4W9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C11 | C27 | sing | 1.51Å | 1.51Å | |
| C8 | C29 | sing | 1.53Å | 1.53Å | |
| C27 | C29 | sing | 1.49Å | 1.51Å | |
| C27 | C26 | doub | 1.31Å | 1.34Å | |
| C29 | C17 | sing | 1.52Å | 1.54Å | |
| O14 | C10 | doub | 1.22Å | 1.29Å | |
| N11 | C10 | sing | 1.35Å | 1.37Å | |
| N11 | C12 | sing | 1.47Å | 1.43Å | |
| C26 | C24 | sing | 1.51Å | 1.51Å | |
| C10 | C9 | sing | 1.46Å | 1.50Å | |
| C17 | C12 | sing | 1.53Å | 1.54Å | |
| C12 | C24 | sing | 1.54Å | 1.49Å | |
| C12 | C13 | sing | 1.50Å | 1.42Å | |
| C24 | C22 | sing | 1.50Å | 1.56Å | |
| C24 | C5 | sing | 1.55Å | 1.53Å | |
| C22 | C20 | sing | 1.50Å | 1.55Å | |
| C6 | CG | sing | 1.53Å | 1.53Å | |
| O4 | C19 | sing | 1.43Å | 1.43Å | |
| C9 | C13 | doub | 1.39Å | 1.44Å | |
| C9 | C7 | sing | 1.47Å | 1.48Å | |
| C19 | C20 | sing | 1.53Å | 1.54Å | |
| C19 | C18 | sing | 1.52Å | 1.55Å | |
| C13 | O16 | sing | 1.34Å | 1.47Å | |
| CD2 | CE2 | sing | 1.53Å | 1.52Å | |
| CD2 | CG | sing | 1.53Å | 1.54Å | |
| CD2 | C18 | sing | 1.54Å | 1.56Å | |
| CE2 | CZ | sing | 1.52Å | 1.33Å | |
| C20 | C21 | sing | 1.52Å | 1.53Å | |
| CG | C7 | sing | 1.51Å | 1.51Å | |
| CG | C14 | sing | 1.52Å | 1.54Å | |
| C7 | O8 | doub | 1.22Å | 1.22Å | |
| C21 | C23 | sing | 1.53Å | 1.52Å | |
| CZ | CE1 | sing | 1.52Å | 1.51Å | |
| CE1 | C14 | sing | 1.54Å | 1.53Å | |
| CE1 | C1 | sing | 1.53Å | 1.54Å | |
| C14 | C4 | sing | 1.53Å | 1.53Å | |
| C4 | C3 | sing | 1.54Å | 1.53Å | |
| O5 | C1 | sing | 1.43Å | 1.43Å | |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| C3 | C2 | sing | 1.53Å | 1.53Å | |
| O5 | H1 | sing | 0.97Å | 0.95Å | |
| C29 | H2 | sing | 1.10Å | 1.10Å | |
| C17 | H3 | sing | 1.10Å | 1.10Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| O16 | H5 | sing | 0.97Å | 0.95Å | |
| N11 | H6 | sing | 0.97Å | 1.00Å | |
| C26 | H7 | sing | 1.07Å | 1.08Å | |
| C22 | H8 | sing | 1.10Å | 1.10Å | |
| C22 | H9 | sing | 1.13Å | 1.10Å | |
| C20 | H10 | sing | 1.12Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C23 | H13 | sing | 1.09Å | 1.10Å | |
| C23 | H14 | sing | 1.09Å | 1.10Å | |
| C23 | H15 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.10Å | 1.10Å | |
| C18 | H17 | sing | 1.07Å | 1.10Å | |
| C18 | H18 | sing | 1.10Å | 1.10Å | |
| CD2 | H19 | sing | 1.09Å | 1.10Å | |
| CE2 | H20 | sing | 1.09Å | 1.10Å | |
| CE2 | H21 | sing | 1.09Å | 1.10Å | |
| CZ | H22 | sing | 1.10Å | 1.10Å | |
| CZ | H23 | sing | 1.09Å | 1.10Å | |
| CE1 | H24 | sing | 1.09Å | 1.10Å | |
| C6 | H25 | sing | 1.09Å | 1.10Å | |
| C6 | H26 | sing | 1.09Å | 1.10Å | |
| C6 | H27 | sing | 1.09Å | 1.10Å | |
| C4 | H28 | sing | 1.09Å | 1.10Å | |
| C4 | H29 | sing | 1.09Å | 1.10Å | |
| C3 | H30 | sing | 1.09Å | 1.10Å | |
| C3 | H31 | sing | 1.09Å | 1.10Å | |
| C2 | H32 | sing | 1.09Å | 1.10Å | |
| C2 | H33 | sing | 1.09Å | 1.10Å | |
| C1 | H34 | sing | 1.09Å | 1.10Å | |
| O4 | H35 | sing | 0.97Å | 0.95Å | |
| C5 | H36 | sing | 1.09Å | 1.10Å | |
| C5 | H37 | sing | 1.09Å | 1.10Å | |
| C5 | H38 | sing | 1.09Å | 1.10Å | |
| C8 | H39 | sing | 1.09Å | 1.10Å | |
| C8 | H40 | sing | 1.09Å | 1.10Å | |
| C8 | H41 | sing | 1.09Å | 1.10Å | |
| C11 | H42 | sing | 1.09Å | 1.10Å | |
