9LC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C8 | C29 | sing | 1.53Å | 1.49Å | |
| C11 | C27 | sing | 1.53Å | 1.50Å | |
| C5 | C24 | sing | 1.51Å | 1.36Å | |
| C29 | C27 | sing | 1.54Å | 1.55Å | |
| C29 | C33 | sing | 1.54Å | 1.54Å | |
| C27 | C26 | sing | 1.50Å | 1.40Å | |
| C27 | C28 | sing | 1.53Å | 1.57Å | |
| C24 | C26 | doub | 1.30Å | 1.40Å | |
| C24 | C22 | sing | 1.52Å | 1.39Å | |
| C22 | C20 | sing | 1.53Å | 1.56Å | |
| C33 | C28 | sing | 1.53Å | 1.54Å | |
| C28 | N5N | sing | 1.46Å | 1.46Å | |
| C28 | C30 | sing | 1.51Å | 1.40Å | |
| C23 | C21 | sing | 1.53Å | 1.55Å | |
| C20 | C21 | sing | 1.53Å | 1.56Å | |
| C20 | C19 | sing | 1.53Å | 1.54Å | |
| N5N | C16 | sing | 1.35Å | 1.33Å | |
| O4 | C19 | sing | 1.43Å | 1.44Å | |
| C30 | O34 | sing | 1.34Å | 1.35Å | |
| C30 | C15 | doub | 1.39Å | 1.37Å | |
| C19 | C18 | sing | 1.53Å | 1.53Å | |
| C16 | C15 | sing | 1.47Å | 1.36Å | |
| C16 | O32 | doub | 1.22Å | 1.36Å | |
| C15 | C6 | sing | 1.45Å | 1.39Å | |
| C18 | CD2 | sing | 1.53Å | 1.53Å | |
| O31 | C6 | doub | 1.21Å | 1.24Å | |
| C6 | CG | sing | 1.50Å | 1.44Å | |
| CD2 | CG | sing | 1.53Å | 1.58Å | |
| CD2 | CE2 | sing | 1.49Å | 1.40Å | |
| CG | C7 | sing | 1.53Å | 1.49Å | |
| CG | C14 | sing | 1.53Å | 1.57Å | |
| CE2 | CZ | doub | 1.30Å | 1.41Å | |
| C14 | C4 | sing | 1.53Å | 1.54Å | |
| C14 | CE1 | sing | 1.53Å | 1.60Å | |
| CZ | CE1 | sing | 1.50Å | 1.40Å | |
| C4 | C3 | sing | 1.53Å | 1.54Å | |
| CE1 | C1 | sing | 1.53Å | 1.55Å | |
| C3 | C2 | sing | 1.53Å | 1.53Å | |
| C1 | C2 | sing | 1.53Å | 1.55Å | |
| C1 | O5 | sing | 1.43Å | 1.44Å | |
| O5 | H54 | sing | 0.97Å | 0.95Å | |
| CD2 | HD2 | sing | 1.09Å | 1.10Å | |
| CE1 | HE1 | sing | 1.09Å | 1.10Å | |
| CE2 | H01 | sing | 1.08Å | 1.08Å | |
| CZ | HZ | sing | 1.08Å | 1.08Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C11 | H85 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H84 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H86 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C2 | H21 | sing | 1.09Å | 1.10Å | |
| C2 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H87 | sing | 1.09Å | 1.10Å | |
| C21 | H88 | sing | 1.09Å | 1.10Å | |
| C22 | H9A | sing | 1.09Å | 1.10Å | |
| C22 | H89 | sing | 1.09Å | 1.10Å | |
| C23 | H9C | sing | 1.09Å | 1.10Å | |
| C23 | H9B | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.08Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C3 | H31 | sing | 1.09Å | 1.10Å | |
| C3 | H32 | sing | 1.09Å | 1.10Å | |
| C33 | H9D | sing | 1.09Å | 1.10Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| C4 | H41 | sing | 1.09Å | 1.10Å | |
| C4 | H42 | sing | 1.09Å | 1.10Å | |
| C5 | H52 | sing | 1.09Å | 1.10Å | |
| C5 | H53 | sing | 1.09Å | 1.10Å | |
| C5 | H51 | sing | 1.09Å | 1.10Å | |
| C7 | H71 | sing | 1.09Å | 1.10Å | |
| C7 | H72 | sing | 1.09Å | 1.10Å | |
| C7 | H73 | sing | 1.09Å | 1.10Å | |
| C8 | H83 | sing | 1.09Å | 1.10Å | |
| C8 | H81 | sing | 1.09Å | 1.10Å | |
| C8 | H82 | sing | 1.09Å | 1.10Å | |
| N5N | H02 | sing | 0.97Å | 1.00Å | |
| O34 | H34 | sing | 0.97Å | 0.95Å | |
