N57
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | C16 | sing | 1.53Å | 1.53Å | |
| C16 | C15 | sing | 1.53Å | 1.54Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| C13 | C14 | sing | 1.53Å | 1.54Å | |
| C13 | C12 | sing | 1.53Å | 1.55Å | |
| C12 | C11 | sing | 1.53Å | 1.53Å | |
| C11 | C10 | sing | 1.53Å | 1.55Å | |
| C10 | C9 | sing | 1.53Å | 1.53Å | |
| C9 | C8 | sing | 1.53Å | 1.54Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C7 | C6 | sing | 1.53Å | 1.54Å | |
| C6 | C5 | sing | 1.53Å | 1.54Å | |
| O32 | C3 | sing | 1.43Å | 1.44Å | |
| C5 | C4 | sing | 1.53Å | 1.54Å | |
| C3 | C4 | sing | 1.53Å | 1.54Å | |
| C3 | C2 | sing | 1.53Å | 1.54Å | |
| C2 | O1 | sing | 1.43Å | 1.43Å | |
| C2 | C1 | sing | 1.53Å | 1.55Å | |
| OG3 | CG2 | sing | 1.43Å | 1.43Å | |
| OG4 | CG3 | sing | 1.43Å | 1.43Å | |
| N | C1 | sing | 1.47Å | 1.47Å | |
| CG3 | CG2 | sing | 1.53Å | 1.52Å | |
| CG3 | CG4 | sing | 1.53Å | 1.52Å | |
| C1 | C | sing | 1.53Å | 1.53Å | |
| CG2 | CG1 | sing | 1.53Å | 1.52Å | |
| OC1 | C | sing | 1.43Å | 1.43Å | |
| OC1 | CG1 | sing | 1.43Å | 1.44Å | |
| CG1 | OG | sing | 1.43Å | 1.46Å | |
| CG4 | OG5 | sing | 1.43Å | 1.44Å | |
| CG4 | CG | sing | 1.53Å | 1.53Å | |
| CG | OG | sing | 1.43Å | 1.45Å | |
| CG | CG5 | sing | 1.53Å | 1.54Å | |
| CG5 | OG6 | sing | 1.43Å | 1.44Å | |
| C17 | H1 | sing | 1.09Å | 1.10Å | |
| C17 | H2 | sing | 1.09Å | 1.10Å | |
| C17 | H3 | sing | 1.09Å | 1.10Å | |
| C16 | H4 | sing | 1.09Å | 1.10Å | |
| C16 | H5 | sing | 1.09Å | 1.10Å | |
| C15 | H6 | sing | 1.09Å | 1.10Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C14 | H8 | sing | 1.09Å | 1.10Å | |
| C14 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C11 | H14 | sing | 1.09Å | 1.10Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C10 | H16 | sing | 1.09Å | 1.10Å | |
| C10 | H17 | sing | 1.09Å | 1.10Å | |
| C9 | H18 | sing | 1.09Å | 1.10Å | |
| C9 | H19 | sing | 1.09Å | 1.10Å | |
| C8 | H20 | sing | 1.09Å | 1.10Å | |
| C8 | H21 | sing | 1.09Å | 1.10Å | |
| C7 | H22 | sing | 1.09Å | 1.10Å | |
| C7 | H23 | sing | 1.09Å | 1.10Å | |
| C6 | H24 | sing | 1.09Å | 1.10Å | |
| C6 | H25 | sing | 1.09Å | 1.10Å | |
| C5 | H26 | sing | 1.09Å | 1.10Å | |
| C5 | 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 | |
| O32 | H31 | sing | 0.97Å | 0.95Å | |
| C2 | H32 | sing | 1.09Å | 1.10Å | |
| O1 | H33 | sing | 0.97Å | 0.95Å | |
| C1 | H34 | sing | 1.09Å | 1.10Å | |
| N | H35 | sing | 1.01Å | 1.00Å | |
| N | H36 | sing | 1.01Å | 1.00Å | |
| C | H38 | sing | 1.09Å | 1.10Å | |
| C | H39 | sing | 1.09Å | 1.10Å | |
| CG1 | H40 | sing | 1.09Å | 1.10Å | |
| CG | H41 | sing | 1.09Å | 1.10Å | |
| CG5 | H42 | sing | 1.09Å | 1.10Å | |
| CG5 | H43 | sing | 1.09Å | 1.10Å | |
| OG6 | H44 | sing | 0.97Å | 0.95Å | |
| CG4 | H45 | sing | 1.09Å | 1.10Å | |
