3ZK
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C37 | O30 | sing | 1.43Å | 1.44Å | |
| C25 | C20 | doub | 1.38Å | 1.41Å | Aromatic |
| C25 | C27 | sing | 1.38Å | 1.41Å | Aromatic |
| C20 | C9 | sing | 1.38Å | 1.40Å | Aromatic |
| C35 | C27 | sing | 1.51Å | 1.54Å | |
| C27 | C26 | doub | 1.38Å | 1.40Å | Aromatic |
| O30 | C32 | sing | 1.43Å | 1.43Å | |
| O11 | S1 | doub | 1.42Å | 1.44Å | |
| N14 | C22 | sing | 1.48Å | 1.48Å | |
| N14 | C23 | sing | 1.49Å | 1.47Å | |
| C9 | S1 | sing | 1.76Å | 1.77Å | |
| C9 | C21 | doub | 1.38Å | 1.41Å | Aromatic |
| C32 | C29 | sing | 1.53Å | 1.54Å | |
| N4 | S1 | sing | 1.66Å | 1.63Å | |
| N4 | C8 | sing | 1.47Å | 1.46Å | |
| C22 | C6 | sing | 1.54Å | 1.54Å | |
| S1 | O12 | doub | 1.42Å | 1.43Å | |
| C26 | C21 | sing | 1.38Å | 1.41Å | Aromatic |
| C23 | C8 | sing | 1.55Å | 1.54Å | |
| C8 | C6 | sing | 1.55Å | 1.55Å | |
| C31 | C29 | sing | 1.53Å | 1.55Å | |
| C31 | O24 | sing | 1.43Å | 1.44Å | |
| C6 | C5 | sing | 1.53Å | 1.56Å | |
| O24 | C13 | sing | 1.36Å | 1.41Å | |
| C33 | C18 | sing | 1.53Å | 1.56Å | |
| C5 | N3 | sing | 1.47Å | 1.49Å | |
| C10 | C13 | doub | 1.38Å | 1.42Å | Aromatic |
| C10 | C7 | sing | 1.40Å | 1.40Å | Aromatic |
| O15 | C2 | doub | 1.22Å | 1.23Å | |
| N3 | C2 | sing | 1.35Å | 1.37Å | |
| N3 | C18 | sing | 1.46Å | 1.49Å | |
| C13 | C16 | sing | 1.39Å | 1.42Å | Aromatic |
| C2 | C7 | sing | 1.48Å | 1.51Å | |
| C18 | C34 | sing | 1.53Å | 1.55Å | |
| C7 | C17 | doub | 1.40Å | 1.41Å | Aromatic |
| C16 | O28 | sing | 1.36Å | 1.41Å | |
| C16 | C19 | doub | 1.39Å | 1.42Å | Aromatic |
| O28 | C36 | sing | 1.43Å | 1.44Å | |
| C17 | C19 | sing | 1.38Å | 1.40Å | Aromatic |
| C17 | H1 | sing | 1.08Å | 1.08Å | |
| C18 | H2 | sing | 1.09Å | 1.10Å | |
| C19 | H3 | sing | 1.08Å | 1.08Å | |
| C20 | H4 | sing | 1.08Å | 1.08Å | |
| C21 | H5 | sing | 1.08Å | 1.08Å | |
| C22 | H6 | sing | 1.09Å | 1.10Å | |
| C22 | H7 | sing | 1.09Å | 1.10Å | |
| C23 | H8 | sing | 1.09Å | 1.10Å | |
| C23 | H9 | sing | 1.09Å | 1.10Å | |
| C25 | H10 | sing | 1.08Å | 1.08Å | |
| C26 | H11 | sing | 1.08Å | 1.08Å | |
| C29 | H12 | sing | 1.09Å | 1.10Å | |
| C29 | H13 | sing | 1.09Å | 1.10Å | |
| N4 | H14 | sing | 0.97Å | 1.00Å | |
| C5 | H15 | sing | 1.09Å | 1.10Å | |
| C5 | H16 | sing | 1.09Å | 1.10Å | |
| C6 | H17 | sing | 1.09Å | 1.10Å | |
| C8 | H18 | sing | 1.09Å | 1.10Å | |
| C10 | H19 | sing | 1.08Å | 1.08Å | |
| N14 | H20 | sing | 1.01Å | 1.00Å | |
| C31 | H22 | sing | 1.09Å | 1.10Å | |
