A0A061I9L9_CRIGR Loading...

Complex 1 LYR protein containing protein

AlphaFold DB , UniProt , Accession A0A061I9L9, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Lyrm4, Length 91 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M51.8Low82.6Confident239 Ų23990.5 Ų90.5100%1.17751%0.508SS*.  0120.30-74.3-75.9-154.500107.7
2A58.6Low84Confident94 Ų9484.4 Ų84.478%0.77747%0.473SS*.PPolyproline II helixtrans-71.3137.8178.200000110.1
3A65Low85.1Confident58 Ų5882.8 Ų82.848%0.47946%0.456SS..PPolyproline II helixtrans-61.1139.5175.700000110.3S5 P49A3-S5 PolarHBondContact O-N 3.08Å; A3-P49 HydrophobicContact CB-CB 4.09Å
4S75.1Confident86Confident14 Ų1485.1 Ų85.110%0.09845%0.454CS..PPolyproline II helixtrans-57.4128.2173.6-720000110.3Q53S4-Q53 VanDerWaalsContact OG-CD 3.31Å; S4-Q53 PolarHBondContact OG-NE2 3.01Å; S4-Q53 PolarHBondContact OG-OE1 2.99Å
5S87.4Confident86.9Confident56 Ų5680.6 Ų80.639%0.39243%0.434SS..PPolyproline II helixtrans-72.9153.5-176.179.60000111.2A3 A7 Q8 V9A3-S5 PolarHBondContact O-N 3.08Å; S5-A7 PolarHBondContact O-N 3.25Å; S5-A7 VanDerWaalsContact O-N 3.12Å; S5-Q8 WeakPolarHBondContact O-CB 3.43Å; S5-Q8 PolarHBondContact O-N 2.75Å; S5-Q8 WeakPolarHBondContact OG-CG 3.31Å; S5-Q8 PolarHBondContact OG-N 2.84Å; S5-V9 PolarHBondContact O-N 3.01Å; S5-V9 VanDerWaalsContact O-N 3.13Å
6R91.8Very high87.6Confident197 Ų19776 Ų7674%0.74341%0.409SS*.Hα-helixtrans-51.5-37173.5-178.9-178.5174.4-81.81.2112.2V9 L10R6-V9 PolarHBondContact O-N 3.34Å; R6-L10 HydrophobicContact CG-CD1 4.32Å; R6-L10 WeakPolarHBondContact O-CG 3.31Å; R6-L10 PolarHBondContact O-N 3.11Å; R6-L10 VanDerWaalsContact O-N 3.12Å
7A93.9Very high88.3Confident55 Ų5573.1 Ų73.146%0.45539%0.393SS..Hα-helixtrans-62.6-48.1177.300000111.4S5 V9 L10 D11S5-A7 PolarHBondContact O-N 3.25Å; S5-A7 VanDerWaalsContact O-N 3.12Å; A7-V9 VanDerWaalsContact C-N 3.31Å; A7-V9 PolarHBondContact O-N 2.9Å; A7-L10 PolarHBondContact O-N 3.12Å; A7-L10 VanDerWaalsContact O-N 3.17Å; A7-D11 PolarHBondContact O-N 3.19Å
8Q93.9Very high88.9Confident104 Ų10476.9 Ų76.949%0.48640%0.401SS..Hα-helixtrans-59.4-40.7178-70.5172.6-33.200112.4S5 D11 L12S5-Q8 WeakPolarHBondContact O-CB 3.43Å; S5-Q8 PolarHBondContact O-N 2.75Å; S5-Q8 WeakPolarHBondContact OG-CG 3.31Å; S5-Q8 PolarHBondContact OG-N 2.84Å; Q8-D11 PolarHBondContact O-N 3.16Å; Q8-L12 VanDerWaalsContact O-CB 3.32Å; Q8-L12 WeakPolarHBondContact O-CB 3.31Å; Q8-L12 PolarHBondContact O-N 3.39Å
9V96.6Very high89.4Confident40 Ų4075.2 Ų75.224%0.24239%0.39CS..Hα-helixtrans-63.4-44.8177.2178.50000111.1S5 R6 A7 L12 Y13 F40 V56S5-V9 PolarHBondContact O-N 3.01Å; S5-V9 VanDerWaalsContact O-N 3.13Å; R6-V9 PolarHBondContact O-N 3.34Å; A7-V9 VanDerWaalsContact C-N 3.31Å; A7-V9 PolarHBondContact O-N 2.9Å; V9-L12 PolarHBondContact O-N 3.4Å; V9-Y13 WeakPolarHBondContact O-CB 3.44Å; V9-Y13 PolarHBondContact O-N 2.9Å; V9-F40 HydrophobicContact CG1-CD1 4.13Å; V9-F40 HydrophobicContact CG1-CE1 3.88Å; V9-V56 HydrophobicContact CG2-CG2 3.85Å
10L97.2Very high89.8Confident51 Ų5171.4 Ų71.427%0.26737%0.371SS..Hα-helixtrans-68.5-36.8179.5-71176.8000112.7R6 A7 Y13 R14R6-L10 HydrophobicContact CG-CD1 4.32Å; R6-L10 WeakPolarHBondContact O-CG 3.31Å; R6-L10 PolarHBondContact O-N 3.11Å; R6-L10 VanDerWaalsContact O-N 3.12Å; A7-L10 PolarHBondContact O-N 3.12Å; A7-L10 VanDerWaalsContact O-N 3.17Å; L10-Y13 PolarHBondContact O-N 3.27Å; L10-R14 WeakPolarHBondContact O-CG 3.37Å; L10-R14 PolarHBondContact O-N 3.07Å
11D97.9Very high90.2Very high88 Ų8874.7 Ų74.747%0.47138%0.382SS..Hα-helixtrans-68.7-40.1177.1-69.1-21000111.4A7 Q8 R14 A15A7-D11 PolarHBondContact O-N 3.19Å; Q8-D11 PolarHBondContact O-N 3.16Å; D11-R14 PolarHBondContact O-N 3.46Å; D11-R14 IonicContact OD1-NH1 3.85Å; D11-R14 PolarHBondContact OD1-NH1 3.3Å; D11-A15 WeakPolarHBondContact O-CB 3.49Å; D11-A15 PolarHBondContact O-N 3.46Å
12L98.3Very high92.4Very high17 Ų1768.3 Ų68.39%0.08935%0.349CS..Hα-helixtrans-62.7-45.5173.1-176.256000111.6Q8 V9 R14 A15 M16 V56 A59 K60 L63Q8-L12 VanDerWaalsContact O-CB 3.32Å; Q8-L12 WeakPolarHBondContact O-CB 3.31Å; Q8-L12 PolarHBondContact O-N 3.39Å; V9-L12 PolarHBondContact O-N 3.4Å; L12-R14 PolarHBondContact O-N 2.79Å; L12-A15 PolarHBondContact O-N 3.34Å; L12-M16 HydrophobicContact CD1-CG 4.23Å; L12-M16 HydrophobicContact CD1-SD 4.43Å; L12-M16 HydrophobicContact CG-SD 4.29Å; L12-M16 VanDerWaalsContact O-CG 3.32Å; L12-M16 WeakPolarHBondContact O-CG 3.44Å; L12-M16 PolarHBondContact O-N 2.72Å; L12-V56 HydrophobicContact CD2-CG1 4.2Å; L12-A59 HydrophobicContact CD2-CB 3.49Å; L12-A59 VanDerWaalsContact CD2-CB 3.49Å; L12-A59 HydrophobicContact CG-CB 4.15Å; L12-K60 HydrophobicContact CD1-CG 4.29Å; L12-K60 HydrophobicContact CD2-CG 3.95Å; L12-L63 HydrophobicContact CD1-CB 4.36Å; L12-L63 HydrophobicContact CD1-CD2 3.86Å
13Y98.6Very high94.3Very high64 Ų6464.8 Ų64.825%0.25132%0.316SS..Hα-helixtrans-55.4-49174.8175.8-114.6000112.1V9 L10 A15 M16 L17 I36 F40V9-Y13 WeakPolarHBondContact O-CB 3.44Å; V9-Y13 PolarHBondContact O-N 2.9Å; L10-Y13 PolarHBondContact O-N 3.27Å; Y13-A15 PolarHBondContact O-N 3.44Å; Y13-M16 PolarHBondContact O-N 3.42Å; Y13-L17 HydrophobicContact CD1-CD1 4.18Å; Y13-L17 HydrophobicContact CD2-CD1 4.38Å; Y13-L17 HydrophobicContact CD2-CG 4.45Å; Y13-L17 HydrophobicContact CE1-CD1 3.58Å; Y13-L17 HydrophobicContact CE2-CD1 3.81Å; Y13-L17 HydrophobicContact CE2-CG 4.12Å; Y13-L17 WeakPolarHBondContact O-CG 3.46Å; Y13-L17 PolarHBondContact O-N 3.25Å; Y13-I36 HydrophobicContact CD2-CG2 3.8Å; Y13-I36 HydrophobicContact CE2-CG2 3.85Å; Y13-F40 HydrophobicContact CD2-CB 3.91Å; Y13-F40 AromaticContact CD2-CD1 3.8Å; Y13-F40 HydrophobicContact CD2-CD1 3.8Å; Y13-F40 AromaticContact CD2-CD2 3.71Å; Y13-F40 HydrophobicContact CD2-CD2 3.71Å; Y13-F40 HydrophobicContact CD2-CE1 4.19Å; Y13-F40 HydrophobicContact CD2-CE2 4.1Å; Y13-F40 AromaticContact CD2-CG 3.52Å; Y13-F40 HydrophobicContact CD2-CG 3.52Å; Y13-F40 HydrophobicContact CD2-CZ 4.32Å; Y13-F40 HydrophobicContact CE2-CB 4.07Å; Y13-F40 HydrophobicContact CE2-CD2 4.36Å; Y13-F40 HydrophobicContact CE2-CG 4.16Å; Y13-F40 HydrophobicContact CG-CD1 4.12Å; Y13-F40 HydrophobicContact CG-CE1 4.33Å; Y13-F40 HydrophobicContact CG-CG 4.31Å
