C0O
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | C7 | doub | 1.21Å | 1.25Å | |
| N6 | C6 | sing | 1.47Å | 1.46Å | |
| C5 | C6 | sing | 1.51Å | 1.54Å | |
| C5 | C4 | doub | 1.31Å | 1.55Å | |
| C6 | C7 | sing | 1.51Å | 1.56Å | |
| C7 | O4 | sing | 1.34Å | 1.27Å | |
| C4 | C3 | sing | 1.51Å | 1.56Å | |
| C3 | CA | sing | 1.53Å | 1.56Å | |
| O | C | doub | 1.21Å | 1.17Å | |
| CA | C | sing | 1.51Å | 1.52Å | |
| CA | N | sing | 1.47Å | 1.48Å | |
| C | OXT | sing | 1.34Å | 1.45Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| C3 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| O4 | H7 | sing | 0.97Å | 0.95Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N6 | H11 | sing | 1.01Å | 1.00Å | |
| N6 | H12 | sing | 1.01Å | 1.00Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | C7 | C6 | 122.1° | 120.0° |
| O3 | C7 | O4 | 115.0° | 119.9° |
| N6 | C6 | C5 | 109.9° | 109.4° |
| N6 | C6 | C7 | 112.6° | 109.5° |
| N6 | C6 | H6 | 108.0° | 109.5° |
| C6 | N6 | H11 | 109.5° | 111.0° |
| C6 | N6 | H12 | 109.4° | 111.0° |
| C6 | C5 | C4 | 115.8° | 120.0° |
| C5 | C6 | C7 | 112.1° | 109.5° |
| C6 | C5 | H5 | 122.1° | 120.0° |
| C5 | C6 | H6 | 107.1° | 109.5° |
| C5 | C4 | C3 | 121.5° | 120.0° |
| C5 | C4 | H4 | 119.3° | 120.0° |
| C4 | C5 | H5 | 122.1° | 120.0° |
| C6 | C7 | O4 | 122.9° | 120.0° |
| C7 | C6 | H6 | 106.8° | 109.5° |
| C7 | O4 | H7 | 109.5° | 117.0° |
| C4 | C3 | CA | 115.2° | 109.5° |
| C4 | C3 | H1 | 108.0° | 109.4° |
| C4 | C3 | H3 | 108.0° | 109.5° |
| C3 | C4 | H4 | 119.2° | 120.0° |
| C3 | CA | C | 109.5° | 109.5° |
| C3 | CA | N | 120.6° | 109.5° |
| C3 | CA | HA | 105.3° | 109.4° |
| CA | C3 | H1 | 108.0° | 109.5° |
| CA | C3 | H3 | 108.0° | 109.5° |
| O | C | CA | 113.4° | 120.0° |
| O | C | OXT | 117.8° | 120.0° |
| C | CA | N | 108.4° | 109.5° |
| CA | C | OXT | 128.8° | 120.0° |
| C | CA | HA | 105.7° | 109.5° |
| N | CA | HA | 106.2° | 109.5° |
| CA | N | H2 | 109.5° | 111.0° |
| CA | N | H | 109.5° | 111.0° |
| C | OXT | HXT | 109.5° | 117.0° |
| H1 | C3 | H3 | 109.5° | 109.5° |
| H2 | N | H | 109.4° | 111.0° |
| H11 | N6 | H12 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C7 | C6 | N6 | 40.9° | 20.0° |
| O3 | C7 | C6 | C5 | 83.6° | 100.0° |
| O3 | C7 | C6 | O4 | 179.0° | 180.0° |
| O3 | C7 | C6 | H6 | 159.4° | 140.0° |
| O3 | C7 | O4 | H7 | 0.0° | 0.0° |
| N6 | C6 | C5 | C7 | 126.1° | 120.0° |
| N6 | C6 | C5 | H6 | 117.1° | 120.0° |
| N6 | C6 | C5 | C4 | 118.0° | 126.5° |
