KJ8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O33 | C29 | doub | 1.21Å | 1.22Å | |
| C24 | C25 | doub | 1.38Å | 1.40Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.40Å | Aromatic |
| C25 | C26 | sing | 1.39Å | 1.41Å | Aromatic |
| C34 | N32 | sing | 1.47Å | 1.48Å | |
| C31 | N32 | sing | 1.47Å | 1.48Å | |
| C31 | C30 | sing | 1.53Å | 1.53Å | |
| C35 | N32 | sing | 1.47Å | 1.48Å | |
| C29 | C30 | sing | 1.51Å | 1.56Å | |
| C29 | N28 | sing | 1.35Å | 1.36Å | |
| C23 | C16 | doub | 1.40Å | 1.40Å | Aromatic |
| C26 | N28 | sing | 1.40Å | 1.37Å | |
| C26 | C27 | doub | 1.39Å | 1.41Å | Aromatic |
| C12 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C10 | sing | 1.40Å | 1.40Å | Aromatic |
| C13 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C16 | C27 | sing | 1.39Å | 1.41Å | Aromatic |
| C16 | C1 | sing | 1.48Å | 1.36Å | |
| C | O | sing | 1.43Å | 1.42Å | |
| C | CA | sing | 1.53Å | 1.51Å | |
| C10 | C15 | doub | 1.40Å | 1.40Å | Aromatic |
| C10 | C2 | sing | 1.47Å | 1.33Å | |
| C14 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C18 | C19 | doub | 1.38Å | 1.40Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | C2 | doub | 1.37Å | 1.36Å | Aromatic |
| C1 | C5 | sing | 1.47Å | 1.37Å | Aromatic |
| N | CA | sing | 1.47Å | 1.49Å | |
| N | C9 | sing | 1.38Å | 1.36Å | |
| C2 | O3 | sing | 1.35Å | 1.33Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | CA | sing | 1.51Å | 1.43Å | |
| C17 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.40Å | Aromatic |
| C5 | C9 | doub | 1.40Å | 1.37Å | Aromatic |
| C5 | C4 | sing | 1.40Å | 1.36Å | Aromatic |
| C9 | N8 | sing | 1.33Å | 1.35Å | Aromatic |
| O3 | C4 | sing | 1.34Å | 1.34Å | Aromatic |
| C4 | N6 | doub | 1.33Å | 1.34Å | Aromatic |
| N8 | C7 | doub | 1.32Å | 1.39Å | Aromatic |
| N6 | C7 | sing | 1.32Å | 1.39Å | Aromatic |
| C35 | H1 | sing | 1.09Å | 1.10Å | |
| C35 | H2 | sing | 1.09Å | 1.10Å | |
| C35 | H3 | sing | 1.09Å | 1.10Å | |
| C34 | H5 | sing | 1.09Å | 1.10Å | |
| C34 | H6 | sing | 1.09Å | 1.10Å | |
| C34 | H7 | sing | 1.09Å | 1.10Å | |
| C31 | H8 | sing | 1.09Å | 1.10Å | |
| C31 | H9 | sing | 1.09Å | 1.10Å | |
| C30 | H10 | sing | 1.09Å | 1.10Å | |
| C30 | H11 | sing | 1.09Å | 1.10Å | |
| N28 | H12 | sing | 0.97Å | 1.00Å | |
| C27 | H13 | sing | 1.08Å | 1.08Å | |
| C25 | H14 | sing | 1.08Å | 1.08Å | |
| C24 | H15 | sing | 1.08Å | 1.08Å | |
| C23 | H16 | sing | 1.08Å | 1.08Å | |
| C11 | H17 | sing | 1.08Å | 1.08Å | |
