A0A096NXA6_PAPAN Loading...

TERF1 interacting nuclear factor 2

AlphaFold DB , UniProt , Accession A0A096NXA6, Species PAPAN (Papio anubis, Olive baboon), Gene TINF2, Length 450 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
1M34.2Very low61.2Low242 Ų24279.9 Ų79.9100%1.19255%0.547SS*.  0120.40-62.5-55.2-169.600107.7
2A43.8Very low63.7Low88 Ų8878.4 Ų78.473%0.72753%0.528SS*.PPolyproline II helixtrans-79.3146.3170.200000109.5
3T45.7Very low65.8Low128 Ų12872.8 Ų72.879%0.78549%0.489SS*.PPolyproline II helixtrans-62.1140.3166.416.60000109.6
4P49.6Very low67.5Low108 Ų10869.9 Ų69.970%0.70146%0.464SS*.PPolyproline II helixtrans-62.2131.7178.425.5-33.5000110G6P4-G6 PolarHBondContact O-N 3.43Å
5P51.9Low69.2Low53 Ų5367.5 Ų67.534%0.34445%0.452SS..THydrogen-bonded Turntrans-79.648.3-17133.7-37.6000113.2V173 W176P5-V173 HydrophobicContact CB-CG2 4.26Å; P5-W176 HydrophobicContact CG-CB 4.2Å; P5-W176 HydrophobicContact CG-CD2 3.75Å; P5-W176 HydrophobicContact CG-CE3 3.77Å; P5-W176 HydrophobicContact CG-CG 3.96Å; P5-W176 HydrophobicContact CG-CZ3 4.43Å
6G53.1Low70.8Confident58 Ų5863.3 Ų63.360%0.59842%0.424SS*.THydrogen-bonded Turntrans-106.7-10.2179.600000115.4P4 A11P4-G6 PolarHBondContact O-N 3.43Å; G6-A11 WeakPolarHBondContact O-CB 3.34Å
7A61.9Low72.1Confident105 Ų10559.8 Ų59.887%0.86840%0.401SS*.SBendtrans-121.468-172.100000112.1
8G77.1Confident73.4Confident29 Ų2959.5 Ų59.530%0.29940%0.404SS..SBendtrans-160.8178-179.800000114.4A10 A11 L12G8-A10 PolarHBondContact O-N 3.08Å; G8-A10 VanDerWaalsContact O-N 3.13Å; G8-A11 PolarHBondContact O-N 3.38Å; G8-L12 PolarHBondContact O-N 3.35Å
9P84.5Confident74.6Confident35 Ų3556.8 Ų56.823%0.22739%0.385CS..Hα-helixtrans-53.5-35.6-174.6-29.536.7000114.7L12 R13 L162 P163P9-L12 PolarHBondContact O-N 3.32Å; P9-R13 WeakPolarHBondContact O-CG 3.48Å; P9-R13 PolarHBondContact O-N 3.09Å; P9-L162 HydrophobicContact CB-CB 4.48Å; P9-L162 HydrophobicContact CB-CD1 4.35Å; P9-L162 HydrophobicContact CB-CD2 4.02Å; P9-L162 HydrophobicContact CG-CD2 4.31Å; P9-P163 HydrophobicContact CG-CG 4.15Å
10A84.5Confident75.7Confident5 Ų554.4 Ų54.44%0.04137%0.368CS..Hα-helixtrans-60.7-46.3176.400000112.7G8 L12 R13 F14 L170 V173G8-A10 PolarHBondContact O-N 3.08Å; G8-A10 VanDerWaalsContact O-N 3.13Å; A10-L12 PolarHBondContact O-N 2.8Å; A10-R13 WeakPolarHBondContact O-CB 3.31Å; A10-R13 PolarHBondContact O-N 3.41Å; A10-R13 VanDerWaalsContact O-N 3.17Å; A10-F14 HydrophobicContact CB-CE2 4.11Å; A10-F14 WeakPolarHBondContact O-CD2 3.15Å; A10-F14 WeakPolarHBondContact O-CG 3.33Å; A10-F14 PolarHBondContact O-N 3.37Å; A10-L170 HydrophobicContact CB-CD2 3.81Å; A10-V173 HydrophobicContact CB-CB 4.21Å; A10-V173 HydrophobicContact CB-CG2 3.83Å
11A86.6Confident76.7Confident28 Ų2855.6 Ų55.623%0.23137%0.368CS..Hα-helixtrans-64-40.7179.200000112.1G6 G8 R13 F14 A15G6-A11 WeakPolarHBondContact O-CB 3.34Å; G8-A11 PolarHBondContact O-N 3.38Å; A11-R13 VanDerWaalsContact C-N 3.32Å; A11-R13 PolarHBondContact O-N 2.86Å; A11-F14 PolarHBondContact O-N 2.82Å; A11-A15 PolarHBondContact O-N 3.37Å; A11-A15 VanDerWaalsContact O-N 3.11Å
12L91.1Very high79.7Confident62 Ų6245 Ų4533%0.32532%0.317SS..Hα-helixtrans-62.2-39.9173.7-67174.6000111.7G8 P9 A10 A15 A16 F37 L41 L162G8-L12 PolarHBondContact O-N 3.35Å; P9-L12 PolarHBondContact O-N 3.32Å; A10-L12 PolarHBondContact O-N 2.8Å; L12-A15 PolarHBondContact O-N 3.17Å; L12-A16 VanDerWaalsContact O-CB 3.32Å; L12-A16 WeakPolarHBondContact O-CB 3.4Å; L12-A16 PolarHBondContact O-N 3.22Å; L12-F37 HydrophobicContact CD2-CE2 4.44Å; L12-L41 HydrophobicContact CD2-CD2 4.07Å; L12-L162 HydrophobicContact CB-CD1 4.36Å; L12-L162 HydrophobicContact CD1-CD2 3.95Å
13R91.5Very high82.3Confident5 Ų540.8 Ų40.82%0.01928%0.282CS..Hα-helixtrans-65.8-40.4175.5-75.5171.3166.21340.5112.8P9 A10 A11 A16 A17 E159 L162 P163 W189 W198P9-R13 WeakPolarHBondContact O-CG 3.48Å; P9-R13 PolarHBondContact O-N 3.09Å; A10-R13 WeakPolarHBondContact O-CB 3.31Å; A10-R13 PolarHBondContact O-N 3.41Å; A10-R13 VanDerWaalsContact O-N 3.17Å; A11-R13 VanDerWaalsContact C-N 3.32Å; A11-R13 PolarHBondContact O-N 2.86Å; R13-A16 WeakPolarHBondContact O-CB 3.49Å; R13-A16 PolarHBondContact O-N 3.38Å; R13-A17 WeakPolarHBondContact O-CB 3.29Å; R13-A17 PolarHBondContact O-N 2.95Å; R13-E159 WeakPolarHBondContact CG-OE1 3.42Å; R13-E159 IonicContact CZ-OE1 2.7Å; R13-E159 IonicContact CZ-OE2 3.85Å; R13-E159 IonicContact NE-OE1 2.69Å; R13-E159 PolarHBondContact NE-OE1 3.36Å; R13-E159 IonicContact NE-OE2 3.24Å; R13-E159 PolarHBondContact NE-OE2 3.04Å; R13-E159 VanDerWaalsContact NE-OE2 3.13Å; R13-E159 IonicContact NH2-OE1 3.22Å; R13-E159 PolarHBondContact NH2-OE1 3.04Å; R13-E159 IonicContact NH2-OE2 3.15Å; R13-E159 PolarHBondContact NH2-OE2 3.37Å; R13-L162 HydrophobicContact CG-CD1 3.91Å; R13-P163 VanDerWaalsContact CZ-O 3.3Å; R13-P163 PolarHBondContact NH1-O 3.31Å; R13-P163 PolarHBondContact NH2-O 3.35Å; R13-W189 HydrophobicContact CB-CH2 3.71Å; R13-W189 HydrophobicContact CB-CZ3 4.01Å; R13-W198 HydrophobicContact CB-CH2 4.38Å; R13-W198 HydrophobicContact CG-CH2 4.31Å; R13-W198 HydrophobicContact CG-CZ2 4.08Å
14F89.4Confident84.6Confident32 Ų3238.1 Ų38.114%0.1426%0.258CS..Hα-helixtrans-64.5-41.7175.9-65-53.4000112.1A10 A11 A18 L170 V173 L174 W189A10-F14 HydrophobicContact CB-CE2 4.11Å; A10-F14 WeakPolarHBondContact O-CD2 3.15Å; A10-F14 WeakPolarHBondContact O-CG 3.33Å; A10-F14 PolarHBondContact O-N 3.37Å; A11-F14 PolarHBondContact O-N 2.82Å; F14-A18 WeakPolarHBondContact O-CB 3.4Å; F14-A18 PolarHBondContact O-N 3.17Å; F14-L170 HydrophobicContact CE2-CD2 4.4Å; F14-L170 HydrophobicContact CZ-CB 4.34Å; F14-L170 HydrophobicContact CZ-CD2 3.95Å; F14-V173 HydrophobicContact CD2-CG1 4.08Å; F14-V173 HydrophobicContact CE2-CB 4.02Å; F14-V173 HydrophobicContact CE2-CG1 3.68Å; F14-L174 HydrophobicContact CD1-CD1 4.33Å; F14-L174 HydrophobicContact CE1-CD1 3.4Å; F14-L174 VanDerWaalsContact CE1-CD1 3.4Å; F14-L174 HydrophobicContact CE1-CD2 4.33Å; F14-L174 HydrophobicContact CE1-CG 3.79Å; F14-L174 HydrophobicContact CE2-CD1 4.47Å; F14-L174 HydrophobicContact CE2-CG 4.03Å; F14-L174 HydrophobicContact CZ-CD1 3.5Å; F14-L174 HydrophobicContact CZ-CD2 4.37Å; F14-L174 HydrophobicContact CZ-CG 3.52Å; F14-W189 HydrophobicContact CD1-CD2 4.24Å; F14-W189 AromaticContact CD1-CE3 3.54Å; F14-W189 HydrophobicContact CD1-CE3 3.54Å; F14-W189 AromaticContact CD1-CH2 3.64Å; F14-W189 HydrophobicContact CD1-CH2 3.64Å; F14-W189 HydrophobicContact CD1-CZ2 4.34Å; F14-W189 AromaticContact CD1-CZ3 3.22Å; F14-W189 HydrophobicContact CD1-CZ3 3.22Å; F14-W189 AromaticContact CE1-CD2 3.93Å; F14-W189 HydrophobicContact CE1-CD2 3.93Å; F14-W189 AromaticContact CE1-CE2 3.92Å; F14-W189 AromaticContact CE1-CE3 3.68Å; F14-W189 HydrophobicContact CE1-CE3 3.68Å; F14-W189 AromaticContact CE1-CH2 3.35Å; F14-W189 HydrophobicContact CE1-CH2 3.35Å; F14-W189 AromaticContact CE1-CZ2 3.65Å; F14-W189 HydrophobicContact CE1-CZ2 3.65Å; F14-W189 AromaticContact CE1-CZ3 3.4Å; F14-W189 HydrophobicContact CE1-CZ3 3.4Å; F14-W189 VanDerWaalsContact CE1-CZ3 3.4Å; F14-W189 HydrophobicContact CG-CH2 4.47Å; F14-W189 HydrophobicContact CG-CZ3 4.12Å; F14-W189 HydrophobicContact CZ-CH2 4.02Å; F14-W189 HydrophobicContact CZ-CZ2 4.23Å; F14-W189 HydrophobicContact CZ-CZ3 4.43Å
15A92.9Very high86.8Confident34 Ų3434.8 Ų34.828%0.28124%0.243SC..Hα-helixtrans-65.7-36.9173.600000112.7A11 L12 S19 F37A11-A15 PolarHBondContact O-N 3.37Å; A11-A15 VanDerWaalsContact O-N 3.11Å; L12-A15 PolarHBondContact O-N 3.17Å; A15-S19 VanDerWaalsContact O-CB 3.27Å; A15-S19 WeakPolarHBondContact O-CB 3.38Å; A15-S19 PolarHBondContact O-N 2.66Å; A15-S19 PolarHBondContact O-OG 3.16Å; A15-F37 HydrophobicContact CB-CD2 3.51Å; A15-F37 HydrophobicContact CB-CE2 3.48Å; A15-F37 VanDerWaalsContact CB-CE2 3.48Å; A15-F37 HydrophobicContact CB-CG 4.19Å; A15-F37 HydrophobicContact CB-CZ 4.14Å
16A95Very high89Confident0 Ų035 Ų350%024%0.237CC..Hα-helixtrans-64-50.7173.600000112.3L12 R13 A18 S19 W20 F37 L155 L158 Y192L12-A16 VanDerWaalsContact O-CB 3.32Å; L12-A16 WeakPolarHBondContact O-CB 3.4Å; L12-A16 PolarHBondContact O-N 3.22Å; R13-A16 WeakPolarHBondContact O-CB 3.49Å; R13-A16 PolarHBondContact O-N 3.38Å; A16-A18 PolarHBondContact O-N 3.43Å; A16-S19 PolarHBondContact O-N 3.39Å; A16-W20 VanDerWaalsContact O-CB 3.24Å; A16-W20 WeakPolarHBondContact O-CB 3.2Å; A16-W20 PolarHBondContact O-N 2.82Å; A16-F37 HydrophobicContact CB-CE1 4.2Å; A16-F37 HydrophobicContact CB-CZ 3.92Å; A16-L155 HydrophobicContact CB-CD1 4.39Å; A16-L155 HydrophobicContact CB-CD2 3.79Å; A16-L158 HydrophobicContact CB-CD2 4.03Å; A16-Y192 HydrophobicContact CB-CE1 4.17Å; A16-Y192 HydrophobicContact CB-CE2 4.16Å; A16-Y192 WeakPolarHBondContact CB-OH 3.09Å
17A93.4Very high91.1Very high4 Ų434 Ų343%0.03322%0.22CC..Hα-helixtrans-60.8-41.8179.100000112.4R13 W20 Q21 W189 Y192R13-A17 WeakPolarHBondContact O-CB 3.29Å; R13-A17 PolarHBondContact O-N 2.95Å; A17-W20 PolarHBondContact O-N 3.4Å; A17-Q21 WeakPolarHBondContact O-CB 3.5Å; A17-Q21 PolarHBondContact O-N 3.46Å; A17-W189 HydrophobicContact CB-CE3 3.63Å; A17-W189 HydrophobicContact CB-CZ3 3.93Å; A17-Y192 HydrophobicContact CB-CD1 3.61Å; A17-Y192 HydrophobicContact CB-CD2 4.44Å; A17-Y192 HydrophobicContact CB-CE1 4.36Å; A17-Y192 HydrophobicContact CB-CG 3.64Å
18A94Very high92.7Very high55 Ų5529.6 Ų29.646%0.45518%0.183SC..Hα-helixtrans-64.4-46.3174.500000111.7F14 A16 W20 Q21 V22F14-A18 WeakPolarHBondContact O-CB 3.4Å; F14-A18 PolarHBondContact O-N 3.17Å; A16-A18 PolarHBondContact O-N 3.43Å; A18-W20 VanDerWaalsContact C-N 3.31Å; A18-W20 PolarHBondContact O-N 2.95Å; A18-Q21 PolarHBondContact O-N 3.22Å; A18-V22 WeakPolarHBondContact O-CB 3.28Å; A18-V22 WeakPolarHBondContact O-CG2 3.43Å; A18-V22 PolarHBondContact O-N 3.13Å
19S97.3Very high93.6Very high8 Ų834.3 Ų34.36%0.05620%0.197CC..Hα-helixtrans-62.1-39.2177.6-62.10000112.5A15 A16 V22 V23 F37A15-S19 VanDerWaalsContact O-CB 3.27Å; A15-S19 WeakPolarHBondContact O-CB 3.38Å; A15-S19 PolarHBondContact O-N 2.66Å; A15-S19 PolarHBondContact O-OG 3.16Å; A16-S19 PolarHBondContact O-N 3.39Å; S19-V22 PolarHBondContact O-N 3.1Å; S19-V23 PolarHBondContact O-N 2.9Å; S19-V23 VanDerWaalsContact O-N 3.14Å; S19-F37 VanDerWaalsContact OG-CD1 3.31Å; S19-F37 WeakPolarHBondContact OG-CD1 3.27Å
20W97.2Very high94.3Very high8 Ų837.3 Ų37.33%0.0321%0.207CC..Hα-helixtrans-64.1-50.9177.1-174.9-128.6000111.2A16 A17 A18 V22 V23 R24 E148 L151 F152 L155 Y192 D195A16-W20 VanDerWaalsContact O-CB 3.24Å; A16-W20 WeakPolarHBondContact O-CB 3.2Å; A16-W20 PolarHBondContact O-N 2.82Å; A17-W20 PolarHBondContact O-N 3.4Å; A18-W20 VanDerWaalsContact C-N 3.31Å; A18-W20 PolarHBondContact O-N 2.95Å; W20-V22 VanDerWaalsContact C-N 3.27Å; W20-V22 PolarHBondContact O-N 3.27Å; W20-V23 PolarHBondContact O-N 3.29Å; W20-R24 HydrophobicContact CD2-CG 4.01Å; W20-R24 HydrophobicContact CE3-CG 4.25Å; W20-R24 HydrophobicContact CH2-CG 4.09Å; W20-R24 HydrophobicContact CZ2-CG 3.92Å; W20-R24 HydrophobicContact CZ3-CG 4.27Å; W20-R24 WeakPolarHBondContact O-CB 3.41Å; W20-R24 WeakPolarHBondContact O-CG 3.4Å; W20-R24 PolarHBondContact O-N 3.05Å; W20-E148 HydrophobicContact CH2-CG 3.71Å; W20-E148 HydrophobicContact CZ3-CG 3.75Å; W20-E148 WeakPolarHBondContact CZ3-O 3.23Å; W20-L151 HydrophobicContact CE3-CB 4.5Å; W20-L151 HydrophobicContact CE3-CD2 3.97Å; W20-L151 HydrophobicContact CE3-CG 4.07Å; W20-L151 HydrophobicContact CZ3-CB 4.47Å; W20-F152 HydrophobicContact CH2-CB 3.63Å; W20-F152 AromaticContact CH2-CD2 3.81Å; W20-F152 HydrophobicContact CH2-CD2 3.81Å; W20-F152 HydrophobicContact CH2-CG 4.13Å; W20-F152 HydrophobicContact CZ2-CB 4.42Å; W20-F152 AromaticContact CZ2-CD2 3.75Å; W20-F152 HydrophobicContact CZ2-CD2 3.75Å; W20-F152 HydrophobicContact CZ3-CB 3.78Å; W20-L155 HydrophobicContact CB-CD1 3.76Å; W20-L155 HydrophobicContact CD2-CD1 4.34Å; W20-L155 HydrophobicContact CE3-CD1 4.28Å; W20-L155 HydrophobicContact CG-CD1 4.17Å; W20-Y192 HydrophobicContact CB-CD2 4.14Å; W20-Y192 AromaticContact CD1-CD2 3.7Å; W20-Y192 HydrophobicContact CG-CD2 4.07Å; W20-D195 PolarHBondContact NE1-OD2 3.06Å
21Q95.9Very high94.9Very high80 Ų8037 Ų3737%0.37421%0.205SC..Hα-helixtrans-57.9-39175.4-178.361.847.100112.5A17 A18 G25 A188A17-Q21 WeakPolarHBondContact O-CB 3.5Å; A17-Q21 PolarHBondContact O-N 3.46Å; A18-Q21 PolarHBondContact O-N 3.22Å; Q21-G25 PolarHBondContact O-N 2.98Å; Q21-A188 HydrophobicContact CB-CB 3.88Å; Q21-A188 HydrophobicContact CG-CB 3.77Å
22V97.4Very high95.4Very high19 Ų1938.1 Ų38.112%0.11521%0.21CC..Hα-helixtrans-62.1-45.3177.5158.80000112.1A18 S19 W20 R26 C27 H30 F31 V34A18-V22 WeakPolarHBondContact O-CB 3.28Å; A18-V22 WeakPolarHBondContact O-CG2 3.43Å; A18-V22 PolarHBondContact O-N 3.13Å; S19-V22 PolarHBondContact O-N 3.1Å; W20-V22 VanDerWaalsContact C-N 3.27Å; W20-V22 PolarHBondContact O-N 3.27Å; V22-R26 PolarHBondContact O-N 2.98Å; V22-C27 HydrophobicContact CG1-CB 4.19Å; V22-C27 HydrophobicContact CG2-CB 4.5Å; V22-C27 PolarHBondContact O-N 3.13Å; V22-H30 HydrophobicContact CB-CB 4.32Å; V22-H30 HydrophobicContact CG1-CB 3.68Å; V22-H30 HydrophobicContact CG2-CB 3.61Å; V22-F31 HydrophobicContact CG1-CD1 3.7Å; V22-F31 HydrophobicContact CG1-CE1 4.05Å; V22-V34 HydrophobicContact CB-CG2 4.2Å; V22-V34 HydrophobicContact CG1-CG2 3.65Å
23V97.5Very high95.7Very high0 Ų043.1 Ų43.10%023%0.225CC..Hα-helixtrans-76.7-39-179.6175.60000112S19 W20 G25 R26 F31 V34 L61 M147 E148 L151S19-V23 PolarHBondContact O-N 2.9Å; S19-V23 VanDerWaalsContact O-N 3.14Å; W20-V23 PolarHBondContact O-N 3.29Å; V23-G25 VanDerWaalsContact C-N 3.32Å; V23-G25 PolarHBondContact O-N 3.33Å; V23-R26 PolarHBondContact O-N 3.14Å; V23-R26 PolarHBondContact O-NH1 3.08Å; V23-F31 HydrophobicContact CG2-CE1 4.21Å; V23-V34 HydrophobicContact CG2-CG2 4.42Å; V23-L61 HydrophobicContact CG2-CD2 4.04Å; V23-M147 HydrophobicContact CG1-CE 4.2Å; V23-E148 HydrophobicContact CG1-CB 4.02Å; V23-L151 HydrophobicContact CB-CD2 3.79Å; V23-L151 HydrophobicContact CG1-CD2 4.37Å; V23-L151 HydrophobicContact CG2-CD2 3.61Å
24R95.1Very high96Very high72 Ų7242.9 Ų42.927%0.27222%0.224SC..Hα-helixtrans-60.2-41.3171.4-67.4-161.977169.3-3.4111.9W20 R26 E148 D195W20-R24 HydrophobicContact CD2-CG 4.01Å; W20-R24 HydrophobicContact CE3-CG 4.25Å; W20-R24 HydrophobicContact CH2-CG 4.09Å; W20-R24 HydrophobicContact CZ2-CG 3.92Å; W20-R24 HydrophobicContact CZ3-CG 4.27Å; W20-R24 WeakPolarHBondContact O-CB 3.41Å; W20-R24 WeakPolarHBondContact O-CG 3.4Å; W20-R24 PolarHBondContact O-N 3.05Å; R24-R26 VanDerWaalsContact C-N 3.29Å; R24-R26 PolarHBondContact O-N 2.98Å; R24-E148 HydrophobicContact CG-CG 4.43Å; R24-E148 IonicContact NE-OE1 3.56Å; R24-D195 IonicContact CZ-OD2 3.93Å; R24-D195 VanDerWaalsContact NH1-CG 3.29Å; R24-D195 IonicContact NH1-OD1 3.96Å; R24-D195 PolarHBondContact NH1-OD1 3.19Å; R24-D195 VanDerWaalsContact NH1-OD1 3.15Å; R24-D195 IonicContact NH1-OD2 2.77Å; R24-D195 PolarHBondContact NH1-OD2 2.84Å
25G95.9Very high96.4Very high38 Ų3841.9 Ų41.939%0.39222%0.22SC..THydrogen-bonded Turntrans-79-1.9179.800000115.6Q21 V23 C27Q21-G25 PolarHBondContact O-N 2.98Å; V23-G25 VanDerWaalsContact C-N 3.32Å; V23-G25 PolarHBondContact O-N 3.33Å; G25-C27 PolarHBondContact O-N 2.97Å
26R97.1Very high96.6Very high59 Ų5944 Ų4422%0.22322%0.224CC..THydrogen-bonded Turntrans57.327.5-174.7-49.7-55.6-172.1-124.5-0.5114.3V22 V23 R24 V28 E141 E148V22-R26 PolarHBondContact O-N 2.98Å; V23-R26 PolarHBondContact O-N 3.14Å; V23-R26 PolarHBondContact O-NH1 3.08Å; R24-R26 VanDerWaalsContact C-N 3.29Å; R24-R26 PolarHBondContact O-N 2.98Å; R26-V28 VanDerWaalsContact C-N 3.3Å; R26-V28 PolarHBondContact O-N 3.34Å; R26-E141 IonicContact CZ-OE2 3.4Å; R26-E141 IonicContact NE-OE1 3.09Å; R26-E141 PolarHBondContact NE-OE1 2.6Å; R26-E141 VanDerWaalsContact NE-OE1 3.09Å; R26-E141 IonicContact NE-OE2 3.07Å; R26-E141 PolarHBondContact NE-OE2 2.73Å; R26-E141 VanDerWaalsContact NE-OE2 3.07Å; R26-E141 IonicContact NH2-OE2 3.14Å; R26-E141 PolarHBondContact NH2-OE2 3.22Å; R26-E148 IonicContact CZ-OE2 3.13Å; R26-E148 IonicContact NH1-OE2 2.71Å; R26-E148 PolarHBondContact NH1-OE2 2.82Å; R26-E148 IonicContact NH2-OE2 2.76Å; R26-E148 PolarHBondContact NH2-OE2 3Å; R26-E148 VanDerWaalsContact NH2-OE2 3.09Å
27C96.8Very high96.7Very high36 Ų3645 Ų4524%0.24323%0.228CC..  trans-74.373.3-178.8-62.50000111.9V22 G25 E29 H30 F31V22-C27 HydrophobicContact CG1-CB 4.19Å; V22-C27 HydrophobicContact CG2-CB 4.5Å; V22-C27 PolarHBondContact O-N 3.13Å; G25-C27 PolarHBondContact O-N 2.97Å; C27-E29 WeakPolarHBondContact CA-OE2 3.44Å; C27-E29 VanDerWaalsContact CB-OE1 3.27Å; C27-E29 WeakPolarHBondContact CB-OE1 2.99Å; C27-E29 PolarHBondContact O-N 3.32Å; C27-H30 HydrophobicContact CB-CB 4.42Å; C27-H30 PolarHBondContact O-N 3.3Å; C27-F31 VanDerWaalsContact O-CD1 3.24Å; C27-F31 WeakPolarHBondContact O-CD1 3.5Å; C27-F31 WeakPolarHBondContact O-CE1 3.32Å; C27-F31 PolarHBondContact O-N 3.24Å
28V97.2Very high96.9Very high13 Ų1344.8 Ų44.88%0.07923%0.227CC..G310 helixtrans-57-32.8-176.2-172.80000112.1R26 H30 F31 K64 V65 E68R26-V28 VanDerWaalsContact C-N 3.3Å; R26-V28 PolarHBondContact O-N 3.34Å; V28-H30 PolarHBondContact O-N 2.98Å; V28-F31 HydrophobicContact CB-CD2 4.32Å; V28-F31 HydrophobicContact CB-CE2 4.25Å; V28-F31 HydrophobicContact CB-CZ 4.47Å; V28-F31 HydrophobicContact CG1-CD2 3.92Å; V28-F31 HydrophobicContact CG1-CE2 4.15Å; V28-F31 HydrophobicContact CG1-CG 4.42Å; V28-F31 HydrophobicContact CG2-CD2 4.47Å; V28-F31 HydrophobicContact CG2-CE2 3.92Å; V28-F31 HydrophobicContact CG2-CZ 4Å; V28-F31 WeakPolarHBondContact O-CB 3.35Å; V28-F31 PolarHBondContact O-N 3.43Å; V28-F31 VanDerWaalsContact O-N 3.08Å; V28-K64 HydrophobicContact CG1-CG 4.14Å; V28-K64 HydrophobicContact CG2-CG 3.89Å; V28-V65 HydrophobicContact CG1-CB 4.46Å; V28-V65 HydrophobicContact CG1-CG2 3.9Å; V28-E68 HydrophobicContact CB-CB 4.46Å; V28-E68 HydrophobicContact CB-CG 4.09Å; V28-E68 HydrophobicContact CG1-CB 3.8Å; V28-E68 HydrophobicContact CG1-CG 3.93Å; V28-E68 HydrophobicContact CG2-CG 4.36Å
29E95.8Very high96.9Very high128 Ų12849.7 Ų49.760%0.59823%0.233SC*.G310 helixtrans-59.8-14.4173.972.4-73.7175.800114.3C27C27-E29 WeakPolarHBondContact CA-OE2 3.44Å; C27-E29 VanDerWaalsContact CB-OE1 3.27Å; C27-E29 WeakPolarHBondContact CB-OE1 2.99Å; C27-E29 PolarHBondContact O-N 3.32Å
30H97.6Very high96.8Very high97 Ų9752.8 Ų52.845%0.44926%0.255SS..G310 helixtrans-113.3-3.3177.1-66.2-15.2000113.7V22 C27 V28 P32 R33 V34V22-H30 HydrophobicContact CB-CB 4.32Å; V22-H30 HydrophobicContact CG1-CB 3.68Å; V22-H30 HydrophobicContact CG2-CB 3.61Å; C27-H30 HydrophobicContact CB-CB 4.42Å; C27-H30 PolarHBondContact O-N 3.3Å; V28-H30 PolarHBondContact O-N 2.98Å; H30-P32 VanDerWaalsContact C-N 3.3Å; H30-R33 WeakPolarHBondContact O-CB 3.46Å; H30-R33 PolarHBondContact O-N 3.42Å; H30-V34 PolarHBondContact O-N 3.14Å
31F98Very high96.6Very high0 Ų052.9 Ų52.90%026%0.256CS..Hα-helixtrans-56.3-33174.8-70.87.5000114V22 V23 C27 V28 R33 V34 L35 L61 K64 V65 M147V22-F31 HydrophobicContact CG1-CD1 3.7Å; V22-F31 HydrophobicContact CG1-CE1 4.05Å; V23-F31 HydrophobicContact CG2-CE1 4.21Å; C27-F31 VanDerWaalsContact O-CD1 3.24Å; C27-F31 WeakPolarHBondContact O-CD1 3.5Å; C27-F31 WeakPolarHBondContact O-CE1 3.32Å; C27-F31 PolarHBondContact O-N 3.24Å; V28-F31 HydrophobicContact CB-CD2 4.32Å; V28-F31 HydrophobicContact CB-CE2 4.25Å; V28-F31 HydrophobicContact CB-CZ 4.47Å; V28-F31 HydrophobicContact CG1-CD2 3.92Å; V28-F31 HydrophobicContact CG1-CE2 4.15Å; V28-F31 HydrophobicContact CG1-CG 4.42Å; V28-F31 HydrophobicContact CG2-CD2 4.47Å; V28-F31 HydrophobicContact CG2-CE2 3.92Å; V28-F31 HydrophobicContact CG2-CZ 4Å; V28-F31 WeakPolarHBondContact O-CB 3.35Å; V28-F31 PolarHBondContact O-N 3.43Å; V28-F31 VanDerWaalsContact O-N 3.08Å; F31-R33 VanDerWaalsContact C-N 3.25Å; F31-R33 PolarHBondContact O-N 3.37Å; F31-V34 WeakPolarHBondContact O-CB 3.43Å; F31-V34 PolarHBondContact O-N 3.08Å; F31-V34 VanDerWaalsContact O-N 3.12Å; F31-L35 PolarHBondContact O-N 3.19Å; F31-L61 HydrophobicContact CB-CD2 4.02Å; F31-L61 HydrophobicContact CD1-CD2 4Å; F31-L61 HydrophobicContact CD2-CB 4.45Å; F31-L61 HydrophobicContact CD2-CD2 3.61Å; F31-L61 HydrophobicContact CE1-CD2 4.4Å; F31-L61 HydrophobicContact CE2-CD2 4.03Å; F31-L61 HydrophobicContact CG-CD2 3.6Å; F31-L61 HydrophobicContact CZ-CD2 4.41Å; F31-K64 HydrophobicContact CD2-CB 4.34Å; F31-K64 HydrophobicContact CE2-CB 3.99Å; F31-K64 HydrophobicContact CE2-CG 3.87Å; F31-V65 HydrophobicContact CB-CG2 3.76Å; F31-V65 HydrophobicContact CD2-CG2 4.26Å; F31-V65 HydrophobicContact CG-CG2 4.47Å; F31-M147 HydrophobicContact CD2-CE 4.44Å; F31-M147 HydrophobicContact CE2-CE 3.54Å; F31-M147 HydrophobicContact CZ-CE 3.64Å
32P97.2Very high96.5Very high51 Ų5150.2 Ų50.233%0.33124%0.243SC..Hα-helixtrans-57.5-33.6171.6-28.737.6000114.2H30 L35 E36H30-P32 VanDerWaalsContact C-N 3.3Å; P32-L35 PolarHBondContact O-N 3.11Å; P32-E36 WeakPolarHBondContact O-CG 3.32Å; P32-E36 PolarHBondContact O-N 3.18Å
33R97.4Very high96.2Very high166 Ų16653.3 Ų53.363%0.62627%0.27SS*.Hα-helixtrans-72.8-35.1175.4-62-53.7-167.7-173.50.5112.2H30 F31 L35 E36 F37H30-R33 WeakPolarHBondContact O-CB 3.46Å; H30-R33 PolarHBondContact O-N 3.42Å; F31-R33 VanDerWaalsContact C-N 3.25Å; F31-R33 PolarHBondContact O-N 3.37Å; R33-L35 VanDerWaalsContact C-N 3.32Å; R33-E36 WeakPolarHBondContact CD-OE2 3.44Å; R33-E36 IonicContact CZ-OE2 3.63Å; R33-E36 IonicContact NE-OE2 3.73Å; R33-E36 VanDerWaalsContact NH1-CD 3.3Å; R33-E36 IonicContact NH1-OE1 3.08Å; R33-E36 PolarHBondContact NH1-OE1 2.92Å; R33-E36 VanDerWaalsContact NH1-OE1 3.08Å; R33-E36 IonicContact NH1-OE2 2.73Å; R33-E36 PolarHBondContact NH1-OE2 3.5Å; R33-E36 PolarHBondContact O-N 3.36Å; R33-F37 PolarHBondContact O-N 3.21Å
