2CO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.44Å | 1.45Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CA | C | sing | 1.52Å | 1.49Å | |
| CA | CB | sing | 1.53Å | 1.54Å | |
| CA | HA | sing | 1.10Å | 1.10Å | |
| C | O | doub | 1.23Å | 1.22Å | |
| C | OXT | sing | 1.35Å | 49.72Å | |
| CB | SG | sing | 1.82Å | 1.87Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| CB | HB3 | sing | 1.10Å | 1.10Å | |
| SG | OD | sing | 1.66Å | 1.50Å | |
| OD | OE | sing | 1.45Å | 1.49Å | |
| OE | HE | sing | 0.97Å | 0.95Å | |
| OXT | HXT | sing | 0.98Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | H | 109.5° | 119.0° |
| CA | N | H2 | 109.5° | 119.0° |
| N | CA | C | 102.0° | 111.9° |
| N | CA | CB | 114.5° | 112.0° |
| N | CA | HA | 111.9° | 105.2° |
| H | N | H2 | 109.5° | 120.6° |
| C | CA | CB | 111.3° | 112.4° |
| C | CA | HA | 115.1° | 106.0° |
| CA | C | O | 121.0° | 123.7° |
| CA | C | OXT | 118.3° | 113.3° |
| CB | CA | HA | 102.7° | 108.8° |
| CA | CB | SG | 110.6° | 113.7° |
| CA | CB | HB2 | 109.1° | 109.9° |
| CA | CB | HB3 | 108.9° | 110.5° |
| O | C | OXT | 44.5° | 123.0° |
| C | OXT | HXT | 90.0° | 111.9° |
| SG | CB | HB2 | 109.1° | 107.3° |
| SG | CB | HB3 | 108.9° | 107.6° |
| CB | SG | OD | 101.0° | 97.9° |
| HB2 | CB | HB3 | 110.3° | 107.6° |
| SG | OD | OE | 125.3° | 110.5° |
| OD | OE | HE | 109.5° | 95.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 120.0° | 166.5° |
| N | CA | C | CB | 122.5° | 127.1° |
| N | CA | C | HA | 121.3° | 114.2° |
| N | CA | CB | HA | 121.5° | 115.9° |
| N | CA | C | O | 98.8° | 5.9° |
| N | CA | C | OXT | 47.2° | 174.9° |
| N | CA | CB | SG | 153.7° | 67.3° |
| N | CA | CB | HB2 | 33.7° | 53.0° |
| N | CA | CB | HB3 | 86.8° | 171.6° |
| H | N | CA | C | 63.3° | 13.0° |
| H | N | CA | CB | 176.5° | 114.3° |
| H | N | CA | HA | 60.2° | 127.7° |
| H2 | N | CA | C | 56.7° | 153.7° |
| H2 | N | CA | CB | 63.5° | 79.0° |
| H2 | N | CA | HA | 179.8° | 39.0° |
| C | CA | CB | HA | 123.6° | 117.1° |
| CA | C | O | OXT | 100.2° | 179.1° |
| C | CA | CB | SG | 91.4° | 59.7° |
| C | CA | CB | HB2 | 148.6° | 180.0° |
| C | CA | CB | HB3 | 28.2° | 61.4° |
| CA | C | OXT | HXT | 90.0° | 179.2° |
| CB | CA | C | O | 138.8° | 121.2° |
| CB | CA | C | OXT | 169.6° | 58.0° |
| CA | CB | SG | HB2 | 120.0° | 121.7° |
| CA | CB | SG | HB3 | 119.6° | 122.7° |
| CA | CB | HB2 | HB3 | 119.6° | 120.3° |
| CA | CB | SG | OD | 76.4° | 180.0° |
| HA | CA | C | O | 22.6° | 120.1° |
| HA | CA | C | OXT | 74.2° | 60.7° |
| HA | CA | CB | SG | 32.2° | 176.8° |
| HA | CA | CB | HB2 | 87.8° | 62.9° |
| HA | CA | CB | HB3 | 151.8° | 55.7° |
| O | C | OXT | HXT | 90.0° | 0.0° |
| SG | CB | HB2 | HB3 | 119.6° | 115.5° |
| CB | SG | OD | OE | 13.9° | 60.0° |
| HB2 | CB | SG | OD | 43.6° | 58.3° |
| HB3 | CB | SG | OD | 164.0° | 57.3° |
| SG | OD | OE | HE | 104.3° | 92.3° |
