A0A075B771_HUMAN Loading...

Zinc finger protein 582

AlphaFold DB , UniProt , Accession A0A075B771, Species HUMAN (Homo sapiens, Human), Gene ZNF582, Length 178 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
1M36.3Very low63.4Low232 Ų23293.8 Ų93.8100%1.14348%0.478SS*.  0105.20-69.2-174162.200106.6L3M1-L3 PolarHBondContact O-N 3.15Å
2S46.2Very low65.2Low69 Ų6987.7 Ų87.748%0.48345%0.452SS..  trans-85.785-175-720000110.2G4 S5S2-G4 PolarHBondContact O-N 2.64Å; S2-G4 VanDerWaalsContact O-N 3.12Å; S2-S5 PolarHBondContact O-N 2.82Å
3L47.4Very low66.7Low111 Ų11187.8 Ų87.858%0.58145%0.452SS*.Hα-helixtrans-56.9-28-175-151.278.2000113.6M1 S5 E6 L7M1-L3 PolarHBondContact O-N 3.15Å; L3-S5 PolarHBondContact O-N 3.35Å; L3-E6 PolarHBondContact O-N 3.42Å; L3-L7 PolarHBondContact O-N 3.05Å
4G47.4Very low67.8Low3 Ų389.6 Ų89.63%0.03147%0.469CS..Hα-helixtrans-78.4-14.4-176.800000115.5S2 L47 V49S2-G4 PolarHBondContact O-N 2.64Å; S2-G4 VanDerWaalsContact O-N 3.12Å; G4-L47 VanDerWaalsContact CA-O 3.29Å; G4-L47 WeakPolarHBondContact CA-O 3.48Å; G4-V49 VanDerWaalsContact CA-CG2 3.5Å
5S54.5Low68.8Low37 Ų3788.1 Ų88.126%0.25946%0.458SS..Hα-helixtrans-79.5-22.3167.6-79.80000112.4S2 L3 R9 S50S2-S5 PolarHBondContact O-N 2.82Å; L3-S5 PolarHBondContact O-N 3.35Å; S5-R9 WeakPolarHBondContact O-CG 3.43Å; S5-S50 PolarHBondContact OG-OG 3.17Å
6E62.2Low69.6Low109 Ų10985.4 Ų85.451%0.50945%0.449SS..Hα-helixtrans-77.1-44.6178.1-69.1170.8178.400110.7L3 F8 R9 D10L3-E6 PolarHBondContact O-N 3.42Å; E6-F8 VanDerWaalsContact C-N 3.32Å; E6-F8 PolarHBondContact O-N 2.92Å; E6-R9 WeakPolarHBondContact O-CB 3.32Å; E6-R9 PolarHBondContact O-N 2.82Å; E6-D10 PolarHBondContact O-N 3.3Å
7L75.9Confident70.3Confident59 Ų5986.6 Ų86.631%0.30945%0.451SS..Hα-helixtrans-58.7-39.5176.8-98.9142.5000113.6L3 R9 D10 V11L3-L7 PolarHBondContact O-N 3.05Å; L7-R9 VanDerWaalsContact C-N 3.29Å; L7-R9 PolarHBondContact O-N 2.79Å; L7-D10 PolarHBondContact O-N 2.95Å; L7-V11 PolarHBondContact O-N 3.15Å
8F80.9Confident71.1Confident9 Ų988.5 Ų88.54%0.03946%0.457CS..Hα-helixtrans-62.9-38.9176.2-178.2-98.2000111.3E6 D10 V11 A12 M35 T38 Y39 L42 P52 V54 I55E6-F8 VanDerWaalsContact C-N 3.32Å; E6-F8 PolarHBondContact O-N 2.92Å; F8-D10 VanDerWaalsContact C-N 3.27Å; F8-D10 PolarHBondContact O-N 3.22Å; F8-V11 WeakPolarHBondContact O-CG2 3.48Å; F8-V11 PolarHBondContact O-N 3.14Å; F8-A12 HydrophobicContact CD1-CB 4.03Å; F8-A12 HydrophobicContact CE1-CB 3.79Å; F8-A12 HydrophobicContact CZ-CB 4.19Å; F8-A12 WeakPolarHBondContact O-CA 3.49Å; F8-A12 WeakPolarHBondContact O-CB 3.42Å; F8-A12 PolarHBondContact O-N 2.56Å; F8-M35 HydrophobicContact CE1-CE 3.83Å; F8-M35 HydrophobicContact CE2-CE 4.2Å; F8-M35 HydrophobicContact CZ-CE 3.34Å; F8-T38 HydrophobicContact CE2-CG2 4.4Å; F8-Y39 HydrophobicContact CD2-CD2 4.29Å; F8-Y39 HydrophobicContact CE2-CD2 4.47Å; F8-L42 HydrophobicContact CB-CD1 3.9Å; F8-L42 HydrophobicContact CD2-CD1 3.76Å; F8-L42 HydrophobicContact CG-CD1 4.33Å; F8-P52 HydrophobicContact CB-CG 4.12Å; F8-P52 HydrophobicContact CD1-CB 3.91Å; F8-P52 HydrophobicContact CD1-CG 3.45Å; F8-P52 VanDerWaalsContact CD1-CG 3.45Å; F8-P52 HydrophobicContact CD2-CG 4.23Å; F8-P52 HydrophobicContact CE1-CB 4Å; F8-P52 HydrophobicContact CE1-CG 3.84Å; F8-P52 HydrophobicContact CG-CG 3.65Å; F8-P52 HydrophobicContact CZ-CG 4.37Å; F8-V54 HydrophobicContact CE1-CG1 3.7Å; F8-V54 HydrophobicContact CZ-CG1 3.95Å; F8-I55 HydrophobicContact CE1-CD1 4.4Å; F8-I55 HydrophobicContact CE1-CG1 4.24Å; F8-I55 HydrophobicContact CE2-CD1 3.75Å; F8-I55 HydrophobicContact CE2-CG1 3.96Å; F8-I55 HydrophobicContact CZ-CD1 3.42Å; F8-I55 VanDerWaalsContact CZ-CD1 3.42Å; F8-I55 HydrophobicContact CZ-CG1 3.63Å
9R80.4Confident71.8Confident194 Ų19489.4 Ų89.473%0.73246%0.459SS*.Hα-helixtrans-65.4-31.1177.7-69.4175.5176.8-93.1-0.2112.7S5 E6 L7 V11S5-R9 WeakPolarHBondContact O-CG 3.43Å; E6-R9 WeakPolarHBondContact O-CB 3.32Å; E6-R9 PolarHBondContact O-N 2.82Å; L7-R9 VanDerWaalsContact C-N 3.29Å; L7-R9 PolarHBondContact O-N 2.79Å; R9-V11 VanDerWaalsContact C-N 3.31Å; R9-V11 PolarHBondContact O-N 3.45Å
10D82.2Confident72.5Confident133 Ų13385.4 Ų85.471%0.71144%0.438SS*.Hα-helixtrans-70.9-27.1179.3-67-29.3000112.9E6 L7 F8E6-D10 PolarHBondContact O-N 3.3Å; L7-D10 PolarHBondContact O-N 2.95Å; F8-D10 VanDerWaalsContact C-N 3.27Å; F8-D10 PolarHBondContact O-N 3.22Å
11V83.6Confident73.1Confident76 Ų7686 Ų8646%0.46144%0.439SS..Hα-helixtrans-106-15179.6-59.30000113.4L7 F8 R9 T38 L42L7-V11 PolarHBondContact O-N 3.15Å; F8-V11 WeakPolarHBondContact O-CG2 3.48Å; F8-V11 PolarHBondContact O-N 3.14Å; R9-V11 VanDerWaalsContact C-N 3.31Å; R9-V11 PolarHBondContact O-N 3.45Å; V11-T38 HydrophobicContact CB-CG2 4.28Å; V11-T38 HydrophobicContact CG2-CG2 3.5Å; V11-L42 HydrophobicContact CG2-CD1 4.17Å
12A85.1Confident75.5Confident20 Ų2085.6 Ų85.617%0.16543%0.425CS..  trans-72.7138.7-178.100000112F8 V14 M35F8-A12 HydrophobicContact CD1-CB 4.03Å; F8-A12 HydrophobicContact CE1-CB 3.79Å; F8-A12 HydrophobicContact CZ-CB 4.19Å; F8-A12 WeakPolarHBondContact O-CA 3.49Å; F8-A12 WeakPolarHBondContact O-CB 3.42Å; F8-A12 PolarHBondContact O-N 2.56Å; A12-V14 HydrophobicContact CB-CG2 4.37Å; A12-M35 HydrophobicContact CB-CE 3.38Å; A12-M35 HydrophobicContact CB-SD 4.46Å
13I84.3Confident77.3Confident89 Ų8983.5 Ų83.546%0.45641%0.408SS..  trans-84.8128.5163.6-58.4172.1000107F15 Y31 M35I13-F15 HydrophobicContact CG2-CD2 4.36Å; I13-F15 HydrophobicContact CG2-CE1 4.43Å; I13-F15 HydrophobicContact CG2-CE2 3.84Å; I13-F15 HydrophobicContact CG2-CZ 3.87Å; I13-Y31 HydrophobicContact CB-CE2 4.15Å; I13-Y31 HydrophobicContact CG2-CE2 4.3Å; I13-Y31 WeakPolarHBondContact O-CE2 3.38Å; I13-Y31 PolarHBondContact O-OH 2.93Å; I13-M35 HydrophobicContact CB-SD 4.37Å
14V83.1Confident79.4Confident113 Ų11380.5 Ų80.569%0.68540%0.4SS*.  trans-123.4122.4179-175.40000108A12A12-V14 HydrophobicContact CB-CG2 4.37Å
15F82.5Confident81.3Confident68 Ų6885.1 Ų85.130%0.29843%0.429SS..  trans-99.1143.1173.5-67.2-71.8000110I13 E19 W20 L23 Y31I13-F15 HydrophobicContact CG2-CD2 4.36Å; I13-F15 HydrophobicContact CG2-CE1 4.43Å; I13-F15 HydrophobicContact CG2-CE2 3.84Å; I13-F15 HydrophobicContact CG2-CZ 3.87Å; F15-E19 HydrophobicContact CB-CB 4.3Å; F15-E19 HydrophobicContact CD1-CB 4.14Å; F15-W20 HydrophobicContact CB-CB 4.31Å; F15-W20 HydrophobicContact CB-CE3 4.04Å; F15-W20 AromaticContact CD2-CE3 3.65Å; F15-W20 HydrophobicContact CD2-CE3 3.65Å; F15-W20 AromaticContact CD2-CZ3 3.85Å; F15-W20 HydrophobicContact CD2-CZ3 3.85Å; F15-W20 HydrophobicContact CE2-CE3 4.48Å; F15-W20 HydrophobicContact CE2-CZ3 4.41Å; F15-W20 HydrophobicContact CG-CE3 4.14Å; F15-L23 HydrophobicContact CD1-CD1 4.37Å; F15-L23 HydrophobicContact CD2-CD1 3.89Å; F15-L23 HydrophobicContact CE1-CD1 4.27Å; F15-L23 HydrophobicContact CE1-CD2 4.3Å; F15-L23 HydrophobicContact CE2-CD1 3.74Å; F15-L23 HydrophobicContact CG-CD1 4.19Å; F15-L23 HydrophobicContact CZ-CD1 3.96Å; F15-L23 HydrophobicContact CZ-CD2 4.31Å; F15-Y31 AromaticContact CD2-CD2 3.79Å; F15-Y31 HydrophobicContact CD2-CD2 3.79Å; F15-Y31 AromaticContact CD2-CE2 3.7Å; F15-Y31 HydrophobicContact CD2-CE2 3.7Å; F15-Y31 HydrophobicContact CD2-CG 4.49Å; F15-Y31 AromaticContact CE2-CD2 3.4Å; F15-Y31 HydrophobicContact CE2-CD2 3.4Å; F15-Y31 VanDerWaalsContact CE2-CD2 3.4Å; F15-Y31 AromaticContact CE2-CE2 3.73Å; F15-Y31 HydrophobicContact CE2-CE2 3.73Å; F15-Y31 HydrophobicContact CE2-CG 4.18Å
16S81.9Confident82.9Confident45 Ų4586.8 Ų86.832%0.31545%0.445SS..  trans-65.8164.8162.395.60000110.4E18 E19 W20S16-E18 VanDerWaalsContact C-N 3.27Å; S16-E18 WeakPolarHBondContact CB-OE2 3.24Å; S16-E18 PolarHBondContact O-N 2.95Å; S16-E18 PolarHBondContact OG-N 2.88Å; S16-E18 PolarHBondContact OG-OE2 3.4Å; S16-E19 PolarHBondContact N-OE2 3.34Å; S16-E19 PolarHBondContact O-N 2.87Å; S16-E19 WeakPolarHBondContact OG-CG 3.47Å; S16-E19 PolarHBondContact OG-N 3.35Å; S16-E19 VanDerWaalsContact OG-N 3.13Å; S16-W20 WeakPolarHBondContact O-CB 3.44Å; S16-W20 PolarHBondContact O-N 3.29Å
17Q81Confident84Confident105 Ų10586.5 Ų86.549%0.49144%0.444SS..Hα-helixtrans-59.4-42.4175.6-176.5176.310.600111.2W20 Q21 W65Q17-W20 PolarHBondContact O-N 2.88Å; Q17-Q21 WeakPolarHBondContact O-CG 3.11Å; Q17-Q21 PolarHBondContact O-N 3.45Å; Q17-Q21 VanDerWaalsContact O-N 3.12Å; Q17-W65 HydrophobicContact CG-CG 4.18Å
