A1L62
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.38Å | 1.41Å | Aromatic |
| C1 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | C2 | sing | 1.38Å | 1.42Å | Aromatic |
| C2 | CD | sing | 1.51Å | 1.52Å | |
| C4 | C3 | doub | 1.38Å | 1.41Å | Aromatic |
| C7 | C3 | sing | 1.51Å | 1.53Å | |
| C5 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| C7 | C8 | sing | 1.53Å | 1.54Å | |
| CB | C7 | sing | 1.53Å | 1.54Å | |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| C9 | N1 | sing | 1.47Å | 1.47Å | |
| N1 | CA | sing | 1.47Å | 1.47Å | |
| CC | N1 | sing | 1.47Å | 1.46Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CD | CE | sing | 1.53Å | 1.56Å | |
| CE | N2 | sing | 1.47Å | 1.46Å | |
| C10 | CE | sing | 1.53Å | 1.54Å | |
| C11 | CE | sing | 1.53Å | 1.54Å | |
| N2 | CF | sing | 1.38Å | 1.37Å | |
| CF | N3 | doub | 1.33Å | 1.33Å | Aromatic |
| CF | N5 | sing | 1.33Å | 1.32Å | Aromatic |
| N3 | C12 | sing | 1.33Å | 1.35Å | Aromatic |
| N4 | C12 | doub | 1.33Å | 1.34Å | Aromatic |
| C12 | N7 | sing | 1.39Å | 1.45Å | |
| C13 | N4 | sing | 1.33Å | 1.32Å | Aromatic |
| N5 | C13 | doub | 1.33Å | 1.31Å | Aromatic |
| N6 | C13 | sing | 1.38Å | 1.36Å | |
| N6 | C14 | sing | 1.47Å | 1.46Å | |
| C17 | N6 | sing | 1.47Å | 1.46Å | |
| N7 | C18 | sing | 1.36Å | 1.40Å | Aromatic |
| N7 | C1A | sing | 1.38Å | 1.40Å | Aromatic |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | O1 | sing | 1.43Å | 1.44Å | |
| O1 | C16 | sing | 1.43Å | 1.43Å | |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| N8 | C18 | doub | 1.30Å | 1.32Å | Aromatic |
| C18 | C1F | sing | 1.51Å | 1.49Å | |
| C19 | N8 | sing | 1.36Å | 1.36Å | Aromatic |
| C19 | C1A | doub | 1.40Å | 1.39Å | Aromatic |
| C1B | C19 | sing | 1.40Å | 1.40Å | Aromatic |
| C1A | C1E | sing | 1.39Å | 1.40Å | Aromatic |
| C1C | C1B | doub | 1.38Å | 1.40Å | Aromatic |
| C1D | C1C | sing | 1.39Å | 1.39Å | Aromatic |
| C1E | C1D | doub | 1.38Å | 1.40Å | Aromatic |
| F1 | C1F | sing | 1.40Å | 1.37Å | |
| C1F | F2 | sing | 1.40Å | 1.36Å | |
| C4 | H2 | sing | 1.08Å | 1.08Å | |
| C5 | H3 | sing | 1.08Å | 1.08Å | |
| C6 | H4 | sing | 1.08Å | 1.08Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C10 | H16 | sing | 1.09Å | 1.10Å | |
| C10 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | H1D | sing | 1.09Å | 1.10Å | |
| C15 | H1C | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| CA | HB | sing | 1.09Å | 1.10Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | HC | sing | 1.09Å | 1.10Å | |
| CB | HD | sing | 1.09Å | 1.10Å | |
| CD | H11 | sing | 1.09Å | 1.10Å | |
| CD | H12 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C11 | H18 | sing | 1.09Å | 1.10Å | |
