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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 A0A077HBL8, Species DROME (Drosophila melanogaster, Fruit fly), Gene COI, Length 280 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
1A74.6Confident95.1Very high110 Ų11058 Ų5891%0.90934%0.342SS*.  0-60000000112.1G4 M5A1-G4 PolarHBondContact O-N 3.44Å; A1-M5 PolarHBondContact O-N 3.41Å
2W93.8Very high95.4Very high151 Ų15162.3 Ų62.357%0.57236%0.361SS*.Hα-helixtrans-57.7-54.8-176.6-173.286.1000114.5G4 M5 V6 L86 L90W2-G4 VanDerWaalsContact C-N 3.28Å; W2-G4 PolarHBondContact O-N 3.33Å; W2-M5 WeakPolarHBondContact O-CB 3.36Å; W2-M5 PolarHBondContact O-N 3.02Å; W2-V6 HydrophobicContact CD2-CG2 4.24Å; W2-V6 HydrophobicContact CE3-CG2 4.21Å; W2-V6 HydrophobicContact CH2-CG2 3.97Å; W2-V6 HydrophobicContact CZ2-CG2 4Å; W2-V6 HydrophobicContact CZ3-CG2 4.07Å; W2-V6 PolarHBondContact O-N 3.28Å; W2-V6 VanDerWaalsContact O-N 3.17Å; W2-L86 HydrophobicContact CE3-CD2 3.75Å; W2-L86 HydrophobicContact CZ3-CD2 3.5Å; W2-L86 HydrophobicContact CZ3-CG 4.13Å; W2-L90 HydrophobicContact CH2-CD1 3.63Å; W2-L90 HydrophobicContact CZ3-CD1 3.95Å
3A96.1Very high95.6Very high10 Ų1064.2 Ų64.28%0.08337%0.368CS..Hα-helixtrans-57.7-40179.200000112.5M5 V6 G7 I41 F45 L86A3-M5 VanDerWaalsContact C-N 3.32Å; A3-M5 PolarHBondContact O-N 3.27Å; A3-V6 WeakPolarHBondContact O-CB 3.37Å; A3-V6 PolarHBondContact O-N 2.87Å; A3-V6 VanDerWaalsContact O-N 3.17Å; A3-G7 PolarHBondContact O-N 3.46Å; A3-I41 HydrophobicContact CB-CG2 4.24Å; A3-I41 WeakPolarHBondContact O-CG2 3.44Å; A3-F45 HydrophobicContact CB-CB 3.87Å; A3-F45 WeakPolarHBondContact CB-O 3.5Å; A3-L86 HydrophobicContact CB-CD2 3.77Å
4G95.9Very high95.8Very high9 Ų960.9 Ų60.99%0.09335%0.348CS..Hα-helixtrans-62.7-34.8176.200000113.7A1 W2 T8 M46A1-G4 PolarHBondContact O-N 3.44Å; W2-G4 VanDerWaalsContact C-N 3.28Å; W2-G4 PolarHBondContact O-N 3.33Å; G4-T8 WeakPolarHBondContact O-CB 3.17Å; G4-T8 PolarHBondContact O-N 3.12Å; G4-T8 PolarHBondContact O-OG1 2.89Å; G4-M46 VanDerWaalsContact CA-SD 3.57Å
5M97.4Very high96Very high120 Ų12068.6 Ų68.659%0.59137%0.369SS*.Hα-helixtrans-66.6-43.5172.9-68-172.4-66.100111.1A1 W2 A3 T8 S9A1-M5 PolarHBondContact O-N 3.41Å; W2-M5 WeakPolarHBondContact O-CB 3.36Å; W2-M5 PolarHBondContact O-N 3.02Å; A3-M5 VanDerWaalsContact C-N 3.32Å; A3-M5 PolarHBondContact O-N 3.27Å; M5-T8 PolarHBondContact O-N 3.01Å; M5-S9 PolarHBondContact O-N 2.95Å; M5-S9 PolarHBondContact O-OG 3.41Å; M5-S9 VanDerWaalsContact O-OG 3.05Å
6V97.9Very high96Very high36 Ų3667.1 Ų67.122%0.21837%0.37CS..Hα-helixtrans-58.9-50.1174.6179.80000110.5W2 A3 T8 S9 L10 I41 L90W2-V6 HydrophobicContact CD2-CG2 4.24Å; W2-V6 HydrophobicContact CE3-CG2 4.21Å; W2-V6 HydrophobicContact CH2-CG2 3.97Å; W2-V6 HydrophobicContact CZ2-CG2 4Å; W2-V6 HydrophobicContact CZ3-CG2 4.07Å; W2-V6 PolarHBondContact O-N 3.28Å; W2-V6 VanDerWaalsContact O-N 3.17Å; A3-V6 WeakPolarHBondContact O-CB 3.37Å; A3-V6 PolarHBondContact O-N 2.87Å; A3-V6 VanDerWaalsContact O-N 3.17Å; V6-T8 VanDerWaalsContact C-N 3.32Å; V6-T8 PolarHBondContact O-N 3.41Å; V6-S9 WeakPolarHBondContact O-CB 3.39Å; V6-S9 PolarHBondContact O-N 3.15Å; V6-L10 WeakPolarHBondContact O-CG 3.35Å; V6-L10 PolarHBondContact O-N 3.12Å; V6-I41 HydrophobicContact CG1-CD1 3.84Å; V6-L90 HydrophobicContact CG1-CD2 4.33Å
7G98Very high96.1Very high0 Ų064.5 Ų64.50%035%0.354CS..Hα-helixtrans-60-39.8178.100000112.8A3 L10 S11 H38A3-G7 PolarHBondContact O-N 3.46Å; G7-L10 PolarHBondContact O-N 3.18Å; G7-S11 PolarHBondContact O-N 2.89Å; G7-H38 PolarHBondContact O-CE1 3.05Å; G7-H38 PolarHBondContact O-ND1 3.16Å
8T98Very high96.2Very high68 Ų6866.6 Ų66.642%0.41736%0.364SS..Hα-helixtrans-65.9-42.1175.8-57.20000111.5G4 M5 V6 L10 S11 I12G4-T8 WeakPolarHBondContact O-CB 3.17Å; G4-T8 PolarHBondContact O-N 3.12Å; G4-T8 PolarHBondContact O-OG1 2.89Å; M5-T8 PolarHBondContact O-N 3.01Å; V6-T8 VanDerWaalsContact C-N 3.32Å; V6-T8 PolarHBondContact O-N 3.41Å; T8-L10 VanDerWaalsContact C-N 3.33Å; T8-L10 PolarHBondContact O-N 3.42Å; T8-S11 VanDerWaalsContact O-CB 3.29Å; T8-S11 WeakPolarHBondContact O-CB 3.13Å; T8-S11 PolarHBondContact O-N 2.71Å; T8-S11 VanDerWaalsContact O-N 3.13Å; T8-I12 HydrophobicContact CG2-CD1 4.33Å; T8-I12 WeakPolarHBondContact O-CG1 3.43Å; T8-I12 PolarHBondContact O-N 2.98Å
9S98.1Very high96.2Very high68 Ų6866.2 Ų66.248%0.47638%0.377SS..Hα-helixtrans-59.5-43.1174.8-61.30000111.8M5 V6 S11 I12 L13M5-S9 PolarHBondContact O-N 2.95Å; M5-S9 PolarHBondContact O-OG 3.41Å; M5-S9 VanDerWaalsContact O-OG 3.05Å; V6-S9 WeakPolarHBondContact O-CB 3.39Å; V6-S9 PolarHBondContact O-N 3.15Å; S9-S11 VanDerWaalsContact C-N 3.33Å; S9-S11 PolarHBondContact O-N 3.24Å; S9-I12 PolarHBondContact O-N 3.28Å; S9-L13 WeakPolarHBondContact O-CG 3.18Å; S9-L13 PolarHBondContact O-N 3.08Å; S9-L13 VanDerWaalsContact O-N 3.09Å
10L98.4Very high96.1Very high30 Ų3068.5 Ų68.516%0.15738%0.384CS..Hα-helixtrans-62.1-39.7174.3-62.7176.4000111.8V6 G7 T8 I12 L13 I14 I34 A37 H38 I41V6-L10 WeakPolarHBondContact O-CG 3.35Å; V6-L10 PolarHBondContact O-N 3.12Å; G7-L10 PolarHBondContact O-N 3.18Å; T8-L10 VanDerWaalsContact C-N 3.33Å; T8-L10 PolarHBondContact O-N 3.42Å; L10-I12 VanDerWaalsContact C-N 3.33Å; L10-I12 PolarHBondContact O-N 2.96Å; L10-L13 HydrophobicContact CD2-CD1 4.43Å; L10-L13 WeakPolarHBondContact O-CB 3.46Å; L10-L13 PolarHBondContact O-N 3.49Å; L10-I14 VanDerWaalsContact O-CG1 3.3Å; L10-I14 WeakPolarHBondContact O-CG1 3.25Å; L10-I14 PolarHBondContact O-N 3.29Å; L10-I34 HydrophobicContact CB-CG2 3.97Å; L10-I34 HydrophobicContact CD2-CG1 4.44Å; L10-I34 HydrophobicContact CD2-CG2 4.01Å; L10-A37 HydrophobicContact CD1-CB 3.86Å; L10-H38 HydrophobicContact CB-CB 3.9Å; L10-H38 HydrophobicContact CD1-CB 4.33Å; L10-I41 HydrophobicContact CD1-CD1 3.85Å
11S98.3Very high96Very high36 Ų3671.6 Ų71.625%0.25241%0.407SS..Hα-helixtrans-59.6-42.3174.1-171.20000112.4G7 T8 S9 L13 I14 R15G7-S11 PolarHBondContact O-N 2.89Å; T8-S11 VanDerWaalsContact O-CB 3.29Å; T8-S11 WeakPolarHBondContact O-CB 3.13Å; T8-S11 PolarHBondContact O-N 2.71Å; T8-S11 VanDerWaalsContact O-N 3.13Å; S9-S11 VanDerWaalsContact C-N 3.33Å; S9-S11 PolarHBondContact O-N 3.24Å; S11-L13 VanDerWaalsContact C-N 3.32Å; S11-L13 PolarHBondContact O-N 2.95Å; S11-I14 PolarHBondContact O-N 3.36Å; S11-R15 WeakPolarHBondContact O-CG 3.4Å; S11-R15 PolarHBondContact O-N 3.43Å
12I98.3Very high96.9Very high109 Ų10969.1 Ų69.156%0.55939%0.393SS*.Hα-helixtrans-62.8-41.1177-67.6167.7000110.4T8 S9 L10 R15 A16T8-I12 HydrophobicContact CG2-CD1 4.33Å; T8-I12 WeakPolarHBondContact O-CG1 3.43Å; T8-I12 PolarHBondContact O-N 2.98Å; S9-I12 PolarHBondContact O-N 3.28Å; L10-I12 VanDerWaalsContact C-N 3.33Å; L10-I12 PolarHBondContact O-N 2.96Å; I12-R15 PolarHBondContact O-N 2.75Å; I12-A16 WeakPolarHBondContact O-CB 3.3Å; I12-A16 PolarHBondContact O-N 2.83Å
13L98Very high96.7Very high88 Ų8865.4 Ų65.446%0.46139%0.394SS..Hα-helixtrans-62.5-44.8175.4-65.6175.6000112.1S9 L10 S11 R15 A16 E17 I34S9-L13 WeakPolarHBondContact O-CG 3.18Å; S9-L13 PolarHBondContact O-N 3.08Å; S9-L13 VanDerWaalsContact O-N 3.09Å; L10-L13 HydrophobicContact CD2-CD1 4.43Å; L10-L13 WeakPolarHBondContact O-CB 3.46Å; L10-L13 PolarHBondContact O-N 3.49Å; S11-L13 VanDerWaalsContact C-N 3.32Å; S11-L13 PolarHBondContact O-N 2.95Å; L13-R15 VanDerWaalsContact C-N 3.31Å; L13-R15 PolarHBondContact O-N 3.35Å; L13-A16 PolarHBondContact O-N 3.05Å; L13-E17 PolarHBondContact O-N 3.34Å; L13-I34 HydrophobicContact CB-CG2 4.42Å; L13-I34 HydrophobicContact CD1-CD1 4.36Å
14I98.4Very high96.6Very high17 Ų1770 Ų709%0.08742%0.417CS..Hα-helixtrans-57.3-46.5175-65.3162.5000110.3L10 S11 E17 L18 Y31 I34 V35 H38L10-I14 VanDerWaalsContact O-CG1 3.3Å; L10-I14 WeakPolarHBondContact O-CG1 3.25Å; L10-I14 PolarHBondContact O-N 3.29Å; S11-I14 PolarHBondContact O-N 3.36Å; I14-E17 PolarHBondContact O-N 3.38Å; I14-L18 HydrophobicContact CG2-CD1 4.09Å; I14-L18 WeakPolarHBondContact O-CG 3.1Å; I14-L18 PolarHBondContact O-N 2.93Å; I14-L18 VanDerWaalsContact O-N 3.1Å; I14-Y31 HydrophobicContact CB-CE2 4.48Å; I14-Y31 HydrophobicContact CG2-CE2 4.02Å; I14-I34 HydrophobicContact CD1-CG2 4.08Å; I14-I34 HydrophobicContact CG1-CG2 3.65Å; I14-V35 HydrophobicContact CD1-CB 4.39Å; I14-V35 HydrophobicContact CD1-CG2 3.85Å; I14-V35 HydrophobicContact CG1-CG2 3.9Å; I14-V35 HydrophobicContact CG2-CG2 4.41Å; I14-H38 HydrophobicContact CD1-CB 3.89Å
15R98.1Very high96.6Very high177 Ų17772.4 Ų72.467%0.66843%0.427SS*.Hα-helixtrans-70.7-31-179.4-65.9-60.5-177.4-178.6-0.6113S11 I12 L13 G19S11-R15 WeakPolarHBondContact O-CG 3.4Å; S11-R15 PolarHBondContact O-N 3.43Å; I12-R15 PolarHBondContact O-N 2.75Å; L13-R15 VanDerWaalsContact C-N 3.31Å; L13-R15 PolarHBondContact O-N 3.35Å; R15-G19 PolarHBondContact O-N 2.88Å
16A97.3Very high96.5Very high45 Ų4569.6 Ų69.637%0.37243%0.429SS..Hα-helixtrans-67.2-44.7173.500000111.2I12 L13 L18 G19 L24I12-A16 WeakPolarHBondContact O-CB 3.3Å; I12-A16 PolarHBondContact O-N 2.83Å; L13-A16 PolarHBondContact O-N 3.05Å; A16-L18 VanDerWaalsContact C-N 3.29Å; A16-L18 PolarHBondContact O-N 3.32Å; A16-G19 PolarHBondContact O-N 3.48Å; A16-G19 VanDerWaalsContact O-N 3.17Å; A16-L24 HydrophobicContact CB-CD2 3.96Å
17E97.3Very high96.4Very high23 Ų2371.3 Ų71.311%0.10744%0.437CS..Hα-helixtrans-57.9-43.5174.4-173.262.7-151.800111.5L13 I14 G19 A23 L24 I25 Y31L13-E17 PolarHBondContact O-N 3.34Å; I14-E17 PolarHBondContact O-N 3.38Å; E17-G19 VanDerWaalsContact C-N 3.25Å; E17-G19 PolarHBondContact O-N 3.46Å; E17-A23 WeakPolarHBondContact OE1-CA 3.38Å; E17-L24 PolarHBondContact OE1-N 2.94Å; E17-L24 WeakPolarHBondContact OE2-CA 3.36Å; E17-L24 VanDerWaalsContact OE2-CB 3.23Å; E17-L24 WeakPolarHBondContact OE2-CB 3.41Å; E17-L24 PolarHBondContact OE2-N 3.29Å; E17-I25 HydrophobicContact CB-CD1 4.14Å; E17-I25 HydrophobicContact CG-CD1 4.17Å; E17-I25 WeakPolarHBondContact OE2-CB 3.33Å; E17-I25 WeakPolarHBondContact OE2-CD1 3.4Å; E17-I25 WeakPolarHBondContact OE2-CG1 3.5Å; E17-I25 PolarHBondContact OE2-N 3.42Å; E17-Y31 HydrophobicContact CB-CD2 4.08Å; E17-Y31 HydrophobicContact CB-CE2 4.13Å; E17-Y31 HydrophobicContact CG-CD2 3.79Å; E17-Y31 HydrophobicContact CG-CE2 4.08Å
18L97.3Very high96.3Very high101 Ų10177.4 Ų77.453%0.52947%0.47SS..THydrogen-bonded Turntrans-83.17.2-178.8-61.9177.9000114.3I14 A16 H20 Y31I14-L18 HydrophobicContact CG2-CD1 4.09Å; I14-L18 WeakPolarHBondContact O-CG 3.1Å; I14-L18 PolarHBondContact O-N 2.93Å; I14-L18 VanDerWaalsContact O-N 3.1Å; A16-L18 VanDerWaalsContact C-N 3.29Å; A16-L18 PolarHBondContact O-N 3.32Å; L18-H20 PolarHBondContact O-N 3.38Å; L18-Y31 WeakPolarHBondContact CD1-OH 3.31Å; L18-Y31 HydrophobicContact CG-CE2 4.39Å
19G97Very high96.3Very high60 Ų6076.6 Ų76.662%0.61946%0.461SS*.THydrogen-bonded Turntrans-70.6-28.4-174.500000114.1R15 A16 E17R15-G19 PolarHBondContact O-N 2.88Å; A16-G19 PolarHBondContact O-N 3.48Å; A16-G19 VanDerWaalsContact O-N 3.17Å; E17-G19 VanDerWaalsContact C-N 3.25Å; E17-G19 PolarHBondContact O-N 3.46Å
20H94.1Very high96.2Very high112 Ų11277.3 Ų77.352%0.51946%0.459SS..SBendtrans-151.5157.4174.158.970.1000110.1L18L18-H20 PolarHBondContact O-N 3.38Å
21P94.6Very high96.2Very high133 Ų13378.4 Ų78.486%0.86446%0.461SS*.SBendtrans-58144.7170.1-22.233.6000111.8
22G92.1Very high96.2Very high59 Ų5979.8 Ų79.861%0.60847%0.466SS*.SBendtrans115.1176.7-173.900000111.7
23A90.5Very high96.2Very high73 Ų7375.2 Ų75.260%0.60344%0.443SS*.  trans-107.1121-179.700000110.4E17E17-A23 WeakPolarHBondContact OE1-CA 3.38Å
24L93.9Very high96.3Very high105 Ų10572 Ų7255%0.5543%0.426SS..SBendtrans-93.3-46172.4169.674.3000110.6A16 E17A16-L24 HydrophobicContact CB-CD2 3.96Å; E17-L24 PolarHBondContact OE1-N 2.94Å; E17-L24 WeakPolarHBondContact OE2-CA 3.36Å; E17-L24 VanDerWaalsContact OE2-CB 3.23Å; E17-L24 WeakPolarHBondContact OE2-CB 3.41Å; E17-L24 PolarHBondContact OE2-N 3.29Å
25I95.6Very high96.3Very high60 Ų6073.4 Ų73.431%0.30844%0.435SS..SBendtrans-73-39175.1-71162.5000110.5E17 D27 I30 Y31 I34E17-I25 HydrophobicContact CB-CD1 4.14Å; E17-I25 HydrophobicContact CG-CD1 4.17Å; E17-I25 WeakPolarHBondContact OE2-CB 3.33Å; E17-I25 WeakPolarHBondContact OE2-CD1 3.4Å; E17-I25 WeakPolarHBondContact OE2-CG1 3.5Å; E17-I25 PolarHBondContact OE2-N 3.42Å; I25-D27 VanDerWaalsContact C-N 3.29Å; I25-D27 HydrophobicContact CG2-CB 4.3Å; I25-D27 PolarHBondContact O-N 2.96Å; I25-I30 HydrophobicContact CG2-CB 4.02Å; I25-I30 HydrophobicContact CG2-CG2 3.88Å; I25-Y31 HydrophobicContact CD1-CD2 4.33Å; I25-I34 HydrophobicContact CD1-CD1 4.11Å
26G95.1Very high96.3Very high62 Ų6265.1 Ų65.164%0.63940%0.404SS*.SBendtrans78.86.7-179.300000115.1
27D95.9Very high96.4Very high72 Ų7263.3 Ų63.339%0.38539%0.389SS..  trans-145.3112.9178.3-173.2-38.3000110.6I25 Q29 I30 Y31I25-D27 VanDerWaalsContact C-N 3.29Å; I25-D27 HydrophobicContact CG2-CB 4.3Å; I25-D27 PolarHBondContact O-N 2.96Å; D27-Q29 VanDerWaalsContact C-N 3.31Å; D27-Q29 PolarHBondContact O-N 3.3Å; D27-Q29 WeakPolarHBondContact OD1-CA 3.38Å; D27-Q29 WeakPolarHBondContact OD1-CB 3.44Å; D27-Q29 PolarHBondContact OD1-N 2.82Å; D27-I30 HydrophobicContact CB-CB 4.14Å; D27-I30 HydrophobicContact CB-CD1 3.9Å; D27-I30 HydrophobicContact CB-CG1 4Å; D27-I30 PolarHBondContact O-N 3.22Å; D27-I30 PolarHBondContact OD1-N 2.99Å; D27-I30 VanDerWaalsContact OD1-N 3.12Å; D27-Y31 PolarHBondContact O-N 3.38Å
28D95.9Very high96.4Very high128 Ų12864.2 Ų64.268%0.68439%0.393SS*.Hα-helixtrans-66.9-30.7-177.9-64.5-18.8000112.7Y31 N32D28-Y31 WeakPolarHBondContact O-CB 3.31Å; D28-Y31 PolarHBondContact O-N 2.93Å; D28-N32 VanDerWaalsContact O-CG 3.32Å; D28-N32 PolarHBondContact O-N 3.14Å; D28-N32 PolarHBondContact O-ND2 3.36Å
29Q97.5Very high96.5Very high50 Ų5060.3 Ų60.323%0.23438%0.375CS..Hα-helixtrans-70.6-42.8178.5176.262.79.200110.4D27 Y31 N32 V33 N97 H115D27-Q29 VanDerWaalsContact C-N 3.31Å; D27-Q29 PolarHBondContact O-N 3.3Å; D27-Q29 WeakPolarHBondContact OD1-CA 3.38Å; D27-Q29 WeakPolarHBondContact OD1-CB 3.44Å; D27-Q29 PolarHBondContact OD1-N 2.82Å; Q29-Y31 VanDerWaalsContact C-N 3.25Å; Q29-Y31 PolarHBondContact O-N 3.22Å; Q29-N32 PolarHBondContact O-N 2.65Å; Q29-N32 VanDerWaalsContact O-N 3.12Å; Q29-V33 HydrophobicContact CG-CG2 4.48Å; Q29-V33 VanDerWaalsContact O-CG2 3.31Å; Q29-V33 WeakPolarHBondContact O-CG2 3.49Å; Q29-V33 PolarHBondContact O-N 3.11Å; Q29-N97 HydrophobicContact CG-CB 4.26Å; Q29-N97 WeakPolarHBondContact CG-O 3.41Å; Q29-N97 PolarHBondContact NE2-O 3.27Å; Q29-H115 PolarHBondContact NE2-NE2 3.39Å; Q29-H115 VanDerWaalsContact NE2-NE2 3.11Å
30I97.8Very high96.6Very high83 Ų8357.6 Ų57.643%0.42635%0.347SS..Hα-helixtrans-58.6-42.5174.3-66.8179.6000110.1I25 D27 N32 V33 I34I25-I30 HydrophobicContact CG2-CB 4.02Å; I25-I30 HydrophobicContact CG2-CG2 3.88Å; D27-I30 HydrophobicContact CB-CB 4.14Å; D27-I30 HydrophobicContact CB-CD1 3.9Å; D27-I30 HydrophobicContact CB-CG1 4Å; D27-I30 PolarHBondContact O-N 3.22Å; D27-I30 PolarHBondContact OD1-N 2.99Å; D27-I30 VanDerWaalsContact OD1-N 3.12Å; I30-N32 PolarHBondContact O-N 3.38Å; I30-V33 PolarHBondContact O-N 3.2Å; I30-I34 HydrophobicContact CG2-CD1 3.89Å; I30-I34 HydrophobicContact CG2-CG1 4.43Å; I30-I34 VanDerWaalsContact O-CG1 3.29Å; I30-I34 WeakPolarHBondContact O-CG1 3.41Å; I30-I34 PolarHBondContact O-N 3.35Å
31Y97.9Very high96.8Very high53 Ų5352.2 Ų52.221%0.20832%0.322CS..Hα-helixtrans-57.5-47.7174.2175.1-94.9000112I14 E17 L18 I25 D27 D28 Q29 V33 I34 V35I14-Y31 HydrophobicContact CB-CE2 4.48Å; I14-Y31 HydrophobicContact CG2-CE2 4.02Å; E17-Y31 HydrophobicContact CB-CD2 4.08Å; E17-Y31 HydrophobicContact CB-CE2 4.13Å; E17-Y31 HydrophobicContact CG-CD2 3.79Å; E17-Y31 HydrophobicContact CG-CE2 4.08Å; L18-Y31 WeakPolarHBondContact CD1-OH 3.31Å; L18-Y31 HydrophobicContact CG-CE2 4.39Å; I25-Y31 HydrophobicContact CD1-CD2 4.33Å; D27-Y31 PolarHBondContact O-N 3.38Å; D28-Y31 WeakPolarHBondContact O-CB 3.31Å; D28-Y31 PolarHBondContact O-N 2.93Å; Q29-Y31 VanDerWaalsContact C-N 3.25Å; Q29-Y31 PolarHBondContact O-N 3.22Å; Y31-V33 VanDerWaalsContact C-N 3.34Å; Y31-V33 PolarHBondContact O-N 3.32Å; Y31-I34 PolarHBondContact O-N 3.22Å; Y31-V35 HydrophobicContact CD1-CG2 4.16Å; Y31-V35 HydrophobicContact CE1-CG2 3.71Å; Y31-V35 HydrophobicContact CE2-CG2 4.15Å; Y31-V35 WeakPolarHBondContact O-CG2 3.08Å; Y31-V35 PolarHBondContact O-N 3.29Å
32N98.4Very high97Very high65 Ų6548 Ų4835%0.34829%0.291SS..Hα-helixtrans-63.4-37178.4-69.5-33.4000113.1D28 Q29 I30 V35 T36D28-N32 VanDerWaalsContact O-CG 3.32Å; D28-N32 PolarHBondContact O-N 3.14Å; D28-N32 PolarHBondContact O-ND2 3.36Å; Q29-N32 PolarHBondContact O-N 2.65Å; Q29-N32 VanDerWaalsContact O-N 3.12Å; I30-N32 PolarHBondContact O-N 3.38Å; N32-V35 PolarHBondContact O-N 2.87Å; N32-T36 WeakPolarHBondContact O-CB 3.42Å; N32-T36 PolarHBondContact O-N 3.47Å; N32-T36 PolarHBondContact O-OG1 2.85Å
33V98.6Very high97.2Very high13 Ų1346.6 Ų46.68%0.07927%0.269CS..Hα-helixtrans-64.3-44.2174.7173.30000110.7Q29 I30 Y31 T36 A37 N97Q29-V33 HydrophobicContact CG-CG2 4.48Å; Q29-V33 VanDerWaalsContact O-CG2 3.31Å; Q29-V33 WeakPolarHBondContact O-CG2 3.49Å; Q29-V33 PolarHBondContact O-N 3.11Å; I30-V33 PolarHBondContact O-N 3.2Å; Y31-V33 VanDerWaalsContact C-N 3.34Å; Y31-V33 PolarHBondContact O-N 3.32Å; V33-T36 PolarHBondContact O-N 3.39Å; V33-A37 VanDerWaalsContact O-CB 3.29Å; V33-A37 WeakPolarHBondContact O-CB 3.47Å; V33-A37 PolarHBondContact O-N 3.23Å; V33-N97 WeakPolarHBondContact CG2-O 3.2Å
34I98.5Very high97.5Very high22 Ų2243.5 Ų43.511%0.11324%0.242CC..Hα-helixtrans-61.4-46176.3-68.7169.2000110.5L10 L13 I14 I25 I30 Y31 T36 A37 H38L10-I34 HydrophobicContact CB-CG2 3.97Å; L10-I34 HydrophobicContact CD2-CG1 4.44Å; L10-I34 HydrophobicContact CD2-CG2 4.01Å; L13-I34 HydrophobicContact CB-CG2 4.42Å; L13-I34 HydrophobicContact CD1-CD1 4.36Å; I14-I34 HydrophobicContact CD1-CG2 4.08Å; I14-I34 HydrophobicContact CG1-CG2 3.65Å; I25-I34 HydrophobicContact CD1-CD1 4.11Å; I30-I34 HydrophobicContact CG2-CD1 3.89Å; I30-I34 HydrophobicContact CG2-CG1 4.43Å; I30-I34 VanDerWaalsContact O-CG1 3.29Å; I30-I34 WeakPolarHBondContact O-CG1 3.41Å; I30-I34 PolarHBondContact O-N 3.35Å; Y31-I34 PolarHBondContact O-N 3.22Å; I34-T36 PolarHBondContact O-N 2.98Å; I34-A37 PolarHBondContact O-N 3.14Å; I34-H38 VanDerWaalsContact O-CB 3.23Å; I34-H38 WeakPolarHBondContact O-CB 3.22Å; I34-H38 PolarHBondContact O-N 2.61Å
35V98.7Very high97.7Very high46 Ų4639.1 Ų39.128%0.27922%0.219SC..Hα-helixtrans-60.3-46.2177.51710000111.2I14 Y31 N32 H38 A39I14-V35 HydrophobicContact CD1-CB 4.39Å; I14-V35 HydrophobicContact CD1-CG2 3.85Å; I14-V35 HydrophobicContact CG1-CG2 3.9Å; I14-V35 HydrophobicContact CG2-CG2 4.41Å; Y31-V35 HydrophobicContact CD1-CG2 4.16Å; Y31-V35 HydrophobicContact CE1-CG2 3.71Å; Y31-V35 HydrophobicContact CE2-CG2 4.15Å; Y31-V35 WeakPolarHBondContact O-CG2 3.08Å; Y31-V35 PolarHBondContact O-N 3.29Å; N32-V35 PolarHBondContact O-N 2.87Å; V35-H38 PolarHBondContact O-N 3.17Å; V35-A39 PolarHBondContact O-N 3.5Å; V35-A39 VanDerWaalsContact O-N 3.11Å
36T98.6Very high97.8Very high3 Ų339 Ų392%0.01822%0.217CC..Hα-helixtrans-64-48.9-180-56.50000111.2N32 V33 I34 A39 F40 A99 G102N32-T36 WeakPolarHBondContact O-CB 3.42Å; N32-T36 PolarHBondContact O-N 3.47Å; N32-T36 PolarHBondContact O-OG1 2.85Å; V33-T36 PolarHBondContact O-N 3.39Å; I34-T36 PolarHBondContact O-N 2.98Å; T36-A39 PolarHBondContact O-N 2.93Å; T36-F40 HydrophobicContact CG2-CD2 3.81Å; T36-F40 HydrophobicContact CG2-CE2 3.48Å; T36-F40 VanDerWaalsContact CG2-CE2 3.48Å; T36-F40 HydrophobicContact CG2-CZ 4.41Å; T36-F40 WeakPolarHBondContact O-CD2 3.22Å; T36-F40 PolarHBondContact O-N 3.45Å; T36-F40 VanDerWaalsContact O-N 3.11Å; T36-A99 VanDerWaalsContact CB-O 3.25Å; T36-A99 WeakPolarHBondContact CB-O 3.3Å; T36-A99 WeakPolarHBondContact CG2-O 3.46Å; T36-A99 PolarHBondContact OG1-O 3.36Å; T36-G102 VanDerWaalsContact OG1-CA 3.27Å; T36-G102 WeakPolarHBondContact OG1-CA 3.44Å; T36-G102 PolarHBondContact OG1-N 3.07Å
37A98.6Very high97.9Very high7 Ų738 Ų386%0.05820%0.199CC..Hα-helixtrans-63.6-41.9178.300000112.1L10 V33 I34 A39 F40 I41L10-A37 HydrophobicContact CD1-CB 3.86Å; V33-A37 VanDerWaalsContact O-CB 3.29Å; V33-A37 WeakPolarHBondContact O-CB 3.47Å; V33-A37 PolarHBondContact O-N 3.23Å; I34-A37 PolarHBondContact O-N 3.14Å; A37-A39 PolarHBondContact O-N 3Å; A37-F40 PolarHBondContact O-N 3.19Å; A37-I41 VanDerWaalsContact O-CB 3.28Å; A37-I41 WeakPolarHBondContact O-CB 3.21Å; A37-I41 WeakPolarHBondContact O-CG1 3.01Å; A37-I41 PolarHBondContact O-N 3.42Å
38H98.7Very high97.8Very high42 Ų4235 Ų3519%0.19418%0.183CC..Hα-helixtrans-55-53175.1169.468.2000111G7 L10 I14 I34 V35 F40 I41 M42G7-H38 PolarHBondContact O-CE1 3.05Å; G7-H38 PolarHBondContact O-ND1 3.16Å; L10-H38 HydrophobicContact CB-CB 3.9Å; L10-H38 HydrophobicContact CD1-CB 4.33Å; I14-H38 HydrophobicContact CD1-CB 3.89Å; I34-H38 VanDerWaalsContact O-CB 3.23Å; I34-H38 WeakPolarHBondContact O-CB 3.22Å; I34-H38 PolarHBondContact O-N 2.61Å; V35-H38 PolarHBondContact O-N 3.17Å; H38-F40 PolarHBondContact O-N 3.13Å; H38-I41 PolarHBondContact O-N 3.17Å; H38-M42 WeakPolarHBondContact CE1-CG 3.33Å; H38-M42 WeakPolarHBondContact O-CB 3.32Å; H38-M42 VanDerWaalsContact O-CG 3.23Å; H38-M42 WeakPolarHBondContact O-CG 3.38Å; H38-M42 PolarHBondContact O-N 3.27Å
39A98.5Very high97.8Very high18 Ų1830.4 Ų30.415%0.14916%0.16CC..Hα-helixtrans-59.9-48.5-178.100000111.9V35 T36 A37 I41 M42 I43 W103V35-A39 PolarHBondContact O-N 3.5Å; V35-A39 VanDerWaalsContact O-N 3.11Å; T36-A39 PolarHBondContact O-N 2.93Å; A37-A39 PolarHBondContact O-N 3Å; A39-I41 PolarHBondContact O-N 3.18Å; A39-M42 PolarHBondContact O-N 2.93Å; A39-I43 WeakPolarHBondContact O-CG1 3.38Å; A39-I43 PolarHBondContact O-N 3.31Å; A39-W103 HydrophobicContact CB-CB 3.53Å; A39-W103 HydrophobicContact CB-CG 4.15Å
40F98.4Very high97.8Very high3 Ų331 Ų311%0.01316%0.164CC..Hα-helixtrans-63.2-43.2178.6-72.8-40.9000112.9T36 A37 H38 M42 F44 L89 W103 V105 L127T36-F40 HydrophobicContact CG2-CD2 3.81Å; T36-F40 HydrophobicContact CG2-CE2 3.48Å; T36-F40 VanDerWaalsContact CG2-CE2 3.48Å; T36-F40 HydrophobicContact CG2-CZ 4.41Å; T36-F40 WeakPolarHBondContact O-CD2 3.22Å; T36-F40 PolarHBondContact O-N 3.45Å; T36-F40 VanDerWaalsContact O-N 3.11Å; A37-F40 PolarHBondContact O-N 3.19Å; H38-F40 PolarHBondContact O-N 3.13Å; F40-M42 PolarHBondContact O-N 3.46Å; F40-F44 AromaticContact CD1-CD2 3.85Å; F40-F44 HydrophobicContact CD1-CD2 3.85Å; F40-F44 AromaticContact CD1-CE2 3.75Å; F40-F44 HydrophobicContact CD1-CE2 3.75Å; F40-F44 HydrophobicContact CE1-CE2 4.2Å; F40-F44 WeakPolarHBondContact O-CB 3.14Å; F40-F44 PolarHBondContact O-N 2.65Å; F40-L89 HydrophobicContact CB-CD1 4.14Å; F40-L89 HydrophobicContact CB-CD2 3.63Å; F40-L89 HydrophobicContact CD2-CD1 3.82Å; F40-L89 HydrophobicContact CG-CD1 4.38Å; F40-W103 HydrophobicContact CD1-CB 4.39Å; F40-W103 HydrophobicContact CE1-CB 4.07Å; F40-W103 WeakPolarHBondContact CE1-O 3.39Å; F40-W103 HydrophobicContact CZ-CB 4.36Å; F40-W103 VanDerWaalsContact CZ-O 3.23Å; F40-W103 WeakPolarHBondContact CZ-O 3.31Å; F40-V105 HydrophobicContact CE2-CG2 4.23Å; F40-V105 HydrophobicContact CZ-CG2 3.55Å; F40-L127 HydrophobicContact CD1-CD2 3.86Å; F40-L127 HydrophobicContact CE1-CD1 3.85Å; F40-L127 HydrophobicContact CE1-CD2 3.96Å; F40-L127 HydrophobicContact CE1-CG 4.46Å; F40-L127 HydrophobicContact CG-CD2 4.41Å; F40-L127 HydrophobicContact CZ-CD1 3.87Å
