A16
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1A | C2A | sing | 1.53Å | 1.61Å | |
| C1A | N4B | sing | 1.47Å | 1.48Å | |
| C1A | C7A | sing | 1.53Å | 1.58Å | |
| C1B | C2B | sing | 1.53Å | 1.58Å | |
| C1B | O4C | sing | 1.43Å | 1.48Å | |
| C1B | O5B | sing | 1.43Å | 1.50Å | |
| C1C | C2C | sing | 1.53Å | 1.55Å | |
| C1C | O5C | sing | 1.43Å | 1.47Å | |
| C1C | OXT | sing | 1.43Å | 1.40Å | |
| C2A | O2A | sing | 1.43Å | 1.44Å | |
| C2A | C3A | sing | 1.53Å | 1.57Å | |
| C2B | O2B | sing | 1.43Å | 1.44Å | |
| C2B | C3B | sing | 1.53Å | 1.55Å | |
| C2C | O2C | sing | 1.43Å | 1.43Å | |
| C2C | C3C | sing | 1.53Å | 1.55Å | |
| C3A | O3A | sing | 1.43Å | 1.44Å | |
| C3A | C4A | sing | 1.53Å | 1.57Å | |
| C3B | O3B | sing | 1.43Å | 1.44Å | |
| C3B | C4B | sing | 1.53Å | 1.59Å | |
| C3C | O3C | sing | 1.43Å | 1.43Å | |
| C3C | C4C | sing | 1.53Å | 1.60Å | |
| C4A | O4A | sing | 1.43Å | 1.44Å | |
| C4A | C5A | sing | 1.53Å | 1.55Å | |
| C4B | N4B | sing | 1.47Å | 1.51Å | |
| C4B | C5B | sing | 1.53Å | 1.58Å | |
| C4C | O4C | sing | 1.43Å | 1.48Å | |
| C4C | C5C | sing | 1.53Å | 1.55Å | |
| C5A | C6A | sing | 1.53Å | 1.52Å | |
| C5A | C7A | sing | 1.53Å | 1.38Å | |
| C5B | O5B | sing | 1.43Å | 1.47Å | |
| C5B | C6B | sing | 1.53Å | 1.54Å | |
| C5C | O5C | sing | 1.43Å | 1.46Å | |
| C5C | C6C | sing | 1.53Å | 1.54Å | |
| C6A | O6A | sing | 1.43Å | 1.44Å | |
| C6C | O6C | sing | 1.43Å | 1.44Å | |
| C1A | H1A | sing | 1.09Å | 1.10Å | |
| C2A | H2A | sing | 1.09Å | 1.10Å | |
| N4B | H4B | sing | 1.01Å | 1.00Å | |
| C7A | H7A1 | sing | 1.09Å | 1.10Å | |
| C7A | H7A2 | sing | 1.09Å | 1.10Å | |
| C1B | H1B | sing | 1.09Å | 1.10Å | |
| C2B | H2B | sing | 1.09Å | 1.10Å | |
| C1C | H1C | sing | 1.09Å | 1.10Å | |
| C2C | H2C | sing | 1.09Å | 1.10Å | |
| OXT | HOT | sing | 0.97Å | 0.95Å | |
| O2A | HA | sing | 0.97Å | 0.95Å | |
| C3A | H3A | sing | 1.09Å | 1.10Å | |
| O2B | HB | sing | 0.97Å | 0.95Å | |
| C3B | H3B | sing | 1.09Å | 1.10Å | |
| O2C | HC | sing | 0.97Å | 0.95Å | |
| C3C | H3C | sing | 1.09Å | 1.10Å | |
| O3A | HD | sing | 0.97Å | 0.95Å | |
| C4A | H4A | sing | 1.09Å | 1.10Å | |
| O3B | HE | sing | 0.97Å | 0.95Å | |
| C4B | HF | sing | 1.09Å | 1.10Å | |
| O3C | HG | sing | 0.97Å | 0.95Å | |
| C4C | H4C | sing | 1.09Å | 1.10Å | |
| O4A | HH | sing | 0.97Å | 0.95Å | |
| C5B | H5B | sing | 1.09Å | 1.10Å | |
| C5C | H5C | sing | 1.09Å | 1.10Å | |
| C6A | H6A1 | sing | 1.09Å | 1.10Å | |
| C6A | H6A2 | sing | 1.09Å | 1.10Å | |
| C6B | H6B1 | sing | 1.09Å | 1.10Å | |
| C6B | H6B2 | sing | 1.09Å | 1.10Å | |
