A0A3Q0KNF3_SCHMA Loading...

Tetraspanin

AlphaFold DB , UniProt , Accession A0A3Q0KNF3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 246 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M58.9Low82.3Confident181 Ų18197.5 Ų97.589%0.89245%0.45SS*.  0-420-155.816897.400113.9N4M1-N4 PolarHBondContact O-N 3.23Å
2L69.7Low83.2Confident130 Ų13095.6 Ų95.668%0.68144%0.444SS*.Hα-helixtrans-62.3-39.9180-74.7164.9000114.2N4 K5 W6L2-N4 VanDerWaalsContact C-N 3.3Å; L2-N4 PolarHBondContact O-N 3.5Å; L2-K5 WeakPolarHBondContact O-CB 3.27Å; L2-K5 PolarHBondContact O-N 3.13Å; L2-W6 PolarHBondContact O-N 3.04Å
3W71Confident84Confident155 Ų15594 Ų9459%0.58745%0.445SS*.Hα-helixtrans-55.4-42.3178.2-175.865.4000112.7K5 W6 I7W3-K5 VanDerWaalsContact C-N 3.29Å; W3-K5 PolarHBondContact O-N 3.42Å; W3-W6 PolarHBondContact O-N 2.94Å; W3-I7 HydrophobicContact CD2-CD1 3.76Å; W3-I7 VanDerWaalsContact CE2-CD1 3.48Å; W3-I7 HydrophobicContact CE3-CD1 4.06Å; W3-I7 HydrophobicContact CG-CD1 4.39Å; W3-I7 HydrophobicContact CH2-CD1 3.87Å; W3-I7 HydrophobicContact CZ2-CD1 3.55Å; W3-I7 HydrophobicContact CZ3-CD1 4.11Å; W3-I7 PolarHBondContact O-N 3.17Å
4N79.1Confident84.9Confident62 Ų6287.8 Ų87.833%0.33242%0.416SS..Hα-helixtrans-64.7-31.5177.9-61.89.5000112.7M1 L2 L8M1-N4 PolarHBondContact O-N 3.23Å; L2-N4 VanDerWaalsContact C-N 3.3Å; L2-N4 PolarHBondContact O-N 3.5Å; N4-L8 VanDerWaalsContact O-CB 3.28Å; N4-L8 WeakPolarHBondContact O-CB 3.36Å; N4-L8 PolarHBondContact O-N 3.24Å
5K85.4Confident85.5Confident104 Ų10481.9 Ų81.945%0.45239%0.388SS..Hα-helixtrans-69.1-37.3179.4-66.8-173.2176.2-176.60111.8L2 W3 R9L2-K5 WeakPolarHBondContact O-CB 3.27Å; L2-K5 PolarHBondContact O-N 3.13Å; W3-K5 VanDerWaalsContact C-N 3.29Å; W3-K5 PolarHBondContact O-N 3.42Å; K5-R9 WeakPolarHBondContact O-CG 3.4Å; K5-R9 PolarHBondContact O-N 2.69Å
6W88.3Confident86.1Confident162 Ų16279.3 Ų79.361%0.61438%0.384SS*.Hα-helixtrans-67.5-48.3176.3-73.9104.7000111.5L2 W3 L8 R9 C10L2-W6 PolarHBondContact O-N 3.04Å; W3-W6 PolarHBondContact O-N 2.94Å; W6-L8 VanDerWaalsContact C-N 3.3Å; W6-L8 PolarHBondContact O-N 3.05Å; W6-R9 PolarHBondContact O-N 3.31Å; W6-C10 PolarHBondContact O-N 2.81Å; W6-C10 PolarHBondContact O-SG 2.61Å; W6-C10 VanDerWaalsContact O-SG 3.35Å
7I88.3Confident86.7Confident26 Ų2680.6 Ų80.613%0.13339%0.388CS..Hα-helixtrans-57.9-44.1177.5-67.3171000111.1W3 R9 C10 L11 F212W3-I7 HydrophobicContact CD2-CD1 3.76Å; W3-I7 VanDerWaalsContact CE2-CD1 3.48Å; W3-I7 HydrophobicContact CE3-CD1 4.06Å; W3-I7 HydrophobicContact CG-CD1 4.39Å; W3-I7 HydrophobicContact CH2-CD1 3.87Å; W3-I7 HydrophobicContact CZ2-CD1 3.55Å; W3-I7 HydrophobicContact CZ3-CD1 4.11Å; W3-I7 PolarHBondContact O-N 3.17Å; I7-R9 VanDerWaalsContact C-N 3.35Å; I7-R9 PolarHBondContact O-N 2.85Å; I7-C10 PolarHBondContact O-N 3.35Å; I7-L11 HydrophobicContact CG2-CD1 3.78Å; I7-L11 HydrophobicContact CG2-CG 4.34Å; I7-L11 WeakPolarHBondContact O-CB 3.5Å; I7-L11 WeakPolarHBondContact O-CG 3.44Å; I7-L11 PolarHBondContact O-N 2.78Å; I7-F212 HydrophobicContact CG2-CB 4.47Å; I7-F212 HydrophobicContact CG2-CD2 4.14Å
8L89.1Confident87.3Confident70 Ų7076.2 Ų76.237%0.36637%0.366SS..Hα-helixtrans-58.2-45.4178.2178.960.5000112.1N4 W6 L11 I12 I74N4-L8 VanDerWaalsContact O-CB 3.28Å; N4-L8 WeakPolarHBondContact O-CB 3.36Å; N4-L8 PolarHBondContact O-N 3.24Å; W6-L8 VanDerWaalsContact C-N 3.3Å; W6-L8 PolarHBondContact O-N 3.05Å; L8-L11 PolarHBondContact O-N 2.79Å; L8-I12 HydrophobicContact CD1-CD1 3.98Å; L8-I12 HydrophobicContact CD1-CG1 4.35Å; L8-I12 HydrophobicContact CG-CD1 3.97Å; L8-I12 VanDerWaalsContact O-CG1 3.29Å; L8-I12 WeakPolarHBondContact O-CG1 3.45Å; L8-I12 PolarHBondContact O-N 3.26Å; L8-I74 HydrophobicContact CD1-CG2 3.07Å
9R90.7Very high87.7Confident116 Ų11678.2 Ų78.244%0.43837%0.37SS..Hα-helixtrans-62.7-46.8176.5-73.4-171.6-68.1-100.26.5111.7K5 W6 I7 L11 I12 T13K5-R9 WeakPolarHBondContact O-CG 3.4Å; K5-R9 PolarHBondContact O-N 2.69Å; W6-R9 PolarHBondContact O-N 3.31Å; I7-R9 VanDerWaalsContact C-N 3.35Å; I7-R9 PolarHBondContact O-N 2.85Å; R9-L11 VanDerWaalsContact C-N 3.3Å; R9-L11 PolarHBondContact O-N 3.01Å; R9-I12 PolarHBondContact O-N 3.19Å; R9-T13 PolarHBondContact O-N 3.11Å; R9-T13 PolarHBondContact O-OG1 3.38Å; R9-T13 VanDerWaalsContact O-OG1 3.09Å
10C92.5Very high88.2Confident67 Ų6778.1 Ų78.145%0.45337%0.371SS..Hα-helixtrans-57.6-43.4177.5-66.60000112W6 I7 F14W6-C10 PolarHBondContact O-N 2.81Å; W6-C10 PolarHBondContact O-SG 2.61Å; W6-C10 VanDerWaalsContact O-SG 3.35Å; I7-C10 PolarHBondContact O-N 3.35Å; C10-F14 VanDerWaalsContact O-CB 3.3Å; C10-F14 WeakPolarHBondContact O-CB 3.11Å; C10-F14 PolarHBondContact O-N 3.28Å
11L92.8Very high88.6Confident0 Ų075.3 Ų75.30%036%0.359CS..Hα-helixtrans-65.7-45.8177.6-76.4167.7000112.1I7 L8 R9 T13 F14 N15 I74 I208 Y209 F212I7-L11 HydrophobicContact CG2-CD1 3.78Å; I7-L11 HydrophobicContact CG2-CG 4.34Å; I7-L11 WeakPolarHBondContact O-CB 3.5Å; I7-L11 WeakPolarHBondContact O-CG 3.44Å; I7-L11 PolarHBondContact O-N 2.78Å; L8-L11 PolarHBondContact O-N 2.79Å; R9-L11 VanDerWaalsContact C-N 3.3Å; R9-L11 PolarHBondContact O-N 3.01Å; L11-T13 VanDerWaalsContact C-N 3.31Å; L11-T13 PolarHBondContact O-N 3.39Å; L11-F14 PolarHBondContact O-N 2.96Å; L11-N15 PolarHBondContact O-N 2.86Å; L11-N15 PolarHBondContact O-ND2 3.05Å; L11-I74 HydrophobicContact CB-CD1 3.65Å; L11-I74 HydrophobicContact CB-CG1 4.28Å; L11-I74 HydrophobicContact CD1-CG1 4.36Å; L11-I208 HydrophobicContact CD2-CB 4.38Å; L11-I208 HydrophobicContact CD2-CG2 3.54Å; L11-I208 HydrophobicContact CG-CG2 3.8Å; L11-Y209 HydrophobicContact CD2-CD1 4.19Å; L11-Y209 HydrophobicContact CD2-CD2 3.77Å; L11-Y209 HydrophobicContact CD2-CE1 4.12Å; L11-Y209 HydrophobicContact CD2-CE2 3.7Å; L11-Y209 HydrophobicContact CD2-CG 4.03Å; L11-F212 HydrophobicContact CD1-CB 3.82Å; L11-F212 HydrophobicContact CD1-CD1 4.2Å; L11-F212 HydrophobicContact CD1-CD2 3.53Å; L11-F212 HydrophobicContact CD1-CE2 4.12Å; L11-F212 HydrophobicContact CD1-CG 3.57Å
12I92.9Very high90.5Very high74 Ų7466.7 Ų66.738%0.37932%0.317SS..Hα-helixtrans-59.1-45.9178-68.6165.9000110.3L8 R9 N15 A16 I74L8-I12 HydrophobicContact CD1-CD1 3.98Å; L8-I12 HydrophobicContact CD1-CG1 4.35Å; L8-I12 HydrophobicContact CG-CD1 3.97Å; L8-I12 VanDerWaalsContact O-CG1 3.29Å; L8-I12 WeakPolarHBondContact O-CG1 3.45Å; L8-I12 PolarHBondContact O-N 3.26Å; R9-I12 PolarHBondContact O-N 3.19Å; I12-N15 PolarHBondContact O-N 3.02Å; I12-A16 PolarHBondContact O-N 3.07Å; I12-A16 VanDerWaalsContact O-N 3.13Å; I12-I74 HydrophobicContact CG1-CG2 4.35Å
13T94Very high91.9Very high75 Ų7562.4 Ų62.446%0.4630%0.297SS..Hα-helixtrans-61.8-46175.8-59.20000111.7R9 L11 N15 A16 F17R9-T13 PolarHBondContact O-N 3.11Å; R9-T13 PolarHBondContact O-OG1 3.38Å; R9-T13 VanDerWaalsContact O-OG1 3.09Å; L11-T13 VanDerWaalsContact C-N 3.31Å; L11-T13 PolarHBondContact O-N 3.39Å; T13-N15 VanDerWaalsContact C-N 3.35Å; T13-N15 PolarHBondContact O-N 2.78Å; T13-A16 PolarHBondContact O-N 2.89Å; T13-F17 HydrophobicContact CG2-CD2 3.79Å; T13-F17 HydrophobicContact CG2-CE2 3.54Å; T13-F17 VanDerWaalsContact O-CD2 3.25Å; T13-F17 WeakPolarHBondContact O-CD2 2.99Å; T13-F17 PolarHBondContact O-N 3.07Å; T13-F17 VanDerWaalsContact O-N 3.09Å
14F95.5Very high93.1Very high7 Ų758.9 Ų58.93%0.03129%0.289CS..Hα-helixtrans-58-44.8177.7173.3-93000112.1C10 L11 A16 F17 Y18 L89 W201 Y209C10-F14 VanDerWaalsContact O-CB 3.3Å; C10-F14 WeakPolarHBondContact O-CB 3.11Å; C10-F14 PolarHBondContact O-N 3.28Å; L11-F14 PolarHBondContact O-N 2.96Å; F14-A16 VanDerWaalsContact C-N 3.34Å; F14-A16 PolarHBondContact O-N 3.34Å; F14-F17 PolarHBondContact O-N 3.17Å; F14-Y18 WeakPolarHBondContact O-CB 3.47Å; F14-Y18 PolarHBondContact O-N 3.23Å; F14-L89 HydrophobicContact CE1-CD1 4.17Å; F14-L89 HydrophobicContact CE1-CD2 4.3Å; F14-L89 HydrophobicContact CZ-CD2 4.41Å; F14-W201 AromaticContact CD2-CE2 3.76Å; F14-W201 AromaticContact CD2-CZ2 3.71Å; F14-W201 HydrophobicContact CD2-CZ2 3.71Å; F14-W201 AromaticContact CD2-NE1 3.72Å; F14-W201 AromaticContact CE2-CD1 3.85Å; F14-W201 HydrophobicContact CE2-CD2 4.4Å; F14-W201 AromaticContact CE2-CE2 3.73Å; F14-W201 HydrophobicContact CE2-CG 4.46Å; F14-W201 HydrophobicContact CE2-CZ2 4.18Å; F14-W201 AromaticContact CE2-NE1 3.34Å; F14-W201 VanDerWaalsContact CE2-NE1 3.34Å; F14-Y209 AromaticContact CD1-CE2 3.9Å; F14-Y209 HydrophobicContact CD1-CE2 3.9Å; F14-Y209 HydrophobicContact CE1-CD2 4.44Å; F14-Y209 AromaticContact CE1-CE2 4Å; F14-Y209 HydrophobicContact CE1-CE2 4Å
15N94.6Very high94Very high0 Ų055.9 Ų55.90%027%0.273CS..Hα-helixtrans-67.7-33.5179.6-74.1-83.8000112.7L11 I12 T13 Y18 W19 G70 I74 F85 Y209L11-N15 PolarHBondContact O-N 2.86Å; L11-N15 PolarHBondContact O-ND2 3.05Å; I12-N15 PolarHBondContact O-N 3.02Å; T13-N15 VanDerWaalsContact C-N 3.35Å; T13-N15 PolarHBondContact O-N 2.78Å; N15-Y18 PolarHBondContact O-N 2.95Å; N15-W19 PolarHBondContact O-N 2.79Å; N15-G70 WeakPolarHBondContact OD1-CA 3.1Å; N15-I74 WeakPolarHBondContact ND2-CD1 3.46Å; N15-F85 VanDerWaalsContact OD1-CE1 3.24Å; N15-F85 WeakPolarHBondContact OD1-CE1 3.18Å; N15-F85 VanDerWaalsContact OD1-CZ 3.27Å; N15-F85 WeakPolarHBondContact OD1-CZ 3.46Å; N15-Y209 PolarHBondContact ND2-OH 3.27Å; N15-Y209 PolarHBondContact OD1-OH 3.42Å
16A95Very high94.6Very high40 Ų4052.9 Ų52.933%0.33126%0.262SS..Hα-helixtrans-62.4-46.3172.400000111.5I12 T13 F14 W19 I20I12-A16 PolarHBondContact O-N 3.07Å; I12-A16 VanDerWaalsContact O-N 3.13Å; T13-A16 PolarHBondContact O-N 2.89Å; F14-A16 VanDerWaalsContact C-N 3.34Å; F14-A16 PolarHBondContact O-N 3.34Å; A16-W19 PolarHBondContact O-N 3.05Å; A16-I20 WeakPolarHBondContact O-CG1 3.45Å; A16-I20 PolarHBondContact O-N 3.38Å; A16-I20 VanDerWaalsContact O-N 3.16Å
17F96.1Very high95Very high102 Ų10248.7 Ų48.745%0.44726%0.257SS..Hα-helixtrans-66-38.7174.3-77-67.7000112.6T13 F14 W19 I20 T21 W201T13-F17 HydrophobicContact CG2-CD2 3.79Å; T13-F17 HydrophobicContact CG2-CE2 3.54Å; T13-F17 VanDerWaalsContact O-CD2 3.25Å; T13-F17 WeakPolarHBondContact O-CD2 2.99Å; T13-F17 PolarHBondContact O-N 3.07Å; T13-F17 VanDerWaalsContact O-N 3.09Å; F14-F17 PolarHBondContact O-N 3.17Å; F17-W19 VanDerWaalsContact C-N 3.32Å; F17-W19 PolarHBondContact O-N 3.41Å; F17-I20 HydrophobicContact CD1-CD1 4.31Å; F17-I20 CarbonylContact O-C 3.6Å; F17-I20 WeakPolarHBondContact O-CB 2.96Å; F17-I20 PolarHBondContact O-N 3.46Å; F17-I20 VanDerWaalsContact O-N 3.13Å; F17-T21 WeakPolarHBondContact O-CG2 3.25Å; F17-T21 PolarHBondContact O-N 3.23Å; F17-W201 HydrophobicContact CB-CH2 4.48Å; F17-W201 HydrophobicContact CB-CZ2 3.57Å; F17-W201 HydrophobicContact CD2-CH2 4.33Å; F17-W201 HydrophobicContact CD2-CZ2 4.1Å; F17-W201 HydrophobicContact CG-CZ2 4.03Å
18Y96.8Very high95.5Very high0 Ų048.8 Ų48.80%026%0.259CS..Hα-helixtrans-57.6-45.1175.4-178.9-111.5000111.2F14 N15 I20 T21 G22 I63 S66 S67 F85 L89 Q202F14-Y18 WeakPolarHBondContact O-CB 3.47Å; F14-Y18 PolarHBondContact O-N 3.23Å; N15-Y18 PolarHBondContact O-N 2.95Å; Y18-I20 PolarHBondContact O-N 2.94Å; Y18-T21 PolarHBondContact O-N 2.91Å; Y18-T21 PolarHBondContact O-OG1 3.22Å; Y18-G22 PolarHBondContact O-N 2.95Å; Y18-G22 VanDerWaalsContact O-N 3.1Å; Y18-I63 HydrophobicContact CD1-CG2 3.97Å; Y18-I63 HydrophobicContact CD2-CG2 4.17Å; Y18-I63 HydrophobicContact CE1-CB 4.33Å; Y18-I63 HydrophobicContact CE1-CG2 3.71Å; Y18-I63 HydrophobicContact CE2-CB 4.47Å; Y18-I63 HydrophobicContact CE2-CD1 4.46Å; Y18-I63 HydrophobicContact CE2-CG1 3.93Å; Y18-I63 HydrophobicContact CE2-CG2 3.92Å; Y18-I63 HydrophobicContact CG-CG2 4.2Å; Y18-I63 WeakPolarHBondContact O-CG2 3.3Å; Y18-I63 WeakPolarHBondContact OH-CG1 3.46Å; Y18-S66 PolarHBondContact OH-OG 3.06Å; Y18-S67 WeakPolarHBondContact CD1-OG 3.48Å; Y18-S67 WeakPolarHBondContact CE1-OG 3.37Å; Y18-F85 HydrophobicContact CD1-CE2 4.21Å; Y18-F85 AromaticContact CD1-CZ 3.73Å; Y18-F85 HydrophobicContact CD1-CZ 3.73Å; Y18-F85 AromaticContact CE1-CE2 3.74Å; Y18-F85 HydrophobicContact CE1-CE2 3.74Å; Y18-F85 AromaticContact CE1-CZ 3.63Å; Y18-F85 HydrophobicContact CE1-CZ 3.63Å; Y18-L89 HydrophobicContact CD2-CD2 3.83Å; Y18-L89 HydrophobicContact CE1-CD2 4.13Å; Y18-L89 HydrophobicContact CE2-CD2 3.35Å; Y18-L89 HydrophobicContact CG-CD2 4.38Å; Y18-Q202 HydrophobicContact CD2-CG 4.26Å; Y18-Q202 HydrophobicContact CE2-CG 4.04Å
19W96.7Very high95.8Very high114 Ų11445.5 Ų45.543%0.43224%0.242SC..Hα-helixtrans-59.6-44.2173.9-173.683.8000112.4N15 A16 F17 T21 G22 C23 L64 W71N15-W19 PolarHBondContact O-N 2.79Å; A16-W19 PolarHBondContact O-N 3.05Å; F17-W19 VanDerWaalsContact C-N 3.32Å; F17-W19 PolarHBondContact O-N 3.41Å; W19-T21 VanDerWaalsContact C-N 3.34Å; W19-T21 PolarHBondContact O-N 2.93Å; W19-G22 WeakPolarHBondContact O-CA 2.87Å; W19-G22 PolarHBondContact O-N 3.39Å; W19-C23 PolarHBondContact O-N 2.93Å; W19-L64 HydrophobicContact CD2-CD2 4.24Å; W19-L64 HydrophobicContact CG-CD2 4.24Å; W19-L64 HydrophobicContact CZ2-CD2 4.37Å; W19-W71 HydrophobicContact CB-CH2 4.13Å; W19-W71 HydrophobicContact CG-CH2 4.21Å
20I97.4Very high96.1Very high77 Ų7743.4 Ų43.440%0.39524%0.239SC..Hα-helixtrans-60.8-41.4175.5-64.3166.9000111.3A16 F17 Y18 G22 C23 I24A16-I20 WeakPolarHBondContact O-CG1 3.45Å; A16-I20 PolarHBondContact O-N 3.38Å; A16-I20 VanDerWaalsContact O-N 3.16Å; F17-I20 HydrophobicContact CD1-CD1 4.31Å; F17-I20 CarbonylContact O-C 3.6Å; F17-I20 WeakPolarHBondContact O-CB 2.96Å; F17-I20 PolarHBondContact O-N 3.46Å; F17-I20 VanDerWaalsContact O-N 3.13Å; Y18-I20 PolarHBondContact O-N 2.94Å; I20-G22 PolarHBondContact O-N 3.46Å; I20-C23 WeakPolarHBondContact O-CB 3.34Å; I20-C23 PolarHBondContact O-N 3.17Å; I20-C23 VanDerWaalsContact O-N 3.11Å; I20-I24 HydrophobicContact CG2-CD1 4.02Å; I20-I24 HydrophobicContact CG2-CG1 4.48Å; I20-I24 WeakPolarHBondContact O-CG1 3.34Å; I20-I24 PolarHBondContact O-N 3.06Å
21T96.8Very high96.3Very high20 Ų2046.3 Ų46.312%0.12324%0.241CC..Hα-helixtrans-61.7-31.8175.665.40000112.2F17 Y18 W19 I24 A25 I198F17-T21 WeakPolarHBondContact O-CG2 3.25Å; F17-T21 PolarHBondContact O-N 3.23Å; Y18-T21 PolarHBondContact O-N 2.91Å; Y18-T21 PolarHBondContact O-OG1 3.22Å; W19-T21 VanDerWaalsContact C-N 3.34Å; W19-T21 PolarHBondContact O-N 2.93Å; T21-I24 PolarHBondContact O-N 3.31Å; T21-A25 VanDerWaalsContact O-CB 3.31Å; T21-A25 WeakPolarHBondContact O-CB 3.02Å; T21-A25 PolarHBondContact O-N 3.27Å; T21-I198 HydrophobicContact CG2-CG1 4.34Å
22G97.9Very high96.3Very high0 Ų046.9 Ų46.90%024%0.243CC..Hα-helixtrans-62.1-45.6171.500000112.6Y18 W19 I20 I24 A25 L26 I63Y18-G22 PolarHBondContact O-N 2.95Å; Y18-G22 VanDerWaalsContact O-N 3.1Å; W19-G22 WeakPolarHBondContact O-CA 2.87Å; W19-G22 PolarHBondContact O-N 3.39Å; I20-G22 PolarHBondContact O-N 3.46Å; G22-I24 VanDerWaalsContact C-N 3.34Å; G22-I24 PolarHBondContact O-N 3.27Å; G22-A25 PolarHBondContact O-N 3.37Å; G22-L26 VanDerWaalsContact O-CB 3.27Å; G22-L26 WeakPolarHBondContact O-CB 3.05Å; G22-L26 PolarHBondContact O-N 2.99Å; G22-I63 VanDerWaalsContact CA-CG2 3.44Å
23C98.1Very high96.3Very high40 Ų4044.2 Ų44.227%0.2723%0.23SC..Hα-helixtrans-60.4-42.8174.2-66.40000112.1W19 I20 S27W19-C23 PolarHBondContact O-N 2.93Å; I20-C23 WeakPolarHBondContact O-CB 3.34Å; I20-C23 PolarHBondContact O-N 3.17Å; I20-C23 VanDerWaalsContact O-N 3.11Å; C23-S27 VanDerWaalsContact O-CB 3.3Å; C23-S27 WeakPolarHBondContact O-CB 3.23Å; C23-S27 PolarHBondContact O-N 3.49Å; C23-S27 PolarHBondContact O-OG 3.02Å
24I98Very high96.2Very high80 Ų8043.8 Ų43.841%0.4123%0.227SC..Hα-helixtrans-64.2-51.5178.3-65.8168.5000110.5I20 T21 G22 L26 S27 V28 V194I20-I24 HydrophobicContact CG2-CD1 4.02Å; I20-I24 HydrophobicContact CG2-CG1 4.48Å; I20-I24 WeakPolarHBondContact O-CG1 3.34Å; I20-I24 PolarHBondContact O-N 3.06Å; T21-I24 PolarHBondContact O-N 3.31Å; G22-I24 VanDerWaalsContact C-N 3.34Å; G22-I24 PolarHBondContact O-N 3.27Å; I24-L26 VanDerWaalsContact C-N 3.32Å; I24-L26 PolarHBondContact O-N 2.03Å; I24-S27 PolarHBondContact O-N 3.09Å; I24-V28 HydrophobicContact CG2-CG2 4.34Å; I24-V28 WeakPolarHBondContact O-CG2 3.46Å; I24-V28 PolarHBondContact O-N 3.37Å; I24-V194 HydrophobicContact CG2-CG1 4.22Å
25A97.8Very high96.1Very high0 Ų051 Ų510%026%0.255CS..Hα-helixtrans-58.1-44179.300000112.1T21 G22 G29 I56 I198T21-A25 VanDerWaalsContact O-CB 3.31Å; T21-A25 WeakPolarHBondContact O-CB 3.02Å; T21-A25 PolarHBondContact O-N 3.27Å; G22-A25 PolarHBondContact O-N 3.37Å; A25-G29 PolarHBondContact O-N 3.4Å; A25-I56 HydrophobicContact CB-CD1 4.47Å; A25-I56 HydrophobicContact CB-CG1 3.94Å; A25-I198 HydrophobicContact CB-CD1 3.94Å
26L97.5Very high95.9Very high40 Ų4051.2 Ų51.221%0.20926%0.256CS..Hα-helixtrans-63-47.2176.5-174.175.6000111.4G22 I24 G29 I30 I61 L64G22-L26 VanDerWaalsContact O-CB 3.27Å; G22-L26 WeakPolarHBondContact O-CB 3.05Å; G22-L26 PolarHBondContact O-N 2.99Å; I24-L26 VanDerWaalsContact C-N 3.32Å; I24-L26 PolarHBondContact O-N 2.03Å; L26-G29 PolarHBondContact O-N 3.14Å; L26-I30 HydrophobicContact CD1-CD1 4.12Å; L26-I30 HydrophobicContact CD2-CD1 4.32Å; L26-I30 HydrophobicContact CG-CD1 3.78Å; L26-I30 HydrophobicContact CG-CG1 4.49Å; L26-I30 WeakPolarHBondContact O-CB 3.26Å; L26-I30 VanDerWaalsContact O-CG1 3.27Å; L26-I30 WeakPolarHBondContact O-CG1 3.34Å; L26-I30 PolarHBondContact O-N 3.23Å; L26-I61 HydrophobicContact CD1-CD1 4.16Å; L26-I61 HydrophobicContact CD1-CG1 3.45Å; L26-I61 VanDerWaalsContact CD1-CG1 3.45Å; L26-L64 HydrophobicContact CD2-CD1 3.92Å
27S97.7Very high95.6Very high75 Ų7553.8 Ų53.852%0.52427%0.265SS..Hα-helixtrans-63.3-46.1-178.5-580000111.8C23 I24 I30 Y31C23-S27 VanDerWaalsContact O-CB 3.3Å; C23-S27 WeakPolarHBondContact O-CB 3.23Å; C23-S27 PolarHBondContact O-N 3.49Å; C23-S27 PolarHBondContact O-OG 3.02Å; I24-S27 PolarHBondContact O-N 3.09Å; S27-I30 PolarHBondContact O-N 3.29Å; S27-Y31 VanDerWaalsContact O-CB 3.28Å; S27-Y31 WeakPolarHBondContact O-CB 3.38Å; S27-Y31 PolarHBondContact O-N 3.3Å
28V96.9Very high95.2Very high28 Ų2849.1 Ų49.117%0.1724%0.244CC..Hα-helixtrans-62.9-45.2176.7171.90000110.7I24 I30 Y31 E32 V191I24-V28 HydrophobicContact CG2-CG2 4.34Å; I24-V28 WeakPolarHBondContact O-CG2 3.46Å; I24-V28 PolarHBondContact O-N 3.37Å; V28-I30 PolarHBondContact O-N 3.02Å; V28-Y31 PolarHBondContact O-N 2.99Å; V28-E32 WeakPolarHBondContact O-CG 3.43Å; V28-E32 PolarHBondContact O-N 3.48Å; V28-V191 HydrophobicContact CG1-CG2 4Å
29G96.1Very high94.9Very high0 Ų052.3 Ų52.30%026%0.259CS..Hα-helixtrans-59.4-48.4177.100000112.7A25 L26 Y31 E32 I33A25-G29 PolarHBondContact O-N 3.4Å; L26-G29 PolarHBondContact O-N 3.14Å; G29-Y31 PolarHBondContact O-N 3.26Å; G29-E32 PolarHBondContact O-N 3.19Å; G29-I33 WeakPolarHBondContact O-CD1 3.23Å; G29-I33 WeakPolarHBondContact O-CG1 3.49Å; G29-I33 PolarHBondContact O-N 3.44Å; G29-I33 VanDerWaalsContact O-N 3.12Å
