Acriflavine Resistance Protein B

(All numbering and residues are taken from first PDB file)

Bending Residue Dihedral Analysis

Residue i Residue i+1 Distance of hinge axis to residue i in conformer 1 (A) Distance of hinge axis to residue i in conformer 2 (A) Change in psi (i) (deg) Change in phi (i+1) (deg) Angle of psi(i) axis to hinge axis conformer 1 (deg) Angle of psi(i) axis to hinge axis conformer 2 (deg) Percentage Progress  TYR-35   PRO-36  16.1 16.9 -11.2 -9.5 59.4 57.2 37.4  PRO-36   THR-37  13.4 14.1 30.9 -6.2 41.9 51.3 101.1  THR-37   ILE-38  10.3 10.9 -11.7 2.4 104.1 103.1 18.1 Graph shows rotational transition at bending residues and can be used to identify hinge bending residues. Probably only informative for interdomain rotations greater than 20 degrees

Residue i Residue i+1 Distance of hinge axis to residue i in conformer 1 (A) Distance of hinge axis to residue i in conformer 2 (A) Change in psi (i) (deg) Change in phi (i+1) (deg) Angle of psi(i) axis to hinge axis conformer 1 (deg) Angle of psi(i) axis to hinge axis conformer 2 (deg) Percentage Progress  SER-128   VAL-129  9.9 9.2 6.9 -6.5 66.2 63.1 -63.4  VAL-129   GLU-130  8.0 7.6 -1.7 -18.5 128.7 127.0 -36.3  GLU-130   LYS-131  5.0 4.4 -14.5 59.9 118.5 100.3 49.6  LYS-131   SER-132  2.1 1.2 47.2 6.2 93.9 131.6 -107.8  SER-132   SER-133  2.8 1.4 -3.5 -26.5 82.2 105.1 17.7  SER-133   SER-134  5.2 5.2 50.8 -74.2 177.7 151.5 88.0  SER-134   SER-135  6.0 6.8 18.5 -58.8 112.4 120.1 69.1  SER-135   PHE-136  9.4 9.9 4.8 -7.7 70.2 62.2 -24.1 Graph shows rotational transition at bending residues and can be used to identify hinge bending residues. Probably only informative for interdomain rotations greater than 20 degrees

Residue i Residue i+1 Distance of hinge axis to residue i in conformer 1 (A) Distance of hinge axis to residue i in conformer 2 (A) Change in psi (i) (deg) Change in phi (i+1) (deg) Angle of psi(i) axis to hinge axis conformer 1 (deg) Angle of psi(i) axis to hinge axis conformer 2 (deg) Percentage Progress  VAL-576   GLN-577  13.6 14.1 15.9 -27.6 72.8 73.8 -69.8  GLN-577   LEU-578  11.0 11.5 -14.5 30.1 173.5 163.3 88.1  LEU-578   PRO-579  10.0 11.3 5.6 29.9 73.6 73.0 -6.2 Graph shows rotational transition at bending residues and can be used to identify hinge bending residues. Probably only informative for interdomain rotations greater than 20 degrees

Residue i Residue i+1 Distance of hinge axis to residue i in conformer 1 (A) Distance of hinge axis to residue i in conformer 2 (A) Change in psi (i) (deg) Change in phi (i+1) (deg) Angle of psi(i) axis to hinge axis conformer 1 (deg) Angle of psi(i) axis to hinge axis conformer 2 (deg) Percentage Progress  GLY-581   ALA-582  3.2 3.9 35.4 -11.2 100.6 101.8 -42.3  ALA-582   THR-583  6.9 7.3 -5.2 11.7 109.4 112.6 -2.0  THR-583   GLN-584  8.9 8.8 13.0 -12.1 44.3 43.8 31.1 Graph shows rotational transition at bending residues and can be used to identify hinge bending residues. Probably only informative for interdomain rotations greater than 20 degrees

Residue i Residue i+1 Distance of hinge axis to residue i in conformer 1 (A) Distance of hinge axis to residue i in conformer 2 (A) Change in psi (i) (deg) Change in phi (i+1) (deg) Angle of psi(i) axis to hinge axis conformer 1 (deg) Angle of psi(i) axis to hinge axis conformer 2 (deg) Percentage Progress  GLY-614   PHE-615  9.8 9.6 -0.4 10.6 36.7 33.5 -39.2  PHE-615   GLY-616  8.9 8.9 34.7 -51.9 91.3 91.2 40.3  GLY-616   PHE-617  8.0 8.6 15.6 -32.7 152.4 141.9 90.6  PHE-617   ALA-618  7.5 8.2 11.0 -11.4 85.1 65.3 -21.8  ALA-618   GLY-619  5.5 7.9 25.1 -35.2 86.6 75.3 -4.1  GLY-619   ARG-620  2.8 4.2 -33.5 35.6 120.0 112.8 13.5  ARG-620   GLY-621  4.5 3.7 31.8 -65.0 17.2 1.2 -154.5  GLY-621   GLN-622  4.8 4.6 -13.8 12.1 117.9 111.2 41.2 Graph shows rotational transition at bending residues and can be used to identify hinge bending residues. Probably only informative for interdomain rotations greater than 20 degrees

