2G0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.54Å | |
| C1 | O5 | sing | 1.43Å | 1.44Å | |
| C1 | C7 | sing | 1.53Å | 1.54Å | |
| C2 | O2 | sing | 1.43Å | 1.42Å | |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| C3 | O3 | sing | 1.43Å | 1.42Å | |
| C3 | C4 | sing | 1.53Å | 1.50Å | |
| C4 | O4 | sing | 1.43Å | 1.41Å | |
| C4 | C5 | sing | 1.53Å | 1.52Å | |
| C5 | O5 | sing | 1.43Å | 1.45Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| C7 | C8 | sing | 1.51Å | 1.53Å | |
| C8 | O6 | doub | 1.21Å | 1.23Å | |
| C8 | N1 | sing | 1.35Å | 1.32Å | |
| N1 | C9 | sing | 1.46Å | 1.46Å | |
| C9 | C10 | sing | 1.51Å | 1.51Å | |
| C9 | C11 | sing | 1.53Å | 1.55Å | |
| C10 | O7 | doub | 1.21Å | 1.28Å | |
| C10 | N3 | sing | 1.35Å | 1.33Å | |
| C11 | C12 | sing | 1.53Å | 1.55Å | |
| C12 | C13 | sing | 1.53Å | 1.53Å | |
| C13 | C14 | sing | 1.53Å | 1.53Å | |
| C14 | N2 | sing | 1.47Å | 1.47Å | |
| N3 | C15 | sing | 1.47Å | 1.47Å | |
| N3 | C19 | sing | 1.47Å | 1.47Å | |
| C15 | C16 | sing | 1.51Å | 1.53Å | |
| C15 | C17 | sing | 1.54Å | 1.53Å | |
| C16 | O8 | doub | 1.21Å | 1.23Å | |
| C16 | N4 | sing | 1.35Å | 1.33Å | |
| C17 | C18 | sing | 1.55Å | 1.51Å | |
| C18 | C19 | sing | 1.55Å | 1.50Å | |
| N4 | C20 | sing | 1.46Å | 1.46Å | |
| C20 | C21 | sing | 1.51Å | 1.53Å | |
| C20 | C22 | sing | 1.53Å | 1.53Å | |
| C21 | O9 | doub | 1.21Å | 1.25Å | |
| C21 | N5 | sing | 1.35Å | 1.26Å | |
| C22 | C23 | sing | 1.53Å | 1.54Å | |
| C23 | C24 | sing | 1.53Å | 1.50Å | |
| C23 | C25 | sing | 1.53Å | 1.51Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| C6 | H6B | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| N1 | HN1 | sing | 0.97Å | 1.00Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| N2 | HN2 | sing | 1.01Å | 1.00Å | |
| N2 | HN2A | sing | 1.01Å | 1.00Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| N4 | HN4 | sing | 0.97Å | 1.00Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| 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 | |
| N5 | HN5 | sing | 0.97Å | 1.00Å | |
| N5 | HN5A | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | O5 | 108.3° | 109.4° |
| C2 | C1 | C7 | 111.8° | 109.5° |
| C1 | C2 | O2 | 110.1° | 109.6° |
| C1 | C2 | C3 | 108.5° | 109.1° |
| C2 | C1 | H1 | 110.5° | 109.5° |
| C1 | C2 | H2 | 109.9° | 109.6° |
| O5 | C1 | C7 | 114.2° | 109.5° |
| C1 | O5 | C5 | 112.2° | 114.1° |
| O5 | C1 | H1 | 107.9° | 109.5° |
| C1 | C7 | C8 | 101.3° | 109.5° |
| C7 | C1 | H1 | 104.1° | 109.5° |
| C1 | C7 | H7 | 112.3° | 109.5° |
| C1 | C7 | H7A | 114.0° | 109.5° |
| O2 | C2 | C3 | 109.9° | 109.5° |
| O2 | C2 | H2 | 108.5° | 109.5° |
| C2 | O2 | HO2 | 109.5° | 114.1° |
| C2 | C3 | O3 | 110.9° | 109.6° |
| C2 | C3 | C4 | 110.3° | 109.1° |
