G67
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | N2 | sing | 1.40Å | 1.35Å | Aromatic |
| N1 | C14 | sing | 1.37Å | 1.35Å | Aromatic |
| O2 | C21 | doub | 1.21Å | 1.22Å | |
| C26 | C25 | sing | 1.50Å | 1.49Å | |
| C26 | N5 | sing | 1.47Å | 1.46Å | |
| C13 | C14 | doub | 1.39Å | 1.38Å | Aromatic |
| C13 | C12 | sing | 1.37Å | 1.38Å | Aromatic |
| C25 | C24 | doub | 1.31Å | 1.40Å | |
| N2 | C8 | doub | 1.31Å | 1.33Å | Aromatic |
| C14 | C9 | sing | 1.41Å | 1.41Å | Aromatic |
| C28 | C29 | doub | 1.38Å | 1.39Å | Aromatic |
| C28 | C27 | sing | 1.40Å | 1.40Å | Aromatic |
| C29 | C30 | sing | 1.39Å | 1.39Å | Aromatic |
| C12 | C11 | doub | 1.39Å | 1.40Å | Aromatic |
| N6 | C34 | doub | 1.31Å | 1.32Å | Aromatic |
| N6 | C33 | sing | 1.34Å | 1.36Å | Aromatic |
| C8 | C9 | sing | 1.47Å | 1.48Å | Aromatic |
| C8 | C6 | sing | 1.48Å | 1.49Å | |
| C5 | C6 | doub | 1.40Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| C9 | C10 | doub | 1.40Å | 1.39Å | Aromatic |
| C21 | N5 | sing | 1.35Å | 1.34Å | |
| C21 | C20 | sing | 1.51Å | 1.52Å | |
| N5 | C22 | sing | 1.47Å | 1.46Å | |
| C34 | N7 | sing | 1.35Å | 1.34Å | Aromatic |
| C11 | C10 | sing | 1.38Å | 1.40Å | Aromatic |
| C11 | N3 | sing | 1.40Å | 1.42Å | |
| C24 | C27 | sing | 1.48Å | 1.50Å | |
| C24 | C23 | sing | 1.50Å | 1.54Å | |
| C6 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | C3 | doub | 1.39Å | 1.40Å | Aromatic |
| C17 | C18 | sing | 1.54Å | 1.51Å | |
| C17 | C16 | sing | 1.54Å | 1.54Å | |
| C27 | C32 | doub | 1.40Å | 1.40Å | Aromatic |
| C18 | N4 | sing | 1.49Å | 1.49Å | |
| C | C1 | sing | 1.53Å | 1.51Å | |
| C30 | C33 | sing | 1.48Å | 1.48Å | |
| C30 | C31 | doub | 1.40Å | 1.39Å | Aromatic |
| C33 | N8 | doub | 1.32Å | 1.33Å | Aromatic |
| O1 | C15 | doub | 1.21Å | 1.22Å | |
| N3 | C15 | sing | 1.35Å | 1.35Å | |
| N4 | C20 | sing | 1.47Å | 1.50Å | |
| N4 | C19 | sing | 1.49Å | 1.51Å | |
| C15 | C16 | sing | 1.51Å | 1.52Å | |
| C22 | C23 | sing | 1.54Å | 1.52Å | |
| C1 | O | sing | 1.43Å | 1.47Å | |
| C1 | C2 | sing | 1.53Å | 1.50Å | |
| N7 | N8 | sing | 1.40Å | 1.36Å | Aromatic |
| N7 | C35 | sing | 1.47Å | 1.46Å | |
| C7 | N | doub | 1.32Å | 1.35Å | Aromatic |
| C3 | N | sing | 1.32Å | 1.33Å | Aromatic |
| C3 | O | sing | 1.36Å | 1.36Å | |
| C16 | C19 | sing | 1.54Å | 1.53Å | |
| C16 | S | sing | 1.81Å | 1.85Å | |
| C32 | C31 | sing | 1.38Å | 1.38Å | Aromatic |
| S | C36 | sing | 1.81Å | 1.79Å | |
| C26 | H29 | sing | 1.09Å | 1.10Å | |
| C26 | H30 | sing | 1.09Å | 1.10Å | |
| C25 | H28 | sing | 1.08Å | 1.08Å | |
| C32 | H34 | sing | 1.08Å | 1.08Å | |
| C31 | H33 | sing | 1.08Å | 1.08Å | |
| C35 | H36 | sing | 1.09Å | 1.10Å | |
| C35 | H37 | sing | 1.09Å | 1.10Å | |
| C35 | H38 | sing | 1.09Å | 1.10Å | |
| C34 | H35 | sing | 1.08Å | 1.08Å | |
| C29 | H32 | sing | 1.08Å | 1.08Å | |
| C28 | H31 | sing | 1.08Å | 1.08Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C22 | H25 | sing | 1.09Å | 1.10Å | |
