A0A087XX21_POEFO Loading...

Transmembrane protein 38B

Intracellular monovalent cation channel required for maintenance of rapid intracellular calcium release. Acts as a potassium counter-ion channel that functions in synchronization with calcium release from intracellular stores. Activated by increased cytosolic Ca(2+) levels.

AlphaFold DB , UniProt , Accession A0A087XX21, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 321 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
1M52Low72Confident185 Ų185102.6 Ų102.691%0.91152%0.516SS*.  0111.20-126.5159.5179.700106.1E5 L9M1-E5 VanDerWaalsContact CA-OE2 3.31Å; M1-E5 WeakPolarHBondContact CA-OE2 3.42Å; M1-L9 HydrophobicContact CE-CD1 4.39Å
2S54Low73.4Confident65 Ų65103 Ų10346%0.45552%0.52SS..  trans-72.1149.2-168.9630000110.8F4 E5 M6S2-F4 PolarHBondContact O-N 3.01Å; S2-F4 VanDerWaalsContact O-N 3.12Å; S2-E5 PolarHBondContact N-OE2 2.77Å; S2-E5 WeakPolarHBondContact O-CB 3.37Å; S2-E5 PolarHBondContact O-N 3.24Å; S2-E5 WeakPolarHBondContact OG-CG 3.39Å; S2-E5 PolarHBondContact OG-OE2 2.88Å; S2-M6 PolarHBondContact O-N 3.48Å
3F63.4Low74.8Confident167 Ų16795.2 Ų95.273%0.73248%0.481SS*.Hα-helixtrans-49.9-39.6-178.6-177-97.7000112.5E5 M6 S7F3-E5 PolarHBondContact O-N 3.24Å; F3-M6 PolarHBondContact O-N 3.33Å; F3-S7 PolarHBondContact O-N 3.12Å; F3-S7 PolarHBondContact O-OG 2.9Å
4F63.1Low75.9Confident170 Ų17092 Ų9275%0.74647%0.466SS*.Hα-helixtrans-62.5-37.2174.8-79.9-84.1000114.2S2 M6 S8S2-F4 PolarHBondContact O-N 3.01Å; S2-F4 VanDerWaalsContact O-N 3.12Å; F4-M6 VanDerWaalsContact C-N 3.34Å; F4-S8 WeakPolarHBondContact O-CB 3.44Å; F4-S8 PolarHBondContact O-N 3.02Å; F4-S8 PolarHBondContact O-OG 2.97Å
5E68.9Low76.8Confident92 Ų9288.8 Ų88.843%0.4347%0.465SS..Hα-helixtrans-66.2-39.8175.2-73.2169.8151.100110.8M1 S2 F3 S8 L9M1-E5 VanDerWaalsContact CA-OE2 3.31Å; M1-E5 WeakPolarHBondContact CA-OE2 3.42Å; S2-E5 PolarHBondContact N-OE2 2.77Å; S2-E5 WeakPolarHBondContact O-CB 3.37Å; S2-E5 PolarHBondContact O-N 3.24Å; S2-E5 WeakPolarHBondContact OG-CG 3.39Å; S2-E5 PolarHBondContact OG-OE2 2.88Å; F3-E5 PolarHBondContact O-N 3.24Å; E5-S8 WeakPolarHBondContact CA-OG 3.27Å; E5-S8 PolarHBondContact O-N 3.32Å; E5-S8 PolarHBondContact O-OG 3.13Å; E5-L9 WeakPolarHBondContact O-CB 3.31Å; E5-L9 VanDerWaalsContact O-CG 3.27Å; E5-L9 WeakPolarHBondContact O-CG 3.46Å; E5-L9 PolarHBondContact O-N 2.85Å
6M67.3Low77.7Confident108 Ų10884.8 Ų84.853%0.53244%0.444SS..Hα-helixtrans-65.8-46.7177.8-164.5166.2-76.600111S2 F3 F4 S8 L9 D10S2-M6 PolarHBondContact O-N 3.48Å; F3-M6 PolarHBondContact O-N 3.33Å; F4-M6 VanDerWaalsContact C-N 3.34Å; M6-S8 VanDerWaalsContact C-N 3.31Å; M6-S8 PolarHBondContact O-N 2.97Å; M6-L9 PolarHBondContact O-N 3.32Å; M6-L9 VanDerWaalsContact O-N 3.13Å; M6-D10 PolarHBondContact O-N 3.41Å
7S73.1Confident78.4Confident39 Ų3980.9 Ų80.927%0.27343%0.427SS..Hα-helixtrans-57.8-42.3175-42.80000112.5F3 D10 E11F3-S7 PolarHBondContact O-N 3.12Å; F3-S7 PolarHBondContact O-OG 2.9Å; S7-D10 PolarHBondContact O-N 3.44Å; S7-E11 WeakPolarHBondContact O-CG 3.21Å; S7-E11 PolarHBondContact O-N 3.1Å; S7-E11 VanDerWaalsContact O-N 3.1Å
8S84.3Confident79Confident51 Ų5183.5 Ų83.536%0.35744%0.441SS..Hα-helixtrans-68.4-34178.4710000113.1F4 E5 M6 L12F4-S8 WeakPolarHBondContact O-CB 3.44Å; F4-S8 PolarHBondContact O-N 3.02Å; F4-S8 PolarHBondContact O-OG 2.97Å; E5-S8 WeakPolarHBondContact CA-OG 3.27Å; E5-S8 PolarHBondContact O-N 3.32Å; E5-S8 PolarHBondContact O-OG 3.13Å; M6-S8 VanDerWaalsContact C-N 3.31Å; M6-S8 PolarHBondContact O-N 2.97Å; S8-L12 WeakPolarHBondContact O-CB 3.42Å; S8-L12 WeakPolarHBondContact O-CG 3.08Å; S8-L12 PolarHBondContact O-N 3.3Å
9L86.9Confident79.7Confident45 Ų4582.1 Ų82.124%0.23643%0.434CS..Hα-helixtrans-69.8-38.9176.2-78174.5000111.4M1 E5 M6 L12 S13 L214M1-L9 HydrophobicContact CE-CD1 4.39Å; E5-L9 WeakPolarHBondContact O-CB 3.31Å; E5-L9 VanDerWaalsContact O-CG 3.27Å; E5-L9 WeakPolarHBondContact O-CG 3.46Å; E5-L9 PolarHBondContact O-N 2.85Å; M6-L9 PolarHBondContact O-N 3.32Å; M6-L9 VanDerWaalsContact O-N 3.13Å; L9-L12 PolarHBondContact O-N 3.34Å; L9-S13 VanDerWaalsContact O-CB 3.3Å; L9-S13 WeakPolarHBondContact O-CB 3.44Å; L9-S13 PolarHBondContact O-N 3.13Å; L9-S13 PolarHBondContact O-OG 3.03Å; L9-L214 HydrophobicContact CD2-CD2 4.35Å
10D89Confident80.2Confident62 Ų6282.6 Ų82.633%0.33244%0.442SS..Hα-helixtrans-60.5-51.6175.2-60.3-12.3000109.9M6 S7 L12 S13 D14 H211M6-D10 PolarHBondContact O-N 3.41Å; S7-D10 PolarHBondContact O-N 3.44Å; D10-L12 PolarHBondContact O-N 3Å; D10-S13 PolarHBondContact O-N 3.45Å; D10-S13 PolarHBondContact O-OG 3.38Å; D10-D14 WeakPolarHBondContact O-CB 3.16Å; D10-D14 PolarHBondContact O-N 2.88Å; D10-H211 IonicContact OD1-CE1 3Å; D10-H211 PolarHBondContact OD1-CE1 2.83Å; D10-H211 IonicContact OD1-NE2 3.34Å; D10-H211 PolarHBondContact OD1-NE2 2.88Å
11E89.7Confident80.7Confident145 Ų14580 Ų8068%0.67843%0.427SS*.Hα-helixtrans-58.2-43.3177.1-73.7177.8-173.700113S7 D14 G15S7-E11 WeakPolarHBondContact O-CG 3.21Å; S7-E11 PolarHBondContact O-N 3.1Å; S7-E11 VanDerWaalsContact O-N 3.1Å; E11-D14 PolarHBondContact O-N 3.41Å; E11-G15 PolarHBondContact O-N 3.46Å
12L89.8Confident82.5Confident107 Ų10776 Ų7656%0.5641%0.405SS*.Hα-helixtrans-65.8-41.2177.2-74.9170.9000112S8 L9 D10 D14 G15 L16 L214S8-L12 WeakPolarHBondContact O-CB 3.42Å; S8-L12 WeakPolarHBondContact O-CG 3.08Å; S8-L12 PolarHBondContact O-N 3.3Å; L9-L12 PolarHBondContact O-N 3.34Å; D10-L12 PolarHBondContact O-N 3Å; L12-D14 VanDerWaalsContact C-N 3.32Å; L12-G15 PolarHBondContact O-N 2.93Å; L12-L16 WeakPolarHBondContact O-CB 3.3Å; L12-L16 PolarHBondContact O-N 3.4Å; L12-L214 HydrophobicContact CB-CD2 4.23Å
13S90.7Very high84.2Confident1 Ų174.9 Ų74.91%0.00740%0.396CS..Hα-helixtrans-67.3-36.9179.175.10000111.7L9 D10 L16 A17 H211L9-S13 VanDerWaalsContact O-CB 3.3Å; L9-S13 WeakPolarHBondContact O-CB 3.44Å; L9-S13 PolarHBondContact O-N 3.13Å; L9-S13 PolarHBondContact O-OG 3.03Å; D10-S13 PolarHBondContact O-N 3.45Å; D10-S13 PolarHBondContact O-OG 3.38Å; S13-L16 PolarHBondContact O-N 2.63Å; S13-A17 VanDerWaalsContact O-CB 3.23Å; S13-A17 WeakPolarHBondContact O-CB 3.49Å; S13-A17 PolarHBondContact O-N 3.14Å; S13-H211 PolarHBondContact OG-ND1 3.23Å
14D90.4Very high85.7Confident51 Ų5174.9 Ų74.927%0.27339%0.392SS..Hα-helixtrans-68.7-43.8174.7-77.86.3000111.9D10 E11 L12 L16 A17 N18 R210D10-D14 WeakPolarHBondContact O-CB 3.16Å; D10-D14 PolarHBondContact O-N 2.88Å; E11-D14 PolarHBondContact O-N 3.41Å; L12-D14 VanDerWaalsContact C-N 3.32Å; D14-L16 VanDerWaalsContact C-N 3.32Å; D14-L16 PolarHBondContact O-N 2.9Å; D14-A17 PolarHBondContact O-N 3.37Å; D14-N18 WeakPolarHBondContact O-CB 3.35Å; D14-N18 PolarHBondContact O-N 3.03Å; D14-N18 PolarHBondContact O-ND2 3.18Å; D14-R210 WeakPolarHBondContact OD1-CD 3.46Å; D14-R210 IonicContact OD1-CZ 3.16Å; D14-R210 VanDerWaalsContact OD1-CZ 3.32Å; D14-R210 IonicContact OD1-NE 3.2Å; D14-R210 PolarHBondContact OD1-NE 2.9Å; D14-R210 IonicContact OD1-NH1 3.52Å; D14-R210 PolarHBondContact OD1-NH1 3.17Å; D14-R210 IonicContact OD2-NH1 2.73Å; D14-R210 PolarHBondContact OD2-NH1 2.98Å
15G89.3Confident87.2Confident44 Ų4468.5 Ų68.545%0.45436%0.364SS..Hα-helixtrans-59.5-43.7175.400000111.8E11 L12 L19E11-G15 PolarHBondContact O-N 3.46Å; L12-G15 PolarHBondContact O-N 2.93Å; G15-L19 PolarHBondContact O-N 3.48Å
16L90.8Very high88.4Confident25 Ų2565.2 Ų65.213%0.13135%0.349CS..Hα-helixtrans-68.1-42.6177.1-178.366.1000112.2L12 S13 D14 N18 L19 V124 W128 M213 L214 T217L12-L16 WeakPolarHBondContact O-CB 3.3Å; L12-L16 PolarHBondContact O-N 3.4Å; S13-L16 PolarHBondContact O-N 2.63Å; D14-L16 VanDerWaalsContact C-N 3.32Å; D14-L16 PolarHBondContact O-N 2.9Å; L16-N18 PolarHBondContact O-N 2.81Å; L16-L19 HydrophobicContact CD1-CD2 4.29Å; L16-L19 VanDerWaalsContact O-CB 3.3Å; L16-L19 WeakPolarHBondContact O-CB 3.49Å; L16-L19 PolarHBondContact O-N 2.62Å; L16-V124 HydrophobicContact CD1-CG1 4.04Å; L16-W128 WeakPolarHBondContact O-CZ2 3.23Å; L16-M213 HydrophobicContact CD2-CG 4.29Å; L16-M213 HydrophobicContact CD2-SD 4.44Å; L16-M213 HydrophobicContact CG-SD 4.28Å; L16-L214 HydrophobicContact CB-CD1 4.35Å; L16-L214 HydrophobicContact CD2-CB 4.28Å; L16-L214 HydrophobicContact CD2-CD1 3.81Å; L16-T217 HydrophobicContact CD1-CG2 4.43Å; L16-T217 HydrophobicContact CD2-CG2 4.08Å
17A90Very high89.8Confident19 Ų1962.5 Ų62.516%0.15734%0.336CS..Hα-helixtrans-71.5-16.4-177.800000113.7S13 D14 W128 R210 M213S13-A17 VanDerWaalsContact O-CB 3.23Å; S13-A17 WeakPolarHBondContact O-CB 3.49Å; S13-A17 PolarHBondContact O-N 3.14Å; D14-A17 PolarHBondContact O-N 3.37Å; A17-W128 WeakPolarHBondContact O-CH2 3.24Å; A17-W128 VanDerWaalsContact O-CZ2 3.24Å; A17-W128 WeakPolarHBondContact O-CZ2 3.35Å; A17-R210 HydrophobicContact CB-CG 4.27Å; A17-M213 HydrophobicContact CB-CE 4.44Å; A17-M213 HydrophobicContact CB-SD 4.06Å
18N90.3Very high90.9Very high127 Ų12760.7 Ų60.768%0.67932%0.324SS*.THydrogen-bonded Turntrans-1087.6175.8-67-61000113.1D14 L16D14-N18 WeakPolarHBondContact O-CB 3.35Å; D14-N18 PolarHBondContact O-N 3.03Å; D14-N18 PolarHBondContact O-ND2 3.18Å; L16-N18 PolarHBondContact O-N 2.81Å
19L90.7Very high91.5Very high57 Ų5759.1 Ų59.130%0.29831%0.311SS..  trans-67.1125.7-175.2-164.369.6000111.2G15 L16 M21 F25 W128G15-L19 PolarHBondContact O-N 3.48Å; L16-L19 HydrophobicContact CD1-CD2 4.29Å; L16-L19 VanDerWaalsContact O-CB 3.3Å; L16-L19 WeakPolarHBondContact O-CB 3.49Å; L16-L19 PolarHBondContact O-N 2.62Å; L19-M21 HydrophobicContact CB-CE 3.82Å; L19-M21 HydrophobicContact CD2-CE 3.95Å; L19-M21 HydrophobicContact CG-CE 3.99Å; L19-M21 WeakPolarHBondContact O-CE 3.2Å; L19-M21 PolarHBondContact O-N 2.73Å; L19-F25 HydrophobicContact CD2-CD2 4.26Å; L19-F25 HydrophobicContact CD2-CE1 4.2Å; L19-F25 HydrophobicContact CD2-CE2 3.36Å; L19-F25 HydrophobicContact CD2-CZ 3.34Å; L19-F25 HydrophobicContact CG-CE2 3.89Å; L19-F25 HydrophobicContact CG-CZ 4.35Å; L19-W128 HydrophobicContact CB-CZ2 4.42Å
20P90.1Very high92Very high92 Ų9257 Ų5760%0.59730%0.299SS*.  trans-70.3119.6177.627.5-33.2000110.6
21M91Very high92.4Very high27 Ų2755 Ų5513%0.13329%0.289CS..  trans-73.8-34.4179.2-66.2-62.2103.400112.7L19 F25 E26 V124 W128L19-M21 HydrophobicContact CB-CE 3.82Å; L19-M21 HydrophobicContact CD2-CE 3.95Å; L19-M21 HydrophobicContact CG-CE 3.99Å; L19-M21 WeakPolarHBondContact O-CE 3.2Å; L19-M21 PolarHBondContact O-N 2.73Å; M21-F25 HydrophobicContact CB-CB 4.49Å; M21-F25 HydrophobicContact CE-CD2 4.16Å; M21-F25 HydrophobicContact CE-CG 4.26Å; M21-F25 WeakPolarHBondContact O-CB 3.22Å; M21-F25 PolarHBondContact O-N 3.48Å; M21-F25 VanDerWaalsContact O-N 3.1Å; M21-F25 HydrophobicContact SD-CB 3.95Å; M21-F25 HydrophobicContact SD-CG 4.14Å; M21-E26 PolarHBondContact O-N 2.91Å; M21-E26 VanDerWaalsContact O-N 3.11Å; M21-V124 HydrophobicContact CE-CG1 4.37Å; M21-W128 HydrophobicContact CE-CD2 4.27Å; M21-W128 HydrophobicContact CE-CG 4.23Å; M21-W128 HydrophobicContact CE-CZ2 4.17Å; M21-W128 HydrophobicContact CG-CB 4.47Å; M21-W128 HydrophobicContact CG-CD2 4.24Å; M21-W128 HydrophobicContact CG-CG 4.19Å; M21-W128 HydrophobicContact SD-CB 4.27Å; M21-W128 HydrophobicContact SD-CD2 4.29Å; M21-W128 HydrophobicContact SD-CG 3.83Å
22F89.1Confident92.7Very high103 Ų10349.1 Ų49.145%0.45226%0.263SS..THydrogen-bonded Turntrans-91.2138.1177.2-174.6-88.8000110.9N86 L89F22-N86 WeakPolarHBondContact CD2-OD1 3.41Å; F22-L89 HydrophobicContact CD2-CD2 4.34Å; F22-L89 HydrophobicContact CE2-CD2 3.69Å; F22-L89 HydrophobicContact CZ-CD2 4.39Å
23P90.8Very high93Very high40 Ų4044.1 Ų44.126%0.2624%0.237SC..THydrogen-bonded Turncis-91-24.4-3.833.3-33.3000113.7F25 E26 I27P23-F25 PolarHBondContact O-N 3.46Å; P23-E26 PolarHBondContact O-N 2.91Å; P23-I27 HydrophobicContact CB-CD1 4.11Å; P23-I27 VanDerWaalsContact O-CG1 3.24Å; P23-I27 WeakPolarHBondContact O-CG1 3.31Å; P23-I27 PolarHBondContact O-N 2.89Å
24Y93.9Very high93.3Very high168 Ų16844.1 Ų44.166%0.65924%0.236SC*.Hα-helixtrans-66.1-44.7-161.4-58.3-72.9000114.7I27 A28 M121Y24-I27 PolarHBondContact O-N 3.4Å; Y24-A28 PolarHBondContact O-N 3.36Å; Y24-A28 VanDerWaalsContact O-N 3.1Å; Y24-M121 WeakPolarHBondContact O-CE 3.42Å
25F95.2Very high93.6Very high36 Ų3641.9 Ų41.916%0.15822%0.224CC..Hα-helixtrans-71-37.4179.2-74.3-89.5000111.5L19 M21 P23 A28 H29 M121 V124 T125L19-F25 HydrophobicContact CD2-CD2 4.26Å; L19-F25 HydrophobicContact CD2-CE1 4.2Å; L19-F25 HydrophobicContact CD2-CE2 3.36Å; L19-F25 HydrophobicContact CD2-CZ 3.34Å; L19-F25 HydrophobicContact CG-CE2 3.89Å; L19-F25 HydrophobicContact CG-CZ 4.35Å; M21-F25 HydrophobicContact CB-CB 4.49Å; M21-F25 HydrophobicContact CE-CD2 4.16Å; M21-F25 HydrophobicContact CE-CG 4.26Å; M21-F25 WeakPolarHBondContact O-CB 3.22Å; M21-F25 PolarHBondContact O-N 3.48Å; M21-F25 VanDerWaalsContact O-N 3.1Å; M21-F25 HydrophobicContact SD-CB 3.95Å; M21-F25 HydrophobicContact SD-CG 4.14Å; P23-F25 PolarHBondContact O-N 3.46Å; F25-A28 PolarHBondContact O-N 3.42Å; F25-H29 PolarHBondContact O-N 3.41Å; F25-M121 HydrophobicContact CD1-CB 3.88Å; F25-M121 HydrophobicContact CD1-CE 4.21Å; F25-M121 HydrophobicContact CD1-CG 4.27Å; F25-M121 HydrophobicContact CE1-CB 4.08Å; F25-M121 HydrophobicContact CE1-CE 4.36Å; F25-M121 HydrophobicContact CE1-CG 4.05Å; F25-M121 HydrophobicContact CG-CE 4.3Å; F25-V124 HydrophobicContact CD1-CB 3.99Å; F25-V124 HydrophobicContact CD1-CG1 4.09Å; F25-V124 HydrophobicContact CE1-CB 3.82Å; F25-V124 HydrophobicContact CE1-CG1 3.83Å; F25-V124 HydrophobicContact CE1-CG2 4.06Å; F25-T125 PolarHBondContact O-OG1 2.86Å
26E94.3Very high93.8Very high23 Ų2341.8 Ų41.811%0.10722%0.219CC..Hα-helixtrans-65.1-39.5172.7-72-63.1136.400112.1M21 P23 A28 H29 Y30 T125 K129M21-E26 PolarHBondContact O-N 2.91Å; M21-E26 VanDerWaalsContact O-N 3.11Å; P23-E26 PolarHBondContact O-N 2.91Å; E26-A28 VanDerWaalsContact C-N 3.34Å; E26-A28 PolarHBondContact O-N 2.94Å; E26-H29 PolarHBondContact O-N 2.93Å; E26-H29 IonicContact OE2-CD2 2.78Å; E26-Y30 HydrophobicContact CB-CE2 3.98Å; E26-Y30 WeakPolarHBondContact O-CB 3.08Å; E26-Y30 VanDerWaalsContact O-CD2 3.23Å; E26-Y30 WeakPolarHBondContact O-CD2 3.49Å; E26-Y30 PolarHBondContact O-N 2.9Å; E26-Y30 WeakPolarHBondContact OE2-CE1 3.35Å; E26-Y30 VanDerWaalsContact OE2-CZ 3.22Å; E26-Y30 PolarHBondContact OE2-OH 2.62Å; E26-T125 VanDerWaalsContact OE1-CG2 3.3Å; E26-T125 WeakPolarHBondContact OE1-CG2 3.48Å; E26-K129 IonicContact OE1-NZ 2.75Å; E26-K129 IonicContact OE2-NZ 3.79Å
27I96.6Very high94Very high51 Ų5140.7 Ų40.726%0.26221%0.213SC..Hα-helixtrans-56.4-49.1171.8-71.5167.7000110.3P23 Y24 H29 Y30 I31 L89 I93P23-I27 HydrophobicContact CB-CD1 4.11Å; P23-I27 VanDerWaalsContact O-CG1 3.24Å; P23-I27 WeakPolarHBondContact O-CG1 3.31Å; P23-I27 PolarHBondContact O-N 2.89Å; Y24-I27 PolarHBondContact O-N 3.4Å; I27-H29 PolarHBondContact O-N 3.44Å; I27-Y30 PolarHBondContact O-N 3.05Å; I27-I31 HydrophobicContact CG2-CD1 3.56Å; I27-I31 HydrophobicContact CG2-CG1 4.22Å; I27-I31 WeakPolarHBondContact O-CB 3.25Å; I27-I31 VanDerWaalsContact O-CG1 3.3Å; I27-I31 WeakPolarHBondContact O-CG1 3.5Å; I27-I31 PolarHBondContact O-N 2.89Å; I27-L89 HydrophobicContact CD1-CD1 4.33Å; I27-L89 HydrophobicContact CG1-CD1 3.92Å; I27-L89 HydrophobicContact CG1-CD2 3.87Å; I27-L89 HydrophobicContact CG1-CG 4.18Å; I27-I93 HydrophobicContact CB-CD1 4.24Å; I27-I93 HydrophobicContact CG1-CD1 4.23Å; I27-I93 HydrophobicContact CG2-CD1 4.04Å
28A96.9Very high94.2Very high1 Ų140.4 Ų40.41%0.00821%0.208CC..Hα-helixtrans-62-43.9179.300000111.9Y24 F25 E26 Y30 I31 V32 L118 M121Y24-A28 PolarHBondContact O-N 3.36Å; Y24-A28 VanDerWaalsContact O-N 3.1Å; F25-A28 PolarHBondContact O-N 3.42Å; E26-A28 VanDerWaalsContact C-N 3.34Å; E26-A28 PolarHBondContact O-N 2.94Å; A28-Y30 PolarHBondContact O-N 2.91Å; A28-I31 PolarHBondContact O-N 3.23Å; A28-V32 WeakPolarHBondContact O-CG2 3.34Å; A28-V32 PolarHBondContact O-N 3.19Å; A28-L118 HydrophobicContact CB-CD2 3.9Å; A28-M121 HydrophobicContact CB-CB 3.54Å; A28-M121 HydrophobicContact CB-CE 4.02Å; A28-M121 HydrophobicContact CB-CG 4.37Å; A28-M121 HydrophobicContact CB-SD 3.97Å
29H96.4Very high94.4Very high18 Ų1838.3 Ų38.38%0.08319%0.194CC..Hα-helixtrans-58.8-46.1174.8169.866000112F25 E26 I27 S33 C62 T125 K129F25-H29 PolarHBondContact O-N 3.41Å; E26-H29 PolarHBondContact O-N 2.93Å; E26-H29 IonicContact OE2-CD2 2.78Å; I27-H29 PolarHBondContact O-N 3.44Å; H29-S33 PolarHBondContact CE1-OG 3.02Å; H29-S33 WeakPolarHBondContact O-CB 3.42Å; H29-S33 PolarHBondContact O-N 2.9Å; H29-S33 PolarHBondContact O-OG 3.33Å; H29-C62 PolarHBondContact NE2-O 3.44Å; H29-T125 HydrophobicContact CB-CG2 4.19Å; H29-K129 PolarHBondContact CD2-NZ 3.01Å; H29-K129 PolarHBondContact NE2-NZ 3.4Å; H29-K129 VanDerWaalsContact NE2-NZ 3.18Å
30Y97Very high94.4Very high0 Ų038 Ų380%019%0.192CC..Hα-helixtrans-66-46.9178.2-61.3-26.2000111.7E26 I27 A28 V32 S33 V34 C62 F63 L89 A90 I93E26-Y30 HydrophobicContact CB-CE2 3.98Å; E26-Y30 WeakPolarHBondContact O-CB 3.08Å; E26-Y30 VanDerWaalsContact O-CD2 3.23Å; E26-Y30 WeakPolarHBondContact O-CD2 3.49Å; E26-Y30 PolarHBondContact O-N 2.9Å; E26-Y30 WeakPolarHBondContact OE2-CE1 3.35Å; E26-Y30 VanDerWaalsContact OE2-CZ 3.22Å; E26-Y30 PolarHBondContact OE2-OH 2.62Å; I27-Y30 PolarHBondContact O-N 3.05Å; A28-Y30 PolarHBondContact O-N 2.91Å; Y30-V32 PolarHBondContact O-N 2.8Å; Y30-S33 PolarHBondContact O-N 3.49Å; Y30-V34 WeakPolarHBondContact O-CB 3.31Å; Y30-V34 VanDerWaalsContact O-CG2 3.24Å; Y30-V34 WeakPolarHBondContact O-CG2 3.43Å; Y30-V34 PolarHBondContact O-N 3.02Å; Y30-C62 HydrophobicContact CD1-CB 3.67Å; Y30-C62 HydrophobicContact CE1-CB 4.02Å; Y30-F63 HydrophobicContact CE1-CE1 4.03Å; Y30-F63 AromaticContact CE1-CZ 3.99Å; Y30-F63 HydrophobicContact CE1-CZ 3.99Å; Y30-F63 AromaticContact CZ-CZ 3.95Å; Y30-L89 HydrophobicContact CD2-CD2 4.3Å; Y30-L89 HydrophobicContact CD2-CG 4.11Å; Y30-L89 HydrophobicContact CE2-CB 4.3Å; Y30-L89 HydrophobicContact CE2-CD2 4.02Å; Y30-L89 HydrophobicContact CE2-CG 4.14Å; Y30-A90 HydrophobicContact CD1-CB 4.21Å; Y30-A90 HydrophobicContact CD2-CB 3.89Å; Y30-A90 HydrophobicContact CE1-CB 4.42Å; Y30-A90 HydrophobicContact CE2-CB 4.07Å; Y30-A90 HydrophobicContact CG-CB 3.98Å; Y30-I93 HydrophobicContact CD2-CD1 3.89Å; Y30-I93 HydrophobicContact CG-CD1 4.25Å
31I97.6Very high94.3Very high21 Ų2141.4 Ų41.411%0.10820%0.2CC..Hα-helixtrans-56.5-53.8177.8-70.1169.8000110.1I27 A28 S33 V34 L35 I93 T109 L118I27-I31 HydrophobicContact CG2-CD1 3.56Å; I27-I31 HydrophobicContact CG2-CG1 4.22Å; I27-I31 WeakPolarHBondContact O-CB 3.25Å; I27-I31 VanDerWaalsContact O-CG1 3.3Å; I27-I31 WeakPolarHBondContact O-CG1 3.5Å; I27-I31 PolarHBondContact O-N 2.89Å; A28-I31 PolarHBondContact O-N 3.23Å; I31-S33 VanDerWaalsContact C-N 3.28Å; I31-S33 PolarHBondContact O-N 3.46Å; I31-V34 PolarHBondContact O-N 3.19Å; I31-L35 HydrophobicContact CG2-CD1 3.71Å; I31-L35 HydrophobicContact CG2-CG 4.18Å; I31-L35 WeakPolarHBondContact O-CB 3.42Å; I31-L35 WeakPolarHBondContact O-CG 3.36Å; I31-L35 PolarHBondContact O-N 2.85Å; I31-I93 HydrophobicContact CB-CG2 4.33Å; I31-I93 HydrophobicContact CG1-CD1 4.29Å; I31-I93 HydrophobicContact CG1-CG1 4.38Å; I31-I93 HydrophobicContact CG1-CG2 3.65Å; I31-T109 HydrophobicContact CG2-CG2 3.75Å; I31-L118 HydrophobicContact CD1-CD2 4.35Å; I31-L118 HydrophobicContact CG2-CD1 3.84Å
32V96.8Very high94.2Very high21 Ų2142.5 Ų42.513%0.12722%0.218CC..Hα-helixtrans-66-32.4-176.7177.60000111.8A28 Y30 A36 L118 K122A28-V32 WeakPolarHBondContact O-CG2 3.34Å; A28-V32 PolarHBondContact O-N 3.19Å; Y30-V32 PolarHBondContact O-N 2.8Å; V32-A36 WeakPolarHBondContact O-CB 3.43Å; V32-A36 PolarHBondContact O-N 3.07Å; V32-L118 HydrophobicContact CG2-CB 3.62Å; V32-K122 HydrophobicContact CB-CD 3.7Å; V32-K122 HydrophobicContact CG1-CD 3.55Å
33S95.7Very high94.3Very high2 Ų237.7 Ų37.71%0.01420%0.197CC..Hα-helixtrans-73.3-41.8178.2-570000112.2H29 Y30 I31 A36 L37 K122H29-S33 PolarHBondContact CE1-OG 3.02Å; H29-S33 WeakPolarHBondContact O-CB 3.42Å; H29-S33 PolarHBondContact O-N 2.9Å; H29-S33 PolarHBondContact O-OG 3.33Å; Y30-S33 PolarHBondContact O-N 3.49Å; I31-S33 VanDerWaalsContact C-N 3.28Å; I31-S33 PolarHBondContact O-N 3.46Å; S33-A36 PolarHBondContact O-N 3.02Å; S33-L37 PolarHBondContact O-N 3.16Å; S33-K122 PolarHBondContact OG-NZ 3.11Å
34V96.8Very high94.4Very high0 Ų039.8 Ų39.80%021%0.205CC..Hα-helixtrans-68.9-38.71751760000111.1Y30 I31 A36 L37 R38 I93 W94 V97 F98Y30-V34 WeakPolarHBondContact O-CB 3.31Å; Y30-V34 VanDerWaalsContact O-CG2 3.24Å; Y30-V34 WeakPolarHBondContact O-CG2 3.43Å; Y30-V34 PolarHBondContact O-N 3.02Å; I31-V34 PolarHBondContact O-N 3.19Å; V34-A36 VanDerWaalsContact C-N 3.34Å; V34-A36 PolarHBondContact O-N 3.09Å; V34-L37 WeakPolarHBondContact O-CB 3.4Å; V34-L37 PolarHBondContact O-N 3.48Å; V34-R38 PolarHBondContact O-N 2.91Å; V34-I93 HydrophobicContact CG2-CG2 4.39Å; V34-W94 HydrophobicContact CG2-CB 4.5Å; V34-V97 HydrophobicContact CG1-CB 3.77Å; V34-V97 HydrophobicContact CG1-CG1 3.72Å; V34-V97 HydrophobicContact CG1-CG2 4.24Å; V34-F98 HydrophobicContact CG1-CD2 3.98Å; V34-F98 HydrophobicContact CG1-CE2 3.69Å
35L96.2Very high94.4Very high4 Ų433.6 Ų33.62%0.02119%0.192CC..Hα-helixtrans-59.3-45.6172.7-75.9174.7000111.5I31 L37 R38 E39 V97 Y106 T110I31-L35 HydrophobicContact CG2-CD1 3.71Å; I31-L35 HydrophobicContact CG2-CG 4.18Å; I31-L35 WeakPolarHBondContact O-CB 3.42Å; I31-L35 WeakPolarHBondContact O-CG 3.36Å; I31-L35 PolarHBondContact O-N 2.85Å; L35-L37 PolarHBondContact O-N 3.16Å; L35-R38 PolarHBondContact O-N 3.38Å; L35-R38 VanDerWaalsContact O-N 3.12Å; L35-E39 WeakPolarHBondContact O-CB 3.41Å; L35-E39 VanDerWaalsContact O-CG 3.32Å; L35-E39 WeakPolarHBondContact O-CG 3.47Å; L35-E39 PolarHBondContact O-N 3Å; L35-V97 HydrophobicContact CD2-CG1 3.94Å; L35-Y106 HydrophobicContact CD2-CD2 3.42Å; L35-Y106 VanDerWaalsContact CD2-CD2 3.42Å; L35-Y106 HydrophobicContact CD2-CE2 3.79Å; L35-T110 HydrophobicContact CD2-CG2 4.31Å
