..Hα-helixtrans-61.7-48.1176-79.7-60.5000112.5I74 G78 V82 M91 G159 A160 T165 T166 I167 V187 A191I74-F163 HydrophobicContact CG2-CD2 4.11Å; I74-F163 HydrophobicContact CG2-CE2 3.6Å; I74-F163 HydrophobicContact CG2-CZ 4.46Å; I74-F163 VanDerWaalsContact O-CZ 3.29Å; I74-F163 WeakPolarHBondContact O-CZ 3.34Å; G78-F163 VanDerWaalsContact C-CE1 3.46Å; V82-F163 HydrophobicContact CB-CD1 4.38Å; V82-F163 HydrophobicContact CB-CE1 4.25Å; V82-F163 HydrophobicContact CG1-CD1 4.37Å; V82-F163 HydrophobicContact CG2-CD1 4.22Å; V82-F163 HydrophobicContact CG2-CE1 4.13Å; M91-F163 HydrophobicContact CE-CD1 3.46Å; M91-F163 VanDerWaalsContact CE-CD1 3.46Å; M91-F163 HydrophobicContact CE-CE1 3.54Å; M91-F163 HydrophobicContact CE-CG 4.03Å; M91-F163 HydrophobicContact CE-CZ 4.2Å; M91-F163 HydrophobicContact SD-CD1 4.37Å; M91-F163 HydrophobicContact SD-CE1 4.17Å; G159-F163 WeakPolarHBondContact O-CD2 3.21Å; G159-F163 PolarHBondContact O-N 3.49Å; A160-F163 PolarHBondContact O-N 3.47Å; F163-T165 VanDerWaalsContact C-N 3.33Å; F163-T165 PolarHBondContact O-N 3.44Å; F163-T166 PolarHBondContact O-N 3.27Å; F163-I167 WeakPolarHBondContact O-CB 3.48Å; F163-I167 VanDerWaalsContact O-CG1 3.24Å; F163-I167 WeakPolarHBondContact O-CG1 3.31Å; F163-I167 PolarHBondContact O-N 2.95Å; F163-V187 HydrophobicContact CB-CG1 4.3Å; F163-V187 HydrophobicContact CD1-CG1 3.77Å; F163-V187 HydrophobicContact CD2-CG1 4.31Å; F163-V187 HydrophobicContact CE1-CG1 4.2Å; F163-V187 HydrophobicContact CG-CG1 3.87Å; F163-A191 HydrophobicContact CB-CB 4.04Å
164I98.8Very high96.1Very high30 Ų3037.4 Ų37.415%0.15422%0.217CC..Hα-helixtrans-57.1-49.9178.6-68.8164.4000109.9A160 T166 I167 I168 L188 A191 I192 L195A160-I164 VanDerWaalsContact O-CG1 3.28Å; A160-I164 WeakPolarHBondContact O-CG1 3.44Å; A160-I164 PolarHBondContact O-N 2.82Å; I164-T166 PolarHBondContact O-N 3.26Å; I164-I167 PolarHBondContact O-N 3.39Å; I164-I168 HydrophobicContact CG2-CD1 3.71Å; I164-I168 WeakPolarHBondContact O-CB 3.11Å; I164-I168 VanDerWaalsContact O-CG1 3.29Å; I164-I168 WeakPolarHBondContact O-CG1 3.45Å; I164-I168 PolarHBondContact O-N 3.25Å; I164-L188 HydrophobicContact CG1-CD1 4.22Å; I164-A191 HydrophobicContact CD1-CB 4.17Å; I164-A191 HydrophobicContact CG1-CB 3.75Å; I164-I192 HydrophobicContact CD1-CG1 4.09Å; I164-I192 HydrophobicContact CG1-CG1 4.31Å; I164-L195 HydrophobicContact CD1-CD2 3.97Å
165T98.6Very high95.6Very high32 Ų3234.7 Ų34.720%0.19620%0.2CC..Hα-helixtrans-63.4-44-178.3-51.80000111.5A92 F93 I161 N162 F163 N169A92-T165 HydrophobicContact CB-CG2 3.76Å; F93-T165 HydrophobicContact CE2-CG2 3.78Å; F93-T165 WeakPolarHBondContact CE2-OG1 3.42Å; F93-T165 HydrophobicContact CZ-CG2 3.78Å; I161-T165 WeakPolarHBondContact O-CB 3.47Å; I161-T165 PolarHBondContact O-N 3.34Å; I161-T165 PolarHBondContact O-OG1 2.98Å; N162-T165 PolarHBondContact O-N 3.36Å; F163-T165 VanDerWaalsContact C-N 3.33Å; F163-T165 PolarHBondContact O-N 3.44Å; T165-N169 VanDerWaalsContact O-CB 3.28Å; T165-N169 WeakPolarHBondContact O-CB 3.32Å; T165-N169 PolarHBondContact O-N 3.06Å
166T98.4Very high95.3Very high0 Ų038 Ų380%022%0.22CC..Hα-helixtrans-62.8-50.9179.3-57.10000111.1I86 M91 A92 N162 F163 I164 I168 M170I86-T166 HydrophobicContact CD1-CG2 4Å; M91-T166 HydrophobicContact SD-CG2 3.88Å; A92-T166 WeakPolarHBondContact CB-OG1 3.38Å; A92-T166 PolarHBondContact N-OG1 2.86Å; N162-T166 VanDerWaalsContact O-CB 3.28Å; N162-T166 WeakPolarHBondContact O-CB 3.38Å; N162-T166 PolarHBondContact O-N 3.03Å; N162-T166 PolarHBondContact O-OG1 3.32Å; N162-T166 PolarHBondContact OD1-OG1 3.45Å; F163-T166 PolarHBondContact O-N 3.27Å; I164-T166 PolarHBondContact O-N 3.26Å; T166-I168 PolarHBondContact O-N 3.14Å; T166-M170 HydrophobicContact CG2-CB 4.39Å; T166-M170 HydrophobicContact CG2-SD 3.99Å; T166-M170 VanDerWaalsContact O-CB 3.32Å; T166-M170 WeakPolarHBondContact O-CB 3.48Å; T166-M170 PolarHBondContact O-N 3.35Å
167I98.1Very high94.9Very high0 Ų039.3 Ų39.30%022%0.224CC..Hα-helixtrans-66.2-37.7-176.2-66.1169.7000111.4V82 F163 I164 K171 V184 V187 L188V82-I167 HydrophobicContact CG1-CD1 3.99Å; V82-I167 HydrophobicContact CG1-CG1 3.53Å; F163-I167 WeakPolarHBondContact O-CB 3.48Å; F163-I167 VanDerWaalsContact O-CG1 3.24Å; F163-I167 WeakPolarHBondContact O-CG1 3.31Å; F163-I167 PolarHBondContact O-N 2.95Å; I164-I167 PolarHBondContact O-N 3.39Å; I167-K171 WeakPolarHBondContact O-CD 3.3Å; I167-K171 VanDerWaalsContact O-CG 3.29Å; I167-K171 WeakPolarHBondContact O-CG 3.31Å; I167-K171 PolarHBondContact O-NZ 3.35Å; I167-V184 HydrophobicContact CB-CG1 4.4Å; I167-V184 HydrophobicContact CD1-CG1 3.91Å; I167-V184 HydrophobicContact CG1-CG1 3.84Å; I167-V184 HydrophobicContact CG2-CG1 3.7Å; I167-V187 HydrophobicContact CD1-CB 4.47Å; I167-V187 HydrophobicContact CD1-CG1 4.27Å; I167-L188 HydrophobicContact CB-CD1 4.38Å; I167-L188 HydrophobicContact CD1-CB 3.9Å; I167-L188 HydrophobicContact CD1-CD1 4.49Å; I167-L188 HydrophobicContact CG2-CB 4.28Å; I167-L188 HydrophobicContact CG2-CD1 4.27Å; I167-L188 HydrophobicContact CG2-CD2 4.07Å; I167-L188 HydrophobicContact CG2-CG 4.44Å
168I96.3Very high94.5Very high89 Ų8943.1 Ų43.146%0.45624%0.236SC..Hα-helixtrans-76.9-45.2-178.4-64.4175.9000110.8I164 T166 K171 L188I164-I168 HydrophobicContact CG2-CD1 3.71Å; I164-I168 WeakPolarHBondContact O-CB 3.11Å; I164-I168 VanDerWaalsContact O-CG1 3.29Å; I164-I168 WeakPolarHBondContact O-CG1 3.45Å; I164-I168 PolarHBondContact O-N 3.25Å; T166-I168 PolarHBondContact O-N 3.14Å; I168-K171 PolarHBondContact O-NZ 3.39Å; I168-L188 HydrophobicContact CG1-CD1 4.47Å
169N95.9Very high94Very high117 Ų11745.2 Ų45.263%0.62625%0.245SC*.Hα-helixtrans-102.1-21.1-165.2-63.6-31.8000115.7T165T165-N169 VanDerWaalsContact O-CB 3.28Å; T165-N169 WeakPolarHBondContact O-CB 3.32Å; T165-N169 PolarHBondContact O-N 3.06Å
170M95.2Very high93.8Very high54 Ų5445 Ų4527%0.26624%0.243SC..SBendtrans-102.89.7-171.3-59.3-173.969.300114.4A88 D90 A92 T166A88-M170 HydrophobicContact CB-CB 4.01Å; A88-M170 HydrophobicContact CB-CE 4.44Å; D90-M170 WeakPolarHBondContact O-CE 3.39Å; A92-M170 WeakPolarHBondContact CA-SD 3.12Å; A92-M170 HydrophobicContact CB-CG 4.48Å; A92-M170 HydrophobicContact CB-SD 3.62Å; A92-M170 PolarHBondContact N-SD 2.96Å; T166-M170 HydrophobicContact CG2-CB 4.39Å; T166-M170 HydrophobicContact CG2-SD 3.99Å; T166-M170 VanDerWaalsContact O-CB 3.32Å; T166-M170 WeakPolarHBondContact O-CB 3.48Å; T166-M170 PolarHBondContact O-N 3.35Å
171K91.9Very high93.7Very high36 Ų3646.5 Ų46.516%0.15725%0.253CS..SBendtrans-70.2147.3173.3-60.4-170.1-63.7-81.10110.7I86 I167 I168 M175 T180I86-K171 HydrophobicContact CB-CG 4.21Å; I86-K171 HydrophobicContact CD1-CG 4.43Å; I86-K171 HydrophobicContact CG2-CG 4.48Å; I167-K171 WeakPolarHBondContact O-CD 3.3Å; I167-K171 VanDerWaalsContact O-CG 3.29Å; I167-K171 WeakPolarHBondContact O-CG 3.31Å; I167-K171 PolarHBondContact O-NZ 3.35Å; I168-K171 PolarHBondContact O-NZ 3.39Å; K171-M175 HydrophobicContact CB-CB 4.47Å; K171-M175 HydrophobicContact CD-CG 4.27Å; K171-M175 HydrophobicContact CD-SD 3.96Å; K171-M175 HydrophobicContact CG-SD 4.37Å; K171-T180 HydrophobicContact CD-CG2 3.42Å; K171-T180 VanDerWaalsContact CD-CG2 3.42Å
172P88.2Confident93.6Very high8 Ų844.1 Ų44.15%0.05224%0.24CC..  trans-53.4142.1167.7-25.931.6000110.8I86 A174 M175 V508I86-P172 WeakPolarHBondContact O-CD 3.47Å; P172-A174 PolarHBondContact O-N 3.46Å; P172-M175 PolarHBondContact O-N 2.83Å; P172-V508 HydrophobicContact CG-CB 4.11Å
173P84.8Confident93.5Very high135 Ų13544.1 Ų44.188%0.87724%0.24SC*.THydrogen-bonded Turntrans-54.7-25.6-177.8-28.635.1000115
174A84.9Confident93.5Very high54 Ų5444 Ų4445%0.44624%0.24SC..THydrogen-bonded Turntrans-79.1-18.5178.600000114.1P172 M510P172-A174 PolarHBondContact O-N 3.46Å; A174-M510 HydrophobicContact CB-CB 4.33Å
175M89.4Confident93.5Very high10 Ų1043.5 Ų43.55%0.04924%0.236CC..  trans-89.9108.3-177.6-177.4-176.2-82.400110.5K171 P172 Q179 T180 L491 M510K171-M175 HydrophobicContact CB-CB 4.47Å; K171-M175 HydrophobicContact CD-CG 4.27Å; K171-M175 HydrophobicContact CD-SD 3.96Å; K171-M175 HydrophobicContact CG-SD 4.37Å; P172-M175 PolarHBondContact O-N 2.83Å; M175-Q179 HydrophobicContact CG-CB 4.31Å; M175-T180 HydrophobicContact CG-CG2 4.38Å; M175-T180 HydrophobicContact SD-CG2 3.97Å; M175-L491 HydrophobicContact CE-CD1 4.13Å; M175-M510 HydrophobicContact CE-CE 3.45Å; M175-M510 VanDerWaalsContact CE-CE 3.45Å; M175-M510 HydrophobicContact CE-SD 4.13Å
176T91.1Very high93.5Very high74 Ų7442 Ų4245%0.45423%0.227SC..  trans-72.4161170.368.80000111.1Y178 Q179T176-Y178 PolarHBondContact O-N 3.36Å; T176-Q179 PolarHBondContact O-N 3.46Å; T176-Q179 WeakPolarHBondContact OG1-CG 3.49Å; T176-Q179 PolarHBondContact OG1-OE1 3.16Å
177Q91.2Very high93.5Very high48 Ų4842 Ų4222%0.22423%0.227CC..G310 helixtrans-60-34.1177.5-173.156.933.800112.3Q179 T180 W185Q177-Q179 PolarHBondContact O-N 2.85Å; Q177-T180 PolarHBondContact NE2-OG1 3.46Å; Q177-T180 PolarHBondContact O-N 3.22Å; Q177-T180 PolarHBondContact O-OG1 3.41Å; Q177-W185 HydrophobicContact CG-CH2 3.49Å; Q177-W185 VanDerWaalsContact CG-CH2 3.49Å; Q177-W185 HydrophobicContact CG-CZ2 3.51Å; Q177-W185 HydrophobicContact CG-CZ3 4.37Å; Q177-W185 WeakPolarHBondContact O-CZ2 3.45Å; Q177-W185 PolarHBondContact O-NE1 3Å
178Y89.1Confident93.5Very high122 Ų12242.6 Ų42.648%0.47823%0.23SC..G310 helixtrans-72.6-10.8176.7-65.4-63.9000113.9T176 W185 Y269 M270T176-Y178 PolarHBondContact O-N 3.36Å; Y178-W185 HydrophobicContact CD1-CZ2 4.43Å; Y178-Y269 WeakPolarHBondContact O-CE1 3.45Å; Y178-Y269 PolarHBondContact O-OH 3.29Å; Y178-M270 HydrophobicContact CD1-CE 3.45Å; Y178-M270 VanDerWaalsContact CD1-CE 3.45Å; Y178-M270 HydrophobicContact CD1-SD 3.76Å; Y178-M270 HydrophobicContact CE1-CE 3.62Å; Y178-M270 HydrophobicContact CG-CE 4.22Å; Y178-M270 HydrophobicContact CG-SD 4.31Å
179Q89.4Confident93.7Very high75 Ų7539 Ų3935%0.3521%0.212SC..G310 helixtrans-97.53.8174.6-69.2163.3-52.600112.7M175 T176 Q177M175-Q179 HydrophobicContact CG-CB 4.31Å; T176-Q179 PolarHBondContact O-N 3.46Å; T176-Q179 WeakPolarHBondContact OG1-CG 3.49Å; T176-Q179 PolarHBondContact OG1-OE1 3.16Å; Q177-Q179 PolarHBondContact O-N 2.85Å
180T93.8Very high93.8Very high1 Ų133.4 Ų33.41%0.00618%0.182CC..SBendtrans-75.1139.8-179.357.80000112K171 M175 Q177 W185 Y269K171-T180 HydrophobicContact CD-CG2 3.42Å; K171-T180 VanDerWaalsContact CD-CG2 3.42Å; M175-T180 HydrophobicContact CG-CG2 4.38Å; M175-T180 HydrophobicContact SD-CG2 3.97Å; Q177-T180 PolarHBondContact NE2-OG1 3.46Å; Q177-T180 PolarHBondContact O-N 3.22Å; Q177-T180 PolarHBondContact O-OG1 3.41Å; T180-W185 VanDerWaalsContact O-CD1 3.3Å; T180-W185 PolarHBondContact OG1-NE1 2.84Å; T180-Y269 PolarHBondContact O-OH 3.43Å
181P95.3Very high94Very high33 Ų3330.9 Ų30.921%0.21417%0.17CC..  trans-60151.4-178.7-2635.9000113.7M85 F183 V184 W185 H255M85-P181 HydrophobicContact CB-CG 4.21Å; P181-F183 PolarHBondContact O-N 2.68Å; P181-V184 HydrophobicContact CB-CG2 4.34Å; P181-V184 HydrophobicContact CG-CG2 4.46Å; P181-V184 WeakPolarHBondContact O-CA 3.43Å; P181-V184 WeakPolarHBondContact O-CB 3.36Å; P181-V184 PolarHBondContact O-N 3.45Å; P181-W185 PolarHBondContact O-N 2.85Å; P181-H255 WeakPolarHBondContact CB-NE2 3.29Å
182L97.2Very high94.3Very high6 Ų632.7 Ų32.73%0.03118%0.18CC..Hα-helixtrans-61.7-30-175.3-72-176.7000113.3S186 P266 Y269 M272 V273 M276L182-S186 WeakPolarHBondContact O-CB 3.31Å; L182-S186 PolarHBondContact O-N 2.83Å; L182-P266 HydrophobicContact CD1-CB 4.36Å; L182-P266 HydrophobicContact CD1-CG 3.49Å; L182-P266 VanDerWaalsContact CD1-CG 3.49Å; L182-P266 HydrophobicContact CG-CG 4.35Å; L182-Y269 HydrophobicContact CD1-CD2 4.35Å; L182-Y269 HydrophobicContact CD2-CD2 3.67Å; L182-Y269 HydrophobicContact CD2-CE2 3.52Å; L182-Y269 HydrophobicContact CG-CD2 3.8Å; L182-Y269 HydrophobicContact CG-CE2 3.8Å; L182-M272 HydrophobicContact CD1-CB 4.01Å; L182-M272 HydrophobicContact CD1-CE 3.8Å; L182-M272 HydrophobicContact CD1-CG 4.5Å; L182-M272 HydrophobicContact CD1-SD 3.65Å; L182-M272 HydrophobicContact CD2-CB 4.18Å; L182-V273 HydrophobicContact CD2-CG2 3.55Å; L182-M276 HydrophobicContact CB-CE 4.49Å; L182-M276 HydrophobicContact CD2-CE 3.76Å
183F98.1Very high94.8Very high0 Ų032.5 Ų32.50%018%0.179CC..Hα-helixtrans-63-44.6172-179.2-103.6000111.6F77 L81 V82 M85 P181 W185 S186 V187 P248 M252 H255F77-F183 HydrophobicContact CB-CE2 4.37Å; F77-F183 HydrophobicContact CB-CZ 3.76Å; L81-F183 HydrophobicContact CB-CD1 4.07Å; L81-F183 HydrophobicContact CB-CE1 3.76Å; L81-F183 HydrophobicContact CD1-CD1 4.27Å; L81-F183 HydrophobicContact CD1-CE1 3.98Å; L81-F183 HydrophobicContact CD1-CZ 4.3Å; L81-F183 HydrophobicContact CG-CE1 4.45Å; V82-F183 HydrophobicContact CG2-CE1 4.28Å; M85-F183 HydrophobicContact CE-CD1 4.44Å; M85-F183 HydrophobicContact SD-CB 4.01Å; M85-F183 HydrophobicContact SD-CD1 3.76Å; M85-F183 HydrophobicContact SD-CG 4.29Å; P181-F183 PolarHBondContact O-N 2.68Å; F183-W185 PolarHBondContact O-N 3.12Å; F183-S186 PolarHBondContact O-N 2.99Å; F183-S186 VanDerWaalsContact O-N 3.13Å; F183-S186 PolarHBondContact O-OG 3.35Å; F183-V187 HydrophobicContact CD1-CG2 4.31Å; F183-V187 HydrophobicContact CE1-CG2 3.8Å; F183-V187 HydrophobicContact CE2-CG2 4.11Å; F183-V187 HydrophobicContact CZ-CG2 3.69Å; F183-V187 WeakPolarHBondContact O-CG2 3.46Å; F183-V187 PolarHBondContact O-N 3.48Å; F183-P248 HydrophobicContact CE2-CB 4.29Å; F183-M252 HydrophobicContact CD2-CG 3.72Å; F183-M252 HydrophobicContact CE2-CG 3.62Å; F183-M252 HydrophobicContact CE2-SD 4.44Å; F183-H255 WeakPolarHBondContact CB-NE2 3.09Å; F183-H255 PolarHBondContact N-NE2 2.72Å
184V98.4Very high95.4Very high0 Ų026.2 Ų26.20%014%0.138CC..Hα-helixtrans-62.3-43.6177.3-178.90000111.3M85 I86 I167 P181 S186 V187 L188M85-V184 HydrophobicContact CB-CG2 3.7Å; M85-V184 HydrophobicContact SD-CG2 4.29Å; I86-V184 HydrophobicContact CG2-CB 4.4Å; I86-V184 HydrophobicContact CG2-CG1 3.72Å; I86-V184 HydrophobicContact CG2-CG2 3.9Å; I167-V184 HydrophobicContact CB-CG1 4.4Å; I167-V184 HydrophobicContact CD1-CG1 3.91Å; I167-V184 HydrophobicContact CG1-CG1 3.84Å; I167-V184 HydrophobicContact CG2-CG1 3.7Å; P181-V184 HydrophobicContact CB-CG2 4.34Å; P181-V184 HydrophobicContact CG-CG2 4.46Å; P181-V184 WeakPolarHBondContact O-CA 3.43Å; P181-V184 WeakPolarHBondContact O-CB 3.36Å; P181-V184 PolarHBondContact O-N 3.45Å; V184-S186 VanDerWaalsContact C-N 3.31Å; V184-S186 PolarHBondContact O-N 3.21Å; V184-V187 PolarHBondContact O-N 2.99Å; V184-L188 WeakPolarHBondContact O-CB 3.41Å; V184-L188 PolarHBondContact O-N 3.28Å
185W98.4Very high96Very high19 Ų1926.8 Ų26.87%0.07213%0.133CC..Hα-helixtrans-56.9-45172.1-90.1112.6000112.6Q177 Y178 T180 P181 F183 V187 L188 I189 Y269 V273 M276 M277Q177-W185 HydrophobicContact CG-CH2 3.49Å; Q177-W185 VanDerWaalsContact CG-CH2 3.49Å; Q177-W185 HydrophobicContact CG-CZ2 3.51Å; Q177-W185 HydrophobicContact CG-CZ3 4.37Å; Q177-W185 WeakPolarHBondContact O-CZ2 3.45Å; Q177-W185 PolarHBondContact O-NE1 3Å; Y178-W185 HydrophobicContact CD1-CZ2 4.43Å; T180-W185 VanDerWaalsContact O-CD1 3.3Å; T180-W185 PolarHBondContact OG1-NE1 2.84Å; P181-W185 PolarHBondContact O-N 2.85Å; F183-W185 PolarHBondContact O-N 3.12Å; W185-V187 VanDerWaalsContact C-N 3.34Å; W185-V187 PolarHBondContact O-N 3.35Å; W185-L188 HydrophobicContact CE3-CD2 4.18Å; W185-L188 HydrophobicContact CZ3-CD2 4.14Å; W185-L188 PolarHBondContact O-N 3.4Å; W185-I189 WeakPolarHBondContact O-CG1 3.16Å; W185-I189 PolarHBondContact O-N 3.05Å; W185-Y269 PolarHBondContact NE1-OH 3.49Å; W185-Y269 VanDerWaalsContact NE1-OH 3.16Å; W185-V273 HydrophobicContact CD2-CG1 3.8Å; W185-V273 HydrophobicContact CD2-CG2 4.44Å; W185-V273 HydrophobicContact CE3-CG1 4.16Å; W185-V273 HydrophobicContact CG-CG1 4.29Å; W185-V273 HydrophobicContact CG-CG2 4.15Å; W185-V273 HydrophobicContact CH2-CG1 4.13Å; W185-V273 HydrophobicContact CZ2-CG1 3.77Å; W185-V273 HydrophobicContact CZ3-CG1 4.32Å; W185-M276 HydrophobicContact CB-CE 3.74Å; W185-M277 HydrophobicContact CH2-SD 4.43Å; W185-M277 HydrophobicContact CZ3-SD 4.06Å
186S98.4Very high96.5Very high0 Ų031 Ų310%016%0.155CC..Hα-helixtrans-64.1-39-179.674.10000112.5L182 F183 V184 T190 L247 P248L182-S186 WeakPolarHBondContact O-CB 3.31Å; L182-S186 PolarHBondContact O-N 2.83Å; F183-S186 PolarHBondContact O-N 2.99Å; F183-S186 VanDerWaalsContact O-N 3.13Å; F183-S186 PolarHBondContact O-OG 3.35Å; V184-S186 VanDerWaalsContact C-N 3.31Å; V184-S186 PolarHBondContact O-N 3.21Å; S186-T190 VanDerWaalsContact O-CB 3.31Å; S186-T190 WeakPolarHBondContact O-CB 3.31Å; S186-T190 PolarHBondContact O-N 3.34Å; S186-T190 PolarHBondContact O-OG1 3.15Å; S186-L247 WeakPolarHBondContact CB-O 3.46Å; S186-P248 WeakPolarHBondContact OG-CA 3.3Å
187V98.8Very high96.8Very high0 Ų027.4 Ų27.40%013%0.133CC..Hα-helixtrans-68.5-40.3174.8175.80000111I74 V82 F163 I167 F183 V184 W185 T190 A191I74-V187 HydrophobicContact CD1-CG1 4.41Å; I74-V187 HydrophobicContact CD1-CG2 4.41Å; V82-V187 HydrophobicContact CG2-CB 4.13Å; V82-V187 HydrophobicContact CG2-CG1 3.99Å; V82-V187 HydrophobicContact CG2-CG2 4.14Å; F163-V187 HydrophobicContact CB-CG1 4.3Å; F163-V187 HydrophobicContact CD1-CG1 3.77Å; F163-V187 HydrophobicContact CD2-CG1 4.31Å; F163-V187 HydrophobicContact CE1-CG1 4.2Å; F163-V187 HydrophobicContact CG-CG1 3.87Å; I167-V187 HydrophobicContact CD1-CB 4.47Å; I167-V187 HydrophobicContact CD1-CG1 4.27Å; F183-V187 HydrophobicContact CD1-CG2 4.31Å; F183-V187 HydrophobicContact CE1-CG2 3.8Å; F183-V187 HydrophobicContact CE2-CG2 4.11Å; F183-V187 HydrophobicContact CZ-CG2 3.69Å; F183-V187 WeakPolarHBondContact O-CG2 3.46Å; F183-V187 PolarHBondContact O-N 3.48Å; V184-V187 PolarHBondContact O-N 2.99Å; W185-V187 VanDerWaalsContact C-N 3.34Å; W185-V187 PolarHBondContact O-N 3.35Å; V187-T190 PolarHBondContact O-N 3.06Å; V187-A191 WeakPolarHBondContact O-CB 3.33Å; V187-A191 PolarHBondContact O-N 3.26Å
188L98.8Very high97Very high13 Ų1325.4 Ų25.47%0.06812%0.124CC..Hα-helixtrans-59.7-48.8176.5178.561.1000111.7I164 I167 I168 V184 W185 T190 A191 I192I164-L188 HydrophobicContact CG1-CD1 4.22Å; I167-L188 HydrophobicContact CB-CD1 4.38Å; I167-L188 HydrophobicContact CD1-CB 3.9Å; I167-L188 HydrophobicContact CD1-CD1 4.49Å; I167-L188 HydrophobicContact CG2-CB 4.28Å; I167-L188 HydrophobicContact CG2-CD1 4.27Å; I167-L188 HydrophobicContact CG2-CD2 4.07Å; I167-L188 HydrophobicContact CG2-CG 4.44Å; I168-L188 HydrophobicContact CG1-CD1 4.47Å; V184-L188 WeakPolarHBondContact O-CB 3.41Å; V184-L188 PolarHBondContact O-N 3.28Å; W185-L188 HydrophobicContact CE3-CD2 4.18Å; W185-L188 HydrophobicContact CZ3-CD2 4.14Å; W185-L188 PolarHBondContact O-N 3.4Å; L188-T190 VanDerWaalsContact C-N 3.33Å; L188-A191 PolarHBondContact O-N 2.83Å; L188-I192 HydrophobicContact CD1-CD1 4.4Å; L188-I192 HydrophobicContact CG-CD1 4.34Å; L188-I192 WeakPolarHBondContact O-CG1 3.44Å; L188-I192 PolarHBondContact O-N 3.35Å; L188-I192 VanDerWaalsContact O-N 3.08Å
189I98.8Very high97.5Very high14 Ų1422.7 Ų22.77%0.07212%0.121CC..Hα-helixtrans-62.9-45.5178.6-63.6162.2000109.3W185 A191 I192 L193 L247 M276 M277W185-I189 WeakPolarHBondContact O-CG1 3.16Å; W185-I189 PolarHBondContact O-N 3.05Å; I189-A191 VanDerWaalsContact C-N 3.32Å; I189-A191 PolarHBondContact O-N 3.41Å; I189-I192 WeakPolarHBondContact O-CB 3.22Å; I189-I192 PolarHBondContact O-N 2.87Å; I189-I192 VanDerWaalsContact O-N 3.13Å; I189-L193 HydrophobicContact CG2-CG 4.45Å; I189-L193 WeakPolarHBondContact O-CG 3.2Å; I189-L193 PolarHBondContact O-N 3.47Å; I189-L247 HydrophobicContact CB-CD1 4.37Å; I189-L247 HydrophobicContact CG2-CD1 3.69Å; I189-M276 HydrophobicContact CD1-CB 3.43Å; I189-M276 VanDerWaalsContact CD1-CB 3.43Å; I189-M277 HydrophobicContact CD1-CG 3.84Å; I189-M277 HydrophobicContact CG1-CG 4.35Å
190T98.6Very high97.9Very high0 Ų020.7 Ų20.70%011%0.114CC..Hα-helixtrans-58.5-42.6177.6-57.50000112.4I74 S186 V187 L188 I192 L193 L194 I244 L247 P248I74-T190 HydrophobicContact CD1-CG2 3.52Å; I74-T190 HydrophobicContact CG1-CG2 3.95Å; S186-T190 VanDerWaalsContact O-CB 3.31Å; S186-T190 WeakPolarHBondContact O-CB 3.31Å; S186-T190 PolarHBondContact O-N 3.34Å; S186-T190 PolarHBondContact O-OG1 3.15Å; V187-T190 PolarHBondContact O-N 3.06Å; L188-T190 VanDerWaalsContact C-N 3.33Å; T190-I192 VanDerWaalsContact C-N 3.34Å; T190-I192 PolarHBondContact O-N 2.95Å; T190-L193 PolarHBondContact O-N 3.25Å; T190-L194 HydrophobicContact CG2-CD1 4.19Å; T190-L194 WeakPolarHBondContact O-CG 3.42Å; T190-L194 PolarHBondContact O-N 3.44Å; T190-I244 HydrophobicContact CG2-CB 3.9Å; T190-I244 HydrophobicContact CG2-CG1 3.97Å; T190-I244 HydrophobicContact CG2-CG2 3.59Å; T190-L247 WeakPolarHBondContact OG1-CB 3.43Å; T190-P248 HydrophobicContact CG2-CG 4.31Å; T190-P248 WeakPolarHBondContact OG1-CD 3.33Å
191A98.8Very high98.1Very high1 Ų121 Ų211%0.00812%0.115CC..Hα-helixtrans-63.6-38.6176.700000112.1A160 F163 I164 V187 L188 I189 L194 L195A160-A191 HydrophobicContact CB-CB 4.04Å; A160-A191 WeakPolarHBondContact CB-O 3.13Å; F163-A191 HydrophobicContact CB-CB 4.04Å; I164-A191 HydrophobicContact CD1-CB 4.17Å; I164-A191 HydrophobicContact CG1-CB 3.75Å; V187-A191 WeakPolarHBondContact O-CB 3.33Å; V187-A191 PolarHBondContact O-N 3.26Å; L188-A191 PolarHBondContact O-N 2.83Å; I189-A191 VanDerWaalsContact C-N 3.32Å; I189-A191 PolarHBondContact O-N 3.41Å; A191-L194 PolarHBondContact O-N 3.5Å; A191-L195 WeakPolarHBondContact O-CB 3.36Å; A191-L195 PolarHBondContact O-N 2.91Å
192I98.8Very high98.3Very high74 Ų7421 Ų2138%0.37912%0.118SC..Hα-helixtrans-64.3-45173.7-67.3166.2000110.7I164 L188 I189 T190 L194 L195 L196I164-I192 HydrophobicContact CD1-CG1 4.09Å; I164-I192 HydrophobicContact CG1-CG1 4.31Å; L188-I192 HydrophobicContact CD1-CD1 4.4Å; L188-I192 HydrophobicContact CG-CD1 4.34Å; L188-I192 WeakPolarHBondContact O-CG1 3.44Å; L188-I192 PolarHBondContact O-N 3.35Å; L188-I192 VanDerWaalsContact O-N 3.08Å; I189-I192 WeakPolarHBondContact O-CB 3.22Å; I189-I192 PolarHBondContact O-N 2.87Å; I189-I192 VanDerWaalsContact O-N 3.13Å; T190-I192 VanDerWaalsContact C-N 3.34Å; T190-I192 PolarHBondContact O-N 2.95Å; I192-L194 VanDerWaalsContact C-N 3.35Å; I192-L194 PolarHBondContact O-N 2.87Å; I192-L195 PolarHBondContact O-N 3.46Å; I192-L196 HydrophobicContact CG2-CD1 3.87Å; I192-L196 HydrophobicContact CG2-CG 4.49Å; I192-L196 WeakPolarHBondContact O-CG 3.27Å; I192-L196 PolarHBondContact O-N 3.46Å; I192-L196 VanDerWaalsContact O-N 3.12Å
193L98.5Very high98.3Very high4 Ų422.7 Ų22.72%0.02113%0.133CC..Hα-helixtrans-59.1-46.2176.5-62.8-174.5000111.3I189 T190 L195 L196 S197 I244 L247 G280 F284I189-L193 HydrophobicContact CG2-CG 4.45Å; I189-L193 WeakPolarHBondContact O-CG 3.2Å; I189-L193 PolarHBondContact O-N 3.47Å; T190-L193 PolarHBondContact O-N 3.25Å; L193-L195 PolarHBondContact O-N 3.48Å; L193-L196 PolarHBondContact O-N 3.48Å; L193-S197 VanDerWaalsContact O-CB 3.24Å; L193-S197 WeakPolarHBondContact O-CB 3.48Å; L193-S197 PolarHBondContact O-N 3.49Å; L193-S197 PolarHBondContact O-OG 3.42Å; L193-I244 HydrophobicContact CB-CD1 3.73Å; L193-I244 HydrophobicContact CB-CG1 3.55Å; L193-I244 HydrophobicContact CD1-CG1 4.02Å; L193-I244 HydrophobicContact CG-CG1 4.42Å; L193-L247 HydrophobicContact CD1-CD1 3.7Å; L193-G280 WeakPolarHBondContact CD2-O 3.23Å; L193-F284 HydrophobicContact CD2-CD2 4.08Å; L193-F284 HydrophobicContact CD2-CE2 3.36Å; L193-F284 HydrophobicContact CD2-CZ 4.07Å
194L98.1Very high98.4Very high3 Ų322.9 Ų22.92%0.01614%0.135CC..Hα-helixtrans-58.6-47.3178.4-78.7167.7000111.4M70 A160 T190 A191 I192 L196 L198 I244M70-L194 HydrophobicContact SD-CD2 4.31Å; A160-L194 HydrophobicContact CB-CB 4Å; T190-L194 HydrophobicContact CG2-CD1 4.19Å; T190-L194 WeakPolarHBondContact O-CG 3.42Å; T190-L194 PolarHBondContact O-N 3.44Å; A191-L194 PolarHBondContact O-N 3.5Å; I192-L194 VanDerWaalsContact C-N 3.35Å; I192-L194 PolarHBondContact O-N 2.87Å; L194-L196 VanDerWaalsContact C-N 3.29Å; L194-L196 PolarHBondContact O-N 3.3Å; L194-L198 HydrophobicContact CB-CD1 4.29Å; L194-L198 HydrophobicContact CD2-CD1 3.71Å; L194-L198 HydrophobicContact CD2-CG 4.25Å; L194-L198 WeakPolarHBondContact O-CB 3.41Å; L194-L198 WeakPolarHBondContact O-CG 3.33Å; L194-L198 PolarHBondContact O-N 3.02Å; L194-L198 VanDerWaalsContact O-N 3.16Å; L194-I244 HydrophobicContact CB-CD1 4.46Å; L194-I244 HydrophobicContact CD1-CG2 4.33Å; L194-I244 HydrophobicContact CD2-CD1 3.73Å; L194-I244 HydrophobicContact CD2-CG1 4.35Å; L194-I244 HydrophobicContact CD2-CG2 3.81Å; L194-I244 HydrophobicContact CG-CD1 3.8Å; L194-I244 HydrophobicContact CG-CG1 4.09Å; L194-I244 HydrophobicContact CG-CG2 3.96Å
195L98.1Very high98.4Very high65 Ų6523 Ų2334%0.3414%0.136SC..Hα-helixtrans-62-36.3-179.1-176.262.9000112.6I157 I161 I164 A191 I192 L193 P199I157-L195 HydrophobicContact CG2-CD1 4.2Å; I161-L195 HydrophobicContact CD1-CD1 4.4Å; I161-L195 HydrophobicContact CG1-CD1 4.02Å; I164-L195 HydrophobicContact CD1-CD2 3.97Å; A191-L195 WeakPolarHBondContact O-CB 3.36Å; A191-L195 PolarHBondContact O-N 2.91Å; I192-L195 PolarHBondContact O-N 3.46Å; L193-L195 PolarHBondContact O-N 3.48Å; L195-P199 WeakPolarHBondContact O-CD 3.25Å; L195-P199 WeakPolarHBondContact O-CG 3.47Å
196L98.1Very high98.4Very high98 Ų9825 Ų2551%0.51315%0.15SC..Hα-helixtrans-87.9-31.1-176.9-65.9177.4000113.6I192 L193 L194 F284I192-L196 HydrophobicContact CG2-CD1 3.87Å; I192-L196 HydrophobicContact CG2-CG 4.49Å; I192-L196 WeakPolarHBondContact O-CG 3.27Å; I192-L196 PolarHBondContact O-N 3.46Å; I192-L196 VanDerWaalsContact O-N 3.12Å; L193-L196 PolarHBondContact O-N 3.48Å; L194-L196 VanDerWaalsContact C-N 3.29Å; L194-L196 PolarHBondContact O-N 3.3Å; L196-F284 HydrophobicContact CB-CE1 4.23Å; L196-F284 HydrophobicContact CB-CE2 4.25Å; L196-F284 HydrophobicContact CB-CZ 3.59Å; L196-F284 HydrophobicContact CD1-CE2 4.17Å; L196-F284 HydrophobicContact CD1-CZ 4.35Å
197S97.6Very high98.4Very high0 Ų026.7 Ų26.70%016%0.158CC..Hα-helixtrans-91.7-40.4-173.461.20000113.9L193 P199 V200L193-S197 VanDerWaalsContact O-CB 3.24Å; L193-S197 WeakPolarHBondContact O-CB 3.48Å; L193-S197 PolarHBondContact O-N 3.49Å; L193-S197 PolarHBondContact O-OG 3.42Å; S197-P199 VanDerWaalsContact C-CD 3.48Å; S197-V200 PolarHBondContact O-N 2.9Å; S197-V200 VanDerWaalsContact O-N 3.11Å
198L97.1Very high98.4Very high6 Ų626.8 Ų26.83%0.03116%0.159CC..Hα-helixtrans-61.5-35.6-175.7-75.6172.3000115I157 L194 V200 L201 A202 F237I157-L198 HydrophobicContact CD1-CB 3.98Å; I157-L198 HydrophobicContact CG1-CB 3.99Å; I157-L198 HydrophobicContact CG1-CD1 3.81Å; L194-L198 HydrophobicContact CB-CD1 4.29Å; L194-L198 HydrophobicContact CD2-CD1 3.71Å; L194-L198 HydrophobicContact CD2-CG 4.25Å; L194-L198 WeakPolarHBondContact O-CB 3.41Å; L194-L198 WeakPolarHBondContact O-CG 3.33Å; L194-L198 PolarHBondContact O-N 3.02Å; L194-L198 VanDerWaalsContact O-N 3.16Å; L198-V200 PolarHBondContact O-N 3.46Å; L198-L201 HydrophobicContact CD2-CD2 4.42Å; L198-L201 PolarHBondContact O-N 2.97Å; L198-A202 PolarHBondContact O-N 3.4Å; L198-F237 HydrophobicContact CD2-CD2 4.11Å; L198-F237 HydrophobicContact CD2-CE2 3.51Å; L198-F237 HydrophobicContact CD2-CZ 4.29Å; L198-F237 HydrophobicContact CG-CE2 4.34Å
199P98.4Very high98.4Very high64 Ų6427.4 Ų27.442%0.41616%0.162SC..Hα-helixtrans-58-32.4174.9-27.536.7000113.4L195 S197 A202 A203L195-P199 WeakPolarHBondContact O-CD 3.25Å; L195-P199 WeakPolarHBondContact O-CG 3.47Å; S197-P199 VanDerWaalsContact C-CD 3.48Å; P199-A202 PolarHBondContact O-N 2.7Å; P199-A203 WeakPolarHBondContact O-CB 3.3Å; P199-A203 PolarHBondContact O-N 3.14Å
200V98.6Very high98.4Very high34 Ų3428 Ų2821%0.20617%0.166CC..Hα-helixtrans-72.3-41.4179.2-175.20000111.2S197 L198 A203 G204 L233 F236S197-V200 PolarHBondContact O-N 2.9Å; S197-V200 VanDerWaalsContact O-N 3.11Å; L198-V200 PolarHBondContact O-N 3.46Å; V200-A203 PolarHBondContact O-N 3.45Å; V200-G204 PolarHBondContact O-N 3.35Å; V200-L233 HydrophobicContact CG1-CB 4.31Å; V200-L233 HydrophobicContact CG1-CD2 3.86Å; V200-F236 HydrophobicContact CB-CD1 3.95Å; V200-F236 HydrophobicContact CG1-CB 4.33Å; V200-F236 HydrophobicContact CG1-CD1 3.85Å; V200-F236 HydrophobicContact CG1-CG 4.42Å; V200-F236 HydrophobicContact CG2-CD1 3.67Å; V200-F236 HydrophobicContact CG2-CE1 3.76Å
201L98.1Very high98.4Very high6 Ų629.4 Ų29.43%0.03117%0.174CC..Hα-helixtrans-58.3-51.8171176.867.2000110.6L198 A203 G204 I205 F234 F237L198-L201 HydrophobicContact CD2-CD2 4.42Å; L198-L201 PolarHBondContact O-N 2.97Å; L201-A203 VanDerWaalsContact C-N 3.27Å; L201-A203 PolarHBondContact O-N 2.86Å; L201-G204 WeakPolarHBondContact O-CA 3.3Å; L201-G204 PolarHBondContact O-N 3.33Å; L201-I205 HydrophobicContact CD1-CG2 3.87Å; L201-I205 HydrophobicContact CG-CD1 4.43Å; L201-I205 HydrophobicContact CG-CG2 4.43Å; L201-I205 WeakPolarHBondContact O-CG1 3.45Å; L201-I205 PolarHBondContact O-N 3.3Å; L201-F234 HydrophobicContact CD1-CD2 3.94Å; L201-F234 HydrophobicContact CD1-CE2 4.09Å; L201-F237 HydrophobicContact CB-CB 3.88Å; L201-F237 HydrophobicContact CB-CD1 3.86Å; L201-F237 HydrophobicContact CB-CD2 3.94Å; L201-F237 HydrophobicContact CB-CE1 4.43Å; L201-F237 HydrophobicContact CB-CG 3.59Å; L201-F237 HydrophobicContact CD1-CD1 3.77Å; L201-F237 HydrophobicContact CD1-CE1 4.1Å; L201-F237 HydrophobicContact CD1-CG 4.39Å; L201-F237 HydrophobicContact CD2-CD1 3.92Å; L201-F237 HydrophobicContact CD2-CD2 4.36Å; L201-F237 HydrophobicContact CD2-CE1 3.64Å; L201-F237 HydrophobicContact CD2-CE2 4.11Å; L201-F237 HydrophobicContact CD2-CG 4.28Å; L201-F237 HydrophobicContact CD2-CZ 3.73Å; L201-F237 HydrophobicContact CG-CD1 4.05Å; L201-F237 HydrophobicContact CG-CE1 4.26Å; L201-F237 HydrophobicContact CG-CG 4.28Å
202A98.4Very high98.3Very high33 Ų3329.7 Ų29.727%0.27318%0.175SC..Hα-helixtrans-56.4-42.5-178.100000111.5L198 P199 T206L198-A202 PolarHBondContact O-N 3.4Å; P199-A202 PolarHBondContact O-N 2.7Å; A202-T206 WeakPolarHBondContact O-CB 3.5Å; A202-T206 PolarHBondContact O-N 3.24Å; A202-T206 PolarHBondContact O-OG1 3.22Å
203A98.6Very high98.3Very high43 Ų4330 Ų3036%0.35518%0.178SC..Hα-helixtrans-61.4-48.8173.300000111.8P199 V200 L201 T206 M207P199-A203 WeakPolarHBondContact O-CB 3.3Å; P199-A203 PolarHBondContact O-N 3.14Å; V200-A203 PolarHBondContact O-N 3.45Å; L201-A203 VanDerWaalsContact C-N 3.27Å; L201-A203 PolarHBondContact O-N 2.86Å; A203-T206 PolarHBondContact O-N 2.85Å; A203-M207 VanDerWaalsContact C-CE 3.5Å; A203-M207 HydrophobicContact CB-CE 4.13Å; A203-M207 VanDerWaalsContact O-CE 3.27Å; A203-M207 WeakPolarHBondContact O-CE 3.14Å; A203-M207 WeakPolarHBondContact O-CG 3.32Å; A203-M207 PolarHBondContact O-N 2.84Å
204G98.6Very high98.2Very high3 Ų335.7 Ų35.73%0.03121%0.207CC..Hα-helixtrans-55.5-51.917800000113.6V200 L201 M207 L208V200-G204 PolarHBondContact O-N 3.35Å; L201-G204 WeakPolarHBondContact O-CA 3.3Å; L201-G204 PolarHBondContact O-N 3.33Å; G204-M207 PolarHBondContact O-N 3.16Å; G204-L208 PolarHBondContact O-N 3.31Å
205I98.6Very high98.1Very high3 Ų342.9 Ų42.92%0.01525%0.245CC..Hα-helixtrans-75.2-25.5-178.966.3177.2000112.6I146 L149 H150 L201 L208 L209I146-I205 HydrophobicContact CG1-CB 4.35Å; I146-I205 HydrophobicContact CG2-CB 4.07Å; I146-I205 HydrophobicContact CG2-CD1 4.22Å; I146-I205 HydrophobicContact CG2-CG1 4.14Å; L149-I205 HydrophobicContact CB-CD1 3.82Å; H150-I205 VanDerWaalsContact CE1-CG1 3.47Å; H150-I205 WeakPolarHBondContact CE1-CG1 3.38Å; L201-I205 HydrophobicContact CD1-CG2 3.87Å; L201-I205 HydrophobicContact CG-CD1 4.43Å; L201-I205 HydrophobicContact CG-CG2 4.43Å; L201-I205 WeakPolarHBondContact O-CG1 3.45Å; L201-I205 PolarHBondContact O-N 3.3Å; I205-L208 PolarHBondContact O-N 3.01Å; I205-L209 WeakPolarHBondContact O-CB 3.27Å; I205-L209 PolarHBondContact O-N 3.48Å
206T98.7Very high98.1Very high60 Ų6042 Ų4237%0.36824%0.243SC..Hα-helixtrans-68.7-45.8170.1-62.90000110.8H150 A202 A203 L208 L209 T210H150-T206 PolarHBondContact NE2-OG1 2.81Å; A202-T206 WeakPolarHBondContact O-CB 3.5Å; A202-T206 PolarHBondContact O-N 3.24Å; A202-T206 PolarHBondContact O-OG1 3.22Å; A203-T206 PolarHBondContact O-N 2.85Å; T206-L208 PolarHBondContact O-N 2.91Å; T206-L209 WeakPolarHBondContact O-CB 3.24Å; T206-L209 PolarHBondContact O-N 2.9Å; T206-L209 VanDerWaalsContact O-N 3.08Å; T206-T210 WeakPolarHBondContact O-CG2 3.5Å; T206-T210 PolarHBondContact O-N 3.17Å
