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Isoform 2 of 14-3-3-like protein G-BOX factor 14 kappa AlphaSync

Canonical isoform description: Is associated with a DNA binding complex that binds to the G box, a well-characterized cis-acting DNA regulatory element found in plant genes. Involved in the regulation of nutrient metabolism1. Negative regulator of freezing tolerance that modulates cold-responsive C-repeat-binding factors (CBF) DREB1A AND DREB1B proteins stability by facilitating their ubiquitin-mediated degradation; this processus is counteracted by B1L2,3.

AlphaFold DB , UniProt , Accession P48348-2 (canonical: P48348), Species ARATH (Arabidopsis thaliana, Mouse-ear cress), Gene GRF8, Length 246 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
1M42.8Very low83.6Confident233 Ų23393.8 Ų93.8100%1.14853%0.525SS*.  0115.60-73.2172.8171.200106T3M1-T3 PolarHBondContact O-N 3.24Å; M1-T3 VanDerWaalsContact O-N 3.08Å
2A57.4Low84.8Confident103 Ų10398.6 Ų98.685%0.85153%0.53SS*.  trans-63.6113169.800000106.3T4A2-T4 PolarHBondContact O-N 3.31Å
3T67.2Low85.9Confident121 Ų12195.2 Ų95.274%0.74251%0.51SS*.PPolyproline II helixtrans-60.4119.317331.80000107.8M1 L5M1-T3 PolarHBondContact O-N 3.24Å; M1-T3 VanDerWaalsContact O-N 3.08Å; T3-L5 PolarHBondContact O-N 3.19Å
4T84.4Confident86.8Confident118 Ų11888.4 Ų88.472%0.72447%0.474SS*.PPolyproline II helixtrans-52.9127.4169.1-48.10000108.1A2 Y10A2-T4 PolarHBondContact O-N 3.31Å; T4-Y10 HydrophobicContact CG2-CE2 4.43Å
5L91.2Very high87.5Confident49 Ų4986.9 Ų86.926%0.25746%0.461SS..PPolyproline II helixtrans-74.6155.8-178.8-60.1178.9000109.9T3 Q9 Y10 M13T3-L5 PolarHBondContact O-N 3.19Å; L5-Q9 HydrophobicContact CB-CB 3.77Å; L5-Q9 HydrophobicContact CD1-CB 4.49Å; L5-Q9 HydrophobicContact CD2-CB 4.35Å; L5-Q9 HydrophobicContact CG-CB 4.43Å; L5-Y10 HydrophobicContact CB-CD1 4.02Å; L5-Y10 HydrophobicContact CB-CD2 3.93Å; L5-Y10 HydrophobicContact CB-CE1 3.82Å; L5-Y10 HydrophobicContact CB-CE2 3.74Å; L5-Y10 HydrophobicContact CB-CG 4.06Å; L5-Y10 HydrophobicContact CD1-CD1 3.9Å; L5-Y10 HydrophobicContact CD1-CE1 3.87Å; L5-Y10 HydrophobicContact CG-CD1 4.44Å; L5-Y10 HydrophobicContact CG-CE1 4.09Å; L5-Y10 PolarHBondContact N-OH 3.26Å; L5-Y10 WeakPolarHBondContact O-CE2 3.27Å; L5-M13 HydrophobicContact CD1-CB 4.49Å; L5-M13 HydrophobicContact CD1-CG 3.69Å
6S93.7Very high88.2Confident57 Ų5786.5 Ų86.540%0.39946%0.459SS..PPolyproline II helixtrans-70.3164.8166.573.30000111.2D8 Q9 Y10S6-D8 VanDerWaalsContact C-N 3.32Å; S6-D8 PolarHBondContact O-N 3.27Å; S6-Q9 WeakPolarHBondContact O-CB 3.43Å; S6-Q9 PolarHBondContact O-N 2.96Å; S6-Q9 VanDerWaalsContact O-N 3.09Å; S6-Q9 VanDerWaalsContact OG-CG 3.3Å; S6-Q9 WeakPolarHBondContact OG-CG 3.23Å; S6-Q9 PolarHBondContact OG-N 2.95Å; S6-Q9 PolarHBondContact OG-OE1 3.01Å; S6-Y10 VanDerWaalsContact O-CD2 3.3Å; S6-Y10 WeakPolarHBondContact O-CD2 3.48Å; S6-Y10 PolarHBondContact O-N 3.36Å
7R94.6Very high88.8Confident87 Ų8781.8 Ų81.833%0.32844%0.435SS..Hα-helixtrans-52.5-49.2175.5-173.5173.7-179.9166.80.2111.7Q9 Y10 V11 L33 E42 E47R7-Q9 VanDerWaalsContact C-N 3.31Å; R7-Q9 PolarHBondContact O-N 3.15Å; R7-Y10 PolarHBondContact O-N 3.46Å; R7-Y10 VanDerWaalsContact O-N 3.17Å; R7-V11 PolarHBondContact O-N 3.21Å; R7-L33 HydrophobicContact CG-CD1 4.38Å; R7-L33 HydrophobicContact CG-CG 4.28Å; R7-E42 PolarHBondContact NH2-O 3.28Å; R7-E47 IonicContact CZ-OE1 2.79Å; R7-E47 IonicContact CZ-OE2 3.1Å; R7-E47 IonicContact NE-OE1 2.64Å; R7-E47 PolarHBondContact NE-OE1 3.04Å; R7-E47 IonicContact NE-OE2 3.65Å; R7-E47 IonicContact NH2-OE1 3.16Å; R7-E47 PolarHBondContact NH2-OE1 3.41Å; R7-E47 IonicContact NH2-OE2 3.31Å; R7-E47 PolarHBondContact NH2-OE2 3.5Å
8D95.7Very high89.3Confident129 Ų12981.1 Ų81.169%0.6943%0.428SS*.Hα-helixtrans-64.2-35.4178.3-60.8-21000112.7S6 V11 Y12S6-D8 VanDerWaalsContact C-N 3.32Å; S6-D8 PolarHBondContact O-N 3.27Å; D8-V11 PolarHBondContact O-N 3.32Å; D8-Y12 WeakPolarHBondContact O-CB 3.38Å; D8-Y12 PolarHBondContact O-N 3.11Å
9Q97Very high89.8Confident97 Ų9785.2 Ų85.245%0.45345%0.445SS..Hα-helixtrans-68.9-37.6175.1-75174.3-3000111.6L5 S6 R7 Y12 M13L5-Q9 HydrophobicContact CB-CB 3.77Å; L5-Q9 HydrophobicContact CD1-CB 4.49Å; L5-Q9 HydrophobicContact CD2-CB 4.35Å; L5-Q9 HydrophobicContact CG-CB 4.43Å; S6-Q9 WeakPolarHBondContact O-CB 3.43Å; S6-Q9 PolarHBondContact O-N 2.96Å; S6-Q9 VanDerWaalsContact O-N 3.09Å; S6-Q9 VanDerWaalsContact OG-CG 3.3Å; S6-Q9 WeakPolarHBondContact OG-CG 3.23Å; S6-Q9 PolarHBondContact OG-N 2.95Å; S6-Q9 PolarHBondContact OG-OE1 3.01Å; R7-Q9 VanDerWaalsContact C-N 3.31Å; R7-Q9 PolarHBondContact O-N 3.15Å; Q9-Y12 PolarHBondContact O-N 2.89Å; Q9-M13 WeakPolarHBondContact O-CB 3.41Å; Q9-M13 VanDerWaalsContact O-CG 3.26Å; Q9-M13 WeakPolarHBondContact O-CG 3.23Å; Q9-M13 PolarHBondContact O-N 3.13Å
10Y97.7Very high90.2Very high24 Ų2484 Ų849%0.09445%0.448CS..Hα-helixtrans-64.2-41.7172.5-77-61000112T4 L5 S6 R7 Y12 M13 A14 F29 Q32 L33T4-Y10 HydrophobicContact CG2-CE2 4.43Å; L5-Y10 HydrophobicContact CB-CD1 4.02Å; L5-Y10 HydrophobicContact CB-CD2 3.93Å; L5-Y10 HydrophobicContact CB-CE1 3.82Å; L5-Y10 HydrophobicContact CB-CE2 3.74Å; L5-Y10 HydrophobicContact CB-CG 4.06Å; L5-Y10 HydrophobicContact CD1-CD1 3.9Å; L5-Y10 HydrophobicContact CD1-CE1 3.87Å; L5-Y10 HydrophobicContact CG-CD1 4.44Å; L5-Y10 HydrophobicContact CG-CE1 4.09Å; L5-Y10 PolarHBondContact N-OH 3.26Å; L5-Y10 WeakPolarHBondContact O-CE2 3.27Å; S6-Y10 VanDerWaalsContact O-CD2 3.3Å; S6-Y10 WeakPolarHBondContact O-CD2 3.48Å; S6-Y10 PolarHBondContact O-N 3.36Å; R7-Y10 PolarHBondContact O-N 3.46Å; R7-Y10 VanDerWaalsContact O-N 3.17Å; Y10-Y12 VanDerWaalsContact C-N 3.34Å; Y10-Y12 PolarHBondContact O-N 2.89Å; Y10-M13 PolarHBondContact O-N 3.05Å; Y10-A14 WeakPolarHBondContact O-CB 3.48Å; Y10-A14 PolarHBondContact O-N 2.74Å; Y10-F29 HydrophobicContact CD1-CB 4.21Å; Y10-F29 HydrophobicContact CD1-CD1 4.12Å; Y10-F29 WeakPolarHBondContact CD1-O 3.35Å; Y10-F29 HydrophobicContact CE1-CD1 4.39Å; Y10-Q32 HydrophobicContact CD1-CB 4.07Å; Y10-Q32 HydrophobicContact CE1-CB 3.43Å; Y10-Q32 VanDerWaalsContact CE1-CB 3.43Å; Y10-Q32 HydrophobicContact CE1-CG 4.08Å; Y10-Q32 HydrophobicContact CE2-CB 4.01Å; Y10-Q32 VanDerWaalsContact CZ-CB 3.41Å; Y10-L33 HydrophobicContact CD2-CB 4.49Å; Y10-L33 HydrophobicContact CG-CB 4.3Å
11V98.1Very high90.5Very high14 Ų1486.7 Ų86.79%0.08546%0.458CS..Hα-helixtrans-59.3-46.2173.3174.20000110.9R7 D8 M13 A14 K15 L33 E47 L50R7-V11 PolarHBondContact O-N 3.21Å; D8-V11 PolarHBondContact O-N 3.32Å; V11-M13 PolarHBondContact O-N 3.5Å; V11-A14 PolarHBondContact O-N 3.19Å; V11-K15 HydrophobicContact CG1-CD 4.22Å; V11-K15 WeakPolarHBondContact O-CG 3.41Å; V11-K15 PolarHBondContact O-N 3.12Å; V11-L33 HydrophobicContact CG2-CD1 3.47Å; V11-L33 VanDerWaalsContact CG2-CD1 3.47Å; V11-E47 HydrophobicContact CG2-CG 3.81Å; V11-L50 HydrophobicContact CG1-CD1 3.92Å
12Y98.2Very high93.2Very high151 Ų15181.7 Ų81.759%0.59243%0.426SS*.Hα-helixtrans-60-46.4176.9175.3-102.1000112.1D8 Q9 Y10 K15 L16D8-Y12 WeakPolarHBondContact O-CB 3.38Å; D8-Y12 PolarHBondContact O-N 3.11Å; Q9-Y12 PolarHBondContact O-N 2.89Å; Y10-Y12 VanDerWaalsContact C-N 3.34Å; Y10-Y12 PolarHBondContact O-N 2.89Å; Y12-K15 PolarHBondContact O-N 3.28Å; Y12-L16 PolarHBondContact O-N 3.3Å
13M98.3Very high95.1Very high55 Ų5579 Ų7927%0.27139%0.394SS..Hα-helixtrans-65.7-37.7178.4-70.2-56.2-61.800112.3L5 Q9 Y10 V11 L16 A17 F29L5-M13 HydrophobicContact CD1-CB 4.49Å; L5-M13 HydrophobicContact CD1-CG 3.69Å; Q9-M13 WeakPolarHBondContact O-CB 3.41Å; Q9-M13 VanDerWaalsContact O-CG 3.26Å; Q9-M13 WeakPolarHBondContact O-CG 3.23Å; Q9-M13 PolarHBondContact O-N 3.13Å; Y10-M13 PolarHBondContact O-N 3.05Å; V11-M13 PolarHBondContact O-N 3.5Å; M13-L16 HydrophobicContact CE-CD2 4.37Å; M13-L16 PolarHBondContact O-N 3.16Å; M13-L16 HydrophobicContact SD-CD2 4.38Å; M13-A17 WeakPolarHBondContact O-CB 3.31Å; M13-A17 PolarHBondContact O-N 2.98Å; M13-F29 HydrophobicContact CB-CB 4.5Å; M13-F29 HydrophobicContact CB-CD1 3.8Å; M13-F29 HydrophobicContact CB-CD2 3.79Å; M13-F29 HydrophobicContact CB-CE1 3.9Å; M13-F29 HydrophobicContact CB-CE2 3.89Å; M13-F29 HydrophobicContact CB-CG 3.77Å; M13-F29 HydrophobicContact CB-CZ 3.96Å; M13-F29 HydrophobicContact CE-CE1 4.06Å; M13-F29 HydrophobicContact CE-CE2 4.03Å; M13-F29 HydrophobicContact CE-CZ 3.5Å; M13-F29 HydrophobicContact CG-CD1 4.48Å; M13-F29 HydrophobicContact CG-CE1 4.26Å; M13-F29 HydrophobicContact CG-CZ 4.44Å
14A98.4Very high96.5Very high0 Ų078.1 Ų78.10%038%0.382CS..Hα-helixtrans-62.9-43.6174.400000111.7Y10 V11 L16 A17 E18 M26 F29 M30 L50Y10-A14 WeakPolarHBondContact O-CB 3.48Å; Y10-A14 PolarHBondContact O-N 2.74Å; V11-A14 PolarHBondContact O-N 3.19Å; A14-L16 VanDerWaalsContact C-N 3.33Å; A14-L16 PolarHBondContact O-N 2.64Å; A14-A17 PolarHBondContact O-N 2.74Å; A14-E18 WeakPolarHBondContact O-CB 3.37Å; A14-E18 PolarHBondContact O-N 3.31Å; A14-M26 HydrophobicContact CB-CG 4.12Å; A14-F29 HydrophobicContact CB-CB 4.37Å; A14-M30 HydrophobicContact CB-CG 4.07Å; A14-M30 HydrophobicContact CB-SD 3.54Å; A14-M30 VanDerWaalsContact CB-SD 3.54Å; A14-L50 HydrophobicContact CB-CD1 4.48Å
15K98.5Very high97.2Very high66 Ų6675.6 Ų75.629%0.28736%0.362SS..Hα-helixtrans-64.7-35174.5-71.8174.7176.8177.50113V11 Y12 Q19 E46 L50V11-K15 HydrophobicContact CG1-CD 4.22Å; V11-K15 WeakPolarHBondContact O-CG 3.41Å; V11-K15 PolarHBondContact O-N 3.12Å; Y12-K15 PolarHBondContact O-N 3.28Å; K15-Q19 WeakPolarHBondContact O-CG 2.99Å; K15-Q19 PolarHBondContact O-N 3.41Å; K15-Q19 VanDerWaalsContact O-N 3.14Å; K15-Q19 PolarHBondContact O-NE2 2.94Å; K15-Q19 VanDerWaalsContact O-NE2 3.13Å; K15-E46 WeakPolarHBondContact CE-OE1 3.4Å; K15-E46 IonicContact NZ-OE1 2.73Å; K15-E46 PolarHBondContact NZ-OE1 3.16Å; K15-E46 IonicContact NZ-OE2 3.43Å; K15-E46 PolarHBondContact NZ-OE2 3.28Å; K15-L50 HydrophobicContact CG-CD1 4.15Å; K15-L50 HydrophobicContact CG-CD2 4.02Å
16L98.3Very high97.5Very high80 Ų8073.3 Ų73.342%0.41935%0.35SS..Hα-helixtrans-68.5-43.8175-175.965.5000110.8Y12 M13 A14 Q19 A20Y12-L16 PolarHBondContact O-N 3.3Å; M13-L16 HydrophobicContact CE-CD2 4.37Å; M13-L16 PolarHBondContact O-N 3.16Å; M13-L16 HydrophobicContact SD-CD2 4.38Å; A14-L16 VanDerWaalsContact C-N 3.33Å; A14-L16 PolarHBondContact O-N 2.64Å; L16-Q19 PolarHBondContact O-N 3.31Å; L16-A20 WeakPolarHBondContact O-CB 3.21Å; L16-A20 PolarHBondContact O-N 3.43Å
17A98.3Very high97.7Very high6 Ų671 Ų715%0.0533%0.334CS..Hα-helixtrans-64.2-38.9176.400000112M13 A14 A20 E21 R22 E25 M26 F29M13-A17 WeakPolarHBondContact O-CB 3.31Å; M13-A17 PolarHBondContact O-N 2.98Å; A14-A17 PolarHBondContact O-N 2.74Å; A17-A20 CarbonylContact O-C 3.58Å; A17-A20 PolarHBondContact O-N 2.81Å; A17-E21 PolarHBondContact O-N 3.31Å; A17-R22 HydrophobicContact CB-CB 4.38Å; A17-R22 PolarHBondContact O-N 2.86Å; A17-E25 HydrophobicContact CB-CB 4.48Å; A17-M26 HydrophobicContact CB-CB 3.78Å; A17-M26 HydrophobicContact CB-CG 4.31Å; A17-F29 HydrophobicContact CB-CD2 4.19Å; A17-F29 HydrophobicContact CB-CE2 4.16Å
18E98.2Very high97.9Very high69 Ų6972.4 Ų72.432%0.32234%0.344SS..Hα-helixtrans-58.7-51.1172.9-174.8-178.2-168.300111.6A14 A20 E21 M26 L50 V53A14-E18 WeakPolarHBondContact O-CB 3.37Å; A14-E18 PolarHBondContact O-N 3.31Å; E18-A20 PolarHBondContact O-N 3.14Å; E18-E21 PolarHBondContact O-N 3.17Å; E18-M26 HydrophobicContact CB-CE 3.97Å; E18-M26 HydrophobicContact CB-SD 3.91Å; E18-M26 HydrophobicContact CG-CE 4.31Å; E18-M26 HydrophobicContact CG-SD 4.41Å; E18-L50 WeakPolarHBondContact OE2-CD2 3.17Å; E18-V53 HydrophobicContact CG-CG1 4.35Å
19Q97.9Very high98Very high160 Ų16068 Ų6875%0.74832%0.319SS*.Hα-helixtrans-63.4-26.2177.8-75.2172.372.300113.4K15 L16K15-Q19 WeakPolarHBondContact O-CG 2.99Å; K15-Q19 PolarHBondContact O-N 3.41Å; K15-Q19 VanDerWaalsContact O-N 3.14Å; K15-Q19 PolarHBondContact O-NE2 2.94Å; K15-Q19 VanDerWaalsContact O-NE2 3.13Å; L16-Q19 PolarHBondContact O-N 3.31Å
20A97.9Very high98Very high60 Ų6063.4 Ų63.450%0.49630%0.297SS..THydrogen-bonded Turntrans-90.61.5175.500000113.3L16 A17 E18 R22L16-A20 WeakPolarHBondContact O-CB 3.21Å; L16-A20 PolarHBondContact O-N 3.43Å; A17-A20 CarbonylContact O-C 3.58Å; A17-A20 PolarHBondContact O-N 2.81Å; E18-A20 PolarHBondContact O-N 3.14Å; A20-R22 HydrophobicContact CB-CG 3.83Å; A20-R22 PolarHBondContact O-N 3.27Å; A20-R22 VanDerWaalsContact O-N 3.16Å
21E97.6Very high98Very high142 Ų14264.6 Ų64.666%0.66430%0.303SS*.THydrogen-bonded Turntrans53.329.3-173.5-58-176.6-16400113.5A17 E18 Y23A17-E21 PolarHBondContact O-N 3.31Å; E18-E21 PolarHBondContact O-N 3.17Å; E21-Y23 HydrophobicContact CB-CE2 3.9Å; E21-Y23 HydrophobicContact CG-CE2 4.4Å; E21-Y23 WeakPolarHBondContact O-CD2 3.46Å; E21-Y23 PolarHBondContact O-N 3.27Å
22R98.1Very high97.9Very high127 Ų12768.6 Ų68.648%0.47932%0.321SS..  trans-92.962.8178.1-61.9-69.3-71.3162.5-2.2110.2A17 A20 E24 E25 M26A17-R22 HydrophobicContact CB-CB 4.38Å; A17-R22 PolarHBondContact O-N 2.86Å; A20-R22 HydrophobicContact CB-CG 3.83Å; A20-R22 PolarHBondContact O-N 3.27Å; A20-R22 VanDerWaalsContact O-N 3.16Å; R22-E24 VanDerWaalsContact C-N 3.29Å; R22-E24 PolarHBondContact O-N 2.96Å; R22-E25 HydrophobicContact CB-CB 4.26Å; R22-E25 HydrophobicContact CB-CG 4.44Å; R22-E25 IonicContact CZ-OE1 2.67Å; R22-E25 IonicContact NE-OE1 3.78Å; R22-E25 PolarHBondContact NE-OE1 3.2Å; R22-E25 IonicContact NH2-OE1 3.42Å; R22-E25 PolarHBondContact NH2-OE1 3.44Å; R22-E25 PolarHBondContact O-N 2.88Å; R22-E25 VanDerWaalsContact O-N 3.11Å; R22-M26 PolarHBondContact O-N 3.2Å
23Y98.2Very high97.8Very high47 Ų4761.6 Ų61.618%0.18429%0.294CS..Hα-helixtrans-65.2-28.3-170-57.8-70.4000114.2E21 M26 V27 V53 N57E21-Y23 HydrophobicContact CB-CE2 3.9Å; E21-Y23 HydrophobicContact CG-CE2 4.4Å; E21-Y23 WeakPolarHBondContact O-CD2 3.46Å; E21-Y23 PolarHBondContact O-N 3.27Å; Y23-M26 HydrophobicContact CD1-SD 4.1Å; Y23-M26 WeakPolarHBondContact O-CB 3.36Å; Y23-M26 PolarHBondContact O-N 3.44Å; Y23-V27 WeakPolarHBondContact O-CG2 3.47Å; Y23-V27 PolarHBondContact O-N 3.12Å; Y23-V53 HydrophobicContact CE1-CG1 4.45Å; Y23-N57 HydrophobicContact CD1-CB 3.54Å; Y23-N57 HydrophobicContact CD2-CB 3.5Å; Y23-N57 HydrophobicContact CE1-CB 3.82Å; Y23-N57 VanDerWaalsContact CE1-CG 3.49Å; Y23-N57 WeakPolarHBondContact CE1-ND2 3.27Å; Y23-N57 HydrophobicContact CE2-CB 3.78Å; Y23-N57 HydrophobicContact CG-CB 3.36Å; Y23-N57 VanDerWaalsContact CZ-CG 3.46Å
24E97.4Very high97.7Very high102 Ų10259 Ų5948%0.47728%0.281SS..Hα-helixtrans-65.6-38.9174-63.379.5-176.500111.8R22 Q28 V58R22-E24 VanDerWaalsContact C-N 3.29Å; R22-E24 PolarHBondContact O-N 2.96Å; E24-Q28 WeakPolarHBondContact O-CG 3.38Å; E24-Q28 PolarHBondContact O-N 3.37Å; E24-V58 HydrophobicContact CG-CG2 4.24Å
25E97.7Very high97.4Very high66 Ų6661.6 Ų61.631%0.30830%0.3SS..Hα-helixtrans-71-39.2173.1-66.9176.2-144.900110.7A17 R22 V27 Q28 F29A17-E25 HydrophobicContact CB-CB 4.48Å; R22-E25 HydrophobicContact CB-CB 4.26Å; R22-E25 HydrophobicContact CB-CG 4.44Å; R22-E25 IonicContact CZ-OE1 2.67Å; R22-E25 IonicContact NE-OE1 3.78Å; R22-E25 PolarHBondContact NE-OE1 3.2Å; R22-E25 IonicContact NH2-OE1 3.42Å; R22-E25 PolarHBondContact NH2-OE1 3.44Å; R22-E25 PolarHBondContact O-N 2.88Å; R22-E25 VanDerWaalsContact O-N 3.11Å; E25-V27 VanDerWaalsContact C-N 3.29Å; E25-V27 PolarHBondContact O-N 3.2Å; E25-Q28 WeakPolarHBondContact O-CB 3.34Å; E25-Q28 PolarHBondContact O-N 2.89Å; E25-Q28 VanDerWaalsContact O-N 3.09Å; E25-F29 HydrophobicContact CB-CE2 4.01Å; E25-F29 WeakPolarHBondContact O-CD2 3.39Å; E25-F29 WeakPolarHBondContact O-CG 3.37Å; E25-F29 PolarHBondContact O-N 3.12Å
26M98.1Very high97.1Very high0 Ų061.8 Ų61.80%032%0.32CS..Hα-helixtrans-56.9-43.9174.4-165-171.6177.600111.3A14 A17 E18 R22 Y23 F29 M30 L50 V53 A54A14-M26 HydrophobicContact CB-CG 4.12Å; A17-M26 HydrophobicContact CB-CB 3.78Å; A17-M26 HydrophobicContact CB-CG 4.31Å; E18-M26 HydrophobicContact CB-CE 3.97Å; E18-M26 HydrophobicContact CB-SD 3.91Å; E18-M26 HydrophobicContact CG-CE 4.31Å; E18-M26 HydrophobicContact CG-SD 4.41Å; R22-M26 PolarHBondContact O-N 3.2Å; Y23-M26 HydrophobicContact CD1-SD 4.1Å; Y23-M26 WeakPolarHBondContact O-CB 3.36Å; Y23-M26 PolarHBondContact O-N 3.44Å; M26-F29 PolarHBondContact O-N 3.31Å; M26-M30 VanDerWaalsContact O-CG 3.3Å; M26-M30 WeakPolarHBondContact O-CG 3.39Å; M26-M30 PolarHBondContact O-N 3.43Å; M26-L50 HydrophobicContact CE-CB 3.94Å; M26-L50 HydrophobicContact CE-CD2 3.55Å; M26-L50 HydrophobicContact CE-CG 4.37Å; M26-L50 WeakPolarHBondContact CE-O 3.49Å; M26-V53 HydrophobicContact CE-CB 4.21Å; M26-V53 HydrophobicContact CE-CG1 4.1Å; M26-V53 HydrophobicContact SD-CG1 4.31Å; M26-A54 HydrophobicContact CB-CB 3.97Å; M26-A54 HydrophobicContact CE-CB 4.17Å; M26-A54 HydrophobicContact CG-CB 3.63Å; M26-A54 HydrophobicContact SD-CB 3.59Å; M26-A54 VanDerWaalsContact SD-CB 3.59Å
27V98.4Very high96.5Very high10 Ų1058.4 Ų58.46%0.06130%0.303CS..Hα-helixtrans-56.5-52.7172.7166.50000109.6Y23 E25 F29 M30 E31 A54 Y55 V58Y23-V27 WeakPolarHBondContact O-CG2 3.47Å; Y23-V27 PolarHBondContact O-N 3.12Å; E25-V27 VanDerWaalsContact C-N 3.29Å; E25-V27 PolarHBondContact O-N 3.2Å; V27-F29 VanDerWaalsContact C-N 3.33Å; V27-F29 PolarHBondContact O-N 3.24Å; V27-M30 CarbonylContact O-C 3.58Å; V27-M30 PolarHBondContact O-N 2.95Å; V27-E31 HydrophobicContact CG1-CG 3.92Å; V27-E31 VanDerWaalsContact O-CG 3.31Å; V27-E31 WeakPolarHBondContact O-CG 3.42Å; V27-E31 PolarHBondContact O-N 3.44Å; V27-A54 HydrophobicContact CG2-CB 3.81Å; V27-Y55 HydrophobicContact CG1-CD1 4.38Å; V27-Y55 HydrophobicContact CG1-CE1 3.77Å; V27-Y55 HydrophobicContact CG1-CE2 3.93Å; V27-Y55 HydrophobicContact CG2-CD1 4.11Å; V27-Y55 HydrophobicContact CG2-CD2 4.06Å; V27-Y55 HydrophobicContact CG2-CE1 4.32Å; V27-Y55 HydrophobicContact CG2-CE2 4.27Å; V27-Y55 HydrophobicContact CG2-CG 3.99Å; V27-V58 HydrophobicContact CG2-CG2 3.95Å
28Q97.5Very high95.6Very high116 Ų11658.5 Ų58.554%0.54230%0.304SS..Hα-helixtrans-55.7-44.6-179.7-67.1171.32000112.8E24 E25 M30 E31 Q32E24-Q28 WeakPolarHBondContact O-CG 3.38Å; E24-Q28 PolarHBondContact O-N 3.37Å; E25-Q28 WeakPolarHBondContact O-CB 3.34Å; E25-Q28 PolarHBondContact O-N 2.89Å; E25-Q28 VanDerWaalsContact O-N 3.09Å; Q28-M30 VanDerWaalsContact C-N 3.35Å; Q28-M30 PolarHBondContact O-N 3.03Å; Q28-E31 PolarHBondContact O-N 2.86Å; Q28-Q32 VanDerWaalsContact O-CG 3.32Å; Q28-Q32 WeakPolarHBondContact O-CG 3.42Å; Q28-Q32 PolarHBondContact O-N 3.41Å
29F97.9Very high94.5Very high36 Ų3660.4 Ų60.416%0.15832%0.322CS..Hα-helixtrans-62.4-42.2176.4-63.6-51.2000112Y10 M13 A14 A17 E25 M26 V27 Q32 L33Y10-F29 HydrophobicContact CD1-CB 4.21Å; Y10-F29 HydrophobicContact CD1-CD1 4.12Å; Y10-F29 WeakPolarHBondContact CD1-O 3.35Å; Y10-F29 HydrophobicContact CE1-CD1 4.39Å; M13-F29 HydrophobicContact CB-CB 4.5Å; M13-F29 HydrophobicContact CB-CD1 3.8Å; M13-F29 HydrophobicContact CB-CD2 3.79Å; M13-F29 HydrophobicContact CB-CE1 3.9Å; M13-F29 HydrophobicContact CB-CE2 3.89Å; M13-F29 HydrophobicContact CB-CG 3.77Å; M13-F29 HydrophobicContact CB-CZ 3.96Å; M13-F29 HydrophobicContact CE-CE1 4.06Å; M13-F29 HydrophobicContact CE-CE2 4.03Å; M13-F29 HydrophobicContact CE-CZ 3.5Å; M13-F29 HydrophobicContact CG-CD1 4.48Å; M13-F29 HydrophobicContact CG-CE1 4.26Å; M13-F29 HydrophobicContact CG-CZ 4.44Å; A14-F29 HydrophobicContact CB-CB 4.37Å; A17-F29 HydrophobicContact CB-CD2 4.19Å; A17-F29 HydrophobicContact CB-CE2 4.16Å; E25-F29 HydrophobicContact CB-CE2 4.01Å; E25-F29 WeakPolarHBondContact O-CD2 3.39Å; E25-F29 WeakPolarHBondContact O-CG 3.37Å; E25-F29 PolarHBondContact O-N 3.12Å; M26-F29 PolarHBondContact O-N 3.31Å; V27-F29 VanDerWaalsContact C-N 3.33Å; V27-F29 PolarHBondContact O-N 3.24Å; F29-Q32 PolarHBondContact O-N 2.98Å; F29-L33 PolarHBondContact O-N 3.04Å
30M97.9Very high93.5Very high0 Ų057.7 Ų57.70%033%0.327CS..Hα-helixtrans-71.5-35.5179.6-66.4-52.9-57.400112.8A14 M26 V27 Q28 Q32 L33 V34 E47 L50 L51A14-M30 HydrophobicContact CB-CG 4.07Å; A14-M30 HydrophobicContact CB-SD 3.54Å; A14-M30 VanDerWaalsContact CB-SD 3.54Å; M26-M30 VanDerWaalsContact O-CG 3.3Å; M26-M30 WeakPolarHBondContact O-CG 3.39Å; M26-M30 PolarHBondContact O-N 3.43Å; V27-M30 CarbonylContact O-C 3.58Å; V27-M30 PolarHBondContact O-N 2.95Å; Q28-M30 VanDerWaalsContact C-N 3.35Å; Q28-M30 PolarHBondContact O-N 3.03Å; M30-Q32 VanDerWaalsContact C-N 3.33Å; M30-Q32 PolarHBondContact O-N 3.06Å; M30-L33 HydrophobicContact CE-CD1 4.14Å; M30-L33 HydrophobicContact CE-CD2 4.32Å; M30-L33 PolarHBondContact O-N 3.42Å; M30-L33 HydrophobicContact SD-CD1 4.32Å; M30-V34 VanDerWaalsContact O-CG2 3.27Å; M30-V34 WeakPolarHBondContact O-CG2 3.49Å; M30-V34 PolarHBondContact O-N 2.71Å; M30-E47 HydrophobicContact CE-CB 4.36Å; M30-E47 WeakPolarHBondContact CE-O 3.47Å; M30-L50 HydrophobicContact CE-CB 4.04Å; M30-L50 HydrophobicContact SD-CB 3.89Å; M30-L51 HydrophobicContact CB-CD1 3.67Å; M30-L51 HydrophobicContact CE-CB 3.97Å
31E96.9Very high92.8Very high49 Ų4956 Ų5623%0.22932%0.315CS..Hα-helixtrans-62-42173.9-63.4-164.115300111.2V27 Q28 S35 Y55 L109V27-E31 HydrophobicContact CG1-CG 3.92Å; V27-E31 VanDerWaalsContact O-CG 3.31Å; V27-E31 WeakPolarHBondContact O-CG 3.42Å; V27-E31 PolarHBondContact O-N 3.44Å; Q28-E31 PolarHBondContact O-N 2.86Å; E31-S35 WeakPolarHBondContact O-CB 3.46Å; E31-S35 PolarHBondContact O-N 2.64Å; E31-S35 PolarHBondContact O-OG 3.05Å; E31-Y55 VanDerWaalsContact CG-OH 3.23Å; E31-Y55 WeakPolarHBondContact CG-OH 3.24Å; E31-Y55 PolarHBondContact OE1-OH 3.11Å; E31-L109 HydrophobicContact CB-CD1 4.17Å; E31-L109 HydrophobicContact CG-CD1 3.79Å