| C12 | H18 | sing | 1.08Å | 1.08Å | |
| C13 | H19 | sing | 1.08Å | 1.08Å | |
| C14 | H20 | sing | 1.08Å | 1.08Å | |
| C15 | H21 | sing | 1.08Å | 1.08Å | |
| C7 | H22 | sing | 1.08Å | 1.08Å | |
| N | H23 | sing | 0.97Å | 1.00Å | |
| CA | H24 | sing | 1.09Å | 1.10Å | |
| C | H25 | sing | 1.09Å | 1.10Å | |
| C | H26 | sing | 1.09Å | 1.10Å | |
| O | H27 | sing | 0.97Å | 0.95Å | |
| C18 | H28 | sing | 1.08Å | 1.08Å | |
| C19 | H29 | sing | 1.08Å | 1.08Å | |
| C20 | H30 | sing | 1.08Å | 1.08Å | |
| C21 | H31 | sing | 1.08Å | 1.08Å | |
| C22 | H32 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O33 | C29 | C30 | 119.4° | 120.0° |
| O33 | C29 | N28 | 123.4° | 120.0° |
| C25 | C24 | C23 | 121.4° | 120.2° |
| C24 | C25 | C26 | 119.8° | 120.2° |
| C24 | C25 | H14 | 120.1° | 119.9° |
| C25 | C24 | H15 | 119.3° | 119.9° |
| C24 | C23 | C16 | 120.5° | 120.0° |
| C23 | C24 | H15 | 119.3° | 119.9° |
| C24 | C23 | H16 | 119.7° | 120.0° |
| C25 | C26 | N28 | 125.0° | 120.0° |
| C25 | C26 | C27 | 117.6° | 120.0° |
| C26 | C25 | H14 | 120.1° | 119.9° |
| C34 | N32 | C31 | 113.8° | 111.0° |
| C34 | N32 | C35 | 109.9° | 111.0° |
| N32 | C34 | H5 | 109.5° | 109.4° |
| N32 | C34 | H6 | 109.5° | 109.5° |
| N32 | C34 | H7 | 109.5° | 109.5° |
| N32 | C31 | C30 | 110.4° | 109.5° |
| C31 | N32 | C35 | 114.4° | 111.0° |
| N32 | C31 | H8 | 109.2° | 109.5° |
| N32 | C31 | H9 | 109.3° | 109.5° |
| C31 | C30 | C29 | 109.1° | 109.5° |
| C30 | C31 | H8 | 109.3° | 109.4° |
| C30 | C31 | H9 | 109.2° | 109.4° |
| C31 | C30 | H10 | 109.6° | 109.5° |
| C31 | C30 | H11 | 109.6° | 109.4° |
| N32 | C35 | H1 | 109.5° | 109.5° |
| N32 | C35 | H2 | 109.5° | 109.5° |
| N32 | C35 | H3 | 109.5° | 109.5° |
| C30 | C29 | N28 | 116.9° | 120.0° |
| C29 | C30 | H10 | 109.6° | 109.5° |
| C29 | C30 | H11 | 109.6° | 109.4° |
| C29 | N28 | C26 | 121.2° | 120.0° |
| C29 | N28 | H12 | 119.4° | 120.0° |
| C23 | C16 | C27 | 117.3° | 119.7° |
| C23 | C16 | C1 | 121.6° | 120.1° |
| C16 | C23 | H16 | 119.7° | 119.9° |
| N28 | C26 | C27 | 117.4° | 120.0° |
| C26 | N28 | H12 | 119.4° | 120.0° |
| C26 | C27 | C16 | 123.3° | 119.8° |
| C26 | C27 | H13 | 118.3° | 120.1° |
| C11 | C12 | C13 | 120.3° | 120.1° |
| C12 | C11 | C10 | 119.8° | 119.9° |
| C12 | C11 | H17 | 120.1° | 120.1° |
| C11 | C12 | H18 | 119.8° | 119.9° |
| C12 | C13 | C14 | 120.4° | 120.4° |
| C13 | C12 | H18 | 119.8° | 119.9° |
| C12 | C13 | H19 | 119.8° | 119.8° |
| C11 | C10 | C15 | 119.1° | 119.6° |