30I96.4Very high94.3Very high73 Ų7348.1 Ų48.137%0.37424%0.244SC..Hα-helixtrans-63.9-42178.4-68170.4000111.2L26 S27 V28 I33 T34L26-I30 HydrophobicContact CD1-CD1 4.12Å; L26-I30 HydrophobicContact CD2-CD1 4.32Å; L26-I30 HydrophobicContact CG-CD1 3.78Å; L26-I30 HydrophobicContact CG-CG1 4.49Å; L26-I30 WeakPolarHBondContact O-CB 3.26Å; L26-I30 VanDerWaalsContact O-CG1 3.27Å; L26-I30 WeakPolarHBondContact O-CG1 3.34Å; L26-I30 PolarHBondContact O-N 3.23Å; S27-I30 PolarHBondContact O-N 3.29Å; V28-I30 PolarHBondContact O-N 3.02Å; I30-I33 PolarHBondContact O-N 3.44Å; I30-T34 VanDerWaalsContact O-CB 3.28Å; I30-T34 WeakPolarHBondContact O-CB 3.47Å; I30-T34 PolarHBondContact O-N 3.42Å; I30-T34 PolarHBondContact O-OG1 3.29Å
31Y96.9Very high93.8Very high128 Ų12844.4 Ų44.450%0.50223%0.225SC..Hα-helixtrans-58.6-49.6178.5179.7-94.7000111.1S27 V28 G29 I33 T34 Y35 S36S27-Y31 VanDerWaalsContact O-CB 3.28Å; S27-Y31 WeakPolarHBondContact O-CB 3.38Å; S27-Y31 PolarHBondContact O-N 3.3Å; V28-Y31 PolarHBondContact O-N 2.99Å; G29-Y31 PolarHBondContact O-N 3.26Å; Y31-I33 VanDerWaalsContact C-N 3.31Å; Y31-I33 PolarHBondContact O-N 2.95Å; Y31-T34 PolarHBondContact O-N 3.26Å; Y31-Y35 CarbonylContact O-C 3.55Å; Y31-Y35 WeakPolarHBondContact O-CA 3.26Å; Y31-Y35 PolarHBondContact O-N 2.96Å; Y31-S36 PolarHBondContact O-N 2.91Å
32E93.2Very high93.2Very high11 Ų1148.2 Ų48.25%0.05124%0.237CC..Hα-helixtrans-66.5-33.6-179.3-68.3-61.7157.900112.8V28 G29 S36 Y38 S53 V191V28-E32 WeakPolarHBondContact O-CG 3.43Å; V28-E32 PolarHBondContact O-N 3.48Å; G29-E32 PolarHBondContact O-N 3.19Å; E32-S36 VanDerWaalsContact O-CB 3.31Å; E32-S36 WeakPolarHBondContact O-CB 3.35Å; E32-S36 PolarHBondContact O-OG 2.95Å; E32-Y38 WeakPolarHBondContact OE2-CE1 3.44Å; E32-Y38 VanDerWaalsContact OE2-CZ 3.23Å; E32-Y38 PolarHBondContact OE2-OH 3.25Å; E32-S53 WeakPolarHBondContact CB-OG 3.18Å; E32-V191 HydrophobicContact CB-CG2 4.48Å; E32-V191 HydrophobicContact CG-CG2 3.67Å
33I92.7Very high92.1Very high18 Ų1851.8 Ų51.89%0.09227%0.274CS..Hα-helixtrans-73.4-36.2178.3-68163.9000112.1G29 I30 Y31 Y54 C57G29-I33 WeakPolarHBondContact O-CD1 3.23Å; G29-I33 WeakPolarHBondContact O-CG1 3.49Å; G29-I33 PolarHBondContact O-N 3.44Å; G29-I33 VanDerWaalsContact O-N 3.12Å; I30-I33 PolarHBondContact O-N 3.44Å; Y31-I33 VanDerWaalsContact C-N 3.31Å; Y31-I33 PolarHBondContact O-N 2.95Å; I33-Y54 HydrophobicContact CD1-CD1 3.63Å; I33-Y54 HydrophobicContact CD1-CE1 3.7Å; I33-Y54 HydrophobicContact CD1-CG 4.36Å; I33-Y54 HydrophobicContact CG1-CD1 4.38Å; I33-Y54 HydrophobicContact CG1-CE1 4.14Å; I33-Y54 HydrophobicContact CG2-CE1 4.29Å; I33-C57 HydrophobicContact CD1-CB 4.3Å
34T92.5Very high90.9Very high66 Ų6653.9 Ų53.941%0.40528%0.278SS..Hα-helixtrans-113.4-36.2-163.2-43.40000113.3I30 Y31I30-T34 VanDerWaalsContact O-CB 3.28Å; I30-T34 WeakPolarHBondContact O-CB 3.47Å; I30-T34 PolarHBondContact O-N 3.42Å; I30-T34 PolarHBondContact O-OG1 3.29Å; Y31-T34 PolarHBondContact O-N 3.26Å
35Y92.2Very high89.4Confident160 Ų16054 Ų5463%0.62727%0.274SS*.THydrogen-bonded Turntrans-117.8-8.1-168.7-65.6-74.5000113.8Y31Y31-Y35 CarbonylContact O-C 3.55Å; Y31-Y35 WeakPolarHBondContact O-CA 3.26Å; Y31-Y35 PolarHBondContact O-N 2.96Å
36S91.1Very high87.7Confident3 Ų357.9 Ų57.92%0.02130%0.295CS..SBendtrans-58.4149.7178630000111.9Y31 E32 Y38 H39Y31-S36 PolarHBondContact O-N 2.91Å; E32-S36 VanDerWaalsContact O-CB 3.31Å; E32-S36 WeakPolarHBondContact O-CB 3.35Å; E32-S36 PolarHBondContact O-OG 2.95Å; S36-Y38 PolarHBondContact O-N 3.49Å; S36-H39 WeakPolarHBondContact O-CB 3.29Å; S36-H39 PolarHBondContact O-N 3Å; S36-H39 PolarHBondContact O-ND1 3.05Å; S36-H39 WeakPolarHBondContact OG-CA 3.35Å; S36-H39 PolarHBondContact OG-N 3.42Å; S36-H39 VanDerWaalsContact OG-N 3.1Å
37D88.6Confident86Confident94 Ų9462.7 Ų62.750%0.50332%0.32SS..THydrogen-bonded Turntrans-59.5-22.7177.1-76.7-34.1000112.6F40 K145 F146 T183D37-F40 VanDerWaalsContact O-CD1 3.27Å; D37-F40 WeakPolarHBondContact O-CD1 3.33Å; D37-F40 WeakPolarHBondContact O-CE1 2.99Å; D37-K145 VanDerWaalsContact O-CE 3.23Å; D37-K145 WeakPolarHBondContact O-CE 3.2Å; D37-K145 PolarHBondContact O-NZ 3.34Å; D37-F146 HydrophobicContact CB-CE1 4.4Å; D37-F146 HydrophobicContact CB-CZ 4.32Å; D37-T183 HydrophobicContact CB-CG2 3.6Å
38Y88.5Confident85.1Confident4 Ų460 Ų602%0.01630%0.304CS..THydrogen-bonded Turntrans-1046.9-179.962.6-84.3000113.8E32 S36 F40 L41 F50 T183 T184E32-Y38 WeakPolarHBondContact OE2-CE1 3.44Å; E32-Y38 VanDerWaalsContact OE2-CZ 3.23Å; E32-Y38 PolarHBondContact OE2-OH 3.25Å; S36-Y38 PolarHBondContact O-N 3.49Å; Y38-F40 PolarHBondContact O-N 3.49Å; Y38-L41 VanDerWaalsContact O-CB 3.29Å; Y38-L41 WeakPolarHBondContact O-CB 3.04Å; Y38-L41 WeakPolarHBondContact O-CG 3.44Å; Y38-L41 PolarHBondContact O-N 3.48Å; Y38-F50 AromaticContact CD2-CE1 3.84Å; Y38-F50 HydrophobicContact CD2-CE1 3.84Å; Y38-F50 HydrophobicContact CD2-CE2 4.48Å; Y38-F50 AromaticContact CD2-CZ 3.58Å; Y38-F50 HydrophobicContact CD2-CZ 3.58Å; Y38-F50 HydrophobicContact CE2-CD1 4.35Å; Y38-F50 AromaticContact CE2-CE1 3.56Å; Y38-F50 HydrophobicContact CE2-CE1 3.56Å; Y38-F50 AromaticContact CE2-CZ 3.77Å; Y38-F50 HydrophobicContact CE2-CZ 3.77Å; Y38-T183 HydrophobicContact CD1-CG2 4.15Å; Y38-T184 HydrophobicContact CD2-CG2 4.25Å; Y38-T184 HydrophobicContact CE2-CG2 4.23Å
39H89Confident84.5Confident67 Ų6758.8 Ų58.831%0.3130%0.297SS..G310 helixtrans-55-30.9-178.977.2-91.5000113.3S36 L41 R42S36-H39 WeakPolarHBondContact O-CB 3.29Å; S36-H39 PolarHBondContact O-N 3Å; S36-H39 PolarHBondContact O-ND1 3.05Å; S36-H39 WeakPolarHBondContact OG-CA 3.35Å; S36-H39 PolarHBondContact OG-N 3.42Å; S36-H39 VanDerWaalsContact OG-N 3.1Å; H39-L41 PolarHBondContact O-N 3.08Å; H39-R42 WeakPolarHBondContact O-CB 3.37Å; H39-R42 PolarHBondContact O-N 3.37Å; H39-R42 VanDerWaalsContact O-N 3.12Å
40F85.9Confident84.2Confident26 Ų2658.8 Ų58.811%0.11430%0.297CS..G310 helixtrans-65.3-19.9-179.970.7-86.7000112.9D37 Y38 R42 F138 Y141 I142 K145 F146D37-F40 VanDerWaalsContact O-CD1 3.27Å; D37-F40 WeakPolarHBondContact O-CD1 3.33Å; D37-F40 WeakPolarHBondContact O-CE1 2.99Å; Y38-F40 PolarHBondContact O-N 3.49Å; F40-R42 PolarHBondContact O-N 3.28Å; F40-F138 AromaticContact CD2-CE2 3.59Å; F40-F138 HydrophobicContact CD2-CE2 3.59Å; F40-F138 AromaticContact CD2-CZ 3.81Å; F40-F138 HydrophobicContact CD2-CZ 3.81Å; F40-F138 HydrophobicContact CE2-CE2 4.05Å; F40-F138 AromaticContact CE2-CZ 3.85Å; F40-F138 HydrophobicContact CE2-CZ 3.85Å; F40-Y141 HydrophobicContact CB-CE1 3.94Å; F40-Y141 HydrophobicContact CD1-CE1 4.02Å; F40-Y141 HydrophobicContact CD2-CD1 4.05Å; F40-Y141 AromaticContact CD2-CE1 3.88Å; F40-Y141 HydrophobicContact CD2-CE1 3.88Å; F40-Y141 HydrophobicContact CE2-CD1 4.45Å; F40-Y141 HydrophobicContact CE2-CE1 4.48Å; F40-Y141 HydrophobicContact CG-CD1 4.29Å; F40-Y141 AromaticContact CG-CE1 3.64Å; F40-Y141 HydrophobicContact CG-CE1 3.64Å; F40-I142 HydrophobicContact CD2-CG1 4.43Å; F40-I142 HydrophobicContact CE2-CD1 3.89Å; F40-I142 HydrophobicContact CE2-CG1 3.39Å; F40-I142 HydrophobicContact CZ-CD1 4.45Å; F40-I142 HydrophobicContact CZ-CG1 3.78Å; F40-K145 HydrophobicContact CD1-CD 4.14Å; F40-K145 HydrophobicContact CE1-CD 4.05Å; F40-F146 AromaticContact CE1-CE2 3.55Å; F40-F146 HydrophobicContact CE1-CE2 3.55Å; F40-F146 HydrophobicContact CE1-CZ 4.06Å; F40-F146 AromaticContact CZ-CE2 3.66Å; F40-F146 HydrophobicContact CZ-CE2 3.66Å; F40-F146 HydrophobicContact CZ-CZ 4.46Å
41L86.6Confident83.9Confident0 Ų057.6 Ų57.60%029%0.293CS..G310 helixtrans-66.7-27.9174.8-63.4179.7000112.1Y38 H39 G43 K44 Y45 F50 L114 M117 F138 V180Y38-L41 VanDerWaalsContact O-CB 3.29Å; Y38-L41 WeakPolarHBondContact O-CB 3.04Å; Y38-L41 WeakPolarHBondContact O-CG 3.44Å; Y38-L41 PolarHBondContact O-N 3.48Å; H39-L41 PolarHBondContact O-N 3.08Å; L41-G43 VanDerWaalsContact C-N 3.32Å; L41-G43 PolarHBondContact O-N 3.15Å; L41-K44 PolarHBondContact O-N 3Å; L41-K44 VanDerWaalsContact O-N 3.1Å; L41-Y45 PolarHBondContact O-N 2.86Å; L41-F50 HydrophobicContact CB-CE2 4.42Å; L41-L114 HydrophobicContact CD1-CD2 4.08Å; L41-M117 HydrophobicContact CD2-CE 4.01Å; L41-M117 HydrophobicContact CD2-SD 3.96Å; L41-F138 HydrophobicContact CD2-CE1 4.34Å; L41-F138 HydrophobicContact CD2-CZ 3.87Å; L41-V180 HydrophobicContact CD1-CG1 3.76Å
42R84Confident83.7Confident100 Ų10051.6 Ų51.638%0.37727%0.27SS..THydrogen-bonded Turntrans-52.4-47.3-176.9-177.6-172.6165.4-170.83.8112.8H39 F40 K44 Y45 D46 F50 Y54H39-R42 WeakPolarHBondContact O-CB 3.37Å; H39-R42 PolarHBondContact O-N 3.37Å; H39-R42 VanDerWaalsContact O-N 3.12Å; F40-R42 PolarHBondContact O-N 3.28Å; R42-K44 PolarHBondContact O-N 3.44Å; R42-K44 VanDerWaalsContact O-N 3.13Å; R42-Y45 PolarHBondContact O-N 3.46Å; R42-D46 WeakPolarHBondContact CG-OD1 3.19Å; R42-D46 IonicContact NE-OD1 3.78Å; R42-D46 WeakPolarHBondContact O-CA 2.99Å; R42-D46 WeakPolarHBondContact O-CB 3.43Å; R42-F50 HydrophobicContact CB-CD2 4Å; R42-F50 HydrophobicContact CB-CE2 3.65Å; R42-F50 HydrophobicContact CB-CZ 4.07Å; R42-F50 HydrophobicContact CG-CD2 4.24Å; R42-F50 HydrophobicContact CG-CE2 4.38Å; R42-Y54 PolarHBondContact NE-OH 3.45Å; R42-Y54 PolarHBondContact NH2-OH 2.99Å
43G75.2Confident83.7Confident75 Ų7551.1 Ų51.177%0.77327%0.268SS*.THydrogen-bonded Turntrans-67.1-14.3-175.800000114.9L41L41-G43 VanDerWaalsContact C-N 3.32Å; L41-G43 PolarHBondContact O-N 3.15Å
44K71.3Confident83.8Confident83 Ų8353.7 Ų53.736%0.36128%0.277SS..THydrogen-bonded Turntrans-111.7-32.4178.9-70.1-93176.6-174.30112L41 R42 E134 F138L41-K44 PolarHBondContact O-N 3Å; L41-K44 VanDerWaalsContact O-N 3.1Å; R42-K44 PolarHBondContact O-N 3.44Å; R42-K44 VanDerWaalsContact O-N 3.13Å; K44-E134 IonicContact NZ-OE2 2.93Å; K44-E134 PolarHBondContact NZ-OE2 3.22Å; K44-F138 HydrophobicContact CB-CZ 4.25Å; K44-F138 HydrophobicContact CG-CD2 4.29Å; K44-F138 HydrophobicContact CG-CE1 4.47Å; K44-F138 HydrophobicContact CG-CE2 3.96Å; K44-F138 HydrophobicContact CG-CZ 4.04Å
45Y66.8Low84Confident82 Ų8252.6 Ų52.632%0.32227%0.27SS..SBendtrans-141.391.6-176-60.5-85.9000109.4L41 R42 M117L41-Y45 PolarHBondContact O-N 2.86Å; R42-Y45 PolarHBondContact O-N 3.46Å; Y45-M117 HydrophobicContact CD2-CB 4.4Å; Y45-M117 HydrophobicContact CD2-CE 4.09Å; Y45-M117 HydrophobicContact CD2-CG 4.08Å; Y45-M117 HydrophobicContact CD2-SD 3.45Å; Y45-M117 WeakPolarHBondContact CD2-SD 3.28Å; Y45-M117 HydrophobicContact CE1-CB 4.13Å; Y45-M117 HydrophobicContact CE2-CB 3.82Å; Y45-M117 HydrophobicContact CE2-CE 4.34Å; Y45-M117 HydrophobicContact CE2-CG 3.38Å; Y45-M117 HydrophobicContact CE2-SD 3.29Å; Y45-M117 WeakPolarHBondContact CE2-SD 3.37Å; Y45-M117 HydrophobicContact CG-SD 4.45Å
46D62.3Low84.2Confident83 Ų8345 Ų4544%0.44424%0.24SC..  trans-93.8-37-152.1-149.52.5000113.9R42R42-D46 WeakPolarHBondContact CG-OD1 3.19Å; R42-D46 IonicContact NE-OD1 3.78Å; R42-D46 WeakPolarHBondContact O-CA 2.99Å; R42-D46 WeakPolarHBondContact O-CB 3.43Å
47L61.2Low84.5Confident140 Ų14045.7 Ų45.773%0.73325%0.245SC*.Hα-helixtrans-88.6-68.3-156.6-72.8161000113.9L49 T51L47-L49 PolarHBondContact O-N 2.03Å; L47-T51 WeakPolarHBondContact O-CB 3.39Å; L47-T51 PolarHBondContact O-N 3.34Å; L47-T51 VanDerWaalsContact O-N 3.07Å; L47-T51 PolarHBondContact O-OG1 3.06Å
48G80.8Confident84.9Confident18 Ų1844 Ų4419%0.18624%0.24CC..Hα-helixtrans-72.6-34.9-165.200000114.3F50 T51 Y106G48-F50 PolarHBondContact O-N 3.24Å; G48-T51 PolarHBondContact O-N 3.08Å; G48-Y106 WeakPolarHBondContact CA-OH 3.31Å
49L82.4Confident85.3Confident4 Ų444 Ų442%0.02124%0.241CC..Hα-helixtrans-61.3-42.3-179.2-73.6169000113.3L47 Y106 I110 L114 T184 Q188L47-L49 PolarHBondContact O-N 2.03Å; L49-Y106 HydrophobicContact CD2-CE1 3.89Å; L49-Y106 HydrophobicContact CG-CE1 4.23Å; L49-Y106 PolarHBondContact N-OH 2.88Å; L49-Y106 VanDerWaalsContact N-OH 3.16Å; L49-I110 HydrophobicContact CD2-CD1 4.37Å; L49-I110 HydrophobicContact CD2-CG1 3.76Å; L49-I110 HydrophobicContact CD2-CG2 4.35Å; L49-L114 HydrophobicContact CD1-CD2 4.18Å; L49-T184 HydrophobicContact CD2-CG2 3.82Å; L49-Q188 PolarHBondContact O-NE2 2.71Å
50F89.8Confident85.7Confident0 Ų040.8 Ų40.80%023%0.226CC..Hα-helixtrans-100.7-4.7-175.7-66.9-83.1000113.5Y38 L41 R42 G48 G52 S53 Y54Y38-F50 AromaticContact CD2-CE1 3.84Å; Y38-F50 HydrophobicContact CD2-CE1 3.84Å; Y38-F50 HydrophobicContact CD2-CE2 4.48Å; Y38-F50 AromaticContact CD2-CZ 3.58Å; Y38-F50 HydrophobicContact CD2-CZ 3.58Å; Y38-F50 HydrophobicContact CE2-CD1 4.35Å; Y38-F50 AromaticContact CE2-CE1 3.56Å; Y38-F50 HydrophobicContact CE2-CE1 3.56Å; Y38-F50 AromaticContact CE2-CZ 3.77Å; Y38-F50 HydrophobicContact CE2-CZ 3.77Å; L41-F50 HydrophobicContact CB-CE2 4.42Å; R42-F50 HydrophobicContact CB-CD2 4Å; R42-F50 HydrophobicContact CB-CE2 3.65Å; R42-F50 HydrophobicContact CB-CZ 4.07Å; R42-F50 HydrophobicContact CG-CD2 4.24Å; R42-F50 HydrophobicContact CG-CE2 4.38Å; G48-F50 PolarHBondContact O-N 3.24Å; F50-G52 PolarHBondContact O-N 3.19Å; F50-S53 PolarHBondContact O-N 3.38Å; F50-Y54 HydrophobicContact CB-CD2 4.04Å; F50-Y54 HydrophobicContact CB-CE2 3.59Å; F50-Y54 WeakPolarHBondContact O-CD2 3.29Å; F50-Y54 PolarHBondContact O-N 2.91Å
51T91.3Very high86.3Confident47 Ų4743.2 Ų43.229%0.28824%0.239SC..Hα-helixtrans-49.7-45178.5-72.50000111.5L47 G48 S53 Y54 V55L47-T51 WeakPolarHBondContact O-CB 3.39Å; L47-T51 PolarHBondContact O-N 3.34Å; L47-T51 VanDerWaalsContact O-N 3.07Å; L47-T51 PolarHBondContact O-OG1 3.06Å; G48-T51 PolarHBondContact O-N 3.08Å; T51-S53 PolarHBondContact O-N 3.12Å; T51-Y54 PolarHBondContact O-N 3.25Å; T51-V55 HydrophobicContact CG2-CG2 4.37Å; T51-V55 VanDerWaalsContact O-CG2 3.3Å; T51-V55 WeakPolarHBondContact O-CG2 3.27Å; T51-V55 PolarHBondContact O-N 3.02Å
52G92.5Very high86.8Confident2 Ų249.4 Ų49.42%0.02127%0.266CS..Hα-helixtrans-57.2-49.4176.400000114.4F50 Y54 V55 I56 C99F50-G52 PolarHBondContact O-N 3.19Å; G52-Y54 VanDerWaalsContact C-N 3.28Å; G52-Y54 PolarHBondContact O-N 3.28Å; G52-V55 PolarHBondContact O-N 2.93Å; G52-I56 WeakPolarHBondContact O-CG2 3.32Å; G52-I56 PolarHBondContact O-N 2.99Å; G52-C99 PolarHBondContact O-SG 3.43Å
53S93.8Very high87.5Confident1 Ų144.6 Ų44.61%0.00725%0.248CC..Hα-helixtrans-63.1-35.6-179.7-50.90000111.5E32 F50 T51 I56 C57E32-S53 WeakPolarHBondContact CB-OG 3.18Å; F50-S53 PolarHBondContact O-N 3.38Å; T51-S53 PolarHBondContact O-N 3.12Å; S53-I56 VanDerWaalsContact O-CG2 3.31Å; S53-I56 WeakPolarHBondContact O-CG2 3.29Å; S53-C57 WeakPolarHBondContact O-CB 3.43Å; S53-C57 PolarHBondContact O-N 2.66Å; S53-C57 VanDerWaalsContact O-N 3.08Å
54Y94.5Very high88.5Confident72 Ų7242.9 Ų42.928%0.28222%0.221SC..Hα-helixtrans-68-41.9172.5-70.8-61000113.3I33 R42 F50 T51 G52 C57 S58I33-Y54 HydrophobicContact CD1-CD1 3.63Å; I33-Y54 HydrophobicContact CD1-CE1 3.7Å; I33-Y54 HydrophobicContact CD1-CG 4.36Å; I33-Y54 HydrophobicContact CG1-CD1 4.38Å; I33-Y54 HydrophobicContact CG1-CE1 4.14Å; I33-Y54 HydrophobicContact CG2-CE1 4.29Å; R42-Y54 PolarHBondContact NE-OH 3.45Å; R42-Y54 PolarHBondContact NH2-OH 2.99Å; F50-Y54 HydrophobicContact CB-CD2 4.04Å; F50-Y54 HydrophobicContact CB-CE2 3.59Å; F50-Y54 WeakPolarHBondContact O-CD2 3.29Å; F50-Y54 PolarHBondContact O-N 2.91Å; T51-Y54 PolarHBondContact O-N 3.25Å; G52-Y54 VanDerWaalsContact C-N 3.28Å; G52-Y54 PolarHBondContact O-N 3.28Å; Y54-C57 PolarHBondContact O-N 2.93Å; Y54-S58 VanDerWaalsContact O-CB 3.31Å; Y54-S58 WeakPolarHBondContact O-CB 3.42Å; Y54-S58 PolarHBondContact O-N 3.28Å; Y54-S58 PolarHBondContact O-OG 2.83Å
55V95.9Very high89.7Confident44 Ų4444 Ų4427%0.26723%0.23SC..Hα-helixtrans-66.1-48.2179.7172.40000110.7T51 G52 C57 S58 C59 C99T51-V55 HydrophobicContact CG2-CG2 4.37Å; T51-V55 VanDerWaalsContact O-CG2 3.3Å; T51-V55 WeakPolarHBondContact O-CG2 3.27Å; T51-V55 PolarHBondContact O-N 3.02Å; G52-V55 PolarHBondContact O-N 2.93Å; V55-C57 VanDerWaalsContact C-N 3.33Å; V55-C57 PolarHBondContact O-N 3.49Å; V55-S58 PolarHBondContact O-N 3.35Å; V55-C59 WeakPolarHBondContact O-CB 3.45Å; V55-C59 PolarHBondContact O-N 2.6Å; V55-C59 PolarHBondContact O-SG 3.23Å; V55-C99 HydrophobicContact CB-CB 4.48Å; V55-C99 HydrophobicContact CG1-CB 3.81Å
56I96.8Very high91.1Very high0 Ų040.4 Ų40.40%022%0.217CC..Hα-helixtrans-64.2-38.6178.1-166171.5000111.8A25 G52 S53 C59 G60 L96 V191 V194A25-I56 HydrophobicContact CB-CD1 4.47Å; A25-I56 HydrophobicContact CB-CG1 3.94Å; G52-I56 WeakPolarHBondContact O-CG2 3.32Å; G52-I56 PolarHBondContact O-N 2.99Å; S53-I56 VanDerWaalsContact O-CG2 3.31Å; S53-I56 WeakPolarHBondContact O-CG2 3.29Å; I56-C59 PolarHBondContact O-N 3.16Å; I56-G60 PolarHBondContact O-N 3.42Å; I56-L96 HydrophobicContact CG1-CD2 4.24Å; I56-V191 HydrophobicContact CB-CG1 4.18Å; I56-V191 HydrophobicContact CD1-CG1 3.96Å; I56-V191 HydrophobicContact CG2-CG1 3.82Å; I56-V194 HydrophobicContact CD1-CB 4.34Å; I56-V194 HydrophobicContact CD1-CG1 3.98Å
57C96.6Very high92.6Very high18 Ų1836.4 Ų36.412%0.12220%0.196CC..Hα-helixtrans-61.6-49.2176.1-176.10000110.5I33 S53 Y54 V55 C59 G60 I61I33-C57 HydrophobicContact CD1-CB 4.3Å; S53-C57 WeakPolarHBondContact O-CB 3.43Å; S53-C57 PolarHBondContact O-N 2.66Å; S53-C57 VanDerWaalsContact O-N 3.08Å; Y54-C57 PolarHBondContact O-N 2.93Å; V55-C57 VanDerWaalsContact C-N 3.33Å; V55-C57 PolarHBondContact O-N 3.49Å; C57-C59 PolarHBondContact O-N 2.55Å; C57-G60 WeakPolarHBondContact O-CA 3.33Å; C57-G60 PolarHBondContact O-N 2.9Å; C57-G60 VanDerWaalsContact O-N 3.13Å; C57-I61 WeakPolarHBondContact O-CG1 3.03Å; C57-I61 PolarHBondContact O-N 2.88Å
58S96.9Very high94.1Very high57 Ų5732.7 Ų32.740%0.39918%0.18SC..Hα-helixtrans-61.7-44.9178.5-59.70000111.8Y54 V55 G60 I61 F62Y54-S58 VanDerWaalsContact O-CB 3.31Å; Y54-S58 WeakPolarHBondContact O-CB 3.42Å; Y54-S58 PolarHBondContact O-N 3.28Å; Y54-S58 PolarHBondContact O-OG 2.83Å; V55-S58 PolarHBondContact O-N 3.35Å; S58-G60 VanDerWaalsContact C-N 3.31Å; S58-G60 PolarHBondContact O-N 3.45Å; S58-I61 PolarHBondContact O-N 2.9Å; S58-F62 WeakPolarHBondContact O-CD2 3.46Å; S58-F62 PolarHBondContact O-N 2.98Å