32Q95.9Very high92.6Very high98 Ų9851.5 Ų51.546%0.45829%0.294SS..Hα-helixtrans-67.5-40.5176.2-64.9-59.7-53.200111.8Y10 Q28 F29 M30 S35 G36Y10-Q32 HydrophobicContact CD1-CB 4.07Å; Y10-Q32 HydrophobicContact CE1-CB 3.43Å; Y10-Q32 VanDerWaalsContact CE1-CB 3.43Å; Y10-Q32 HydrophobicContact CE1-CG 4.08Å; Y10-Q32 HydrophobicContact CE2-CB 4.01Å; Y10-Q32 VanDerWaalsContact CZ-CB 3.41Å; Q28-Q32 VanDerWaalsContact O-CG 3.32Å; Q28-Q32 WeakPolarHBondContact O-CG 3.42Å; Q28-Q32 PolarHBondContact O-N 3.41Å; F29-Q32 PolarHBondContact O-N 2.98Å; M30-Q32 VanDerWaalsContact C-N 3.33Å; M30-Q32 PolarHBondContact O-N 3.06Å; Q32-S35 PolarHBondContact O-N 2.79Å; Q32-G36 PolarHBondContact O-N 3.34Å
33L96.1Very high92.5Very high4 Ų446 Ų462%0.02127%0.274CS..Hα-helixtrans-58.1-51.5173.5-175.8155.2000111.2R7 Y10 V11 F29 M30 S35 G36 A37 L43 E47R7-L33 HydrophobicContact CG-CD1 4.38Å; R7-L33 HydrophobicContact CG-CG 4.28Å; Y10-L33 HydrophobicContact CD2-CB 4.49Å; Y10-L33 HydrophobicContact CG-CB 4.3Å; V11-L33 HydrophobicContact CG2-CD1 3.47Å; V11-L33 VanDerWaalsContact CG2-CD1 3.47Å; F29-L33 PolarHBondContact O-N 3.04Å; M30-L33 HydrophobicContact CE-CD1 4.14Å; M30-L33 HydrophobicContact CE-CD2 4.32Å; M30-L33 PolarHBondContact O-N 3.42Å; M30-L33 HydrophobicContact SD-CD1 4.32Å; L33-S35 PolarHBondContact O-N 3.42Å; L33-G36 PolarHBondContact O-N 3.46Å; L33-A37 HydrophobicContact CD2-CB 4.43Å; L33-A37 WeakPolarHBondContact O-CB 3.35Å; L33-A37 PolarHBondContact O-N 2.88Å; L33-L43 HydrophobicContact CD2-CG 4.32Å; L33-E47 HydrophobicContact CD1-CG 4.18Å; L33-E47 HydrophobicContact CD2-CB 4.48Å; L33-E47 HydrophobicContact CD2-CG 4.38Å
34V96.4Very high92.4Very high0 Ų047 Ų470%029%0.285CS..Hα-helixtrans-59.4-48.2-179.5172.30000110.4M30 G36 A37 T38 L43 L51 L109 H113 L114M30-V34 VanDerWaalsContact O-CG2 3.27Å; M30-V34 WeakPolarHBondContact O-CG2 3.49Å; M30-V34 PolarHBondContact O-N 2.71Å; V34-G36 VanDerWaalsContact C-N 3.28Å; V34-G36 PolarHBondContact O-N 2.86Å; V34-A37 PolarHBondContact O-N 3.22Å; V34-T38 HydrophobicContact CG1-CG2 4.37Å; V34-T38 WeakPolarHBondContact O-CB 3.4Å; V34-T38 PolarHBondContact O-N 2.95Å; V34-T38 PolarHBondContact O-OG1 2.64Å; V34-L43 HydrophobicContact CG2-CD1 4.37Å; V34-L43 HydrophobicContact CG2-CD2 3.96Å; V34-L51 HydrophobicContact CG2-CD1 4.29Å; V34-L51 HydrophobicContact CG2-CD2 4.35Å; V34-L109 HydrophobicContact CG1-CD2 4.07Å; V34-H113 HydrophobicContact CG1-CB 3.64Å; V34-L114 HydrophobicContact CG1-CD2 3.79Å; V34-L114 HydrophobicContact CG1-CG 4.07Å; V34-L114 HydrophobicContact CG2-CD2 4Å
35S92.5Very high92.2Very high56 Ų5646 Ų4639%0.39229%0.286SS..Hα-helixtrans-63.2-32.9-179.1-55.90000112.9E31 Q32 L33E31-S35 WeakPolarHBondContact O-CB 3.46Å; E31-S35 PolarHBondContact O-N 2.64Å; E31-S35 PolarHBondContact O-OG 3.05Å; Q32-S35 PolarHBondContact O-N 2.79Å; L33-S35 PolarHBondContact O-N 3.42Å
36G90.9Very high92.2Very high69 Ų6947.5 Ų47.571%0.71129%0.293SS*.Hα-helixtrans-85-26.417800000114.7Q32 L33 V34Q32-G36 PolarHBondContact O-N 3.34Å; L33-G36 PolarHBondContact O-N 3.46Å; V34-G36 VanDerWaalsContact C-N 3.28Å; V34-G36 PolarHBondContact O-N 2.86Å
37A86.3Confident92.1Very high9 Ų947.9 Ų47.97%0.07430%0.295CS..Hα-helixtrans-92.6-26.7-17600000113.7L33 V34 A40 G41L33-A37 HydrophobicContact CD2-CB 4.43Å; L33-A37 WeakPolarHBondContact O-CB 3.35Å; L33-A37 PolarHBondContact O-N 2.88Å; V34-A37 PolarHBondContact O-N 3.22Å; A37-A40 PolarHBondContact O-N 3.01Å; A37-G41 PolarHBondContact O-N 3.01Å
38T80.6Confident92.1Very high9 Ų947.9 Ų47.96%0.05529%0.294CS..THydrogen-bonded Turntrans-109.7153.6-175.5650000111.1V34 A40 G41 L43 H113V34-T38 HydrophobicContact CG1-CG2 4.37Å; V34-T38 WeakPolarHBondContact O-CB 3.4Å; V34-T38 PolarHBondContact O-N 2.95Å; V34-T38 PolarHBondContact O-OG1 2.64Å; T38-A40 VanDerWaalsContact C-N 3.25Å; T38-G41 WeakPolarHBondContact CG2-O 3.37Å; T38-L43 HydrophobicContact CG2-CD1 3.77Å; T38-H113 HydrophobicContact CG2-CB 4.36Å; T38-H113 WeakPolarHBondContact OG1-CB 3.49Å; T38-H113 PolarHBondContact OG1-ND1 3.46Å
39P75Confident92Very high108 Ų10845.8 Ų45.870%0.70129%0.286SS*.THydrogen-bonded Turncis-81.57.7-135.2-36.6000113.8G41P39-G41 PolarHBondContact O-N 2.86Å
40A76.2Confident92Very high103 Ų10344.5 Ų44.585%0.85128%0.281SS*.THydrogen-bonded Turntrans-64.7-23.9-175.400000113.9A37 T38A37-A40 PolarHBondContact O-N 3.01Å; T38-A40 VanDerWaalsContact C-N 3.25Å
41G83.8Confident92Very high24 Ų2444.5 Ų44.525%0.24728%0.281CS..SBendtrans-155.6165.6175.200000113.5A37 T38 P39A37-G41 PolarHBondContact O-N 3.01Å; T38-G41 WeakPolarHBondContact CG2-O 3.37Å; P39-G41 PolarHBondContact O-N 2.86Å
42E92.3Very high92.1Very high48 Ų4843.7 Ų43.722%0.22428%0.281CS..PPolyproline II helixtrans-83.1150.7172.9-165.5171160.300110.2R7 T119 S123R7-E42 PolarHBondContact NH2-O 3.28Å; E42-T119 WeakPolarHBondContact OE2-CB 3.24Å; E42-T119 PolarHBondContact OE2-N 2.87Å; E42-T119 PolarHBondContact OE2-OG1 3.13Å; E42-S123 WeakPolarHBondContact OE1-CB 3.46Å; E42-S123 PolarHBondContact OE1-OG 3.1Å
43L95.7Very high92.2Very high11 Ų1141.1 Ų41.16%0.05827%0.272CS..PPolyproline II helixtrans-68.8144.5170.1-85.561.2000109.7L33 V34 T38 E47 L51 L114L33-L43 HydrophobicContact CD2-CG 4.32Å; V34-L43 HydrophobicContact CG2-CD1 4.37Å; V34-L43 HydrophobicContact CG2-CD2 3.96Å; T38-L43 HydrophobicContact CG2-CD1 3.77Å; L43-E47 VanDerWaalsContact CA-OE2 3.31Å; L43-E47 WeakPolarHBondContact CA-OE2 3.46Å; L43-E47 HydrophobicContact CB-CB 4.06Å; L43-E47 HydrophobicContact CD2-CB 4.25Å; L43-E47 HydrophobicContact CG-CB 4.05Å; L43-L51 HydrophobicContact CD2-CD2 4.37Å; L43-L114 HydrophobicContact CD1-CD2 3.69Å; L43-L114 HydrophobicContact CD2-CD2 3.71Å; L43-L114 HydrophobicContact CG-CD2 4.31Å
44T95.6Very high92.3Very high68 Ų6841 Ų4142%0.41727%0.271SS..PPolyproline II helixtrans-69.4163.9168.170.60000110.3E46 E47 R48T44-E46 PolarHBondContact O-N 3.29Å; T44-E47 PolarHBondContact N-OE2 3.11Å; T44-E47 PolarHBondContact O-N 3.24Å; T44-E47 WeakPolarHBondContact OG1-CG 3.42Å; T44-E47 PolarHBondContact OG1-N 3.36Å; T44-E47 PolarHBondContact OG1-OE2 2.98Å; T44-R48 WeakPolarHBondContact O-CB 3.4Å; T44-R48 PolarHBondContact O-N 3.04Å
45V94.5Very high92.4Very high83 Ų8341 Ų4150%0.50327%0.271SS..Hα-helixtrans-56.2-39.4174.41740000111.2N49V45-N49 WeakPolarHBondContact O-CB 3.3Å; V45-N49 PolarHBondContact O-N 3.24Å; V45-N49 PolarHBondContact O-ND2 2.92Å; V45-N49 PolarHBondContact O-OD1 2.85Å
46E96.5Very high92.6Very high97 Ų9745.3 Ų45.345%0.45328%0.283SS..Hα-helixtrans-63.2-49.2176.9179.9172-125.800111.8K15 T44 R48 N49 L50K15-E46 WeakPolarHBondContact CE-OE1 3.4Å; K15-E46 IonicContact NZ-OE1 2.73Å; K15-E46 PolarHBondContact NZ-OE1 3.16Å; K15-E46 IonicContact NZ-OE2 3.43Å; K15-E46 PolarHBondContact NZ-OE2 3.28Å; T44-E46 PolarHBondContact O-N 3.29Å; E46-R48 VanDerWaalsContact C-N 3.35Å; E46-R48 PolarHBondContact O-N 3.22Å; E46-N49 PolarHBondContact O-N 3.42Å; E46-L50 HydrophobicContact CG-CD1 4.17Å; E46-L50 WeakPolarHBondContact O-CG 3.41Å; E46-L50 PolarHBondContact O-N 2.73Å
47E97.5Very high93Very high8 Ų844.9 Ų44.94%0.03726%0.264CS..Hα-helixtrans-63.5-41.7179.6-69.5167.7157.100111.9R7 V11 M30 L33 L43 T44 N49 L50 L51R7-E47 IonicContact CZ-OE1 2.79Å; R7-E47 IonicContact CZ-OE2 3.1Å; R7-E47 IonicContact NE-OE1 2.64Å; R7-E47 PolarHBondContact NE-OE1 3.04Å; R7-E47 IonicContact NE-OE2 3.65Å; R7-E47 IonicContact NH2-OE1 3.16Å; R7-E47 PolarHBondContact NH2-OE1 3.41Å; R7-E47 IonicContact NH2-OE2 3.31Å; R7-E47 PolarHBondContact NH2-OE2 3.5Å; V11-E47 HydrophobicContact CG2-CG 3.81Å; M30-E47 HydrophobicContact CE-CB 4.36Å; M30-E47 WeakPolarHBondContact CE-O 3.47Å; L33-E47 HydrophobicContact CD1-CG 4.18Å; L33-E47 HydrophobicContact CD2-CB 4.48Å; L33-E47 HydrophobicContact CD2-CG 4.38Å; L43-E47 VanDerWaalsContact CA-OE2 3.31Å; L43-E47 WeakPolarHBondContact CA-OE2 3.46Å; L43-E47 HydrophobicContact CB-CB 4.06Å; L43-E47 HydrophobicContact CD2-CB 4.25Å; L43-E47 HydrophobicContact CG-CB 4.05Å; T44-E47 PolarHBondContact N-OE2 3.11Å; T44-E47 PolarHBondContact O-N 3.24Å; T44-E47 WeakPolarHBondContact OG1-CG 3.42Å; T44-E47 PolarHBondContact OG1-N 3.36Å; T44-E47 PolarHBondContact OG1-OE2 2.98Å; E47-N49 VanDerWaalsContact C-N 3.31Å; E47-N49 PolarHBondContact O-N 2.95Å; E47-L50 PolarHBondContact O-N 3.36Å; E47-L51 WeakPolarHBondContact O-CB 3.43Å; E47-L51 PolarHBondContact O-N 3.31Å
48R97Very high93.6Very high10 Ų1044.7 Ų44.74%0.03826%0.262CS..Hα-helixtrans-59.5-43.1174.7-178.8-169.275.3-173.11.1111.3T44 E46 S52 E122 F126 Y127T44-R48 WeakPolarHBondContact O-CB 3.4Å; T44-R48 PolarHBondContact O-N 3.04Å; E46-R48 VanDerWaalsContact C-N 3.35Å; E46-R48 PolarHBondContact O-N 3.22Å; R48-S52 WeakPolarHBondContact O-CB 3.44Å; R48-S52 PolarHBondContact O-N 3.43Å; R48-E122 IonicContact CZ-OE1 3.49Å; R48-E122 VanDerWaalsContact CZ-OE1 3.23Å; R48-E122 IonicContact NH1-OE1 2.87Å; R48-E122 PolarHBondContact NH1-OE1 3.08Å; R48-E122 IonicContact NH2-OE1 3.92Å; R48-E122 PolarHBondContact NH2-OE1 2.61Å; R48-F126 VanDerWaalsContact CD-CD1 3.49Å; R48-F126 HydrophobicContact CG-CD1 3.54Å; R48-F126 HydrophobicContact CG-CD2 4.42Å; R48-F126 HydrophobicContact CG-CE1 3.28Å; R48-F126 HydrophobicContact CG-CE2 4.21Å; R48-F126 HydrophobicContact CG-CG 4.1Å; R48-F126 HydrophobicContact CG-CZ 3.63Å; R48-Y127 HydrophobicContact CG-CE1 3.89Å
49N96.2Very high94.4Very high72 Ų7244.4 Ų44.439%0.38526%0.26SS..Hα-helixtrans-67.9-42.9178.6-70.4-9.2000111.3V45 E46 E47 L51 S52 V53V45-N49 WeakPolarHBondContact O-CB 3.3Å; V45-N49 PolarHBondContact O-N 3.24Å; V45-N49 PolarHBondContact O-ND2 2.92Å; V45-N49 PolarHBondContact O-OD1 2.85Å; E46-N49 PolarHBondContact O-N 3.42Å; E47-N49 VanDerWaalsContact C-N 3.31Å; E47-N49 PolarHBondContact O-N 2.95Å; N49-L51 PolarHBondContact O-N 3.04Å; N49-S52 WeakPolarHBondContact O-CB 3.45Å; N49-S52 PolarHBondContact O-N 2.88Å; N49-V53 WeakPolarHBondContact O-CG2 3.5Å; N49-V53 PolarHBondContact O-N 2.86Å
50L98.4Very high95.5Very high9 Ų940.8 Ų40.85%0.04724%0.242CC..Hα-helixtrans-59.5-44.6174.8-72.6170.3000111.9V11 A14 K15 E18 M26 M30 E46 E47 S52 V53 A54V11-L50 HydrophobicContact CG1-CD1 3.92Å; A14-L50 HydrophobicContact CB-CD1 4.48Å; K15-L50 HydrophobicContact CG-CD1 4.15Å; K15-L50 HydrophobicContact CG-CD2 4.02Å; E18-L50 WeakPolarHBondContact OE2-CD2 3.17Å; M26-L50 HydrophobicContact CE-CB 3.94Å; M26-L50 HydrophobicContact CE-CD2 3.55Å; M26-L50 HydrophobicContact CE-CG 4.37Å; M26-L50 WeakPolarHBondContact CE-O 3.49Å; M30-L50 HydrophobicContact CE-CB 4.04Å; M30-L50 HydrophobicContact SD-CB 3.89Å; E46-L50 HydrophobicContact CG-CD1 4.17Å; E46-L50 WeakPolarHBondContact O-CG 3.41Å; E46-L50 PolarHBondContact O-N 2.73Å; E47-L50 PolarHBondContact O-N 3.36Å; L50-S52 VanDerWaalsContact C-N 3.31Å; L50-S52 PolarHBondContact O-N 3.44Å; L50-V53 PolarHBondContact O-N 3.15Å; L50-A54 WeakPolarHBondContact O-CB 3.08Å; L50-A54 PolarHBondContact O-N 2.85Å
51L98.4Very high96.5Very high0 Ų039.6 Ų39.60%023%0.228CC..Hα-helixtrans-57.6-46.5175.1-178.773.4000110.9M30 V34 L43 E47 N49 A54 Y55 I106 L114M30-L51 HydrophobicContact CB-CD1 3.67Å; M30-L51 HydrophobicContact CE-CB 3.97Å; V34-L51 HydrophobicContact CG2-CD1 4.29Å; V34-L51 HydrophobicContact CG2-CD2 4.35Å; L43-L51 HydrophobicContact CD2-CD2 4.37Å; E47-L51 WeakPolarHBondContact O-CB 3.43Å; E47-L51 PolarHBondContact O-N 3.31Å; N49-L51 PolarHBondContact O-N 3.04Å; L51-A54 PolarHBondContact O-N 2.96Å; L51-Y55 HydrophobicContact CD1-CD2 3.85Å; L51-Y55 HydrophobicContact CD1-CE2 3.56Å; L51-Y55 HydrophobicContact CG-CD2 4.26Å; L51-Y55 HydrophobicContact CG-CE2 4.39Å; L51-Y55 WeakPolarHBondContact O-CD2 3.48Å; L51-Y55 PolarHBondContact O-N 2.94Å; L51-Y55 VanDerWaalsContact O-N 3.15Å; L51-I106 HydrophobicContact CD2-CD1 4.35Å; L51-L114 HydrophobicContact CD2-CD1 3.54Å; L51-L114 HydrophobicContact CD2-CD2 4.42Å
52S97.7Very high97.2Very high32 Ų3239.6 Ų39.622%0.22422%0.222CC..Hα-helixtrans-63.1-46.2179-172.30000112.5R48 N49 L50 A54 K56R48-S52 WeakPolarHBondContact O-CB 3.44Å; R48-S52 PolarHBondContact O-N 3.43Å; N49-S52 WeakPolarHBondContact O-CB 3.45Å; N49-S52 PolarHBondContact O-N 2.88Å; L50-S52 VanDerWaalsContact C-N 3.31Å; L50-S52 PolarHBondContact O-N 3.44Å; S52-A54 VanDerWaalsContact C-N 3.34Å; S52-A54 PolarHBondContact O-N 3.29Å; S52-K56 WeakPolarHBondContact O-CB 3.4Å; S52-K56 PolarHBondContact O-N 3.22Å
53V98.2Very high97.5Very high44 Ų4438.9 Ų38.927%0.26722%0.217SC..Hα-helixtrans-60.1-45.3177168.90000110.8E18 Y23 M26 N49 L50 N57E18-V53 HydrophobicContact CG-CG1 4.35Å; Y23-V53 HydrophobicContact CE1-CG1 4.45Å; M26-V53 HydrophobicContact CE-CB 4.21Å; M26-V53 HydrophobicContact CE-CG1 4.1Å; M26-V53 HydrophobicContact SD-CG1 4.31Å; N49-V53 WeakPolarHBondContact O-CG2 3.5Å; N49-V53 PolarHBondContact O-N 2.86Å; L50-V53 PolarHBondContact O-N 3.15Å; V53-N57 PolarHBondContact O-N 3.25Å; V53-N57 VanDerWaalsContact O-N 3.15Å; V53-N57 PolarHBondContact O-ND2 3.46Å
54A98.5Very high97.6Very high0 Ų040.6 Ų40.60%023%0.233CC..Hα-helixtrans-56.5-59.2179.600000111.2M26 V27 L50 L51 S52 K56 N57 V58M26-A54 HydrophobicContact CB-CB 3.97Å; M26-A54 HydrophobicContact CE-CB 4.17Å; M26-A54 HydrophobicContact CG-CB 3.63Å; M26-A54 HydrophobicContact SD-CB 3.59Å; M26-A54 VanDerWaalsContact SD-CB 3.59Å; V27-A54 HydrophobicContact CG2-CB 3.81Å; L50-A54 WeakPolarHBondContact O-CB 3.08Å; L50-A54 PolarHBondContact O-N 2.85Å; L51-A54 PolarHBondContact O-N 2.96Å; S52-A54 VanDerWaalsContact C-N 3.34Å; S52-A54 PolarHBondContact O-N 3.29Å; A54-K56 PolarHBondContact O-N 3.09Å; A54-N57 PolarHBondContact O-N 3.39Å; A54-V58 WeakPolarHBondContact O-CG2 3.25Å; A54-V58 PolarHBondContact O-N 3.38Å
55Y98.6Very high97.8Very high1 Ų139 Ų390%0.00423%0.226CC..Hα-helixtrans-70.2-35.1-176.7-79-88.9000112.9V27 E31 L51 N57 V58 I59 I102 I106 L109 Y134V27-Y55 HydrophobicContact CG1-CD1 4.38Å; V27-Y55 HydrophobicContact CG1-CE1 3.77Å; V27-Y55 HydrophobicContact CG1-CE2 3.93Å; V27-Y55 HydrophobicContact CG2-CD1 4.11Å; V27-Y55 HydrophobicContact CG2-CD2 4.06Å; V27-Y55 HydrophobicContact CG2-CE1 4.32Å; V27-Y55 HydrophobicContact CG2-CE2 4.27Å; V27-Y55 HydrophobicContact CG2-CG 3.99Å; E31-Y55 VanDerWaalsContact CG-OH 3.23Å; E31-Y55 WeakPolarHBondContact CG-OH 3.24Å; E31-Y55 PolarHBondContact OE1-OH 3.11Å; L51-Y55 HydrophobicContact CD1-CD2 3.85Å; L51-Y55 HydrophobicContact CD1-CE2 3.56Å; L51-Y55 HydrophobicContact CG-CD2 4.26Å; L51-Y55 HydrophobicContact CG-CE2 4.39Å; L51-Y55 WeakPolarHBondContact O-CD2 3.48Å; L51-Y55 PolarHBondContact O-N 2.94Å; L51-Y55 VanDerWaalsContact O-N 3.15Å; Y55-N57 VanDerWaalsContact C-N 3.3Å; Y55-N57 PolarHBondContact O-N 3.27Å; Y55-V58 PolarHBondContact O-N 3.39Å; Y55-I59 WeakPolarHBondContact O-CB 3.4Å; Y55-I59 WeakPolarHBondContact O-CG2 3.26Å; Y55-I59 PolarHBondContact O-N 3.44Å; Y55-I102 HydrophobicContact CD1-CG2 3.88Å; Y55-I102 HydrophobicContact CE1-CG2 4.28Å; Y55-I106 HydrophobicContact CD1-CB 3.9Å; Y55-I106 HydrophobicContact CD1-CG1 4.45Å; Y55-I106 HydrophobicContact CD1-CG2 4.37Å; Y55-I106 HydrophobicContact CD2-CD1 4Å; Y55-I106 HydrophobicContact CD2-CG1 4.47Å; Y55-I106 HydrophobicContact CE1-CB 3.63Å; Y55-I106 HydrophobicContact CE1-CG1 4.45Å; Y55-I106 HydrophobicContact CE1-CG2 4.37Å; Y55-I106 HydrophobicContact CE2-CB 4.38Å; Y55-I106 HydrophobicContact CE2-CD1 3.77Å; Y55-I106 HydrophobicContact CE2-CG1 4.44Å; Y55-I106 HydrophobicContact CG-CB 4.38Å; Y55-I106 HydrophobicContact CG-CD1 4.47Å; Y55-I106 HydrophobicContact CG-CG1 4.45Å; Y55-L109 WeakPolarHBondContact OH-CD1 3.41Å; Y55-Y134 WeakPolarHBondContact CB-OH 3.48Å
56K97.6Very high98Very high147 Ų14736.8 Ų36.864%0.63921%0.209SC*.Hα-helixtrans-60.2-40178.6-177.4-179.1177-1740111.7S52 A54 G60S52-K56 WeakPolarHBondContact O-CB 3.4Å; S52-K56 PolarHBondContact O-N 3.22Å; A54-K56 PolarHBondContact O-N 3.09Å; K56-G60 WeakPolarHBondContact O-CA 3.37Å; K56-G60 PolarHBondContact O-N 3.49Å
57N98.2Very high98Very high59 Ų5937.1 Ų37.132%0.31621%0.206SC..Hα-helixtrans-70.6-46.8178.4-80.6-74.1000111.9Y23 V53 A54 Y55 G60 S61Y23-N57 HydrophobicContact CD1-CB 3.54Å; Y23-N57 HydrophobicContact CD2-CB 3.5Å; Y23-N57 HydrophobicContact CE1-CB 3.82Å; Y23-N57 VanDerWaalsContact CE1-CG 3.49Å; Y23-N57 WeakPolarHBondContact CE1-ND2 3.27Å; Y23-N57 HydrophobicContact CE2-CB 3.78Å; Y23-N57 HydrophobicContact CG-CB 3.36Å; Y23-N57 VanDerWaalsContact CZ-CG 3.46Å; V53-N57 PolarHBondContact O-N 3.25Å; V53-N57 VanDerWaalsContact O-N 3.15Å; V53-N57 PolarHBondContact O-ND2 3.46Å; A54-N57 PolarHBondContact O-N 3.39Å; Y55-N57 VanDerWaalsContact C-N 3.3Å; Y55-N57 PolarHBondContact O-N 3.27Å; N57-G60 PolarHBondContact O-N 2.86Å; N57-S61 PolarHBondContact O-N 2.87Å
58V98.4Very high98.1Very high6 Ų641.8 Ų41.84%0.03623%0.23CC..Hα-helixtrans-60.2-52.7178177.80000110.8E24 V27 A54 Y55 G60 S61 L62 I102E24-V58 HydrophobicContact CG-CG2 4.24Å; V27-V58 HydrophobicContact CG2-CG2 3.95Å; A54-V58 WeakPolarHBondContact O-CG2 3.25Å; A54-V58 PolarHBondContact O-N 3.38Å; Y55-V58 PolarHBondContact O-N 3.39Å; V58-G60 VanDerWaalsContact C-N 3.3Å; V58-G60 PolarHBondContact O-N 3.15Å; V58-S61 PolarHBondContact O-N 2.88Å; V58-L62 HydrophobicContact CG1-CD1 4.17Å; V58-L62 WeakPolarHBondContact O-CG 3.48Å; V58-L62 PolarHBondContact O-N 3.42Å; V58-L62 VanDerWaalsContact O-N 3.15Å; V58-I102 HydrophobicContact CG1-CD1 3.83Å; V58-I102 HydrophobicContact CG1-CG1 3.95Å; V58-I102 HydrophobicContact CG1-CG2 4.42Å
59I98.3Very high98.2Very high2 Ų242 Ų421%0.0123%0.232CC..Hα-helixtrans-67.7-32.7-178.6-157.874.5000111.7Y55 L62 R63 L99 I102 Y134 Y137Y55-I59 WeakPolarHBondContact O-CB 3.4Å; Y55-I59 WeakPolarHBondContact O-CG2 3.26Å; Y55-I59 PolarHBondContact O-N 3.44Å; I59-L62 PolarHBondContact O-N 3.3Å; I59-R63 HydrophobicContact CG1-CG 4.31Å; I59-R63 VanDerWaalsContact O-CB 3.3Å; I59-R63 WeakPolarHBondContact O-CB 3.3Å; I59-R63 VanDerWaalsContact O-CG 3.25Å; I59-R63 WeakPolarHBondContact O-CG 3.41Å; I59-R63 PolarHBondContact O-N 3.3Å; I59-L99 HydrophobicContact CD1-CD2 3.57Å; I59-L99 HydrophobicContact CG1-CD2 4.22Å; I59-I102 HydrophobicContact CB-CG2 4.43Å; I59-I102 HydrophobicContact CD1-CB 4.06Å; I59-I102 HydrophobicContact CD1-CG2 3.78Å; I59-Y134 HydrophobicContact CB-CE1 4.06Å; I59-Y134 HydrophobicContact CD1-CE1 4.28Å; I59-Y134 HydrophobicContact CG1-CD1 4.48Å; I59-Y134 HydrophobicContact CG1-CE1 3.98Å; I59-Y134 HydrophobicContact CG2-CE1 4.06Å; I59-Y137 HydrophobicContact CG1-CD2 3.76Å; I59-Y137 HydrophobicContact CG1-CE2 4.2Å; I59-Y137 HydrophobicContact CG2-CD2 4.38Å; I59-Y137 HydrophobicContact CG2-CE2 3.96Å
60G98Very high98.2Very high32 Ų3239.5 Ų39.533%0.3322%0.221SC..Hα-helixtrans-61.9-47.8176.500000111.9K56 N57 V58 R63 A64K56-G60 WeakPolarHBondContact O-CA 3.37Å; K56-G60 PolarHBondContact O-N 3.49Å; N57-G60 PolarHBondContact O-N 2.86Å; V58-G60 VanDerWaalsContact C-N 3.3Å; V58-G60 PolarHBondContact O-N 3.15Å; G60-R63 PolarHBondContact O-N 3.04Å; G60-A64 WeakPolarHBondContact O-CB 3.36Å; G60-A64 PolarHBondContact O-N 3.35Å
61S98Very high98.2Very high78 Ų7841.2 Ų41.255%0.54523%0.234SC..Hα-helixtrans-59.7-49.1176.1-177.70000111.5N57 V58 R63 A64 A65N57-S61 PolarHBondContact O-N 2.87Å; V58-S61 PolarHBondContact O-N 2.88Å; S61-R63 PolarHBondContact O-N 3.36Å; S61-A64 PolarHBondContact O-N 3.48Å; S61-A65 PolarHBondContact O-N 2.87Å
62L98.3Very high98.2Very high24 Ų2444.6 Ų44.613%0.12625%0.251CS..Hα-helixtrans-63.3-41.4179.5-70.9172.4000112.5V58 I59 A64 A65 W66 E98 L99 I102V58-L62 HydrophobicContact CG1-CD1 4.17Å; V58-L62 WeakPolarHBondContact O-CG 3.48Å; V58-L62 PolarHBondContact O-N 3.42Å; V58-L62 VanDerWaalsContact O-N 3.15Å; I59-L62 PolarHBondContact O-N 3.3Å; L62-A64 VanDerWaalsContact C-N 3.34Å; L62-A64 PolarHBondContact O-N 3.29Å; L62-A65 PolarHBondContact O-N 3.37Å; L62-W66 WeakPolarHBondContact O-CB 3.42Å; L62-W66 PolarHBondContact O-N 3.38Å; L62-E98 HydrophobicContact CD1-CB 4.28Å; L62-E98 HydrophobicContact CD2-CB 3.95Å; L62-E98 WeakPolarHBondContact CD2-OE2 3.36Å; L62-L99 HydrophobicContact CB-CD2 3.42Å; L62-L99 VanDerWaalsContact CB-CD2 3.42Å; L62-L99 HydrophobicContact CB-CG 3.89Å; L62-L99 HydrophobicContact CD1-CD2 4.38Å; L62-I102 HydrophobicContact CD1-CG1 3.79Å
63R98.3Very high98.2Very high34 Ų3443.9 Ų43.913%0.12824%0.244CC..Hα-helixtrans-66.5-36.5177-75.7178.167.5-13311111.9I59 G60 S61 R67 L99 E140I59-R63 HydrophobicContact CG1-CG 4.31Å; I59-R63 VanDerWaalsContact O-CB 3.3Å; I59-R63 WeakPolarHBondContact O-CB 3.3Å; I59-R63 VanDerWaalsContact O-CG 3.25Å; I59-R63 WeakPolarHBondContact O-CG 3.41Å; I59-R63 PolarHBondContact O-N 3.3Å; G60-R63 PolarHBondContact O-N 3.04Å; S61-R63 PolarHBondContact O-N 3.36Å; R63-R67 WeakPolarHBondContact O-CG 3.39Å; R63-R67 PolarHBondContact O-N 3.16Å; R63-L99 HydrophobicContact CG-CD2 3.72Å; R63-E140 IonicContact CZ-OE1 3.53Å; R63-E140 IonicContact CZ-OE2 3.06Å; R63-E140 VanDerWaalsContact CZ-OE2 3.29Å; R63-E140 IonicContact NE-OE1 3.21Å; R63-E140 IonicContact NE-OE2 3.25Å; R63-E140 PolarHBondContact NE-OE2 3.35Å; R63-E140 IonicContact NH2-OE1 2.73Å; R63-E140 PolarHBondContact NH2-OE1 3.45Å; R63-E140 IonicContact NH2-OE2 2.66Å; R63-E140 PolarHBondContact NH2-OE2 2.67Å