| C11 | C10 | C2 | 123.6° | 120.2° |
| C10 | C11 | H17 | 120.1° | 120.1° |
| C13 | C14 | C15 | 119.6° | 120.1° |
| C14 | C13 | H19 | 119.8° | 119.8° |
| C13 | C14 | H20 | 120.2° | 120.0° |
| C27 | C16 | C1 | 121.1° | 120.1° |
| C16 | C27 | H13 | 118.4° | 120.1° |
| C16 | C1 | C2 | 127.6° | 127.2° |
| C16 | C1 | C5 | 124.9° | 127.2° |
| O | C | CA | 109.7° | 109.5° |
| O | C | H25 | 109.4° | 109.4° |
| O | C | H26 | 109.4° | 109.5° |
| C | O | H27 | 109.5° | 114.0° |
| C | CA | N | 110.7° | 109.5° |
| C | CA | C17 | 107.5° | 109.5° |
| C | CA | H24 | 107.8° | 109.5° |
| CA | C | H25 | 109.4° | 109.4° |
| CA | C | H26 | 109.4° | 109.5° |
| C15 | C10 | C2 | 117.1° | 120.2° |
| C10 | C15 | C14 | 120.7° | 119.9° |
| C10 | C15 | H21 | 119.6° | 120.1° |
| C10 | C2 | C1 | 132.1° | 125.2° |
| C10 | C2 | O3 | 118.7° | 125.3° |
| C15 | C14 | H20 | 120.2° | 119.9° |
| C14 | C15 | H21 | 119.7° | 120.0° |
| C19 | C18 | C17 | 121.1° | 120.0° |
| C18 | C19 | C20 | 120.8° | 120.0° |
| C19 | C18 | H28 | 119.4° | 120.0° |
| C18 | C19 | H29 | 119.6° | 120.0° |
| C18 | C17 | CA | 123.2° | 120.0° |
| C18 | C17 | C22 | 117.3° | 120.0° |
| C17 | C18 | H28 | 119.4° | 120.0° |
| C19 | C20 | C21 | 118.7° | 120.0° |
| C20 | C19 | H29 | 119.6° | 120.0° |
| C19 | C20 | H30 | 120.7° | 120.0° |
| C2 | C1 | C5 | 107.5° | 105.7° |
| C1 | C2 | O3 | 109.1° | 109.5° |
| C1 | C5 | C9 | 135.4° | 135.2° |
| C1 | C5 | C4 | 106.2° | 105.8° |
| CA | N | C9 | 123.5° | 120.0° |
| N | CA | C17 | 113.9° | 109.4° |
| CA | N | H23 | 105.9° | 120.0° |
| N | CA | H24 | 108.0° | 109.5° |
| N | C9 | C5 | 120.1° | 120.9° |
| N | C9 | N8 | 118.7° | 120.9° |
| C9 | N | H23 | 105.8° | 120.0° |
| C2 | O3 | C4 | 107.7° | 111.3° |
| C20 | C21 | C22 | 120.5° | 120.0° |
| C21 | C20 | H30 | 120.6° | 120.0° |
| C20 | C21 | H31 | 119.7° | 120.0° |
| CA | C17 | C22 | 119.6° | 120.0° |
| C17 | CA | H24 | 108.8° | 109.5° |
| C17 | C22 | C21 | 121.6° | 120.0° |
| C17 | C22 | H32 | 119.2° | 120.0° |
| C22 | C21 | H31 | 119.8° | 120.0° |
| C21 | C22 | H32 | 119.2° | 120.0° |
| C9 | C5 | C4 | 118.3° | 118.9° |
| C5 | C9 | N8 | 121.2° | 118.3° |
| C5 | C4 | O3 | 109.5° | 107.7° |
| C5 | C4 | N6 | 122.6° | 118.4° |
| C9 | N8 | C7 | 120.2° | 120.9° |
| O3 | C4 | N6 | 127.9° | 133.9° |
| C4 | N6 | C7 | 119.1° | 120.8° |
| N8 | C7 | N6 | 118.6° | 122.8° |
| N8 | C7 | H22 | 120.7° | 118.6° |
| N6 | C7 | H22 | 120.7° | 118.6° |
| H1 | C35 | H2 | 109.5° | 109.4° |