| C3 | C2 | H2 | 110.1° | 109.6° |
| C2 | C3 | H3 | 107.6° | 109.5° |
| O3 | C3 | C4 | 108.3° | 109.6° |
| O3 | C3 | H3 | 109.5° | 109.5° |
| C3 | O3 | HO3 | 109.5° | 114.0° |
| C3 | C4 | O4 | 109.4° | 109.5° |
| C3 | C4 | C5 | 110.9° | 109.1° |
| C4 | C3 | H3 | 110.2° | 109.6° |
| C3 | C4 | H4 | 108.6° | 109.5° |
| O4 | C4 | C5 | 109.6° | 109.5° |
| O4 | C4 | H4 | 110.0° | 109.5° |
| C4 | O4 | HO4 | 109.5° | 114.0° |
| C4 | C5 | O5 | 109.9° | 109.4° |
| C4 | C5 | C6 | 111.4° | 109.5° |
| C5 | C4 | H4 | 108.3° | 109.6° |
| C4 | C5 | H5 | 107.4° | 109.5° |
| O5 | C5 | C6 | 108.0° | 109.5° |
| O5 | C5 | H5 | 110.9° | 109.5° |
| C6 | C5 | H5 | 109.3° | 109.5° |
| C5 | C6 | H6 | 109.5° | 109.5° |
| C5 | C6 | H6A | 109.5° | 109.4° |
| C5 | C6 | H6B | 109.5° | 109.5° |
| C7 | C8 | O6 | 120.7° | 120.0° |
| C7 | C8 | N1 | 118.9° | 120.0° |
| C8 | C7 | H7 | 112.3° | 109.4° |
| C8 | C7 | H7A | 114.0° | 109.5° |
| O6 | C8 | N1 | 120.4° | 120.0° |
| C8 | N1 | C9 | 124.4° | 120.0° |
| C8 | N1 | HN1 | 117.8° | 120.0° |
| N1 | C9 | C10 | 111.0° | 109.5° |
| N1 | C9 | C11 | 109.4° | 109.5° |
| C9 | N1 | HN1 | 117.8° | 120.0° |
| N1 | C9 | H9 | 109.0° | 109.5° |
| C10 | C9 | C11 | 111.0° | 109.4° |
| C9 | C10 | O7 | 117.3° | 120.0° |
| C9 | C10 | N3 | 121.8° | 120.0° |
| C10 | C9 | H9 | 107.4° | 109.5° |
| C9 | C11 | C12 | 113.4° | 109.4° |
| C11 | C9 | H9 | 109.0° | 109.5° |
| C9 | C11 | H11 | 108.2° | 109.5° |
| C9 | C11 | H11A | 107.3° | 109.5° |
| O7 | C10 | N3 | 120.4° | 120.0° |
| C10 | N3 | C15 | 122.5° | 125.6° |
| C10 | N3 | C19 | 126.0° | 125.6° |
| C11 | C12 | C13 | 114.9° | 109.5° |
| C12 | C11 | H11 | 108.2° | 109.5° |
| C12 | C11 | H11A | 107.3° | 109.5° |
| C11 | C12 | H12 | 107.7° | 109.5° |
| C11 | C12 | H12A | 106.5° | 109.5° |
| C12 | C13 | C14 | 109.3° | 109.5° |
| C13 | C12 | H12 | 107.7° | 109.5° |
| C13 | C12 | H12A | 106.5° | 109.5° |
| C12 | C13 | H13 | 109.5° | 109.5° |
| C12 | C13 | H13A | 109.6° | 109.5° |
| C13 | C14 | N2 | 109.4° | 109.5° |
| C14 | C13 | H13 | 109.5° | 109.5° |
| C14 | C13 | H13A | 109.6° | 109.5° |
| C13 | C14 | H14 | 109.5° | 109.5° |
| C13 | C14 | H14A | 109.5° | 109.5° |
| N2 | C14 | H14 | 109.5° | 109.4° |
| N2 | C14 | H14A | 109.5° | 109.4° |
| C14 | N2 | HN2 | 109.5° | 111.0° |
| C14 | N2 | HN2A | 109.5° | 111.0° |
| C15 | N3 | C19 | 111.5° | 108.7° |
| N3 | C15 | C16 | 116.3° | 109.9° |
| N3 | C15 | C17 | 103.4° | 107.3° |
| N3 | C15 | H15 | 110.1° | 109.8° |
| N3 | C19 | C18 | 102.2° | 104.7° |
| N3 | C19 | H19 | 112.0° | 110.4° |
| N3 | C19 | H19A | 113.5° | 110.4° |
| C16 | C15 | C17 | 112.4° | 109.9° |
| C15 | C16 | O8 | 120.1° | 120.0° |
| C15 | C16 | N4 | 116.8° | 120.0° |
| C16 | C15 | H15 | 100.7° | 109.9° |