207M98.7Very high98.1Very high36 Ų3640.3 Ų40.318%0.17724%0.237CC..Hα-helixtrans-57.6-39.5173.9-75.5-178-82.400111.2A203 G204 T210 D211 F218 F219 L233A203-M207 VanDerWaalsContact C-CE 3.5Å; A203-M207 HydrophobicContact CB-CE 4.13Å; A203-M207 VanDerWaalsContact O-CE 3.27Å; A203-M207 WeakPolarHBondContact O-CE 3.14Å; A203-M207 WeakPolarHBondContact O-CG 3.32Å; A203-M207 PolarHBondContact O-N 2.84Å; G204-M207 PolarHBondContact O-N 3.16Å; M207-T210 PolarHBondContact O-N 3.04Å; M207-T210 PolarHBondContact O-OG1 2.88Å; M207-D211 PolarHBondContact O-N 3.49Å; M207-F218 HydrophobicContact CB-CB 4.2Å; M207-F218 HydrophobicContact CB-CD2 3.68Å; M207-F218 HydrophobicContact CB-CE2 4.16Å; M207-F218 HydrophobicContact CB-CG 3.89Å; M207-F218 HydrophobicContact CG-CD1 4.04Å; M207-F218 HydrophobicContact CG-CD2 3.75Å; M207-F218 HydrophobicContact CG-CE1 4.08Å; M207-F218 HydrophobicContact CG-CE2 3.8Å; M207-F218 HydrophobicContact CG-CG 3.89Å; M207-F218 HydrophobicContact CG-CZ 3.96Å; M207-F218 HydrophobicContact SD-CD1 3.61Å; M207-F218 HydrophobicContact SD-CD2 4.4Å; M207-F218 HydrophobicContact SD-CE1 3.79Å; M207-F218 HydrophobicContact SD-CG 3.94Å; M207-F218 HydrophobicContact SD-CZ 4.28Å; M207-F219 HydrophobicContact CB-CE2 3.66Å; M207-F219 HydrophobicContact CB-CZ 3.68Å; M207-F219 HydrophobicContact CE-CZ 4.48Å; M207-F219 HydrophobicContact SD-CZ 4.42Å; M207-L233 HydrophobicContact CE-CD1 3.35Å
208L98.6Very high98.1Very high2 Ų244.4 Ų44.41%0.0126%0.255CS..Hα-helixtrans-66.5-41.2175.7179.962.2000111.2V127 P129 A132 I146 G204 I205 T206 T210 D211 R212 F219 Y230V127-L208 HydrophobicContact CG1-CD2 3.84Å; P129-L208 HydrophobicContact CB-CD1 4.09Å; P129-L208 HydrophobicContact CG-CD1 4.38Å; A132-L208 HydrophobicContact CB-CD1 4.44Å; A132-L208 HydrophobicContact CB-CD2 3.9Å; I146-L208 HydrophobicContact CD1-CD2 4.17Å; I146-L208 HydrophobicContact CD1-CG 4.22Å; G204-L208 PolarHBondContact O-N 3.31Å; I205-L208 PolarHBondContact O-N 3.01Å; T206-L208 PolarHBondContact O-N 2.91Å; L208-T210 VanDerWaalsContact C-N 3.31Å; L208-T210 PolarHBondContact O-N 3.11Å; L208-D211 PolarHBondContact O-N 2.9Å; L208-R212 VanDerWaalsContact O-CG 3.27Å; L208-R212 WeakPolarHBondContact O-CG 3.45Å; L208-R212 PolarHBondContact O-N 3.15Å; L208-F219 HydrophobicContact CB-CD2 4.32Å; L208-F219 HydrophobicContact CB-CE2 3.99Å; L208-F219 HydrophobicContact CD1-CD2 4.28Å; L208-Y230 HydrophobicContact CB-CE2 4.17Å; L208-Y230 HydrophobicContact CD2-CE2 3.95Å
209L98.6Very high98.2Very high26 Ų2644.2 Ų44.214%0.13625%0.254CS..Hα-helixtrans-61.9-38.8176.3-170.969.3000111.8D143 I146 F147 I205 T206 R212 N213D143-L209 HydrophobicContact CB-CD1 3.9Å; D143-L209 WeakPolarHBondContact OD1-CD1 3.33Å; I146-L209 HydrophobicContact CB-CD1 4.48Å; I146-L209 HydrophobicContact CD1-CB 4.15Å; I146-L209 HydrophobicContact CD1-CD1 4.11Å; I146-L209 HydrophobicContact CG2-CB 4.22Å; I146-L209 HydrophobicContact CG2-CD1 4.33Å; I146-L209 HydrophobicContact CG2-CD2 4.33Å; F147-L209 HydrophobicContact CE1-CD2 3.91Å; F147-L209 HydrophobicContact CZ-CD2 3.93Å; I205-L209 WeakPolarHBondContact O-CB 3.27Å; I205-L209 PolarHBondContact O-N 3.48Å; T206-L209 WeakPolarHBondContact O-CB 3.24Å; T206-L209 PolarHBondContact O-N 2.9Å; T206-L209 VanDerWaalsContact O-N 3.08Å; L209-R212 PolarHBondContact O-N 3.46Å; L209-N213 WeakPolarHBondContact CD1-ND2 3.27Å; L209-N213 WeakPolarHBondContact O-CB 2.9Å; L209-N213 PolarHBondContact O-N 3.41Å; L209-N213 PolarHBondContact O-ND2 3.34Å
210T98.4Very high98.1Very high27 Ų2743.7 Ų43.717%0.16625%0.247CC..Hα-helixtrans-73.4-34.7176.462.70000112.2T206 M207 L208 R212 N213 L214 N215 T216T206-T210 WeakPolarHBondContact O-CG2 3.5Å; T206-T210 PolarHBondContact O-N 3.17Å; M207-T210 PolarHBondContact O-N 3.04Å; M207-T210 PolarHBondContact O-OG1 2.88Å; L208-T210 VanDerWaalsContact C-N 3.31Å; L208-T210 PolarHBondContact O-N 3.11Å; T210-R212 PolarHBondContact O-N 3.04Å; T210-N213 PolarHBondContact O-N 2.85Å; T210-L214 HydrophobicContact CG2-CD1 3.86Å; T210-L214 CarbonylContact O-C 3.54Å; T210-L214 WeakPolarHBondContact O-CA 2.84Å; T210-L214 PolarHBondContact O-N 2.98Å; T210-N215 PolarHBondContact O-N 2.97Å; T210-T216 VanDerWaalsContact CB-OG1 3.31Å; T210-T216 WeakPolarHBondContact CB-OG1 3.4Å; T210-T216 PolarHBondContact O-N 2.99Å; T210-T216 PolarHBondContact O-OG1 3.45Å; T210-T216 PolarHBondContact OG1-OG1 3.12Å
211D98.3Very high98Very high30 Ų3046 Ų4616%0.1626%0.263CS..Hα-helixtrans-63.2-36.7173.2-85.115.8000110.7M207 L208 T216 T217 F218 F219M207-D211 PolarHBondContact O-N 3.49Å; L208-D211 PolarHBondContact O-N 2.9Å; D211-T216 WeakPolarHBondContact CA-O 3.41Å; D211-T216 VanDerWaalsContact CA-OG1 3.32Å; D211-T216 WeakPolarHBondContact CA-OG1 3.44Å; D211-T216 PolarHBondContact N-OG1 3.32Å; D211-T216 WeakPolarHBondContact OD1-CB 3.47Å; D211-T216 VanDerWaalsContact OD1-O 3.11Å; D211-T216 PolarHBondContact OD1-OG1 3.13Å; D211-T217 PolarHBondContact OD1-N 3.46Å; D211-T217 VanDerWaalsContact OD1-N 3.14Å; D211-F218 VanDerWaalsContact CG-N 3.32Å; D211-F218 WeakPolarHBondContact OD1-CD2 3.42Å; D211-F218 PolarHBondContact OD1-N 3.37Å; D211-F218 PolarHBondContact OD2-N 3.07Å; D211-F219 PolarHBondContact OD2-N 2.96Å
212R97.8Very high97.8Very high6 Ų650.1 Ų50.12%0.02330%0.298CS..Hα-helixtrans-71.4-45174.2-68.2174.462.167.514.9112.6A132 G133 N134 H137 G139 D143 L208 L209 T210A132-R212 WeakPolarHBondContact O-CD 3.1Å; A132-R212 PolarHBondContact O-NH1 3.4Å; G133-R212 VanDerWaalsContact C-NH1 3.32Å; G133-R212 PolarHBondContact O-NH1 3.18Å; N134-R212 PolarHBondContact ND2-O 2.91Å; N134-R212 PolarHBondContact OD1-NH1 2.91Å; N134-R212 PolarHBondContact OD1-NH2 3.19Å; N134-R212 VanDerWaalsContact OD1-NH2 3.11Å; H137-R212 PolarHBondContact O-NH1 3.18Å; H137-R212 PolarHBondContact O-NH2 3.41Å; G139-R212 PolarHBondContact O-NH2 2.9Å; D143-R212 IonicContact OD1-CZ 3.35Å; D143-R212 IonicContact OD1-NE 3.34Å; D143-R212 PolarHBondContact OD1-NE 3.08Å; D143-R212 IonicContact OD1-NH2 2.98Å; D143-R212 IonicContact OD2-NH2 2.82Å; L208-R212 VanDerWaalsContact O-CG 3.27Å; L208-R212 WeakPolarHBondContact O-CG 3.45Å; L208-R212 PolarHBondContact O-N 3.15Å; L209-R212 PolarHBondContact O-N 3.46Å; T210-R212 PolarHBondContact O-N 3.04Å
213N98.1Very high97.6Very high82 Ų8250.5 Ų50.544%0.43931%0.305SS..Hα-helixtrans-113.1-18.6-162.5-65.6-75000115.3D143 L209 T210D143-N213 PolarHBondContact OD1-ND2 3.04Å; L209-N213 WeakPolarHBondContact CD1-ND2 3.27Å; L209-N213 WeakPolarHBondContact O-CB 2.9Å; L209-N213 PolarHBondContact O-N 3.41Å; L209-N213 PolarHBondContact O-ND2 3.34Å; T210-N213 PolarHBondContact O-N 2.85Å
214L97.8Very high97.5Very high122 Ų12251.8 Ų51.864%0.63932%0.323SS*.SBendtrans-123.214.9-172-57.7-177.6000113.4T210 T216T210-L214 HydrophobicContact CG2-CD1 3.86Å; T210-L214 CarbonylContact O-C 3.54Å; T210-L214 WeakPolarHBondContact O-CA 2.84Å; T210-L214 PolarHBondContact O-N 2.98Å; L214-T216 PolarHBondContact O-N 2.64Å
215N96Very high97.5Very high154 Ų15452.4 Ų52.482%0.82433%0.329SS*.  trans54.632.3179.8-58.3-45.6000113.8T210T210-N215 PolarHBondContact O-N 2.97Å
216T98Very high97.4Very high46 Ų4655.9 Ų55.928%0.28235%0.347SS..  trans-78.3166.416563.60000109.9T210 D211 L214 F218T210-T216 VanDerWaalsContact CB-OG1 3.31Å; T210-T216 WeakPolarHBondContact CB-OG1 3.4Å; T210-T216 PolarHBondContact O-N 2.99Å; T210-T216 PolarHBondContact O-OG1 3.45Å; T210-T216 PolarHBondContact OG1-OG1 3.12Å; D211-T216 WeakPolarHBondContact CA-O 3.41Å; D211-T216 VanDerWaalsContact CA-OG1 3.32Å; D211-T216 WeakPolarHBondContact CA-OG1 3.44Å; D211-T216 PolarHBondContact N-OG1 3.32Å; D211-T216 WeakPolarHBondContact OD1-CB 3.47Å; D211-T216 VanDerWaalsContact OD1-O 3.11Å; D211-T216 PolarHBondContact OD1-OG1 3.13Å; L214-T216 PolarHBondContact O-N 2.64Å; T216-F218 HydrophobicContact CG2-CE2 4.3Å
217T97.4Very high97.4Very high63 Ų6354.2 Ų54.239%0.38734%0.338SS..  trans-138.451.3-176.458.10000111.4D211 D220 G223 G225D211-T217 PolarHBondContact OD1-N 3.46Å; D211-T217 VanDerWaalsContact OD1-N 3.14Å; T217-D220 HydrophobicContact CG2-CB 4.48Å; T217-G223 PolarHBondContact OG1-O 3.27Å; T217-G225 VanDerWaalsContact O-CA 3.28Å; T217-G225 WeakPolarHBondContact O-CA 3.37Å; T217-G225 PolarHBondContact O-N 3Å
218F98.4Very high97.3Very high87 Ų8755.2 Ų55.238%0.38234%0.343SS..SBendtrans-64.8-40.6176-72.6-75.7000112.1M207 D211 T216 G225 D226M207-F218 HydrophobicContact CB-CB 4.2Å; M207-F218 HydrophobicContact CB-CD2 3.68Å; M207-F218 HydrophobicContact CB-CE2 4.16Å; M207-F218 HydrophobicContact CB-CG 3.89Å; M207-F218 HydrophobicContact CG-CD1 4.04Å; M207-F218 HydrophobicContact CG-CD2 3.75Å; M207-F218 HydrophobicContact CG-CE1 4.08Å; M207-F218 HydrophobicContact CG-CE2 3.8Å; M207-F218 HydrophobicContact CG-CG 3.89Å; M207-F218 HydrophobicContact CG-CZ 3.96Å; M207-F218 HydrophobicContact SD-CD1 3.61Å; M207-F218 HydrophobicContact SD-CD2 4.4Å; M207-F218 HydrophobicContact SD-CE1 3.79Å; M207-F218 HydrophobicContact SD-CG 3.94Å; M207-F218 HydrophobicContact SD-CZ 4.28Å; D211-F218 VanDerWaalsContact CG-N 3.32Å; D211-F218 WeakPolarHBondContact OD1-CD2 3.42Å; D211-F218 PolarHBondContact OD1-N 3.37Å; D211-F218 PolarHBondContact OD2-N 3.07Å; T216-F218 HydrophobicContact CG2-CE2 4.3Å; F218-G225 CarbonylContact O-C 3.6Å; F218-G225 WeakPolarHBondContact O-CA 3.41Å; F218-D226 PolarHBondContact O-N 3.48Å; F218-D226 VanDerWaalsContact O-N 3.08Å
219F98.3Very high97.3Very high2 Ų258.6 Ų58.61%0.00936%0.361CS..SBendtrans-118.8-5.2-173.2-48.3-54.7000113.6P129 M207 L208 D211 P221 P227 L229 Y230 L233P129-F219 HydrophobicContact CB-CB 3.88Å; P129-F219 HydrophobicContact CG-CB 3.56Å; P129-F219 HydrophobicContact CG-CD2 4Å; P129-F219 HydrophobicContact CG-CG 3.81Å; M207-F219 HydrophobicContact CB-CE2 3.66Å; M207-F219 HydrophobicContact CB-CZ 3.68Å; M207-F219 HydrophobicContact CE-CZ 4.48Å; M207-F219 HydrophobicContact SD-CZ 4.42Å; L208-F219 HydrophobicContact CB-CD2 4.32Å; L208-F219 HydrophobicContact CB-CE2 3.99Å; L208-F219 HydrophobicContact CD1-CD2 4.28Å; D211-F219 PolarHBondContact OD2-N 2.96Å; F219-P221 VanDerWaalsContact O-CD 3.31Å; F219-P221 WeakPolarHBondContact O-CD 3.28Å; F219-P227 VanDerWaalsContact O-CD 3.23Å; F219-P227 WeakPolarHBondContact O-CD 3.13Å; F219-P227 VanDerWaalsContact O-CG 3.3Å; F219-P227 WeakPolarHBondContact O-CG 3.41Å; F219-L229 HydrophobicContact CD1-CB 4.41Å; F219-L229 HydrophobicContact CE1-CB 4.33Å; F219-L229 HydrophobicContact CE1-CD2 4.16Å; F219-L229 HydrophobicContact CE1-CG 4.11Å; F219-Y230 HydrophobicContact CD2-CD2 4.1Å; F219-Y230 HydrophobicContact CE1-CD2 4.25Å; F219-Y230 HydrophobicContact CE1-CG 4.47Å; F219-Y230 AromaticContact CE2-CD2 3.62Å; F219-Y230 HydrophobicContact CE2-CD2 3.62Å; F219-Y230 HydrophobicContact CE2-CE2 4.48Å; F219-Y230 HydrophobicContact CE2-CG 4.48Å; F219-Y230 AromaticContact CZ-CD2 3.7Å; F219-Y230 HydrophobicContact CZ-CD2 3.7Å; F219-Y230 HydrophobicContact CZ-CG 4.36Å; F219-L233 HydrophobicContact CE1-CD1 4.27Å; F219-L233 HydrophobicContact CZ-CD1 4.27Å
220D96.3Very high97.3Very high53 Ų5357.4 Ų57.428%0.28335%0.354SS..  trans-86.2112.7177.2-175-3.6000111.4T217 A222 G223 G224 G225T217-D220 HydrophobicContact CG2-CB 4.48Å; D220-A222 PolarHBondContact O-N 3.39Å; D220-A222 WeakPolarHBondContact OD1-CB 3.37Å; D220-A222 PolarHBondContact OD1-N 3.36Å; D220-G223 PolarHBondContact O-N 2.97Å; D220-G224 PolarHBondContact O-N 3.2Å; D220-G225 WeakPolarHBondContact O-CA 3.4Å; D220-G225 PolarHBondContact O-N 3.21Å
221P95.7Very high97.3Very high82 Ų8257.8 Ų57.853%0.53235%0.354SS..G310 helixtrans-59-27.5177.4-2435.6000114.3F219 G223 G224 G225 P227F219-P221 VanDerWaalsContact O-CD 3.31Å; F219-P221 WeakPolarHBondContact O-CD 3.28Å; P221-G223 PolarHBondContact O-N 2.71Å; P221-G224 PolarHBondContact O-N 2.87Å; P221-G224 VanDerWaalsContact O-N 3.08Å; P221-G225 WeakPolarHBondContact CA-O 3.3Å; P221-P227 HydrophobicContact CG-CG 4.09Å
222A94.6Very high97.4Very high93 Ų9359.5 Ų59.577%0.76936%0.361SS*.G310 helixtrans-65.1-26.4177.900000112.4D220D220-A222 PolarHBondContact O-N 3.39Å; D220-A222 WeakPolarHBondContact OD1-CB 3.37Å; D220-A222 PolarHBondContact OD1-N 3.36Å
223G94.6Very high97.4Very high40 Ų4060.9 Ų60.941%0.41237%0.369SS..G310 helixtrans-100.89.4172.900000114.5T217 D220 P221T217-G223 PolarHBondContact OG1-O 3.27Å; D220-G223 PolarHBondContact O-N 2.97Å; P221-G223 PolarHBondContact O-N 2.71Å
224G96.3Very high97.4Very high71 Ų7157.3 Ų57.373%0.73235%0.349SS*.THydrogen-bonded Turntrans85.68.9-17800000115.5D220 P221D220-G224 PolarHBondContact O-N 3.2Å; P221-G224 PolarHBondContact O-N 2.87Å; P221-G224 VanDerWaalsContact O-N 3.08Å
225G97.6Very high97.5Very high15 Ų1552 Ų5216%0.15532%0.321CS..  trans-77.2170.8173.400000113.5T217 F218 D220 P221T217-G225 VanDerWaalsContact O-CA 3.28Å; T217-G225 WeakPolarHBondContact O-CA 3.37Å; T217-G225 PolarHBondContact O-N 3Å; F218-G225 CarbonylContact O-C 3.6Å; F218-G225 WeakPolarHBondContact O-CA 3.41Å; D220-G225 WeakPolarHBondContact O-CA 3.4Å; D220-G225 PolarHBondContact O-N 3.21Å; P221-G225 WeakPolarHBondContact CA-O 3.3Å
226D97.9Very high97.6Very high76 Ų7647.5 Ų47.541%0.40629%0.294SS..  trans-133.9114.2-179-176.44000111.9F218 I228 L229F218-D226 PolarHBondContact O-N 3.48Å; F218-D226 VanDerWaalsContact O-N 3.08Å; D226-I228 PolarHBondContact O-N 3.07Å; D226-I228 VanDerWaalsContact OD1-CB 3.32Å; D226-I228 WeakPolarHBondContact OD1-CB 3.48Å; D226-I228 PolarHBondContact OD1-N 2.84Å; D226-L229 HydrophobicContact CB-CB 4.32Å; D226-L229 VanDerWaalsContact O-CB 3.25Å; D226-L229 WeakPolarHBondContact O-CB 3.47Å; D226-L229 PolarHBondContact O-N 3.5Å
227P97.5Very high97.6Very high26 Ų2645.3 Ų45.317%0.16928%0.281CS..Hα-helixtrans-57.9-26172.9-24.132.8000114.2F219 P221 L229 Y230 Q231F219-P227 VanDerWaalsContact O-CD 3.23Å; F219-P227 WeakPolarHBondContact O-CD 3.13Å; F219-P227 VanDerWaalsContact O-CG 3.3Å; F219-P227 WeakPolarHBondContact O-CG 3.41Å; P221-P227 HydrophobicContact CG-CG 4.09Å; P227-L229 VanDerWaalsContact C-N 3.3Å; P227-Y230 WeakPolarHBondContact O-CB 3.5Å; P227-Y230 PolarHBondContact O-N 3.22Å; P227-Q231 PolarHBondContact O-N 3.49Å
228I98.3Very high97.5Very high56 Ų5642.3 Ų42.329%0.28726%0.262SS..Hα-helixtrans-70.2-30.1177.4-57.7177.2000110.6D226 Y230 Q231 H232 M291 V294D226-I228 PolarHBondContact O-N 3.07Å; D226-I228 VanDerWaalsContact OD1-CB 3.32Å; D226-I228 WeakPolarHBondContact OD1-CB 3.48Å; D226-I228 PolarHBondContact OD1-N 2.84Å; I228-Y230 VanDerWaalsContact C-N 3.28Å; I228-Y230 PolarHBondContact O-N 2.88Å; I228-Q231 WeakPolarHBondContact O-CB 3.37Å; I228-Q231 PolarHBondContact O-N 3.35Å; I228-H232 PolarHBondContact O-CD2 3.4Å; I228-H232 VanDerWaalsContact O-CD2 3.3Å; I228-H232 PolarHBondContact O-N 3.5Å; I228-M291 HydrophobicContact CG2-CE 3.78Å; I228-V294 HydrophobicContact CD1-CB 4.44Å; I228-V294 HydrophobicContact CG2-CG2 4.21Å
229L98.4Very high97.5Very high73 Ų7338.6 Ų38.638%0.38225%0.246SC..Hα-helixtrans-57.5-43.6170.8177.262.4000111F219 D226 P227 Q231 H232 L233F219-L229 HydrophobicContact CD1-CB 4.41Å; F219-L229 HydrophobicContact CE1-CB 4.33Å; F219-L229 HydrophobicContact CE1-CD2 4.16Å; F219-L229 HydrophobicContact CE1-CG 4.11Å; D226-L229 HydrophobicContact CB-CB 4.32Å; D226-L229 VanDerWaalsContact O-CB 3.25Å; D226-L229 WeakPolarHBondContact O-CB 3.47Å; D226-L229 PolarHBondContact O-N 3.5Å; P227-L229 VanDerWaalsContact C-N 3.3Å; L229-Q231 VanDerWaalsContact C-N 3.29Å; L229-Q231 PolarHBondContact O-N 2.95Å; L229-H232 PolarHBondContact O-N 2.99Å; L229-L233 HydrophobicContact CD1-CD1 4.39Å; L229-L233 HydrophobicContact CD1-CG 4.37Å; L229-L233 HydrophobicContact CG-CD1 4.15Å; L229-L233 WeakPolarHBondContact O-CG 3.37Å; L229-L233 PolarHBondContact O-N 2.9Å
230Y98.6Very high97.5Very high2 Ų238.5 Ų38.51%0.00825%0.246CC..Hα-helixtrans-59.4-42.7175.2-176.5-81.7000111T126 V127 Y128 P129 L208 F219 P227 I228 H232 L233 F234T126-Y230 WeakPolarHBondContact O-CE1 3.18Å; T126-Y230 PolarHBondContact O-OH 3.4Å; V127-Y230 PolarHBondContact O-OH 3.44Å; Y128-Y230 AromaticContact CD1-CD1 3.59Å; Y128-Y230 HydrophobicContact CD1-CD1 3.59Å; Y128-Y230 AromaticContact CD1-CE1 3.61Å; Y128-Y230 HydrophobicContact CD1-CE1 3.61Å; Y128-Y230 HydrophobicContact CE1-CD1 4.11Å; Y128-Y230 HydrophobicContact CE1-CE1 4.12Å; P129-Y230 VanDerWaalsContact CD-CG 3.41Å; P129-Y230 HydrophobicContact CG-CD1 4.44Å; P129-Y230 HydrophobicContact CG-CD2 4.15Å; P129-Y230 HydrophobicContact CG-CG 3.84Å; L208-Y230 HydrophobicContact CB-CE2 4.17Å; L208-Y230 HydrophobicContact CD2-CE2 3.95Å; F219-Y230 HydrophobicContact CD2-CD2 4.1Å; F219-Y230 HydrophobicContact CE1-CD2 4.25Å; F219-Y230 HydrophobicContact CE1-CG 4.47Å; F219-Y230 AromaticContact CE2-CD2 3.62Å; F219-Y230 HydrophobicContact CE2-CD2 3.62Å; F219-Y230 HydrophobicContact CE2-CE2 4.48Å; F219-Y230 HydrophobicContact CE2-CG 4.48Å; F219-Y230 AromaticContact CZ-CD2 3.7Å; F219-Y230 HydrophobicContact CZ-CD2 3.7Å; F219-Y230 HydrophobicContact CZ-CG 4.36Å; P227-Y230 WeakPolarHBondContact O-CB 3.5Å; P227-Y230 PolarHBondContact O-N 3.22Å; I228-Y230 VanDerWaalsContact C-N 3.28Å; I228-Y230 PolarHBondContact O-N 2.88Å; Y230-H232 PolarHBondContact O-N 3.31Å; Y230-L233 PolarHBondContact O-N 3.24Å; Y230-F234 HydrophobicContact CD1-CB 4.17Å; Y230-F234 HydrophobicContact CE1-CB 3.81Å; Y230-F234 HydrophobicContact CE1-CD2 4.05Å; Y230-F234 HydrophobicContact CE1-CG 4.15Å; Y230-F234 VanDerWaalsContact O-CB 3.26Å; Y230-F234 WeakPolarHBondContact O-CB 3.35Å; Y230-F234 PolarHBondContact O-N 3.02Å
231Q98.5Very high97.5Very high35 Ų3536 Ų3616%0.16423%0.232CC..Hα-helixtrans-61.5-42.1177.7-61.9-165.133.200112.3Y128 P227 I228 L229 F234 W235 M291Y128-Q231 HydrophobicContact CD1-CG 4.2Å; Y128-Q231 HydrophobicContact CE1-CB 4.46Å; Y128-Q231 HydrophobicContact CE1-CG 3.82Å; Y128-Q231 HydrophobicContact CE2-CG 4.29Å; P227-Q231 PolarHBondContact O-N 3.49Å; I228-Q231 WeakPolarHBondContact O-CB 3.37Å; I228-Q231 PolarHBondContact O-N 3.35Å; L229-Q231 VanDerWaalsContact C-N 3.29Å; L229-Q231 PolarHBondContact O-N 2.95Å; Q231-F234 PolarHBondContact O-N 2.87Å; Q231-W235 WeakPolarHBondContact O-CB 3.49Å; Q231-W235 VanDerWaalsContact O-CD1 3.23Å; Q231-W235 PolarHBondContact O-N 2.74Å; Q231-M291 HydrophobicContact CB-CE 3.61Å; Q231-M291 HydrophobicContact CB-CG 4.42Å; Q231-M291 HydrophobicContact CB-SD 4.07Å
232H98.5Very high97.5Very high66 Ų6633.4 Ų33.431%0.30622%0.215SC..Hα-helixtrans-60-48.9174.8-80.5-76.7000111.6I228 L229 Y230 F236 W287 M291I228-H232 PolarHBondContact O-CD2 3.4Å; I228-H232 VanDerWaalsContact O-CD2 3.3Å; I228-H232 PolarHBondContact O-N 3.5Å; L229-H232 PolarHBondContact O-N 2.99Å; Y230-H232 PolarHBondContact O-N 3.31Å; H232-F236 WeakPolarHBondContact O-CB 3.31Å; H232-F236 PolarHBondContact O-N 3.44Å; H232-W287 AromaticContact ND1-NE1 3.55Å; H232-M291 VanDerWaalsContact CD2-CE 3.46Å; H232-M291 WeakPolarHBondContact CD2-CE 3.21Å; H232-M291 WeakPolarHBondContact NE2-CE 3.28Å
233L98.6Very high97.6Very high35 Ų3530.4 Ų30.418%0.18318%0.184CC..Hα-helixtrans-63-46180-65.9170.3000111.7V200 M207 F219 L229 Y230 F237V200-L233 HydrophobicContact CG1-CB 4.31Å; V200-L233 HydrophobicContact CG1-CD2 3.86Å; M207-L233 HydrophobicContact CE-CD1 3.35Å; F219-L233 HydrophobicContact CE1-CD1 4.27Å; F219-L233 HydrophobicContact CZ-CD1 4.27Å; L229-L233 HydrophobicContact CD1-CD1 4.39Å; L229-L233 HydrophobicContact CD1-CG 4.37Å; L229-L233 HydrophobicContact CG-CD1 4.15Å; L229-L233 WeakPolarHBondContact O-CG 3.37Å; L229-L233 PolarHBondContact O-N 2.9Å; Y230-L233 PolarHBondContact O-N 3.24Å; L233-F237 PolarHBondContact O-N 2.93Å
234F98.7Very high97.7Very high6 Ų628.6 Ų28.63%0.02617%0.165CC..Hα-helixtrans-63-47.5179.8-175.6-87.6000111.1W125 T126 Y128 L201 Y230 Q231 F237 G238W125-F234 HydrophobicContact CD2-CZ 4.34Å; W125-F234 HydrophobicContact CE3-CE1 4.45Å; W125-F234 AromaticContact CE3-CZ 3.75Å; W125-F234 HydrophobicContact CE3-CZ 3.75Å; W125-F234 AromaticContact CH2-CE1 3.93Å; W125-F234 HydrophobicContact CH2-CE1 3.93Å; W125-F234 AromaticContact CH2-CZ 3.97Å; W125-F234 HydrophobicContact CH2-CZ 3.97Å; W125-F234 HydrophobicContact CZ2-CE1 4.33Å; W125-F234 HydrophobicContact CZ3-CE1 4.01Å; W125-F234 AromaticContact CZ3-CZ 3.55Å; W125-F234 HydrophobicContact CZ3-CZ 3.55Å; T126-F234 HydrophobicContact CG2-CD1 4.33Å; T126-F234 HydrophobicContact CG2-CE1 3.71Å; T126-F234 HydrophobicContact CG2-CZ 4.09Å; Y128-F234 HydrophobicContact CE1-CD1 4.47Å; L201-F234 HydrophobicContact CD1-CD2 3.94Å; L201-F234 HydrophobicContact CD1-CE2 4.09Å; Y230-F234 HydrophobicContact CD1-CB 4.17Å; Y230-F234 HydrophobicContact CE1-CB 3.81Å; Y230-F234 HydrophobicContact CE1-CD2 4.05Å; Y230-F234 HydrophobicContact CE1-CG 4.15Å; Y230-F234 VanDerWaalsContact O-CB 3.26Å; Y230-F234 WeakPolarHBondContact O-CB 3.35Å; Y230-F234 PolarHBondContact O-N 3.02Å; Q231-F234 PolarHBondContact O-N 2.87Å; F234-F237 CarbonylContact O-C 3.57Å; F234-F237 WeakPolarHBondContact O-CB 3.14Å; F234-F237 PolarHBondContact O-N 3.49Å; F234-G238 WeakPolarHBondContact O-CA 3.4Å; F234-G238 PolarHBondContact O-N 3.05Å
235W98.6Very high97.6Very high10 Ų1025.2 Ų25.24%0.03813%0.13CC..Hα-helixtrans-76.6-29.1-177.4-73.1126.8000113.7W125 T126 Y128 Q231 F237 G238 H239 W287 H290W125-W235 HydrophobicContact CH2-CH2 4.35Å; W125-W235 HydrophobicContact CH2-CZ3 4.07Å; W125-W235 AromaticContact CZ2-CH2 3.77Å; W125-W235 HydrophobicContact CZ2-CH2 3.77Å; W125-W235 AromaticContact CZ2-CZ3 3.92Å; W125-W235 HydrophobicContact CZ2-CZ3 3.92Å; T126-W235 HydrophobicContact CG2-CH2 4.15Å; T126-W235 HydrophobicContact CG2-CZ2 3.96Å; Y128-W235 AromaticContact CZ-NE1 3.95Å; Y128-W235 WeakPolarHBondContact OH-CZ2 3.44Å; Y128-W235 PolarHBondContact OH-NE1 2.84Å; Q231-W235 WeakPolarHBondContact O-CB 3.49Å; Q231-W235 VanDerWaalsContact O-CD1 3.23Å; Q231-W235 PolarHBondContact O-N 2.74Å; W235-F237 PolarHBondContact O-N 3.26Å; W235-G238 PolarHBondContact O-N 3Å; W235-H239 PolarHBondContact O-N 3.24Å; W235-W287 HydrophobicContact CB-CB 4.26Å; W235-W287 VanDerWaalsContact O-CB 3.27Å; W235-W287 WeakPolarHBondContact O-CB 3.24Å; W235-H290 HydrophobicContact CD2-CB 3.4Å; W235-H290 VanDerWaalsContact CD2-CB 3.4Å; W235-H290 AromaticContact CD2-CD2 3.55Å; W235-H290 AromaticContact CD2-CG 3.55Å; W235-H290 AromaticContact CE2-CG 3.75Å; W235-H290 HydrophobicContact CE3-CB 3.97Å; W235-H290 AromaticContact CE3-CD2 3.24Å; W235-H290 AromaticContact CE3-CG 3.55Å; W235-H290 AromaticContact CE3-NE2 3.64Å; W235-H290 HydrophobicContact CG-CB 3.67Å; W235-H290 HydrophobicContact CH2-CB 4.31Å; W235-H290 AromaticContact CH2-CG 4Å; W235-H290 AromaticContact CH2-ND1 3.89Å; W235-H290 HydrophobicContact CZ2-CB 3.79Å; W235-H290 AromaticContact CZ2-CG 3.99Å; W235-H290 HydrophobicContact CZ3-CB 4.38Å; W235-H290 AromaticContact CZ3-CD2 3.71Å; W235-H290 AromaticContact CZ3-CE1 3.81Å; W235-H290 AromaticContact CZ3-CG 3.78Å; W235-H290 AromaticContact CZ3-ND1 3.85Å; W235-H290 AromaticContact CZ3-NE2 3.71Å
236F98.4Very high97.6Very high60 Ų6025 Ų2526%0.26313%0.125SC..Hα-helixtrans-57-34.7169.9-175-87.1000111.2V200 H232 P240 F284 W287V200-F236 HydrophobicContact CB-CD1 3.95Å; V200-F236 HydrophobicContact CG1-CB 4.33Å; V200-F236 HydrophobicContact CG1-CD1 3.85Å; V200-F236 HydrophobicContact CG1-CG 4.42Å; V200-F236 HydrophobicContact CG2-CD1 3.67Å; V200-F236 HydrophobicContact CG2-CE1 3.76Å; H232-F236 WeakPolarHBondContact O-CB 3.31Å; H232-F236 PolarHBondContact O-N 3.44Å; F236-P240 WeakPolarHBondContact O-CD 3.29Å; F236-P240 WeakPolarHBondContact O-CG 3.38Å; F236-F284 AromaticContact CE1-CD1 3.97Å; F236-F284 HydrophobicContact CE1-CD1 3.97Å; F236-F284 HydrophobicContact CE1-CE1 4.1Å; F236-F284 HydrophobicContact CE2-CD1 4.32Å; F236-F284 AromaticContact CZ-CD1 3.74Å; F236-F284 HydrophobicContact CZ-CD1 3.74Å; F236-F284 HydrophobicContact CZ-CE1 4.29Å; F236-W287 HydrophobicContact CB-CG 4.37Å; F236-W287 HydrophobicContact CD2-CD2 4.07Å; F236-W287 HydrophobicContact CD2-CE3 4.05Å; F236-W287 HydrophobicContact CD2-CZ3 4.33Å; F236-W287 HydrophobicContact CE2-CZ3 4.49Å
237F98.1Very high97.6Very high0 Ų021.3 Ų21.30%011%0.106CC..Hα-helixtrans-76.8-50165.7154.5-101.7000112.5F66 L198 L201 L233 F234 W235 H239 P240 E241F66-F237 HydrophobicContact CE1-CZ 4.02Å; F66-F237 HydrophobicContact CZ-CE1 4.2Å; F66-F237 AromaticContact CZ-CZ 3.9Å; F66-F237 HydrophobicContact CZ-CZ 3.9Å; L198-F237 HydrophobicContact CD2-CD2 4.11Å; L198-F237 HydrophobicContact CD2-CE2 3.51Å; L198-F237 HydrophobicContact CD2-CZ 4.29Å; L198-F237 HydrophobicContact CG-CE2 4.34Å; L201-F237 HydrophobicContact CB-CB 3.88Å; L201-F237 HydrophobicContact CB-CD1 3.86Å; L201-F237 HydrophobicContact CB-CD2 3.94Å; L201-F237 HydrophobicContact CB-CE1 4.43Å; L201-F237 HydrophobicContact CB-CG 3.59Å; L201-F237 HydrophobicContact CD1-CD1 3.77Å; L201-F237 HydrophobicContact CD1-CE1 4.1Å; L201-F237 HydrophobicContact CD1-CG 4.39Å; L201-F237 HydrophobicContact CD2-CD1 3.92Å; L201-F237 HydrophobicContact CD2-CD2 4.36Å; L201-F237 HydrophobicContact CD2-CE1 3.64Å; L201-F237 HydrophobicContact CD2-CE2 4.11Å; L201-F237 HydrophobicContact CD2-CG 4.28Å; L201-F237 HydrophobicContact CD2-CZ 3.73Å; L201-F237 HydrophobicContact CG-CD1 4.05Å; L201-F237 HydrophobicContact CG-CE1 4.26Å; L201-F237 HydrophobicContact CG-CG 4.28Å; L233-F237 PolarHBondContact O-N 2.93Å; F234-F237 CarbonylContact O-C 3.57Å; F234-F237 WeakPolarHBondContact O-CB 3.14Å; F234-F237 PolarHBondContact O-N 3.49Å; W235-F237 PolarHBondContact O-N 3.26Å; F237-H239 VanDerWaalsContact C-N 3.33Å; F237-H239 PolarHBondContact O-N 2.78Å; F237-P240 VanDerWaalsContact O-CD 3.25Å; F237-P240 WeakPolarHBondContact O-CD 3.37Å; F237-E241 HydrophobicContact CD2-CB 4.35Å; F237-E241 HydrophobicContact CE1-CB 4.15Å; F237-E241 HydrophobicContact CE1-CG 4.23Å; F237-E241 HydrophobicContact CE2-CB 3.76Å; F237-E241 HydrophobicContact CE2-CG 3.98Å; F237-E241 WeakPolarHBondContact CE2-OE2 3.35Å; F237-E241 HydrophobicContact CZ-CB 3.65Å; F237-E241 HydrophobicContact CZ-CG 3.54Å; F237-E241 WeakPolarHBondContact O-CB 3.16Å; F237-E241 PolarHBondContact O-N 3.37Å
238G96.6Very high97.7Very high0 Ų020.1 Ų20.10%010%0.097CC..Hα-helixtrans-66.3-30.6-16400000113.9F234 W235 E241 V242F234-G238 WeakPolarHBondContact O-CA 3.4Å; F234-G238 PolarHBondContact O-N 3.05Å; W235-G238 PolarHBondContact O-N 3Å; G238-E241 WeakPolarHBondContact O-CB 3.34Å; G238-V242 PolarHBondContact O-N 3.5Å
239H97.3Very high97.7Very high9 Ų917.4 Ų17.44%0.0428%0.084CC..Hα-helixtrans-76-46.5176-163.379.2000113.2W235 F237 E241 V242 Y243 V286 W287 H289 H290W235-H239 PolarHBondContact O-N 3.24Å; F237-H239 VanDerWaalsContact C-N 3.33Å; F237-H239 PolarHBondContact O-N 2.78Å; H239-E241 PolarHBondContact O-N 2.75Å; H239-V242 WeakPolarHBondContact O-CG2 3.39Å; H239-V242 PolarHBondContact O-N 3.07Å; H239-Y243 AromaticContact CD2-CE2 3.39Å; H239-Y243 WeakPolarHBondContact CD2-CE2 3.28Å; H239-Y243 AromaticContact NE2-CD2 3.97Å; H239-Y243 AromaticContact NE2-CE2 2.98Å; H239-Y243 WeakPolarHBondContact NE2-CE2 3.39Å; H239-Y243 AromaticContact NE2-CZ 3.24Å; H239-Y243 PolarHBondContact NE2-OH 3.21Å; H239-V286 WeakPolarHBondContact CD2-CG2 3.29Å; H239-V286 WeakPolarHBondContact NE2-CG2 3.4Å; H239-W287 HydrophobicContact CB-CB 4.11Å; H239-H289 AromaticContact CE1-CE1 3.01Å; H239-H289 PolarHBondContact CE1-CE1 2.87Å; H239-H289 AromaticContact CE1-NE2 3.21Å; H239-H289 PolarHBondContact CE1-NE2 3.37Å; H239-H289 AromaticContact CG-CE1 3.85Å; H239-H289 AromaticContact CG-NE2 3.89Å; H239-H289 AromaticContact ND1-CE1 3.07Å; H239-H289 PolarHBondContact ND1-CE1 2.94Å; H239-H289 AromaticContact ND1-NE2 2.89Å; H239-H289 PolarHBondContact ND1-NE2 3.29Å; H239-H289 AromaticContact NE2-CE1 3.65Å; H239-H290 AromaticContact ND1-NE2 3.29Å; H239-H290 PolarHBondContact ND1-NE2 2.72Å
240P98Very high97.7Very high0 Ų014.1 Ų14.10%07%0.066CC..Hα-helixtrans-53.2-38.7165-30.436.6000113.7F236 F237 V242 Y243 I244 G283 F284F236-P240 WeakPolarHBondContact O-CD 3.29Å; F236-P240 WeakPolarHBondContact O-CG 3.38Å; F237-P240 VanDerWaalsContact O-CD 3.25Å; F237-P240 WeakPolarHBondContact O-CD 3.37Å; P240-V242 PolarHBondContact O-N 3.01Å; P240-Y243 WeakPolarHBondContact O-CA 3.22Å; P240-Y243 WeakPolarHBondContact O-CB 3.44Å; P240-Y243 PolarHBondContact O-N 3.49Å; P240-I244 WeakPolarHBondContact O-CG1 3.47Å; P240-I244 PolarHBondContact O-N 3.41Å; P240-G283 WeakPolarHBondContact CD-O 3.36Å; P240-F284 HydrophobicContact CB-CE1 4.09Å; P240-F284 HydrophobicContact CB-CZ 4.2Å; P240-F284 HydrophobicContact CG-CD1 3.65Å; P240-F284 HydrophobicContact CG-CE1 3.61Å; P240-F284 HydrophobicContact CG-CG 4.22Å; P240-F284 HydrophobicContact CG-CZ 4.16Å
241E97.1Very high97.7Very high1 Ų114 Ų141%0.0057%0.066CC..Hα-helixtrans-58.2-45.8177.4-17759.6-155.700111.8M70 F237 G238 H239 Y243 I244 L245M70-E241 WeakPolarHBondContact CE-OE1 3.4Å; F237-E241 HydrophobicContact CD2-CB 4.35Å; F237-E241 HydrophobicContact CE1-CB 4.15Å; F237-E241 HydrophobicContact CE1-CG 4.23Å; F237-E241 HydrophobicContact CE2-CB 3.76Å; F237-E241 HydrophobicContact CE2-CG 3.98Å; F237-E241 WeakPolarHBondContact CE2-OE2 3.35Å; F237-E241 HydrophobicContact CZ-CB 3.65Å; F237-E241 HydrophobicContact CZ-CG 3.54Å; F237-E241 WeakPolarHBondContact O-CB 3.16Å; F237-E241 PolarHBondContact O-N 3.37Å; G238-E241 WeakPolarHBondContact O-CB 3.34Å; H239-E241 PolarHBondContact O-N 2.75Å; E241-Y243 PolarHBondContact O-N 2.89Å; E241-Y243 VanDerWaalsContact O-N 3.12Å; E241-I244 WeakPolarHBondContact O-CA 3.41Å; E241-I244 VanDerWaalsContact O-CB 3.28Å; E241-I244 WeakPolarHBondContact O-CB 3.45Å; E241-I244 PolarHBondContact O-N 2.76Å; E241-I244 WeakPolarHBondContact OE2-CD1 3.49Å; E241-L245 VanDerWaalsContact O-CG 3.3Å; E241-L245 WeakPolarHBondContact O-CG 3.35Å; E241-L245 PolarHBondContact O-N 3.3Å
242V95.6Very high97.7Very high28 Ų2812.3 Ų12.317%0.176%0.058CC..Hα-helixtrans-63.6-24177.8-58.50000113G238 H239 P240 F376G238-V242 PolarHBondContact O-N 3.5Å; H239-V242 WeakPolarHBondContact O-CG2 3.39Å; H239-V242 PolarHBondContact O-N 3.07Å; P240-V242 PolarHBondContact O-N 3.01Å; V242-F376 HydrophobicContact CB-CE2 4.33Å; V242-F376 HydrophobicContact CG1-CE2 3.58Å; V242-F376 HydrophobicContact CG1-CZ 4.14Å
243Y96.5Very high97.7Very high30 Ų309.2 Ų9.212%0.1184%0.044CC..Hα-helixtrans-78.4-37.8170.1-68.8-50.3000113.6H239 P240 E241 L245 I246 L247 I279 I311H239-Y243 AromaticContact CD2-CE2 3.39Å; H239-Y243 WeakPolarHBondContact CD2-CE2 3.28Å; H239-Y243 AromaticContact NE2-CD2 3.97Å; H239-Y243 AromaticContact NE2-CE2 2.98Å; H239-Y243 WeakPolarHBondContact NE2-CE2 3.39Å; H239-Y243 AromaticContact NE2-CZ 3.24Å; H239-Y243 PolarHBondContact NE2-OH 3.21Å; P240-Y243 WeakPolarHBondContact O-CA 3.22Å; P240-Y243 WeakPolarHBondContact O-CB 3.44Å; P240-Y243 PolarHBondContact O-N 3.49Å; E241-Y243 PolarHBondContact O-N 2.89Å; E241-Y243 VanDerWaalsContact O-N 3.12Å; Y243-L245 PolarHBondContact O-N 3.41Å; Y243-I246 HydrophobicContact CD1-CG2 4.15Å; Y243-I246 PolarHBondContact O-N 2.87Å; Y243-L247 WeakPolarHBondContact O-CB 3.48Å; Y243-L247 VanDerWaalsContact O-CG 3.29Å; Y243-L247 WeakPolarHBondContact O-CG 3.35Å; Y243-L247 PolarHBondContact O-N 2.87Å; Y243-I279 HydrophobicContact CD1-CG2 3.48Å; Y243-I279 VanDerWaalsContact CD1-CG2 3.48Å; Y243-I279 HydrophobicContact CD2-CG2 4.29Å; Y243-I279 HydrophobicContact CE1-CG2 3.75Å; Y243-I279 HydrophobicContact CE2-CG2 4.47Å; Y243-I279 HydrophobicContact CG-CG2 3.82Å; Y243-I311 HydrophobicContact CE1-CG2 4.35Å; Y243-I311 HydrophobicContact CE2-CD1 4.14Å; Y243-I311 WeakPolarHBondContact OH-CD1 3.36Å; Y243-I311 WeakPolarHBondContact OH-CG2 3.17Å
244I96.6Very high97.6Very high1 Ų17.6 Ų7.61%0.0054%0.035CC..Hα-helixtrans-52.5-39169.9-72.7157.3000109.9M70 T190 L193 L194 P240 E241 I246 P248M70-I244 HydrophobicContact CG-CG2 4.49Å; M70-I244 HydrophobicContact SD-CG2 4.42Å; T190-I244 HydrophobicContact CG2-CB 3.9Å; T190-I244 HydrophobicContact CG2-CG1 3.97Å; T190-I244 HydrophobicContact CG2-CG2 3.59Å; L193-I244 HydrophobicContact CB-CD1 3.73Å; L193-I244 HydrophobicContact CB-CG1 3.55Å; L193-I244 HydrophobicContact CD1-CG1 4.02Å; L193-I244 HydrophobicContact CG-CG1 4.42Å; L194-I244 HydrophobicContact CB-CD1 4.46Å; L194-I244 HydrophobicContact CD1-CG2 4.33Å; L194-I244 HydrophobicContact CD2-CD1 3.73Å; L194-I244 HydrophobicContact CD2-CG1 4.35Å; L194-I244 HydrophobicContact CD2-CG2 3.81Å; L194-I244 HydrophobicContact CG-CD1 3.8Å; L194-I244 HydrophobicContact CG-CG1 4.09Å; L194-I244 HydrophobicContact CG-CG2 3.96Å; P240-I244 WeakPolarHBondContact O-CG1 3.47Å; P240-I244 PolarHBondContact O-N 3.41Å; E241-I244 WeakPolarHBondContact O-CA 3.41Å; E241-I244 VanDerWaalsContact O-CB 3.28Å; E241-I244 WeakPolarHBondContact O-CB 3.45Å; E241-I244 PolarHBondContact O-N 2.76Å; E241-I244 WeakPolarHBondContact OE2-CD1 3.49Å; I244-I246 VanDerWaalsContact C-N 3.34Å; I244-I246 PolarHBondContact O-N 3.21Å; I244-P248 WeakPolarHBondContact O-CD 3.21Å
245L95Very high97.5Very high1 Ų18.2 Ų8.21%0.0054%0.038CC..THydrogen-bonded Turntrans-75.1-9.8178.5-58.9176.5000115.1I65 V69 M70 M73 E241 Y243 L380 A384I65-L245 HydrophobicContact CG1-CD1 4.31Å; I65-L245 HydrophobicContact CG2-CD1 3.8Å; I65-L245 HydrophobicContact CG2-CD2 4.29Å; V69-L245 HydrophobicContact CB-CD2 4.32Å; V69-L245 HydrophobicContact CG1-CB 4.39Å; V69-L245 HydrophobicContact CG1-CD2 3.79Å; M70-L245 HydrophobicContact CG-CD2 3.57Å; M73-L245 VanDerWaalsContact CE-C 3.5Å; M73-L245 WeakPolarHBondContact CE-O 3.44Å; E241-L245 VanDerWaalsContact O-CG 3.3Å; E241-L245 WeakPolarHBondContact O-CG 3.35Å; E241-L245 PolarHBondContact O-N 3.3Å; Y243-L245 PolarHBondContact O-N 3.41Å; L245-L380 HydrophobicContact CB-CD1 3.88Å; L245-L380 HydrophobicContact CD1-CD1 3.39Å; L245-L380 HydrophobicContact CG-CD1 4.24Å; L245-A384 WeakPolarHBondContact O-CB 3.48Å