64A98.4Very high98.1Very high46 Ų4648 Ų4838%0.3826%0.26SS..Hα-helixtrans-65-46.8174.200000111G60 S61 L62 W66 R67 I68G60-A64 WeakPolarHBondContact O-CB 3.36Å; G60-A64 PolarHBondContact O-N 3.35Å; S61-A64 PolarHBondContact O-N 3.48Å; L62-A64 VanDerWaalsContact C-N 3.34Å; L62-A64 PolarHBondContact O-N 3.29Å; A64-W66 PolarHBondContact O-N 3.13Å; A64-R67 PolarHBondContact O-N 2.87Å; A64-I68 WeakPolarHBondContact O-CG1 3.38Å; A64-I68 PolarHBondContact O-N 2.98Å; A64-I68 VanDerWaalsContact O-N 3.11Å
65A98.4Very high98Very high34 Ų3453.2 Ų53.228%0.28128%0.283SS..Hα-helixtrans-57.4-48.7175.100000111.4S61 L62 R67 I68 V69 V95S61-A65 PolarHBondContact O-N 2.87Å; L62-A65 PolarHBondContact O-N 3.37Å; A65-R67 PolarHBondContact O-N 2.98Å; A65-I68 PolarHBondContact O-N 2.93Å; A65-V69 VanDerWaalsContact O-CG2 3.27Å; A65-V69 WeakPolarHBondContact O-CG2 3.14Å; A65-V69 PolarHBondContact O-N 3.04Å; A65-V95 HydrophobicContact CB-CG1 4.36Å
66W98.6Very high97.9Very high38 Ų3854 Ų5414%0.14429%0.287CS..Hα-helixtrans-57.6-47.6178.2175.777.8000112.4L62 A64 I68 V69 S70 V95 E96 L99 E140 F141L62-W66 WeakPolarHBondContact O-CB 3.42Å; L62-W66 PolarHBondContact O-N 3.38Å; A64-W66 PolarHBondContact O-N 3.13Å; W66-I68 VanDerWaalsContact C-N 3.33Å; W66-I68 PolarHBondContact O-N 3.14Å; W66-V69 PolarHBondContact O-N 3.23Å; W66-S70 PolarHBondContact NE1-OG 3.25Å; W66-S70 WeakPolarHBondContact O-CB 3.36Å; W66-S70 PolarHBondContact O-N 3.48Å; W66-S70 PolarHBondContact O-OG 2.86Å; W66-V95 HydrophobicContact CB-CG1 3.84Å; W66-E96 PolarHBondContact NE1-OE1 3.26Å; W66-L99 HydrophobicContact CB-CD1 3.76Å; W66-L99 HydrophobicContact CG-CD1 3.95Å; W66-E140 HydrophobicContact CH2-CB 4.42Å; W66-E140 HydrophobicContact CZ3-CB 4.36Å; W66-F141 HydrophobicContact CD2-CB 4.08Å; W66-F141 HydrophobicContact CH2-CB 3.95Å; W66-F141 HydrophobicContact CZ2-CB 3.27Å
67R98.1Very high97.9Very high104 Ų10451 Ų5139%0.39228%0.275SS..Hα-helixtrans-58.6-42.9177.3-75.7-174.8-179.990.12.8112.7R63 A64 A65 S71 E140R63-R67 WeakPolarHBondContact O-CG 3.39Å; R63-R67 PolarHBondContact O-N 3.16Å; A64-R67 PolarHBondContact O-N 2.87Å; A65-R67 PolarHBondContact O-N 2.98Å; R67-S71 WeakPolarHBondContact O-CB 3.5Å; R67-S71 PolarHBondContact O-N 3.4Å; R67-E140 IonicContact NH2-OE2 2.62Å; R67-E140 PolarHBondContact NH2-OE2 2.95Å
68I98.4Very high97.8Very high106 Ų10652.7 Ų52.754%0.54429%0.291SS..Hα-helixtrans-64.4-48.7179.1-67.2166.9000110.1A64 A65 W66 S71 I72A64-I68 WeakPolarHBondContact O-CG1 3.38Å; A64-I68 PolarHBondContact O-N 2.98Å; A64-I68 VanDerWaalsContact O-N 3.11Å; A65-I68 PolarHBondContact O-N 2.93Å; W66-I68 VanDerWaalsContact C-N 3.33Å; W66-I68 PolarHBondContact O-N 3.14Å; I68-S71 PolarHBondContact O-N 3.36Å; I68-I72 HydrophobicContact CG2-CD1 3.88Å; I68-I72 WeakPolarHBondContact O-CG1 3.43Å; I68-I72 PolarHBondContact O-N 3.49Å
69V98.5Very high97.7Very high13 Ų1360.5 Ų60.58%0.07932%0.32CS..Hα-helixtrans-63.2-44.3-178.9178.90000110.7A65 W66 S71 I72 E73 V88 Y91 R92A65-V69 VanDerWaalsContact O-CG2 3.27Å; A65-V69 WeakPolarHBondContact O-CG2 3.14Å; A65-V69 PolarHBondContact O-N 3.04Å; W66-V69 PolarHBondContact O-N 3.23Å; V69-S71 VanDerWaalsContact C-N 3.3Å; V69-S71 PolarHBondContact O-N 3.05Å; V69-I72 PolarHBondContact O-N 3.27Å; V69-I72 VanDerWaalsContact O-N 3.12Å; V69-E73 PolarHBondContact O-N 3.48Å; V69-V88 HydrophobicContact CG1-CG1 3.82Å; V69-Y91 HydrophobicContact CG1-CD1 4Å; V69-Y91 HydrophobicContact CG2-CD1 3.66Å; V69-Y91 HydrophobicContact CG2-CE1 3.67Å; V69-R92 HydrophobicContact CG1-CB 3.71Å; V69-R92 HydrophobicContact CG1-CG 4.43Å
70S97.8Very high97.5Very high21 Ų2169.1 Ų69.115%0.14736%0.357CS..Hα-helixtrans-60.3-37.6174.8-63.50000112.6W66 E73 Q74 R92W66-S70 PolarHBondContact NE1-OG 3.25Å; W66-S70 WeakPolarHBondContact O-CB 3.36Å; W66-S70 PolarHBondContact O-N 3.48Å; W66-S70 PolarHBondContact O-OG 2.86Å; S70-E73 PolarHBondContact O-N 3.41Å; S70-Q74 WeakPolarHBondContact O-CG 3.32Å; S70-Q74 PolarHBondContact O-N 3.46Å; S70-R92 VanDerWaalsContact OG-CD 3.24Å; S70-R92 WeakPolarHBondContact OG-CD 3.21Å
71S98Very high97.3Very high45 Ų4570 Ų7032%0.31535%0.354SS..Hα-helixtrans-68.5-36.9174.3-175.40000112.5R67 I68 V69 K75R67-S71 WeakPolarHBondContact O-CB 3.5Å; R67-S71 PolarHBondContact O-N 3.4Å; I68-S71 PolarHBondContact O-N 3.36Å; V69-S71 VanDerWaalsContact C-N 3.3Å; V69-S71 PolarHBondContact O-N 3.05Å; S71-K75 WeakPolarHBondContact O-CG 3.47Å; S71-K75 PolarHBondContact O-N 2.61Å
72I98Very high97.1Very high71 Ų7174.1 Ų74.136%0.36437%0.365SS..Hα-helixtrans-66.6-41.3174.9-67.9167.4000110.2I68 V69 Q74 K75 E76 V88I68-I72 HydrophobicContact CG2-CD1 3.88Å; I68-I72 WeakPolarHBondContact O-CG1 3.43Å; I68-I72 PolarHBondContact O-N 3.49Å; V69-I72 PolarHBondContact O-N 3.27Å; V69-I72 VanDerWaalsContact O-N 3.12Å; I72-Q74 PolarHBondContact O-N 3.48Å; I72-K75 WeakPolarHBondContact O-CB 3.31Å; I72-K75 PolarHBondContact O-N 2.97Å; I72-K75 VanDerWaalsContact O-N 3.12Å; I72-E76 HydrophobicContact CG2-CG 4.22Å; I72-E76 PolarHBondContact O-N 3.34Å; I72-V88 HydrophobicContact CB-CG1 4.48Å; I72-V88 HydrophobicContact CG2-CG1 4.23Å; I72-V88 HydrophobicContact CG2-CG2 3.94Å
73E97.1Very high97Very high16 Ų1679.8 Ų79.88%0.07539%0.391CS..Hα-helixtrans-55.3-51.9176.6-174171.1152.900110.9V69 S70 K75 E76 E77 V88 K89 R92V69-E73 PolarHBondContact O-N 3.48Å; S70-E73 PolarHBondContact O-N 3.41Å; E73-K75 VanDerWaalsContact C-N 3.26Å; E73-K75 PolarHBondContact O-N 3.17Å; E73-E76 PolarHBondContact O-N 3.46Å; E73-E76 VanDerWaalsContact O-N 3.17Å; E73-E77 WeakPolarHBondContact O-CB 3.17Å; E73-E77 WeakPolarHBondContact O-CG 3.1Å; E73-E77 PolarHBondContact O-N 3.47Å; E73-V88 HydrophobicContact CB-CG1 3.69Å; E73-V88 HydrophobicContact CG-CG1 4.41Å; E73-K89 VanDerWaalsContact CD-CG 3.47Å; E73-K89 HydrophobicContact CG-CG 4.16Å; E73-K89 WeakPolarHBondContact OE1-CE 3.45Å; E73-K89 VanDerWaalsContact OE1-CG 3.23Å; E73-K89 WeakPolarHBondContact OE1-CG 3.46Å; E73-R92 IonicContact OE1-CZ 2.98Å; E73-R92 IonicContact OE1-NE 2.71Å; E73-R92 IonicContact OE1-NH2 3.98Å; E73-R92 PolarHBondContact OE1-NH2 3.15Å; E73-R92 WeakPolarHBondContact OE2-CD 3.41Å; E73-R92 IonicContact OE2-CZ 2.74Å; E73-R92 IonicContact OE2-NE 3.67Å; E73-R92 PolarHBondContact OE2-NE 2.92Å; E73-R92 IonicContact OE2-NH2 2.74Å; E73-R92 PolarHBondContact OE2-NH2 3.38Å
74Q96.4Very high97Very high130 Ų13082.1 Ų82.161%0.60740%0.403SS*.Hα-helixtrans-57.9-38.8177.8-69.1172.22.400112.2S70 I72 S78S70-Q74 WeakPolarHBondContact O-CG 3.32Å; S70-Q74 PolarHBondContact O-N 3.46Å; I72-Q74 PolarHBondContact O-N 3.48Å; Q74-S78 PolarHBondContact O-N 3.39Å
75K96.9Very high96.9Very high111 Ų11180.7 Ų80.748%0.48339%0.39SS..Hα-helixtrans-68.3-43.6177.4-72.3170.9-172.7171.90111.9S71 I72 E73 S78 R79S71-K75 WeakPolarHBondContact O-CG 3.47Å; S71-K75 PolarHBondContact O-N 2.61Å; I72-K75 WeakPolarHBondContact O-CB 3.31Å; I72-K75 PolarHBondContact O-N 2.97Å; I72-K75 VanDerWaalsContact O-N 3.12Å; E73-K75 VanDerWaalsContact C-N 3.26Å; E73-K75 PolarHBondContact O-N 3.17Å; K75-S78 PolarHBondContact O-N 3.2Å; K75-S78 PolarHBondContact O-OG 3.31Å; K75-R79 WeakPolarHBondContact O-CG 3.23Å; K75-R79 PolarHBondContact O-N 3.12Å
76E97.1Very high96.9Very high18 Ų1882 Ų828%0.08440%0.397CS..Hα-helixtrans-69.2-34.4178-65.4-56.8119.900111.8I72 E73 S78 R79 K80 N81 H84 V85I72-E76 HydrophobicContact CG2-CG 4.22Å; I72-E76 PolarHBondContact O-N 3.34Å; E73-E76 PolarHBondContact O-N 3.46Å; E73-E76 VanDerWaalsContact O-N 3.17Å; E76-S78 PolarHBondContact O-N 2.96Å; E76-R79 CarbonylContact O-C 3.48Å; E76-R79 PolarHBondContact O-N 3.38Å; E76-R79 VanDerWaalsContact O-N 3.16Å; E76-R79 IonicContact OE1-CZ 2.88Å; E76-R79 IonicContact OE1-NE 3.72Å; E76-R79 IonicContact OE1-NH1 3.53Å; E76-R79 PolarHBondContact OE1-NH1 3.22Å; E76-K80 PolarHBondContact O-N 3.32Å; E76-K80 VanDerWaalsContact O-N 3.13Å; E76-N81 PolarHBondContact O-N 2.96Å; E76-H84 HydrophobicContact CB-CB 4.31Å; E76-H84 HydrophobicContact CG-CB 4.07Å; E76-H84 WeakPolarHBondContact OE2-CB 3.41Å; E76-H84 IonicContact OE2-CG 3.58Å; E76-H84 IonicContact OE2-ND1 2.95Å; E76-H84 PolarHBondContact OE2-ND1 3.4Å; E76-V85 VanDerWaalsContact C-CG2 3.43Å; E76-V85 HydrophobicContact CB-CG2 3.8Å
77E96.2Very high96.9Very high84 Ų8485.1 Ų85.139%0.39342%0.416SS..Hα-helixtrans-61.7-42.7171.3-74.7-175.9156.100111.3E73 R79 K80 V85 K89E73-E77 WeakPolarHBondContact O-CB 3.17Å; E73-E77 WeakPolarHBondContact O-CG 3.1Å; E73-E77 PolarHBondContact O-N 3.47Å; E77-R79 PolarHBondContact O-N 3.16Å; E77-K80 PolarHBondContact O-N 3.32Å; E77-V85 HydrophobicContact CB-CG2 4.34Å; E77-V85 HydrophobicContact CG-CB 4.46Å; E77-V85 HydrophobicContact CG-CG1 3.79Å; E77-V85 HydrophobicContact CG-CG2 3.72Å; E77-K89 WeakPolarHBondContact OE1-CE 3.09Å; E77-K89 IonicContact OE1-NZ 3.67Å; E77-K89 PolarHBondContact OE1-NZ 2.85Å
78S96.8Very high96.9Very high93 Ų9381.3 Ų81.365%0.6540%0.404SS*.Hα-helixtrans-63.2-28175.880.70000113.3Q74 K75 E76Q74-S78 PolarHBondContact O-N 3.39Å; K75-S78 PolarHBondContact O-N 3.2Å; K75-S78 PolarHBondContact O-OG 3.31Å; E76-S78 PolarHBondContact O-N 2.96Å
79R96Very high96.9Very high170 Ų17080 Ų8064%0.64240%0.395SS*.THydrogen-bonded Turntrans-85.4-7.4176.8-68.4168.5178.6-179.5-5.5113.1K75 E76 E77 N81K75-R79 WeakPolarHBondContact O-CG 3.23Å; K75-R79 PolarHBondContact O-N 3.12Å; E76-R79 CarbonylContact O-C 3.48Å; E76-R79 PolarHBondContact O-N 3.38Å; E76-R79 VanDerWaalsContact O-N 3.16Å; E76-R79 IonicContact OE1-CZ 2.88Å; E76-R79 IonicContact OE1-NE 3.72Å; E76-R79 IonicContact OE1-NH1 3.53Å; E76-R79 PolarHBondContact OE1-NH1 3.22Å; E77-R79 PolarHBondContact O-N 3.16Å; R79-N81 PolarHBondContact O-N 3.07Å
80K93.6Very high96.9Very high183 Ų18384.5 Ų84.580%0.79642%0.418SS*.THydrogen-bonded Turntrans54.634-174.9-55.6-178.6179.1-179.10113E76 E77 E82E76-K80 PolarHBondContact O-N 3.32Å; E76-K80 VanDerWaalsContact O-N 3.13Å; E77-K80 PolarHBondContact O-N 3.32Å; K80-E82 PolarHBondContact O-N 2.89Å
81N93.7Very high96.9Very high50 Ų5089.7 Ų89.727%0.26744%0.436SS..  trans-88.683.9175.1-172.6-16.2000109.7E76 R79 E83 H84 V85E76-N81 PolarHBondContact O-N 2.96Å; R79-N81 PolarHBondContact O-N 3.07Å; N81-E83 VanDerWaalsContact C-N 3.27Å; N81-E83 PolarHBondContact O-N 3.37Å; N81-H84 HydrophobicContact CB-CB 4.19Å; N81-H84 PolarHBondContact ND2-CE1 3.17Å; N81-H84 VanDerWaalsContact ND2-CE1 3.27Å; N81-H84 PolarHBondContact ND2-ND1 3.47Å; N81-H84 PolarHBondContact O-N 3.01Å; N81-H84 PolarHBondContact OD1-N 2.87Å; N81-V85 VanDerWaalsContact O-CG2 3.27Å; N81-V85 WeakPolarHBondContact O-CG2 3.23Å; N81-V85 PolarHBondContact O-N 2.88Å
82E94.8Very high96.9Very high165 Ų16590.4 Ų90.477%0.77143%0.431SS*.Hα-helixtrans-57.4-36.9-172.6-64.8-177.2174.300113.4K80 V85 S86K80-E82 PolarHBondContact O-N 2.89Å; E82-V85 PolarHBondContact O-N 3.29Å; E82-S86 PolarHBondContact O-N 2.88Å
83E96.3Very high96.9Very high143 Ų14389.9 Ų89.967%0.66843%0.434SS*.Hα-helixtrans-63.4-50.7177.5-175.6-179.417500111.1N81 V85 S86 L87N81-E83 VanDerWaalsContact C-N 3.27Å; N81-E83 PolarHBondContact O-N 3.37Å; E83-V85 PolarHBondContact O-N 2.81Å; E83-S86 PolarHBondContact O-N 3.04Å; E83-L87 HydrophobicContact CG-CD1 4.49Å; E83-L87 WeakPolarHBondContact O-CG 3.06Å; E83-L87 PolarHBondContact O-N 3.36Å; E83-L87 VanDerWaalsContact O-N 3.15Å
84H97.5Very high97Very high83 Ų8394.8 Ų94.838%0.38446%0.455SS..Hα-helixtrans-65.5-39.8177.3-73.5-172.1000112.2E76 N81 S86 L87 V88E76-H84 HydrophobicContact CB-CB 4.31Å; E76-H84 HydrophobicContact CG-CB 4.07Å; E76-H84 WeakPolarHBondContact OE2-CB 3.41Å; E76-H84 IonicContact OE2-CG 3.58Å; E76-H84 IonicContact OE2-ND1 2.95Å; E76-H84 PolarHBondContact OE2-ND1 3.4Å; N81-H84 HydrophobicContact CB-CB 4.19Å; N81-H84 PolarHBondContact ND2-CE1 3.17Å; N81-H84 VanDerWaalsContact ND2-CE1 3.27Å; N81-H84 PolarHBondContact ND2-ND1 3.47Å; N81-H84 PolarHBondContact O-N 3.01Å; N81-H84 PolarHBondContact OD1-N 2.87Å; H84-S86 VanDerWaalsContact C-N 3.27Å; H84-S86 PolarHBondContact O-N 3.5Å; H84-L87 PolarHBondContact O-N 2.94Å; H84-V88 WeakPolarHBondContact O-CB 3.5Å; H84-V88 VanDerWaalsContact O-CG2 3.23Å; H84-V88 WeakPolarHBondContact O-CG2 3.49Å; H84-V88 PolarHBondContact O-N 3Å
85V97.7Very high97.1Very high16 Ų1688.7 Ų88.710%0.09743%0.427CS..Hα-helixtrans-57.6-43176.8169.90000110.6E76 E77 N81 E82 E83 K89E76-V85 VanDerWaalsContact C-CG2 3.43Å; E76-V85 HydrophobicContact CB-CG2 3.8Å; E77-V85 HydrophobicContact CB-CG2 4.34Å; E77-V85 HydrophobicContact CG-CB 4.46Å; E77-V85 HydrophobicContact CG-CG1 3.79Å; E77-V85 HydrophobicContact CG-CG2 3.72Å; N81-V85 VanDerWaalsContact O-CG2 3.27Å; N81-V85 WeakPolarHBondContact O-CG2 3.23Å; N81-V85 PolarHBondContact O-N 2.88Å; E82-V85 PolarHBondContact O-N 3.29Å; E83-V85 PolarHBondContact O-N 2.81Å; V85-K89 HydrophobicContact CG1-CD 3.92Å; V85-K89 WeakPolarHBondContact O-CB 3.3Å; V85-K89 VanDerWaalsContact O-CG 3.31Å; V85-K89 WeakPolarHBondContact O-CG 3.3Å; V85-K89 PolarHBondContact O-N 2.67Å
86S97.8Very high97.2Very high63 Ų6384.8 Ų84.844%0.44141%0.41SS..Hα-helixtrans-61.9-48.3176.2-166.40000111.9E82 E83 H84 V88 K89 D90E82-S86 PolarHBondContact O-N 2.88Å; E83-S86 PolarHBondContact O-N 3.04Å; H84-S86 VanDerWaalsContact C-N 3.27Å; H84-S86 PolarHBondContact O-N 3.5Å; S86-V88 VanDerWaalsContact C-N 3.34Å; S86-V88 PolarHBondContact O-N 3.32Å; S86-K89 PolarHBondContact O-N 2.95Å; S86-D90 PolarHBondContact O-N 3.32Å
87L98.2Very high97.2Very high103 Ų10388.2 Ų88.254%0.53943%0.433SS..Hα-helixtrans-62-40.9-179.6-67.5169.5000112.3E83 H84 Y91E83-L87 HydrophobicContact CG-CD1 4.49Å; E83-L87 WeakPolarHBondContact O-CG 3.06Å; E83-L87 PolarHBondContact O-N 3.36Å; E83-L87 VanDerWaalsContact O-N 3.15Å; H84-L87 PolarHBondContact O-N 2.94Å; L87-Y91 PolarHBondContact O-N 3.48Å; L87-Y91 VanDerWaalsContact O-N 3.11Å
88V98.1Very high97.3Very high24 Ų2488 Ų8815%0.14543%0.431CS..Hα-helixtrans-69.6-39179.11790000110.8V69 I72 E73 H84 S86 Y91 R92V69-V88 HydrophobicContact CG1-CG1 3.82Å; I72-V88 HydrophobicContact CB-CG1 4.48Å; I72-V88 HydrophobicContact CG2-CG1 4.23Å; I72-V88 HydrophobicContact CG2-CG2 3.94Å; E73-V88 HydrophobicContact CB-CG1 3.69Å; E73-V88 HydrophobicContact CG-CG1 4.41Å; H84-V88 WeakPolarHBondContact O-CB 3.5Å; H84-V88 VanDerWaalsContact O-CG2 3.23Å; H84-V88 WeakPolarHBondContact O-CG2 3.49Å; H84-V88 PolarHBondContact O-N 3Å; S86-V88 VanDerWaalsContact C-N 3.34Å; S86-V88 PolarHBondContact O-N 3.32Å; V88-Y91 PolarHBondContact O-N 3.48Å; V88-R92 WeakPolarHBondContact O-CB 3.44Å; V88-R92 PolarHBondContact O-N 3.41Å
89K97.9Very high97.4Very high78 Ų7883.5 Ų83.534%0.33940%0.401SS..Hα-helixtrans-60.6-46.4175-82.5175.1179171.90112.3E73 E77 V85 S86 Y91 R92 S93E73-K89 VanDerWaalsContact CD-CG 3.47Å; E73-K89 HydrophobicContact CG-CG 4.16Å; E73-K89 WeakPolarHBondContact OE1-CE 3.45Å; E73-K89 VanDerWaalsContact OE1-CG 3.23Å; E73-K89 WeakPolarHBondContact OE1-CG 3.46Å; E77-K89 WeakPolarHBondContact OE1-CE 3.09Å; E77-K89 IonicContact OE1-NZ 3.67Å; E77-K89 PolarHBondContact OE1-NZ 2.85Å; V85-K89 HydrophobicContact CG1-CD 3.92Å; V85-K89 WeakPolarHBondContact O-CB 3.3Å; V85-K89 VanDerWaalsContact O-CG 3.31Å; V85-K89 WeakPolarHBondContact O-CG 3.3Å; V85-K89 PolarHBondContact O-N 2.67Å; S86-K89 PolarHBondContact O-N 2.95Å; K89-Y91 VanDerWaalsContact C-N 3.3Å; K89-Y91 PolarHBondContact O-N 3.46Å; K89-R92 PolarHBondContact O-N 2.86Å; K89-S93 WeakPolarHBondContact O-CB 3.47Å; K89-S93 PolarHBondContact O-N 3.35Å
90D98.3Very high97.5Very high108 Ų10876.4 Ų76.458%0.57838%0.377SS*.Hα-helixtrans-61.4-42.7177.6-70.2-18.7000111S86 S93 K94S86-D90 PolarHBondContact O-N 3.32Å; D90-S93 PolarHBondContact O-N 3.15Å; D90-K94 PolarHBondContact O-N 3.46Å; D90-K94 VanDerWaalsContact O-N 3.12Å
91Y98.4Very high97.8Very high130 Ų13071.6 Ų71.651%0.5137%0.366SS..Hα-helixtrans-67.7-41.5177.5-169.7-116.9000112.6V69 L87 V88 K89 S93 K94 V95V69-Y91 HydrophobicContact CG1-CD1 4Å; V69-Y91 HydrophobicContact CG2-CD1 3.66Å; V69-Y91 HydrophobicContact CG2-CE1 3.67Å; L87-Y91 PolarHBondContact O-N 3.48Å; L87-Y91 VanDerWaalsContact O-N 3.11Å; V88-Y91 PolarHBondContact O-N 3.48Å; K89-Y91 VanDerWaalsContact C-N 3.3Å; K89-Y91 PolarHBondContact O-N 3.46Å; Y91-S93 VanDerWaalsContact C-N 3.32Å; Y91-S93 PolarHBondContact O-N 2.87Å; Y91-K94 WeakPolarHBondContact O-CB 3.45Å; Y91-K94 PolarHBondContact O-N 3.21Å; Y91-V95 HydrophobicContact CE1-CG2 4.33Å; Y91-V95 PolarHBondContact O-N 3.47Å; Y91-V95 VanDerWaalsContact O-N 3.14Å
92R98.3Very high98Very high59 Ų5971 Ų7122%0.22336%0.362CS..Hα-helixtrans-57.8-47.1173.7-176.6176.852.195.3-9110.8V69 S70 E73 V88 K89 K94 V95 E96V69-R92 HydrophobicContact CG1-CB 3.71Å; V69-R92 HydrophobicContact CG1-CG 4.43Å; S70-R92 VanDerWaalsContact OG-CD 3.24Å; S70-R92 WeakPolarHBondContact OG-CD 3.21Å; E73-R92 IonicContact OE1-CZ 2.98Å; E73-R92 IonicContact OE1-NE 2.71Å; E73-R92 IonicContact OE1-NH2 3.98Å; E73-R92 PolarHBondContact OE1-NH2 3.15Å; E73-R92 WeakPolarHBondContact OE2-CD 3.41Å; E73-R92 IonicContact OE2-CZ 2.74Å; E73-R92 IonicContact OE2-NE 3.67Å; E73-R92 PolarHBondContact OE2-NE 2.92Å; E73-R92 IonicContact OE2-NH2 2.74Å; E73-R92 PolarHBondContact OE2-NH2 3.38Å; V88-R92 WeakPolarHBondContact O-CB 3.44Å; V88-R92 PolarHBondContact O-N 3.41Å; K89-R92 PolarHBondContact O-N 2.86Å; R92-K94 VanDerWaalsContact C-N 3.26Å; R92-K94 PolarHBondContact O-N 2.9Å; R92-V95 PolarHBondContact O-N 2.75Å; R92-E96 WeakPolarHBondContact CD-OE1 3.26Å; R92-E96 HydrophobicContact CG-CG 4.25Å; R92-E96 WeakPolarHBondContact CG-OE1 3.26Å; R92-E96 IonicContact CZ-OE1 3.41Å; R92-E96 IonicContact NE-OE1 3.75Å; R92-E96 IonicContact NH1-OE1 3.47Å; R92-E96 PolarHBondContact NH1-OE1 2.85Å; R92-E96 IonicContact NH1-OE2 2.9Å; R92-E96 PolarHBondContact NH1-OE2 3.37Å; R92-E96 WeakPolarHBondContact O-CG 3.39Å; R92-E96 PolarHBondContact O-N 3.11Å
93S98.1Very high98.2Very high61 Ų6163.1 Ų63.143%0.42733%0.326SS..Hα-helixtrans-60.2-35.9179.9-173.40000112.5K89 D90 Y91 E96 T97K89-S93 WeakPolarHBondContact O-CB 3.47Å; K89-S93 PolarHBondContact O-N 3.35Å; D90-S93 PolarHBondContact O-N 3.15Å; Y91-S93 VanDerWaalsContact C-N 3.32Å; Y91-S93 PolarHBondContact O-N 2.87Å; S93-E96 PolarHBondContact O-N 3.4Å; S93-T97 PolarHBondContact O-N 3.47Å; S93-T97 PolarHBondContact O-OG1 3Å
94K98.5Very high98.3Very high118 Ų11859.6 Ų59.651%0.51332%0.317SS..Hα-helixtrans-61.3-49.2171.5-176.7-176.7173.9-172.80111.7D90 Y91 R92 E96 T97 E98D90-K94 PolarHBondContact O-N 3.46Å; D90-K94 VanDerWaalsContact O-N 3.12Å; Y91-K94 WeakPolarHBondContact O-CB 3.45Å; Y91-K94 PolarHBondContact O-N 3.21Å; R92-K94 VanDerWaalsContact C-N 3.26Å; R92-K94 PolarHBondContact O-N 2.9Å; K94-E96 VanDerWaalsContact C-N 3.31Å; K94-E96 PolarHBondContact O-N 3.15Å; K94-T97 WeakPolarHBondContact O-CB 3.43Å; K94-T97 PolarHBondContact O-N 3.46Å; K94-T97 VanDerWaalsContact O-N 3.15Å; K94-E98 WeakPolarHBondContact CE-OE1 3.45Å; K94-E98 PolarHBondContact O-N 3.36Å
95V98.5Very high98.3Very high3 Ų355.9 Ų55.92%0.01830%0.301CS..Hα-helixtrans-62.3-39.3178.1-1790000111.2A65 W66 Y91 R92 T97 E98 L99A65-V95 HydrophobicContact CB-CG1 4.36Å; W66-V95 HydrophobicContact CB-CG1 3.84Å; Y91-V95 HydrophobicContact CE1-CG2 4.33Å; Y91-V95 PolarHBondContact O-N 3.47Å; Y91-V95 VanDerWaalsContact O-N 3.14Å; R92-V95 PolarHBondContact O-N 2.75Å; V95-T97 VanDerWaalsContact C-N 3.3Å; V95-T97 PolarHBondContact O-N 3.45Å; V95-E98 PolarHBondContact O-N 3.2Å; V95-L99 HydrophobicContact CG1-CD1 4.35Å; V95-L99 WeakPolarHBondContact O-CB 3.39Å; V95-L99 WeakPolarHBondContact O-CG 3.16Å; V95-L99 PolarHBondContact O-N 3.26Å
96E98.6Very high98.3Very high28 Ų2855.1 Ų55.113%0.13130%0.296CS..Hα-helixtrans-64.8-33.9175.6-71174.917400112.7W66 R92 S93 K94 S100 F141W66-E96 PolarHBondContact NE1-OE1 3.26Å; R92-E96 WeakPolarHBondContact CD-OE1 3.26Å; R92-E96 HydrophobicContact CG-CG 4.25Å; R92-E96 WeakPolarHBondContact CG-OE1 3.26Å; R92-E96 IonicContact CZ-OE1 3.41Å; R92-E96 IonicContact NE-OE1 3.75Å; R92-E96 IonicContact NH1-OE1 3.47Å; R92-E96 PolarHBondContact NH1-OE1 2.85Å; R92-E96 IonicContact NH1-OE2 2.9Å; R92-E96 PolarHBondContact NH1-OE2 3.37Å; R92-E96 WeakPolarHBondContact O-CG 3.39Å; R92-E96 PolarHBondContact O-N 3.11Å; S93-E96 PolarHBondContact O-N 3.4Å; K94-E96 VanDerWaalsContact C-N 3.31Å; K94-E96 PolarHBondContact O-N 3.15Å; E96-S100 VanDerWaalsContact O-CB 3.3Å; E96-S100 WeakPolarHBondContact O-CB 3.37Å; E96-S100 PolarHBondContact O-N 2.97Å; E96-S100 PolarHBondContact O-OG 3.46Å; E96-F141 HydrophobicContact CB-CD2 3.8Å; E96-F141 HydrophobicContact CB-CE2 3.89Å; E96-F141 HydrophobicContact CG-CB 4.3Å; E96-F141 HydrophobicContact CG-CD2 3.61Å; E96-F141 HydrophobicContact CG-CE2 4.21Å; E96-F141 HydrophobicContact CG-CG 4.16Å
97T98.6Very high98.3Very high91 Ų9152.8 Ų52.856%0.55828%0.279SS*.Hα-helixtrans-66.9-43.1173.6-58.90000110.9S93 K94 V95 S100 S101S93-T97 PolarHBondContact O-N 3.47Å; S93-T97 PolarHBondContact O-OG1 3Å; K94-T97 WeakPolarHBondContact O-CB 3.43Å; K94-T97 PolarHBondContact O-N 3.46Å; K94-T97 VanDerWaalsContact O-N 3.15Å; V95-T97 VanDerWaalsContact C-N 3.3Å; V95-T97 PolarHBondContact O-N 3.45Å; T97-S100 PolarHBondContact O-N 3.39Å; T97-S101 WeakPolarHBondContact O-CB 3.39Å; T97-S101 PolarHBondContact O-N 2.99Å
98E98.4Very high98.3Very high78 Ų7855.7 Ų55.736%0.36428%0.283SS..Hα-helixtrans-62.9-47.1175.3-68.4170.8-168.800111.2L62 K94 V95 S100 S101 I102L62-E98 HydrophobicContact CD1-CB 4.28Å; L62-E98 HydrophobicContact CD2-CB 3.95Å; L62-E98 WeakPolarHBondContact CD2-OE2 3.36Å; K94-E98 WeakPolarHBondContact CE-OE1 3.45Å; K94-E98 PolarHBondContact O-N 3.36Å; V95-E98 PolarHBondContact O-N 3.2Å; E98-S100 VanDerWaalsContact C-N 3.35Å; E98-S100 PolarHBondContact O-N 2.94Å; E98-S101 PolarHBondContact O-N 2.91Å; E98-I102 WeakPolarHBondContact O-CG1 3.43Å; E98-I102 PolarHBondContact O-N 3.21Å