59C97.7Very high94.7Very high4 Ų436.9 Ų36.93%0.02719%0.193CC..Hα-helixtrans-60.1-41.2173.5-66.50000111.6V55 I56 C57 I61 F62 I63 C95 L96V55-C59 WeakPolarHBondContact O-CB 3.45Å; V55-C59 PolarHBondContact O-N 2.6Å; V55-C59 PolarHBondContact O-SG 3.23Å; I56-C59 PolarHBondContact O-N 3.16Å; C57-C59 PolarHBondContact O-N 2.55Å; C59-I61 VanDerWaalsContact C-N 3.33Å; C59-I61 PolarHBondContact O-N 3.02Å; C59-F62 PolarHBondContact O-N 3.23Å; C59-I63 WeakPolarHBondContact O-CB 3.46Å; C59-I63 WeakPolarHBondContact O-CG1 3.25Å; C59-I63 PolarHBondContact O-N 2.95Å; C59-C95 PolarHBondContact SG-SG 3.39Å; C59-L96 HydrophobicContact CB-CD2 3.88Å; C59-L96 HydrophobicContact CB-CG 4.26Å
60G98.1Very high95.1Very high0 Ų036.8 Ų36.80%019%0.193CC..Hα-helixtrans-55.9-45.5174.500000112.5I56 C57 S58 I63 L64I56-G60 PolarHBondContact O-N 3.42Å; C57-G60 WeakPolarHBondContact O-CA 3.33Å; C57-G60 PolarHBondContact O-N 2.9Å; C57-G60 VanDerWaalsContact O-N 3.13Å; S58-G60 VanDerWaalsContact C-N 3.31Å; S58-G60 PolarHBondContact O-N 3.45Å; G60-I63 PolarHBondContact O-N 2.83Å; G60-L64 WeakPolarHBondContact O-CG 3.4Å; G60-L64 PolarHBondContact O-N 3.18Å; G60-L64 VanDerWaalsContact O-N 3.07Å
61I98Very high95.3Very high78 Ų7840.6 Ų40.640%0.421%0.207SC..Hα-helixtrans-61.3-48.2175.3-60.8172.7000110.8L26 C57 S58 C59 I63 L64 I65L26-I61 HydrophobicContact CD1-CD1 4.16Å; L26-I61 HydrophobicContact CD1-CG1 3.45Å; L26-I61 VanDerWaalsContact CD1-CG1 3.45Å; C57-I61 WeakPolarHBondContact O-CG1 3.03Å; C57-I61 PolarHBondContact O-N 2.88Å; S58-I61 PolarHBondContact O-N 2.9Å; C59-I61 VanDerWaalsContact C-N 3.33Å; C59-I61 PolarHBondContact O-N 3.02Å; I61-I63 VanDerWaalsContact C-N 3.32Å; I61-I63 PolarHBondContact O-N 2.88Å; I61-L64 PolarHBondContact O-N 3.28Å; I61-I65 HydrophobicContact CG2-CD1 3.73Å; I61-I65 HydrophobicContact CG2-CG1 4.43Å; I61-I65 WeakPolarHBondContact O-CG1 3.44Å; I61-I65 PolarHBondContact O-N 3.12Å
62F96.8Very high95.3Very high129 Ų12940.3 Ų40.357%0.56621%0.209SC*.Hα-helixtrans-61.9-38178.6-75.6-63.4000112.6S58 C59 I65 S66S58-F62 WeakPolarHBondContact O-CD2 3.46Å; S58-F62 PolarHBondContact O-N 2.98Å; C59-F62 PolarHBondContact O-N 3.23Å; F62-I65 PolarHBondContact O-N 3.19Å; F62-S66 WeakPolarHBondContact O-CB 3.28Å; F62-S66 PolarHBondContact O-N 3.42Å; F62-S66 PolarHBondContact O-OG 3.34Å
63I97.9Very high95.2Very high0 Ų040.2 Ų40.20%021%0.208CC..Hα-helixtrans-61-47174.7-70.1164.1000110.2Y18 G22 C59 G60 I61 I65 S66 S67 L96Y18-I63 HydrophobicContact CD1-CG2 3.97Å; Y18-I63 HydrophobicContact CD2-CG2 4.17Å; Y18-I63 HydrophobicContact CE1-CB 4.33Å; Y18-I63 HydrophobicContact CE1-CG2 3.71Å; Y18-I63 HydrophobicContact CE2-CB 4.47Å; Y18-I63 HydrophobicContact CE2-CD1 4.46Å; Y18-I63 HydrophobicContact CE2-CG1 3.93Å; Y18-I63 HydrophobicContact CE2-CG2 3.92Å; Y18-I63 HydrophobicContact CG-CG2 4.2Å; Y18-I63 WeakPolarHBondContact O-CG2 3.3Å; Y18-I63 WeakPolarHBondContact OH-CG1 3.46Å; G22-I63 VanDerWaalsContact CA-CG2 3.44Å; C59-I63 WeakPolarHBondContact O-CB 3.46Å; C59-I63 WeakPolarHBondContact O-CG1 3.25Å; C59-I63 PolarHBondContact O-N 2.95Å; G60-I63 PolarHBondContact O-N 2.83Å; I61-I63 VanDerWaalsContact C-N 3.32Å; I61-I63 PolarHBondContact O-N 2.88Å; I63-I65 PolarHBondContact O-N 3.41Å; I63-S66 WeakPolarHBondContact CA-OG 3.34Å; I63-S66 PolarHBondContact O-N 2.91Å; I63-S66 PolarHBondContact O-OG 3.34Å; I63-S67 WeakPolarHBondContact O-CB 3.27Å; I63-S67 PolarHBondContact O-N 3.49Å; I63-S67 PolarHBondContact O-OG 3.1Å; I63-L96 HydrophobicContact CD1-CD1 4.32Å
64L97.5Very high95Very high39 Ų3940.5 Ų40.520%0.20421%0.21CC..Hα-helixtrans-63.3-42.1-179.9-68.8171.5000112.5W19 L26 G60 I61 P68W19-L64 HydrophobicContact CD2-CD2 4.24Å; W19-L64 HydrophobicContact CG-CD2 4.24Å; W19-L64 HydrophobicContact CZ2-CD2 4.37Å; L26-L64 HydrophobicContact CD2-CD1 3.92Å; G60-L64 WeakPolarHBondContact O-CG 3.4Å; G60-L64 PolarHBondContact O-N 3.18Å; G60-L64 VanDerWaalsContact O-N 3.07Å; I61-L64 PolarHBondContact O-N 3.28Å; L64-P68 WeakPolarHBondContact O-CD 3.45Å
65I96.4Very high94.7Very high106 Ų10643.9 Ų43.954%0.54423%0.232SC..Hα-helixtrans-71.5-37.1178.5-64.8171.6000111.4I61 F62 I63 P68 F69I61-I65 HydrophobicContact CG2-CD1 3.73Å; I61-I65 HydrophobicContact CG2-CG1 4.43Å; I61-I65 WeakPolarHBondContact O-CG1 3.44Å; I61-I65 PolarHBondContact O-N 3.12Å; F62-I65 PolarHBondContact O-N 3.19Å; I63-I65 PolarHBondContact O-N 3.41Å; I65-P68 WeakPolarHBondContact O-CD 3.36Å; I65-F69 WeakPolarHBondContact O-CD2 3.29Å; I65-F69 WeakPolarHBondContact O-CE2 3.27Å
66S95.3Very high94.4Very high6 Ų645 Ų454%0.04224%0.242CC..Hα-helixtrans-80.1-26.9-17760.90000113.8Y18 F62 I63 F69 G70 F85Y18-S66 PolarHBondContact OH-OG 3.06Å; F62-S66 WeakPolarHBondContact O-CB 3.28Å; F62-S66 PolarHBondContact O-N 3.42Å; F62-S66 PolarHBondContact O-OG 3.34Å; I63-S66 WeakPolarHBondContact CA-OG 3.34Å; I63-S66 PolarHBondContact O-N 2.91Å; I63-S66 PolarHBondContact O-OG 3.34Å; S66-F69 VanDerWaalsContact O-CB 3.3Å; S66-F69 WeakPolarHBondContact O-CB 3.12Å; S66-F69 PolarHBondContact O-N 3.49Å; S66-G70 PolarHBondContact O-N 3.27Å; S66-F85 WeakPolarHBondContact O-CD2 3.2Å; S66-F85 VanDerWaalsContact O-CE2 3.29Å; S66-F85 WeakPolarHBondContact O-CE2 3.36Å
67S95.2Very high93.8Very high0 Ų050.3 Ų50.30%026%0.262CS..Hα-helixtrans-55-42-176.3-64.50000114.5Y18 I63 F69 G70 W71Y18-S67 WeakPolarHBondContact CD1-OG 3.48Å; Y18-S67 WeakPolarHBondContact CE1-OG 3.37Å; I63-S67 WeakPolarHBondContact O-CB 3.27Å; I63-S67 PolarHBondContact O-N 3.49Å; I63-S67 PolarHBondContact O-OG 3.1Å; S67-F69 PolarHBondContact O-N 3.24Å; S67-G70 WeakPolarHBondContact O-CA 3.27Å; S67-G70 PolarHBondContact O-N 2.72Å; S67-W71 PolarHBondContact O-N 3.1Å
68P92.9Very high93.3Very high62 Ų6251.5 Ų51.540%0.40327%0.27SS..Hα-helixtrans-57.1-33.4173.5-26.635.8000114.5L64 I65 G70 W71 A72L64-P68 WeakPolarHBondContact O-CD 3.45Å; I65-P68 WeakPolarHBondContact O-CD 3.36Å; P68-G70 VanDerWaalsContact C-N 3.26Å; P68-G70 PolarHBondContact O-N 3.1Å; P68-W71 PolarHBondContact O-N 3.28Å; P68-A72 WeakPolarHBondContact O-CB 3.44Å; P68-A72 PolarHBondContact O-N 3.45Å
69F91.4Very high92.8Very high106 Ų10652.4 Ų52.447%0.46527%0.265SS..Hα-helixtrans-66.5-31.4176.1-64.6-94000111.7I65 S66 S67 A72 G73 I81 F85I65-F69 WeakPolarHBondContact O-CD2 3.29Å; I65-F69 WeakPolarHBondContact O-CE2 3.27Å; S66-F69 VanDerWaalsContact O-CB 3.3Å; S66-F69 WeakPolarHBondContact O-CB 3.12Å; S66-F69 PolarHBondContact O-N 3.49Å; S67-F69 PolarHBondContact O-N 3.24Å; F69-A72 PolarHBondContact O-N 3.43Å; F69-G73 PolarHBondContact O-N 2.96Å; F69-I81 WeakPolarHBondContact O-CG2 3.49Å; F69-F85 HydrophobicContact CB-CD2 4.36Å
70G92.6Very high92.4Very high1 Ų154.5 Ų54.51%0.0129%0.287CS..Hα-helixtrans-59.4-55.1171.800000111.5N15 S66 S67 P68 A72 G73 I74N15-G70 WeakPolarHBondContact OD1-CA 3.1Å; S66-G70 PolarHBondContact O-N 3.27Å; S67-G70 WeakPolarHBondContact O-CA 3.27Å; S67-G70 PolarHBondContact O-N 2.72Å; P68-G70 VanDerWaalsContact C-N 3.26Å; P68-G70 PolarHBondContact O-N 3.1Å; G70-A72 PolarHBondContact O-N 3.12Å; G70-G73 PolarHBondContact O-N 3.06Å; G70-I74 VanDerWaalsContact O-CD1 3.32Å; G70-I74 WeakPolarHBondContact O-CD1 3.48Å; G70-I74 VanDerWaalsContact O-CG1 3.26Å; G70-I74 WeakPolarHBondContact O-CG1 3.23Å; G70-I74 PolarHBondContact O-N 3.13Å; G70-I74 VanDerWaalsContact O-N 3.13Å
71W92.8Very high92.1Very high80 Ų8057.1 Ų57.130%0.30330%0.301SS..Hα-helixtrans-60.3-44.8175.6-65.8-51000112.3W19 S67 P68 G73 I74 L75W19-W71 HydrophobicContact CB-CH2 4.13Å; W19-W71 HydrophobicContact CG-CH2 4.21Å; S67-W71 PolarHBondContact O-N 3.1Å; P68-W71 PolarHBondContact O-N 3.28Å; W71-G73 PolarHBondContact O-N 3.42Å; W71-I74 PolarHBondContact O-N 2.56Å; W71-L75 HydrophobicContact CB-CD1 4.23Å; W71-L75 WeakPolarHBondContact O-CB 3.39Å; W71-L75 WeakPolarHBondContact O-CD1 3.28Å; W71-L75 WeakPolarHBondContact O-CG 3.49Å; W71-L75 PolarHBondContact O-N 3.07Å
72A92.2Very high91.8Very high41 Ų4153.5 Ų53.534%0.33928%0.282SS..Hα-helixtrans-60-43.6179.600000112P68 F69 G70 I74 S76 I81P68-A72 WeakPolarHBondContact O-CB 3.44Å; P68-A72 PolarHBondContact O-N 3.45Å; F69-A72 PolarHBondContact O-N 3.43Å; G70-A72 PolarHBondContact O-N 3.12Å; A72-I74 VanDerWaalsContact C-N 3.33Å; A72-I74 PolarHBondContact O-N 3.22Å; A72-S76 WeakPolarHBondContact O-CB 3.14Å; A72-S76 PolarHBondContact O-N 3.2Å; A72-S76 PolarHBondContact O-OG 3.05Å; A72-I81 HydrophobicContact CB-CG2 4.43Å
73G89.7Confident91.6Very high0 Ų051.2 Ų51.20%028%0.275CS..Hα-helixtrans-63.5-39.1177.100000112.6F69 G70 W71 R77 S78 S82F69-G73 PolarHBondContact O-N 2.96Å; G70-G73 PolarHBondContact O-N 3.06Å; W71-G73 PolarHBondContact O-N 3.42Å; G73-R77 WeakPolarHBondContact O-CA 3.34Å; G73-R77 PolarHBondContact O-N 3.1Å; G73-S78 PolarHBondContact O-N 3.01Å; G73-S82 PolarHBondContact O-OG 3.27Å
74I90.6Very high91.4Very high8 Ų853.6 Ų53.64%0.04129%0.292CS..Hα-helixtrans-67.9-50.3177.3-67.7161.5000111.6L8 L11 I12 N15 G70 W71 A72 R77L8-I74 HydrophobicContact CD1-CG2 3.07Å; L11-I74 HydrophobicContact CB-CD1 3.65Å; L11-I74 HydrophobicContact CB-CG1 4.28Å; L11-I74 HydrophobicContact CD1-CG1 4.36Å; I12-I74 HydrophobicContact CG1-CG2 4.35Å; N15-I74 WeakPolarHBondContact ND2-CD1 3.46Å; G70-I74 VanDerWaalsContact O-CD1 3.32Å; G70-I74 WeakPolarHBondContact O-CD1 3.48Å; G70-I74 VanDerWaalsContact O-CG1 3.26Å; G70-I74 WeakPolarHBondContact O-CG1 3.23Å; G70-I74 PolarHBondContact O-N 3.13Å; G70-I74 VanDerWaalsContact O-N 3.13Å; W71-I74 PolarHBondContact O-N 2.56Å; A72-I74 VanDerWaalsContact C-N 3.33Å; A72-I74 PolarHBondContact O-N 3.22Å; I74-R77 PolarHBondContact O-N 3.05Å
75L88.3Confident91.3Very high142 Ų14251.8 Ų51.874%0.74328%0.282SS*.Hα-helixtrans-68.1-44.9-176.4-76.5154000112.3W71 R77W71-L75 HydrophobicContact CB-CD1 4.23Å; W71-L75 WeakPolarHBondContact O-CB 3.39Å; W71-L75 WeakPolarHBondContact O-CD1 3.28Å; W71-L75 WeakPolarHBondContact O-CG 3.49Å; W71-L75 PolarHBondContact O-N 3.07Å; L75-R77 PolarHBondContact O-N 2.7Å
76S88.2Confident91.2Very high67 Ų6750 Ų5047%0.46927%0.269SS..Hα-helixtrans-72.6-13176.964.90000113.1A72 S78A72-S76 WeakPolarHBondContact O-CB 3.14Å; A72-S76 PolarHBondContact O-N 3.2Å; A72-S76 PolarHBondContact O-OG 3.05Å; S76-S78 PolarHBondContact O-N 3.4Å; S76-S78 WeakPolarHBondContact OG-CB 3.07Å; S76-S78 PolarHBondContact OG-N 3.27Å
77R84.3Confident91.2Very high112 Ų11253.9 Ų53.942%0.42329%0.289SS..THydrogen-bonded Turntrans51.725.5-170.4-158.9160.4176.4-175.7-8.1112.5G73 I74 L75 N216G73-R77 WeakPolarHBondContact O-CA 3.34Å; G73-R77 PolarHBondContact O-N 3.1Å; I74-R77 PolarHBondContact O-N 3.05Å; L75-R77 PolarHBondContact O-N 2.7Å; R77-N216 PolarHBondContact O-ND2 3.45Å
78S86.7Confident91.3Very high43 Ų4356.4 Ų56.430%0.30130%0.301SS..  trans-79.5120.2-178178.80000111G73 S76 G80 S82G73-S78 PolarHBondContact O-N 3.01Å; S76-S78 PolarHBondContact O-N 3.4Å; S76-S78 WeakPolarHBondContact OG-CB 3.07Å; S76-S78 PolarHBondContact OG-N 3.27Å; S78-G80 VanDerWaalsContact C-N 3.33Å; S78-G80 PolarHBondContact O-N 3.33Å; S78-S82 PolarHBondContact O-N 3.49Å; S78-S82 PolarHBondContact O-OG 3.37Å
79R85.3Confident91.4Very high77 Ų7753.4 Ų53.429%0.29128%0.282SS..Hα-helixtrans-57.9-44.7177.6-70.4-167.6-66.1-176.7-9.1112I81 S82 I83 N216 Q220R79-I81 PolarHBondContact O-N 3Å; R79-S82 PolarHBondContact O-N 2.86Å; R79-I83 WeakPolarHBondContact O-CB 3.46Å; R79-I83 WeakPolarHBondContact O-CD1 3.31Å; R79-I83 VanDerWaalsContact O-CG1 3.23Å; R79-I83 WeakPolarHBondContact O-CG1 3.48Å; R79-I83 PolarHBondContact O-N 3.23Å; R79-N216 HydrophobicContact CG-CB 4.42Å; R79-N216 WeakPolarHBondContact CG-ND2 3.3Å; R79-Q220 VanDerWaalsContact NE-CD 3.25Å
80G90.3Very high91.7Very high48 Ų4850.5 Ų50.550%0.49527%0.273SS..Hα-helixtrans-61.2-47.7-17600000112.6S78 I83 S84S78-G80 VanDerWaalsContact C-N 3.33Å; S78-G80 PolarHBondContact O-N 3.33Å; G80-I83 PolarHBondContact O-N 3.21Å; G80-S84 PolarHBondContact O-N 3.33Å; G80-S84 PolarHBondContact O-OG 3.45Å
81I92Very high91.9Very high55 Ų5555.7 Ų55.728%0.28230%0.3SS..Hα-helixtrans-67.6-40.5-177.9-57.4175.2000111F69 A72 R79 S84 F85F69-I81 WeakPolarHBondContact O-CG2 3.49Å; A72-I81 HydrophobicContact CB-CG2 4.43Å; R79-I81 PolarHBondContact O-N 3Å; I81-S84 WeakPolarHBondContact CA-OG 3.4Å; I81-S84 PolarHBondContact O-N 2.52Å; I81-S84 PolarHBondContact O-OG 2.88Å; I81-F85 PolarHBondContact O-N 3.31Å
82S90.7Very high92.1Very high1 Ų152.4 Ų52.41%0.00729%0.288CS..Hα-helixtrans-66.7-38.1176.3-63.50000112.8G73 S78 R79 F85 Y86G73-S82 PolarHBondContact O-OG 3.27Å; S78-S82 PolarHBondContact O-N 3.49Å; S78-S82 PolarHBondContact O-OG 3.37Å; R79-S82 PolarHBondContact O-N 2.86Å; S82-F85 PolarHBondContact O-N 3.44Å; S82-Y86 WeakPolarHBondContact O-CB 3.3Å; S82-Y86 PolarHBondContact O-N 3.16Å
83I93.2Very high92.3Very high81 Ų8150.8 Ų50.842%0.41528%0.275SS..Hα-helixtrans-67.4-42.8176-69.8167.1000110.6R79 G80 F85 Y86 I87 T213R79-I83 WeakPolarHBondContact O-CB 3.46Å; R79-I83 WeakPolarHBondContact O-CD1 3.31Å; R79-I83 VanDerWaalsContact O-CG1 3.23Å; R79-I83 WeakPolarHBondContact O-CG1 3.48Å; R79-I83 PolarHBondContact O-N 3.23Å; G80-I83 PolarHBondContact O-N 3.21Å; I83-F85 VanDerWaalsContact C-N 3.32Å; I83-F85 PolarHBondContact O-N 2.87Å; I83-Y86 WeakPolarHBondContact O-CB 3.47Å; I83-Y86 PolarHBondContact O-N 2.98Å; I83-I87 HydrophobicContact CG2-CD1 4.02Å; I83-I87 WeakPolarHBondContact O-CG1 3.34Å; I83-I87 PolarHBondContact O-N 2.77Å; I83-T213 HydrophobicContact CG1-CG2 4.13Å
84S93.8Very high92.7Very high51 Ų5156 Ų5636%0.35730%0.302SS..Hα-helixtrans-61.2-42.2176.254.80000111.9G80 I81 I87 I88G80-S84 PolarHBondContact O-N 3.33Å; G80-S84 PolarHBondContact O-OG 3.45Å; I81-S84 WeakPolarHBondContact CA-OG 3.4Å; I81-S84 PolarHBondContact O-N 2.52Å; I81-S84 PolarHBondContact O-OG 2.88Å; S84-I87 PolarHBondContact O-N 2.82Å; S84-I88 VanDerWaalsContact O-CG1 3.3Å; S84-I88 WeakPolarHBondContact O-CG1 3.37Å; S84-I88 PolarHBondContact O-N 3.18Å
85F95.1Very high93Very high0 Ų058.2 Ų58.20%032%0.318CS..Hα-helixtrans-65.9-39.5176.4-175.9-103.4000112.3N15 Y18 S66 F69 I81 S82 I83 I87 I88 L89 Y209N15-F85 VanDerWaalsContact OD1-CE1 3.24Å; N15-F85 WeakPolarHBondContact OD1-CE1 3.18Å; N15-F85 VanDerWaalsContact OD1-CZ 3.27Å; N15-F85 WeakPolarHBondContact OD1-CZ 3.46Å; Y18-F85 HydrophobicContact CD1-CE2 4.21Å; Y18-F85 AromaticContact CD1-CZ 3.73Å; Y18-F85 HydrophobicContact CD1-CZ 3.73Å; Y18-F85 AromaticContact CE1-CE2 3.74Å; Y18-F85 HydrophobicContact CE1-CE2 3.74Å; Y18-F85 AromaticContact CE1-CZ 3.63Å; Y18-F85 HydrophobicContact CE1-CZ 3.63Å; S66-F85 WeakPolarHBondContact O-CD2 3.2Å; S66-F85 VanDerWaalsContact O-CE2 3.29Å; S66-F85 WeakPolarHBondContact O-CE2 3.36Å; F69-F85 HydrophobicContact CB-CD2 4.36Å; I81-F85 PolarHBondContact O-N 3.31Å; S82-F85 PolarHBondContact O-N 3.44Å; I83-F85 VanDerWaalsContact C-N 3.32Å; I83-F85 PolarHBondContact O-N 2.87Å; F85-I87 VanDerWaalsContact C-N 3.35Å; F85-I87 PolarHBondContact O-N 2.92Å; F85-I88 PolarHBondContact O-N 2.99Å; F85-L89 HydrophobicContact CD1-CD1 3.9Å; F85-L89 HydrophobicContact CD1-CG 4.12Å; F85-L89 HydrophobicContact CE1-CD1 3.52Å; F85-L89 HydrophobicContact CE1-CD2 4.05Å; F85-L89 HydrophobicContact CE1-CG 3.71Å; F85-L89 HydrophobicContact CZ-CD1 4.28Å; F85-L89 HydrophobicContact CZ-CD2 3.97Å; F85-L89 HydrophobicContact CZ-CG 4.03Å; F85-L89 PolarHBondContact O-N 3.47Å; F85-Y209 HydrophobicContact CD1-CD1 4.42Å; F85-Y209 AromaticContact CD1-CE1 3.69Å; F85-Y209 HydrophobicContact CD1-CE1 3.69Å; F85-Y209 AromaticContact CD1-CE2 3.81Å; F85-Y209 HydrophobicContact CD1-CE2 3.81Å; F85-Y209 AromaticContact CD1-CZ 3.31Å; F85-Y209 WeakPolarHBondContact CD1-OH 3.28Å; F85-Y209 HydrophobicContact CE1-CD2 4.42Å; F85-Y209 HydrophobicContact CE1-CE1 4.21Å; F85-Y209 AromaticContact CE1-CE2 3.5Å; F85-Y209 HydrophobicContact CE1-CE2 3.5Å; F85-Y209 VanDerWaalsContact CE1-CE2 3.5Å; F85-Y209 AromaticContact CE1-CZ 3.35Å; F85-Y209 WeakPolarHBondContact CE1-OH 3.47Å
86Y94.8Very high93.4Very high69 Ų6951.4 Ų51.427%0.27128%0.282SS..Hα-helixtrans-58.1-44.7173.5171.2-94.7000112.3S82 I83 I88 L89 V90 I206S82-Y86 WeakPolarHBondContact O-CB 3.3Å; S82-Y86 PolarHBondContact O-N 3.16Å; I83-Y86 WeakPolarHBondContact O-CB 3.47Å; I83-Y86 PolarHBondContact O-N 2.98Å; Y86-I88 VanDerWaalsContact C-N 3.34Å; Y86-I88 PolarHBondContact O-N 3.29Å; Y86-L89 WeakPolarHBondContact O-CB 3.32Å; Y86-L89 PolarHBondContact O-N 3.48Å; Y86-V90 HydrophobicContact CE1-CG2 4.13Å; Y86-V90 HydrophobicContact CE2-CG2 4.45Å; Y86-V90 WeakPolarHBondContact O-CG2 3.45Å; Y86-V90 PolarHBondContact O-N 3.01Å; Y86-V90 VanDerWaalsContact O-N 3.08Å; Y86-I206 HydrophobicContact CE2-CB 4.29Å; Y86-I206 HydrophobicContact CE2-CG2 3.57Å; Y86-I206 WeakPolarHBondContact CE2-O 3.31Å
87I96.2Very high93.8Very high87 Ų8751.9 Ų51.945%0.44628%0.279SS..Hα-helixtrans-62.4-43.2176.4-66166000110.5I83 S84 F85 L89 V90 L91I83-I87 HydrophobicContact CG2-CD1 4.02Å; I83-I87 WeakPolarHBondContact O-CG1 3.34Å; I83-I87 PolarHBondContact O-N 2.77Å; S84-I87 PolarHBondContact O-N 2.82Å; F85-I87 VanDerWaalsContact C-N 3.35Å; F85-I87 PolarHBondContact O-N 2.92Å; I87-L89 VanDerWaalsContact C-N 3.33Å; I87-L89 PolarHBondContact O-N 3.17Å; I87-V90 PolarHBondContact O-N 3.45Å; I87-L91 HydrophobicContact CG2-CD1 3.99Å; I87-L91 HydrophobicContact CG2-CG 4.35Å; I87-L91 WeakPolarHBondContact O-CG 3.11Å; I87-L91 PolarHBondContact O-N 3.4Å
88I95.9Very high94.4Very high53 Ų5348.3 Ų48.327%0.27228%0.277SS..Hα-helixtrans-61.1-40.8176.9-67.8165.7000111.4S84 F85 Y86 L91 N92S84-I88 VanDerWaalsContact O-CG1 3.3Å; S84-I88 WeakPolarHBondContact O-CG1 3.37Å; S84-I88 PolarHBondContact O-N 3.18Å; F85-I88 PolarHBondContact O-N 2.99Å; Y86-I88 VanDerWaalsContact C-N 3.34Å; Y86-I88 PolarHBondContact O-N 3.29Å; I88-L91 PolarHBondContact O-N 2.68Å; I88-N92 VanDerWaalsContact CG2-ND2 3.29Å; I88-N92 WeakPolarHBondContact CG2-ND2 3.32Å; I88-N92 WeakPolarHBondContact O-CB 3.31Å; I88-N92 PolarHBondContact O-N 2.76Å; I88-N92 PolarHBondContact O-ND2 3.03Å
89L96.1Very high94.8Very high0 Ų046.6 Ų46.60%027%0.265CS..Hα-helixtrans-60.2-45.5174.9-76.7176.2000111.7F14 Y18 F85 Y86 I87 G93 I206 Y209F14-L89 HydrophobicContact CE1-CD1 4.17Å; F14-L89 HydrophobicContact CE1-CD2 4.3Å; F14-L89 HydrophobicContact CZ-CD2 4.41Å; Y18-L89 HydrophobicContact CD2-CD2 3.83Å; Y18-L89 HydrophobicContact CE1-CD2 4.13Å; Y18-L89 HydrophobicContact CE2-CD2 3.35Å; Y18-L89 HydrophobicContact CG-CD2 4.38Å; F85-L89 HydrophobicContact CD1-CD1 3.9Å; F85-L89 HydrophobicContact CD1-CG 4.12Å; F85-L89 HydrophobicContact CE1-CD1 3.52Å; F85-L89 HydrophobicContact CE1-CD2 4.05Å; F85-L89 HydrophobicContact CE1-CG 3.71Å; F85-L89 HydrophobicContact CZ-CD1 4.28Å; F85-L89 HydrophobicContact CZ-CD2 3.97Å; F85-L89 HydrophobicContact CZ-CG 4.03Å; F85-L89 PolarHBondContact O-N 3.47Å; Y86-L89 WeakPolarHBondContact O-CB 3.32Å; Y86-L89 PolarHBondContact O-N 3.48Å; I87-L89 VanDerWaalsContact C-N 3.33Å; I87-L89 PolarHBondContact O-N 3.17Å; L89-G93 PolarHBondContact O-N 2.88Å; L89-I206 HydrophobicContact CB-CG1 4.16Å; L89-Y209 HydrophobicContact CD1-CD2 3.61Å; L89-Y209 HydrophobicContact CD1-CE2 3.82Å; L89-Y209 HydrophobicContact CD1-CG 4.3Å