14R98.6Very high95.8Very high114 Ų11464.1 Ų64.143%0.4331%0.309SS..Hα-helixtrans-63.8-40.9177.5-69.8178.4-168.8113.9-2.9111.8L10 D11 L12 L17 R18L10-R14 WeakPolarHBondContact O-CG 3.37Å; L10-R14 PolarHBondContact O-N 3.07Å; D11-R14 PolarHBondContact O-N 3.46Å; D11-R14 IonicContact OD1-NH1 3.85Å; D11-R14 PolarHBondContact OD1-NH1 3.3Å; L12-R14 PolarHBondContact O-N 2.79Å; R14-L17 PolarHBondContact O-N 2.92Å; R14-R18 WeakPolarHBondContact O-CB 3.41Å; R14-R18 WeakPolarHBondContact O-CG 3.46Å; R14-R18 PolarHBondContact O-N 3.01Å
15A98.6Very high96.8Very high18 Ų1865 Ų6515%0.14932%0.317CS..Hα-helixtrans-61.3-47.9177.600000111.4D11 L12 Y13 L17 R18 E19 L63D11-A15 WeakPolarHBondContact O-CB 3.49Å; D11-A15 PolarHBondContact O-N 3.46Å; L12-A15 PolarHBondContact O-N 3.34Å; Y13-A15 PolarHBondContact O-N 3.44Å; A15-L17 PolarHBondContact O-N 2.94Å; A15-R18 PolarHBondContact O-N 3.28Å; A15-E19 WeakPolarHBondContact O-CB 3.48Å; A15-E19 PolarHBondContact O-N 2.86Å; A15-L63 HydrophobicContact CB-CD1 4.47Å; A15-L63 HydrophobicContact CB-CD2 4.1Å
16M98.8Very high97.2Very high7 Ų766 Ų663%0.03431%0.312CS..Hα-helixtrans-61.7-42.1177.7-66.6179.982.100112.2L12 Y13 S20 I36 F40 A59 D62 L63 I66L12-M16 HydrophobicContact CD1-CG 4.23Å; L12-M16 HydrophobicContact CD1-SD 4.43Å; L12-M16 HydrophobicContact CG-SD 4.29Å; L12-M16 VanDerWaalsContact O-CG 3.32Å; L12-M16 WeakPolarHBondContact O-CG 3.44Å; L12-M16 PolarHBondContact O-N 2.72Å; Y13-M16 PolarHBondContact O-N 3.42Å; M16-S20 VanDerWaalsContact O-CB 3.32Å; M16-S20 WeakPolarHBondContact O-CB 3.34Å; M16-S20 PolarHBondContact O-N 3.43Å; M16-S20 PolarHBondContact O-OG 3.47Å; M16-I36 HydrophobicContact CB-CD1 3.73Å; M16-I36 HydrophobicContact CB-CG1 4.27Å; M16-I36 HydrophobicContact CB-CG2 4.15Å; M16-I36 HydrophobicContact CE-CD1 4.38Å; M16-I36 HydrophobicContact CE-CG1 4.03Å; M16-F40 HydrophobicContact SD-CE2 3.73Å; M16-F40 HydrophobicContact SD-CZ 3.94Å; M16-A59 HydrophobicContact SD-CB 3.91Å; M16-D62 HydrophobicContact CE-CB 3.83Å; M16-L63 HydrophobicContact CB-CD1 4.47Å; M16-L63 HydrophobicContact CG-CB 4Å; M16-L63 HydrophobicContact CG-CD1 3.96Å; M16-L63 HydrophobicContact CG-CG 4.46Å; M16-I66 HydrophobicContact CE-CD1 4Å
17L98.8Very high97.5Very high26 Ų2660.9 Ų60.914%0.13630%0.3CS..Hα-helixtrans-66.8-38.8176.5-73.7-177.1000113.2Y13 R14 A15 K21 V33 I36 R37Y13-L17 HydrophobicContact CD1-CD1 4.18Å; Y13-L17 HydrophobicContact CD2-CD1 4.38Å; Y13-L17 HydrophobicContact CD2-CG 4.45Å; Y13-L17 HydrophobicContact CE1-CD1 3.58Å; Y13-L17 HydrophobicContact CE2-CD1 3.81Å; Y13-L17 HydrophobicContact CE2-CG 4.12Å; Y13-L17 WeakPolarHBondContact O-CG 3.46Å; Y13-L17 PolarHBondContact O-N 3.25Å; R14-L17 PolarHBondContact O-N 2.92Å; A15-L17 PolarHBondContact O-N 2.94Å; L17-K21 WeakPolarHBondContact O-CG 3.33Å; L17-K21 PolarHBondContact O-N 2.92Å; L17-V33 HydrophobicContact CD2-CG1 4.18Å; L17-I36 HydrophobicContact CD2-CB 4.11Å; L17-I36 HydrophobicContact CD2-CG2 3.8Å; L17-I36 HydrophobicContact CG-CG2 4.07Å; L17-R37 HydrophobicContact CD2-CG 4.27Å
18R98.6Very high97.6Very high143 Ų14364.6 Ų64.654%0.5430%0.303SS..Hα-helixtrans-64.6-50.2175.7-76.9-173.2-61.5-110.7-0.4110.5R14 A15 S20 K21 H22R14-R18 WeakPolarHBondContact O-CB 3.41Å; R14-R18 WeakPolarHBondContact O-CG 3.46Å; R14-R18 PolarHBondContact O-N 3.01Å; A15-R18 PolarHBondContact O-N 3.28Å; R18-S20 VanDerWaalsContact C-N 3.34Å; R18-S20 PolarHBondContact O-N 2.92Å; R18-K21 WeakPolarHBondContact O-CB 3.49Å; R18-K21 PolarHBondContact O-N 3.03Å; R18-H22 PolarHBondContact O-CD2 2.82Å; R18-H22 VanDerWaalsContact O-CD2 3.29Å
19E98.6Very high97.8Very high43 Ų4362.2 Ų62.220%0.20129%0.29CS..Hα-helixtrans-60.1-44.6-179.4-163.667.7-147.100111.7A15 K21 H22 L63 I66 R67 V70A15-E19 WeakPolarHBondContact O-CB 3.48Å; A15-E19 PolarHBondContact O-N 2.86Å; E19-K21 PolarHBondContact O-N 3.44Å; E19-K21 VanDerWaalsContact O-N 3.11Å; E19-H22 WeakPolarHBondContact O-CB 3.3Å; E19-H22 PolarHBondContact O-N 3.17Å; E19-L63 HydrophobicContact CB-CD1 4.04Å; E19-L63 HydrophobicContact CG-CD1 4.46Å; E19-I66 HydrophobicContact CB-CG2 3.86Å; E19-I66 HydrophobicContact CG-CB 4.35Å; E19-I66 HydrophobicContact CG-CG2 3.53Å; E19-R67 HydrophobicContact CG-CB 4.49Å; E19-R67 HydrophobicContact CG-CG 3.7Å; E19-V70 HydrophobicContact CG-CG2 4.38Å
20S98.4Very high97.9Very high0 Ų064.9 Ų64.90%030%0.3CS..Hα-helixtrans-60.9-25.3-179.4-59.30000113.7M16 R18 H22 F23 I36M16-S20 VanDerWaalsContact O-CB 3.32Å; M16-S20 WeakPolarHBondContact O-CB 3.34Å; M16-S20 PolarHBondContact O-N 3.43Å; M16-S20 PolarHBondContact O-OG 3.47Å; R18-S20 VanDerWaalsContact C-N 3.34Å; R18-S20 PolarHBondContact O-N 2.92Å; S20-H22 PolarHBondContact O-N 3.47Å; S20-F23 WeakPolarHBondContact O-CD2 3.28Å; S20-F23 PolarHBondContact O-N 3.43Å; S20-I36 WeakPolarHBondContact OG-CD1 3.28Å
21K97.6Very high98Very high140 Ų14068.8 Ų68.861%0.60931%0.312SS*.THydrogen-bonded Turntrans-70.2-19176-71.8176.7-178.2-1710112.8L17 R18 E19 F23 R29L17-K21 WeakPolarHBondContact O-CG 3.33Å; L17-K21 PolarHBondContact O-N 2.92Å; R18-K21 WeakPolarHBondContact O-CB 3.49Å; R18-K21 PolarHBondContact O-N 3.03Å; E19-K21 PolarHBondContact O-N 3.44Å; E19-K21 VanDerWaalsContact O-N 3.11Å; K21-F23 VanDerWaalsContact C-N 3.32Å; K21-R29 WeakPolarHBondContact O-CD 3.41Å
22H97.9Very high98Very high106 Ų10665.1 Ų65.149%0.49129%0.294SS..THydrogen-bonded Turntrans-83.9-4.7-179.8-64.3-64.1000113.8R18 E19 S20 S24 V70 Q74R18-H22 PolarHBondContact O-CD2 2.82Å; R18-H22 VanDerWaalsContact O-CD2 3.29Å; E19-H22 WeakPolarHBondContact O-CB 3.3Å; E19-H22 PolarHBondContact O-N 3.17Å; S20-H22 PolarHBondContact O-N 3.47Å; H22-S24 PolarHBondContact O-N 3.11Å; H22-V70 HydrophobicContact CB-CG1 3.51Å; H22-V70 HydrophobicContact CB-CG2 4.31Å; H22-Q74 PolarHBondContact O-NE2 3.34Å