| C31 | H23 | sing | 1.09Å | 1.10Å | |
| C32 | H24 | sing | 1.09Å | 1.10Å | |
| C32 | H25 | sing | 1.09Å | 1.10Å | |
| C33 | H26 | sing | 1.09Å | 1.10Å | |
| C33 | H27 | sing | 1.09Å | 1.10Å | |
| C33 | H28 | sing | 1.09Å | 1.10Å | |
| C34 | H29 | sing | 1.09Å | 1.10Å | |
| C34 | H30 | sing | 1.09Å | 1.10Å | |
| C34 | H31 | sing | 1.09Å | 1.10Å | |
| C35 | H32 | sing | 1.09Å | 1.10Å | |
| C35 | H33 | sing | 1.09Å | 1.10Å | |
| C35 | H34 | sing | 1.09Å | 1.10Å | |
| C36 | H35 | sing | 1.09Å | 1.10Å | |
| C36 | H36 | sing | 1.09Å | 1.10Å | |
| C36 | H37 | sing | 1.09Å | 1.10Å | |
| C37 | H38 | sing | 1.09Å | 1.10Å | |
| C37 | H39 | sing | 1.09Å | 1.10Å | |
| C37 | H40 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C37 | O30 | C32 | 113.0° | 114.0° |
| O30 | C37 | H38 | 109.5° | 109.4° |
| O30 | C37 | H39 | 109.5° | 109.4° |
| O30 | C37 | H40 | 109.5° | 109.5° |
| C20 | C25 | C27 | 120.8° | 120.0° |
| C25 | C20 | C9 | 119.6° | 120.0° |
| C25 | C20 | H4 | 120.2° | 120.0° |
| C20 | C25 | H10 | 119.6° | 119.9° |
| C25 | C27 | C35 | 120.7° | 120.0° |
| C25 | C27 | C26 | 119.1° | 120.0° |
| C27 | C25 | H10 | 119.6° | 120.0° |
| C20 | C9 | S1 | 120.0° | 119.9° |
| C20 | C9 | C21 | 119.9° | 120.0° |
| C9 | C20 | H4 | 120.2° | 120.0° |
| C35 | C27 | C26 | 120.2° | 120.0° |
| C27 | C35 | H32 | 109.5° | 109.5° |
| C27 | C35 | H33 | 109.5° | 109.4° |
| C27 | C35 | H34 | 109.5° | 109.4° |
| C27 | C26 | C21 | 120.4° | 120.0° |
| C27 | C26 | H11 | 119.8° | 120.0° |
| O30 | C32 | C29 | 109.4° | 109.5° |
| O30 | C32 | H24 | 109.5° | 109.5° |
| O30 | C32 | H25 | 109.5° | 109.5° |
| O11 | S1 | C9 | 108.9° | 106.4° |
| O11 | S1 | N4 | 108.8° | 106.4° |
| O11 | S1 | O12 | 115.9° | 123.2° |
| C22 | N14 | C23 | 107.7° | 105.8° |
| N14 | C22 | C6 | 107.1° | 107.0° |
| N14 | C22 | H6 | 110.1° | 109.9° |
| N14 | C22 | H7 | 110.1° | 110.1° |
| C22 | N14 | H20 | 109.9° | 111.0° |
| N14 | C23 | C8 | 101.5° | 103.2° |
| N14 | C23 | H8 | 111.4° | 110.7° |
| N14 | C23 | H9 | 111.4° | 110.8° |
| C23 | N14 | H20 | 109.9° | 111.0° |
| S1 | C9 | C21 | 120.0° | 120.0° |
| C9 | S1 | N4 | 101.2° | 107.2° |
| C9 | S1 | O12 | 111.0° | 106.4° |
| C9 | C21 | C26 | 120.2° | 120.0° |
| C9 | C21 | H5 | 119.9° | 120.0° |
| C32 | C29 | C31 | 110.8° | 109.5° |
| C32 | C29 | H12 | 109.1° | 109.5° |
| C32 | C29 | H13 | 109.2° | 109.5° |
| C29 | C32 | H24 | 109.5° | 109.4° |
| C29 | C32 | H25 | 109.5° | 109.5° |
| S1 | N4 | C8 | 123.7° | 120.0° |