34V98.3Very high95.9Very high1 Ų159.6 Ų59.61%0.00631%0.308CS..Hα-helixtrans-62.7-41.4171.3-174.10000110.4V22 V23 H30 F31 F37 L38 L61V22-V34 HydrophobicContact CB-CG2 4.2Å; V22-V34 HydrophobicContact CG1-CG2 3.65Å; V23-V34 HydrophobicContact CG2-CG2 4.42Å; H30-V34 PolarHBondContact O-N 3.14Å; F31-V34 WeakPolarHBondContact O-CB 3.43Å; F31-V34 PolarHBondContact O-N 3.08Å; F31-V34 VanDerWaalsContact O-N 3.12Å; V34-F37 PolarHBondContact O-N 3.07Å; V34-L38 HydrophobicContact CG1-CD1 3.92Å; V34-L38 HydrophobicContact CG1-CG 4.28Å; V34-L38 WeakPolarHBondContact O-CB 3.16Å; V34-L38 VanDerWaalsContact O-CG 3.27Å; V34-L38 WeakPolarHBondContact O-CG 3.37Å; V34-L38 PolarHBondContact O-N 2.91Å; V34-L61 HydrophobicContact CB-CD1 4.2Å; V34-L61 HydrophobicContact CG1-CD1 3.69Å; V34-L61 HydrophobicContact CG1-CD2 4.48Å
35L97.8Very high95.7Very high10 Ų1057.8 Ų57.85%0.05231%0.309CS..Hα-helixtrans-64.4-37.7175.6-73.4170000113.1F31 P32 R33 R39 C58 L61 K62F31-L35 PolarHBondContact O-N 3.19Å; P32-L35 PolarHBondContact O-N 3.11Å; R33-L35 VanDerWaalsContact C-N 3.32Å; L35-R39 WeakPolarHBondContact O-CB 3.42Å; L35-R39 PolarHBondContact O-N 3.19Å; L35-C58 HydrophobicContact CD2-CB 3.86Å; L35-C58 WeakPolarHBondContact CD2-O 3.42Å; L35-L61 HydrophobicContact CD1-CB 4.28Å; L35-L61 HydrophobicContact CD2-CB 3.91Å; L35-L61 HydrophobicContact CD2-CD1 4.01Å; L35-L61 HydrophobicContact CG-CB 4.03Å; L35-L61 HydrophobicContact CG-CD1 4.24Å; L35-K62 HydrophobicContact CD1-CG 3.87Å; L35-K62 HydrophobicContact CD2-CG 4.33Å
36E97Very high95.4Very high79 Ų7958.3 Ų58.337%0.36931%0.305SS..Hα-helixtrans-64.8-44.5173.1-72.5168.3170.400112.1P32 R33 S40P32-E36 WeakPolarHBondContact O-CG 3.32Å; P32-E36 PolarHBondContact O-N 3.18Å; R33-E36 WeakPolarHBondContact CD-OE2 3.44Å; R33-E36 IonicContact CZ-OE2 3.63Å; R33-E36 IonicContact NE-OE2 3.73Å; R33-E36 VanDerWaalsContact NH1-CD 3.3Å; R33-E36 IonicContact NH1-OE1 3.08Å; R33-E36 PolarHBondContact NH1-OE1 2.92Å; R33-E36 VanDerWaalsContact NH1-OE1 3.08Å; R33-E36 IonicContact NH1-OE2 2.73Å; R33-E36 PolarHBondContact NH1-OE2 3.5Å; R33-E36 PolarHBondContact O-N 3.36Å; E36-S40 WeakPolarHBondContact O-CB 3.39Å; E36-S40 PolarHBondContact O-N 3.41Å; E36-S40 PolarHBondContact O-OG 2.83Å
37F97.1Very high95Very high20 Ų2057.8 Ų57.89%0.08832%0.318CS..Hα-helixtrans-62-50.3175.9173.2-120.8000112.1L12 A15 A16 S19 R33 V34 R39 S40 L41 L155 L158L12-F37 HydrophobicContact CD2-CE2 4.44Å; A15-F37 HydrophobicContact CB-CD2 3.51Å; A15-F37 HydrophobicContact CB-CE2 3.48Å; A15-F37 VanDerWaalsContact CB-CE2 3.48Å; A15-F37 HydrophobicContact CB-CG 4.19Å; A15-F37 HydrophobicContact CB-CZ 4.14Å; A16-F37 HydrophobicContact CB-CE1 4.2Å; A16-F37 HydrophobicContact CB-CZ 3.92Å; S19-F37 VanDerWaalsContact OG-CD1 3.31Å; S19-F37 WeakPolarHBondContact OG-CD1 3.27Å; R33-F37 PolarHBondContact O-N 3.21Å; V34-F37 PolarHBondContact O-N 3.07Å; F37-R39 PolarHBondContact O-N 2.87Å; F37-S40 WeakPolarHBondContact O-CB 2.99Å; F37-S40 PolarHBondContact O-N 2.83Å; F37-S40 VanDerWaalsContact O-N 3.16Å; F37-L41 HydrophobicContact CD1-CD1 4.37Å; F37-L41 HydrophobicContact CD2-CG 4.38Å; F37-L41 HydrophobicContact CE1-CD1 3.8Å; F37-L41 HydrophobicContact CE2-CD1 4Å; F37-L41 HydrophobicContact CE2-CD2 4.22Å; F37-L41 HydrophobicContact CE2-CG 4.02Å; F37-L41 HydrophobicContact CZ-CD1 3.62Å; F37-L41 HydrophobicContact CZ-CD2 4.47Å; F37-L41 HydrophobicContact CZ-CG 4.16Å; F37-L41 PolarHBondContact O-N 2.73Å; F37-L155 HydrophobicContact CE1-CD2 4.06Å; F37-L158 HydrophobicContact CZ-CD2 3.95Å
38L96.9Very high94.8Very high0 Ų057.3 Ų57.30%031%0.313CS..Hα-helixtrans-61.3-41.3178.4-69.8172.2000112V34 S40 L41 R42 H54 L57 L61 L151 Y154V34-L38 HydrophobicContact CG1-CD1 3.92Å; V34-L38 HydrophobicContact CG1-CG 4.28Å; V34-L38 WeakPolarHBondContact O-CB 3.16Å; V34-L38 VanDerWaalsContact O-CG 3.27Å; V34-L38 WeakPolarHBondContact O-CG 3.37Å; V34-L38 PolarHBondContact O-N 2.91Å; L38-S40 VanDerWaalsContact C-N 3.32Å; L38-S40 PolarHBondContact O-N 3.37Å; L38-L41 PolarHBondContact O-N 3.25Å; L38-R42 PolarHBondContact O-N 3.1Å; L38-H54 PolarHBondContact O-CE1 2.92Å; L38-L57 HydrophobicContact CD1-CD2 3.65Å; L38-L57 HydrophobicContact CD1-CG 3.8Å; L38-L57 HydrophobicContact CD2-CD2 4.01Å; L38-L61 HydrophobicContact CD1-CD1 3.68Å; L38-L151 HydrophobicContact CD2-CD1 4.31Å; L38-Y154 HydrophobicContact CD2-CD1 4.13Å; L38-Y154 HydrophobicContact CD2-CD2 3.92Å; L38-Y154 HydrophobicContact CD2-CE1 3.99Å; L38-Y154 HydrophobicContact CD2-CE2 3.76Å; L38-Y154 HydrophobicContact CD2-CG 4.11Å
39R94.8Very high94.5Very high158 Ų15857.4 Ų57.460%0.59631%0.313SS*.Hα-helixtrans-60.8-42174.8-172.5-170.8-53.7149.97.7111.6L35 F37 R42 A43L35-R39 WeakPolarHBondContact O-CB 3.42Å; L35-R39 PolarHBondContact O-N 3.19Å; F37-R39 PolarHBondContact O-N 2.87Å; R39-R42 PolarHBondContact O-N 3.39Å; R39-A43 PolarHBondContact O-N 3.1Å
40S94.4Very high94.3Very high73 Ų7358.4 Ų58.451%0.5131%0.312SS..Hα-helixtrans-64.8-42.5177.3-54.90000111.4E36 F37 L38 R42 A43 V44E36-S40 WeakPolarHBondContact O-CB 3.39Å; E36-S40 PolarHBondContact O-N 3.41Å; E36-S40 PolarHBondContact O-OG 2.83Å; F37-S40 WeakPolarHBondContact O-CB 2.99Å; F37-S40 PolarHBondContact O-N 2.83Å; F37-S40 VanDerWaalsContact O-N 3.16Å; L38-S40 VanDerWaalsContact C-N 3.32Å; L38-S40 PolarHBondContact O-N 3.37Å; S40-R42 PolarHBondContact O-N 2.93Å; S40-A43 PolarHBondContact O-N 2.93Å; S40-V44 PolarHBondContact O-N 3.4Å; S40-V44 VanDerWaalsContact O-N 3.16Å
41L94Very high94Very high10 Ų1054.5 Ų54.55%0.05229%0.293CS..Hα-helixtrans-61.9-39.5171.7-69.9-178000112.5L12 F37 L38 A45 L48 Y154 L158L12-L41 HydrophobicContact CD2-CD2 4.07Å; F37-L41 HydrophobicContact CD1-CD1 4.37Å; F37-L41 HydrophobicContact CD2-CG 4.38Å; F37-L41 HydrophobicContact CE1-CD1 3.8Å; F37-L41 HydrophobicContact CE2-CD1 4Å; F37-L41 HydrophobicContact CE2-CD2 4.22Å; F37-L41 HydrophobicContact CE2-CG 4.02Å; F37-L41 HydrophobicContact CZ-CD1 3.62Å; F37-L41 HydrophobicContact CZ-CD2 4.47Å; F37-L41 HydrophobicContact CZ-CG 4.16Å; F37-L41 PolarHBondContact O-N 2.73Å; L38-L41 PolarHBondContact O-N 3.25Å; L41-A45 CarbonylContact O-C 3.41Å; L41-A45 WeakPolarHBondContact O-CA 3.37Å; L41-A45 PolarHBondContact O-N 3.02Å; L41-L48 HydrophobicContact CD1-CD2 4.47Å; L41-Y154 HydrophobicContact CB-CE1 4.31Å; L41-Y154 HydrophobicContact CD1-CD1 4.31Å; L41-Y154 HydrophobicContact CD1-CE1 3.75Å; L41-L158 HydrophobicContact CD1-CD2 4.24Å; L41-L158 HydrophobicContact CD2-CD1 3.96Å
42R92.4Very high93.6Very high25 Ų2556.8 Ų56.89%0.09430%0.302CS..Hα-helixtrans-67.8-37.7178-165.773.5-166.5165.97.8112.4L38 R39 S40 P46 V49 D96L38-R42 PolarHBondContact O-N 3.1Å; R39-R42 PolarHBondContact O-N 3.39Å; S40-R42 PolarHBondContact O-N 2.93Å; R42-P46 PolarHBondContact NH1-O 3.07Å; R42-P46 VanDerWaalsContact NH1-O 3.11Å; R42-P46 PolarHBondContact NH2-O 2.93Å; R42-P46 WeakPolarHBondContact O-CA 3.45Å; R42-P46 WeakPolarHBondContact O-CB 3.48Å; R42-P46 VanDerWaalsContact O-CD 3.26Å; R42-P46 WeakPolarHBondContact O-CD 3.45Å; R42-V49 PolarHBondContact NH1-O 2.87Å; R42-D96 IonicContact CZ-OD2 3.37Å; R42-D96 VanDerWaalsContact CZ-OD2 3.22Å; R42-D96 IonicContact NE-OD2 2.78Å; R42-D96 PolarHBondContact NE-OD2 3.39Å; R42-D96 VanDerWaalsContact NH2-CG 3.27Å; R42-D96 IonicContact NH2-OD1 3.09Å; R42-D96 PolarHBondContact NH2-OD1 3.44Å; R42-D96 IonicContact NH2-OD2 3.34Å; R42-D96 PolarHBondContact NH2-OD2 3.25Å
43A91.3Very high93.4Very high83 Ų8355.2 Ų55.269%0.68629%0.29SS*.Hα-helixtrans-66.7-41.1178.400000112.5R39 S40R39-A43 PolarHBondContact O-N 3.1Å; S40-A43 PolarHBondContact O-N 2.93Å
44V90.9Very high93.3Very high132 Ų13247.8 Ų47.880%0.826%0.262SS*.Hα-helixtrans-84.7-36.1-179.3179.20000112.3S40S40-V44 PolarHBondContact O-N 3.4Å; S40-V44 VanDerWaalsContact O-N 3.16Å
45A90.8Very high93Very high35 Ų3549.2 Ų49.229%0.28927%0.269SS..  trans-136.866.6-173.500000112.5L41 G47 L48L41-A45 CarbonylContact O-C 3.41Å; L41-A45 WeakPolarHBondContact O-CA 3.37Å; L41-A45 PolarHBondContact O-N 3.02Å; A45-G47 PolarHBondContact O-N 2.93Å; A45-L48 HydrophobicContact CB-CB 4.08Å; A45-L48 WeakPolarHBondContact O-CB 3.45Å; A45-L48 PolarHBondContact O-N 2.77Å
46P89.6Confident92.8Very high49 Ų4949.6 Ų49.632%0.31827%0.27SS..THydrogen-bonded Turntrans-64.8-11.4176.727.7-34.8000113.3R42R42-P46 PolarHBondContact NH1-O 3.07Å; R42-P46 VanDerWaalsContact NH1-O 3.11Å; R42-P46 PolarHBondContact NH2-O 2.93Å; R42-P46 WeakPolarHBondContact O-CA 3.45Å; R42-P46 WeakPolarHBondContact O-CB 3.48Å; R42-P46 VanDerWaalsContact O-CD 3.26Å; R42-P46 WeakPolarHBondContact O-CD 3.45Å
47G89.5Confident92.8Very high47 Ų4745.9 Ų45.949%0.48525%0.252SS..THydrogen-bonded Turntrans-81.1-11.3170.900000115.6A45 V49A45-G47 PolarHBondContact O-N 2.93Å; G47-V49 PolarHBondContact O-N 3.08Å
48L91.9Very high92.7Very high27 Ų2745.3 Ų45.314%0.14125%0.25CS..SBendtrans-67.1-34.8-168.3-173.659.4000113.9L41 A45 Y154 Q157 L158 A161L41-L48 HydrophobicContact CD1-CD2 4.47Å; A45-L48 HydrophobicContact CB-CB 4.08Å; A45-L48 WeakPolarHBondContact O-CB 3.45Å; A45-L48 PolarHBondContact O-N 2.77Å; L48-Y154 HydrophobicContact CD2-CD1 4.47Å; L48-Y154 HydrophobicContact CD2-CE1 3.97Å; L48-Q157 HydrophobicContact CD1-CB 4.05Å; L48-Q157 WeakPolarHBondContact CD1-O 3.44Å; L48-Q157 HydrophobicContact CG-CB 4.37Å; L48-Q157 WeakPolarHBondContact O-CB 3.49Å; L48-L158 HydrophobicContact CD2-CB 4.34Å; L48-L158 HydrophobicContact CD2-CD1 4.08Å; L48-A161 HydrophobicContact CD1-CB 3.91Å
49V92.8Very high92.6Very high14 Ų1445.4 Ų45.49%0.08525%0.251CS..SBendtrans-139.8163.1171.4-61.70000109.9R42 G47 H53 H54 Y154 Q157R42-V49 PolarHBondContact NH1-O 2.87Å; G47-V49 PolarHBondContact O-N 3.08Å; V49-H53 HydrophobicContact CB-CB 4.19Å; V49-H53 HydrophobicContact CG2-CB 4.32Å; V49-H54 HydrophobicContact CG2-CB 3.92Å; V49-Y154 HydrophobicContact CB-CE2 4.48Å; V49-Y154 HydrophobicContact CG1-CD1 4.11Å; V49-Y154 HydrophobicContact CG1-CD2 3.99Å; V49-Y154 HydrophobicContact CG1-CE1 4.35Å; V49-Y154 HydrophobicContact CG1-CE2 4.25Å; V49-Y154 HydrophobicContact CG1-CG 3.91Å; V49-Y154 HydrophobicContact CG2-CD2 3.91Å; V49-Y154 HydrophobicContact CG2-CE1 4.41Å; V49-Y154 HydrophobicContact CG2-CE2 3.43Å; V49-Y154 VanDerWaalsContact CG2-CE2 3.43Å; V49-Q157 HydrophobicContact CG1-CB 4.35Å; V49-Q157 HydrophobicContact CG1-CG 4.2Å
50R91.1Very high92.7Very high149 Ų14937.9 Ų37.956%0.56222%0.223SC*.  trans-61.8149.9171.1-66.2179.8179.2144.9-7.9110.7R52 H53 H54 D394R50-R52 PolarHBondContact O-N 3.05Å; R50-H53 HydrophobicContact CB-CB 4.46Å; R50-H53 VanDerWaalsContact O-CB 3.31Å; R50-H53 WeakPolarHBondContact O-CB 3.48Å; R50-H53 PolarHBondContact O-N 2.72Å; R50-H53 VanDerWaalsContact O-N 3.08Å; R50-H54 PolarHBondContact O-N 3.49Å; R50-D394 PolarHBondContact NH1-O 3.02Å
51Y90.6Very high92.8Very high16 Ų1634.4 Ų34.46%0.06320%0.198CC..Hα-helixtrans-57.4-47.5-179.6175.9-107.7000112.5H53 H54 E55 D96 A99 D103 L104 I107Y51-H53 PolarHBondContact O-N 3.34Å; Y51-H54 PolarHBondContact O-N 3.44Å; Y51-H54 VanDerWaalsContact O-N 3.14Å; Y51-E55 HydrophobicContact CD2-CG 4.17Å; Y51-E55 HydrophobicContact CE1-CG 4.15Å; Y51-E55 HydrophobicContact CE2-CG 3.6Å; Y51-E55 PolarHBondContact O-N 3.14Å; Y51-D96 HydrophobicContact CD2-CB 3.54Å; Y51-D96 HydrophobicContact CE2-CB 3.82Å; Y51-D96 HydrophobicContact CG-CB 4.2Å; Y51-A99 HydrophobicContact CD1-CB 3.3Å; Y51-A99 HydrophobicContact CD2-CB 4.35Å; Y51-A99 HydrophobicContact CE1-CB 3.69Å; Y51-A99 HydrophobicContact CG-CB 3.66Å; Y51-D103 HydrophobicContact CD1-CB 4.35Å; Y51-L104 HydrophobicContact CE1-CD2 3.67Å; Y51-L104 HydrophobicContact CE1-CG 4.29Å; Y51-I107 HydrophobicContact CD1-CD1 3.77Å; Y51-I107 HydrophobicContact CE1-CD1 3.36Å
52R90Very high93Very high48 Ų4836 Ų3618%0.18121%0.205CC..Hα-helixtrans-55.3-33.9174.2178.1172.8167.3-146.1-4.5113.5R50 R56 D103 D396R50-R52 PolarHBondContact O-N 3.05Å; R52-R56 HydrophobicContact CG-CG 4.37Å; R52-R56 VanDerWaalsContact O-CB 3.27Å; R52-R56 WeakPolarHBondContact O-CB 3.18Å; R52-R56 VanDerWaalsContact O-CD 3.31Å; R52-R56 WeakPolarHBondContact O-CD 3.42Å; R52-R56 WeakPolarHBondContact O-CG 3.34Å; R52-R56 PolarHBondContact O-N 3.38Å; R52-D103 HydrophobicContact CB-CB 4.34Å; R52-D103 WeakPolarHBondContact CB-OD1 3.48Å; R52-D103 WeakPolarHBondContact CD-OD1 3.29Å; R52-D396 IonicContact CZ-OD2 3.35Å; R52-D396 IonicContact NH1-OD2 3.52Å; R52-D396 PolarHBondContact NH1-OD2 3.38Å; R52-D396 IonicContact NH2-OD2 2.74Å; R52-D396 PolarHBondContact NH2-OD2 2.8Å
53H93.2Very high93.2Very high18 Ų1834.8 Ų34.88%0.08320%0.2CC..Hα-helixtrans-68.7-48.7176.3-167.1105.3000111.7V49 R50 Y51 L57 L150 E153 Y154V49-H53 HydrophobicContact CB-CB 4.19Å; V49-H53 HydrophobicContact CG2-CB 4.32Å; R50-H53 HydrophobicContact CB-CB 4.46Å; R50-H53 VanDerWaalsContact O-CB 3.31Å; R50-H53 WeakPolarHBondContact O-CB 3.48Å; R50-H53 PolarHBondContact O-N 2.72Å; R50-H53 VanDerWaalsContact O-N 3.08Å; Y51-H53 PolarHBondContact O-N 3.34Å; H53-L57 PolarHBondContact O-N 2.82Å; H53-L150 VanDerWaalsContact CE1-CD2 3.5Å; H53-L150 WeakPolarHBondContact CE1-CD2 3.43Å; H53-L150 PolarHBondContact NE2-O 2.92Å; H53-E153 IonicContact CE1-OE2 3.67Å; H53-E153 PolarHBondContact CE1-OE2 3.17Å; H53-Y154 AromaticContact CD2-CD2 3.9Å
54H94.1Very high93.5Very high10 Ų1031.6 Ų31.65%0.04617%0.171CC..Hα-helixtrans-61.1-47.6179179.484.2000111.7L38 V49 R50 Y51 L57 C58 Y154L38-H54 PolarHBondContact O-CE1 2.92Å; V49-H54 HydrophobicContact CG2-CB 3.92Å; R50-H54 PolarHBondContact O-N 3.49Å; Y51-H54 PolarHBondContact O-N 3.44Å; Y51-H54 VanDerWaalsContact O-N 3.14Å; H54-L57 PolarHBondContact O-N 3.17Å; H54-C58 VanDerWaalsContact CE1-SG 3.53Å; H54-C58 PolarHBondContact NE2-SG 3.32Å; H54-C58 WeakPolarHBondContact O-CB 3.43Å; H54-C58 PolarHBondContact O-N 2.9Å; H54-C58 PolarHBondContact O-SG 3.28Å; H54-Y154 HydrophobicContact CB-CE2 4.16Å; H54-Y154 AromaticContact ND1-CE2 3.51Å; H54-Y154 AromaticContact ND1-CZ 3.67Å; H54-Y154 PolarHBondContact ND1-OH 3.25Å
55E92.9Very high93.8Very high30 Ų3026.1 Ų26.114%0.1414%0.138CC..Hα-helixtrans-70.7-38.3-179.1-71-58.4146.400112.8Y51 L57 C58 M59 I107Y51-E55 HydrophobicContact CD2-CG 4.17Å; Y51-E55 HydrophobicContact CE1-CG 4.15Å; Y51-E55 HydrophobicContact CE2-CG 3.6Å; Y51-E55 PolarHBondContact O-N 3.14Å; E55-L57 VanDerWaalsContact C-N 3.29Å; E55-L57 PolarHBondContact O-N 2.78Å; E55-C58 PolarHBondContact O-N 3.41Å; E55-M59 HydrophobicContact CB-CE 4.21Å; E55-M59 WeakPolarHBondContact O-CB 3.27Å; E55-M59 WeakPolarHBondContact O-CE 3.49Å; E55-M59 WeakPolarHBondContact O-CG 3.44Å; E55-M59 PolarHBondContact O-N 2.98Å; E55-I107 HydrophobicContact CB-CD1 3.71Å; E55-I107 HydrophobicContact CB-CG1 4.13Å; E55-I107 HydrophobicContact CB-CG2 4.29Å; E55-I107 HydrophobicContact CG-CD1 4.03Å; E55-I107 HydrophobicContact CG-CG2 4.46Å
56R93.3Very high94.1Very high19 Ų1924.5 Ų24.57%0.07212%0.124CC..Hα-helixtrans-55.9-44.9173.2-78.916679.7-164.28.3111.6R52 G60 L150 N258 L259 D394R52-R56 HydrophobicContact CG-CG 4.37Å; R52-R56 VanDerWaalsContact O-CB 3.27Å; R52-R56 WeakPolarHBondContact O-CB 3.18Å; R52-R56 VanDerWaalsContact O-CD 3.31Å; R52-R56 WeakPolarHBondContact O-CD 3.42Å; R52-R56 WeakPolarHBondContact O-CG 3.34Å; R52-R56 PolarHBondContact O-N 3.38Å; R56-G60 PolarHBondContact O-N 2.95Å; R56-L150 HydrophobicContact CB-CD1 3.76Å; R56-N258 PolarHBondContact NH2-O 3.24Å; R56-L259 HydrophobicContact CB-CD2 4.08Å; R56-L259 HydrophobicContact CG-CD2 4.45Å; R56-D394 IonicContact NH1-OD1 2.97Å; R56-D394 PolarHBondContact NH1-OD1 3.18Å; R56-D394 VanDerWaalsContact NH1-OD1 3.14Å; R56-D394 IonicContact NH1-OD2 3.73Å
57L96.2Very high94.5Very high0 Ų022.1 Ų22.10%011%0.109CC..Hα-helixtrans-67.7-48.3177.3178.856.9000112.2L38 H53 H54 E55 G60 L61 M147 L150 L151 Y154L38-L57 HydrophobicContact CD1-CD2 3.65Å; L38-L57 HydrophobicContact CD1-CG 3.8Å; L38-L57 HydrophobicContact CD2-CD2 4.01Å; H53-L57 PolarHBondContact O-N 2.82Å; H54-L57 PolarHBondContact O-N 3.17Å; E55-L57 VanDerWaalsContact C-N 3.29Å; E55-L57 PolarHBondContact O-N 2.78Å; L57-G60 PolarHBondContact O-N 3.12Å; L57-L61 HydrophobicContact CD1-CD1 4.13Å; L57-L61 HydrophobicContact CD1-CG 4.34Å; L57-L61 HydrophobicContact CG-CD1 4.22Å; L57-L61 WeakPolarHBondContact O-CG 3.31Å; L57-L61 PolarHBondContact O-N 3.5Å; L57-M147 HydrophobicContact CD1-CG 3.77Å; L57-L150 HydrophobicContact CB-CB 4.28Å; L57-L150 HydrophobicContact CD1-CB 4.24Å; L57-L151 HydrophobicContact CD1-CB 4.13Å; L57-L151 HydrophobicContact CD2-CB 4.14Å; L57-L151 HydrophobicContact CD2-CD1 4.05Å; L57-Y154 HydrophobicContact CD2-CD2 3.79Å; L57-Y154 HydrophobicContact CD2-CG 4.43Å
58C96.2Very high94.9Very high8 Ų822.3 Ų22.35%0.05410%0.097CC..Hα-helixtrans-66.5-40-178.8-69.10000112.5L35 H54 E55 K62L35-C58 HydrophobicContact CD2-CB 3.86Å; L35-C58 WeakPolarHBondContact CD2-O 3.42Å; H54-C58 VanDerWaalsContact CE1-SG 3.53Å; H54-C58 PolarHBondContact NE2-SG 3.32Å; H54-C58 WeakPolarHBondContact O-CB 3.43Å; H54-C58 PolarHBondContact O-N 2.9Å; H54-C58 PolarHBondContact O-SG 3.28Å; E55-C58 PolarHBondContact O-N 3.41Å; C58-K62 WeakPolarHBondContact O-CB 3.4Å; C58-K62 WeakPolarHBondContact O-CG 3.39Å; C58-K62 PolarHBondContact O-N 3.39Å
59M94.8Very high95.2Very high3 Ų322.1 Ų22.12%0.01510%0.096CC..Hα-helixtrans-65.2-41.5172.6-69-172.6-64.400111.9E55 L61 K62 A63 F87 I107 A110 Q111 F257E55-M59 HydrophobicContact CB-CE 4.21Å; E55-M59 WeakPolarHBondContact O-CB 3.27Å; E55-M59 WeakPolarHBondContact O-CE 3.49Å; E55-M59 WeakPolarHBondContact O-CG 3.44Å; E55-M59 PolarHBondContact O-N 2.98Å; M59-L61 PolarHBondContact O-N 3.08Å; M59-K62 PolarHBondContact O-N 3.35Å; M59-A63 VanDerWaalsContact O-CB 3.26Å; M59-A63 WeakPolarHBondContact O-CB 3.47Å; M59-A63 PolarHBondContact O-N 2.88Å; M59-F87 HydrophobicContact CG-CE1 4.42Å; M59-I107 HydrophobicContact CE-CB 4.34Å; M59-I107 HydrophobicContact CE-CG1 4Å; M59-I107 HydrophobicContact CE-CG2 4.07Å; M59-I107 HydrophobicContact SD-CG2 3.92Å; M59-A110 HydrophobicContact CE-CB 4.39Å; M59-A110 HydrophobicContact SD-CB 4.39Å; M59-Q111 HydrophobicContact CG-CG 4.31Å; M59-Q111 HydrophobicContact SD-CG 3.44Å; M59-Q111 WeakPolarHBondContact SD-CG 3.43Å; M59-Q111 PolarHBondContact SD-NE2 3Å; M59-F257 HydrophobicContact CB-CD1 3.66Å; M59-F257 HydrophobicContact CB-CE1 3.62Å; M59-F257 HydrophobicContact CE-CD1 4.1Å; M59-F257 HydrophobicContact CG-CD1 4.46Å; M59-F257 HydrophobicContact CG-CE1 4.23Å; M59-F257 HydrophobicContact SD-CD1 4.05Å; M59-F257 HydrophobicContact SD-CE1 3.9Å
60G96.2Very high95.4Very high0 Ų022 Ų220%010%0.095CC..Hα-helixtrans-58.7-47.1177.300000112.7R56 L57 A63 K64 F143 M147R56-G60 PolarHBondContact O-N 2.95Å; L57-G60 PolarHBondContact O-N 3.12Å; G60-A63 PolarHBondContact O-N 2.81Å; G60-K64 PolarHBondContact O-N 3Å; G60-F143 WeakPolarHBondContact O-CZ 3.37Å; G60-M147 VanDerWaalsContact C-SD 3.53Å
61L97.8Very high95.6Very high0 Ų017.8 Ų17.80%08%0.083CC..Hα-helixtrans-61-48.5175.6-70.2165.5000111.7V23 F31 V34 L35 L38 L57 M59 A63 K64 V65 M147V23-L61 HydrophobicContact CG2-CD2 4.04Å; F31-L61 HydrophobicContact CB-CD2 4.02Å; F31-L61 HydrophobicContact CD1-CD2 4Å; F31-L61 HydrophobicContact CD2-CB 4.45Å; F31-L61 HydrophobicContact CD2-CD2 3.61Å; F31-L61 HydrophobicContact CE1-CD2 4.4Å; F31-L61 HydrophobicContact CE2-CD2 4.03Å; F31-L61 HydrophobicContact CG-CD2 3.6Å; F31-L61 HydrophobicContact CZ-CD2 4.41Å; V34-L61 HydrophobicContact CB-CD1 4.2Å; V34-L61 HydrophobicContact CG1-CD1 3.69Å; V34-L61 HydrophobicContact CG1-CD2 4.48Å; L35-L61 HydrophobicContact CD1-CB 4.28Å; L35-L61 HydrophobicContact CD2-CB 3.91Å; L35-L61 HydrophobicContact CD2-CD1 4.01Å; L35-L61 HydrophobicContact CG-CB 4.03Å; L35-L61 HydrophobicContact CG-CD1 4.24Å; L38-L61 HydrophobicContact CD1-CD1 3.68Å; L57-L61 HydrophobicContact CD1-CD1 4.13Å; L57-L61 HydrophobicContact CD1-CG 4.34Å; L57-L61 HydrophobicContact CG-CD1 4.22Å; L57-L61 WeakPolarHBondContact O-CG 3.31Å; L57-L61 PolarHBondContact O-N 3.5Å; M59-L61 PolarHBondContact O-N 3.08Å; L61-A63 PolarHBondContact O-N 3.48Å; L61-K64 PolarHBondContact O-N 3.14Å; L61-V65 WeakPolarHBondContact O-CG2 3.44Å; L61-V65 PolarHBondContact O-N 3.49Å; L61-V65 VanDerWaalsContact O-N 3.14Å; L61-M147 HydrophobicContact CB-SD 4.46Å; L61-M147 HydrophobicContact CD2-CE 3.92Å; L61-M147 HydrophobicContact CD2-SD 3.75Å; L61-M147 HydrophobicContact CG-SD 3.88Å
62K97.3Very high95.8Very high43 Ų4322 Ų2219%0.18710%0.103CC..Hα-helixtrans-58.1-46.8176.2-75169.7174.5-1700112.2L35 C58 M59 V65 V66 H86 F87L35-K62 HydrophobicContact CD1-CG 3.87Å; L35-K62 HydrophobicContact CD2-CG 4.33Å; C58-K62 WeakPolarHBondContact O-CB 3.4Å; C58-K62 WeakPolarHBondContact O-CG 3.39Å; C58-K62 PolarHBondContact O-N 3.39Å; M59-K62 PolarHBondContact O-N 3.35Å; K62-V65 PolarHBondContact O-N 3.49Å; K62-V66 PolarHBondContact O-N 3Å; K62-H86 HydrophobicContact CB-CB 3.99Å; K62-H86 HydrophobicContact CD-CB 4.04Å; K62-H86 WeakPolarHBondContact CD-O 3.44Å; K62-H86 VanDerWaalsContact CE-O 3.27Å; K62-H86 WeakPolarHBondContact CE-O 3.46Å; K62-H86 HydrophobicContact CG-CB 3.86Å; K62-H86 PolarHBondContact NZ-O 3.35Å; K62-F87 HydrophobicContact CB-CE1 4.45Å; K62-F87 HydrophobicContact CB-CE2 3.63Å; K62-F87 HydrophobicContact CB-CZ 3.52Å; K62-F87 HydrophobicContact CD-CE1 4.25Å; K62-F87 HydrophobicContact CD-CE2 4.4Å; K62-F87 HydrophobicContact CD-CZ 4.08Å; K62-F87 HydrophobicContact CG-CZ 4.49Å
63A96.7Very high96Very high0 Ų022.8 Ų22.80%013%0.126CC..Hα-helixtrans-64.6-45.1-177.500000110.8M59 G60 L61 V65 V66 V67 F87 F114 Y139 F257M59-A63 VanDerWaalsContact O-CB 3.26Å; M59-A63 WeakPolarHBondContact O-CB 3.47Å; M59-A63 PolarHBondContact O-N 2.88Å; G60-A63 PolarHBondContact O-N 2.81Å; L61-A63 PolarHBondContact O-N 3.48Å; A63-V65 VanDerWaalsContact C-N 3.33Å; A63-V65 PolarHBondContact O-N 3.26Å; A63-V66 PolarHBondContact O-N 3.42Å; A63-V66 VanDerWaalsContact O-N 3.11Å; A63-V67 WeakPolarHBondContact O-CG2 3.46Å; A63-V67 PolarHBondContact O-N 3.41Å; A63-F87 HydrophobicContact CB-CZ 4.28Å; A63-F114 HydrophobicContact CB-CD1 4.4Å; A63-F114 HydrophobicContact CB-CE1 3.94Å; A63-F114 HydrophobicContact CB-CE2 4.11Å; A63-F114 HydrophobicContact CB-CZ 3.78Å; A63-Y139 HydrophobicContact CB-CD1 4.42Å; A63-Y139 HydrophobicContact CB-CE1 3.92Å; A63-F257 HydrophobicContact CB-CD2 4.2Å; A63-F257 HydrophobicContact CB-CE2 3.46Å; A63-F257 VanDerWaalsContact CB-CE2 3.46Å; A63-F257 HydrophobicContact CB-CZ 3.85Å