36A93.5Very high94.2Very high42 Ų4233.5 Ų33.535%0.34719%0.193SC..Hα-helixtrans-59.7-33.3177.500000112.3V32 S33 V34 Q40V32-A36 WeakPolarHBondContact O-CB 3.43Å; V32-A36 PolarHBondContact O-N 3.07Å; S33-A36 PolarHBondContact O-N 3.02Å; V34-A36 VanDerWaalsContact C-N 3.34Å; V34-A36 PolarHBondContact O-N 3.09Å; A36-Q40 VanDerWaalsContact O-CG 3.31Å; A36-Q40 WeakPolarHBondContact O-CG 3.3Å
37L94.6Very high94.2Very high2 Ų232.4 Ų32.41%0.0119%0.188CC..Hα-helixtrans-71.9-48.3171.3173.962.8000112S33 V34 L35 E39 Q40 A43 S57 S58 F98 E166S33-L37 PolarHBondContact O-N 3.16Å; V34-L37 WeakPolarHBondContact O-CB 3.4Å; V34-L37 PolarHBondContact O-N 3.48Å; L35-L37 PolarHBondContact O-N 3.16Å; L37-E39 PolarHBondContact O-N 2.93Å; L37-Q40 VanDerWaalsContact O-CB 3.3Å; L37-Q40 WeakPolarHBondContact O-CB 3.17Å; L37-Q40 WeakPolarHBondContact O-CG 3.5Å; L37-Q40 PolarHBondContact O-N 2.74Å; L37-A43 WeakPolarHBondContact O-CB 3.43Å; L37-S57 WeakPolarHBondContact CD1-OG 3.3Å; L37-S57 WeakPolarHBondContact CD2-OG 3.44Å; L37-S58 WeakPolarHBondContact CD2-OG 3.4Å; L37-F98 HydrophobicContact CD2-CZ 4.41Å; L37-F98 HydrophobicContact CG-CZ 4.39Å; L37-E166 WeakPolarHBondContact CD1-OE1 3.2Å
38R95.3Very high94.1Very high14 Ų1437.3 Ų37.35%0.05320%0.203CC..Hα-helixtrans-58.5-35.5-178.8-179177163.7162.24.6111.9V34 L35 Q40 I44 V97 F98 D103 Y106V34-R38 PolarHBondContact O-N 2.91Å; L35-R38 PolarHBondContact O-N 3.38Å; L35-R38 VanDerWaalsContact O-N 3.12Å; R38-Q40 PolarHBondContact O-N 3.2Å; R38-I44 HydrophobicContact CG-CG1 4.18Å; R38-V97 HydrophobicContact CB-CG1 4.43Å; R38-V97 PolarHBondContact NH1-O 3.36Å; R38-F98 HydrophobicContact CB-CE1 4.01Å; R38-F98 HydrophobicContact CB-CE2 4.1Å; R38-F98 HydrophobicContact CB-CZ 3.65Å; R38-F98 HydrophobicContact CG-CD1 4.41Å; R38-F98 HydrophobicContact CG-CE1 3.97Å; R38-F98 HydrophobicContact CG-CZ 4.13Å; R38-D103 IonicContact CZ-OD1 3.84Å; R38-D103 IonicContact CZ-OD2 2.78Å; R38-D103 IonicContact NH1-OD1 2.83Å; R38-D103 PolarHBondContact NH1-OD1 3.37Å; R38-D103 IonicContact NH1-OD2 3.74Å; R38-D103 IonicContact NH2-OD1 3.64Å; R38-D103 PolarHBondContact NH2-OD1 3.19Å; R38-D103 VanDerWaalsContact NH2-OD1 3.12Å; R38-D103 IonicContact NH2-OD2 2.86Å; R38-D103 PolarHBondContact NH2-OD2 3.16Å; R38-Y106 HydrophobicContact CG-CE2 4.38Å; R38-Y106 VanDerWaalsContact NH1-CG 3.33Å
39E94.1Very high94Very high82 Ų8244 Ų4438%0.38324%0.237SC..THydrogen-bonded Turntrans-73-10.8177.4-70.5177.2164.200113.4L35 L37 R115L35-E39 WeakPolarHBondContact O-CB 3.41Å; L35-E39 VanDerWaalsContact O-CG 3.32Å; L35-E39 WeakPolarHBondContact O-CG 3.47Å; L35-E39 PolarHBondContact O-N 3Å; L37-E39 PolarHBondContact O-N 2.93Å; E39-R115 VanDerWaalsContact CD-NH2 3.32Å; E39-R115 IonicContact OE1-CZ 2.62Å; E39-R115 VanDerWaalsContact OE1-CZ 3.26Å; E39-R115 IonicContact OE1-NH1 2.71Å; E39-R115 PolarHBondContact OE1-NH1 3.03Å; E39-R115 IonicContact OE1-NH2 2.73Å; E39-R115 PolarHBondContact OE1-NH2 2.95Å; E39-R115 IonicContact OE2-CZ 3.05Å; E39-R115 IonicContact OE2-NH1 2.69Å; E39-R115 IonicContact OE2-NH2 3.92Å; E39-R115 PolarHBondContact OE2-NH2 3.22Å
40Q91.3Very high94Very high52 Ų5245.5 Ų45.524%0.24325%0.25CS..SBendtrans-72.7147.6174.2-57.7-168.62100111.9A36 L37 R38 G42 A43 H61A36-Q40 VanDerWaalsContact O-CG 3.31Å; A36-Q40 WeakPolarHBondContact O-CG 3.3Å; L37-Q40 VanDerWaalsContact O-CB 3.3Å; L37-Q40 WeakPolarHBondContact O-CB 3.17Å; L37-Q40 WeakPolarHBondContact O-CG 3.5Å; L37-Q40 PolarHBondContact O-N 2.74Å; R38-Q40 PolarHBondContact O-N 3.2Å; Q40-G42 PolarHBondContact O-N 3.48Å; Q40-A43 WeakPolarHBondContact O-CB 3.48Å; Q40-A43 PolarHBondContact O-N 3.47Å; Q40-H61 PolarHBondContact NE2-NE2 3.02Å
41Q87.8Confident93.9Very high163 Ų16348.5 Ų48.576%0.76227%0.27SS*.THydrogen-bonded Turntrans-60.5128.3179.9-164.7168.813.100111.2A43Q41-A43 VanDerWaalsContact C-N 3.31Å; Q41-A43 PolarHBondContact O-N 3.33Å
42G88.9Confident93.7Very high50 Ų5053.7 Ų53.752%0.51530%0.297SS..THydrogen-bonded Turntrans82.1-5.2178.900000115.6Q40 I44 G45 L46Q40-G42 PolarHBondContact O-N 3.48Å; G42-I44 PolarHBondContact O-N 2.87Å; G42-G45 PolarHBondContact O-N 3.47Å; G42-L46 PolarHBondContact O-N 3.33Å
43A91.7Very high93.6Very high2 Ų253.9 Ų53.92%0.01730%0.301CS..Hα-helixtrans-62.9-39.5-177.500000113.2L37 Q40 Q41 L46 S47L37-A43 WeakPolarHBondContact O-CB 3.43Å; Q40-A43 WeakPolarHBondContact O-CB 3.48Å; Q40-A43 PolarHBondContact O-N 3.47Å; Q41-A43 VanDerWaalsContact C-N 3.31Å; Q41-A43 PolarHBondContact O-N 3.33Å; A43-L46 PolarHBondContact O-N 3Å; A43-S47 PolarHBondContact O-N 2.88Å
44I93.1Very high93.6Very high84 Ų8453.9 Ų53.943%0.43130%0.301SS..Hα-helixtrans-66.8-39.9176.4-60.1173.7000111.1R38 G42 S47 R48R38-I44 HydrophobicContact CG-CG1 4.18Å; G42-I44 PolarHBondContact O-N 2.87Å; I44-S47 PolarHBondContact O-N 3.33Å; I44-S47 PolarHBondContact O-OG 3.24Å; I44-R48 WeakPolarHBondContact O-CG 3.24Å; I44-R48 PolarHBondContact O-N 3.35Å
45G92.5Very high93.6Very high38 Ų3857.1 Ų57.139%0.39231%0.313SS..Hα-helixtrans-63.6-44.9175.500000111.5G42 S47 R48 I49G42-G45 PolarHBondContact O-N 3.47Å; G45-S47 VanDerWaalsContact C-N 3.33Å; G45-S47 PolarHBondContact O-N 3.42Å; G45-R48 PolarHBondContact O-N 3.3Å; G45-I49 WeakPolarHBondContact O-CG1 3.34Å; G45-I49 PolarHBondContact O-N 3.31Å; G45-I49 VanDerWaalsContact O-N 3.09Å
46L91.9Very high93.5Very high33 Ų3359.4 Ų59.417%0.17333%0.327CS..Hα-helixtrans-59.6-41.6176.4-177.168.9000112.1G42 A43 R48 I49 S50 A53 R170G42-L46 PolarHBondContact O-N 3.33Å; A43-L46 PolarHBondContact O-N 3Å; L46-R48 PolarHBondContact O-N 3.15Å; L46-I49 PolarHBondContact O-N 3.37Å; L46-S50 CarbonylContact O-C 3.31Å; L46-S50 VanDerWaalsContact O-C 3.24Å; L46-S50 WeakPolarHBondContact O-CA 3.24Å; L46-S50 PolarHBondContact O-N 3.08Å; L46-A53 HydrophobicContact CD1-CB 4.29Å; L46-R170 HydrophobicContact CD2-CB 3.78Å; L46-R170 HydrophobicContact CD2-CG 3.6Å
47S94.4Very high93.5Very high1 Ų157.4 Ų57.41%0.00731%0.311CS..Hα-helixtrans-63.5-26.6-179.781.20000113.2A43 I44 G45 P51 C54 Y99A43-S47 PolarHBondContact O-N 2.88Å; I44-S47 PolarHBondContact O-N 3.33Å; I44-S47 PolarHBondContact O-OG 3.24Å; G45-S47 VanDerWaalsContact C-N 3.33Å; G45-S47 PolarHBondContact O-N 3.42Å; S47-P51 WeakPolarHBondContact O-CA 3.41Å; S47-C54 WeakPolarHBondContact CB-SG 3.42Å; S47-Y99 PolarHBondContact O-OH 3.36Å
48R94.4Very high93.5Very high153 Ų15357.3 Ų57.358%0.57731%0.31SS*.Hα-helixtrans-87-33.9178.2-58.5-61.5174.6171.5-4.5113I44 G45 L46 F98I44-R48 WeakPolarHBondContact O-CG 3.24Å; I44-R48 PolarHBondContact O-N 3.35Å; G45-R48 PolarHBondContact O-N 3.3Å; L46-R48 PolarHBondContact O-N 3.15Å; R48-F98 PolarHBondContact NH2-O 2.79Å; R48-F98 VanDerWaalsContact NH2-O 3.12Å
49I95.3Very high93.5Very high141 Ų14157.1 Ų57.172%0.72331%0.31SS*.Hα-helixtrans-86-39.3-179-61.9167.7000111.4G45 L46G45-I49 WeakPolarHBondContact O-CG1 3.34Å; G45-I49 PolarHBondContact O-N 3.31Å; G45-I49 VanDerWaalsContact O-N 3.09Å; L46-I49 PolarHBondContact O-N 3.37Å
50S94.9Very high93.5Very high50 Ų5054.3 Ų54.335%0.3530%0.297SS..  trans-142.274.2-173.9-60.80000110L46 L52 A53 C54L46-S50 CarbonylContact O-C 3.31Å; L46-S50 VanDerWaalsContact O-C 3.24Å; L46-S50 WeakPolarHBondContact O-CA 3.24Å; L46-S50 PolarHBondContact O-N 3.08Å; S50-L52 PolarHBondContact O-N 3.28Å; S50-A53 PolarHBondContact O-N 3.49Å; S50-A53 VanDerWaalsContact O-N 3.13Å; S50-C54 PolarHBondContact O-N 3.04Å
51P94.8Very high93.6Very high63 Ų6353.1 Ų53.141%0.40929%0.292SS..Hα-helixtrans-58.7-35.1-176.122.6-33.9000112.7S47 C54 W55 W94 Y99S47-P51 WeakPolarHBondContact O-CA 3.41Å; P51-C54 WeakPolarHBondContact O-CB 3.37Å; P51-C54 PolarHBondContact O-N 3.45Å; P51-W55 PolarHBondContact O-N 2.94Å; P51-W94 HydrophobicContact CB-CH2 4.47Å; P51-W94 WeakPolarHBondContact O-CZ2 3.43Å; P51-Y99 WeakPolarHBondContact CB-OH 3.23Å
52L94.6Very high93.9Very high130 Ų13045.6 Ų45.668%0.68126%0.257SS*.Hα-helixtrans-64-43.1177.5-173.667.7000112.2S50 C54 W55 V56S50-L52 PolarHBondContact O-N 3.28Å; L52-C54 VanDerWaalsContact C-N 3.31Å; L52-C54 PolarHBondContact O-N 2.87Å; L52-W55 HydrophobicContact CD1-CE3 4.44Å; L52-W55 PolarHBondContact O-N 2.95Å; L52-V56 WeakPolarHBondContact O-CG2 3.23Å; L52-V56 PolarHBondContact O-N 2.91Å
53A93.7Very high94.2Very high25 Ų2544 Ų4421%0.20724%0.236CC..Hα-helixtrans-63.8-39.817700000111.2L46 S50 V56 S57L46-A53 HydrophobicContact CD1-CB 4.29Å; S50-A53 PolarHBondContact O-N 3.49Å; S50-A53 VanDerWaalsContact O-N 3.13Å; A53-V56 PolarHBondContact O-N 2.94Å; A53-S57 WeakPolarHBondContact O-CB 3.32Å; A53-S57 PolarHBondContact O-N 3.09Å
54C95.6Very high94.2Very high2 Ų243.9 Ų43.91%0.01424%0.235CC..Hα-helixtrans-63.4-41.5173.8-178.60000112.4S47 S50 P51 L52 S58 W94 F98S47-C54 WeakPolarHBondContact CB-SG 3.42Å; S50-C54 PolarHBondContact O-N 3.04Å; P51-C54 WeakPolarHBondContact O-CB 3.37Å; P51-C54 PolarHBondContact O-N 3.45Å; L52-C54 VanDerWaalsContact C-N 3.31Å; L52-C54 PolarHBondContact O-N 2.87Å; C54-S58 WeakPolarHBondContact O-CB 3.46Å; C54-S58 PolarHBondContact O-N 3.34Å; C54-S58 PolarHBondContact O-OG 2.69Å; C54-W94 PolarHBondContact SG-NE1 3.33Å; C54-F98 VanDerWaalsContact SG-CZ 3.6Å
55W96.4Very high94.2Very high68 Ų6840.3 Ų40.326%0.25822%0.219SC..Hα-helixtrans-62.8-48.7175.2178.586.1000111.5P51 L52 S57 S58 M59 I87 S91 W94P51-W55 PolarHBondContact O-N 2.94Å; L52-W55 HydrophobicContact CD1-CE3 4.44Å; L52-W55 PolarHBondContact O-N 2.95Å; W55-S57 VanDerWaalsContact C-N 3.35Å; W55-S57 PolarHBondContact O-N 3.3Å; W55-S58 WeakPolarHBondContact O-CA 3.43Å; W55-S58 WeakPolarHBondContact O-CB 3.42Å; W55-S58 PolarHBondContact O-N 3.45Å; W55-S58 VanDerWaalsContact O-N 3.08Å; W55-M59 HydrophobicContact CD2-CG 3.9Å; W55-M59 HydrophobicContact CE3-CG 4.12Å; W55-M59 HydrophobicContact CH2-CG 3.82Å; W55-M59 HydrophobicContact CZ2-CG 3.58Å; W55-M59 HydrophobicContact CZ2-SD 3.89Å; W55-M59 HydrophobicContact CZ3-CG 4.08Å; W55-M59 WeakPolarHBondContact O-CG 3.34Å; W55-M59 PolarHBondContact O-N 2.9Å; W55-I87 HydrophobicContact CZ2-CG2 4.08Å; W55-S91 PolarHBondContact NE1-OG 3.4Å; W55-W94 HydrophobicContact CB-CD2 4.23Å; W55-W94 HydrophobicContact CB-CE3 4.46Å; W55-W94 HydrophobicContact CB-CH2 4.03Å; W55-W94 HydrophobicContact CB-CZ2 3.78Å; W55-W94 HydrophobicContact CB-CZ3 4.37Å; W55-W94 AromaticContact CD1-CD2 3.8Å; W55-W94 AromaticContact CD1-CE3 3.58Å; W55-W94 AromaticContact CD1-CZ3 3.92Å; W55-W94 HydrophobicContact CG-CD2 4.43Å; W55-W94 HydrophobicContact CG-CE3 4.41Å
56V94.3Very high94.3Very high53 Ų5339.6 Ų39.632%0.32121%0.209SC..Hα-helixtrans-59.1-46.5177.7172.70000111L52 A53 S58 M59 L60 V169L52-V56 WeakPolarHBondContact O-CG2 3.23Å; L52-V56 PolarHBondContact O-N 2.91Å; A53-V56 PolarHBondContact O-N 2.94Å; V56-S58 VanDerWaalsContact C-N 3.29Å; V56-S58 PolarHBondContact O-N 3.37Å; V56-M59 PolarHBondContact O-N 3.24Å; V56-M59 VanDerWaalsContact O-N 3.16Å; V56-L60 HydrophobicContact CG1-CD1 4.37Å; V56-L60 WeakPolarHBondContact O-CG 3.37Å; V56-L60 PolarHBondContact O-N 2.99Å; V56-V169 HydrophobicContact CB-CG1 4.46Å; V56-V169 HydrophobicContact CG1-CG1 4.1Å
57S94.1Very high94.4Very high0 Ų039 Ų390%021%0.207CC..Hα-helixtrans-58.2-41.4175161.30000111.6L37 A53 W55 M59 L60 H61 E166L37-S57 WeakPolarHBondContact CD1-OG 3.3Å; L37-S57 WeakPolarHBondContact CD2-OG 3.44Å; A53-S57 WeakPolarHBondContact O-CB 3.32Å; A53-S57 PolarHBondContact O-N 3.09Å; W55-S57 VanDerWaalsContact C-N 3.35Å; W55-S57 PolarHBondContact O-N 3.3Å; S57-M59 PolarHBondContact O-N 2.98Å; S57-L60 PolarHBondContact O-N 3.32Å; S57-H61 PolarHBondContact O-CD2 3.09Å; S57-H61 PolarHBondContact O-N 3.22Å; S57-E166 WeakPolarHBondContact CB-OE1 3.25Å; S57-E166 PolarHBondContact OG-OE1 2.71Å
58S95.3Very high94.3Very high0 Ų040.6 Ų40.60%022%0.215CC..Hα-helixtrans-63.3-40.9175.3-58.40000112.5L37 C54 W55 V56 H61 C62 W94L37-S58 WeakPolarHBondContact CD2-OG 3.4Å; C54-S58 WeakPolarHBondContact O-CB 3.46Å; C54-S58 PolarHBondContact O-N 3.34Å; C54-S58 PolarHBondContact O-OG 2.69Å; W55-S58 WeakPolarHBondContact O-CA 3.43Å; W55-S58 WeakPolarHBondContact O-CB 3.42Å; W55-S58 PolarHBondContact O-N 3.45Å; W55-S58 VanDerWaalsContact O-N 3.08Å; V56-S58 VanDerWaalsContact C-N 3.29Å; V56-S58 PolarHBondContact O-N 3.37Å; S58-H61 PolarHBondContact O-N 2.9Å; S58-C62 PolarHBondContact O-N 3.24Å; S58-C62 PolarHBondContact O-SG 3.33Å; S58-W94 PolarHBondContact OG-NE1 2.92Å
59M95.2Very high94.3Very high9 Ų933.3 Ų33.34%0.04419%0.188CC..Hα-helixtrans-65.1-38.9175.4-64.8-54.2103.100111.4W55 V56 S57 H61 C62 F63 A90W55-M59 HydrophobicContact CD2-CG 3.9Å; W55-M59 HydrophobicContact CE3-CG 4.12Å; W55-M59 HydrophobicContact CH2-CG 3.82Å; W55-M59 HydrophobicContact CZ2-CG 3.58Å; W55-M59 HydrophobicContact CZ2-SD 3.89Å; W55-M59 HydrophobicContact CZ3-CG 4.08Å; W55-M59 WeakPolarHBondContact O-CG 3.34Å; W55-M59 PolarHBondContact O-N 2.9Å; V56-M59 PolarHBondContact O-N 3.24Å; V56-M59 VanDerWaalsContact O-N 3.16Å; S57-M59 PolarHBondContact O-N 2.98Å; M59-H61 VanDerWaalsContact C-N 3.33Å; M59-H61 PolarHBondContact O-N 3.39Å; M59-C62 PolarHBondContact O-N 2.68Å; M59-F63 HydrophobicContact CB-CD2 4.3Å; M59-F63 WeakPolarHBondContact O-CB 3.26Å; M59-F63 WeakPolarHBondContact O-CD2 3.19Å; M59-F63 PolarHBondContact O-N 2.91Å; M59-F63 HydrophobicContact SD-CD2 4.17Å; M59-F63 HydrophobicContact SD-CE2 3.74Å; M59-A90 HydrophobicContact CE-CB 3.82Å; M59-A90 HydrophobicContact SD-CB 4.05Å
60L93.2Very high94.1Very high23 Ų2326.8 Ų26.812%0.1216%0.155CC..Hα-helixtrans-64-37.5173.8-69.5174.2000111.9V56 S57 G64 I162 F165 E166 V169V56-L60 HydrophobicContact CG1-CD1 4.37Å; V56-L60 WeakPolarHBondContact O-CG 3.37Å; V56-L60 PolarHBondContact O-N 2.99Å; S57-L60 PolarHBondContact O-N 3.32Å; L60-G64 WeakPolarHBondContact O-CA 3.05Å; L60-G64 PolarHBondContact O-N 3.35Å; L60-I162 HydrophobicContact CB-CD1 4.37Å; L60-I162 HydrophobicContact CD2-CD1 4.18Å; L60-F165 HydrophobicContact CD1-CD1 4.23Å; L60-F165 HydrophobicContact CD1-CE1 4.25Å; L60-E166 HydrophobicContact CB-CG 4.48Å; L60-E166 HydrophobicContact CD1-CB 4.36Å; L60-V169 HydrophobicContact CD1-CG2 4.04Å
61H93Very high94Very high28 Ų2831 Ų3113%0.1317%0.167CC..Hα-helixtrans-65.8-36.7172.5-90-86.6000113Q40 S57 S58 M59 E166Q40-H61 PolarHBondContact NE2-NE2 3.02Å; S57-H61 PolarHBondContact O-CD2 3.09Å; S57-H61 PolarHBondContact O-N 3.22Å; S58-H61 PolarHBondContact O-N 2.9Å; M59-H61 VanDerWaalsContact C-N 3.33Å; M59-H61 PolarHBondContact O-N 3.39Å; H61-E166 IonicContact NE2-OE2 2.7Å
62C94.6Very high93.9Very high4 Ų432.3 Ų32.33%0.02717%0.169CC..Hα-helixtrans-79.8-43.6-178.3-65.90000113.1H29 Y30 S58 M59H29-C62 PolarHBondContact NE2-O 3.44Å; Y30-C62 HydrophobicContact CD1-CB 3.67Å; Y30-C62 HydrophobicContact CE1-CB 4.02Å; S58-C62 PolarHBondContact O-N 3.24Å; S58-C62 PolarHBondContact O-SG 3.33Å; M59-C62 PolarHBondContact O-N 2.68Å
63F94.4Very high93.7Very high16 Ų1626.2 Ų26.27%0.0714%0.138CC..Hα-helixtrans-110.32.5-171.9-58.4-71.7000113.6Y30 M59 G65 A66 V67 P80 L81 N86 A90Y30-F63 HydrophobicContact CE1-CE1 4.03Å; Y30-F63 AromaticContact CE1-CZ 3.99Å; Y30-F63 HydrophobicContact CE1-CZ 3.99Å; Y30-F63 AromaticContact CZ-CZ 3.95Å; M59-F63 HydrophobicContact CB-CD2 4.3Å; M59-F63 WeakPolarHBondContact O-CB 3.26Å; M59-F63 WeakPolarHBondContact O-CD2 3.19Å; M59-F63 PolarHBondContact O-N 2.91Å; M59-F63 HydrophobicContact SD-CD2 4.17Å; M59-F63 HydrophobicContact SD-CE2 3.74Å; F63-G65 PolarHBondContact O-N 3.49Å; F63-G65 VanDerWaalsContact O-N 3.08Å; F63-A66 PolarHBondContact O-N 2.74Å; F63-V67 HydrophobicContact CB-CG2 4.39Å; F63-V67 PolarHBondContact O-N 3.48Å; F63-P80 HydrophobicContact CB-CB 4.46Å; F63-L81 HydrophobicContact CD2-CD2 4.46Å; F63-N86 HydrophobicContact CE1-CB 4.1Å; F63-N86 HydrophobicContact CZ-CB 4.14Å; F63-A90 HydrophobicContact CE2-CB 3.86Å; F63-A90 HydrophobicContact CZ-CB 3.97Å
64G93.4Very high93.6Very high1 Ų129.6 Ų29.61%0.0117%0.166CC..Hα-helixtrans-54.7-33.4-174.500000114.4L60 L68 I162L60-G64 WeakPolarHBondContact O-CA 3.05Å; L60-G64 PolarHBondContact O-N 3.35Å; G64-L68 WeakPolarHBondContact O-CB 3.32Å; G64-L68 PolarHBondContact O-N 3.41Å; G64-I162 VanDerWaalsContact CA-CD1 3.4Å
65G93.3Very high93.3Very high8 Ų832.3 Ų32.38%0.08218%0.178CC..Hα-helixtrans-63-43.1173.200000113.9F63 S69 A154F63-G65 PolarHBondContact O-N 3.49Å; F63-G65 VanDerWaalsContact O-N 3.08Å; G65-S69 WeakPolarHBondContact O-CB 3.45Å; G65-S69 PolarHBondContact O-N 2.89Å; G65-S69 PolarHBondContact O-OG 2.9Å; G65-A154 WeakPolarHBondContact CA-O 3.34Å
66A93.3Very high92.9Very high23 Ų2332.9 Ų32.919%0.1919%0.191CC..Hα-helixtrans-72.9-42.7178.800000111.1F63 S69 G70 P80F63-A66 PolarHBondContact O-N 2.74Å; A66-S69 WeakPolarHBondContact CA-OG 3.08Å; A66-S69 PolarHBondContact O-N 2.9Å; A66-S69 PolarHBondContact O-OG 3.33Å; A66-G70 PolarHBondContact O-N 3.36Å; A66-P80 HydrophobicContact CB-CB 3.74Å; A66-P80 HydrophobicContact CB-CG 3.36Å
67V93.8Very high92.4Very high22 Ų2232.1 Ų32.113%0.13319%0.186CC..Hα-helixtrans-58.6-50.8175.6173.90000110.9F63 S69 G70 F71 P77 P80F63-V67 HydrophobicContact CB-CG2 4.39Å; F63-V67 PolarHBondContact O-N 3.48Å; V67-S69 PolarHBondContact O-N 3.02Å; V67-G70 PolarHBondContact O-N 3.41Å; V67-F71 HydrophobicContact CG1-CD2 3.99Å; V67-F71 HydrophobicContact CG1-CE2 3.71Å; V67-F71 VanDerWaalsContact O-CD2 3.29Å; V67-F71 WeakPolarHBondContact O-CD2 3.33Å; V67-F71 PolarHBondContact O-N 3.24Å; V67-F71 VanDerWaalsContact O-N 3.09Å; V67-P77 HydrophobicContact CG1-CB 4.3Å; V67-P80 HydrophobicContact CG2-CG 4.49Å
68L93.4Very high92Very high33 Ų3337.8 Ų37.817%0.17322%0.215CC..Hα-helixtrans-61.5-46.5179.4-178.761.1000111.2G64 G70 F71 M72 A154 L161 I162G64-L68 WeakPolarHBondContact O-CB 3.32Å; G64-L68 PolarHBondContact O-N 3.41Å; L68-G70 VanDerWaalsContact C-N 3.27Å; L68-G70 PolarHBondContact O-N 3.25Å; L68-F71 PolarHBondContact O-N 3.27Å; L68-M72 HydrophobicContact CG-SD 4.31Å; L68-M72 WeakPolarHBondContact O-CG 3.35Å; L68-M72 PolarHBondContact O-N 3.41Å; L68-M72 VanDerWaalsContact O-N 3.11Å; L68-A154 HydrophobicContact CB-CB 4.49Å; L68-A154 HydrophobicContact CD2-CB 3.85Å; L68-A154 HydrophobicContact CG-CB 3.95Å; L68-L161 HydrophobicContact CD2-CB 3.75Å; L68-L161 HydrophobicContact CD2-CD1 3.78Å; L68-L161 HydrophobicContact CD2-CG 4.43Å; L68-I162 HydrophobicContact CB-CG2 4.04Å; L68-I162 HydrophobicContact CD1-CG2 3.91Å; L68-I162 HydrophobicContact CD2-CG2 4.08Å; L68-I162 HydrophobicContact CG-CG2 4.23Å
69S93.4Very high91.5Very high0 Ų039.7 Ų39.70%023%0.232CC..Hα-helixtrans-62.4-34.5176.667.80000113G65 A66 V67 M72 L73 R155G65-S69 WeakPolarHBondContact O-CB 3.45Å; G65-S69 PolarHBondContact O-N 2.89Å; G65-S69 PolarHBondContact O-OG 2.9Å; A66-S69 WeakPolarHBondContact CA-OG 3.08Å; A66-S69 PolarHBondContact O-N 2.9Å; A66-S69 PolarHBondContact O-OG 3.33Å; V67-S69 PolarHBondContact O-N 3.02Å; S69-M72 PolarHBondContact O-N 3.49Å; S69-L73 WeakPolarHBondContact O-CB 3.45Å; S69-L73 VanDerWaalsContact O-CG 3.29Å; S69-L73 WeakPolarHBondContact O-CG 3.41Å; S69-L73 PolarHBondContact O-N 2.94Å; S69-R155 PolarHBondContact OG-NE 3.17Å; S69-R155 PolarHBondContact OG-NH2 3.39Å
70G92.1Very high90.7Very high4 Ų440.2 Ų40.24%0.04124%0.236CC..Hα-helixtrans-61.8-46.9175.400000111.6A66 V67 L68 M72 L73 A74 E75A66-G70 PolarHBondContact O-N 3.36Å; V67-G70 PolarHBondContact O-N 3.41Å; L68-G70 VanDerWaalsContact C-N 3.27Å; L68-G70 PolarHBondContact O-N 3.25Å; G70-M72 VanDerWaalsContact C-N 3.32Å; G70-M72 PolarHBondContact O-N 3.03Å; G70-L73 PolarHBondContact O-N 3.07Å; G70-A74 PolarHBondContact O-N 2.9Å; G70-A74 VanDerWaalsContact O-N 3.1Å; G70-E75 CarbonylContact C-O 3.24Å; G70-E75 PolarHBondContact O-N 3.36Å; G70-E75 VanDerWaalsContact O-O 3.1Å
71F92.6Very high90.1Very high138 Ų13842.5 Ų42.561%0.60525%0.248SC*.Hα-helixtrans-56.9-44.4173.6-80.8-67.9000112.7V67 L68 A74 P77V67-F71 HydrophobicContact CG1-CD2 3.99Å; V67-F71 HydrophobicContact CG1-CE2 3.71Å; V67-F71 VanDerWaalsContact O-CD2 3.29Å; V67-F71 WeakPolarHBondContact O-CD2 3.33Å; V67-F71 PolarHBondContact O-N 3.24Å; V67-F71 VanDerWaalsContact O-N 3.09Å; L68-F71 PolarHBondContact O-N 3.27Å; F71-A74 PolarHBondContact O-N 3.41Å; F71-P77 HydrophobicContact CD1-CB 4.18Å; F71-P77 HydrophobicContact CD1-CG 4.18Å; F71-P77 HydrophobicContact CD2-CB 3.71Å; F71-P77 HydrophobicContact CD2-CG 4.47Å; F71-P77 HydrophobicContact CE1-CB 3.99Å; F71-P77 HydrophobicContact CE1-CG 3.69Å; F71-P77 HydrophobicContact CE2-CB 3.49Å; F71-P77 VanDerWaalsContact CE2-CB 3.49Å; F71-P77 HydrophobicContact CE2-CG 4.02Å; F71-P77 HydrophobicContact CG-CB 4.05Å; F71-P77 HydrophobicContact CZ-CB 3.64Å; F71-P77 HydrophobicContact CZ-CG 3.6Å
72M92.3Very high89.6Confident91 Ų9145.2 Ų45.245%0.44827%0.27SS..Hα-helixtrans-69.7-32.6-178.2-62.2-176.798.800113.1L68 S69 G70 A74 T150 I151 A154L68-M72 HydrophobicContact CG-SD 4.31Å; L68-M72 WeakPolarHBondContact O-CG 3.35Å; L68-M72 PolarHBondContact O-N 3.41Å; L68-M72 VanDerWaalsContact O-N 3.11Å; S69-M72 PolarHBondContact O-N 3.49Å; G70-M72 VanDerWaalsContact C-N 3.32Å; G70-M72 PolarHBondContact O-N 3.03Å; M72-A74 VanDerWaalsContact C-N 3.31Å; M72-T150 HydrophobicContact CE-CG2 3.07Å; M72-T150 HydrophobicContact SD-CG2 3.91Å; M72-I151 HydrophobicContact CB-CD1 3.58Å; M72-I151 HydrophobicContact SD-CD1 4.33Å; M72-A154 HydrophobicContact SD-CB 3.8Å
73L90.8Very high89.3Confident3 Ų349.1 Ų49.12%0.01629%0.29CS..THydrogen-bonded Turntrans-88.33.1178.7-67.7175000113.5S69 G70 E75 L136 K140 Y141 I151S69-L73 WeakPolarHBondContact O-CB 3.45Å; S69-L73 VanDerWaalsContact O-CG 3.29Å; S69-L73 WeakPolarHBondContact O-CG 3.41Å; S69-L73 PolarHBondContact O-N 2.94Å; G70-L73 PolarHBondContact O-N 3.07Å; L73-E75 HydrophobicContact CB-CG 4.24Å; L73-E75 PolarHBondContact O-N 2.99Å; L73-L136 HydrophobicContact CD1-CD2 3.69Å; L73-L136 HydrophobicContact CD1-CG 4.17Å; L73-K140 HydrophobicContact CD2-CD 4.26Å; L73-K140 PolarHBondContact O-NZ 3.06Å; L73-Y141 HydrophobicContact CD2-CD2 4.37Å; L73-Y141 HydrophobicContact CD2-CE2 3.65Å; L73-I151 HydrophobicContact CD1-CD1 4.36Å; L73-I151 HydrophobicContact CD1-CG2 4.17Å; L73-I151 HydrophobicContact CD2-CD1 3.73Å; L73-I151 HydrophobicContact CD2-CG1 3.86Å; L73-I151 HydrophobicContact CG-CD1 3.68Å; L73-I151 HydrophobicContact CG-CG1 4.23Å
