IL8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | O02 | sing | 1.43Å | 1.39Å | |
| O02 | C03 | sing | 1.36Å | 1.38Å | |
| O09 | C10 | sing | 1.43Å | 1.41Å | |
| O09 | C08 | sing | 1.36Å | 1.42Å | |
| C03 | C08 | doub | 1.39Å | 1.35Å | Aromatic |
| C03 | C04 | sing | 1.39Å | 1.38Å | Aromatic |
| C08 | C07 | sing | 1.38Å | 1.41Å | Aromatic |
| C04 | C05 | doub | 1.38Å | 1.37Å | Aromatic |
| C07 | C06 | doub | 1.39Å | 1.38Å | Aromatic |
| C05 | C06 | sing | 1.39Å | 1.36Å | Aromatic |
| C06 | C11 | sing | 1.48Å | 1.37Å | |
| N12 | C11 | doub | 1.31Å | 1.30Å | Aromatic |
| N12 | O13 | sing | 1.21Å | 1.36Å | Aromatic |
| C11 | N15 | sing | 1.35Å | 1.35Å | Aromatic |
| O13 | C14 | sing | 1.34Å | 1.30Å | Aromatic |
| N15 | C14 | doub | 1.32Å | 1.34Å | Aromatic |
| C14 | C16 | sing | 1.48Å | 1.46Å | |
| C16 | O17 | doub | 1.22Å | 1.18Å | |
| C16 | N18 | sing | 1.35Å | 1.41Å | |
| N18 | C19 | sing | 1.47Å | 1.43Å | |
| C19 | C20 | sing | 1.53Å | 1.45Å | |
| C20 | C21 | sing | 1.51Å | 1.52Å | |
| C21 | C26 | doub | 1.38Å | 1.40Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | C25 | sing | 1.38Å | 1.38Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C25 | C24 | doub | 1.40Å | 1.39Å | Aromatic |
| C23 | C24 | sing | 1.40Å | 1.38Å | Aromatic |
| C24 | C27 | sing | 1.48Å | 1.49Å | |
| C30 | C31 | sing | 1.54Å | 1.50Å | |
| C30 | N29 | sing | 1.48Å | 1.47Å | |
| C27 | N29 | sing | 1.35Å | 1.41Å | |
| C27 | O28 | doub | 1.22Å | 1.22Å | |
| C31 | C32 | sing | 1.54Å | 1.48Å | |
| N29 | C32 | sing | 1.48Å | 1.49Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| C20 | H4 | sing | 1.09Å | 1.10Å | |
| C20 | H5 | sing | 1.09Å | 1.10Å | |
| C22 | H6 | sing | 1.08Å | 1.08Å | |
| C19 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C23 | H9 | sing | 1.08Å | 1.08Å | |
| C01 | H10 | sing | 1.09Å | 1.10Å | |
| C01 | H11 | sing | 1.09Å | 1.10Å | |
| C01 | H12 | sing | 1.09Å | 1.10Å | |
| C04 | H13 | sing | 1.08Å | 1.08Å | |
| C05 | H14 | sing | 1.08Å | 1.08Å | |
| C07 | H15 | sing | 1.08Å | 1.08Å | |
| N18 | H16 | sing | 0.97Å | 1.00Å | |
| C25 | H17 | sing | 1.08Å | 1.08Å | |
| C26 | H18 | sing | 1.08Å | 1.08Å | |
| C30 | H19 | sing | 1.09Å | 1.10Å | |
| C30 | H20 | sing | 1.09Å | 1.10Å | |
| C31 | H21 | sing | 1.09Å | 1.10Å | |
| C31 | H22 | sing | 1.09Å | 1.10Å | |
| C32 | H23 | sing | 1.09Å | 1.10Å | |
| C32 | H24 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | O02 | C03 | 116.1° | 117.0° |
| O02 | C01 | H10 | 109.5° | 109.5° |
| O02 | C01 | H11 | 109.4° | 109.5° |
| O02 | C01 | H12 | 109.5° | 109.5° |
| O02 | C03 | C08 | 115.7° | 120.0° |
| O02 | C03 | C04 | 124.3° | 120.0° |
| C10 | O09 | C08 | 111.9° | 117.0° |
| O09 | C10 | H1 | 109.5° | 109.4° |
| O09 | C10 | H2 | 109.5° | 109.4° |
| O09 | C10 | H3 | 109.5° | 109.5° |
| O09 | C08 | C03 | 114.1° | 120.0° |
| O09 | C08 | C07 | 127.3° | 120.0° |
| C08 | C03 | C04 | 120.0° | 120.0° |
| C03 | C08 | C07 | 118.6° | 120.0° |
| C03 | C04 | C05 | 121.5° | 120.2° |
| C03 | C04 | H13 | 119.2° | 119.9° |
| C08 | C07 | C06 | 121.3° | 119.9° |
| C08 | C07 | H15 | 119.3° | 120.1° |
| C04 | C05 | C06 | 119.7° | 120.0° |
| C05 | C04 | H13 | 119.3° | 119.9° |
| C04 | C05 | H14 | 120.2° | 120.0° |
| C07 | C06 | C05 | 118.9° | 119.9° |
| C07 | C06 | C11 | 122.9° | 120.1° |