| C15 | C17 | C18 | 103.9° | 102.9° |
| C17 | C15 | H15 | 114.3° | 110.0° |
| C15 | C17 | H17 | 111.4° | 110.7° |
| C15 | C17 | H17A | 112.6° | 110.7° |
| O8 | C16 | N4 | 123.1° | 120.0° |
| C16 | N4 | C20 | 122.4° | 120.0° |
| C16 | N4 | HN4 | 118.8° | 120.0° |
| C17 | C18 | C19 | 103.6° | 101.5° |
| C18 | C17 | H17 | 111.4° | 110.7° |
| C18 | C17 | H17A | 112.5° | 110.7° |
| C17 | C18 | H18 | 111.5° | 111.0° |
| C17 | C18 | H18A | 112.7° | 111.0° |
| C19 | C18 | H18 | 111.5° | 111.2° |
| C19 | C18 | H18A | 112.7° | 110.9° |
| C18 | C19 | H19 | 112.0° | 110.4° |
| C18 | C19 | H19A | 113.5° | 110.3° |
| N4 | C20 | C21 | 109.0° | 109.5° |
| N4 | C20 | C22 | 109.6° | 109.5° |
| C20 | N4 | HN4 | 118.8° | 120.0° |
| N4 | C20 | H20 | 109.6° | 109.5° |
| C21 | C20 | C22 | 109.4° | 109.4° |
| C20 | C21 | O9 | 117.1° | 120.0° |
| C20 | C21 | N5 | 119.4° | 120.0° |
| C21 | C20 | H20 | 109.9° | 109.5° |
| C20 | C22 | C23 | 121.8° | 109.4° |
| C22 | C20 | H20 | 109.3° | 109.5° |
| C20 | C22 | H22 | 105.5° | 109.5° |
| C20 | C22 | H22A | 102.7° | 109.5° |
| O9 | C21 | N5 | 123.4° | 120.0° |
| C21 | N5 | HN5 | 108.7° | 120.0° |
| C21 | N5 | HN5A | 125.6° | 120.0° |
| C22 | C23 | C24 | 112.7° | 109.5° |
| C22 | C23 | C25 | 108.2° | 109.5° |
| C23 | C22 | H22 | 105.6° | 109.5° |
| C23 | C22 | H22A | 102.7° | 109.5° |
| C22 | C23 | H23 | 108.9° | 109.5° |
| C24 | C23 | C25 | 111.7° | 109.5° |
| C24 | C23 | H23 | 105.3° | 109.5° |
| C23 | C24 | H24 | 109.5° | 109.5° |
| C23 | C24 | H24A | 109.4° | 109.5° |
| C23 | C24 | H24B | 109.5° | 109.5° |
| C25 | C23 | H23 | 110.0° | 109.5° |
| C23 | C25 | H25 | 109.5° | 109.5° |
| C23 | C25 | H25A | 109.5° | 109.5° |
| C23 | C25 | H25B | 109.5° | 109.5° |
| H6 | C6 | H6A | 109.4° | 109.5° |
| H6 | C6 | H6B | 109.5° | 109.5° |
| H6A | C6 | H6B | 109.5° | 109.5° |
| H7 | C7 | H7A | 103.4° | 109.5° |
| H11 | C11 | H11A | 112.6° | 109.5° |
| H12 | C12 | H12A | 113.8° | 109.4° |
| H13 | C13 | H13A | 109.3° | 109.5° |
| H14 | C14 | H14A | 109.4° | 109.5° |
| HN2 | N2 | HN2A | 109.4° | 111.0° |
| H17 | C17 | H17A | 105.2° | 110.8° |
| H18 | C18 | H18A | 105.1° | 110.9° |
| H19 | C19 | H19A | 104.0° | 110.4° |
| H22 | C22 | H22A | 119.7° | 109.5° |
| H24 | C24 | H24A | 109.5° | 109.4° |
| H24 | C24 | H24B | 109.4° | 109.4° |
| H24A | C24 | H24B | 109.5° | 109.5° |
| H25 | C25 | H25A | 109.5° | 109.5° |
| H25 | C25 | H25B | 109.5° | 109.4° |
| H25A | C25 | H25B | 109.5° | 109.5° |
| HN5 | N5 | HN5A | 125.6° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | O5 | C7 | 125.3° | 120.0° |
| C2 | C1 | O5 | H1 | 119.6° | 120.0° |
| C2 | C1 | C7 | H1 | 119.3° | 120.0° |
| C1 | C2 | O2 | C3 | 119.4° | 119.6° |
| C1 | C2 | O2 | H2 | 120.2° | 120.2° |