| C11 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H1A | sing | 1.09Å | 1.10Å | |
| C14 | H1B | sing | 1.09Å | 1.10Å | |
| C16 | H1E | sing | 1.09Å | 1.10Å | |
| C16 | H1F | sing | 1.09Å | 1.10Å | |
| C1B | H22 | sing | 1.08Å | 1.08Å | |
| C1C | H23 | sing | 1.08Å | 1.08Å | |
| C1D | H24 | sing | 1.08Å | 1.08Å | |
| C1E | H25 | sing | 1.08Å | 1.08Å | |
| C1F | H26 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| CC | HE | sing | 1.09Å | 1.10Å | |
| CC | H10 | sing | 1.09Å | 1.10Å | |
| CC | HF | sing | 1.09Å | 1.10Å | |
| N2 | H13 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 121.9° | 120.0° |
| C1 | C2 | C3 | 118.6° | 120.0° |
| C1 | C2 | CD | 116.3° | 120.0° |
| C2 | C1 | H1 | 119.1° | 120.0° |
| C1 | C6 | C5 | 119.5° | 120.0° |
| C1 | C6 | H4 | 120.3° | 120.0° |
| C6 | C1 | H1 | 119.0° | 120.0° |
| C3 | C2 | CD | 125.1° | 120.0° |
| C2 | C3 | C4 | 118.3° | 120.0° |
| C2 | C3 | C7 | 123.8° | 120.0° |
| C2 | CD | CE | 118.7° | 109.4° |
| C2 | CD | H11 | 107.1° | 109.5° |
| C2 | CD | H12 | 107.1° | 109.4° |
| C4 | C3 | C7 | 117.9° | 120.0° |
| C3 | C4 | C5 | 121.9° | 120.0° |
| C3 | C4 | H2 | 119.0° | 120.0° |
| C3 | C7 | C8 | 111.2° | 109.5° |
| C3 | C7 | CB | 113.2° | 109.5° |
| C3 | C7 | H5 | 107.7° | 109.5° |
| C4 | C5 | C6 | 119.8° | 120.0° |
| C5 | C4 | H2 | 119.1° | 120.0° |
| C4 | C5 | H3 | 120.1° | 120.0° |
| C6 | C5 | H3 | 120.1° | 120.0° |
| C5 | C6 | H4 | 120.2° | 120.0° |
| C8 | C7 | CB | 109.2° | 109.2° |
| C7 | C8 | C9 | 110.9° | 109.3° |
| C8 | C7 | H5 | 107.6° | 109.5° |
| C7 | C8 | H7 | 109.1° | 109.5° |
| C7 | C8 | H6 | 109.1° | 109.5° |
| C7 | CB | CA | 110.5° | 109.3° |
| CB | C7 | H5 | 107.6° | 109.6° |
| C7 | CB | HC | 109.2° | 109.5° |
| C7 | CB | HD | 109.2° | 109.5° |
| C8 | C9 | N1 | 111.3° | 109.5° |
| C9 | C8 | H7 | 109.1° | 109.6° |
| C9 | C8 | H6 | 109.1° | 109.5° |
| C8 | C9 | H9 | 109.0° | 109.5° |
| C8 | C9 | H8 | 109.0° | 109.5° |
| C9 | N1 | CA | 111.6° | 111.2° |
| C9 | N1 | CC | 110.4° | 111.0° |
| N1 | C9 | H9 | 109.0° | 109.4° |
| N1 | C9 | H8 | 109.0° | 109.4° |
| CA | N1 | CC | 110.3° | 111.0° |
| N1 | CA | CB | 110.8° | 109.5° |
| N1 | CA | HB | 109.1° | 109.5° |
| N1 | CA | HA | 109.1° | 109.4° |
| N1 | CC | HE | 109.5° | 109.5° |
| N1 | CC | H10 | 109.4° | 109.4° |
| N1 | CC | HF | 109.4° | 109.5° |
| CB | CA | HB | 109.1° | 109.5° |
| CB | CA | HA | 109.1° | 109.5° |
| CA | CB | HC | 109.2° | 109.5° |
| CA | CB | HD | 109.2° | 109.5° |
| CD | CE | N2 | 111.3° | 109.4° |
| CD | CE | C10 | 112.5° | 109.5° |
| CD | CE | C11 | 112.5° | 109.5° |
| CE | CD | H11 | 107.1° | 109.5° |
| CE | CD | H12 | 107.1° | 109.5° |