| C11 | H43 | sing | 1.09Å | 1.10Å | |
| C11 | H44 | sing | 1.09Å | 1.10Å | |
| C14 | H45 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C11 | C27 | C29 | 120.9° | 117.7° |
| C11 | C27 | C26 | 118.1° | 117.2° |
| C27 | C11 | H42 | 109.5° | 109.5° |
| C27 | C11 | H43 | 109.5° | 109.5° |
| C27 | C11 | H44 | 109.5° | 109.5° |
| C8 | C29 | C27 | 110.2° | 108.6° |
| C8 | C29 | C17 | 111.8° | 108.8° |
| C8 | C29 | H2 | 107.6° | 107.4° |
| C29 | C8 | H39 | 109.5° | 109.5° |
| C29 | C8 | H40 | 109.5° | 109.5° |
| C29 | C8 | H41 | 109.5° | 109.5° |
| C29 | C27 | C26 | 121.0° | 125.1° |
| C27 | C29 | C17 | 111.8° | 116.2° |
| C27 | C29 | H2 | 107.8° | 107.7° |
| C27 | C26 | C24 | 123.2° | 117.2° |
| C27 | C26 | H7 | 118.4° | 120.9° |
| C29 | C17 | C12 | 116.5° | 111.9° |
| C17 | C29 | H2 | 107.4° | 107.8° |
| C29 | C17 | H3 | 107.7° | 107.9° |
| C29 | C17 | H4 | 107.7° | 110.8° |
| O14 | C10 | N11 | 122.1° | 121.1° |
| O14 | C10 | C9 | 123.4° | 128.3° |
| C10 | N11 | C12 | 105.3° | 107.9° |
| N11 | C10 | C9 | 114.4° | 110.6° |
| C10 | N11 | H6 | 127.3° | 125.6° |
| N11 | C12 | C17 | 104.9° | 107.6° |
| N11 | C12 | C24 | 117.2° | 110.2° |
| N11 | C12 | C13 | 107.7° | 106.0° |
| C12 | N11 | H6 | 127.4° | 126.5° |
| C26 | C24 | C12 | 111.1° | 109.1° |
| C26 | C24 | C22 | 105.5° | 114.7° |
| C26 | C24 | C5 | 106.3° | 105.4° |
| C24 | C26 | H7 | 118.4° | 121.9° |
| C10 | C9 | C13 | 99.1° | 108.1° |
| C10 | C9 | C7 | 138.0° | 128.7° |
| C17 | C12 | C24 | 104.5° | 108.8° |
| C17 | C12 | C13 | 101.0° | 112.5° |
| C12 | C17 | H3 | 107.7° | 107.7° |
| C12 | C17 | H4 | 107.7° | 111.4° |
| C24 | C12 | C13 | 119.1° | 111.5° |
| C12 | C24 | C22 | 109.4° | 113.5° |
| C12 | C24 | C5 | 114.7° | 107.2° |
| C12 | C13 | C9 | 112.2° | 106.4° |
| C12 | C13 | O16 | 128.1° | 127.6° |
| C22 | C24 | C5 | 109.4° | 106.4° |
| C24 | C22 | C20 | 119.1° | 121.6° |
| C24 | C22 | H8 | 107.0° | 109.1° |
| C24 | C22 | H9 | 107.0° | 105.3° |
| C24 | C5 | H36 | 109.5° | 109.5° |
| C24 | C5 | H37 | 109.5° | 109.5° |
| C24 | C5 | H38 | 109.4° | 109.5° |
| C22 | C20 | C19 | 113.5° | 112.8° |
| C22 | C20 | C21 | 110.3° | 116.6° |
| C20 | C22 | H8 | 107.0° | 111.6° |
| C20 | C22 | H9 | 107.0° | 105.8° |
| C22 | C20 | H10 | 107.7° | 106.7° |
| C6 | CG | CD2 | 111.0° | 109.8° |
| C6 | CG | C7 | 110.6° | 108.5° |
| C6 | CG | C14 | 108.2° | 108.4° |
| CG | C6 | H25 | 109.5° | 109.5° |
| CG | C6 | H26 | 109.5° | 109.5° |
| CG | C6 | H27 | 109.4° | 109.5° |
| O4 | C19 | C20 | 108.8° | 108.8° |
| O4 | C19 | C18 | 108.5° | 109.3° |
| O4 | C19 | H16 | 108.6° | 108.4° |
| C19 | O4 | H35 | 109.5° | 114.0° |
| C13 | C9 | C7 | 122.5° | 122.9° |
| C9 | C13 | O16 | 118.9° | 126.0° |
| C9 | C7 | CG | 121.5° | 119.4° |
| C9 | C7 | O8 | 116.0° | 118.8° |
| C20 | C19 | C18 | 116.1° | 112.9° |
| C19 | C20 | C21 | 109.4° | 109.2° |
| C19 | C20 | H10 | 107.8° | 105.1° |
| C20 | C19 | H16 | 107.3° | 108.4° |
| C19 | C18 | CD2 | 112.0° | 111.0° |
| C18 | C19 | H16 | 107.2° | 109.0° |
| C19 | C18 | H17 | 108.8° | 111.1° |
| C19 | C18 | H18 | 108.8° | 107.9° |
| C13 | O16 | H5 | 109.5° | 117.0° |
| CE2 | CD2 | CG | 109.1° | 110.5° |
| CE2 | CD2 | C18 | 111.8° | 106.7° |
| CD2 | CE2 | CZ | 121.3° | 112.6° |
| CE2 | CD2 | H19 | 106.6° | 110.1° |