| H1 | C35 | H3 | 109.5° | 109.5° |
| H2 | C35 | H3 | 109.4° | 109.5° |
| H5 | C34 | H6 | 109.4° | 109.5° |
| H5 | C34 | H7 | 109.5° | 109.5° |
| H6 | C34 | H7 | 109.5° | 109.5° |
| H8 | C31 | H9 | 109.5° | 109.5° |
| H10 | C30 | H11 | 109.5° | 109.5° |
| H25 | C | H26 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O33 | C29 | C30 | C31 | 40.9° | 0.1° |
| O33 | C29 | C30 | N28 | 174.2° | 179.9° |
| O33 | C29 | N28 | C26 | 4.2° | 4.9° |
| O33 | C29 | C30 | H10 | 160.9° | 120.0° |
| O33 | C29 | C30 | H11 | 79.0° | 120.0° |
| O33 | C29 | N28 | H12 | 175.8° | 175.2° |
| C25 | C24 | C23 | H15 | 180.0° | 179.9° |
| C24 | C25 | C26 | H14 | 180.0° | 180.0° |
| C25 | C24 | C23 | C16 | 0.9° | 0.2° |
| C24 | C25 | C26 | N28 | 179.4° | 180.0° |
| C24 | C25 | C26 | C27 | 0.6° | 0.3° |
| C25 | C24 | C23 | H16 | 179.1° | 180.0° |
| C23 | C24 | C25 | C26 | 0.0° | 0.0° |
| C24 | C23 | C16 | H16 | 180.0° | 179.8° |
| C24 | C23 | C16 | C27 | 1.1° | 0.2° |
| C24 | C23 | C16 | C1 | 179.2° | 180.0° |
| C23 | C24 | C25 | H14 | 180.0° | 180.0° |
| C25 | C26 | N28 | C29 | 13.2° | 146.5° |
| C25 | C26 | N28 | C27 | 180.0° | 179.7° |
| C25 | C26 | C27 | C16 | 0.5° | 0.3° |
| C25 | C26 | N28 | H12 | 166.8° | 33.6° |
| C25 | C26 | C27 | H13 | 179.5° | 179.7° |
| C26 | C25 | C24 | H15 | 180.0° | 180.0° |
| C34 | N32 | C31 | C35 | 127.5° | 124.0° |
| C34 | N32 | C31 | C30 | 99.8° | 66.1° |
| C34 | N32 | C35 | H1 | 180.0° | 56.1° |
| C34 | N32 | C35 | H2 | 60.0° | 176.0° |
| C34 | N32 | C35 | H3 | 60.0° | 63.9° |
| N32 | C34 | H5 | H6 | 120.0° | 120.0° |
| N32 | C34 | H5 | H7 | 120.0° | 120.0° |
| N32 | C34 | H6 | H7 | 120.0° | 120.0° |
| C34 | N32 | C31 | H8 | 140.0° | 53.9° |
| C34 | N32 | C31 | H9 | 20.3° | 174.0° |
| N32 | C31 | C30 | H8 | 120.1° | 120.0° |
| N32 | C31 | C30 | H9 | 120.2° | 120.0° |
| N32 | C31 | C30 | C29 | 122.4° | 179.9° |
| C31 | N32 | C35 | H1 | 50.6° | 180.0° |
| C31 | N32 | C35 | H2 | 170.6° | 60.0° |
| C31 | N32 | C35 | H3 | 69.5° | 60.1° |
| C31 | N32 | C34 | H5 | 180.0° | 63.9° |
| C31 | N32 | C34 | H6 | 60.0° | 56.1° |
| C31 | N32 | C34 | H7 | 60.0° | 176.0° |
| N32 | C31 | H8 | H9 | 119.6° | 120.1° |
| N32 | C31 | C30 | H10 | 2.5° | 60.0° |
| N32 | C31 | C30 | H11 | 117.6° | 60.0° |
| C30 | C31 | N32 | C35 | 132.7° | 170.0° |
| C31 | C30 | C29 | H10 | 119.9° | 120.0° |
| C31 | C30 | C29 | H11 | 120.0° | 120.0° |
| C31 | C30 | C29 | N28 | 144.9° | 180.0° |
| C30 | C31 | H8 | H9 | 119.6° | 120.0° |