| OG5 | H46 | sing | 0.97Å | 0.95Å | |
| CG3 | H47 | sing | 1.09Å | 1.10Å | |
| OG4 | H48 | sing | 0.97Å | 0.95Å | |
| CG2 | H49 | sing | 1.09Å | 1.10Å | |
| OG3 | H50 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | C16 | C15 | 111.5° | 109.5° |
| C16 | C17 | H1 | 109.5° | 109.4° |
| C16 | C17 | H2 | 109.5° | 109.5° |
| C16 | C17 | H3 | 109.5° | 109.5° |
| C17 | C16 | H4 | 109.0° | 109.5° |
| C17 | C16 | H5 | 109.0° | 109.4° |
| C16 | C15 | C14 | 108.6° | 109.4° |
| C15 | C16 | H4 | 109.0° | 109.5° |
| C15 | C16 | H5 | 108.9° | 109.5° |
| C16 | C15 | H6 | 109.7° | 109.5° |
| C16 | C15 | H7 | 109.7° | 109.4° |
| C15 | C14 | C13 | 112.8° | 109.5° |
| C14 | C15 | H6 | 109.7° | 109.5° |
| C14 | C15 | H7 | 109.7° | 109.5° |
| C15 | C14 | H8 | 108.7° | 109.5° |
| C15 | C14 | H9 | 108.6° | 109.5° |
| C14 | C13 | C12 | 108.2° | 109.5° |
| C13 | C14 | H8 | 108.6° | 109.5° |
| C13 | C14 | H9 | 108.6° | 109.4° |
| C14 | C13 | H10 | 109.8° | 109.5° |
| C14 | C13 | H11 | 109.8° | 109.5° |
| C13 | C12 | C11 | 112.0° | 109.5° |
| C12 | C13 | H10 | 109.8° | 109.4° |
| C12 | C13 | H11 | 109.8° | 109.5° |
| C13 | C12 | H12 | 108.8° | 109.5° |
| C13 | C12 | H13 | 108.9° | 109.5° |
| C12 | C11 | C10 | 112.0° | 109.5° |
| C11 | C12 | H12 | 108.8° | 109.4° |
| C11 | C12 | H13 | 108.8° | 109.5° |
| C12 | C11 | H14 | 108.8° | 109.4° |
| C12 | C11 | H15 | 108.8° | 109.5° |
| C11 | C10 | C9 | 109.5° | 109.4° |
| C10 | C11 | H14 | 108.8° | 109.5° |
| C10 | C11 | H15 | 108.8° | 109.5° |
| C11 | C10 | H16 | 109.5° | 109.5° |
| C11 | C10 | H17 | 109.5° | 109.5° |
| C10 | C9 | C8 | 111.8° | 109.4° |
| C9 | C10 | H16 | 109.5° | 109.5° |
| C9 | C10 | H17 | 109.5° | 109.4° |
| C10 | C9 | H18 | 108.9° | 109.5° |
| C10 | C9 | H19 | 108.9° | 109.4° |
| C9 | C8 | C7 | 111.1° | 109.4° |
| C8 | C9 | H18 | 108.9° | 109.5° |
| C8 | C9 | H19 | 108.9° | 109.5° |
| C9 | C8 | H20 | 109.1° | 109.5° |
| C9 | C8 | H21 | 109.1° | 109.5° |
| C8 | C7 | C6 | 110.7° | 109.5° |
| C7 | C8 | H20 | 109.0° | 109.5° |
| C7 | C8 | H21 | 109.0° | 109.4° |
| C8 | C7 | H22 | 109.2° | 109.5° |
| C8 | C7 | H23 | 109.2° | 109.5° |
| C7 | C6 | C5 | 110.7° | 109.5° |
| C6 | C7 | H22 | 109.2° | 109.5° |
| C6 | C7 | H23 | 109.2° | 109.4° |
| C7 | C6 | H24 | 109.1° | 109.5° |
| C7 | C6 | H25 | 109.2° | 109.5° |
| C6 | C5 | C4 | 111.9° | 109.5° |
| C5 | C6 | H24 | 109.2° | 109.4° |
| C5 | C6 | H25 | 109.2° | 109.5° |
| C6 | C5 | H26 | 108.9° | 109.4° |
| C6 | C5 | H27 | 108.9° | 109.5° |
| O32 | C3 | C4 | 111.6° | 109.5° |
| O32 | C3 | C2 | 108.8° | 109.5° |
| O32 | C3 | H30 | 109.2° | 109.5° |
| C3 | O32 | H31 | 109.5° | 114.0° |
| C5 | C4 | C3 | 112.8° | 109.4° |
| C4 | C5 | H26 | 108.8° | 109.5° |
| C4 | C5 | H27 | 108.8° | 109.5° |
| C5 | C4 | H28 | 108.6° | 109.5° |
| C5 | C4 | H29 | 108.6° | 109.5° |
| C4 | C3 | C2 | 111.2° | 109.5° |