| O4 | H43 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C8 | C29 | C27 | 117.4° | 113.6° |
| C8 | C29 | C33 | 118.4° | 113.6° |
| C8 | C29 | H29 | 109.9° | 112.9° |
| C29 | C8 | H83 | 109.5° | 109.4° |
| C29 | C8 | H81 | 109.5° | 109.5° |
| C29 | C8 | H82 | 109.5° | 109.5° |
| C11 | C27 | C29 | 112.0° | 111.2° |
| C11 | C27 | C26 | 116.2° | 114.5° |
| C11 | C27 | C28 | 116.2° | 113.9° |
| C27 | C11 | H85 | 109.5° | 109.5° |
| C27 | C11 | H11 | 109.5° | 109.4° |
| C27 | C11 | H84 | 109.4° | 109.5° |
| C5 | C24 | C26 | 124.1° | 123.3° |
| C5 | C24 | C22 | 118.8° | 118.0° |
| C24 | C5 | H52 | 109.5° | 109.5° |
| C24 | C5 | H53 | 109.5° | 109.5° |
| C24 | C5 | H51 | 109.5° | 109.4° |
| C27 | C29 | C33 | 91.1° | 87.1° |
| C29 | C27 | C26 | 113.7° | 112.5° |
| C29 | C27 | C28 | 83.4° | 89.0° |
| C27 | C29 | H29 | 109.2° | 113.6° |
| C29 | C33 | C28 | 85.3° | 89.3° |
| C33 | C29 | H29 | 109.4° | 113.6° |
| C29 | C33 | H9D | 115.1° | 113.2° |
| C29 | C33 | H33 | 115.1° | 113.2° |
| C26 | C27 | C28 | 111.0° | 113.1° |
| C27 | C26 | C24 | 132.6° | 125.1° |
| C27 | C26 | H26 | 113.7° | 117.5° |
| C27 | C28 | C33 | 90.2° | 87.8° |
| C27 | C28 | N5N | 115.1° | 115.9° |
| C27 | C28 | C30 | 117.5° | 114.8° |
| C26 | C24 | C22 | 117.1° | 118.6° |
| C24 | C26 | H26 | 113.7° | 117.3° |
| C24 | C22 | C20 | 109.0° | 108.9° |
| C24 | C22 | H9A | 109.6° | 109.6° |
| C24 | C22 | H89 | 109.6° | 109.7° |
| C22 | C20 | C21 | 108.5° | 109.4° |
| C22 | C20 | C19 | 119.3° | 109.7° |
| C22 | C20 | H20 | 106.3° | 109.4° |
| C20 | C22 | H9A | 109.6° | 109.6° |
| C20 | C22 | H89 | 109.6° | 109.5° |
| C33 | C28 | N5N | 120.8° | 116.5° |
| C33 | C28 | C30 | 112.2° | 114.5° |
| C28 | C33 | H9D | 115.1° | 113.3° |
| C28 | C33 | H33 | 115.1° | 113.2° |
| N5N | C28 | C30 | 102.0° | 106.8° |
| C28 | N5N | C16 | 107.1° | 108.0° |
| C28 | N5N | H02 | 126.4° | 126.0° |
| C28 | C30 | O34 | 118.6° | 127.0° |
| C28 | C30 | C15 | 112.1° | 106.0° |
| C23 | C21 | C20 | 115.7° | 109.5° |
| C23 | C21 | H87 | 107.9° | 109.5° |
| C23 | C21 | H88 | 107.9° | 109.5° |
| C21 | C23 | H9C | 109.5° | 109.5° |
| C21 | C23 | H9B | 109.4° | 109.5° |
| C21 | C23 | H23 | 109.5° | 109.5° |
| C21 | C20 | C19 | 109.2° | 109.4° |
| C21 | C20 | H20 | 106.3° | 109.4° |
| C20 | C21 | H87 | 107.9° | 109.5° |
| C20 | C21 | H88 | 107.9° | 109.4° |
| C20 | C19 | O4 | 110.2° | 109.2° |
| C20 | C19 | C18 | 115.0° | 110.3° |
| C20 | C19 | H19 | 105.1° | 109.3° |
| C19 | C20 | H20 | 106.5° | 109.5° |
| N5N | C16 | C15 | 112.7° | 110.8° |
| N5N | C16 | O32 | 116.3° | 124.6° |
| C16 | N5N | H02 | 126.4° | 126.0° |
| O4 | C19 | C18 | 114.2° | 109.3° |
| O4 | C19 | H19 | 106.2° | 109.3° |
| C19 | O4 | H43 | 109.5° | 114.0° |
| O34 | C30 | C15 | 128.7° | 127.0° |
| C30 | O34 | H34 | 109.5° | 116.9° |
| C30 | C15 | C16 | 104.6° | 108.3° |
| C30 | C15 | C6 | 121.9° | 123.0° |
| C19 | C18 | CD2 | 115.9° | 110.4° |
| C19 | C18 | H86 | 107.9° | 109.3° |
| C19 | C18 | H18 | 107.9° | 109.2° |
| C18 | C19 | H19 | 105.2° | 109.3° |
| C15 | C16 | O32 | 131.0° | 124.6° |
