AS2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C | doub | 1.21Å | 1.22Å | |
| C | OXT | sing | 1.34Å | 1.25Å | |
| C | CA | sing | 1.51Å | 1.54Å | |
| CA | N | sing | 1.47Å | 1.49Å | |
| CA | CB | sing | 1.53Å | 1.54Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| N | HN | sing | 1.01Å | 1.00Å | |
| N | HNA | sing | 1.01Å | 1.00Å | |
| CB | CG | sing | 1.51Å | 1.54Å | |
| CB | HB | sing | 1.09Å | 1.10Å | |
| CB | HBA | sing | 1.09Å | 1.10Å | |
| CG | OD2 | doub | 1.21Å | 1.24Å | |
| CG | HG | sing | 1.08Å | 1.08Å | |
| OXT | H7 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | OXT | 118.5° | 120.0° |
| O | C | CA | 116.4° | 120.0° |
| OXT | C | CA | 125.0° | 120.0° |
| C | OXT | H7 | 109.5° | 117.0° |
| C | CA | N | 107.4° | 109.5° |
| C | CA | CB | 113.8° | 109.5° |
| C | CA | HA | 108.7° | 109.4° |
| N | CA | CB | 111.5° | 109.5° |
| N | CA | HA | 111.1° | 109.5° |
| CA | N | HN | 109.5° | 111.1° |
| CA | N | HNA | 109.4° | 111.0° |
| CB | CA | HA | 104.4° | 109.5° |
| CA | CB | CG | 113.5° | 109.5° |
| CA | CB | HB | 108.2° | 109.5° |
| CA | CB | HBA | 107.2° | 109.5° |
| HN | N | HNA | 109.5° | 111.0° |
| CG | CB | HB | 108.2° | 109.5° |
| CG | CB | HBA | 107.2° | 109.5° |
| CB | CG | OD2 | 121.2° | 119.9° |
| CB | CG | HG | 119.4° | 120.0° |
| HB | CB | HBA | 112.7° | 109.4° |
| OD2 | CG | HG | 119.4° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | OXT | CA | 179.8° | 179.7° |
| O | C | CA | N | 78.3° | 20.0° |
| O | C | CA | CB | 157.9° | 100.0° |
| O | C | CA | HA | 42.0° | 140.0° |
| O | C | OXT | H7 | 0.0° | 0.0° |
| OXT | C | CA | N | 101.5° | 160.3° |
| OXT | C | CA | CB | 22.3° | 79.7° |
| OXT | C | CA | HA | 138.2° | 40.2° |
| C | CA | N | CB | 125.3° | 120.0° |
| C | CA | N | HA | 118.8° | 120.0° |
| C | CA | CB | HA | 118.4° | 119.9° |
| C | CA | N | HN | 63.1° | 176.0° |
| C | CA | N | HNA | 56.9° | 60.0° |
| C | CA | CB | CG | 127.9° | 175.0° |
| C | CA | CB | HB | 112.1° | 55.0° |
| C | CA | CB | HBA | 9.7° | 65.0° |
| CA | C | OXT | H7 | 179.8° | 179.7° |
| N | CA | CB | HA | 120.0° | 120.0° |
| CA | N | HN | HNA | 120.0° | 124.0° |
| N | CA | CB | CG | 6.3° | 65.0° |
| N | CA | CB | HB | 126.3° | 175.0° |
| N | CA | CB | HBA | 111.9° | 55.1° |
| CB | CA | N | HN | 62.1° | 64.0° |
| CB | CA | N | HNA | 177.9° | 60.0° |
| CA | CB | CG | HB | 120.0° | 120.0° |
| CA | CB | CG | HBA | 118.2° | 120.0° |
| CA | CB | HB | HBA | 118.4° | 120.0° |
| CA | CB | CG | OD2 | 43.5° | 125.0° |
| CA | CB | CG | HG | 136.5° | 55.0° |
| HA | CA | N | HN | 178.1° | 56.1° |
| HA | CA | N | HNA | 61.9° | 180.0° |
| HA | CA | CB | CG | 113.7° | 55.1° |
| HA | CA | CB | HB | 6.3° | 64.9° |
| HA | CA | CB | HBA | 128.0° | 175.1° |
| CG | CB | HB | HBA | 118.4° | 120.0° |
| CB | CG | OD2 | HG | 180.0° | 180.0° |
| HB | CB | CG | OD2 | 76.5° | 5.0° |
| HB | CB | CG | HG | 103.5° | 175.0° |
| HBA | CB | CG | OD2 | 161.7° | 115.0° |
| HBA | CB | CG | HG | 18.3° | 65.0° |