| C22 | H24 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H19 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| C36 | H41 | sing | 1.09Å | 1.10Å | |
| C36 | H39 | sing | 1.09Å | 1.10Å | |
| C36 | H40 | sing | 1.09Å | 1.10Å | |
| N3 | H15 | sing | 0.97Å | 1.00Å | |
| C10 | H12 | sing | 1.08Å | 1.08Å | |
| C12 | H13 | sing | 1.08Å | 1.08Å | |
| C13 | H14 | sing | 1.08Å | 1.08Å | |
| N1 | H | sing | 0.97Å | 1.00Å | |
| C5 | H10 | sing | 1.08Å | 1.08Å | |
| C4 | H9 | sing | 1.08Å | 1.08Å | |
| C7 | H11 | sing | 1.08Å | 1.08Å | |
| C1 | H5 | sing | 1.09Å | 1.10Å | |
| C2 | H8 | sing | 1.09Å | 1.10Å | |
| C2 | H7 | sing | 1.09Å | 1.10Å | |
| C2 | H6 | sing | 1.09Å | 1.10Å | |
| C | H3 | sing | 1.09Å | 1.10Å | |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C | H4 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N2 | N1 | C14 | 111.7° | 109.3° |
| N1 | N2 | C8 | 109.7° | 110.0° |
| N2 | N1 | H | 124.1° | 125.3° |
| N1 | C14 | C13 | 131.5° | 133.5° |
| N1 | C14 | C9 | 106.4° | 106.9° |
| C14 | N1 | H | 124.2° | 125.4° |
| O2 | C21 | N5 | 121.8° | 120.0° |
| O2 | C21 | C20 | 119.9° | 120.0° |
| C25 | C26 | N5 | 107.9° | 109.2° |
| C26 | C25 | C24 | 122.6° | 123.4° |
| C25 | C26 | H29 | 109.9° | 109.5° |
| C25 | C26 | H30 | 109.9° | 109.6° |
| C26 | C25 | H28 | 118.7° | 118.3° |
| C26 | N5 | C21 | 122.7° | 121.3° |
| C26 | N5 | C22 | 110.6° | 117.3° |
| N5 | C26 | H29 | 109.9° | 109.5° |
| N5 | C26 | H30 | 109.9° | 109.5° |
| C14 | C13 | C12 | 118.6° | 120.1° |
| C13 | C14 | C9 | 122.0° | 119.6° |
| C14 | C13 | H14 | 120.7° | 120.0° |
| C13 | C12 | C11 | 120.7° | 120.7° |
| C13 | C12 | H13 | 119.7° | 119.7° |
| C12 | C13 | H14 | 120.7° | 119.9° |
| C25 | C24 | C27 | 123.2° | 117.8° |
| C25 | C24 | C23 | 119.5° | 124.4° |
| C24 | C25 | H28 | 118.7° | 118.3° |
| N2 | C8 | C9 | 106.6° | 107.6° |
| N2 | C8 | C6 | 122.6° | 126.2° |
| C14 | C9 | C8 | 105.5° | 106.3° |
| C14 | C9 | C10 | 118.6° | 119.8° |
| C29 | C28 | C27 | 120.8° | 120.0° |
| C28 | C29 | C30 | 120.7° | 120.0° |
| C28 | C29 | H32 | 119.6° | 120.0° |
| C29 | C28 | H31 | 119.6° | 120.0° |
| C28 | C27 | C24 | 121.0° | 120.0° |
| C28 | C27 | C32 | 118.3° | 120.0° |
| C27 | C28 | H31 | 119.6° | 120.0° |
| C29 | C30 | C33 | 120.8° | 120.0° |
| C29 | C30 | C31 | 118.4° | 120.0° |
| C30 | C29 | H32 | 119.6° | 119.9° |
| C12 | C11 | C10 | 120.4° | 120.3° |
| C12 | C11 | N3 | 122.3° | 119.9° |
| C11 | C12 | H13 | 119.7° | 119.7° |
| C34 | N6 | C33 | 102.6° | 109.8° |
| N6 | C34 | N7 | 110.5° | 108.3° |
| N6 | C34 | H35 | 124.8° | 125.9° |
| N6 | C33 | C30 | 122.5° | 125.7° |
| N6 | C33 | N8 | 114.9° | 108.7° |
| C9 | C8 | C6 | 130.8° | 126.2° |
| C8 | C9 | C10 | 135.8° | 133.8° |
| C8 | C6 | C5 | 120.3° | 120.5° |
| C8 | C6 | C7 | 122.1° | 120.5° |
| C6 | C5 | C4 | 120.4° | 118.4° |
| C5 | C6 | C7 | 117.5° | 119.0° |
| C6 | C5 | H10 | 119.8° | 120.7° |
| C5 | C4 | C3 | 117.3° | 119.3° |
| C4 | C5 | H10 | 119.8° | 120.9° |