| C16 | C15 | C6 | 132.9° | 128.8° |
| C15 | C6 | O31 | 117.6° | 117.2° |
| C15 | C6 | CG | 127.8° | 125.7° |
| C18 | CD2 | CG | 113.1° | 109.5° |
| C18 | CD2 | CE2 | 113.1° | 108.6° |
| C18 | CD2 | HD2 | 104.2° | 108.9° |
| CD2 | C18 | H86 | 107.9° | 109.4° |
| CD2 | C18 | H18 | 107.8° | 109.3° |
| O31 | C6 | CG | 114.3° | 117.2° |
| C6 | CG | CD2 | 108.9° | 109.1° |
| C6 | CG | C7 | 119.2° | 110.6° |
| C6 | CG | C14 | 111.7° | 108.7° |
| CG | CD2 | CE2 | 115.5° | 112.3° |
| CD2 | CG | C7 | 108.3° | 109.5° |
| CD2 | CG | C14 | 106.4° | 109.5° |
| CG | CD2 | HD2 | 103.8° | 108.7° |
| CD2 | CE2 | CZ | 121.5° | 126.0° |
| CE2 | CD2 | HD2 | 105.6° | 108.8° |
| CD2 | CE2 | H01 | 119.2° | 117.0° |
| C7 | CG | C14 | 101.5° | 109.4° |
| CG | C7 | H71 | 109.5° | 109.4° |
| CG | C7 | H72 | 109.5° | 109.4° |
| CG | C7 | H73 | 109.5° | 109.5° |
| CG | C14 | C4 | 121.6° | 110.6° |
| CG | C14 | CE1 | 112.0° | 110.0° |
| CG | C14 | H14 | 103.9° | 109.1° |
| CE2 | CZ | CE1 | 121.5° | 122.1° |
| CZ | CE2 | H01 | 119.2° | 117.0° |
| CE2 | CZ | HZ | 119.2° | 119.0° |
| C4 | C14 | CE1 | 109.6° | 108.9° |
| C14 | C4 | C3 | 116.6° | 108.9° |
| C4 | C14 | H14 | 104.2° | 109.1° |
| C14 | C4 | H41 | 107.7° | 109.5° |
| C14 | C4 | H42 | 107.6° | 109.6° |
| C14 | CE1 | CZ | 114.4° | 109.2° |
| C14 | CE1 | C1 | 112.4° | 108.3° |
| C14 | CE1 | HE1 | 105.5° | 110.5° |
| CE1 | C14 | H14 | 103.6° | 109.3° |
| CZ | CE1 | C1 | 110.0° | 110.8° |
| CZ | CE1 | HE1 | 107.9° | 109.7° |
| CE1 | CZ | HZ | 119.3° | 118.9° |
| C4 | C3 | C2 | 113.3° | 110.1° |
| C4 | C3 | H31 | 108.5° | 109.3° |
| C4 | C3 | H32 | 108.5° | 109.3° |
| C3 | C4 | H41 | 107.6° | 109.6° |
| C3 | C4 | H42 | 107.7° | 109.6° |
| CE1 | C1 | C2 | 113.2° | 108.4° |
| CE1 | C1 | O5 | 109.7° | 109.6° |
| C1 | CE1 | HE1 | 106.1° | 108.3° |
| CE1 | C1 | H1 | 107.7° | 109.6° |
| C3 | C2 | C1 | 115.6° | 110.0° |
| C3 | C2 | H21 | 107.9° | 109.4° |
| C3 | C2 | H22 | 107.9° | 109.3° |
| C2 | C3 | H31 | 108.5° | 109.4° |
| C2 | C3 | H32 | 108.5° | 109.3° |
| C2 | C1 | O5 | 109.3° | 109.7° |
| C2 | C1 | H1 | 107.7° | 109.7° |
| C1 | C2 | H21 | 107.9° | 109.3° |
| C1 | C2 | H22 | 107.9° | 109.4° |
| C1 | O5 | H54 | 109.5° | 114.0° |
| O5 | C1 | H1 | 109.1° | 109.8° |
| H85 | C11 | H11 | 109.5° | 109.4° |
| H85 | C11 | H84 | 109.5° | 109.5° |
| H11 | C11 | H84 | 109.5° | 109.5° |
| H86 | C18 | H18 | 109.4° | 109.3° |
| H21 | C2 | H22 | 109.5° | 109.4° |
| H87 | C21 | H88 | 109.5° | 109.6° |
| H9A | C22 | H89 | 109.4° | 109.6° |
| H9C | C23 | H9B | 109.5° | 109.5° |
| H9C | C23 | H23 | 109.5° | 109.4° |
| H9B | C23 | H23 | 109.5° | 109.4° |
| H31 | C3 | H32 | 109.5° | 109.3° |
| H9D | C33 | H33 | 109.5° | 112.6° |
| H41 | C4 | H42 | 109.5° | 109.6° |
| H52 | C5 | H53 | 109.5° | 109.5° |
| H52 | C5 | H51 | 109.5° | 109.4° |
| H53 | C5 | H51 | 109.4° | 109.5° |
| H71 | C7 | H72 | 109.4° | 109.5° |
| H71 | C7 | H73 | 109.4° | 109.5° |
| H72 | C7 | H73 | 109.5° | 109.5° |
| H83 | C8 | H81 | 109.4° | 109.4° |
| H83 | C8 | H82 | 109.5° | 109.5° |
