AS7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | O | doub | 1.21Å | 1.22Å | |
| C | CA | sing | 1.51Å | 1.50Å | |
| C | OXT | sing | 1.34Å | 1.33Å | |
| N | CA | sing | 1.47Å | 1.44Å | |
| C1 | C2 | sing | 1.51Å | 1.51Å | |
| C1 | ND2 | sing | 1.46Å | 1.46Å | |
| C2 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
| C2 | C7 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | C5 | doub | 1.40Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.40Å | 1.39Å | Aromatic |
| C5 | C8 | sing | 1.43Å | 1.29Å | |
| C6 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| C8 | N9 | trip | 1.14Å | 1.16Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CB | CG | sing | 1.51Å | 1.51Å | |
| CG | OD1 | doub | 1.21Å | 1.22Å | |
| CG | ND2 | sing | 1.35Å | 1.33Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | HB | sing | 1.09Å | 1.10Å | |
| CB | HBA | sing | 1.09Å | 1.10Å | |
| ND2 | HND2 | 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) |
| O | C | CA | 120.5° | 119.9° |
| O | C | OXT | 123.7° | 120.0° |
| CA | C | OXT | 115.7° | 120.0° |
| C | CA | N | 111.2° | 109.5° |
| C | CA | CB | 109.3° | 109.4° |
| C | CA | HA | 109.9° | 109.5° |
| C | OXT | HXT | 109.5° | 117.0° |
| N | CA | CB | 113.6° | 109.5° |
| CA | N | H | 109.5° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| N | CA | HA | 105.2° | 109.5° |
| C2 | C1 | ND2 | 111.4° | 109.5° |
| C1 | C2 | C3 | 118.9° | 119.8° |
| C1 | C2 | C7 | 121.0° | 119.8° |
| C2 | C1 | H1 | 108.8° | 109.5° |
| C2 | C1 | H1A | 108.8° | 109.5° |
| C1 | ND2 | CG | 124.9° | 120.0° |
| ND2 | C1 | H1 | 108.8° | 109.5° |
| ND2 | C1 | H1A | 108.8° | 109.5° |
| C1 | ND2 | HND2 | 117.5° | 120.0° |
| C3 | C2 | C7 | 120.1° | 120.3° |
| C2 | C3 | C4 | 120.2° | 120.1° |
| C2 | C3 | H3 | 119.9° | 119.9° |
| C2 | C7 | C6 | 119.7° | 120.1° |
| C2 | C7 | H7 | 120.2° | 119.9° |
| C3 | C4 | C5 | 119.7° | 119.9° |
| C4 | C3 | H3 | 119.9° | 120.0° |
| C3 | C4 | H4 | 120.2° | 120.1° |
| C4 | C5 | C6 | 120.1° | 119.7° |
| C4 | C5 | C8 | 119.7° | 120.1° |
| C5 | C4 | H4 | 120.2° | 120.1° |
| C6 | C5 | C8 | 120.3° | 120.1° |
| C5 | C6 | C7 | 120.3° | 119.9° |
| C5 | C6 | H6 | 119.8° | 120.1° |
| C5 | C8 | N9 | 179.8° | 180.0° |
| C7 | C6 | H6 | 119.8° | 120.0° |
| C6 | C7 | H7 | 120.2° | 120.0° |
| CA | CB | CG | 116.6° | 109.4° |
| CB | CA | HA | 107.3° | 109.5° |
| CA | CB | HB | 107.2° | 109.5° |
| CA | CB | HBA | 107.2° | 109.5° |
| CB | CG | OD1 | 122.0° | 120.0° |
| CB | CG | ND2 | 116.2° | 120.0° |
| CG | CB | HB | 107.2° | 109.4° |
| CG | CB | HBA | 107.1° | 109.5° |
| OD1 | CG | ND2 | 121.7° | 120.1° |
| CG | ND2 | HND2 | 117.6° | 120.0° |
| H | N | H2 | 109.4° | 111.0° |
| H1 | C1 | H1A | 110.1° | 109.4° |
| HB | CB | HBA | 111.7° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | CA | OXT | 179.0° | 179.8° |
| O | C | CA | N | 22.7° | 20.0° |
| O | C | CA | CB | 103.6° | 100.0° |
| O | C | CA | HA | 138.9° | 140.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| C | CA | N | CB | 123.9° | 120.0° |
| C | CA | N | HA | 119.0° | 120.0° |
| C | CA | CB | HA | 119.2° | 120.0° |
| C | CA | CB | CG | 101.0° | 175.0° |
| C | CA | N | H | 180.0° | 60.0° |
| C | CA | N | H2 | 60.0° | 176.1° |