41I98.6Very high97.6Very high0 Ų028.5 Ų28.50%015%0.151CC..Iπ-helixtrans-61.1-46177.8-71.9170.7000110.8A3 V6 L10 A37 H38 A39 F45 M46 L86 L89 L90A3-I41 HydrophobicContact CB-CG2 4.24Å; A3-I41 WeakPolarHBondContact O-CG2 3.44Å; V6-I41 HydrophobicContact CG1-CD1 3.84Å; L10-I41 HydrophobicContact CD1-CD1 3.85Å; A37-I41 VanDerWaalsContact O-CB 3.28Å; A37-I41 WeakPolarHBondContact O-CB 3.21Å; A37-I41 WeakPolarHBondContact O-CG1 3.01Å; A37-I41 PolarHBondContact O-N 3.42Å; H38-I41 PolarHBondContact O-N 3.17Å; A39-I41 PolarHBondContact O-N 3.18Å; I41-F45 CarbonylContact O-C 3.29Å; I41-F45 VanDerWaalsContact O-C 3.29Å; I41-F45 VanDerWaalsContact O-CA 3.32Å; I41-F45 WeakPolarHBondContact O-CA 3.44Å; I41-F45 WeakPolarHBondContact O-CB 3.13Å; I41-F45 PolarHBondContact O-N 3.37Å; I41-M46 PolarHBondContact O-N 3.23Å; I41-L86 HydrophobicContact CG1-CD1 4.21Å; I41-L89 HydrophobicContact CG1-CD2 3.69Å; I41-L90 HydrophobicContact CD1-CD2 4.1Å
42M98.4Very high97.4Very high43 Ų4326.8 Ų26.821%0.21215%0.145CC..Iπ-helixtrans-67.5-42.4-177-66.6-57.9-69.600112.1H38 A39 F40 M46 V47H38-M42 WeakPolarHBondContact CE1-CG 3.33Å; H38-M42 WeakPolarHBondContact O-CB 3.32Å; H38-M42 VanDerWaalsContact O-CG 3.23Å; H38-M42 WeakPolarHBondContact O-CG 3.38Å; H38-M42 PolarHBondContact O-N 3.27Å; A39-M42 PolarHBondContact O-N 2.93Å; F40-M42 PolarHBondContact O-N 3.46Å; M42-M46 HydrophobicContact CE-CE 4.01Å; M42-M46 HydrophobicContact CE-SD 3.27Å; M42-M46 WeakPolarHBondContact CE-SD 3.48Å; M42-M46 WeakPolarHBondContact O-CB 3.23Å; M42-M46 HydrophobicContact SD-SD 3.65Å; M42-M46 VanDerWaalsContact SD-SD 3.65Å; M42-V47 WeakPolarHBondContact O-CG2 3.26Å; M42-V47 PolarHBondContact O-N 3.18Å
43I96.9Very high97.1Very high30 Ų3025.3 Ų25.315%0.15415%0.146CC..Iπ-helixtrans-75-62-178.5-64.7168.3000110.5A39 M48 W103 L223A39-I43 WeakPolarHBondContact O-CG1 3.38Å; A39-I43 PolarHBondContact O-N 3.31Å; I43-M48 HydrophobicContact CG2-CE 4.26Å; I43-M48 PolarHBondContact O-N 2.86Å; I43-M48 VanDerWaalsContact O-N 3.16Å; I43-W103 HydrophobicContact CD1-CD2 4.46Å; I43-W103 HydrophobicContact CD1-CE3 3.95Å; I43-W103 HydrophobicContact CD1-CZ3 4.08Å; I43-L223 HydrophobicContact CG1-CD1 4.43Å; I43-L223 HydrophobicContact CG2-CD1 4.27Å; I43-L223 HydrophobicContact CG2-CD2 4.36Å
44F97.6Very high97Very high8 Ų826.4 Ų26.44%0.03516%0.159CC..Iπ-helixtrans-85.6-23.4-167.4-63.3-87000114F40 M48 P49 L127 F215F40-F44 AromaticContact CD1-CD2 3.85Å; F40-F44 HydrophobicContact CD1-CD2 3.85Å; F40-F44 AromaticContact CD1-CE2 3.75Å; F40-F44 HydrophobicContact CD1-CE2 3.75Å; F40-F44 HydrophobicContact CE1-CE2 4.2Å; F40-F44 WeakPolarHBondContact O-CB 3.14Å; F40-F44 PolarHBondContact O-N 2.65Å; F44-M48 HydrophobicContact CB-CE 4.1Å; F44-M48 HydrophobicContact CD1-CE 3.05Å; F44-M48 HydrophobicContact CE1-CE 3.5Å; F44-M48 HydrophobicContact CG-CE 3.74Å; F44-P49 VanDerWaalsContact O-CD 3.26Å; F44-P49 WeakPolarHBondContact O-CD 3.26Å; F44-P49 VanDerWaalsContact O-CG 3.3Å; F44-P49 WeakPolarHBondContact O-CG 3.5Å; F44-L127 HydrophobicContact CD1-CD2 4.38Å; F44-L127 HydrophobicContact CD2-CD2 3.87Å; F44-L127 HydrophobicContact CE1-CD2 4.43Å; F44-L127 HydrophobicContact CE2-CD2 3.9Å; F44-L127 HydrophobicContact CG-CD2 4.15Å; F44-L127 HydrophobicContact CZ-CD2 4.2Å; F44-F215 HydrophobicContact CE1-CZ 4.06Å; F44-F215 HydrophobicContact CZ-CE1 4.24Å; F44-F215 AromaticContact CZ-CZ 3.93Å; F44-F215 HydrophobicContact CZ-CZ 3.93Å
45F98.1Very high96.9Very high14 Ų1429 Ų296%0.06117%0.17CC..Iπ-helixtrans-117.7-7.3-173.4-60.6-80.9000114.5A3 I41 A85 L86 L89 S126 A130A3-F45 HydrophobicContact CB-CB 3.87Å; A3-F45 WeakPolarHBondContact CB-O 3.5Å; I41-F45 CarbonylContact O-C 3.29Å; I41-F45 VanDerWaalsContact O-C 3.29Å; I41-F45 VanDerWaalsContact O-CA 3.32Å; I41-F45 WeakPolarHBondContact O-CA 3.44Å; I41-F45 WeakPolarHBondContact O-CB 3.13Å; I41-F45 PolarHBondContact O-N 3.37Å; F45-A85 HydrophobicContact CE1-CB 3.67Å; F45-A85 HydrophobicContact CZ-CB 3.81Å; F45-L86 HydrophobicContact CB-CD1 4.19Å; F45-L86 HydrophobicContact CD1-CB 3.7Å; F45-L86 HydrophobicContact CD1-CD1 4.04Å; F45-L86 HydrophobicContact CD1-CD2 4.47Å; F45-L86 HydrophobicContact CD1-CG 4.28Å; F45-L86 HydrophobicContact CD2-CD1 4.18Å; F45-L86 HydrophobicContact CE1-CB 3.71Å; F45-L86 HydrophobicContact CE1-CD1 4.49Å; F45-L86 VanDerWaalsContact CE1-N 3.31Å; F45-L86 HydrophobicContact CG-CB 4.4Å; F45-L86 HydrophobicContact CG-CD1 3.86Å; F45-L86 HydrophobicContact CZ-CB 4.42Å; F45-L89 HydrophobicContact CD2-CD2 3.91Å; F45-L89 HydrophobicContact CE2-CD2 3.66Å; F45-S126 WeakPolarHBondContact CZ-OG 3.42Å; F45-A130 HydrophobicContact CZ-CB 4.18Å
46M96.7Very high96.9Very high56 Ų5626.8 Ų26.828%0.27616%0.157SC..Iπ-helixtrans-117.1-69.2173175.8179162.800111.9G4 I41 M42 I50G4-M46 VanDerWaalsContact CA-SD 3.57Å; I41-M46 PolarHBondContact O-N 3.23Å; M42-M46 HydrophobicContact CE-CE 4.01Å; M42-M46 HydrophobicContact CE-SD 3.27Å; M42-M46 WeakPolarHBondContact CE-SD 3.48Å; M42-M46 WeakPolarHBondContact O-CB 3.23Å; M42-M46 HydrophobicContact SD-SD 3.65Å; M42-M46 VanDerWaalsContact SD-SD 3.65Å; M46-I50 HydrophobicContact CG-CD1 3.83Å; M46-I50 WeakPolarHBondContact O-CB 3.48Å; M46-I50 WeakPolarHBondContact O-CD1 3.4Å; M46-I50 WeakPolarHBondContact O-CG1 3.13Å; M46-I50 PolarHBondContact O-N 3.49Å
47V96.6Very high96.9Very high42 Ų4228.3 Ų28.326%0.25517%0.165SC..Iπ-helixtrans-65.7-53.7-169.8177.40000110.8M42 I50 M51 L223M42-V47 WeakPolarHBondContact O-CG2 3.26Å; M42-V47 PolarHBondContact O-N 3.18Å; V47-I50 PolarHBondContact O-N 3.15Å; V47-M51 HydrophobicContact CG1-CG 3.96Å; V47-M51 WeakPolarHBondContact O-CB 3.4Å; V47-M51 VanDerWaalsContact O-CG 3.22Å; V47-M51 WeakPolarHBondContact O-CG 3.43Å; V47-M51 PolarHBondContact O-N 3.37Å; V47-L223 HydrophobicContact CB-CD2 4.1Å; V47-L223 HydrophobicContact CG1-CB 4.21Å; V47-L223 HydrophobicContact CG1-CD2 3.68Å; V47-L223 HydrophobicContact CG1-CG 4.42Å
48M95.4Very high96.8Very high8 Ų836.5 Ų36.54%0.03919%0.194CC..Hα-helixtrans-58.1-51.1179.6-87.3-160.2-81.100113.3I43 F44 I50 M51 I52 G53 L172 E219 I222 L223I43-M48 HydrophobicContact CG2-CE 4.26Å; I43-M48 PolarHBondContact O-N 2.86Å; I43-M48 VanDerWaalsContact O-N 3.16Å; F44-M48 HydrophobicContact CB-CE 4.1Å; F44-M48 HydrophobicContact CD1-CE 3.05Å; F44-M48 HydrophobicContact CE1-CE 3.5Å; F44-M48 HydrophobicContact CG-CE 3.74Å; M48-I50 VanDerWaalsContact C-N 3.3Å; M48-I50 PolarHBondContact O-N 2.96Å; M48-M51 PolarHBondContact O-N 3.45Å; M48-I52 PolarHBondContact O-N 3.28Å; M48-G53 PolarHBondContact O-N 3.12Å; M48-L172 HydrophobicContact SD-CD2 4.18Å; M48-E219 WeakPolarHBondContact CE-OE1 3.38Å; M48-I222 HydrophobicContact SD-CG2 4.47Å; M48-L223 HydrophobicContact CG-CD2 3.79Å
49P95.6Very high96.8Very high32 Ų3236.6 Ų36.621%0.20820%0.196CC..Iπ-helixtrans-64-30.6178.9-27.437.6000114.2F44 G53 G54 L82F44-P49 VanDerWaalsContact O-CD 3.26Å; F44-P49 WeakPolarHBondContact O-CD 3.26Å; F44-P49 VanDerWaalsContact O-CG 3.3Å; F44-P49 WeakPolarHBondContact O-CG 3.5Å; P49-G53 CarbonylContact O-C 3.23Å; P49-G53 VanDerWaalsContact O-C 3.23Å; P49-G53 WeakPolarHBondContact O-CA 3.46Å; P49-G53 PolarHBondContact O-N 3.43Å; P49-G54 PolarHBondContact O-N 2.94Å; P49-L82 HydrophobicContact CB-CD1 4.03Å; P49-L82 HydrophobicContact CG-CD1 3.93Å
50I96.3Very high96.8Very high64 Ų6435.7 Ų35.733%0.32819%0.189SC..Iπ-helixtrans-74.3-51.7176.9-70.7169.9000110.6M46 V47 M48 G54 F55M46-I50 HydrophobicContact CG-CD1 3.83Å; M46-I50 WeakPolarHBondContact O-CB 3.48Å; M46-I50 WeakPolarHBondContact O-CD1 3.4Å; M46-I50 WeakPolarHBondContact O-CG1 3.13Å; M46-I50 PolarHBondContact O-N 3.49Å; V47-I50 PolarHBondContact O-N 3.15Å; M48-I50 VanDerWaalsContact C-N 3.3Å; M48-I50 PolarHBondContact O-N 2.96Å; I50-G54 WeakPolarHBondContact O-CA 3.37Å; I50-G54 PolarHBondContact O-N 3.06Å; I50-F55 HydrophobicContact CG2-CD2 4.09Å; I50-F55 HydrophobicContact CG2-CE2 3.92Å; I50-F55 WeakPolarHBondContact O-CD2 3.25Å; I50-F55 PolarHBondContact O-N 2.87Å
51M95Very high96.8Very high29 Ų2936 Ų3614%0.14319%0.191CC..Iπ-helixtrans-72.8-48.8-170.8-61.4-62.9-7300111.8V47 M48 F55 G56 P226 M230V47-M51 HydrophobicContact CG1-CG 3.96Å; V47-M51 WeakPolarHBondContact O-CB 3.4Å; V47-M51 VanDerWaalsContact O-CG 3.22Å; V47-M51 WeakPolarHBondContact O-CG 3.43Å; V47-M51 PolarHBondContact O-N 3.37Å; M48-M51 PolarHBondContact O-N 3.45Å; M51-F55 HydrophobicContact SD-CD2 4.48Å; M51-G56 PolarHBondContact O-N 3.38Å; M51-G56 VanDerWaalsContact O-N 3.12Å; M51-P226 HydrophobicContact CB-CB 4.2Å; M51-P226 HydrophobicContact CB-CG 4.47Å; M51-P226 HydrophobicContact CE-CB 3.76Å; M51-M230 HydrophobicContact CE-CE 3.12Å; M51-M230 HydrophobicContact SD-CE 3.5Å; M51-M230 WeakPolarHBondContact SD-CE 3.31Å
52I93.9Very high96.7Very high18 Ų1841.4 Ų41.49%0.09222%0.219CC..Iπ-helixtrans-94.4-48.8-177.5-63-59.3000110.7M48 G56 N57 F141 V165 T168 P226M48-I52 PolarHBondContact O-N 3.28Å; I52-G56 VanDerWaalsContact O-CA 3.26Å; I52-G56 WeakPolarHBondContact O-CA 3.24Å; I52-G56 PolarHBondContact O-N 3.24Å; I52-N57 PolarHBondContact O-N 3.07Å; I52-F141 HydrophobicContact CG2-CD2 4.13Å; I52-F141 HydrophobicContact CG2-CE2 3.49Å; I52-F141 VanDerWaalsContact CG2-CE2 3.49Å; I52-F141 HydrophobicContact CG2-CZ 4.28Å; I52-F141 WeakPolarHBondContact O-CZ 3.42Å; I52-V165 HydrophobicContact CD1-CG1 4.48Å; I52-V165 HydrophobicContact CD1-CG2 4.44Å; I52-T168 HydrophobicContact CD1-CG2 3.6Å; I52-T168 HydrophobicContact CG1-CG2 4.01Å; I52-P226 HydrophobicContact CD1-CB 4.41Å; I52-P226 HydrophobicContact CD1-CG 3.54Å; I52-P226 HydrophobicContact CG1-CG 4.34Å
53G91.6Very high96.7Very high34 Ų3442.1 Ų42.135%0.35122%0.223SC..Iπ-helixtrans-68-39.4-178.300000114M48 P49 N57M48-G53 PolarHBondContact O-N 3.12Å; P49-G53 CarbonylContact O-C 3.23Å; P49-G53 VanDerWaalsContact O-C 3.23Å; P49-G53 WeakPolarHBondContact O-CA 3.46Å; P49-G53 PolarHBondContact O-N 3.43Å; G53-N57 VanDerWaalsContact O-CB 3.31Å; G53-N57 WeakPolarHBondContact O-CB 3.31Å; G53-N57 PolarHBondContact O-ND2 2.92Å
54G95.6Very high96.7Very high36 Ų3640.7 Ų40.737%0.37122%0.215SC..Iπ-helixtrans-90.9-74.2-177.500000111.9P49 I50 G56 W58P49-G54 PolarHBondContact O-N 2.94Å; I50-G54 WeakPolarHBondContact O-CA 3.37Å; I50-G54 PolarHBondContact O-N 3.06Å; G54-G56 PolarHBondContact O-N 3.34Å; G54-W58 WeakPolarHBondContact O-CB 3.14Å; G54-W58 PolarHBondContact O-N 3.19Å
55F97.8Very high96.7Very high76 Ų7642.8 Ų42.833%0.33324%0.239SC..Iπ-helixtrans-62.2-42.9-177.9-72.7-64.2000112.4I50 M51 W58 L59 F161 M230I50-F55 HydrophobicContact CG2-CD2 4.09Å; I50-F55 HydrophobicContact CG2-CE2 3.92Å; I50-F55 WeakPolarHBondContact O-CD2 3.25Å; I50-F55 PolarHBondContact O-N 2.87Å; M51-F55 HydrophobicContact SD-CD2 4.48Å; F55-W58 PolarHBondContact O-N 3.5Å; F55-L59 HydrophobicContact CB-CD1 4.3Å; F55-L59 HydrophobicContact CD1-CD1 3.89Å; F55-L59 VanDerWaalsContact O-CB 3.26Å; F55-L59 WeakPolarHBondContact O-CB 3.26Å; F55-L59 WeakPolarHBondContact O-CG 3.22Å; F55-L59 PolarHBondContact O-N 2.92Å; F55-F161 HydrophobicContact CB-CE2 4.49Å; F55-F161 HydrophobicContact CB-CZ 3.85Å; F55-M230 HydrophobicContact CB-SD 4.49Å; F55-M230 HydrophobicContact CD1-SD 4.25Å; F55-M230 HydrophobicContact CD2-CE 4.08Å; F55-M230 HydrophobicContact CD2-SD 3.88Å; F55-M230 HydrophobicContact CE1-SD 4.44Å; F55-M230 HydrophobicContact CE2-CE 4.21Å; F55-M230 HydrophobicContact CE2-SD 4.07Å; F55-M230 HydrophobicContact CG-SD 3.97Å; F55-M230 HydrophobicContact CZ-SD 4.35Å
56G97.9Very high96.7Very high0 Ų042.6 Ų42.60%024%0.24CC..Iπ-helixtrans-56.5-58.2177.100000112.1M51 I52 G54 W58 V60M51-G56 PolarHBondContact O-N 3.38Å; M51-G56 VanDerWaalsContact O-N 3.12Å; I52-G56 VanDerWaalsContact O-CA 3.26Å; I52-G56 WeakPolarHBondContact O-CA 3.24Å; I52-G56 PolarHBondContact O-N 3.24Å; G54-G56 PolarHBondContact O-N 3.34Å; G56-W58 VanDerWaalsContact C-N 3.25Å; G56-W58 PolarHBondContact O-N 3.38Å; G56-V60 WeakPolarHBondContact O-CB 3.4Å; G56-V60 VanDerWaalsContact O-CG2 3.24Å; G56-V60 WeakPolarHBondContact O-CG2 3.46Å; G56-V60 PolarHBondContact O-N 3.08Å
57N97.8Very high96.6Very high35 Ų3546 Ų4619%0.18727%0.266CS..Hα-helixtrans-63.8-30.4-177.4-78.6-55.2000113.7I52 G53 P61 N75 F141I52-N57 PolarHBondContact O-N 3.07Å; G53-N57 VanDerWaalsContact O-CB 3.31Å; G53-N57 WeakPolarHBondContact O-CB 3.31Å; G53-N57 PolarHBondContact O-ND2 2.92Å; N57-P61 WeakPolarHBondContact O-CD 3.25Å; N57-N75 VanDerWaalsContact OD1-CG 3.24Å; N57-N75 PolarHBondContact OD1-ND2 3.15Å; N57-N75 PolarHBondContact OD1-OD1 3.39Å; N57-F141 HydrophobicContact CB-CZ 4.44Å; N57-F141 WeakPolarHBondContact OD1-CZ 3.48Å
58W97.8Very high96.6Very high178 Ų17847.7 Ų47.767%0.67427%0.274SS*.Hα-helixtrans-80.8-51.1179.2-174.314.1000112.3G54 F55 G56 L62G54-W58 WeakPolarHBondContact O-CB 3.14Å; G54-W58 PolarHBondContact O-N 3.19Å; F55-W58 PolarHBondContact O-N 3.5Å; G56-W58 VanDerWaalsContact C-N 3.25Å; G56-W58 PolarHBondContact O-N 3.38Å; W58-L62 WeakPolarHBondContact O-CD1 3.04Å; W58-L62 WeakPolarHBondContact O-CG 3.36Å
59L98.4Very high96.8Very high44 Ų4447.5 Ų47.523%0.2327%0.273CS..Hα-helixtrans-85.8-30.9-169-60.9176.9000113.1F55 L62 M63 F161F55-L59 HydrophobicContact CB-CD1 4.3Å; F55-L59 HydrophobicContact CD1-CD1 3.89Å; F55-L59 VanDerWaalsContact O-CB 3.26Å; F55-L59 WeakPolarHBondContact O-CB 3.26Å; F55-L59 WeakPolarHBondContact O-CG 3.22Å; F55-L59 PolarHBondContact O-N 2.92Å; L59-L62 PolarHBondContact O-N 3.04Å; L59-M63 HydrophobicContact CB-CE 4.26Å; L59-M63 HydrophobicContact CB-SD 4.46Å; L59-M63 HydrophobicContact CD1-CE 4.41Å; L59-M63 VanDerWaalsContact O-CB 3.25Å; L59-M63 WeakPolarHBondContact O-CB 3.47Å; L59-M63 VanDerWaalsContact O-CG 3.25Å; L59-M63 WeakPolarHBondContact O-CG 3.37Å; L59-M63 PolarHBondContact O-N 2.91Å; L59-F161 HydrophobicContact CB-CD1 4.16Å; L59-F161 HydrophobicContact CB-CE1 3.77Å; L59-F161 HydrophobicContact CD1-CD1 4.46Å; L59-F161 HydrophobicContact CD1-CE1 4.1Å; L59-F161 HydrophobicContact CD1-CZ 4.4Å
60V98.4Very high96.9Very high0 Ų047.4 Ų47.40%028%0.275CS..Hα-helixtrans-61.8-51-176170.60000112.3G56 L62 M63 L64 F141 V145 F161 V162 V165G56-V60 WeakPolarHBondContact O-CB 3.4Å; G56-V60 VanDerWaalsContact O-CG2 3.24Å; G56-V60 WeakPolarHBondContact O-CG2 3.46Å; G56-V60 PolarHBondContact O-N 3.08Å; V60-L62 VanDerWaalsContact C-N 3.33Å; V60-L62 PolarHBondContact O-N 2.9Å; V60-M63 PolarHBondContact O-N 3.29Å; V60-L64 HydrophobicContact CG1-CD1 3.88Å; V60-L64 HydrophobicContact CG1-CG 4.49Å; V60-L64 WeakPolarHBondContact O-CB 3.49Å; V60-L64 VanDerWaalsContact O-CG 3.32Å; V60-L64 WeakPolarHBondContact O-CG 3.4Å; V60-L64 PolarHBondContact O-N 2.96Å; V60-L64 VanDerWaalsContact O-N 3.09Å; V60-F141 HydrophobicContact CB-CD1 4.46Å; V60-F141 HydrophobicContact CB-CE1 4.32Å; V60-F141 HydrophobicContact CG1-CD1 4.43Å; V60-F141 HydrophobicContact CG2-CD1 4.32Å; V60-F141 HydrophobicContact CG2-CE1 4.19Å; V60-V145 HydrophobicContact CG1-CG2 3.86Å; V60-F161 HydrophobicContact CG2-CE1 4.18Å; V60-V162 HydrophobicContact CG1-CG1 4.41Å; V60-V165 HydrophobicContact CG2-CB 4.08Å; V60-V165 HydrophobicContact CG2-CG1 3.96Å; V60-V165 HydrophobicContact CG2-CG2 4.09Å
61P97.9Very high97Very high9 Ų948.1 Ų48.16%0.05828%0.276CS..Hα-helixtrans-58.8-44.6176.8-25.836.2000112.4N57 M63 L64 G65 A66 M69N57-P61 WeakPolarHBondContact O-CD 3.25Å; P61-M63 PolarHBondContact O-N 3.38Å; P61-L64 PolarHBondContact O-N 3.47Å; P61-G65 PolarHBondContact O-N 3.29Å; P61-A66 HydrophobicContact CB-CB 4.22Å; P61-A66 PolarHBondContact O-N 2.97Å; P61-M69 HydrophobicContact CG-CG 3.98Å; P61-M69 HydrophobicContact CG-SD 3.41Å; P61-M69 WeakPolarHBondContact CG-SD 3.42Å
62L97.9Very high97.1Very high113 Ų11349.6 Ų49.659%0.59229%0.287SS*.Hα-helixtrans-61.1-45.4-179.7-65.8177.7000111.9W58 L59 V60 L64 G65W58-L62 WeakPolarHBondContact O-CD1 3.04Å; W58-L62 WeakPolarHBondContact O-CG 3.36Å; L59-L62 PolarHBondContact O-N 3.04Å; V60-L62 VanDerWaalsContact C-N 3.33Å; V60-L62 PolarHBondContact O-N 2.9Å; L62-L64 VanDerWaalsContact C-N 3.25Å; L62-L64 PolarHBondContact O-N 3.23Å; L62-G65 PolarHBondContact O-N 3.02Å
63M97.5Very high97.3Very high59 Ų5959.5 Ų59.529%0.29132%0.324SS..Hα-helixtrans-68.9-22.6179.2-76.2-174.517900113.3L59 V60 P61 P159 F161 V162L59-M63 HydrophobicContact CB-CE 4.26Å; L59-M63 HydrophobicContact CB-SD 4.46Å; L59-M63 HydrophobicContact CD1-CE 4.41Å; L59-M63 VanDerWaalsContact O-CB 3.25Å; L59-M63 WeakPolarHBondContact O-CB 3.47Å; L59-M63 VanDerWaalsContact O-CG 3.25Å; L59-M63 WeakPolarHBondContact O-CG 3.37Å; L59-M63 PolarHBondContact O-N 2.91Å; V60-M63 PolarHBondContact O-N 3.29Å; P61-M63 PolarHBondContact O-N 3.38Å; M63-P159 HydrophobicContact CB-CG 4.16Å; M63-P159 HydrophobicContact SD-CB 4.06Å; M63-P159 HydrophobicContact SD-CG 4.48Å; M63-F161 HydrophobicContact CE-CB 4.43Å; M63-F161 HydrophobicContact CE-CD1 4.31Å; M63-F161 HydrophobicContact SD-CB 4.11Å; M63-F161 HydrophobicContact SD-CD1 3.87Å; M63-F161 HydrophobicContact SD-CG 4.43Å; M63-V162 HydrophobicContact CB-CG2 3.68Å; M63-V162 HydrophobicContact CG-CG2 4.5Å; M63-V162 HydrophobicContact SD-CG2 4.06Å
64L97.7Very high97.6Very high0 Ų060.6 Ų60.60%032%0.321CS..Hα-helixtrans-92.2-12175.9-68.6-179.6000113.5V60 P61 L62 A66 V145 R149 S150 M158 V162V60-L64 HydrophobicContact CG1-CD1 3.88Å; V60-L64 HydrophobicContact CG1-CG 4.49Å; V60-L64 WeakPolarHBondContact O-CB 3.49Å; V60-L64 VanDerWaalsContact O-CG 3.32Å; V60-L64 WeakPolarHBondContact O-CG 3.4Å; V60-L64 PolarHBondContact O-N 2.96Å; V60-L64 VanDerWaalsContact O-N 3.09Å; P61-L64 PolarHBondContact O-N 3.47Å; L62-L64 VanDerWaalsContact C-N 3.25Å; L62-L64 PolarHBondContact O-N 3.23Å; L64-A66 VanDerWaalsContact C-N 3.28Å; L64-A66 HydrophobicContact CB-CB 4.47Å; L64-V145 HydrophobicContact CD1-CB 4.39Å; L64-V145 HydrophobicContact CD1-CG2 4.09Å; L64-R149 HydrophobicContact CD1-CG 4.39Å; L64-R149 HydrophobicContact CD2-CG 3.84Å; L64-S150 WeakPolarHBondContact O-CB 3.15Å; L64-S150 PolarHBondContact O-N 3.47Å; L64-S150 PolarHBondContact O-OG 2.91Å; L64-M158 HydrophobicContact CD2-CG 4.4Å; L64-M158 HydrophobicContact CD2-SD 4.26Å; L64-V162 HydrophobicContact CD1-CG1 4.27Å; L64-V162 HydrophobicContact CD2-CG1 3.94Å; L64-V162 HydrophobicContact CD2-CG2 4.41Å; L64-V162 HydrophobicContact CG-CG1 4.22Å; L64-V162 HydrophobicContact CG-CG2 4.45Å
65G96.9Very high97.7Very high52 Ų5260.1 Ų60.154%0.53631%0.31SS..THydrogen-bonded Turntrans71.124.2-169.600000113.1P61 L62P61-G65 PolarHBondContact O-N 3.29Å; L62-G65 PolarHBondContact O-N 3.02Å
66A97.2Very high97.8Very high10 Ų1061 Ų618%0.08332%0.318CS..  trans-84.5142.2176.400000110.4P61 L64 D68 M148P61-A66 HydrophobicContact CB-CB 4.22Å; P61-A66 PolarHBondContact O-N 2.97Å; L64-A66 VanDerWaalsContact C-N 3.28Å; L64-A66 HydrophobicContact CB-CB 4.47Å; A66-D68 VanDerWaalsContact C-N 3.32Å; A66-D68 PolarHBondContact O-N 3.33Å; A66-M148 HydrophobicContact CB-CB 3.99Å; A66-M148 HydrophobicContact CB-CE 4.41Å
67P95.9Very high97.8Very high127 Ų12766 Ų6683%0.82534%0.342SS*.SBendtrans-69.4-29.3178.827.3-34.5000113.3M148P67-M148 HydrophobicContact CG-CE 4.48Å
68D96.9Very high97.8Very high77 Ų7764.7 Ų64.741%0.41234%0.336SS..SBendtrans-161.9180177.7-162-2.5000108.7A66 P72 M148A66-D68 VanDerWaalsContact C-N 3.32Å; A66-D68 PolarHBondContact O-N 3.33Å; D68-P72 HydrophobicContact CB-CG 4.45Å; D68-P72 WeakPolarHBondContact OD2-CB 3.36Å; D68-P72 WeakPolarHBondContact OD2-CG 3.1Å; D68-M148 WeakPolarHBondContact O-CE 3.33Å
69M98.1Very high97.8Very high4 Ų461.5 Ų61.52%0.0233%0.327CS..  trans-67.5157.4167.5-61.3-66.5-71.100111.9P61 F71 P72 N140 F141 T144P61-M69 HydrophobicContact CG-CG 3.98Å; P61-M69 HydrophobicContact CG-SD 3.41Å; P61-M69 WeakPolarHBondContact CG-SD 3.42Å; M69-F71 VanDerWaalsContact C-N 3.33Å; M69-F71 PolarHBondContact O-N 2.98Å; M69-P72 WeakPolarHBondContact O-CD 3.48Å; M69-P72 WeakPolarHBondContact O-CG 3.34Å; M69-N140 WeakPolarHBondContact CB-ND2 3.28Å; M69-N140 HydrophobicContact CE-CB 4.41Å; M69-F141 HydrophobicContact CE-CD1 3.44Å; M69-F141 VanDerWaalsContact CE-CD1 3.44Å; M69-F141 HydrophobicContact CE-CE1 3.52Å; M69-F141 HydrophobicContact CE-CG 4.04Å; M69-F141 HydrophobicContact CE-CZ 4.21Å; M69-F141 HydrophobicContact SD-CD1 4.47Å; M69-F141 HydrophobicContact SD-CE1 4.25Å; M69-T144 HydrophobicContact CE-CG2 4.48Å; M69-T144 HydrophobicContact SD-CG2 4Å
70A98.2Very high97.8Very high30 Ų3066.8 Ų66.825%0.24834%0.344CS..SBendtrans-62.4-36.4-178.700000113.6P72 N140 T143 T144 M148A70-P72 WeakPolarHBondContact O-CD 3.41Å; A70-N140 PolarHBondContact N-OD1 3.34Å; A70-T143 HydrophobicContact CB-CG2 3.69Å; A70-T144 WeakPolarHBondContact CB-OG1 3.25Å; A70-T144 PolarHBondContact N-OG1 3.31Å; A70-M148 WeakPolarHBondContact CA-SD 3.47Å; A70-M148 HydrophobicContact CB-SD 3.62Å; A70-M148 PolarHBondContact N-SD 3.36Å
71F98.4Very high97.8Very high80 Ų8068 Ų6835%0.35135%0.35SS..  trans-124.275.2179.5-52.7-56.1000111.6M69 R73 M74 N75 V139 N140 T143M69-F71 VanDerWaalsContact C-N 3.33Å; M69-F71 PolarHBondContact O-N 2.98Å; F71-R73 VanDerWaalsContact C-N 3.31Å; F71-R73 PolarHBondContact O-N 2.87Å; F71-M74 HydrophobicContact CB-CB 3.68Å; F71-M74 HydrophobicContact CB-CE 4.4Å; F71-M74 HydrophobicContact CB-SD 4.33Å; F71-M74 HydrophobicContact CD2-CE 4.15Å; F71-M74 HydrophobicContact CD2-SD 4.16Å; F71-M74 HydrophobicContact CG-CE 4.29Å; F71-M74 WeakPolarHBondContact O-CB 3.5Å; F71-M74 PolarHBondContact O-N 3.42Å; F71-M74 VanDerWaalsContact O-N 3.13Å; F71-N75 PolarHBondContact O-N 3.28Å; F71-V139 HydrophobicContact CE2-CG1 4.25Å; F71-N140 HydrophobicContact CD2-CB 4.31Å; F71-N140 PolarHBondContact N-OD1 2.93Å; F71-T143 HydrophobicContact CE2-CG2 3.71Å; F71-T143 WeakPolarHBondContact CE2-OG1 3.46Å; F71-T143 HydrophobicContact CZ-CG2 3.72Å
72P97.9Very high97.8Very high59 Ų5968.9 Ų68.938%0.38335%0.354SS..Hα-helixtrans-59.7-36.9-173-26.135.8000114D68 M69 A70 N75 N76D68-P72 HydrophobicContact CB-CG 4.45Å; D68-P72 WeakPolarHBondContact OD2-CB 3.36Å; D68-P72 WeakPolarHBondContact OD2-CG 3.1Å; M69-P72 WeakPolarHBondContact O-CD 3.48Å; M69-P72 WeakPolarHBondContact O-CG 3.34Å; A70-P72 WeakPolarHBondContact O-CD 3.41Å; P72-N75 VanDerWaalsContact O-CB 3.3Å; P72-N75 WeakPolarHBondContact O-CB 3.24Å; P72-N75 PolarHBondContact O-N 2.97Å; P72-N76 PolarHBondContact O-N 2.94Å
73R98.3Very high97.8Very high226 Ų22666 Ų6685%0.85334%0.342SS*.Hα-helixtrans-70.5-39.2178-64.7-177.2-175.5174.81.7112.6F71 N75 N76 M77F71-R73 VanDerWaalsContact C-N 3.31Å; F71-R73 PolarHBondContact O-N 2.87Å; R73-N75 VanDerWaalsContact C-N 3.26Å; R73-N76 PolarHBondContact O-N 3.07Å; R73-M77 PolarHBondContact O-N 3.04Å
74M97.7Very high97.9Very high58 Ų5865.8 Ų65.829%0.28635%0.346SS..Hα-helixtrans-64.4-37.5173.5-174.5-172.3-66.400110.3F71 M77 S78 L136F71-M74 HydrophobicContact CB-CB 3.68Å; F71-M74 HydrophobicContact CB-CE 4.4Å; F71-M74 HydrophobicContact CB-SD 4.33Å; F71-M74 HydrophobicContact CD2-CE 4.15Å; F71-M74 HydrophobicContact CD2-SD 4.16Å; F71-M74 HydrophobicContact CG-CE 4.29Å; F71-M74 WeakPolarHBondContact O-CB 3.5Å; F71-M74 PolarHBondContact O-N 3.42Å; F71-M74 VanDerWaalsContact O-N 3.13Å; M74-M77 WeakPolarHBondContact O-CB 3.33Å; M74-M77 PolarHBondContact O-N 3.43Å; M74-S78 PolarHBondContact O-N 3.46Å; M74-L136 HydrophobicContact CG-CB 3.92Å; M74-L136 HydrophobicContact CG-CD1 4.49Å; M74-L136 HydrophobicContact CG-CD2 3.88Å; M74-L136 HydrophobicContact CG-CG 4.3Å; M74-L136 HydrophobicContact SD-CB 4.28Å; M74-L136 HydrophobicContact SD-CD2 3.96Å