| N2 | CE | C10 | 107.5° | 109.4° |
| N2 | CE | C11 | 106.6° | 109.5° |
| CE | N2 | CF | 133.6° | 120.0° |
| CE | N2 | H13 | 103.1° | 120.0° |
| C10 | CE | C11 | 106.0° | 109.5° |
| CE | C10 | H15 | 109.5° | 109.5° |
| CE | C10 | H16 | 109.5° | 109.5° |
| CE | C10 | H14 | 109.5° | 109.5° |
| CE | C11 | H17 | 109.5° | 109.5° |
| CE | C11 | H18 | 109.5° | 109.5° |
| CE | C11 | H19 | 109.5° | 109.4° |
| N2 | CF | N3 | 125.3° | 120.0° |
| N2 | CF | N5 | 111.3° | 120.1° |
| CF | N2 | H13 | 103.1° | 120.0° |
| N3 | CF | N5 | 123.4° | 120.0° |
| CF | N3 | C12 | 116.2° | 120.0° |
| CF | N5 | C13 | 118.0° | 120.0° |
| N3 | C12 | N4 | 122.1° | 120.0° |
| N3 | C12 | N7 | 122.4° | 120.0° |
| N4 | C12 | N7 | 115.5° | 120.0° |
| C12 | N4 | C13 | 117.7° | 120.0° |
| C12 | N7 | C18 | 129.1° | 126.4° |
| C12 | N7 | C1A | 125.0° | 126.4° |
| N4 | C13 | N5 | 122.5° | 120.0° |
| N4 | C13 | N6 | 120.3° | 120.0° |
| N5 | C13 | N6 | 117.2° | 120.0° |
| C13 | N6 | C14 | 120.2° | 111.0° |
| C13 | N6 | C17 | 122.3° | 111.0° |
| C14 | N6 | C17 | 117.4° | 110.8° |
| N6 | C14 | C15 | 110.3° | 109.3° |
| N6 | C14 | H1A | 109.3° | 109.5° |
| N6 | C14 | H1B | 109.3° | 109.6° |
| N6 | C17 | C16 | 109.9° | 109.3° |
| N6 | C17 | H20 | 109.4° | 109.6° |
| N6 | C17 | H21 | 109.4° | 109.5° |
| C18 | N7 | C1A | 105.9° | 107.2° |
| N7 | C18 | N8 | 111.4° | 110.0° |
| N7 | C18 | C1F | 124.7° | 125.0° |
| N7 | C1A | C19 | 105.3° | 106.0° |
| N7 | C1A | C1E | 134.1° | 134.1° |
| C14 | C15 | O1 | 111.2° | 109.2° |
| C14 | C15 | H1D | 109.0° | 109.5° |
| C14 | C15 | H1C | 109.0° | 109.6° |
| C15 | C14 | H1A | 109.3° | 109.5° |
| C15 | C14 | H1B | 109.3° | 109.5° |
| C15 | O1 | C16 | 110.5° | 113.8° |
| O1 | C15 | H1D | 109.0° | 109.5° |
| O1 | C15 | H1C | 109.0° | 109.5° |
| O1 | C16 | C17 | 110.8° | 109.2° |
| O1 | C16 | H1E | 109.2° | 109.5° |
| O1 | C16 | H1F | 109.1° | 109.5° |
| C16 | C17 | H20 | 109.4° | 109.5° |
| C16 | C17 | H21 | 109.3° | 109.5° |
| C17 | C16 | H1E | 109.1° | 109.5° |
| C17 | C16 | H1F | 109.1° | 109.6° |
| N8 | C18 | C1F | 123.9° | 125.0° |
| C18 | N8 | C19 | 106.3° | 109.8° |
| C18 | C1F | F1 | 111.0° | 109.5° |
| C18 | C1F | F2 | 111.1° | 109.5° |
| C18 | C1F | H26 | 108.5° | 109.5° |
| N8 | C19 | C1A | 111.0° | 107.0° |
| N8 | C19 | C1B | 128.6° | 133.5° |
| C1A | C19 | C1B | 120.4° | 119.5° |
| C19 | C1A | C1E | 120.6° | 120.0° |
| C19 | C1B | C1C | 119.3° | 119.8° |
| C19 | C1B | H22 | 120.4° | 120.1° |
| C1A | C1E | C1D | 118.6° | 119.8° |
| C1A | C1E | H25 | 120.7° | 120.1° |
| C1B | C1C | C1D | 120.2° | 120.5° |
| C1C | C1B | H22 | 120.4° | 120.1° |
| C1B | C1C | H23 | 119.9° | 119.8° |
| C1C | C1D | C1E | 120.9° | 120.5° |
