Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.46Å | |
| N | HN1 | sing | 1.01Å | 1.02Å | |
| N | HN2 | sing | 1.01Å | 1.02Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CA | C | sing | 1.51Å | 1.53Å | |
| CA | HA | sing | 1.09Å | 1.12Å | |
| CB | SD | sing | 1.81Å | 1.81Å | |
| CB | HB1 | sing | 1.09Å | 1.11Å | |
| CB | HB2 | sing | 1.09Å | 1.11Å | |
| CG | SD | sing | 1.81Å | 1.80Å | |
| CG | CE | sing | 1.51Å | 1.51Å | |
| CG | HG1 | sing | 1.09Å | 1.11Å | |
| CG | HG2 | sing | 1.09Å | 1.11Å | |
| CE | OF1 | doub | 1.21Å | 1.25Å | |
| CE | OF2 | sing | 1.34Å | 1.25Å | |
| C | O | doub | 1.21Å | 1.23Å | |
| C | OXT | sing | 1.34Å | 1.33Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å | |
| OF2 | HF2 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | HN1 | 110.4° | 106.7° |
| CA | N | HN2 | 111.9° | 106.6° |
| N | CA | CB | 110.4° | 109.5° |
| N | CA | C | 107.7° | 109.4° |
| N | CA | HA | 110.1° | 109.4° |
| HN1 | N | HN2 | 111.8° | 106.7° |
| CB | CA | C | 109.7° | 109.6° |
| CB | CA | HA | 108.1° | 109.4° |
| CA | CB | SD | 113.2° | 109.6° |
| CA | CB | HB1 | 110.8° | 109.4° |
| CA | CB | HB2 | 110.8° | 109.5° |
| C | CA | HA | 110.8° | 109.4° |
| CA | C | O | 120.8° | 120.0° |
| CA | C | OXT | 116.4° | 120.0° |
| SD | CB | HB1 | 110.9° | 109.4° |
| SD | CB | HB2 | 110.9° | 109.5° |
| CB | SD | CG | 100.5° | 100.1° |
| HB1 | CB | HB2 | 99.5° | 109.4° |
| SD | CG | CE | 114.6° | 109.5° |
| SD | CG | HG1 | 110.3° | 109.4° |
| SD | CG | HG2 | 110.3° | 109.5° |
| CE | CG | HG1 | 110.3° | 109.5° |
| CE | CG | HG2 | 110.3° | 109.5° |
| CG | CE | OF1 | 118.4° | 120.0° |
| CG | CE | OF2 | 118.6° | 120.0° |
| HG1 | CG | HG2 | 100.0° | 109.4° |
| OF1 | CE | OF2 | 123.0° | 120.0° |
| CE | OF2 | HF2 | 118.6° | 119.9° |
| O | C | OXT | 122.8° | 120.0° |
| C | OXT | HXT | 116.5° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | HN1 | HN2 | 125.2° | 113.7° |
| N | CA | CB | C | 118.6° | 120.0° |
| N | CA | CB | HA | 120.5° | 120.0° |
| N | CA | C | HA | 120.5° | 119.9° |
| N | CA | CB | SD | 146.1° | 59.9° |
| N | CA | CB | HB1 | 20.8° | 60.0° |
| N | CA | CB | HB2 | 88.7° | 180.0° |
| N | CA | C | O | 73.5° | 30.1° |
| N | CA | C | OXT | 105.8° | 150.0° |
| HN1 | N | CA | CB | 180.0° | 53.7° |
| HN1 | N | CA | C | 60.2° | 173.9° |
| HN1 | N | CA | HA | 60.7° | 66.2° |
| HN2 | N | CA | CB | 54.8° | 60.0° |
| HN2 | N | CA | C | 174.6° | 60.1° |
| HN2 | N | CA | HA | 64.5° | 180.0° |
| CB | CA | C | HA | 119.3° | 120.0° |
| CA | CB | SD | HB1 | 125.2° | 120.0° |
| CA | CB | SD | HB2 | 125.2° | 120.1° |
| CA | CB | HB1 | HB2 | 116.7° | 120.0° |
| CA | CB | SD | CG | 114.8° | 180.0° |
| CB | CA | C | O | 46.7° | 90.0° |
| CB | CA | C | OXT | 134.0° | 89.9° |
| C | CA | CB | SD | 95.3° | 180.0° |
| C | CA | CB | HB1 | 139.4° | 60.0° |
| C | CA | CB | HB2 | 29.9° | 59.9° |
| CA | C | O | OXT | 179.2° | 179.9° |
| CA | C | OXT | HXT | 180.0° | 179.9° |
| HA | CA | CB | SD | 25.6° | 60.0° |
| HA | CA | CB | HB1 | 99.7° | 180.0° |
| HA | CA | CB | HB2 | 150.8° | 60.1° |
| HA | CA | C | O | 166.0° | 150.0° |
| HA | CA | C | OXT | 14.7° | 30.1° |
| SD | CB | HB1 | HB2 | 116.8° | 120.0° |
| CB | SD | CG | CE | 87.1° | 180.0° |
| CB | SD | CG | HG1 | 38.2° | 60.0° |
| CB | SD | CG | HG2 | 147.7° | 59.9° |
| HB1 | CB | SD | CG | 10.5° | 60.0° |
| HB2 | CB | SD | CG | 120.0° | 59.9° |
| SD | CG | CE | HG1 | 125.2° | 119.9° |
| SD | CG | CE | HG2 | 125.2° | 120.0° |
| SD | CG | HG1 | HG2 | 116.2° | 119.9° |
| SD | CG | CE | OF1 | 178.4° | 0.0° |
| SD | CG | CE | OF2 | 1.2° | 180.0° |
| CE | CG | HG1 | HG2 | 116.2° | 120.1° |
| CG | CE | OF1 | OF2 | 179.6° | 179.9° |
| CG | CE | OF2 | HF2 | 180.0° | 180.0° |
| HG1 | CG | CE | OF1 | 56.4° | 119.9° |
| HG1 | CG | CE | OF2 | 124.0° | 60.0° |
| HG2 | CG | CE | OF1 | 53.2° | 120.1° |
| HG2 | CG | CE | OF2 | 126.5° | 60.0° |
| OF1 | CE | OF2 | HF2 | 0.4° | 0.1° |
| O | C | OXT | HXT | 0.7° | 0.0° |
