2U4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O45 | C44 | sing | 1.36Å | 1.36Å | |
| C44 | C41 | doub | 1.39Å | 1.40Å | Aromatic |
| C44 | C43 | sing | 1.39Å | 1.41Å | Aromatic |
| C41 | C40 | sing | 1.39Å | 1.40Å | Aromatic |
| O37 | C35 | doub | 1.22Å | 1.22Å | |
| O46 | C43 | sing | 1.36Å | 1.36Å | |
| C43 | C42 | doub | 1.39Å | 1.40Å | Aromatic |
| C40 | C35 | sing | 1.48Å | 1.48Å | |
| C40 | C39 | doub | 1.41Å | 1.43Å | Aromatic |
| C35 | N34 | sing | 1.34Å | 1.36Å | |
| O5 | C4 | doub | 1.21Å | 1.22Å | |
| C42 | C39 | sing | 1.39Å | 1.40Å | Aromatic |
| C39 | C36 | sing | 1.48Å | 1.49Å | |
| N34 | C36 | sing | 1.35Å | 1.37Å | |
| N34 | C3 | sing | 1.47Å | 1.48Å | |
| C4 | C3 | sing | 1.51Å | 1.51Å | |
| C4 | O33 | sing | 1.34Å | 1.23Å | |
| C36 | O38 | doub | 1.21Å | 1.23Å | |
| C3 | C2 | sing | 1.53Å | 1.54Å | |
| O32 | C30 | doub | 1.21Å | 1.23Å | |
| O31 | C30 | sing | 1.35Å | 1.22Å | |
| C30 | C1 | sing | 1.47Å | 1.47Å | |
| C2 | C1 | sing | 1.51Å | 1.52Å | |
| C1 | N26 | doub | 1.29Å | 1.28Å | |
| N26 | O27 | sing | 1.42Å | 1.41Å | |
| O27 | C28 | sing | 1.43Å | 1.43Å | |
| C28 | C24 | sing | 1.53Å | 1.53Å | |
| C25 | C24 | sing | 1.51Å | 1.50Å | |
| C25 | O29 | doub | 1.21Å | 1.21Å | |
| C24 | N23 | sing | 1.47Å | 1.46Å | |
| C18 | C16 | sing | 1.53Å | 1.53Å | |
| N23 | C13 | sing | 1.35Å | 1.34Å | |
| C19 | C16 | sing | 1.53Å | 1.54Å | |
| C16 | O15 | sing | 1.43Å | 1.45Å | |
| C16 | C17 | sing | 1.51Å | 1.53Å | |
| O15 | N14 | sing | 1.42Å | 1.44Å | |
| C13 | O22 | doub | 1.21Å | 1.22Å | |
| C13 | C12 | sing | 1.48Å | 1.48Å | |
| C17 | O21 | doub | 1.21Å | 1.24Å | |
| C17 | O20 | sing | 1.34Å | 1.23Å | |
| N14 | C12 | doub | 1.30Å | 1.32Å | |
| C12 | C8 | sing | 1.48Å | 1.49Å | |
| C8 | C7 | doub | 1.35Å | 1.36Å | Aromatic |
| C8 | N9 | sing | 1.33Å | 1.33Å | Aromatic |
| C7 | S6 | sing | 1.76Å | 1.76Å | Aromatic |
| N9 | C10 | doub | 1.30Å | 1.29Å | Aromatic |
| S6 | C10 | sing | 1.76Å | 1.76Å | Aromatic |
| C10 | N11 | sing | 1.38Å | 1.38Å | |
| C41 | H1 | sing | 1.08Å | 1.08Å | |
| C42 | H2 | sing | 1.08Å | 1.08Å | |
| C7 | H3 | sing | 1.08Å | 1.08Å | |
| C25 | H4 | sing | 1.08Å | 1.08Å | |
| C18 | H5 | sing | 1.09Å | 1.10Å | |
| C18 | H6 | sing | 1.09Å | 1.10Å | |
| C18 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C19 | H9 | sing | 1.09Å | 1.10Å | |