64K97.4Very high96.2Very high15 Ų1526.8 Ų26.87%0.06514%0.141CC..Hα-helixtrans-63-37.3176.6-173.161.9178.8-176.90112.5V28 F31 G60 L61 V66 V67 E68 Y139 F143 L144V28-K64 HydrophobicContact CG1-CG 4.14Å; V28-K64 HydrophobicContact CG2-CG 3.89Å; F31-K64 HydrophobicContact CD2-CB 4.34Å; F31-K64 HydrophobicContact CE2-CB 3.99Å; F31-K64 HydrophobicContact CE2-CG 3.87Å; G60-K64 PolarHBondContact O-N 3Å; L61-K64 PolarHBondContact O-N 3.14Å; K64-V66 VanDerWaalsContact C-N 3.31Å; K64-V66 PolarHBondContact O-N 3.31Å; K64-V67 PolarHBondContact O-N 3.49Å; K64-E68 WeakPolarHBondContact O-CB 3.22Å; K64-E68 PolarHBondContact O-N 3.45Å; K64-Y139 PolarHBondContact NZ-O 3.34Å; K64-F143 HydrophobicContact CB-CE1 4.19Å; K64-L144 HydrophobicContact CD-CD2 4.11Å; K64-L144 HydrophobicContact CG-CD2 3.97Å
65V97.9Very high96.3Very high18 Ų1830.4 Ų30.411%0.10917%0.165CC..Hα-helixtrans-59.8-40.5173.3170.40000111.7V28 F31 L61 K62 A63 L69 T82V28-V65 HydrophobicContact CG1-CB 4.46Å; V28-V65 HydrophobicContact CG1-CG2 3.9Å; F31-V65 HydrophobicContact CB-CG2 3.76Å; F31-V65 HydrophobicContact CD2-CG2 4.26Å; F31-V65 HydrophobicContact CG-CG2 4.47Å; L61-V65 WeakPolarHBondContact O-CG2 3.44Å; L61-V65 PolarHBondContact O-N 3.49Å; L61-V65 VanDerWaalsContact O-N 3.14Å; K62-V65 PolarHBondContact O-N 3.49Å; A63-V65 VanDerWaalsContact C-N 3.33Å; A63-V65 PolarHBondContact O-N 3.26Å; V65-L69 WeakPolarHBondContact O-CG 3.35Å; V65-L69 PolarHBondContact O-N 3Å; V65-T82 HydrophobicContact CG1-CG2 4.15Å
66V97.8Very high96.5Very high0 Ų032.4 Ų32.40%017%0.172CC..Hα-helixtrans-69.5-46.9176.3175.10000111.4K62 A63 K64 E68 L69 I70 V79 T82 L83 F114 V118K62-V66 PolarHBondContact O-N 3Å; A63-V66 PolarHBondContact O-N 3.42Å; A63-V66 VanDerWaalsContact O-N 3.11Å; K64-V66 VanDerWaalsContact C-N 3.31Å; K64-V66 PolarHBondContact O-N 3.31Å; V66-E68 VanDerWaalsContact C-N 3.33Å; V66-E68 PolarHBondContact O-N 3.42Å; V66-L69 PolarHBondContact O-N 3.39Å; V66-I70 HydrophobicContact CG1-CD1 4.22Å; V66-I70 WeakPolarHBondContact O-CG1 3.41Å; V66-I70 PolarHBondContact O-N 3Å; V66-V79 HydrophobicContact CG1-CG1 4.1Å; V66-T82 HydrophobicContact CG2-CG2 4.12Å; V66-L83 HydrophobicContact CG1-CB 4.41Å; V66-L83 HydrophobicContact CG1-CD1 4.14Å; V66-L83 HydrophobicContact CG2-CB 4.48Å; V66-L83 HydrophobicContact CG2-CD1 4.42Å; V66-F114 HydrophobicContact CB-CE1 4.24Å; V66-F114 HydrophobicContact CB-CZ 4.04Å; V66-F114 HydrophobicContact CG1-CE1 4.32Å; V66-F114 HydrophobicContact CG1-CZ 4.08Å; V66-V118 HydrophobicContact CG1-CG1 4.07Å; V66-V118 HydrophobicContact CG1-CG2 4.04Å
67V97Very high96.6Very high0 Ų035.4 Ų35.40%020%0.2CC..Hα-helixtrans-61.9-40.1178.9172.70000111.8A63 K64 L69 I70 L71 F114 L135 Y139A63-V67 WeakPolarHBondContact O-CG2 3.46Å; A63-V67 PolarHBondContact O-N 3.41Å; K64-V67 PolarHBondContact O-N 3.49Å; V67-L69 VanDerWaalsContact C-N 3.32Å; V67-L69 PolarHBondContact O-N 3.16Å; V67-I70 WeakPolarHBondContact O-CA 3.44Å; V67-I70 WeakPolarHBondContact O-CB 3.39Å; V67-I70 PolarHBondContact O-N 2.7Å; V67-L71 HydrophobicContact CG1-CD1 3.78Å; V67-L71 HydrophobicContact CG1-CG 4.09Å; V67-L71 WeakPolarHBondContact O-CG 3.39Å; V67-L71 PolarHBondContact O-N 3.05Å; V67-F114 HydrophobicContact CG2-CE2 4Å; V67-F114 HydrophobicContact CG2-CZ 4.14Å; V67-L135 HydrophobicContact CB-CD2 4.48Å; V67-L135 HydrophobicContact CG1-CD2 3.94Å; V67-L135 HydrophobicContact CG1-CG 3.97Å; V67-L135 HydrophobicContact CG2-CD1 4.12Å; V67-L135 HydrophobicContact CG2-CD2 4.12Å; V67-L135 HydrophobicContact CG2-CG 4.09Å; V67-Y139 HydrophobicContact CG1-CG 4.46Å; V67-Y139 HydrophobicContact CG2-CD1 4.25Å; V67-Y139 HydrophobicContact CG2-CD2 3.83Å; V67-Y139 HydrophobicContact CG2-CE2 4.26Å; V67-Y139 HydrophobicContact CG2-CG 3.85Å
68E97.6Very high96.7Very high51 Ų5138.6 Ų38.624%0.23822%0.215CC..Hα-helixtrans-61.1-40.2177.3-172.760.6-144.700111.7V28 K64 V66 I70 L71 Q72V28-E68 HydrophobicContact CB-CB 4.46Å; V28-E68 HydrophobicContact CB-CG 4.09Å; V28-E68 HydrophobicContact CG1-CB 3.8Å; V28-E68 HydrophobicContact CG1-CG 3.93Å; V28-E68 HydrophobicContact CG2-CG 4.36Å; K64-E68 WeakPolarHBondContact O-CB 3.22Å; K64-E68 PolarHBondContact O-N 3.45Å; V66-E68 VanDerWaalsContact C-N 3.33Å; V66-E68 PolarHBondContact O-N 3.42Å; E68-I70 VanDerWaalsContact C-N 3.31Å; E68-I70 PolarHBondContact O-N 3.48Å; E68-L71 PolarHBondContact O-N 2.89Å; E68-Q72 VanDerWaalsContact O-CB 3.29Å; E68-Q72 WeakPolarHBondContact O-CB 3.35Å; E68-Q72 WeakPolarHBondContact O-CG 3.26Å; E68-Q72 PolarHBondContact O-N 3.03Å; E68-Q72 PolarHBondContact OE1-NE2 3.28Å
69L97.6Very high96.7Very high22 Ų2238.2 Ų38.212%0.11521%0.213CC..Hα-helixtrans-64.7-34.2173.1-66.1169.9000112.3V65 V66 V67 R74 V79 T82V65-L69 WeakPolarHBondContact O-CG 3.35Å; V65-L69 PolarHBondContact O-N 3Å; V66-L69 PolarHBondContact O-N 3.39Å; V67-L69 VanDerWaalsContact C-N 3.32Å; V67-L69 PolarHBondContact O-N 3.16Å; L69-R74 HydrophobicContact CB-CB 4.31Å; L69-R74 HydrophobicContact CB-CG 4.15Å; L69-R74 HydrophobicContact CD2-CG 3.9Å; L69-R74 WeakPolarHBondContact O-CB 3.33Å; L69-R74 WeakPolarHBondContact O-CG 3.48Å; L69-R74 PolarHBondContact O-N 3.29Å; L69-V79 HydrophobicContact CB-CG2 4.19Å; L69-T82 HydrophobicContact CD1-CG2 3.78Å; L69-T82 WeakPolarHBondContact CD1-OG1 3.41Å
70I96.8Very high96.8Very high11 Ų1140.5 Ų40.56%0.05623%0.225CC..Hα-helixtrans-68.1-50.3176.3-63.9167.4000110.4V66 V67 E68 Q72 G73 W76 V79 V118 L132 L135V66-I70 HydrophobicContact CG1-CD1 4.22Å; V66-I70 WeakPolarHBondContact O-CG1 3.41Å; V66-I70 PolarHBondContact O-N 3Å; V67-I70 WeakPolarHBondContact O-CA 3.44Å; V67-I70 WeakPolarHBondContact O-CB 3.39Å; V67-I70 PolarHBondContact O-N 2.7Å; E68-I70 VanDerWaalsContact C-N 3.31Å; E68-I70 PolarHBondContact O-N 3.48Å; I70-Q72 VanDerWaalsContact C-N 3.31Å; I70-Q72 PolarHBondContact O-N 3.39Å; I70-G73 PolarHBondContact O-N 2.97Å; I70-W76 HydrophobicContact CD1-CH2 4.37Å; I70-W76 HydrophobicContact CD1-CZ3 4.09Å; I70-W76 HydrophobicContact CG1-CH2 4.13Å; I70-W76 HydrophobicContact CG1-CZ3 3.85Å; I70-W76 HydrophobicContact CG2-CH2 3.81Å; I70-W76 HydrophobicContact CG2-CZ3 4.39Å; I70-V79 HydrophobicContact CD1-CG1 3.95Å; I70-V79 HydrophobicContact CG1-CB 4.47Å; I70-V79 HydrophobicContact CG1-CG1 3.53Å; I70-V79 HydrophobicContact CG1-CG2 4.07Å; I70-V118 HydrophobicContact CD1-CG1 3.89Å; I70-V118 HydrophobicContact CD1-CG2 4.1Å; I70-L132 HydrophobicContact CG2-CD2 3.32Å; I70-L135 HydrophobicContact CB-CD2 4.45Å; I70-L135 HydrophobicContact CD1-CD2 4.06Å; I70-L135 HydrophobicContact CG2-CD2 4.11Å
71L95.3Very high96.8Very high61 Ų6148.3 Ų48.332%0.31926%0.259SS..Hα-helixtrans-67.4-29.9-178.1-62.7176.8000112.5V67 E68 G73 E136V67-L71 HydrophobicContact CG1-CD1 3.78Å; V67-L71 HydrophobicContact CG1-CG 4.09Å; V67-L71 WeakPolarHBondContact O-CG 3.39Å; V67-L71 PolarHBondContact O-N 3.05Å; E68-L71 PolarHBondContact O-N 2.89Å; L71-G73 PolarHBondContact O-N 3.23Å; L71-E136 HydrophobicContact CD1-CB 4.12Å; L71-E136 HydrophobicContact CD1-CG 4.1Å; L71-E136 HydrophobicContact CD2-CB 4.06Å
72Q96.4Very high96.7Very high105 Ų10549.7 Ų49.749%0.49127%0.267SS..THydrogen-bonded Turntrans-72.22.8169.2-71.6178.215.400114.2E68 I70 R74E68-Q72 VanDerWaalsContact O-CB 3.29Å; E68-Q72 WeakPolarHBondContact O-CB 3.35Å; E68-Q72 WeakPolarHBondContact O-CG 3.26Å; E68-Q72 PolarHBondContact O-N 3.03Å; E68-Q72 PolarHBondContact OE1-NE2 3.28Å; I70-Q72 VanDerWaalsContact C-N 3.31Å; I70-Q72 PolarHBondContact O-N 3.39Å; Q72-R74 VanDerWaalsContact C-N 3.3Å; Q72-R74 HydrophobicContact CB-CG 3.96Å; Q72-R74 PolarHBondContact O-N 2.86Å
73G94.4Very high96.6Very high64 Ų6447.6 Ų47.666%0.6626%0.258SS*.THydrogen-bonded Turntrans65.729.2178.700000113.8I70 L71I70-G73 PolarHBondContact O-N 2.97Å; L71-G73 PolarHBondContact O-N 3.23Å
74R97Very high96.4Very high102 Ų10250.6 Ų50.639%0.38527%0.274SS..  trans-70.8147-178.4-55.3-66.5-68.4-112.54.9110.3L69 Q72 W76 Q78 V79L69-R74 HydrophobicContact CB-CB 4.31Å; L69-R74 HydrophobicContact CB-CG 4.15Å; L69-R74 HydrophobicContact CD2-CG 3.9Å; L69-R74 WeakPolarHBondContact O-CB 3.33Å; L69-R74 WeakPolarHBondContact O-CG 3.48Å; L69-R74 PolarHBondContact O-N 3.29Å; Q72-R74 VanDerWaalsContact C-N 3.3Å; Q72-R74 HydrophobicContact CB-CG 3.96Å; Q72-R74 PolarHBondContact O-N 2.86Å; R74-W76 PolarHBondContact O-N 3.41Å; R74-Q78 VanDerWaalsContact NH2-NE2 3.11Å; R74-V79 HydrophobicContact CB-CG2 4.42Å
75P96.6Very high96.3Very high87 Ų8756.7 Ų56.757%0.56530%0.302SS*.  trans-56.4137-178.2-25.634.5000112.1A77 Q78 V79P75-A77 PolarHBondContact O-N 3.46Å; P75-A77 VanDerWaalsContact O-N 3.09Å; P75-Q78 WeakPolarHBondContact O-CA 3.38Å; P75-Q78 WeakPolarHBondContact O-CB 3.36Å; P75-Q78 PolarHBondContact O-N 3.33Å; P75-V79 PolarHBondContact O-N 3.17Å
76W96.3Very high96Very high72 Ų7256.9 Ų56.927%0.27330%0.302SS..Hα-helixtrans-54.9-33.1-176.9-73.9118.8000113.8I70 R74 Q78 V79 L80 L121 S122 L128I70-W76 HydrophobicContact CD1-CH2 4.37Å; I70-W76 HydrophobicContact CD1-CZ3 4.09Å; I70-W76 HydrophobicContact CG1-CH2 4.13Å; I70-W76 HydrophobicContact CG1-CZ3 3.85Å; I70-W76 HydrophobicContact CG2-CH2 3.81Å; I70-W76 HydrophobicContact CG2-CZ3 4.39Å; R74-W76 PolarHBondContact O-N 3.41Å; W76-Q78 VanDerWaalsContact C-N 3.27Å; W76-Q78 PolarHBondContact O-N 3.06Å; W76-V79 HydrophobicContact CE3-CB 3.95Å; W76-V79 HydrophobicContact CE3-CG1 3.97Å; W76-V79 HydrophobicContact CE3-CG2 4.18Å; W76-V79 HydrophobicContact CZ3-CB 4.38Å; W76-V79 HydrophobicContact CZ3-CG1 3.94Å; W76-V79 PolarHBondContact O-N 3.28Å; W76-L80 WeakPolarHBondContact O-CB 3.43Å; W76-L80 WeakPolarHBondContact O-CG 3.49Å; W76-L80 PolarHBondContact O-N 3.08Å; W76-L121 HydrophobicContact CH2-CB 3.59Å; W76-L121 HydrophobicContact CZ2-CB 4.24Å; W76-L121 WeakPolarHBondContact CZ2-O 3.24Å; W76-L121 HydrophobicContact CZ3-CB 4.24Å; W76-S122 VanDerWaalsContact CE3-CB 3.4Å; W76-L128 HydrophobicContact CZ2-CD1 4.45Å
77A96Very high95.7Very high82 Ų8257.1 Ų57.168%0.67830%0.303SS*.Hα-helixtrans-60.6-32.2172.800000113.6P75 K81P75-A77 PolarHBondContact O-N 3.46Å; P75-A77 VanDerWaalsContact O-N 3.09Å; A77-K81 VanDerWaalsContact O-CB 3.31Å; A77-K81 WeakPolarHBondContact O-CB 3.41Å; A77-K81 PolarHBondContact O-N 3.43Å
78Q97.1Very high95.1Very high67 Ų6760.5 Ų60.531%0.31333%0.325SS..Hα-helixtrans-75.1-44.6172-171.9-174.9-1500110.9R74 P75 W76 K81 T82R74-Q78 VanDerWaalsContact NH2-NE2 3.11Å; P75-Q78 WeakPolarHBondContact O-CA 3.38Å; P75-Q78 WeakPolarHBondContact O-CB 3.36Å; P75-Q78 PolarHBondContact O-N 3.33Å; W76-Q78 VanDerWaalsContact C-N 3.27Å; W76-Q78 PolarHBondContact O-N 3.06Å; Q78-K81 PolarHBondContact O-N 2.9Å; Q78-T82 PolarHBondContact O-N 3.45Å; Q78-T82 PolarHBondContact O-OG1 3.03Å
79V97Very high93.7Very high0 Ų063.9 Ų63.90%034%0.341CS..Hα-helixtrans-58.7-52.3178.7177.60000111V66 L69 I70 R74 P75 W76 K81 T82 L83 V118V66-V79 HydrophobicContact CG1-CG1 4.1Å; L69-V79 HydrophobicContact CB-CG2 4.19Å; I70-V79 HydrophobicContact CD1-CG1 3.95Å; I70-V79 HydrophobicContact CG1-CB 4.47Å; I70-V79 HydrophobicContact CG1-CG1 3.53Å; I70-V79 HydrophobicContact CG1-CG2 4.07Å; R74-V79 HydrophobicContact CB-CG2 4.42Å; P75-V79 PolarHBondContact O-N 3.17Å; W76-V79 HydrophobicContact CE3-CB 3.95Å; W76-V79 HydrophobicContact CE3-CG1 3.97Å; W76-V79 HydrophobicContact CE3-CG2 4.18Å; W76-V79 HydrophobicContact CZ3-CB 4.38Å; W76-V79 HydrophobicContact CZ3-CG1 3.94Å; W76-V79 PolarHBondContact O-N 3.28Å; V79-K81 VanDerWaalsContact C-N 3.3Å; V79-K81 PolarHBondContact O-N 2.87Å; V79-T82 PolarHBondContact O-N 3.23Å; V79-T82 VanDerWaalsContact O-N 3.13Å; V79-L83 WeakPolarHBondContact O-CB 3.35Å; V79-L83 PolarHBondContact O-N 3.18Å; V79-V118 HydrophobicContact CG1-CG1 3.93Å
80L96Very high92Very high50 Ų5068.5 Ų68.526%0.26238%0.375SS..Hα-helixtrans-65.2-31.9-178.6-66.2172.7000112.5W76 L83 N84W76-L80 WeakPolarHBondContact O-CB 3.43Å; W76-L80 WeakPolarHBondContact O-CG 3.49Å; W76-L80 PolarHBondContact O-N 3.08Å; L80-L83 HydrophobicContact CD2-CD2 4.08Å; L80-N84 WeakPolarHBondContact O-CB 3.4Å; L80-N84 PolarHBondContact O-N 3.43Å; L80-N84 PolarHBondContact O-ND2 3.39Å
81K96.1Very high90.2Very high164 Ų16469.8 Ų69.871%0.71339%0.391SS*.Hα-helixtrans-65.2-44171.2-178.3177.7179178.80111.8A77 Q78 V79 H85A77-K81 VanDerWaalsContact O-CB 3.31Å; A77-K81 WeakPolarHBondContact O-CB 3.41Å; A77-K81 PolarHBondContact O-N 3.43Å; Q78-K81 PolarHBondContact O-N 2.9Å; V79-K81 VanDerWaalsContact C-N 3.3Å; V79-K81 PolarHBondContact O-N 2.87Å; K81-H85 WeakPolarHBondContact O-CB 3.41Å; K81-H85 PolarHBondContact O-N 2.76Å; K81-H85 VanDerWaalsContact O-N 3.1Å
82T95.5Very high88.2Confident29 Ų2972.6 Ų72.618%0.17841%0.412CS..Hα-helixtrans-69-39.4176.3-60.20000111.7V65 V66 L69 Q78 V79 H85 H86V65-T82 HydrophobicContact CG1-CG2 4.15Å; V66-T82 HydrophobicContact CG2-CG2 4.12Å; L69-T82 HydrophobicContact CD1-CG2 3.78Å; L69-T82 WeakPolarHBondContact CD1-OG1 3.41Å; Q78-T82 PolarHBondContact O-N 3.45Å; Q78-T82 PolarHBondContact O-OG1 3.03Å; V79-T82 PolarHBondContact O-N 3.23Å; V79-T82 VanDerWaalsContact O-N 3.13Å; T82-H85 PolarHBondContact O-N 3.16Å; T82-H86 PolarHBondContact O-N 3.47Å; T82-H86 VanDerWaalsContact O-N 3.08Å
83L95.3Very high86.3Confident0 Ų073.8 Ų73.80%042%0.421CS..Hα-helixtrans-55.5-56.5173.6-179.372.7000110.4V66 V79 L80 H85 H86 F87 F114 Y115 V118V66-L83 HydrophobicContact CG1-CB 4.41Å; V66-L83 HydrophobicContact CG1-CD1 4.14Å; V66-L83 HydrophobicContact CG2-CB 4.48Å; V66-L83 HydrophobicContact CG2-CD1 4.42Å; V79-L83 WeakPolarHBondContact O-CB 3.35Å; V79-L83 PolarHBondContact O-N 3.18Å; L80-L83 HydrophobicContact CD2-CD2 4.08Å; L83-H85 VanDerWaalsContact C-N 3.27Å; L83-H85 PolarHBondContact O-N 3.02Å; L83-H86 PolarHBondContact O-N 2.89Å; L83-F87 HydrophobicContact CD1-CD2 3.99Å; L83-F87 WeakPolarHBondContact O-CA 3.21Å; L83-F87 PolarHBondContact O-N 3Å; L83-F114 HydrophobicContact CD1-CD1 4.18Å; L83-F114 HydrophobicContact CD1-CE1 3.86Å; L83-Y115 HydrophobicContact CD1-CD2 4.01Å; L83-Y115 HydrophobicContact CD2-CD2 3.46Å; L83-Y115 VanDerWaalsContact CD2-CD2 3.46Å; L83-Y115 HydrophobicContact CD2-CE2 3.47Å; L83-Y115 VanDerWaalsContact CD2-CE2 3.47Å; L83-Y115 HydrophobicContact CD2-CG 4.2Å; L83-Y115 HydrophobicContact CG-CD2 3.53Å; L83-Y115 HydrophobicContact CG-CE2 3.68Å; L83-V118 HydrophobicContact CD1-CB 4.13Å; L83-V118 HydrophobicContact CD1-CG1 4.29Å; L83-V118 HydrophobicContact CD1-CG2 4.25Å; L83-V118 HydrophobicContact CD2-CB 3.95Å; L83-V118 HydrophobicContact CD2-CG1 3.81Å; L83-V118 HydrophobicContact CG-CG1 4.49Å
84N94.4Very high84.6Confident62 Ų6275.3 Ų75.333%0.33242%0.417SS..Hα-helixtrans-61-31.7179.1-87.5-90.4000113.6L80 P88 Y115L80-N84 WeakPolarHBondContact O-CB 3.4Å; L80-N84 PolarHBondContact O-N 3.43Å; L80-N84 PolarHBondContact O-ND2 3.39Å; N84-P88 WeakPolarHBondContact O-CA 3.36Å; N84-Y115 PolarHBondContact ND2-OH 3.35Å; N84-Y115 VanDerWaalsContact ND2-OH 3.14Å; N84-Y115 PolarHBondContact OD1-OH 2.81Å
85H93.4Very high82.9Confident143 Ų14381 Ų8166%0.66244%0.439SS*.Hα-helixtrans-70.2-32.1175.3176.463.9000113.1K81 T82 L83K81-H85 WeakPolarHBondContact O-CB 3.41Å; K81-H85 PolarHBondContact O-N 2.76Å; K81-H85 VanDerWaalsContact O-N 3.1Å; T82-H85 PolarHBondContact O-N 3.16Å; L83-H85 VanDerWaalsContact C-N 3.27Å; L83-H85 PolarHBondContact O-N 3.02Å
86H92.3Very high81.5Confident22 Ų2277.8 Ų77.810%0.10242%0.417CS..Hα-helixtrans-94.2-28.8-179.7-73.8-20.5000113.8K62 T82 L83K62-H86 HydrophobicContact CB-CB 3.99Å; K62-H86 HydrophobicContact CD-CB 4.04Å; K62-H86 WeakPolarHBondContact CD-O 3.44Å; K62-H86 VanDerWaalsContact CE-O 3.27Å; K62-H86 WeakPolarHBondContact CE-O 3.46Å; K62-H86 HydrophobicContact CG-CB 3.86Å; K62-H86 PolarHBondContact NZ-O 3.35Å; T82-H86 PolarHBondContact O-N 3.47Å; T82-H86 VanDerWaalsContact O-N 3.08Å; L83-H86 PolarHBondContact O-N 2.89Å
87F90.9Very high80.1Confident6 Ų680.3 Ų80.33%0.02644%0.443CS..SBendtrans-136.178.8-176.2-56.2-87.7000108.8M59 K62 A63 L83 Q111 F114 Y115 F257M59-F87 HydrophobicContact CG-CE1 4.42Å; K62-F87 HydrophobicContact CB-CE1 4.45Å; K62-F87 HydrophobicContact CB-CE2 3.63Å; K62-F87 HydrophobicContact CB-CZ 3.52Å; K62-F87 HydrophobicContact CD-CE1 4.25Å; K62-F87 HydrophobicContact CD-CE2 4.4Å; K62-F87 HydrophobicContact CD-CZ 4.08Å; K62-F87 HydrophobicContact CG-CZ 4.49Å; A63-F87 HydrophobicContact CB-CZ 4.28Å; L83-F87 HydrophobicContact CD1-CD2 3.99Å; L83-F87 WeakPolarHBondContact O-CA 3.21Å; L83-F87 PolarHBondContact O-N 3Å; F87-Q111 HydrophobicContact CD1-CB 4.08Å; F87-Q111 HydrophobicContact CD1-CG 3.86Å; F87-Q111 HydrophobicContact CE1-CG 4.09Å; F87-F114 HydrophobicContact CD2-CD1 4.19Å; F87-F114 HydrophobicContact CD2-CE1 4.14Å; F87-F114 HydrophobicContact CE1-CD1 4.3Å; F87-F114 AromaticContact CE2-CD1 3.78Å; F87-F114 HydrophobicContact CE2-CD1 3.78Å; F87-F114 AromaticContact CE2-CE1 3.57Å; F87-F114 HydrophobicContact CE2-CE1 3.57Å; F87-F114 AromaticContact CZ-CD1 3.84Å; F87-F114 HydrophobicContact CZ-CD1 3.84Å; F87-F114 AromaticContact CZ-CE1 3.96Å; F87-F114 HydrophobicContact CZ-CE1 3.96Å; F87-Y115 HydrophobicContact CB-CD2 4.31Å; F87-F257 HydrophobicContact CE1-CE1 4.37Å; F87-F257 HydrophobicContact CE1-CZ 4.28Å; F87-F257 HydrophobicContact CZ-CZ 4.28Å
88P85.4Confident78.9Confident71 Ų7183 Ų8346%0.46144%0.439SS..  trans-77.9131.3-178.729.9-33.9000111.8N84 S90 G91N84-P88 WeakPolarHBondContact O-CA 3.36Å; P88-S90 PolarHBondContact O-N 3.42Å; P88-G91 PolarHBondContact O-N 3.48Å
89E68.9Low78.3Confident122 Ų12281 Ų8157%0.5743%0.433SS*.THydrogen-bonded Turntrans-55.7-15.7179-62.8-177162.200114.6Y115E89-Y115 VanDerWaalsContact CD-OH 3.26Å; E89-Y115 HydrophobicContact CG-CE1 3.78Å; E89-Y115 HydrophobicContact CG-CE2 4.24Å; E89-Y115 WeakPolarHBondContact CG-OH 3.49Å; E89-Y115 WeakPolarHBondContact OE1-CE1 3.18Å; E89-Y115 PolarHBondContact OE1-OH 3.38Å
90S61.7Low77.7Confident119 Ų11984.3 Ų84.383%0.83245%0.454SS*.THydrogen-bonded Turntrans-14754.8178.9-68.40000111.7P88P88-S90 PolarHBondContact O-N 3.42Å
91G57.9Low77.3Confident37 Ų3790.4 Ų90.438%0.38148%0.478SS..  trans-66.1148.1169.700000112.6P88 I93P88-G91 PolarHBondContact O-N 3.48Å; G91-I93 PolarHBondContact O-N 2.99Å
92P54.3Low76.8Confident120 Ų12087 Ų8778%0.77947%0.465SS*.  trans-61.9132.4170.127.4-33.9000109.7V94P92-V94 PolarHBondContact O-N 2.9Å
93I56.8Low76.4Confident131 Ų13186.7 Ų86.767%0.67246%0.462SS*.  trans-64.4102.2179.2-59.6172.5000108.8G91 R95G91-I93 PolarHBondContact O-N 2.99Å; I93-R95 VanDerWaalsContact C-N 3.34Å; I93-R95 HydrophobicContact CG2-CG 4.31Å; I93-R95 PolarHBondContact O-N 3.41Å
94V58.8Low76Confident95 Ų9588.6 Ų88.658%0.57647%0.472SS*.  trans-69.191.4177.7-177.60000108.7P92 D96P92-V94 PolarHBondContact O-N 2.9Å; V94-D96 PolarHBondContact O-N 2.72Å
95R60.1Low75.6Confident222 Ų22293.5 Ų93.584%0.83849%0.486SS*.  trans-73.575.2171.6-68.6-170178.2-161.81.3110I93I93-R95 VanDerWaalsContact C-N 3.34Å; I93-R95 HydrophobicContact CG2-CG 4.31Å; I93-R95 PolarHBondContact O-N 3.41Å
96D67.4Low75.3Confident19 Ų1990.4 Ų90.410%0.10247%0.471CS..  trans-61.5125.5164.9-173.3-65.8000108.6R42 Y51 V94 K98 A99R42-D96 IonicContact CZ-OD2 3.37Å; R42-D96 VanDerWaalsContact CZ-OD2 3.22Å; R42-D96 IonicContact NE-OD2 2.78Å; R42-D96 PolarHBondContact NE-OD2 3.39Å; R42-D96 VanDerWaalsContact NH2-CG 3.27Å; R42-D96 IonicContact NH2-OD1 3.09Å; R42-D96 PolarHBondContact NH2-OD1 3.44Å; R42-D96 IonicContact NH2-OD2 3.34Å; R42-D96 PolarHBondContact NH2-OD2 3.25Å; Y51-D96 HydrophobicContact CD2-CB 3.54Å; Y51-D96 HydrophobicContact CE2-CB 3.82Å; Y51-D96 HydrophobicContact CG-CB 4.2Å; V94-D96 PolarHBondContact O-N 2.72Å; D96-K98 PolarHBondContact O-N 3.4Å; D96-K98 PolarHBondContact OD1-N 3.31Å; D96-A99 HydrophobicContact CB-CB 4.17Å; D96-A99 WeakPolarHBondContact O-CB 3.34Å; D96-A99 PolarHBondContact O-N 3.18Å
97P68.1Low75.1Confident126 Ų12689.7 Ų89.782%0.81847%0.468SS*.THydrogen-bonded Turntrans-68.6-4.4-173.528.3-35.8000113.7
98K70.7Confident75Confident139 Ų13994.1 Ų94.160%0.60449%0.491SS*.THydrogen-bonded Turntrans-112.412.2173.6-62.4-170.7175-170.80113.4D96D96-K98 PolarHBondContact O-N 3.4Å; D96-K98 PolarHBondContact OD1-N 3.31Å
99A82.8Confident75.2Confident23 Ų2396.8 Ų96.819%0.1950%0.497CS..  trans-86128.9173.500000111.7Y51 D96 L104Y51-A99 HydrophobicContact CD1-CB 3.3Å; Y51-A99 HydrophobicContact CD2-CB 4.35Å; Y51-A99 HydrophobicContact CE1-CB 3.69Å; Y51-A99 HydrophobicContact CG-CB 3.66Å; D96-A99 HydrophobicContact CB-CB 4.17Å; D96-A99 WeakPolarHBondContact O-CB 3.34Å; D96-A99 PolarHBondContact O-N 3.18Å; A99-L104 HydrophobicContact CB-CD1 4.08Å; A99-L104 HydrophobicContact CB-CD2 4.13Å; A99-L104 HydrophobicContact CB-CG 3.94Å
100T86.3Confident76.1Confident70 Ų7091.2 Ų91.243%0.42947%0.472SS..  trans-78157.8169.974.60000110.9Q102 D103 L104T100-Q102 PolarHBondContact O-N 3.25Å; T100-Q102 PolarHBondContact OG1-N 3.34Å; T100-D103 WeakPolarHBondContact CB-OD2 3.38Å; T100-D103 WeakPolarHBondContact CG2-OD2 3.2Å; T100-D103 PolarHBondContact N-OD2 2.84Å; T100-D103 PolarHBondContact O-N 3.3Å; T100-D103 PolarHBondContact OG1-N 2.95Å; T100-D103 PolarHBondContact OG1-OD2 3.47Å; T100-L104 WeakPolarHBondContact O-CG 3.44Å; T100-L104 PolarHBondContact O-N 3.11Å; T100-L104 VanDerWaalsContact O-N 3.1Å
101K86.1Confident77.4Confident178 Ų17887.5 Ų87.577%0.77444%0.442SS*.Hα-helixtrans-57.7-31.5171.6-66.3179.9-177.9173.80112R105K101-R105 WeakPolarHBondContact O-CG 3.38Å; K101-R105 PolarHBondContact O-N 3.29Å
102Q87.1Confident78.9Confident92 Ų9290.3 Ų90.343%0.4345%0.445SS..Hα-helixtrans-74.9-42.6179.4-167.8-170.614.700111.7T100 R105 K106T100-Q102 PolarHBondContact O-N 3.25Å; T100-Q102 PolarHBondContact OG1-N 3.34Å; Q102-R105 PolarHBondContact O-N 2.97Å; Q102-K106 HydrophobicContact CG-CD 4.42Å; Q102-K106 PolarHBondContact O-N 3.46Å
103D86Confident80.7Confident24 Ų2487.3 Ų87.313%0.12842%0.424CS..Hα-helixtrans-59.3-48.3175.2-62.4-52000110.7Y51 R52 T100 R105 K106 I107Y51-D103 HydrophobicContact CD1-CB 4.35Å; R52-D103 HydrophobicContact CB-CB 4.34Å; R52-D103 WeakPolarHBondContact CB-OD1 3.48Å; R52-D103 WeakPolarHBondContact CD-OD1 3.29Å; T100-D103 WeakPolarHBondContact CB-OD2 3.38Å; T100-D103 WeakPolarHBondContact CG2-OD2 3.2Å; T100-D103 PolarHBondContact N-OD2 2.84Å; T100-D103 PolarHBondContact O-N 3.3Å; T100-D103 PolarHBondContact OG1-N 2.95Å; T100-D103 PolarHBondContact OG1-OD2 3.47Å; D103-R105 VanDerWaalsContact C-N 3.31Å; D103-R105 PolarHBondContact O-N 2.74Å; D103-K106 PolarHBondContact O-N 3.03Å; D103-I107 HydrophobicContact CB-CD1 4.32Å; D103-I107 WeakPolarHBondContact O-CB 3.5Å; D103-I107 WeakPolarHBondContact O-CD1 3.37Å; D103-I107 VanDerWaalsContact O-CG1 3.24Å; D103-I107 WeakPolarHBondContact O-CG1 3.27Å; D103-I107 PolarHBondContact O-N 3.05Å