23F98.3Very high98Very high19 Ų1965.5 Ų65.58%0.08330%0.298CS..  trans-58.9123.5169.3-83.9-62.1000110.4S20 K21 R29 A32 I66 Q69 V70S20-F23 WeakPolarHBondContact O-CD2 3.28Å; S20-F23 PolarHBondContact O-N 3.43Å; K21-F23 VanDerWaalsContact C-N 3.32Å; F23-R29 HydrophobicContact CB-CB 3.82Å; F23-R29 PolarHBondContact O-NH1 3.38Å; F23-A32 HydrophobicContact CD2-CB 4.24Å; F23-A32 HydrophobicContact CE2-CB 3.98Å; F23-I66 HydrophobicContact CE2-CG2 3.75Å; F23-I66 HydrophobicContact CZ-CG2 4.1Å; F23-Q69 HydrophobicContact CE1-CB 3.62Å; F23-Q69 HydrophobicContact CZ-CB 3.86Å; F23-V70 HydrophobicContact CD1-CG2 3.78Å; F23-V70 HydrophobicContact CD2-CG2 4Å; F23-V70 HydrophobicContact CE1-CG2 3.85Å; F23-V70 HydrophobicContact CE2-CG2 4.07Å; F23-V70 HydrophobicContact CG-CG2 3.85Å; F23-V70 HydrophobicContact CZ-CG2 3.98Å
24S96Very high98Very high45 Ų4569.8 Ų69.832%0.31531%0.313SS..SBendtrans-63.2-49.8174.250.60000110.9H22 Y26 R29 G73H22-S24 PolarHBondContact O-N 3.11Å; S24-Y26 PolarHBondContact O-N 3.39Å; S24-R29 PolarHBondContact O-NH1 3.47Å; S24-G73 VanDerWaalsContact OG-C 3.28Å; S24-G73 PolarHBondContact OG-O 2.97Å
25A96.7Very high98Very high32 Ų3269.4 Ų69.426%0.26431%0.312SS..SBendtrans-67.9123.5179.500000112.5N27 Y28 R29A25-N27 WeakPolarHBondContact CB-OD1 3.37Å; A25-N27 PolarHBondContact O-N 2.91Å; A25-Y28 HydrophobicContact CB-CD2 4.17Å; A25-Y28 HydrophobicContact CB-CG 4.4Å; A25-Y28 PolarHBondContact O-N 3.29Å; A25-R29 WeakPolarHBondContact O-CB 3.36Å; A25-R29 PolarHBondContact O-N 2.7Å
26Y96.1Very high98Very high76 Ų7669 Ų6930%0.29831%0.307SS..Hα-helixtrans-55.9-49.7-177.6177.5-95.3000113.8S24 Y28 R29 M30 L81 I83 E84S24-Y26 PolarHBondContact O-N 3.39Å; Y26-Y28 VanDerWaalsContact C-N 3.33Å; Y26-Y28 PolarHBondContact O-N 3.28Å; Y26-R29 PolarHBondContact O-N 2.93Å; Y26-M30 HydrophobicContact CD1-CG 4.2Å; Y26-M30 HydrophobicContact CD2-CG 4.13Å; Y26-M30 HydrophobicContact CE1-CG 3.85Å; Y26-M30 HydrophobicContact CE2-CG 3.75Å; Y26-M30 HydrophobicContact CE2-SD 4.29Å; Y26-M30 HydrophobicContact CG-CG 4.33Å; Y26-M30 WeakPolarHBondContact O-CB 3.13Å; Y26-M30 VanDerWaalsContact O-CG 3.31Å; Y26-M30 WeakPolarHBondContact O-CG 3.43Å; Y26-M30 PolarHBondContact O-N 3.24Å; Y26-L81 HydrophobicContact CD1-CD1 4Å; Y26-L81 HydrophobicContact CG-CD1 4.25Å; Y26-I83 HydrophobicContact CD1-CD1 4.01Å; Y26-I83 HydrophobicContact CE1-CD1 3.59Å; Y26-E84 WeakPolarHBondContact CB-OE1 3.36Å; Y26-E84 HydrophobicContact CD2-CG 3.55Å; Y26-E84 HydrophobicContact CE2-CG 4.24Å; Y26-E84 HydrophobicContact CG-CG 4.04Å
27N97Very high98Very high90 Ų9075.4 Ų75.448%0.48133%0.331SS..Hα-helixtrans-57.9-44.5-178.859.4-29.2000111.6A25 Y31A25-N27 WeakPolarHBondContact CB-OD1 3.37Å; A25-N27 PolarHBondContact O-N 2.91Å; N27-Y31 WeakPolarHBondContact O-CB 3.32Å; N27-Y31 PolarHBondContact O-N 3.5Å
28Y97.8Very high98Very high133 Ų13377.4 Ų77.452%0.52234%0.342SS..Hα-helixtrans-69.1-43.9177.9-69-10.2000112.3A25 Y26 M30 Y31 A32A25-Y28 HydrophobicContact CB-CD2 4.17Å; A25-Y28 HydrophobicContact CB-CG 4.4Å; A25-Y28 PolarHBondContact O-N 3.29Å; Y26-Y28 VanDerWaalsContact C-N 3.33Å; Y26-Y28 PolarHBondContact O-N 3.28Å; Y28-M30 PolarHBondContact O-N 3.08Å; Y28-Y31 PolarHBondContact O-N 3.05Å; Y28-A32 VanDerWaalsContact O-CB 3.22Å; Y28-A32 WeakPolarHBondContact O-CB 3.44Å; Y28-A32 PolarHBondContact O-N 3.07Å
29R98Very high97.9Very high55 Ų5571.7 Ų71.721%0.20833%0.325CS..Hα-helixtrans-56.1-51175.4-176.5166.863.9-106.52.8111.6K21 F23 S24 A25 Y26 V33 E84K21-R29 WeakPolarHBondContact O-CD 3.41Å; F23-R29 HydrophobicContact CB-CB 3.82Å; F23-R29 PolarHBondContact O-NH1 3.38Å; S24-R29 PolarHBondContact O-NH1 3.47Å; A25-R29 WeakPolarHBondContact O-CB 3.36Å; A25-R29 PolarHBondContact O-N 2.7Å; Y26-R29 PolarHBondContact O-N 2.93Å; R29-V33 WeakPolarHBondContact O-CB 3.43Å; R29-V33 VanDerWaalsContact O-CG2 3.28Å; R29-V33 WeakPolarHBondContact O-CG2 3.32Å; R29-V33 PolarHBondContact O-N 2.93Å; R29-V33 VanDerWaalsContact O-N 3.16Å; R29-E84 IonicContact CZ-OE2 3.01Å; R29-E84 IonicContact NH2-OE2 3.71Å; R29-E84 PolarHBondContact NH2-OE2 2.93Å
30M98Very high97.9Very high95 Ų9572.1 Ų72.147%0.46833%0.327SS..Hα-helixtrans-68.2-42.7-178.5-66.8-55.1-70.400112.2Y26 Y28 R34Y26-M30 HydrophobicContact CD1-CG 4.2Å; Y26-M30 HydrophobicContact CD2-CG 4.13Å; Y26-M30 HydrophobicContact CE1-CG 3.85Å; Y26-M30 HydrophobicContact CE2-CG 3.75Å; Y26-M30 HydrophobicContact CE2-SD 4.29Å; Y26-M30 HydrophobicContact CG-CG 4.33Å; Y26-M30 WeakPolarHBondContact O-CB 3.13Å; Y26-M30 VanDerWaalsContact O-CG 3.31Å; Y26-M30 WeakPolarHBondContact O-CG 3.43Å; Y26-M30 PolarHBondContact O-N 3.24Å; Y28-M30 PolarHBondContact O-N 3.08Å; M30-R34 WeakPolarHBondContact O-CB 3.37Å; M30-R34 PolarHBondContact O-N 3.28Å; M30-R34 VanDerWaalsContact O-N 3.07Å
31Y98.4Very high97.9Very high133 Ų13381.9 Ų81.952%0.52236%0.363SS..Hα-helixtrans-62-50.6177.1170.3-103.8000111.8N27 Y28 V33 R34 R35N27-Y31 WeakPolarHBondContact O-CB 3.32Å; N27-Y31 PolarHBondContact O-N 3.5Å; Y28-Y31 PolarHBondContact O-N 3.05Å; Y31-V33 PolarHBondContact O-N 3.34Å; Y31-R34 PolarHBondContact O-N 2.87Å; Y31-R35 HydrophobicContact CE2-CB 4.27Å; Y31-R35 WeakPolarHBondContact O-CB 3.34Å; Y31-R35 PolarHBondContact O-N 3.08Å
32A98.5Very high97.9Very high11 Ų1180.8 Ų80.89%0.09136%0.36CS..Hα-helixtrans-60.5-48.2-177.500000111.1F23 Y28 R34 R35 I36F23-A32 HydrophobicContact CD2-CB 4.24Å; F23-A32 HydrophobicContact CE2-CB 3.98Å; Y28-A32 VanDerWaalsContact O-CB 3.22Å; Y28-A32 WeakPolarHBondContact O-CB 3.44Å; Y28-A32 PolarHBondContact O-N 3.07Å; A32-R34 VanDerWaalsContact C-N 3.35Å; A32-R34 PolarHBondContact O-N 3.41Å; A32-R35 PolarHBondContact O-N 3.49Å; A32-I36 WeakPolarHBondContact O-CB 3.46Å; A32-I36 VanDerWaalsContact O-CD1 3.28Å; A32-I36 WeakPolarHBondContact O-CD1 3.06Å; A32-I36 WeakPolarHBondContact O-CG1 3.24Å; A32-I36 PolarHBondContact O-N 3.45Å