246I97.6Very high97.4Very high9 Ų97.7 Ų7.75%0.0464%0.036CC..THydrogen-bonded Turntrans-123.4-27.9-177.1-161.762.4000114.1Y243 I244 G249 F250 F343 F347Y243-I246 HydrophobicContact CD1-CG2 4.15Å; Y243-I246 PolarHBondContact O-N 2.87Å; I244-I246 VanDerWaalsContact C-N 3.34Å; I244-I246 PolarHBondContact O-N 3.21Å; I246-G249 CarbonylContact O-C 3.58Å; I246-G249 VanDerWaalsContact O-CA 3.3Å; I246-G249 WeakPolarHBondContact O-CA 3.21Å; I246-G249 PolarHBondContact O-N 3.07Å; I246-F250 HydrophobicContact CD1-CE1 4.39Å; I246-F250 HydrophobicContact CG1-CD1 4.16Å; I246-F250 HydrophobicContact CG1-CE1 3.59Å; I246-F250 HydrophobicContact CG1-CE2 4.44Å; I246-F250 HydrophobicContact CG1-CZ 3.75Å; I246-F250 HydrophobicContact CG2-CE2 4.05Å; I246-F250 HydrophobicContact CG2-CZ 4Å; I246-F250 PolarHBondContact O-N 3.41Å; I246-F343 HydrophobicContact CD1-CE2 3.9Å; I246-F343 HydrophobicContact CD1-CZ 4.24Å; I246-F347 HydrophobicContact CD1-CD2 4.18Å; I246-F347 HydrophobicContact CD1-CE2 4Å; I246-F347 HydrophobicContact CG1-CD2 4.37Å; I246-F347 HydrophobicContact CG1-CE2 3.71Å; I246-F347 HydrophobicContact CG1-CZ 4.27Å
247L98.2Very high97.3Very high0 Ų05 Ų50%03%0.025CC..Hα-helixtrans-56.8-47.5-178.9-74.9172.1000112.4S186 I189 T190 L193 Y243 G249 F250 G251 M276 I279S186-L247 WeakPolarHBondContact CB-O 3.46Å; I189-L247 HydrophobicContact CB-CD1 4.37Å; I189-L247 HydrophobicContact CG2-CD1 3.69Å; T190-L247 WeakPolarHBondContact OG1-CB 3.43Å; L193-L247 HydrophobicContact CD1-CD1 3.7Å; Y243-L247 WeakPolarHBondContact O-CB 3.48Å; Y243-L247 VanDerWaalsContact O-CG 3.29Å; Y243-L247 WeakPolarHBondContact O-CG 3.35Å; Y243-L247 PolarHBondContact O-N 2.87Å; L247-G249 PolarHBondContact O-N 3.46Å; L247-F250 HydrophobicContact CD2-CD2 3.94Å; L247-F250 HydrophobicContact CD2-CE2 4.27Å; L247-F250 VanDerWaalsContact O-CB 3.32Å; L247-F250 WeakPolarHBondContact O-CB 3.23Å; L247-F250 PolarHBondContact O-N 2.79Å; L247-G251 PolarHBondContact O-N 3.39Å; L247-G251 VanDerWaalsContact O-N 3.07Å; L247-M276 HydrophobicContact CD2-CB 4.29Å; L247-M276 HydrophobicContact CD2-CG 4.29Å; L247-I279 HydrophobicContact CD2-CB 4.49Å; L247-I279 HydrophobicContact CD2-CG2 4.14Å
248P98.4Very high97.1Very high0 Ų05.8 Ų5.80%03%0.029CC..Hα-helixtrans-60-35.7174.5-23.836.1000112.4M73 I74 F183 S186 T190 I244 F250 G251 M252M73-P248 HydrophobicContact CB-CB 4.08Å; M73-P248 HydrophobicContact CB-CG 4.44Å; M73-P248 HydrophobicContact SD-CB 4.23Å; I74-P248 HydrophobicContact CD1-CB 4.34Å; I74-P248 HydrophobicContact CD1-CG 3.45Å; I74-P248 VanDerWaalsContact CD1-CG 3.45Å; I74-P248 HydrophobicContact CG1-CG 4.21Å; F183-P248 HydrophobicContact CE2-CB 4.29Å; S186-P248 WeakPolarHBondContact OG-CA 3.3Å; T190-P248 HydrophobicContact CG2-CG 4.31Å; T190-P248 WeakPolarHBondContact OG1-CD 3.33Å; I244-P248 WeakPolarHBondContact O-CD 3.21Å; P248-F250 PolarHBondContact O-N 3.18Å; P248-G251 WeakPolarHBondContact O-CA 3.34Å; P248-G251 PolarHBondContact O-N 3.13Å; P248-G251 VanDerWaalsContact O-N 3.12Å; P248-M252 WeakPolarHBondContact O-CG 3.3Å; P248-M252 PolarHBondContact O-N 3.09Å
249G98.1Very high96.9Very high0 Ų07.6 Ų7.60%04%0.036CC..Hα-helixtrans-57.4-47.2172.300000111.9I246 L247 G251 M252 I253 A387I246-G249 CarbonylContact O-C 3.58Å; I246-G249 VanDerWaalsContact O-CA 3.3Å; I246-G249 WeakPolarHBondContact O-CA 3.21Å; I246-G249 PolarHBondContact O-N 3.07Å; L247-G249 PolarHBondContact O-N 3.46Å; G249-G251 VanDerWaalsContact C-N 3.27Å; G249-G251 PolarHBondContact O-N 3.06Å; G249-M252 PolarHBondContact O-N 3.33Å; G249-M252 VanDerWaalsContact O-N 3.16Å; G249-I253 VanDerWaalsContact O-CG1 3.28Å; G249-I253 WeakPolarHBondContact O-CG1 3.32Å; G249-I253 PolarHBondContact O-N 3.1Å; G249-A387 VanDerWaalsContact CA-CB 3.48Å
250F98.4Very high96.7Very high3 Ų38.6 Ų8.61%0.0134%0.04CC..Hα-helixtrans-58.9-38.7173.6-61.6-23.4000113I246 L247 P248 S254 I279 K318 W322 F343 F347I246-F250 HydrophobicContact CD1-CE1 4.39Å; I246-F250 HydrophobicContact CG1-CD1 4.16Å; I246-F250 HydrophobicContact CG1-CE1 3.59Å; I246-F250 HydrophobicContact CG1-CE2 4.44Å; I246-F250 HydrophobicContact CG1-CZ 3.75Å; I246-F250 HydrophobicContact CG2-CE2 4.05Å; I246-F250 HydrophobicContact CG2-CZ 4Å; I246-F250 PolarHBondContact O-N 3.41Å; L247-F250 HydrophobicContact CD2-CD2 3.94Å; L247-F250 HydrophobicContact CD2-CE2 4.27Å; L247-F250 VanDerWaalsContact O-CB 3.32Å; L247-F250 WeakPolarHBondContact O-CB 3.23Å; L247-F250 PolarHBondContact O-N 2.79Å; P248-F250 PolarHBondContact O-N 3.18Å; F250-S254 WeakPolarHBondContact O-CB 3.32Å; F250-S254 PolarHBondContact O-N 3.47Å; F250-S254 VanDerWaalsContact O-N 3.08Å; F250-S254 PolarHBondContact O-OG 2.65Å; F250-I279 HydrophobicContact CE2-CD1 4.07Å; F250-K318 VanDerWaalsContact CB-CE 3.42Å; F250-K318 HydrophobicContact CD2-CD 4.03Å; F250-K318 HydrophobicContact CE2-CD 4.4Å; F250-W322 HydrophobicContact CB-CH2 4.1Å; F250-W322 HydrophobicContact CB-CZ2 3.89Å; F250-W322 AromaticContact CD1-CH2 3.42Å; F250-W322 HydrophobicContact CD1-CH2 3.42Å; F250-W322 VanDerWaalsContact CD1-CH2 3.42Å; F250-W322 HydrophobicContact CD1-CZ2 4.07Å; F250-W322 HydrophobicContact CD1-CZ3 4.42Å; F250-W322 AromaticContact CE1-CH2 3.97Å; F250-W322 HydrophobicContact CE1-CH2 3.97Å; F250-W322 AromaticContact CG-CH2 3.89Å; F250-W322 HydrophobicContact CG-CH2 3.89Å; F250-W322 HydrophobicContact CG-CZ2 4.21Å; F250-F343 HydrophobicContact CD1-CE1 4.17Å; F250-F343 AromaticContact CD1-CZ 3.64Å; F250-F343 HydrophobicContact CD1-CZ 3.64Å; F250-F343 HydrophobicContact CE1-CE1 4.37Å; F250-F343 AromaticContact CE1-CZ 3.75Å; F250-F343 HydrophobicContact CE1-CZ 3.75Å; F250-F347 HydrophobicContact CE1-CD1 4.24Å; F250-F347 AromaticContact CE1-CE1 3.68Å; F250-F347 HydrophobicContact CE1-CE1 3.68Å; F250-F347 HydrophobicContact CE1-CE2 4.1Å; F250-F347 AromaticContact CE1-CZ 3.62Å; F250-F347 HydrophobicContact CE1-CZ 3.62Å; F250-F347 AromaticContact CZ-CE1 3.76Å; F250-F347 HydrophobicContact CZ-CE1 3.76Å; F250-F347 HydrophobicContact CZ-CE2 4.22Å; F250-F347 AromaticContact CZ-CZ 3.47Å; F250-F347 HydrophobicContact CZ-CZ 3.47Å; F250-F347 VanDerWaalsContact CZ-CZ 3.47Å
251G98.1Very high96.5Very high0 Ų09 Ų90%04%0.043CC..Hα-helixtrans-58.4-53.4172.400000111.7L247 P248 G249 I253 S254 H255L247-G251 PolarHBondContact O-N 3.39Å; L247-G251 VanDerWaalsContact O-N 3.07Å; P248-G251 WeakPolarHBondContact O-CA 3.34Å; P248-G251 PolarHBondContact O-N 3.13Å; P248-G251 VanDerWaalsContact O-N 3.12Å; G249-G251 VanDerWaalsContact C-N 3.27Å; G249-G251 PolarHBondContact O-N 3.06Å; G251-I253 PolarHBondContact O-N 3.42Å; G251-S254 WeakPolarHBondContact O-CB 3.42Å; G251-S254 PolarHBondContact O-N 3.15Å; G251-H255 PolarHBondContact O-CD2 3.27Å; G251-H255 PolarHBondContact O-N 2.98Å; G251-H255 VanDerWaalsContact O-N 3.15Å
252M98.5Very high96.1Very high0 Ų011.9 Ų11.90%07%0.073CC..Hα-helixtrans-59.8-47.4-179-68.2-171.4-77.900112.4M73 F77 F183 P248 G249 S254 H255 I256 A387 W395M73-M252 HydrophobicContact CG-CE 3.92Å; M73-M252 HydrophobicContact SD-CE 3.85Å; F77-M252 HydrophobicContact CB-SD 4.48Å; F77-M252 HydrophobicContact CD1-SD 4.21Å; F77-M252 HydrophobicContact CD2-CE 4.38Å; F77-M252 HydrophobicContact CD2-SD 3.7Å; F77-M252 HydrophobicContact CE1-SD 4.39Å; F77-M252 HydrophobicContact CE2-SD 3.89Å; F77-M252 HydrophobicContact CG-SD 3.88Å; F77-M252 HydrophobicContact CZ-SD 4.24Å; F183-M252 HydrophobicContact CD2-CG 3.72Å; F183-M252 HydrophobicContact CE2-CG 3.62Å; F183-M252 HydrophobicContact CE2-SD 4.44Å; P248-M252 WeakPolarHBondContact O-CG 3.3Å; P248-M252 PolarHBondContact O-N 3.09Å; G249-M252 PolarHBondContact O-N 3.33Å; G249-M252 VanDerWaalsContact O-N 3.16Å; M252-S254 VanDerWaalsContact C-N 3.27Å; M252-S254 PolarHBondContact O-N 2.94Å; M252-H255 PolarHBondContact O-N 3.19Å; M252-H255 VanDerWaalsContact O-N 3.16Å; M252-I256 WeakPolarHBondContact O-CG1 3.29Å; M252-I256 PolarHBondContact O-N 3.37Å; M252-A387 HydrophobicContact CE-CB 3.99Å; M252-W395 HydrophobicContact CB-CH2 4.14Å; M252-W395 HydrophobicContact CB-CZ3 3.97Å; M252-W395 HydrophobicContact CG-CH2 4.01Å; M252-W395 HydrophobicContact CG-CZ3 3.67Å; M252-W395 HydrophobicContact SD-CZ3 4.04Å
253I98.5Very high95.8Very high0 Ų013.8 Ų13.80%08%0.079CC..Hα-helixtrans-61-38.3177.8-64.4-54.2000111.3G249 G251 H255 I256 V257 W322 A340 F343 I344 A387G249-I253 VanDerWaalsContact O-CG1 3.28Å; G249-I253 WeakPolarHBondContact O-CG1 3.32Å; G249-I253 PolarHBondContact O-N 3.1Å; G251-I253 PolarHBondContact O-N 3.42Å; I253-H255 VanDerWaalsContact C-N 3.33Å; I253-H255 PolarHBondContact O-N 2.85Å; I253-I256 HydrophobicContact CD1-CD1 4.41Å; I253-I256 PolarHBondContact O-N 3.46Å; I253-V257 HydrophobicContact CG2-CG2 4.11Å; I253-V257 VanDerWaalsContact O-CB 3.32Å; I253-V257 WeakPolarHBondContact O-CB 3.44Å; I253-V257 VanDerWaalsContact O-CG2 3.26Å; I253-V257 WeakPolarHBondContact O-CG2 3.49Å; I253-V257 PolarHBondContact O-N 3.39Å; I253-W322 HydrophobicContact CB-CZ2 4.48Å; I253-W322 HydrophobicContact CG2-CD2 4.05Å; I253-W322 HydrophobicContact CG2-CG 4.34Å; I253-W322 HydrophobicContact CG2-CZ2 4.31Å; I253-A340 HydrophobicContact CD1-CB 4.01Å; I253-A340 HydrophobicContact CG2-CB 4.46Å; I253-F343 HydrophobicContact CB-CD1 4.25Å; I253-F343 HydrophobicContact CB-CE1 4.33Å; I253-F343 HydrophobicContact CD1-CB 3.97Å; I253-F343 HydrophobicContact CD1-CD1 4.12Å; I253-F343 HydrophobicContact CD1-CD2 4.4Å; I253-F343 HydrophobicContact CD1-CG 3.9Å; I253-F343 HydrophobicContact CG1-CB 4.34Å; I253-F343 HydrophobicContact CG1-CD1 3.55Å; I253-F343 HydrophobicContact CG1-CD2 4.12Å; I253-F343 HydrophobicContact CG1-CE1 3.82Å; I253-F343 HydrophobicContact CG1-CE2 4.32Å; I253-F343 HydrophobicContact CG1-CG 3.73Å; I253-F343 HydrophobicContact CG1-CZ 4.2Å; I253-F343 HydrophobicContact CG2-CD1 3.95Å; I253-F343 HydrophobicContact CG2-CE1 4.25Å; I253-I344 HydrophobicContact CG2-CD1 4.48Å; I253-I344 HydrophobicContact CG2-CG1 4.33Å; I253-A387 HydrophobicContact CD1-CB 4.21Å; I253-A387 HydrophobicContact CG1-CB 4.15Å
254S97.7Very high95.3Very high2 Ų220.5 Ų20.51%0.01411%0.109CC..Hα-helixtrans-64.2-38.1177.3-53.40000112.6F250 G251 M252 T258 M272 W322F250-S254 WeakPolarHBondContact O-CB 3.32Å; F250-S254 PolarHBondContact O-N 3.47Å; F250-S254 VanDerWaalsContact O-N 3.08Å; F250-S254 PolarHBondContact O-OG 2.65Å; G251-S254 WeakPolarHBondContact O-CB 3.42Å; G251-S254 PolarHBondContact O-N 3.15Å; M252-S254 VanDerWaalsContact C-N 3.27Å; M252-S254 PolarHBondContact O-N 2.94Å; S254-T258 VanDerWaalsContact O-CB 3.3Å; S254-T258 WeakPolarHBondContact O-CB 3.43Å; S254-T258 PolarHBondContact O-N 3.39Å; S254-T258 VanDerWaalsContact O-N 3.14Å; S254-T258 PolarHBondContact O-OG1 2.96Å; S254-M272 VanDerWaalsContact OG-CE 3.24Å; S254-M272 WeakPolarHBondContact OG-CE 3.41Å; S254-W322 PolarHBondContact OG-NE1 3.28Å
255H95.9Very high94.9Very high18 Ų1826.6 Ų26.68%0.08314%0.137CC..Hα-helixtrans-68.3-48.3174.8-84.6-102.4000111.6P181 F183 G251 M252 I253 V257 T258 Y259 W395P181-H255 WeakPolarHBondContact CB-NE2 3.29Å; F183-H255 WeakPolarHBondContact CB-NE2 3.09Å; F183-H255 PolarHBondContact N-NE2 2.72Å; G251-H255 PolarHBondContact O-CD2 3.27Å; G251-H255 PolarHBondContact O-N 2.98Å; G251-H255 VanDerWaalsContact O-N 3.15Å; M252-H255 PolarHBondContact O-N 3.19Å; M252-H255 VanDerWaalsContact O-N 3.16Å; I253-H255 VanDerWaalsContact C-N 3.33Å; I253-H255 PolarHBondContact O-N 2.85Å; H255-V257 PolarHBondContact O-N 3.46Å; H255-T258 PolarHBondContact O-N 2.87Å; H255-Y259 VanDerWaalsContact O-CB 3.24Å; H255-Y259 WeakPolarHBondContact O-CB 3.42Å; H255-Y259 PolarHBondContact O-N 3.34Å; H255-W395 HydrophobicContact CB-CH2 4.07Å; H255-W395 HydrophobicContact CB-CZ2 3.97Å
256I96.3Very high94.9Very high0 Ų027.1 Ų27.10%014%0.141CC..Hα-helixtrans-59.8-49.4-179.7-65.2164.4000110.5M252 I253 T258 Y259 Y260 A336 A340 H394M252-I256 WeakPolarHBondContact O-CG1 3.29Å; M252-I256 PolarHBondContact O-N 3.37Å; I253-I256 HydrophobicContact CD1-CD1 4.41Å; I253-I256 PolarHBondContact O-N 3.46Å; I256-T258 PolarHBondContact O-N 2.95Å; I256-Y259 PolarHBondContact O-N 3.36Å; I256-Y260 HydrophobicContact CG2-CD2 3.81Å; I256-Y260 HydrophobicContact CG2-CE2 4.08Å; I256-Y260 VanDerWaalsContact O-CD2 3.29Å; I256-Y260 WeakPolarHBondContact O-CD2 3.24Å; I256-Y260 PolarHBondContact O-N 3.3Å; I256-A336 HydrophobicContact CG2-CB 4.08Å; I256-A340 HydrophobicContact CG2-CB 3.9Å; I256-H394 HydrophobicContact CD1-CB 4.46Å; I256-H394 HydrophobicContact CG1-CB 4.06Å
257V96.4Very high94.8Very high3 Ų333 Ų332%0.01817%0.166CC..Hα-helixtrans-59.5-48.4179.61670000110.6I253 H255 S261 T325 L326 A340 I344I253-V257 HydrophobicContact CG2-CG2 4.11Å; I253-V257 VanDerWaalsContact O-CB 3.32Å; I253-V257 WeakPolarHBondContact O-CB 3.44Å; I253-V257 VanDerWaalsContact O-CG2 3.26Å; I253-V257 WeakPolarHBondContact O-CG2 3.49Å; I253-V257 PolarHBondContact O-N 3.39Å; H255-V257 PolarHBondContact O-N 3.46Å; V257-S261 VanDerWaalsContact O-CB 3.22Å; V257-S261 WeakPolarHBondContact O-CB 3.26Å; V257-S261 PolarHBondContact O-N 3.2Å; V257-S261 PolarHBondContact O-OG 3.3Å; V257-T325 HydrophobicContact CG1-CG2 3.74Å; V257-L326 HydrophobicContact CG1-CD2 3.79Å; V257-L326 HydrophobicContact CG1-CG 3.75Å; V257-L326 HydrophobicContact CG2-CD2 4.46Å; V257-A340 HydrophobicContact CG2-CB 4.15Å; V257-I344 HydrophobicContact CG2-CD1 4.28Å
258T94.1Very high94.7Very high16 Ų1634.8 Ų34.810%0.09819%0.185CC..Hα-helixtrans-62.1-47.7-180-56.20000111.8S254 H255 I256 S261 G262 K263S254-T258 VanDerWaalsContact O-CB 3.3Å; S254-T258 WeakPolarHBondContact O-CB 3.43Å; S254-T258 PolarHBondContact O-N 3.39Å; S254-T258 VanDerWaalsContact O-N 3.14Å; S254-T258 PolarHBondContact O-OG1 2.96Å; H255-T258 PolarHBondContact O-N 2.87Å; I256-T258 PolarHBondContact O-N 2.95Å; T258-S261 PolarHBondContact O-N 3.38Å; T258-G262 PolarHBondContact O-N 2.93Å; T258-K263 WeakPolarHBondContact CG2-O 3.3Å; T258-K263 PolarHBondContact O-N 2.91Å
259Y93.3Very high94.6Very high38 Ų3836.3 Ų36.315%0.14919%0.191CC..Hα-helixtrans-58.4-52.9-178.4-174.9-91.3000111.8H255 I256 S261 G262 H394 E485H255-Y259 VanDerWaalsContact O-CB 3.24Å; H255-Y259 WeakPolarHBondContact O-CB 3.42Å; H255-Y259 PolarHBondContact O-N 3.34Å; I256-Y259 PolarHBondContact O-N 3.36Å; Y259-S261 VanDerWaalsContact C-N 3.35Å; Y259-S261 PolarHBondContact O-N 2.82Å; Y259-G262 PolarHBondContact O-N 3.47Å; Y259-G262 VanDerWaalsContact O-N 3.15Å; Y259-H394 AromaticContact CD1-CE1 3.75Å; Y259-H394 AromaticContact CG-CE1 3.71Å; Y259-E485 WeakPolarHBondContact CE2-O 3.37Å; Y259-E485 PolarHBondContact OH-N 3.43Å; Y259-E485 PolarHBondContact OH-O 3.05Å
260Y93.1Very high94.5Very high31 Ų3140 Ų4012%0.12221%0.208CC..Hα-helixtrans-80.1-14.8-175.7-72-77.5000114.3I256 G262 K332 S334 A336 V337 H394I256-Y260 HydrophobicContact CG2-CD2 3.81Å; I256-Y260 HydrophobicContact CG2-CE2 4.08Å; I256-Y260 VanDerWaalsContact O-CD2 3.29Å; I256-Y260 WeakPolarHBondContact O-CD2 3.24Å; I256-Y260 PolarHBondContact O-N 3.3Å; Y260-G262 VanDerWaalsContact C-N 3.3Å; Y260-K332 HydrophobicContact CD1-CB 4.1Å; Y260-K332 PolarHBondContact O-N 2.61Å; Y260-S334 WeakPolarHBondContact CD1-OG 3.39Å; Y260-S334 VanDerWaalsContact CE1-CB 3.43Å; Y260-S334 WeakPolarHBondContact CE1-OG 3.38Å; Y260-A336 HydrophobicContact CD2-CB 4.46Å; Y260-A336 HydrophobicContact CE2-CB 3.61Å; Y260-V337 HydrophobicContact CD1-CG2 4.03Å; Y260-V337 HydrophobicContact CD2-CG2 3.7Å; Y260-V337 HydrophobicContact CG-CG2 3.39Å; Y260-H394 AromaticContact CE2-ND1 3.82Å
261S92.4Very high94.5Very high8 Ų841.3 Ų41.36%0.05622%0.224CC..Hα-helixtrans-79.8-10.3166.8-690000113.3V257 T258 Y259 K263 S329 M331V257-S261 VanDerWaalsContact O-CB 3.22Å; V257-S261 WeakPolarHBondContact O-CB 3.26Å; V257-S261 PolarHBondContact O-N 3.2Å; V257-S261 PolarHBondContact O-OG 3.3Å; T258-S261 PolarHBondContact O-N 3.38Å; Y259-S261 VanDerWaalsContact C-N 3.35Å; Y259-S261 PolarHBondContact O-N 2.82Å; S261-K263 PolarHBondContact O-N 2.71Å; S261-S329 WeakPolarHBondContact O-CB 3.38Å; S261-S329 PolarHBondContact OG-OG 3.47Å; S261-M331 PolarHBondContact OG-SD 3.33Å
262G88.8Confident94.5Very high61 Ų6141.3 Ų41.363%0.62922%0.224SC*.THydrogen-bonded Turntrans64.619.9-17600000113.7T258 Y259 Y260T258-G262 PolarHBondContact O-N 2.93Å; Y259-G262 PolarHBondContact O-N 3.47Å; Y259-G262 VanDerWaalsContact O-N 3.15Å; Y260-G262 VanDerWaalsContact C-N 3.3Å
263K88.9Confident94.5Very high68 Ų6841.3 Ų41.330%0.29622%0.224SC..  trans-88.9148.9176.4-69.9-174.1178.5173.30109T258 S261 A324 T325 H327T258-K263 WeakPolarHBondContact CG2-O 3.3Å; T258-K263 PolarHBondContact O-N 2.91Å; S261-K263 PolarHBondContact O-N 2.71Å; K263-A324 PolarHBondContact NZ-O 3.1Å; K263-A324 VanDerWaalsContact NZ-O 3.15Å; K263-T325 HydrophobicContact CD-CG2 4.06Å; K263-T325 VanDerWaalsContact CD-O 3.28Å; K263-T325 WeakPolarHBondContact CD-O 3.41Å; K263-T325 WeakPolarHBondContact CE-O 3.35Å; K263-T325 PolarHBondContact NZ-O 2.97Å; K263-H327 PolarHBondContact NZ-O 3.21Å
264K86.5Confident94.4Very high172 Ų17247.8 Ų47.875%0.74825%0.248SC*.SBendtrans-71.2-34.6178.9-58-167.7175.8-179.80112.5M489K264-M489 HydrophobicContact CB-SD 4.12Å; K264-M489 HydrophobicContact CD-CE 4.25Å; K264-M489 HydrophobicContact CG-CE 3.83Å; K264-M489 HydrophobicContact CG-SD 3.75Å
265E89.8Confident94.5Very high128 Ų12847.9 Ų47.960%0.59825%0.249SC*.SBendtrans-145.2155.2-177.763.7179.1170.500110
266P93.4Very high94.6Very high13 Ų1347 Ų478%0.08425%0.245CC..  trans-69.7150.2172.728-32.7000111.1L182 G268 Y269 M272 T325L182-P266 HydrophobicContact CD1-CB 4.36Å; L182-P266 HydrophobicContact CD1-CG 3.49Å; L182-P266 VanDerWaalsContact CD1-CG 3.49Å; L182-P266 HydrophobicContact CG-CG 4.35Å; P266-G268 PolarHBondContact O-N 2.9Å; P266-Y269 HydrophobicContact CG-CD2 4.35Å; P266-Y269 PolarHBondContact O-N 2.93Å; P266-M272 HydrophobicContact CB-SD 3.69Å; P266-M272 HydrophobicContact CG-SD 4Å; P266-T325 HydrophobicContact CB-CG2 4.47Å
267F96.6Very high94.7Very high131 Ų13149.5 Ų49.558%0.57526%0.257SS*.THydrogen-bonded Turntrans-59.5121.7177.7-179.3-92.3000111.3S321 A324 T325F267-S321 VanDerWaalsContact O-CB 3.28Å; F267-S321 WeakPolarHBondContact O-CB 3.48Å; F267-S321 PolarHBondContact O-OG 3.25Å; F267-A324 HydrophobicContact CB-CB 3.82Å; F267-A324 HydrophobicContact CD1-CB 3.52Å; F267-A324 HydrophobicContact CD2-CB 4.19Å; F267-A324 HydrophobicContact CE1-CB 4.11Å; F267-A324 HydrophobicContact CG-CB 3.56Å; F267-T325 PolarHBondContact N-OG1 3.24Å
268G95.9Very high94.8Very high38 Ų3851.8 Ų51.839%0.39227%0.273SS..THydrogen-bonded Turntrans66.944.4179.500000112.5P266 M270 G271 M272P266-G268 PolarHBondContact O-N 2.9Å; G268-M270 VanDerWaalsContact C-N 3.26Å; G268-M270 PolarHBondContact O-N 3.46Å; G268-M270 VanDerWaalsContact O-N 3.14Å; G268-G271 CarbonylContact O-C 3.28Å; G268-G271 VanDerWaalsContact O-CA 3.32Å; G268-G271 WeakPolarHBondContact O-CA 3.42Å; G268-G271 PolarHBondContact O-N 2.95Å; G268-M272 PolarHBondContact O-N 3.13Å
269Y95.9Very high94.9Very high33 Ų3351 Ų5113%0.12927%0.269CS..Hα-helixtrans-41.4-50.3178.4165.9-90.4000113.2Y178 T180 L182 W185 P266 G271 M272 V273Y178-Y269 WeakPolarHBondContact O-CE1 3.45Å; Y178-Y269 PolarHBondContact O-OH 3.29Å; T180-Y269 PolarHBondContact O-OH 3.43Å; L182-Y269 HydrophobicContact CD1-CD2 4.35Å; L182-Y269 HydrophobicContact CD2-CD2 3.67Å; L182-Y269 HydrophobicContact CD2-CE2 3.52Å; L182-Y269 HydrophobicContact CG-CD2 3.8Å; L182-Y269 HydrophobicContact CG-CE2 3.8Å; W185-Y269 PolarHBondContact NE1-OH 3.49Å; W185-Y269 VanDerWaalsContact NE1-OH 3.16Å; P266-Y269 HydrophobicContact CG-CD2 4.35Å; P266-Y269 PolarHBondContact O-N 2.93Å; Y269-G271 PolarHBondContact O-N 3.44Å; Y269-M272 WeakPolarHBondContact O-CB 3.11Å; Y269-M272 PolarHBondContact O-N 3.27Å; Y269-M272 VanDerWaalsContact O-N 3.09Å; Y269-V273 HydrophobicContact CE1-CG2 3.98Å; Y269-V273 HydrophobicContact CE2-CG2 4.12Å; Y269-V273 PolarHBondContact O-N 3.36Å
270M96.6Very high95.1Very high76 Ų7649.4 Ų49.437%0.37426%0.263SS..Hα-helixtrans-61.7-41.1177.4-71.5-62.1-65.600112.6Y178 G268 M272 V273 W274Y178-M270 HydrophobicContact CD1-CE 3.45Å; Y178-M270 VanDerWaalsContact CD1-CE 3.45Å; Y178-M270 HydrophobicContact CD1-SD 3.76Å; Y178-M270 HydrophobicContact CE1-CE 3.62Å; Y178-M270 HydrophobicContact CG-CE 4.22Å; Y178-M270 HydrophobicContact CG-SD 4.31Å; G268-M270 VanDerWaalsContact C-N 3.26Å; G268-M270 PolarHBondContact O-N 3.46Å; G268-M270 VanDerWaalsContact O-N 3.14Å; M270-M272 VanDerWaalsContact C-N 3.27Å; M270-M272 PolarHBondContact O-N 2.9Å; M270-V273 PolarHBondContact O-N 3.25Å; M270-W274 PolarHBondContact O-N 3.12Å
271G97.4Very high95.4Very high32 Ų3254.8 Ų54.833%0.3329%0.288SS..Hα-helixtrans-60.8-36.9174.200000112.3G268 Y269 A275G268-G271 CarbonylContact O-C 3.28Å; G268-G271 VanDerWaalsContact O-CA 3.32Å; G268-G271 WeakPolarHBondContact O-CA 3.42Å; G268-G271 PolarHBondContact O-N 2.95Å; Y269-G271 PolarHBondContact O-N 3.44Å; G271-A275 VanDerWaalsContact O-CB 3.22Å; G271-A275 WeakPolarHBondContact O-CB 3.28Å; G271-A275 PolarHBondContact O-N 3.07Å
272M97.9Very high95.6Very high0 Ų055.6 Ų55.60%029%0.291CS..Hα-helixtrans-69.4-36.1175.2-62.8-175.676.900112.9L182 S254 P266 G268 Y269 M270 M276 W322L182-M272 HydrophobicContact CD1-CB 4.01Å; L182-M272 HydrophobicContact CD1-CE 3.8Å; L182-M272 HydrophobicContact CD1-CG 4.5Å; L182-M272 HydrophobicContact CD1-SD 3.65Å; L182-M272 HydrophobicContact CD2-CB 4.18Å; S254-M272 VanDerWaalsContact OG-CE 3.24Å; S254-M272 WeakPolarHBondContact OG-CE 3.41Å; P266-M272 HydrophobicContact CB-SD 3.69Å; P266-M272 HydrophobicContact CG-SD 4Å; G268-M272 PolarHBondContact O-N 3.13Å; Y269-M272 WeakPolarHBondContact O-CB 3.11Å; Y269-M272 PolarHBondContact O-N 3.27Å; Y269-M272 VanDerWaalsContact O-N 3.09Å; M270-M272 VanDerWaalsContact C-N 3.27Å; M270-M272 PolarHBondContact O-N 2.9Å; M272-M276 WeakPolarHBondContact O-CG 3.42Å; M272-M276 PolarHBondContact O-N 3.2Å; M272-M276 VanDerWaalsContact O-N 3.13Å; M272-W322 HydrophobicContact CE-CZ2 4.38Å; M272-W322 VanDerWaalsContact CE-NE1 3.33Å
273V98.2Very high95.8Very high0 Ų052.7 Ų52.70%026%0.261CS..Hα-helixtrans-64.6-52173.9174.10000110.3L182 W185 Y269 M270 A275 M276 M277L182-V273 HydrophobicContact CD2-CG2 3.55Å; W185-V273 HydrophobicContact CD2-CG1 3.8Å; W185-V273 HydrophobicContact CD2-CG2 4.44Å; W185-V273 HydrophobicContact CE3-CG1 4.16Å; W185-V273 HydrophobicContact CG-CG1 4.29Å; W185-V273 HydrophobicContact CG-CG2 4.15Å; W185-V273 HydrophobicContact CH2-CG1 4.13Å; W185-V273 HydrophobicContact CZ2-CG1 3.77Å; W185-V273 HydrophobicContact CZ3-CG1 4.32Å; Y269-V273 HydrophobicContact CE1-CG2 3.98Å; Y269-V273 HydrophobicContact CE2-CG2 4.12Å; Y269-V273 PolarHBondContact O-N 3.36Å; M270-V273 PolarHBondContact O-N 3.25Å; V273-A275 VanDerWaalsContact C-N 3.31Å; V273-A275 PolarHBondContact O-N 3.43Å; V273-M276 PolarHBondContact O-N 3.43Å; V273-M276 VanDerWaalsContact O-N 3.14Å; V273-M277 HydrophobicContact CG1-CE 4.02Å; V273-M277 PolarHBondContact O-N 2.93Å
274W98.2Very high96.3Very high135 Ų13551.1 Ų51.151%0.51126%0.255SS..Hα-helixtrans-60-40.4177.2-74111.9000112.1M270 M276 M277 S278M270-W274 PolarHBondContact O-N 3.12Å; W274-M276 PolarHBondContact O-N 2.88Å; W274-M277 HydrophobicContact CD2-CE 3.48Å; W274-M277 VanDerWaalsContact CD2-CE 3.48Å; W274-M277 HydrophobicContact CE3-CE 3.11Å; W274-M277 HydrophobicContact CG-CE 4.19Å; W274-M277 HydrophobicContact CH2-CE 3.81Å; W274-M277 HydrophobicContact CZ2-CE 4.17Å; W274-M277 HydrophobicContact CZ3-CE 3.28Å; W274-M277 PolarHBondContact O-N 3.23Å; W274-S278 WeakPolarHBondContact O-CB 3.38Å; W274-S278 PolarHBondContact O-N 2.98Å; W274-S278 PolarHBondContact O-OG 3.36Å; W274-S278 VanDerWaalsContact O-OG 3.06Å
275A98.3Very high96.8Very high5 Ų545.1 Ų45.14%0.04123%0.23CC..Hα-helixtrans-59.5-43174.800000112.7G271 V273 S278 I279 P314 V317 K318G271-A275 VanDerWaalsContact O-CB 3.22Å; G271-A275 WeakPolarHBondContact O-CB 3.28Å; G271-A275 PolarHBondContact O-N 3.07Å; V273-A275 VanDerWaalsContact C-N 3.31Å; V273-A275 PolarHBondContact O-N 3.43Å; A275-S278 PolarHBondContact O-N 3.32Å; A275-I279 VanDerWaalsContact O-CG1 3.27Å; A275-I279 WeakPolarHBondContact O-CG1 3.32Å; A275-I279 PolarHBondContact O-N 2.95Å; A275-P314 HydrophobicContact CB-CB 3.91Å; A275-P314 WeakPolarHBondContact CB-O 3.36Å; A275-V317 HydrophobicContact CB-CB 4.4Å; A275-V317 HydrophobicContact CB-CG1 4.29Å; A275-K318 HydrophobicContact CB-CD 4.09Å; A275-K318 HydrophobicContact CB-CG 3.73Å
276M98.3Very high97.2Very high0 Ų039 Ų390%020%0.202CC..Hα-helixtrans-66.5-40.6176.8-68.3-177.4-61.400112.1L182 W185 I189 L247 M272 V273 W274 I279 G280 K318L182-M276 HydrophobicContact CB-CE 4.49Å; L182-M276 HydrophobicContact CD2-CE 3.76Å; W185-M276 HydrophobicContact CB-CE 3.74Å; I189-M276 HydrophobicContact CD1-CB 3.43Å; I189-M276 VanDerWaalsContact CD1-CB 3.43Å; L247-M276 HydrophobicContact CD2-CB 4.29Å; L247-M276 HydrophobicContact CD2-CG 4.29Å; M272-M276 WeakPolarHBondContact O-CG 3.42Å; M272-M276 PolarHBondContact O-N 3.2Å; M272-M276 VanDerWaalsContact O-N 3.13Å; V273-M276 PolarHBondContact O-N 3.43Å; V273-M276 VanDerWaalsContact O-N 3.14Å; W274-M276 PolarHBondContact O-N 2.88Å; M276-I279 PolarHBondContact O-N 3.39Å; M276-G280 PolarHBondContact O-N 3.36Å; M276-K318 HydrophobicContact CG-CD 3.92Å; M276-K318 PolarHBondContact SD-NZ 2.9Å
277M98.2Very high97.4Very high52 Ų5241.1 Ų41.126%0.25621%0.208SC..Hα-helixtrans-64.8-40.7176.3-68.2-170.8-59.800111.5W185 I189 V273 W274 G280 F281W185-M277 HydrophobicContact CH2-SD 4.43Å; W185-M277 HydrophobicContact CZ3-SD 4.06Å; I189-M277 HydrophobicContact CD1-CG 3.84Å; I189-M277 HydrophobicContact CG1-CG 4.35Å; V273-M277 HydrophobicContact CG1-CE 4.02Å; V273-M277 PolarHBondContact O-N 2.93Å; W274-M277 HydrophobicContact CD2-CE 3.48Å; W274-M277 VanDerWaalsContact CD2-CE 3.48Å; W274-M277 HydrophobicContact CE3-CE 3.11Å; W274-M277 HydrophobicContact CG-CE 4.19Å; W274-M277 HydrophobicContact CH2-CE 3.81Å; W274-M277 HydrophobicContact CZ2-CE 4.17Å; W274-M277 HydrophobicContact CZ3-CE 3.28Å; W274-M277 PolarHBondContact O-N 3.23Å; M277-G280 PolarHBondContact O-N 3.27Å; M277-F281 PolarHBondContact O-N 3.13Å
278S98.3Very high97.4Very high50 Ų5034.9 Ų34.935%0.3518%0.181SC..Hα-helixtrans-61.7-44.5173.9-63.80000111.9W274 A275 G280 F281 L282W274-S278 WeakPolarHBondContact O-CB 3.38Å; W274-S278 PolarHBondContact O-N 2.98Å; W274-S278 PolarHBondContact O-OG 3.36Å; W274-S278 VanDerWaalsContact O-OG 3.06Å; A275-S278 PolarHBondContact O-N 3.32Å; S278-G280 VanDerWaalsContact C-N 3.35Å; S278-G280 PolarHBondContact O-N 3.44Å; S278-F281 PolarHBondContact O-N 2.9Å; S278-L282 VanDerWaalsContact O-CB 3.25Å; S278-L282 WeakPolarHBondContact O-CB 3.5Å; S278-L282 WeakPolarHBondContact O-CG 3.19Å; S278-L282 PolarHBondContact O-N 3.35Å
279I98.1Very high97.5Very high0 Ų034.2 Ų34.20%017%0.167CC..Hα-helixtrans-60.4-46.1175.6-69.1163.2000110.5Y243 L247 F250 A275 M276 F281 L282 G283 I311 P314 K318Y243-I279 HydrophobicContact CD1-CG2 3.48Å; Y243-I279 VanDerWaalsContact CD1-CG2 3.48Å; Y243-I279 HydrophobicContact CD2-CG2 4.29Å; Y243-I279 HydrophobicContact CE1-CG2 3.75Å; Y243-I279 HydrophobicContact CE2-CG2 4.47Å; Y243-I279 HydrophobicContact CG-CG2 3.82Å; L247-I279 HydrophobicContact CD2-CB 4.49Å; L247-I279 HydrophobicContact CD2-CG2 4.14Å; F250-I279 HydrophobicContact CE2-CD1 4.07Å; A275-I279 VanDerWaalsContact O-CG1 3.27Å; A275-I279 WeakPolarHBondContact O-CG1 3.32Å; A275-I279 PolarHBondContact O-N 2.95Å; M276-I279 PolarHBondContact O-N 3.39Å; I279-F281 PolarHBondContact O-N 3.46Å; I279-L282 PolarHBondContact O-N 2.96Å; I279-G283 PolarHBondContact O-N 3.27Å; I279-I311 HydrophobicContact CG1-CG2 4.46Å; I279-P314 HydrophobicContact CD1-CB 4.35Å; I279-P314 HydrophobicContact CG1-CB 3.97Å; I279-P314 HydrophobicContact CG1-CG 3.83Å; I279-K318 HydrophobicContact CD1-CD 4.08Å
280G97.5Very high97.6Very high4 Ų434.8 Ų34.84%0.04117%0.171CC..Hα-helixtrans-60-45.6178.100000112.9L193 M276 M277 S278L193-G280 WeakPolarHBondContact CD2-O 3.23Å; M276-G280 PolarHBondContact O-N 3.36Å; M277-G280 PolarHBondContact O-N 3.27Å; S278-G280 VanDerWaalsContact C-N 3.35Å; S278-G280 PolarHBondContact O-N 3.44Å
281F97.9Very high97.7Very high144 Ų14431.2 Ų31.263%0.63215%0.153SC*.Hα-helixtrans-66.2-49.9176.9175.7-98.9000112.2M277 S278 I279 G283 F284 I285M277-F281 PolarHBondContact O-N 3.13Å; S278-F281 PolarHBondContact O-N 2.9Å; I279-F281 PolarHBondContact O-N 3.46Å; F281-G283 PolarHBondContact O-N 2.9Å; F281-F284 PolarHBondContact O-N 3.42Å; F281-I285 HydrophobicContact CE1-CD1 4.35Å
282L96.1Very high97.7Very high25 Ų2529.8 Ų29.813%0.13114%0.138CC..Hα-helixtrans-62.4-27.7-178.2-69173.2000111.8S278 I279 F284 I285 I310 I311 P314S278-L282 VanDerWaalsContact O-CB 3.25Å; S278-L282 WeakPolarHBondContact O-CB 3.5Å; S278-L282 WeakPolarHBondContact O-CG 3.19Å; S278-L282 PolarHBondContact O-N 3.35Å; I279-L282 PolarHBondContact O-N 2.96Å; L282-F284 PolarHBondContact O-N 2.69Å; L282-F284 VanDerWaalsContact O-N 3.16Å; L282-I285 HydrophobicContact CD2-CD1 3.7Å; L282-I285 HydrophobicContact CD2-CG1 4.22Å; L282-I285 VanDerWaalsContact O-CG1 3.32Å; L282-I285 WeakPolarHBondContact O-CG1 3.29Å; L282-I285 PolarHBondContact O-N 3.3Å; L282-I310 HydrophobicContact CD1-CG2 4Å; L282-I311 HydrophobicContact CB-CD1 3.95Å; L282-I311 HydrophobicContact CB-CG1 3.77Å; L282-I311 HydrophobicContact CD1-CG1 3.92Å; L282-I311 HydrophobicContact CG-CG1 4.45Å; L282-P314 HydrophobicContact CD1-CG 4.37Å
283G94.9Very high97.7Very high0 Ų032.9 Ų32.90%016%0.157CC..THydrogen-bonded Turntrans-58.3-26.3177.100000115.1P240 I279 F281P240-G283 WeakPolarHBondContact CD-O 3.36Å; I279-G283 PolarHBondContact O-N 3.27Å; F281-G283 PolarHBondContact O-N 2.9Å
284F97.5Very high97.6Very high36 Ų3634.8 Ų34.816%0.15817%0.169CC..THydrogen-bonded Turntrans-84.1-7.7176-77.1-70.7000114.7L193 L196 F236 P240 F281 L282 W287L193-F284 HydrophobicContact CD2-CD2 4.08Å; L193-F284 HydrophobicContact CD2-CE2 3.36Å; L193-F284 HydrophobicContact CD2-CZ 4.07Å; L196-F284 HydrophobicContact CB-CE1 4.23Å; L196-F284 HydrophobicContact CB-CE2 4.25Å; L196-F284 HydrophobicContact CB-CZ 3.59Å; L196-F284 HydrophobicContact CD1-CE2 4.17Å; L196-F284 HydrophobicContact CD1-CZ 4.35Å; F236-F284 AromaticContact CE1-CD1 3.97Å; F236-F284 HydrophobicContact CE1-CD1 3.97Å; F236-F284 HydrophobicContact CE1-CE1 4.1Å; F236-F284 HydrophobicContact CE2-CD1 4.32Å; F236-F284 AromaticContact CZ-CD1 3.74Å; F236-F284 HydrophobicContact CZ-CD1 3.74Å; F236-F284 HydrophobicContact CZ-CE1 4.29Å; P240-F284 HydrophobicContact CB-CE1 4.09Å; P240-F284 HydrophobicContact CB-CZ 4.2Å; P240-F284 HydrophobicContact CG-CD1 3.65Å; P240-F284 HydrophobicContact CG-CE1 3.61Å; P240-F284 HydrophobicContact CG-CG 4.22Å; P240-F284 HydrophobicContact CG-CZ 4.16Å; F281-F284 PolarHBondContact O-N 3.42Å; L282-F284 PolarHBondContact O-N 2.69Å; L282-F284 VanDerWaalsContact O-N 3.16Å; F284-W287 WeakPolarHBondContact O-CZ3 3.41Å
285I97.3Very high97.4Very high46 Ų4631.7 Ų31.724%0.23618%0.179CC..SBendtrans-118.212.1-175.168.7169000113.7F281 L282 F304F281-I285 HydrophobicContact CE1-CD1 4.35Å; L282-I285 HydrophobicContact CD2-CD1 3.7Å; L282-I285 HydrophobicContact CD2-CG1 4.22Å; L282-I285 VanDerWaalsContact O-CG1 3.32Å; L282-I285 WeakPolarHBondContact O-CG1 3.29Å; L282-I285 PolarHBondContact O-N 3.3Å; I285-F304 WeakPolarHBondContact O-CE1 3.23Å
286V98.1Very high97.3Very high0 Ų032.6 Ų32.60%018%0.183CC..  trans-124.51.9-177.4-600000114.4H239 A288 H289 A307 I311H239-V286 WeakPolarHBondContact CD2-CG2 3.29Å; H239-V286 WeakPolarHBondContact NE2-CG2 3.4Å; V286-A288 PolarHBondContact O-N 2.91Å; V286-H289 PolarHBondContact O-CE1 3.02Å; V286-H289 VanDerWaalsContact O-CG 3.3Å; V286-H289 PolarHBondContact O-N 2.71Å; V286-H289 PolarHBondContact O-ND1 2.78Å; V286-A307 HydrophobicContact CG1-CB 3.87Å; V286-I311 HydrophobicContact CB-CD1 4.2Å; V286-I311 HydrophobicContact CG1-CD1 3.73Å; V286-I311 HydrophobicContact CG1-CG1 4.44Å; V286-I311 HydrophobicContact CG2-CD1 3.61Å
287W98.3Very high97.2Very high56 Ų5636.9 Ų36.921%0.21221%0.205CC..G310 helixtrans-56.1-32.4-168.173.494.1000114.9H232 W235 F236 H239 F284 H289 H290 F304H232-W287 AromaticContact ND1-NE1 3.55Å; W235-W287 HydrophobicContact CB-CB 4.26Å; W235-W287 VanDerWaalsContact O-CB 3.27Å; W235-W287 WeakPolarHBondContact O-CB 3.24Å; F236-W287 HydrophobicContact CB-CG 4.37Å; F236-W287 HydrophobicContact CD2-CD2 4.07Å; F236-W287 HydrophobicContact CD2-CE3 4.05Å; F236-W287 HydrophobicContact CD2-CZ3 4.33Å; F236-W287 HydrophobicContact CE2-CZ3 4.49Å; H239-W287 HydrophobicContact CB-CB 4.11Å; F284-W287 WeakPolarHBondContact O-CZ3 3.41Å; W287-H289 PolarHBondContact O-N 3.15Å; W287-H290 PolarHBondContact O-CD2 2.92Å; W287-H290 PolarHBondContact O-N 3.38Å; W287-F304 HydrophobicContact CD2-CE1 4.21Å; W287-F304 HydrophobicContact CD2-CZ 4.31Å; W287-F304 HydrophobicContact CE3-CE1 4.05Å; W287-F304 HydrophobicContact CE3-CZ 4.28Å; W287-F304 HydrophobicContact CH2-CE1 4.49Å; W287-F304 AromaticContact CH2-CZ 3.94Å; W287-F304 HydrophobicContact CH2-CZ 3.94Å; W287-F304 AromaticContact CZ2-CZ 3.96Å; W287-F304 HydrophobicContact CZ2-CZ 3.96Å; W287-F304 HydrophobicContact CZ3-CE1 4.21Å; W287-F304 HydrophobicContact CZ3-CZ 4.11Å
