G4VM11_SCHMA Loading...

LYR motif-containing protein 4

AlphaFold DB , UniProt , Accession G4VM11, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 82 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
1M62.1Low91Very high162 Ų16277.3 Ų77.380%0.79838%0.382SS*.  0120.80-163.1160.6-178.600107.6F3M1-F3 PolarHBondContact O-N 3.46Å; M1-F3 VanDerWaalsContact O-N 3.14Å
2N88.2Confident91.5Very high99 Ų9975.8 Ų75.853%0.52938%0.384SS..  trans-83.890.1-176.7-171.5-26.1000110Q4 L5 R6N2-Q4 VanDerWaalsContact C-N 3.29Å; N2-Q4 PolarHBondContact O-N 3.41Å; N2-Q4 PolarHBondContact OD1-N 3.22Å; N2-L5 HydrophobicContact CB-CB 4.28Å; N2-L5 PolarHBondContact O-N 3.49Å; N2-L5 PolarHBondContact OD1-N 2.93Å; N2-L5 VanDerWaalsContact OD1-N 3.1Å; N2-R6 PolarHBondContact O-N 3.1Å
3F92.2Very high91.9Very high51 Ų5175.3 Ų75.322%0.22438%0.384CS..Hα-helixtrans-62.6-34-179-71.3-68.2000113.3M1 R6 L7 A47 L50 E51 L54M1-F3 PolarHBondContact O-N 3.46Å; M1-F3 VanDerWaalsContact O-N 3.14Å; F3-R6 PolarHBondContact O-N 3.24Å; F3-L7 WeakPolarHBondContact O-CB 3.4Å; F3-L7 WeakPolarHBondContact O-CG 3.49Å; F3-L7 PolarHBondContact O-N 3.39Å; F3-A47 HydrophobicContact CE2-CB 4.1Å; F3-A47 HydrophobicContact CZ-CB 4.19Å; F3-L50 HydrophobicContact CB-CD2 3.68Å; F3-L50 HydrophobicContact CD1-CD2 3.78Å; F3-L50 HydrophobicContact CD1-CG 3.93Å; F3-L50 HydrophobicContact CD2-CD2 4.13Å; F3-L50 HydrophobicContact CE1-CD2 4.41Å; F3-L50 HydrophobicContact CE1-CG 4.33Å; F3-L50 HydrophobicContact CG-CD2 3.61Å; F3-L50 HydrophobicContact CG-CG 4.3Å; F3-E51 HydrophobicContact CE1-CB 4.38Å; F3-E51 WeakPolarHBondContact CE1-OE2 3.35Å; F3-L54 HydrophobicContact CD1-CD1 3.71Å; F3-L54 HydrophobicContact CE1-CD1 4.3Å
4Q91.5Very high92.3Very high147 Ų14770.4 Ų70.469%0.68736%0.358SS*.Hα-helixtrans-64-45.8-179.9-67.1177.4-20.600111.4N2 R6 L7 Q8N2-Q4 VanDerWaalsContact C-N 3.29Å; N2-Q4 PolarHBondContact O-N 3.41Å; N2-Q4 PolarHBondContact OD1-N 3.22Å; Q4-R6 VanDerWaalsContact C-N 3.35Å; Q4-R6 PolarHBondContact O-N 3.14Å; Q4-L7 PolarHBondContact O-N 2.84Å; Q4-Q8 WeakPolarHBondContact O-CG 3.41Å; Q4-Q8 PolarHBondContact O-N 3.49Å
5L93.9Very high92.6Very high87 Ų8768.9 Ų68.946%0.45535%0.349SS..Hα-helixtrans-63.8-41176.1-177.264.2000111.6N2 Q8 N9N2-L5 HydrophobicContact CB-CB 4.28Å; N2-L5 PolarHBondContact O-N 3.49Å; N2-L5 PolarHBondContact OD1-N 2.93Å; N2-L5 VanDerWaalsContact OD1-N 3.1Å; L5-Q8 PolarHBondContact O-N 3.31Å; L5-N9 WeakPolarHBondContact O-CB 3.33Å; L5-N9 VanDerWaalsContact O-CG 3.29Å; L5-N9 PolarHBondContact O-N 3.29Å; L5-N9 PolarHBondContact O-ND2 2.93Å
6R94.4Very high92.8Very high42 Ų4273.2 Ų73.216%0.15836%0.364CS..Hα-helixtrans-65.9-41177.9-171.7169.8166.2-151.68112N2 F3 Q4 L10 E51 L54 E58N2-R6 PolarHBondContact O-N 3.1Å; F3-R6 PolarHBondContact O-N 3.24Å; Q4-R6 VanDerWaalsContact C-N 3.35Å; Q4-R6 PolarHBondContact O-N 3.14Å; R6-L10 VanDerWaalsContact O-CB 3.25Å; R6-L10 WeakPolarHBondContact O-CB 3.36Å; R6-L10 PolarHBondContact O-N 3.01Å; R6-E51 IonicContact CZ-OE1 2.79Å; R6-E51 IonicContact CZ-OE2 3.82Å; R6-E51 IonicContact NH1-OE1 2.92Å; R6-E51 PolarHBondContact NH1-OE1 3.37Å; R6-E51 IonicContact NH1-OE2 3.2Å; R6-E51 PolarHBondContact NH1-OE2 3.01Å; R6-E51 IonicContact NH2-OE1 3.61Å; R6-E51 PolarHBondContact NH2-OE1 3.23Å; R6-L54 HydrophobicContact CB-CD1 4.4Å; R6-L54 HydrophobicContact CG-CD1 4.11Å; R6-L54 HydrophobicContact CG-CD2 4.38Å; R6-E58 IonicContact CZ-OE1 2.69Å; R6-E58 IonicContact CZ-OE2 3.91Å; R6-E58 IonicContact NE-OE1 2.73Å; R6-E58 PolarHBondContact NE-OE1 3.39Å; R6-E58 IonicContact NH2-OE1 3.62Å; R6-E58 PolarHBondContact NH2-OE1 3.47Å; R6-E58 IonicContact NH2-OE2 3.57Å; R6-E58 PolarHBondContact NH2-OE2 3.47Å
7L94.7Very high93Very high21 Ų2171.4 Ų71.411%0.1135%0.354CS..Hα-helixtrans-58.5-49.4173-80.7166.1000111.2F3 Q4 S11 F38 L41 L50 L54F3-L7 WeakPolarHBondContact O-CB 3.4Å; F3-L7 WeakPolarHBondContact O-CG 3.49Å; F3-L7 PolarHBondContact O-N 3.39Å; Q4-L7 PolarHBondContact O-N 2.84Å; L7-S11 WeakPolarHBondContact O-CB 3.25Å; L7-S11 PolarHBondContact O-N 3.27Å; L7-F38 HydrophobicContact CB-CD1 4.45Å; L7-F38 HydrophobicContact CD2-CD1 3.71Å; L7-F38 HydrophobicContact CD2-CE1 3.91Å; L7-F38 WeakPolarHBondContact O-CD1 3.24Å; L7-F38 VanDerWaalsContact O-CE1 3.25Å; L7-F38 WeakPolarHBondContact O-CE1 3.41Å; L7-L41 HydrophobicContact CD2-CB 3.78Å; L7-L41 HydrophobicContact CD2-CD1 4.23Å; L7-L50 HydrophobicContact CD1-CD1 4.3Å; L7-L50 HydrophobicContact CD2-CD1 4.27Å; L7-L54 HydrophobicContact CD2-CD2 3.65Å; L7-L54 HydrophobicContact CD2-CG 4.47Å; L7-L54 HydrophobicContact CG-CD2 4.04Å
8Q95Very high93.1Very high125 Ų12567.4 Ų67.458%0.58434%0.335SS*.Hα-helixtrans-62.3-46.6-179.9-74.1174.5-9.800112.3Q4 L5 S12Q4-Q8 WeakPolarHBondContact O-CG 3.41Å; Q4-Q8 PolarHBondContact O-N 3.49Å; L5-Q8 PolarHBondContact O-N 3.31Å; Q8-S12 VanDerWaalsContact O-CB 3.31Å; Q8-S12 WeakPolarHBondContact O-CB 3.35Å; Q8-S12 PolarHBondContact O-N 3.45Å; Q8-S12 PolarHBondContact O-OG 2.8Å
9N96Very high93.2Very high86 Ų8669.5 Ų69.546%0.4634%0.343SS..Hα-helixtrans-64.5-46.9179.9-74.6-18.1000111.7L5 S12 N13L5-N9 WeakPolarHBondContact O-CB 3.33Å; L5-N9 VanDerWaalsContact O-CG 3.29Å; L5-N9 PolarHBondContact O-N 3.29Å; L5-N9 PolarHBondContact O-ND2 2.93Å; N9-S12 PolarHBondContact O-N 2.95Å; N9-N13 WeakPolarHBondContact O-CB 3.11Å; N9-N13 VanDerWaalsContact O-CG 3.27Å; N9-N13 PolarHBondContact O-N 3.24Å; N9-N13 PolarHBondContact O-ND2 2.95Å
10L96.7Very high93.3Very high9 Ų971.2 Ų71.25%0.04735%0.346CS..Hα-helixtrans-67.1-42.4-179.1-174.660000111.6R6 S12 N13 L14 F38 L54 N57 E58 L61R6-L10 VanDerWaalsContact O-CB 3.25Å; R6-L10 WeakPolarHBondContact O-CB 3.36Å; R6-L10 PolarHBondContact O-N 3.01Å; L10-S12 PolarHBondContact O-N 2.88Å; L10-N13 PolarHBondContact O-N 3.45Å; L10-L14 HydrophobicContact CD1-CD1 4.42Å; L10-L14 HydrophobicContact CG-CD1 4.11Å; L10-L14 WeakPolarHBondContact O-CB 3.49Å; L10-L14 WeakPolarHBondContact O-CG 3.38Å; L10-L14 PolarHBondContact O-N 3.2Å; L10-F38 HydrophobicContact CB-CE1 4.1Å; L10-F38 HydrophobicContact CB-CZ 4.07Å; L10-F38 HydrophobicContact CD2-CE1 4.36Å; L10-F38 HydrophobicContact CD2-CZ 3.9Å; L10-F38 HydrophobicContact CG-CE1 4.28Å; L10-F38 HydrophobicContact CG-CZ 3.76Å; L10-L54 HydrophobicContact CD2-CD2 3.91Å; L10-N57 HydrophobicContact CD2-CB 3.62Å; L10-N57 HydrophobicContact CG-CB 4.41Å; L10-E58 HydrophobicContact CD1-CG 3.85Å; L10-E58 HydrophobicContact CD2-CG 3.86Å; L10-E58 HydrophobicContact CG-CG 4.49Å; L10-L61 HydrophobicContact CD1-CB 4.39Å; L10-L61 HydrophobicContact CD1-CD2 4.08Å
