0FQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1B | CB | sing | 1.51Å | 1.55Å | |
| CB | S1P | sing | 1.81Å | 1.79Å | |
| CB | HB | sing | 1.09Å | 1.10Å | |
| CB | HBA | sing | 1.09Å | 1.10Å | |
| C6A | N1A | doub | 1.33Å | 1.45Å | Aromatic |
| N1A | C2A | sing | 1.32Å | 1.40Å | Aromatic |
| P1A | O1A | doub | 1.48Å | 1.64Å | |
| O3A | P1A | sing | 1.61Å | 1.67Å | |
| O5D | P1A | sing | 1.61Å | 1.64Å | |
| P1A | O2A | sing | 1.61Å | 1.45Å | |
| C2B | C1B | sing | 1.47Å | 1.56Å | |
| C1B | O1B | doub | 1.21Å | 1.19Å | |
| N9A | C1D | sing | 1.47Å | 1.46Å | |
| C1D | O4D | sing | 1.44Å | 1.41Å | |
| C1D | C2D | sing | 1.54Å | 1.50Å | |
| C1D | H1D | sing | 1.09Å | 1.10Å | |
| S1P | C2P | sing | 1.81Å | 1.85Å | |
| C2A | N3A | doub | 1.32Å | 1.43Å | Aromatic |
| C2A | H2A | sing | 1.08Å | 1.08Å | |
| O2A | HO2A | sing | 0.97Å | 0.95Å | |
| O6A | P2A | sing | 1.61Å | 1.67Å | |
| O4A | P2A | doub | 1.48Å | 1.61Å | |
| O5A | P2A | sing | 1.61Å | 1.45Å | |
| P2A | O3A | sing | 1.61Å | 1.65Å | |
| C7B | C2B | doub | 1.40Å | 1.53Å | Aromatic |
| C3B | C2B | sing | 1.40Å | 1.43Å | Aromatic |
| C2D | O2D | sing | 1.43Å | 1.42Å | |
| C2D | C3D | sing | 1.55Å | 1.48Å | |
| C2D | H2D | sing | 1.09Å | 1.10Å | |
| O2D | HO2D | sing | 0.97Å | 0.95Å | |
| C2P | C3P | sing | 1.53Å | 1.55Å | |
| C2P | H2P | sing | 1.09Å | 1.10Å | |
| C2P | H2PA | sing | 1.09Å | 1.10Å | |
| C4A | N3A | sing | 1.33Å | 1.39Å | Aromatic |
| C4B | C3B | doub | 1.38Å | 1.47Å | Aromatic |
| C3B | H3B | sing | 1.08Å | 1.08Å | |
| C4D | C3D | sing | 1.54Å | 1.61Å | |
| C3D | O3D | sing | 1.43Å | 1.43Å | |
| C3D | H3D | sing | 1.09Å | 1.10Å | |
| O3D | P3D | sing | 1.61Å | 1.66Å | |
| O7A | P3D | doub | 1.48Å | 1.65Å | |
| P3D | O9A | sing | 1.61Å | 1.47Å | |
| P3D | O8A | sing | 1.61Å | 1.65Å | |
| C3P | N4P | sing | 1.46Å | 1.48Å | |
| C3P | H3P | sing | 1.09Å | 1.10Å | |
| C3P | H3PA | sing | 1.09Å | 1.10Å | |
| C5A | C4A | doub | 1.40Å | 1.44Å | Aromatic |
| C4A | N9A | sing | 1.37Å | 1.37Å | Aromatic |
| C5B | C4B | sing | 1.38Å | 1.48Å | Aromatic |
| C4B | H4B | sing | 1.08Å | 1.08Å | |
| O4D | C4D | sing | 1.44Å | 1.49Å | |
| C4D | C5D | sing | 1.53Å | 1.53Å | |
| C4D | H4D | sing | 1.09Å | 1.10Å | |
| N4P | C5P | sing | 1.35Å | 1.46Å | |
| N4P | HN4P | sing | 0.97Å | 1.00Å | |
| C6A | C5A | sing | 1.41Å | 1.38Å | Aromatic |
| C5A | N7A | sing | 1.36Å | 1.39Å | Aromatic |
| O5A | HO5A | sing | 0.97Å | 0.95Å | |
| C5B | C6B | doub | 1.38Å | 1.47Å | Aromatic |
| C5B | H5B | sing | 1.08Å | 1.08Å | |
| O5D | C5D | sing | 1.43Å | 1.41Å | |
| C5D | H5D | sing | 1.09Å | 1.10Å | |
| C5D | H5DA | sing | 1.09Å | 1.10Å | |
| C5P | C6P | sing | 1.51Å | 1.54Å | |
| C5P | O5P | doub | 1.21Å | 1.19Å | |
| N6A | C6A | sing | 1.38Å | 1.46Å | |
| N6A | HN6A | sing | 0.97Å | 1.00Å | |
| N6A | HN6B | sing | 0.97Å | 1.00Å | |
| CCP | O6A | sing | 1.43Å | 1.40Å | |
| C6B | C7B | sing | 1.38Å | 1.43Å | Aromatic |
| C6B | H6B | sing | 1.08Å | 1.08Å | |
| C6P | C7P | sing | 1.53Å | 1.54Å | |
| C6P | H6P | sing | 1.09Å | 1.10Å | |
| C6P | H6PA | sing | 1.09Å | 1.10Å | |
| N7A | C8A | doub | 1.30Å | 1.41Å | Aromatic |
| C7B | H7B | sing | 1.08Å | 1.08Å | |
| C7P | N8P | sing | 1.47Å | 1.46Å | |
