chi_angles_atoms
氨基酸中决定侧链扭转角的原子基团的名称，每个氨基酸最多有四个侧链扭转角，其中ALA与GLY没有侧链扭转角；每个扭转角由4个原子基团的位置决定（二面角）。
key |
value |
|---|---|
ALA |
[] |
ARG |
[[‘N’, ‘CA’, ‘CB’, ‘CG’], [‘CA’, ‘CB’, ‘CG’, ‘CD’], [‘CB’, ‘CG’, ‘CD’, ‘NE’], [‘CG’, ‘CD’, ‘NE’, ‘CZ’]] |
ASN |
[[‘N’, ‘CA’, ‘CB’, ‘CG’], [‘CA’, ‘CB’, ‘CG’, ‘OD1’]] |
ASP |
[[‘N’, ‘CA’, ‘CB’, ‘CG’], [‘CA’, ‘CB’, ‘CG’, ‘OD1’]] |
CYS |
[[‘N’, ‘CA’, ‘CB’, ‘SG’]] |
GLN |
[[‘N’, ‘CA’, ‘CB’, ‘CG’], [‘CA’, ‘CB’, ‘CG’, ‘CD’], [‘CB’, ‘CG’, ‘CD’, ‘OE1’]] |
GLU |
[[‘N’, ‘CA’, ‘CB’, ‘CG’], [‘CA’, ‘CB’, ‘CG’, ‘CD’], [‘CB’, ‘CG’, ‘CD’, ‘OE1’]] |
GLY |
[] |
HIS |
[[‘N’, ‘CA’, ‘CB’, ‘CG’], [‘CA’, ‘CB’, ‘CG’, ‘ND1’]] |
ILE |
[[‘N’, ‘CA’, ‘CB’, ‘CG1’], [‘CA’, ‘CB’, ‘CG1’, ‘CD1’]] |
LEU |
[[‘N’, ‘CA’, ‘CB’, ‘CG’], [‘CA’, ‘CB’, ‘CG’, ‘CD1’]] |
LYS |
[[‘N’, ‘CA’, ‘CB’, ‘CG’], [‘CA’, ‘CB’, ‘CG’, ‘CD’], [‘CB’, ‘CG’, ‘CD’, ‘CE’], [‘CG’, ‘CD’, ‘CE’, ‘NZ’]] |
MET |
[[‘N’, ‘CA’, ‘CB’, ‘CG’], [‘CA’, ‘CB’, ‘CG’, ‘SD’], [‘CB’, ‘CG’, ‘SD’, ‘CE’]] |
PHE |
[[‘N’, ‘CA’, ‘CB’, ‘CG’], [‘CA’, ‘CB’, ‘CG’, ‘CD1’]] |
PRO |
[[‘N’, ‘CA’, ‘CB’, ‘CG’], [‘CA’, ‘CB’, ‘CG’, ‘CD’]] |
SER |
[[‘N’, ‘CA’, ‘CB’, ‘OG’]] |
THR |
[[‘N’, ‘CA’, ‘CB’, ‘OG1’]] |
TRP |
[[‘N’, ‘CA’, ‘CB’, ‘CG’], [‘CA’, ‘CB’, ‘CG’, ‘CD1’]] |
TYR |
[[‘N’, ‘CA’, ‘CB’, ‘CG’], [‘CA’, ‘CB’, ‘CG’, ‘CD1’]] |
VAL |
[[‘N’, ‘CA’, ‘CB’, ‘CG1’]] |