75N98Very high97.9Very high26 Ų2665.8 Ų65.814%0.13935%0.346CS..Hα-helixtrans-63.2-41.9174.3-150.140.5000112.9N57 F71 P72 R73 M77 S78 F79 N140N57-N75 VanDerWaalsContact OD1-CG 3.24Å; N57-N75 PolarHBondContact OD1-ND2 3.15Å; N57-N75 PolarHBondContact OD1-OD1 3.39Å; F71-N75 PolarHBondContact O-N 3.28Å; P72-N75 VanDerWaalsContact O-CB 3.3Å; P72-N75 WeakPolarHBondContact O-CB 3.24Å; P72-N75 PolarHBondContact O-N 2.97Å; R73-N75 VanDerWaalsContact C-N 3.26Å; N75-M77 VanDerWaalsContact C-N 3.33Å; N75-S78 PolarHBondContact O-N 2.94Å; N75-S78 PolarHBondContact O-OG 3.5Å; N75-F79 PolarHBondContact O-N 3.38Å; N75-N140 VanDerWaalsContact CB-ND2 3.33Å; N75-N140 WeakPolarHBondContact CB-ND2 3.15Å; N75-N140 VanDerWaalsContact CG-ND2 3.3Å; N75-N140 PolarHBondContact OD1-ND2 3.23Å; N75-N140 VanDerWaalsContact OD1-ND2 3.15Å
76N98.1Very high98Very high94 Ų9464.2 Ų64.250%0.50333%0.325SS..Hα-helixtrans-64.6-42174.2-174.351.1000110.7P72 R73 S78 F79 W80P72-N76 PolarHBondContact O-N 2.94Å; R73-N76 PolarHBondContact O-N 3.07Å; N76-S78 PolarHBondContact O-N 3.02Å; N76-F79 PolarHBondContact O-N 2.92Å; N76-W80 PolarHBondContact O-N 3.47Å; N76-W80 VanDerWaalsContact O-N 3.08Å; N76-W80 VanDerWaalsContact OD1-CD1 3.29Å; N76-W80 PolarHBondContact OD1-NE1 3.2Å; N76-W80 VanDerWaalsContact OD1-NE1 3.09Å
77M97.8Very high98Very high104 Ų10467 Ų6751%0.51234%0.344SS..Hα-helixtrans-61.7-41.8176.2-177173.517700112.4R73 M74 N75 F79 W80 L81 L136R73-M77 PolarHBondContact O-N 3.04Å; M74-M77 WeakPolarHBondContact O-CB 3.33Å; M74-M77 PolarHBondContact O-N 3.43Å; N75-M77 VanDerWaalsContact C-N 3.33Å; M77-F79 VanDerWaalsContact C-N 3.29Å; M77-F79 PolarHBondContact O-N 3.48Å; M77-W80 PolarHBondContact O-N 3.12Å; M77-W80 VanDerWaalsContact O-N 3.15Å; M77-L81 HydrophobicContact CE-CD1 4.4Å; M77-L81 HydrophobicContact CG-CD1 4.39Å; M77-L81 WeakPolarHBondContact O-CG 3.25Å; M77-L81 PolarHBondContact O-N 3.48Å; M77-L81 VanDerWaalsContact O-N 3.13Å; M77-L136 HydrophobicContact CE-CD1 4.49Å; M77-L136 HydrophobicContact CG-CD1 4.18Å; M77-L136 HydrophobicContact SD-CD1 4.24Å
78S97.8Very high98.2Very high9 Ų963.3 Ų63.36%0.06332%0.317CS..Hα-helixtrans-57.9-44.2177.469.40000111.1M74 N75 N76 L81 S133M74-S78 PolarHBondContact O-N 3.46Å; N75-S78 PolarHBondContact O-N 2.94Å; N75-S78 PolarHBondContact O-OG 3.5Å; N76-S78 PolarHBondContact O-N 3.02Å; S78-L81 PolarHBondContact O-N 3.45Å; S78-S133 VanDerWaalsContact C-OG 3.3Å; S78-S133 VanDerWaalsContact CB-O 3.26Å; S78-S133 WeakPolarHBondContact CB-O 3.49Å; S78-S133 VanDerWaalsContact O-CB 3.27Å; S78-S133 WeakPolarHBondContact O-CB 3.38Å; S78-S133 PolarHBondContact O-OG 3.18Å
79F98.1Very high98.3Very high111 Ų11159.9 Ų59.949%0.48730%0.298SS..Hα-helixtrans-59.5-49.1173.8170.8-99.4000112.4N75 N76 M77 L81 L82 P83N75-F79 PolarHBondContact O-N 3.38Å; N76-F79 PolarHBondContact O-N 2.92Å; M77-F79 VanDerWaalsContact C-N 3.29Å; M77-F79 PolarHBondContact O-N 3.48Å; F79-L81 PolarHBondContact O-N 3.24Å; F79-L81 VanDerWaalsContact O-N 3.16Å; F79-L82 WeakPolarHBondContact O-CB 3.25Å; F79-L82 PolarHBondContact O-N 3.45Å; F79-P83 WeakPolarHBondContact O-CD 3.32Å
80W98.4Very high98.3Very high154 Ų15461.6 Ų61.658%0.58331%0.307SS*.Hα-helixtrans-68.9-13.3-174.4-78.4111.1000115N76 M77 P83 P84N76-W80 PolarHBondContact O-N 3.47Å; N76-W80 VanDerWaalsContact O-N 3.08Å; N76-W80 VanDerWaalsContact OD1-CD1 3.29Å; N76-W80 PolarHBondContact OD1-NE1 3.2Å; N76-W80 VanDerWaalsContact OD1-NE1 3.09Å; M77-W80 PolarHBondContact O-N 3.12Å; M77-W80 VanDerWaalsContact O-N 3.15Å; W80-P83 HydrophobicContact CE3-CG 4.43Å; W80-P84 WeakPolarHBondContact O-CD 3.48Å
81L98.5Very high98.3Very high26 Ų2663 Ų6314%0.13631%0.313CS..Hα-helixtrans-77.3-21.9170.5-70.1170.1000113.1M77 S78 F79 P84 A85 L129 I132 L136M77-L81 HydrophobicContact CE-CD1 4.4Å; M77-L81 HydrophobicContact CG-CD1 4.39Å; M77-L81 WeakPolarHBondContact O-CG 3.25Å; M77-L81 PolarHBondContact O-N 3.48Å; M77-L81 VanDerWaalsContact O-N 3.13Å; S78-L81 PolarHBondContact O-N 3.45Å; F79-L81 PolarHBondContact O-N 3.24Å; F79-L81 VanDerWaalsContact O-N 3.16Å; L81-P84 WeakPolarHBondContact O-CD 3.26Å; L81-P84 WeakPolarHBondContact O-CG 3.46Å; L81-A85 VanDerWaalsContact O-CB 3.25Å; L81-A85 WeakPolarHBondContact O-CB 3.44Å; L81-A85 PolarHBondContact O-N 2.89Å; L81-L129 HydrophobicContact CD2-CD2 4.25Å; L81-I132 HydrophobicContact CD1-CB 4.15Å; L81-I132 HydrophobicContact CD1-CG2 3.58Å; L81-L136 HydrophobicContact CD1-CD1 4.01Å
82L98.3Very high98.3Very high27 Ų2759.3 Ų59.314%0.14130%0.297CS..Hα-helixtrans-71.2-42.6-177.9-62.5174.4000113.9P49 F79 A85 L86P49-L82 HydrophobicContact CB-CD1 4.03Å; P49-L82 HydrophobicContact CG-CD1 3.93Å; F79-L82 WeakPolarHBondContact O-CB 3.25Å; F79-L82 PolarHBondContact O-N 3.45Å; L82-A85 WeakPolarHBondContact O-CB 3.43Å; L82-A85 PolarHBondContact O-N 3.09Å; L82-L86 WeakPolarHBondContact O-CB 3.31Å; L82-L86 PolarHBondContact O-N 3.28Å
83P98.4Very high98.2Very high52 Ų5258.4 Ų58.434%0.33829%0.292SS..Hα-helixtrans-57.1-52.1175.2-24.533000114.5F79 W80 A85 L86 S87F79-P83 WeakPolarHBondContact O-CD 3.32Å; W80-P83 HydrophobicContact CE3-CG 4.43Å; P83-A85 VanDerWaalsContact C-N 3.31Å; P83-A85 PolarHBondContact O-N 3.47Å; P83-L86 PolarHBondContact O-N 3.35Å; P83-S87 PolarHBondContact O-N 3.49Å; P83-S87 PolarHBondContact O-OG 2.97Å
84P98.6Very high98.1Very high56 Ų5654.2 Ų54.236%0.36428%0.284SS..Hα-helixtrans-65.4-34.7177.525.1-32.7000112.1W80 L81 L86 S87 L88 L129W80-P84 WeakPolarHBondContact O-CD 3.48Å; L81-P84 WeakPolarHBondContact O-CD 3.26Å; L81-P84 WeakPolarHBondContact O-CG 3.46Å; P84-L86 PolarHBondContact O-N 3.37Å; P84-S87 PolarHBondContact O-N 3.29Å; P84-L88 WeakPolarHBondContact O-CG 3.47Å; P84-L88 PolarHBondContact O-N 2.85Å; P84-L129 HydrophobicContact CB-CD1 4.2Å; P84-L129 HydrophobicContact CG-CD1 4.33Å
85A98.6Very high98Very high0 Ų053.6 Ų53.60%028%0.283CS..Hα-helixtrans-58.7-47172.800000111.6F45 L81 L82 P83 L88 L89 S126 L129 A130F45-A85 HydrophobicContact CE1-CB 3.67Å; F45-A85 HydrophobicContact CZ-CB 3.81Å; L81-A85 VanDerWaalsContact O-CB 3.25Å; L81-A85 WeakPolarHBondContact O-CB 3.44Å; L81-A85 PolarHBondContact O-N 2.89Å; L82-A85 WeakPolarHBondContact O-CB 3.43Å; L82-A85 PolarHBondContact O-N 3.09Å; P83-A85 VanDerWaalsContact C-N 3.31Å; P83-A85 PolarHBondContact O-N 3.47Å; A85-L88 PolarHBondContact O-N 2.97Å; A85-L89 PolarHBondContact O-N 3.49Å; A85-L89 VanDerWaalsContact O-N 3.1Å; A85-S126 VanDerWaalsContact O-CB 3.26Å; A85-S126 WeakPolarHBondContact O-CB 3.26Å; A85-S126 PolarHBondContact O-OG 3.27Å; A85-L129 HydrophobicContact CB-CB 3.63Å; A85-L129 HydrophobicContact CB-CD1 4.45Å; A85-A130 HydrophobicContact CB-CB 4.36Å
86L98.6Very high97.9Very high19 Ų1957.9 Ų57.910%0.09930%0.302CS..Hα-helixtrans-65.3-41.1177.9-177.453.9000111.6W2 A3 I41 F45 L82 P83 P84 L88 L89 L90W2-L86 HydrophobicContact CE3-CD2 3.75Å; W2-L86 HydrophobicContact CZ3-CD2 3.5Å; W2-L86 HydrophobicContact CZ3-CG 4.13Å; A3-L86 HydrophobicContact CB-CD2 3.77Å; I41-L86 HydrophobicContact CG1-CD1 4.21Å; F45-L86 HydrophobicContact CB-CD1 4.19Å; F45-L86 HydrophobicContact CD1-CB 3.7Å; F45-L86 HydrophobicContact CD1-CD1 4.04Å; F45-L86 HydrophobicContact CD1-CD2 4.47Å; F45-L86 HydrophobicContact CD1-CG 4.28Å; F45-L86 HydrophobicContact CD2-CD1 4.18Å; F45-L86 HydrophobicContact CE1-CB 3.71Å; F45-L86 HydrophobicContact CE1-CD1 4.49Å; F45-L86 VanDerWaalsContact CE1-N 3.31Å; F45-L86 HydrophobicContact CG-CB 4.4Å; F45-L86 HydrophobicContact CG-CD1 3.86Å; F45-L86 HydrophobicContact CZ-CB 4.42Å; L82-L86 WeakPolarHBondContact O-CB 3.31Å; L82-L86 PolarHBondContact O-N 3.28Å; P83-L86 PolarHBondContact O-N 3.35Å; P84-L86 PolarHBondContact O-N 3.37Å; L86-L88 VanDerWaalsContact C-N 3.34Å; L86-L88 PolarHBondContact O-N 2.98Å; L86-L89 PolarHBondContact O-N 3.27Å; L86-L90 HydrophobicContact CD1-CD1 4.42Å; L86-L90 HydrophobicContact CD1-CG 4.28Å; L86-L90 HydrophobicContact CG-CD1 4.26Å; L86-L90 WeakPolarHBondContact O-CG 3.36Å; L86-L90 PolarHBondContact O-N 2.84Å
87S98.4Very high97.7Very high69 Ų6959.4 Ų59.448%0.48331%0.311SS..Hα-helixtrans-58.7-44.6174.7-62.80000111.8P83 P84 L89 L90 V91P83-S87 PolarHBondContact O-N 3.49Å; P83-S87 PolarHBondContact O-OG 2.97Å; P84-S87 PolarHBondContact O-N 3.29Å; S87-L89 VanDerWaalsContact C-N 3.32Å; S87-L89 PolarHBondContact O-N 3.06Å; S87-L90 PolarHBondContact O-N 2.93Å; S87-V91 WeakPolarHBondContact O-CB 3.3Å; S87-V91 VanDerWaalsContact O-CG2 3.26Å; S87-V91 WeakPolarHBondContact O-CG2 3.49Å; S87-V91 PolarHBondContact O-N 3.22Å
88L98.8Very high97.7Very high48 Ų4854.5 Ų54.525%0.25129%0.287SS..Hα-helixtrans-60.3-40.5175.7-71.8171.7000112.2P84 A85 L86 V91 S92 L122 F125 L129P84-L88 WeakPolarHBondContact O-CG 3.47Å; P84-L88 PolarHBondContact O-N 2.85Å; A85-L88 PolarHBondContact O-N 2.97Å; L86-L88 VanDerWaalsContact C-N 3.34Å; L86-L88 PolarHBondContact O-N 2.98Å; L88-V91 PolarHBondContact O-N 3.11Å; L88-S92 VanDerWaalsContact O-CB 3.27Å; L88-S92 WeakPolarHBondContact O-CB 3.36Å; L88-S92 PolarHBondContact O-N 2.99Å; L88-L122 HydrophobicContact CD2-CD2 3.82Å; L88-F125 HydrophobicContact CD1-CB 3.9Å; L88-L129 HydrophobicContact CD1-CD1 3.67Å; L88-L129 HydrophobicContact CD1-CG 4.47Å
89L98.6Very high97.7Very high5 Ų554.4 Ų54.43%0.02629%0.286CS..Hα-helixtrans-65.2-42.5176.9-177.662.6000112.2F40 I41 F45 A85 L86 S87 S92 S93 S126F40-L89 HydrophobicContact CB-CD1 4.14Å; F40-L89 HydrophobicContact CB-CD2 3.63Å; F40-L89 HydrophobicContact CD2-CD1 3.82Å; F40-L89 HydrophobicContact CG-CD1 4.38Å; I41-L89 HydrophobicContact CG1-CD2 3.69Å; F45-L89 HydrophobicContact CD2-CD2 3.91Å; F45-L89 HydrophobicContact CE2-CD2 3.66Å; A85-L89 PolarHBondContact O-N 3.49Å; A85-L89 VanDerWaalsContact O-N 3.1Å; L86-L89 PolarHBondContact O-N 3.27Å; S87-L89 VanDerWaalsContact C-N 3.32Å; S87-L89 PolarHBondContact O-N 3.06Å; L89-S92 VanDerWaalsContact O-CB 3.32Å; L89-S92 WeakPolarHBondContact O-CB 3.49Å; L89-S92 PolarHBondContact O-N 3.41Å; L89-S93 PolarHBondContact O-N 3.08Å; L89-S126 WeakPolarHBondContact CB-OG 3.21Å
90L98.3Very high97.7Very high40 Ų4049.3 Ų49.321%0.20927%0.265CS..Hα-helixtrans-67.6-42.4178.2-65.1174.7000110.9W2 V6 I41 L86 S87 S92 S93 M94W2-L90 HydrophobicContact CH2-CD1 3.63Å; W2-L90 HydrophobicContact CZ3-CD1 3.95Å; V6-L90 HydrophobicContact CG1-CD2 4.33Å; I41-L90 HydrophobicContact CD1-CD2 4.1Å; L86-L90 HydrophobicContact CD1-CD1 4.42Å; L86-L90 HydrophobicContact CD1-CG 4.28Å; L86-L90 HydrophobicContact CG-CD1 4.26Å; L86-L90 WeakPolarHBondContact O-CG 3.36Å; L86-L90 PolarHBondContact O-N 2.84Å; S87-L90 PolarHBondContact O-N 2.93Å; L90-S92 VanDerWaalsContact C-N 3.32Å; L90-S92 PolarHBondContact O-N 3.09Å; L90-S93 PolarHBondContact O-N 3.4Å; L90-S93 VanDerWaalsContact O-N 3.13Å; L90-S93 PolarHBondContact O-OG 2.87Å; L90-M94 WeakPolarHBondContact O-CE 3.19Å; L90-M94 PolarHBondContact O-N 3Å
91V98.4Very high97.6Very high61 Ų6142.4 Ų42.437%0.3724%0.24SC..Hα-helixtrans-63.8-39.3174.91770000110.9S87 L88 S93 M94 V95 L122S87-V91 WeakPolarHBondContact O-CB 3.3Å; S87-V91 VanDerWaalsContact O-CG2 3.26Å; S87-V91 WeakPolarHBondContact O-CG2 3.49Å; S87-V91 PolarHBondContact O-N 3.22Å; L88-V91 PolarHBondContact O-N 3.11Å; V91-S93 PolarHBondContact O-N 3.36Å; V91-M94 HydrophobicContact CG2-CE 4.21Å; V91-M94 PolarHBondContact O-N 3.25Å; V91-V95 HydrophobicContact CG1-CG2 3.58Å; V91-V95 WeakPolarHBondContact O-CG2 3.28Å; V91-V95 PolarHBondContact O-N 2.68Å; V91-L122 HydrophobicContact CG1-CD1 3.85Å
92S98.5Very high97.6Very high2 Ų242.3 Ų42.31%0.01425%0.245CC..Hα-helixtrans-53-37.2172.6167.20000112.3L88 L89 L90 M94 G98 A99 S119L88-S92 VanDerWaalsContact O-CB 3.27Å; L88-S92 WeakPolarHBondContact O-CB 3.36Å; L88-S92 PolarHBondContact O-N 2.99Å; L89-S92 VanDerWaalsContact O-CB 3.32Å; L89-S92 WeakPolarHBondContact O-CB 3.49Å; L89-S92 PolarHBondContact O-N 3.41Å; L90-S92 VanDerWaalsContact C-N 3.32Å; L90-S92 PolarHBondContact O-N 3.09Å; S92-M94 VanDerWaalsContact C-N 3.33Å; S92-M94 PolarHBondContact O-N 3.37Å; S92-G98 VanDerWaalsContact O-CA 3.31Å; S92-G98 WeakPolarHBondContact O-CA 3.42Å; S92-A99 WeakPolarHBondContact OG-CB 3.41Å; S92-S119 VanDerWaalsContact CB-O 3.31Å; S92-S119 WeakPolarHBondContact CB-O 3.33Å; S92-S119 WeakPolarHBondContact O-CB 3.09Å; S92-S119 PolarHBondContact OG-O 3.18Å
93S96.3Very high97.6Very high40 Ų4044.1 Ų44.128%0.2825%0.25SS..Hα-helixtrans-75.5-16.2177.372.50000114.9L89 L90 V91L89-S93 PolarHBondContact O-N 3.08Å; L90-S93 PolarHBondContact O-N 3.4Å; L90-S93 VanDerWaalsContact O-N 3.13Å; L90-S93 PolarHBondContact O-OG 2.87Å; V91-S93 PolarHBondContact O-N 3.36Å
94M96.2Very high97.5Very high138 Ų13842.6 Ų42.668%0.6824%0.24SC*.Hα-helixtrans-107.9-16.8-175.6-64.4-175.9-68.500113.6L90 V91 S92L90-M94 WeakPolarHBondContact O-CE 3.19Å; L90-M94 PolarHBondContact O-N 3Å; V91-M94 HydrophobicContact CG2-CE 4.21Å; V91-M94 PolarHBondContact O-N 3.25Å; S92-M94 VanDerWaalsContact C-N 3.33Å; S92-M94 PolarHBondContact O-N 3.37Å
95V96.3Very high97.5Very high45 Ų4540.1 Ų40.127%0.27322%0.224SC..SBendtrans-87.6131.1179.7170.10000109.6V91 N97 G98 A118 L122V91-V95 HydrophobicContact CG1-CG2 3.58Å; V91-V95 WeakPolarHBondContact O-CG2 3.28Å; V91-V95 PolarHBondContact O-N 2.68Å; V95-N97 PolarHBondContact O-N 3.45Å; V95-G98 PolarHBondContact O-N 2.85Å; V95-A118 HydrophobicContact CG1-CB 4.39Å; V95-L122 HydrophobicContact CB-CD1 4.27Å; V95-L122 HydrophobicContact CG2-CD1 4.1Å
96E94.7Very high97.5Very high115 Ų11542.7 Ų42.754%0.53723%0.234SC..THydrogen-bonded Turntrans52.4-125.2-179.6-60.1167.1-171.800111.9G98 G117 A118E96-G98 VanDerWaalsContact C-N 3.35Å; E96-G117 VanDerWaalsContact CD-CA 3.43Å; E96-G117 VanDerWaalsContact OE1-CA 3.29Å; E96-G117 WeakPolarHBondContact OE1-CA 3.29Å; E96-G117 WeakPolarHBondContact OE2-CA 3.37Å; E96-G117 PolarHBondContact OE2-N 3.38Å; E96-A118 VanDerWaalsContact CD-N 3.27Å; E96-A118 PolarHBondContact OE1-N 2.93Å; E96-A118 PolarHBondContact OE2-N 3.47Å
97N94.1Very high97.4Very high127 Ų12742.3 Ų42.368%0.67923%0.233SC*.THydrogen-bonded Turntrans-9410.2179.4-65.9-26.3000113Q29 V33 V95Q29-N97 HydrophobicContact CG-CB 4.26Å; Q29-N97 WeakPolarHBondContact CG-O 3.41Å; Q29-N97 PolarHBondContact NE2-O 3.27Å; V33-N97 WeakPolarHBondContact CG2-O 3.2Å; V95-N97 PolarHBondContact O-N 3.45Å
98G97.4Very high97.4Very high1 Ų143 Ų431%0.0124%0.236CC..  trans67.4170.8-176.500000114.4S92 V95 E96 G100 S119S92-G98 VanDerWaalsContact O-CA 3.31Å; S92-G98 WeakPolarHBondContact O-CA 3.42Å; V95-G98 PolarHBondContact O-N 2.85Å; E96-G98 VanDerWaalsContact C-N 3.35Å; G98-G100 PolarHBondContact O-N 3.38Å; G98-S119 PolarHBondContact O-OG 3.28Å
99A98Very high97.3Very high6 Ų644.8 Ų44.85%0.0525%0.245CC..  trans-87.287.1174.600000110.5T36 S92 T101 V120 A123T36-A99 VanDerWaalsContact CB-O 3.25Å; T36-A99 WeakPolarHBondContact CB-O 3.3Å; T36-A99 WeakPolarHBondContact CG2-O 3.46Å; T36-A99 PolarHBondContact OG1-O 3.36Å; S92-A99 WeakPolarHBondContact OG-CB 3.41Å; A99-T101 VanDerWaalsContact C-N 3.35Å; A99-T101 PolarHBondContact O-N 3.37Å; A99-V120 HydrophobicContact CB-CG2 4.28Å; A99-A123 HydrophobicContact CB-CB 4.15Å
100G97.5Very high97.3Very high4 Ų444.6 Ų44.64%0.04124%0.244CC..  trans-94.239.2-179.200000114G98 H115G98-G100 PolarHBondContact O-N 3.38Å; G100-H115 PolarHBondContact N-NE2 3.2Å
101T97.6Very high97.2Very high10 Ų1043.6 Ų43.66%0.06124%0.241CC..SBendtrans-98.7-2.8-168.961.90000114A99 V120A99-T101 VanDerWaalsContact C-N 3.35Å; A99-T101 PolarHBondContact O-N 3.37Å; T101-V120 HydrophobicContact CG2-CG2 3.96Å
102G97.7Very high96.9Very high24 Ų2442.4 Ų42.425%0.24724%0.241CC..THydrogen-bonded Turntrans77.4163.9-163.700000111.7T36 T104 V105T36-G102 VanDerWaalsContact OG1-CA 3.27Å; T36-G102 WeakPolarHBondContact OG1-CA 3.44Å; T36-G102 PolarHBondContact OG1-N 3.07Å; G102-T104 PolarHBondContact O-N 3Å; G102-T104 VanDerWaalsContact O-N 3.15Å; G102-V105 PolarHBondContact O-N 3.07Å; G102-V105 VanDerWaalsContact O-N 3.14Å
103W97.8Very high96.6Very high64 Ų6449.5 Ų49.524%0.24228%0.278CS..THydrogen-bonded Turntrans-66.4-16.7-178.584.4-77.6000113.7A39 F40 I43 F212 W213A39-W103 HydrophobicContact CB-CB 3.53Å; A39-W103 HydrophobicContact CB-CG 4.15Å; F40-W103 HydrophobicContact CD1-CB 4.39Å; F40-W103 HydrophobicContact CE1-CB 4.07Å; F40-W103 WeakPolarHBondContact CE1-O 3.39Å; F40-W103 HydrophobicContact CZ-CB 4.36Å; F40-W103 VanDerWaalsContact CZ-O 3.23Å; F40-W103 WeakPolarHBondContact CZ-O 3.31Å; I43-W103 HydrophobicContact CD1-CD2 4.46Å; I43-W103 HydrophobicContact CD1-CE3 3.95Å; I43-W103 HydrophobicContact CD1-CZ3 4.08Å; W103-F212 HydrophobicContact CD2-CZ 4.24Å; W103-F212 HydrophobicContact CE3-CE1 4.48Å; W103-F212 AromaticContact CE3-CZ 3.75Å; W103-F212 HydrophobicContact CE3-CZ 3.75Å; W103-F212 AromaticContact CH2-CE1 3.82Å; W103-F212 HydrophobicContact CH2-CE1 3.82Å; W103-F212 AromaticContact CH2-CZ 3.84Å; W103-F212 HydrophobicContact CH2-CZ 3.84Å; W103-F212 HydrophobicContact CZ2-CE1 4.1Å; W103-F212 HydrophobicContact CZ2-CZ 4.3Å; W103-F212 HydrophobicContact CZ3-CE1 4.04Å; W103-F212 AromaticContact CZ3-CZ 3.54Å; W103-F212 HydrophobicContact CZ3-CZ 3.54Å; W103-W213 HydrophobicContact CH2-CH2 4.41Å; W103-W213 HydrophobicContact CH2-CZ3 4.06Å; W103-W213 AromaticContact CZ2-CH2 3.7Å; W103-W213 HydrophobicContact CZ2-CH2 3.7Å; W103-W213 AromaticContact CZ2-CZ3 3.78Å; W103-W213 HydrophobicContact CZ2-CZ3 3.78Å
104T97.7Very high96.6Very high20 Ų2050.3 Ų50.312%0.12329%0.287CS..THydrogen-bonded Turntrans-84.1-16.3177.462.60000113.4G102 Y106 Y208 F212 W213G102-T104 PolarHBondContact O-N 3Å; G102-T104 VanDerWaalsContact O-N 3.15Å; T104-Y106 VanDerWaalsContact C-N 3.28Å; T104-Y106 VanDerWaalsContact CB-CE1 3.49Å; T104-Y106 HydrophobicContact CG2-CE1 4.29Å; T104-Y106 WeakPolarHBondContact O-CD1 3.41Å; T104-Y106 PolarHBondContact O-N 3.28Å; T104-Y208 WeakPolarHBondContact O-CE1 3.33Å; T104-Y208 PolarHBondContact O-OH 3.19Å; T104-F212 HydrophobicContact CG2-CD1 4.34Å; T104-F212 HydrophobicContact CG2-CE1 3.7Å; T104-F212 HydrophobicContact CG2-CZ 4.05Å; T104-W213 HydrophobicContact CG2-CH2 4.21Å; T104-W213 HydrophobicContact CG2-CZ2 4.04Å
105V98.1Very high96.6Very high5 Ų544.4 Ų44.43%0.0326%0.257CS..THydrogen-bonded Turntrans53.940.6173.6-1570000113.5F40 G102 S110 V120 L186F40-V105 HydrophobicContact CE2-CG2 4.23Å; F40-V105 HydrophobicContact CZ-CG2 3.55Å; G102-V105 PolarHBondContact O-N 3.07Å; G102-V105 VanDerWaalsContact O-N 3.14Å; V105-S110 VanDerWaalsContact O-CB 3.29Å; V105-S110 WeakPolarHBondContact O-CB 3.35Å; V105-S110 PolarHBondContact O-OG 3.25Å; V105-V120 HydrophobicContact CG1-CG1 4.11Å; V105-L186 HydrophobicContact CG1-CD2 3.8Å
106Y98.3Very high96.4Very high54 Ų5445.5 Ų45.521%0.21228%0.278CS..  trans-67.9129.8-174.9-71.6-17000114T104 L109 S110 Y208 Q209 F212 W213T104-Y106 VanDerWaalsContact C-N 3.28Å; T104-Y106 VanDerWaalsContact CB-CE1 3.49Å; T104-Y106 HydrophobicContact CG2-CE1 4.29Å; T104-Y106 WeakPolarHBondContact O-CD1 3.41Å; T104-Y106 PolarHBondContact O-N 3.28Å; Y106-L109 WeakPolarHBondContact O-CB 3.37Å; Y106-L109 PolarHBondContact O-N 2.88Å; Y106-S110 PolarHBondContact O-N 3.26Å; Y106-S110 PolarHBondContact O-OG 3.3Å; Y106-Y208 AromaticContact CD1-CD1 3.55Å; Y106-Y208 HydrophobicContact CD1-CD1 3.55Å; Y106-Y208 AromaticContact CD1-CE1 3.64Å; Y106-Y208 HydrophobicContact CD1-CE1 3.64Å; Y106-Y208 HydrophobicContact CE1-CD1 4.02Å; Y106-Y208 HydrophobicContact CE1-CE1 4.11Å; Y106-Q209 HydrophobicContact CD1-CG 4.23Å; Y106-Q209 HydrophobicContact CE1-CB 4.43Å; Y106-Q209 HydrophobicContact CE1-CG 3.81Å; Y106-Q209 HydrophobicContact CE2-CG 4.15Å; Y106-F212 HydrophobicContact CE1-CD1 4.41Å; Y106-F212 HydrophobicContact CE1-CG 4.47Å; Y106-W213 AromaticContact CZ-NE1 3.95Å; Y106-W213 WeakPolarHBondContact OH-CZ2 3.47Å; Y106-W213 PolarHBondContact OH-NE1 2.92Å
107P97.4Very high96.5Very high11 Ų1140.7 Ų40.77%0.07126%0.26CS..THydrogen-bonded Turntrans-69.3153.3160.629.3-31.4000110S110 L186 F197 Y208P107-S110 VanDerWaalsContact N-OG 3.1Å; P107-L186 HydrophobicContact CB-CD1 4.14Å; P107-L186 HydrophobicContact CG-CD1 4.43Å; P107-F197 HydrophobicContact CB-CB 3.95Å; P107-F197 HydrophobicContact CG-CB 3.56Å; P107-F197 HydrophobicContact CG-CD2 4.06Å; P107-F197 HydrophobicContact CG-CG 3.84Å; P107-Y208 HydrophobicContact CG-CD2 4Å; P107-Y208 HydrophobicContact CG-CG 3.85Å
108P96.9Very high96.6Very high83 Ų8336.4 Ų36.454%0.53924%0.242SC..THydrogen-bonded Turncis-81.6-4.92.133.7-36.2000114S110 A111P108-S110 VanDerWaalsContact C-N 3.29Å; P108-S110 PolarHBondContact O-N 3.44Å; P108-A111 VanDerWaalsContact O-CB 3.29Å; P108-A111 WeakPolarHBondContact O-CB 3.38Å; P108-A111 PolarHBondContact O-N 2.9Å
109L97.7Very high96.7Very high86 Ų8636.5 Ų36.545%0.4524%0.242SC..THydrogen-bonded Turntrans-61.4-38.5-178.8-179.963.2000112Y106 A111 A114 H115Y106-L109 WeakPolarHBondContact O-CB 3.37Å; Y106-L109 PolarHBondContact O-N 2.88Å; L109-A111 VanDerWaalsContact C-N 3.31Å; L109-A114 HydrophobicContact CD1-CB 4.2Å; L109-A114 VanDerWaalsContact O-CB 3.29Å; L109-A114 WeakPolarHBondContact O-CB 3.47Å; L109-H115 PolarHBondContact O-ND1 2.72Å
110S97.4Very high96.7Very high0 Ų036.2 Ų36.20%024%0.24CC..THydrogen-bonded Turntrans-82.9-1175.364.50000114.2V105 Y106 P107 P108 L186 R190V105-S110 VanDerWaalsContact O-CB 3.29Å; V105-S110 WeakPolarHBondContact O-CB 3.35Å; V105-S110 PolarHBondContact O-OG 3.25Å; Y106-S110 PolarHBondContact O-N 3.26Å; Y106-S110 PolarHBondContact O-OG 3.3Å; P107-S110 VanDerWaalsContact N-OG 3.1Å; P108-S110 VanDerWaalsContact C-N 3.29Å; P108-S110 PolarHBondContact O-N 3.44Å; S110-L186 WeakPolarHBondContact OG-CD2 3.49Å; S110-R190 WeakPolarHBondContact O-CD 3.16Å; S110-R190 PolarHBondContact O-NH1 3.48Å
111A96.3Very high96.7Very high19 Ų1936.8 Ų36.816%0.15724%0.242CC..SBendtrans-81.5167177.500000111.9P108 L109 I113 A114 H115 R190P108-A111 VanDerWaalsContact O-CB 3.29Å; P108-A111 WeakPolarHBondContact O-CB 3.38Å; P108-A111 PolarHBondContact O-N 2.9Å; L109-A111 VanDerWaalsContact C-N 3.31Å; A111-I113 PolarHBondContact O-N 2.94Å; A111-I113 VanDerWaalsContact O-N 3.13Å; A111-A114 PolarHBondContact O-N 3.43Å; A111-A114 VanDerWaalsContact O-N 3.12Å; A111-H115 PolarHBondContact O-N 3.06Å; A111-R190 VanDerWaalsContact C-NH1 3.34Å; A111-R190 PolarHBondContact O-NH1 2.92Å
112G93.6Very high96.8Very high36 Ų3637.9 Ų37.937%0.37125%0.247SC..THydrogen-bonded Turntrans-61.2-22-17800000114.5A114 G116G112-A114 VanDerWaalsContact C-N 3.32Å; G112-A114 PolarHBondContact O-N 3.11Å; G112-G116 WeakPolarHBondContact O-CA 3.48Å
113I92.6Very high96.9Very high152 Ų15236.9 Ų36.978%0.77924%0.236SC*.THydrogen-bonded Turntrans-66.1-34.8177-62.9168.2000111.6A111A111-I113 PolarHBondContact O-N 2.94Å; A111-I113 VanDerWaalsContact O-N 3.13Å
