A0A087WRG7_MOUSE Loading...

Transmembrane protein 131

AlphaFold DB , UniProt , Accession A0A087WRG7, Species MOUSE (Mus musculus, Mouse), Gene Tmem131, Length 146 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
1Q36.3Very low70.7Confident236 Ų236104.8 Ų104.8100%1.10359%0.588SS**  0130.60-81.2164.3-51.400107.3G3Q1-G3 PolarHBondContact O-N 2.87Å; Q1-G3 VanDerWaalsContact O-N 3.14Å
2P44.6Very low72.4Confident133 Ų133101.5 Ų101.586%0.86457%0.568SS**  trans-64.7116.1172.6-2.218.2000106.7
3G55.8Low73.9Confident63 Ų6397.8 Ų97.865%0.64956%0.558SS**  trans-59.8140.8178.100000109.7Q1 A5Q1-G3 PolarHBondContact O-N 2.87Å; Q1-G3 VanDerWaalsContact O-N 3.14Å; G3-A5 PolarHBondContact O-N 2.94Å
4V66.6Low75.1Confident132 Ų13295.4 Ų95.480%0.854%0.543SS*.  trans-65.586.8179.2-178.40000108.2
5A68.1Low76.2Confident65 Ų6591.5 Ų91.554%0.53752%0.516SS..PPolyproline II helixtrans-64.5142.2166.600000108.4G3G3-A5 PolarHBondContact O-N 2.94Å
6M81.3Confident77.3Confident48 Ų4891.3 Ų91.324%0.23651%0.513CS..PPolyproline II helixtrans-67.4165.4172.8-64.617393.300110.3L10 I100 L104 Y105M6-L10 HydrophobicContact CB-CD2 3.81Å; M6-L10 HydrophobicContact CE-CD2 3.14Å; M6-L10 HydrophobicContact CE-CG 4.45Å; M6-L10 HydrophobicContact CG-CD2 4.22Å; M6-L10 HydrophobicContact SD-CD2 4.03Å; M6-I100 HydrophobicContact CE-CD1 4.24Å; M6-I100 HydrophobicContact CE-CG2 4.26Å; M6-I100 HydrophobicContact SD-CG2 3.8Å; M6-L104 WeakPolarHBondContact CB-O 3.37Å; M6-L104 HydrophobicContact CG-CB 4.01Å; M6-L104 PolarHBondContact N-O 2.81Å; M6-L104 HydrophobicContact SD-CB 3.84Å; M6-Y105 HydrophobicContact SD-CD1 4.31Å; M6-Y105 HydrophobicContact SD-CE1 4.28Å
7Q82.8Confident78.2Confident134 Ų13488.8 Ų88.863%0.62651%0.506SS*.PPolyproline II helixtrans-51.4141.7178.3-162.5179.5-63.900111.1D9 L10Q7-D9 VanDerWaalsContact CD-OD1 3.31Å; Q7-D9 WeakPolarHBondContact CG-OD1 3.24Å; Q7-D9 VanDerWaalsContact NE2-CG 3.35Å; Q7-D9 PolarHBondContact NE2-OD1 3.09Å; Q7-D9 PolarHBondContact NE2-OD2 3.09Å; Q7-D9 PolarHBondContact O-N 3.15Å; Q7-D9 VanDerWaalsContact O-N 3.08Å; Q7-L10 HydrophobicContact CB-CB 4.33Å; Q7-L10 WeakPolarHBondContact O-CB 3.12Å; Q7-L10 PolarHBondContact O-N 2.78Å
8E81.3Confident79Confident165 Ų16585.9 Ų85.977%0.77149%0.488SS*.THydrogen-bonded Turntrans-59.5-27.3-166.6-71-171.5164.700114.9W11 S106E8-W11 PolarHBondContact O-NE1 2.81Å; E8-S106 PolarHBondContact O-OG 3.37Å
9D84.6Confident79.7Confident86 Ų8685.2 Ų85.246%0.4648%0.48SS..THydrogen-bonded Turntrans-98.9-3.6-177.860.5-16.2000113.9Q7 W11 D12 A13Q7-D9 VanDerWaalsContact CD-OD1 3.31Å; Q7-D9 WeakPolarHBondContact CG-OD1 3.24Å; Q7-D9 VanDerWaalsContact NE2-CG 3.35Å; Q7-D9 PolarHBondContact NE2-OD1 3.09Å; Q7-D9 PolarHBondContact NE2-OD2 3.09Å; Q7-D9 PolarHBondContact O-N 3.15Å; Q7-D9 VanDerWaalsContact O-N 3.08Å; D9-W11 VanDerWaalsContact C-N 3.34Å; D9-W11 PolarHBondContact O-N 2.96Å; D9-D12 WeakPolarHBondContact O-CB 3.46Å; D9-D12 PolarHBondContact O-N 3.01Å; D9-A13 PolarHBondContact O-N 3.02Å; D9-A13 VanDerWaalsContact O-N 3.09Å
10L87.4Confident80.6Confident52 Ų5285 Ų8527%0.27248%0.484SS..Hα-helixtrans-66.3-35.8-167.9-164.269.8000113.1M6 Q7 D12 A13 D14M6-L10 HydrophobicContact CB-CD2 3.81Å; M6-L10 HydrophobicContact CE-CD2 3.14Å; M6-L10 HydrophobicContact CE-CG 4.45Å; M6-L10 HydrophobicContact CG-CD2 4.22Å; M6-L10 HydrophobicContact SD-CD2 4.03Å; Q7-L10 HydrophobicContact CB-CB 4.33Å; Q7-L10 WeakPolarHBondContact O-CB 3.12Å; Q7-L10 PolarHBondContact O-N 2.78Å; L10-D12 PolarHBondContact O-N 3.39Å; L10-A13 PolarHBondContact O-N 2.82Å; L10-D14 PolarHBondContact O-N 2.93Å
11W88.9Confident81.2Confident39 Ų3986.3 Ų86.315%0.14849%0.489CS..Hα-helixtrans-63.2-31.3175.570.3-85.5000112.2E8 D9 W15 Y105 V110 F111 K114E8-W11 PolarHBondContact O-NE1 2.81Å; D9-W11 VanDerWaalsContact C-N 3.34Å; D9-W11 PolarHBondContact O-N 2.96Å; W11-W15 WeakPolarHBondContact O-CB 3.38Å; W11-W15 PolarHBondContact O-N 3.49Å; W11-W15 VanDerWaalsContact O-N 3.12Å; W11-Y105 HydrophobicContact CB-CD1 3.4Å; W11-Y105 VanDerWaalsContact CB-CD1 3.4Å; W11-Y105 HydrophobicContact CB-CE1 3.95Å; W11-Y105 HydrophobicContact CB-CG 3.94Å; W11-V110 HydrophobicContact CE3-CG1 4.46Å; W11-V110 HydrophobicContact CH2-CG1 3.6Å; W11-V110 HydrophobicContact CZ2-CG1 4.37Å; W11-V110 HydrophobicContact CZ3-CG1 3.61Å; W11-F111 HydrophobicContact CB-CB 4.37Å; W11-F111 HydrophobicContact CB-CD1 4.38Å; W11-F111 HydrophobicContact CB-CG 4.26Å; W11-F111 HydrophobicContact CE3-CB 4.23Å; W11-F111 HydrophobicContact CE3-CD2 4.34Å; W11-K114 HydrophobicContact CZ3-CD 3.92Å; W11-K114 VanDerWaalsContact CZ3-NZ 3.27Å
12D90.9Very high83.9Confident65 Ų6577.2 Ų77.235%0.34845%0.446SS..Hα-helixtrans-76.7-42.8179.8-156.232.6000109.9D9 L10 D14 W15 D16 K114D9-D12 WeakPolarHBondContact O-CB 3.46Å; D9-D12 PolarHBondContact O-N 3.01Å; L10-D12 PolarHBondContact O-N 3.39Å; D12-D14 PolarHBondContact O-N 3.45Å; D12-W15 WeakPolarHBondContact O-CB 3.43Å; D12-W15 PolarHBondContact O-N 3.34Å; D12-D16 WeakPolarHBondContact O-CB 3.33Å; D12-D16 PolarHBondContact O-N 3.34Å; D12-K114 IonicContact OD1-NZ 3.45Å; D12-K114 PolarHBondContact OD1-NZ 3.09Å
13A91.8Very high86.3Confident53 Ų5378.8 Ų78.844%0.43844%0.44SS..Hα-helixtrans-58.3-45.7173.300000112.5D9 L10 W15 D16 A17D9-A13 PolarHBondContact O-N 3.02Å; D9-A13 VanDerWaalsContact O-N 3.09Å; L10-A13 PolarHBondContact O-N 2.82Å; A13-W15 VanDerWaalsContact C-N 3.31Å; A13-W15 PolarHBondContact O-N 3.31Å; A13-D16 PolarHBondContact O-N 3.11Å; A13-A17 WeakPolarHBondContact O-CB 3.32Å; A13-A17 PolarHBondContact O-N 3.49Å
14D90.6Very high88.2Confident65 Ų6578.7 Ų78.735%0.34843%0.433SS..Hα-helixtrans-64-38.1176.6-78-24.4000111.8L10 D12 H18 Y105L10-D14 PolarHBondContact O-N 2.93Å; D12-D14 PolarHBondContact O-N 3.45Å; D14-H18 WeakPolarHBondContact O-CB 3.27Å; D14-H18 PolarHBondContact O-N 3.05Å; D14-Y105 PolarHBondContact OD2-OH 3.49Å
15W92Very high89.5Confident37 Ų3773.9 Ų73.914%0.1440%0.4CS..Hα-helixtrans-67.4-44176-178.4-100.8000112.5W11 D12 A13 H18 Q19 F111 K114 R118W11-W15 WeakPolarHBondContact O-CB 3.38Å; W11-W15 PolarHBondContact O-N 3.49Å; W11-W15 VanDerWaalsContact O-N 3.12Å; D12-W15 WeakPolarHBondContact O-CB 3.43Å; D12-W15 PolarHBondContact O-N 3.34Å; A13-W15 VanDerWaalsContact C-N 3.31Å; A13-W15 PolarHBondContact O-N 3.31Å; W15-H18 WeakPolarHBondContact O-CB 3.15Å; W15-H18 PolarHBondContact O-N 3.47Å; W15-Q19 HydrophobicContact CD2-CG 4.34Å; W15-Q19 HydrophobicContact CG-CG 4.49Å; W15-Q19 HydrophobicContact CZ2-CG 4.27Å; W15-Q19 WeakPolarHBondContact O-CG 3.46Å; W15-Q19 PolarHBondContact O-N 3.1Å; W15-F111 HydrophobicContact CB-CE2 4.3Å; W15-F111 HydrophobicContact CE3-CE2 4.01Å; W15-K114 HydrophobicContact CD2-CB 4.25Å; W15-K114 HydrophobicContact CD2-CD 3.65Å; W15-K114 HydrophobicContact CD2-CG 4.37Å; W15-K114 HydrophobicContact CE3-CB 4.05Å; W15-K114 HydrophobicContact CE3-CD 4.24Å; W15-K114 HydrophobicContact CG-CD 3.79Å; W15-K114 HydrophobicContact CH2-CB 3.71Å; W15-K114 HydrophobicContact CH2-CG 4.36Å; W15-K114 HydrophobicContact CZ2-CB 3.95Å; W15-K114 HydrophobicContact CZ2-CD 4.15Å; W15-K114 HydrophobicContact CZ2-CG 4.07Å; W15-K114 HydrophobicContact CZ3-CB 3.79Å; W15-R118 HydrophobicContact CH2-CB 4.06Å; W15-R118 HydrophobicContact CH2-CG 4.45Å; W15-R118 HydrophobicContact CZ3-CB 4.43Å
