719
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C2 | sing | 1.47Å | 1.45Å | |
| N1 | C3 | sing | 1.37Å | 1.37Å | Aromatic |
| N1 | C8 | sing | 1.36Å | 1.39Å | Aromatic |
| C2 | C6 | sing | 1.54Å | 1.52Å | |
| C2 | O9 | sing | 1.44Å | 1.44Å | |
| C3 | C4 | doub | 1.40Å | 1.37Å | Aromatic |
| C3 | N15 | sing | 1.33Å | 1.32Å | Aromatic |
| C4 | N5 | sing | 1.36Å | 1.37Å | Aromatic |
| C4 | C19 | sing | 1.41Å | 1.40Å | Aromatic |
| N5 | C8 | doub | 1.30Å | 1.31Å | Aromatic |
| C6 | C10 | sing | 1.55Å | 1.53Å | |
| C6 | O25 | sing | 1.43Å | 1.43Å | |
| C7 | C11 | doub | 1.40Å | 1.44Å | Aromatic |
| C7 | C12 | sing | 1.40Å | 1.36Å | Aromatic |
| C7 | C14 | sing | 1.48Å | 1.45Å | |
| O9 | C13 | sing | 1.44Å | 1.46Å | |
| C10 | C13 | sing | 1.55Å | 1.51Å | |
| C10 | O30 | sing | 1.43Å | 1.41Å | |
| C11 | C17 | sing | 1.39Å | 1.45Å | Aromatic |
| C11 | O31 | sing | 1.36Å | 1.28Å | |
| C12 | C16 | doub | 1.39Å | 1.43Å | Aromatic |
| C13 | C23 | sing | 1.51Å | 1.49Å | |
| C14 | O24 | doub | 1.22Å | 1.25Å | |
| C14 | N26 | sing | 1.35Å | 1.35Å | |
| N15 | C21 | doub | 1.32Å | 1.32Å | Aromatic |
| C16 | C18 | sing | 1.40Å | 1.38Å | Aromatic |
| C16 | C22 | sing | 1.48Å | 1.45Å | Aromatic |
| C17 | C18 | doub | 1.38Å | 1.43Å | Aromatic |
| C17 | O32 | sing | 1.36Å | 1.29Å | |
| C19 | N20 | doub | 1.33Å | 1.32Å | Aromatic |
| C19 | N38 | sing | 1.38Å | 1.39Å | |
| N20 | C21 | sing | 1.32Å | 1.36Å | Aromatic |
| C22 | C28 | doub | 1.39Å | 1.41Å | Aromatic |
| C22 | C29 | sing | 1.39Å | 1.41Å | Aromatic |
| C23 | C27 | doub | 1.31Å | 1.31Å | |
| N26 | C37 | sing | 1.47Å | 1.47Å | |
| C27 | C37 | sing | 1.51Å | 1.48Å | |
| C28 | C34 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | C35 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C34 | doub | 1.39Å | 1.37Å | Aromatic |
| C33 | C35 | sing | 1.39Å | 1.38Å | Aromatic |
| C33 | F36 | sing | 1.35Å | 1.37Å | |
| N38 | C39 | sing | 1.46Å | 1.46Å | |
| C39 | CA | sing | 1.53Å | 1.51Å | |
| CA | OB | sing | 1.43Å | 1.41Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| O25 | HO25 | sing | 0.97Å | 0.95Å | |
| N26 | HN26 | sing | 0.97Å | 1.00Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| O30 | HO30 | sing | 0.97Å | 0.95Å | |
| O31 | HO31 | sing | 0.97Å | 0.95Å | |
| O32 | HO32 | sing | 0.97Å | 0.95Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C35 | H35 | sing | 1.08Å | 1.08Å | |
| C37 | H37 | sing | 1.09Å | 1.10Å | |
