00O
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C37 | C7 | doub | 1.38Å | 1.40Å | Aromatic |
| C37 | C26 | sing | 1.38Å | 1.40Å | Aromatic |
| C37 | H37 | sing | 1.08Å | 1.08Å | |
| C26 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C25 | C34 | sing | 1.38Å | 1.39Å | Aromatic |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C23 | C34 | doub | 1.38Å | 1.40Å | Aromatic |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C7 | C23 | sing | 1.38Å | 1.40Å | Aromatic |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| CB | C7 | sing | 1.51Å | 1.55Å | |
| CA | CB | sing | 1.53Å | 1.55Å | |
| CB | C1 | sing | 1.51Å | 1.55Å | |
| CB | HB1 | sing | 1.09Å | 1.10Å | |
| C | CA | sing | 1.51Å | 1.52Å | |
| N | CA | sing | 1.47Å | 1.50Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| C | O | doub | 1.21Å | 1.23Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| C6 | C1 | doub | 1.38Å | 1.40Å | Aromatic |
| C1 | C2 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C5 | sing | 1.38Å | 1.41Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C5 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C4 | C3 | sing | 1.38Å | 1.40Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C2 | C3 | doub | 1.38Å | 1.40Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C2 | H2A | sing | 1.08Å | 1.08Å | |
| C | OXT | sing | 1.34Å | 31.91Å | |
| OXT | HXT | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C7 | C37 | C26 | 119.8° | 120.0° |
| C7 | C37 | H37 | 120.1° | 120.0° |
| C37 | C7 | C23 | 120.0° | 120.0° |
| C37 | C7 | CB | 116.7° | 120.0° |
| C26 | C37 | H37 | 120.1° | 120.0° |
| C37 | C26 | C25 | 119.6° | 120.0° |
| C37 | C26 | H26 | 120.2° | 120.0° |
| C25 | C26 | H26 | 120.2° | 120.0° |
| C26 | C25 | C34 | 121.0° | 120.0° |
| C26 | C25 | H25 | 119.5° | 120.0° |
| C34 | C25 | H25 | 119.5° | 120.0° |
| C25 | C34 | C23 | 119.3° | 120.0° |
| C25 | C34 | H34 | 120.3° | 119.9° |
| C23 | C34 | H34 | 120.3° | 120.1° |
| C34 | C23 | C7 | 120.3° | 120.0° |
| C34 | C23 | H23 | 119.9° | 120.0° |
| C7 | C23 | H23 | 119.9° | 120.0° |
| C23 | C7 | CB | 123.3° | 120.0° |
| C7 | CB | CA | 116.3° | 109.5° |
| C7 | CB | C1 | 108.5° | 109.5° |
| C7 | CB | HB1 | 105.8° | 109.5° |
| CA | CB | C1 | 110.7° | 109.5° |
| CA | CB | HB1 | 103.4° | 109.5° |
| CB | CA | C | 108.2° | 109.5° |
| CB | CA | N | 112.9° | 109.5° |
| CB | CA | HA | 108.9° | 109.5° |
| C1 | CB | HB1 | 111.9° | 109.5° |
| CB | C1 | C6 | 121.9° | 120.0° |
| CB | C1 | C2 | 119.4° | 120.0° |
| C | CA | N | 112.1° | 109.5° |
