MNHB2_STAA8 Loading...

Putative antiporter subunit mnhB2

AlphaFold DB , UniProt , Accession Q2G214, Species STAA8 (Staphylococcus aureus (strain NCTC 8325 / PS 47)), Gene mnhB2, Length 141 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
1M51.8Low80.5Confident161 Ų161108.2 Ų108.279%0.79356%0.557SS**  0131.10-73.2163.471.200107.1V6M1-V6 HydrophobicContact CB-CG2 4.43Å; M1-V6 HydrophobicContact CE-CG2 4.11Å
2K55Low81.8Confident167 Ų16799.4 Ų99.473%0.72651%0.512SS*.  trans-66.5144.5173.5-77.1175.9173.7177.80107.5N4 D5K2-N4 PolarHBondContact O-N 3.4Å; K2-D5 PolarHBondContact N-OD2 2.86Å; K2-D5 WeakPolarHBondContact O-CB 3.31Å; K2-D5 PolarHBondContact O-N 3.23Å
3E65Low82.8Confident169 Ų169102.8 Ų102.879%0.7952%0.52SS*.Hα-helixtrans-50.8-35.8-179-73.8178138.800112.5D5 V6 V7E3-D5 VanDerWaalsContact C-N 3.25Å; E3-D5 PolarHBondContact O-N 3.29Å; E3-V6 PolarHBondContact O-N 2.93Å; E3-V6 VanDerWaalsContact O-N 3.12Å; E3-V7 PolarHBondContact O-N 3.19Å
4N71.9Confident83.8Confident130 Ų130103.5 Ų103.570%0.69553%0.525SS*.Hα-helixtrans-57.1-33.1175.6-67.2-0.8000113.7K2 L8K2-N4 PolarHBondContact O-N 3.4Å; N4-L8 WeakPolarHBondContact O-CB 3.36Å; N4-L8 PolarHBondContact O-N 2.98Å
5D83Confident84.7Confident70 Ų7099.5 Ų99.537%0.37451%0.508SS..Hα-helixtrans-71.4-34.7179.3-64.9-30.8000111.6K2 E3 R9K2-D5 PolarHBondContact N-OD2 2.86Å; K2-D5 WeakPolarHBondContact O-CB 3.31Å; K2-D5 PolarHBondContact O-N 3.23Å; E3-D5 VanDerWaalsContact C-N 3.25Å; E3-D5 PolarHBondContact O-N 3.29Å; D5-R9 VanDerWaalsContact O-CB 3.31Å; D5-R9 WeakPolarHBondContact O-CB 3.46Å; D5-R9 VanDerWaalsContact O-CG 3.23Å; D5-R9 WeakPolarHBondContact O-CG 3.4Å; D5-R9 PolarHBondContact O-N 3.48Å
6V89.1Confident85.5Confident73 Ų7394.6 Ų94.644%0.44248%0.484SS..Hα-helixtrans-69.7-44.5-178.6-177.20000110M1 E3 T10M1-V6 HydrophobicContact CB-CG2 4.43Å; M1-V6 HydrophobicContact CE-CG2 4.11Å; E3-V6 PolarHBondContact O-N 2.93Å; E3-V6 VanDerWaalsContact O-N 3.12Å; V6-T10 WeakPolarHBondContact O-CB 3.43Å; V6-T10 PolarHBondContact O-N 3.27Å; V6-T10 PolarHBondContact O-OG1 2.96Å
7V92.5Very high86.2Confident95 Ų9597.5 Ų97.558%0.57649%0.493SS*.Hα-helixtrans-61.9-49.5175.5179.60000110E3 R9 T10 V11E3-V7 PolarHBondContact O-N 3.19Å; V7-R9 PolarHBondContact O-N 2.97Å; V7-T10 PolarHBondContact O-N 3.34Å; V7-V11 HydrophobicContact CG1-CG2 4.29Å; V7-V11 WeakPolarHBondContact O-CG2 3.44Å; V7-V11 PolarHBondContact O-N 2.68Å
8L93.1Very high86.8Confident77 Ų7797.3 Ų97.340%0.40349%0.492SS..Hα-helixtrans-57.8-51.4179.518062.2000111.9N4 T10 V11 T12 A54N4-L8 WeakPolarHBondContact O-CB 3.36Å; N4-L8 PolarHBondContact O-N 2.98Å; L8-T10 VanDerWaalsContact C-N 3.29Å; L8-T10 PolarHBondContact O-N 3.22Å; L8-V11 PolarHBondContact O-N 2.87Å; L8-T12 WeakPolarHBondContact O-CB 3.47Å; L8-T12 PolarHBondContact O-N 3.15Å; L8-T12 PolarHBondContact O-OG1 3.29Å; L8-A54 HydrophobicContact CD2-CB 4.32Å; L8-A54 HydrophobicContact CG-CB 4.01Å
9R93.4Very high87.4Confident81 Ų8194.4 Ų94.431%0.30648%0.478SS..Hα-helixtrans-60.3-38.2179.6-74.8176.9177.2-143.8-1.2112.7D5 V7 K13 A54 F55D5-R9 VanDerWaalsContact O-CB 3.31Å; D5-R9 WeakPolarHBondContact O-CB 3.46Å; D5-R9 VanDerWaalsContact O-CG 3.23Å; D5-R9 WeakPolarHBondContact O-CG 3.4Å; D5-R9 PolarHBondContact O-N 3.48Å; V7-R9 PolarHBondContact O-N 2.97Å; R9-K13 WeakPolarHBondContact O-CG 3.23Å; R9-K13 PolarHBondContact O-N 3.09Å; R9-A54 WeakPolarHBondContact CG-O 3.39Å; R9-A54 PolarHBondContact NE-O 3.2Å; R9-F55 HydrophobicContact CB-CE1 3.95Å; R9-F55 HydrophobicContact CB-CZ 3.84Å; R9-F55 HydrophobicContact CG-CD1 4.18Å; R9-F55 HydrophobicContact CG-CE1 3.68Å; R9-F55 HydrophobicContact CG-CZ 3.91Å
10T94.5Very high87.9Confident90 Ų9092.4 Ų92.455%0.55247%0.468SS*.Hα-helixtrans-69.2-47.6-180-56.50000111V6 V7 L8 K13V6-T10 WeakPolarHBondContact O-CB 3.43Å; V6-T10 PolarHBondContact O-N 3.27Å; V6-T10 PolarHBondContact O-OG1 2.96Å; V7-T10 PolarHBondContact O-N 3.34Å; L8-T10 VanDerWaalsContact C-N 3.29Å; L8-T10 PolarHBondContact O-N 3.22Å; T10-K13 PolarHBondContact O-N 3.32Å
11V95.9Very high88.4Confident77 Ų7791.6 Ų91.647%0.46747%0.468SS..Hα-helixtrans-63.2-43.3177.4173.70000110.7V7 L8 K13 L14 V15V7-V11 HydrophobicContact CG1-CG2 4.29Å; V7-V11 WeakPolarHBondContact O-CG2 3.44Å; V7-V11 PolarHBondContact O-N 2.68Å; L8-V11 PolarHBondContact O-N 2.87Å; V11-K13 VanDerWaalsContact C-N 3.33Å; V11-K13 PolarHBondContact O-N 3.26Å; V11-L14 PolarHBondContact O-N 2.93Å; V11-L14 VanDerWaalsContact O-N 3.13Å; V11-V15 HydrophobicContact CG1-CG2 3.85Å; V11-V15 WeakPolarHBondContact O-CG2 3.28Å; V11-V15 PolarHBondContact O-N 3.28Å
12T96Very high90.5Very high3 Ų388.9 Ų88.92%0.01845%0.452CS..Hα-helixtrans-57.5-43.5179.5-690000112.3L8 L14 V15 V16 L50 A54 F55L8-T12 WeakPolarHBondContact O-CB 3.47Å; L8-T12 PolarHBondContact O-N 3.15Å; L8-T12 PolarHBondContact O-OG1 3.29Å; T12-L14 VanDerWaalsContact C-N 3.28Å; T12-L14 PolarHBondContact O-N 2.94Å; T12-V15 PolarHBondContact O-N 3.26Å; T12-V16 HydrophobicContact CG2-CG2 3.82Å; T12-V16 VanDerWaalsContact O-CB 3.3Å; T12-V16 WeakPolarHBondContact O-CB 3.33Å; T12-V16 WeakPolarHBondContact O-CG2 3.45Å; T12-V16 PolarHBondContact O-N 3.39Å; T12-L50 HydrophobicContact CG2-CD2 4.2Å; T12-L50 HydrophobicContact CG2-CG 3.84Å; T12-A54 HydrophobicContact CG2-CB 3.77Å; T12-A54 VanDerWaalsContact OG1-CB 3.3Å; T12-A54 WeakPolarHBondContact OG1-CB 3.28Å; T12-F55 HydrophobicContact CG2-CD2 4.44Å; T12-F55 HydrophobicContact CG2-CE2 3.87Å
13K94.8Very high92.6Very high143 Ų14380.9 Ų80.962%0.62242%0.417SS*.Hα-helixtrans-57.5-43178.1-73.4176.6-179.6-175.40112.2R9 T10 V11 F17 F55R9-K13 WeakPolarHBondContact O-CG 3.23Å; R9-K13 PolarHBondContact O-N 3.09Å; T10-K13 PolarHBondContact O-N 3.32Å; V11-K13 VanDerWaalsContact C-N 3.33Å; V11-K13 PolarHBondContact O-N 3.26Å; K13-F17 PolarHBondContact O-N 3.05Å; K13-F55 HydrophobicContact CG-CZ 4.09Å
14L97Very high94Very high113 Ų11378.2 Ų78.259%0.59240%0.403SS*.Hα-helixtrans-70.6-44.5179.5-173.4132.9000111.6V11 T12 F17 I18V11-L14 PolarHBondContact O-N 2.93Å; V11-L14 VanDerWaalsContact O-N 3.13Å; T12-L14 VanDerWaalsContact C-N 3.28Å; T12-L14 PolarHBondContact O-N 2.94Å; L14-F17 PolarHBondContact O-N 3.06Å; L14-I18 HydrophobicContact CD2-CD1 3.7Å; L14-I18 HydrophobicContact CG-CD1 4.43Å; L14-I18 WeakPolarHBondContact O-CG1 3.34Å; L14-I18 PolarHBondContact O-N 3.31Å
15V97.8Very high95.1Very high44 Ų4479 Ų7927%0.26740%0.397SS..Hα-helixtrans-67.1-41.4-180175.80000111.5V11 T12 F17 I18 L19 L50V11-V15 HydrophobicContact CG1-CG2 3.85Å; V11-V15 WeakPolarHBondContact O-CG2 3.28Å; V11-V15 PolarHBondContact O-N 3.28Å; T12-V15 PolarHBondContact O-N 3.26Å; V15-F17 VanDerWaalsContact C-N 3.31Å; V15-F17 PolarHBondContact O-N 3.06Å; V15-I18 WeakPolarHBondContact O-CB 3.31Å; V15-I18 PolarHBondContact O-N 3.47Å; V15-I18 VanDerWaalsContact O-N 3.14Å; V15-L19 HydrophobicContact CG1-CD1 3.91Å; V15-L19 HydrophobicContact CG1-CG 4.07Å; V15-L19 WeakPolarHBondContact O-CG 3.41Å; V15-L19 PolarHBondContact O-N 3.12Å; V15-L50 HydrophobicContact CB-CD2 3.84Å; V15-L50 HydrophobicContact CG1-CD2 3.5Å
16V97.3Very high95.7Very high20 Ų2076.1 Ų76.112%0.12138%0.383CS..Hα-helixtrans-57.7-45.7175.9165.90000110.5T12 I18 L19 L20 A47 L50 M51T12-V16 HydrophobicContact CG2-CG2 3.82Å; T12-V16 VanDerWaalsContact O-CB 3.3Å; T12-V16 WeakPolarHBondContact O-CB 3.33Å; T12-V16 WeakPolarHBondContact O-CG2 3.45Å; T12-V16 PolarHBondContact O-N 3.39Å; V16-I18 VanDerWaalsContact C-N 3.3Å; V16-I18 PolarHBondContact O-N 3.24Å; V16-L19 PolarHBondContact O-N 2.86Å; V16-L20 HydrophobicContact CG1-CD1 3.92Å; V16-L20 HydrophobicContact CG1-CG 4.21Å; V16-L20 VanDerWaalsContact O-CG 3.28Å; V16-L20 WeakPolarHBondContact O-CG 3.44Å; V16-L20 PolarHBondContact O-N 2.73Å; V16-A47 HydrophobicContact CG1-CB 4.35Å; V16-L50 HydrophobicContact CG2-CD2 4.25Å; V16-M51 HydrophobicContact CG2-CB 4.47Å
17F97.1Very high96Very high145 Ų14573.3 Ų73.364%0.63636%0.364SS*.Hα-helixtrans-58.4-42.7176.6179.9-99.2000112.4K13 L14 V15 T21K13-F17 PolarHBondContact O-N 3.05Å; L14-F17 PolarHBondContact O-N 3.06Å; V15-F17 VanDerWaalsContact C-N 3.31Å; V15-F17 PolarHBondContact O-N 3.06Å; F17-T21 WeakPolarHBondContact O-CB 3.34Å; F17-T21 PolarHBondContact O-N 3.04Å; F17-T21 VanDerWaalsContact O-N 3.1Å; F17-T21 PolarHBondContact O-OG1 3.29Å
18I98Very high95.9Very high93 Ų9374.6 Ų74.648%0.47736%0.363SS..Hα-helixtrans-64.2-47.1176.3-65.7167.7000110.7L14 V15 V16 L20 T21 F22L14-I18 HydrophobicContact CD2-CD1 3.7Å; L14-I18 HydrophobicContact CG-CD1 4.43Å; L14-I18 WeakPolarHBondContact O-CG1 3.34Å; L14-I18 PolarHBondContact O-N 3.31Å; V15-I18 WeakPolarHBondContact O-CB 3.31Å; V15-I18 PolarHBondContact O-N 3.47Å; V15-I18 VanDerWaalsContact O-N 3.14Å; V16-I18 VanDerWaalsContact C-N 3.3Å; V16-I18 PolarHBondContact O-N 3.24Å; I18-L20 PolarHBondContact O-N 2.73Å; I18-T21 PolarHBondContact O-N 2.8Å; I18-F22 WeakPolarHBondContact O-CB 3.21Å; I18-F22 PolarHBondContact O-N 3.49Å
19L98.2Very high95.8Very high42 Ų4271.6 Ų71.622%0.2235%0.349CS..Hα-helixtrans-61.8-44.3-179.6-70.5175.2000111.6V15 V16 F22 G23 I43 A47 L50V15-L19 HydrophobicContact CG1-CD1 3.91Å; V15-L19 HydrophobicContact CG1-CG 4.07Å; V15-L19 WeakPolarHBondContact O-CG 3.41Å; V15-L19 PolarHBondContact O-N 3.12Å; V16-L19 PolarHBondContact O-N 2.86Å; L19-F22 PolarHBondContact O-N 3.2Å; L19-G23 PolarHBondContact O-N 2.91Å; L19-I43 HydrophobicContact CB-CG2 4.28Å; L19-I43 HydrophobicContact CD2-CG2 4.21Å; L19-I43 WeakPolarHBondContact O-CG2 3.34Å; L19-A47 HydrophobicContact CB-CB 3.78Å; L19-A47 HydrophobicContact CD1-CB 4.08Å; L19-L50 HydrophobicContact CD1-CD2 4.35Å
20L97.4Very high95.4Very high54 Ų5469.2 Ų69.228%0.28335%0.35SS..Hα-helixtrans-63-45.8178-65.7177.9000111.3V16 I18 G23 F24 F44 A47V16-L20 HydrophobicContact CG1-CD1 3.92Å; V16-L20 HydrophobicContact CG1-CG 4.21Å; V16-L20 VanDerWaalsContact O-CG 3.28Å; V16-L20 WeakPolarHBondContact O-CG 3.44Å; V16-L20 PolarHBondContact O-N 2.73Å; I18-L20 PolarHBondContact O-N 2.73Å; L20-G23 PolarHBondContact O-N 3.37Å; L20-F24 WeakPolarHBondContact O-CD2 3.5Å; L20-F24 PolarHBondContact O-N 2.77Å; L20-F24 VanDerWaalsContact O-N 3.08Å; L20-F44 HydrophobicContact CB-CE1 4.31Å; L20-F44 HydrophobicContact CD2-CD1 3.44Å; L20-F44 VanDerWaalsContact CD2-CD1 3.44Å; L20-F44 HydrophobicContact CD2-CE1 3.77Å; L20-A47 HydrophobicContact CD2-CB 3.81Å; L20-A47 HydrophobicContact CG-CB 4.16Å