33V98.4Very high97.9Very high26 Ų2678.4 Ų78.416%0.15835%0.351CS..Hα-helixtrans-58.5-45.7177.5169.70000111.6L17 R29 Y31 R37L17-V33 HydrophobicContact CD2-CG1 4.18Å; R29-V33 WeakPolarHBondContact O-CB 3.43Å; R29-V33 VanDerWaalsContact O-CG2 3.28Å; R29-V33 WeakPolarHBondContact O-CG2 3.32Å; R29-V33 PolarHBondContact O-N 2.93Å; R29-V33 VanDerWaalsContact O-N 3.16Å; Y31-V33 PolarHBondContact O-N 3.34Å; V33-R37 WeakPolarHBondContact O-CG 3.41Å; V33-R37 PolarHBondContact O-N 3.47Å
34R98.5Very high97.7Very high154 Ų15486.1 Ų86.158%0.58139%0.385SS*.Hα-helixtrans-63.2-52.4177.6-178.3174.268.4-155.31.1111.1M30 Y31 A32 I36 R37 D38M30-R34 WeakPolarHBondContact O-CB 3.37Å; M30-R34 PolarHBondContact O-N 3.28Å; M30-R34 VanDerWaalsContact O-N 3.07Å; Y31-R34 PolarHBondContact O-N 2.87Å; A32-R34 VanDerWaalsContact C-N 3.35Å; A32-R34 PolarHBondContact O-N 3.41Å; R34-I36 VanDerWaalsContact C-N 3.29Å; R34-I36 PolarHBondContact O-N 2.99Å; R34-R37 WeakPolarHBondContact O-CB 3.19Å; R34-R37 PolarHBondContact O-N 3.29Å; R34-R37 VanDerWaalsContact O-N 3.08Å; R34-D38 VanDerWaalsContact CG-OD2 3.3Å; R34-D38 WeakPolarHBondContact CG-OD2 3.22Å; R34-D38 VanDerWaalsContact O-CG 3.27Å; R34-D38 PolarHBondContact O-N 3.41Å
35R98.4Very high97.7Very high106 Ų10688.6 Ų88.640%0.440%0.402SS..Hα-helixtrans-61-37.4-176.5-17758.9-174.6127.4-4.3112.6Y31 A32 A39 E42Y31-R35 HydrophobicContact CE2-CB 4.27Å; Y31-R35 WeakPolarHBondContact O-CB 3.34Å; Y31-R35 PolarHBondContact O-N 3.08Å; A32-R35 PolarHBondContact O-N 3.49Å; R35-A39 WeakPolarHBondContact O-CB 3.31Å; R35-A39 PolarHBondContact O-N 3.13Å; R35-E42 IonicContact NH1-OE1 2.67Å; R35-E42 IonicContact NH1-OE2 2.69Å; R35-E42 PolarHBondContact NH1-OE2 3.48Å
36I98.6Very high97.6Very high10 Ų1088.6 Ų88.65%0.05140%0.399CS..Hα-helixtrans-64.3-47.6174.8-69.5159.2000110.7Y13 M16 L17 S20 A32 R34 D38 A39 F40 I66Y13-I36 HydrophobicContact CD2-CG2 3.8Å; Y13-I36 HydrophobicContact CE2-CG2 3.85Å; M16-I36 HydrophobicContact CB-CD1 3.73Å; M16-I36 HydrophobicContact CB-CG1 4.27Å; M16-I36 HydrophobicContact CB-CG2 4.15Å; M16-I36 HydrophobicContact CE-CD1 4.38Å; M16-I36 HydrophobicContact CE-CG1 4.03Å; L17-I36 HydrophobicContact CD2-CB 4.11Å; L17-I36 HydrophobicContact CD2-CG2 3.8Å; L17-I36 HydrophobicContact CG-CG2 4.07Å; S20-I36 WeakPolarHBondContact OG-CD1 3.28Å; A32-I36 WeakPolarHBondContact O-CB 3.46Å; A32-I36 VanDerWaalsContact O-CD1 3.28Å; A32-I36 WeakPolarHBondContact O-CD1 3.06Å; A32-I36 WeakPolarHBondContact O-CG1 3.24Å; A32-I36 PolarHBondContact O-N 3.45Å; R34-I36 VanDerWaalsContact C-N 3.29Å; R34-I36 PolarHBondContact O-N 2.99Å; I36-D38 VanDerWaalsContact C-N 3.33Å; I36-D38 PolarHBondContact O-N 3Å; I36-A39 PolarHBondContact O-N 3.2Å; I36-F40 HydrophobicContact CG2-CD2 3.99Å; I36-F40 HydrophobicContact CG2-CE2 4.06Å; I36-F40 VanDerWaalsContact O-CD2 3.24Å; I36-F40 WeakPolarHBondContact O-CD2 3.3Å; I36-F40 PolarHBondContact O-N 3.05Å; I36-F40 VanDerWaalsContact O-N 3.07Å; I36-I66 HydrophobicContact CD1-CD1 3.99Å
37R98.5Very high97.5Very high141 Ų14193.7 Ų93.753%0.53242%0.422SS..Hα-helixtrans-58.3-48177.7-73.5176.3176.9-175.9-1.4111.4L17 V33 R34 R41L17-R37 HydrophobicContact CD2-CG 4.27Å; V33-R37 WeakPolarHBondContact O-CG 3.41Å; V33-R37 PolarHBondContact O-N 3.47Å; R34-R37 WeakPolarHBondContact O-CB 3.19Å; R34-R37 PolarHBondContact O-N 3.29Å; R34-R37 VanDerWaalsContact O-N 3.08Å; R37-R41 VanDerWaalsContact O-CB 3.3Å; R37-R41 WeakPolarHBondContact O-CB 3.37Å; R37-R41 PolarHBondContact O-N 3.34Å
38D98.6Very high97.4Very high67 Ų6793.1 Ų93.136%0.35842%0.419SS..Hα-helixtrans-64.7-49.4-177.6-61.7-18.7000110.3R34 I36 F40 R41 E42R34-D38 VanDerWaalsContact CG-OD2 3.3Å; R34-D38 WeakPolarHBondContact CG-OD2 3.22Å; R34-D38 VanDerWaalsContact O-CG 3.27Å; R34-D38 PolarHBondContact O-N 3.41Å; I36-D38 VanDerWaalsContact C-N 3.33Å; I36-D38 PolarHBondContact O-N 3Å; D38-F40 PolarHBondContact O-N 2.79Å; D38-R41 PolarHBondContact O-N 2.91Å; D38-R41 VanDerWaalsContact O-N 3.08Å; D38-E42 WeakPolarHBondContact O-CB 3.26Å; D38-E42 WeakPolarHBondContact O-CG 3.38Å; D38-E42 PolarHBondContact O-N 2.91Å
39A98.3Very high97.1Very high24 Ų2490.1 Ų90.120%0.19842%0.416CS..Hα-helixtrans-59.4-43.8-179.800000113.1R35 I36 R41 N43R35-A39 WeakPolarHBondContact O-CB 3.31Å; R35-A39 PolarHBondContact O-N 3.13Å; I36-A39 PolarHBondContact O-N 3.2Å; A39-R41 VanDerWaalsContact C-N 3.32Å; A39-R41 PolarHBondContact O-N 3.05Å; A39-N43 PolarHBondContact O-N 3.45Å; A39-N43 PolarHBondContact O-ND2 2.87Å
40F98Very high96.9Very high52 Ų5292.7 Ų92.723%0.22844%0.438CS..Hα-helixtrans-70.5-30178.1-83.6-104.1000112.2V9 Y13 M16 I36 D38 K44 A59V9-F40 HydrophobicContact CG1-CD1 4.13Å; V9-F40 HydrophobicContact CG1-CE1 3.88Å; Y13-F40 HydrophobicContact CD2-CB 3.91Å; Y13-F40 AromaticContact CD2-CD1 3.8Å; Y13-F40 HydrophobicContact CD2-CD1 3.8Å; Y13-F40 AromaticContact CD2-CD2 3.71Å; Y13-F40 HydrophobicContact CD2-CD2 3.71Å; Y13-F40 HydrophobicContact CD2-CE1 4.19Å; Y13-F40 HydrophobicContact CD2-CE2 4.1Å; Y13-F40 AromaticContact CD2-CG 3.52Å; Y13-F40 HydrophobicContact CD2-CG 3.52Å; Y13-F40 HydrophobicContact CD2-CZ 4.32Å; Y13-F40 HydrophobicContact CE2-CB 4.07Å; Y13-F40 HydrophobicContact CE2-CD2 4.36Å; Y13-F40 HydrophobicContact CE2-CG 4.16Å; Y13-F40 HydrophobicContact CG-CD1 4.12Å; Y13-F40 HydrophobicContact CG-CE1 4.33Å; Y13-F40 HydrophobicContact CG-CG 4.31Å; M16-F40 HydrophobicContact SD-CE2 3.73Å; M16-F40 HydrophobicContact SD-CZ 3.94Å; I36-F40 HydrophobicContact CG2-CD2 3.99Å; I36-F40 HydrophobicContact CG2-CE2 4.06Å; I36-F40 VanDerWaalsContact O-CD2 3.24Å; I36-F40 WeakPolarHBondContact O-CD2 3.3Å; I36-F40 PolarHBondContact O-N 3.05Å; I36-F40 VanDerWaalsContact O-N 3.07Å; D38-F40 PolarHBondContact O-N 2.79Å; F40-K44 PolarHBondContact O-N 3.38Å; F40-A59 HydrophobicContact CZ-CB 4.25Å