| C19 | H10 | sing | 1.09Å | 1.10Å | |
| C2 | H11 | sing | 1.09Å | 1.10Å | |
| C2 | H12 | sing | 1.09Å | 1.10Å | |
| C28 | H13 | sing | 1.09Å | 1.10Å | |
| C28 | H14 | sing | 1.09Å | 1.10Å | |
| C24 | H15 | sing | 1.09Å | 1.10Å | |
| C3 | H16 | sing | 1.09Å | 1.10Å | |
| N11 | H17 | sing | 0.97Å | 1.00Å | |
| N11 | H18 | sing | 0.97Å | 1.00Å | |
| N23 | H19 | sing | 0.97Å | 1.00Å | |
| O31 | H20 | sing | 0.97Å | 0.95Å | |
| O33 | H21 | sing | 0.97Å | 0.95Å | |
| O20 | H22 | sing | 0.97Å | 0.95Å | |
| O45 | H23 | sing | 0.97Å | 0.95Å | |
| O46 | H24 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O45 | C44 | C41 | 119.6° | 119.9° |
| O45 | C44 | C43 | 120.0° | 119.9° |
| C44 | O45 | H23 | 109.5° | 114.0° |
| C41 | C44 | C43 | 120.4° | 120.3° |
| C44 | C41 | C40 | 119.4° | 119.8° |
| C44 | C41 | H1 | 120.3° | 120.1° |
| C44 | C43 | O46 | 120.2° | 119.8° |
| C44 | C43 | C42 | 120.5° | 120.3° |
| C41 | C40 | C35 | 133.8° | 134.2° |
| C41 | C40 | C39 | 120.4° | 119.9° |
| C40 | C41 | H1 | 120.3° | 120.1° |
| O37 | C35 | C40 | 124.1° | 125.7° |
| O37 | C35 | N34 | 126.7° | 125.7° |
| O46 | C43 | C42 | 119.3° | 119.8° |
| C43 | O46 | H24 | 109.5° | 114.0° |
| C43 | C42 | C39 | 119.6° | 119.7° |
| C43 | C42 | H2 | 120.2° | 120.1° |
| C35 | C40 | C39 | 105.7° | 105.9° |
| C40 | C35 | N34 | 109.2° | 108.6° |
| C40 | C39 | C42 | 119.7° | 120.0° |
| C40 | C39 | C36 | 106.2° | 105.8° |
| C35 | N34 | C36 | 110.5° | 111.0° |
| C35 | N34 | C3 | 123.3° | 124.5° |
| O5 | C4 | C3 | 117.2° | 120.0° |
| O5 | C4 | O33 | 121.3° | 120.0° |
| C42 | C39 | C36 | 134.0° | 134.2° |
| C39 | C42 | H2 | 120.2° | 120.1° |
| C39 | C36 | N34 | 108.4° | 108.6° |
| C39 | C36 | O38 | 124.2° | 125.7° |
| C36 | N34 | C3 | 126.1° | 124.5° |
| N34 | C36 | O38 | 127.5° | 125.7° |
| N34 | C3 | C4 | 106.3° | 109.4° |
| N34 | C3 | C2 | 115.9° | 109.5° |
| N34 | C3 | H16 | 106.1° | 109.4° |
| C3 | C4 | O33 | 121.3° | 120.0° |
| C4 | C3 | C2 | 116.4° | 109.5° |
| C4 | C3 | H16 | 105.8° | 109.5° |
| C4 | O33 | H21 | 109.5° | 117.0° |
| C3 | C2 | C1 | 112.7° | 109.5° |
| C3 | C2 | H11 | 108.7° | 109.4° |
| C3 | C2 | H12 | 108.7° | 109.4° |
| C2 | C3 | H16 | 105.4° | 109.5° |
| O32 | C30 | O31 | 120.4° | 120.0° |
| O32 | C30 | C1 | 118.4° | 120.0° |
| O31 | C30 | C1 | 121.1° | 120.0° |
| C30 | O31 | H20 | 109.5° | 117.0° |
