IPG
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N | CA | sing | 1.47Å | 1.46Å | |
N | CN | sing | 1.47Å | 1.47Å | |
N | H | sing | 1.01Å | 1.02Å | |
CA | C | sing | 1.51Å | 1.52Å | |
CA | HA3 | sing | 1.09Å | 1.11Å | |
CA | HA2 | sing | 1.09Å | 1.12Å | |
C | O | doub | 1.21Å | 1.23Å | |
C | OXT | sing | 1.34Å | 1.34Å | |
CN | CG1 | sing | 1.53Å | 1.53Å | |
CN | CG2 | sing | 1.53Å | 1.52Å | |
CN | HCN | sing | 1.09Å | 1.12Å | |
CG1 | HG11 | sing | 1.09Å | 1.12Å | |
CG1 | HG12 | sing | 1.09Å | 1.12Å | |
CG1 | HG13 | sing | 1.09Å | 1.11Å | |
CG2 | HG21 | sing | 1.09Å | 1.12Å | |
CG2 | HG22 | sing | 1.09Å | 1.11Å | |
CG2 | HG23 | sing | 1.09Å | 1.11Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CA | N | CN | 110.6° | 106.7° |
CA | N | H | 111.8° | 106.7° |
N | CA | C | 112.4° | 109.5° |
N | CA | HA3 | 111.1° | 109.5° |
N | CA | HA2 | 111.1° | 109.5° |
CN | N | H | 111.8° | 106.7° |
N | CN | CG1 | 110.8° | 109.5° |
N | CN | CG2 | 110.7° | 109.5° |
N | CN | HCN | 108.2° | 109.5° |
C | CA | HA3 | 111.1° | 109.4° |
C | CA | HA2 | 111.1° | 109.4° |
CA | C | O | 120.0° | 119.9° |
CA | C | OXT | 118.3° | 120.1° |
HA3 | CA | HA2 | 99.3° | 109.5° |
O | C | OXT | 121.7° | 120.0° |
C | OXT | HXT | 118.2° | 120.0° |
CG1 | CN | CG2 | 110.9° | 109.4° |
CG1 | CN | HCN | 108.0° | 109.5° |
CN | CG1 | HG11 | 110.9° | 109.5° |
CN | CG1 | HG12 | 111.7° | 109.5° |
CN | CG1 | HG13 | 111.7° | 109.5° |
CG2 | CN | HCN | 108.1° | 109.5° |
CN | CG2 | HG21 | 110.7° | 109.4° |
CN | CG2 | HG22 | 111.7° | 109.5° |
CN | CG2 | HG23 | 111.7° | 109.4° |
HG11 | CG1 | HG12 | 111.6° | 109.4° |
HG11 | CG1 | HG13 | 111.7° | 109.5° |
HG12 | CG1 | HG13 | 98.7° | 109.4° |
HG21 | CG2 | HG22 | 111.8° | 109.5° |
HG21 | CG2 | HG23 | 111.8° | 109.5° |
HG22 | CG2 | HG23 | 98.7° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CA | N | CN | H | 125.3° | 113.8° |
N | CA | C | HA3 | 125.2° | 120.0° |
N | CA | C | HA2 | 125.2° | 120.0° |
N | CA | HA3 | HA2 | 117.0° | 120.0° |
N | CA | C | O | 14.9° | 0.1° |
N | CA | C | OXT | 164.2° | 180.0° |
CA | N | CN | CG1 | 63.6° | 150.0° |
CA | N | CN | CG2 | 60.0° | 90.0° |
CA | N | CN | HCN | 178.3° | 30.0° |
CN | N | CA | C | 115.4° | 180.0° |
CN | N | CA | HA3 | 119.4° | 60.0° |
CN | N | CA | HA2 | 9.8° | 60.0° |
N | CN | CG1 | CG2 | 123.5° | 120.0° |
N | CN | CG1 | HCN | 118.3° | 120.0° |
N | CN | CG2 | HCN | 118.3° | 120.0° |
N | CN | CG1 | HG11 | 180.0° | 180.0° |
N | CN | CG1 | HG12 | 54.8° | 60.0° |
N | CN | CG1 | HG13 | 54.7° | 60.0° |
N | CN | CG2 | HG21 | 180.0° | 60.0° |
N | CN | CG2 | HG22 | 54.8° | 60.0° |
N | CN | CG2 | HG23 | 54.8° | 180.0° |
H | N | CA | C | 9.9° | 66.2° |
H | N | CA | HA3 | 115.3° | 173.8° |
H | N | CA | HA2 | 135.1° | 53.8° |
H | N | CN | CG1 | 61.7° | 96.2° |
H | N | CN | CG2 | 174.7° | 23.8° |
H | N | CN | HCN | 56.5° | 143.8° |
C | CA | HA3 | HA2 | 117.0° | 119.9° |
CA | C | O | OXT | 179.1° | 179.9° |
CA | C | OXT | HXT | 180.0° | 180.0° |
HA3 | CA | C | O | 140.1° | 120.0° |
HA3 | CA | C | OXT | 39.0° | 59.9° |
HA2 | CA | C | O | 110.3° | 120.1° |
HA2 | CA | C | OXT | 70.5° | 60.0° |
O | C | OXT | HXT | 0.9° | 0.1° |
CG1 | CN | CG2 | HCN | 118.2° | 120.0° |
CN | CG1 | HG11 | HG12 | 125.2° | 120.0° |
CN | CG1 | HG11 | HG13 | 125.3° | 120.1° |
CN | CG1 | HG12 | HG13 | 117.6° | 120.0° |
CG1 | CN | CG2 | HG21 | 56.5° | 60.0° |
CG1 | CN | CG2 | HG22 | 68.7° | 180.0° |
CG1 | CN | CG2 | HG23 | 178.3° | 60.0° |
CG2 | CN | CG1 | HG11 | 56.6° | 60.0° |
CG2 | CN | CG1 | HG12 | 178.2° | 180.0° |
CG2 | CN | CG1 | HG13 | 68.8° | 60.1° |
CN | CG2 | HG21 | HG22 | 125.2° | 120.0° |
CN | CG2 | HG21 | HG23 | 125.2° | 119.9° |
CN | CG2 | HG22 | HG23 | 117.6° | 120.0° |
HCN | CN | CG1 | HG11 | 61.7° | 60.0° |
HCN | CN | CG1 | HG12 | 63.5° | 60.0° |
HCN | CN | CG1 | HG13 | 173.0° | 180.0° |
HCN | CN | CG2 | HG21 | 61.7° | 179.9° |
HCN | CN | CG2 | HG22 | 173.1° | 60.1° |
HCN | CN | CG2 | HG23 | 63.6° | 60.0° |
HG11 | CG1 | HG12 | HG13 | 117.6° | 120.0° |
HG21 | CG2 | HG22 | HG23 | 117.7° | 120.0° |