| C1D | C1C | H23 | 119.9° | 119.7° |
| C1C | C1D | H24 | 119.5° | 119.8° |
| C1E | C1D | H24 | 119.5° | 119.8° |
| C1D | C1E | H25 | 120.7° | 120.1° |
| F1 | C1F | F2 | 105.9° | 109.5° |
| F1 | C1F | H26 | 110.1° | 109.5° |
| F2 | C1F | H26 | 110.2° | 109.5° |
| H7 | C8 | H6 | 109.5° | 109.5° |
| H15 | C10 | H16 | 109.5° | 109.4° |
| H15 | C10 | H14 | 109.5° | 109.4° |
| H16 | C10 | H14 | 109.5° | 109.4° |
| H1D | C15 | H1C | 109.5° | 109.5° |
| H20 | C17 | H21 | 109.5° | 109.5° |
| HB | CA | HA | 109.4° | 109.5° |
| HC | CB | HD | 109.5° | 109.5° |
| H11 | CD | H12 | 109.5° | 109.5° |
| H17 | C11 | H18 | 109.4° | 109.5° |
| H17 | C11 | H19 | 109.5° | 109.5° |
| H18 | C11 | H19 | 109.5° | 109.5° |
| H1A | C14 | H1B | 109.5° | 109.5° |
| H1E | C16 | H1F | 109.5° | 109.5° |
| H9 | C9 | H8 | 109.5° | 109.4° |
| HE | CC | H10 | 109.5° | 109.5° |
| HE | CC | HF | 109.5° | 109.5° |
| H10 | CC | HF | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | H1 | 180.0° | 179.9° |
| C1 | C2 | C3 | CD | 179.0° | 180.0° |
| C1 | C2 | C3 | C4 | 0.8° | 0.0° |
| C1 | C2 | C3 | C7 | 179.8° | 179.8° |
| C2 | C1 | C6 | C5 | 0.4° | 0.0° |
| C1 | C2 | CD | CE | 93.4° | 85.8° |
| C2 | C1 | C6 | H4 | 179.6° | 180.0° |
| C1 | C2 | CD | H11 | 145.3° | 154.2° |
| C1 | C2 | CD | H12 | 27.9° | 34.2° |
| C6 | C1 | C2 | C3 | 0.8° | 0.0° |
| C6 | C1 | C2 | CD | 179.8° | 180.0° |
| C1 | C6 | C5 | C4 | 0.1° | 0.1° |
| C1 | C6 | C5 | H4 | 180.0° | 180.0° |
| C1 | C6 | C5 | H3 | 179.9° | 180.0° |
| C2 | C3 | C4 | C7 | 179.4° | 179.8° |
| C2 | C3 | C4 | C5 | 0.5° | 0.0° |
| C2 | C3 | C7 | C8 | 131.3° | 113.7° |
| C2 | C3 | C7 | CB | 105.2° | 126.5° |
| C3 | C2 | CD | CE | 87.6° | 94.2° |
| C2 | C3 | C4 | H2 | 179.5° | 179.7° |
| C2 | C3 | C7 | H5 | 13.6° | 6.3° |
| C3 | C2 | CD | H11 | 33.7° | 25.8° |
| C3 | C2 | CD | H12 | 151.1° | 145.8° |
| C3 | C2 | C1 | H1 | 179.2° | 179.9° |
| CD | C2 | C3 | C4 | 179.8° | 180.0° |
| CD | C2 | C3 | C7 | 0.9° | 0.3° |
| C2 | CD | CE | H11 | 121.3° | 120.0° |
| C2 | CD | CE | H12 | 121.3° | 120.0° |
| C2 | CD | CE | N2 | 115.5° | 175.2° |
| C2 | CD | CE | C10 | 123.7° | 64.9° |
| C2 | CD | CE | C11 | 4.1° | 55.1° |
| C2 | CD | H11 | H12 | 115.8° | 120.0° |
| CD | C2 | C1 | H1 | 0.2° | 0.1° |
| C3 | C4 | C5 | H2 | 180.0° | 179.7° |
| C3 | C4 | C5 | C6 | 0.1° | 0.1° |
| C4 | C3 | C7 | C8 | 48.1° | 66.0° |
| C4 | C3 | C7 | CB | 75.4° | 53.7° |
| C3 | C4 | C5 | H3 | 179.9° | 180.0° |
| C4 | C3 | C7 | H5 | 165.8° | 173.9° |
| C7 | C3 | C4 | C5 | 179.9° | 179.7° |
| C3 | C7 | C8 | CB | 125.7° | 120.0° |
| C3 | C7 | C8 | H5 | 117.8° | 120.0° |
| C3 | C7 | CB | H5 | 118.9° | 120.1° |
| C3 | C7 | C8 | C9 | 180.0° | 177.6° |