41R97.9Very high96.8Very high204 Ų20492.5 Ų92.577%0.7744%0.436SS*.Hα-helixtrans-75-43.8176.6-169.6175.8-171.5165.82.2111.8R37 D38 A39 N43 K44R37-R41 VanDerWaalsContact O-CB 3.3Å; R37-R41 WeakPolarHBondContact O-CB 3.37Å; R37-R41 PolarHBondContact O-N 3.34Å; D38-R41 PolarHBondContact O-N 2.91Å; D38-R41 VanDerWaalsContact O-N 3.08Å; A39-R41 VanDerWaalsContact C-N 3.32Å; A39-R41 PolarHBondContact O-N 3.05Å; R41-N43 PolarHBondContact O-N 3.01Å; R41-K44 VanDerWaalsContact O-CB 3.3Å; R41-K44 WeakPolarHBondContact O-CB 3.35Å; R41-K44 PolarHBondContact O-N 2.93Å
42E97.9Very high96.6Very high118 Ų11888.3 Ų88.355%0.55142%0.422SS*.Hα-helixtrans-53.7-41.3174.2-75.3162.4-170.900111R35 D38R35-E42 IonicContact NH1-OE1 2.67Å; R35-E42 IonicContact NH1-OE2 2.69Å; R35-E42 PolarHBondContact NH1-OE2 3.48Å; D38-E42 WeakPolarHBondContact O-CB 3.26Å; D38-E42 WeakPolarHBondContact O-CG 3.38Å; D38-E42 PolarHBondContact O-N 2.91Å
43N96.9Very high96.5Very high55 Ų5589.9 Ų89.929%0.29443%0.427SS..THydrogen-bonded Turntrans-95.39.4-176.3-66.4-79.3000114.4A39 R41 S45 V46 L55A39-N43 PolarHBondContact O-N 3.45Å; A39-N43 PolarHBondContact O-ND2 2.87Å; R41-N43 PolarHBondContact O-N 3.01Å; N43-S45 PolarHBondContact O-N 3.46Å; N43-V46 HydrophobicContact CB-CG2 4.09Å; N43-V46 WeakPolarHBondContact O-CG2 3.42Å; N43-V46 PolarHBondContact O-N 3Å; N43-L55 HydrophobicContact CB-CD1 3.94Å; N43-L55 WeakPolarHBondContact OD1-CD1 3.19Å
44K95.4Very high96.4Very high181 Ų18191.4 Ų91.479%0.78744%0.442SS*.THydrogen-bonded Turntrans-60.2-32.7-174.8-178.8-176.3174.8-171.40113.3F40 R41F40-K44 PolarHBondContact O-N 3.38Å; R41-K44 VanDerWaalsContact O-CB 3.3Å; R41-K44 WeakPolarHBondContact O-CB 3.35Å; R41-K44 PolarHBondContact O-N 2.93Å
45S94.8Very high96.3Very high97 Ų9786.7 Ų86.768%0.67843%0.428SS*.THydrogen-bonded Turntrans-97.64.4-174.650.10000114.2N43 K47N43-S45 PolarHBondContact O-N 3.46Å; S45-K47 PolarHBondContact O-N 3.42Å
46V95.3Very high96.3Very high32 Ų3282.1 Ų82.119%0.19441%0.412CS..  trans-63.5131.4174.9177.10000109.1N43 E51 I52 L55N43-V46 HydrophobicContact CB-CG2 4.09Å; N43-V46 WeakPolarHBondContact O-CG2 3.42Å; N43-V46 PolarHBondContact O-N 3Å; V46-E51 HydrophobicContact CG1-CB 3.94Å; V46-E51 HydrophobicContact CG1-CG 3.82Å; V46-E51 WeakPolarHBondContact CG1-OE2 3.43Å; V46-I52 HydrophobicContact CB-CG1 4.42Å; V46-I52 HydrophobicContact CG1-CG1 3.85Å; V46-L55 HydrophobicContact CG2-CD1 4.31Å
47K93.3Very high96.2Very high184 Ų18484.6 Ų84.680%0.843%0.426SS*.  trans-115.6-21.9-177.5-62.8-177.1-176.1177.50113.5S45 P49S45-K47 PolarHBondContact O-N 3.42Å; K47-P49 VanDerWaalsContact O-CD 3.25Å; K47-P49 WeakPolarHBondContact O-CD 3.4Å
48D94.9Very high96.2Very high77 Ų7782.4 Ų82.441%0.41242%0.42SS..  trans-66.5117.5179.2173.720.5000110V50 E51 I52D48-V50 PolarHBondContact O-N 2.9Å; D48-V50 PolarHBondContact OD1-N 3.21Å; D48-E51 HydrophobicContact CB-CB 3.9Å; D48-E51 PolarHBondContact O-N 3.49Å; D48-E51 PolarHBondContact OD2-N 3.42Å; D48-I52 VanDerWaalsContact O-CG1 3.28Å; D48-I52 WeakPolarHBondContact O-CG1 3.44Å; D48-I52 PolarHBondContact O-N 3.2Å
49P92.1Very high96.1Very high71 Ų7179.7 Ų79.746%0.46141%0.407SS..Hα-helixtrans-57.9-32178.6-25.736.4000113.9A3 K47 Q53A3-P49 HydrophobicContact CB-CB 4.09Å; K47-P49 VanDerWaalsContact O-CD 3.25Å; K47-P49 WeakPolarHBondContact O-CD 3.4Å; P49-Q53 WeakPolarHBondContact O-CB 3.2Å; P49-Q53 PolarHBondContact O-N 2.89Å
50V94.3Very high96.1Very high108 Ų10883.5 Ų83.566%0.65542%0.419SS*.Hα-helixtrans-71.1-48.1-179.8-1800000109.9D48 Q53 A54D48-V50 PolarHBondContact O-N 2.9Å; D48-V50 PolarHBondContact OD1-N 3.21Å; V50-Q53 PolarHBondContact O-N 3.38Å; V50-A54 PolarHBondContact O-N 3.34Å
51E95.4Very high96.2Very high92 Ų9288.2 Ų88.243%0.4344%0.435SS..Hα-helixtrans-58.8-46.1174.1-169.2179.1-178.200112.2V46 D48 Q53 A54 L55V46-E51 HydrophobicContact CG1-CB 3.94Å; V46-E51 HydrophobicContact CG1-CG 3.82Å; V46-E51 WeakPolarHBondContact CG1-OE2 3.43Å; D48-E51 HydrophobicContact CB-CB 3.9Å; D48-E51 PolarHBondContact O-N 3.49Å; D48-E51 PolarHBondContact OD2-N 3.42Å; E51-Q53 VanDerWaalsContact C-N 3.28Å; E51-Q53 PolarHBondContact O-N 3.28Å; E51-A54 WeakPolarHBondContact O-CB 3.35Å; E51-A54 PolarHBondContact O-N 3.22Å; E51-A54 VanDerWaalsContact O-N 3.16Å; E51-L55 HydrophobicContact CG-CD1 4.18Å; E51-L55 WeakPolarHBondContact O-CG 3.29Å; E51-L55 PolarHBondContact O-N 3.29Å
52I95.1Very high96.2Very high44 Ų4480.7 Ų80.723%0.22641%0.41CS..Hα-helixtrans-55.6-46.5175.3-69167.7000110.3V46 D48 A54 L55 V56V46-I52 HydrophobicContact CB-CG1 4.42Å; V46-I52 HydrophobicContact CG1-CG1 3.85Å; D48-I52 VanDerWaalsContact O-CG1 3.28Å; D48-I52 WeakPolarHBondContact O-CG1 3.44Å; D48-I52 PolarHBondContact O-N 3.2Å; I52-A54 VanDerWaalsContact C-N 3.34Å; I52-A54 PolarHBondContact O-N 3.35Å; I52-L55 PolarHBondContact O-N 3.44Å; I52-V56 HydrophobicContact CG2-CG2 4.37Å; I52-V56 WeakPolarHBondContact O-CB 3.32Å; I52-V56 VanDerWaalsContact O-CG2 3.32Å; I52-V56 WeakPolarHBondContact O-CG2 3.44Å; I52-V56 PolarHBondContact O-N 3.19Å
53Q94.8Very high96.2Very high45 Ų4575.7 Ų75.721%0.2139%0.387CS..Hα-helixtrans-65.6-38.9-179.3-168.65854.500112.1S4 P49 V50 E51 V56 N57S4-Q53 VanDerWaalsContact OG-CD 3.31Å; S4-Q53 PolarHBondContact OG-NE2 3.01Å; S4-Q53 PolarHBondContact OG-OE1 2.99Å; P49-Q53 WeakPolarHBondContact O-CB 3.2Å; P49-Q53 PolarHBondContact O-N 2.89Å; V50-Q53 PolarHBondContact O-N 3.38Å; E51-Q53 VanDerWaalsContact C-N 3.28Å; E51-Q53 PolarHBondContact O-N 3.28Å; Q53-V56 PolarHBondContact O-N 2.81Å; Q53-N57 PolarHBondContact NE2-OD1 2.97Å; Q53-N57 WeakPolarHBondContact O-CB 3.3Å; Q53-N57 PolarHBondContact O-N 3.2Å; Q53-N57 PolarHBondContact O-ND2 3.19Å