104L86.4Confident82.4Confident40 Ų4081 Ų8121%0.20939%0.392CS..Hα-helixtrans-57.5-42.5178.5-72.3164.7000111.9Y51 A99 T100 L108Y51-L104 HydrophobicContact CE1-CD2 3.67Å; Y51-L104 HydrophobicContact CE1-CG 4.29Å; A99-L104 HydrophobicContact CB-CD1 4.08Å; A99-L104 HydrophobicContact CB-CD2 4.13Å; A99-L104 HydrophobicContact CB-CG 3.94Å; T100-L104 WeakPolarHBondContact O-CG 3.44Å; T100-L104 PolarHBondContact O-N 3.11Å; T100-L104 VanDerWaalsContact O-N 3.1Å; L104-L108 WeakPolarHBondContact O-CB 3.31Å; L104-L108 VanDerWaalsContact O-CG 3.26Å; L104-L108 WeakPolarHBondContact O-CG 3.27Å; L104-L108 PolarHBondContact O-N 2.88Å
105R86.9Confident84Confident164 Ų16477.3 Ų77.362%0.61937%0.368SS*.Hα-helixtrans-62.7-53.2174.1-72.9-173.3-57.7-142.96.8111.8K101 Q102 D103 I107 L108 E109K101-R105 WeakPolarHBondContact O-CG 3.38Å; K101-R105 PolarHBondContact O-N 3.29Å; Q102-R105 PolarHBondContact O-N 2.97Å; D103-R105 VanDerWaalsContact C-N 3.31Å; D103-R105 PolarHBondContact O-N 2.74Å; R105-I107 PolarHBondContact O-N 3.31Å; R105-L108 PolarHBondContact O-N 3.46Å; R105-E109 VanDerWaalsContact O-CB 3.28Å; R105-E109 WeakPolarHBondContact O-CB 3.38Å; R105-E109 PolarHBondContact O-N 3.29Å
106K87.3Confident85.6Confident79 Ų7969.7 Ų69.734%0.34334%0.342SS..Hα-helixtrans-58-34.2179.7-73.4-179.9173.3177.70112.1Q102 D103 A110Q102-K106 HydrophobicContact CG-CD 4.42Å; Q102-K106 PolarHBondContact O-N 3.46Å; D103-K106 PolarHBondContact O-N 3.03Å; K106-A110 WeakPolarHBondContact O-CB 3.02Å; K106-A110 PolarHBondContact O-N 2.78Å
107I87.6Confident86.8Confident7 Ų770.7 Ų70.74%0.03635%0.346CS..Hα-helixtrans-74.3-46.3177.8-72.4160.8000111.6Y51 E55 M59 D103 R105 A110 Q111Y51-I107 HydrophobicContact CD1-CD1 3.77Å; Y51-I107 HydrophobicContact CE1-CD1 3.36Å; E55-I107 HydrophobicContact CB-CD1 3.71Å; E55-I107 HydrophobicContact CB-CG1 4.13Å; E55-I107 HydrophobicContact CB-CG2 4.29Å; E55-I107 HydrophobicContact CG-CD1 4.03Å; E55-I107 HydrophobicContact CG-CG2 4.46Å; M59-I107 HydrophobicContact CE-CB 4.34Å; M59-I107 HydrophobicContact CE-CG1 4Å; M59-I107 HydrophobicContact CE-CG2 4.07Å; M59-I107 HydrophobicContact SD-CG2 3.92Å; D103-I107 HydrophobicContact CB-CD1 4.32Å; D103-I107 WeakPolarHBondContact O-CB 3.5Å; D103-I107 WeakPolarHBondContact O-CD1 3.37Å; D103-I107 VanDerWaalsContact O-CG1 3.24Å; D103-I107 WeakPolarHBondContact O-CG1 3.27Å; D103-I107 PolarHBondContact O-N 3.05Å; R105-I107 PolarHBondContact O-N 3.31Å; I107-A110 PolarHBondContact O-N 3.04Å; I107-Q111 VanDerWaalsContact O-CG 3.29Å; I107-Q111 WeakPolarHBondContact O-CG 3.39Å; I107-Q111 PolarHBondContact O-N 2.86Å
108L87.9Confident88Confident98 Ų9864.7 Ų64.751%0.51331%0.307SS..Hα-helixtrans-65.5-39.6177.9-70.4168.4000111.8L104 R105 Q111 E112L104-L108 WeakPolarHBondContact O-CB 3.31Å; L104-L108 VanDerWaalsContact O-CG 3.26Å; L104-L108 WeakPolarHBondContact O-CG 3.27Å; L104-L108 PolarHBondContact O-N 2.88Å; R105-L108 PolarHBondContact O-N 3.46Å; L108-Q111 PolarHBondContact O-N 3.06Å; L108-E112 WeakPolarHBondContact O-CB 3.25Å; L108-E112 PolarHBondContact O-N 3.5Å
109E89.4Confident89.1Confident128 Ų12861.5 Ų61.560%0.59829%0.293SS*.Hα-helixtrans-61-43.1174.3-173.8-179.6172.100112R105 T113R105-E109 VanDerWaalsContact O-CB 3.28Å; R105-E109 WeakPolarHBondContact O-CB 3.38Å; R105-E109 PolarHBondContact O-N 3.29Å; E109-T113 WeakPolarHBondContact O-CB 3.26Å; E109-T113 VanDerWaalsContact O-CG2 3.27Å; E109-T113 WeakPolarHBondContact O-CG2 3.2Å; E109-T113 PolarHBondContact O-N 2.82Å; E109-T113 PolarHBondContact O-OG1 3Å
110A88.5Confident89.6Confident5 Ų565.8 Ų65.84%0.04131%0.309CS..Hα-helixtrans-62-41.417400000112.8M59 K106 I107 T113 F114 H256 F257M59-A110 HydrophobicContact CE-CB 4.39Å; M59-A110 HydrophobicContact SD-CB 4.39Å; K106-A110 WeakPolarHBondContact O-CB 3.02Å; K106-A110 PolarHBondContact O-N 2.78Å; I107-A110 PolarHBondContact O-N 3.04Å; A110-T113 PolarHBondContact O-OG1 3.23Å; A110-F114 WeakPolarHBondContact O-CB 3.44Å; A110-F114 PolarHBondContact O-N 3.43Å; A110-H256 WeakPolarHBondContact CB-O 3.21Å; A110-F257 HydrophobicContact CB-CD1 3.91Å; A110-F257 HydrophobicContact CB-CE1 4.06Å
111Q89.7Confident90Very high41 Ų4162.8 Ų62.819%0.19229%0.29CS..Hα-helixtrans-68.5-48.6179.1-68.5176.211.900111.7M59 F87 I107 L108 F114 Y115M59-Q111 HydrophobicContact CG-CG 4.31Å; M59-Q111 HydrophobicContact SD-CG 3.44Å; M59-Q111 WeakPolarHBondContact SD-CG 3.43Å; M59-Q111 PolarHBondContact SD-NE2 3Å; F87-Q111 HydrophobicContact CD1-CB 4.08Å; F87-Q111 HydrophobicContact CD1-CG 3.86Å; F87-Q111 HydrophobicContact CE1-CG 4.09Å; I107-Q111 VanDerWaalsContact O-CG 3.29Å; I107-Q111 WeakPolarHBondContact O-CG 3.39Å; I107-Q111 PolarHBondContact O-N 2.86Å; L108-Q111 PolarHBondContact O-N 3.06Å; Q111-F114 PolarHBondContact O-N 3.43Å; Q111-Y115 VanDerWaalsContact O-CB 3.31Å; Q111-Y115 WeakPolarHBondContact O-CB 3.24Å; Q111-Y115 PolarHBondContact O-N 3.23Å
112E89.5Confident90.3Very high95 Ų9555.5 Ų55.544%0.44426%0.262SS..Hα-helixtrans-63.5-47.1-179.4-177.957.8-149.400111.4L108 F114 Y115 Q116L108-E112 WeakPolarHBondContact O-CB 3.25Å; L108-E112 PolarHBondContact O-N 3.5Å; E112-F114 PolarHBondContact O-N 2.85Å; E112-Y115 WeakPolarHBondContact O-CB 3.48Å; E112-Y115 PolarHBondContact O-N 3.14Å; E112-Y115 VanDerWaalsContact O-N 3.17Å; E112-Q116 WeakPolarHBondContact O-CG 3.44Å; E112-Q116 PolarHBondContact O-N 2.77Å; E112-Q116 WeakPolarHBondContact OE1-CG 3.37Å; E112-Q116 PolarHBondContact OE1-NE2 3.37Å
113T91.3Very high90.6Very high57 Ų5757.3 Ų57.335%0.3527%0.27SS..Hα-helixtrans-66.4-35.4-178.655.50000112.5E109 A110 Q117 H256E109-T113 WeakPolarHBondContact O-CB 3.26Å; E109-T113 VanDerWaalsContact O-CG2 3.27Å; E109-T113 WeakPolarHBondContact O-CG2 3.2Å; E109-T113 PolarHBondContact O-N 2.82Å; E109-T113 PolarHBondContact O-OG1 3Å; A110-T113 PolarHBondContact O-OG1 3.23Å; T113-Q117 WeakPolarHBondContact O-CB 3.44Å; T113-Q117 PolarHBondContact O-N 3.2Å; T113-H256 VanDerWaalsContact CB-ND1 3.25Å; T113-H256 WeakPolarHBondContact CB-ND1 3.44Å; T113-H256 PolarHBondContact OG1-ND1 3.03Å
114F93.2Very high90.4Very high0 Ų059.6 Ų59.60%029%0.292CS..Hα-helixtrans-68.8-40.3170.5178.4-110.3000112.6A63 V66 V67 L83 F87 A110 Q111 E112 Q116 Q117 V118 Y139 F257A63-F114 HydrophobicContact CB-CD1 4.4Å; A63-F114 HydrophobicContact CB-CE1 3.94Å; A63-F114 HydrophobicContact CB-CE2 4.11Å; A63-F114 HydrophobicContact CB-CZ 3.78Å; V66-F114 HydrophobicContact CB-CE1 4.24Å; V66-F114 HydrophobicContact CB-CZ 4.04Å; V66-F114 HydrophobicContact CG1-CE1 4.32Å; V66-F114 HydrophobicContact CG1-CZ 4.08Å; V67-F114 HydrophobicContact CG2-CE2 4Å; V67-F114 HydrophobicContact CG2-CZ 4.14Å; L83-F114 HydrophobicContact CD1-CD1 4.18Å; L83-F114 HydrophobicContact CD1-CE1 3.86Å; F87-F114 HydrophobicContact CD2-CD1 4.19Å; F87-F114 HydrophobicContact CD2-CE1 4.14Å; F87-F114 HydrophobicContact CE1-CD1 4.3Å; F87-F114 AromaticContact CE2-CD1 3.78Å; F87-F114 HydrophobicContact CE2-CD1 3.78Å; F87-F114 AromaticContact CE2-CE1 3.57Å; F87-F114 HydrophobicContact CE2-CE1 3.57Å; F87-F114 AromaticContact CZ-CD1 3.84Å; F87-F114 HydrophobicContact CZ-CD1 3.84Å; F87-F114 AromaticContact CZ-CE1 3.96Å; F87-F114 HydrophobicContact CZ-CE1 3.96Å; A110-F114 WeakPolarHBondContact O-CB 3.44Å; A110-F114 PolarHBondContact O-N 3.43Å; Q111-F114 PolarHBondContact O-N 3.43Å; E112-F114 PolarHBondContact O-N 2.85Å; F114-Q116 PolarHBondContact O-N 3.06Å; F114-Q117 WeakPolarHBondContact O-CB 3.36Å; F114-Q117 PolarHBondContact O-N 3.3Å; F114-V118 HydrophobicContact CD2-CG2 4.25Å; F114-V118 HydrophobicContact CE1-CG2 4.07Å; F114-V118 HydrophobicContact CE2-CG2 3.74Å; F114-V118 HydrophobicContact CZ-CG2 3.63Å; F114-V118 PolarHBondContact O-N 2.71Å; F114-Y139 AromaticContact CD2-CZ 3.87Å; F114-Y139 WeakPolarHBondContact CD2-OH 3.39Å; F114-Y139 HydrophobicContact CE2-CE1 4.27Å; F114-Y139 HydrophobicContact CE2-CE2 4.27Å; F114-Y139 AromaticContact CE2-CZ 3.82Å; F114-F257 HydrophobicContact CB-CE2 3.94Å; F114-F257 HydrophobicContact CB-CZ 3.56Å; F114-F257 HydrophobicContact CD1-CE2 4.39Å; F114-F257 AromaticContact CD1-CZ 3.97Å; F114-F257 HydrophobicContact CD1-CZ 3.97Å; F114-F257 AromaticContact CD2-CE2 3.92Å; F114-F257 HydrophobicContact CD2-CE2 3.92Å; F114-F257 HydrophobicContact CD2-CZ 4.25Å; F114-F257 AromaticContact CG-CE2 3.82Å; F114-F257 HydrophobicContact CG-CE2 3.82Å; F114-F257 AromaticContact CG-CZ 3.66Å; F114-F257 HydrophobicContact CG-CZ 3.66Å
115Y92.8Very high90.2Very high16 Ų1659.2 Ų59.26%0.06329%0.292CS..Hα-helixtrans-59.9-47177.3-173.9-94.9000111.2L83 N84 F87 E89 Q111 E112 V118 K119L83-Y115 HydrophobicContact CD1-CD2 4.01Å; L83-Y115 HydrophobicContact CD2-CD2 3.46Å; L83-Y115 VanDerWaalsContact CD2-CD2 3.46Å; L83-Y115 HydrophobicContact CD2-CE2 3.47Å; L83-Y115 VanDerWaalsContact CD2-CE2 3.47Å; L83-Y115 HydrophobicContact CD2-CG 4.2Å; L83-Y115 HydrophobicContact CG-CD2 3.53Å; L83-Y115 HydrophobicContact CG-CE2 3.68Å; N84-Y115 PolarHBondContact ND2-OH 3.35Å; N84-Y115 VanDerWaalsContact ND2-OH 3.14Å; N84-Y115 PolarHBondContact OD1-OH 2.81Å; F87-Y115 HydrophobicContact CB-CD2 4.31Å; E89-Y115 VanDerWaalsContact CD-OH 3.26Å; E89-Y115 HydrophobicContact CG-CE1 3.78Å; E89-Y115 HydrophobicContact CG-CE2 4.24Å; E89-Y115 WeakPolarHBondContact CG-OH 3.49Å; E89-Y115 WeakPolarHBondContact OE1-CE1 3.18Å; E89-Y115 PolarHBondContact OE1-OH 3.38Å; Q111-Y115 VanDerWaalsContact O-CB 3.31Å; Q111-Y115 WeakPolarHBondContact O-CB 3.24Å; Q111-Y115 PolarHBondContact O-N 3.23Å; E112-Y115 WeakPolarHBondContact O-CB 3.48Å; E112-Y115 PolarHBondContact O-N 3.14Å; E112-Y115 VanDerWaalsContact O-N 3.17Å; Y115-V118 PolarHBondContact O-N 3.23Å; Y115-K119 WeakPolarHBondContact O-CB 3.41Å; Y115-K119 PolarHBondContact O-N 3.38Å
116Q92.3Very high90.1Very high62 Ų6259.1 Ų59.129%0.2931%0.31SS..Hα-helixtrans-67.6-36.7175.4-60.3-59.6-19.600112.5E112 F114 V118 K119 Q120E112-Q116 WeakPolarHBondContact O-CG 3.44Å; E112-Q116 PolarHBondContact O-N 2.77Å; E112-Q116 WeakPolarHBondContact OE1-CG 3.37Å; E112-Q116 PolarHBondContact OE1-NE2 3.37Å; F114-Q116 PolarHBondContact O-N 3.06Å; Q116-V118 PolarHBondContact O-N 2.84Å; Q116-K119 PolarHBondContact O-N 3.07Å; Q116-Q120 WeakPolarHBondContact O-CB 3.41Å; Q116-Q120 VanDerWaalsContact O-CG 3.26Å; Q116-Q120 WeakPolarHBondContact O-CG 3.44Å; Q116-Q120 PolarHBondContact O-N 3.04Å
117Q93.3Very high90.3Very high40 Ų4058.6 Ų58.619%0.18731%0.311CS..Hα-helixtrans-55.9-51.4173.2-173.2-172.938.500110.7T113 F114 Q120 L121 E138 Y139 H256T113-Q117 WeakPolarHBondContact O-CB 3.44Å; T113-Q117 PolarHBondContact O-N 3.2Å; F114-Q117 WeakPolarHBondContact O-CB 3.36Å; F114-Q117 PolarHBondContact O-N 3.3Å; Q117-Q120 PolarHBondContact O-N 3.33Å; Q117-L121 WeakPolarHBondContact O-CG 3.5Å; Q117-L121 PolarHBondContact O-N 3.17Å; Q117-E138 PolarHBondContact NE2-OE2 3.21Å; Q117-Y139 PolarHBondContact OE1-OH 2.91Å; Q117-H256 PolarHBondContact NE2-NE2 2.97Å; Q117-H256 PolarHBondContact OE1-CD2 2.92Å
118V93.9Very high90.4Very high0 Ų060.3 Ų60.30%032%0.32CS..Hα-helixtrans-67.9-37.4179.7176.20000112.2V66 I70 V79 L83 F114 Y115 Q116 L121 S122V66-V118 HydrophobicContact CG1-CG1 4.07Å; V66-V118 HydrophobicContact CG1-CG2 4.04Å; I70-V118 HydrophobicContact CD1-CG1 3.89Å; I70-V118 HydrophobicContact CD1-CG2 4.1Å; V79-V118 HydrophobicContact CG1-CG1 3.93Å; L83-V118 HydrophobicContact CD1-CB 4.13Å; L83-V118 HydrophobicContact CD1-CG1 4.29Å; L83-V118 HydrophobicContact CD1-CG2 4.25Å; L83-V118 HydrophobicContact CD2-CB 3.95Å; L83-V118 HydrophobicContact CD2-CG1 3.81Å; L83-V118 HydrophobicContact CG-CG1 4.49Å; F114-V118 HydrophobicContact CD2-CG2 4.25Å; F114-V118 HydrophobicContact CE1-CG2 4.07Å; F114-V118 HydrophobicContact CE2-CG2 3.74Å; F114-V118 HydrophobicContact CZ-CG2 3.63Å; F114-V118 PolarHBondContact O-N 2.71Å; Y115-V118 PolarHBondContact O-N 3.23Å; Q116-V118 PolarHBondContact O-N 2.84Å; V118-L121 PolarHBondContact O-N 2.84Å; V118-S122 PolarHBondContact O-N 3.42Å; V118-S122 VanDerWaalsContact O-N 3.16Å
119K93.1Very high90.6Very high73 Ų7359.5 Ų59.532%0.31733%0.327SS..Hα-helixtrans-62-48.2176.3-173.6175.9177.8177.60111.8Y115 Q116 L121 S122 E123Y115-K119 WeakPolarHBondContact O-CB 3.41Å; Y115-K119 PolarHBondContact O-N 3.38Å; Q116-K119 PolarHBondContact O-N 3.07Å; K119-L121 VanDerWaalsContact C-N 3.28Å; K119-L121 PolarHBondContact O-N 3.09Å; K119-S122 WeakPolarHBondContact O-CA 3.35Å; K119-S122 WeakPolarHBondContact O-CB 3.4Å; K119-S122 PolarHBondContact O-N 3.06Å; K119-S122 PolarHBondContact O-OG 2.99Å; K119-E123 PolarHBondContact O-N 3.21Å
120Q93Very high90.7Very high113 Ų11356.7 Ų56.753%0.52832%0.322SS..Hα-helixtrans-62.6-31.3177.6-71.317216.300113.2Q116 Q117 P125Q116-Q120 WeakPolarHBondContact O-CB 3.41Å; Q116-Q120 VanDerWaalsContact O-CG 3.26Å; Q116-Q120 WeakPolarHBondContact O-CG 3.44Å; Q116-Q120 PolarHBondContact O-N 3.04Å; Q117-Q120 PolarHBondContact O-N 3.33Å; Q120-P125 WeakPolarHBondContact O-CD 3.46Å
121L93.9Very high90.9Very high7 Ų759.9 Ų59.94%0.03734%0.335CS..Hα-helixtrans-67.6-36.3171.5-67.3169.3000112W76 Q117 V118 K119 E123 A124 P125 L128 K131 L135W76-L121 HydrophobicContact CH2-CB 3.59Å; W76-L121 HydrophobicContact CZ2-CB 4.24Å; W76-L121 WeakPolarHBondContact CZ2-O 3.24Å; W76-L121 HydrophobicContact CZ3-CB 4.24Å; Q117-L121 WeakPolarHBondContact O-CG 3.5Å; Q117-L121 PolarHBondContact O-N 3.17Å; V118-L121 PolarHBondContact O-N 2.84Å; K119-L121 VanDerWaalsContact C-N 3.28Å; K119-L121 PolarHBondContact O-N 3.09Å; L121-E123 VanDerWaalsContact C-N 3.26Å; L121-E123 PolarHBondContact O-N 3.4Å; L121-A124 PolarHBondContact O-N 3.22Å; L121-P125 WeakPolarHBondContact O-CD 3.31Å; L121-L128 HydrophobicContact CB-CD1 4.33Å; L121-L128 HydrophobicContact CD2-CD1 3.85Å; L121-K131 HydrophobicContact CD2-CB 3.6Å; L121-K131 HydrophobicContact CD2-CD 4.26Å; L121-L135 HydrophobicContact CD1-CD1 4.32Å; L121-L135 HydrophobicContact CD1-CD2 3.84Å
122S93.7Very high91.1Very high25 Ų2560 Ų6018%0.17534%0.337CS..Hα-helixtrans-71-19.9-179.378.80000114.4W76 V118 K119 A124W76-S122 VanDerWaalsContact CE3-CB 3.4Å; V118-S122 PolarHBondContact O-N 3.42Å; V118-S122 VanDerWaalsContact O-N 3.16Å; K119-S122 WeakPolarHBondContact O-CA 3.35Å; K119-S122 WeakPolarHBondContact O-CB 3.4Å; K119-S122 PolarHBondContact O-N 3.06Å; K119-S122 PolarHBondContact O-OG 2.99Å; S122-A124 PolarHBondContact O-N 2.87Å
123E93.2Very high91.3Very high129 Ų12961.1 Ų61.160%0.60334%0.342SS*.THydrogen-bonded Turntrans-78.910177-68.3168.6-174.100113K119 L121K119-E123 PolarHBondContact O-N 3.21Å; L121-E123 VanDerWaalsContact C-N 3.26Å; L121-E123 PolarHBondContact O-N 3.4Å
124A82.5Confident91.3Very high72 Ų7264.1 Ų64.160%0.59535%0.352SS*.  trans52.957.6176.300000114.7L121 S122L121-A124 PolarHBondContact O-N 3.22Å; S122-A124 PolarHBondContact O-N 2.87Å
125P82.4Confident91.3Very high32 Ų3264.2 Ų64.221%0.20835%0.352CS..  trans-68.5154-176.932.1-37.8000112.2Q120 L121 D127 L128 K131Q120-P125 WeakPolarHBondContact O-CD 3.46Å; L121-P125 WeakPolarHBondContact O-CD 3.31Å; P125-D127 WeakPolarHBondContact CB-OD1 3.26Å; P125-D127 PolarHBondContact O-N 3.09Å; P125-L128 HydrophobicContact CG-CB 4.16Å; P125-L128 HydrophobicContact CG-CD1 4.44Å; P125-L128 VanDerWaalsContact O-CB 3.23Å; P125-L128 WeakPolarHBondContact O-CB 3.44Å; P125-L128 PolarHBondContact O-N 2.78Å; P125-K131 HydrophobicContact CG-CD 4.29Å
126V83.9Confident91.3Very high162 Ų16268.8 Ų68.898%0.98237%0.374SS*.THydrogen-bonded Turntrans-57.7-27.3-174.4-178.10000113.3
127D90.4Very high91.3Very high68 Ų6871.8 Ų71.836%0.36439%0.388SS..THydrogen-bonded Turntrans-102.716.8-17960.4-13.3000113.6P125 A129 S130 K131P125-D127 WeakPolarHBondContact CB-OD1 3.26Å; P125-D127 PolarHBondContact O-N 3.09Å; D127-A129 VanDerWaalsContact C-N 3.27Å; D127-A129 PolarHBondContact O-N 2.74Å; D127-A129 VanDerWaalsContact O-N 3.13Å; D127-S130 WeakPolarHBondContact O-CB 3.43Å; D127-S130 PolarHBondContact O-N 3.05Å; D127-K131 VanDerWaalsContact CG-CE 3.48Å; D127-K131 PolarHBondContact O-N 2.87Å; D127-K131 VanDerWaalsContact O-N 3.1Å; D127-K131 WeakPolarHBondContact OD1-CD 3.46Å; D127-K131 WeakPolarHBondContact OD1-CE 3.19Å; D127-K131 IonicContact OD1-NZ 2.73Å; D127-K131 PolarHBondContact OD1-NZ 3.49Å; D127-K131 WeakPolarHBondContact OD2-CE 3.27Å; D127-K131 IonicContact OD2-NZ 2.83Å; D127-K131 PolarHBondContact OD2-NZ 2.89Å
128L91.4Very high91.2Very high43 Ų4370.5 Ų70.523%0.22538%0.382CS..Hα-helixtrans-49.2-42.9-174.9177.361.7000113.5W76 L121 P125 S130 K131 L132W76-L128 HydrophobicContact CZ2-CD1 4.45Å; L121-L128 HydrophobicContact CB-CD1 4.33Å; L121-L128 HydrophobicContact CD2-CD1 3.85Å; P125-L128 HydrophobicContact CG-CB 4.16Å; P125-L128 HydrophobicContact CG-CD1 4.44Å; P125-L128 VanDerWaalsContact O-CB 3.23Å; P125-L128 WeakPolarHBondContact O-CB 3.44Å; P125-L128 PolarHBondContact O-N 2.78Å; L128-S130 VanDerWaalsContact C-N 3.35Å; L128-S130 PolarHBondContact O-N 3.38Å; L128-K131 PolarHBondContact O-N 3.16Å; L128-L132 HydrophobicContact CD1-CD1 4.03Å; L128-L132 HydrophobicContact CD1-CD2 4.22Å; L128-L132 HydrophobicContact CD1-CG 3.84Å; L128-L132 HydrophobicContact CG-CD1 3.96Å; L128-L132 HydrophobicContact CG-CG 4.2Å; L128-L132 WeakPolarHBondContact O-CB 3.35Å; L128-L132 VanDerWaalsContact O-CG 3.28Å; L128-L132 WeakPolarHBondContact O-CG 3.28Å; L128-L132 PolarHBondContact O-N 3.24Å
129A91.1Very high91.3Very high82 Ų8270.5 Ų70.568%0.67838%0.382SS*.Hα-helixtrans-60.1-42.2-179.900000112.8D127 Q133D127-A129 VanDerWaalsContact C-N 3.27Å; D127-A129 PolarHBondContact O-N 2.74Å; D127-A129 VanDerWaalsContact O-N 3.13Å; A129-Q133 PolarHBondContact O-N 3.04Å
130S91.9Very high91.3Very high69 Ų6967.7 Ų67.748%0.48337%0.374SS..Hα-helixtrans-66.9-45.3175.8-52.30000111D127 L128 L132 Q133 E134D127-S130 WeakPolarHBondContact O-CB 3.43Å; D127-S130 PolarHBondContact O-N 3.05Å; L128-S130 VanDerWaalsContact C-N 3.35Å; L128-S130 PolarHBondContact O-N 3.38Å; S130-L132 VanDerWaalsContact C-N 3.31Å; S130-L132 PolarHBondContact O-N 3.37Å; S130-Q133 WeakPolarHBondContact O-CB 3.41Å; S130-Q133 PolarHBondContact O-N 3.13Å; S130-Q133 VanDerWaalsContact O-N 3.1Å; S130-E134 PolarHBondContact O-N 2.9Å
131K91.9Very high91.3Very high71 Ų7167.1 Ų67.131%0.30937%0.372SS..Hα-helixtrans-64.6-33179.3-71.3178.3166.4146.40113.3L121 P125 D127 L128 E134 L135L121-K131 HydrophobicContact CD2-CB 3.6Å; L121-K131 HydrophobicContact CD2-CD 4.26Å; P125-K131 HydrophobicContact CG-CD 4.29Å; D127-K131 VanDerWaalsContact CG-CE 3.48Å; D127-K131 PolarHBondContact O-N 2.87Å; D127-K131 VanDerWaalsContact O-N 3.1Å; D127-K131 WeakPolarHBondContact OD1-CD 3.46Å; D127-K131 WeakPolarHBondContact OD1-CE 3.19Å; D127-K131 IonicContact OD1-NZ 2.73Å; D127-K131 PolarHBondContact OD1-NZ 3.49Å; D127-K131 WeakPolarHBondContact OD2-CE 3.27Å; D127-K131 IonicContact OD2-NZ 2.83Å; D127-K131 PolarHBondContact OD2-NZ 2.89Å; L128-K131 PolarHBondContact O-N 3.16Å; K131-E134 PolarHBondContact O-N 3.4Å; K131-L135 WeakPolarHBondContact O-CB 3.33Å; K131-L135 PolarHBondContact O-N 2.97Å
132L93.9Very high91.4Very high45 Ų4569.5 Ų69.524%0.23639%0.388CS..Hα-helixtrans-67.3-37.3172.3-71.4177.6000111.9I70 L128 S130 L135 E136I70-L132 HydrophobicContact CG2-CD2 3.32Å; L128-L132 HydrophobicContact CD1-CD1 4.03Å; L128-L132 HydrophobicContact CD1-CD2 4.22Å; L128-L132 HydrophobicContact CD1-CG 3.84Å; L128-L132 HydrophobicContact CG-CD1 3.96Å; L128-L132 HydrophobicContact CG-CG 4.2Å; L128-L132 WeakPolarHBondContact O-CB 3.35Å; L128-L132 VanDerWaalsContact O-CG 3.28Å; L128-L132 WeakPolarHBondContact O-CG 3.28Å; L128-L132 PolarHBondContact O-N 3.24Å; S130-L132 VanDerWaalsContact C-N 3.31Å; S130-L132 PolarHBondContact O-N 3.37Å; L132-L135 HydrophobicContact CD2-CD2 4.48Å; L132-L135 PolarHBondContact O-N 3.46Å; L132-E136 PolarHBondContact O-N 3.46Å
133Q93.8Very high91.4Very high118 Ų11868.3 Ų68.355%0.55138%0.379SS*.Hα-helixtrans-69-36.5174.1-169.1178.719.800112.2A129 S130 Q137A129-Q133 PolarHBondContact O-N 3.04Å; S130-Q133 WeakPolarHBondContact O-CB 3.41Å; S130-Q133 PolarHBondContact O-N 3.13Å; S130-Q133 VanDerWaalsContact O-N 3.1Å; Q133-Q137 WeakPolarHBondContact O-CG 3.22Å; Q133-Q137 PolarHBondContact O-N 3.36Å
134E91.9Very high91.5Very high119 Ų11962.5 Ų62.556%0.55635%0.352SS*.Hα-helixtrans-64.7-42.3171.4-71.5-179.2-159.800111.6S130 K131 Q137 E138S130-E134 PolarHBondContact O-N 2.9Å; K131-E134 PolarHBondContact O-N 3.4Å; E134-Q137 PolarHBondContact O-N 2.94Å; E134-E138 WeakPolarHBondContact O-CB 3.48Å; E134-E138 PolarHBondContact O-N 2.94Å
135L92.3Very high92.1Very high2 Ų261.2 Ų61.21%0.0134%0.341CS..Hα-helixtrans-63.1-41.9176-168.378.4000112.1V67 I70 L121 K131 L132 Q137 E138 Y139V67-L135 HydrophobicContact CB-CD2 4.48Å; V67-L135 HydrophobicContact CG1-CD2 3.94Å; V67-L135 HydrophobicContact CG1-CG 3.97Å; V67-L135 HydrophobicContact CG2-CD1 4.12Å; V67-L135 HydrophobicContact CG2-CD2 4.12Å; V67-L135 HydrophobicContact CG2-CG 4.09Å; I70-L135 HydrophobicContact CB-CD2 4.45Å; I70-L135 HydrophobicContact CD1-CD2 4.06Å; I70-L135 HydrophobicContact CG2-CD2 4.11Å; L121-L135 HydrophobicContact CD1-CD1 4.32Å; L121-L135 HydrophobicContact CD1-CD2 3.84Å; K131-L135 WeakPolarHBondContact O-CB 3.33Å; K131-L135 PolarHBondContact O-N 2.97Å; L132-L135 HydrophobicContact CD2-CD2 4.48Å; L132-L135 PolarHBondContact O-N 3.46Å; L135-Q137 VanDerWaalsContact C-N 3.32Å; L135-Q137 PolarHBondContact O-N 3.28Å; L135-E138 PolarHBondContact O-N 3.31Å; L135-Y139 HydrophobicContact CD1-CD2 3.78Å; L135-Y139 HydrophobicContact CD1-CE2 3.66Å; L135-Y139 HydrophobicContact CG-CD2 4.15Å; L135-Y139 WeakPolarHBondContact O-CD2 3.49Å; L135-Y139 PolarHBondContact O-N 3.48Å; L135-Y139 VanDerWaalsContact O-N 3.08Å