| C30 | C1 | C2 | 125.1° | 120.0° |
| C30 | C1 | N26 | 112.2° | 120.0° |
| C2 | C1 | N26 | 122.6° | 120.0° |
| C1 | C2 | H11 | 108.6° | 109.5° |
| C1 | C2 | H12 | 108.7° | 109.5° |
| C1 | N26 | O27 | 126.1° | 120.0° |
| N26 | O27 | C28 | 111.7° | 114.0° |
| O27 | C28 | C24 | 111.6° | 109.5° |
| O27 | C28 | H13 | 108.9° | 109.5° |
| O27 | C28 | H14 | 108.9° | 109.5° |
| C28 | C24 | C25 | 111.4° | 109.5° |
| C28 | C24 | N23 | 112.9° | 109.4° |
| C24 | C28 | H13 | 108.9° | 109.4° |
| C24 | C28 | H14 | 108.9° | 109.5° |
| C28 | C24 | H15 | 108.4° | 109.5° |
| C24 | C25 | O29 | 120.6° | 120.0° |
| C25 | C24 | N23 | 105.8° | 109.4° |
| C24 | C25 | H4 | 119.7° | 120.0° |
| C25 | C24 | H15 | 108.8° | 109.5° |
| O29 | C25 | H4 | 119.7° | 120.0° |
| C24 | N23 | C13 | 120.5° | 120.0° |
| N23 | C24 | H15 | 109.4° | 109.5° |
| C24 | N23 | H19 | 119.8° | 120.0° |
| C18 | C16 | C19 | 105.4° | 109.5° |
| C18 | C16 | O15 | 108.2° | 109.5° |
| C18 | C16 | C17 | 109.0° | 109.5° |
| C16 | C18 | H5 | 109.5° | 109.4° |
| C16 | C18 | H6 | 109.5° | 109.4° |
| C16 | C18 | H7 | 109.5° | 109.5° |
| N23 | C13 | O22 | 122.2° | 120.0° |
| N23 | C13 | C12 | 119.0° | 120.0° |
| C13 | N23 | H19 | 119.7° | 120.0° |
| C19 | C16 | O15 | 110.7° | 109.5° |
| C19 | C16 | C17 | 112.0° | 109.5° |
| C16 | C19 | H8 | 109.5° | 109.5° |
| C16 | C19 | H9 | 109.4° | 109.5° |
| C16 | C19 | H10 | 109.5° | 109.5° |
| O15 | C16 | C17 | 111.2° | 109.5° |
| C16 | O15 | N14 | 119.4° | 114.0° |
| C16 | C17 | O21 | 122.0° | 120.0° |
| C16 | C17 | O20 | 119.1° | 120.0° |
| O15 | N14 | C12 | 122.2° | 120.0° |
| O22 | C13 | C12 | 118.7° | 120.0° |
| C13 | C12 | N14 | 121.4° | 120.0° |
| C13 | C12 | C8 | 116.6° | 120.0° |
| O21 | C17 | O20 | 118.8° | 119.9° |
| C17 | O20 | H22 | 109.5° | 117.0° |
| N14 | C12 | C8 | 122.0° | 120.0° |
| C12 | C8 | C7 | 124.1° | 122.4° |
| C12 | C8 | N9 | 121.8° | 122.5° |
| C7 | C8 | N9 | 114.1° | 115.1° |
| C8 | C7 | S6 | 109.1° | 108.3° |
| C8 | C7 | H3 | 125.5° | 125.9° |
| C8 | N9 | C10 | 117.1° | 116.9° |
| C7 | S6 | C10 | 89.4° | 90.2° |
| S6 | C7 | H3 | 125.4° | 125.9° |
| N9 | C10 | S6 | 110.3° | 109.5° |
| N9 | C10 | N11 | 123.8° | 125.3° |
| S6 | C10 | N11 | 125.9° | 125.2° |
| C10 | N11 | H17 | 109.5° | 120.0° |
| C10 | N11 | H18 | 109.5° | 120.0° |
| H5 | C18 | H6 | 109.5° | 109.5° |