| N4 | S1 | O12 | 110.0° | 106.4° |
| S1 | N4 | H14 | 105.8° | 120.0° |
| N4 | C8 | C23 | 113.8° | 110.7° |
| N4 | C8 | C6 | 111.4° | 110.7° |
| C8 | N4 | H14 | 105.8° | 120.0° |
| N4 | C8 | H18 | 110.4° | 110.6° |
| C22 | C6 | C8 | 102.5° | 105.2° |
| C22 | C6 | C5 | 116.0° | 110.3° |
| C6 | C22 | H6 | 110.1° | 109.9° |
| C6 | C22 | H7 | 110.1° | 109.9° |
| C22 | C6 | H17 | 108.2° | 110.3° |
| C26 | C21 | H5 | 119.9° | 120.0° |
| C21 | C26 | H11 | 119.8° | 120.0° |
| C23 | C8 | C6 | 102.7° | 102.9° |
| C8 | C23 | H8 | 111.4° | 110.7° |
| C8 | C23 | H9 | 111.4° | 110.6° |
| C23 | C8 | H18 | 109.2° | 110.7° |
| C8 | C6 | C5 | 113.6° | 110.3° |
| C8 | C6 | H17 | 108.1° | 110.4° |
| C6 | C8 | H18 | 109.1° | 110.9° |
| C29 | C31 | O24 | 111.1° | 109.4° |
| C31 | C29 | H12 | 109.1° | 109.5° |
| C31 | C29 | H13 | 109.1° | 109.5° |
| C29 | C31 | H22 | 109.1° | 109.5° |
| C29 | C31 | H23 | 109.1° | 109.5° |
| C31 | O24 | C13 | 125.5° | 117.0° |
| O24 | C31 | H22 | 109.1° | 109.5° |
| O24 | C31 | H23 | 109.1° | 109.5° |
| C6 | C5 | N3 | 115.9° | 109.5° |
| C6 | C5 | H15 | 107.8° | 109.5° |
| C6 | C5 | H16 | 107.8° | 109.4° |
| C5 | C6 | H17 | 108.0° | 110.2° |
| O24 | C13 | C10 | 124.3° | 120.0° |
| O24 | C13 | C16 | 115.7° | 120.0° |
| C33 | C18 | N3 | 121.9° | 109.5° |
| C33 | C18 | C34 | 114.0° | 109.5° |
| C33 | C18 | H2 | 103.0° | 109.5° |
| C18 | C33 | H26 | 109.5° | 109.5° |
| C18 | C33 | H27 | 109.5° | 109.5° |
| C18 | C33 | H28 | 109.4° | 109.5° |
| C5 | N3 | C2 | 119.1° | 120.0° |
| C5 | N3 | C18 | 119.6° | 120.0° |
| N3 | C5 | H15 | 107.8° | 109.5° |
| N3 | C5 | H16 | 107.8° | 109.5° |
| C13 | C10 | C7 | 119.5° | 119.9° |
| C10 | C13 | C16 | 119.9° | 120.0° |
| C13 | C10 | H19 | 120.2° | 120.1° |
| C10 | C7 | C2 | 118.0° | 120.1° |
| C10 | C7 | C17 | 120.6° | 119.8° |
| C7 | C10 | H19 | 120.2° | 120.1° |
| O15 | C2 | N3 | 123.0° | 120.0° |
| O15 | C2 | C7 | 110.6° | 120.0° |
| C2 | N3 | C18 | 120.6° | 120.0° |
| N3 | C2 | C7 | 126.2° | 120.0° |
| N3 | C18 | C34 | 108.8° | 109.5° |
| N3 | C18 | H2 | 103.6° | 109.5° |
| C13 | C16 | O28 | 117.7° | 120.0° |
| C13 | C16 | C19 | 119.8° | 120.1° |
| C2 | C7 | C17 | 121.2° | 120.0° |
| C34 | C18 | H2 | 103.0° | 109.4° |
| C18 | C34 | H29 | 109.5° | 109.5° |
| C18 | C34 | H30 | 109.5° | 109.5° |
| C18 | C34 | H31 | 109.5° | 109.5° |
| C7 | C17 | C19 | 120.2° | 120.0° |
| C7 | C17 | H1 | 119.9° | 120.0° |
| O28 | C16 | C19 | 122.5° | 119.9° |
| C16 | O28 | C36 | 122.1° | 117.0° |