| C3 | C4 | H28 | 108.6° | 109.5° |
| C3 | C4 | H29 | 108.6° | 109.4° |
| C4 | C3 | H30 | 107.9° | 109.5° |
| C3 | C2 | O1 | 109.2° | 109.5° |
| C3 | C2 | C1 | 112.6° | 109.5° |
| C2 | C3 | H30 | 107.9° | 109.4° |
| C3 | C2 | H32 | 108.0° | 109.5° |
| O1 | C2 | C1 | 109.9° | 109.5° |
| O1 | C2 | H32 | 109.3° | 109.4° |
| C2 | O1 | H33 | 109.5° | 114.0° |
| C2 | C1 | N | 111.2° | 109.4° |
| C2 | C1 | C | 109.6° | 109.5° |
| C1 | C2 | H32 | 107.8° | 109.5° |
| C2 | C1 | H34 | 108.5° | 109.4° |
| OG3 | CG2 | CG3 | 109.4° | 109.5° |
| OG3 | CG2 | CG1 | 108.7° | 109.5° |
| OG3 | CG2 | H49 | 110.3° | 109.6° |
| CG2 | OG3 | H50 | 109.5° | 114.0° |
| OG4 | CG3 | CG2 | 108.9° | 109.6° |
| OG4 | CG3 | CG4 | 109.4° | 109.5° |
| OG4 | CG3 | H47 | 110.2° | 109.6° |
| CG3 | OG4 | H48 | 109.5° | 114.0° |
| N | C1 | C | 109.2° | 109.5° |
| N | C1 | H34 | 109.5° | 109.5° |
| C1 | N | H35 | 109.5° | 111.0° |
| C1 | N | H36 | 109.5° | 111.0° |
| CG2 | CG3 | CG4 | 110.5° | 109.0° |
| CG3 | CG2 | CG1 | 110.4° | 109.2° |
| CG2 | CG3 | H47 | 108.9° | 109.5° |
| CG3 | CG2 | H49 | 109.0° | 109.5° |
| CG3 | CG4 | OG5 | 109.7° | 109.5° |
| CG3 | CG4 | CG | 109.3° | 109.1° |
| CG3 | CG4 | H45 | 108.9° | 109.6° |
| CG4 | CG3 | H47 | 108.9° | 109.5° |
| C1 | C | OC1 | 109.4° | 109.4° |
| C | C1 | H34 | 108.7° | 109.5° |
| C1 | C | H38 | 109.5° | 109.4° |
| C1 | C | H39 | 109.5° | 109.5° |
| CG2 | CG1 | OC1 | 108.1° | 109.5° |
| CG2 | CG1 | OG | 110.0° | 109.4° |
| CG2 | CG1 | H40 | 107.9° | 109.5° |
| CG1 | CG2 | H49 | 109.1° | 109.5° |
| C | OC1 | CG1 | 113.0° | 114.0° |
| OC1 | C | H38 | 109.5° | 109.5° |
| OC1 | C | H39 | 109.5° | 109.5° |
| OC1 | CG1 | OG | 113.2° | 109.4° |
| OC1 | CG1 | H40 | 108.8° | 109.5° |
| CG1 | OG | CG | 113.2° | 114.1° |
| OG | CG1 | H40 | 108.6° | 109.5° |
| OG5 | CG4 | CG | 109.9° | 109.5° |
| OG5 | CG4 | H45 | 110.1° | 109.6° |
| CG4 | OG5 | H46 | 109.5° | 114.0° |
| CG4 | CG | OG | 109.7° | 109.5° |
| CG4 | CG | CG5 | 110.9° | 109.5° |
| CG4 | CG | H41 | 108.7° | 109.5° |
| CG | CG4 | H45 | 108.9° | 109.5° |
| OG | CG | CG5 | 109.4° | 109.4° |
| OG | CG | H41 | 109.7° | 109.5° |
| CG | CG5 | OG6 | 109.3° | 109.5° |
| CG5 | CG | H41 | 108.5° | 109.5° |
| CG | CG5 | H42 | 109.5° | 109.5° |
| CG | CG5 | H43 | 109.5° | 109.5° |
| OG6 | CG5 | H42 | 109.5° | 109.4° |
| OG6 | CG5 | H43 | 109.5° | 109.5° |
| CG5 | OG6 | H44 | 109.5° | 114.0° |
| H1 | C17 | H2 | 109.4° | 109.5° |
| H1 | C17 | H3 | 109.5° | 109.5° |
| H2 | C17 | H3 | 109.5° | 109.5° |
| H4 | C16 | H5 | 109.5° | 109.5° |
| H6 | C15 | H7 | 109.5° | 109.5° |
| H8 | C14 | H9 | 109.5° | 109.5° |
| H10 | C13 | H11 | 109.5° | 109.5° |
| H12 | C12 | H13 | 109.5° | 109.4° |
| H14 | C11 | H15 | 109.5° | 109.5° |
| H16 | C10 | H17 | 109.5° | 109.5° |
| H18 | C9 | H19 | 109.5° | 109.5° |