| CD2 | CE2 | H20 | 106.4° | 108.9° |
| CD2 | CE2 | H21 | 106.4° | 108.8° |
| CG | CD2 | C18 | 116.3° | 109.7° |
| CD2 | CG | C7 | 106.2° | 108.7° |
| CD2 | CG | C14 | 111.4° | 109.2° |
| CG | CD2 | H19 | 106.3° | 110.1° |
| CD2 | C18 | H17 | 108.8° | 111.3° |
| CD2 | C18 | H18 | 108.9° | 107.5° |
| C18 | CD2 | H19 | 106.2° | 109.6° |
| CE2 | CZ | CE1 | 120.2° | 110.7° |
| CZ | CE2 | H20 | 106.4° | 109.2° |
| CZ | CE2 | H21 | 106.4° | 109.1° |
| CE2 | CZ | H22 | 106.7° | 108.9° |
| CE2 | CZ | H23 | 106.7° | 109.8° |
| C20 | C21 | C23 | 113.4° | 109.5° |
| C21 | C20 | H10 | 107.9° | 105.6° |
| C20 | C21 | H11 | 108.5° | 109.5° |
| C20 | C21 | H12 | 108.5° | 109.5° |
| C7 | CG | C14 | 109.5° | 112.1° |
| CG | C7 | O8 | 121.7° | 121.8° |
| CG | C14 | CE1 | 112.9° | 109.0° |
| CG | C14 | C4 | 114.4° | 113.7° |
| CG | C14 | H45 | 107.3° | 109.3° |
| C23 | C21 | H11 | 108.5° | 109.5° |
| C23 | C21 | H12 | 108.5° | 109.5° |
| C21 | C23 | H13 | 109.5° | 109.5° |
| C21 | C23 | H14 | 109.4° | 109.4° |
| C21 | C23 | H15 | 109.5° | 109.5° |
| CZ | CE1 | C14 | 109.4° | 110.9° |
| CZ | CE1 | C1 | 110.4° | 111.5° |
| CE1 | CZ | H22 | 106.7° | 109.3° |
| CE1 | CZ | H23 | 106.7° | 109.9° |
| CZ | CE1 | H24 | 109.3° | 110.0° |
| C14 | CE1 | C1 | 109.9° | 108.0° |
| CE1 | C14 | C4 | 107.2° | 107.5° |
| C14 | CE1 | H24 | 109.0° | 109.2° |
| CE1 | C14 | H45 | 107.4° | 108.0° |
| CE1 | C1 | O5 | 111.1° | 109.5° |
| CE1 | C1 | C2 | 112.2° | 108.1° |
| C1 | CE1 | H24 | 108.9° | 107.2° |
| CE1 | C1 | H34 | 108.4° | 109.8° |
| C14 | C4 | C3 | 108.8° | 108.4° |
| C14 | C4 | H28 | 109.7° | 111.3° |
| C14 | C4 | H29 | 109.7° | 110.0° |
| C4 | C14 | H45 | 107.3° | 109.2° |
| C4 | C3 | C2 | 111.5° | 110.1° |
| C3 | C4 | H28 | 109.7° | 108.4° |
| C3 | C4 | H29 | 109.6° | 109.0° |
| C4 | C3 | H30 | 108.9° | 109.1° |
| C4 | C3 | H31 | 109.0° | 109.2° |
| O5 | C1 | C2 | 106.6° | 109.4° |
| C1 | O5 | H1 | 109.5° | 114.0° |
| O5 | C1 | H34 | 109.9° | 110.1° |
| C1 | C2 | C3 | 111.9° | 110.4° |
| C1 | C2 | H32 | 108.9° | 109.1° |
| C1 | C2 | H33 | 108.9° | 109.3° |
| C2 | C1 | H34 | 108.6° | 109.9° |
| C2 | C3 | H30 | 109.0° | 109.4° |
| C2 | C3 | H31 | 108.9° | 109.5° |
| C3 | C2 | H32 | 108.9° | 109.3° |
| C3 | C2 | H33 | 108.9° | 109.5° |
| H3 | C17 | H4 | 109.5° | 106.8° |
| H8 | C22 | H9 | 109.5° | 101.2° |
| H11 | C21 | H12 | 109.5° | 109.5° |
| H13 | C23 | H14 | 109.4° | 109.5° |
| H13 | C23 | H15 | 109.5° | 109.4° |
| H14 | C23 | H15 | 109.5° | 109.5° |
| H17 | C18 | H18 | 109.5° | 107.8° |
| H20 | CE2 | H21 | 109.5° | 108.2° |
| H22 | CZ | H23 | 109.5° | 108.2° |
| H25 | C6 | H26 | 109.4° | 109.5° |
| H25 | C6 | H27 | 109.5° | 109.5° |
| H26 | C6 | H27 | 109.5° | 109.4° |
| H28 | C4 | H29 | 109.4° | 109.8° |
| H30 | C3 | H31 | 109.5° | 109.5° |
| H32 | C2 | H33 | 109.5° | 109.2° |
| H36 | C5 | H37 | 109.5° | 109.5° |
| H36 | C5 | H38 | 109.5° | 109.4° |
| H37 | C5 | H38 | 109.5° | 109.5° |
| H39 | C8 | H40 | 109.5° | 109.5° |
| H39 | C8 | H41 | 109.5° | 109.5° |
| H40 | C8 | H41 | 109.5° | 109.5° |
| H42 | C11 | H43 | 109.4° | 109.5° |
| H42 | C11 | H44 | 109.5° | 109.4° |
| H43 | C11 | H44 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C11 | C27 | C29 | C8 | 44.4° | 41.2° |