114A95.1Very high96.9Very high57 Ų5733.9 Ų33.947%0.47123%0.225SC..THydrogen-bonded Turntrans-107.1-35.3-177.300000113.2L109 A111 G112L109-A114 HydrophobicContact CD1-CB 4.2Å; L109-A114 VanDerWaalsContact O-CB 3.29Å; L109-A114 WeakPolarHBondContact O-CB 3.47Å; A111-A114 PolarHBondContact O-N 3.43Å; A111-A114 VanDerWaalsContact O-N 3.12Å; G112-A114 VanDerWaalsContact C-N 3.32Å; G112-A114 PolarHBondContact O-N 3.11Å
115H96.8Very high97Very high13 Ų1337.6 Ų37.66%0.0624%0.24CC..SBendtrans-123.384.7174.4-77.579.5000109.7Q29 G100 L109 A111 G117 V120 R190Q29-H115 PolarHBondContact NE2-NE2 3.39Å; Q29-H115 VanDerWaalsContact NE2-NE2 3.11Å; G100-H115 PolarHBondContact N-NE2 3.2Å; L109-H115 PolarHBondContact O-ND1 2.72Å; A111-H115 PolarHBondContact O-N 3.06Å; H115-G117 PolarHBondContact O-N 2.83Å; H115-V120 HydrophobicContact CB-CG2 3.68Å; H115-R190 PolarHBondContact O-NH1 2.92Å; H115-R190 PolarHBondContact O-NH2 3.12Å
116G92.4Very high97Very high68 Ų6837.3 Ų37.370%0.70124%0.238SC*.  trans-74.6-14.9-163.900000118G112G112-G116 WeakPolarHBondContact O-CA 3.48Å
117G95.2Very high97Very high15 Ų1535.1 Ų35.116%0.15523%0.23CC..SBendtrans-127.9-158.7179.200000114.4E96 H115 S119 R190E96-G117 VanDerWaalsContact CD-CA 3.43Å; E96-G117 VanDerWaalsContact OE1-CA 3.29Å; E96-G117 WeakPolarHBondContact OE1-CA 3.29Å; E96-G117 WeakPolarHBondContact OE2-CA 3.37Å; E96-G117 PolarHBondContact OE2-N 3.38Å; H115-G117 PolarHBondContact O-N 2.83Å; G117-S119 PolarHBondContact O-N 3.02Å; G117-S119 VanDerWaalsContact O-N 3.09Å; G117-R190 PolarHBondContact O-NH2 3.46Å
118A97.6Very high97.1Very high37 Ų3736.4 Ų36.431%0.30624%0.235SC..THydrogen-bonded Turntrans-75.2-6.6-150.500000115.1V95 E96 V120 D121 L122V95-A118 HydrophobicContact CG1-CB 4.39Å; E96-A118 VanDerWaalsContact CD-N 3.27Å; E96-A118 PolarHBondContact OE1-N 2.93Å; E96-A118 PolarHBondContact OE2-N 3.47Å; A118-V120 PolarHBondContact O-N 2.95Å; A118-D121 PolarHBondContact O-N 3.43Å; A118-L122 WeakPolarHBondContact O-CG 3.37Å; A118-L122 PolarHBondContact O-N 3.37Å
119S98.3Very high97.2Very high2 Ų234.6 Ų34.61%0.01422%0.221CC..Hα-helixtrans-59.1-47.1-174.566.40000112.3S92 G98 G117 L122 A123S92-S119 VanDerWaalsContact CB-O 3.31Å; S92-S119 WeakPolarHBondContact CB-O 3.33Å; S92-S119 WeakPolarHBondContact O-CB 3.09Å; S92-S119 PolarHBondContact OG-O 3.18Å; G98-S119 PolarHBondContact O-OG 3.28Å; G117-S119 PolarHBondContact O-N 3.02Å; G117-S119 VanDerWaalsContact O-N 3.09Å; S119-L122 PolarHBondContact O-N 3.28Å; S119-A123 PolarHBondContact O-N 2.66Å; S119-A123 VanDerWaalsContact O-N 3.15Å
120V98.7Very high97.2Very high0 Ų030.6 Ų30.60%020%0.2CC..Hα-helixtrans-69.1-35.6179177.90000111.1A99 T101 V105 H115 A118 L122 A123 I124A99-V120 HydrophobicContact CB-CG2 4.28Å; T101-V120 HydrophobicContact CG2-CG2 3.96Å; V105-V120 HydrophobicContact CG1-CG1 4.11Å; H115-V120 HydrophobicContact CB-CG2 3.68Å; A118-V120 PolarHBondContact O-N 2.95Å; V120-L122 PolarHBondContact O-N 2.77Å; V120-A123 WeakPolarHBondContact O-CB 3.3Å; V120-A123 PolarHBondContact O-N 3.03Å; V120-I124 HydrophobicContact CG1-CD1 4.03Å; V120-I124 HydrophobicContact CG1-CG1 4.45Å; V120-I124 WeakPolarHBondContact O-CG1 3.09Å; V120-I124 PolarHBondContact O-N 3.37Å
121D98.6Very high97.3Very high16 Ų1631.1 Ų31.19%0.08621%0.205CC..Hα-helixtrans-65-42.2178.6-53.1-46.7000111.1A118 A123 I124 F125 L187 R190 N191A118-D121 PolarHBondContact O-N 3.43Å; D121-A123 PolarHBondContact O-N 2.98Å; D121-I124 WeakPolarHBondContact O-CB 3.38Å; D121-I124 PolarHBondContact O-N 2.85Å; D121-F125 HydrophobicContact CB-CE2 4.44Å; D121-F125 WeakPolarHBondContact O-CD2 3.36Å; D121-F125 PolarHBondContact O-N 3.35Å; D121-L187 HydrophobicContact CB-CD1 3.88Å; D121-L187 WeakPolarHBondContact OD1-CD1 3.3Å; D121-R190 IonicContact OD1-CZ 3.53Å; D121-R190 IonicContact OD1-NE 2.78Å; D121-R190 PolarHBondContact OD1-NE 3.45Å; D121-R190 IonicContact OD1-NH2 3.35Å; D121-R190 IonicContact OD2-NE 3.99Å; D121-R190 IonicContact OD2-NH2 3.59Å; D121-R190 PolarHBondContact OD2-NH2 3.01Å; D121-N191 PolarHBondContact OD1-ND2 2.87Å
122L98.8Very high97.4Very high33 Ų3333.9 Ų33.917%0.17322%0.217CC..Hα-helixtrans-63.9-38.4174.3-69.2172.3000112.5L88 V91 V95 A118 S119 V120 F125 S126L88-L122 HydrophobicContact CD2-CD2 3.82Å; V91-L122 HydrophobicContact CG1-CD1 3.85Å; V95-L122 HydrophobicContact CB-CD1 4.27Å; V95-L122 HydrophobicContact CG2-CD1 4.1Å; A118-L122 WeakPolarHBondContact O-CG 3.37Å; A118-L122 PolarHBondContact O-N 3.37Å; S119-L122 PolarHBondContact O-N 3.28Å; V120-L122 PolarHBondContact O-N 2.77Å; L122-F125 PolarHBondContact O-N 3.36Å; L122-S126 WeakPolarHBondContact O-CB 3.2Å; L122-S126 PolarHBondContact O-N 2.89Å
123A98.7Very high97.6Very high3 Ų332.6 Ų32.63%0.02520%0.202CC..Hα-helixtrans-63.6-42.9172.700000111.2A99 S119 V120 D121 F125 S126 L127A99-A123 HydrophobicContact CB-CB 4.15Å; S119-A123 PolarHBondContact O-N 2.66Å; S119-A123 VanDerWaalsContact O-N 3.15Å; V120-A123 WeakPolarHBondContact O-CB 3.3Å; V120-A123 PolarHBondContact O-N 3.03Å; D121-A123 PolarHBondContact O-N 2.98Å; A123-F125 PolarHBondContact O-N 3.01Å; A123-S126 VanDerWaalsContact O-CB 3.31Å; A123-S126 WeakPolarHBondContact O-CB 3.32Å; A123-S126 PolarHBondContact O-N 3.26Å; A123-L127 WeakPolarHBondContact O-CG 3.41Å; A123-L127 PolarHBondContact O-N 2.94Å
124I98.8Very high97.9Very high2 Ų226.4 Ų26.41%0.0117%0.172CC..Hα-helixtrans-61-45.2175.3-70.5168.3000110.8V120 D121 S126 L127 H128 I183 L186 L187V120-I124 HydrophobicContact CG1-CD1 4.03Å; V120-I124 HydrophobicContact CG1-CG1 4.45Å; V120-I124 WeakPolarHBondContact O-CG1 3.09Å; V120-I124 PolarHBondContact O-N 3.37Å; D121-I124 WeakPolarHBondContact O-CB 3.38Å; D121-I124 PolarHBondContact O-N 2.85Å; I124-S126 VanDerWaalsContact C-N 3.32Å; I124-S126 PolarHBondContact O-N 2.69Å; I124-L127 PolarHBondContact O-N 2.88Å; I124-H128 WeakPolarHBondContact CG2-CE1 3.35Å; I124-H128 WeakPolarHBondContact CG2-ND1 3.34Å; I124-H128 PolarHBondContact O-N 3.34Å; I124-H128 PolarHBondContact O-ND1 3.27Å; I124-I183 HydrophobicContact CG1-CB 4.36Å; I124-I183 HydrophobicContact CG2-CB 4.06Å; I124-I183 HydrophobicContact CG2-CD1 4.25Å; I124-I183 HydrophobicContact CG2-CG1 4.19Å; I124-L186 HydrophobicContact CD1-CD2 4.04Å; I124-L186 HydrophobicContact CD1-CG 4.18Å; I124-L187 HydrophobicContact CD1-CB 4.25Å; I124-L187 HydrophobicContact CD1-CD1 4.2Å; I124-L187 HydrophobicContact CG2-CB 4.24Å; I124-L187 HydrophobicContact CG2-CD1 4.31Å; I124-L187 HydrophobicContact CG2-CD2 4.36Å
125F98.9Very high98Very high97 Ų9725.9 Ų25.943%0.42516%0.161SC..Hα-helixtrans-64.3-36.9176.5-70.6-54.1000112.6L88 D121 L122 A123 H128 L129 L187L88-F125 HydrophobicContact CD1-CB 3.9Å; D121-F125 HydrophobicContact CB-CE2 4.44Å; D121-F125 WeakPolarHBondContact O-CD2 3.36Å; D121-F125 PolarHBondContact O-N 3.35Å; L122-F125 PolarHBondContact O-N 3.36Å; A123-F125 PolarHBondContact O-N 3.01Å; F125-H128 PolarHBondContact O-N 3.48Å; F125-L129 PolarHBondContact O-N 2.94Å; F125-L187 HydrophobicContact CE1-CD2 3.84Å; F125-L187 HydrophobicContact CZ-CD1 4.5Å; F125-L187 HydrophobicContact CZ-CD2 3.89Å
126S98.8Very high98.1Very high0 Ų027 Ų270%017%0.167CC..Hα-helixtrans-57.4-50.2172.1178.10000111.7F45 A85 L89 L122 A123 I124 H128 L129 A130F45-S126 WeakPolarHBondContact CZ-OG 3.42Å; A85-S126 VanDerWaalsContact O-CB 3.26Å; A85-S126 WeakPolarHBondContact O-CB 3.26Å; A85-S126 PolarHBondContact O-OG 3.27Å; L89-S126 WeakPolarHBondContact CB-OG 3.21Å; L122-S126 WeakPolarHBondContact O-CB 3.2Å; L122-S126 PolarHBondContact O-N 2.89Å; A123-S126 VanDerWaalsContact O-CB 3.31Å; A123-S126 WeakPolarHBondContact O-CB 3.32Å; A123-S126 PolarHBondContact O-N 3.26Å; I124-S126 VanDerWaalsContact C-N 3.32Å; I124-S126 PolarHBondContact O-N 2.69Å; S126-H128 VanDerWaalsContact C-N 3.33Å; S126-H128 PolarHBondContact O-N 2.92Å; S126-L129 PolarHBondContact O-N 2.95Å; S126-A130 WeakPolarHBondContact O-CB 3.45Å; S126-A130 PolarHBondContact O-N 3.12Å
127L98.6Very high98.4Very high8 Ų824 Ų244%0.04214%0.137CC..Hα-helixtrans-64.7-35.6179.4-66.4178.4000112.3F40 F44 A123 I124 G131 I183F40-L127 HydrophobicContact CD1-CD2 3.86Å; F40-L127 HydrophobicContact CE1-CD1 3.85Å; F40-L127 HydrophobicContact CE1-CD2 3.96Å; F40-L127 HydrophobicContact CE1-CG 4.46Å; F40-L127 HydrophobicContact CG-CD2 4.41Å; F40-L127 HydrophobicContact CZ-CD1 3.87Å; F44-L127 HydrophobicContact CD1-CD2 4.38Å; F44-L127 HydrophobicContact CD2-CD2 3.87Å; F44-L127 HydrophobicContact CE1-CD2 4.43Å; F44-L127 HydrophobicContact CE2-CD2 3.9Å; F44-L127 HydrophobicContact CG-CD2 4.15Å; F44-L127 HydrophobicContact CZ-CD2 4.2Å; A123-L127 WeakPolarHBondContact O-CG 3.41Å; A123-L127 PolarHBondContact O-N 2.94Å; I124-L127 PolarHBondContact O-N 2.88Å; L127-G131 PolarHBondContact O-N 2.83Å; L127-I183 HydrophobicContact CB-CD1 3.84Å
128H98.9Very high98.6Very high38 Ų3823.4 Ų23.418%0.17613%0.13CC..Hα-helixtrans-61.2-49.1172.5-80.299.3000112.3I124 F125 S126 A130 G131 I132 I183 T184I124-H128 WeakPolarHBondContact CG2-CE1 3.35Å; I124-H128 WeakPolarHBondContact CG2-ND1 3.34Å; I124-H128 PolarHBondContact O-N 3.34Å; I124-H128 PolarHBondContact O-ND1 3.27Å; F125-H128 PolarHBondContact O-N 3.48Å; S126-H128 VanDerWaalsContact C-N 3.33Å; S126-H128 PolarHBondContact O-N 2.92Å; H128-A130 PolarHBondContact O-N 3.26Å; H128-G131 PolarHBondContact O-N 3.43Å; H128-I132 VanDerWaalsContact O-CG1 3.28Å; H128-I132 WeakPolarHBondContact O-CG1 3.22Å; H128-I132 PolarHBondContact O-N 3.45Å; H128-I183 VanDerWaalsContact CE1-CG1 3.42Å; H128-I183 WeakPolarHBondContact CE1-CG1 3.49Å; H128-T184 PolarHBondContact NE2-OG1 3.43Å
129L98.8Very high98.6Very high44 Ų4423.9 Ų23.923%0.2313%0.129CC..Hα-helixtrans-64.5-41.3180-69.5-173.4000111.9L81 P84 A85 L88 F125 S126 G131 I132 S133L81-L129 HydrophobicContact CD2-CD2 4.25Å; P84-L129 HydrophobicContact CB-CD1 4.2Å; P84-L129 HydrophobicContact CG-CD1 4.33Å; A85-L129 HydrophobicContact CB-CB 3.63Å; A85-L129 HydrophobicContact CB-CD1 4.45Å; L88-L129 HydrophobicContact CD1-CD1 3.67Å; L88-L129 HydrophobicContact CD1-CG 4.47Å; F125-L129 PolarHBondContact O-N 2.94Å; S126-L129 PolarHBondContact O-N 2.95Å; L129-G131 VanDerWaalsContact C-N 3.35Å; L129-I132 PolarHBondContact O-N 3.07Å; L129-S133 PolarHBondContact O-N 3.46Å
130A98.5Very high98.6Very high2 Ų223.8 Ų23.82%0.01713%0.129CC..Hα-helixtrans-63.1-40.7173.200000111.7F45 A85 S126 H128 S133 S134F45-A130 HydrophobicContact CZ-CB 4.18Å; A85-A130 HydrophobicContact CB-CB 4.36Å; S126-A130 WeakPolarHBondContact O-CB 3.45Å; S126-A130 PolarHBondContact O-N 3.12Å; H128-A130 PolarHBondContact O-N 3.26Å; A130-S133 VanDerWaalsContact O-CB 3.31Å; A130-S133 WeakPolarHBondContact O-CB 3.38Å; A130-S133 PolarHBondContact O-N 3.11Å; A130-S134 PolarHBondContact O-N 3.25Å; A130-S134 PolarHBondContact O-OG 3.04Å
131G98.4Very high98.6Very high11 Ų1123.9 Ų23.911%0.11313%0.129CC..Hα-helixtrans-62.6-44.5175.600000112.8L127 H128 L129 S133 S134 I135L127-G131 PolarHBondContact O-N 2.83Å; H128-G131 PolarHBondContact O-N 3.43Å; L129-G131 VanDerWaalsContact C-N 3.35Å; G131-S133 VanDerWaalsContact C-N 3.33Å; G131-S133 PolarHBondContact O-N 2.83Å; G131-S134 PolarHBondContact O-N 3.4Å; G131-I135 WeakPolarHBondContact O-CG1 3.32Å; G131-I135 PolarHBondContact O-N 2.96Å
132I98.8Very high98.6Very high77 Ų7724.2 Ų24.240%0.39513%0.13SC..Hα-helixtrans-61.2-44175.8-65.3163.3000110.2L81 H128 L129 S134 I135 L136L81-I132 HydrophobicContact CD1-CB 4.15Å; L81-I132 HydrophobicContact CD1-CG2 3.58Å; H128-I132 VanDerWaalsContact O-CG1 3.28Å; H128-I132 WeakPolarHBondContact O-CG1 3.22Å; H128-I132 PolarHBondContact O-N 3.45Å; L129-I132 PolarHBondContact O-N 3.07Å; I132-S134 VanDerWaalsContact C-N 3.34Å; I132-S134 PolarHBondContact O-N 3.27Å; I132-I135 PolarHBondContact O-N 3.35Å; I132-L136 HydrophobicContact CG2-CD1 4.02Å; I132-L136 HydrophobicContact CG2-CG 4.25Å; I132-L136 WeakPolarHBondContact O-CB 3.5Å; I132-L136 VanDerWaalsContact O-CG 3.29Å; I132-L136 WeakPolarHBondContact O-CG 3.34Å; I132-L136 PolarHBondContact O-N 2.96Å
133S98.6Very high98.6Very high9 Ų924.3 Ų24.36%0.06313%0.132CC..Hα-helixtrans-52.5-51.8174.2176.60000111.5S78 L129 A130 G131 L136 G137S78-S133 VanDerWaalsContact C-OG 3.3Å; S78-S133 VanDerWaalsContact CB-O 3.26Å; S78-S133 WeakPolarHBondContact CB-O 3.49Å; S78-S133 VanDerWaalsContact O-CB 3.27Å; S78-S133 WeakPolarHBondContact O-CB 3.38Å; S78-S133 PolarHBondContact O-OG 3.18Å; L129-S133 PolarHBondContact O-N 3.46Å; A130-S133 VanDerWaalsContact O-CB 3.31Å; A130-S133 WeakPolarHBondContact O-CB 3.38Å; A130-S133 PolarHBondContact O-N 3.11Å; G131-S133 VanDerWaalsContact C-N 3.33Å; G131-S133 PolarHBondContact O-N 2.83Å; S133-L136 PolarHBondContact O-N 3.4Å; S133-G137 PolarHBondContact O-N 2.81Å
134S98.3Very high98.6Very high22 Ų2224.1 Ų24.115%0.15413%0.131CC..Hα-helixtrans-66.2-38.5-178.8-67.70000113.5A130 G131 I132 G137 A138 L176A130-S134 PolarHBondContact O-N 3.25Å; A130-S134 PolarHBondContact O-OG 3.04Å; G131-S134 PolarHBondContact O-N 3.4Å; I132-S134 VanDerWaalsContact C-N 3.34Å; I132-S134 PolarHBondContact O-N 3.27Å; S134-G137 PolarHBondContact O-N 3.25Å; S134-A138 WeakPolarHBondContact O-CB 3.29Å; S134-A138 PolarHBondContact O-N 2.93Å; S134-L176 VanDerWaalsContact CB-CD1 3.45Å
135I98.6Very high98.6Very high47 Ų4724.2 Ų24.224%0.24113%0.131CC..Hα-helixtrans-64.6-46.3176.2-69.3168.1000110.9G131 I132 G137 A138 V139 L173 L176G131-I135 WeakPolarHBondContact O-CG1 3.32Å; G131-I135 PolarHBondContact O-N 2.96Å; I132-I135 PolarHBondContact O-N 3.35Å; I135-G137 VanDerWaalsContact C-N 3.31Å; I135-G137 PolarHBondContact O-N 3.27Å; I135-A138 PolarHBondContact O-N 3.11Å; I135-V139 WeakPolarHBondContact O-CG2 3.22Å; I135-V139 PolarHBondContact O-N 2.99Å; I135-L173 HydrophobicContact CG2-CD1 4.13Å; I135-L176 HydrophobicContact CD1-CB 3.99Å; I135-L176 HydrophobicContact CG1-CB 3.98Å; I135-L176 HydrophobicContact CG1-CD1 3.86Å
136L98.6Very high98.5Very high36 Ų3623.9 Ų23.919%0.18813%0.133CC..Hα-helixtrans-60.3-43176.7-68.8179.1000111.2M74 M77 L81 I132 S133 N140M74-L136 HydrophobicContact CG-CB 3.92Å; M74-L136 HydrophobicContact CG-CD1 4.49Å; M74-L136 HydrophobicContact CG-CD2 3.88Å; M74-L136 HydrophobicContact CG-CG 4.3Å; M74-L136 HydrophobicContact SD-CB 4.28Å; M74-L136 HydrophobicContact SD-CD2 3.96Å; M77-L136 HydrophobicContact CE-CD1 4.49Å; M77-L136 HydrophobicContact CG-CD1 4.18Å; M77-L136 HydrophobicContact SD-CD1 4.24Å; L81-L136 HydrophobicContact CD1-CD1 4.01Å; I132-L136 HydrophobicContact CG2-CD1 4.02Å; I132-L136 HydrophobicContact CG2-CG 4.25Å; I132-L136 WeakPolarHBondContact O-CB 3.5Å; I132-L136 VanDerWaalsContact O-CG 3.29Å; I132-L136 WeakPolarHBondContact O-CG 3.34Å; I132-L136 PolarHBondContact O-N 2.96Å; S133-L136 PolarHBondContact O-N 3.4Å; L136-N140 WeakPolarHBondContact O-CB 3.35Å; L136-N140 PolarHBondContact O-N 3.43Å; L136-N140 VanDerWaalsContact O-N 3.16Å
137G98.3Very high98.4Very high6 Ų629.5 Ų29.56%0.06216%0.163CC..Hα-helixtrans-59.7-47.8173.100000112.3S133 S134 I135 V139 N140 F141S133-G137 PolarHBondContact O-N 2.81Å; S134-G137 PolarHBondContact O-N 3.25Å; I135-G137 VanDerWaalsContact C-N 3.31Å; I135-G137 PolarHBondContact O-N 3.27Å; G137-V139 PolarHBondContact O-N 3.21Å; G137-N140 WeakPolarHBondContact O-CB 3.23Å; G137-N140 PolarHBondContact O-N 3.17Å; G137-F141 WeakPolarHBondContact O-CD2 3.4Å; G137-F141 PolarHBondContact O-N 3.4Å
138A98.6Very high98.4Very high1 Ų131.7 Ų31.71%0.00817%0.174CC..Hα-helixtrans-59.4-47.6-179.500000112.7S134 I135 N140 F141 I142 A169 L172 L173S134-A138 WeakPolarHBondContact O-CB 3.29Å; S134-A138 PolarHBondContact O-N 2.93Å; I135-A138 PolarHBondContact O-N 3.11Å; A138-N140 VanDerWaalsContact C-N 3.27Å; A138-N140 PolarHBondContact O-N 3Å; A138-F141 PolarHBondContact O-N 3.48Å; A138-I142 VanDerWaalsContact O-CG1 3.31Å; A138-I142 WeakPolarHBondContact O-CG1 3.43Å; A138-I142 PolarHBondContact O-N 3.42Å; A138-A169 HydrophobicContact CB-CB 4.05Å; A138-A169 WeakPolarHBondContact CB-O 3.33Å; A138-L172 HydrophobicContact CB-CB 4.07Å; A138-L173 HydrophobicContact CB-CB 4.47Å
139V98.8Very high98.3Very high48 Ų4833.2 Ų33.229%0.29118%0.178SC..Hα-helixtrans-58.8-42176172.10000110.9F71 I135 G137 T143 L173F71-V139 HydrophobicContact CE2-CG1 4.25Å; I135-V139 WeakPolarHBondContact O-CG2 3.22Å; I135-V139 PolarHBondContact O-N 2.99Å; G137-V139 PolarHBondContact O-N 3.21Å; V139-T143 WeakPolarHBondContact O-CB 3.33Å; V139-T143 PolarHBondContact O-N 3.15Å; V139-T143 PolarHBondContact O-OG1 3.35Å; V139-L173 HydrophobicContact CG2-CD1 3.94Å
140N98.6Very high98.1Very high0 Ų033.4 Ų33.40%018%0.183CC..Hα-helixtrans-66.4-44.3178-17024.3000112.5M69 A70 F71 N75 L136 G137 A138 T143 T144M69-N140 WeakPolarHBondContact CB-ND2 3.28Å; M69-N140 HydrophobicContact CE-CB 4.41Å; A70-N140 PolarHBondContact N-OD1 3.34Å; F71-N140 HydrophobicContact CD2-CB 4.31Å; F71-N140 PolarHBondContact N-OD1 2.93Å; N75-N140 VanDerWaalsContact CB-ND2 3.33Å; N75-N140 WeakPolarHBondContact CB-ND2 3.15Å; N75-N140 VanDerWaalsContact CG-ND2 3.3Å; N75-N140 PolarHBondContact OD1-ND2 3.23Å; N75-N140 VanDerWaalsContact OD1-ND2 3.15Å; L136-N140 WeakPolarHBondContact O-CB 3.35Å; L136-N140 PolarHBondContact O-N 3.43Å; L136-N140 VanDerWaalsContact O-N 3.16Å; G137-N140 WeakPolarHBondContact O-CB 3.23Å; G137-N140 PolarHBondContact O-N 3.17Å; A138-N140 VanDerWaalsContact C-N 3.27Å; A138-N140 PolarHBondContact O-N 3Å; N140-T143 PolarHBondContact O-N 2.86Å; N140-T144 VanDerWaalsContact O-CB 3.3Å; N140-T144 WeakPolarHBondContact O-CB 3.36Å; N140-T144 PolarHBondContact O-N 3.15Å; N140-T144 PolarHBondContact O-OG1 3.16Å
141F98.7Very high97.8Very high1 Ų140.7 Ų40.70%0.00423%0.228CC..Hα-helixtrans-60.4-50.4175.2-79-61.4000112.1I52 N57 V60 M69 G137 A138 T143 T144 V145 V165 A169I52-F141 HydrophobicContact CG2-CD2 4.13Å; I52-F141 HydrophobicContact CG2-CE2 3.49Å; I52-F141 VanDerWaalsContact CG2-CE2 3.49Å; I52-F141 HydrophobicContact CG2-CZ 4.28Å; I52-F141 WeakPolarHBondContact O-CZ 3.42Å; N57-F141 HydrophobicContact CB-CZ 4.44Å; N57-F141 WeakPolarHBondContact OD1-CZ 3.48Å; V60-F141 HydrophobicContact CB-CD1 4.46Å; V60-F141 HydrophobicContact CB-CE1 4.32Å; V60-F141 HydrophobicContact CG1-CD1 4.43Å; V60-F141 HydrophobicContact CG2-CD1 4.32Å; V60-F141 HydrophobicContact CG2-CE1 4.19Å; M69-F141 HydrophobicContact CE-CD1 3.44Å; M69-F141 VanDerWaalsContact CE-CD1 3.44Å; M69-F141 HydrophobicContact CE-CE1 3.52Å; M69-F141 HydrophobicContact CE-CG 4.04Å; M69-F141 HydrophobicContact CE-CZ 4.21Å; M69-F141 HydrophobicContact SD-CD1 4.47Å; M69-F141 HydrophobicContact SD-CE1 4.25Å; G137-F141 WeakPolarHBondContact O-CD2 3.4Å; G137-F141 PolarHBondContact O-N 3.4Å; A138-F141 PolarHBondContact O-N 3.48Å; F141-T143 VanDerWaalsContact C-N 3.3Å; F141-T143 PolarHBondContact O-N 3.41Å; F141-T144 PolarHBondContact O-N 3.23Å; F141-V145 WeakPolarHBondContact O-CB 3.45Å; F141-V145 VanDerWaalsContact O-CG2 3.25Å; F141-V145 WeakPolarHBondContact O-CG2 3.42Å; F141-V145 PolarHBondContact O-N 2.85Å; F141-V165 HydrophobicContact CB-CG1 4.37Å; F141-V165 HydrophobicContact CD1-CG1 3.66Å; F141-V165 HydrophobicContact CD2-CG1 4.32Å; F141-V165 HydrophobicContact CE1-CG1 4.04Å; F141-V165 HydrophobicContact CG-CG1 3.86Å; F141-A169 HydrophobicContact CB-CB 3.99Å
142I98.6Very high97.4Very high23 Ų2343 Ų4312%0.11825%0.251CS..Hα-helixtrans-57.1-48.1179.4-68.6163.3000109.9A138 T144 V145 I146 V166 A169 L170 L173A138-I142 VanDerWaalsContact O-CG1 3.31Å; A138-I142 WeakPolarHBondContact O-CG1 3.43Å; A138-I142 PolarHBondContact O-N 3.42Å; I142-T144 PolarHBondContact O-N 2.84Å; I142-V145 PolarHBondContact O-N 3.4Å; I142-I146 HydrophobicContact CG2-CD1 3.62Å; I142-I146 HydrophobicContact CG2-CG1 4.47Å; I142-I146 WeakPolarHBondContact O-CB 3.37Å; I142-I146 VanDerWaalsContact O-CG1 3.25Å; I142-I146 WeakPolarHBondContact O-CG1 3.33Å; I142-I146 PolarHBondContact O-N 2.99Å; I142-V166 HydrophobicContact CG1-CG2 4.44Å; I142-A169 HydrophobicContact CD1-CB 4.17Å; I142-A169 HydrophobicContact CG1-CB 3.81Å; I142-L170 HydrophobicContact CD1-CD2 3.83Å; I142-L170 HydrophobicContact CD1-CG 4.28Å; I142-L170 HydrophobicContact CG1-CD2 4.36Å; I142-L173 HydrophobicContact CD1-CD2 3.93Å
143T98.6Very high97.2Very high35 Ų3541.3 Ų41.322%0.21524%0.243CC..Hα-helixtrans-64.9-42.8-178.4-54.50000111.9A70 F71 V139 N140 F141 I146 N147A70-T143 HydrophobicContact CB-CG2 3.69Å; F71-T143 HydrophobicContact CE2-CG2 3.71Å; F71-T143 WeakPolarHBondContact CE2-OG1 3.46Å; F71-T143 HydrophobicContact CZ-CG2 3.72Å; V139-T143 WeakPolarHBondContact O-CB 3.33Å; V139-T143 PolarHBondContact O-N 3.15Å; V139-T143 PolarHBondContact O-OG1 3.35Å; N140-T143 PolarHBondContact O-N 2.86Å; F141-T143 VanDerWaalsContact C-N 3.3Å; F141-T143 PolarHBondContact O-N 3.41Å; T143-I146 PolarHBondContact O-N 2.84Å; T143-N147 WeakPolarHBondContact O-CB 3.49Å; T143-N147 PolarHBondContact O-N 3.37Å; T143-N147 PolarHBondContact O-ND2 3.47Å
144T98.4Very high97Very high0 Ų042.6 Ų42.60%025%0.252CS..Hα-helixtrans-62.9-50.7178.2-56.30000110.6M69 A70 N140 F141 I142 I146 N147 M148M69-T144 HydrophobicContact CE-CG2 4.48Å; M69-T144 HydrophobicContact SD-CG2 4Å; A70-T144 WeakPolarHBondContact CB-OG1 3.25Å; A70-T144 PolarHBondContact N-OG1 3.31Å; N140-T144 VanDerWaalsContact O-CB 3.3Å; N140-T144 WeakPolarHBondContact O-CB 3.36Å; N140-T144 PolarHBondContact O-N 3.15Å; N140-T144 PolarHBondContact O-OG1 3.16Å; F141-T144 PolarHBondContact O-N 3.23Å; I142-T144 PolarHBondContact O-N 2.84Å; T144-I146 VanDerWaalsContact C-N 3.31Å; T144-I146 PolarHBondContact O-N 2.82Å; T144-N147 PolarHBondContact O-N 3.11Å; T144-M148 HydrophobicContact CG2-CB 4.28Å; T144-M148 HydrophobicContact CG2-SD 4.13Å; T144-M148 WeakPolarHBondContact O-CB 3.47Å; T144-M148 PolarHBondContact O-N 3.04Å
145V98.2Very high96.8Very high3 Ų345.6 Ų45.62%0.01827%0.265CS..Hα-helixtrans-62.5-39.8-179174.30000111V60 L64 F141 I142 R149 M158 V162 V166V60-V145 HydrophobicContact CG1-CG2 3.86Å; L64-V145 HydrophobicContact CD1-CB 4.39Å; L64-V145 HydrophobicContact CD1-CG2 4.09Å; F141-V145 WeakPolarHBondContact O-CB 3.45Å; F141-V145 VanDerWaalsContact O-CG2 3.25Å; F141-V145 WeakPolarHBondContact O-CG2 3.42Å; F141-V145 PolarHBondContact O-N 2.85Å; I142-V145 PolarHBondContact O-N 3.4Å; V145-R149 WeakPolarHBondContact O-CD 3.23Å; V145-R149 WeakPolarHBondContact O-CG 3.34Å; V145-R149 PolarHBondContact O-NH1 3.48Å; V145-M158 HydrophobicContact CG1-CE 4.09Å; V145-M158 HydrophobicContact CG1-SD 3.72Å; V145-V162 HydrophobicContact CG1-CG1 4.03Å; V145-V162 HydrophobicContact CG2-CG1 3.82Å; V145-V166 HydrophobicContact CB-CG2 4.22Å; V145-V166 HydrophobicContact CG1-CB 4.18Å; V145-V166 HydrophobicContact CG1-CG2 4.08Å; V145-V166 HydrophobicContact CG2-CB 4.38Å
146I96.9Very high96.6Very high91 Ų9148 Ų4847%0.46728%0.278SS..Hα-helixtrans-72.5-41.9-178-69.5174.2000112I142 T143 T144 R149I142-I146 HydrophobicContact CG2-CD1 3.62Å; I142-I146 HydrophobicContact CG2-CG1 4.47Å; I142-I146 WeakPolarHBondContact O-CB 3.37Å; I142-I146 VanDerWaalsContact O-CG1 3.25Å; I142-I146 WeakPolarHBondContact O-CG1 3.33Å; I142-I146 PolarHBondContact O-N 2.99Å; T143-I146 PolarHBondContact O-N 2.84Å; T144-I146 VanDerWaalsContact C-N 3.31Å; T144-I146 PolarHBondContact O-N 2.82Å; I146-R149 VanDerWaalsContact C-NH1 3.34Å; I146-R149 VanDerWaalsContact CA-NH1 3.27Å; I146-R149 PolarHBondContact O-NH1 3.48Å; I146-R149 PolarHBondContact O-NH2 3.35Å