99L98.4Very high98.3Very high0 Ų055.1 Ų55.10%028%0.279CS..Hα-helixtrans-55.3-49172.9-79.5170000111.7I59 L62 R63 W66 V95 S101 I102 C103 F141I59-L99 HydrophobicContact CD1-CD2 3.57Å; I59-L99 HydrophobicContact CG1-CD2 4.22Å; L62-L99 HydrophobicContact CB-CD2 3.42Å; L62-L99 VanDerWaalsContact CB-CD2 3.42Å; L62-L99 HydrophobicContact CB-CG 3.89Å; L62-L99 HydrophobicContact CD1-CD2 4.38Å; R63-L99 HydrophobicContact CG-CD2 3.72Å; W66-L99 HydrophobicContact CB-CD1 3.76Å; W66-L99 HydrophobicContact CG-CD1 3.95Å; V95-L99 HydrophobicContact CG1-CD1 4.35Å; V95-L99 WeakPolarHBondContact O-CB 3.39Å; V95-L99 WeakPolarHBondContact O-CG 3.16Å; V95-L99 PolarHBondContact O-N 3.26Å; L99-S101 VanDerWaalsContact C-N 3.32Å; L99-S101 PolarHBondContact O-N 2.87Å; L99-I102 PolarHBondContact O-N 2.98Å; L99-C103 WeakPolarHBondContact O-CB 3.5Å; L99-C103 PolarHBondContact O-N 3.13Å; L99-C103 PolarHBondContact O-SG 3.21Å; L99-C103 VanDerWaalsContact O-SG 3.34Å; L99-F141 HydrophobicContact CB-CD1 4.5Å; L99-F141 HydrophobicContact CB-CE1 3.69Å; L99-F141 HydrophobicContact CB-CZ 3.68Å; L99-F141 HydrophobicContact CD1-CD1 3.94Å; L99-F141 HydrophobicContact CD1-CE1 3.96Å; L99-F141 HydrophobicContact CD1-CG 4.48Å; L99-F141 HydrophobicContact CD1-CZ 4.5Å; L99-F141 HydrophobicContact CG-CE1 4.37Å
100S98.5Very high98.3Very high21 Ų2151.4 Ų51.415%0.14726%0.262CS..Hα-helixtrans-59.9-43.9179.6-60.90000111.1E96 T97 E98 I102 C103 S104 F141E96-S100 VanDerWaalsContact O-CB 3.3Å; E96-S100 WeakPolarHBondContact O-CB 3.37Å; E96-S100 PolarHBondContact O-N 2.97Å; E96-S100 PolarHBondContact O-OG 3.46Å; T97-S100 PolarHBondContact O-N 3.39Å; E98-S100 VanDerWaalsContact C-N 3.35Å; E98-S100 PolarHBondContact O-N 2.94Å; S100-I102 PolarHBondContact O-N 3.34Å; S100-C103 PolarHBondContact O-N 3.46Å; S100-S104 WeakPolarHBondContact O-CB 3.35Å; S100-S104 PolarHBondContact O-N 2.82Å; S100-S104 PolarHBondContact O-OG 3.09Å; S100-S104 VanDerWaalsContact O-OG 3.05Å; S100-F141 WeakPolarHBondContact OG-CE2 3.05Å; S100-F141 WeakPolarHBondContact OG-CZ 3.42Å
101S98.4Very high98.2Very high81 Ų8149.9 Ų49.957%0.56626%0.255SS*.Hα-helixtrans-61.2-45.2178.6-174.30000112.2T97 E98 L99 S104 G105T97-S101 WeakPolarHBondContact O-CB 3.39Å; T97-S101 PolarHBondContact O-N 2.99Å; E98-S101 PolarHBondContact O-N 2.91Å; L99-S101 VanDerWaalsContact C-N 3.32Å; L99-S101 PolarHBondContact O-N 2.87Å; S101-S104 PolarHBondContact O-N 2.94Å; S101-G105 PolarHBondContact O-N 3.5Å
102I98.2Very high98.1Very high37 Ų3746.6 Ų46.619%0.1925%0.251CS..Hα-helixtrans-64.7-47.1178.4-64.4-60.4000110.7Y55 V58 I59 L62 E98 L99 S100 S104 G105 I106Y55-I102 HydrophobicContact CD1-CG2 3.88Å; Y55-I102 HydrophobicContact CE1-CG2 4.28Å; V58-I102 HydrophobicContact CG1-CD1 3.83Å; V58-I102 HydrophobicContact CG1-CG1 3.95Å; V58-I102 HydrophobicContact CG1-CG2 4.42Å; I59-I102 HydrophobicContact CB-CG2 4.43Å; I59-I102 HydrophobicContact CD1-CB 4.06Å; I59-I102 HydrophobicContact CD1-CG2 3.78Å; L62-I102 HydrophobicContact CD1-CG1 3.79Å; E98-I102 WeakPolarHBondContact O-CG1 3.43Å; E98-I102 PolarHBondContact O-N 3.21Å; L99-I102 PolarHBondContact O-N 2.98Å; S100-I102 PolarHBondContact O-N 3.34Å; I102-S104 PolarHBondContact O-N 3.45Å; I102-G105 PolarHBondContact O-N 3.37Å; I102-I106 PolarHBondContact O-N 3.31Å
103C98.6Very high98Very high0 Ų045.9 Ų45.90%025%0.25CC..Hα-helixtrans-58.9-47.7176.5-69.70000111.6L99 S100 G105 I106 L107 Y134 L138L99-C103 WeakPolarHBondContact O-CB 3.5Å; L99-C103 PolarHBondContact O-N 3.13Å; L99-C103 PolarHBondContact O-SG 3.21Å; L99-C103 VanDerWaalsContact O-SG 3.34Å; S100-C103 PolarHBondContact O-N 3.46Å; C103-G105 VanDerWaalsContact C-N 3.28Å; C103-G105 PolarHBondContact O-N 2.95Å; C103-I106 VanDerWaalsContact O-CG2 3.31Å; C103-I106 WeakPolarHBondContact O-CG2 3.46Å; C103-I106 PolarHBondContact O-N 3.05Å; C103-L107 VanDerWaalsContact O-CB 3.28Å; C103-L107 WeakPolarHBondContact O-CB 3.31Å; C103-L107 WeakPolarHBondContact O-CG 3.19Å; C103-L107 PolarHBondContact O-N 3.26Å; C103-Y134 HydrophobicContact CB-CD1 4.39Å; C103-L138 HydrophobicContact CB-CD1 3.99Å; C103-L138 HydrophobicContact CB-CD2 3.81Å; C103-L138 HydrophobicContact CB-CG 3.81Å
104S98.3Very high98Very high69 Ų6943.1 Ų43.148%0.48323%0.23SC..Hα-helixtrans-61.9-36.1178.2-650000112.6S100 S101 I102 R108S100-S104 WeakPolarHBondContact O-CB 3.35Å; S100-S104 PolarHBondContact O-N 2.82Å; S100-S104 PolarHBondContact O-OG 3.09Å; S100-S104 VanDerWaalsContact O-OG 3.05Å; S101-S104 PolarHBondContact O-N 2.94Å; I102-S104 PolarHBondContact O-N 3.45Å; S104-R108 VanDerWaalsContact O-CB 3.29Å; S104-R108 WeakPolarHBondContact O-CB 3.47Å; S104-R108 PolarHBondContact O-N 3.09Å; S104-R108 VanDerWaalsContact O-N 3.11Å
105G97.4Very high97.9Very high5 Ų539.5 Ų39.55%0.05222%0.216CC..Hα-helixtrans-58.5-56.617600000112.4S101 I102 C103 R108 L109S101-G105 PolarHBondContact O-N 3.5Å; I102-G105 PolarHBondContact O-N 3.37Å; C103-G105 VanDerWaalsContact C-N 3.28Å; C103-G105 PolarHBondContact O-N 2.95Å; G105-R108 PolarHBondContact O-N 3.37Å; G105-L109 PolarHBondContact O-N 3Å
106I98.3Very high97.8Very high0 Ų043.5 Ų43.50%024%0.242CC..Hα-helixtrans-69.9-38.6-178.8-173.956.8000112.8L51 Y55 I102 C103 R108 L109 L110 M130 Y134L51-I106 HydrophobicContact CD2-CD1 4.35Å; Y55-I106 HydrophobicContact CD1-CB 3.9Å; Y55-I106 HydrophobicContact CD1-CG1 4.45Å; Y55-I106 HydrophobicContact CD1-CG2 4.37Å; Y55-I106 HydrophobicContact CD2-CD1 4Å; Y55-I106 HydrophobicContact CD2-CG1 4.47Å; Y55-I106 HydrophobicContact CE1-CB 3.63Å; Y55-I106 HydrophobicContact CE1-CG1 4.45Å; Y55-I106 HydrophobicContact CE1-CG2 4.37Å; Y55-I106 HydrophobicContact CE2-CB 4.38Å; Y55-I106 HydrophobicContact CE2-CD1 3.77Å; Y55-I106 HydrophobicContact CE2-CG1 4.44Å; Y55-I106 HydrophobicContact CG-CB 4.38Å; Y55-I106 HydrophobicContact CG-CD1 4.47Å; Y55-I106 HydrophobicContact CG-CG1 4.45Å; I102-I106 PolarHBondContact O-N 3.31Å; C103-I106 VanDerWaalsContact O-CG2 3.31Å; C103-I106 WeakPolarHBondContact O-CG2 3.46Å; C103-I106 PolarHBondContact O-N 3.05Å; I106-R108 VanDerWaalsContact C-N 3.28Å; I106-R108 PolarHBondContact O-N 3.09Å; I106-L109 HydrophobicContact CD1-CB 4.5Å; I106-L109 PolarHBondContact O-N 3.32Å; I106-L109 VanDerWaalsContact O-N 3.13Å; I106-L110 HydrophobicContact CD1-CD1 4.45Å; I106-L110 HydrophobicContact CD1-CG 4.23Å; I106-L110 HydrophobicContact CG1-CD1 3.9Å; I106-L110 HydrophobicContact CG1-CG 4.2Å; I106-L110 WeakPolarHBondContact O-CB 3.29Å; I106-L110 VanDerWaalsContact O-CG 3.28Å; I106-L110 WeakPolarHBondContact O-CG 3.47Å; I106-L110 PolarHBondContact O-N 3.46Å; I106-M130 HydrophobicContact CD1-SD 4.11Å; I106-M130 HydrophobicContact CG1-SD 4.17Å; I106-Y134 HydrophobicContact CB-CD2 4.49Å; I106-Y134 HydrophobicContact CG1-CD2 4.1Å; I106-Y134 HydrophobicContact CG1-CE2 3.97Å; I106-Y134 HydrophobicContact CG2-CD1 3.42Å; I106-Y134 VanDerWaalsContact CG2-CD1 3.42Å; I106-Y134 HydrophobicContact CG2-CD2 3.54Å; I106-Y134 HydrophobicContact CG2-CE1 3.71Å; I106-Y134 HydrophobicContact CG2-CE2 3.85Å; I106-Y134 HydrophobicContact CG2-CG 3.36Å
107L98.7Very high97.6Very high14 Ų1442.9 Ų42.97%0.07324%0.24CC..Hα-helixtrans-60.3-41177.6-72.4172.9000111.2C103 L110 D111 K131 H135 L138C103-L107 VanDerWaalsContact O-CB 3.28Å; C103-L107 WeakPolarHBondContact O-CB 3.31Å; C103-L107 WeakPolarHBondContact O-CG 3.19Å; C103-L107 PolarHBondContact O-N 3.26Å; L107-L110 HydrophobicContact CD2-CD1 4.43Å; L107-L110 PolarHBondContact O-N 3.39Å; L107-D111 WeakPolarHBondContact O-CB 3.28Å; L107-D111 PolarHBondContact O-N 3.02Å; L107-K131 HydrophobicContact CD2-CG 3.85Å; L107-H135 VanDerWaalsContact CD2-CD2 3.46Å; L107-H135 WeakPolarHBondContact CD2-CD2 3.28Å; L107-L138 HydrophobicContact CD1-CD1 3.78Å
108R97.9Very high97.4Very high165 Ų16538.9 Ų38.962%0.62322%0.217SC*.Hα-helixtrans-62-45.1173.7176.1177.751.7-174-5.7111.8S104 G105 I106 L110 D111 S112S104-R108 VanDerWaalsContact O-CB 3.29Å; S104-R108 WeakPolarHBondContact O-CB 3.47Å; S104-R108 PolarHBondContact O-N 3.09Å; S104-R108 VanDerWaalsContact O-N 3.11Å; G105-R108 PolarHBondContact O-N 3.37Å; I106-R108 VanDerWaalsContact C-N 3.28Å; I106-R108 PolarHBondContact O-N 3.09Å; R108-L110 VanDerWaalsContact C-N 3.34Å; R108-D111 PolarHBondContact O-N 3.46Å; R108-S112 WeakPolarHBondContact O-CB 3.4Å; R108-S112 PolarHBondContact O-N 3.04Å; R108-S112 PolarHBondContact O-OG 3.43Å
109L97.1Very high97.2Very high11 Ų1140.4 Ų40.46%0.05823%0.232CC..Hα-helixtrans-63.6-40.2176.5-70.3178.7000112.1E31 V34 Y55 G105 I106 D111 H113 L114E31-L109 HydrophobicContact CB-CD1 4.17Å; E31-L109 HydrophobicContact CG-CD1 3.79Å; V34-L109 HydrophobicContact CG1-CD2 4.07Å; Y55-L109 WeakPolarHBondContact OH-CD1 3.41Å; G105-L109 PolarHBondContact O-N 3Å; I106-L109 HydrophobicContact CD1-CB 4.5Å; I106-L109 PolarHBondContact O-N 3.32Å; I106-L109 VanDerWaalsContact O-N 3.13Å; L109-D111 PolarHBondContact O-N 2.89Å; L109-H113 WeakPolarHBondContact O-CA 3.42Å; L109-H113 VanDerWaalsContact O-CB 3.27Å; L109-H113 WeakPolarHBondContact O-CB 3.3Å; L109-H113 PolarHBondContact O-N 2.93Å; L109-L114 HydrophobicContact CB-CD1 4.37Å; L109-L114 PolarHBondContact O-N 3.35Å
110L98.2Very high97Very high0 Ų042.5 Ų42.50%025%0.249CC..Iπ-helixtrans-59.6-48.7176.6-72.8164.7000110.9I106 L107 R108 L114 I115 Y127 M130 K131I106-L110 HydrophobicContact CD1-CD1 4.45Å; I106-L110 HydrophobicContact CD1-CG 4.23Å; I106-L110 HydrophobicContact CG1-CD1 3.9Å; I106-L110 HydrophobicContact CG1-CG 4.2Å; I106-L110 WeakPolarHBondContact O-CB 3.29Å; I106-L110 VanDerWaalsContact O-CG 3.28Å; I106-L110 WeakPolarHBondContact O-CG 3.47Å; I106-L110 PolarHBondContact O-N 3.46Å; L107-L110 HydrophobicContact CD2-CD1 4.43Å; L107-L110 PolarHBondContact O-N 3.39Å; R108-L110 VanDerWaalsContact C-N 3.34Å; L110-L114 HydrophobicContact CD2-CB 4.27Å; L110-L114 HydrophobicContact CD2-CD1 3.82Å; L110-L114 HydrophobicContact CG-CD1 4.28Å; L110-L114 PolarHBondContact O-N 3.41Å; L110-I115 HydrophobicContact CB-CD1 4.01Å; L110-I115 HydrophobicContact CB-CG1 4.38Å; L110-I115 VanDerWaalsContact O-CB 3.29Å; L110-I115 WeakPolarHBondContact O-CB 3.22Å; L110-I115 WeakPolarHBondContact O-CG1 3.14Å; L110-I115 PolarHBondContact O-N 2.89Å; L110-Y127 HydrophobicContact CD2-CD1 3.9Å; L110-Y127 HydrophobicContact CD2-CG 4.16Å; L110-M130 HydrophobicContact CD1-CB 4.38Å; L110-M130 HydrophobicContact CD1-CG 4.12Å; L110-M130 HydrophobicContact CD2-CB 4.36Å; L110-M130 HydrophobicContact CD2-CG 4.48Å; L110-M130 HydrophobicContact CD2-SD 4.28Å; L110-K131 HydrophobicContact CD1-CB 3.97Å
111D97.8Very high96.9Very high77 Ų7743.2 Ų43.241%0.41225%0.254SS..Iπ-helixtrans-74.8-37.1-174.6-73.7-15.7000113.9L107 R108 L109 P116 K131L107-D111 WeakPolarHBondContact O-CB 3.28Å; L107-D111 PolarHBondContact O-N 3.02Å; R108-D111 PolarHBondContact O-N 3.46Å; L109-D111 PolarHBondContact O-N 2.89Å; D111-P116 VanDerWaalsContact O-CG 3.24Å; D111-P116 WeakPolarHBondContact O-CG 3.37Å; D111-K131 WeakPolarHBondContact OD1-CD 3.31Å; D111-K131 WeakPolarHBondContact OD1-CE 3.46Å; D111-K131 IonicContact OD1-NZ 3.23Å; D111-K131 PolarHBondContact OD1-NZ 3.2Å; D111-K131 IonicContact OD2-NZ 2.73Å; D111-K131 PolarHBondContact OD2-NZ 3.33Å
112S95.5Very high96.8Very high61 Ų6142.1 Ų42.143%0.42724%0.24SC..Iπ-helixtrans-92.5-22.5-175.457.20000114.5R108R108-S112 WeakPolarHBondContact O-CB 3.4Å; R108-S112 PolarHBondContact O-N 3.04Å; R108-S112 PolarHBondContact O-OG 3.43Å
113H96.2Very high96.8Very high44 Ų4440.8 Ų40.820%0.20423%0.234CC..Iπ-helixtrans-128-59.2-169.9-67.8-73.6000112.6V34 T38 L109 S117V34-H113 HydrophobicContact CG1-CB 3.64Å; T38-H113 HydrophobicContact CG2-CB 4.36Å; T38-H113 WeakPolarHBondContact OG1-CB 3.49Å; T38-H113 PolarHBondContact OG1-ND1 3.46Å; L109-H113 WeakPolarHBondContact O-CA 3.42Å; L109-H113 VanDerWaalsContact O-CB 3.27Å; L109-H113 WeakPolarHBondContact O-CB 3.3Å; L109-H113 PolarHBondContact O-N 2.93Å; H113-S117 WeakPolarHBondContact O-CB 3.41Å; H113-S117 PolarHBondContact O-N 2.86Å; H113-S117 PolarHBondContact O-OG 2.74Å
114L97.5Very high96.8Very high2 Ų244.5 Ų44.51%0.0125%0.25CC..Iπ-helixtrans-79.4-50.3-163.4-59.2166.8000113.3V34 L43 L51 L109 L110 S117 A118 Y127V34-L114 HydrophobicContact CG1-CD2 3.79Å; V34-L114 HydrophobicContact CG1-CG 4.07Å; V34-L114 HydrophobicContact CG2-CD2 4Å; L43-L114 HydrophobicContact CD1-CD2 3.69Å; L43-L114 HydrophobicContact CD2-CD2 3.71Å; L43-L114 HydrophobicContact CG-CD2 4.31Å; L51-L114 HydrophobicContact CD2-CD1 3.54Å; L51-L114 HydrophobicContact CD2-CD2 4.42Å; L109-L114 HydrophobicContact CB-CD1 4.37Å; L109-L114 PolarHBondContact O-N 3.35Å; L110-L114 HydrophobicContact CD2-CB 4.27Å; L110-L114 HydrophobicContact CD2-CD1 3.82Å; L110-L114 HydrophobicContact CG-CD1 4.28Å; L110-L114 PolarHBondContact O-N 3.41Å; L114-S117 PolarHBondContact O-N 3.06Å; L114-A118 WeakPolarHBondContact O-CB 3.27Å; L114-A118 PolarHBondContact O-N 3.35Å; L114-A118 VanDerWaalsContact O-N 3.1Å; L114-Y127 HydrophobicContact CB-CD1 3.91Å; L114-Y127 HydrophobicContact CB-CD2 4Å; L114-Y127 HydrophobicContact CB-CE1 4.02Å; L114-Y127 HydrophobicContact CB-CE2 4.11Å; L114-Y127 HydrophobicContact CB-CG 3.93Å; L114-Y127 HydrophobicContact CD1-CD1 4.17Å; L114-Y127 HydrophobicContact CD1-CE1 4.13Å; L114-Y127 HydrophobicContact CD2-CE1 4.12Å; L114-Y127 HydrophobicContact CG-CE1 4.32Å
115I97.2Very high96.8Very high43 Ų4341.2 Ų41.222%0.22123%0.227CC..Hα-helixtrans-63.8-45.3179.5-63.7168000110.6L110 S117 A118 L128 K131L110-I115 HydrophobicContact CB-CD1 4.01Å; L110-I115 HydrophobicContact CB-CG1 4.38Å; L110-I115 VanDerWaalsContact O-CB 3.29Å; L110-I115 WeakPolarHBondContact O-CB 3.22Å; L110-I115 WeakPolarHBondContact O-CG1 3.14Å; L110-I115 PolarHBondContact O-N 2.89Å; I115-S117 VanDerWaalsContact C-N 3.27Å; I115-S117 PolarHBondContact O-N 3.18Å; I115-A118 PolarHBondContact O-N 3.45Å; I115-L128 HydrophobicContact CD1-CD2 4.08Å; I115-L128 HydrophobicContact CG2-CD2 4.36Å; I115-K131 HydrophobicContact CD1-CB 4.36Å; I115-K131 HydrophobicContact CD1-CD 3.89Å
116P95.6Very high96.8Very high87 Ų8742.2 Ų42.257%0.56523%0.23SC*.Hα-helixtrans-63.4-29.8176.5-24.435.4000114.3D111D111-P116 VanDerWaalsContact O-CG 3.24Å; D111-P116 WeakPolarHBondContact O-CG 3.37Å
117S94.5Very high96.8Very high14 Ų1442.3 Ų42.310%0.09823%0.23CC..Hα-helixtrans-88.9-7.8-178.4-520000113.6H113 L114 I115 T119H113-S117 WeakPolarHBondContact O-CB 3.41Å; H113-S117 PolarHBondContact O-N 2.86Å; H113-S117 PolarHBondContact O-OG 2.74Å; L114-S117 PolarHBondContact O-N 3.06Å; I115-S117 VanDerWaalsContact C-N 3.27Å; I115-S117 PolarHBondContact O-N 3.18Å; S117-T119 PolarHBondContact O-N 2.9Å
118A95.1Very high96.8Very high7 Ų742.9 Ų42.96%0.05823%0.233CC..  trans-76.6108.8-176.900000111.2L114 I115 K124 Y127L114-A118 WeakPolarHBondContact O-CB 3.27Å; L114-A118 PolarHBondContact O-N 3.35Å; L114-A118 VanDerWaalsContact O-N 3.1Å; I115-A118 PolarHBondContact O-N 3.45Å; A118-K124 HydrophobicContact CB-CG 3.73Å; A118-K124 WeakPolarHBondContact O-CE 3.42Å; A118-Y127 HydrophobicContact CB-CD2 3.81Å; A118-Y127 HydrophobicContact CB-CE2 4.03Å
119T93.5Very high96.9Very high111 Ų11136.8 Ų36.868%0.68121%0.211SC*.  trans-91.8-43.2177.563.90000111.5E42 S117 K124E42-T119 WeakPolarHBondContact OE2-CB 3.24Å; E42-T119 PolarHBondContact OE2-N 2.87Å; E42-T119 PolarHBondContact OE2-OG1 3.13Å; S117-T119 PolarHBondContact O-N 2.9Å; T119-K124 WeakPolarHBondContact O-CE 3.49Å; T119-K124 PolarHBondContact O-NZ 3.04Å
120A94.7Very high96.9Very high44 Ų4436.8 Ų36.836%0.36421%0.211SC..SBendtrans-71139177.700000111.9E122 S123 K124A120-E122 VanDerWaalsContact C-N 3.25Å; A120-E122 PolarHBondContact O-N 2.8Å; A120-S123 PolarHBondContact O-N 3.45Å; A120-S123 VanDerWaalsContact O-N 3.14Å; A120-K124 PolarHBondContact O-N 3.32Å
121S96.9Very high97Very high35 Ų3538.8 Ų38.825%0.24522%0.22CC..Hα-helixtrans-59.1-37.9177.7-58.30000112.1S123 K124 V125 D168S121-S123 PolarHBondContact O-N 3.44Å; S121-K124 PolarHBondContact O-N 3.01Å; S121-V125 VanDerWaalsContact O-CG2 3.3Å; S121-V125 WeakPolarHBondContact O-CG2 3.39Å; S121-V125 PolarHBondContact O-N 3.5Å; S121-D168 WeakPolarHBondContact CB-OD2 3.45Å; S121-D168 PolarHBondContact OG-OD2 3.33Å
122E96.4Very high97Very high59 Ų5935.1 Ų35.128%0.27620%0.2SC..Hα-helixtrans-57.5-48.3174.8-169.5-171.7121.100112.1R48 A120 K124 V125 F126 L169 H173 I175R48-E122 IonicContact CZ-OE1 3.49Å; R48-E122 VanDerWaalsContact CZ-OE1 3.23Å; R48-E122 IonicContact NH1-OE1 2.87Å; R48-E122 PolarHBondContact NH1-OE1 3.08Å; R48-E122 IonicContact NH2-OE1 3.92Å; R48-E122 PolarHBondContact NH2-OE1 2.61Å; A120-E122 VanDerWaalsContact C-N 3.25Å; A120-E122 PolarHBondContact O-N 2.8Å; E122-K124 PolarHBondContact O-N 3.46Å; E122-V125 PolarHBondContact O-N 3.25Å; E122-F126 VanDerWaalsContact O-CB 3.32Å; E122-F126 WeakPolarHBondContact O-CB 3.4Å; E122-F126 PolarHBondContact O-N 2.62Å; E122-L169 HydrophobicContact CB-CD2 4.43Å; E122-H173 IonicContact OE2-CE1 2.87Å; E122-H173 IonicContact OE2-NE2 3.83Å; E122-H173 PolarHBondContact OE2-NE2 3.11Å; E122-I175 HydrophobicContact CG-CD1 3.33Å
123S97Very high97.2Very high9 Ų932.7 Ų32.76%0.06318%0.182CC..Hα-helixtrans-63.9-40.7177.8-63.90000112.1E42 A120 S121 F126 Y127E42-S123 WeakPolarHBondContact OE1-CB 3.46Å; E42-S123 PolarHBondContact OE1-OG 3.1Å; A120-S123 PolarHBondContact O-N 3.45Å; A120-S123 VanDerWaalsContact O-N 3.14Å; S121-S123 PolarHBondContact O-N 3.44Å; S123-F126 WeakPolarHBondContact O-CB 3.15Å; S123-F126 PolarHBondContact O-N 2.96Å; S123-Y127 WeakPolarHBondContact O-CD2 3.05Å; S123-Y127 PolarHBondContact O-N 3.21Å
124K97.9Very high97.3Very high77 Ų7730.9 Ų30.934%0.33517%0.174SC..Hα-helixtrans-59.7-50.5175.9-69.4175.2-173.8169.30111.2A118 T119 A120 S121 E122 F126 Y127 L128 V164A118-K124 HydrophobicContact CB-CG 3.73Å; A118-K124 WeakPolarHBondContact O-CE 3.42Å; T119-K124 WeakPolarHBondContact O-CE 3.49Å; T119-K124 PolarHBondContact O-NZ 3.04Å; A120-K124 PolarHBondContact O-N 3.32Å; S121-K124 PolarHBondContact O-N 3.01Å; E122-K124 PolarHBondContact O-N 3.46Å; K124-F126 VanDerWaalsContact C-N 3.3Å; K124-F126 PolarHBondContact O-N 3.29Å; K124-Y127 PolarHBondContact O-N 3.35Å; K124-L128 VanDerWaalsContact O-CB 3.3Å; K124-L128 WeakPolarHBondContact O-CB 3.38Å; K124-L128 WeakPolarHBondContact O-CD1 3.48Å; K124-L128 VanDerWaalsContact O-CG 3.25Å; K124-L128 WeakPolarHBondContact O-CG 3.35Å; K124-L128 PolarHBondContact O-N 2.89Å; K124-V164 HydrophobicContact CB-CG1 4.48Å
125V98.7Very high97.4Very high0 Ų031.6 Ų31.60%018%0.177CC..Hα-helixtrans-61.1-42.8178.2-179.70000110.2S121 E122 K129 A161 V164 A165 L169 I175 L179S121-V125 VanDerWaalsContact O-CG2 3.3Å; S121-V125 WeakPolarHBondContact O-CG2 3.39Å; S121-V125 PolarHBondContact O-N 3.5Å; E122-V125 PolarHBondContact O-N 3.25Å; V125-K129 WeakPolarHBondContact O-CB 3.28Å; V125-K129 PolarHBondContact O-N 3.25Å; V125-A161 HydrophobicContact CG1-CB 4.42Å; V125-V164 HydrophobicContact CG2-CB 3.77Å; V125-V164 HydrophobicContact CG2-CG1 3.64Å; V125-A165 HydrophobicContact CG1-CB 3.82Å; V125-A165 HydrophobicContact CG2-CB 3.87Å; V125-L169 HydrophobicContact CB-CD1 4.13Å; V125-L169 HydrophobicContact CG1-CD1 4.2Å; V125-L169 HydrophobicContact CG2-CD1 3.92Å; V125-I175 HydrophobicContact CB-CG2 3.96Å; V125-I175 HydrophobicContact CG1-CG2 3.51Å; V125-L179 HydrophobicContact CG1-CD2 4.18Å
126F98.3Very high97.4Very high26 Ų2630 Ų3011%0.11417%0.168CC..Hα-helixtrans-58.2-51.4178.4-172.9-83.4000112.4R48 E122 S123 K124 M130 I175R48-F126 VanDerWaalsContact CD-CD1 3.49Å; R48-F126 HydrophobicContact CG-CD1 3.54Å; R48-F126 HydrophobicContact CG-CD2 4.42Å; R48-F126 HydrophobicContact CG-CE1 3.28Å; R48-F126 HydrophobicContact CG-CE2 4.21Å; R48-F126 HydrophobicContact CG-CG 4.1Å; R48-F126 HydrophobicContact CG-CZ 3.63Å; E122-F126 VanDerWaalsContact O-CB 3.32Å; E122-F126 WeakPolarHBondContact O-CB 3.4Å; E122-F126 PolarHBondContact O-N 2.62Å; S123-F126 WeakPolarHBondContact O-CB 3.15Å; S123-F126 PolarHBondContact O-N 2.96Å; K124-F126 VanDerWaalsContact C-N 3.3Å; K124-F126 PolarHBondContact O-N 3.29Å; F126-M130 HydrophobicContact CD1-CE 4.48Å; F126-M130 HydrophobicContact CE1-CE 3.55Å; F126-M130 HydrophobicContact CZ-CE 4.01Å; F126-M130 WeakPolarHBondContact O-CB 3.44Å; F126-M130 PolarHBondContact O-N 3.4Å; F126-I175 HydrophobicContact CB-CD1 4.31Å; F126-I175 HydrophobicContact CD2-CD1 3.82Å; F126-I175 HydrophobicContact CD2-CG1 4.18Å
127Y98.6Very high97.6Very high2 Ų227.1 Ų27.11%0.00815%0.146CC..Hα-helixtrans-72.6-37.8-177.6-61.9-47.2000112.7R48 L110 L114 A118 S123 K124 M130 K131R48-Y127 HydrophobicContact CG-CE1 3.89Å; L110-Y127 HydrophobicContact CD2-CD1 3.9Å; L110-Y127 HydrophobicContact CD2-CG 4.16Å; L114-Y127 HydrophobicContact CB-CD1 3.91Å; L114-Y127 HydrophobicContact CB-CD2 4Å; L114-Y127 HydrophobicContact CB-CE1 4.02Å; L114-Y127 HydrophobicContact CB-CE2 4.11Å; L114-Y127 HydrophobicContact CB-CG 3.93Å; L114-Y127 HydrophobicContact CD1-CD1 4.17Å; L114-Y127 HydrophobicContact CD1-CE1 4.13Å; L114-Y127 HydrophobicContact CD2-CE1 4.12Å; L114-Y127 HydrophobicContact CG-CE1 4.32Å; A118-Y127 HydrophobicContact CB-CD2 3.81Å; A118-Y127 HydrophobicContact CB-CE2 4.03Å; S123-Y127 WeakPolarHBondContact O-CD2 3.05Å; S123-Y127 PolarHBondContact O-N 3.21Å; K124-Y127 PolarHBondContact O-N 3.35Å; Y127-M130 PolarHBondContact O-N 3.16Å; Y127-K131 WeakPolarHBondContact O-CB 3.3Å; Y127-K131 PolarHBondContact O-N 3.33Å