| H20 | C8 | H21 | 109.5° | 109.5° |
| H22 | C7 | H23 | 109.5° | 109.5° |
| H24 | C6 | H25 | 109.5° | 109.4° |
| H26 | C5 | H27 | 109.5° | 109.4° |
| H28 | C4 | H29 | 109.5° | 109.5° |
| H35 | N | H36 | 109.5° | 111.0° |
| H38 | C | H39 | 109.5° | 109.5° |
| H42 | CG5 | H43 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | C16 | C15 | H4 | 120.3° | 120.1° |
| C17 | C16 | C15 | H5 | 120.3° | 119.9° |
| C17 | C16 | C15 | C14 | 147.4° | 180.0° |
| C16 | C17 | H1 | H2 | 120.0° | 120.0° |
| C16 | C17 | H1 | H3 | 120.0° | 120.0° |
| C16 | C17 | H2 | H3 | 120.0° | 120.1° |
| C17 | C16 | H4 | H5 | 119.1° | 119.9° |
| C17 | C16 | C15 | H6 | 27.5° | 60.0° |
| C17 | C16 | C15 | H7 | 92.8° | 60.0° |
| C16 | C15 | C14 | H6 | 119.9° | 120.0° |
| C16 | C15 | C14 | H7 | 119.8° | 120.0° |
| C16 | C15 | C14 | C13 | 163.5° | 180.0° |
| C15 | C16 | C17 | H1 | 180.0° | 60.0° |
| C15 | C16 | C17 | H2 | 60.0° | 59.9° |
| C15 | C16 | C17 | H3 | 60.0° | 180.0° |
| C15 | C16 | H4 | H5 | 119.1° | 120.0° |
| C16 | C15 | H6 | H7 | 120.4° | 120.0° |
| C16 | C15 | C14 | H8 | 43.0° | 60.0° |
| C16 | C15 | C14 | H9 | 76.0° | 60.0° |
| C15 | C14 | C13 | H8 | 120.5° | 120.0° |
| C15 | C14 | C13 | H9 | 120.5° | 120.0° |
| C15 | C14 | C13 | C12 | 169.6° | 180.0° |
| C14 | C15 | C16 | H4 | 92.3° | 60.0° |
| C14 | C15 | C16 | H5 | 27.1° | 60.0° |
| C14 | C15 | H6 | H7 | 120.4° | 120.0° |
| C15 | C14 | H8 | H9 | 118.5° | 120.0° |
| C15 | C14 | C13 | H10 | 70.6° | 60.0° |
| C15 | C14 | C13 | H11 | 49.8° | 60.0° |
| C14 | C13 | C12 | H10 | 119.8° | 120.0° |
| C14 | C13 | C12 | H11 | 119.8° | 120.0° |
| C14 | C13 | C12 | C11 | 139.0° | 180.0° |
| C13 | C14 | C15 | H6 | 76.6° | 60.0° |
| C13 | C14 | C15 | H7 | 43.7° | 60.0° |
| C13 | C14 | H8 | H9 | 118.5° | 120.0° |
| C14 | C13 | H10 | H11 | 120.6° | 120.0° |
| C14 | C13 | C12 | H12 | 100.6° | 60.0° |
| C14 | C13 | C12 | H13 | 18.7° | 59.9° |
| C13 | C12 | C11 | H12 | 120.4° | 120.0° |
| C13 | C12 | C11 | H13 | 120.4° | 120.1° |
| C13 | C12 | C11 | C10 | 162.6° | 180.0° |
| C12 | C13 | C14 | H8 | 49.0° | 60.0° |
| C12 | C13 | C14 | H9 | 69.9° | 60.0° |
| C12 | C13 | H10 | H11 | 120.6° | 119.9° |
| C13 | C12 | H12 | H13 | 118.9° | 119.9° |
| C13 | C12 | C11 | H14 | 42.2° | 60.0° |
| C13 | C12 | C11 | H15 | 77.0° | 60.0° |
| C12 | C11 | C10 | H14 | 120.4° | 120.0° |
| C12 | C11 | C10 | H15 | 120.4° | 120.0° |
| C12 | C11 | C10 | C9 | 115.9° | 180.0° |
| C11 | C12 | C13 | H10 | 19.2° | 60.0° |
| C11 | C12 | C13 | H11 | 101.1° | 59.9° |
| C11 | C12 | H12 | H13 | 118.9° | 120.0° |
| C12 | C11 | H14 | H15 | 118.8° | 120.0° |
| C12 | C11 | C10 | H16 | 124.1° | 60.0° |
| C12 | C11 | C10 | H17 | 4.1° | 60.0° |
| C11 | C10 | C9 | H16 | 120.0° | 120.0° |
| C11 | C10 | C9 | H17 | 120.0° | 120.0° |
| C11 | C10 | C9 | C8 | 167.8° | 180.0° |