| H81 | C8 | H82 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C8 | C29 | C27 | C11 | 30.9° | 18.7° |
| C8 | C29 | C27 | C33 | 123.1° | 114.6° |
| C8 | C29 | C27 | H29 | 126.0° | 130.9° |
| C8 | C29 | C33 | H29 | 126.9° | 130.9° |
| C8 | C29 | C27 | C26 | 103.3° | 111.3° |
| C8 | C29 | C27 | C28 | 146.6° | 134.0° |
| C8 | C29 | C33 | C28 | 146.3° | 134.0° |
| C8 | C29 | C33 | H9D | 30.7° | 110.8° |
| C8 | C29 | C33 | H33 | 98.1° | 18.9° |
| C29 | C8 | H83 | H81 | 120.0° | 120.0° |
| C29 | C8 | H83 | H82 | 120.0° | 120.0° |
| C29 | C8 | H81 | H82 | 120.0° | 120.0° |
| C11 | C27 | C29 | C26 | 134.3° | 130.0° |
| C11 | C27 | C29 | C28 | 115.7° | 115.3° |
| C11 | C27 | C29 | C33 | 92.1° | 95.9° |
| C11 | C27 | C26 | C28 | 135.8° | 132.7° |
| C11 | C27 | C26 | C24 | 41.7° | 65.0° |
| C11 | C27 | C28 | C33 | 87.8° | 93.3° |
| C11 | C27 | C28 | N5N | 36.8° | 25.3° |
| C11 | C27 | C28 | C30 | 156.9° | 150.6° |
| C27 | C11 | H85 | H11 | 120.0° | 119.9° |
| C27 | C11 | H85 | H84 | 120.0° | 120.0° |
| C27 | C11 | H11 | H84 | 120.0° | 120.0° |
| C11 | C27 | C26 | H26 | 138.3° | 119.5° |
| C11 | C27 | C29 | H29 | 156.9° | 149.6° |
| C5 | C24 | C26 | C27 | 4.9° | 9.7° |
| C5 | C24 | C26 | C22 | 179.1° | 179.0° |
| C5 | C24 | C22 | C20 | 94.2° | 50.6° |
| C5 | C24 | C22 | H9A | 145.9° | 69.2° |
| C5 | C24 | C22 | H89 | 25.8° | 170.5° |
| C5 | C24 | C26 | H26 | 175.1° | 174.7° |
| C24 | C5 | H52 | H53 | 120.0° | 120.0° |
| C24 | C5 | H52 | H51 | 120.0° | 119.9° |
| C24 | C5 | H53 | H51 | 120.0° | 120.0° |
| C27 | C29 | C33 | H29 | 110.8° | 114.5° |
| C29 | C27 | C26 | C28 | 92.0° | 99.0° |
| C29 | C27 | C26 | C24 | 173.9° | 166.7° |
| C27 | C29 | C33 | C28 | 24.1° | 19.5° |
| C29 | C27 | C28 | N5N | 148.1° | 138.1° |
| C29 | C27 | C28 | C30 | 91.8° | 96.6° |
| C29 | C27 | C11 | H85 | 180.0° | 73.9° |
| C29 | C27 | C11 | H11 | 60.0° | 46.0° |
| C29 | C27 | C11 | H84 | 60.0° | 166.0° |
| C29 | C27 | C26 | H26 | 6.1° | 8.8° |
| C27 | C29 | C33 | H9D | 91.5° | 134.6° |
| C27 | C29 | C33 | H33 | 139.6° | 95.6° |
| C27 | C29 | C8 | H83 | 180.0° | 60.0° |
| C27 | C29 | C8 | H81 | 60.0° | 180.0° |
| C27 | C29 | C8 | H82 | 60.0° | 60.0° |
| C33 | C29 | C27 | C26 | 133.6° | 134.1° |
| C29 | C33 | C28 | H9D | 115.6° | 115.1° |
| C29 | C33 | C28 | H33 | 115.6° | 115.1° |
| C29 | C33 | C28 | N5N | 143.4° | 137.6° |
| C29 | C33 | C28 | C30 | 96.3° | 96.8° |
| C29 | C33 | H9D | H33 | 131.6° | 130.0° |
| C33 | C29 | C8 | H83 | 72.2° | 157.5° |
| C33 | C29 | C8 | H81 | 47.8° | 82.5° |
| C33 | C29 | C8 | H82 | 167.7° | 37.5° |
| C27 | C26 | C24 | H26 | 180.0° | 175.6° |
| C27 | C26 | C24 | C22 | 176.0° | 171.2° |
| C26 | C27 | C28 | C33 | 136.4° | 133.7° |
| C26 | C27 | C28 | N5N | 99.0° | 107.8° |
| C26 | C27 | C28 | C30 | 21.1° | 17.6° |
| C26 | C27 | C11 | H85 | 47.0° | 55.0° |
| C26 | C27 | C11 | H11 | 73.0° | 174.9° |
| C26 | C27 | C11 | H84 | 167.0° | 65.0° |
| C26 | C27 | C29 | H29 | 22.7° | 19.6° |
| C28 | C27 | C26 | C24 | 94.1° | 67.7° |
| C27 | C28 | C33 | N5N | 119.7° | 118.0° |
| C27 | C28 | C33 | C30 | 120.0° | 116.4° |
| C27 | C28 | N5N | C30 | 128.3° | 129.4° |