90V97Very high95.3Very high44 Ų4443 Ų4327%0.26725%0.251SS..Hα-helixtrans-62.2-47.1178.3172.60000110.9Y86 I87 G93 I94 I206Y86-V90 HydrophobicContact CE1-CG2 4.13Å; Y86-V90 HydrophobicContact CE2-CG2 4.45Å; Y86-V90 WeakPolarHBondContact O-CG2 3.45Å; Y86-V90 PolarHBondContact O-N 3.01Å; Y86-V90 VanDerWaalsContact O-N 3.08Å; I87-V90 PolarHBondContact O-N 3.45Å; V90-G93 PolarHBondContact O-N 3.02Å; V90-I94 HydrophobicContact CG1-CD1 3.85Å; V90-I94 VanDerWaalsContact O-CG1 3.32Å; V90-I94 WeakPolarHBondContact O-CG1 3.28Å; V90-I94 PolarHBondContact O-N 2.97Å; V90-I206 HydrophobicContact CB-CD1 4.47Å; V90-I206 HydrophobicContact CG2-CD1 3.83Å; V90-I206 HydrophobicContact CG2-CG1 4.01Å; V90-I206 HydrophobicContact CG2-CG2 4.27Å
91L97.3Very high95.5Very high110 Ų11045.2 Ų45.258%0.57625%0.251SS*.Hα-helixtrans-64.2-44.4-179.9-68.6175.6000112.4I87 I88 G93 I94 C95I87-L91 HydrophobicContact CG2-CD1 3.99Å; I87-L91 HydrophobicContact CG2-CG 4.35Å; I87-L91 WeakPolarHBondContact O-CG 3.11Å; I87-L91 PolarHBondContact O-N 3.4Å; I88-L91 PolarHBondContact O-N 2.68Å; L91-G93 VanDerWaalsContact C-N 3.31Å; L91-G93 PolarHBondContact O-N 3.38Å; L91-I94 PolarHBondContact O-N 3.32Å; L91-C95 WeakPolarHBondContact O-CB 3.32Å; L91-C95 PolarHBondContact O-N 3.12Å
92N96.5Very high95.5Very high12 Ų1249.1 Ų49.16%0.06426%0.262CS..Hα-helixtrans-63.7-38.7175.1-82.5-82.3000111.5I88 C95 L96I88-N92 VanDerWaalsContact CG2-ND2 3.29Å; I88-N92 WeakPolarHBondContact CG2-ND2 3.32Å; I88-N92 WeakPolarHBondContact O-CB 3.31Å; I88-N92 PolarHBondContact O-N 2.76Å; I88-N92 PolarHBondContact O-ND2 3.03Å; N92-C95 PolarHBondContact O-N 3.26Å; N92-L96 WeakPolarHBondContact O-CB 3.33Å; N92-L96 WeakPolarHBondContact O-CG 3.47Å; N92-L96 PolarHBondContact O-N 3.43Å
93G96.7Very high95.6Very high6 Ų649.3 Ų49.36%0.06226%0.263CS..Hα-helixtrans-63.6-46.2178.500000112.1L89 V90 L91 C95 L96 L97L89-G93 PolarHBondContact O-N 2.88Å; V90-G93 PolarHBondContact O-N 3.02Å; L91-G93 VanDerWaalsContact C-N 3.31Å; L91-G93 PolarHBondContact O-N 3.38Å; G93-C95 VanDerWaalsContact C-N 3.33Å; G93-C95 PolarHBondContact O-N 3.45Å; G93-L96 PolarHBondContact O-N 3.36Å; G93-L97 WeakPolarHBondContact O-CB 3.21Å; G93-L97 WeakPolarHBondContact O-CG 3.42Å; G93-L97 PolarHBondContact O-N 2.94Å
94I97.3Very high95.4Very high110 Ų11048.3 Ų48.356%0.56426%0.264SS*.Hα-helixtrans-61.6-43.5175-66.2166.9000110.6V90 L91 L97 G98V90-I94 HydrophobicContact CG1-CD1 3.85Å; V90-I94 VanDerWaalsContact O-CG1 3.32Å; V90-I94 WeakPolarHBondContact O-CG1 3.28Å; V90-I94 PolarHBondContact O-N 2.97Å; L91-I94 PolarHBondContact O-N 3.32Å; I94-L97 PolarHBondContact O-N 3.32Å; I94-G98 PolarHBondContact O-N 3.18Å
95C97.1Very high95.2Very high54 Ų5453 Ų5337%0.36528%0.278SS..Hα-helixtrans-61.9-45.2179-166.20000112C59 L91 N92 G93 G98 C99C59-C95 PolarHBondContact SG-SG 3.39Å; L91-C95 WeakPolarHBondContact O-CB 3.32Å; L91-C95 PolarHBondContact O-N 3.12Å; N92-C95 PolarHBondContact O-N 3.26Å; G93-C95 VanDerWaalsContact C-N 3.33Å; G93-C95 PolarHBondContact O-N 3.45Å; C95-G98 PolarHBondContact O-N 3.42Å; C95-C99 WeakPolarHBondContact O-CB 3.43Å; C95-C99 PolarHBondContact O-N 2.78Å
96L97.3Very high94.9Very high0 Ų053.7 Ų53.70%028%0.28CS..Hα-helixtrans-69.2-39.6179-73.3171.2000112.7I56 C59 I63 N92 G93 C99 G100 I198 A199I56-L96 HydrophobicContact CG1-CD2 4.24Å; C59-L96 HydrophobicContact CB-CD2 3.88Å; C59-L96 HydrophobicContact CB-CG 4.26Å; I63-L96 HydrophobicContact CD1-CD1 4.32Å; N92-L96 WeakPolarHBondContact O-CB 3.33Å; N92-L96 WeakPolarHBondContact O-CG 3.47Å; N92-L96 PolarHBondContact O-N 3.43Å; G93-L96 PolarHBondContact O-N 3.36Å; L96-C99 WeakPolarHBondContact O-CB 3.41Å; L96-C99 PolarHBondContact O-N 3.2Å; L96-G100 PolarHBondContact O-N 3.49Å; L96-I198 HydrophobicContact CD1-CB 4.05Å; L96-I198 HydrophobicContact CD1-CG2 3.47Å; L96-I198 VanDerWaalsContact CD1-CG2 3.47Å; L96-A199 HydrophobicContact CB-CB 4.15Å
97L96.9Very high94.2Very high76 Ų7652.1 Ų52.140%0.39828%0.28SS..Hα-helixtrans-61.5-45.9171.4-72.1175000111.2G93 I94 C99 G100 I101 A199G93-L97 WeakPolarHBondContact O-CB 3.21Å; G93-L97 WeakPolarHBondContact O-CG 3.42Å; G93-L97 PolarHBondContact O-N 2.94Å; I94-L97 PolarHBondContact O-N 3.32Å; L97-C99 VanDerWaalsContact C-N 3.32Å; L97-C99 PolarHBondContact O-N 3.37Å; L97-G100 PolarHBondContact O-N 2.85Å; L97-I101 VanDerWaalsContact O-CG1 3.28Å; L97-I101 WeakPolarHBondContact O-CG1 3.36Å; L97-I101 PolarHBondContact O-N 3.11Å; L97-A199 HydrophobicContact CD1-CB 4.44Å; L97-A199 HydrophobicContact CD2-CB 3.39Å; L97-A199 HydrophobicContact CG-CB 3.5Å; L97-A199 VanDerWaalsContact CG-CB 3.5Å
98G95.9Very high93.6Very high38 Ų3855 Ų5539%0.39229%0.291SS..Hα-helixtrans-58.5-43.9176.200000112I94 C95 I101 W102I94-G98 PolarHBondContact O-N 3.18Å; C95-G98 PolarHBondContact O-N 3.42Å; G98-I101 PolarHBondContact O-N 2.95Å; G98-W102 VanDerWaalsContact O-CB 3.27Å; G98-W102 WeakPolarHBondContact O-CB 3.29Å; G98-W102 PolarHBondContact O-N 3.06Å
99C95.5Very high93.2Very high7 Ų756.5 Ų56.55%0.04730%0.3CS..Hα-helixtrans-58.7-50.1174.2-172.80000111.6G52 V55 C95 L96 L97 I101 W102 L103G52-C99 PolarHBondContact O-SG 3.43Å; V55-C99 HydrophobicContact CB-CB 4.48Å; V55-C99 HydrophobicContact CG1-CB 3.81Å; C95-C99 WeakPolarHBondContact O-CB 3.43Å; C95-C99 PolarHBondContact O-N 2.78Å; L96-C99 WeakPolarHBondContact O-CB 3.41Å; L96-C99 PolarHBondContact O-N 3.2Å; L97-C99 VanDerWaalsContact C-N 3.32Å; L97-C99 PolarHBondContact O-N 3.37Å; C99-I101 PolarHBondContact O-N 3.36Å; C99-W102 PolarHBondContact O-N 3.47Å; C99-L103 WeakPolarHBondContact O-CD1 3.28Å; C99-L103 PolarHBondContact O-N 2.94Å
100G95.2Very high92.8Very high0 Ų056.5 Ų56.50%030%0.3CS..Hα-helixtrans-60.1-42178.700000113.7L96 L97 S104 S195L96-G100 PolarHBondContact O-N 3.49Å; L97-G100 PolarHBondContact O-N 2.85Å; G100-S104 WeakPolarHBondContact O-CB 3.41Å; G100-S104 PolarHBondContact O-N 3Å; G100-S104 PolarHBondContact O-OG 2.79Å; G100-S195 WeakPolarHBondContact CA-OG 3.41Å; G100-S195 PolarHBondContact N-OG 3.36Å
101I94.2Very high92.4Very high96 Ų9660 Ų6049%0.49231%0.309SS..Hα-helixtrans-67.7-44.5176.8-65164.7000110.9L97 G98 C99 L103 S104 K105L97-I101 VanDerWaalsContact O-CG1 3.28Å; L97-I101 WeakPolarHBondContact O-CG1 3.36Å; L97-I101 PolarHBondContact O-N 3.11Å; G98-I101 PolarHBondContact O-N 2.95Å; C99-I101 PolarHBondContact O-N 3.36Å; I101-L103 VanDerWaalsContact C-N 3.34Å; I101-L103 PolarHBondContact O-N 3.41Å; I101-S104 PolarHBondContact O-N 3.48Å; I101-K105 PolarHBondContact O-N 3.4Å; I101-K105 VanDerWaalsContact O-N 3.12Å
102W92.8Very high92Very high136 Ų13659.7 Ų59.752%0.51531%0.307SS..Hα-helixtrans-56.9-48.5178.6-179.6-91.6000111.1G98 C99 S104 K105 Y106G98-W102 VanDerWaalsContact O-CB 3.27Å; G98-W102 WeakPolarHBondContact O-CB 3.29Å; G98-W102 PolarHBondContact O-N 3.06Å; C99-W102 PolarHBondContact O-N 3.47Å; W102-S104 VanDerWaalsContact C-N 3.31Å; W102-S104 PolarHBondContact O-N 3.44Å; W102-K105 PolarHBondContact O-N 3.16Å; W102-Y106 HydrophobicContact CZ2-CD2 4.27Å; W102-Y106 AromaticContact NE1-CD2 3.91Å; W102-Y106 VanDerWaalsContact O-CB 3.25Å; W102-Y106 WeakPolarHBondContact O-CB 3.09Å; W102-Y106 PolarHBondContact O-N 3.5Å
103L92.5Very high91.6Very high5 Ų562.6 Ų62.63%0.02632%0.32CS..Hα-helixtrans-65.8-38-177.2-92.768.5000111.8C99 I101 Y106 S107 Q188 V191 A192C99-L103 WeakPolarHBondContact O-CD1 3.28Å; C99-L103 PolarHBondContact O-N 2.94Å; I101-L103 VanDerWaalsContact C-N 3.34Å; I101-L103 PolarHBondContact O-N 3.41Å; L103-Y106 PolarHBondContact O-N 3.08Å; L103-S107 PolarHBondContact O-N 2.92Å; L103-Q188 HydrophobicContact CD2-CB 4.31Å; L103-Q188 WeakPolarHBondContact CD2-O 3.34Å; L103-V191 HydrophobicContact CD2-CB 3.49Å; L103-V191 VanDerWaalsContact CD2-CB 3.49Å; L103-V191 HydrophobicContact CD2-CG1 3.43Å; L103-V191 VanDerWaalsContact CD2-CG1 3.43Å; L103-A192 HydrophobicContact CB-CB 3.92Å; L103-A192 HydrophobicContact CD2-CB 4.42Å
104S89.5Confident91.3Very high61 Ų6162.3 Ų62.343%0.42732%0.317SS..Hα-helixtrans-62.8-43.9178.1-60.40000111.3G100 I101 W102 S107G100-S104 WeakPolarHBondContact O-CB 3.41Å; G100-S104 PolarHBondContact O-N 3Å; G100-S104 PolarHBondContact O-OG 2.79Å; I101-S104 PolarHBondContact O-N 3.48Å; W102-S104 VanDerWaalsContact C-N 3.31Å; W102-S104 PolarHBondContact O-N 3.44Å; S104-S107 WeakPolarHBondContact O-CB 3.38Å; S104-S107 PolarHBondContact O-OG 3.5Å
105K89.8Confident91Very high149 Ų14958.7 Ų58.765%0.64830%0.299SS*.Hα-helixtrans-72.4-39.3176.2-69.6-172.9176.5-171.70112.9I101 W102 S107 E108I101-K105 PolarHBondContact O-N 3.4Å; I101-K105 VanDerWaalsContact O-N 3.12Å; W102-K105 PolarHBondContact O-N 3.16Å; K105-S107 PolarHBondContact O-N 3.45Å; K105-E108 PolarHBondContact O-N 2.94Å
106Y88.3Confident90.7Very high15 Ų1561.7 Ų61.76%0.05931%0.308CS..Hα-helixtrans-62.6-25.7-178.7-162.2-89.2000112.1G48 L49 W102 L103 E108 N109 I110 E113G48-Y106 WeakPolarHBondContact CA-OH 3.31Å; L49-Y106 HydrophobicContact CD2-CE1 3.89Å; L49-Y106 HydrophobicContact CG-CE1 4.23Å; L49-Y106 PolarHBondContact N-OH 2.88Å; L49-Y106 VanDerWaalsContact N-OH 3.16Å; W102-Y106 HydrophobicContact CZ2-CD2 4.27Å; W102-Y106 AromaticContact NE1-CD2 3.91Å; W102-Y106 VanDerWaalsContact O-CB 3.25Å; W102-Y106 WeakPolarHBondContact O-CB 3.09Å; W102-Y106 PolarHBondContact O-N 3.5Å; L103-Y106 PolarHBondContact O-N 3.08Å; Y106-E108 PolarHBondContact O-N 3.35Å; Y106-N109 PolarHBondContact O-N 2.93Å; Y106-I110 HydrophobicContact CD1-CD1 3.98Å; Y106-I110 HydrophobicContact CD1-CG1 3.57Å; Y106-I110 HydrophobicContact CE1-CD1 4.43Å; Y106-I110 HydrophobicContact CE1-CG1 3.64Å; Y106-I110 WeakPolarHBondContact O-CG1 3.48Å; Y106-I110 PolarHBondContact O-N 3.46Å; Y106-I110 VanDerWaalsContact O-N 3.08Å; Y106-E113 PolarHBondContact OH-OE1 2.96Å; Y106-E113 PolarHBondContact OH-OE2 3.33Å
107S81.1Confident90.2Very high36 Ų3661.8 Ų61.825%0.25231%0.308SS..Hα-helixtrans-52.9-27.5174.780.20000114.7L103 S104 K105 K185L103-S107 PolarHBondContact O-N 2.92Å; S104-S107 WeakPolarHBondContact O-CB 3.38Å; S104-S107 PolarHBondContact O-OG 3.5Å; K105-S107 PolarHBondContact O-N 3.45Å; S107-K185 WeakPolarHBondContact O-CE 3.48Å; S107-K185 PolarHBondContact O-NZ 3.44Å
108E83.5Confident89.9Confident147 Ų14758.2 Ų58.269%0.68729%0.289SS*.Hα-helixtrans-78.4-43.6175.5-65.2177-165.800111.7K105 Y106 I110 Y111K105-E108 PolarHBondContact O-N 2.94Å; Y106-E108 PolarHBondContact O-N 3.35Å; E108-I110 VanDerWaalsContact C-N 3.3Å; E108-I110 PolarHBondContact O-N 3.5Å; E108-Y111 PolarHBondContact O-N 2.9Å
109N87.1Confident89.6Confident85 Ų8559.7 Ų59.746%0.45529%0.288SS..Hα-helixtrans-70-24.2-178.4-73.3-0.3000113.7Y106 Y111 I112 E113Y106-N109 PolarHBondContact O-N 2.93Å; N109-Y111 PolarHBondContact O-N 2.82Å; N109-Y111 VanDerWaalsContact O-N 3.15Å; N109-I112 PolarHBondContact O-N 2.91Å; N109-E113 PolarHBondContact O-N 3.35Å
110I87.6Confident89.3Confident0 Ų062.2 Ų62.20%030%0.301CS..Hα-helixtrans-53.3-36.4176.9-73.2164.2000112.3L49 Y106 E108 I112 L114 I181 T184 K185 Q188L49-I110 HydrophobicContact CD2-CD1 4.37Å; L49-I110 HydrophobicContact CD2-CG1 3.76Å; L49-I110 HydrophobicContact CD2-CG2 4.35Å; Y106-I110 HydrophobicContact CD1-CD1 3.98Å; Y106-I110 HydrophobicContact CD1-CG1 3.57Å; Y106-I110 HydrophobicContact CE1-CD1 4.43Å; Y106-I110 HydrophobicContact CE1-CG1 3.64Å; Y106-I110 WeakPolarHBondContact O-CG1 3.48Å; Y106-I110 PolarHBondContact O-N 3.46Å; Y106-I110 VanDerWaalsContact O-N 3.08Å; E108-I110 VanDerWaalsContact C-N 3.3Å; E108-I110 PolarHBondContact O-N 3.5Å; I110-I112 VanDerWaalsContact C-N 3.3Å; I110-I112 PolarHBondContact O-N 2.92Å; I110-L114 HydrophobicContact CG2-CD1 3.5Å; I110-L114 HydrophobicContact CG2-CG 3.92Å; I110-L114 WeakPolarHBondContact O-CB 3.2Å; I110-L114 VanDerWaalsContact O-CG 3.29Å; I110-L114 WeakPolarHBondContact O-CG 3.48Å; I110-L114 PolarHBondContact O-N 3.39Å; I110-I181 HydrophobicContact CG2-CG1 4.34Å; I110-I181 HydrophobicContact CG2-CG2 4.47Å; I110-T184 HydrophobicContact CD1-CG2 4.16Å; I110-T184 HydrophobicContact CG2-CG2 4.41Å; I110-K185 HydrophobicContact CD1-CG 4.42Å; I110-Q188 VanDerWaalsContact CD1-CD 3.44Å
111Y88.2Confident88.9Confident117 Ų11762.3 Ų62.346%0.45930%0.302SS..Hα-helixtrans-59.4-46178.8178.4-88.8000110.7E108 N109 N115 L177 I181E108-Y111 PolarHBondContact O-N 2.9Å; N109-Y111 PolarHBondContact O-N 2.82Å; N109-Y111 VanDerWaalsContact O-N 3.15Å; Y111-N115 HydrophobicContact CD1-CB 4.5Å; Y111-N115 HydrophobicContact CE1-CB 4.28Å; Y111-N115 WeakPolarHBondContact O-CB 3.43Å; Y111-N115 PolarHBondContact O-N 3.47Å; Y111-L177 HydrophobicContact CE2-CD2 4.27Å; Y111-I181 HydrophobicContact CD2-CD1 3.57Å; Y111-I181 HydrophobicContact CE2-CD1 4.21Å; Y111-I181 HydrophobicContact CG-CD1 4.37Å
112I89.8Confident88.5Confident103 Ų10358.5 Ų58.553%0.52828%0.282SS..Hα-helixtrans-64.7-49.4-175.8-60.1172.9000110.2N109 I110 N115 E116N109-I112 PolarHBondContact O-N 2.91Å; I110-I112 VanDerWaalsContact C-N 3.3Å; I110-I112 PolarHBondContact O-N 2.92Å; I112-N115 PolarHBondContact O-N 3.47Å; I112-E116 WeakPolarHBondContact O-CB 3.31Å; I112-E116 PolarHBondContact O-N 2.87Å
113E87.4Confident88.2Confident74 Ų7459.5 Ų59.535%0.34629%0.29SS..Hα-helixtrans-66.3-44.8-177.7-67-178.1174.300112.6Y106 N109 N115 M117Y106-E113 PolarHBondContact OH-OE1 2.96Å; Y106-E113 PolarHBondContact OH-OE2 3.33Å; N109-E113 PolarHBondContact O-N 3.35Å; E113-N115 VanDerWaalsContact C-N 3.32Å; E113-M117 WeakPolarHBondContact O-CB 3.27Å; E113-M117 PolarHBondContact O-N 3.29Å
114L89.6Confident87.8Confident0 Ų062.5 Ų62.50%031%0.306CS..Hα-helixtrans-66.8-38.9176.8-64.1-174.3000110.2L41 L49 I110 M117 F118 L177 V180 I181L41-L114 HydrophobicContact CD1-CD2 4.08Å; L49-L114 HydrophobicContact CD1-CD2 4.18Å; I110-L114 HydrophobicContact CG2-CD1 3.5Å; I110-L114 HydrophobicContact CG2-CG 3.92Å; I110-L114 WeakPolarHBondContact O-CB 3.2Å; I110-L114 VanDerWaalsContact O-CG 3.29Å; I110-L114 WeakPolarHBondContact O-CG 3.48Å; I110-L114 PolarHBondContact O-N 3.39Å; L114-M117 HydrophobicContact CB-CE 4.31Å; L114-M117 HydrophobicContact CD2-CE 3.05Å; L114-M117 HydrophobicContact CG-CE 4.23Å; L114-M117 WeakPolarHBondContact O-CB 3.27Å; L114-M117 PolarHBondContact O-N 2.95Å; L114-F118 VanDerWaalsContact O-CD2 3.23Å; L114-F118 WeakPolarHBondContact O-CD2 3.47Å; L114-F118 PolarHBondContact O-N 3.03Å; L114-L177 HydrophobicContact CB-CD1 3.72Å; L114-V180 HydrophobicContact CD1-CG1 3.89Å; L114-V180 HydrophobicContact CD2-CG1 4.43Å; L114-I181 HydrophobicContact CB-CG1 4.2Å; L114-I181 HydrophobicContact CD1-CB 4.25Å; L114-I181 HydrophobicContact CD1-CG1 3.46Å; L114-I181 VanDerWaalsContact CD1-CG1 3.46Å; L114-I181 HydrophobicContact CG-CG1 4.38Å
115N91.2Very high87.4Confident34 Ų3460.1 Ų60.118%0.18229%0.288CS..Hα-helixtrans-61-47.4177.8-177.878.4000111.8Y111 I112 E113 F118 D119 K151 L177Y111-N115 HydrophobicContact CD1-CB 4.5Å; Y111-N115 HydrophobicContact CE1-CB 4.28Å; Y111-N115 WeakPolarHBondContact O-CB 3.43Å; Y111-N115 PolarHBondContact O-N 3.47Å; I112-N115 PolarHBondContact O-N 3.47Å; E113-N115 VanDerWaalsContact C-N 3.32Å; N115-F118 PolarHBondContact O-N 2.96Å; N115-D119 PolarHBondContact ND2-OD2 3.46Å; N115-D119 PolarHBondContact O-N 3.45Å; N115-K151 WeakPolarHBondContact O-CE 3.42Å; N115-K151 WeakPolarHBondContact OD1-CE 3.48Å; N115-K151 PolarHBondContact OD1-NZ 3.41Å; N115-L177 HydrophobicContact CB-CD1 4.34Å; N115-L177 HydrophobicContact CB-CD2 4.18Å
116E90.5Very high86.6Confident117 Ų11755.6 Ų55.655%0.54727%0.271SS..Hα-helixtrans-64.1-40.6176.1-175.2178-176.100112.1I112 F118 D119 N120I112-E116 WeakPolarHBondContact O-CB 3.31Å; I112-E116 PolarHBondContact O-N 2.87Å; E116-F118 PolarHBondContact O-N 3.22Å; E116-D119 PolarHBondContact O-N 3.43Å; E116-N120 PolarHBondContact O-N 3.35Å; E116-N120 PolarHBondContact O-ND2 2.92Å
117M88.3Confident85.7Confident2 Ų258.2 Ų58.21%0.0128%0.284CS..Hα-helixtrans-56.6-50.3172162177.727.900110.9L41 Y45 E113 L114 D119 N120 L121 F138L41-M117 HydrophobicContact CD2-CE 4.01Å; L41-M117 HydrophobicContact CD2-SD 3.96Å; Y45-M117 HydrophobicContact CD2-CB 4.4Å; Y45-M117 HydrophobicContact CD2-CE 4.09Å; Y45-M117 HydrophobicContact CD2-CG 4.08Å; Y45-M117 HydrophobicContact CD2-SD 3.45Å; Y45-M117 WeakPolarHBondContact CD2-SD 3.28Å; Y45-M117 HydrophobicContact CE1-CB 4.13Å; Y45-M117 HydrophobicContact CE2-CB 3.82Å; Y45-M117 HydrophobicContact CE2-CE 4.34Å; Y45-M117 HydrophobicContact CE2-CG 3.38Å; Y45-M117 HydrophobicContact CE2-SD 3.29Å; Y45-M117 WeakPolarHBondContact CE2-SD 3.37Å; Y45-M117 HydrophobicContact CG-SD 4.45Å; E113-M117 WeakPolarHBondContact O-CB 3.27Å; E113-M117 PolarHBondContact O-N 3.29Å; L114-M117 HydrophobicContact CB-CE 4.31Å; L114-M117 HydrophobicContact CD2-CE 3.05Å; L114-M117 HydrophobicContact CG-CE 4.23Å; L114-M117 WeakPolarHBondContact O-CB 3.27Å; L114-M117 PolarHBondContact O-N 2.95Å; M117-D119 VanDerWaalsContact C-N 3.27Å; M117-D119 PolarHBondContact O-N 2.99Å; M117-N120 PolarHBondContact O-N 3.45Å; M117-L121 HydrophobicContact CG-CD1 3.77Å; M117-L121 HydrophobicContact CG-CG 4.19Å; M117-L121 VanDerWaalsContact O-CG 3.26Å; M117-L121 WeakPolarHBondContact O-CG 3.3Å; M117-L121 PolarHBondContact O-N 3.02Å; M117-L121 HydrophobicContact SD-CD1 4.3Å; M117-F138 HydrophobicContact SD-CE1 3.93Å
118F89.4Confident85Confident0 Ų064.8 Ų64.80%031%0.308CS..Hα-helixtrans-64.8-33-179.8-86-78.8000111.9L114 N115 E116 L122 L139 I142 K151 C176 L177 V180L114-F118 VanDerWaalsContact O-CD2 3.23Å; L114-F118 WeakPolarHBondContact O-CD2 3.47Å; L114-F118 PolarHBondContact O-N 3.03Å; N115-F118 PolarHBondContact O-N 2.96Å; E116-F118 PolarHBondContact O-N 3.22Å; F118-L122 WeakPolarHBondContact O-CB 3.36Å; F118-L122 WeakPolarHBondContact O-CG 3.5Å; F118-L122 PolarHBondContact O-N 3.25Å; F118-L139 HydrophobicContact CD1-CD1 3.92Å; F118-L139 HydrophobicContact CE1-CD1 3.8Å; F118-I142 HydrophobicContact CE1-CG2 4.34Å; F118-I142 HydrophobicContact CZ-CD1 4.45Å; F118-I142 HydrophobicContact CZ-CG2 4.06Å; F118-K151 HydrophobicContact CB-CB 4.07Å; F118-K151 HydrophobicContact CB-CD 3.81Å; F118-K151 HydrophobicContact CB-CG 3.61Å; F118-K151 HydrophobicContact CD1-CB 4.3Å; F118-K151 HydrophobicContact CG-CB 4.41Å; F118-K151 HydrophobicContact CG-CG 4.14Å; F118-C176 HydrophobicContact CE1-CB 3.46Å; F118-C176 VanDerWaalsContact CE1-CB 3.46Å; F118-C176 HydrophobicContact CZ-CB 3.5Å; F118-C176 VanDerWaalsContact CZ-CB 3.5Å; F118-L177 HydrophobicContact CD2-CB 4.02Å; F118-L177 HydrophobicContact CD2-CD1 3.59Å; F118-L177 HydrophobicContact CD2-CG 4.4Å; F118-L177 HydrophobicContact CE2-CB 4.17Å; F118-L177 HydrophobicContact CE2-CD1 4.04Å; F118-V180 HydrophobicContact CE2-CB 4.46Å; F118-V180 HydrophobicContact CE2-CG2 4.43Å; F118-V180 HydrophobicContact CZ-CG2 4.14Å