| C1 | C2 | C3 | H2 | 120.2° | 120.0° |
| C1 | C2 | C3 | O3 | 176.2° | 62.9° |
| C1 | C2 | C3 | C4 | 56.2° | 57.0° |
| C2 | C1 | O5 | C5 | 64.1° | 61.1° |
| C2 | C1 | C7 | C8 | 169.4° | 175.0° |
| C1 | C2 | O2 | HO2 | 111.5° | 180.0° |
| C1 | C2 | C3 | H3 | 64.0° | 177.0° |
| C2 | C1 | C7 | H7 | 49.4° | 65.0° |
| C2 | C1 | C7 | H7A | 67.7° | 55.0° |
| O5 | C1 | C7 | H1 | 117.4° | 120.0° |
| O5 | C1 | C2 | O2 | 179.7° | 62.3° |
| O5 | C1 | C2 | C3 | 60.1° | 57.6° |
| C1 | O5 | C5 | C4 | 61.4° | 61.1° |
| C1 | O5 | C5 | C6 | 177.0° | 58.8° |
| O5 | C1 | C7 | C8 | 46.0° | 65.0° |
| O5 | C1 | C2 | H2 | 60.3° | 177.6° |
| C1 | O5 | C5 | H5 | 57.2° | 178.9° |
| O5 | C1 | C7 | H7 | 74.0° | 55.0° |
| O5 | C1 | C7 | H7A | 168.9° | 175.0° |
| C7 | C1 | C2 | O2 | 53.7° | 57.7° |
| C7 | C1 | C2 | C3 | 66.5° | 177.6° |
| C7 | C1 | O5 | C5 | 61.1° | 178.9° |
| C1 | C7 | C8 | H7 | 120.0° | 120.0° |
| C1 | C7 | C8 | H7A | 122.9° | 120.0° |
| C1 | C7 | C8 | O6 | 64.9° | 0.0° |
| C1 | C7 | C8 | N1 | 117.7° | 180.0° |
| C7 | C1 | C2 | H2 | 173.1° | 62.4° |
| C1 | C7 | H7 | H7A | 123.3° | 120.0° |
| O2 | C2 | C3 | H2 | 119.4° | 120.1° |
| O2 | C2 | C3 | O3 | 63.4° | 177.2° |
| O2 | C2 | C3 | C4 | 176.6° | 62.9° |
| O2 | C2 | C1 | H1 | 61.7° | 177.8° |
| O2 | C2 | C3 | H3 | 56.4° | 57.1° |
| C2 | C3 | O3 | C4 | 121.2° | 119.6° |
| C2 | C3 | O3 | H3 | 118.6° | 120.1° |
| C2 | C3 | C4 | H3 | 118.6° | 119.9° |
| C2 | C3 | C4 | O4 | 66.9° | 176.9° |
| C2 | C3 | C4 | C5 | 54.1° | 57.0° |
| C3 | C2 | C1 | H1 | 178.0° | 62.4° |
| C3 | C2 | O2 | HO2 | 7.9° | 60.3° |
| C2 | C3 | O3 | HO3 | 90.6° | 180.0° |
| C2 | C3 | C4 | H4 | 173.0° | 63.0° |
| O3 | C3 | C4 | H3 | 119.8° | 120.2° |
| O3 | C3 | C4 | O4 | 54.6° | 57.0° |
| O3 | C3 | C4 | C5 | 175.6° | 62.9° |
| O3 | C3 | C2 | H2 | 56.0° | 57.1° |
| O3 | C3 | C4 | H4 | 65.4° | 177.1° |
| C3 | C4 | O4 | C5 | 121.8° | 119.7° |
| C3 | C4 | O4 | H4 | 119.2° | 120.1° |
| C3 | C4 | C5 | H4 | 119.1° | 119.9° |
| C3 | C4 | C5 | O5 | 55.3° | 57.6° |
| C3 | C4 | C5 | C6 | 174.9° | 62.4° |
| C4 | C3 | C2 | H2 | 64.0° | 177.0° |
| C4 | C3 | O3 | HO3 | 148.2° | 60.4° |
| C3 | C4 | O4 | HO4 | 51.6° | 180.0° |
| C3 | C4 | C5 | H5 | 65.4° | 177.6° |
| O4 | C4 | C5 | H4 | 120.0° | 120.2° |
| O4 | C4 | C5 | O5 | 65.5° | 177.5° |
| O4 | C4 | C5 | C6 | 54.1° | 57.5° |
| O4 | C4 | C3 | H3 | 174.4° | 63.2° |
| O4 | C4 | C5 | H5 | 173.8° | 62.5° |
| C4 | C5 | O5 | C6 | 121.6° | 120.0° |
| C4 | C5 | O5 | H5 | 118.6° | 120.0° |
| C4 | C5 | C6 | H5 | 118.6° | 120.0° |
| C5 | C4 | C3 | H3 | 64.6° | 176.9° |
| C5 | C4 | O4 | HO4 | 173.4° | 60.3° |
| C4 | C5 | C6 | H6 | 8.1° | 51.0° |
| C4 | C5 | C6 | H6A | 111.8° | 171.0° |
| C4 | C5 | C6 | H6B | 128.1° | 69.0° |
| O5 | C5 | C6 | H5 | 120.7° | 120.1° |