| C31 | C30 | H10 | H11 | 120.1° | 120.0° |
| N32 | C35 | H1 | H2 | 120.0° | 120.0° |
| N32 | C35 | H1 | H3 | 120.0° | 120.0° |
| N32 | C35 | H2 | H3 | 120.0° | 120.1° |
| C35 | N32 | C34 | H5 | 50.3° | 60.0° |
| C35 | N32 | C34 | H6 | 170.2° | 180.0° |
| C35 | N32 | C34 | H7 | 69.8° | 60.0° |
| C35 | N32 | C31 | H8 | 12.6° | 70.1° |
| C35 | N32 | C31 | H9 | 107.1° | 50.0° |
| C30 | C29 | N28 | C26 | 178.1° | 175.2° |
| C29 | C30 | C31 | H8 | 117.4° | 60.0° |
| C29 | C30 | C31 | H9 | 2.3° | 60.0° |
| C29 | C30 | H10 | H11 | 120.2° | 120.0° |
| C30 | C29 | N28 | H12 | 1.9° | 4.7° |
| C29 | N28 | C26 | H12 | 180.0° | 179.9° |
| C29 | N28 | C26 | C27 | 166.8° | 33.2° |
| N28 | C29 | C30 | H10 | 24.9° | 59.9° |
| N28 | C29 | C30 | H11 | 95.2° | 60.1° |
| C23 | C16 | C27 | C26 | 0.4° | 0.0° |
| C23 | C16 | C27 | C1 | 178.2° | 179.7° |
| C23 | C16 | C1 | C2 | 57.3° | 112.8° |
| C23 | C16 | C1 | C5 | 120.5° | 67.0° |
| C23 | C16 | C27 | H13 | 179.7° | 180.0° |
| C16 | C23 | C24 | H15 | 179.1° | 179.7° |
| N28 | C26 | C27 | C16 | 179.5° | 180.0° |
| N28 | C26 | C27 | H13 | 0.5° | 0.0° |
| N28 | C26 | C25 | H14 | 0.6° | 0.0° |
| C26 | C27 | C16 | H13 | 180.0° | 179.9° |
| C26 | C27 | C16 | C1 | 178.5° | 179.7° |
| C27 | C26 | N28 | H12 | 13.2° | 146.7° |
| C27 | C26 | C25 | H14 | 179.3° | 179.7° |
| C11 | C12 | C13 | H18 | 180.0° | 180.0° |
| C12 | C11 | C10 | H17 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 0.1° | 0.0° |
| C12 | C11 | C10 | C15 | 3.6° | 0.1° |
| C12 | C11 | C10 | C2 | 177.9° | 179.7° |
| C11 | C12 | C13 | H19 | 179.9° | 180.0° |
| C13 | C12 | C11 | C10 | 2.2° | 0.0° |
| C12 | C13 | C14 | H19 | 180.0° | 179.9° |
| C12 | C13 | C14 | C15 | 0.7° | 0.0° |
| C13 | C12 | C11 | H17 | 177.8° | 180.0° |
| C12 | C13 | C14 | H20 | 179.3° | 180.0° |
| C11 | C10 | C15 | C2 | 174.7° | 179.7° |
| C11 | C10 | C15 | C14 | 2.8° | 0.1° |
| C11 | C10 | C2 | C1 | 13.3° | 133.1° |
| C11 | C10 | C2 | O3 | 162.6° | 46.9° |
| C10 | C11 | C12 | H18 | 177.8° | 180.0° |
| C11 | C10 | C15 | H21 | 177.2° | 179.7° |
| C13 | C14 | C15 | C10 | 0.7° | 0.0° |
| C13 | C14 | C15 | H20 | 180.0° | 180.0° |
| C14 | C13 | C12 | H18 | 179.9° | 180.0° |
| C13 | C14 | C15 | H21 | 179.3° | 179.8° |
| C27 | C16 | C1 | C2 | 124.6° | 66.9° |
| C27 | C16 | C1 | C5 | 57.6° | 113.3° |
| C27 | C16 | C23 | H16 | 178.9° | 180.0° |
| C16 | C1 | C2 | C10 | 4.6° | 0.0° |
| C16 | C1 | C2 | C5 | 178.1° | 179.8° |