288A97.4Very high97Very high0 Ų039 Ų390%022%0.222CC..G310 helixtrans-75.7-1.4-173.300000113.9V286 H290 M291 M296 F304V286-A288 PolarHBondContact O-N 2.91Å; A288-H290 PolarHBondContact O-N 3.48Å; A288-M291 HydrophobicContact CB-SD 4.48Å; A288-M291 WeakPolarHBondContact O-CA 3.15Å; A288-M291 WeakPolarHBondContact O-CB 3.47Å; A288-M291 PolarHBondContact O-N 2.97Å; A288-M296 HydrophobicContact CB-CE 4Å; A288-M296 HydrophobicContact CB-SD 4Å; A288-M296 VanDerWaalsContact O-CE 3.28Å; A288-M296 WeakPolarHBondContact O-CE 3.41Å; A288-F304 HydrophobicContact CB-CD1 3.82Å; A288-F304 HydrophobicContact CB-CD2 3.66Å; A288-F304 HydrophobicContact CB-CE1 3.63Å; A288-F304 HydrophobicContact CB-CE2 3.46Å; A288-F304 VanDerWaalsContact CB-CE2 3.46Å; A288-F304 HydrophobicContact CB-CG 3.85Å; A288-F304 HydrophobicContact CB-CZ 3.45Å; A288-F304 VanDerWaalsContact CB-CZ 3.45Å
289H98.2Very high97Very high24 Ų2442.9 Ų42.911%0.11124%0.238CC..G310 helixtrans-62.9-20.516961.4-132.5000113.1H239 V286 W287 M291 F292 T308H239-H289 AromaticContact CE1-CE1 3.01Å; H239-H289 PolarHBondContact CE1-CE1 2.87Å; H239-H289 AromaticContact CE1-NE2 3.21Å; H239-H289 PolarHBondContact CE1-NE2 3.37Å; H239-H289 AromaticContact CG-CE1 3.85Å; H239-H289 AromaticContact CG-NE2 3.89Å; H239-H289 AromaticContact ND1-CE1 3.07Å; H239-H289 PolarHBondContact ND1-CE1 2.94Å; H239-H289 AromaticContact ND1-NE2 2.89Å; H239-H289 PolarHBondContact ND1-NE2 3.29Å; H239-H289 AromaticContact NE2-CE1 3.65Å; V286-H289 PolarHBondContact O-CE1 3.02Å; V286-H289 VanDerWaalsContact O-CG 3.3Å; V286-H289 PolarHBondContact O-N 2.71Å; V286-H289 PolarHBondContact O-ND1 2.78Å; W287-H289 PolarHBondContact O-N 3.15Å; H289-M291 PolarHBondContact O-N 3.43Å; H289-F292 HydrophobicContact CB-CD2 4.19Å; H289-F292 HydrophobicContact CB-CE1 4.2Å; H289-F292 HydrophobicContact CB-CE2 3.47Å; H289-F292 VanDerWaalsContact CB-CE2 3.47Å; H289-F292 HydrophobicContact CB-CZ 3.49Å; H289-F292 VanDerWaalsContact CB-CZ 3.49Å; H289-F292 VanDerWaalsContact O-CD2 3.23Å; H289-F292 WeakPolarHBondContact O-CD2 3.44Å; H289-T308 VanDerWaalsContact ND1-CG2 3.29Å; H289-T308 WeakPolarHBondContact ND1-CG2 3.18Å; H289-T308 PolarHBondContact ND1-OG1 3.07Å
290H98.1Very high96.9Very high46 Ų4645 Ų4521%0.21325%0.251CS..G310 helixtrans-75.80.5172.7-63.5-70.5000113W235 H239 W287 A288 H367W235-H290 HydrophobicContact CD2-CB 3.4Å; W235-H290 VanDerWaalsContact CD2-CB 3.4Å; W235-H290 AromaticContact CD2-CD2 3.55Å; W235-H290 AromaticContact CD2-CG 3.55Å; W235-H290 AromaticContact CE2-CG 3.75Å; W235-H290 HydrophobicContact CE3-CB 3.97Å; W235-H290 AromaticContact CE3-CD2 3.24Å; W235-H290 AromaticContact CE3-CG 3.55Å; W235-H290 AromaticContact CE3-NE2 3.64Å; W235-H290 HydrophobicContact CG-CB 3.67Å; W235-H290 HydrophobicContact CH2-CB 4.31Å; W235-H290 AromaticContact CH2-CG 4Å; W235-H290 AromaticContact CH2-ND1 3.89Å; W235-H290 HydrophobicContact CZ2-CB 3.79Å; W235-H290 AromaticContact CZ2-CG 3.99Å; W235-H290 HydrophobicContact CZ3-CB 4.38Å; W235-H290 AromaticContact CZ3-CD2 3.71Å; W235-H290 AromaticContact CZ3-CE1 3.81Å; W235-H290 AromaticContact CZ3-CG 3.78Å; W235-H290 AromaticContact CZ3-ND1 3.85Å; W235-H290 AromaticContact CZ3-NE2 3.71Å; H239-H290 AromaticContact ND1-NE2 3.29Å; H239-H290 PolarHBondContact ND1-NE2 2.72Å; W287-H290 PolarHBondContact O-CD2 2.92Å; W287-H290 PolarHBondContact O-N 3.38Å; A288-H290 PolarHBondContact O-N 3.48Å; H290-H367 PolarHBondContact O-CE1 2.92Å
291M97.8Very high96.9Very high0 Ų047.6 Ų47.60%026%0.259CS..G310 helixtrans-126.414.5-171.5-56.2173.561.300111.6I228 Q231 H232 A288 H289 T293 V294 M296I228-M291 HydrophobicContact CG2-CE 3.78Å; Q231-M291 HydrophobicContact CB-CE 3.61Å; Q231-M291 HydrophobicContact CB-CG 4.42Å; Q231-M291 HydrophobicContact CB-SD 4.07Å; H232-M291 VanDerWaalsContact CD2-CE 3.46Å; H232-M291 WeakPolarHBondContact CD2-CE 3.21Å; H232-M291 WeakPolarHBondContact NE2-CE 3.28Å; A288-M291 HydrophobicContact CB-SD 4.48Å; A288-M291 WeakPolarHBondContact O-CA 3.15Å; A288-M291 WeakPolarHBondContact O-CB 3.47Å; A288-M291 PolarHBondContact O-N 2.97Å; H289-M291 PolarHBondContact O-N 3.43Å; M291-T293 PolarHBondContact O-N 2.86Å; M291-V294 HydrophobicContact CB-CG1 3.97Å; M291-V294 HydrophobicContact CB-CG2 4.03Å; M291-V294 HydrophobicContact CE-CG2 4.19Å; M291-V294 VanDerWaalsContact O-CG2 3.25Å; M291-V294 WeakPolarHBondContact O-CG2 3.27Å; M291-V294 PolarHBondContact O-N 2.94Å; M291-M296 HydrophobicContact CB-CE 4.04Å; M291-M296 WeakPolarHBondContact O-CE 3.16Å
292F97.8Very high96.8Very high3 Ų343 Ų431%0.01325%0.248CC..THydrogen-bonded Turntrans-58.7-20.4-174.4-73.1-37.6000114.7H289 M296 R301 F304 D363H289-F292 HydrophobicContact CB-CD2 4.19Å; H289-F292 HydrophobicContact CB-CE1 4.2Å; H289-F292 HydrophobicContact CB-CE2 3.47Å; H289-F292 VanDerWaalsContact CB-CE2 3.47Å; H289-F292 HydrophobicContact CB-CZ 3.49Å; H289-F292 VanDerWaalsContact CB-CZ 3.49Å; H289-F292 VanDerWaalsContact O-CD2 3.23Å; H289-F292 WeakPolarHBondContact O-CD2 3.44Å; F292-M296 HydrophobicContact CD1-CE 3.96Å; F292-R301 HydrophobicContact CD1-CB 4.4Å; F292-R301 HydrophobicContact CD1-CG 4.05Å; F292-F304 HydrophobicContact CE1-CB 3.68Å; F292-F304 HydrophobicContact CZ-CB 4.07Å; F292-D363 HydrophobicContact CB-CB 4.37Å; F292-D363 HydrophobicContact CD2-CB 3.84Å
293T96.5Very high96.9Very high64 Ų6447.5 Ų47.539%0.39326%0.264SS..THydrogen-bonded Turntrans-93.5-4179.554.10000114.4M291 G295 H367M291-T293 PolarHBondContact O-N 2.86Å; T293-G295 PolarHBondContact O-N 3.31Å; T293-H367 HydrophobicContact CG2-CB 3.49Å; T293-H367 VanDerWaalsContact CG2-CB 3.49Å; T293-H367 VanDerWaalsContact CG2-CG 3.49Å; T293-H367 PolarHBondContact OG1-CD2 2.73Å; T293-H367 VanDerWaalsContact OG1-CD2 3.3Å; T293-H367 PolarHBondContact OG1-NE2 3.03Å
294V96.1Very high97.1Very high40 Ų4048.1 Ų48.124%0.24227%0.267CS..SBendtrans-79.70.7-177.8-48.30000114.1I228 M291 M296I228-V294 HydrophobicContact CD1-CB 4.44Å; I228-V294 HydrophobicContact CG2-CG2 4.21Å; M291-V294 HydrophobicContact CB-CG1 3.97Å; M291-V294 HydrophobicContact CB-CG2 4.03Å; M291-V294 HydrophobicContact CE-CG2 4.19Å; M291-V294 VanDerWaalsContact O-CG2 3.25Å; M291-V294 WeakPolarHBondContact O-CG2 3.27Å; M291-V294 PolarHBondContact O-N 2.94Å; V294-M296 HydrophobicContact CG2-CG 3.88Å
295G95.1Very high97.1Very high71 Ų7147.1 Ų47.173%0.73226%0.264SS*.  trans88.725.6179.400000115.1T293T293-G295 PolarHBondContact O-N 3.31Å
296M95.3Very high97.1Very high24 Ų2448.2 Ų48.212%0.11828%0.276CS..  trans-58.3149.5170.1-66.4-170.6-70.100111.7A288 M291 F292 V294 T300 R301A288-M296 HydrophobicContact CB-CE 4Å; A288-M296 HydrophobicContact CB-SD 4Å; A288-M296 VanDerWaalsContact O-CE 3.28Å; A288-M296 WeakPolarHBondContact O-CE 3.41Å; M291-M296 HydrophobicContact CB-CE 4.04Å; M291-M296 WeakPolarHBondContact O-CE 3.16Å; F292-M296 HydrophobicContact CD1-CE 3.96Å; V294-M296 HydrophobicContact CG2-CG 3.88Å; M296-T300 HydrophobicContact CB-CG2 4.26Å; M296-T300 HydrophobicContact CG-CG2 4.46Å; M296-T300 HydrophobicContact SD-CG2 3.69Å; M296-R301 HydrophobicContact CB-CG 4Å; M296-R301 HydrophobicContact CE-CG 4.34Å; M296-R301 PolarHBondContact O-NE 3.08Å
297D95.9Very high97.1Very high89 Ų8948.7 Ų48.748%0.47628%0.279SS..  trans-60.9162.6177.270.2-90.5000112.3D299 T300 R301D297-D299 VanDerWaalsContact C-N 3.33Å; D297-D299 PolarHBondContact O-N 3.5Å; D297-D299 PolarHBondContact OD2-N 3.45Å; D297-T300 VanDerWaalsContact CG-OG1 3.26Å; D297-T300 VanDerWaalsContact OD1-CB 3.3Å; D297-T300 WeakPolarHBondContact OD1-CB 3.46Å; D297-T300 PolarHBondContact OD1-OG1 3.33Å; D297-T300 PolarHBondContact OD2-N 3.2Å; D297-T300 PolarHBondContact OD2-OG1 3.4Å; D297-R301 WeakPolarHBondContact O-CG 3.37Å; D297-R301 PolarHBondContact O-N 3.16Å; D297-R301 VanDerWaalsContact O-N 3.11Å
298V95.6Very high97.1Very high98 Ų9846.9 Ų46.959%0.59428%0.275SS*.Hα-helixtrans-63.3-39.3-173.9177.10000111.8R301 A302V298-R301 PolarHBondContact O-N 2.9Å; V298-A302 WeakPolarHBondContact O-CB 3.16Å; V298-A302 PolarHBondContact O-N 2.87Å
299D97.3Very high97.1Very high131 Ų13149.9 Ų49.970%0.70129%0.29SS*.Hα-helixtrans-72.2-41-175.7-65.9-22.8000110.8D297 R301 A302 Y303D297-D299 VanDerWaalsContact C-N 3.33Å; D297-D299 PolarHBondContact O-N 3.5Å; D297-D299 PolarHBondContact OD2-N 3.45Å; D299-R301 PolarHBondContact O-N 3.17Å; D299-A302 PolarHBondContact O-N 2.68Å; D299-Y303 WeakPolarHBondContact O-CB 3.32Å; D299-Y303 PolarHBondContact O-N 3.35Å
300T96.8Very high97Very high43 Ų4352.9 Ų52.926%0.26431%0.305SS..Hα-helixtrans-59.2-46.2172.6-64.80000110.9M296 D297 A302 Y303 F304M296-T300 HydrophobicContact CB-CG2 4.26Å; M296-T300 HydrophobicContact CG-CG2 4.46Å; M296-T300 HydrophobicContact SD-CG2 3.69Å; D297-T300 VanDerWaalsContact CG-OG1 3.26Å; D297-T300 VanDerWaalsContact OD1-CB 3.3Å; D297-T300 WeakPolarHBondContact OD1-CB 3.46Å; D297-T300 PolarHBondContact OD1-OG1 3.33Å; D297-T300 PolarHBondContact OD2-N 3.2Å; D297-T300 PolarHBondContact OD2-OG1 3.4Å; T300-A302 PolarHBondContact O-N 3.39Å; T300-Y303 PolarHBondContact O-N 2.8Å; T300-F304 HydrophobicContact CG2-CD2 3.75Å; T300-F304 HydrophobicContact CG2-CE2 3.85Å; T300-F304 VanDerWaalsContact O-CD2 3.31Å; T300-F304 WeakPolarHBondContact O-CD2 3.44Å; T300-F304 PolarHBondContact O-N 3.48Å
301R96.8Very high97Very high59 Ų5951 Ų5122%0.22330%0.297CS..Hα-helixtrans-64.2-39176.4-70.7-171-67.9155.32.1112.6F292 M296 D297 V298 D299 T305F292-R301 HydrophobicContact CD1-CB 4.4Å; F292-R301 HydrophobicContact CD1-CG 4.05Å; M296-R301 HydrophobicContact CB-CG 4Å; M296-R301 HydrophobicContact CE-CG 4.34Å; M296-R301 PolarHBondContact O-NE 3.08Å; D297-R301 WeakPolarHBondContact O-CG 3.37Å; D297-R301 PolarHBondContact O-N 3.16Å; D297-R301 VanDerWaalsContact O-N 3.11Å; V298-R301 PolarHBondContact O-N 2.9Å; D299-R301 PolarHBondContact O-N 3.17Å; R301-T305 VanDerWaalsContact O-CB 3.28Å; R301-T305 WeakPolarHBondContact O-CB 3.3Å; R301-T305 PolarHBondContact O-N 3Å; R301-T305 PolarHBondContact O-OG1 2.98Å
302A96.9Very high97Very high48 Ų4852.8 Ų52.840%0.39731%0.311SS..Hα-helixtrans-65.4-41176.300000112.2V298 D299 T300 S306V298-A302 WeakPolarHBondContact O-CB 3.16Å; V298-A302 PolarHBondContact O-N 2.87Å; D299-A302 PolarHBondContact O-N 2.68Å; T300-A302 PolarHBondContact O-N 3.39Å; A302-S306 WeakPolarHBondContact O-CB 3.33Å; A302-S306 PolarHBondContact O-N 3.3Å; A302-S306 PolarHBondContact O-OG 3.13Å
303Y98.1Very high97Very high119 Ų11958.1 Ų58.147%0.46734%0.339SS..Hα-helixtrans-59.1-56.4173.1169.6-96.5000111.1D299 T300 T305 S306 A307D299-Y303 WeakPolarHBondContact O-CB 3.32Å; D299-Y303 PolarHBondContact O-N 3.35Å; T300-Y303 PolarHBondContact O-N 2.8Å; Y303-T305 VanDerWaalsContact C-N 3.28Å; Y303-T305 PolarHBondContact O-N 3.24Å; Y303-S306 PolarHBondContact O-N 2.91Å; Y303-S306 VanDerWaalsContact O-N 3.12Å; Y303-A307 HydrophobicContact CE1-CB 4.4Å; Y303-A307 WeakPolarHBondContact O-CB 3.37Å; Y303-A307 PolarHBondContact O-N 3.25Å
304F98.1Very high97.1Very high13 Ų1355.7 Ų55.76%0.05732%0.324CS..Hα-helixtrans-65.9-31-176.6-83.7-73.2000112.5I285 W287 A288 F292 T300 T308I285-F304 WeakPolarHBondContact O-CE1 3.23Å; W287-F304 HydrophobicContact CD2-CE1 4.21Å; W287-F304 HydrophobicContact CD2-CZ 4.31Å; W287-F304 HydrophobicContact CE3-CE1 4.05Å; W287-F304 HydrophobicContact CE3-CZ 4.28Å; W287-F304 HydrophobicContact CH2-CE1 4.49Å; W287-F304 AromaticContact CH2-CZ 3.94Å; W287-F304 HydrophobicContact CH2-CZ 3.94Å; W287-F304 AromaticContact CZ2-CZ 3.96Å; W287-F304 HydrophobicContact CZ2-CZ 3.96Å; W287-F304 HydrophobicContact CZ3-CE1 4.21Å; W287-F304 HydrophobicContact CZ3-CZ 4.11Å; A288-F304 HydrophobicContact CB-CD1 3.82Å; A288-F304 HydrophobicContact CB-CD2 3.66Å; A288-F304 HydrophobicContact CB-CE1 3.63Å; A288-F304 HydrophobicContact CB-CE2 3.46Å; A288-F304 VanDerWaalsContact CB-CE2 3.46Å; A288-F304 HydrophobicContact CB-CG 3.85Å; A288-F304 HydrophobicContact CB-CZ 3.45Å; A288-F304 VanDerWaalsContact CB-CZ 3.45Å; F292-F304 HydrophobicContact CE1-CB 3.68Å; F292-F304 HydrophobicContact CZ-CB 4.07Å; T300-F304 HydrophobicContact CG2-CD2 3.75Å; T300-F304 HydrophobicContact CG2-CE2 3.85Å; T300-F304 VanDerWaalsContact O-CD2 3.31Å; T300-F304 WeakPolarHBondContact O-CD2 3.44Å; T300-F304 PolarHBondContact O-N 3.48Å; F304-T308 WeakPolarHBondContact O-CB 3.49Å; F304-T308 PolarHBondContact O-N 3.14Å; F304-T308 PolarHBondContact O-OG1 2.63Å
305T97.9Very high97.1Very high15 Ų1555 Ų559%0.09232%0.32CS..Hα-helixtrans-60.2-53.7170.3-64.60000110.6R301 Y303 T308 M309 A358 S360R301-T305 VanDerWaalsContact O-CB 3.28Å; R301-T305 WeakPolarHBondContact O-CB 3.3Å; R301-T305 PolarHBondContact O-N 3Å; R301-T305 PolarHBondContact O-OG1 2.98Å; Y303-T305 VanDerWaalsContact C-N 3.28Å; Y303-T305 PolarHBondContact O-N 3.24Å; T305-T308 PolarHBondContact O-N 2.95Å; T305-M309 HydrophobicContact CG2-CE 3.77Å; T305-M309 HydrophobicContact CG2-SD 4.19Å; T305-M309 WeakPolarHBondContact O-CG 3.46Å; T305-M309 PolarHBondContact O-N 3.05Å; T305-A358 WeakPolarHBondContact CA-O 3.41Å; T305-A358 WeakPolarHBondContact CG2-O 3.16Å; T305-S360 VanDerWaalsContact OG1-CB 3.3Å; T305-S360 WeakPolarHBondContact OG1-CB 3.04Å; T305-S360 PolarHBondContact OG1-N 3.47Å; T305-S360 PolarHBondContact OG1-OG 3.32Å
306S97.4Very high97.2Very high70 Ų7052.4 Ų52.449%0.4929%0.294SS..Hα-helixtrans-63.9-47.1-177.3-55.60000111.8A302 Y303 T308 M309 I310A302-S306 WeakPolarHBondContact O-CB 3.33Å; A302-S306 PolarHBondContact O-N 3.3Å; A302-S306 PolarHBondContact O-OG 3.13Å; Y303-S306 PolarHBondContact O-N 2.91Å; Y303-S306 VanDerWaalsContact O-N 3.12Å; S306-T308 PolarHBondContact O-N 3Å; S306-M309 PolarHBondContact O-N 3.2Å; S306-I310 WeakPolarHBondContact O-CG1 3.3Å; S306-I310 PolarHBondContact O-N 3.29Å; S306-I310 VanDerWaalsContact O-N 3.1Å
307A97.6Very high97.4Very high9 Ų954.2 Ų54.27%0.07431%0.306CS..Hα-helixtrans-62.1-41.4179.700000112V286 Y303 I310V286-A307 HydrophobicContact CG1-CB 3.87Å; Y303-A307 HydrophobicContact CE1-CB 4.4Å; Y303-A307 WeakPolarHBondContact O-CB 3.37Å; Y303-A307 PolarHBondContact O-N 3.25Å; A307-I310 PolarHBondContact O-N 2.84Å
308T97.7Very high97.5Very high19 Ų1950 Ų5012%0.11728%0.283CS..Hα-helixtrans-65.9-42.8177.3-56.10000111.5H289 F304 T305 S306 I310 I311 A358H289-T308 VanDerWaalsContact ND1-CG2 3.29Å; H289-T308 WeakPolarHBondContact ND1-CG2 3.18Å; H289-T308 PolarHBondContact ND1-OG1 3.07Å; F304-T308 WeakPolarHBondContact O-CB 3.49Å; F304-T308 PolarHBondContact O-N 3.14Å; F304-T308 PolarHBondContact O-OG1 2.63Å; T305-T308 PolarHBondContact O-N 2.95Å; S306-T308 PolarHBondContact O-N 3Å; T308-I310 VanDerWaalsContact C-N 3.28Å; T308-I310 PolarHBondContact O-N 3.42Å; T308-I311 WeakPolarHBondContact O-CB 3.41Å; T308-I311 PolarHBondContact O-N 2.93Å; T308-A358 HydrophobicContact CG2-CB 3.53Å
309M97.6Very high97.6Very high63 Ų6346 Ų4631%0.3126%0.259SS..Hα-helixtrans-63.6-32.3177.6-71.7-179.5-179.200112.9T305 S306 I311 A312 A358 N359T305-M309 HydrophobicContact CG2-CE 3.77Å; T305-M309 HydrophobicContact CG2-SD 4.19Å; T305-M309 WeakPolarHBondContact O-CG 3.46Å; T305-M309 PolarHBondContact O-N 3.05Å; S306-M309 PolarHBondContact O-N 3.2Å; M309-I311 PolarHBondContact O-N 3.11Å; M309-A312 VanDerWaalsContact O-CB 3.23Å; M309-A312 WeakPolarHBondContact O-CB 3.24Å; M309-A312 PolarHBondContact O-N 3.25Å; M309-A312 VanDerWaalsContact O-N 3.08Å; M309-A358 HydrophobicContact CE-CB 4.38Å; M309-A358 HydrophobicContact CG-CB 3.9Å; M309-N359 HydrophobicContact CE-CB 3.77Å
310I97.7Very high97.7Very high86 Ų8646.6 Ų46.644%0.44126%0.256SS..Hα-helixtrans-60-29.6176.9-72.2166.3000111.8L282 S306 A307 T308 A312 I313 P314L282-I310 HydrophobicContact CD1-CG2 4Å; S306-I310 WeakPolarHBondContact O-CG1 3.3Å; S306-I310 PolarHBondContact O-N 3.29Å; S306-I310 VanDerWaalsContact O-N 3.1Å; A307-I310 PolarHBondContact O-N 2.84Å; T308-I310 VanDerWaalsContact C-N 3.28Å; T308-I310 PolarHBondContact O-N 3.42Å; I310-A312 PolarHBondContact O-N 3.16Å; I310-I313 WeakPolarHBondContact O-CB 3.23Å; I310-I313 PolarHBondContact O-N 2.67Å; I310-P314 VanDerWaalsContact O-CD 3.23Å; I310-P314 WeakPolarHBondContact O-CD 3.36Å
311I97Very high97.7Very high7 Ų745 Ų454%0.03625%0.246CC..THydrogen-bonded Turntrans-62.5-24.3178.3-58.6-178.1000112.3Y243 I279 L282 V286 T308 M309 I313 P314 T315Y243-I311 HydrophobicContact CE1-CG2 4.35Å; Y243-I311 HydrophobicContact CE2-CD1 4.14Å; Y243-I311 WeakPolarHBondContact OH-CD1 3.36Å; Y243-I311 WeakPolarHBondContact OH-CG2 3.17Å; I279-I311 HydrophobicContact CG1-CG2 4.46Å; L282-I311 HydrophobicContact CB-CD1 3.95Å; L282-I311 HydrophobicContact CB-CG1 3.77Å; L282-I311 HydrophobicContact CD1-CG1 3.92Å; L282-I311 HydrophobicContact CG-CG1 4.45Å; V286-I311 HydrophobicContact CB-CD1 4.2Å; V286-I311 HydrophobicContact CG1-CD1 3.73Å; V286-I311 HydrophobicContact CG1-CG1 4.44Å; V286-I311 HydrophobicContact CG2-CD1 3.61Å; T308-I311 WeakPolarHBondContact O-CB 3.41Å; T308-I311 PolarHBondContact O-N 2.93Å; M309-I311 PolarHBondContact O-N 3.11Å; I311-I313 PolarHBondContact O-N 2.91Å; I311-P314 VanDerWaalsContact O-CD 3.27Å; I311-P314 WeakPolarHBondContact O-CD 3.32Å; I311-P314 WeakPolarHBondContact O-CG 3.36Å; I311-T315 WeakPolarHBondContact O-CB 3.49Å; I311-T315 PolarHBondContact O-N 3.47Å; I311-T315 PolarHBondContact O-OG1 2.97Å
312A97.2Very high97.8Very high37 Ų3742.2 Ų42.231%0.30624%0.236SC..Hα-helixtrans-60.9-26.8174.600000112.5M309 I310 G316 I355M309-A312 VanDerWaalsContact O-CB 3.23Å; M309-A312 WeakPolarHBondContact O-CB 3.24Å; M309-A312 PolarHBondContact O-N 3.25Å; M309-A312 VanDerWaalsContact O-N 3.08Å; I310-A312 PolarHBondContact O-N 3.16Å; A312-G316 WeakPolarHBondContact O-CA 3.06Å; A312-G316 PolarHBondContact O-N 2.7Å; A312-I355 HydrophobicContact CB-CD1 3.77Å; A312-I355 HydrophobicContact CB-CG1 4.09Å
313I98.3Very high97.8Very high115 Ų11543.8 Ų43.859%0.5924%0.237SC*.Hα-helixtrans-67.6-62.2-179.2-59.2173.1000111.8I310 I311 T315 G316 V317I310-I313 WeakPolarHBondContact O-CB 3.23Å; I310-I313 PolarHBondContact O-N 2.67Å; I311-I313 PolarHBondContact O-N 2.91Å; I313-T315 PolarHBondContact O-N 3.31Å; I313-G316 PolarHBondContact O-N 3.16Å; I313-G316 VanDerWaalsContact O-N 3.13Å; I313-V317 WeakPolarHBondContact O-CG2 3.44Å; I313-V317 PolarHBondContact O-N 2.99Å
314P98.2Very high97.8Very high13 Ų1339.5 Ų39.58%0.08423%0.226CC..Hα-helixtrans-63.1-32.717925.4-34.8000112.1A275 I279 L282 I310 I311 V317 K318A275-P314 HydrophobicContact CB-CB 3.91Å; A275-P314 WeakPolarHBondContact CB-O 3.36Å; I279-P314 HydrophobicContact CD1-CB 4.35Å; I279-P314 HydrophobicContact CG1-CB 3.97Å; I279-P314 HydrophobicContact CG1-CG 3.83Å; L282-P314 HydrophobicContact CD1-CG 4.37Å; I310-P314 VanDerWaalsContact O-CD 3.23Å; I310-P314 WeakPolarHBondContact O-CD 3.36Å; I311-P314 VanDerWaalsContact O-CD 3.27Å; I311-P314 WeakPolarHBondContact O-CD 3.32Å; I311-P314 WeakPolarHBondContact O-CG 3.36Å; P314-V317 PolarHBondContact O-N 2.81Å; P314-K318 PolarHBondContact O-N 3.36Å
315T97.4Very high97.7Very high25 Ų2538.9 Ų38.915%0.15322%0.224CC..Hα-helixtrans-63-45.6173.7-54.70000111.2I311 I313 V317 K318 V319 F347I311-T315 WeakPolarHBondContact O-CB 3.49Å; I311-T315 PolarHBondContact O-N 3.47Å; I311-T315 PolarHBondContact O-OG1 2.97Å; I313-T315 PolarHBondContact O-N 3.31Å; T315-V317 PolarHBondContact O-N 3Å; T315-K318 PolarHBondContact O-N 3.42Å; T315-V319 PolarHBondContact O-N 3.46Å; T315-V319 VanDerWaalsContact O-N 3.12Å; T315-F347 HydrophobicContact CG2-CE1 3.59Å; T315-F347 HydrophobicContact CG2-CZ 4.11Å
316G97.6Very high97.6Very high18 Ų1839.4 Ų39.419%0.18623%0.226CC..Hα-helixtrans-60.5-42.4175.100000112.7A312 I313 K318 V319 F320A312-G316 WeakPolarHBondContact O-CA 3.06Å; A312-G316 PolarHBondContact O-N 2.7Å; I313-G316 PolarHBondContact O-N 3.16Å; I313-G316 VanDerWaalsContact O-N 3.13Å; G316-K318 PolarHBondContact O-N 3.03Å; G316-V319 PolarHBondContact O-N 3.13Å; G316-V319 VanDerWaalsContact O-N 3.14Å; G316-F320 WeakPolarHBondContact O-CD2 3.28Å; G316-F320 PolarHBondContact O-N 3.33Å
317V98.2Very high97.5Very high61 Ų6143.2 Ų43.237%0.3724%0.236SC..Hα-helixtrans-53-44.7174.2170.30000110.8A275 I313 P314 T315 S321A275-V317 HydrophobicContact CB-CB 4.4Å; A275-V317 HydrophobicContact CB-CG1 4.29Å; I313-V317 WeakPolarHBondContact O-CG2 3.44Å; I313-V317 PolarHBondContact O-N 2.99Å; P314-V317 PolarHBondContact O-N 2.81Å; T315-V317 PolarHBondContact O-N 3Å; V317-S321 VanDerWaalsContact O-CB 3.32Å; V317-S321 WeakPolarHBondContact O-CB 3.45Å; V317-S321 PolarHBondContact O-N 2.82Å; V317-S321 PolarHBondContact O-OG 2.85Å
318K98.1Very high97.2Very high0 Ų046.5 Ų46.50%027%0.27CS..Hα-helixtrans-66.7-43.9178.6-64.3179.465.6680112.4F250 A275 M276 I279 P314 T315 G316 F320 S321 W322F250-K318 VanDerWaalsContact CB-CE 3.42Å; F250-K318 HydrophobicContact CD2-CD 4.03Å; F250-K318 HydrophobicContact CE2-CD 4.4Å; A275-K318 HydrophobicContact CB-CD 4.09Å; A275-K318 HydrophobicContact CB-CG 3.73Å; M276-K318 HydrophobicContact CG-CD 3.92Å; M276-K318 PolarHBondContact SD-NZ 2.9Å; I279-K318 HydrophobicContact CD1-CD 4.08Å; P314-K318 PolarHBondContact O-N 3.36Å; T315-K318 PolarHBondContact O-N 3.42Å; G316-K318 PolarHBondContact O-N 3.03Å; K318-F320 PolarHBondContact O-N 3.16Å; K318-S321 PolarHBondContact O-N 3.46Å; K318-W322 HydrophobicContact CB-CH2 3.89Å; K318-W322 HydrophobicContact CB-CZ2 4.19Å; K318-W322 HydrophobicContact CB-CZ3 4.16Å; K318-W322 VanDerWaalsContact O-CD2 3.28Å; K318-W322 PolarHBondContact O-N 3.45Å
319V98.2Very high96.8Very high14 Ų1447 Ų479%0.08527%0.274CS..Hα-helixtrans-58.1-49.3176.3172.70000110.9T315 G316 S321 W322 L323 I344T315-V319 PolarHBondContact O-N 3.46Å; T315-V319 VanDerWaalsContact O-N 3.12Å; G316-V319 PolarHBondContact O-N 3.13Å; G316-V319 VanDerWaalsContact O-N 3.14Å; V319-S321 PolarHBondContact O-N 3.08Å; V319-W322 HydrophobicContact CG2-CE3 4.29Å; V319-W322 HydrophobicContact CG2-CZ3 4Å; V319-W322 PolarHBondContact O-N 3.37Å; V319-L323 HydrophobicContact CG1-CD1 4.37Å; V319-L323 WeakPolarHBondContact O-CG 3.45Å; V319-L323 PolarHBondContact O-N 3.3Å; V319-L323 VanDerWaalsContact O-N 3.11Å; V319-I344 HydrophobicContact CG1-CG2 4.26Å
320F98.3Very high96.2Very high145 Ų14551.4 Ų51.464%0.63630%0.299SS*.Hα-helixtrans-66.2-36.9177.9-68.8-59.4000112.6G316 K318 W322 L323 A324G316-F320 WeakPolarHBondContact O-CD2 3.28Å; G316-F320 PolarHBondContact O-N 3.33Å; K318-F320 PolarHBondContact O-N 3.16Å; F320-W322 PolarHBondContact O-N 3.32Å; F320-L323 HydrophobicContact CD1-CD1 4.48Å; F320-L323 PolarHBondContact O-N 3.31Å; F320-A324 VanDerWaalsContact O-CB 3.3Å; F320-A324 WeakPolarHBondContact O-CB 2.99Å; F320-A324 PolarHBondContact O-N 3.26Å
321S98.3Very high95.7Very high8 Ų848.7 Ų48.76%0.05629%0.285CS..Hα-helixtrans-61.3-41.4173.1-83.80000112.5F267 V317 K318 V319 A324 T325F267-S321 VanDerWaalsContact O-CB 3.28Å; F267-S321 WeakPolarHBondContact O-CB 3.48Å; F267-S321 PolarHBondContact O-OG 3.25Å; V317-S321 VanDerWaalsContact O-CB 3.32Å; V317-S321 WeakPolarHBondContact O-CB 3.45Å; V317-S321 PolarHBondContact O-N 2.82Å; V317-S321 PolarHBondContact O-OG 2.85Å; K318-S321 PolarHBondContact O-N 3.46Å; V319-S321 PolarHBondContact O-N 3.08Å; S321-A324 PolarHBondContact O-N 2.94Å; S321-T325 WeakPolarHBondContact O-CB 3.44Å; S321-T325 PolarHBondContact O-N 2.74Å; S321-T325 PolarHBondContact O-OG1 3.35Å
322W98.2Very high95.1Very high1 Ų153.3 Ų53.30%0.00431%0.305CS..Hα-helixtrans-63.6-45.8174.4-66.8-46.5000111.6F250 I253 S254 M272 K318 V319 F320 A324 T325 L326 F343 I344F250-W322 HydrophobicContact CB-CH2 4.1Å; F250-W322 HydrophobicContact CB-CZ2 3.89Å; F250-W322 AromaticContact CD1-CH2 3.42Å; F250-W322 HydrophobicContact CD1-CH2 3.42Å; F250-W322 VanDerWaalsContact CD1-CH2 3.42Å; F250-W322 HydrophobicContact CD1-CZ2 4.07Å; F250-W322 HydrophobicContact CD1-CZ3 4.42Å; F250-W322 AromaticContact CE1-CH2 3.97Å; F250-W322 HydrophobicContact CE1-CH2 3.97Å; F250-W322 AromaticContact CG-CH2 3.89Å; F250-W322 HydrophobicContact CG-CH2 3.89Å; F250-W322 HydrophobicContact CG-CZ2 4.21Å; I253-W322 HydrophobicContact CB-CZ2 4.48Å; I253-W322 HydrophobicContact CG2-CD2 4.05Å; I253-W322 HydrophobicContact CG2-CG 4.34Å; I253-W322 HydrophobicContact CG2-CZ2 4.31Å; S254-W322 PolarHBondContact OG-NE1 3.28Å; M272-W322 HydrophobicContact CE-CZ2 4.38Å; M272-W322 VanDerWaalsContact CE-NE1 3.33Å; K318-W322 HydrophobicContact CB-CH2 3.89Å; K318-W322 HydrophobicContact CB-CZ2 4.19Å; K318-W322 HydrophobicContact CB-CZ3 4.16Å; K318-W322 VanDerWaalsContact O-CD2 3.28Å; K318-W322 PolarHBondContact O-N 3.45Å; V319-W322 HydrophobicContact CG2-CE3 4.29Å; V319-W322 HydrophobicContact CG2-CZ3 4Å; V319-W322 PolarHBondContact O-N 3.37Å; F320-W322 PolarHBondContact O-N 3.32Å; W322-A324 VanDerWaalsContact C-N 3.34Å; W322-A324 PolarHBondContact O-N 2.94Å; W322-T325 WeakPolarHBondContact O-CB 3.45Å; W322-T325 PolarHBondContact O-N 2.99Å; W322-T325 VanDerWaalsContact O-N 3.13Å; W322-L326 WeakPolarHBondContact O-CG 3.38Å; W322-L326 PolarHBondContact O-N 3.03Å; W322-F343 HydrophobicContact CH2-CE1 4.01Å; W322-F343 AromaticContact CZ3-CE1 3.92Å; W322-F343 HydrophobicContact CZ3-CE1 3.92Å; W322-I344 HydrophobicContact CB-CD1 3.7Å; W322-I344 HydrophobicContact CB-CG1 4.38Å; W322-I344 HydrophobicContact CD2-CG1 4.42Å; W322-I344 HydrophobicContact CE3-CG1 3.96Å; W322-I344 HydrophobicContact CG-CD1 4.25Å
323L97.8Very high94.9Very high82 Ų8259 Ų5943%0.42932%0.319SS..Hα-helixtrans-61.5-41.6177.3-65.7176.6000112.1V319 F320 T325 L326 H327 I344V319-L323 HydrophobicContact CG1-CD1 4.37Å; V319-L323 WeakPolarHBondContact O-CG 3.45Å; V319-L323 PolarHBondContact O-N 3.3Å; V319-L323 VanDerWaalsContact O-N 3.11Å; F320-L323 HydrophobicContact CD1-CD1 4.48Å; F320-L323 PolarHBondContact O-N 3.31Å; L323-T325 VanDerWaalsContact C-N 3.32Å; L323-T325 PolarHBondContact O-N 3.01Å; L323-L326 PolarHBondContact O-N 3.3Å; L323-H327 WeakPolarHBondContact O-CB 3.31Å; L323-H327 PolarHBondContact O-N 3.15Å; L323-I344 HydrophobicContact CD2-CG2 4.22Å
324A97.5Very high94.7Very high29 Ų2954.1 Ų54.124%0.2429%0.294CS..Hα-helixtrans-66.7-32.917500000112.5K263 F267 F320 S321 W322 H327K263-A324 PolarHBondContact NZ-O 3.1Å; K263-A324 VanDerWaalsContact NZ-O 3.15Å; F267-A324 HydrophobicContact CB-CB 3.82Å; F267-A324 HydrophobicContact CD1-CB 3.52Å; F267-A324 HydrophobicContact CD2-CB 4.19Å; F267-A324 HydrophobicContact CE1-CB 4.11Å; F267-A324 HydrophobicContact CG-CB 3.56Å; F320-A324 VanDerWaalsContact O-CB 3.3Å; F320-A324 WeakPolarHBondContact O-CB 2.99Å; F320-A324 PolarHBondContact O-N 3.26Å; S321-A324 PolarHBondContact O-N 2.94Å; W322-A324 VanDerWaalsContact C-N 3.34Å; W322-A324 PolarHBondContact O-N 2.94Å; A324-H327 PolarHBondContact O-N 2.88Å
325T96.4Very high94.6Very high0 Ų053.5 Ų53.50%029%0.29CS..Hα-helixtrans-66.6-40.2173.2-53.50000110.9V257 K263 P266 F267 S321 W322 L323V257-T325 HydrophobicContact CG1-CG2 3.74Å; K263-T325 HydrophobicContact CD-CG2 4.06Å; K263-T325 VanDerWaalsContact CD-O 3.28Å; K263-T325 WeakPolarHBondContact CD-O 3.41Å; K263-T325 WeakPolarHBondContact CE-O 3.35Å; K263-T325 PolarHBondContact NZ-O 2.97Å; P266-T325 HydrophobicContact CB-CG2 4.47Å; F267-T325 PolarHBondContact N-OG1 3.24Å; S321-T325 WeakPolarHBondContact O-CB 3.44Å; S321-T325 PolarHBondContact O-N 2.74Å; S321-T325 PolarHBondContact O-OG1 3.35Å; W322-T325 WeakPolarHBondContact O-CB 3.45Å; W322-T325 PolarHBondContact O-N 2.99Å; W322-T325 VanDerWaalsContact O-N 3.13Å; L323-T325 VanDerWaalsContact C-N 3.32Å; L323-T325 PolarHBondContact O-N 3.01Å
326L95.4Very high94.6Very high25 Ų2552.3 Ų52.313%0.13128%0.283CS..Hα-helixtrans-70-34.2175.2-65.7166000112.5V257 W322 L323 G328 S329 M331 L341 I344V257-L326 HydrophobicContact CG1-CD2 3.79Å; V257-L326 HydrophobicContact CG1-CG 3.75Å; V257-L326 HydrophobicContact CG2-CD2 4.46Å; W322-L326 WeakPolarHBondContact O-CG 3.38Å; W322-L326 PolarHBondContact O-N 3.03Å; L323-L326 PolarHBondContact O-N 3.3Å; L326-G328 PolarHBondContact O-N 3.46Å; L326-S329 WeakPolarHBondContact O-CB 3.47Å; L326-S329 PolarHBondContact O-N 2.79Å; L326-S329 PolarHBondContact O-OG 3.34Å; L326-M331 HydrophobicContact CD2-CE 3.39Å; L326-M331 HydrophobicContact CD2-SD 3.46Å; L326-M331 WeakPolarHBondContact CD2-SD 3.46Å; L326-L341 HydrophobicContact CD1-CD2 3.6Å; L326-I344 HydrophobicContact CD1-CD1 4.25Å
327H95.1Very high94.6Very high151 Ų15151.6 Ų51.670%0.69928%0.275SS*.THydrogen-bonded Turntrans-60.5133.2-176.3-175.9-102.6000112.7K263 L323 A324 S329K263-H327 PolarHBondContact NZ-O 3.21Å; L323-H327 WeakPolarHBondContact O-CB 3.31Å; L323-H327 PolarHBondContact O-N 3.15Å; A324-H327 PolarHBondContact O-N 2.88Å; H327-S329 PolarHBondContact O-N 3.07Å
328G90.6Very high94.6Very high78 Ų7850.6 Ų50.680%0.80427%0.268SS*.THydrogen-bonded Turntrans68.613.2179.100000115.1L326L326-G328 PolarHBondContact O-N 3.46Å
329S89.6Confident94.6Very high29 Ų2950.6 Ų50.620%0.20327%0.268CS..  trans-94.2150.7178.169.20000112.7S261 L326 H327 M331S261-S329 WeakPolarHBondContact O-CB 3.38Å; S261-S329 PolarHBondContact OG-OG 3.47Å; L326-S329 WeakPolarHBondContact O-CB 3.47Å; L326-S329 PolarHBondContact O-N 2.79Å; L326-S329 PolarHBondContact O-OG 3.34Å; H327-S329 PolarHBondContact O-N 3.07Å; S329-M331 PolarHBondContact O-N 2.8Å; S329-M331 VanDerWaalsContact OG-CG 3.31Å; S329-M331 WeakPolarHBondContact OG-CG 3.37Å; S329-M331 PolarHBondContact OG-SD 3.03Å; S329-M331 VanDerWaalsContact OG-SD 3.34Å
330N85.4Confident94.6Very high156 Ų15650 Ų5083%0.83426%0.264SS*.  trans-8683.3169.2-172.813000109.3
331M86.8Confident94.6Very high28 Ų2845.8 Ų45.814%0.13825%0.248CC..  trans-66.5130.7-171.6-74.5-70-66.900113.4S261 L326 S329 V337S261-M331 PolarHBondContact OG-SD 3.33Å; L326-M331 HydrophobicContact CD2-CE 3.39Å; L326-M331 HydrophobicContact CD2-SD 3.46Å; L326-M331 WeakPolarHBondContact CD2-SD 3.46Å; S329-M331 PolarHBondContact O-N 2.8Å; S329-M331 VanDerWaalsContact OG-CG 3.31Å; S329-M331 WeakPolarHBondContact OG-CG 3.37Å; S329-M331 PolarHBondContact OG-SD 3.03Å; S329-M331 VanDerWaalsContact OG-SD 3.34Å; M331-V337 HydrophobicContact CE-CB 4.26Å; M331-V337 HydrophobicContact CE-CG1 3.3Å; M331-V337 HydrophobicContact CE-CG2 3.87Å
332K85.8Confident94.5Very high105 Ų10545.5 Ų45.546%0.45725%0.247SC..  trans-85.9109.9165-68.1-177.6-172.9179.10110.1Y260 S334 V337 E485Y260-K332 HydrophobicContact CD1-CB 4.1Å; Y260-K332 PolarHBondContact O-N 2.61Å; K332-S334 VanDerWaalsContact C-N 3.27Å; K332-S334 PolarHBondContact O-N 3.28Å; K332-V337 WeakPolarHBondContact O-CG2 3.34Å; K332-E485 WeakPolarHBondContact CD-OE2 3.34Å; K332-E485 IonicContact NZ-OE1 3.72Å; K332-E485 PolarHBondContact NZ-OE1 3.12Å; K332-E485 IonicContact NZ-OE2 3.94Å; K332-E485 PolarHBondContact NZ-OE2 3Å
333W91.6Very high94.6Very high156 Ų15645.5 Ų45.559%0.59125%0.246SC*.  trans-76.271-177.6-67100.9000113.4V337 L338 L341 K410W333-V337 HydrophobicContact CE3-CG1 4.17Å; W333-V337 HydrophobicContact CZ3-CG1 4.24Å; W333-L338 HydrophobicContact CE3-CD2 4.21Å; W333-L338 HydrophobicContact CZ3-CD2 4.4Å; W333-L341 HydrophobicContact CH2-CD1 4.02Å; W333-L341 HydrophobicContact CZ3-CD1 3.52Å; W333-K410 WeakPolarHBondContact O-CE 3.33Å; W333-K410 PolarHBondContact O-NZ 3.13Å
334S94.2Very high94.6Very high12 Ų1242 Ų428%0.08423%0.228CC..  trans-83.9164.6170.673.20000111.7Y260 K332 A336 V337 L338Y260-S334 WeakPolarHBondContact CD1-OG 3.39Å; Y260-S334 VanDerWaalsContact CE1-CB 3.43Å; Y260-S334 WeakPolarHBondContact CE1-OG 3.38Å; K332-S334 VanDerWaalsContact C-N 3.27Å; K332-S334 PolarHBondContact O-N 3.28Å; S334-A336 VanDerWaalsContact C-N 3.27Å; S334-A336 PolarHBondContact O-N 2.92Å; S334-A336 PolarHBondContact OG-N 3.5Å; S334-V337 PolarHBondContact O-N 2.93Å; S334-V337 PolarHBondContact OG-N 2.92Å; S334-L338 PolarHBondContact O-N 3.2Å
335A97Very high94.6Very high0 Ų046.1 Ų46.10%024%0.241CC..Hα-helixtrans-59.7-37172.400000112.4V337 L338 W339 I393 A409 K410A335-V337 VanDerWaalsContact C-N 3.29Å; A335-V337 PolarHBondContact O-N 2.79Å; A335-L338 WeakPolarHBondContact O-CB 3.48Å; A335-L338 PolarHBondContact O-N 2.64Å; A335-W339 PolarHBondContact O-N 2.84Å; A335-W339 VanDerWaalsContact O-N 3.08Å; A335-I393 HydrophobicContact CB-CD1 4.41Å; A335-I393 HydrophobicContact CB-CG2 4.2Å; A335-A409 HydrophobicContact CB-CB 3.46Å; A335-A409 VanDerWaalsContact CB-CB 3.46Å; A335-K410 HydrophobicContact CB-CG 4.18Å