| C7P | H7P | sing | 1.09Å | 1.10Å | |
| C7P | H7PA | sing | 1.09Å | 1.10Å | |
| C8A | N9A | sing | 1.36Å | 1.44Å | Aromatic |
| C8A | H8A | sing | 1.08Å | 1.08Å | |
| O8A | HO8A | sing | 0.97Å | 0.95Å | |
| N8P | C9P | sing | 1.35Å | 1.45Å | |
| N8P | HN8P | sing | 0.97Å | 1.00Å | |
| O9A | HO9A | sing | 0.97Å | 0.95Å | |
| O9P | C9P | doub | 1.21Å | 1.20Å | |
| C9P | CAP | sing | 1.51Å | 1.55Å | |
| CBP | CAP | sing | 1.53Å | 1.54Å | |
| CAP | OAP | sing | 1.43Å | 1.41Å | |
| CAP | HAP | sing | 1.09Å | 1.10Å | |
| OAP | HOAP | sing | 0.97Å | 0.95Å | |
| CEP | CBP | sing | 1.53Å | 1.53Å | |
| CDP | CBP | sing | 1.53Å | 1.54Å | |
| CBP | CCP | sing | 1.53Å | 1.55Å | |
| CCP | HCP | sing | 1.09Å | 1.10Å | |
| CCP | HCPA | sing | 1.09Å | 1.10Å | |
| CDP | HDP | sing | 1.09Å | 1.10Å | |
| CDP | HDPA | sing | 1.09Å | 1.10Å | |
| CDP | HDPB | sing | 1.09Å | 1.10Å | |
| CEP | HEP | sing | 1.09Å | 1.10Å | |
| CEP | HEPA | sing | 1.09Å | 1.10Å | |
| CEP | HEPB | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1B | CB | S1P | 120.8° | 109.5° |
| C1B | CB | HB | 105.9° | 109.5° |
| C1B | CB | HBA | 105.9° | 109.5° |
| CB | C1B | C2B | 122.1° | 120.0° |
| CB | C1B | O1B | 118.2° | 120.0° |
| S1P | CB | HB | 105.9° | 109.5° |
| S1P | CB | HBA | 105.9° | 109.5° |
| CB | S1P | C2P | 102.0° | 103.0° |
| HB | CB | HBA | 112.8° | 109.4° |
| C6A | N1A | C2A | 121.0° | 121.2° |
| N1A | C6A | C5A | 120.0° | 118.4° |
| N1A | C6A | N6A | 119.0° | 120.8° |
| N1A | C2A | N3A | 118.6° | 122.5° |
| N1A | C2A | H2A | 120.7° | 118.8° |
| O1A | P1A | O3A | 114.4° | 109.4° |
| O1A | P1A | O5D | 109.9° | 109.5° |
| O1A | P1A | O2A | 111.9° | 109.5° |
| O3A | P1A | O5D | 105.6° | 109.5° |
| O3A | P1A | O2A | 106.4° | 109.5° |
| P1A | O3A | P2A | 123.2° | 134.0° |
| O5D | P1A | O2A | 108.3° | 109.4° |
| P1A | O5D | C5D | 117.8° | 123.0° |
| P1A | O2A | HO2A | 109.5° | 114.0° |
| C2B | C1B | O1B | 119.6° | 120.0° |
| C1B | C2B | C7B | 121.7° | 120.2° |
| C1B | C2B | C3B | 118.5° | 120.2° |
| N9A | C1D | O4D | 109.0° | 110.3° |
| N9A | C1D | C2D | 111.5° | 110.4° |
| N9A | C1D | H1D | 108.1° | 110.4° |
| C1D | N9A | C4A | 123.2° | 126.3° |
| C1D | N9A | C8A | 127.6° | 126.3° |
| O4D | C1D | C2D | 108.4° | 104.8° |
| O4D | C1D | H1D | 111.2° | 110.4° |
| C1D | O4D | C4D | 108.1° | 105.3° |
| C2D | C1D | H1D | 108.7° | 110.4° |
| C1D | C2D | O2D | 114.7° | 110.5° |
| C1D | C2D | C3D | 95.3° | 104.1° |
| C1D | C2D | H2D | 118.3° | 110.5° |
| S1P | C2P | C3P | 113.9° | 109.5° |
| S1P | C2P | H2P | 108.0° | 109.5° |
| S1P | C2P | H2PA | 108.0° | 109.5° |
| N3A | C2A | H2A | 120.7° | 118.7° |
| C2A | N3A | C4A | 120.5° | 120.6° |
| O6A | P2A | O4A | 114.7° | 109.5° |
| O6A | P2A | O5A | 104.7° | 109.5° |
| O6A | P2A | O3A | 106.7° | 109.5° |
| P2A | O6A | CCP | 123.6° | 123.0° |
| O4A | P2A | O5A | 109.1° | 109.5° |
| O4A | P2A | O3A | 107.4° | 109.5° |
| O5A | P2A | O3A | 114.4° | 109.5° |
| P2A | O5A | HO5A | 109.5° | 114.0° |
| C7B | C2B | C3B | 119.8° | 119.6° |
| C2B | C7B | C6B | 119.6° | 119.9° |
| C2B | C7B | H7B | 120.2° | 120.0° |
| C2B | C3B | C4B | 120.4° | 119.8° |
| C2B | C3B | H3B | 119.8° | 120.1° |
| O2D | C2D | C3D | 117.2° | 110.5° |
| O2D | C2D | H2D | 97.0° | 110.4° |