| C16 | C1 | C2 | O3 | 179.2° | 180.0° |
| C16 | C1 | C5 | C9 | 2.0° | 0.0° |
| C16 | C1 | C5 | C4 | 179.0° | 180.0° |
| C1 | C16 | C27 | H13 | 1.5° | 0.2° |
| C1 | C16 | C23 | H16 | 0.8° | 0.3° |
| O | C | CA | H25 | 120.0° | 119.9° |
| O | C | CA | H26 | 120.0° | 120.1° |
| O | C | CA | N | 73.0° | 64.9° |
| O | C | CA | C17 | 161.9° | 55.0° |
| O | C | CA | H24 | 44.9° | 175.0° |
| O | C | H25 | H26 | 119.9° | 120.1° |
| C | CA | C17 | C18 | 108.5° | 79.7° |
| C | CA | N | C17 | 121.3° | 120.0° |
| C | CA | N | H24 | 117.8° | 120.0° |
| C | CA | N | C9 | 175.8° | 85.1° |
| C | CA | C17 | H24 | 116.4° | 120.0° |
| C | CA | C17 | C22 | 71.4° | 100.0° |
| C | CA | N | H23 | 53.8° | 95.0° |
| CA | C | H25 | H26 | 119.9° | 120.0° |
| CA | C | O | H27 | 180.0° | 180.0° |
| C10 | C15 | C14 | H21 | 180.0° | 179.8° |
| C15 | C10 | C2 | C1 | 172.3° | 47.2° |
| C15 | C10 | C2 | O3 | 11.8° | 132.7° |
| C15 | C10 | C11 | H17 | 176.4° | 180.0° |
| C10 | C15 | C14 | H20 | 179.3° | 180.0° |
| C2 | C10 | C15 | C14 | 177.5° | 179.7° |
| C10 | C2 | C1 | O3 | 176.2° | 180.0° |
| C10 | C2 | C1 | C5 | 177.3° | 179.8° |
| C10 | C2 | O3 | C4 | 177.7° | 179.8° |
| C2 | C10 | C11 | H17 | 2.1° | 0.3° |
| C2 | C10 | C15 | H21 | 2.5° | 0.1° |
| C15 | C14 | C13 | H19 | 179.3° | 179.9° |
| C19 | C18 | C17 | H28 | 180.0° | 180.0° |
| C18 | C19 | C20 | H29 | 180.0° | 179.9° |
| C18 | C19 | C20 | C21 | 0.1° | 0.1° |
| C19 | C18 | C17 | CA | 179.5° | 180.0° |
| C19 | C18 | C17 | C22 | 0.5° | 0.3° |
| C18 | C19 | C20 | H30 | 179.9° | 180.0° |
| C17 | C18 | C19 | C20 | 0.7° | 0.0° |
| C18 | C17 | CA | N | 14.6° | 40.3° |
| C18 | C17 | CA | C22 | 179.9° | 179.7° |
| C18 | C17 | C22 | C21 | 0.2° | 0.5° |
| C18 | C17 | CA | H24 | 135.1° | 160.3° |
| C17 | C18 | C19 | H29 | 179.3° | 180.0° |
| C18 | C17 | C22 | H32 | 179.8° | 179.7° |
| C19 | C20 | C21 | H30 | 180.0° | 179.9° |
| C19 | C20 | C21 | C22 | 0.6° | 0.2° |
| C20 | C19 | C18 | H28 | 179.3° | 179.9° |
| C19 | C20 | C21 | H31 | 179.4° | 179.9° |
| C2 | C1 | C5 | C9 | 179.9° | 179.8° |
| C2 | C1 | C5 | C4 | 0.9° | 0.2° |
| C1 | C2 | O3 | C4 | 0.9° | 0.1° |
| C1 | C5 | C9 | N | 3.4° | 0.0° |
| C5 | C1 | C2 | O3 | 1.1° | 0.2° |
| C1 | C5 | C9 | C4 | 178.9° | 180.0° |
| C1 | C5 | C9 | N8 | 178.9° | 179.9° |
| C1 | C5 | C4 | O3 | 0.3° | 0.1° |
| C1 | C5 | C4 | N6 | 179.7° | 180.0° |
| CA | N | C9 | H23 | 121.9° | 179.9° |
| N | CA | C17 | H24 | 120.5° | 120.0° |
| N | CA | C17 | C22 | 165.5° | 140.1° |
