Pectocin M2

(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
 GLU-103   THR-104  13.2 13.0 5.5 -8.3 128.9 123.3 6.4
 THR-104   GLY-105  10.6 10.4 2.8 -8.0 67.5 57.8 -1.1
 GLY-105   LEU-106  7.8 8.0 6.3 -2.2 85.8 75.4 -1.7
 LEU-106   GLU-107  9.3 8.4 1.8 14.9 152.2 145.4 -10.2
 GLU-107   PHE-108  9.8 8.0 -12.2 4.8 67.1 87.7 3.8
 PHE-108   PHE-109  6.1 4.4 4.2 37.9 62.3 43.5 31.4
 PHE-109   ASN-110  5.2 3.9 -48.5 86.4 103.8 77.5 7.1
 LEU-116   PRO-117  13.4 6.7 -8.2 36.5 66.6 139.1 -2.3
 PRO-117   ARG-118  10.2 8.2 173.6 -3.1 49.7 29.3 181.1
 ARG-118   SER-119  6.8 6.2 -6.1 -25.6 140.1 136.9 -19.5

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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