04D
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CA | N | sing | 1.47Å | 1.45Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| C | O | sing | 1.43Å | 1.48Å | |
| O | HO6 | sing | 0.97Å | 0.95Å | |
| O7 | C27 | sing | 1.43Å | 1.50Å | |
| O7 | HO7 | sing | 0.97Å | 0.95Å | |
| C | CA | sing | 1.53Å | 1.62Å | |
| C26 | CA | sing | 1.53Å | 1.57Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| C29 | C | sing | 1.53Å | 1.71Å | |
| C | H21 | sing | 1.09Å | 1.10Å | |
| C26 | C23 | sing | 1.53Å | 1.59Å | |
| C23 | C25 | sing | 1.53Å | 1.52Å | |
| C23 | C24 | sing | 1.53Å | 1.56Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C24 | H24B | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C25 | H25B | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| C29 | C27 | sing | 1.53Å | 1.66Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C29 | C28 | sing | 1.53Å | 1.61Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C28 | H28B | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| N | H2 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | H | 109.5° | 111.0° |
| N | CA | C | 117.4° | 109.5° |
| N | CA | C26 | 104.2° | 109.4° |
| N | CA | HA | 107.4° | 109.4° |
| CA | N | H2 | 109.5° | 111.0° |
| H | N | H2 | 109.4° | 111.0° |
| C | O | HO6 | 109.5° | 113.9° |
| O | C | CA | 97.9° | 109.5° |
| O | C | C29 | 95.1° | 109.5° |
| O | C | H21 | 114.7° | 109.5° |
| C27 | O7 | HO7 | 109.5° | 114.0° |
| O7 | C27 | C29 | 114.4° | 109.5° |
| O7 | C27 | H27 | 108.2° | 109.5° |
| O7 | C27 | H27A | 108.2° | 109.5° |
| C | CA | C26 | 115.4° | 109.5° |
| C | CA | HA | 105.6° | 109.5° |
| CA | C | C29 | 123.3° | 109.5° |
| CA | C | H21 | 112.5° | 109.5° |
| C26 | CA | HA | 106.0° | 109.5° |
| CA | C26 | C23 | 117.5° | 109.5° |
| CA | C26 | H26 | 107.4° | 109.5° |
| CA | C26 | H26A | 107.4° | 109.5° |
| C29 | C | H21 | 111.2° | 109.4° |
| C | C29 | C27 | 123.9° | 109.5° |
| C | C29 | C28 | 114.0° | 109.4° |
| C | C29 | H29 | 103.6° | 109.5° |
| C26 | C23 | C25 | 108.7° | 109.4° |
| C26 | C23 | C24 | 117.4° | 109.5° |
| C26 | C23 | H23 | 107.8° | 109.4° |
| C23 | C26 | H26 | 107.4° | 109.4° |
| C23 | C26 | H26A | 107.4° | 109.5° |
| C25 | C23 | C24 | 105.9° | 109.5° |
| C25 | C23 | H23 | 108.7° | 109.5° |
| C23 | C25 | H25 | 109.5° | 109.5° |
| C23 | C25 | H25A | 109.5° | 109.5° |
| C23 | C25 | H25B | 109.5° | 109.5° |
| C24 | C23 | H23 | 108.2° | 109.5° |
| C23 | C24 | H24 | 109.5° | 109.4° |
| C23 | C24 | H24A | 109.5° | 109.5° |
| C23 | C24 | H24B | 109.4° | 109.5° |
| H24 | C24 | H24A | 109.5° | 109.5° |
| H24 | C24 | H24B | 109.5° | 109.5° |
| H24A | C24 | H24B | 109.5° | 109.4° |
| H25 | C25 | H25A | 109.4° | 109.5° |
| H25 | C25 | H25B | 109.5° | 109.4° |
| H25A | C25 | H25B | 109.5° | 109.5° |
| H26 | C26 | H26A | 109.5° | 109.4° |