11S96.6Very high93.2Very high21 Ų2168.1 Ų68.115%0.14733%0.331CS..Hα-helixtrans-57.7-49.5173.8-177.50000111L7 N13 L14 F15L7-S11 WeakPolarHBondContact O-CB 3.25Å; L7-S11 PolarHBondContact O-N 3.27Å; S11-N13 VanDerWaalsContact C-N 3.33Å; S11-N13 PolarHBondContact O-N 3.4Å; S11-L14 PolarHBondContact O-N 2.78Å; S11-F15 WeakPolarHBondContact O-CD2 3.33Å; S11-F15 PolarHBondContact O-N 3.18Å; S11-F15 WeakPolarHBondContact OG-CE2 3.31Å
12S96.4Very high94.5Very high59 Ų5963.4 Ų63.441%0.41331%0.311SS..Hα-helixtrans-60.3-41.3179.5-60.80000112.3Q8 N9 L10 F15 K16Q8-S12 VanDerWaalsContact O-CB 3.31Å; Q8-S12 WeakPolarHBondContact O-CB 3.35Å; Q8-S12 PolarHBondContact O-N 3.45Å; Q8-S12 PolarHBondContact O-OG 2.8Å; N9-S12 PolarHBondContact O-N 2.95Å; L10-S12 PolarHBondContact O-N 2.88Å; S12-F15 PolarHBondContact O-N 2.73Å; S12-K16 WeakPolarHBondContact O-CG 3.23Å; S12-K16 PolarHBondContact O-N 2.69Å
13N97.1Very high94.5Very high70 Ų7059.8 Ų59.837%0.37429%0.292SS..Hα-helixtrans-67.6-42.9177.5-71.5-16.2000111.7N9 L10 S11 F15 K16 E17 L61N9-N13 WeakPolarHBondContact O-CB 3.11Å; N9-N13 VanDerWaalsContact O-CG 3.27Å; N9-N13 PolarHBondContact O-N 3.24Å; N9-N13 PolarHBondContact O-ND2 2.95Å; L10-N13 PolarHBondContact O-N 3.45Å; S11-N13 VanDerWaalsContact C-N 3.33Å; S11-N13 PolarHBondContact O-N 3.4Å; N13-F15 VanDerWaalsContact C-N 3.32Å; N13-F15 PolarHBondContact O-N 3.09Å; N13-K16 PolarHBondContact O-N 3.15Å; N13-E17 WeakPolarHBondContact O-CG 3.5Å; N13-E17 PolarHBondContact O-N 2.86Å; N13-L61 HydrophobicContact CB-CD1 4.1Å; N13-L61 HydrophobicContact CB-CD2 3.91Å
14L97Very high94.4Very high6 Ų662.1 Ų62.13%0.03130%0.3CS..Hα-helixtrans-61.4-40.8175.1-76.8165.5000111.8L10 S11 E17 A18 I34 F38 N57 L61 L64L10-L14 HydrophobicContact CD1-CD1 4.42Å; L10-L14 HydrophobicContact CG-CD1 4.11Å; L10-L14 WeakPolarHBondContact O-CB 3.49Å; L10-L14 WeakPolarHBondContact O-CG 3.38Å; L10-L14 PolarHBondContact O-N 3.2Å; S11-L14 PolarHBondContact O-N 2.78Å; L14-E17 PolarHBondContact O-N 2.77Å; L14-A18 WeakPolarHBondContact O-CB 3.17Å; L14-A18 PolarHBondContact O-N 3.48Å; L14-I34 HydrophobicContact CB-CD1 3.72Å; L14-I34 HydrophobicContact CB-CG1 3.99Å; L14-I34 HydrophobicContact CB-CG2 4.12Å; L14-I34 WeakPolarHBondContact O-CD1 3.41Å; L14-F38 HydrophobicContact CD1-CE2 3.39Å; L14-F38 HydrophobicContact CD1-CZ 3.65Å; L14-N57 HydrophobicContact CD1-CB 4.33Å; L14-L61 HydrophobicContact CD2-CB 3.87Å; L14-L61 HydrophobicContact CD2-CD1 3.77Å; L14-L61 HydrophobicContact CD2-CG 4.45Å; L14-L61 HydrophobicContact CG-CB 4.41Å; L14-L61 HydrophobicContact CG-CD1 3.99Å; L14-L64 HydrophobicContact CD2-CD2 3.85Å; L14-L64 WeakPolarHBondContact O-CD2 3.5Å
15F96.8Very high94.4Very high49 Ų4959.1 Ų59.122%0.21529%0.288CS..Hα-helixtrans-62.5-45.2174.5-86.5-65.3000112.1S11 S12 N13 E17 A18 Q19 E31 I34 D35S11-F15 WeakPolarHBondContact O-CD2 3.33Å; S11-F15 PolarHBondContact O-N 3.18Å; S11-F15 WeakPolarHBondContact OG-CE2 3.31Å; S12-F15 PolarHBondContact O-N 2.73Å; N13-F15 VanDerWaalsContact C-N 3.32Å; N13-F15 PolarHBondContact O-N 3.09Å; F15-E17 VanDerWaalsContact C-N 3.3Å; F15-E17 PolarHBondContact O-N 2.67Å; F15-A18 PolarHBondContact O-N 3.37Å; F15-Q19 WeakPolarHBondContact O-CG 3.35Å; F15-Q19 PolarHBondContact O-N 3.43Å; F15-E31 HydrophobicContact CD1-CB 4.47Å; F15-E31 HydrophobicContact CD1-CG 4.12Å; F15-E31 HydrophobicContact CE1-CB 3.94Å; F15-E31 HydrophobicContact CE1-CG 4.08Å; F15-I34 HydrophobicContact CD1-CD1 4.47Å; F15-I34 HydrophobicContact CD2-CG2 3.8Å; F15-I34 HydrophobicContact CE1-CB 4.27Å; F15-I34 HydrophobicContact CE1-CG2 4.28Å; F15-I34 HydrophobicContact CE2-CB 4.23Å; F15-I34 HydrophobicContact CE2-CG2 3.42Å; F15-I34 VanDerWaalsContact CE2-CG2 3.42Å; F15-I34 HydrophobicContact CG-CG2 4.35Å; F15-I34 HydrophobicContact CZ-CB 3.95Å; F15-I34 HydrophobicContact CZ-CG2 3.66Å; F15-D35 HydrophobicContact CZ-CB 4.49Å; F15-D35 VanDerWaalsContact CZ-OD1 3.22Å; F15-D35 WeakPolarHBondContact CZ-OD1 3.29Å
16K96.5Very high94.3Very high137 Ų13757.7 Ų57.760%0.59628%0.281SS*.Hα-helixtrans-58.6-42.1175.9-73.2173.8-175.2177.50112S12 N13 Q19S12-K16 WeakPolarHBondContact O-CG 3.23Å; S12-K16 PolarHBondContact O-N 2.69Å; N13-K16 PolarHBondContact O-N 3.15Å; K16-Q19 PolarHBondContact O-N 2.95Å
17E95.8Very high94.3Very high42 Ų4258.1 Ų58.120%0.19628%0.282CS..Hα-helixtrans-69.1-37.4176.3-68.6-55.4140.200112.5N13 L14 F15 Q19 R20 L61 L64 A65N13-E17 WeakPolarHBondContact O-CG 3.5Å; N13-E17 PolarHBondContact O-N 2.86Å; L14-E17 PolarHBondContact O-N 2.77Å; F15-E17 VanDerWaalsContact C-N 3.3Å; F15-E17 PolarHBondContact O-N 2.67Å; E17-Q19 VanDerWaalsContact C-N 3.31Å; E17-Q19 PolarHBondContact O-N 3.5Å; E17-R20 WeakPolarHBondContact O-CB 3.49Å; E17-R20 PolarHBondContact O-N 2.91Å; E17-R20 VanDerWaalsContact O-N 3.16Å; E17-R20 IonicContact OE1-NH1 3.85Å; E17-R20 VanDerWaalsContact OE2-CD 3.29Å; E17-R20 WeakPolarHBondContact OE2-CD 3.39Å; E17-R20 IonicContact OE2-CZ 3.5Å; E17-R20 IonicContact OE2-NE 2.8Å; E17-R20 IonicContact OE2-NH1 3.24Å; E17-R20 PolarHBondContact OE2-NH1 2.97Å; E17-L61 HydrophobicContact CB-CD1 4.25Å; E17-L61 HydrophobicContact CG-CD1 3.6Å; E17-L64 HydrophobicContact CB-CB 4.48Å; E17-L64 HydrophobicContact CB-CD2 3.78Å; E17-L64 HydrophobicContact CB-CG 4.01Å; E17-A65 HydrophobicContact CG-CB 4.35Å; E17-A65 WeakPolarHBondContact OE2-CA 3.43Å; E17-A65 WeakPolarHBondContact OE2-CB 3.43Å
18A95.7Very high94.3Very high0 Ų057.5 Ų57.50%028%0.28CS..Hα-helixtrans-63.6-35174.400000112.5L14 F15 R20 F21 R27 F30 E31 I34 L64L14-A18 WeakPolarHBondContact O-CB 3.17Å; L14-A18 PolarHBondContact O-N 3.48Å; F15-A18 PolarHBondContact O-N 3.37Å; A18-R20 PolarHBondContact O-N 3.45Å; A18-F21 WeakPolarHBondContact O-CD2 3.25Å; A18-F21 PolarHBondContact O-N 3.01Å; A18-R27 WeakPolarHBondContact O-CG 3.49Å; A18-F30 HydrophobicContact CB-CB 3.83Å; A18-E31 HydrophobicContact CB-CG 4.42Å; A18-I34 HydrophobicContact CB-CD1 3.86Å; A18-L64 HydrophobicContact CB-CD2 4.35Å