18E84.3Confident84.6Confident121 Ų12186.2 Ų86.257%0.56544%0.439SS*.Hα-helixtrans-64.4-50.5178.7-5772.3-157.200110.9S16 W20 Q21 W22S16-E18 VanDerWaalsContact C-N 3.27Å; S16-E18 WeakPolarHBondContact CB-OE2 3.24Å; S16-E18 PolarHBondContact O-N 2.95Å; S16-E18 PolarHBondContact OG-N 2.88Å; S16-E18 PolarHBondContact OG-OE2 3.4Å; E18-W20 PolarHBondContact O-N 2.98Å; E18-Q21 PolarHBondContact O-N 3.5Å; E18-Q21 VanDerWaalsContact O-N 3.07Å; E18-W22 PolarHBondContact O-N 3.47Å
19E85Confident84.8Confident106 Ų10690.2 Ų90.250%0.49546%0.46SS..Hα-helixtrans-57.5-40.4178.1-69.8174.3147.100111.3F15 S16 Q21 W22 L23F15-E19 HydrophobicContact CB-CB 4.3Å; F15-E19 HydrophobicContact CD1-CB 4.14Å; S16-E19 PolarHBondContact N-OE2 3.34Å; S16-E19 PolarHBondContact O-N 2.87Å; S16-E19 WeakPolarHBondContact OG-CG 3.47Å; S16-E19 PolarHBondContact OG-N 3.35Å; S16-E19 VanDerWaalsContact OG-N 3.13Å; E19-Q21 PolarHBondContact O-N 3.3Å; E19-W22 PolarHBondContact O-N 3.36Å; E19-L23 PolarHBondContact O-N 3.13Å
20W85.4Confident85.2Confident9 Ų986 Ų863%0.03445%0.451CS..Hα-helixtrans-63.6-40.9176.7-171.9-78.1000112.7F15 S16 Q17 E18 W22 L23 R28 Y31 P64 W65F15-W20 HydrophobicContact CB-CB 4.31Å; F15-W20 HydrophobicContact CB-CE3 4.04Å; F15-W20 AromaticContact CD2-CE3 3.65Å; F15-W20 HydrophobicContact CD2-CE3 3.65Å; F15-W20 AromaticContact CD2-CZ3 3.85Å; F15-W20 HydrophobicContact CD2-CZ3 3.85Å; F15-W20 HydrophobicContact CE2-CE3 4.48Å; F15-W20 HydrophobicContact CE2-CZ3 4.41Å; F15-W20 HydrophobicContact CG-CE3 4.14Å; S16-W20 WeakPolarHBondContact O-CB 3.44Å; S16-W20 PolarHBondContact O-N 3.29Å; Q17-W20 PolarHBondContact O-N 2.88Å; E18-W20 PolarHBondContact O-N 2.98Å; W20-W22 PolarHBondContact O-N 3.3Å; W20-L23 HydrophobicContact CD2-CD1 3.9Å; W20-L23 HydrophobicContact CE3-CD1 3.68Å; W20-L23 HydrophobicContact CG-CD1 4.41Å; W20-L23 HydrophobicContact CZ3-CD1 4.11Å; W20-L23 WeakPolarHBondContact O-CB 3.41Å; W20-L23 PolarHBondContact O-N 3.08Å; W20-R28 HydrophobicContact CH2-CB 4.18Å; W20-R28 HydrophobicContact CH2-CG 4.37Å; W20-R28 HydrophobicContact CZ2-CB 3.59Å; W20-R28 HydrophobicContact CZ2-CG 3.57Å; W20-R28 VanDerWaalsContact NE1-NE 3.18Å; W20-R28 PolarHBondContact O-NE 2.84Å; W20-R28 PolarHBondContact O-NH2 2.91Å; W20-R28 VanDerWaalsContact O-NH2 3.14Å; W20-Y31 AromaticContact CH2-CD1 3.31Å; W20-Y31 HydrophobicContact CH2-CD1 3.31Å; W20-Y31 AromaticContact CH2-CE1 3.86Å; W20-Y31 HydrophobicContact CH2-CE1 3.86Å; W20-Y31 AromaticContact CH2-CG 3.81Å; W20-Y31 HydrophobicContact CH2-CG 3.81Å; W20-Y31 AromaticContact CZ3-CD1 3.27Å; W20-Y31 HydrophobicContact CZ3-CD1 3.27Å; W20-Y31 HydrophobicContact CZ3-CD2 4.12Å; W20-Y31 AromaticContact CZ3-CE1 3.53Å; W20-Y31 HydrophobicContact CZ3-CE1 3.53Å; W20-Y31 HydrophobicContact CZ3-CE2 4.33Å; W20-Y31 AromaticContact CZ3-CG 3.54Å; W20-Y31 HydrophobicContact CZ3-CG 3.54Å; W20-P64 HydrophobicContact CE3-CG 4.16Å; W20-P64 HydrophobicContact CH2-CG 3.77Å; W20-P64 HydrophobicContact CZ2-CG 4.22Å; W20-P64 HydrophobicContact CZ3-CG 3.76Å; W20-W65 HydrophobicContact CB-CE3 4.02Å; W20-W65 HydrophobicContact CB-CH2 4.44Å; W20-W65 HydrophobicContact CB-CZ3 4Å; W20-W65 AromaticContact CD1-CE3 3.87Å; W20-W65 AromaticContact CD1-CH2 2.83Å; W20-W65 AromaticContact CD1-CZ2 3.52Å; W20-W65 AromaticContact CD1-CZ3 3.05Å; W20-W65 AromaticContact CD2-CE3 3.86Å; W20-W65 HydrophobicContact CD2-CE3 3.86Å; W20-W65 AromaticContact CD2-CH2 3.77Å; W20-W65 HydrophobicContact CD2-CH2 3.77Å; W20-W65 AromaticContact CD2-CZ3 3.14Å; W20-W65 HydrophobicContact CD2-CZ3 3.14Å; W20-W65 AromaticContact CE2-CH2 3.35Å; W20-W65 AromaticContact CE2-CZ3 3.07Å; W20-W65 HydrophobicContact CE3-CE3 4.44Å; W20-W65 AromaticContact CE3-CZ3 3.95Å; W20-W65 HydrophobicContact CE3-CZ3 3.95Å; W20-W65 HydrophobicContact CG-CD2 4.47Å; W20-W65 AromaticContact CG-CE3 3.6Å; W20-W65 HydrophobicContact CG-CE3 3.6Å; W20-W65 AromaticContact CG-CH2 3.45Å; W20-W65 HydrophobicContact CG-CH2 3.45Å; W20-W65 VanDerWaalsContact CG-CH2 3.45Å; W20-W65 HydrophobicContact CG-CZ2 4.2Å; W20-W65 AromaticContact CG-CZ3 3.1Å; W20-W65 HydrophobicContact CG-CZ3 3.1Å; W20-W65 HydrophobicContact CH2-CZ3 4.43Å; W20-W65 HydrophobicContact CZ2-CH2 4.11Å; W20-W65 AromaticContact CZ2-CZ3 3.73Å; W20-W65 HydrophobicContact CZ2-CZ3 3.73Å; W20-W65 AromaticContact NE1-CH2 2.81Å; W20-W65 AromaticContact NE1-CZ2 3.85Å; W20-W65 AromaticContact NE1-CZ3 3.09Å
21Q85Confident85.6Confident99 Ų9980.4 Ų80.446%0.46342%0.421SS..Hα-helixtrans-60.5-29.2178.5-69.7-53.2-33.800112.3Q17 E18 E19 L23 R28Q17-Q21 WeakPolarHBondContact O-CG 3.11Å; Q17-Q21 PolarHBondContact O-N 3.45Å; Q17-Q21 VanDerWaalsContact O-N 3.12Å; E18-Q21 PolarHBondContact O-N 3.5Å; E18-Q21 VanDerWaalsContact O-N 3.07Å; E19-Q21 PolarHBondContact O-N 3.3Å; Q21-L23 VanDerWaalsContact C-N 3.32Å; Q21-R28 PolarHBondContact O-NH2 3.28Å
22W86.6Confident85.9Confident223 Ų22381.1 Ų81.185%0.84542%0.415SS*.THydrogen-bonded Turntrans-77.3-12.5175.4-67.9108.6000114.4E18 E19 W20E18-W22 PolarHBondContact O-N 3.47Å; E19-W22 PolarHBondContact O-N 3.36Å; W20-W22 PolarHBondContact O-N 3.3Å
23L84.9Confident85.9Confident25 Ų2584.8 Ų84.813%0.13143%0.432CS..SBendtrans-73.1132.2177.8-63.1179000111.5F15 E19 W20 Q21 Q27 R28F15-L23 HydrophobicContact CD1-CD1 4.37Å; F15-L23 HydrophobicContact CD2-CD1 3.89Å; F15-L23 HydrophobicContact CE1-CD1 4.27Å; F15-L23 HydrophobicContact CE1-CD2 4.3Å; F15-L23 HydrophobicContact CE2-CD1 3.74Å; F15-L23 HydrophobicContact CG-CD1 4.19Å; F15-L23 HydrophobicContact CZ-CD1 3.96Å; F15-L23 HydrophobicContact CZ-CD2 4.31Å; E19-L23 PolarHBondContact O-N 3.13Å; W20-L23 HydrophobicContact CD2-CD1 3.9Å; W20-L23 HydrophobicContact CE3-CD1 3.68Å; W20-L23 HydrophobicContact CG-CD1 4.41Å; W20-L23 HydrophobicContact CZ3-CD1 4.11Å; W20-L23 WeakPolarHBondContact O-CB 3.41Å; W20-L23 PolarHBondContact O-N 3.08Å; Q21-L23 VanDerWaalsContact C-N 3.32Å; L23-Q27 HydrophobicContact CB-CB 4.24Å; L23-Q27 HydrophobicContact CD2-CB 4.28Å; L23-R28 HydrophobicContact CB-CG 3.77Å; L23-R28 HydrophobicContact CD1-CG 4.42Å; L23-R28 PolarHBondContact O-NE 3.34Å; L23-R28 PolarHBondContact O-NH2 2.8Å
24A90.5Very high86.1Confident48 Ų4883.1 Ų83.140%0.39743%0.426SS..  trans-64.5152.9169.600000110.6A26 Q27 R28A24-A26 VanDerWaalsContact C-N 3.29Å; A24-A26 PolarHBondContact O-N 2.72Å; A24-Q27 HydrophobicContact CB-CG 4.34Å; A24-Q27 WeakPolarHBondContact O-CA 3.5Å; A24-Q27 WeakPolarHBondContact O-CB 3.29Å; A24-Q27 PolarHBondContact O-N 3.13Å; A24-R28 PolarHBondContact O-N 3.11Å; A24-R28 VanDerWaalsContact O-N 3.13Å
25P88.1Confident86.4Confident99 Ų9977.8 Ų77.864%0.64339%0.393SS*.Hα-helixtrans-49.7-46.7179.8-29.735.9000113.7Q27 R28 D29P25-Q27 PolarHBondContact O-N 3.48Å; P25-R28 WeakPolarHBondContact O-CB 3.38Å; P25-R28 PolarHBondContact O-N 3Å; P25-D29 PolarHBondContact O-N 3.36Å
26A88.3Confident86.6Confident73 Ų7376.6 Ų76.660%0.60339%0.39SS*.Hα-helixtrans-61-30.1177.900000113.9A24 L30A24-A26 VanDerWaalsContact C-N 3.29Å; A24-A26 PolarHBondContact O-N 2.72Å; A26-L30 WeakPolarHBondContact O-CB 3.41Å; A26-L30 PolarHBondContact O-N 3.4Å
27Q84.8Confident87Confident103 Ų10380.3 Ų80.348%0.48140%0.402SS..Hα-helixtrans-75.7-33.7175.8-65.5176.5-47.400111.8L23 A24 P25 L30 Y31L23-Q27 HydrophobicContact CB-CB 4.24Å; L23-Q27 HydrophobicContact CD2-CB 4.28Å; A24-Q27 HydrophobicContact CB-CG 4.34Å; A24-Q27 WeakPolarHBondContact O-CA 3.5Å; A24-Q27 WeakPolarHBondContact O-CB 3.29Å; A24-Q27 PolarHBondContact O-N 3.13Å; P25-Q27 PolarHBondContact O-N 3.48Å; Q27-L30 PolarHBondContact O-N 2.86Å; Q27-Y31 WeakPolarHBondContact O-CB 3.47Å; Q27-Y31 PolarHBondContact O-N 2.93Å
28R88.2Confident87.4Confident53 Ų5376.7 Ų76.720%0.239%0.388CS..Hα-helixtrans-67.6-39.5174.4-61.1177.8-177.6-165.91.8111W20 Q21 L23 A24 P25 Y31 R32 E63W20-R28 HydrophobicContact CH2-CB 4.18Å; W20-R28 HydrophobicContact CH2-CG 4.37Å; W20-R28 HydrophobicContact CZ2-CB 3.59Å; W20-R28 HydrophobicContact CZ2-CG 3.57Å; W20-R28 VanDerWaalsContact NE1-NE 3.18Å; W20-R28 PolarHBondContact O-NE 2.84Å; W20-R28 PolarHBondContact O-NH2 2.91Å; W20-R28 VanDerWaalsContact O-NH2 3.14Å; Q21-R28 PolarHBondContact O-NH2 3.28Å; L23-R28 HydrophobicContact CB-CG 3.77Å; L23-R28 HydrophobicContact CD1-CG 4.42Å; L23-R28 PolarHBondContact O-NE 3.34Å; L23-R28 PolarHBondContact O-NH2 2.8Å; A24-R28 PolarHBondContact O-N 3.11Å; A24-R28 VanDerWaalsContact O-N 3.13Å; P25-R28 WeakPolarHBondContact O-CB 3.38Å; P25-R28 PolarHBondContact O-N 3Å; R28-Y31 WeakPolarHBondContact O-CB 3.44Å; R28-Y31 PolarHBondContact O-N 3.42Å; R28-R32 PolarHBondContact O-N 3.2Å; R28-E63 IonicContact NH1-OE1 3.51Å