16D94.3Very high90.7Very high87 Ų8773.7 Ų73.747%0.46539%0.389SS..Hα-helixtrans-65.5-39.5179-80.2-7.2000111.9D12 A13 Q19 S20D12-D16 WeakPolarHBondContact O-CB 3.33Å; D12-D16 PolarHBondContact O-N 3.34Å; A13-D16 PolarHBondContact O-N 3.11Å; D16-Q19 PolarHBondContact O-N 3.22Å; D16-S20 VanDerWaalsContact O-CB 3.32Å; D16-S20 WeakPolarHBondContact O-CB 3.47Å; D16-S20 PolarHBondContact O-N 2.85Å; D16-S20 PolarHBondContact O-OG 2.82Å
17A92.8Very high91.4Very high49 Ų4972.6 Ų72.641%0.40539%0.39SS..Hα-helixtrans-59.9-47.3171.500000110.9A13 Q19 S20 L21A13-A17 WeakPolarHBondContact O-CB 3.32Å; A13-A17 PolarHBondContact O-N 3.49Å; A17-Q19 PolarHBondContact O-N 3.49Å; A17-S20 PolarHBondContact O-N 2.84Å; A17-L21 WeakPolarHBondContact O-CB 3.08Å; A17-L21 WeakPolarHBondContact O-CG 3.38Å; A17-L21 PolarHBondContact O-N 2.78Å
18H91.4Very high91.9Very high38 Ų3869.8 Ų69.818%0.17638%0.378CS..Hα-helixtrans-57.7-49.7175.3174.882.2000112D14 W15 S20 L21 F22 R118D14-H18 WeakPolarHBondContact O-CB 3.27Å; D14-H18 PolarHBondContact O-N 3.05Å; W15-H18 WeakPolarHBondContact O-CB 3.15Å; W15-H18 PolarHBondContact O-N 3.47Å; H18-S20 PolarHBondContact O-N 2.84Å; H18-L21 PolarHBondContact O-N 2.97Å; H18-F22 VanDerWaalsContact O-CB 3.22Å; H18-F22 WeakPolarHBondContact O-CB 3.27Å; H18-F22 PolarHBondContact O-N 3.03Å; H18-R118 PolarHBondContact NE2-NE 3.32Å
19Q93.4Very high92.4Very high72 Ų7266.8 Ų66.834%0.33636%0.363SS..Hα-helixtrans-61.8-43.7-178.4-72.3-59.4-46.800111.8W15 D16 A17 F22 K23W15-Q19 HydrophobicContact CD2-CG 4.34Å; W15-Q19 HydrophobicContact CG-CG 4.49Å; W15-Q19 HydrophobicContact CZ2-CG 4.27Å; W15-Q19 WeakPolarHBondContact O-CG 3.46Å; W15-Q19 PolarHBondContact O-N 3.1Å; D16-Q19 PolarHBondContact O-N 3.22Å; A17-Q19 PolarHBondContact O-N 3.49Å; Q19-F22 PolarHBondContact O-N 3.32Å; Q19-K23 VanDerWaalsContact O-CB 3.26Å; Q19-K23 WeakPolarHBondContact O-CB 3.39Å; Q19-K23 PolarHBondContact O-N 3.46Å
20S96.3Very high92.8Very high80 Ų8069.5 Ų69.556%0.55937%0.373SS*.Hα-helixtrans-61.9-48.6179.6-61.30000111.5D16 A17 H18 K23 A24D16-S20 VanDerWaalsContact O-CB 3.32Å; D16-S20 WeakPolarHBondContact O-CB 3.47Å; D16-S20 PolarHBondContact O-N 2.85Å; D16-S20 PolarHBondContact O-OG 2.82Å; A17-S20 PolarHBondContact O-N 2.84Å; H18-S20 PolarHBondContact O-N 2.84Å; S20-K23 PolarHBondContact O-N 2.81Å; S20-A24 PolarHBondContact O-N 3.29Å; S20-A24 VanDerWaalsContact O-N 3.11Å
21L94.3Very high93Very high113 Ų11373.5 Ų73.559%0.59239%0.394SS*.Hα-helixtrans-66.3-42.1178.3-68.7170.7000111.9A17 H18 K23 A24 W25 W60A17-L21 WeakPolarHBondContact O-CB 3.08Å; A17-L21 WeakPolarHBondContact O-CG 3.38Å; A17-L21 PolarHBondContact O-N 2.78Å; H18-L21 PolarHBondContact O-N 2.97Å; L21-K23 VanDerWaalsContact C-N 3.35Å; L21-K23 PolarHBondContact O-N 2.84Å; L21-A24 PolarHBondContact O-N 3.4Å; L21-W25 PolarHBondContact O-N 2.84Å; L21-W60 HydrophobicContact CB-CH2 3.78Å; L21-W60 HydrophobicContact CB-CZ3 4.34Å
22F93Very high92.8Very high46 Ų4674.3 Ų74.320%0.20241%0.409CS..Hα-helixtrans-67.3-37.6-179.6-174.1-111.2000111.8H18 Q19 W25 M26 W60H18-F22 VanDerWaalsContact O-CB 3.22Å; H18-F22 WeakPolarHBondContact O-CB 3.27Å; H18-F22 PolarHBondContact O-N 3.03Å; Q19-F22 PolarHBondContact O-N 3.32Å; F22-W25 AromaticContact CE2-CD1 3.78Å; F22-W25 WeakPolarHBondContact O-CB 3.34Å; F22-W25 PolarHBondContact O-N 3.15Å; F22-M26 HydrophobicContact CD1-CG 4.29Å; F22-M26 HydrophobicContact CE1-CG 3.8Å; F22-M26 HydrophobicContact CE1-SD 4.25Å; F22-M26 HydrophobicContact CE2-CG 4.27Å; F22-M26 HydrophobicContact CE2-SD 4.25Å; F22-M26 HydrophobicContact CZ-CG 3.77Å; F22-M26 HydrophobicContact CZ-SD 3.7Å; F22-M26 WeakPolarHBondContact O-CG 3.41Å; F22-M26 PolarHBondContact O-N 3.46Å; F22-W60 HydrophobicContact CB-CH2 3.99Å; F22-W60 HydrophobicContact CB-CZ2 4.17Å; F22-W60 HydrophobicContact CD2-CD2 4.07Å; F22-W60 AromaticContact CD2-CE2 3.96Å; F22-W60 HydrophobicContact CD2-CE3 4.32Å; F22-W60 HydrophobicContact CD2-CH2 4.28Å; F22-W60 HydrophobicContact CD2-CZ2 4.06Å; F22-W60 HydrophobicContact CD2-CZ3 4.41Å
23K95.1Very high92.5Very high166 Ų16673.3 Ų73.372%0.72241%0.414SS*.Hα-helixtrans-62.1-45.2173-176.9179.3178.4-178.90111.7Q19 S20 L21 W25 M26 G27Q19-K23 VanDerWaalsContact O-CB 3.26Å; Q19-K23 WeakPolarHBondContact O-CB 3.39Å; Q19-K23 PolarHBondContact O-N 3.46Å; S20-K23 PolarHBondContact O-N 2.81Å; L21-K23 VanDerWaalsContact C-N 3.35Å; L21-K23 PolarHBondContact O-N 2.84Å; K23-W25 VanDerWaalsContact C-N 3.33Å; K23-W25 PolarHBondContact O-N 2.91Å; K23-M26 PolarHBondContact O-N 3.29Å; K23-G27 PolarHBondContact O-N 3.08Å; K23-G27 VanDerWaalsContact O-N 3.08Å
24A94.9Very high92.4Very high61 Ų6171.8 Ų71.850%0.50440%0.398SS..Hα-helixtrans-60.2-43.9175.600000111.6S20 L21 M26 G27 I28S20-A24 PolarHBondContact O-N 3.29Å; S20-A24 VanDerWaalsContact O-N 3.11Å; L21-A24 PolarHBondContact O-N 3.4Å; A24-M26 PolarHBondContact O-N 3.1Å; A24-G27 PolarHBondContact O-N 3.38Å; A24-I28 PolarHBondContact O-N 2.87Å; A24-I28 VanDerWaalsContact O-N 3.1Å
25W93.8Very high92.4Very high30 Ų3075.5 Ų75.511%0.11441%0.407CS..Hα-helixtrans-59.4-45174.6165.9-107.1000113.1L21 F22 K23 G27 I28 K29 H34 L58 W60L21-W25 PolarHBondContact O-N 2.84Å; F22-W25 AromaticContact CE2-CD1 3.78Å; F22-W25 WeakPolarHBondContact O-CB 3.34Å; F22-W25 PolarHBondContact O-N 3.15Å; K23-W25 VanDerWaalsContact C-N 3.33Å; K23-W25 PolarHBondContact O-N 2.91Å; W25-G27 VanDerWaalsContact C-N 3.27Å; W25-G27 PolarHBondContact O-N 3.49Å; W25-I28 HydrophobicContact CZ3-CG2 4.42Å; W25-I28 WeakPolarHBondContact O-CB 3.38Å; W25-I28 PolarHBondContact O-N 3.2Å; W25-I28 VanDerWaalsContact O-N 3.1Å; W25-K29 HydrophobicContact CZ2-CB 4.45Å; W25-K29 HydrophobicContact CZ2-CD 4.34Å; W25-K29 PolarHBondContact O-N 2.89Å; W25-H34 HydrophobicContact CH2-CB 3.76Å; W25-H34 HydrophobicContact CZ3-CB 4.17Å; W25-L58 HydrophobicContact CH2-CB 4.14Å; W25-L58 VanDerWaalsContact CH2-O 3.25Å; W25-L58 WeakPolarHBondContact CH2-O 3.33Å; W25-L58 HydrophobicContact CZ3-CB 3.94Å; W25-W60 HydrophobicContact CB-CE3 3.41Å; W25-W60 VanDerWaalsContact CB-CE3 3.41Å; W25-W60 HydrophobicContact CB-CZ3 3.46Å; W25-W60 VanDerWaalsContact CB-CZ3 3.46Å; W25-W60 AromaticContact CD1-CE3 3.66Å; W25-W60 HydrophobicContact CD2-CB 4.31Å; W25-W60 AromaticContact CD2-CE3 3.96Å; W25-W60 HydrophobicContact CD2-CE3 3.96Å; W25-W60 HydrophobicContact CG-CB 4.46Å; W25-W60 HydrophobicContact CG-CD2 4.19Å; W25-W60 AromaticContact CG-CE3 3.34Å; W25-W60 HydrophobicContact CG-CE3 3.34Å; W25-W60 AromaticContact CG-CZ3 3.96Å; W25-W60 HydrophobicContact CG-CZ3 3.96Å; W25-W60 HydrophobicContact CZ2-CB 4.31Å
26M94.5Very high92.2Very high61 Ų6179.4 Ų79.430%0.343%0.43SS..Hα-helixtrans-59.3-41176.4-74.1-58.7-57.500111.5F22 K23 A24 I28 K29 E30F22-M26 HydrophobicContact CD1-CG 4.29Å; F22-M26 HydrophobicContact CE1-CG 3.8Å; F22-M26 HydrophobicContact CE1-SD 4.25Å; F22-M26 HydrophobicContact CE2-CG 4.27Å; F22-M26 HydrophobicContact CE2-SD 4.25Å; F22-M26 HydrophobicContact CZ-CG 3.77Å; F22-M26 HydrophobicContact CZ-SD 3.7Å; F22-M26 WeakPolarHBondContact O-CG 3.41Å; F22-M26 PolarHBondContact O-N 3.46Å; K23-M26 PolarHBondContact O-N 3.29Å; A24-M26 PolarHBondContact O-N 3.1Å; M26-I28 VanDerWaalsContact C-N 3.33Å; M26-I28 PolarHBondContact O-N 3.49Å; M26-K29 PolarHBondContact O-N 3.48Å; M26-K29 VanDerWaalsContact O-N 3.15Å; M26-E30 WeakPolarHBondContact O-CB 3.44Å; M26-E30 VanDerWaalsContact O-CG 3.27Å; M26-E30 WeakPolarHBondContact O-CG 3.49Å; M26-E30 PolarHBondContact O-N 3.3Å
27G94.9Very high92Very high25 Ų2579.3 Ų79.326%0.25843%0.429SS..Hα-helixtrans-60.2-38.3173.400000113.7K23 A24 W25 N31K23-G27 PolarHBondContact O-N 3.08Å; K23-G27 VanDerWaalsContact O-N 3.08Å; A24-G27 PolarHBondContact O-N 3.38Å; W25-G27 VanDerWaalsContact C-N 3.27Å; W25-G27 PolarHBondContact O-N 3.49Å; G27-N31 PolarHBondContact O-N 3.32Å; G27-N31 PolarHBondContact O-ND2 3.17Å