54A96.4Very high96.3Very high57 Ų5776.9 Ų76.947%0.47139%0.391SS..Hα-helixtrans-61-46.7174.500000111.7V50 E51 I52 N57 K58V50-A54 PolarHBondContact O-N 3.34Å; E51-A54 WeakPolarHBondContact O-CB 3.35Å; E51-A54 PolarHBondContact O-N 3.22Å; E51-A54 VanDerWaalsContact O-N 3.16Å; I52-A54 VanDerWaalsContact C-N 3.34Å; I52-A54 PolarHBondContact O-N 3.35Å; A54-N57 PolarHBondContact O-N 2.93Å; A54-K58 PolarHBondContact O-N 3.41Å
55L97.6Very high96.5Very high55 Ų5572 Ų7229%0.28837%0.373SS..Hα-helixtrans-63.5-42.9177.5-69.9169.1000112N43 V46 E51 I52 K58 A59N43-L55 HydrophobicContact CB-CD1 3.94Å; N43-L55 WeakPolarHBondContact OD1-CD1 3.19Å; V46-L55 HydrophobicContact CG2-CD1 4.31Å; E51-L55 HydrophobicContact CG-CD1 4.18Å; E51-L55 WeakPolarHBondContact O-CG 3.29Å; E51-L55 PolarHBondContact O-N 3.29Å; I52-L55 PolarHBondContact O-N 3.44Å; L55-K58 WeakPolarHBondContact O-CB 3.49Å; L55-K58 PolarHBondContact O-N 2.94Å; L55-A59 WeakPolarHBondContact O-CB 3.34Å; L55-A59 PolarHBondContact O-N 3.14Å
56V97.1Very high96.7Very high11 Ų1168.2 Ų68.27%0.06735%0.345CS..Hα-helixtrans-63.3-43.1175.6168.90000111.1V9 L12 I52 Q53 K58 A59 K60V9-V56 HydrophobicContact CG2-CG2 3.85Å; L12-V56 HydrophobicContact CD2-CG1 4.2Å; I52-V56 HydrophobicContact CG2-CG2 4.37Å; I52-V56 WeakPolarHBondContact O-CB 3.32Å; I52-V56 VanDerWaalsContact O-CG2 3.32Å; I52-V56 WeakPolarHBondContact O-CG2 3.44Å; I52-V56 PolarHBondContact O-N 3.19Å; Q53-V56 PolarHBondContact O-N 2.81Å; V56-K58 VanDerWaalsContact C-N 3.3Å; V56-K58 PolarHBondContact O-N 3.2Å; V56-A59 PolarHBondContact O-N 2.8Å; V56-K60 HydrophobicContact CG1-CD 4.4Å; V56-K60 WeakPolarHBondContact O-CG 3.37Å; V56-K60 PolarHBondContact O-N 3.47Å
57N97.1Very high96.8Very high61 Ų6171.8 Ų71.833%0.32636%0.355SS..Hα-helixtrans-64.1-38176.8-70.6-15.6000111.6Q53 A54 K60 R61Q53-N57 PolarHBondContact NE2-OD1 2.97Å; Q53-N57 WeakPolarHBondContact O-CB 3.3Å; Q53-N57 PolarHBondContact O-N 3.2Å; Q53-N57 PolarHBondContact O-ND2 3.19Å; A54-N57 PolarHBondContact O-N 2.93Å; N57-K60 PolarHBondContact O-N 3.12Å; N57-R61 WeakPolarHBondContact O-CG 3.24Å; N57-R61 PolarHBondContact O-N 3.01Å; N57-R61 VanDerWaalsContact O-N 3.16Å
58K98.1Very high97.1Very high96 Ų9669.3 Ų69.342%0.41734%0.34SS..Hα-helixtrans-61.6-50.4171.8-176.2-175.7178.9-63.60111.2A54 L55 V56 K60 R61 D62A54-K58 PolarHBondContact O-N 3.41Å; L55-K58 WeakPolarHBondContact O-CB 3.49Å; L55-K58 PolarHBondContact O-N 2.94Å; V56-K58 VanDerWaalsContact C-N 3.3Å; V56-K58 PolarHBondContact O-N 3.2Å; K58-K60 VanDerWaalsContact C-N 3.28Å; K58-K60 PolarHBondContact O-N 3.31Å; K58-R61 WeakPolarHBondContact O-CB 3.41Å; K58-R61 PolarHBondContact O-N 3.34Å; K58-R61 VanDerWaalsContact O-N 3.07Å; K58-D62 IonicContact NZ-OD1 3.72Å; K58-D62 IonicContact NZ-OD2 3.92Å; K58-D62 PolarHBondContact NZ-OD2 2.69Å; K58-D62 VanDerWaalsContact O-CG 3.31Å; K58-D62 PolarHBondContact O-N 3.31Å
59A98.2Very high97.2Very high10 Ų1069.7 Ų69.78%0.08334%0.34CS..Hα-helixtrans-60.8-35.2179.900000112.8L12 M16 F40 L55 V56 D62 L63L12-A59 HydrophobicContact CD2-CB 3.49Å; L12-A59 VanDerWaalsContact CD2-CB 3.49Å; L12-A59 HydrophobicContact CG-CB 4.15Å; M16-A59 HydrophobicContact SD-CB 3.91Å; F40-A59 HydrophobicContact CZ-CB 4.25Å; L55-A59 WeakPolarHBondContact O-CB 3.34Å; L55-A59 PolarHBondContact O-N 3.14Å; V56-A59 PolarHBondContact O-N 2.8Å; A59-D62 PolarHBondContact O-N 3.22Å; A59-L63 WeakPolarHBondContact O-CB 3.45Å; A59-L63 PolarHBondContact O-N 3.12Å
60K98.4Very high97.5Very high104 Ų10466.5 Ų66.545%0.45232%0.319SS..Hα-helixtrans-63-45.5171.7-73.2175.7-179.3177.50112.1L12 V56 N57 K58 D62 L63 E64L12-K60 HydrophobicContact CD1-CG 4.29Å; L12-K60 HydrophobicContact CD2-CG 3.95Å; V56-K60 HydrophobicContact CG1-CD 4.4Å; V56-K60 WeakPolarHBondContact O-CG 3.37Å; V56-K60 PolarHBondContact O-N 3.47Å; N57-K60 PolarHBondContact O-N 3.12Å; K58-K60 VanDerWaalsContact C-N 3.28Å; K58-K60 PolarHBondContact O-N 3.31Å; K60-D62 VanDerWaalsContact C-N 3.34Å; K60-L63 PolarHBondContact O-N 3.5Å; K60-E64 PolarHBondContact O-N 3.43Å
61R98.7Very high97.7Very high150 Ų15066.6 Ų66.657%0.56631%0.312SS*.Hα-helixtrans-62.4-42.9175.4-69.9-173-62.2-934.2111.6N57 K58 L63 E64 I65N57-R61 WeakPolarHBondContact O-CG 3.24Å; N57-R61 PolarHBondContact O-N 3.01Å; N57-R61 VanDerWaalsContact O-N 3.16Å; K58-R61 WeakPolarHBondContact O-CB 3.41Å; K58-R61 PolarHBondContact O-N 3.34Å; K58-R61 VanDerWaalsContact O-N 3.07Å; R61-L63 VanDerWaalsContact C-N 3.34Å; R61-L63 PolarHBondContact O-N 2.93Å; R61-E64 PolarHBondContact O-N 2.89Å; R61-I65 WeakPolarHBondContact O-CG1 3.32Å; R61-I65 PolarHBondContact O-N 3.27Å
62D98.6Very high97.9Very high47 Ų4765.9 Ų65.925%0.25131%0.31SS..Hα-helixtrans-64.5-38.4178.6-66.5-12.4000111.4M16 K58 A59 K60 E64 I65 I66M16-D62 HydrophobicContact CE-CB 3.83Å; K58-D62 IonicContact NZ-OD1 3.72Å; K58-D62 IonicContact NZ-OD2 3.92Å; K58-D62 PolarHBondContact NZ-OD2 2.69Å; K58-D62 VanDerWaalsContact O-CG 3.31Å; K58-D62 PolarHBondContact O-N 3.31Å; A59-D62 PolarHBondContact O-N 3.22Å; K60-D62 VanDerWaalsContact C-N 3.34Å; D62-E64 VanDerWaalsContact C-N 3.33Å; D62-E64 PolarHBondContact O-N 3.17Å; D62-I65 WeakPolarHBondContact O-CB 3.42Å; D62-I65 PolarHBondContact O-N 3.13Å; D62-I66 VanDerWaalsContact O-CG1 3.29Å; D62-I66 WeakPolarHBondContact O-CG1 3.46Å; D62-I66 PolarHBondContact O-N 2.99Å
63L98.8Very high98Very high12 Ų1264.6 Ų64.66%0.06331%0.308CS..Hα-helixtrans-58.5-44.7173.2176.962.9000111.7L12 A15 M16 E19 A59 K60 R61 I65 I66 R67L12-L63 HydrophobicContact CD1-CB 4.36Å; L12-L63 HydrophobicContact CD1-CD2 3.86Å; A15-L63 HydrophobicContact CB-CD1 4.47Å; A15-L63 HydrophobicContact CB-CD2 4.1Å; M16-L63 HydrophobicContact CB-CD1 4.47Å; M16-L63 HydrophobicContact CG-CB 4Å; M16-L63 HydrophobicContact CG-CD1 3.96Å; M16-L63 HydrophobicContact CG-CG 4.46Å; E19-L63 HydrophobicContact CB-CD1 4.04Å; E19-L63 HydrophobicContact CG-CD1 4.46Å; A59-L63 WeakPolarHBondContact O-CB 3.45Å; A59-L63 PolarHBondContact O-N 3.12Å; K60-L63 PolarHBondContact O-N 3.5Å; R61-L63 VanDerWaalsContact C-N 3.34Å; R61-L63 PolarHBondContact O-N 2.93Å; L63-I65 VanDerWaalsContact C-N 3.3Å; L63-I65 PolarHBondContact O-N 3.31Å; L63-I66 PolarHBondContact O-N 3.23Å; L63-R67 WeakPolarHBondContact O-CG 3.34Å; L63-R67 PolarHBondContact O-N 3.36Å