29D86.2Confident87.6Confident92 Ų9272.8 Ų72.849%0.49237%0.368SS..Hα-helixtrans-63.6-48.5173.6-65.5-27.2000110.6P25 Y31 R32 D33P25-D29 PolarHBondContact O-N 3.36Å; D29-Y31 VanDerWaalsContact C-N 3.3Å; D29-Y31 PolarHBondContact O-N 3.25Å; D29-R32 VanDerWaalsContact O-CB 3.31Å; D29-R32 WeakPolarHBondContact O-CB 3.44Å; D29-R32 PolarHBondContact O-N 3.31Å; D29-R32 VanDerWaalsContact O-N 3.07Å; D29-D33 PolarHBondContact O-N 3.08Å
30L89.1Confident87.7Confident105 Ų10570.8 Ų70.855%0.5537%0.366SS..Hα-helixtrans-58.7-41.7175.6179.663.2000112.4A26 Q27 R32 D33 V34A26-L30 WeakPolarHBondContact O-CB 3.41Å; A26-L30 PolarHBondContact O-N 3.4Å; Q27-L30 PolarHBondContact O-N 2.86Å; L30-R32 VanDerWaalsContact C-N 3.31Å; L30-R32 PolarHBondContact O-N 3.33Å; L30-D33 PolarHBondContact O-N 3.14Å; L30-V34 HydrophobicContact CD1-CG2 3.97Å; L30-V34 HydrophobicContact CG-CG2 4.26Å; L30-V34 WeakPolarHBondContact O-CB 3.38Å; L30-V34 VanDerWaalsContact O-CG2 3.31Å; L30-V34 WeakPolarHBondContact O-CG2 3.27Å; L30-V34 PolarHBondContact O-N 3.43Å
31Y89.9Confident87.9Confident17 Ų1774.1 Ų74.17%0.06738%0.384CS..Hα-helixtrans-57.8-46.8175.1173.9-93.6000111.5I13 F15 W20 Q27 R28 D29 D33 V34 M35 L58 P64I13-Y31 HydrophobicContact CB-CE2 4.15Å; I13-Y31 HydrophobicContact CG2-CE2 4.3Å; I13-Y31 WeakPolarHBondContact O-CE2 3.38Å; I13-Y31 PolarHBondContact O-OH 2.93Å; F15-Y31 AromaticContact CD2-CD2 3.79Å; F15-Y31 HydrophobicContact CD2-CD2 3.79Å; F15-Y31 AromaticContact CD2-CE2 3.7Å; F15-Y31 HydrophobicContact CD2-CE2 3.7Å; F15-Y31 HydrophobicContact CD2-CG 4.49Å; F15-Y31 AromaticContact CE2-CD2 3.4Å; F15-Y31 HydrophobicContact CE2-CD2 3.4Å; F15-Y31 VanDerWaalsContact CE2-CD2 3.4Å; F15-Y31 AromaticContact CE2-CE2 3.73Å; F15-Y31 HydrophobicContact CE2-CE2 3.73Å; F15-Y31 HydrophobicContact CE2-CG 4.18Å; W20-Y31 AromaticContact CH2-CD1 3.31Å; W20-Y31 HydrophobicContact CH2-CD1 3.31Å; W20-Y31 AromaticContact CH2-CE1 3.86Å; W20-Y31 HydrophobicContact CH2-CE1 3.86Å; W20-Y31 AromaticContact CH2-CG 3.81Å; W20-Y31 HydrophobicContact CH2-CG 3.81Å; W20-Y31 AromaticContact CZ3-CD1 3.27Å; W20-Y31 HydrophobicContact CZ3-CD1 3.27Å; W20-Y31 HydrophobicContact CZ3-CD2 4.12Å; W20-Y31 AromaticContact CZ3-CE1 3.53Å; W20-Y31 HydrophobicContact CZ3-CE1 3.53Å; W20-Y31 HydrophobicContact CZ3-CE2 4.33Å; W20-Y31 AromaticContact CZ3-CG 3.54Å; W20-Y31 HydrophobicContact CZ3-CG 3.54Å; Q27-Y31 WeakPolarHBondContact O-CB 3.47Å; Q27-Y31 PolarHBondContact O-N 2.93Å; R28-Y31 WeakPolarHBondContact O-CB 3.44Å; R28-Y31 PolarHBondContact O-N 3.42Å; D29-Y31 VanDerWaalsContact C-N 3.3Å; D29-Y31 PolarHBondContact O-N 3.25Å; Y31-D33 VanDerWaalsContact C-N 3.3Å; Y31-D33 PolarHBondContact O-N 3.14Å; Y31-V34 PolarHBondContact O-N 3.23Å; Y31-M35 HydrophobicContact CD1-CG 4.04Å; Y31-M35 HydrophobicContact CD2-CG 3.82Å; Y31-M35 HydrophobicContact CE1-CB 4.5Å; Y31-M35 HydrophobicContact CE1-CG 3.75Å; Y31-M35 HydrophobicContact CE2-CG 3.52Å; Y31-M35 HydrophobicContact CE2-SD 4Å; Y31-M35 HydrophobicContact CG-CG 4.13Å; Y31-M35 VanDerWaalsContact CZ-CG 3.5Å; Y31-M35 VanDerWaalsContact O-CB 3.3Å; Y31-M35 WeakPolarHBondContact O-CB 3.47Å; Y31-M35 WeakPolarHBondContact O-CG 3.29Å; Y31-M35 PolarHBondContact O-N 3.21Å; Y31-L58 HydrophobicContact CD1-CD1 4.31Å; Y31-L58 HydrophobicContact CD1-CD2 4.14Å; Y31-L58 HydrophobicContact CE1-CD1 3.86Å; Y31-L58 HydrophobicContact CE1-CD2 4.08Å; Y31-P64 HydrophobicContact CE1-CB 4.45Å; Y31-P64 HydrophobicContact CE1-CG 3.9Å
32R88.8Confident87.9Confident90 Ų9070.1 Ų70.134%0.3437%0.366SS..Hα-helixtrans-55.9-49.6178.4-177.8-174.8-173.4-162.6-2.9110.3R28 D29 L30 M35 L36 L58 E59R28-R32 PolarHBondContact O-N 3.2Å; D29-R32 VanDerWaalsContact O-CB 3.31Å; D29-R32 WeakPolarHBondContact O-CB 3.44Å; D29-R32 PolarHBondContact O-N 3.31Å; D29-R32 VanDerWaalsContact O-N 3.07Å; L30-R32 VanDerWaalsContact C-N 3.31Å; L30-R32 PolarHBondContact O-N 3.33Å; R32-M35 PolarHBondContact O-N 2.83Å; R32-L36 HydrophobicContact CG-CD1 3.88Å; R32-L36 HydrophobicContact CG-CG 4.49Å; R32-L36 WeakPolarHBondContact O-CB 3.48Å; R32-L36 VanDerWaalsContact O-CG 3.23Å; R32-L36 WeakPolarHBondContact O-CG 3.23Å; R32-L36 PolarHBondContact O-N 3.12Å; R32-L58 HydrophobicContact CB-CD2 4.16Å; R32-L58 HydrophobicContact CG-CB 4.21Å; R32-L58 HydrophobicContact CG-CD2 4.11Å; R32-L58 VanDerWaalsContact CZ-O 3.31Å; R32-L58 PolarHBondContact NE-O 3.16Å; R32-L58 PolarHBondContact NH2-O 2.88Å; R32-L58 VanDerWaalsContact NH2-O 3.08Å; R32-E59 PolarHBondContact NH2-O 3.49Å
33D85.1Confident87.9Confident97 Ų9763 Ų6352%0.51935%0.347SS..Hα-helixtrans-62.1-51.3-178-65.5-16.9000111.5D29 L30 Y31 M35 L36 E37D29-D33 PolarHBondContact O-N 3.08Å; L30-D33 PolarHBondContact O-N 3.14Å; Y31-D33 VanDerWaalsContact C-N 3.3Å; Y31-D33 PolarHBondContact O-N 3.14Å; D33-M35 VanDerWaalsContact C-N 3.31Å; D33-M35 PolarHBondContact O-N 3.26Å; D33-L36 PolarHBondContact O-N 3.02Å; D33-E37 WeakPolarHBondContact O-CB 3.31Å; D33-E37 PolarHBondContact O-N 3.26Å
34V88.8Confident87.8Confident54 Ų5466.2 Ų66.233%0.32737%0.372SS..Hα-helixtrans-59.7-42.1-179.5169.90000111.4L30 Y31 T38L30-V34 HydrophobicContact CD1-CG2 3.97Å; L30-V34 HydrophobicContact CG-CG2 4.26Å; L30-V34 WeakPolarHBondContact O-CB 3.38Å; L30-V34 VanDerWaalsContact O-CG2 3.31Å; L30-V34 WeakPolarHBondContact O-CG2 3.27Å; L30-V34 PolarHBondContact O-N 3.43Å; Y31-V34 PolarHBondContact O-N 3.23Å; V34-T38 VanDerWaalsContact O-CB 3.27Å; V34-T38 WeakPolarHBondContact O-CB 3.36Å; V34-T38 PolarHBondContact O-N 2.95Å; V34-T38 PolarHBondContact O-OG1 2.74Å
35M90.6Very high87.6Confident1 Ų169.9 Ų69.91%0.00538%0.384CS..Hα-helixtrans-72.3-38.5-177.7-68.7-56.4-7100112.5F8 A12 I13 Y31 R32 D33 Y39 V54 I55 L58F8-M35 HydrophobicContact CE1-CE 3.83Å; F8-M35 HydrophobicContact CE2-CE 4.2Å; F8-M35 HydrophobicContact CZ-CE 3.34Å; A12-M35 HydrophobicContact CB-CE 3.38Å; A12-M35 HydrophobicContact CB-SD 4.46Å; I13-M35 HydrophobicContact CB-SD 4.37Å; Y31-M35 HydrophobicContact CD1-CG 4.04Å; Y31-M35 HydrophobicContact CD2-CG 3.82Å; Y31-M35 HydrophobicContact CE1-CB 4.5Å; Y31-M35 HydrophobicContact CE1-CG 3.75Å; Y31-M35 HydrophobicContact CE2-CG 3.52Å; Y31-M35 HydrophobicContact CE2-SD 4Å; Y31-M35 HydrophobicContact CG-CG 4.13Å; Y31-M35 VanDerWaalsContact CZ-CG 3.5Å; Y31-M35 VanDerWaalsContact O-CB 3.3Å; Y31-M35 WeakPolarHBondContact O-CB 3.47Å; Y31-M35 WeakPolarHBondContact O-CG 3.29Å; Y31-M35 PolarHBondContact O-N 3.21Å; R32-M35 PolarHBondContact O-N 2.83Å; D33-M35 VanDerWaalsContact C-N 3.31Å; D33-M35 PolarHBondContact O-N 3.26Å; M35-Y39 PolarHBondContact O-N 3.45Å; M35-V54 HydrophobicContact CE-CG1 4.38Å; M35-I55 HydrophobicContact CB-CD1 4.38Å; M35-I55 WeakPolarHBondContact O-CD1 3.45Å; M35-L58 HydrophobicContact CB-CD1 3.62Å; M35-L58 HydrophobicContact CG-CD1 4.31Å
36L87Confident87.4Confident44 Ų4468.2 Ų68.223%0.2339%0.385CS..Hα-helixtrans-66.6-43.3174.8-69.9176.3000111.4R32 D33 Y39 S40 I55 L58 E59R32-L36 HydrophobicContact CG-CD1 3.88Å; R32-L36 HydrophobicContact CG-CG 4.49Å; R32-L36 WeakPolarHBondContact O-CB 3.48Å; R32-L36 VanDerWaalsContact O-CG 3.23Å; R32-L36 WeakPolarHBondContact O-CG 3.23Å; R32-L36 PolarHBondContact O-N 3.12Å; D33-L36 PolarHBondContact O-N 3.02Å; L36-Y39 PolarHBondContact O-N 3.18Å; L36-S40 WeakPolarHBondContact O-CB 3.42Å; L36-S40 PolarHBondContact O-N 3.32Å; L36-I55 HydrophobicContact CD2-CD1 4.48Å; L36-I55 HydrophobicContact CD2-CG2 4.13Å; L36-L58 HydrophobicContact CD2-CB 4.06Å; L36-L58 HydrophobicContact CG-CB 4.32Å; L36-E59 HydrophobicContact CD2-CG 3.58Å
37E89.9Confident87.1Confident122 Ų12268.1 Ų68.157%0.5737%0.374SS*.Hα-helixtrans-62.7-43.8175.6-174.1178.4-177.800111.2D33 Y39 S40 N41D33-E37 WeakPolarHBondContact O-CB 3.31Å; D33-E37 PolarHBondContact O-N 3.26Å; E37-Y39 VanDerWaalsContact C-N 3.33Å; E37-Y39 PolarHBondContact O-N 3.07Å; E37-S40 WeakPolarHBondContact O-CB 3.32Å; E37-S40 PolarHBondContact O-N 3.04Å; E37-N41 WeakPolarHBondContact O-CB 3.42Å; E37-N41 VanDerWaalsContact O-CG 3.23Å; E37-N41 PolarHBondContact O-N 3.33Å; E37-N41 PolarHBondContact O-ND2 2.95Å
38T88.4Confident86.9Confident30 Ų3064.5 Ų64.518%0.18436%0.362CS..Hα-helixtrans-58-45.7176.6-62.30000111.3F8 V11 V34 N41 L42F8-T38 HydrophobicContact CE2-CG2 4.4Å; V11-T38 HydrophobicContact CB-CG2 4.28Å; V11-T38 HydrophobicContact CG2-CG2 3.5Å; V34-T38 VanDerWaalsContact O-CB 3.27Å; V34-T38 WeakPolarHBondContact O-CB 3.36Å; V34-T38 PolarHBondContact O-N 2.95Å; V34-T38 PolarHBondContact O-OG1 2.74Å; T38-N41 PolarHBondContact O-N 3.31Å; T38-L42 WeakPolarHBondContact O-CG 3.2Å; T38-L42 PolarHBondContact O-N 3.44Å; T38-L42 VanDerWaalsContact O-N 3.09Å