74A90.9Very high89.2Confident96 Ų9652.5 Ų52.579%0.79332%0.316SS*.THydrogen-bonded Turntrans52.631.8-170.500000113.4G70 F71 M72G70-A74 PolarHBondContact O-N 2.9Å; G70-A74 VanDerWaalsContact O-N 3.1Å; F71-A74 PolarHBondContact O-N 3.41Å; M72-A74 VanDerWaalsContact C-N 3.31Å
75E89Confident89.1Confident58 Ų5858 Ų5827%0.27135%0.345SS..SBendtrans-91.4154.9172-79.4166.3-152.300109.9G70 L73 P77 K140G70-E75 CarbonylContact C-O 3.24Å; G70-E75 PolarHBondContact O-N 3.36Å; G70-E75 VanDerWaalsContact O-O 3.1Å; L73-E75 HydrophobicContact CB-CG 4.24Å; L73-E75 PolarHBondContact O-N 2.99Å; E75-P77 WeakPolarHBondContact O-CD 3.44Å; E75-K140 IonicContact OE1-NZ 3.91Å; E75-K140 PolarHBondContact OE1-NZ 3.36Å
76P88.6Confident89.1Confident81 Ų8159.4 Ų59.453%0.52635%0.351SS..  trans-55.7113.8177.515.4-24.2000109.5I78 A79P76-I78 HydrophobicContact CB-CG1 4.31Å; P76-I78 PolarHBondContact O-N 3.48Å; P76-A79 HydrophobicContact CG-CB 4.17Å; P76-A79 WeakPolarHBondContact O-CB 3.49Å; P76-A79 PolarHBondContact O-N 2.99Å
77P84.2Confident89.1Confident36 Ų3659.7 Ų59.723%0.23435%0.349CS..THydrogen-bonded Turntrans-67.9-14.7-173.627.3-35.8000112.4V67 F71 E75 P80V67-P77 HydrophobicContact CG1-CB 4.3Å; F71-P77 HydrophobicContact CD1-CB 4.18Å; F71-P77 HydrophobicContact CD1-CG 4.18Å; F71-P77 HydrophobicContact CD2-CB 3.71Å; F71-P77 HydrophobicContact CD2-CG 4.47Å; F71-P77 HydrophobicContact CE1-CB 3.99Å; F71-P77 HydrophobicContact CE1-CG 3.69Å; F71-P77 HydrophobicContact CE2-CB 3.49Å; F71-P77 VanDerWaalsContact CE2-CB 3.49Å; F71-P77 HydrophobicContact CE2-CG 4.02Å; F71-P77 HydrophobicContact CG-CB 4.05Å; F71-P77 HydrophobicContact CZ-CB 3.64Å; F71-P77 HydrophobicContact CZ-CG 3.6Å; E75-P77 WeakPolarHBondContact O-CD 3.44Å; P77-P80 VanDerWaalsContact O-CD 3.23Å; P77-P80 WeakPolarHBondContact O-CD 3.29Å
78I85.7Confident89.2Confident119 Ų11963.7 Ų63.761%0.6137%0.369SS*.THydrogen-bonded Turntrans-84.3-6.8172.361.3167.5000113.2P76 P80 L81P76-I78 HydrophobicContact CB-CG1 4.31Å; P76-I78 PolarHBondContact O-N 3.48Å; I78-P80 VanDerWaalsContact C-N 3.3Å; I78-L81 HydrophobicContact CB-CD1 4.46Å; I78-L81 HydrophobicContact CG2-CD1 4.48Å; I78-L81 VanDerWaalsContact O-CA 3.31Å; I78-L81 WeakPolarHBondContact O-CA 3.44Å; I78-L81 WeakPolarHBondContact O-CB 3.43Å; I78-L81 PolarHBondContact O-N 2.94Å
79A84.5Confident89.3Confident41 Ų4163.5 Ų63.534%0.33937%0.368SS..G310 helixtrans-54.6-36.3177.700000114.1P76 L81 S82P76-A79 HydrophobicContact CG-CB 4.17Å; P76-A79 WeakPolarHBondContact O-CB 3.49Å; P76-A79 PolarHBondContact O-N 2.99Å; A79-L81 PolarHBondContact O-N 3.35Å; A79-L81 VanDerWaalsContact O-N 3.15Å; A79-S82 WeakPolarHBondContact O-CB 3.36Å; A79-S82 PolarHBondContact O-N 2.97Å; A79-S82 PolarHBondContact O-OG 2.71Å
80P79.4Confident89.4Confident20 Ų2063.5 Ų63.513%0.1337%0.368CS..G310 helixtrans-60.5-25.1173.3-23.336.1000112.9F63 A66 V67 P77 I78 S82F63-P80 HydrophobicContact CB-CB 4.46Å; A66-P80 HydrophobicContact CB-CB 3.74Å; A66-P80 HydrophobicContact CB-CG 3.36Å; V67-P80 HydrophobicContact CG2-CG 4.49Å; P77-P80 VanDerWaalsContact O-CD 3.23Å; P77-P80 WeakPolarHBondContact O-CD 3.29Å; I78-P80 VanDerWaalsContact C-N 3.3Å; P80-S82 VanDerWaalsContact C-N 3.3Å
81L78.7Confident89.7Confident71 Ų7164.5 Ų64.537%0.37237%0.374SS..G310 helixtrans-84.16.3175.7-54.6172.3000113.6F63 I78 A79 I87F63-L81 HydrophobicContact CD2-CD2 4.46Å; I78-L81 HydrophobicContact CB-CD1 4.46Å; I78-L81 HydrophobicContact CG2-CD1 4.48Å; I78-L81 VanDerWaalsContact O-CA 3.31Å; I78-L81 WeakPolarHBondContact O-CA 3.44Å; I78-L81 WeakPolarHBondContact O-CB 3.43Å; I78-L81 PolarHBondContact O-N 2.94Å; A79-L81 PolarHBondContact O-N 3.35Å; A79-L81 VanDerWaalsContact O-N 3.15Å; L81-I87 HydrophobicContact CB-CD1 3.85Å; L81-I87 HydrophobicContact CD2-CD1 4.18Å; L81-I87 HydrophobicContact CD2-CG1 4.14Å; L81-I87 WeakPolarHBondContact O-CD1 3.23Å
82S83.9Confident89.9Confident85 Ų8561.9 Ų61.959%0.59437%0.366SS*.G310 helixtrans-81.8-20.4168.971.10000112.3A79 P80 S84A79-S82 WeakPolarHBondContact O-CB 3.36Å; A79-S82 PolarHBondContact O-N 2.97Å; A79-S82 PolarHBondContact O-OG 2.71Å; P80-S82 VanDerWaalsContact C-N 3.3Å; S82-S84 PolarHBondContact O-N 2.92Å
83N88.3Confident90.1Very high86 Ų8658 Ų5846%0.4635%0.347SS..  trans-79.684.3-179.4-70.6-64000111N85 N86 I87N83-N85 PolarHBondContact O-N 3.29Å; N83-N85 VanDerWaalsContact O-N 3.14Å; N83-N86 HydrophobicContact CB-CB 4.21Å; N83-N86 PolarHBondContact O-N 3.25Å; N83-N86 VanDerWaalsContact O-N 3.07Å; N83-I87 WeakPolarHBondContact O-CG1 3.44Å; N83-I87 PolarHBondContact O-N 2.71Å; N83-I87 VanDerWaalsContact O-N 3.11Å
84S91.5Very high90.5Very high87 Ų8759.3 Ų59.361%0.60835%0.351SS*.Hα-helixtrans-50.8-39.8-177.8-55.70000113.3S82 I87 L88S82-S84 PolarHBondContact O-N 2.92Å; S84-I87 PolarHBondContact O-N 3.1Å; S84-L88 WeakPolarHBondContact O-CB 3.34Å; S84-L88 PolarHBondContact O-N 2.7Å
85N92.6Very high90.8Very high115 Ų11561 Ų6162%0.61534%0.338SS*.Hα-helixtrans-63-45.3179.7-67.5-14.1000112.5N83 L89N83-N85 PolarHBondContact O-N 3.29Å; N83-N85 VanDerWaalsContact O-N 3.14Å; N85-L89 VanDerWaalsContact O-CB 3.23Å; N85-L89 WeakPolarHBondContact O-CB 3.49Å; N85-L89 PolarHBondContact O-N 3.42Å
86N92.4Very high91.1Very high39 Ų3961.6 Ų61.621%0.20934%0.343CS..Hα-helixtrans-70.6-39.8-179.1-74.5-30.1000111.5F22 F63 N83 L89 A90F22-N86 WeakPolarHBondContact CD2-OD1 3.41Å; F63-N86 HydrophobicContact CE1-CB 4.1Å; F63-N86 HydrophobicContact CZ-CB 4.14Å; N83-N86 HydrophobicContact CB-CB 4.21Å; N83-N86 PolarHBondContact O-N 3.25Å; N83-N86 VanDerWaalsContact O-N 3.07Å; N86-L89 PolarHBondContact O-N 3.04Å; N86-A90 VanDerWaalsContact O-CB 3.3Å; N86-A90 WeakPolarHBondContact O-CB 3.28Å; N86-A90 PolarHBondContact O-N 2.79Å
87I94Very high91.5Very high29 Ų2957.7 Ų57.715%0.14932%0.318CS..Hα-helixtrans-66.7-44.4177-62.5162000110.8W55 L81 N83 S84 L89 A90 S91W55-I87 HydrophobicContact CZ2-CG2 4.08Å; L81-I87 HydrophobicContact CB-CD1 3.85Å; L81-I87 HydrophobicContact CD2-CD1 4.18Å; L81-I87 HydrophobicContact CD2-CG1 4.14Å; L81-I87 WeakPolarHBondContact O-CD1 3.23Å; N83-I87 WeakPolarHBondContact O-CG1 3.44Å; N83-I87 PolarHBondContact O-N 2.71Å; N83-I87 VanDerWaalsContact O-N 3.11Å; S84-I87 PolarHBondContact O-N 3.1Å; I87-L89 VanDerWaalsContact C-N 3.31Å; I87-L89 PolarHBondContact O-N 3.26Å; I87-A90 PolarHBondContact O-N 3.23Å; I87-S91 VanDerWaalsContact O-CB 3.23Å; I87-S91 WeakPolarHBondContact O-CB 3.33Å; I87-S91 PolarHBondContact O-N 3.11Å; I87-S91 PolarHBondContact O-OG 3.31Å
88L94.9Very high92.1Very high105 Ų10556.2 Ų56.255%0.5531%0.308SS..Hα-helixtrans-59.5-47.3177.2-179.165.2000109.8S84 S91 I92S84-L88 WeakPolarHBondContact O-CB 3.34Å; S84-L88 PolarHBondContact O-N 2.7Å; L88-S91 PolarHBondContact O-N 3.49Å; L88-I92 HydrophobicContact CD1-CD1 4.27Å; L88-I92 HydrophobicContact CG-CD1 3.98Å; L88-I92 VanDerWaalsContact O-CG1 3.28Å; L88-I92 WeakPolarHBondContact O-CG1 3.48Å; L88-I92 PolarHBondContact O-N 3.31Å
89L95.6Very high92.5Very high30 Ų3052.7 Ų52.716%0.15729%0.287CS..Hα-helixtrans-61.2-47.8177.9-174.760.2000112.4F22 I27 Y30 N85 N86 I87 S91 I92 I93F22-L89 HydrophobicContact CD2-CD2 4.34Å; F22-L89 HydrophobicContact CE2-CD2 3.69Å; F22-L89 HydrophobicContact CZ-CD2 4.39Å; I27-L89 HydrophobicContact CD1-CD1 4.33Å; I27-L89 HydrophobicContact CG1-CD1 3.92Å; I27-L89 HydrophobicContact CG1-CD2 3.87Å; I27-L89 HydrophobicContact CG1-CG 4.18Å; Y30-L89 HydrophobicContact CD2-CD2 4.3Å; Y30-L89 HydrophobicContact CD2-CG 4.11Å; Y30-L89 HydrophobicContact CE2-CB 4.3Å; Y30-L89 HydrophobicContact CE2-CD2 4.02Å; Y30-L89 HydrophobicContact CE2-CG 4.14Å; N85-L89 VanDerWaalsContact O-CB 3.23Å; N85-L89 WeakPolarHBondContact O-CB 3.49Å; N85-L89 PolarHBondContact O-N 3.42Å; N86-L89 PolarHBondContact O-N 3.04Å; I87-L89 VanDerWaalsContact C-N 3.31Å; I87-L89 PolarHBondContact O-N 3.26Å; L89-S91 VanDerWaalsContact C-N 3.29Å; L89-S91 PolarHBondContact O-N 3.45Å; L89-I92 PolarHBondContact O-N 2.92Å; L89-I93 HydrophobicContact CD1-CD1 4.36Å; L89-I93 HydrophobicContact CG-CD1 4.22Å; L89-I93 WeakPolarHBondContact O-CG1 3.47Å; L89-I93 PolarHBondContact O-N 3.23Å
90A96.3Very high93Very high0 Ų051.7 Ų51.70%028%0.277CS..Hα-helixtrans-62.7-36.4176.100000112Y30 M59 F63 N86 I87 I93 W94Y30-A90 HydrophobicContact CD1-CB 4.21Å; Y30-A90 HydrophobicContact CD2-CB 3.89Å; Y30-A90 HydrophobicContact CE1-CB 4.42Å; Y30-A90 HydrophobicContact CE2-CB 4.07Å; Y30-A90 HydrophobicContact CG-CB 3.98Å; M59-A90 HydrophobicContact CE-CB 3.82Å; M59-A90 HydrophobicContact SD-CB 4.05Å; F63-A90 HydrophobicContact CE2-CB 3.86Å; F63-A90 HydrophobicContact CZ-CB 3.97Å; N86-A90 VanDerWaalsContact O-CB 3.3Å; N86-A90 WeakPolarHBondContact O-CB 3.28Å; N86-A90 PolarHBondContact O-N 2.79Å; I87-A90 PolarHBondContact O-N 3.23Å; A90-I93 PolarHBondContact O-N 3Å; A90-W94 WeakPolarHBondContact O-CB 3.31Å; A90-W94 PolarHBondContact O-N 2.81Å
91S96.9Very high93.6Very high25 Ų2555.5 Ų55.518%0.17530%0.302CS..Hα-helixtrans-69.5-40.8177.4-59.50000112.1W55 I87 L88 L89 I93 W94 Y95W55-S91 PolarHBondContact NE1-OG 3.4Å; I87-S91 VanDerWaalsContact O-CB 3.23Å; I87-S91 WeakPolarHBondContact O-CB 3.33Å; I87-S91 PolarHBondContact O-N 3.11Å; I87-S91 PolarHBondContact O-OG 3.31Å; L88-S91 PolarHBondContact O-N 3.49Å; L89-S91 VanDerWaalsContact C-N 3.29Å; L89-S91 PolarHBondContact O-N 3.45Å; S91-I93 VanDerWaalsContact C-N 3.35Å; S91-W94 PolarHBondContact O-N 3.36Å; S91-Y95 WeakPolarHBondContact O-CB 3.15Å; S91-Y95 PolarHBondContact O-N 3.19Å
92I97.2Very high94.1Very high82 Ų8260.1 Ų60.142%0.42132%0.324SS..Hα-helixtrans-61.4-46.5173.3-70.2165000109.7L88 L89 Y95 L96L88-I92 HydrophobicContact CD1-CD1 4.27Å; L88-I92 HydrophobicContact CG-CD1 3.98Å; L88-I92 VanDerWaalsContact O-CG1 3.28Å; L88-I92 WeakPolarHBondContact O-CG1 3.48Å; L88-I92 PolarHBondContact O-N 3.31Å; L89-I92 PolarHBondContact O-N 2.92Å; I92-Y95 PolarHBondContact O-N 3.48Å; I92-L96 HydrophobicContact CG2-CD1 3.86Å; I92-L96 HydrophobicContact CG2-CG 4.29Å; I92-L96 WeakPolarHBondContact O-CB 2.89Å; I92-L96 VanDerWaalsContact O-CG 3.29Å; I92-L96 WeakPolarHBondContact O-CG 3.24Å; I92-L96 PolarHBondContact O-N 3.36Å
93I97.4Very high94.5Very high11 Ų1158.8 Ų58.86%0.05631%0.31CS..Hα-helixtrans-63.6-44.2178.6-70.6166.1000111.2I27 Y30 I31 V34 L89 A90 S91 Y95 L96 V97I27-I93 HydrophobicContact CB-CD1 4.24Å; I27-I93 HydrophobicContact CG1-CD1 4.23Å; I27-I93 HydrophobicContact CG2-CD1 4.04Å; Y30-I93 HydrophobicContact CD2-CD1 3.89Å; Y30-I93 HydrophobicContact CG-CD1 4.25Å; I31-I93 HydrophobicContact CB-CG2 4.33Å; I31-I93 HydrophobicContact CG1-CD1 4.29Å; I31-I93 HydrophobicContact CG1-CG1 4.38Å; I31-I93 HydrophobicContact CG1-CG2 3.65Å; V34-I93 HydrophobicContact CG2-CG2 4.39Å; L89-I93 HydrophobicContact CD1-CD1 4.36Å; L89-I93 HydrophobicContact CG-CD1 4.22Å; L89-I93 WeakPolarHBondContact O-CG1 3.47Å; L89-I93 PolarHBondContact O-N 3.23Å; A90-I93 PolarHBondContact O-N 3Å; S91-I93 VanDerWaalsContact C-N 3.35Å; I93-Y95 VanDerWaalsContact C-N 3.32Å; I93-Y95 PolarHBondContact O-N 3.24Å; I93-L96 PolarHBondContact O-N 3.24Å; I93-V97 HydrophobicContact CG2-CG2 4.19Å; I93-V97 WeakPolarHBondContact O-CB 3.31Å; I93-V97 VanDerWaalsContact O-CG2 3.25Å; I93-V97 WeakPolarHBondContact O-CG2 3.4Å; I93-V97 PolarHBondContact O-N 3.48Å
94W97.6Very high94.8Very high29 Ų2959.9 Ų59.911%0.1132%0.315CS..Hα-helixtrans-54.6-49.4172.4164.873.8000111.6V34 P51 C54 W55 S58 A90 S91 L96 V97 F98 Y99V34-W94 HydrophobicContact CG2-CB 4.5Å; P51-W94 HydrophobicContact CB-CH2 4.47Å; P51-W94 WeakPolarHBondContact O-CZ2 3.43Å; C54-W94 PolarHBondContact SG-NE1 3.33Å; W55-W94 HydrophobicContact CB-CD2 4.23Å; W55-W94 HydrophobicContact CB-CE3 4.46Å; W55-W94 HydrophobicContact CB-CH2 4.03Å; W55-W94 HydrophobicContact CB-CZ2 3.78Å; W55-W94 HydrophobicContact CB-CZ3 4.37Å; W55-W94 AromaticContact CD1-CD2 3.8Å; W55-W94 AromaticContact CD1-CE3 3.58Å; W55-W94 AromaticContact CD1-CZ3 3.92Å; W55-W94 HydrophobicContact CG-CD2 4.43Å; W55-W94 HydrophobicContact CG-CE3 4.41Å; S58-W94 PolarHBondContact OG-NE1 2.92Å; A90-W94 WeakPolarHBondContact O-CB 3.31Å; A90-W94 PolarHBondContact O-N 2.81Å; S91-W94 PolarHBondContact O-N 3.36Å; W94-L96 PolarHBondContact O-N 3.04Å; W94-V97 PolarHBondContact O-N 3.15Å; W94-F98 AromaticContact CD1-CD2 3.44Å; W94-F98 VanDerWaalsContact CD1-CD2 3.44Å; W94-F98 AromaticContact CD1-CE2 3.72Å; W94-F98 HydrophobicContact CG-CD2 4.39Å; W94-F98 AromaticContact NE1-CD2 3.65Å; W94-F98 AromaticContact NE1-CE2 3.98Å; W94-F98 WeakPolarHBondContact O-CD2 3.29Å; W94-F98 PolarHBondContact O-N 3.2Å; W94-Y99 AromaticContact CE2-CE2 3.97Å; W94-Y99 AromaticContact CH2-CE2 3.69Å; W94-Y99 HydrophobicContact CH2-CE2 3.69Å; W94-Y99 AromaticContact CZ2-CE2 3.53Å; W94-Y99 HydrophobicContact CZ2-CE2 3.53Å; W94-Y99 HydrophobicContact CZ3-CE2 4.25Å
95Y97.1Very high94.9Very high132 Ų13257.6 Ų57.652%0.51830%0.298SS..Hα-helixtrans-62.1-47.2-179-176.6-96.1000111.6S91 I92 I93 V97 F98 Y99S91-Y95 WeakPolarHBondContact O-CB 3.15Å; S91-Y95 PolarHBondContact O-N 3.19Å; I92-Y95 PolarHBondContact O-N 3.48Å; I93-Y95 VanDerWaalsContact C-N 3.32Å; I93-Y95 PolarHBondContact O-N 3.24Å; Y95-V97 PolarHBondContact O-N 3.48Å; Y95-F98 PolarHBondContact O-N 2.96Å; Y95-Y99 AromaticContact CD2-CD2 3.72Å; Y95-Y99 HydrophobicContact CD2-CD2 3.72Å; Y95-Y99 HydrophobicContact CD2-CE2 4.42Å; Y95-Y99 HydrophobicContact CD2-CG 4.19Å; Y95-Y99 HydrophobicContact CE2-CD2 4.11Å; Y95-Y99 HydrophobicContact CE2-CG 4.11Å; Y95-Y99 HydrophobicContact CG-CD2 4.33Å; Y95-Y99 WeakPolarHBondContact O-CA 3.39Å; Y95-Y99 WeakPolarHBondContact O-CB 3.36Å; Y95-Y99 WeakPolarHBondContact O-CD2 3.45Å; Y95-Y99 PolarHBondContact O-N 2.98Å
96L96.6Very high95Very high70 Ų7055 Ų5537%0.36628%0.279SS..Hα-helixtrans-62.6-42.3177.9-71.6177000112.1I92 I93 W94 C100 V105I92-L96 HydrophobicContact CG2-CD1 3.86Å; I92-L96 HydrophobicContact CG2-CG 4.29Å; I92-L96 WeakPolarHBondContact O-CB 2.89Å; I92-L96 VanDerWaalsContact O-CG 3.29Å; I92-L96 WeakPolarHBondContact O-CG 3.24Å; I92-L96 PolarHBondContact O-N 3.36Å; I93-L96 PolarHBondContact O-N 3.24Å; W94-L96 PolarHBondContact O-N 3.04Å; L96-C100 WeakPolarHBondContact O-CB 3.43Å; L96-C100 PolarHBondContact O-N 3.42Å; L96-V105 HydrophobicContact CB-CG1 4.23Å; L96-V105 HydrophobicContact CB-CG2 4.23Å
97V96.5Very high95.1Very high0 Ų055.9 Ų55.90%029%0.289CS..Hα-helixtrans-70.2-32-179.9171.80000111.8V34 L35 R38 I93 W94 Y95 V105V34-V97 HydrophobicContact CG1-CB 3.77Å; V34-V97 HydrophobicContact CG1-CG1 3.72Å; V34-V97 HydrophobicContact CG1-CG2 4.24Å; L35-V97 HydrophobicContact CD2-CG1 3.94Å; R38-V97 HydrophobicContact CB-CG1 4.43Å; R38-V97 PolarHBondContact NH1-O 3.36Å; I93-V97 HydrophobicContact CG2-CG2 4.19Å; I93-V97 WeakPolarHBondContact O-CB 3.31Å; I93-V97 VanDerWaalsContact O-CG2 3.25Å; I93-V97 WeakPolarHBondContact O-CG2 3.4Å; I93-V97 PolarHBondContact O-N 3.48Å; W94-V97 PolarHBondContact O-N 3.15Å; Y95-V97 PolarHBondContact O-N 3.48Å; V97-V105 HydrophobicContact CG2-CG1 4.14Å
98F95.9Very high95.2Very high5 Ų560.4 Ų60.42%0.02231%0.308CS..Hα-helixtrans-98-27.4-177-84.4-88.1000115.4V34 L37 R38 R48 C54 W94 Y95V34-F98 HydrophobicContact CG1-CD2 3.98Å; V34-F98 HydrophobicContact CG1-CE2 3.69Å; L37-F98 HydrophobicContact CD2-CZ 4.41Å; L37-F98 HydrophobicContact CG-CZ 4.39Å; R38-F98 HydrophobicContact CB-CE1 4.01Å; R38-F98 HydrophobicContact CB-CE2 4.1Å; R38-F98 HydrophobicContact CB-CZ 3.65Å; R38-F98 HydrophobicContact CG-CD1 4.41Å; R38-F98 HydrophobicContact CG-CE1 3.97Å; R38-F98 HydrophobicContact CG-CZ 4.13Å; R48-F98 PolarHBondContact NH2-O 2.79Å; R48-F98 VanDerWaalsContact NH2-O 3.12Å; C54-F98 VanDerWaalsContact SG-CZ 3.6Å; W94-F98 AromaticContact CD1-CD2 3.44Å; W94-F98 VanDerWaalsContact CD1-CD2 3.44Å; W94-F98 AromaticContact CD1-CE2 3.72Å; W94-F98 HydrophobicContact CG-CD2 4.39Å; W94-F98 AromaticContact NE1-CD2 3.65Å; W94-F98 AromaticContact NE1-CE2 3.98Å; W94-F98 WeakPolarHBondContact O-CD2 3.29Å; W94-F98 PolarHBondContact O-N 3.2Å; Y95-F98 PolarHBondContact O-N 2.96Å
99Y95.3Very high95.2Very high44 Ų4455.6 Ų55.617%0.17328%0.283CS..Hα-helixtrans-126.1-1.2-167.6-54.6-87.5000114.5S47 P51 W94 Y95S47-Y99 PolarHBondContact O-OH 3.36Å; P51-Y99 WeakPolarHBondContact CB-OH 3.23Å; W94-Y99 AromaticContact CE2-CE2 3.97Å; W94-Y99 AromaticContact CH2-CE2 3.69Å; W94-Y99 HydrophobicContact CH2-CE2 3.69Å; W94-Y99 AromaticContact CZ2-CE2 3.53Å; W94-Y99 HydrophobicContact CZ2-CE2 3.53Å; W94-Y99 HydrophobicContact CZ3-CE2 4.25Å; Y95-Y99 AromaticContact CD2-CD2 3.72Å; Y95-Y99 HydrophobicContact CD2-CD2 3.72Å; Y95-Y99 HydrophobicContact CD2-CE2 4.42Å; Y95-Y99 HydrophobicContact CD2-CG 4.19Å; Y95-Y99 HydrophobicContact CE2-CD2 4.11Å; Y95-Y99 HydrophobicContact CE2-CG 4.11Å; Y95-Y99 HydrophobicContact CG-CD2 4.33Å; Y95-Y99 WeakPolarHBondContact O-CA 3.39Å; Y95-Y99 WeakPolarHBondContact O-CB 3.36Å; Y95-Y99 WeakPolarHBondContact O-CD2 3.45Å; Y95-Y99 PolarHBondContact O-N 2.98Å
100C94.4Very high95.1Very high20 Ų2056 Ų5614%0.13529%0.286CS..  trans-57.1133.6176.91790000111.2L96 M102 D103 V105L96-C100 WeakPolarHBondContact O-CB 3.43Å; L96-C100 PolarHBondContact O-N 3.42Å; C100-M102 PolarHBondContact O-N 3.48Å; C100-D103 PolarHBondContact O-N 3.05Å; C100-D103 VanDerWaalsContact O-N 3.09Å; C100-V105 HydrophobicContact CB-CB 4.3Å; C100-V105 HydrophobicContact CB-CG2 4.14Å
101P91.6Very high95Very high100 Ų10060.3 Ų60.365%0.64931%0.309SS*.G310 helixtrans-57.9141.9179.125.4-35.4000110.5D103 L104P101-D103 PolarHBondContact O-N 3.27Å; P101-L104 WeakPolarHBondContact O-CG 3.46Å; P101-L104 PolarHBondContact O-N 3.39Å
102M90.6Very high94.9Very high169 Ų16963.9 Ų63.983%0.83333%0.325SS*.G310 helixtrans57.615.3-177.1-57.3-63.4-69.500114.7C100 L104C100-M102 PolarHBondContact O-N 3.48Å; M102-L104 HydrophobicContact CB-CD2 4.37Å; M102-L104 HydrophobicContact CB-CG 4.15Å; M102-L104 PolarHBondContact O-N 2.92Å; M102-L104 VanDerWaalsContact O-N 3.14Å
103D92Very high94.8Very high57 Ų5764.1 Ų64.131%0.30533%0.332SS..G310 helixtrans52.833-177.8-85.6-32.6000113.5R38 C100 P101 V105 Y106 S107R38-D103 IonicContact CZ-OD1 3.84Å; R38-D103 IonicContact CZ-OD2 2.78Å; R38-D103 IonicContact NH1-OD1 2.83Å; R38-D103 PolarHBondContact NH1-OD1 3.37Å; R38-D103 IonicContact NH1-OD2 3.74Å; R38-D103 IonicContact NH2-OD1 3.64Å; R38-D103 PolarHBondContact NH2-OD1 3.19Å; R38-D103 VanDerWaalsContact NH2-OD1 3.12Å; R38-D103 IonicContact NH2-OD2 2.86Å; R38-D103 PolarHBondContact NH2-OD2 3.16Å; C100-D103 PolarHBondContact O-N 3.05Å; C100-D103 VanDerWaalsContact O-N 3.09Å; P101-D103 PolarHBondContact O-N 3.27Å; D103-V105 PolarHBondContact O-N 2.94Å; D103-Y106 PolarHBondContact O-N 2.87Å; D103-S107 VanDerWaalsContact O-CB 3.32Å; D103-S107 WeakPolarHBondContact O-CB 3.32Å; D103-S107 PolarHBondContact O-N 3.15Å; D103-S107 PolarHBondContact O-OG 3.33Å
104L93.7Very high94.7Very high109 Ų10965 Ų6557%0.57134%0.338SS*.Hα-helixtrans-59.1-47.8-174.3-68.6172.8000112.5P101 M102 Y106 S107 F108P101-L104 WeakPolarHBondContact O-CG 3.46Å; P101-L104 PolarHBondContact O-N 3.39Å; M102-L104 HydrophobicContact CB-CD2 4.37Å; M102-L104 HydrophobicContact CB-CG 4.15Å; M102-L104 PolarHBondContact O-N 2.92Å; M102-L104 VanDerWaalsContact O-N 3.14Å; L104-Y106 PolarHBondContact O-N 3.34Å; L104-S107 PolarHBondContact O-N 2.72Å; L104-F108 VanDerWaalsContact O-CB 3.28Å; L104-F108 WeakPolarHBondContact O-CB 3.4Å; L104-F108 PolarHBondContact O-N 3.24Å
105V94.3Very high94.6Very high39 Ų3967.4 Ų67.424%0.23635%0.347CS..Hα-helixtrans-64.7-42.6-178.41730000111.1L96 V97 C100 D103 T109L96-V105 HydrophobicContact CB-CG1 4.23Å; L96-V105 HydrophobicContact CB-CG2 4.23Å; V97-V105 HydrophobicContact CG2-CG1 4.14Å; C100-V105 HydrophobicContact CB-CB 4.3Å; C100-V105 HydrophobicContact CB-CG2 4.14Å; D103-V105 PolarHBondContact O-N 2.94Å; V105-T109 HydrophobicContact CG1-CG2 4.39Å; V105-T109 WeakPolarHBondContact O-CB 3.44Å; V105-T109 VanDerWaalsContact O-CG2 3.22Å; V105-T109 WeakPolarHBondContact O-CG2 3.26Å; V105-T109 PolarHBondContact O-N 3.26Å; V105-T109 PolarHBondContact O-OG1 3.13Å
106Y94.6Very high94.6Very high60 Ų6062.1 Ų62.124%0.23533%0.329CS..Hα-helixtrans-64.3-47.9175.7173.3-102.5000111.6L35 R38 D103 L104 F108 T109 T110L35-Y106 HydrophobicContact CD2-CD2 3.42Å; L35-Y106 VanDerWaalsContact CD2-CD2 3.42Å; L35-Y106 HydrophobicContact CD2-CE2 3.79Å; R38-Y106 HydrophobicContact CG-CE2 4.38Å; R38-Y106 VanDerWaalsContact NH1-CG 3.33Å; D103-Y106 PolarHBondContact O-N 2.87Å; L104-Y106 PolarHBondContact O-N 3.34Å; Y106-F108 VanDerWaalsContact C-N 3.34Å; Y106-F108 PolarHBondContact O-N 2.9Å; Y106-T109 PolarHBondContact O-N 3.09Å; Y106-T109 PolarHBondContact O-OG1 3.1Å; Y106-T110 HydrophobicContact CD2-CG2 3.94Å; Y106-T110 HydrophobicContact CE1-CG2 4.19Å; Y106-T110 HydrophobicContact CE2-CG2 3.56Å; Y106-T110 HydrophobicContact CG-CG2 4.4Å; Y106-T110 WeakPolarHBondContact O-CB 3.5Å; Y106-T110 VanDerWaalsContact O-CG2 3.28Å; Y106-T110 WeakPolarHBondContact O-CG2 3.47Å; Y106-T110 PolarHBondContact O-N 3.43Å; Y106-T110 PolarHBondContact O-OG1 3.06Å
107S94.8Very high94.6Very high58 Ų5862.8 Ų62.841%0.40634%0.336SS..Hα-helixtrans-60.1-44.2179.4-57.50000111.5D103 L104 T110 L111D103-S107 VanDerWaalsContact O-CB 3.32Å; D103-S107 WeakPolarHBondContact O-CB 3.32Å; D103-S107 PolarHBondContact O-N 3.15Å; D103-S107 PolarHBondContact O-OG 3.33Å; L104-S107 PolarHBondContact O-N 2.72Å; S107-T110 WeakPolarHBondContact CA-OG1 3.5Å; S107-T110 PolarHBondContact O-OG1 3.26Å; S107-L111 WeakPolarHBondContact O-CG 3.47Å; S107-L111 PolarHBondContact O-N 3.43Å