| C3 | C7 | CB | CA | 179.8° | 177.6° |
| C7 | C3 | C4 | H2 | 0.1° | 0.1° |
| C3 | C7 | C8 | H7 | 59.7° | 62.4° |
| C3 | C7 | C8 | H6 | 59.8° | 57.6° |
| C3 | C7 | CB | HC | 59.6° | 57.6° |
| C3 | C7 | CB | HD | 60.1° | 62.5° |
| C4 | C5 | C6 | H3 | 180.0° | 180.0° |
| C4 | C5 | C6 | H4 | 179.9° | 180.0° |
| C6 | C5 | C4 | H2 | 179.9° | 179.7° |
| C5 | C6 | C1 | H1 | 179.6° | 179.9° |
| C8 | C7 | CB | H5 | 116.5° | 119.9° |
| C7 | C8 | C9 | H7 | 120.2° | 120.0° |
| C7 | C8 | C9 | H6 | 120.2° | 119.9° |
| C7 | C8 | C9 | N1 | 56.1° | 59.1° |
| C8 | C7 | CB | CA | 55.2° | 57.6° |
| C7 | C8 | H7 | H6 | 119.4° | 120.0° |
| C8 | C7 | CB | HC | 64.9° | 62.3° |
| C8 | C7 | CB | HD | 175.4° | 177.6° |
| C7 | C8 | C9 | H9 | 64.2° | 179.2° |
| C7 | C8 | C9 | H8 | 176.3° | 60.9° |
| CB | C7 | C8 | C9 | 54.3° | 57.6° |
| C7 | CB | CA | N1 | 57.9° | 59.2° |
| C7 | CB | CA | HC | 120.1° | 119.9° |
| C7 | CB | CA | HD | 120.2° | 120.0° |
| CB | C7 | C8 | H7 | 174.6° | 177.7° |
| CB | C7 | C8 | H6 | 65.9° | 62.3° |
| C7 | CB | CA | HB | 62.4° | 60.9° |
| C7 | CB | CA | HA | 178.1° | 179.2° |
| C7 | CB | HC | HD | 119.5° | 120.1° |
| C8 | C9 | N1 | H9 | 120.3° | 120.0° |
| C8 | C9 | N1 | H8 | 120.3° | 120.0° |
| C8 | C9 | N1 | CA | 58.2° | 61.7° |
| C8 | C9 | N1 | CC | 178.7° | 174.2° |
| C9 | C8 | C7 | H5 | 62.2° | 62.4° |
| C9 | C8 | H7 | H6 | 119.3° | 120.1° |
| C8 | C9 | H9 | H8 | 119.2° | 120.0° |
| C9 | N1 | CA | CC | 123.1° | 124.1° |
| C9 | N1 | CA | CB | 59.1° | 61.8° |
| N1 | C9 | C8 | H7 | 176.3° | 179.2° |
| N1 | C9 | C8 | H6 | 64.2° | 60.8° |
| C9 | N1 | CA | HB | 61.1° | 58.3° |
| C9 | N1 | CA | HA | 179.4° | 178.2° |
| N1 | C9 | H9 | H8 | 119.2° | 119.9° |
| C9 | N1 | CC | HE | 180.0° | 64.1° |
| C9 | N1 | CC | H10 | 60.0° | 55.8° |
| C9 | N1 | CC | HF | 60.0° | 175.8° |
| N1 | CA | CB | HB | 120.2° | 120.0° |
| N1 | CA | CB | HA | 120.2° | 120.0° |
| N1 | CA | HB | HA | 119.4° | 120.0° |
| N1 | CA | CB | HC | 62.3° | 60.7° |
| N1 | CA | CB | HD | 178.0° | 179.1° |
| CA | N1 | C9 | H9 | 62.0° | 178.2° |
| CA | N1 | C9 | H8 | 178.5° | 58.3° |
| CA | N1 | CC | HE | 56.2° | 60.0° |
| CA | N1 | CC | H10 | 63.8° | 180.0° |
| CA | N1 | CC | HF | 176.2° | 60.0° |
| CC | N1 | CA | CB | 177.7° | 174.1° |
| CC | N1 | CA | HB | 62.1° | 65.8° |
| CC | N1 | CA | HA | 57.5° | 54.2° |
| CC | N1 | C9 | H9 | 61.0° | 54.2° |
| CC | N1 | C9 | H8 | 58.4° | 65.8° |
| N1 | CC | HE | H10 | 120.0° | 119.9° |
| N1 | CC | HE | HF | 120.0° | 120.0° |
| N1 | CC | H10 | HF | 119.9° | 120.0° |
| CA | CB | C7 | H5 | 61.3° | 62.3° |
| CB | CA | HB | HA | 119.3° | 120.0° |
| CA | CB | HC | HD | 119.6° | 120.1° |
| CD | CE | N2 | C10 | 123.6° | 120.0° |