| C5 | C4 | H9 | 121.4° | 120.4° |
| C9 | C10 | C11 | 119.5° | 119.4° |
| C9 | C10 | H12 | 120.2° | 120.3° |
| N5 | C21 | C20 | 118.3° | 120.0° |
| C21 | N5 | C22 | 125.6° | 121.3° |
| C21 | C20 | N4 | 111.3° | 109.4° |
| C21 | C20 | H23 | 109.0° | 109.5° |
| C21 | C20 | H22 | 109.0° | 109.5° |
| N5 | C22 | C23 | 107.4° | 107.7° |
| N5 | C22 | H25 | 110.0° | 109.7° |
| N5 | C22 | H24 | 110.0° | 109.8° |
| C34 | N7 | N8 | 109.8° | 106.6° |
| C34 | N7 | C35 | 130.7° | 126.7° |
| N7 | C34 | H35 | 124.7° | 125.9° |
| C10 | C11 | N3 | 117.3° | 119.8° |
| C11 | C10 | H12 | 120.2° | 120.3° |
| C11 | N3 | C15 | 126.7° | 120.0° |
| C11 | N3 | H15 | 116.6° | 120.0° |
| C27 | C24 | C23 | 117.1° | 117.8° |
| C24 | C27 | C32 | 120.7° | 120.0° |
| C24 | C23 | C22 | 111.9° | 110.4° |
| C24 | C23 | H27 | 108.9° | 109.3° |
| C24 | C23 | H26 | 108.9° | 109.3° |
| C6 | C7 | N | 123.7° | 120.7° |
| C6 | C7 | H11 | 118.1° | 119.7° |
| C4 | C3 | N | 124.1° | 120.9° |
| C4 | C3 | O | 120.6° | 119.5° |
| C3 | C4 | H9 | 121.4° | 120.3° |
| C18 | C17 | C16 | 102.7° | 105.1° |
| C17 | C18 | N4 | 103.2° | 104.6° |
| C17 | C18 | H19 | 111.0° | 110.4° |
| C17 | C18 | H18 | 111.0° | 110.5° |
| C18 | C17 | H17 | 111.1° | 110.4° |
| C18 | C17 | H16 | 111.1° | 110.3° |
| C17 | C16 | C15 | 110.1° | 110.3° |
| C17 | C16 | C19 | 107.3° | 105.1° |
| C17 | C16 | S | 106.7° | 110.3° |
| C16 | C17 | H17 | 111.1° | 110.3° |
| C16 | C17 | H16 | 111.2° | 110.3° |
| C27 | C32 | C31 | 120.8° | 120.0° |
| C27 | C32 | H34 | 119.6° | 120.0° |
| C18 | N4 | C20 | 113.7° | 111.1° |
| C18 | N4 | C19 | 101.8° | 104.2° |
| N4 | C18 | H19 | 111.0° | 110.4° |
| N4 | C18 | H18 | 111.0° | 110.4° |
| C | C1 | O | 111.6° | 109.5° |
| C | C1 | C2 | 112.6° | 109.5° |
| C | C1 | H5 | 109.2° | 109.5° |
| C1 | C | H3 | 109.5° | 109.5° |
| C1 | C | H2 | 109.5° | 109.5° |
| C1 | C | H4 | 109.5° | 109.5° |
| C33 | C30 | C31 | 120.4° | 120.0° |
| C30 | C33 | N8 | 122.6° | 125.6° |
| C30 | C31 | C32 | 120.9° | 120.0° |
| C30 | C31 | H33 | 119.5° | 119.9° |
| C33 | N8 | N7 | 102.3° | 106.7° |
| O1 | C15 | N3 | 124.6° | 120.0° |
| O1 | C15 | C16 | 121.3° | 120.0° |
| N3 | C15 | C16 | 114.0° | 120.0° |
| C15 | N3 | H15 | 116.7° | 120.0° |
| C20 | N4 | C19 | 110.9° | 111.0° |
| N4 | C20 | H23 | 109.0° | 109.5° |
| N4 | C20 | H22 | 109.0° | 109.4° |
| N4 | C19 | C16 | 99.7° | 104.6° |
| N4 | C19 | H21 | 111.8° | 110.4° |
| N4 | C19 | H20 | 111.8° | 110.4° |
| C15 | C16 | C19 | 111.3° | 110.3° |
| C15 | C16 | S | 112.5° | 110.4° |
| C22 | C23 | H27 | 108.9° | 109.5° |
| C22 | C23 | H26 | 108.9° | 109.1° |
| C23 | C22 | H25 | 110.0° | 109.9° |
| C23 | C22 | H24 | 110.0° | 109.9° |
| O | C1 | C2 | 104.3° | 109.5° |
| C1 | O | C3 | 122.0° | 117.0° |
| O | C1 | H5 | 109.7° | 109.5° |
| C2 | C1 | H5 | 109.3° | 109.5° |
| C1 | C2 | H8 | 109.5° | 109.5° |
| C1 | C2 | H7 | 109.4° | 109.5° |
| C1 | C2 | H6 | 109.5° | 109.5° |
| N8 | N7 | C35 | 119.5° | 126.7° |