| C11 | C27 | C29 | C26 | 179.5° | 179.9° |
| C11 | C27 | C29 | C17 | 169.3° | 164.2° |
| C11 | C27 | C26 | C24 | 170.1° | 178.8° |
| C11 | C27 | C29 | H2 | 72.8° | 74.8° |
| C11 | C27 | C26 | H7 | 9.9° | 2.8° |
| C27 | C11 | H42 | H43 | 120.0° | 120.0° |
| C27 | C11 | H42 | H44 | 120.0° | 120.0° |
| C27 | C11 | H43 | H44 | 120.0° | 120.0° |
| C8 | C29 | C27 | C17 | 125.0° | 123.0° |
| C8 | C29 | C27 | H2 | 117.2° | 116.0° |
| C8 | C29 | C27 | C26 | 136.1° | 138.7° |
| C8 | C29 | C17 | H2 | 117.8° | 116.1° |
| C8 | C29 | C17 | C12 | 99.1° | 111.0° |
| C8 | C29 | C17 | H3 | 21.9° | 7.4° |
| C8 | C29 | C17 | H4 | 139.9° | 124.0° |
| C29 | C8 | H39 | H40 | 120.0° | 120.0° |
| C29 | C8 | H39 | H41 | 120.0° | 120.0° |
| C29 | C8 | H40 | H41 | 120.0° | 120.0° |
| C27 | C29 | C17 | H2 | 118.1° | 120.9° |
| C29 | C27 | C26 | C24 | 10.4° | 1.1° |
| C27 | C29 | C17 | C12 | 25.0° | 11.9° |
| C27 | C29 | C17 | H3 | 146.0° | 130.3° |
| C27 | C29 | C17 | H4 | 96.1° | 113.1° |
| C29 | C27 | C26 | H7 | 169.6° | 177.3° |
| C27 | C29 | C8 | H39 | 180.0° | 60.0° |
| C27 | C29 | C8 | H40 | 60.0° | 180.0° |
| C27 | C29 | C8 | H41 | 60.0° | 60.0° |
| C29 | C27 | C11 | H42 | 180.0° | 89.9° |
| C29 | C27 | C11 | H43 | 60.0° | 150.0° |
| C29 | C27 | C11 | H44 | 60.0° | 30.0° |
| C26 | C27 | C29 | C17 | 11.2° | 15.7° |
| C27 | C26 | C24 | H7 | 180.0° | 178.4° |
| C27 | C26 | C24 | C12 | 27.5° | 38.8° |
| C27 | C26 | C24 | C22 | 145.9° | 167.4° |
| C27 | C26 | C24 | C5 | 98.0° | 76.0° |
| C26 | C27 | C29 | H2 | 106.7° | 105.3° |
| C26 | C27 | C11 | H42 | 0.5° | 90.0° |
| C26 | C27 | C11 | H43 | 119.5° | 30.1° |
| C26 | C27 | C11 | H44 | 120.5° | 150.0° |
| C29 | C17 | C12 | N11 | 64.7° | 69.7° |
| C29 | C17 | C12 | H3 | 121.0° | 118.5° |
| C29 | C17 | C12 | H4 | 121.1° | 124.7° |
| C29 | C17 | C12 | C24 | 59.2° | 49.7° |
| C29 | C17 | C12 | C13 | 176.6° | 173.8° |
| C29 | C17 | H3 | H4 | 116.8° | 119.2° |
| C17 | C29 | C8 | H39 | 55.0° | 172.6° |
| C17 | C29 | C8 | H40 | 65.0° | 52.6° |
| C17 | C29 | C8 | H41 | 175.0° | 67.4° |
| O14 | C10 | N11 | C9 | 177.3° | 179.6° |
| O14 | C10 | N11 | C12 | 174.2° | 176.2° |
| O14 | C10 | C9 | C13 | 179.4° | 177.3° |
| O14 | C10 | C9 | C7 | 8.5° | 8.3° |
| O14 | C10 | N11 | H6 | 5.7° | 4.7° |
| C10 | N11 | C12 | H6 | 180.0° | 179.1° |
| C10 | N11 | C12 | C17 | 118.3° | 129.2° |
| C10 | N11 | C12 | C24 | 126.3° | 112.3° |
| C10 | N11 | C12 | C13 | 11.3° | 8.6° |
| N11 | C10 | C9 | C13 | 2.1° | 2.3° |
| N11 | C10 | C9 | C7 | 174.2° | 172.1° |
| N11 | C12 | C24 | C26 | 57.7° | 53.8° |
| C12 | N11 | C10 | C9 | 8.4° | 4.1° |
| N11 | C12 | C17 | C24 | 123.9° | 119.4° |
| N11 | C12 | C17 | C13 | 111.9° | 116.5° |
| N11 | C12 | C24 | C13 | 132.7° | 117.5° |
| N11 | C12 | C24 | C22 | 58.3° | 75.4° |
| N11 | C12 | C24 | C5 | 178.4° | 167.5° |
| N11 | C12 | C13 | C9 | 10.8° | 9.8° |
| N11 | C12 | C13 | O16 | 179.6° | 169.7° |
| N11 | C12 | C17 | H3 | 56.3° | 48.8° |
| N11 | C12 | C17 | H4 | 174.3° | 165.6° |
| C26 | C24 | C12 | C17 | 57.9° | 64.0° |
| C26 | C24 | C12 | C22 | 116.1° | 129.2° |
| C26 | C24 | C12 | C5 | 120.6° | 113.6° |
| C26 | C24 | C12 | C13 | 169.6° | 171.3° |
| C26 | C24 | C22 | C5 | 114.0° | 116.1° |