39Y88.4Confident86.2Confident38 Ų3866.2 Ų66.215%0.14938%0.378CS..Hα-helixtrans-65-43.9176.7179.4-106.7000112.3F8 M35 L36 E37 N41 L42 V43 A48 K51 P52 I55F8-Y39 HydrophobicContact CD2-CD2 4.29Å; F8-Y39 HydrophobicContact CE2-CD2 4.47Å; M35-Y39 PolarHBondContact O-N 3.45Å; L36-Y39 PolarHBondContact O-N 3.18Å; E37-Y39 VanDerWaalsContact C-N 3.33Å; E37-Y39 PolarHBondContact O-N 3.07Å; Y39-N41 VanDerWaalsContact C-N 3.27Å; Y39-N41 PolarHBondContact O-N 3.42Å; Y39-L42 PolarHBondContact O-N 3.45Å; Y39-L42 VanDerWaalsContact O-N 3.11Å; Y39-V43 HydrophobicContact CD1-CG2 4.11Å; Y39-V43 HydrophobicContact CE1-CG2 3.66Å; Y39-V43 HydrophobicContact CE2-CG2 4.1Å; Y39-V43 WeakPolarHBondContact O-CG2 3.48Å; Y39-V43 PolarHBondContact O-N 2.69Å; Y39-A48 HydrophobicContact CE2-CB 3.95Å; Y39-K51 HydrophobicContact CE1-CG 4.18Å; Y39-K51 WeakPolarHBondContact OH-CA 3.47Å; Y39-K51 WeakPolarHBondContact OH-CB 3.14Å; Y39-P52 HydrophobicContact CD2-CG 4.31Å; Y39-P52 VanDerWaalsContact CE2-CD 3.42Å; Y39-P52 HydrophobicContact CE2-CG 4.39Å; Y39-I55 HydrophobicContact CD1-CG1 4.45Å; Y39-I55 HydrophobicContact CD1-CG2 3.63Å; Y39-I55 HydrophobicContact CD2-CG1 4.07Å; Y39-I55 HydrophobicContact CE1-CG2 4.05Å; Y39-I55 HydrophobicContact CG-CB 4.44Å; Y39-I55 HydrophobicContact CG-CD1 4.24Å; Y39-I55 HydrophobicContact CG-CG1 3.85Å; Y39-I55 HydrophobicContact CG-CG2 3.91Å
40S87.6Confident86.1Confident65 Ų6564 Ų6446%0.45537%0.369SS..Hα-helixtrans-57.9-40.7176.4-173.30000112.1L36 E37 V43 S44L36-S40 WeakPolarHBondContact O-CB 3.42Å; L36-S40 PolarHBondContact O-N 3.32Å; E37-S40 WeakPolarHBondContact O-CB 3.32Å; E37-S40 PolarHBondContact O-N 3.04Å; S40-V43 PolarHBondContact O-N 3.32Å; S40-S44 WeakPolarHBondContact O-CB 3.3Å; S40-S44 PolarHBondContact O-N 2.91Å; S40-S44 PolarHBondContact O-OG 3.2Å
41N88.8Confident85.9Confident79 Ų7963.3 Ų63.342%0.42236%0.362SS..Hα-helixtrans-63.9-42.8175.3-70.5-25.2000111.6E37 T38 Y39 V43 S44 L45E37-N41 WeakPolarHBondContact O-CB 3.42Å; E37-N41 VanDerWaalsContact O-CG 3.23Å; E37-N41 PolarHBondContact O-N 3.33Å; E37-N41 PolarHBondContact O-ND2 2.95Å; T38-N41 PolarHBondContact O-N 3.31Å; Y39-N41 VanDerWaalsContact C-N 3.27Å; Y39-N41 PolarHBondContact O-N 3.42Å; N41-V43 VanDerWaalsContact C-N 3.34Å; N41-V43 PolarHBondContact O-N 2.9Å; N41-S44 PolarHBondContact O-N 3.29Å; N41-L45 WeakPolarHBondContact O-CB 3.36Å; N41-L45 VanDerWaalsContact O-CG 3.24Å; N41-L45 WeakPolarHBondContact O-CG 3.11Å; N41-L45 PolarHBondContact O-N 3.01Å
42L86.6Confident85.6Confident14 Ų1463.5 Ų63.57%0.07337%0.365CS..Hα-helixtrans-64-38.2175.1-67-179.6000112.6F8 V11 T38 Y39 L45 G46 L47 A48F8-L42 HydrophobicContact CB-CD1 3.9Å; F8-L42 HydrophobicContact CD2-CD1 3.76Å; F8-L42 HydrophobicContact CG-CD1 4.33Å; V11-L42 HydrophobicContact CG2-CD1 4.17Å; T38-L42 WeakPolarHBondContact O-CG 3.2Å; T38-L42 PolarHBondContact O-N 3.44Å; T38-L42 VanDerWaalsContact O-N 3.09Å; Y39-L42 PolarHBondContact O-N 3.45Å; Y39-L42 VanDerWaalsContact O-N 3.11Å; L42-L45 PolarHBondContact O-N 3.07Å; L42-G46 PolarHBondContact O-N 3.01Å; L42-L47 HydrophobicContact CD2-CB 4.27Å; L42-L47 HydrophobicContact CD2-CD1 4.34Å; L42-L47 PolarHBondContact O-N 3.32Å; L42-A48 HydrophobicContact CB-CB 4.21Å; L42-A48 PolarHBondContact O-N 3.23Å
43V85.1Confident85.3Confident73 Ų7364.2 Ų64.244%0.44238%0.376SS..Hα-helixtrans-63.2-46.9174.1173.10000110.4Y39 S40 N41 L45 G46 A48Y39-V43 HydrophobicContact CD1-CG2 4.11Å; Y39-V43 HydrophobicContact CE1-CG2 3.66Å; Y39-V43 HydrophobicContact CE2-CG2 4.1Å; Y39-V43 WeakPolarHBondContact O-CG2 3.48Å; Y39-V43 PolarHBondContact O-N 2.69Å; S40-V43 PolarHBondContact O-N 3.32Å; N41-V43 VanDerWaalsContact C-N 3.34Å; N41-V43 PolarHBondContact O-N 2.9Å; V43-L45 PolarHBondContact O-N 3.09Å; V43-G46 WeakPolarHBondContact O-CA 3.05Å; V43-G46 PolarHBondContact O-N 3.3Å; V43-A48 HydrophobicContact CB-CB 4.29Å; V43-A48 HydrophobicContact CG2-CB 3.55Å
44S84.4Confident85.3Confident94 Ų9461.1 Ų61.166%0.65736%0.36SS*.Hα-helixtrans-61.9-32.5179.7-59.80000112.7S40 N41 G46S40-S44 WeakPolarHBondContact O-CB 3.3Å; S40-S44 PolarHBondContact O-N 2.91Å; S40-S44 PolarHBondContact O-OG 3.2Å; N41-S44 PolarHBondContact O-N 3.29Å; S44-G46 VanDerWaalsContact C-N 3.27Å; S44-G46 PolarHBondContact O-N 3.38Å
45L86.4Confident85.3Confident125 Ų12558.5 Ų58.565%0.65434%0.344SS*.THydrogen-bonded Turntrans-81.5-2.4174.5-66.1171.8000113.5N41 L42 V43 L47N41-L45 WeakPolarHBondContact O-CB 3.36Å; N41-L45 VanDerWaalsContact O-CG 3.24Å; N41-L45 WeakPolarHBondContact O-CG 3.11Å; N41-L45 PolarHBondContact O-N 3.01Å; L42-L45 PolarHBondContact O-N 3.07Å; V43-L45 PolarHBondContact O-N 3.09Å; L45-L47 HydrophobicContact CB-CB 4.48Å; L45-L47 HydrophobicContact CB-CD1 3.84Å; L45-L47 HydrophobicContact CB-CG 3.82Å; L45-L47 HydrophobicContact CD1-CD1 4.09Å; L45-L47 PolarHBondContact O-N 3.35Å
46G82.3Confident85.1Confident64 Ų6460.3 Ų60.366%0.6636%0.357SS*.THydrogen-bonded Turntrans67.419.8-174.900000113.8L42 V43 S44L42-G46 PolarHBondContact O-N 3.01Å; V43-G46 WeakPolarHBondContact O-CA 3.05Å; V43-G46 PolarHBondContact O-N 3.3Å; S44-G46 VanDerWaalsContact C-N 3.27Å; S44-G46 PolarHBondContact O-N 3.38Å
47L81.9Confident85Confident71 Ų7160 Ų6037%0.37235%0.354SS..  trans-95.6-13.8-177.4-61.4178000112.8G4 L42 L45 V49G4-L47 VanDerWaalsContact CA-O 3.29Å; G4-L47 WeakPolarHBondContact CA-O 3.48Å; L42-L47 HydrophobicContact CD2-CB 4.27Å; L42-L47 HydrophobicContact CD2-CD1 4.34Å; L42-L47 PolarHBondContact O-N 3.32Å; L45-L47 HydrophobicContact CB-CB 4.48Å; L45-L47 HydrophobicContact CB-CD1 3.84Å; L45-L47 HydrophobicContact CB-CG 3.82Å; L45-L47 HydrophobicContact CD1-CD1 4.09Å; L45-L47 PolarHBondContact O-N 3.35Å; L47-V49 PolarHBondContact O-N 3.46Å
48A80.8Confident84.9Confident27 Ų2754.5 Ų54.522%0.22333%0.328CS..  trans-83109.4175.700000111Y39 L42 V43Y39-A48 HydrophobicContact CE2-CB 3.95Å; L42-A48 HydrophobicContact CB-CB 4.21Å; L42-A48 PolarHBondContact O-N 3.23Å; V43-A48 HydrophobicContact CB-CB 4.29Å; V43-A48 HydrophobicContact CG2-CB 3.55Å
49V74.8Confident84.9Confident89 Ų8957.5 Ų57.554%0.53934%0.34SS..SBendtrans-87.3-32.6178.2174.40000111.7G4 L47G4-V49 VanDerWaalsContact CA-CG2 3.5Å; L47-V49 PolarHBondContact O-N 3.46Å
50S82.6Confident84.6Confident44 Ų4460.6 Ų60.631%0.30836%0.356SS..SBendtrans-151156.9177.5600000109.8S5 P52S5-S50 PolarHBondContact OG-OG 3.17Å; S50-P52 WeakPolarHBondContact O-CD 3.38Å
51K84.9Confident84.3Confident92 Ų9260 Ų6040%0.436%0.36SS..  trans-79123.7178.1-167.3171.8-167.4162.20110.7Y39 I55 E59Y39-K51 HydrophobicContact CE1-CG 4.18Å; Y39-K51 WeakPolarHBondContact OH-CA 3.47Å; Y39-K51 WeakPolarHBondContact OH-CB 3.14Å; K51-I55 HydrophobicContact CD-CG2 4.5Å; K51-I55 HydrophobicContact CG-CB 4.31Å; K51-I55 HydrophobicContact CG-CG2 4.11Å; K51-E59 VanDerWaalsContact CE-CD 3.49Å; K51-E59 WeakPolarHBondContact CE-OE1 3.34Å; K51-E59 VanDerWaalsContact CE-OE2 3.32Å; K51-E59 WeakPolarHBondContact CE-OE2 3.21Å; K51-E59 IonicContact NZ-OE1 2.72Å; K51-E59 PolarHBondContact NZ-OE1 3.13Å; K51-E59 IonicContact NZ-OE2 2.56Å; K51-E59 PolarHBondContact NZ-OE2 2.9Å
52P84.4Confident83.9Confident20 Ų2060.7 Ų60.713%0.1336%0.359CS..  trans-68.1146.5174.5-17.129.4000111.9F8 Y39 S50 V54 I55 S56F8-P52 HydrophobicContact CB-CG 4.12Å; F8-P52 HydrophobicContact CD1-CB 3.91Å; F8-P52 HydrophobicContact CD1-CG 3.45Å; F8-P52 VanDerWaalsContact CD1-CG 3.45Å; F8-P52 HydrophobicContact CD2-CG 4.23Å; F8-P52 HydrophobicContact CE1-CB 4Å; F8-P52 HydrophobicContact CE1-CG 3.84Å; F8-P52 HydrophobicContact CG-CG 3.65Å; F8-P52 HydrophobicContact CZ-CG 4.37Å; Y39-P52 HydrophobicContact CD2-CG 4.31Å; Y39-P52 VanDerWaalsContact CE2-CD 3.42Å; Y39-P52 HydrophobicContact CE2-CG 4.39Å; S50-P52 WeakPolarHBondContact O-CD 3.38Å; P52-V54 PolarHBondContact O-N 3.06Å; P52-I55 HydrophobicContact CB-CG1 4.16Å; P52-I55 HydrophobicContact CG-CG1 3.98Å; P52-I55 WeakPolarHBondContact O-CB 3.43Å; P52-I55 PolarHBondContact O-N 3.21Å; P52-S56 PolarHBondContact O-N 3.36Å; P52-S56 VanDerWaalsContact O-N 3.14Å
53D83.6Confident83.4Confident106 Ų10663.6 Ų63.657%0.56737%0.373SS*.Hα-helixtrans-57.6-38177.1-63.8-40.8000112.2I55 S56 F57D53-I55 VanDerWaalsContact C-N 3.26Å; D53-I55 PolarHBondContact O-N 3.23Å; D53-S56 WeakPolarHBondContact O-CB 3.31Å; D53-S56 PolarHBondContact O-N 3.49Å; D53-S56 VanDerWaalsContact O-N 3.14Å; D53-F57 HydrophobicContact CB-CD2 4.43Å; D53-F57 HydrophobicContact CB-CE2 3.98Å; D53-F57 WeakPolarHBondContact O-CD2 3.17Å; D53-F57 WeakPolarHBondContact O-CG 3.18Å; D53-F57 PolarHBondContact O-N 3.43Å