19Q94.5Very high94.3Very high107 Ų10757 Ų5750%0.527%0.273SS..THydrogen-bonded Turntrans-65.4-19.1175.7-69.8-60.3-2900113.4F15 K16 E17 F21 E31F15-Q19 WeakPolarHBondContact O-CG 3.35Å; F15-Q19 PolarHBondContact O-N 3.43Å; K16-Q19 PolarHBondContact O-N 2.95Å; E17-Q19 VanDerWaalsContact C-N 3.31Å; E17-Q19 PolarHBondContact O-N 3.5Å; Q19-F21 VanDerWaalsContact C-N 3.29Å; Q19-F21 PolarHBondContact O-N 3.38Å; Q19-E31 PolarHBondContact NE2-OE1 3Å
20R94.6Very high94.3Very high104 Ų10455 Ų5539%0.39226%0.261SS..THydrogen-bonded Turntrans-77.7-10.5-179.2-65.6173.864.7-161.2-2.9114E17 A18 A68 N72E17-R20 WeakPolarHBondContact O-CB 3.49Å; E17-R20 PolarHBondContact O-N 2.91Å; E17-R20 VanDerWaalsContact O-N 3.16Å; E17-R20 IonicContact OE1-NH1 3.85Å; E17-R20 VanDerWaalsContact OE2-CD 3.29Å; E17-R20 WeakPolarHBondContact OE2-CD 3.39Å; E17-R20 IonicContact OE2-CZ 3.5Å; E17-R20 IonicContact OE2-NE 2.8Å; E17-R20 IonicContact OE2-NH1 3.24Å; E17-R20 PolarHBondContact OE2-NH1 2.97Å; A18-R20 PolarHBondContact O-N 3.45Å; R20-A68 HydrophobicContact CB-CB 3.85Å; R20-N72 PolarHBondContact O-ND2 3.34Å; R20-N72 PolarHBondContact O-OD1 2.7Å
21F92.3Very high94.3Very high7 Ų756.9 Ų56.93%0.03127%0.269CS..  trans-72.6131.8173.9-72.6-89.1000109.8A18 Q19 I26 R27 F30 L64 Q67 A68 N71A18-F21 WeakPolarHBondContact O-CD2 3.25Å; A18-F21 PolarHBondContact O-N 3.01Å; Q19-F21 VanDerWaalsContact C-N 3.29Å; Q19-F21 PolarHBondContact O-N 3.38Å; F21-I26 HydrophobicContact CB-CG2 4.29Å; F21-I26 HydrophobicContact CD1-CB 4.3Å; F21-I26 HydrophobicContact CD1-CG2 3.38Å; F21-I26 HydrophobicContact CD2-CG2 4.47Å; F21-I26 HydrophobicContact CE1-CG2 3.72Å; F21-I26 HydrophobicContact CG-CG2 3.79Å; F21-I26 HydrophobicContact CZ-CG2 4.4Å; F21-R27 HydrophobicContact CB-CB 4.12Å; F21-R27 PolarHBondContact O-NH1 2.89Å; F21-F30 HydrophobicContact CD2-CD2 4.14Å; F21-F30 HydrophobicContact CE1-CE2 4.05Å; F21-F30 AromaticContact CE2-CD2 3.79Å; F21-F30 HydrophobicContact CE2-CD2 3.79Å; F21-F30 AromaticContact CE2-CE2 3.91Å; F21-F30 HydrophobicContact CE2-CE2 3.91Å; F21-F30 AromaticContact CZ-CD2 4Å; F21-F30 HydrophobicContact CZ-CD2 4Å; F21-F30 AromaticContact CZ-CE2 3.61Å; F21-F30 HydrophobicContact CZ-CE2 3.61Å; F21-F30 HydrophobicContact CZ-CZ 4.45Å; F21-L64 HydrophobicContact CE2-CD1 3.48Å; F21-L64 VanDerWaalsContact CE2-CD1 3.48Å; F21-L64 HydrophobicContact CE2-CG 4.03Å; F21-L64 HydrophobicContact CZ-CD1 3.8Å; F21-Q67 HydrophobicContact CE1-CB 3.99Å; F21-Q67 HydrophobicContact CZ-CB 3.71Å; F21-A68 HydrophobicContact CD2-CB 4.19Å; F21-A68 HydrophobicContact CE1-CB 4.42Å; F21-A68 HydrophobicContact CE2-CB 3.87Å; F21-A68 HydrophobicContact CZ-CB 4.01Å; F21-N71 HydrophobicContact CD1-CB 3.8Å; F21-N71 HydrophobicContact CE1-CB 4.11Å
22T88.5Confident94.3Very high63 Ų6363.2 Ų63.239%0.38729%0.29SS..SBendtrans-74.7-40.6178.347.60000111.2Y24 R27 N71 N72T22-Y24 PolarHBondContact O-N 3Å; T22-R27 PolarHBondContact O-NH1 2.81Å; T22-N71 PolarHBondContact N-OD1 3.45Å; T22-N71 PolarHBondContact OG1-OD1 3.41Å; T22-N72 VanDerWaalsContact CG2-OD1 3.26Å; T22-N72 WeakPolarHBondContact CG2-OD1 3.42Å
23D89.1Confident94.3Very high22 Ų2264.6 Ų64.612%0.11829%0.288CS..SBendtrans-66.3121.5177.7-169.1-67.4000112.3N25 I26 R27 S76D23-N25 VanDerWaalsContact C-N 3.34Å; D23-N25 PolarHBondContact O-N 3.34Å; D23-N25 WeakPolarHBondContact OD1-CA 3.48Å; D23-N25 VanDerWaalsContact OD1-CB 3.3Å; D23-N25 WeakPolarHBondContact OD1-CB 3.5Å; D23-N25 PolarHBondContact OD1-N 2.92Å; D23-I26 HydrophobicContact CB-CB 4.03Å; D23-I26 HydrophobicContact CB-CD1 3.8Å; D23-I26 HydrophobicContact CB-CG1 3.88Å; D23-I26 PolarHBondContact O-N 3.29Å; D23-I26 PolarHBondContact OD1-N 2.86Å; D23-R27 WeakPolarHBondContact O-CB 3.43Å; D23-R27 PolarHBondContact O-N 3.46Å; D23-S76 WeakPolarHBondContact CB-OG 3.45Å; D23-S76 PolarHBondContact OD2-OG 2.93Å
24Y89.8Confident94.3Very high101 Ų10161.7 Ų61.740%0.39627%0.273SS..Hα-helixtrans-61-39.5-180173.7-94.2000113.4T22 S28 E82T22-Y24 PolarHBondContact O-N 3Å; Y24-S28 WeakPolarHBondContact CE2-OG 3.38Å; Y24-S28 WeakPolarHBondContact O-CB 3.21Å; Y24-S28 PolarHBondContact O-N 3.4Å; Y24-S28 PolarHBondContact O-OG 2.79Å; Y24-E82 WeakPolarHBondContact CA-OE1 3.45Å; Y24-E82 VanDerWaalsContact CB-CD 3.48Å; Y24-E82 VanDerWaalsContact CB-CG 3.46Å; Y24-E82 WeakPolarHBondContact CB-OE1 3.36Å; Y24-E82 HydrophobicContact CG-CG 4.16Å; Y24-E82 PolarHBondContact N-OE1 3.35Å
25N91.2Very high94.3Very high83 Ų8365.9 Ų65.944%0.44430%0.295SS..Hα-helixtrans-67.7-42-177.5-64.8-49.8000110.4D23 Y29D23-N25 VanDerWaalsContact C-N 3.34Å; D23-N25 PolarHBondContact O-N 3.34Å; D23-N25 WeakPolarHBondContact OD1-CA 3.48Å; D23-N25 VanDerWaalsContact OD1-CB 3.3Å; D23-N25 WeakPolarHBondContact OD1-CB 3.5Å; D23-N25 PolarHBondContact OD1-N 2.92Å; N25-Y29 WeakPolarHBondContact O-CB 3.42Å; N25-Y29 PolarHBondContact O-N 2.92Å
26I92.2Very high94.3Very high57 Ų5770.6 Ų70.629%0.29232%0.316SS..Hα-helixtrans-66.2-49.5177.4-59.2178.5000110.3F21 D23 S28 Y29 F30F21-I26 HydrophobicContact CB-CG2 4.29Å; F21-I26 HydrophobicContact CD1-CB 4.3Å; F21-I26 HydrophobicContact CD1-CG2 3.38Å; F21-I26 HydrophobicContact CD2-CG2 4.47Å; F21-I26 HydrophobicContact CE1-CG2 3.72Å; F21-I26 HydrophobicContact CG-CG2 3.79Å; F21-I26 HydrophobicContact CZ-CG2 4.4Å; D23-I26 HydrophobicContact CB-CB 4.03Å; D23-I26 HydrophobicContact CB-CD1 3.8Å; D23-I26 HydrophobicContact CB-CG1 3.88Å; D23-I26 PolarHBondContact O-N 3.29Å; D23-I26 PolarHBondContact OD1-N 2.86Å; I26-S28 PolarHBondContact O-N 2.99Å; I26-Y29 PolarHBondContact O-N 2.95Å; I26-F30 HydrophobicContact CG2-CD2 3.68Å; I26-F30 HydrophobicContact CG2-CE2 3.47Å; I26-F30 VanDerWaalsContact CG2-CE2 3.47Å; I26-F30 VanDerWaalsContact O-CD2 3.24Å; I26-F30 WeakPolarHBondContact O-CD2 3.39Å; I26-F30 PolarHBondContact O-N 2.94Å