128L98.8Very high97.8Very high27 Ų2727.4 Ų27.414%0.14115%0.147CC..Hα-helixtrans-66.6-41.4175.2-70.9167.4000111.5I115 K124 M130 K131 G132 A160 A161I115-L128 HydrophobicContact CD1-CD2 4.08Å; I115-L128 HydrophobicContact CG2-CD2 4.36Å; K124-L128 VanDerWaalsContact O-CB 3.3Å; K124-L128 WeakPolarHBondContact O-CB 3.38Å; K124-L128 WeakPolarHBondContact O-CD1 3.48Å; K124-L128 VanDerWaalsContact O-CG 3.25Å; K124-L128 WeakPolarHBondContact O-CG 3.35Å; K124-L128 PolarHBondContact O-N 2.89Å; L128-M130 VanDerWaalsContact C-N 3.34Å; L128-K131 WeakPolarHBondContact O-CB 3.39Å; L128-K131 PolarHBondContact O-N 2.99Å; L128-G132 PolarHBondContact O-N 3.34Å; L128-A160 HydrophobicContact CD1-CB 4.1Å; L128-A160 HydrophobicContact CD2-CB 4.22Å; L128-A161 HydrophobicContact CB-CB 3.64Å
129K98.7Very high97.9Very high37 Ų3727.1 Ų27.116%0.16114%0.144CC..Hα-helixtrans-58.5-48.2171178.1-167.8171.6-67.10110.5V125 K131 G132 D133 Y158 G178 L179 N182V125-K129 WeakPolarHBondContact O-CB 3.28Å; V125-K129 PolarHBondContact O-N 3.25Å; K129-K131 VanDerWaalsContact C-N 3.31Å; K129-K131 PolarHBondContact O-N 2.65Å; K129-G132 PolarHBondContact O-N 3.1Å; K129-G132 VanDerWaalsContact O-N 3.16Å; K129-D133 IonicContact NZ-OD2 3.77Å; K129-D133 PolarHBondContact NZ-OD2 2.6Å; K129-D133 PolarHBondContact O-N 3.14Å; K129-Y158 HydrophobicContact CG-CE1 4.34Å; K129-Y158 WeakPolarHBondContact O-CE1 3.3Å; K129-G178 WeakPolarHBondContact CE-O 3.26Å; K129-L179 HydrophobicContact CB-CD1 4.1Å; K129-L179 HydrophobicContact CD-CB 4.11Å; K129-L179 HydrophobicContact CG-CB 4.3Å; K129-L179 HydrophobicContact CG-CD1 4.01Å; K129-N182 WeakPolarHBondContact CE-ND2 3.25Å; K129-N182 PolarHBondContact NZ-ND2 3.19Å
130M98.7Very high98.1Very high10 Ų1022.8 Ų22.85%0.04912%0.116CC..Hα-helixtrans-59.7-42.5178.2-172.2176.1-83.400111.2I106 L110 F126 Y127 L128 G132 D133 Y134I106-M130 HydrophobicContact CD1-SD 4.11Å; I106-M130 HydrophobicContact CG1-SD 4.17Å; L110-M130 HydrophobicContact CD1-CB 4.38Å; L110-M130 HydrophobicContact CD1-CG 4.12Å; L110-M130 HydrophobicContact CD2-CB 4.36Å; L110-M130 HydrophobicContact CD2-CG 4.48Å; L110-M130 HydrophobicContact CD2-SD 4.28Å; F126-M130 HydrophobicContact CD1-CE 4.48Å; F126-M130 HydrophobicContact CE1-CE 3.55Å; F126-M130 HydrophobicContact CZ-CE 4.01Å; F126-M130 WeakPolarHBondContact O-CB 3.44Å; F126-M130 PolarHBondContact O-N 3.4Å; Y127-M130 PolarHBondContact O-N 3.16Å; L128-M130 VanDerWaalsContact C-N 3.34Å; M130-G132 VanDerWaalsContact C-N 3.34Å; M130-G132 PolarHBondContact O-N 3.3Å; M130-D133 WeakPolarHBondContact O-CB 3.43Å; M130-D133 PolarHBondContact O-N 2.8Å; M130-D133 VanDerWaalsContact O-N 3.15Å; M130-Y134 HydrophobicContact CG-CD2 3.83Å; M130-Y134 HydrophobicContact CG-CE2 3.58Å; M130-Y134 WeakPolarHBondContact O-CD2 3.48Å; M130-Y134 PolarHBondContact O-N 2.96Å; M130-Y134 VanDerWaalsContact O-N 3.09Å; M130-Y134 HydrophobicContact SD-CE2 4.29Å
131K98.9Very high98.2Very high43 Ų4321.5 Ų21.519%0.18710%0.102CC..Hα-helixtrans-56.6-47.8173.8-177.9169.3-178.9169.30111.5L107 L110 D111 I115 Y127 L128 K129 D133 Y134 H135 A157L107-K131 HydrophobicContact CD2-CG 3.85Å; L110-K131 HydrophobicContact CD1-CB 3.97Å; D111-K131 WeakPolarHBondContact OD1-CD 3.31Å; D111-K131 WeakPolarHBondContact OD1-CE 3.46Å; D111-K131 IonicContact OD1-NZ 3.23Å; D111-K131 PolarHBondContact OD1-NZ 3.2Å; D111-K131 IonicContact OD2-NZ 2.73Å; D111-K131 PolarHBondContact OD2-NZ 3.33Å; I115-K131 HydrophobicContact CD1-CB 4.36Å; I115-K131 HydrophobicContact CD1-CD 3.89Å; Y127-K131 WeakPolarHBondContact O-CB 3.3Å; Y127-K131 PolarHBondContact O-N 3.33Å; L128-K131 WeakPolarHBondContact O-CB 3.39Å; L128-K131 PolarHBondContact O-N 2.99Å; K129-K131 VanDerWaalsContact C-N 3.31Å; K129-K131 PolarHBondContact O-N 2.65Å; K131-D133 VanDerWaalsContact C-N 3.33Å; K131-D133 PolarHBondContact O-N 3.05Å; K131-Y134 PolarHBondContact O-N 3.23Å; K131-H135 WeakPolarHBondContact CE-NE2 3.33Å; K131-H135 PolarHBondContact O-CD2 3.21Å; K131-H135 VanDerWaalsContact O-CD2 3.3Å; K131-H135 PolarHBondContact O-N 2.66Å; K131-H135 VanDerWaalsContact O-N 3.09Å; K131-A157 HydrophobicContact CB-CB 4.13Å; K131-A157 HydrophobicContact CD-CB 4.36Å; K131-A157 HydrophobicContact CG-CB 3.96Å
132G98.9Very high98.3Very high0 Ų022.1 Ų22.10%010%0.101CC..Hα-helixtrans-59.8-41.7175.200000112.7L128 K129 M130 Y134 H135 R136L128-G132 PolarHBondContact O-N 3.34Å; K129-G132 PolarHBondContact O-N 3.1Å; K129-G132 VanDerWaalsContact O-N 3.16Å; M130-G132 VanDerWaalsContact C-N 3.34Å; M130-G132 PolarHBondContact O-N 3.3Å; G132-Y134 PolarHBondContact O-N 3.41Å; G132-H135 PolarHBondContact O-N 2.97Å; G132-R136 VanDerWaalsContact O-CB 3.24Å; G132-R136 WeakPolarHBondContact O-CB 3.49Å; G132-R136 PolarHBondContact O-N 2.86Å
133D98.8Very high98.3Very high9 Ų923.6 Ų23.65%0.04812%0.118CC..Hα-helixtrans-58.9-45.8176.8-80.8-48.2000112.5K129 M130 K131 R136 Y137 Y158 N182K129-D133 IonicContact NZ-OD2 3.77Å; K129-D133 PolarHBondContact NZ-OD2 2.6Å; K129-D133 PolarHBondContact O-N 3.14Å; M130-D133 WeakPolarHBondContact O-CB 3.43Å; M130-D133 PolarHBondContact O-N 2.8Å; M130-D133 VanDerWaalsContact O-N 3.15Å; K131-D133 VanDerWaalsContact C-N 3.33Å; K131-D133 PolarHBondContact O-N 3.05Å; D133-R136 WeakPolarHBondContact O-CB 3.49Å; D133-R136 PolarHBondContact O-N 3.24Å; D133-R136 IonicContact OD1-CZ 3.51Å; D133-R136 IonicContact OD1-NE 2.67Å; D133-R136 IonicContact OD1-NH2 3.49Å; D133-R136 PolarHBondContact OD1-NH2 2.84Å; D133-Y137 HydrophobicContact CB-CE2 4.28Å; D133-Y137 VanDerWaalsContact O-CD1 3.26Å; D133-Y137 WeakPolarHBondContact O-CD1 3.39Å; D133-Y137 VanDerWaalsContact O-CD2 3.26Å; D133-Y137 WeakPolarHBondContact O-CD2 3.49Å; D133-Y137 PolarHBondContact O-N 2.98Å; D133-Y158 PolarHBondContact N-OH 2.73Å; D133-Y158 PolarHBondContact OD1-OH 2.77Å; D133-N182 WeakPolarHBondContact OD1-CB 3.5Å; D133-N182 PolarHBondContact OD1-ND2 2.98Å; D133-N182 PolarHBondContact OD2-ND2 3.09Å
134Y98.8Very high98.3Very high7 Ų726 Ų263%0.02714%0.144CC..Hα-helixtrans-75-35.2-178.6-75.6-80.7000113.7Y55 I59 C103 I106 M130 K131 G132 R136 Y137 L138Y55-Y134 WeakPolarHBondContact CB-OH 3.48Å; I59-Y134 HydrophobicContact CB-CE1 4.06Å; I59-Y134 HydrophobicContact CD1-CE1 4.28Å; I59-Y134 HydrophobicContact CG1-CD1 4.48Å; I59-Y134 HydrophobicContact CG1-CE1 3.98Å; I59-Y134 HydrophobicContact CG2-CE1 4.06Å; C103-Y134 HydrophobicContact CB-CD1 4.39Å; I106-Y134 HydrophobicContact CB-CD2 4.49Å; I106-Y134 HydrophobicContact CG1-CD2 4.1Å; I106-Y134 HydrophobicContact CG1-CE2 3.97Å; I106-Y134 HydrophobicContact CG2-CD1 3.42Å; I106-Y134 VanDerWaalsContact CG2-CD1 3.42Å; I106-Y134 HydrophobicContact CG2-CD2 3.54Å; I106-Y134 HydrophobicContact CG2-CE1 3.71Å; I106-Y134 HydrophobicContact CG2-CE2 3.85Å; I106-Y134 HydrophobicContact CG2-CG 3.36Å; M130-Y134 HydrophobicContact CG-CD2 3.83Å; M130-Y134 HydrophobicContact CG-CE2 3.58Å; M130-Y134 WeakPolarHBondContact O-CD2 3.48Å; M130-Y134 PolarHBondContact O-N 2.96Å; M130-Y134 VanDerWaalsContact O-N 3.09Å; M130-Y134 HydrophobicContact SD-CE2 4.29Å; K131-Y134 PolarHBondContact O-N 3.23Å; G132-Y134 PolarHBondContact O-N 3.41Å; Y134-R136 VanDerWaalsContact C-N 3.28Å; Y134-Y137 AromaticContact CD1-CD2 3.8Å; Y134-Y137 HydrophobicContact CD1-CD2 3.8Å; Y134-Y137 HydrophobicContact CD1-CE2 4.18Å; Y134-Y137 HydrophobicContact CE1-CD2 4.08Å; Y134-Y137 HydrophobicContact CE1-CE2 4.12Å; Y134-Y137 HydrophobicContact CG-CD2 4.28Å; Y134-Y137 PolarHBondContact O-N 3.06Å; Y134-L138 PolarHBondContact O-N 2.92Å; Y134-L138 VanDerWaalsContact O-N 3.12Å
135H98.8Very high98.3Very high17 Ų1728.7 Ų28.78%0.07916%0.162CC..Hα-helixtrans-64-37.2169.1-79.8-74000111.5L107 K131 G132 Y137 L138 A139 D153 T154L107-H135 VanDerWaalsContact CD2-CD2 3.46Å; L107-H135 WeakPolarHBondContact CD2-CD2 3.28Å; K131-H135 WeakPolarHBondContact CE-NE2 3.33Å; K131-H135 PolarHBondContact O-CD2 3.21Å; K131-H135 VanDerWaalsContact O-CD2 3.3Å; K131-H135 PolarHBondContact O-N 2.66Å; K131-H135 VanDerWaalsContact O-N 3.09Å; G132-H135 PolarHBondContact O-N 2.97Å; H135-Y137 VanDerWaalsContact C-N 3.34Å; H135-Y137 PolarHBondContact O-N 3.33Å; H135-L138 WeakPolarHBondContact O-CB 3.47Å; H135-L138 PolarHBondContact O-N 3.2Å; H135-L138 VanDerWaalsContact O-N 3.16Å; H135-A139 PolarHBondContact O-N 3.46Å; H135-D153 HydrophobicContact CB-CB 4.16Å; H135-D153 VanDerWaalsContact CE1-CB 3.46Å; H135-D153 WeakPolarHBondContact CE1-CB 3.37Å; H135-D153 IonicContact CE1-OD2 3.88Å; H135-D153 PolarHBondContact CE1-OD2 3.5Å; H135-D153 VanDerWaalsContact ND1-CB 3.34Å; H135-D153 WeakPolarHBondContact ND1-CB 3.41Å; H135-D153 IonicContact ND1-OD2 2.79Å; H135-D153 PolarHBondContact ND1-OD2 3.49Å; H135-T154 VanDerWaalsContact CB-OG1 3.29Å; H135-T154 WeakPolarHBondContact CB-OG1 3.1Å
136R98.7Very high98.2Very high10 Ų1033.9 Ų33.94%0.03819%0.186CC..Hα-helixtrans-62.5-43.4175.9-178172.561.498-12.6111.4G132 D133 Y134 L138 A139 E140 T154 Y158 F186 E189 I190G132-R136 VanDerWaalsContact O-CB 3.24Å; G132-R136 WeakPolarHBondContact O-CB 3.49Å; G132-R136 PolarHBondContact O-N 2.86Å; D133-R136 WeakPolarHBondContact O-CB 3.49Å; D133-R136 PolarHBondContact O-N 3.24Å; D133-R136 IonicContact OD1-CZ 3.51Å; D133-R136 IonicContact OD1-NE 2.67Å; D133-R136 IonicContact OD1-NH2 3.49Å; D133-R136 PolarHBondContact OD1-NH2 2.84Å; Y134-R136 VanDerWaalsContact C-N 3.28Å; R136-L138 VanDerWaalsContact C-N 3.27Å; R136-L138 PolarHBondContact O-N 3.02Å; R136-A139 WeakPolarHBondContact O-CA 3.46Å; R136-A139 WeakPolarHBondContact O-CB 3.45Å; R136-A139 PolarHBondContact O-N 3.5Å; R136-E140 IonicContact NH1-OE1 3.5Å; R136-E140 PolarHBondContact O-N 3.3Å; R136-T154 WeakPolarHBondContact CA-OG1 3.48Å; R136-T154 HydrophobicContact CB-CG2 3.8Å; R136-T154 HydrophobicContact CG-CG2 4.47Å; R136-T154 PolarHBondContact N-OG1 3.2Å; R136-Y158 PolarHBondContact NE-OH 3.21Å; R136-Y158 VanDerWaalsContact NE-OH 3.13Å; R136-F186 HydrophobicContact CG-CD2 4.17Å; R136-E189 IonicContact NH1-OE2 2.64Å; R136-I190 HydrophobicContact CG-CG1 4.02Å
137Y98.6Very high98.2Very high25 Ų2536.8 Ų36.810%0.09820%0.196CC..Hα-helixtrans-61-37.7175.6-56.3-25.9000111.9I59 D133 Y134 H135 E140 F141I59-Y137 HydrophobicContact CG1-CD2 3.76Å; I59-Y137 HydrophobicContact CG1-CE2 4.2Å; I59-Y137 HydrophobicContact CG2-CD2 4.38Å; I59-Y137 HydrophobicContact CG2-CE2 3.96Å; D133-Y137 HydrophobicContact CB-CE2 4.28Å; D133-Y137 VanDerWaalsContact O-CD1 3.26Å; D133-Y137 WeakPolarHBondContact O-CD1 3.39Å; D133-Y137 VanDerWaalsContact O-CD2 3.26Å; D133-Y137 WeakPolarHBondContact O-CD2 3.49Å; D133-Y137 PolarHBondContact O-N 2.98Å; Y134-Y137 AromaticContact CD1-CD2 3.8Å; Y134-Y137 HydrophobicContact CD1-CD2 3.8Å; Y134-Y137 HydrophobicContact CD1-CE2 4.18Å; Y134-Y137 HydrophobicContact CE1-CD2 4.08Å; Y134-Y137 HydrophobicContact CE1-CE2 4.12Å; Y134-Y137 HydrophobicContact CG-CD2 4.28Å; Y134-Y137 PolarHBondContact O-N 3.06Å; H135-Y137 VanDerWaalsContact C-N 3.34Å; H135-Y137 PolarHBondContact O-N 3.33Å; Y137-E140 WeakPolarHBondContact CD1-OE1 3.02Å; Y137-E140 WeakPolarHBondContact O-CB 3.41Å; Y137-E140 PolarHBondContact O-N 3.35Å; Y137-F141 WeakPolarHBondContact O-CD1 3.41Å; Y137-F141 VanDerWaalsContact O-CE1 3.23Å; Y137-F141 WeakPolarHBondContact O-CE1 3.45Å
138L98.7Very high98.2Very high21 Ų2142.6 Ų42.611%0.1122%0.222CC..Hα-helixtrans-62.5-43.4171.5-68.7166.5000111.3C103 L107 Y134 H135 R136 E140 F141 K142 A150C103-L138 HydrophobicContact CB-CD1 3.99Å; C103-L138 HydrophobicContact CB-CD2 3.81Å; C103-L138 HydrophobicContact CB-CG 3.81Å; L107-L138 HydrophobicContact CD1-CD1 3.78Å; Y134-L138 PolarHBondContact O-N 2.92Å; Y134-L138 VanDerWaalsContact O-N 3.12Å; H135-L138 WeakPolarHBondContact O-CB 3.47Å; H135-L138 PolarHBondContact O-N 3.2Å; H135-L138 VanDerWaalsContact O-N 3.16Å; R136-L138 VanDerWaalsContact C-N 3.27Å; R136-L138 PolarHBondContact O-N 3.02Å; L138-E140 PolarHBondContact O-N 3.32Å; L138-F141 HydrophobicContact CD2-CE1 4.25Å; L138-F141 HydrophobicContact CD2-CZ 3.8Å; L138-F141 PolarHBondContact O-N 2.63Å; L138-K142 HydrophobicContact CB-CG 4.41Å; L138-K142 WeakPolarHBondContact O-CB 3.16Å; L138-K142 WeakPolarHBondContact O-CG 3.47Å; L138-K142 PolarHBondContact O-N 3Å; L138-A150 HydrophobicContact CB-CB 3.87Å
139A98.5Very high98.2Very high0 Ų044.7 Ų44.70%024%0.235CC..Hα-helixtrans-64.3-21.5178.600000113.8H135 R136 R147 A150 A151 I190H135-A139 PolarHBondContact O-N 3.46Å; R136-A139 WeakPolarHBondContact O-CA 3.46Å; R136-A139 WeakPolarHBondContact O-CB 3.45Å; R136-A139 PolarHBondContact O-N 3.5Å; A139-R147 WeakPolarHBondContact O-CG 3.34Å; A139-R147 VanDerWaalsContact O-CZ 3.22Å; A139-R147 PolarHBondContact O-NH1 2.82Å; A139-A150 HydrophobicContact CB-CB 3.85Å; A139-A151 HydrophobicContact CB-CB 4.42Å; A139-I190 HydrophobicContact CB-CD1 4.35Å; A139-I190 HydrophobicContact CB-CG2 3.9Å
140E97.6Very high98.2Very high20 Ų2043.1 Ų43.19%0.09323%0.23CC..Hα-helixtrans-64.1-45.5177.3-73.1170.5-15300112.1R63 W66 R67 R136 Y137 L138 R147 I190R63-E140 IonicContact CZ-OE1 3.53Å; R63-E140 IonicContact CZ-OE2 3.06Å; R63-E140 VanDerWaalsContact CZ-OE2 3.29Å; R63-E140 IonicContact NE-OE1 3.21Å; R63-E140 IonicContact NE-OE2 3.25Å; R63-E140 PolarHBondContact NE-OE2 3.35Å; R63-E140 IonicContact NH2-OE1 2.73Å; R63-E140 PolarHBondContact NH2-OE1 3.45Å; R63-E140 IonicContact NH2-OE2 2.66Å; R63-E140 PolarHBondContact NH2-OE2 2.67Å; W66-E140 HydrophobicContact CH2-CB 4.42Å; W66-E140 HydrophobicContact CZ3-CB 4.36Å; R67-E140 IonicContact NH2-OE2 2.62Å; R67-E140 PolarHBondContact NH2-OE2 2.95Å; R136-E140 IonicContact NH1-OE1 3.5Å; R136-E140 PolarHBondContact O-N 3.3Å; Y137-E140 WeakPolarHBondContact CD1-OE1 3.02Å; Y137-E140 WeakPolarHBondContact O-CB 3.41Å; Y137-E140 PolarHBondContact O-N 3.35Å; L138-E140 PolarHBondContact O-N 3.32Å; E140-R147 PolarHBondContact O-NH1 3.29Å; E140-I190 HydrophobicContact CG-CD1 3.81Å
141F97.1Very high98.2Very high18 Ų1843.4 Ų43.48%0.07923%0.233CC..Hα-helixtrans-113.1-19.9-170.369.2-95.1000114.6W66 E96 L99 S100 Y137 L138W66-F141 HydrophobicContact CD2-CB 4.08Å; W66-F141 HydrophobicContact CH2-CB 3.95Å; W66-F141 HydrophobicContact CZ2-CB 3.27Å; E96-F141 HydrophobicContact CB-CD2 3.8Å; E96-F141 HydrophobicContact CB-CE2 3.89Å; E96-F141 HydrophobicContact CG-CB 4.3Å; E96-F141 HydrophobicContact CG-CD2 3.61Å; E96-F141 HydrophobicContact CG-CE2 4.21Å; E96-F141 HydrophobicContact CG-CG 4.16Å; L99-F141 HydrophobicContact CB-CD1 4.5Å; L99-F141 HydrophobicContact CB-CE1 3.69Å; L99-F141 HydrophobicContact CB-CZ 3.68Å; L99-F141 HydrophobicContact CD1-CD1 3.94Å; L99-F141 HydrophobicContact CD1-CE1 3.96Å; L99-F141 HydrophobicContact CD1-CG 4.48Å; L99-F141 HydrophobicContact CD1-CZ 4.5Å; L99-F141 HydrophobicContact CG-CE1 4.37Å; S100-F141 WeakPolarHBondContact OG-CE2 3.05Å; S100-F141 WeakPolarHBondContact OG-CZ 3.42Å; Y137-F141 WeakPolarHBondContact O-CD1 3.41Å; Y137-F141 VanDerWaalsContact O-CE1 3.23Å; Y137-F141 WeakPolarHBondContact O-CE1 3.45Å; L138-F141 HydrophobicContact CD2-CE1 4.25Å; L138-F141 HydrophobicContact CD2-CZ 3.8Å; L138-F141 PolarHBondContact O-N 2.63Å
142K97.9Very high98.2Very high47 Ų4746 Ų4620%0.20425%0.246CC..  trans-68159.1174.4-68.8-65.2-164.2158.60111.2L138 E146 R147L138-K142 HydrophobicContact CB-CG 4.41Å; L138-K142 WeakPolarHBondContact O-CB 3.16Å; L138-K142 WeakPolarHBondContact O-CG 3.47Å; L138-K142 PolarHBondContact O-N 3Å; K142-E146 HydrophobicContact CB-CB 4.04Å; K142-E146 HydrophobicContact CD-CB 4.21Å; K142-E146 WeakPolarHBondContact CD-OE2 3.29Å; K142-E146 HydrophobicContact CG-CB 4.31Å; K142-E146 VanDerWaalsContact NZ-CD 3.35Å; K142-E146 IonicContact NZ-OE1 3.85Å; K142-E146 PolarHBondContact NZ-OE1 2.73Å; K142-E146 IonicContact NZ-OE2 3.74Å; K142-E146 PolarHBondContact NZ-OE2 2.92Å; K142-E146 VanDerWaalsContact NZ-OE2 3.16Å; K142-R147 HydrophobicContact CB-CB 4.34Å; K142-R147 WeakPolarHBondContact O-CB 3.27Å; K142-R147 WeakPolarHBondContact O-CD 3.49Å; K142-R147 WeakPolarHBondContact O-CG 3.44Å
143S96Very high98.2Very high91 Ų9148.5 Ų48.564%0.63626%0.259SS*.  trans-128.3160.6-179.160.40000112.1E146S143-E146 PolarHBondContact O-N 3.38Å
144G97.2Very high98.2Very high59 Ų5948 Ų4861%0.60826%0.257SS*.Hα-helixtrans59.7-137.4175.700000113E146 R147 K148G144-E146 VanDerWaalsContact C-N 3.32Å; G144-E146 PolarHBondContact O-N 3.02Å; G144-R147 WeakPolarHBondContact O-CB 3.33Å; G144-R147 PolarHBondContact O-N 2.67Å; G144-K148 PolarHBondContact O-N 3.42Å
145D98Very high98.2Very high134 Ų13449.4 Ų49.472%0.71726%0.264SS*.Hα-helixtrans-63-36.2-177.3-67.6-26.8000112.7R147 K148 T149D145-R147 VanDerWaalsContact C-N 3.3Å; D145-R147 PolarHBondContact O-N 2.95Å; D145-K148 WeakPolarHBondContact O-CB 3.46Å; D145-K148 PolarHBondContact O-N 3.43Å; D145-K148 VanDerWaalsContact O-N 3.15Å; D145-T149 PolarHBondContact O-N 3.43Å; D145-T149 PolarHBondContact O-OG1 2.95Å
146E97.8Very high98.2Very high108 Ų10854 Ų5451%0.50529%0.288SS..Hα-helixtrans-60.7-40.5176.8-65.9-172.111300111.7K142 S143 G144 A150K142-E146 HydrophobicContact CB-CB 4.04Å; K142-E146 HydrophobicContact CD-CB 4.21Å; K142-E146 WeakPolarHBondContact CD-OE2 3.29Å; K142-E146 HydrophobicContact CG-CB 4.31Å; K142-E146 VanDerWaalsContact NZ-CD 3.35Å; K142-E146 IonicContact NZ-OE1 3.85Å; K142-E146 PolarHBondContact NZ-OE1 2.73Å; K142-E146 IonicContact NZ-OE2 3.74Å; K142-E146 PolarHBondContact NZ-OE2 2.92Å; K142-E146 VanDerWaalsContact NZ-OE2 3.16Å; S143-E146 PolarHBondContact O-N 3.38Å; G144-E146 VanDerWaalsContact C-N 3.32Å; G144-E146 PolarHBondContact O-N 3.02Å; E146-A150 VanDerWaalsContact O-CB 3.31Å; E146-A150 WeakPolarHBondContact O-CB 3.49Å; E146-A150 PolarHBondContact O-N 3.43Å
147R98.2Very high98.2Very high87 Ų8753.7 Ų53.733%0.32829%0.288SS..Hα-helixtrans-63.8-44.1175.7-171.3-178.2172.9104.6-1.6111A139 E140 K142 G144 D145 A150 A151A139-R147 WeakPolarHBondContact O-CG 3.34Å; A139-R147 VanDerWaalsContact O-CZ 3.22Å; A139-R147 PolarHBondContact O-NH1 2.82Å; E140-R147 PolarHBondContact O-NH1 3.29Å; K142-R147 HydrophobicContact CB-CB 4.34Å; K142-R147 WeakPolarHBondContact O-CB 3.27Å; K142-R147 WeakPolarHBondContact O-CD 3.49Å; K142-R147 WeakPolarHBondContact O-CG 3.44Å; G144-R147 WeakPolarHBondContact O-CB 3.33Å; G144-R147 PolarHBondContact O-N 2.67Å; D145-R147 VanDerWaalsContact C-N 3.3Å; D145-R147 PolarHBondContact O-N 2.95Å; R147-A150 PolarHBondContact O-N 3.16Å; R147-A151 WeakPolarHBondContact O-CB 3.38Å; R147-A151 PolarHBondContact O-N 3.43Å
148K98.4Very high98.2Very high125 Ų12552.5 Ų52.554%0.54328%0.283SS..Hα-helixtrans-62.4-49.6-179.2-177.2-178.5171.1-1740110.8G144 D145 A150 A151 E152G144-K148 PolarHBondContact O-N 3.42Å; D145-K148 WeakPolarHBondContact O-CB 3.46Å; D145-K148 PolarHBondContact O-N 3.43Å; D145-K148 VanDerWaalsContact O-N 3.15Å; K148-A150 VanDerWaalsContact C-N 3.34Å; K148-A150 PolarHBondContact O-N 2.98Å; K148-A151 PolarHBondContact O-N 3.29Å; K148-E152 WeakPolarHBondContact CE-OE1 3.34Å; K148-E152 WeakPolarHBondContact O-CG 3.3Å; K148-E152 PolarHBondContact O-N 2.92Å
149T98.6Very high98.2Very high70 Ų7056.5 Ų56.543%0.42930%0.3SS..Hα-helixtrans-59-45.8176-60.70000111.3D145 A151 E152 D153D145-T149 PolarHBondContact O-N 3.43Å; D145-T149 PolarHBondContact O-OG1 2.95Å; T149-A151 VanDerWaalsContact C-N 3.32Å; T149-A151 PolarHBondContact O-N 3.15Å; T149-E152 PolarHBondContact O-N 2.89Å; T149-D153 WeakPolarHBondContact O-CB 3.37Å; T149-D153 PolarHBondContact O-N 3.5Å
150A98.6Very high98.2Very high5 Ų558.2 Ų58.24%0.04131%0.314CS..Hα-helixtrans-60.3-39.7177.300000112.7L138 A139 E146 R147 K148 T154L138-A150 HydrophobicContact CB-CB 3.87Å; A139-A150 HydrophobicContact CB-CB 3.85Å; E146-A150 VanDerWaalsContact O-CB 3.31Å; E146-A150 WeakPolarHBondContact O-CB 3.49Å; E146-A150 PolarHBondContact O-N 3.43Å; R147-A150 PolarHBondContact O-N 3.16Å; K148-A150 VanDerWaalsContact C-N 3.34Å; K148-A150 PolarHBondContact O-N 2.98Å; A150-T154 WeakPolarHBondContact O-CB 3.34Å; A150-T154 PolarHBondContact O-N 2.83Å; A150-T154 PolarHBondContact O-OG1 2.91Å
151A98.6Very high98.3Very high15 Ų1557.3 Ų57.312%0.12431%0.309CS..Hα-helixtrans-68.5-40.2175.800000112.5A139 R147 K148 T149 T154 M155 F186 I190A139-A151 HydrophobicContact CB-CB 4.42Å; R147-A151 WeakPolarHBondContact O-CB 3.38Å; R147-A151 PolarHBondContact O-N 3.43Å; K148-A151 PolarHBondContact O-N 3.29Å; T149-A151 VanDerWaalsContact C-N 3.32Å; T149-A151 PolarHBondContact O-N 3.15Å; A151-T154 WeakPolarHBondContact O-CB 3.49Å; A151-T154 PolarHBondContact O-N 3.21Å; A151-M155 PolarHBondContact O-N 3.39Å; A151-F186 HydrophobicContact CB-CE2 4.27Å; A151-F186 HydrophobicContact CB-CZ 4.38Å; A151-F186 VanDerWaalsContact O-CZ 3.3Å; A151-F186 WeakPolarHBondContact O-CZ 3.45Å; A151-I190 HydrophobicContact CB-CG2 4.08Å
152E98.7Very high98.3Very high97 Ų9759.4 Ų59.445%0.45332%0.32SS..Hα-helixtrans-62.9-47.2175.1-73.1172.1175.200111.3K148 T149 T154 M155 I156K148-E152 WeakPolarHBondContact CE-OE1 3.34Å; K148-E152 WeakPolarHBondContact O-CG 3.3Å; K148-E152 PolarHBondContact O-N 2.92Å; T149-E152 PolarHBondContact O-N 2.89Å; E152-T154 VanDerWaalsContact C-N 3.33Å; E152-T154 PolarHBondContact O-N 2.96Å; E152-M155 WeakPolarHBondContact O-CB 3.37Å; E152-M155 PolarHBondContact O-N 3.45Å; E152-M155 VanDerWaalsContact O-N 3.17Å; E152-I156 WeakPolarHBondContact O-CG1 3.49Å; E152-I156 PolarHBondContact O-N 3.21Å