54V84.1Confident82.6Confident31 Ų3160.8 Ų60.819%0.18836%0.356CS..Hα-helixtrans-57-41176.6107.40000111.3F8 M35 P52 F57 L58 P64F8-V54 HydrophobicContact CE1-CG1 3.7Å; F8-V54 HydrophobicContact CZ-CG1 3.95Å; M35-V54 HydrophobicContact CE-CG1 4.38Å; P52-V54 PolarHBondContact O-N 3.06Å; V54-F57 PolarHBondContact O-N 3.33Å; V54-L58 WeakPolarHBondContact O-CB 3.45Å; V54-L58 WeakPolarHBondContact O-CG 3.45Å; V54-L58 PolarHBondContact O-N 2.8Å; V54-P64 HydrophobicContact CG2-CB 3.43Å; V54-P64 VanDerWaalsContact CG2-CB 3.43Å
55I87.9Confident81.7Confident0 Ų058.8 Ų58.80%033%0.334CS..Hα-helixtrans-69.3-43.6178.2-64.1-56.7000110.3F8 M35 L36 Y39 K51 P52 D53 F57 L58 E59F8-I55 HydrophobicContact CE1-CD1 4.4Å; F8-I55 HydrophobicContact CE1-CG1 4.24Å; F8-I55 HydrophobicContact CE2-CD1 3.75Å; F8-I55 HydrophobicContact CE2-CG1 3.96Å; F8-I55 HydrophobicContact CZ-CD1 3.42Å; F8-I55 VanDerWaalsContact CZ-CD1 3.42Å; F8-I55 HydrophobicContact CZ-CG1 3.63Å; M35-I55 HydrophobicContact CB-CD1 4.38Å; M35-I55 WeakPolarHBondContact O-CD1 3.45Å; L36-I55 HydrophobicContact CD2-CD1 4.48Å; L36-I55 HydrophobicContact CD2-CG2 4.13Å; Y39-I55 HydrophobicContact CD1-CG1 4.45Å; Y39-I55 HydrophobicContact CD1-CG2 3.63Å; Y39-I55 HydrophobicContact CD2-CG1 4.07Å; Y39-I55 HydrophobicContact CE1-CG2 4.05Å; Y39-I55 HydrophobicContact CG-CB 4.44Å; Y39-I55 HydrophobicContact CG-CD1 4.24Å; Y39-I55 HydrophobicContact CG-CG1 3.85Å; Y39-I55 HydrophobicContact CG-CG2 3.91Å; K51-I55 HydrophobicContact CD-CG2 4.5Å; K51-I55 HydrophobicContact CG-CB 4.31Å; K51-I55 HydrophobicContact CG-CG2 4.11Å; P52-I55 HydrophobicContact CB-CG1 4.16Å; P52-I55 HydrophobicContact CG-CG1 3.98Å; P52-I55 WeakPolarHBondContact O-CB 3.43Å; P52-I55 PolarHBondContact O-N 3.21Å; D53-I55 VanDerWaalsContact C-N 3.26Å; D53-I55 PolarHBondContact O-N 3.23Å; I55-F57 VanDerWaalsContact C-N 3.27Å; I55-F57 PolarHBondContact O-N 3.17Å; I55-L58 PolarHBondContact O-N 3.12Å; I55-E59 WeakPolarHBondContact O-CG 2.97Å; I55-E59 PolarHBondContact O-N 2.98Å
56S87Confident80.3Confident38 Ų3855.9 Ų55.927%0.26632%0.318SS..Hα-helixtrans-56.7-41175.6-174.30000112.2P52 D53 Q60P52-S56 PolarHBondContact O-N 3.36Å; P52-S56 VanDerWaalsContact O-N 3.14Å; D53-S56 WeakPolarHBondContact O-CB 3.31Å; D53-S56 PolarHBondContact O-N 3.49Å; D53-S56 VanDerWaalsContact O-N 3.14Å; S56-Q60 VanDerWaalsContact O-CG 3.29Å; S56-Q60 WeakPolarHBondContact O-CG 3Å; S56-Q60 PolarHBondContact O-N 3.41Å; S56-Q60 PolarHBondContact O-NE2 3.11Å; S56-Q60 VanDerWaalsContact O-NE2 3.12Å; S56-Q60 PolarHBondContact OG-NE2 2.81Å
57F86.1Confident78.8Confident39 Ų3956 Ų5617%0.17131%0.305CS..Hα-helixtrans-69.5-45.9176.4-66.6-49.9000112.5D53 V54 I55 E59 Q60 G61 K62 V67D53-F57 HydrophobicContact CB-CD2 4.43Å; D53-F57 HydrophobicContact CB-CE2 3.98Å; D53-F57 WeakPolarHBondContact O-CD2 3.17Å; D53-F57 WeakPolarHBondContact O-CG 3.18Å; D53-F57 PolarHBondContact O-N 3.43Å; V54-F57 PolarHBondContact O-N 3.33Å; I55-F57 VanDerWaalsContact C-N 3.27Å; I55-F57 PolarHBondContact O-N 3.17Å; F57-E59 VanDerWaalsContact C-N 3.31Å; F57-E59 PolarHBondContact O-N 3.03Å; F57-Q60 CarbonylContact O-C 3.55Å; F57-Q60 PolarHBondContact O-N 3.45Å; F57-Q60 VanDerWaalsContact O-N 3.08Å; F57-G61 PolarHBondContact O-N 3.5Å; F57-K62 CarbonylContact C-O 3.49Å; F57-K62 HydrophobicContact CB-CB 4.04Å; F57-K62 HydrophobicContact CD1-CB 4.23Å; F57-K62 HydrophobicContact CD1-CD 4.16Å; F57-K62 WeakPolarHBondContact O-CA 3.46Å; F57-K62 WeakPolarHBondContact O-CB 3.47Å; F57-K62 PolarHBondContact O-N 3.36Å; F57-V67 HydrophobicContact CD2-CG2 3.69Å; F57-V67 HydrophobicContact CE2-CB 3.91Å; F57-V67 HydrophobicContact CE2-CG1 4.39Å; F57-V67 HydrophobicContact CE2-CG2 3.31Å; F57-V67 HydrophobicContact CZ-CG2 4.42Å
58L87.8Confident77.1Confident6 Ų660.1 Ų60.13%0.03132%0.323CS..Hα-helixtrans-61.9-37.4-179.3-70.9174.1000112.6Y31 R32 M35 L36 V54 I55 Q60 G61 P64Y31-L58 HydrophobicContact CD1-CD1 4.31Å; Y31-L58 HydrophobicContact CD1-CD2 4.14Å; Y31-L58 HydrophobicContact CE1-CD1 3.86Å; Y31-L58 HydrophobicContact CE1-CD2 4.08Å; R32-L58 HydrophobicContact CB-CD2 4.16Å; R32-L58 HydrophobicContact CG-CB 4.21Å; R32-L58 HydrophobicContact CG-CD2 4.11Å; R32-L58 VanDerWaalsContact CZ-O 3.31Å; R32-L58 PolarHBondContact NE-O 3.16Å; R32-L58 PolarHBondContact NH2-O 2.88Å; R32-L58 VanDerWaalsContact NH2-O 3.08Å; M35-L58 HydrophobicContact CB-CD1 3.62Å; M35-L58 HydrophobicContact CG-CD1 4.31Å; L36-L58 HydrophobicContact CD2-CB 4.06Å; L36-L58 HydrophobicContact CG-CB 4.32Å; V54-L58 WeakPolarHBondContact O-CB 3.45Å; V54-L58 WeakPolarHBondContact O-CG 3.45Å; V54-L58 PolarHBondContact O-N 2.8Å; I55-L58 PolarHBondContact O-N 3.12Å; L58-Q60 VanDerWaalsContact C-N 3.34Å; L58-Q60 PolarHBondContact O-N 3.2Å; L58-G61 PolarHBondContact O-N 3.21Å; L58-G61 VanDerWaalsContact O-N 3.13Å; L58-P64 HydrophobicContact CD2-CG 4.23Å
59E86.8Confident75.3Confident93 Ų9369.1 Ų69.144%0.43535%0.351SS..Hα-helixtrans-63.4-40173.7-73177-177.200112.4R32 L36 K51 I55 F57 G61R32-E59 PolarHBondContact NH2-O 3.49Å; L36-E59 HydrophobicContact CD2-CG 3.58Å; K51-E59 VanDerWaalsContact CE-CD 3.49Å; K51-E59 WeakPolarHBondContact CE-OE1 3.34Å; K51-E59 VanDerWaalsContact CE-OE2 3.32Å; K51-E59 WeakPolarHBondContact CE-OE2 3.21Å; K51-E59 IonicContact NZ-OE1 2.72Å; K51-E59 PolarHBondContact NZ-OE1 3.13Å; K51-E59 IonicContact NZ-OE2 2.56Å; K51-E59 PolarHBondContact NZ-OE2 2.9Å; I55-E59 WeakPolarHBondContact O-CG 2.97Å; I55-E59 PolarHBondContact O-N 2.98Å; F57-E59 VanDerWaalsContact C-N 3.31Å; F57-E59 PolarHBondContact O-N 3.03Å; E59-G61 PolarHBondContact O-N 3.03Å; E59-G61 VanDerWaalsContact O-N 3.13Å
60Q81.9Confident73.4Confident103 Ų10371.1 Ų71.148%0.48136%0.363SS..THydrogen-bonded Turntrans-72.10.6176.3-66.6171.64600113.3S56 F57 L58 K62S56-Q60 VanDerWaalsContact O-CG 3.29Å; S56-Q60 WeakPolarHBondContact O-CG 3Å; S56-Q60 PolarHBondContact O-N 3.41Å; S56-Q60 PolarHBondContact O-NE2 3.11Å; S56-Q60 VanDerWaalsContact O-NE2 3.12Å; S56-Q60 PolarHBondContact OG-NE2 2.81Å; F57-Q60 CarbonylContact O-C 3.55Å; F57-Q60 PolarHBondContact O-N 3.45Å; F57-Q60 VanDerWaalsContact O-N 3.08Å; L58-Q60 VanDerWaalsContact C-N 3.34Å; L58-Q60 PolarHBondContact O-N 3.2Å; Q60-K62 HydrophobicContact CB-CB 4.36Å; Q60-K62 HydrophobicContact CB-CD 4Å; Q60-K62 HydrophobicContact CB-CG 4Å; Q60-K62 PolarHBondContact O-N 3.05Å
61G81.3Confident71.4Confident53 Ų5375.2 Ų75.255%0.54639%0.386SS..THydrogen-bonded Turntrans66.121-17300000112.7F57 L58 E59F57-G61 PolarHBondContact O-N 3.5Å; L58-G61 PolarHBondContact O-N 3.21Å; L58-G61 VanDerWaalsContact O-N 3.13Å; E59-G61 PolarHBondContact O-N 3.03Å; E59-G61 VanDerWaalsContact O-N 3.13Å
62K80.5Confident69.1Low92 Ų9276.4 Ų76.440%0.441%0.406SS..  trans-93.8150.2179.9-75179.5-176.4168.90110.5F57 Q60 M66F57-K62 CarbonylContact C-O 3.49Å; F57-K62 HydrophobicContact CB-CB 4.04Å; F57-K62 HydrophobicContact CD1-CB 4.23Å; F57-K62 HydrophobicContact CD1-CD 4.16Å; F57-K62 WeakPolarHBondContact O-CA 3.46Å; F57-K62 WeakPolarHBondContact O-CB 3.47Å; F57-K62 PolarHBondContact O-N 3.36Å; Q60-K62 HydrophobicContact CB-CB 4.36Å; Q60-K62 HydrophobicContact CB-CD 4Å; Q60-K62 HydrophobicContact CB-CG 4Å; Q60-K62 PolarHBondContact O-N 3.05Å; K62-M66 HydrophobicContact CB-CE 3.51Å; K62-M66 HydrophobicContact CD-CE 3.86Å; K62-M66 HydrophobicContact CG-CE 3.65Å
63E76.4Confident66.9Low76 Ų7679.1 Ų79.136%0.35544%0.437SS..  trans-72.5132.1-179.4-76.8-173.4144.100112.1R28 W65 M66R28-E63 IonicContact NH1-OE1 3.51Å; E63-W65 VanDerWaalsContact C-N 3.33Å; E63-W65 HydrophobicContact CB-CD2 4.3Å; E63-W65 HydrophobicContact CB-CE3 4.24Å; E63-W65 HydrophobicContact CB-CH2 3.26Å; E63-W65 HydrophobicContact CB-CZ2 3.57Å; E63-W65 HydrophobicContact CB-CZ3 3.64Å; E63-W65 HydrophobicContact CG-CH2 3.25Å; E63-W65 HydrophobicContact CG-CZ2 3.68Å; E63-W65 HydrophobicContact CG-CZ3 4.02Å; E63-W65 PolarHBondContact O-N 3.3Å; E63-W65 WeakPolarHBondContact OE1-CH2 3.4Å; E63-W65 WeakPolarHBondContact OE1-CZ2 3.38Å; E63-W65 WeakPolarHBondContact OE2-CZ2 3.48Å; E63-M66 HydrophobicContact CB-CG 4.12Å; E63-M66 WeakPolarHBondContact O-CB 3.35Å; E63-M66 WeakPolarHBondContact O-CG 3.4Å; E63-M66 PolarHBondContact O-N 3.42Å