| C6B | H6B3 | sing | 1.09Å | 1.10Å | |
| C6C | H6C1 | sing | 1.09Å | 1.10Å | |
| C6C | H6C2 | sing | 1.09Å | 1.10Å | |
| O6A | H6A | sing | 0.97Å | 0.95Å | |
| O6C | H6C | sing | 0.97Å | 0.95Å | |
| C5A | H5A | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2A | C1A | N4B | 111.0° | 109.5° |
| C2A | C1A | C7A | 110.2° | 109.5° |
| C1A | C2A | O2A | 111.0° | 109.5° |
| C1A | C2A | C3A | 111.9° | 109.5° |
| C2A | C1A | H1A | 108.6° | 109.5° |
| C1A | C2A | H2A | 106.5° | 109.5° |
| N4B | C1A | C7A | 111.4° | 109.5° |
| C1A | N4B | C4B | 128.2° | 111.0° |
| N4B | C1A | H1A | 107.3° | 109.4° |
| C1A | N4B | H4B | 103.7° | 111.0° |
| C1A | C7A | C5A | 117.8° | 109.5° |
| C7A | C1A | H1A | 108.2° | 109.5° |
| C1A | C7A | H7A1 | 106.8° | 109.5° |
| C1A | C7A | H7A2 | 104.8° | 109.5° |
| C2B | C1B | O4C | 108.7° | 109.5° |
| C2B | C1B | O5B | 110.7° | 109.4° |
| C1B | C2B | O2B | 111.1° | 109.5° |
| C1B | C2B | C3B | 108.7° | 109.2° |
| C2B | C1B | H1B | 108.7° | 109.5° |
| C1B | C2B | H2B | 109.4° | 109.5° |
| O4C | C1B | O5B | 107.8° | 109.5° |
| C1B | O4C | C4C | 123.6° | 114.0° |
| O4C | C1B | H1B | 111.5° | 109.5° |
| C1B | O5B | C5B | 113.9° | 114.1° |
| O5B | C1B | H1B | 109.6° | 109.5° |
| C2C | C1C | O5C | 111.0° | 109.4° |
| C2C | C1C | OXT | 112.1° | 109.5° |
| C1C | C2C | O2C | 109.7° | 109.5° |
| C1C | C2C | C3C | 109.4° | 109.2° |
| C2C | C1C | H1C | 107.6° | 109.5° |
| C1C | C2C | H2C | 110.4° | 109.5° |
| O5C | C1C | OXT | 112.2° | 109.5° |
| C1C | O5C | C5C | 116.0° | 114.1° |
| O5C | C1C | H1C | 107.4° | 109.4° |
| OXT | C1C | H1C | 106.2° | 109.5° |
| C1C | OXT | HOT | 109.5° | 114.0° |
| O2A | C2A | C3A | 108.6° | 109.5° |
| O2A | C2A | H2A | 109.9° | 109.4° |
| C2A | O2A | HA | 109.5° | 114.0° |
| C2A | C3A | O3A | 112.8° | 109.5° |
| C2A | C3A | C4A | 110.4° | 109.4° |
| C3A | C2A | H2A | 109.0° | 109.4° |
| C2A | C3A | H3A | 106.8° | 109.4° |
| O2B | C2B | C3B | 110.9° | 109.5° |
| O2B | C2B | H2B | 107.2° | 109.6° |
| C2B | O2B | HB | 109.5° | 114.0° |
| C2B | C3B | O3B | 109.5° | 109.5° |
| C2B | C3B | C4B | 109.6° | 109.0° |
| C3B | C2B | H2B | 109.6° | 109.6° |
| C2B | C3B | H3B | 110.1° | 109.6° |
| O2C | C2C | C3C | 112.3° | 109.5° |
| O2C | C2C | H2C | 107.4° | 109.5° |
| C2C | O2C | HC | 109.5° | 114.0° |
| C2C | C3C | O3C | 108.7° | 109.6° |
| C2C | C3C | C4C | 109.1° | 109.1° |
| C3C | C2C | H2C | 107.6° | 109.5° |
| C2C | C3C | H3C | 111.0° | 109.5° |
| O3A | C3A | C4A | 110.1° | 109.5° |
| O3A | C3A | H3A | 107.1° | 109.5° |
| C3A | O3A | HD | 109.5° | 113.9° |