119D90.5Very high84.2Confident70 Ų7065 Ų6537%0.37430%0.302SS..Hα-helixtrans-63.3-43.7172.9-75.3-37.3000112.1N115 E116 M117 L122 K123 K151N115-D119 PolarHBondContact ND2-OD2 3.46Å; N115-D119 PolarHBondContact O-N 3.45Å; E116-D119 PolarHBondContact O-N 3.43Å; M117-D119 VanDerWaalsContact C-N 3.27Å; M117-D119 PolarHBondContact O-N 2.99Å; D119-L122 PolarHBondContact O-N 3.48Å; D119-K123 VanDerWaalsContact O-CB 3.27Å; D119-K123 WeakPolarHBondContact O-CB 3.32Å; D119-K123 PolarHBondContact O-N 3.2Å; D119-K151 IonicContact OD1-NZ 2.86Å; D119-K151 PolarHBondContact OD1-NZ 3.4Å; D119-K151 IonicContact OD2-NZ 2.61Å; D119-K151 PolarHBondContact OD2-NZ 3.47Å
120N88.7Confident83.2Confident60 Ų6063.2 Ų63.232%0.32129%0.292SS..Hα-helixtrans-65.3-45.6176.1-72.1-30.4000111.8E116 M117 L122 K123 N124E116-N120 PolarHBondContact O-N 3.35Å; E116-N120 PolarHBondContact O-ND2 2.92Å; M117-N120 PolarHBondContact O-N 3.45Å; N120-L122 VanDerWaalsContact C-N 3.32Å; N120-L122 PolarHBondContact O-N 2.99Å; N120-K123 PolarHBondContact O-N 3.41Å; N120-K123 VanDerWaalsContact O-N 3.17Å; N120-N124 PolarHBondContact O-N 2.84Å
121L87.2Confident82.1Confident2 Ų271.6 Ų71.61%0.0133%0.334CS..Hα-helixtrans-60.4-40.7177.4-68.9175.4000112.1M117 Y125 E135 F138 L139 I142M117-L121 HydrophobicContact CG-CD1 3.77Å; M117-L121 HydrophobicContact CG-CG 4.19Å; M117-L121 VanDerWaalsContact O-CG 3.26Å; M117-L121 WeakPolarHBondContact O-CG 3.3Å; M117-L121 PolarHBondContact O-N 3.02Å; M117-L121 HydrophobicContact SD-CD1 4.3Å; L121-Y125 WeakPolarHBondContact O-CB 3.35Å; L121-Y125 PolarHBondContact O-N 2.98Å; L121-E135 HydrophobicContact CD2-CB 3.93Å; L121-E135 HydrophobicContact CD2-CG 4.3Å; L121-F138 HydrophobicContact CD1-CD1 3.75Å; L121-F138 HydrophobicContact CD1-CE1 4.04Å; L121-F138 HydrophobicContact CD2-CD1 3.77Å; L121-F138 HydrophobicContact CG-CD1 4.41Å; L121-L139 HydrophobicContact CB-CB 4.41Å; L121-L139 HydrophobicContact CB-CD1 4.42Å; L121-L139 HydrophobicContact CB-CD2 4.47Å; L121-L139 HydrophobicContact CD1-CD1 4.23Å; L121-I142 HydrophobicContact CD1-CD1 4.24Å
122L85.7Confident81.2Confident16 Ų1670.9 Ų70.98%0.08434%0.341CS..Hα-helixtrans-70.4-41.9174.8-75.7177.5000111.3F118 D119 N120 N124 Y125 L139 K151 D156 L157 R160F118-L122 WeakPolarHBondContact O-CB 3.36Å; F118-L122 WeakPolarHBondContact O-CG 3.5Å; F118-L122 PolarHBondContact O-N 3.25Å; D119-L122 PolarHBondContact O-N 3.48Å; N120-L122 VanDerWaalsContact C-N 3.32Å; N120-L122 PolarHBondContact O-N 2.99Å; L122-N124 VanDerWaalsContact C-N 3.32Å; L122-N124 PolarHBondContact O-N 3.47Å; L122-Y125 WeakPolarHBondContact O-CB 3.33Å; L122-Y125 PolarHBondContact O-N 3.44Å; L122-L139 HydrophobicContact CD2-CD2 3.93Å; L122-K151 HydrophobicContact CD1-CB 3.56Å; L122-K151 HydrophobicContact CD1-CD 4.19Å; L122-D156 HydrophobicContact CD1-CB 4.07Å; L122-D156 HydrophobicContact CD2-CB 4.49Å; L122-L157 HydrophobicContact CD2-CD1 3.87Å; L122-R160 PolarHBondContact O-NH1 3.13Å; L122-R160 PolarHBondContact O-NH2 2.86Å
123K85.7Confident80.7Confident157 Ų15768.4 Ų68.468%0.68333%0.329SS*.Hα-helixtrans-58.3-43.7-179.7-175.1178.2178.5-177.90112.3D119 N120D119-K123 VanDerWaalsContact O-CB 3.27Å; D119-K123 WeakPolarHBondContact O-CB 3.32Å; D119-K123 PolarHBondContact O-N 3.2Å; N120-K123 PolarHBondContact O-N 3.41Å; N120-K123 VanDerWaalsContact O-N 3.17Å
124N84.3Confident80.5Confident67 Ų6771.3 Ų71.336%0.35834%0.343SS..THydrogen-bonded Turntrans-94.17.3-177.5-60.2-32.1000113.6N120 L122 D126 N133 E135N120-N124 PolarHBondContact O-N 2.84Å; L122-N124 VanDerWaalsContact C-N 3.32Å; L122-N124 PolarHBondContact O-N 3.47Å; N124-D126 PolarHBondContact O-N 3.22Å; N124-N133 PolarHBondContact O-ND2 2.91Å; N124-E135 HydrophobicContact CB-CB 4.46Å; N124-E135 WeakPolarHBondContact CB-OE2 3.43Å; N124-E135 PolarHBondContact ND2-OE1 3.48Å; N124-E135 PolarHBondContact ND2-OE2 3.46Å
125Y80.6Confident80.1Confident11 Ų1173.8 Ų73.84%0.04335%0.354CS..  trans-63.7108.7178.2-168.8-93.4000111.3L121 L122 T136 L139 N140 R160L121-Y125 WeakPolarHBondContact O-CB 3.35Å; L121-Y125 PolarHBondContact O-N 2.98Å; L122-Y125 WeakPolarHBondContact O-CB 3.33Å; L122-Y125 PolarHBondContact O-N 3.44Å; Y125-T136 HydrophobicContact CD2-CG2 3.92Å; Y125-T136 HydrophobicContact CE2-CG2 3.61Å; Y125-L139 HydrophobicContact CD2-CD2 3.64Å; Y125-L139 HydrophobicContact CE2-CD2 3.94Å; Y125-N140 PolarHBondContact OH-OD1 3.04Å; Y125-R160 HydrophobicContact CD1-CB 4.32Å; Y125-R160 HydrophobicContact CE1-CB 4.41Å; Y125-R160 PolarHBondContact O-NH1 3.1Å
126D74.1Confident79.7Confident55 Ų5572.2 Ų72.229%0.29435%0.346SS..  trans-91.5113.4174.2-174.3-11.7000110.6N124 K128 R129 T136N124-D126 PolarHBondContact O-N 3.22Å; D126-K128 PolarHBondContact OD1-N 3.43Å; D126-R129 PolarHBondContact OD1-N 3.36Å; D126-R129 WeakPolarHBondContact OD2-CB 3.44Å; D126-T136 PolarHBondContact N-OG1 3.05Å
127E68.6Low79.4Confident69 Ų6973.3 Ų73.332%0.32235%0.349SS..SBendtrans-70.9-28.9179.970-175.6179.700113.4R160 K161E127-R160 WeakPolarHBondContact OE2-CA 3.45Å; E127-K161 PolarHBondContact OE2-N 3.3Å
128K67.8Low79.3Confident175 Ų17574.2 Ų74.276%0.76135%0.353SS*.SBendtrans-85.9-24.2-173.9-62.4-176.7-177.5171.90111.4D126D126-K128 PolarHBondContact OD1-N 3.43Å
129R66.7Low79.2Confident152 Ų15274.2 Ų74.257%0.57435%0.353SS*.  trans-127.962.2-173.9-59.9-175.8170.1-172.90.3112.5D126 M131 V132D126-R129 PolarHBondContact OD1-N 3.36Å; D126-R129 WeakPolarHBondContact OD2-CB 3.44Å; R129-M131 PolarHBondContact O-N 3.27Å; R129-V132 HydrophobicContact CB-CB 3.76Å; R129-V132 HydrophobicContact CB-CG2 3.72Å; R129-V132 HydrophobicContact CG-CG2 4.2Å; R129-V132 PolarHBondContact O-N 3.08Å
130L64.8Low79Confident46 Ų4672.2 Ų72.224%0.24134%0.342CS..THydrogen-bonded Turntrans-50.3-28-178.7-65.8172.8000115.4T136 I164L130-T136 HydrophobicContact CD2-CG2 4.06Å; L130-I164 HydrophobicContact CD1-CD1 4.16Å
131M65Low78.9Confident176 Ų17674.1 Ų74.187%0.86735%0.345SS*.THydrogen-bonded Turntrans-107.5-4.3-178.9-59.5-154.9-150.400114.8R129R129-M131 PolarHBondContact O-N 3.27Å
132V69.7Low79Confident103 Ų10374 Ų7462%0.62435%0.345SS*.THydrogen-bonded Turntrans-92.5-44.2-175.3-175.90000110.9R129R129-V132 HydrophobicContact CB-CB 3.76Å; R129-V132 HydrophobicContact CB-CG2 3.72Å; R129-V132 HydrophobicContact CG-CG2 4.2Å; R129-V132 PolarHBondContact O-N 3.08Å
133N79Confident79.1Confident50 Ų5073.3 Ų73.327%0.26734%0.341SS..  trans-81.5124.9178.8-166-4.3000110.4N124 E135 T136 K137N124-N133 PolarHBondContact O-ND2 2.91Å; N133-E135 PolarHBondContact O-N 2.94Å; N133-E135 PolarHBondContact OD1-N 3.39Å; N133-T136 PolarHBondContact O-N 2.9Å; N133-K137 PolarHBondContact O-N 2.92Å
134E82.5Confident79.2Confident136 Ų13674.9 Ų74.964%0.63634%0.344SS*.Hα-helixtrans-58.3-34.8176-66.5-169175.700112.4K44 K137 F138K44-E134 IonicContact NZ-OE2 2.93Å; K44-E134 PolarHBondContact NZ-OE2 3.22Å; E134-K137 PolarHBondContact O-N 3.19Å; E134-F138 VanDerWaalsContact O-CB 3.27Å; E134-F138 WeakPolarHBondContact O-CB 3.49Å; E134-F138 PolarHBondContact O-N 2.85Å
135E81.5Confident79.4Confident52 Ų5274.8 Ų74.824%0.24334%0.34CS..Hα-helixtrans-69.5-43.4-179.6-63.8-171.5-148.200111.6L121 N124 N133 K137 F138 L139L121-E135 HydrophobicContact CD2-CB 3.93Å; L121-E135 HydrophobicContact CD2-CG 4.3Å; N124-E135 HydrophobicContact CB-CB 4.46Å; N124-E135 WeakPolarHBondContact CB-OE2 3.43Å; N124-E135 PolarHBondContact ND2-OE1 3.48Å; N124-E135 PolarHBondContact ND2-OE2 3.46Å; N133-E135 PolarHBondContact O-N 2.94Å; N133-E135 PolarHBondContact OD1-N 3.39Å; E135-K137 PolarHBondContact O-N 3.01Å; E135-F138 PolarHBondContact O-N 2.95Å; E135-L139 PolarHBondContact O-N 3.46Å
136T82.8Confident79.7Confident0 Ų075.2 Ų75.20%034%0.343CS..Hα-helixtrans-59.6-46172.1-58.90000111.1Y125 D126 L130 N133 F138 L139 N140Y125-T136 HydrophobicContact CD2-CG2 3.92Å; Y125-T136 HydrophobicContact CE2-CG2 3.61Å; D126-T136 PolarHBondContact N-OG1 3.05Å; L130-T136 HydrophobicContact CD2-CG2 4.06Å; N133-T136 PolarHBondContact O-N 2.9Å; T136-F138 VanDerWaalsContact C-N 3.32Å; T136-F138 PolarHBondContact O-N 2.88Å; T136-L139 PolarHBondContact O-N 2.7Å; T136-N140 WeakPolarHBondContact O-CB 3.44Å; T136-N140 PolarHBondContact O-N 2.98Å; T136-N140 PolarHBondContact O-ND2 3.41Å
137K84.3Confident80.4Confident141 Ų14177.8 Ų77.861%0.61336%0.356SS*.Hα-helixtrans-61.4-41.6177.9-174.6179.8179.9-178.30111.8N133 E134 E135 Y141N133-K137 PolarHBondContact O-N 2.92Å; E134-K137 PolarHBondContact O-N 3.19Å; E135-K137 PolarHBondContact O-N 3.01Å; K137-Y141 WeakPolarHBondContact O-CB 3.36Å; K137-Y141 PolarHBondContact O-N 3.4Å
138F86.1Confident81.4Confident21 Ų2174.6 Ų74.69%0.09234%0.341CS..Hα-helixtrans-67.2-45.3178.9-173.5-106000112.2F40 L41 K44 M117 L121 E134 E135 T136 N140 Y141 I142F40-F138 AromaticContact CD2-CE2 3.59Å; F40-F138 HydrophobicContact CD2-CE2 3.59Å; F40-F138 AromaticContact CD2-CZ 3.81Å; F40-F138 HydrophobicContact CD2-CZ 3.81Å; F40-F138 HydrophobicContact CE2-CE2 4.05Å; F40-F138 AromaticContact CE2-CZ 3.85Å; F40-F138 HydrophobicContact CE2-CZ 3.85Å; L41-F138 HydrophobicContact CD2-CE1 4.34Å; L41-F138 HydrophobicContact CD2-CZ 3.87Å; K44-F138 HydrophobicContact CB-CZ 4.25Å; K44-F138 HydrophobicContact CG-CD2 4.29Å; K44-F138 HydrophobicContact CG-CE1 4.47Å; K44-F138 HydrophobicContact CG-CE2 3.96Å; K44-F138 HydrophobicContact CG-CZ 4.04Å; M117-F138 HydrophobicContact SD-CE1 3.93Å; L121-F138 HydrophobicContact CD1-CD1 3.75Å; L121-F138 HydrophobicContact CD1-CE1 4.04Å; L121-F138 HydrophobicContact CD2-CD1 3.77Å; L121-F138 HydrophobicContact CG-CD1 4.41Å; E134-F138 VanDerWaalsContact O-CB 3.27Å; E134-F138 WeakPolarHBondContact O-CB 3.49Å; E134-F138 PolarHBondContact O-N 2.85Å; E135-F138 PolarHBondContact O-N 2.95Å; T136-F138 VanDerWaalsContact C-N 3.32Å; T136-F138 PolarHBondContact O-N 2.88Å; F138-N140 PolarHBondContact O-N 3.5Å; F138-Y141 WeakPolarHBondContact O-CB 3.29Å; F138-Y141 PolarHBondContact O-N 3.22Å; F138-I142 HydrophobicContact CD1-CD1 3.78Å; F138-I142 HydrophobicContact CE1-CD1 3.54Å; F138-I142 HydrophobicContact CE1-CG1 4.49Å; F138-I142 HydrophobicContact CZ-CD1 4.16Å; F138-I142 WeakPolarHBondContact O-CG1 3.3Å; F138-I142 PolarHBondContact O-N 3.46Å
139L86.7Confident82.4Confident0 Ų066.2 Ų66.20%031%0.305CS..Hα-helixtrans-62.8-43.1176.1-17561.7000111.6F118 L121 L122 Y125 E135 T136 Y141 I142 Q143F118-L139 HydrophobicContact CD1-CD1 3.92Å; F118-L139 HydrophobicContact CE1-CD1 3.8Å; L121-L139 HydrophobicContact CB-CB 4.41Å; L121-L139 HydrophobicContact CB-CD1 4.42Å; L121-L139 HydrophobicContact CB-CD2 4.47Å; L121-L139 HydrophobicContact CD1-CD1 4.23Å; L122-L139 HydrophobicContact CD2-CD2 3.93Å; Y125-L139 HydrophobicContact CD2-CD2 3.64Å; Y125-L139 HydrophobicContact CE2-CD2 3.94Å; E135-L139 PolarHBondContact O-N 3.46Å; T136-L139 PolarHBondContact O-N 2.7Å; L139-Y141 VanDerWaalsContact C-N 3.3Å; L139-Y141 PolarHBondContact O-N 3.41Å; L139-I142 PolarHBondContact O-N 2.87Å; L139-Q143 WeakPolarHBondContact O-CG 3.2Å; L139-Q143 PolarHBondContact O-N 3.26Å
140N86.4Confident83.4Confident27 Ų2759 Ų5914%0.14428%0.278CS..Hα-helixtrans-62-37.8175.8-70.5-19.2000111.9Y125 T136 F138 Q143 Y144 A165Y125-N140 PolarHBondContact OH-OD1 3.04Å; T136-N140 WeakPolarHBondContact O-CB 3.44Å; T136-N140 PolarHBondContact O-N 2.98Å; T136-N140 PolarHBondContact O-ND2 3.41Å; F138-N140 PolarHBondContact O-N 3.5Å; N140-Q143 PolarHBondContact O-N 3.37Å; N140-Y144 WeakPolarHBondContact O-CB 3.38Å; N140-Y144 PolarHBondContact O-N 3.1Å; N140-A165 HydrophobicContact CB-CB 3.65Å; N140-A165 VanDerWaalsContact CG-CB 3.48Å; N140-A165 WeakPolarHBondContact OD1-CB 3.44Å
141Y87.1Confident84.6Confident100 Ų10057.6 Ų57.639%0.39227%0.27SS..Hα-helixtrans-64-43.7174.8175.6-98.9000112.1F40 K137 F138 L139 Y144 K145F40-Y141 HydrophobicContact CB-CE1 3.94Å; F40-Y141 HydrophobicContact CD1-CE1 4.02Å; F40-Y141 HydrophobicContact CD2-CD1 4.05Å; F40-Y141 AromaticContact CD2-CE1 3.88Å; F40-Y141 HydrophobicContact CD2-CE1 3.88Å; F40-Y141 HydrophobicContact CE2-CD1 4.45Å; F40-Y141 HydrophobicContact CE2-CE1 4.48Å; F40-Y141 HydrophobicContact CG-CD1 4.29Å; F40-Y141 AromaticContact CG-CE1 3.64Å; F40-Y141 HydrophobicContact CG-CE1 3.64Å; K137-Y141 WeakPolarHBondContact O-CB 3.36Å; K137-Y141 PolarHBondContact O-N 3.4Å; F138-Y141 WeakPolarHBondContact O-CB 3.29Å; F138-Y141 PolarHBondContact O-N 3.22Å; L139-Y141 VanDerWaalsContact C-N 3.3Å; L139-Y141 PolarHBondContact O-N 3.41Å; Y141-Y144 PolarHBondContact O-N 3.39Å; Y141-K145 HydrophobicContact CE1-CD 3.95Å; Y141-K145 VanDerWaalsContact O-CB 3.27Å; Y141-K145 WeakPolarHBondContact O-CB 3.45Å; Y141-K145 PolarHBondContact O-N 3.24Å
142I88.9Confident85.8Confident0 Ų053.4 Ų53.40%025%0.251CS..Hα-helixtrans-60-49176-68.2168.4000110.6F40 F118 L121 F138 L139 Y144 K145 F146 C176 V180F40-I142 HydrophobicContact CD2-CG1 4.43Å; F40-I142 HydrophobicContact CE2-CD1 3.89Å; F40-I142 HydrophobicContact CE2-CG1 3.39Å; F40-I142 HydrophobicContact CZ-CD1 4.45Å; F40-I142 HydrophobicContact CZ-CG1 3.78Å; F118-I142 HydrophobicContact CE1-CG2 4.34Å; F118-I142 HydrophobicContact CZ-CD1 4.45Å; F118-I142 HydrophobicContact CZ-CG2 4.06Å; L121-I142 HydrophobicContact CD1-CD1 4.24Å; F138-I142 HydrophobicContact CD1-CD1 3.78Å; F138-I142 HydrophobicContact CE1-CD1 3.54Å; F138-I142 HydrophobicContact CE1-CG1 4.49Å; F138-I142 HydrophobicContact CZ-CD1 4.16Å; F138-I142 WeakPolarHBondContact O-CG1 3.3Å; F138-I142 PolarHBondContact O-N 3.46Å; L139-I142 PolarHBondContact O-N 2.87Å; I142-Y144 VanDerWaalsContact C-N 3.33Å; I142-Y144 PolarHBondContact O-N 3.3Å; I142-K145 PolarHBondContact O-N 3.05Å; I142-F146 HydrophobicContact CG2-CD2 4.05Å; I142-F146 PolarHBondContact O-N 3.47Å; I142-C176 HydrophobicContact CG2-CB 3.99Å; I142-V180 HydrophobicContact CG2-CG2 3.97Å
143Q88.5Confident86.6Confident1 Ų152.3 Ų52.31%0.00524%0.241CC..Hα-helixtrans-57.9-45.9-179.5-73.3177.417.500111.9L139 N140 D147 C148 C166L139-Q143 WeakPolarHBondContact O-CG 3.2Å; L139-Q143 PolarHBondContact O-N 3.26Å; N140-Q143 PolarHBondContact O-N 3.37Å; Q143-D147 WeakPolarHBondContact O-CA 3.18Å; Q143-D147 PolarHBondContact O-N 3.21Å; Q143-D147 VanDerWaalsContact O-N 3.08Å; Q143-C148 WeakPolarHBondContact CA-O 3.5Å; Q143-C148 VanDerWaalsContact CB-O 3.28Å; Q143-C148 WeakPolarHBondContact CB-O 3.44Å; Q143-C148 WeakPolarHBondContact CG-O 3.33Å; Q143-C148 PolarHBondContact O-N 2.96Å; Q143-C148 VanDerWaalsContact O-N 3.12Å; Q143-C166 PolarHBondContact OE1-SG 2.88Å
144Y87.6Confident86.8Confident190 Ų19050.5 Ų50.575%0.74523%0.232SC*.Hα-helixtrans-64.6-45.1176.2179.9-100.9000112.3N140 Y141 I142N140-Y144 WeakPolarHBondContact O-CB 3.38Å; N140-Y144 PolarHBondContact O-N 3.1Å; Y141-Y144 PolarHBondContact O-N 3.39Å; I142-Y144 VanDerWaalsContact C-N 3.33Å; I142-Y144 PolarHBondContact O-N 3.3Å
145K88.2Confident86.8Confident65 Ų6550.4 Ų50.428%0.28323%0.231SC..Hα-helixtrans-67.2-41.3-176-174.6175.2-171.1176.60113.2D37 F40 Y141 I142D37-K145 VanDerWaalsContact O-CE 3.23Å; D37-K145 WeakPolarHBondContact O-CE 3.2Å; D37-K145 PolarHBondContact O-NZ 3.34Å; F40-K145 HydrophobicContact CD1-CD 4.14Å; F40-K145 HydrophobicContact CE1-CD 4.05Å; Y141-K145 HydrophobicContact CE1-CD 3.95Å; Y141-K145 VanDerWaalsContact O-CB 3.27Å; Y141-K145 WeakPolarHBondContact O-CB 3.45Å; Y141-K145 PolarHBondContact O-N 3.24Å; I142-K145 PolarHBondContact O-N 3.05Å
146F88.3Confident86.7Confident21 Ų2150.5 Ų50.59%0.09223%0.234CC..Hα-helixtrans-99.43.5-174.9-74.4-78.7000114.1D37 F40 I142 C148 K179 V180 T183D37-F146 HydrophobicContact CB-CE1 4.4Å; D37-F146 HydrophobicContact CB-CZ 4.32Å; F40-F146 AromaticContact CE1-CE2 3.55Å; F40-F146 HydrophobicContact CE1-CE2 3.55Å; F40-F146 HydrophobicContact CE1-CZ 4.06Å; F40-F146 AromaticContact CZ-CE2 3.66Å; F40-F146 HydrophobicContact CZ-CE2 3.66Å; F40-F146 HydrophobicContact CZ-CZ 4.46Å; I142-F146 HydrophobicContact CG2-CD2 4.05Å; I142-F146 PolarHBondContact O-N 3.47Å; F146-C148 VanDerWaalsContact C-N 3.25Å; F146-C148 HydrophobicContact CB-CB 4.36Å; F146-C148 PolarHBondContact O-N 3.22Å; F146-K179 HydrophobicContact CB-CG 3.93Å; F146-K179 HydrophobicContact CD1-CG 3.76Å; F146-K179 HydrophobicContact CG-CG 4.18Å; F146-V180 HydrophobicContact CD2-CG2 3.96Å; F146-V180 HydrophobicContact CE2-CG2 3.91Å; F146-V180 HydrophobicContact CG-CG2 4.39Å; F146-V180 HydrophobicContact CZ-CG2 4.32Å; F146-T183 HydrophobicContact CE1-CG2 4.1Å
147D88.5Confident86.5Confident108 Ų10850.5 Ų50.558%0.57823%0.234SC*.THydrogen-bonded Turntrans5047.7-175.4-163.638.6000112.2Q143 K173Q143-D147 WeakPolarHBondContact O-CA 3.18Å; Q143-D147 PolarHBondContact O-N 3.21Å; Q143-D147 VanDerWaalsContact O-N 3.08Å; D147-K173 VanDerWaalsContact OD1-CE 3.29Å; D147-K173 WeakPolarHBondContact OD1-CE 3.1Å; D147-K173 IonicContact OD1-NZ 2.81Å; D147-K173 PolarHBondContact OD1-NZ 3.13Å
148C90.2Very high86Confident2 Ų249.1 Ų49.11%0.01423%0.228CC..  trans-125.5161.4-174.262.70000110.6Q143 F146 K174 C176Q143-C148 WeakPolarHBondContact CA-O 3.5Å; Q143-C148 VanDerWaalsContact CB-O 3.28Å; Q143-C148 WeakPolarHBondContact CB-O 3.44Å; Q143-C148 WeakPolarHBondContact CG-O 3.33Å; Q143-C148 PolarHBondContact O-N 2.96Å; Q143-C148 VanDerWaalsContact O-N 3.12Å; F146-C148 VanDerWaalsContact C-N 3.25Å; F146-C148 HydrophobicContact CB-CB 4.36Å; F146-C148 PolarHBondContact O-N 3.22Å; C148-K174 WeakPolarHBondContact CA-O 3.41Å; C148-K174 VanDerWaalsContact CB-O 3.26Å; C148-K174 WeakPolarHBondContact CB-O 3.38Å; C148-C176 HydrophobicContact CB-CB 3.9Å; C148-C176 WeakPolarHBondContact CB-SG 3.4Å; C148-C176 WeakPolarHBondContact SG-CA 3.43Å; C148-C176 WeakPolarHBondContact SG-CB 3.42Å; C148-C176 CovalentContact SG-SG 2.03Å; C148-C176 PolarHBondContact SG-SG 3.18Å
149C88.7Confident85.2Confident0 Ų055.5 Ų55.50%026%0.263CS..  trans-135.8129-179.6-164.50000111.2N153 V154 C166 K173 K174C149-N153 CarbonylContact O-C 3.53Å; C149-N153 VanDerWaalsContact O-C 3.31Å; C149-V154 HydrophobicContact CB-CB 4.48Å; C149-C166 WeakPolarHBondContact CA-SG 3.39Å; C149-C166 HydrophobicContact CB-CB 3.77Å; C149-C166 WeakPolarHBondContact CB-SG 3.49Å; C149-C166 WeakPolarHBondContact SG-CB 3.37Å; C149-C166 CovalentContact SG-SG 2.03Å; C149-C166 PolarHBondContact SG-SG 3.24Å; C149-K173 HydrophobicContact CB-CB 3.96Å; C149-K174 PolarHBondContact N-O 3.41Å; C149-K174 VanDerWaalsContact N-O 3.09Å