21T97.4Very high94.9Very high77 Ų7768.5 Ų68.547%0.47234%0.34SS..Hα-helixtrans-63.7-43.8178.3-53.30000111.4F17 I18 F24 Y25F17-T21 WeakPolarHBondContact O-CB 3.34Å; F17-T21 PolarHBondContact O-N 3.04Å; F17-T21 VanDerWaalsContact O-N 3.1Å; F17-T21 PolarHBondContact O-OG1 3.29Å; I18-T21 PolarHBondContact O-N 2.8Å; T21-F24 PolarHBondContact O-N 3.49Å; T21-Y25 PolarHBondContact O-N 3.07Å
22F97.1Very high94.3Very high103 Ų10371.8 Ų71.845%0.45235%0.354SS..Hα-helixtrans-67.5-36.4177.6-174.5-116.5000112.1I18 L19 F24 Y25 V26 I43I18-F22 WeakPolarHBondContact O-CB 3.21Å; I18-F22 PolarHBondContact O-N 3.49Å; L19-F22 PolarHBondContact O-N 3.2Å; F22-F24 PolarHBondContact O-N 3.24Å; F22-Y25 HydrophobicContact CD2-CD1 4.06Å; F22-Y25 AromaticContact CE2-CD1 3.92Å; F22-Y25 HydrophobicContact CE2-CD1 3.92Å; F22-Y25 HydrophobicContact CE2-CE1 4.35Å; F22-Y25 WeakPolarHBondContact O-CB 3.36Å; F22-Y25 PolarHBondContact O-N 2.75Å; F22-V26 HydrophobicContact CD1-CG2 4.16Å; F22-V26 HydrophobicContact CD2-CG2 4.26Å; F22-V26 HydrophobicContact CE1-CG2 3.72Å; F22-V26 HydrophobicContact CE2-CG2 3.84Å; F22-V26 HydrophobicContact CG-CG2 4.41Å; F22-V26 HydrophobicContact CZ-CG2 3.54Å; F22-V26 WeakPolarHBondContact O-CG2 3.31Å; F22-V26 PolarHBondContact O-N 3.48Å; F22-I43 HydrophobicContact CD1-CD1 3.74Å; F22-I43 HydrophobicContact CD1-CG2 4.26Å; F22-I43 HydrophobicContact CE1-CD1 3.7Å
23G97.2Very high93.9Very high0 Ų076.1 Ų76.10%038%0.378CS..Hα-helixtrans-59.4-44.5173.500000112L19 L20 V26 F27 F44L19-G23 PolarHBondContact O-N 2.91Å; L20-G23 PolarHBondContact O-N 3.37Å; G23-V26 PolarHBondContact O-N 3.42Å; G23-F27 WeakPolarHBondContact O-CB 3.47Å; G23-F27 PolarHBondContact O-N 3.13Å; G23-F44 VanDerWaalsContact C-CE2 3.45Å
24F95.6Very high93.5Very high112 Ų11275.3 Ų75.349%0.49139%0.387SS..Hα-helixtrans-61.7-45172.5-79.3-63.2000112.1L20 T21 F22 F27 F28 F44L20-F24 WeakPolarHBondContact O-CD2 3.5Å; L20-F24 PolarHBondContact O-N 2.77Å; L20-F24 VanDerWaalsContact O-N 3.08Å; T21-F24 PolarHBondContact O-N 3.49Å; F22-F24 PolarHBondContact O-N 3.24Å; F24-F27 PolarHBondContact O-N 2.95Å; F24-F28 HydrophobicContact CB-CD2 4.47Å; F24-F28 HydrophobicContact CB-CE2 4.39Å; F24-F28 HydrophobicContact CD1-CE2 4.03Å; F24-F28 WeakPolarHBondContact O-CD2 3.2Å; F24-F28 PolarHBondContact O-N 3.34Å; F24-F44 HydrophobicContact CB-CZ 4.39Å; F24-F44 HydrophobicContact CD1-CE2 4.49Å; F24-F44 AromaticContact CD1-CZ 3.8Å; F24-F44 HydrophobicContact CD1-CZ 3.8Å; F24-F44 HydrophobicContact CD2-CE1 4.01Å; F24-F44 AromaticContact CD2-CZ 3.63Å; F24-F44 HydrophobicContact CD2-CZ 3.63Å; F24-F44 AromaticContact CE1-CZ 3.86Å; F24-F44 HydrophobicContact CE1-CZ 3.86Å; F24-F44 AromaticContact CE2-CE1 3.77Å; F24-F44 HydrophobicContact CE2-CE1 3.77Å; F24-F44 AromaticContact CE2-CZ 3.69Å; F24-F44 HydrophobicContact CE2-CZ 3.69Å; F24-F44 HydrophobicContact CG-CE1 4.5Å; F24-F44 AromaticContact CG-CZ 3.67Å; F24-F44 HydrophobicContact CG-CZ 3.67Å; F24-F44 HydrophobicContact CZ-CE1 4.06Å; F24-F44 AromaticContact CZ-CZ 3.8Å; F24-F44 HydrophobicContact CZ-CZ 3.8Å
25Y94.9Very high93.2Very high146 Ų14671.1 Ų71.157%0.57337%0.371SS*.Hα-helixtrans-58.1-50.5177.3169.4-98.9000111.9T21 F22 F27 F28 A29T21-Y25 PolarHBondContact O-N 3.07Å; F22-Y25 HydrophobicContact CD2-CD1 4.06Å; F22-Y25 AromaticContact CE2-CD1 3.92Å; F22-Y25 HydrophobicContact CE2-CD1 3.92Å; F22-Y25 HydrophobicContact CE2-CE1 4.35Å; F22-Y25 WeakPolarHBondContact O-CB 3.36Å; F22-Y25 PolarHBondContact O-N 2.75Å; Y25-F27 VanDerWaalsContact C-N 3.3Å; Y25-F27 PolarHBondContact O-N 2.99Å; Y25-F28 PolarHBondContact O-N 3.16Å; Y25-A29 HydrophobicContact CE1-CB 4.44Å; Y25-A29 HydrophobicContact CE2-CB 4.48Å; Y25-A29 WeakPolarHBondContact O-CB 3.45Å; Y25-A29 PolarHBondContact O-N 3.47Å
26V95.3Very high93Very high11 Ų1169.2 Ų69.27%0.06736%0.361CS..Hα-helixtrans-64.5-36.1-179.4173.70000111.7F22 G23 G30 G36 I39 I43F22-V26 HydrophobicContact CD1-CG2 4.16Å; F22-V26 HydrophobicContact CD2-CG2 4.26Å; F22-V26 HydrophobicContact CE1-CG2 3.72Å; F22-V26 HydrophobicContact CE2-CG2 3.84Å; F22-V26 HydrophobicContact CG-CG2 4.41Å; F22-V26 HydrophobicContact CZ-CG2 3.54Å; F22-V26 WeakPolarHBondContact O-CG2 3.31Å; F22-V26 PolarHBondContact O-N 3.48Å; G23-V26 PolarHBondContact O-N 3.42Å; V26-G30 PolarHBondContact O-N 3.32Å; V26-G36 PolarHBondContact O-N 3.03Å; V26-I39 HydrophobicContact CG1-CB 4.06Å; V26-I39 HydrophobicContact CG1-CG2 3.79Å; V26-I43 HydrophobicContact CB-CD1 4.1Å; V26-I43 HydrophobicContact CG1-CD1 4.26Å; V26-I43 HydrophobicContact CG2-CD1 3.86Å
27F95.3Very high92.9Very high13 Ų1368.3 Ų68.36%0.05736%0.355CS..Hα-helixtrans-60.2-55173.9172.2-109.2000111.3G23 F24 Y25 G30 T115 E118 L119 L122G23-F27 WeakPolarHBondContact O-CB 3.47Å; G23-F27 PolarHBondContact O-N 3.13Å; F24-F27 PolarHBondContact O-N 2.95Å; Y25-F27 VanDerWaalsContact C-N 3.3Å; Y25-F27 PolarHBondContact O-N 2.99Å; F27-G30 PolarHBondContact O-N 3.31Å; F27-T115 HydrophobicContact CE1-CG2 4.45Å; F27-T115 HydrophobicContact CZ-CG2 4.25Å; F27-E118 HydrophobicContact CE2-CB 3.87Å; F27-L119 HydrophobicContact CE1-CD1 4.27Å; F27-L119 HydrophobicContact CE2-CB 4.37Å; F27-L119 HydrophobicContact CE2-CD1 4.48Å; F27-L119 HydrophobicContact CZ-CB 3.92Å; F27-L119 HydrophobicContact CZ-CD1 3.89Å; F27-L122 HydrophobicContact CB-CD1 4.02Å; F27-L122 HydrophobicContact CD2-CD1 3.52Å; F27-L122 HydrophobicContact CE2-CD1 4.11Å; F27-L122 HydrophobicContact CG-CD1 3.77Å
28F90.8Very high92.9Very high123 Ų12367 Ų6754%0.53935%0.349SS..Hα-helixtrans-71.1-31.6-177.8-69.6-60.4000113.3F24 Y25 G30F24-F28 HydrophobicContact CB-CD2 4.47Å; F24-F28 HydrophobicContact CB-CE2 4.39Å; F24-F28 HydrophobicContact CD1-CE2 4.03Å; F24-F28 WeakPolarHBondContact O-CD2 3.2Å; F24-F28 PolarHBondContact O-N 3.34Å; Y25-F28 PolarHBondContact O-N 3.16Å; F28-G30 PolarHBondContact O-N 3.22Å
29A90.2Very high92.8Very high14 Ų1466.4 Ų66.412%0.11635%0.346CS..Hα-helixtrans-68.3-17176.500000113Y25 H31 N32 N33Y25-A29 HydrophobicContact CE1-CB 4.44Å; Y25-A29 HydrophobicContact CE2-CB 4.48Å; Y25-A29 WeakPolarHBondContact O-CB 3.45Å; Y25-A29 PolarHBondContact O-N 3.47Å; A29-H31 PolarHBondContact O-N 3.33Å; A29-N32 PolarHBondContact O-N 3.1Å; A29-N32 VanDerWaalsContact O-N 3.11Å; A29-N33 HydrophobicContact CB-CB 4.42Å; A29-N33 PolarHBondContact O-N 3.21Å
30G86.1Confident92.8Very high31 Ų3164.4 Ų64.432%0.3234%0.336SS..THydrogen-bonded Turntrans-59.1-16.6-175.300000115.7V26 F27 F28 N33V26-G30 PolarHBondContact O-N 3.32Å; F27-G30 PolarHBondContact O-N 3.31Å; F28-G30 PolarHBondContact O-N 3.22Å; G30-N33 WeakPolarHBondContact CA-O 3.37Å
31H84.1Confident92.8Very high75 Ų7561.9 Ų61.935%0.34732%0.322SS..THydrogen-bonded Turntrans-70.8-34.2175.5-75.6-78000113.9A29 I114 T115A29-H31 PolarHBondContact O-N 3.33Å; H31-I114 WeakPolarHBondContact CE1-CG2 3.45Å; H31-I114 WeakPolarHBondContact ND1-CG2 3.41Å; H31-T115 PolarHBondContact CE1-OG1 3.37Å; H31-T115 WeakPolarHBondContact NE2-CG2 3.39Å; H31-T115 PolarHBondContact NE2-OG1 3.24Å
32N83.4Confident92.8Very high145 Ų14561.3 Ų61.378%0.77532%0.316SS*.THydrogen-bonded Turntrans-125.6-17.7-169.9-55.8103.1000112.8A29A29-N32 PolarHBondContact O-N 3.1Å; A29-N32 VanDerWaalsContact O-N 3.11Å
33N87Confident92.9Very high94 Ų9457.5 Ų57.550%0.50330%0.3SS..SBendtrans-131.2161.6-176.6-64.6-75.9000110A29 G30 G35A29-N33 HydrophobicContact CB-CB 4.42Å; A29-N33 PolarHBondContact O-N 3.21Å; G30-N33 WeakPolarHBondContact CA-O 3.37Å; N33-G35 PolarHBondContact O-N 3.43Å
34P86.4Confident92.9Very high127 Ų12758.3 Ų58.383%0.82530%0.304SS*.SBendtrans-53.4124.1170.9-24.734.4000111.3
35G90.9Very high93Very high25 Ų2553 Ų5326%0.25828%0.281SS..  trans167.1-140.8-173.600000112.5N33N33-G35 PolarHBondContact O-N 3.43Å
36G93.9Very high93.2Very high4 Ų448.8 Ų48.84%0.04127%0.273CS..  trans103.8-173175.200000114.5V26 F38 G40V26-G36 PolarHBondContact O-N 3.03Å; G36-F38 PolarHBondContact O-N 3.32Å; G36-G40 PolarHBondContact O-N 3.3Å
37G95.6Very high93.3Very high0 Ų048.3 Ų48.30%027%0.27CS..Hα-helixtrans-63.7-36.9-174.100000113.7G41 E118 L122G37-G41 WeakPolarHBondContact O-CA 3.3Å; G37-G41 PolarHBondContact O-N 2.82Å; G37-E118 WeakPolarHBondContact CA-O 3.14Å; G37-E118 WeakPolarHBondContact CA-OE2 3.3Å; G37-E118 PolarHBondContact N-OE2 3.49Å; G37-L122 WeakPolarHBondContact O-CA 3.21Å
38F96.6Very high93.3Very high118 Ų11849 Ų4952%0.51827%0.273SS..Hα-helixtrans-67.4-56.1-180-167-92000112.1G36 G41 L42 I121 V125G36-F38 PolarHBondContact O-N 3.32Å; F38-G41 PolarHBondContact O-N 3.13Å; F38-L42 HydrophobicContact CD1-CD1 3.94Å; F38-L42 HydrophobicContact CD1-CG 4.4Å; F38-L42 HydrophobicContact CE1-CD1 3.6Å; F38-L42 HydrophobicContact CE1-CG 4.22Å; F38-L42 HydrophobicContact CZ-CD1 4.45Å; F38-L42 WeakPolarHBondContact O-CG 3.22Å; F38-L42 PolarHBondContact O-N 3.34Å; F38-I121 HydrophobicContact CB-CG2 4.25Å; F38-I121 HydrophobicContact CD2-CG2 4.41Å; F38-V125 HydrophobicContact CD2-CG2 3.59Å; F38-V125 HydrophobicContact CE2-CG2 3.9Å; F38-V125 HydrophobicContact CG-CG2 4.36Å
39I96.2Very high93.5Very high81 Ų8145.3 Ų45.342%0.41526%0.258SS..Hα-helixtrans-66.3-43.1-179.2-59174.4000110.3V26 G41 L42 I43V26-I39 HydrophobicContact CG1-CB 4.06Å; V26-I39 HydrophobicContact CG1-CG2 3.79Å; I39-G41 VanDerWaalsContact C-N 3.3Å; I39-G41 PolarHBondContact O-N 2.9Å; I39-L42 PolarHBondContact O-N 3.11Å; I39-I43 HydrophobicContact CG2-CD1 4.02Å; I39-I43 WeakPolarHBondContact O-CG1 3.3Å; I39-I43 PolarHBondContact O-N 2.85Å
40G97Very high93.7Very high0 Ų046.7 Ų46.70%026%0.264CS..Hα-helixtrans-54.6-48.8172.800000111.1G36 L42 I43 F44G36-G40 PolarHBondContact O-N 3.3Å; G40-L42 VanDerWaalsContact C-N 3.34Å; G40-L42 PolarHBondContact O-N 2.87Å; G40-I43 PolarHBondContact O-N 3.35Å; G40-I43 VanDerWaalsContact O-N 3.13Å; G40-F44 WeakPolarHBondContact O-CD2 3.45Å; G40-F44 PolarHBondContact O-N 2.89Å
41G98Very high94.1Very high0 Ų046.9 Ų46.90%026%0.256CS..Hα-helixtrans-59-39.2177.200000113.7G37 F38 I39 F44 S45 V126G37-G41 WeakPolarHBondContact O-CA 3.3Å; G37-G41 PolarHBondContact O-N 2.82Å; F38-G41 PolarHBondContact O-N 3.13Å; I39-G41 VanDerWaalsContact C-N 3.3Å; I39-G41 PolarHBondContact O-N 2.9Å; G41-F44 PolarHBondContact O-N 2.95Å; G41-S45 WeakPolarHBondContact O-CB 3.35Å; G41-S45 PolarHBondContact O-N 3.41Å; G41-S45 PolarHBondContact O-OG 3.32Å; G41-V126 WeakPolarHBondContact O-CG2 3.41Å