| C37 | H37A | sing | 1.09Å | 1.10Å | |
| N38 | HN38 | sing | 0.97Å | 1.00Å | |
| C39 | H39 | sing | 1.09Å | 1.10Å | |
| C39 | H39A | sing | 1.09Å | 1.10Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CA | HAA | sing | 1.09Å | 1.10Å | |
| OB | HOB | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | N1 | C3 | 126.3° | 126.3° |
| C2 | N1 | C8 | 127.3° | 126.3° |
| N1 | C2 | C6 | 114.0° | 109.8° |
| N1 | C2 | O9 | 105.7° | 109.9° |
| N1 | C2 | H2 | 107.8° | 109.8° |
| C3 | N1 | C8 | 105.9° | 107.4° |
| N1 | C3 | C4 | 106.0° | 106.0° |
| N1 | C3 | N15 | 127.7° | 134.9° |
| N1 | C8 | N5 | 111.7° | 109.9° |
| N1 | C8 | H8 | 124.2° | 125.0° |
| C6 | C2 | O9 | 105.0° | 107.3° |
| C2 | C6 | C10 | 102.0° | 104.2° |
| C2 | C6 | O25 | 109.3° | 110.5° |
| C6 | C2 | H2 | 108.3° | 109.9° |
| C2 | C6 | H6 | 116.5° | 110.5° |
| C2 | O9 | C13 | 107.9° | 107.0° |
| O9 | C2 | H2 | 116.3° | 110.0° |
| C4 | C3 | N15 | 126.2° | 119.1° |
| C3 | C4 | N5 | 110.7° | 107.2° |
| C3 | C4 | C19 | 115.2° | 118.2° |
| C3 | N15 | C21 | 114.8° | 120.6° |
| N5 | C4 | C19 | 134.1° | 134.6° |
| C4 | N5 | C8 | 105.7° | 109.4° |
| C4 | C19 | N20 | 119.9° | 118.4° |
| C4 | C19 | N38 | 125.0° | 120.8° |
| N5 | C8 | H8 | 124.1° | 125.0° |
| C10 | C6 | O25 | 115.2° | 110.5° |
| C6 | C10 | C13 | 98.6° | 102.1° |
| C6 | C10 | O30 | 115.1° | 110.9° |
| C10 | C6 | H6 | 110.8° | 110.5° |
| C6 | C10 | H10 | 113.2° | 110.9° |
| O25 | C6 | H6 | 103.6° | 110.6° |
| C6 | O25 | HO25 | 109.5° | 114.0° |
| C11 | C7 | C12 | 120.3° | 119.8° |
| C11 | C7 | C14 | 122.4° | 120.1° |
| C7 | C11 | C17 | 117.6° | 119.9° |
| C7 | C11 | O31 | 125.4° | 120.0° |
| C12 | C7 | C14 | 117.3° | 120.1° |
| C7 | C12 | C16 | 122.4° | 119.9° |
| C7 | C12 | H12 | 118.8° | 120.1° |
| C7 | C14 | O24 | 121.2° | 119.9° |
| C7 | C14 | N26 | 120.0° | 120.0° |
| O9 | C13 | C10 | 107.3° | 103.5° |
| O9 | C13 | C23 | 110.5° | 110.6° |
| O9 | C13 | H13 | 110.4° | 110.6° |
| C13 | C10 | O30 | 110.0° | 110.9° |
| C10 | C13 | C23 | 109.8° | 110.6° |
| C13 | C10 | H10 | 118.0° | 110.9° |
| C10 | C13 | H13 | 111.0° | 110.6° |
| O30 | C10 | H10 | 102.5° | 110.8° |
| C10 | O30 | HO30 | 109.5° | 114.0° |
| C17 | C11 | O31 | 117.0° | 120.0° |
| C11 | C17 | C18 | 120.0° | 120.1° |
| C11 | C17 | O32 | 116.6° | 119.9° |
| C11 | O31 | HO31 | 109.5° | 114.0° |
| C12 | C16 | C18 | 119.3° | 120.1° |
| C12 | C16 | C22 | 120.0° | 120.0° |
| C16 | C12 | H12 | 118.8° | 120.1° |