147N97.4Very high96.3Very high117 Ų11754.7 Ų54.763%0.62630%0.301SS*.Hα-helixtrans-108.7-21.7-164.4-62-66.3000115.3T143 T144T143-N147 WeakPolarHBondContact O-CB 3.49Å; T143-N147 PolarHBondContact O-N 3.37Å; T143-N147 PolarHBondContact O-ND2 3.47Å; T144-N147 PolarHBondContact O-N 3.11Å
148M97.4Very high96.2Very high54 Ų5454.7 Ų54.727%0.26630%0.3SS..  trans-109.517-168.9-58.4-175.671.300113.9A66 P67 D68 A70 T144A66-M148 HydrophobicContact CB-CB 3.99Å; A66-M148 HydrophobicContact CB-CE 4.41Å; P67-M148 HydrophobicContact CG-CE 4.48Å; D68-M148 WeakPolarHBondContact O-CE 3.33Å; A70-M148 WeakPolarHBondContact CA-SD 3.47Å; A70-M148 HydrophobicContact CB-SD 3.62Å; A70-M148 PolarHBondContact N-SD 3.36Å; T144-M148 HydrophobicContact CG2-CB 4.28Å; T144-M148 HydrophobicContact CG2-SD 4.13Å; T144-M148 WeakPolarHBondContact O-CB 3.47Å; T144-M148 PolarHBondContact O-N 3.04Å
149R96.6Very high96.1Very high71 Ų7156.2 Ų56.227%0.26831%0.309SS..PPolyproline II helixtrans-67.8136.2174.7-55.5-170.7-63.9-78.3-13110.2L64 V145 I146 I153 M158L64-R149 HydrophobicContact CD1-CG 4.39Å; L64-R149 HydrophobicContact CD2-CG 3.84Å; V145-R149 WeakPolarHBondContact O-CD 3.23Å; V145-R149 WeakPolarHBondContact O-CG 3.34Å; V145-R149 PolarHBondContact O-NH1 3.48Å; I146-R149 VanDerWaalsContact C-NH1 3.34Å; I146-R149 VanDerWaalsContact CA-NH1 3.27Å; I146-R149 PolarHBondContact O-NH1 3.48Å; I146-R149 PolarHBondContact O-NH2 3.35Å; R149-I153 HydrophobicContact CB-CB 4.38Å; R149-I153 PolarHBondContact NE-O 2.94Å; R149-M158 WeakPolarHBondContact CD-SD 3.48Å
150S95.1Very high96.1Very high47 Ų4754.1 Ų54.133%0.32930%0.297SS..PPolyproline II helixtrans-61.1151.6171.154.90000112L64 G152 I153L64-S150 WeakPolarHBondContact O-CB 3.15Å; L64-S150 PolarHBondContact O-N 3.47Å; L64-S150 PolarHBondContact O-OG 2.91Å; S150-G152 PolarHBondContact O-N 2.91Å; S150-I153 PolarHBondContact O-N 2.9Å; S150-I153 VanDerWaalsContact O-N 3.14Å; S150-I153 WeakPolarHBondContact OG-CD1 3.31Å
151T92.8Very high96.1Very high156 Ų15654.1 Ų54.196%0.95730%0.297SS*.THydrogen-bonded Turntrans-56.8126.9-180-51.80000110.6
152G89.6Confident96Very high58 Ų5854.1 Ų54.160%0.59830%0.297SS*.THydrogen-bonded Turntrans100.2-15.9-179.200000114.7S150 S154S150-G152 PolarHBondContact O-N 2.91Å; G152-S154 PolarHBondContact O-N 3.16Å
153I94.8Very high96Very high43 Ų4354.8 Ų54.822%0.22130%0.298CS..  trans-82.896.1169.6-55.6-175.5000109.2R149 S150 M158R149-I153 HydrophobicContact CB-CB 4.38Å; R149-I153 PolarHBondContact NE-O 2.94Å; S150-I153 PolarHBondContact O-N 2.9Å; S150-I153 VanDerWaalsContact O-N 3.14Å; S150-I153 WeakPolarHBondContact OG-CD1 3.31Å; I153-M158 HydrophobicContact CG2-CG 3.88Å
154S94.7Very high96Very high36 Ų3653.1 Ų53.125%0.25229%0.288SS..  trans-79.7161.7168.835.50000110.5G152 D156 R157 M158G152-S154 PolarHBondContact O-N 3.16Å; S154-D156 VanDerWaalsContact C-N 3.33Å; S154-D156 WeakPolarHBondContact CB-OD1 3.41Å; S154-D156 PolarHBondContact O-N 3.32Å; S154-D156 PolarHBondContact OG-OD1 3.06Å; S154-R157 CarbonylContact O-C 3.55Å; S154-R157 WeakPolarHBondContact O-CA 3.23Å; S154-R157 PolarHBondContact O-N 2.76Å; S154-R157 PolarHBondContact OG-NE 2.78Å; S154-M158 PolarHBondContact O-N 3.4Å
155L94.1Very high96Very high84 Ų8453.1 Ų53.144%0.4429%0.288SS..G310 helixtrans-59.9-42.5-173.7-72.5173.7000112.4R157 M158 W163L155-R157 PolarHBondContact O-N 3.48Å; L155-M158 HydrophobicContact CB-CE 4.45Å; L155-M158 HydrophobicContact CD2-CE 3.53Å; L155-M158 HydrophobicContact CD2-SD 4.01Å; L155-M158 PolarHBondContact O-N 3.1Å; L155-W163 HydrophobicContact CB-CZ2 4.07Å; L155-W163 WeakPolarHBondContact O-CZ2 3.41Å; L155-W163 PolarHBondContact O-NE1 3.3Å
156D93.5Very high96Very high97 Ų9753.6 Ų53.652%0.51929%0.29SS..G310 helixtrans-64.5-17.2175.859-52.3000113.5S154S154-D156 VanDerWaalsContact C-N 3.33Å; S154-D156 WeakPolarHBondContact CB-OD1 3.41Å; S154-D156 PolarHBondContact O-N 3.32Å; S154-D156 PolarHBondContact OG-OD1 3.06Å
157R92.2Very high96.1Very high178 Ų17849.6 Ų49.667%0.67227%0.27SS*.G310 helixtrans-104.64.6178.4-67.7-169.6-107.5-177.9-5.5114.1S154 L155S154-R157 CarbonylContact O-C 3.55Å; S154-R157 WeakPolarHBondContact O-CA 3.23Å; S154-R157 PolarHBondContact O-N 2.76Å; S154-R157 PolarHBondContact OG-NE 2.78Å; L155-R157 PolarHBondContact O-N 3.48Å
158M96.5Very high96.2Very high5 Ų544 Ų443%0.02524%0.24CC..SBendtrans-68.5143.8174.1-67.4-170.1-57.400111.2L64 V145 R149 I153 S154 L155 V162 W163L64-M158 HydrophobicContact CD2-CG 4.4Å; L64-M158 HydrophobicContact CD2-SD 4.26Å; V145-M158 HydrophobicContact CG1-CE 4.09Å; V145-M158 HydrophobicContact CG1-SD 3.72Å; R149-M158 WeakPolarHBondContact CD-SD 3.48Å; I153-M158 HydrophobicContact CG2-CG 3.88Å; S154-M158 PolarHBondContact O-N 3.4Å; L155-M158 HydrophobicContact CB-CE 4.45Å; L155-M158 HydrophobicContact CD2-CE 3.53Å; L155-M158 HydrophobicContact CD2-SD 4.01Å; L155-M158 PolarHBondContact O-N 3.1Å; M158-V162 HydrophobicContact SD-CG1 4.21Å; M158-W163 HydrophobicContact CE-CD2 3.85Å; M158-W163 VanDerWaalsContact CE-CE2 3.41Å; M158-W163 HydrophobicContact CE-CE3 4.38Å; M158-W163 HydrophobicContact CE-CG 4.31Å; M158-W163 HydrophobicContact CE-CH2 4.18Å; M158-W163 HydrophobicContact CE-CZ2 3.62Å
159P96.9Very high96.2Very high33 Ų3341.5 Ų41.521%0.21423%0.228CC..  trans-56.8145.5175-28.938.9000113M63 F161 V162 W163M63-P159 HydrophobicContact CB-CG 4.16Å; M63-P159 HydrophobicContact SD-CB 4.06Å; M63-P159 HydrophobicContact SD-CG 4.48Å; P159-F161 PolarHBondContact O-N 3.3Å; P159-V162 HydrophobicContact CB-CG2 4.21Å; P159-V162 HydrophobicContact CG-CG2 4.38Å; P159-V162 WeakPolarHBondContact O-CB 3.43Å; P159-V162 PolarHBondContact O-N 3.42Å; P159-W163 PolarHBondContact O-N 3.44Å; P159-W163 VanDerWaalsContact O-N 3.08Å
160L97.9Very high96.3Very high4 Ų442 Ų422%0.02124%0.235CC..Hα-helixtrans-57.8-34.5-178-70.3176.2000113.4W163 S164 T244 M250 I251 M254L160-W163 PolarHBondContact O-N 3.4Å; L160-S164 PolarHBondContact O-N 2.76Å; L160-T244 HydrophobicContact CD1-CG2 3.96Å; L160-M250 HydrophobicContact CD1-CB 4.42Å; L160-M250 HydrophobicContact CD1-CE 4.13Å; L160-M250 HydrophobicContact CD1-SD 3.83Å; L160-M250 HydrophobicContact CD2-CB 4.03Å; L160-I251 HydrophobicContact CD2-CD1 4.4Å; L160-I251 HydrophobicContact CD2-CG1 3.71Å; L160-M254 HydrophobicContact CD2-CE 3.97Å
161F98.3Very high96.5Very high1 Ų140.1 Ų40.10%0.00422%0.221CC..Hα-helixtrans-63.9-39172.3-178.5-103000113.5F55 L59 V60 M63 P159 W163 S164 V165 P226 M230 H233F55-F161 HydrophobicContact CB-CE2 4.49Å; F55-F161 HydrophobicContact CB-CZ 3.85Å; L59-F161 HydrophobicContact CB-CD1 4.16Å; L59-F161 HydrophobicContact CB-CE1 3.77Å; L59-F161 HydrophobicContact CD1-CD1 4.46Å; L59-F161 HydrophobicContact CD1-CE1 4.1Å; L59-F161 HydrophobicContact CD1-CZ 4.4Å; V60-F161 HydrophobicContact CG2-CE1 4.18Å; M63-F161 HydrophobicContact CE-CB 4.43Å; M63-F161 HydrophobicContact CE-CD1 4.31Å; M63-F161 HydrophobicContact SD-CB 4.11Å; M63-F161 HydrophobicContact SD-CD1 3.87Å; M63-F161 HydrophobicContact SD-CG 4.43Å; P159-F161 PolarHBondContact O-N 3.3Å; F161-W163 VanDerWaalsContact C-N 3.33Å; F161-S164 PolarHBondContact O-N 3.49Å; F161-S164 PolarHBondContact O-OG 3.17Å; F161-V165 HydrophobicContact CD1-CG2 4.31Å; F161-V165 HydrophobicContact CD2-CG2 4.49Å; F161-V165 HydrophobicContact CE1-CG2 3.81Å; F161-V165 HydrophobicContact CE2-CG2 4.03Å; F161-V165 HydrophobicContact CZ-CG2 3.67Å; F161-V165 WeakPolarHBondContact O-CG2 3.32Å; F161-V165 PolarHBondContact O-N 3.18Å; F161-P226 HydrophobicContact CE2-CB 4.33Å; F161-M230 HydrophobicContact CD2-CG 3.52Å; F161-M230 HydrophobicContact CE2-CG 3.52Å; F161-M230 HydrophobicContact CE2-SD 4.32Å; F161-H233 PolarHBondContact N-NE2 2.94Å
162V98.4Very high96.8Very high0 Ų032.7 Ų32.70%018%0.176CC..Hα-helixtrans-67.2-39.8176.1179.20000110.3V60 M63 L64 V145 M158 P159 V165 V166V60-V162 HydrophobicContact CG1-CG1 4.41Å; M63-V162 HydrophobicContact CB-CG2 3.68Å; M63-V162 HydrophobicContact CG-CG2 4.5Å; M63-V162 HydrophobicContact SD-CG2 4.06Å; L64-V162 HydrophobicContact CD1-CG1 4.27Å; L64-V162 HydrophobicContact CD2-CG1 3.94Å; L64-V162 HydrophobicContact CD2-CG2 4.41Å; L64-V162 HydrophobicContact CG-CG1 4.22Å; L64-V162 HydrophobicContact CG-CG2 4.45Å; V145-V162 HydrophobicContact CG1-CG1 4.03Å; V145-V162 HydrophobicContact CG2-CG1 3.82Å; M158-V162 HydrophobicContact SD-CG1 4.21Å; P159-V162 HydrophobicContact CB-CG2 4.21Å; P159-V162 HydrophobicContact CG-CG2 4.38Å; P159-V162 WeakPolarHBondContact O-CB 3.43Å; P159-V162 PolarHBondContact O-N 3.42Å; V162-V165 PolarHBondContact O-N 2.83Å; V162-V166 PolarHBondContact O-N 2.93Å
163W98.4Very high97.2Very high38 Ų3833 Ų3314%0.14416%0.163CC..Hα-helixtrans-60.7-45.1172.3-91.5112.3000112.7L155 M158 P159 L160 F161 V165 V166 I167 I251 M254 L255L155-W163 HydrophobicContact CB-CZ2 4.07Å; L155-W163 WeakPolarHBondContact O-CZ2 3.41Å; L155-W163 PolarHBondContact O-NE1 3.3Å; M158-W163 HydrophobicContact CE-CD2 3.85Å; M158-W163 VanDerWaalsContact CE-CE2 3.41Å; M158-W163 HydrophobicContact CE-CE3 4.38Å; M158-W163 HydrophobicContact CE-CG 4.31Å; M158-W163 HydrophobicContact CE-CH2 4.18Å; M158-W163 HydrophobicContact CE-CZ2 3.62Å; P159-W163 PolarHBondContact O-N 3.44Å; P159-W163 VanDerWaalsContact O-N 3.08Å; L160-W163 PolarHBondContact O-N 3.4Å; F161-W163 VanDerWaalsContact C-N 3.33Å; W163-V165 VanDerWaalsContact C-N 3.33Å; W163-V165 PolarHBondContact O-N 3.22Å; W163-V166 HydrophobicContact CE3-CG1 3.8Å; W163-V166 HydrophobicContact CZ3-CG1 4.24Å; W163-V166 WeakPolarHBondContact O-CG1 3.13Å; W163-V166 PolarHBondContact O-N 2.97Å; W163-I167 WeakPolarHBondContact O-CD1 3.27Å; W163-I167 VanDerWaalsContact O-CG1 3.23Å; W163-I167 WeakPolarHBondContact O-CG1 3.49Å; W163-I167 PolarHBondContact O-N 3.47Å; W163-I251 HydrophobicContact CB-CG1 4.47Å; W163-I251 HydrophobicContact CD2-CG1 4.37Å; W163-I251 HydrophobicContact CD2-CG2 3.76Å; W163-I251 HydrophobicContact CE3-CG2 4.06Å; W163-I251 HydrophobicContact CG-CD1 4.25Å; W163-I251 HydrophobicContact CG-CG1 3.93Å; W163-I251 HydrophobicContact CG-CG2 4.17Å; W163-I251 HydrophobicContact CH2-CG2 4.37Å; W163-I251 HydrophobicContact CZ2-CG2 4.08Å; W163-I251 HydrophobicContact CZ3-CG2 4.36Å; W163-M254 HydrophobicContact CB-CE 4.06Å; W163-L255 HydrophobicContact CZ3-CD2 4.43Å
164S98.4Very high97.3Very high0 Ų036 Ų360%018%0.179CC..Hα-helixtrans-65.7-37.5179.170.30000112.3L160 F161 T168 L225L160-S164 PolarHBondContact O-N 2.76Å; F161-S164 PolarHBondContact O-N 3.49Å; F161-S164 PolarHBondContact O-OG 3.17Å; S164-T168 WeakPolarHBondContact O-CB 3.36Å; S164-T168 PolarHBondContact O-N 3.07Å; S164-T168 PolarHBondContact O-OG1 3.43Å; S164-L225 WeakPolarHBondContact CB-O 3.48Å; S164-L225 PolarHBondContact OG-O 2.9Å
165V98.6Very high97.5Very high0 Ų034.3 Ų34.30%017%0.167CC..Hα-helixtrans-66.5-43175.1173.70000111.7I52 V60 F141 F161 V162 W163 I167 T168 A169I52-V165 HydrophobicContact CD1-CG1 4.48Å; I52-V165 HydrophobicContact CD1-CG2 4.44Å; V60-V165 HydrophobicContact CG2-CB 4.08Å; V60-V165 HydrophobicContact CG2-CG1 3.96Å; V60-V165 HydrophobicContact CG2-CG2 4.09Å; F141-V165 HydrophobicContact CB-CG1 4.37Å; F141-V165 HydrophobicContact CD1-CG1 3.66Å; F141-V165 HydrophobicContact CD2-CG1 4.32Å; F141-V165 HydrophobicContact CE1-CG1 4.04Å; F141-V165 HydrophobicContact CG-CG1 3.86Å; F161-V165 HydrophobicContact CD1-CG2 4.31Å; F161-V165 HydrophobicContact CD2-CG2 4.49Å; F161-V165 HydrophobicContact CE1-CG2 3.81Å; F161-V165 HydrophobicContact CE2-CG2 4.03Å; F161-V165 HydrophobicContact CZ-CG2 3.67Å; F161-V165 WeakPolarHBondContact O-CG2 3.32Å; F161-V165 PolarHBondContact O-N 3.18Å; V162-V165 PolarHBondContact O-N 2.83Å; W163-V165 VanDerWaalsContact C-N 3.33Å; W163-V165 PolarHBondContact O-N 3.22Å; V165-I167 PolarHBondContact O-N 3.18Å; V165-T168 WeakPolarHBondContact O-CB 3.33Å; V165-T168 PolarHBondContact O-N 2.84Å; V165-A169 WeakPolarHBondContact O-CB 3.17Å; V165-A169 PolarHBondContact O-N 3.3Å
166V98.3Very high97.6Very high13 Ų1330.5 Ų30.58%0.07915%0.148CC..Hα-helixtrans-67.8-36.9179.777.40000112.1I142 V145 V162 W163 A169 L170I142-V166 HydrophobicContact CG1-CG2 4.44Å; V145-V166 HydrophobicContact CB-CG2 4.22Å; V145-V166 HydrophobicContact CG1-CB 4.18Å; V145-V166 HydrophobicContact CG1-CG2 4.08Å; V145-V166 HydrophobicContact CG2-CB 4.38Å; V162-V166 PolarHBondContact O-N 2.93Å; W163-V166 HydrophobicContact CE3-CG1 3.8Å; W163-V166 HydrophobicContact CZ3-CG1 4.24Å; W163-V166 WeakPolarHBondContact O-CG1 3.13Å; W163-V166 PolarHBondContact O-N 2.97Å; V166-A169 PolarHBondContact O-N 3.15Å; V166-L170 WeakPolarHBondContact O-CG 3.35Å; V166-L170 PolarHBondContact O-N 3.05Å
167I98.6Very high97.9Very high6 Ų629 Ų293%0.03114%0.144CC..Hα-helixtrans-63.3-47.2173.3-63.8164.8000109.3W163 V165 A169 L170 L171 L225 M254 L255W163-I167 WeakPolarHBondContact O-CD1 3.27Å; W163-I167 VanDerWaalsContact O-CG1 3.23Å; W163-I167 WeakPolarHBondContact O-CG1 3.49Å; W163-I167 PolarHBondContact O-N 3.47Å; V165-I167 PolarHBondContact O-N 3.18Å; I167-A169 VanDerWaalsContact C-N 3.3Å; I167-A169 PolarHBondContact O-N 3.34Å; I167-L170 WeakPolarHBondContact O-CB 3.29Å; I167-L170 PolarHBondContact O-N 3.03Å; I167-L170 VanDerWaalsContact O-N 3.12Å; I167-L171 WeakPolarHBondContact O-CG 3.33Å; I167-L171 PolarHBondContact O-N 2.9Å; I167-L225 HydrophobicContact CB-CD1 4.45Å; I167-L225 HydrophobicContact CG2-CD1 3.72Å; I167-M254 HydrophobicContact CD1-CB 3.51Å; I167-L255 HydrophobicContact CD1-CD2 3.97Å; I167-L255 HydrophobicContact CD1-CG 4.02Å; I167-L255 HydrophobicContact CG1-CD2 3.9Å; I167-L255 HydrophobicContact CG1-CG 4.5Å
168T98.5Very high98.2Very high0 Ų022.3 Ų22.30%012%0.122CC..Hα-helixtrans-57.9-42.4177-56.80000112.1I52 S164 V165 L170 L171 L172 I222 L225 P226I52-T168 HydrophobicContact CD1-CG2 3.6Å; I52-T168 HydrophobicContact CG1-CG2 4.01Å; S164-T168 WeakPolarHBondContact O-CB 3.36Å; S164-T168 PolarHBondContact O-N 3.07Å; S164-T168 PolarHBondContact O-OG1 3.43Å; V165-T168 WeakPolarHBondContact O-CB 3.33Å; V165-T168 PolarHBondContact O-N 2.84Å; T168-L170 PolarHBondContact O-N 2.87Å; T168-L171 PolarHBondContact O-N 3.02Å; T168-L172 HydrophobicContact CG2-CD1 4.18Å; T168-L172 WeakPolarHBondContact O-CG 3.25Å; T168-L172 PolarHBondContact O-N 3.33Å; T168-I222 HydrophobicContact CG2-CB 3.9Å; T168-I222 HydrophobicContact CG2-CG1 3.98Å; T168-I222 HydrophobicContact CG2-CG2 3.54Å; T168-L225 WeakPolarHBondContact OG1-CB 3.33Å; T168-P226 HydrophobicContact CG2-CG 4.3Å; T168-P226 WeakPolarHBondContact OG1-CD 3.5Å
169A98.6Very high98.3Very high1 Ų122.4 Ų22.41%0.00812%0.123CC..Hα-helixtrans-63.1-39.5176.500000112.4A138 F141 I142 V165 V166 I167 L172 L173A138-A169 HydrophobicContact CB-CB 4.05Å; A138-A169 WeakPolarHBondContact CB-O 3.33Å; F141-A169 HydrophobicContact CB-CB 3.99Å; I142-A169 HydrophobicContact CD1-CB 4.17Å; I142-A169 HydrophobicContact CG1-CB 3.81Å; V165-A169 WeakPolarHBondContact O-CB 3.17Å; V165-A169 PolarHBondContact O-N 3.3Å; V166-A169 PolarHBondContact O-N 3.15Å; I167-A169 VanDerWaalsContact C-N 3.3Å; I167-A169 PolarHBondContact O-N 3.34Å; A169-L172 PolarHBondContact O-N 3.49Å; A169-L173 WeakPolarHBondContact O-CB 3.35Å; A169-L173 PolarHBondContact O-N 3.3Å
170L98.7Very high98.4Very high81 Ų8122.4 Ų22.442%0.42413%0.125SC..Hα-helixtrans-64.4-43.8174.1-71167.9000111.7I142 V166 I167 T168 L173 L174I142-L170 HydrophobicContact CD1-CD2 3.83Å; I142-L170 HydrophobicContact CD1-CG 4.28Å; I142-L170 HydrophobicContact CG1-CD2 4.36Å; V166-L170 WeakPolarHBondContact O-CG 3.35Å; V166-L170 PolarHBondContact O-N 3.05Å; I167-L170 WeakPolarHBondContact O-CB 3.29Å; I167-L170 PolarHBondContact O-N 3.03Å; I167-L170 VanDerWaalsContact O-N 3.12Å; T168-L170 PolarHBondContact O-N 2.87Å; L170-L173 PolarHBondContact O-N 2.81Å; L170-L174 VanDerWaalsContact O-CG 3.31Å; L170-L174 WeakPolarHBondContact O-CG 3.39Å; L170-L174 PolarHBondContact O-N 3.41Å; L170-L174 VanDerWaalsContact O-N 3.15Å
171L98.5Very high98.4Very high8 Ų823.6 Ų23.64%0.04214%0.139CC..Hα-helixtrans-58.9-49.6175.5-62.1-174.2000110.9I167 T168 L173 L174 S175 I222 L225 G258 F262I167-L171 WeakPolarHBondContact O-CG 3.33Å; I167-L171 PolarHBondContact O-N 2.9Å; T168-L171 PolarHBondContact O-N 3.02Å; L171-L173 VanDerWaalsContact C-N 3.33Å; L171-L173 PolarHBondContact O-N 2.74Å; L171-L174 PolarHBondContact O-N 2.92Å; L171-S175 VanDerWaalsContact O-CB 3.28Å; L171-S175 WeakPolarHBondContact O-CB 3.21Å; L171-S175 PolarHBondContact O-N 2.93Å; L171-S175 PolarHBondContact O-OG 3.16Å; L171-I222 HydrophobicContact CB-CD1 3.72Å; L171-I222 HydrophobicContact CB-CG1 3.55Å; L171-I222 HydrophobicContact CD1-CG1 3.98Å; L171-I222 HydrophobicContact CG-CG1 4.4Å; L171-L225 HydrophobicContact CD1-CD1 3.65Å; L171-G258 WeakPolarHBondContact CD2-O 3.37Å; L171-F262 HydrophobicContact CD2-CD2 4.08Å; L171-F262 HydrophobicContact CD2-CE2 3.4Å; L171-F262 HydrophobicContact CD2-CZ 4.19Å
172L98.3Very high98.4Very high1 Ų123.5 Ų23.51%0.00514%0.138CC..Hα-helixtrans-56.9-45.9179.1-77167.6000112M48 A138 T168 A169 L174 L176 I222M48-L172 HydrophobicContact SD-CD2 4.18Å; A138-L172 HydrophobicContact CB-CB 4.07Å; T168-L172 HydrophobicContact CG2-CD1 4.18Å; T168-L172 WeakPolarHBondContact O-CG 3.25Å; T168-L172 PolarHBondContact O-N 3.33Å; A169-L172 PolarHBondContact O-N 3.49Å; L172-L174 VanDerWaalsContact C-N 3.28Å; L172-L174 PolarHBondContact O-N 3.25Å; L172-L176 HydrophobicContact CB-CD1 4.24Å; L172-L176 HydrophobicContact CD2-CD1 3.7Å; L172-L176 HydrophobicContact CD2-CG 4.22Å; L172-L176 VanDerWaalsContact O-CB 3.3Å; L172-L176 WeakPolarHBondContact O-CB 3.4Å; L172-L176 WeakPolarHBondContact O-CG 3.16Å; L172-L176 PolarHBondContact O-N 2.71Å; L172-L176 VanDerWaalsContact O-N 3.11Å; L172-I222 HydrophobicContact CB-CD1 4.45Å; L172-I222 HydrophobicContact CD1-CG2 4.35Å; L172-I222 HydrophobicContact CD2-CD1 3.68Å; L172-I222 HydrophobicContact CD2-CG1 4.35Å; L172-I222 HydrophobicContact CD2-CG2 3.82Å; L172-I222 HydrophobicContact CG-CD1 3.77Å; L172-I222 HydrophobicContact CG-CG1 4.11Å; L172-I222 HydrophobicContact CG-CG2 3.99Å
173L98.1Very high98.4Very high63 Ų6323.6 Ų23.633%0.3314%0.139SC..Hα-helixtrans-64.6-33.7-178.3-174.162.7000112.4I135 A138 V139 I142 A169 L170 L171 P177I135-L173 HydrophobicContact CG2-CD1 4.13Å; A138-L173 HydrophobicContact CB-CB 4.47Å; V139-L173 HydrophobicContact CG2-CD1 3.94Å; I142-L173 HydrophobicContact CD1-CD2 3.93Å; A169-L173 WeakPolarHBondContact O-CB 3.35Å; A169-L173 PolarHBondContact O-N 3.3Å; L170-L173 PolarHBondContact O-N 2.81Å; L171-L173 VanDerWaalsContact C-N 3.33Å; L171-L173 PolarHBondContact O-N 2.74Å; L173-P177 VanDerWaalsContact O-CD 3.3Å; L173-P177 WeakPolarHBondContact O-CD 3.33Å; L173-P177 WeakPolarHBondContact O-CG 3.34Å
174L98.2Very high98.4Very high107 Ų10724.6 Ų24.656%0.5615%0.149SC*.Hα-helixtrans-87-34-179-66.4174.6000113.1L170 L171 L172 F262L170-L174 VanDerWaalsContact O-CG 3.31Å; L170-L174 WeakPolarHBondContact O-CG 3.39Å; L170-L174 PolarHBondContact O-N 3.41Å; L170-L174 VanDerWaalsContact O-N 3.15Å; L171-L174 PolarHBondContact O-N 2.92Å; L172-L174 VanDerWaalsContact C-N 3.28Å; L172-L174 PolarHBondContact O-N 3.25Å; L174-F262 HydrophobicContact CB-CE1 4.3Å; L174-F262 HydrophobicContact CB-CE2 4.24Å; L174-F262 HydrophobicContact CB-CZ 3.62Å; L174-F262 HydrophobicContact CD1-CE2 4.15Å; L174-F262 HydrophobicContact CD1-CZ 4.37Å
175S97.8Very high98.5Very high0 Ų026.5 Ų26.50%016%0.159CC..Hα-helixtrans-89.5-41.1-172.770.50000113.5L171 V178 L179L171-S175 VanDerWaalsContact O-CB 3.28Å; L171-S175 WeakPolarHBondContact O-CB 3.21Å; L171-S175 PolarHBondContact O-N 2.93Å; L171-S175 PolarHBondContact O-OG 3.16Å; S175-V178 WeakPolarHBondContact O-CB 3.35Å; S175-V178 PolarHBondContact O-N 3.22Å; S175-V178 VanDerWaalsContact O-N 3.11Å; S175-L179 PolarHBondContact O-N 3.2Å
176L97.8Very high98.5Very high5 Ų526.6 Ų26.63%0.02616%0.159CC..Hα-helixtrans-63-35.2-174.6-74.9172.7000114.9S134 I135 L172 V178 L179 A180 F215S134-L176 VanDerWaalsContact CB-CD1 3.45Å; I135-L176 HydrophobicContact CD1-CB 3.99Å; I135-L176 HydrophobicContact CG1-CB 3.98Å; I135-L176 HydrophobicContact CG1-CD1 3.86Å; L172-L176 HydrophobicContact CB-CD1 4.24Å; L172-L176 HydrophobicContact CD2-CD1 3.7Å; L172-L176 HydrophobicContact CD2-CG 4.22Å; L172-L176 VanDerWaalsContact O-CB 3.3Å; L172-L176 WeakPolarHBondContact O-CB 3.4Å; L172-L176 WeakPolarHBondContact O-CG 3.16Å; L172-L176 PolarHBondContact O-N 2.71Å; L172-L176 VanDerWaalsContact O-N 3.11Å; L176-V178 PolarHBondContact O-N 2.81Å; L176-L179 HydrophobicContact CD2-CD2 4.35Å; L176-L179 PolarHBondContact O-N 2.88Å; L176-A180 WeakPolarHBondContact O-CB 3.37Å; L176-A180 PolarHBondContact O-N 2.94Å; L176-F215 HydrophobicContact CD2-CD2 4.08Å; L176-F215 HydrophobicContact CD2-CE2 3.48Å; L176-F215 VanDerWaalsContact CD2-CE2 3.48Å; L176-F215 HydrophobicContact CD2-CZ 4.25Å; L176-F215 HydrophobicContact CG-CE2 4.31Å
177P98.5Very high98.5Very high66 Ų6627.2 Ų27.243%0.42916%0.162SC..Hα-helixtrans-58.4-32.8173.9-27.136.7000113.2L173 G181L173-P177 VanDerWaalsContact O-CD 3.3Å; L173-P177 WeakPolarHBondContact O-CD 3.33Å; L173-P177 WeakPolarHBondContact O-CG 3.34Å; P177-G181 PolarHBondContact O-N 3.14Å
178V98.6Very high98.5Very high37 Ų3728.2 Ų28.222%0.22417%0.168CC..Hα-helixtrans-70.7-43.3178.3-175.90000110.9S175 L176 G181 A182 L211 F214S175-V178 WeakPolarHBondContact O-CB 3.35Å; S175-V178 PolarHBondContact O-N 3.22Å; S175-V178 VanDerWaalsContact O-N 3.11Å; L176-V178 PolarHBondContact O-N 2.81Å; V178-G181 PolarHBondContact O-N 3.5Å; V178-A182 PolarHBondContact O-N 2.97Å; V178-L211 HydrophobicContact CG1-CB 4.21Å; V178-L211 HydrophobicContact CG1-CD2 3.91Å; V178-L211 WeakPolarHBondContact CG1-O 3.42Å; V178-F214 HydrophobicContact CB-CD1 3.99Å; V178-F214 HydrophobicContact CG1-CB 4.38Å; V178-F214 HydrophobicContact CG1-CD1 3.88Å; V178-F214 HydrophobicContact CG1-CG 4.48Å; V178-F214 HydrophobicContact CG2-CD1 3.69Å; V178-F214 HydrophobicContact CG2-CE1 3.77Å
179L98.4Very high98.5Very high6 Ų629.4 Ų29.43%0.03118%0.175CC..Hα-helixtrans-58.1-51.5171.8177.266.9000110.8S175 L176 G181 A182 I183 F212 F215S175-L179 PolarHBondContact O-N 3.2Å; L176-L179 HydrophobicContact CD2-CD2 4.35Å; L176-L179 PolarHBondContact O-N 2.88Å; L179-G181 PolarHBondContact O-N 3.07Å; L179-A182 WeakPolarHBondContact O-CB 3.29Å; L179-A182 PolarHBondContact O-N 3.04Å; L179-I183 HydrophobicContact CD1-CG2 3.92Å; L179-I183 HydrophobicContact CG-CD1 4.5Å; L179-I183 HydrophobicContact CG-CG2 4.46Å; L179-I183 WeakPolarHBondContact O-CG1 3.48Å; L179-I183 PolarHBondContact O-N 3.44Å; L179-F212 HydrophobicContact CD1-CD2 3.99Å; L179-F212 HydrophobicContact CD1-CE2 4.15Å; L179-F215 HydrophobicContact CB-CB 3.91Å; L179-F215 HydrophobicContact CB-CD1 3.88Å; L179-F215 HydrophobicContact CB-CD2 3.93Å; L179-F215 HydrophobicContact CB-CE1 4.44Å; L179-F215 HydrophobicContact CB-CE2 4.49Å; L179-F215 HydrophobicContact CB-CG 3.6Å; L179-F215 HydrophobicContact CD1-CD1 3.79Å; L179-F215 HydrophobicContact CD1-CE1 4.12Å; L179-F215 HydrophobicContact CD1-CG 4.39Å; L179-F215 HydrophobicContact CD2-CD1 3.92Å; L179-F215 HydrophobicContact CD2-CD2 4.34Å; L179-F215 HydrophobicContact CD2-CE1 3.64Å; L179-F215 HydrophobicContact CD2-CE2 4.09Å; L179-F215 HydrophobicContact CD2-CG 4.27Å; L179-F215 HydrophobicContact CD2-CZ 3.72Å; L179-F215 HydrophobicContact CG-CD1 4.06Å; L179-F215 HydrophobicContact CG-CE1 4.27Å; L179-F215 HydrophobicContact CG-CG 4.28Å