| C | CA | CB | HB | 19.0° | 65.1° |
| C | CA | CB | HBA | 139.0° | 55.0° |
| CA | C | OXT | HXT | 179.0° | 179.7° |
| OXT | C | CA | N | 156.3° | 160.3° |
| OXT | C | CA | CB | 77.4° | 79.7° |
| OXT | C | CA | HA | 40.1° | 40.3° |
| N | CA | CB | HA | 115.9° | 120.0° |
| N | CA | CB | CG | 23.9° | 65.0° |
| CA | N | H | H2 | 120.0° | 124.0° |
| N | CA | CB | HB | 143.9° | 55.0° |
| N | CA | CB | HBA | 96.1° | 175.0° |
| C2 | C1 | ND2 | H1 | 120.0° | 120.0° |
| C2 | C1 | ND2 | H1A | 120.0° | 120.0° |
| C1 | C2 | C3 | C7 | 179.5° | 179.7° |
| C1 | C2 | C3 | C4 | 179.6° | 180.0° |
| C1 | C2 | C7 | C6 | 179.7° | 179.7° |
| C2 | C1 | ND2 | CG | 90.6° | 179.9° |
| C2 | C1 | H1 | H1A | 119.2° | 120.0° |
| C1 | C2 | C3 | H3 | 0.4° | 0.0° |
| C1 | C2 | C7 | H7 | 0.3° | 0.0° |
| C2 | C1 | ND2 | HND2 | 89.3° | 0.1° |
| ND2 | C1 | C2 | C3 | 170.2° | 90.0° |
| ND2 | C1 | C2 | C7 | 9.3° | 90.3° |
| C1 | ND2 | CG | CB | 178.8° | 180.0° |
| C1 | ND2 | CG | OD1 | 1.0° | 0.1° |
| C1 | ND2 | CG | HND2 | 180.0° | 179.9° |
| ND2 | C1 | H1 | H1A | 119.2° | 120.0° |
| C2 | C3 | C4 | H3 | 180.0° | 179.9° |
| C2 | C3 | C4 | C5 | 0.2° | 0.1° |
| C3 | C2 | C7 | C6 | 0.2° | 0.5° |
| C3 | C2 | C1 | H1 | 69.9° | 150.0° |
| C3 | C2 | C1 | H1A | 50.2° | 30.1° |
| C2 | C3 | C4 | H4 | 179.8° | 179.9° |
| C3 | C2 | C7 | H7 | 179.8° | 179.8° |
| C7 | C2 | C3 | C4 | 0.1° | 0.2° |
| C2 | C7 | C6 | C5 | 0.0° | 0.5° |
| C2 | C7 | C6 | H7 | 180.0° | 179.7° |
| C7 | C2 | C1 | H1 | 110.7° | 29.7° |
| C7 | C2 | C1 | H1A | 129.3° | 149.7° |
| C7 | C2 | C3 | H3 | 179.9° | 179.7° |
| C2 | C7 | C6 | H6 | 179.9° | 179.7° |
| C3 | C4 | C5 | H4 | 180.0° | 179.8° |
| C3 | C4 | C5 | C6 | 0.3° | 0.1° |
| C3 | C4 | C5 | C8 | 179.4° | 180.0° |
| C4 | C5 | C6 | C8 | 179.7° | 179.9° |
| C4 | C5 | C6 | C7 | 0.2° | 0.2° |
| C4 | C5 | C8 | N9 | 2.0° | 67.3° |
| C5 | C4 | C3 | H3 | 179.8° | 180.0° |
| C4 | C5 | C6 | H6 | 179.8° | 180.0° |
| C5 | C6 | C7 | H6 | 180.0° | 179.7° |
| C6 | C5 | C8 | N9 | 178.3° | 112.8° |
| C6 | C5 | C4 | H4 | 179.7° | 179.9° |
| C5 | C6 | C7 | H7 | 180.0° | 179.8° |
| C8 | C5 | C6 | C7 | 179.5° | 179.7° |
| C8 | C5 | C4 | H4 | 0.5° | 0.1° |
| C8 | C5 | C6 | H6 | 0.4° | 0.0° |
| CA | CB | CG | HB | 120.0° | 119.9° |
| CA | CB | CG | HBA | 120.0° | 120.0° |
| CA | CB | CG | OD1 | 57.9° | 0.1° |
| CA | CB | CG | ND2 | 122.3° | 180.0° |
| CB | CA | N | H | 56.1° | 60.0° |
| CB | CA | N | H2 | 176.1° | 64.0° |
| CA | CB | HB | HBA | 117.1° | 120.0° |
| CB | CG | OD1 | ND2 | 179.8° | 179.9° |
| CG | CB | CA | HA | 139.8° | 55.0° |
| CG | CB | HB | HBA | 117.0° | 120.1° |
| CB | CG | ND2 | HND2 | 1.2° | 0.1° |
| OD1 | CG | CB | HB | 62.1° | 120.0° |
| OD1 | CG | CB | HBA | 177.9° | 119.9° |
| OD1 | CG | ND2 | HND2 | 179.0° | 180.0° |
| CG | ND2 | C1 | H1 | 149.4° | 59.9° |
| CG | ND2 | C1 | H1A | 29.3° | 60.0° |
| ND2 | CG | CB | HB | 117.7° | 60.1° |
| ND2 | CG | CB | HBA | 2.3° | 60.0° |
| H | N | CA | HA | 61.0° | 180.0° |
| H2 | N | CA | HA | 59.0° | 56.0° |
| H1 | C1 | ND2 | HND2 | 30.7° | 120.0° |
| H1A | C1 | ND2 | HND2 | 150.7° | 120.1° |
| H3 | C3 | C4 | H4 | 0.1° | 0.1° |
| H6 | C6 | C7 | H7 | 0.1° | 0.0° |
| HA | CA | CB | HB | 100.2° | 175.0° |
| HA | CA | CB | HBA | 19.8° | 65.0° |