| C26 | C24 | C22 | C20 | 178.2° | 40.2° |
| C26 | C24 | C22 | H8 | 56.9° | 172.3° |
| C26 | C24 | C22 | H9 | 60.4° | 79.8° |
| C26 | C24 | C5 | H36 | 180.0° | 56.2° |
| C26 | C24 | C5 | H37 | 60.0° | 63.9° |
| C26 | C24 | C5 | H38 | 60.0° | 176.1° |
| C10 | C9 | C13 | C12 | 5.4° | 7.5° |
| C10 | C9 | C13 | C7 | 173.8° | 174.8° |
| C10 | C9 | C13 | O16 | 176.0° | 172.1° |
| C10 | C9 | C7 | CG | 15.5° | 19.8° |
| C10 | C9 | C7 | O8 | 174.7° | 161.2° |
| C9 | C10 | N11 | H6 | 171.6° | 175.0° |
| C17 | C12 | C24 | C13 | 111.7° | 124.7° |
| C17 | C12 | C24 | C22 | 173.9° | 166.8° |
| C17 | C12 | C24 | C5 | 62.8° | 49.6° |
| C17 | C12 | C13 | C9 | 120.5° | 127.3° |
| C17 | C12 | C13 | O16 | 69.9° | 52.3° |
| C12 | C17 | C29 | H2 | 143.1° | 132.8° |
| C12 | C17 | H3 | H4 | 116.8° | 119.8° |
| C17 | C12 | N11 | H6 | 61.7° | 49.9° |
| C12 | C24 | C22 | C5 | 126.4° | 117.6° |
| C12 | C24 | C22 | C20 | 62.2° | 86.1° |
| C24 | C12 | C13 | C9 | 125.9° | 110.2° |
| C24 | C12 | C13 | O16 | 43.7° | 70.3° |
| C24 | C12 | C17 | H3 | 179.8° | 168.2° |
| C24 | C12 | C17 | H4 | 61.9° | 74.9° |
| C24 | C12 | N11 | H6 | 53.7° | 68.6° |
| C12 | C24 | C26 | H7 | 152.5° | 142.8° |
| C12 | C24 | C22 | H8 | 176.4° | 46.0° |
| C12 | C24 | C22 | H9 | 59.2° | 153.9° |
| C12 | C24 | C5 | H36 | 56.8° | 59.9° |
| C12 | C24 | C5 | H37 | 63.2° | 180.0° |
| C12 | C24 | C5 | H38 | 176.8° | 60.0° |
| C13 | C12 | C24 | C22 | 74.3° | 42.1° |
| C13 | C12 | C24 | C5 | 49.0° | 75.0° |
| C12 | C13 | C9 | O16 | 170.7° | 179.6° |
| C12 | C13 | C9 | C7 | 168.4° | 167.3° |
| C13 | C12 | C17 | H3 | 55.6° | 67.7° |
| C13 | C12 | C17 | H4 | 62.4° | 49.2° |
| C12 | C13 | O16 | H5 | 173.1° | 180.0° |
| C13 | C12 | N11 | H6 | 168.7° | 170.5° |
| C24 | C22 | C20 | H8 | 121.4° | 131.1° |
| C24 | C22 | C20 | H9 | 121.4° | 119.7° |
| C24 | C22 | C20 | C19 | 113.2° | 141.9° |
| C24 | C22 | C20 | C21 | 123.6° | 14.4° |
| C22 | C24 | C26 | H7 | 34.1° | 14.2° |
| C24 | C22 | H8 | H9 | 115.6° | 110.6° |
| C24 | C22 | C20 | H10 | 6.1° | 103.2° |
| C22 | C24 | C5 | H36 | 66.5° | 178.3° |
| C22 | C24 | C5 | H37 | 173.5° | 58.3° |
| C22 | C24 | C5 | H38 | 53.5° | 61.7° |
| C5 | C24 | C22 | C20 | 64.2° | 156.3° |
| C5 | C24 | C26 | H7 | 82.0° | 102.4° |
| C5 | C24 | C22 | H8 | 57.1° | 71.6° |
| C5 | C24 | C22 | H9 | 174.4° | 36.3° |
| C24 | C5 | H36 | H37 | 120.0° | 120.0° |
| C24 | C5 | H36 | H38 | 120.0° | 120.0° |
| C24 | C5 | H37 | H38 | 120.0° | 120.0° |
| C22 | C20 | C19 | O4 | 88.6° | 83.2° |
| C22 | C20 | C19 | C21 | 123.7° | 131.4° |
| C22 | C20 | C19 | H10 | 119.2° | 115.8° |
| C22 | C20 | C19 | C18 | 148.7° | 38.3° |
| C22 | C20 | C21 | H10 | 117.4° | 118.3° |
| C22 | C20 | C21 | C23 | 71.7° | 173.2° |
| C20 | C22 | H8 | H9 | 115.6° | 112.2° |
| C22 | C20 | C21 | H11 | 48.9° | 53.1° |
| C22 | C20 | C21 | H12 | 167.7° | 66.8° |
| C22 | C20 | C19 | H16 | 28.8° | 159.1° |
| C6 | CG | C7 | C9 | 69.2° | 71.4° |
| C6 | CG | CD2 | CE2 | 72.8° | 95.7° |
| C6 | CG | CD2 | C7 | 120.2° | 118.6° |
| C6 | CG | CD2 | C14 | 120.7° | 118.8° |
| C6 | CG | CD2 | C18 | 159.8° | 146.9° |
| C6 | CG | C7 | C14 | 119.1° | 119.7° |
| C6 | CG | C7 | O8 | 121.6° | 109.6° |
| C6 | CG | C14 | CE1 | 66.4° | 50.6° |