| C3A | C4A | O4A | 111.6° | 109.5° |
| C3A | C4A | C5A | 109.6° | 109.5° |
| C4A | C3A | H3A | 109.6° | 109.5° |
| C3A | C4A | H4A | 108.9° | 109.5° |
| O3B | C3B | C4B | 111.4° | 109.5° |
| O3B | C3B | H3B | 108.1° | 109.6° |
| C3B | O3B | HE | 109.5° | 114.0° |
| C3B | C4B | N4B | 112.6° | 109.6° |
| C3B | C4B | C5B | 109.3° | 109.2° |
| C4B | C3B | H3B | 108.1° | 109.6° |
| C3B | C4B | HF | 107.3° | 109.5° |
| O3C | C3C | C4C | 111.9° | 109.6° |
| O3C | C3C | H3C | 108.2° | 109.5° |
| C3C | O3C | HG | 109.5° | 114.0° |
| C3C | C4C | O4C | 114.5° | 109.5° |
| C3C | C4C | C5C | 107.8° | 109.2° |
| C4C | C3C | H3C | 107.9° | 109.6° |
| C3C | C4C | H4C | 106.8° | 109.5° |
| O4A | C4A | C5A | 112.2° | 109.5° |
| O4A | C4A | H4A | 106.1° | 109.5° |
| C4A | O4A | HH | 109.5° | 114.0° |
| C4A | C5A | C6A | 120.1° | 109.5° |
| C4A | C5A | C7A | 118.3° | 109.5° |
| C5A | C4A | H4A | 108.2° | 109.5° |
| C4A | C5A | H5A | 137.9° | 109.5° |
| N4B | C4B | C5B | 109.0° | 109.5° |
| C4B | N4B | H4B | 103.7° | 110.9° |
| N4B | C4B | HF | 107.6° | 109.6° |
| C4B | C5B | O5B | 110.1° | 109.4° |
| C4B | C5B | C6B | 110.8° | 109.5° |
| C5B | C4B | HF | 111.0° | 109.5° |
| C4B | C5B | H5B | 108.4° | 109.4° |
| O4C | C4C | C5C | 108.2° | 109.5° |
| O4C | C4C | H4C | 106.4° | 109.5° |
| C4C | C5C | O5C | 110.4° | 109.4° |
| C4C | C5C | C6C | 111.1° | 109.5° |
| C5C | C4C | H4C | 113.3° | 109.6° |
| C4C | C5C | H5C | 107.8° | 109.5° |
| C6A | C5A | C7A | 121.6° | 109.5° |
| C5A | C6A | O6A | 111.8° | 109.5° |
| C5A | C6A | H6A1 | 108.7° | 109.5° |
| C5A | C6A | H6A2 | 108.2° | 109.5° |
| C6A | C5A | H5A | 41.5° | 109.5° |
| C5A | C7A | H7A1 | 106.8° | 109.4° |
| C5A | C7A | H7A2 | 104.8° | 109.4° |
| C7A | C5A | H5A | 92.3° | 109.4° |
| O5B | C5B | C6B | 110.3° | 109.5° |
| O5B | C5B | H5B | 108.9° | 109.5° |
| C6B | C5B | H5B | 108.3° | 109.5° |
| C5B | C6B | H6B1 | 109.5° | 109.5° |
| C5B | C6B | H6B2 | 109.4° | 109.4° |
| C5B | C6B | H6B3 | 109.5° | 109.5° |
| O5C | C5C | C6C | 109.9° | 109.5° |
| O5C | C5C | H5C | 109.1° | 109.4° |
| C5C | C6C | O6C | 110.2° | 109.5° |
| C6C | C5C | H5C | 108.4° | 109.5° |
| C5C | C6C | H6C1 | 109.2° | 109.4° |
| C5C | C6C | H6C2 | 109.1° | 109.5° |
| O6A | C6A | H6A1 | 108.7° | 109.4° |
| O6A | C6A | H6A2 | 108.2° | 109.4° |
| C6A | O6A | H6A | 109.5° | 114.0° |
| O6C | C6C | H6C1 | 109.2° | 109.5° |
| O6C | C6C | H6C2 | 109.1° | 109.4° |
| C6C | O6C | H6C | 109.5° | 114.0° |
| H7A1 | C7A | H7A2 | 116.3° | 109.5° |
| H6A1 | C6A | H6A2 | 111.3° | 109.5° |