| C29 | C27 | H27 | 108.2° | 109.5° |
| C29 | C27 | H27A | 108.2° | 109.5° |
| C27 | C29 | C28 | 104.8° | 109.5° |
| C27 | C29 | H29 | 104.0° | 109.5° |
| H27 | C27 | H27A | 109.4° | 109.5° |
| C29 | C28 | H28 | 109.5° | 109.4° |
| C29 | C28 | H28A | 109.4° | 109.4° |
| C29 | C28 | H28B | 109.5° | 109.5° |
| C28 | C29 | H29 | 104.4° | 109.5° |
| H28 | C28 | H28A | 109.5° | 109.5° |
| H28 | C28 | H28B | 109.5° | 109.5° |
| H28A | C28 | H28B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 120.0° | 124.0° |
| N | CA | C | O | 82.5° | 179.3° |
| N | CA | C | C26 | 123.5° | 120.0° |
| N | CA | C | HA | 119.7° | 120.0° |
| N | CA | C26 | HA | 113.2° | 120.0° |
| N | CA | C | C29 | 18.9° | 60.7° |
| N | CA | C | H21 | 156.6° | 59.3° |
| N | CA | C26 | C23 | 108.6° | 65.4° |
| N | CA | C26 | H26 | 12.6° | 54.6° |
| N | CA | C26 | H26A | 130.3° | 174.6° |
| H | N | CA | C | 180.0° | 56.9° |
| H | N | CA | C26 | 51.0° | 63.1° |
| H | N | CA | HA | 61.2° | 176.9° |
| O | C | CA | C29 | 101.4° | 120.0° |
| O | C | CA | H21 | 120.9° | 120.0° |
| O | C | CA | C26 | 153.9° | 59.3° |
| O | C | CA | HA | 37.2° | 60.7° |
| O | C | C29 | H21 | 118.9° | 120.0° |
| O | C | C29 | C27 | 163.4° | 54.4° |
| O | C | C29 | C28 | 33.8° | 65.6° |
| O | C | C29 | H29 | 79.1° | 174.4° |
| HO6 | O | C | CA | 180.0° | 60.0° |
| HO6 | O | C | C29 | 55.3° | 60.0° |
| HO6 | O | C | H21 | 60.8° | 180.0° |
| O7 | C27 | C29 | C | 179.0° | 175.0° |
| O7 | C27 | C29 | H27 | 120.7° | 120.0° |
| O7 | C27 | C29 | H27A | 120.7° | 120.0° |
| O7 | C27 | H27 | H27A | 117.7° | 120.0° |
| O7 | C27 | C29 | C28 | 47.7° | 65.0° |
| O7 | C27 | C29 | H29 | 61.7° | 55.0° |
| HO7 | O7 | C27 | C29 | 180.0° | 180.0° |
| HO7 | O7 | C27 | H27 | 59.3° | 60.0° |
| HO7 | O7 | C27 | H27A | 59.3° | 60.0° |
| C | CA | C26 | HA | 116.5° | 120.0° |
| CA | C | C29 | H21 | 138.2° | 120.0° |
| C | CA | C26 | C23 | 121.2° | 174.6° |
| C | CA | C26 | H26 | 117.7° | 65.4° |
| C | CA | C26 | H26A | 0.0° | 54.6° |
| CA | C | C29 | C27 | 60.5° | 65.7° |
| CA | C | C29 | C28 | 69.1° | 174.4° |
| CA | C | C29 | H29 | 178.0° | 54.4° |
| C | CA | N | H2 | 60.0° | 179.1° |
| C26 | CA | C | C29 | 104.6° | 179.3° |
| C26 | CA | C | H21 | 33.1° | 60.7° |
| CA | C26 | C23 | H26 | 121.2° | 120.1° |
| CA | C26 | C23 | H26A | 121.2° | 120.0° |
| CA | C26 | C23 | C25 | 160.6° | 64.9° |
| CA | C26 | C23 | C24 | 40.5° | 175.1° |
| CA | C26 | C23 | H23 | 81.8° | 55.0° |
| CA | C26 | H26 | H26A | 116.4° | 120.0° |
| C26 | CA | N | H2 | 171.0° | 60.9° |
| HA | CA | C | C29 | 138.6° | 59.3° |
| HA | CA | C | H21 | 83.7° | 179.3° |
| HA | CA | C26 | C23 | 4.7° | 54.5° |
| HA | CA | C26 | H26 | 125.8° | 174.6° |
| HA | CA | C26 | H26A | 116.5° | 65.4° |
| HA | CA | N | H2 | 58.7° | 59.1° |