| H5 | C18 | H7 | 109.4° | 109.5° |
| H6 | C18 | H7 | 109.5° | 109.5° |
| H8 | C19 | H9 | 109.5° | 109.5° |
| H8 | C19 | H10 | 109.4° | 109.5° |
| H9 | C19 | H10 | 109.5° | 109.5° |
| H11 | C2 | H12 | 109.4° | 109.5° |
| H13 | C28 | H14 | 109.5° | 109.5° |
| H17 | N11 | H18 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O45 | C44 | C41 | C43 | 179.8° | 180.0° |
| O45 | C44 | C41 | C40 | 177.7° | 180.0° |
| O45 | C44 | C43 | O46 | 0.5° | 0.1° |
| O45 | C44 | C43 | C42 | 179.4° | 179.5° |
| O45 | C44 | C41 | H1 | 2.3° | 0.3° |
| C44 | C41 | C40 | H1 | 180.0° | 179.7° |
| C41 | C44 | C43 | O46 | 179.8° | 180.0° |
| C41 | C44 | C43 | C42 | 0.3° | 0.5° |
| C44 | C41 | C40 | C35 | 178.8° | 179.7° |
| C44 | C41 | C40 | C39 | 3.0° | 0.2° |
| C41 | C44 | O45 | H23 | 180.0° | 90.0° |
| C43 | C44 | C41 | C40 | 2.0° | 0.0° |
| C44 | C43 | O46 | C42 | 179.9° | 179.5° |
| C44 | C43 | C42 | C39 | 0.4° | 0.8° |
| C43 | C44 | C41 | H1 | 178.0° | 179.7° |
| C44 | C43 | C42 | H2 | 179.6° | 179.8° |
| C43 | C44 | O45 | H23 | 0.2° | 90.0° |
| C44 | C43 | O46 | H24 | 180.0° | 90.0° |
| C41 | C40 | C35 | O37 | 6.5° | 0.0° |
| C41 | C40 | C35 | C39 | 176.2° | 180.0° |
| C41 | C40 | C35 | N34 | 175.5° | 180.0° |
| C41 | C40 | C39 | C42 | 2.3° | 0.0° |
| C41 | C40 | C39 | C36 | 175.8° | 180.0° |
| O37 | C35 | C40 | N34 | 178.0° | 180.0° |
| O37 | C35 | C40 | C39 | 177.3° | 180.0° |
| O37 | C35 | N34 | C36 | 177.9° | 180.0° |
| O37 | C35 | N34 | C3 | 4.2° | 0.0° |
| O46 | C43 | C42 | C39 | 179.5° | 179.7° |
| O46 | C43 | C42 | H2 | 0.5° | 0.3° |
| C43 | C42 | C39 | C40 | 0.6° | 0.6° |
| C43 | C42 | C39 | H2 | 180.0° | 179.4° |
| C43 | C42 | C39 | C36 | 176.9° | 179.5° |
| C42 | C43 | O46 | H24 | 0.1° | 89.5° |
| C35 | C40 | C39 | C42 | 179.2° | 180.0° |
| C35 | C40 | C39 | C36 | 1.0° | 0.0° |
| C40 | C35 | N34 | C36 | 0.1° | 0.0° |
| C40 | C35 | N34 | C3 | 177.8° | 180.0° |
| C35 | C40 | C41 | H1 | 1.2° | 0.0° |
| C39 | C40 | C35 | N34 | 0.7° | 0.0° |
| C40 | C39 | C42 | C36 | 177.5° | 180.0° |
| C40 | C39 | C36 | N34 | 1.0° | 0.0° |
| C40 | C39 | C36 | O38 | 179.4° | 179.9° |
| C39 | C40 | C41 | H1 | 177.0° | 179.9° |
| C40 | C39 | C42 | H2 | 179.4° | 180.0° |
| C35 | N34 | C36 | C39 | 0.6° | 0.0° |
| C35 | N34 | C36 | C3 | 177.8° | 180.0° |
| C35 | N34 | C3 | C4 | 122.5° | 120.0° |
| C35 | N34 | C36 | O38 | 179.8° | 179.9° |