| C10 | C11 | C12 | H12 | 77.1° | 60.0° |
| C10 | C11 | C12 | H13 | 42.2° | 59.9° |
| C10 | C11 | H14 | H15 | 118.8° | 120.0° |
| C11 | C10 | H16 | H17 | 120.0° | 120.0° |
| C11 | C10 | C9 | H18 | 71.9° | 60.0° |
| C11 | C10 | C9 | H19 | 47.4° | 60.0° |
| C10 | C9 | C8 | H18 | 120.3° | 120.0° |
| C10 | C9 | C8 | H19 | 120.4° | 120.0° |
| C10 | C9 | C8 | C7 | 70.5° | 180.0° |
| C9 | C10 | C11 | H14 | 4.5° | 60.0° |
| C9 | C10 | C11 | H15 | 123.7° | 60.0° |
| C9 | C10 | H16 | H17 | 120.0° | 120.0° |
| C10 | C9 | H18 | H19 | 118.9° | 120.0° |
| C10 | C9 | C8 | H20 | 169.3° | 60.0° |
| C10 | C9 | C8 | H21 | 49.7° | 60.0° |
| C9 | C8 | C7 | H20 | 120.2° | 120.0° |
| C9 | C8 | C7 | H21 | 120.2° | 120.0° |
| C9 | C8 | C7 | C6 | 154.4° | 180.0° |
| C8 | C9 | C10 | H16 | 47.8° | 60.0° |
| C8 | C9 | C10 | H17 | 72.2° | 60.0° |
| C8 | C9 | H18 | H19 | 118.9° | 120.0° |
| C9 | C8 | H20 | H21 | 119.3° | 120.0° |
| C9 | C8 | C7 | H22 | 85.4° | 60.0° |
| C9 | C8 | C7 | H23 | 34.2° | 60.0° |
| C8 | C7 | C6 | H22 | 120.2° | 120.0° |
| C8 | C7 | C6 | H23 | 120.2° | 120.0° |
| C8 | C7 | C6 | C5 | 96.4° | 180.0° |
| C7 | C8 | C9 | H18 | 49.9° | 60.0° |
| C7 | C8 | C9 | H19 | 169.2° | 60.0° |
| C7 | C8 | H20 | H21 | 119.2° | 120.0° |
| C8 | C7 | H22 | H23 | 119.5° | 120.0° |
| C8 | C7 | C6 | H24 | 23.8° | 60.0° |
| C8 | C7 | C6 | H25 | 143.4° | 59.9° |
| C7 | C6 | C5 | H24 | 120.2° | 120.0° |
| C7 | C6 | C5 | H25 | 120.2° | 120.1° |
| C7 | C6 | C5 | C4 | 157.2° | 180.0° |
| C6 | C7 | C8 | H20 | 34.2° | 60.0° |
| C6 | C7 | C8 | H21 | 85.4° | 60.0° |
| C6 | C7 | H22 | H23 | 119.5° | 119.9° |
| C7 | C6 | H24 | H25 | 119.4° | 120.0° |
| C7 | C6 | C5 | H26 | 36.9° | 60.0° |
| C7 | C6 | C5 | H27 | 82.4° | 59.9° |
| C6 | C5 | C4 | H26 | 120.4° | 120.0° |
| C6 | C5 | C4 | H27 | 120.4° | 120.0° |
| C6 | C5 | C4 | C3 | 63.5° | 180.0° |
| C5 | C6 | C7 | H22 | 143.4° | 60.0° |
| C5 | C6 | C7 | H23 | 23.8° | 60.0° |
| C5 | C6 | H24 | H25 | 119.5° | 120.0° |
| C6 | C5 | H26 | H27 | 118.9° | 120.0° |
| C6 | C5 | C4 | H28 | 176.0° | 60.0° |
| C6 | C5 | C4 | H29 | 56.9° | 60.0° |
| O32 | C3 | C4 | C5 | 33.0° | 65.0° |
| O32 | C3 | C4 | C2 | 121.8° | 120.0° |
| O32 | C3 | C4 | H30 | 120.0° | 120.0° |
| O32 | C3 | C2 | H30 | 118.4° | 120.0° |
| O32 | C3 | C2 | O1 | 52.0° | 175.1° |
| O32 | C3 | C2 | C1 | 174.3° | 55.1° |
| O32 | C3 | C4 | H28 | 87.5° | 55.0° |
| O32 | C3 | C4 | H29 | 153.5° | 175.0° |
| O32 | C3 | C2 | H32 | 66.8° | 65.0° |
| C5 | C4 | C3 | H28 | 120.5° | 120.0° |
| C5 | C4 | C3 | H29 | 120.5° | 120.0° |
| C5 | C4 | C3 | C2 | 154.8° | 175.0° |
| C4 | C5 | C6 | H24 | 82.6° | 60.0° |
| C4 | C5 | C6 | H25 | 37.0° | 59.9° |
| C4 | C5 | H26 | H27 | 118.8° | 120.0° |
| C5 | C4 | H28 | H29 | 118.5° | 120.0° |
| C5 | C4 | C3 | H30 | 87.0° | 55.0° |
| C4 | C3 | C2 | H30 | 118.2° | 120.0° |