| N6 | C6 | C7 | H6 | 118.4° | 120.0° |
| N6 | C6 | C7 | O4 | 138.1° | 160.0° |
| N6 | C6 | C5 | H5 | 61.9° | 53.5° |
| C6 | N6 | H11 | H12 | 120.0° | 123.9° |
| C6 | C5 | C4 | H5 | 180.0° | 180.0° |
| C5 | C6 | C7 | H6 | 117.0° | 120.0° |
| C5 | C6 | C7 | O4 | 97.4° | 80.0° |
| C6 | C5 | C4 | C3 | 4.6° | 8.4° |
| C6 | C5 | C4 | H4 | 175.4° | 171.6° |
| C5 | C6 | N6 | H11 | 180.0° | 55.2° |
| C5 | C6 | N6 | H12 | 60.0° | 179.1° |
| C4 | C5 | C6 | C7 | 115.9° | 113.5° |
| C5 | C4 | C3 | H4 | 180.0° | 180.0° |
| C5 | C4 | C3 | CA | 78.5° | 127.4° |
| C5 | C4 | C3 | H1 | 160.6° | 7.4° |
| C5 | C4 | C3 | H3 | 42.3° | 112.6° |
| C4 | C5 | C6 | H6 | 1.0° | 6.5° |
| C7 | C6 | C5 | H5 | 64.2° | 66.5° |
| C6 | C7 | O4 | H7 | 179.0° | 180.0° |
| C7 | C6 | N6 | H11 | 54.2° | 64.8° |
| C7 | C6 | N6 | H12 | 174.2° | 59.1° |
| O4 | C7 | C6 | H6 | 19.6° | 40.0° |
| C4 | C3 | CA | H1 | 120.8° | 120.0° |
| C4 | C3 | CA | H3 | 120.8° | 120.0° |
| C4 | C3 | CA | C | 52.9° | 175.0° |
| C4 | C3 | CA | N | 179.7° | 65.0° |
| C4 | C3 | CA | HA | 60.4° | 55.0° |
| C4 | C3 | H1 | H3 | 117.4° | 120.0° |
| C3 | C4 | C5 | H5 | 175.4° | 171.6° |
| C3 | CA | C | O | 91.4° | 100.3° |
| C3 | CA | C | N | 133.4° | 120.0° |
| C3 | CA | C | HA | 113.1° | 119.9° |
| C3 | CA | N | HA | 119.5° | 120.0° |
| C3 | CA | C | OXT | 88.7° | 80.0° |
| CA | C3 | H1 | H3 | 117.4° | 120.0° |
| CA | C3 | C4 | H4 | 101.5° | 52.6° |
| C3 | CA | N | H2 | 180.0° | 176.0° |
| C3 | CA | N | H | 60.0° | 60.1° |
| O | C | CA | OXT | 179.9° | 179.7° |
| O | C | CA | N | 135.2° | 19.7° |
| O | C | CA | HA | 21.7° | 139.7° |
| O | C | OXT | HXT | 0.0° | 0.3° |
| C | CA | N | HA | 113.2° | 120.0° |
| C | CA | C3 | H1 | 67.9° | 65.0° |
| C | CA | C3 | H3 | 173.7° | 55.0° |
| C | CA | N | H2 | 52.7° | 63.9° |
| C | CA | N | H | 67.3° | 60.0° |
| CA | C | OXT | HXT | 179.9° | 180.0° |
| N | CA | C | OXT | 44.7° | 160.0° |
| N | CA | C3 | H1 | 58.8° | 55.0° |
| N | CA | C3 | H3 | 59.5° | 175.0° |
| CA | N | H2 | H | 120.0° | 123.9° |
| OXT | C | CA | HA | 158.3° | 40.0° |
| HA | CA | C3 | H1 | 178.8° | 175.0° |
| HA | CA | C3 | H3 | 60.4° | 65.0° |
| HA | CA | N | H2 | 60.5° | 56.1° |
| HA | CA | N | H | 179.5° | 180.0° |
| H1 | C3 | C4 | H4 | 19.4° | 172.6° |
| H3 | C3 | C4 | H4 | 137.7° | 67.5° |
| H4 | C4 | C5 | H5 | 4.6° | 8.4° |
| H5 | C5 | C6 | H6 | 179.0° | 173.5° |
| H6 | C6 | N6 | H11 | 63.5° | 175.2° |
| H6 | C6 | N6 | H12 | 56.5° | 60.9° |