| N7 | C35 | H36 | 109.5° | 109.5° |
| N7 | C35 | H37 | 109.5° | 109.5° |
| N7 | C35 | H38 | 109.5° | 109.5° |
| C7 | N | C3 | 117.0° | 121.8° |
| N | C7 | H11 | 118.2° | 119.7° |
| N | C3 | O | 115.3° | 119.6° |
| C19 | C16 | S | 108.6° | 110.3° |
| C16 | C19 | H21 | 111.8° | 110.4° |
| C16 | C19 | H20 | 111.8° | 110.5° |
| C16 | S | C36 | 108.7° | 103.0° |
| C31 | C32 | H34 | 119.6° | 120.0° |
| C32 | C31 | H33 | 119.6° | 120.0° |
| S | C36 | H41 | 109.5° | 109.5° |
| S | C36 | H39 | 109.5° | 109.5° |
| S | C36 | H40 | 109.4° | 109.4° |
| H29 | C26 | H30 | 109.5° | 109.5° |
| H36 | C35 | H37 | 109.4° | 109.5° |
| H36 | C35 | H38 | 109.5° | 109.4° |
| H37 | C35 | H38 | 109.5° | 109.5° |
| H27 | C23 | H26 | 109.4° | 109.3° |
| H25 | C22 | H24 | 109.5° | 109.9° |
| H23 | C20 | H22 | 109.5° | 109.5° |
| H19 | C18 | H18 | 109.5° | 110.3° |
| H17 | C17 | H16 | 109.5° | 110.3° |
| H21 | C19 | H20 | 109.5° | 110.4° |
| H41 | C36 | H39 | 109.5° | 109.5° |
| H41 | C36 | H40 | 109.5° | 109.5° |
| H39 | C36 | H40 | 109.5° | 109.5° |
| H8 | C2 | H7 | 109.4° | 109.4° |
| H8 | C2 | H6 | 109.5° | 109.5° |
| H7 | C2 | H6 | 109.5° | 109.5° |
| H3 | C | H2 | 109.4° | 109.4° |
| H3 | C | H4 | 109.5° | 109.4° |
| H2 | C | H4 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N2 | N1 | C14 | H | 180.0° | 179.8° |
| N2 | N1 | C14 | C13 | 179.0° | 180.0° |
| N2 | N1 | C14 | C9 | 1.1° | 0.2° |
| N1 | N2 | C8 | C9 | 0.8° | 0.1° |
| N1 | N2 | C8 | C6 | 179.6° | 180.0° |
| N1 | C14 | C13 | C9 | 179.9° | 179.7° |
| N1 | C14 | C13 | C12 | 178.9° | 180.0° |
| C14 | N1 | N2 | C8 | 0.2° | 0.2° |
| N1 | C14 | C9 | C8 | 1.4° | 0.2° |
| N1 | C14 | C9 | C10 | 177.8° | 179.7° |
| N1 | C14 | C13 | H14 | 1.1° | 0.3° |
| O2 | C21 | N5 | C26 | 11.2° | 179.7° |
| O2 | C21 | N5 | C20 | 178.9° | 179.8° |
| O2 | C21 | N5 | C22 | 178.4° | 0.0° |
| O2 | C21 | C20 | N4 | 7.9° | 0.0° |
| O2 | C21 | C20 | H23 | 112.3° | 120.0° |
| O2 | C21 | C20 | H22 | 128.2° | 120.0° |
| C25 | C26 | N5 | H29 | 119.7° | 119.9° |
| C25 | C26 | N5 | H30 | 119.7° | 120.0° |
| C26 | C25 | C24 | H28 | 180.0° | 179.9° |
| C25 | C26 | N5 | C21 | 109.0° | 136.7° |
| C25 | C26 | N5 | C22 | 59.9° | 43.5° |
| C26 | C25 | C24 | C27 | 172.1° | 179.2° |
| C26 | C25 | C24 | C23 | 3.6° | 0.8° |
| C25 | C26 | H29 | H30 | 120.7° | 120.2° |
| N5 | C26 | C25 | C24 | 20.8° | 11.1° |
| C26 | N5 | C21 | C22 | 167.2° | 179.8° |
| C26 | N5 | C21 | C20 | 167.7° | 0.5° |
| C26 | N5 | C22 | C23 | 73.8° | 62.5° |
| N5 | C26 | H29 | H30 | 120.8° | 120.2° |
| N5 | C26 | C25 | H28 | 159.2° | 169.0° |
| C26 | N5 | C22 | H25 | 166.6° | 57.1° |
| C26 | N5 | C22 | H24 | 45.9° | 177.9° |
| C14 | C13 | C12 | H14 | 180.0° | 179.7° |
| C14 | C13 | C12 | C11 | 1.5° | 0.1° |
| C13 | C14 | C9 | C8 | 178.6° | 179.9° |
| C13 | C14 | C9 | C10 | 2.2° | 0.5° |
| C14 | C13 | C12 | H13 | 178.5° | 179.9° |
| C13 | C14 | N1 | H | 1.0° | 0.2° |
| C12 | C13 | C14 | C9 | 1.2° | 0.3° |