64E98.6Very high98Very high80 Ų8067 Ų6737%0.37432%0.319SS..Hα-helixtrans-65.6-34.1177.5-66.5-52.8129.400112.4K60 R61 D62 R67 R68K60-E64 PolarHBondContact O-N 3.43Å; R61-E64 PolarHBondContact O-N 2.89Å; D62-E64 VanDerWaalsContact C-N 3.33Å; D62-E64 PolarHBondContact O-N 3.17Å; E64-R67 IonicContact OE1-CZ 2.75Å; E64-R67 IonicContact OE1-NH1 3.05Å; E64-R67 PolarHBondContact OE1-NH1 3.16Å; E64-R68 WeakPolarHBondContact O-CG 3.32Å; E64-R68 PolarHBondContact O-N 3.07Å; E64-R68 PolarHBondContact O-NH1 3.44Å
65I98.5Very high98.1Very high79 Ų7969.5 Ų69.541%0.40532%0.324SS..Hα-helixtrans-63.1-48.7171.2-67.6167.4000110R61 D62 L63 R67 R68 Q69R61-I65 WeakPolarHBondContact O-CG1 3.32Å; R61-I65 PolarHBondContact O-N 3.27Å; D62-I65 WeakPolarHBondContact O-CB 3.42Å; D62-I65 PolarHBondContact O-N 3.13Å; L63-I65 VanDerWaalsContact C-N 3.3Å; L63-I65 PolarHBondContact O-N 3.31Å; I65-R67 VanDerWaalsContact C-N 3.34Å; I65-R67 PolarHBondContact O-N 3.49Å; I65-R68 PolarHBondContact O-N 3.21Å; I65-Q69 HydrophobicContact CG2-CG 4.05Å; I65-Q69 WeakPolarHBondContact O-CB 3.47Å; I65-Q69 VanDerWaalsContact O-CG 3.24Å; I65-Q69 WeakPolarHBondContact O-CG 3.45Å; I65-Q69 PolarHBondContact O-N 2.86Å
66I98.6Very high98Very high18 Ų1875.6 Ų75.69%0.09235%0.345CS..Hα-helixtrans-56.9-48.7179.4-66.5164000110.1M16 E19 F23 I36 D62 L63 R68 Q69 V70M16-I66 HydrophobicContact CE-CD1 4Å; E19-I66 HydrophobicContact CB-CG2 3.86Å; E19-I66 HydrophobicContact CG-CB 4.35Å; E19-I66 HydrophobicContact CG-CG2 3.53Å; F23-I66 HydrophobicContact CE2-CG2 3.75Å; F23-I66 HydrophobicContact CZ-CG2 4.1Å; I36-I66 HydrophobicContact CD1-CD1 3.99Å; D62-I66 VanDerWaalsContact O-CG1 3.29Å; D62-I66 WeakPolarHBondContact O-CG1 3.46Å; D62-I66 PolarHBondContact O-N 2.99Å; L63-I66 PolarHBondContact O-N 3.23Å; I66-R68 PolarHBondContact O-N 3.06Å; I66-Q69 PolarHBondContact O-N 3.23Å; I66-V70 HydrophobicContact CG2-CG2 4.11Å; I66-V70 WeakPolarHBondContact O-CB 3.44Å; I66-V70 VanDerWaalsContact O-CG2 3.26Å; I66-V70 WeakPolarHBondContact O-CG2 3.48Å; I66-V70 PolarHBondContact O-N 3.44Å
67R98.7Very high97.9Very high106 Ų10678.7 Ų78.740%0.437%0.367SS..Hα-helixtrans-54.1-49.6177.9-74.8172.4168.2172.4-8.5112.8E19 L63 E64 I65 H71E19-R67 HydrophobicContact CG-CB 4.49Å; E19-R67 HydrophobicContact CG-CG 3.7Å; L63-R67 WeakPolarHBondContact O-CG 3.34Å; L63-R67 PolarHBondContact O-N 3.36Å; E64-R67 IonicContact OE1-CZ 2.75Å; E64-R67 IonicContact OE1-NH1 3.05Å; E64-R67 PolarHBondContact OE1-NH1 3.16Å; I65-R67 VanDerWaalsContact C-N 3.34Å; I65-R67 PolarHBondContact O-N 3.49Å; R67-H71 PolarHBondContact O-N 2.67Å; R67-H71 VanDerWaalsContact O-N 3.14Å
68R98.7Very high97.8Very high132 Ų13281.7 Ų81.750%0.49839%0.388SS..Hα-helixtrans-63.7-44178.5-71-171.4-62.9-84.51.2112E64 I65 I66 H71 I72E64-R68 WeakPolarHBondContact O-CG 3.32Å; E64-R68 PolarHBondContact O-N 3.07Å; E64-R68 PolarHBondContact O-NH1 3.44Å; I65-R68 PolarHBondContact O-N 3.21Å; I66-R68 PolarHBondContact O-N 3.06Å; R68-H71 PolarHBondContact O-N 2.88Å; R68-I72 WeakPolarHBondContact O-CG1 3.36Å; R68-I72 PolarHBondContact O-N 3.29Å
69Q98.4Very high97.6Very high86 Ų8684.4 Ų84.440%0.40241%0.407SS..Hα-helixtrans-70.6-34.6-177.6-67.6-61.9-54.700112.2F23 I65 I66 G73F23-Q69 HydrophobicContact CE1-CB 3.62Å; F23-Q69 HydrophobicContact CZ-CB 3.86Å; I65-Q69 HydrophobicContact CG2-CG 4.05Å; I65-Q69 WeakPolarHBondContact O-CB 3.47Å; I65-Q69 VanDerWaalsContact O-CG 3.24Å; I65-Q69 WeakPolarHBondContact O-CG 3.45Å; I65-Q69 PolarHBondContact O-N 2.86Å; I66-Q69 PolarHBondContact O-N 3.23Å; Q69-G73 PolarHBondContact O-N 2.67Å
70V98.5Very high97.4Very high4 Ų491 Ų912%0.02443%0.434CS..Hα-helixtrans-58.8-49.9170.4162.50000109.9E19 H22 F23 I66 G73 Q74E19-V70 HydrophobicContact CG-CG2 4.38Å; H22-V70 HydrophobicContact CB-CG1 3.51Å; H22-V70 HydrophobicContact CB-CG2 4.31Å; F23-V70 HydrophobicContact CD1-CG2 3.78Å; F23-V70 HydrophobicContact CD2-CG2 4Å; F23-V70 HydrophobicContact CE1-CG2 3.85Å; F23-V70 HydrophobicContact CE2-CG2 4.07Å; F23-V70 HydrophobicContact CG-CG2 3.85Å; F23-V70 HydrophobicContact CZ-CG2 3.98Å; I66-V70 HydrophobicContact CG2-CG2 4.11Å; I66-V70 WeakPolarHBondContact O-CB 3.44Å; I66-V70 VanDerWaalsContact O-CG2 3.26Å; I66-V70 WeakPolarHBondContact O-CG2 3.48Å; I66-V70 PolarHBondContact O-N 3.44Å; V70-G73 PolarHBondContact O-N 3.24Å; V70-Q74 VanDerWaalsContact O-CG 3.31Å; V70-Q74 WeakPolarHBondContact O-CG 3.45Å; V70-Q74 PolarHBondContact O-N 3.27Å
71H98.3Very high97.2Very high109 Ų10990.1 Ų90.151%0.50543%0.433SS..Hα-helixtrans-63.2-46.5-179.1-168.664.8000112.3R67 R68 G73 Q74 L75R67-H71 PolarHBondContact O-N 2.67Å; R67-H71 VanDerWaalsContact O-N 3.14Å; R68-H71 PolarHBondContact O-N 2.88Å; H71-G73 VanDerWaalsContact C-N 3.32Å; H71-G73 PolarHBondContact O-N 3.04Å; H71-Q74 WeakPolarHBondContact O-CB 3.47Å; H71-Q74 PolarHBondContact O-N 3.33Å; H71-Q74 VanDerWaalsContact O-N 3.13Å; H71-L75 WeakPolarHBondContact O-CG 3.25Å; H71-L75 PolarHBondContact O-N 3.47Å
72I98.1Very high97Very high77 Ų7789.6 Ų89.640%0.39544%0.44SS..Hα-helixtrans-60.1-43.7175.5-68.2168.6000110.9R68 Q74 L75 Y76R68-I72 WeakPolarHBondContact O-CG1 3.36Å; R68-I72 PolarHBondContact O-N 3.29Å; I72-Q74 PolarHBondContact O-N 3.21Å; I72-L75 PolarHBondContact O-N 2.9Å; I72-Y76 HydrophobicContact CG2-CD2 3.97Å; I72-Y76 HydrophobicContact CG2-CE2 4.4Å; I72-Y76 WeakPolarHBondContact O-CD2 3.47Å; I72-Y76 PolarHBondContact O-N 3.02Å
73G97.1Very high96.7Very high18 Ų1891.6 Ų91.619%0.18645%0.45CS..Hα-helixtrans-65.7-23.2178.100000113.9S24 Q69 V70 H71 S77S24-G73 VanDerWaalsContact OG-C 3.28Å; S24-G73 PolarHBondContact OG-O 2.97Å; Q69-G73 PolarHBondContact O-N 2.67Å; V70-G73 PolarHBondContact O-N 3.24Å; H71-G73 VanDerWaalsContact C-N 3.32Å; H71-G73 PolarHBondContact O-N 3.04Å; G73-S77 WeakPolarHBondContact O-CA 3.28Å; G73-S77 WeakPolarHBondContact O-CB 3.49Å; G73-S77 PolarHBondContact O-N 3.32Å