| CD | CE | N2 | C11 | 123.1° | 120.0° |
| CD | CE | C10 | C11 | 123.4° | 120.1° |
| CD | CE | N2 | CF | 24.0° | 180.0° |
| CD | CE | C10 | H15 | 180.0° | 59.9° |
| CD | CE | C10 | H16 | 60.0° | 180.0° |
| CD | CE | C10 | H14 | 60.0° | 60.0° |
| CE | CD | H11 | H12 | 115.8° | 120.1° |
| CD | CE | C11 | H17 | 180.0° | 175.5° |
| CD | CE | C11 | H18 | 60.0° | 64.4° |
| CD | CE | C11 | H19 | 60.0° | 55.6° |
| CD | CE | N2 | H13 | 147.1° | 0.0° |
| N2 | CE | C10 | C11 | 113.7° | 120.0° |
| CE | N2 | CF | H13 | 123.0° | 180.0° |
| CE | N2 | CF | N3 | 107.7° | 0.0° |
| CE | N2 | CF | N5 | 75.8° | 179.9° |
| N2 | CE | C10 | H15 | 57.1° | 60.0° |
| N2 | CE | C10 | H16 | 177.1° | 60.0° |
| N2 | CE | C10 | H14 | 62.9° | 180.0° |
| N2 | CE | CD | H11 | 123.2° | 55.2° |
| N2 | CE | CD | H12 | 5.8° | 64.9° |
| N2 | CE | C11 | H17 | 57.7° | 64.5° |
| N2 | CE | C11 | H18 | 62.3° | 55.6° |
| N2 | CE | C11 | H19 | 177.7° | 175.6° |
| C10 | CE | N2 | CF | 147.7° | 60.0° |
| CE | C10 | H15 | H16 | 120.0° | 120.1° |
| CE | C10 | H15 | H14 | 120.0° | 120.0° |
| CE | C10 | H16 | H14 | 120.0° | 120.0° |
| C10 | CE | CD | H11 | 2.4° | 175.1° |
| C10 | CE | CD | H12 | 115.0° | 55.0° |
| C10 | CE | C11 | H17 | 56.7° | 55.5° |
| C10 | CE | C11 | H18 | 176.7° | 175.5° |
| C10 | CE | C11 | H19 | 63.3° | 64.5° |
| C10 | CE | N2 | H13 | 89.3° | 120.0° |
| C11 | CE | N2 | CF | 99.0° | 60.0° |
| C11 | CE | C10 | H15 | 56.7° | 180.0° |
| C11 | CE | C10 | H16 | 63.4° | 59.9° |
| C11 | CE | C10 | H14 | 176.6° | 60.0° |
| C11 | CE | CD | H11 | 117.2° | 64.8° |
| C11 | CE | CD | H12 | 125.4° | 175.1° |
| CE | C11 | H17 | H18 | 120.0° | 120.1° |
| CE | C11 | H17 | H19 | 120.0° | 120.0° |
| CE | C11 | H18 | H19 | 120.0° | 120.0° |
| C11 | CE | N2 | H13 | 24.0° | 120.0° |
| N2 | CF | N3 | N5 | 176.1° | 180.0° |
| N2 | CF | N3 | C12 | 178.1° | 180.0° |
| N2 | CF | N5 | C13 | 179.0° | 180.0° |
| CF | N3 | C12 | N4 | 0.4° | 0.1° |
| CF | N3 | C12 | N7 | 179.3° | 180.0° |
| N3 | CF | N5 | C13 | 2.4° | 0.0° |
| N3 | CF | N2 | H13 | 15.3° | 180.0° |
| N5 | CF | N3 | C12 | 2.0° | 0.1° |
| CF | N5 | C13 | N4 | 1.2° | 0.0° |
| CF | N5 | C13 | N6 | 179.0° | 180.0° |
| N5 | CF | N2 | H13 | 161.2° | 0.0° |
| N3 | C12 | N4 | N7 | 179.7° | 179.9° |
| N3 | C12 | N4 | C13 | 0.7° | 0.0° |
| N3 | C12 | N7 | C18 | 41.0° | 178.4° |
| N3 | C12 | N7 | C1A | 136.5° | 1.6° |
| C12 | N4 | C13 | N5 | 0.3° | 0.0° |
| C12 | N4 | C13 | N6 | 179.5° | 180.0° |
| N4 | C12 | N7 | C18 | 138.6° | 1.5° |
| N4 | C12 | N7 | C1A | 43.8° | 178.5° |
| N7 | C12 | N4 | C13 | 179.6° | 179.9° |
| C12 | N7 | C18 | C1A | 177.9° | 180.0° |
| C12 | N7 | C18 | N8 | 178.8° | 179.7° |