42L98.1Very high94.5Very high66 Ų6643.9 Ų43.935%0.34624%0.242SC..Hα-helixtrans-66.2-39.2174.7-69.4178.7000112.5F38 I39 G40 S45 S46 V125 I129F38-L42 HydrophobicContact CD1-CD1 3.94Å; F38-L42 HydrophobicContact CD1-CG 4.4Å; F38-L42 HydrophobicContact CE1-CD1 3.6Å; F38-L42 HydrophobicContact CE1-CG 4.22Å; F38-L42 HydrophobicContact CZ-CD1 4.45Å; F38-L42 WeakPolarHBondContact O-CG 3.22Å; F38-L42 PolarHBondContact O-N 3.34Å; I39-L42 PolarHBondContact O-N 3.11Å; G40-L42 VanDerWaalsContact C-N 3.34Å; G40-L42 PolarHBondContact O-N 2.87Å; L42-S45 PolarHBondContact O-N 3.28Å; L42-S46 WeakPolarHBondContact O-CB 3.37Å; L42-S46 PolarHBondContact O-N 2.76Å; L42-S46 PolarHBondContact O-OG 3.1Å; L42-V125 HydrophobicContact CD2-CG1 3.86Å; L42-V125 HydrophobicContact CG-CG1 4.13Å; L42-I129 HydrophobicContact CD2-CD1 4.4Å; L42-I129 HydrophobicContact CD2-CG1 4.25Å
43I98.2Very high94.9Very high23 Ų2342.5 Ų42.512%0.11824%0.235CC..Hα-helixtrans-65.7-46.6176.3-65.4163000110.2L19 F22 V26 I39 G40 S45 S46 A47L19-I43 HydrophobicContact CB-CG2 4.28Å; L19-I43 HydrophobicContact CD2-CG2 4.21Å; L19-I43 WeakPolarHBondContact O-CG2 3.34Å; F22-I43 HydrophobicContact CD1-CD1 3.74Å; F22-I43 HydrophobicContact CD1-CG2 4.26Å; F22-I43 HydrophobicContact CE1-CD1 3.7Å; V26-I43 HydrophobicContact CB-CD1 4.1Å; V26-I43 HydrophobicContact CG1-CD1 4.26Å; V26-I43 HydrophobicContact CG2-CD1 3.86Å; I39-I43 HydrophobicContact CG2-CD1 4.02Å; I39-I43 WeakPolarHBondContact O-CG1 3.3Å; I39-I43 PolarHBondContact O-N 2.85Å; G40-I43 PolarHBondContact O-N 3.35Å; G40-I43 VanDerWaalsContact O-N 3.13Å; I43-S45 VanDerWaalsContact C-N 3.32Å; I43-S45 PolarHBondContact O-N 3.26Å; I43-S46 WeakPolarHBondContact O-CB 3.1Å; I43-S46 PolarHBondContact O-N 2.87Å; I43-A47 PolarHBondContact O-N 3.39Å; I43-A47 VanDerWaalsContact O-N 3.07Å
44F98Very high95.1Very high16 Ų1638.5 Ų38.57%0.0721%0.214CC..Hα-helixtrans-56.4-47173.3-81-68.4000111.5L20 G23 F24 G40 G41 S46 A47 F48 L122 V126L20-F44 HydrophobicContact CB-CE1 4.31Å; L20-F44 HydrophobicContact CD2-CD1 3.44Å; L20-F44 VanDerWaalsContact CD2-CD1 3.44Å; L20-F44 HydrophobicContact CD2-CE1 3.77Å; G23-F44 VanDerWaalsContact C-CE2 3.45Å; F24-F44 HydrophobicContact CB-CZ 4.39Å; F24-F44 HydrophobicContact CD1-CE2 4.49Å; F24-F44 AromaticContact CD1-CZ 3.8Å; F24-F44 HydrophobicContact CD1-CZ 3.8Å; F24-F44 HydrophobicContact CD2-CE1 4.01Å; F24-F44 AromaticContact CD2-CZ 3.63Å; F24-F44 HydrophobicContact CD2-CZ 3.63Å; F24-F44 AromaticContact CE1-CZ 3.86Å; F24-F44 HydrophobicContact CE1-CZ 3.86Å; F24-F44 AromaticContact CE2-CE1 3.77Å; F24-F44 HydrophobicContact CE2-CE1 3.77Å; F24-F44 AromaticContact CE2-CZ 3.69Å; F24-F44 HydrophobicContact CE2-CZ 3.69Å; F24-F44 HydrophobicContact CG-CE1 4.5Å; F24-F44 AromaticContact CG-CZ 3.67Å; F24-F44 HydrophobicContact CG-CZ 3.67Å; F24-F44 HydrophobicContact CZ-CE1 4.06Å; F24-F44 AromaticContact CZ-CZ 3.8Å; F24-F44 HydrophobicContact CZ-CZ 3.8Å; G40-F44 WeakPolarHBondContact O-CD2 3.45Å; G40-F44 PolarHBondContact O-N 2.89Å; G41-F44 PolarHBondContact O-N 2.95Å; F44-S46 VanDerWaalsContact C-N 3.3Å; F44-S46 PolarHBondContact O-N 3.46Å; F44-A47 VanDerWaalsContact O-CB 3.32Å; F44-A47 WeakPolarHBondContact O-CB 3.4Å; F44-A47 PolarHBondContact O-N 3.47Å; F44-A47 VanDerWaalsContact O-N 3.11Å; F44-F48 WeakPolarHBondContact O-CD2 3.49Å; F44-F48 PolarHBondContact O-N 2.96Å; F44-L122 HydrophobicContact CD2-CD1 3.99Å; F44-L122 HydrophobicContact CD2-CD2 4.22Å; F44-L122 HydrophobicContact CD2-CG 4.3Å; F44-L122 HydrophobicContact CE2-CD1 3.9Å; F44-V126 HydrophobicContact CB-CG2 3.65Å
45S97.6Very high95.3Very high1 Ų134.5 Ų34.51%0.00718%0.184CC..Hα-helixtrans-59.8-41.4177.6-56.60000112G41 L42 I43 A47 F48 I49 V126G41-S45 WeakPolarHBondContact O-CB 3.35Å; G41-S45 PolarHBondContact O-N 3.41Å; G41-S45 PolarHBondContact O-OG 3.32Å; L42-S45 PolarHBondContact O-N 3.28Å; I43-S45 VanDerWaalsContact C-N 3.32Å; I43-S45 PolarHBondContact O-N 3.26Å; S45-A47 VanDerWaalsContact C-N 3.27Å; S45-A47 PolarHBondContact O-N 2.64Å; S45-F48 PolarHBondContact O-N 3.32Å; S45-I49 VanDerWaalsContact O-CG1 3.28Å; S45-I49 WeakPolarHBondContact O-CG1 3.38Å; S45-I49 PolarHBondContact O-N 3.46Å; S45-V126 WeakPolarHBondContact OG-CA 3.45Å
46S97.9Very high95.3Very high58 Ų5836.4 Ų36.441%0.40619%0.188SC..Hα-helixtrans-61.7-36.2177-58.30000111.8L42 I43 F44 I49 L50L42-S46 WeakPolarHBondContact O-CB 3.37Å; L42-S46 PolarHBondContact O-N 2.76Å; L42-S46 PolarHBondContact O-OG 3.1Å; I43-S46 WeakPolarHBondContact O-CB 3.1Å; I43-S46 PolarHBondContact O-N 2.87Å; F44-S46 VanDerWaalsContact C-N 3.3Å; F44-S46 PolarHBondContact O-N 3.46Å; S46-I49 PolarHBondContact O-N 3.01Å; S46-L50 WeakPolarHBondContact O-CB 3.47Å; S46-L50 PolarHBondContact O-N 3.21Å
47A97.4Very high95.1Very high1 Ų137.4 Ų37.41%0.00819%0.193CC..Hα-helixtrans-63.8-45.5174.900000111.7V16 L19 L20 I43 F44 S45 L50 M51V16-A47 HydrophobicContact CG1-CB 4.35Å; L19-A47 HydrophobicContact CB-CB 3.78Å; L19-A47 HydrophobicContact CD1-CB 4.08Å; L20-A47 HydrophobicContact CD2-CB 3.81Å; L20-A47 HydrophobicContact CG-CB 4.16Å; I43-A47 PolarHBondContact O-N 3.39Å; I43-A47 VanDerWaalsContact O-N 3.07Å; F44-A47 VanDerWaalsContact O-CB 3.32Å; F44-A47 WeakPolarHBondContact O-CB 3.4Å; F44-A47 PolarHBondContact O-N 3.47Å; F44-A47 VanDerWaalsContact O-N 3.11Å; S45-A47 VanDerWaalsContact C-N 3.27Å; S45-A47 PolarHBondContact O-N 2.64Å; A47-L50 PolarHBondContact O-N 2.99Å; A47-M51 PolarHBondContact O-N 2.96Å; A47-M51 VanDerWaalsContact O-N 3.1Å
48F95.3Very high94.7Very high27 Ų2742.3 Ų42.312%0.11822%0.216CC..Hα-helixtrans-64-44.4175.7-66.2-66.6000111.9F44 S45 L50 M51 F52 L64 F68 V126 V130F44-F48 WeakPolarHBondContact O-CD2 3.49Å; F44-F48 PolarHBondContact O-N 2.96Å; S45-F48 PolarHBondContact O-N 3.32Å; F48-L50 VanDerWaalsContact C-N 3.34Å; F48-L50 PolarHBondContact O-N 3.17Å; F48-M51 HydrophobicContact CD1-CE 3.79Å; F48-M51 HydrophobicContact CE1-CE 4.36Å; F48-M51 WeakPolarHBondContact O-CB 3.16Å; F48-M51 PolarHBondContact O-N 3.26Å; F48-M51 VanDerWaalsContact O-N 3.13Å; F48-F52 HydrophobicContact CB-CE2 4.02Å; F48-F52 HydrophobicContact CB-CZ 4.35Å; F48-F52 WeakPolarHBondContact O-CD2 3.08Å; F48-F52 VanDerWaalsContact O-CG 3.3Å; F48-F52 WeakPolarHBondContact O-CG 3.33Å; F48-F52 PolarHBondContact O-N 3.39Å; F48-L64 HydrophobicContact CD1-CD1 3.84Å; F48-L64 HydrophobicContact CE1-CD1 3.61Å; F48-F68 HydrophobicContact CD1-CZ 4.16Å; F48-F68 HydrophobicContact CD2-CE1 4.32Å; F48-F68 HydrophobicContact CE1-CZ 4.19Å; F48-F68 HydrophobicContact CE2-CE1 4.27Å; F48-F68 HydrophobicContact CG-CZ 4.37Å; F48-F68 HydrophobicContact CZ-CE1 4.42Å; F48-F68 HydrophobicContact CZ-CZ 4.42Å; F48-V126 HydrophobicContact CD2-CG1 4.18Å; F48-V126 HydrophobicContact CE2-CG1 3.9Å; F48-V130 HydrophobicContact CB-CG2 3.92Å; F48-V130 HydrophobicContact CD2-CG2 4.07Å; F48-V130 HydrophobicContact CG-CG2 4.23Å
49I94.9Very high94.3Very high46 Ų4642 Ų4224%0.23622%0.217CC..Hα-helixtrans-59.8-44.8177.2-67.2166.1000111S45 S46 M51 F52 L53 I129 M133S45-I49 VanDerWaalsContact O-CG1 3.28Å; S45-I49 WeakPolarHBondContact O-CG1 3.38Å; S45-I49 PolarHBondContact O-N 3.46Å; S46-I49 PolarHBondContact O-N 3.01Å; I49-M51 PolarHBondContact O-N 2.9Å; I49-F52 PolarHBondContact O-N 3.47Å; I49-F52 VanDerWaalsContact O-N 3.16Å; I49-L53 HydrophobicContact CG2-CD1 4.2Å; I49-L53 HydrophobicContact CG2-CG 4.5Å; I49-L53 WeakPolarHBondContact O-CG 3.35Å; I49-L53 PolarHBondContact O-N 3.21Å; I49-I129 HydrophobicContact CD1-CG2 3.83Å; I49-M133 HydrophobicContact CG1-CB 4.43Å; I49-M133 HydrophobicContact CG1-CG 4.22Å
50L95.5Very high94Very high43 Ų4338.5 Ų38.523%0.22520%0.199CC..Hα-helixtrans-61.3-36.8177.7-175.164.8000111.8T12 V15 V16 L19 S46 A47 F48 L53 A54T12-L50 HydrophobicContact CG2-CD2 4.2Å; T12-L50 HydrophobicContact CG2-CG 3.84Å; V15-L50 HydrophobicContact CB-CD2 3.84Å; V15-L50 HydrophobicContact CG1-CD2 3.5Å; V16-L50 HydrophobicContact CG2-CD2 4.25Å; L19-L50 HydrophobicContact CD1-CD2 4.35Å; S46-L50 WeakPolarHBondContact O-CB 3.47Å; S46-L50 PolarHBondContact O-N 3.21Å; A47-L50 PolarHBondContact O-N 2.99Å; F48-L50 VanDerWaalsContact C-N 3.34Å; F48-L50 PolarHBondContact O-N 3.17Å; L50-L53 PolarHBondContact O-N 3.37Å; L50-A54 PolarHBondContact O-N 3.05Å
51M93.7Very high93.7Very high34 Ų3441.1 Ų41.117%0.16721%0.212CC..Hα-helixtrans-65.5-43.8174.6-171.4166.744.900111.6V16 A47 F48 I49 L53 A54 F55 V60 L64V16-M51 HydrophobicContact CG2-CB 4.47Å; A47-M51 PolarHBondContact O-N 2.96Å; A47-M51 VanDerWaalsContact O-N 3.1Å; F48-M51 HydrophobicContact CD1-CE 3.79Å; F48-M51 HydrophobicContact CE1-CE 4.36Å; F48-M51 WeakPolarHBondContact O-CB 3.16Å; F48-M51 PolarHBondContact O-N 3.26Å; F48-M51 VanDerWaalsContact O-N 3.13Å; I49-M51 PolarHBondContact O-N 2.9Å; M51-L53 PolarHBondContact O-N 3.34Å; M51-A54 PolarHBondContact O-N 2.9Å; M51-F55 HydrophobicContact CG-CD2 3.93Å; M51-F55 WeakPolarHBondContact O-CB 3.32Å; M51-F55 WeakPolarHBondContact O-CD2 3.36Å; M51-F55 PolarHBondContact O-N 3.43Å; M51-V60 HydrophobicContact CE-CG1 3.32Å; M51-V60 HydrophobicContact CG-CB 4.4Å; M51-V60 HydrophobicContact CG-CG1 3.77Å; M51-V60 HydrophobicContact CG-CG2 3.62Å; M51-V60 HydrophobicContact SD-CG1 3.66Å; M51-V60 HydrophobicContact SD-CG2 4.2Å; M51-L64 HydrophobicContact CE-CD1 3.96Å
52F92Very high93.2Very high12 Ų1249 Ų495%0.05325%0.25CC..Hα-helixtrans-64.7-24.3174.7-59-38.6000114F48 I49 V57 V60 L61 V130 M133 L134F48-F52 HydrophobicContact CB-CE2 4.02Å; F48-F52 HydrophobicContact CB-CZ 4.35Å; F48-F52 WeakPolarHBondContact O-CD2 3.08Å; F48-F52 VanDerWaalsContact O-CG 3.3Å; F48-F52 WeakPolarHBondContact O-CG 3.33Å; F48-F52 PolarHBondContact O-N 3.39Å; I49-F52 PolarHBondContact O-N 3.47Å; I49-F52 VanDerWaalsContact O-N 3.16Å; F52-V57 HydrophobicContact CB-CG2 4.11Å; F52-V57 HydrophobicContact CD1-CB 4.5Å; F52-V57 HydrophobicContact CD1-CG1 4.13Å; F52-V57 HydrophobicContact CD1-CG2 4.32Å; F52-V57 HydrophobicContact CE1-CG1 4.37Å; F52-V57 HydrophobicContact CG-CG2 4.44Å; F52-V60 HydrophobicContact CD1-CB 4.05Å; F52-V60 HydrophobicContact CD1-CG1 3.78Å; F52-V60 HydrophobicContact CD1-CG2 4.47Å; F52-V60 HydrophobicContact CE1-CB 3.96Å; F52-V60 HydrophobicContact CE1-CG1 3.4Å; F52-V60 VanDerWaalsContact CE1-CG1 3.4Å; F52-V60 HydrophobicContact CZ-CG1 4.43Å; F52-L61 HydrophobicContact CE1-CD2 4.15Å; F52-L61 HydrophobicContact CE1-CG 4.37Å; F52-L61 HydrophobicContact CZ-CD2 4.14Å; F52-V130 HydrophobicContact CE2-CG1 3.8Å; F52-V130 HydrophobicContact CZ-CG1 4.04Å; F52-M133 HydrophobicContact CD2-CG 4.43Å; F52-L134 HydrophobicContact CE1-CD2 4.47Å; F52-L134 HydrophobicContact CE2-CD2 4.22Å; F52-L134 HydrophobicContact CZ-CD2 4.16Å
53L91.8Very high92.9Very high117 Ų11749.7 Ų49.761%0.61326%0.26SS*.Hα-helixtrans-79.7-29.7175.2-71172.5000113.1I49 L50 M51I49-L53 HydrophobicContact CG2-CD1 4.2Å; I49-L53 HydrophobicContact CG2-CG 4.5Å; I49-L53 WeakPolarHBondContact O-CG 3.35Å; I49-L53 PolarHBondContact O-N 3.21Å; L50-L53 PolarHBondContact O-N 3.37Å; M51-L53 PolarHBondContact O-N 3.34Å