150G87.9Confident84.2Confident0 Ų059 Ų590%028%0.276CS..SBendtrans66.2-173.6-17700000114.5L157 C176G150-L157 VanDerWaalsContact CA-CD1 3.4Å; G150-C176 VanDerWaalsContact O-CB 3.23Å; G150-C176 WeakPolarHBondContact O-CB 3.48Å; G150-C176 PolarHBondContact O-N 3.43Å; G150-C176 PolarHBondContact O-SG 2.89Å; G150-C176 VanDerWaalsContact O-SG 3.37Å
151K89.4Confident82.9Confident17 Ų1765.4 Ų65.47%0.07430%0.303CS..SBendtrans-77.4-58.9177.7172.4-175.5-174.4-165.50109.1N115 F118 D119 L122 D156 G175 C176 L177N115-K151 WeakPolarHBondContact O-CE 3.42Å; N115-K151 WeakPolarHBondContact OD1-CE 3.48Å; N115-K151 PolarHBondContact OD1-NZ 3.41Å; F118-K151 HydrophobicContact CB-CB 4.07Å; F118-K151 HydrophobicContact CB-CD 3.81Å; F118-K151 HydrophobicContact CB-CG 3.61Å; F118-K151 HydrophobicContact CD1-CB 4.3Å; F118-K151 HydrophobicContact CG-CB 4.41Å; F118-K151 HydrophobicContact CG-CG 4.14Å; D119-K151 IonicContact OD1-NZ 2.86Å; D119-K151 PolarHBondContact OD1-NZ 3.4Å; D119-K151 IonicContact OD2-NZ 2.61Å; D119-K151 PolarHBondContact OD2-NZ 3.47Å; L122-K151 HydrophobicContact CD1-CB 3.56Å; L122-K151 HydrophobicContact CD1-CD 4.19Å; K151-D156 WeakPolarHBondContact CB-OD2 3.16Å; K151-D156 PolarHBondContact N-OD2 3.2Å; K151-G175 CarbonylContact O-C 3.54Å; K151-G175 WeakPolarHBondContact O-CA 3.4Å; K151-C176 PolarHBondContact O-N 2.7Å; K151-L177 HydrophobicContact CG-CB 4.1Å; K151-L177 HydrophobicContact CG-CD2 4.12Å; K151-L177 VanDerWaalsContact O-CB 3.25Å; K151-L177 WeakPolarHBondContact O-CB 3.34Å; K151-L177 PolarHBondContact O-N 3.21Å
152L90.1Very high81.6Confident88 Ų8863.4 Ų63.446%0.46130%0.302SS..SBendtrans-98.6-47178.3-63.2179.1000111D156 G175 L177L152-D156 PolarHBondContact N-OD2 3.07Å; L152-G175 VanDerWaalsContact C-CA 3.49Å; L152-G175 WeakPolarHBondContact O-CA 3.15Å; L152-G175 PolarHBondContact O-N 3.4Å; L152-G175 VanDerWaalsContact O-N 3.07Å; L152-L177 HydrophobicContact CD2-CD2 4.25Å
153N86Confident80.3Confident80 Ų8065.2 Ų65.243%0.42831%0.313SS..SBendtrans-156.5175.4-179.6-70.4-48000110.6C149 E155 D156C149-N153 CarbonylContact O-C 3.53Å; C149-N153 VanDerWaalsContact O-C 3.31Å; N153-E155 PolarHBondContact O-N 3.36Å; N153-E155 VanDerWaalsContact O-N 3.11Å; N153-D156 PolarHBondContact N-OD2 2.98Å; N153-D156 PolarHBondContact O-N 3.48Å
154V83.7Confident79.1Confident12 Ų1270.7 Ų70.77%0.07334%0.341CS..G310 helixtrans-55.8-25.3173.166.50000113.5C149 D156 L157 F158 P170 T171C149-V154 HydrophobicContact CB-CB 4.48Å; V154-D156 PolarHBondContact O-N 3.01Å; V154-L157 PolarHBondContact O-N 3.45Å; V154-F158 HydrophobicContact CG1-CE2 4.22Å; V154-F158 HydrophobicContact CG1-CZ 3.91Å; V154-F158 HydrophobicContact CG2-CE1 4.37Å; V154-F158 HydrophobicContact CG2-CZ 4.47Å; V154-F158 PolarHBondContact O-N 3.27Å; V154-P170 HydrophobicContact CG2-CB 3.91Å; V154-T171 HydrophobicContact CG1-CG2 4.39Å
155E81.7Confident78.2Confident133 Ų13362.8 Ų62.862%0.62132%0.315SS*.G310 helixtrans-56.2-33179.8-78.3171.9-165.100113.5N153 L157 F158N153-E155 PolarHBondContact O-N 3.36Å; N153-E155 VanDerWaalsContact O-N 3.11Å; E155-L157 PolarHBondContact O-N 2.87Å; E155-F158 VanDerWaalsContact CA-CD2 3.43Å; E155-F158 HydrophobicContact CB-CD2 4.02Å; E155-F158 HydrophobicContact CB-CE2 4.19Å; E155-F158 HydrophobicContact CG-CD2 3.66Å; E155-F158 HydrophobicContact CG-CE2 3.41Å; E155-F158 VanDerWaalsContact CG-CE2 3.41Å; E155-F158 PolarHBondContact O-N 2.91Å; E155-F158 VanDerWaalsContact O-N 3.13Å
156D80.9Confident77.6Confident55 Ų5559.8 Ų59.829%0.29430%0.302SS..G310 helixtrans-61.2-18.1177.4-58.3-30.3000112.9L122 K151 L152 N153 V154L122-D156 HydrophobicContact CD1-CB 4.07Å; L122-D156 HydrophobicContact CD2-CB 4.49Å; K151-D156 WeakPolarHBondContact CB-OD2 3.16Å; K151-D156 PolarHBondContact N-OD2 3.2Å; L152-D156 PolarHBondContact N-OD2 3.07Å; N153-D156 PolarHBondContact N-OD2 2.98Å; N153-D156 PolarHBondContact O-N 3.48Å; V154-D156 PolarHBondContact O-N 3.01Å
157L77.9Confident76.9Confident0 Ų061 Ų610%032%0.32CS..G310 helixtrans-113.32-178.9-79.479.8000113.5L122 G150 V154 E155 D159 R160 V163L122-L157 HydrophobicContact CD2-CD1 3.87Å; G150-L157 VanDerWaalsContact CA-CD1 3.4Å; V154-L157 PolarHBondContact O-N 3.45Å; E155-L157 PolarHBondContact O-N 2.87Å; L157-D159 PolarHBondContact O-N 2.65Å; L157-R160 CarbonylContact O-C 3.45Å; L157-R160 PolarHBondContact O-N 2.94Å; L157-V163 HydrophobicContact CB-CG1 4.34Å; L157-V163 HydrophobicContact CB-CG2 3.86Å; L157-V163 HydrophobicContact CD2-CG1 3.68Å; L157-V163 HydrophobicContact CD2-CG2 4.3Å
158F72.7Confident76.2Confident111 Ų11164.1 Ų64.149%0.48733%0.334SS..THydrogen-bonded Turntrans-61.2-34-176.2-87.3-44.2000113.6V154 E155 R160V154-F158 HydrophobicContact CG1-CE2 4.22Å; V154-F158 HydrophobicContact CG1-CZ 3.91Å; V154-F158 HydrophobicContact CG2-CE1 4.37Å; V154-F158 HydrophobicContact CG2-CZ 4.47Å; V154-F158 PolarHBondContact O-N 3.27Å; E155-F158 VanDerWaalsContact CA-CD2 3.43Å; E155-F158 HydrophobicContact CB-CD2 4.02Å; E155-F158 HydrophobicContact CB-CE2 4.19Å; E155-F158 HydrophobicContact CG-CD2 3.66Å; E155-F158 HydrophobicContact CG-CE2 3.41Å; E155-F158 VanDerWaalsContact CG-CE2 3.41Å; E155-F158 PolarHBondContact O-N 2.91Å; E155-F158 VanDerWaalsContact O-N 3.13Å; F158-R160 PolarHBondContact O-N 3.06Å
159D70.3Confident75.5Confident156 Ų15670 Ų7083%0.83436%0.359SS*.THydrogen-bonded Turntrans-78.1-7.4176.7-64.4-32.5000113.4L157L157-D159 PolarHBondContact O-N 2.65Å
160R65.8Low74.7Confident73 Ų7372 Ų7228%0.27537%0.372SS..SBendtrans-121.289.2-169.9-53.8-174.1-167-135.212.6110.3L122 Y125 E127 L157 F158 V163L122-R160 PolarHBondContact O-NH1 3.13Å; L122-R160 PolarHBondContact O-NH2 2.86Å; Y125-R160 HydrophobicContact CD1-CB 4.32Å; Y125-R160 HydrophobicContact CE1-CB 4.41Å; Y125-R160 PolarHBondContact O-NH1 3.1Å; E127-R160 WeakPolarHBondContact OE2-CA 3.45Å; L157-R160 CarbonylContact O-C 3.45Å; L157-R160 PolarHBondContact O-N 2.94Å; F158-R160 PolarHBondContact O-N 3.06Å; R160-V163 WeakPolarHBondContact O-CG2 3.4Å
161K59.7Low74.2Confident161 Ų16176.9 Ų76.970%0.740%0.402SS*.SBendtrans-102.3139.4-177.8-72.6-179.6-176.3175.20111.2E127E127-K161 PolarHBondContact OE2-N 3.3Å
162P57.9Low73.7Confident59 Ų5982.6 Ų82.638%0.38343%0.429SS..  cis-100.5140.48.436.5-33.1000114.4I164P162-I164 HydrophobicContact CB-CD1 4.14Å; P162-I164 HydrophobicContact CB-CG1 3.78Å; P162-I164 HydrophobicContact CG-CD1 3.73Å; P162-I164 HydrophobicContact CG-CG1 3.85Å; P162-I164 PolarHBondContact O-N 3.11Å
163V61.6Low73.3Confident37 Ų3780 Ų8022%0.22441%0.414CS..  trans-83.858.8175.7-164.90000110.7L157 R160 A165 C166L157-V163 HydrophobicContact CB-CG1 4.34Å; L157-V163 HydrophobicContact CB-CG2 3.86Å; L157-V163 HydrophobicContact CD2-CG1 3.68Å; L157-V163 HydrophobicContact CD2-CG2 4.3Å; R160-V163 WeakPolarHBondContact O-CG2 3.4Å; V163-A165 VanDerWaalsContact C-N 3.32Å; V163-A165 PolarHBondContact O-N 3.2Å; V163-C166 HydrophobicContact CG1-CB 3.81Å; V163-C166 WeakPolarHBondContact CG1-SG 3.38Å
164I64Low73.4Confident117 Ų11784.3 Ų84.360%0.643%0.429SS*.  trans-69.8-32.3-175.7-56176.6000111.1L130 P162 C166 G167L130-I164 HydrophobicContact CD1-CD1 4.16Å; P162-I164 HydrophobicContact CB-CD1 4.14Å; P162-I164 HydrophobicContact CB-CG1 3.78Å; P162-I164 HydrophobicContact CG-CD1 3.73Å; P162-I164 HydrophobicContact CG-CG1 3.85Å; P162-I164 PolarHBondContact O-N 3.11Å; I164-C166 VanDerWaalsContact C-N 3.31Å; I164-C166 PolarHBondContact O-N 3.46Å; I164-G167 PolarHBondContact O-N 3.38Å
165A68.5Low73.7Confident24 Ų2484 Ų8420%0.19843%0.427CS..THydrogen-bonded Turntrans-70.5-22.7-173.800000114.3N140 V163 G167N140-A165 HydrophobicContact CB-CB 3.65Å; N140-A165 VanDerWaalsContact CG-CB 3.48Å; N140-A165 WeakPolarHBondContact OD1-CB 3.44Å; V163-A165 VanDerWaalsContact C-N 3.32Å; V163-A165 PolarHBondContact O-N 3.2Å; A165-G167 PolarHBondContact O-N 3.47Å
166C75.8Confident74.2Confident1 Ų177.6 Ų77.61%0.00740%0.398CS..THydrogen-bonded Turntrans-74.8-2.4176.4-65.60000113.3Q143 C149 V163 I164 P170 K173Q143-C166 PolarHBondContact OE1-SG 2.88Å; C149-C166 WeakPolarHBondContact CA-SG 3.39Å; C149-C166 HydrophobicContact CB-CB 3.77Å; C149-C166 WeakPolarHBondContact CB-SG 3.49Å; C149-C166 WeakPolarHBondContact SG-CB 3.37Å; C149-C166 CovalentContact SG-SG 2.03Å; C149-C166 PolarHBondContact SG-SG 3.24Å; V163-C166 HydrophobicContact CG1-CB 3.81Å; V163-C166 WeakPolarHBondContact CG1-SG 3.38Å; I164-C166 VanDerWaalsContact C-N 3.31Å; I164-C166 PolarHBondContact O-N 3.46Å; C166-P170 HydrophobicContact CB-CB 3.86Å; C166-K173 WeakPolarHBondContact O-CD 3.47Å; C166-K173 WeakPolarHBondContact O-CE 3.32Å; C166-K173 PolarHBondContact O-NZ 3.16Å
167G74.7Confident74.7Confident46 Ų4675 Ų7547%0.47438%0.384SS..  trans62.9-153.4176.800000113.9I164 A165I164-G167 PolarHBondContact O-N 3.38Å; A165-G167 PolarHBondContact O-N 3.47Å
168M71.9Confident75.4Confident174 Ų17479.8 Ų79.886%0.85741%0.413SS*.SBendtrans-76141.6-178.9-63.1178.174.100111.3K173M168-K173 WeakPolarHBondContact O-CE 3.35Å
169K76.7Confident76.3Confident126 Ų12679.8 Ų79.855%0.54841%0.413SS..  trans55.861.3179.6-60.6177.8154.6-142.80114.9T171 E172K169-T171 PolarHBondContact O-N 3.18Å; K169-E172 IonicContact NZ-OE1 3.19Å; K169-E172 PolarHBondContact NZ-OE1 2.83Å; K169-E172 IonicContact NZ-OE2 2.6Å; K169-E172 PolarHBondContact NZ-OE2 3.43Å; K169-E172 PolarHBondContact O-N 2.8Å
170P71.8Confident77.3Confident42 Ų4272.3 Ų72.327%0.27337%0.373SS..G310 helixtrans-63.2-25.8-176.829-37.2000113.5V154 C166 E172 K173V154-P170 HydrophobicContact CG2-CB 3.91Å; C166-P170 HydrophobicContact CB-CB 3.86Å; P170-E172 VanDerWaalsContact C-N 3.31Å; P170-E172 PolarHBondContact O-N 2.66Å; P170-K173 PolarHBondContact O-N 3.43Å
171T76.5Confident78.6Confident102 Ų10269.6 Ų69.663%0.62636%0.364SS*.G310 helixtrans-72-17.9-179.253.20000114.7V154 K169V154-T171 HydrophobicContact CG1-CG2 4.39Å; K169-T171 PolarHBondContact O-N 3.18Å
172E79.6Confident80.1Confident137 Ų13763.8 Ų63.864%0.6435%0.35SS*.G310 helixtrans-93.6-7.1178-67.5176.5-158.900112.2K169 P170K169-E172 IonicContact NZ-OE1 3.19Å; K169-E172 PolarHBondContact NZ-OE1 2.83Å; K169-E172 IonicContact NZ-OE2 2.6Å; K169-E172 PolarHBondContact NZ-OE2 3.43Å; K169-E172 PolarHBondContact O-N 2.8Å; P170-E172 VanDerWaalsContact C-N 3.31Å; P170-E172 PolarHBondContact O-N 2.66Å
173K82.3Confident81.7Confident34 Ų3462.4 Ų62.415%0.14834%0.34CS..PPolyproline II helixtrans-85.7141-173.2-63.7-168.5178.6-1670112.4D147 C149 C166 M168 P170D147-K173 VanDerWaalsContact OD1-CE 3.29Å; D147-K173 WeakPolarHBondContact OD1-CE 3.1Å; D147-K173 IonicContact OD1-NZ 2.81Å; D147-K173 PolarHBondContact OD1-NZ 3.13Å; C149-K173 HydrophobicContact CB-CB 3.96Å; C166-K173 WeakPolarHBondContact O-CD 3.47Å; C166-K173 WeakPolarHBondContact O-CE 3.32Å; C166-K173 PolarHBondContact O-NZ 3.16Å; M168-K173 WeakPolarHBondContact O-CE 3.35Å; P170-K173 PolarHBondContact O-N 3.43Å
174K87.3Confident83.1Confident171 Ų17160.7 Ų60.774%0.74333%0.33SS*.PPolyproline II helixtrans-74.5157.5174.2-63.9-175.9179.3-177.60111.1C148 C149C148-K174 WeakPolarHBondContact CA-O 3.41Å; C148-K174 VanDerWaalsContact CB-O 3.26Å; C148-K174 WeakPolarHBondContact CB-O 3.38Å; C149-K174 PolarHBondContact N-O 3.41Å; C149-K174 VanDerWaalsContact N-O 3.09Å
175G90.1Very high84.4Confident4 Ų459 Ų594%0.04132%0.318CS..PPolyproline II helixtrans-60.3142.6171.500000114K151 L152 L177K151-G175 CarbonylContact O-C 3.54Å; K151-G175 WeakPolarHBondContact O-CA 3.4Å; L152-G175 VanDerWaalsContact C-CA 3.49Å; L152-G175 WeakPolarHBondContact O-CA 3.15Å; L152-G175 PolarHBondContact O-N 3.4Å; L152-G175 VanDerWaalsContact O-N 3.07Å; G175-L177 VanDerWaalsContact C-N 3.33Å; G175-L177 PolarHBondContact O-N 3.01Å
176C91.5Very high85.6Confident0 Ų061.8 Ų61.80%034%0.336CS..Hα-helixtrans-68.4-31.7179.5-66.30000113F118 I142 C148 G150 K151 T178 K179 V180F118-C176 HydrophobicContact CE1-CB 3.46Å; F118-C176 VanDerWaalsContact CE1-CB 3.46Å; F118-C176 HydrophobicContact CZ-CB 3.5Å; F118-C176 VanDerWaalsContact CZ-CB 3.5Å; I142-C176 HydrophobicContact CG2-CB 3.99Å; C148-C176 HydrophobicContact CB-CB 3.9Å; C148-C176 WeakPolarHBondContact CB-SG 3.4Å; C148-C176 WeakPolarHBondContact SG-CA 3.43Å; C148-C176 WeakPolarHBondContact SG-CB 3.42Å; C148-C176 CovalentContact SG-SG 2.03Å; C148-C176 PolarHBondContact SG-SG 3.18Å; G150-C176 VanDerWaalsContact O-CB 3.23Å; G150-C176 WeakPolarHBondContact O-CB 3.48Å; G150-C176 PolarHBondContact O-N 3.43Å; G150-C176 PolarHBondContact O-SG 2.89Å; G150-C176 VanDerWaalsContact O-SG 3.37Å; K151-C176 PolarHBondContact O-N 2.7Å; C176-T178 PolarHBondContact O-N 3.12Å; C176-K179 PolarHBondContact O-N 3.38Å; C176-V180 WeakPolarHBondContact O-CB 3.5Å; C176-V180 VanDerWaalsContact O-CG2 3.28Å; C176-V180 WeakPolarHBondContact O-CG2 3.23Å; C176-V180 PolarHBondContact O-N 2.85Å
177L91.9Very high86.4Confident1 Ų162 Ų621%0.00534%0.339CS..Hα-helixtrans-57.4-53-178.8177.762.9000111.3Y111 L114 N115 F118 K151 L152 G175 K179 V180 I181Y111-L177 HydrophobicContact CE2-CD2 4.27Å; L114-L177 HydrophobicContact CB-CD1 3.72Å; N115-L177 HydrophobicContact CB-CD1 4.34Å; N115-L177 HydrophobicContact CB-CD2 4.18Å; F118-L177 HydrophobicContact CD2-CB 4.02Å; F118-L177 HydrophobicContact CD2-CD1 3.59Å; F118-L177 HydrophobicContact CD2-CG 4.4Å; F118-L177 HydrophobicContact CE2-CB 4.17Å; F118-L177 HydrophobicContact CE2-CD1 4.04Å; K151-L177 HydrophobicContact CG-CB 4.1Å; K151-L177 HydrophobicContact CG-CD2 4.12Å; K151-L177 VanDerWaalsContact O-CB 3.25Å; K151-L177 WeakPolarHBondContact O-CB 3.34Å; K151-L177 PolarHBondContact O-N 3.21Å; L152-L177 HydrophobicContact CD2-CD2 4.25Å; G175-L177 VanDerWaalsContact C-N 3.33Å; G175-L177 PolarHBondContact O-N 3.01Å; L177-K179 VanDerWaalsContact C-N 3.31Å; L177-K179 PolarHBondContact O-N 3.45Å; L177-V180 PolarHBondContact O-N 3.18Å; L177-I181 HydrophobicContact CD1-CD1 3.62Å; L177-I181 HydrophobicContact CD1-CG1 4.15Å; L177-I181 HydrophobicContact CG-CD1 3.68Å; L177-I181 WeakPolarHBondContact O-CB 3.44Å; L177-I181 WeakPolarHBondContact O-CD1 3.07Å; L177-I181 WeakPolarHBondContact O-CG1 3.29Å; L177-I181 PolarHBondContact O-N 3.27Å
178T92.1Very high87.2Confident100 Ų10060.1 Ų60.161%0.61332%0.318SS*.Hα-helixtrans-63.1-38.3-179.1-54.50000112C176 G182C176-T178 PolarHBondContact O-N 3.12Å; T178-G182 PolarHBondContact O-N 3.35Å
179K91.9Very high88.2Confident110 Ų11058.7 Ų58.748%0.47831%0.307SS..Hα-helixtrans-69-46.1-179.2-170.765.7173.1-174.20111.5F146 C176 L177 G182 T183F146-K179 HydrophobicContact CB-CG 3.93Å; F146-K179 HydrophobicContact CD1-CG 3.76Å; F146-K179 HydrophobicContact CG-CG 4.18Å; C176-K179 PolarHBondContact O-N 3.38Å; L177-K179 VanDerWaalsContact C-N 3.31Å; L177-K179 PolarHBondContact O-N 3.45Å; K179-G182 PolarHBondContact O-N 2.79Å; K179-T183 PolarHBondContact O-N 3.45Å; K179-T183 PolarHBondContact O-OG1 3.42Å
180V92.4Very high89Confident0 Ų055.3 Ų55.30%030%0.299CS..Hα-helixtrans-64.8-46.7177.5176.50000110.6L41 L114 F118 I142 F146 C176 L177 G182 T183 T184L41-V180 HydrophobicContact CD1-CG1 3.76Å; L114-V180 HydrophobicContact CD1-CG1 3.89Å; L114-V180 HydrophobicContact CD2-CG1 4.43Å; F118-V180 HydrophobicContact CE2-CB 4.46Å; F118-V180 HydrophobicContact CE2-CG2 4.43Å; F118-V180 HydrophobicContact CZ-CG2 4.14Å; I142-V180 HydrophobicContact CG2-CG2 3.97Å; F146-V180 HydrophobicContact CD2-CG2 3.96Å; F146-V180 HydrophobicContact CE2-CG2 3.91Å; F146-V180 HydrophobicContact CG-CG2 4.39Å; F146-V180 HydrophobicContact CZ-CG2 4.32Å; C176-V180 WeakPolarHBondContact O-CB 3.5Å; C176-V180 VanDerWaalsContact O-CG2 3.28Å; C176-V180 WeakPolarHBondContact O-CG2 3.23Å; C176-V180 PolarHBondContact O-N 2.85Å; L177-V180 PolarHBondContact O-N 3.18Å; V180-G182 VanDerWaalsContact C-N 3.3Å; V180-G182 PolarHBondContact O-N 3.34Å; V180-T183 PolarHBondContact O-N 3.37Å; V180-T184 WeakPolarHBondContact O-CB 3.39Å; V180-T184 PolarHBondContact O-N 3.48Å; V180-T184 PolarHBondContact O-OG1 3.49Å; V180-T184 VanDerWaalsContact O-OG1 3.1Å
181I91.7Very high90.1Very high16 Ų1653.3 Ų53.38%0.08229%0.286CS..Hα-helixtrans-54.4-48174.6-71164.9000110.7I110 Y111 L114 L177 T183 T184 K185I110-I181 HydrophobicContact CG2-CG1 4.34Å; I110-I181 HydrophobicContact CG2-CG2 4.47Å; Y111-I181 HydrophobicContact CD2-CD1 3.57Å; Y111-I181 HydrophobicContact CE2-CD1 4.21Å; Y111-I181 HydrophobicContact CG-CD1 4.37Å; L114-I181 HydrophobicContact CB-CG1 4.2Å; L114-I181 HydrophobicContact CD1-CB 4.25Å; L114-I181 HydrophobicContact CD1-CG1 3.46Å; L114-I181 VanDerWaalsContact CD1-CG1 3.46Å; L114-I181 HydrophobicContact CG-CG1 4.38Å; L177-I181 HydrophobicContact CD1-CD1 3.62Å; L177-I181 HydrophobicContact CD1-CG1 4.15Å; L177-I181 HydrophobicContact CG-CD1 3.68Å; L177-I181 WeakPolarHBondContact O-CB 3.44Å; L177-I181 WeakPolarHBondContact O-CD1 3.07Å; L177-I181 WeakPolarHBondContact O-CG1 3.29Å; L177-I181 PolarHBondContact O-N 3.27Å; I181-T183 PolarHBondContact O-N 3.47Å; I181-T184 PolarHBondContact O-N 3.03Å; I181-K185 HydrophobicContact CG2-CD 3.79Å; I181-K185 HydrophobicContact CG2-CG 4.19Å; I181-K185 WeakPolarHBondContact O-CB 3.27Å; I181-K185 VanDerWaalsContact O-CG 3.3Å; I181-K185 WeakPolarHBondContact O-CG 3.19Å; I181-K185 PolarHBondContact O-N 3.24Å
182G92.1Very high91.1Very high39 Ų3948.7 Ų48.740%0.40226%0.257SS..Hα-helixtrans-60-46.7-178.700000112.5T178 K179 V180 K185 S186T178-G182 PolarHBondContact O-N 3.35Å; K179-G182 PolarHBondContact O-N 2.79Å; V180-G182 VanDerWaalsContact C-N 3.3Å; V180-G182 PolarHBondContact O-N 3.34Å; G182-K185 PolarHBondContact O-N 2.96Å; G182-S186 PolarHBondContact O-N 2.96Å; G182-S186 VanDerWaalsContact O-N 3.1Å
183T91.5Very high91.9Very high30 Ų3046.5 Ų46.518%0.18425%0.25CC..Hα-helixtrans-65-44178.2-62.90000112.1D37 Y38 F146 K179 V180 I181 S186 G187D37-T183 HydrophobicContact CB-CG2 3.6Å; Y38-T183 HydrophobicContact CD1-CG2 4.15Å; F146-T183 HydrophobicContact CE1-CG2 4.1Å; K179-T183 PolarHBondContact O-N 3.45Å; K179-T183 PolarHBondContact O-OG1 3.42Å; V180-T183 PolarHBondContact O-N 3.37Å; I181-T183 PolarHBondContact O-N 3.47Å; T183-S186 WeakPolarHBondContact O-CB 3.24Å; T183-S186 PolarHBondContact O-N 3.24Å; T183-G187 PolarHBondContact O-N 2.94Å