64P68.1Low64.5Low13 Ų1377.1 Ų77.18%0.08444%0.442CS..G310 helixtrans-64.7-20.4-170.218.8-32.5000116.6W20 Y31 V54 L58 M66 V67W20-P64 HydrophobicContact CE3-CG 4.16Å; W20-P64 HydrophobicContact CH2-CG 3.77Å; W20-P64 HydrophobicContact CZ2-CG 4.22Å; W20-P64 HydrophobicContact CZ3-CG 3.76Å; Y31-P64 HydrophobicContact CE1-CB 4.45Å; Y31-P64 HydrophobicContact CE1-CG 3.9Å; V54-P64 HydrophobicContact CG2-CB 3.43Å; V54-P64 VanDerWaalsContact CG2-CB 3.43Å; L58-P64 HydrophobicContact CD2-CG 4.23Å; P64-M66 VanDerWaalsContact C-N 3.33Å; P64-V67 WeakPolarHBondContact O-CG2 3.39Å
65W67Low62Low52 Ų5283.6 Ų83.620%0.19748%0.475CS..G310 helixtrans-872.517460.592.5000113.4Q17 W20 E63 V67Q17-W65 HydrophobicContact CG-CG 4.18Å; W20-W65 HydrophobicContact CB-CE3 4.02Å; W20-W65 HydrophobicContact CB-CH2 4.44Å; W20-W65 HydrophobicContact CB-CZ3 4Å; W20-W65 AromaticContact CD1-CE3 3.87Å; W20-W65 AromaticContact CD1-CH2 2.83Å; W20-W65 AromaticContact CD1-CZ2 3.52Å; W20-W65 AromaticContact CD1-CZ3 3.05Å; W20-W65 AromaticContact CD2-CE3 3.86Å; W20-W65 HydrophobicContact CD2-CE3 3.86Å; W20-W65 AromaticContact CD2-CH2 3.77Å; W20-W65 HydrophobicContact CD2-CH2 3.77Å; W20-W65 AromaticContact CD2-CZ3 3.14Å; W20-W65 HydrophobicContact CD2-CZ3 3.14Å; W20-W65 AromaticContact CE2-CH2 3.35Å; W20-W65 AromaticContact CE2-CZ3 3.07Å; W20-W65 HydrophobicContact CE3-CE3 4.44Å; W20-W65 AromaticContact CE3-CZ3 3.95Å; W20-W65 HydrophobicContact CE3-CZ3 3.95Å; W20-W65 HydrophobicContact CG-CD2 4.47Å; W20-W65 AromaticContact CG-CE3 3.6Å; W20-W65 HydrophobicContact CG-CE3 3.6Å; W20-W65 AromaticContact CG-CH2 3.45Å; W20-W65 HydrophobicContact CG-CH2 3.45Å; W20-W65 VanDerWaalsContact CG-CH2 3.45Å; W20-W65 HydrophobicContact CG-CZ2 4.2Å; W20-W65 AromaticContact CG-CZ3 3.1Å; W20-W65 HydrophobicContact CG-CZ3 3.1Å; W20-W65 HydrophobicContact CH2-CZ3 4.43Å; W20-W65 HydrophobicContact CZ2-CH2 4.11Å; W20-W65 AromaticContact CZ2-CZ3 3.73Å; W20-W65 HydrophobicContact CZ2-CZ3 3.73Å; W20-W65 AromaticContact NE1-CH2 2.81Å; W20-W65 AromaticContact NE1-CZ2 3.85Å; W20-W65 AromaticContact NE1-CZ3 3.09Å; E63-W65 VanDerWaalsContact C-N 3.33Å; E63-W65 HydrophobicContact CB-CD2 4.3Å; E63-W65 HydrophobicContact CB-CE3 4.24Å; E63-W65 HydrophobicContact CB-CH2 3.26Å; E63-W65 HydrophobicContact CB-CZ2 3.57Å; E63-W65 HydrophobicContact CB-CZ3 3.64Å; E63-W65 HydrophobicContact CG-CH2 3.25Å; E63-W65 HydrophobicContact CG-CZ2 3.68Å; E63-W65 HydrophobicContact CG-CZ3 4.02Å; E63-W65 PolarHBondContact O-N 3.3Å; E63-W65 WeakPolarHBondContact OE1-CH2 3.4Å; E63-W65 WeakPolarHBondContact OE1-CZ2 3.38Å; E63-W65 WeakPolarHBondContact OE2-CZ2 3.48Å; W65-V67 PolarHBondContact O-N 3.38Å
66M55.4Low59.6Low65 Ų6589.3 Ų89.332%0.3251%0.513SS..G310 helixtrans-73.11173.3-66.2-156-52.300113.9K62 E63 P64 E68 R69K62-M66 HydrophobicContact CB-CE 3.51Å; K62-M66 HydrophobicContact CD-CE 3.86Å; K62-M66 HydrophobicContact CG-CE 3.65Å; E63-M66 HydrophobicContact CB-CG 4.12Å; E63-M66 WeakPolarHBondContact O-CB 3.35Å; E63-M66 WeakPolarHBondContact O-CG 3.4Å; E63-M66 PolarHBondContact O-N 3.42Å; P64-M66 VanDerWaalsContact C-N 3.33Å; M66-E68 PolarHBondContact O-N 2.9Å; M66-E68 VanDerWaalsContact O-N 3.11Å; M66-R69 PolarHBondContact O-N 3.25Å
67V51.9Low57.2Low66 Ų6693.2 Ų93.240%0.454%0.538SS..G310 helixtrans-52.2-31.5174.6-175.80000111.5F57 P64 W65 R69F57-V67 HydrophobicContact CD2-CG2 3.69Å; F57-V67 HydrophobicContact CE2-CB 3.91Å; F57-V67 HydrophobicContact CE2-CG1 4.39Å; F57-V67 HydrophobicContact CE2-CG2 3.31Å; F57-V67 HydrophobicContact CZ-CG2 4.42Å; P64-V67 WeakPolarHBondContact O-CG2 3.39Å; W65-V67 PolarHBondContact O-N 3.38Å; V67-R69 PolarHBondContact O-N 3.21Å
68E46Very low54.7Low157 Ų15797.2 Ų97.273%0.73457%0.565SS**G310 helixtrans-87.9-1.1-170.3-160.9165.8-169.200115.5M66M66-E68 PolarHBondContact O-N 2.9Å; M66-E68 VanDerWaalsContact O-N 3.11Å
69R42.1Very low52.4Low216 Ų216105.3 Ų105.382%0.81561%0.608SS**G310 helixtrans-106.416.7-174.2-71.9-141.9-70.7-178.4-5.5117M66 V67M66-R69 PolarHBondContact O-N 3.25Å; V67-R69 PolarHBondContact O-N 3.21Å
70V36.4Very low49.7Very low132 Ų132109.5 Ų109.580%0.863%0.627SS**SBendtrans-115.3-10.3169.4-171.20000112.8
71V39.1Very low47.6Very low130 Ų130109 Ų10979%0.78864%0.635SS**SBendtrans-94.2-12.4177.4-176.80000113.1G73V71-G73 PolarHBondContact O-N 3.43Å
72S37.4Very low45.4Very low116 Ų116116.2 Ų116.281%0.81165%0.646SS**THydrogen-bonded Turntrans-9661171.7-86.40000112.7
73G39.2Very low42.9Very low77 Ų77121.5 Ų121.579%0.79467%0.665SS**THydrogen-bonded Turntrans-107.47.5154.100000112.3V71 L75V71-G73 PolarHBondContact O-N 3.43Å; G73-L75 PolarHBondContact O-N 3.03Å
74G32.3Very low40.7Very low65 Ų65125.3 Ų125.367%0.6769%0.687SS**  trans-9577.1178.800000111.3C76G74-C76 VanDerWaalsContact C-N 3.34Å; G74-C76 PolarHBondContact O-N 3.3Å; G74-C76 VanDerWaalsContact O-N 3.17Å
75L31.6Very low39Very low166 Ų166129.5 Ų129.587%0.86971%0.713SS**  trans-72.7101.1152.1-75173.9000106.3G73 P77G73-L75 PolarHBondContact O-N 3.03Å; L75-P77 WeakPolarHBondContact O-CD 3.5Å
76C37.3Very low37.4Very low120 Ų120135.8 Ų135.881%0.81174%0.741SS**  trans-56.8114.5157-73.80000108G74 V78G74-C76 VanDerWaalsContact C-N 3.34Å; G74-C76 PolarHBondContact O-N 3.3Å; G74-C76 VanDerWaalsContact O-N 3.17Å; C76-V78 PolarHBondContact O-N 3.03Å
77P37Very low36.8Very low121 Ų121140.3 Ų140.379%0.78676%0.762SS**  trans-70.9120.5154.1-3.223.7000105.5L75 L79L75-P77 WeakPolarHBondContact O-CD 3.5Å; P77-L79 PolarHBondContact O-N 3.04Å
78V32.9Very low35.8Very low122 Ų122144.3 Ų144.374%0.73978%0.78SS**  trans-28.1128.7160.11670000110.4C76 E80C76-V78 PolarHBondContact O-N 3.03Å; V78-E80 VanDerWaalsContact C-N 3.28Å; V78-E80 PolarHBondContact O-N 2.89Å
79L40.3Very low35.3Very low177 Ų177146 Ų14693%0.92779%0.785SS**  trans-52.391.4166.5-85.5154.2000109.7P77P77-L79 PolarHBondContact O-N 3.04Å
80E30.3Very low35Very low181 Ų181141.5 Ų141.585%0.84678%0.784SS**  trans-116.8105.1155.6-88.1-172.1158.400108.3V78V78-E80 VanDerWaalsContact C-N 3.28Å; V78-E80 PolarHBondContact O-N 2.89Å
81S37.4Very low34.8Very low91 Ų91143.6 Ų143.664%0.63678%0.783SS**  trans-74.8145.5-179.768.90000111.6
82R35.3Very low34.5Very low206 Ų206145.5 Ų145.578%0.77778%0.783SS**  trans80.1131.8160.6-49.3159.147.8178-7.2112.3
83Y28.5Very low34Very low203 Ų203147.1 Ų147.180%0.79678%0.778SS**  cis-165.413137.78.6-99.3000109.8
84D29.8Very low34.2Very low155 Ų155149.4 Ų149.483%0.82978%0.776SS**  trans50135.6139.1-124.4-19.6000125.9
85T31.4Very low34.1Very low101 Ų101154.9 Ų154.962%0.6278%0.777SS**  trans90.4125.7143.4-5.70000124
86K34.3Very low34.5Very low184 Ų184155.4 Ų155.480%0.878%0.775SS**  trans90.9100.5152.1-49.4-171.7-173.6-178.40116.3
87E41.6Very low34.3Very low160 Ų160155.5 Ų155.575%0.74877%0.772SS**  58.3117.699.1-82.9-99131.500111.8
88L31.2Very low34.3Very low151 Ų151157.9 Ų157.979%0.79177%0.772SS**  -159.3134.770.7-74.7160.7000111.1
89F35.6Very low34.3Very low191 Ų191156.8 Ų156.884%0.83877%0.771SS**  trans-73.8157.2160.4-70.2-86.7000110.7
90P35.5Very low34.2Very low123 Ų123153.8 Ų153.880%0.79976%0.762SS**  -139.3120.8118.928.1-10000115.1
91K32Very low34.5Very low176 Ų176152.2 Ų152.277%0.76575%0.754SS**  trans48.4121.9136.8-72.3177.3179.5171.40122.6
92Q34.4Very low34.2Very low170 Ų170158.8 Ų158.879%0.79477%0.765SS**  70.1113.8129.6-74.1170.2-2600118.8
93H26.6Very low34.1Very low150 Ų150155.8 Ų155.869%0.69476%0.76SS**  -161.9127.591.4-159.1-97.4000109.8Y95H93-Y95 HydrophobicContact CB-CD1 4.44Å; H93-Y95 HydrophobicContact CB-CE1 4.38Å; H93-Y95 AromaticContact ND1-CD1 3.92Å; H93-Y95 PolarHBondContact O-N 3Å
94V42.2Very low34.7Very low124 Ų124151.5 Ų151.575%0.75275%0.75SS**  trans-71.4115.1166.8174.40000106.3
95Y30.1Very low34.7Very low180 Ų180151.3 Ų151.371%0.70675%0.746SS**  trans-113.4104.215124.7-95.5000105.7H93 V97H93-Y95 HydrophobicContact CB-CD1 4.44Å; H93-Y95 HydrophobicContact CB-CE1 4.38Å; H93-Y95 AromaticContact ND1-CD1 3.92Å; H93-Y95 PolarHBondContact O-N 3Å; Y95-V97 HydrophobicContact CD2-CG2 4.38Å; Y95-V97 PolarHBondContact O-N 3.41Å
96E40.7Very low34.9Very low177 Ų177154.2 Ų154.283%0.82775%0.752SS**  trans-63.189.3160.6-160.3163.5-146.800105.5E98E96-E98 VanDerWaalsContact C-N 3.34Å; E96-E98 PolarHBondContact O-N 3.49Å; E96-E98 VanDerWaalsContact O-N 3.15Å
97V32.3Very low34.6Very low122 Ų122150.2 Ų150.274%0.73975%0.747SS**  trans-77.899.1168.6169.50000105.2Y95 S99Y95-V97 HydrophobicContact CD2-CG2 4.38Å; Y95-V97 PolarHBondContact O-N 3.41Å; V97-S99 PolarHBondContact O-N 3.48Å
98E37.1Very low34.3Very low171 Ų171149.4 Ų149.480%0.79975%0.747SS**  trans-38.3125.9165.6-66.8174.6150.600109.8E96E96-E98 VanDerWaalsContact C-N 3.34Å; E96-E98 PolarHBondContact O-N 3.49Å; E96-E98 VanDerWaalsContact O-N 3.15Å