28I93.1Very high91.7Very high76 Ų7679.8 Ų79.839%0.3943%0.433SS..Hα-helixtrans-66.5-43.8173.5-65.1167.3000110.6A24 W25 M26 N31 A32 G33 H34A24-I28 PolarHBondContact O-N 2.87Å; A24-I28 VanDerWaalsContact O-N 3.1Å; W25-I28 HydrophobicContact CZ3-CG2 4.42Å; W25-I28 WeakPolarHBondContact O-CB 3.38Å; W25-I28 PolarHBondContact O-N 3.2Å; W25-I28 VanDerWaalsContact O-N 3.1Å; M26-I28 VanDerWaalsContact C-N 3.33Å; M26-I28 PolarHBondContact O-N 3.49Å; I28-N31 PolarHBondContact O-N 3.38Å; I28-A32 PolarHBondContact O-N 3.46Å; I28-G33 PolarHBondContact O-N 3.38Å; I28-H34 HydrophobicContact CG2-CB 4.31Å
29K91.7Very high91.7Very high102 Ų10284.1 Ų84.144%0.44346%0.455SS..Hα-helixtrans-65-46.8-177-168.5177.6-178.1178.50111.9W25 M26 N31 A32 H34W25-K29 HydrophobicContact CZ2-CB 4.45Å; W25-K29 HydrophobicContact CZ2-CD 4.34Å; W25-K29 PolarHBondContact O-N 2.89Å; M26-K29 PolarHBondContact O-N 3.48Å; M26-K29 VanDerWaalsContact O-N 3.15Å; K29-N31 VanDerWaalsContact C-N 3.28Å; K29-N31 PolarHBondContact O-N 2.82Å; K29-A32 PolarHBondContact O-N 2.92Å; K29-A32 VanDerWaalsContact O-N 3.09Å; K29-H34 PolarHBondContact O-CE1 2.95Å; K29-H34 PolarHBondContact O-ND1 3.22Å
30E93.6Very high91.4Very high143 Ų14385.4 Ų85.467%0.66846%0.46SS*.Hα-helixtrans-61.4-35.6179.6-74.1168.8-175.500112.3M26 A32M26-E30 WeakPolarHBondContact O-CB 3.44Å; M26-E30 VanDerWaalsContact O-CG 3.27Å; M26-E30 WeakPolarHBondContact O-CG 3.49Å; M26-E30 PolarHBondContact O-N 3.3Å; E30-A32 PolarHBondContact O-N 3.45Å
31N91.5Very high91Very high136 Ų13686.7 Ų86.773%0.72746%0.457SS*.THydrogen-bonded Turntrans-85.112177.3-68.3-49.5000114G27 I28 K29 G33G27-N31 PolarHBondContact O-N 3.32Å; G27-N31 PolarHBondContact O-ND2 3.17Å; I28-N31 PolarHBondContact O-N 3.38Å; K29-N31 VanDerWaalsContact C-N 3.28Å; K29-N31 PolarHBondContact O-N 2.82Å; N31-G33 PolarHBondContact O-N 2.87Å
32A84.9Confident90.6Very high56 Ų5683.8 Ų83.846%0.46344%0.444SS..THydrogen-bonded Turntrans56.49.9-174.100000115.4I28 K29 E30 H34 R35I28-A32 PolarHBondContact O-N 3.46Å; K29-A32 PolarHBondContact O-N 2.92Å; K29-A32 VanDerWaalsContact O-N 3.09Å; E30-A32 PolarHBondContact O-N 3.45Å; A32-H34 PolarHBondContact O-N 3.46Å; A32-H34 VanDerWaalsContact O-N 3.09Å; A32-R35 PolarHBondContact O-N 3.42Å
33G85.5Confident90.2Very high43 Ų4385.8 Ų85.844%0.44346%0.457SS..THydrogen-bonded Turntrans-66.2-12.6-179.700000114.1I28 N31 R35I28-G33 PolarHBondContact O-N 3.38Å; N31-G33 PolarHBondContact O-N 2.87Å; G33-R35 VanDerWaalsContact C-N 3.26Å; G33-R35 PolarHBondContact O-N 3.48Å
34H88.1Confident89.7Confident22 Ų2280.8 Ų80.810%0.10244%0.44CS..THydrogen-bonded Turntrans-71.9-14.7171.166.9-66.8000113.5W25 I28 K29 A32 E57 L58W25-H34 HydrophobicContact CH2-CB 3.76Å; W25-H34 HydrophobicContact CZ3-CB 4.17Å; I28-H34 HydrophobicContact CG2-CB 4.31Å; K29-H34 PolarHBondContact O-CE1 2.95Å; K29-H34 PolarHBondContact O-ND1 3.22Å; A32-H34 PolarHBondContact O-N 3.46Å; A32-H34 VanDerWaalsContact O-N 3.09Å; H34-E57 IonicContact CD2-OE1 3.39Å; H34-E57 PolarHBondContact CD2-OE1 3.03Å; H34-E57 IonicContact NE2-OE1 3.8Å; H34-E57 CarbonylContact O-C 3.51Å; H34-E57 VanDerWaalsContact O-CA 3.27Å; H34-E57 WeakPolarHBondContact O-CA 3.49Å; H34-L58 HydrophobicContact CB-CB 4.17Å; H34-L58 PolarHBondContact O-N 3.12Å
35R90.9Very high89.4Confident143 Ų14386.4 Ų86.454%0.5446%0.462SS..EExtended strand (participates in β ladder)trans-113.2122.8-175.4-63.3174.870.6-177.34.1111.1A32 G33 E57A32-R35 PolarHBondContact O-N 3.42Å; G33-R35 VanDerWaalsContact C-N 3.26Å; G33-R35 PolarHBondContact O-N 3.48Å; R35-E57 HydrophobicContact CG-CG 4.21Å
36L88Confident89Confident119 Ų11993.5 Ų93.562%0.62350%0.501SS*.EExtended strand (participates in β ladder)trans-110.2130.3172.4-79.3156.5000108.9S55 A56L36-S55 CarbonylContact O-C 3.58Å; L36-S55 VanDerWaalsContact O-CA 3.27Å; L36-S55 WeakPolarHBondContact O-CA 3.36Å; L36-A56 HydrophobicContact CB-CB 4.37Å; L36-A56 PolarHBondContact N-O 2.96Å; L36-A56 PolarHBondContact O-N 3.43Å
37N89.4Confident88Confident84 Ų8496.4 Ų96.445%0.44951%0.514SS..EExtended strand (participates in β ladder)trans-121.9131.4173.4-63.1-73000108.8K53 V54 S55N37-K53 WeakPolarHBondContact OD1-CE 3.42Å; N37-K53 PolarHBondContact OD1-NZ 2.86Å; N37-V54 CarbonylContact C-O 3.59Å; N37-V54 WeakPolarHBondContact CA-O 3.43Å; N37-S55 WeakPolarHBondContact OD1-CB 3.48Å
38A88.4Confident87.4Confident59 Ų59102.7 Ų102.749%0.48853%0.534SS..EExtended strand (participates in β ladder)trans-122.5145172.900000109.4K53 V54A38-K53 CarbonylContact O-C 3.58Å; A38-K53 WeakPolarHBondContact O-CA 3.26Å; A38-V54 PolarHBondContact N-O 3.34Å; A38-V54 PolarHBondContact O-N 3.35Å
39M89.6Confident86.9Confident130 Ų130104.4 Ų104.464%0.6454%0.544SS*.EExtended strand (participates in β ladder)trans-112.1131.6172.3-62.5-67.3-109.500107.7V51 S52 K53M39-V51 HydrophobicContact CB-CG1 4.2Å; M39-V51 HydrophobicContact CE-CG1 3.72Å; M39-V51 HydrophobicContact SD-CG1 4.22Å; M39-S52 CarbonylContact C-O 3.53Å; M39-S52 WeakPolarHBondContact CA-O 3.22Å; M39-K53 HydrophobicContact CE-CB 4.45Å; M39-K53 HydrophobicContact SD-CB 3.43Å; M39-K53 WeakPolarHBondContact SD-CB 3.47Å; M39-K53 HydrophobicContact SD-CD 4.17Å; M39-K53 HydrophobicContact SD-CG 3.59Å; M39-K53 VanDerWaalsContact SD-CG 3.59Å
40F87.8Confident86.6Confident98 Ų98102.1 Ų102.143%0.4354%0.536SS..EExtended strand (participates in β ladder)trans-122.7137.917364.6-78.4000109.6V42 S52 V54F40-V42 HydrophobicContact CD2-CG2 3.42Å; F40-V42 VanDerWaalsContact CD2-CG2 3.42Å; F40-V42 HydrophobicContact CE2-CG2 3.38Å; F40-S52 WeakPolarHBondContact CD1-O 3.27Å; F40-S52 PolarHBondContact N-O 2.89Å; F40-S52 PolarHBondContact O-N 2.8Å; F40-V54 HydrophobicContact CD1-CG2 3.58Å; F40-V54 HydrophobicContact CE1-CG2 3.24Å; F40-V54 HydrophobicContact CZ-CG2 4.33Å
41E88.3Confident86.3Confident108 Ų10899.5 Ų99.551%0.50553%0.53SS..EExtended strand (participates in β ladder)trans-95.9124.6176.7-168.2-169.1128.700109.1N43 N49 I50E41-N43 PolarHBondContact OE1-ND2 2.77Å; E41-N49 PolarHBondContact OE1-OD1 3.39Å; E41-I50 CarbonylContact C-O 3.59Å; E41-I50 WeakPolarHBondContact CA-O 3.39Å
42V85.8Confident86.1Confident52 Ų5295 Ų9532%0.31551%0.508SS..EExtended strand (participates in β ladder)trans-107.7126.2176.9-173.80000108.5F40 T44 I50F40-V42 HydrophobicContact CD2-CG2 3.42Å; F40-V42 VanDerWaalsContact CD2-CG2 3.42Å; F40-V42 HydrophobicContact CE2-CG2 3.38Å; V42-T44 HydrophobicContact CG1-CG2 4.21Å; V42-I50 HydrophobicContact CB-CB 4.27Å; V42-I50 PolarHBondContact N-O 3.44Å; V42-I50 WeakPolarHBondContact O-CB 3.25Å; V42-I50 PolarHBondContact O-N 2.72Å
43N84.8Confident86.3Confident88 Ų8898.6 Ų98.647%0.47151%0.514SS..  trans-109124.8172.2-74.7-57.2000108.3E41 K48 N49E41-N43 PolarHBondContact OE1-ND2 2.77Å; N43-K48 WeakPolarHBondContact OD1-CA 3.19Å; N43-K48 VanDerWaalsContact OD1-CB 3.24Å; N43-K48 WeakPolarHBondContact OD1-CB 3.33Å; N43-N49 PolarHBondContact OD1-N 3.33Å
44T84.3Confident86.5Confident60 Ų60100.2 Ų100.237%0.36852%0.515SS..  trans-114.5164.6174670000109.5V42 L46 Q47 I50V42-T44 HydrophobicContact CG1-CG2 4.21Å; T44-L46 PolarHBondContact O-N 3.15Å; T44-Q47 PolarHBondContact N-O 3.02Å; T44-Q47 CarbonylContact O-C 3.55Å; T44-Q47 PolarHBondContact O-N 3.31Å; T44-Q47 VanDerWaalsContact O-O 3.12Å; T44-Q47 PolarHBondContact OG1-N 3.09Å; T44-Q47 PolarHBondContact OG1-O 3.3Å; T44-I50 HydrophobicContact CG2-CD1 4.32Å