54A92.9Very high92.5Very high9 Ų950.5 Ų50.57%0.07426%0.264CS..Hα-helixtrans-98.1-23.7-175.100000113.9L8 R9 T12 L50 M51L8-A54 HydrophobicContact CD2-CB 4.32Å; L8-A54 HydrophobicContact CG-CB 4.01Å; R9-A54 WeakPolarHBondContact CG-O 3.39Å; R9-A54 PolarHBondContact NE-O 3.2Å; T12-A54 HydrophobicContact CG2-CB 3.77Å; T12-A54 VanDerWaalsContact OG1-CB 3.3Å; T12-A54 WeakPolarHBondContact OG1-CB 3.28Å; L50-A54 PolarHBondContact O-N 3.05Å; M51-A54 PolarHBondContact O-N 2.9Å
55F90.9Very high92Very high43 Ų4356 Ų5619%0.18930%0.302CS..SBendtrans-124.2166.5-176.3-60.3-82.7000111R9 T12 K13 M51 V60R9-F55 HydrophobicContact CB-CE1 3.95Å; R9-F55 HydrophobicContact CB-CZ 3.84Å; R9-F55 HydrophobicContact CG-CD1 4.18Å; R9-F55 HydrophobicContact CG-CE1 3.68Å; R9-F55 HydrophobicContact CG-CZ 3.91Å; T12-F55 HydrophobicContact CG2-CD2 4.44Å; T12-F55 HydrophobicContact CG2-CE2 3.87Å; K13-F55 HydrophobicContact CG-CZ 4.09Å; M51-F55 HydrophobicContact CG-CD2 3.93Å; M51-F55 WeakPolarHBondContact O-CB 3.32Å; M51-F55 WeakPolarHBondContact O-CD2 3.36Å; M51-F55 PolarHBondContact O-N 3.43Å; F55-V60 HydrophobicContact CB-CG2 3.66Å
56N89.4Confident91.8Very high66 Ų6659.4 Ų59.435%0.35332%0.319SS..  trans-68.5135172.8170.5-79.7000109.3E58 E59 V60N56-E58 VanDerWaalsContact CG-OE2 3.26Å; N56-E58 PolarHBondContact ND2-OE2 3.4Å; N56-E58 PolarHBondContact O-N 3.11Å; N56-E58 WeakPolarHBondContact OD1-CA 3.28Å; N56-E58 VanDerWaalsContact OD1-CB 3.31Å; N56-E58 WeakPolarHBondContact OD1-CB 3.33Å; N56-E58 PolarHBondContact OD1-N 3.07Å; N56-E58 PolarHBondContact OD1-OE2 3.38Å; N56-E59 HydrophobicContact CB-CB 4.27Å; N56-E59 HydrophobicContact CB-CG 4.03Å; N56-E59 PolarHBondContact O-N 3.21Å; N56-E59 PolarHBondContact OD1-N 3.36Å; N56-V60 VanDerWaalsContact O-CG2 3.28Å; N56-V60 WeakPolarHBondContact O-CG2 3.48Å; N56-V60 PolarHBondContact O-N 3.14Å; N56-V60 VanDerWaalsContact O-N 3.15Å
57V89.3Confident91.6Very high24 Ų2460.5 Ų60.515%0.14532%0.32CS..Hα-helixtrans-64.7-41.2-173.6177.50000111.2F52 V60 L61 L134F52-V57 HydrophobicContact CB-CG2 4.11Å; F52-V57 HydrophobicContact CD1-CB 4.5Å; F52-V57 HydrophobicContact CD1-CG1 4.13Å; F52-V57 HydrophobicContact CD1-CG2 4.32Å; F52-V57 HydrophobicContact CE1-CG1 4.37Å; F52-V57 HydrophobicContact CG-CG2 4.44Å; V57-V60 PolarHBondContact O-N 2.82Å; V57-L61 HydrophobicContact CG1-CD1 3.99Å; V57-L61 HydrophobicContact CG1-CG 4.35Å; V57-L61 WeakPolarHBondContact O-CG 3.45Å; V57-L61 PolarHBondContact O-N 3.33Å; V57-L134 HydrophobicContact CG1-CD2 3.47Å; V57-L134 VanDerWaalsContact CG1-CD2 3.47Å
58E87.5Confident91.4Very high103 Ų10360.8 Ų60.848%0.48132%0.321SS..Hα-helixtrans-62.2-46.8178-63.273.2-153.900111.3N56 V60 L61 E62N56-E58 VanDerWaalsContact CG-OE2 3.26Å; N56-E58 PolarHBondContact ND2-OE2 3.4Å; N56-E58 PolarHBondContact O-N 3.11Å; N56-E58 WeakPolarHBondContact OD1-CA 3.28Å; N56-E58 VanDerWaalsContact OD1-CB 3.31Å; N56-E58 WeakPolarHBondContact OD1-CB 3.33Å; N56-E58 PolarHBondContact OD1-N 3.07Å; N56-E58 PolarHBondContact OD1-OE2 3.38Å; E58-V60 VanDerWaalsContact C-N 3.26Å; E58-V60 PolarHBondContact O-N 2.92Å; E58-L61 PolarHBondContact O-N 3.48Å; E58-E62 WeakPolarHBondContact O-CB 3.4Å; E58-E62 WeakPolarHBondContact O-CG 3.34Å; E58-E62 PolarHBondContact O-N 2.89Å
59E88.2Confident91.4Very high113 Ų11365.4 Ų65.453%0.52834%0.338SS..Hα-helixtrans-57.5-40176.3-71.3177.4-17500112N56 S63N56-E59 HydrophobicContact CB-CB 4.27Å; N56-E59 HydrophobicContact CB-CG 4.03Å; N56-E59 PolarHBondContact O-N 3.21Å; N56-E59 PolarHBondContact OD1-N 3.36Å; E59-S63 PolarHBondContact O-N 2.83Å
60V90.6Very high91.5Very high6 Ų667.5 Ų67.54%0.03635%0.349CS..Hα-helixtrans-68.8-45.5179.7173.70000111M51 F52 F55 N56 V57 E58 S63 L64M51-V60 HydrophobicContact CE-CG1 3.32Å; M51-V60 HydrophobicContact CG-CB 4.4Å; M51-V60 HydrophobicContact CG-CG1 3.77Å; M51-V60 HydrophobicContact CG-CG2 3.62Å; M51-V60 HydrophobicContact SD-CG1 3.66Å; M51-V60 HydrophobicContact SD-CG2 4.2Å; F52-V60 HydrophobicContact CD1-CB 4.05Å; F52-V60 HydrophobicContact CD1-CG1 3.78Å; F52-V60 HydrophobicContact CD1-CG2 4.47Å; F52-V60 HydrophobicContact CE1-CB 3.96Å; F52-V60 HydrophobicContact CE1-CG1 3.4Å; F52-V60 VanDerWaalsContact CE1-CG1 3.4Å; F52-V60 HydrophobicContact CZ-CG1 4.43Å; F55-V60 HydrophobicContact CB-CG2 3.66Å; N56-V60 VanDerWaalsContact O-CG2 3.28Å; N56-V60 WeakPolarHBondContact O-CG2 3.48Å; N56-V60 PolarHBondContact O-N 3.14Å; N56-V60 VanDerWaalsContact O-N 3.15Å; V57-V60 PolarHBondContact O-N 2.82Å; E58-V60 VanDerWaalsContact C-N 3.26Å; E58-V60 PolarHBondContact O-N 2.92Å; V60-S63 PolarHBondContact O-N 2.87Å; V60-S63 PolarHBondContact O-OG 3.19Å; V60-L64 HydrophobicContact CG1-CD1 4.2Å; V60-L64 PolarHBondContact O-N 3.48Å
61L89.9Confident91.6Very high55 Ų5566.9 Ų66.929%0.28835%0.345SS..Hα-helixtrans-67.4-36.5178.6-68.8177.3000111.9F52 V57 E58 S63 L64 F68 L134F52-L61 HydrophobicContact CE1-CD2 4.15Å; F52-L61 HydrophobicContact CE1-CG 4.37Å; F52-L61 HydrophobicContact CZ-CD2 4.14Å; V57-L61 HydrophobicContact CG1-CD1 3.99Å; V57-L61 HydrophobicContact CG1-CG 4.35Å; V57-L61 WeakPolarHBondContact O-CG 3.45Å; V57-L61 PolarHBondContact O-N 3.33Å; E58-L61 PolarHBondContact O-N 3.48Å; L61-S63 PolarHBondContact O-N 2.91Å; L61-L64 CarbonylContact O-C 3.59Å; L61-L64 PolarHBondContact O-N 3.29Å; L61-L64 VanDerWaalsContact O-N 3.09Å; L61-F68 HydrophobicContact CD2-CD2 4.31Å; L61-F68 HydrophobicContact CD2-CE2 3.89Å; L61-L134 HydrophobicContact CD1-CD1 4.15Å; L61-L134 HydrophobicContact CD1-CD2 4.01Å; L61-L134 HydrophobicContact CD2-CD1 4.16Å
62E88.9Confident91.8Very high167 Ų16767.6 Ų67.678%0.7835%0.349SS*.Hα-helixtrans-62.9-31.3173.4-75.4-179.2176.900112.4E58 L64E58-E62 WeakPolarHBondContact O-CB 3.4Å; E58-E62 WeakPolarHBondContact O-CG 3.34Å; E58-E62 PolarHBondContact O-N 2.89Å; E62-L64 VanDerWaalsContact C-N 3.31Å
63S90.9Very high92.1Very high80 Ų8071.5 Ų71.556%0.55937%0.369SS*.Hα-helixtrans-77.7-14.5175.478.10000114.2E59 V60 L61E59-S63 PolarHBondContact O-N 2.83Å; V60-S63 PolarHBondContact O-N 2.87Å; V60-S63 PolarHBondContact O-OG 3.19Å; L61-S63 PolarHBondContact O-N 2.91Å
64L89.8Confident92.4Very high40 Ų4069.8 Ų69.821%0.20936%0.36CS..  trans-116.1105.9-177.4-68.8176.7000110.4F48 M51 V60 L61 E62 I66 F68F48-L64 HydrophobicContact CD1-CD1 3.84Å; F48-L64 HydrophobicContact CE1-CD1 3.61Å; M51-L64 HydrophobicContact CE-CD1 3.96Å; V60-L64 HydrophobicContact CG1-CD1 4.2Å; V60-L64 PolarHBondContact O-N 3.48Å; L61-L64 CarbonylContact O-C 3.59Å; L61-L64 PolarHBondContact O-N 3.29Å; L61-L64 VanDerWaalsContact O-N 3.09Å; E62-L64 VanDerWaalsContact C-N 3.31Å; L64-I66 PolarHBondContact O-N 3.3Å; L64-F68 HydrophobicContact CD1-CZ 4.4Å
65P88.5Confident92.7Very high132 Ų13269.4 Ų69.486%0.85736%0.356SS*.  trans-76.651.1178.434-37.1000111.9
66I91.6Very high93Very high72 Ų7269.3 Ų69.337%0.36936%0.364SS..  trans-129.1117.6-174.8-56176.9000109.1L64 F68 L71L64-I66 PolarHBondContact O-N 3.3Å; I66-F68 HydrophobicContact CG2-CD1 4.47Å; I66-F68 HydrophobicContact CG2-CE1 4.44Å; I66-F68 PolarHBondContact O-N 2.96Å; I66-L71 HydrophobicContact CG2-CB 4.43Å; I66-L71 HydrophobicContact CG2-CD2 4.15Å
67D93.8Very high93.4Very high80 Ų8070.8 Ų70.843%0.42837%0.371SS..  trans-83.1109.3164.1-178.9-31.6000108.7R69 I70 L71D67-R69 PolarHBondContact O-N 3.46Å; D67-R69 WeakPolarHBondContact OD1-CA 3.46Å; D67-R69 WeakPolarHBondContact OD1-CB 3.22Å; D67-R69 PolarHBondContact OD1-N 3.44Å; D67-I70 HydrophobicContact CB-CB 4.04Å; D67-I70 HydrophobicContact CB-CD1 3.91Å; D67-I70 HydrophobicContact CB-CG1 4.04Å; D67-I70 PolarHBondContact O-N 3.3Å; D67-I70 PolarHBondContact OD1-N 3.01Å; D67-I70 WeakPolarHBondContact OD2-CD1 3.27Å; D67-L71 WeakPolarHBondContact O-CB 3.46Å; D67-L71 PolarHBondContact O-N 3.19Å
68F95Very high93.8Very high7 Ų771.5 Ų71.53%0.03138%0.376CS..Hα-helixtrans-66.6-23.3-178.1-70.6-82.1000113.5F48 L61 L64 I66 L71 M72 V126 G127 V130 L134F48-F68 HydrophobicContact CD1-CZ 4.16Å; F48-F68 HydrophobicContact CD2-CE1 4.32Å; F48-F68 HydrophobicContact CE1-CZ 4.19Å; F48-F68 HydrophobicContact CE2-CE1 4.27Å; F48-F68 HydrophobicContact CG-CZ 4.37Å; F48-F68 HydrophobicContact CZ-CE1 4.42Å; F48-F68 HydrophobicContact CZ-CZ 4.42Å; L61-F68 HydrophobicContact CD2-CD2 4.31Å; L61-F68 HydrophobicContact CD2-CE2 3.89Å; L64-F68 HydrophobicContact CD1-CZ 4.4Å; I66-F68 HydrophobicContact CG2-CD1 4.47Å; I66-F68 HydrophobicContact CG2-CE1 4.44Å; I66-F68 PolarHBondContact O-N 2.96Å; F68-L71 HydrophobicContact CD1-CD2 4.13Å; F68-M72 PolarHBondContact O-N 2.97Å; F68-M72 VanDerWaalsContact O-N 3.11Å; F68-V126 HydrophobicContact CD1-CG1 4.14Å; F68-V126 HydrophobicContact CE1-CG1 3.96Å; F68-G127 CarbonylContact O-C 3.46Å; F68-G127 WeakPolarHBondContact O-CA 3.39Å; F68-V130 HydrophobicContact CB-CB 4.23Å; F68-V130 HydrophobicContact CB-CG1 4.08Å; F68-V130 HydrophobicContact CD1-CB 3.57Å; F68-V130 HydrophobicContact CD1-CG1 3.59Å; F68-V130 HydrophobicContact CD1-CG2 3.92Å; F68-V130 HydrophobicContact CD2-CB 4.31Å; F68-V130 HydrophobicContact CD2-CG1 3.43Å; F68-V130 VanDerWaalsContact CD2-CG1 3.43Å; F68-V130 HydrophobicContact CE1-CB 3.93Å; F68-V130 HydrophobicContact CE1-CG1 3.79Å; F68-V130 HydrophobicContact CE1-CG2 3.82Å; F68-V130 HydrophobicContact CE2-CG1 3.64Å; F68-V130 HydrophobicContact CG-CB 3.78Å; F68-V130 HydrophobicContact CG-CG1 3.4Å; F68-V130 VanDerWaalsContact CG-CG1 3.4Å; F68-V130 HydrophobicContact CZ-CB 4.44Å; F68-V130 HydrophobicContact CZ-CG1 3.81Å; F68-V130 HydrophobicContact CZ-CG2 4.39Å; F68-L134 HydrophobicContact CD2-CD1 4.47Å
69R95.1Very high94.3Very high124 Ų12467.1 Ų67.147%0.46836%0.356SS..Hα-helixtrans-73.2-45.2175.2-168.1-178.3-70.8-154-3.2110.1D67 L71 M72 I73 S141D67-R69 PolarHBondContact O-N 3.46Å; D67-R69 WeakPolarHBondContact OD1-CA 3.46Å; D67-R69 WeakPolarHBondContact OD1-CB 3.22Å; D67-R69 PolarHBondContact OD1-N 3.44Å; R69-L71 VanDerWaalsContact C-N 3.32Å; R69-M72 HydrophobicContact CB-CE 4.37Å; R69-M72 HydrophobicContact CG-CE 4.01Å; R69-M72 PolarHBondContact O-N 3.46Å; R69-I73 WeakPolarHBondContact O-CG1 3.29Å; R69-I73 PolarHBondContact O-N 3.46Å; R69-S141 VanDerWaalsContact CZ-OG 3.31Å; R69-S141 PolarHBondContact NE-OG 3.49Å; R69-S141 PolarHBondContact NH2-OG 3.36Å