| C16 | C19 | C17 | 119.8° | 120.1° |
| C16 | C19 | H3 | 120.1° | 119.9° |
| O28 | C36 | H35 | 109.5° | 109.5° |
| O28 | C36 | H36 | 109.5° | 109.5° |
| O28 | C36 | H37 | 109.5° | 109.5° |
| C19 | C17 | H1 | 119.9° | 120.0° |
| C17 | C19 | H3 | 120.1° | 120.0° |
| H6 | C22 | H7 | 109.5° | 109.9° |
| H8 | C23 | H9 | 109.5° | 110.6° |
| H12 | C29 | H13 | 109.5° | 109.5° |
| H15 | C5 | H16 | 109.5° | 109.5° |
| H22 | C31 | H23 | 109.5° | 109.5° |
| H24 | C32 | H25 | 109.5° | 109.5° |
| H26 | C33 | H27 | 109.5° | 109.5° |
| H26 | C33 | H28 | 109.4° | 109.5° |
| H27 | C33 | H28 | 109.5° | 109.5° |
| H29 | C34 | H30 | 109.5° | 109.4° |
| H29 | C34 | H31 | 109.5° | 109.4° |
| H30 | C34 | H31 | 109.5° | 109.5° |
| H32 | C35 | H33 | 109.5° | 109.5° |
| H32 | C35 | H34 | 109.5° | 109.5° |
| H33 | C35 | H34 | 109.5° | 109.5° |
| H35 | C36 | H36 | 109.4° | 109.4° |
| H35 | C36 | H37 | 109.5° | 109.5° |
| H36 | C36 | H37 | 109.5° | 109.4° |
| H38 | C37 | H39 | 109.5° | 109.5° |
| H38 | C37 | H40 | 109.5° | 109.5° |
| H39 | C37 | H40 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C37 | O30 | C32 | C29 | 135.1° | 180.0° |
| C37 | O30 | C32 | H24 | 104.9° | 60.0° |
| C37 | O30 | C32 | H25 | 15.2° | 60.0° |
| O30 | C37 | H38 | H39 | 120.0° | 120.0° |
| O30 | C37 | H38 | H40 | 120.0° | 120.0° |
| O30 | C37 | H39 | H40 | 120.0° | 120.0° |
| C20 | C25 | C27 | H10 | 180.0° | 180.0° |
| C25 | C20 | C9 | H4 | 180.0° | 179.6° |
| C20 | C25 | C27 | C35 | 179.8° | 179.9° |
| C20 | C25 | C27 | C26 | 0.1° | 0.0° |
| C25 | C20 | C9 | S1 | 178.1° | 179.7° |
| C25 | C20 | C9 | C21 | 1.7° | 0.3° |
| C27 | C25 | C20 | C9 | 1.1° | 0.0° |
| C25 | C27 | C35 | C26 | 179.7° | 180.0° |
| C25 | C27 | C26 | C21 | 0.3° | 0.3° |
| C27 | C25 | C20 | H4 | 178.9° | 179.7° |
| C25 | C27 | C26 | H11 | 179.7° | 179.7° |
| C25 | C27 | C35 | H32 | 90.1° | 90.0° |
| C25 | C27 | C35 | H33 | 149.8° | 150.0° |
| C25 | C27 | C35 | H34 | 29.9° | 30.0° |
| C20 | C9 | S1 | O11 | 63.0° | 23.5° |
| C20 | C9 | S1 | C21 | 176.4° | 180.0° |
| C20 | C9 | S1 | N4 | 51.5° | 90.0° |
| C20 | C9 | S1 | O12 | 168.2° | 156.5° |
| C20 | C9 | C21 | C26 | 1.3° | 0.5° |
| C20 | C9 | C21 | H5 | 178.7° | 179.9° |
| C9 | C20 | C25 | H10 | 178.9° | 180.0° |
| C35 | C27 | C26 | C21 | 179.4° | 179.7° |
| C35 | C27 | C25 | H10 | 0.2° | 0.0° |
| C35 | C27 | C26 | H11 | 0.6° | 0.4° |
| C27 | C35 | H32 | H33 | 120.0° | 120.0° |
| C27 | C35 | H32 | H34 | 120.0° | 120.0° |