45D87.8Confident86.6Confident179 Ų179103.3 Ų103.396%0.95754%0.539SS*.SBendtrans-62.4-30.6179.8-64.5-25.1000112.9
46L86.7Confident86.5Confident180 Ų18099.3 Ų99.394%0.94254%0.536SS*.SBendtrans-87.8-31.4176.8-83.4110.3000113.7T44T44-L46 PolarHBondContact O-N 3.15Å
47Q72.2Confident86.4Confident121 Ų12199.9 Ų99.957%0.56554%0.536SS*.  trans-146.4130.4-171-172.9174.37.600112.1T44 I50T44-Q47 PolarHBondContact N-O 3.02Å; T44-Q47 CarbonylContact O-C 3.55Å; T44-Q47 PolarHBondContact O-N 3.31Å; T44-Q47 VanDerWaalsContact O-O 3.12Å; T44-Q47 PolarHBondContact OG1-N 3.09Å; T44-Q47 PolarHBondContact OG1-O 3.3Å; Q47-I50 HydrophobicContact CB-CD1 4.14Å; Q47-I50 HydrophobicContact CG-CD1 4.07Å; Q47-I50 HydrophobicContact CG-CG1 3.95Å
48K84.2Confident86.3Confident158 Ų158100.4 Ų100.469%0.68754%0.538SS*.  trans-102.4161.2177.8-63.5-170.1179.8-174.90112.1N43 I50N43-K48 WeakPolarHBondContact OD1-CA 3.19Å; N43-K48 VanDerWaalsContact OD1-CB 3.24Å; N43-K48 WeakPolarHBondContact OD1-CB 3.33Å; K48-I50 PolarHBondContact O-N 2.69Å
49N81.7Confident86.1Confident111 Ų111101 Ų10159%0.59454%0.539SS*.  trans62.235174.9-46.4-38.1000114.6E41 N43 V51E41-N49 PolarHBondContact OE1-OD1 3.39Å; N43-N49 PolarHBondContact OD1-N 3.33Å; N49-V51 PolarHBondContact O-N 2.97Å; N49-V51 VanDerWaalsContact O-N 3.09Å
50I85.3Confident85.9Confident54 Ų5498.1 Ų98.128%0.27752%0.521SS..EExtended strand (participates in β ladder)trans-74.9103.1175.7-57.7173.7000108E41 V42 T44 Q47 K48E41-I50 CarbonylContact C-O 3.59Å; E41-I50 WeakPolarHBondContact CA-O 3.39Å; V42-I50 HydrophobicContact CB-CB 4.27Å; V42-I50 PolarHBondContact N-O 3.44Å; V42-I50 WeakPolarHBondContact O-CB 3.25Å; V42-I50 PolarHBondContact O-N 2.72Å; T44-I50 HydrophobicContact CG2-CD1 4.32Å; Q47-I50 HydrophobicContact CB-CD1 4.14Å; Q47-I50 HydrophobicContact CG-CD1 4.07Å; Q47-I50 HydrophobicContact CG-CG1 3.95Å; K48-I50 PolarHBondContact O-N 2.69Å
51V87.1Confident85.5Confident89 Ų8998.4 Ų98.454%0.53953%0.532SS..EExtended strand (participates in β ladder)trans-84.3120.4177.3-175.90000109.8M39 N49M39-V51 HydrophobicContact CB-CG1 4.2Å; M39-V51 HydrophobicContact CE-CG1 3.72Å; M39-V51 HydrophobicContact SD-CG1 4.22Å; N49-V51 PolarHBondContact O-N 2.97Å; N49-V51 VanDerWaalsContact O-N 3.09Å
52S88Confident84.8Confident40 Ų4095.9 Ų95.928%0.2853%0.527SS..EExtended strand (participates in β ladder)trans-115.5136.5177.2-70.40000110.6M39 F40M39-S52 CarbonylContact C-O 3.53Å; M39-S52 WeakPolarHBondContact CA-O 3.22Å; F40-S52 WeakPolarHBondContact CD1-O 3.27Å; F40-S52 PolarHBondContact N-O 2.89Å; F40-S52 PolarHBondContact O-N 2.8Å
53K89.6Confident84.1Confident133 Ų13397 Ų9758%0.57853%0.534SS*.EExtended strand (participates in β ladder)trans-99125.2179-172.6176.5178-175.50110.2N37 A38 M39N37-K53 WeakPolarHBondContact OD1-CE 3.42Å; N37-K53 PolarHBondContact OD1-NZ 2.86Å; A38-K53 CarbonylContact O-C 3.58Å; A38-K53 WeakPolarHBondContact O-CA 3.26Å; M39-K53 HydrophobicContact CE-CB 4.45Å; M39-K53 HydrophobicContact SD-CB 3.43Å; M39-K53 WeakPolarHBondContact SD-CB 3.47Å; M39-K53 HydrophobicContact SD-CD 4.17Å; M39-K53 HydrophobicContact SD-CG 3.59Å; M39-K53 VanDerWaalsContact SD-CG 3.59Å
54V89.2Confident82.7Confident77 Ų7797.2 Ų97.247%0.46753%0.534SS..EExtended strand (participates in β ladder)trans-103.4139.6164.6-170.30000108.6N37 A38 F40N37-V54 CarbonylContact C-O 3.59Å; N37-V54 WeakPolarHBondContact CA-O 3.43Å; A38-V54 PolarHBondContact N-O 3.34Å; A38-V54 PolarHBondContact O-N 3.35Å; F40-V54 HydrophobicContact CD1-CG2 3.58Å; F40-V54 HydrophobicContact CE1-CG2 3.24Å; F40-V54 HydrophobicContact CZ-CG2 4.33Å
55S89.8Confident81.3Confident86 Ų8698.9 Ų98.960%0.60155%0.548SS*.EExtended strand (participates in β ladder)trans-125.3136.9170.456.10000110.4L36 N37L36-S55 CarbonylContact O-C 3.58Å; L36-S55 VanDerWaalsContact O-CA 3.27Å; L36-S55 WeakPolarHBondContact O-CA 3.36Å; N37-S55 WeakPolarHBondContact OD1-CB 3.48Å
56A87.9Confident79.8Confident59 Ų5991.7 Ų91.749%0.48851%0.512SS..EExtended strand (participates in β ladder)trans-119.4145.1169.100000109L36L36-A56 HydrophobicContact CB-CB 4.37Å; L36-A56 PolarHBondContact N-O 2.96Å; L36-A56 PolarHBondContact O-N 3.43Å
57E87.6Confident78.7Confident131 Ų13187.1 Ų87.161%0.61249%0.494SS*.EExtended strand (participates in β ladder)trans-132127.2179.5-172.8171.916600110.2H34 R35H34-E57 IonicContact CD2-OE1 3.39Å; H34-E57 PolarHBondContact CD2-OE1 3.03Å; H34-E57 IonicContact NE2-OE1 3.8Å; H34-E57 CarbonylContact O-C 3.51Å; H34-E57 VanDerWaalsContact O-CA 3.27Å; H34-E57 WeakPolarHBondContact O-CA 3.49Å; R35-E57 HydrophobicContact CG-CG 4.21Å
58L86.3Confident78.5Confident95 Ų9591.5 Ų91.550%0.49751%0.505SS..  trans-70.9140.1167.4-63.4176.4000108.7W25 H34W25-L58 HydrophobicContact CH2-CB 4.14Å; W25-L58 VanDerWaalsContact CH2-O 3.25Å; W25-L58 WeakPolarHBondContact CH2-O 3.33Å; W25-L58 HydrophobicContact CZ3-CB 3.94Å; H34-L58 HydrophobicContact CB-CB 4.17Å; H34-L58 PolarHBondContact O-N 3.12Å
59S84Confident78.1Confident71 Ų7188 Ų8850%0.49749%0.493SS..  trans-122.3148.6174.462.40000110.3
60W85.3Confident78Confident70 Ų7085.1 Ų85.127%0.26548%0.477SS..  trans-65.1137.2168.5-179-100.2000108.9L21 F22 W25 S62L21-W60 HydrophobicContact CB-CH2 3.78Å; L21-W60 HydrophobicContact CB-CZ3 4.34Å; F22-W60 HydrophobicContact CB-CH2 3.99Å; F22-W60 HydrophobicContact CB-CZ2 4.17Å; F22-W60 HydrophobicContact CD2-CD2 4.07Å; F22-W60 AromaticContact CD2-CE2 3.96Å; F22-W60 HydrophobicContact CD2-CE3 4.32Å; F22-W60 HydrophobicContact CD2-CH2 4.28Å; F22-W60 HydrophobicContact CD2-CZ2 4.06Å; F22-W60 HydrophobicContact CD2-CZ3 4.41Å; W25-W60 HydrophobicContact CB-CE3 3.41Å; W25-W60 VanDerWaalsContact CB-CE3 3.41Å; W25-W60 HydrophobicContact CB-CZ3 3.46Å; W25-W60 VanDerWaalsContact CB-CZ3 3.46Å; W25-W60 AromaticContact CD1-CE3 3.66Å; W25-W60 HydrophobicContact CD2-CB 4.31Å; W25-W60 AromaticContact CD2-CE3 3.96Å; W25-W60 HydrophobicContact CD2-CE3 3.96Å; W25-W60 HydrophobicContact CG-CB 4.46Å; W25-W60 HydrophobicContact CG-CD2 4.19Å; W25-W60 AromaticContact CG-CE3 3.34Å; W25-W60 HydrophobicContact CG-CE3 3.34Å; W25-W60 AromaticContact CG-CZ3 3.96Å; W25-W60 HydrophobicContact CG-CZ3 3.96Å; W25-W60 HydrophobicContact CZ2-CB 4.31Å; W60-S62 PolarHBondContact O-N 3.16Å; W60-S62 VanDerWaalsContact O-N 3.16Å
61P79.4Confident77.6Confident104 Ų10490.5 Ų90.568%0.67550%0.499SS*.  trans-50.3124.6179.2-29.135.9000111.8
62S73.3Confident77.4Confident56 Ų5691.9 Ų91.939%0.39250%0.498SS..  trans-148.9152.518074.30000109.9W60 L64W60-S62 PolarHBondContact O-N 3.16Å; W60-S62 VanDerWaalsContact O-N 3.16Å; S62-L64 PolarHBondContact O-N 3.05Å
63V71.4Confident77.2Confident76 Ų7693.7 Ų93.746%0.46151%0.509SS..  trans-75.2107.9173.1-170.60000107.7S65 S66 I85 L87V63-S65 VanDerWaalsContact C-N 3.3Å; V63-S65 PolarHBondContact O-N 3.3Å; V63-S66 VanDerWaalsContact CG1-OG 3.22Å; V63-S66 WeakPolarHBondContact CG1-OG 3.32Å; V63-I85 HydrophobicContact CG1-CG2 4.46Å; V63-L87 HydrophobicContact CG2-CD1 4.31Å
64L56.2Low77Confident91 Ų9196.1 Ų96.148%0.47653%0.527SS..SBendtrans-75.5-14.5-164.7-74.1166.5000114.3S62S62-L64 PolarHBondContact O-N 3.05Å
65S54.5Low76.9Confident95 Ų9595.7 Ų95.766%0.66453%0.525SS*.SBendtrans-147.72.3-165.3-44.20000115.6V63V63-S65 VanDerWaalsContact C-N 3.3Å; V63-S65 PolarHBondContact O-N 3.3Å
66S57.3Low76.9Confident29 Ų2998 Ų9820%0.20353%0.53CS..SBendtrans-105.1148.2178.890.60000111.3V63 R68V63-S66 VanDerWaalsContact CG1-OG 3.22Å; V63-S66 WeakPolarHBondContact CG1-OG 3.32Å; S66-R68 PolarHBondContact O-N 3.08Å