| C13 | C12 | C11 | H13 | 180.0° | 180.0° |
| C13 | C12 | C11 | C10 | 1.5° | 0.0° |
| C13 | C12 | C11 | N3 | 177.6° | 179.7° |
| C25 | C24 | C27 | C28 | 9.4° | 115.2° |
| C25 | C24 | C27 | C23 | 175.8° | 180.0° |
| C25 | C24 | C27 | C32 | 168.5° | 65.1° |
| C25 | C24 | C23 | C22 | 8.4° | 19.1° |
| C24 | C25 | C26 | H29 | 140.5° | 130.9° |
| C24 | C25 | C26 | H30 | 99.0° | 108.9° |
| C25 | C24 | C23 | H27 | 128.8° | 101.3° |
| C25 | C24 | C23 | H26 | 111.9° | 139.1° |
| N2 | C8 | C9 | C14 | 1.4° | 0.0° |
| N2 | C8 | C9 | C6 | 179.6° | 179.9° |
| N2 | C8 | C6 | C5 | 24.6° | 34.7° |
| N2 | C8 | C9 | C10 | 177.7° | 179.5° |
| N2 | C8 | C6 | C7 | 150.8° | 145.0° |
| C8 | N2 | N1 | H | 179.9° | 180.0° |
| C14 | C9 | C8 | C10 | 179.0° | 179.5° |
| C14 | C9 | C8 | C6 | 179.1° | 179.9° |
| C14 | C9 | C10 | C11 | 5.1° | 0.5° |
| C14 | C9 | C10 | H12 | 174.9° | 179.5° |
| C9 | C14 | C13 | H14 | 178.8° | 180.0° |
| C9 | C14 | N1 | H | 179.0° | 180.0° |
| C29 | C28 | C27 | H31 | 180.0° | 179.4° |
| C28 | C29 | C30 | H32 | 180.0° | 179.7° |
| C29 | C28 | C27 | C24 | 175.6° | 179.7° |
| C29 | C28 | C27 | C32 | 2.3° | 0.6° |
| C28 | C29 | C30 | C33 | 172.5° | 179.7° |
| C28 | C29 | C30 | C31 | 0.9° | 0.3° |
| C27 | C28 | C29 | C30 | 1.2° | 0.6° |
| C28 | C27 | C24 | C32 | 177.9° | 179.7° |
| C28 | C27 | C24 | C23 | 174.8° | 64.7° |
| C28 | C27 | C32 | C31 | 1.4° | 0.3° |
| C28 | C27 | C32 | H34 | 178.6° | 179.8° |
| C27 | C28 | C29 | H32 | 178.8° | 179.7° |
| C29 | C30 | C33 | N6 | 6.2° | 179.7° |
| C29 | C30 | C33 | C31 | 173.3° | 179.9° |
| C29 | C30 | C33 | N8 | 171.9° | 0.1° |
| C29 | C30 | C31 | C32 | 1.7° | 0.0° |
| C29 | C30 | C31 | H33 | 178.2° | 179.9° |
| C30 | C29 | C28 | H31 | 178.8° | 180.0° |
| C12 | C11 | C10 | C9 | 4.9° | 0.2° |
| C12 | C11 | C10 | N3 | 179.1° | 179.7° |
| C12 | C11 | N3 | C15 | 7.8° | 24.9° |
| C12 | C11 | N3 | H15 | 172.2° | 155.0° |
| C12 | C11 | C10 | H12 | 175.1° | 179.7° |
| C11 | C12 | C13 | H14 | 178.4° | 179.8° |
| N6 | C34 | N7 | H35 | 180.0° | 179.8° |
| C34 | N6 | C33 | C30 | 178.6° | 179.8° |
| C34 | N6 | C33 | N8 | 0.4° | 0.4° |
| N6 | C34 | N7 | N8 | 0.6° | 0.2° |
| N6 | C34 | N7 | C35 | 176.8° | 179.8° |
| C33 | N6 | C34 | N7 | 0.6° | 0.4° |
| N6 | C33 | C30 | N8 | 178.1° | 179.8° |
| N6 | C33 | C30 | C31 | 167.1° | 0.2° |
| N6 | C33 | N8 | N7 | 0.0° | 0.2° |
| C33 | N6 | C34 | H35 | 179.4° | 179.9° |
| C9 | C8 | C6 | C5 | 154.9° | 145.2° |
| C8 | C9 | C10 | C11 | 175.9° | 179.9° |
| C9 | C8 | C6 | C7 | 29.7° | 35.1° |
| C8 | C9 | C10 | H12 | 4.1° | 0.1° |
| C8 | C6 | C5 | C7 | 175.6° | 179.8° |
| C8 | C6 | C5 | C4 | 175.3° | 180.0° |
| C6 | C8 | C9 | C10 | 1.9° | 0.4° |
| C8 | C6 | C7 | N | 176.8° | 180.0° |
| C8 | C6 | C5 | H10 | 4.7° | 0.0° |
| C8 | C6 | C7 | H11 | 3.2° | 0.0° |
| C6 | C5 | C4 | H10 | 180.0° | 180.0° |
| C6 | C5 | C4 | C3 | 1.8° | 0.0° |
| C5 | C6 | C7 | N | 1.3° | 0.2° |
| C6 | C5 | C4 | H9 | 178.2° | 180.0° |
| C5 | C6 | C7 | H11 | 178.7° | 179.8° |