| C5 | O5 | C1 | H1 | 176.3° | 58.8° |
| O5 | C5 | C4 | H4 | 174.5° | 62.3° |
| O5 | C5 | C6 | H6 | 112.6° | 170.9° |
| O5 | C5 | C6 | H6A | 127.4° | 69.1° |
| O5 | C5 | C6 | H6B | 7.4° | 50.9° |
| C6 | C5 | C4 | H4 | 65.9° | 177.7° |
| C5 | C6 | H6 | H6A | 120.0° | 120.0° |
| C5 | C6 | H6 | H6B | 120.0° | 120.0° |
| C5 | C6 | H6A | H6B | 120.0° | 120.0° |
| C7 | C8 | O6 | N1 | 177.4° | 180.0° |
| C7 | C8 | N1 | C9 | 172.4° | 180.0° |
| C8 | C7 | C1 | H1 | 71.3° | 55.0° |
| C8 | C7 | H7 | H7A | 123.3° | 120.0° |
| C7 | C8 | N1 | HN1 | 7.6° | 0.0° |
| O6 | C8 | N1 | C9 | 10.2° | 0.0° |
| O6 | C8 | C7 | H7 | 175.1° | 120.0° |
| O6 | C8 | C7 | H7A | 58.0° | 120.0° |
| O6 | C8 | N1 | HN1 | 169.8° | 180.0° |
| C8 | N1 | C9 | HN1 | 180.0° | 180.0° |
| C8 | N1 | C9 | C10 | 47.1° | 155.0° |
| C8 | N1 | C9 | C11 | 169.9° | 85.0° |
| N1 | C8 | C7 | H7 | 2.3° | 60.0° |
| N1 | C8 | C7 | H7A | 119.4° | 60.0° |
| C8 | N1 | C9 | H9 | 71.0° | 35.0° |
| N1 | C9 | C10 | C11 | 121.9° | 120.0° |
| N1 | C9 | C10 | H9 | 119.1° | 120.0° |
| N1 | C9 | C11 | H9 | 119.1° | 120.0° |
| N1 | C9 | C10 | O7 | 134.7° | 19.8° |
| N1 | C9 | C10 | N3 | 53.0° | 160.1° |
| N1 | C9 | C11 | C12 | 78.2° | 66.2° |
| N1 | C9 | C11 | H11 | 41.8° | 53.8° |
| N1 | C9 | C11 | H11A | 163.5° | 173.8° |
| C10 | C9 | C11 | H9 | 118.1° | 120.0° |
| C9 | C10 | O7 | N3 | 172.4° | 179.9° |
| C10 | C9 | C11 | C12 | 159.1° | 173.8° |
| C9 | C10 | N3 | C15 | 177.0° | 175.1° |
| C9 | C10 | N3 | C19 | 0.9° | 5.1° |
| C10 | C9 | N1 | HN1 | 132.9° | 25.0° |
| C10 | C9 | C11 | H11 | 81.0° | 66.2° |
| C10 | C9 | C11 | H11A | 40.8° | 53.8° |
| C11 | C9 | C10 | O7 | 103.4° | 100.2° |
| C11 | C9 | C10 | N3 | 68.9° | 79.9° |
| C9 | C11 | C12 | H11 | 120.0° | 120.0° |
| C9 | C11 | C12 | H11A | 118.3° | 120.0° |
| C9 | C11 | C12 | C13 | 176.3° | 180.0° |
| C11 | C9 | N1 | HN1 | 10.1° | 95.0° |
| C9 | C11 | H11 | H11A | 118.4° | 120.0° |
| C9 | C11 | C12 | H12 | 63.7° | 60.0° |
| C9 | C11 | C12 | H12A | 58.7° | 60.0° |
| O7 | C10 | N3 | C15 | 4.9° | 5.0° |
| O7 | C10 | N3 | C19 | 173.0° | 174.9° |
| O7 | C10 | C9 | H9 | 15.6° | 139.8° |
| C10 | N3 | C15 | C19 | 178.2° | 179.9° |
| C10 | N3 | C15 | C16 | 59.7° | 59.5° |
| C10 | N3 | C15 | C17 | 176.6° | 178.9° |
| C10 | N3 | C19 | C18 | 159.9° | 155.8° |
| N3 | C10 | C9 | H9 | 172.0° | 40.1° |
| C10 | N3 | C15 | H15 | 54.1° | 61.5° |
| C10 | N3 | C19 | H19 | 80.0° | 85.4° |
| C10 | N3 | C19 | H19A | 37.3° | 37.0° |
| C11 | C12 | C13 | H12 | 120.0° | 120.1° |
| C11 | C12 | C13 | H12A | 117.6° | 120.0° |
| C11 | C12 | C13 | C14 | 175.0° | 180.0° |
| C12 | C11 | C9 | H9 | 41.0° | 53.8° |
| C12 | C11 | H11 | H11A | 118.4° | 120.0° |
| C11 | C12 | H12 | H12A | 117.8° | 120.0° |