67P63.2Low76.9Confident84 Ų84101.3 Ų101.355%0.54555%0.545SS..  trans-58.913216826.2-32.4000108.6L69 L70P67-L69 WeakPolarHBondContact CB-O 3.34Å; P67-L69 PolarHBondContact O-N 3.42Å; P67-L70 HydrophobicContact CG-CD2 3.88Å
68R68.1Low76.8Confident212 Ų212103.1 Ų103.180%0.856%0.559SS**SBendtrans-62.2-11.9175.9-64.9-176.8-175.8-133.8-1.8112.8S66S66-R68 PolarHBondContact O-N 3.08Å
69L75.3Confident76.7Confident84 Ų84102 Ų10244%0.4456%0.558SS.*SBendtrans-130.6116.7176.317764.6000108.1P67 V124P67-L69 WeakPolarHBondContact CB-O 3.34Å; P67-L69 PolarHBondContact O-N 3.42Å; L69-V124 HydrophobicContact CD1-CG1 3.66Å; L69-V124 HydrophobicContact CD2-CG1 3.65Å; L69-V124 HydrophobicContact CG-CG1 4.18Å
70L78.6Confident76.7Confident51 Ų51103.1 Ų103.127%0.26757%0.565SS.*  trans-90.9138.8170.9-64.6165.5000109P67 F72 I85P67-L70 HydrophobicContact CG-CD2 3.88Å; L70-F72 HydrophobicContact CB-CE2 4.21Å; L70-I85 HydrophobicContact CD1-CD1 3.42Å; L70-I85 VanDerWaalsContact CD1-CD1 3.42Å; L70-I85 HydrophobicContact CD1-CG1 3.83Å
71K77.8Confident76.7Confident167 Ų167101.5 Ų101.573%0.72657%0.565SS**  trans-118.1107.5175.4-71.6-175.2-179.6179.90108.1
72F82.6Confident77Confident119 Ų119104 Ų10452%0.52257%0.568SS.*PPolyproline II helixtrans-76.5126.9172.6-65-85.9000109.2L70 E83L70-F72 HydrophobicContact CB-CE2 4.21Å; F72-E83 HydrophobicContact CD1-CG 3.85Å; F72-E83 HydrophobicContact CE1-CB 3.85Å; F72-E83 HydrophobicContact CE1-CG 3.58Å; F72-E83 HydrophobicContact CZ-CB 4.25Å; F72-E83 HydrophobicContact CZ-CG 4.2Å
73P83.7Confident77.4Confident78 Ų78105.9 Ų105.951%0.50657%0.57SS.*PPolyproline II helixtrans-60.7153.8171.924.9-35.5000111.4T75 S81P73-T75 PolarHBondContact O-N 3.29Å; P73-S81 VanDerWaalsContact CD-OG 3.26Å; P73-S81 WeakPolarHBondContact CD-OG 3.29Å; P73-S81 WeakPolarHBondContact CG-OG 3.48Å
74L85.6Confident77.8Confident183 Ų183110.4 Ų110.496%0.95859%0.586SS**PPolyproline II helixtrans-62.3130.1171.4-67.8172.7000109.5
75T86.5Confident78.7Confident69 Ų69109.3 Ų109.342%0.42358%0.58SS.*  trans-108.7155.7175.762.20000110.5P73 C79P73-T75 PolarHBondContact O-N 3.29Å; T75-C79 WeakPolarHBondContact CB-O 3.48Å; T75-C79 PolarHBondContact OG1-O 3.3Å
76N91Very high79.8Confident134 Ų134108.5 Ų108.572%0.71758%0.575SS**  trans-66.5160.8167.9-70.6-34000110.2N78 C79N76-N78 PolarHBondContact O-N 3.49Å; N76-C79 WeakPolarHBondContact O-CB 3.29Å; N76-C79 PolarHBondContact O-N 3.35Å
77T88Confident80.7Confident129 Ų129111.3 Ų111.379%0.79159%0.587SS**THydrogen-bonded Turntrans-53.1132.2174.5-450000110.6C79T77-C79 VanDerWaalsContact C-N 3.28Å; T77-C79 PolarHBondContact O-N 3.2Å
78N83.9Confident81.4Confident169 Ų169113.5 Ų113.590%0.90459%0.59SS**THydrogen-bonded Turntrans67.317.1-175.6-51.8-36.3000115.8N76N76-N78 PolarHBondContact O-N 3.49Å
79C85.5Confident82Confident72 Ų72106.2 Ų106.249%0.48657%0.567SS.*  trans-107.4144.5169-63.70000110.9T75 N76 T77T75-C79 WeakPolarHBondContact CB-O 3.48Å; T75-C79 PolarHBondContact OG1-O 3.3Å; N76-C79 WeakPolarHBondContact O-CB 3.29Å; N76-C79 PolarHBondContact O-N 3.35Å; T77-C79 VanDerWaalsContact C-N 3.28Å; T77-C79 PolarHBondContact O-N 3.2Å
80S83.9Confident82.1Confident93 Ų93106.8 Ų106.865%0.6558%0.575SS**  trans-100.5160.2171.553.30000111.2
81S85.3Confident82.2Confident36 Ų36106.5 Ų106.525%0.25258%0.581SS.*  trans-120.8141.9164.9167.40000107.7P73P73-S81 VanDerWaalsContact CD-OG 3.26Å; P73-S81 WeakPolarHBondContact CD-OG 3.29Å; P73-S81 WeakPolarHBondContact CG-OG 3.48Å
82E84.7Confident82.4Confident157 Ų157106.3 Ų106.373%0.73459%0.588SS**  trans-122.8138.8-177.9-65.8177.2-168.500109.2
83E82.1Confident82.5Confident95 Ų95104.7 Ų104.744%0.44459%0.587SS.*  trans-129.9134.4177.5-73.4-67.6155.900108.7F72F72-E83 HydrophobicContact CD1-CG 3.85Å; F72-E83 HydrophobicContact CE1-CB 3.85Å; F72-E83 HydrophobicContact CE1-CG 3.58Å; F72-E83 HydrophobicContact CZ-CB 4.25Å; F72-E83 HydrophobicContact CZ-CG 4.2Å
84E79.6Confident82.5Confident171 Ų171106.6 Ų106.680%0.79960%0.6SS**  trans-93.4131179-172.7174.4-175.800110.6
85I76.4Confident82.4Confident69 Ų69101.5 Ų101.535%0.35458%0.576SS.*  trans-120.7120.6176.3-51.9169.8000108.4V63 L70 F99V63-I85 HydrophobicContact CG1-CG2 4.46Å; L70-I85 HydrophobicContact CD1-CD1 3.42Å; L70-I85 VanDerWaalsContact CD1-CD1 3.42Å; L70-I85 HydrophobicContact CD1-CG1 3.83Å; I85-F99 HydrophobicContact CD1-CE1 4.45Å
86S76.4Confident82.3Confident78 Ų78109.4 Ų109.455%0.54560%0.599SS.*  trans-95.7124.8173.3-57.90000110.3
87L77Confident81.8Confident88 Ų88106.3 Ų106.346%0.46159%0.586SS.*  trans-114.8121.5172.3-179.267.5000109.1V63 V97V63-L87 HydrophobicContact CG2-CD1 4.31Å; L87-V97 HydrophobicContact CD2-CB 4.18Å; L87-V97 HydrophobicContact CD2-CG1 3.73Å; L87-V97 HydrophobicContact CD2-CG2 3.44Å; L87-V97 VanDerWaalsContact CD2-CG2 3.44Å
88E77.7Confident81.6Confident130 Ų130107 Ų10761%0.60758%0.58SS**  trans-100.4130.5175.3-171.6176.3167.700109.6P90E88-P90 WeakPolarHBondContact O-CD 3.42Å
89N81.1Confident81.5Confident59 Ų59104.6 Ų104.632%0.31656%0.561SS.*  trans-95.4107.2170.7177.326.4000108.9A91 V93 V95N89-A91 PolarHBondContact O-N 3.46Å; N89-A91 WeakPolarHBondContact OD1-CB 3.28Å; N89-A91 PolarHBondContact OD1-N 3.22Å; N89-A91 VanDerWaalsContact OD1-N 3.15Å; N89-V93 PolarHBondContact ND2-O 3.42Å; N89-V95 HydrophobicContact CB-CG2 3.72Å; N89-V95 WeakPolarHBondContact OD1-CG1 3.28Å
90P77.2Confident81.4Confident95 Ų95103.3 Ų103.362%0.61755%0.549SS*.  trans-75.6-6.3179.232.2-36.3000113.1E88E88-P90 WeakPolarHBondContact O-CD 3.42Å
91A79.4Confident81.5Confident46 Ų4699.9 Ų99.938%0.3853%0.525SS..SBendtrans-82.8156.7179.400000112.2N89 V93N89-A91 PolarHBondContact O-N 3.46Å; N89-A91 WeakPolarHBondContact OD1-CB 3.28Å; N89-A91 PolarHBondContact OD1-N 3.22Å; N89-A91 VanDerWaalsContact OD1-N 3.15Å; A91-V93 HydrophobicContact CB-CG2 4.09Å; A91-V93 PolarHBondContact O-N 3.4Å
92D82.7Confident81.4Confident163 Ų163100.1 Ų100.187%0.87252%0.523SS*.SBendtrans-80.7-3.5173.161.5-19.6000113.4
93V85Confident81.5Confident85 Ų8594 Ų9452%0.51550%0.499SS..SBendtrans-112.5148.7178.2-63.50000111.9N89 A91N89-V93 PolarHBondContact ND2-O 3.42Å; A91-V93 HydrophobicContact CB-CG2 4.09Å; A91-V93 PolarHBondContact O-N 3.4Å
94P84.6Confident81.7Confident118 Ų11891.9 Ų91.977%0.76649%0.491SS*.  trans-60.4141175.4-22.233000112.7
95V82.7Confident82.1Confident76 Ų7684.6 Ų84.646%0.46146%0.456SS..  trans-116.4139.8173.4-63.70000110.6N89 V97N89-V95 HydrophobicContact CB-CG2 3.72Å; N89-V95 WeakPolarHBondContact OD1-CG1 3.28Å; V95-V97 HydrophobicContact CG2-CG2 4.26Å
96Y83.8Confident82.7Confident234 Ų23483.7 Ų83.792%0.91846%0.455SS*.  trans-93.4131.9172.9-69.5-86.1000109.7
97V81.8Confident83.1Confident70 Ų7083 Ų8342%0.42445%0.446SS..  trans-125.3130.7-176.6-177.10000108.3L87 V95 F99L87-V97 HydrophobicContact CD2-CB 4.18Å; L87-V97 HydrophobicContact CD2-CG1 3.73Å; L87-V97 HydrophobicContact CD2-CG2 3.44Å; L87-V97 VanDerWaalsContact CD2-CG2 3.44Å; V95-V97 HydrophobicContact CG2-CG2 4.26Å; V97-F99 HydrophobicContact CG1-CE2 4.28Å
98Q83.6Confident83.6Confident143 Ų14380 Ų8067%0.66843%0.432SS*.  trans-127.2135.8-179.6-166.7177.99.400110.2I100Q98-I100 HydrophobicContact CG-CD1 4.1Å; Q98-I100 HydrophobicContact CG-CG1 3.7Å
99F81.4Confident84Confident119 Ų11976.7 Ų76.752%0.52242%0.423SS..  trans-103.4125.6168.4-69-90.3000108.1I85 V97 V136I85-F99 HydrophobicContact CD1-CE1 4.45Å; V97-F99 HydrophobicContact CG1-CE2 4.28Å; F99-V136 HydrophobicContact CB-CG1 4.44Å; F99-V136 HydrophobicContact CB-CG2 3.92Å; F99-V136 HydrophobicContact CD2-CG1 3.98Å; F99-V136 HydrophobicContact CG-CG1 4.3Å; F99-V136 HydrophobicContact CG-CG2 4.35Å