| C4 | C5 | C6 | C7 | 0.3° | 0.2° |
| C5 | C4 | C3 | H9 | 180.0° | 180.0° |
| C5 | C4 | C3 | N | 2.0° | 0.3° |
| C5 | C4 | C3 | O | 179.7° | 180.0° |
| C9 | C10 | C11 | H12 | 180.0° | 180.0° |
| C9 | C10 | C11 | N3 | 174.3° | 179.9° |
| N5 | C21 | C20 | N4 | 171.0° | 179.7° |
| C21 | N5 | C22 | C23 | 94.7° | 117.7° |
| C21 | N5 | C26 | H29 | 10.8° | 16.8° |
| C21 | N5 | C26 | H30 | 131.3° | 103.3° |
| C21 | N5 | C22 | H25 | 25.0° | 122.7° |
| C21 | N5 | C22 | H24 | 145.6° | 1.9° |
| N5 | C21 | C20 | H23 | 68.8° | 60.2° |
| N5 | C21 | C20 | H22 | 50.7° | 59.8° |
| C20 | C21 | N5 | C22 | 0.5° | 179.7° |
| C21 | C20 | N4 | C18 | 75.8° | 74.5° |
| C21 | C20 | N4 | H23 | 120.3° | 120.0° |
| C21 | C20 | N4 | H22 | 120.3° | 119.9° |
| C21 | C20 | N4 | C19 | 170.2° | 170.0° |
| C21 | C20 | H23 | H22 | 119.2° | 120.0° |
| N5 | C22 | C23 | C24 | 44.1° | 45.9° |
| N5 | C22 | C23 | H25 | 119.7° | 119.5° |
| N5 | C22 | C23 | H24 | 119.7° | 119.5° |
| C22 | N5 | C26 | H29 | 179.6° | 163.4° |
| C22 | N5 | C26 | H30 | 59.9° | 76.4° |
| N5 | C22 | C23 | H27 | 164.5° | 74.5° |
| N5 | C22 | C23 | H26 | 76.3° | 166.0° |
| N5 | C22 | H25 | H24 | 120.9° | 120.8° |
| C34 | N7 | N8 | C33 | 0.4° | 0.0° |
| C34 | N7 | N8 | C35 | 177.7° | 180.0° |
| C34 | N7 | C35 | H36 | 177.2° | 90.0° |
| C34 | N7 | C35 | H37 | 57.2° | 30.0° |
| C34 | N7 | C35 | H38 | 62.8° | 150.0° |
| C10 | C11 | N3 | C15 | 171.3° | 154.8° |
| C10 | C11 | N3 | H15 | 8.7° | 25.3° |
| C10 | C11 | C12 | H13 | 178.5° | 180.0° |
| C11 | N3 | C15 | O1 | 9.9° | 8.9° |
| C11 | N3 | C15 | H15 | 180.0° | 180.0° |
| C11 | N3 | C15 | C16 | 174.4° | 171.0° |
| N3 | C11 | C10 | H12 | 5.7° | 0.0° |
| N3 | C11 | C12 | H13 | 2.4° | 0.3° |
| C27 | C24 | C23 | C22 | 175.6° | 160.9° |
| C24 | C27 | C32 | C31 | 176.5° | 180.0° |
| C27 | C24 | C25 | H28 | 7.9° | 0.8° |
| C24 | C27 | C32 | H34 | 3.5° | 0.1° |
| C24 | C27 | C28 | H31 | 4.4° | 0.3° |
| C27 | C24 | C23 | H27 | 55.2° | 78.7° |
| C27 | C24 | C23 | H26 | 64.0° | 40.9° |
| C23 | C24 | C27 | C32 | 7.3° | 115.0° |
| C24 | C23 | C22 | H27 | 120.4° | 120.4° |
| C24 | C23 | C22 | H26 | 120.4° | 120.1° |
| C23 | C24 | C25 | H28 | 176.4° | 179.2° |
| C24 | C23 | H27 | H26 | 118.9° | 119.6° |
| C24 | C23 | C22 | H25 | 163.8° | 73.6° |
| C24 | C23 | C22 | H24 | 75.6° | 165.4° |
| C6 | C7 | N | H11 | 180.0° | 180.0° |
| C6 | C7 | N | C3 | 1.3° | 0.1° |
| C7 | C6 | C5 | H10 | 179.7° | 179.8° |
| C4 | C3 | O | C1 | 24.5° | 180.0° |
| C4 | C3 | N | C7 | 0.4° | 0.3° |
| C4 | C3 | N | O | 178.4° | 179.7° |
| C3 | C4 | C5 | H10 | 178.2° | 180.0° |
| C18 | C17 | C16 | H17 | 118.9° | 118.9° |
| C18 | C17 | C16 | H16 | 118.9° | 118.9° |
| C17 | C18 | N4 | H19 | 119.0° | 118.8° |
| C17 | C18 | N4 | H18 | 119.0° | 118.9° |
| C17 | C18 | N4 | C20 | 168.9° | 159.0° |
| C17 | C18 | N4 | C19 | 49.6° | 39.5° |
| C18 | C17 | C16 | C15 | 123.0° | 118.9° |
| C18 | C17 | C16 | C19 | 1.7° | 0.0° |
| C18 | C17 | C16 | S | 114.7° | 118.9° |