108F95.6Very high94.6Very high124 Ų12463.8 Ų63.854%0.54434%0.341SS..Hα-helixtrans-64-46.8176.8176.3-106.3000112.7L104 Y106 T110 L111 V114L104-F108 VanDerWaalsContact O-CB 3.28Å; L104-F108 WeakPolarHBondContact O-CB 3.4Å; L104-F108 PolarHBondContact O-N 3.24Å; Y106-F108 VanDerWaalsContact C-N 3.34Å; Y106-F108 PolarHBondContact O-N 2.9Å; F108-T110 VanDerWaalsContact C-N 3.28Å; F108-T110 PolarHBondContact O-N 3.39Å; F108-L111 HydrophobicContact CD2-CD1 4.13Å; F108-L111 WeakPolarHBondContact O-CB 3.31Å; F108-L111 WeakPolarHBondContact O-CG 3.47Å; F108-L111 PolarHBondContact O-N 3.31Å; F108-V114 HydrophobicContact CD1-CG1 4.29Å; F108-V114 HydrophobicContact CD2-CG2 4.49Å; F108-V114 HydrophobicContact CE1-CG1 3.89Å; F108-V114 HydrophobicContact CE1-CG2 4.44Å; F108-V114 HydrophobicContact CE2-CG2 3.96Å; F108-V114 HydrophobicContact CZ-CG1 4.18Å; F108-V114 HydrophobicContact CZ-CG2 3.93Å
109T94.3Very high94.6Very high4 Ų463.9 Ų63.93%0.02534%0.342CS..Hα-helixtrans-75.4-17.3-176.255.20000113.5I31 V105 Y106 R115 L118I31-T109 HydrophobicContact CG2-CG2 3.75Å; V105-T109 HydrophobicContact CG1-CG2 4.39Å; V105-T109 WeakPolarHBondContact O-CB 3.44Å; V105-T109 VanDerWaalsContact O-CG2 3.22Å; V105-T109 WeakPolarHBondContact O-CG2 3.26Å; V105-T109 PolarHBondContact O-N 3.26Å; V105-T109 PolarHBondContact O-OG1 3.13Å; Y106-T109 PolarHBondContact O-N 3.09Å; Y106-T109 PolarHBondContact O-OG1 3.1Å; T109-R115 WeakPolarHBondContact O-CB 3.46Å; T109-L118 HydrophobicContact CG2-CD1 4.05Å
110T93.4Very high94.7Very high38 Ų3862.7 Ų62.723%0.23334%0.342CS..Hα-helixtrans-87.1-13.4173.4510000113.7L35 Y106 S107 F108 L112L35-T110 HydrophobicContact CD2-CG2 4.31Å; Y106-T110 HydrophobicContact CD2-CG2 3.94Å; Y106-T110 HydrophobicContact CE1-CG2 4.19Å; Y106-T110 HydrophobicContact CE2-CG2 3.56Å; Y106-T110 HydrophobicContact CG-CG2 4.4Å; Y106-T110 WeakPolarHBondContact O-CB 3.5Å; Y106-T110 VanDerWaalsContact O-CG2 3.28Å; Y106-T110 WeakPolarHBondContact O-CG2 3.47Å; Y106-T110 PolarHBondContact O-N 3.43Å; Y106-T110 PolarHBondContact O-OG1 3.06Å; S107-T110 WeakPolarHBondContact CA-OG1 3.5Å; S107-T110 PolarHBondContact O-OG1 3.26Å; F108-T110 VanDerWaalsContact C-N 3.28Å; F108-T110 PolarHBondContact O-N 3.39Å; T110-L112 PolarHBondContact O-N 2.97Å
111L95.7Very high94.8Very high91 Ų9163.9 Ų63.948%0.47635%0.345SS..SBendtrans-53.9126.7169.8-66176.5000109.4S107 F108 V114 R115S107-L111 WeakPolarHBondContact O-CG 3.47Å; S107-L111 PolarHBondContact O-N 3.43Å; F108-L111 HydrophobicContact CD2-CD1 4.13Å; F108-L111 WeakPolarHBondContact O-CB 3.31Å; F108-L111 WeakPolarHBondContact O-CG 3.47Å; F108-L111 PolarHBondContact O-N 3.31Å; L111-V114 HydrophobicContact CB-CB 4.32Å; L111-V114 HydrophobicContact CB-CG2 4.15Å; L111-V114 PolarHBondContact O-N 3.28Å; L111-R115 WeakPolarHBondContact O-CB 3.19Å; L111-R115 PolarHBondContact O-N 2.73Å
112L93.8Very high95Very high99 Ų9960.9 Ų60.952%0.51832%0.322SS..Hα-helixtrans-48.2-50.2-174-173.7142.9000114.5T110 V114 R115 V116 L229T110-L112 PolarHBondContact O-N 2.97Å; L112-V114 VanDerWaalsContact C-N 3.35Å; L112-V114 PolarHBondContact O-N 3.21Å; L112-R115 PolarHBondContact O-N 3.16Å; L112-V116 HydrophobicContact CD2-CG2 4.34Å; L112-V116 HydrophobicContact CG-CG2 4.49Å; L112-V116 WeakPolarHBondContact O-CB 3.37Å; L112-V116 VanDerWaalsContact O-CG2 3.24Å; L112-V116 WeakPolarHBondContact O-CG2 3.15Å; L112-V116 PolarHBondContact O-N 2.71Å; L112-L229 HydrophobicContact CD2-CD2 3.97Å
113P95.1Very high95.3Very high87 Ų8752.9 Ų52.957%0.56528%0.283SS*.Hα-helixtrans-62.4-41.3179.723.3-33.8000112.6V116 V117P113-V116 PolarHBondContact O-N 3.15Å; P113-V117 WeakPolarHBondContact O-CG2 3.34Å; P113-V117 PolarHBondContact O-N 2.9Å; P113-V117 VanDerWaalsContact O-N 3.15Å
114V96.6Very high95.5Very high31 Ų3151 Ų5119%0.18827%0.273CS..Hα-helixtrans-66.4-47.2178.1-179.60000110.2F108 L111 L112 V116 V117 L118F108-V114 HydrophobicContact CD1-CG1 4.29Å; F108-V114 HydrophobicContact CD2-CG2 4.49Å; F108-V114 HydrophobicContact CE1-CG1 3.89Å; F108-V114 HydrophobicContact CE1-CG2 4.44Å; F108-V114 HydrophobicContact CE2-CG2 3.96Å; F108-V114 HydrophobicContact CZ-CG1 4.18Å; F108-V114 HydrophobicContact CZ-CG2 3.93Å; L111-V114 HydrophobicContact CB-CB 4.32Å; L111-V114 HydrophobicContact CB-CG2 4.15Å; L111-V114 PolarHBondContact O-N 3.28Å; L112-V114 VanDerWaalsContact C-N 3.35Å; L112-V114 PolarHBondContact O-N 3.21Å; V114-V116 VanDerWaalsContact C-N 3.28Å; V114-V116 PolarHBondContact O-N 3.14Å; V114-V117 PolarHBondContact O-N 2.9Å; V114-L118 HydrophobicContact CG1-CD1 3.83Å; V114-L118 HydrophobicContact CG1-CG 4.27Å; V114-L118 VanDerWaalsContact O-CG 3.31Å; V114-L118 WeakPolarHBondContact O-CG 3.35Å; V114-L118 PolarHBondContact O-N 2.68Å
115R95.6Very high95.6Very high78 Ų7845.8 Ų45.829%0.29425%0.246SC..Hα-helixtrans-60.4-38.3179.8-160.9-174173141.66.4111.9E39 T109 L111 L112 S119 M228E39-R115 VanDerWaalsContact CD-NH2 3.32Å; E39-R115 IonicContact OE1-CZ 2.62Å; E39-R115 VanDerWaalsContact OE1-CZ 3.26Å; E39-R115 IonicContact OE1-NH1 2.71Å; E39-R115 PolarHBondContact OE1-NH1 3.03Å; E39-R115 IonicContact OE1-NH2 2.73Å; E39-R115 PolarHBondContact OE1-NH2 2.95Å; E39-R115 IonicContact OE2-CZ 3.05Å; E39-R115 IonicContact OE2-NH1 2.69Å; E39-R115 IonicContact OE2-NH2 3.92Å; E39-R115 PolarHBondContact OE2-NH2 3.22Å; T109-R115 WeakPolarHBondContact O-CB 3.46Å; L111-R115 WeakPolarHBondContact O-CB 3.19Å; L111-R115 PolarHBondContact O-N 2.73Å; L112-R115 PolarHBondContact O-N 3.16Å; R115-S119 VanDerWaalsContact O-CB 3.23Å; R115-S119 WeakPolarHBondContact O-CB 3.49Å; R115-S119 PolarHBondContact O-N 3.47Å; R115-S119 PolarHBondContact O-OG 3.41Å; R115-M228 HydrophobicContact CB-CE 3.99Å; R115-M228 HydrophobicContact CG-CE 3.65Å
116V96.3Very high95.7Very high21 Ų2144.8 Ų44.813%0.12724%0.238CC..Hα-helixtrans-64-49.6175.5165.40000110.6L112 P113 V114 L118 S119 A120 T225 M228L112-V116 HydrophobicContact CD2-CG2 4.34Å; L112-V116 HydrophobicContact CG-CG2 4.49Å; L112-V116 WeakPolarHBondContact O-CB 3.37Å; L112-V116 VanDerWaalsContact O-CG2 3.24Å; L112-V116 WeakPolarHBondContact O-CG2 3.15Å; L112-V116 PolarHBondContact O-N 2.71Å; P113-V116 PolarHBondContact O-N 3.15Å; V114-V116 VanDerWaalsContact C-N 3.28Å; V114-V116 PolarHBondContact O-N 3.14Å; V116-L118 PolarHBondContact O-N 2.96Å; V116-S119 PolarHBondContact O-N 2.93Å; V116-A120 WeakPolarHBondContact O-CB 3.42Å; V116-A120 PolarHBondContact O-N 3.3Å; V116-T225 HydrophobicContact CG1-CG2 3.56Å; V116-M228 HydrophobicContact CG2-CB 4.13Å; V116-M228 HydrophobicContact CG2-CE 3.89Å; V116-M228 HydrophobicContact CG2-SD 4.31Å
117V96.9Very high95.8Very high85 Ų8542 Ų4252%0.51523%0.227SC..Hα-helixtrans-60.4-48178.6172.40000111.2P113 V114 S119 A120 M121P113-V117 WeakPolarHBondContact O-CG2 3.34Å; P113-V117 PolarHBondContact O-N 2.9Å; P113-V117 VanDerWaalsContact O-N 3.15Å; V114-V117 PolarHBondContact O-N 2.9Å; V117-S119 VanDerWaalsContact C-N 3.29Å; V117-S119 PolarHBondContact O-N 3Å; V117-A120 WeakPolarHBondContact O-CB 3.26Å; V117-A120 PolarHBondContact O-N 3.39Å; V117-M121 HydrophobicContact CG1-SD 4.18Å; V117-M121 WeakPolarHBondContact O-CG 3.43Å; V117-M121 PolarHBondContact O-N 2.67Å
118L97Very high95.8Very high21 Ų2142.5 Ų42.511%0.1122%0.22CC..Hα-helixtrans-61.1-39.6178-67.8171.9000112A28 I31 V32 T109 V114 V116 M121 K122A28-L118 HydrophobicContact CB-CD2 3.9Å; I31-L118 HydrophobicContact CD1-CD2 4.35Å; I31-L118 HydrophobicContact CG2-CD1 3.84Å; V32-L118 HydrophobicContact CG2-CB 3.62Å; T109-L118 HydrophobicContact CG2-CD1 4.05Å; V114-L118 HydrophobicContact CG1-CD1 3.83Å; V114-L118 HydrophobicContact CG1-CG 4.27Å; V114-L118 VanDerWaalsContact O-CG 3.31Å; V114-L118 WeakPolarHBondContact O-CG 3.35Å; V114-L118 PolarHBondContact O-N 2.68Å; V116-L118 PolarHBondContact O-N 2.96Å; L118-M121 PolarHBondContact O-N 3.27Å; L118-K122 PolarHBondContact O-N 3.22Å
119S95.9Very high95.8Very high6 Ų639 Ų394%0.04221%0.205CC..Hα-helixtrans-67.9-40.1177-62.20000111.6R115 V116 V117 K122 E123 M228R115-S119 VanDerWaalsContact O-CB 3.23Å; R115-S119 WeakPolarHBondContact O-CB 3.49Å; R115-S119 PolarHBondContact O-N 3.47Å; R115-S119 PolarHBondContact O-OG 3.41Å; V116-S119 PolarHBondContact O-N 2.93Å; V117-S119 VanDerWaalsContact C-N 3.29Å; V117-S119 PolarHBondContact O-N 3Å; S119-K122 PolarHBondContact O-N 2.86Å; S119-E123 WeakPolarHBondContact O-CG 3.49Å; S119-E123 PolarHBondContact O-N 2.99Å; S119-M228 WeakPolarHBondContact CB-SD 3.16Å; S119-M228 PolarHBondContact OG-SD 2.88Å; S119-M228 VanDerWaalsContact OG-SD 3.34Å
120A96.3Very high96Very high20 Ų2038.9 Ų38.917%0.16520%0.204CC..Hα-helixtrans-60.3-47.9174.300000111.3V116 V117 K122 E123 V124 V221V116-A120 WeakPolarHBondContact O-CB 3.42Å; V116-A120 PolarHBondContact O-N 3.3Å; V117-A120 WeakPolarHBondContact O-CB 3.26Å; V117-A120 PolarHBondContact O-N 3.39Å; A120-K122 VanDerWaalsContact C-N 3.3Å; A120-K122 PolarHBondContact O-N 3.44Å; A120-E123 PolarHBondContact O-N 3.05Å; A120-E123 VanDerWaalsContact O-N 3.1Å; A120-V124 PolarHBondContact O-N 3.25Å; A120-V124 VanDerWaalsContact O-N 3.15Å; A120-V221 HydrophobicContact CB-CG1 3.79Å
121M96.9Very high96.1Very high44 Ų4437.5 Ų37.522%0.21720%0.195CC..Hα-helixtrans-58.3-41.8175.2-67.7175.274.200111.8Y24 F25 A28 V117 L118 E123 V124 T125Y24-M121 WeakPolarHBondContact O-CE 3.42Å; F25-M121 HydrophobicContact CD1-CB 3.88Å; F25-M121 HydrophobicContact CD1-CE 4.21Å; F25-M121 HydrophobicContact CD1-CG 4.27Å; F25-M121 HydrophobicContact CE1-CB 4.08Å; F25-M121 HydrophobicContact CE1-CE 4.36Å; F25-M121 HydrophobicContact CE1-CG 4.05Å; F25-M121 HydrophobicContact CG-CE 4.3Å; A28-M121 HydrophobicContact CB-CB 3.54Å; A28-M121 HydrophobicContact CB-CE 4.02Å; A28-M121 HydrophobicContact CB-CG 4.37Å; A28-M121 HydrophobicContact CB-SD 3.97Å; V117-M121 HydrophobicContact CG1-SD 4.18Å; V117-M121 WeakPolarHBondContact O-CG 3.43Å; V117-M121 PolarHBondContact O-N 2.67Å; L118-M121 PolarHBondContact O-N 3.27Å; M121-E123 VanDerWaalsContact C-N 3.32Å; M121-E123 PolarHBondContact O-N 3.06Å; M121-V124 WeakPolarHBondContact O-CB 3.29Å; M121-V124 PolarHBondContact O-N 3.11Å; M121-V124 VanDerWaalsContact O-N 3.16Å; M121-T125 PolarHBondContact O-N 2.93Å; M121-T125 PolarHBondContact O-OG1 3.49Å
122K95.8Very high96Very high37 Ų3734.7 Ų34.716%0.16119%0.188CC..Hα-helixtrans-61.5-36.8175.5174.7171.1173.51670113V32 S33 L118 S119 A120 V124 T125 R126V32-K122 HydrophobicContact CB-CD 3.7Å; V32-K122 HydrophobicContact CG1-CD 3.55Å; S33-K122 PolarHBondContact OG-NZ 3.11Å; L118-K122 PolarHBondContact O-N 3.22Å; S119-K122 PolarHBondContact O-N 2.86Å; A120-K122 VanDerWaalsContact C-N 3.3Å; A120-K122 PolarHBondContact O-N 3.44Å; K122-V124 VanDerWaalsContact C-N 3.34Å; K122-T125 PolarHBondContact O-N 3.14Å; K122-R126 WeakPolarHBondContact O-CB 3.43Å; K122-R126 PolarHBondContact O-N 2.85Å
123E96.3Very high96.1Very high2 Ų230 Ų301%0.00916%0.164CC..Hα-helixtrans-68.6-33.1175.8-62.3-59.5134.200112S119 A120 M121 R126 T127 V221 K224S119-E123 WeakPolarHBondContact O-CG 3.49Å; S119-E123 PolarHBondContact O-N 2.99Å; A120-E123 PolarHBondContact O-N 3.05Å; A120-E123 VanDerWaalsContact O-N 3.1Å; M121-E123 VanDerWaalsContact C-N 3.32Å; M121-E123 PolarHBondContact O-N 3.06Å; E123-R126 VanDerWaalsContact CD-NH1 3.33Å; E123-R126 WeakPolarHBondContact O-CB 3.33Å; E123-R126 PolarHBondContact O-N 2.72Å; E123-R126 IonicContact OE1-CZ 3.41Å; E123-R126 IonicContact OE1-NH1 3.12Å; E123-R126 PolarHBondContact OE1-NH1 3.15Å; E123-R126 VanDerWaalsContact OE1-NH1 3.16Å; E123-R126 IonicContact OE1-NH2 3.97Å; E123-R126 PolarHBondContact OE1-NH2 3.42Å; E123-R126 IonicContact OE2-CZ 3.84Å; E123-R126 IonicContact OE2-NE 3.51Å; E123-R126 IonicContact OE2-NH1 2.74Å; E123-R126 PolarHBondContact OE2-NH1 3.21Å; E123-R126 IonicContact OE2-NH2 3.06Å; E123-T127 PolarHBondContact O-N 2.96Å; E123-T127 VanDerWaalsContact O-N 3.13Å; E123-T127 PolarHBondContact O-OG1 3.1Å; E123-V221 HydrophobicContact CB-CG2 4Å; E123-K224 HydrophobicContact CG-CB 3.76Å; E123-K224 HydrophobicContact CG-CD 4.49Å; E123-K224 HydrophobicContact CG-CG 3.73Å
124V96.4Very high96.1Very high16 Ų1625.9 Ų25.910%0.09714%0.137CC..Hα-helixtrans-60.3-51.9169.3-179.50000110.1L16 M21 F25 A120 M121 K122 R126 T127 W128 T217 V221L16-V124 HydrophobicContact CD1-CG1 4.04Å; M21-V124 HydrophobicContact CE-CG1 4.37Å; F25-V124 HydrophobicContact CD1-CB 3.99Å; F25-V124 HydrophobicContact CD1-CG1 4.09Å; F25-V124 HydrophobicContact CE1-CB 3.82Å; F25-V124 HydrophobicContact CE1-CG1 3.83Å; F25-V124 HydrophobicContact CE1-CG2 4.06Å; A120-V124 PolarHBondContact O-N 3.25Å; A120-V124 VanDerWaalsContact O-N 3.15Å; M121-V124 WeakPolarHBondContact O-CB 3.29Å; M121-V124 PolarHBondContact O-N 3.11Å; M121-V124 VanDerWaalsContact O-N 3.16Å; K122-V124 VanDerWaalsContact C-N 3.34Å; V124-R126 PolarHBondContact O-N 3.01Å; V124-T127 WeakPolarHBondContact O-CB 3.35Å; V124-T127 PolarHBondContact O-N 2.99Å; V124-T127 VanDerWaalsContact O-N 3.09Å; V124-W128 PolarHBondContact O-N 3.49Å; V124-T217 HydrophobicContact CB-CG2 4.26Å; V124-T217 HydrophobicContact CG1-CG2 4.35Å; V124-T217 HydrophobicContact CG2-CG2 3.74Å; V124-V221 HydrophobicContact CG2-CG2 4.11Å
125T95.7Very high96Very high1 Ų125.9 Ų25.91%0.00614%0.137CC..Hα-helixtrans-57.8-37.6177.1-49.30000112.4F25 E26 H29 M121 K122 W128 K129F25-T125 PolarHBondContact O-OG1 2.86Å; E26-T125 VanDerWaalsContact OE1-CG2 3.3Å; E26-T125 WeakPolarHBondContact OE1-CG2 3.48Å; H29-T125 HydrophobicContact CB-CG2 4.19Å; M121-T125 PolarHBondContact O-N 2.93Å; M121-T125 PolarHBondContact O-OG1 3.49Å; K122-T125 PolarHBondContact O-N 3.14Å; T125-W128 PolarHBondContact O-N 3.46Å; T125-K129 HydrophobicContact CG2-CD 4.06Å; T125-K129 HydrophobicContact CG2-CG 4.46Å; T125-K129 WeakPolarHBondContact O-CG 3.22Å; T125-K129 PolarHBondContact O-N 3.38Å
126R96.3Very high95.9Very high18 Ų1824.6 Ų24.67%0.06814%0.135CC..Hα-helixtrans-60.7-45.4176.5174-174.6-75.9153.235111.4K122 E123 V124 W128 K129 I130 T190K122-R126 WeakPolarHBondContact O-CB 3.43Å; K122-R126 PolarHBondContact O-N 2.85Å; E123-R126 VanDerWaalsContact CD-NH1 3.33Å; E123-R126 WeakPolarHBondContact O-CB 3.33Å; E123-R126 PolarHBondContact O-N 2.72Å; E123-R126 IonicContact OE1-CZ 3.41Å; E123-R126 IonicContact OE1-NH1 3.12Å; E123-R126 PolarHBondContact OE1-NH1 3.15Å; E123-R126 VanDerWaalsContact OE1-NH1 3.16Å; E123-R126 IonicContact OE1-NH2 3.97Å; E123-R126 PolarHBondContact OE1-NH2 3.42Å; E123-R126 IonicContact OE2-CZ 3.84Å; E123-R126 IonicContact OE2-NE 3.51Å; E123-R126 IonicContact OE2-NH1 2.74Å; E123-R126 PolarHBondContact OE2-NH1 3.21Å; E123-R126 IonicContact OE2-NH2 3.06Å; V124-R126 PolarHBondContact O-N 3.01Å; R126-W128 VanDerWaalsContact C-N 3.31Å; R126-W128 PolarHBondContact O-N 3.11Å; R126-K129 PolarHBondContact O-N 3.1Å; R126-K129 VanDerWaalsContact O-N 3.15Å; R126-I130 HydrophobicContact CG-CD1 3.84Å; R126-I130 HydrophobicContact CG-CG1 4.31Å; R126-I130 VanDerWaalsContact O-CG1 3.32Å; R126-I130 WeakPolarHBondContact O-CG1 3.43Å; R126-I130 PolarHBondContact O-N 2.98Å; R126-T190 HydrophobicContact CG-CG2 3.88Å
127T96.6Very high95.8Very high0 Ų023.6 Ų23.60%013%0.13CC..Hα-helixtrans-57.9-47178.7-590000111.1E123 V124 K129 I130 L131 F197 M213 Y216 T217E123-T127 PolarHBondContact O-N 2.96Å; E123-T127 VanDerWaalsContact O-N 3.13Å; E123-T127 PolarHBondContact O-OG1 3.1Å; V124-T127 WeakPolarHBondContact O-CB 3.35Å; V124-T127 PolarHBondContact O-N 2.99Å; V124-T127 VanDerWaalsContact O-N 3.09Å; T127-K129 VanDerWaalsContact C-N 3.35Å; T127-K129 PolarHBondContact O-N 3.27Å; T127-I130 PolarHBondContact O-N 3.42Å; T127-L131 WeakPolarHBondContact O-CB 3.32Å; T127-L131 PolarHBondContact O-N 3.1Å; T127-F197 HydrophobicContact CG2-CE2 4.01Å; T127-F197 HydrophobicContact CG2-CZ 3.78Å; T127-M213 HydrophobicContact CG2-CG 3.87Å; T127-Y216 HydrophobicContact CG2-CD1 3.57Å; T127-Y216 HydrophobicContact CG2-CE1 4.1Å; T127-Y216 VanDerWaalsContact OG1-CD1 3.32Å; T127-Y216 WeakPolarHBondContact OG1-CD1 3.3Å; T127-Y216 WeakPolarHBondContact OG1-CE1 3.35Å; T127-T217 WeakPolarHBondContact CG2-OG1 3.02Å; T127-T217 PolarHBondContact OG1-OG1 3.29Å
128W95.7Very high95.6Very high69 Ų6921.1 Ų21.126%0.26111%0.113SC..Hα-helixtrans-58.9-42.8174.8-83.688.2000113L16 A17 L19 M21 V124 T125 R126 G132 M213L16-W128 WeakPolarHBondContact O-CZ2 3.23Å; A17-W128 WeakPolarHBondContact O-CH2 3.24Å; A17-W128 VanDerWaalsContact O-CZ2 3.24Å; A17-W128 WeakPolarHBondContact O-CZ2 3.35Å; L19-W128 HydrophobicContact CB-CZ2 4.42Å; M21-W128 HydrophobicContact CE-CD2 4.27Å; M21-W128 HydrophobicContact CE-CG 4.23Å; M21-W128 HydrophobicContact CE-CZ2 4.17Å; M21-W128 HydrophobicContact CG-CB 4.47Å; M21-W128 HydrophobicContact CG-CD2 4.24Å; M21-W128 HydrophobicContact CG-CG 4.19Å; M21-W128 HydrophobicContact SD-CB 4.27Å; M21-W128 HydrophobicContact SD-CD2 4.29Å; M21-W128 HydrophobicContact SD-CG 3.83Å; V124-W128 PolarHBondContact O-N 3.49Å; T125-W128 PolarHBondContact O-N 3.46Å; R126-W128 VanDerWaalsContact C-N 3.31Å; R126-W128 PolarHBondContact O-N 3.11Å; W128-G132 PolarHBondContact O-N 3.45Å; W128-M213 HydrophobicContact CD2-CE 4.46Å
129K95.8Very high95.4Very high52 Ų5226.3 Ų26.323%0.22614%0.141CC..Hα-helixtrans-65.7-41.2177.7-74.8176.4177.7171.80112.5E26 H29 T125 R126 T127 G133 R155E26-K129 IonicContact OE1-NZ 2.75Å; E26-K129 IonicContact OE2-NZ 3.79Å; H29-K129 PolarHBondContact CD2-NZ 3.01Å; H29-K129 PolarHBondContact NE2-NZ 3.4Å; H29-K129 VanDerWaalsContact NE2-NZ 3.18Å; T125-K129 HydrophobicContact CG2-CD 4.06Å; T125-K129 HydrophobicContact CG2-CG 4.46Å; T125-K129 WeakPolarHBondContact O-CG 3.22Å; T125-K129 PolarHBondContact O-N 3.38Å; R126-K129 PolarHBondContact O-N 3.1Å; R126-K129 VanDerWaalsContact O-N 3.15Å; T127-K129 VanDerWaalsContact C-N 3.35Å; T127-K129 PolarHBondContact O-N 3.27Å; K129-G133 PolarHBondContact O-N 3.29Å; K129-R155 WeakPolarHBondContact O-CB 3.4Å
130I97.3Very high95.2Very high0 Ų030.2 Ų30.20%016%0.157CC..Hα-helixtrans-61.9-54.3175.9-64.7163.4000109.3R126 T127 G132 G133 V134 T190 A194 F197 Y216R126-I130 HydrophobicContact CG-CD1 3.84Å; R126-I130 HydrophobicContact CG-CG1 4.31Å; R126-I130 VanDerWaalsContact O-CG1 3.32Å; R126-I130 WeakPolarHBondContact O-CG1 3.43Å; R126-I130 PolarHBondContact O-N 2.98Å; T127-I130 PolarHBondContact O-N 3.42Å; I130-G132 VanDerWaalsContact C-N 3.35Å; I130-G132 PolarHBondContact O-N 3.48Å; I130-G133 WeakPolarHBondContact O-CA 3.15Å; I130-G133 PolarHBondContact O-N 2.96Å; I130-V134 HydrophobicContact CG2-CG2 4.38Å; I130-V134 WeakPolarHBondContact O-CG2 3.3Å; I130-V134 PolarHBondContact O-N 2.98Å; I130-T190 HydrophobicContact CD1-CG2 4.03Å; I130-A194 HydrophobicContact CG2-CB 4.09Å; I130-F197 HydrophobicContact CG2-CD2 3.84Å; I130-F197 HydrophobicContact CG2-CE2 4.44Å; I130-Y216 HydrophobicContact CD1-CE1 4.03Å; I130-Y216 WeakPolarHBondContact CD1-OH 3.49Å
131L95.8Very high94.7Very high10 Ų1033.6 Ų33.65%0.05217%0.166CC..Hα-helixtrans-59.4-46.3-177.8-173.360.5000111.6T127 G133 V134 T135 F197 K209 M213T127-L131 WeakPolarHBondContact O-CB 3.32Å; T127-L131 PolarHBondContact O-N 3.1Å; L131-G133 PolarHBondContact O-N 3.32Å; L131-V134 PolarHBondContact O-N 3.47Å; L131-V134 VanDerWaalsContact O-N 3.14Å; L131-T135 HydrophobicContact CD1-CG2 4.46Å; L131-T135 HydrophobicContact CG-CG2 4.47Å; L131-T135 WeakPolarHBondContact O-CG2 3.3Å; L131-T135 PolarHBondContact O-N 3.27Å; L131-T135 PolarHBondContact O-OG1 2.92Å; L131-F197 HydrophobicContact CD1-CB 4.02Å; L131-F197 HydrophobicContact CD1-CD1 3.54Å; L131-F197 HydrophobicContact CD1-CE1 4.12Å; L131-F197 HydrophobicContact CD1-CG 3.8Å; L131-K209 HydrophobicContact CD1-CG 4.48Å; L131-K209 HydrophobicContact CD2-CG 4.34Å; L131-M213 HydrophobicContact CD2-CE 3.13Å
132G94.7Very high93.8Very high32 Ų3239 Ų3933%0.3319%0.191SC..Hα-helixtrans-61.2-30175.900000113.4W128 I130 T135 L136W128-G132 PolarHBondContact O-N 3.45Å; I130-G132 VanDerWaalsContact C-N 3.35Å; I130-G132 PolarHBondContact O-N 3.48Å; G132-T135 WeakPolarHBondContact CA-OG1 3.4Å; G132-T135 PolarHBondContact O-OG1 2.94Å; G132-T135 VanDerWaalsContact O-OG1 3.1Å; G132-L136 WeakPolarHBondContact O-CB 3.46Å; G132-L136 PolarHBondContact O-N 2.89Å; G132-L136 VanDerWaalsContact O-N 3.09Å
133G95.3Very high92.6Very high0 Ų042 Ų420%021%0.209CC..Hα-helixtrans-71.7-43.5172.300000113.1K129 I130 L131 L136 A137 I151K129-G133 PolarHBondContact O-N 3.29Å; I130-G133 WeakPolarHBondContact O-CA 3.15Å; I130-G133 PolarHBondContact O-N 2.96Å; L131-G133 PolarHBondContact O-N 3.32Å; G133-L136 PolarHBondContact O-N 3.41Å; G133-A137 WeakPolarHBondContact O-CB 3.14Å; G133-A137 PolarHBondContact O-N 3.03Å; G133-I151 VanDerWaalsContact O-CG2 3.3Å; G133-I151 WeakPolarHBondContact O-CG2 3.45Å
134V95.8Very high92.2Very high0 Ų045.8 Ų45.80%023%0.229CC..Hα-helixtrans-62.8-46.7177175.40000110.4I130 L131 A137 Q138 M148 F197 A198 E201I130-V134 HydrophobicContact CG2-CG2 4.38Å; I130-V134 WeakPolarHBondContact O-CG2 3.3Å; I130-V134 PolarHBondContact O-N 2.98Å; L131-V134 PolarHBondContact O-N 3.47Å; L131-V134 VanDerWaalsContact O-N 3.14Å; V134-A137 PolarHBondContact O-N 3.09Å; V134-Q138 PolarHBondContact O-N 2.99Å; V134-M148 HydrophobicContact CG1-CB 4.16Å; V134-M148 HydrophobicContact CG1-CE 3.98Å; V134-F197 HydrophobicContact CB-CB 4.5Å; V134-F197 HydrophobicContact CG1-CB 4.38Å; V134-F197 HydrophobicContact CG2-CB 4.11Å; V134-A198 HydrophobicContact CG1-CB 4.27Å; V134-E201 HydrophobicContact CG1-CB 4.38Å; V134-E201 HydrophobicContact CG1-CG 3.75Å
135T94Very high91.9Very high32 Ų3247.5 Ų47.520%0.19624%0.237CC..Hα-helixtrans-64.7-43177.956.80000111.8L131 G132 A137 Q138 D139L131-T135 HydrophobicContact CD1-CG2 4.46Å; L131-T135 HydrophobicContact CG-CG2 4.47Å; L131-T135 WeakPolarHBondContact O-CG2 3.3Å; L131-T135 PolarHBondContact O-N 3.27Å; L131-T135 PolarHBondContact O-OG1 2.92Å; G132-T135 WeakPolarHBondContact CA-OG1 3.4Å; G132-T135 PolarHBondContact O-OG1 2.94Å; G132-T135 VanDerWaalsContact O-OG1 3.1Å; T135-A137 VanDerWaalsContact C-N 3.28Å; T135-A137 PolarHBondContact O-N 3.43Å; T135-Q138 VanDerWaalsContact O-CB 3.3Å; T135-Q138 WeakPolarHBondContact O-CB 3.46Å; T135-Q138 PolarHBondContact O-N 3.3Å; T135-Q138 VanDerWaalsContact O-N 3.1Å; T135-D139 VanDerWaalsContact O-CG 3.27Å; T135-D139 PolarHBondContact O-N 3.41Å