100I83.4Confident84.4Confident45 Ų4576.4 Ų76.423%0.23142%0.423CS..  trans-128.8117.9-178.3-53.5179.2000108.3M6 Q98 L102 L104 Y105M6-I100 HydrophobicContact CE-CD1 4.24Å; M6-I100 HydrophobicContact CE-CG2 4.26Å; M6-I100 HydrophobicContact SD-CG2 3.8Å; Q98-I100 HydrophobicContact CG-CD1 4.1Å; Q98-I100 HydrophobicContact CG-CG1 3.7Å; I100-L102 PolarHBondContact O-N 3.01Å; I100-L104 HydrophobicContact CG2-CD1 4.45Å; I100-Y105 HydrophobicContact CG2-CE2 3.8Å
101P84.9Confident84.9Confident21 Ų2172.8 Ų72.814%0.13640%0.398CS..  trans-57.9127.1166.7-12.819.3000111.4A103 L104 L132 F134P101-A103 PolarHBondContact O-N 3.23Å; P101-A103 VanDerWaalsContact O-N 3.15Å; P101-L104 HydrophobicContact CB-CD1 4.39Å; P101-L104 HydrophobicContact CB-CG 4.08Å; P101-L104 HydrophobicContact CG-CD1 3.9Å; P101-L104 HydrophobicContact CG-CG 4.09Å; P101-L104 WeakPolarHBondContact O-CB 3.36Å; P101-L104 PolarHBondContact O-N 3Å; P101-L132 HydrophobicContact CB-CD2 4.44Å; P101-F134 HydrophobicContact CB-CE1 3.63Å; P101-F134 HydrophobicContact CB-CE2 4.2Å; P101-F134 HydrophobicContact CB-CZ 3.38Å; P101-F134 HydrophobicContact CG-CE1 3.97Å; P101-F134 HydrophobicContact CG-CE2 3.66Å; P101-F134 HydrophobicContact CG-CZ 3.37Å
102L84.9Confident85.3Confident40 Ų4070.8 Ų70.821%0.20938%0.381CS..G310 helixtrans-56.9-33.8179.7-170.956.5000111.6I100 L104 Y105 P108 F111 A112 L115 L129I100-L102 PolarHBondContact O-N 3.01Å; L102-L104 PolarHBondContact O-N 3.41Å; L102-L104 VanDerWaalsContact O-N 3.11Å; L102-Y105 HydrophobicContact CD1-CD2 3.95Å; L102-Y105 HydrophobicContact CD1-CE2 4.36Å; L102-Y105 WeakPolarHBondContact O-CD2 3.39Å; L102-Y105 PolarHBondContact O-N 3.4Å; L102-Y105 VanDerWaalsContact O-N 3.16Å; L102-P108 HydrophobicContact CG-CB 4.18Å; L102-P108 WeakPolarHBondContact O-CB 3.49Å; L102-F111 HydrophobicContact CD1-CB 4.19Å; L102-F111 HydrophobicContact CD1-CD1 3.38Å; L102-F111 HydrophobicContact CD1-CE1 4.14Å; L102-F111 HydrophobicContact CD1-CG 4.15Å; L102-A112 HydrophobicContact CD2-CB 3.82Å; L102-L115 HydrophobicContact CD1-CD1 4.29Å; L102-L129 HydrophobicContact CD2-CD2 3.53Å; L102-L129 HydrophobicContact CG-CD2 4.19Å
103A86.1Confident85.5Confident28 Ų2868.4 Ų68.423%0.23137%0.368CS..G310 helixtrans-60.3-15.3175.800000114.9P101 L129 T131 L132P101-A103 PolarHBondContact O-N 3.23Å; P101-A103 VanDerWaalsContact O-N 3.15Å; A103-L129 WeakPolarHBondContact CA-O 3.42Å; A103-L129 WeakPolarHBondContact CB-O 3.43Å; A103-T131 WeakPolarHBondContact CB-O 3.26Å; A103-L132 HydrophobicContact CB-CD2 3.78Å; A103-L132 HydrophobicContact CB-CG 4.4Å
104L86.4Confident85.7Confident52 Ų5266.7 Ų66.727%0.27235%0.354SS..G310 helixtrans-80.7-21.1177-64.5-176.9000113.3M6 I100 P101 L102 L132M6-L104 WeakPolarHBondContact CB-O 3.37Å; M6-L104 HydrophobicContact CG-CB 4.01Å; M6-L104 PolarHBondContact N-O 2.81Å; M6-L104 HydrophobicContact SD-CB 3.84Å; I100-L104 HydrophobicContact CG2-CD1 4.45Å; P101-L104 HydrophobicContact CB-CD1 4.39Å; P101-L104 HydrophobicContact CB-CG 4.08Å; P101-L104 HydrophobicContact CG-CD1 3.9Å; P101-L104 HydrophobicContact CG-CG 4.09Å; P101-L104 WeakPolarHBondContact O-CB 3.36Å; P101-L104 PolarHBondContact O-N 3Å; L102-L104 PolarHBondContact O-N 3.41Å; L102-L104 VanDerWaalsContact O-N 3.11Å; L104-L132 HydrophobicContact CD2-CD2 3.8Å; L104-L132 HydrophobicContact CG-CD2 4.37Å
105Y88.6Confident85.8Confident18 Ų1863.1 Ų63.17%0.07133%0.328CS..SBendtrans-70.5148.4175.9-68.8-77.9000110.7M6 W11 D14 I100 L102 N107 P108 F111M6-Y105 HydrophobicContact SD-CD1 4.31Å; M6-Y105 HydrophobicContact SD-CE1 4.28Å; W11-Y105 HydrophobicContact CB-CD1 3.4Å; W11-Y105 VanDerWaalsContact CB-CD1 3.4Å; W11-Y105 HydrophobicContact CB-CE1 3.95Å; W11-Y105 HydrophobicContact CB-CG 3.94Å; D14-Y105 PolarHBondContact OD2-OH 3.49Å; I100-Y105 HydrophobicContact CG2-CE2 3.8Å; L102-Y105 HydrophobicContact CD1-CD2 3.95Å; L102-Y105 HydrophobicContact CD1-CE2 4.36Å; L102-Y105 WeakPolarHBondContact O-CD2 3.39Å; L102-Y105 PolarHBondContact O-N 3.4Å; L102-Y105 VanDerWaalsContact O-N 3.16Å; Y105-N107 PolarHBondContact O-N 3.24Å; Y105-P108 WeakPolarHBondContact O-CD 3.44Å; Y105-F111 AromaticContact CD2-CD1 3.79Å; Y105-F111 HydrophobicContact CD2-CD1 3.79Å; Y105-F111 HydrophobicContact CD2-CE1 4.08Å; Y105-F111 HydrophobicContact CE1-CE1 4.32Å; Y105-F111 AromaticContact CE2-CD1 3.75Å; Y105-F111 HydrophobicContact CE2-CD1 3.75Å; Y105-F111 AromaticContact CE2-CE1 3.54Å; Y105-F111 HydrophobicContact CE2-CE1 3.54Å; Y105-F111 HydrophobicContact CG-CD1 4.22Å; Y105-F111 AromaticContact CZ-CE1 3.65Å
106S87.5Confident85.9Confident49 Ų4960.8 Ų60.834%0.34331%0.314SS..SBendtrans-59.1-30.6177.555.20000113.6E8E8-S106 PolarHBondContact O-OG 3.37Å
107N85.6Confident86Confident63 Ų6354.1 Ų54.134%0.33730%0.302SS..  trans-135.276.4178-163.7-18.1000111.9Y105 S109 V110 F111Y105-N107 PolarHBondContact O-N 3.24Å; N107-S109 VanDerWaalsContact C-N 3.27Å; N107-S109 PolarHBondContact O-N 3.43Å; N107-V110 VanDerWaalsContact ND2-CG2 3.29Å; N107-V110 WeakPolarHBondContact ND2-CG2 3.23Å; N107-V110 PolarHBondContact O-N 2.94Å; N107-V110 WeakPolarHBondContact OD1-CG2 3.22Å; N107-V110 PolarHBondContact OD1-N 3.47Å; N107-F111 PolarHBondContact O-N 3.18Å
108P87Confident86.1Confident27 Ų2753.9 Ų53.918%0.17529%0.293CS..Hα-helixtrans-65.7-29.9-172.427.2-34.6000112.5L102 Y105 A112 L129L102-P108 HydrophobicContact CG-CB 4.18Å; L102-P108 WeakPolarHBondContact O-CB 3.49Å; Y105-P108 WeakPolarHBondContact O-CD 3.44Å; P108-A112 VanDerWaalsContact O-CB 3.23Å; P108-A112 WeakPolarHBondContact O-CB 3.35Å; P108-A112 PolarHBondContact O-N 3.02Å; P108-L129 HydrophobicContact CB-CB 4.24Å; P108-L129 HydrophobicContact CG-CB 4.35Å
109S87.3Confident86Confident60 Ų6051 Ų5142%0.4228%0.279SS..Hα-helixtrans-67.7-48.5-179-53.90000112.2N107 F111 A112 D113 L129N107-S109 VanDerWaalsContact C-N 3.27Å; N107-S109 PolarHBondContact O-N 3.43Å; S109-F111 VanDerWaalsContact C-N 3.29Å; S109-F111 PolarHBondContact O-N 3.01Å; S109-A112 WeakPolarHBondContact O-CB 3.47Å; S109-A112 PolarHBondContact O-N 3.01Å; S109-D113 PolarHBondContact O-N 3.09Å; S109-L129 WeakPolarHBondContact OG-CD1 3.27Å
110V88.1Confident85.8Confident53 Ų5351.7 Ų51.732%0.32129%0.288SS..Hα-helixtrans-62.5-41.8178.9172.40000110.7W11 N107 D113 K114W11-V110 HydrophobicContact CE3-CG1 4.46Å; W11-V110 HydrophobicContact CH2-CG1 3.6Å; W11-V110 HydrophobicContact CZ2-CG1 4.37Å; W11-V110 HydrophobicContact CZ3-CG1 3.61Å; N107-V110 VanDerWaalsContact ND2-CG2 3.29Å; N107-V110 WeakPolarHBondContact ND2-CG2 3.23Å; N107-V110 PolarHBondContact O-N 2.94Å; N107-V110 WeakPolarHBondContact OD1-CG2 3.22Å; N107-V110 PolarHBondContact OD1-N 3.47Å; V110-D113 PolarHBondContact O-N 3.42Å; V110-K114 PolarHBondContact O-N 2.82Å