| C12 | N7 | C18 | C1F | 1.6° | 0.0° |
| C12 | N7 | C1A | C19 | 179.0° | 179.8° |
| C12 | N7 | C1A | C1E | 2.2° | 0.2° |
| N4 | C13 | N5 | N6 | 179.8° | 180.0° |
| N4 | C13 | N6 | C14 | 169.2° | 56.4° |
| N4 | C13 | N6 | C17 | 15.2° | 180.0° |
| N5 | C13 | N6 | C14 | 11.0° | 123.6° |
| N5 | C13 | N6 | C17 | 164.6° | 0.0° |
| C13 | N6 | C14 | C17 | 175.8° | 123.8° |
| C13 | N6 | C14 | C15 | 130.4° | 177.6° |
| C13 | N6 | C17 | C16 | 129.5° | 177.6° |
| C13 | N6 | C17 | H20 | 110.4° | 62.4° |
| C13 | N6 | C17 | H21 | 9.5° | 57.7° |
| C13 | N6 | C14 | H1A | 10.3° | 57.7° |
| C13 | N6 | C14 | H1B | 109.5° | 62.5° |
| N6 | C14 | C15 | H1A | 120.1° | 120.0° |
| N6 | C14 | C15 | H1B | 120.1° | 120.0° |
| N6 | C14 | C15 | O1 | 51.3° | 56.8° |
| C14 | N6 | C17 | C16 | 46.2° | 58.7° |
| N6 | C14 | C15 | H1D | 68.9° | 176.8° |
| N6 | C14 | C15 | H1C | 171.6° | 63.1° |
| C14 | N6 | C17 | H20 | 73.9° | 61.3° |
| C14 | N6 | C17 | H21 | 166.3° | 178.6° |
| N6 | C14 | H1A | H1B | 119.7° | 120.2° |
| C17 | N6 | C14 | C15 | 45.4° | 58.7° |
| N6 | C17 | C16 | O1 | 53.0° | 56.8° |
| N6 | C17 | C16 | H20 | 120.1° | 120.0° |
| N6 | C17 | C16 | H21 | 120.1° | 120.0° |
| N6 | C17 | H20 | H21 | 119.8° | 120.1° |
| C17 | N6 | C14 | H1A | 165.5° | 178.6° |
| C17 | N6 | C14 | H1B | 74.7° | 61.3° |
| N6 | C17 | C16 | H1E | 67.2° | 63.0° |
| N6 | C17 | C16 | H1F | 173.2° | 176.8° |
| N7 | C18 | N8 | C1F | 179.5° | 179.7° |
| N7 | C18 | N8 | C19 | 0.4° | 0.2° |
| C18 | N7 | C1A | C19 | 1.0° | 0.2° |
| C18 | N7 | C1A | C1E | 179.8° | 179.8° |
| N7 | C18 | C1F | F1 | 174.4° | 56.9° |
| N7 | C18 | C1F | F2 | 68.1° | 63.1° |
| N7 | C18 | C1F | H26 | 53.2° | 176.8° |
| C1A | N7 | C18 | N8 | 0.9° | 0.3° |
| C1A | N7 | C18 | C1F | 179.5° | 180.0° |
| N7 | C1A | C19 | N8 | 0.8° | 0.0° |
| N7 | C1A | C19 | C1E | 179.0° | 180.0° |
| N7 | C1A | C19 | C1B | 179.5° | 179.9° |
| N7 | C1A | C1E | C1D | 179.1° | 179.9° |
| N7 | C1A | C1E | H25 | 0.9° | 0.0° |
| C14 | C15 | O1 | H1D | 120.3° | 120.0° |
| C14 | C15 | O1 | H1C | 120.2° | 120.0° |
| C14 | C15 | O1 | C16 | 61.7° | 58.6° |
| C14 | C15 | H1D | H1C | 119.2° | 120.2° |
| C15 | C14 | H1A | H1B | 119.6° | 120.0° |
| C15 | O1 | C16 | C17 | 62.6° | 58.6° |
| O1 | C15 | H1D | H1C | 119.2° | 120.1° |
| O1 | C15 | C14 | H1A | 171.5° | 176.8° |
| O1 | C15 | C14 | H1B | 68.8° | 63.2° |
| C15 | O1 | C16 | H1E | 57.7° | 61.2° |
| C15 | O1 | C16 | H1F | 177.2° | 178.6° |
| O1 | C16 | C17 | H1E | 120.2° | 119.9° |
| O1 | C16 | C17 | H1F | 120.2° | 120.0° |
| C16 | O1 | C15 | H1D | 58.5° | 178.6° |
| C16 | O1 | C15 | H1C | 178.0° | 61.3° |
| O1 | C16 | C17 | H20 | 67.1° | 63.2° |
| O1 | C16 | C17 | H21 | 173.1° | 176.8° |