136L93.6Very high91.8Very high50 Ų5053.7 Ų53.726%0.26227%0.269SS..Hα-helixtrans-59-40.8176.3177.365.7000112L73 G132 G133 K140L73-L136 HydrophobicContact CD1-CD2 3.69Å; L73-L136 HydrophobicContact CD1-CG 4.17Å; G132-L136 WeakPolarHBondContact O-CB 3.46Å; G132-L136 PolarHBondContact O-N 2.89Å; G132-L136 VanDerWaalsContact O-N 3.09Å; G133-L136 PolarHBondContact O-N 3.41Å; L136-K140 PolarHBondContact O-N 3.1Å
137A93.8Very high91.7Very high1 Ų155.5 Ų55.51%0.00828%0.28CS..Hα-helixtrans-68.6-37.1176.100000112.2G133 V134 T135 K140 Y141 I147 M148 I151G133-A137 WeakPolarHBondContact O-CB 3.14Å; G133-A137 PolarHBondContact O-N 3.03Å; V134-A137 PolarHBondContact O-N 3.09Å; T135-A137 VanDerWaalsContact C-N 3.28Å; T135-A137 PolarHBondContact O-N 3.43Å; A137-K140 PolarHBondContact O-N 3.33Å; A137-Y141 PolarHBondContact O-N 2.74Å; A137-I147 HydrophobicContact CB-CG2 4.32Å; A137-M148 HydrophobicContact CB-CB 4.41Å; A137-M148 HydrophobicContact CB-CG 4.15Å; A137-I151 HydrophobicContact CB-CB 3.95Å; A137-I151 HydrophobicContact CB-CG1 4.05Å; A137-I151 HydrophobicContact CB-CG2 4.25Å
138Q93.1Very high91.6Very high33 Ų3355.5 Ų55.515%0.15428%0.28CS..Hα-helixtrans-59.3-50.5175.8-172.552.57.300111.5V134 T135 K140 Q142 D143 M148V134-Q138 PolarHBondContact O-N 2.99Å; T135-Q138 VanDerWaalsContact O-CB 3.3Å; T135-Q138 WeakPolarHBondContact O-CB 3.46Å; T135-Q138 PolarHBondContact O-N 3.3Å; T135-Q138 VanDerWaalsContact O-N 3.1Å; Q138-K140 PolarHBondContact O-N 2.76Å; Q138-Q142 WeakPolarHBondContact O-CA 3.32Å; Q138-Q142 PolarHBondContact O-N 3.46Å; Q138-D143 PolarHBondContact NE2-OD1 3.1Å; Q138-M148 HydrophobicContact CB-CE 3.7Å; Q138-M148 HydrophobicContact CG-CE 3.93Å; Q138-M148 PolarHBondContact OE1-SD 2.98Å
139D91.8Very high91.6Very high130 Ų13053.3 Ų53.370%0.69527%0.273SS*.Hα-helixtrans-61.3-33-177.1-64.7-21.6000111.6T135T135-D139 VanDerWaalsContact O-CG 3.27Å; T135-D139 PolarHBondContact O-N 3.41Å
140K91.6Very high91.6Very high88 Ų8853.2 Ų53.238%0.38328%0.277SS..Hα-helixtrans-88.2-36.6-175.8-165.6171.2-172.3175.10114.2L73 E75 L136 A137 Q138L73-K140 HydrophobicContact CD2-CD 4.26Å; L73-K140 PolarHBondContact O-NZ 3.06Å; E75-K140 IonicContact OE1-NZ 3.91Å; E75-K140 PolarHBondContact OE1-NZ 3.36Å; L136-K140 PolarHBondContact O-N 3.1Å; A137-K140 PolarHBondContact O-N 3.33Å; Q138-K140 PolarHBondContact O-N 2.76Å
141Y87.4Confident91.5Very high90 Ų9053.4 Ų53.435%0.35328%0.278SS..Hα-helixtrans-122.36.8-169.9-67.5-78.3000115L73 A137 N144 I147L73-Y141 HydrophobicContact CD2-CD2 4.37Å; L73-Y141 HydrophobicContact CD2-CE2 3.65Å; A137-Y141 PolarHBondContact O-N 2.74Å; Y141-N144 PolarHBondContact O-ND2 3.03Å; Y141-I147 HydrophobicContact CD1-CD1 4.08Å; Y141-I147 HydrophobicContact CD2-CD1 4.41Å; Y141-I147 HydrophobicContact CD2-CG2 3.79Å; Y141-I147 HydrophobicContact CE2-CG2 4.28Å; Y141-I147 HydrophobicContact CG-CD1 3.95Å; Y141-I147 HydrophobicContact CG-CG2 4.28Å
142Q78.1Confident91.6Very high158 Ų15852.9 Ų52.974%0.73828%0.275SS*.SBendtrans41.991.6171.6-62.4-165.2-23.400115Q138 N144Q138-Q142 WeakPolarHBondContact O-CA 3.32Å; Q138-Q142 PolarHBondContact O-N 3.46Å; Q142-N144 PolarHBondContact O-N 3.3Å
143D70Confident91.7Very high101 Ų10153.2 Ų53.254%0.5427%0.266SS..SBendtrans66.124.3173.2-64.9-42.5000117.1Q138 L145Q138-D143 PolarHBondContact NE2-OD1 3.1Å; D143-L145 PolarHBondContact O-N 3.48Å
144N86.9Confident91.7Very high81 Ų8153.3 Ų53.343%0.43327%0.267SS..  trans-8786.3172.2-81.5-56.6000112.5Y141 Q142 L146 I147 M148Y141-N144 PolarHBondContact O-ND2 3.03Å; Q142-N144 PolarHBondContact O-N 3.3Å; N144-L146 VanDerWaalsContact C-N 3.31Å; N144-L146 PolarHBondContact O-N 3.4Å; N144-L146 VanDerWaalsContact O-N 3.15Å; N144-I147 HydrophobicContact CB-CB 4.08Å; N144-I147 HydrophobicContact CB-CD1 3.72Å; N144-I147 HydrophobicContact CB-CG1 3.93Å; N144-I147 WeakPolarHBondContact O-CB 3.31Å; N144-I147 PolarHBondContact O-N 3.44Å; N144-M148 WeakPolarHBondContact O-CG 3.12Å; N144-M148 PolarHBondContact O-N 2.91Å
145L91.7Very high91.6Very high52 Ų5256.7 Ų56.727%0.27228%0.28SS..Hα-helixtrans-48.9-44-175.5-177.4144.8000114.2D143 I147 M148 I149 L199 Y204D143-L145 PolarHBondContact O-N 3.48Å; L145-I147 PolarHBondContact O-N 3.48Å; L145-M148 PolarHBondContact O-N 3.35Å; L145-I149 HydrophobicContact CD2-CD1 3.38Å; L145-I149 HydrophobicContact CD2-CG1 4.42Å; L145-I149 HydrophobicContact CG-CD1 4.06Å; L145-I149 VanDerWaalsContact O-CG1 3.26Å; L145-I149 WeakPolarHBondContact O-CG1 3.34Å; L145-I149 PolarHBondContact O-N 3.31Å; L145-L199 HydrophobicContact CD1-CD2 3.76Å; L145-Y204 HydrophobicContact CD1-CD2 4.43Å
146L93.2Very high91.6Very high131 Ų13155.8 Ų55.869%0.68628%0.277SS*.Hα-helixtrans-66.3-37.9179.2-69.1-178.4000112.9N144 T150N144-L146 VanDerWaalsContact C-N 3.31Å; N144-L146 PolarHBondContact O-N 3.4Å; N144-L146 VanDerWaalsContact O-N 3.15Å; L146-T150 VanDerWaalsContact O-CB 3.27Å; L146-T150 WeakPolarHBondContact O-CB 3.27Å; L146-T150 PolarHBondContact O-N 2.95Å; L146-T150 PolarHBondContact O-OG1 3.39Å
147I93.1Very high91.6Very high55 Ų5553.9 Ų53.928%0.28227%0.269SS..Hα-helixtrans-66.9-45177.8-59.8-179.9000108.9A137 Y141 N144 L145 I149 T150 I151A137-I147 HydrophobicContact CB-CG2 4.32Å; Y141-I147 HydrophobicContact CD1-CD1 4.08Å; Y141-I147 HydrophobicContact CD2-CD1 4.41Å; Y141-I147 HydrophobicContact CD2-CG2 3.79Å; Y141-I147 HydrophobicContact CE2-CG2 4.28Å; Y141-I147 HydrophobicContact CG-CD1 3.95Å; Y141-I147 HydrophobicContact CG-CG2 4.28Å; N144-I147 HydrophobicContact CB-CB 4.08Å; N144-I147 HydrophobicContact CB-CD1 3.72Å; N144-I147 HydrophobicContact CB-CG1 3.93Å; N144-I147 WeakPolarHBondContact O-CB 3.31Å; N144-I147 PolarHBondContact O-N 3.44Å; L145-I147 PolarHBondContact O-N 3.48Å; I147-I149 PolarHBondContact O-N 3.02Å; I147-T150 PolarHBondContact O-N 2.95Å; I147-I151 HydrophobicContact CG2-CG1 4.16Å; I147-I151 VanDerWaalsContact O-CG1 3.31Å; I147-I151 WeakPolarHBondContact O-CG1 3.19Å; I147-I151 PolarHBondContact O-N 3.36Å
148M94.5Very high91.3Very high1 Ų153.9 Ų53.91%0.00527%0.269CS..Hα-helixtrans-58.4-48177.8-60.1165.29100112.2V134 A137 Q138 N144 L145 T150 I151 G152 A198 E201 T202V134-M148 HydrophobicContact CG1-CB 4.16Å; V134-M148 HydrophobicContact CG1-CE 3.98Å; A137-M148 HydrophobicContact CB-CB 4.41Å; A137-M148 HydrophobicContact CB-CG 4.15Å; Q138-M148 HydrophobicContact CB-CE 3.7Å; Q138-M148 HydrophobicContact CG-CE 3.93Å; Q138-M148 PolarHBondContact OE1-SD 2.98Å; N144-M148 WeakPolarHBondContact O-CG 3.12Å; N144-M148 PolarHBondContact O-N 2.91Å; L145-M148 PolarHBondContact O-N 3.35Å; M148-T150 VanDerWaalsContact C-N 3.32Å; M148-T150 PolarHBondContact O-N 3.24Å; M148-I151 PolarHBondContact O-N 2.95Å; M148-G152 PolarHBondContact O-N 3.48Å; M148-A198 HydrophobicContact CB-CB 3.92Å; M148-E201 HydrophobicContact CE-CB 3.45Å; M148-E201 VanDerWaalsContact CE-CB 3.45Å; M148-E201 HydrophobicContact CE-CG 4.19Å; M148-T202 HydrophobicContact CE-CG2 4.23Å; M148-T202 HydrophobicContact SD-CG2 3.78Å
149I96.4Very high90.9Very high22 Ų2253 Ų5311%0.11327%0.269CS..Hα-helixtrans-58.7-47.5176-68.5167.9000110.1L145 I147 I151 G152 W153 L191 A194 V195 A198L145-I149 HydrophobicContact CD2-CD1 3.38Å; L145-I149 HydrophobicContact CD2-CG1 4.42Å; L145-I149 HydrophobicContact CG-CD1 4.06Å; L145-I149 VanDerWaalsContact O-CG1 3.26Å; L145-I149 WeakPolarHBondContact O-CG1 3.34Å; L145-I149 PolarHBondContact O-N 3.31Å; I147-I149 PolarHBondContact O-N 3.02Å; I149-I151 PolarHBondContact O-N 2.93Å; I149-G152 PolarHBondContact O-N 2.92Å; I149-W153 WeakPolarHBondContact O-CB 3.24Å; I149-W153 PolarHBondContact O-N 3.49Å; I149-L191 HydrophobicContact CG2-CD1 3.95Å; I149-A194 HydrophobicContact CG2-CB 4.32Å; I149-A194 WeakPolarHBondContact O-CB 3.49Å; I149-V195 HydrophobicContact CD1-CG2 3.97Å; I149-V195 HydrophobicContact CG1-CG2 4.23Å; I149-V195 HydrophobicContact CG2-CG2 4.08Å; I149-A198 HydrophobicContact CG1-CB 3.66Å
150T95.3Very high90.7Very high50 Ų5048 Ų4831%0.30725%0.247SC..Hα-helixtrans-63.8-44.6-175.3-60.30000111.7M72 L146 I147 M148 A154M72-T150 HydrophobicContact CE-CG2 3.07Å; M72-T150 HydrophobicContact SD-CG2 3.91Å; L146-T150 VanDerWaalsContact O-CB 3.27Å; L146-T150 WeakPolarHBondContact O-CB 3.27Å; L146-T150 PolarHBondContact O-N 2.95Å; L146-T150 PolarHBondContact O-OG1 3.39Å; I147-T150 PolarHBondContact O-N 2.95Å; M148-T150 VanDerWaalsContact C-N 3.32Å; M148-T150 PolarHBondContact O-N 3.24Å; T150-A154 WeakPolarHBondContact O-CB 3.03Å; T150-A154 PolarHBondContact O-N 3.49Å
151I96.2Very high90.5Very high4 Ų445.7 Ų45.72%0.02124%0.239CC..Hα-helixtrans-72.1-41.5179.6-61.4-55.4000111.8M72 L73 G133 A137 I147 M148 I149 W153 A154 R155M72-I151 HydrophobicContact CB-CD1 3.58Å; M72-I151 HydrophobicContact SD-CD1 4.33Å; L73-I151 HydrophobicContact CD1-CD1 4.36Å; L73-I151 HydrophobicContact CD1-CG2 4.17Å; L73-I151 HydrophobicContact CD2-CD1 3.73Å; L73-I151 HydrophobicContact CD2-CG1 3.86Å; L73-I151 HydrophobicContact CG-CD1 3.68Å; L73-I151 HydrophobicContact CG-CG1 4.23Å; G133-I151 VanDerWaalsContact O-CG2 3.3Å; G133-I151 WeakPolarHBondContact O-CG2 3.45Å; A137-I151 HydrophobicContact CB-CB 3.95Å; A137-I151 HydrophobicContact CB-CG1 4.05Å; A137-I151 HydrophobicContact CB-CG2 4.25Å; I147-I151 HydrophobicContact CG2-CG1 4.16Å; I147-I151 VanDerWaalsContact O-CG1 3.31Å; I147-I151 WeakPolarHBondContact O-CG1 3.19Å; I147-I151 PolarHBondContact O-N 3.36Å; M148-I151 PolarHBondContact O-N 2.95Å; I149-I151 PolarHBondContact O-N 2.93Å; I151-W153 VanDerWaalsContact C-N 3.32Å; I151-W153 PolarHBondContact O-N 2.9Å; I151-A154 PolarHBondContact O-N 2.85Å; I151-R155 WeakPolarHBondContact O-CG 3.28Å; I151-R155 PolarHBondContact O-N 2.9Å
152G96.6Very high90.6Very high0 Ų042.6 Ų42.60%023%0.228CC..Hα-helixtrans-60.1-43.2173.600000112M148 I149 R155 G156M148-G152 PolarHBondContact O-N 3.48Å; I149-G152 PolarHBondContact O-N 2.92Å; G152-R155 PolarHBondContact O-N 2.99Å; G152-G156 PolarHBondContact O-N 2.78Å
153W96.6Very high91.1Very high39 Ų3936 Ų3615%0.14820%0.199CC..Hα-helixtrans-64.4-45.8176.2-177.335.4000111.8I149 I151 R155 G156 A157 L161 L180 M183 T187 L191 A194I149-W153 WeakPolarHBondContact O-CB 3.24Å; I149-W153 PolarHBondContact O-N 3.49Å; I151-W153 VanDerWaalsContact C-N 3.32Å; I151-W153 PolarHBondContact O-N 2.9Å; W153-R155 PolarHBondContact O-N 3.44Å; W153-G156 PolarHBondContact O-N 2.98Å; W153-A157 WeakPolarHBondContact O-CB 3.38Å; W153-A157 PolarHBondContact O-N 3.18Å; W153-L161 HydrophobicContact CD2-CD1 4.21Å; W153-L161 HydrophobicContact CH2-CD2 4.26Å; W153-L161 HydrophobicContact CZ2-CD1 4.5Å; W153-L161 HydrophobicContact CZ2-CD2 3.81Å; W153-L180 HydrophobicContact CH2-CD2 3.4Å; W153-L180 VanDerWaalsContact CH2-CD2 3.4Å; W153-L180 HydrophobicContact CZ2-CD2 4.13Å; W153-L180 HydrophobicContact CZ3-CD2 4.21Å; W153-M183 HydrophobicContact CH2-CE 3.78Å; W153-M183 HydrophobicContact CZ2-CE 3.74Å; W153-M183 HydrophobicContact CZ2-SD 4.41Å; W153-T187 HydrophobicContact CZ2-CG2 3.73Å; W153-T187 PolarHBondContact NE1-O 2.89Å; W153-L191 HydrophobicContact CB-CD1 4.44Å; W153-L191 HydrophobicContact CD2-CD1 3.96Å; W153-L191 HydrophobicContact CE3-CD1 4.22Å; W153-L191 HydrophobicContact CG-CB 4.34Å; W153-L191 HydrophobicContact CG-CD1 4.07Å; W153-A194 HydrophobicContact CB-CB 4.15Å
154A95.7Very high91.9Very high1 Ų132.4 Ų32.41%0.00818%0.18CC..Hα-helixtrans-57.7-45.7174.800000111.8G65 L68 M72 T150 I151 G156 G158G65-A154 WeakPolarHBondContact CA-O 3.34Å; L68-A154 HydrophobicContact CB-CB 4.49Å; L68-A154 HydrophobicContact CD2-CB 3.85Å; L68-A154 HydrophobicContact CG-CB 3.95Å; M72-A154 HydrophobicContact SD-CB 3.8Å; T150-A154 WeakPolarHBondContact O-CB 3.03Å; T150-A154 PolarHBondContact O-N 3.49Å; I151-A154 PolarHBondContact O-N 2.85Å; A154-G156 PolarHBondContact O-N 2.76Å; A154-G158 WeakPolarHBondContact O-CA 3.32Å; A154-G158 PolarHBondContact O-N 2.87Å
155R94.9Very high91.8Very high71 Ų7134.3 Ų34.327%0.26819%0.185SC..Hα-helixtrans-65.5-37.6178.7-74.4-110.6171.3167.32.5113.3S69 K129 I151 G152 W153S69-R155 PolarHBondContact OG-NE 3.17Å; S69-R155 PolarHBondContact OG-NH2 3.39Å; K129-R155 WeakPolarHBondContact O-CB 3.4Å; I151-R155 WeakPolarHBondContact O-CG 3.28Å; I151-R155 PolarHBondContact O-N 2.9Å; G152-R155 PolarHBondContact O-N 2.99Å; W153-R155 PolarHBondContact O-N 3.44Å
156G93.6Very high91.7Very high14 Ų1431.9 Ų31.914%0.14417%0.172CC..Hα-helixtrans-76.7-36.3-179.600000114.7G152 W153 A154G152-G156 PolarHBondContact O-N 2.78Å; W153-G156 PolarHBondContact O-N 2.98Å; A154-G156 PolarHBondContact O-N 2.76Å
157A93.1Very high91.5Very high10 Ų1026.9 Ų26.98%0.08315%0.145CC..Hα-helixtrans-120.13.6-170.400000114.7W153 G159 G160 L161 T190W153-A157 WeakPolarHBondContact O-CB 3.38Å; W153-A157 PolarHBondContact O-N 3.18Å; A157-G159 VanDerWaalsContact C-N 3.27Å; A157-G159 PolarHBondContact O-N 2.67Å; A157-G159 VanDerWaalsContact O-N 3.1Å; A157-G160 WeakPolarHBondContact O-CA 3.38Å; A157-G160 PolarHBondContact O-N 2.69Å; A157-L161 HydrophobicContact CB-CD1 4.17Å; A157-L161 HydrophobicContact CB-CG 4.22Å; A157-L161 PolarHBondContact O-N 3.01Å; A157-T190 HydrophobicContact CB-CG2 4.04Å; A157-T190 VanDerWaalsContact CB-OG1 3.31Å; A157-T190 WeakPolarHBondContact CB-OG1 3.34Å
158G86.9Confident91.3Very high1 Ų128.4 Ų28.41%0.0115%0.153CC..Hα-helixtrans-59.6-32.7-164.400000114.8A154 G160 L161 I162A154-G158 WeakPolarHBondContact O-CA 3.32Å; A154-G158 PolarHBondContact O-N 2.87Å; G158-G160 VanDerWaalsContact C-N 3.26Å; G158-G160 PolarHBondContact O-N 3.11Å; G158-L161 PolarHBondContact O-N 2.97Å; G158-I162 VanDerWaalsContact O-CG1 3.23Å; G158-I162 WeakPolarHBondContact O-CG1 3.49Å; G158-I162 WeakPolarHBondContact O-CG2 3.28Å; G158-I162 PolarHBondContact O-N 3.4Å
159G85.9Confident90.9Very high15 Ų1530.7 Ų30.716%0.15517%0.167CC..Hα-helixtrans-61-33.1173.700000113.7A157A157-G159 VanDerWaalsContact C-N 3.27Å; A157-G159 PolarHBondContact O-N 2.67Å; A157-G159 VanDerWaalsContact O-N 3.1Å
160G86.9Confident90.4Very high23 Ų2331 Ų3124%0.23717%0.167CC..Hα-helixtrans-77.3-45.3171.400000111.7A157 G158 I162 S163 E179A157-G160 WeakPolarHBondContact O-CA 3.38Å; A157-G160 PolarHBondContact O-N 2.69Å; G158-G160 VanDerWaalsContact C-N 3.26Å; G158-G160 PolarHBondContact O-N 3.11Å; G160-I162 VanDerWaalsContact C-N 3.26Å; G160-I162 PolarHBondContact O-N 3.41Å; G160-S163 WeakPolarHBondContact O-CB 3.22Å; G160-S163 PolarHBondContact O-N 2.85Å; G160-S163 PolarHBondContact O-OG 3.35Å; G160-E179 WeakPolarHBondContact O-CG 3.4Å
161L88.2Confident89.9Confident41 Ų4131.9 Ų31.922%0.21519%0.186CC..Hα-helixtrans-61.4-33.5-179.3-66.9173.2000113.1L68 W153 A157 G158 E179 L180 T187L68-L161 HydrophobicContact CD2-CB 3.75Å; L68-L161 HydrophobicContact CD2-CD1 3.78Å; L68-L161 HydrophobicContact CD2-CG 4.43Å; W153-L161 HydrophobicContact CD2-CD1 4.21Å; W153-L161 HydrophobicContact CH2-CD2 4.26Å; W153-L161 HydrophobicContact CZ2-CD1 4.5Å; W153-L161 HydrophobicContact CZ2-CD2 3.81Å; A157-L161 HydrophobicContact CB-CD1 4.17Å; A157-L161 HydrophobicContact CB-CG 4.22Å; A157-L161 PolarHBondContact O-N 3.01Å; G158-L161 PolarHBondContact O-N 2.97Å; L161-E179 HydrophobicContact CD2-CB 4.28Å; L161-L180 HydrophobicContact CD2-CD2 4.12Å; L161-T187 HydrophobicContact CD2-CG2 4.09Å
162I90.1Very high89.5Confident24 Ų2434 Ų3412%0.12320%0.197CC..THydrogen-bonded Turntrans-93.18.9175.677.4-171.2000113.4L60 G64 L68 G158 G160 N164 F165 E166L60-I162 HydrophobicContact CB-CD1 4.37Å; L60-I162 HydrophobicContact CD2-CD1 4.18Å; G64-I162 VanDerWaalsContact CA-CD1 3.4Å; L68-I162 HydrophobicContact CB-CG2 4.04Å; L68-I162 HydrophobicContact CD1-CG2 3.91Å; L68-I162 HydrophobicContact CD2-CG2 4.08Å; L68-I162 HydrophobicContact CG-CG2 4.23Å; G158-I162 VanDerWaalsContact O-CG1 3.23Å; G158-I162 WeakPolarHBondContact O-CG1 3.49Å; G158-I162 WeakPolarHBondContact O-CG2 3.28Å; G158-I162 PolarHBondContact O-N 3.4Å; G160-I162 VanDerWaalsContact C-N 3.26Å; G160-I162 PolarHBondContact O-N 3.41Å; I162-N164 PolarHBondContact O-N 2.86Å; I162-F165 WeakPolarHBondContact O-CB 3.36Å; I162-F165 PolarHBondContact O-N 3.37Å; I162-E166 PolarHBondContact O-N 3.49Å
163S86.9Confident89Confident19 Ų1941.7 Ų41.713%0.13323%0.226CC..Hα-helixtrans-57.1-30.4-174.565.10000113.3G160 E166 Q167G160-S163 WeakPolarHBondContact O-CB 3.22Å; G160-S163 PolarHBondContact O-N 2.85Å; G160-S163 PolarHBondContact O-OG 3.35Å; S163-E166 PolarHBondContact O-N 2.75Å; S163-Q167 WeakPolarHBondContact O-CB 3.3Å; S163-Q167 VanDerWaalsContact O-CG 3.27Å; S163-Q167 WeakPolarHBondContact O-CG 3.23Å; S163-Q167 PolarHBondContact O-N 2.85Å; S163-Q167 PolarHBondContact O-NE2 2.84Å
164N86.4Confident88.3Confident27 Ų2745.8 Ų45.814%0.14424%0.241CC..Hα-helixtrans-73.2-36.3179.7-71.725.3000112.2I162 Q167 L168 T177 N178I162-N164 PolarHBondContact O-N 2.86Å; N164-Q167 PolarHBondContact O-N 3.29Å; N164-L168 PolarHBondContact O-N 3.35Å; N164-L168 VanDerWaalsContact O-N 3.09Å; N164-T177 PolarHBondContact ND2-O 3.12Å; N164-T177 PolarHBondContact OD1-O 3.41Å; N164-N178 PolarHBondContact ND2-OD1 3.41Å
165F86.1Confident87.6Confident120 Ų12048.6 Ų48.653%0.52626%0.26SS..Hα-helixtrans-69.3-39.8171.9-179.8-98.9000110.7L60 I162 Q167 L168 V169L60-F165 HydrophobicContact CD1-CD1 4.23Å; L60-F165 HydrophobicContact CD1-CE1 4.25Å; I162-F165 WeakPolarHBondContact O-CB 3.36Å; I162-F165 PolarHBondContact O-N 3.37Å; F165-Q167 PolarHBondContact O-N 2.84Å; F165-L168 WeakPolarHBondContact O-CB 3.49Å; F165-L168 PolarHBondContact O-N 2.81Å; F165-L168 VanDerWaalsContact O-N 3.15Å; F165-V169 HydrophobicContact CD1-CG2 4.44Å; F165-V169 HydrophobicContact CE1-CG2 4.07Å; F165-V169 HydrophobicContact CZ-CG2 4.45Å; F165-V169 PolarHBondContact O-N 2.85Å
166E89Confident86.9Confident2 Ų252 Ų521%0.00928%0.278CS..Hα-helixtrans-59.4-44.9172.5178.9-76.8139.300111.8L37 S57 L60 H61 I162 S163 L168 V169 R170L37-E166 WeakPolarHBondContact CD1-OE1 3.2Å; S57-E166 WeakPolarHBondContact CB-OE1 3.25Å; S57-E166 PolarHBondContact OG-OE1 2.71Å; L60-E166 HydrophobicContact CB-CG 4.48Å; L60-E166 HydrophobicContact CD1-CB 4.36Å; H61-E166 IonicContact NE2-OE2 2.7Å; I162-E166 PolarHBondContact O-N 3.49Å; S163-E166 PolarHBondContact O-N 2.75Å; E166-L168 VanDerWaalsContact C-N 3.25Å; E166-L168 PolarHBondContact O-N 3.22Å; E166-V169 WeakPolarHBondContact O-CB 3.47Å; E166-V169 PolarHBondContact O-N 2.72Å; E166-V169 VanDerWaalsContact O-N 3.07Å; E166-R170 PolarHBondContact O-N 3.33Å; E166-R170 VanDerWaalsContact OE1-CD 3.25Å; E166-R170 WeakPolarHBondContact OE1-CD 3.39Å; E166-R170 WeakPolarHBondContact OE1-CG 3.33Å; E166-R170 IonicContact OE1-CZ 2.68Å; E166-R170 IonicContact OE1-NE 3.82Å; E166-R170 IonicContact OE1-NH1 3.56Å; E166-R170 PolarHBondContact OE1-NH1 3.32Å; E166-R170 IonicContact OE2-NH1 3.17Å; E166-R170 PolarHBondContact OE2-NH1 2.65Å
167Q88.4Confident85.9Confident25 Ų2554.8 Ų54.812%0.11729%0.293CS..Hα-helixtrans-58.7-39.3174.3-76.3171.357.300111.6S163 N164 F165 V169 R170 G171 I172S163-Q167 WeakPolarHBondContact O-CB 3.3Å; S163-Q167 VanDerWaalsContact O-CG 3.27Å; S163-Q167 WeakPolarHBondContact O-CG 3.23Å; S163-Q167 PolarHBondContact O-N 2.85Å; S163-Q167 PolarHBondContact O-NE2 2.84Å; N164-Q167 PolarHBondContact O-N 3.29Å; F165-Q167 PolarHBondContact O-N 2.84Å; Q167-V169 VanDerWaalsContact C-N 3.32Å; Q167-V169 PolarHBondContact O-N 2.87Å; Q167-R170 CarbonylContact O-C 3.49Å; Q167-R170 WeakPolarHBondContact O-CA 3.42Å; Q167-R170 WeakPolarHBondContact O-CB 3.2Å; Q167-R170 PolarHBondContact O-N 3.07Å; Q167-G171 PolarHBondContact O-N 2.75Å; Q167-I172 CarbonylContact C-O 3.52Å; Q167-I172 HydrophobicContact CB-CB 4.31Å; Q167-I172 WeakPolarHBondContact CB-O 3.2Å; Q167-I172 PolarHBondContact O-N 3.4Å
168L88.7Confident85.2Confident87 Ų8757.1 Ų57.146%0.45530%0.304SS..Hα-helixtrans-62.2-38.4175.7-175.965.2000111.8N164 F165 E166 R170 G171 I172 W173N164-L168 PolarHBondContact O-N 3.35Å; N164-L168 VanDerWaalsContact O-N 3.09Å; F165-L168 WeakPolarHBondContact O-CB 3.49Å; F165-L168 PolarHBondContact O-N 2.81Å; F165-L168 VanDerWaalsContact O-N 3.15Å; E166-L168 VanDerWaalsContact C-N 3.25Å; E166-L168 PolarHBondContact O-N 3.22Å; L168-R170 PolarHBondContact O-N 3.44Å; L168-G171 PolarHBondContact O-N 2.9Å; L168-I172 PolarHBondContact N-O 3.24Å; L168-W173 HydrophobicContact CB-CE3 4.33Å; L168-W173 HydrophobicContact CD1-CE3 4.08Å; L168-W173 HydrophobicContact CD2-CZ3 4.46Å
169V86.9Confident85Confident49 Ų4958.9 Ų58.930%0.29731%0.312SS..Hα-helixtrans-59.4-29.5172.6174.10000111.6V56 L60 F165 E166 Q167 G171V56-V169 HydrophobicContact CB-CG1 4.46Å; V56-V169 HydrophobicContact CG1-CG1 4.1Å; L60-V169 HydrophobicContact CD1-CG2 4.04Å; F165-V169 HydrophobicContact CD1-CG2 4.44Å; F165-V169 HydrophobicContact CE1-CG2 4.07Å; F165-V169 HydrophobicContact CZ-CG2 4.45Å; F165-V169 PolarHBondContact O-N 2.85Å; E166-V169 WeakPolarHBondContact O-CB 3.47Å; E166-V169 PolarHBondContact O-N 2.72Å; E166-V169 VanDerWaalsContact O-N 3.07Å; Q167-V169 VanDerWaalsContact C-N 3.32Å; Q167-V169 PolarHBondContact O-N 2.87Å; V169-G171 VanDerWaalsContact C-N 3.34Å
170R86.1Confident84.6Confident30 Ų3063.6 Ų63.611%0.11333%0.333CS..THydrogen-bonded Turntrans-86.3-1.2174.2-51.4-158-39.9-100.611114.3L46 E166 Q167 L168L46-R170 HydrophobicContact CD2-CB 3.78Å; L46-R170 HydrophobicContact CD2-CG 3.6Å; E166-R170 PolarHBondContact O-N 3.33Å; E166-R170 VanDerWaalsContact OE1-CD 3.25Å; E166-R170 WeakPolarHBondContact OE1-CD 3.39Å; E166-R170 WeakPolarHBondContact OE1-CG 3.33Å; E166-R170 IonicContact OE1-CZ 2.68Å; E166-R170 IonicContact OE1-NE 3.82Å; E166-R170 IonicContact OE1-NH1 3.56Å; E166-R170 PolarHBondContact OE1-NH1 3.32Å; E166-R170 IonicContact OE2-NH1 3.17Å; E166-R170 PolarHBondContact OE2-NH1 2.65Å; Q167-R170 CarbonylContact O-C 3.49Å; Q167-R170 WeakPolarHBondContact O-CA 3.42Å; Q167-R170 WeakPolarHBondContact O-CB 3.2Å; Q167-R170 PolarHBondContact O-N 3.07Å; L168-R170 PolarHBondContact O-N 3.44Å