| C4 | C3 | C2 | O1 | 71.4° | 64.9° |
| C4 | C3 | C2 | C1 | 51.0° | 175.0° |
| C3 | C4 | C5 | H26 | 56.8° | 60.0° |
| C3 | C4 | C5 | H27 | 176.1° | 60.0° |
| C3 | C4 | H28 | H29 | 118.5° | 120.0° |
| C4 | C3 | O32 | H31 | 180.0° | 60.0° |
| C4 | C3 | C2 | H32 | 169.9° | 55.0° |
| C3 | C2 | O1 | C1 | 123.9° | 120.0° |
| C3 | C2 | O1 | H32 | 117.9° | 120.0° |
| C3 | C2 | C1 | H32 | 119.0° | 120.0° |
| C3 | C2 | C1 | N | 45.8° | 174.9° |
| C3 | C2 | C1 | C | 166.7° | 65.1° |
| C2 | C3 | C4 | H28 | 34.3° | 65.0° |
| C2 | C3 | C4 | H29 | 84.8° | 55.0° |
| C2 | C3 | O32 | H31 | 56.9° | 60.0° |
| C3 | C2 | O1 | H33 | 180.0° | 60.0° |
| C3 | C2 | C1 | H34 | 74.7° | 54.9° |
| O1 | C2 | C1 | H32 | 119.1° | 120.0° |
| O1 | C2 | C1 | N | 167.7° | 65.1° |
| O1 | C2 | C1 | C | 71.4° | 55.0° |
| O1 | C2 | C3 | H30 | 170.4° | 55.1° |
| O1 | C2 | C1 | H34 | 47.2° | 175.0° |
| C2 | C1 | N | C | 121.1° | 120.0° |
| C2 | C1 | N | H34 | 119.9° | 120.0° |
| C2 | C1 | C | H34 | 118.5° | 120.0° |
| C2 | C1 | C | OC1 | 59.4° | 175.0° |
| C1 | C2 | C3 | H30 | 67.2° | 64.9° |
| C1 | C2 | O1 | H33 | 56.1° | 60.0° |
| C2 | C1 | N | H35 | 180.0° | 65.4° |
| C2 | C1 | N | H36 | 60.0° | 58.6° |
| C2 | C1 | C | H38 | 60.6° | 65.0° |
| C2 | C1 | C | H39 | 179.4° | 55.0° |
| OG3 | CG2 | CG3 | OG4 | 65.5° | 63.3° |
| OG3 | CG2 | CG3 | CG1 | 119.6° | 119.9° |
| OG3 | CG2 | CG3 | H49 | 120.7° | 120.2° |
| OG3 | CG2 | CG3 | CG4 | 174.3° | 176.9° |
| OG3 | CG2 | CG1 | H49 | 120.3° | 120.2° |
| OG3 | CG2 | CG1 | OC1 | 51.0° | 57.6° |
| OG3 | CG2 | CG1 | OG | 175.1° | 177.5° |
| OG3 | CG2 | CG1 | H40 | 66.5° | 62.5° |
| OG3 | CG2 | CG3 | H47 | 54.6° | 57.0° |
| OG4 | CG3 | CG2 | CG4 | 120.2° | 119.9° |
| OG4 | CG3 | CG2 | H47 | 120.1° | 120.3° |
| OG4 | CG3 | CG4 | H47 | 120.5° | 120.3° |
| OG4 | CG3 | CG2 | CG1 | 174.9° | 176.8° |
| OG4 | CG3 | CG4 | OG5 | 55.0° | 57.0° |
| OG4 | CG3 | CG4 | CG | 175.6° | 176.8° |
| OG4 | CG3 | CG4 | H45 | 65.5° | 63.2° |
| OG4 | CG3 | CG2 | H49 | 55.2° | 56.9° |
| N | C1 | C | H34 | 119.4° | 120.0° |
| N | C1 | C | OC1 | 62.7° | 65.0° |
| N | C1 | C2 | H32 | 73.2° | 54.9° |
| C1 | N | H35 | H36 | 120.0° | 124.0° |
| N | C1 | C | H38 | 177.3° | 55.0° |
| N | C1 | C | H39 | 57.3° | 175.0° |
| CG2 | CG3 | CG4 | H47 | 119.6° | 119.9° |
| CG3 | CG2 | CG1 | H49 | 119.7° | 119.9° |
| CG3 | CG2 | CG1 | OC1 | 69.0° | 62.4° |
| CG3 | CG2 | CG1 | OG | 55.1° | 57.6° |
| CG2 | CG3 | CG4 | OG5 | 64.9° | 62.9° |
| CG2 | CG3 | CG4 | CG | 55.7° | 57.0° |
| CG3 | CG2 | CG1 | H40 | 173.5° | 177.6° |
| CG2 | CG3 | CG4 | H45 | 174.5° | 176.9° |
| CG2 | CG3 | OG4 | H48 | 180.0° | 60.0° |
| CG3 | CG2 | OG3 | H50 | 180.0° | 180.0° |
| CG4 | CG3 | CG2 | CG1 | 54.7° | 57.0° |
| CG3 | CG4 | OG5 | CG | 120.2° | 119.6° |
| CG3 | CG4 | OG5 | H45 | 119.9° | 120.2° |
| CG3 | CG4 | CG | H45 | 118.9° | 120.0° |