| C | CA | HA | 109.8° | 109.5° |
| CA | C | O | 115.4° | 120.0° |
| CA | C | OXT | 135.4° | 120.0° |
| N | CA | HA | 104.8° | 109.4° |
| CA | N | H | 109.5° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| O | C | OXT | 62.7° | 120.0° |
| H | N | H2 | 109.4° | 111.1° |
| C6 | C1 | C2 | 118.7° | 120.0° |
| C1 | C6 | C5 | 119.3° | 120.0° |
| C1 | C6 | H6 | 120.3° | 120.0° |
| C1 | C2 | C3 | 122.1° | 120.0° |
| C1 | C2 | H2A | 119.0° | 120.0° |
| C5 | C6 | H6 | 120.4° | 120.0° |
| C6 | C5 | C4 | 121.7° | 120.0° |
| C6 | C5 | H5 | 119.2° | 120.0° |
| C4 | C5 | H5 | 119.2° | 120.0° |
| C5 | C4 | C3 | 119.2° | 120.0° |
| C5 | C4 | H4 | 120.4° | 120.0° |
| C3 | C4 | H4 | 120.4° | 120.0° |
| C4 | C3 | C2 | 119.1° | 120.0° |
| C4 | C3 | H3 | 120.4° | 120.0° |
| C2 | C3 | H3 | 120.4° | 120.0° |
| C3 | C2 | H2A | 118.9° | 120.1° |
| C | OXT | HXT | 90.0° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C7 | C37 | C26 | H37 | 180.0° | 179.8° |
| C7 | C37 | C26 | C25 | 0.0° | 0.0° |
| C7 | C37 | C26 | H26 | 180.0° | 179.9° |
| C37 | C7 | C23 | C34 | 0.1° | 0.1° |
| C37 | C7 | C23 | CB | 179.9° | 180.0° |
| C37 | C7 | C23 | H23 | 179.9° | 180.0° |
| C37 | C7 | CB | CA | 35.7° | 127.6° |
| C37 | C7 | CB | C1 | 89.9° | 112.4° |
| C37 | C7 | CB | HB1 | 149.8° | 7.6° |
| C37 | C26 | C25 | H26 | 180.0° | 179.9° |
| C37 | C26 | C25 | C34 | 0.0° | 0.1° |
| C37 | C26 | C25 | H25 | 180.0° | 179.9° |
| C26 | C37 | C7 | C23 | 0.0° | 0.0° |
| C26 | C37 | C7 | CB | 180.0° | 180.0° |
| H37 | C37 | C26 | C25 | 180.0° | 179.8° |
| H37 | C37 | C26 | H26 | 0.0° | 0.3° |
| H37 | C37 | C7 | C23 | 180.0° | 179.7° |
| H37 | C37 | C7 | CB | 0.0° | 0.3° |
| C26 | C25 | C34 | H25 | 180.0° | 180.0° |
| C26 | C25 | C34 | C23 | 0.0° | 0.0° |
| C26 | C25 | C34 | H34 | 180.0° | 180.0° |
| H26 | C26 | C25 | C34 | 180.0° | 180.0° |
| H26 | C26 | C25 | H25 | 0.0° | 0.0° |
| C25 | C34 | C23 | H34 | 180.0° | 180.0° |
| C25 | C34 | C23 | C7 | 0.1° | 0.0° |
| C25 | C34 | C23 | H23 | 179.9° | 180.0° |
| H25 | C25 | C34 | C23 | 180.0° | 180.0° |
| H25 | C25 | C34 | H34 | 0.0° | 0.0° |
| C34 | C23 | C7 | H23 | 180.0° | 179.9° |
| C34 | C23 | C7 | CB | 180.0° | 179.9° |
| H34 | C34 | C23 | C7 | 180.0° | 179.9° |
| H34 | C34 | C23 | H23 | 0.1° | 0.0° |
| C23 | C7 | CB | CA | 144.4° | 52.4° |
| C23 | C7 | CB | C1 | 90.0° | 67.6° |
| C23 | C7 | CB | HB1 | 30.3° | 172.4° |
| H23 | C23 | C7 | CB | 0.0° | 0.0° |
| C7 | CB | CA | C1 | 124.5° | 120.0° |
| C7 | CB | CA | HB1 | 115.4° | 120.0° |
| C7 | CB | C1 | HB1 | 116.4° | 120.0° |