336A96.9Very high94.7Very high0 Ų046.1 Ų46.10%024%0.241CC..Hα-helixtrans-59.9-37.6178.400000112.6I256 Y260 S334 W339 A340 I393 H394I256-A336 HydrophobicContact CG2-CB 4.08Å; Y260-A336 HydrophobicContact CD2-CB 4.46Å; Y260-A336 HydrophobicContact CE2-CB 3.61Å; S334-A336 VanDerWaalsContact C-N 3.27Å; S334-A336 PolarHBondContact O-N 2.92Å; S334-A336 PolarHBondContact OG-N 3.5Å; A336-W339 PolarHBondContact O-N 2.77Å; A336-A340 PolarHBondContact O-N 3.42Å; A336-I393 HydrophobicContact CB-CG2 4.14Å; A336-H394 HydrophobicContact CB-CB 4.22Å
337V96.6Very high94.8Very high4 Ų445.8 Ų45.82%0.02424%0.238CC..Hα-helixtrans-64.1-40.6173.2170.70000111.7Y260 M331 K332 W333 S334 A335 W339 A340 L341Y260-V337 HydrophobicContact CD1-CG2 4.03Å; Y260-V337 HydrophobicContact CD2-CG2 3.7Å; Y260-V337 HydrophobicContact CG-CG2 3.39Å; M331-V337 HydrophobicContact CE-CB 4.26Å; M331-V337 HydrophobicContact CE-CG1 3.3Å; M331-V337 HydrophobicContact CE-CG2 3.87Å; K332-V337 WeakPolarHBondContact O-CG2 3.34Å; W333-V337 HydrophobicContact CE3-CG1 4.17Å; W333-V337 HydrophobicContact CZ3-CG1 4.24Å; S334-V337 PolarHBondContact O-N 2.93Å; S334-V337 PolarHBondContact OG-N 2.92Å; A335-V337 VanDerWaalsContact C-N 3.29Å; A335-V337 PolarHBondContact O-N 2.79Å; V337-W339 VanDerWaalsContact C-N 3.32Å; V337-W339 PolarHBondContact O-N 3.21Å; V337-A340 PolarHBondContact O-N 3.38Å; V337-A340 VanDerWaalsContact O-N 3.16Å; V337-L341 HydrophobicContact CG1-CD1 3.88Å; V337-L341 HydrophobicContact CG1-CG 4.22Å; V337-L341 WeakPolarHBondContact O-CG 3.41Å; V337-L341 PolarHBondContact O-N 3.17Å
338L98.1Very high94.9Very high39 Ų3941 Ų4120%0.20422%0.22CC..Hα-helixtrans-61.8-43177.5-61.5-178.3000111.3W333 S334 A335 A340 L341 G342 K410 F413W333-L338 HydrophobicContact CE3-CD2 4.21Å; W333-L338 HydrophobicContact CZ3-CD2 4.4Å; S334-L338 PolarHBondContact O-N 3.2Å; A335-L338 WeakPolarHBondContact O-CB 3.48Å; A335-L338 PolarHBondContact O-N 2.64Å; L338-A340 VanDerWaalsContact C-N 3.33Å; L338-A340 PolarHBondContact O-N 3.05Å; L338-L341 PolarHBondContact O-N 3.5Å; L338-G342 PolarHBondContact O-N 3.29Å; L338-K410 HydrophobicContact CD1-CB 4.34Å; L338-K410 HydrophobicContact CD1-CG 3.84Å; L338-F413 VanDerWaalsContact C-CE2 3.49Å; L338-F413 HydrophobicContact CB-CD1 3.65Å; L338-F413 HydrophobicContact CB-CD2 4.1Å; L338-F413 HydrophobicContact CB-CE1 3.76Å; L338-F413 HydrophobicContact CB-CE2 4.19Å; L338-F413 HydrophobicContact CB-CG 3.81Å; L338-F413 HydrophobicContact CB-CZ 4.03Å; L338-F413 HydrophobicContact CD1-CD1 3.86Å; L338-F413 HydrophobicContact CD1-CE1 4.36Å; L338-F413 HydrophobicContact CD1-CG 4.46Å; L338-F413 HydrophobicContact CG-CD1 4.34Å; L338-F413 WeakPolarHBondContact O-CE2 3.35Å; L338-F413 WeakPolarHBondContact O-CZ 3.2Å
339W98.4Very high95.3Very high1 Ų139 Ų390%0.00419%0.192CC..Hα-helixtrans-60.5-41.6172.7-73.4101.8000112.4A335 A336 V337 G342 F343 F386 M389 I393 H412 F413 M416A335-W339 PolarHBondContact O-N 2.84Å; A335-W339 VanDerWaalsContact O-N 3.08Å; A336-W339 PolarHBondContact O-N 2.77Å; V337-W339 VanDerWaalsContact C-N 3.32Å; V337-W339 PolarHBondContact O-N 3.21Å; W339-G342 PolarHBondContact O-N 3.08Å; W339-F343 VanDerWaalsContact O-CB 3.31Å; W339-F343 WeakPolarHBondContact O-CB 3.32Å; W339-F343 PolarHBondContact O-N 2.95Å; W339-F386 HydrophobicContact CE3-CB 4.09Å; W339-F386 AromaticContact CE3-CD1 3.57Å; W339-F386 HydrophobicContact CE3-CD1 3.57Å; W339-F386 HydrophobicContact CE3-CD2 4.21Å; W339-F386 AromaticContact CE3-CE1 3.93Å; W339-F386 HydrophobicContact CE3-CE1 3.93Å; W339-F386 AromaticContact CE3-CG 3.71Å; W339-F386 HydrophobicContact CE3-CG 3.71Å; W339-F386 HydrophobicContact CE3-CZ 4.4Å; W339-F386 AromaticContact CZ3-CD1 3.87Å; W339-F386 HydrophobicContact CZ3-CD1 3.87Å; W339-F386 AromaticContact CZ3-CD2 3.82Å; W339-F386 HydrophobicContact CZ3-CD2 3.82Å; W339-F386 AromaticContact CZ3-CE1 3.9Å; W339-F386 HydrophobicContact CZ3-CE1 3.9Å; W339-F386 AromaticContact CZ3-CE2 3.86Å; W339-F386 HydrophobicContact CZ3-CE2 3.86Å; W339-F386 AromaticContact CZ3-CG 3.82Å; W339-F386 HydrophobicContact CZ3-CG 3.82Å; W339-F386 AromaticContact CZ3-CZ 3.9Å; W339-F386 HydrophobicContact CZ3-CZ 3.9Å; W339-M389 HydrophobicContact CD2-CB 3.68Å; W339-M389 HydrophobicContact CE3-CB 3.64Å; W339-M389 HydrophobicContact CE3-CG 4.36Å; W339-M389 HydrophobicContact CG-CB 4.36Å; W339-M389 HydrophobicContact CH2-CB 3.92Å; W339-M389 HydrophobicContact CH2-CG 3.95Å; W339-M389 HydrophobicContact CZ2-CB 3.99Å; W339-M389 HydrophobicContact CZ2-CG 4.35Å; W339-M389 HydrophobicContact CZ3-CB 3.75Å; W339-M389 HydrophobicContact CZ3-CG 3.97Å; W339-I393 VanDerWaalsContact CD1-CD1 3.4Å; W339-I393 HydrophobicContact CG-CD1 4.49Å; W339-H412 AromaticContact CH2-CE1 3.88Å; W339-H412 AromaticContact CZ2-CE1 3.44Å; W339-H412 VanDerWaalsContact CZ2-CE1 3.44Å; W339-H412 WeakPolarHBondContact CZ2-CE1 3.49Å; W339-H412 AromaticContact CZ2-ND1 3.42Å; W339-H412 WeakPolarHBondContact CZ2-ND1 3.05Å; W339-F413 HydrophobicContact CD2-CB 4.5Å; W339-F413 AromaticContact CD2-CD2 3.69Å; W339-F413 HydrophobicContact CD2-CD2 3.69Å; W339-F413 AromaticContact CE2-CD2 3.83Å; W339-F413 AromaticContact CE3-CD2 3.99Å; W339-F413 HydrophobicContact CE3-CD2 3.99Å; W339-F413 AromaticContact CG-CD2 3.99Å; W339-F413 HydrophobicContact CG-CD2 3.99Å; W339-F413 HydrophobicContact CZ2-CB 3.97Å; W339-F413 HydrophobicContact CZ2-CD2 4.26Å; W339-F413 HydrophobicContact CZ3-CD2 4.43Å; W339-M416 HydrophobicContact CH2-CB 3.67Å; W339-M416 HydrophobicContact CH2-CG 3.73Å; W339-M416 HydrophobicContact CZ2-CB 4.46Å; W339-M416 HydrophobicContact CZ3-CB 4.43Å; W339-M416 HydrophobicContact CZ3-CG 4.14Å
340A98.1Very high95.6Very high1 Ų137.6 Ų37.61%0.00818%0.182CC..Hα-helixtrans-66.5-40.2177.200000113.1I253 I256 V257 A336 V337 L338 F343 I344I253-A340 HydrophobicContact CD1-CB 4.01Å; I253-A340 HydrophobicContact CG2-CB 4.46Å; I256-A340 HydrophobicContact CG2-CB 3.9Å; V257-A340 HydrophobicContact CG2-CB 4.15Å; A336-A340 PolarHBondContact O-N 3.42Å; V337-A340 PolarHBondContact O-N 3.38Å; V337-A340 VanDerWaalsContact O-N 3.16Å; L338-A340 VanDerWaalsContact C-N 3.33Å; L338-A340 PolarHBondContact O-N 3.05Å; A340-F343 WeakPolarHBondContact O-CB 3.41Å; A340-F343 PolarHBondContact O-N 3.14Å; A340-I344 VanDerWaalsContact O-CG1 3.24Å; A340-I344 WeakPolarHBondContact O-CG1 3.33Å; A340-I344 PolarHBondContact O-N 3.48Å
341L98Very high96.2Very high56 Ų5631.4 Ų31.429%0.29316%0.155SC..Hα-helixtrans-69-41.5175-69.1173.4000111.8L326 W333 V337 L338 F343 I344 F345L326-L341 HydrophobicContact CD1-CD2 3.6Å; W333-L341 HydrophobicContact CH2-CD1 4.02Å; W333-L341 HydrophobicContact CZ3-CD1 3.52Å; V337-L341 HydrophobicContact CG1-CD1 3.88Å; V337-L341 HydrophobicContact CG1-CG 4.22Å; V337-L341 WeakPolarHBondContact O-CG 3.41Å; V337-L341 PolarHBondContact O-N 3.17Å; L338-L341 PolarHBondContact O-N 3.5Å; L341-F343 VanDerWaalsContact C-N 3.32Å; L341-F343 PolarHBondContact O-N 3.35Å; L341-I344 PolarHBondContact O-N 2.9Å; L341-F345 WeakPolarHBondContact O-CB 3.37Å; L341-F345 PolarHBondContact O-N 3.41Å
342G98.1Very high96.7Very high3 Ų335.2 Ų35.23%0.03118%0.175CC..Hα-helixtrans-59.2-44173.200000111.6L338 W339 L346L338-G342 PolarHBondContact O-N 3.29Å; W339-G342 PolarHBondContact O-N 3.08Å; G342-L346 WeakPolarHBondContact O-CB 3.37Å; G342-L346 VanDerWaalsContact O-CG 3.23Å; G342-L346 WeakPolarHBondContact O-CG 3.33Å; G342-L346 PolarHBondContact O-N 3.32Å
343F98.4Very high97.3Very high0 Ų031 Ų310%016%0.159CC..Hα-helixtrans-56.3-56.6171.5172-87.2000111.1I246 F250 I253 W322 W339 A340 L341 F345 L346 F347 G383 F386 A387I246-F343 HydrophobicContact CD1-CE2 3.9Å; I246-F343 HydrophobicContact CD1-CZ 4.24Å; F250-F343 HydrophobicContact CD1-CE1 4.17Å; F250-F343 AromaticContact CD1-CZ 3.64Å; F250-F343 HydrophobicContact CD1-CZ 3.64Å; F250-F343 HydrophobicContact CE1-CE1 4.37Å; F250-F343 AromaticContact CE1-CZ 3.75Å; F250-F343 HydrophobicContact CE1-CZ 3.75Å; I253-F343 HydrophobicContact CB-CD1 4.25Å; I253-F343 HydrophobicContact CB-CE1 4.33Å; I253-F343 HydrophobicContact CD1-CB 3.97Å; I253-F343 HydrophobicContact CD1-CD1 4.12Å; I253-F343 HydrophobicContact CD1-CD2 4.4Å; I253-F343 HydrophobicContact CD1-CG 3.9Å; I253-F343 HydrophobicContact CG1-CB 4.34Å; I253-F343 HydrophobicContact CG1-CD1 3.55Å; I253-F343 HydrophobicContact CG1-CD2 4.12Å; I253-F343 HydrophobicContact CG1-CE1 3.82Å; I253-F343 HydrophobicContact CG1-CE2 4.32Å; I253-F343 HydrophobicContact CG1-CG 3.73Å; I253-F343 HydrophobicContact CG1-CZ 4.2Å; I253-F343 HydrophobicContact CG2-CD1 3.95Å; I253-F343 HydrophobicContact CG2-CE1 4.25Å; W322-F343 HydrophobicContact CH2-CE1 4.01Å; W322-F343 AromaticContact CZ3-CE1 3.92Å; W322-F343 HydrophobicContact CZ3-CE1 3.92Å; W339-F343 VanDerWaalsContact O-CB 3.31Å; W339-F343 WeakPolarHBondContact O-CB 3.32Å; W339-F343 PolarHBondContact O-N 2.95Å; A340-F343 WeakPolarHBondContact O-CB 3.41Å; A340-F343 PolarHBondContact O-N 3.14Å; L341-F343 VanDerWaalsContact C-N 3.32Å; L341-F343 PolarHBondContact O-N 3.35Å; F343-F345 VanDerWaalsContact C-N 3.27Å; F343-F345 PolarHBondContact O-N 2.89Å; F343-L346 PolarHBondContact O-N 3.27Å; F343-F347 HydrophobicContact CE1-CB 4.35Å; F343-F347 HydrophobicContact CE1-CG 4.43Å; F343-F347 HydrophobicContact CE2-CB 4.48Å; F343-F347 HydrophobicContact CE2-CD2 4.49Å; F343-F347 HydrophobicContact CZ-CB 4.3Å; F343-F347 HydrophobicContact CZ-CD2 4.33Å; F343-F347 HydrophobicContact CZ-CG 4.11Å; F343-F347 WeakPolarHBondContact O-CA 3.31Å; F343-F347 WeakPolarHBondContact O-CB 3.42Å; F343-F347 PolarHBondContact O-N 3.48Å; F343-G383 WeakPolarHBondContact CD2-O 3.47Å; F343-G383 VanDerWaalsContact CE2-CA 3.48Å; F343-G383 VanDerWaalsContact CE2-O 3.27Å; F343-G383 WeakPolarHBondContact CE2-O 3.17Å; F343-F386 HydrophobicContact CB-CB 4.17Å; F343-F386 HydrophobicContact CD2-CB 4.44Å; F343-A387 HydrophobicContact CD2-CB 4.17Å; F343-A387 HydrophobicContact CE2-CB 4.22Å
344I98.4Very high97.5Very high9 Ų924.3 Ų24.35%0.04614%0.138CC..Hα-helixtrans-57.3-44.3-175.7-68.7164.8000110.4I253 V257 V319 W322 L323 L326 A340 L341 T348I253-I344 HydrophobicContact CG2-CD1 4.48Å; I253-I344 HydrophobicContact CG2-CG1 4.33Å; V257-I344 HydrophobicContact CG2-CD1 4.28Å; V319-I344 HydrophobicContact CG1-CG2 4.26Å; W322-I344 HydrophobicContact CB-CD1 3.7Å; W322-I344 HydrophobicContact CB-CG1 4.38Å; W322-I344 HydrophobicContact CD2-CG1 4.42Å; W322-I344 HydrophobicContact CE3-CG1 3.96Å; W322-I344 HydrophobicContact CG-CD1 4.25Å; L323-I344 HydrophobicContact CD2-CG2 4.22Å; L326-I344 HydrophobicContact CD1-CD1 4.25Å; A340-I344 VanDerWaalsContact O-CG1 3.24Å; A340-I344 WeakPolarHBondContact O-CG1 3.33Å; A340-I344 PolarHBondContact O-N 3.48Å; L341-I344 PolarHBondContact O-N 2.9Å; I344-T348 WeakPolarHBondContact O-CB 3.43Å; I344-T348 PolarHBondContact O-N 3.32Å; I344-T348 PolarHBondContact O-OG1 2.83Å
345F98.2Very high97.7Very high116 Ų11626.9 Ų26.951%0.50915%0.15SC..Hα-helixtrans-65-57.6179176.3-110.4000112.4L341 F343 F347 T348 V349 F417L341-F345 WeakPolarHBondContact O-CB 3.37Å; L341-F345 PolarHBondContact O-N 3.41Å; F343-F345 VanDerWaalsContact C-N 3.27Å; F343-F345 PolarHBondContact O-N 2.89Å; F345-F347 PolarHBondContact O-N 3.24Å; F345-T348 WeakPolarHBondContact O-CB 3.19Å; F345-T348 PolarHBondContact O-N 3.41Å; F345-T348 VanDerWaalsContact O-N 3.17Å; F345-V349 HydrophobicContact CE1-CG2 4.42Å; F345-V349 HydrophobicContact CE2-CG2 4.23Å; F345-V349 HydrophobicContact CZ-CG2 4.11Å; F345-V349 PolarHBondContact O-N 3.21Å; F345-F417 HydrophobicContact CD1-CE2 4.33Å; F345-F417 HydrophobicContact CD1-CZ 4.14Å; F345-F417 HydrophobicContact CE1-CZ 4.33Å
346L97.8Very high97.7Very high0 Ų029.3 Ų29.30%017%0.165CC..Hα-helixtrans-70.6-36.7-172.3-61.7167.5000111.7G342 F343 T348 V349 G350 Y378 M382 F386 F417 N421G342-L346 WeakPolarHBondContact O-CB 3.37Å; G342-L346 VanDerWaalsContact O-CG 3.23Å; G342-L346 WeakPolarHBondContact O-CG 3.33Å; G342-L346 PolarHBondContact O-N 3.32Å; F343-L346 PolarHBondContact O-N 3.27Å; L346-T348 VanDerWaalsContact C-N 3.28Å; L346-T348 PolarHBondContact O-N 2.66Å; L346-V349 PolarHBondContact O-N 3.45Å; L346-G350 PolarHBondContact O-N 2.84Å; L346-Y378 HydrophobicContact CB-CD1 4.29Å; L346-Y378 HydrophobicContact CB-CE1 4.46Å; L346-Y378 HydrophobicContact CD2-CD1 4.42Å; L346-Y378 HydrophobicContact CD2-CE1 3.76Å; L346-Y378 WeakPolarHBondContact O-CD1 3.28Å; L346-M382 HydrophobicContact CB-CB 3.7Å; L346-M382 HydrophobicContact CB-CG 4.28Å; L346-M382 HydrophobicContact CB-SD 3.96Å; L346-M382 HydrophobicContact CD1-CB 4Å; L346-M382 HydrophobicContact CD1-CG 3.84Å; L346-M382 HydrophobicContact CD1-SD 3.61Å; L346-M382 HydrophobicContact CD2-SD 3.87Å; L346-M382 HydrophobicContact CG-CB 4.44Å; L346-M382 HydrophobicContact CG-SD 4Å; L346-F386 HydrophobicContact CD1-CD1 4.34Å; L346-F386 HydrophobicContact CD1-CE1 3.67Å; L346-F386 HydrophobicContact CD1-CZ 3.78Å; L346-F417 HydrophobicContact CD1-CD2 3.74Å; L346-F417 HydrophobicContact CD1-CE2 3.57Å; L346-F417 HydrophobicContact CD2-CE2 4.09Å; L346-F417 HydrophobicContact CD2-CZ 4.41Å; L346-F417 HydrophobicContact CG-CE2 3.91Å; L346-N421 WeakPolarHBondContact CD2-ND2 3.27Å; L346-N421 VanDerWaalsContact CD2-OD1 3.24Å; L346-N421 WeakPolarHBondContact CD2-OD1 3.46Å
347F97.8Very high97.8Very high17 Ų1730.1 Ų30.18%0.07517%0.169CC..Hα-helixtrans-62.2-37172.9-175.5-98.6000111.6I246 F250 T315 F343 F345 G350 G351 V379I246-F347 HydrophobicContact CD1-CD2 4.18Å; I246-F347 HydrophobicContact CD1-CE2 4Å; I246-F347 HydrophobicContact CG1-CD2 4.37Å; I246-F347 HydrophobicContact CG1-CE2 3.71Å; I246-F347 HydrophobicContact CG1-CZ 4.27Å; F250-F347 HydrophobicContact CE1-CD1 4.24Å; F250-F347 AromaticContact CE1-CE1 3.68Å; F250-F347 HydrophobicContact CE1-CE1 3.68Å; F250-F347 HydrophobicContact CE1-CE2 4.1Å; F250-F347 AromaticContact CE1-CZ 3.62Å; F250-F347 HydrophobicContact CE1-CZ 3.62Å; F250-F347 AromaticContact CZ-CE1 3.76Å; F250-F347 HydrophobicContact CZ-CE1 3.76Å; F250-F347 HydrophobicContact CZ-CE2 4.22Å; F250-F347 AromaticContact CZ-CZ 3.47Å; F250-F347 HydrophobicContact CZ-CZ 3.47Å; F250-F347 VanDerWaalsContact CZ-CZ 3.47Å; T315-F347 HydrophobicContact CG2-CE1 3.59Å; T315-F347 HydrophobicContact CG2-CZ 4.11Å; F343-F347 HydrophobicContact CE1-CB 4.35Å; F343-F347 HydrophobicContact CE1-CG 4.43Å; F343-F347 HydrophobicContact CE2-CB 4.48Å; F343-F347 HydrophobicContact CE2-CD2 4.49Å; F343-F347 HydrophobicContact CZ-CB 4.3Å; F343-F347 HydrophobicContact CZ-CD2 4.33Å; F343-F347 HydrophobicContact CZ-CG 4.11Å; F343-F347 WeakPolarHBondContact O-CA 3.31Å; F343-F347 WeakPolarHBondContact O-CB 3.42Å; F343-F347 PolarHBondContact O-N 3.48Å; F345-F347 PolarHBondContact O-N 3.24Å; F347-G350 PolarHBondContact O-N 2.75Å; F347-G351 PolarHBondContact O-N 2.96Å; F347-V379 HydrophobicContact CD2-CB 4.35Å; F347-V379 HydrophobicContact CD2-CG1 4.39Å; F347-V379 HydrophobicContact CE2-CB 4.1Å; F347-V379 HydrophobicContact CE2-CG1 4.2Å
348T97.9Very high97.8Very high51 Ų5130 Ų3031%0.31317%0.169SC..Hα-helixtrans-66.8-43.2174.5-56.90000111.4I344 F345 L346 G350 G351 L352I344-T348 WeakPolarHBondContact O-CB 3.43Å; I344-T348 PolarHBondContact O-N 3.32Å; I344-T348 PolarHBondContact O-OG1 2.83Å; F345-T348 WeakPolarHBondContact O-CB 3.19Å; F345-T348 PolarHBondContact O-N 3.41Å; F345-T348 VanDerWaalsContact O-N 3.17Å; L346-T348 VanDerWaalsContact C-N 3.28Å; L346-T348 PolarHBondContact O-N 2.66Å; T348-G350 VanDerWaalsContact C-N 3.35Å; T348-G350 PolarHBondContact O-N 3.28Å; T348-G351 PolarHBondContact O-N 3.27Å; T348-L352 WeakPolarHBondContact O-CG 3.25Å; T348-L352 PolarHBondContact O-N 2.88Å
349V97.8Very high97.8Very high36 Ų3630.5 Ų30.522%0.21817%0.171CC..Hα-helixtrans-59.1-46.3174.7174.10000111F345 L346 L352 T353 Y378F345-V349 HydrophobicContact CE1-CG2 4.42Å; F345-V349 HydrophobicContact CE2-CG2 4.23Å; F345-V349 HydrophobicContact CZ-CG2 4.11Å; F345-V349 PolarHBondContact O-N 3.21Å; L346-V349 PolarHBondContact O-N 3.45Å; V349-L352 PolarHBondContact O-N 3.5Å; V349-T353 PolarHBondContact O-N 3.11Å; V349-Y378 HydrophobicContact CB-CD1 4.14Å; V349-Y378 HydrophobicContact CB-CE1 4.26Å; V349-Y378 HydrophobicContact CG1-CD1 3.98Å; V349-Y378 HydrophobicContact CG1-CE1 3.89Å
350G97.3Very high97.7Very high0 Ų031 Ų310%018%0.175CC..Hα-helixtrans-61.3-41.8173.800000113.2L346 F347 T348 L352 T353 G354 H375L346-G350 PolarHBondContact O-N 2.84Å; F347-G350 PolarHBondContact O-N 2.75Å; T348-G350 VanDerWaalsContact C-N 3.35Å; T348-G350 PolarHBondContact O-N 3.28Å; G350-L352 VanDerWaalsContact C-N 3.34Å; G350-L352 PolarHBondContact O-N 3.48Å; G350-T353 PolarHBondContact O-N 3.14Å; G350-T353 PolarHBondContact O-OG1 3.4Å; G350-G354 PolarHBondContact O-N 3.12Å; G350-H375 PolarHBondContact O-CE1 3.5Å; G350-H375 PolarHBondContact O-ND1 3.22Å
351G96.8Very high97.6Very high26 Ų2634.9 Ų34.927%0.26820%0.202SC..Hα-helixtrans-61.1-42176.700000112.4F347 T348 G354 I355F347-G351 PolarHBondContact O-N 2.96Å; T348-G351 PolarHBondContact O-N 3.27Å; G351-G354 WeakPolarHBondContact O-CA 3.27Å; G351-G354 PolarHBondContact O-N 3.03Å; G351-G354 VanDerWaalsContact O-N 3.15Å; G351-I355 WeakPolarHBondContact O-CG1 3.26Å; G351-I355 PolarHBondContact O-N 3.04Å
352L97.6Very high97.6Very high107 Ų10736 Ų3656%0.5621%0.208SC*.Hα-helixtrans-63.8-41.8177.2-69.1175000112.1T348 V349 G350 G354 I355 V356T348-L352 WeakPolarHBondContact O-CG 3.25Å; T348-L352 PolarHBondContact O-N 2.88Å; V349-L352 PolarHBondContact O-N 3.5Å; G350-L352 VanDerWaalsContact C-N 3.34Å; G350-L352 PolarHBondContact O-N 3.48Å; L352-G354 VanDerWaalsContact C-N 3.25Å; L352-G354 PolarHBondContact O-N 3.09Å; L352-I355 HydrophobicContact CD2-CD1 4.38Å; L352-I355 PolarHBondContact O-N 2.88Å; L352-V356 PolarHBondContact O-N 3.29Å
353T98.1Very high97.6Very high18 Ų1836.2 Ų36.211%0.1121%0.208CC..Hα-helixtrans-68.1-28.5174.958.50000111.9V349 G350 V356 L357 H375V349-T353 PolarHBondContact O-N 3.11Å; G350-T353 PolarHBondContact O-N 3.14Å; G350-T353 PolarHBondContact O-OG1 3.4Å; T353-V356 WeakPolarHBondContact O-CB 3.39Å; T353-V356 PolarHBondContact O-N 2.87Å; T353-L357 PolarHBondContact O-N 2.73Å; T353-L357 VanDerWaalsContact O-N 3.15Å; T353-H375 PolarHBondContact OG1-ND1 3Å
354G97.3Very high97.4Very high14 Ų1440.8 Ų40.814%0.14423%0.232CC..Hα-helixtrans-67.1-36.9171.500000113.6G350 G351 L352 V356 L357 A358 H375G350-G354 PolarHBondContact O-N 3.12Å; G351-G354 WeakPolarHBondContact O-CA 3.27Å; G351-G354 PolarHBondContact O-N 3.03Å; G351-G354 VanDerWaalsContact O-N 3.15Å; L352-G354 VanDerWaalsContact C-N 3.25Å; L352-G354 PolarHBondContact O-N 3.09Å; G354-V356 VanDerWaalsContact C-N 3.25Å; G354-V356 PolarHBondContact O-N 2.95Å; G354-L357 CarbonylContact O-C 3.57Å; G354-L357 PolarHBondContact O-N 3.4Å; G354-A358 WeakPolarHBondContact O-CB 3.23Å; G354-A358 PolarHBondContact O-N 2.83Å; G354-H375 WeakPolarHBondContact CA-CE1 3.3Å; G354-H375 VanDerWaalsContact CA-ND1 3.33Å; G354-H375 WeakPolarHBondContact CA-ND1 3.43Å; G354-H375 PolarHBondContact N-CE1 3.12Å; G354-H375 PolarHBondContact N-ND1 3.4Å; G354-H375 VanDerWaalsContact N-ND1 3.12Å
355I97.2Very high97.3Very high67 Ų6745.2 Ų45.234%0.34426%0.259SS..Hα-helixtrans-63.9-34.5173.8-65.5168.7000110.8A312 G351 L352 A358A312-I355 HydrophobicContact CB-CD1 3.77Å; A312-I355 HydrophobicContact CB-CG1 4.09Å; G351-I355 WeakPolarHBondContact O-CG1 3.26Å; G351-I355 PolarHBondContact O-N 3.04Å; L352-I355 HydrophobicContact CD2-CD1 4.38Å; L352-I355 PolarHBondContact O-N 2.88Å; I355-A358 PolarHBondContact O-N 3.14Å
356V98.1Very high97.3Very high50 Ų5040.1 Ų40.130%0.30324%0.237SC..Hα-helixtrans-63.3-47.4172.7-179.80000110.5L352 T353 G354 A358 N359 L362 L366 Y371L352-V356 PolarHBondContact O-N 3.29Å; T353-V356 WeakPolarHBondContact O-CB 3.39Å; T353-V356 PolarHBondContact O-N 2.87Å; G354-V356 VanDerWaalsContact C-N 3.25Å; G354-V356 PolarHBondContact O-N 2.95Å; V356-A358 VanDerWaalsContact C-N 3.3Å; V356-A358 PolarHBondContact O-N 3.35Å; V356-N359 WeakPolarHBondContact O-CB 3.23Å; V356-N359 PolarHBondContact O-N 3.17Å; V356-L362 HydrophobicContact CG1-CD1 3.82Å; V356-L366 HydrophobicContact CG1-CD1 3.88Å; V356-Y371 HydrophobicContact CB-CE1 4.45Å; V356-Y371 HydrophobicContact CG1-CE1 4.39Å
357L98.1Very high97.3Very high17 Ų1741.9 Ų41.99%0.08925%0.245CC..Hα-helixtrans-69-25.1178.2-70.7173000113.8T353 G354 N359 L366 Y371 V372 H375T353-L357 PolarHBondContact O-N 2.73Å; T353-L357 VanDerWaalsContact O-N 3.15Å; G354-L357 CarbonylContact O-C 3.57Å; G354-L357 PolarHBondContact O-N 3.4Å; L357-N359 PolarHBondContact O-N 3.09Å; L357-L366 HydrophobicContact CD2-CB 3.72Å; L357-L366 HydrophobicContact CD2-CD1 3.98Å; L357-Y371 HydrophobicContact CD1-CD1 4.04Å; L357-Y371 HydrophobicContact CD1-CE1 4.3Å; L357-Y371 HydrophobicContact CD2-CD1 3.77Å; L357-Y371 HydrophobicContact CD2-CE1 4.19Å; L357-Y371 HydrophobicContact CG-CD1 3.89Å; L357-Y371 HydrophobicContact CG-CE1 3.94Å; L357-V372 HydrophobicContact CD1-CB 4.37Å; L357-V372 HydrophobicContact CD1-CG2 4Å; L357-V372 HydrophobicContact CD2-CG2 3.75Å; L357-H375 HydrophobicContact CD1-CB 3.6Å
358A97.5Very high97.3Very high3 Ų344.5 Ų44.53%0.02526%0.26CS..THydrogen-bonded Turntrans-64.7-16.9174.500000112.5T305 T308 M309 G354 I355 V356 S360T305-A358 WeakPolarHBondContact CA-O 3.41Å; T305-A358 WeakPolarHBondContact CG2-O 3.16Å; T308-A358 HydrophobicContact CG2-CB 3.53Å; M309-A358 HydrophobicContact CE-CB 4.38Å; M309-A358 HydrophobicContact CG-CB 3.9Å; G354-A358 WeakPolarHBondContact O-CB 3.23Å; G354-A358 PolarHBondContact O-N 2.83Å; I355-A358 PolarHBondContact O-N 3.14Å; V356-A358 VanDerWaalsContact C-N 3.3Å; V356-A358 PolarHBondContact O-N 3.35Å; A358-S360 PolarHBondContact O-N 2.72Å
359N97.9Very high97.3Very high48 Ų4842.5 Ų42.526%0.25725%0.248SC..  trans-83.6109.7176.5-171.4-54.8000111M309 V356 L357 S361 L362 D363M309-N359 HydrophobicContact CE-CB 3.77Å; V356-N359 WeakPolarHBondContact O-CB 3.23Å; V356-N359 PolarHBondContact O-N 3.17Å; L357-N359 PolarHBondContact O-N 3.09Å; N359-S361 PolarHBondContact O-N 3.26Å; N359-S361 VanDerWaalsContact O-N 3.11Å; N359-S361 WeakPolarHBondContact OD1-CA 3.37Å; N359-S361 VanDerWaalsContact OD1-CB 3.29Å; N359-S361 WeakPolarHBondContact OD1-CB 3.24Å; N359-S361 PolarHBondContact OD1-N 2.87Å; N359-L362 HydrophobicContact CB-CB 4.18Å; N359-L362 HydrophobicContact CB-CD1 4.08Å; N359-L362 HydrophobicContact CB-CG 4.13Å; N359-L362 PolarHBondContact O-N 2.79Å; N359-L362 PolarHBondContact OD1-N 2.9Å; N359-D363 PolarHBondContact O-N 3.31Å
360S96.6Very high97.4Very high12 Ų1241.4 Ų41.48%0.08424%0.24CC..Hα-helixtrans-57.5-26.4-179.756.90000115.3T305 A358 I364T305-S360 VanDerWaalsContact OG1-CB 3.3Å; T305-S360 WeakPolarHBondContact OG1-CB 3.04Å; T305-S360 PolarHBondContact OG1-N 3.47Å; T305-S360 PolarHBondContact OG1-OG 3.32Å; A358-S360 PolarHBondContact O-N 2.72Å; S360-I364 WeakPolarHBondContact O-CG1 3.48Å
361S95.9Very high97.4Very high82 Ų8242.4 Ų42.457%0.57324%0.244SC*.Hα-helixtrans-75.3-36.8176-57.90000112.3N359N359-S361 PolarHBondContact O-N 3.26Å; N359-S361 VanDerWaalsContact O-N 3.11Å; N359-S361 WeakPolarHBondContact OD1-CA 3.37Å; N359-S361 VanDerWaalsContact OD1-CB 3.29Å; N359-S361 WeakPolarHBondContact OD1-CB 3.24Å; N359-S361 PolarHBondContact OD1-N 2.87Å
362L97.3Very high97.5Very high80 Ų8042.5 Ų42.542%0.41924%0.239SC..Hα-helixtrans-77.3-34.8175.8-63.4179.3000111.3V356 N359 I364 V365 L366V356-L362 HydrophobicContact CG1-CD1 3.82Å; N359-L362 HydrophobicContact CB-CB 4.18Å; N359-L362 HydrophobicContact CB-CD1 4.08Å; N359-L362 HydrophobicContact CB-CG 4.13Å; N359-L362 PolarHBondContact O-N 2.79Å; N359-L362 PolarHBondContact OD1-N 2.9Å; L362-I364 PolarHBondContact O-N 2.87Å; L362-V365 WeakPolarHBondContact O-CG2 3.47Å; L362-V365 PolarHBondContact O-N 3.31Å; L362-V365 VanDerWaalsContact O-N 3.12Å; L362-L366 HydrophobicContact CB-CD1 4.5Å; L362-L366 PolarHBondContact O-N 3.35Å
363D96.9Very high97.5Very high7 Ų738.8 Ų38.84%0.03722%0.221CC..Hα-helixtrans-61.8-29.2179.2-16252.5000111.5F292 N359 V365 L366 H367F292-D363 HydrophobicContact CB-CB 4.37Å; F292-D363 HydrophobicContact CD2-CB 3.84Å; N359-D363 PolarHBondContact O-N 3.31Å; D363-V365 PolarHBondContact O-N 3.04Å; D363-L366 PolarHBondContact O-N 3.2Å; D363-H367 WeakPolarHBondContact O-CA 3.06Å; D363-H367 WeakPolarHBondContact O-CB 3.47Å; D363-H367 PolarHBondContact O-N 3.07Å; D363-H367 IonicContact OD1-ND1 3.71Å; D363-H367 IonicContact OD2-CE1 3.31Å; D363-H367 IonicContact OD2-CG 3.79Å; D363-H367 IonicContact OD2-ND1 3.6Å; D363-H367 PolarHBondContact OD2-ND1 3.28Å
364I95.1Very high97.5Very high96 Ų9638 Ų3849%0.49222%0.216SC..Hα-helixtrans-51.2-36.5174.6-67.3164.5000112.9S360 L362S360-I364 WeakPolarHBondContact O-CG1 3.48Å; L362-I364 PolarHBondContact O-N 2.87Å
365V96.8Very high97.6Very high102 Ų10239 Ų3962%0.61822%0.217SC*.Hα-helixtrans-97.9-17.1-179.9-60.40000113.7L362 D363L362-V365 WeakPolarHBondContact O-CG2 3.47Å; L362-V365 PolarHBondContact O-N 3.31Å; L362-V365 VanDerWaalsContact O-N 3.12Å; D363-V365 PolarHBondContact O-N 3.04Å
366L98Very high97.5Very high10 Ų1038.1 Ų38.15%0.05221%0.21CC..Hα-helixtrans-102.1-18.7-178-61.4178.5000113.3V356 L357 L362 D363 T369 Y371 V372 L432V356-L366 HydrophobicContact CG1-CD1 3.88Å; L357-L366 HydrophobicContact CD2-CB 3.72Å; L357-L366 HydrophobicContact CD2-CD1 3.98Å; L362-L366 HydrophobicContact CB-CD1 4.5Å; L362-L366 PolarHBondContact O-N 3.35Å; D363-L366 PolarHBondContact O-N 3.2Å; L366-T369 WeakPolarHBondContact O-CB 3.42Å; L366-T369 WeakPolarHBondContact O-CG2 3.36Å; L366-T369 PolarHBondContact O-N 2.92Å; L366-T369 VanDerWaalsContact O-N 3.14Å; L366-T369 PolarHBondContact O-OG1 3.31Å; L366-Y371 HydrophobicContact CD1-CD1 3.98Å; L366-Y371 HydrophobicContact CD1-CE1 4.07Å; L366-Y371 HydrophobicContact CD1-CG 4.34Å; L366-Y371 HydrophobicContact CD2-CD2 4.36Å; L366-Y371 HydrophobicContact CD2-CG 4.12Å; L366-V372 WeakPolarHBondContact O-CG2 3.22Å; L366-L432 HydrophobicContact CD2-CD2 4.05Å
367H98.1Very high97.5Very high37 Ų3737.6 Ų37.617%0.17121%0.205CC..THydrogen-bonded Turntrans-58.1141-179.4-162.388.3000110.5H290 T293 D363 T369H290-H367 PolarHBondContact O-CE1 2.92Å; T293-H367 HydrophobicContact CG2-CB 3.49Å; T293-H367 VanDerWaalsContact CG2-CB 3.49Å; T293-H367 VanDerWaalsContact CG2-CG 3.49Å; T293-H367 PolarHBondContact OG1-CD2 2.73Å; T293-H367 VanDerWaalsContact OG1-CD2 3.3Å; T293-H367 PolarHBondContact OG1-NE2 3.03Å; D363-H367 WeakPolarHBondContact O-CA 3.06Å; D363-H367 WeakPolarHBondContact O-CB 3.47Å; D363-H367 PolarHBondContact O-N 3.07Å; D363-H367 IonicContact OD1-ND1 3.71Å; D363-H367 IonicContact OD2-CE1 3.31Å; D363-H367 IonicContact OD2-CG 3.79Å; D363-H367 IonicContact OD2-ND1 3.6Å; D363-H367 PolarHBondContact OD2-ND1 3.28Å; H367-T369 PolarHBondContact O-N 3.45Å
368D97.3Very high97.4Very high72 Ų7236.8 Ų36.839%0.38520%0.201SC..THydrogen-bonded Turntrans54.717.6-176.7-73.4-34.5000115.5P436 R437D368-P436 CarbonylContact O-C 3.53Å; D368-P436 WeakPolarHBondContact O-CA 3.41Å; D368-R437 HydrophobicContact CB-CG 4.41Å; D368-R437 VanDerWaalsContact O-CG 3.32Å; D368-R437 WeakPolarHBondContact O-CG 3.32Å; D368-R437 PolarHBondContact O-N 2.96Å; D368-R437 IonicContact OD1-CZ 2.67Å; D368-R437 IonicContact OD1-NE 2.7Å; D368-R437 PolarHBondContact OD1-NE 2.85Å; D368-R437 IonicContact OD1-NH2 2.59Å; D368-R437 PolarHBondContact OD1-NH2 3.4Å
369T98.5Very high97.2Very high9 Ų937.9 Ų37.96%0.05521%0.207CC..BIsolated β-bridgetrans-97.3171.1171.775.60000112.2L366 H367 Y371 V372 M435L366-T369 WeakPolarHBondContact O-CB 3.42Å; L366-T369 WeakPolarHBondContact O-CG2 3.36Å; L366-T369 PolarHBondContact O-N 2.92Å; L366-T369 VanDerWaalsContact O-N 3.14Å; L366-T369 PolarHBondContact O-OG1 3.31Å; H367-T369 PolarHBondContact O-N 3.45Å; T369-Y371 PolarHBondContact O-N 3.35Å; T369-Y371 VanDerWaalsContact O-N 3.12Å; T369-Y371 WeakPolarHBondContact OG1-CB 3.47Å; T369-Y371 PolarHBondContact OG1-N 2.95Å; T369-Y371 VanDerWaalsContact OG1-N 3.13Å; T369-V372 PolarHBondContact O-N 3.26Å; T369-M435 CarbonylContact C-O 3.58Å; T369-M435 VanDerWaalsContact CA-O 3.27Å; T369-M435 WeakPolarHBondContact CA-O 3.34Å; T369-M435 WeakPolarHBondContact CB-O 3.15Å
370Y98.4Very high96.6Very high12 Ų1236.6 Ų36.65%0.04720%0.2CC..Hα-helixtrans-61.6-12170.2-91.5-102.2000114.2L40 V373 A374 Q427 L430 M435 P436L40-Y370 WeakPolarHBondContact CD1-OH 3Å; Y370-V373 HydrophobicContact CD1-CB 4.45Å; Y370-V373 PolarHBondContact O-N 3.27Å; Y370-A374 WeakPolarHBondContact O-CB 3.44Å; Y370-A374 PolarHBondContact O-N 3.04Å; Y370-Q427 CarbonylContact C-O 3.41Å; Y370-Q427 WeakPolarHBondContact CB-O 3.46Å; Y370-Q427 HydrophobicContact CD1-CB 4.04Å; Y370-Q427 HydrophobicContact CD1-CG 3.83Å; Y370-Q427 HydrophobicContact CE1-CG 4.41Å; Y370-L430 HydrophobicContact CD1-CD1 4.37Å; Y370-L430 HydrophobicContact CG-CB 4.34Å; Y370-M435 HydrophobicContact CD2-CB 4.24Å; Y370-M435 HydrophobicContact CD2-CE 4.13Å; Y370-M435 HydrophobicContact CD2-CG 3.75Å; Y370-M435 HydrophobicContact CD2-SD 3.78Å; Y370-M435 HydrophobicContact CE2-CE 3.55Å; Y370-M435 HydrophobicContact CE2-CG 4.06Å; Y370-M435 HydrophobicContact CE2-SD 3.85Å; Y370-M435 HydrophobicContact CG-SD 4.26Å; Y370-M435 PolarHBondContact N-O 3.47Å; Y370-P436 WeakPolarHBondContact CD2-O 3.3Å; Y370-P436 VanDerWaalsContact CE2-O 3.24Å; Y370-P436 WeakPolarHBondContact CE2-O 3.4Å
371Y98.7Very high95.6Very high21 Ų2137.2 Ų37.28%0.08220%0.204CC..Hα-helixtrans-66.6-43.1175.7-165.7-86.2000110.8V356 L357 L366 T369 V373 A374 H375 H428 G431 L432V356-Y371 HydrophobicContact CB-CE1 4.45Å; V356-Y371 HydrophobicContact CG1-CE1 4.39Å; L357-Y371 HydrophobicContact CD1-CD1 4.04Å; L357-Y371 HydrophobicContact CD1-CE1 4.3Å; L357-Y371 HydrophobicContact CD2-CD1 3.77Å; L357-Y371 HydrophobicContact CD2-CE1 4.19Å; L357-Y371 HydrophobicContact CG-CD1 3.89Å; L357-Y371 HydrophobicContact CG-CE1 3.94Å; L366-Y371 HydrophobicContact CD1-CD1 3.98Å; L366-Y371 HydrophobicContact CD1-CE1 4.07Å; L366-Y371 HydrophobicContact CD1-CG 4.34Å; L366-Y371 HydrophobicContact CD2-CD2 4.36Å; L366-Y371 HydrophobicContact CD2-CG 4.12Å; T369-Y371 PolarHBondContact O-N 3.35Å; T369-Y371 VanDerWaalsContact O-N 3.12Å; T369-Y371 WeakPolarHBondContact OG1-CB 3.47Å; T369-Y371 PolarHBondContact OG1-N 2.95Å; T369-Y371 VanDerWaalsContact OG1-N 3.13Å; Y371-V373 VanDerWaalsContact C-N 3.33Å; Y371-A374 PolarHBondContact O-N 3.13Å; Y371-H375 WeakPolarHBondContact O-CB 3.5Å; Y371-H375 PolarHBondContact O-N 3.37Å; Y371-H428 HydrophobicContact CD2-CB 4.16Å; Y371-H428 AromaticContact CD2-CD2 3.98Å; Y371-H428 HydrophobicContact CE2-CB 4.23Å; Y371-H428 AromaticContact CE2-CD2 3.83Å; Y371-G431 VanDerWaalsContact N-CA 3.35Å; Y371-L432 HydrophobicContact CD2-CD2 4.06Å; Y371-L432 HydrophobicContact CD2-CG 3.85Å; Y371-L432 HydrophobicContact CE2-CD1 4.31Å; Y371-L432 HydrophobicContact CE2-CD2 3.99Å; Y371-L432 HydrophobicContact CE2-CG 3.99Å
372V98.2Very high94.9Very high28 Ų2833.3 Ų33.317%0.1718%0.177CC..Hα-helixtrans-65.9-39.3175.6-179.50000110.5L357 L366 T369 F376L357-V372 HydrophobicContact CD1-CB 4.37Å; L357-V372 HydrophobicContact CD1-CG2 4Å; L357-V372 HydrophobicContact CD2-CG2 3.75Å; L366-V372 WeakPolarHBondContact O-CG2 3.22Å; T369-V372 PolarHBondContact O-N 3.26Å; V372-F376 WeakPolarHBondContact O-CB 3.36Å; V372-F376 PolarHBondContact O-N 2.64Å
373V98.1Very high94.5Very high30 Ų3029.5 Ų29.518%0.18216%0.157CC..Hα-helixtrans-60.9-48.1175.5-177.80000110.1Y370 Y371 F376 H377 R437Y370-V373 HydrophobicContact CD1-CB 4.45Å; Y370-V373 PolarHBondContact O-N 3.27Å; Y371-V373 VanDerWaalsContact C-N 3.33Å; V373-F376 PolarHBondContact O-N 3.14Å; V373-H377 PolarHBondContact O-N 3.41Å; V373-H377 PolarHBondContact O-ND1 2.93Å; V373-R437 HydrophobicContact CG2-CB 3.84Å
374A98.3Very high94.3Very high0 Ų029.2 Ų29.20%016%0.155CC..Hα-helixtrans-62-51178.900000111.6Y370 Y371 F376 H377 Y378 Q427 H428Y370-A374 WeakPolarHBondContact O-CB 3.44Å; Y370-A374 PolarHBondContact O-N 3.04Å; Y371-A374 PolarHBondContact O-N 3.13Å; A374-F376 VanDerWaalsContact C-N 3.32Å; A374-F376 PolarHBondContact O-N 3.43Å; A374-H377 PolarHBondContact O-N 3.46Å; A374-Y378 WeakPolarHBondContact O-CD2 3.32Å; A374-Y378 PolarHBondContact O-N 2.96Å; A374-Q427 HydrophobicContact CB-CB 3.73Å; A374-H428 WeakPolarHBondContact CB-NE2 3.46Å
375H98.1Very high94.3Very high35 Ų3525.5 Ų25.516%0.16214%0.137CC..Hα-helixtrans-50.4-53.6175.116560.5000111.2G350 T353 G354 L357 Y371 H377 Y378 V379G350-H375 PolarHBondContact O-CE1 3.5Å; G350-H375 PolarHBondContact O-ND1 3.22Å; T353-H375 PolarHBondContact OG1-ND1 3Å; G354-H375 WeakPolarHBondContact CA-CE1 3.3Å; G354-H375 VanDerWaalsContact CA-ND1 3.33Å; G354-H375 WeakPolarHBondContact CA-ND1 3.43Å; G354-H375 PolarHBondContact N-CE1 3.12Å; G354-H375 PolarHBondContact N-ND1 3.4Å; G354-H375 VanDerWaalsContact N-ND1 3.12Å; L357-H375 HydrophobicContact CD1-CB 3.6Å; Y371-H375 WeakPolarHBondContact O-CB 3.5Å; Y371-H375 PolarHBondContact O-N 3.37Å; H375-H377 PolarHBondContact O-N 2.98Å; H375-Y378 PolarHBondContact O-N 3.08Å; H375-Y378 VanDerWaalsContact O-N 3.14Å; H375-V379 PolarHBondContact O-N 3.3Å; H375-V379 VanDerWaalsContact O-N 3.08Å