| C2D | O2D | HO2D | 109.5° | 114.0° |
| C3D | C2D | H2D | 115.9° | 110.6° |
| C2D | C3D | C4D | 102.9° | 104.0° |
| C2D | C3D | O3D | 113.6° | 110.5° |
| C2D | C3D | H3D | 114.2° | 110.5° |
| C3P | C2P | H2P | 108.0° | 109.5° |
| C3P | C2P | H2PA | 108.0° | 109.5° |
| C2P | C3P | N4P | 113.2° | 109.5° |
| C2P | C3P | H3P | 108.2° | 109.4° |
| C2P | C3P | H3PA | 108.2° | 109.5° |
| H2P | C2P | H2PA | 110.9° | 109.4° |
| N3A | C4A | C5A | 121.0° | 119.1° |
| N3A | C4A | N9A | 131.4° | 134.9° |
| C4B | C3B | H3B | 119.8° | 120.1° |
| C3B | C4B | C5B | 120.0° | 120.2° |
| C3B | C4B | H4B | 120.0° | 119.9° |
| C4D | C3D | O3D | 116.9° | 110.5° |
| C4D | C3D | H3D | 110.7° | 110.6° |
| C3D | C4D | O4D | 99.3° | 104.8° |
| C3D | C4D | C5D | 119.4° | 110.4° |
| C3D | C4D | H4D | 111.5° | 110.4° |
| O3D | C3D | H3D | 99.2° | 110.5° |
| C3D | O3D | P3D | 116.2° | 123.0° |
| O3D | P3D | O7A | 106.8° | 109.5° |
| O3D | P3D | O9A | 105.5° | 109.5° |
| O3D | P3D | O8A | 108.9° | 109.4° |
| O7A | P3D | O9A | 112.6° | 109.5° |
| O7A | P3D | O8A | 110.5° | 109.5° |
| O9A | P3D | O8A | 112.2° | 109.5° |
| P3D | O9A | HO9A | 109.5° | 114.0° |
| P3D | O8A | HO8A | 109.5° | 114.0° |
| N4P | C3P | H3P | 108.2° | 109.5° |
| N4P | C3P | H3PA | 108.3° | 109.5° |
| C3P | N4P | C5P | 115.5° | 120.0° |
| C3P | N4P | HN4P | 122.2° | 120.0° |
| H3P | C3P | H3PA | 110.7° | 109.5° |
| C5A | C4A | N9A | 107.6° | 106.0° |
| C4A | C5A | C6A | 118.8° | 118.2° |
| C4A | C5A | N7A | 107.9° | 107.1° |
| C4A | N9A | C8A | 109.1° | 107.4° |
| C5B | C4B | H4B | 120.0° | 120.0° |
| C4B | C5B | C6B | 119.7° | 120.4° |
| C4B | C5B | H5B | 120.1° | 119.8° |
| O4D | C4D | C5D | 113.4° | 110.4° |
| O4D | C4D | H4D | 117.8° | 110.5° |
| C5D | C4D | H4D | 96.7° | 110.3° |
| C4D | C5D | O5D | 109.0° | 109.5° |
| C4D | C5D | H5D | 109.6° | 109.5° |
| C4D | C5D | H5DA | 109.6° | 109.5° |
| C5P | N4P | HN4P | 122.2° | 120.0° |
| N4P | C5P | C6P | 118.7° | 120.0° |
| N4P | C5P | O5P | 120.6° | 120.0° |
| C6A | C5A | N7A | 133.3° | 134.7° |
| C5A | C6A | N6A | 120.9° | 120.8° |
| C5A | N7A | C8A | 108.8° | 109.4° |
| C6B | C5B | H5B | 120.2° | 119.8° |
| C5B | C6B | C7B | 120.5° | 120.2° |
| C5B | C6B | H6B | 119.7° | 119.9° |
| O5D | C5D | H5D | 109.6° | 109.5° |
| O5D | C5D | H5DA | 109.6° | 109.5° |
| H5D | C5D | H5DA | 109.3° | 109.4° |
| C6P | C5P | O5P | 120.7° | 120.0° |
| C5P | C6P | C7P | 110.0° | 109.5° |
| C5P | C6P | H6P | 109.3° | 109.4° |
| C5P | C6P | H6PA | 109.3° | 109.5° |
| C6A | N6A | HN6A | 109.5° | 120.0° |
| C6A | N6A | HN6B | 109.5° | 120.0° |
| HN6A | N6A | HN6B | 109.5° | 120.0° |
| O6A | CCP | CBP | 109.7° | 109.5° |
| O6A | CCP | HCP | 109.4° | 109.5° |
| O6A | CCP | HCPA | 109.4° | 109.5° |
| C7B | C6B | H6B | 119.7° | 119.9° |
| C6B | C7B | H7B | 120.2° | 120.1° |
| C7P | C6P | H6P | 109.3° | 109.5° |
| C7P | C6P | H6PA | 109.3° | 109.5° |
| C6P | C7P | N8P | 114.3° | 109.4° |
| C6P | C7P | H7P | 107.9° | 109.5° |
| C6P | C7P | H7PA | 107.9° | 109.5° |
| H6P | C6P | H6PA | 109.6° | 109.5° |
| N7A | C8A | N9A | 106.6° | 110.0° |
| N7A | C8A | H8A | 126.7° | 124.9° |
| N8P | C7P | H7P | 107.9° | 109.5° |
| N8P | C7P | H7PA | 107.9° | 109.4° |