| C13 | C23 | C27 | 122.3° | 120.0° |
| C23 | C13 | H13 | 107.8° | 110.7° |
| C13 | C23 | H23 | 118.8° | 120.0° |
| O24 | C14 | N26 | 118.7° | 120.0° |
| C14 | N26 | C37 | 120.3° | 120.0° |
| C14 | N26 | HN26 | 119.9° | 120.0° |
| N15 | C21 | N20 | 124.4° | 122.5° |
| N15 | C21 | H21 | 117.8° | 118.8° |
| C18 | C16 | C22 | 120.6° | 119.9° |
| C16 | C18 | C17 | 120.4° | 120.2° |
| C16 | C18 | H18 | 119.8° | 119.9° |
| C16 | C22 | C28 | 120.8° | 120.1° |
| C16 | C22 | C29 | 119.4° | 120.1° |
| C18 | C17 | O32 | 123.4° | 120.0° |
| C17 | C18 | H18 | 119.8° | 119.9° |
| C17 | O32 | HO32 | 109.5° | 114.0° |
| N20 | C19 | N38 | 115.2° | 120.7° |
| C19 | N20 | C21 | 119.5° | 121.2° |
| C19 | N38 | C39 | 124.3° | 120.0° |
| C19 | N38 | HN38 | 104.8° | 119.9° |
| N20 | C21 | H21 | 117.8° | 118.8° |
| C28 | C22 | C29 | 119.8° | 119.8° |
| C22 | C28 | C34 | 120.3° | 119.9° |
| C22 | C28 | H28 | 119.9° | 120.0° |
| C22 | C29 | C35 | 119.5° | 119.9° |
| C22 | C29 | H29 | 120.2° | 120.0° |
| C23 | C27 | C37 | 124.8° | 120.0° |
| C27 | C23 | H23 | 118.8° | 120.0° |
| C23 | C27 | H27 | 117.6° | 120.0° |
| N26 | C37 | C27 | 106.5° | 109.5° |
| C37 | N26 | HN26 | 119.9° | 120.0° |
| N26 | C37 | H37 | 110.5° | 109.5° |
| N26 | C37 | H37A | 111.1° | 109.4° |
| C37 | C27 | H27 | 117.6° | 120.0° |
| C27 | C37 | H37 | 110.5° | 109.5° |
| C27 | C37 | H37A | 111.1° | 109.5° |
| C28 | C34 | C33 | 117.5° | 120.1° |
| C34 | C28 | H28 | 119.8° | 120.1° |
| C28 | C34 | H34 | 121.2° | 119.9° |
| C29 | C35 | C33 | 118.0° | 120.1° |
| C35 | C29 | H29 | 120.3° | 120.1° |
| C29 | C35 | H35 | 121.0° | 120.0° |
| C34 | C33 | C35 | 124.6° | 120.2° |
| C34 | C33 | F36 | 115.5° | 119.9° |
| C33 | C34 | H34 | 121.2° | 119.9° |
| C35 | C33 | F36 | 119.6° | 119.9° |
| C33 | C35 | H35 | 121.0° | 119.9° |
| N38 | C39 | CA | 111.8° | 109.5° |
| C39 | N38 | HN38 | 104.8° | 120.1° |
| N38 | C39 | H39 | 108.7° | 109.5° |
| N38 | C39 | H39A | 108.2° | 109.5° |
| C39 | CA | OB | 110.5° | 109.4° |
| CA | C39 | H39 | 108.7° | 109.5° |
| CA | C39 | H39A | 108.2° | 109.4° |
| C39 | CA | HA | 109.1° | 109.5° |
| C39 | CA | HAA | 108.9° | 109.5° |
| OB | CA | HA | 109.1° | 109.5° |
| OB | CA | HAA | 108.9° | 109.5° |
| CA | OB | HOB | 109.5° | 114.0° |
| H37 | C37 | H37A | 107.2° | 109.5° |
| H39 | C39 | H39A | 111.3° | 109.5° |
| HA | CA | HAA | 110.3° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | N1 | C3 | C8 | 172.4° | 179.7° |
