MVA
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N | CN | sing | 1.47Å | 1.48Å | |
N | CA | sing | 1.47Å | 1.46Å | |
N | H | sing | 1.01Å | 1.00Å | |
CN | HN1 | sing | 1.09Å | 1.10Å | |
CN | HN2 | sing | 1.09Å | 1.10Å | |
CN | HN3 | sing | 1.09Å | 1.10Å | |
CA | CB | sing | 1.53Å | 1.59Å | |
CA | C | sing | 1.51Å | 1.54Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
CB | CG1 | sing | 1.53Å | 1.52Å | |
CB | CG2 | sing | 1.53Å | 1.54Å | |
CB | HB | sing | 1.09Å | 1.10Å | |
CG1 | HG11 | sing | 1.09Å | 1.10Å | |
CG1 | HG12 | sing | 1.09Å | 1.10Å | |
CG1 | HG13 | sing | 1.09Å | 1.10Å | |
CG2 | HG21 | sing | 1.09Å | 1.10Å | |
CG2 | HG22 | sing | 1.09Å | 1.10Å | |
CG2 | HG23 | sing | 1.09Å | 1.10Å | |
C | O | doub | 1.21Å | 1.24Å | |
C | OXT | sing | 1.34Å | 39.85Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CN | N | CA | 119.8° | 111.0° |
CN | N | H | 106.1° | 111.0° |
N | CN | HN1 | 109.5° | 109.5° |
N | CN | HN2 | 109.5° | 109.5° |
N | CN | HN3 | 109.4° | 109.4° |
CA | N | H | 106.2° | 111.0° |
N | CA | CB | 111.6° | 109.5° |
N | CA | C | 106.2° | 109.5° |
N | CA | HA | 111.2° | 109.5° |
HN1 | CN | HN2 | 109.4° | 109.5° |
HN1 | CN | HN3 | 109.5° | 109.5° |
HN2 | CN | HN3 | 109.5° | 109.5° |
CB | CA | C | 112.0° | 109.5° |
CB | CA | HA | 105.2° | 109.5° |
CA | CB | CG1 | 111.0° | 109.5° |
CA | CB | CG2 | 111.1° | 109.5° |
CA | CB | HB | 105.6° | 109.5° |
C | CA | HA | 110.7° | 109.5° |
CA | C | O | 119.0° | 120.0° |
CA | C | OXT | 105.5° | 120.0° |
CG1 | CB | CG2 | 103.5° | 109.5° |
CG1 | CB | HB | 113.0° | 109.5° |
CB | CG1 | HG11 | 109.5° | 109.4° |
CB | CG1 | HG12 | 109.5° | 109.5° |
CB | CG1 | HG13 | 109.5° | 109.5° |
CG2 | CB | HB | 112.9° | 109.5° |
CB | CG2 | HG21 | 109.5° | 109.5° |
CB | CG2 | HG22 | 109.5° | 109.5° |
CB | CG2 | HG23 | 109.5° | 109.5° |
HG11 | CG1 | HG12 | 109.5° | 109.5° |
HG11 | CG1 | HG13 | 109.4° | 109.5° |
HG12 | CG1 | HG13 | 109.5° | 109.5° |
HG21 | CG2 | HG22 | 109.5° | 109.4° |
HG21 | CG2 | HG23 | 109.5° | 109.5° |
HG22 | CG2 | HG23 | 109.5° | 109.5° |
O | C | OXT | 47.0° | 120.0° |
C | OXT | HXT | 105.5° | 117.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CN | N | CA | H | 120.0° | 123.9° |
N | CN | HN1 | HN2 | 120.0° | 120.0° |
N | CN | HN1 | HN3 | 120.0° | 120.0° |
N | CN | HN2 | HN3 | 120.0° | 120.0° |
CN | N | CA | CB | 55.5° | 154.6° |
CN | N | CA | C | 66.9° | 85.4° |
CN | N | CA | HA | 172.7° | 34.6° |