| C27 | C35 | H33 | H34 | 120.0° | 119.9° |
| C27 | C26 | C21 | C9 | 0.3° | 0.5° |
| C27 | C26 | C21 | H11 | 180.0° | 179.9° |
| C27 | C26 | C21 | H5 | 179.7° | 179.9° |
| C26 | C27 | C25 | H10 | 179.9° | 180.0° |
| C26 | C27 | C35 | H32 | 90.1° | 90.0° |
| C26 | C27 | C35 | H33 | 29.9° | 30.0° |
| C26 | C27 | C35 | H34 | 149.8° | 150.0° |
| O30 | C32 | C29 | H24 | 120.0° | 120.0° |
| O30 | C32 | C29 | H25 | 120.0° | 120.0° |
| O30 | C32 | C29 | C31 | 70.9° | 180.0° |
| O30 | C32 | C29 | H12 | 49.2° | 60.0° |
| O30 | C32 | C29 | H13 | 168.9° | 60.0° |
| O30 | C32 | H24 | H25 | 120.1° | 120.0° |
| C32 | O30 | C37 | H38 | 180.0° | 60.0° |
| C32 | O30 | C37 | H39 | 60.0° | 60.0° |
| C32 | O30 | C37 | H40 | 60.0° | 180.0° |
| O11 | S1 | C9 | N4 | 114.5° | 113.5° |
| O11 | S1 | C9 | O12 | 128.8° | 132.9° |
| O11 | S1 | C9 | C21 | 113.4° | 156.4° |
| O11 | S1 | N4 | O12 | 127.9° | 133.0° |
| O11 | S1 | N4 | C8 | 172.4° | 178.5° |
| O11 | S1 | N4 | H14 | 50.5° | 1.5° |
| C22 | N14 | C23 | H20 | 119.7° | 120.5° |
| N14 | C22 | C6 | H6 | 119.6° | 119.3° |
| N14 | C22 | C6 | H7 | 119.6° | 119.6° |
| C22 | N14 | C23 | C8 | 36.5° | 39.2° |
| N14 | C22 | C6 | C8 | 11.8° | 1.2° |
| N14 | C22 | C6 | C5 | 112.6° | 117.7° |
| N14 | C22 | H6 | H7 | 121.1° | 121.3° |
| C22 | N14 | C23 | H8 | 82.2° | 79.2° |
| C22 | N14 | C23 | H9 | 155.2° | 157.7° |
| N14 | C22 | C6 | H17 | 125.9° | 120.3° |
| N14 | C23 | C8 | N4 | 77.4° | 155.8° |
| C23 | N14 | C22 | C6 | 15.6° | 25.4° |
| N14 | C23 | C8 | H8 | 118.7° | 118.5° |
| N14 | C23 | C8 | H9 | 118.7° | 118.6° |
| N14 | C23 | C8 | C6 | 43.1° | 37.4° |
| C23 | N14 | C22 | H6 | 135.2° | 144.7° |
| C23 | N14 | C22 | H7 | 104.0° | 94.1° |
| N14 | C23 | H8 | H9 | 123.7° | 123.2° |
| N14 | C23 | C8 | H18 | 158.8° | 81.1° |
| C9 | S1 | N4 | O12 | 117.5° | 113.5° |
| C9 | S1 | N4 | C8 | 73.0° | 65.0° |
| S1 | C9 | C21 | C26 | 177.7° | 179.5° |
| S1 | C9 | C20 | H4 | 1.9° | 0.1° |
| S1 | C9 | C21 | H5 | 2.3° | 0.1° |
| C9 | S1 | N4 | H14 | 165.1° | 115.1° |
| C21 | C9 | S1 | N4 | 132.1° | 90.0° |
| C21 | C9 | S1 | O12 | 15.4° | 23.5° |
| C9 | C21 | C26 | H5 | 180.0° | 179.6° |
| C21 | C9 | C20 | H4 | 178.3° | 179.9° |
| C9 | C21 | C26 | H11 | 179.7° | 179.4° |
| C32 | C29 | C31 | H12 | 120.2° | 120.0° |
| C32 | C29 | C31 | H13 | 120.2° | 120.0° |
| C32 | C29 | C31 | O24 | 171.8° | 180.0° |
| C32 | C29 | H12 | H13 | 119.4° | 120.0° |
| C32 | C29 | C31 | H22 | 51.6° | 60.0° |
| C32 | C29 | C31 | H23 | 67.9° | 60.0° |