| C7 | CB | CA | C | 176.0° | 60.0° |
| C7 | CB | CA | N | 51.3° | 180.0° |
| C7 | CB | CA | HA | 64.7° | 60.0° |
| C7 | CB | C1 | C6 | 74.4° | 68.0° |
| C7 | CB | C1 | C2 | 105.7° | 111.7° |
| CA | CB | C1 | HB1 | 114.8° | 120.0° |
| CB | CA | C | N | 125.1° | 120.0° |
| CB | CA | C | HA | 118.8° | 120.0° |
| CB | CA | N | HA | 118.4° | 120.0° |
| CB | CA | C | O | 71.9° | 120.0° |
| CB | CA | N | H | 180.0° | 176.0° |
| CB | CA | N | H2 | 60.0° | 60.0° |
| CA | CB | C1 | C6 | 54.4° | 52.0° |
| CA | CB | C1 | C2 | 125.5° | 128.3° |
| CB | CA | C | OXT | 147.9° | 60.0° |
| C1 | CB | CA | C | 59.6° | 180.0° |
| C1 | CB | CA | N | 175.8° | 60.0° |
| C1 | CB | CA | HA | 59.8° | 60.0° |
| CB | C1 | C6 | C2 | 180.0° | 179.7° |
| CB | C1 | C6 | C5 | 180.0° | 180.0° |
| CB | C1 | C6 | H6 | 0.0° | 0.0° |
| CB | C1 | C2 | C3 | 180.0° | 179.8° |
| CB | C1 | C2 | H2A | 0.0° | 0.0° |
| HB1 | CB | CA | C | 60.5° | 60.0° |
| HB1 | CB | CA | N | 64.1° | 60.0° |
| HB1 | CB | CA | HA | 179.9° | 179.9° |
| HB1 | CB | C1 | C6 | 169.2° | 172.0° |
| HB1 | CB | C1 | C2 | 10.7° | 8.3° |
| C | CA | N | HA | 119.1° | 120.0° |
| CA | C | O | OXT | 130.0° | 180.0° |
| C | CA | N | H | 57.5° | 56.0° |
| C | CA | N | H2 | 177.5° | 180.0° |
| CA | C | OXT | HXT | 90.0° | 179.9° |
| N | CA | C | O | 53.3° | 0.1° |
| CA | N | H | H2 | 120.0° | 124.0° |
| N | CA | C | OXT | 22.7° | 180.0° |
| HA | CA | C | O | 169.3° | 120.0° |
| HA | CA | N | H | 61.6° | 64.0° |
| HA | CA | N | H2 | 58.4° | 60.0° |
| HA | CA | C | OXT | 93.3° | 60.0° |
| O | C | OXT | HXT | 90.0° | 0.0° |
| C1 | C6 | C5 | H6 | 180.0° | 180.0° |
| C1 | C6 | C5 | C4 | 0.1° | 0.1° |
| C1 | C6 | C5 | H5 | 179.9° | 180.0° |
| C6 | C1 | C2 | C3 | 0.1° | 0.5° |
| C6 | C1 | C2 | H2A | 179.9° | 179.7° |
| C2 | C1 | C6 | C5 | 0.0° | 0.3° |
| C2 | C1 | C6 | H6 | 180.0° | 179.7° |
| C1 | C2 | C3 | C4 | 0.0° | 0.4° |
| C1 | C2 | C3 | H2A | 180.0° | 179.8° |
| C1 | C2 | C3 | H3 | 180.0° | 179.7° |
| C6 | C5 | C4 | H5 | 180.0° | 180.0° |
| C6 | C5 | C4 | C3 | 0.1° | 0.0° |
| C6 | C5 | C4 | H4 | 179.9° | 179.9° |
| H6 | C6 | C5 | C4 | 179.9° | 179.9° |
| H6 | C6 | C5 | H5 | 0.1° | 0.1° |
| C5 | C4 | C3 | H4 | 180.0° | 179.9° |
| C5 | C4 | C3 | C2 | 0.1° | 0.2° |
| C5 | C4 | C3 | H3 | 179.9° | 179.9° |
| H5 | C5 | C4 | C3 | 179.9° | 180.0° |
| H5 | C5 | C4 | H4 | 0.1° | 0.1° |
| C4 | C3 | C2 | H3 | 180.0° | 179.9° |
| C4 | C3 | C2 | H2A | 180.0° | 179.8° |
| H4 | C4 | C3 | C2 | 180.0° | 179.9° |
| H4 | C4 | C3 | H3 | 0.1° | 0.0° |
| H3 | C3 | C2 | H2A | 0.0° | 0.1° |
