RGI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | N | sing | 1.47Å | 1.47Å | |
| C1 | H1C1 | sing | 1.09Å | 1.10Å | |
| C1 | HA2 | sing | 1.09Å | 1.10Å | |
| C1 | HB3 | sing | 1.09Å | 1.10Å | |
| C | O | doub | 1.22Å | 1.24Å | |
| C | N | sing | 1.35Å | 1.34Å | |
| C | OXT | sing | 1.35Å | 1.34Å | |
| N | H | sing | 0.97Å | 1.00Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N | C1 | H1C1 | 109.5° | 109.5° |
| N | C1 | HA2 | 109.5° | 109.5° |
| N | C1 | HB3 | 109.5° | 109.5° |
| C1 | N | C | 118.0° | 120.0° |
| C1 | N | H | 121.0° | 120.0° |
| H1C1 | C1 | HA2 | 109.5° | 109.5° |
| H1C1 | C1 | HB3 | 109.5° | 109.4° |
| HA2 | C1 | HB3 | 109.5° | 109.4° |
| O | C | N | 122.0° | 120.0° |
| O | C | OXT | 121.7° | 120.0° |
| N | C | OXT | 116.2° | 120.0° |
| C | N | H | 121.0° | 120.1° |
| C | OXT | HXT | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N | C1 | H1C1 | HA2 | 120.0° | 120.1° |
| N | C1 | H1C1 | HB3 | 120.0° | 120.0° |
| N | C1 | HA2 | HB3 | 120.0° | 120.0° |
| C1 | N | C | O | 3.3° | 0.0° |
| C1 | N | C | H | 180.0° | 180.0° |
| C1 | N | C | OXT | 179.7° | 180.0° |
| H1C1 | C1 | HA2 | HB3 | 120.0° | 120.0° |
| H1C1 | C1 | N | C | 180.0° | 60.0° |
| H1C1 | C1 | N | H | 0.0° | 120.0° |
| HA2 | C1 | N | C | 60.0° | 60.0° |
| HA2 | C1 | N | H | 119.9° | 120.0° |
| HB3 | C1 | N | C | 60.0° | 180.0° |
| HB3 | C1 | N | H | 120.1° | 0.0° |
| O | C | N | OXT | 176.4° | 180.0° |
| O | C | N | H | 176.8° | 180.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| N | C | OXT | HXT | 176.4° | 180.0° |
| OXT | C | N | H | 0.4° | 0.0° |