70I96.9Very high94.7Very high91 Ų9164.6 Ų64.647%0.46735%0.351SS..Hα-helixtrans-63.2-41.9173.3-65.3177.2000110.3D67 M72 I73 I74D67-I70 HydrophobicContact CB-CB 4.04Å; D67-I70 HydrophobicContact CB-CD1 3.91Å; D67-I70 HydrophobicContact CB-CG1 4.04Å; D67-I70 PolarHBondContact O-N 3.3Å; D67-I70 PolarHBondContact OD1-N 3.01Å; D67-I70 WeakPolarHBondContact OD2-CD1 3.27Å; I70-M72 VanDerWaalsContact C-N 3.28Å; I70-M72 PolarHBondContact O-N 2.87Å; I70-I73 PolarHBondContact O-N 3.43Å; I70-I73 VanDerWaalsContact O-N 3.1Å; I70-I74 HydrophobicContact CG2-CD1 3.63Å; I70-I74 HydrophobicContact CG2-CG1 4.11Å; I70-I74 WeakPolarHBondContact O-CG1 3.48Å; I70-I74 PolarHBondContact O-N 2.89Å
71L97.6Very high95Very high29 Ų2968.5 Ų68.515%0.15237%0.371CS..Hα-helixtrans-56.8-42.5177.5-172.667.2000111.8I66 D67 F68 R69 I73 I74 G75 F123 V126I66-L71 HydrophobicContact CG2-CB 4.43Å; I66-L71 HydrophobicContact CG2-CD2 4.15Å; D67-L71 WeakPolarHBondContact O-CB 3.46Å; D67-L71 PolarHBondContact O-N 3.19Å; F68-L71 HydrophobicContact CD1-CD2 4.13Å; R69-L71 VanDerWaalsContact C-N 3.32Å; L71-I73 PolarHBondContact O-N 3.37Å; L71-I74 PolarHBondContact O-N 3.46Å; L71-G75 PolarHBondContact O-N 3.46Å; L71-F123 HydrophobicContact CD1-CB 4.05Å; L71-F123 HydrophobicContact CD1-CD1 4.11Å; L71-F123 HydrophobicContact CD1-CD2 4.25Å; L71-F123 HydrophobicContact CD1-CG 3.89Å; L71-F123 HydrophobicContact CG-CB 4.14Å; L71-F123 HydrophobicContact CG-CG 4.46Å; L71-V126 HydrophobicContact CD2-CB 4.32Å; L71-V126 HydrophobicContact CD2-CG1 3.94Å
72M97.5Very high95.2Very high50 Ų5066.6 Ų66.625%0.24636%0.362CS..Hα-helixtrans-63.3-42.3177.2114.9174.967.400111.8F68 R69 I70 G75 A76 V128 T131F68-M72 PolarHBondContact O-N 2.97Å; F68-M72 VanDerWaalsContact O-N 3.11Å; R69-M72 HydrophobicContact CB-CE 4.37Å; R69-M72 HydrophobicContact CG-CE 4.01Å; R69-M72 PolarHBondContact O-N 3.46Å; I70-M72 VanDerWaalsContact C-N 3.28Å; I70-M72 PolarHBondContact O-N 2.87Å; M72-G75 PolarHBondContact O-N 3.49Å; M72-A76 WeakPolarHBondContact O-CB 3.43Å; M72-A76 PolarHBondContact O-N 2.94Å; M72-V128 HydrophobicContact CB-CG2 4.25Å; M72-V128 HydrophobicContact CG-CG2 4.33Å; M72-V128 HydrophobicContact SD-CG2 3.58Å; M72-V128 VanDerWaalsContact SD-CG2 3.58Å; M72-T131 HydrophobicContact CE-CG2 4.19Å
73I98.2Very high95.5Very high94 Ų9458.8 Ų58.848%0.48233%0.326SS..Hα-helixtrans-65.9-45.6-179.9-65166.9000110R69 I70 L71 G75 A76 L77R69-I73 WeakPolarHBondContact O-CG1 3.29Å; R69-I73 PolarHBondContact O-N 3.46Å; I70-I73 PolarHBondContact O-N 3.43Å; I70-I73 VanDerWaalsContact O-N 3.1Å; L71-I73 PolarHBondContact O-N 3.37Å; I73-G75 VanDerWaalsContact C-N 3.32Å; I73-G75 PolarHBondContact O-N 2.9Å; I73-A76 PolarHBondContact O-N 2.93Å; I73-L77 HydrophobicContact CG2-CD1 4.04Å; I73-L77 HydrophobicContact CG2-CG 4.44Å; I73-L77 WeakPolarHBondContact O-CB 3.34Å; I73-L77 WeakPolarHBondContact O-CG 3.28Å; I73-L77 PolarHBondContact O-N 3.01Å
74I98.2Very high95.8Very high81 Ų8158.5 Ų58.542%0.41532%0.317SS..Hα-helixtrans-59.4-46176-68.6173.4000110I70 L71 A76 L77 V78I70-I74 HydrophobicContact CG2-CD1 3.63Å; I70-I74 HydrophobicContact CG2-CG1 4.11Å; I70-I74 WeakPolarHBondContact O-CG1 3.48Å; I70-I74 PolarHBondContact O-N 2.89Å; L71-I74 PolarHBondContact O-N 3.46Å; I74-A76 PolarHBondContact O-N 2.87Å; I74-L77 PolarHBondContact O-N 3.49Å; I74-V78 HydrophobicContact CG2-CG2 4.24Å; I74-V78 WeakPolarHBondContact O-CB 3.44Å; I74-V78 VanDerWaalsContact O-CG2 3.29Å; I74-V78 WeakPolarHBondContact O-CG2 3.33Å; I74-V78 PolarHBondContact O-N 3.18Å
75G98.2Very high96Very high0 Ų060.4 Ų60.40%033%0.327CS..Hα-helixtrans-57.2-47.6177.300000112.6L71 M72 I73 L77 V78 S79 G120 S124L71-G75 PolarHBondContact O-N 3.46Å; M72-G75 PolarHBondContact O-N 3.49Å; I73-G75 VanDerWaalsContact C-N 3.32Å; I73-G75 PolarHBondContact O-N 2.9Å; G75-L77 VanDerWaalsContact C-N 3.35Å; G75-L77 PolarHBondContact O-N 2.68Å; G75-V78 PolarHBondContact O-N 3.38Å; G75-S79 PolarHBondContact O-N 3.39Å; G75-S79 PolarHBondContact O-OG 3.43Å; G75-G120 CarbonylContact C-O 3.24Å; G75-G120 VanDerWaalsContact C-O 3.24Å; G75-G120 WeakPolarHBondContact CA-O 3.48Å; G75-G120 CarbonylContact O-C 3.36Å; G75-G120 VanDerWaalsContact O-CA 3.23Å; G75-G120 WeakPolarHBondContact O-CA 3.23Å; G75-S124 WeakPolarHBondContact CA-OG 3.12Å
76A98.3Very high96.2Very high42 Ų4254.3 Ų54.335%0.34729%0.287SS..Hα-helixtrans-65.3-38.7179.900000111.9M72 I73 I74 S79 S80 S124M72-A76 WeakPolarHBondContact O-CB 3.43Å; M72-A76 PolarHBondContact O-N 2.94Å; I73-A76 PolarHBondContact O-N 2.93Å; I74-A76 PolarHBondContact O-N 2.87Å; A76-S79 PolarHBondContact O-OG 3.27Å; A76-S79 VanDerWaalsContact O-OG 3.13Å; A76-S80 WeakPolarHBondContact O-CB 3.44Å; A76-S80 PolarHBondContact O-N 2.76Å; A76-S80 PolarHBondContact O-OG 3.49Å; A76-S124 PolarHBondContact N-OG 3.32Å
77L98.3Very high96.3Very high97 Ų9755.7 Ų55.751%0.50829%0.293SS..Hα-helixtrans-65.6-46.6174.7-74.3174000111.4I73 I74 G75 S79 S80 I81I73-L77 HydrophobicContact CG2-CD1 4.04Å; I73-L77 HydrophobicContact CG2-CG 4.44Å; I73-L77 WeakPolarHBondContact O-CB 3.34Å; I73-L77 WeakPolarHBondContact O-CG 3.28Å; I73-L77 PolarHBondContact O-N 3.01Å; I74-L77 PolarHBondContact O-N 3.49Å; G75-L77 VanDerWaalsContact C-N 3.35Å; G75-L77 PolarHBondContact O-N 2.68Å; L77-S79 PolarHBondContact O-N 2.87Å; L77-S80 PolarHBondContact O-N 2.89Å; L77-I81 HydrophobicContact CB-CD1 4.4Å; L77-I81 VanDerWaalsContact O-CB 3.22Å; L77-I81 WeakPolarHBondContact O-CB 3.44Å; L77-I81 WeakPolarHBondContact O-CD1 3.43Å; L77-I81 WeakPolarHBondContact O-CG1 3.35Å; L77-I81 PolarHBondContact O-N 3.37Å
78V97.5Very high96.4Very high39 Ų3960 Ų6024%0.23631%0.308CS..Hα-helixtrans-59.8-48.5179.51690000110.9I74 G75 T82 L116I74-V78 HydrophobicContact CG2-CG2 4.24Å; I74-V78 WeakPolarHBondContact O-CB 3.44Å; I74-V78 VanDerWaalsContact O-CG2 3.29Å; I74-V78 WeakPolarHBondContact O-CG2 3.33Å; I74-V78 PolarHBondContact O-N 3.18Å; G75-V78 PolarHBondContact O-N 3.38Å; V78-T82 WeakPolarHBondContact O-CB 3.47Å; V78-T82 PolarHBondContact O-N 3.33Å; V78-T82 PolarHBondContact O-OG1 3.42Å; V78-L116 HydrophobicContact CG1-CD1 4.03Å; V78-L116 HydrophobicContact CG1-CG 4.08Å
79S97.1Very high96.2Very high11 Ų1166.7 Ų66.78%0.07734%0.338CS..Hα-helixtrans-65.6-43.3179.461.70000111.8G75 A76 L77 T82 A83 F117G75-S79 PolarHBondContact O-N 3.39Å; G75-S79 PolarHBondContact O-OG 3.43Å; A76-S79 PolarHBondContact O-OG 3.27Å; A76-S79 VanDerWaalsContact O-OG 3.13Å; L77-S79 PolarHBondContact O-N 2.87Å; S79-T82 PolarHBondContact O-N 2.77Å; S79-A83 WeakPolarHBondContact O-CB 3.4Å; S79-A83 PolarHBondContact O-N 2.83Å; S79-F117 VanDerWaalsContact O-CD2 3.28Å; S79-F117 WeakPolarHBondContact O-CD2 3.33Å; S79-F117 WeakPolarHBondContact O-CE2 3.37Å
80S97Very high96.1Very high60 Ų6064.2 Ų64.242%0.4235%0.351SS..Hα-helixtrans-63.8-46.6178.5-59.10000112.2A76 L77 T82 A83 I84A76-S80 WeakPolarHBondContact O-CB 3.44Å; A76-S80 PolarHBondContact O-N 2.76Å; A76-S80 PolarHBondContact O-OG 3.49Å; L77-S80 PolarHBondContact O-N 2.89Å; S80-T82 VanDerWaalsContact C-N 3.35Å; S80-T82 PolarHBondContact O-N 2.91Å; S80-A83 PolarHBondContact O-N 3.13Å; S80-I84 WeakPolarHBondContact O-CD1 3.22Å; S80-I84 WeakPolarHBondContact O-CG1 3.2Å; S80-I84 PolarHBondContact O-N 3.06Å
81I96.5Very high95.9Very high88 Ų8865.1 Ų65.145%0.45135%0.351SS..Hα-helixtrans-61.4-46.6178.1-72167.4000109.8L77 A83 I84 I85L77-I81 HydrophobicContact CB-CD1 4.4Å; L77-I81 VanDerWaalsContact O-CB 3.22Å; L77-I81 WeakPolarHBondContact O-CB 3.44Å; L77-I81 WeakPolarHBondContact O-CD1 3.43Å; L77-I81 WeakPolarHBondContact O-CG1 3.35Å; L77-I81 PolarHBondContact O-N 3.37Å; I81-A83 PolarHBondContact O-N 3.08Å; I81-I84 PolarHBondContact O-N 3.35Å; I81-I84 VanDerWaalsContact O-N 3.15Å; I81-I85 HydrophobicContact CG2-CD1 3.43Å; I81-I85 VanDerWaalsContact CG2-CD1 3.43Å; I81-I85 HydrophobicContact CG2-CG1 3.9Å; I81-I85 WeakPolarHBondContact O-CB 3.44Å; I81-I85 VanDerWaalsContact O-CG1 3.23Å; I81-I85 WeakPolarHBondContact O-CG1 3.15Å; I81-I85 PolarHBondContact O-N 3.04Å
82T94.6Very high95.7Very high15 Ų1568.2 Ų68.29%0.09237%0.373CS..Hα-helixtrans-61.6-34.1179.4-500000111.8V78 S79 S80 P86 T113 L116 F117V78-T82 WeakPolarHBondContact O-CB 3.47Å; V78-T82 PolarHBondContact O-N 3.33Å; V78-T82 PolarHBondContact O-OG1 3.42Å; S79-T82 PolarHBondContact O-N 2.77Å; S80-T82 VanDerWaalsContact C-N 3.35Å; S80-T82 PolarHBondContact O-N 2.91Å; T82-P86 WeakPolarHBondContact O-CD 3.19Å; T82-T113 WeakPolarHBondContact CG2-O 3.09Å; T82-L116 HydrophobicContact CG2-CB 4.39Å; T82-L116 HydrophobicContact CG2-CD2 4.38Å; T82-F117 HydrophobicContact CG2-CB 4.04Å
83A95.2Very high95.5Very high3 Ų371.2 Ų71.23%0.02539%0.385CS..Hα-helixtrans-73.6-33.6176.500000113.8S79 S80 I81 F93 L94 F117S79-A83 WeakPolarHBondContact O-CB 3.4Å; S79-A83 PolarHBondContact O-N 2.83Å; S80-A83 PolarHBondContact O-N 3.13Å; I81-A83 PolarHBondContact O-N 3.08Å; A83-F93 HydrophobicContact CB-CD2 4.21Å; A83-F93 HydrophobicContact CB-CE1 4.49Å; A83-F93 HydrophobicContact CB-CE2 3.44Å; A83-F93 VanDerWaalsContact CB-CE2 3.44Å; A83-F93 HydrophobicContact CB-CZ 3.61Å; A83-F93 VanDerWaalsContact O-CD2 3.25Å; A83-F93 WeakPolarHBondContact O-CD2 3.44Å; A83-L94 HydrophobicContact CB-CD2 3.47Å; A83-L94 VanDerWaalsContact CB-CD2 3.47Å; A83-L94 HydrophobicContact CB-CG 3.97Å; A83-L94 PolarHBondContact O-N 3.1Å; A83-F117 HydrophobicContact CB-CD2 4.37Å; A83-F117 HydrophobicContact CB-CE2 4.11Å
84I96.1Very high95.3Very high73 Ų7370.2 Ų70.237%0.37438%0.38SS..Hα-helixtrans-88.1-36.2-175.2-63.8166.6000112.2S80 I81 P86 M87 F88 F93S80-I84 WeakPolarHBondContact O-CD1 3.22Å; S80-I84 WeakPolarHBondContact O-CG1 3.2Å; S80-I84 PolarHBondContact O-N 3.06Å; I81-I84 PolarHBondContact O-N 3.35Å; I81-I84 VanDerWaalsContact O-N 3.15Å; I84-P86 VanDerWaalsContact C-N 3.29Å; I84-P86 VanDerWaalsContact O-N 3.1Å; I84-M87 VanDerWaalsContact O-CB 3.29Å; I84-M87 WeakPolarHBondContact O-CB 3.17Å; I84-M87 PolarHBondContact O-N 3.1Å; I84-F88 HydrophobicContact CG2-CD2 4.38Å; I84-F88 HydrophobicContact CG2-CE2 3.71Å; I84-F88 HydrophobicContact CG2-CZ 4.47Å; I84-F93 HydrophobicContact CG1-CD2 4.39Å; I84-F93 HydrophobicContact CG1-CE2 3.95Å
85I94.4Very high95Very high81 Ų8167.8 Ų67.842%0.41537%0.37SS..G310 helixtrans-43.2-47-178.6-82.6171.1000113.5I81 M87 F88 F89I81-I85 HydrophobicContact CG2-CD1 3.43Å; I81-I85 VanDerWaalsContact CG2-CD1 3.43Å; I81-I85 HydrophobicContact CG2-CG1 3.9Å; I81-I85 WeakPolarHBondContact O-CB 3.44Å; I81-I85 VanDerWaalsContact O-CG1 3.23Å; I81-I85 WeakPolarHBondContact O-CG1 3.15Å; I81-I85 PolarHBondContact O-N 3.04Å; I85-M87 PolarHBondContact O-N 3.03Å; I85-M87 VanDerWaalsContact O-N 3.16Å; I85-F88 PolarHBondContact O-N 3.39Å; I85-F88 VanDerWaalsContact O-N 3.13Å; I85-F89 HydrophobicContact CG2-CD2 4.42Å; I85-F89 HydrophobicContact CG2-CE2 4.02Å; I85-F89 WeakPolarHBondContact O-CD2 3.5Å