| H6B1 | C6B | H6B2 | 109.5° | 109.5° |
| H6B1 | C6B | H6B3 | 109.4° | 109.5° |
| H6B2 | C6B | H6B3 | 109.5° | 109.5° |
| H6C1 | C6C | H6C2 | 110.1° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2A | C1A | N4B | C7A | 123.1° | 120.1° |
| C2A | C1A | N4B | H1A | 118.6° | 120.0° |
| C2A | C1A | C7A | H1A | 118.6° | 120.0° |
| C1A | C2A | O2A | C3A | 123.4° | 120.0° |
| C1A | C2A | O2A | H2A | 117.5° | 120.0° |
| C1A | C2A | C3A | H2A | 117.5° | 120.0° |
| C1A | C2A | C3A | O3A | 179.3° | 180.0° |
| C1A | C2A | C3A | C4A | 57.1° | 60.0° |
| C2A | C1A | N4B | C4B | 179.7° | 97.0° |
| C2A | C1A | C7A | C5A | 40.9° | 60.0° |
| C2A | C1A | N4B | H4B | 59.7° | 26.8° |
| C2A | C1A | C7A | H7A1 | 160.9° | 60.0° |
| C2A | C1A | C7A | H7A2 | 75.1° | 180.0° |
| C1A | C2A | O2A | HA | 60.8° | 180.0° |
| C1A | C2A | C3A | H3A | 61.9° | 60.0° |
| N4B | C1A | C7A | H1A | 117.8° | 120.0° |
| N4B | C1A | C2A | O2A | 9.3° | 60.0° |
| N4B | C1A | C2A | C3A | 112.2° | 60.0° |
| C1A | N4B | C4B | C3B | 58.3° | 138.4° |
| C1A | N4B | C4B | H4B | 120.0° | 123.9° |
| C1A | N4B | C4B | C5B | 179.8° | 101.9° |
| N4B | C1A | C7A | C5A | 164.6° | 60.0° |
| N4B | C1A | C2A | H2A | 128.9° | 180.0° |
| N4B | C1A | C7A | H7A1 | 75.5° | 180.0° |
| N4B | C1A | C7A | H7A2 | 48.5° | 60.0° |
| C1A | N4B | C4B | HF | 59.7° | 18.2° |
| C7A | C1A | C2A | O2A | 133.2° | 180.0° |
| C7A | C1A | C2A | C3A | 11.7° | 60.0° |
| C1A | C7A | C5A | C4A | 47.2° | 60.0° |
| C7A | C1A | N4B | C4B | 57.1° | 142.9° |
| C1A | C7A | C5A | C6A | 131.6° | 180.0° |
| C1A | C7A | C5A | H7A1 | 120.0° | 120.0° |
| C1A | C7A | C5A | H7A2 | 116.1° | 120.1° |
| C7A | C1A | C2A | H2A | 107.3° | 60.0° |
| C7A | C1A | N4B | H4B | 177.1° | 93.2° |
| C1A | C7A | H7A1 | H7A2 | 116.6° | 120.1° |
| C1A | C7A | C5A | H5A | 162.8° | 60.0° |
| C2B | C1B | O4C | O5B | 120.0° | 119.9° |
| C2B | C1B | O4C | H1B | 119.7° | 120.0° |
| C2B | C1B | O5B | H1B | 119.8° | 120.0° |
| C1B | C2B | O2B | C3B | 120.9° | 119.7° |
| C1B | C2B | O2B | H2B | 119.5° | 120.1° |
| C1B | C2B | C3B | H2B | 119.5° | 119.9° |
| C1B | C2B | C3B | O3B | 179.6° | 176.8° |
| C1B | C2B | C3B | C4B | 57.9° | 57.0° |
| C2B | C1B | O4C | C4C | 147.1° | 167.5° |
| C2B | C1B | O5B | C5B | 58.6° | 61.2° |
| C1B | C2B | O2B | HB | 136.8° | 60.0° |
| C1B | C2B | C3B | H3B | 60.9° | 63.0° |
| O4C | C1B | O5B | H1B | 121.5° | 120.0° |
| O4C | C1B | C2B | O2B | 61.5° | 57.5° |
| O4C | C1B | C2B | C3B | 60.8° | 62.4° |
| C1B | O4C | C4C | C3C | 61.5° | 85.6° |
| C1B | O4C | C4C | C5C | 178.3° | 154.7° |