136E93.1Very high92.7Very high112 Ų11260.4 Ų60.452%0.52334%0.337SS..Hα-helixtrans-60.6-41.1175-175.7179.6-159.500111.7L71 L132 G140L71-E136 HydrophobicContact CD1-CB 4.12Å; L71-E136 HydrophobicContact CD1-CG 4.1Å; L71-E136 HydrophobicContact CD2-CB 4.06Å; L132-E136 PolarHBondContact O-N 3.46Å; E136-G140 WeakPolarHBondContact O-CA 3.5Å; E136-G140 PolarHBondContact O-N 3.05Å
137Q92.6Very high93.2Very high126 Ų12652.7 Ų52.759%0.58929%0.29SS*.Hα-helixtrans-70.6-43.5177.3-70.6175.639.200112.3Q133 E134 L135 Y139 G140Q133-Q137 WeakPolarHBondContact O-CG 3.22Å; Q133-Q137 PolarHBondContact O-N 3.36Å; E134-Q137 PolarHBondContact O-N 2.94Å; L135-Q137 VanDerWaalsContact C-N 3.32Å; L135-Q137 PolarHBondContact O-N 3.28Å; Q137-Y139 VanDerWaalsContact C-N 3.32Å; Q137-Y139 PolarHBondContact O-N 3.44Å; Q137-G140 PolarHBondContact O-N 3.27Å
138E92Very high93.5Very high12 Ų1250.6 Ų50.66%0.05628%0.279CS..Hα-helixtrans-62.3-38.9-179.2178.9169.3-14600112.3Q117 E134 L135 F143 L252 G254 R255 H256Q117-E138 PolarHBondContact NE2-OE2 3.21Å; E134-E138 WeakPolarHBondContact O-CB 3.48Å; E134-E138 PolarHBondContact O-N 2.94Å; L135-E138 PolarHBondContact O-N 3.31Å; E138-F143 WeakPolarHBondContact O-CB 3.47Å; E138-L252 WeakPolarHBondContact CA-O 3.17Å; E138-G254 PolarHBondContact O-N 2.99Å; E138-R255 WeakPolarHBondContact OE1-CA 3.47Å; E138-R255 WeakPolarHBondContact OE1-CB 3.32Å; E138-R255 WeakPolarHBondContact OE1-CG 3.41Å; E138-R255 PolarHBondContact OE1-N 2.92Å; E138-H256 IonicContact OE1-CD2 3.38Å; E138-H256 PolarHBondContact OE1-CD2 2.77Å; E138-H256 IonicContact OE2-CD2 3.71Å
139Y94.9Very high93.7Very high0 Ų051.1 Ų51.10%028%0.279CS..THydrogen-bonded Turntrans-106.826.3-179.5-62-88.2000112.6A63 K64 V67 F114 Q117 L135 Q137 F143 F257A63-Y139 HydrophobicContact CB-CD1 4.42Å; A63-Y139 HydrophobicContact CB-CE1 3.92Å; K64-Y139 PolarHBondContact NZ-O 3.34Å; V67-Y139 HydrophobicContact CG1-CG 4.46Å; V67-Y139 HydrophobicContact CG2-CD1 4.25Å; V67-Y139 HydrophobicContact CG2-CD2 3.83Å; V67-Y139 HydrophobicContact CG2-CE2 4.26Å; V67-Y139 HydrophobicContact CG2-CG 3.85Å; F114-Y139 AromaticContact CD2-CZ 3.87Å; F114-Y139 WeakPolarHBondContact CD2-OH 3.39Å; F114-Y139 HydrophobicContact CE2-CE1 4.27Å; F114-Y139 HydrophobicContact CE2-CE2 4.27Å; F114-Y139 AromaticContact CE2-CZ 3.82Å; Q117-Y139 PolarHBondContact OE1-OH 2.91Å; L135-Y139 HydrophobicContact CD1-CD2 3.78Å; L135-Y139 HydrophobicContact CD1-CE2 3.66Å; L135-Y139 HydrophobicContact CG-CD2 4.15Å; L135-Y139 WeakPolarHBondContact O-CD2 3.49Å; L135-Y139 PolarHBondContact O-N 3.48Å; L135-Y139 VanDerWaalsContact O-N 3.08Å; Q137-Y139 VanDerWaalsContact C-N 3.32Å; Q137-Y139 PolarHBondContact O-N 3.44Å; Y139-F143 HydrophobicContact CD1-CD1 4.33Å; Y139-F143 AromaticContact CD1-CD2 3.91Å; Y139-F143 HydrophobicContact CD1-CD2 3.91Å; Y139-F143 HydrophobicContact CD1-CE1 4Å; Y139-F143 AromaticContact CD1-CE2 3.5Å; Y139-F143 HydrophobicContact CD1-CE2 3.5Å; Y139-F143 VanDerWaalsContact CD1-CE2 3.5Å; Y139-F143 HydrophobicContact CD1-CG 4.3Å; Y139-F143 AromaticContact CD1-CZ 3.55Å; Y139-F143 HydrophobicContact CD1-CZ 3.55Å; Y139-F143 HydrophobicContact CE1-CD2 4.28Å; Y139-F143 AromaticContact CE1-CE2 3.64Å; Y139-F143 HydrophobicContact CE1-CE2 3.64Å; Y139-F143 AromaticContact CE1-CZ 3.93Å; Y139-F143 HydrophobicContact CE1-CZ 3.93Å; Y139-F257 AromaticContact CE1-CD2 3.82Å; Y139-F257 HydrophobicContact CE1-CD2 3.82Å; Y139-F257 AromaticContact CE1-CE2 3.81Å; Y139-F257 HydrophobicContact CE1-CE2 3.81Å; Y139-F257 WeakPolarHBondContact OH-CE2 3.35Å
140G92.9Very high93.9Very high15 Ų1547.8 Ų47.816%0.15525%0.25CC..SBendtrans-87.2-162.417700000113.8E136 Q137 P142 F143 L144E136-G140 WeakPolarHBondContact O-CA 3.5Å; E136-G140 PolarHBondContact O-N 3.05Å; Q137-G140 PolarHBondContact O-N 3.27Å; G140-P142 VanDerWaalsContact C-CD 3.45Å; G140-F143 WeakPolarHBondContact O-CB 3.37Å; G140-F143 PolarHBondContact O-N 3.35Å; G140-L144 WeakPolarHBondContact O-CG 3.45Å; G140-L144 PolarHBondContact O-N 2.7Å
141E94.3Very high94.2Very high101 Ų10144.5 Ų44.547%0.47223%0.227SC..Hα-helixtrans-53.7-37.5-175.1-79-57128.400116.2R26 F143 L144 A145R26-E141 IonicContact CZ-OE2 3.4Å; R26-E141 IonicContact NE-OE1 3.09Å; R26-E141 PolarHBondContact NE-OE1 2.6Å; R26-E141 VanDerWaalsContact NE-OE1 3.09Å; R26-E141 IonicContact NE-OE2 3.07Å; R26-E141 PolarHBondContact NE-OE2 2.73Å; R26-E141 VanDerWaalsContact NE-OE2 3.07Å; R26-E141 IonicContact NH2-OE2 3.14Å; R26-E141 PolarHBondContact NH2-OE2 3.22Å; E141-F143 VanDerWaalsContact C-N 3.29Å; E141-F143 PolarHBondContact O-N 3.17Å; E141-L144 PolarHBondContact O-N 2.91Å; E141-L144 WeakPolarHBondContact OE1-CD1 3.36Å; E141-A145 VanDerWaalsContact O-CB 3.31Å; E141-A145 WeakPolarHBondContact O-CB 3.05Å; E141-A145 PolarHBondContact O-N 3.32Å
142P94.4Very high94.5Very high57 Ų5741.3 Ų41.337%0.3721%0.213SC..Hα-helixtrans-59-38.1175.3-27.637.6000113.7G140 A146 A253G140-P142 VanDerWaalsContact C-CD 3.45Å; P142-A146 PolarHBondContact O-N 3.42Å; P142-A253 HydrophobicContact CB-CB 3.74Å
143F94.3Very high94.5Very high0 Ų040.3 Ų40.30%021%0.207CC..Hα-helixtrans-71.7-43.6174.9169.5-82.8000111.2G60 K64 E138 Y139 G140 E141 A146 M147 F257 L259G60-F143 WeakPolarHBondContact O-CZ 3.37Å; K64-F143 HydrophobicContact CB-CE1 4.19Å; E138-F143 WeakPolarHBondContact O-CB 3.47Å; Y139-F143 HydrophobicContact CD1-CD1 4.33Å; Y139-F143 AromaticContact CD1-CD2 3.91Å; Y139-F143 HydrophobicContact CD1-CD2 3.91Å; Y139-F143 HydrophobicContact CD1-CE1 4Å; Y139-F143 AromaticContact CD1-CE2 3.5Å; Y139-F143 HydrophobicContact CD1-CE2 3.5Å; Y139-F143 VanDerWaalsContact CD1-CE2 3.5Å; Y139-F143 HydrophobicContact CD1-CG 4.3Å; Y139-F143 AromaticContact CD1-CZ 3.55Å; Y139-F143 HydrophobicContact CD1-CZ 3.55Å; Y139-F143 HydrophobicContact CE1-CD2 4.28Å; Y139-F143 AromaticContact CE1-CE2 3.64Å; Y139-F143 HydrophobicContact CE1-CE2 3.64Å; Y139-F143 AromaticContact CE1-CZ 3.93Å; Y139-F143 HydrophobicContact CE1-CZ 3.93Å; G140-F143 WeakPolarHBondContact O-CB 3.37Å; G140-F143 PolarHBondContact O-N 3.35Å; E141-F143 VanDerWaalsContact C-N 3.29Å; E141-F143 PolarHBondContact O-N 3.17Å; F143-A146 PolarHBondContact O-N 3.23Å; F143-M147 HydrophobicContact CE1-SD 4.22Å; F143-M147 WeakPolarHBondContact O-CB 3.42Å; F143-M147 PolarHBondContact O-N 2.98Å; F143-F257 HydrophobicContact CE2-CD2 4.2Å; F143-L259 HydrophobicContact CD2-CB 4.27Å; F143-L259 HydrophobicContact CD2-CD1 3.8Å; F143-L259 HydrophobicContact CD2-CG 4.34Å; F143-L259 HydrophobicContact CE2-CD1 3.57Å; F143-L259 HydrophobicContact CE2-CG 4.27Å; F143-L259 HydrophobicContact CG-CD1 4.42Å; F143-L259 HydrophobicContact CZ-CD1 3.99Å
144L95.6Very high94.7Very high7 Ų734.7 Ų34.74%0.03718%0.181CC..Hα-helixtrans-67.1-38.9-178-62.8165.6000112.1K64 G140 E141 M147 E148K64-L144 HydrophobicContact CD-CD2 4.11Å; K64-L144 HydrophobicContact CG-CD2 3.97Å; G140-L144 WeakPolarHBondContact O-CG 3.45Å; G140-L144 PolarHBondContact O-N 2.7Å; E141-L144 PolarHBondContact O-N 2.91Å; E141-L144 WeakPolarHBondContact OE1-CD1 3.36Å; L144-M147 HydrophobicContact CD2-CE 3.8Å; L144-M147 PolarHBondContact O-N 2.79Å; L144-E148 WeakPolarHBondContact O-CB 3.43Å; L144-E148 PolarHBondContact O-N 3.05Å
145A95.3Very high94.9Very high44 Ų4429 Ų2936%0.36415%0.154SC..Hα-helixtrans-67.3-34.4174.900000112.8E141 K149E141-A145 VanDerWaalsContact O-CB 3.31Å; E141-A145 WeakPolarHBondContact O-CB 3.05Å; E141-A145 PolarHBondContact O-N 3.32Å; A145-K149 PolarHBondContact O-N 3.32Å
146A94.1Very high95Very high15 Ų1529.4 Ų29.412%0.12416%0.157CC..Hα-helixtrans-72.4-37.8173.700000112.3P142 F143 K149 L150 L259P142-A146 PolarHBondContact O-N 3.42Å; F143-A146 PolarHBondContact O-N 3.23Å; A146-K149 PolarHBondContact O-N 3.23Å; A146-L150 PolarHBondContact O-N 3.35Å; A146-L259 HydrophobicContact CB-CB 4.04Å; A146-L259 WeakPolarHBondContact CB-O 3.31Å
147M95.4Very high95.2Very high0 Ų027 Ų270%015%0.146CC..Hα-helixtrans-65.6-37.4172.2-173.2-179.171.600112V23 F31 L57 G60 L61 F143 L144 L150 L151 L259V23-M147 HydrophobicContact CG1-CE 4.2Å; F31-M147 HydrophobicContact CD2-CE 4.44Å; F31-M147 HydrophobicContact CE2-CE 3.54Å; F31-M147 HydrophobicContact CZ-CE 3.64Å; L57-M147 HydrophobicContact CD1-CG 3.77Å; G60-M147 VanDerWaalsContact C-SD 3.53Å; L61-M147 HydrophobicContact CB-SD 4.46Å; L61-M147 HydrophobicContact CD2-CE 3.92Å; L61-M147 HydrophobicContact CD2-SD 3.75Å; L61-M147 HydrophobicContact CG-SD 3.88Å; F143-M147 HydrophobicContact CE1-SD 4.22Å; F143-M147 WeakPolarHBondContact O-CB 3.42Å; F143-M147 PolarHBondContact O-N 2.98Å; L144-M147 HydrophobicContact CD2-CE 3.8Å; L144-M147 PolarHBondContact O-N 2.79Å; M147-L150 PolarHBondContact O-N 3.17Å; M147-L151 PolarHBondContact O-N 3.35Å; M147-L259 HydrophobicContact CB-CD1 4.34Å
148E96.6Very high95.3Very high25 Ų2521.2 Ų21.212%0.11712%0.119CC..Hα-helixtrans-60-48.2169.3-178.5179.7175.900111W20 V23 R24 R26 L144 L150 L151 F152W20-E148 HydrophobicContact CH2-CG 3.71Å; W20-E148 HydrophobicContact CZ3-CG 3.75Å; W20-E148 WeakPolarHBondContact CZ3-O 3.23Å; V23-E148 HydrophobicContact CG1-CB 4.02Å; R24-E148 HydrophobicContact CG-CG 4.43Å; R24-E148 IonicContact NE-OE1 3.56Å; R26-E148 IonicContact CZ-OE2 3.13Å; R26-E148 IonicContact NH1-OE2 2.71Å; R26-E148 PolarHBondContact NH1-OE2 2.82Å; R26-E148 IonicContact NH2-OE2 2.76Å; R26-E148 PolarHBondContact NH2-OE2 3Å; R26-E148 VanDerWaalsContact NH2-OE2 3.09Å; L144-E148 WeakPolarHBondContact O-CB 3.43Å; L144-E148 PolarHBondContact O-N 3.05Å; E148-L150 PolarHBondContact O-N 3.03Å; E148-L151 PolarHBondContact O-N 3.05Å; E148-F152 PolarHBondContact O-N 3.08Å
149K95.8Very high95.4Very high54 Ų5421.8 Ų21.824%0.23512%0.122CC..Hα-helixtrans-58.6-44.2174.6179.8166.4177.7163.20112.5A145 A146 L151 F152 E153 I386 D390A145-K149 PolarHBondContact O-N 3.32Å; A146-K149 PolarHBondContact O-N 3.23Å; K149-L151 VanDerWaalsContact C-N 3.32Å; K149-L151 PolarHBondContact O-N 3.43Å; K149-F152 WeakPolarHBondContact O-CB 2.96Å; K149-F152 PolarHBondContact O-N 3.35Å; K149-E153 WeakPolarHBondContact CE-OE1 3.36Å; K149-E153 HydrophobicContact CG-CG 4.46Å; K149-E153 IonicContact NZ-OE1 2.66Å; K149-E153 WeakPolarHBondContact O-CG 3.26Å; K149-E153 PolarHBondContact O-N 3.4Å; K149-I386 HydrophobicContact CB-CD1 4.22Å; K149-D390 PolarHBondContact NZ-O 3.45Å
150L95.9Very high95.3Very high11 Ų1128.2 Ų28.26%0.05815%0.149CC..Hα-helixtrans-61.7-37.6176.2-74.6178.9000112.6H53 R56 L57 A146 M147 E148 Y154 L259H53-L150 VanDerWaalsContact CE1-CD2 3.5Å; H53-L150 WeakPolarHBondContact CE1-CD2 3.43Å; H53-L150 PolarHBondContact NE2-O 2.92Å; R56-L150 HydrophobicContact CB-CD1 3.76Å; L57-L150 HydrophobicContact CB-CB 4.28Å; L57-L150 HydrophobicContact CD1-CB 4.24Å; A146-L150 PolarHBondContact O-N 3.35Å; M147-L150 PolarHBondContact O-N 3.17Å; E148-L150 PolarHBondContact O-N 3.03Å; L150-Y154 WeakPolarHBondContact O-CB 3.36Å; L150-Y154 PolarHBondContact O-N 3.02Å; L150-Y154 VanDerWaalsContact O-N 3.17Å; L150-L259 HydrophobicContact CD1-CD2 3.64Å
151L97.8Very high95.3Very high0 Ų030.8 Ų30.80%017%0.169CC..Hα-helixtrans-69.2-44.6173.6-179.661.1000111.3W20 V23 L38 L57 M147 E148 K149 E153 Y154 L155W20-L151 HydrophobicContact CE3-CB 4.5Å; W20-L151 HydrophobicContact CE3-CD2 3.97Å; W20-L151 HydrophobicContact CE3-CG 4.07Å; W20-L151 HydrophobicContact CZ3-CB 4.47Å; V23-L151 HydrophobicContact CB-CD2 3.79Å; V23-L151 HydrophobicContact CG1-CD2 4.37Å; V23-L151 HydrophobicContact CG2-CD2 3.61Å; L38-L151 HydrophobicContact CD2-CD1 4.31Å; L57-L151 HydrophobicContact CD1-CB 4.13Å; L57-L151 HydrophobicContact CD2-CB 4.14Å; L57-L151 HydrophobicContact CD2-CD1 4.05Å; M147-L151 PolarHBondContact O-N 3.35Å; E148-L151 PolarHBondContact O-N 3.05Å; K149-L151 VanDerWaalsContact C-N 3.32Å; K149-L151 PolarHBondContact O-N 3.43Å; L151-E153 VanDerWaalsContact C-N 3.31Å; L151-E153 PolarHBondContact O-N 3.13Å; L151-Y154 WeakPolarHBondContact O-CA 3.2Å; L151-Y154 VanDerWaalsContact O-CB 3.3Å; L151-Y154 WeakPolarHBondContact O-CB 3.44Å; L151-Y154 PolarHBondContact O-N 3.23Å; L151-Y154 VanDerWaalsContact O-N 3.08Å; L151-L155 HydrophobicContact CD1-CD1 4.12Å; L151-L155 HydrophobicContact CD1-CD2 4.15Å; L151-L155 HydrophobicContact CD1-CG 3.92Å; L151-L155 HydrophobicContact CG-CD1 4.02Å; L151-L155 HydrophobicContact CG-CG 4.19Å; L151-L155 WeakPolarHBondContact O-CG 3.46Å; L151-L155 PolarHBondContact O-N 2.87Å
152F96.8Very high95.1Very high4 Ų427.3 Ų27.32%0.01815%0.154CC..Hα-helixtrans-53.4-48.9176.8-179.8-106.5000111.6W20 E148 K149 Y154 L155 C156 D195 M196 I386 I388 L391W20-F152 HydrophobicContact CH2-CB 3.63Å; W20-F152 AromaticContact CH2-CD2 3.81Å; W20-F152 HydrophobicContact CH2-CD2 3.81Å; W20-F152 HydrophobicContact CH2-CG 4.13Å; W20-F152 HydrophobicContact CZ2-CB 4.42Å; W20-F152 AromaticContact CZ2-CD2 3.75Å; W20-F152 HydrophobicContact CZ2-CD2 3.75Å; W20-F152 HydrophobicContact CZ3-CB 3.78Å; E148-F152 PolarHBondContact O-N 3.08Å; K149-F152 WeakPolarHBondContact O-CB 2.96Å; K149-F152 PolarHBondContact O-N 3.35Å; F152-Y154 VanDerWaalsContact C-N 3.32Å; F152-Y154 PolarHBondContact O-N 2.9Å; F152-L155 PolarHBondContact O-N 3.02Å; F152-C156 WeakPolarHBondContact O-CB 3.49Å; F152-C156 PolarHBondContact O-N 3.25Å; F152-C156 PolarHBondContact O-SG 3.34Å; F152-C156 VanDerWaalsContact O-SG 3.36Å; F152-D195 HydrophobicContact CE2-CB 4.36Å; F152-D195 WeakPolarHBondContact CE2-O 3.41Å; F152-M196 HydrophobicContact CD2-CE 3.66Å; F152-M196 HydrophobicContact CE2-CE 3.55Å; F152-I386 HydrophobicContact CD1-CG2 3.75Å; F152-I386 HydrophobicContact CE1-CG2 3.79Å; F152-I386 HydrophobicContact CG-CG2 4.43Å; F152-I388 HydrophobicContact CZ-CG1 4.36Å; F152-L391 HydrophobicContact CD1-CD2 4.37Å; F152-L391 HydrophobicContact CE1-CD2 4.16Å
153E95.9Very high94.9Very high25 Ų2528.3 Ų28.312%0.11716%0.161CC..Hα-helixtrans-62.2-38.5177.5-72.3170.2166.700112.3H53 K149 L151 C156 Q157 L391H53-E153 IonicContact CE1-OE2 3.67Å; H53-E153 PolarHBondContact CE1-OE2 3.17Å; K149-E153 WeakPolarHBondContact CE-OE1 3.36Å; K149-E153 HydrophobicContact CG-CG 4.46Å; K149-E153 IonicContact NZ-OE1 2.66Å; K149-E153 WeakPolarHBondContact O-CG 3.26Å; K149-E153 PolarHBondContact O-N 3.4Å; L151-E153 VanDerWaalsContact C-N 3.31Å; L151-E153 PolarHBondContact O-N 3.13Å; E153-C156 PolarHBondContact O-N 3.02Å; E153-Q157 WeakPolarHBondContact O-CG 3.46Å; E153-Q157 PolarHBondContact O-N 3.46Å; E153-Q157 VanDerWaalsContact O-N 3.16Å; E153-L391 HydrophobicContact CG-CD2 3.75Å
154Y96.8Very high94.5Very high0 Ų033.6 Ų33.60%019%0.193CC..Hα-helixtrans-62.3-46.6174.4-152.6-58.8000111.3L38 L41 L48 V49 H53 H54 L57 L150 L151 F152 Q157 L158L38-Y154 HydrophobicContact CD2-CD1 4.13Å; L38-Y154 HydrophobicContact CD2-CD2 3.92Å; L38-Y154 HydrophobicContact CD2-CE1 3.99Å; L38-Y154 HydrophobicContact CD2-CE2 3.76Å; L38-Y154 HydrophobicContact CD2-CG 4.11Å; L41-Y154 HydrophobicContact CB-CE1 4.31Å; L41-Y154 HydrophobicContact CD1-CD1 4.31Å; L41-Y154 HydrophobicContact CD1-CE1 3.75Å; L48-Y154 HydrophobicContact CD2-CD1 4.47Å; L48-Y154 HydrophobicContact CD2-CE1 3.97Å; V49-Y154 HydrophobicContact CB-CE2 4.48Å; V49-Y154 HydrophobicContact CG1-CD1 4.11Å; V49-Y154 HydrophobicContact CG1-CD2 3.99Å; V49-Y154 HydrophobicContact CG1-CE1 4.35Å; V49-Y154 HydrophobicContact CG1-CE2 4.25Å; V49-Y154 HydrophobicContact CG1-CG 3.91Å; V49-Y154 HydrophobicContact CG2-CD2 3.91Å; V49-Y154 HydrophobicContact CG2-CE1 4.41Å; V49-Y154 HydrophobicContact CG2-CE2 3.43Å; V49-Y154 VanDerWaalsContact CG2-CE2 3.43Å; H53-Y154 AromaticContact CD2-CD2 3.9Å; H54-Y154 HydrophobicContact CB-CE2 4.16Å; H54-Y154 AromaticContact ND1-CE2 3.51Å; H54-Y154 AromaticContact ND1-CZ 3.67Å; H54-Y154 PolarHBondContact ND1-OH 3.25Å; L57-Y154 HydrophobicContact CD2-CD2 3.79Å; L57-Y154 HydrophobicContact CD2-CG 4.43Å; L150-Y154 WeakPolarHBondContact O-CB 3.36Å; L150-Y154 PolarHBondContact O-N 3.02Å; L150-Y154 VanDerWaalsContact O-N 3.17Å; L151-Y154 WeakPolarHBondContact O-CA 3.2Å; L151-Y154 VanDerWaalsContact O-CB 3.3Å; L151-Y154 WeakPolarHBondContact O-CB 3.44Å; L151-Y154 PolarHBondContact O-N 3.23Å; L151-Y154 VanDerWaalsContact O-N 3.08Å; F152-Y154 VanDerWaalsContact C-N 3.32Å; F152-Y154 PolarHBondContact O-N 2.9Å; Y154-Q157 PolarHBondContact O-N 3.41Å; Y154-L158 PolarHBondContact O-N 2.91Å
155L96.4Very high93.8Very high0 Ų034.7 Ų34.70%020%0.2CC..Hα-helixtrans-70.7-32.7-179.5-61-175.6000112A16 W20 F37 L151 F152 Q157 L158 E159 Y192 M196A16-L155 HydrophobicContact CB-CD1 4.39Å; A16-L155 HydrophobicContact CB-CD2 3.79Å; W20-L155 HydrophobicContact CB-CD1 3.76Å; W20-L155 HydrophobicContact CD2-CD1 4.34Å; W20-L155 HydrophobicContact CE3-CD1 4.28Å; W20-L155 HydrophobicContact CG-CD1 4.17Å; F37-L155 HydrophobicContact CE1-CD2 4.06Å; L151-L155 HydrophobicContact CD1-CD1 4.12Å; L151-L155 HydrophobicContact CD1-CD2 4.15Å; L151-L155 HydrophobicContact CD1-CG 3.92Å; L151-L155 HydrophobicContact CG-CD1 4.02Å; L151-L155 HydrophobicContact CG-CG 4.19Å; L151-L155 WeakPolarHBondContact O-CG 3.46Å; L151-L155 PolarHBondContact O-N 2.87Å; F152-L155 PolarHBondContact O-N 3.02Å; L155-Q157 VanDerWaalsContact C-N 3.3Å; L155-Q157 PolarHBondContact O-N 3.37Å; L155-L158 HydrophobicContact CD2-CD2 4.21Å; L155-L158 WeakPolarHBondContact O-CB 3.41Å; L155-L158 PolarHBondContact O-N 3.34Å; L155-E159 PolarHBondContact O-N 2.97Å; L155-Y192 HydrophobicContact CB-CE2 4.27Å; L155-Y192 HydrophobicContact CD1-CE2 3.84Å; L155-M196 HydrophobicContact CB-CE 4.12Å; L155-M196 HydrophobicContact CB-SD 4.02Å
156C95Very high92.8Very high10 Ų1037.4 Ų37.47%0.06821%0.205CC..Hα-helixtrans-61.9-33.4169.2-780000112.9F152 E153 K160F152-C156 WeakPolarHBondContact O-CB 3.49Å; F152-C156 PolarHBondContact O-N 3.25Å; F152-C156 PolarHBondContact O-SG 3.34Å; F152-C156 VanDerWaalsContact O-SG 3.36Å; E153-C156 PolarHBondContact O-N 3.02Å; C156-K160 VanDerWaalsContact O-CD 3.27Å; C156-K160 WeakPolarHBondContact O-CD 3.36Å; C156-K160 WeakPolarHBondContact O-CE 3.24Å; C156-K160 WeakPolarHBondContact O-CG 3.31Å; C156-K160 PolarHBondContact O-N 2.94Å
157Q96.1Very high91.7Very high60 Ų6039.5 Ų39.528%0.2822%0.223SC..Hα-helixtrans-76.6-35.3171.8-57.6-58-5.400111.9L48 V49 E153 Y154 L155 K160 A161L48-Q157 HydrophobicContact CD1-CB 4.05Å; L48-Q157 WeakPolarHBondContact CD1-O 3.44Å; L48-Q157 HydrophobicContact CG-CB 4.37Å; L48-Q157 WeakPolarHBondContact O-CB 3.49Å; V49-Q157 HydrophobicContact CG1-CB 4.35Å; V49-Q157 HydrophobicContact CG1-CG 4.2Å; E153-Q157 WeakPolarHBondContact O-CG 3.46Å; E153-Q157 PolarHBondContact O-N 3.46Å; E153-Q157 VanDerWaalsContact O-N 3.16Å; Y154-Q157 PolarHBondContact O-N 3.41Å; L155-Q157 VanDerWaalsContact C-N 3.3Å; L155-Q157 PolarHBondContact O-N 3.37Å; Q157-K160 PolarHBondContact O-N 3.31Å; Q157-A161 PolarHBondContact O-N 3.38Å
158L95.3Very high90.4Very high6 Ų645.3 Ų45.33%0.03125%0.25CC..Hα-helixtrans-58.5-50.9173.5-178.762.7000111.1A16 F37 L41 L48 Y154 L155 K160 A161 L162A16-L158 HydrophobicContact CB-CD2 4.03Å; F37-L158 HydrophobicContact CZ-CD2 3.95Å; L41-L158 HydrophobicContact CD1-CD2 4.24Å; L41-L158 HydrophobicContact CD2-CD1 3.96Å; L48-L158 HydrophobicContact CD2-CB 4.34Å; L48-L158 HydrophobicContact CD2-CD1 4.08Å; Y154-L158 PolarHBondContact O-N 2.91Å; L155-L158 HydrophobicContact CD2-CD2 4.21Å; L155-L158 WeakPolarHBondContact O-CB 3.41Å; L155-L158 PolarHBondContact O-N 3.34Å; L158-K160 VanDerWaalsContact C-N 3.31Å; L158-K160 PolarHBondContact O-N 3.43Å; L158-A161 PolarHBondContact O-N 2.7Å; L158-L162 HydrophobicContact CD1-CD1 4.29Å; L158-L162 HydrophobicContact CD1-CG 4.31Å; L158-L162 HydrophobicContact CG-CD1 4.13Å; L158-L162 HydrophobicContact CG-CG 4.48Å; L158-L162 WeakPolarHBondContact O-CG 3.34Å; L158-L162 PolarHBondContact O-N 3.3Å; L158-L162 VanDerWaalsContact O-N 3.15Å
159E93.9Very high89Confident24 Ų2447.9 Ų47.911%0.11226%0.262CS..Hα-helixtrans-61.3-36.9179.4-78.7-60.9117.900113.2R13 L155 A161 L162 M196 W198R13-E159 WeakPolarHBondContact CG-OE1 3.42Å; R13-E159 IonicContact CZ-OE1 2.7Å; R13-E159 IonicContact CZ-OE2 3.85Å; R13-E159 IonicContact NE-OE1 2.69Å; R13-E159 PolarHBondContact NE-OE1 3.36Å; R13-E159 IonicContact NE-OE2 3.24Å; R13-E159 PolarHBondContact NE-OE2 3.04Å; R13-E159 VanDerWaalsContact NE-OE2 3.13Å; R13-E159 IonicContact NH2-OE1 3.22Å; R13-E159 PolarHBondContact NH2-OE1 3.04Å; R13-E159 IonicContact NH2-OE2 3.15Å; R13-E159 PolarHBondContact NH2-OE2 3.37Å; L155-E159 PolarHBondContact O-N 2.97Å; E159-A161 PolarHBondContact O-N 2.94Å; E159-L162 PolarHBondContact O-N 2.98Å; E159-M196 HydrophobicContact CG-CB 4.23Å; E159-M196 HydrophobicContact CG-CG 3.97Å; E159-M196 HydrophobicContact CG-SD 3.83Å; E159-W198 PolarHBondContact OE2-NE1 3.24Å
160K92.9Very high87.8Confident134 Ų13445.8 Ų45.858%0.58325%0.253SS*.Hα-helixtrans-65.9-23.5173.7-70.4166.3-167172.30113.6C156 Q157 L158C156-K160 VanDerWaalsContact O-CD 3.27Å; C156-K160 WeakPolarHBondContact O-CD 3.36Å; C156-K160 WeakPolarHBondContact O-CE 3.24Å; C156-K160 WeakPolarHBondContact O-CG 3.31Å; C156-K160 PolarHBondContact O-N 2.94Å; Q157-K160 PolarHBondContact O-N 3.31Å; L158-K160 VanDerWaalsContact C-N 3.31Å; L158-K160 PolarHBondContact O-N 3.43Å
161A92.8Very high86.7Confident69 Ų6948.9 Ų48.957%0.5727%0.268SS*.Hα-helixtrans-92.7-9.417800000113.4L48 Q157 L158 E159L48-A161 HydrophobicContact CD1-CB 3.91Å; Q157-A161 PolarHBondContact O-N 3.38Å; L158-A161 PolarHBondContact O-N 2.7Å; E159-A161 PolarHBondContact O-N 2.94Å
162L91.1Very high85.3Confident28 Ų2852.1 Ų52.115%0.14729%0.285CS..SBendtrans-99.2150.2178.8-66.9-177.9000111.6P9 L12 R13 L158 E159P9-L162 HydrophobicContact CB-CB 4.48Å; P9-L162 HydrophobicContact CB-CD1 4.35Å; P9-L162 HydrophobicContact CB-CD2 4.02Å; P9-L162 HydrophobicContact CG-CD2 4.31Å; L12-L162 HydrophobicContact CB-CD1 4.36Å; L12-L162 HydrophobicContact CD1-CD2 3.95Å; R13-L162 HydrophobicContact CG-CD1 3.91Å; L158-L162 HydrophobicContact CD1-CD1 4.29Å; L158-L162 HydrophobicContact CD1-CG 4.31Å; L158-L162 HydrophobicContact CG-CD1 4.13Å; L158-L162 HydrophobicContact CG-CG 4.48Å; L158-L162 WeakPolarHBondContact O-CG 3.34Å; L158-L162 PolarHBondContact O-N 3.3Å; L158-L162 VanDerWaalsContact O-N 3.15Å; E159-L162 PolarHBondContact O-N 2.98Å
163P89.4Confident84.1Confident79 Ų7952.7 Ų52.751%0.51329%0.288SS..  trans-56.3151.1168.1-23.333.8000111.8P9 R13P9-P163 HydrophobicContact CG-CG 4.15Å; R13-P163 VanDerWaalsContact CZ-O 3.3Å; R13-P163 PolarHBondContact NH1-O 3.31Å; R13-P163 PolarHBondContact NH2-O 3.35Å