| CA | N | C9 | C5 | 176.0° | 180.0° |
| CA | N | C9 | N8 | 6.2° | 0.1° |
| N | CA | C | H25 | 47.0° | 55.0° |
| N | CA | C | H26 | 167.0° | 175.0° |
| C9 | N | CA | C17 | 63.0° | 155.0° |
| N | C9 | C5 | N8 | 177.8° | 179.9° |
| N | C9 | C5 | C4 | 177.7° | 180.0° |
| N | C9 | N8 | C7 | 177.4° | 180.0° |
| C9 | N | CA | H24 | 58.0° | 35.0° |
| C2 | O3 | C4 | C5 | 0.3° | 0.0° |
| C2 | O3 | C4 | N6 | 179.6° | 179.8° |
| C20 | C21 | C22 | C17 | 0.8° | 0.5° |
| C20 | C21 | C22 | H31 | 180.0° | 179.8° |
| C21 | C20 | C19 | H29 | 179.9° | 180.0° |
| C20 | C21 | C22 | H32 | 179.2° | 179.8° |
| CA | C17 | C22 | C21 | 179.7° | 179.8° |
| C17 | CA | N | H23 | 175.1° | 24.9° |
| C17 | CA | C | H25 | 78.0° | 174.9° |
| C17 | CA | C | H26 | 41.9° | 65.0° |
| CA | C17 | C18 | H28 | 0.5° | 0.0° |
| CA | C17 | C22 | H32 | 0.3° | 0.0° |
| C17 | C22 | C21 | H32 | 180.0° | 179.7° |
| C22 | C17 | CA | H24 | 45.0° | 20.0° |
| C22 | C17 | C18 | H28 | 179.5° | 179.7° |
| C17 | C22 | C21 | H31 | 179.2° | 179.7° |
| C22 | C21 | C20 | H30 | 179.4° | 179.8° |
| C9 | C5 | C4 | O3 | 179.6° | 179.8° |
| C9 | C5 | C4 | N6 | 0.5° | 0.0° |
| C5 | C9 | N8 | C7 | 0.4° | 0.1° |
| C5 | C9 | N | H23 | 54.0° | 0.1° |
| C4 | C5 | C9 | N8 | 0.1° | 0.0° |
| C5 | C4 | O3 | N6 | 180.0° | 179.8° |
| C5 | C4 | N6 | C7 | 0.6° | 0.0° |
| C9 | N8 | C7 | N6 | 0.3° | 0.1° |
| C9 | N8 | C7 | H22 | 179.8° | 180.0° |
| N8 | C9 | N | H23 | 128.1° | 180.0° |
| O3 | C4 | N6 | C7 | 179.4° | 179.8° |
| C4 | N6 | C7 | N8 | 0.3° | 0.0° |
| C4 | N6 | C7 | H22 | 179.7° | 179.9° |
| N8 | C7 | N6 | H22 | 180.0° | 179.9° |
| H1 | C35 | H2 | H3 | 120.0° | 120.0° |
| H5 | C34 | H6 | H7 | 120.0° | 120.1° |
| H8 | C31 | C30 | H10 | 122.6° | 180.0° |
| H8 | C31 | C30 | H11 | 2.5° | 60.0° |
| H9 | C31 | C30 | H10 | 117.7° | 60.0° |
| H9 | C31 | C30 | H11 | 122.2° | 180.0° |
| H14 | C25 | C24 | H15 | 0.0° | 0.1° |
| H15 | C24 | C23 | H16 | 0.9° | 0.1° |
| H17 | C11 | C12 | H18 | 2.3° | 0.0° |
| H18 | C12 | C13 | H19 | 0.1° | 0.0° |
| H19 | C13 | C14 | H20 | 0.7° | 0.1° |
| H20 | C14 | C15 | H21 | 0.7° | 0.2° |
| H23 | N | CA | H24 | 63.9° | 144.9° |
| H24 | CA | C | H25 | 164.9° | 65.1° |
| H24 | CA | C | H26 | 75.1° | 55.0° |
| H25 | C | O | H27 | 59.9° | 60.1° |
| H26 | C | O | H27 | 60.0° | 59.9° |
| H28 | C18 | C19 | H29 | 0.7° | 0.0° |
| H29 | C19 | C20 | H30 | 0.1° | 0.1° |
| H30 | C20 | C21 | H31 | 0.6° | 0.0° |
| H31 | C21 | C22 | H32 | 0.8° | 0.0° |