184T91Very high92.6Very high0 Ų046.3 Ų46.30%025%0.251CS..Hα-helixtrans-63.4-44.2177.1-62.10000111.9Y38 L49 I110 V180 I181 S186 G187 Q188Y38-T184 HydrophobicContact CD2-CG2 4.25Å; Y38-T184 HydrophobicContact CE2-CG2 4.23Å; L49-T184 HydrophobicContact CD2-CG2 3.82Å; I110-T184 HydrophobicContact CD1-CG2 4.16Å; I110-T184 HydrophobicContact CG2-CG2 4.41Å; V180-T184 WeakPolarHBondContact O-CB 3.39Å; V180-T184 PolarHBondContact O-N 3.48Å; V180-T184 PolarHBondContact O-OG1 3.49Å; V180-T184 VanDerWaalsContact O-OG1 3.1Å; I181-T184 PolarHBondContact O-N 3.03Å; T184-S186 VanDerWaalsContact C-N 3.28Å; T184-S186 PolarHBondContact O-N 2.97Å; T184-G187 PolarHBondContact O-N 2.98Å; T184-Q188 PolarHBondContact O-N 3.43Å
185K91.8Very high93Very high82 Ų8238.1 Ų38.136%0.35722%0.216SC..Hα-helixtrans-60.4-38.5176.8-77.4-176.4175.7-1660112.2S107 I110 I181 G182 Q188 F189S107-K185 WeakPolarHBondContact O-CE 3.48Å; S107-K185 PolarHBondContact O-NZ 3.44Å; I110-K185 HydrophobicContact CD1-CG 4.42Å; I181-K185 HydrophobicContact CG2-CD 3.79Å; I181-K185 HydrophobicContact CG2-CG 4.19Å; I181-K185 WeakPolarHBondContact O-CB 3.27Å; I181-K185 VanDerWaalsContact O-CG 3.3Å; I181-K185 WeakPolarHBondContact O-CG 3.19Å; I181-K185 PolarHBondContact O-N 3.24Å; G182-K185 PolarHBondContact O-N 2.96Å; K185-Q188 PolarHBondContact O-N 3.26Å; K185-F189 VanDerWaalsContact O-CB 3.28Å; K185-F189 WeakPolarHBondContact O-CB 3.38Å; K185-F189 PolarHBondContact O-N 3.13Å
186S92.3Very high93.4Very high82 Ų8240.7 Ų40.757%0.57323%0.228SC*.Hα-helixtrans-61.7-46.8176.6-174.30000112.1G182 T183 T184 F189 C190G182-S186 PolarHBondContact O-N 2.96Å; G182-S186 VanDerWaalsContact O-N 3.1Å; T183-S186 WeakPolarHBondContact O-CB 3.24Å; T183-S186 PolarHBondContact O-N 3.24Å; T184-S186 VanDerWaalsContact C-N 3.28Å; T184-S186 PolarHBondContact O-N 2.97Å; S186-F189 PolarHBondContact O-N 3.47Å; S186-C190 PolarHBondContact O-N 3.02Å; S186-C190 VanDerWaalsContact O-N 3.16Å
187G92.8Very high93.6Very high7 Ų744 Ų447%0.07225%0.25CS..Hα-helixtrans-63.6-45.3177.200000112.2T183 T184 F189 C190 V191T183-G187 PolarHBondContact O-N 2.94Å; T184-G187 PolarHBondContact O-N 2.98Å; G187-F189 PolarHBondContact O-N 2.86Å; G187-C190 VanDerWaalsContact O-CB 3.3Å; G187-C190 WeakPolarHBondContact O-CB 3.36Å; G187-C190 PolarHBondContact O-N 3.42Å; G187-V191 PolarHBondContact O-N 2.87Å; G187-V191 VanDerWaalsContact O-N 3.11Å
188Q91.4Very high93.9Very high6 Ų644.5 Ų44.53%0.02825%0.253CS..Hα-helixtrans-64.6-37.8177.2-72.2-170.9-10.700113.4L49 L103 I110 T184 K185 C190 V191 A192L49-Q188 PolarHBondContact O-NE2 2.71Å; L103-Q188 HydrophobicContact CD2-CB 4.31Å; L103-Q188 WeakPolarHBondContact CD2-O 3.34Å; I110-Q188 VanDerWaalsContact CD1-CD 3.44Å; T184-Q188 PolarHBondContact O-N 3.43Å; K185-Q188 PolarHBondContact O-N 3.26Å; Q188-C190 VanDerWaalsContact C-N 3.29Å; Q188-C190 PolarHBondContact O-N 3.34Å; Q188-V191 PolarHBondContact O-N 2.81Å; Q188-A192 WeakPolarHBondContact O-CB 3.45Å; Q188-A192 PolarHBondContact O-N 2.79Å
189F93.4Very high94.2Very high144 Ų14440 Ų4063%0.63223%0.225SC*.Hα-helixtrans-61.1-40.7174.6-179.9-100.2000111.4K185 S186 G187 A192 L193K185-F189 VanDerWaalsContact O-CB 3.28Å; K185-F189 WeakPolarHBondContact O-CB 3.38Å; K185-F189 PolarHBondContact O-N 3.13Å; S186-F189 PolarHBondContact O-N 3.47Å; G187-F189 PolarHBondContact O-N 2.86Å; F189-A192 PolarHBondContact O-N 3.4Å; F189-L193 HydrophobicContact CE1-CD2 4.44Å; F189-L193 WeakPolarHBondContact O-CB 3.35Å; F189-L193 PolarHBondContact O-N 2.93Å
190C94Very high94.4Very high55 Ų5539 Ų3937%0.37223%0.225SC..Hα-helixtrans-58.3-51.1174.3-174.70000111.5S186 G187 Q188 A192 L193 V194S186-C190 PolarHBondContact O-N 3.02Å; S186-C190 VanDerWaalsContact O-N 3.16Å; G187-C190 VanDerWaalsContact O-CB 3.3Å; G187-C190 WeakPolarHBondContact O-CB 3.36Å; G187-C190 PolarHBondContact O-N 3.42Å; Q188-C190 VanDerWaalsContact C-N 3.29Å; Q188-C190 PolarHBondContact O-N 3.34Å; C190-A192 PolarHBondContact O-N 2.95Å; C190-L193 PolarHBondContact O-N 3.35Å; C190-V194 VanDerWaalsContact O-CG2 3.31Å; C190-V194 WeakPolarHBondContact O-CG2 3.43Å; C190-V194 PolarHBondContact O-N 3.23Å
191V95.6Very high94.5Very high0 Ų043.3 Ų43.30%024%0.241CC..Hα-helixtrans-62.2-44179.11780000111.8V28 E32 I56 L103 G187 Q188 L193 V194 S195V28-V191 HydrophobicContact CG1-CG2 4Å; E32-V191 HydrophobicContact CB-CG2 4.48Å; E32-V191 HydrophobicContact CG-CG2 3.67Å; I56-V191 HydrophobicContact CB-CG1 4.18Å; I56-V191 HydrophobicContact CD1-CG1 3.96Å; I56-V191 HydrophobicContact CG2-CG1 3.82Å; L103-V191 HydrophobicContact CD2-CB 3.49Å; L103-V191 VanDerWaalsContact CD2-CB 3.49Å; L103-V191 HydrophobicContact CD2-CG1 3.43Å; L103-V191 VanDerWaalsContact CD2-CG1 3.43Å; G187-V191 PolarHBondContact O-N 2.87Å; G187-V191 VanDerWaalsContact O-N 3.11Å; Q188-V191 PolarHBondContact O-N 2.81Å; V191-L193 PolarHBondContact O-N 3.41Å; V191-V194 PolarHBondContact O-N 2.98Å; V191-S195 WeakPolarHBondContact O-CB 3.38Å; V191-S195 PolarHBondContact O-N 3.41Å; V191-S195 PolarHBondContact O-OG 3.28Å
192A95.7Very high94.8Very high4 Ų442.6 Ų42.63%0.03324%0.237CC..Hα-helixtrans-59.6-48.6178.300000111L103 Q188 F189 C190 V194 S195 I196L103-A192 HydrophobicContact CB-CB 3.92Å; L103-A192 HydrophobicContact CD2-CB 4.42Å; Q188-A192 WeakPolarHBondContact O-CB 3.45Å; Q188-A192 PolarHBondContact O-N 2.79Å; F189-A192 PolarHBondContact O-N 3.4Å; C190-A192 PolarHBondContact O-N 2.95Å; A192-V194 PolarHBondContact O-N 3.39Å; A192-S195 PolarHBondContact O-N 3.01Å; A192-S195 PolarHBondContact O-OG 3.09Å; A192-I196 WeakPolarHBondContact O-CG1 3.38Å; A192-I196 PolarHBondContact O-N 3.35Å
193L96.5Very high94.9Very high92 Ų9247 Ų4748%0.48225%0.246SC..Hα-helixtrans-60.5-47.8178.8-177.563.7000111.8F189 C190 V191 S195 I196 C197F189-L193 HydrophobicContact CE1-CD2 4.44Å; F189-L193 WeakPolarHBondContact O-CB 3.35Å; F189-L193 PolarHBondContact O-N 2.93Å; C190-L193 PolarHBondContact O-N 3.35Å; V191-L193 PolarHBondContact O-N 3.41Å; L193-S195 PolarHBondContact O-N 2.85Å; L193-I196 PolarHBondContact O-N 3.35Å; L193-C197 WeakPolarHBondContact O-CB 3.3Å; L193-C197 PolarHBondContact O-N 3.5Å; L193-C197 PolarHBondContact O-SG 3.45Å
194V97.1Very high95.1Very high29 Ų2951.3 Ų51.318%0.17626%0.262CS..Hα-helixtrans-60.7-46.2179.2172.90000110.9I24 I56 C190 V191 A192 I196 C197 I198I24-V194 HydrophobicContact CG2-CG1 4.22Å; I56-V194 HydrophobicContact CD1-CB 4.34Å; I56-V194 HydrophobicContact CD1-CG1 3.98Å; C190-V194 VanDerWaalsContact O-CG2 3.31Å; C190-V194 WeakPolarHBondContact O-CG2 3.43Å; C190-V194 PolarHBondContact O-N 3.23Å; V191-V194 PolarHBondContact O-N 2.98Å; A192-V194 PolarHBondContact O-N 3.39Å; V194-I196 PolarHBondContact O-N 3.41Å; V194-C197 PolarHBondContact O-N 3.24Å; V194-I198 HydrophobicContact CG1-CD1 3.74Å; V194-I198 HydrophobicContact CG1-CG1 4.41Å; V194-I198 VanDerWaalsContact O-CG1 3.29Å; V194-I198 WeakPolarHBondContact O-CG1 3.15Å; V194-I198 PolarHBondContact O-N 3.31Å
195S97.1Very high95.3Very high0 Ų051.3 Ų51.30%026%0.262CS..Hα-helixtrans-61.9-42.5-179.966.90000113G100 V191 A192 L193 I198 A199G100-S195 WeakPolarHBondContact CA-OG 3.41Å; G100-S195 PolarHBondContact N-OG 3.36Å; V191-S195 WeakPolarHBondContact O-CB 3.38Å; V191-S195 PolarHBondContact O-N 3.41Å; V191-S195 PolarHBondContact O-OG 3.28Å; A192-S195 PolarHBondContact O-N 3.01Å; A192-S195 PolarHBondContact O-OG 3.09Å; L193-S195 PolarHBondContact O-N 2.85Å; S195-I198 PolarHBondContact O-N 3.35Å; S195-A199 WeakPolarHBondContact O-CB 3.37Å; S195-A199 PolarHBondContact O-N 3.42Å
196I97Very high95.5Very high58 Ų5848.9 Ų48.930%0.29725%0.253SS..Hα-helixtrans-66.4-44.6177.6-67.2168.5000110.6A192 L193 V194 I198 A199 I200A192-I196 WeakPolarHBondContact O-CG1 3.38Å; A192-I196 PolarHBondContact O-N 3.35Å; L193-I196 PolarHBondContact O-N 3.35Å; V194-I196 PolarHBondContact O-N 3.41Å; I196-I198 VanDerWaalsContact C-N 3.35Å; I196-I198 PolarHBondContact O-N 3.23Å; I196-A199 PolarHBondContact O-N 3.45Å; I196-I200 HydrophobicContact CG2-CD1 3.82Å; I196-I200 HydrophobicContact CG2-CG1 4.42Å; I196-I200 WeakPolarHBondContact O-CG1 2.96Å; I196-I200 PolarHBondContact O-N 3.48Å
197C97.4Very high95.6Very high70 Ų7047.8 Ų47.847%0.47324%0.242SC..Hα-helixtrans-59.1-44.8177-73.80000112L193 V194 I200 W201L193-C197 WeakPolarHBondContact O-CB 3.3Å; L193-C197 PolarHBondContact O-N 3.5Å; L193-C197 PolarHBondContact O-SG 3.45Å; V194-C197 PolarHBondContact O-N 3.24Å; C197-I200 PolarHBondContact O-N 2.89Å; C197-W201 PolarHBondContact O-N 3.34Å
198I97.5Very high95.6Very high10 Ų1049.9 Ų49.95%0.05125%0.251CS..Hα-helixtrans-65.5-41.2177.3-64.5171.2000110.6T21 A25 L96 V194 S195 I196 I200 W201 Q202T21-I198 HydrophobicContact CG2-CG1 4.34Å; A25-I198 HydrophobicContact CB-CD1 3.94Å; L96-I198 HydrophobicContact CD1-CB 4.05Å; L96-I198 HydrophobicContact CD1-CG2 3.47Å; L96-I198 VanDerWaalsContact CD1-CG2 3.47Å; V194-I198 HydrophobicContact CG1-CD1 3.74Å; V194-I198 HydrophobicContact CG1-CG1 4.41Å; V194-I198 VanDerWaalsContact O-CG1 3.29Å; V194-I198 WeakPolarHBondContact O-CG1 3.15Å; V194-I198 PolarHBondContact O-N 3.31Å; S195-I198 PolarHBondContact O-N 3.35Å; I196-I198 VanDerWaalsContact C-N 3.35Å; I196-I198 PolarHBondContact O-N 3.23Å; I198-I200 PolarHBondContact O-N 3.37Å; I198-W201 WeakPolarHBondContact O-CB 3.25Å; I198-W201 PolarHBondContact O-N 2.87Å; I198-Q202 HydrophobicContact CG2-CG 4.39Å; I198-Q202 WeakPolarHBondContact O-CG 3.46Å; I198-Q202 PolarHBondContact O-N 3.4Å
199A97.4Very high95.7Very high5 Ų549.6 Ų49.64%0.04125%0.25CC..Hα-helixtrans-63.5-41.5177.600000113.2L96 L97 S195 I196 W201 Q202 F203L96-A199 HydrophobicContact CB-CB 4.15Å; L97-A199 HydrophobicContact CD1-CB 4.44Å; L97-A199 HydrophobicContact CD2-CB 3.39Å; L97-A199 HydrophobicContact CG-CB 3.5Å; L97-A199 VanDerWaalsContact CG-CB 3.5Å; S195-A199 WeakPolarHBondContact O-CB 3.37Å; S195-A199 PolarHBondContact O-N 3.42Å; I196-A199 PolarHBondContact O-N 3.45Å; A199-W201 VanDerWaalsContact C-N 3.33Å; A199-Q202 WeakPolarHBondContact O-CB 3.32Å; A199-Q202 PolarHBondContact O-N 3.13Å; A199-F203 PolarHBondContact O-N 3.25Å
200I96.3Very high95.7Very high91 Ų9144.9 Ų44.947%0.46724%0.235SC..Hα-helixtrans-62.3-43.8174.3-68.1167.8000110.1I196 C197 I198 Q202 F203 F204I196-I200 HydrophobicContact CG2-CD1 3.82Å; I196-I200 HydrophobicContact CG2-CG1 4.42Å; I196-I200 WeakPolarHBondContact O-CG1 2.96Å; I196-I200 PolarHBondContact O-N 3.48Å; C197-I200 PolarHBondContact O-N 2.89Å; I198-I200 PolarHBondContact O-N 3.37Å; I200-Q202 VanDerWaalsContact C-N 3.31Å; I200-Q202 PolarHBondContact O-N 3.42Å; I200-F203 WeakPolarHBondContact O-CB 3.47Å; I200-F203 PolarHBondContact O-N 3.36Å; I200-F204 HydrophobicContact CG2-CE2 3.91Å; I200-F204 WeakPolarHBondContact O-CD2 3.3Å; I200-F204 PolarHBondContact O-N 3.45Å
201W95.9Very high95.6Very high90 Ų9048.2 Ų48.234%0.34124%0.243SC..Hα-helixtrans-58.3-43.1173.8176.8-102.8000112.1F14 F17 C197 I198 A199 F203 F204 G205F14-W201 AromaticContact CD2-CE2 3.76Å; F14-W201 AromaticContact CD2-CZ2 3.71Å; F14-W201 HydrophobicContact CD2-CZ2 3.71Å; F14-W201 AromaticContact CD2-NE1 3.72Å; F14-W201 AromaticContact CE2-CD1 3.85Å; F14-W201 HydrophobicContact CE2-CD2 4.4Å; F14-W201 AromaticContact CE2-CE2 3.73Å; F14-W201 HydrophobicContact CE2-CG 4.46Å; F14-W201 HydrophobicContact CE2-CZ2 4.18Å; F14-W201 AromaticContact CE2-NE1 3.34Å; F14-W201 VanDerWaalsContact CE2-NE1 3.34Å; F17-W201 HydrophobicContact CB-CH2 4.48Å; F17-W201 HydrophobicContact CB-CZ2 3.57Å; F17-W201 HydrophobicContact CD2-CH2 4.33Å; F17-W201 HydrophobicContact CD2-CZ2 4.1Å; F17-W201 HydrophobicContact CG-CZ2 4.03Å; C197-W201 PolarHBondContact O-N 3.34Å; I198-W201 WeakPolarHBondContact O-CB 3.25Å; I198-W201 PolarHBondContact O-N 2.87Å; A199-W201 VanDerWaalsContact C-N 3.33Å; W201-F203 VanDerWaalsContact C-N 3.31Å; W201-F203 PolarHBondContact O-N 3Å; W201-F204 WeakPolarHBondContact O-CB 3.46Å; W201-F204 PolarHBondContact O-N 3.39Å; W201-G205 PolarHBondContact O-N 3.35Å
202Q96.1Very high95.4Very high0 Ų049.2 Ų49.20%025%0.248CC..Hα-helixtrans-64.3-33.5177.2-73.6176.48.400112.8Y18 I198 A199 I200 F204 G205 I206Y18-Q202 HydrophobicContact CD2-CG 4.26Å; Y18-Q202 HydrophobicContact CE2-CG 4.04Å; I198-Q202 HydrophobicContact CG2-CG 4.39Å; I198-Q202 WeakPolarHBondContact O-CG 3.46Å; I198-Q202 PolarHBondContact O-N 3.4Å; A199-Q202 WeakPolarHBondContact O-CB 3.32Å; A199-Q202 PolarHBondContact O-N 3.13Å; I200-Q202 VanDerWaalsContact C-N 3.31Å; I200-Q202 PolarHBondContact O-N 3.42Å; Q202-F204 VanDerWaalsContact C-N 3.31Å; Q202-F204 PolarHBondContact O-N 3Å; Q202-G205 CarbonylContact O-C 3.31Å; Q202-G205 WeakPolarHBondContact O-CA 3.26Å; Q202-G205 PolarHBondContact O-N 3.26Å; Q202-I206 WeakPolarHBondContact O-CG1 3.36Å; Q202-I206 PolarHBondContact O-N 3.03Å
203F95.6Very high95Very high133 Ų13350.2 Ų50.258%0.58325%0.254SS*.Hα-helixtrans-57.8-43.1174.1-178-99000112A199 I200 W201 G205 I206 V207A199-F203 PolarHBondContact O-N 3.25Å; I200-F203 WeakPolarHBondContact O-CB 3.47Å; I200-F203 PolarHBondContact O-N 3.36Å; W201-F203 VanDerWaalsContact C-N 3.31Å; W201-F203 PolarHBondContact O-N 3Å; F203-G205 VanDerWaalsContact C-N 3.28Å; F203-G205 PolarHBondContact O-N 3.27Å; F203-I206 PolarHBondContact O-N 2.78Å; F203-V207 HydrophobicContact CD1-CG2 4.49Å; F203-V207 HydrophobicContact CE1-CG2 4.12Å; F203-V207 HydrophobicContact CZ-CG2 4.28Å; F203-V207 WeakPolarHBondContact O-CG2 3.31Å; F203-V207 PolarHBondContact O-N 2.9Å; F203-V207 VanDerWaalsContact O-N 3.1Å
204F94.5Very high94.7Very high120 Ų12049.4 Ų49.453%0.52626%0.255SS..Hα-helixtrans-60.6-40.2172.7-67.3-74.8000111.9I200 W201 Q202 V207 I208I200-F204 HydrophobicContact CG2-CE2 3.91Å; I200-F204 WeakPolarHBondContact O-CD2 3.3Å; I200-F204 PolarHBondContact O-N 3.45Å; W201-F204 WeakPolarHBondContact O-CB 3.46Å; W201-F204 PolarHBondContact O-N 3.39Å; Q202-F204 VanDerWaalsContact C-N 3.31Å; Q202-F204 PolarHBondContact O-N 3Å; F204-V207 PolarHBondContact O-N 3.03Å; F204-I208 WeakPolarHBondContact O-CG1 3.1Å; F204-I208 PolarHBondContact O-N 3.41Å; F204-I208 VanDerWaalsContact O-N 3.12Å
205G95.2Very high94.2Very high0 Ų049.7 Ų49.70%026%0.258CS..Hα-helixtrans-56.7-50.4172.500000113.3W201 Q202 F203 V207 I208 Y209W201-G205 PolarHBondContact O-N 3.35Å; Q202-G205 CarbonylContact O-C 3.31Å; Q202-G205 WeakPolarHBondContact O-CA 3.26Å; Q202-G205 PolarHBondContact O-N 3.26Å; F203-G205 VanDerWaalsContact C-N 3.28Å; F203-G205 PolarHBondContact O-N 3.27Å; G205-V207 VanDerWaalsContact C-N 3.28Å; G205-V207 PolarHBondContact O-N 3.36Å; G205-I208 PolarHBondContact O-N 2.92Å; G205-Y209 WeakPolarHBondContact O-CB 3.47Å; G205-Y209 WeakPolarHBondContact O-CD2 3.36Å; G205-Y209 PolarHBondContact O-N 2.95Å
206I95.8Very high93.6Very high31 Ų3149.9 Ų49.916%0.15926%0.259CS..Hα-helixtrans-55.9-45179.4-69.9165.5000110.2Y86 L89 V90 Q202 F203 Y209 S210Y86-I206 HydrophobicContact CE2-CB 4.29Å; Y86-I206 HydrophobicContact CE2-CG2 3.57Å; Y86-I206 WeakPolarHBondContact CE2-O 3.31Å; L89-I206 HydrophobicContact CB-CG1 4.16Å; V90-I206 HydrophobicContact CB-CD1 4.47Å; V90-I206 HydrophobicContact CG2-CD1 3.83Å; V90-I206 HydrophobicContact CG2-CG1 4.01Å; V90-I206 HydrophobicContact CG2-CG2 4.27Å; Q202-I206 WeakPolarHBondContact O-CG1 3.36Å; Q202-I206 PolarHBondContact O-N 3.03Å; F203-I206 PolarHBondContact O-N 2.78Å; I206-Y209 PolarHBondContact O-N 3.29Å; I206-S210 WeakPolarHBondContact O-CB 3.43Å; I206-S210 PolarHBondContact O-N 3.49Å
207V95Very high93Very high58 Ų5854.2 Ų54.235%0.35227%0.272SS..Hα-helixtrans-60.6-50.7177.3174.40000111F203 F204 G205 Y209 S210 F211F203-V207 HydrophobicContact CD1-CG2 4.49Å; F203-V207 HydrophobicContact CE1-CG2 4.12Å; F203-V207 HydrophobicContact CZ-CG2 4.28Å; F203-V207 WeakPolarHBondContact O-CG2 3.31Å; F203-V207 PolarHBondContact O-N 2.9Å; F203-V207 VanDerWaalsContact O-N 3.1Å; F204-V207 PolarHBondContact O-N 3.03Å; G205-V207 VanDerWaalsContact C-N 3.28Å; G205-V207 PolarHBondContact O-N 3.36Å; V207-Y209 PolarHBondContact O-N 2.99Å; V207-S210 WeakPolarHBondContact O-CB 3.41Å; V207-S210 PolarHBondContact O-N 2.99Å; V207-F211 HydrophobicContact CG1-CD2 3.98Å; V207-F211 HydrophobicContact CG1-CE2 3.54Å; V207-F211 WeakPolarHBondContact O-CD2 3.43Å; V207-F211 PolarHBondContact O-N 3.28Å
208I93.3Very high92.4Very high51 Ų5155 Ų5526%0.26227%0.271SS..Hα-helixtrans-63.6-41.9-179-60.4167.5000111.2L11 F204 G205 F211 F212L11-I208 HydrophobicContact CD2-CB 4.38Å; L11-I208 HydrophobicContact CD2-CG2 3.54Å; L11-I208 HydrophobicContact CG-CG2 3.8Å; F204-I208 WeakPolarHBondContact O-CG1 3.1Å; F204-I208 PolarHBondContact O-N 3.41Å; F204-I208 VanDerWaalsContact O-N 3.12Å; G205-I208 PolarHBondContact O-N 2.92Å; I208-F211 PolarHBondContact O-N 3.29Å; I208-F212 PolarHBondContact O-N 3.09Å
209Y94.2Very high91.6Very high0 Ų058.4 Ų58.40%029%0.287CS..Hα-helixtrans-67.1-34.7177.2-92-81.3000113L11 F14 N15 F85 L89 G205 I206 V207 F212 T213L11-Y209 HydrophobicContact CD2-CD1 4.19Å; L11-Y209 HydrophobicContact CD2-CD2 3.77Å; L11-Y209 HydrophobicContact CD2-CE1 4.12Å; L11-Y209 HydrophobicContact CD2-CE2 3.7Å; L11-Y209 HydrophobicContact CD2-CG 4.03Å; F14-Y209 AromaticContact CD1-CE2 3.9Å; F14-Y209 HydrophobicContact CD1-CE2 3.9Å; F14-Y209 HydrophobicContact CE1-CD2 4.44Å; F14-Y209 AromaticContact CE1-CE2 4Å; F14-Y209 HydrophobicContact CE1-CE2 4Å; N15-Y209 PolarHBondContact ND2-OH 3.27Å; N15-Y209 PolarHBondContact OD1-OH 3.42Å; F85-Y209 HydrophobicContact CD1-CD1 4.42Å; F85-Y209 AromaticContact CD1-CE1 3.69Å; F85-Y209 HydrophobicContact CD1-CE1 3.69Å; F85-Y209 AromaticContact CD1-CE2 3.81Å; F85-Y209 HydrophobicContact CD1-CE2 3.81Å; F85-Y209 AromaticContact CD1-CZ 3.31Å; F85-Y209 WeakPolarHBondContact CD1-OH 3.28Å; F85-Y209 HydrophobicContact CE1-CD2 4.42Å; F85-Y209 HydrophobicContact CE1-CE1 4.21Å; F85-Y209 AromaticContact CE1-CE2 3.5Å; F85-Y209 HydrophobicContact CE1-CE2 3.5Å; F85-Y209 VanDerWaalsContact CE1-CE2 3.5Å; F85-Y209 AromaticContact CE1-CZ 3.35Å; F85-Y209 WeakPolarHBondContact CE1-OH 3.47Å; L89-Y209 HydrophobicContact CD1-CD2 3.61Å; L89-Y209 HydrophobicContact CD1-CE2 3.82Å; L89-Y209 HydrophobicContact CD1-CG 4.3Å; G205-Y209 WeakPolarHBondContact O-CB 3.47Å; G205-Y209 WeakPolarHBondContact O-CD2 3.36Å; G205-Y209 PolarHBondContact O-N 2.95Å; I206-Y209 PolarHBondContact O-N 3.29Å; V207-Y209 PolarHBondContact O-N 2.99Å; Y209-F212 PolarHBondContact O-N 3.37Å; Y209-T213 WeakPolarHBondContact O-CB 3.46Å; Y209-T213 WeakPolarHBondContact O-CG2 3.17Å; Y209-T213 PolarHBondContact O-N 3.24Å; Y209-T213 PolarHBondContact O-OG1 2.94Å