164T85.8Confident82.7Confident110 Ų11053.1 Ų53.168%0.67529%0.291SS*.  trans-43132.4176.9-48.20000111.6Q166T164-Q166 PolarHBondContact O-N 3.24Å
165P80.1Confident81.4Confident30 Ų3056 Ų5620%0.19531%0.312CS..  trans-63110.4-176.425.6-35.3000111.4L170 W198P165-L170 HydrophobicContact CB-CD1 4.4Å; P165-W198 HydrophobicContact CB-CD2 4Å; P165-W198 HydrophobicContact CB-CE3 4.3Å; P165-W198 HydrophobicContact CB-CG 4.42Å; P165-W198 HydrophobicContact CB-CZ2 4.31Å; P165-W198 HydrophobicContact CG-CB 4.39Å; P165-W198 HydrophobicContact CG-CD2 3.91Å; P165-W198 HydrophobicContact CG-CG 3.8Å
166Q74.8Confident80Confident101 Ų10164.7 Ų64.747%0.47235%0.345SS..  trans-92.3113.9177.1-64.3-177.711.600109.8T164 Q168 Q169 L170T164-Q166 PolarHBondContact O-N 3.24Å; Q166-Q168 PolarHBondContact O-N 3.48Å; Q166-Q168 VanDerWaalsContact O-N 3.13Å; Q166-Q169 HydrophobicContact CB-CB 4.33Å; Q166-Q169 HydrophobicContact CB-CG 4.04Å; Q166-Q169 PolarHBondContact O-N 2.78Å; Q166-L170 WeakPolarHBondContact O-CD1 3.44Å; Q166-L170 WeakPolarHBondContact O-CG 3.4Å; Q166-L170 PolarHBondContact O-N 3.15Å
167A71.7Confident78.5Confident59 Ų5969.8 Ų69.849%0.48837%0.369SS..Hα-helixtrans-54.1-35.4-178.500000113.2L170 Q171A167-L170 PolarHBondContact O-N 2.86Å; A167-Q171 WeakPolarHBondContact O-CG 3.48Å; A167-Q171 PolarHBondContact O-N 3.45Å
168Q67.3Low76.9Confident122 Ų12272.5 Ų72.557%0.5738%0.382SS*.Hα-helixtrans-64.1-54178.2-16860.146.400112.3Q166 L170 Q171 D172Q166-Q168 PolarHBondContact O-N 3.48Å; Q166-Q168 VanDerWaalsContact O-N 3.13Å; Q168-L170 PolarHBondContact O-N 3.02Å; Q168-Q171 WeakPolarHBondContact O-CB 3.36Å; Q168-Q171 PolarHBondContact O-N 2.7Å; Q168-D172 PolarHBondContact NE2-OD1 3.41Å; Q168-D172 PolarHBondContact O-N 3.02Å
169Q68.1Low75.2Confident80 Ų8077.5 Ų77.537%0.37442%0.415SS..Hα-helixtrans-56.4-30178.8-64.7-173.2-7.200113Q166 V173Q166-Q169 HydrophobicContact CB-CB 4.33Å; Q166-Q169 HydrophobicContact CB-CG 4.04Å; Q166-Q169 PolarHBondContact O-N 2.78Å; Q169-V173 WeakPolarHBondContact O-CG2 3.3Å; Q169-V173 PolarHBondContact O-N 3.09Å
170L70.9Confident73.5Confident9 Ų980.2 Ų80.25%0.04745%0.448CS..Hα-helixtrans-74.9-42.4177.6-63.7164.3000111.5A10 F14 P165 Q166 A167 Q168 L174 I183 W189 W198A10-L170 HydrophobicContact CB-CD2 3.81Å; F14-L170 HydrophobicContact CE2-CD2 4.4Å; F14-L170 HydrophobicContact CZ-CB 4.34Å; F14-L170 HydrophobicContact CZ-CD2 3.95Å; P165-L170 HydrophobicContact CB-CD1 4.4Å; Q166-L170 WeakPolarHBondContact O-CD1 3.44Å; Q166-L170 WeakPolarHBondContact O-CG 3.4Å; Q166-L170 PolarHBondContact O-N 3.15Å; A167-L170 PolarHBondContact O-N 2.86Å; Q168-L170 PolarHBondContact O-N 3.02Å; L170-L174 PolarHBondContact O-N 3.37Å; L170-I183 HydrophobicContact CB-CD1 3.95Å; L170-W189 HydrophobicContact CB-CZ2 4.33Å; L170-W189 HydrophobicContact CD1-CZ2 3.83Å; L170-W189 HydrophobicContact CD2-CH2 3.65Å; L170-W189 HydrophobicContact CD2-CZ2 3.59Å; L170-W189 HydrophobicContact CG-CZ2 4.1Å; L170-W198 HydrophobicContact CD1-CZ3 4.48Å
171Q71.1Confident71.8Confident77 Ų7777.4 Ų77.436%0.3644%0.442SS..Hα-helixtrans-63.4-43.8171.6-66.9-7718.100110.9A167 Q168 L174 S175 I183A167-Q171 WeakPolarHBondContact O-CG 3.48Å; A167-Q171 PolarHBondContact O-N 3.45Å; Q168-Q171 WeakPolarHBondContact O-CB 3.36Å; Q168-Q171 PolarHBondContact O-N 2.7Å; Q171-L174 PolarHBondContact O-N 2.85Å; Q171-S175 WeakPolarHBondContact O-CB 3.49Å; Q171-S175 PolarHBondContact O-N 3.17Å; Q171-S175 PolarHBondContact O-OG 2.82Å; Q171-I183 HydrophobicContact CB-CD1 4.39Å; Q171-I183 HydrophobicContact CG-CD1 3.85Å
172D69.4Low70.1Confident68 Ų6877.6 Ų77.636%0.36444%0.44SS..Hα-helixtrans-58.5-55.1-178.2-59.7-27.3000110.2Q168 L174 S175 W176Q168-D172 PolarHBondContact NE2-OD1 3.41Å; Q168-D172 PolarHBondContact O-N 3.02Å; D172-L174 VanDerWaalsContact C-N 3.32Å; D172-L174 PolarHBondContact O-N 2.82Å; D172-S175 PolarHBondContact O-N 3.44Å; D172-S175 PolarHBondContact O-OG 3.27Å; D172-W176 PolarHBondContact O-N 3.08Å; D172-W176 VanDerWaalsContact O-N 3.14Å
173V70.3Confident68.3Low15 Ų1577.4 Ų77.49%0.09144%0.439CS..Hα-helixtrans-59.8-39.5179.4171.60000112.3P5 A10 F14 Q169 W176 M177P5-V173 HydrophobicContact CB-CG2 4.26Å; A10-V173 HydrophobicContact CB-CB 4.21Å; A10-V173 HydrophobicContact CB-CG2 3.83Å; F14-V173 HydrophobicContact CD2-CG1 4.08Å; F14-V173 HydrophobicContact CE2-CB 4.02Å; F14-V173 HydrophobicContact CE2-CG1 3.68Å; Q169-V173 WeakPolarHBondContact O-CG2 3.3Å; Q169-V173 PolarHBondContact O-N 3.09Å; V173-W176 PolarHBondContact O-N 2.89Å; V173-M177 HydrophobicContact CG1-CG 4.31Å; V173-M177 HydrophobicContact CG1-SD 3.84Å; V173-M177 WeakPolarHBondContact O-CB 3.31Å; V173-M177 WeakPolarHBondContact O-CG 3.13Å; V173-M177 PolarHBondContact O-N 3.04Å
174L67.8Low66.6Low34 Ų3478.1 Ų78.118%0.17844%0.442CS..Hα-helixtrans-71.6-35.6176.9-83.6169.4000113.5F14 L170 Q171 D172 W176 M177 Q178 I183F14-L174 HydrophobicContact CD1-CD1 4.33Å; F14-L174 HydrophobicContact CE1-CD1 3.4Å; F14-L174 VanDerWaalsContact CE1-CD1 3.4Å; F14-L174 HydrophobicContact CE1-CD2 4.33Å; F14-L174 HydrophobicContact CE1-CG 3.79Å; F14-L174 HydrophobicContact CE2-CD1 4.47Å; F14-L174 HydrophobicContact CE2-CG 4.03Å; F14-L174 HydrophobicContact CZ-CD1 3.5Å; F14-L174 HydrophobicContact CZ-CD2 4.37Å; F14-L174 HydrophobicContact CZ-CG 3.52Å; L170-L174 PolarHBondContact O-N 3.37Å; Q171-L174 PolarHBondContact O-N 2.85Å; D172-L174 VanDerWaalsContact C-N 3.32Å; D172-L174 PolarHBondContact O-N 2.82Å; L174-W176 PolarHBondContact O-N 2.97Å; L174-M177 PolarHBondContact O-N 2.81Å; L174-Q178 CarbonylContact O-C 3.41Å; L174-Q178 WeakPolarHBondContact O-CA 3.27Å; L174-Q178 PolarHBondContact O-N 2.85Å; L174-I183 HydrophobicContact CD1-CD1 3.92Å; L174-I183 HydrophobicContact CD1-CG1 3.45Å; L174-I183 VanDerWaalsContact CD1-CG1 3.45Å
175S68.9Low65.4Low62 Ų6276.4 Ų76.443%0.43443%0.434SS..Hα-helixtrans-63.6-28.7174.472.70000112.5Q171 D172 P179Q171-S175 WeakPolarHBondContact O-CB 3.49Å; Q171-S175 PolarHBondContact O-N 3.17Å; Q171-S175 PolarHBondContact O-OG 2.82Å; D172-S175 PolarHBondContact O-N 3.44Å; D172-S175 PolarHBondContact O-OG 3.27Å; S175-P179 WeakPolarHBondContact O-CA 3.25Å
176W66.8Low65Low181 Ų18177.5 Ų77.569%0.68644%0.443SS*.Hα-helixtrans-80.7-39.5172.3-77.862.5000113P5 D172 V173 L174P5-W176 HydrophobicContact CG-CB 4.2Å; P5-W176 HydrophobicContact CG-CD2 3.75Å; P5-W176 HydrophobicContact CG-CE3 3.77Å; P5-W176 HydrophobicContact CG-CG 3.96Å; P5-W176 HydrophobicContact CG-CZ3 4.43Å; D172-W176 PolarHBondContact O-N 3.08Å; D172-W176 VanDerWaalsContact O-N 3.14Å; V173-W176 PolarHBondContact O-N 2.89Å; L174-W176 PolarHBondContact O-N 2.97Å
177M63.5Low65.1Low117 Ų11778.5 Ų78.558%0.57645%0.451SS*.Hα-helixtrans-76.7-33.8-179.7-72.5-176.570.700113.5V173 L174V173-M177 HydrophobicContact CG1-CG 4.31Å; V173-M177 HydrophobicContact CG1-SD 3.84Å; V173-M177 WeakPolarHBondContact O-CB 3.31Å; V173-M177 WeakPolarHBondContact O-CG 3.13Å; V173-M177 PolarHBondContact O-N 3.04Å; L174-M177 PolarHBondContact O-N 2.81Å
178Q62.8Low65.6Low118 Ų11876.9 Ų76.955%0.55144%0.437SS*.SBendtrans-146.174.1-175.6-70.5-65.5-81.600110L174 G180 V181L174-Q178 CarbonylContact O-C 3.41Å; L174-Q178 WeakPolarHBondContact O-CA 3.27Å; L174-Q178 PolarHBondContact O-N 2.85Å; Q178-G180 PolarHBondContact O-N 2.92Å; Q178-G180 VanDerWaalsContact O-N 3.08Å; Q178-V181 HydrophobicContact CB-CB 4.13Å; Q178-V181 HydrophobicContact CB-CG2 3.97Å; Q178-V181 PolarHBondContact O-N 3.24Å; Q178-V181 VanDerWaalsContact O-N 3.14Å
179P59Low66.4Low111 Ų11172 Ų7272%0.72141%0.414SS*.THydrogen-bonded Turntrans-57.3116.7-179.822.3-33.3000111.3S175S175-P179 WeakPolarHBondContact O-CA 3.25Å
180G58.3Low67.1Low80 Ų8073.5 Ų73.583%0.82542%0.416SS*.THydrogen-bonded Turntrans108.7-4.7-178.900000116.1Q178Q178-G180 PolarHBondContact O-N 2.92Å; Q178-G180 VanDerWaalsContact O-N 3.08Å
181V57.8Low67.9Low75 Ų7576.3 Ų76.346%0.45543%0.429SS..  trans-101.9107.9-179-176.30000112.1Q178Q178-V181 HydrophobicContact CB-CB 4.13Å; Q178-V181 HydrophobicContact CB-CG2 3.97Å; Q178-V181 PolarHBondContact O-N 3.24Å; Q178-V181 VanDerWaalsContact O-N 3.14Å
182S56.8Low68.9Low74 Ų7472.7 Ų72.752%0.51741%0.412SS..  trans-73.8131.9178.6-57.10000112.8T184 S185S182-T184 PolarHBondContact O-N 2.69Å; S182-S185 WeakPolarHBondContact O-CB 3.43Å; S182-S185 PolarHBondContact O-N 2.97Å; S182-S185 PolarHBondContact O-OG 3.36Å
183I54.7Low69.9Low24 Ų2469.6 Ų69.612%0.12340%0.396CS..G310 helixtrans-46.7-38.8178.4-79.8-176.4000114.4L170 Q171 L174 S185 S186L170-I183 HydrophobicContact CB-CD1 3.95Å; Q171-I183 HydrophobicContact CB-CD1 4.39Å; Q171-I183 HydrophobicContact CG-CD1 3.85Å; L174-I183 HydrophobicContact CD1-CD1 3.92Å; L174-I183 HydrophobicContact CD1-CG1 3.45Å; L174-I183 VanDerWaalsContact CD1-CG1 3.45Å; I183-S185 PolarHBondContact O-N 3.26Å; I183-S186 PolarHBondContact O-N 2.99Å; I183-S186 VanDerWaalsContact O-N 3.16Å
184T53.9Low70.8Confident94 Ų9473.1 Ų73.158%0.57742%0.417SS*.G310 helixtrans-60.2-16.8-177.547.50000114.1S182 R190S182-T184 PolarHBondContact O-N 2.69Å; T184-R190 PolarHBondContact O-NE 2.86Å; T184-R190 PolarHBondContact O-NH1 3.23Å; T184-R190 PolarHBondContact O-NH2 3.23Å
185S58.7Low71.9Confident73 Ų7373 Ų7351%0.5142%0.417SS..G310 helixtrans-75.5-42.6174.963.80000113.2S182 I183 L187 R190S182-S185 WeakPolarHBondContact O-CB 3.43Å; S182-S185 PolarHBondContact O-N 2.97Å; S182-S185 PolarHBondContact O-OG 3.36Å; I183-S185 PolarHBondContact O-N 3.26Å; S185-L187 PolarHBondContact O-N 3.31Å; S185-R190 PolarHBondContact O-NH2 2.98Å
186S71.9Confident73Confident54 Ų5470.9 Ų70.938%0.37840%0.4SS..  trans-68.9115.5-170.7-178.20000111.6I183 W189 R190I183-S186 PolarHBondContact O-N 2.99Å; I183-S186 VanDerWaalsContact O-N 3.16Å; S186-W189 WeakPolarHBondContact OG-CB 3.38Å; S186-W189 PolarHBondContact OG-N 2.81Å; S186-R190 PolarHBondContact O-N 3.21Å; S186-R190 PolarHBondContact O-NE 3.1Å
187L78Confident74Confident122 Ų12264.8 Ų64.864%0.63939%0.393SS*.Hα-helixtrans-71.8-46.5178.3-17762.4000111.1S185 W189 R190 Q191S185-L187 PolarHBondContact O-N 3.31Å; L187-W189 VanDerWaalsContact C-N 3.27Å; L187-W189 PolarHBondContact O-N 3.19Å; L187-R190 PolarHBondContact O-N 3.08Å; L187-Q191 WeakPolarHBondContact O-CB 3.45Å; L187-Q191 PolarHBondContact O-N 2.88Å
188A81.1Confident75.1Confident25 Ų2561.1 Ų61.121%0.20737%0.373CS..Hα-helixtrans-57.6-39.3178.800000112.5Q21 Y192Q21-A188 HydrophobicContact CB-CB 3.88Å; Q21-A188 HydrophobicContact CG-CB 3.77Å; A188-Y192 WeakPolarHBondContact O-CB 3.5Å; A188-Y192 PolarHBondContact O-N 3.14Å
189W84Confident75.4Confident20 Ų2060.6 Ų60.68%0.07638%0.38CS..Hα-helixtrans-65.5-47.5176.7-178.2-106.7000112.7R13 F14 A17 L170 S186 L187 Q191 Y192 G193 W198R13-W189 HydrophobicContact CB-CH2 3.71Å; R13-W189 HydrophobicContact CB-CZ3 4.01Å; F14-W189 HydrophobicContact CD1-CD2 4.24Å; F14-W189 AromaticContact CD1-CE3 3.54Å; F14-W189 HydrophobicContact CD1-CE3 3.54Å; F14-W189 AromaticContact CD1-CH2 3.64Å; F14-W189 HydrophobicContact CD1-CH2 3.64Å; F14-W189 HydrophobicContact CD1-CZ2 4.34Å; F14-W189 AromaticContact CD1-CZ3 3.22Å; F14-W189 HydrophobicContact CD1-CZ3 3.22Å; F14-W189 AromaticContact CE1-CD2 3.93Å; F14-W189 HydrophobicContact CE1-CD2 3.93Å; F14-W189 AromaticContact CE1-CE2 3.92Å; F14-W189 AromaticContact CE1-CE3 3.68Å; F14-W189 HydrophobicContact CE1-CE3 3.68Å; F14-W189 AromaticContact CE1-CH2 3.35Å; F14-W189 HydrophobicContact CE1-CH2 3.35Å; F14-W189 AromaticContact CE1-CZ2 3.65Å; F14-W189 HydrophobicContact CE1-CZ2 3.65Å; F14-W189 AromaticContact CE1-CZ3 3.4Å; F14-W189 HydrophobicContact CE1-CZ3 3.4Å; F14-W189 VanDerWaalsContact CE1-CZ3 3.4Å; F14-W189 HydrophobicContact CG-CH2 4.47Å; F14-W189 HydrophobicContact CG-CZ3 4.12Å; F14-W189 HydrophobicContact CZ-CH2 4.02Å; F14-W189 HydrophobicContact CZ-CZ2 4.23Å; F14-W189 HydrophobicContact CZ-CZ3 4.43Å; A17-W189 HydrophobicContact CB-CE3 3.63Å; A17-W189 HydrophobicContact CB-CZ3 3.93Å; L170-W189 HydrophobicContact CB-CZ2 4.33Å; L170-W189 HydrophobicContact CD1-CZ2 3.83Å; L170-W189 HydrophobicContact CD2-CH2 3.65Å; L170-W189 HydrophobicContact CD2-CZ2 3.59Å; L170-W189 HydrophobicContact CG-CZ2 4.1Å; S186-W189 WeakPolarHBondContact OG-CB 3.38Å; S186-W189 PolarHBondContact OG-N 2.81Å; L187-W189 VanDerWaalsContact C-N 3.27Å; L187-W189 PolarHBondContact O-N 3.19Å; W189-Q191 VanDerWaalsContact C-N 3.34Å; W189-Y192 HydrophobicContact CZ3-CD1 4.44Å; W189-Y192 PolarHBondContact O-N 3.43Å; W189-G193 PolarHBondContact O-N 2.76Å; W189-W198 AromaticContact CE2-CZ3 3.93Å; W189-W198 AromaticContact CH2-CH2 3.57Å; W189-W198 HydrophobicContact CH2-CH2 3.57Å; W189-W198 AromaticContact CH2-CZ3 3.96Å; W189-W198 HydrophobicContact CH2-CZ3 3.96Å; W189-W198 AromaticContact CZ2-CH2 3.64Å; W189-W198 HydrophobicContact CZ2-CH2 3.64Å; W189-W198 AromaticContact CZ2-CZ3 3.51Å; W189-W198 HydrophobicContact CZ2-CZ3 3.51Å; W189-W198 HydrophobicContact CZ3-CH2 4.22Å
190R83.4Confident75.4Confident111 Ų11160.4 Ų60.442%0.41937%0.372SS..Hα-helixtrans-64.3-40.3177.4-73.1-178.3-72.8167.6-5.2111.5T184 S185 S186 L187 G193 V194T184-R190 PolarHBondContact O-NE 2.86Å; T184-R190 PolarHBondContact O-NH1 3.23Å; T184-R190 PolarHBondContact O-NH2 3.23Å; S185-R190 PolarHBondContact O-NH2 2.98Å; S186-R190 PolarHBondContact O-N 3.21Å; S186-R190 PolarHBondContact O-NE 3.1Å; L187-R190 PolarHBondContact O-N 3.08Å; R190-G193 PolarHBondContact O-N 2.91Å; R190-V194 WeakPolarHBondContact O-CG2 3.46Å; R190-V194 PolarHBondContact O-N 3.15Å
191Q88.6Confident75.2Confident68 Ų6861 Ų6132%0.31836%0.361SS..Hα-helixtrans-62.7-45.1175.9-170.261.357.900111.6L187 W189 G193 V194 D195L187-Q191 WeakPolarHBondContact O-CB 3.45Å; L187-Q191 PolarHBondContact O-N 2.88Å; W189-Q191 VanDerWaalsContact C-N 3.34Å; Q191-G193 PolarHBondContact O-N 3Å; Q191-V194 PolarHBondContact O-N 3Å; Q191-D195 PolarHBondContact NE2-OD1 3.18Å; Q191-D195 PolarHBondContact NE2-OD2 3.5Å; Q191-D195 WeakPolarHBondContact O-CB 2.77Å; Q191-D195 PolarHBondContact O-N 2.74Å
192Y91.6Very high74.2Confident0 Ų066.2 Ų66.20%038%0.381CS..Hα-helixtrans-59.3-44.6174.6179.4-114000112.3A16 A17 W20 L155 A188 W189 V194 D195 M196 W198A16-Y192 HydrophobicContact CB-CE1 4.17Å; A16-Y192 HydrophobicContact CB-CE2 4.16Å; A16-Y192 WeakPolarHBondContact CB-OH 3.09Å; A17-Y192 HydrophobicContact CB-CD1 3.61Å; A17-Y192 HydrophobicContact CB-CD2 4.44Å; A17-Y192 HydrophobicContact CB-CE1 4.36Å; A17-Y192 HydrophobicContact CB-CG 3.64Å; W20-Y192 HydrophobicContact CB-CD2 4.14Å; W20-Y192 AromaticContact CD1-CD2 3.7Å; W20-Y192 HydrophobicContact CG-CD2 4.07Å; L155-Y192 HydrophobicContact CB-CE2 4.27Å; L155-Y192 HydrophobicContact CD1-CE2 3.84Å; A188-Y192 WeakPolarHBondContact O-CB 3.5Å; A188-Y192 PolarHBondContact O-N 3.14Å; W189-Y192 HydrophobicContact CZ3-CD1 4.44Å; W189-Y192 PolarHBondContact O-N 3.43Å; Y192-V194 VanDerWaalsContact C-N 3.34Å; Y192-V194 PolarHBondContact O-N 3.49Å; Y192-D195 PolarHBondContact O-N 2.81Å; Y192-M196 HydrophobicContact CD1-CG 4.42Å; Y192-M196 HydrophobicContact CD2-CE 4.45Å; Y192-M196 HydrophobicContact CD2-CG 3.76Å; Y192-M196 HydrophobicContact CD2-SD 4.49Å; Y192-M196 HydrophobicContact CE1-CG 4.08Å; Y192-M196 HydrophobicContact CE2-CE 4Å; Y192-M196 HydrophobicContact CE2-CG 3.32Å; Y192-M196 HydrophobicContact CE2-SD 3.66Å; Y192-M196 HydrophobicContact CG-CG 4.29Å; Y192-M196 WeakPolarHBondContact O-CB 3.4Å; Y192-M196 VanDerWaalsContact O-CG 3.25Å; Y192-M196 WeakPolarHBondContact O-CG 3.45Å; Y192-M196 PolarHBondContact O-N 3.13Å; Y192-W198 AromaticContact CD1-CH2 3.96Å; Y192-W198 HydrophobicContact CD1-CH2 3.96Å; Y192-W198 HydrophobicContact CD1-CZ2 4.1Å; Y192-W198 AromaticContact CE1-CH2 3.96Å; Y192-W198 HydrophobicContact CE1-CH2 3.96Å; Y192-W198 AromaticContact CE1-CZ2 3.74Å; Y192-W198 HydrophobicContact CE1-CZ2 3.74Å
193G89.1Confident73.3Confident3 Ų368 Ų683%0.03139%0.392CS..Hα-helixtrans-62-3817600000113.6W189 R190 Q191 G197 W198W189-G193 PolarHBondContact O-N 2.76Å; R190-G193 PolarHBondContact O-N 2.91Å; Q191-G193 PolarHBondContact O-N 3Å; G193-G197 PolarHBondContact O-N 3.35Å; G193-W198 WeakPolarHBondContact O-CB 3.46Å; G193-W198 PolarHBondContact O-N 3.47Å
194V89.8Confident72.2Confident90 Ų9071.9 Ų71.955%0.54542%0.422SS..Hα-helixtrans-67.1-47.8174168.50000111.3R190 Q191 Y192 M196 G197R190-V194 WeakPolarHBondContact O-CG2 3.46Å; R190-V194 PolarHBondContact O-N 3.15Å; Q191-V194 PolarHBondContact O-N 3Å; Y192-V194 VanDerWaalsContact C-N 3.34Å; Y192-V194 PolarHBondContact O-N 3.49Å; V194-M196 VanDerWaalsContact C-N 3.31Å; V194-M196 PolarHBondContact O-N 2.8Å; V194-G197 PolarHBondContact O-N 3.36Å
195D91.2Very high71.1Confident32 Ų3272.7 Ų72.717%0.17143%0.426CS..Hα-helixtrans-65.7-33.3-178.6-62.9-28.9000112.1W20 R24 F152 Q191 Y192 G197W20-D195 PolarHBondContact NE1-OD2 3.06Å; R24-D195 IonicContact CZ-OD2 3.93Å; R24-D195 VanDerWaalsContact NH1-CG 3.29Å; R24-D195 IonicContact NH1-OD1 3.96Å; R24-D195 PolarHBondContact NH1-OD1 3.19Å; R24-D195 VanDerWaalsContact NH1-OD1 3.15Å; R24-D195 IonicContact NH1-OD2 2.77Å; R24-D195 PolarHBondContact NH1-OD2 2.84Å; F152-D195 HydrophobicContact CE2-CB 4.36Å; F152-D195 WeakPolarHBondContact CE2-O 3.41Å; Q191-D195 PolarHBondContact NE2-OD1 3.18Å; Q191-D195 PolarHBondContact NE2-OD2 3.5Å; Q191-D195 WeakPolarHBondContact O-CB 2.77Å; Q191-D195 PolarHBondContact O-N 2.74Å; Y192-D195 PolarHBondContact O-N 2.81Å; D195-G197 VanDerWaalsContact C-N 3.28Å
196M91.7Very high69.9Low17 Ų1775.1 Ų75.18%0.08444%0.438CS..THydrogen-bonded Turntrans-82.20.6173.7-63.2-65.4104.400113.6F152 L155 E159 Y192 V194 W198F152-M196 HydrophobicContact CD2-CE 3.66Å; F152-M196 HydrophobicContact CE2-CE 3.55Å; L155-M196 HydrophobicContact CB-CE 4.12Å; L155-M196 HydrophobicContact CB-SD 4.02Å; E159-M196 HydrophobicContact CG-CB 4.23Å; E159-M196 HydrophobicContact CG-CG 3.97Å; E159-M196 HydrophobicContact CG-SD 3.83Å; Y192-M196 HydrophobicContact CD1-CG 4.42Å; Y192-M196 HydrophobicContact CD2-CE 4.45Å; Y192-M196 HydrophobicContact CD2-CG 3.76Å; Y192-M196 HydrophobicContact CD2-SD 4.49Å; Y192-M196 HydrophobicContact CE1-CG 4.08Å; Y192-M196 HydrophobicContact CE2-CE 4Å; Y192-M196 HydrophobicContact CE2-CG 3.32Å; Y192-M196 HydrophobicContact CE2-SD 3.66Å; Y192-M196 HydrophobicContact CG-CG 4.29Å; Y192-M196 WeakPolarHBondContact O-CB 3.4Å; Y192-M196 VanDerWaalsContact O-CG 3.25Å; Y192-M196 WeakPolarHBondContact O-CG 3.45Å; Y192-M196 PolarHBondContact O-N 3.13Å; V194-M196 VanDerWaalsContact C-N 3.31Å; V194-M196 PolarHBondContact O-N 2.8Å; M196-W198 PolarHBondContact O-N 2.86Å
197G88.1Confident68Low52 Ų5279.8 Ų79.854%0.53646%0.458SS..THydrogen-bonded Turntrans66.830.6177.200000114.7G193 V194 D195G193-G197 PolarHBondContact O-N 3.35Å; V194-G197 PolarHBondContact O-N 3.36Å; D195-G197 VanDerWaalsContact C-N 3.28Å
198W85.9Confident66.2Low41 Ų4178.4 Ų78.416%0.15546%0.459CS..  trans-65145.2177.4-68.2-4.5000111.6R13 E159 P165 L170 W189 Y192 G193 M196 L200R13-W198 HydrophobicContact CB-CH2 4.38Å; R13-W198 HydrophobicContact CG-CH2 4.31Å; R13-W198 HydrophobicContact CG-CZ2 4.08Å; E159-W198 PolarHBondContact OE2-NE1 3.24Å; P165-W198 HydrophobicContact CB-CD2 4Å; P165-W198 HydrophobicContact CB-CE3 4.3Å; P165-W198 HydrophobicContact CB-CG 4.42Å; P165-W198 HydrophobicContact CB-CZ2 4.31Å; P165-W198 HydrophobicContact CG-CB 4.39Å; P165-W198 HydrophobicContact CG-CD2 3.91Å; P165-W198 HydrophobicContact CG-CG 3.8Å; L170-W198 HydrophobicContact CD1-CZ3 4.48Å; W189-W198 AromaticContact CE2-CZ3 3.93Å; W189-W198 AromaticContact CH2-CH2 3.57Å; W189-W198 HydrophobicContact CH2-CH2 3.57Å; W189-W198 AromaticContact CH2-CZ3 3.96Å; W189-W198 HydrophobicContact CH2-CZ3 3.96Å; W189-W198 AromaticContact CZ2-CH2 3.64Å; W189-W198 HydrophobicContact CZ2-CH2 3.64Å; W189-W198 AromaticContact CZ2-CZ3 3.51Å; W189-W198 HydrophobicContact CZ2-CZ3 3.51Å; W189-W198 HydrophobicContact CZ3-CH2 4.22Å; Y192-W198 AromaticContact CD1-CH2 3.96Å; Y192-W198 HydrophobicContact CD1-CH2 3.96Å; Y192-W198 HydrophobicContact CD1-CZ2 4.1Å; Y192-W198 AromaticContact CE1-CH2 3.96Å; Y192-W198 HydrophobicContact CE1-CH2 3.96Å; Y192-W198 AromaticContact CE1-CZ2 3.74Å; Y192-W198 HydrophobicContact CE1-CZ2 3.74Å; G193-W198 WeakPolarHBondContact O-CB 3.46Å; G193-W198 PolarHBondContact O-N 3.47Å; M196-W198 PolarHBondContact O-N 2.86Å; W198-L200 PolarHBondContact O-N 3.42Å
199P70.7Confident63.8Low106 Ų10683.9 Ų83.969%0.68849%0.49SS*.  trans-6796169.629.2-33.5000109
200L58.1Low61.3Low108 Ų10889.8 Ų89.857%0.56552%0.523SS*.PPolyproline II helixtrans-64.4131.1176.8-155.577.6000108.5W198 E202W198-L200 PolarHBondContact O-N 3.42Å; L200-E202 PolarHBondContact O-N 2.97Å; L200-E202 VanDerWaalsContact O-N 3.16Å
201P53.7Low58.9Low91 Ų9192.7 Ų92.759%0.59155%0.546SS*.PPolyproline II helixtrans-57.2123.5166.6-21.432.9000108.4C203P201-C203 PolarHBondContact O-N 3.17Å
202E37.4Very low56.1Low185 Ų18594 Ų9486%0.86457%0.568SS**PPolyproline II helixtrans-57.7116.6173.2-66.8-176.5160.700107.8L200 S204L200-E202 PolarHBondContact O-N 2.97Å; L200-E202 VanDerWaalsContact O-N 3.16Å; E202-S204 PolarHBondContact O-N 3.4Å
203C37.3Very low53.2Low112 Ų112102.7 Ų102.776%0.75761%0.609SS**  trans-67.691171.9-74.30000107.6P201 V205P201-C203 PolarHBondContact O-N 3.17Å; C203-V205 VanDerWaalsContact C-N 3.3Å; C203-V205 PolarHBondContact O-N 3.43Å
204S32.1Very low50.1Low106 Ų106110.6 Ų110.674%0.74165%0.649SS**  trans-58.396.9167.739.90000108.2E202 T206E202-S204 PolarHBondContact O-N 3.4Å; S204-T206 PolarHBondContact O-N 2.93Å; S204-T206 PolarHBondContact O-OG1 3.14Å
205V30.9Very low47.2Very low111 Ų111114.8 Ų114.867%0.67367%0.665SS**  trans-64.7106166.7179.30000105.4C203 D207C203-V205 VanDerWaalsContact C-N 3.3Å; C203-V205 PolarHBondContact O-N 3.43Å; V205-D207 PolarHBondContact O-N 2.9Å
206T32.8Very low44.3Very low123 Ų123121.3 Ų121.376%0.75570%0.695SS**  trans-75.676.5179.7-28.70000108.7S204 S208S204-T206 PolarHBondContact O-N 2.93Å; S204-T206 PolarHBondContact O-OG1 3.14Å; T206-S208 PolarHBondContact O-N 2.9Å
207D32.2Very low41.2Very low152 Ų152130.1 Ų130.181%0.81374%0.736SS**  trans-67.473.6174.5-79.9-32.4000110.4V205V205-D207 PolarHBondContact O-N 2.9Å