| C6 | CG | C14 | C4 | 56.6° | 69.3° |
| C6 | CG | CD2 | H19 | 41.8° | 26.2° |
| CG | C6 | H25 | H26 | 120.0° | 120.0° |
| CG | C6 | H25 | H27 | 120.0° | 120.0° |
| CG | C6 | H26 | H27 | 120.0° | 120.0° |
| C6 | CG | C14 | H45 | 175.5° | 168.4° |
| O4 | C19 | C20 | C18 | 122.8° | 121.5° |
| O4 | C19 | C20 | H16 | 117.4° | 117.7° |
| O4 | C19 | C18 | H16 | 117.2° | 118.2° |
| O4 | C19 | C18 | CD2 | 98.0° | 124.2° |
| O4 | C19 | C20 | C21 | 35.1° | 145.4° |
| O4 | C19 | C20 | H10 | 152.3° | 32.6° |
| O4 | C19 | C18 | H17 | 141.6° | 111.4° |
| O4 | C19 | C18 | H18 | 22.4° | 6.6° |
| C13 | C9 | C7 | CG | 155.3° | 153.8° |
| C13 | C9 | C7 | O8 | 14.5° | 25.2° |
| C9 | C13 | O16 | H5 | 4.2° | 0.5° |
| C7 | C9 | C13 | O16 | 2.2° | 13.2° |
| C9 | C7 | CG | CD2 | 51.3° | 48.0° |
| C9 | C7 | CG | O8 | 169.2° | 179.0° |
| C9 | C7 | CG | C14 | 171.7° | 168.8° |
| C20 | C19 | C18 | H16 | 119.9° | 120.5° |
| C20 | C19 | C18 | CD2 | 139.0° | 114.5° |
| C19 | C20 | C21 | H10 | 117.1° | 112.5° |
| C19 | C20 | C21 | C23 | 162.8° | 57.6° |
| C19 | C20 | C22 | H8 | 125.5° | 10.9° |
| C19 | C20 | C22 | H9 | 8.2° | 98.3° |
| C19 | C20 | C21 | H11 | 76.6° | 177.6° |
| C19 | C20 | C21 | H12 | 42.2° | 62.4° |
| C20 | C19 | C18 | H17 | 18.7° | 9.9° |
| C20 | C19 | C18 | H18 | 100.6° | 127.9° |
| C20 | C19 | O4 | H35 | 180.0° | 180.0° |
| C19 | C18 | CD2 | CE2 | 114.7° | 74.4° |
| C19 | C18 | CD2 | CG | 119.1° | 165.9° |
| C19 | C18 | CD2 | H17 | 120.3° | 124.3° |
| C19 | C18 | CD2 | H18 | 120.4° | 117.8° |
| C18 | C19 | C20 | C21 | 87.7° | 93.1° |
| C18 | C19 | C20 | H10 | 29.5° | 154.1° |
| C19 | C18 | H17 | H18 | 118.8° | 118.1° |
| C19 | C18 | CD2 | H19 | 1.1° | 44.8° |
| C18 | C19 | O4 | H35 | 52.8° | 56.3° |
| CE2 | CD2 | CG | C18 | 127.5° | 117.4° |
| CE2 | CD2 | CG | H19 | 114.6° | 121.9° |
| CE2 | CD2 | C18 | H19 | 115.9° | 119.2° |
| CD2 | CE2 | CZ | H20 | 121.6° | 121.1° |
| CD2 | CE2 | CZ | H21 | 121.6° | 120.8° |
| CE2 | CD2 | CG | C7 | 167.0° | 145.7° |
| CE2 | CD2 | CG | C14 | 47.9° | 23.1° |
| CD2 | CE2 | CZ | CE1 | 39.3° | 61.5° |
| CE2 | CD2 | C18 | H17 | 124.9° | 161.3° |
| CE2 | CD2 | C18 | H18 | 5.6° | 43.5° |
| CD2 | CE2 | H20 | H21 | 114.6° | 118.0° |
| CD2 | CE2 | CZ | H22 | 82.3° | 178.3° |
| CD2 | CE2 | CZ | H23 | 160.7° | 60.0° |
| CG | CD2 | C18 | H19 | 118.0° | 121.0° |
| CG | CD2 | CE2 | CZ | 41.3° | 40.0° |
| CD2 | CG | C7 | C14 | 120.4° | 120.8° |
| CD2 | CG | C7 | O8 | 117.9° | 131.0° |
| CD2 | CG | C14 | CE1 | 55.9° | 69.1° |
| CD2 | CG | C14 | C4 | 178.9° | 171.1° |
| CG | CD2 | C18 | H17 | 1.2° | 41.6° |
| CG | CD2 | C18 | H18 | 120.5° | 76.3° |
| CG | CD2 | CE2 | H20 | 163.0° | 81.2° |
| CG | CD2 | CE2 | H21 | 80.3° | 161.1° |
| CD2 | CG | C6 | H25 | 180.0° | 166.6° |
| CD2 | CG | C6 | H26 | 60.0° | 46.6° |
| CD2 | CG | C6 | H27 | 60.0° | 73.3° |
| CD2 | CG | C14 | H45 | 62.2° | 48.7° |
| C18 | CD2 | CE2 | CZ | 88.6° | 159.3° |
| C18 | CD2 | CG | C7 | 39.5° | 28.3° |
| C18 | CD2 | CG | C14 | 79.6° | 94.3° |
| CD2 | C18 | C19 | H16 | 19.2° | 5.9° |
| CD2 | C18 | H17 | H18 | 118.9° | 117.7° |
| C18 | CD2 | CE2 | H20 | 33.0° | 38.0° |
| C18 | CD2 | CE2 | H21 | 149.7° | 79.7° |
| CE2 | CZ | CE1 | H22 | 121.5° | 120.0° |
| CE2 | CZ | CE1 | H23 | 121.5° | 121.4° |