27R94.1Very high94.3Very high52 Ų5266.3 Ų66.320%0.19630%0.299CS..Hα-helixtrans-54.7-54.4176.7178.6164.667.3-105.8-1111.3A18 F21 T22 D23 Y29 F30 E31A18-R27 WeakPolarHBondContact O-CG 3.49Å; F21-R27 HydrophobicContact CB-CB 4.12Å; F21-R27 PolarHBondContact O-NH1 2.89Å; T22-R27 PolarHBondContact O-NH1 2.81Å; D23-R27 WeakPolarHBondContact O-CB 3.43Å; D23-R27 PolarHBondContact O-N 3.46Å; R27-Y29 VanDerWaalsContact C-N 3.31Å; R27-Y29 PolarHBondContact O-N 2.9Å; R27-F30 PolarHBondContact O-N 3.27Å; R27-E31 VanDerWaalsContact CG-OE1 3.29Å; R27-E31 WeakPolarHBondContact CG-OE1 3.34Å; R27-E31 WeakPolarHBondContact O-CG 3.45Å; R27-E31 PolarHBondContact O-N 2.92Å
28S94.3Very high94.3Very high8 Ų865.1 Ų65.16%0.05629%0.293CS..Hα-helixtrans-63.7-34-179.7-560000113Y24 I26 R32Y24-S28 WeakPolarHBondContact CE2-OG 3.38Å; Y24-S28 WeakPolarHBondContact O-CB 3.21Å; Y24-S28 PolarHBondContact O-N 3.4Å; Y24-S28 PolarHBondContact O-OG 2.79Å; I26-S28 PolarHBondContact O-N 2.99Å; S28-R32 WeakPolarHBondContact O-CG 3.43Å; S28-R32 PolarHBondContact O-N 3.33Å; S28-R32 PolarHBondContact O-NH1 3.07Å
29Y95.4Very high94.3Very high114 Ų11471.8 Ų71.845%0.44732%0.322SS..Hα-helixtrans-63.1-47.6174.7167.9-94.4000111.1N25 I26 R27 K33N25-Y29 WeakPolarHBondContact O-CB 3.42Å; N25-Y29 PolarHBondContact O-N 2.92Å; I26-Y29 PolarHBondContact O-N 2.95Å; R27-Y29 VanDerWaalsContact C-N 3.31Å; R27-Y29 PolarHBondContact O-N 2.9Å; Y29-K33 HydrophobicContact CE1-CD 3.85Å; Y29-K33 VanDerWaalsContact O-CB 3.31Å; Y29-K33 WeakPolarHBondContact O-CB 3.22Å; Y29-K33 PolarHBondContact O-N 3.46Å; Y29-K33 PolarHBondContact OH-NZ 3.21Å
30F96.3Very high94.4Very high45 Ų4570.8 Ų70.820%0.19732%0.32CS..Hα-helixtrans-67.2-42-179.2-77.3-61.1000112A18 F21 I26 R27 R32 K33 I34 L64A18-F30 HydrophobicContact CB-CB 3.83Å; F21-F30 HydrophobicContact CD2-CD2 4.14Å; F21-F30 HydrophobicContact CE1-CE2 4.05Å; F21-F30 AromaticContact CE2-CD2 3.79Å; F21-F30 HydrophobicContact CE2-CD2 3.79Å; F21-F30 AromaticContact CE2-CE2 3.91Å; F21-F30 HydrophobicContact CE2-CE2 3.91Å; F21-F30 AromaticContact CZ-CD2 4Å; F21-F30 HydrophobicContact CZ-CD2 4Å; F21-F30 AromaticContact CZ-CE2 3.61Å; F21-F30 HydrophobicContact CZ-CE2 3.61Å; F21-F30 HydrophobicContact CZ-CZ 4.45Å; I26-F30 HydrophobicContact CG2-CD2 3.68Å; I26-F30 HydrophobicContact CG2-CE2 3.47Å; I26-F30 VanDerWaalsContact CG2-CE2 3.47Å; I26-F30 VanDerWaalsContact O-CD2 3.24Å; I26-F30 WeakPolarHBondContact O-CD2 3.39Å; I26-F30 PolarHBondContact O-N 2.94Å; R27-F30 PolarHBondContact O-N 3.27Å; F30-R32 PolarHBondContact O-N 3.45Å; F30-K33 PolarHBondContact O-N 3.4Å; F30-K33 VanDerWaalsContact O-N 3.16Å; F30-I34 WeakPolarHBondContact O-CB 3.19Å; F30-I34 WeakPolarHBondContact O-CD1 3.36Å; F30-I34 WeakPolarHBondContact O-CG1 3.42Å; F30-I34 PolarHBondContact O-N 3.45Å; F30-L64 HydrophobicContact CB-CD1 4.4Å; F30-L64 HydrophobicContact CD1-CD1 3.61Å; F30-L64 HydrophobicContact CD2-CD1 3.78Å; F30-L64 HydrophobicContact CE1-CD1 3.68Å; F30-L64 HydrophobicContact CE2-CD1 3.83Å; F30-L64 HydrophobicContact CG-CD1 3.68Å; F30-L64 HydrophobicContact CZ-CD1 3.79Å
31E96.5Very high94.4Very high47 Ų4766.7 Ų66.722%0.2231%0.306CS..Hα-helixtrans-53.8-54174.1-72.3170.2-169.200111.9F15 A18 Q19 R27 K33 I34 D35F15-E31 HydrophobicContact CD1-CB 4.47Å; F15-E31 HydrophobicContact CD1-CG 4.12Å; F15-E31 HydrophobicContact CE1-CB 3.94Å; F15-E31 HydrophobicContact CE1-CG 4.08Å; A18-E31 HydrophobicContact CB-CG 4.42Å; Q19-E31 PolarHBondContact NE2-OE1 3Å; R27-E31 VanDerWaalsContact CG-OE1 3.29Å; R27-E31 WeakPolarHBondContact CG-OE1 3.34Å; R27-E31 WeakPolarHBondContact O-CG 3.45Å; R27-E31 PolarHBondContact O-N 2.92Å; E31-K33 VanDerWaalsContact C-N 3.26Å; E31-K33 PolarHBondContact O-N 3.42Å; E31-I34 PolarHBondContact O-N 3.16Å; E31-D35 PolarHBondContact O-N 3.14Å
32R97.1Very high94.5Very high155 Ų15570.2 Ų70.259%0.58533%0.331SS*.Hα-helixtrans-59.9-37.4177.9-71.3-171.8-62.2-94.52112.6S28 F30 K36S28-R32 WeakPolarHBondContact O-CG 3.43Å; S28-R32 PolarHBondContact O-N 3.33Å; S28-R32 PolarHBondContact O-NH1 3.07Å; F30-R32 PolarHBondContact O-N 3.45Å; R32-K36 WeakPolarHBondContact O-CB 3.41Å; R32-K36 PolarHBondContact O-N 2.96Å; R32-K36 VanDerWaalsContact O-N 3.07Å
33K96.5Very high94.8Very high87 Ų8773.6 Ų73.638%0.37834%0.343SS..Hα-helixtrans-68.3-43.7179.1-175.2174.9-175.8174.70111.2Y29 F30 E31 K36 I37Y29-K33 HydrophobicContact CE1-CD 3.85Å; Y29-K33 VanDerWaalsContact O-CB 3.31Å; Y29-K33 WeakPolarHBondContact O-CB 3.22Å; Y29-K33 PolarHBondContact O-N 3.46Å; Y29-K33 PolarHBondContact OH-NZ 3.21Å; F30-K33 PolarHBondContact O-N 3.4Å; F30-K33 VanDerWaalsContact O-N 3.16Å; E31-K33 VanDerWaalsContact C-N 3.26Å; E31-K33 PolarHBondContact O-N 3.42Å; K33-K36 PolarHBondContact O-N 3.19Å; K33-I37 HydrophobicContact CG-CD1 3.83Å; K33-I37 WeakPolarHBondContact O-CB 3.34Å; K33-I37 VanDerWaalsContact O-CG1 3.24Å; K33-I37 WeakPolarHBondContact O-CG1 3.47Å; K33-I37 PolarHBondContact O-N 3.44Å
34I96.9Very high95.1Very high10 Ų1074.5 Ų74.55%0.05135%0.349CS..Hα-helixtrans-61.5-50.6176.6-66.4158000109.1L14 F15 A18 F30 E31 K36 I37 F38 L64L14-I34 HydrophobicContact CB-CD1 3.72Å; L14-I34 HydrophobicContact CB-CG1 3.99Å; L14-I34 HydrophobicContact CB-CG2 4.12Å; L14-I34 WeakPolarHBondContact O-CD1 3.41Å; F15-I34 HydrophobicContact CD1-CD1 4.47Å; F15-I34 HydrophobicContact CD2-CG2 3.8Å; F15-I34 HydrophobicContact CE1-CB 4.27Å; F15-I34 HydrophobicContact CE1-CG2 4.28Å; F15-I34 HydrophobicContact CE2-CB 4.23Å; F15-I34 HydrophobicContact CE2-CG2 3.42Å; F15-I34 VanDerWaalsContact CE2-CG2 3.42Å; F15-I34 HydrophobicContact CG-CG2 4.35Å; F15-I34 HydrophobicContact CZ-CB 3.95Å; F15-I34 HydrophobicContact CZ-CG2 3.66Å; A18-I34 HydrophobicContact CB-CD1 3.86Å; F30-I34 WeakPolarHBondContact O-CB 3.19Å; F30-I34 WeakPolarHBondContact O-CD1 3.36Å; F30-I34 WeakPolarHBondContact O-CG1 3.42Å; F30-I34 PolarHBondContact O-N 3.45Å; E31-I34 PolarHBondContact O-N 3.16Å; I34-K36 VanDerWaalsContact C-N 3.34Å; I34-K36 PolarHBondContact O-N 3.39Å; I34-I37 PolarHBondContact O-N 2.89Å; I34-I37 VanDerWaalsContact O-N 3.16Å; I34-F38 HydrophobicContact CG2-CD2 3.85Å; I34-F38 HydrophobicContact CG2-CE2 4.19Å; I34-F38 WeakPolarHBondContact O-CD2 3.48Å; I34-F38 PolarHBondContact O-N 3.37Å; I34-L64 HydrophobicContact CD1-CD2 4.38Å