111F88.4Confident85.4Confident18 Ų1852.2 Ų52.28%0.07929%0.291CS..Hα-helixtrans-69-38.9177.8-167.5-142.7000111.9W11 W15 L102 Y105 N107 S109 D113 K114 L115W11-F111 HydrophobicContact CB-CB 4.37Å; W11-F111 HydrophobicContact CB-CD1 4.38Å; W11-F111 HydrophobicContact CB-CG 4.26Å; W11-F111 HydrophobicContact CE3-CB 4.23Å; W11-F111 HydrophobicContact CE3-CD2 4.34Å; W15-F111 HydrophobicContact CB-CE2 4.3Å; W15-F111 HydrophobicContact CE3-CE2 4.01Å; L102-F111 HydrophobicContact CD1-CB 4.19Å; L102-F111 HydrophobicContact CD1-CD1 3.38Å; L102-F111 HydrophobicContact CD1-CE1 4.14Å; L102-F111 HydrophobicContact CD1-CG 4.15Å; Y105-F111 AromaticContact CD2-CD1 3.79Å; Y105-F111 HydrophobicContact CD2-CD1 3.79Å; Y105-F111 HydrophobicContact CD2-CE1 4.08Å; Y105-F111 HydrophobicContact CE1-CE1 4.32Å; Y105-F111 AromaticContact CE2-CD1 3.75Å; Y105-F111 HydrophobicContact CE2-CD1 3.75Å; Y105-F111 AromaticContact CE2-CE1 3.54Å; Y105-F111 HydrophobicContact CE2-CE1 3.54Å; Y105-F111 HydrophobicContact CG-CD1 4.22Å; Y105-F111 AromaticContact CZ-CE1 3.65Å; N107-F111 PolarHBondContact O-N 3.18Å; S109-F111 VanDerWaalsContact C-N 3.29Å; S109-F111 PolarHBondContact O-N 3.01Å; F111-D113 VanDerWaalsContact C-N 3.33Å; F111-D113 PolarHBondContact O-N 3.1Å; F111-K114 PolarHBondContact O-N 2.84Å; F111-L115 HydrophobicContact CD1-CD1 4.18Å; F111-L115 HydrophobicContact CD2-CG 4.36Å; F111-L115 HydrophobicContact CE1-CD1 4.08Å; F111-L115 HydrophobicContact CE2-CD2 4.16Å; F111-L115 HydrophobicContact CE2-CG 4.24Å; F111-L115 HydrophobicContact CG-CD1 4.41Å; F111-L115 HydrophobicContact CZ-CD1 4.25Å; F111-L115 HydrophobicContact CZ-CD2 4.16Å; F111-L115 HydrophobicContact CZ-CG 4.38Å; F111-L115 VanDerWaalsContact O-CG 3.28Å; F111-L115 WeakPolarHBondContact O-CG 3.46Å; F111-L115 PolarHBondContact O-N 3.42Å
112A87.8Confident84.6Confident4 Ų455.6 Ų55.63%0.03332%0.315CS..Hα-helixtrans-55.2-47172.600000111.9L102 P108 S109 K114 L115 V116 L127 L129L102-A112 HydrophobicContact CD2-CB 3.82Å; P108-A112 VanDerWaalsContact O-CB 3.23Å; P108-A112 WeakPolarHBondContact O-CB 3.35Å; P108-A112 PolarHBondContact O-N 3.02Å; S109-A112 WeakPolarHBondContact O-CB 3.47Å; S109-A112 PolarHBondContact O-N 3.01Å; A112-K114 PolarHBondContact O-N 3.02Å; A112-L115 PolarHBondContact O-N 2.79Å; A112-V116 WeakPolarHBondContact O-CB 3.39Å; A112-V116 VanDerWaalsContact O-CG2 3.27Å; A112-V116 WeakPolarHBondContact O-CG2 3.5Å; A112-V116 PolarHBondContact O-N 3.15Å; A112-L127 HydrophobicContact CB-CD1 4.15Å; A112-L129 HydrophobicContact CB-CD1 4.45Å; A112-L129 HydrophobicContact CB-CD2 3.86Å
113D87.3Confident83.4Confident113 Ų11363.3 Ų63.360%0.60435%0.347SS*.Hα-helixtrans-61.9-43.4-179.3-71.2-23.7000111.9S109 V110 F111 L115 V116 S117S109-D113 PolarHBondContact O-N 3.09Å; V110-D113 PolarHBondContact O-N 3.42Å; F111-D113 VanDerWaalsContact C-N 3.33Å; F111-D113 PolarHBondContact O-N 3.1Å; D113-L115 PolarHBondContact O-N 3.27Å; D113-V116 PolarHBondContact O-N 3.35Å; D113-S117 WeakPolarHBondContact O-CB 3.5Å; D113-S117 PolarHBondContact O-N 3.19Å
114K88.4Confident82Confident50 Ų5065.4 Ų65.422%0.21736%0.357CS..Hα-helixtrans-57.8-46.3173.6-77.6179.8167.9-167.50111.2W11 D12 W15 V110 F111 A112 R118W11-K114 HydrophobicContact CZ3-CD 3.92Å; W11-K114 VanDerWaalsContact CZ3-NZ 3.27Å; D12-K114 IonicContact OD1-NZ 3.45Å; D12-K114 PolarHBondContact OD1-NZ 3.09Å; W15-K114 HydrophobicContact CD2-CB 4.25Å; W15-K114 HydrophobicContact CD2-CD 3.65Å; W15-K114 HydrophobicContact CD2-CG 4.37Å; W15-K114 HydrophobicContact CE3-CB 4.05Å; W15-K114 HydrophobicContact CE3-CD 4.24Å; W15-K114 HydrophobicContact CG-CD 3.79Å; W15-K114 HydrophobicContact CH2-CB 3.71Å; W15-K114 HydrophobicContact CH2-CG 4.36Å; W15-K114 HydrophobicContact CZ2-CB 3.95Å; W15-K114 HydrophobicContact CZ2-CD 4.15Å; W15-K114 HydrophobicContact CZ2-CG 4.07Å; W15-K114 HydrophobicContact CZ3-CB 3.79Å; V110-K114 PolarHBondContact O-N 2.82Å; F111-K114 PolarHBondContact O-N 2.84Å; A112-K114 PolarHBondContact O-N 3.02Å; K114-R118 VanDerWaalsContact O-CB 3.29Å; K114-R118 WeakPolarHBondContact O-CB 3.27Å; K114-R118 PolarHBondContact O-N 2.84Å
115L86.7Confident80.8Confident43 Ų4365.3 Ų65.323%0.22536%0.363CS..Hα-helixtrans-66.7-44.3178.7-64.9171.9000112.2L102 F111 A112 D113 S117 R118 F119L102-L115 HydrophobicContact CD1-CD1 4.29Å; F111-L115 HydrophobicContact CD1-CD1 4.18Å; F111-L115 HydrophobicContact CD2-CG 4.36Å; F111-L115 HydrophobicContact CE1-CD1 4.08Å; F111-L115 HydrophobicContact CE2-CD2 4.16Å; F111-L115 HydrophobicContact CE2-CG 4.24Å; F111-L115 HydrophobicContact CG-CD1 4.41Å; F111-L115 HydrophobicContact CZ-CD1 4.25Å; F111-L115 HydrophobicContact CZ-CD2 4.16Å; F111-L115 HydrophobicContact CZ-CG 4.38Å; F111-L115 VanDerWaalsContact O-CG 3.28Å; F111-L115 WeakPolarHBondContact O-CG 3.46Å; F111-L115 PolarHBondContact O-N 3.42Å; A112-L115 PolarHBondContact O-N 2.79Å; D113-L115 PolarHBondContact O-N 3.27Å; L115-S117 VanDerWaalsContact C-N 3.33Å; L115-S117 PolarHBondContact O-N 3.16Å; L115-R118 PolarHBondContact O-N 3.11Å; L115-F119 HydrophobicContact CB-CD2 4.34Å; L115-F119 HydrophobicContact CD2-CD2 4.24Å; L115-F119 HydrophobicContact CD2-CE2 3.72Å; L115-F119 WeakPolarHBondContact O-CB 3.21Å; L115-F119 VanDerWaalsContact O-CD2 3.28Å; L115-F119 WeakPolarHBondContact O-CD2 3.49Å; L115-F119 PolarHBondContact O-N 2.95Å
116V85.6Confident79.9Confident27 Ų2774.3 Ų74.316%0.16440%0.403CS..Hα-helixtrans-59.8-45.3179.1168.30000110.9A112 D113 N120 L121 A125 L127A112-V116 WeakPolarHBondContact O-CB 3.39Å; A112-V116 VanDerWaalsContact O-CG2 3.27Å; A112-V116 WeakPolarHBondContact O-CG2 3.5Å; A112-V116 PolarHBondContact O-N 3.15Å; D113-V116 PolarHBondContact O-N 3.35Å; V116-N120 WeakPolarHBondContact O-CA 3.23Å; V116-N120 PolarHBondContact O-N 2.85Å; V116-N120 VanDerWaalsContact O-N 3.09Å; V116-L121 HydrophobicContact CB-CB 4.4Å; V116-L121 HydrophobicContact CG1-CB 4.34Å; V116-L121 HydrophobicContact CG2-CB 4.2Å; V116-L121 PolarHBondContact O-N 3.27Å; V116-A125 HydrophobicContact CG2-CB 4.24Å; V116-L127 HydrophobicContact CG2-CD1 3.95Å
117S85.4Confident79.3Confident94 Ų9476.3 Ų76.366%0.65741%0.409SS*.Hα-helixtrans-60.8-49.8175.1-179.10000111.3D113 L115 F119D113-S117 WeakPolarHBondContact O-CB 3.5Å; D113-S117 PolarHBondContact O-N 3.19Å; L115-S117 VanDerWaalsContact C-N 3.33Å; L115-S117 PolarHBondContact O-N 3.16Å; S117-F119 PolarHBondContact O-N 3.36Å
118R84.4Confident78.9Confident65 Ų6578.3 Ų78.325%0.24542%0.42CS..Hα-helixtrans-65.5-38.8-174.5178.960.7-17490.30.7114.1W15 H18 K114 L115W15-R118 HydrophobicContact CH2-CB 4.06Å; W15-R118 HydrophobicContact CH2-CG 4.45Å; W15-R118 HydrophobicContact CZ3-CB 4.43Å; H18-R118 PolarHBondContact NE2-NE 3.32Å; K114-R118 VanDerWaalsContact O-CB 3.29Å; K114-R118 WeakPolarHBondContact O-CB 3.27Å; K114-R118 PolarHBondContact O-N 2.84Å; L115-R118 PolarHBondContact O-N 3.11Å
119F80.4Confident78.5Confident82 Ų8278.9 Ų78.936%0.3642%0.421SS..Hα-helixtrans-102.65.7-173.8-64.1-67.9000113.3L115 S117 L121L115-F119 HydrophobicContact CB-CD2 4.34Å; L115-F119 HydrophobicContact CD2-CD2 4.24Å; L115-F119 HydrophobicContact CD2-CE2 3.72Å; L115-F119 WeakPolarHBondContact O-CB 3.21Å; L115-F119 VanDerWaalsContact O-CD2 3.28Å; L115-F119 WeakPolarHBondContact O-CD2 3.49Å; L115-F119 PolarHBondContact O-N 2.95Å; S117-F119 PolarHBondContact O-N 3.36Å; F119-L121 VanDerWaalsContact C-N 3.3Å; F119-L121 HydrophobicContact CB-CD1 4.07Å; F119-L121 HydrophobicContact CB-CD2 3.96Å; F119-L121 HydrophobicContact CB-CG 3.73Å; F119-L121 PolarHBondContact O-N 3.27Å
120N77.6Confident77.9Confident133 Ų13386.6 Ų86.671%0.71144%0.441SS*.THydrogen-bonded Turntrans54.243.9-176.9-62.9-60.9000112.8V116 S122V116-N120 WeakPolarHBondContact O-CA 3.23Å; V116-N120 PolarHBondContact O-N 2.85Å; V116-N120 VanDerWaalsContact O-N 3.09Å; N120-S122 PolarHBondContact O-N 2.88Å