| N1 | C2 | C6 | O9 | 115.2° | 119.4° |
| N1 | C2 | C6 | H2 | 119.9° | 121.0° |
| N1 | C2 | O9 | H2 | 119.5° | 121.1° |
| C2 | N1 | C3 | C4 | 171.9° | 180.0° |
| C2 | N1 | C3 | N15 | 5.8° | 0.0° |
| C2 | N1 | C8 | N5 | 172.9° | 179.8° |
| N1 | C2 | C6 | C10 | 151.8° | 121.4° |
| N1 | C2 | C6 | O25 | 85.8° | 119.9° |
| N1 | C2 | O9 | C13 | 135.5° | 145.9° |
| N1 | C2 | C6 | H6 | 31.1° | 2.8° |
| C2 | N1 | C8 | H8 | 7.1° | 0.0° |
| C3 | N1 | C2 | C6 | 139.2° | 85.0° |
| C3 | N1 | C2 | O9 | 106.0° | 157.2° |
| N1 | C3 | C4 | N15 | 177.7° | 180.0° |
| N1 | C3 | C4 | N5 | 1.5° | 0.0° |
| N1 | C3 | C4 | C19 | 179.1° | 180.0° |
| C3 | N1 | C8 | N5 | 0.7° | 0.4° |
| N1 | C3 | N15 | C21 | 177.9° | 180.0° |
| C3 | N1 | C2 | H2 | 19.0° | 36.0° |
| C3 | N1 | C8 | H8 | 179.3° | 179.8° |
| C8 | N1 | C2 | C6 | 50.1° | 95.3° |
| C8 | N1 | C2 | O9 | 64.7° | 22.5° |
| C8 | N1 | C3 | C4 | 0.5° | 0.2° |
| C8 | N1 | C3 | N15 | 178.2° | 179.7° |
| N1 | C8 | N5 | C4 | 1.5° | 0.4° |
| N1 | C8 | N5 | H8 | 180.0° | 179.8° |
| C8 | N1 | C2 | H2 | 170.3° | 143.7° |
| C6 | C2 | O9 | H2 | 119.7° | 119.5° |
| C2 | C6 | C10 | O25 | 118.3° | 118.7° |
| C2 | C6 | C10 | H6 | 124.6° | 118.7° |
| C2 | C6 | O25 | H6 | 124.8° | 122.7° |
| C6 | C2 | O9 | C13 | 14.7° | 26.5° |
| C2 | C6 | C10 | C13 | 42.5° | 20.9° |
| C2 | C6 | C10 | O30 | 74.4° | 139.0° |
| C2 | C6 | C10 | H10 | 168.1° | 97.3° |
| C2 | C6 | O25 | HO25 | 175.4° | 180.0° |
| O9 | C2 | C6 | C10 | 36.6° | 2.0° |
| O9 | C2 | C6 | O25 | 159.0° | 120.7° |
| C2 | O9 | C13 | C10 | 13.5° | 40.1° |
| C2 | O9 | C13 | C23 | 106.3° | 158.6° |
| O9 | C2 | C6 | H6 | 84.1° | 116.6° |
| C2 | O9 | C13 | H13 | 134.6° | 78.4° |
| C3 | C4 | N5 | C19 | 179.3° | 180.0° |
| C3 | C4 | N5 | C8 | 1.9° | 0.3° |
| C4 | C3 | N15 | C21 | 0.7° | 0.0° |
| C3 | C4 | C19 | N20 | 1.7° | 0.0° |
| C3 | C4 | C19 | N38 | 177.7° | 180.0° |
| N15 | C3 | C4 | N5 | 179.2° | 180.0° |
| N15 | C3 | C4 | C19 | 1.3° | 0.0° |
| C3 | N15 | C21 | N20 | 0.3° | 0.0° |
| C3 | N15 | C21 | H21 | 179.7° | 179.9° |
| N5 | C4 | C19 | N20 | 179.0° | 180.0° |
| N5 | C4 | C19 | N38 | 1.6° | 0.0° |
| C4 | N5 | C8 | H8 | 178.5° | 179.7° |
| C19 | C4 | N5 | C8 | 178.8° | 179.7° |
| C4 | C19 | N20 | N38 | 179.4° | 180.0° |
| C4 | C19 | N20 | C21 | 1.4° | 0.1° |
| C4 | C19 | N38 | C39 | 5.4° | 180.0° |
| C4 | C19 | N38 | HN38 | 125.4° | 0.0° |
| C10 | C6 | O25 | H6 | 121.1° | 122.6° |
