Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CA | CB1 | sing | 1.53Å | 1.43Å | |
| CA | CB2 | sing | 1.53Å | 2.41Å | |
| CA | O | sing | 1.43Å | 2.31Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB1 | HB11 | sing | 1.09Å | 1.10Å | |
| CB1 | HB12 | sing | 1.09Å | 1.10Å | |
| CB1 | HB13 | sing | 1.09Å | 1.10Å | |
| CB2 | HB21 | sing | 1.09Å | 1.10Å | |
| CB2 | HB22 | sing | 1.09Å | 1.10Å | |
| CB2 | HB23 | sing | 1.09Å | 1.10Å | |
| O | H | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CB1 | CA | CB2 | 35.2° | 109.5° |
| CB1 | CA | O | 36.3° | 109.5° |
| CB1 | CA | HA | 168.1° | 109.4° |
| CA | CB1 | HB11 | 109.5° | 109.5° |
| CA | CB1 | HB12 | 109.5° | 109.5° |
| CA | CB1 | HB13 | 109.5° | 109.5° |
| CB2 | CA | O | 62.0° | 109.5° |
| CB2 | CA | HA | 148.5° | 109.5° |
| CA | CB2 | HB21 | 109.5° | 109.5° |
| CA | CB2 | HB22 | 109.5° | 109.4° |
| CA | CB2 | HB23 | 109.5° | 109.5° |
| O | CA | HA | 148.1° | 109.5° |
| CA | O | H | 109.5° | 114.0° |
| HB11 | CB1 | HB12 | 109.5° | 109.5° |
| HB11 | CB1 | HB13 | 109.4° | 109.5° |
| HB12 | CB1 | HB13 | 109.5° | 109.4° |
| HB21 | CB2 | HB22 | 109.4° | 109.5° |
| HB21 | CB2 | HB23 | 109.5° | 109.4° |
| HB22 | CB2 | HB23 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CB1 | CA | CB2 | O | 33.9° | 120.0° |
| CB1 | CA | CB2 | HA | 159.4° | 119.9° |
| CB1 | CA | O | HA | 160.2° | 119.9° |
| CA | CB1 | HB11 | HB12 | 120.0° | 120.0° |
| CA | CB1 | HB11 | HB13 | 120.0° | 120.0° |
| CA | CB1 | HB12 | HB13 | 120.0° | 120.0° |
| CB1 | CA | CB2 | HB21 | 180.0° | 60.0° |
| CB1 | CA | CB2 | HB22 | 60.0° | 180.0° |
| CB1 | CA | CB2 | HB23 | 60.0° | 59.9° |
| CB1 | CA | O | H | 180.0° | 59.9° |
| CB2 | CA | O | HA | 166.9° | 120.0° |
| CB2 | CA | CB1 | HB11 | 180.0° | 180.0° |
| CB2 | CA | CB1 | HB12 | 60.0° | 60.0° |
| CB2 | CA | CB1 | HB13 | 60.0° | 59.9° |
| CA | CB2 | HB21 | HB22 | 120.0° | 120.0° |
| CA | CB2 | HB21 | HB23 | 120.0° | 120.0° |
| CA | CB2 | HB22 | HB23 | 120.0° | 120.1° |
| CB2 | CA | O | H | 147.1° | 180.0° |
| O | CA | CB1 | HB11 | 56.3° | 60.0° |
| O | CA | CB1 | HB12 | 176.3° | 60.1° |
| O | CA | CB1 | HB13 | 63.7° | 180.0° |
| O | CA | CB2 | HB21 | 146.1° | 60.0° |
| O | CA | CB2 | HB22 | 26.1° | 59.9° |
| O | CA | CB2 | HB23 | 93.9° | 180.0° |
| HA | CA | CB1 | HB11 | 63.3° | 60.0° |
| HA | CA | CB1 | HB12 | 56.7° | 180.0° |
| HA | CA | CB1 | HB13 | 176.7° | 60.0° |
| HA | CA | CB2 | HB21 | 20.6° | 179.9° |
| HA | CA | CB2 | HB22 | 140.6° | 60.1° |
| HA | CA | CB2 | HB23 | 99.4° | 60.0° |
| HA | CA | O | H | 19.8° | 60.0° |
| HB11 | CB1 | HB12 | HB13 | 120.0° | 120.0° |
| HB21 | CB2 | HB22 | HB23 | 120.0° | 120.0° |
