Torsion Angle Defintions
The torsion angle definitions listed below are identical to those given in Lovell, S.C., et. al. "The Penultimate Rotamer Library." Proteins 40:389-408. They are standard in the protein nomenclature.
Backbone Angle Defintions
Torsion | Atom #1 | Atom #2 | Atom #3 | Atom #4 |
φ | Ci-1 | Ni | CAi | Ci |
ψ | Ni | CAi | Ci | Ni+1 |
ω | CAi-1 | Ci-1 | Ni | CAi |
χ1 Angle Defintions
Amino Acid | Atom #1 | Atom #2 | Atom #3 | Atom #4 |
ARG | N | CA | CB | CG |
ASN | N | CA | CB | CG |
ASP | N | CA | CB | CG |
CYS | N | CA | CB | SG |
SER | N | CA | CB | OG |
GLN | N | CA | CB | CG |
GLU | N | CA | CB | CG |
HIS | N | CA | CB | CG |
ILE | N | CA | CB | CG1 |
LEU | N | CA | CB | CG |
LYS | N | CA | CB | CG |
MET | N | CA | CB | CG |
PHE | N | CA | CB | CG |
PRO | N | CA | CB | CG |
THR | N | CA | CB | OG1 |
TRP | N | CA | CB | CG |
TYR | N | CA | CB | CG |
VAL | N | CA | CB | CG1 |
GLX | N | CA | CB | CG |
ASX | N | CA | CB | CG |
CYX | N | CA | CB | CG |
PCA | N | CA | CB | CG |
χ2 Angle Defintions
Amino Acid | Atom #1 | Atom #2 | Atom #3 | Atom #4 |
ARG | CA | CB | CG | CD |
ASN | CA | CB | CG | OD1 |
ASP | CA | CB | CG | OD1 |
ASX | CA | CB | CG | OD1 |
GLN | CA | CB | CG | CD |
GLU | CA | CB | CG | CD |
GLX | CA | CB | CG | CD |
HIS | CA | CB | CG | ND1 |
ILE | CA | CB | CG1 | CD1 |
LEU | CA | CB | CG | CD1 |
LYS | CA | CB | CG | CD |
MET | CA | CB | CG | SD |
PHE | CA | CB | CG | CD1 |
PRO | CA | CB | CG | CD |
TRP | CA | CB | CG | CD1 |
TYR | CA | CB | CG | CD1 |
χ3 Angle Defintions
Amino Acid | Atom #1 | Atom #2 | Atom #3 | Atom #4 |
ARG | CB | CG | CD | NE |
GLN | CB | CG | CD | OE1 |
GLU | CB | CG | CD | OE1 |
GLX | CB | CG | CD | OE1 |
LYS | CB | CG | CD | CE |
MET | CB | CG | SD | CE |
χ4 Angle Defintions
Amino Acid | Atom #1 | Atom #2 | Atom #3 | Atom #4 |
ARG | CG | CD | NE | CZ |
LYS | CG | CD | CE | NZ |