| CE2 | CZ | CE1 | C14 | 40.7° | 14.9° |
| CE2 | CZ | CE1 | C1 | 161.7° | 105.4° |
| CZ | CE2 | CD2 | H19 | 155.7° | 81.9° |
| CZ | CE2 | H20 | H21 | 114.7° | 118.6° |
| CE2 | CZ | H22 | H23 | 115.1° | 119.3° |
| CE2 | CZ | CE1 | H24 | 78.6° | 135.8° |
| C20 | C21 | C23 | H11 | 120.6° | 120.0° |
| C20 | C21 | C23 | H12 | 120.6° | 120.0° |
| C21 | C20 | C22 | H8 | 2.3° | 116.6° |
| C21 | C20 | C22 | H9 | 115.0° | 134.1° |
| C20 | C21 | H11 | H12 | 118.3° | 120.0° |
| C20 | C21 | C23 | H13 | 180.0° | 66.7° |
| C20 | C21 | C23 | H14 | 60.0° | 53.3° |
| C20 | C21 | C23 | H15 | 60.0° | 173.3° |
| C21 | C20 | C19 | H16 | 152.5° | 27.8° |
| C7 | CG | C14 | CE1 | 173.0° | 170.4° |
| C7 | CG | C14 | C4 | 64.0° | 50.5° |
| C7 | CG | CD2 | H19 | 78.4° | 92.4° |
| C7 | CG | C6 | H25 | 62.4° | 74.6° |
| C7 | CG | C6 | H26 | 177.6° | 165.4° |
| C7 | CG | C6 | H27 | 57.6° | 45.4° |
| C7 | CG | C14 | H45 | 54.9° | 71.8° |
| C14 | CG | C7 | O8 | 2.5° | 10.1° |
| CG | C14 | CE1 | CZ | 48.6° | 47.6° |
| CG | C14 | CE1 | C4 | 126.9° | 123.7° |
| CG | C14 | CE1 | H45 | 118.0° | 118.6° |
| CG | C14 | CE1 | C1 | 170.0° | 170.0° |
| CG | C14 | C4 | H45 | 118.9° | 122.4° |
| CG | C14 | C4 | C3 | 168.7° | 175.7° |
| C14 | CG | CD2 | H19 | 162.5° | 145.0° |
| CG | C14 | CE1 | H24 | 70.8° | 73.7° |
| C14 | CG | C6 | H25 | 57.4° | 47.4° |
| C14 | CG | C6 | H26 | 62.6° | 72.6° |
| C14 | CG | C6 | H27 | 177.5° | 167.4° |
| CG | C14 | C4 | H28 | 71.3° | 56.6° |
| CG | C14 | C4 | H29 | 48.9° | 65.2° |
| C23 | C21 | C20 | H10 | 45.7° | 54.9° |
| C23 | C21 | H11 | H12 | 118.2° | 120.0° |
| C21 | C23 | H13 | H14 | 120.0° | 120.0° |
| C21 | C23 | H13 | H15 | 120.0° | 120.0° |
| C21 | C23 | H14 | H15 | 120.0° | 120.0° |
| CZ | CE1 | C14 | C1 | 121.3° | 122.4° |
| CZ | CE1 | C14 | H24 | 119.4° | 121.4° |
| CZ | CE1 | C1 | H24 | 119.9° | 120.4° |
| CZ | CE1 | C14 | C4 | 175.6° | 171.3° |
| CZ | CE1 | C1 | O5 | 64.2° | 55.4° |
| CZ | CE1 | C1 | C2 | 176.6° | 174.5° |
| CE1 | CZ | CE2 | H20 | 160.9° | 59.6° |
| CE1 | CZ | CE2 | H21 | 82.4° | 177.7° |
| CE1 | CZ | H22 | H23 | 115.2° | 119.6° |
| CZ | CE1 | C1 | H34 | 56.7° | 65.6° |
| CZ | CE1 | C14 | H45 | 69.4° | 71.0° |
| C14 | CE1 | C1 | H24 | 119.3° | 117.5° |
| CE1 | C14 | C4 | H45 | 115.1° | 116.9° |
| CE1 | C14 | C4 | C3 | 65.2° | 63.6° |
| C14 | CE1 | C1 | O5 | 175.1° | 177.5° |
| C14 | CE1 | C1 | C2 | 55.8° | 63.5° |
| C14 | CE1 | CZ | H22 | 80.8° | 134.9° |
| C14 | CE1 | CZ | H23 | 162.2° | 106.5° |
| CE1 | C14 | C4 | H28 | 54.7° | 177.3° |
| CE1 | C14 | C4 | H29 | 174.9° | 55.5° |
| C14 | CE1 | C1 | H34 | 64.1° | 56.4° |
| C1 | CE1 | C14 | C4 | 63.1° | 66.3° |
| CE1 | C1 | O5 | C2 | 122.6° | 118.3° |
| CE1 | C1 | O5 | H34 | 120.0° | 120.8° |
| CE1 | C1 | C2 | H34 | 119.8° | 119.8° |
| CE1 | C1 | C2 | C3 | 49.2° | 59.2° |
| CE1 | C1 | O5 | H1 | 180.0° | 180.0° |
| C1 | CE1 | CZ | H22 | 40.2° | 14.6° |
| C1 | CE1 | CZ | H23 | 76.8° | 133.2° |
| CE1 | C1 | C2 | H32 | 169.6° | 60.9° |
| CE1 | C1 | C2 | H33 | 71.1° | 179.7° |
| C1 | CE1 | C14 | H45 | 52.0° | 51.4° |
| C14 | C4 | C3 | H28 | 119.9° | 120.9° |
| C14 | C4 | C3 | H29 | 119.9° | 119.7° |
| C14 | C4 | C3 | C2 | 59.9° | 59.5° |
| C4 | C14 | CE1 | H24 | 56.1° | 49.9° |