| CG3 | CG4 | CG | OG | 57.8° | 57.6° |
| CG3 | CG4 | CG | CG5 | 178.7° | 177.5° |
| CG3 | CG4 | CG | H41 | 62.2° | 62.4° |
| CG3 | CG4 | OG5 | H46 | 180.0° | 60.4° |
| CG4 | CG3 | OG4 | H48 | 59.1° | 179.5° |
| CG4 | CG3 | CG2 | H49 | 65.1° | 63.0° |
| C1 | C | OC1 | H38 | 120.0° | 119.9° |
| C1 | C | OC1 | H39 | 120.0° | 120.0° |
| C1 | C | OC1 | CG1 | 172.0° | 180.0° |
| C | C1 | C2 | H32 | 47.7° | 174.9° |
| C | C1 | N | H35 | 58.9° | 174.6° |
| C | C1 | N | H36 | 178.9° | 61.4° |
| C1 | C | H38 | H39 | 120.0° | 120.0° |
| CG2 | CG1 | OC1 | C | 169.7° | 170.1° |
| CG2 | CG1 | OC1 | OG | 122.2° | 119.9° |
| CG2 | CG1 | OC1 | H40 | 116.9° | 120.1° |
| CG2 | CG1 | OG | H40 | 117.9° | 120.0° |
| CG2 | CG1 | OG | CG | 59.5° | 61.1° |
| CG1 | CG2 | CG3 | H47 | 64.9° | 62.9° |
| CG1 | CG2 | OG3 | H50 | 59.4° | 60.3° |
| C | OC1 | CG1 | OG | 68.1° | 70.0° |
| OC1 | C | C1 | H34 | 177.9° | 55.0° |
| OC1 | C | H38 | H39 | 120.0° | 120.1° |
| C | OC1 | CG1 | H40 | 52.7° | 50.0° |
| OC1 | CG1 | OG | H40 | 121.0° | 120.0° |
| OC1 | CG1 | OG | CG | 61.6° | 58.9° |
| CG1 | OC1 | C | H38 | 52.0° | 60.0° |
| CG1 | OC1 | C | H39 | 68.0° | 60.0° |
| OC1 | CG1 | CG2 | H49 | 171.3° | 177.7° |
| CG1 | OG | CG | CG4 | 60.9° | 61.1° |
| CG1 | OG | CG | CG5 | 177.3° | 178.9° |
| CG1 | OG | CG | H41 | 58.4° | 58.9° |
| OG | CG1 | CG2 | H49 | 64.6° | 62.3° |
| OG5 | CG4 | CG | H45 | 120.7° | 120.2° |
| OG5 | CG4 | CG | OG | 62.6° | 62.2° |
| OG5 | CG4 | CG | CG5 | 58.3° | 57.7° |
| OG5 | CG4 | CG | H41 | 177.4° | 177.8° |
| OG5 | CG4 | CG3 | H47 | 175.5° | 177.2° |
| CG4 | CG | OG | CG5 | 121.8° | 120.0° |
| CG4 | CG | OG | H41 | 119.3° | 120.1° |
| CG4 | CG | CG5 | H41 | 119.3° | 120.1° |
| CG4 | CG | CG5 | OG6 | 146.2° | 175.0° |
| CG4 | CG | CG5 | H42 | 26.2° | 55.1° |
| CG4 | CG | CG5 | H43 | 93.8° | 64.9° |
| CG | CG4 | OG5 | H46 | 59.8° | 180.0° |
| CG | CG4 | CG3 | H47 | 63.9° | 62.9° |
| OG | CG | CG5 | H41 | 119.7° | 120.0° |
| OG | CG | CG5 | OG6 | 92.7° | 65.0° |
| CG | OG | CG1 | H40 | 177.4° | 178.9° |
| OG | CG | CG5 | H42 | 147.3° | 175.0° |
| OG | CG | CG5 | H43 | 27.2° | 55.0° |
| OG | CG | CG4 | H45 | 176.7° | 177.6° |
| CG | CG5 | OG6 | H42 | 120.0° | 120.0° |
| CG | CG5 | OG6 | H43 | 120.0° | 120.1° |
| CG | CG5 | H42 | H43 | 120.1° | 120.1° |
| CG | CG5 | OG6 | H44 | 180.0° | 180.0° |
| CG5 | CG | CG4 | H45 | 62.4° | 62.5° |
| OG6 | CG5 | CG | H41 | 26.9° | 54.9° |
| OG6 | CG5 | H42 | H43 | 120.0° | 120.0° |
| H1 | C17 | H2 | H3 | 120.0° | 120.0° |
| H1 | C17 | C16 | H4 | 59.7° | 60.0° |
| H1 | C17 | C16 | H5 | 59.8° | 180.0° |
| H2 | C17 | C16 | H4 | 60.3° | 180.0° |
| H2 | C17 | C16 | H5 | 179.7° | 60.0° |
| H3 | C17 | C16 | H4 | 179.7° | 59.9° |
| H3 | C17 | C16 | H5 | 60.3° | 60.0° |
| H4 | C16 | C15 | H6 | 147.8° | 180.0° |