| C | C29 | C27 | C28 | 133.3° | 119.9° |
| C | C29 | C27 | H29 | 117.4° | 120.0° |
| C | C29 | C27 | H27 | 60.2° | 65.0° |
| C | C29 | C27 | H27A | 58.3° | 55.0° |
| C | C29 | C28 | H29 | 112.4° | 120.0° |
| C | C29 | C28 | H28 | 180.0° | 64.5° |
| C | C29 | C28 | H28A | 60.0° | 175.6° |
| C | C29 | C28 | H28B | 60.0° | 55.5° |
| H21 | C | C29 | C27 | 77.7° | 174.3° |
| H21 | C | C29 | C28 | 152.7° | 54.4° |
| H21 | C | C29 | H29 | 39.8° | 65.6° |
| C26 | C23 | C25 | C24 | 126.9° | 120.0° |
| C26 | C23 | C25 | H23 | 117.0° | 119.9° |
| C26 | C23 | C24 | H23 | 122.1° | 120.0° |
| C26 | C23 | C24 | H24 | 180.0° | 175.1° |
| C26 | C23 | C24 | H24A | 60.0° | 55.2° |
| C26 | C23 | C24 | H24B | 60.0° | 64.8° |
| C26 | C23 | C25 | H25 | 180.0° | 60.1° |
| C26 | C23 | C25 | H25A | 60.0° | 60.0° |
| C26 | C23 | C25 | H25B | 60.0° | 180.0° |
| C23 | C26 | H26 | H26A | 116.3° | 120.0° |
| C25 | C23 | C24 | H23 | 116.4° | 120.1° |
| C25 | C23 | C24 | H24 | 58.5° | 64.9° |
| C25 | C23 | C24 | H24A | 178.5° | 175.2° |
| C25 | C23 | C24 | H24B | 61.5° | 55.2° |
| C23 | C25 | H25 | H25A | 120.0° | 120.1° |
| C23 | C25 | H25 | H25B | 120.0° | 120.0° |
| C23 | C25 | H25A | H25B | 120.0° | 120.0° |
| C25 | C23 | C26 | H26 | 39.4° | 175.0° |
| C25 | C23 | C26 | H26A | 78.2° | 55.0° |
| C23 | C24 | H24 | H24A | 120.0° | 120.0° |
| C23 | C24 | H24 | H24B | 120.0° | 120.1° |
| C23 | C24 | H24A | H24B | 120.0° | 120.1° |
| C24 | C23 | C25 | H25 | 53.0° | 59.9° |
| C24 | C23 | C25 | H25A | 67.0° | 180.0° |
| C24 | C23 | C25 | H25B | 173.1° | 60.0° |
| C24 | C23 | C26 | H26 | 80.6° | 55.0° |
| C24 | C23 | C26 | H26A | 161.7° | 64.9° |
| H23 | C23 | C24 | H24 | 57.9° | 55.2° |
| H23 | C23 | C24 | H24A | 62.1° | 64.8° |
| H23 | C23 | C24 | H24B | 177.9° | 175.2° |
| H23 | C23 | C25 | H25 | 63.0° | 180.0° |
| H23 | C23 | C25 | H25A | 177.0° | 59.9° |
| H23 | C23 | C25 | H25B | 57.0° | 60.1° |
| H23 | C23 | C26 | H26 | 157.0° | 65.0° |
| H23 | C23 | C26 | H26A | 39.4° | 175.0° |
| H24 | C24 | H24A | H24B | 120.0° | 120.0° |
| H25 | C25 | H25A | H25B | 120.0° | 119.9° |
| C29 | C27 | H27 | H27A | 117.7° | 120.0° |
| C27 | C29 | C28 | H29 | 109.1° | 120.1° |
| C27 | C29 | C28 | H28 | 41.4° | 175.5° |
| C27 | C29 | C28 | H28A | 78.6° | 55.6° |
| C27 | C29 | C28 | H28B | 161.4° | 64.4° |
| H27 | C27 | C29 | C28 | 73.1° | 55.0° |
| H27 | C27 | C29 | H29 | 177.6° | 175.0° |
| H27A | C27 | C29 | C28 | 168.4° | 174.9° |
| H27A | C27 | C29 | H29 | 59.1° | 65.0° |
| C29 | C28 | H28 | H28A | 120.0° | 119.9° |
| C29 | C28 | H28 | H28B | 120.0° | 120.0° |
| C29 | C28 | H28A | H28B | 120.0° | 120.0° |
| H28 | C28 | H28A | H28B | 120.0° | 120.1° |
| H28 | C28 | C29 | H29 | 67.6° | 55.5° |
| H28A | C28 | C29 | H29 | 172.3° | 64.5° |
| H28B | C28 | C29 | H29 | 52.4° | 175.5° |