| C29 | C32 | H24 | H25 | 120.0° | 120.0° |
| S1 | N4 | C8 | H14 | 121.9° | 180.0° |
| S1 | N4 | C8 | C23 | 110.4° | 96.5° |
| S1 | N4 | C8 | C6 | 134.2° | 150.0° |
| S1 | N4 | C8 | H18 | 12.8° | 26.7° |
| N4 | C8 | C6 | C22 | 88.7° | 140.3° |
| C8 | N4 | S1 | O12 | 44.5° | 48.5° |
| N4 | C8 | C23 | C6 | 120.5° | 118.4° |
| N4 | C8 | C23 | H18 | 123.8° | 123.1° |
| N4 | C8 | C6 | H18 | 122.1° | 123.2° |
| N4 | C8 | C6 | C5 | 145.3° | 100.7° |
| N4 | C8 | C23 | H8 | 163.8° | 37.4° |
| N4 | C8 | C23 | H9 | 41.3° | 85.6° |
| N4 | C8 | C6 | H17 | 25.4° | 21.3° |
| C22 | C6 | C8 | C23 | 33.4° | 22.0° |
| C22 | C6 | C8 | C5 | 126.0° | 118.9° |
| C22 | C6 | C8 | H17 | 114.2° | 119.0° |
| C22 | C6 | C5 | H17 | 121.7° | 122.1° |
| C22 | C6 | C5 | N3 | 67.7° | 58.0° |
| C6 | C22 | H6 | H7 | 121.1° | 121.1° |
| C22 | C6 | C5 | H15 | 53.3° | 178.0° |
| C22 | C6 | C5 | H16 | 171.4° | 62.0° |
| C22 | C6 | C8 | H18 | 149.2° | 96.5° |
| C6 | C22 | N14 | H20 | 135.3° | 95.2° |
| O12 | S1 | N4 | H14 | 77.4° | 131.5° |
| C23 | C8 | C6 | H18 | 115.8° | 118.5° |
| C23 | C8 | C6 | C5 | 92.6° | 140.9° |
| C8 | C23 | H8 | H9 | 123.7° | 123.0° |
| C23 | C8 | N4 | H14 | 127.7° | 83.6° |
| C23 | C8 | C6 | H17 | 147.6° | 97.0° |
| C8 | C23 | N14 | H20 | 156.2° | 81.3° |
| C8 | C6 | C5 | H17 | 119.9° | 122.2° |
| C8 | C6 | C5 | N3 | 173.9° | 173.7° |
| C8 | C6 | C22 | H6 | 107.9° | 120.6° |
| C8 | C6 | C22 | H7 | 131.4° | 118.3° |
| C6 | C8 | C23 | H8 | 75.7° | 81.0° |
| C6 | C8 | C23 | H9 | 161.8° | 156.0° |
| C6 | C8 | N4 | H14 | 12.2° | 29.9° |
| C8 | C6 | C5 | H15 | 65.1° | 66.3° |
| C8 | C6 | C5 | H16 | 53.0° | 53.7° |
| C29 | C31 | O24 | H22 | 120.2° | 120.0° |
| C29 | C31 | O24 | H23 | 120.2° | 120.0° |
| C29 | C31 | O24 | C13 | 90.1° | 180.0° |
| C31 | C29 | H12 | H13 | 119.4° | 120.0° |
| C29 | C31 | H22 | H23 | 119.3° | 120.0° |
| C31 | C29 | C32 | H24 | 169.1° | 60.0° |
| C31 | C29 | C32 | H25 | 49.0° | 60.0° |
| C31 | O24 | C13 | C10 | 0.4° | 0.3° |
| C31 | O24 | C13 | C16 | 178.0° | 180.0° |
| O24 | C31 | C29 | H12 | 68.0° | 60.0° |
| O24 | C31 | C29 | H13 | 51.6° | 60.0° |
| O24 | C31 | H22 | H23 | 119.3° | 120.0° |
| C6 | C5 | N3 | H15 | 120.9° | 120.0° |
| C6 | C5 | N3 | H16 | 121.0° | 120.0° |
| C6 | C5 | N3 | C2 | 68.2° | 128.1° |
| C6 | C5 | N3 | C18 | 121.5° | 51.8° |
| C5 | C6 | C22 | H6 | 127.8° | 1.6° |
| C5 | C6 | C22 | H7 | 7.0° | 122.7° |
| C6 | C5 | H15 | H16 | 117.1° | 120.0° |