| C27 | C28 | N5N | C16 | 119.3° | 125.7° |
| C27 | C28 | C30 | O34 | 73.2° | 52.9° |
| C27 | C28 | C30 | C15 | 114.5° | 127.1° |
| C28 | C27 | C11 | H85 | 86.5° | 172.6° |
| C28 | C27 | C11 | H11 | 153.5° | 52.7° |
| C28 | C27 | C11 | H84 | 33.5° | 67.3° |
| C28 | C27 | C26 | H26 | 85.9° | 107.8° |
| C28 | C27 | C29 | H29 | 87.4° | 95.1° |
| C27 | C28 | C33 | H9D | 91.9° | 134.7° |
| C27 | C28 | C33 | H33 | 139.3° | 95.5° |
| C27 | C28 | N5N | H02 | 60.8° | 54.2° |
| C26 | C24 | C22 | C20 | 86.6° | 130.3° |
| C26 | C24 | C22 | H9A | 33.3° | 109.9° |
| C26 | C24 | C22 | H89 | 153.4° | 10.4° |
| C26 | C24 | C5 | H52 | 180.0° | 4.9° |
| C26 | C24 | C5 | H53 | 60.0° | 115.1° |
| C26 | C24 | C5 | H51 | 60.0° | 124.9° |
| C24 | C22 | C20 | H9A | 120.0° | 119.8° |
| C24 | C22 | C20 | H89 | 119.9° | 119.9° |
| C24 | C22 | C20 | C21 | 175.4° | 71.1° |
| C24 | C22 | C20 | C19 | 49.5° | 49.0° |
| C24 | C22 | C20 | H20 | 70.7° | 169.1° |
| C24 | C22 | H9A | H89 | 120.2° | 120.4° |
| C22 | C24 | C26 | H26 | 4.0° | 4.4° |
| C22 | C24 | C5 | H52 | 0.9° | 174.1° |
| C22 | C24 | C5 | H53 | 119.1° | 65.8° |
| C22 | C24 | C5 | H51 | 120.9° | 54.2° |
| C22 | C20 | C21 | C23 | 82.5° | 66.2° |
| C22 | C20 | C21 | C19 | 131.6° | 120.2° |
| C22 | C20 | C21 | H20 | 113.9° | 119.9° |
| C22 | C20 | C19 | H20 | 120.1° | 120.0° |
| C22 | C20 | C19 | O4 | 57.6° | 59.3° |
| C22 | C20 | C19 | C18 | 171.6° | 179.6° |
| C22 | C20 | C19 | H19 | 56.4° | 60.2° |
| C22 | C20 | C21 | H87 | 156.6° | 53.8° |
| C22 | C20 | C21 | H88 | 38.4° | 173.9° |
| C20 | C22 | H9A | H89 | 120.2° | 120.2° |
| C33 | C28 | N5N | C30 | 125.2° | 129.4° |
| C33 | C28 | N5N | C16 | 134.3° | 133.1° |
| C33 | C28 | C30 | O34 | 29.3° | 46.5° |
| C33 | C28 | C30 | C15 | 143.0° | 133.5° |
| C28 | C33 | C29 | H29 | 86.7° | 95.1° |
| C28 | C33 | H9D | H33 | 131.6° | 130.1° |
| C33 | C28 | N5N | H02 | 45.7° | 47.0° |
| C28 | N5N | C16 | H02 | 180.0° | 180.0° |
| N5N | C28 | C30 | O34 | 160.0° | 177.1° |
| N5N | C28 | C30 | C15 | 12.3° | 2.9° |
| C28 | N5N | C16 | C15 | 3.1° | 3.0° |
| C28 | N5N | C16 | O32 | 178.1° | 177.1° |
| N5N | C28 | C33 | H9D | 27.8° | 107.3° |
| N5N | C28 | C33 | H33 | 101.0° | 22.5° |
| C30 | C28 | N5N | C16 | 9.0° | 3.6° |
| C28 | C30 | O34 | C15 | 170.9° | 180.0° |
| C28 | C30 | C15 | C16 | 10.8° | 1.2° |
| C28 | C30 | C15 | C6 | 176.4° | 177.9° |
| C30 | C28 | C33 | H9D | 148.1° | 18.4° |
| C30 | C28 | C33 | H33 | 19.3° | 148.2° |
| C30 | C28 | N5N | H02 | 170.9° | 176.4° |
| C28 | C30 | O34 | H34 | 174.1° | 180.0° |
| C23 | C21 | C20 | H87 | 120.9° | 120.0° |
| C23 | C21 | C20 | H88 | 120.9° | 119.9° |
| C23 | C21 | C20 | C19 | 145.9° | 173.7° |
| C23 | C21 | C20 | H20 | 31.4° | 53.7° |
| C23 | C21 | H87 | H88 | 117.2° | 120.0° |
| C21 | C23 | H9C | H9B | 120.0° | 120.0° |
| C21 | C23 | H9C | H23 | 120.0° | 120.0° |
| C21 | C23 | H9B | H23 | 120.0° | 120.0° |
| C21 | C20 | C19 | H20 | 114.3° | 119.9° |
| C21 | C20 | C19 | O4 | 67.9° | 60.7° |
| C21 | C20 | C19 | C18 | 62.9° | 59.5° |
| C21 | C20 | C19 | H19 | 178.1° | 179.7° |