153D98.8Very high98.4Very high53 Ų5362.8 Ų62.828%0.28334%0.34SS..Hα-helixtrans-63.8-38177.3-71.3-25.1000112.2H135 T149 M155 I156 A157H135-D153 HydrophobicContact CB-CB 4.16Å; H135-D153 VanDerWaalsContact CE1-CB 3.46Å; H135-D153 WeakPolarHBondContact CE1-CB 3.37Å; H135-D153 IonicContact CE1-OD2 3.88Å; H135-D153 PolarHBondContact CE1-OD2 3.5Å; H135-D153 VanDerWaalsContact ND1-CB 3.34Å; H135-D153 WeakPolarHBondContact ND1-CB 3.41Å; H135-D153 IonicContact ND1-OD2 2.79Å; H135-D153 PolarHBondContact ND1-OD2 3.49Å; T149-D153 WeakPolarHBondContact O-CB 3.37Å; T149-D153 PolarHBondContact O-N 3.5Å; D153-M155 VanDerWaalsContact C-N 3.35Å; D153-I156 PolarHBondContact O-N 3.2Å; D153-A157 WeakPolarHBondContact O-CB 3.35Å; D153-A157 PolarHBondContact O-N 3.19Å
154T98.8Very high98.5Very high0 Ų060.1 Ų60.10%032%0.32CS..Hα-helixtrans-57.7-49.2172.4-59.40000110.8H135 R136 A150 A151 E152 I156 A157 Y158 F186H135-T154 VanDerWaalsContact CB-OG1 3.29Å; H135-T154 WeakPolarHBondContact CB-OG1 3.1Å; R136-T154 WeakPolarHBondContact CA-OG1 3.48Å; R136-T154 HydrophobicContact CB-CG2 3.8Å; R136-T154 HydrophobicContact CG-CG2 4.47Å; R136-T154 PolarHBondContact N-OG1 3.2Å; A150-T154 WeakPolarHBondContact O-CB 3.34Å; A150-T154 PolarHBondContact O-N 2.83Å; A150-T154 PolarHBondContact O-OG1 2.91Å; A151-T154 WeakPolarHBondContact O-CB 3.49Å; A151-T154 PolarHBondContact O-N 3.21Å; E152-T154 VanDerWaalsContact C-N 3.33Å; E152-T154 PolarHBondContact O-N 2.96Å; T154-I156 PolarHBondContact O-N 3.29Å; T154-A157 PolarHBondContact O-N 2.73Å; T154-Y158 HydrophobicContact CG2-CD2 3.6Å; T154-Y158 HydrophobicContact CG2-CE2 3.42Å; T154-Y158 VanDerWaalsContact CG2-CE2 3.42Å; T154-Y158 PolarHBondContact O-N 3.12Å; T154-F186 HydrophobicContact CG2-CB 4.4Å; T154-F186 HydrophobicContact CG2-CD1 4.02Å; T154-F186 HydrophobicContact CG2-CD2 3.41Å; T154-F186 VanDerWaalsContact CG2-CD2 3.41Å; T154-F186 HydrophobicContact CG2-CE1 4.07Å; T154-F186 HydrophobicContact CG2-CE2 3.5Å; T154-F186 HydrophobicContact CG2-CG 3.68Å; T154-F186 HydrophobicContact CG2-CZ 3.84Å
155M98.7Very high98.6Very high36 Ų3657.3 Ų57.318%0.17729%0.291CS..Hα-helixtrans-61.6-44.4179.8-178.964.980.100111.5A151 E152 D153 K159 F183 F186 Y187 L191A151-M155 PolarHBondContact O-N 3.39Å; E152-M155 WeakPolarHBondContact O-CB 3.37Å; E152-M155 PolarHBondContact O-N 3.45Å; E152-M155 VanDerWaalsContact O-N 3.17Å; D153-M155 VanDerWaalsContact C-N 3.35Å; M155-K159 HydrophobicContact CG-CD 4.12Å; M155-K159 WeakPolarHBondContact O-CB 3.28Å; M155-K159 WeakPolarHBondContact O-CG 3.26Å; M155-K159 PolarHBondContact O-N 3.34Å; M155-K159 HydrophobicContact SD-CD 4.05Å; M155-K159 WeakPolarHBondContact SD-CE 3.34Å; M155-K159 HydrophobicContact SD-CG 4.18Å; M155-F183 HydrophobicContact SD-CE2 3.75Å; M155-F183 HydrophobicContact SD-CZ 3.68Å; M155-F186 HydrophobicContact CB-CE1 4.09Å; M155-F186 HydrophobicContact CB-CZ 4.33Å; M155-F186 HydrophobicContact CE-CE1 3.7Å; M155-F186 HydrophobicContact SD-CE1 4.26Å; M155-Y187 HydrophobicContact CE-CE1 3.74Å; M155-L191 HydrophobicContact CE-CD1 3.43Å; M155-L191 VanDerWaalsContact CE-CD1 3.43Å
156I98.8Very high98.5Very high112 Ų11255 Ų5557%0.57428%0.281SS*.Hα-helixtrans-60.9-49.6178.6-69.5164.9000110.2E152 D153 T154 K159 A160E152-I156 WeakPolarHBondContact O-CG1 3.49Å; E152-I156 PolarHBondContact O-N 3.21Å; D153-I156 PolarHBondContact O-N 3.2Å; T154-I156 PolarHBondContact O-N 3.29Å; I156-K159 PolarHBondContact O-N 2.93Å; I156-A160 WeakPolarHBondContact O-CB 3.33Å; I156-A160 PolarHBondContact O-N 2.84Å
157A98.8Very high98.5Very high5 Ų553.4 Ų53.44%0.04129%0.287CS..Hα-helixtrans-64.2-44.5-177.500000112.3K131 D153 T154 A160 A161K131-A157 HydrophobicContact CB-CB 4.13Å; K131-A157 HydrophobicContact CD-CB 4.36Å; K131-A157 HydrophobicContact CG-CB 3.96Å; D153-A157 WeakPolarHBondContact O-CB 3.35Å; D153-A157 PolarHBondContact O-N 3.19Å; T154-A157 PolarHBondContact O-N 2.73Å; A157-A160 PolarHBondContact O-N 2.83Å; A157-A161 WeakPolarHBondContact O-CB 3.49Å; A157-A161 PolarHBondContact O-N 3.44Å
158Y98.8Very high98.5Very high0 Ų053.6 Ų53.60%030%0.295CS..Hα-helixtrans-69.5-37.1178.4-73.6-32.6000113.8K129 D133 R136 T154 A161 Q162 L179 N182 F183 F186K129-Y158 HydrophobicContact CG-CE1 4.34Å; K129-Y158 WeakPolarHBondContact O-CE1 3.3Å; D133-Y158 PolarHBondContact N-OH 2.73Å; D133-Y158 PolarHBondContact OD1-OH 2.77Å; R136-Y158 PolarHBondContact NE-OH 3.21Å; R136-Y158 VanDerWaalsContact NE-OH 3.13Å; T154-Y158 HydrophobicContact CG2-CD2 3.6Å; T154-Y158 HydrophobicContact CG2-CE2 3.42Å; T154-Y158 VanDerWaalsContact CG2-CE2 3.42Å; T154-Y158 PolarHBondContact O-N 3.12Å; Y158-A161 PolarHBondContact O-N 3.16Å; Y158-Q162 VanDerWaalsContact O-CB 3.27Å; Y158-Q162 WeakPolarHBondContact O-CB 3.4Å; Y158-Q162 PolarHBondContact O-N 3.11Å; Y158-L179 HydrophobicContact CD1-CD1 3.56Å; Y158-L179 HydrophobicContact CE1-CD1 4.21Å; Y158-L179 HydrophobicContact CG-CD1 4.24Å; Y158-N182 HydrophobicContact CE1-CB 4.45Å; Y158-F183 HydrophobicContact CD2-CB 4.08Å; Y158-F183 AromaticContact CD2-CD2 3.4Å; Y158-F183 HydrophobicContact CD2-CD2 3.4Å; Y158-F183 VanDerWaalsContact CD2-CD2 3.4Å; Y158-F183 AromaticContact CD2-CE2 3.91Å; Y158-F183 HydrophobicContact CD2-CE2 3.91Å; Y158-F183 AromaticContact CD2-CG 3.83Å; Y158-F183 HydrophobicContact CD2-CG 3.83Å; Y158-F183 HydrophobicContact CE2-CB 4.48Å; Y158-F183 HydrophobicContact CE2-CD2 4.25Å; Y158-F183 HydrophobicContact CG-CB 4.2Å; Y158-F183 HydrophobicContact CG-CD1 4.38Å; Y158-F183 AromaticContact CG-CD2 3.91Å; Y158-F183 HydrophobicContact CG-CD2 3.91Å; Y158-F183 HydrophobicContact CG-CE2 4.31Å; Y158-F183 AromaticContact CG-CG 3.94Å; Y158-F183 HydrophobicContact CG-CG 3.94Å; Y158-F186 HydrophobicContact CD2-CB 4.33Å; Y158-F186 HydrophobicContact CD2-CD1 4.31Å; Y158-F186 HydrophobicContact CD2-CG 4.44Å; Y158-F186 HydrophobicContact CE2-CB 3.83Å; Y158-F186 HydrophobicContact CE2-CG 4.23Å
159K98.7Very high98.4Very high105 Ų10548.5 Ų48.546%0.45727%0.273SS..Hα-helixtrans-62.4-46.4173.3-77.7-179.1171.4174.20111.3M155 I156 A161 Q162 D163 F183M155-K159 HydrophobicContact CG-CD 4.12Å; M155-K159 WeakPolarHBondContact O-CB 3.28Å; M155-K159 WeakPolarHBondContact O-CG 3.26Å; M155-K159 PolarHBondContact O-N 3.34Å; M155-K159 HydrophobicContact SD-CD 4.05Å; M155-K159 WeakPolarHBondContact SD-CE 3.34Å; M155-K159 HydrophobicContact SD-CG 4.18Å; I156-K159 PolarHBondContact O-N 2.93Å; K159-A161 VanDerWaalsContact C-N 3.3Å; K159-A161 PolarHBondContact O-N 2.93Å; K159-Q162 WeakPolarHBondContact O-CB 3.28Å; K159-Q162 PolarHBondContact O-N 3.21Å; K159-D163 VanDerWaalsContact O-CG 3.3Å; K159-D163 PolarHBondContact O-N 3.08Å; K159-F183 HydrophobicContact CG-CE1 4.29Å; K159-F183 HydrophobicContact CG-CZ 3.96Å
160A98.7Very high98.3Very high36 Ų3647.5 Ų47.530%0.29827%0.272SS..Hα-helixtrans-60-40.8176.100000112.1L128 I156 A157 Q162 V164L128-A160 HydrophobicContact CD1-CB 4.1Å; L128-A160 HydrophobicContact CD2-CB 4.22Å; I156-A160 WeakPolarHBondContact O-CB 3.33Å; I156-A160 PolarHBondContact O-N 2.84Å; A157-A160 PolarHBondContact O-N 2.83Å; A160-Q162 VanDerWaalsContact C-N 3.34Å; A160-V164 PolarHBondContact O-N 3.03Å
161A98.8Very high98.2Very high0 Ų048.1 Ų48.10%028%0.275CS..Hα-helixtrans-63.7-40.4173.700000111.8V125 L128 A157 Y158 K159 A165 L179V125-A161 HydrophobicContact CG1-CB 4.42Å; L128-A161 HydrophobicContact CB-CB 3.64Å; A157-A161 WeakPolarHBondContact O-CB 3.49Å; A157-A161 PolarHBondContact O-N 3.44Å; Y158-A161 PolarHBondContact O-N 3.16Å; K159-A161 VanDerWaalsContact C-N 3.3Å; K159-A161 PolarHBondContact O-N 2.93Å; A161-A165 VanDerWaalsContact O-CB 3.23Å; A161-A165 WeakPolarHBondContact O-CB 3.24Å; A161-A165 PolarHBondContact O-N 3.37Å; A161-L179 VanDerWaalsContact C-CD2 3.45Å; A161-L179 HydrophobicContact CB-CD1 3.79Å; A161-L179 HydrophobicContact CB-CD2 3.61Å; A161-L179 HydrophobicContact CB-CG 4.36Å
162Q98.6Very high98.1Very high63 Ų6347.6 Ų47.629%0.29427%0.271SS..Hα-helixtrans-68.3-42.1-176.7-17617133.300111.5Y158 K159 A160 V164 A165 V166 L179Y158-Q162 VanDerWaalsContact O-CB 3.27Å; Y158-Q162 WeakPolarHBondContact O-CB 3.4Å; Y158-Q162 PolarHBondContact O-N 3.11Å; K159-Q162 WeakPolarHBondContact O-CB 3.28Å; K159-Q162 PolarHBondContact O-N 3.21Å; A160-Q162 VanDerWaalsContact C-N 3.34Å; Q162-V164 VanDerWaalsContact C-N 3.33Å; Q162-V164 PolarHBondContact O-N 3.44Å; Q162-A165 PolarHBondContact O-N 3.38Å; Q162-V166 HydrophobicContact CG-CG2 4.11Å; Q162-V166 WeakPolarHBondContact O-CB 3.33Å; Q162-V166 WeakPolarHBondContact O-CG2 3.22Å; Q162-V166 PolarHBondContact O-N 2.95Å; Q162-L179 HydrophobicContact CB-CD2 4.06Å
163D98.4Very high97.9Very high118 Ų11845 Ų4563%0.63126%0.258SS*.Hα-helixtrans-59-44.9178.8-67.9-20.2000111.2K159 A167K159-D163 VanDerWaalsContact O-CG 3.3Å; K159-D163 PolarHBondContact O-N 3.08Å; D163-A167 WeakPolarHBondContact O-CB 3.32Å; D163-A167 PolarHBondContact O-N 3.07Å
164V98.6Very high97.8Very high34 Ų3443.5 Ų43.521%0.20625%0.252CS..Hα-helixtrans-69.9-42176.2-177.40000111.2K124 V125 A160 Q162 V166 A167 D168K124-V164 HydrophobicContact CB-CG1 4.48Å; V125-V164 HydrophobicContact CG2-CB 3.77Å; V125-V164 HydrophobicContact CG2-CG1 3.64Å; A160-V164 PolarHBondContact O-N 3.03Å; Q162-V164 VanDerWaalsContact C-N 3.33Å; Q162-V164 PolarHBondContact O-N 3.44Å; V164-V166 PolarHBondContact O-N 3.11Å; V164-A167 PolarHBondContact O-N 3.37Å; V164-D168 WeakPolarHBondContact O-CB 3.42Å; V164-D168 PolarHBondContact O-N 2.82Å
165A98.5Very high97.7Very high1 Ų144.6 Ų44.61%0.00826%0.257CS..Hα-helixtrans-64.8-41-177.700000112.7V125 A161 Q162 A167 L169 R176 L179V125-A165 HydrophobicContact CG1-CB 3.82Å; V125-A165 HydrophobicContact CG2-CB 3.87Å; A161-A165 VanDerWaalsContact O-CB 3.23Å; A161-A165 WeakPolarHBondContact O-CB 3.24Å; A161-A165 PolarHBondContact O-N 3.37Å; Q162-A165 PolarHBondContact O-N 3.38Å; A165-A167 VanDerWaalsContact C-N 3.33Å; A165-L169 HydrophobicContact CB-CD1 4.28Å; A165-L169 WeakPolarHBondContact O-CA 3.33Å; A165-L169 WeakPolarHBondContact O-CB 3.24Å; A165-L169 PolarHBondContact O-N 2.83Å; A165-L169 VanDerWaalsContact O-O 3.06Å; A165-R176 HydrophobicContact CB-CB 4.28Å; A165-R176 HydrophobicContact CB-CG 4.1Å; A165-L179 HydrophobicContact CB-CD2 4.05Å
166V97.6Very high97.7Very high84 Ų8444.4 Ų44.451%0.50926%0.255SS..Hα-helixtrans-68.6-35.8179.2170.30000111.2Q162 V164Q162-V166 HydrophobicContact CG-CG2 4.11Å; Q162-V166 WeakPolarHBondContact O-CB 3.33Å; Q162-V166 WeakPolarHBondContact O-CG2 3.22Å; Q162-V166 PolarHBondContact O-N 2.95Å; V164-V166 PolarHBondContact O-N 3.11Å
167A97.6Very high97.7Very high76 Ų7639.2 Ų39.263%0.62823%0.228SC*.Hα-helixtrans-72.8-42.917900000112.8D163 V164 A165D163-A167 WeakPolarHBondContact O-CB 3.32Å; D163-A167 PolarHBondContact O-N 3.07Å; V164-A167 PolarHBondContact O-N 3.37Å; A165-A167 VanDerWaalsContact C-N 3.33Å
168D97.9Very high97.6Very high91 Ų9139.4 Ų39.449%0.48723%0.231SC..Hα-helixtrans-117.1-13.6-161.8-61.5-19.4000114.6S121 V164S121-D168 WeakPolarHBondContact CB-OD2 3.45Å; S121-D168 PolarHBondContact OG-OD2 3.33Å; V164-D168 WeakPolarHBondContact O-CB 3.42Å; V164-D168 PolarHBondContact O-N 2.82Å
169L96.6Very high97.6Very high18 Ų1839.7 Ų39.79%0.09423%0.232CC..SBendtrans-117.9135.8-177.2-53.5-179000111.3E122 V125 A165 H173 I175 R176E122-L169 HydrophobicContact CB-CD2 4.43Å; V125-L169 HydrophobicContact CB-CD1 4.13Å; V125-L169 HydrophobicContact CG1-CD1 4.2Å; V125-L169 HydrophobicContact CG2-CD1 3.92Å; A165-L169 HydrophobicContact CB-CD1 4.28Å; A165-L169 WeakPolarHBondContact O-CA 3.33Å; A165-L169 WeakPolarHBondContact O-CB 3.24Å; A165-L169 PolarHBondContact O-N 2.83Å; A165-L169 VanDerWaalsContact O-O 3.06Å; L169-H173 HydrophobicContact CB-CB 4.04Å; L169-I175 HydrophobicContact CD1-CG2 4.31Å; L169-R176 HydrophobicContact CB-CB 4.21Å; L169-R176 HydrophobicContact CD1-CB 4.34Å; L169-R176 WeakPolarHBondContact O-CD 3.33Å; L169-R176 PolarHBondContact O-NH1 3.41Å
170A95.8Very high97.6Very high48 Ų4835.4 Ų35.440%0.39722%0.216SC..  trans-57.8146.7173.800000111.2T172 H173 R176A170-T172 PolarHBondContact O-N 2.9Å; A170-H173 WeakPolarHBondContact O-CB 3.2Å; A170-H173 PolarHBondContact O-N 3.35Å; A170-R176 WeakPolarHBondContact O-CD 3.43Å
171P96.8Very high97.6Very high18 Ų1834.5 Ų34.512%0.11721%0.206CC..THydrogen-bonded Turntrans-51.6-28.7175.9-28.334.8000114.9L177 E207 E211P171-L177 WeakPolarHBondContact O-CG 3.41Å; P171-E207 HydrophobicContact CB-CB 3.82Å; P171-E207 HydrophobicContact CG-CB 4.34Å; P171-E211 WeakPolarHBondContact CD-OE2 3.32Å
172T95.9Very high97.6Very high5 Ų535.9 Ų35.93%0.03121%0.214CC..THydrogen-bonded Turntrans-87-2.8178.654.20000114.2A170 A208 E211 L215 S223A170-T172 PolarHBondContact O-N 2.9Å; T172-A208 HydrophobicContact CG2-CB 4.23Å; T172-A208 VanDerWaalsContact CG2-O 3.26Å; T172-A208 WeakPolarHBondContact CG2-O 3.24Å; T172-E211 HydrophobicContact CG2-CB 3.79Å; T172-L215 HydrophobicContact CG2-CD1 3.95Å; T172-L215 WeakPolarHBondContact OG1-CD1 3.5Å; T172-S223 WeakPolarHBondContact O-CB 3.4Å; T172-S223 PolarHBondContact O-OG 2.92Å
173H95.6Very high97.6Very high42 Ų4233 Ų3319%0.19420%0.2CC..  trans-66.3128.5-178.3-167.9-73.3000111E122 L169 A170 I175 R176 L177E122-H173 IonicContact OE2-CE1 2.87Å; E122-H173 IonicContact OE2-NE2 3.83Å; E122-H173 PolarHBondContact OE2-NE2 3.11Å; L169-H173 HydrophobicContact CB-CB 4.04Å; A170-H173 WeakPolarHBondContact O-CB 3.2Å; A170-H173 PolarHBondContact O-N 3.35Å; H173-I175 VanDerWaalsContact C-N 3.29Å; H173-I175 PolarHBondContact ND1-N 2.93Å; H173-I175 PolarHBondContact O-N 2.87Å; H173-I175 VanDerWaalsContact O-N 3.14Å; H173-R176 HydrophobicContact CB-CB 4.25Å; H173-R176 PolarHBondContact O-N 3.33Å; H173-L177 PolarHBondContact O-N 2.96Å
174P96.1Very high97.6Very high22 Ų2227.3 Ų27.314%0.14317%0.17CC..Hα-helixtrans-54.2-39.8-174.7-27.131.7000114.2G178 D222 S223 I226P174-G178 PolarHBondContact O-N 2.98Å; P174-D222 HydrophobicContact CB-CB 4.16Å; P174-D222 HydrophobicContact CG-CB 4.04Å; P174-S223 WeakPolarHBondContact CD-OG 3.36Å; P174-S223 WeakPolarHBondContact CG-OG 3.49Å; P174-I226 HydrophobicContact CB-CD1 4.09Å; P174-I226 VanDerWaalsContact O-CD1 3.27Å; P174-I226 WeakPolarHBondContact O-CD1 3.29Å
175I97.2Very high97.6Very high22 Ų2226.5 Ų26.511%0.11317%0.165CC..Hα-helixtrans-67.1-39.2177.9-70.1169000112.4E122 V125 F126 L169 H173 G178 L179E122-I175 HydrophobicContact CG-CD1 3.33Å; V125-I175 HydrophobicContact CB-CG2 3.96Å; V125-I175 HydrophobicContact CG1-CG2 3.51Å; F126-I175 HydrophobicContact CB-CD1 4.31Å; F126-I175 HydrophobicContact CD2-CD1 3.82Å; F126-I175 HydrophobicContact CD2-CG1 4.18Å; L169-I175 HydrophobicContact CD1-CG2 4.31Å; H173-I175 VanDerWaalsContact C-N 3.29Å; H173-I175 PolarHBondContact ND1-N 2.93Å; H173-I175 PolarHBondContact O-N 2.87Å; H173-I175 VanDerWaalsContact O-N 3.14Å; I175-G178 PolarHBondContact O-N 2.69Å; I175-L179 WeakPolarHBondContact O-CB 3.31Å; I175-L179 PolarHBondContact O-N 3.35Å
176R98.1Very high97.6Very high33 Ų3326.4 Ų26.413%0.12516%0.164CC..Hα-helixtrans-67.9-45176.6177173.3168.1173.4-5.2110.7A165 L169 A170 H173 L179 A180 E207A165-R176 HydrophobicContact CB-CB 4.28Å; A165-R176 HydrophobicContact CB-CG 4.1Å; L169-R176 HydrophobicContact CB-CB 4.21Å; L169-R176 HydrophobicContact CD1-CB 4.34Å; L169-R176 WeakPolarHBondContact O-CD 3.33Å; L169-R176 PolarHBondContact O-NH1 3.41Å; A170-R176 WeakPolarHBondContact O-CD 3.43Å; H173-R176 HydrophobicContact CB-CB 4.25Å; H173-R176 PolarHBondContact O-N 3.33Å; R176-L179 WeakPolarHBondContact O-CB 3.03Å; R176-L179 PolarHBondContact O-N 2.91Å; R176-A180 PolarHBondContact O-N 3.48Å; R176-E207 IonicContact CZ-OE2 3.4Å; R176-E207 IonicContact NH2-OE2 3.29Å; R176-E207 PolarHBondContact NH2-OE2 3.17Å
177L98.3Very high97.7Very high2 Ų223.6 Ų23.61%0.0115%0.145CC..Hα-helixtrans-59.8-45.8173.9-75.8172.9000111.8P171 H173 L179 A180 L181 A208 I226 M227 L230P171-L177 WeakPolarHBondContact O-CG 3.41Å; H173-L177 PolarHBondContact O-N 2.96Å; L177-L179 VanDerWaalsContact C-N 3.29Å; L177-L179 PolarHBondContact O-N 3.5Å; L177-A180 PolarHBondContact O-N 3.1Å; L177-L181 PolarHBondContact O-N 3.39Å; L177-A208 HydrophobicContact CD2-CB 3.75Å; L177-I226 HydrophobicContact CB-CB 4.17Å; L177-I226 HydrophobicContact CB-CD1 4.34Å; L177-I226 HydrophobicContact CB-CG2 3.65Å; L177-M227 HydrophobicContact CD1-CG 4.03Å; L177-M227 HydrophobicContact CD1-SD 4.5Å; L177-M227 HydrophobicContact CD2-CG 4.24Å; L177-L230 HydrophobicContact CD2-CD1 4.08Å
178G98.2Very high97.7Very high10 Ų1022.6 Ų22.610%0.10313%0.125CC..Hα-helixtrans-63.7-34.5178.200000112.5K129 P174 I175 N182K129-G178 WeakPolarHBondContact CE-O 3.26Å; P174-G178 PolarHBondContact O-N 2.98Å; I175-G178 PolarHBondContact O-N 2.69Å; G178-N182 WeakPolarHBondContact O-CB 3.49Å; G178-N182 PolarHBondContact O-N 3.04Å
179L98.7Very high97.6Very high5 Ų522.3 Ų22.33%0.02612%0.121CC..Hα-helixtrans-64.5-49.3171.317263.8000111V125 K129 Y158 A161 Q162 A165 I175 R176 L177 L181 N182 F183V125-L179 HydrophobicContact CG1-CD2 4.18Å; K129-L179 HydrophobicContact CB-CD1 4.1Å; K129-L179 HydrophobicContact CD-CB 4.11Å; K129-L179 HydrophobicContact CG-CB 4.3Å; K129-L179 HydrophobicContact CG-CD1 4.01Å; Y158-L179 HydrophobicContact CD1-CD1 3.56Å; Y158-L179 HydrophobicContact CE1-CD1 4.21Å; Y158-L179 HydrophobicContact CG-CD1 4.24Å; A161-L179 VanDerWaalsContact C-CD2 3.45Å; A161-L179 HydrophobicContact CB-CD1 3.79Å; A161-L179 HydrophobicContact CB-CD2 3.61Å; A161-L179 HydrophobicContact CB-CG 4.36Å; Q162-L179 HydrophobicContact CB-CD2 4.06Å; A165-L179 HydrophobicContact CB-CD2 4.05Å; I175-L179 WeakPolarHBondContact O-CB 3.31Å; I175-L179 PolarHBondContact O-N 3.35Å; R176-L179 WeakPolarHBondContact O-CB 3.03Å; R176-L179 PolarHBondContact O-N 2.91Å; L177-L179 VanDerWaalsContact C-N 3.29Å; L177-L179 PolarHBondContact O-N 3.5Å; L179-L181 VanDerWaalsContact C-N 3.3Å; L179-L181 PolarHBondContact O-N 3.28Å; L179-N182 PolarHBondContact O-N 3.22Å; L179-F183 VanDerWaalsContact O-CB 3.22Å; L179-F183 WeakPolarHBondContact O-CB 3.3Å; L179-F183 PolarHBondContact O-N 3.38Å
180A98.7Very high97.7Very high15 Ų1522.1 Ų22.112%0.12412%0.12CC..Hα-helixtrans-60-40.8178.900000112.3R176 L177 S184 A204R176-A180 PolarHBondContact O-N 3.48Å; L177-A180 PolarHBondContact O-N 3.1Å; A180-S184 WeakPolarHBondContact O-CB 3.46Å; A180-S184 PolarHBondContact O-N 3.42Å; A180-S184 PolarHBondContact O-OG 2.89Å; A180-A204 HydrophobicContact CB-CB 3.46Å; A180-A204 VanDerWaalsContact CB-CB 3.46Å
181L98.6Very high97.8Very high18 Ų1823 Ų239%0.09412%0.117CC..Hα-helixtrans-58.4-53.5173.5177.665.2000111.1L177 L179 F183 S184 V185 I226 L229 L230 N233L177-L181 PolarHBondContact O-N 3.39Å; L179-L181 VanDerWaalsContact C-N 3.3Å; L179-L181 PolarHBondContact O-N 3.28Å; L181-F183 VanDerWaalsContact C-N 3.35Å; L181-F183 PolarHBondContact O-N 3.45Å; L181-S184 PolarHBondContact O-N 2.91Å; L181-S184 PolarHBondContact O-OG 2.67Å; L181-V185 VanDerWaalsContact O-CG2 3.26Å; L181-V185 WeakPolarHBondContact O-CG2 3.37Å; L181-V185 PolarHBondContact O-N 2.99Å; L181-V185 VanDerWaalsContact O-N 3.08Å; L181-I226 HydrophobicContact CB-CG2 4.24Å; L181-I226 HydrophobicContact CD2-CG2 4.14Å; L181-L229 HydrophobicContact CD1-CB 4.14Å; L181-L229 HydrophobicContact CD2-CB 3.91Å; L181-L229 HydrophobicContact CD2-CD1 3.91Å; L181-L230 HydrophobicContact CB-CD2 3.96Å; L181-L230 HydrophobicContact CB-CG 4.25Å; L181-L230 HydrophobicContact CD1-CD2 3.91Å; L181-L230 HydrophobicContact CD1-CG 4.12Å; L181-N233 VanDerWaalsContact CD1-ND2 3.3Å; L181-N233 WeakPolarHBondContact CD1-ND2 3.44Å
182N98.5Very high97.8Very high29 Ų2928.4 Ų28.416%0.15515%0.145CC..Hα-helixtrans-72.4-30.4-174.7-727000112.9K129 D133 Y158 G178 L179 F186K129-N182 WeakPolarHBondContact CE-ND2 3.25Å; K129-N182 PolarHBondContact NZ-ND2 3.19Å; D133-N182 WeakPolarHBondContact OD1-CB 3.5Å; D133-N182 PolarHBondContact OD1-ND2 2.98Å; D133-N182 PolarHBondContact OD2-ND2 3.09Å; Y158-N182 HydrophobicContact CE1-CB 4.45Å; G178-N182 WeakPolarHBondContact O-CB 3.49Å; G178-N182 PolarHBondContact O-N 3.04Å; L179-N182 PolarHBondContact O-N 3.22Å; N182-F186 PolarHBondContact O-N 3Å; N182-F186 VanDerWaalsContact O-N 3.12Å
183F98.7Very high97.8Very high1 Ų130.3 Ų30.30%0.00416%0.159CC..Hα-helixtrans-74.1-38.9176.8-162.2-179000111.4M155 Y158 K159 L179 L181 F186 Y187 M200M155-F183 HydrophobicContact SD-CE2 3.75Å; M155-F183 HydrophobicContact SD-CZ 3.68Å; Y158-F183 HydrophobicContact CD2-CB 4.08Å; Y158-F183 AromaticContact CD2-CD2 3.4Å; Y158-F183 HydrophobicContact CD2-CD2 3.4Å; Y158-F183 VanDerWaalsContact CD2-CD2 3.4Å; Y158-F183 AromaticContact CD2-CE2 3.91Å; Y158-F183 HydrophobicContact CD2-CE2 3.91Å; Y158-F183 AromaticContact CD2-CG 3.83Å; Y158-F183 HydrophobicContact CD2-CG 3.83Å; Y158-F183 HydrophobicContact CE2-CB 4.48Å; Y158-F183 HydrophobicContact CE2-CD2 4.25Å; Y158-F183 HydrophobicContact CG-CB 4.2Å; Y158-F183 HydrophobicContact CG-CD1 4.38Å; Y158-F183 AromaticContact CG-CD2 3.91Å; Y158-F183 HydrophobicContact CG-CD2 3.91Å; Y158-F183 HydrophobicContact CG-CE2 4.31Å; Y158-F183 AromaticContact CG-CG 3.94Å; Y158-F183 HydrophobicContact CG-CG 3.94Å; K159-F183 HydrophobicContact CG-CE1 4.29Å; K159-F183 HydrophobicContact CG-CZ 3.96Å; L179-F183 VanDerWaalsContact O-CB 3.22Å; L179-F183 WeakPolarHBondContact O-CB 3.3Å; L179-F183 PolarHBondContact O-N 3.38Å; L181-F183 VanDerWaalsContact C-N 3.35Å; L181-F183 PolarHBondContact O-N 3.45Å; F183-F186 HydrophobicContact CD2-CB 4.49Å; F183-F186 AromaticContact CD2-CD1 3.9Å; F183-F186 HydrophobicContact CD2-CD1 3.9Å; F183-F186 AromaticContact CE2-CD1 3.85Å; F183-F186 HydrophobicContact CE2-CD1 3.85Å; F183-F186 HydrophobicContact CE2-CE1 4.3Å; F183-F186 WeakPolarHBondContact O-CB 3.49Å; F183-F186 PolarHBondContact O-N 3.49Å; F183-Y187 AromaticContact CD2-CD2 3.9Å; F183-Y187 HydrophobicContact CD2-CD2 3.9Å; F183-Y187 AromaticContact CD2-CE2 3.54Å; F183-Y187 HydrophobicContact CD2-CE2 3.54Å; F183-Y187 HydrophobicContact CE1-CE2 4.38Å; F183-Y187 HydrophobicContact CE2-CD2 4.08Å; F183-Y187 AromaticContact CE2-CE2 3.33Å; F183-Y187 HydrophobicContact CE2-CE2 3.33Å; F183-Y187 AromaticContact CE2-CZ 3.8Å; F183-Y187 HydrophobicContact CG-CE2 4.18Å; F183-Y187 AromaticContact CZ-CE2 3.8Å; F183-Y187 HydrophobicContact CZ-CE2 3.8Å; F183-Y187 VanDerWaalsContact O-CD2 3.26Å; F183-Y187 WeakPolarHBondContact O-CD2 3.49Å; F183-Y187 PolarHBondContact O-N 3.29Å; F183-Y187 VanDerWaalsContact O-N 3.11Å; F183-M200 HydrophobicContact CB-SD 3.69Å; F183-M200 HydrophobicContact CD1-CE 3.68Å; F183-M200 HydrophobicContact CD1-SD 3.83Å; F183-M200 HydrophobicContact CD2-SD 4.45Å; F183-M200 HydrophobicContact CE1-CE 3.97Å; F183-M200 HydrophobicContact CG-CE 4.05Å; F183-M200 HydrophobicContact CG-SD 3.71Å