35D96.4Very high95.2Very high94 Ų9479 Ų7950%0.50337%0.373SS..Hα-helixtrans-53-50.6176.8-86-33000112.3F15 E31 I37 F38 K39F15-D35 HydrophobicContact CZ-CB 4.49Å; F15-D35 VanDerWaalsContact CZ-OD1 3.22Å; F15-D35 WeakPolarHBondContact CZ-OD1 3.29Å; E31-D35 PolarHBondContact O-N 3.14Å; D35-I37 VanDerWaalsContact C-N 3.35Å; D35-I37 PolarHBondContact O-N 3.24Å; D35-F38 PolarHBondContact O-N 2.99Å; D35-K39 WeakPolarHBondContact O-CB 3.34Å; D35-K39 PolarHBondContact O-N 3.41Å
36K97.2Very high95.4Very high148 Ų14878.6 Ų78.664%0.64337%0.371SS*.Hα-helixtrans-60.6-44-179.9-177.7176.1177.4177.30111.8R32 K33 I34 N40R32-K36 WeakPolarHBondContact O-CB 3.41Å; R32-K36 PolarHBondContact O-N 2.96Å; R32-K36 VanDerWaalsContact O-N 3.07Å; K33-K36 PolarHBondContact O-N 3.19Å; I34-K36 VanDerWaalsContact C-N 3.34Å; I34-K36 PolarHBondContact O-N 3.39Å; K36-N40 PolarHBondContact O-N 2.95Å; K36-N40 VanDerWaalsContact O-N 3.14Å; K36-N40 PolarHBondContact O-ND2 3.18Å; K36-N40 PolarHBondContact O-OD1 3.31Å
37I96.4Very high95.4Very high46 Ų4678.1 Ų78.124%0.23638%0.376CS..Hα-helixtrans-66.4-47.9-178.6-71.8169.2000110.6K33 I34 D35 N40 L41K33-I37 HydrophobicContact CG-CD1 3.83Å; K33-I37 WeakPolarHBondContact O-CB 3.34Å; K33-I37 VanDerWaalsContact O-CG1 3.24Å; K33-I37 WeakPolarHBondContact O-CG1 3.47Å; K33-I37 PolarHBondContact O-N 3.44Å; I34-I37 PolarHBondContact O-N 2.89Å; I34-I37 VanDerWaalsContact O-N 3.16Å; D35-I37 VanDerWaalsContact C-N 3.35Å; D35-I37 PolarHBondContact O-N 3.24Å; I37-N40 PolarHBondContact O-N 2.78Å; I37-L41 HydrophobicContact CG2-CD1 3.89Å; I37-L41 HydrophobicContact CG2-CG 4.31Å; I37-L41 WeakPolarHBondContact O-CG 3.39Å; I37-L41 PolarHBondContact O-N 3.08Å
38F96Very high95.5Very high17 Ų1781.5 Ų81.58%0.07540%0.398CS..Hα-helixtrans-73.1-31.2-176.1-81.5-96.4000112.5L7 L10 L14 I34 D35 L41 S42 N57L7-F38 HydrophobicContact CB-CD1 4.45Å; L7-F38 HydrophobicContact CD2-CD1 3.71Å; L7-F38 HydrophobicContact CD2-CE1 3.91Å; L7-F38 WeakPolarHBondContact O-CD1 3.24Å; L7-F38 VanDerWaalsContact O-CE1 3.25Å; L7-F38 WeakPolarHBondContact O-CE1 3.41Å; L10-F38 HydrophobicContact CB-CE1 4.1Å; L10-F38 HydrophobicContact CB-CZ 4.07Å; L10-F38 HydrophobicContact CD2-CE1 4.36Å; L10-F38 HydrophobicContact CD2-CZ 3.9Å; L10-F38 HydrophobicContact CG-CE1 4.28Å; L10-F38 HydrophobicContact CG-CZ 3.76Å; L14-F38 HydrophobicContact CD1-CE2 3.39Å; L14-F38 HydrophobicContact CD1-CZ 3.65Å; I34-F38 HydrophobicContact CG2-CD2 3.85Å; I34-F38 HydrophobicContact CG2-CE2 4.19Å; I34-F38 WeakPolarHBondContact O-CD2 3.48Å; I34-F38 PolarHBondContact O-N 3.37Å; D35-F38 PolarHBondContact O-N 2.99Å; F38-L41 PolarHBondContact O-N 3.35Å; F38-S42 WeakPolarHBondContact O-CB 3.46Å; F38-S42 PolarHBondContact O-N 3.25Å; F38-S42 PolarHBondContact O-OG 2.87Å; F38-N57 HydrophobicContact CZ-CB 4.35Å
39K95.5Very high95.5Very high141 Ų14185.9 Ų85.961%0.61342%0.42SS*.Hα-helixtrans-59.2-47.2167.5-174.1175.7-177.91770111.1D35 S42 Q43D35-K39 WeakPolarHBondContact O-CB 3.34Å; D35-K39 PolarHBondContact O-N 3.41Å; K39-S42 PolarHBondContact O-N 3.22Å; K39-S42 PolarHBondContact O-OG 3.09Å; K39-Q43 WeakPolarHBondContact O-CG 3.35Å
40N95.7Very high95.5Very high86 Ų8681 Ų8146%0.4640%0.401SS..Hα-helixtrans-66.3-44.5178.5-68-10.9000112.2K36 I37 S42 Q43K36-N40 PolarHBondContact O-N 2.95Å; K36-N40 VanDerWaalsContact O-N 3.14Å; K36-N40 PolarHBondContact O-ND2 3.18Å; K36-N40 PolarHBondContact O-OD1 3.31Å; I37-N40 PolarHBondContact O-N 2.78Å; N40-S42 VanDerWaalsContact C-N 3.28Å; N40-S42 PolarHBondContact O-N 3.41Å; N40-Q43 WeakPolarHBondContact O-CB 3.39Å; N40-Q43 PolarHBondContact O-N 3.45Å; N40-Q43 VanDerWaalsContact O-N 3.09Å
41L95.4Very high95.5Very high18 Ų1880.5 Ų80.59%0.09440%0.4CS..Hα-helixtrans-62.9-34.2178.2-72.5175.8000112.4L7 I37 F38 Q43 V44 L50L7-L41 HydrophobicContact CD2-CB 3.78Å; L7-L41 HydrophobicContact CD2-CD1 4.23Å; I37-L41 HydrophobicContact CG2-CD1 3.89Å; I37-L41 HydrophobicContact CG2-CG 4.31Å; I37-L41 WeakPolarHBondContact O-CG 3.39Å; I37-L41 PolarHBondContact O-N 3.08Å; F38-L41 PolarHBondContact O-N 3.35Å; L41-Q43 PolarHBondContact O-N 3.17Å; L41-V44 PolarHBondContact O-N 3.31Å; L41-V44 VanDerWaalsContact O-N 3.15Å; L41-L50 HydrophobicContact CB-CD1 4.12Å; L41-L50 HydrophobicContact CD2-CD1 4.31Å
42S93.7Very high95.4Very high80 Ų8082.9 Ų82.956%0.55942%0.417SS*.THydrogen-bonded Turntrans-64.7-16.117674.50000114.1F38 K39 N40F38-S42 WeakPolarHBondContact O-CB 3.46Å; F38-S42 PolarHBondContact O-N 3.25Å; F38-S42 PolarHBondContact O-OG 2.87Å; K39-S42 PolarHBondContact O-N 3.22Å; K39-S42 PolarHBondContact O-OG 3.09Å; N40-S42 VanDerWaalsContact C-N 3.28Å; N40-S42 PolarHBondContact O-N 3.41Å
43Q95Very high95.4Very high135 Ų13576.1 Ų76.163%0.63140%0.396SS*.THydrogen-bonded Turntrans-99.2-2.1178.7-63177.4-35.600113K39 N40 L41 E45K39-Q43 WeakPolarHBondContact O-CG 3.35Å; N40-Q43 WeakPolarHBondContact O-CB 3.39Å; N40-Q43 PolarHBondContact O-N 3.45Å; N40-Q43 VanDerWaalsContact O-N 3.09Å; L41-Q43 PolarHBondContact O-N 3.17Å; Q43-E45 PolarHBondContact O-N 3.1Å
44V94.8Very high95.3Very high41 Ų4172 Ų7225%0.24838%0.378CS..  trans-81.6118.1179.71770000109.6L41 D46 I49 L50L41-V44 PolarHBondContact O-N 3.31Å; L41-V44 VanDerWaalsContact O-N 3.15Å; V44-D46 WeakPolarHBondContact CG1-O 3.44Å; V44-I49 HydrophobicContact CG1-CB 3.77Å; V44-I49 HydrophobicContact CG1-CG2 3.76Å; V44-L50 HydrophobicContact CB-CB 4.5Å; V44-L50 HydrophobicContact CG1-CB 4.1Å
45E93Very high95.3Very high195 Ų19576.9 Ų76.991%0.91140%0.399SS*.  trans-84.4-30.4177.6-63-178.9179.100112.9Q43 A47Q43-E45 PolarHBondContact O-N 3.1Å; E45-A47 PolarHBondContact O-N 3Å
46D94.6Very high95.3Very high74 Ų7478.8 Ų78.840%0.39640%0.403SS..  trans-74114.3179-173.6-33.8000111V44 N48 I49 L50V44-D46 WeakPolarHBondContact CG1-O 3.44Å; D46-N48 VanDerWaalsContact C-N 3.27Å; D46-N48 PolarHBondContact O-N 2.63Å; D46-N48 WeakPolarHBondContact OD1-CA 3.17Å; D46-N48 WeakPolarHBondContact OD1-CB 3.39Å; D46-N48 PolarHBondContact OD1-N 3.2Å; D46-I49 HydrophobicContact CB-CB 4.1Å; D46-I49 HydrophobicContact CB-CD1 3.76Å; D46-I49 HydrophobicContact CB-CG1 3.83Å; D46-I49 PolarHBondContact O-N 3.18Å; D46-I49 PolarHBondContact OD1-N 3.27Å; D46-L50 WeakPolarHBondContact O-CB 3.35Å; D46-L50 PolarHBondContact O-N 3.46Å