| C7P | N8P | C9P | 116.7° | 120.0° |
| C7P | N8P | HN8P | 121.7° | 120.0° |
| H7P | C7P | H7PA | 111.0° | 109.5° |
| N9A | C8A | H8A | 126.7° | 125.1° |
| C9P | N8P | HN8P | 121.6° | 120.0° |
| N8P | C9P | O9P | 119.2° | 120.0° |
| N8P | C9P | CAP | 117.8° | 120.0° |
| O9P | C9P | CAP | 122.8° | 120.0° |
| C9P | CAP | CBP | 109.1° | 109.5° |
| C9P | CAP | OAP | 111.5° | 109.5° |
| C9P | CAP | HAP | 108.9° | 109.5° |
| CBP | CAP | OAP | 111.1° | 109.5° |
| CBP | CAP | HAP | 109.3° | 109.5° |
| CAP | CBP | CEP | 111.0° | 109.5° |
| CAP | CBP | CDP | 108.4° | 109.5° |
| CAP | CBP | CCP | 107.6° | 109.5° |
| OAP | CAP | HAP | 106.9° | 109.5° |
| CAP | OAP | HOAP | 109.5° | 114.1° |
| CEP | CBP | CDP | 113.1° | 109.5° |
| CEP | CBP | CCP | 108.9° | 109.4° |
| CBP | CEP | HEP | 109.5° | 109.5° |
| CBP | CEP | HEPA | 109.4° | 109.5° |
| CBP | CEP | HEPB | 109.5° | 109.5° |
| CDP | CBP | CCP | 107.5° | 109.5° |
| CBP | CDP | HDP | 109.5° | 109.5° |
| CBP | CDP | HDPA | 109.5° | 109.5° |
| CBP | CDP | HDPB | 109.5° | 109.4° |
| CBP | CCP | HCP | 109.4° | 109.5° |
| CBP | CCP | HCPA | 109.4° | 109.5° |
| HCP | CCP | HCPA | 109.5° | 109.4° |
| HDP | CDP | HDPA | 109.4° | 109.5° |
| HDP | CDP | HDPB | 109.5° | 109.5° |
| HDPA | CDP | HDPB | 109.5° | 109.4° |
| HEP | CEP | HEPA | 109.5° | 109.5° |
| HEP | CEP | HEPB | 109.5° | 109.4° |
| HEPA | CEP | HEPB | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1B | CB | S1P | HB | 120.0° | 120.1° |
| C1B | CB | S1P | HBA | 120.0° | 120.0° |
| C1B | CB | HB | HBA | 115.3° | 120.0° |
| CB | C1B | C2B | O1B | 176.9° | 179.9° |
| C1B | CB | S1P | C2P | 76.3° | 180.0° |
| CB | C1B | C2B | C7B | 5.5° | 0.2° |
| CB | C1B | C2B | C3B | 174.8° | 180.0° |
| S1P | CB | HB | HBA | 115.3° | 120.0° |
| S1P | CB | C1B | C2B | 78.5° | 180.0° |
| S1P | CB | C1B | O1B | 104.5° | 0.0° |
| CB | S1P | C2P | C3P | 63.6° | 180.0° |
| CB | S1P | C2P | H2P | 56.4° | 59.9° |
| CB | S1P | C2P | H2PA | 176.4° | 60.0° |
| HB | CB | C1B | C2B | 41.5° | 60.0° |
| HB | CB | C1B | O1B | 135.5° | 120.1° |
| HB | CB | S1P | C2P | 163.7° | 60.0° |
| HBA | CB | C1B | C2B | 161.5° | 60.0° |
| HBA | CB | C1B | O1B | 15.5° | 120.0° |
| HBA | CB | S1P | C2P | 43.7° | 60.0° |
| C6A | N1A | C2A | N3A | 0.5° | 0.0° |
| C6A | N1A | C2A | H2A | 179.4° | 180.0° |
| N1A | C6A | C5A | C4A | 0.7° | 0.0° |
| N1A | C6A | C5A | N6A | 177.8° | 180.0° |
| N1A | C6A | C5A | N7A | 179.6° | 180.0° |
| N1A | C6A | N6A | HN6A | 0.0° | 0.0° |
| N1A | C6A | N6A | HN6B | 120.0° | 180.0° |
| N1A | C2A | N3A | H2A | 180.0° | 180.0° |
| N1A | C2A | N3A | C4A | 0.2° | 0.0° |
| C2A | N1A | C6A | C5A | 0.8° | 0.0° |
| C2A | N1A | C6A | N6A | 178.6° | 180.0° |
| O1A | P1A | O3A | O5D | 121.0° | 120.0° |
| O1A | P1A | O3A | O2A | 124.1° | 120.0° |
| O1A | P1A | O5D | O2A | 122.5° | 120.1° |
| O1A | P1A | O2A | HO2A | 0.0° | 180.0° |
| O1A | P1A | O3A | P2A | 51.9° | 40.0° |
| O1A | P1A | O5D | C5D | 151.1° | 55.0° |
| O3A | P1A | O5D | O2A | 113.6° | 120.0° |
| O3A | P1A | O2A | HO2A | 125.6° | 60.0° |
| P1A | O3A | P2A | O6A | 84.2° | 160.0° |
| P1A | O3A | P2A | O4A | 152.4° | 40.0° |
| P1A | O3A | P2A | O5A | 31.1° | 80.0° |
| O3A | P1A | O5D | C5D | 85.0° | 175.0° |