| C14 | C4 | H28 | H29 | 120.3° | 122.0° |
| C14 | C4 | C3 | H30 | 179.8° | 179.6° |
| C14 | C4 | C3 | H31 | 60.4° | 60.7° |
| C4 | C3 | C2 | C1 | 51.5° | 57.5° |
| C4 | C3 | C2 | H30 | 120.3° | 119.9° |
| C4 | C3 | C2 | H31 | 120.3° | 120.1° |
| C3 | C4 | H28 | H29 | 120.3° | 118.9° |
| C4 | C3 | H30 | H31 | 119.1° | 119.5° |
| C4 | C3 | C2 | H32 | 171.9° | 62.5° |
| C4 | C3 | C2 | H33 | 68.9° | 177.9° |
| C3 | C4 | C14 | H45 | 49.9° | 53.3° |
| O5 | C1 | C2 | H34 | 118.3° | 121.0° |
| O5 | C1 | C2 | C3 | 171.1° | 178.4° |
| O5 | C1 | CE1 | H24 | 55.8° | 65.0° |
| O5 | C1 | C2 | H32 | 68.5° | 58.3° |
| O5 | C1 | C2 | H33 | 50.8° | 61.1° |
| C1 | C2 | C3 | H32 | 120.3° | 120.0° |
| C1 | C2 | C3 | H33 | 120.4° | 120.4° |
| C2 | C1 | O5 | H1 | 57.5° | 61.7° |
| C2 | C1 | CE1 | H24 | 63.5° | 54.1° |
| C1 | C2 | C3 | H30 | 171.8° | 177.4° |
| C1 | C2 | C3 | H31 | 68.8° | 62.6° |
| C1 | C2 | H32 | H33 | 118.9° | 119.4° |
| C2 | C3 | C4 | H28 | 60.1° | 179.6° |
| C2 | C3 | C4 | H29 | 179.8° | 60.2° |
| C2 | C3 | H30 | H31 | 119.1° | 120.0° |
| C3 | C2 | H32 | H33 | 118.9° | 119.7° |
| C3 | C2 | C1 | H34 | 70.5° | 60.6° |
| H1 | O5 | C1 | H34 | 60.0° | 59.2° |
| H2 | C29 | C17 | H3 | 95.9° | 108.8° |
| H2 | C29 | C17 | H4 | 22.0° | 7.9° |
| H2 | C29 | C8 | H39 | 62.7° | 56.2° |
| H2 | C29 | C8 | H40 | 177.3° | 63.8° |
| H2 | C29 | C8 | H41 | 57.3° | 176.2° |
| H8 | C22 | C20 | H10 | 115.3° | 125.7° |
| H9 | C22 | C20 | H10 | 127.4° | 16.5° |
| H10 | C20 | C21 | H11 | 166.3° | 65.1° |
| H10 | C20 | C21 | H12 | 74.8° | 174.9° |
| H10 | C20 | C19 | H16 | 90.4° | 85.1° |
| H11 | C21 | C23 | H13 | 59.4° | 173.2° |
| H11 | C21 | C23 | H14 | 179.4° | 66.8° |
| H11 | C21 | C23 | H15 | 60.6° | 53.3° |
| H12 | C21 | C23 | H13 | 59.4° | 53.2° |
| H12 | C21 | C23 | H14 | 60.6° | 173.3° |
| H12 | C21 | C23 | H15 | 179.4° | 66.7° |
| H13 | C23 | H14 | H15 | 120.0° | 120.0° |
| H16 | C19 | C18 | H17 | 101.2° | 130.4° |
| H16 | C19 | C18 | H18 | 139.6° | 111.6° |
| H16 | C19 | O4 | H35 | 63.5° | 62.3° |
| H17 | C18 | CD2 | H19 | 119.2° | 79.5° |
| H18 | C18 | CD2 | H19 | 121.5° | 162.7° |
| H19 | CD2 | CE2 | H20 | 82.6° | 156.8° |
| H19 | CD2 | CE2 | H21 | 34.1° | 39.1° |
| H20 | CE2 | CZ | H22 | 39.4° | 60.6° |
| H20 | CE2 | CZ | H23 | 77.6° | 178.9° |
| H21 | CE2 | CZ | H22 | 156.1° | 57.4° |
| H21 | CE2 | CZ | H23 | 39.1° | 60.8° |
| H22 | CZ | CE1 | H24 | 159.9° | 104.2° |
| H23 | CZ | CE1 | H24 | 42.9° | 14.4° |
| H24 | CE1 | C1 | H34 | 176.6° | 174.0° |
| H24 | CE1 | C14 | H45 | 171.2° | 167.7° |
| H25 | C6 | H26 | H27 | 120.0° | 120.0° |
| H28 | C4 | C3 | H30 | 60.2° | 59.5° |
| H28 | C4 | C3 | H31 | 179.7° | 60.1° |
| H28 | C4 | C14 | H45 | 169.8° | 65.7° |
| H29 | C4 | C3 | H30 | 59.9° | 59.9° |
| H29 | C4 | C3 | H31 | 59.5° | 179.6° |
| H29 | C4 | C14 | H45 | 70.0° | 172.4° |
| H30 | C3 | C2 | H32 | 67.8° | 57.4° |
| H30 | C3 | C2 | H33 | 51.4° | 62.2° |
| H31 | C3 | C2 | H32 | 51.6° | 177.4° |
| H31 | C3 | C2 | H33 | 170.8° | 57.8° |
| H32 | C2 | C1 | H34 | 49.8° | 179.3° |
| H33 | C2 | C1 | H34 | 169.1° | 59.9° |
| H36 | C5 | H37 | H38 | 120.0° | 120.0° |
| H39 | C8 | H40 | H41 | 120.0° | 120.0° |
| H42 | C11 | H43 | H44 | 120.0° | 119.9° |