| O4C | C1B | O5B | C5B | 60.1° | 58.9° |
| O4C | C1B | C2B | H2B | 179.6° | 177.7° |
| C1B | O4C | C4C | H4C | 56.3° | 34.5° |
| O5B | C1B | C2B | O2B | 179.6° | 177.5° |
| O5B | C1B | C2B | C3B | 57.4° | 57.6° |
| C1B | O5B | C5B | C4B | 58.0° | 61.1° |
| O5B | C1B | O4C | C4C | 93.0° | 72.6° |
| C1B | O5B | C5B | C6B | 179.5° | 178.9° |
| O5B | C1B | C2B | H2B | 62.3° | 62.4° |
| C1B | O5B | C5B | H5B | 60.8° | 58.8° |
| C2C | C1C | O5C | OXT | 126.2° | 120.0° |
| C2C | C1C | O5C | H1C | 117.4° | 119.9° |
| C2C | C1C | OXT | H1C | 117.3° | 120.0° |
| C1C | C2C | O2C | C3C | 122.0° | 119.7° |
| C1C | C2C | O2C | H2C | 119.9° | 120.1° |
| C1C | C2C | C3C | H2C | 119.9° | 119.9° |
| C1C | C2C | C3C | O3C | 179.5° | 176.8° |
| C1C | C2C | C3C | C4C | 58.3° | 56.9° |
| C2C | C1C | O5C | C5C | 55.5° | 61.1° |
| C2C | C1C | OXT | HOT | 12.0° | 180.0° |
| C1C | C2C | O2C | HC | 148.9° | 60.0° |
| C1C | C2C | C3C | H3C | 60.5° | 63.0° |
| O5C | C1C | OXT | H1C | 117.1° | 120.0° |
| O5C | C1C | C2C | O2C | 178.6° | 177.5° |
| O5C | C1C | C2C | C3C | 54.9° | 57.6° |
| C1C | O5C | C5C | C4C | 57.2° | 61.1° |
| C1C | O5C | C5C | C6C | 179.8° | 178.9° |
| O5C | C1C | C2C | H2C | 63.3° | 62.4° |
| O5C | C1C | OXT | HOT | 113.6° | 60.0° |
| C1C | O5C | C5C | H5C | 61.1° | 58.8° |
| OXT | C1C | C2C | O2C | 55.1° | 62.5° |
| OXT | C1C | C2C | C3C | 178.8° | 177.6° |
| OXT | C1C | O5C | C5C | 178.3° | 178.8° |
| OXT | C1C | C2C | H2C | 63.0° | 57.7° |
| O2A | C2A | C3A | H2A | 119.7° | 119.9° |
| O2A | C2A | C3A | O3A | 56.5° | 60.0° |
| O2A | C2A | C3A | C4A | 180.0° | 180.0° |
| O2A | C2A | C1A | H1A | 108.5° | 60.0° |
| O2A | C2A | C3A | H3A | 60.9° | 60.0° |
| C2A | C3A | O3A | C4A | 123.7° | 120.0° |
| C2A | C3A | O3A | H3A | 117.2° | 120.0° |
| C2A | C3A | C4A | H3A | 117.3° | 119.9° |
| C2A | C3A | C4A | O4A | 178.1° | 180.0° |
| C2A | C3A | C4A | C5A | 53.0° | 60.0° |
| C3A | C2A | C1A | H1A | 130.1° | 180.0° |
| C3A | C2A | O2A | HA | 175.8° | 60.0° |
| C2A | C3A | O3A | HD | 4.7° | 180.0° |
| C2A | C3A | C4A | H4A | 65.2° | 60.0° |
| O2B | C2B | C3B | H2B | 118.1° | 120.2° |
| O2B | C2B | C3B | O3B | 57.2° | 63.3° |
| O2B | C2B | C3B | C4B | 179.8° | 176.9° |
| O2B | C2B | C1B | H1B | 60.0° | 62.5° |
| O2B | C2B | C3B | H3B | 61.5° | 56.9° |
| C2B | C3B | O3B | C4B | 121.4° | 119.6° |
| C2B | C3B | O3B | H3B | 120.0° | 120.2° |
| C2B | C3B | C4B | H3B | 120.0° | 119.9° |
| C2B | C3B | C4B | N4B | 179.3° | 176.9° |
| C2B | C3B | C4B | C5B | 57.9° | 56.9° |
| C3B | C2B | C1B | H1B | 177.7° | 177.6° |
| C3B | C2B | O2B | HB | 102.3° | 179.7° |