171G85.8Confident84Confident68 Ų6867 Ų6770%0.70135%0.345SS*.THydrogen-bonded Turntrans77.717.9-174.900000114.5Q167 L168 V169Q167-G171 PolarHBondContact O-N 2.75Å; L168-G171 PolarHBondContact O-N 2.9Å; V169-G171 VanDerWaalsContact C-N 3.34Å
172I87.3Confident83.6Confident48 Ų4870 Ų7025%0.24635%0.353CS..  trans-106.9127.9176.1-62.5165.9000108.3Q167 L168 R174Q167-I172 CarbonylContact C-O 3.52Å; Q167-I172 HydrophobicContact CB-CB 4.31Å; Q167-I172 WeakPolarHBondContact CB-O 3.2Å; Q167-I172 PolarHBondContact O-N 3.4Å; L168-I172 PolarHBondContact N-O 3.24Å; I172-R174 HydrophobicContact CG2-CG 4.11Å
173W85Confident83.2Confident161 Ų16171.7 Ų71.761%0.6136%0.362SS*.  trans-124.1119.7174.6-177-107.4000109.9L168 P175L168-W173 HydrophobicContact CB-CE3 4.33Å; L168-W173 HydrophobicContact CD1-CE3 4.08Å; L168-W173 HydrophobicContact CD2-CZ3 4.46Å; W173-P175 HydrophobicContact CZ2-CB 4.19Å
174R82.9Confident83.3Confident125 Ų12572.7 Ų72.747%0.47237%0.368SS..  trans-13484.1178.9-66.9-176.6-176.5-178.31.9109.4I172 E176I172-R174 HydrophobicContact CG2-CG 4.11Å; R174-E176 WeakPolarHBondContact CA-OE2 3.24Å; R174-E176 PolarHBondContact O-N 2.99Å
175P81.1Confident83.4Confident61 Ų6172.1 Ų72.140%0.39636%0.364SS..THydrogen-bonded Turntrans-74.1-12.3-175.631.4-34.7000112.8W173 T177 N178W173-P175 HydrophobicContact CZ2-CB 4.19Å; P175-T177 VanDerWaalsContact C-N 3.25Å; P175-T177 PolarHBondContact O-N 3.18Å; P175-N178 PolarHBondContact O-OD1 2.9Å
176E78.9Confident83.6Confident141 Ų14168.2 Ų68.266%0.65935%0.351SS*.THydrogen-bonded Turntrans-73.6-18.7-176.1-49.683.9-176.200112.7R174R174-E176 WeakPolarHBondContact CA-OE2 3.24Å; R174-E176 PolarHBondContact O-N 2.99Å
177T73.9Confident83.7Confident74 Ų7468.2 Ų68.245%0.45435%0.351SS..  trans-131.2115.1-175.560.50000111.1N164 P175N164-T177 PolarHBondContact ND2-O 3.12Å; N164-T177 PolarHBondContact OD1-O 3.41Å; P175-T177 VanDerWaalsContact C-N 3.25Å; P175-T177 PolarHBondContact O-N 3.18Å
178N78.1Confident83.9Confident59 Ų5968.8 Ų68.832%0.31635%0.353SS..  trans-129.8148.6174.6-54-0.1000108.7N164 P175 L180 I181 R182N164-N178 PolarHBondContact ND2-OD1 3.41Å; P175-N178 PolarHBondContact O-OD1 2.9Å; N178-L180 PolarHBondContact O-N 2.81Å; N178-L180 VanDerWaalsContact O-N 3.15Å; N178-I181 HydrophobicContact CB-CD1 4.12Å; N178-I181 HydrophobicContact CB-CG1 4.23Å; N178-I181 PolarHBondContact O-N 3.27Å; N178-R182 PolarHBondContact O-N 3.39Å
179E81.8Confident84.1Confident38 Ų3864.6 Ų64.618%0.17833%0.331CS..THydrogen-bonded Turntrans-57.7-27.7175.6-84.5-72.8166.200112.9G160 L161 R182 M183 S184 T187G160-E179 WeakPolarHBondContact O-CG 3.4Å; L161-E179 HydrophobicContact CD2-CB 4.28Å; E179-R182 CarbonylContact O-C 2.99Å; E179-R182 VanDerWaalsContact O-C 3.31Å; E179-M183 WeakPolarHBondContact O-CA 3.45Å; E179-M183 WeakPolarHBondContact O-CG 3.49Å; E179-M183 PolarHBondContact O-N 3.22Å; E179-M183 VanDerWaalsContact O-N 3.11Å; E179-S184 VanDerWaalsContact CD-OG 3.25Å; E179-S184 WeakPolarHBondContact OE1-CB 3.38Å; E179-S184 PolarHBondContact OE1-OG 3.08Å; E179-S184 PolarHBondContact OE2-N 2.89Å; E179-S184 PolarHBondContact OE2-OG 2.86Å; E179-T187 WeakPolarHBondContact OE2-CB 3.32Å; E179-T187 PolarHBondContact OE2-OG1 3.12Å
180L77.1Confident84.5Confident114 Ų11462.3 Ų62.360%0.59732%0.317SS*.THydrogen-bonded Turntrans-71.6-32.7174.8-65.2179.1000113.4W153 L161 N178W153-L180 HydrophobicContact CH2-CD2 3.4Å; W153-L180 VanDerWaalsContact CH2-CD2 3.4Å; W153-L180 HydrophobicContact CZ2-CD2 4.13Å; W153-L180 HydrophobicContact CZ3-CD2 4.21Å; L161-L180 HydrophobicContact CD2-CD2 4.12Å; N178-L180 PolarHBondContact O-N 2.81Å; N178-L180 VanDerWaalsContact O-N 3.15Å
181I76.1Confident84.9Confident94 Ų9463.2 Ų63.248%0.48232%0.324SS..THydrogen-bonded Turntrans-80.1-41.1-179.5-61.8171.2000109.8N178 F267N178-I181 HydrophobicContact CB-CD1 4.12Å; N178-I181 HydrophobicContact CB-CG1 4.23Å; N178-I181 PolarHBondContact O-N 3.27Å; I181-F267 HydrophobicContact CG2-CZ 4.1Å
182R78.7Confident85.3Confident104 Ų10462.7 Ų62.739%0.39230%0.304SS..SBendtrans-134.691177.6-78.2178.8160.6-173.1-5.4109.3N178 E179 S184 F267N178-R182 PolarHBondContact O-N 3.39Å; E179-R182 CarbonylContact O-C 2.99Å; E179-R182 VanDerWaalsContact O-C 3.31Å; R182-S184 PolarHBondContact O-N 3.07Å; R182-F267 HydrophobicContact CG-CD1 4.44Å; R182-F267 HydrophobicContact CG-CE1 3.69Å; R182-F267 HydrophobicContact CG-CZ 3.98Å; R182-F267 PolarHBondContact NE-O 2.94Å; R182-F267 VanDerWaalsContact NH2-CA 3.29Å; R182-F267 VanDerWaalsContact NH2-CD2 3.33Å; R182-F267 PolarHBondContact NH2-O 3.18Å
183M82.8Confident85.7Confident60 Ų6060.4 Ų60.430%0.29629%0.292SS..  trans-68126.6-179.8-67.1-179.1-178.100111.1W153 E179 T187 K188 L191W153-M183 HydrophobicContact CH2-CE 3.78Å; W153-M183 HydrophobicContact CZ2-CE 3.74Å; W153-M183 HydrophobicContact CZ2-SD 4.41Å; E179-M183 WeakPolarHBondContact O-CA 3.45Å; E179-M183 WeakPolarHBondContact O-CG 3.49Å; E179-M183 PolarHBondContact O-N 3.22Å; E179-M183 VanDerWaalsContact O-N 3.11Å; M183-T187 HydrophobicContact CB-CG2 4.24Å; M183-T187 HydrophobicContact CG-CG2 4.05Å; M183-T187 HydrophobicContact SD-CG2 4.42Å; M183-K188 HydrophobicContact CB-CD 4.39Å; M183-K188 HydrophobicContact CB-CG 3.65Å; M183-K188 WeakPolarHBondContact O-CE 3.31Å; M183-K188 HydrophobicContact SD-CG 4.44Å; M183-L191 HydrophobicContact CE-CD2 4.49Å; M183-L191 HydrophobicContact SD-CD2 4.38Å
184S87.2Confident86.3Confident39 Ų3952.7 Ų52.727%0.27326%0.263SS..  trans-71.1162.2170.264.40000111.6E179 R182 P186 T187 K188E179-S184 VanDerWaalsContact CD-OG 3.25Å; E179-S184 WeakPolarHBondContact OE1-CB 3.38Å; E179-S184 PolarHBondContact OE1-OG 3.08Å; E179-S184 PolarHBondContact OE2-N 2.89Å; E179-S184 PolarHBondContact OE2-OG 2.86Å; R182-S184 PolarHBondContact O-N 3.07Å; S184-P186 VanDerWaalsContact C-N 3.35Å; S184-T187 PolarHBondContact O-N 3.1Å; S184-T187 VanDerWaalsContact O-N 3.11Å; S184-T187 PolarHBondContact OG-OG1 2.84Å; S184-K188 PolarHBondContact O-N 3.15Å
185Y89.1Confident86.9Confident16 Ų1649.1 Ų49.16%0.06326%0.255CS..Hα-helixtrans-49.9-48.4176.4165.3-85.6000112.8T187 K188 I189 N223 M227 F235Y185-T187 VanDerWaalsContact C-N 3.34Å; Y185-T187 PolarHBondContact O-N 3.23Å; Y185-K188 PolarHBondContact O-N 3.02Å; Y185-I189 HydrophobicContact CD1-CG1 4.41Å; Y185-I189 HydrophobicContact CD2-CG1 4.03Å; Y185-I189 HydrophobicContact CE1-CG1 3.97Å; Y185-I189 HydrophobicContact CE2-CD1 4.02Å; Y185-I189 HydrophobicContact CE2-CG1 3.53Å; Y185-I189 HydrophobicContact CG-CG1 4.42Å; Y185-I189 VanDerWaalsContact CZ-CG1 3.5Å; Y185-I189 WeakPolarHBondContact O-CB 3.45Å; Y185-I189 WeakPolarHBondContact O-CG1 3.23Å; Y185-I189 PolarHBondContact O-N 3.33Å; Y185-N223 HydrophobicContact CE2-CB 4.39Å; Y185-N223 WeakPolarHBondContact OH-CB 3.28Å; Y185-M227 HydrophobicContact CD1-CE 3.96Å; Y185-M227 HydrophobicContact CD1-SD 3.52Å; Y185-M227 VanDerWaalsContact CD1-SD 3.52Å; Y185-M227 HydrophobicContact CD2-CE 3.85Å; Y185-M227 HydrophobicContact CD2-SD 3.41Å; Y185-M227 WeakPolarHBondContact CD2-SD 3.5Å; Y185-M227 HydrophobicContact CE1-SD 3.6Å; Y185-M227 HydrophobicContact CE2-SD 3.5Å; Y185-M227 VanDerWaalsContact CE2-SD 3.5Å; Y185-M227 HydrophobicContact CG-CE 3.56Å; Y185-M227 HydrophobicContact CG-SD 3.45Å; Y185-M227 VanDerWaalsContact CZ-SD 3.6Å; Y185-F235 AromaticContact CD2-CD2 3.79Å; Y185-F235 HydrophobicContact CD2-CD2 3.79Å; Y185-F235 HydrophobicContact CE2-CD2 4.25Å
186P90.4Very high87.6Confident37 Ų3748.6 Ų48.624%0.2425%0.249CC..Hα-helixtrans-55.6-46.9176.8-28.437.8000112.8S184 K188 I189 T190S184-P186 VanDerWaalsContact C-N 3.35Å; P186-K188 PolarHBondContact O-N 2.86Å; P186-I189 PolarHBondContact O-N 3.15Å; P186-T190 WeakPolarHBondContact O-CB 3.18Å; P186-T190 WeakPolarHBondContact O-CG2 3.09Å; P186-T190 PolarHBondContact O-N 3.28Å; P186-T190 PolarHBondContact O-OG1 3.14Å
187T92Very high88.4Confident2 Ų242 Ų421%0.01222%0.218CC..Hα-helixtrans-62.8-41.6-179.7-54.10000112.2W153 L161 E179 M183 S184 Y185 T190 L191W153-T187 HydrophobicContact CZ2-CG2 3.73Å; W153-T187 PolarHBondContact NE1-O 2.89Å; L161-T187 HydrophobicContact CD2-CG2 4.09Å; E179-T187 WeakPolarHBondContact OE2-CB 3.32Å; E179-T187 PolarHBondContact OE2-OG1 3.12Å; M183-T187 HydrophobicContact CB-CG2 4.24Å; M183-T187 HydrophobicContact CG-CG2 4.05Å; M183-T187 HydrophobicContact SD-CG2 4.42Å; S184-T187 PolarHBondContact O-N 3.1Å; S184-T187 VanDerWaalsContact O-N 3.11Å; S184-T187 PolarHBondContact OG-OG1 2.84Å; Y185-T187 VanDerWaalsContact C-N 3.34Å; Y185-T187 PolarHBondContact O-N 3.23Å; T187-T190 VanDerWaalsContact C-OG1 3.22Å; T187-T190 VanDerWaalsContact CA-OG1 3.26Å; T187-T190 WeakPolarHBondContact CA-OG1 3.39Å; T187-T190 PolarHBondContact O-OG1 3.05Å; T187-L191 WeakPolarHBondContact O-CB 3.29Å; T187-L191 PolarHBondContact O-N 2.81Å
188K91.7Very high89.4Confident37 Ų3738.4 Ų38.416%0.16120%0.196CC..Hα-helixtrans-65.3-47.4177-68.9-173.7172.9-165.30112.2M183 S184 Y185 P186 T190 L191 M192 F235 E241M183-K188 HydrophobicContact CB-CD 4.39Å; M183-K188 HydrophobicContact CB-CG 3.65Å; M183-K188 WeakPolarHBondContact O-CE 3.31Å; M183-K188 HydrophobicContact SD-CG 4.44Å; S184-K188 PolarHBondContact O-N 3.15Å; Y185-K188 PolarHBondContact O-N 3.02Å; P186-K188 PolarHBondContact O-N 2.86Å; K188-T190 VanDerWaalsContact C-N 3.34Å; K188-T190 PolarHBondContact O-N 3.39Å; K188-L191 PolarHBondContact O-N 2.93Å; K188-M192 PolarHBondContact O-N 2.99Å; K188-F235 HydrophobicContact CB-CD2 4.22Å; K188-F235 HydrophobicContact CB-CE2 3.72Å; K188-F235 HydrophobicContact CB-CZ 4.02Å; K188-F235 HydrophobicContact CD-CD1 4.28Å; K188-F235 HydrophobicContact CD-CD2 4.24Å; K188-F235 HydrophobicContact CD-CE1 4.38Å; K188-F235 HydrophobicContact CD-CE2 4.37Å; K188-F235 HydrophobicContact CD-CG 4.23Å; K188-F235 HydrophobicContact CD-CZ 4.47Å; K188-E241 WeakPolarHBondContact CE-OE1 3.5Å; K188-E241 IonicContact NZ-OE1 2.76Å; K188-E241 PolarHBondContact NZ-OE1 3.41Å; K188-E241 IonicContact NZ-OE2 3.26Å; K188-E241 PolarHBondContact NZ-OE2 3.4Å
189I93.1Very high90.2Very high0 Ų038.2 Ų38.20%020%0.195CC..Hα-helixtrans-64.8-38.5179.4-73.1-62000111.9Y185 P186 M192 G193 Y216 F219 T220 F235Y185-I189 HydrophobicContact CD1-CG1 4.41Å; Y185-I189 HydrophobicContact CD2-CG1 4.03Å; Y185-I189 HydrophobicContact CE1-CG1 3.97Å; Y185-I189 HydrophobicContact CE2-CD1 4.02Å; Y185-I189 HydrophobicContact CE2-CG1 3.53Å; Y185-I189 HydrophobicContact CG-CG1 4.42Å; Y185-I189 VanDerWaalsContact CZ-CG1 3.5Å; Y185-I189 WeakPolarHBondContact O-CB 3.45Å; Y185-I189 WeakPolarHBondContact O-CG1 3.23Å; Y185-I189 PolarHBondContact O-N 3.33Å; P186-I189 PolarHBondContact O-N 3.15Å; I189-M192 PolarHBondContact O-N 2.87Å; I189-G193 PolarHBondContact O-N 3.41Å; I189-Y216 HydrophobicContact CG2-CE2 4.42Å; I189-Y216 WeakPolarHBondContact CG2-OH 3.14Å; I189-Y216 PolarHBondContact O-OH 2.86Å; I189-F219 HydrophobicContact CD1-CE1 3.75Å; I189-F219 HydrophobicContact CD1-CZ 4.48Å; I189-T220 HydrophobicContact CG2-CG2 3.32Å; I189-F235 HydrophobicContact CD1-CD2 4.43Å; I189-F235 HydrophobicContact CD1-CE2 3.58Å; I189-F235 HydrophobicContact CD1-CZ 4.35Å; I189-F235 HydrophobicContact CG1-CE2 3.89Å
190T95.2Very high90.8Very high0 Ų037 Ų370%019%0.189CC..Hα-helixtrans-65.9-38.2175.348.20000112.2R126 I130 A157 P186 T187 K188 G193 A194R126-T190 HydrophobicContact CG-CG2 3.88Å; I130-T190 HydrophobicContact CD1-CG2 4.03Å; A157-T190 HydrophobicContact CB-CG2 4.04Å; A157-T190 VanDerWaalsContact CB-OG1 3.31Å; A157-T190 WeakPolarHBondContact CB-OG1 3.34Å; P186-T190 WeakPolarHBondContact O-CB 3.18Å; P186-T190 WeakPolarHBondContact O-CG2 3.09Å; P186-T190 PolarHBondContact O-N 3.28Å; P186-T190 PolarHBondContact O-OG1 3.14Å; T187-T190 VanDerWaalsContact C-OG1 3.22Å; T187-T190 VanDerWaalsContact CA-OG1 3.26Å; T187-T190 WeakPolarHBondContact CA-OG1 3.39Å; T187-T190 PolarHBondContact O-OG1 3.05Å; K188-T190 VanDerWaalsContact C-N 3.34Å; K188-T190 PolarHBondContact O-N 3.39Å; T190-G193 PolarHBondContact O-N 2.98Å; T190-A194 WeakPolarHBondContact O-CB 3.48Å; T190-A194 PolarHBondContact O-N 3.46Å
191L95.1Very high91.5Very high50 Ų5033.5 Ų33.526%0.26217%0.17SC..Hα-helixtrans-65.2-46.6176.8178.761.8000110.3I149 W153 M183 T187 K188 G193 A194 V195I149-L191 HydrophobicContact CG2-CD1 3.95Å; W153-L191 HydrophobicContact CB-CD1 4.44Å; W153-L191 HydrophobicContact CD2-CD1 3.96Å; W153-L191 HydrophobicContact CE3-CD1 4.22Å; W153-L191 HydrophobicContact CG-CB 4.34Å; W153-L191 HydrophobicContact CG-CD1 4.07Å; M183-L191 HydrophobicContact CE-CD2 4.49Å; M183-L191 HydrophobicContact SD-CD2 4.38Å; T187-L191 WeakPolarHBondContact O-CB 3.29Å; T187-L191 PolarHBondContact O-N 2.81Å; K188-L191 PolarHBondContact O-N 2.93Å; L191-G193 VanDerWaalsContact C-N 3.32Å; L191-G193 PolarHBondContact O-N 3.48Å; L191-A194 PolarHBondContact O-N 3.44Å; L191-V195 WeakPolarHBondContact O-CG2 3.15Å; L191-V195 PolarHBondContact O-N 3.12Å
192M94.6Very high92.1Very high56 Ų5630 Ų3028%0.27615%0.153SC..Hα-helixtrans-57-45.4173.7177.9-171.9143.700111.6K188 I189 V195 L196 F219 F237K188-M192 PolarHBondContact O-N 2.99Å; I189-M192 PolarHBondContact O-N 2.87Å; M192-V195 PolarHBondContact O-N 3.22Å; M192-L196 HydrophobicContact CE-CD1 3.79Å; M192-L196 HydrophobicContact CG-CD1 4.24Å; M192-L196 WeakPolarHBondContact O-CG 3.23Å; M192-L196 PolarHBondContact O-N 3.35Å; M192-F219 HydrophobicContact CE-CD1 4.46Å; M192-F219 HydrophobicContact CE-CE1 4.1Å; M192-F237 HydrophobicContact CE-CE2 3.87Å; M192-F237 HydrophobicContact CE-CZ 4.48Å; M192-F237 HydrophobicContact SD-CD2 3.99Å; M192-F237 HydrophobicContact SD-CE2 3.68Å
193G95.8Very high92.5Very high0 Ų032 Ų320%017%0.167CC..Hα-helixtrans-60.7-45.5175.900000112.6I189 T190 L191 V195 L196 F197I189-G193 PolarHBondContact O-N 3.41Å; T190-G193 PolarHBondContact O-N 2.98Å; L191-G193 VanDerWaalsContact C-N 3.32Å; L191-G193 PolarHBondContact O-N 3.48Å; G193-V195 VanDerWaalsContact C-N 3.32Å; G193-V195 PolarHBondContact O-N 3.45Å; G193-L196 PolarHBondContact O-N 3.07Å; G193-F197 WeakPolarHBondContact O-CD2 3.36Å; G193-F197 PolarHBondContact O-N 2.63Å
194A96.8Very high92.8Very high0 Ų038 Ų380%019%0.187CC..Hα-helixtrans-61.5-39.9178.300000112I130 I149 W153 T190 L191 A198I130-A194 HydrophobicContact CG2-CB 4.09Å; I149-A194 HydrophobicContact CG2-CB 4.32Å; I149-A194 WeakPolarHBondContact O-CB 3.49Å; W153-A194 HydrophobicContact CB-CB 4.15Å; T190-A194 WeakPolarHBondContact O-CB 3.48Å; T190-A194 PolarHBondContact O-N 3.46Å; L191-A194 PolarHBondContact O-N 3.44Å; A194-A198 WeakPolarHBondContact O-CB 2.94Å; A194-A198 PolarHBondContact O-N 3.48Å
195V96.1Very high92.8Very high50 Ų5038.7 Ų38.730%0.30319%0.187SC..Hα-helixtrans-62.5-49.6173.1173.80000111.3I149 L191 M192 G193 A198 L199I149-V195 HydrophobicContact CD1-CG2 3.97Å; I149-V195 HydrophobicContact CG1-CG2 4.23Å; I149-V195 HydrophobicContact CG2-CG2 4.08Å; L191-V195 WeakPolarHBondContact O-CG2 3.15Å; L191-V195 PolarHBondContact O-N 3.12Å; M192-V195 PolarHBondContact O-N 3.22Å; G193-V195 VanDerWaalsContact C-N 3.32Å; G193-V195 PolarHBondContact O-N 3.45Å; V195-A198 PolarHBondContact O-N 2.75Å; V195-L199 HydrophobicContact CG1-CD1 3.82Å; V195-L199 HydrophobicContact CG1-CG 4.38Å; V195-L199 WeakPolarHBondContact O-CB 3.29Å; V195-L199 VanDerWaalsContact O-CG 3.29Å; V195-L199 WeakPolarHBondContact O-CG 3.43Å; V195-L199 PolarHBondContact O-N 3.09Å
196L95.6Very high92.7Very high50 Ų5043.8 Ų43.826%0.26223%0.225SC..Hα-helixtrans-60.7-47.9-179.5-71.4173.5000112M192 G193 L199 Q200 L212 Y216M192-L196 HydrophobicContact CE-CD1 3.79Å; M192-L196 HydrophobicContact CG-CD1 4.24Å; M192-L196 WeakPolarHBondContact O-CG 3.23Å; M192-L196 PolarHBondContact O-N 3.35Å; G193-L196 PolarHBondContact O-N 3.07Å; L196-L199 PolarHBondContact O-N 3.37Å; L196-Q200 WeakPolarHBondContact O-CB 3.35Å; L196-Q200 PolarHBondContact O-N 3Å; L196-L212 HydrophobicContact CB-CD2 4.47Å; L196-Y216 HydrophobicContact CD1-CD2 4.36Å
197F96.3Very high92.7Very high1 Ų145 Ų450%0.00423%0.232CC..Hα-helixtrans-68.6-35.5178.9-70.1-58.8000112.3T127 I130 L131 V134 G193 Q200 E201 L212 M213 Y216T127-F197 HydrophobicContact CG2-CE2 4.01Å; T127-F197 HydrophobicContact CG2-CZ 3.78Å; I130-F197 HydrophobicContact CG2-CD2 3.84Å; I130-F197 HydrophobicContact CG2-CE2 4.44Å; L131-F197 HydrophobicContact CD1-CB 4.02Å; L131-F197 HydrophobicContact CD1-CD1 3.54Å; L131-F197 HydrophobicContact CD1-CE1 4.12Å; L131-F197 HydrophobicContact CD1-CG 3.8Å; V134-F197 HydrophobicContact CB-CB 4.5Å; V134-F197 HydrophobicContact CG1-CB 4.38Å; V134-F197 HydrophobicContact CG2-CB 4.11Å; G193-F197 WeakPolarHBondContact O-CD2 3.36Å; G193-F197 PolarHBondContact O-N 2.63Å; F197-Q200 WeakPolarHBondContact O-CB 3.37Å; F197-Q200 PolarHBondContact O-N 3.42Å; F197-E201 WeakPolarHBondContact O-CG 3.3Å; F197-E201 PolarHBondContact O-N 3.38Å; F197-L212 HydrophobicContact CD1-CD2 3.73Å; F197-L212 HydrophobicContact CD1-CG 4.11Å; F197-L212 HydrophobicContact CE1-CB 4.36Å; F197-L212 HydrophobicContact CE1-CD2 4.01Å; F197-L212 HydrophobicContact CE1-CG 3.85Å; F197-M213 HydrophobicContact CE1-CB 4.36Å; F197-Y216 AromaticContact CE2-CD1 3.77Å; F197-Y216 HydrophobicContact CE2-CD1 3.77Å; F197-Y216 HydrophobicContact CE2-CE1 4.13Å; F197-Y216 HydrophobicContact CE2-CG 4.06Å; F197-Y216 HydrophobicContact CZ-CD1 4.01Å; F197-Y216 HydrophobicContact CZ-CG 4.13Å
198A95.1Very high92.6Very high0 Ų048.7 Ų48.70%025%0.249CC..Hα-helixtrans-67.3-42.1175.400000112.4V134 M148 I149 A194 V195 Q200 E201 T202V134-A198 HydrophobicContact CG1-CB 4.27Å; M148-A198 HydrophobicContact CB-CB 3.92Å; I149-A198 HydrophobicContact CG1-CB 3.66Å; A194-A198 WeakPolarHBondContact O-CB 2.94Å; A194-A198 PolarHBondContact O-N 3.48Å; V195-A198 PolarHBondContact O-N 2.75Å; A198-Q200 PolarHBondContact O-N 2.86Å; A198-E201 PolarHBondContact O-N 3.44Å; A198-T202 PolarHBondContact O-N 2.87Å; A198-T202 PolarHBondContact O-OG1 3.35Å
199L93.8Very high92.6Very high55 Ų5550.4 Ų50.429%0.28826%0.256SS..Hα-helixtrans-62.8-34.5174.3-72.9171.6000112.1L145 V195 L196 T202 Q203 Y204 L205L145-L199 HydrophobicContact CD1-CD2 3.76Å; V195-L199 HydrophobicContact CG1-CD1 3.82Å; V195-L199 HydrophobicContact CG1-CG 4.38Å; V195-L199 WeakPolarHBondContact O-CB 3.29Å; V195-L199 VanDerWaalsContact O-CG 3.29Å; V195-L199 WeakPolarHBondContact O-CG 3.43Å; V195-L199 PolarHBondContact O-N 3.09Å; L196-L199 PolarHBondContact O-N 3.37Å; L199-T202 WeakPolarHBondContact CA-OG1 3.25Å; L199-T202 PolarHBondContact O-OG1 2.85Å; L199-Q203 PolarHBondContact O-N 2.78Å; L199-Y204 HydrophobicContact CD2-CD2 4.25Å; L199-Y204 HydrophobicContact CD2-CG 4.39Å; L199-Y204 PolarHBondContact O-N 3.34Å; L199-L205 HydrophobicContact CB-CB 4.41Å; L199-L205 PolarHBondContact O-N 3.27Å; L199-L205 VanDerWaalsContact O-N 3.16Å
200Q94.4Very high92.5Very high12 Ų1255 Ų556%0.05627%0.274CS..Hα-helixtrans-68.4-45.7174.6176.756.841.700112.6L196 F197 A198 T202 Q203 L205 V207 L212L196-Q200 WeakPolarHBondContact O-CB 3.35Å; L196-Q200 PolarHBondContact O-N 3Å; F197-Q200 WeakPolarHBondContact O-CB 3.37Å; F197-Q200 PolarHBondContact O-N 3.42Å; A198-Q200 PolarHBondContact O-N 2.86Å; Q200-T202 VanDerWaalsContact C-N 3.33Å; Q200-T202 PolarHBondContact O-N 3.11Å; Q200-Q203 PolarHBondContact O-N 2.85Å; Q200-Q203 PolarHBondContact O-NE2 3.49Å; Q200-L205 HydrophobicContact CB-CD2 4.49Å; Q200-L205 PolarHBondContact OE1-O 2.99Å; Q200-V207 PolarHBondContact NE2-O 3.2Å; Q200-V207 PolarHBondContact OE1-O 3.48Å; Q200-V207 VanDerWaalsContact OE1-O 3.05Å; Q200-L212 HydrophobicContact CB-CD2 3.55Å; Q200-L212 HydrophobicContact CG-CD2 3.78Å
201E91.4Very high92.4Very high41 Ų4156.7 Ų56.719%0.19228%0.282CS..Hα-helixtrans-64.9-38.1178.4-70.9-66.5158.300111.7V134 M148 F197 A198 Q203 K209V134-E201 HydrophobicContact CG1-CB 4.38Å; V134-E201 HydrophobicContact CG1-CG 3.75Å; M148-E201 HydrophobicContact CE-CB 3.45Å; M148-E201 VanDerWaalsContact CE-CB 3.45Å; M148-E201 HydrophobicContact CE-CG 4.19Å; F197-E201 WeakPolarHBondContact O-CG 3.3Å; F197-E201 PolarHBondContact O-N 3.38Å; A198-E201 PolarHBondContact O-N 3.44Å; E201-Q203 PolarHBondContact O-N 3.19Å; E201-K209 WeakPolarHBondContact OE1-CD 3.4Å; E201-K209 VanDerWaalsContact OE1-CE 3.25Å; E201-K209 WeakPolarHBondContact OE1-CE 3.45Å; E201-K209 IonicContact OE1-NZ 3.73Å; E201-K209 PolarHBondContact OE1-NZ 3.39Å
202T89.1Confident92.4Very high21 Ų2155.1 Ų55.113%0.12927%0.273CS..THydrogen-bonded Turntrans-79.99.2177.550.30000114.3M148 A198 L199 Q200 Y204M148-T202 HydrophobicContact CE-CG2 4.23Å; M148-T202 HydrophobicContact SD-CG2 3.78Å; A198-T202 PolarHBondContact O-N 2.87Å; A198-T202 PolarHBondContact O-OG1 3.35Å; L199-T202 WeakPolarHBondContact CA-OG1 3.25Å; L199-T202 PolarHBondContact O-OG1 2.85Å; Q200-T202 VanDerWaalsContact C-N 3.33Å; Q200-T202 PolarHBondContact O-N 3.11Å; T202-Y204 PolarHBondContact O-N 3.19Å; T202-Y204 VanDerWaalsContact O-N 3.11Å; T202-Y204 WeakPolarHBondContact OG1-CD2 3.46Å
203Q87.8Confident92.4Very high146 Ų14652.9 Ų52.968%0.68226%0.262SS*.THydrogen-bonded Turntrans60.714.2178.1-55.4-64.3-57.100115.8L199 Q200 E201 L205L199-Q203 PolarHBondContact O-N 2.78Å; Q200-Q203 PolarHBondContact O-N 2.85Å; Q200-Q203 PolarHBondContact O-NE2 3.49Å; E201-Q203 PolarHBondContact O-N 3.19Å; Q203-L205 VanDerWaalsContact C-N 3.3Å
204Y88.3Confident92.3Very high186 Ų18653.9 Ų53.973%0.72927%0.267SS*.SBendtrans-72.5-27.2170.3-75.5-69.8000112.3L145 L199 T202L145-Y204 HydrophobicContact CD1-CD2 4.43Å; L199-Y204 HydrophobicContact CD2-CD2 4.25Å; L199-Y204 HydrophobicContact CD2-CG 4.39Å; L199-Y204 PolarHBondContact O-N 3.34Å; T202-Y204 PolarHBondContact O-N 3.19Å; T202-Y204 VanDerWaalsContact O-N 3.11Å; T202-Y204 WeakPolarHBondContact OG1-CD2 3.46Å