86P93.8Very high94.5Very high3 Ų372 Ų722%0.01939%0.39CS..G310 helixtrans-60.2-27.9-178.2-2130.4000114.3T82 I84 F88 F89 K91 S95 Y97T82-P86 WeakPolarHBondContact O-CD 3.19Å; I84-P86 VanDerWaalsContact C-N 3.29Å; I84-P86 VanDerWaalsContact O-N 3.1Å; P86-F88 VanDerWaalsContact C-N 3.27Å; P86-F88 PolarHBondContact O-N 3.48Å; P86-F89 CarbonylContact O-C 3.58Å; P86-F89 PolarHBondContact O-N 3.38Å; P86-K91 HydrophobicContact CB-CB 3.94Å; P86-K91 WeakPolarHBondContact O-CB 3.22Å; P86-K91 PolarHBondContact O-N 2.82Å; P86-K91 VanDerWaalsContact O-N 3.08Å; P86-S95 WeakPolarHBondContact CG-O 3.32Å; P86-Y97 HydrophobicContact CB-CE2 4.35Å; P86-Y97 HydrophobicContact CG-CE2 4.49Å
87M94.2Very high93.8Very high102 Ų10274.8 Ų74.850%0.50239%0.393SS..G310 helixtrans-63.5-33.7178.6-63.9176.564.100112.2I84 I85 F89 G90 K91 F93I84-M87 VanDerWaalsContact O-CB 3.29Å; I84-M87 WeakPolarHBondContact O-CB 3.17Å; I84-M87 PolarHBondContact O-N 3.1Å; I85-M87 PolarHBondContact O-N 3.03Å; I85-M87 VanDerWaalsContact O-N 3.16Å; M87-F89 PolarHBondContact O-N 2.69Å; M87-G90 PolarHBondContact O-N 3.13Å; M87-G90 VanDerWaalsContact O-N 3.13Å; M87-K91 VanDerWaalsContact CA-O 3.3Å; M87-K91 WeakPolarHBondContact CA-O 3.34Å; M87-F93 HydrophobicContact CG-CB 4.22Å; M87-F93 HydrophobicContact SD-CB 3.82Å; M87-F93 HydrophobicContact SD-CD2 3.8Å; M87-F93 HydrophobicContact SD-CG 4.29Å
88F93.9Very high92.9Very high169 Ų16977.2 Ų77.274%0.74140%0.401SS*.G310 helixtrans-68-15.4175.7-67.1-76.4000113.2I84 I85 P86I84-F88 HydrophobicContact CG2-CD2 4.38Å; I84-F88 HydrophobicContact CG2-CE2 3.71Å; I84-F88 HydrophobicContact CG2-CZ 4.47Å; I85-F88 PolarHBondContact O-N 3.39Å; I85-F88 VanDerWaalsContact O-N 3.13Å; P86-F88 VanDerWaalsContact C-N 3.27Å; P86-F88 PolarHBondContact O-N 3.48Å
89F92.6Very high91.7Very high149 Ų14978.7 Ų78.765%0.65441%0.41SS*.G310 helixtrans-104.716.2175.8-60.5-83.5000112.6I85 P86 M87 K91I85-F89 HydrophobicContact CG2-CD2 4.42Å; I85-F89 HydrophobicContact CG2-CE2 4.02Å; I85-F89 WeakPolarHBondContact O-CD2 3.5Å; P86-F89 CarbonylContact O-C 3.58Å; P86-F89 PolarHBondContact O-N 3.38Å; M87-F89 PolarHBondContact O-N 2.69Å; F89-K91 VanDerWaalsContact C-N 3.27Å; F89-K91 PolarHBondContact O-N 3Å
90G92.5Very high90.3Very high72 Ų7281.5 Ų81.574%0.74243%0.427SS*.THydrogen-bonded Turntrans72.815.1179.200000114.4M87M87-G90 PolarHBondContact O-N 3.13Å; M87-G90 VanDerWaalsContact O-N 3.13Å
91K92.7Very high88.8Confident109 Ų10986 Ų8647%0.47444%0.435SS..PPolyproline II helixtrans-93.8154.6172.9-62.4-64.3-173.1175.40110.9P86 M87 F89 Y97P86-K91 HydrophobicContact CB-CB 3.94Å; P86-K91 WeakPolarHBondContact O-CB 3.22Å; P86-K91 PolarHBondContact O-N 2.82Å; P86-K91 VanDerWaalsContact O-N 3.08Å; M87-K91 VanDerWaalsContact CA-O 3.3Å; M87-K91 WeakPolarHBondContact CA-O 3.34Å; F89-K91 VanDerWaalsContact C-N 3.27Å; F89-K91 PolarHBondContact O-N 3Å; K91-Y97 WeakPolarHBondContact CG-OH 3.35Å
92P94Very high87.2Confident95 Ų9588 Ų8862%0.61745%0.445SS*.PPolyproline II helixtrans-55.8154171.7-25.133.8000113.1S95P92-S95 WeakPolarHBondContact CD-OG 3.41Å; P92-S95 VanDerWaalsContact O-CB 3.24Å; P92-S95 WeakPolarHBondContact O-CB 3.23Å; P92-S95 PolarHBondContact O-N 2.64Å; P92-S95 VanDerWaalsContact O-N 3.11Å; P92-S95 PolarHBondContact O-OG 2.99Å
93F93.4Very high85.8Confident112 Ų11290.8 Ų90.849%0.49146%0.459SS..THydrogen-bonded Turntrans-49.7143.1168.2178.7-108.4000111.1A83 I84 M87 S95A83-F93 HydrophobicContact CB-CD2 4.21Å; A83-F93 HydrophobicContact CB-CE1 4.49Å; A83-F93 HydrophobicContact CB-CE2 3.44Å; A83-F93 VanDerWaalsContact CB-CE2 3.44Å; A83-F93 HydrophobicContact CB-CZ 3.61Å; A83-F93 VanDerWaalsContact O-CD2 3.25Å; A83-F93 WeakPolarHBondContact O-CD2 3.44Å; I84-F93 HydrophobicContact CG1-CD2 4.39Å; I84-F93 HydrophobicContact CG1-CE2 3.95Å; M87-F93 HydrophobicContact CG-CB 4.22Å; M87-F93 HydrophobicContact SD-CB 3.82Å; M87-F93 HydrophobicContact SD-CD2 3.8Å; M87-F93 HydrophobicContact SD-CG 4.29Å; F93-S95 PolarHBondContact O-N 3.4Å
94L92.8Very high84.1Confident73 Ų7396.9 Ų96.938%0.38250%0.498SS..THydrogen-bonded Turntrans6114.7-175.5-70.6163.7000115.5A83 Q96 F117A83-L94 HydrophobicContact CB-CD2 3.47Å; A83-L94 VanDerWaalsContact CB-CD2 3.47Å; A83-L94 HydrophobicContact CB-CG 3.97Å; A83-L94 PolarHBondContact O-N 3.1Å; L94-Q96 PolarHBondContact O-N 3.39Å; L94-F117 HydrophobicContact CD2-CD2 4.1Å; L94-F117 HydrophobicContact CD2-CE2 3.66Å; L94-F117 HydrophobicContact CD2-CZ 3.95Å
95S92.2Very high83.1Confident30 Ų30101 Ų10121%0.2152%0.52CS..  trans-64.1132.5171.7-63.60000110.6P86 P92 F93P86-S95 WeakPolarHBondContact CG-O 3.32Å; P92-S95 WeakPolarHBondContact CD-OG 3.41Å; P92-S95 VanDerWaalsContact O-CB 3.24Å; P92-S95 WeakPolarHBondContact O-CB 3.23Å; P92-S95 PolarHBondContact O-N 2.64Å; P92-S95 VanDerWaalsContact O-N 3.11Å; P92-S95 PolarHBondContact O-OG 2.99Å; F93-S95 PolarHBondContact O-N 3.4Å
96Q87.1Confident81.4Confident88 Ų88103.5 Ų103.541%0.41153%0.533SS..  trans-109.8145-175.5-69.7164.7-4.400111.2L94 T113 I114L94-Q96 PolarHBondContact O-N 3.39Å; Q96-T113 VanDerWaalsContact CA-OG1 3.26Å; Q96-T113 WeakPolarHBondContact CA-OG1 3.36Å; Q96-I114 VanDerWaalsContact CD-CB 3.42Å; Q96-I114 HydrophobicContact CG-CB 4.22Å
97Y84Confident80.3Confident102 Ų102105 Ų10540%0.455%0.549SS..  trans-111134173.8-64.1-85.3000109P86 K91 S112 T113P86-Y97 HydrophobicContact CB-CE2 4.35Å; P86-Y97 HydrophobicContact CG-CE2 4.49Å; K91-Y97 WeakPolarHBondContact CG-OH 3.35Å; Y97-S112 WeakPolarHBondContact O-CA 3.49Å; Y97-S112 PolarHBondContact O-OG 3.07Å; Y97-T113 PolarHBondContact N-OG1 3.33Å; Y97-T113 PolarHBondContact O-N 3.22Å; Y97-T113 PolarHBondContact O-OG1 2.92Å
98E80.2Confident78.9Confident148 Ų148106.7 Ų106.769%0.69256%0.556SS**EExtended strand (participates in β ladder)trans-106.3132.3172.6-54-153.3147.700109.3
99T71.6Confident77.6Confident69 Ų69101.2 Ų101.242%0.42353%0.534SS..EExtended strand (participates in β ladder)trans-133.5128.7174.7-175.20000109.6W101 V111T99-W101 VanDerWaalsContact CG2-NE1 3.34Å; T99-W101 PolarHBondContact OG1-NE1 2.73Å; T99-V111 HydrophobicContact CG2-CB 4.39Å; T99-V111 WeakPolarHBondContact CG2-O 3.47Å; T99-V111 PolarHBondContact N-O 3.5Å; T99-V111 PolarHBondContact O-N 3.35Å
100T67.4Low76.4Confident70 Ų7099.8 Ų99.843%0.42953%0.529SS..EExtended strand (participates in β ladder)trans-90.6112.3175.4-43.20000108.2Q108T100-Q108 HydrophobicContact CG2-CB 3.99Å; T100-Q108 HydrophobicContact CG2-CG 4.33Å
101W65Low75.4Confident156 Ų15699.6 Ų99.659%0.59151%0.513SS*.EExtended strand (participates in β ladder)trans-97.4131174.2-77.550.9000109T99 I109T99-W101 VanDerWaalsContact CG2-NE1 3.34Å; T99-W101 PolarHBondContact OG1-NE1 2.73Å; W101-I109 PolarHBondContact N-O 3.01Å; W101-I109 PolarHBondContact O-N 3.18Å
102I62.8Low74.9Confident130 Ų13094.7 Ų94.767%0.66749%0.492SS*.EExtended strand (participates in β ladder)trans-93.899.5173.4-55.1174.1000106.8Q108I102-Q108 HydrophobicContact CG1-CG 4.21Å
103L65Low74.5Confident72 Ų7292.2 Ų92.238%0.37748%0.476SS..EExtended strand (participates in β ladder)trans-87.8136.9171.8-72.7-169.9000109.8I105 L106 G107 I109L103-I105 PolarHBondContact O-N 3.23Å; L103-L106 HydrophobicContact CB-CB 4.39Å; L103-L106 HydrophobicContact CD1-CD1 4.38Å; L103-L106 PolarHBondContact O-N 3.48Å; L103-G107 PolarHBondContact N-O 3.44Å; L103-G107 PolarHBondContact O-N 3.03Å; L103-I109 HydrophobicContact CB-CD1 3.83Å; L103-I109 HydrophobicContact CB-CG1 4.36Å; L103-I109 HydrophobicContact CD1-CD1 3.22Å; L103-I109 HydrophobicContact CD1-CG1 4.45Å; L103-I109 HydrophobicContact CG-CD1 3.52Å; L103-I109 HydrophobicContact CG-CG1 4.3Å
104P60.5Low74.4Confident131 Ų13189 Ų8985%0.85146%0.463SS*.THydrogen-bonded Turntrans-63.4-16.6-172.620.6-30000114.6
105I74.1Confident74.3Confident161 Ų16186.7 Ų86.783%0.82645%0.452SS*.THydrogen-bonded Turntrans-107.6-35.2-178-57.1168.5000112L103L103-I105 PolarHBondContact O-N 3.23Å
106L60.4Low74.4Confident133 Ų13389.3 Ų89.370%0.69646%0.463SS*.THydrogen-bonded Turntrans-103.7-5-170.5-71.3166.9000113.5L103 I109L103-L106 HydrophobicContact CB-CB 4.39Å; L103-L106 HydrophobicContact CD1-CD1 4.38Å; L103-L106 PolarHBondContact O-N 3.48Å; L106-I109 HydrophobicContact CB-CD1 3.89Å; L106-I109 HydrophobicContact CB-CG1 4.26Å; L106-I109 HydrophobicContact CD1-CD1 4.01Å
107G70.5Confident74.8Confident34 Ų3487.1 Ų87.135%0.35145%0.452SS..EExtended strand (participates in β ladder)trans75.9-150.4-176.400000112.6L103 I109L103-G107 PolarHBondContact N-O 3.44Å; L103-G107 PolarHBondContact O-N 3.03Å; G107-I109 PolarHBondContact O-N 3.31Å
108Q64Low75.3Confident138 Ų13884.7 Ų84.765%0.64545%0.445SS*.EExtended strand (participates in β ladder)trans-76.2108.6179.6-69.2-173.86.300110.6T100 I102T100-Q108 HydrophobicContact CG2-CB 3.99Å; T100-Q108 HydrophobicContact CG2-CG 4.33Å; I102-Q108 HydrophobicContact CG1-CG 4.21Å
109I66.5Low76.1Confident54 Ų5480.3 Ų80.328%0.27743%0.425SS..EExtended strand (participates in β ladder)trans-100.1119.7174.8-26.6-177.6000108W101 L103 L106 G107 V111W101-I109 PolarHBondContact N-O 3.01Å; W101-I109 PolarHBondContact O-N 3.18Å; L103-I109 HydrophobicContact CB-CD1 3.83Å; L103-I109 HydrophobicContact CB-CG1 4.36Å; L103-I109 HydrophobicContact CD1-CD1 3.22Å; L103-I109 HydrophobicContact CD1-CG1 4.45Å; L103-I109 HydrophobicContact CG-CD1 3.52Å; L103-I109 HydrophobicContact CG-CG1 4.3Å; L106-I109 HydrophobicContact CB-CD1 3.89Å; L106-I109 HydrophobicContact CB-CG1 4.26Å; L106-I109 HydrophobicContact CD1-CD1 4.01Å; G107-I109 PolarHBondContact O-N 3.31Å; I109-V111 HydrophobicContact CB-CG2 4.28Å; I109-V111 HydrophobicContact CG2-CG2 4.31Å; I109-V111 PolarHBondContact O-N 3.09Å
110H67.7Low77.3Confident119 Ų11977 Ų7755%0.55141%0.405SS*.EExtended strand (participates in β ladder)trans-80.1101.4171.3-73.558000107.4
111V70.6Confident78.8Confident67 Ų6775.6 Ų75.641%0.40640%0.395SS..EExtended strand (participates in β ladder)trans-100.6114.2175.5-173.50000106.5T99 I109T99-V111 HydrophobicContact CG2-CB 4.39Å; T99-V111 WeakPolarHBondContact CG2-O 3.47Å; T99-V111 PolarHBondContact N-O 3.5Å; T99-V111 PolarHBondContact O-N 3.35Å; I109-V111 HydrophobicContact CB-CG2 4.28Å; I109-V111 HydrophobicContact CG2-CG2 4.31Å; I109-V111 PolarHBondContact O-N 3.09Å