180A98.6Very high98.4Very high33 Ų3330.8 Ų30.827%0.27318%0.18SC..Hα-helixtrans-56-41.7-179.400000111.4L176 T184L176-A180 WeakPolarHBondContact O-CB 3.37Å; L176-A180 PolarHBondContact O-N 2.94Å; A180-T184 WeakPolarHBondContact O-CB 3.28Å; A180-T184 PolarHBondContact O-N 3.41Å; A180-T184 PolarHBondContact O-OG1 3.24Å
181G98.8Very high98.4Very high29 Ų2930.9 Ų30.930%0.29918%0.181SC..Hα-helixtrans-59.3-50.2171.800000112.7P177 V178 L179 I183 T184 M185P177-G181 PolarHBondContact O-N 3.14Å; V178-G181 PolarHBondContact O-N 3.5Å; L179-G181 PolarHBondContact O-N 3.07Å; G181-I183 PolarHBondContact O-N 3.46Å; G181-T184 PolarHBondContact O-N 3.32Å; G181-M185 WeakPolarHBondContact O-CE 3.31Å; G181-M185 WeakPolarHBondContact O-CG 3.42Å; G181-M185 PolarHBondContact O-N 2.88Å
182A98.8Very high98.4Very high0 Ų036.3 Ų36.30%021%0.209CC..Hα-helixtrans-58-50179.900000112.7V178 L179 M185 L186 Y208 L211V178-A182 PolarHBondContact O-N 2.97Å; L179-A182 WeakPolarHBondContact O-CB 3.29Å; L179-A182 PolarHBondContact O-N 3.04Å; A182-M185 PolarHBondContact O-N 3.33Å; A182-L186 PolarHBondContact O-N 2.91Å; A182-Y208 HydrophobicContact CB-CE2 4.31Å; A182-L211 HydrophobicContact CB-CB 3.73Å; A182-L211 HydrophobicContact CB-CD1 4.13Å
183I98.7Very high98.3Very high1 Ų143.9 Ų43.91%0.00525%0.249CC..Hα-helixtrans-75.2-25.3-178.265.6175.7000112.3I124 L127 H128 L179 G181 L187I124-I183 HydrophobicContact CG1-CB 4.36Å; I124-I183 HydrophobicContact CG2-CB 4.06Å; I124-I183 HydrophobicContact CG2-CD1 4.25Å; I124-I183 HydrophobicContact CG2-CG1 4.19Å; L127-I183 HydrophobicContact CB-CD1 3.84Å; H128-I183 VanDerWaalsContact CE1-CG1 3.42Å; H128-I183 WeakPolarHBondContact CE1-CG1 3.49Å; L179-I183 HydrophobicContact CD1-CG2 3.92Å; L179-I183 HydrophobicContact CG-CD1 4.5Å; L179-I183 HydrophobicContact CG-CG2 4.46Å; L179-I183 WeakPolarHBondContact O-CG1 3.48Å; L179-I183 PolarHBondContact O-N 3.44Å; G181-I183 PolarHBondContact O-N 3.46Å; I183-L187 WeakPolarHBondContact O-CB 3.26Å; I183-L187 PolarHBondContact O-N 3.13Å
184T98.8Very high98.3Very high59 Ų5943.2 Ų43.236%0.36225%0.248SC..Hα-helixtrans-68.9-47169.4-62.50000110.9H128 A180 G181 L186 L187 T188H128-T184 PolarHBondContact NE2-OG1 3.43Å; A180-T184 WeakPolarHBondContact O-CB 3.28Å; A180-T184 PolarHBondContact O-N 3.41Å; A180-T184 PolarHBondContact O-OG1 3.24Å; G181-T184 PolarHBondContact O-N 3.32Å; T184-L186 PolarHBondContact O-N 3.25Å; T184-L187 WeakPolarHBondContact O-CB 3.29Å; T184-L187 PolarHBondContact O-N 3.49Å; T184-L187 VanDerWaalsContact O-N 3.08Å; T184-T188 HydrophobicContact CG2-CG2 4.5Å; T184-T188 WeakPolarHBondContact O-CG2 3.49Å; T184-T188 PolarHBondContact O-N 2.95Å; T184-T188 PolarHBondContact O-OG1 2.58Å
185M98.8Very high98.3Very high41 Ų4140.4 Ų40.420%0.20224%0.237CC..Hα-helixtrans-57.7-39.2174.8-75.6-177.4-79.100111.3G181 A182 T188 D189 F196 F197 L211G181-M185 WeakPolarHBondContact O-CE 3.31Å; G181-M185 WeakPolarHBondContact O-CG 3.42Å; G181-M185 PolarHBondContact O-N 2.88Å; A182-M185 PolarHBondContact O-N 3.33Å; M185-T188 PolarHBondContact O-N 2.97Å; M185-T188 PolarHBondContact O-OG1 3.32Å; M185-D189 PolarHBondContact O-N 3.33Å; M185-F196 HydrophobicContact CB-CB 4.18Å; M185-F196 HydrophobicContact CB-CD1 4.49Å; M185-F196 HydrophobicContact CB-CD2 3.71Å; M185-F196 HydrophobicContact CB-CE2 4.2Å; M185-F196 HydrophobicContact CB-CG 3.88Å; M185-F196 HydrophobicContact CG-CD1 4.01Å; M185-F196 HydrophobicContact CG-CD2 3.77Å; M185-F196 HydrophobicContact CG-CE1 4.07Å; M185-F196 HydrophobicContact CG-CE2 3.84Å; M185-F196 HydrophobicContact CG-CG 3.87Å; M185-F196 HydrophobicContact CG-CZ 3.99Å; M185-F196 HydrophobicContact SD-CB 4.47Å; M185-F196 HydrophobicContact SD-CD1 3.56Å; M185-F196 VanDerWaalsContact SD-CD1 3.56Å; M185-F196 HydrophobicContact SD-CD2 4.41Å; M185-F196 HydrophobicContact SD-CE1 3.78Å; M185-F196 HydrophobicContact SD-CG 3.91Å; M185-F196 HydrophobicContact SD-CZ 4.3Å; M185-F197 HydrophobicContact CB-CE2 3.61Å; M185-F197 HydrophobicContact CB-CZ 3.7Å; M185-F197 HydrophobicContact CE-CZ 4.35Å; M185-F197 HydrophobicContact SD-CZ 4.42Å; M185-L211 HydrophobicContact CE-CD1 3.34Å
186L98.8Very high98.3Very high1 Ų144.7 Ų44.71%0.00526%0.256CS..Hα-helixtrans-66.4-42.6175.4177.963.2000111.2V105 P107 S110 I124 A182 T184 T188 D189 R190 F197 Y208V105-L186 HydrophobicContact CG1-CD2 3.8Å; P107-L186 HydrophobicContact CB-CD1 4.14Å; P107-L186 HydrophobicContact CG-CD1 4.43Å; S110-L186 WeakPolarHBondContact OG-CD2 3.49Å; I124-L186 HydrophobicContact CD1-CD2 4.04Å; I124-L186 HydrophobicContact CD1-CG 4.18Å; A182-L186 PolarHBondContact O-N 2.91Å; T184-L186 PolarHBondContact O-N 3.25Å; L186-T188 VanDerWaalsContact C-N 3.28Å; L186-T188 PolarHBondContact O-N 3.41Å; L186-D189 PolarHBondContact O-N 2.82Å; L186-R190 HydrophobicContact CD1-CG 4.38Å; L186-R190 WeakPolarHBondContact O-CB 3.27Å; L186-R190 VanDerWaalsContact O-CG 3.23Å; L186-R190 WeakPolarHBondContact O-CG 3.33Å; L186-R190 PolarHBondContact O-N 3.46Å; L186-F197 HydrophobicContact CB-CD2 4.35Å; L186-F197 HydrophobicContact CB-CE2 4.03Å; L186-F197 HydrophobicContact CD1-CD2 4.4Å; L186-Y208 HydrophobicContact CB-CE2 4.11Å; L186-Y208 HydrophobicContact CD2-CE2 3.92Å
187L98.7Very high98.3Very high27 Ų2744.6 Ų44.614%0.14126%0.256CS..Hα-helixtrans-60.6-39.3176.7-171.569.8000111.5D121 I124 F125 I183 T184 R190 N191D121-L187 HydrophobicContact CB-CD1 3.88Å; D121-L187 WeakPolarHBondContact OD1-CD1 3.3Å; I124-L187 HydrophobicContact CD1-CB 4.25Å; I124-L187 HydrophobicContact CD1-CD1 4.2Å; I124-L187 HydrophobicContact CG2-CB 4.24Å; I124-L187 HydrophobicContact CG2-CD1 4.31Å; I124-L187 HydrophobicContact CG2-CD2 4.36Å; F125-L187 HydrophobicContact CE1-CD2 3.84Å; F125-L187 HydrophobicContact CZ-CD1 4.5Å; F125-L187 HydrophobicContact CZ-CD2 3.89Å; I183-L187 WeakPolarHBondContact O-CB 3.26Å; I183-L187 PolarHBondContact O-N 3.13Å; T184-L187 WeakPolarHBondContact O-CB 3.29Å; T184-L187 PolarHBondContact O-N 3.49Å; T184-L187 VanDerWaalsContact O-N 3.08Å; L187-R190 PolarHBondContact O-N 3.18Å; L187-N191 WeakPolarHBondContact CD1-ND2 3.33Å; L187-N191 WeakPolarHBondContact O-CB 3.27Å; L187-N191 PolarHBondContact O-N 3.49Å; L187-N191 PolarHBondContact O-ND2 3.21Å
188T98.5Very high98.3Very high27 Ų2744.4 Ų44.417%0.16625%0.251CS..Hα-helixtrans-72.7-35.8176.662.40000112.3T184 M185 L186 R190 N191 L192 N193 T194T184-T188 HydrophobicContact CG2-CG2 4.5Å; T184-T188 WeakPolarHBondContact O-CG2 3.49Å; T184-T188 PolarHBondContact O-N 2.95Å; T184-T188 PolarHBondContact O-OG1 2.58Å; M185-T188 PolarHBondContact O-N 2.97Å; M185-T188 PolarHBondContact O-OG1 3.32Å; L186-T188 VanDerWaalsContact C-N 3.28Å; L186-T188 PolarHBondContact O-N 3.41Å; T188-R190 VanDerWaalsContact C-N 3.25Å; T188-R190 PolarHBondContact O-N 2.73Å; T188-N191 PolarHBondContact O-N 2.85Å; T188-L192 HydrophobicContact CG2-CD1 3.89Å; T188-L192 CarbonylContact O-C 3.51Å; T188-L192 WeakPolarHBondContact O-CA 3.41Å; T188-L192 WeakPolarHBondContact O-CB 3.44Å; T188-L192 PolarHBondContact O-N 3.49Å; T188-N193 PolarHBondContact O-N 3.11Å; T188-T194 WeakPolarHBondContact CB-OG1 3.3Å; T188-T194 PolarHBondContact O-OG1 3.5Å; T188-T194 PolarHBondContact OG1-OG1 2.9Å
189D98.4Very high98.2Very high25 Ų2546.6 Ų46.613%0.13427%0.266CS..Hα-helixtrans-62.8-37.4173.4-83.412.4000110.7M185 L186 T194 S195 F196 F197M185-D189 PolarHBondContact O-N 3.33Å; L186-D189 PolarHBondContact O-N 2.82Å; D189-T194 VanDerWaalsContact CA-OG1 3.32Å; D189-T194 WeakPolarHBondContact CA-OG1 3.45Å; D189-T194 PolarHBondContact N-OG1 3.44Å; D189-T194 WeakPolarHBondContact OD1-CB 3.26Å; D189-T194 VanDerWaalsContact OD1-O 3.13Å; D189-T194 PolarHBondContact OD1-OG1 3.05Å; D189-S195 WeakPolarHBondContact OD1-CA 3.43Å; D189-S195 PolarHBondContact OD1-N 2.93Å; D189-S195 VanDerWaalsContact OD1-N 3.12Å; D189-F196 VanDerWaalsContact CG-N 3.33Å; D189-F196 WeakPolarHBondContact OD1-CD2 3.33Å; D189-F196 PolarHBondContact OD1-N 3.22Å; D189-F196 PolarHBondContact OD2-N 3Å; D189-F197 PolarHBondContact OD2-N 3.37Å
190R97.9Very high98.1Very high30 Ų3050.8 Ų50.811%0.11330%0.301CS..Hα-helixtrans-71-38.6177.4-70.8173.659.465.515113.8S110 A111 H115 G117 D121 L186 L187 T188S110-R190 WeakPolarHBondContact O-CD 3.16Å; S110-R190 PolarHBondContact O-NH1 3.48Å; A111-R190 VanDerWaalsContact C-NH1 3.34Å; A111-R190 PolarHBondContact O-NH1 2.92Å; H115-R190 PolarHBondContact O-NH1 2.92Å; H115-R190 PolarHBondContact O-NH2 3.12Å; G117-R190 PolarHBondContact O-NH2 3.46Å; D121-R190 IonicContact OD1-CZ 3.53Å; D121-R190 IonicContact OD1-NE 2.78Å; D121-R190 PolarHBondContact OD1-NE 3.45Å; D121-R190 IonicContact OD1-NH2 3.35Å; D121-R190 IonicContact OD2-NE 3.99Å; D121-R190 IonicContact OD2-NH2 3.59Å; D121-R190 PolarHBondContact OD2-NH2 3.01Å; L186-R190 HydrophobicContact CD1-CG 4.38Å; L186-R190 WeakPolarHBondContact O-CB 3.27Å; L186-R190 VanDerWaalsContact O-CG 3.23Å; L186-R190 WeakPolarHBondContact O-CG 3.33Å; L186-R190 PolarHBondContact O-N 3.46Å; L187-R190 PolarHBondContact O-N 3.18Å; T188-R190 VanDerWaalsContact C-N 3.25Å; T188-R190 PolarHBondContact O-N 2.73Å
191N98.3Very high97.9Very high83 Ų8351.3 Ų51.344%0.44431%0.31SS..Hα-helixtrans-120.4-20.3-163.3-65-78.9000115.2D121 L187 T188D121-N191 PolarHBondContact OD1-ND2 2.87Å; L187-N191 WeakPolarHBondContact CD1-ND2 3.33Å; L187-N191 WeakPolarHBondContact O-CB 3.27Å; L187-N191 PolarHBondContact O-N 3.49Å; L187-N191 PolarHBondContact O-ND2 3.21Å; T188-N191 PolarHBondContact O-N 2.85Å
192L97.9Very high97.8Very high121 Ų12153.3 Ų53.363%0.63433%0.331SS*.SBendtrans-122.815.2-171.7-58.4-177.4000113.3T188 T194T188-L192 HydrophobicContact CG2-CD1 3.89Å; T188-L192 CarbonylContact O-C 3.51Å; T188-L192 WeakPolarHBondContact O-CA 3.41Å; T188-L192 WeakPolarHBondContact O-CB 3.44Å; T188-L192 PolarHBondContact O-N 3.49Å; L192-T194 PolarHBondContact O-N 3.36Å
193N96.1Very high97.8Very high160 Ų16054 Ų5486%0.85634%0.338SS*.  trans54.933.1179.2-56.1-53.5000113.8T188T188-N193 PolarHBondContact O-N 3.11Å
194T98.1Very high97.8Very high50 Ų5057.5 Ų57.531%0.30736%0.357SS..  trans-79.4167.8164.6630000110.1T188 D189 L192 F196T188-T194 WeakPolarHBondContact CB-OG1 3.3Å; T188-T194 PolarHBondContact O-OG1 3.5Å; T188-T194 PolarHBondContact OG1-OG1 2.9Å; D189-T194 VanDerWaalsContact CA-OG1 3.32Å; D189-T194 WeakPolarHBondContact CA-OG1 3.45Å; D189-T194 PolarHBondContact N-OG1 3.44Å; D189-T194 WeakPolarHBondContact OD1-CB 3.26Å; D189-T194 VanDerWaalsContact OD1-O 3.13Å; D189-T194 PolarHBondContact OD1-OG1 3.05Å; L192-T194 PolarHBondContact O-N 3.36Å; T194-F196 HydrophobicContact CG2-CE2 4.27Å
195S97.8Very high97.7Very high48 Ų4856 Ų5634%0.33635%0.348SS..  trans-138.950.5-177.8600000112.2D189 F197 G201 G203D189-S195 WeakPolarHBondContact OD1-CA 3.43Å; D189-S195 PolarHBondContact OD1-N 2.93Å; D189-S195 VanDerWaalsContact OD1-N 3.12Å; S195-F197 VanDerWaalsContact C-N 3.35Å; S195-G201 PolarHBondContact OG-O 2.7Å; S195-G203 VanDerWaalsContact O-CA 3.25Å; S195-G203 WeakPolarHBondContact O-CA 3.32Å; S195-G203 PolarHBondContact O-N 2.91Å
196F98.6Very high97.7Very high90 Ų9056.6 Ų56.640%0.39535%0.352SS..SBendtrans-64-40.9175.8-71.9-77.1000112M185 D189 T194 G203 D204M185-F196 HydrophobicContact CB-CB 4.18Å; M185-F196 HydrophobicContact CB-CD1 4.49Å; M185-F196 HydrophobicContact CB-CD2 3.71Å; M185-F196 HydrophobicContact CB-CE2 4.2Å; M185-F196 HydrophobicContact CB-CG 3.88Å; M185-F196 HydrophobicContact CG-CD1 4.01Å; M185-F196 HydrophobicContact CG-CD2 3.77Å; M185-F196 HydrophobicContact CG-CE1 4.07Å; M185-F196 HydrophobicContact CG-CE2 3.84Å; M185-F196 HydrophobicContact CG-CG 3.87Å; M185-F196 HydrophobicContact CG-CZ 3.99Å; M185-F196 HydrophobicContact SD-CB 4.47Å; M185-F196 HydrophobicContact SD-CD1 3.56Å; M185-F196 VanDerWaalsContact SD-CD1 3.56Å; M185-F196 HydrophobicContact SD-CD2 4.41Å; M185-F196 HydrophobicContact SD-CE1 3.78Å; M185-F196 HydrophobicContact SD-CG 3.91Å; M185-F196 HydrophobicContact SD-CZ 4.3Å; D189-F196 VanDerWaalsContact CG-N 3.33Å; D189-F196 WeakPolarHBondContact OD1-CD2 3.33Å; D189-F196 PolarHBondContact OD1-N 3.22Å; D189-F196 PolarHBondContact OD2-N 3Å; T194-F196 HydrophobicContact CG2-CE2 4.27Å; F196-G203 WeakPolarHBondContact O-CA 3.39Å; F196-D204 PolarHBondContact O-N 2.96Å; F196-D204 VanDerWaalsContact O-N 3.11Å
197F98.4Very high97.7Very high3 Ų360 Ų601%0.01337%0.369CS..SBendtrans-118.1-2.8-173.4-49-56.3000113.6P107 M185 L186 D189 S195 P199 P205 L207 Y208 L211P107-F197 HydrophobicContact CB-CB 3.95Å; P107-F197 HydrophobicContact CG-CB 3.56Å; P107-F197 HydrophobicContact CG-CD2 4.06Å; P107-F197 HydrophobicContact CG-CG 3.84Å; M185-F197 HydrophobicContact CB-CE2 3.61Å; M185-F197 HydrophobicContact CB-CZ 3.7Å; M185-F197 HydrophobicContact CE-CZ 4.35Å; M185-F197 HydrophobicContact SD-CZ 4.42Å; L186-F197 HydrophobicContact CB-CD2 4.35Å; L186-F197 HydrophobicContact CB-CE2 4.03Å; L186-F197 HydrophobicContact CD1-CD2 4.4Å; D189-F197 PolarHBondContact OD2-N 3.37Å; S195-F197 VanDerWaalsContact C-N 3.35Å; F197-P199 WeakPolarHBondContact O-CD 3.28Å; F197-P205 VanDerWaalsContact O-CD 3.23Å; F197-P205 WeakPolarHBondContact O-CD 3.23Å; F197-P205 VanDerWaalsContact O-CG 3.29Å; F197-P205 WeakPolarHBondContact O-CG 3.3Å; F197-L207 HydrophobicContact CD1-CB 4.35Å; F197-L207 HydrophobicContact CE1-CB 4.29Å; F197-L207 HydrophobicContact CE1-CD2 4.14Å; F197-L207 HydrophobicContact CE1-CG 4.06Å; F197-Y208 HydrophobicContact CD2-CD2 4.04Å; F197-Y208 HydrophobicContact CE1-CD2 4.19Å; F197-Y208 HydrophobicContact CE1-CG 4.44Å; F197-Y208 AromaticContact CE2-CD2 3.62Å; F197-Y208 HydrophobicContact CE2-CD2 3.62Å; F197-Y208 HydrophobicContact CE2-CE2 4.42Å; F197-Y208 HydrophobicContact CG-CD2 4.48Å; F197-Y208 AromaticContact CZ-CD2 3.7Å; F197-Y208 HydrophobicContact CZ-CD2 3.7Å; F197-Y208 HydrophobicContact CZ-CG 4.38Å; F197-L211 HydrophobicContact CE1-CD1 4.25Å; F197-L211 HydrophobicContact CZ-CD1 4.28Å
198D97.3Very high97.7Very high61 Ų6158.7 Ų58.733%0.32636%0.362SS..  trans-89.7112.7178.1-178.24.4000111.6A200 G201 G202 G203D198-A200 PolarHBondContact O-N 3.17Å; D198-A200 WeakPolarHBondContact OD1-CB 3.36Å; D198-A200 PolarHBondContact OD1-N 3.39Å; D198-G201 CarbonylContact O-C 3.6Å; D198-G201 PolarHBondContact O-N 2.86Å; D198-G202 PolarHBondContact O-N 3.39Å; D198-G203 WeakPolarHBondContact O-CA 3.34Å; D198-G203 PolarHBondContact O-N 3.32Å
199P96.8Very high97.7Very high83 Ų8359.1 Ų59.154%0.53936%0.362SS..G310 helixtrans-58.2-28177-24.635.6000114.5F197 G201 G202 G203 P205F197-P199 WeakPolarHBondContact O-CD 3.28Å; P199-G201 PolarHBondContact O-N 3.28Å; P199-G202 PolarHBondContact O-N 3.34Å; P199-G202 VanDerWaalsContact O-N 3.07Å; P199-G203 WeakPolarHBondContact CA-O 3.17Å; P199-P205 HydrophobicContact CG-CG 4.09Å
200A95.5Very high97.7Very high94 Ų9461 Ų6178%0.77737%0.371SS*.G310 helixtrans-65.5-2817800000112.3D198D198-A200 PolarHBondContact O-N 3.17Å; D198-A200 WeakPolarHBondContact OD1-CB 3.36Å; D198-A200 PolarHBondContact OD1-N 3.39Å
201G95.6Very high97.7Very high44 Ų4461.4 Ų61.445%0.45437%0.374SS..G310 helixtrans-99.610.8172.500000114.1S195 D198 P199S195-G201 PolarHBondContact OG-O 2.7Å; D198-G201 CarbonylContact O-C 3.6Å; D198-G201 PolarHBondContact O-N 2.86Å; P199-G201 PolarHBondContact O-N 3.28Å
202G96.8Very high97.7Very high72 Ų7257.7 Ų57.774%0.74235%0.354SS*.THydrogen-bonded Turntrans84.78.5-179.300000115.7D198 P199D198-G202 PolarHBondContact O-N 3.39Å; P199-G202 PolarHBondContact O-N 3.34Å; P199-G202 VanDerWaalsContact O-N 3.07Å
203G97.9Very high97.8Very high15 Ų1552.9 Ų52.916%0.15533%0.328CS..  trans-76.8172.1173.300000113.4S195 F196 D198 P199S195-G203 VanDerWaalsContact O-CA 3.25Å; S195-G203 WeakPolarHBondContact O-CA 3.32Å; S195-G203 PolarHBondContact O-N 2.91Å; F196-G203 WeakPolarHBondContact O-CA 3.39Å; D198-G203 WeakPolarHBondContact O-CA 3.34Å; D198-G203 PolarHBondContact O-N 3.32Å; P199-G203 WeakPolarHBondContact CA-O 3.17Å
204D98.1Very high97.9Very high74 Ų7448.1 Ų48.140%0.39630%0.3SS..  trans-134.5114.8-179-176.95.4000111.7F196 I206 L207F196-D204 PolarHBondContact O-N 2.96Å; F196-D204 VanDerWaalsContact O-N 3.11Å; D204-I206 PolarHBondContact O-N 2.98Å; D204-I206 VanDerWaalsContact OD1-CB 3.31Å; D204-I206 WeakPolarHBondContact OD1-CB 3.43Å; D204-I206 PolarHBondContact OD1-N 3.24Å; D204-L207 HydrophobicContact CB-CB 4.3Å; D204-L207 VanDerWaalsContact O-CB 3.22Å; D204-L207 WeakPolarHBondContact O-CB 3.47Å; D204-L207 PolarHBondContact O-N 3.13Å
205P97.6Very high97.9Very high26 Ų2645.8 Ų45.817%0.16929%0.285CS..Hα-helixtrans-57.5-25.9172.4-24.432.9000114.2F197 P199 L207 Y208 Q209F197-P205 VanDerWaalsContact O-CD 3.23Å; F197-P205 WeakPolarHBondContact O-CD 3.23Å; F197-P205 VanDerWaalsContact O-CG 3.29Å; F197-P205 WeakPolarHBondContact O-CG 3.3Å; P199-P205 HydrophobicContact CG-CG 4.09Å; P205-L207 VanDerWaalsContact C-N 3.31Å; P205-Y208 WeakPolarHBondContact O-CB 3.11Å; P205-Y208 PolarHBondContact O-N 3.05Å; P205-Q209 PolarHBondContact O-N 2.91Å
206I98.3Very high97.9Very high55 Ų5543.5 Ų43.528%0.28227%0.269SS..Hα-helixtrans-70.2-29.7177-59.1174.5000110.8D204 Y208 Q209 H210 M269 V272D204-I206 PolarHBondContact O-N 2.98Å; D204-I206 VanDerWaalsContact OD1-CB 3.31Å; D204-I206 WeakPolarHBondContact OD1-CB 3.43Å; D204-I206 PolarHBondContact OD1-N 3.24Å; I206-Y208 VanDerWaalsContact C-N 3.27Å; I206-Y208 PolarHBondContact O-N 3.21Å; I206-Q209 WeakPolarHBondContact O-CB 3.03Å; I206-Q209 PolarHBondContact O-N 3.09Å; I206-Q209 VanDerWaalsContact O-N 3.07Å; I206-H210 PolarHBondContact O-CD2 2.88Å; I206-H210 PolarHBondContact O-N 3.45Å; I206-M269 HydrophobicContact CG2-CE 3.72Å; I206-V272 HydrophobicContact CD1-CB 4.35Å; I206-V272 HydrophobicContact CG2-CG2 4.12Å
207L98.6Very high97.8Very high71 Ų7139.8 Ų39.837%0.37225%0.253SS..Hα-helixtrans-57.3-43170.6177.562.7000111F197 D204 P205 Q209 H210 L211F197-L207 HydrophobicContact CD1-CB 4.35Å; F197-L207 HydrophobicContact CE1-CB 4.29Å; F197-L207 HydrophobicContact CE1-CD2 4.14Å; F197-L207 HydrophobicContact CE1-CG 4.06Å; D204-L207 HydrophobicContact CB-CB 4.3Å; D204-L207 VanDerWaalsContact O-CB 3.22Å; D204-L207 WeakPolarHBondContact O-CB 3.47Å; D204-L207 PolarHBondContact O-N 3.13Å; P205-L207 VanDerWaalsContact C-N 3.31Å; L207-Q209 VanDerWaalsContact C-N 3.3Å; L207-Q209 PolarHBondContact O-N 3.43Å; L207-H210 PolarHBondContact O-N 3.01Å; L207-L211 HydrophobicContact CD1-CD1 4.33Å; L207-L211 HydrophobicContact CD1-CG 4.34Å; L207-L211 HydrophobicContact CG-CD1 4.12Å; L207-L211 WeakPolarHBondContact O-CG 3.46Å; L207-L211 PolarHBondContact O-N 3.17Å
208Y98.7Very high97.8Very high0 Ų039.6 Ų39.60%025%0.252CS..Hα-helixtrans-58.3-44.8175.2-174.5-79.4000110.9T104 Y106 P107 A182 L186 F197 P205 I206 H210 L211 F212T104-Y208 WeakPolarHBondContact O-CE1 3.33Å; T104-Y208 PolarHBondContact O-OH 3.19Å; Y106-Y208 AromaticContact CD1-CD1 3.55Å; Y106-Y208 HydrophobicContact CD1-CD1 3.55Å; Y106-Y208 AromaticContact CD1-CE1 3.64Å; Y106-Y208 HydrophobicContact CD1-CE1 3.64Å; Y106-Y208 HydrophobicContact CE1-CD1 4.02Å; Y106-Y208 HydrophobicContact CE1-CE1 4.11Å; P107-Y208 HydrophobicContact CG-CD2 4Å; P107-Y208 HydrophobicContact CG-CG 3.85Å; A182-Y208 HydrophobicContact CB-CE2 4.31Å; L186-Y208 HydrophobicContact CB-CE2 4.11Å; L186-Y208 HydrophobicContact CD2-CE2 3.92Å; F197-Y208 HydrophobicContact CD2-CD2 4.04Å; F197-Y208 HydrophobicContact CE1-CD2 4.19Å; F197-Y208 HydrophobicContact CE1-CG 4.44Å; F197-Y208 AromaticContact CE2-CD2 3.62Å; F197-Y208 HydrophobicContact CE2-CD2 3.62Å; F197-Y208 HydrophobicContact CE2-CE2 4.42Å; F197-Y208 HydrophobicContact CG-CD2 4.48Å; F197-Y208 AromaticContact CZ-CD2 3.7Å; F197-Y208 HydrophobicContact CZ-CD2 3.7Å; F197-Y208 HydrophobicContact CZ-CG 4.38Å; P205-Y208 WeakPolarHBondContact O-CB 3.11Å; P205-Y208 PolarHBondContact O-N 3.05Å; I206-Y208 VanDerWaalsContact C-N 3.27Å; I206-Y208 PolarHBondContact O-N 3.21Å; Y208-H210 VanDerWaalsContact C-N 3.35Å; Y208-H210 PolarHBondContact O-N 3.3Å; Y208-L211 PolarHBondContact O-N 3.05Å; Y208-F212 HydrophobicContact CD1-CB 4.09Å; Y208-F212 HydrophobicContact CE1-CB 3.75Å; Y208-F212 AromaticContact CE1-CD2 3.97Å; Y208-F212 HydrophobicContact CE1-CD2 3.97Å; Y208-F212 HydrophobicContact CE1-CG 4.1Å; Y208-F212 VanDerWaalsContact O-CB 3.28Å; Y208-F212 WeakPolarHBondContact O-CB 3.49Å; Y208-F212 PolarHBondContact O-N 3.18Å
209Q98.6Very high97.8Very high36 Ų3636.8 Ų36.817%0.16824%0.237CC..Hα-helixtrans-61.6-42.1179.5-61.3-168.838.200112.1Y106 P205 I206 L207 F212 W213 M269Y106-Q209 HydrophobicContact CD1-CG 4.23Å; Y106-Q209 HydrophobicContact CE1-CB 4.43Å; Y106-Q209 HydrophobicContact CE1-CG 3.81Å; Y106-Q209 HydrophobicContact CE2-CG 4.15Å; P205-Q209 PolarHBondContact O-N 2.91Å; I206-Q209 WeakPolarHBondContact O-CB 3.03Å; I206-Q209 PolarHBondContact O-N 3.09Å; I206-Q209 VanDerWaalsContact O-N 3.07Å; L207-Q209 VanDerWaalsContact C-N 3.3Å; L207-Q209 PolarHBondContact O-N 3.43Å; Q209-F212 PolarHBondContact O-N 3.37Å; Q209-W213 WeakPolarHBondContact O-CB 3.44Å; Q209-W213 PolarHBondContact O-N 2.95Å; Q209-M269 HydrophobicContact CB-CE 3.6Å; Q209-M269 HydrophobicContact CB-CG 4.35Å; Q209-M269 HydrophobicContact CB-SD 3.99Å
210H98.6Very high97.8Very high66 Ų6635.7 Ų35.731%0.30623%0.229SC..Hα-helixtrans-59.9-48.3175.4-80-65.1000111.6I206 L207 Y208 F214 W265 M269I206-H210 PolarHBondContact O-CD2 2.88Å; I206-H210 PolarHBondContact O-N 3.45Å; L207-H210 PolarHBondContact O-N 3.01Å; Y208-H210 VanDerWaalsContact C-N 3.35Å; Y208-H210 PolarHBondContact O-N 3.3Å; H210-F214 WeakPolarHBondContact O-CB 3.49Å; H210-F214 PolarHBondContact O-N 3.27Å; H210-W265 AromaticContact ND1-NE1 3.75Å; H210-M269 HydrophobicContact CB-CE 4.44Å; H210-M269 VanDerWaalsContact CE1-CE 3.43Å; H210-M269 WeakPolarHBondContact CE1-CE 3.23Å; H210-M269 WeakPolarHBondContact NE2-CE 3.41Å
211L98.7Very high97.9Very high37 Ų3734.3 Ų34.319%0.19420%0.204CC..Hα-helixtrans-65.2-44.7-179.7-63168.1000111.7V178 A182 M185 F197 L207 Y208 F215V178-L211 HydrophobicContact CG1-CB 4.21Å; V178-L211 HydrophobicContact CG1-CD2 3.91Å; V178-L211 WeakPolarHBondContact CG1-O 3.42Å; A182-L211 HydrophobicContact CB-CB 3.73Å; A182-L211 HydrophobicContact CB-CD1 4.13Å; M185-L211 HydrophobicContact CE-CD1 3.34Å; F197-L211 HydrophobicContact CE1-CD1 4.25Å; F197-L211 HydrophobicContact CZ-CD1 4.28Å; L207-L211 HydrophobicContact CD1-CD1 4.33Å; L207-L211 HydrophobicContact CD1-CG 4.34Å; L207-L211 HydrophobicContact CG-CD1 4.12Å; L207-L211 WeakPolarHBondContact O-CG 3.46Å; L207-L211 PolarHBondContact O-N 3.17Å; Y208-L211 PolarHBondContact O-N 3.05Å; L211-F215 PolarHBondContact O-N 2.92Å