99S34.6Very low34.7Very low100 Ų100147.5 Ų147.570%0.69974%0.742SS**  trans-50.5126.6166.8175.30000108.1V97 Q101V97-S99 PolarHBondContact O-N 3.48Å; S99-Q101 PolarHBondContact O-N 2.96Å
100P37Very low34.6Very low114 Ų114142.9 Ų142.974%0.7473%0.734SS**  trans-69.398.216827.5-27.9000106.4W102P100-W102 PolarHBondContact O-N 3.14Å
101Q36.7Very low34.4Very low148 Ų148147.3 Ų147.369%0.69274%0.736SS**  trans-49.4101.1150.5-95.1169.7-31.900105.8S99 E103S99-Q101 PolarHBondContact O-N 2.96Å; Q101-E103 HydrophobicContact CB-CG 4.16Å; Q101-E103 PolarHBondContact O-N 3.18Å
102W31.6Very low34.4Very low229 Ų229142.4 Ų142.487%0.86774%0.736SS**  trans-69.672.4155.664.7-78.1000105P100 I104P100-W102 PolarHBondContact O-N 3.14Å; W102-I104 PolarHBondContact O-N 3.48Å
103E32.8Very low35.1Very low142 Ų142142.7 Ų142.766%0.66474%0.741SS**  trans-56.2100.3162.9-90.3165.9177.300105.2Q101Q101-E103 HydrophobicContact CB-CG 4.16Å; Q101-E103 PolarHBondContact O-N 3.18Å
104I42.1Very low35.3Very low114 Ų114144 Ų14459%0.58575%0.748SS**  trans38.4104.9141-48.5177.1000111W102 E106W102-I104 PolarHBondContact O-N 3.48Å; I104-E106 HydrophobicContact CB-CB 4.23Å; I104-E106 HydrophobicContact CG2-CB 3.64Å; I104-E106 HydrophobicContact CG2-CG 3.89Å; I104-E106 WeakPolarHBondContact O-CB 3.41Å; I104-E106 PolarHBondContact O-N 3.07Å
105M30.2Very low35.1Very low150 Ų150144.6 Ų144.674%0.73976%0.756SS**  trans-61.366.1159.4-178.7140.955.500109.4S107 L108M105-S107 PolarHBondContact O-N 3.12Å; M105-L108 HydrophobicContact CG-CD1 4.19Å; M105-L108 HydrophobicContact CG-CG 4.34Å; M105-L108 HydrophobicContact SD-CD1 4.42Å
106E33.9Very low35.3Very low162 Ų162140.2 Ų140.276%0.75775%0.752SS**THydrogen-bonded Turntrans-7925.3-170.3-153.8-171.8-176.800111.5I104I104-E106 HydrophobicContact CB-CB 4.23Å; I104-E106 HydrophobicContact CG2-CB 3.64Å; I104-E106 HydrophobicContact CG2-CG 3.89Å; I104-E106 WeakPolarHBondContact O-CB 3.41Å; I104-E106 PolarHBondContact O-N 3.07Å
107S29.4Very low35.2Very low100 Ų100136.8 Ų136.870%0.69975%0.747SS**THydrogen-bonded Turntrans-120-6.2179.562.60000114.6M105 T109M105-S107 PolarHBondContact O-N 3.12Å; S107-T109 VanDerWaalsContact C-N 3.3Å
108L34.8Very low35.2Very low143 Ų143141.3 Ų141.375%0.74976%0.757SS**SBendtrans-86.5-2.4177.5-66.3177.8000113.7M105 S110M105-L108 HydrophobicContact CG-CD1 4.19Å; M105-L108 HydrophobicContact CG-CG 4.34Å; M105-L108 HydrophobicContact SD-CD1 4.42Å; L108-S110 PolarHBondContact O-N 3.19Å
109T38.5Very low35.3Very low111 Ų111140.5 Ų140.568%0.68175%0.754SS**  trans-94.784.2171.7-30.90000110S107S107-T109 VanDerWaalsContact C-N 3.3Å
110S33.7Very low35.4Very low95 Ų95142.9 Ų142.966%0.66476%0.758SS**SBendtrans-162.283.5144.6174.80000110.4L108L108-S110 PolarHBondContact O-N 3.19Å
111Y31.6Very low35.3Very low216 Ų216145.3 Ų145.385%0.84777%0.766SS**  trans36.293.9145.6-48.4-83.6000117
112G32.1Very low35.7Very low73 Ų73148.3 Ų148.375%0.75377%0.771SS**  trans136.4121.315900000112.9E114G112-E114 PolarHBondContact O-N 2.94Å; G112-E114 VanDerWaalsContact O-N 3.15Å
113L48.4Very low36Very low175 Ų175145.9 Ų145.992%0.91677%0.769SS**  trans-31.5114.9158.5-79.7145.5000112
114E31.4Very low36.1Very low177 Ų177144.4 Ų144.483%0.82777%0.773SS**  trans-151.983141.4-77.5-148.9158.200109.4G112 S116G112-E114 PolarHBondContact O-N 2.94Å; G112-E114 VanDerWaalsContact O-N 3.15Å; E114-S116 PolarHBondContact O-N 3.31Å
115C38.8Very low35.3Very low138 Ų138150.3 Ų150.393%0.93279%0.788SS**  trans-70.598.3152-80.40000107.7
116S34.5Very low35.4Very low88 Ų88150.9 Ų150.962%0.61579%0.794SS**  trans-153.9131.5155.5630000109.7E114E114-S116 PolarHBondContact O-N 3.31Å
117S38.9Very low35.4Very low104 Ų104151.8 Ų151.873%0.72780%0.798SS**  trans109.313.817480.10000120Q119S117-Q119 PolarHBondContact O-N 3.45Å; S117-Q119 VanDerWaalsContact O-N 3.14Å
118F31.1Very low35.2Very low217 Ų217156.3 Ų156.395%0.95281%0.806SS**THydrogen-bonded Turntrans-84.140.6153.6-140.2-90.6000111.5
119Q39.9Very low35.2Very low154 Ų154156.7 Ų156.772%0.7281%0.808SS**THydrogen-bonded Turntrans-118.1-0.8-176.3-168.1152.113.300113.5S117S117-Q119 PolarHBondContact O-N 3.45Å; S117-Q119 VanDerWaalsContact O-N 3.14Å
120D36.9Very low35.4Very low150 Ų150162.3 Ų162.380%0.80282%0.817SS**SBendtrans-123.922.4-169.2-90-8.9000116.2
121D33.8Very low35.4Very low166 Ų166166.7 Ų166.789%0.88883%0.827SS**SBendtrans-136.915.8174.7-127.719.2000114.8
122W45.5Very low35.7Very low211 Ų211165.6 Ų165.680%0.79983%0.83SS**  trans-97.66.2-176.190.4-76.4000114.8C124W122-C124 PolarHBondContact O-N 3.42Å
123E37.8Very low35.5Very low178 Ų178165.6 Ų165.683%0.83283%0.829SS**  trans-95.376.7171.1-70.3-172.2175.600111.9
124C33.8Very low34.9Very low111 Ų111165 Ų16575%0.7583%0.827SS**  trans178.192.7144.3-103.10000114W122W122-C124 PolarHBondContact O-N 3.42Å
125R27.1Very low35.5Very low237 Ų237161.9 Ų161.989%0.89482%0.822SS**SBendtrans-162.334.4131.9-124.1179.7-140.2-950.5117.3
126N30.6Very low35.1Very low163 Ų163162.4 Ų162.487%0.87282%0.816SS**  trans-12174.7164.1-71.6-40.2000109.8F128N126-F128 PolarHBondContact O-N 3.4Å
127Q34.2Very low35.7Very low180 Ų180168.5 Ų168.584%0.84183%0.826SS**  trans-79.289.1164-79.1-174.34300108.6
128F26.3Very low35.2Very low196 Ų196171.9 Ų171.986%0.8683%0.829SS**  trans-133.8107.4148.6-109.6-84.5000109.6N126N126-F128 PolarHBondContact O-N 3.4Å
129D33.5Very low35.3Very low150 Ų150171.7 Ų171.780%0.80283%0.828SS**  trans55.8121.7165-86.1-38.4000123.7Q131D129-Q131 PolarHBondContact O-N 2.87Å
130R43Very low35.2Very low229 Ų229172.4 Ų172.486%0.86483%0.832SS**  trans-60.3120.6166.7-63.4163.579.8-178.66.7110
131Q35Very low35Very low188 Ų188173 Ų17388%0.87983%0.829SS**  trans-144.7140.3132.6-76.9-56.1-44.600110.1D129D129-Q131 PolarHBondContact O-N 2.87Å
132Q37.4Very low34.8Very low193 Ų193173.2 Ų173.290%0.90283%0.827SS**  trans-82.3141.5-163.8175.9172.418.200113.1
133G26.9Very low34.1Very low72 Ų72169.2 Ų169.274%0.74282%0.82SS**  trans15988.8160.200000118.3
134N35.4Very low33.8Very low163 Ų163167.6 Ų167.687%0.87282%0.816SS**  trans54.6143.2150.8-143.333.7000120.8
135P44.7Very low33.5Very low112 Ų112171.4 Ų171.473%0.72781%0.814SS**  trans-91.7126.6-167.935.9-26.7000110.9
136D30.1Very low34Very low149 Ų149168 Ų16880%0.79781%0.808SS**  trans-137.5134.2153.1-146.5-9000110.7
137R47.5Very low34.2Very low216 Ų216168 Ų16882%0.81580%0.803SS**  trans-63.1146.4-176.8-67.1168.2167.8-165.6-6.4108.4
138H29Very low34.4Very low175 Ų175168 Ų16881%0.8180%0.803SS**  trans166.8122.4132.4-82.1-54.3000107.6H140H138-H140 VanDerWaalsContact C-N 3.31Å; H138-H140 PolarHBondContact O-N 3.26Å
139F33.7Very low34.7Very low212 Ų212164.9 Ų164.993%0.9379%0.793SS**  trans-57.398.8166.2-102-98.3000107.9Q141F139-Q141 PolarHBondContact O-N 2.86Å; F139-Q141 VanDerWaalsContact O-N 3.16Å
140H37Very low34.8Very low170 Ų170163.2 Ų163.279%0.78779%0.79SS**  trans-76.1105.3172-154.3-52.6000106.4H138 M142H138-H140 VanDerWaalsContact C-N 3.31Å; H138-H140 PolarHBondContact O-N 3.26Å; H140-M142 VanDerWaalsContact C-N 3.32Å; H140-M142 PolarHBondContact O-N 2.88Å
141Q33.3Very low34.6Very low162 Ų162159.6 Ų159.676%0.75779%0.793SS**  trans-54.9101.2161.8-169.9169.939.300106.8F139 I143F139-Q141 PolarHBondContact O-N 2.86Å; F139-Q141 VanDerWaalsContact O-N 3.16Å; Q141-I143 VanDerWaalsContact C-N 3.27Å; Q141-I143 HydrophobicContact CG-CG1 4.43Å; Q141-I143 PolarHBondContact O-N 3.23Å
142M29.3Very low34.7Very low170 Ų170156.5 Ų156.584%0.83778%0.777SS**  trans-80.886.1174.9-167.5130.9108.400106.7H140 I144H140-M142 VanDerWaalsContact C-N 3.32Å; H140-M142 PolarHBondContact O-N 2.88Å; M142-I144 PolarHBondContact O-N 3.37Å
143I30.5Very low34.8Very low127 Ų127152.8 Ų152.865%0.65176%0.764SS**  trans-58.7110.8160.2-63.7-172.1000105.2Q141 R145Q141-I143 VanDerWaalsContact C-N 3.27Å; Q141-I143 HydrophobicContact CG-CG1 4.43Å; Q141-I143 PolarHBondContact O-N 3.23Å; I143-R145 PolarHBondContact O-N 3.13Å
144I30.7Very low35.5Very low145 Ų145156.7 Ų156.774%0.74476%0.763SS**  trans-54.9105.4170.8-60.5177.9000106.1M142 H146M142-I144 PolarHBondContact O-N 3.37Å; I144-H146 PolarHBondContact O-N 3.34Å
145R27.3Very low35.7Very low191 Ų191156 Ų15672%0.72175%0.754SS**  trans-69.6124.9175.2-73.9178139.5-136.2-3.2107.1I143 E147I143-R145 PolarHBondContact O-N 3.13Å; R145-E147 PolarHBondContact O-N 2.7Å
146H38.7Very low35.3Very low166 Ų166153 Ų15377%0.76974%0.739SS**G310 helixtrans-55-8.3-179.6-179.1-85000114.7I144I144-H146 PolarHBondContact O-N 3.34Å