74Q96.1Very high96.3Very high95 Ų9593 Ų9344%0.44446%0.456SS..Hα-helixtrans-77.9-42.2171.8-71.4167.1-4.100111.4H22 V70 H71 I72 Y76 S77H22-Q74 PolarHBondContact O-NE2 3.34Å; V70-Q74 VanDerWaalsContact O-CG 3.31Å; V70-Q74 WeakPolarHBondContact O-CG 3.45Å; V70-Q74 PolarHBondContact O-N 3.27Å; H71-Q74 WeakPolarHBondContact O-CB 3.47Å; H71-Q74 PolarHBondContact O-N 3.33Å; H71-Q74 VanDerWaalsContact O-N 3.13Å; I72-Q74 PolarHBondContact O-N 3.21Å; Q74-Y76 VanDerWaalsContact C-N 3.28Å; Q74-Y76 PolarHBondContact O-N 2.93Å; Q74-S77 PolarHBondContact O-OG 3.46Å
75L97.6Very high95.6Very high110 Ų11094 Ų9458%0.57647%0.465SS*.Hα-helixtrans-61.7-36.3176.2-66.5175.5000112.4H71 I72H71-L75 WeakPolarHBondContact O-CG 3.25Å; H71-L75 PolarHBondContact O-N 3.47Å; I72-L75 PolarHBondContact O-N 2.9Å
76Y96.9Very high94.5Very high182 Ų18297.5 Ų97.571%0.71448%0.479SS*.THydrogen-bonded Turntrans-118.847.5-179-55.2-73.4000111.5I72 Q74I72-Y76 HydrophobicContact CG2-CD2 3.97Å; I72-Y76 HydrophobicContact CG2-CE2 4.4Å; I72-Y76 WeakPolarHBondContact O-CD2 3.47Å; I72-Y76 PolarHBondContact O-N 3.02Å; Q74-Y76 VanDerWaalsContact C-N 3.28Å; Q74-Y76 PolarHBondContact O-N 2.93Å
77S94.6Very high92.7Very high76 Ų76105.6 Ų105.653%0.53152%0.516SS..  trans-72.1155.5178.960.60000112.5G73 Q74G73-S77 WeakPolarHBondContact O-CA 3.28Å; G73-S77 WeakPolarHBondContact O-CB 3.49Å; G73-S77 PolarHBondContact O-N 3.32Å; Q74-S77 PolarHBondContact O-OG 3.46Å
78T94Very high90.9Very high124 Ų124106.5 Ų106.576%0.76153%0.534SS*.  trans-126.6173.317668.10000110.1
79D94.7Very high89Confident154 Ų154105.4 Ų105.482%0.82454%0.544SS*.PPolyproline II helixtrans-57.2149.5171.9-62.1-47.2000111.8
80K93.7Very high87.3Confident149 Ų149113.3 Ų113.365%0.64857%0.57SS**PPolyproline II helixtrans-68.5153.2177.7-66.8-174.4-178.1177.20111E84K80-E84 WeakPolarHBondContact CA-OE1 3.39Å; K80-E84 HydrophobicContact CB-CB 4.13Å; K80-E84 HydrophobicContact CD-CB 4.34Å
81L94.4Very high85.5Confident85 Ų85122.9 Ų122.945%0.44563%0.629SS.*PPolyproline II helixtrans-68151.6172.7-57.9179.6000110.6Y26 I83 E84Y26-L81 HydrophobicContact CD1-CD1 4Å; Y26-L81 HydrophobicContact CG-CD1 4.25Å; L81-I83 HydrophobicContact CB-CG1 3.88Å; L81-I83 HydrophobicContact CD1-CD1 4.27Å; L81-I83 HydrophobicContact CD1-CG1 4.42Å; L81-I83 PolarHBondContact O-N 3.31Å; L81-I83 VanDerWaalsContact O-N 3.12Å; L81-E84 HydrophobicContact CB-CG 4.28Å; L81-E84 PolarHBondContact N-OE1 3.24Å; L81-E84 VanDerWaalsContact O-CB 3.31Å; L81-E84 WeakPolarHBondContact O-CB 3.41Å; L81-E84 PolarHBondContact O-N 3.23Å
82I93.8Very high84.8Confident138 Ų138123.6 Ų123.671%0.70864%0.635SS**G310 helixtrans-54.5-35177.8-171.958.9000113.1E84 N85I82-E84 PolarHBondContact O-N 3.45Å; I82-N85 WeakPolarHBondContact O-CB 3.49Å; I82-N85 PolarHBondContact O-N 3.3Å; I82-N85 VanDerWaalsContact O-N 3.11Å
83I91.8Very high84.1Confident90 Ų90126.1 Ų126.146%0.46265%0.648SS.*G310 helixtrans-67.5-18.2178.860.4174.2000113.5Y26 L81 N85 Q86Y26-I83 HydrophobicContact CD1-CD1 4.01Å; Y26-I83 HydrophobicContact CE1-CD1 3.59Å; L81-I83 HydrophobicContact CB-CG1 3.88Å; L81-I83 HydrophobicContact CD1-CD1 4.27Å; L81-I83 HydrophobicContact CD1-CG1 4.42Å; L81-I83 PolarHBondContact O-N 3.31Å; L81-I83 VanDerWaalsContact O-N 3.12Å; I83-N85 VanDerWaalsContact C-N 3.34Å; I83-Q86 PolarHBondContact O-NE2 3.16Å
84E90.9Very high83.4Confident41 Ų41132.1 Ų132.119%0.19267%0.674CS.*G310 helixtrans-82.4-15.5176-60.5-178.2-98.800112.3Y26 R29 K80 L81 I82 Q86Y26-E84 WeakPolarHBondContact CB-OE1 3.36Å; Y26-E84 HydrophobicContact CD2-CG 3.55Å; Y26-E84 HydrophobicContact CE2-CG 4.24Å; Y26-E84 HydrophobicContact CG-CG 4.04Å; R29-E84 IonicContact CZ-OE2 3.01Å; R29-E84 IonicContact NH2-OE2 3.71Å; R29-E84 PolarHBondContact NH2-OE2 2.93Å; K80-E84 WeakPolarHBondContact CA-OE1 3.39Å; K80-E84 HydrophobicContact CB-CB 4.13Å; K80-E84 HydrophobicContact CD-CB 4.34Å; L81-E84 HydrophobicContact CB-CG 4.28Å; L81-E84 PolarHBondContact N-OE1 3.24Å; L81-E84 VanDerWaalsContact O-CB 3.31Å; L81-E84 WeakPolarHBondContact O-CB 3.41Å; L81-E84 PolarHBondContact O-N 3.23Å; I82-E84 PolarHBondContact O-N 3.45Å; E84-Q86 PolarHBondContact O-N 2.92Å
85N84.1Confident82.7Confident102 Ų102134.2 Ų134.255%0.54569%0.687SS.*  trans-83.366.3176-62.2-26.8000109.6I82 I83I82-N85 WeakPolarHBondContact O-CB 3.49Å; I82-N85 PolarHBondContact O-N 3.3Å; I82-N85 VanDerWaalsContact O-N 3.11Å; I83-N85 VanDerWaalsContact C-N 3.34Å
86Q74.8Confident81.7Confident151 Ų151135.8 Ų135.871%0.70669%0.694SS**  trans-90.1106166-60.1-61.6-48.500107.4I83 E84 T88I83-Q86 PolarHBondContact O-NE2 3.16Å; E84-Q86 PolarHBondContact O-N 2.92Å; Q86-T88 PolarHBondContact O-N 2.96Å; Q86-T88 VanDerWaalsContact O-N 3.08Å
87E61.9Low80.7Confident188 Ų188132.7 Ų132.788%0.87969%0.693SS**  trans-56.7114.9164.8-71.8-174.6169.700107.4P89E87-P89 VanDerWaalsContact O-CD 3.31Å; E87-P89 WeakPolarHBondContact O-CD 3.46Å
88T61.3Low79.7Confident125 Ų125136.7 Ų136.777%0.76770%0.704SS**  trans-66.5119.9171.5-5.90000105.7Q86 R90Q86-T88 PolarHBondContact O-N 2.96Å; Q86-T88 VanDerWaalsContact O-N 3.08Å; T88-R90 PolarHBondContact O-N 2.91Å
89P58.3Low78.6Confident110 Ų110137.7 Ų137.771%0.71470%0.7SS**  trans-57.4118.7174.9-14.725.9000106.6E87 T91E87-P89 VanDerWaalsContact O-CD 3.31Å; E87-P89 WeakPolarHBondContact O-CD 3.46Å; P89-T91 PolarHBondContact O-N 3.03Å
90R62.8Low77.3Confident251 Ų251136.3 Ų136.395%0.94769%0.69SS**  trans-63110.2170.9-64.5-175-172.9178.43.4105.6T88T88-R90 PolarHBondContact O-N 2.91Å
91T59.8Low75.8Confident206 Ų206135.2 Ų135.2100%1.26469%0.693SS**  trans-850169.231.70000109P89P89-T91 PolarHBondContact O-N 3.03Å

Retrieved 91 of 91 residues in 122.5 ms (Link to these results)

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