| C35 | N34 | C3 | C2 | 106.4° | 120.0° |
| C35 | N34 | C3 | H16 | 10.2° | 0.0° |
| O5 | C4 | C3 | N34 | 77.5° | 0.1° |
| O5 | C4 | C3 | O33 | 175.8° | 180.0° |
| O5 | C4 | C3 | C2 | 151.8° | 120.0° |
| O5 | C4 | C3 | H16 | 35.1° | 120.0° |
| O5 | C4 | O33 | H21 | 0.0° | 0.0° |
| C42 | C39 | C36 | N34 | 178.8° | 180.0° |
| C42 | C39 | C36 | O38 | 1.6° | 0.1° |
| C39 | C36 | N34 | O38 | 179.6° | 179.9° |
| C39 | C36 | N34 | C3 | 178.4° | 180.0° |
| C36 | C39 | C42 | H2 | 3.1° | 0.1° |
| C36 | N34 | C3 | C4 | 55.0° | 60.0° |
| C36 | N34 | C3 | C2 | 76.1° | 60.0° |
| C36 | N34 | C3 | H16 | 167.3° | 180.0° |
| N34 | C3 | C4 | C2 | 130.8° | 120.0° |
| N34 | C3 | C4 | H16 | 112.5° | 119.9° |
| N34 | C3 | C4 | O33 | 98.3° | 180.0° |
| C3 | N34 | C36 | O38 | 2.0° | 0.1° |
| N34 | C3 | C2 | H16 | 117.0° | 120.0° |
| N34 | C3 | C2 | C1 | 178.3° | 65.0° |
| N34 | C3 | C2 | H11 | 57.9° | 175.0° |
| N34 | C3 | C2 | H12 | 61.2° | 55.0° |
| C4 | C3 | C2 | H16 | 116.9° | 120.0° |
| C4 | C3 | C2 | C1 | 55.6° | 175.0° |
| C4 | C3 | C2 | H11 | 176.1° | 55.0° |
| C4 | C3 | C2 | H12 | 64.9° | 65.0° |
| C3 | C4 | O33 | H21 | 175.6° | 180.0° |
| O33 | C4 | C3 | C2 | 32.4° | 60.0° |
| O33 | C4 | C3 | H16 | 149.1° | 60.0° |
| C3 | C2 | C1 | C30 | 72.5° | 65.0° |
| C3 | C2 | C1 | H11 | 120.5° | 120.0° |
| C3 | C2 | C1 | H12 | 120.5° | 120.0° |
| C3 | C2 | C1 | N26 | 106.7° | 115.0° |
| C3 | C2 | H11 | H12 | 118.5° | 120.0° |
| O32 | C30 | O31 | C1 | 176.6° | 180.0° |
| O32 | C30 | C1 | C2 | 132.8° | 0.0° |
| O32 | C30 | C1 | N26 | 46.5° | 180.0° |
| O32 | C30 | O31 | H20 | 0.0° | 0.0° |
| O31 | C30 | C1 | C2 | 50.5° | 180.0° |
| O31 | C30 | C1 | N26 | 130.3° | 0.0° |
| C30 | C1 | C2 | N26 | 179.2° | 180.0° |
| C30 | C1 | N26 | O27 | 179.4° | 180.0° |
| C30 | C1 | C2 | H11 | 48.0° | 55.0° |
| C30 | C1 | C2 | H12 | 167.0° | 175.0° |
| C1 | C30 | O31 | H20 | 176.6° | 180.0° |
| C2 | C1 | N26 | O27 | 0.2° | 0.0° |
| C1 | C2 | H11 | H12 | 118.5° | 120.1° |
| C1 | C2 | C3 | H16 | 61.3° | 55.0° |
| C1 | N26 | O27 | C28 | 155.9° | 180.0° |
| N26 | C1 | C2 | H11 | 132.8° | 125.0° |
| N26 | C1 | C2 | H12 | 13.8° | 4.9° |
| N26 | O27 | C28 | C24 | 79.2° | 180.0° |
| N26 | O27 | C28 | H13 | 160.5° | 60.1° |
| N26 | O27 | C28 | H14 | 41.1° | 60.0° |
| O27 | C28 | C24 | H13 | 120.3° | 120.0° |