| O1 | C16 | H1E | H1F | 119.3° | 120.1° |
| C16 | C17 | H20 | H21 | 119.8° | 120.1° |
| C17 | C16 | H1E | H1F | 119.4° | 120.1° |
| C18 | N8 | C19 | C1A | 0.2° | 0.1° |
| C18 | N8 | C19 | C1B | 179.9° | 179.9° |
| N8 | C18 | C1F | F1 | 6.1° | 122.8° |
| N8 | C18 | C1F | F2 | 111.4° | 117.2° |
| N8 | C18 | C1F | H26 | 127.3° | 2.9° |
| C1F | C18 | N8 | C19 | 180.0° | 180.0° |
| C18 | C1F | F1 | F2 | 120.7° | 120.0° |
| C18 | C1F | F1 | H26 | 120.2° | 120.0° |
| C18 | C1F | F2 | H26 | 120.3° | 120.0° |
| N8 | C19 | C1A | C1B | 179.7° | 179.9° |
| N8 | C19 | C1A | C1E | 179.8° | 180.0° |
| N8 | C19 | C1B | C1C | 180.0° | 180.0° |
| N8 | C19 | C1B | H22 | 0.0° | 0.1° |
| C1A | C19 | C1B | C1C | 0.3° | 0.1° |
| C19 | C1A | C1E | C1D | 0.5° | 0.1° |
| C1A | C19 | C1B | H22 | 179.6° | 179.8° |
| C19 | C1A | C1E | H25 | 179.5° | 180.0° |
| C1B | C19 | C1A | C1E | 0.5° | 0.1° |
| C19 | C1B | C1C | H22 | 180.0° | 179.9° |
| C19 | C1B | C1C | C1D | 0.1° | 0.0° |
| C19 | C1B | C1C | H23 | 179.9° | 179.9° |
| C1A | C1E | C1D | C1C | 0.3° | 0.2° |
| C1A | C1E | C1D | H25 | 180.0° | 179.9° |
| C1A | C1E | C1D | H24 | 179.7° | 180.0° |
| C1B | C1C | C1D | H23 | 180.0° | 180.0° |
| C1B | C1C | C1D | C1E | 0.1° | 0.2° |
| C1B | C1C | C1D | H24 | 179.9° | 180.0° |
| C1C | C1D | C1E | H24 | 180.0° | 179.8° |
| C1D | C1C | C1B | H22 | 179.8° | 179.9° |
| C1C | C1D | C1E | H25 | 179.7° | 179.8° |
| C1E | C1D | C1C | H23 | 179.9° | 179.8° |
| F1 | C1F | F2 | H26 | 119.1° | 120.0° |
| H2 | C4 | C5 | H3 | 0.1° | 0.3° |
| H3 | C5 | C6 | H4 | 0.1° | 0.0° |
| H4 | C6 | C1 | H1 | 0.4° | 0.1° |
| H5 | C7 | C8 | H7 | 58.1° | 57.7° |
| H5 | C7 | C8 | H6 | 177.6° | 177.7° |
| H5 | C7 | CB | HC | 178.6° | 177.8° |
| H5 | C7 | CB | HD | 58.9° | 57.7° |
| H7 | C8 | C9 | H9 | 56.0° | 60.8° |
| H7 | C8 | C9 | H8 | 63.5° | 59.2° |
| H6 | C8 | C9 | H9 | 175.6° | 59.2° |
| H6 | C8 | C9 | H8 | 56.1° | 179.2° |
| H15 | C10 | H16 | H14 | 120.0° | 119.9° |
| H1D | C15 | C14 | H1A | 51.2° | 63.3° |
| H1D | C15 | C14 | H1B | 170.9° | 56.8° |
| H1C | C15 | C14 | H1A | 68.3° | 56.9° |
| H1C | C15 | C14 | H1B | 51.5° | 176.9° |
| H20 | C17 | C16 | H1E | 172.7° | 177.0° |
| H20 | C17 | C16 | H1F | 53.1° | 56.8° |
| H21 | C17 | C16 | H1E | 52.9° | 56.9° |
| H21 | C17 | C16 | H1F | 66.7° | 63.2° |
| HB | CA | CB | HC | 177.5° | 179.2° |
| HB | CA | CB | HD | 57.8° | 59.1° |
| HA | CA | CB | HC | 57.9° | 59.2° |
| HA | CA | CB | HD | 61.8° | 60.9° |
| H17 | C11 | H18 | H19 | 120.0° | 120.0° |
| H22 | C1B | C1C | H23 | 0.1° | 0.1° |
| H23 | C1C | C1D | H24 | 0.1° | 0.0° |
| H24 | C1D | C1E | H25 | 0.3° | 0.1° |
| HE | CC | H10 | HF | 120.0° | 120.0° |