| C20 | C21 | H87 | H88 | 117.2° | 120.0° |
| C21 | C20 | C22 | H9A | 64.6° | 48.8° |
| C21 | C20 | C22 | H89 | 55.5° | 169.0° |
| C20 | C21 | C23 | H9C | 180.0° | 180.0° |
| C20 | C21 | C23 | H9B | 60.0° | 60.0° |
| C20 | C21 | C23 | H23 | 60.0° | 60.0° |
| C20 | C19 | O4 | C18 | 131.3° | 120.8° |
| C20 | C19 | O4 | H19 | 113.3° | 119.6° |
| C20 | C19 | C18 | H19 | 115.2° | 120.2° |
| C20 | C19 | C18 | CD2 | 145.3° | 99.1° |
| C20 | C19 | C18 | H86 | 24.3° | 21.2° |
| C20 | C19 | C18 | H18 | 93.8° | 140.7° |
| C19 | C20 | C21 | H87 | 25.0° | 66.4° |
| C19 | C20 | C21 | H88 | 93.2° | 53.7° |
| C19 | C20 | C22 | H9A | 169.5° | 168.8° |
| C19 | C20 | C22 | H89 | 70.4° | 71.0° |
| C20 | C19 | O4 | H43 | 180.0° | 67.1° |
| N5N | C16 | C15 | C30 | 4.5° | 1.1° |
| N5N | C16 | C15 | O32 | 178.6° | 179.9° |
| N5N | C16 | C15 | C6 | 176.1° | 179.9° |
| O4 | C19 | C18 | H19 | 116.0° | 119.6° |
| O4 | C19 | C18 | CD2 | 85.9° | 21.0° |
| O4 | C19 | C18 | H86 | 153.2° | 141.3° |
| O4 | C19 | C18 | H18 | 35.1° | 99.2° |
| O4 | C19 | C20 | H20 | 177.7° | 179.4° |
| O34 | C30 | C15 | C16 | 160.5° | 178.8° |
| O34 | C30 | C15 | C6 | 12.3° | 2.1° |
| C30 | C15 | C16 | C6 | 171.7° | 179.0° |
| C30 | C15 | C16 | O32 | 174.2° | 179.0° |
| C30 | C15 | C6 | O31 | 10.5° | 26.2° |
| C30 | C15 | C6 | CG | 175.8° | 153.9° |
| C15 | C30 | O34 | H34 | 15.0° | 0.1° |
| C19 | C18 | CD2 | H86 | 121.0° | 120.3° |
| C19 | C18 | CD2 | H18 | 121.0° | 120.1° |
| C19 | C18 | CD2 | CG | 100.9° | 82.4° |
| C19 | C18 | CD2 | CE2 | 125.4° | 154.7° |
| C19 | C18 | CD2 | HD2 | 11.2° | 36.3° |
| C19 | C18 | H86 | H18 | 117.1° | 119.4° |
| C18 | C19 | C20 | H20 | 51.5° | 60.4° |
| C18 | C19 | O4 | H43 | 48.7° | 172.1° |
| C16 | C15 | C6 | O31 | 179.0° | 154.9° |
| C16 | C15 | C6 | CG | 5.3° | 25.0° |
| C15 | C16 | N5N | H02 | 176.9° | 177.1° |
| O32 | C16 | C15 | C6 | 2.5° | 0.0° |
| O32 | C16 | N5N | H02 | 2.0° | 2.8° |
| C15 | C6 | O31 | CG | 174.6° | 179.9° |
| C15 | C6 | CG | CD2 | 81.5° | 87.4° |
| C15 | C6 | CG | C7 | 43.3° | 33.1° |
| C15 | C6 | CG | C14 | 161.2° | 153.2° |
| C18 | CD2 | CG | C6 | 37.2° | 36.4° |
| C18 | CD2 | CG | CE2 | 132.6° | 120.7° |
| C18 | CD2 | CG | HD2 | 112.3° | 118.9° |
| C18 | CD2 | CE2 | HD2 | 113.4° | 118.4° |
| C18 | CD2 | CG | C7 | 168.1° | 157.6° |
| C18 | CD2 | CG | C14 | 83.4° | 82.5° |
| C18 | CD2 | CE2 | CZ | 95.4° | 113.3° |
| C18 | CD2 | CE2 | H01 | 84.6° | 66.6° |
| CD2 | C18 | H86 | H18 | 117.1° | 119.7° |
| CD2 | C18 | C19 | H19 | 30.1° | 140.6° |
| O31 | C6 | CG | CD2 | 92.4° | 92.7° |
| O31 | C6 | CG | C7 | 142.8° | 146.8° |
| O31 | C6 | CG | C14 | 24.9° | 26.7° |
| C6 | CG | CD2 | C7 | 131.0° | 121.2° |
| C6 | CG | CD2 | C14 | 120.6° | 118.9° |
| C6 | CG | CD2 | CE2 | 169.7° | 157.1° |
| C6 | CG | C7 | C14 | 123.1° | 119.7° |
| C6 | CG | C14 | C4 | 57.7° | 57.6° |
| C6 | CG | C14 | CE1 | 170.0° | 177.9° |
| C6 | CG | CD2 | HD2 | 75.2° | 82.5° |
| C6 | CG | C14 | H14 | 58.9° | 62.3° |
| C6 | CG | C7 | H71 | 180.0° | 162.8° |
| C6 | CG | C7 | H72 | 60.0° | 77.3° |
| C6 | CG | C7 | H73 | 60.0° | 42.8° |