| C11 | C12 | C13 | H13 | 55.1° | 60.0° |
| C11 | C12 | C13 | H13A | 64.9° | 60.0° |
| C12 | C13 | C14 | H13 | 120.0° | 120.0° |
| C12 | C13 | C14 | H13A | 120.1° | 120.0° |
| C12 | C13 | C14 | N2 | 65.6° | 180.0° |
| C13 | C12 | C11 | H11 | 56.3° | 60.0° |
| C13 | C12 | C11 | H11A | 65.4° | 60.0° |
| C13 | C12 | H12 | H12A | 117.8° | 120.0° |
| C12 | C13 | H13 | H13A | 120.1° | 120.0° |
| C12 | C13 | C14 | H14 | 174.4° | 60.1° |
| C12 | C13 | C14 | H14A | 54.4° | 60.0° |
| C13 | C14 | N2 | H14 | 120.0° | 120.0° |
| C13 | C14 | N2 | H14A | 120.0° | 120.0° |
| C14 | C13 | C12 | H12 | 64.9° | 59.9° |
| C14 | C13 | C12 | H12A | 57.5° | 60.0° |
| C14 | C13 | H13 | H13A | 120.1° | 120.0° |
| C13 | C14 | H14 | H14A | 120.0° | 120.1° |
| C13 | C14 | N2 | HN2 | 42.7° | 180.0° |
| C13 | C14 | N2 | HN2A | 162.7° | 56.1° |
| N2 | C14 | C13 | H13 | 54.4° | 60.0° |
| N2 | C14 | C13 | H13A | 174.3° | 60.0° |
| N2 | C14 | H14 | H14A | 120.0° | 120.0° |
| C14 | N2 | HN2 | HN2A | 120.0° | 123.9° |
| N3 | C15 | C16 | C17 | 118.9° | 117.8° |
| N3 | C15 | C16 | H15 | 119.0° | 121.0° |
| N3 | C15 | C17 | H15 | 119.7° | 119.5° |
| N3 | C15 | C16 | O8 | 170.8° | 0.0° |
| N3 | C15 | C16 | N4 | 10.2° | 180.0° |
| N3 | C15 | C17 | C18 | 24.5° | 22.2° |
| C15 | N3 | C19 | C18 | 21.9° | 24.4° |
| N3 | C15 | C17 | H17 | 144.5° | 140.6° |
| N3 | C15 | C17 | H17A | 97.6° | 96.1° |
| C15 | N3 | C19 | H19 | 98.1° | 94.5° |
| C15 | N3 | C19 | H19A | 144.6° | 143.2° |
| C19 | N3 | C15 | C16 | 122.1° | 120.7° |
| C19 | N3 | C15 | C17 | 1.6° | 1.2° |
| N3 | C19 | C18 | C17 | 36.6° | 37.3° |
| N3 | C19 | C18 | H19 | 120.0° | 118.8° |
| N3 | C19 | C18 | H19A | 122.6° | 118.8° |
| C19 | N3 | C15 | H15 | 124.1° | 118.3° |
| N3 | C19 | C18 | H18 | 83.4° | 80.9° |
| N3 | C19 | C18 | H18A | 158.8° | 155.3° |
| N3 | C19 | H19 | H19A | 122.9° | 122.4° |
| C16 | C15 | C17 | H15 | 114.0° | 121.1° |
| C15 | C16 | O8 | N4 | 179.0° | 179.9° |
| C16 | C15 | C17 | C18 | 101.8° | 97.2° |
| C15 | C16 | N4 | C20 | 179.1° | 180.0° |
| C16 | C15 | C17 | H17 | 18.2° | 21.2° |
| C16 | C15 | C17 | H17A | 136.2° | 144.4° |
| C15 | C16 | N4 | HN4 | 0.9° | 0.1° |
| C17 | C15 | C16 | O8 | 70.3° | 117.8° |
| C17 | C15 | C16 | N4 | 108.8° | 62.2° |
| C15 | C17 | C18 | H17 | 120.0° | 118.3° |
| C15 | C17 | C18 | H17A | 122.1° | 118.3° |
| C15 | C17 | C18 | C19 | 38.5° | 35.6° |
| C15 | C17 | H17 | H17A | 122.3° | 123.2° |
| C15 | C17 | C18 | H18 | 81.5° | 82.6° |
| C15 | C17 | C18 | H18A | 160.6° | 153.6° |
| O8 | C16 | N4 | C20 | 1.9° | 0.0° |
| O8 | C16 | C15 | H15 | 51.8° | 121.0° |
| O8 | C16 | N4 | HN4 | 178.1° | 180.0° |
| C16 | N4 | C20 | HN4 | 180.0° | 179.9° |
| C16 | N4 | C20 | C21 | 85.1° | 85.0° |