| C2B | C3B | O3B | HE | 119.9° | 60.0° |
| C2B | C3B | C4B | HF | 62.5° | 62.9° |
| O2C | C2C | C3C | H2C | 118.0° | 120.1° |
| O2C | C2C | C3C | O3C | 57.4° | 63.2° |
| O2C | C2C | C3C | C4C | 179.7° | 176.9° |
| O2C | C2C | C1C | H1C | 61.3° | 57.6° |
| O2C | C2C | C3C | H3C | 61.6° | 56.9° |
| C2C | C3C | O3C | C4C | 120.6° | 119.6° |
| C2C | C3C | O3C | H3C | 120.7° | 120.2° |
| C2C | C3C | C4C | H3C | 120.7° | 119.9° |
| C2C | C3C | C4C | O4C | 179.7° | 176.9° |
| C2C | C3C | C4C | C5C | 59.2° | 56.9° |
| C3C | C2C | C1C | H1C | 62.3° | 62.4° |
| C3C | C2C | O2C | HC | 27.0° | 179.7° |
| C2C | C3C | O3C | HG | 177.9° | 60.0° |
| C2C | C3C | C4C | H4C | 62.8° | 63.0° |
| O3A | C3A | C4A | H3A | 117.5° | 120.1° |
| O3A | C3A | C4A | O4A | 56.8° | 60.0° |
| O3A | C3A | C4A | C5A | 178.2° | 180.0° |
| O3A | C3A | C2A | H2A | 63.2° | 59.9° |
| O3A | C3A | C4A | H4A | 59.9° | 60.0° |
| C3A | C4A | O4A | C5A | 123.6° | 120.0° |
| C3A | C4A | O4A | H4A | 118.4° | 120.0° |
| C3A | C4A | C5A | H4A | 118.6° | 120.0° |
| C3A | C4A | C5A | C6A | 179.3° | 180.0° |
| C3A | C4A | C5A | C7A | 1.8° | 60.0° |
| C4A | C3A | C2A | H2A | 60.3° | 60.1° |
| C4A | C3A | O3A | HD | 128.5° | 60.1° |
| C3A | C4A | O4A | HH | 19.4° | 60.0° |
| C3A | C4A | C5A | H5A | 129.9° | 60.0° |
| O3B | C3B | C4B | H3B | 118.7° | 120.2° |
| O3B | C3B | C4B | N4B | 59.3° | 63.3° |
| O3B | C3B | C4B | C5B | 179.3° | 176.8° |
| O3B | C3B | C2B | H2B | 60.9° | 56.9° |
| O3B | C3B | C4B | HF | 58.9° | 56.9° |
| C3B | C4B | N4B | C5B | 121.5° | 119.7° |
| C3B | C4B | N4B | HF | 118.0° | 120.1° |
| C3B | C4B | C5B | HF | 118.2° | 119.9° |
| C3B | C4B | C5B | O5B | 56.5° | 57.5° |
| C3B | C4B | C5B | C6B | 178.8° | 177.6° |
| C3B | C4B | N4B | H4B | 61.7° | 14.5° |
| C4B | C3B | C2B | H2B | 61.6° | 62.9° |
| C4B | C3B | O3B | HE | 118.7° | 179.6° |
| C3B | C4B | C5B | H5B | 62.6° | 62.4° |
| O3C | C3C | C4C | H3C | 118.9° | 120.2° |
| O3C | C3C | C4C | O4C | 59.9° | 63.2° |
| O3C | C3C | C4C | C5C | 179.6° | 176.8° |
| O3C | C3C | C2C | H2C | 60.6° | 56.9° |
| O3C | C3C | C4C | H4C | 57.5° | 56.9° |
| C3C | C4C | O4C | C5C | 120.2° | 119.7° |
| C3C | C4C | O4C | H4C | 117.7° | 120.1° |
| C3C | C4C | C5C | H4C | 118.0° | 119.9° |
| C3C | C4C | C5C | O5C | 56.9° | 57.6° |
| C3C | C4C | C5C | C6C | 179.2° | 177.6° |
| C4C | C3C | C2C | H2C | 61.7° | 63.0° |
| C4C | C3C | O3C | HG | 57.3° | 179.6° |
| C3C | C4C | C5C | H5C | 62.2° | 62.4° |
| O4A | C4A | C5A | H4A | 116.7° | 120.0° |
| O4A | C4A | C5A | C6A | 54.7° | 60.0° |