| CG | CD2 | CE2 | HD2 | 114.1° | 120.4° |
| CD2 | CG | C7 | C14 | 111.8° | 120.0° |
| CG | CD2 | CE2 | CZ | 37.2° | 7.8° |
| CD2 | CG | C14 | C4 | 176.4° | 176.8° |
| CD2 | CG | C14 | CE1 | 51.3° | 62.9° |
| CG | CD2 | CE2 | H01 | 142.8° | 172.2° |
| CD2 | CG | C14 | H14 | 59.9° | 56.9° |
| CG | CD2 | C18 | H86 | 20.1° | 157.3° |
| CG | CD2 | C18 | H18 | 138.2° | 37.6° |
| CD2 | CG | C7 | H71 | 54.9° | 77.0° |
| CD2 | CG | C7 | H72 | 65.1° | 43.0° |
| CD2 | CG | C7 | H73 | 174.9° | 163.1° |
| CE2 | CD2 | CG | C7 | 59.3° | 81.7° |
| CE2 | CD2 | CG | C14 | 49.2° | 38.3° |
| CD2 | CE2 | CZ | H01 | 180.0° | 180.0° |
| CD2 | CE2 | CZ | CE1 | 26.4° | 0.2° |
| CD2 | CE2 | CZ | HZ | 153.6° | 179.8° |
| CE2 | CD2 | C18 | H86 | 113.6° | 34.4° |
| CE2 | CD2 | C18 | H18 | 4.5° | 85.3° |
| C7 | CG | C14 | C4 | 70.4° | 63.2° |
| C7 | CG | C14 | CE1 | 61.9° | 57.1° |
| C7 | CG | CD2 | HD2 | 55.8° | 38.7° |
| C7 | CG | C14 | H14 | 173.1° | 176.9° |
| CG | C7 | H71 | H72 | 120.0° | 119.9° |
| CG | C7 | H71 | H73 | 120.0° | 120.0° |
| CG | C7 | H72 | H73 | 120.0° | 120.1° |
| CG | C14 | C4 | CE1 | 133.3° | 121.0° |
| CG | C14 | C4 | H14 | 116.4° | 119.9° |
| CG | C14 | CE1 | H14 | 111.3° | 119.7° |
| CG | C14 | CE1 | CZ | 43.5° | 54.2° |
| CG | C14 | C4 | C3 | 176.3° | 177.6° |
| CG | C14 | CE1 | C1 | 169.8° | 175.0° |
| C14 | CG | CD2 | HD2 | 164.3° | 158.7° |
| CG | C14 | CE1 | HE1 | 74.9° | 66.5° |
| CG | C14 | C4 | H41 | 62.7° | 62.5° |
| CG | C14 | C4 | H42 | 55.2° | 57.8° |
| C14 | CG | C7 | H71 | 56.9° | 43.1° |
| C14 | CG | C7 | H72 | 176.9° | 163.0° |
| C14 | CG | C7 | H73 | 63.1° | 76.9° |
| CE2 | CZ | CE1 | C14 | 28.5° | 23.5° |
| CE2 | CZ | CE1 | HZ | 180.0° | 180.0° |
| CE2 | CZ | CE1 | C1 | 156.0° | 142.8° |
| CZ | CE2 | CD2 | HD2 | 151.2° | 128.2° |
| CE2 | CZ | CE1 | HE1 | 88.6° | 97.7° |
| C4 | C14 | CE1 | H14 | 110.7° | 119.0° |
| C4 | C14 | CE1 | CZ | 178.5° | 175.5° |
| C14 | C4 | C3 | H41 | 121.0° | 119.8° |
| C14 | C4 | C3 | H42 | 121.0° | 119.9° |
| C4 | C14 | CE1 | C1 | 52.2° | 63.7° |
| C14 | C4 | C3 | C2 | 46.5° | 58.8° |
| C4 | C14 | CE1 | HE1 | 63.0° | 54.8° |
| C14 | C4 | C3 | H31 | 167.1° | 61.5° |
| C14 | C4 | C3 | H32 | 74.1° | 178.9° |
| C14 | C4 | H41 | H42 | 116.7° | 120.3° |
| C14 | CE1 | CZ | C1 | 127.6° | 119.3° |
| C14 | CE1 | CZ | HE1 | 117.1° | 121.3° |
| CE1 | C14 | C4 | C3 | 50.4° | 61.4° |
| C14 | CE1 | C1 | HE1 | 114.9° | 119.9° |
| C14 | CE1 | C1 | C2 | 51.4° | 62.4° |
| C14 | CE1 | C1 | O5 | 173.7° | 177.9° |
| C14 | CE1 | CZ | HZ | 151.5° | 156.4° |
| C14 | CE1 | C1 | H1 | 67.6° | 57.3° |
| CE1 | C14 | C4 | H41 | 70.6° | 58.4° |
| CE1 | C14 | C4 | H42 | 171.5° | 178.7° |
| CZ | CE1 | C1 | HE1 | 116.4° | 120.3° |
| CZ | CE1 | C1 | C2 | 179.9° | 177.8° |
| CZ | CE1 | C1 | O5 | 57.6° | 58.0° |
| CE1 | CZ | CE2 | H01 | 153.6° | 179.8° |
| CZ | CE1 | C1 | H1 | 61.1° | 62.5° |
| CZ | CE1 | C14 | H14 | 67.9° | 65.5° |
| C4 | C3 | C2 | H31 | 120.6° | 120.2° |
| C4 | C3 | C2 | H32 | 120.6° | 120.1° |
| C4 | C3 | C2 | C1 | 43.2° | 58.5° |
| C3 | C4 | C14 | H14 | 59.9° | 57.7° |