| C5 | C6 | C8 | H18 | 23.2° | 22.5° |
| O24 | C13 | C10 | C16 | 177.5° | 179.7° |
| O24 | C13 | C10 | C7 | 179.7° | 179.7° |
| O24 | C13 | C16 | O28 | 1.3° | 0.3° |
| O24 | C13 | C16 | C19 | 179.3° | 179.7° |
| O24 | C13 | C10 | H19 | 0.2° | 0.2° |
| C13 | O24 | C31 | H22 | 30.2° | 60.0° |
| C13 | O24 | C31 | H23 | 149.7° | 60.0° |
| C33 | C18 | N3 | C5 | 62.1° | 43.9° |
| C33 | C18 | N3 | C2 | 127.8° | 136.1° |
| C33 | C18 | N3 | C34 | 135.9° | 120.0° |
| C33 | C18 | N3 | H2 | 115.0° | 120.0° |
| C33 | C18 | C34 | H2 | 110.8° | 120.0° |
| C18 | C33 | H26 | H27 | 120.0° | 120.0° |
| C18 | C33 | H26 | H28 | 120.0° | 120.0° |
| C18 | C33 | H27 | H28 | 120.0° | 120.0° |
| C33 | C18 | C34 | H29 | 180.0° | 180.0° |
| C33 | C18 | C34 | H30 | 60.0° | 59.9° |
| C33 | C18 | C34 | H31 | 60.0° | 60.1° |
| C5 | N3 | C2 | O15 | 5.0° | 175.1° |
| C5 | N3 | C2 | C18 | 170.2° | 179.9° |
| C5 | N3 | C2 | C7 | 179.1° | 5.2° |
| C5 | N3 | C18 | C34 | 73.8° | 76.1° |
| C5 | N3 | C18 | H2 | 177.1° | 163.9° |
| N3 | C5 | H15 | H16 | 117.1° | 120.0° |
| N3 | C5 | C6 | H17 | 54.0° | 64.1° |
| C13 | C10 | C7 | H19 | 180.0° | 179.9° |
| C13 | C10 | C7 | C2 | 178.3° | 180.0° |
| C13 | C10 | C7 | C17 | 3.7° | 0.1° |
| C10 | C13 | C16 | O28 | 176.4° | 180.0° |
| C10 | C13 | C16 | C19 | 1.6° | 0.0° |
| C10 | C7 | C2 | O15 | 109.8° | 44.0° |
| C10 | C7 | C2 | N3 | 64.9° | 135.7° |
| C7 | C10 | C13 | C16 | 2.2° | 0.0° |
| C10 | C7 | C2 | C17 | 174.5° | 179.9° |
| C10 | C7 | C17 | C19 | 4.6° | 0.1° |
| C10 | C7 | C17 | H1 | 175.4° | 180.0° |
| O15 | C2 | N3 | C7 | 174.1° | 179.7° |
| O15 | C2 | N3 | C18 | 175.2° | 4.9° |
| O15 | C2 | C7 | C17 | 64.8° | 136.1° |
| C2 | N3 | C18 | C34 | 96.3° | 103.9° |
| N3 | C2 | C7 | C17 | 120.5° | 44.2° |
| C2 | N3 | C18 | H2 | 12.7° | 16.1° |
| C2 | N3 | C5 | H15 | 170.9° | 111.9° |
| C2 | N3 | C5 | H16 | 52.7° | 8.2° |
| C18 | N3 | C2 | C7 | 10.7° | 174.8° |
| N3 | C18 | C34 | H2 | 109.5° | 120.0° |
| C18 | N3 | C5 | H15 | 0.6° | 68.2° |
| C18 | N3 | C5 | H16 | 117.5° | 171.8° |
| N3 | C18 | C33 | H26 | 180.0° | 180.0° |
| N3 | C18 | C33 | H27 | 60.0° | 60.0° |
| N3 | C18 | C33 | H28 | 60.0° | 60.0° |
| N3 | C18 | C34 | H29 | 40.3° | 60.0° |
| N3 | C18 | C34 | H30 | 160.3° | 180.0° |
| N3 | C18 | C34 | H31 | 79.7° | 60.0° |
| C13 | C16 | O28 | C19 | 177.9° | 180.0° |
| C13 | C16 | O28 | C36 | 175.2° | 180.0° |
| C13 | C16 | C19 | C17 | 2.4° | 0.0° |
| C13 | C16 | C19 | H3 | 177.6° | 180.0° |
| C16 | C13 | C10 | H19 | 177.7° | 179.9° |