208S39.9Very low38.3Very low94 Ų94133.7 Ų133.766%0.65774%0.742SS**  trans-107.576.4177.9-170.10000109.4T206T206-S208 PolarHBondContact O-N 2.9Å
209V32.2Very low36.1Very low140 Ų140136.6 Ų136.685%0.84877%0.767SS**  trans-126.1123.4160.5-175.60000106.9
210N31.5Very low34Very low144 Ų144139.2 Ų139.277%0.7777%0.77SS**  trans-71146.6-167.4-72.5-79.6000113A212N210-A212 PolarHBondContact O-N 3.44Å
211L31.9Very low32.5Very low172 Ų172142.3 Ų142.390%0.90178%0.781SS**  trans-65.6119.6158.4-17377.9000108.6
212A30.9Very low31.2Very low94 Ų94146.2 Ų146.278%0.77779%0.792SS**  trans-142.1124.2167.700000108.4N210N210-A212 PolarHBondContact O-N 3.44Å
213E29.1Very low30.5Very low184 Ų184148.3 Ų148.386%0.8679%0.791SS**  trans-80.2145-172.4-61.2165.2106.400112.1
214L25.4Very low30Very low169 Ų169150.5 Ų150.589%0.88580%0.795SS**  trans-146.384.6149.1-159.8118000112.1
215M28.1Very low29.6Very low178 Ų178149.7 Ų149.788%0.87779%0.794SS**  trans48.8139.8151.3-65.6-177.665.500121.5
216E30.6Very low29.3Very low169 Ų169151.2 Ų151.279%0.7980%0.798SS**  trans-62.3149.9175.4-49.7178.7103.400114.1
217Q26.9Very low29Very low202 Ų202153.4 Ų153.494%0.94480%0.799SS**  -137.9136.5123-72-158.2-21.800111.1
218N26.3Very low29Very low127 Ų127153.5 Ų153.568%0.67980%0.8SS**  trans-131.2177176.5-138.92.1000105.4
219P40.1Very low28.9Very low102 Ų102154.8 Ų154.866%0.66281%0.806SS**  cis-140157.815.940.9-20.7000119.1
220Q26Very low29.2Very low161 Ų161155 Ų15575%0.75280%0.801SS**  trans46.6125.1136.6-62.4174.8-9.500122
221Q27.4Very low29.4Very low172 Ų172153.6 Ų153.680%0.80480%0.8SS**  -179.8148.6122.2-94170.835.500107.2
222Q26Very low29.3Very low174 Ų174155 Ų15581%0.81380%0.799SS**  cis-153.2167.80.6-130.8156.530.400109.4
223R23.6Very low29.2Very low228 Ų228155.5 Ų155.586%0.8680%0.803SS**  trans-131.3132.3178.5174.5-157-80.5172.7-5.6109.7
224L26.2Very low29.4Very low159 Ų159156.6 Ų156.683%0.83281%0.805SS**  trans165.2134.3134.2-92.1161.3000114.8
225A23.7Very low29.8Very low88 Ų88154.6 Ų154.673%0.72780%0.802SS**  trans61.2163.7152.400000118.8
226L23.6Very low29.8Very low143 Ų143149.2 Ų149.275%0.74979%0.792SS**  cis-156.5150.217.4-16967.2000112.7
227H27.4Very low29.9Very low170 Ų170147.5 Ų147.579%0.78780%0.796SS**  trans25.8137.2163.5-63.9-51.1000125.8
228N32.8Very low29.9Very low154 Ų154143.9 Ų143.982%0.82479%0.791SS**  trans-69.7156.9155.4-99.2-58.7000112.3
229P37.6Very low30.1Very low121 Ų121145.8 Ų145.879%0.78680%0.801SS**  -145.6159.7103.238.1-23.1000117.5
230L38.2Very low29.8Very low143 Ų143146.9 Ų146.975%0.74981%0.808SS**PPolyproline II helixtrans-77.4140.8177.9170.876000114.1
231P35.4Very low30Very low116 Ų116148.5 Ų148.575%0.75382%0.815SS**PPolyproline II helixtrans-92.3143.7158.234.6-31.4000112.8
232K30.1Very low30Very low202 Ų202143.1 Ų143.188%0.87881%0.806SS**PPolyproline II helixtrans-101.3146.3175.4-65.4173.6179.7172.80111.1
233A28.8Very low30.3Very low103 Ų103141.4 Ų141.485%0.85181%0.81SS**  trans-122.1153.7165.400000110.9
234K32.3Very low30.5Very low207 Ų207135.7 Ų135.790%0.981%0.805SS**PPolyproline II helixtrans-103.6157.1-178.4-84.2-174.5176.6-178.30111.8
235P34.7Very low31.1Very low128 Ų128133.9 Ų133.983%0.83181%0.806SS**PPolyproline II helixtrans-79.1152.6-171.932-36.7000114.2
236G27.3Very low31.4Very low64 Ų64140 Ų14066%0.6681%0.81SS**PPolyproline II helixtrans-92.6166.6166.200000112.8
237P33.9Very low31.7Very low134 Ų134139.6 Ų139.687%0.8781%0.813SS**PPolyproline II helixtrans-82.1145.8-167.932.2-35.9000114.5
238C27.1Very low31.9Very low126 Ų126139.6 Ų139.685%0.85181%0.813SS**PPolyproline II helixtrans-81.2144.1173.1-56.50000112.1
239L30.1Very low32.2Very low167 Ų167138 Ų13887%0.87481%0.812SS**PPolyproline II helixtrans-101.2143.1160.5-75.4168.6000109.6
240P33.3Very low32.5Very low125 Ų125138.6 Ų138.681%0.81280%0.804SS**PPolyproline II helixtrans-79.9122.8-175.930.7-33.4000112
241Q30Very low32.9Very low195 Ų195136.2 Ų136.291%0.91180%0.797SS**PPolyproline II helixtrans-81.2132.1162.7-93.7-177.6-18.400110.3
242G28.8Very low33.7Very low58 Ų58135.3 Ų135.360%0.59879%0.785SS**PPolyproline II helixtrans-71.5162.6172.500000112.8S244G242-S244 PolarHBondContact O-N 3.27Å; G242-S244 VanDerWaalsContact O-N 3.08Å
243P31.9Very low34.7Very low138 Ų138126 Ų12690%0.89675%0.745SS**  trans-70.5105.1-174.828.8-34.8000111.8S245P243-S245 PolarHBondContact O-N 3.03Å
244S27.9Very low35.9Very low109 Ų109121 Ų12176%0.76271%0.705SS**  trans-80.499.6171.845.30000110.5G242 R246G242-S244 PolarHBondContact O-N 3.27Å; G242-S244 VanDerWaalsContact O-N 3.08Å; S244-R246 PolarHBondContact O-N 3.4Å
245S38.5Very low37.1Very low121 Ų121118.4 Ų118.485%0.84669%0.689SS**  trans-70.876.6174.6560000111.4P243 T247P243-S245 PolarHBondContact O-N 3.03Å; S245-T247 PolarHBondContact O-N 3Å
246R30.6Very low38.2Very low217 Ų217114.2 Ų114.282%0.81966%0.659SS**  trans-93.491.3175.9-154.7173.1-164.2177.44110.4S244 H248S244-R246 PolarHBondContact O-N 3.4Å; R246-H248 PolarHBondContact O-N 3.16Å
247T30.1Very low39.7Very low133 Ų133111.4 Ų111.482%0.81663%0.628SS**PPolyproline II helixtrans-56.3116.1164.530.90000109.3S245 P249S245-T247 PolarHBondContact O-N 3Å; T247-P249 WeakPolarHBondContact O-CD 3.44Å
248H30.7Very low40.9Very low170 Ų170110.2 Ų110.279%0.78762%0.615SS**PPolyproline II helixtrans-72.5128.2168.3-76.4-102.7000108.7R246 E250R246-H248 PolarHBondContact O-N 3.16Å; H248-E250 PolarHBondContact O-N 3.05Å
249P38.3Very low42.3Very low122 Ų122104.3 Ų104.379%0.79257%0.574SS**PPolyproline II helixtrans-59.2129163.6-2133.7000109.4T247T247-P249 WeakPolarHBondContact O-CD 3.44Å
250E44.8Very low42.6Very low133 Ų13398.9 Ų98.962%0.62155%0.554SS**PPolyproline II helixtrans-73.6134.2178.4-155.9155.7-140.800108.8H248 L252 R266H248-E250 PolarHBondContact O-N 3.05Å; E250-L252 WeakPolarHBondContact O-CG 3.46Å; E250-L252 PolarHBondContact O-N 2.87Å; E250-R266 IonicContact OE1-CZ 2.86Å; E250-R266 IonicContact OE1-NH2 2.82Å; E250-R266 PolarHBondContact OE1-NH2 2.87Å; E250-R266 IonicContact OE2-NH2 3.34Å
251P47.1Very low42.5Very low93 Ų9397.1 Ų97.160%0.60454%0.542SS*.  trans-64.7107.7-172.4-24.935.5000113.4A253P251-A253 VanDerWaalsContact C-N 3.28Å; P251-A253 PolarHBondContact O-N 3.03Å
252L51.8Low42.9Very low96 Ų9693.1 Ų93.150%0.50353%0.527SS..  trans-79.962.9-174.3-60175.4000112.9E138 E250 G254 R255E138-L252 WeakPolarHBondContact CA-O 3.17Å; E250-L252 WeakPolarHBondContact O-CG 3.46Å; E250-L252 PolarHBondContact O-N 2.87Å; L252-G254 PolarHBondContact O-N 3.23Å; L252-G254 VanDerWaalsContact O-N 3.17Å; L252-R255 VanDerWaalsContact CD1-NH2 3.33Å
253A50.3Low43.3Very low6 Ų693.5 Ų93.55%0.0553%0.53CS..  trans-74.5100.5-17900000112.5P142 P251P142-A253 HydrophobicContact CB-CB 3.74Å; P251-A253 VanDerWaalsContact C-N 3.28Å; P251-A253 PolarHBondContact O-N 3.03Å
254G53.4Low43.2Very low0 Ų098.2 Ų98.20%053%0.53CS..  trans47.972.9174.800000114.9E138 L252 H256 F257 N258E138-G254 PolarHBondContact O-N 2.99Å; L252-G254 PolarHBondContact O-N 3.23Å; L252-G254 VanDerWaalsContact O-N 3.17Å; G254-H256 PolarHBondContact O-N 2.77Å; G254-F257 PolarHBondContact O-N 3.02Å; G254-N258 PolarHBondContact O-N 3.24Å
255R59.2Low43.3Very low152 Ų152104.3 Ų104.357%0.57454%0.536SS*.THydrogen-bonded Turntrans-52.6-44.7179.9-62.5168.6156.9168.9-6.1111E138 L252 F257 N258E138-R255 WeakPolarHBondContact OE1-CA 3.47Å; E138-R255 WeakPolarHBondContact OE1-CB 3.32Å; E138-R255 WeakPolarHBondContact OE1-CG 3.41Å; E138-R255 PolarHBondContact OE1-N 2.92Å; L252-R255 VanDerWaalsContact CD1-NH2 3.33Å; R255-F257 PolarHBondContact O-N 3.11Å; R255-N258 PolarHBondContact O-ND2 3.39Å
256H57.3Low43Very low40 Ų40107.7 Ų107.719%0.18553%0.531CS..THydrogen-bonded Turntrans-58.9-42.5178.6-64.2-76.8000112.9A110 T113 Q117 E138 G254A110-H256 WeakPolarHBondContact CB-O 3.21Å; T113-H256 VanDerWaalsContact CB-ND1 3.25Å; T113-H256 WeakPolarHBondContact CB-ND1 3.44Å; T113-H256 PolarHBondContact OG1-ND1 3.03Å; Q117-H256 PolarHBondContact NE2-NE2 2.97Å; Q117-H256 PolarHBondContact OE1-CD2 2.92Å; E138-H256 IonicContact OE1-CD2 3.38Å; E138-H256 PolarHBondContact OE1-CD2 2.77Å; E138-H256 IonicContact OE2-CD2 3.71Å; G254-H256 PolarHBondContact O-N 2.77Å
257F59.1Low42.9Very low4 Ų4103.3 Ų103.32%0.01853%0.528CS..THydrogen-bonded Turntrans-100.7-1-170.4-62.5-68000114.9M59 A63 F87 A110 F114 Y139 F143 G254 R255 L259M59-F257 HydrophobicContact CB-CD1 3.66Å; M59-F257 HydrophobicContact CB-CE1 3.62Å; M59-F257 HydrophobicContact CE-CD1 4.1Å; M59-F257 HydrophobicContact CG-CD1 4.46Å; M59-F257 HydrophobicContact CG-CE1 4.23Å; M59-F257 HydrophobicContact SD-CD1 4.05Å; M59-F257 HydrophobicContact SD-CE1 3.9Å; A63-F257 HydrophobicContact CB-CD2 4.2Å; A63-F257 HydrophobicContact CB-CE2 3.46Å; A63-F257 VanDerWaalsContact CB-CE2 3.46Å; A63-F257 HydrophobicContact CB-CZ 3.85Å; F87-F257 HydrophobicContact CE1-CE1 4.37Å; F87-F257 HydrophobicContact CE1-CZ 4.28Å; F87-F257 HydrophobicContact CZ-CZ 4.28Å; A110-F257 HydrophobicContact CB-CD1 3.91Å; A110-F257 HydrophobicContact CB-CE1 4.06Å; F114-F257 HydrophobicContact CB-CE2 3.94Å; F114-F257 HydrophobicContact CB-CZ 3.56Å; F114-F257 HydrophobicContact CD1-CE2 4.39Å; F114-F257 AromaticContact CD1-CZ 3.97Å; F114-F257 HydrophobicContact CD1-CZ 3.97Å; F114-F257 AromaticContact CD2-CE2 3.92Å; F114-F257 HydrophobicContact CD2-CE2 3.92Å; F114-F257 HydrophobicContact CD2-CZ 4.25Å; F114-F257 AromaticContact CG-CE2 3.82Å; F114-F257 HydrophobicContact CG-CE2 3.82Å; F114-F257 AromaticContact CG-CZ 3.66Å; F114-F257 HydrophobicContact CG-CZ 3.66Å; Y139-F257 AromaticContact CE1-CD2 3.82Å; Y139-F257 HydrophobicContact CE1-CD2 3.82Å; Y139-F257 AromaticContact CE1-CE2 3.81Å; Y139-F257 HydrophobicContact CE1-CE2 3.81Å; Y139-F257 WeakPolarHBondContact OH-CE2 3.35Å; F143-F257 HydrophobicContact CE2-CD2 4.2Å; G254-F257 PolarHBondContact O-N 3.02Å; R255-F257 PolarHBondContact O-N 3.11Å; F257-L259 VanDerWaalsContact C-N 3.29Å; F257-L259 HydrophobicContact CB-CD1 4.49Å; F257-L259 HydrophobicContact CB-CD2 4.46Å; F257-L259 HydrophobicContact CB-CG 3.94Å; F257-L259 WeakPolarHBondContact O-CD2 3.27Å; F257-L259 PolarHBondContact O-N 2.92Å
258N58.4Low42.7Very low110 Ų110104.1 Ų104.159%0.58852%0.522SS*.THydrogen-bonded Turntrans5149-178.6-73.5-96.9000111.9R56 G254 R255 A260R56-N258 PolarHBondContact NH2-O 3.24Å; G254-N258 PolarHBondContact O-N 3.24Å; R255-N258 PolarHBondContact O-ND2 3.39Å; N258-A260 VanDerWaalsContact C-N 3.32Å
259L55.9Low42.7Very low1 Ų1100.6 Ų100.61%0.00552%0.517CS..  trans-9625.4175.4-57.2-163.5000112.3R56 F143 A146 M147 L150 F257R56-L259 HydrophobicContact CB-CD2 4.08Å; R56-L259 HydrophobicContact CG-CD2 4.45Å; F143-L259 HydrophobicContact CD2-CB 4.27Å; F143-L259 HydrophobicContact CD2-CD1 3.8Å; F143-L259 HydrophobicContact CD2-CG 4.34Å; F143-L259 HydrophobicContact CE2-CD1 3.57Å; F143-L259 HydrophobicContact CE2-CG 4.27Å; F143-L259 HydrophobicContact CG-CD1 4.42Å; F143-L259 HydrophobicContact CZ-CD1 3.99Å; A146-L259 HydrophobicContact CB-CB 4.04Å; A146-L259 WeakPolarHBondContact CB-O 3.31Å; M147-L259 HydrophobicContact CB-CD1 4.34Å; L150-L259 HydrophobicContact CD1-CD2 3.64Å; F257-L259 VanDerWaalsContact C-N 3.29Å; F257-L259 HydrophobicContact CB-CD1 4.49Å; F257-L259 HydrophobicContact CB-CD2 4.46Å; F257-L259 HydrophobicContact CB-CG 3.94Å; F257-L259 WeakPolarHBondContact O-CD2 3.27Å; F257-L259 PolarHBondContact O-N 2.92Å
260A36.8Very low42.5Very low53 Ų53102.2 Ų102.244%0.43851%0.514SS..  trans-62.3138.6175.400000111.3N258 L262N258-A260 VanDerWaalsContact C-N 3.32Å; A260-L262 PolarHBondContact O-N 3.43Å
261P32.5Very low41.7Very low88 Ų88107.4 Ų107.457%0.57153%0.528SS*.  trans-67.6104.9177.726.5-33.6000110.6G263P261-G263 PolarHBondContact O-N 3.29Å
262L38.4Very low40.8Very low112 Ų112107.4 Ų107.459%0.58654%0.535SS*.  trans-64.779.4172.6-65.3174.5000110.1A260A260-L262 PolarHBondContact O-N 3.43Å
263G35.3Very low39.8Very low65 Ų65108.2 Ų108.267%0.6755%0.549SS*.  trans-151.75.1-161.900000117.4P261P261-G263 PolarHBondContact O-N 3.29Å
264R29.9Very low39Very low238 Ų238114.1 Ų114.190%0.89859%0.585SS**  trans-149.895.4167.8-108.9179.1-170.9-88.5-1.6111.9R266R264-R266 PolarHBondContact O-N 2.62Å
265R29.9Very low38Very low236 Ų236126.1 Ų126.189%0.89163%0.63SS**  trans-58.3124159.4-73.2-171-173.9-119.11.5107.7V267R265-V267 PolarHBondContact O-N 3.04Å
266R32.4Very low36.7Very low192 Ų192122.5 Ų122.573%0.72564%0.64SS**  trans-66.4102.5157.4-63.2-177.4-169.5-151.23.6105.5E250 R264 Q268E250-R266 IonicContact OE1-CZ 2.86Å; E250-R266 IonicContact OE1-NH2 2.82Å; E250-R266 PolarHBondContact OE1-NH2 2.87Å; E250-R266 IonicContact OE2-NH2 3.34Å; R264-R266 PolarHBondContact O-N 2.62Å; R266-Q268 PolarHBondContact O-N 3.01Å
267V28.4Very low35.3Very low126 Ų126124.2 Ų124.276%0.76467%0.669SS**  trans-71.476.1164.7-178.20000106.2R265 S269R265-V267 PolarHBondContact O-N 3.04Å; V267-S269 PolarHBondContact O-N 3.34Å
268Q27.7Very low34.1Very low150 Ų150133.2 Ų133.270%0.70171%0.71SS**  trans-76.284.1173.6-167.41736.900106.5R266 Q270R266-Q268 PolarHBondContact O-N 3.01Å; Q268-Q270 HydrophobicContact CG-CG 4.3Å; Q268-Q270 PolarHBondContact O-N 3.26Å
269S30.6Very low33.1Very low96 Ų96137.8 Ų137.867%0.67173%0.725SS**  trans-67.978.2-178.555.90000110.5V267 W271V267-S269 PolarHBondContact O-N 3.34Å; S269-W271 PolarHBondContact O-N 3.18Å
270Q32.4Very low32.1Very low155 Ų155146.8 Ų146.872%0.72477%0.767SS**  trans-72.558.2170.2-69.9-168.6-10.600111Q268Q268-Q270 HydrophobicContact CG-CG 4.3Å; Q268-Q270 PolarHBondContact O-N 3.26Å
271W28.7Very low31.9Very low243 Ų243155.6 Ų155.692%0.9279%0.789SS**  trans-122.559.5165.1-77.795000108.5S269 S273S269-W271 PolarHBondContact O-N 3.18Å; W271-S273 PolarHBondContact O-N 3.42Å
272A29.1Very low32.2Very low92 Ų92157 Ų15776%0.7680%0.798SS**  trans-67.686.6164.800000108.2T274A272-T274 PolarHBondContact O-N 3.39Å
273S30.3Very low32Very low113 Ų113157.8 Ų157.879%0.7981%0.807SS**  trans-66.294.9-177.2-173.40000110.8W271 R275W271-S273 PolarHBondContact O-N 3.42Å; S273-R275 PolarHBondContact O-N 3.43Å
274T32.8Very low31.9Very low131 Ų131160.3 Ų160.380%0.80481%0.81SS**  trans-65.5111.5171.946.30000109.5A272 G276A272-T274 PolarHBondContact O-N 3.39Å; T274-G276 PolarHBondContact O-N 3.16Å
275R33.8Very low32.1Very low252 Ų252155.6 Ų155.695%0.95180%0.8SS**SBendtrans-56.4120.2179.4172.8-168.3-83.1-133.9-1.8111.6S273S273-R275 PolarHBondContact O-N 3.43Å
276G30.9Very low32.2Very low76 Ų76152.1 Ų152.178%0.78480%0.798SS**  trans142.799.3159.700000114.6T274T274-G276 PolarHBondContact O-N 3.16Å
277G28.7Very low32.2Very low76 Ų76150.5 Ų150.578%0.78480%0.796SS**  trans16689.7173.700000113.7K279G277-K279 PolarHBondContact O-N 2.82Å
278H34.1Very low32.5Very low192 Ų192150 Ų15089%0.88980%0.796SS**  trans-71.2125.8170.7-79.3-102.7000110.9
279K35.7Very low32.8Very low206 Ų206152.3 Ų152.390%0.89680%0.804SS**  trans-165.8126.5142-105.8150.7-172.2176.10109.9G277G277-K279 PolarHBondContact O-N 2.82Å
280E34.9Very low33Very low191 Ų191158.4 Ų158.489%0.89381%0.812SS**  trans-72.6150-177.5-61164132.700111.1
281R33.6Very low32.9Very low238 Ų238157.6 Ų157.690%0.89881%0.813SS**  trans-136.3145.2159.2-77.4-166.3170.6-175.7-2.9109.3
282P38.9Very low33.1Very low117 Ų117154.5 Ų154.576%0.7681%0.813SS**  trans-79.2146-157.630.1-36.5000113.8V284P282-V284 PolarHBondContact O-N 2.86Å
283T33.5Very low33Very low128 Ų128153.9 Ų153.979%0.78582%0.815SS**  trans-64.8119.2168.8-53.80000110.7M285T283-M285 HydrophobicContact CG2-CG 3.81Å
284V33.9Very low33.1Very low119 Ų119154.2 Ų154.272%0.72182%0.818SS**  trans-114.2103.9162.11800000107.6P282P282-V284 PolarHBondContact O-N 2.86Å
285M33.5Very low33.8Very low139 Ų139153.4 Ų153.469%0.68582%0.815SS**  trans-81.6125.4172.2-63.2-162.8-63.100109.5T283 F287T283-M285 HydrophobicContact CG2-CG 3.81Å; M285-F287 HydrophobicContact CE-CE2 3.96Å; M285-F287 HydrophobicContact SD-CE2 4.5Å
286L33.1Very low33.5Very low163 Ų163148.3 Ų148.385%0.85381%0.812SS**  trans-105.9104.3168.8-73.7171.3000109.3
287F32.3Very low33.5Very low157 Ų157153 Ų15369%0.68981%0.814SS**  trans-79.4145.3168.3-80-81000110.7M285 F289M285-F287 HydrophobicContact CE-CE2 3.96Å; M285-F287 HydrophobicContact SD-CE2 4.5Å; F287-F289 HydrophobicContact CB-CE2 4.42Å
288P35Very low33.4Very low116 Ų116155.4 Ų155.475%0.75381%0.813SS**  trans-83.4139.5176.833.5-33.6000111.8
289F33.8Very low33.2Very low199 Ų199153.2 Ų153.287%0.87381%0.806SS**  trans-130.6154.9166.7-79.6-76000111.6F287F287-F289 HydrophobicContact CB-CE2 4.42Å
290R35.1Very low32.9Very low224 Ų224148.9 Ų148.985%0.84580%0.801SS**  trans-98.3150-172.5-77.6176.3163.3-176.6-5.8112.2
291N30.3Very low32.7Very low137 Ų137149.1 Ų149.173%0.73380%0.8SS**  trans40.4124.8142.4-52.4-5.2000119.9
292L32Very low33.4Very low179 Ų179142.9 Ų142.994%0.93779%0.79SS**  173.6152.6110.5-93.2163.2000112.1
293G27.7Very low32.9Very low78 Ų78145.1 Ų145.180%0.80479%0.79SS**  trans108.4117.715200000118.8
294S30.9Very low32.6Very low120 Ų120144.1 Ų144.184%0.83979%0.789SS**  trans-168.8169.1158.866.20000108.5
295P47.3Very low32.5Very low114 Ų114146.3 Ų146.374%0.7479%0.789SS**  cis-126.4176.4-24.640-26.5000113
296T28.6Very low32.2Very low146 Ų146147 Ų14790%0.89679%0.79SS**  trans-140.4154.2163.2-46.20000111.1
297Q29.8Very low32.1Very low175 Ų175146.4 Ų146.482%0.81878%0.783SS**  trans-108.5-158.1-170.6-51.7-179.86.500113.9
298V27.1Very low31.8Very low125 Ų125147 Ų14776%0.75879%0.788SS**  trans101.3102.6174.5-177.50000112.4
299I30.4Very low31.4Very low147 Ų147145.9 Ų145.975%0.75479%0.788SS**  72.8130.871.4-64.5163.3000110.5
300S29.4Very low31.2Very low114 Ų114143.3 Ų143.380%0.79778%0.782SS**  cis-151.8178.634.349.60000116.5
301K29.5Very low30.7Very low196 Ų196142.5 Ų142.585%0.85278%0.78SS**  trans-120.4-176.2162.9-104.3-171.6177.5-173.60108.3
302P49.3Very low30.6Very low108 Ų108141.8 Ų141.870%0.70178%0.781SS**  cis-123.9-152.71.541.3-21.1000111.6
303E28Very low30.4Very low164 Ų164137.3 Ų137.377%0.76677%0.769SS**  cis-139.8-124.7-1.9-150.9174.685.300112.6
304S27.7Very low30.2Very low107 Ų107140.1 Ų140.175%0.74877%0.766SS**  cis-149.5-145.74.264.70000113.2
305K31.1Very low30.1Very low165 Ų165141.7 Ų141.772%0.71776%0.764SS**  trans-118.7-177.9-173-56.5179.9178.7-178.50111.8
306E28Very low29.1Very low153 Ų153140.1 Ų140.172%0.71576%0.761SS**  cis-159-16622.9-150149.9104.600114.1
307E30Very low29Very low150 Ų150141.8 Ų141.870%0.70176%0.761SS**  trans-86.4158.1-145-71.4171.6-16700123.2
308H26.5Very low28.9Very low171 Ų171137.2 Ų137.279%0.79276%0.761SS**  trans61.6157.6133.3-66.5-44.1000128
309A26.4Very low29.1Very low91 Ų91136.7 Ų136.775%0.75276%0.758SS**  trans81.5151154.500000121
310I30.3Very low29Very low146 Ų146141.5 Ų141.575%0.74977%0.767SS**  cis-166.1142.5-24-119.2173.9000111.3
311Y24.2Very low28.8Very low206 Ų206140.2 Ų140.281%0.80876%0.763SS**  trans59.5169.9163.6-79.1-119.7000118
312T28.8Very low28.7Very low122 Ų122135 Ų13575%0.74876%0.756SS**  cis-158.6147.123.2-27.30000113.2
313A27.3Very low27.8Very low85 Ų85135.1 Ų135.170%0.70276%0.76SS**  trans56.2170.1149.800000120.4
314D24.6Very low27.8Very low138 Ų138133.9 Ų133.974%0.73876%0.764SS**  cis-160.1163.4-1.8-139.6-9.5000113.1
315L27.1Very low27.8Very low153 Ų153132.4 Ų132.480%0.80177%0.765SS**  trans52162161.8-8877.5000120.2
316A27.1Very low27.8Very low81 Ų81134.7 Ų134.767%0.66978%0.775SS**  cis-160.1146.8-21.300000113.1
317M27.3Very low28Very low180 Ų180132.1 Ų132.189%0.88777%0.774SS**  trans12.7126.2141.7-171.9174.1178.500121
318G28.2Very low28.1Very low80 Ų80134.8 Ų134.883%0.82578%0.783SS**  trans-159.4116.1162.700000113
319T29.8Very low28.1Very low114 Ų114132.3 Ų132.370%0.69979%0.785SS**  trans-124.5133.7-168.1-44.40000112.9
320R28.4Very low28.7Very low248 Ų248133.7 Ų133.794%0.93679%0.787SS**  trans147.4163153.6-86.7166.7178.9-169.11.4111
321A25.7Very low28.6Very low86 Ų86133 Ų13371%0.71179%0.793SS**  cis-174159.3-34.100000110.4
322A26.6Very low28.9Very low86 Ų86132.4 Ų132.471%0.71180%0.798SS**  trans63.9111.114900000122
323S30.6Very low28.9Very low111 Ų111133.7 Ų133.778%0.77681%0.806SS**  81.7161.1126.486.90000118.7
324T28.7Very low29.1Very low139 Ų139137.9 Ų137.985%0.85382%0.815SS**  cis-138.9169.1-2.644.50000109.5
325G27.5Very low29.1Very low75 Ų75135 Ų13577%0.77382%0.818SS**  trans158.8135160.800000116.6
326K31.7Very low29.2Very low213 Ų213131.3 Ų131.393%0.92682%0.817SS**  trans-118.6172.6164.6-55172.3179.5168.90106.6
327S31.6Very low29.3Very low99 Ų99139.7 Ų139.769%0.69283%0.831SS**  cis-166.7148.821.153.80000114
328K31.7Very low29.4Very low206 Ų206135.6 Ų135.690%0.89683%0.826SS**  trans42.8126.8139-63.6-178.1174.2-174.70121.8
329S27.6Very low29.3Very low119 Ų119139.6 Ų139.683%0.83283%0.828SS**  -151.3146127.565.20000110.8
330P38Very low29.4Very low121 Ų121141.7 Ų141.779%0.78683%0.827SS**  trans-136.9146.7169.838.8-24.7000114.7
331C28Very low29.3Very low131 Ų131137.7 Ų137.789%0.88582%0.819SS**  trans-143.7115.2165.8-82.30000111.3
332Q31.2Very low29.5Very low194 Ų194140.5 Ų140.591%0.90782%0.822SS**  trans-148.9138.9157.9-72.6-168.2300108.6
333T28.2Very low30.5Very low149 Ų149141.8 Ų141.891%0.91482%0.823SS**  trans-137.2134.1172.6-51.40000108.8
334L30.9Very low30.4Very low173 Ų173142.2 Ų142.291%0.90682%0.821SS**  trans-145132.5-174.3-168.3162.8000108
335G25.8Very low30.3Very low76 Ų76143 Ų14378%0.78482%0.82SS**  trans180137176.200000113.7
336G28.8Very low30.5Very low76 Ų76146.7 Ų146.778%0.78482%0.821SS**  trans-145179.3172.800000110.7
337R29.8Very low30.8Very low258 Ų258142.5 Ų142.597%0.97482%0.815SS**  trans-157.5161.3175-108.2179.7-168.9-93.5-0.2111.8
338A28.3Very low30.5Very low94 Ų94141.9 Ų141.978%0.77782%0.816SS**  trans-150.9142.9175.500000112.3
339L26.3Very low30.5Very low164 Ų164138.9 Ų138.986%0.85982%0.815SS**  trans-176.2117160-133.761.2000104.9
340K31.5Very low30.6Very low158 Ų158142.3 Ų142.369%0.68782%0.818SS**  74.498.157.1-170.5-119.1175-164.40113.6
341E27.4Very low30.2Very low163 Ų163145.3 Ų145.376%0.76282%0.822SS**  -171.6171.2122.5-105.7160.3-155.400113.6
342N29.3Very low30.2Very low146 Ų146148.9 Ų148.978%0.78182%0.822SS**  trans-162150.2-165.1-154.9-11.3000108.3