| O5D | P1A | O2A | HO2A | 121.3° | 60.0° |
| O5D | P1A | O3A | P2A | 69.2° | 160.0° |
| P1A | O5D | C5D | C4D | 157.3° | 180.0° |
| P1A | O5D | C5D | H5D | 82.7° | 60.0° |
| P1A | O5D | C5D | H5DA | 37.3° | 60.0° |
| O2A | P1A | O3A | P2A | 175.9° | 80.0° |
| O2A | P1A | O5D | C5D | 28.6° | 65.1° |
| C1B | C2B | C7B | C3B | 179.8° | 179.8° |
| C1B | C2B | C3B | C4B | 179.1° | 180.0° |
| C1B | C2B | C3B | H3B | 0.9° | 0.1° |
| C1B | C2B | C7B | C6B | 179.6° | 179.7° |
| C1B | C2B | C7B | H7B | 0.4° | 0.2° |
| O1B | C1B | C2B | C7B | 177.6° | 179.7° |
| O1B | C1B | C2B | C3B | 2.1° | 0.1° |
| N9A | C1D | O4D | C2D | 121.5° | 118.8° |
| N9A | C1D | O4D | H1D | 119.1° | 122.3° |
| N9A | C1D | C2D | H1D | 119.1° | 122.4° |
| N9A | C1D | C2D | O2D | 70.5° | 98.6° |
| N9A | C1D | C2D | C3D | 166.3° | 142.8° |
| N9A | C1D | C2D | H2D | 43.0° | 24.0° |
| C1D | N9A | C4A | N3A | 1.7° | 0.1° |
| C1D | N9A | C4A | C5A | 178.0° | 180.0° |
| C1D | N9A | C4A | C8A | 178.3° | 180.0° |
| N9A | C1D | O4D | C4D | 145.9° | 159.4° |
| C1D | N9A | C8A | N7A | 178.1° | 180.0° |
| C1D | N9A | C8A | H8A | 1.9° | 0.0° |
| O4D | C1D | C2D | H1D | 121.0° | 118.8° |
| O4D | C1D | C2D | O2D | 169.5° | 142.6° |
| O4D | C1D | C2D | C3D | 46.3° | 24.0° |
| O4D | C1D | C2D | H2D | 77.0° | 94.8° |
| C1D | O4D | C4D | C3D | 7.1° | 40.5° |
| O4D | C1D | N9A | C4A | 99.7° | 156.5° |
| C1D | O4D | C4D | C5D | 120.7° | 159.4° |
| C1D | O4D | C4D | H4D | 127.5° | 78.4° |
| O4D | C1D | N9A | C8A | 82.3° | 23.5° |
| C1D | C2D | O2D | C3D | 110.5° | 114.7° |
| C1D | C2D | O2D | H2D | 125.6° | 122.6° |
| C1D | C2D | C3D | H2D | 125.1° | 118.7° |
| C1D | C2D | O2D | HO2D | 107.5° | 61.4° |
| C1D | C2D | C3D | C4D | 48.3° | 0.0° |
| C1D | C2D | C3D | O3D | 78.9° | 118.6° |
| C1D | C2D | C3D | H3D | 168.3° | 118.8° |
| C2D | C1D | N9A | C4A | 140.7° | 88.2° |
| C2D | C1D | O4D | C4D | 24.4° | 40.5° |
| C2D | C1D | N9A | C8A | 37.3° | 91.8° |
| H1D | C1D | C2D | O2D | 48.5° | 23.8° |
| H1D | C1D | C2D | C3D | 74.7° | 94.8° |
| H1D | C1D | C2D | H2D | 162.1° | 146.4° |
| H1D | C1D | N9A | C4A | 21.3° | 34.2° |
| H1D | C1D | O4D | C4D | 95.1° | 78.3° |
| H1D | C1D | N9A | C8A | 156.7° | 145.8° |
| S1P | C2P | C3P | H2P | 120.0° | 120.0° |
| S1P | C2P | C3P | H2PA | 120.0° | 120.0° |
| S1P | C2P | H2P | H2PA | 118.2° | 120.0° |
| S1P | C2P | C3P | N4P | 59.3° | 180.0° |
| S1P | C2P | C3P | H3P | 60.7° | 60.0° |
| S1P | C2P | C3P | H3PA | 179.3° | 60.0° |
| C2A | N3A | C4A | C5A | 0.1° | 0.0° |
| C2A | N3A | C4A | N9A | 179.6° | 179.9° |
| H2A | C2A | N3A | C4A | 179.8° | 180.0° |
| O6A | P2A | O4A | O5A | 117.0° | 120.0° |
| O6A | P2A | O4A | O3A | 118.4° | 120.0° |
| O6A | P2A | O5A | O3A | 116.5° | 120.0° |
| O6A | P2A | O5A | HO5A | 123.2° | 60.0° |
| P2A | O6A | CCP | CBP | 156.9° | 180.0° |
| P2A | O6A | CCP | HCP | 36.9° | 60.0° |
| P2A | O6A | CCP | HCPA | 83.1° | 59.9° |
| O4A | P2A | O5A | O3A | 120.3° | 120.0° |
| O4A | P2A | O5A | HO5A | 0.0° | 180.0° |
| O4A | P2A | O6A | CCP | 18.3° | 55.0° |
| O5A | P2A | O6A | CCP | 101.2° | 65.0° |
| O3A | P2A | O5A | HO5A | 120.3° | 60.0° |
| O3A | P2A | O6A | CCP | 137.1° | 175.0° |
| C7B | C2B | C3B | C4B | 0.6° | 0.2° |
| C7B | C2B | C3B | H3B | 179.4° | 179.8° |