| C17 | C18 | H19 | H18 | 122.9° | 122.5° |
| C18 | C17 | H17 | H16 | 123.1° | 122.2° |
| C16 | C17 | C18 | N4 | 30.9° | 23.8° |
| C17 | C16 | C15 | O1 | 106.8° | 12.3° |
| C17 | C16 | C15 | N3 | 77.4° | 167.7° |
| C17 | C16 | C19 | N4 | 27.2° | 23.8° |
| C17 | C16 | C15 | C19 | 118.9° | 115.6° |
| C17 | C16 | C15 | S | 118.9° | 122.2° |
| C17 | C16 | C19 | S | 115.1° | 118.9° |
| C17 | C16 | S | C36 | 176.7° | 58.6° |
| C16 | C17 | C18 | H19 | 149.9° | 95.0° |
| C16 | C17 | C18 | H18 | 88.1° | 142.7° |
| C16 | C17 | H17 | H16 | 123.2° | 122.2° |
| C17 | C16 | C19 | H21 | 145.6° | 142.6° |
| C17 | C16 | C19 | H20 | 91.2° | 94.9° |
| C27 | C32 | C31 | C30 | 0.6° | 0.0° |
| C27 | C32 | C31 | H34 | 180.0° | 179.9° |
| C27 | C32 | C31 | H33 | 179.4° | 179.9° |
| C32 | C27 | C28 | H31 | 177.7° | 180.0° |
| C18 | N4 | C20 | C19 | 114.0° | 115.5° |
| C18 | N4 | C19 | C16 | 46.5° | 39.4° |
| C18 | N4 | C20 | H23 | 163.9° | 165.4° |
| C18 | N4 | C20 | H22 | 44.5° | 45.4° |
| N4 | C18 | H19 | H18 | 122.9° | 122.3° |
| N4 | C18 | C17 | H17 | 149.8° | 142.8° |
| N4 | C18 | C17 | H16 | 88.0° | 95.0° |
| C18 | N4 | C19 | H21 | 164.9° | 158.2° |
| C18 | N4 | C19 | H20 | 71.9° | 79.4° |
| C | C1 | O | C2 | 121.8° | 120.0° |
| C | C1 | O | H5 | 121.2° | 120.0° |
| C | C1 | C2 | H5 | 121.6° | 120.0° |
| C | C1 | O | C3 | 79.8° | 150.0° |
| C | C1 | C2 | H8 | 180.0° | 180.0° |
| C | C1 | C2 | H7 | 60.0° | 60.0° |
| C | C1 | C2 | H6 | 60.0° | 60.0° |
| C1 | C | H3 | H2 | 120.0° | 120.0° |
| C1 | C | H3 | H4 | 120.0° | 120.0° |
| C1 | C | H2 | H4 | 120.0° | 120.0° |
| C30 | C33 | N8 | N7 | 178.2° | 180.0° |
| C33 | C30 | C31 | C32 | 171.7° | 180.0° |
| C33 | C30 | C31 | H33 | 8.3° | 0.0° |
| C33 | C30 | C29 | H32 | 7.5° | 0.0° |
| C31 | C30 | C33 | N8 | 14.9° | 180.0° |
| C30 | C31 | C32 | H33 | 180.0° | 180.0° |
| C30 | C31 | C32 | H34 | 179.4° | 179.9° |
| C31 | C30 | C29 | H32 | 179.1° | 180.0° |
| C33 | N8 | N7 | C35 | 177.4° | 180.0° |
| O1 | C15 | N3 | C16 | 175.6° | 180.0° |
| O1 | C15 | C16 | C19 | 12.0° | 103.3° |
| O1 | C15 | C16 | S | 134.3° | 134.5° |
| O1 | C15 | N3 | H15 | 170.1° | 171.1° |
| N3 | C15 | C16 | C19 | 163.8° | 76.7° |
| N3 | C15 | C16 | S | 41.6° | 45.5° |
| C20 | N4 | C19 | C16 | 167.8° | 159.1° |
| N4 | C20 | H23 | H22 | 119.1° | 120.0° |
| C20 | N4 | C18 | H19 | 72.1° | 40.2° |
| C20 | N4 | C18 | H18 | 49.9° | 82.0° |
| C20 | N4 | C19 | H21 | 73.8° | 82.1° |
| C20 | N4 | C19 | H20 | 49.4° | 40.2° |
| N4 | C19 | C16 | C15 | 93.3° | 95.1° |
| N4 | C19 | C16 | H21 | 118.4° | 118.8° |
| N4 | C19 | C16 | H20 | 118.4° | 118.8° |
| N4 | C19 | C16 | S | 142.3° | 142.7° |
| C19 | N4 | C20 | H23 | 49.9° | 50.0° |
| C19 | N4 | C20 | H22 | 69.5° | 70.1° |
| C19 | N4 | C18 | H19 | 168.6° | 79.3° |
| C19 | N4 | C18 | H18 | 69.4° | 158.4° |
| N4 | C19 | H21 | H20 | 124.5° | 122.3° |
| C15 | C16 | C19 | S | 124.4° | 122.2° |
| C15 | C16 | S | C36 | 55.9° | 63.6° |