| H4 | C16 | C15 | H7 | 27.5° | 60.0° |
| H5 | C16 | C15 | H6 | 92.8° | 59.9° |
| H5 | C16 | C15 | H7 | 146.9° | 180.0° |
| H6 | C15 | C14 | H8 | 162.9° | NaN° |
| H6 | C15 | C14 | H9 | 43.9° | 60.0° |
| H7 | C15 | C14 | H8 | 76.8° | 60.0° |
| H7 | C15 | C14 | H9 | 164.2° | 180.0° |
| H8 | C14 | C13 | H10 | 168.8° | 180.0° |
| H8 | C14 | C13 | H11 | 70.8° | 60.0° |
| H9 | C14 | C13 | H10 | 49.8° | 60.0° |
| H9 | C14 | C13 | H11 | 170.2° | 180.0° |
| H10 | C13 | C12 | H12 | 139.6° | 180.0° |
| H10 | C13 | C12 | H13 | 101.1° | 60.1° |
| H11 | C13 | C12 | H12 | 19.2° | 60.1° |
| H11 | C13 | C12 | H13 | 138.5° | 180.0° |
| H12 | C12 | C11 | H14 | 162.6° | 180.0° |
| H12 | C12 | C11 | H15 | 43.3° | 60.0° |
| H13 | C12 | C11 | H14 | 78.2° | 60.0° |
| H13 | C12 | C11 | H15 | 162.6° | 180.0° |
| H14 | C11 | C10 | H16 | 115.5° | 180.0° |
| H14 | C11 | C10 | H17 | 124.4° | 59.9° |
| H15 | C11 | C10 | H16 | 3.7° | 60.0° |
| H15 | C11 | C10 | H17 | 116.3° | 180.0° |
| H16 | C10 | C9 | H18 | 168.1° | 180.0° |
| H16 | C10 | C9 | H19 | 72.6° | 60.0° |
| H17 | C10 | C9 | H18 | 48.1° | 60.0° |
| H17 | C10 | C9 | H19 | 167.4° | 180.0° |
| H18 | C9 | C8 | H20 | 70.3° | 180.0° |
| H18 | C9 | C8 | H21 | 170.1° | 60.0° |
| H19 | C9 | C8 | H20 | 49.0° | 60.0° |
| H19 | C9 | C8 | H21 | 70.6° | 180.0° |
| H20 | C8 | C7 | H22 | 154.3° | 180.0° |
| H20 | C8 | C7 | H23 | 86.0° | 59.9° |
| H21 | C8 | C7 | H22 | 34.8° | 60.0° |
| H21 | C8 | C7 | H23 | 154.5° | 180.0° |
| H22 | C7 | C6 | H24 | 96.4° | 180.0° |
| H22 | C7 | C6 | H25 | 23.2° | 60.1° |
| H23 | C7 | C6 | H24 | 144.0° | 60.0° |
| H23 | C7 | C6 | H25 | 96.4° | 179.9° |
| H24 | C6 | C5 | H26 | 157.0° | 180.0° |
| H24 | C6 | C5 | H27 | 37.8° | 60.1° |
| H25 | C6 | C5 | H26 | 83.3° | 60.0° |
| H25 | C6 | C5 | H27 | 157.4° | 180.0° |
| H26 | C5 | C4 | H28 | 63.6° | 180.0° |
| H26 | C5 | C4 | H29 | 177.3° | 59.9° |
| H27 | C5 | C4 | H28 | 55.6° | 60.0° |
| H27 | C5 | C4 | H29 | 63.4° | 179.9° |
| H28 | C4 | C3 | H30 | 152.5° | 175.0° |
| H29 | C4 | C3 | H30 | 33.5° | 65.0° |
| H30 | C3 | O32 | H31 | 60.7° | 180.0° |
| H30 | C3 | C2 | H32 | 51.7° | 175.1° |
| H32 | C2 | O1 | H33 | 62.1° | 180.0° |
| H32 | C2 | C1 | H34 | 166.3° | 65.1° |
| H34 | C1 | N | H35 | 60.1° | 54.6° |
| H34 | C1 | N | H36 | 59.9° | 178.6° |
| H34 | C1 | C | H38 | 57.9° | 175.0° |
| H34 | C1 | C | H39 | 62.1° | 65.0° |
| H40 | CG1 | CG2 | H49 | 53.7° | 57.7° |
| H41 | CG | CG5 | H42 | 93.0° | 65.0° |
| H41 | CG | CG5 | H43 | 146.9° | 175.0° |
| H41 | CG | CG4 | H45 | 56.8° | 57.6° |
| H42 | CG5 | OG6 | H44 | 60.0° | 60.0° |
| H43 | CG5 | OG6 | H44 | 60.0° | 59.9° |
| H45 | CG4 | OG5 | H46 | 60.1° | 59.8° |
| H45 | CG4 | CG3 | H47 | 54.9° | 57.0° |
| H47 | CG3 | OG4 | H48 | 60.7° | 60.2° |
| H47 | CG3 | CG2 | H49 | 175.3° | 177.2° |
| H49 | CG2 | OG3 | H50 | 60.1° | 59.9° |