47A93.5Very high95.2Very high48 Ų4872.3 Ų72.340%0.39738%0.375SS..Hα-helixtrans-59.5-32.7-179.300000113.7F3 E45 E51F3-A47 HydrophobicContact CE2-CB 4.1Å; F3-A47 HydrophobicContact CZ-CB 4.19Å; E45-A47 PolarHBondContact O-N 3Å; A47-E51 VanDerWaalsContact O-CB 3.23Å; A47-E51 WeakPolarHBondContact O-CB 3.31Å; A47-E51 PolarHBondContact O-N 3.16Å
48N95Very high95.2Very high123 Ų12373.5 Ų73.566%0.65838%0.38SS*.Hα-helixtrans-72.3-40178.9-65-48.7000111.2D46 T52D46-N48 VanDerWaalsContact C-N 3.27Å; D46-N48 PolarHBondContact O-N 2.63Å; D46-N48 WeakPolarHBondContact OD1-CA 3.17Å; D46-N48 WeakPolarHBondContact OD1-CB 3.39Å; D46-N48 PolarHBondContact OD1-N 3.2Å; N48-T52 WeakPolarHBondContact O-CB 3.49Å; N48-T52 PolarHBondContact O-N 2.83Å; N48-T52 PolarHBondContact O-OG1 2.83Å
49I95Very high95.2Very high99 Ų9979 Ų7951%0.50841%0.406SS..Hα-helixtrans-66.1-44175.7-58.9180000109.5V44 D46 T52 G53V44-I49 HydrophobicContact CG1-CB 3.77Å; V44-I49 HydrophobicContact CG1-CG2 3.76Å; D46-I49 HydrophobicContact CB-CB 4.1Å; D46-I49 HydrophobicContact CB-CD1 3.76Å; D46-I49 HydrophobicContact CB-CG1 3.83Å; D46-I49 PolarHBondContact O-N 3.18Å; D46-I49 PolarHBondContact OD1-N 3.27Å; I49-T52 PolarHBondContact O-N 3.16Å; I49-G53 PolarHBondContact O-N 2.69Å
50L95.2Very high95.1Very high13 Ų1375.6 Ų75.67%0.06839%0.394CS..Hα-helixtrans-62.9-44.7177.4-177.854.8000112F3 L7 L41 V44 D46 G53 L54F3-L50 HydrophobicContact CB-CD2 3.68Å; F3-L50 HydrophobicContact CD1-CD2 3.78Å; F3-L50 HydrophobicContact CD1-CG 3.93Å; F3-L50 HydrophobicContact CD2-CD2 4.13Å; F3-L50 HydrophobicContact CE1-CD2 4.41Å; F3-L50 HydrophobicContact CE1-CG 4.33Å; F3-L50 HydrophobicContact CG-CD2 3.61Å; F3-L50 HydrophobicContact CG-CG 4.3Å; L7-L50 HydrophobicContact CD1-CD1 4.3Å; L7-L50 HydrophobicContact CD2-CD1 4.27Å; L41-L50 HydrophobicContact CB-CD1 4.12Å; L41-L50 HydrophobicContact CD2-CD1 4.31Å; V44-L50 HydrophobicContact CB-CB 4.5Å; V44-L50 HydrophobicContact CG1-CB 4.1Å; D46-L50 WeakPolarHBondContact O-CB 3.35Å; D46-L50 PolarHBondContact O-N 3.46Å; L50-G53 PolarHBondContact O-N 3.44Å; L50-L54 HydrophobicContact CD1-CD1 4.3Å; L50-L54 HydrophobicContact CD1-CG 4.31Å; L50-L54 HydrophobicContact CG-CD1 4.21Å; L50-L54 WeakPolarHBondContact O-CB 3.39Å; L50-L54 WeakPolarHBondContact O-CG 3.41Å; L50-L54 PolarHBondContact O-N 3.45Å
51E95.4Very high95.1Very high34 Ų3473.2 Ų73.216%0.15938%0.381CS..Hα-helixtrans-60.9-45.7176.7-17758.8-144.500111.7F3 R6 A47 G53 L54 K55F3-E51 HydrophobicContact CE1-CB 4.38Å; F3-E51 WeakPolarHBondContact CE1-OE2 3.35Å; R6-E51 IonicContact CZ-OE1 2.79Å; R6-E51 IonicContact CZ-OE2 3.82Å; R6-E51 IonicContact NH1-OE1 2.92Å; R6-E51 PolarHBondContact NH1-OE1 3.37Å; R6-E51 IonicContact NH1-OE2 3.2Å; R6-E51 PolarHBondContact NH1-OE2 3.01Å; R6-E51 IonicContact NH2-OE1 3.61Å; R6-E51 PolarHBondContact NH2-OE1 3.23Å; A47-E51 VanDerWaalsContact O-CB 3.23Å; A47-E51 WeakPolarHBondContact O-CB 3.31Å; A47-E51 PolarHBondContact O-N 3.16Å; E51-G53 VanDerWaalsContact C-N 3.32Å; E51-G53 PolarHBondContact O-N 3.43Å; E51-L54 PolarHBondContact O-N 3.09Å; E51-K55 WeakPolarHBondContact O-CG 3.29Å; E51-K55 PolarHBondContact O-N 3.42Å; E51-K55 WeakPolarHBondContact OE1-CE 3.47Å
52T95.9Very high95.1Very high96 Ų9678.2 Ų78.259%0.58940%0.403SS*.Hα-helixtrans-61.7-42.5176.7-58.70000111.1N48 I49 K56N48-T52 WeakPolarHBondContact O-CB 3.49Å; N48-T52 PolarHBondContact O-N 2.83Å; N48-T52 PolarHBondContact O-OG1 2.83Å; I49-T52 PolarHBondContact O-N 3.16Å; T52-K56 WeakPolarHBondContact O-CB 3.48Å; T52-K56 PolarHBondContact O-N 3.11Å; T52-K56 VanDerWaalsContact O-N 3.08Å
53G95.7Very high95.1Very high13 Ų1377 Ų7713%0.13439%0.393CS..Hα-helixtrans-62.2-43.2175.900000112.8I49 L50 E51 N57I49-G53 PolarHBondContact O-N 2.69Å; L50-G53 PolarHBondContact O-N 3.44Å; E51-G53 VanDerWaalsContact C-N 3.32Å; E51-G53 PolarHBondContact O-N 3.43Å; G53-N57 PolarHBondContact O-N 3.21Å; G53-N57 PolarHBondContact O-ND2 3.49Å
54L95.7Very high95.1Very high0 Ų071 Ų710%037%0.365CS..Hα-helixtrans-65.9-48.7177.6-75.7171.3000111.9F3 R6 L7 L10 L50 E51 K56 N57 E58F3-L54 HydrophobicContact CD1-CD1 3.71Å; F3-L54 HydrophobicContact CE1-CD1 4.3Å; R6-L54 HydrophobicContact CB-CD1 4.4Å; R6-L54 HydrophobicContact CG-CD1 4.11Å; R6-L54 HydrophobicContact CG-CD2 4.38Å; L7-L54 HydrophobicContact CD2-CD2 3.65Å; L7-L54 HydrophobicContact CD2-CG 4.47Å; L7-L54 HydrophobicContact CG-CD2 4.04Å; L10-L54 HydrophobicContact CD2-CD2 3.91Å; L50-L54 HydrophobicContact CD1-CD1 4.3Å; L50-L54 HydrophobicContact CD1-CG 4.31Å; L50-L54 HydrophobicContact CG-CD1 4.21Å; L50-L54 WeakPolarHBondContact O-CB 3.39Å; L50-L54 WeakPolarHBondContact O-CG 3.41Å; L50-L54 PolarHBondContact O-N 3.45Å; E51-L54 PolarHBondContact O-N 3.09Å; L54-K56 VanDerWaalsContact C-N 3.31Å; L54-K56 PolarHBondContact O-N 3.28Å; L54-N57 CarbonylContact O-C 3.6Å; L54-N57 PolarHBondContact O-N 3.47Å; L54-E58 WeakPolarHBondContact O-CG 3.46Å; L54-E58 PolarHBondContact O-N 2.95Å
55K95.9Very high95.1Very high113 Ų11370.3 Ų70.349%0.49136%0.363SS..Hα-helixtrans-56.1-45.1177.2-74.2-175.9179-176.30112.2E51 N57 E58 E59E51-K55 WeakPolarHBondContact O-CG 3.29Å; E51-K55 PolarHBondContact O-N 3.42Å; E51-K55 WeakPolarHBondContact OE1-CE 3.47Å; K55-N57 VanDerWaalsContact C-N 3.27Å; K55-N57 PolarHBondContact O-N 2.85Å; K55-E58 WeakPolarHBondContact O-CB 3.17Å; K55-E58 PolarHBondContact O-N 3.27Å; K55-E58 VanDerWaalsContact O-N 3.17Å; K55-E59 PolarHBondContact O-N 2.74Å; K55-E59 VanDerWaalsContact O-N 3.09Å
56K96.5Very high95.2Very high134 Ų13467.1 Ų67.158%0.58334%0.343SS*.Hα-helixtrans-58.9-38.6175.5-178.8175.2-179.31750112.4T52 L54 L60T52-K56 WeakPolarHBondContact O-CB 3.48Å; T52-K56 PolarHBondContact O-N 3.11Å; T52-K56 VanDerWaalsContact O-N 3.08Å; L54-K56 VanDerWaalsContact C-N 3.31Å; L54-K56 PolarHBondContact O-N 3.28Å; K56-L60 HydrophobicContact CG-CD1 4.45Å; K56-L60 VanDerWaalsContact O-CG 3.31Å; K56-L60 WeakPolarHBondContact O-CG 3.36Å; K56-L60 PolarHBondContact O-N 3.47Å; K56-L60 VanDerWaalsContact O-N 3.1Å