205L88.5Confident92.2Very high53 Ų5359.5 Ų59.528%0.27729%0.292SS..SBendtrans-105116.9173.9-166.672.3000109.2L199 Q200 Q203 V207 L212L199-L205 HydrophobicContact CB-CB 4.41Å; L199-L205 PolarHBondContact O-N 3.27Å; L199-L205 VanDerWaalsContact O-N 3.16Å; Q200-L205 HydrophobicContact CB-CD2 4.49Å; Q200-L205 PolarHBondContact OE1-O 2.99Å; Q203-L205 VanDerWaalsContact C-N 3.3Å; L205-V207 HydrophobicContact CD1-CG2 4.37Å; L205-V207 HydrophobicContact CD2-CB 4.27Å; L205-V207 HydrophobicContact CD2-CG2 4.17Å; L205-V207 HydrophobicContact CG-CB 4.23Å; L205-V207 HydrophobicContact CG-CG2 3.91Å; L205-V207 PolarHBondContact O-N 2.78Å; L205-V207 VanDerWaalsContact O-N 3.13Å; L205-L212 HydrophobicContact CD2-CD1 4.32Å; L205-L212 HydrophobicContact CD2-CD2 4.1Å
206S86.6Confident92.2Very high123 Ų12357.4 Ų57.486%0.8628%0.279SS*.  trans-87.248.3179.354.30000112.4
207V89.5Confident92.3Very high62 Ų6255.3 Ų55.338%0.37627%0.268SS..SBendtrans-106.4162.9173.4177.50000107.9Q200 L205 H211 L212Q200-V207 PolarHBondContact NE2-O 3.2Å; Q200-V207 PolarHBondContact OE1-O 3.48Å; Q200-V207 VanDerWaalsContact OE1-O 3.05Å; L205-V207 HydrophobicContact CD1-CG2 4.37Å; L205-V207 HydrophobicContact CD2-CB 4.27Å; L205-V207 HydrophobicContact CD2-CG2 4.17Å; L205-V207 HydrophobicContact CG-CB 4.23Å; L205-V207 HydrophobicContact CG-CG2 3.91Å; L205-V207 PolarHBondContact O-N 2.78Å; L205-V207 VanDerWaalsContact O-N 3.13Å; V207-H211 HydrophobicContact CG1-CB 4.35Å; V207-L212 HydrophobicContact CG1-CB 4.24Å
208E90.6Very high92.2Very high80 Ų8059 Ų5937%0.37429%0.291SS..  trans-83138.2170.4-166.7171179.100111.2R210 H211 L212E208-R210 HydrophobicContact CG-CB 4.5Å; E208-R210 PolarHBondContact O-N 3.26Å; E208-R210 IonicContact OE1-CZ 2.93Å; E208-R210 IonicContact OE1-NE 2.63Å; E208-R210 PolarHBondContact OE1-NE 3.44Å; E208-R210 IonicContact OE1-NH2 3.48Å; E208-R210 PolarHBondContact OE1-NH2 3.38Å; E208-R210 IonicContact OE2-NH2 3.32Å; E208-H211 HydrophobicContact CB-CB 4.42Å; E208-H211 PolarHBondContact O-N 2.98Å; E208-H211 VanDerWaalsContact O-N 3.14Å; E208-H211 IonicContact OE2-CD2 3.73Å; E208-H211 IonicContact OE2-NE2 3.54Å; E208-L212 PolarHBondContact O-N 2.96Å
209K90.8Very high92.2Very high72 Ų7261.5 Ų61.531%0.31330%0.301SS..Hα-helixtrans-52-40.7178.6-179.6174177.41620113.2L131 E201 L212 M213L131-K209 HydrophobicContact CD1-CG 4.48Å; L131-K209 HydrophobicContact CD2-CG 4.34Å; E201-K209 WeakPolarHBondContact OE1-CD 3.4Å; E201-K209 VanDerWaalsContact OE1-CE 3.25Å; E201-K209 WeakPolarHBondContact OE1-CE 3.45Å; E201-K209 IonicContact OE1-NZ 3.73Å; E201-K209 PolarHBondContact OE1-NZ 3.39Å; K209-L212 PolarHBondContact O-N 3.18Å; K209-M213 WeakPolarHBondContact O-CB 3.48Å; K209-M213 PolarHBondContact O-N 2.9Å
210R92.5Very high92.3Very high98 Ų9858.9 Ų58.937%0.3729%0.288SS..Hα-helixtrans-65.4-46.5-179.8-61.1-176.4-77.5168.7-5.4111.2D14 A17 E208 M213 L214D14-R210 WeakPolarHBondContact OD1-CD 3.46Å; D14-R210 IonicContact OD1-CZ 3.16Å; D14-R210 VanDerWaalsContact OD1-CZ 3.32Å; D14-R210 IonicContact OD1-NE 3.2Å; D14-R210 PolarHBondContact OD1-NE 2.9Å; D14-R210 IonicContact OD1-NH1 3.52Å; D14-R210 PolarHBondContact OD1-NH1 3.17Å; D14-R210 IonicContact OD2-NH1 2.73Å; D14-R210 PolarHBondContact OD2-NH1 2.98Å; A17-R210 HydrophobicContact CB-CG 4.27Å; E208-R210 HydrophobicContact CG-CB 4.5Å; E208-R210 PolarHBondContact O-N 3.26Å; E208-R210 IonicContact OE1-CZ 2.93Å; E208-R210 IonicContact OE1-NE 2.63Å; E208-R210 PolarHBondContact OE1-NE 3.44Å; E208-R210 IonicContact OE1-NH2 3.48Å; E208-R210 PolarHBondContact OE1-NH2 3.38Å; E208-R210 IonicContact OE2-NH2 3.32Å; R210-M213 WeakPolarHBondContact O-CB 3.23Å; R210-M213 PolarHBondContact O-N 3.4Å; R210-L214 PolarHBondContact O-N 2.96Å
211H92.7Very high92.4Very high35 Ų3559.8 Ų59.816%0.16229%0.294CS..Hα-helixtrans-64.1-43.4174.1-63.4-39.8000112.8D10 S13 V207 E208 M213 L214 F215D10-H211 IonicContact OD1-CE1 3Å; D10-H211 PolarHBondContact OD1-CE1 2.83Å; D10-H211 IonicContact OD1-NE2 3.34Å; D10-H211 PolarHBondContact OD1-NE2 2.88Å; S13-H211 PolarHBondContact OG-ND1 3.23Å; V207-H211 HydrophobicContact CG1-CB 4.35Å; E208-H211 HydrophobicContact CB-CB 4.42Å; E208-H211 PolarHBondContact O-N 2.98Å; E208-H211 VanDerWaalsContact O-N 3.14Å; E208-H211 IonicContact OE2-CD2 3.73Å; E208-H211 IonicContact OE2-NE2 3.54Å; H211-M213 VanDerWaalsContact C-N 3.3Å; H211-M213 PolarHBondContact O-N 3.35Å; H211-L214 PolarHBondContact O-N 3.09Å; H211-F215 HydrophobicContact CB-CD2 4.33Å; H211-F215 HydrophobicContact CB-CE2 4.11Å; H211-F215 WeakPolarHBondContact O-CD2 3.48Å; H211-F215 PolarHBondContact O-N 3.39Å
212L94.1Very high92.5Very high17 Ų1762 Ų629%0.08931%0.31CS..Hα-helixtrans-61.5-41.2177.5-175.862.7000111.4L196 F197 Q200 L205 V207 E208 K209 Y216L196-L212 HydrophobicContact CB-CD2 4.47Å; F197-L212 HydrophobicContact CD1-CD2 3.73Å; F197-L212 HydrophobicContact CD1-CG 4.11Å; F197-L212 HydrophobicContact CE1-CB 4.36Å; F197-L212 HydrophobicContact CE1-CD2 4.01Å; F197-L212 HydrophobicContact CE1-CG 3.85Å; Q200-L212 HydrophobicContact CB-CD2 3.55Å; Q200-L212 HydrophobicContact CG-CD2 3.78Å; L205-L212 HydrophobicContact CD2-CD1 4.32Å; L205-L212 HydrophobicContact CD2-CD2 4.1Å; V207-L212 HydrophobicContact CG1-CB 4.24Å; E208-L212 PolarHBondContact O-N 2.96Å; K209-L212 PolarHBondContact O-N 3.18Å; L212-Y216 VanDerWaalsContact O-CB 3.22Å; L212-Y216 WeakPolarHBondContact O-CB 3.15Å; L212-Y216 PolarHBondContact O-N 2.83Å
213M94.4Very high92.6Very high9 Ų962 Ų624%0.04431%0.309CS..Hα-helixtrans-59-47.4173.9-175.9-165.3-78.200111.4L16 A17 T127 W128 L131 F197 K209 R210 H211 T217L16-M213 HydrophobicContact CD2-CG 4.29Å; L16-M213 HydrophobicContact CD2-SD 4.44Å; L16-M213 HydrophobicContact CG-SD 4.28Å; A17-M213 HydrophobicContact CB-CE 4.44Å; A17-M213 HydrophobicContact CB-SD 4.06Å; T127-M213 HydrophobicContact CG2-CG 3.87Å; W128-M213 HydrophobicContact CD2-CE 4.46Å; L131-M213 HydrophobicContact CD2-CE 3.13Å; F197-M213 HydrophobicContact CE1-CB 4.36Å; K209-M213 WeakPolarHBondContact O-CB 3.48Å; K209-M213 PolarHBondContact O-N 2.9Å; R210-M213 WeakPolarHBondContact O-CB 3.23Å; R210-M213 PolarHBondContact O-N 3.4Å; H211-M213 VanDerWaalsContact C-N 3.3Å; H211-M213 PolarHBondContact O-N 3.35Å; M213-T217 VanDerWaalsContact O-CB 3.23Å; M213-T217 WeakPolarHBondContact O-CB 3.3Å; M213-T217 PolarHBondContact O-N 2.87Å; M213-T217 PolarHBondContact O-OG1 2.78Å
214L94.8Very high92.8Very high20 Ų2057.2 Ų57.211%0.10529%0.286CS..Hα-helixtrans-59.8-54.4178.2-177.169.8000111.5L9 L12 L16 R210 H211 Y216 T217 V218L9-L214 HydrophobicContact CD2-CD2 4.35Å; L12-L214 HydrophobicContact CB-CD2 4.23Å; L16-L214 HydrophobicContact CB-CD1 4.35Å; L16-L214 HydrophobicContact CD2-CB 4.28Å; L16-L214 HydrophobicContact CD2-CD1 3.81Å; R210-L214 PolarHBondContact O-N 2.96Å; H211-L214 PolarHBondContact O-N 3.09Å; L214-Y216 PolarHBondContact O-N 3.22Å; L214-T217 PolarHBondContact O-N 3.5Å; L214-V218 HydrophobicContact CD1-CG2 4.35Å; L214-V218 WeakPolarHBondContact O-CG2 3.16Å; L214-V218 PolarHBondContact O-N 2.86Å
215F94.8Very high93Very high118 Ų11849.9 Ų49.952%0.51826%0.261SS..Hα-helixtrans-61.2-44.3-178.3-70.4-55000112.2H211 F219H211-F215 HydrophobicContact CB-CD2 4.33Å; H211-F215 HydrophobicContact CB-CE2 4.11Å; H211-F215 WeakPolarHBondContact O-CD2 3.48Å; H211-F215 PolarHBondContact O-N 3.39Å; F215-F219 WeakPolarHBondContact O-CB 3.13Å; F215-F219 PolarHBondContact O-N 2.95Å
216Y95.9Very high93.1Very high7 Ų753.4 Ų53.43%0.02727%0.27CS..Hα-helixtrans-64-42.4177.2179.6-95.6000111.7T127 I130 I189 L196 F197 L212 L214 F219 T220T127-Y216 HydrophobicContact CG2-CD1 3.57Å; T127-Y216 HydrophobicContact CG2-CE1 4.1Å; T127-Y216 VanDerWaalsContact OG1-CD1 3.32Å; T127-Y216 WeakPolarHBondContact OG1-CD1 3.3Å; T127-Y216 WeakPolarHBondContact OG1-CE1 3.35Å; I130-Y216 HydrophobicContact CD1-CE1 4.03Å; I130-Y216 WeakPolarHBondContact CD1-OH 3.49Å; I189-Y216 HydrophobicContact CG2-CE2 4.42Å; I189-Y216 WeakPolarHBondContact CG2-OH 3.14Å; I189-Y216 PolarHBondContact O-OH 2.86Å; L196-Y216 HydrophobicContact CD1-CD2 4.36Å; F197-Y216 AromaticContact CE2-CD1 3.77Å; F197-Y216 HydrophobicContact CE2-CD1 3.77Å; F197-Y216 HydrophobicContact CE2-CE1 4.13Å; F197-Y216 HydrophobicContact CE2-CG 4.06Å; F197-Y216 HydrophobicContact CZ-CD1 4.01Å; F197-Y216 HydrophobicContact CZ-CG 4.13Å; L212-Y216 VanDerWaalsContact O-CB 3.22Å; L212-Y216 WeakPolarHBondContact O-CB 3.15Å; L212-Y216 PolarHBondContact O-N 2.83Å; L214-Y216 PolarHBondContact O-N 3.22Å; Y216-F219 PolarHBondContact O-N 3.07Å; Y216-T220 HydrophobicContact CD1-CG2 4.14Å; Y216-T220 HydrophobicContact CD2-CG2 4.32Å; Y216-T220 HydrophobicContact CE1-CG2 3.71Å; Y216-T220 HydrophobicContact CE2-CG2 3.88Å; Y216-T220 HydrophobicContact CG-CG2 4.44Å; Y216-T220 WeakPolarHBondContact O-CG2 3.35Å; Y216-T220 PolarHBondContact O-N 3.27Å; Y216-T220 PolarHBondContact O-OG1 3.11Å; Y216-T220 VanDerWaalsContact O-OG1 3.09Å
217T96.6Very high93.3Very high6 Ų648.8 Ų48.84%0.03724%0.236CC..Hα-helixtrans-63.8-48.7178.5-59.90000111.3L16 V124 T127 M213 L214 F219 T220 V221L16-T217 HydrophobicContact CD1-CG2 4.43Å; L16-T217 HydrophobicContact CD2-CG2 4.08Å; V124-T217 HydrophobicContact CB-CG2 4.26Å; V124-T217 HydrophobicContact CG1-CG2 4.35Å; V124-T217 HydrophobicContact CG2-CG2 3.74Å; T127-T217 WeakPolarHBondContact CG2-OG1 3.02Å; T127-T217 PolarHBondContact OG1-OG1 3.29Å; M213-T217 VanDerWaalsContact O-CB 3.23Å; M213-T217 WeakPolarHBondContact O-CB 3.3Å; M213-T217 PolarHBondContact O-N 2.87Å; M213-T217 PolarHBondContact O-OG1 2.78Å; L214-T217 PolarHBondContact O-N 3.5Å; T217-F219 VanDerWaalsContact C-N 3.3Å; T217-F219 PolarHBondContact O-N 3.26Å; T217-T220 PolarHBondContact O-N 3.18Å; T217-T220 PolarHBondContact O-OG1 3.38Å; T217-V221 HydrophobicContact CG2-CG2 4.26Å; T217-V221 WeakPolarHBondContact O-CB 3.47Å; T217-V221 VanDerWaalsContact O-CG2 3.24Å; T217-V221 WeakPolarHBondContact O-CG2 3.27Å; T217-V221 PolarHBondContact O-N 3.25Å
218V95.6Very high93.3Very high78 Ų7848 Ų4847%0.47323%0.228SC..Hα-helixtrans-59-45.6176.5172.10000110.2L214 T220 V221 V222L214-V218 HydrophobicContact CD1-CG2 4.35Å; L214-V218 WeakPolarHBondContact O-CG2 3.16Å; L214-V218 PolarHBondContact O-N 2.86Å; V218-T220 PolarHBondContact O-N 2.98Å; V218-V221 PolarHBondContact O-N 3Å; V218-V222 HydrophobicContact CG1-CG2 4.18Å; V218-V222 WeakPolarHBondContact O-CB 3.48Å; V218-V222 VanDerWaalsContact O-CG2 3.24Å; V218-V222 WeakPolarHBondContact O-CG2 3.49Å; V218-V222 PolarHBondContact O-N 3.29Å
219F95Very high93.3Very high52 Ų5249.4 Ų49.423%0.22824%0.238CC..Hα-helixtrans-58.4-49.5178.1175.7-100.3000112.3I189 M192 F215 Y216 T217 N223 P236 F237I189-F219 HydrophobicContact CD1-CE1 3.75Å; I189-F219 HydrophobicContact CD1-CZ 4.48Å; M192-F219 HydrophobicContact CE-CD1 4.46Å; M192-F219 HydrophobicContact CE-CE1 4.1Å; F215-F219 WeakPolarHBondContact O-CB 3.13Å; F215-F219 PolarHBondContact O-N 2.95Å; Y216-F219 PolarHBondContact O-N 3.07Å; T217-F219 VanDerWaalsContact C-N 3.3Å; T217-F219 PolarHBondContact O-N 3.26Å; F219-N223 VanDerWaalsContact CD2-ND2 3.31Å; F219-N223 WeakPolarHBondContact CD2-ND2 3.47Å; F219-N223 WeakPolarHBondContact CE2-ND2 3.41Å; F219-N223 VanDerWaalsContact CZ-ND2 3.34Å; F219-N223 WeakPolarHBondContact CZ-ND2 3.48Å; F219-N223 WeakPolarHBondContact O-CB 3.29Å; F219-N223 PolarHBondContact O-N 2.62Å; F219-N223 PolarHBondContact O-ND2 3.46Å; F219-P236 HydrophobicContact CZ-CG 4.03Å; F219-F237 AromaticContact CE1-CE2 3.85Å; F219-F237 HydrophobicContact CE1-CE2 3.85Å; F219-F237 AromaticContact CE2-CE2 3.98Å; F219-F237 HydrophobicContact CE2-CE2 3.98Å; F219-F237 AromaticContact CE2-CZ 3.9Å; F219-F237 HydrophobicContact CE2-CZ 3.9Å; F219-F237 HydrophobicContact CZ-CD2 4.17Å; F219-F237 AromaticContact CZ-CE2 3.22Å; F219-F237 HydrophobicContact CZ-CE2 3.22Å; F219-F237 AromaticContact CZ-CZ 3.64Å; F219-F237 HydrophobicContact CZ-CZ 3.64Å
220T94.6Very high93Very high0 Ų049.8 Ų49.80%025%0.247CC..Hα-helixtrans-67.2-41.5-178.755.30000112.4I189 Y216 T217 V218 K224I189-T220 HydrophobicContact CG2-CG2 3.32Å; Y216-T220 HydrophobicContact CD1-CG2 4.14Å; Y216-T220 HydrophobicContact CD2-CG2 4.32Å; Y216-T220 HydrophobicContact CE1-CG2 3.71Å; Y216-T220 HydrophobicContact CE2-CG2 3.88Å; Y216-T220 HydrophobicContact CG-CG2 4.44Å; Y216-T220 WeakPolarHBondContact O-CG2 3.35Å; Y216-T220 PolarHBondContact O-N 3.27Å; Y216-T220 PolarHBondContact O-OG1 3.11Å; Y216-T220 VanDerWaalsContact O-OG1 3.09Å; T217-T220 PolarHBondContact O-N 3.18Å; T217-T220 PolarHBondContact O-OG1 3.38Å; V218-T220 PolarHBondContact O-N 2.98Å; T220-K224 WeakPolarHBondContact O-CB 3.42Å; T220-K224 PolarHBondContact O-N 3.34Å
221V95.9Very high92.4Very high31 Ų3148.6 Ų48.619%0.18826%0.264CS..Hα-helixtrans-62.8-50.4176.7169.80000111.1A120 E123 V124 T217 V218 N223 K224 T225A120-V221 HydrophobicContact CB-CG1 3.79Å; E123-V221 HydrophobicContact CB-CG2 4Å; V124-V221 HydrophobicContact CG2-CG2 4.11Å; T217-V221 HydrophobicContact CG2-CG2 4.26Å; T217-V221 WeakPolarHBondContact O-CB 3.47Å; T217-V221 VanDerWaalsContact O-CG2 3.24Å; T217-V221 WeakPolarHBondContact O-CG2 3.27Å; T217-V221 PolarHBondContact O-N 3.25Å; V218-V221 PolarHBondContact O-N 3Å; V221-N223 PolarHBondContact O-N 2.94Å; V221-K224 PolarHBondContact O-N 3.36Å; V221-T225 WeakPolarHBondContact O-CB 3.23Å; V221-T225 PolarHBondContact O-N 3.1Å; V221-T225 PolarHBondContact O-OG1 2.86Å
222V94Very high91.5Very high87 Ų8748.8 Ų48.853%0.52727%0.27SS..Hα-helixtrans-60.4-47-179.8169.20000111V218 T225 R226V218-V222 HydrophobicContact CG1-CG2 4.18Å; V218-V222 WeakPolarHBondContact O-CB 3.48Å; V218-V222 VanDerWaalsContact O-CG2 3.24Å; V218-V222 WeakPolarHBondContact O-CG2 3.49Å; V218-V222 PolarHBondContact O-N 3.29Å; V222-T225 PolarHBondContact O-N 3.43Å; V222-R226 VanDerWaalsContact O-CB 3.31Å; V222-R226 WeakPolarHBondContact O-CB 2.87Å; V222-R226 PolarHBondContact O-N 3.48Å
223N91.9Very high90.1Very high21 Ų2152.8 Ų52.811%0.11230%0.299CS..Hα-helixtrans-65.4-41.9178.8-79.9-79.9000112Y185 F219 V221 T225 R226 M227Y185-N223 HydrophobicContact CE2-CB 4.39Å; Y185-N223 WeakPolarHBondContact OH-CB 3.28Å; F219-N223 VanDerWaalsContact CD2-ND2 3.31Å; F219-N223 WeakPolarHBondContact CD2-ND2 3.47Å; F219-N223 WeakPolarHBondContact CE2-ND2 3.41Å; F219-N223 VanDerWaalsContact CZ-ND2 3.34Å; F219-N223 WeakPolarHBondContact CZ-ND2 3.48Å; F219-N223 WeakPolarHBondContact O-CB 3.29Å; F219-N223 PolarHBondContact O-N 2.62Å; F219-N223 PolarHBondContact O-ND2 3.46Å; V221-N223 PolarHBondContact O-N 2.94Å; N223-T225 PolarHBondContact O-N 3.5Å; N223-R226 PolarHBondContact O-N 3.24Å; N223-M227 VanDerWaalsContact O-CG 3.26Å; N223-M227 WeakPolarHBondContact O-CG 3.14Å; N223-M227 PolarHBondContact O-N 3.49Å
224K92.6Very high89Confident47 Ų4755.9 Ų55.920%0.20432%0.321CS..Hα-helixtrans-61.4-46.3177.6-177.862.9173.6178.40111.5E123 T220 V221 M227 M228E123-K224 HydrophobicContact CG-CB 3.76Å; E123-K224 HydrophobicContact CG-CD 4.49Å; E123-K224 HydrophobicContact CG-CG 3.73Å; T220-K224 WeakPolarHBondContact O-CB 3.42Å; T220-K224 PolarHBondContact O-N 3.34Å; V221-K224 PolarHBondContact O-N 3.36Å; K224-M227 PolarHBondContact O-N 3.14Å; K224-M228 WeakPolarHBondContact O-CG 3.49Å; K224-M228 PolarHBondContact O-N 2.84Å; K224-M228 VanDerWaalsContact O-N 3.09Å
225T91.9Very high87.9Confident32 Ų3256.3 Ų56.320%0.19632%0.323CS..Hα-helixtrans-63.7-43.9177.7-57.70000111.2V116 V221 V222 N223 M227 M228 L229V116-T225 HydrophobicContact CG1-CG2 3.56Å; V221-T225 WeakPolarHBondContact O-CB 3.23Å; V221-T225 PolarHBondContact O-N 3.1Å; V221-T225 PolarHBondContact O-OG1 2.86Å; V222-T225 PolarHBondContact O-N 3.43Å; N223-T225 PolarHBondContact O-N 3.5Å; T225-M227 PolarHBondContact O-N 2.99Å; T225-M228 PolarHBondContact O-N 3.49Å; T225-L229 HydrophobicContact CG2-CD1 3.93Å; T225-L229 HydrophobicContact CG2-CG 4.4Å; T225-L229 WeakPolarHBondContact O-CG 3.32Å; T225-L229 PolarHBondContact O-N 2.69Å
226R91Very high86.9Confident126 Ų12653 Ų5348%0.47531%0.313SS..Hα-helixtrans-56.4-48.5173.8179.8-172.1178.5-90.6-2.2111.7V222 N223 M228 L229 T230V222-R226 VanDerWaalsContact O-CB 3.31Å; V222-R226 WeakPolarHBondContact O-CB 2.87Å; V222-R226 PolarHBondContact O-N 3.48Å; N223-R226 PolarHBondContact O-N 3.24Å; R226-M228 VanDerWaalsContact C-N 3.29Å; R226-M228 PolarHBondContact O-N 2.9Å; R226-L229 PolarHBondContact O-N 2.82Å; R226-T230 HydrophobicContact CG-CG2 4.27Å; R226-T230 WeakPolarHBondContact O-CB 3.48Å; R226-T230 WeakPolarHBondContact O-CG2 3.42Å; R226-T230 PolarHBondContact O-N 2.83Å; R226-T230 PolarHBondContact O-OG1 2.87Å
227M89.6Confident86Confident26 Ų2655.9 Ų55.913%0.12833%0.326CS..Hα-helixtrans-59.4-40.7179.1-71.41747900111.9Y185 N223 K224 T225 G231Y185-M227 HydrophobicContact CD1-CE 3.96Å; Y185-M227 HydrophobicContact CD1-SD 3.52Å; Y185-M227 VanDerWaalsContact CD1-SD 3.52Å; Y185-M227 HydrophobicContact CD2-CE 3.85Å; Y185-M227 HydrophobicContact CD2-SD 3.41Å; Y185-M227 WeakPolarHBondContact CD2-SD 3.5Å; Y185-M227 HydrophobicContact CE1-SD 3.6Å; Y185-M227 HydrophobicContact CE2-SD 3.5Å; Y185-M227 VanDerWaalsContact CE2-SD 3.5Å; Y185-M227 HydrophobicContact CG-CE 3.56Å; Y185-M227 HydrophobicContact CG-SD 3.45Å; Y185-M227 VanDerWaalsContact CZ-SD 3.6Å; N223-M227 VanDerWaalsContact O-CG 3.26Å; N223-M227 WeakPolarHBondContact O-CG 3.14Å; N223-M227 PolarHBondContact O-N 3.49Å; K224-M227 PolarHBondContact O-N 3.14Å; T225-M227 PolarHBondContact O-N 2.99Å; M227-G231 WeakPolarHBondContact O-CA 3.41Å; M227-G231 PolarHBondContact O-N 3.12Å
228M89.8Confident85.2Confident45 Ų4557.9 Ų57.922%0.22234%0.34CS..Hα-helixtrans-68.1-36.8177.6-69.9-177.667.800113.1R115 V116 S119 K224 T225 R226R115-M228 HydrophobicContact CB-CE 3.99Å; R115-M228 HydrophobicContact CG-CE 3.65Å; V116-M228 HydrophobicContact CG2-CB 4.13Å; V116-M228 HydrophobicContact CG2-CE 3.89Å; V116-M228 HydrophobicContact CG2-SD 4.31Å; S119-M228 WeakPolarHBondContact CB-SD 3.16Å; S119-M228 PolarHBondContact OG-SD 2.88Å; S119-M228 VanDerWaalsContact OG-SD 3.34Å; K224-M228 WeakPolarHBondContact O-CG 3.49Å; K224-M228 PolarHBondContact O-N 2.84Å; K224-M228 VanDerWaalsContact O-N 3.09Å; T225-M228 PolarHBondContact O-N 3.49Å; R226-M228 VanDerWaalsContact C-N 3.29Å; R226-M228 PolarHBondContact O-N 2.9Å
229L89.8Confident84.3Confident111 Ų11158.8 Ų58.858%0.58135%0.347SS*.Hα-helixtrans-77.4-36.2179.9-68.8174000113.1L112 T225 R226L112-L229 HydrophobicContact CD2-CD2 3.97Å; T225-L229 HydrophobicContact CG2-CD1 3.93Å; T225-L229 HydrophobicContact CG2-CG 4.4Å; T225-L229 WeakPolarHBondContact O-CG 3.32Å; T225-L229 PolarHBondContact O-N 2.69Å; R226-L229 PolarHBondContact O-N 2.82Å
230T86.3Confident83.6Confident80 Ų8060.6 Ų60.649%0.49136%0.359SS..Hα-helixtrans-90.4-12.1-177.3560000113.7R226 S232R226-T230 HydrophobicContact CG-CG2 4.27Å; R226-T230 WeakPolarHBondContact O-CB 3.48Å; R226-T230 WeakPolarHBondContact O-CG2 3.42Å; R226-T230 PolarHBondContact O-N 2.83Å; R226-T230 PolarHBondContact O-OG1 2.87Å; T230-S232 PolarHBondContact O-N 2.98Å; T230-S232 VanDerWaalsContact O-N 3.07Å
231G79.6Confident82.9Confident72 Ų7264.2 Ų64.274%0.74238%0.376SS*.  trans65.15.3-174.200000114.3M227M227-G231 WeakPolarHBondContact O-CA 3.41Å; M227-G231 PolarHBondContact O-N 3.12Å
232S72.9Confident82.2Confident40 Ų4065.5 Ų65.528%0.2838%0.377SS..  trans-90.2131.9-179.5178.50000110.7T230 S234T230-S232 PolarHBondContact O-N 2.98Å; T230-S232 VanDerWaalsContact O-N 3.07Å; S232-S234 VanDerWaalsContact C-N 3.31Å; S232-S234 WeakPolarHBondContact OG-CB 3.39Å; S232-S234 PolarHBondContact OG-N 2.97Å; S232-S234 PolarHBondContact OG-OG 3.5Å; S232-S234 VanDerWaalsContact OG-OG 3.1Å
233S65.6Low81.4Confident100 Ų10067.1 Ų67.170%0.69938%0.377SS*.  trans-90.38.7173.656.30000113.3F235S233-F235 PolarHBondContact O-N 3.3Å
234S70.2Confident80.9Confident74 Ų7470.3 Ų70.352%0.51739%0.394SS..  trans-64.5121.9-175.5-62.50000111.7S232S232-S234 VanDerWaalsContact C-N 3.31Å; S232-S234 WeakPolarHBondContact OG-CB 3.39Å; S232-S234 PolarHBondContact OG-N 2.97Å; S232-S234 PolarHBondContact OG-OG 3.5Å; S232-S234 VanDerWaalsContact OG-OG 3.1Å
235F72.5Confident80.2Confident29 Ų2971.9 Ų71.913%0.12740%0.401CS..  trans-68.7128.3174.5-177.9-116.8000110Y185 K188 I189 S233 F237 S238Y185-F235 AromaticContact CD2-CD2 3.79Å; Y185-F235 HydrophobicContact CD2-CD2 3.79Å; Y185-F235 HydrophobicContact CE2-CD2 4.25Å; K188-F235 HydrophobicContact CB-CD2 4.22Å; K188-F235 HydrophobicContact CB-CE2 3.72Å; K188-F235 HydrophobicContact CB-CZ 4.02Å; K188-F235 HydrophobicContact CD-CD1 4.28Å; K188-F235 HydrophobicContact CD-CD2 4.24Å; K188-F235 HydrophobicContact CD-CE1 4.38Å; K188-F235 HydrophobicContact CD-CE2 4.37Å; K188-F235 HydrophobicContact CD-CG 4.23Å; K188-F235 HydrophobicContact CD-CZ 4.47Å; I189-F235 HydrophobicContact CD1-CD2 4.43Å; I189-F235 HydrophobicContact CD1-CE2 3.58Å; I189-F235 HydrophobicContact CD1-CZ 4.35Å; I189-F235 HydrophobicContact CG1-CE2 3.89Å; S233-F235 PolarHBondContact O-N 3.3Å; F235-F237 HydrophobicContact CD1-CB 4.1Å; F235-F237 HydrophobicContact CE1-CB 3.56Å; F235-F237 HydrophobicContact CE1-CD2 4.43Å; F235-F237 HydrophobicContact CZ-CB 4.1Å; F235-F237 HydrophobicContact CZ-CD2 4.12Å; F235-F237 PolarHBondContact O-N 2.77Å; F235-S238 VanDerWaalsContact O-CB 3.25Å; F235-S238 WeakPolarHBondContact O-CB 3.2Å; F235-S238 PolarHBondContact O-N 2.88Å
236P74.1Confident79.7Confident49 Ų4973.7 Ų73.732%0.31841%0.407SS..THydrogen-bonded Turntrans-61.5-30.8-172.824-35.1000112.9F219F219-P236 HydrophobicContact CZ-CG 4.03Å
237F77.3Confident79.2Confident67 Ų6772.5 Ų72.529%0.29441%0.409SS..THydrogen-bonded Turntrans-99.418.1178.5-56.2-64.7000113.6M192 F219 F235 P239 I240 E241M192-F237 HydrophobicContact CE-CE2 3.87Å; M192-F237 HydrophobicContact CE-CZ 4.48Å; M192-F237 HydrophobicContact SD-CD2 3.99Å; M192-F237 HydrophobicContact SD-CE2 3.68Å; F219-F237 AromaticContact CE1-CE2 3.85Å; F219-F237 HydrophobicContact CE1-CE2 3.85Å; F219-F237 AromaticContact CE2-CE2 3.98Å; F219-F237 HydrophobicContact CE2-CE2 3.98Å; F219-F237 AromaticContact CE2-CZ 3.9Å; F219-F237 HydrophobicContact CE2-CZ 3.9Å; F219-F237 HydrophobicContact CZ-CD2 4.17Å; F219-F237 AromaticContact CZ-CE2 3.22Å; F219-F237 HydrophobicContact CZ-CE2 3.22Å; F219-F237 AromaticContact CZ-CZ 3.64Å; F219-F237 HydrophobicContact CZ-CZ 3.64Å; F235-F237 HydrophobicContact CD1-CB 4.1Å; F235-F237 HydrophobicContact CE1-CB 3.56Å; F235-F237 HydrophobicContact CE1-CD2 4.43Å; F235-F237 HydrophobicContact CZ-CB 4.1Å; F235-F237 HydrophobicContact CZ-CD2 4.12Å; F235-F237 PolarHBondContact O-N 2.77Å; F237-P239 VanDerWaalsContact C-N 3.29Å; F237-I240 HydrophobicContact CB-CB 4.39Å; F237-I240 HydrophobicContact CB-CD1 4.41Å; F237-I240 HydrophobicContact CD1-CD1 3.59Å; F237-I240 HydrophobicContact CD1-CG1 4.5Å; F237-I240 HydrophobicContact CE1-CD1 4.31Å; F237-I240 HydrophobicContact CG-CD1 4.41Å; F237-I240 PolarHBondContact O-N 3.42Å; F237-E241 PolarHBondContact O-N 3.21Å