| C2B | C7B | C6B | C5B | 0.0° | 0.5° |
| C2B | C7B | C6B | H7B | 180.0° | 179.5° |
| C2B | C7B | C6B | H6B | 180.0° | 179.7° |
| C2B | C3B | C4B | H3B | 180.0° | 180.0° |
| C2B | C3B | C4B | C5B | 0.8° | 0.0° |
| C2B | C3B | C4B | H4B | 179.2° | 180.0° |
| C3B | C2B | C7B | C6B | 0.2° | 0.5° |
| C3B | C2B | C7B | H7B | 179.8° | 180.0° |
| O2D | C2D | C3D | H2D | 113.6° | 122.6° |
| O2D | C2D | C3D | C4D | 169.6° | 118.6° |
| O2D | C2D | C3D | O3D | 42.3° | 0.0° |
| O2D | C2D | C3D | H3D | 70.4° | 122.6° |
| C3D | C2D | O2D | HO2D | 3.0° | 176.1° |
| C2D | C3D | C4D | O3D | 125.1° | 118.6° |
| C2D | C3D | C4D | H3D | 122.3° | 118.7° |
| C2D | C3D | O3D | H3D | 121.5° | 122.6° |
| C2D | C3D | O3D | P3D | 101.7° | 121.5° |
| C2D | C3D | C4D | O4D | 36.3° | 24.0° |
| C2D | C3D | C4D | C5D | 87.4° | 142.8° |
| C2D | C3D | C4D | H4D | 161.1° | 95.0° |
| H2D | C2D | O2D | HO2D | 126.9° | 61.1° |
| H2D | C2D | C3D | C4D | 76.8° | 118.7° |
| H2D | C2D | C3D | O3D | 156.0° | 122.7° |
| H2D | C2D | C3D | H3D | 43.2° | 0.1° |
| C3P | C2P | H2P | H2PA | 118.2° | 120.0° |
| C2P | C3P | N4P | H3P | 120.0° | 120.0° |
| C2P | C3P | N4P | H3PA | 120.0° | 120.0° |
| C2P | C3P | H3P | H3PA | 118.5° | 120.0° |
| C2P | C3P | N4P | C5P | 69.0° | 180.0° |
| C2P | C3P | N4P | HN4P | 111.0° | 0.0° |
| H2P | C2P | C3P | N4P | 179.3° | 59.9° |
| H2P | C2P | C3P | H3P | 59.3° | 180.0° |
| H2P | C2P | C3P | H3PA | 60.7° | 60.1° |
| H2PA | C2P | C3P | N4P | 60.7° | 60.0° |
| H2PA | C2P | C3P | H3P | 179.3° | 60.0° |
| H2PA | C2P | C3P | H3PA | 59.3° | 180.0° |
| N3A | C4A | C5A | N9A | 179.8° | 179.9° |
| N3A | C4A | C5A | C6A | 0.3° | 0.0° |
| N3A | C4A | C5A | N7A | 179.9° | 180.0° |
| N3A | C4A | N9A | C8A | 180.0° | 179.9° |
| C3B | C4B | C5B | H4B | 180.0° | 180.0° |
| C3B | C4B | C5B | C6B | 0.6° | 0.0° |
| C3B | C4B | C5B | H5B | 179.4° | 180.0° |
| H3B | C3B | C4B | C5B | 179.2° | 180.0° |
| H3B | C3B | C4B | H4B | 0.8° | 0.0° |
| C4D | C3D | O3D | H3D | 118.9° | 122.8° |
| C4D | C3D | O3D | P3D | 138.7° | 123.9° |
| C3D | C4D | O4D | C5D | 127.8° | 118.8° |
| C3D | C4D | O4D | H4D | 120.4° | 118.9° |
| C3D | C4D | C5D | H4D | 119.4° | 122.2° |
| C3D | C4D | C5D | O5D | 49.9° | 175.0° |
| C3D | C4D | C5D | H5D | 169.9° | 55.0° |
| C3D | C4D | C5D | H5DA | 70.1° | 65.0° |
| C3D | O3D | P3D | O7A | 89.7° | 55.1° |
| C3D | O3D | P3D | O9A | 150.2° | 65.0° |
| C3D | O3D | P3D | O8A | 29.6° | 175.0° |
| O3D | C3D | C4D | O4D | 88.9° | 142.6° |
| O3D | C3D | C4D | C5D | 147.5° | 98.5° |
| O3D | C3D | C4D | H4D | 36.0° | 23.6° |
| H3D | C3D | O3D | P3D | 19.8° | 1.2° |
| H3D | C3D | C4D | O4D | 158.6° | 94.7° |
| H3D | C3D | C4D | C5D | 35.0° | 24.1° |
| H3D | C3D | C4D | H4D | 76.6° | 146.3° |
| O3D | P3D | O7A | O9A | 115.4° | 120.0° |
| O3D | P3D | O7A | O8A | 118.3° | 120.0° |
| O3D | P3D | O9A | O8A | 118.5° | 120.0° |
| O3D | P3D | O8A | HO8A | 116.9° | 180.0° |
| O3D | P3D | O9A | HO9A | 116.1° | 60.0° |
| O7A | P3D | O9A | O8A | 125.4° | 120.0° |
| O7A | P3D | O8A | HO8A | 0.0° | 60.0° |
| O7A | P3D | O9A | HO9A | 0.0° | 180.0° |
| O9A | P3D | O8A | HO8A | 126.6° | 60.0° |
| O8A | P3D | O9A | HO9A | 125.4° | 60.0° |
| N4P | C3P | H3P | H3PA | 118.5° | 120.0° |