212F98.7Very high98Very high5 Ų532.2 Ų32.22%0.02218%0.182CC..Hα-helixtrans-62.4-47.5179-176.4-88000111.1W103 T104 Y106 L179 Y208 Q209 F215 G216W103-F212 HydrophobicContact CD2-CZ 4.24Å; W103-F212 HydrophobicContact CE3-CE1 4.48Å; W103-F212 AromaticContact CE3-CZ 3.75Å; W103-F212 HydrophobicContact CE3-CZ 3.75Å; W103-F212 AromaticContact CH2-CE1 3.82Å; W103-F212 HydrophobicContact CH2-CE1 3.82Å; W103-F212 AromaticContact CH2-CZ 3.84Å; W103-F212 HydrophobicContact CH2-CZ 3.84Å; W103-F212 HydrophobicContact CZ2-CE1 4.1Å; W103-F212 HydrophobicContact CZ2-CZ 4.3Å; W103-F212 HydrophobicContact CZ3-CE1 4.04Å; W103-F212 AromaticContact CZ3-CZ 3.54Å; W103-F212 HydrophobicContact CZ3-CZ 3.54Å; T104-F212 HydrophobicContact CG2-CD1 4.34Å; T104-F212 HydrophobicContact CG2-CE1 3.7Å; T104-F212 HydrophobicContact CG2-CZ 4.05Å; Y106-F212 HydrophobicContact CE1-CD1 4.41Å; Y106-F212 HydrophobicContact CE1-CG 4.47Å; L179-F212 HydrophobicContact CD1-CD2 3.99Å; L179-F212 HydrophobicContact CD1-CE2 4.15Å; Y208-F212 HydrophobicContact CD1-CB 4.09Å; Y208-F212 HydrophobicContact CE1-CB 3.75Å; Y208-F212 AromaticContact CE1-CD2 3.97Å; Y208-F212 HydrophobicContact CE1-CD2 3.97Å; Y208-F212 HydrophobicContact CE1-CG 4.1Å; Y208-F212 VanDerWaalsContact O-CB 3.28Å; Y208-F212 WeakPolarHBondContact O-CB 3.49Å; Y208-F212 PolarHBondContact O-N 3.18Å; Q209-F212 PolarHBondContact O-N 3.37Å; F212-F215 CarbonylContact O-C 3.59Å; F212-F215 WeakPolarHBondContact O-CB 3.49Å; F212-F215 PolarHBondContact O-N 3.12Å; F212-G216 WeakPolarHBondContact O-CA 3.47Å; F212-G216 PolarHBondContact O-N 3.24Å
213W98.6Very high97.9Very high21 Ų2130.7 Ų30.78%0.0816%0.157CC..Hα-helixtrans-76-30-177.8-73126000113.7W103 T104 Y106 Q209 F215 G216 H217 W265 H268 M269W103-W213 HydrophobicContact CH2-CH2 4.41Å; W103-W213 HydrophobicContact CH2-CZ3 4.06Å; W103-W213 AromaticContact CZ2-CH2 3.7Å; W103-W213 HydrophobicContact CZ2-CH2 3.7Å; W103-W213 AromaticContact CZ2-CZ3 3.78Å; W103-W213 HydrophobicContact CZ2-CZ3 3.78Å; T104-W213 HydrophobicContact CG2-CH2 4.21Å; T104-W213 HydrophobicContact CG2-CZ2 4.04Å; Y106-W213 AromaticContact CZ-NE1 3.95Å; Y106-W213 WeakPolarHBondContact OH-CZ2 3.47Å; Y106-W213 PolarHBondContact OH-NE1 2.92Å; Q209-W213 WeakPolarHBondContact O-CB 3.44Å; Q209-W213 PolarHBondContact O-N 2.95Å; W213-F215 CarbonylContact O-C 3.58Å; W213-F215 PolarHBondContact O-N 3.49Å; W213-G216 PolarHBondContact O-N 2.87Å; W213-H217 PolarHBondContact O-N 2.58Å; W213-W265 HydrophobicContact CB-CB 4.31Å; W213-W265 VanDerWaalsContact O-CB 3.31Å; W213-W265 WeakPolarHBondContact O-CB 3.38Å; W213-H268 HydrophobicContact CD2-CB 3.42Å; W213-H268 VanDerWaalsContact CD2-CB 3.42Å; W213-H268 AromaticContact CD2-CD2 3.53Å; W213-H268 AromaticContact CD2-CG 3.56Å; W213-H268 AromaticContact CE2-CG 3.76Å; W213-H268 HydrophobicContact CE3-CB 3.99Å; W213-H268 AromaticContact CE3-CD2 3.24Å; W213-H268 AromaticContact CE3-CG 3.57Å; W213-H268 AromaticContact CE3-NE2 3.52Å; W213-H268 HydrophobicContact CG-CB 3.69Å; W213-H268 HydrophobicContact CH2-CB 4.32Å; W213-H268 AromaticContact CH2-ND1 3.83Å; W213-H268 HydrophobicContact CZ2-CB 3.8Å; W213-H268 HydrophobicContact CZ3-CB 4.4Å; W213-H268 AromaticContact CZ3-CD2 3.71Å; W213-H268 AromaticContact CZ3-CE1 3.65Å; W213-H268 AromaticContact CZ3-CG 3.8Å; W213-H268 AromaticContact CZ3-ND1 3.8Å; W213-H268 AromaticContact CZ3-NE2 3.59Å; W213-M269 HydrophobicContact CG-CG 4.48Å
214F98.4Very high97.9Very high60 Ų6033.6 Ų33.626%0.26317%0.168SC..Hα-helixtrans-56.5-34.3169.7-175-87.2000111.2V178 H210 P218 F262 W265V178-F214 HydrophobicContact CB-CD1 3.99Å; V178-F214 HydrophobicContact CG1-CB 4.38Å; V178-F214 HydrophobicContact CG1-CD1 3.88Å; V178-F214 HydrophobicContact CG1-CG 4.48Å; V178-F214 HydrophobicContact CG2-CD1 3.69Å; V178-F214 HydrophobicContact CG2-CE1 3.77Å; H210-F214 WeakPolarHBondContact O-CB 3.49Å; H210-F214 PolarHBondContact O-N 3.27Å; F214-P218 WeakPolarHBondContact O-CD 3.32Å; F214-P218 VanDerWaalsContact O-CG 3.22Å; F214-P218 WeakPolarHBondContact O-CG 3.33Å; F214-F262 AromaticContact CE1-CD1 3.9Å; F214-F262 HydrophobicContact CE1-CD1 3.9Å; F214-F262 AromaticContact CE1-CE1 3.95Å; F214-F262 HydrophobicContact CE1-CE1 3.95Å; F214-F262 HydrophobicContact CE2-CD1 4.17Å; F214-F262 AromaticContact CZ-CD1 3.65Å; F214-F262 HydrophobicContact CZ-CD1 3.65Å; F214-F262 HydrophobicContact CZ-CE1 4.14Å; F214-W265 HydrophobicContact CB-CG 4.31Å; F214-W265 HydrophobicContact CD2-CD2 4.01Å; F214-W265 HydrophobicContact CD2-CE3 4.09Å; F214-W265 HydrophobicContact CD2-CG 4.49Å; F214-W265 HydrophobicContact CD2-CZ2 4.42Å; F214-W265 HydrophobicContact CD2-CZ3 4.33Å; F214-W265 HydrophobicContact CE2-CZ3 4.48Å
215F98.3Very high97.9Very high0 Ų030 Ų300%015%0.149CC..Hα-helixtrans-77.2-50.4165.8154.9-101.2000112.8F44 L176 L179 L211 F212 W213 H217 P218 E219F44-F215 HydrophobicContact CE1-CZ 4.06Å; F44-F215 HydrophobicContact CZ-CE1 4.24Å; F44-F215 AromaticContact CZ-CZ 3.93Å; F44-F215 HydrophobicContact CZ-CZ 3.93Å; L176-F215 HydrophobicContact CD2-CD2 4.08Å; L176-F215 HydrophobicContact CD2-CE2 3.48Å; L176-F215 VanDerWaalsContact CD2-CE2 3.48Å; L176-F215 HydrophobicContact CD2-CZ 4.25Å; L176-F215 HydrophobicContact CG-CE2 4.31Å; L179-F215 HydrophobicContact CB-CB 3.91Å; L179-F215 HydrophobicContact CB-CD1 3.88Å; L179-F215 HydrophobicContact CB-CD2 3.93Å; L179-F215 HydrophobicContact CB-CE1 4.44Å; L179-F215 HydrophobicContact CB-CE2 4.49Å; L179-F215 HydrophobicContact CB-CG 3.6Å; L179-F215 HydrophobicContact CD1-CD1 3.79Å; L179-F215 HydrophobicContact CD1-CE1 4.12Å; L179-F215 HydrophobicContact CD1-CG 4.39Å; L179-F215 HydrophobicContact CD2-CD1 3.92Å; L179-F215 HydrophobicContact CD2-CD2 4.34Å; L179-F215 HydrophobicContact CD2-CE1 3.64Å; L179-F215 HydrophobicContact CD2-CE2 4.09Å; L179-F215 HydrophobicContact CD2-CG 4.27Å; L179-F215 HydrophobicContact CD2-CZ 3.72Å; L179-F215 HydrophobicContact CG-CD1 4.06Å; L179-F215 HydrophobicContact CG-CE1 4.27Å; L179-F215 HydrophobicContact CG-CG 4.28Å; L211-F215 PolarHBondContact O-N 2.92Å; F212-F215 CarbonylContact O-C 3.59Å; F212-F215 WeakPolarHBondContact O-CB 3.49Å; F212-F215 PolarHBondContact O-N 3.12Å; W213-F215 CarbonylContact O-C 3.58Å; W213-F215 PolarHBondContact O-N 3.49Å; F215-H217 VanDerWaalsContact C-N 3.33Å; F215-H217 PolarHBondContact O-N 3.41Å; F215-P218 VanDerWaalsContact O-CD 3.26Å; F215-P218 WeakPolarHBondContact O-CD 3.32Å; F215-E219 HydrophobicContact CD2-CB 4.4Å; F215-E219 HydrophobicContact CE1-CB 4.13Å; F215-E219 HydrophobicContact CE1-CG 4.23Å; F215-E219 HydrophobicContact CE2-CB 3.79Å; F215-E219 HydrophobicContact CE2-CG 4.01Å; F215-E219 WeakPolarHBondContact CE2-OE2 3.29Å; F215-E219 HydrophobicContact CZ-CB 3.64Å; F215-E219 HydrophobicContact CZ-CG 3.54Å; F215-E219 WeakPolarHBondContact O-CB 3.43Å; F215-E219 PolarHBondContact O-N 3.38Å
216G97.1Very high97.9Very high0 Ų028.8 Ų28.80%014%0.141CC..Hα-helixtrans-68-28.4-163.200000113.9F212 W213 V220F212-G216 WeakPolarHBondContact O-CA 3.47Å; F212-G216 PolarHBondContact O-N 3.24Å; W213-G216 PolarHBondContact O-N 2.87Å; G216-V220 PolarHBondContact O-N 2.9Å
217H98.1Very high97.9Very high12 Ų1226.9 Ų26.96%0.05614%0.135CC..Hα-helixtrans-75.8-48.9174.6-164.973.6000113.1W213 F215 E219 V220 Y221 G261 V264 W265 H267 H268W213-H217 PolarHBondContact O-N 2.58Å; F215-H217 VanDerWaalsContact C-N 3.33Å; F215-H217 PolarHBondContact O-N 3.41Å; H217-E219 PolarHBondContact O-N 3.32Å; H217-V220 WeakPolarHBondContact O-CG2 3.35Å; H217-V220 PolarHBondContact O-N 3.01Å; H217-Y221 AromaticContact CD2-CD2 3.98Å; H217-Y221 AromaticContact CD2-CE2 3.53Å; H217-Y221 AromaticContact NE2-CD2 3.81Å; H217-Y221 AromaticContact NE2-CE2 3.01Å; H217-Y221 WeakPolarHBondContact NE2-CE2 3.23Å; H217-Y221 AromaticContact NE2-CZ 3.45Å; H217-Y221 PolarHBondContact NE2-OH 3.12Å; H217-Y221 PolarHBondContact O-N 3.08Å; H217-G261 PolarHBondContact CD2-O 3.35Å; H217-V264 WeakPolarHBondContact CD2-CG2 3.1Å; H217-V264 WeakPolarHBondContact NE2-CG2 3.31Å; H217-W265 HydrophobicContact CB-CB 4.09Å; H217-H267 AromaticContact CE1-CE1 3.15Å; H217-H267 PolarHBondContact CE1-CE1 3.37Å; H217-H267 AromaticContact CE1-NE2 3.58Å; H217-H267 AromaticContact CG-CE1 3.94Å; H217-H267 AromaticContact ND1-CE1 3.18Å; H217-H267 PolarHBondContact ND1-CE1 3.47Å; H217-H267 AromaticContact ND1-NE2 3.23Å; H217-H267 PolarHBondContact ND1-NE2 3.47Å; H217-H267 AromaticContact NE2-CE1 3.82Å; H217-H268 AromaticContact ND1-NE2 3.47Å; H217-H268 PolarHBondContact ND1-NE2 2.93Å
218P98.1Very high97.8Very high0 Ų027.3 Ų27.30%013%0.134CC..Hα-helixtrans-52.5-37.2166.1-30.136.2000113.6F214 F215 V220 Y221 I222 F262F214-P218 WeakPolarHBondContact O-CD 3.32Å; F214-P218 VanDerWaalsContact O-CG 3.22Å; F214-P218 WeakPolarHBondContact O-CG 3.33Å; F215-P218 VanDerWaalsContact O-CD 3.26Å; F215-P218 WeakPolarHBondContact O-CD 3.32Å; P218-V220 PolarHBondContact O-N 2.96Å; P218-Y221 WeakPolarHBondContact O-CA 3.39Å; P218-Y221 WeakPolarHBondContact O-CB 3.34Å; P218-Y221 PolarHBondContact O-N 3.35Å; P218-Y221 VanDerWaalsContact O-N 3.09Å; P218-I222 WeakPolarHBondContact O-CG1 3.49Å; P218-I222 PolarHBondContact O-N 3Å; P218-F262 HydrophobicContact CB-CE1 4.07Å; P218-F262 HydrophobicContact CB-CZ 4.08Å; P218-F262 HydrophobicContact CG-CD1 3.62Å; P218-F262 HydrophobicContact CG-CE1 3.53Å; P218-F262 HydrophobicContact CG-CG 4.15Å; P218-F262 HydrophobicContact CG-CZ 4Å
219E97.6Very high97.8Very high2 Ų227.3 Ų27.31%0.00913%0.134CC..Hα-helixtrans-58.9-45177.1-176.460.5-159.600112.5M48 F215 H217 Y221 I222 L223M48-E219 WeakPolarHBondContact CE-OE1 3.38Å; F215-E219 HydrophobicContact CD2-CB 4.4Å; F215-E219 HydrophobicContact CE1-CB 4.13Å; F215-E219 HydrophobicContact CE1-CG 4.23Å; F215-E219 HydrophobicContact CE2-CB 3.79Å; F215-E219 HydrophobicContact CE2-CG 4.01Å; F215-E219 WeakPolarHBondContact CE2-OE2 3.29Å; F215-E219 HydrophobicContact CZ-CB 3.64Å; F215-E219 HydrophobicContact CZ-CG 3.54Å; F215-E219 WeakPolarHBondContact O-CB 3.43Å; F215-E219 PolarHBondContact O-N 3.38Å; H217-E219 PolarHBondContact O-N 3.32Å; E219-Y221 PolarHBondContact O-N 2.94Å; E219-I222 VanDerWaalsContact O-CB 3.29Å; E219-I222 WeakPolarHBondContact O-CB 3.37Å; E219-I222 PolarHBondContact O-N 2.9Å; E219-I222 VanDerWaalsContact O-N 3.08Å; E219-I222 WeakPolarHBondContact OE2-CD1 3.48Å; E219-L223 WeakPolarHBondContact O-CG 3.39Å; E219-L223 PolarHBondContact O-N 3.49Å
220V96.8Very high97.7Very high60 Ų6027.4 Ų27.436%0.36413%0.134SC..Hα-helixtrans-64.8-26.9177.4-61.80000112.6G216 H217 P218G216-V220 PolarHBondContact O-N 2.9Å; H217-V220 WeakPolarHBondContact O-CG2 3.35Å; H217-V220 PolarHBondContact O-N 3.01Å; P218-V220 PolarHBondContact O-N 2.96Å
221Y97.1Very high97.7Very high64 Ų6428.5 Ų28.525%0.25114%0.142SC..Hα-helixtrans-74-39170.7-72.5-49.1000113.1H217 P218 E219 L223 I224 L225 I257 G261H217-Y221 AromaticContact CD2-CD2 3.98Å; H217-Y221 AromaticContact CD2-CE2 3.53Å; H217-Y221 AromaticContact NE2-CD2 3.81Å; H217-Y221 AromaticContact NE2-CE2 3.01Å; H217-Y221 WeakPolarHBondContact NE2-CE2 3.23Å; H217-Y221 AromaticContact NE2-CZ 3.45Å; H217-Y221 PolarHBondContact NE2-OH 3.12Å; H217-Y221 PolarHBondContact O-N 3.08Å; P218-Y221 WeakPolarHBondContact O-CA 3.39Å; P218-Y221 WeakPolarHBondContact O-CB 3.34Å; P218-Y221 PolarHBondContact O-N 3.35Å; P218-Y221 VanDerWaalsContact O-N 3.09Å; E219-Y221 PolarHBondContact O-N 2.94Å; Y221-L223 PolarHBondContact O-N 2.77Å; Y221-I224 HydrophobicContact CD1-CG2 4.21Å; Y221-I224 WeakPolarHBondContact O-CG2 3.29Å; Y221-I224 PolarHBondContact O-N 2.72Å; Y221-I224 VanDerWaalsContact O-N 3.11Å; Y221-L225 WeakPolarHBondContact O-CB 3.49Å; Y221-L225 VanDerWaalsContact O-CG 3.26Å; Y221-L225 WeakPolarHBondContact O-CG 3.47Å; Y221-L225 PolarHBondContact O-N 2.84Å; Y221-I257 HydrophobicContact CD1-CG2 3.48Å; Y221-I257 VanDerWaalsContact CD1-CG2 3.48Å; Y221-I257 HydrophobicContact CD2-CG2 4.27Å; Y221-I257 HydrophobicContact CE1-CG2 3.59Å; Y221-I257 HydrophobicContact CE2-CG2 4.32Å; Y221-I257 HydrophobicContact CG-CG2 3.86Å; Y221-G261 VanDerWaalsContact CE2-CA 3.5Å
222I96.6Very high97.6Very high1 Ų127.2 Ų27.21%0.00514%0.136CC..Hα-helixtrans-53.1-40171.4-73.3157.2000110.4M48 T168 L171 L172 P218 E219 I224 P226M48-I222 HydrophobicContact SD-CG2 4.47Å; T168-I222 HydrophobicContact CG2-CB 3.9Å; T168-I222 HydrophobicContact CG2-CG1 3.98Å; T168-I222 HydrophobicContact CG2-CG2 3.54Å; L171-I222 HydrophobicContact CB-CD1 3.72Å; L171-I222 HydrophobicContact CB-CG1 3.55Å; L171-I222 HydrophobicContact CD1-CG1 3.98Å; L171-I222 HydrophobicContact CG-CG1 4.4Å; L172-I222 HydrophobicContact CB-CD1 4.45Å; L172-I222 HydrophobicContact CD1-CG2 4.35Å; L172-I222 HydrophobicContact CD2-CD1 3.68Å; L172-I222 HydrophobicContact CD2-CG1 4.35Å; L172-I222 HydrophobicContact CD2-CG2 3.82Å; L172-I222 HydrophobicContact CG-CD1 3.77Å; L172-I222 HydrophobicContact CG-CG1 4.11Å; L172-I222 HydrophobicContact CG-CG2 3.99Å; P218-I222 WeakPolarHBondContact O-CG1 3.49Å; P218-I222 PolarHBondContact O-N 3Å; E219-I222 VanDerWaalsContact O-CB 3.29Å; E219-I222 WeakPolarHBondContact O-CB 3.37Å; E219-I222 PolarHBondContact O-N 2.9Å; E219-I222 VanDerWaalsContact O-N 3.08Å; E219-I222 WeakPolarHBondContact OE2-CD1 3.48Å; I222-I224 PolarHBondContact O-N 3.49Å; I222-P226 WeakPolarHBondContact O-CD 3.42Å
223L95.6Very high97.4Very high39 Ų3930 Ų3020%0.20415%0.149CC..Hα-helixtrans-68.4-32.5179.7-59.8-179.5000113.6I43 V47 M48 E219 Y221I43-L223 HydrophobicContact CG1-CD1 4.43Å; I43-L223 HydrophobicContact CG2-CD1 4.27Å; I43-L223 HydrophobicContact CG2-CD2 4.36Å; V47-L223 HydrophobicContact CB-CD2 4.1Å; V47-L223 HydrophobicContact CG1-CB 4.21Å; V47-L223 HydrophobicContact CG1-CD2 3.68Å; V47-L223 HydrophobicContact CG1-CG 4.42Å; M48-L223 HydrophobicContact CG-CD2 3.79Å; E219-L223 WeakPolarHBondContact O-CG 3.39Å; E219-L223 PolarHBondContact O-N 3.49Å; Y221-L223 PolarHBondContact O-N 2.77Å
224I97.6Very high97.3Very high76 Ų7633.4 Ų33.439%0.3917%0.167SC..Hα-helixtrans-100-30.6-172-164.761.2000114.3Y221 I222 G227 F228Y221-I224 HydrophobicContact CD1-CG2 4.21Å; Y221-I224 WeakPolarHBondContact O-CG2 3.29Å; Y221-I224 PolarHBondContact O-N 2.72Å; Y221-I224 VanDerWaalsContact O-N 3.11Å; I222-I224 PolarHBondContact O-N 3.49Å; I224-G227 CarbonylContact O-C 3.6Å; I224-G227 VanDerWaalsContact O-CA 3.25Å; I224-G227 WeakPolarHBondContact O-CA 3.4Å; I224-G227 PolarHBondContact O-N 3.24Å; I224-F228 HydrophobicContact CB-CZ 4.45Å; I224-F228 HydrophobicContact CD1-CE1 4.24Å; I224-F228 HydrophobicContact CG1-CD1 4.18Å; I224-F228 HydrophobicContact CG1-CE1 3.52Å; I224-F228 HydrophobicContact CG1-CE2 4.3Å; I224-F228 HydrophobicContact CG1-CZ 3.59Å; I224-F228 HydrophobicContact CG2-CE2 4.06Å; I224-F228 HydrophobicContact CG2-CZ 4Å; I224-F228 PolarHBondContact O-N 3.22Å
225L98.3Very high97.3Very high0 Ų035.1 Ų35.10%018%0.179CC..Hα-helixtrans-56.2-47-176.7-77.6169.6000112.8S164 I167 T168 L171 Y221 G227 F228 G229 M254 I257S164-L225 WeakPolarHBondContact CB-O 3.48Å; S164-L225 PolarHBondContact OG-O 2.9Å; I167-L225 HydrophobicContact CB-CD1 4.45Å; I167-L225 HydrophobicContact CG2-CD1 3.72Å; T168-L225 WeakPolarHBondContact OG1-CB 3.33Å; L171-L225 HydrophobicContact CD1-CD1 3.65Å; Y221-L225 WeakPolarHBondContact O-CB 3.49Å; Y221-L225 VanDerWaalsContact O-CG 3.26Å; Y221-L225 WeakPolarHBondContact O-CG 3.47Å; Y221-L225 PolarHBondContact O-N 2.84Å; L225-G227 PolarHBondContact O-N 3.49Å; L225-F228 HydrophobicContact CD2-CD2 4Å; L225-F228 HydrophobicContact CD2-CE2 4.33Å; L225-F228 WeakPolarHBondContact O-CB 3.31Å; L225-F228 PolarHBondContact O-N 3.41Å; L225-F228 VanDerWaalsContact O-N 3.07Å; L225-G229 PolarHBondContact O-N 2.88Å; L225-G229 VanDerWaalsContact O-N 3.12Å; L225-M254 HydrophobicContact CD2-CB 4.17Å; L225-M254 HydrophobicContact CD2-CG 4.19Å; L225-I257 HydrophobicContact CD2-CG2 4.32Å
226P98Very high97.2Very high0 Ų035.9 Ų35.90%018%0.184CC..Hα-helixtrans-59.4-32.8174.4-25.337.4000112.6M51 I52 F161 T168 I222 G229 M230M51-P226 HydrophobicContact CB-CB 4.2Å; M51-P226 HydrophobicContact CB-CG 4.47Å; M51-P226 HydrophobicContact CE-CB 3.76Å; I52-P226 HydrophobicContact CD1-CB 4.41Å; I52-P226 HydrophobicContact CD1-CG 3.54Å; I52-P226 HydrophobicContact CG1-CG 4.34Å; F161-P226 HydrophobicContact CE2-CB 4.33Å; T168-P226 HydrophobicContact CG2-CG 4.3Å; T168-P226 WeakPolarHBondContact OG1-CD 3.5Å; I222-P226 WeakPolarHBondContact O-CD 3.42Å; P226-G229 PolarHBondContact O-N 3.25Å; P226-M230 PolarHBondContact O-N 3.06Å
227G97.6Very high97.1Very high14 Ų1442.7 Ų42.714%0.14422%0.216CC..Hα-helixtrans-60.4-46.8172.100000112.5I224 L225 G229 M230 I231I224-G227 CarbonylContact O-C 3.6Å; I224-G227 VanDerWaalsContact O-CA 3.25Å; I224-G227 WeakPolarHBondContact O-CA 3.4Å; I224-G227 PolarHBondContact O-N 3.24Å; L225-G227 PolarHBondContact O-N 3.49Å; G227-G229 VanDerWaalsContact C-N 3.29Å; G227-G229 PolarHBondContact O-N 2.96Å; G227-M230 PolarHBondContact O-N 3.28Å; G227-I231 WeakPolarHBondContact O-CB 3.25Å; G227-I231 VanDerWaalsContact O-CG1 3.26Å; G227-I231 WeakPolarHBondContact O-CG1 3.48Å; G227-I231 PolarHBondContact O-N 3.46Å
228F98Very high97.1Very high81 Ų8149.5 Ų49.536%0.35525%0.248SC..Hα-helixtrans-57.8-43.5173.9-60.5-26.3000111.8I224 L225 S232 M254 I257I224-F228 HydrophobicContact CB-CZ 4.45Å; I224-F228 HydrophobicContact CD1-CE1 4.24Å; I224-F228 HydrophobicContact CG1-CD1 4.18Å; I224-F228 HydrophobicContact CG1-CE1 3.52Å; I224-F228 HydrophobicContact CG1-CE2 4.3Å; I224-F228 HydrophobicContact CG1-CZ 3.59Å; I224-F228 HydrophobicContact CG2-CE2 4.06Å; I224-F228 HydrophobicContact CG2-CZ 4Å; I224-F228 PolarHBondContact O-N 3.22Å; L225-F228 HydrophobicContact CD2-CD2 4Å; L225-F228 HydrophobicContact CD2-CE2 4.33Å; L225-F228 WeakPolarHBondContact O-CB 3.31Å; L225-F228 PolarHBondContact O-N 3.41Å; L225-F228 VanDerWaalsContact O-N 3.07Å; F228-S232 WeakPolarHBondContact O-CB 3.26Å; F228-S232 PolarHBondContact O-N 3Å; F228-S232 PolarHBondContact O-OG 3.15Å; F228-M254 HydrophobicContact CB-SD 4.46Å; F228-I257 HydrophobicContact CE2-CD1 4.19Å
229G97.1Very high97Very high0 Ų052.9 Ų52.90%027%0.271CS..Hα-helixtrans-59.5-48.8176.700000112.8L225 P226 G227 H233L225-G229 PolarHBondContact O-N 2.88Å; L225-G229 VanDerWaalsContact O-N 3.12Å; P226-G229 PolarHBondContact O-N 3.25Å; G227-G229 VanDerWaalsContact C-N 3.29Å; G227-G229 PolarHBondContact O-N 2.96Å; G229-H233 PolarHBondContact O-CD2 3.27Å; G229-H233 VanDerWaalsContact O-CD2 3.23Å; G229-H233 PolarHBondContact O-N 2.93Å
230M97.1Very high96.9Very high37 Ų3756.1 Ų56.118%0.18231%0.305CS..Hα-helixtrans-65.7-47.5179.2-71.8-161.4-73.100112.5M51 F55 F161 P226 G227 S232 H233 I234M51-M230 HydrophobicContact CE-CE 3.12Å; M51-M230 HydrophobicContact SD-CE 3.5Å; M51-M230 WeakPolarHBondContact SD-CE 3.31Å; F55-M230 HydrophobicContact CB-SD 4.49Å; F55-M230 HydrophobicContact CD1-SD 4.25Å; F55-M230 HydrophobicContact CD2-CE 4.08Å; F55-M230 HydrophobicContact CD2-SD 3.88Å; F55-M230 HydrophobicContact CE1-SD 4.44Å; F55-M230 HydrophobicContact CE2-CE 4.21Å; F55-M230 HydrophobicContact CE2-SD 4.07Å; F55-M230 HydrophobicContact CG-SD 3.97Å; F55-M230 HydrophobicContact CZ-SD 4.35Å; F161-M230 HydrophobicContact CD2-CG 3.52Å; F161-M230 HydrophobicContact CE2-CG 3.52Å; F161-M230 HydrophobicContact CE2-SD 4.32Å; P226-M230 PolarHBondContact O-N 3.06Å; G227-M230 PolarHBondContact O-N 3.28Å; M230-S232 PolarHBondContact O-N 3.36Å; M230-H233 PolarHBondContact O-N 3.37Å; M230-H233 VanDerWaalsContact O-N 3.11Å; M230-I234 WeakPolarHBondContact O-CG1 3.25Å; M230-I234 PolarHBondContact O-N 3.35Å
231I97.8Very high96.7Very high90 Ų9059.2 Ų59.246%0.46231%0.314SS..Hα-helixtrans-61.5-36.6-179-68.8-65.9000111G227 H233 I234 I235G227-I231 WeakPolarHBondContact O-CB 3.25Å; G227-I231 VanDerWaalsContact O-CG1 3.26Å; G227-I231 WeakPolarHBondContact O-CG1 3.48Å; G227-I231 PolarHBondContact O-N 3.46Å; I231-H233 VanDerWaalsContact C-N 3.29Å; I231-H233 PolarHBondContact O-N 2.96Å; I231-I234 HydrophobicContact CD1-CD1 4.45Å; I231-I234 PolarHBondContact O-N 3.43Å; I231-I235 HydrophobicContact CG2-CD1 3.45Å; I231-I235 VanDerWaalsContact CG2-CD1 3.45Å; I231-I235 HydrophobicContact CG2-CG1 4.03Å; I231-I235 WeakPolarHBondContact O-CB 3.46Å; I231-I235 VanDerWaalsContact O-CG1 3.31Å; I231-I235 WeakPolarHBondContact O-CG1 3.37Å; I231-I235 PolarHBondContact O-N 3.33Å
232S96.5Very high96.3Very high9 Ų966.6 Ų66.66%0.06335%0.347CS..Hα-helixtrans-59.4-39.9176-58.30000112.7F228 M230 S236 T244 M250F228-S232 WeakPolarHBondContact O-CB 3.26Å; F228-S232 PolarHBondContact O-N 3Å; F228-S232 PolarHBondContact O-OG 3.15Å; M230-S232 PolarHBondContact O-N 3.36Å; S232-S236 WeakPolarHBondContact O-CB 3.45Å; S232-S236 PolarHBondContact O-N 3.13Å; S232-T244 PolarHBondContact O-OG1 3Å; S232-M250 WeakPolarHBondContact OG-CE 3.31Å
233H95.4Very high96Very high65 Ų6573.4 Ų73.430%0.30138%0.379SS..Hα-helixtrans-72.3-46.5176.3-78.9-70.1000112.3F161 G229 M230 I231 I235 S236 Q237F161-H233 PolarHBondContact N-NE2 2.94Å; G229-H233 PolarHBondContact O-CD2 3.27Å; G229-H233 VanDerWaalsContact O-CD2 3.23Å; G229-H233 PolarHBondContact O-N 2.93Å; M230-H233 PolarHBondContact O-N 3.37Å; M230-H233 VanDerWaalsContact O-N 3.11Å; I231-H233 VanDerWaalsContact C-N 3.29Å; I231-H233 PolarHBondContact O-N 2.96Å; H233-I235 PolarHBondContact O-N 2.59Å; H233-S236 PolarHBondContact O-N 3.42Å; H233-Q237 WeakPolarHBondContact O-CB 3.49Å; H233-Q237 PolarHBondContact O-N 3.32Å
234I96.9Very high95.9Very high91 Ų9173 Ų7347%0.46738%0.378SS..Hα-helixtrans-58.6-50.1178.6-66.1165.8000109.9M230 I231 S236 Q237 E238M230-I234 WeakPolarHBondContact O-CG1 3.25Å; M230-I234 PolarHBondContact O-N 3.35Å; I231-I234 HydrophobicContact CD1-CD1 4.45Å; I231-I234 PolarHBondContact O-N 3.43Å; I234-S236 VanDerWaalsContact C-N 3.34Å; I234-S236 PolarHBondContact O-N 3.2Å; I234-Q237 PolarHBondContact O-N 3.11Å; I234-E238 HydrophobicContact CG2-CG 4.02Å; I234-E238 WeakPolarHBondContact O-CB 3.35Å; I234-E238 VanDerWaalsContact O-CG 3.31Å; I234-E238 WeakPolarHBondContact O-CG 3.1Å; I234-E238 PolarHBondContact O-N 3.31Å
235I97.1Very high95.6Very high97 Ų9778.2 Ų78.250%0.49740%0.398SS..Hα-helixtrans-61.9-42.6-179.8-68.9174.7000111.2I231 H233 Q237 S239I231-I235 HydrophobicContact CG2-CD1 3.45Å; I231-I235 VanDerWaalsContact CG2-CD1 3.45Å; I231-I235 HydrophobicContact CG2-CG1 4.03Å; I231-I235 WeakPolarHBondContact O-CB 3.46Å; I231-I235 VanDerWaalsContact O-CG1 3.31Å; I231-I235 WeakPolarHBondContact O-CG1 3.37Å; I231-I235 PolarHBondContact O-N 3.33Å; H233-I235 PolarHBondContact O-N 2.59Å; I235-Q237 VanDerWaalsContact C-N 3.31Å; I235-Q237 PolarHBondContact O-N 3.15Å; I235-S239 WeakPolarHBondContact O-CB 3.14Å; I235-S239 PolarHBondContact O-N 2.6Å; I235-S239 PolarHBondContact O-OG 3.23Å
236S96.1Very high95.4Very high16 Ų1680.3 Ų80.311%0.11242%0.42CS..Hα-helixtrans-59.6-45.7177.9-1690000111.2S232 H233 I234 G240 K241 E243S232-S236 WeakPolarHBondContact O-CB 3.45Å; S232-S236 PolarHBondContact O-N 3.13Å; H233-S236 PolarHBondContact O-N 3.42Å; I234-S236 VanDerWaalsContact C-N 3.34Å; I234-S236 PolarHBondContact O-N 3.2Å; S236-G240 PolarHBondContact O-N 2.9Å; S236-K241 PolarHBondContact O-N 3.36Å; S236-K241 PolarHBondContact OG-O 3.1Å; S236-K241 VanDerWaalsContact OG-O 3.12Å; S236-E243 VanDerWaalsContact OG-C 3.32Å
237Q95.6Very high95.3Very high143 Ų14382 Ų8267%0.66843%0.431SS*.Hα-helixtrans-66-52.5-179.3-177.662.622.300111.9H233 I234 I235 S239 G240H233-Q237 WeakPolarHBondContact O-CB 3.49Å; H233-Q237 PolarHBondContact O-N 3.32Å; I234-Q237 PolarHBondContact O-N 3.11Å; I235-Q237 VanDerWaalsContact C-N 3.31Å; I235-Q237 PolarHBondContact O-N 3.15Å; Q237-S239 PolarHBondContact O-N 3.49Å; Q237-G240 PolarHBondContact O-N 3.31Å