| O4A | C4A | C5A | C7A | 126.5° | 180.0° |
| O4A | C4A | C3A | H3A | 60.7° | 60.0° |
| O4A | C4A | C5A | H5A | 5.2° | 60.0° |
| C4A | C5A | C6A | C7A | 178.8° | 120.0° |
| C4A | C5A | C6A | H5A | 129.8° | 120.0° |
| C4A | C5A | C7A | H5A | 149.9° | 120.0° |
| C4A | C5A | C6A | O6A | 179.4° | 65.0° |
| C4A | C5A | C7A | H7A1 | 167.2° | 60.0° |
| C4A | C5A | C7A | H7A2 | 68.9° | 179.9° |
| C5A | C4A | C3A | H3A | 64.3° | 60.0° |
| C5A | C4A | O4A | HH | 142.9° | 180.0° |
| C4A | C5A | C6A | H6A1 | 60.6° | 55.0° |
| C4A | C5A | C6A | H6A2 | 60.3° | 175.0° |
| N4B | C4B | C5B | HF | 118.3° | 120.2° |
| N4B | C4B | C5B | O5B | 180.0° | 177.5° |
| N4B | C4B | C5B | C6B | 57.7° | 62.5° |
| C4B | N4B | C1A | H1A | 61.2° | 22.9° |
| N4B | C4B | C3B | H3B | 59.3° | 57.0° |
| N4B | C4B | C5B | H5B | 60.9° | 57.5° |
| C4B | C5B | O5B | C6B | 122.5° | 120.0° |
| C4B | C5B | O5B | H5B | 118.8° | 119.9° |
| C4B | C5B | C6B | H5B | 118.7° | 120.0° |
| C5B | C4B | N4B | H4B | 59.8° | 134.2° |
| C5B | C4B | C3B | H3B | 62.0° | 63.0° |
| C4B | C5B | C6B | H6B1 | 135.9° | 56.1° |
| C4B | C5B | C6B | H6B2 | 15.9° | 176.1° |
| C4B | C5B | C6B | H6B3 | 104.1° | 63.9° |
| O4C | C4C | C5C | H4C | 117.7° | 120.1° |
| O4C | C4C | C5C | O5C | 178.7° | 177.5° |
| O4C | C4C | C5C | C6C | 56.5° | 62.5° |
| C4C | O4C | C1B | H1B | 27.3° | 47.5° |
| O4C | C4C | C3C | H3C | 59.0° | 57.0° |
| O4C | C4C | C5C | H5C | 62.2° | 57.6° |
| C4C | C5C | O5C | C6C | 123.0° | 120.0° |
| C4C | C5C | O5C | H5C | 118.3° | 119.9° |
| C4C | C5C | C6C | H5C | 118.3° | 120.0° |
| C4C | C5C | C6C | O6C | 76.5° | 176.0° |
| C5C | C4C | C3C | H3C | 61.5° | 63.0° |
| C4C | C5C | C6C | H6C1 | 163.5° | 56.0° |
| C4C | C5C | C6C | H6C2 | 43.2° | 64.1° |
| C6A | C5A | C7A | H5A | 31.2° | 120.0° |
| C5A | C6A | O6A | H6A1 | 120.0° | 120.0° |
| C5A | C6A | O6A | H6A2 | 119.0° | 120.0° |
| C6A | C5A | C7A | H7A1 | 11.6° | 60.0° |
| C6A | C5A | C7A | H7A2 | 112.3° | 60.0° |
| C6A | C5A | C4A | H4A | 62.1° | 60.0° |
| C5A | C6A | H6A1 | H6A2 | 119.1° | 120.1° |
| C5A | C6A | O6A | H6A | 136.6° | 180.0° |
| C7A | C5A | C6A | O6A | 0.5° | 175.0° |
| C5A | C7A | C1A | H1A | 77.7° | 180.0° |
| C5A | C7A | H7A1 | H7A2 | 116.6° | 119.9° |
| C7A | C5A | C4A | H4A | 116.8° | 60.0° |
| C7A | C5A | C6A | H6A1 | 120.5° | 65.0° |
| C7A | C5A | C6A | H6A2 | 118.5° | 55.1° |
| O5B | C5B | C6B | H5B | 119.1° | 120.1° |
| C5B | O5B | C1B | H1B | 178.4° | 178.9° |
| O5B | C5B | C4B | HF | 61.7° | 62.3° |
| O5B | C5B | C6B | H6B1 | 101.9° | 63.8° |
| O5B | C5B | C6B | H6B2 | 138.1° | 56.2° |