| C3P | N4P | C5P | HN4P | 180.0° | 180.0° |
| C3P | N4P | C5P | C6P | 175.4° | 180.0° |
| C3P | N4P | C5P | O5P | 1.2° | 0.0° |
| H3P | C3P | N4P | C5P | 171.0° | 60.0° |
| H3P | C3P | N4P | HN4P | 9.0° | 120.0° |
| H3PA | C3P | N4P | C5P | 51.0° | 60.0° |
| H3PA | C3P | N4P | HN4P | 129.0° | 120.0° |
| C4A | C5A | C6A | N7A | 179.7° | 180.0° |
| C4A | C5A | C6A | N6A | 178.4° | 180.0° |
| C4A | C5A | N7A | C8A | 0.2° | 0.0° |
| C5A | C4A | N9A | C8A | 0.3° | 0.0° |
| N9A | C4A | C5A | C6A | 179.4° | 180.0° |
| N9A | C4A | C5A | N7A | 0.3° | 0.0° |
| C4A | N9A | C8A | N7A | 0.2° | 0.0° |
| C4A | N9A | C8A | H8A | 179.8° | 180.0° |
| C4B | C5B | C6B | H5B | 180.0° | 180.0° |
| C4B | C5B | C6B | C7B | 0.2° | 0.2° |
| C4B | C5B | C6B | H6B | 179.8° | 179.9° |
| H4B | C4B | C5B | C6B | 179.4° | 180.0° |
| H4B | C4B | C5B | H5B | 0.6° | 0.0° |
| O4D | C4D | C5D | H4D | 124.2° | 122.4° |
| O4D | C4D | C5D | O5D | 66.6° | 69.6° |
| O4D | C4D | C5D | H5D | 53.4° | 170.4° |
| O4D | C4D | C5D | H5DA | 173.4° | 50.4° |
| C4D | C5D | O5D | H5D | 120.0° | 120.0° |
| C4D | C5D | O5D | H5DA | 120.0° | 120.0° |
| C4D | C5D | H5D | H5DA | 120.2° | 120.0° |
| H4D | C4D | C5D | O5D | 169.2° | 52.8° |
| H4D | C4D | C5D | H5D | 70.8° | 67.2° |
| H4D | C4D | C5D | H5DA | 49.2° | 172.8° |
| N4P | C5P | C6P | O5P | 176.6° | 180.0° |
| N4P | C5P | C6P | C7P | 139.4° | 180.0° |
| N4P | C5P | C6P | H6P | 100.6° | 60.0° |
| N4P | C5P | C6P | H6PA | 19.4° | 60.0° |
| HN4P | N4P | C5P | C6P | 4.6° | 0.0° |
| HN4P | N4P | C5P | O5P | 178.8° | 180.0° |
| C5A | C6A | N6A | HN6A | 177.8° | 180.0° |
| C5A | C6A | N6A | HN6B | 57.8° | 0.0° |
| C6A | C5A | N7A | C8A | 179.5° | 180.0° |
| N7A | C5A | C6A | N6A | 1.9° | 0.0° |
| C5A | N7A | C8A | N9A | 0.0° | 0.0° |
| C5A | N7A | C8A | H8A | 180.0° | 180.0° |
| C5B | C6B | C7B | H6B | 180.0° | 179.8° |
| C5B | C6B | C7B | H7B | 180.0° | 180.0° |
| H5B | C5B | C6B | C7B | 179.9° | 179.7° |
| H5B | C5B | C6B | H6B | 0.1° | 0.1° |
| O5D | C5D | H5D | H5DA | 120.2° | 120.0° |
| C5P | C6P | C7P | H6P | 120.0° | 120.0° |
| C5P | C6P | C7P | H6PA | 120.0° | 120.0° |
| C5P | C6P | H6P | H6PA | 119.8° | 120.0° |
| C5P | C6P | C7P | N8P | 165.0° | 180.0° |
| C5P | C6P | C7P | H7P | 45.1° | 60.0° |
| C5P | C6P | C7P | H7PA | 75.0° | 60.0° |
| O5P | C5P | C6P | C7P | 44.0° | 0.0° |
| O5P | C5P | C6P | H6P | 76.0° | 120.0° |
| O5P | C5P | C6P | H6PA | 164.0° | 120.0° |
| C6A | N6A | HN6A | HN6B | 120.0° | 180.0° |
| O6A | CCP | CBP | CAP | 47.5° | 180.0° |
| O6A | CCP | CBP | CEP | 168.0° | 60.0° |
| O6A | CCP | CBP | CDP | 69.1° | 59.9° |
| O6A | CCP | CBP | HCP | 120.0° | 120.0° |
| O6A | CCP | CBP | HCPA | 120.0° | 120.1° |
| O6A | CCP | HCP | HCPA | 119.9° | 119.9° |
| H6B | C6B | C7B | H7B | 0.0° | 0.2° |
| C7P | C6P | H6P | H6PA | 119.8° | 120.0° |
| C6P | C7P | N8P | H7P | 120.0° | 120.0° |
| C6P | C7P | N8P | H7PA | 120.0° | 119.9° |
| C6P | C7P | H7P | H7PA | 118.0° | 120.0° |
| C6P | C7P | N8P | C9P | 101.1° | 180.0° |
| C6P | C7P | N8P | HN8P | 78.9° | 0.0° |
| H6P | C6P | C7P | N8P | 74.9° | 60.0° |
| H6P | C6P | C7P | H7P | 165.1° | 180.0° |
| H6P | C6P | C7P | H7PA | 45.0° | 59.9° |
| H6PA | C6P | C7P | N8P | 45.0° | 60.0° |