| C6 | C10 | C13 | O9 | 35.0° | 37.0° |
| C6 | C10 | C13 | O30 | 120.8° | 118.2° |
| C6 | C10 | C13 | H10 | 122.2° | 118.2° |
| C6 | C10 | O30 | H10 | 123.4° | 123.7° |
| C6 | C10 | C13 | C23 | 85.2° | 155.5° |
| C10 | C6 | C2 | H2 | 88.3° | 117.6° |
| C6 | C10 | C13 | H13 | 155.7° | 81.5° |
| C10 | C6 | O25 | HO25 | 61.3° | 65.2° |
| C6 | C10 | O30 | HO30 | 118.3° | 180.0° |
| O25 | C6 | C10 | C13 | 160.8° | 97.8° |
| O25 | C6 | C10 | O30 | 43.8° | 20.4° |
| O25 | C6 | C2 | H2 | 34.1° | 1.1° |
| O25 | C6 | C10 | H10 | 73.6° | 144.0° |
| C11 | C7 | C12 | C14 | 179.3° | 179.7° |
| C7 | C11 | C17 | O31 | 177.5° | 180.0° |
| C11 | C7 | C12 | C16 | 0.9° | 0.0° |
| C11 | C7 | C14 | O24 | 169.0° | 0.0° |
| C11 | C7 | C14 | N26 | 7.8° | 180.0° |
| C7 | C11 | C17 | C18 | 1.5° | 0.0° |
| C7 | C11 | C17 | O32 | 179.3° | 180.0° |
| C11 | C7 | C12 | H12 | 179.2° | 180.0° |
| C7 | C11 | O31 | HO31 | 84.3° | 90.0° |
| C12 | C7 | C11 | C17 | 1.8° | 0.0° |
| C12 | C7 | C11 | O31 | 175.4° | 180.0° |
| C7 | C12 | C16 | H12 | 180.0° | 180.0° |
| C12 | C7 | C14 | O24 | 11.7° | 179.8° |
| C12 | C7 | C14 | N26 | 171.5° | 0.3° |
| C7 | C12 | C16 | C18 | 0.5° | 0.0° |
| C7 | C12 | C16 | C22 | 178.9° | 180.0° |
| C14 | C7 | C11 | C17 | 177.4° | 179.7° |
| C14 | C7 | C11 | O31 | 5.4° | 0.3° |
| C14 | C7 | C12 | C16 | 178.4° | 179.7° |
| C7 | C14 | O24 | N26 | 176.8° | 179.9° |
| C7 | C14 | N26 | C37 | 174.7° | 180.0° |
| C14 | C7 | C12 | H12 | 1.5° | 0.3° |
| C7 | C14 | N26 | HN26 | 5.4° | 0.1° |
| O9 | C13 | C10 | C23 | 120.2° | 118.5° |
| O9 | C13 | C10 | H13 | 120.7° | 118.5° |
| O9 | C13 | C10 | O30 | 85.8° | 155.2° |
| O9 | C13 | C23 | H13 | 120.7° | 123.0° |
| O9 | C13 | C23 | C27 | 89.3° | 6.4° |
| C13 | O9 | C2 | H2 | 105.1° | 93.0° |
| O9 | C13 | C10 | H10 | 157.2° | 81.2° |
| O9 | C13 | C23 | H23 | 90.7° | 173.6° |
| C13 | C10 | O30 | H10 | 126.4° | 123.7° |
| C10 | C13 | C23 | H13 | 121.1° | 122.9° |
| C10 | C13 | C23 | C27 | 152.5° | 120.5° |
| C13 | C10 | C6 | H6 | 82.1° | 139.6° |
| C10 | C13 | C23 | H23 | 27.5° | 59.5° |
| C13 | C10 | O30 | HO30 | 131.5° | 67.3° |
| O30 | C10 | C13 | C23 | 154.1° | 86.3° |
| O30 | C10 | C6 | H6 | 161.0° | 102.3° |
| O30 | C10 | C13 | H13 | 34.9° | 36.7° |
| C11 | C17 | C18 | C16 | 0.2° | 0.0° |
| C11 | C17 | C18 | O32 | 179.1° | 179.9° |
| C11 | C17 | C18 | H18 | 179.7° | 180.0° |
| C17 | C11 | O31 | HO31 | 98.4° | 90.0° |
| C11 | C17 | O32 | HO32 | 55.3° | 90.1° |