| O27 | C28 | C24 | H14 | 120.3° | 120.0° |
| O27 | C28 | C24 | C25 | 73.2° | 55.0° |
| O27 | C28 | C24 | N23 | 45.7° | 65.0° |
| O27 | C28 | H13 | H14 | 119.0° | 120.1° |
| O27 | C28 | C24 | H15 | 167.1° | 175.0° |
| C28 | C24 | C25 | N23 | 123.1° | 119.9° |
| C28 | C24 | C25 | H15 | 119.5° | 120.1° |
| C28 | C24 | C25 | O29 | 104.4° | 120.0° |
| C28 | C24 | N23 | H15 | 120.8° | 120.0° |
| C28 | C24 | N23 | C13 | 129.0° | 155.0° |
| C28 | C24 | C25 | H4 | 75.6° | 60.0° |
| C24 | C28 | H13 | H14 | 119.0° | 120.0° |
| C28 | C24 | N23 | H19 | 51.0° | 24.9° |
| C24 | C25 | O29 | H4 | 180.0° | 180.0° |
| C25 | C24 | N23 | H15 | 117.1° | 120.0° |
| C25 | C24 | N23 | C13 | 108.9° | 85.1° |
| C25 | C24 | C28 | H13 | 166.5° | 65.0° |
| C25 | C24 | C28 | H14 | 47.1° | 175.0° |
| C25 | C24 | N23 | H19 | 71.1° | 95.0° |
| O29 | C25 | C24 | N23 | 18.7° | 0.0° |
| O29 | C25 | C24 | H15 | 136.1° | 120.0° |
| C24 | N23 | C13 | H19 | 180.0° | 179.9° |
| C24 | N23 | C13 | O22 | 2.3° | 5.2° |
| C24 | N23 | C13 | C12 | 175.3° | 174.8° |
| N23 | C24 | C25 | H4 | 161.3° | 180.0° |
| N23 | C24 | C28 | H13 | 74.6° | 175.0° |
| N23 | C24 | C28 | H14 | 166.1° | 55.1° |
| C18 | C16 | C19 | O15 | 116.8° | 120.0° |
| C18 | C16 | C19 | C17 | 118.4° | 120.0° |
| C18 | C16 | O15 | C17 | 119.7° | 120.0° |
| C18 | C16 | O15 | N14 | 172.1° | 60.0° |
| C18 | C16 | C17 | O21 | 91.0° | 120.1° |
| C18 | C16 | C17 | O20 | 88.6° | 60.0° |
| C16 | C18 | H5 | H6 | 120.0° | 119.9° |
| C16 | C18 | H5 | H7 | 120.0° | 120.0° |
| C16 | C18 | H6 | H7 | 120.0° | 120.0° |
| C18 | C16 | C19 | H8 | 180.0° | 60.0° |
| C18 | C16 | C19 | H9 | 60.0° | 180.0° |
| C18 | C16 | C19 | H10 | 60.0° | 60.0° |
| N23 | C13 | O22 | C12 | 177.6° | 180.0° |
| N23 | C13 | C12 | N14 | 57.9° | 174.5° |
| N23 | C13 | C12 | C8 | 119.5° | 5.4° |
| C13 | N23 | C24 | H15 | 8.2° | 35.0° |
| C19 | C16 | O15 | C17 | 125.2° | 120.0° |
| C19 | C16 | O15 | N14 | 57.0° | 60.0° |
| C19 | C16 | C17 | O21 | 25.2° | 120.0° |
| C19 | C16 | C17 | O20 | 155.2° | 60.0° |
| C19 | C16 | C18 | H5 | 180.0° | 60.0° |
| C19 | C16 | C18 | H6 | 60.0° | 180.0° |
| C19 | C16 | C18 | H7 | 60.0° | 60.0° |
| C16 | C19 | H8 | H9 | 120.0° | 120.0° |
| C16 | C19 | H8 | H10 | 120.0° | 120.0° |
| C16 | C19 | H9 | H10 | 120.0° | 120.0° |
| O15 | C16 | C17 | O21 | 149.8° | 0.0° |
| O15 | C16 | C17 | O20 | 30.7° | 180.0° |