343P47.4Very low30.4Very low113 Ų113147.7 Ų147.773%0.73482%0.817SS**  -154.1147.4109.637-18.6000118.3
344V27.9Very low30.4Very low120 Ų120147.7 Ų147.773%0.72781%0.811SS**  trans56.5114.3135-178.80000119.9
345D26.9Very low30.6Very low156 Ų156144.9 Ų144.983%0.83481%0.805SS**  -153.9168.7107.6-127.7-33.7000113
346L32.3Very low30.7Very low151 Ų151148.5 Ų148.579%0.79181%0.805SS**  trans-103.2175.2-168.2-83.4170.2000113.3
347P36.9Very low30.7Very low125 Ų125151.9 Ų151.981%0.81281%0.805SS**  cis-131.7-174.916.143.3-25.7000116.6
348A26.2Very low30.5Very low86 Ų86145.3 Ų145.371%0.71180%0.798SS**  trans-94.4158.2-173.200000115.2
349T30.9Very low30.5Very low143 Ų143150 Ų15088%0.87780%0.797SS**  trans-124140.6153.644.50000108.6
350E31.6Very low31.1Very low191 Ų191150 Ų15089%0.89380%0.795SS**  trans-82.4173.7-166.1-67.5-172.1132.500114.7
351Q29.3Very low30.9Very low185 Ų185148.7 Ų148.786%0.86480%0.795SS**  trans-63.4137.3-156.5-76.7163.7-107.500115.9E353Q351-E353 PolarHBondContact O-N 3.34Å
352K28.1Very low31.1Very low206 Ų206146.1 Ų146.190%0.89679%0.792SS**  trans-87.991.3166.4-179.8-171.3176.6-178.20110.1
353E35.1Very low31.3Very low168 Ų168147.1 Ų147.179%0.78580%0.797SS**  trans-92.3127.7149.3-72.2-162139.500109.2Q351Q351-E353 PolarHBondContact O-N 3.34Å
354N28.1Very low30.5Very low149 Ų149153.3 Ų153.380%0.79781%0.805SS**  trans-178.7130.5139.3-98.6-48.6000109.6
355C34Very low30.6Very low115 Ų115155.1 Ų155.178%0.77781%0.81SS**  trans-73.7140.3163.3-166.10000108.5
356L27.7Very low30.6Very low151 Ų151153.6 Ų153.679%0.79181%0.812SS**  trans-138.3113.5172.1-78.9176.6000110.1
357D28.7Very low30.5Very low147 Ų147154.5 Ų154.579%0.78682%0.817SS**  trans-62.9133.9166.5-69.2-74.5000110.8Y359D357-Y359 PolarHBondContact O-N 2.85Å
358C26.6Very low30Very low121 Ų121156.4 Ų156.482%0.81882%0.819SS**  trans-77.165.5175.3-70.70000111.7M360C358-M360 PolarHBondContact O-N 2.88Å
359Y28.1Very low30.3Very low192 Ų192157.7 Ų157.775%0.75382%0.82SS**  trans-67.7120.1170-160.6-86.3000109.7D357D357-Y359 PolarHBondContact O-N 2.85Å
360M39.1Very low30.4Very low165 Ų165156.9 Ų156.981%0.81382%0.817SS**  trans-107.9101.5-179-69.7-74.996.700110.3C358C358-M360 PolarHBondContact O-N 2.88Å
361D27.1Very low30.4Very low129 Ų129159.5 Ų159.569%0.6982%0.819SS**  trans-78.3142.8-179.1-145.123.8000111.1L363D361-L363 PolarHBondContact O-N 3.2Å
362P33Very low30.5Very low110 Ų110155.6 Ų155.671%0.71482%0.818SS**  trans-84.5112.1-16731.5-32.2000112.8R364P362-R364 PolarHBondContact O-N 3.09Å; P362-R364 VanDerWaalsContact O-N 3.08Å
363L32.3Very low30.8Very low167 Ų167157.5 Ų157.587%0.87482%0.82SS**  trans-60.6109.3176.1-71.4174.2000112.5D361 L365D361-L363 PolarHBondContact O-N 3.2Å; L363-L365 PolarHBondContact O-N 2.66Å
364R31.2Very low30.7Very low242 Ų242158.8 Ų158.891%0.91382%0.823SS**  trans-71.1116164-72.6-176.3172.5-171.8-1.5109.8P362P362-R364 PolarHBondContact O-N 3.09Å; P362-R364 VanDerWaalsContact O-N 3.08Å
365L29.4Very low30.7Very low159 Ų159157.8 Ų157.883%0.83282%0.824SS**PPolyproline II helixtrans-96.3123.9167.2-73.2171000110.2L363L363-L365 PolarHBondContact O-N 2.66Å
366S27.3Very low30.4Very low123 Ų123158.9 Ų158.986%0.8683%0.828SS**PPolyproline II helixtrans-70.5130.7-179.7-56.20000111.7
367L30Very low30.5Very low171 Ų171157.1 Ų157.190%0.89583%0.827SS**PPolyproline II helixtrans-80.8133178-66.2169.7000111.6
368L26.8Very low30.6Very low164 Ų164155.7 Ų155.786%0.85983%0.825SS**  trans-124.3141.1157.1-80.7171.3000108.8
369P32.1Very low30.9Very low114 Ų114155.8 Ų155.874%0.7482%0.824SS**PPolyproline II helixtrans-82.9141.7-161.531-35.9000113.8
370P33.2Very low30.9Very low125 Ų125152 Ų15281%0.81283%0.826SS**PPolyproline II helixtrans-71143.8170.530.1-34000111.5
371R31.2Very low30.7Very low247 Ų247152 Ų15293%0.93283%0.829SS**PPolyproline II helixtrans-66.6140.1175.3-77.8179.5169.7168.5-3.9111.3
372A30.6Very low30.8Very low103 Ų103152 Ų15285%0.85184%0.837SS**PPolyproline II helixtrans-62135.1-17600000113.8
373R36.3Very low30.9Very low245 Ų245149.8 Ų149.893%0.92582%0.824SS**  trans-119.7148.6152.7-76.3-174.6169.4-175.2-2.7108.1
374K32.4Very low31.1Very low195 Ų195147.1 Ų147.185%0.84882%0.82SS**  trans-69.1148.2-171.9-68.9-178.5177.5-1790111.5
375P27.9Very low31.5Very low128 Ų128142.4 Ų142.483%0.83181%0.811SS**  trans-67.5142.7177.329.1-35.2000111.3
376V27.8Very low32.5Very low139 Ų139137.4 Ų137.484%0.84278%0.784SS**  trans-110.7136.8163.2177.70000106.6
377C30.1Very low33.2Very low114 Ų114134.6 Ų134.677%0.7776%0.762SS**PPolyproline II helixtrans-61.8145.8-176.7-58.10000111.6
378P31Very low33.7Very low117 Ų117130.8 Ų130.876%0.7674%0.742SS**PPolyproline II helixtrans-65.2138.1174.828.3-34.3000110.3
379P32.7Very low34Very low123 Ų123126.4 Ų126.480%0.79974%0.736SS**PPolyproline II helixtrans-64.3147.5168.928.5-33.6000110.2L381P379-L381 PolarHBondContact O-N 2.96Å
380S28.5Very low34.6Very low113 Ų113124.5 Ų124.579%0.7972%0.72SS**PPolyproline II helixtrans-60.7130.4-175.152.30000112.7C382S380-C382 PolarHBondContact O-N 3.23Å
381L33.9Very low34.9Very low165 Ų165120.6 Ų120.686%0.86469%0.692SS**  trans-57.7108.3173-74.9164.3000111P379P379-L381 PolarHBondContact O-N 2.96Å
382C28.2Very low35.4Very low127 Ų127113.2 Ų113.286%0.85867%0.674SS**  trans-113.253.8163.4-156.90000109.1S380 S384S380-C382 PolarHBondContact O-N 3.23Å; C382-S384 PolarHBondContact O-N 3.49Å
383S35.4Very low35.9Very low65 Ų65113.5 Ų113.546%0.45566%0.66SS.*  trans-74.6115.7173.254.90000109.3I385S383-I385 PolarHBondContact O-N 3.49Å; S383-I385 VanDerWaalsContact O-N 3.09Å
384S37.8Very low36.1Very low111 Ų111103.4 Ų103.478%0.77663%0.625SS**  trans-53.5116168.5-580000109.4C382 I386C382-S384 PolarHBondContact O-N 3.49Å; S384-I386 PolarHBondContact O-N 2.77Å
385I39.1Very low36.4Very low143 Ų14398.7 Ų98.773%0.73362%0.616SS**  trans-71.8102.3177.4-57.4175.2000107.1S383 T387S383-I385 PolarHBondContact O-N 3.49Å; S383-I385 VanDerWaalsContact O-N 3.09Å; I385-T387 HydrophobicContact CG2-CG2 4.09Å; I385-T387 PolarHBondContact O-N 3.01Å
386I49.9Very low37Very low53 Ų5396.3 Ų96.327%0.27260%0.597SS.*  trans-69.4112.1169.6-57.8175.8000106.4K149 F152 S384 D390K149-I386 HydrophobicContact CB-CD1 4.22Å; F152-I386 HydrophobicContact CD1-CG2 3.75Å; F152-I386 HydrophobicContact CE1-CG2 3.79Å; F152-I386 HydrophobicContact CG-CG2 4.43Å; S384-I386 PolarHBondContact O-N 2.77Å; I386-D390 HydrophobicContact CG2-CB 4.44Å
387T42.1Very low37.8Very low65 Ų6598.5 Ų98.540%0.39960%0.598SS.*  trans-94.4163.5179.271.90000111I385 G389 D390I385-T387 HydrophobicContact CG2-CG2 4.09Å; I385-T387 PolarHBondContact O-N 3.01Å; T387-G389 PolarHBondContact O-N 3.03Å; T387-G389 VanDerWaalsContact O-N 3.09Å; T387-G389 PolarHBondContact OG1-N 2.8Å; T387-D390 WeakPolarHBondContact CB-OD2 3.44Å; T387-D390 PolarHBondContact N-OD2 2.78Å; T387-D390 PolarHBondContact O-N 2.99Å; T387-D390 PolarHBondContact OG1-OD2 3.01Å
388I40.5Very low38.3Very low91 Ų91100.3 Ų100.347%0.46760%0.595SS.*G310 helixtrans-61.2-15.1170.4-64.5171.3000111.5F152 L391F152-I388 HydrophobicContact CZ-CG1 4.36Å; I388-L391 HydrophobicContact CG2-CD1 4.02Å; I388-L391 WeakPolarHBondContact O-CD1 3.34Å; I388-L391 VanDerWaalsContact O-CG 3.31Å; I388-L391 WeakPolarHBondContact O-CG 3.36Å
389G34.2Very low38.7Very low71 Ų71103.4 Ų103.473%0.73260%0.599SS**G310 helixtrans-77.1-20171.100000115T387 L391T387-G389 PolarHBondContact O-N 3.03Å; T387-G389 VanDerWaalsContact O-N 3.09Å; T387-G389 PolarHBondContact OG1-N 2.8Å; G389-L391 PolarHBondContact O-N 2.98Å
390D44.3Very low39.3Very low74 Ų74105.1 Ų105.140%0.39660%0.602SS.*G310 helixtrans-86.710.6-177.3-60.7-70.7000113.6K149 I386 T387 V392K149-D390 PolarHBondContact NZ-O 3.45Å; I386-D390 HydrophobicContact CG2-CB 4.44Å; T387-D390 WeakPolarHBondContact CB-OD2 3.44Å; T387-D390 PolarHBondContact N-OD2 2.78Å; T387-D390 PolarHBondContact O-N 2.99Å; T387-D390 PolarHBondContact OG1-OD2 3.01Å; D390-V392 PolarHBondContact O-N 3.2Å
391L39.8Very low40.1Very low43 Ų43103.1 Ų103.123%0.22560%0.599CS.*  trans-7364.8179.4-66.2179.6000112.2F152 E153 I388 G389 L393F152-L391 HydrophobicContact CD1-CD2 4.37Å; F152-L391 HydrophobicContact CE1-CD2 4.16Å; E153-L391 HydrophobicContact CG-CD2 3.75Å; I388-L391 HydrophobicContact CG2-CD1 4.02Å; I388-L391 WeakPolarHBondContact O-CD1 3.34Å; I388-L391 VanDerWaalsContact O-CG 3.31Å; I388-L391 WeakPolarHBondContact O-CG 3.36Å; G389-L391 PolarHBondContact O-N 2.98Å; L391-L393 VanDerWaalsContact C-N 3.33Å; L391-L393 PolarHBondContact O-N 2.94Å
392V40.1Very low40.1Very low92 Ų92104.5 Ų104.556%0.55860%0.601SS**  trans-67.893.9162.3-178.10000108D390D390-V392 PolarHBondContact O-N 3.2Å
393L41.8Very low40.9Very low109 Ų109102.3 Ų102.357%0.57160%0.6SS**  trans-51.7147.2165.8-62.6171.8000109.6L391 S395L391-L393 VanDerWaalsContact C-N 3.33Å; L391-L393 PolarHBondContact O-N 2.94Å; L393-S395 PolarHBondContact O-N 2.77Å
394D41.1Very low40.8Very low33 Ų33108.7 Ų108.718%0.17662%0.622CS.*  trans-53.1101.5169.2-80.4-29.8000108.6R50 R56R50-D394 PolarHBondContact NH1-O 3.02Å; R56-D394 IonicContact NH1-OD1 2.97Å; R56-D394 PolarHBondContact NH1-OD1 3.18Å; R56-D394 VanDerWaalsContact NH1-OD1 3.14Å; R56-D394 IonicContact NH1-OD2 3.73Å
395S39.1Very low40.5Very low96 Ų96106.7 Ų106.767%0.67162%0.62SS**  trans-122.252.3174.9-83.60000108.7L393 E397L393-S395 PolarHBondContact O-N 2.77Å; S395-E397 PolarHBondContact O-N 2.76Å
396D39.1Very low40.7Very low78 Ų78109.8 Ų109.842%0.41763%0.628SS.*  trans-70.974.2158.5-64.7-21.7000107.7R52 E398R52-D396 IonicContact CZ-OD2 3.35Å; R52-D396 IonicContact NH1-OD2 3.52Å; R52-D396 PolarHBondContact NH1-OD2 3.38Å; R52-D396 IonicContact NH2-OD2 2.74Å; R52-D396 PolarHBondContact NH2-OD2 2.8Å; D396-E398 PolarHBondContact O-N 2.82Å
397E44.8Very low40Very low186 Ų186116.6 Ų116.687%0.86966%0.659SS**  trans-7774.4163.5-68.8-161.9150.700108.9S395 E399S395-E397 PolarHBondContact O-N 2.76Å; E397-E399 PolarHBondContact O-N 2.9Å
398E41Very low40.2Very low151 Ų151117.3 Ų117.371%0.70667%0.666SS**  trans-76.595.2163.2-70.9-168.1124.600108.4D396D396-E398 PolarHBondContact O-N 2.82Å
399E39.2Very low40.6Very low183 Ų183118.7 Ų118.786%0.85567%0.674SS**  trans-55.8146.9173.6-171.2176.9172.700111.5E397 G401E397-E399 PolarHBondContact O-N 2.9Å; E399-G401 PolarHBondContact O-N 3.29Å
400N46.5Very low41.5Very low159 Ų159122.5 Ų122.585%0.8567%0.673SS**SBendtrans-55.7104-175.2179.528.6000112.7
401G44Very low42Very low70 Ų70122 Ų12272%0.72267%0.67SS**  trans-129.91.7-16200000118.2E399E399-G401 PolarHBondContact O-N 3.29Å
402Q33.9Very low43.3Very low194 Ų194125.8 Ų125.891%0.90768%0.682SS**SBendtrans-151.4130.6175-127.6167.9-10.300113.2
403G45.6Very low44.7Very low82 Ų82128.1 Ų128.185%0.84569%0.687SS**  trans-94.7112.2-164.400000115.5
404E32.7Very low46.1Very low198 Ų198128.5 Ų128.593%0.92568%0.684SS**  trans-103.9144.5141.6-58.7179.5136.500106.4
405G32.9Very low47.7Very low70 Ų70129.1 Ų129.172%0.72269%0.689SS**  cis177.945.22.300000111.7
406K41.8Very low49.2Very low207 Ų207133.2 Ų133.290%0.970%0.695SS**  trans58.564.4-175.2-57.4178.8180176.60114.9
407E36.2Very low50.7Low197 Ų197137 Ų13792%0.92171%0.708SS**  trans-67.9134.3147.4-71.9-175162.800108.1
408S45.4Very low51.6Low80 Ų80133.6 Ų133.656%0.55970%0.696SS**  trans-78144.6-166.930.10000112.3E410S408-E410 WeakPolarHBondContact CB-OE2 3.14Å; S408-E410 PolarHBondContact O-N 3.08Å; S408-E410 PolarHBondContact OG-OE2 2.85Å
409L49.8Very low52.9Low119 Ų119130.5 Ų130.562%0.62369%0.687SS**G310 helixtrans-79.234.8-179.9-135.1161.5000111.8Y412 L420L409-Y412 HydrophobicContact CD2-CD2 4.17Å; L409-Y412 HydrophobicContact CD2-CG 4.27Å; L409-L420 HydrophobicContact CD2-CD1 4.47Å; L409-L420 HydrophobicContact CD2-CD2 4.13Å
410E53.4Low54.4Low152 Ų152125.7 Ų125.771%0.7167%0.667SS**G310 helixtrans-75.1-26.4-172.7-80.6169.5124.400113.2S408 Y412S408-E410 WeakPolarHBondContact CB-OE2 3.14Å; S408-E410 PolarHBondContact O-N 3.08Å; S408-E410 PolarHBondContact OG-OE2 2.85Å; E410-Y412 PolarHBondContact O-N 3.02Å
411N53.9Low55.3Low64 Ų64122.5 Ų122.534%0.34265%0.649SS.*G310 helixtrans-90.717.2-178-73.4-11.7000114.7P422 T423 E426N411-P422 WeakPolarHBondContact O-CA 3.49Å; N411-T423 WeakPolarHBondContact CA-OG1 3.38Å; N411-T423 PolarHBondContact O-N 3.45Å; N411-T423 PolarHBondContact O-OG1 3.28Å; N411-T423 VanDerWaalsContact O-OG1 3.14Å; N411-E426 PolarHBondContact ND2-OE1 2.89Å
412Y67.5Low56.1Low122 Ų122121.9 Ų121.948%0.47863%0.632SS.*EExtended strand (participates in β ladder)trans-139134.5173.9-61.6-106.1000112.6L409 E410 L420 I421 P422L409-Y412 HydrophobicContact CD2-CD2 4.17Å; L409-Y412 HydrophobicContact CD2-CG 4.27Å; E410-Y412 PolarHBondContact O-N 3.02Å; Y412-L420 HydrophobicContact CD1-CB 4.15Å; Y412-I421 CarbonylContact C-O 3.55Å; Y412-I421 VanDerWaalsContact CA-O 3.29Å; Y412-I421 WeakPolarHBondContact CA-O 3.43Å; Y412-P422 HydrophobicContact CD1-CB 4.25Å; Y412-P422 HydrophobicContact CD1-CG 4.09Å; Y412-P422 HydrophobicContact CE1-CB 4.09Å; Y412-P422 HydrophobicContact CE1-CG 3.73Å
413Q69.5Low57.5Low141 Ų141114.8 Ų114.866%0.65960%0.602SS**EExtended strand (participates in β ladder)trans-96.4127171.4-164.5171.815.800110.4I421 T423Q413-I421 PolarHBondContact N-O 3.14Å; Q413-I421 PolarHBondContact O-N 2.92Å; Q413-T423 HydrophobicContact CB-CG2 4.13Å
414K71.7Confident57.8Low117 Ų117117.7 Ų117.751%0.50959%0.592SS.*EExtended strand (participates in β ladder)trans-82.7126.9175.8-154.9-173.3-163.7-153.10110.6D418 L420K414-D418 VanDerWaalsContact CE-OD1 3.24Å; K414-D418 WeakPolarHBondContact CE-OD1 3.29Å; K414-D418 WeakPolarHBondContact CE-OD2 3.45Å; K414-D418 IonicContact NZ-OD1 3.49Å; K414-D418 PolarHBondContact NZ-OD1 3.32Å; K414-D418 IonicContact NZ-OD2 2.7Å; K414-D418 PolarHBondContact NZ-OD2 2.54Å; K414-L420 HydrophobicContact CB-CD2 3.82Å; K414-L420 HydrophobicContact CG-CD2 3.83Å; K414-L420 HydrophobicContact CG-CG 4.5Å
415T73.1Confident58.8Low45 Ų45112.8 Ų112.828%0.27658%0.578SS.*PPolyproline II helixtrans-84165.7176.863.70000112.2F417 D418 T419 I421T415-F417 PolarHBondContact O-N 3.2Å; T415-D418 PolarHBondContact O-N 3.4Å; T415-T419 WeakPolarHBondContact CB-O 3.4Å; T415-T419 WeakPolarHBondContact CG2-O 3.24Å; T415-T419 PolarHBondContact N-O 2.9Å; T415-T419 WeakPolarHBondContact OG1-CB 3.47Å; T415-T419 PolarHBondContact OG1-N 3.08Å; T415-T419 PolarHBondContact OG1-O 3.17Å; T415-I421 HydrophobicContact CG2-CD1 3.54Å; T415-I421 HydrophobicContact CG2-CG1 3.97Å
416K70.4Confident59.6Low183 Ų183116 Ų11680%0.79657%0.574SS**THydrogen-bonded Turntrans-63.5-2.217470.4-179.8-177.9-179.40115.5
417F70.9Confident60Low158 Ų158114.6 Ų114.669%0.69357%0.565SS**THydrogen-bonded Turntrans-117.127.5176-58.1-60.7000111.1T415 T419T415-F417 PolarHBondContact O-N 3.2Å; F417-T419 PolarHBondContact O-N 2.92Å; F417-T419 PolarHBondContact O-OG1 2.8Å
418D63.8Low60.4Low114 Ų114111.7 Ų111.761%0.6156%0.555SS**SBendtrans57.24179.1-103.635.7000117K414 T415K414-D418 VanDerWaalsContact CE-OD1 3.24Å; K414-D418 WeakPolarHBondContact CE-OD1 3.29Å; K414-D418 WeakPolarHBondContact CE-OD2 3.45Å; K414-D418 IonicContact NZ-OD1 3.49Å; K414-D418 PolarHBondContact NZ-OD1 3.32Å; K414-D418 IonicContact NZ-OD2 2.7Å; K414-D418 PolarHBondContact NZ-OD2 2.54Å; T415-D418 PolarHBondContact O-N 3.4Å
419T69.3Low60.2Low86 Ų86113.5 Ų113.553%0.52856%0.564SS.*  trans-77.7130.9174.3-52.90000109.9T415 F417T415-T419 WeakPolarHBondContact CB-O 3.4Å; T415-T419 WeakPolarHBondContact CG2-O 3.24Å; T415-T419 PolarHBondContact N-O 2.9Å; T415-T419 WeakPolarHBondContact OG1-CB 3.47Å; T415-T419 PolarHBondContact OG1-N 3.08Å; T415-T419 PolarHBondContact OG1-O 3.17Å; F417-T419 PolarHBondContact O-N 2.92Å; F417-T419 PolarHBondContact O-OG1 2.8Å
420L70.6Confident59.9Low82 Ų82113.8 Ų113.843%0.42958%0.577SS.*EExtended strand (participates in β ladder)trans-88.6133.3174.1-69.3166.8000110.2L409 Y412 K414L409-L420 HydrophobicContact CD2-CD1 4.47Å; L409-L420 HydrophobicContact CD2-CD2 4.13Å; Y412-L420 HydrophobicContact CD1-CB 4.15Å; K414-L420 HydrophobicContact CB-CD2 3.82Å; K414-L420 HydrophobicContact CG-CD2 3.83Å; K414-L420 HydrophobicContact CG-CG 4.5Å
421I64.9Low59.3Low92 Ų92111.8 Ų111.847%0.47258%0.579SS.*EExtended strand (participates in β ladder)trans-117.7128.7176.3-60.8179.9000108.9Y412 Q413 T415Y412-I421 CarbonylContact C-O 3.55Å; Y412-I421 VanDerWaalsContact CA-O 3.29Å; Y412-I421 WeakPolarHBondContact CA-O 3.43Å; Q413-I421 PolarHBondContact N-O 3.14Å; Q413-I421 PolarHBondContact O-N 2.92Å; T415-I421 HydrophobicContact CG2-CD1 3.54Å; T415-I421 HydrophobicContact CG2-CG1 3.97Å
422P59.8Low58.4Low57 Ų57112 Ų11237%0.3760%0.597SS.*EExtended strand (participates in β ladder)trans-62.8135.9176.2-15.726.5000112.1N411 Y412 F424N411-P422 WeakPolarHBondContact O-CA 3.49Å; Y412-P422 HydrophobicContact CD1-CB 4.25Å; Y412-P422 HydrophobicContact CD1-CG 4.09Å; Y412-P422 HydrophobicContact CE1-CB 4.09Å; Y412-P422 HydrophobicContact CE1-CG 3.73Å; P422-F424 HydrophobicContact CB-CE2 4.27Å; P422-F424 HydrophobicContact CB-CZ 4.31Å
423T63.7Low57Low45 Ų45115.3 Ų115.328%0.27662%0.616SS.*  trans-95.5105171.444.90000109.5N411 Q413 C425N411-T423 WeakPolarHBondContact CA-OG1 3.38Å; N411-T423 PolarHBondContact O-N 3.45Å; N411-T423 PolarHBondContact O-OG1 3.28Å; N411-T423 VanDerWaalsContact O-OG1 3.14Å; Q413-T423 HydrophobicContact CB-CG2 4.13Å; T423-C425 PolarHBondContact O-N 2.88Å
424F52.9Low55.3Low143 Ų143112.5 Ų112.563%0.62763%0.625SS**  trans-72.133.8-175.2-66-86.1000114.9P422 E426 Y427P422-F424 HydrophobicContact CB-CE2 4.27Å; P422-F424 HydrophobicContact CB-CZ 4.31Å; F424-E426 PolarHBondContact O-N 2.79Å; F424-Y427 HydrophobicContact CB-CD2 4.38Å; F424-Y427 AromaticContact CD1-CD2 3.99Å; F424-Y427 HydrophobicContact CD1-CD2 3.99Å; F424-Y427 HydrophobicContact CD1-CE2 4.4Å; F424-Y427 PolarHBondContact O-N 2.66Å; F424-Y427 VanDerWaalsContact O-N 3.08Å
425C53.8Low53.5Low94 Ų94111.7 Ų111.764%0.63564%0.64SS**G310 helixtrans-60.2-28.6-177.6-63.40000113.1T423 Y427T423-C425 PolarHBondContact O-N 2.88Å; C425-Y427 VanDerWaalsContact C-N 3.27Å; C425-Y427 PolarHBondContact O-N 2.96Å
426E48.8Very low51.8Low139 Ų139117.7 Ų117.765%0.6567%0.667SS**G310 helixtrans-73.7-12.7178.1-62.4178.4170.700114N411 F424N411-E426 PolarHBondContact ND2-OE1 2.89Å; F424-E426 PolarHBondContact O-N 2.79Å
427Y49.9Very low50Low177 Ų177114.7 Ų114.769%0.69467%0.666SS**G310 helixtrans-105.50.8-173.9-66.9-89.3000114.1F424 C425F424-Y427 HydrophobicContact CB-CD2 4.38Å; F424-Y427 AromaticContact CD1-CD2 3.99Å; F424-Y427 HydrophobicContact CD1-CD2 3.99Å; F424-Y427 HydrophobicContact CD1-CE2 4.4Å; F424-Y427 PolarHBondContact O-N 2.66Å; F424-Y427 VanDerWaalsContact O-N 3.08Å; C425-Y427 VanDerWaalsContact C-N 3.27Å; C425-Y427 PolarHBondContact O-N 2.96Å
428L46Very low48.4Very low136 Ų136113.3 Ų113.371%0.71267%0.671SS**SBendtrans-97.1119.7174.4-65.3177.7000110.1S430L428-S430 PolarHBondContact O-N 2.7Å
429P41.3Very low47.3Very low117 Ų117112.9 Ų112.976%0.7667%0.674SS**  trans-66.6127175.627.6-33.3000109.8S431P429-S431 PolarHBondContact O-N 3.48Å
430S42.6Very low45.5Very low126 Ų126114 Ų11488%0.88169%0.685SS**  trans-62.8107.9176.7-73.20000110.5L428 G432L428-S430 PolarHBondContact O-N 2.7Å; S430-G432 PolarHBondContact O-N 3.3Å
431S40Very low43.8Very low109 Ų109120.2 Ų120.276%0.76270%0.704SS**  trans-76.356.6-179.747.80000112.5P429 H433P429-S431 PolarHBondContact O-N 3.48Å; S431-H433 PolarHBondContact O-N 3.01Å; S431-H433 VanDerWaalsContact O-N 3.08Å
432G37Very low42.2Very low70 Ų70123.6 Ų123.672%0.72272%0.724SS**  trans-58.3111.7175.200000111S430 G434S430-G432 PolarHBondContact O-N 3.3Å; G432-G434 PolarHBondContact O-N 3.07Å
433H36.6Very low41Very low191 Ų191126.7 Ų126.788%0.88475%0.745SS**  trans-61.4123.7172.9-90.141.4000110S431S431-H433 PolarHBondContact O-N 3.01Å; S431-H433 VanDerWaalsContact O-N 3.08Å
434G35Very low39.6Very low82 Ų82136 Ų13685%0.84578%0.775SS**  trans-76.1138.9177.300000112.4G432G432-G434 PolarHBondContact O-N 3.07Å
435A32.7Very low38.7Very low99 Ų99136 Ų13682%0.81878%0.782SS**  trans-130.2122.2161.500000108.3
436M38.1Very low37.9Very low171 Ų171137.2 Ų137.284%0.84279%0.792SS**PPolyproline II helixtrans-74.9139.3-175.7-69.9-78.3-73.800111.6V438M436-V438 PolarHBondContact O-N 3.32Å
437P33.4Very low37.4Very low120 Ų120134.7 Ų134.778%0.77979%0.79SS**PPolyproline II helixtrans-76.2117.8162.930.8-30.7000110
438V37Very low36.8Very low130 Ų130137.8 Ų137.879%0.78880%0.8SS**PPolyproline II helixtrans-80.5138.6167.5175.80000108.3M436M436-V438 PolarHBondContact O-N 3.32Å
439P41Very low36.9Very low104 Ų104137 Ų13768%0.67580%0.803SS**PPolyproline II helixtrans-70140.8-175.527.9-35.9000112.7
440S30Very low36.7Very low110 Ų110143 Ų14377%0.76983%0.828SS**PPolyproline II helixtrans-90.7125.3167.1-170.60000110.3
441Y35.7Very low36.4Very low212 Ų212143.9 Ų143.983%0.83183%0.825SS**  trans-112.5108.9164-86.4-87000108.4C443Y441-C443 PolarHBondContact O-N 2.85Å
442D32Very low36.2Very low163 Ų163145.7 Ų145.787%0.87283%0.828SS**  trans-73.8120.3160.8-93.4-51.1000108.8
443C33Very low36.2Very low123 Ų123149.9 Ų149.983%0.83183%0.834SS**  trans-136142.7165.3-167.40000109.6Y441Y441-C443 PolarHBondContact O-N 2.85Å
444R34.3Very low36.1Very low239 Ų239147.5 Ų147.590%0.90283%0.831SS**  trans-77.7144.3-164-67.9167.173171.93.8112.9
445D33.9Very low36.2Very low143 Ų143151.6 Ų151.677%0.76583%0.83SS**  trans-33.6129.4154.2174.624.7000113.3S447D445-S447 PolarHBondContact OD1-OG 3.36Å
446S37.6Very low36.5Very low120 Ų120155.1 Ų155.184%0.83983%0.831SS**  trans-150.1142.1151.7-170.80000108.5
447S38.9Very low36.3Very low87 Ų87154 Ų15461%0.60883%0.83SS**  trans-110.1152.5-160.4-33.30000114.6D445D445-S447 PolarHBondContact OD1-OG 3.36Å
448R37.3Very low36.6Very low241 Ų241156.6 Ų156.691%0.90983%0.834SS**  trans80.3154.8155-69.1-178.3176.4-137.9-2.6118.9
449P47Very low36.5Very low120 Ų120158.8 Ų158.878%0.77984%0.838SS**  trans-101.5166.4-173.240.6-35.6000113.5
450L37.6Very low36.1Very low244 Ų244163.8 Ų163.8100%1.27785%0.853SS**  trans-151.80136.9-110.1167.5000109.2

Retrieved 450 of 450 residues in 62.1 ms (Link to these results)

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