| O31 | C11 | C17 | C18 | 175.9° | 180.0° |
| O31 | C11 | C17 | O32 | 3.2° | 0.0° |
| C12 | C16 | C18 | C22 | 178.4° | 180.0° |
| C12 | C16 | C18 | C17 | 0.8° | 0.0° |
| C12 | C16 | C22 | C28 | 143.0° | 180.0° |
| C12 | C16 | C22 | C29 | 34.4° | 0.3° |
| C12 | C16 | C18 | H18 | 179.2° | 180.0° |
| C13 | C23 | C27 | H23 | 180.0° | 180.0° |
| C13 | C23 | C27 | C37 | 179.8° | 180.0° |
| C23 | C13 | C10 | H10 | 37.0° | 37.3° |
| C13 | C23 | C27 | H27 | 0.2° | 0.0° |
| O24 | C14 | N26 | C37 | 8.5° | 0.1° |
| O24 | C14 | N26 | HN26 | 171.5° | 180.0° |
| C14 | N26 | C37 | HN26 | 180.0° | 179.9° |
| C14 | N26 | C37 | C27 | 148.0° | 180.0° |
| C14 | N26 | C37 | H37 | 92.0° | 60.0° |
| C14 | N26 | C37 | H37A | 26.8° | 60.1° |
| N15 | C21 | N20 | C19 | 0.7° | 0.1° |
| N15 | C21 | N20 | H21 | 180.0° | 179.9° |
| C16 | C18 | C17 | H18 | 180.0° | 179.9° |
| C16 | C18 | C17 | O32 | 179.3° | 180.0° |
| C18 | C16 | C22 | C28 | 38.6° | 0.0° |
| C18 | C16 | C22 | C29 | 144.0° | 179.7° |
| C18 | C16 | C12 | H12 | 179.5° | 180.0° |
| C22 | C16 | C18 | C17 | 179.2° | 180.0° |
| C16 | C22 | C28 | C29 | 177.4° | 179.7° |
| C16 | C22 | C28 | C34 | 178.5° | 180.0° |
| C16 | C22 | C29 | C35 | 179.4° | 180.0° |
| C22 | C16 | C12 | H12 | 1.0° | 0.0° |
| C22 | C16 | C18 | H18 | 0.8° | 0.1° |
| C16 | C22 | C28 | H28 | 1.5° | 0.0° |
| C16 | C22 | C29 | H29 | 0.6° | 0.0° |
| C18 | C17 | O32 | HO32 | 123.8° | 90.0° |
| O32 | C17 | C18 | H18 | 0.7° | 0.1° |
| N20 | C19 | N38 | C39 | 174.0° | 0.0° |
| C19 | N20 | C21 | H21 | 179.3° | 180.0° |
| N20 | C19 | N38 | HN38 | 54.0° | 180.0° |
| N38 | C19 | N20 | C21 | 178.0° | 180.0° |
| C19 | N38 | C39 | HN38 | 120.0° | 180.0° |
| C19 | N38 | C39 | CA | 73.0° | 179.9° |
| C19 | N38 | C39 | H39 | 167.0° | 60.0° |
| C19 | N38 | C39 | H39A | 46.0° | 60.0° |
| C22 | C28 | C34 | H28 | 180.0° | 180.0° |
| C28 | C22 | C29 | C35 | 3.2° | 0.2° |
| C22 | C28 | C34 | C33 | 4.4° | 0.0° |
| C28 | C22 | C29 | H29 | 176.8° | 179.7° |
| C22 | C28 | C34 | H34 | 175.6° | 180.0° |
| C29 | C22 | C28 | C34 | 4.1° | 0.3° |
| C22 | C29 | C35 | H29 | 180.0° | 180.0° |
| C22 | C29 | C35 | C33 | 2.6° | 0.0° |
| C29 | C22 | C28 | H28 | 175.9° | 179.8° |
| C22 | C29 | C35 | H35 | 177.4° | 180.0° |
| C23 | C27 | C37 | N26 | 144.8° | 125.0° |
| C23 | C27 | C37 | H27 | 180.0° | 180.0° |
| C27 | C23 | C13 | H13 | 31.4° | 116.5° |
| C23 | C27 | C37 | H37 | 95.2° | 5.0° |