| C2 | C7 | C17 | C19 | 179.0° | 180.0° |
| C2 | C7 | C17 | H1 | 1.0° | 0.1° |
| C2 | C7 | C10 | H19 | 1.7° | 0.1° |
| C34 | C18 | C33 | H26 | 46.1° | 60.0° |
| C34 | C18 | C33 | H27 | 166.2° | 180.0° |
| C34 | C18 | C33 | H28 | 73.8° | 60.0° |
| C18 | C34 | H29 | H30 | 120.0° | 120.1° |
| C18 | C34 | H29 | H31 | 120.0° | 120.0° |
| C18 | C34 | H30 | H31 | 120.0° | 120.0° |
| C7 | C17 | C19 | C16 | 3.9° | 0.0° |
| C7 | C17 | C19 | H1 | 180.0° | 180.0° |
| C7 | C17 | C19 | H3 | 176.1° | 180.0° |
| C17 | C7 | C10 | H19 | 176.2° | 180.0° |
| O28 | C16 | C19 | C17 | 175.5° | 180.0° |
| O28 | C16 | C19 | H3 | 4.5° | 0.0° |
| C16 | O28 | C36 | H35 | 180.0° | 180.0° |
| C16 | O28 | C36 | H36 | 60.0° | 60.0° |
| C16 | O28 | C36 | H37 | 60.0° | 60.0° |
| C19 | C16 | O28 | C36 | 6.9° | 0.0° |
| C16 | C19 | C17 | H3 | 180.0° | 180.0° |
| C16 | C19 | C17 | H1 | 176.1° | 180.0° |
| O28 | C36 | H35 | H36 | 120.0° | 120.1° |
| O28 | C36 | H35 | H37 | 120.0° | 120.0° |
| O28 | C36 | H36 | H37 | 120.0° | 120.0° |
| H1 | C17 | C19 | H3 | 3.9° | 0.0° |
| H2 | C18 | C33 | H26 | 64.7° | 60.0° |
| H2 | C18 | C33 | H27 | 55.4° | 60.0° |
| H2 | C18 | C33 | H28 | 175.4° | 180.0° |
| H2 | C18 | C34 | H29 | 69.1° | 60.0° |
| H2 | C18 | C34 | H30 | 50.9° | 60.0° |
| H2 | C18 | C34 | H31 | 170.8° | 180.0° |
| H4 | C20 | C25 | H10 | 1.1° | 0.3° |
| H5 | C21 | C26 | H11 | 0.3° | 0.1° |
| H6 | C22 | C6 | H17 | 6.2° | 120.4° |
| H6 | C22 | N14 | H20 | 105.0° | 24.2° |
| H7 | C22 | C6 | H17 | 114.5° | 0.7° |
| H7 | C22 | N14 | H20 | 15.7° | 145.4° |
| H8 | C23 | C8 | H18 | 40.0° | 160.4° |
| H8 | C23 | N14 | H20 | 37.5° | 160.3° |
| H9 | C23 | C8 | H18 | 82.5° | 37.4° |
| H9 | C23 | N14 | H20 | 85.1° | 37.2° |
| H12 | C29 | C31 | H22 | 171.8° | 60.0° |
| H12 | C29 | C31 | H23 | 52.3° | 180.0° |
| H12 | C29 | C32 | H24 | 70.8° | 180.0° |
| H12 | C29 | C32 | H25 | 169.2° | 60.0° |
| H13 | C29 | C31 | H22 | 68.6° | 180.0° |
| H13 | C29 | C31 | H23 | 171.9° | 60.0° |
| H13 | C29 | C32 | H24 | 48.9° | 60.0° |
| H13 | C29 | C32 | H25 | 71.2° | 180.0° |
| H14 | N4 | C8 | H18 | 109.1° | 153.3° |
| H15 | C5 | C6 | H17 | 174.9° | 55.9° |
| H16 | C5 | C6 | H17 | 66.9° | 175.9° |
| H17 | C6 | C8 | H18 | 96.6° | 144.5° |
| H26 | C33 | H27 | H28 | 120.0° | 120.0° |
| H29 | C34 | H30 | H31 | 120.0° | 119.9° |
| H32 | C35 | H33 | H34 | 120.0° | 120.0° |
| H35 | C36 | H36 | H37 | 120.0° | 119.9° |
| H38 | C37 | H39 | H40 | 120.0° | 120.1° |