184S98.6Very high97.8Very high0 Ų029.9 Ų29.90%016%0.16CC..Hα-helixtrans-63.7-41172.3600000112A180 L181 F186 Y187 Y188 A197A180-S184 WeakPolarHBondContact O-CB 3.46Å; A180-S184 PolarHBondContact O-N 3.42Å; A180-S184 PolarHBondContact O-OG 2.89Å; L181-S184 PolarHBondContact O-N 2.91Å; L181-S184 PolarHBondContact O-OG 2.67Å; S184-F186 VanDerWaalsContact C-N 3.28Å; S184-F186 PolarHBondContact O-N 2.63Å; S184-Y187 PolarHBondContact O-N 2.89Å; S184-Y187 VanDerWaalsContact O-N 3.16Å; S184-Y188 PolarHBondContact O-N 3.42Å; S184-A197 WeakPolarHBondContact CB-O 3.27Å; S184-A197 VanDerWaalsContact O-CB 3.28Å; S184-A197 WeakPolarHBondContact O-CB 3.33Å
185V98.4Very high97.8Very high16 Ų1636 Ų3610%0.09719%0.187CC..Hα-helixtrans-58.2-39.6172.81720000111.6L181 Y188 E189 W237L181-V185 VanDerWaalsContact O-CG2 3.26Å; L181-V185 WeakPolarHBondContact O-CG2 3.37Å; L181-V185 PolarHBondContact O-N 2.99Å; L181-V185 VanDerWaalsContact O-N 3.08Å; V185-Y188 PolarHBondContact O-N 3.25Å; V185-E189 VanDerWaalsContact CG1-CD 3.42Å; V185-E189 HydrophobicContact CG1-CG 3.93Å; V185-E189 VanDerWaalsContact CG1-OE2 3.28Å; V185-E189 WeakPolarHBondContact CG1-OE2 3.32Å; V185-E189 WeakPolarHBondContact O-CB 3Å; V185-E189 PolarHBondContact O-N 2.95Å; V185-W237 HydrophobicContact CG2-CH2 4.04Å; V185-W237 HydrophobicContact CG2-CZ2 3.96Å
186F98.7Very high97.8Very high0 Ų039.5 Ų39.50%020%0.202CC..Hα-helixtrans-62.3-45.4174.6170.1-115.4000113.1R136 A151 T154 M155 Y158 N182 F183 S184 Y188 I190 L191R136-F186 HydrophobicContact CG-CD2 4.17Å; A151-F186 HydrophobicContact CB-CE2 4.27Å; A151-F186 HydrophobicContact CB-CZ 4.38Å; A151-F186 VanDerWaalsContact O-CZ 3.3Å; A151-F186 WeakPolarHBondContact O-CZ 3.45Å; T154-F186 HydrophobicContact CG2-CB 4.4Å; T154-F186 HydrophobicContact CG2-CD1 4.02Å; T154-F186 HydrophobicContact CG2-CD2 3.41Å; T154-F186 VanDerWaalsContact CG2-CD2 3.41Å; T154-F186 HydrophobicContact CG2-CE1 4.07Å; T154-F186 HydrophobicContact CG2-CE2 3.5Å; T154-F186 HydrophobicContact CG2-CG 3.68Å; T154-F186 HydrophobicContact CG2-CZ 3.84Å; M155-F186 HydrophobicContact CB-CE1 4.09Å; M155-F186 HydrophobicContact CB-CZ 4.33Å; M155-F186 HydrophobicContact CE-CE1 3.7Å; M155-F186 HydrophobicContact SD-CE1 4.26Å; Y158-F186 HydrophobicContact CD2-CB 4.33Å; Y158-F186 HydrophobicContact CD2-CD1 4.31Å; Y158-F186 HydrophobicContact CD2-CG 4.44Å; Y158-F186 HydrophobicContact CE2-CB 3.83Å; Y158-F186 HydrophobicContact CE2-CG 4.23Å; N182-F186 PolarHBondContact O-N 3Å; N182-F186 VanDerWaalsContact O-N 3.12Å; F183-F186 HydrophobicContact CD2-CB 4.49Å; F183-F186 AromaticContact CD2-CD1 3.9Å; F183-F186 HydrophobicContact CD2-CD1 3.9Å; F183-F186 AromaticContact CE2-CD1 3.85Å; F183-F186 HydrophobicContact CE2-CD1 3.85Å; F183-F186 HydrophobicContact CE2-CE1 4.3Å; F183-F186 WeakPolarHBondContact O-CB 3.49Å; F183-F186 PolarHBondContact O-N 3.49Å; S184-F186 VanDerWaalsContact C-N 3.28Å; S184-F186 PolarHBondContact O-N 2.63Å; F186-Y188 VanDerWaalsContact C-N 3.26Å; F186-Y188 PolarHBondContact O-N 3.24Å; F186-I190 HydrophobicContact CD2-CB 3.57Å; F186-I190 HydrophobicContact CD2-CG1 3.72Å; F186-I190 HydrophobicContact CD2-CG2 4.03Å; F186-I190 HydrophobicContact CE2-CB 3.69Å; F186-I190 HydrophobicContact CE2-CG1 4.18Å; F186-I190 HydrophobicContact CE2-CG2 3.61Å; F186-I190 WeakPolarHBondContact O-CB 3.08Å; F186-I190 PolarHBondContact O-N 3.4Å; F186-L191 HydrophobicContact CD1-CD1 4.05Å; F186-L191 HydrophobicContact CD1-CG 4.4Å; F186-L191 HydrophobicContact CE1-CD1 3.43Å; F186-L191 VanDerWaalsContact CE1-CD1 3.43Å; F186-L191 HydrophobicContact CE1-CD2 4.41Å; F186-L191 HydrophobicContact CE1-CG 3.87Å; F186-L191 HydrophobicContact CE2-CD2 4.32Å; F186-L191 HydrophobicContact CE2-CG 4.16Å; F186-L191 HydrophobicContact CZ-CD1 3.74Å; F186-L191 HydrophobicContact CZ-CD2 3.85Å; F186-L191 HydrophobicContact CZ-CG 3.72Å; F186-L191 PolarHBondContact O-N 3.33Å
187Y98.5Very high97.7Very high24 Ų2438 Ų389%0.09420%0.196CC..Hα-helixtrans-58.7-41.5176-82.1-70.6000111.5M155 F183 S184 L191 N192 S193 K196 M200M155-Y187 HydrophobicContact CE-CE1 3.74Å; F183-Y187 AromaticContact CD2-CD2 3.9Å; F183-Y187 HydrophobicContact CD2-CD2 3.9Å; F183-Y187 AromaticContact CD2-CE2 3.54Å; F183-Y187 HydrophobicContact CD2-CE2 3.54Å; F183-Y187 HydrophobicContact CE1-CE2 4.38Å; F183-Y187 HydrophobicContact CE2-CD2 4.08Å; F183-Y187 AromaticContact CE2-CE2 3.33Å; F183-Y187 HydrophobicContact CE2-CE2 3.33Å; F183-Y187 AromaticContact CE2-CZ 3.8Å; F183-Y187 HydrophobicContact CG-CE2 4.18Å; F183-Y187 AromaticContact CZ-CE2 3.8Å; F183-Y187 HydrophobicContact CZ-CE2 3.8Å; F183-Y187 VanDerWaalsContact O-CD2 3.26Å; F183-Y187 WeakPolarHBondContact O-CD2 3.49Å; F183-Y187 PolarHBondContact O-N 3.29Å; F183-Y187 VanDerWaalsContact O-N 3.11Å; S184-Y187 PolarHBondContact O-N 2.89Å; S184-Y187 VanDerWaalsContact O-N 3.16Å; Y187-L191 HydrophobicContact CD1-CD1 3.72Å; Y187-L191 HydrophobicContact CE1-CD1 3.89Å; Y187-L191 CarbonylContact O-C 3.51Å; Y187-N192 PolarHBondContact O-N 3.02Å; Y187-S193 PolarHBondContact O-N 3.49Å; Y187-K196 HydrophobicContact CD1-CB 4Å; Y187-K196 HydrophobicContact CD1-CG 3.59Å; Y187-K196 HydrophobicContact CD2-CG 4.19Å; Y187-K196 HydrophobicContact CE1-CB 4.44Å; Y187-K196 HydrophobicContact CE1-CG 3.59Å; Y187-K196 HydrophobicContact CE2-CG 4.2Å; Y187-K196 HydrophobicContact CG-CB 4.27Å; Y187-K196 HydrophobicContact CG-CG 3.91Å; Y187-M200 HydrophobicContact CD2-CE 4.16Å; Y187-M200 HydrophobicContact CD2-SD 4.1Å; Y187-M200 HydrophobicContact CE2-CE 3.56Å; Y187-M200 HydrophobicContact CE2-SD 4.06Å
188Y98.2Very high97.7Very high56 Ų5638.7 Ų38.722%0.2220%0.201CC..Hα-helixtrans-72.2-60.8179.8-176.2-91.6000111.8S184 V185 F186 N192 W237 D240S184-Y188 PolarHBondContact O-N 3.42Å; V185-Y188 PolarHBondContact O-N 3.25Å; F186-Y188 VanDerWaalsContact C-N 3.26Å; F186-Y188 PolarHBondContact O-N 3.24Å; Y188-N192 WeakPolarHBondContact O-CA 3.45Å; Y188-N192 PolarHBondContact O-N 2.94Å; Y188-W237 AromaticContact CD1-CD1 3.86Å; Y188-W237 AromaticContact CD1-CE2 3.94Å; Y188-W237 HydrophobicContact CD1-CZ2 4.45Å; Y188-W237 AromaticContact CD1-NE1 3.41Å; Y188-W237 HydrophobicContact CD2-CB 3.95Å; Y188-W237 AromaticContact CD2-CD1 3.4Å; Y188-W237 VanDerWaalsContact CD2-CD1 3.4Å; Y188-W237 AromaticContact CD2-CD2 3.77Å; Y188-W237 HydrophobicContact CD2-CD2 3.77Å; Y188-W237 AromaticContact CD2-CE2 3.9Å; Y188-W237 AromaticContact CD2-CG 3.43Å; Y188-W237 HydrophobicContact CD2-CG 3.43Å; Y188-W237 VanDerWaalsContact CD2-CG 3.43Å; Y188-W237 AromaticContact CD2-NE1 3.67Å; Y188-W237 AromaticContact CE1-CD1 3.65Å; Y188-W237 AromaticContact CE1-NE1 3.53Å; Y188-W237 HydrophobicContact CE2-CB 3.75Å; Y188-W237 AromaticContact CE2-CD1 3.13Å; Y188-W237 HydrophobicContact CE2-CD2 4.26Å; Y188-W237 AromaticContact CE2-CG 3.44Å; Y188-W237 HydrophobicContact CE2-CG 3.44Å; Y188-W237 VanDerWaalsContact CE2-CG 3.44Å; Y188-W237 AromaticContact CE2-NE1 3.76Å; Y188-W237 AromaticContact CG-CD1 3.76Å; Y188-W237 AromaticContact CG-CD2 3.98Å; Y188-W237 HydrophobicContact CG-CD2 3.98Å; Y188-W237 AromaticContact CG-CE2 3.64Å; Y188-W237 HydrophobicContact CG-CG 4.03Å; Y188-W237 HydrophobicContact CG-CZ2 4.17Å; Y188-W237 AromaticContact CG-NE1 3.49Å; Y188-W237 AromaticContact CZ-CD1 3.27Å; Y188-W237 AromaticContact CZ-NE1 3.7Å; Y188-D240 PolarHBondContact OH-OD2 3.1Å
189E96.4Very high97.7Very high84 Ų8441.2 Ų41.239%0.39322%0.217SC..Hα-helixtrans-77.3-30.5-168.4-63.9-175.7161.200114.4R136 V185R136-E189 IonicContact NH1-OE2 2.64Å; V185-E189 VanDerWaalsContact CG1-CD 3.42Å; V185-E189 HydrophobicContact CG1-CG 3.93Å; V185-E189 VanDerWaalsContact CG1-OE2 3.28Å; V185-E189 WeakPolarHBondContact CG1-OE2 3.32Å; V185-E189 WeakPolarHBondContact O-CB 3Å; V185-E189 PolarHBondContact O-N 2.95Å
190I98Very high97.6Very high14 Ų1441.7 Ų41.77%0.07222%0.219CC..THydrogen-bonded Turntrans-107.2-42-172.9-54.5-57.5000112R136 A139 E140 A151 F186R136-I190 HydrophobicContact CG-CG1 4.02Å; A139-I190 HydrophobicContact CB-CD1 4.35Å; A139-I190 HydrophobicContact CB-CG2 3.9Å; E140-I190 HydrophobicContact CG-CD1 3.81Å; A151-I190 HydrophobicContact CB-CG2 4.08Å; F186-I190 HydrophobicContact CD2-CB 3.57Å; F186-I190 HydrophobicContact CD2-CG1 3.72Å; F186-I190 HydrophobicContact CD2-CG2 4.03Å; F186-I190 HydrophobicContact CE2-CB 3.69Å; F186-I190 HydrophobicContact CE2-CG1 4.18Å; F186-I190 HydrophobicContact CE2-CG2 3.61Å; F186-I190 WeakPolarHBondContact O-CB 3.08Å; F186-I190 PolarHBondContact O-N 3.4Å
191L97.5Very high97.6Very high67 Ų6741 Ų4135%0.35121%0.214SC..THydrogen-bonded Turntrans-93.6-5.6-178-58.9-176.4000113.7M155 F186 Y187 S193M155-L191 HydrophobicContact CE-CD1 3.43Å; M155-L191 VanDerWaalsContact CE-CD1 3.43Å; F186-L191 HydrophobicContact CD1-CD1 4.05Å; F186-L191 HydrophobicContact CD1-CG 4.4Å; F186-L191 HydrophobicContact CE1-CD1 3.43Å; F186-L191 VanDerWaalsContact CE1-CD1 3.43Å; F186-L191 HydrophobicContact CE1-CD2 4.41Å; F186-L191 HydrophobicContact CE1-CG 3.87Å; F186-L191 HydrophobicContact CE2-CD2 4.32Å; F186-L191 HydrophobicContact CE2-CG 4.16Å; F186-L191 HydrophobicContact CZ-CD1 3.74Å; F186-L191 HydrophobicContact CZ-CD2 3.85Å; F186-L191 HydrophobicContact CZ-CG 3.72Å; F186-L191 PolarHBondContact O-N 3.33Å; Y187-L191 HydrophobicContact CD1-CD1 3.72Å; Y187-L191 HydrophobicContact CE1-CD1 3.89Å; Y187-L191 CarbonylContact O-C 3.51Å; L191-S193 PolarHBondContact O-N 3.46Å
192N96.1Very high97.5Very high131 Ų13145.4 Ų45.470%0.70123%0.232SC*.  trans49.839.6-176-56.9-55000112.3Y187 Y188Y187-N192 PolarHBondContact O-N 3.02Å; Y188-N192 WeakPolarHBondContact O-CA 3.45Å; Y188-N192 PolarHBondContact O-N 2.94Å
193S96.7Very high97.5Very high45 Ų4548.9 Ų48.932%0.31525%0.247SC..  trans-112.868.1-177.3-165.90000109.7Y187 L191 E195 K196 A197Y187-S193 PolarHBondContact O-N 3.49Å; L191-S193 PolarHBondContact O-N 3.46Å; S193-E195 VanDerWaalsContact C-N 3.34Å; S193-E195 PolarHBondContact O-N 3.17Å; S193-K196 PolarHBondContact O-N 3.3Å; S193-K196 VanDerWaalsContact O-N 3.11Å; S193-K196 WeakPolarHBondContact OG-CB 3.22Å; S193-A197 PolarHBondContact O-N 2.93Å
194S95.7Very high97.5Very high33 Ų3349.4 Ų49.423%0.23125%0.251CS..Hα-helixtrans-57.8-42.5-174.8-52.20000112.7K196 A197 C198S194-K196 VanDerWaalsContact C-N 3.32Å; S194-K196 PolarHBondContact O-N 3.39Å; S194-A197 PolarHBondContact O-N 2.95Å; S194-C198 WeakPolarHBondContact O-CB 3.45Å; S194-C198 PolarHBondContact O-N 2.92Å; S194-C198 PolarHBondContact O-SG 2.86Å; S194-C198 VanDerWaalsContact O-SG 3.35Å
195E95.6Very high97.4Very high150 Ų15051.5 Ų51.570%0.70126%0.261SS*.Hα-helixtrans-57.2-44.7175.3-69.6-178.1-178.900112.3S193 S199 M241S193-E195 VanDerWaalsContact C-N 3.34Å; S193-E195 PolarHBondContact O-N 3.17Å; E195-S199 VanDerWaalsContact O-CB 3.28Å; E195-S199 WeakPolarHBondContact O-CB 3.45Å; E195-S199 PolarHBondContact O-N 3Å; E195-M241 HydrophobicContact CG-CE 3.7Å
196K97Very high97.4Very high97 Ų9755.8 Ų55.842%0.42228%0.28SS..Hα-helixtrans-70.5-39-179.2-171.259.9175.71770111.4Y187 S193 S194 M200Y187-K196 HydrophobicContact CD1-CB 4Å; Y187-K196 HydrophobicContact CD1-CG 3.59Å; Y187-K196 HydrophobicContact CD2-CG 4.19Å; Y187-K196 HydrophobicContact CE1-CB 4.44Å; Y187-K196 HydrophobicContact CE1-CG 3.59Å; Y187-K196 HydrophobicContact CE2-CG 4.2Å; Y187-K196 HydrophobicContact CG-CB 4.27Å; Y187-K196 HydrophobicContact CG-CG 3.91Å; S193-K196 PolarHBondContact O-N 3.3Å; S193-K196 VanDerWaalsContact O-N 3.11Å; S193-K196 WeakPolarHBondContact OG-CB 3.22Å; S194-K196 VanDerWaalsContact C-N 3.32Å; S194-K196 PolarHBondContact O-N 3.39Å; K196-M200 WeakPolarHBondContact O-CB 3.36Å; K196-M200 PolarHBondContact O-N 3.42Å
197A97.7Very high97.3Very high0 Ų058.7 Ų58.70%029%0.293CS..Hα-helixtrans-60-50.4174.100000111.3S184 S193 S194 M200 A201 W237S184-A197 WeakPolarHBondContact CB-O 3.27Å; S184-A197 VanDerWaalsContact O-CB 3.28Å; S184-A197 WeakPolarHBondContact O-CB 3.33Å; S193-A197 PolarHBondContact O-N 2.93Å; S194-A197 PolarHBondContact O-N 2.95Å; A197-M200 PolarHBondContact O-N 2.84Å; A197-A201 WeakPolarHBondContact O-CB 3.28Å; A197-A201 PolarHBondContact O-N 2.73Å; A197-W237 HydrophobicContact CB-CE3 4.01Å; A197-W237 HydrophobicContact CB-CZ3 3.9Å
198C97.5Very high97.1Very high17 Ų1757.5 Ų57.512%0.11529%0.289CS..Hα-helixtrans-62.2-46177.8-71.50000111.9S194 M200 A201 K202 L234 W237S194-C198 WeakPolarHBondContact O-CB 3.45Å; S194-C198 PolarHBondContact O-N 2.92Å; S194-C198 PolarHBondContact O-SG 2.86Å; S194-C198 VanDerWaalsContact O-SG 3.35Å; C198-M200 VanDerWaalsContact C-N 3.33Å; C198-M200 PolarHBondContact O-N 2.99Å; C198-A201 PolarHBondContact O-N 3.23Å; C198-K202 WeakPolarHBondContact O-CB 3.32Å; C198-K202 PolarHBondContact O-N 3.45Å; C198-L234 HydrophobicContact CB-CD2 4.22Å; C198-L234 VanDerWaalsContact O-CD2 3.31Å; C198-L234 WeakPolarHBondContact O-CD2 3.27Å; C198-W237 VanDerWaalsContact SG-CB 3.58Å
199S97.5Very high97Very high64 Ų6459 Ų5945%0.44830%0.3SS..Hα-helixtrans-57.7-45.6176.91710000111.8E195 Q203E195-S199 VanDerWaalsContact O-CB 3.28Å; E195-S199 WeakPolarHBondContact O-CB 3.45Å; E195-S199 PolarHBondContact O-N 3Å; S199-Q203 WeakPolarHBondContact O-CB 3.44Å; S199-Q203 PolarHBondContact O-N 3.34Å
200M97.9Very high96.9Very high15 Ų1559 Ų597%0.07431%0.314CS..Hα-helixtrans-66.2-48179.4176.7172.1-74.900112.4F183 Y187 K196 A197 C198 K202 Q203 A204F183-M200 HydrophobicContact CB-SD 3.69Å; F183-M200 HydrophobicContact CD1-CE 3.68Å; F183-M200 HydrophobicContact CD1-SD 3.83Å; F183-M200 HydrophobicContact CD2-SD 4.45Å; F183-M200 HydrophobicContact CE1-CE 3.97Å; F183-M200 HydrophobicContact CG-CE 4.05Å; F183-M200 HydrophobicContact CG-SD 3.71Å; Y187-M200 HydrophobicContact CD2-CE 4.16Å; Y187-M200 HydrophobicContact CD2-SD 4.1Å; Y187-M200 HydrophobicContact CE2-CE 3.56Å; Y187-M200 HydrophobicContact CE2-SD 4.06Å; K196-M200 WeakPolarHBondContact O-CB 3.36Å; K196-M200 PolarHBondContact O-N 3.42Å; A197-M200 PolarHBondContact O-N 2.84Å; C198-M200 VanDerWaalsContact C-N 3.33Å; C198-M200 PolarHBondContact O-N 2.99Å; M200-K202 VanDerWaalsContact C-N 3.33Å; M200-K202 PolarHBondContact O-N 2.56Å; M200-Q203 PolarHBondContact O-N 3.4Å; M200-A204 PolarHBondContact O-N 2.89Å
201A97.9Very high96.7Very high0 Ų061.9 Ų61.90%033%0.327CS..Hα-helixtrans-64.5-39.3-179.600000111.7A197 C198 F205 L230 L234 W237A197-A201 WeakPolarHBondContact O-CB 3.28Å; A197-A201 PolarHBondContact O-N 2.73Å; C198-A201 PolarHBondContact O-N 3.23Å; A201-F205 WeakPolarHBondContact O-CB 3.15Å; A201-F205 PolarHBondContact O-N 3.25Å; A201-L230 HydrophobicContact CB-CD2 3.83Å; A201-L234 HydrophobicContact CB-CD1 4.32Å; A201-L234 HydrophobicContact CB-CD2 3.77Å; A201-L234 HydrophobicContact CB-CG 3.83Å; A201-W237 HydrophobicContact CB-CZ3 4.11Å
202K97.4Very high96.4Very high111 Ų11160.4 Ų60.448%0.48332%0.319SS..Hα-helixtrans-64-48.7176.6-178.1176.2175.8179.80111.5C198 M200 A204 F205 E206 L234C198-K202 WeakPolarHBondContact O-CB 3.32Å; C198-K202 PolarHBondContact O-N 3.45Å; M200-K202 VanDerWaalsContact C-N 3.33Å; M200-K202 PolarHBondContact O-N 2.56Å; K202-A204 PolarHBondContact O-N 3.35Å; K202-F205 PolarHBondContact O-N 3.14Å; K202-E206 WeakPolarHBondContact CE-OE1 3.4Å; K202-E206 HydrophobicContact CG-CG 4.32Å; K202-E206 IonicContact NZ-OE1 2.85Å; K202-E206 WeakPolarHBondContact O-CB 3.31Å; K202-E206 WeakPolarHBondContact O-CG 3.46Å; K202-E206 PolarHBondContact O-N 3.38Å; K202-L234 HydrophobicContact CB-CD1 4.26Å; K202-L234 HydrophobicContact CB-CD2 4.04Å
203Q98Very high96.1Very high102 Ų10262.1 Ų62.148%0.47733%0.329SS..Hα-helixtrans-57-49.6177.7179.8-178-9.700111.2S199 M200 F205 E206 E207S199-Q203 WeakPolarHBondContact O-CB 3.44Å; S199-Q203 PolarHBondContact O-N 3.34Å; M200-Q203 PolarHBondContact O-N 3.4Å; Q203-F205 VanDerWaalsContact C-N 3.31Å; Q203-F205 PolarHBondContact O-N 3.27Å; Q203-E206 PolarHBondContact O-N 3.27Å; Q203-E207 HydrophobicContact CG-CG 4.3Å; Q203-E207 VanDerWaalsContact CG-OE1 3.28Å; Q203-E207 WeakPolarHBondContact CG-OE1 3.34Å; Q203-E207 PolarHBondContact NE2-OE1 3Å; Q203-E207 WeakPolarHBondContact O-CB 3.37Å; Q203-E207 VanDerWaalsContact O-CG 3.31Å; Q203-E207 WeakPolarHBondContact O-CG 3.39Å; Q203-E207 PolarHBondContact O-N 2.94Å
204A97.8Very high95.5Very high11 Ų1165.1 Ų65.19%0.09135%0.345CS..Hα-helixtrans-61.8-39.4179.800000112.6A180 M200 K202 A208 L230A180-A204 HydrophobicContact CB-CB 3.46Å; A180-A204 VanDerWaalsContact CB-CB 3.46Å; M200-A204 PolarHBondContact O-N 2.89Å; K202-A204 PolarHBondContact O-N 3.35Å; A204-A208 VanDerWaalsContact O-CB 3.27Å; A204-A208 WeakPolarHBondContact O-CB 3.37Å; A204-A208 PolarHBondContact O-N 2.79Å; A204-A208 VanDerWaalsContact O-N 3.11Å; A204-L230 HydrophobicContact CB-CD1 4.25Å
205F97.1Very high95Very high44 Ų4465.2 Ų65.219%0.19334%0.343CS..Hα-helixtrans-66.5-44.6177.2-173.9-99.3000112.1A201 K202 Q203 A208 I209 M227 L230 R231A201-F205 WeakPolarHBondContact O-CB 3.15Å; A201-F205 PolarHBondContact O-N 3.25Å; K202-F205 PolarHBondContact O-N 3.14Å; Q203-F205 VanDerWaalsContact C-N 3.31Å; Q203-F205 PolarHBondContact O-N 3.27Å; F205-A208 PolarHBondContact O-N 3.39Å; F205-I209 HydrophobicContact CD1-CD1 3.62Å; F205-I209 HydrophobicContact CD1-CG1 4.42Å; F205-I209 HydrophobicContact CE1-CD1 3.13Å; F205-I209 HydrophobicContact CE1-CG1 4.2Å; F205-I209 HydrophobicContact CE2-CD1 4.38Å; F205-I209 HydrophobicContact CG-CD1 4.44Å; F205-I209 HydrophobicContact CZ-CD1 3.57Å; F205-I209 HydrophobicContact CZ-CG1 4.4Å; F205-I209 WeakPolarHBondContact O-CG1 3.47Å; F205-I209 PolarHBondContact O-N 3.01Å; F205-M227 HydrophobicContact CD2-CB 4.06Å; F205-M227 WeakPolarHBondContact CD2-O 3.35Å; F205-M227 HydrophobicContact CE2-CB 4.01Å; F205-M227 HydrophobicContact CE2-CE 4.47Å; F205-M227 VanDerWaalsContact CE2-O 3.32Å; F205-M227 WeakPolarHBondContact CE2-O 3.13Å; F205-L230 HydrophobicContact CD2-CB 4.4Å; F205-R231 HydrophobicContact CD2-CB 4.45Å; F205-R231 HydrophobicContact CE2-CB 3.91Å; F205-R231 HydrophobicContact CZ-CB 4.22Å; F205-R231 HydrophobicContact CZ-CG 4.32Å
206E97.5Very high94.5Very high106 Ų10660.3 Ų60.350%0.49533%0.333SS..Hα-helixtrans-67.2-44.4179.2-72.3176.5166.800112.3K202 Q203 A208 I209 A210K202-E206 WeakPolarHBondContact CE-OE1 3.4Å; K202-E206 HydrophobicContact CG-CG 4.32Å; K202-E206 IonicContact NZ-OE1 2.85Å; K202-E206 WeakPolarHBondContact O-CB 3.31Å; K202-E206 WeakPolarHBondContact O-CG 3.46Å; K202-E206 PolarHBondContact O-N 3.38Å; Q203-E206 PolarHBondContact O-N 3.27Å; E206-A208 VanDerWaalsContact C-N 3.31Å; E206-A208 PolarHBondContact O-N 3.48Å; E206-I209 PolarHBondContact O-N 2.98Å; E206-A210 PolarHBondContact O-N 3.19Å; E206-A210 VanDerWaalsContact O-N 3.12Å
207E96.8Very high93.9Very high61 Ų6164.7 Ų64.729%0.28536%0.355SS..Hα-helixtrans-60-42.3175.2-70.8176.3-175.500111.3P171 R176 Q203 A210P171-E207 HydrophobicContact CB-CB 3.82Å; P171-E207 HydrophobicContact CG-CB 4.34Å; R176-E207 IonicContact CZ-OE2 3.4Å; R176-E207 IonicContact NH2-OE2 3.29Å; R176-E207 PolarHBondContact NH2-OE2 3.17Å; Q203-E207 HydrophobicContact CG-CG 4.3Å; Q203-E207 VanDerWaalsContact CG-OE1 3.28Å; Q203-E207 WeakPolarHBondContact CG-OE1 3.34Å; Q203-E207 PolarHBondContact NE2-OE1 3Å; Q203-E207 WeakPolarHBondContact O-CB 3.37Å; Q203-E207 VanDerWaalsContact O-CG 3.31Å; Q203-E207 WeakPolarHBondContact O-CG 3.39Å; Q203-E207 PolarHBondContact O-N 2.94Å; E207-A210 PolarHBondContact O-N 3.42Å
208A95.8Very high93.1Very high0 Ų073.4 Ų73.40%040%0.396CS..Hα-helixtrans-71.5-36.1179.500000113.2T172 L177 A204 F205 E206 A210 E211 L212 M227T172-A208 HydrophobicContact CG2-CB 4.23Å; T172-A208 VanDerWaalsContact CG2-O 3.26Å; T172-A208 WeakPolarHBondContact CG2-O 3.24Å; L177-A208 HydrophobicContact CD2-CB 3.75Å; A204-A208 VanDerWaalsContact O-CB 3.27Å; A204-A208 WeakPolarHBondContact O-CB 3.37Å; A204-A208 PolarHBondContact O-N 2.79Å; A204-A208 VanDerWaalsContact O-N 3.11Å; F205-A208 PolarHBondContact O-N 3.39Å; E206-A208 VanDerWaalsContact C-N 3.31Å; E206-A208 PolarHBondContact O-N 3.48Å; A208-A210 VanDerWaalsContact C-N 3.3Å; A208-A210 PolarHBondContact O-N 2.94Å; A208-E211 PolarHBondContact O-N 2.81Å; A208-L212 PolarHBondContact O-N 2.98Å; A208-M227 HydrophobicContact CB-CE 3.96Å; A208-M227 HydrophobicContact CB-CG 4.26Å; A208-M227 HydrophobicContact CB-SD 3.94Å