210S93Very high90.8Very high46 Ų4661.5 Ų61.532%0.32230%0.3SS..Hα-helixtrans-60.3-48.1173-1700000110.6I206 V207 F212 T213 C214I206-S210 WeakPolarHBondContact O-CB 3.43Å; I206-S210 PolarHBondContact O-N 3.49Å; V207-S210 WeakPolarHBondContact O-CB 3.41Å; V207-S210 PolarHBondContact O-N 2.99Å; S210-F212 VanDerWaalsContact C-N 3.35Å; S210-F212 PolarHBondContact O-N 3.27Å; S210-T213 PolarHBondContact O-N 2.94Å; S210-T213 PolarHBondContact O-OG1 3.28Å; S210-C214 WeakPolarHBondContact O-CB 3.49Å; S210-C214 PolarHBondContact O-N 3.04Å; S210-C214 PolarHBondContact O-SG 3.18Å
211F91.1Very high90.1Very high125 Ų12559 Ų5955%0.54829%0.288SS..Hα-helixtrans-61.5-42.8176.1-73.1-66.5000112.4V207 I208 S215V207-F211 HydrophobicContact CG1-CD2 3.98Å; V207-F211 HydrophobicContact CG1-CE2 3.54Å; V207-F211 WeakPolarHBondContact O-CD2 3.43Å; V207-F211 PolarHBondContact O-N 3.28Å; I208-F211 PolarHBondContact O-N 3.29Å; F211-S215 WeakPolarHBondContact O-CB 3.29Å; F211-S215 PolarHBondContact O-N 3.31Å; F211-S215 PolarHBondContact O-OG 3.02Å
212F90.6Very high89.4Confident20 Ų2059.6 Ų59.69%0.08829%0.294CS..Hα-helixtrans-61.2-49.5177.9-179.9-105.9000112.1I7 L11 I208 Y209 S210 S215 N216I7-F212 HydrophobicContact CG2-CB 4.47Å; I7-F212 HydrophobicContact CG2-CD2 4.14Å; L11-F212 HydrophobicContact CD1-CB 3.82Å; L11-F212 HydrophobicContact CD1-CD1 4.2Å; L11-F212 HydrophobicContact CD1-CD2 3.53Å; L11-F212 HydrophobicContact CD1-CE2 4.12Å; L11-F212 HydrophobicContact CD1-CG 3.57Å; I208-F212 PolarHBondContact O-N 3.09Å; Y209-F212 PolarHBondContact O-N 3.37Å; S210-F212 VanDerWaalsContact C-N 3.35Å; S210-F212 PolarHBondContact O-N 3.27Å; F212-S215 PolarHBondContact O-N 3.18Å; F212-S215 PolarHBondContact O-OG 3.25Å; F212-N216 WeakPolarHBondContact O-CB 3.21Å; F212-N216 PolarHBondContact O-N 3.31Å
213T89Confident88.6Confident26 Ų2665.1 Ų65.116%0.1632%0.32CS..Hα-helixtrans-65.2-40.8-179.8520000112I83 Y209 S210 N216 W217I83-T213 HydrophobicContact CG1-CG2 4.13Å; Y209-T213 WeakPolarHBondContact O-CB 3.46Å; Y209-T213 WeakPolarHBondContact O-CG2 3.17Å; Y209-T213 PolarHBondContact O-N 3.24Å; Y209-T213 PolarHBondContact O-OG1 2.94Å; S210-T213 PolarHBondContact O-N 2.94Å; S210-T213 PolarHBondContact O-OG1 3.28Å; T213-N216 PolarHBondContact O-N 3.48Å; T213-W217 WeakPolarHBondContact O-CB 3.45Å; T213-W217 PolarHBondContact O-N 3.33Å
214C89.4Confident87.9Confident75 Ų7563.7 Ų63.751%0.50732%0.315SS..Hα-helixtrans-60.6-45.7172.6-70.60000112.3S210 N216 W217 N218S210-C214 WeakPolarHBondContact O-CB 3.49Å; S210-C214 PolarHBondContact O-N 3.04Å; S210-C214 PolarHBondContact O-SG 3.18Å; C214-N216 VanDerWaalsContact C-N 3.34Å; C214-N216 PolarHBondContact O-N 3.37Å; C214-W217 WeakPolarHBondContact O-CB 3.43Å; C214-W217 PolarHBondContact O-N 2.62Å; C214-N218 PolarHBondContact O-N 3.21Å
215S87.2Confident87.4Confident34 Ų3464.9 Ų64.924%0.23832%0.32CS..Hα-helixtrans-64.6-38.7179.173.50000112.4F211 F212 H219F211-S215 WeakPolarHBondContact O-CB 3.29Å; F211-S215 PolarHBondContact O-N 3.31Å; F211-S215 PolarHBondContact O-OG 3.02Å; F212-S215 PolarHBondContact O-N 3.18Å; F212-S215 PolarHBondContact O-OG 3.25Å; S215-H219 PolarHBondContact O-N 3.17Å
216N84.4Confident87Confident5 Ų569.7 Ų69.73%0.02735%0.346CS..Hα-helixtrans-71-33.8177.8-15825.2000111.4R77 R79 F212 T213 C214 Q220R77-N216 PolarHBondContact O-ND2 3.45Å; R79-N216 HydrophobicContact CG-CB 4.42Å; R79-N216 WeakPolarHBondContact CG-ND2 3.3Å; F212-N216 WeakPolarHBondContact O-CB 3.21Å; F212-N216 PolarHBondContact O-N 3.31Å; T213-N216 PolarHBondContact O-N 3.48Å; C214-N216 VanDerWaalsContact C-N 3.34Å; C214-N216 PolarHBondContact O-N 3.37Å; N216-Q220 WeakPolarHBondContact O-CG 3.4Å; N216-Q220 PolarHBondContact O-N 3.39Å; N216-Q220 VanDerWaalsContact O-N 3.12Å
217W84Confident86.6Confident149 Ų14974.5 Ų74.556%0.56436%0.363SS*.Hα-helixtrans-63.1-49173.6-175.388.9000111.8T213 C214 H219 Q220 N221T213-W217 WeakPolarHBondContact O-CB 3.45Å; T213-W217 PolarHBondContact O-N 3.33Å; C214-W217 WeakPolarHBondContact O-CB 3.43Å; C214-W217 PolarHBondContact O-N 2.62Å; W217-H219 VanDerWaalsContact C-N 3.31Å; W217-H219 PolarHBondContact O-N 2.92Å; W217-Q220 PolarHBondContact O-N 3.46Å; W217-N221 VanDerWaalsContact CD2-ND2 3.29Å; W217-N221 WeakPolarHBondContact CH2-ND2 3.17Å; W217-N221 WeakPolarHBondContact CZ2-ND2 3.39Å; W217-N221 VanDerWaalsContact CZ3-ND2 3.31Å; W217-N221 WeakPolarHBondContact CZ3-ND2 3.28Å; W217-N221 PolarHBondContact O-N 2.87Å
218N85Confident86.4Confident85 Ų8575.4 Ų75.446%0.45536%0.363SS..Hα-helixtrans-58.5-45.1178.8-167.748.9000111.4C214 Q220 N221 H222C214-N218 PolarHBondContact O-N 3.21Å; N218-Q220 PolarHBondContact O-N 3.09Å; N218-N221 PolarHBondContact O-N 3.45Å; N218-H222 PolarHBondContact ND2-NE2 3.32Å; N218-H222 PolarHBondContact O-CD2 3.46Å; N218-H222 PolarHBondContact O-N 3.43Å; N218-H222 VanDerWaalsContact O-N 3.09Å
219H80.6Confident86.3Confident83 Ų8380.4 Ų80.438%0.38438%0.38SS..Hα-helixtrans-61.1-43.9178.7-171.5-79.7000113S215 W217 H223S215-H219 PolarHBondContact O-N 3.17Å; W217-H219 VanDerWaalsContact C-N 3.31Å; W217-H219 PolarHBondContact O-N 2.92Å; H219-H223 AromaticContact CE1-CD2 3.34Å; H219-H223 PolarHBondContact CE1-CD2 3.04Å; H219-H223 AromaticContact CE1-NE2 3.25Å; H219-H223 PolarHBondContact CE1-NE2 3.45Å; H219-H223 AromaticContact ND1-CD2 3.52Å; H219-H223 AromaticContact ND1-NE2 3.93Å; H219-H223 AromaticContact NE2-NE2 3.92Å; H219-H223 PolarHBondContact O-CD2 3.12Å; H219-H223 PolarHBondContact O-N 3.45Å
220Q80.7Confident86.2Confident70 Ų7082.8 Ų82.833%0.32740%0.397SS..Hα-helixtrans-70.7-33.3179.2-69-155.61.800112.7R79 N216 W217 N218 H223 H224R79-Q220 VanDerWaalsContact NE-CD 3.25Å; N216-Q220 WeakPolarHBondContact O-CG 3.4Å; N216-Q220 PolarHBondContact O-N 3.39Å; N216-Q220 VanDerWaalsContact O-N 3.12Å; W217-Q220 PolarHBondContact O-N 3.46Å; N218-Q220 PolarHBondContact O-N 3.09Å; Q220-H223 PolarHBondContact O-N 3.3Å; Q220-H224 WeakPolarHBondContact O-CB 3.49Å; Q220-H224 PolarHBondContact O-N 3.2Å
221N82.2Confident86.2Confident37 Ų3785 Ų8520%0.19840%0.401CS..Hα-helixtrans-66.5-43.6176.2-75.3-2000111.9W217 N218 H223 H224 F225W217-N221 VanDerWaalsContact CD2-ND2 3.29Å; W217-N221 WeakPolarHBondContact CH2-ND2 3.17Å; W217-N221 WeakPolarHBondContact CZ2-ND2 3.39Å; W217-N221 VanDerWaalsContact CZ3-ND2 3.31Å; W217-N221 WeakPolarHBondContact CZ3-ND2 3.28Å; W217-N221 PolarHBondContact O-N 2.87Å; N218-N221 PolarHBondContact O-N 3.45Å; N221-H223 PolarHBondContact O-N 3.32Å; N221-H224 PolarHBondContact O-N 3.5Å; N221-H224 VanDerWaalsContact O-N 3.17Å; N221-F225 WeakPolarHBondContact O-CD2 3.23Å; N221-F225 PolarHBondContact O-N 3.25Å
222H80.3Confident86.4Confident104 Ų10487.2 Ų87.248%0.48141%0.405SS..Hα-helixtrans-56-50.1174.2-80.8-70.7000111.5N218 H224 F225 D226N218-H222 PolarHBondContact ND2-NE2 3.32Å; N218-H222 PolarHBondContact O-CD2 3.46Å; N218-H222 PolarHBondContact O-N 3.43Å; N218-H222 VanDerWaalsContact O-N 3.09Å; H222-H224 VanDerWaalsContact C-N 3.31Å; H222-H224 PolarHBondContact O-N 2.82Å; H222-F225 PolarHBondContact O-N 2.89Å; H222-D226 VanDerWaalsContact O-CG 3.22Å; H222-D226 PolarHBondContact O-N 3.4Å
223H79Confident86.5Confident115 Ų11590.3 Ų90.353%0.53242%0.421SS..Hα-helixtrans-60-38.8176-87.2-75.2000113.6H219 Q220 N221 Y227H219-H223 AromaticContact CE1-CD2 3.34Å; H219-H223 PolarHBondContact CE1-CD2 3.04Å; H219-H223 AromaticContact CE1-NE2 3.25Å; H219-H223 PolarHBondContact CE1-NE2 3.45Å; H219-H223 AromaticContact ND1-CD2 3.52Å; H219-H223 AromaticContact ND1-NE2 3.93Å; H219-H223 AromaticContact NE2-NE2 3.92Å; H219-H223 PolarHBondContact O-CD2 3.12Å; H219-H223 PolarHBondContact O-N 3.45Å; Q220-H223 PolarHBondContact O-N 3.3Å; N221-H223 PolarHBondContact O-N 3.32Å; H223-Y227 VanDerWaalsContact O-CB 3.26Å; H223-Y227 WeakPolarHBondContact O-CB 3.45Å; H223-Y227 PolarHBondContact O-N 3.41Å
224H81.5Confident86.8Confident104 Ų10495 Ų9548%0.48144%0.441SS..Hα-helixtrans-67.6-41.4177.1-175.9-94.2000111.6Q220 N221 H222 Y227 Q228Q220-H224 WeakPolarHBondContact O-CB 3.49Å; Q220-H224 PolarHBondContact O-N 3.2Å; N221-H224 PolarHBondContact O-N 3.5Å; N221-H224 VanDerWaalsContact O-N 3.17Å; H222-H224 VanDerWaalsContact C-N 3.31Å; H222-H224 PolarHBondContact O-N 2.82Å; H224-Y227 PolarHBondContact O-N 2.94Å; H224-Q228 PolarHBondContact NE2-NE2 3.01Å; H224-Q228 WeakPolarHBondContact O-CB 3.46Å; H224-Q228 VanDerWaalsContact O-CG 3.23Å; H224-Q228 WeakPolarHBondContact O-CG 3.26Å; H224-Q228 PolarHBondContact O-N 2.85Å
225F84.8Confident87Confident144 Ų14497.7 Ų97.763%0.63244%0.44SS*.Hα-helixtrans-62.4-46.2174.2-83.4-68.4000111.8N221 H222 Y227 Q228 Y229N221-F225 WeakPolarHBondContact O-CD2 3.23Å; N221-F225 PolarHBondContact O-N 3.25Å; H222-F225 PolarHBondContact O-N 2.89Å; F225-Y227 VanDerWaalsContact C-N 3.3Å; F225-Y227 PolarHBondContact O-N 3.19Å; F225-Q228 PolarHBondContact O-N 3.33Å; F225-Y229 VanDerWaalsContact O-CB 3.28Å; F225-Y229 WeakPolarHBondContact O-CB 3.41Å; F225-Y229 PolarHBondContact O-N 2.89Å
226D86.9Confident87.3Confident101 Ų10199 Ų9954%0.5445%0.447SS..Hα-helixtrans-61.7-39.4177.6-65.2-23.9000111.6H222 Y229 S230H222-D226 VanDerWaalsContact O-CG 3.22Å; H222-D226 PolarHBondContact O-N 3.4Å; D226-Y229 PolarHBondContact O-N 3.25Å; D226-S230 WeakPolarHBondContact O-CB 3.44Å; D226-S230 PolarHBondContact O-N 3.38Å; D226-S230 PolarHBondContact O-OG 3.37Å
227Y86.1Confident87.7Confident133 Ų133103.5 Ų103.552%0.52247%0.471SS..Hα-helixtrans-66-46.2175.1179.9-97.4000112.2H223 H224 F225 Y229 S230 K231H223-Y227 VanDerWaalsContact O-CB 3.26Å; H223-Y227 WeakPolarHBondContact O-CB 3.45Å; H223-Y227 PolarHBondContact O-N 3.41Å; H224-Y227 PolarHBondContact O-N 2.94Å; F225-Y227 VanDerWaalsContact C-N 3.3Å; F225-Y227 PolarHBondContact O-N 3.19Å; Y227-Y229 VanDerWaalsContact C-N 3.31Å; Y227-Y229 PolarHBondContact O-N 3.34Å; Y227-S230 WeakPolarHBondContact CA-OG 3.49Å; Y227-S230 PolarHBondContact O-N 2.92Å; Y227-S230 PolarHBondContact O-OG 3.06Å; Y227-K231 HydrophobicContact CE1-CD 4.21Å; Y227-K231 WeakPolarHBondContact O-CB 3.46Å; Y227-K231 PolarHBondContact O-N 3.39Å
228Q91.6Very high88.2Confident76 Ų76101 Ų10136%0.35547%0.468SS..Hα-helixtrans-65-37177.4-69.4-67.1-18.400111.8H224 F225 R232H224-Q228 PolarHBondContact NE2-NE2 3.01Å; H224-Q228 WeakPolarHBondContact O-CB 3.46Å; H224-Q228 VanDerWaalsContact O-CG 3.23Å; H224-Q228 WeakPolarHBondContact O-CG 3.26Å; H224-Q228 PolarHBondContact O-N 2.85Å; F225-Q228 PolarHBondContact O-N 3.33Å; Q228-R232 WeakPolarHBondContact O-CB 3.28Å; Q228-R232 PolarHBondContact O-N 3.17Å
229Y91.8Very high88.6Confident156 Ų156101.8 Ų101.861%0.61247%0.473SS*.Hα-helixtrans-64.6-51.1176.4-176.8-97.6000111.4F225 D226 Y227 K231 R232 M233F225-Y229 VanDerWaalsContact O-CB 3.28Å; F225-Y229 WeakPolarHBondContact O-CB 3.41Å; F225-Y229 PolarHBondContact O-N 2.89Å; D226-Y229 PolarHBondContact O-N 3.25Å; Y227-Y229 VanDerWaalsContact C-N 3.31Å; Y227-Y229 PolarHBondContact O-N 3.34Å; Y229-K231 VanDerWaalsContact C-N 3.33Å; Y229-K231 PolarHBondContact O-N 3.27Å; Y229-R232 PolarHBondContact O-N 2.94Å; Y229-M233 HydrophobicContact CD1-CG 4.12Å; Y229-M233 HydrophobicContact CE1-CG 3.71Å; Y229-M233 HydrophobicContact CE1-SD 4.34Å; Y229-M233 WeakPolarHBondContact O-CG 3.36Å; Y229-M233 PolarHBondContact O-N 3.01Å
230S91.7Very high89.2Confident51 Ų51103 Ų10336%0.35748%0.482SS..Hα-helixtrans-60.1-41177.355.90000112.4D226 Y227 R232 M233 Q234D226-S230 WeakPolarHBondContact O-CB 3.44Å; D226-S230 PolarHBondContact O-N 3.38Å; D226-S230 PolarHBondContact O-OG 3.37Å; Y227-S230 WeakPolarHBondContact CA-OG 3.49Å; Y227-S230 PolarHBondContact O-N 2.92Å; Y227-S230 PolarHBondContact O-OG 3.06Å; S230-R232 VanDerWaalsContact C-N 3.29Å; S230-R232 PolarHBondContact O-N 3.47Å; S230-M233 PolarHBondContact O-N 2.89Å; S230-Q234 WeakPolarHBondContact O-CG 3.49Å; S230-Q234 PolarHBondContact O-N 2.99Å
231K93.3Very high89.7Confident93 Ų93104 Ų10440%0.40449%0.49SS..Hα-helixtrans-67.7-25.5175.1-167.9173.4-176.3175.50113.7Y227 Y229 R235Y227-K231 HydrophobicContact CE1-CD 4.21Å; Y227-K231 WeakPolarHBondContact O-CB 3.46Å; Y227-K231 PolarHBondContact O-N 3.39Å; Y229-K231 VanDerWaalsContact C-N 3.33Å; Y229-K231 PolarHBondContact O-N 3.27Å; K231-R235 PolarHBondContact O-NE 3.49Å
232R94.2Very high90.1Very high170 Ų170107.3 Ų107.364%0.64251%0.507SS*.Hα-helixtrans-77.9-44.8173.8-170.1-179.5-68.1-176.4-2.3110.7Q228 Y229 S230 Q234 R235 T236Q228-R232 WeakPolarHBondContact O-CB 3.28Å; Q228-R232 PolarHBondContact O-N 3.17Å; Y229-R232 PolarHBondContact O-N 2.94Å; S230-R232 VanDerWaalsContact C-N 3.29Å; S230-R232 PolarHBondContact O-N 3.47Å; R232-Q234 VanDerWaalsContact C-N 3.29Å; R232-Q234 PolarHBondContact O-N 3.38Å; R232-R235 PolarHBondContact O-N 3.4Å; R232-R235 VanDerWaalsContact O-N 3.09Å; R232-T236 PolarHBondContact O-N 3.09Å; R232-T236 VanDerWaalsContact O-N 3.07Å
233M93.6Very high90.6Very high86 Ų86105.8 Ų105.842%0.42451%0.513SS..Hα-helixtrans-58.3-39.6174.8-71.6-65.5-61.700112.6Y229 S230 R235 T236 L237Y229-M233 HydrophobicContact CD1-CG 4.12Å; Y229-M233 HydrophobicContact CE1-CG 3.71Å; Y229-M233 HydrophobicContact CE1-SD 4.34Å; Y229-M233 WeakPolarHBondContact O-CG 3.36Å; Y229-M233 PolarHBondContact O-N 3.01Å; S230-M233 PolarHBondContact O-N 2.89Å; M233-R235 VanDerWaalsContact C-N 3.33Å; M233-R235 PolarHBondContact O-N 3.07Å; M233-T236 PolarHBondContact O-OG1 3.16Å; M233-L237 WeakPolarHBondContact O-CG 3.37Å; M233-L237 PolarHBondContact O-N 3.14Å; M233-L237 VanDerWaalsContact O-N 3.14Å
234Q93.8Very high91Very high123 Ų123104.7 Ų104.758%0.57552%0.518SS*.Hα-helixtrans-66.1-34.2175.6-75175.3-24.700113S230 R232 N238S230-Q234 WeakPolarHBondContact O-CG 3.49Å; S230-Q234 PolarHBondContact O-N 2.99Å; R232-Q234 VanDerWaalsContact C-N 3.29Å; R232-Q234 PolarHBondContact O-N 3.38Å; Q234-N238 PolarHBondContact O-N 2.93Å; Q234-N238 VanDerWaalsContact O-N 3.16Å
235R93.8Very high91.2Very high132 Ų132106.3 Ų106.350%0.49853%0.528SS..Hα-helixtrans-70.1-45.1176.6-87.4-178.1-79.6169.2-6.3111.9K231 R232 M233 L237 N238 D239K231-R235 PolarHBondContact O-NE 3.49Å; R232-R235 PolarHBondContact O-N 3.4Å; R232-R235 VanDerWaalsContact O-N 3.09Å; M233-R235 VanDerWaalsContact C-N 3.33Å; M233-R235 PolarHBondContact O-N 3.07Å; R235-L237 VanDerWaalsContact C-N 3.28Å; R235-L237 PolarHBondContact O-N 3.07Å; R235-N238 PolarHBondContact O-N 3.35Å; R235-N238 VanDerWaalsContact O-N 3.07Å; R235-D239 PolarHBondContact O-N 2.99Å
236T94.1Very high91Very high62 Ų62106.4 Ų106.438%0.3856%0.556SS.*Hα-helixtrans-59.8-40.7176.9540000111.6R232 M233 N238 D239 D240R232-T236 PolarHBondContact O-N 3.09Å; R232-T236 VanDerWaalsContact O-N 3.07Å; M233-T236 PolarHBondContact O-OG1 3.16Å; T236-N238 VanDerWaalsContact C-N 3.33Å; T236-N238 PolarHBondContact O-N 2.86Å; T236-D239 PolarHBondContact O-N 3.39Å; T236-D240 WeakPolarHBondContact O-CB 3.32Å; T236-D240 VanDerWaalsContact O-CG 3.23Å; T236-D240 PolarHBondContact O-N 3.25Å
237L93.6Very high91.2Very high99 Ų99106.7 Ų106.752%0.51856%0.557SS.*Hα-helixtrans-64.1-34.7175.1-72.7169000113.4M233 R235 N241M233-L237 WeakPolarHBondContact O-CG 3.37Å; M233-L237 PolarHBondContact O-N 3.14Å; M233-L237 VanDerWaalsContact O-N 3.14Å; R235-L237 VanDerWaalsContact C-N 3.28Å; R235-L237 PolarHBondContact O-N 3.07Å; L237-N241 VanDerWaalsContact O-CG 3.29Å; L237-N241 PolarHBondContact O-N 3.14Å; L237-N241 PolarHBondContact O-ND2 3.47Å
238N93.4Very high91.4Very high96 Ų96105.3 Ų105.351%0.51356%0.558SS.*Hα-helixtrans-73.2-41.6176.8-73.1-5.2000111.8Q234 R235 T236 D240 N241 D242Q234-N238 PolarHBondContact O-N 2.93Å; Q234-N238 VanDerWaalsContact O-N 3.16Å; R235-N238 PolarHBondContact O-N 3.35Å; R235-N238 VanDerWaalsContact O-N 3.07Å; T236-N238 VanDerWaalsContact C-N 3.33Å; T236-N238 PolarHBondContact O-N 2.86Å; N238-D240 VanDerWaalsContact C-N 3.32Å; N238-D240 PolarHBondContact O-N 3.33Å; N238-N241 PolarHBondContact O-N 3.24Å; N238-D242 PolarHBondContact O-N 3.42Å
239D93.6Very high91.4Very high103 Ų103106.9 Ų106.955%0.55157%0.57SS**Hα-helixtrans-62.4-40176.9-63.7-26000111.1R235 T236 N241 D242 A243R235-D239 PolarHBondContact O-N 2.99Å; T236-D239 PolarHBondContact O-N 3.39Å; D239-N241 VanDerWaalsContact C-N 3.34Å; D239-N241 PolarHBondContact O-N 3Å; D239-D242 PolarHBondContact O-N 2.95Å; D239-A243 WeakPolarHBondContact O-CB 3.39Å; D239-A243 PolarHBondContact O-N 3.02Å
240D93Very high91.4Very high108 Ų108104 Ų10458%0.57857%0.567SS**Hα-helixtrans-63.5-38.7174.9-71.2-24.1000111.9T236 N238 S244T236-D240 WeakPolarHBondContact O-CB 3.32Å; T236-D240 VanDerWaalsContact O-CG 3.23Å; T236-D240 PolarHBondContact O-N 3.25Å; N238-D240 VanDerWaalsContact C-N 3.32Å; N238-D240 PolarHBondContact O-N 3.33Å; D240-S244 PolarHBondContact O-N 3.3Å
241N91.2Very high91.4Very high92 Ų92107.3 Ų107.349%0.49258%0.58SS.*Hα-helixtrans-68.2-44176.4-76.2-22.8000111.8L237 N238 D239 A243 S244 I245L237-N241 VanDerWaalsContact O-CG 3.29Å; L237-N241 PolarHBondContact O-N 3.14Å; L237-N241 PolarHBondContact O-ND2 3.47Å; N238-N241 PolarHBondContact O-N 3.24Å; D239-N241 VanDerWaalsContact C-N 3.34Å; D239-N241 PolarHBondContact O-N 3Å; N241-A243 VanDerWaalsContact C-N 3.33Å; N241-A243 PolarHBondContact O-N 3.45Å; N241-S244 PolarHBondContact O-N 3.43Å; N241-S244 VanDerWaalsContact O-N 3.14Å; N241-S244 PolarHBondContact O-OG 3.42Å; N241-I245 WeakPolarHBondContact O-CG1 3.48Å; N241-I245 PolarHBondContact O-N 2.68Å
242D91.8Very high91.3Very high106 Ų106108.3 Ų108.357%0.56759%0.592SS**Hα-helixtrans-64.8-38.5178.7-72.1-20.4000111.5N238 D239 S244 I245 A246N238-D242 PolarHBondContact O-N 3.42Å; D239-D242 PolarHBondContact O-N 2.95Å; D242-S244 PolarHBondContact O-N 3.5Å; D242-I245 PolarHBondContact O-N 3.19Å; D242-A246 PolarHBondContact O-N 3.22Å
243A89.6Confident91.1Very high72 Ų72103.9 Ų103.960%0.59559%0.589SS**Hα-helixtrans-65.1-24.6174.300000113.6D239 N241D239-A243 WeakPolarHBondContact O-CB 3.39Å; D239-A243 PolarHBondContact O-N 3.02Å; N241-A243 VanDerWaalsContact C-N 3.33Å; N241-A243 PolarHBondContact O-N 3.45Å
244S87.5Confident90.9Very high91 Ų91105.2 Ų105.264%0.63660%0.601SS**Hα-helixtrans-82-16.517775.50000114.4D240 N241 D242D240-S244 PolarHBondContact O-N 3.3Å; N241-S244 PolarHBondContact O-N 3.43Å; N241-S244 VanDerWaalsContact O-N 3.14Å; N241-S244 PolarHBondContact O-OG 3.42Å; D242-S244 PolarHBondContact O-N 3.5Å
245I86.4Confident90.6Very high138 Ų138103.8 Ų103.871%0.70860%0.604SS**Hα-helixtrans-95.3-26.6-178.2-64.1168.6000111.8N241 D242N241-I245 WeakPolarHBondContact O-CG1 3.48Å; N241-I245 PolarHBondContact O-N 2.68Å; D242-I245 PolarHBondContact O-N 3.19Å
246A79.5Confident90.3Very high146 Ų146101.2 Ų101.2100%1.20761%0.613SS**  trans-750177.700000112.7D242D242-A246 PolarHBondContact O-N 3.22Å

Retrieved 246 of 246 residues in 127.3 ms (Link to these results)

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