57N95.7Very high95.2Very high12 Ų1268 Ų686%0.06435%0.345CS..Hα-helixtrans-77.8-25.1179.4-78.1-79.5000112.9L10 L14 F38 G53 L54 K55 L60 L61L10-N57 HydrophobicContact CD2-CB 3.62Å; L10-N57 HydrophobicContact CG-CB 4.41Å; L14-N57 HydrophobicContact CD1-CB 4.33Å; F38-N57 HydrophobicContact CZ-CB 4.35Å; G53-N57 PolarHBondContact O-N 3.21Å; G53-N57 PolarHBondContact O-ND2 3.49Å; L54-N57 CarbonylContact O-C 3.6Å; L54-N57 PolarHBondContact O-N 3.47Å; K55-N57 VanDerWaalsContact C-N 3.27Å; K55-N57 PolarHBondContact O-N 2.85Å; N57-L60 PolarHBondContact O-N 3.29Å; N57-L61 PolarHBondContact O-N 2.83Å
58E96.2Very high95.1Very high72 Ų7265.7 Ų65.734%0.33633%0.326SS..Hα-helixtrans-64.8-44.5168.9-71.4166.8168.200110.9R6 L10 L54 K55 L60 L61R6-E58 IonicContact CZ-OE1 2.69Å; R6-E58 IonicContact CZ-OE2 3.91Å; R6-E58 IonicContact NE-OE1 2.73Å; R6-E58 PolarHBondContact NE-OE1 3.39Å; R6-E58 IonicContact NH2-OE1 3.62Å; R6-E58 PolarHBondContact NH2-OE1 3.47Å; R6-E58 IonicContact NH2-OE2 3.57Å; R6-E58 PolarHBondContact NH2-OE2 3.47Å; L10-E58 HydrophobicContact CD1-CG 3.85Å; L10-E58 HydrophobicContact CD2-CG 3.86Å; L10-E58 HydrophobicContact CG-CG 4.49Å; L54-E58 WeakPolarHBondContact O-CG 3.46Å; L54-E58 PolarHBondContact O-N 2.95Å; K55-E58 WeakPolarHBondContact O-CB 3.17Å; K55-E58 PolarHBondContact O-N 3.27Å; K55-E58 VanDerWaalsContact O-N 3.17Å; E58-L60 VanDerWaalsContact C-N 3.33Å; E58-L60 PolarHBondContact O-N 3.28Å; E58-L61 WeakPolarHBondContact O-CB 3.31Å; E58-L61 PolarHBondContact O-N 2.86Å
59E95.7Very high95Very high133 Ų13362.8 Ų62.862%0.62131%0.313SS*.Hα-helixtrans-61.6-41.4172.8-66.4170.8-175.900111.8K55 L61 E62 V63K55-E59 PolarHBondContact O-N 2.74Å; K55-E59 VanDerWaalsContact O-N 3.09Å; E59-L61 VanDerWaalsContact C-N 3.29Å; E59-L61 PolarHBondContact O-N 3.48Å; E59-E62 PolarHBondContact O-N 2.91Å; E59-V63 PolarHBondContact O-N 3.26Å
60L94Very high94.9Very high68 Ų6862.1 Ų62.136%0.35631%0.31SS..Hα-helixtrans-67.6-27177.5-72.6173.9000113.2K56 N57 E58 E62 V63 L64K56-L60 HydrophobicContact CG-CD1 4.45Å; K56-L60 VanDerWaalsContact O-CG 3.31Å; K56-L60 WeakPolarHBondContact O-CG 3.36Å; K56-L60 PolarHBondContact O-N 3.47Å; K56-L60 VanDerWaalsContact O-N 3.1Å; N57-L60 PolarHBondContact O-N 3.29Å; E58-L60 VanDerWaalsContact C-N 3.33Å; E58-L60 PolarHBondContact O-N 3.28Å; L60-E62 VanDerWaalsContact C-N 3.32Å; L60-V63 PolarHBondContact O-N 2.72Å; L60-L64 WeakPolarHBondContact O-CB 3.24Å; L60-L64 PolarHBondContact O-N 3.18Å
61L95.1Very high94.6Very high36 Ų3662.5 Ų62.519%0.18831%0.311CS..Hα-helixtrans-60.9-43.9174.3177.563.9000110.7L10 N13 L14 E17 N57 E58 E59 V63 L64 A65L10-L61 HydrophobicContact CD1-CB 4.39Å; L10-L61 HydrophobicContact CD1-CD2 4.08Å; N13-L61 HydrophobicContact CB-CD1 4.1Å; N13-L61 HydrophobicContact CB-CD2 3.91Å; L14-L61 HydrophobicContact CD2-CB 3.87Å; L14-L61 HydrophobicContact CD2-CD1 3.77Å; L14-L61 HydrophobicContact CD2-CG 4.45Å; L14-L61 HydrophobicContact CG-CB 4.41Å; L14-L61 HydrophobicContact CG-CD1 3.99Å; E17-L61 HydrophobicContact CB-CD1 4.25Å; E17-L61 HydrophobicContact CG-CD1 3.6Å; N57-L61 PolarHBondContact O-N 2.83Å; E58-L61 WeakPolarHBondContact O-CB 3.31Å; E58-L61 PolarHBondContact O-N 2.86Å; E59-L61 VanDerWaalsContact C-N 3.29Å; E59-L61 PolarHBondContact O-N 3.48Å; L61-V63 VanDerWaalsContact C-N 3.34Å; L61-V63 PolarHBondContact O-N 2.89Å; L61-L64 PolarHBondContact O-N 2.94Å; L61-A65 WeakPolarHBondContact O-CB 3.47Å; L61-A65 PolarHBondContact O-N 3.34Å
62E95.1Very high94.2Very high123 Ų12364.2 Ų64.258%0.57532%0.322SS*.Hα-helixtrans-65.9-38.4176.3-57.3-174.2172.900112.3E59 L60 L64 A65 R66E59-E62 PolarHBondContact O-N 2.91Å; L60-E62 VanDerWaalsContact C-N 3.32Å; E62-L64 VanDerWaalsContact C-N 3.35Å; E62-A65 PolarHBondContact O-N 3.03Å; E62-R66 WeakPolarHBondContact O-CG 3.33Å; E62-R66 PolarHBondContact O-N 3.27Å; E62-R66 VanDerWaalsContact O-N 3.09Å; E62-R66 PolarHBondContact O-NH1 3.33Å; E62-R66 IonicContact OE2-NH1 2.69Å
63V95Very high93.9Very high56 Ų5664.4 Ų64.434%0.33932%0.318SS..Hα-helixtrans-61.1-46.8174.1175.70000110.1E59 L60 L61 A65 R66 Q67E59-V63 PolarHBondContact O-N 3.26Å; L60-V63 PolarHBondContact O-N 2.72Å; L61-V63 VanDerWaalsContact C-N 3.34Å; L61-V63 PolarHBondContact O-N 2.89Å; V63-A65 PolarHBondContact O-N 3.17Å; V63-R66 VanDerWaalsContact CG2-NH2 3.28Å; V63-R66 PolarHBondContact O-N 3.12Å; V63-Q67 HydrophobicContact CG1-CG 4.3Å; V63-Q67 VanDerWaalsContact O-CG 3.3Å; V63-Q67 WeakPolarHBondContact O-CG 3.49Å; V63-Q67 PolarHBondContact O-N 3.33Å
64L95Very high93.5Very high9 Ų972.3 Ų72.35%0.04735%0.345CS..Hα-helixtrans-61.9-43.4-179.6-167.665.8000111.2L14 E17 A18 F21 F30 I34 L60 L61 E62 R66 Q67 A68L14-L64 HydrophobicContact CD2-CD2 3.85Å; L14-L64 WeakPolarHBondContact O-CD2 3.5Å; E17-L64 HydrophobicContact CB-CB 4.48Å; E17-L64 HydrophobicContact CB-CD2 3.78Å; E17-L64 HydrophobicContact CB-CG 4.01Å; A18-L64 HydrophobicContact CB-CD2 4.35Å; F21-L64 HydrophobicContact CE2-CD1 3.48Å; F21-L64 VanDerWaalsContact CE2-CD1 3.48Å; F21-L64 HydrophobicContact CE2-CG 4.03Å; F21-L64 HydrophobicContact CZ-CD1 3.8Å; F30-L64 HydrophobicContact CB-CD1 4.4Å; F30-L64 HydrophobicContact CD1-CD1 3.61Å; F30-L64 HydrophobicContact CD2-CD1 3.78Å; F30-L64 HydrophobicContact CE1-CD1 3.68Å; F30-L64 HydrophobicContact CE2-CD1 3.83Å; F30-L64 HydrophobicContact CG-CD1 3.68Å; F30-L64 HydrophobicContact CZ-CD1 3.79Å; I34-L64 HydrophobicContact CD1-CD2 4.38Å; L60-L64 WeakPolarHBondContact O-CB 3.24Å; L60-L64 PolarHBondContact O-N 3.18Å; L61-L64 PolarHBondContact O-N 2.94Å; E62-L64 VanDerWaalsContact C-N 3.35Å; L64-R66 PolarHBondContact O-N 3.47Å; L64-Q67 PolarHBondContact O-N 3.06Å; L64-A68 WeakPolarHBondContact O-CB 3.26Å; L64-A68 PolarHBondContact O-N 3.35Å
65A94.2Very high92.6Very high25 Ų2576.5 Ų76.521%0.20737%0.373CS..Hα-helixtrans-61.5-40.9176.600000112.8E17 L61 E62 V63 T69E17-A65 HydrophobicContact CG-CB 4.35Å; E17-A65 WeakPolarHBondContact OE2-CA 3.43Å; E17-A65 WeakPolarHBondContact OE2-CB 3.43Å; L61-A65 WeakPolarHBondContact O-CB 3.47Å; L61-A65 PolarHBondContact O-N 3.34Å; E62-A65 PolarHBondContact O-N 3.03Å; V63-A65 PolarHBondContact O-N 3.17Å; A65-T69 PolarHBondContact O-N 3.07Å; A65-T69 VanDerWaalsContact O-N 3.11Å; A65-T69 PolarHBondContact O-OG1 3.21Å