| C15 | C16 | C17 | H17 | 118.1° | 122.2° |
| C15 | C16 | C17 | H16 | 4.1° | 0.0° |
| C15 | C16 | C19 | H21 | 25.1° | 23.7° |
| C15 | C16 | C19 | H20 | 148.3° | 146.2° |
| C16 | C15 | N3 | H15 | 5.6° | 9.0° |
| C22 | C23 | H27 | H26 | 118.9° | 119.4° |
| C23 | C22 | H25 | H24 | 121.0° | 121.0° |
| O | C1 | C2 | H5 | 117.3° | 120.0° |
| C1 | O | C3 | N | 157.1° | 0.3° |
| O | C1 | C2 | H8 | 58.8° | 60.0° |
| O | C1 | C2 | H7 | 61.2° | 60.0° |
| O | C1 | C2 | H6 | 178.8° | 180.0° |
| O | C1 | C | H3 | 180.0° | 60.0° |
| O | C1 | C | H2 | 60.0° | 180.0° |
| O | C1 | C | H4 | 60.0° | 60.0° |
| C2 | C1 | O | C3 | 158.4° | 90.0° |
| C1 | C2 | H8 | H7 | 120.0° | 120.0° |
| C1 | C2 | H8 | H6 | 120.0° | 120.0° |
| C1 | C2 | H7 | H6 | 120.0° | 120.0° |
| C2 | C1 | C | H3 | 63.1° | 180.0° |
| C2 | C1 | C | H2 | 56.9° | 60.0° |
| C2 | C1 | C | H4 | 176.9° | 60.0° |
| N8 | N7 | C35 | H36 | 0.0° | 89.9° |
| N8 | N7 | C35 | H37 | 120.0° | 150.0° |
| N8 | N7 | C35 | H38 | 120.0° | 30.0° |
| N8 | N7 | C34 | H35 | 179.4° | 180.0° |
| N7 | C35 | H36 | H37 | 120.0° | 120.0° |
| N7 | C35 | H36 | H38 | 120.0° | 120.0° |
| N7 | C35 | H37 | H38 | 120.0° | 120.0° |
| C35 | N7 | C34 | H35 | 3.2° | 0.0° |
| C7 | N | C3 | O | 178.8° | 179.9° |
| N | C3 | C4 | H9 | 178.0° | 179.7° |
| C3 | N | C7 | H11 | 178.7° | 179.9° |
| O | C3 | C4 | H9 | 0.3° | 0.0° |
| C3 | O | C1 | H5 | 41.4° | 30.0° |
| C19 | C16 | S | C36 | 67.8° | 174.3° |
| C19 | C16 | C17 | H17 | 120.6° | 118.9° |
| C19 | C16 | C17 | H16 | 117.2° | 118.9° |
| C16 | C19 | H21 | H20 | 124.6° | 122.5° |
| S | C16 | C17 | H17 | 4.2° | 0.0° |
| S | C16 | C17 | H16 | 126.4° | 122.2° |
| S | C16 | C19 | H21 | 99.3° | 98.5° |
| S | C16 | C19 | H20 | 23.9° | 24.0° |
| C16 | S | C36 | H41 | 180.0° | 55.3° |
| C16 | S | C36 | H39 | 60.0° | 64.7° |
| C16 | S | C36 | H40 | 60.0° | 175.3° |
| S | C36 | H41 | H39 | 120.0° | 120.0° |
| S | C36 | H41 | H40 | 120.0° | 119.9° |
| S | C36 | H39 | H40 | 120.0° | 119.9° |
| H29 | C26 | C25 | H28 | 39.5° | 49.1° |
| H30 | C26 | C25 | H28 | 81.0° | 71.0° |
| H34 | C32 | C31 | H33 | 0.6° | 0.0° |
| H36 | C35 | H37 | H38 | 120.0° | 119.9° |
| H32 | C29 | C28 | H31 | 1.2° | 0.3° |
| H27 | C23 | C22 | H25 | 75.8° | 166.0° |
| H27 | C23 | C22 | H24 | 44.8° | 45.0° |
| H26 | C23 | C22 | H25 | 43.4° | 46.5° |
| H26 | C23 | C22 | H24 | 164.1° | 74.5° |
| H19 | C18 | C17 | H17 | 91.2° | 24.0° |
| H19 | C18 | C17 | H16 | 31.0° | 146.1° |
| H18 | C18 | C17 | H17 | 30.8° | 98.4° |
| H18 | C18 | C17 | H16 | 153.0° | 23.8° |
| H41 | C36 | H39 | H40 | 120.0° | 120.0° |
| H13 | C12 | C13 | H14 | 1.5° | 0.3° |
| H10 | C5 | C4 | H9 | 1.8° | 0.0° |
| H5 | C1 | C2 | H8 | 58.4° | 60.0° |
| H5 | C1 | C2 | H7 | 178.4° | 180.0° |
| H5 | C1 | C2 | H6 | 61.6° | 60.0° |
| H5 | C1 | C | H3 | 58.6° | 60.0° |
| H5 | C1 | C | H2 | 178.5° | 60.0° |
| H5 | C1 | C | H4 | 61.5° | 180.0° |
| H8 | C2 | H7 | H6 | 120.0° | 120.0° |
| H3 | C | H2 | H4 | 120.0° | 120.0° |