| O5B | C5B | C6B | H6B3 | 18.1° | 176.1° |
| C6B | C5B | C4B | HF | 60.6° | 57.7° |
| C5B | C6B | H6B1 | H6B2 | 120.0° | 120.0° |
| C5B | C6B | H6B1 | H6B3 | 120.0° | 120.0° |
| C5B | C6B | H6B2 | H6B3 | 120.0° | 120.0° |
| O5C | C5C | C6C | H5C | 119.2° | 120.0° |
| O5C | C5C | C6C | O6C | 46.1° | 64.0° |
| C5C | O5C | C1C | H1C | 61.8° | 58.8° |
| O5C | C5C | C4C | H4C | 61.0° | 62.4° |
| O5C | C5C | C6C | H6C1 | 73.9° | 175.9° |
| O5C | C5C | C6C | H6C2 | 165.8° | 55.9° |
| C5C | C6C | O6C | H6C1 | 120.0° | 120.0° |
| C5C | C6C | O6C | H6C2 | 119.7° | 120.0° |
| C6C | C5C | C4C | H4C | 61.3° | 57.6° |
| C5C | C6C | H6C1 | H6C2 | 119.7° | 120.0° |
| C5C | C6C | O6C | H6C | 73.7° | 180.0° |
| O6A | C6A | H6A1 | H6A2 | 119.1° | 119.9° |
| O6A | C6A | C5A | H5A | 50.9° | 55.0° |
| O6C | C6C | C5C | H5C | 165.2° | 56.0° |
| O6C | C6C | H6C1 | H6C2 | 119.7° | 120.0° |
| H1A | C1A | C2A | H2A | 11.1° | 60.0° |
| H1A | C1A | N4B | H4B | 58.8° | 146.8° |
| H1A | C1A | C7A | H7A1 | 42.3° | 60.1° |
| H1A | C1A | C7A | H7A2 | 166.2° | 60.0° |
| H2A | C2A | O2A | HA | 56.7° | 60.0° |
| H2A | C2A | C3A | H3A | 179.4° | 179.9° |
| H4B | N4B | C4B | HF | 179.8° | 105.7° |
| H7A1 | C7A | C5A | H5A | 42.8° | 180.0° |
| H7A2 | C7A | C5A | H5A | 81.1° | 60.1° |
| H1B | C1B | C2B | H2B | 58.1° | 57.6° |
| H2B | C2B | O2B | HB | 17.3° | 60.1° |
| H2B | C2B | C3B | H3B | 179.6° | 177.1° |
| H1C | C1C | C2C | H2C | 179.4° | 177.7° |
| H1C | C1C | OXT | HOT | 129.3° | 60.0° |
| H2C | C2C | O2C | HC | 91.1° | 60.1° |
| H2C | C2C | C3C | H3C | 179.6° | 177.1° |
| H3A | C3A | O3A | HD | 112.4° | 60.0° |
| H3A | C3A | C4A | H4A | 177.5° | 180.0° |
| H3B | C3B | O3B | HE | 0.1° | 60.1° |
| H3B | C3B | C4B | HF | 177.5° | 177.2° |
| H3C | C3C | O3C | HG | 61.4° | 60.2° |
| H3C | C3C | C4C | H4C | 176.5° | 177.1° |
| H4A | C4A | O4A | HH | 99.0° | 60.0° |
| H4A | C4A | C5A | H5A | 111.5° | 180.0° |
| HF | C4B | C5B | H5B | 179.2° | 177.7° |
| H4C | C4C | C5C | H5C | 179.9° | 177.7° |
| H5B | C5B | C6B | H6B1 | 17.2° | 176.1° |
| H5B | C5B | C6B | H6B2 | 102.8° | 63.9° |
| H5B | C5B | C6B | H6B3 | 137.2° | 56.0° |
| H5C | C5C | C6C | H6C1 | 45.2° | 64.1° |
| H5C | C5C | C6C | H6C2 | 75.1° | 175.9° |
| H6A1 | C6A | O6A | H6A | 16.6° | 60.0° |
| H6A1 | C6A | C5A | H5A | 69.1° | 175.0° |
| H6A2 | C6A | O6A | H6A | 104.4° | 60.0° |
| H6A2 | C6A | C5A | H5A | 169.9° | 64.9° |
| H6B1 | C6B | H6B2 | H6B3 | 120.0° | 120.0° |
| H6C1 | C6C | O6C | H6C | 46.3° | 60.0° |
| H6C2 | C6C | O6C | H6C | 166.6° | 60.0° |