| C16 | O15 | N14 | C12 | 159.7° | 180.0° |
| O15 | C16 | C18 | H5 | 61.5° | 60.0° |
| O15 | C16 | C18 | H6 | 178.5° | 60.0° |
| O15 | C16 | C18 | H7 | 58.5° | 180.0° |
| O15 | C16 | C19 | H8 | 63.2° | 180.0° |
| O15 | C16 | C19 | H9 | 56.8° | 60.0° |
| O15 | C16 | C19 | H10 | 176.8° | 60.0° |
| C17 | C16 | O15 | N14 | 68.2° | 180.0° |
| C16 | C17 | O21 | O20 | 179.6° | 179.9° |
| C17 | C16 | C18 | H5 | 59.6° | 180.0° |
| C17 | C16 | C18 | H6 | 60.4° | 60.0° |
| C17 | C16 | C18 | H7 | 179.6° | 60.0° |
| C17 | C16 | C19 | H8 | 61.6° | 60.0° |
| C17 | C16 | C19 | H9 | 178.4° | 60.0° |
| C17 | C16 | C19 | H10 | 58.4° | 180.0° |
| C16 | C17 | O20 | H22 | 179.6° | 180.0° |
| O15 | N14 | C12 | C13 | 2.4° | 5.2° |
| O15 | N14 | C12 | C8 | 179.6° | 174.7° |
| O22 | C13 | C12 | N14 | 124.4° | 5.5° |
| O22 | C13 | C12 | C8 | 58.3° | 174.6° |
| O22 | C13 | N23 | H19 | 177.6° | 174.7° |
| C13 | C12 | N14 | C8 | 177.2° | 180.0° |
| C13 | C12 | C8 | C7 | 8.3° | 174.7° |
| C13 | C12 | C8 | N9 | 172.0° | 5.3° |
| C12 | C13 | N23 | H19 | 4.7° | 5.3° |
| O21 | C17 | O20 | H22 | 0.0° | 0.0° |
| N14 | C12 | C8 | C7 | 169.0° | 5.3° |
| N14 | C12 | C8 | N9 | 10.7° | 174.7° |
| C12 | C8 | C7 | N9 | 179.7° | 180.0° |
| C12 | C8 | C7 | S6 | 179.3° | 180.0° |
| C12 | C8 | N9 | C10 | 179.0° | 180.0° |
| C12 | C8 | C7 | H3 | 0.7° | 0.3° |
| C8 | C7 | S6 | H3 | 180.0° | 179.7° |
| C7 | C8 | N9 | C10 | 0.7° | 0.0° |
| C8 | C7 | S6 | C10 | 0.1° | 0.0° |
| N9 | C8 | C7 | S6 | 0.4° | 0.0° |
| C8 | N9 | C10 | S6 | 0.7° | 0.0° |
| C8 | N9 | C10 | N11 | 180.0° | 179.9° |
| N9 | C8 | C7 | H3 | 179.5° | 179.7° |
| C7 | S6 | C10 | N9 | 0.3° | 0.0° |
| C7 | S6 | C10 | N11 | 179.7° | 179.9° |
| N9 | C10 | S6 | N11 | 179.3° | 180.0° |
| N9 | C10 | N11 | H17 | 0.0° | 0.1° |
| N9 | C10 | N11 | H18 | 120.0° | 180.0° |
| C10 | S6 | C7 | H3 | 179.9° | 179.7° |
| S6 | C10 | N11 | H17 | 179.2° | 180.0° |
| S6 | C10 | N11 | H18 | 59.2° | 0.1° |
| C10 | N11 | H17 | H18 | 120.0° | 179.9° |
| H4 | C25 | C24 | H15 | 43.9° | 60.0° |
| H5 | C18 | H6 | H7 | 120.0° | 120.1° |
| H8 | C19 | H9 | H10 | 120.0° | 120.0° |
| H11 | C2 | C3 | H16 | 59.2° | 65.0° |
| H12 | C2 | C3 | H16 | 178.2° | 175.0° |
| H13 | C28 | C24 | H15 | 46.8° | 55.1° |
| H14 | C28 | C24 | H15 | 72.6° | 64.9° |
| H15 | C24 | N23 | H19 | 171.8° | 144.9° |