| C16 | N4 | C20 | C22 | 155.2° | 155.1° |
| N4 | C16 | C15 | H15 | 129.2° | 59.0° |
| C16 | N4 | C20 | H20 | 35.3° | 35.0° |
| C17 | C18 | C19 | H18 | 120.0° | 118.1° |
| C17 | C18 | C19 | H18A | 122.2° | 118.0° |
| C18 | C17 | C15 | H15 | 144.2° | 141.7° |
| C18 | C17 | H17 | H17A | 122.2° | 123.3° |
| C17 | C18 | H18 | H18A | 122.4° | 123.9° |
| C17 | C18 | C19 | H19 | 83.4° | 81.6° |
| C17 | C18 | C19 | H19A | 159.2° | 156.1° |
| C19 | C18 | C17 | H17 | 158.5° | 154.0° |
| C19 | C18 | C17 | H17A | 83.6° | 82.7° |
| C19 | C18 | H18 | H18A | 122.4° | 123.9° |
| C18 | C19 | H19 | H19A | 122.9° | 122.3° |
| N4 | C20 | C21 | C22 | 119.9° | 120.0° |
| N4 | C20 | C21 | H20 | 120.2° | 120.0° |
| N4 | C20 | C22 | H20 | 120.2° | 120.0° |
| N4 | C20 | C21 | O9 | 17.8° | 0.0° |
| N4 | C20 | C21 | N5 | 163.6° | 180.0° |
| N4 | C20 | C22 | C23 | 94.2° | 65.0° |
| N4 | C20 | C22 | H22 | 25.8° | 54.9° |
| N4 | C20 | C22 | H22A | 152.0° | 175.0° |
| C21 | C20 | C22 | H20 | 120.3° | 120.0° |
| C20 | C21 | O9 | N5 | 178.5° | 179.9° |
| C21 | C20 | C22 | C23 | 146.3° | 175.0° |
| C21 | C20 | N4 | HN4 | 94.9° | 94.9° |
| C21 | C20 | C22 | H22 | 93.7° | 65.0° |
| C21 | C20 | C22 | H22A | 32.5° | 55.0° |
| C20 | C21 | N5 | HN5 | 0.7° | 0.1° |
| C20 | C21 | N5 | HN5A | 179.3° | 180.0° |
| C22 | C20 | C21 | O9 | 102.0° | 120.0° |
| C22 | C20 | C21 | N5 | 76.5° | 60.0° |
| C20 | C22 | C23 | H22 | 120.0° | 120.0° |
| C20 | C22 | C23 | H22A | 113.8° | 120.0° |
| C20 | C22 | C23 | C24 | 22.8° | 175.0° |
| C20 | C22 | C23 | C25 | 146.8° | 65.0° |
| C22 | C20 | N4 | HN4 | 24.8° | 25.0° |
| C20 | C22 | H22 | H22A | 114.9° | 120.1° |
| C20 | C22 | C23 | H23 | 93.6° | 55.0° |
| O9 | C21 | C20 | H20 | 138.0° | 120.0° |
| O9 | C21 | N5 | HN5 | 179.1° | 180.0° |
| O9 | C21 | N5 | HN5A | 0.8° | 0.1° |
| N5 | C21 | C20 | H20 | 43.4° | 60.0° |
| C21 | N5 | HN5 | HN5A | 180.0° | 179.9° |
| C22 | C23 | C24 | C25 | 122.1° | 120.0° |
| C22 | C23 | C24 | H23 | 118.6° | 120.0° |
| C22 | C23 | C25 | H23 | 118.9° | 120.0° |
| C23 | C22 | C20 | H20 | 26.0° | 55.0° |
| C23 | C22 | H22 | H22A | 114.9° | 120.0° |
| C22 | C23 | C24 | H24 | 39.4° | 60.0° |
| C22 | C23 | C24 | H24A | 80.6° | 180.0° |
| C22 | C23 | C24 | H24B | 159.4° | 60.0° |
| C22 | C23 | C25 | H25 | 139.5° | 60.0° |
| C22 | C23 | C25 | H25A | 19.4° | 60.0° |
| C22 | C23 | C25 | H25B | 100.5° | 179.9° |
| C24 | C23 | C25 | H23 | 116.5° | 120.0° |
| C24 | C23 | C22 | H22 | 97.2° | 55.0° |
| C24 | C23 | C22 | H22A | 136.7° | 65.0° |
| C23 | C24 | H24 | H24A | 120.0° | 120.0° |
| C23 | C24 | H24 | H24B | 120.0° | 120.0° |
| C23 | C24 | H24A | H24B | 120.0° | 120.1° |
| C24 | C23 | C25 | H25 | 14.8° | 60.0° |
| C24 | C23 | C25 | H25A | 105.2° | 180.0° |