147E34Very low35.8Very low162 Ų162148.1 Ų148.176%0.75772%0.716SS**G310 helixtrans-85-12.2-171.7-65.4-178.6162.700114.2R145R145-E147 PolarHBondContact O-N 2.7Å
148E38.5Very low35.3Very low181 Ų181142.3 Ų142.385%0.84670%0.701SS**G310 helixtrans-107.215.9-178.6-65.9-173.8-179.300114.5P150E148-P150 WeakPolarHBondContact O-CD 3.35Å
149M32.8Very low35.8Very low129 Ų129138 Ų13864%0.63569%0.687SS**SBendtrans-79.3117.9167.6-83.9-176.6155.900109.7T151M149-T151 PolarHBondContact O-N 2.74Å
150P36.1Very low35.7Very low116 Ų116134.5 Ų134.575%0.75367%0.671SS**  trans-59.9130.1165.627.2-33.4000107.7E148 F152E148-P150 WeakPolarHBondContact O-CD 3.35Å; P150-F152 VanDerWaalsContact C-N 3.34Å; P150-F152 PolarHBondContact O-N 3.29Å
151T39.4Very low35.4Very low152 Ų152134.3 Ų134.393%0.93367%0.665SS**  trans-29.588.4-175.4260000113.4M149M149-T151 PolarHBondContact O-N 2.74Å
152F36.2Very low35.2Very low123 Ų123131.9 Ų131.954%0.53965%0.654SS.*  trans-87.7127.9171-176-104.7000106.6P150 Q154 A156 S157P150-F152 VanDerWaalsContact C-N 3.34Å; P150-F152 PolarHBondContact O-N 3.29Å; F152-Q154 PolarHBondContact O-N 3.26Å; F152-Q154 VanDerWaalsContact O-N 3.08Å; F152-A156 HydrophobicContact CD1-CB 4.45Å; F152-A156 HydrophobicContact CE1-CB 3.48Å; F152-A156 VanDerWaalsContact CE1-CB 3.48Å; F152-A156 HydrophobicContact CZ-CB 3.57Å; F152-S157 VanDerWaalsContact CD1-OG 3.25Å; F152-S157 WeakPolarHBondContact CD1-OG 3.42Å; F152-S157 WeakPolarHBondContact CE1-OG 3.25Å
153D40.5Very low35.4Very low116 Ų116132.2 Ų132.262%0.6265%0.65SS**  trans-54116.4-175.7-169.3-13.3000110H155 A156D153-H155 PolarHBondContact O-N 3.2Å; D153-H155 PolarHBondContact OD1-N 3.44Å; D153-A156 PolarHBondContact O-N 3.44Å
154Q40Very low35.7Very low153 Ų153131.6 Ų131.672%0.71565%0.647SS**Hα-helixtrans-60.9-16.7-170.8-66.7177-5.500112.4F152 L158F152-Q154 PolarHBondContact O-N 3.26Å; F152-Q154 VanDerWaalsContact O-N 3.08Å; Q154-L158 PolarHBondContact O-N 3.11Å
155H39.5Very low35.7Very low149 Ų149132.2 Ų132.269%0.6965%0.647SS**Hα-helixtrans-67.6-31.4173.6-91.3-85.2000113.9D153 T159D153-H155 PolarHBondContact O-N 3.2Å; D153-H155 PolarHBondContact OD1-N 3.44Å; H155-T159 PolarHBondContact O-N 3.26Å; H155-T159 PolarHBondContact O-OG1 3.45Å
156A38.2Very low35.9Very low50 Ų50128.7 Ų128.741%0.41365%0.646SS.*Hα-helixtrans-76.6-38.9179.700000111.7F152 D153 F160F152-A156 HydrophobicContact CD1-CB 4.45Å; F152-A156 HydrophobicContact CE1-CB 3.48Å; F152-A156 VanDerWaalsContact CE1-CB 3.48Å; F152-A156 HydrophobicContact CZ-CB 3.57Å; D153-A156 PolarHBondContact O-N 3.44Å; A156-F160 PolarHBondContact O-N 3.45Å
157S39.1Very low35.6Very low45 Ų45132.1 Ų132.132%0.31565%0.653SS.*Hα-helixtrans-68.4-42.9178.4-51.10000112.8F152 T159 F160 Y161F152-S157 VanDerWaalsContact CD1-OG 3.25Å; F152-S157 WeakPolarHBondContact CD1-OG 3.42Å; F152-S157 WeakPolarHBondContact CE1-OG 3.25Å; S157-T159 VanDerWaalsContact C-N 3.33Å; S157-T159 PolarHBondContact O-N 3.39Å; S157-F160 PolarHBondContact O-N 3.1Å; S157-Y161 WeakPolarHBondContact O-CD2 3.18Å; S157-Y161 PolarHBondContact O-N 3.08Å
158L37.9Very low35.8Very low94 Ų94132.7 Ų132.749%0.49266%0.656SS.*Hα-helixtrans-64.9-37.9-179.4-106.4150.2000112Q154 F160 Q162Q154-L158 PolarHBondContact O-N 3.11Å; L158-F160 VanDerWaalsContact C-N 3.29Å; L158-F160 PolarHBondContact O-N 3.27Å; L158-Q162 HydrophobicContact CD2-CG 4.09Å; L158-Q162 VanDerWaalsContact CD2-NE2 3.32Å; L158-Q162 WeakPolarHBondContact O-CB 3.4Å; L158-Q162 VanDerWaalsContact O-CG 3.22Å; L158-Q162 WeakPolarHBondContact O-CG 3.47Å; L158-Q162 PolarHBondContact O-N 3.31Å
159T38.5Very low36.2Very low85 Ų85132.2 Ų132.252%0.52165%0.651SS.*Hα-helixtrans-66.3-34.4178.4-45.80000111.5H155 S157 K163H155-T159 PolarHBondContact O-N 3.26Å; H155-T159 PolarHBondContact O-OG1 3.45Å; S157-T159 VanDerWaalsContact C-N 3.33Å; S157-T159 PolarHBondContact O-N 3.39Å; T159-K163 WeakPolarHBondContact O-CB 3.22Å; T159-K163 PolarHBondContact O-N 3.43Å
160F31.8Very low36.4Very low138 Ų138132.3 Ų132.361%0.60566%0.661SS**Hα-helixtrans-69.9-48.2178.7-170.9-99000112.3A156 S157 L158 I164A156-F160 PolarHBondContact O-N 3.45Å; S157-F160 PolarHBondContact O-N 3.1Å; L158-F160 VanDerWaalsContact C-N 3.29Å; L158-F160 PolarHBondContact O-N 3.27Å; F160-I164 HydrophobicContact CE1-CD1 4.23Å; F160-I164 WeakPolarHBondContact O-CG1 3.45Å
161Y30.8Very low36.4Very low167 Ų167135.4 Ų135.466%0.65566%0.663SS**Hα-helixtrans-74.5-35.4178.8-75.7-79.6000113.4S157 K163 I164 H165S157-Y161 WeakPolarHBondContact O-CD2 3.18Å; S157-Y161 PolarHBondContact O-N 3.08Å; Y161-K163 VanDerWaalsContact C-N 3.33Å; Y161-K163 PolarHBondContact O-N 2.97Å; Y161-I164 PolarHBondContact O-N 2.97Å; Y161-H165 PolarHBondContact O-N 3.24Å
162Q30.4Very low36.3Very low111 Ų111131.2 Ų131.252%0.51965%0.65SS.*Hα-helixtrans-64-39.1176.8-77.2176.6-18.400111.3L158 I164 H165 T166L158-Q162 HydrophobicContact CD2-CG 4.09Å; L158-Q162 VanDerWaalsContact CD2-NE2 3.32Å; L158-Q162 WeakPolarHBondContact O-CB 3.4Å; L158-Q162 VanDerWaalsContact O-CG 3.22Å; L158-Q162 WeakPolarHBondContact O-CG 3.47Å; L158-Q162 PolarHBondContact O-N 3.31Å; Q162-I164 PolarHBondContact O-N 2.91Å; Q162-I164 VanDerWaalsContact O-N 3.11Å; Q162-H165 PolarHBondContact O-N 3.27Å; Q162-H165 VanDerWaalsContact O-N 3.1Å; Q162-T166 PolarHBondContact O-N 3.41Å; Q162-T166 PolarHBondContact O-OG1 3.48Å
163K32.3Very low36.4Very low176 Ų176136 Ų13677%0.76567%0.666SS**Hα-helixtrans-60.6-25.6178.8-129174.5-178.31790113.7T159 Y161T159-K163 WeakPolarHBondContact O-CB 3.22Å; T159-K163 PolarHBondContact O-N 3.43Å; Y161-K163 VanDerWaalsContact C-N 3.33Å; Y161-K163 PolarHBondContact O-N 2.97Å
164I36.9Very low36.3Very low115 Ų115137.2 Ų137.259%0.5967%0.672SS**Hα-helixtrans-82.9-29.5-179.6-57.7176.8000111.2F160 Y161 Q162F160-I164 HydrophobicContact CE1-CD1 4.23Å; F160-I164 WeakPolarHBondContact O-CG1 3.45Å; Y161-I164 PolarHBondContact O-N 2.97Å; Q162-I164 PolarHBondContact O-N 2.91Å; Q162-I164 VanDerWaalsContact O-N 3.11Å
165H31.2Very low36.3Very low158 Ų158139.3 Ų139.373%0.73168%0.679SS**Hα-helixtrans-96.9-22.4179.7-90.2-50.2000115.7Y161 Q162 R167Y161-H165 PolarHBondContact O-N 3.24Å; Q162-H165 PolarHBondContact O-N 3.27Å; Q162-H165 VanDerWaalsContact O-N 3.1Å; H165-R167 VanDerWaalsContact C-N 3.29Å; H165-R167 PolarHBondContact O-N 3.18Å
166T30.4Very low36.4Very low116 Ų116138.2 Ų138.271%0.71269%0.687SS**  trans-83.39.1-175.8-21.50000115.4Q162 E168Q162-T166 PolarHBondContact O-N 3.41Å; Q162-T166 PolarHBondContact O-OG1 3.48Å; T166-E168 PolarHBondContact O-N 2.72Å
167R33.8Very low36.3Very low238 Ų238147.1 Ų147.190%0.89871%0.709SS**  trans-89.160.8164.6-158.1-178.6-174.5-164.72110H165H165-R167 VanDerWaalsContact C-N 3.29Å; H165-R167 PolarHBondContact O-N 3.18Å
168E37.2Very low36.6Very low175 Ų175158.4 Ų158.482%0.81875%0.753SS**  trans-74.2138.2171.2-75.6-164.2150.800111.9T166T166-E168 PolarHBondContact O-N 2.72Å
169K47.3Very low36.6Very low171 Ų171161.7 Ų161.774%0.74377%0.766SS**  trans-56.2162.9170.5-69.2163.5170.5172.20112.4F171K169-F171 HydrophobicContact CD-CD2 4.31Å
170P36.1Very low36.5Very low130 Ų130165.7 Ų165.784%0.84478%0.779SS**  trans-115.4109.8134.916.12.1000110.3
171F36.9Very low36.7Very low181 Ų181167.2 Ų167.279%0.79479%0.789SS**  trans-78.5110.9156.8-120-94.7000107K169K169-F171 HydrophobicContact CD-CD2 4.31Å
172G37.5Very low37.1Very low64 Ų64167.2 Ų167.266%0.6680%0.796SS**  trans-87112.2169.900000110N174G172-N174 PolarHBondContact O-N 2.76Å; G172-N174 PolarHBondContact O-OD1 3.21Å
173Y37.6Very low37.5Very low224 Ų224170.8 Ų170.888%0.87881%0.814SS**  trans-76113.5179.4-141.7-92.6000110.3K175Y173-K175 PolarHBondContact O-N 2.99Å
174N38.8Very low37.8Very low141 Ų141170.4 Ų170.475%0.75482%0.817SS**  trans-74.2109.8173.5-4.4-21000108.5G172 C176G172-N174 PolarHBondContact O-N 2.76Å; G172-N174 PolarHBondContact O-OD1 3.21Å; N174-C176 PolarHBondContact O-N 3.24Å
175K41.2Very low37.9Very low198 Ų198174.4 Ų174.486%0.86183%0.833SS**  trans-8191.8174.1-162.5177.4-173.11770109.3Y173Y173-K175 PolarHBondContact O-N 2.99Å
176C40.5Very low38.4Very low126 Ų126175.6 Ų175.685%0.85184%0.841SS**  trans-74.7121.2161.1-68.40000109.1N174N174-C176 PolarHBondContact O-N 3.24Å
177R37Very low39.1Very low236 Ų236180.6 Ų180.689%0.89185%0.852SS**  trans-141.9135.5154.7-158.2173.9-174.5175.51.9108.9
178K45.2Very low39.6Very low283 Ų283175.4 Ų175.4100%1.2385%0.848SS**  trans-38.50-174.3-71.5171173172.80116.2

Retrieved 178 of 178 residues in 37.3 ms (Link to these results)

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