112S82.6Confident80.4Confident6 Ų668.8 Ų68.84%0.04237%0.37CS..EExtended strand (participates in β ladder)trans-110.9148.2177.1173.10000109.4Y97 I114 T115Y97-S112 WeakPolarHBondContact O-CA 3.49Å; Y97-S112 PolarHBondContact O-OG 3.07Å; S112-I114 PolarHBondContact O-N 2.84Å; S112-I114 VanDerWaalsContact O-N 3.12Å; S112-I114 VanDerWaalsContact OG-CG2 3.26Å; S112-I114 WeakPolarHBondContact OG-CG2 3.42Å; S112-I114 PolarHBondContact OG-N 2.84Å; S112-T115 PolarHBondContact N-OG1 3.41Å; S112-T115 WeakPolarHBondContact O-CB 3.46Å; S112-T115 PolarHBondContact O-N 2.97Å; S112-T115 PolarHBondContact O-OG1 3.31Å
113T87Confident82.1Confident44 Ų4465.7 Ų65.727%0.2735%0.352SS..Hα-helixtrans-61.4-19.4173.255.50000111.7T82 Q96 Y97 T115 L116 F117T82-T113 WeakPolarHBondContact CG2-O 3.09Å; Q96-T113 VanDerWaalsContact CA-OG1 3.26Å; Q96-T113 WeakPolarHBondContact CA-OG1 3.36Å; Y97-T113 PolarHBondContact N-OG1 3.33Å; Y97-T113 PolarHBondContact O-N 3.22Å; Y97-T113 PolarHBondContact O-OG1 2.92Å; T113-T115 VanDerWaalsContact C-N 3.28Å; T113-T115 PolarHBondContact O-N 3.19Å; T113-L116 PolarHBondContact O-N 2.93Å; T113-F117 PolarHBondContact O-N 3.02Å
114I90.9Very high83.7Confident44 Ų4463.3 Ų63.323%0.22634%0.341CS..Hα-helixtrans-62.1-36.1170.2-164.3169.6000111.8H31 Q96 S112 L116 F117 E118H31-I114 WeakPolarHBondContact CE1-CG2 3.45Å; H31-I114 WeakPolarHBondContact ND1-CG2 3.41Å; Q96-I114 VanDerWaalsContact CD-CB 3.42Å; Q96-I114 HydrophobicContact CG-CB 4.22Å; S112-I114 PolarHBondContact O-N 2.84Å; S112-I114 VanDerWaalsContact O-N 3.12Å; S112-I114 VanDerWaalsContact OG-CG2 3.26Å; S112-I114 WeakPolarHBondContact OG-CG2 3.42Å; S112-I114 PolarHBondContact OG-N 2.84Å; I114-L116 VanDerWaalsContact C-N 3.26Å; I114-L116 PolarHBondContact O-N 3.28Å; I114-F117 WeakPolarHBondContact O-CB 3.25Å; I114-F117 PolarHBondContact O-N 3.32Å; I114-E118 HydrophobicContact CG1-CG 4.18Å; I114-E118 WeakPolarHBondContact O-CB 3.1Å; I114-E118 VanDerWaalsContact O-CG 3.3Å; I114-E118 WeakPolarHBondContact O-CG 3.38Å; I114-E118 PolarHBondContact O-N 2.98Å
115T91.2Very high85.5Confident24 Ų2457.8 Ų57.815%0.14731%0.305CS..Hα-helixtrans-64-37.4179.2-23.50000110.7F27 H31 S112 T113 L119F27-T115 HydrophobicContact CE1-CG2 4.45Å; F27-T115 HydrophobicContact CZ-CG2 4.25Å; H31-T115 PolarHBondContact CE1-OG1 3.37Å; H31-T115 WeakPolarHBondContact NE2-CG2 3.39Å; H31-T115 PolarHBondContact NE2-OG1 3.24Å; S112-T115 PolarHBondContact N-OG1 3.41Å; S112-T115 WeakPolarHBondContact O-CB 3.46Å; S112-T115 PolarHBondContact O-N 2.97Å; S112-T115 PolarHBondContact O-OG1 3.31Å; T113-T115 VanDerWaalsContact C-N 3.28Å; T113-T115 PolarHBondContact O-N 3.19Å; T115-L119 WeakPolarHBondContact O-CB 3.47Å; T115-L119 PolarHBondContact O-N 2.88Å
116L92.9Very high86.6Confident86 Ų8650.4 Ų50.445%0.4527%0.267SS..Hα-helixtrans-69.9-40.5175.3-173.765.1000111.9V78 T82 T113 I114 L119 G120V78-L116 HydrophobicContact CG1-CD1 4.03Å; V78-L116 HydrophobicContact CG1-CG 4.08Å; T82-L116 HydrophobicContact CG2-CB 4.39Å; T82-L116 HydrophobicContact CG2-CD2 4.38Å; T113-L116 PolarHBondContact O-N 2.93Å; I114-L116 VanDerWaalsContact C-N 3.26Å; I114-L116 PolarHBondContact O-N 3.28Å; L116-L119 HydrophobicContact CD1-CD2 4.48Å; L116-L119 WeakPolarHBondContact O-CB 3.47Å; L116-L119 PolarHBondContact O-N 2.82Å; L116-G120 PolarHBondContact O-N 3.29Å; L116-G120 VanDerWaalsContact O-N 3.09Å
117F95.2Very high88.4Confident41 Ų4144 Ų4418%0.1823%0.234CC..Hα-helixtrans-59.4-50.5173.9178.5-95000111.2S79 T82 A83 L94 T113 I114 L119 G120 I121S79-F117 VanDerWaalsContact O-CD2 3.28Å; S79-F117 WeakPolarHBondContact O-CD2 3.33Å; S79-F117 WeakPolarHBondContact O-CE2 3.37Å; T82-F117 HydrophobicContact CG2-CB 4.04Å; A83-F117 HydrophobicContact CB-CD2 4.37Å; A83-F117 HydrophobicContact CB-CE2 4.11Å; L94-F117 HydrophobicContact CD2-CD2 4.1Å; L94-F117 HydrophobicContact CD2-CE2 3.66Å; L94-F117 HydrophobicContact CD2-CZ 3.95Å; T113-F117 PolarHBondContact O-N 3.02Å; I114-F117 WeakPolarHBondContact O-CB 3.25Å; I114-F117 PolarHBondContact O-N 3.32Å; F117-L119 VanDerWaalsContact C-N 3.3Å; F117-L119 PolarHBondContact O-N 3.01Å; F117-G120 WeakPolarHBondContact O-CA 3.44Å; F117-G120 PolarHBondContact O-N 3.4Å; F117-G120 VanDerWaalsContact O-N 3.1Å; F117-I121 HydrophobicContact CD1-CG1 4.3Å; F117-I121 HydrophobicContact CE1-CD1 4.3Å; F117-I121 HydrophobicContact CE1-CG1 3.91Å; F117-I121 HydrophobicContact CZ-CD1 4.18Å; F117-I121 HydrophobicContact CZ-CG1 4.28Å; F117-I121 PolarHBondContact O-N 3.34Å
118E95.9Very high89.7Confident52 Ų5245.4 Ų45.424%0.24324%0.235CC..Hα-helixtrans-62.5-34.8177.4-70.3-64.9135.200112.1F27 G37 I114 G120 I121 L122F27-E118 HydrophobicContact CE2-CB 3.87Å; G37-E118 WeakPolarHBondContact CA-O 3.14Å; G37-E118 WeakPolarHBondContact CA-OE2 3.3Å; G37-E118 PolarHBondContact N-OE2 3.49Å; I114-E118 HydrophobicContact CG1-CG 4.18Å; I114-E118 WeakPolarHBondContact O-CB 3.1Å; I114-E118 VanDerWaalsContact O-CG 3.3Å; I114-E118 WeakPolarHBondContact O-CG 3.38Å; I114-E118 PolarHBondContact O-N 2.98Å; E118-G120 VanDerWaalsContact C-N 3.33Å; E118-G120 PolarHBondContact O-N 2.83Å; E118-I121 PolarHBondContact O-N 3.13Å; E118-L122 WeakPolarHBondContact O-CB 3.41Å; E118-L122 PolarHBondContact O-N 2.92Å
119L96.3Very high91.3Very high55 Ų5541.7 Ų41.729%0.28822%0.219SC..Hα-helixtrans-62.9-41.3173.9-172.767.1000111.3F27 T115 L116 F117 I121 L122 F123F27-L119 HydrophobicContact CE1-CD1 4.27Å; F27-L119 HydrophobicContact CE2-CB 4.37Å; F27-L119 HydrophobicContact CE2-CD1 4.48Å; F27-L119 HydrophobicContact CZ-CB 3.92Å; F27-L119 HydrophobicContact CZ-CD1 3.89Å; T115-L119 WeakPolarHBondContact O-CB 3.47Å; T115-L119 PolarHBondContact O-N 2.88Å; L116-L119 HydrophobicContact CD1-CD2 4.48Å; L116-L119 WeakPolarHBondContact O-CB 3.47Å; L116-L119 PolarHBondContact O-N 2.82Å; F117-L119 VanDerWaalsContact C-N 3.3Å; F117-L119 PolarHBondContact O-N 3.01Å; L119-I121 VanDerWaalsContact C-N 3.34Å; L119-L122 WeakPolarHBondContact O-CB 3.33Å; L119-L122 PolarHBondContact O-N 3.2Å; L119-F123 HydrophobicContact CD1-CE1 3.98Å; L119-F123 HydrophobicContact CD1-CE2 4.42Å; L119-F123 HydrophobicContact CD1-CZ 3.87Å; L119-F123 HydrophobicContact CD2-CE2 4.33Å; L119-F123 HydrophobicContact CD2-CZ 4.34Å; L119-F123 HydrophobicContact CG-CE1 4.45Å; L119-F123 HydrophobicContact CG-CE2 4.06Å; L119-F123 HydrophobicContact CG-CZ 4Å; L119-F123 PolarHBondContact O-N 3.02Å
120G97.8Very high92.7Very high0 Ų039.1 Ų39.10%021%0.206CC..Hα-helixtrans-60.6-42.6172.800000112.4G75 L116 F117 E118 F123 S124G75-G120 CarbonylContact C-O 3.24Å; G75-G120 VanDerWaalsContact C-O 3.24Å; G75-G120 WeakPolarHBondContact CA-O 3.48Å; G75-G120 CarbonylContact O-C 3.36Å; G75-G120 VanDerWaalsContact O-CA 3.23Å; G75-G120 WeakPolarHBondContact O-CA 3.23Å; L116-G120 PolarHBondContact O-N 3.29Å; L116-G120 VanDerWaalsContact O-N 3.09Å; F117-G120 WeakPolarHBondContact O-CA 3.44Å; F117-G120 PolarHBondContact O-N 3.4Å; F117-G120 VanDerWaalsContact O-N 3.1Å; E118-G120 VanDerWaalsContact C-N 3.33Å; E118-G120 PolarHBondContact O-N 2.83Å; G120-F123 PolarHBondContact O-N 3.16Å; G120-S124 WeakPolarHBondContact O-CB 3.37Å; G120-S124 PolarHBondContact O-N 3Å; G120-S124 PolarHBondContact O-OG 3.48Å
121I98Very high94.1Very high41 Ų4134.1 Ų34.121%0.2118%0.184CC..Hα-helixtrans-62.4-44.2173.9-60.6-58.9000111.1F38 F117 E118 L119 F123 S124 V125F38-I121 HydrophobicContact CB-CG2 4.25Å; F38-I121 HydrophobicContact CD2-CG2 4.41Å; F117-I121 HydrophobicContact CD1-CG1 4.3Å; F117-I121 HydrophobicContact CE1-CD1 4.3Å; F117-I121 HydrophobicContact CE1-CG1 3.91Å; F117-I121 HydrophobicContact CZ-CD1 4.18Å; F117-I121 HydrophobicContact CZ-CG1 4.28Å; F117-I121 PolarHBondContact O-N 3.34Å; E118-I121 PolarHBondContact O-N 3.13Å; L119-I121 VanDerWaalsContact C-N 3.34Å; I121-F123 PolarHBondContact O-N 2.88Å; I121-S124 WeakPolarHBondContact O-CB 3.45Å; I121-S124 PolarHBondContact O-N 3.28Å; I121-V125 HydrophobicContact CG2-CG2 4.19Å; I121-V125 VanDerWaalsContact O-CG2 3.32Å; I121-V125 WeakPolarHBondContact O-CG2 3.29Å; I121-V125 PolarHBondContact O-N 3Å
122L98.2Very high95.2Very high13 Ų1334.6 Ų34.67%0.06819%0.187CC..Hα-helixtrans-57.3-49.7178-174.5153000111.5F27 G37 F44 E118 L119 S124 V125 V126F27-L122 HydrophobicContact CB-CD1 4.02Å; F27-L122 HydrophobicContact CD2-CD1 3.52Å; F27-L122 HydrophobicContact CE2-CD1 4.11Å; F27-L122 HydrophobicContact CG-CD1 3.77Å; G37-L122 WeakPolarHBondContact O-CA 3.21Å; F44-L122 HydrophobicContact CD2-CD1 3.99Å; F44-L122 HydrophobicContact CD2-CD2 4.22Å; F44-L122 HydrophobicContact CD2-CG 4.3Å; F44-L122 HydrophobicContact CE2-CD1 3.9Å; E118-L122 WeakPolarHBondContact O-CB 3.41Å; E118-L122 PolarHBondContact O-N 2.92Å; L119-L122 WeakPolarHBondContact O-CB 3.33Å; L119-L122 PolarHBondContact O-N 3.2Å; L122-S124 VanDerWaalsContact C-N 3.33Å; L122-S124 PolarHBondContact O-N 3.23Å; L122-V125 PolarHBondContact O-N 3.4Å; L122-V126 HydrophobicContact CD2-CG2 4.17Å; L122-V126 WeakPolarHBondContact O-CG2 3.36Å; L122-V126 PolarHBondContact O-N 3.5Å
123F98.4Very high95.8Very high65 Ų6536.6 Ų36.629%0.28520%0.196SC..Hα-helixtrans-63.4-38.9177.1-69-12.8000112.5L71 L119 G120 I121 G127L71-F123 HydrophobicContact CD1-CB 4.05Å; L71-F123 HydrophobicContact CD1-CD1 4.11Å; L71-F123 HydrophobicContact CD1-CD2 4.25Å; L71-F123 HydrophobicContact CD1-CG 3.89Å; L71-F123 HydrophobicContact CG-CB 4.14Å; L71-F123 HydrophobicContact CG-CG 4.46Å; L119-F123 HydrophobicContact CD1-CE1 3.98Å; L119-F123 HydrophobicContact CD1-CE2 4.42Å; L119-F123 HydrophobicContact CD1-CZ 3.87Å; L119-F123 HydrophobicContact CD2-CE2 4.33Å; L119-F123 HydrophobicContact CD2-CZ 4.34Å; L119-F123 HydrophobicContact CG-CE1 4.45Å; L119-F123 HydrophobicContact CG-CE2 4.06Å; L119-F123 HydrophobicContact CG-CZ 4Å; L119-F123 PolarHBondContact O-N 3.02Å; G120-F123 PolarHBondContact O-N 3.16Å; I121-F123 PolarHBondContact O-N 2.88Å; F123-G127 PolarHBondContact O-N 3.15Å
124S98.5Very high96Very high21 Ų2135.3 Ų35.315%0.14719%0.187CC..Hα-helixtrans-60.1-48.7175.1-55.70000111.3G75 A76 G120 I121 L122 G127 V128G75-S124 WeakPolarHBondContact CA-OG 3.12Å; A76-S124 PolarHBondContact N-OG 3.32Å; G120-S124 WeakPolarHBondContact O-CB 3.37Å; G120-S124 PolarHBondContact O-N 3Å; G120-S124 PolarHBondContact O-OG 3.48Å; I121-S124 WeakPolarHBondContact O-CB 3.45Å; I121-S124 PolarHBondContact O-N 3.28Å; L122-S124 VanDerWaalsContact C-N 3.33Å; L122-S124 PolarHBondContact O-N 3.23Å; S124-G127 PolarHBondContact O-N 2.92Å; S124-V128 WeakPolarHBondContact O-CB 3.45Å; S124-V128 VanDerWaalsContact O-CG2 3.22Å; S124-V128 WeakPolarHBondContact O-CG2 3.32Å; S124-V128 PolarHBondContact O-N 3.31Å