238E97.5Very high95.2Very high155 Ų15585.1 Ų85.172%0.72444%0.444SS*.Hα-helixtrans-67.1-24.4-178.4-64.3-53.5128.200112.4I234 G240I234-E238 HydrophobicContact CG2-CG 4.02Å; I234-E238 WeakPolarHBondContact O-CB 3.35Å; I234-E238 VanDerWaalsContact O-CG 3.31Å; I234-E238 WeakPolarHBondContact O-CG 3.1Å; I234-E238 PolarHBondContact O-N 3.31Å; E238-G240 VanDerWaalsContact C-N 3.3Å
239S96.8Very high95.2Very high70 Ų7083.3 Ų83.349%0.4945%0.449SS..THydrogen-bonded Turntrans-84.6-1.2173.6-55.40000113.6I235 Q237 K241I235-S239 WeakPolarHBondContact O-CB 3.14Å; I235-S239 PolarHBondContact O-N 2.6Å; I235-S239 PolarHBondContact O-OG 3.23Å; Q237-S239 PolarHBondContact O-N 3.49Å; S239-K241 PolarHBondContact O-N 3.2Å
240G95Very high95.2Very high71 Ų7186 Ų8673%0.73246%0.462SS*.THydrogen-bonded Turntrans6322.3-175.600000114S236 Q237 E238S236-G240 PolarHBondContact O-N 2.9Å; Q237-G240 PolarHBondContact O-N 3.31Å; E238-G240 VanDerWaalsContact C-N 3.3Å
241K93.6Very high95.2Very high125 Ų12584.4 Ų84.454%0.54346%0.455SS..  trans-89.3142.6179.3-66-168.1-176.7-177.90110.3S236 S239 E243S236-K241 PolarHBondContact O-N 3.36Å; S236-K241 PolarHBondContact OG-O 3.1Å; S236-K241 VanDerWaalsContact OG-O 3.12Å; S239-K241 PolarHBondContact O-N 3.2Å; K241-E243 VanDerWaalsContact C-N 3.27Å; K241-E243 PolarHBondContact O-N 3.42Å
242K88.1Confident95.2Very high218 Ų21886.8 Ų86.895%0.94846%0.459SS*.SBendtrans-67-29.9177.8-64.9-175.7179.6-179.40112.9
243E89.9Confident95.3Very high145 Ų14588.8 Ų88.868%0.67848%0.475SS*.SBendtrans-152.9160.8-179.165.4-176.8172.500111.4S236 K241S236-E243 VanDerWaalsContact OG-C 3.32Å; K241-E243 VanDerWaalsContact C-N 3.27Å; K241-E243 PolarHBondContact O-N 3.42Å
244T93.2Very high95.5Very high29 Ų2986 Ų8618%0.17846%0.463CS..  trans-70.5132172.3-44.60000110.1L160 S232 G246 S247 M250L160-T244 HydrophobicContact CD1-CG2 3.96Å; S232-T244 PolarHBondContact O-OG1 3Å; T244-G246 PolarHBondContact O-N 3.16Å; T244-S247 PolarHBondContact O-N 3.09Å; T244-M250 HydrophobicContact CG2-CE 4.36Å; T244-M250 HydrophobicContact CG2-SD 3.35Å; T244-M250 WeakPolarHBondContact CG2-SD 3.46Å
245F93Very high95.5Very high186 Ų18684.9 Ų84.982%0.81646%0.457SS*.THydrogen-bonded Turntrans-60.9125.2178.3179.1-96.7000110.8
246G94.2Very high95.6Very high44 Ų4482.3 Ų82.345%0.45445%0.451SS..THydrogen-bonded Turntrans683817700000114.2T244 L248 G249 M250T244-G246 PolarHBondContact O-N 3.16Å; G246-L248 VanDerWaalsContact C-N 3.27Å; G246-L248 PolarHBondContact O-N 3.08Å; G246-L248 VanDerWaalsContact O-N 3.15Å; G246-G249 WeakPolarHBondContact O-CA 3.38Å; G246-G249 PolarHBondContact O-N 3.4Å; G246-M250 PolarHBondContact O-N 3.4Å
247S94.4Very high95.6Very high35 Ų3584 Ų8425%0.24546%0.458CS..Hα-helixtrans-45.2-46.7-179.1-176.80000113.8T244 G249 M250 I251T244-S247 PolarHBondContact O-N 3.09Å; S247-G249 VanDerWaalsContact C-N 3.35Å; S247-G249 PolarHBondContact O-N 2.91Å; S247-M250 WeakPolarHBondContact O-CB 3.42Å; S247-M250 PolarHBondContact O-N 3.37Å; S247-M250 VanDerWaalsContact O-N 3.12Å; S247-I251 WeakPolarHBondContact O-CG1 3.32Å; S247-I251 PolarHBondContact O-N 2.93Å
248L96.1Very high95.7Very high80 Ų8077.3 Ų77.342%0.41943%0.428SS..Hα-helixtrans-63.3-39.5178.1-169.866.1000112.8G246 M250 I251 Y252G246-L248 VanDerWaalsContact C-N 3.27Å; G246-L248 PolarHBondContact O-N 3.08Å; G246-L248 VanDerWaalsContact O-N 3.15Å; L248-M250 VanDerWaalsContact C-N 3.3Å; L248-M250 PolarHBondContact O-N 2.82Å; L248-I251 HydrophobicContact CD1-CD1 4.48Å; L248-I251 PolarHBondContact O-N 3.44Å; L248-Y252 HydrophobicContact CD1-CE1 4.29Å; L248-Y252 HydrophobicContact CD1-CE2 4.11Å; L248-Y252 HydrophobicContact CD2-CE2 3.87Å; L248-Y252 HydrophobicContact CG-CD2 4.21Å; L248-Y252 HydrophobicContact CG-CE2 3.56Å; L248-Y252 WeakPolarHBondContact O-CD2 3.29Å; L248-Y252 PolarHBondContact O-N 3.22Å
249G97.4Very high95.7Very high44 Ų4476 Ų7645%0.45443%0.425SS..Hα-helixtrans-63.3-36.9173.800000112.2G246 S247 Y252 A253G246-G249 WeakPolarHBondContact O-CA 3.38Å; G246-G249 PolarHBondContact O-N 3.4Å; S247-G249 VanDerWaalsContact C-N 3.35Å; S247-G249 PolarHBondContact O-N 2.91Å; G249-Y252 PolarHBondContact O-N 3.29Å; G249-A253 WeakPolarHBondContact O-CB 3.34Å; G249-A253 PolarHBondContact O-N 2.96Å
250M97.3Very high95.6Very high57 Ų5776.8 Ų76.828%0.28142%0.423SS..Hα-helixtrans-67.5-39.4174.4-64.4-171.467.600112.4L160 S232 T244 G246 S247 L248 A253 M254L160-M250 HydrophobicContact CD1-CB 4.42Å; L160-M250 HydrophobicContact CD1-CE 4.13Å; L160-M250 HydrophobicContact CD1-SD 3.83Å; L160-M250 HydrophobicContact CD2-CB 4.03Å; S232-M250 WeakPolarHBondContact OG-CE 3.31Å; T244-M250 HydrophobicContact CG2-CE 4.36Å; T244-M250 HydrophobicContact CG2-SD 3.35Å; T244-M250 WeakPolarHBondContact CG2-SD 3.46Å; G246-M250 PolarHBondContact O-N 3.4Å; S247-M250 WeakPolarHBondContact O-CB 3.42Å; S247-M250 PolarHBondContact O-N 3.37Å; S247-M250 VanDerWaalsContact O-N 3.12Å; L248-M250 VanDerWaalsContact C-N 3.3Å; L248-M250 PolarHBondContact O-N 2.82Å; M250-A253 PolarHBondContact O-N 3.22Å; M250-M254 WeakPolarHBondContact O-CG 3.35Å; M250-M254 PolarHBondContact O-N 3.12Å
251I97.9Very high95.6Very high3 Ų373.5 Ų73.52%0.01539%0.389CS..Hα-helixtrans-58.6-49.6173.2-66.3164.4000109.8L160 W163 S247 L248 A253 M254 L255L160-I251 HydrophobicContact CD2-CD1 4.4Å; L160-I251 HydrophobicContact CD2-CG1 3.71Å; W163-I251 HydrophobicContact CB-CG1 4.47Å; W163-I251 HydrophobicContact CD2-CG1 4.37Å; W163-I251 HydrophobicContact CD2-CG2 3.76Å; W163-I251 HydrophobicContact CE3-CG2 4.06Å; W163-I251 HydrophobicContact CG-CD1 4.25Å; W163-I251 HydrophobicContact CG-CG1 3.93Å; W163-I251 HydrophobicContact CG-CG2 4.17Å; W163-I251 HydrophobicContact CH2-CG2 4.37Å; W163-I251 HydrophobicContact CZ2-CG2 4.08Å; W163-I251 HydrophobicContact CZ3-CG2 4.36Å; S247-I251 WeakPolarHBondContact O-CG1 3.32Å; S247-I251 PolarHBondContact O-N 2.93Å; L248-I251 HydrophobicContact CD1-CD1 4.48Å; L248-I251 PolarHBondContact O-N 3.44Å; I251-A253 VanDerWaalsContact C-N 3.34Å; I251-A253 PolarHBondContact O-N 3.41Å; I251-M254 PolarHBondContact O-N 3.47Å; I251-L255 HydrophobicContact CG2-CD1 3.98Å; I251-L255 WeakPolarHBondContact O-CG 3.29Å; I251-L255 PolarHBondContact O-N 2.96Å
252Y98Very high95.8Very high140 Ų14069.1 Ų69.155%0.54937%0.37SS..Hα-helixtrans-64-37.4178-63.4-34.1000113.1L248 G249 L255 A256L248-Y252 HydrophobicContact CD1-CE1 4.29Å; L248-Y252 HydrophobicContact CD1-CE2 4.11Å; L248-Y252 HydrophobicContact CD2-CE2 3.87Å; L248-Y252 HydrophobicContact CG-CD2 4.21Å; L248-Y252 HydrophobicContact CG-CE2 3.56Å; L248-Y252 WeakPolarHBondContact O-CD2 3.29Å; L248-Y252 PolarHBondContact O-N 3.22Å; G249-Y252 PolarHBondContact O-N 3.29Å; Y252-L255 HydrophobicContact CD1-CD1 4.25Å; Y252-L255 PolarHBondContact O-N 3.23Å; Y252-A256 WeakPolarHBondContact O-CB 3.5Å; Y252-A256 PolarHBondContact O-N 2.96Å
253A98.1Very high96.2Very high50 Ų5064.3 Ų64.341%0.41335%0.353SS..Hα-helixtrans-63-45.3174.900000111.7G249 M250 I251 L255 A256 I257G249-A253 WeakPolarHBondContact O-CB 3.34Å; G249-A253 PolarHBondContact O-N 2.96Å; M250-A253 PolarHBondContact O-N 3.22Å; I251-A253 VanDerWaalsContact C-N 3.34Å; I251-A253 PolarHBondContact O-N 3.41Å; A253-L255 VanDerWaalsContact C-N 3.35Å; A253-L255 PolarHBondContact O-N 3.44Å; A253-A256 PolarHBondContact O-N 3.41Å; A253-I257 VanDerWaalsContact O-CG1 3.3Å; A253-I257 WeakPolarHBondContact O-CG1 3.36Å; A253-I257 PolarHBondContact O-N 3.13Å
254M98.3Very high96.6Very high7 Ų759.9 Ų59.93%0.03434%0.336CS..Hα-helixtrans-64-39.6176.4-69.8-172.6-69.800112.1L160 W163 I167 L225 F228 M250 I251 I257 G258L160-M254 HydrophobicContact CD2-CE 3.97Å; W163-M254 HydrophobicContact CB-CE 4.06Å; I167-M254 HydrophobicContact CD1-CB 3.51Å; L225-M254 HydrophobicContact CD2-CB 4.17Å; L225-M254 HydrophobicContact CD2-CG 4.19Å; F228-M254 HydrophobicContact CB-SD 4.46Å; M250-M254 WeakPolarHBondContact O-CG 3.35Å; M250-M254 PolarHBondContact O-N 3.12Å; I251-M254 PolarHBondContact O-N 3.47Å; M254-I257 PolarHBondContact O-N 3.46Å; M254-G258 PolarHBondContact O-N 2.78Å
255L98.1Very high96.8Very high68 Ų6861.8 Ų61.836%0.35634%0.34SS..Hα-helixtrans-63-44.1174.8-75.4167.4000111.7W163 I167 I251 Y252 A253 G258 L259W163-L255 HydrophobicContact CZ3-CD2 4.43Å; I167-L255 HydrophobicContact CD1-CD2 3.97Å; I167-L255 HydrophobicContact CD1-CG 4.02Å; I167-L255 HydrophobicContact CG1-CD2 3.9Å; I167-L255 HydrophobicContact CG1-CG 4.5Å; I251-L255 HydrophobicContact CG2-CD1 3.98Å; I251-L255 WeakPolarHBondContact O-CG 3.29Å; I251-L255 PolarHBondContact O-N 2.96Å; Y252-L255 HydrophobicContact CD1-CD1 4.25Å; Y252-L255 PolarHBondContact O-N 3.23Å; A253-L255 VanDerWaalsContact C-N 3.35Å; A253-L255 PolarHBondContact O-N 3.44Å; L255-G258 PolarHBondContact O-N 3.37Å; L255-L259 PolarHBondContact O-N 3.03Å
256A98.2Very high97Very high43 Ų4353.9 Ų53.936%0.35531%0.309SS..Hα-helixtrans-62.2-44.4176.700000111.3Y252 A253 G258 L259 L260Y252-A256 WeakPolarHBondContact O-CB 3.5Å; Y252-A256 PolarHBondContact O-N 2.96Å; A253-A256 PolarHBondContact O-N 3.41Å; A256-G258 VanDerWaalsContact C-N 3.34Å; A256-G258 PolarHBondContact O-N 3.45Å; A256-L259 PolarHBondContact O-N 2.79Å; A256-L260 VanDerWaalsContact O-CB 3.25Å; A256-L260 WeakPolarHBondContact O-CB 3.21Å; A256-L260 WeakPolarHBondContact O-CG 3.47Å; A256-L260 PolarHBondContact O-N 2.92Å
257I97.6Very high97.2Very high50 Ų5055.1 Ų55.126%0.25630%0.303SS..Hα-helixtrans-58.2-47.2174.5-70.1165.5000110.7Y221 L225 F228 A253 M254 L259 G261Y221-I257 HydrophobicContact CD1-CG2 3.48Å; Y221-I257 VanDerWaalsContact CD1-CG2 3.48Å; Y221-I257 HydrophobicContact CD2-CG2 4.27Å; Y221-I257 HydrophobicContact CE1-CG2 3.59Å; Y221-I257 HydrophobicContact CE2-CG2 4.32Å; Y221-I257 HydrophobicContact CG-CG2 3.86Å; L225-I257 HydrophobicContact CD2-CG2 4.32Å; F228-I257 HydrophobicContact CE2-CD1 4.19Å; A253-I257 VanDerWaalsContact O-CG1 3.3Å; A253-I257 WeakPolarHBondContact O-CG1 3.36Å; A253-I257 PolarHBondContact O-N 3.13Å; M254-I257 PolarHBondContact O-N 3.46Å; I257-L259 PolarHBondContact O-N 2.96Å; I257-G261 PolarHBondContact O-N 2.86Å
258G96.6Very high97.3Very high4 Ų456.6 Ų56.64%0.04131%0.306CS..Hα-helixtrans-60.1-45178.600000113L171 M254 L255 A256L171-G258 WeakPolarHBondContact CD2-O 3.37Å; M254-G258 PolarHBondContact O-N 2.78Å; L255-G258 PolarHBondContact O-N 3.37Å; A256-G258 VanDerWaalsContact C-N 3.34Å; A256-G258 PolarHBondContact O-N 3.45Å
259L97Very high97.4Very high127 Ų12752.8 Ų52.867%0.66529%0.286SS*.Hα-helixtrans-67.6-50.3178.4-179.666.3000112L255 A256 I257 G261 F262L255-L259 PolarHBondContact O-N 3.03Å; A256-L259 PolarHBondContact O-N 2.79Å; I257-L259 PolarHBondContact O-N 2.96Å; L259-G261 PolarHBondContact O-N 3.06Å; L259-F262 PolarHBondContact O-N 2.74Å
260L96.6Very high97.3Very high87 Ų8755.4 Ų55.446%0.45529%0.285SS..Hα-helixtrans-66.1-24.5-177.4-65.3174.2000111.8A256 F262 I263A256-L260 VanDerWaalsContact O-CB 3.25Å; A256-L260 WeakPolarHBondContact O-CB 3.21Å; A256-L260 WeakPolarHBondContact O-CG 3.47Å; A256-L260 PolarHBondContact O-N 2.92Å; L260-F262 PolarHBondContact O-N 3.09Å; L260-I263 HydrophobicContact CD2-CD1 3.59Å; L260-I263 HydrophobicContact CD2-CG1 4.24Å; L260-I263 WeakPolarHBondContact O-CG1 3.34Å; L260-I263 PolarHBondContact O-N 3.38Å
261G94.8Very high97.3Very high1 Ų159.3 Ų59.31%0.0131%0.312CS..THydrogen-bonded Turntrans-60-24.4174.700000114.8H217 Y221 I257 L259H217-G261 PolarHBondContact CD2-O 3.35Å; Y221-G261 VanDerWaalsContact CE2-CA 3.5Å; I257-G261 PolarHBondContact O-N 2.86Å; L259-G261 PolarHBondContact O-N 3.06Å
262F96.9Very high97.1Very high33 Ų3361 Ų6115%0.14532%0.323CS..THydrogen-bonded Turntrans-84.3-4.2174.7-78.5-72.6000114.5L171 L174 F214 P218 L259 L260 W265L171-F262 HydrophobicContact CD2-CD2 4.08Å; L171-F262 HydrophobicContact CD2-CE2 3.4Å; L171-F262 HydrophobicContact CD2-CZ 4.19Å; L174-F262 HydrophobicContact CB-CE1 4.3Å; L174-F262 HydrophobicContact CB-CE2 4.24Å; L174-F262 HydrophobicContact CB-CZ 3.62Å; L174-F262 HydrophobicContact CD1-CE2 4.15Å; L174-F262 HydrophobicContact CD1-CZ 4.37Å; F214-F262 AromaticContact CE1-CD1 3.9Å; F214-F262 HydrophobicContact CE1-CD1 3.9Å; F214-F262 AromaticContact CE1-CE1 3.95Å; F214-F262 HydrophobicContact CE1-CE1 3.95Å; F214-F262 HydrophobicContact CE2-CD1 4.17Å; F214-F262 AromaticContact CZ-CD1 3.65Å; F214-F262 HydrophobicContact CZ-CD1 3.65Å; F214-F262 HydrophobicContact CZ-CE1 4.14Å; P218-F262 HydrophobicContact CB-CE1 4.07Å; P218-F262 HydrophobicContact CB-CZ 4.08Å; P218-F262 HydrophobicContact CG-CD1 3.62Å; P218-F262 HydrophobicContact CG-CE1 3.53Å; P218-F262 HydrophobicContact CG-CG 4.15Å; P218-F262 HydrophobicContact CG-CZ 4Å; L259-F262 PolarHBondContact O-N 2.74Å; L260-F262 PolarHBondContact O-N 3.09Å; F262-W265 WeakPolarHBondContact O-CZ3 3.35Å
263I96.6Very high97Very high117 Ų11757.6 Ų57.660%0.633%0.33SS*.THydrogen-bonded Turntrans-115.91.9-178.368.7169.5000114.2L260L260-I263 HydrophobicContact CD2-CD1 3.59Å; L260-I263 HydrophobicContact CD2-CG1 4.24Å; L260-I263 WeakPolarHBondContact O-CG1 3.34Å; L260-I263 PolarHBondContact O-N 3.38Å
264V97.6Very high96.8Very high53 Ų5356.3 Ų56.332%0.32132%0.316SS..  trans-115.94.2-177.1-58.20000113.4H217 A266 H267H217-V264 WeakPolarHBondContact CD2-CG2 3.1Å; H217-V264 WeakPolarHBondContact NE2-CG2 3.31Å; V264-A266 PolarHBondContact O-N 3.22Å; V264-H267 PolarHBondContact O-CE1 2.97Å; V264-H267 VanDerWaalsContact O-CG 3.28Å; V264-H267 PolarHBondContact O-N 3.35Å; V264-H267 VanDerWaalsContact O-N 3.16Å; V264-H267 PolarHBondContact O-ND1 3.41Å
265W98.1Very high96.6Very high69 Ų6960 Ų6026%0.26134%0.335SS..G310 helixtrans-57.5-30.8-171.976.496.7000114.5H210 W213 F214 H217 F262 H267 H268H210-W265 AromaticContact ND1-NE1 3.75Å; W213-W265 HydrophobicContact CB-CB 4.31Å; W213-W265 VanDerWaalsContact O-CB 3.31Å; W213-W265 WeakPolarHBondContact O-CB 3.38Å; F214-W265 HydrophobicContact CB-CG 4.31Å; F214-W265 HydrophobicContact CD2-CD2 4.01Å; F214-W265 HydrophobicContact CD2-CE3 4.09Å; F214-W265 HydrophobicContact CD2-CG 4.49Å; F214-W265 HydrophobicContact CD2-CZ2 4.42Å; F214-W265 HydrophobicContact CD2-CZ3 4.33Å; F214-W265 HydrophobicContact CE2-CZ3 4.48Å; H217-W265 HydrophobicContact CB-CB 4.09Å; F262-W265 WeakPolarHBondContact O-CZ3 3.35Å; W265-H267 PolarHBondContact O-N 3.49Å; W265-H268 PolarHBondContact O-CD2 3.49Å; W265-H268 PolarHBondContact O-N 3.47Å
266A97.1Very high96.4Very high19 Ų1961.5 Ų61.516%0.15735%0.347CS..G310 helixtrans-67.1-13-176.300000113.7V264 H268 M269 M274V264-A266 PolarHBondContact O-N 3.22Å; A266-H268 PolarHBondContact O-N 2.87Å; A266-M269 WeakPolarHBondContact O-CA 3.31Å; A266-M269 WeakPolarHBondContact O-CB 3.32Å; A266-M269 PolarHBondContact O-N 3.02Å; A266-M274 HydrophobicContact CB-CE 4.23Å; A266-M274 HydrophobicContact CB-SD 4.2Å; A266-M274 WeakPolarHBondContact O-CE 3.47Å
267H97.6Very high96.3Very high70 Ų7065.9 Ų65.932%0.32437%0.365SS..G310 helixtrans-61.8-19.817766.4-135.9000113.9H217 V264 W265 M269 F270H217-H267 AromaticContact CE1-CE1 3.15Å; H217-H267 PolarHBondContact CE1-CE1 3.37Å; H217-H267 AromaticContact CE1-NE2 3.58Å; H217-H267 AromaticContact CG-CE1 3.94Å; H217-H267 AromaticContact ND1-CE1 3.18Å; H217-H267 PolarHBondContact ND1-CE1 3.47Å; H217-H267 AromaticContact ND1-NE2 3.23Å; H217-H267 PolarHBondContact ND1-NE2 3.47Å; H217-H267 AromaticContact NE2-CE1 3.82Å; V264-H267 PolarHBondContact O-CE1 2.97Å; V264-H267 VanDerWaalsContact O-CG 3.28Å; V264-H267 PolarHBondContact O-N 3.35Å; V264-H267 VanDerWaalsContact O-N 3.16Å; V264-H267 PolarHBondContact O-ND1 3.41Å; W265-H267 PolarHBondContact O-N 3.49Å; H267-M269 PolarHBondContact O-N 2.82Å; H267-F270 HydrophobicContact CB-CD2 4.38Å; H267-F270 HydrophobicContact CB-CE1 4.13Å; H267-F270 HydrophobicContact CB-CE2 3.67Å; H267-F270 HydrophobicContact CB-CZ 3.55Å; H267-F270 WeakPolarHBondContact O-CD2 3.27Å
268H97.8Very high96.1Very high67 Ų6767.1 Ų67.131%0.3138%0.375SS..G310 helixtrans-77.5-6.6174.9-64.3-74.1000113W213 H217 W265 A266W213-H268 HydrophobicContact CD2-CB 3.42Å; W213-H268 VanDerWaalsContact CD2-CB 3.42Å; W213-H268 AromaticContact CD2-CD2 3.53Å; W213-H268 AromaticContact CD2-CG 3.56Å; W213-H268 AromaticContact CE2-CG 3.76Å; W213-H268 HydrophobicContact CE3-CB 3.99Å; W213-H268 AromaticContact CE3-CD2 3.24Å; W213-H268 AromaticContact CE3-CG 3.57Å; W213-H268 AromaticContact CE3-NE2 3.52Å; W213-H268 HydrophobicContact CG-CB 3.69Å; W213-H268 HydrophobicContact CH2-CB 4.32Å; W213-H268 AromaticContact CH2-ND1 3.83Å; W213-H268 HydrophobicContact CZ2-CB 3.8Å; W213-H268 HydrophobicContact CZ3-CB 4.4Å; W213-H268 AromaticContact CZ3-CD2 3.71Å; W213-H268 AromaticContact CZ3-CE1 3.65Å; W213-H268 AromaticContact CZ3-CG 3.8Å; W213-H268 AromaticContact CZ3-ND1 3.8Å; W213-H268 AromaticContact CZ3-NE2 3.59Å; H217-H268 AromaticContact ND1-NE2 3.47Å; H217-H268 PolarHBondContact ND1-NE2 2.93Å; W265-H268 PolarHBondContact O-CD2 3.49Å; W265-H268 PolarHBondContact O-N 3.47Å; A266-H268 PolarHBondContact O-N 2.87Å
269M97.4Very high95.9Very high0 Ų072.2 Ų72.20%039%0.393CS..G310 helixtrans-117.813-172.2-56.617559.500112.2I206 Q209 H210 W213 A266 H267 T271 V272 M274I206-M269 HydrophobicContact CG2-CE 3.72Å; Q209-M269 HydrophobicContact CB-CE 3.6Å; Q209-M269 HydrophobicContact CB-CG 4.35Å; Q209-M269 HydrophobicContact CB-SD 3.99Å; H210-M269 HydrophobicContact CB-CE 4.44Å; H210-M269 VanDerWaalsContact CE1-CE 3.43Å; H210-M269 WeakPolarHBondContact CE1-CE 3.23Å; H210-M269 WeakPolarHBondContact NE2-CE 3.41Å; W213-M269 HydrophobicContact CG-CG 4.48Å; A266-M269 WeakPolarHBondContact O-CA 3.31Å; A266-M269 WeakPolarHBondContact O-CB 3.32Å; A266-M269 PolarHBondContact O-N 3.02Å; H267-M269 PolarHBondContact O-N 2.82Å; M269-T271 PolarHBondContact O-N 3.45Å; M269-V272 HydrophobicContact CB-CG1 4.1Å; M269-V272 HydrophobicContact CB-CG2 4.06Å; M269-V272 HydrophobicContact CE-CG2 4.18Å; M269-V272 VanDerWaalsContact O-CG2 3.24Å; M269-V272 WeakPolarHBondContact O-CG2 3.34Å; M269-V272 PolarHBondContact O-N 3.33Å; M269-M274 HydrophobicContact CB-CE 4.07Å; M269-M274 HydrophobicContact CB-SD 4.23Å; M269-M274 WeakPolarHBondContact O-CE 3.48Å
270F96.4Very high95.5Very high98 Ų9872.6 Ų72.643%0.4341%0.414SS..THydrogen-bonded Turntrans-58.3-19.4-175.6-72.1-24.6000115.2H267 M274 R279H267-F270 HydrophobicContact CB-CD2 4.38Å; H267-F270 HydrophobicContact CB-CE1 4.13Å; H267-F270 HydrophobicContact CB-CE2 3.67Å; H267-F270 HydrophobicContact CB-CZ 3.55Å; H267-F270 WeakPolarHBondContact O-CD2 3.27Å; F270-M274 HydrophobicContact CD1-CE 3.69Å; F270-M274 HydrophobicContact CE1-CE 4.33Å; F270-R279 HydrophobicContact CD1-CB 4.39Å; F270-R279 HydrophobicContact CD1-CG 3.86Å; F270-R279 HydrophobicContact CE1-CB 4.36Å; F270-R279 HydrophobicContact CE1-CG 4.23Å
271T95.7Very high95.5Very high139 Ų13971.9 Ų71.985%0.85341%0.412SS*.THydrogen-bonded Turntrans-93.7-3.417955.60000114.1M269 G273M269-T271 PolarHBondContact O-N 3.45Å; T271-G273 PolarHBondContact O-N 2.93Å
272V94.9Very high95.5Very high39 Ų3975.6 Ų75.624%0.23643%0.433CS..SBendtrans-821.5-177.4-47.30000114I206 M269 M274I206-V272 HydrophobicContact CD1-CB 4.35Å; I206-V272 HydrophobicContact CG2-CG2 4.12Å; M269-V272 HydrophobicContact CB-CG1 4.1Å; M269-V272 HydrophobicContact CB-CG2 4.06Å; M269-V272 HydrophobicContact CE-CG2 4.18Å; M269-V272 VanDerWaalsContact O-CG2 3.24Å; M269-V272 WeakPolarHBondContact O-CG2 3.34Å; M269-V272 PolarHBondContact O-N 3.33Å; V272-M274 HydrophobicContact CG2-CG 3.82Å
273G95.1Very high95.4Very high68 Ų6878 Ų7870%0.70145%0.449SS*.  trans87.628.317900000114.8T271T271-G273 PolarHBondContact O-N 2.93Å
274M94Very high95.3Very high23 Ų2375.7 Ų75.711%0.11344%0.441CS..  trans-60.3154.5170.8-63.2-175.2-57.500111.5A266 M269 F270 V272 T278 R279A266-M274 HydrophobicContact CB-CE 4.23Å; A266-M274 HydrophobicContact CB-SD 4.2Å; A266-M274 WeakPolarHBondContact O-CE 3.47Å; M269-M274 HydrophobicContact CB-CE 4.07Å; M269-M274 HydrophobicContact CB-SD 4.23Å; M269-M274 WeakPolarHBondContact O-CE 3.48Å; F270-M274 HydrophobicContact CD1-CE 3.69Å; F270-M274 HydrophobicContact CE1-CE 4.33Å; V272-M274 HydrophobicContact CG2-CG 3.82Å; M274-T278 HydrophobicContact CB-CG2 4.46Å; M274-T278 HydrophobicContact SD-CG2 4.09Å; M274-R279 HydrophobicContact CB-CG 4.14Å; M274-R279 HydrophobicContact CE-CG 4.09Å; M274-R279 PolarHBondContact O-NE 3.42Å; M274-R279 VanDerWaalsContact O-NE 3.13Å
275D94.8Very high95.2Very high84 Ų8477.1 Ų77.145%0.44945%0.448SS..  trans-60.2162177.367.9-84.5000111.9D277 T278 R279D275-D277 VanDerWaalsContact C-N 3.3Å; D275-D277 PolarHBondContact O-N 3.28Å; D275-D277 PolarHBondContact OD2-N 3.15Å; D275-D277 VanDerWaalsContact OD2-N 3.08Å; D275-T278 WeakPolarHBondContact OD1-CB 2.85Å; D275-T278 PolarHBondContact OD1-OG1 3.2Å; D275-T278 WeakPolarHBondContact OD2-CB 3.29Å; D275-T278 PolarHBondContact OD2-N 3.32Å; D275-T278 PolarHBondContact OD2-OG1 3.13Å; D275-T278 VanDerWaalsContact OD2-OG1 3.14Å; D275-R279 WeakPolarHBondContact O-CG 3.26Å; D275-R279 PolarHBondContact O-N 3.03Å; D275-R279 PolarHBondContact O-NE 2.63Å
276V94.5Very high95Very high101 Ų10177.7 Ų77.761%0.61246%0.46SS*.Hα-helixtrans-66.7-36.5-176.2178.20000110.9R279 A280V276-R279 PolarHBondContact O-N 2.94Å; V276-A280 WeakPolarHBondContact O-CB 3.38Å; V276-A280 PolarHBondContact O-N 2.89Å
277D95.7Very high94.9Very high134 Ų13481.9 Ų81.972%0.71748%0.482SS*.Hα-helixtrans-74.2-36.6-174.6-61.5-26.8000111.6D275 R279 A280D275-D277 VanDerWaalsContact C-N 3.3Å; D275-D277 PolarHBondContact O-N 3.28Å; D275-D277 PolarHBondContact OD2-N 3.15Å; D275-D277 VanDerWaalsContact OD2-N 3.08Å; D277-R279 PolarHBondContact O-N 2.97Å; D277-A280 PolarHBondContact O-N 2.93Å
278T92.1Very high94.6Very high76 Ų7682.8 Ų82.847%0.46649%0.494SS..Hα-helixtrans-65.6-27172.5-65.60000112.4M274 D275M274-T278 HydrophobicContact CB-CG2 4.46Å; M274-T278 HydrophobicContact SD-CG2 4.09Å; D275-T278 WeakPolarHBondContact OD1-CB 2.85Å; D275-T278 PolarHBondContact OD1-OG1 3.2Å; D275-T278 WeakPolarHBondContact OD2-CB 3.29Å; D275-T278 PolarHBondContact OD2-N 3.32Å; D275-T278 PolarHBondContact OD2-OG1 3.13Å; D275-T278 VanDerWaalsContact OD2-OG1 3.14Å
279R92.5Very high94.4Very high112 Ų11284.1 Ų84.142%0.42351%0.51SS..Hα-helixtrans-87.3-22.5177.6-69.8-176.8-69.1159.50.2113.4F270 M274 D275 V276 D277F270-R279 HydrophobicContact CD1-CB 4.39Å; F270-R279 HydrophobicContact CD1-CG 3.86Å; F270-R279 HydrophobicContact CE1-CB 4.36Å; F270-R279 HydrophobicContact CE1-CG 4.23Å; M274-R279 HydrophobicContact CB-CG 4.14Å; M274-R279 HydrophobicContact CE-CG 4.09Å; M274-R279 PolarHBondContact O-NE 3.42Å; M274-R279 VanDerWaalsContact O-NE 3.13Å; D275-R279 WeakPolarHBondContact O-CG 3.26Å; D275-R279 PolarHBondContact O-N 3.03Å; D275-R279 PolarHBondContact O-NE 2.63Å; V276-R279 PolarHBondContact O-N 2.94Å; D277-R279 PolarHBondContact O-N 2.97Å
280A89.4Confident94.1Very high135 Ų13591.7 Ų91.7100%1.11656%0.556SS**  trans-78.10-178.600000111.4V276 D277V276-A280 WeakPolarHBondContact O-CB 3.38Å; V276-A280 PolarHBondContact O-N 2.89Å; D277-A280 PolarHBondContact O-N 2.93Å

Retrieved 280 of 280 residues in 213.8 ms (Link to these results)