| C24 | C23 | C25 | H25B | 134.8° | 60.0° |
| C25 | C23 | C22 | H22 | 26.9° | 175.0° |
| C25 | C23 | C22 | H22A | 99.3° | 55.0° |
| C25 | C23 | C24 | H24 | 161.5° | 60.0° |
| C25 | C23 | C24 | H24A | 41.5° | 60.0° |
| C25 | C23 | C24 | H24B | 78.5° | 180.0° |
| C23 | C25 | H25 | H25A | 120.0° | 120.0° |
| C23 | C25 | H25 | H25B | 120.0° | 120.0° |
| C23 | C25 | H25A | H25B | 120.0° | 120.0° |
| H1 | C1 | C2 | H2 | 57.7° | 57.6° |
| H1 | C1 | C7 | H7 | 168.7° | 175.0° |
| H1 | C1 | C7 | H7A | 51.5° | 65.0° |
| H2 | C2 | O2 | HO2 | 128.2° | 59.8° |
| H2 | C2 | C3 | H3 | 175.8° | 63.1° |
| H3 | C3 | O3 | HO3 | 28.0° | 59.9° |
| H3 | C3 | C4 | H4 | 54.4° | 56.9° |
| H4 | C4 | O4 | HO4 | 67.6° | 59.9° |
| H4 | C4 | C5 | H5 | 53.8° | 57.7° |
| H5 | C5 | C6 | H6 | 126.7° | 69.0° |
| H5 | C5 | C6 | H6A | 6.7° | 51.0° |
| H5 | C5 | C6 | H6B | 113.3° | 171.0° |
| H6 | C6 | H6A | H6B | 120.0° | 120.0° |
| HN1 | N1 | C9 | H9 | 109.0° | 145.0° |
| H9 | C9 | C11 | H11 | 161.0° | 173.8° |
| H9 | C9 | C11 | H11A | 77.3° | 66.2° |
| H11 | C11 | C12 | H12 | 176.3° | 180.0° |
| H11 | C11 | C12 | H12A | 61.3° | 60.0° |
| H11A | C11 | C12 | H12 | 54.6° | 60.0° |
| H11A | C11 | C12 | H12A | 177.0° | 179.9° |
| H12 | C12 | C13 | H13 | 175.1° | 179.9° |
| H12 | C12 | C13 | H13A | 55.2° | 60.1° |
| H12A | C12 | C13 | H13 | 62.5° | 60.0° |
| H12A | C12 | C13 | H13A | 177.5° | 180.0° |
| H13 | C13 | C14 | H14 | 65.6° | 179.9° |
| H13 | C13 | C14 | H14A | 174.4° | 60.0° |
| H13A | C13 | C14 | H14 | 54.3° | 60.0° |
| H13A | C13 | C14 | H14A | 65.7° | 179.9° |
| H14 | C14 | N2 | HN2 | 77.3° | 60.0° |
| H14 | C14 | N2 | HN2A | 42.7° | 176.1° |
| H14A | C14 | N2 | HN2 | 162.7° | 60.0° |
| H14A | C14 | N2 | HN2A | 77.3° | 63.9° |
| H15 | C15 | C17 | H17 | 95.8° | 100.0° |
| H15 | C15 | C17 | H17A | 22.2° | 23.3° |
| H17 | C17 | C18 | H18 | 38.5° | 35.7° |
| H17 | C17 | C18 | H18A | 79.4° | 88.1° |
| H17A | C17 | C18 | H18 | 156.4° | 159.0° |
| H17A | C17 | C18 | H18A | 38.5° | 35.2° |
| H18 | C18 | C19 | H19 | 156.6° | 160.3° |
| H18 | C18 | C19 | H19A | 39.3° | 38.0° |
| H18A | C18 | C19 | H19 | 38.8° | 36.5° |
| H18A | C18 | C19 | H19A | 78.6° | 85.9° |
| HN4 | N4 | C20 | H20 | 144.7° | 145.1° |
| H20 | C20 | C22 | H22 | 146.0° | 175.0° |
| H20 | C20 | C22 | H22A | 87.8° | 65.0° |
| H22 | C22 | C23 | H23 | 146.4° | 65.0° |
| H22A | C22 | C23 | H23 | 20.2° | 175.0° |
| H23 | C23 | C24 | H24 | 79.2° | 180.0° |
| H23 | C23 | C24 | H24A | 160.8° | 60.0° |
| H23 | C23 | C24 | H24B | 40.8° | 60.0° |
| H23 | C23 | C25 | H25 | 101.7° | NaN° |
| H23 | C23 | C25 | H25A | 138.3° | 60.0° |
| H23 | C23 | C25 | H25B | 18.3° | 60.0° |
| H24 | C24 | H24A | H24B | 120.0° | 119.9° |
| H25 | C25 | H25A | H25B | 120.0° | 120.0° |