CA | N | CN | HN1 | 180.0° | 64.5° |
CA | N | CN | HN2 | 60.0° | 55.5° |
CA | N | CN | HN3 | 60.0° | 175.5° |
N | CA | CB | C | 118.9° | 120.0° |
N | CA | CB | HA | 120.7° | 120.0° |
N | CA | C | HA | 120.8° | 120.0° |
N | CA | CB | CG1 | 170.1° | 180.0° |
N | CA | CB | CG2 | 55.6° | 60.0° |
N | CA | CB | HB | 67.1° | 60.0° |
N | CA | C | O | 93.0° | 27.2° |
N | CA | C | OXT | 44.1° | 152.8° |
H | N | CN | HN1 | 60.0° | 59.5° |
H | N | CN | HN2 | 60.0° | 179.5° |
H | N | CN | HN3 | 180.0° | 60.5° |
H | N | CA | CB | 175.5° | 30.7° |
H | N | CA | C | 53.1° | 150.7° |
H | N | CA | HA | 67.3° | 89.3° |
HN1 | CN | HN2 | HN3 | 120.0° | 120.0° |
CB | CA | C | HA | 117.1° | 120.0° |
CA | CB | CG1 | CG2 | 119.3° | 120.0° |
CA | CB | CG1 | HB | 118.4° | 120.0° |
CA | CB | CG2 | HB | 118.3° | 120.0° |
CA | CB | CG1 | HG11 | 180.0° | 180.0° |
CA | CB | CG1 | HG12 | 60.0° | 60.0° |
CA | CB | CG1 | HG13 | 60.0° | 60.0° |
CA | CB | CG2 | HG21 | 180.0° | 60.0° |
CA | CB | CG2 | HG22 | 60.0° | 180.0° |
CA | CB | CG2 | HG23 | 60.0° | 60.0° |
CB | CA | C | O | 29.0° | 92.8° |
CB | CA | C | OXT | 78.0° | 87.2° |
C | CA | CB | CG1 | 70.9° | 60.0° |
C | CA | CB | CG2 | 174.5° | 180.0° |
C | CA | CB | HB | 51.8° | 60.0° |
CA | C | O | OXT | 84.3° | 180.0° |
CA | C | OXT | HXT | 180.0° | 180.0° |
HA | CA | CB | CG1 | 49.4° | 60.0° |
HA | CA | CB | CG2 | 65.2° | 60.0° |
HA | CA | CB | HB | 172.2° | 180.0° |
HA | CA | C | O | 146.2° | 147.2° |
HA | CA | C | OXT | 164.9° | 32.8° |
CG1 | CB | CG2 | HB | 122.5° | 120.0° |
CB | CG1 | HG11 | HG12 | 120.0° | 120.0° |
CB | CG1 | HG11 | HG13 | 120.0° | 119.9° |
CB | CG1 | HG12 | HG13 | 120.0° | 120.0° |
CG1 | CB | CG2 | HG21 | 60.8° | 180.0° |
CG1 | CB | CG2 | HG22 | 59.2° | 60.0° |
CG1 | CB | CG2 | HG23 | 179.2° | 60.0° |
CG2 | CB | CG1 | HG11 | 60.7° | 60.0° |
CG2 | CB | CG1 | HG12 | 179.3° | 180.0° |
CG2 | CB | CG1 | HG13 | 59.2° | 60.0° |
CB | CG2 | HG21 | HG22 | 120.0° | 120.0° |
CB | CG2 | HG21 | HG23 | 120.0° | 120.0° |
CB | CG2 | HG22 | HG23 | 120.0° | 120.0° |
HB | CB | CG1 | HG11 | 61.7° | 60.1° |
HB | CB | CG1 | HG12 | 58.4° | 60.0° |
HB | CB | CG1 | HG13 | 178.4° | 180.0° |
HB | CB | CG2 | HG21 | 61.7° | 60.0° |
HB | CB | CG2 | HG22 | 178.3° | 60.0° |
HB | CB | CG2 | HG23 | 58.4° | 180.0° |
HG11 | CG1 | HG12 | HG13 | 120.0° | 120.0° |
HG21 | CG2 | HG22 | HG23 | 120.0° | 119.9° |
O | C | OXT | HXT | 64.5° | 0.1° |