238S79.4Confident78.8Confident49 Ų4977 Ų7734%0.34343%0.433SS..Hα-helixtrans-54-38.3176.9179.10000113.7F235 I240 W242F235-S238 VanDerWaalsContact O-CB 3.25Å; F235-S238 WeakPolarHBondContact O-CB 3.2Å; F235-S238 PolarHBondContact O-N 2.88Å; S238-I240 VanDerWaalsContact C-N 3.33Å; S238-I240 PolarHBondContact O-N 3.16Å; S238-W242 WeakPolarHBondContact O-CB 3.31Å; S238-W242 PolarHBondContact O-N 3.46Å; S238-W242 VanDerWaalsContact O-N 3.09Å
239P76.9Confident78.3Confident96 Ų9682.5 Ų82.562%0.62346%0.456SS*.Hα-helixtrans-64.4-36.5174.6-22.834.6000113.3F237 F243F237-P239 VanDerWaalsContact C-N 3.29Å; P239-F243 WeakPolarHBondContact O-CB 3.11Å; P239-F243 PolarHBondContact O-N 3.08Å
240I78.9Confident77.2Confident90 Ų9079.8 Ų79.846%0.46244%0.441SS..Hα-helixtrans-72.7-43.7179.8-56.2-177.7000110.3F237 S238 W242 F243 L244F237-I240 HydrophobicContact CB-CB 4.39Å; F237-I240 HydrophobicContact CB-CD1 4.41Å; F237-I240 HydrophobicContact CD1-CD1 3.59Å; F237-I240 HydrophobicContact CD1-CG1 4.5Å; F237-I240 HydrophobicContact CE1-CD1 4.31Å; F237-I240 HydrophobicContact CG-CD1 4.41Å; F237-I240 PolarHBondContact O-N 3.42Å; S238-I240 VanDerWaalsContact C-N 3.33Å; S238-I240 PolarHBondContact O-N 3.16Å; I240-W242 VanDerWaalsContact C-N 3.27Å; I240-W242 PolarHBondContact O-N 3.15Å; I240-F243 PolarHBondContact O-N 2.83Å; I240-F243 VanDerWaalsContact O-N 3.16Å; I240-L244 HydrophobicContact CG2-CD1 4.18Å; I240-L244 HydrophobicContact CG2-CG 4.37Å; I240-L244 WeakPolarHBondContact O-CG 3.35Å; I240-L244 PolarHBondContact O-N 2.84Å
241E80.1Confident75.7Confident76 Ų7677.9 Ų77.936%0.35544%0.437SS..Hα-helixtrans-56.3-44.7175.3-176.8-178175.600110.9K188 F237 L244 F245K188-E241 WeakPolarHBondContact CE-OE1 3.5Å; K188-E241 IonicContact NZ-OE1 2.76Å; K188-E241 PolarHBondContact NZ-OE1 3.41Å; K188-E241 IonicContact NZ-OE2 3.26Å; K188-E241 PolarHBondContact NZ-OE2 3.4Å; F237-E241 PolarHBondContact O-N 3.21Å; E241-L244 PolarHBondContact O-N 2.56Å; E241-F245 WeakPolarHBondContact O-CB 3.34Å; E241-F245 PolarHBondContact O-N 3.43Å
242W80.8Confident74.5Confident59 Ų5986.5 Ų86.522%0.22345%0.447CS..Hα-helixtrans-62.6-45.4175.3-179.4-98.3000112.3S238 I240 L244 F245 E246 C264S238-W242 WeakPolarHBondContact O-CB 3.31Å; S238-W242 PolarHBondContact O-N 3.46Å; S238-W242 VanDerWaalsContact O-N 3.09Å; I240-W242 VanDerWaalsContact C-N 3.27Å; I240-W242 PolarHBondContact O-N 3.15Å; W242-L244 PolarHBondContact O-N 2.95Å; W242-F245 HydrophobicContact CE3-CD1 4.29Å; W242-F245 HydrophobicContact CZ3-CD1 4.07Å; W242-F245 HydrophobicContact CZ3-CE1 4.31Å; W242-F245 WeakPolarHBondContact O-CB 3.44Å; W242-F245 PolarHBondContact O-N 3.49Å; W242-E246 HydrophobicContact CZ2-CG 4.26Å; W242-E246 PolarHBondContact NE1-OE1 3.41Å; W242-E246 PolarHBondContact O-N 2.98Å; W242-C264 HydrophobicContact CH2-CB 4.01Å; W242-C264 HydrophobicContact CZ3-CB 3.68Å
243F79Confident73.3Confident120 Ų12090.9 Ų90.953%0.52646%0.462SS..Hα-helixtrans-62.2-43178.3-179.6-106.7000112.6P239 I240 F245 E246 I247P239-F243 WeakPolarHBondContact O-CB 3.11Å; P239-F243 PolarHBondContact O-N 3.08Å; I240-F243 PolarHBondContact O-N 2.83Å; I240-F243 VanDerWaalsContact O-N 3.16Å; F243-F245 VanDerWaalsContact C-N 3.33Å; F243-E246 PolarHBondContact O-N 2.92Å; F243-I247 HydrophobicContact CD1-CD1 3.74Å; F243-I247 HydrophobicContact CD2-CD1 4.27Å; F243-I247 HydrophobicContact CE1-CD1 3.22Å; F243-I247 HydrophobicContact CE1-CG1 4.47Å; F243-I247 HydrophobicContact CE2-CD1 3.81Å; F243-I247 HydrophobicContact CE2-CG1 4.5Å; F243-I247 HydrophobicContact CG-CD1 4.26Å; F243-I247 HydrophobicContact CZ-CD1 3.28Å; F243-I247 HydrophobicContact CZ-CG1 4.39Å; F243-I247 WeakPolarHBondContact O-CG1 3.18Å; F243-I247 PolarHBondContact O-N 3.38Å
244L80.1Confident72.6Confident88 Ų8891.7 Ų91.746%0.46146%0.464SS..Hα-helixtrans-62.9-41.4174-73.4174.9000111.2I240 E241 W242 I247 L248I240-L244 HydrophobicContact CG2-CD1 4.18Å; I240-L244 HydrophobicContact CG2-CG 4.37Å; I240-L244 WeakPolarHBondContact O-CG 3.35Å; I240-L244 PolarHBondContact O-N 2.84Å; E241-L244 PolarHBondContact O-N 2.56Å; W242-L244 PolarHBondContact O-N 2.95Å; L244-I247 PolarHBondContact O-N 2.92Å; L244-L248 HydrophobicContact CB-CD1 4.36Å; L244-L248 HydrophobicContact CD2-CD1 4.42Å; L244-L248 VanDerWaalsContact O-CB 3.3Å; L244-L248 WeakPolarHBondContact O-CB 3.25Å; L244-L248 PolarHBondContact O-N 3.06Å
245F79.3Confident71.6Confident81 Ų8192.8 Ų92.836%0.35547%0.472SS..Hα-helixtrans-60.8-44.6175.5177.2-102.1000111.9E241 W242 F243 I247 F249 M250E241-F245 WeakPolarHBondContact O-CB 3.34Å; E241-F245 PolarHBondContact O-N 3.43Å; W242-F245 HydrophobicContact CE3-CD1 4.29Å; W242-F245 HydrophobicContact CZ3-CD1 4.07Å; W242-F245 HydrophobicContact CZ3-CE1 4.31Å; W242-F245 WeakPolarHBondContact O-CB 3.44Å; W242-F245 PolarHBondContact O-N 3.49Å; F243-F245 VanDerWaalsContact C-N 3.33Å; F245-I247 PolarHBondContact O-N 3.28Å; F245-F249 HydrophobicContact CD2-CB 4.09Å; F245-F249 AromaticContact CD2-CD2 3.87Å; F245-F249 HydrophobicContact CD2-CD2 3.87Å; F245-F249 HydrophobicContact CD2-CG 4.31Å; F245-F249 HydrophobicContact CE2-CB 3.99Å; F245-F249 HydrophobicContact CE2-CD2 4.41Å; F245-F249 HydrophobicContact CE2-CG 4.43Å; F245-F249 WeakPolarHBondContact O-CB 3.39Å; F245-F249 PolarHBondContact O-N 3.07Å; F245-M250 HydrophobicContact CD1-CG 4.12Å; F245-M250 HydrophobicContact CD1-SD 4.08Å; F245-M250 HydrophobicContact CE1-CG 3.67Å; F245-M250 HydrophobicContact CE1-SD 3.63Å; F245-M250 HydrophobicContact CZ-CG 4.23Å; F245-M250 PolarHBondContact O-N 3.33Å
246E79.8Confident70.5Confident70 Ų7098 Ų9833%0.32749%0.492SS..Iπ-helixtrans-61.3-43.6176.3-76.8-172.616200112.1W242 F243 M250 G251W242-E246 HydrophobicContact CZ2-CG 4.26Å; W242-E246 PolarHBondContact NE1-OE1 3.41Å; W242-E246 PolarHBondContact O-N 2.98Å; F243-E246 PolarHBondContact O-N 2.92Å; E246-M250 HydrophobicContact CG-SD 4.24Å; E246-M250 WeakPolarHBondContact O-CB 3.41Å; E246-M250 PolarHBondContact O-N 3.5Å; E246-G251 PolarHBondContact O-N 2.86Å; E246-G251 VanDerWaalsContact O-N 3.08Å
247I82.1Confident69.4Low101 Ų10199.2 Ų99.252%0.51850%0.499SS..Iπ-helixtrans-71-49.6-178.2-71.8175.7000112.2F243 L244 F245F243-I247 HydrophobicContact CD1-CD1 3.74Å; F243-I247 HydrophobicContact CD2-CD1 4.27Å; F243-I247 HydrophobicContact CE1-CD1 3.22Å; F243-I247 HydrophobicContact CE1-CG1 4.47Å; F243-I247 HydrophobicContact CE2-CD1 3.81Å; F243-I247 HydrophobicContact CE2-CG1 4.5Å; F243-I247 HydrophobicContact CG-CD1 4.26Å; F243-I247 HydrophobicContact CZ-CD1 3.28Å; F243-I247 HydrophobicContact CZ-CG1 4.39Å; F243-I247 WeakPolarHBondContact O-CG1 3.18Å; F243-I247 PolarHBondContact O-N 3.38Å; L244-I247 PolarHBondContact O-N 2.92Å; F245-I247 PolarHBondContact O-N 3.28Å
248L79.9Confident68.2Low121 Ų121102.3 Ų102.363%0.63452%0.518SS*.Iπ-helixtrans-80.1-36.8-171.1-78.6154.1000112.7L244L244-L248 HydrophobicContact CB-CD1 4.36Å; L244-L248 HydrophobicContact CD2-CD1 4.42Å; L244-L248 VanDerWaalsContact O-CB 3.3Å; L244-L248 WeakPolarHBondContact O-CB 3.25Å; L244-L248 PolarHBondContact O-N 3.06Å
249F80.2Confident66.7Low159 Ų159103.2 Ų103.270%0.69752%0.524SS*.Iπ-helixtrans-117.3-30.2-168.3-61.7-76.2000114.2F245F245-F249 HydrophobicContact CD2-CB 4.09Å; F245-F249 AromaticContact CD2-CD2 3.87Å; F245-F249 HydrophobicContact CD2-CD2 3.87Å; F245-F249 HydrophobicContact CD2-CG 4.31Å; F245-F249 HydrophobicContact CE2-CB 3.99Å; F245-F249 HydrophobicContact CE2-CD2 4.41Å; F245-F249 HydrophobicContact CE2-CG 4.43Å; F245-F249 WeakPolarHBondContact O-CB 3.39Å; F245-F249 PolarHBondContact O-N 3.07Å
250M67.2Low65.5Low55 Ų55101.6 Ų101.627%0.27151%0.509SS..Iπ-helixtrans-87.8-33.6179.6-66.5-168.569.600113.3F245 E246 F253 L260F245-M250 HydrophobicContact CD1-CG 4.12Å; F245-M250 HydrophobicContact CD1-SD 4.08Å; F245-M250 HydrophobicContact CE1-CG 3.67Å; F245-M250 HydrophobicContact CE1-SD 3.63Å; F245-M250 HydrophobicContact CZ-CG 4.23Å; F245-M250 PolarHBondContact O-N 3.33Å; E246-M250 HydrophobicContact CG-SD 4.24Å; E246-M250 WeakPolarHBondContact O-CB 3.41Å; E246-M250 PolarHBondContact O-N 3.5Å; M250-F253 WeakPolarHBondContact O-CD2 3.33Å; M250-L260 HydrophobicContact CE-CD1 3.76Å
251G53.8Low64.2Low40 Ų40105.3 Ų105.341%0.41252%0.518SS..  trans61.3159-170.400000111.8E246 F253E246-G251 PolarHBondContact O-N 2.86Å; E246-G251 VanDerWaalsContact O-N 3.08Å; G251-F253 PolarHBondContact O-N 3.44Å
252R53.7Low62.8Low252 Ų252108.4 Ų108.495%0.95153%0.532SS*.SBendtrans-6589.2-179.7-81.7177.3160163-5.5111.5
253F49.6Very low61.5Low133 Ų133110.8 Ų110.858%0.58355%0.548SS*.  trans-111.5106.7168-80.5-75.9000110.6M250 G251 S255 Y256M250-F253 WeakPolarHBondContact O-CD2 3.33Å; G251-F253 PolarHBondContact O-N 3.44Å; F253-S255 VanDerWaalsContact C-N 3.3Å; F253-S255 PolarHBondContact O-N 3.04Å; F253-S255 VanDerWaalsContact O-N 3.15Å; F253-Y256 HydrophobicContact CB-CD2 4.06Å; F253-Y256 HydrophobicContact CB-CE2 3.87Å; F253-Y256 HydrophobicContact CD1-CE2 4.23Å; F253-Y256 HydrophobicContact CG-CE2 4.29Å
254P50.4Low60.3Low116 Ų116106.6 Ų106.675%0.75353%0.533SS*.THydrogen-bonded Turntrans-70.7-5.5-167-20.532.5000117.5
255S49.4Very low58.9Low98 Ų98103.4 Ų103.469%0.68552%0.522SS*.THydrogen-bonded Turntrans-1267.7-159.9-54.70000117.3F253F253-S255 VanDerWaalsContact C-N 3.3Å; F253-S255 PolarHBondContact O-N 3.04Å; F253-S255 VanDerWaalsContact O-N 3.15Å
256Y48.7Very low57.4Low139 Ų139105 Ų10555%0.54553%0.534SS..SBendtrans-128.17.2-179.9-29.3-77.4000114F253 L258 S259 L260F253-Y256 HydrophobicContact CB-CD2 4.06Å; F253-Y256 HydrophobicContact CB-CE2 3.87Å; F253-Y256 HydrophobicContact CD1-CE2 4.23Å; F253-Y256 HydrophobicContact CG-CE2 4.29Å; Y256-L258 VanDerWaalsContact C-N 3.29Å; Y256-L258 PolarHBondContact O-N 2.9Å; Y256-S259 PolarHBondContact O-N 3.09Å; Y256-S259 PolarHBondContact O-OG 3.15Å; Y256-L260 PolarHBondContact O-N 3.22Å
257T50.8Low55.9Low74 Ų74106.6 Ų106.645%0.45454%0.54SS..Hα-helixtrans-66.4-25.8-167.256.40000113.8R261T257-R261 WeakPolarHBondContact O-CB 3.42Å; T257-R261 PolarHBondContact O-N 3.2Å
258L51.5Low54.3Low132 Ų132106.3 Ų106.369%0.69154%0.538SS*.Hα-helixtrans-81.2-38.5179.4-80.7167.6000113.7Y256 Q262Y256-L258 VanDerWaalsContact C-N 3.29Å; Y256-L258 PolarHBondContact O-N 2.9Å; L258-Q262 PolarHBondContact O-N 2.68Å
259S49.7Very low52.5Low67 Ų67107.1 Ų107.147%0.46954%0.542SS..Hα-helixtrans-75.6-39.1-178.461.70000112Y256 Q262 I263Y256-S259 PolarHBondContact O-N 3.09Å; Y256-S259 PolarHBondContact O-OG 3.15Å; S259-Q262 PolarHBondContact O-N 3.23Å; S259-I263 WeakPolarHBondContact O-CD1 3.37Å; S259-I263 VanDerWaalsContact O-CG1 3.29Å; S259-I263 WeakPolarHBondContact O-CG1 3.33Å; S259-I263 PolarHBondContact O-N 2.87Å; S259-I263 VanDerWaalsContact O-N 3.11Å
260L51.7Low50.2Low62 Ų62101.5 Ų101.533%0.32553%0.529SS..Hα-helixtrans-73.3-31.2176.6-86.9169.1000113.3M250 Y256 Q262 I263 C264M250-L260 HydrophobicContact CE-CD1 3.76Å; Y256-L260 PolarHBondContact O-N 3.22Å; L260-Q262 PolarHBondContact O-N 3.19Å; L260-I263 HydrophobicContact CD2-CD1 4.49Å; L260-I263 PolarHBondContact O-N 3.24Å; L260-C264 WeakPolarHBondContact O-CB 3.45Å; L260-C264 PolarHBondContact O-N 3.23Å
261R50.3Low48.8Very low169 Ų169106.7 Ų106.764%0.63856%0.558SS**Hα-helixtrans-60-33.7170.9-173.6177-170.4-170.23.7111.9T257 G265T257-R261 WeakPolarHBondContact O-CB 3.42Å; T257-R261 PolarHBondContact O-N 3.2Å; R261-G265 VanDerWaalsContact O-CA 3.28Å; R261-G265 WeakPolarHBondContact O-CA 3.48Å; R261-G265 PolarHBondContact O-N 3.31Å
262Q50.9Low47.9Very low141 Ų141107.8 Ų107.866%0.65957%0.569SS**Hα-helixtrans-78.6-35.7177.5-152.2160.4-14.100112L258 S259 L260 N266L258-Q262 PolarHBondContact O-N 2.68Å; S259-Q262 PolarHBondContact O-N 3.23Å; L260-Q262 PolarHBondContact O-N 3.19Å; Q262-N266 VanDerWaalsContact O-CB 3.31Å; Q262-N266 WeakPolarHBondContact O-CB 3.5Å; Q262-N266 PolarHBondContact O-N 3.46Å; Q262-N266 PolarHBondContact O-ND2 3.45Å
263I53.9Low47Very low108 Ų108102.6 Ų102.655%0.55457%0.565SS**Hα-helixtrans-74-50.3177.5-64.7162.9000111.6S259 L260 N266 F267S259-I263 WeakPolarHBondContact O-CD1 3.37Å; S259-I263 VanDerWaalsContact O-CG1 3.29Å; S259-I263 WeakPolarHBondContact O-CG1 3.33Å; S259-I263 PolarHBondContact O-N 2.87Å; S259-I263 VanDerWaalsContact O-N 3.11Å; L260-I263 HydrophobicContact CD2-CD1 4.49Å; L260-I263 PolarHBondContact O-N 3.24Å; I263-N266 PolarHBondContact O-N 3.32Å; I263-F267 PolarHBondContact O-N 3.41Å
264C53.7Low46Very low32 Ų32102.1 Ų102.122%0.21658%0.579CS.*Hα-helixtrans-68.7-36.3174.7-75.80000111.9W242 L260 N266 F267 I268W242-C264 HydrophobicContact CH2-CB 4.01Å; W242-C264 HydrophobicContact CZ3-CB 3.68Å; L260-C264 WeakPolarHBondContact O-CB 3.45Å; L260-C264 PolarHBondContact O-N 3.23Å; C264-N266 PolarHBondContact O-N 3.09Å; C264-F267 CarbonylContact O-C 3.44Å; C264-F267 WeakPolarHBondContact O-CA 3.41Å; C264-F267 PolarHBondContact O-N 2.77Å; C264-F267 VanDerWaalsContact O-N 3.1Å; C264-I268 WeakPolarHBondContact O-CB 3.41Å; C264-I268 VanDerWaalsContact O-CG1 3.29Å; C264-I268 WeakPolarHBondContact O-CG1 3.37Å; C264-I268 PolarHBondContact O-N 3.13Å
265G51.1Low45.1Very low21 Ų21104.1 Ų104.122%0.21658%0.583CS.*Hα-helixtrans-59.3-44.9172.600000112.2R261 F267 I268 I269R261-G265 VanDerWaalsContact O-CA 3.28Å; R261-G265 WeakPolarHBondContact O-CA 3.48Å; R261-G265 PolarHBondContact O-N 3.31Å; G265-F267 VanDerWaalsContact C-N 3.3Å; G265-F267 PolarHBondContact O-N 2.91Å; G265-I268 PolarHBondContact O-N 3.45Å; G265-I269 VanDerWaalsContact O-CB 3.23Å; G265-I269 WeakPolarHBondContact O-CB 3.41Å; G265-I269 WeakPolarHBondContact O-CG1 3.4Å; G265-I269 PolarHBondContact O-N 3.24Å
266N46.8Very low44.2Very low116 Ų116111.2 Ų111.262%0.6260%0.595SS**Hα-helixtrans-66-32.6172.8-75.5-9.8000112.5Q262 I263 C264 G270Q262-N266 VanDerWaalsContact O-CB 3.31Å; Q262-N266 WeakPolarHBondContact O-CB 3.5Å; Q262-N266 PolarHBondContact O-N 3.46Å; Q262-N266 PolarHBondContact O-ND2 3.45Å; I263-N266 PolarHBondContact O-N 3.32Å; C264-N266 PolarHBondContact O-N 3.09Å; N266-G270 PolarHBondContact O-N 2.98Å; N266-G270 VanDerWaalsContact O-N 3.14Å
267F48.3Very low43.1Very low102 Ų102108.3 Ų108.345%0.44761%0.607SS.*Hα-helixtrans-72.5-27175.5-164.7-95.9000113.3I181 R182 I263 C264 G265I181-F267 HydrophobicContact CG2-CZ 4.1Å; R182-F267 HydrophobicContact CG-CD1 4.44Å; R182-F267 HydrophobicContact CG-CE1 3.69Å; R182-F267 HydrophobicContact CG-CZ 3.98Å; R182-F267 PolarHBondContact NE-O 2.94Å; R182-F267 VanDerWaalsContact NH2-CA 3.29Å; R182-F267 VanDerWaalsContact NH2-CD2 3.33Å; R182-F267 PolarHBondContact NH2-O 3.18Å; I263-F267 PolarHBondContact O-N 3.41Å; C264-F267 CarbonylContact O-C 3.44Å; C264-F267 WeakPolarHBondContact O-CA 3.41Å; C264-F267 PolarHBondContact O-N 2.77Å; C264-F267 VanDerWaalsContact O-N 3.1Å; G265-F267 VanDerWaalsContact C-N 3.3Å; G265-F267 PolarHBondContact O-N 2.91Å
268I49Very low42.3Very low95 Ų95117 Ų11749%0.48763%0.631SS.*Hα-helixtrans-95.4-27.1-178.3-66.5170.4000111.9C264 G265C264-I268 WeakPolarHBondContact O-CB 3.41Å; C264-I268 VanDerWaalsContact O-CG1 3.29Å; C264-I268 WeakPolarHBondContact O-CG1 3.37Å; C264-I268 PolarHBondContact O-N 3.13Å; G265-I268 PolarHBondContact O-N 3.45Å
269I42.2Very low41.1Very low139 Ų139115.1 Ų115.171%0.71363%0.634SS**Hα-helixtrans-107-15-172.7-58.8173.3000113.2G265 N271G265-I269 VanDerWaalsContact O-CB 3.23Å; G265-I269 WeakPolarHBondContact O-CB 3.41Å; G265-I269 WeakPolarHBondContact O-CG1 3.4Å; G265-I269 PolarHBondContact O-N 3.24Å; I269-N271 PolarHBondContact O-N 3.44Å
270G32.3Very low40Very low40 Ų40116.1 Ų116.141%0.41265%0.647SS.*  trans-76.682-173.300000115.5N266N266-G270 PolarHBondContact O-N 2.98Å; N266-G270 VanDerWaalsContact O-N 3.14Å
271N36.4Very low38.7Very low165 Ų165120.3 Ų120.388%0.88268%0.675SS**  -16685.9127.6-124-2.4000112.5I269I269-N271 PolarHBondContact O-N 3.44Å
272G35.9Very low37.6Very low62 Ų62123.4 Ų123.464%0.63969%0.687SS**SBendtrans-132.3100.6161.500000108.1
273T34.4Very low36.5Very low144 Ų144123 Ų12388%0.88369%0.694SS**  trans66.5113.5170.863.60000117.6
274S28.8Very low35.2Very low123 Ų123122.7 Ų122.786%0.8671%0.707SS**  trans-136.994.3145.6-172.10000108.7
275N30.3Very low33.8Very low158 Ų158127.4 Ų127.485%0.84574%0.735SS**  trans-134.9125.3155.2-1420000107.1
276R31.3Very low32.8Very low247 Ų247136.4 Ų136.493%0.93277%0.769SS**  trans67.1123.9178.4-78.2-179170.7-179.3-2.1118.9
277G25.3Very low31.8Very low77 Ų77139.2 Ų139.279%0.79478%0.778SS**  trans163.891.215600000114.4
278R34.6Very low30.7Very low258 Ų258140.7 Ų140.797%0.97480%0.799SS**  trans-63.8126.2171.7-165.2-179.7-165.9179.13.2110.2
279A26Very low29.6Very low91 Ų91145 Ų14575%0.75282%0.815SS**  trans-154.1102163.600000108.6
280A26Very low28.8Very low88 Ų88145.2 Ų145.273%0.72782%0.817SS**  70.388.887.100000112.3R282A280-R282 PolarHBondContact O-N 2.91Å
281T25.8Very low28.5Very low150 Ų150149.6 Ų149.692%0.9283%0.831SS**  trans-58114.1168.6-35.90000109.5
282R27.6Very low28.1Very low235 Ų235152.4 Ų152.489%0.88783%0.83SS**  trans-104.4117.6165.5-78.4179.793.8168.75.2109.7A280A280-R282 PolarHBondContact O-N 2.91Å
283T26.9Very low27.7Very low131 Ų131158 Ų15880%0.80484%0.838SS**  trans-30.3133.5157.223.10000114.6
284A26.3Very low27.4Very low102 Ų102158.7 Ų158.784%0.84384%0.837SS**  trans-128.397.115700000108.4
285T25.5Very low27.2Very low131 Ų131158.9 Ų158.980%0.80484%0.837SS**  trans-65.7127.9163.1-17.30000108.4
286K29Very low27.1Very low210 Ų210156.6 Ų156.691%0.91383%0.831SS**  trans-154.6119.5148.5-111.1175.9-174.3-175.60109.7
287E25.2Very low26.9Very low176 Ų176150 Ų15082%0.82282%0.822SS**  trans-52.3140.4175-69.6168.1112.900112.4
288C25.3Very low27Very low132 Ų132151.4 Ų151.489%0.89282%0.82SS**  trans-140.5119.6141.8-149.90000107.8
289K26.3Very low27.2Very low186 Ų186144.4 Ų144.481%0.80981%0.808SS**  trans-73.8154.7177.4-89.2176.9171.2173.90110.8
290D26.1Very low27.3Very low144 Ų144145.9 Ų145.977%0.7781%0.807SS**  trans92.794.5147.2-124.26.1000118.8
291N26.8Very low27.4Very low132 Ų132153.4 Ų153.471%0.70682%0.817SS**  173.1123106.7-98.4-41.3000113.2
292R27.1Very low27.4Very low224 Ų224149.5 Ų149.585%0.84581%0.807SS**  trans14.2110.4151.3-61.8176.1-165.8-170.32.6118
293H28.4Very low27.3Very low178 Ų178144.3 Ų144.382%0.82480%0.797SS**  63.8104.489.1-79.4-30.1000116.7
294N26.1Very low27.4Very low159 Ų159148.7 Ų148.785%0.8580%0.798SS**  -173.7115.8119.3-104.5-4.8000111.3
295C25.2Very low27.4Very low128 Ų128147.5 Ų147.587%0.86580%0.796SS**  172.4150.8129-95.90000111.7
296P29.2Very low27.5Very low110 Ų110147.4 Ų147.471%0.71480%0.795SS**  trans-112.1153-146.439.5-28.7000115
297S26.2Very low27.5Very low107 Ų107148.2 Ų148.275%0.74879%0.793SS**  trans38.7112.7143.457.80000121.2
298S26.7Very low27.7Very low107 Ų107151 Ų15175%0.74880%0.796SS**  trans-36.7164.2138.349.40000113.8
299P39.8Very low27.9Very low111 Ų111149.1 Ų149.172%0.72179%0.79SS**  -164.6178.256.346.5-23.3000121.5
300V28.8Very low28Very low122 Ų122149.1 Ų149.174%0.73979%0.79SS**  trans93.8126.9137.6165.70000122.4
301R26.4Very low28.1Very low246 Ų246148.4 Ų148.493%0.92879%0.786SS**  trans48.8147.2148.3-77.8172.4170.7-167.5-3.9119.5
302G25.8Very low28.3Very low69 Ų69149.4 Ų149.471%0.71179%0.791SS**  cis148.2141.210.100000109.3
303D27.2Very low28.4Very low126 Ų126145.6 Ų145.667%0.67479%0.788SS**  trans81134.5149.3-141.47.3000122.8
304R27.3Very low28.5Very low222 Ų222143.6 Ų143.684%0.83879%0.789SS**  trans54.6133.7148.4-96.9176.4-84.3-161.1-0.8123.5
305G27Very low28.8Very low77 Ų77145.1 Ų145.179%0.79479%0.787SS**  trans158.2100.9145.300000118.4
306T28.4Very low29.2Very low129 Ų129146.5 Ų146.579%0.79179%0.786SS**  trans-56.2150.4163.941.60000116
307R29.4Very low29.4Very low227 Ų227145.9 Ų145.986%0.85779%0.785SS**  165.9128.6120.2-93.8173-173.7-172.33.4115.2
308R28.3Very low29.8Very low234 Ų234150.5 Ų150.588%0.88379%0.791SS**  trans41.1124.3131.4-74.1-176.5176.4-177.7-1.8120
309A28.6Very low30.3Very low94 Ų94154.7 Ų154.778%0.77780%0.796SS**  98.1122.858.900000113.7
310K29.1Very low30.2Very low185 Ų185159.1 Ų159.180%0.80480%0.8SS**  trans146.1114.2147.5-93.2-171.9154.2178.70110.2
311D28.9Very low30.7Very low130 Ų130165.9 Ų165.970%0.69582%0.819SS**  6411185.9-64.2-18.7000110.9
312D29.5Very low31Very low152 Ų152161.9 Ų161.981%0.81381%0.814SS**  179155.681.6-109.3-32000112.2
313D30.2Very low31.2Very low145 Ų145166.8 Ų166.878%0.77582%0.819SS**  trans-47.5156.1171.6-82-49000114.8
314T30.6Very low31.5Very low136 Ų136169.1 Ų169.183%0.83483%0.828SS**  -177.6133.8108-52.20000110.7
315K32.4Very low31.7Very low190 Ų190165.9 Ų165.983%0.82683%0.827SS**  trans-45.2145.6164.8-64.4162.9174.1170.30112.5
316D33.2Very low32Very low157 Ų157171.5 Ų171.584%0.8483%0.829SS**  -160.2149116.5-128.9-20.5000115.1
317S33.2Very low32.2Very low98 Ų98174.3 Ų174.369%0.68583%0.831SS**  trans-84.7142.6-177.5-37.60000109.5
318K35.4Very low32.4Very low203 Ų203170.6 Ų170.688%0.88383%0.83SS**  trans-164115.9145-111.2162.4-168.1175.10113.5
319K36.7Very low32.8Very low196 Ų196165.7 Ų165.785%0.85283%0.826SS**  trans-43.9145.9152.2-79172.5164.9177.90111.8
320Y37.9Very low33.1Very low204 Ų204171.7 Ų171.780%0.883%0.83SS**  trans-157.4109.9131.2-102.5-81.2000107
321K40.3Very low33.5Very low264 Ų264170.5 Ų170.5100%1.14883%0.832SS**  85.40112-96-165.9-179-177.30113.2

Retrieved 321 of 321 residues in 89.9 ms (Link to these results)

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