209I95.3Very high92.6Very high87 Ų8774.7 Ų74.745%0.44641%0.405SS..Hα-helixtrans-60-42.9172.9-78.9179.6000110.9F205 E206 E211 L212 M227F205-I209 HydrophobicContact CD1-CD1 3.62Å; F205-I209 HydrophobicContact CD1-CG1 4.42Å; F205-I209 HydrophobicContact CE1-CD1 3.13Å; F205-I209 HydrophobicContact CE1-CG1 4.2Å; F205-I209 HydrophobicContact CE2-CD1 4.38Å; F205-I209 HydrophobicContact CG-CD1 4.44Å; F205-I209 HydrophobicContact CZ-CD1 3.57Å; F205-I209 HydrophobicContact CZ-CG1 4.4Å; F205-I209 WeakPolarHBondContact O-CG1 3.47Å; F205-I209 PolarHBondContact O-N 3.01Å; E206-I209 PolarHBondContact O-N 2.98Å; I209-E211 PolarHBondContact O-N 3.06Å; I209-E211 VanDerWaalsContact O-N 3.14Å; I209-L212 PolarHBondContact O-N 3.34Å; I209-M227 HydrophobicContact CG1-CE 3.57Å
210A94.8Very high92.2Very high84 Ų8477 Ų7769%0.69440%0.404SS*.Hα-helixtrans-61.7-23.2-176.600000113.5E206 E207 A208E206-A210 PolarHBondContact O-N 3.19Å; E206-A210 VanDerWaalsContact O-N 3.12Å; E207-A210 PolarHBondContact O-N 3.42Å; A208-A210 VanDerWaalsContact C-N 3.3Å; A208-A210 PolarHBondContact O-N 2.94Å
211E93.6Very high91.9Very high75 Ų7583.8 Ų83.835%0.3543%0.433SS..Hα-helixtrans-116.35.7-178.2-66-175.4-154.700113.4P171 T172 A208 I209 D213 T214P171-E211 WeakPolarHBondContact CD-OE2 3.32Å; T172-E211 HydrophobicContact CG2-CB 3.79Å; A208-E211 PolarHBondContact O-N 2.81Å; I209-E211 PolarHBondContact O-N 3.06Å; I209-E211 VanDerWaalsContact O-N 3.14Å; E211-D213 VanDerWaalsContact C-N 3.27Å; E211-D213 PolarHBondContact O-N 3.44Å; E211-T214 WeakPolarHBondContact O-CB 2.92Å; E211-T214 PolarHBondContact O-N 3.47Å; E211-T214 PolarHBondContact O-OG1 3.4Å
212L90.3Very high91.7Very high35 Ų3587.9 Ų87.918%0.18346%0.455CS..G310 helixtrans-60.9-34.5-172.3-17461.6000113.1A208 I209 T214 L215 Y220 T224 M227A208-L212 PolarHBondContact O-N 2.98Å; I209-L212 PolarHBondContact O-N 3.34Å; L212-T214 PolarHBondContact O-N 2.89Å; L212-T214 VanDerWaalsContact O-N 3.16Å; L212-L215 WeakPolarHBondContact O-CB 3.46Å; L212-L215 PolarHBondContact O-N 2.89Å; L212-Y220 HydrophobicContact CD1-CD2 4.46Å; L212-Y220 HydrophobicContact CD1-CE2 4.1Å; L212-Y220 HydrophobicContact CG-CE2 4.27Å; L212-T224 HydrophobicContact CD1-CG2 4.11Å; L212-M227 HydrophobicContact CD1-SD 4.1Å; L212-M227 HydrophobicContact CD2-CE 4.35Å
213D89.3Confident91.5Very high168 Ų16882.6 Ų82.690%0.89843%0.432SS*.G310 helixtrans-66.9-13.4179.6-67.3-24.9000113.3E211E211-D213 VanDerWaalsContact C-N 3.27Å; E211-D213 PolarHBondContact O-N 3.44Å
214T85.5Confident91.4Very high108 Ų10879.8 Ų79.866%0.66342%0.422SS*.G310 helixtrans-89-6.1179.5710000113.3E211 L212E211-T214 WeakPolarHBondContact O-CB 2.92Å; E211-T214 PolarHBondContact O-N 3.47Å; E211-T214 PolarHBondContact O-OG1 3.4Å; L212-T214 PolarHBondContact O-N 2.89Å; L212-T214 VanDerWaalsContact O-N 3.16Å
215L85.3Confident91.3Very high34 Ų3484.1 Ų84.118%0.17844%0.443CS..  trans-78.7137.9-169.2-13989.1000113.3T172 L212 Y220T172-L215 HydrophobicContact CG2-CD1 3.95Å; T172-L215 WeakPolarHBondContact OG1-CD1 3.5Å; L212-L215 WeakPolarHBondContact O-CB 3.46Å; L212-L215 PolarHBondContact O-N 2.89Å; L215-Y220 HydrophobicContact CB-CD2 4.27Å; L215-Y220 HydrophobicContact CD2-CD2 4.27Å; L215-Y220 VanDerWaalsContact CD2-N 3.32Å
216G84.4Confident91.3Very high48 Ų4883.4 Ų83.450%0.49544%0.441SS..  trans-72.4156.8167.900000112.7E218 S219 Y220G216-E218 PolarHBondContact O-N 2.59Å; G216-S219 PolarHBondContact O-N 3.03Å; G216-Y220 PolarHBondContact O-N 3.24Å; G216-Y220 VanDerWaalsContact O-N 3.16Å
217E84Confident91.3Very high188 Ų18878.8 Ų78.888%0.87942%0.42SS*.Hα-helixtrans-57.5-35.1-177.9-168.6175-17500113S219 Y220E217-S219 PolarHBondContact O-N 3.38Å; E217-Y220 PolarHBondContact O-N 3.48Å
218E81.2Confident91.3Very high184 Ų18479 Ų7986%0.8642%0.42SS*.Hα-helixtrans-60.8-45.2-179.1-171177.4-175.400112.6G216G216-E218 PolarHBondContact O-N 2.59Å
219S87.2Confident91.4Very high44 Ų4482.6 Ų82.631%0.30844%0.439SS..Hα-helixtrans-86.8-15.9179.9-60.30000113G216 E217 K221 D222 S223G216-S219 PolarHBondContact O-N 3.03Å; E217-S219 PolarHBondContact O-N 3.38Å; S219-K221 PolarHBondContact O-N 3.33Å; S219-D222 PolarHBondContact O-N 3.33Å; S219-S223 WeakPolarHBondContact O-CB 3.3Å; S219-S223 PolarHBondContact O-N 3.25Å; S219-S223 PolarHBondContact O-OG 3.03Å; S219-S223 VanDerWaalsContact O-OG 3.12Å
220Y89.2Confident91.5Very high113 Ų11378.4 Ų78.444%0.44342%0.418SS..Hα-helixtrans-61.3-46.1-169.3-170.2-89.8000112.4L212 L215 G216 E217 D222 T224L212-Y220 HydrophobicContact CD1-CD2 4.46Å; L212-Y220 HydrophobicContact CD1-CE2 4.1Å; L212-Y220 HydrophobicContact CG-CE2 4.27Å; L215-Y220 HydrophobicContact CB-CD2 4.27Å; L215-Y220 HydrophobicContact CD2-CD2 4.27Å; L215-Y220 VanDerWaalsContact CD2-N 3.32Å; G216-Y220 PolarHBondContact O-N 3.24Å; G216-Y220 VanDerWaalsContact O-N 3.16Å; E217-Y220 PolarHBondContact O-N 3.48Å; Y220-D222 PolarHBondContact O-N 2.63Å; Y220-T224 HydrophobicContact CD1-CG2 4.08Å; Y220-T224 HydrophobicContact CD2-CG2 4.47Å; Y220-T224 HydrophobicContact CE1-CG2 3.79Å; Y220-T224 HydrophobicContact CE2-CG2 4.21Å; Y220-T224 HydrophobicContact CG-CG2 4.41Å; Y220-T224 WeakPolarHBondContact O-CB 3.23Å; Y220-T224 VanDerWaalsContact O-CG2 3.24Å; Y220-T224 WeakPolarHBondContact O-CG2 3.33Å; Y220-T224 PolarHBondContact O-N 3.31Å; Y220-T224 PolarHBondContact O-OG1 3.12Å
221K91.9Very high91.6Very high157 Ų15780 Ų8068%0.68341%0.406SS*.Hα-helixtrans-62.7-45.5179.6-174.3-177.9175.2-172.80111.9S219 T224 L225S219-K221 PolarHBondContact O-N 3.33Å; K221-T224 PolarHBondContact O-OG1 3.16Å; K221-L225 WeakPolarHBondContact O-CB 3.43Å; K221-L225 PolarHBondContact O-N 3.23Å; K221-L225 VanDerWaalsContact O-N 3.1Å
222D92.4Very high91.8Very high86 Ų8679.6 Ų79.646%0.4641%0.406SS..Hα-helixtrans-72-44.7-176-72.4-7.7000111.3P174 S219 Y220 L225 I226P174-D222 HydrophobicContact CB-CB 4.16Å; P174-D222 HydrophobicContact CG-CB 4.04Å; S219-D222 PolarHBondContact O-N 3.33Å; Y220-D222 PolarHBondContact O-N 2.63Å; D222-L225 PolarHBondContact O-N 3.37Å; D222-I226 VanDerWaalsContact O-CG1 3.28Å; D222-I226 WeakPolarHBondContact O-CG1 3.28Å; D222-I226 PolarHBondContact O-N 3.05Å; D222-I226 VanDerWaalsContact O-N 3.09Å
223S94.4Very high92.1Very high0 Ų079.7 Ų79.70%041%0.407CS..Hα-helixtrans-62.9-46.4177.8-630000111.9T172 P174 S219 L225 I226 M227T172-S223 WeakPolarHBondContact O-CB 3.4Å; T172-S223 PolarHBondContact O-OG 2.92Å; P174-S223 WeakPolarHBondContact CD-OG 3.36Å; P174-S223 WeakPolarHBondContact CG-OG 3.49Å; S219-S223 WeakPolarHBondContact O-CB 3.3Å; S219-S223 PolarHBondContact O-N 3.25Å; S219-S223 PolarHBondContact O-OG 3.03Å; S219-S223 VanDerWaalsContact O-OG 3.12Å; S223-L225 VanDerWaalsContact C-N 3.35Å; S223-L225 PolarHBondContact O-N 3.49Å; S223-I226 PolarHBondContact O-N 3.14Å; S223-M227 VanDerWaalsContact O-CG 3.24Å; S223-M227 WeakPolarHBondContact O-CG 3.45Å; S223-M227 PolarHBondContact O-N 2.91Å
224T95Very high92.4Very high43 Ų4372.9 Ų72.926%0.26437%0.371SS..Hα-helixtrans-66.6-35.3179.854.30000112.5L212 Y220 K221 M227 Q228L212-T224 HydrophobicContact CD1-CG2 4.11Å; Y220-T224 HydrophobicContact CD1-CG2 4.08Å; Y220-T224 HydrophobicContact CD2-CG2 4.47Å; Y220-T224 HydrophobicContact CE1-CG2 3.79Å; Y220-T224 HydrophobicContact CE2-CG2 4.21Å; Y220-T224 HydrophobicContact CG-CG2 4.41Å; Y220-T224 WeakPolarHBondContact O-CB 3.23Å; Y220-T224 VanDerWaalsContact O-CG2 3.24Å; Y220-T224 WeakPolarHBondContact O-CG2 3.33Å; Y220-T224 PolarHBondContact O-N 3.31Å; Y220-T224 PolarHBondContact O-OG1 3.12Å; K221-T224 PolarHBondContact O-OG1 3.16Å; T224-M227 PolarHBondContact O-N 3.5Å; T224-Q228 WeakPolarHBondContact O-CB 3.37Å; T224-Q228 PolarHBondContact O-N 3.25Å
225L95.8Very high92.9Very high102 Ų10272.1 Ų72.153%0.53437%0.366SS..Hα-helixtrans-61.4-43.5172.1178.162.1000111.6K221 D222 S223 Q228 L229K221-L225 WeakPolarHBondContact O-CB 3.43Å; K221-L225 PolarHBondContact O-N 3.23Å; K221-L225 VanDerWaalsContact O-N 3.1Å; D222-L225 PolarHBondContact O-N 3.37Å; S223-L225 VanDerWaalsContact C-N 3.35Å; S223-L225 PolarHBondContact O-N 3.49Å; L225-Q228 WeakPolarHBondContact O-CB 3.45Å; L225-Q228 PolarHBondContact O-N 2.91Å; L225-L229 WeakPolarHBondContact O-CG 3.31Å; L225-L229 PolarHBondContact O-N 3.49Å; L225-L229 VanDerWaalsContact O-N 3.14Å
226I97Very high93.4Very high28 Ų2874.7 Ų74.714%0.14438%0.379CS..Hα-helixtrans-69.8-39.7179-61.1163.9000111.1P174 L177 L181 D222 S223 Q228 L229 L230P174-I226 HydrophobicContact CB-CD1 4.09Å; P174-I226 VanDerWaalsContact O-CD1 3.27Å; P174-I226 WeakPolarHBondContact O-CD1 3.29Å; L177-I226 HydrophobicContact CB-CB 4.17Å; L177-I226 HydrophobicContact CB-CD1 4.34Å; L177-I226 HydrophobicContact CB-CG2 3.65Å; L181-I226 HydrophobicContact CB-CG2 4.24Å; L181-I226 HydrophobicContact CD2-CG2 4.14Å; D222-I226 VanDerWaalsContact O-CG1 3.28Å; D222-I226 WeakPolarHBondContact O-CG1 3.28Å; D222-I226 PolarHBondContact O-N 3.05Å; D222-I226 VanDerWaalsContact O-N 3.09Å; S223-I226 PolarHBondContact O-N 3.14Å; I226-Q228 VanDerWaalsContact C-N 3.28Å; I226-Q228 PolarHBondContact O-N 3.44Å; I226-L229 WeakPolarHBondContact O-CB 3.27Å; I226-L229 PolarHBondContact O-N 3.31Å; I226-L230 PolarHBondContact O-N 3.05Å
227M97.5Very high93.9Very high9 Ų972.7 Ų72.74%0.04436%0.357CS..Hα-helixtrans-60.6-38.9174.2-70169.471.300111.7L177 F205 A208 I209 L212 S223 T224 L230 R231L177-M227 HydrophobicContact CD1-CG 4.03Å; L177-M227 HydrophobicContact CD1-SD 4.5Å; L177-M227 HydrophobicContact CD2-CG 4.24Å; F205-M227 HydrophobicContact CD2-CB 4.06Å; F205-M227 WeakPolarHBondContact CD2-O 3.35Å; F205-M227 HydrophobicContact CE2-CB 4.01Å; F205-M227 HydrophobicContact CE2-CE 4.47Å; F205-M227 VanDerWaalsContact CE2-O 3.32Å; F205-M227 WeakPolarHBondContact CE2-O 3.13Å; A208-M227 HydrophobicContact CB-CE 3.96Å; A208-M227 HydrophobicContact CB-CG 4.26Å; A208-M227 HydrophobicContact CB-SD 3.94Å; I209-M227 HydrophobicContact CG1-CE 3.57Å; L212-M227 HydrophobicContact CD1-SD 4.1Å; L212-M227 HydrophobicContact CD2-CE 4.35Å; S223-M227 VanDerWaalsContact O-CG 3.24Å; S223-M227 WeakPolarHBondContact O-CG 3.45Å; S223-M227 PolarHBondContact O-N 2.91Å; T224-M227 PolarHBondContact O-N 3.5Å; M227-L230 WeakPolarHBondContact O-CB 3.37Å; M227-L230 PolarHBondContact O-N 3.11Å; M227-R231 PolarHBondContact O-N 2.95Å
228Q97.3Very high94.3Very high65 Ų6566.7 Ų66.730%0.30433%0.333SS..Hα-helixtrans-60.2-46.2173.8175.655.442.700111.3T224 L225 I226 L230 R231 D232T224-Q228 WeakPolarHBondContact O-CB 3.37Å; T224-Q228 PolarHBondContact O-N 3.25Å; L225-Q228 WeakPolarHBondContact O-CB 3.45Å; L225-Q228 PolarHBondContact O-N 2.91Å; I226-Q228 VanDerWaalsContact C-N 3.28Å; I226-Q228 PolarHBondContact O-N 3.44Å; Q228-L230 PolarHBondContact O-N 2.92Å; Q228-R231 WeakPolarHBondContact O-CB 3.44Å; Q228-R231 PolarHBondContact O-N 3.22Å; Q228-D232 PolarHBondContact NE2-OD1 2.88Å; Q228-D232 PolarHBondContact NE2-OD2 3.42Å; Q228-D232 PolarHBondContact O-N 2.93Å
229L97.8Very high94.8Very high76 Ų7660 Ų6040%0.39831%0.307SS..Hα-helixtrans-63.1-39.5175.9-65.7172.7000112.8L181 L225 I226 R231 D232 N233L181-L229 HydrophobicContact CD1-CB 4.14Å; L181-L229 HydrophobicContact CD2-CB 3.91Å; L181-L229 HydrophobicContact CD2-CD1 3.91Å; L225-L229 WeakPolarHBondContact O-CG 3.31Å; L225-L229 PolarHBondContact O-N 3.49Å; L225-L229 VanDerWaalsContact O-N 3.14Å; I226-L229 WeakPolarHBondContact O-CB 3.27Å; I226-L229 PolarHBondContact O-N 3.31Å; L229-R231 VanDerWaalsContact C-N 3.34Å; L229-R231 PolarHBondContact O-N 3Å; L229-D232 PolarHBondContact O-N 2.88Å; L229-N233 WeakPolarHBondContact O-CB 3.05Å; L229-N233 PolarHBondContact O-N 3.04Å
230L97.6Very high94.9Very high0 Ų059.5 Ų59.50%030%0.3CS..Hα-helixtrans-59.7-45.1174-78.6167.7000111.4L177 L181 A201 A204 F205 I226 M227 Q228 N233 L234L177-L230 HydrophobicContact CD2-CD1 4.08Å; L181-L230 HydrophobicContact CB-CD2 3.96Å; L181-L230 HydrophobicContact CB-CG 4.25Å; L181-L230 HydrophobicContact CD1-CD2 3.91Å; L181-L230 HydrophobicContact CD1-CG 4.12Å; A201-L230 HydrophobicContact CB-CD2 3.83Å; A204-L230 HydrophobicContact CB-CD1 4.25Å; F205-L230 HydrophobicContact CD2-CB 4.4Å; I226-L230 PolarHBondContact O-N 3.05Å; M227-L230 WeakPolarHBondContact O-CB 3.37Å; M227-L230 PolarHBondContact O-N 3.11Å; Q228-L230 PolarHBondContact O-N 2.92Å; L230-N233 PolarHBondContact O-N 3.22Å; L230-L234 WeakPolarHBondContact O-CG 3.47Å; L230-L234 PolarHBondContact O-N 3.44Å
231R97.3Very high94.8Very high116 Ų11656.1 Ų56.144%0.43829%0.289SS..Hα-helixtrans-63.1-41.9177.6-169.5-168.674-1633.4112F205 M227 Q228 L229 L234 T235F205-R231 HydrophobicContact CD2-CB 4.45Å; F205-R231 HydrophobicContact CE2-CB 3.91Å; F205-R231 HydrophobicContact CZ-CB 4.22Å; F205-R231 HydrophobicContact CZ-CG 4.32Å; M227-R231 PolarHBondContact O-N 2.95Å; Q228-R231 WeakPolarHBondContact O-CB 3.44Å; Q228-R231 PolarHBondContact O-N 3.22Å; L229-R231 VanDerWaalsContact C-N 3.34Å; L229-R231 PolarHBondContact O-N 3Å; R231-L234 PolarHBondContact O-N 3.46Å; R231-T235 PolarHBondContact O-N 2.95Å; R231-T235 PolarHBondContact O-OG1 3.06Å
232D97.9Very high94.5Very high67 Ų6754.8 Ų54.836%0.35829%0.286SS..Hα-helixtrans-66.4-42-179.1-64.4-16.1000110.7Q228 L229 T235 L236Q228-D232 PolarHBondContact NE2-OD1 2.88Å; Q228-D232 PolarHBondContact NE2-OD2 3.42Å; Q228-D232 PolarHBondContact O-N 2.93Å; L229-D232 PolarHBondContact O-N 2.88Å; D232-T235 WeakPolarHBondContact O-CB 2.81Å; D232-T235 PolarHBondContact O-N 3.32Å; D232-L236 PolarHBondContact O-N 2.9Å
233N96.8Very high94.2Very high37 Ų3756.3 Ų56.320%0.19829%0.291CS..Hα-helixtrans-60.8-46.5172.1-78.9-1.4000112.4L181 L229 L230 T235 L236 W237L181-N233 VanDerWaalsContact CD1-ND2 3.3Å; L181-N233 WeakPolarHBondContact CD1-ND2 3.44Å; L229-N233 WeakPolarHBondContact O-CB 3.05Å; L229-N233 PolarHBondContact O-N 3.04Å; L230-N233 PolarHBondContact O-N 3.22Å; N233-T235 VanDerWaalsContact C-N 3.26Å; N233-T235 PolarHBondContact O-N 2.65Å; N233-L236 PolarHBondContact O-N 3.45Å; N233-W237 HydrophobicContact CB-CD2 4.12Å; N233-W237 HydrophobicContact CB-CE3 4.11Å; N233-W237 HydrophobicContact CB-CH2 3.66Å; N233-W237 HydrophobicContact CB-CZ2 3.65Å; N233-W237 HydrophobicContact CB-CZ3 3.88Å; N233-W237 WeakPolarHBondContact O-CB 3.41Å; N233-W237 VanDerWaalsContact O-CD2 3.26Å; N233-W237 PolarHBondContact O-N 3.22Å
234L95.9Very high93.4Very high26 Ų2663 Ų6314%0.13633%0.327CS..Hα-helixtrans-57-41.6176.1-78.3168.9000112.3C198 A201 K202 L230 R231 T238C198-L234 HydrophobicContact CB-CD2 4.22Å; C198-L234 VanDerWaalsContact O-CD2 3.31Å; C198-L234 WeakPolarHBondContact O-CD2 3.27Å; A201-L234 HydrophobicContact CB-CD1 4.32Å; A201-L234 HydrophobicContact CB-CD2 3.77Å; A201-L234 HydrophobicContact CB-CG 3.83Å; K202-L234 HydrophobicContact CB-CD1 4.26Å; K202-L234 HydrophobicContact CB-CD2 4.04Å; L230-L234 WeakPolarHBondContact O-CG 3.47Å; L230-L234 PolarHBondContact O-N 3.44Å; R231-L234 PolarHBondContact O-N 3.46Å; L234-T238 WeakPolarHBondContact O-CB 3.26Å; L234-T238 PolarHBondContact O-N 3.41Å; L234-T238 PolarHBondContact O-OG1 3.12Å
235T95.3Very high92.4Very high91 Ų9168.6 Ų68.656%0.55835%0.35SS*.Hα-helixtrans-62.7-49.7178.4-54.80000110.7R231 D232 N233 S239R231-T235 PolarHBondContact O-N 2.95Å; R231-T235 PolarHBondContact O-OG1 3.06Å; D232-T235 WeakPolarHBondContact O-CB 2.81Å; D232-T235 PolarHBondContact O-N 3.32Å; N233-T235 VanDerWaalsContact C-N 3.26Å; N233-T235 PolarHBondContact O-N 2.65Å; T235-S239 PolarHBondContact O-N 3.36Å; T235-S239 VanDerWaalsContact O-N 3.16Å; T235-S239 PolarHBondContact O-OG 3.35Å
236L94.7Very high90.8Very high89 Ų8970.5 Ų70.547%0.46638%0.381SS..Hα-helixtrans-59.7-56.2178.917963.9000111.2D232 N233 T238 S239 D240D232-L236 PolarHBondContact O-N 2.9Å; N233-L236 PolarHBondContact O-N 3.45Å; L236-T238 VanDerWaalsContact C-N 3.33Å; L236-T238 PolarHBondContact O-N 3.44Å; L236-S239 PolarHBondContact O-N 3.47Å; L236-S239 PolarHBondContact O-OG 2.56Å; L236-D240 PolarHBondContact O-N 2.97Å
237W96.3Very high90.5Very high6 Ų672.7 Ų72.72%0.02339%0.393CS..Hα-helixtrans-67.2-33.9-172.7-56.4-23000113V185 Y188 A197 C198 A201 N233 S239 D240 M241V185-W237 HydrophobicContact CG2-CH2 4.04Å; V185-W237 HydrophobicContact CG2-CZ2 3.96Å; Y188-W237 AromaticContact CD1-CD1 3.86Å; Y188-W237 AromaticContact CD1-CE2 3.94Å; Y188-W237 HydrophobicContact CD1-CZ2 4.45Å; Y188-W237 AromaticContact CD1-NE1 3.41Å; Y188-W237 HydrophobicContact CD2-CB 3.95Å; Y188-W237 AromaticContact CD2-CD1 3.4Å; Y188-W237 VanDerWaalsContact CD2-CD1 3.4Å; Y188-W237 AromaticContact CD2-CD2 3.77Å; Y188-W237 HydrophobicContact CD2-CD2 3.77Å; Y188-W237 AromaticContact CD2-CE2 3.9Å; Y188-W237 AromaticContact CD2-CG 3.43Å; Y188-W237 HydrophobicContact CD2-CG 3.43Å; Y188-W237 VanDerWaalsContact CD2-CG 3.43Å; Y188-W237 AromaticContact CD2-NE1 3.67Å; Y188-W237 AromaticContact CE1-CD1 3.65Å; Y188-W237 AromaticContact CE1-NE1 3.53Å; Y188-W237 HydrophobicContact CE2-CB 3.75Å; Y188-W237 AromaticContact CE2-CD1 3.13Å; Y188-W237 HydrophobicContact CE2-CD2 4.26Å; Y188-W237 AromaticContact CE2-CG 3.44Å; Y188-W237 HydrophobicContact CE2-CG 3.44Å; Y188-W237 VanDerWaalsContact CE2-CG 3.44Å; Y188-W237 AromaticContact CE2-NE1 3.76Å; Y188-W237 AromaticContact CG-CD1 3.76Å; Y188-W237 AromaticContact CG-CD2 3.98Å; Y188-W237 HydrophobicContact CG-CD2 3.98Å; Y188-W237 AromaticContact CG-CE2 3.64Å; Y188-W237 HydrophobicContact CG-CG 4.03Å; Y188-W237 HydrophobicContact CG-CZ2 4.17Å; Y188-W237 AromaticContact CG-NE1 3.49Å; Y188-W237 AromaticContact CZ-CD1 3.27Å; Y188-W237 AromaticContact CZ-NE1 3.7Å; A197-W237 HydrophobicContact CB-CE3 4.01Å; A197-W237 HydrophobicContact CB-CZ3 3.9Å; C198-W237 VanDerWaalsContact SG-CB 3.58Å; A201-W237 HydrophobicContact CB-CZ3 4.11Å; N233-W237 HydrophobicContact CB-CD2 4.12Å; N233-W237 HydrophobicContact CB-CE3 4.11Å; N233-W237 HydrophobicContact CB-CH2 3.66Å; N233-W237 HydrophobicContact CB-CZ2 3.65Å; N233-W237 HydrophobicContact CB-CZ3 3.88Å; N233-W237 WeakPolarHBondContact O-CB 3.41Å; N233-W237 VanDerWaalsContact O-CD2 3.26Å; N233-W237 PolarHBondContact O-N 3.22Å; W237-S239 VanDerWaalsContact C-N 3.33Å; W237-D240 PolarHBondContact O-N 3.16Å; W237-M241 VanDerWaalsContact O-CG 3.3Å; W237-M241 WeakPolarHBondContact O-CG 3.16Å; W237-M241 PolarHBondContact O-N 3.36Å; W237-M241 VanDerWaalsContact O-N 3.11Å
238T92.4Very high90.1Very high61 Ų6176 Ų7637%0.37441%0.411SS..Hα-helixtrans-68-36.2174.3-54.60000111.1L234 L236 Q242L234-T238 WeakPolarHBondContact O-CB 3.26Å; L234-T238 PolarHBondContact O-N 3.41Å; L234-T238 PolarHBondContact O-OG1 3.12Å; L236-T238 VanDerWaalsContact C-N 3.33Å; L236-T238 PolarHBondContact O-N 3.44Å; T238-Q242 WeakPolarHBondContact O-CG 3.46Å; T238-Q242 PolarHBondContact O-N 3.26Å
239S91.7Very high89.7Confident44 Ų4476.6 Ų76.631%0.30842%0.417SS..Hα-helixtrans-68.2-38.9175.670.50000112.4T235 L236 W237 Q242 M243T235-S239 PolarHBondContact O-N 3.36Å; T235-S239 VanDerWaalsContact O-N 3.16Å; T235-S239 PolarHBondContact O-OG 3.35Å; L236-S239 PolarHBondContact O-N 3.47Å; L236-S239 PolarHBondContact O-OG 2.56Å; W237-S239 VanDerWaalsContact C-N 3.33Å; S239-Q242 PolarHBondContact O-N 2.77Å; S239-M243 WeakPolarHBondContact O-CG 3.38Å; S239-M243 PolarHBondContact O-N 2.85Å; S239-M243 VanDerWaalsContact O-N 3.1Å
240D89.5Confident89.2Confident33 Ų3376.6 Ų76.618%0.17642%0.418CS..Hα-helixtrans-62.6-45.7176.5-61.4-29.8000111.3Y188 L236 W237 Q242 M243 D244Y188-D240 PolarHBondContact OH-OD2 3.1Å; L236-D240 PolarHBondContact O-N 2.97Å; W237-D240 PolarHBondContact O-N 3.16Å; D240-Q242 VanDerWaalsContact C-N 3.29Å; D240-Q242 PolarHBondContact O-N 3.35Å; D240-M243 PolarHBondContact O-N 3.48Å; D240-M243 VanDerWaalsContact O-N 3.1Å; D240-M243 WeakPolarHBondContact OD1-CE 3.48Å; D240-D244 PolarHBondContact O-N 2.77Å
241M86.9Confident88.7Confident43 Ų4381.4 Ų81.421%0.21244%0.444CS..Hα-helixtrans-59.3-38.9176.9-71174.963.800112.6E195 W237 M243 D244 E245E195-M241 HydrophobicContact CG-CE 3.7Å; W237-M241 VanDerWaalsContact O-CG 3.3Å; W237-M241 WeakPolarHBondContact O-CG 3.16Å; W237-M241 PolarHBondContact O-N 3.36Å; W237-M241 VanDerWaalsContact O-N 3.11Å; M241-M243 VanDerWaalsContact C-N 3.34Å; M241-D244 PolarHBondContact O-N 3.14Å; M241-E245 WeakPolarHBondContact O-CG 3.48Å; M241-E245 PolarHBondContact O-N 3Å
242Q85.8Confident88.1Confident129 Ų12979.1 Ų79.160%0.60345%0.445SS*.Hα-helixtrans-69.7-31.2177.2-71.7173.31000112.8T238 S239 D240T238-Q242 WeakPolarHBondContact O-CG 3.46Å; T238-Q242 PolarHBondContact O-N 3.26Å; S239-Q242 PolarHBondContact O-N 2.77Å; D240-Q242 VanDerWaalsContact C-N 3.29Å; D240-Q242 PolarHBondContact O-N 3.35Å
243M84.4Confident87.5Confident118 Ų11880 Ų8058%0.58145%0.451SS*.Hα-helixtrans-74.3-34.7175.3-70.1-175.3-66.100112S239 D240 M241 E245S239-M243 WeakPolarHBondContact O-CG 3.38Å; S239-M243 PolarHBondContact O-N 2.85Å; S239-M243 VanDerWaalsContact O-N 3.1Å; D240-M243 PolarHBondContact O-N 3.48Å; D240-M243 VanDerWaalsContact O-N 3.1Å; D240-M243 WeakPolarHBondContact OD1-CE 3.48Å; M241-M243 VanDerWaalsContact C-N 3.34Å; M243-E245 VanDerWaalsContact C-N 3.32Å
244D78.4Confident86.7Confident140 Ų14083.3 Ų83.375%0.74947%0.47SS*.Hα-helixtrans-73-23.5177.8-72.1-19.2000113D240 M241D240-D244 PolarHBondContact O-N 2.77Å; M241-D244 PolarHBondContact O-N 3.14Å
245E73.5Confident86Confident161 Ų16188.1 Ų88.175%0.75250%0.498SS*.  trans-85.4-15.2176.6-74.3179.1-178.400114.4M241 M243M241-E245 WeakPolarHBondContact O-CG 3.48Å; M241-E245 PolarHBondContact O-N 3Å; M243-E245 VanDerWaalsContact C-N 3.32Å
246A62.7Low85.1Confident142 Ų14287.8 Ų87.8100%1.17449%0.493SS*.  trans-910-174.100000113.6

Retrieved 246 of 246 residues in 336.7 ms (Link to these results)

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