| C23 | C27 | C37 | H37A | 23.6° | 115.0° |
| N26 | C37 | C27 | H37 | 120.0° | 120.0° |
| N26 | C37 | C27 | H37A | 121.1° | 119.9° |
| N26 | C37 | C27 | H27 | 35.2° | 54.9° |
| N26 | C37 | H37 | H37A | 121.2° | 120.0° |
| C37 | C27 | C23 | H23 | 0.2° | 0.0° |
| C27 | C37 | N26 | HN26 | 32.0° | 0.0° |
| C27 | C37 | H37 | H37A | 121.2° | 120.0° |
| C28 | C34 | C33 | H34 | 180.0° | 180.0° |
| C28 | C34 | C33 | C35 | 4.1° | 0.2° |
| C28 | C34 | C33 | F36 | 178.8° | 179.9° |
| C29 | C35 | C33 | C34 | 3.3° | 0.2° |
| C29 | C35 | C33 | H35 | 180.0° | 180.0° |
| C29 | C35 | C33 | F36 | 177.8° | 179.9° |
| C34 | C33 | C35 | F36 | 174.5° | 179.8° |
| C33 | C34 | C28 | H28 | 175.6° | 180.0° |
| C34 | C33 | C35 | H35 | 176.8° | 179.7° |
| C33 | C35 | C29 | H29 | 177.4° | 180.0° |
| C35 | C33 | C34 | H34 | 175.9° | 179.8° |
| F36 | C33 | C34 | H34 | 1.2° | 0.0° |
| F36 | C33 | C35 | H35 | 2.3° | 0.1° |
| N38 | C39 | CA | H39 | 120.0° | 120.1° |
| N38 | C39 | CA | H39A | 119.0° | 120.0° |
| N38 | C39 | CA | OB | 75.4° | 65.0° |
| N38 | C39 | H39 | H39A | 119.0° | 120.0° |
| N38 | C39 | CA | HA | 164.6° | 175.0° |
| N38 | C39 | CA | HAA | 44.2° | 54.9° |
| C39 | CA | OB | HA | 120.0° | 120.0° |
| C39 | CA | OB | HAA | 119.5° | 120.0° |
| CA | C39 | N38 | HN38 | 47.0° | 0.1° |
| CA | C39 | H39 | H39A | 119.0° | 119.9° |
| C39 | CA | HA | HAA | 119.5° | 120.0° |
| C39 | CA | OB | HOB | 163.6° | 180.0° |
| OB | CA | C39 | H39 | 44.6° | 55.0° |
| OB | CA | C39 | H39A | 165.6° | 175.0° |
| OB | CA | HA | HAA | 119.6° | 120.0° |
| H2 | C2 | C6 | H6 | 151.0° | 123.7° |
| H6 | C6 | C10 | H10 | 43.5° | 21.3° |
| H6 | C6 | O25 | HO25 | 59.8° | 57.4° |
| H10 | C10 | C13 | H13 | 82.2° | 160.3° |
| H10 | C10 | O30 | HO30 | 5.1° | 56.4° |
| H13 | C13 | C23 | H23 | 148.6° | 63.5° |
| H23 | C23 | C27 | H27 | 179.8° | 180.0° |
| HN26 | N26 | C37 | H37 | 88.0° | 120.0° |
| HN26 | N26 | C37 | H37A | 153.2° | 120.0° |
| H27 | C27 | C37 | H37 | 84.8° | 174.9° |
| H27 | C27 | C37 | H37A | 156.3° | 65.0° |
| H28 | C28 | C34 | H34 | 4.4° | 0.0° |
| H29 | C29 | C35 | H35 | 2.6° | 0.0° |
| HN38 | N38 | C39 | H39 | 73.0° | 120.0° |
| HN38 | N38 | C39 | H39A | 166.0° | 120.0° |
| H39 | C39 | CA | HA | 75.4° | 65.0° |
| H39 | C39 | CA | HAA | 164.2° | 175.0° |
| H39A | C39 | CA | HA | 45.6° | 55.0° |
| H39A | C39 | CA | HAA | 74.9° | 65.0° |
| HA | CA | OB | HOB | 76.4° | 60.0° |
| HAA | CA | OB | HOB | 44.1° | 60.0° |