| H6PA | C6P | C7P | H7P | 74.9° | 60.0° |
| H6PA | C6P | C7P | H7PA | 165.0° | 180.0° |
| N7A | C8A | N9A | H8A | 180.0° | 180.0° |
| N8P | C7P | H7P | H7PA | 118.0° | 120.0° |
| C7P | N8P | C9P | HN8P | 180.0° | 180.0° |
| C7P | N8P | C9P | O9P | 3.4° | 5.1° |
| C7P | N8P | C9P | CAP | 177.4° | 174.9° |
| H7P | C7P | N8P | C9P | 138.9° | 60.0° |
| H7P | C7P | N8P | HN8P | 41.1° | 120.0° |
| H7PA | C7P | N8P | C9P | 18.9° | 60.1° |
| H7PA | C7P | N8P | HN8P | 161.2° | 120.0° |
| N8P | C9P | O9P | CAP | 173.7° | 180.0° |
| N8P | C9P | CAP | CBP | 113.2° | 108.3° |
| N8P | C9P | CAP | OAP | 9.8° | 11.7° |
| N8P | C9P | CAP | HAP | 127.5° | 131.8° |
| HN8P | N8P | C9P | O9P | 176.6° | 174.9° |
| HN8P | N8P | C9P | CAP | 2.6° | 5.1° |
| O9P | C9P | CAP | CBP | 60.5° | 71.8° |
| O9P | C9P | CAP | OAP | 176.4° | 168.3° |
| O9P | C9P | CAP | HAP | 58.7° | 48.2° |
| C9P | CAP | CBP | OAP | 123.3° | 120.0° |
| C9P | CAP | CBP | HAP | 119.0° | 120.0° |
| C9P | CAP | OAP | HAP | 118.9° | 120.0° |
| C9P | CAP | OAP | HOAP | 180.0° | 59.9° |
| C9P | CAP | CBP | CEP | 56.6° | 54.0° |
| C9P | CAP | CBP | CDP | 68.3° | 65.9° |
| C9P | CAP | CBP | CCP | 175.7° | 174.0° |
| CBP | CAP | OAP | HAP | 119.1° | 120.0° |
| CBP | CAP | OAP | HOAP | 58.1° | 60.0° |
| CAP | CBP | CEP | CDP | 122.1° | 120.0° |
| CAP | CBP | CEP | CCP | 118.3° | 120.0° |
| CAP | CBP | CDP | CCP | 116.1° | 120.0° |
| CAP | CBP | CCP | HCP | 72.5° | 60.0° |
| CAP | CBP | CCP | HCPA | 167.5° | 59.9° |
| CAP | CBP | CDP | HDP | 180.0° | 64.4° |
| CAP | CBP | CDP | HDPA | 60.0° | 175.6° |
| CAP | CBP | CDP | HDPB | 60.0° | 55.7° |
| CAP | CBP | CEP | HEP | 180.0° | 60.0° |
| CAP | CBP | CEP | HEPA | 60.0° | 180.0° |
| CAP | CBP | CEP | HEPB | 60.0° | 60.0° |
| OAP | CAP | CBP | CEP | 66.7° | 65.9° |
| OAP | CAP | CBP | CDP | 168.5° | 174.1° |
| OAP | CAP | CBP | CCP | 52.4° | 54.0° |
| HAP | CAP | OAP | HOAP | 61.1° | 180.0° |
| HAP | CAP | CBP | CEP | 175.6° | 174.1° |
| HAP | CAP | CBP | CDP | 50.8° | 54.1° |
| HAP | CAP | CBP | CCP | 65.2° | 66.0° |
| CEP | CBP | CDP | CCP | 120.3° | 120.0° |
| CEP | CBP | CCP | HCP | 47.9° | 180.0° |
| CEP | CBP | CCP | HCPA | 72.1° | 60.0° |
| CEP | CBP | CDP | HDP | 56.4° | 55.6° |
| CEP | CBP | CDP | HDPA | 176.4° | 64.4° |
| CEP | CBP | CDP | HDPB | 63.6° | 175.7° |
| CBP | CEP | HEP | HEPA | 120.0° | 120.1° |
| CBP | CEP | HEP | HEPB | 120.0° | 120.0° |
| CBP | CEP | HEPA | HEPB | 120.0° | 120.0° |
| CDP | CBP | CCP | HCP | 170.9° | 60.0° |
| CDP | CBP | CCP | HCPA | 50.9° | 180.0° |
| CBP | CDP | HDP | HDPA | 120.0° | 120.0° |
| CBP | CDP | HDP | HDPB | 120.0° | 120.0° |
| CBP | CDP | HDPA | HDPB | 120.0° | 119.9° |
| CDP | CBP | CEP | HEP | 57.9° | 180.0° |
| CDP | CBP | CEP | HEPA | 62.2° | 60.0° |
| CDP | CBP | CEP | HEPB | 177.9° | 60.0° |
| CBP | CCP | HCP | HCPA | 119.9° | 120.0° |
| CCP | CBP | CDP | HDP | 63.9° | 175.6° |
| CCP | CBP | CDP | HDPA | 56.1° | 55.5° |
| CCP | CBP | CDP | HDPB | 176.1° | 64.4° |
| CCP | CBP | CEP | HEP | 61.7° | 60.0° |
| CCP | CBP | CEP | HEPA | 178.3° | 60.0° |
| CCP | CBP | CEP | HEPB | 58.3° | 180.0° |
| HDP | CDP | HDPA | HDPB | 120.0° | 120.0° |
| HEP | CEP | HEPA | HEPB | 120.0° | 120.0° |