66R95.3Very high91.6Very high128 Ų12873.5 Ų73.548%0.48337%0.366SS..Hα-helixtrans-64.6-44.2173.7-71.7-173.7-65.2-91.34.5111.6E62 V63 L64 T69 L70E62-R66 WeakPolarHBondContact O-CG 3.33Å; E62-R66 PolarHBondContact O-N 3.27Å; E62-R66 VanDerWaalsContact O-N 3.09Å; E62-R66 PolarHBondContact O-NH1 3.33Å; E62-R66 IonicContact OE2-NH1 2.69Å; V63-R66 VanDerWaalsContact CG2-NH2 3.28Å; V63-R66 PolarHBondContact O-N 3.12Å; L64-R66 PolarHBondContact O-N 3.47Å; R66-T69 WeakPolarHBondContact O-CB 3.3Å; R66-T69 PolarHBondContact O-N 2.88Å; R66-L70 WeakPolarHBondContact O-CG 2.95Å; R66-L70 PolarHBondContact O-N 2.85Å
67Q93.9Very high90.5Very high93 Ų9370.4 Ų70.444%0.43537%0.372SS..Hα-helixtrans-65.5-40.4179.4-70.5-61.3-30.100112.4F21 V63 L64 T69 L70 N71F21-Q67 HydrophobicContact CE1-CB 3.99Å; F21-Q67 HydrophobicContact CZ-CB 3.71Å; V63-Q67 HydrophobicContact CG1-CG 4.3Å; V63-Q67 VanDerWaalsContact O-CG 3.3Å; V63-Q67 WeakPolarHBondContact O-CG 3.49Å; V63-Q67 PolarHBondContact O-N 3.33Å; L64-Q67 PolarHBondContact O-N 3.06Å; Q67-T69 VanDerWaalsContact C-N 3.29Å; Q67-T69 PolarHBondContact O-N 2.95Å; Q67-L70 PolarHBondContact O-N 3.41Å; Q67-N71 WeakPolarHBondContact O-CB 3.3Å; Q67-N71 PolarHBondContact O-N 2.93Å
68A92.5Very high89.6Confident0 Ų078.1 Ų78.10%041%0.405CS..Hα-helixtrans-61.1-41.2173.300000111.3R20 F21 L64 N71 N72R20-A68 HydrophobicContact CB-CB 3.85Å; F21-A68 HydrophobicContact CD2-CB 4.19Å; F21-A68 HydrophobicContact CE1-CB 4.42Å; F21-A68 HydrophobicContact CE2-CB 3.87Å; F21-A68 HydrophobicContact CZ-CB 4.01Å; L64-A68 WeakPolarHBondContact O-CB 3.26Å; L64-A68 PolarHBondContact O-N 3.35Å; A68-N71 PolarHBondContact O-N 3.44Å; A68-N72 VanDerWaalsContact O-CG 3.23Å; A68-N72 PolarHBondContact O-N 3.23Å; A68-N72 VanDerWaalsContact O-N 3.12Å; A68-N72 PolarHBondContact O-ND2 3.39Å; A68-N72 VanDerWaalsContact O-ND2 3.07Å
69T93.1Very high88.6Confident62 Ų6276.2 Ų76.238%0.3840%0.4SS..Hα-helixtrans-64.2-45.3176.8-56.30000111.6A65 R66 Q67 N72 I73A65-T69 PolarHBondContact O-N 3.07Å; A65-T69 VanDerWaalsContact O-N 3.11Å; A65-T69 PolarHBondContact O-OG1 3.21Å; R66-T69 WeakPolarHBondContact O-CB 3.3Å; R66-T69 PolarHBondContact O-N 2.88Å; Q67-T69 VanDerWaalsContact C-N 3.29Å; Q67-T69 PolarHBondContact O-N 2.95Å; T69-N72 PolarHBondContact O-N 3.18Å; T69-I73 HydrophobicContact CG2-CD1 4.33Å; T69-I73 WeakPolarHBondContact O-CG1 3.2Å; T69-I73 PolarHBondContact O-N 2.84Å
70L91.5Very high87.7Confident85 Ų8577 Ų7745%0.44541%0.413SS..Hα-helixtrans-64-42.2176.8-71.4173.9000112.5R66 Q67 N72 I73 Y74R66-L70 WeakPolarHBondContact O-CG 2.95Å; R66-L70 PolarHBondContact O-N 2.85Å; Q67-L70 PolarHBondContact O-N 3.41Å; L70-N72 PolarHBondContact O-N 3.06Å; L70-I73 PolarHBondContact O-N 3.01Å; L70-I73 VanDerWaalsContact O-N 3.11Å; L70-Y74 PolarHBondContact O-N 3.04Å
71N88.9Confident86.8Confident20 Ų2080.2 Ų80.211%0.10743%0.429CS..Hα-helixtrans-61.1-32.2176.7179.4-111.8000112F21 T22 Q67 A68 Y74 P75F21-N71 HydrophobicContact CD1-CB 3.8Å; F21-N71 HydrophobicContact CE1-CB 4.11Å; T22-N71 PolarHBondContact N-OD1 3.45Å; T22-N71 PolarHBondContact OG1-OD1 3.41Å; Q67-N71 WeakPolarHBondContact O-CB 3.3Å; Q67-N71 PolarHBondContact O-N 2.93Å; A68-N71 PolarHBondContact O-N 3.44Å; N71-Y74 CarbonylContact O-C 3.2Å; N71-P75 WeakPolarHBondContact O-CA 3.35Å
72N86.7Confident85.3Confident70 Ų7083.5 Ų83.537%0.37444%0.443SS..Hα-helixtrans-77.7-24.2176.5-69.5-27.7000113.6R20 T22 A68 T69 L70R20-N72 PolarHBondContact O-ND2 3.34Å; R20-N72 PolarHBondContact O-OD1 2.7Å; T22-N72 VanDerWaalsContact CG2-OD1 3.26Å; T22-N72 WeakPolarHBondContact CG2-OD1 3.42Å; A68-N72 VanDerWaalsContact O-CG 3.23Å; A68-N72 PolarHBondContact O-N 3.23Å; A68-N72 VanDerWaalsContact O-N 3.12Å; A68-N72 PolarHBondContact O-ND2 3.39Å; A68-N72 VanDerWaalsContact O-ND2 3.07Å; T69-N72 PolarHBondContact O-N 3.18Å; L70-N72 PolarHBondContact O-N 3.06Å
73I90.7Very high84.9Confident101 Ų10181.5 Ų81.552%0.51844%0.437SS..Hα-helixtrans-77.8-34.1173.5-64.9165.2000110.7T69 L70 P75T69-I73 HydrophobicContact CG2-CD1 4.33Å; T69-I73 WeakPolarHBondContact O-CG1 3.2Å; T69-I73 PolarHBondContact O-N 2.84Å; L70-I73 PolarHBondContact O-N 3.01Å; L70-I73 VanDerWaalsContact O-N 3.11Å; I73-P75 WeakPolarHBondContact O-CD 3.47Å
74Y86.3Confident84.3Confident178 Ų17882.8 Ų82.870%0.69844%0.442SS*.SBendtrans-122.973.1179-57.7-76.3000110.2L70 N71 S76L70-Y74 PolarHBondContact O-N 3.04Å; N71-Y74 CarbonylContact O-C 3.2Å; Y74-S76 PolarHBondContact O-N 3.11Å
75P76.8Confident83.7Confident89 Ų8986.9 Ų86.958%0.57846%0.464SS*.PPolyproline II helixtrans-63131.7-176.526.5-33.9000110.2N71 I73N71-P75 WeakPolarHBondContact O-CA 3.35Å; I73-P75 WeakPolarHBondContact O-CD 3.47Å
76S75.4Confident83.1Confident49 Ų4990.6 Ų90.634%0.34348%0.479SS..PPolyproline II helixtrans-69.7149.7163.446.60000109.1D23 Y74D23-S76 WeakPolarHBondContact CB-OG 3.45Å; D23-S76 PolarHBondContact OD2-OG 2.93Å; Y74-S76 PolarHBondContact O-N 3.11Å
77G74Confident82.3Confident69 Ų6988.3 Ų88.371%0.71148%0.479SS*.PPolyproline II helixtrans-59.1142.5169.400000109.9S79G77-S79 PolarHBondContact O-N 3.31Å
78K75.9Confident81.6Confident175 Ų17587.9 Ų87.976%0.76148%0.482SS*.PPolyproline II helixtrans-56.1136176.3-68.4-172.6172.4-174.60110.3E82K78-E82 WeakPolarHBondContact CG-OE2 3.33Å
79S75.1Confident80.8Confident32 Ų3294.2 Ų94.222%0.22452%0.516CS..PPolyproline II helixtrans-63.9154.7171.7-178.90000110.4G77 I81 E82G77-S79 PolarHBondContact O-N 3.31Å; S79-I81 PolarHBondContact O-N 3.09Å; S79-I81 VanDerWaalsContact O-N 3.09Å; S79-E82 PolarHBondContact O-N 3.41Å
80V77.5Confident79.8Confident148 Ų14896.7 Ų96.790%0.89753%0.526SS*.THydrogen-bonded Turntrans-61.6-17.4175.1-178.40000112.3
81I75.2Confident78.9Confident136 Ų13697.7 Ų97.770%0.69753%0.533SS*.THydrogen-bonded Turntrans-91.5-7.5-175.3-53.4173.1000111.8S79S79-I81 PolarHBondContact O-N 3.09Å; S79-I81 VanDerWaalsContact O-N 3.09Å
82E64.3Low78Confident105 Ų105104.7 Ų104.749%0.49157%0.572SS.*  trans-92.50177.8-67.7175.4-155.800113Y24 K78 S79Y24-E82 WeakPolarHBondContact CA-OE1 3.45Å; Y24-E82 VanDerWaalsContact CB-CD 3.48Å; Y24-E82 VanDerWaalsContact CB-CG 3.46Å; Y24-E82 WeakPolarHBondContact CB-OE1 3.36Å; Y24-E82 HydrophobicContact CG-CG 4.16Å; Y24-E82 PolarHBondContact N-OE1 3.35Å; K78-E82 WeakPolarHBondContact CG-OE2 3.33Å; S79-E82 PolarHBondContact O-N 3.41Å

Retrieved 82 of 82 residues in 21.1 ms (Link to these results)

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