376F95.6Very high94.4Very high49 Ų4920.8 Ų20.822%0.21511%0.108CC..Hα-helixtrans-64.5-38.9-177.2-173.4-115.1000112.2V242 V372 V373 A374 Y378 V379 L380V242-F376 HydrophobicContact CB-CE2 4.33Å; V242-F376 HydrophobicContact CG1-CE2 3.58Å; V242-F376 HydrophobicContact CG1-CZ 4.14Å; V372-F376 WeakPolarHBondContact O-CB 3.36Å; V372-F376 PolarHBondContact O-N 2.64Å; V373-F376 PolarHBondContact O-N 3.14Å; A374-F376 VanDerWaalsContact C-N 3.32Å; A374-F376 PolarHBondContact O-N 3.43Å; F376-Y378 VanDerWaalsContact C-N 3.34Å; F376-Y378 PolarHBondContact O-N 3.44Å; F376-V379 HydrophobicContact CD2-CG2 4.22Å; F376-V379 WeakPolarHBondContact O-CG2 3.14Å; F376-V379 PolarHBondContact O-N 3.49Å; F376-L380 HydrophobicContact CD1-CB 4.4Å; F376-L380 HydrophobicContact CD2-CB 4.44Å; F376-L380 HydrophobicContact CE1-CB 4.12Å; F376-L380 HydrophobicContact CE1-CD2 3.69Å; F376-L380 HydrophobicContact CE1-CG 4.3Å; F376-L380 HydrophobicContact CE2-CB 4.13Å; F376-L380 HydrophobicContact CE2-CD1 4.24Å; F376-L380 HydrophobicContact CZ-CB 3.98Å; F376-L380 HydrophobicContact CZ-CD1 3.82Å; F376-L380 HydrophobicContact CZ-CD2 3.84Å; F376-L380 HydrophobicContact CZ-CG 4.07Å; F376-L380 WeakPolarHBondContact O-CA 3.07Å; F376-L380 WeakPolarHBondContact O-CB 3.41Å; F376-L380 PolarHBondContact O-N 2.91Å
377H97.8Very high94.4Very high39 Ų3920.3 Ų20.318%0.18111%0.106CC..Hα-helixtrans-70.6-28175.5-73.681.5000112.7V373 A374 H375 S381 M382 F424V373-H377 PolarHBondContact O-N 3.41Å; V373-H377 PolarHBondContact O-ND1 2.93Å; A374-H377 PolarHBondContact O-N 3.46Å; H375-H377 PolarHBondContact O-N 2.98Å; H377-S381 CarbonylContact O-C 3.5Å; H377-S381 VanDerWaalsContact O-CA 3.29Å; H377-S381 WeakPolarHBondContact O-CA 3.35Å; H377-S381 WeakPolarHBondContact O-CB 3.49Å; H377-S381 PolarHBondContact O-N 3.05Å; H377-M382 PolarHBondContact O-N 3.03Å; H377-F424 HydrophobicContact CB-CB 4.47Å; H377-F424 HydrophobicContact CB-CD1 3.44Å; H377-F424 VanDerWaalsContact CB-CD1 3.44Å; H377-F424 HydrophobicContact CB-CD2 4.01Å; H377-F424 HydrophobicContact CB-CE1 3.51Å; H377-F424 HydrophobicContact CB-CE2 4.06Å; H377-F424 HydrophobicContact CB-CG 3.71Å; H377-F424 HydrophobicContact CB-CZ 3.83Å; H377-F424 AromaticContact CD2-CE1 3.21Å; H377-F424 WeakPolarHBondContact CD2-CE1 3.26Å; H377-F424 AromaticContact CD2-CZ 3.33Å; H377-F424 WeakPolarHBondContact CD2-CZ 3.27Å; H377-F424 AromaticContact CG-CD1 3.7Å; H377-F424 AromaticContact CG-CE1 3.33Å; H377-F424 AromaticContact CG-CZ 3.78Å; H377-F424 AromaticContact NE2-CE1 3.95Å
378Y97.2Very high94.4Very high1 Ų118.9 Ų18.90%0.00410%0.1CC..Hα-helixtrans-67-39.9169.7-91.7-94.8000113.1L346 V349 A374 H375 F376 M382 G383 N421 F424 F425 H428L346-Y378 HydrophobicContact CB-CD1 4.29Å; L346-Y378 HydrophobicContact CB-CE1 4.46Å; L346-Y378 HydrophobicContact CD2-CD1 4.42Å; L346-Y378 HydrophobicContact CD2-CE1 3.76Å; L346-Y378 WeakPolarHBondContact O-CD1 3.28Å; V349-Y378 HydrophobicContact CB-CD1 4.14Å; V349-Y378 HydrophobicContact CB-CE1 4.26Å; V349-Y378 HydrophobicContact CG1-CD1 3.98Å; V349-Y378 HydrophobicContact CG1-CE1 3.89Å; A374-Y378 WeakPolarHBondContact O-CD2 3.32Å; A374-Y378 PolarHBondContact O-N 2.96Å; H375-Y378 PolarHBondContact O-N 3.08Å; H375-Y378 VanDerWaalsContact O-N 3.14Å; F376-Y378 VanDerWaalsContact C-N 3.34Å; F376-Y378 PolarHBondContact O-N 3.44Å; Y378-M382 HydrophobicContact CD1-CE 3.48Å; Y378-M382 VanDerWaalsContact CD1-CE 3.48Å; Y378-M382 HydrophobicContact CD1-SD 3.77Å; Y378-M382 HydrophobicContact CD2-CE 3.27Å; Y378-M382 HydrophobicContact CE1-CE 3.56Å; Y378-M382 HydrophobicContact CE1-SD 3.63Å; Y378-M382 HydrophobicContact CE2-CE 3.35Å; Y378-M382 HydrophobicContact CE2-SD 4.43Å; Y378-M382 HydrophobicContact CG-CE 3.33Å; Y378-M382 HydrophobicContact CG-SD 4.23Å; Y378-M382 VanDerWaalsContact CZ-CE 3.47Å; Y378-M382 CarbonylContact O-C 3.47Å; Y378-M382 VanDerWaalsContact O-CB 3.29Å; Y378-M382 WeakPolarHBondContact O-CB 3.34Å; Y378-G383 PolarHBondContact O-N 3.24Å; Y378-N421 PolarHBondContact OH-OD1 2.94Å; Y378-F424 HydrophobicContact CD2-CB 4.01Å; Y378-F424 HydrophobicContact CE2-CB 3.65Å; Y378-F425 WeakPolarHBondContact OH-CB 3.48Å; Y378-H428 AromaticContact CD2-CE1 3.55Å; Y378-H428 AromaticContact CE2-CE1 3.56Å
379V93.5Very high94.4Very high26 Ų2617 Ų1716%0.1589%0.088CC..Hα-helixtrans-85.4-31.4179.1-60.60000113.4F347 H375 F376 G383F347-V379 HydrophobicContact CD2-CB 4.35Å; F347-V379 HydrophobicContact CD2-CG1 4.39Å; F347-V379 HydrophobicContact CE2-CB 4.1Å; F347-V379 HydrophobicContact CE2-CG1 4.2Å; H375-V379 PolarHBondContact O-N 3.3Å; H375-V379 VanDerWaalsContact O-N 3.08Å; F376-V379 HydrophobicContact CD2-CG2 4.22Å; F376-V379 WeakPolarHBondContact O-CG2 3.14Å; F376-V379 PolarHBondContact O-N 3.49Å; V379-G383 WeakPolarHBondContact O-CA 3.45Å; V379-G383 PolarHBondContact O-N 3.11Å
380L84.3Confident94.4Very high21 Ų2116.5 Ų16.511%0.119%0.086CC..Iπ-helixtrans-91-61.8179.2-168.390.6000112I65 L245 F376 A384 V385I65-L380 HydrophobicContact CG1-CD2 4.43Å; L245-L380 HydrophobicContact CB-CD1 3.88Å; L245-L380 HydrophobicContact CD1-CD1 3.39Å; L245-L380 HydrophobicContact CG-CD1 4.24Å; F376-L380 HydrophobicContact CD1-CB 4.4Å; F376-L380 HydrophobicContact CD2-CB 4.44Å; F376-L380 HydrophobicContact CE1-CB 4.12Å; F376-L380 HydrophobicContact CE1-CD2 3.69Å; F376-L380 HydrophobicContact CE1-CG 4.3Å; F376-L380 HydrophobicContact CE2-CB 4.13Å; F376-L380 HydrophobicContact CE2-CD1 4.24Å; F376-L380 HydrophobicContact CZ-CB 3.98Å; F376-L380 HydrophobicContact CZ-CD1 3.82Å; F376-L380 HydrophobicContact CZ-CD2 3.84Å; F376-L380 HydrophobicContact CZ-CG 4.07Å; F376-L380 WeakPolarHBondContact O-CA 3.07Å; F376-L380 WeakPolarHBondContact O-CB 3.41Å; F376-L380 PolarHBondContact O-N 2.91Å; L380-A384 WeakPolarHBondContact O-CA 3.32Å; L380-A384 VanDerWaalsContact O-CB 3.23Å; L380-A384 WeakPolarHBondContact O-CB 3.45Å; L380-A384 PolarHBondContact O-N 3.42Å; L380-V385 PolarHBondContact O-N 2.65Å
381S76.1Confident94.4Very high25 Ų2516 Ų1618%0.1758%0.084CC..Iπ-helixtrans-65.8-50.1-178.8-170.30000110.6H377 V385H377-S381 CarbonylContact O-C 3.5Å; H377-S381 VanDerWaalsContact O-CA 3.29Å; H377-S381 WeakPolarHBondContact O-CA 3.35Å; H377-S381 WeakPolarHBondContact O-CB 3.49Å; H377-S381 PolarHBondContact O-N 3.05Å; S381-V385 WeakPolarHBondContact O-CB 3.49Å; S381-V385 PolarHBondContact O-N 3.31Å
382M81.5Confident94.4Very high0 Ų016.8 Ų16.80%09%0.088CC..Iπ-helixtrans-84.7-9.7-179.6-68.6172-94.800114L346 H377 Y378 F386 V420 F424L346-M382 HydrophobicContact CB-CB 3.7Å; L346-M382 HydrophobicContact CB-CG 4.28Å; L346-M382 HydrophobicContact CB-SD 3.96Å; L346-M382 HydrophobicContact CD1-CB 4Å; L346-M382 HydrophobicContact CD1-CG 3.84Å; L346-M382 HydrophobicContact CD1-SD 3.61Å; L346-M382 HydrophobicContact CD2-SD 3.87Å; L346-M382 HydrophobicContact CG-CB 4.44Å; L346-M382 HydrophobicContact CG-SD 4Å; H377-M382 PolarHBondContact O-N 3.03Å; Y378-M382 HydrophobicContact CD1-CE 3.48Å; Y378-M382 VanDerWaalsContact CD1-CE 3.48Å; Y378-M382 HydrophobicContact CD1-SD 3.77Å; Y378-M382 HydrophobicContact CD2-CE 3.27Å; Y378-M382 HydrophobicContact CE1-CE 3.56Å; Y378-M382 HydrophobicContact CE1-SD 3.63Å; Y378-M382 HydrophobicContact CE2-CE 3.35Å; Y378-M382 HydrophobicContact CE2-SD 4.43Å; Y378-M382 HydrophobicContact CG-CE 3.33Å; Y378-M382 HydrophobicContact CG-SD 4.23Å; Y378-M382 VanDerWaalsContact CZ-CE 3.47Å; Y378-M382 CarbonylContact O-C 3.47Å; Y378-M382 VanDerWaalsContact O-CB 3.29Å; Y378-M382 WeakPolarHBondContact O-CB 3.34Å; M382-F386 HydrophobicContact CB-CD2 4.39Å; M382-F386 HydrophobicContact CB-CE2 4.46Å; M382-F386 HydrophobicContact CG-CD2 4.4Å; M382-F386 HydrophobicContact CG-CE2 4.02Å; M382-F386 VanDerWaalsContact O-CB 3.3Å; M382-F386 WeakPolarHBondContact O-CB 3.48Å; M382-F386 WeakPolarHBondContact O-CG 3.48Å; M382-V420 HydrophobicContact CG-CB 4.19Å; M382-V420 HydrophobicContact CG-CG2 3.75Å; M382-V420 HydrophobicContact SD-CB 4.16Å; M382-V420 HydrophobicContact SD-CG2 3.64Å; M382-F424 HydrophobicContact CE-CB 3.85Å; M382-F424 HydrophobicContact CE-CD2 3.58Å; M382-F424 HydrophobicContact CE-CG 4.1Å
383G87.4Confident94.4Very high0 Ų015.8 Ų15.80%08%0.081CC..Iπ-helixtrans-89.8-74.9167.300000112F343 Y378 V379 F386 A387F343-G383 WeakPolarHBondContact CD2-O 3.47Å; F343-G383 VanDerWaalsContact CE2-CA 3.48Å; F343-G383 VanDerWaalsContact CE2-O 3.27Å; F343-G383 WeakPolarHBondContact CE2-O 3.17Å; Y378-G383 PolarHBondContact O-N 3.24Å; V379-G383 WeakPolarHBondContact O-CA 3.45Å; V379-G383 PolarHBondContact O-N 3.11Å; G383-F386 PolarHBondContact O-N 3.47Å; G383-A387 WeakPolarHBondContact O-CB 3.29Å; G383-A387 PolarHBondContact O-N 3.34Å
384A93.3Very high94.3Very high0 Ų014.7 Ų14.70%07%0.074CC..Iπ-helixtrans-61.4-49.2-173.900000113.1V69 M73 L245 L380 F386 A387 I388V69-A384 HydrophobicContact CG1-CB 3.8Å; M73-A384 HydrophobicContact CE-CB 4.04Å; M73-A384 HydrophobicContact SD-CB 4.36Å; L245-A384 WeakPolarHBondContact O-CB 3.48Å; L380-A384 WeakPolarHBondContact O-CA 3.32Å; L380-A384 VanDerWaalsContact O-CB 3.23Å; L380-A384 WeakPolarHBondContact O-CB 3.45Å; L380-A384 PolarHBondContact O-N 3.42Å; A384-F386 PolarHBondContact O-N 3.41Å; A384-A387 PolarHBondContact O-N 2.92Å; A384-I388 WeakPolarHBondContact O-CB 3.37Å; A384-I388 VanDerWaalsContact O-CG1 3.27Å; A384-I388 WeakPolarHBondContact O-CG1 3.27Å; A384-I388 PolarHBondContact O-N 2.94Å
385V95.6Very high94.3Very high19 Ų1914.7 Ų14.712%0.1157%0.074CC..Iπ-helixtrans-67.8-38.1-176.9-173.20000111.2M68 L380 S381 I388 M389M68-V385 HydrophobicContact CE-CG1 4.31Å; M68-V385 HydrophobicContact CE-CG2 4.23Å; L380-V385 PolarHBondContact O-N 2.65Å; S381-V385 WeakPolarHBondContact O-CB 3.49Å; S381-V385 PolarHBondContact O-N 3.31Å; V385-I388 WeakPolarHBondContact O-CB 3.25Å; V385-I388 PolarHBondContact O-N 2.88Å; V385-M389 HydrophobicContact CG1-CE 4Å; V385-M389 HydrophobicContact CG1-CG 4.25Å; V385-M389 VanDerWaalsContact O-CG 3.25Å; V385-M389 WeakPolarHBondContact O-CG 3.24Å; V385-M389 PolarHBondContact O-N 3.3Å
386F97.9Very high94.2Very high2 Ų213.4 Ų13.41%0.0097%0.068CC..Hα-helixtrans-66-39.7176.2-86.5-125.6000112W339 F343 L346 M382 G383 A384 M389 G390 F413 M416 F417 V420W339-F386 HydrophobicContact CE3-CB 4.09Å; W339-F386 AromaticContact CE3-CD1 3.57Å; W339-F386 HydrophobicContact CE3-CD1 3.57Å; W339-F386 HydrophobicContact CE3-CD2 4.21Å; W339-F386 AromaticContact CE3-CE1 3.93Å; W339-F386 HydrophobicContact CE3-CE1 3.93Å; W339-F386 AromaticContact CE3-CG 3.71Å; W339-F386 HydrophobicContact CE3-CG 3.71Å; W339-F386 HydrophobicContact CE3-CZ 4.4Å; W339-F386 AromaticContact CZ3-CD1 3.87Å; W339-F386 HydrophobicContact CZ3-CD1 3.87Å; W339-F386 AromaticContact CZ3-CD2 3.82Å; W339-F386 HydrophobicContact CZ3-CD2 3.82Å; W339-F386 AromaticContact CZ3-CE1 3.9Å; W339-F386 HydrophobicContact CZ3-CE1 3.9Å; W339-F386 AromaticContact CZ3-CE2 3.86Å; W339-F386 HydrophobicContact CZ3-CE2 3.86Å; W339-F386 AromaticContact CZ3-CG 3.82Å; W339-F386 HydrophobicContact CZ3-CG 3.82Å; W339-F386 AromaticContact CZ3-CZ 3.9Å; W339-F386 HydrophobicContact CZ3-CZ 3.9Å; F343-F386 HydrophobicContact CB-CB 4.17Å; F343-F386 HydrophobicContact CD2-CB 4.44Å; L346-F386 HydrophobicContact CD1-CD1 4.34Å; L346-F386 HydrophobicContact CD1-CE1 3.67Å; L346-F386 HydrophobicContact CD1-CZ 3.78Å; M382-F386 HydrophobicContact CB-CD2 4.39Å; M382-F386 HydrophobicContact CB-CE2 4.46Å; M382-F386 HydrophobicContact CG-CD2 4.4Å; M382-F386 HydrophobicContact CG-CE2 4.02Å; M382-F386 VanDerWaalsContact O-CB 3.3Å; M382-F386 WeakPolarHBondContact O-CB 3.48Å; M382-F386 WeakPolarHBondContact O-CG 3.48Å; G383-F386 PolarHBondContact O-N 3.47Å; A384-F386 PolarHBondContact O-N 3.41Å; F386-M389 PolarHBondContact O-N 2.8Å; F386-G390 PolarHBondContact O-N 2.94Å; F386-F413 HydrophobicContact CE1-CE2 4.07Å; F386-M416 HydrophobicContact CE2-CG 4.21Å; F386-M416 HydrophobicContact CZ-CG 4.43Å; F386-F417 HydrophobicContact CE1-CD2 4.08Å; F386-F417 HydrophobicContact CZ-CD2 4.4Å; F386-V420 HydrophobicContact CE2-CG2 4.03Å; F386-V420 HydrophobicContact CZ-CG2 3.94Å
387A98.3Very high94.2Very high0 Ų012.1 Ų12.10%07%0.065CC..Hα-helixtrans-65.2-40.217400000111.6G249 M252 I253 F343 G383 A384 G391G249-A387 VanDerWaalsContact CA-CB 3.48Å; M252-A387 HydrophobicContact CE-CB 3.99Å; I253-A387 HydrophobicContact CD1-CB 4.21Å; I253-A387 HydrophobicContact CG1-CB 4.15Å; F343-A387 HydrophobicContact CD2-CB 4.17Å; F343-A387 HydrophobicContact CE2-CB 4.22Å; G383-A387 WeakPolarHBondContact O-CB 3.29Å; G383-A387 PolarHBondContact O-N 3.34Å; A384-A387 PolarHBondContact O-N 2.92Å; A387-G391 PolarHBondContact O-N 3.36Å
388I98.4Very high94.1Very high8 Ų810.3 Ų10.34%0.0416%0.056CC..Hα-helixtrans-58.9-47.5172.1-73.3167.1000110.9V69 I72 M73 F77 A384 V385 G391 F392V69-I388 HydrophobicContact CG1-CD1 4.48Å; I72-I388 HydrophobicContact CB-CD1 4.19Å; I72-I388 HydrophobicContact CD1-CG2 4.5Å; I72-I388 HydrophobicContact CG2-CB 4.37Å; I72-I388 HydrophobicContact CG2-CD1 3.94Å; I72-I388 HydrophobicContact CG2-CG1 3.83Å; I72-I388 HydrophobicContact CG2-CG2 3.67Å; M73-I388 HydrophobicContact CG-CD1 3.83Å; M73-I388 HydrophobicContact CG-CG1 3.58Å; M73-I388 HydrophobicContact SD-CD1 4.41Å; M73-I388 HydrophobicContact SD-CG1 4.15Å; F77-I388 HydrophobicContact CE2-CG2 4.44Å; A384-I388 WeakPolarHBondContact O-CB 3.37Å; A384-I388 VanDerWaalsContact O-CG1 3.27Å; A384-I388 WeakPolarHBondContact O-CG1 3.27Å; A384-I388 PolarHBondContact O-N 2.94Å; V385-I388 WeakPolarHBondContact O-CB 3.25Å; V385-I388 PolarHBondContact O-N 2.88Å; I388-G391 PolarHBondContact O-N 2.92Å; I388-F392 WeakPolarHBondContact O-CB 3.46Å; I388-F392 PolarHBondContact O-N 2.9Å
389M98.2Very high94.1Very high31 Ų3111.6 Ų11.615%0.1536%0.062CC..Hα-helixtrans-68.5-42.1-178.5-67.1-60162.100111.9W339 V385 F386 F392 I393 M467W339-M389 HydrophobicContact CD2-CB 3.68Å; W339-M389 HydrophobicContact CE3-CB 3.64Å; W339-M389 HydrophobicContact CE3-CG 4.36Å; W339-M389 HydrophobicContact CG-CB 4.36Å; W339-M389 HydrophobicContact CH2-CB 3.92Å; W339-M389 HydrophobicContact CH2-CG 3.95Å; W339-M389 HydrophobicContact CZ2-CB 3.99Å; W339-M389 HydrophobicContact CZ2-CG 4.35Å; W339-M389 HydrophobicContact CZ3-CB 3.75Å; W339-M389 HydrophobicContact CZ3-CG 3.97Å; V385-M389 HydrophobicContact CG1-CE 4Å; V385-M389 HydrophobicContact CG1-CG 4.25Å; V385-M389 VanDerWaalsContact O-CG 3.25Å; V385-M389 WeakPolarHBondContact O-CG 3.24Å; V385-M389 PolarHBondContact O-N 3.3Å; F386-M389 PolarHBondContact O-N 2.8Å; M389-F392 PolarHBondContact O-N 3.21Å; M389-I393 WeakPolarHBondContact O-CB 3.4Å; M389-I393 WeakPolarHBondContact O-CG1 3.47Å; M389-I393 PolarHBondContact O-N 3.47Å; M389-M467 HydrophobicContact CE-CE 4.49Å; M389-M467 HydrophobicContact SD-CE 3.26Å; M389-M467 WeakPolarHBondContact SD-CE 3.33Å
390G98.3Very high94.2Very high0 Ų011.4 Ų11.40%06%0.062CC..Hα-helixtrans-61.3-46.3173.700000111.9F386 I393 H394F386-G390 PolarHBondContact O-N 2.94Å; G390-I393 PolarHBondContact O-N 2.9Å; G390-H394 VanDerWaalsContact O-CB 3.32Å; G390-H394 WeakPolarHBondContact O-CB 3.32Å; G390-H394 PolarHBondContact O-N 2.83Å
391G98.1Very high94.7Very high0 Ų010.8 Ų10.80%06%0.06CC..Hα-helixtrans-63.6-44.117600000112A387 I388 I393 H394 W395A387-G391 PolarHBondContact O-N 3.36Å; I388-G391 PolarHBondContact O-N 2.92Å; G391-I393 PolarHBondContact O-N 3.33Å; G391-H394 PolarHBondContact O-N 2.93Å; G391-W395 PolarHBondContact O-N 2.99Å
392F98.3Very high95.6Very high38 Ų3811.9 Ų11.917%0.1676%0.061CC..Hα-helixtrans-61-49.5178.2-179.4-99.9000110.1F77 I388 M389 H394 W395 F396 L404 M467 I471F77-F392 HydrophobicContact CZ-CB 4.23Å; I388-F392 WeakPolarHBondContact O-CB 3.46Å; I388-F392 PolarHBondContact O-N 2.9Å; M389-F392 PolarHBondContact O-N 3.21Å; F392-H394 VanDerWaalsContact C-N 3.3Å; F392-H394 PolarHBondContact O-N 3.33Å; F392-W395 PolarHBondContact O-N 3.43Å; F392-F396 AromaticContact CE1-CD2 3.75Å; F392-F396 HydrophobicContact CE1-CD2 3.75Å; F392-F396 HydrophobicContact CE1-CE2 4.29Å; F392-F396 HydrophobicContact CE1-CG 4.44Å; F392-F396 AromaticContact CE2-CD2 3.85Å; F392-F396 HydrophobicContact CE2-CD2 3.85Å; F392-F396 HydrophobicContact CE2-CE2 4.47Å; F392-F396 AromaticContact CZ-CD2 3.33Å; F392-F396 HydrophobicContact CZ-CD2 3.33Å; F392-F396 AromaticContact CZ-CE2 3.73Å; F392-F396 HydrophobicContact CZ-CE2 3.73Å; F392-F396 HydrophobicContact CZ-CG 4.38Å; F392-F396 WeakPolarHBondContact O-CA 3.27Å; F392-F396 WeakPolarHBondContact O-CB 3.38Å; F392-F396 PolarHBondContact O-N 3.5Å; F392-L404 HydrophobicContact CE1-CD1 4.32Å; F392-M467 HydrophobicContact CD1-CE 4.01Å; F392-M467 HydrophobicContact CD1-SD 4.27Å; F392-M467 HydrophobicContact CE1-CE 4.31Å; F392-M467 HydrophobicContact CE1-SD 3.96Å; F392-I471 HydrophobicContact CE1-CD1 4.08Å; F392-I471 HydrophobicContact CE1-CG1 4.06Å; F392-I471 HydrophobicContact CZ-CD1 3.76Å; F392-I471 HydrophobicContact CZ-CG1 3.94Å
393I97.7Very high96.3Very high8 Ų814.1 Ų14.14%0.0418%0.075CC..Hα-helixtrans-63.1-37.6178.5-69.4164.2000111.7A335 A336 W339 M389 G390 G391 L404A335-I393 HydrophobicContact CB-CD1 4.41Å; A335-I393 HydrophobicContact CB-CG2 4.2Å; A336-I393 HydrophobicContact CB-CG2 4.14Å; W339-I393 VanDerWaalsContact CD1-CD1 3.4Å; W339-I393 HydrophobicContact CG-CD1 4.49Å; M389-I393 WeakPolarHBondContact O-CB 3.4Å; M389-I393 WeakPolarHBondContact O-CG1 3.47Å; M389-I393 PolarHBondContact O-N 3.47Å; G390-I393 PolarHBondContact O-N 2.9Å; G391-I393 PolarHBondContact O-N 3.33Å; I393-L404 HydrophobicContact CB-CD1 4.45Å; I393-L404 HydrophobicContact CG1-CD1 3.91Å
394H96.6Very high96.7Very high6 Ų614.6 Ų14.63%0.0288%0.077CC..Hα-helixtrans-68-47.6178.6177.449.6000112.6I256 Y259 Y260 A336 G390 G391 F392 P397 W493I256-H394 HydrophobicContact CD1-CB 4.46Å; I256-H394 HydrophobicContact CG1-CB 4.06Å; Y259-H394 AromaticContact CD1-CE1 3.75Å; Y259-H394 AromaticContact CG-CE1 3.71Å; Y260-H394 AromaticContact CE2-ND1 3.82Å; A336-H394 HydrophobicContact CB-CB 4.22Å; G390-H394 VanDerWaalsContact O-CB 3.32Å; G390-H394 WeakPolarHBondContact O-CB 3.32Å; G390-H394 PolarHBondContact O-N 2.83Å; G391-H394 PolarHBondContact O-N 2.93Å; F392-H394 VanDerWaalsContact C-N 3.3Å; F392-H394 PolarHBondContact O-N 3.33Å; H394-P397 WeakPolarHBondContact O-CD 3.41Å; H394-W493 AromaticContact CE1-CZ2 3.84Å; H394-W493 AromaticContact NE2-CZ2 3.99Å; H394-W493 WeakPolarHBondContact O-CH2 3.43Å
395W97.4Very high96.8Very high0 Ų016.8 Ų16.80%09%0.089CC..Hα-helixtrans-97.6-0.6-175.9-67.9-67.8000114.6F77 L81 M85 M252 H255 G391 F392 P397 L398 F399 W493F77-W395 AromaticContact CD1-CE3 3.91Å; F77-W395 HydrophobicContact CD1-CE3 3.91Å; F77-W395 HydrophobicContact CD1-CZ3 4.39Å; F77-W395 AromaticContact CE1-CE3 3.71Å; F77-W395 HydrophobicContact CE1-CE3 3.71Å; F77-W395 HydrophobicContact CE1-CZ3 4.39Å; L81-W395 HydrophobicContact CD1-CD2 3.71Å; L81-W395 HydrophobicContact CD1-CE3 3.83Å; L81-W395 HydrophobicContact CD1-CG 4.35Å; L81-W395 HydrophobicContact CD1-CH2 4.02Å; L81-W395 HydrophobicContact CD1-CZ2 3.87Å; L81-W395 HydrophobicContact CD1-CZ3 4Å; L81-W395 HydrophobicContact CD2-CD2 4.26Å; L81-W395 HydrophobicContact CD2-CG 4.08Å; M85-W395 HydrophobicContact CE-CZ2 3.73Å; M252-W395 HydrophobicContact CB-CH2 4.14Å; M252-W395 HydrophobicContact CB-CZ3 3.97Å; M252-W395 HydrophobicContact CG-CH2 4.01Å; M252-W395 HydrophobicContact CG-CZ3 3.67Å; M252-W395 HydrophobicContact SD-CZ3 4.04Å; H255-W395 HydrophobicContact CB-CH2 4.07Å; H255-W395 HydrophobicContact CB-CZ2 3.97Å; G391-W395 PolarHBondContact O-N 2.99Å; F392-W395 PolarHBondContact O-N 3.43Å; W395-P397 VanDerWaalsContact C-CD 3.43Å; W395-P397 VanDerWaalsContact C-N 3.29Å; W395-L398 HydrophobicContact CB-CB 4.39Å; W395-L398 WeakPolarHBondContact O-CA 3.37Å; W395-L398 VanDerWaalsContact O-CB 3.23Å; W395-L398 WeakPolarHBondContact O-CB 3.43Å; W395-L398 PolarHBondContact O-N 3.39Å; W395-F399 HydrophobicContact CB-CD2 4.39Å; W395-F399 HydrophobicContact CB-CE1 3.89Å; W395-F399 HydrophobicContact CB-CE2 3.7Å; W395-F399 HydrophobicContact CB-CZ 3.41Å; W395-F399 VanDerWaalsContact CB-CZ 3.41Å; W395-F399 HydrophobicContact CG-CZ 4.28Å; W395-F399 WeakPolarHBondContact O-CD2 3.21Å; W395-F399 WeakPolarHBondContact O-CG 3.31Å; W395-F399 PolarHBondContact O-N 2.99Å; W395-W493 AromaticContact CD1-CH2 3.91Å; W395-W493 AromaticContact CD1-CZ2 3.4Å; W395-W493 HydrophobicContact CG-CZ2 4.36Å; W395-W493 AromaticContact NE1-CZ2 3.83Å
396F97.1Very high96.8Very high8 Ų819.6 Ų19.64%0.03510%0.101CC..Hα-helixtrans-53.3-41.5174.3-178.6-97.1000112.9F392 L398 F399 S400 Y402 L404 A474 F475F392-F396 AromaticContact CE1-CD2 3.75Å; F392-F396 HydrophobicContact CE1-CD2 3.75Å; F392-F396 HydrophobicContact CE1-CE2 4.29Å; F392-F396 HydrophobicContact CE1-CG 4.44Å; F392-F396 AromaticContact CE2-CD2 3.85Å; F392-F396 HydrophobicContact CE2-CD2 3.85Å; F392-F396 HydrophobicContact CE2-CE2 4.47Å; F392-F396 AromaticContact CZ-CD2 3.33Å; F392-F396 HydrophobicContact CZ-CD2 3.33Å; F392-F396 AromaticContact CZ-CE2 3.73Å; F392-F396 HydrophobicContact CZ-CE2 3.73Å; F392-F396 HydrophobicContact CZ-CG 4.38Å; F392-F396 WeakPolarHBondContact O-CA 3.27Å; F392-F396 WeakPolarHBondContact O-CB 3.38Å; F392-F396 PolarHBondContact O-N 3.5Å; F396-L398 VanDerWaalsContact C-N 3.31Å; F396-L398 PolarHBondContact O-N 2.7Å; F396-F399 PolarHBondContact O-N 3.12Å; F396-S400 WeakPolarHBondContact CE1-OG 3.44Å; F396-S400 WeakPolarHBondContact O-CB 3.41Å; F396-S400 PolarHBondContact O-N 3.1Å; F396-S400 PolarHBondContact O-OG 3.15Å; F396-Y402 VanDerWaalsContact CD1-O 3.3Å; F396-Y402 WeakPolarHBondContact CD1-O 3.24Å; F396-L404 HydrophobicContact CB-CD1 4.23Å; F396-L404 HydrophobicContact CB-CG 4.44Å; F396-L404 HydrophobicContact CD1-CD1 4.24Å; F396-L404 HydrophobicContact CD1-CD2 3.82Å; F396-L404 HydrophobicContact CD1-CG 3.57Å; F396-L404 HydrophobicContact CE1-CD2 3.61Å; F396-L404 HydrophobicContact CE1-CG 3.89Å; F396-L404 HydrophobicContact CE2-CD2 4.36Å; F396-L404 HydrophobicContact CG-CD1 4.16Å; F396-L404 HydrophobicContact CG-CD2 4.27Å; F396-L404 HydrophobicContact CG-CG 3.99Å; F396-L404 HydrophobicContact CZ-CD2 3.9Å; F396-A474 HydrophobicContact CE1-CB 3.8Å; F396-A474 HydrophobicContact CZ-CB 3.94Å; F396-F475 HydrophobicContact CE2-CE2 4.31Å; F396-F475 HydrophobicContact CZ-CE2 4.09Å; F396-F475 HydrophobicContact CZ-CZ 4.45Å
397P95.7Very high96.8Very high23 Ų2323.8 Ų23.815%0.14913%0.127CC..Hα-helixtrans-57.4-41.1170.7-26.738.2000113.5H394 W395 G401 Y402 V481 W493 C497H394-P397 WeakPolarHBondContact O-CD 3.41Å; W395-P397 VanDerWaalsContact C-CD 3.43Å; W395-P397 VanDerWaalsContact C-N 3.29Å; P397-G401 VanDerWaalsContact O-CA 3.25Å; P397-G401 WeakPolarHBondContact O-CA 3.45Å; P397-G401 PolarHBondContact O-N 2.93Å; P397-Y402 VanDerWaalsContact CA-O 3.27Å; P397-Y402 WeakPolarHBondContact CA-O 3.44Å; P397-V481 HydrophobicContact CB-CG2 3.6Å; P397-W493 HydrophobicContact CB-CZ3 4.33Å; P397-C497 WeakPolarHBondContact O-CB 3.37Å
398L95.8Very high96.8Very high0 Ų028.1 Ų28.10%014%0.144CC..Hα-helixtrans-63.7-43.8178.4-173.764.4000111.6L81 L84 W395 F396 E492 W493 P498 P499L81-L398 HydrophobicContact CD2-CD2 3.72Å; L84-L398 HydrophobicContact CD1-CD2 4.17Å; W395-L398 HydrophobicContact CB-CB 4.39Å; W395-L398 WeakPolarHBondContact O-CA 3.37Å; W395-L398 VanDerWaalsContact O-CB 3.23Å; W395-L398 WeakPolarHBondContact O-CB 3.43Å; W395-L398 PolarHBondContact O-N 3.39Å; F396-L398 VanDerWaalsContact C-N 3.31Å; F396-L398 PolarHBondContact O-N 2.7Å; L398-E492 WeakPolarHBondContact CD1-O 3.43Å; L398-E492 HydrophobicContact CD2-CB 4.14Å; L398-E492 HydrophobicContact CD2-CG 4.19Å; L398-W493 HydrophobicContact CB-CE3 4.21Å; L398-W493 HydrophobicContact CB-CH2 3.79Å; L398-W493 HydrophobicContact CB-CZ3 3.54Å; L398-W493 HydrophobicContact CD1-CE3 3.98Å; L398-W493 HydrophobicContact CD1-CZ3 4.18Å; L398-W493 HydrophobicContact CG-CZ3 4.37Å; L398-P498 WeakPolarHBondContact O-CA 3.3Å; L398-P499 HydrophobicContact CD1-CG 4.4Å; L398-P499 WeakPolarHBondContact O-CD 3.25Å
399F96.3Very high96.7Very high29 Ų2927.7 Ų27.713%0.12714%0.142CC..Hα-helixtrans-75.1-37.5-175.8-53.3-30.3000112.8L19 F77 W80 L81 W395 F396L19-F399 HydrophobicContact CD1-CD2 4.11Å; L19-F399 HydrophobicContact CD1-CE2 4.08Å; F77-F399 HydrophobicContact CD1-CE2 4.21Å; F77-F399 AromaticContact CD1-CZ 3.79Å; F77-F399 HydrophobicContact CD1-CZ 3.79Å; F77-F399 AromaticContact CE1-CE2 3.71Å; F77-F399 HydrophobicContact CE1-CE2 3.71Å; F77-F399 AromaticContact CE1-CZ 3.72Å; F77-F399 HydrophobicContact CE1-CZ 3.72Å; W80-F399 HydrophobicContact CB-CD1 4.46Å; W80-F399 HydrophobicContact CB-CE1 3.78Å; W80-F399 HydrophobicContact CB-CZ 4.42Å; W80-F399 AromaticContact CD2-CD1 3.58Å; W80-F399 HydrophobicContact CD2-CD1 3.58Å; W80-F399 AromaticContact CD2-CE1 3.82Å; W80-F399 HydrophobicContact CD2-CE1 3.82Å; W80-F399 AromaticContact CE2-CD1 3.89Å; W80-F399 AromaticContact CE3-CD1 3.75Å; W80-F399 HydrophobicContact CE3-CD1 3.75Å; W80-F399 HydrophobicContact CE3-CE1 4.07Å; W80-F399 AromaticContact CG-CD1 3.92Å; W80-F399 HydrophobicContact CG-CD1 3.92Å; W80-F399 AromaticContact CG-CE1 3.7Å; W80-F399 HydrophobicContact CG-CE1 3.7Å; W80-F399 HydrophobicContact CG-CZ 4.48Å; W80-F399 HydrophobicContact CH2-CD1 4.43Å; W80-F399 HydrophobicContact CZ2-CB 4.46Å; W80-F399 HydrophobicContact CZ2-CD1 4.31Å; W80-F399 HydrophobicContact CZ3-CD1 4.17Å; L81-F399 HydrophobicContact CD2-CE1 4.22Å; W395-F399 HydrophobicContact CB-CD2 4.39Å; W395-F399 HydrophobicContact CB-CE1 3.89Å; W395-F399 HydrophobicContact CB-CE2 3.7Å; W395-F399 HydrophobicContact CB-CZ 3.41Å; W395-F399 VanDerWaalsContact CB-CZ 3.41Å; W395-F399 HydrophobicContact CG-CZ 4.28Å; W395-F399 WeakPolarHBondContact O-CD2 3.21Å; W395-F399 WeakPolarHBondContact O-CG 3.31Å; W395-F399 PolarHBondContact O-N 2.99Å; F396-F399 PolarHBondContact O-N 3.12Å
400S96Very high96.8Very high21 Ų2130 Ų3015%0.14715%0.151CC..Hα-helixtrans-110.8-21.9-168.470.50000114.9F396 Y402F396-S400 WeakPolarHBondContact CE1-OG 3.44Å; F396-S400 WeakPolarHBondContact O-CB 3.41Å; F396-S400 PolarHBondContact O-N 3.1Å; F396-S400 PolarHBondContact O-OG 3.15Å; S400-Y402 PolarHBondContact O-N 3.48Å; S400-Y402 PolarHBondContact OG-N 3.13Å; S400-Y402 VanDerWaalsContact OG-N 3.07Å; S400-Y402 PolarHBondContact OG-O 3.4Å
401G94.9Very high96.8Very high8 Ų833.6 Ų33.68%0.08217%0.169CC..SBendtrans753.9-167.300000115P397 V481 C497P397-G401 VanDerWaalsContact O-CA 3.25Å; P397-G401 WeakPolarHBondContact O-CA 3.45Å; P397-G401 PolarHBondContact O-N 2.93Å; G401-V481 PolarHBondContact O-N 3.45Å; G401-C497 VanDerWaalsContact CA-O 3.3Å; G401-C497 WeakPolarHBondContact CA-O 3.47Å
402Y95.6Very high96.8Very high49 Ų4933.6 Ų33.619%0.19217%0.169CC..BIsolated β-bridgetrans-116.6159.3-179.8-58-58.5000112.7F396 P397 S400 F475 K478 R479 K480F396-Y402 VanDerWaalsContact CD1-O 3.3Å; F396-Y402 WeakPolarHBondContact CD1-O 3.24Å; P397-Y402 VanDerWaalsContact CA-O 3.27Å; P397-Y402 WeakPolarHBondContact CA-O 3.44Å; S400-Y402 PolarHBondContact O-N 3.48Å; S400-Y402 PolarHBondContact OG-N 3.13Å; S400-Y402 VanDerWaalsContact OG-N 3.07Å; S400-Y402 PolarHBondContact OG-O 3.4Å; Y402-F475 AromaticContact CD2-CD1 3.63Å; Y402-F475 HydrophobicContact CD2-CD1 3.63Å; Y402-F475 AromaticContact CD2-CE1 3.67Å; Y402-F475 HydrophobicContact CD2-CE1 3.67Å; Y402-F475 AromaticContact CE2-CD1 3.56Å; Y402-F475 HydrophobicContact CE2-CD1 3.56Å; Y402-F475 AromaticContact CE2-CE1 3.75Å; Y402-F475 HydrophobicContact CE2-CE1 3.75Å; Y402-K478 HydrophobicContact CD1-CB 4.36Å; Y402-K478 HydrophobicContact CE1-CB 3.73Å; Y402-K478 HydrophobicContact CE1-CG 4.22Å; Y402-R479 CarbonylContact C-O 3.48Å; Y402-R479 WeakPolarHBondContact CA-O 3.28Å; Y402-K480 HydrophobicContact CD1-CG 4.33Å; Y402-K480 HydrophobicContact CE1-CG 4.15Å
403T95Very high96.8Very high46 Ų4632.9 Ų32.928%0.28217%0.166SC..  trans-107.4137.5177.361.30000112.2R479 V481T403-R479 PolarHBondContact N-O 2.91Å; T403-R479 PolarHBondContact O-NE 3.02Å; T403-R479 PolarHBondContact O-NH2 3.32Å; T403-R479 VanDerWaalsContact O-NH2 3.15Å; T403-R479 WeakPolarHBondContact OG1-CB 3.31Å; T403-R479 PolarHBondContact OG1-O 3.33Å; T403-V481 HydrophobicContact CG2-CG2 3.94Å
404L95.8Very high96.9Very high11 Ų1135.9 Ų35.96%0.05819%0.185CC..  trans-73.7142.2168.6-62173.7000109.7F392 I393 F396 Q406 M470 A474F392-L404 HydrophobicContact CE1-CD1 4.32Å; I393-L404 HydrophobicContact CB-CD1 4.45Å; I393-L404 HydrophobicContact CG1-CD1 3.91Å; F396-L404 HydrophobicContact CB-CD1 4.23Å; F396-L404 HydrophobicContact CB-CG 4.44Å; F396-L404 HydrophobicContact CD1-CD1 4.24Å; F396-L404 HydrophobicContact CD1-CD2 3.82Å; F396-L404 HydrophobicContact CD1-CG 3.57Å; F396-L404 HydrophobicContact CE1-CD2 3.61Å; F396-L404 HydrophobicContact CE1-CG 3.89Å; F396-L404 HydrophobicContact CE2-CD2 4.36Å; F396-L404 HydrophobicContact CG-CD1 4.16Å; F396-L404 HydrophobicContact CG-CD2 4.27Å; F396-L404 HydrophobicContact CG-CG 3.99Å; F396-L404 HydrophobicContact CZ-CD2 3.9Å; L404-Q406 PolarHBondContact O-N 3.4Å; L404-M470 HydrophobicContact CB-CE 4.3Å; L404-M470 HydrophobicContact CD1-CE 3.99Å; L404-M470 HydrophobicContact CD2-CB 4.42Å; L404-M470 HydrophobicContact CD2-CE 4.39Å; L404-M470 HydrophobicContact CG-CE 4.46Å; L404-A474 HydrophobicContact CD2-CB 3.93Å
405D96.4Very high96.9Very high46 Ų4637.8 Ų37.825%0.24620%0.195CC..  trans-63.9125.6171.1-177-84.5000110.2T407 Y408 A409D405-T407 VanDerWaalsContact C-N 3.3Å; D405-T407 PolarHBondContact O-N 3.22Å; D405-T407 VanDerWaalsContact OD1-CA 3.29Å; D405-T407 WeakPolarHBondContact OD1-CA 3.5Å; D405-T407 WeakPolarHBondContact OD1-CB 3.35Å; D405-T407 PolarHBondContact OD1-N 3.07Å; D405-Y408 HydrophobicContact CB-CD2 3.68Å; D405-Y408 HydrophobicContact CB-CE2 4.38Å; D405-Y408 HydrophobicContact CB-CG 4.39Å; D405-Y408 PolarHBondContact OD1-N 3.05Å; D405-A409 VanDerWaalsContact O-CB 3.31Å; D405-A409 WeakPolarHBondContact O-CB 3.34Å; D405-A409 PolarHBondContact O-N 3.48Å
406Q95.1Very high97Very high77 Ų7738.5 Ų38.536%0.3620%0.198SC..Hα-helixtrans-70-26.1-175.7-73.7-64.6-44.600113L404 K410L404-Q406 PolarHBondContact O-N 3.4Å; Q406-K410 WeakPolarHBondContact O-CB 3.46Å; Q406-K410 WeakPolarHBondContact O-CG 3.25Å; Q406-K410 PolarHBondContact O-N 3.15Å
407T97.4Very high97Very high90 Ų9040.9 Ų40.955%0.55221%0.209SC*.Hα-helixtrans-69.9-51.8177.2-50.80000109.4D405 A409 K410 I411D405-T407 VanDerWaalsContact C-N 3.3Å; D405-T407 PolarHBondContact O-N 3.22Å; D405-T407 VanDerWaalsContact OD1-CA 3.29Å; D405-T407 WeakPolarHBondContact OD1-CA 3.5Å; D405-T407 WeakPolarHBondContact OD1-CB 3.35Å; D405-T407 PolarHBondContact OD1-N 3.07Å; T407-A409 VanDerWaalsContact C-N 3.31Å; T407-A409 PolarHBondContact O-N 3.35Å; T407-K410 PolarHBondContact O-N 3.16Å; T407-I411 HydrophobicContact CG2-CD1 4.08Å; T407-I411 WeakPolarHBondContact O-CG1 3.36Å; T407-I411 PolarHBondContact O-N 3.31Å
408Y97.9Very high97.2Very high91 Ų9143.7 Ų43.736%0.35722%0.222SC..Hα-helixtrans-61.8-39.8176.1-63.1-43.7000112D405 K410 I411 H412 F469D405-Y408 HydrophobicContact CB-CD2 3.68Å; D405-Y408 HydrophobicContact CB-CE2 4.38Å; D405-Y408 HydrophobicContact CB-CG 4.39Å; D405-Y408 PolarHBondContact OD1-N 3.05Å; Y408-K410 VanDerWaalsContact C-N 3.34Å; Y408-K410 PolarHBondContact O-N 2.9Å; Y408-I411 PolarHBondContact O-N 2.87Å; Y408-H412 WeakPolarHBondContact O-CB 3.32Å; Y408-H412 PolarHBondContact O-N 3.34Å; Y408-F469 HydrophobicContact CD2-CE1 4.17Å; Y408-F469 HydrophobicContact CE2-CE1 4.02Å
409A98.1Very high97.3Very high0 Ų043.7 Ų43.70%022%0.222CC..Hα-helixtrans-64-36.117800000113.5A335 D405 T407 F413 M470A335-A409 HydrophobicContact CB-CB 3.46Å; A335-A409 VanDerWaalsContact CB-CB 3.46Å; D405-A409 VanDerWaalsContact O-CB 3.31Å; D405-A409 WeakPolarHBondContact O-CB 3.34Å; D405-A409 PolarHBondContact O-N 3.48Å; T407-A409 VanDerWaalsContact C-N 3.31Å; T407-A409 PolarHBondContact O-N 3.35Å; A409-F413 PolarHBondContact O-N 3.25Å; A409-F413 VanDerWaalsContact O-N 3.13Å; A409-M470 VanDerWaalsContact CA-CE 3.49Å; A409-M470 HydrophobicContact CB-CE 3.59Å
410K98.6Very high97.3Very high80 Ų8042.5 Ų42.535%0.34822%0.217SC..Hα-helixtrans-70.8-42.1174.1-73.3175.1-179.8-176.40111.7W333 A335 L338 Q406 T407 Y408 H412 F413 T414W333-K410 WeakPolarHBondContact O-CE 3.33Å; W333-K410 PolarHBondContact O-NZ 3.13Å; A335-K410 HydrophobicContact CB-CG 4.18Å; L338-K410 HydrophobicContact CD1-CB 4.34Å; L338-K410 HydrophobicContact CD1-CG 3.84Å; Q406-K410 WeakPolarHBondContact O-CB 3.46Å; Q406-K410 WeakPolarHBondContact O-CG 3.25Å; Q406-K410 PolarHBondContact O-N 3.15Å; T407-K410 PolarHBondContact O-N 3.16Å; Y408-K410 VanDerWaalsContact C-N 3.34Å; Y408-K410 PolarHBondContact O-N 2.9Å; K410-H412 VanDerWaalsContact C-N 3.32Å; K410-H412 PolarHBondContact O-N 3.36Å; K410-F413 WeakPolarHBondContact O-CB 3.41Å; K410-F413 PolarHBondContact O-N 3.38Å; K410-T414 PolarHBondContact O-N 2.8Å; K410-T414 PolarHBondContact O-OG1 3.12Å