125V98.5Very high96Very high15 Ų1536.4 Ų36.49%0.09120%0.199CC..Hα-helixtrans-64.6-49-178.9172.10000110.9F38 L42 I121 L122 G127 V128 I129F38-V125 HydrophobicContact CD2-CG2 3.59Å; F38-V125 HydrophobicContact CE2-CG2 3.9Å; F38-V125 HydrophobicContact CG-CG2 4.36Å; L42-V125 HydrophobicContact CD2-CG1 3.86Å; L42-V125 HydrophobicContact CG-CG1 4.13Å; I121-V125 HydrophobicContact CG2-CG2 4.19Å; I121-V125 VanDerWaalsContact O-CG2 3.32Å; I121-V125 WeakPolarHBondContact O-CG2 3.29Å; I121-V125 PolarHBondContact O-N 3Å; L122-V125 PolarHBondContact O-N 3.4Å; V125-G127 VanDerWaalsContact C-N 3.34Å; V125-G127 PolarHBondContact O-N 3.46Å; V125-V128 PolarHBondContact O-N 3.12Å; V125-I129 HydrophobicContact CG1-CG1 4.21Å; V125-I129 WeakPolarHBondContact O-CB 3.28Å; V125-I129 VanDerWaalsContact O-CG1 3.28Å; V125-I129 WeakPolarHBondContact O-CG1 3.26Å; V125-I129 PolarHBondContact O-N 2.89Å
126V98.3Very high96Very high6 Ų642 Ų424%0.03623%0.227CC..Hα-helixtrans-59.5-47.7177.7174.50000110.8G41 F44 S45 F48 F68 L71 L122 V128 V130G41-V126 WeakPolarHBondContact O-CG2 3.41Å; F44-V126 HydrophobicContact CB-CG2 3.65Å; S45-V126 WeakPolarHBondContact OG-CA 3.45Å; F48-V126 HydrophobicContact CD2-CG1 4.18Å; F48-V126 HydrophobicContact CE2-CG1 3.9Å; F68-V126 HydrophobicContact CD1-CG1 4.14Å; F68-V126 HydrophobicContact CE1-CG1 3.96Å; L71-V126 HydrophobicContact CD2-CB 4.32Å; L71-V126 HydrophobicContact CD2-CG1 3.94Å; L122-V126 HydrophobicContact CD2-CG2 4.17Å; L122-V126 WeakPolarHBondContact O-CG2 3.36Å; L122-V126 PolarHBondContact O-N 3.5Å; V126-V128 PolarHBondContact O-N 2.84Å; V126-V130 HydrophobicContact CG1-CG2 4.36Å; V126-V130 WeakPolarHBondContact O-CB 3.26Å; V126-V130 WeakPolarHBondContact O-CG2 3.3Å; V126-V130 PolarHBondContact O-N 2.95Å
127G97.7Very high95.5Very high0 Ų040.6 Ų40.60%023%0.225CC..Hα-helixtrans-59-48.2178.700000112.5F68 F123 S124 V125 T131F68-G127 CarbonylContact O-C 3.46Å; F68-G127 WeakPolarHBondContact O-CA 3.39Å; F123-G127 PolarHBondContact O-N 3.15Å; S124-G127 PolarHBondContact O-N 2.92Å; V125-G127 VanDerWaalsContact C-N 3.34Å; V125-G127 PolarHBondContact O-N 3.46Å; G127-T131 WeakPolarHBondContact O-CB 3.12Å; G127-T131 PolarHBondContact O-N 2.93Å; G127-T131 PolarHBondContact O-OG1 2.99Å
128V98Very high94.5Very high62 Ų6241.8 Ų41.838%0.37625%0.249SC..Hα-helixtrans-63.8-53.6179.4169.60000111.4M72 S124 V125 V126 V130 T131 V132M72-V128 HydrophobicContact CB-CG2 4.25Å; M72-V128 HydrophobicContact CG-CG2 4.33Å; M72-V128 HydrophobicContact SD-CG2 3.58Å; M72-V128 VanDerWaalsContact SD-CG2 3.58Å; S124-V128 WeakPolarHBondContact O-CB 3.45Å; S124-V128 VanDerWaalsContact O-CG2 3.22Å; S124-V128 WeakPolarHBondContact O-CG2 3.32Å; S124-V128 PolarHBondContact O-N 3.31Å; V125-V128 PolarHBondContact O-N 3.12Å; V126-V128 PolarHBondContact O-N 2.84Å; V128-V130 PolarHBondContact O-N 2.71Å; V128-T131 PolarHBondContact O-N 3.44Å; V128-V132 HydrophobicContact CG1-CG2 4.29Å; V128-V132 WeakPolarHBondContact O-CB 3.45Å; V128-V132 VanDerWaalsContact O-CG2 3.27Å; V128-V132 WeakPolarHBondContact O-CG2 3.24Å; V128-V132 PolarHBondContact O-N 3.2Å
129I97.6Very high92.7Very high60 Ų6040.2 Ų40.231%0.30825%0.246SC..Hα-helixtrans-64.2-44.1-172.7-64.9-66.9000110.9L42 I49 V125 V132 M133L42-I129 HydrophobicContact CD2-CD1 4.4Å; L42-I129 HydrophobicContact CD2-CG1 4.25Å; I49-I129 HydrophobicContact CD1-CG2 3.83Å; V125-I129 HydrophobicContact CG1-CG1 4.21Å; V125-I129 WeakPolarHBondContact O-CB 3.28Å; V125-I129 VanDerWaalsContact O-CG1 3.28Å; V125-I129 WeakPolarHBondContact O-CG1 3.26Å; V125-I129 PolarHBondContact O-N 2.89Å; I129-V132 PolarHBondContact O-N 2.91Å; I129-M133 WeakPolarHBondContact O-CB 3.3Å; I129-M133 PolarHBondContact O-N 3.02Å
130V96.2Very high90.6Very high0 Ų049.5 Ų49.50%028%0.278CS..Hα-helixtrans-66.8-43.8178174.50000110.8F48 F52 F68 V126 V128 V132 M133 L134F48-V130 HydrophobicContact CB-CG2 3.92Å; F48-V130 HydrophobicContact CD2-CG2 4.07Å; F48-V130 HydrophobicContact CG-CG2 4.23Å; F52-V130 HydrophobicContact CE2-CG1 3.8Å; F52-V130 HydrophobicContact CZ-CG1 4.04Å; F68-V130 HydrophobicContact CB-CB 4.23Å; F68-V130 HydrophobicContact CB-CG1 4.08Å; F68-V130 HydrophobicContact CD1-CB 3.57Å; F68-V130 HydrophobicContact CD1-CG1 3.59Å; F68-V130 HydrophobicContact CD1-CG2 3.92Å; F68-V130 HydrophobicContact CD2-CB 4.31Å; F68-V130 HydrophobicContact CD2-CG1 3.43Å; F68-V130 VanDerWaalsContact CD2-CG1 3.43Å; F68-V130 HydrophobicContact CE1-CB 3.93Å; F68-V130 HydrophobicContact CE1-CG1 3.79Å; F68-V130 HydrophobicContact CE1-CG2 3.82Å; F68-V130 HydrophobicContact CE2-CG1 3.64Å; F68-V130 HydrophobicContact CG-CB 3.78Å; F68-V130 HydrophobicContact CG-CG1 3.4Å; F68-V130 VanDerWaalsContact CG-CG1 3.4Å; F68-V130 HydrophobicContact CZ-CB 4.44Å; F68-V130 HydrophobicContact CZ-CG1 3.81Å; F68-V130 HydrophobicContact CZ-CG2 4.39Å; V126-V130 HydrophobicContact CG1-CG2 4.36Å; V126-V130 WeakPolarHBondContact O-CB 3.26Å; V126-V130 WeakPolarHBondContact O-CG2 3.3Å; V126-V130 PolarHBondContact O-N 2.95Å; V128-V130 PolarHBondContact O-N 2.71Å; V130-V132 VanDerWaalsContact C-N 3.33Å; V130-V132 PolarHBondContact O-N 3.24Å; V130-M133 PolarHBondContact O-N 2.89Å; V130-L134 HydrophobicContact CG1-CD1 3.91Å; V130-L134 HydrophobicContact CG1-CG 4.21Å; V130-L134 VanDerWaalsContact O-CG 3.31Å; V130-L134 WeakPolarHBondContact O-CG 3.25Å; V130-L134 PolarHBondContact O-N 3.43Å
131T95.4Very high88.2Confident15 Ų1554.2 Ų54.29%0.09231%0.31CS..Hα-helixtrans-60.4-42.3177.3-590000112M72 G127 V128 L134 S135M72-T131 HydrophobicContact CE-CG2 4.19Å; G127-T131 WeakPolarHBondContact O-CB 3.12Å; G127-T131 PolarHBondContact O-N 2.93Å; G127-T131 PolarHBondContact O-OG1 2.99Å; V128-T131 PolarHBondContact O-N 3.44Å; T131-L134 PolarHBondContact O-N 3.06Å; T131-S135 WeakPolarHBondContact O-CB 3.44Å; T131-S135 PolarHBondContact O-N 2.89Å; T131-S135 PolarHBondContact O-OG 3.37Å
132V95.6Very high87.7Confident77 Ų7754.9 Ų54.947%0.46732%0.315SS..Hα-helixtrans-63.1-46.3176.1168.80000110.4V128 I129 V130 L134 S135 L136V128-V132 HydrophobicContact CG1-CG2 4.29Å; V128-V132 WeakPolarHBondContact O-CB 3.45Å; V128-V132 VanDerWaalsContact O-CG2 3.27Å; V128-V132 WeakPolarHBondContact O-CG2 3.24Å; V128-V132 PolarHBondContact O-N 3.2Å; I129-V132 PolarHBondContact O-N 2.91Å; V130-V132 VanDerWaalsContact C-N 3.33Å; V130-V132 PolarHBondContact O-N 3.24Å; V132-L134 PolarHBondContact O-N 2.96Å; V132-S135 WeakPolarHBondContact O-CB 3.36Å; V132-S135 PolarHBondContact O-N 3.11Å; V132-L136 HydrophobicContact CG1-CD1 3.97Å; V132-L136 HydrophobicContact CG1-CG 4.41Å; V132-L136 WeakPolarHBondContact O-CG 2.94Å; V132-L136 PolarHBondContact O-N 3.22Å
133M93.9Very high87.2Confident48 Ų4857.1 Ų57.124%0.23633%0.328CS..Hα-helixtrans-60.2-46.2177.9174.448.2-165.800111.9I49 F52 I129 V130 S135 L136 S137I49-M133 HydrophobicContact CG1-CB 4.43Å; I49-M133 HydrophobicContact CG1-CG 4.22Å; F52-M133 HydrophobicContact CD2-CG 4.43Å; I129-M133 WeakPolarHBondContact O-CB 3.3Å; I129-M133 PolarHBondContact O-N 3.02Å; V130-M133 PolarHBondContact O-N 2.89Å; M133-S135 VanDerWaalsContact C-N 3.31Å; M133-S135 PolarHBondContact O-N 3.13Å; M133-L136 PolarHBondContact O-N 3.02Å; M133-L136 VanDerWaalsContact O-N 3.17Å; M133-S137 WeakPolarHBondContact O-CB 3.33Å; M133-S137 PolarHBondContact O-N 3.37Å; M133-S137 PolarHBondContact O-OG 3.11Å
134L92Very high86.6Confident16 Ų1656.6 Ų56.68%0.08433%0.331CS..Hα-helixtrans-59.8-43.8177.5-68174.3000111.4F52 V57 L61 F68 V130 T131 V132 L136 S137 G138 G139F52-L134 HydrophobicContact CE1-CD2 4.47Å; F52-L134 HydrophobicContact CE2-CD2 4.22Å; F52-L134 HydrophobicContact CZ-CD2 4.16Å; V57-L134 HydrophobicContact CG1-CD2 3.47Å; V57-L134 VanDerWaalsContact CG1-CD2 3.47Å; L61-L134 HydrophobicContact CD1-CD1 4.15Å; L61-L134 HydrophobicContact CD1-CD2 4.01Å; L61-L134 HydrophobicContact CD2-CD1 4.16Å; F68-L134 HydrophobicContact CD2-CD1 4.47Å; V130-L134 HydrophobicContact CG1-CD1 3.91Å; V130-L134 HydrophobicContact CG1-CG 4.21Å; V130-L134 VanDerWaalsContact O-CG 3.31Å; V130-L134 WeakPolarHBondContact O-CG 3.25Å; V130-L134 PolarHBondContact O-N 3.43Å; T131-L134 PolarHBondContact O-N 3.06Å; V132-L134 PolarHBondContact O-N 2.96Å; L134-L136 VanDerWaalsContact C-N 3.31Å; L134-L136 PolarHBondContact O-N 3.28Å; L134-S137 WeakPolarHBondContact CA-OG 3.44Å; L134-S137 PolarHBondContact O-N 2.66Å; L134-S137 PolarHBondContact O-OG 3.32Å; L134-G138 PolarHBondContact O-N 2.9Å; L134-G139 PolarHBondContact O-N 3Å
135S91.5Very high85.9Confident68 Ų6858.7 Ų58.748%0.47634%0.341SS..Hα-helixtrans-61.4-37.5176.9-56.70000112.6T131 V132 M133T131-S135 WeakPolarHBondContact O-CB 3.44Å; T131-S135 PolarHBondContact O-N 2.89Å; T131-S135 PolarHBondContact O-OG 3.37Å; V132-S135 WeakPolarHBondContact O-CB 3.36Å; V132-S135 PolarHBondContact O-N 3.11Å; M133-S135 VanDerWaalsContact C-N 3.31Å; M133-S135 PolarHBondContact O-N 3.13Å
136L90.3Very high85.1Confident141 Ų14161.4 Ų61.474%0.73836%0.357SS*.Hα-helixtrans-74.2-33.1176.8-69.5173.7000112.7V132 M133 L134 G138V132-L136 HydrophobicContact CG1-CD1 3.97Å; V132-L136 HydrophobicContact CG1-CG 4.41Å; V132-L136 WeakPolarHBondContact O-CG 2.94Å; V132-L136 PolarHBondContact O-N 3.22Å; M133-L136 PolarHBondContact O-N 3.02Å; M133-L136 VanDerWaalsContact O-N 3.17Å; L134-L136 VanDerWaalsContact C-N 3.31Å; L134-L136 PolarHBondContact O-N 3.28Å; L136-G138 PolarHBondContact O-N 3.08Å
137S83.2Confident84.2Confident56 Ų5665.1 Ų65.139%0.39238%0.378SS..THydrogen-bonded Turntrans-73-5.2-179.472.20000114.2M133 L134 G139M133-S137 WeakPolarHBondContact O-CB 3.33Å; M133-S137 PolarHBondContact O-N 3.37Å; M133-S137 PolarHBondContact O-OG 3.11Å; L134-S137 WeakPolarHBondContact CA-OG 3.44Å; L134-S137 PolarHBondContact O-N 2.66Å; L134-S137 PolarHBondContact O-OG 3.32Å; S137-G139 PolarHBondContact O-N 3.38Å
138G72.9Confident83.2Confident67 Ų6769.8 Ų69.869%0.69141%0.405SS*.THydrogen-bonded Turntrans80.72.6-175.400000114L134 L136L134-G138 PolarHBondContact O-N 2.9Å; L136-G138 PolarHBondContact O-N 3.08Å
139G58.6Low82.1Confident18 Ų1870.4 Ų70.419%0.18641%0.408CS..  trans-70.5127.3174.100000110.9L134 S137 S141L134-G139 PolarHBondContact O-N 3Å; S137-G139 PolarHBondContact O-N 3.38Å; G139-S141 PolarHBondContact O-N 3.2Å
140R51.3Low80.8Confident251 Ų25171.3 Ų71.395%0.94742%0.416SS*.  trans-63.1112175.5-61.3176.685.4156.24.4107.9
141S48.5Very low79.4Confident98 Ų9877.7 Ų77.769%0.68545%0.454SS*.  trans-67.30163.3169.30000111.3R69 G139R69-S141 VanDerWaalsContact CZ-OG 3.31Å; R69-S141 PolarHBondContact NE-OG 3.49Å; R69-S141 PolarHBondContact NH2-OG 3.36Å; G139-S141 PolarHBondContact O-N 3.2Å

Retrieved 141 of 141 residues in 319.4 ms (Link to these results)

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