Residue i Residue i+1 Distance of hinge axis to residue i in conformer 1 (A) Distance of hinge axis to residue i in conformer 2 (A) Change in psi (i) (deg) Change in phi (i+1) (deg) Angle of psi(i) axis to hinge axis conformer 1 (deg) Angle of psi(i) axis to hinge axis conformer 2 (deg) Percentage Progress  ASN-667   LEU-668  20.9 21.4 42.7 -35.8 122.5 116.4 -3.9  LEU-668   PRO-669  17.8 18.4 25.3 -15.3 137.0 130.1 -37.1  PRO-669   ALA-670  18.6 17.7 24.8 -22.2 160.1 158.9 -17.5  ALA-670   ILE-671  19.7 18.6 1.2 -15.6 119.7 120.4 25.0  ILE-671   VAL-672  17.4 15.2 7.6 -7.2 58.9 44.5 -13.5  VAL-672   GLU-673  14.3 13.6 -157.4 -130.2 96.1 100.6 40.5  GLU-673   LEU-674  12.1 10.0 -58.0 81.5 65.2 104.8 55.7  LEU-674   GLY-675  14.8 11.2 -156.7 173.2 100.1 166.3 150.9  GLY-675   THR-676  18.1 13.2 44.6 -7.0 60.7 69.4 169.3  THR-676   ALA-677  20.3 13.0 -157.5 -133.8 87.1 112.7 -61.0  ALA-677   THR-678  24.2 16.5 -117.6 68.6 96.4 58.9 127.2  THR-678   GLY-679  24.8 20.0 92.8 -173.2 47.4 74.3 -259.9  GLY-679   PHE-680  21.6 21.4 51.7 50.4 109.6 91.1 -38.4  PHE-680   ASP-681  20.3 20.3 -16.1 7.2 116.5 121.7 17.2  ASP-681   PHE-682  17.3 17.1 21.1 -10.9 78.8 88.5 41.3 Graph shows rotational transition at bending residues and can be used to identify hinge bending residues. Probably only informative for interdomain rotations greater than 20 degrees

Residue i Residue i+1 Distance of hinge axis to residue i in conformer 1 (A) Distance of hinge axis to residue i in conformer 2 (A) Change in psi (i) (deg) Change in phi (i+1) (deg) Angle of psi(i) axis to hinge axis conformer 1 (deg) Angle of psi(i) axis to hinge axis conformer 2 (deg) Percentage Progress  THR-724   PRO-725  5.1 4.4 -4.6 -1.2 54.4 47.2 37.8  PRO-725   GLN-726  4.7 4.2 28.6 -18.4 69.0 68.2 40.2  GLN-726   PHE-727  6.0 5.8 -40.4 24.1 38.0 39.8 71.1 Graph shows rotational transition at bending residues and can be used to identify hinge bending residues. Probably only informative for interdomain rotations greater than 20 degrees

Residue i Residue i+1 Distance of hinge axis to residue i in conformer 1 (A) Distance of hinge axis to residue i in conformer 2 (A) Change in psi (i) (deg) Change in phi (i+1) (deg) Angle of psi(i) axis to hinge axis conformer 1 (deg) Angle of psi(i) axis to hinge axis conformer 2 (deg) Percentage Progress  GLU-810   TYR-811  9.3 9.4 6.5 -29.7 139.6 121.7 111.7  TYR-811   GLY-812  9.0 9.2 37.7 -69.8 150.4 161.6 130.8  GLY-812   SER-813  8.9 9.3 -2.8 -0.1 45.8 58.1 5.4  SER-813   PRO-814  8.0 7.5 31.9 -15.9 115.3 114.2 -32.3 Graph shows rotational transition at bending residues and can be used to identify hinge bending residues. Probably only informative for interdomain rotations greater than 20 degrees

Residue i Residue i+1 Distance of hinge axis to residue i in conformer 1 (A) Distance of hinge axis to residue i in conformer 2 (A) Change in psi (i) (deg) Change in phi (i+1) (deg) Angle of psi(i) axis to hinge axis conformer 1 (deg) Angle of psi(i) axis to hinge axis conformer 2 (deg) Percentage Progress  GLU-866   ARG-867  21.5 22.1 -9.3 12.9 92.0 97.9 -8.9  ARG-867   LEU-868  23.1 23.6 -21.7 13.6 147.3 162.9 -41.2  LEU-868   SER-869  21.5 22.4 -8.1 87.7 141.7 124.2 271.8  SER-869   GLY-870  22.8 23.8 179.2 121.3 107.7 93.2 60.7  GLY-870   ASN-871  26.1 27.2 141.5 -133.4 66.1 63.6 79.8  ASN-871   GLN-872  29.7 27.5 -53.5 18.8 176.6 174.4 -189.4  GLN-872   ALA-873  28.5 26.3 -14.6 10.1 119.5 118.4 -48.9 Graph shows rotational transition at bending residues and can be used to identify hinge bending residues. Probably only informative for interdomain rotations greater than 20 degrees