411I98.6Very high97.4Very high75 Ų7543 Ų4339%0.38522%0.218SC..Hα-helixtrans-60.4-45.1174.6-67166.6000110.2T407 Y408 F413 T414 I415 L466T407-I411 HydrophobicContact CG2-CD1 4.08Å; T407-I411 WeakPolarHBondContact O-CG1 3.36Å; T407-I411 PolarHBondContact O-N 3.31Å; Y408-I411 PolarHBondContact O-N 2.87Å; I411-F413 VanDerWaalsContact C-N 3.35Å; I411-F413 PolarHBondContact O-N 3.29Å; I411-T414 PolarHBondContact O-N 2.95Å; I411-T414 VanDerWaalsContact O-N 3.14Å; I411-I415 HydrophobicContact CG2-CD1 3.64Å; I411-I415 HydrophobicContact CG2-CG1 4.19Å; I411-I415 WeakPolarHBondContact O-CG1 2.98Å; I411-I415 PolarHBondContact O-N 2.9Å; I411-L466 HydrophobicContact CB-CD2 4.34Å; I411-L466 HydrophobicContact CG2-CD2 3.8Å
412H98.6Very high97.5Very high0 Ų045.3 Ų45.30%023%0.228CC..Hα-helixtrans-56.4-47.1176.3174.6-116.7000112.1W339 Y408 K410 M416 A463 L466 M467 M470W339-H412 AromaticContact CH2-CE1 3.88Å; W339-H412 AromaticContact CZ2-CE1 3.44Å; W339-H412 VanDerWaalsContact CZ2-CE1 3.44Å; W339-H412 WeakPolarHBondContact CZ2-CE1 3.49Å; W339-H412 AromaticContact CZ2-ND1 3.42Å; W339-H412 WeakPolarHBondContact CZ2-ND1 3.05Å; Y408-H412 WeakPolarHBondContact O-CB 3.32Å; Y408-H412 PolarHBondContact O-N 3.34Å; K410-H412 VanDerWaalsContact C-N 3.32Å; K410-H412 PolarHBondContact O-N 3.36Å; H412-M416 WeakPolarHBondContact O-CB 3.14Å; H412-M416 PolarHBondContact O-N 3.33Å; H412-A463 PolarHBondContact CD2-O 3.34Å; H412-A463 PolarHBondContact NE2-O 3.4Å; H412-L466 HydrophobicContact CB-CD2 3.8Å; H412-L466 HydrophobicContact CB-CG 4.19Å; H412-M467 VanDerWaalsContact CE1-CE 3.47Å; H412-M467 WeakPolarHBondContact CE1-CE 3.47Å; H412-M470 HydrophobicContact CB-SD 3.66Å
413F98.6Very high97.7Very high23 Ų2343.1 Ų43.110%0.10122%0.22CC..Hα-helixtrans-56.8-51.1172.6168.9-99.3000112L338 W339 F386 A409 K410 I411 I415 M416 F417L338-F413 VanDerWaalsContact C-CE2 3.49Å; L338-F413 HydrophobicContact CB-CD1 3.65Å; L338-F413 HydrophobicContact CB-CD2 4.1Å; L338-F413 HydrophobicContact CB-CE1 3.76Å; L338-F413 HydrophobicContact CB-CE2 4.19Å; L338-F413 HydrophobicContact CB-CG 3.81Å; L338-F413 HydrophobicContact CB-CZ 4.03Å; L338-F413 HydrophobicContact CD1-CD1 3.86Å; L338-F413 HydrophobicContact CD1-CE1 4.36Å; L338-F413 HydrophobicContact CD1-CG 4.46Å; L338-F413 HydrophobicContact CG-CD1 4.34Å; L338-F413 WeakPolarHBondContact O-CE2 3.35Å; L338-F413 WeakPolarHBondContact O-CZ 3.2Å; W339-F413 HydrophobicContact CD2-CB 4.5Å; W339-F413 AromaticContact CD2-CD2 3.69Å; W339-F413 HydrophobicContact CD2-CD2 3.69Å; W339-F413 AromaticContact CE2-CD2 3.83Å; W339-F413 AromaticContact CE3-CD2 3.99Å; W339-F413 HydrophobicContact CE3-CD2 3.99Å; W339-F413 AromaticContact CG-CD2 3.99Å; W339-F413 HydrophobicContact CG-CD2 3.99Å; W339-F413 HydrophobicContact CZ2-CB 3.97Å; W339-F413 HydrophobicContact CZ2-CD2 4.26Å; W339-F413 HydrophobicContact CZ3-CD2 4.43Å; F386-F413 HydrophobicContact CE1-CE2 4.07Å; A409-F413 PolarHBondContact O-N 3.25Å; A409-F413 VanDerWaalsContact O-N 3.13Å; K410-F413 WeakPolarHBondContact O-CB 3.41Å; K410-F413 PolarHBondContact O-N 3.38Å; I411-F413 VanDerWaalsContact C-N 3.35Å; I411-F413 PolarHBondContact O-N 3.29Å; F413-I415 PolarHBondContact O-N 3.12Å; F413-M416 PolarHBondContact O-N 3.45Å; F413-F417 HydrophobicContact CE1-CB 4.4Å; F413-F417 HydrophobicContact CE2-CB 4.3Å; F413-F417 HydrophobicContact CE2-CD2 4.15Å; F413-F417 HydrophobicContact CZ-CB 4.15Å; F413-F417 AromaticContact CZ-CD2 3.84Å; F413-F417 HydrophobicContact CZ-CD2 3.84Å; F413-F417 HydrophobicContact CZ-CG 4.11Å; F413-F417 WeakPolarHBondContact O-CB 3.39Å; F413-F417 PolarHBondContact O-N 3.36Å
414T98.6Very high97.8Very high70 Ų7042 Ų4243%0.42921%0.211SC..Hα-helixtrans-61-45.6-176.1-59.80000112.1K410 I411 F417 I418K410-T414 PolarHBondContact O-N 2.8Å; K410-T414 PolarHBondContact O-OG1 3.12Å; I411-T414 PolarHBondContact O-N 2.95Å; I411-T414 VanDerWaalsContact O-N 3.14Å; T414-F417 PolarHBondContact O-N 2.95Å; T414-I418 HydrophobicContact CG2-CD1 3.93Å; T414-I418 WeakPolarHBondContact O-CG1 3.43Å; T414-I418 PolarHBondContact O-N 2.79Å
415I98.5Very high97.9Very high46 Ų4646.2 Ų46.224%0.23623%0.229CC..Hα-helixtrans-63.1-48178.5-64.2173.7000110.1I411 F413 F417 I418 G419 I459 T462 A463 L466I411-I415 HydrophobicContact CG2-CD1 3.64Å; I411-I415 HydrophobicContact CG2-CG1 4.19Å; I411-I415 WeakPolarHBondContact O-CG1 2.98Å; I411-I415 PolarHBondContact O-N 2.9Å; F413-I415 PolarHBondContact O-N 3.12Å; I415-F417 PolarHBondContact O-N 2.85Å; I415-I418 PolarHBondContact O-N 2.96Å; I415-G419 PolarHBondContact O-N 3.16Å; I415-I459 HydrophobicContact CG2-CG2 3.86Å; I415-T462 WeakPolarHBondContact CG2-OG1 3.25Å; I415-A463 HydrophobicContact CB-CB 4.23Å; I415-A463 HydrophobicContact CG2-CB 3.84Å; I415-L466 HydrophobicContact CD1-CD2 4.09Å
416M98Very high98Very high15 Ų1544.2 Ų44.27%0.07422%0.218CC..Hα-helixtrans-61.8-47.3179.1-174.163.181.200111.2W339 F386 H412 F413 I418 G419 V420 A463 V464W339-M416 HydrophobicContact CH2-CB 3.67Å; W339-M416 HydrophobicContact CH2-CG 3.73Å; W339-M416 HydrophobicContact CZ2-CB 4.46Å; W339-M416 HydrophobicContact CZ3-CB 4.43Å; W339-M416 HydrophobicContact CZ3-CG 4.14Å; F386-M416 HydrophobicContact CE2-CG 4.21Å; F386-M416 HydrophobicContact CZ-CG 4.43Å; H412-M416 WeakPolarHBondContact O-CB 3.14Å; H412-M416 PolarHBondContact O-N 3.33Å; F413-M416 PolarHBondContact O-N 3.45Å; M416-I418 VanDerWaalsContact C-N 3.33Å; M416-I418 PolarHBondContact O-N 2.8Å; M416-G419 PolarHBondContact O-N 3.47Å; M416-V420 HydrophobicContact CG-CG1 4.07Å; M416-V420 WeakPolarHBondContact O-CG1 3.47Å; M416-V420 VanDerWaalsContact O-CG2 3.31Å; M416-V420 WeakPolarHBondContact O-CG2 3.18Å; M416-V420 PolarHBondContact O-N 2.7Å; M416-V420 HydrophobicContact SD-CG1 3.64Å; M416-A463 HydrophobicContact CB-CB 3.83Å; M416-A463 HydrophobicContact CE-CB 3.71Å; M416-A463 HydrophobicContact SD-CB 4.2Å; M416-V464 HydrophobicContact CE-CG2 4.14Å
417F98.3Very high98.2Very high58 Ų5840.8 Ų40.825%0.25420%0.203SC..Hα-helixtrans-57.6-44.3-178.9-176.9-91.8000112.1F345 L346 F386 F413 T414 I415 N421F345-F417 HydrophobicContact CD1-CE2 4.33Å; F345-F417 HydrophobicContact CD1-CZ 4.14Å; F345-F417 HydrophobicContact CE1-CZ 4.33Å; L346-F417 HydrophobicContact CD1-CD2 3.74Å; L346-F417 HydrophobicContact CD1-CE2 3.57Å; L346-F417 HydrophobicContact CD2-CE2 4.09Å; L346-F417 HydrophobicContact CD2-CZ 4.41Å; L346-F417 HydrophobicContact CG-CE2 3.91Å; F386-F417 HydrophobicContact CE1-CD2 4.08Å; F386-F417 HydrophobicContact CZ-CD2 4.4Å; F413-F417 HydrophobicContact CE1-CB 4.4Å; F413-F417 HydrophobicContact CE2-CB 4.3Å; F413-F417 HydrophobicContact CE2-CD2 4.15Å; F413-F417 HydrophobicContact CZ-CB 4.15Å; F413-F417 AromaticContact CZ-CD2 3.84Å; F413-F417 HydrophobicContact CZ-CD2 3.84Å; F413-F417 HydrophobicContact CZ-CG 4.11Å; F413-F417 WeakPolarHBondContact O-CB 3.39Å; F413-F417 PolarHBondContact O-N 3.36Å; T414-F417 PolarHBondContact O-N 2.95Å; I415-F417 PolarHBondContact O-N 2.85Å; F417-N421 PolarHBondContact O-N 3.48Å; F417-N421 PolarHBondContact O-ND2 3.21Å
418I98.4Very high98.3Very high83 Ų8337.1 Ų37.143%0.42618%0.179SC..Hα-helixtrans-67.3-48.6175.8-67.4169.3000110.4T414 I415 M416 V420 N421 L422T414-I418 HydrophobicContact CG2-CD1 3.93Å; T414-I418 WeakPolarHBondContact O-CG1 3.43Å; T414-I418 PolarHBondContact O-N 2.79Å; I415-I418 PolarHBondContact O-N 2.96Å; M416-I418 VanDerWaalsContact C-N 3.33Å; M416-I418 PolarHBondContact O-N 2.8Å; I418-V420 PolarHBondContact O-N 2.82Å; I418-N421 PolarHBondContact O-N 2.88Å; I418-L422 HydrophobicContact CG2-CD1 3.77Å; I418-L422 HydrophobicContact CG2-CG 4.29Å; I418-L422 WeakPolarHBondContact O-CB 3.41Å; I418-L422 WeakPolarHBondContact O-CG 3.22Å; I418-L422 PolarHBondContact O-N 3.39Å
419G98.1Very high98.3Very high0 Ų036.6 Ų36.60%018%0.179CC..Hα-helixtrans-58.8-47.7-177.300000113.3I415 M416 N421 L422 T423 G456 S460I415-G419 PolarHBondContact O-N 3.16Å; M416-G419 PolarHBondContact O-N 3.47Å; G419-N421 PolarHBondContact O-N 3.45Å; G419-L422 PolarHBondContact O-N 3.2Å; G419-T423 WeakPolarHBondContact O-CB 3.27Å; G419-T423 PolarHBondContact O-N 3.27Å; G419-T423 PolarHBondContact O-OG1 2.61Å; G419-G456 CarbonylContact C-O 3.41Å; G419-G456 WeakPolarHBondContact CA-O 3.42Å; G419-G456 CarbonylContact O-C 3.6Å; G419-G456 WeakPolarHBondContact O-CA 3.4Å; G419-S460 VanDerWaalsContact C-OG 3.29Å
420V97.2Very high98.3Very high4 Ų436.6 Ų36.62%0.02418%0.179CC..Hα-helixtrans-67.9-36.7-179-60.40000112.5M382 F386 M416 I418 T423 F424 S460M382-V420 HydrophobicContact CG-CB 4.19Å; M382-V420 HydrophobicContact CG-CG2 3.75Å; M382-V420 HydrophobicContact SD-CB 4.16Å; M382-V420 HydrophobicContact SD-CG2 3.64Å; F386-V420 HydrophobicContact CE2-CG2 4.03Å; F386-V420 HydrophobicContact CZ-CG2 3.94Å; M416-V420 HydrophobicContact CG-CG1 4.07Å; M416-V420 WeakPolarHBondContact O-CG1 3.47Å; M416-V420 VanDerWaalsContact O-CG2 3.31Å; M416-V420 WeakPolarHBondContact O-CG2 3.18Å; M416-V420 PolarHBondContact O-N 2.7Å; M416-V420 HydrophobicContact SD-CG1 3.64Å; I418-V420 PolarHBondContact O-N 2.82Å; V420-T423 PolarHBondContact O-N 2.69Å; V420-F424 HydrophobicContact CB-CD2 4.2Å; V420-F424 HydrophobicContact CB-CE2 4.31Å; V420-F424 WeakPolarHBondContact O-CD2 3.44Å; V420-F424 PolarHBondContact O-N 3.18Å; V420-S460 PolarHBondContact N-OG 3.13Å
421N97.9Very high98.3Very high31 Ų3132.8 Ų32.817%0.16616%0.163CC..Hα-helixtrans-69.5-42.6176.6-82.3-81.5000111.1L346 Y378 F417 I418 G419 T423 F425L346-N421 WeakPolarHBondContact CD2-ND2 3.27Å; L346-N421 VanDerWaalsContact CD2-OD1 3.24Å; L346-N421 WeakPolarHBondContact CD2-OD1 3.46Å; Y378-N421 PolarHBondContact OH-OD1 2.94Å; F417-N421 PolarHBondContact O-N 3.48Å; F417-N421 PolarHBondContact O-ND2 3.21Å; I418-N421 PolarHBondContact O-N 2.88Å; G419-N421 PolarHBondContact O-N 3.45Å; N421-T423 PolarHBondContact O-N 3.29Å; N421-F425 WeakPolarHBondContact O-CB 3.1Å; N421-F425 PolarHBondContact O-N 3.27Å
422L97.8Very high98.2Very high56 Ų5634.5 Ų34.529%0.29317%0.172SC..Hα-helixtrans-62.8-30.8172.8-71.4178.9000112.1I418 G419 P426 L452 S453 I459I418-L422 HydrophobicContact CG2-CD1 3.77Å; I418-L422 HydrophobicContact CG2-CG 4.29Å; I418-L422 WeakPolarHBondContact O-CB 3.41Å; I418-L422 WeakPolarHBondContact O-CG 3.22Å; I418-L422 PolarHBondContact O-N 3.39Å; G419-L422 PolarHBondContact O-N 3.2Å; L422-P426 WeakPolarHBondContact O-CD 3.17Å; L422-P426 VanDerWaalsContact O-CG 3.23Å; L422-P426 WeakPolarHBondContact O-CG 3.39Å; L422-L452 HydrophobicContact CD2-CD1 4.05Å; L422-L452 HydrophobicContact CD2-CG 4.4Å; L422-S453 WeakPolarHBondContact O-CA 3.23Å; L422-I459 HydrophobicContact CD1-CD1 3.74Å
423T98.3Very high98.2Very high4 Ų437.3 Ų37.33%0.02519%0.192CC..Hα-helixtrans-70.6-57176-530000111.6G419 V420 N421 Q427 S453 G456 S457G419-T423 WeakPolarHBondContact O-CB 3.27Å; G419-T423 PolarHBondContact O-N 3.27Å; G419-T423 PolarHBondContact O-OG1 2.61Å; V420-T423 PolarHBondContact O-N 2.69Å; N421-T423 PolarHBondContact O-N 3.29Å; T423-Q427 PolarHBondContact O-NE2 2.84Å; T423-S453 WeakPolarHBondContact CA-O 3.29Å; T423-S453 VanDerWaalsContact O-CB 3.26Å; T423-S453 WeakPolarHBondContact O-CB 3.47Å; T423-S453 PolarHBondContact O-OG 2.88Å; T423-G456 WeakPolarHBondContact OG1-CA 3.3Å; T423-G456 PolarHBondContact OG1-O 3.15Å; T423-S457 WeakPolarHBondContact OG1-CA 3.41Å; T423-S457 PolarHBondContact OG1-N 3.29Å
424F98.4Very high98.1Very high23 Ų2338.1 Ų38.110%0.10121%0.206CC..Hα-helixtrans-99.5-24.4-163.8-59.4-60.9000113.8H377 Y378 M382 V420 Q427H377-F424 HydrophobicContact CB-CB 4.47Å; H377-F424 HydrophobicContact CB-CD1 3.44Å; H377-F424 VanDerWaalsContact CB-CD1 3.44Å; H377-F424 HydrophobicContact CB-CD2 4.01Å; H377-F424 HydrophobicContact CB-CE1 3.51Å; H377-F424 HydrophobicContact CB-CE2 4.06Å; H377-F424 HydrophobicContact CB-CG 3.71Å; H377-F424 HydrophobicContact CB-CZ 3.83Å; H377-F424 AromaticContact CD2-CE1 3.21Å; H377-F424 WeakPolarHBondContact CD2-CE1 3.26Å; H377-F424 AromaticContact CD2-CZ 3.33Å; H377-F424 WeakPolarHBondContact CD2-CZ 3.27Å; H377-F424 AromaticContact CG-CD1 3.7Å; H377-F424 AromaticContact CG-CE1 3.33Å; H377-F424 AromaticContact CG-CZ 3.78Å; H377-F424 AromaticContact NE2-CE1 3.95Å; Y378-F424 HydrophobicContact CD2-CB 4.01Å; Y378-F424 HydrophobicContact CE2-CB 3.65Å; M382-F424 HydrophobicContact CE-CB 3.85Å; M382-F424 HydrophobicContact CE-CD2 3.58Å; M382-F424 HydrophobicContact CE-CG 4.1Å; V420-F424 HydrophobicContact CB-CD2 4.2Å; V420-F424 HydrophobicContact CB-CE2 4.31Å; V420-F424 WeakPolarHBondContact O-CD2 3.44Å; V420-F424 PolarHBondContact O-N 3.18Å; F424-Q427 WeakPolarHBondContact O-CB 3.36Å; F424-Q427 PolarHBondContact O-N 3.01Å
425F98.2Very high98.1Very high98 Ų9834.9 Ų34.943%0.4319%0.187SC..Hα-helixtrans-61.6-46.1177.9-164.3-105.3000111.9Y378 N421 Q427 H428 F429Y378-F425 WeakPolarHBondContact OH-CB 3.48Å; N421-F425 WeakPolarHBondContact O-CB 3.1Å; N421-F425 PolarHBondContact O-N 3.27Å; F425-Q427 PolarHBondContact O-N 2.89Å; F425-Q427 VanDerWaalsContact O-N 3.15Å; F425-H428 PolarHBondContact O-N 3.33Å; F425-H428 VanDerWaalsContact O-N 3.16Å; F425-H428 PolarHBondContact O-ND1 2.9Å; F425-F429 AromaticContact CD1-CE2 3.91Å; F425-F429 HydrophobicContact CD1-CE2 3.91Å; F425-F429 HydrophobicContact CD1-CZ 4.37Å; F425-F429 AromaticContact CE1-CE2 3.7Å; F425-F429 HydrophobicContact CE1-CE2 3.7Å; F425-F429 AromaticContact CE1-CZ 3.71Å; F425-F429 HydrophobicContact CE1-CZ 3.71Å; F425-F429 HydrophobicContact CZ-CZ 4.32Å
426P98.4Very high98.1Very high4 Ų434.9 Ų34.93%0.02619%0.19CC..Hα-helixtrans-60.7-25177.2-26.238.5000114.2L422 H428 F429 L430 W449 L452L422-P426 WeakPolarHBondContact O-CD 3.17Å; L422-P426 VanDerWaalsContact O-CG 3.23Å; L422-P426 WeakPolarHBondContact O-CG 3.39Å; P426-H428 VanDerWaalsContact C-N 3.25Å; P426-H428 PolarHBondContact O-N 3.21Å; P426-F429 WeakPolarHBondContact O-CB 3.14Å; P426-F429 PolarHBondContact O-N 3.28Å; P426-L430 PolarHBondContact O-N 3.26Å; P426-L430 VanDerWaalsContact O-N 3.07Å; P426-W449 HydrophobicContact CB-CB 4.07Å; P426-W449 HydrophobicContact CB-CD2 4.39Å; P426-W449 HydrophobicContact CB-CE3 3.9Å; P426-W449 HydrophobicContact CG-CE3 4.48Å; P426-L452 HydrophobicContact CB-CD2 4.49Å; P426-L452 HydrophobicContact CG-CB 4.3Å; P426-L452 HydrophobicContact CG-CD2 3.66Å; P426-L452 HydrophobicContact CG-CG 3.96Å
427Q98.5Very high98Very high6 Ų636.3 Ų36.33%0.02819%0.194CC..Hα-helixtrans-67.9-24.5-179.8-64.9-177.67.400112.8Y370 A374 T423 F424 F425 F429 L430 G431 S453Y370-Q427 CarbonylContact C-O 3.41Å; Y370-Q427 WeakPolarHBondContact CB-O 3.46Å; Y370-Q427 HydrophobicContact CD1-CB 4.04Å; Y370-Q427 HydrophobicContact CD1-CG 3.83Å; Y370-Q427 HydrophobicContact CE1-CG 4.41Å; A374-Q427 HydrophobicContact CB-CB 3.73Å; T423-Q427 PolarHBondContact O-NE2 2.84Å; F424-Q427 WeakPolarHBondContact O-CB 3.36Å; F424-Q427 PolarHBondContact O-N 3.01Å; F425-Q427 PolarHBondContact O-N 2.89Å; F425-Q427 VanDerWaalsContact O-N 3.15Å; Q427-F429 VanDerWaalsContact C-N 3.33Å; Q427-L430 HydrophobicContact CG-CD1 4.31Å; Q427-L430 PolarHBondContact O-N 3.24Å; Q427-G431 PolarHBondContact O-N 3.07Å; Q427-S453 PolarHBondContact NE2-OG 3.34Å
428H98.6Very high97.9Very high12 Ų1236.8 Ų36.86%0.05619%0.194CC..Hα-helixtrans-62.9-41.6168.9-6499.9000111.3Y371 A374 Y378 F425 P426 G431 L432Y371-H428 HydrophobicContact CD2-CB 4.16Å; Y371-H428 AromaticContact CD2-CD2 3.98Å; Y371-H428 HydrophobicContact CE2-CB 4.23Å; Y371-H428 AromaticContact CE2-CD2 3.83Å; A374-H428 WeakPolarHBondContact CB-NE2 3.46Å; Y378-H428 AromaticContact CD2-CE1 3.55Å; Y378-H428 AromaticContact CE2-CE1 3.56Å; F425-H428 PolarHBondContact O-N 3.33Å; F425-H428 VanDerWaalsContact O-N 3.16Å; F425-H428 PolarHBondContact O-ND1 2.9Å; P426-H428 VanDerWaalsContact C-N 3.25Å; P426-H428 PolarHBondContact O-N 3.21Å; H428-G431 PolarHBondContact O-N 2.89Å; H428-L432 WeakPolarHBondContact O-CB 3.45Å; H428-L432 VanDerWaalsContact O-CG 3.26Å; H428-L432 WeakPolarHBondContact O-CG 3.19Å; H428-L432 PolarHBondContact O-N 3.29Å
429F98.4Very high97.8Very high80 Ų8039.4 Ų39.435%0.35120%0.2SC..Hα-helixtrans-67.2-40.9176.8-57.3-55.3000111.5F425 P426 Q427 G431 L432 S433 W449F425-F429 AromaticContact CD1-CE2 3.91Å; F425-F429 HydrophobicContact CD1-CE2 3.91Å; F425-F429 HydrophobicContact CD1-CZ 4.37Å; F425-F429 AromaticContact CE1-CE2 3.7Å; F425-F429 HydrophobicContact CE1-CE2 3.7Å; F425-F429 AromaticContact CE1-CZ 3.71Å; F425-F429 HydrophobicContact CE1-CZ 3.71Å; F425-F429 HydrophobicContact CZ-CZ 4.32Å; P426-F429 WeakPolarHBondContact O-CB 3.14Å; P426-F429 PolarHBondContact O-N 3.28Å; Q427-F429 VanDerWaalsContact C-N 3.33Å; F429-G431 VanDerWaalsContact C-N 3.32Å; F429-G431 PolarHBondContact O-N 3.31Å; F429-L432 PolarHBondContact O-N 3.21Å; F429-S433 WeakPolarHBondContact O-CB 3.2Å; F429-S433 PolarHBondContact O-N 3.5Å; F429-S433 PolarHBondContact O-OG 2.95Å; F429-W449 HydrophobicContact CB-CD2 4.36Å; F429-W449 HydrophobicContact CB-CG 4.41Å; F429-W449 HydrophobicContact CB-CZ2 4.47Å; F429-W449 HydrophobicContact CD2-CD2 4.34Å; F429-W449 HydrophobicContact CD2-CE3 4.42Å; F429-W449 HydrophobicContact CD2-CH2 4.14Å; F429-W449 HydrophobicContact CD2-CZ2 4.04Å; F429-W449 HydrophobicContact CD2-CZ3 4.32Å; F429-W449 HydrophobicContact CE2-CH2 4.44Å; F429-W449 HydrophobicContact CG-CZ2 4.35Å
430L98.4Very high97.6Very high0 Ų040 Ų400%020%0.204CC..Hα-helixtrans-55.5-49.1172.1-71.2174.4000111.2Y370 P426 Q427 S433 G434 M435 Y446 W449Y370-L430 HydrophobicContact CD1-CD1 4.37Å; Y370-L430 HydrophobicContact CG-CB 4.34Å; P426-L430 PolarHBondContact O-N 3.26Å; P426-L430 VanDerWaalsContact O-N 3.07Å; Q427-L430 HydrophobicContact CG-CD1 4.31Å; Q427-L430 PolarHBondContact O-N 3.24Å; L430-S433 WeakPolarHBondContact CA-OG 3.25Å; L430-S433 CarbonylContact O-C 3.59Å; L430-S433 PolarHBondContact O-N 2.92Å; L430-S433 PolarHBondContact O-OG 3.21Å; L430-G434 PolarHBondContact O-N 3.33Å; L430-M435 HydrophobicContact CB-CB 4.06Å; L430-M435 HydrophobicContact CB-SD 3.98Å; L430-M435 HydrophobicContact CD1-SD 3.79Å; L430-M435 HydrophobicContact CD2-SD 3.66Å; L430-M435 HydrophobicContact CG-SD 4.02Å; L430-M435 WeakPolarHBondContact O-CB 3.37Å; L430-M435 PolarHBondContact O-N 3.46Å; L430-Y446 HydrophobicContact CD2-CD1 3.94Å; L430-Y446 HydrophobicContact CD2-CG 4.12Å; L430-W449 HydrophobicContact CD1-CB 4.05Å; L430-W449 HydrophobicContact CD2-CB 3.58Å; L430-W449 HydrophobicContact CD2-CG 4.26Å; L430-W449 HydrophobicContact CG-CB 3.6Å; L430-W449 HydrophobicContact CG-CG 4.37Å
431G98.1Very high97.6Very high1 Ų142.9 Ų42.91%0.0122%0.219CC..Hα-helixtrans-63.6-44.5178.300000114.1Y371 Q427 H428 F429 S433 G434Y371-G431 VanDerWaalsContact N-CA 3.35Å; Q427-G431 PolarHBondContact O-N 3.07Å; H428-G431 PolarHBondContact O-N 2.89Å; F429-G431 VanDerWaalsContact C-N 3.32Å; F429-G431 PolarHBondContact O-N 3.31Å; G431-S433 PolarHBondContact O-N 3.27Å; G431-G434 PolarHBondContact O-N 3.49Å
432L97.8Very high97.5Very high110 Ų11042 Ų4258%0.57621%0.214SC*.Hα-helixtrans-62.4-29175.4-72.1169.9000112.5L366 Y371 H428 F429 G434L366-L432 HydrophobicContact CD2-CD2 4.05Å; Y371-L432 HydrophobicContact CD2-CD2 4.06Å; Y371-L432 HydrophobicContact CD2-CG 3.85Å; Y371-L432 HydrophobicContact CE2-CD1 4.31Å; Y371-L432 HydrophobicContact CE2-CD2 3.99Å; Y371-L432 HydrophobicContact CE2-CG 3.99Å; H428-L432 WeakPolarHBondContact O-CB 3.45Å; H428-L432 VanDerWaalsContact O-CG 3.26Å; H428-L432 WeakPolarHBondContact O-CG 3.19Å; H428-L432 PolarHBondContact O-N 3.29Å; F429-L432 PolarHBondContact O-N 3.21Å; L432-G434 VanDerWaalsContact C-N 3.27Å
433S97.4Very high97.5Very high60 Ų6043.4 Ų43.442%0.4223%0.226SC..THydrogen-bonded Turntrans-84.65.9173.164.60000114.2F429 L430 G431 Y446F429-S433 WeakPolarHBondContact O-CB 3.2Å; F429-S433 PolarHBondContact O-N 3.5Å; F429-S433 PolarHBondContact O-OG 2.95Å; L430-S433 WeakPolarHBondContact CA-OG 3.25Å; L430-S433 CarbonylContact O-C 3.59Å; L430-S433 PolarHBondContact O-N 2.92Å; L430-S433 PolarHBondContact O-OG 3.21Å; G431-S433 PolarHBondContact O-N 3.27Å; S433-Y446 PolarHBondContact O-OH 2.88Å; S433-Y446 WeakPolarHBondContact OG-CE1 3.42Å
434G97.4Very high97.4Very high40 Ų4049.1 Ų49.141%0.41226%0.256SS..THydrogen-bonded Turntrans83.215.7174.800000115.6L430 G431 L432 P436L430-G434 PolarHBondContact O-N 3.33Å; G431-G434 PolarHBondContact O-N 3.49Å; L432-G434 VanDerWaalsContact C-N 3.27Å; G434-P436 VanDerWaalsContact O-CD 3.3Å; G434-P436 WeakPolarHBondContact O-CD 3.27Å
435M98.1Very high97.3Very high2 Ų252.2 Ų52.21%0.0129%0.286CS..PPolyproline II helixtrans-66.3118.9177.2-174.4-177.517800110.1T369 Y370 L430 Y442 Y446 N450T369-M435 CarbonylContact C-O 3.58Å; T369-M435 VanDerWaalsContact CA-O 3.27Å; T369-M435 WeakPolarHBondContact CA-O 3.34Å; T369-M435 WeakPolarHBondContact CB-O 3.15Å; Y370-M435 HydrophobicContact CD2-CB 4.24Å; Y370-M435 HydrophobicContact CD2-CE 4.13Å; Y370-M435 HydrophobicContact CD2-CG 3.75Å; Y370-M435 HydrophobicContact CD2-SD 3.78Å; Y370-M435 HydrophobicContact CE2-CE 3.55Å; Y370-M435 HydrophobicContact CE2-CG 4.06Å; Y370-M435 HydrophobicContact CE2-SD 3.85Å; Y370-M435 HydrophobicContact CG-SD 4.26Å; Y370-M435 PolarHBondContact N-O 3.47Å; L430-M435 HydrophobicContact CB-CB 4.06Å; L430-M435 HydrophobicContact CB-SD 3.98Å; L430-M435 HydrophobicContact CD1-SD 3.79Å; L430-M435 HydrophobicContact CD2-SD 3.66Å; L430-M435 HydrophobicContact CG-SD 4.02Å; L430-M435 WeakPolarHBondContact O-CB 3.37Å; L430-M435 PolarHBondContact O-N 3.46Å; M435-Y442 HydrophobicContact CE-CD1 3.8Å; M435-Y442 HydrophobicContact CE-CG 3.86Å; M435-Y446 HydrophobicContact CB-CD1 4.09Å; M435-Y446 HydrophobicContact CB-CD2 4.16Å; M435-Y446 HydrophobicContact CB-CE1 3.99Å; M435-Y446 HydrophobicContact CB-CE2 4.03Å; M435-Y446 HydrophobicContact CB-CG 4.17Å; M435-Y446 HydrophobicContact CG-CD2 3.98Å; M435-Y446 HydrophobicContact CG-CE2 4.17Å; M435-Y446 HydrophobicContact CG-CG 4.19Å; M435-Y446 HydrophobicContact SD-CD2 4.4Å; M435-Y446 HydrophobicContact SD-CG 4.19Å; M435-N450 WeakPolarHBondContact CE-ND2 3.47Å; M435-N450 PolarHBondContact SD-ND2 2.89Å; M435-N450 VanDerWaalsContact SD-ND2 3.4Å
436P97.7Very high97.3Very high46 Ų4649.4 Ų49.430%0.29927%0.273SS..BIsolated β-bridgetrans-76.8152-178.833.2-36.4000111.7D368 Y370 G434 Y439D368-P436 CarbonylContact O-C 3.53Å; D368-P436 WeakPolarHBondContact O-CA 3.41Å; Y370-P436 WeakPolarHBondContact CD2-O 3.3Å; Y370-P436 VanDerWaalsContact CE2-O 3.24Å; Y370-P436 WeakPolarHBondContact CE2-O 3.4Å; G434-P436 VanDerWaalsContact O-CD 3.3Å; G434-P436 WeakPolarHBondContact O-CD 3.27Å; P436-Y439 HydrophobicContact CB-CD2 3.72Å; P436-Y439 HydrophobicContact CB-CE2 3.49Å; P436-Y439 VanDerWaalsContact CB-CE2 3.49Å; P436-Y439 HydrophobicContact CG-CD2 3.52Å; P436-Y439 HydrophobicContact CG-CE2 3.54Å; P436-Y439 HydrophobicContact CG-CG 4.1Å
437R97.1Very high97.2Very high44 Ų4450.5 Ų50.517%0.16628%0.279CS..SBendtrans-83.6157.4177.274.4-175.7-178.9171.4-4.4111.8D368 V373 Y439D368-R437 HydrophobicContact CB-CG 4.41Å; D368-R437 VanDerWaalsContact O-CG 3.32Å; D368-R437 WeakPolarHBondContact O-CG 3.32Å; D368-R437 PolarHBondContact O-N 2.96Å; D368-R437 IonicContact OD1-CZ 2.67Å; D368-R437 IonicContact OD1-NE 2.7Å; D368-R437 PolarHBondContact OD1-NE 2.85Å; D368-R437 IonicContact OD1-NH2 2.59Å; D368-R437 PolarHBondContact OD1-NH2 3.4Å; V373-R437 HydrophobicContact CG2-CB 3.84Å; R437-Y439 VanDerWaalsContact C-N 3.33Å; R437-Y439 VanDerWaalsContact O-CD2 3.25Å; R437-Y439 WeakPolarHBondContact O-CD2 3.44Å; R437-Y439 PolarHBondContact O-N 2.85Å
438R95.4Very high97.2Very high68 Ų6855.2 Ų55.226%0.25731%0.309SS..SBendtrans64.230.3177-53.9171.8-175.2176.81.5114.7N54 V57N54-R438 PolarHBondContact OD1-O 3.42Å; V57-R438 HydrophobicContact CG1-CG 4.47Å
439Y95.6Very high97.2Very high139 Ų13959.3 Ų59.355%0.54532%0.324SS..  trans-101.5138.9166.2-72.8-105.9000109Y53 P436 R437 D441Y53-Y439 VanDerWaalsContact CE1-C 3.41Å; Y53-Y439 VanDerWaalsContact CE1-O 3.22Å; Y53-Y439 WeakPolarHBondContact CE1-O 3.26Å; Y53-Y439 PolarHBondContact OH-O 3.06Å; P436-Y439 HydrophobicContact CB-CD2 3.72Å; P436-Y439 HydrophobicContact CB-CE2 3.49Å; P436-Y439 VanDerWaalsContact CB-CE2 3.49Å; P436-Y439 HydrophobicContact CG-CD2 3.52Å; P436-Y439 HydrophobicContact CG-CE2 3.54Å; P436-Y439 HydrophobicContact CG-CG 4.1Å; R437-Y439 VanDerWaalsContact C-N 3.33Å; R437-Y439 VanDerWaalsContact O-CD2 3.25Å; R437-Y439 WeakPolarHBondContact O-CD2 3.44Å; R437-Y439 PolarHBondContact O-N 2.85Å; Y439-D441 WeakPolarHBondContact CB-O 3.36Å
440S95.6Very high97.1Very high12 Ų1255.5 Ų55.58%0.08431%0.307CS..SBendtrans-77.8-27.3175.542.20000112.4D50D50-S440 WeakPolarHBondContact CB-OG 3.45Å; D50-S440 WeakPolarHBondContact OD1-CB 3.42Å; D50-S440 PolarHBondContact OD1-OG 2.9Å
441D96.5Very high97.1Very high65 Ų6559.4 Ų59.435%0.34833%0.327SS..  trans-130.9162.7179.3-164.49.2000111.1G44 Y439G44-D441 PolarHBondContact N-OD1 3.46Å; Y439-D441 WeakPolarHBondContact CB-O 3.36Å
442Y96.4Very high97.1Very high13 Ų1362.4 Ų62.45%0.05134%0.343CS..  trans-151152.8-175.858.3-98.4000113.5L40 Q42 P43 M435 N450L40-Y442 HydrophobicContact CB-CE1 4.14Å; L40-Y442 HydrophobicContact CD2-CD1 3.84Å; L40-Y442 HydrophobicContact CD2-CE1 4Å; L40-Y442 VanDerWaalsContact O-CE1 3.27Å; L40-Y442 WeakPolarHBondContact O-CE1 3.42Å; L40-Y442 PolarHBondContact O-OH 3.45Å; Q42-Y442 VanDerWaalsContact C-OH 3.27Å; Q42-Y442 VanDerWaalsContact CA-OH 3.31Å; Q42-Y442 WeakPolarHBondContact CA-OH 3.4Å; Q42-Y442 PolarHBondContact N-OH 2.82Å; P43-Y442 HydrophobicContact CB-CE2 4.5Å; P43-Y442 HydrophobicContact CG-CD2 4.36Å; P43-Y442 HydrophobicContact CG-CE2 3.77Å; M435-Y442 HydrophobicContact CE-CD1 3.8Å; M435-Y442 HydrophobicContact CE-CG 3.86Å; Y442-N450 HydrophobicContact CE1-CB 4.02Å; Y442-N450 HydrophobicContact CE2-CB 4.17Å; Y442-N450 VanDerWaalsContact OH-CB 3.25Å; Y442-N450 WeakPolarHBondContact OH-CB 3.44Å
443P96.9Very high97.1Very high84 Ų8457.2 Ų57.255%0.54532%0.315SS..  trans-58.6142.8173.9-25.632.9000113.9A445 Y446P443-A445 PolarHBondContact O-N 3.3Å; P443-Y446 HydrophobicContact CB-CD2 4.28Å; P443-Y446 HydrophobicContact CB-CE2 4.35Å; P443-Y446 HydrophobicContact CG-CD2 4.31Å; P443-Y446 HydrophobicContact CG-CE2 4.09Å; P443-Y446 PolarHBondContact O-N 3.34Å
444D95.9Very high97.2Very high125 Ų12554.6 Ų54.667%0.66830%0.297SS*.G310 helixtrans-50.6-26.7-177-62.5-0.9000114.8Y446 T447D444-Y446 PolarHBondContact O-N 3.03Å; D444-Y446 VanDerWaalsContact O-N 3.15Å; D444-T447 WeakPolarHBondContact CA-OG1 3.36Å; D444-T447 VanDerWaalsContact O-CB 3.25Å; D444-T447 WeakPolarHBondContact O-CB 3.37Å; D444-T447 PolarHBondContact O-N 3.19Å; D444-T447 VanDerWaalsContact O-N 3.1Å; D444-T447 PolarHBondContact O-OG1 3.21Å
445A97.1Very high97.2Very high87 Ų8756.1 Ų56.172%0.71930%0.298SS*.G310 helixtrans-57.6-24.8175.900000113.8P443P443-A445 PolarHBondContact O-N 3.3Å
446Y97.6Very high97.2Very high39 Ų3956 Ų5615%0.15330%0.298CS..G310 helixtrans-93.3-2.6-179.6-58.1-50000113.9L430 S433 M435 P443 D444 T448 W449 N450L430-Y446 HydrophobicContact CD2-CD1 3.94Å; L430-Y446 HydrophobicContact CD2-CG 4.12Å; S433-Y446 PolarHBondContact O-OH 2.88Å; S433-Y446 WeakPolarHBondContact OG-CE1 3.42Å; M435-Y446 HydrophobicContact CB-CD1 4.09Å; M435-Y446 HydrophobicContact CB-CD2 4.16Å; M435-Y446 HydrophobicContact CB-CE1 3.99Å; M435-Y446 HydrophobicContact CB-CE2 4.03Å; M435-Y446 HydrophobicContact CB-CG 4.17Å; M435-Y446 HydrophobicContact CG-CD2 3.98Å; M435-Y446 HydrophobicContact CG-CE2 4.17Å; M435-Y446 HydrophobicContact CG-CG 4.19Å; M435-Y446 HydrophobicContact SD-CD2 4.4Å; M435-Y446 HydrophobicContact SD-CG 4.19Å; P443-Y446 HydrophobicContact CB-CD2 4.28Å; P443-Y446 HydrophobicContact CB-CE2 4.35Å; P443-Y446 HydrophobicContact CG-CD2 4.31Å; P443-Y446 HydrophobicContact CG-CE2 4.09Å; P443-Y446 PolarHBondContact O-N 3.34Å; D444-Y446 PolarHBondContact O-N 3.03Å; D444-Y446 VanDerWaalsContact O-N 3.15Å; Y446-T448 PolarHBondContact O-N 2.86Å; Y446-W449 PolarHBondContact O-N 2.81Å; Y446-N450 PolarHBondContact O-N 3.02Å; Y446-N450 PolarHBondContact O-ND2 2.99Å; Y446-N450 VanDerWaalsContact O-ND2 3.13Å
447T97.3Very high97.3Very high28 Ų2854.3 Ų54.317%0.17229%0.287CS..Hα-helixtrans-58.5-47.5-171.2-560000113.2P43 D444 W449 N450 I451P43-T447 HydrophobicContact CG-CG2 4.35Å; P43-T447 WeakPolarHBondContact CG-OG1 3.25Å; D444-T447 WeakPolarHBondContact CA-OG1 3.36Å; D444-T447 VanDerWaalsContact O-CB 3.25Å; D444-T447 WeakPolarHBondContact O-CB 3.37Å; D444-T447 PolarHBondContact O-N 3.19Å; D444-T447 VanDerWaalsContact O-N 3.1Å; D444-T447 PolarHBondContact O-OG1 3.21Å; T447-W449 VanDerWaalsContact C-N 3.34Å; T447-W449 PolarHBondContact O-N 2.92Å; T447-N450 PolarHBondContact O-N 3.14Å; T447-N450 VanDerWaalsContact O-N 3.15Å; T447-I451 HydrophobicContact CG2-CD1 3.57Å; T447-I451 HydrophobicContact CG2-CG1 4.1Å; T447-I451 WeakPolarHBondContact O-CG1 3.47Å; T447-I451 PolarHBondContact O-N 2.6Å
448T97.4Very high97.3Very high104 Ų10457 Ų5764%0.63830%0.3SS*.Hα-helixtrans-56.7-46.8-175-54.80000112.4Y446 L452Y446-T448 PolarHBondContact O-N 2.86Å; T448-L452 PolarHBondContact O-N 3.37Å
449W98.2Very high97.4Very high98 Ų9856 Ų5637%0.37130%0.299SS..Hα-helixtrans-74.7-31.3-179.1-62.4130.9000112.6P426 F429 L430 Y446 T447 L452 S453P426-W449 HydrophobicContact CB-CB 4.07Å; P426-W449 HydrophobicContact CB-CD2 4.39Å; P426-W449 HydrophobicContact CB-CE3 3.9Å; P426-W449 HydrophobicContact CG-CE3 4.48Å; F429-W449 HydrophobicContact CB-CD2 4.36Å; F429-W449 HydrophobicContact CB-CG 4.41Å; F429-W449 HydrophobicContact CB-CZ2 4.47Å; F429-W449 HydrophobicContact CD2-CD2 4.34Å; F429-W449 HydrophobicContact CD2-CE3 4.42Å; F429-W449 HydrophobicContact CD2-CH2 4.14Å; F429-W449 HydrophobicContact CD2-CZ2 4.04Å; F429-W449 HydrophobicContact CD2-CZ3 4.32Å; F429-W449 HydrophobicContact CE2-CH2 4.44Å; F429-W449 HydrophobicContact CG-CZ2 4.35Å; L430-W449 HydrophobicContact CD1-CB 4.05Å; L430-W449 HydrophobicContact CD2-CB 3.58Å; L430-W449 HydrophobicContact CD2-CG 4.26Å; L430-W449 HydrophobicContact CG-CB 3.6Å; L430-W449 HydrophobicContact CG-CG 4.37Å; Y446-W449 PolarHBondContact O-N 2.81Å; T447-W449 VanDerWaalsContact C-N 3.34Å; T447-W449 PolarHBondContact O-N 2.92Å; W449-L452 HydrophobicContact CE3-CD2 4.13Å; W449-L452 HydrophobicContact CZ3-CD2 4.08Å; W449-S453 VanDerWaalsContact O-CB 3.23Å; W449-S453 WeakPolarHBondContact O-CB 3.23Å; W449-S453 PolarHBondContact O-N 3Å
450N98.2Very high97.5Very high0 Ų050.2 Ų50.20%028%0.279CS..Hα-helixtrans-68.6-42.5174.3-89.5-61.5000112.8R37 L40 M435 Y442 Y446 T447 L452 S453 S454R37-N450 PolarHBondContact NH2-O 2.88Å; R37-N450 PolarHBondContact NH2-OD1 2.72Å; L40-N450 WeakPolarHBondContact O-CB 3.44Å; M435-N450 WeakPolarHBondContact CE-ND2 3.47Å; M435-N450 PolarHBondContact SD-ND2 2.89Å; M435-N450 VanDerWaalsContact SD-ND2 3.4Å; Y442-N450 HydrophobicContact CE1-CB 4.02Å; Y442-N450 HydrophobicContact CE2-CB 4.17Å; Y442-N450 VanDerWaalsContact OH-CB 3.25Å; Y442-N450 WeakPolarHBondContact OH-CB 3.44Å; Y446-N450 PolarHBondContact O-N 3.02Å; Y446-N450 PolarHBondContact O-ND2 2.99Å; Y446-N450 VanDerWaalsContact O-ND2 3.13Å; T447-N450 PolarHBondContact O-N 3.14Å; T447-N450 VanDerWaalsContact O-N 3.15Å; N450-L452 VanDerWaalsContact C-N 3.34Å; N450-L452 PolarHBondContact O-N 3.44Å; N450-S453 PolarHBondContact O-N 2.97Å; N450-S454 WeakPolarHBondContact O-CB 3.21Å; N450-S454 PolarHBondContact O-N 2.67Å; N450-S454 PolarHBondContact O-OG 3.34Å; N450-S454 VanDerWaalsContact O-OG 3.09Å
451I98Very high97.6Very high83 Ų8352.2 Ų52.243%0.42629%0.288SS..Hα-helixtrans-57.6-49.5173.2-70.2170.2000109.8G41 T447 S453 S454 V455G41-I451 WeakPolarHBondContact O-CG1 3.45Å; T447-I451 HydrophobicContact CG2-CD1 3.57Å; T447-I451 HydrophobicContact CG2-CG1 4.1Å; T447-I451 WeakPolarHBondContact O-CG1 3.47Å; T447-I451 PolarHBondContact O-N 2.6Å; I451-S453 VanDerWaalsContact C-N 3.32Å; I451-S453 PolarHBondContact O-N 2.95Å; I451-S454 PolarHBondContact O-N 3.29Å; I451-V455 HydrophobicContact CG2-CG2 4.37Å; I451-V455 WeakPolarHBondContact O-CG2 3.23Å; I451-V455 PolarHBondContact O-N 3.23Å
452L98Very high97.7Very high64 Ų6452.6 Ų52.634%0.33529%0.293SS..Hα-helixtrans-61.4-42.8-180-171.362.1000111.7L422 P426 T448 W449 N450 S454 V455 G456L422-L452 HydrophobicContact CD2-CD1 4.05Å; L422-L452 HydrophobicContact CD2-CG 4.4Å; P426-L452 HydrophobicContact CB-CD2 4.49Å; P426-L452 HydrophobicContact CG-CB 4.3Å; P426-L452 HydrophobicContact CG-CD2 3.66Å; P426-L452 HydrophobicContact CG-CG 3.96Å; T448-L452 PolarHBondContact O-N 3.37Å; W449-L452 HydrophobicContact CE3-CD2 4.13Å; W449-L452 HydrophobicContact CZ3-CD2 4.08Å; N450-L452 VanDerWaalsContact C-N 3.34Å; N450-L452 PolarHBondContact O-N 3.44Å; L452-S454 VanDerWaalsContact C-N 3.34Å; L452-S454 PolarHBondContact O-N 2.99Å; L452-V455 PolarHBondContact O-N 3.43Å; L452-G456 PolarHBondContact O-N 3.43Å