| C4 | C3 | C2 | H21 | 77.7° | 178.6° |
| C4 | C3 | C2 | H22 | 164.1° | 61.7° |
| C4 | C3 | H31 | H32 | 118.3° | 119.6° |
| C3 | C4 | H41 | H42 | 116.8° | 120.3° |
| CE1 | C1 | C2 | C3 | 47.1° | 60.0° |
| CE1 | C1 | C2 | O5 | 122.6° | 119.7° |
| CE1 | C1 | C2 | H1 | 119.0° | 119.7° |
| CE1 | C1 | O5 | H1 | 117.8° | 120.5° |
| CE1 | C1 | O5 | H54 | 180.0° | 180.0° |
| C1 | CE1 | CZ | HZ | 24.0° | 37.1° |
| C1 | CE1 | C14 | H14 | 58.5° | 55.3° |
| CE1 | C1 | C2 | H21 | 73.8° | 179.9° |
| CE1 | C1 | C2 | H22 | 168.0° | 60.1° |
| C3 | C2 | C1 | H21 | 120.9° | 120.1° |
| C3 | C2 | C1 | H22 | 120.9° | 120.1° |
| C3 | C2 | C1 | O5 | 169.7° | 179.7° |
| C3 | C2 | C1 | H1 | 71.9° | 59.7° |
| C3 | C2 | H21 | H22 | 117.2° | 119.7° |
| C2 | C3 | H31 | H32 | 118.3° | 119.7° |
| C2 | C3 | C4 | H41 | 74.5° | 61.1° |
| C2 | C3 | C4 | H42 | 167.5° | 178.6° |
| C2 | C1 | O5 | H1 | 117.6° | 120.6° |
| C2 | C1 | O5 | H54 | 55.4° | 61.1° |
| C2 | C1 | CE1 | HE1 | 63.5° | 57.5° |
| C1 | C2 | H21 | H22 | 117.2° | 119.7° |
| C1 | C2 | C3 | H31 | 163.8° | 61.7° |
| C1 | C2 | C3 | H32 | 77.3° | 178.6° |
| O5 | C1 | CE1 | HE1 | 58.8° | 62.3° |
| O5 | C1 | C2 | H21 | 48.8° | 60.2° |
| O5 | C1 | C2 | H22 | 69.5° | 59.6° |
| H54 | O5 | C1 | H1 | 62.1° | 59.5° |
| HD2 | CD2 | CE2 | H01 | 28.8° | 51.8° |
| HD2 | CD2 | C18 | H86 | 132.2° | 83.9° |
| HD2 | CD2 | C18 | H18 | 109.7° | 156.4° |
| HE1 | CE1 | CZ | HZ | 91.4° | 82.3° |
| HE1 | CE1 | C1 | H1 | 177.5° | 177.2° |
| HE1 | CE1 | C14 | H14 | 173.7° | 173.8° |
| H01 | CE2 | CZ | HZ | 26.4° | 0.2° |
| H1 | C1 | C2 | H21 | 167.2° | 60.5° |
| H1 | C1 | C2 | H22 | 49.0° | 179.8° |
| H85 | C11 | H11 | H84 | 120.0° | 120.0° |
| H14 | C14 | C4 | H41 | 179.1° | 177.5° |
| H14 | C14 | C4 | H42 | 61.2° | 62.2° |
| H86 | C18 | C19 | H19 | 90.8° | 99.1° |
| H18 | C18 | C19 | H19 | 151.0° | 20.4° |
| H19 | C19 | C20 | H20 | 63.7° | 59.8° |
| H19 | C19 | O4 | H43 | 66.7° | 52.5° |
| H21 | C2 | C3 | H31 | 42.9° | 58.4° |
| H21 | C2 | C3 | H32 | 161.8° | 61.3° |
| H22 | C2 | C3 | H31 | 75.3° | 178.1° |
| H22 | C2 | C3 | H32 | 43.5° | 58.5° |
| H20 | C20 | C21 | H87 | 89.5° | 173.7° |
| H20 | C20 | C21 | H88 | 152.3° | 66.3° |
| H20 | C20 | C22 | H9A | 49.3° | 71.1° |
| H20 | C20 | C22 | H89 | 169.4° | 49.1° |
| H87 | C21 | C23 | H9C | 59.1° | 60.0° |
| H87 | C21 | C23 | H9B | 60.9° | 180.0° |
| H87 | C21 | C23 | H23 | 179.1° | 60.0° |
| H88 | C21 | C23 | H9C | 59.1° | 60.1° |
| H88 | C21 | C23 | H9B | 179.1° | 60.0° |
| H88 | C21 | C23 | H23 | 60.9° | 179.9° |
| H9C | C23 | H9B | H23 | 120.0° | 119.9° |
| H29 | C29 | C33 | H9D | 157.7° | 20.1° |
| H29 | C29 | C33 | H33 | 28.9° | 149.8° |
| H29 | C29 | C8 | H83 | 54.4° | 71.2° |
| H29 | C29 | C8 | H81 | 174.4° | 48.7° |
| H29 | C29 | C8 | H82 | 65.6° | 168.7° |
| H31 | C3 | C4 | H41 | 46.0° | 178.7° |
| H31 | C3 | C4 | H42 | 71.9° | 58.4° |
| H32 | C3 | C4 | H41 | 164.9° | 59.1° |
| H32 | C3 | C4 | H42 | 47.0° | 61.2° |
| H52 | C5 | H53 | H51 | 120.0° | 120.0° |
| H71 | C7 | H72 | H73 | 120.0° | 120.0° |
| H83 | C8 | H81 | H82 | 120.0° | 120.1° |