121L75.8Confident77.2Confident56 Ų5685.9 Ų85.929%0.29344%0.437SS..G310 helixtrans-83.37.8-178-52.5173.9000112.9V116 F119 K123 V124 A125V116-L121 HydrophobicContact CB-CB 4.4Å; V116-L121 HydrophobicContact CG1-CB 4.34Å; V116-L121 HydrophobicContact CG2-CB 4.2Å; V116-L121 PolarHBondContact O-N 3.27Å; F119-L121 VanDerWaalsContact C-N 3.3Å; F119-L121 HydrophobicContact CB-CD1 4.07Å; F119-L121 HydrophobicContact CB-CD2 3.96Å; F119-L121 HydrophobicContact CB-CG 3.73Å; F119-L121 PolarHBondContact O-N 3.27Å; L121-K123 PolarHBondContact O-N 2.85Å; L121-V124 WeakPolarHBondContact O-CA 3.43Å; L121-V124 PolarHBondContact O-N 3.07Å; L121-A125 PolarHBondContact O-N 3Å
122S67.3Low76.3Confident93 Ų9390 Ų9065%0.6546%0.46SS*.G310 helixtrans-58.5-23.7-174.855.20000114N120 V124N120-S122 PolarHBondContact O-N 2.88Å; S122-V124 VanDerWaalsContact C-N 3.31Å
123K59Low75.2Confident202 Ų20298 Ų9888%0.87850%0.496SS*.G310 helixtrans-79.7-9.1174.7-65.2-177.9179.3179.30114L121L121-K123 PolarHBondContact O-N 2.85Å
124V58.3Low74.2Confident71 Ų7197 Ų9743%0.4349%0.486SS..THydrogen-bonded Turntrans-121.1-13.7-167.8-175.30000112.5L69 L121 S122 K126L69-V124 HydrophobicContact CD1-CG1 3.66Å; L69-V124 HydrophobicContact CD2-CG1 3.65Å; L69-V124 HydrophobicContact CG-CG1 4.18Å; L121-V124 WeakPolarHBondContact O-CA 3.43Å; L121-V124 PolarHBondContact O-N 3.07Å; S122-V124 VanDerWaalsContact C-N 3.31Å; V124-K126 PolarHBondContact O-N 3.5Å
125A59.9Low73.1Confident50 Ų50101.5 Ų101.541%0.41351%0.508SS..  trans-80.880.2-163.700000114.5V116 L121V116-A125 HydrophobicContact CG2-CB 4.24Å; L121-A125 PolarHBondContact O-N 3Å
126K69.3Low72Confident208 Ų208103 Ų10390%0.90452%0.519SS*.  trans-108.979.3137.6-82.8-172.8177.8-1790106.9V124V124-K126 PolarHBondContact O-N 3.5Å
127L75.5Confident71Confident91 Ų91110.2 Ų110.248%0.47655%0.545SS..  trans-79.4121.8176.4-65.1173.1000108.5A112 V116 L129A112-L127 HydrophobicContact CB-CD1 4.15Å; V116-L127 HydrophobicContact CG2-CD1 3.95Å; L127-L129 HydrophobicContact CB-CD2 4.07Å
128D77.1Confident69.9Low105 Ų105115.8 Ų115.856%0.56155%0.551SS**  trans-82.1114.6163.3-171.5-10.2000108.5R130D128-R130 VanDerWaalsContact C-N 3.3Å; D128-R130 WeakPolarHBondContact OD1-CB 3.45Å; D128-R130 PolarHBondContact OD1-N 2.91Å
129L79.1Confident68.4Low38 Ų38120 Ų12020%0.19958%0.579CS.*SBendtrans-89.53.5-177.1-58178.3000113L102 A103 P108 S109 A112 L127L102-L129 HydrophobicContact CD2-CD2 3.53Å; L102-L129 HydrophobicContact CG-CD2 4.19Å; A103-L129 WeakPolarHBondContact CA-O 3.42Å; A103-L129 WeakPolarHBondContact CB-O 3.43Å; P108-L129 HydrophobicContact CB-CB 4.24Å; P108-L129 HydrophobicContact CG-CB 4.35Å; S109-L129 WeakPolarHBondContact OG-CD1 3.27Å; A112-L129 HydrophobicContact CB-CD1 4.45Å; A112-L129 HydrophobicContact CB-CD2 3.86Å; L127-L129 HydrophobicContact CB-CD2 4.07Å
130R74.6Confident67.2Low222 Ų222121 Ų12184%0.83860%0.596SS**SBendtrans-107.3-9.8-177.8-59179.9-179.7-176.40112.8D128 L132D128-R130 VanDerWaalsContact C-N 3.3Å; D128-R130 WeakPolarHBondContact OD1-CB 3.45Å; D128-R130 PolarHBondContact OD1-N 2.91Å; R130-L132 PolarHBondContact O-N 2.94Å
131T73Confident65.8Low39 Ų39117.1 Ų117.124%0.23959%0.587CS.*  trans-68.7124.2-178-1730000110.9A103 E133A103-T131 WeakPolarHBondContact CB-O 3.26Å; T131-E133 VanDerWaalsContact OG1-CB 3.27Å; T131-E133 WeakPolarHBondContact OG1-CB 3.44Å; T131-E133 VanDerWaalsContact OG1-CG 3.23Å; T131-E133 WeakPolarHBondContact OG1-CG 3.34Å; T131-E133 PolarHBondContact OG1-N 2.68Å; T131-E133 PolarHBondContact OG1-OE2 3.06Å
132L70Confident64.2Low105 Ų105124 Ų12455%0.5562%0.615SS.*  trans-112.318.6165.6-63.8173000109.8P101 A103 L104 R130 F134P101-L132 HydrophobicContact CB-CD2 4.44Å; A103-L132 HydrophobicContact CB-CD2 3.78Å; A103-L132 HydrophobicContact CB-CG 4.4Å; L104-L132 HydrophobicContact CD2-CD2 3.8Å; L104-L132 HydrophobicContact CG-CD2 4.37Å; R130-L132 PolarHBondContact O-N 2.94Å; L132-F134 VanDerWaalsContact C-N 3.27Å; L132-F134 PolarHBondContact O-N 3.14Å
133E65.3Low63Low172 Ų172130.3 Ų130.380%0.80463%0.626SS**  trans-80.4-5.8-161-63.2173.3147.200113.8T131T131-E133 VanDerWaalsContact OG1-CB 3.27Å; T131-E133 WeakPolarHBondContact OG1-CB 3.44Å; T131-E133 VanDerWaalsContact OG1-CG 3.23Å; T131-E133 WeakPolarHBondContact OG1-CG 3.34Å; T131-E133 PolarHBondContact OG1-N 2.68Å; T131-E133 PolarHBondContact OG1-OE2 3.06Å
134F66.6Low62.1Low91 Ų91131.2 Ų131.240%0.39962%0.624SS.*  trans-99.9131.2-17964.9-94.7000111.7P101 L132 V136P101-F134 HydrophobicContact CB-CE1 3.63Å; P101-F134 HydrophobicContact CB-CE2 4.2Å; P101-F134 HydrophobicContact CB-CZ 3.38Å; P101-F134 HydrophobicContact CG-CE1 3.97Å; P101-F134 HydrophobicContact CG-CE2 3.66Å; P101-F134 HydrophobicContact CG-CZ 3.37Å; L132-F134 VanDerWaalsContact C-N 3.27Å; L132-F134 PolarHBondContact O-N 3.14Å; F134-V136 HydrophobicContact CD2-CG2 3.91Å; F134-V136 HydrophobicContact CE2-CG2 4.13Å
135Q65Low61.3Low144 Ų144133.5 Ų133.567%0.67364%0.643SS**  trans-105.1126.5170.6-67.8175.9-3.700107.9Y137Q135-Y137 HydrophobicContact CB-CD2 4.42Å; Q135-Y137 HydrophobicContact CB-CE2 3.74Å; Q135-Y137 PolarHBondContact OE1-OH 3.28Å
136V63.2Low60.2Low76 Ų76142.9 Ų142.946%0.46168%0.678SS.*  trans-95.6110.8177.8-177.10000108.5F99 F134F99-V136 HydrophobicContact CB-CG1 4.44Å; F99-V136 HydrophobicContact CB-CG2 3.92Å; F99-V136 HydrophobicContact CD2-CG1 3.98Å; F99-V136 HydrophobicContact CG-CG1 4.3Å; F99-V136 HydrophobicContact CG-CG2 4.35Å; F134-V136 HydrophobicContact CD2-CG2 3.91Å; F134-V136 HydrophobicContact CE2-CG2 4.13Å
137Y63.8Low59.7Low177 Ų177139.6 Ų139.669%0.69467%0.667SS**  trans-89.1119172.8-67-85.2000109.2Q135 N139Q135-Y137 HydrophobicContact CB-CD2 4.42Å; Q135-Y137 HydrophobicContact CB-CE2 3.74Å; Q135-Y137 PolarHBondContact OE1-OH 3.28Å; Y137-N139 PolarHBondContact O-N 3.32Å
138R62.8Low58.9Low211 Ų211142.2 Ų142.280%0.79668%0.677SS**  trans-78123.1172.4-73.4-178.1176.6146.9-1.7108.7S140R138-S140 VanDerWaalsContact C-N 3.3Å; R138-S140 PolarHBondContact O-N 3.23Å
139N54.1Low57.9Low154 Ų154144.2 Ų144.282%0.82468%0.683SS**  trans-73.892.5160.8-162.9-7.8000107.5Y137 G141Y137-N139 PolarHBondContact O-N 3.32Å; N139-G141 PolarHBondContact O-N 2.9Å
140S53.7Low56.7Low104 Ų104150.5 Ų150.573%0.72771%0.712SS**  trans-69.882.7168.250.50000107.4R138 K142R138-S140 VanDerWaalsContact C-N 3.3Å; R138-S140 PolarHBondContact O-N 3.23Å; S140-K142 PolarHBondContact O-N 2.99Å
141G47.7Very low55.5Low51 Ų51146 Ų14653%0.52670%0.704SS.*  trans-52.9104.9177.400000109.2N139 Y143N139-G141 PolarHBondContact O-N 2.9Å; G141-Y143 VanDerWaalsContact C-N 3.29Å; G141-Y143 PolarHBondContact O-N 3.45Å
142K43.1Very low54.4Low200 Ų200153.1 Ų153.187%0.8774%0.735SS**  trans-65.2102.1155.5-75.1-175178.2-179.20104.7S140 R144S140-K142 PolarHBondContact O-N 2.99Å; K142-R144 VanDerWaalsContact C-N 3.27Å; K142-R144 PolarHBondContact O-N 3.37Å
143Y42.8Very low53.2Low225 Ų225156.6 Ų156.688%0.88275%0.748SS**  trans-54.4101.1161.4-72.2-86.1000106.4G141 S145G141-Y143 VanDerWaalsContact C-N 3.29Å; G141-Y143 PolarHBondContact O-N 3.45Å; Y143-S145 VanDerWaalsContact C-N 3.32Å; Y143-S145 PolarHBondContact O-N 2.97Å; Y143-S145 VanDerWaalsContact O-N 3.1Å
144R40.3Very low52.3Low222 Ų222155.4 Ų155.484%0.83874%0.744SS**  trans-71.199.1163.4-90.2-174.3178.7175.8-0105.2K142 Q146K142-R144 VanDerWaalsContact C-N 3.27Å; K142-R144 PolarHBondContact O-N 3.37Å; R144-Q146 PolarHBondContact O-N 3.32Å
145S40.6Very low51.1Low118 Ų118160.8 Ų160.883%0.82577%0.772SS**  trans-58.9111.3153.84.50000106.9Y143Y143-S145 VanDerWaalsContact C-N 3.32Å; Y143-S145 PolarHBondContact O-N 2.97Å; Y143-S145 VanDerWaalsContact O-N 3.1Å
146Q36.7Very low49.9Very low247 Ų247162.3 Ų162.3100%1.15478%0.782SS**  trans-93.40153.6-75.4-1687.600107.7R144R144-Q146 PolarHBondContact O-N 3.32Å

Retrieved 146 of 146 residues in 174 ms (Link to these results)