453S98.4Very high97.7Very high0 Ų052 Ų520%029%0.291CS..Hα-helixtrans-61.3-41.9176.4-176.40000111.8L422 T423 Q427 W449 N450 I451 G456 S457L422-S453 WeakPolarHBondContact O-CA 3.23Å; T423-S453 WeakPolarHBondContact CA-O 3.29Å; T423-S453 VanDerWaalsContact O-CB 3.26Å; T423-S453 WeakPolarHBondContact O-CB 3.47Å; T423-S453 PolarHBondContact O-OG 2.88Å; Q427-S453 PolarHBondContact NE2-OG 3.34Å; W449-S453 VanDerWaalsContact O-CB 3.23Å; W449-S453 WeakPolarHBondContact O-CB 3.23Å; W449-S453 PolarHBondContact O-N 3Å; N450-S453 PolarHBondContact O-N 2.97Å; I451-S453 VanDerWaalsContact C-N 3.32Å; I451-S453 PolarHBondContact O-N 2.95Å; S453-G456 PolarHBondContact O-N 2.93Å; S453-S457 PolarHBondContact O-N 3.28Å; S453-S457 VanDerWaalsContact O-N 3.15Å
454S98.3Very high97.7Very high6 Ų649.4 Ų49.44%0.04227%0.273CS..Hα-helixtrans-70.5-39.7177.8-62.50000112.6R37 N450 I451 L452 G456 S457 F458R37-S454 PolarHBondContact NE-OG 3.3Å; R37-S454 PolarHBondContact NH2-OG 3.4Å; R37-S454 WeakPolarHBondContact O-CB 3.47Å; R37-S454 PolarHBondContact O-OG 3.23Å; N450-S454 WeakPolarHBondContact O-CB 3.21Å; N450-S454 PolarHBondContact O-N 2.67Å; N450-S454 PolarHBondContact O-OG 3.34Å; N450-S454 VanDerWaalsContact O-OG 3.09Å; I451-S454 PolarHBondContact O-N 3.29Å; L452-S454 VanDerWaalsContact C-N 3.34Å; L452-S454 PolarHBondContact O-N 2.99Å; S454-G456 VanDerWaalsContact C-N 3.3Å; S454-G456 PolarHBondContact O-N 3.14Å; S454-S457 WeakPolarHBondContact O-CB 3.42Å; S454-S457 PolarHBondContact O-N 2.72Å; S454-S457 VanDerWaalsContact O-N 3.1Å; S454-F458 WeakPolarHBondContact O-CD2 3.41Å; S454-F458 PolarHBondContact O-N 2.9Å; S454-F458 VanDerWaalsContact O-N 3.1Å
455V98.4Very high97.8Very high71 Ų7148.8 Ų48.843%0.4327%0.268SS..Hα-helixtrans-58.3-43.9171.7170.10000110.9I451 L452 S457 F458 I459I451-V455 HydrophobicContact CG2-CG2 4.37Å; I451-V455 WeakPolarHBondContact O-CG2 3.23Å; I451-V455 PolarHBondContact O-N 3.23Å; L452-V455 PolarHBondContact O-N 3.43Å; V455-S457 VanDerWaalsContact C-N 3.28Å; V455-S457 PolarHBondContact O-N 3.15Å; V455-F458 PolarHBondContact O-N 3.3Å; V455-I459 HydrophobicContact CG1-CD1 4.05Å; V455-I459 WeakPolarHBondContact O-CG1 3.32Å; V455-I459 PolarHBondContact O-N 3.45Å
456G98.4Very high97.9Very high0 Ų046 Ų460%024%0.241CC..Hα-helixtrans-55.6-42.917400000112.7G419 T423 L452 S453 S454 F458 I459 S460G419-G456 CarbonylContact C-O 3.41Å; G419-G456 WeakPolarHBondContact CA-O 3.42Å; G419-G456 CarbonylContact O-C 3.6Å; G419-G456 WeakPolarHBondContact O-CA 3.4Å; T423-G456 WeakPolarHBondContact OG1-CA 3.3Å; T423-G456 PolarHBondContact OG1-O 3.15Å; L452-G456 PolarHBondContact O-N 3.43Å; S453-G456 PolarHBondContact O-N 2.93Å; S454-G456 VanDerWaalsContact C-N 3.3Å; S454-G456 PolarHBondContact O-N 3.14Å; G456-F458 PolarHBondContact O-N 2.81Å; G456-I459 WeakPolarHBondContact O-CB 3.33Å; G456-I459 PolarHBondContact O-N 3.19Å; G456-S460 PolarHBondContact O-N 3.23Å; G456-S460 PolarHBondContact O-OG 3.25Å
457S97.9Very high97.9Very high10 Ų1045 Ų457%0.0724%0.237CC..Hα-helixtrans-65.4-40.4-179.6-177.10000112.1L34 T423 S453 S454 V455 I459 S460 L461L34-S457 WeakPolarHBondContact CD2-OG 3.46Å; T423-S457 WeakPolarHBondContact OG1-CA 3.41Å; T423-S457 PolarHBondContact OG1-N 3.29Å; S453-S457 PolarHBondContact O-N 3.28Å; S453-S457 VanDerWaalsContact O-N 3.15Å; S454-S457 WeakPolarHBondContact O-CB 3.42Å; S454-S457 PolarHBondContact O-N 2.72Å; S454-S457 VanDerWaalsContact O-N 3.1Å; V455-S457 VanDerWaalsContact C-N 3.28Å; V455-S457 PolarHBondContact O-N 3.15Å; S457-I459 VanDerWaalsContact C-N 3.35Å; S457-I459 PolarHBondContact O-N 3Å; S457-S460 WeakPolarHBondContact O-CB 3.39Å; S457-S460 PolarHBondContact O-N 3.21Å; S457-L461 PolarHBondContact O-N 3.36Å
458F97.6Very high97.9Very high101 Ų10147.6 Ų47.644%0.44325%0.249SC..Hα-helixtrans-66.5-34173.3-73-69.7000112.8L34 A38 S454 V455 G456 L461 T462L34-F458 HydrophobicContact CD2-CD1 4.21Å; L34-F458 HydrophobicContact CD2-CE1 4.36Å; A38-F458 HydrophobicContact CB-CZ 4.46Å; S454-F458 WeakPolarHBondContact O-CD2 3.41Å; S454-F458 PolarHBondContact O-N 2.9Å; S454-F458 VanDerWaalsContact O-N 3.1Å; V455-F458 PolarHBondContact O-N 3.3Å; G456-F458 PolarHBondContact O-N 2.81Å; F458-L461 WeakPolarHBondContact O-CB 3.31Å; F458-L461 PolarHBondContact O-N 3.43Å; F458-T462 PolarHBondContact O-N 2.65Å
459I98.4Very high98Very high48 Ų4846.3 Ų46.325%0.24624%0.235CC..Hα-helixtrans-64-44.8171.1-66165.6000109.9I415 L422 V455 G456 S457 L461 T462 A463I415-I459 HydrophobicContact CG2-CG2 3.86Å; L422-I459 HydrophobicContact CD1-CD1 3.74Å; V455-I459 HydrophobicContact CG1-CD1 4.05Å; V455-I459 WeakPolarHBondContact O-CG1 3.32Å; V455-I459 PolarHBondContact O-N 3.45Å; G456-I459 WeakPolarHBondContact O-CB 3.33Å; G456-I459 PolarHBondContact O-N 3.19Å; S457-I459 VanDerWaalsContact C-N 3.35Å; S457-I459 PolarHBondContact O-N 3Å; I459-L461 VanDerWaalsContact C-N 3.27Å; I459-L461 PolarHBondContact O-N 2.94Å; I459-T462 WeakPolarHBondContact O-CB 3.23Å; I459-T462 PolarHBondContact O-N 3.43Å; I459-T462 PolarHBondContact O-OG1 3.08Å; I459-A463 PolarHBondContact O-N 3.35Å
460S97.3Very high98Very high16 Ų1641.8 Ų41.811%0.11222%0.218CC..Hα-helixtrans-60.5-33.8175.6-710000113G419 V420 G456 S457 T462 A463 V464G419-S460 VanDerWaalsContact C-OG 3.29Å; V420-S460 PolarHBondContact N-OG 3.13Å; G456-S460 PolarHBondContact O-N 3.23Å; G456-S460 PolarHBondContact O-OG 3.25Å; S457-S460 WeakPolarHBondContact O-CB 3.39Å; S457-S460 PolarHBondContact O-N 3.21Å; S460-T462 VanDerWaalsContact C-N 3.31Å; S460-T462 PolarHBondContact O-N 2.89Å; S460-A463 WeakPolarHBondContact O-CB 3.37Å; S460-A463 PolarHBondContact O-N 3.02Å; S460-A463 VanDerWaalsContact O-N 3.14Å; S460-V464 PolarHBondContact O-N 3.36Å; S460-V464 VanDerWaalsContact O-N 3.07Å
461L97.4Very high97.9Very high55 Ų5544.4 Ų44.429%0.28823%0.232SC..Hα-helixtrans-58.6-41.9171.417062.5000111.7L34 S457 F458 I459 A463 V464 M465L34-L461 HydrophobicContact CD1-CB 4.14Å; L34-L461 HydrophobicContact CD1-CD1 3.83Å; L34-L461 HydrophobicContact CD1-CD2 3.87Å; L34-L461 HydrophobicContact CD1-CG 4.14Å; L34-L461 HydrophobicContact CD2-CB 4.12Å; L34-L461 HydrophobicContact CD2-CD2 4.44Å; S457-L461 PolarHBondContact O-N 3.36Å; F458-L461 WeakPolarHBondContact O-CB 3.31Å; F458-L461 PolarHBondContact O-N 3.43Å; I459-L461 VanDerWaalsContact C-N 3.27Å; I459-L461 PolarHBondContact O-N 2.94Å; L461-A463 PolarHBondContact O-N 3.17Å; L461-V464 PolarHBondContact O-N 2.89Å; L461-V464 VanDerWaalsContact O-N 3.11Å; L461-M465 HydrophobicContact CD1-CG 4.15Å; L461-M465 HydrophobicContact CD1-SD 4.45Å; L461-M465 WeakPolarHBondContact O-CG 3.19Å; L461-M465 PolarHBondContact O-N 3.2Å
462T97.9Very high97.9Very high73 Ų7348.2 Ų48.245%0.44824%0.241SC..Hα-helixtrans-62-34.2177.369.40000112.2I415 F458 I459 S460 M465 L466I415-T462 WeakPolarHBondContact CG2-OG1 3.25Å; F458-T462 PolarHBondContact O-N 2.65Å; I459-T462 WeakPolarHBondContact O-CB 3.23Å; I459-T462 PolarHBondContact O-N 3.43Å; I459-T462 PolarHBondContact O-OG1 3.08Å; S460-T462 VanDerWaalsContact C-N 3.31Å; S460-T462 PolarHBondContact O-N 2.89Å; T462-M465 PolarHBondContact O-N 3.22Å; T462-L466 WeakPolarHBondContact O-CB 3.42Å; T462-L466 PolarHBondContact O-N 3.18Å
463A97.8Very high97.9Very high0 Ų046.6 Ų46.60%023%0.232CC..Hα-helixtrans-66.1-43.1172.600000112H412 I415 M416 I459 S460 L461 M465 L466 M467H412-A463 PolarHBondContact CD2-O 3.34Å; H412-A463 PolarHBondContact NE2-O 3.4Å; I415-A463 HydrophobicContact CB-CB 4.23Å; I415-A463 HydrophobicContact CG2-CB 3.84Å; M416-A463 HydrophobicContact CB-CB 3.83Å; M416-A463 HydrophobicContact CE-CB 3.71Å; M416-A463 HydrophobicContact SD-CB 4.2Å; I459-A463 PolarHBondContact O-N 3.35Å; S460-A463 WeakPolarHBondContact O-CB 3.37Å; S460-A463 PolarHBondContact O-N 3.02Å; S460-A463 VanDerWaalsContact O-N 3.14Å; L461-A463 PolarHBondContact O-N 3.17Å; A463-M465 VanDerWaalsContact C-N 3.33Å; A463-M465 PolarHBondContact O-N 3.04Å; A463-L466 WeakPolarHBondContact O-CB 3.28Å; A463-L466 PolarHBondContact O-N 3.01Å; A463-L466 VanDerWaalsContact O-N 3.16Å; A463-M467 PolarHBondContact O-N 3.16Å
464V97.2Very high97.8Very high30 Ų3046.6 Ų46.618%0.18223%0.232CC..Hα-helixtrans-59.6-43.5175.7175.20000111.5T30 M416 S460 L461 L466 M467 I468T30-V464 HydrophobicContact CG2-CG2 4.34Å; M416-V464 HydrophobicContact CE-CG2 4.14Å; S460-V464 PolarHBondContact O-N 3.36Å; S460-V464 VanDerWaalsContact O-N 3.07Å; L461-V464 PolarHBondContact O-N 2.89Å; L461-V464 VanDerWaalsContact O-N 3.11Å; V464-L466 VanDerWaalsContact C-N 3.34Å; V464-L466 PolarHBondContact O-N 3.06Å; V464-M467 WeakPolarHBondContact O-CB 3.36Å; V464-M467 PolarHBondContact O-N 3.25Å; V464-I468 PolarHBondContact O-N 3.18Å
465M97.9Very high97.7Very high111 Ų11151 Ų5155%0.54725%0.25SS..Hα-helixtrans-64.3-39.3176-64-53.8-66.300112.1L461 T462 A463 M467 I468 F469L461-M465 HydrophobicContact CD1-CG 4.15Å; L461-M465 HydrophobicContact CD1-SD 4.45Å; L461-M465 WeakPolarHBondContact O-CG 3.19Å; L461-M465 PolarHBondContact O-N 3.2Å; T462-M465 PolarHBondContact O-N 3.22Å; A463-M465 VanDerWaalsContact C-N 3.33Å; A463-M465 PolarHBondContact O-N 3.04Å; M465-M467 VanDerWaalsContact C-N 3.34Å; M465-M467 PolarHBondContact O-N 2.92Å; M465-I468 PolarHBondContact O-N 3.06Å; M465-I468 HydrophobicContact SD-CD1 4.33Å; M465-F469 PolarHBondContact O-N 3.38Å
466L98.3Very high97.7Very high29 Ų2950.5 Ų50.515%0.15225%0.254CS..Hα-helixtrans-64.2-37.2175.4-179.259000112I411 H412 I415 T462 A463 V464 F469 M470I411-L466 HydrophobicContact CB-CD2 4.34Å; I411-L466 HydrophobicContact CG2-CD2 3.8Å; H412-L466 HydrophobicContact CB-CD2 3.8Å; H412-L466 HydrophobicContact CB-CG 4.19Å; I415-L466 HydrophobicContact CD1-CD2 4.09Å; T462-L466 WeakPolarHBondContact O-CB 3.42Å; T462-L466 PolarHBondContact O-N 3.18Å; A463-L466 WeakPolarHBondContact O-CB 3.28Å; A463-L466 PolarHBondContact O-N 3.01Å; A463-L466 VanDerWaalsContact O-N 3.16Å; V464-L466 VanDerWaalsContact C-N 3.34Å; V464-L466 PolarHBondContact O-N 3.06Å; L466-F469 HydrophobicContact CD1-CD1 3.96Å; L466-F469 WeakPolarHBondContact O-CB 3.35Å; L466-F469 PolarHBondContact O-N 3.24Å; L466-M470 HydrophobicContact CD1-CG 4.4Å; L466-M470 HydrophobicContact CG-CG 4.45Å; L466-M470 HydrophobicContact CG-SD 4.34Å; L466-M470 WeakPolarHBondContact O-CB 3.15Å; L466-M470 VanDerWaalsContact O-CG 3.27Å; L466-M470 WeakPolarHBondContact O-CG 3.21Å; L466-M470 PolarHBondContact O-N 2.87Å
467M97.8Very high97.5Very high17 Ų1752.9 Ų52.98%0.08427%0.27CS..Hα-helixtrans-60.6-46.2174177.758.692.600111.6M389 F392 H412 A463 V464 M465 F469 M470 I471M389-M467 HydrophobicContact CE-CE 4.49Å; M389-M467 HydrophobicContact SD-CE 3.26Å; M389-M467 WeakPolarHBondContact SD-CE 3.33Å; F392-M467 HydrophobicContact CD1-CE 4.01Å; F392-M467 HydrophobicContact CD1-SD 4.27Å; F392-M467 HydrophobicContact CE1-CE 4.31Å; F392-M467 HydrophobicContact CE1-SD 3.96Å; H412-M467 VanDerWaalsContact CE1-CE 3.47Å; H412-M467 WeakPolarHBondContact CE1-CE 3.47Å; A463-M467 PolarHBondContact O-N 3.16Å; V464-M467 WeakPolarHBondContact O-CB 3.36Å; V464-M467 PolarHBondContact O-N 3.25Å; M465-M467 VanDerWaalsContact C-N 3.34Å; M465-M467 PolarHBondContact O-N 2.92Å; M467-F469 VanDerWaalsContact C-N 3.3Å; M467-F469 PolarHBondContact O-N 3.3Å; M467-M470 WeakPolarHBondContact O-CB 3.09Å; M467-M470 PolarHBondContact O-N 3.46Å; M467-I471 HydrophobicContact CG-CD1 4.16Å; M467-I471 WeakPolarHBondContact O-CG1 3.41Å; M467-I471 PolarHBondContact O-N 3.19Å; M467-I471 HydrophobicContact SD-CD1 4.17Å; M467-I471 HydrophobicContact SD-CG1 4.23Å
468I97.6Very high97.3Very high83 Ų8358.6 Ų58.643%0.42629%0.294SS..Hα-helixtrans-60.2-44.1177.6-64165000110.3V464 M465 I471 W472V464-I468 PolarHBondContact O-N 3.18Å; M465-I468 PolarHBondContact O-N 3.06Å; M465-I468 HydrophobicContact SD-CD1 4.33Å; I468-I471 PolarHBondContact O-N 3.19Å; I468-W472 PolarHBondContact O-N 3.08Å
469F98.3Very high97Very high78 Ų7857.2 Ų57.234%0.34229%0.286SS..Hα-helixtrans-59.8-45.6174.7170.8-97.2000112.3Y408 M465 L466 M467 I471 W472 E473Y408-F469 HydrophobicContact CD2-CE1 4.17Å; Y408-F469 HydrophobicContact CE2-CE1 4.02Å; M465-F469 PolarHBondContact O-N 3.38Å; L466-F469 HydrophobicContact CD1-CD1 3.96Å; L466-F469 WeakPolarHBondContact O-CB 3.35Å; L466-F469 PolarHBondContact O-N 3.24Å; M467-F469 VanDerWaalsContact C-N 3.3Å; M467-F469 PolarHBondContact O-N 3.3Å; F469-I471 VanDerWaalsContact C-N 3.33Å; F469-I471 PolarHBondContact O-N 2.98Å; F469-W472 AromaticContact CD2-CE3 3.9Å; F469-W472 HydrophobicContact CD2-CE3 3.9Å; F469-W472 HydrophobicContact CD2-CZ3 4.12Å; F469-W472 AromaticContact CE2-CE3 3.88Å; F469-W472 HydrophobicContact CE2-CE3 3.88Å; F469-W472 AromaticContact CE2-CZ3 3.66Å; F469-W472 HydrophobicContact CE2-CZ3 3.66Å; F469-W472 HydrophobicContact CZ-CZ3 4.5Å; F469-W472 PolarHBondContact O-N 2.83Å; F469-E473 HydrophobicContact CE1-CB 4.31Å; F469-E473 HydrophobicContact CE1-CG 4.39Å; F469-E473 HydrophobicContact CZ-CB 4.31Å; F469-E473 HydrophobicContact CZ-CG 4.25Å; F469-E473 WeakPolarHBondContact O-CB 3.25Å; F469-E473 PolarHBondContact O-N 3.06Å
470M98.1Very high96.7Very high2 Ų262.2 Ų62.21%0.0131%0.306CS..Hα-helixtrans-60.2-41.9179.5-76.5173.151.300112.4L404 A409 H412 L466 M467 E473 A474L404-M470 HydrophobicContact CB-CE 4.3Å; L404-M470 HydrophobicContact CD1-CE 3.99Å; L404-M470 HydrophobicContact CD2-CB 4.42Å; L404-M470 HydrophobicContact CD2-CE 4.39Å; L404-M470 HydrophobicContact CG-CE 4.46Å; A409-M470 VanDerWaalsContact CA-CE 3.49Å; A409-M470 HydrophobicContact CB-CE 3.59Å; H412-M470 HydrophobicContact CB-SD 3.66Å; L466-M470 HydrophobicContact CD1-CG 4.4Å; L466-M470 HydrophobicContact CG-CG 4.45Å; L466-M470 HydrophobicContact CG-SD 4.34Å; L466-M470 WeakPolarHBondContact O-CB 3.15Å; L466-M470 VanDerWaalsContact O-CG 3.27Å; L466-M470 WeakPolarHBondContact O-CG 3.21Å; L466-M470 PolarHBondContact O-N 2.87Å; M467-M470 WeakPolarHBondContact O-CB 3.09Å; M467-M470 PolarHBondContact O-N 3.46Å; M470-E473 PolarHBondContact O-N 3.24Å; M470-A474 WeakPolarHBondContact O-CB 3.46Å; M470-A474 PolarHBondContact O-N 3.46Å
471I97.3Very high96.2Very high55 Ų5563.2 Ų63.228%0.28231%0.311SS..Hα-helixtrans-63.8-49.8176.9-65.9169.7000109.6F392 M467 I468 F469 E473 A474 F475F392-I471 HydrophobicContact CE1-CD1 4.08Å; F392-I471 HydrophobicContact CE1-CG1 4.06Å; F392-I471 HydrophobicContact CZ-CD1 3.76Å; F392-I471 HydrophobicContact CZ-CG1 3.94Å; M467-I471 HydrophobicContact CG-CD1 4.16Å; M467-I471 WeakPolarHBondContact O-CG1 3.41Å; M467-I471 PolarHBondContact O-N 3.19Å; M467-I471 HydrophobicContact SD-CD1 4.17Å; M467-I471 HydrophobicContact SD-CG1 4.23Å; I468-I471 PolarHBondContact O-N 3.19Å; F469-I471 VanDerWaalsContact C-N 3.33Å; F469-I471 PolarHBondContact O-N 2.98Å; I471-E473 VanDerWaalsContact C-N 3.32Å; I471-E473 PolarHBondContact O-N 3.03Å; I471-A474 PolarHBondContact O-N 3.03Å; I471-F475 HydrophobicContact CG2-CD2 3.92Å; I471-F475 HydrophobicContact CG2-CE2 3.84Å; I471-F475 VanDerWaalsContact O-CD2 3.23Å; I471-F475 WeakPolarHBondContact O-CD2 3.33Å; I471-F475 PolarHBondContact O-N 3.17Å
472W97.5Very high95.4Very high164 Ų16469 Ų6962%0.62134%0.341SS*.Hα-helixtrans-56.6-46.6176.617081.8000112I468 F469 A474 F475 A476I468-W472 PolarHBondContact O-N 3.08Å; F469-W472 AromaticContact CD2-CE3 3.9Å; F469-W472 HydrophobicContact CD2-CE3 3.9Å; F469-W472 HydrophobicContact CD2-CZ3 4.12Å; F469-W472 AromaticContact CE2-CE3 3.88Å; F469-W472 HydrophobicContact CE2-CE3 3.88Å; F469-W472 AromaticContact CE2-CZ3 3.66Å; F469-W472 HydrophobicContact CE2-CZ3 3.66Å; F469-W472 HydrophobicContact CZ-CZ3 4.5Å; F469-W472 PolarHBondContact O-N 2.83Å; W472-A474 VanDerWaalsContact C-N 3.35Å; W472-A474 PolarHBondContact O-N 3.26Å; W472-F475 PolarHBondContact O-N 3.05Å; W472-A476 HydrophobicContact CZ2-CB 4.45Å; W472-A476 WeakPolarHBondContact O-CB 3.33Å; W472-A476 PolarHBondContact O-N 3.35Å
473E97.7Very high94.5Very high30 Ų3073 Ų7314%0.1436%0.356CS..Hα-helixtrans-63.3-39.3-178.4-171.4-75.4147.100111.6F469 M470 I471 A476 S477 R479F469-E473 HydrophobicContact CE1-CB 4.31Å; F469-E473 HydrophobicContact CE1-CG 4.39Å; F469-E473 HydrophobicContact CZ-CB 4.31Å; F469-E473 HydrophobicContact CZ-CG 4.25Å; F469-E473 WeakPolarHBondContact O-CB 3.25Å; F469-E473 PolarHBondContact O-N 3.06Å; M470-E473 PolarHBondContact O-N 3.24Å; I471-E473 VanDerWaalsContact C-N 3.32Å; I471-E473 PolarHBondContact O-N 3.03Å; E473-A476 PolarHBondContact O-N 3.12Å; E473-S477 VanDerWaalsContact O-CB 3.25Å; E473-S477 WeakPolarHBondContact O-CB 3.41Å; E473-S477 PolarHBondContact O-N 3.22Å; E473-S477 PolarHBondContact O-OG 3.23Å; E473-R479 IonicContact OE1-CZ 2.81Å; E473-R479 IonicContact OE1-NH1 2.96Å; E473-R479 PolarHBondContact OE1-NH1 2.86Å; E473-R479 IonicContact OE1-NH2 3.75Å; E473-R479 IonicContact OE2-CZ 3.52Å; E473-R479 IonicContact OE2-NH1 3.5Å; E473-R479 PolarHBondContact OE2-NH1 3.1Å; E473-R479 IonicContact OE2-NH2 2.9Å; E473-R479 PolarHBondContact OE2-NH2 3.23Å
474A96.8Very high93.7Very high0 Ų074.1 Ų74.10%036%0.363CS..Hα-helixtrans-64.1-41.6175.800000112.6F396 L404 M470 I471 W472 S477 K478F396-A474 HydrophobicContact CE1-CB 3.8Å; F396-A474 HydrophobicContact CZ-CB 3.94Å; L404-A474 HydrophobicContact CD2-CB 3.93Å; M470-A474 WeakPolarHBondContact O-CB 3.46Å; M470-A474 PolarHBondContact O-N 3.46Å; I471-A474 PolarHBondContact O-N 3.03Å; W472-A474 VanDerWaalsContact C-N 3.35Å; W472-A474 PolarHBondContact O-N 3.26Å; A474-S477 PolarHBondContact O-OG 3Å; A474-K478 PolarHBondContact O-N 3.11Å
475F96.3Very high92.3Very high98 Ų9877 Ų7743%0.4338%0.375SS..Hα-helixtrans-73.4-31176.4-77-71000113.3F396 Y402 I471 W472 K478F396-F475 HydrophobicContact CE2-CE2 4.31Å; F396-F475 HydrophobicContact CZ-CE2 4.09Å; F396-F475 HydrophobicContact CZ-CZ 4.45Å; Y402-F475 AromaticContact CD2-CD1 3.63Å; Y402-F475 HydrophobicContact CD2-CD1 3.63Å; Y402-F475 AromaticContact CD2-CE1 3.67Å; Y402-F475 HydrophobicContact CD2-CE1 3.67Å; Y402-F475 AromaticContact CE2-CD1 3.56Å; Y402-F475 HydrophobicContact CE2-CD1 3.56Å; Y402-F475 AromaticContact CE2-CE1 3.75Å; Y402-F475 HydrophobicContact CE2-CE1 3.75Å; I471-F475 HydrophobicContact CG2-CD2 3.92Å; I471-F475 HydrophobicContact CG2-CE2 3.84Å; I471-F475 VanDerWaalsContact O-CD2 3.23Å; I471-F475 WeakPolarHBondContact O-CD2 3.33Å; I471-F475 PolarHBondContact O-N 3.17Å; W472-F475 PolarHBondContact O-N 3.05Å; F475-K478 VanDerWaalsContact O-CG 3.23Å; F475-K478 WeakPolarHBondContact O-CG 3.32Å
476A97.4Very high90.9Very high61 Ų6176.6 Ų76.650%0.50437%0.372SS..Hα-helixtrans-72.3-44.9175.600000111.7W472 E473W472-A476 HydrophobicContact CZ2-CB 4.45Å; W472-A476 WeakPolarHBondContact O-CB 3.33Å; W472-A476 PolarHBondContact O-N 3.35Å; E473-A476 PolarHBondContact O-N 3.12Å
477S95.5Very high89.2Confident49 Ų4977.8 Ų77.834%0.34338%0.381SS..Hα-helixtrans-75.1-25.1179.563.80000113.4E473 A474 R479E473-S477 VanDerWaalsContact O-CB 3.25Å; E473-S477 WeakPolarHBondContact O-CB 3.41Å; E473-S477 PolarHBondContact O-N 3.22Å; E473-S477 PolarHBondContact O-OG 3.23Å; A474-S477 PolarHBondContact O-OG 3Å; S477-R479 PolarHBondContact O-N 3.27Å; S477-R479 PolarHBondContact OG-NH1 3.36Å
478K93.8Very high87.5Confident131 Ų13181.7 Ų81.757%0.5741%0.41SS*.THydrogen-bonded Turntrans5337.1-179.8-59.1-178.4-177.8176.20113.1Y402 A474 F475 K480Y402-K478 HydrophobicContact CD1-CB 4.36Å; Y402-K478 HydrophobicContact CE1-CB 3.73Å; Y402-K478 HydrophobicContact CE1-CG 4.22Å; A474-K478 PolarHBondContact O-N 3.11Å; F475-K478 VanDerWaalsContact O-CG 3.23Å; F475-K478 WeakPolarHBondContact O-CG 3.32Å; K478-K480 PolarHBondContact O-N 2.96Å
479R91.1Very high86.4Confident72 Ų7281.6 Ų81.627%0.27241%0.409SS..  trans-65.997176.7-72.7-171.8-61-91.9-14.5110.3Y402 T403 E473 S477Y402-R479 CarbonylContact C-O 3.48Å; Y402-R479 WeakPolarHBondContact CA-O 3.28Å; T403-R479 PolarHBondContact N-O 2.91Å; T403-R479 PolarHBondContact O-NE 3.02Å; T403-R479 PolarHBondContact O-NH2 3.32Å; T403-R479 VanDerWaalsContact O-NH2 3.15Å; T403-R479 WeakPolarHBondContact OG1-CB 3.31Å; T403-R479 PolarHBondContact OG1-O 3.33Å; E473-R479 IonicContact OE1-CZ 2.81Å; E473-R479 IonicContact OE1-NH1 2.96Å; E473-R479 PolarHBondContact OE1-NH1 2.86Å; E473-R479 IonicContact OE1-NH2 3.75Å; E473-R479 IonicContact OE2-CZ 3.52Å; E473-R479 IonicContact OE2-NH1 3.5Å; E473-R479 PolarHBondContact OE2-NH1 3.1Å; E473-R479 IonicContact OE2-NH2 2.9Å; E473-R479 PolarHBondContact OE2-NH2 3.23Å; S477-R479 PolarHBondContact O-N 3.27Å; S477-R479 PolarHBondContact OG-NH1 3.36Å
480K91Very high85.8Confident153 Ų15379.3 Ų79.367%0.66540%0.4SS*.BIsolated β-bridgetrans-70.2149.7-179.2-67.6-175.3178.6-177.30111.9Y402 K478 L482Y402-K480 HydrophobicContact CD1-CG 4.33Å; Y402-K480 HydrophobicContact CE1-CG 4.15Å; K478-K480 PolarHBondContact O-N 2.96Å; K480-L482 PolarHBondContact O-N 3.05Å
481V87.8Confident85.4Confident36 Ų3680.6 Ų80.622%0.21841%0.407CS..  trans-65.9121.1169.6-174.10000109.1P397 G401 T403 V484 C497P397-V481 HydrophobicContact CB-CG2 3.6Å; G401-V481 PolarHBondContact O-N 3.45Å; T403-V481 HydrophobicContact CG2-CG2 3.94Å; V481-V484 HydrophobicContact CG1-CG2 3.97Å; V481-C497 HydrophobicContact CB-CB 4.24Å; V481-C497 HydrophobicContact CG2-CB 4Å
482L80.2Confident85.2Confident176 Ų17678.1 Ų78.192%0.92139%0.394SS*.  trans-84.8-43.5177.8-66.1175.2000111.9K480K480-L482 PolarHBondContact O-N 3.05Å
483M79Confident84.9Confident158 Ų15870.9 Ų70.978%0.77837%0.367SS*.  trans-154.4140.1179.9-173.2173.6178.800109.1
484V80.3Confident84.6Confident24 Ų2473.7 Ų73.715%0.14538%0.382CS..  trans-95.4133.4167.6-1770000108.1V481 W493V481-V484 HydrophobicContact CG1-CG2 3.97Å; V484-W493 HydrophobicContact CG1-CB 3.86Å; V484-W493 HydrophobicContact CG1-CD2 3.76Å; V484-W493 HydrophobicContact CG1-CE3 3.84Å; V484-W493 HydrophobicContact CG1-CG 3.76Å; V484-W493 HydrophobicContact CG2-CE3 3.94Å; V484-W493 HydrophobicContact CG2-CZ3 4.5Å
485E69.6Low84.2Confident89 Ų8977.9 Ų77.942%0.41640%0.399SS..SBendtrans-80.5136.2177.1-57.2-179.9143.200109.7Y259 K332Y259-E485 WeakPolarHBondContact CE2-O 3.37Å; Y259-E485 PolarHBondContact OH-N 3.43Å; Y259-E485 PolarHBondContact OH-O 3.05Å; K332-E485 WeakPolarHBondContact CD-OE2 3.34Å; K332-E485 IonicContact NZ-OE1 3.72Å; K332-E485 PolarHBondContact NZ-OE1 3.12Å; K332-E485 IonicContact NZ-OE2 3.94Å; K332-E485 PolarHBondContact NZ-OE2 3Å
486E67.8Low83.8Confident104 Ų10474.8 Ų74.849%0.48639%0.394SS..  trans55.652.1177.1-57.2-62.6155.700116.7S488 M489E486-S488 PolarHBondContact O-N 3.3Å; E486-M489 PolarHBondContact O-N 2.84Å
487P61.5Low83.6Confident53 Ų5373.3 Ų73.334%0.34438%0.38SS..THydrogen-bonded Turntrans-68.4-17.5179.430.2-35.7000113.5M489 W493P487-M489 VanDerWaalsContact C-N 3.33Å; P487-M489 PolarHBondContact O-N 3.08Å; P487-W493 HydrophobicContact CB-CB 4.38Å
488S63.1Low83.5Confident100 Ų10074.4 Ų74.470%0.69939%0.386SS*.THydrogen-bonded Turntrans-75.6-19.6-178.357.10000113.8E486E486-S488 PolarHBondContact O-N 3.3Å
489M73.9Confident83.5Confident80 Ų8068.8 Ų68.839%0.39436%0.363SS..THydrogen-bonded Turntrans-95.6-17.9179.7-59.4-172-168.500113.1K264 E486 P487K264-M489 HydrophobicContact CB-SD 4.12Å; K264-M489 HydrophobicContact CD-CE 4.25Å; K264-M489 HydrophobicContact CG-CE 3.83Å; K264-M489 HydrophobicContact CG-SD 3.75Å; E486-M489 PolarHBondContact O-N 2.84Å; P487-M489 VanDerWaalsContact C-N 3.33Å; P487-M489 PolarHBondContact O-N 3.08Å
490N86.3Confident83.6Confident31 Ų3168.8 Ų68.817%0.16637%0.372CS..  trans-131104.2-172.4-66-65000109.6E492 W493N490-E492 PolarHBondContact O-N 3.29Å; N490-E492 VanDerWaalsContact O-N 3.16Å; N490-W493 PolarHBondContact O-N 2.93Å
491L90.1Very high83.5Confident28 Ų2867.1 Ų67.115%0.14736%0.363CS..G310 helixtrans-59.6-28.2-172.6-68.5178.9000113.4L84 M175 W493 L494 V508 M510L84-L491 WeakPolarHBondContact O-CB 3.35Å; M175-L491 HydrophobicContact CE-CD1 4.13Å; L491-W493 PolarHBondContact O-N 2.92Å; L491-L494 VanDerWaalsContact O-CB 3.29Å; L491-L494 WeakPolarHBondContact O-CB 3.29Å; L491-L494 PolarHBondContact O-N 2.75Å; L491-L494 VanDerWaalsContact O-N 3.16Å; L491-V508 HydrophobicContact CD2-CG1 3.99Å; L491-M510 HydrophobicContact CD1-SD 4.24Å
492E92.8Very high83.6Confident4 Ų471.3 Ų71.32%0.01938%0.379CS..G310 helixtrans-64.7-21.8-177.870.9-84.7-160.200113.6L84 M85 L398 N490L84-E492 HydrophobicContact CB-CB 3.89Å; L84-E492 HydrophobicContact CD1-CB 4.35Å; M85-E492 HydrophobicContact CE-CG 4.24Å; M85-E492 HydrophobicContact CG-CB 4.25Å; L398-E492 WeakPolarHBondContact CD1-O 3.43Å; L398-E492 HydrophobicContact CD2-CB 4.14Å; L398-E492 HydrophobicContact CD2-CG 4.19Å; N490-E492 PolarHBondContact O-N 3.29Å; N490-E492 VanDerWaalsContact O-N 3.16Å
493W92.1Very high84.1Confident12 Ų1263 Ų635%0.04534%0.336CS..G310 helixtrans-93.7-4.1179.6-57.2100.6000113.9H394 W395 P397 L398 V484 P487 N490 L491 Y495 G496 C497H394-W493 AromaticContact CE1-CZ2 3.84Å; H394-W493 AromaticContact NE2-CZ2 3.99Å; H394-W493 WeakPolarHBondContact O-CH2 3.43Å; W395-W493 AromaticContact CD1-CH2 3.91Å; W395-W493 AromaticContact CD1-CZ2 3.4Å; W395-W493 HydrophobicContact CG-CZ2 4.36Å; W395-W493 AromaticContact NE1-CZ2 3.83Å; P397-W493 HydrophobicContact CB-CZ3 4.33Å; L398-W493 HydrophobicContact CB-CE3 4.21Å; L398-W493 HydrophobicContact CB-CH2 3.79Å; L398-W493 HydrophobicContact CB-CZ3 3.54Å; L398-W493 HydrophobicContact CD1-CE3 3.98Å; L398-W493 HydrophobicContact CD1-CZ3 4.18Å; L398-W493 HydrophobicContact CG-CZ3 4.37Å; V484-W493 HydrophobicContact CG1-CB 3.86Å; V484-W493 HydrophobicContact CG1-CD2 3.76Å; V484-W493 HydrophobicContact CG1-CE3 3.84Å; V484-W493 HydrophobicContact CG1-CG 3.76Å; V484-W493 HydrophobicContact CG2-CE3 3.94Å; V484-W493 HydrophobicContact CG2-CZ3 4.5Å; P487-W493 HydrophobicContact CB-CB 4.38Å; N490-W493 PolarHBondContact O-N 2.93Å; L491-W493 PolarHBondContact O-N 2.92Å; W493-Y495 PolarHBondContact O-N 3.23Å; W493-G496 PolarHBondContact O-N 2.86Å; W493-C497 VanDerWaalsContact CE3-SG 3.56Å
494L89.6Confident84.6Confident88 Ų8855.9 Ų55.946%0.46130%0.301SS..THydrogen-bonded Turntrans-63.9-38.1-170.1-175.663.8000113.4L491 G496 F504L491-L494 VanDerWaalsContact O-CB 3.29Å; L491-L494 WeakPolarHBondContact O-CB 3.29Å; L491-L494 PolarHBondContact O-N 2.75Å; L491-L494 VanDerWaalsContact O-N 3.16Å; L494-G496 PolarHBondContact O-N 3.11Å; L494-F504 HydrophobicContact CD2-CE1 4.36Å
495Y88.9Confident84.8Confident89 Ų8962.8 Ų62.835%0.34933%0.331SS..THydrogen-bonded Turntrans-95.820.6-175.2-69.7-83.9000113.9W493 P499 P500 T503 F504W493-Y495 PolarHBondContact O-N 3.23Å; Y495-P499 WeakPolarHBondContact O-CA 3.49Å; Y495-P500 WeakPolarHBondContact O-CD 3.45Å; Y495-T503 HydrophobicContact CD1-CG2 4.16Å; Y495-T503 HydrophobicContact CD2-CG2 3.72Å; Y495-T503 HydrophobicContact CE2-CG2 4.35Å; Y495-T503 HydrophobicContact CG-CG2 3.61Å; Y495-F504 HydrophobicContact CD2-CE1 4.24Å; Y495-F504 HydrophobicContact CD2-CE2 4.27Å; Y495-F504 HydrophobicContact CD2-CZ 4.03Å; Y495-F504 AromaticContact CE2-CD1 3.55Å; Y495-F504 HydrophobicContact CE2-CD1 3.55Å; Y495-F504 HydrophobicContact CE2-CD2 4.19Å; Y495-F504 AromaticContact CE2-CE1 3.44Å; Y495-F504 HydrophobicContact CE2-CE1 3.44Å; Y495-F504 VanDerWaalsContact CE2-CE1 3.44Å; Y495-F504 HydrophobicContact CE2-CE2 4.02Å; Y495-F504 AromaticContact CE2-CG 3.96Å; Y495-F504 HydrophobicContact CE2-CG 3.96Å; Y495-F504 AromaticContact CE2-CZ 3.67Å; Y495-F504 HydrophobicContact CE2-CZ 3.67Å; Y495-F504 PolarHBondContact OH-N 3.25Å
496G88.6Confident85.3Confident33 Ų3366 Ų6634%0.3435%0.347SS..  trans79.8-171.5177.200000114.3W493 L494 P498W493-G496 PolarHBondContact O-N 2.86Å; L494-G496 PolarHBondContact O-N 3.11Å; G496-P498 CarbonylContact O-C 3.54Å
497C92.4Very high85.8Confident30 Ų3066 Ų6620%0.20336%0.356CS..SBendtrans-134.9105.1-170.6-68.30000110.7P397 G401 V481 W493P397-C497 WeakPolarHBondContact O-CB 3.37Å; G401-C497 VanDerWaalsContact CA-O 3.3Å; G401-C497 WeakPolarHBondContact CA-O 3.47Å; V481-C497 HydrophobicContact CB-CB 4.24Å; V481-C497 HydrophobicContact CG2-CB 4Å; W493-C497 VanDerWaalsContact CE3-SG 3.56Å
498P93.9Very high86.6Confident71 Ų7164.6 Ų64.646%0.46135%0.346SS..SBendcis-77.2155.9-4.934.3-35.1000112.3L398 G496L398-P498 WeakPolarHBondContact O-CA 3.3Å; G496-P498 CarbonylContact O-C 3.54Å
499P93.4Very high87Confident13 Ų1369.2 Ų69.28%0.08435%0.349CS..PPolyproline II helixtrans-66.8154.6174.127.7-34000111.7K12 W80 L84 L398 Y495 T503K12-P499 HydrophobicContact CD-CG 4.32Å; W80-P499 HydrophobicContact CZ3-CG 4.13Å; L84-P499 HydrophobicContact CD1-CG 4.42Å; L398-P499 HydrophobicContact CD1-CG 4.4Å; L398-P499 WeakPolarHBondContact O-CD 3.25Å; Y495-P499 WeakPolarHBondContact O-CA 3.49Å; P499-T503 HydrophobicContact CB-CG2 4.02Å
500P93.4Very high86.7Confident73 Ų7368.1 Ų68.147%0.47434%0.344SS..PPolyproline II helixtrans-59163.7172.5-19.931.7000111.9K12 Y495 H502K12-P500 PolarHBondContact NZ-O 3.39Å; Y495-P500 WeakPolarHBondContact O-CD 3.45Å; P500-H502 PolarHBondContact O-N 3.48Å
501Y89.2Confident85.6Confident118 Ų11875.4 Ų75.446%0.46337%0.374SS..SBendtrans-56.4-51.3179.2-70-75.6000112.2R4 N10 K12R4-Y501 PolarHBondContact NH1-OH 2.82Å; R4-Y501 PolarHBondContact NH2-OH 3.42Å; N10-Y501 PolarHBondContact ND2-O 3.35Å; K12-Y501 PolarHBondContact NZ-O 3.47Å
502H89.6Confident83.8Confident123 Ų12381.8 Ų81.857%0.56942%0.421SS*.SBendtrans-98.5129.4173.6-59.8-67.2000109.3P500P500-H502 PolarHBondContact O-N 3.48Å
503T91.2Very high83.4Confident2 Ų285.7 Ų85.71%0.01244%0.441CS..  trans-129.1156.9176.9400000107.8K12 P89 Y495 P499 E505K12-T503 PolarHBondContact NZ-OG1 2.79Å; P89-T503 VanDerWaalsContact CA-O 3.25Å; P89-T503 WeakPolarHBondContact CA-O 3.28Å; P89-T503 WeakPolarHBondContact CB-O 3.47Å; Y495-T503 HydrophobicContact CD1-CG2 4.16Å; Y495-T503 HydrophobicContact CD2-CG2 3.72Å; Y495-T503 HydrophobicContact CE2-CG2 4.35Å; Y495-T503 HydrophobicContact CG-CG2 3.61Å; P499-T503 HydrophobicContact CB-CG2 4.02Å; T503-E505 PolarHBondContact O-N 2.86Å
504F89.6Confident82.9Confident8 Ų889.6 Ų89.64%0.03546%0.462CS..  trans58.546.8178-48.3-76.1000113.7L84 G87 A88 L494 Y495 E506 V508L84-F504 HydrophobicContact CD2-CE2 3.93Å; G87-F504 WeakPolarHBondContact O-CB 3.3Å; G87-F504 WeakPolarHBondContact O-CG 3.5Å; A88-F504 WeakPolarHBondContact O-CD2 3.39Å; L494-F504 HydrophobicContact CD2-CE1 4.36Å; Y495-F504 HydrophobicContact CD2-CE1 4.24Å; Y495-F504 HydrophobicContact CD2-CE2 4.27Å; Y495-F504 HydrophobicContact CD2-CZ 4.03Å; Y495-F504 AromaticContact CE2-CD1 3.55Å; Y495-F504 HydrophobicContact CE2-CD1 3.55Å; Y495-F504 HydrophobicContact CE2-CD2 4.19Å; Y495-F504 AromaticContact CE2-CE1 3.44Å; Y495-F504 HydrophobicContact CE2-CE1 3.44Å; Y495-F504 VanDerWaalsContact CE2-CE1 3.44Å; Y495-F504 HydrophobicContact CE2-CE2 4.02Å; Y495-F504 AromaticContact CE2-CG 3.96Å; Y495-F504 HydrophobicContact CE2-CG 3.96Å; Y495-F504 AromaticContact CE2-CZ 3.67Å; Y495-F504 HydrophobicContact CE2-CZ 3.67Å; Y495-F504 PolarHBondContact OH-N 3.25Å; F504-E506 CarbonylContact C-O 3.22Å; F504-E506 PolarHBondContact O-N 2.92Å; F504-V508 HydrophobicContact CD1-CG2 3.12Å; F504-V508 HydrophobicContact CE1-CG2 3.26Å; F504-V508 HydrophobicContact CG-CG2 4.24Å
505E84.1Confident82.6Confident169 Ų16989.7 Ų89.779%0.7946%0.462SS*.SBendtrans-60.7-30.4171.5-65.7-174.9179.400111.7T503T503-E505 PolarHBondContact O-N 2.86Å
506E80.9Confident82.2Confident158 Ų15889.7 Ų89.774%0.73847%0.469SS*.SBendtrans-109.8144.2168.3-64-175.5174.300110.4F504 V508F504-E506 CarbonylContact C-O 3.22Å; F504-E506 PolarHBondContact O-N 2.92Å; E506-V508 PolarHBondContact O-N 2.65Å
507P77.6Confident81.8Confident104 Ų10493.3 Ų93.368%0.67548%0.477SS*.  trans-58.3134.1177.2-23.633.2000112.2Y509P507-Y509 PolarHBondContact O-N 3.03Å
508V77.4Confident81.1Confident23 Ų2397.5 Ų97.514%0.13950%0.495CS..  trans-61.9125.2177-174.50000110.4P172 L491 F504 E506 M510P172-V508 HydrophobicContact CG-CB 4.11Å; L491-V508 HydrophobicContact CD2-CG1 3.99Å; F504-V508 HydrophobicContact CD1-CG2 3.12Å; F504-V508 HydrophobicContact CE1-CG2 3.26Å; F504-V508 HydrophobicContact CG-CG2 4.24Å; E506-V508 PolarHBondContact O-N 2.65Å; V508-M510 HydrophobicContact CG1-CG 4.21Å; V508-M510 HydrophobicContact CG1-SD 4.5Å; V508-M510 PolarHBondContact O-N 3.21Å
509Y72.4Confident80.2Confident196 Ų19699.4 Ų99.477%0.76950%0.498SS*.  trans-80.2112.2167.2-175.3-97.5000110.1P507 K511P507-Y509 PolarHBondContact O-N 3.03Å; Y509-K511 HydrophobicContact CE1-CB 4.38Å
510M67.9Low79.1Confident58 Ų58106 Ų10629%0.28653%0.53SS..  trans-99.6120175.5-67.6-91.9-71.300109A174 M175 L491 V508A174-M510 HydrophobicContact CB-CB 4.33Å; M175-M510 HydrophobicContact CE-CE 3.45Å; M175-M510 VanDerWaalsContact CE-CE 3.45Å; M175-M510 HydrophobicContact CE-SD 4.13Å; L491-M510 HydrophobicContact CD1-SD 4.24Å; V508-M510 HydrophobicContact CG1-CG 4.21Å; V508-M510 HydrophobicContact CG1-SD 4.5Å; V508-M510 PolarHBondContact O-N 3.21Å
511K63.4Low77.9Confident184 Ų184108.8 Ų108.880%0.853%0.534SS*.  trans-82.7120.6170.5-157.3175-175.31790107.7Y509Y509-K511 HydrophobicContact CE1-CB 4.38Å
512S52Low76.9Confident162 Ų162107.9 Ų107.9100%1.13354%0.541SS*.  trans-510-175.261.70000114.3

Retrieved 512 of 512 residues in 378 ms (Link to these results)