| C06 | C07 | H15 | 119.3° | 120.0° |
| C05 | C06 | C11 | 118.0° | 120.0° |
| C06 | C05 | H14 | 120.2° | 120.0° |
| C06 | C11 | N12 | 117.3° | 126.3° |
| C06 | C11 | N15 | 132.6° | 126.3° |
| C11 | N12 | O13 | 106.5° | 110.2° |
| N12 | C11 | N15 | 110.0° | 107.3° |
| N12 | O13 | C14 | 108.7° | 109.9° |
| C11 | N15 | C14 | 105.7° | 105.6° |
| O13 | C14 | N15 | 109.0° | 106.9° |
| O13 | C14 | C16 | 120.1° | 126.5° |
| N15 | C14 | C16 | 130.6° | 126.6° |
| C14 | C16 | O17 | 121.3° | 120.0° |
| C14 | C16 | N18 | 116.4° | 120.0° |
| O17 | C16 | N18 | 122.2° | 120.0° |
| C16 | N18 | C19 | 121.9° | 120.0° |
| C16 | N18 | H16 | 119.1° | 120.0° |
| N18 | C19 | C20 | 107.4° | 109.4° |
| N18 | C19 | H7 | 110.0° | 109.5° |
| N18 | C19 | H8 | 110.0° | 109.5° |
| C19 | N18 | H16 | 119.0° | 120.0° |
| C19 | C20 | C21 | 110.1° | 109.5° |
| C19 | C20 | H4 | 109.3° | 109.5° |
| C19 | C20 | H5 | 109.3° | 109.5° |
| C20 | C19 | H7 | 110.0° | 109.5° |
| C20 | C19 | H8 | 110.0° | 109.4° |
| C20 | C21 | C26 | 118.3° | 119.8° |
| C20 | C21 | C22 | 121.0° | 119.8° |
| C21 | C20 | H4 | 109.3° | 109.4° |
| C21 | C20 | H5 | 109.3° | 109.5° |
| C26 | C21 | C22 | 120.7° | 120.3° |
| C21 | C26 | C25 | 119.0° | 120.1° |
| C21 | C26 | H18 | 120.5° | 119.9° |
| C21 | C22 | C23 | 119.7° | 120.1° |
| C21 | C22 | H6 | 120.2° | 119.9° |
| C26 | C25 | C24 | 119.7° | 119.8° |
| C26 | C25 | H17 | 120.1° | 120.1° |
| C25 | C26 | H18 | 120.5° | 119.9° |
| C22 | C23 | C24 | 119.5° | 119.8° |
| C23 | C22 | H6 | 120.2° | 119.9° |
| C22 | C23 | H9 | 120.3° | 120.1° |
| C25 | C24 | C23 | 121.4° | 119.7° |
| C25 | C24 | C27 | 118.8° | 120.1° |
| C24 | C25 | H17 | 120.1° | 120.1° |
| C23 | C24 | C27 | 119.3° | 120.1° |
| C24 | C23 | H9 | 120.2° | 120.1° |
| C24 | C27 | N29 | 124.6° | 120.0° |
| C24 | C27 | O28 | 116.2° | 120.0° |
| C31 | C30 | N29 | 87.8° | 86.1° |
| C30 | C31 | C32 | 90.8° | 86.4° |
| C31 | C30 | H19 | 114.6° | 113.8° |
| C31 | C30 | H20 | 114.6° | 113.8° |
| C30 | C31 | H21 | 113.9° | 113.7° |
| C30 | C31 | H22 | 113.9° | 113.7° |
| C30 | N29 | C27 | 137.6° | 134.5° |
| C30 | N29 | C32 | 91.8° | 91.0° |
| N29 | C30 | H19 | 114.6° | 113.6° |
| N29 | C30 | H20 | 114.6° | 113.9° |
| N29 | C27 | O28 | 118.5° | 120.0° |
| C27 | N29 | C32 | 130.2° | 134.5° |
| C31 | C32 | N29 | 87.6° | 86.2° |
| C32 | C31 | H21 | 113.9° | 113.9° |
| C32 | C31 | H22 | 113.9° | 113.5° |
| C31 | C32 | H23 | 114.6° | 113.7° |
| C31 | C32 | H24 | 114.6° | 113.8° |
| N29 | C32 | H23 | 114.6° | 113.7° |
| N29 | C32 | H24 | 114.6° | 113.8° |
| H1 | C10 | H2 | 109.4° | 109.5° |
| H1 | C10 | H3 | 109.5° | 109.5° |
| H2 | C10 | H3 | 109.5° | 109.5° |
| H4 | C20 | H5 | 109.5° | 109.5° |
| H7 | C19 | H8 | 109.5° | 109.5° |
| H10 | C01 | H11 | 109.5° | 109.5° |
| H10 | C01 | H12 | 109.5° | 109.4° |
| H11 | C01 | H12 | 109.5° | 109.5° |
| H19 | C30 | H20 | 109.5° | 113.0° |
| H21 | C31 | H22 | 109.5° | 113.1° |
| H23 | C32 | H24 | 109.5° | 113.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | O02 | C03 | C08 | 175.8° | 180.0° |
| C01 | O02 | C03 | C04 | 3.9° | 0.2° |
| O02 | C01 | H10 | H11 | 120.0° | 120.0° |
| O02 | C01 | H10 | H12 | 120.0° | 120.0° |
| O02 | C01 | H11 | H12 | 120.0° | 120.0° |
| O02 | C03 | C08 | O09 | 1.1° | 0.0° |
| O02 | C03 | C08 | C04 | 179.7° | 179.7° |
| O02 | C03 | C08 | C07 | 178.6° | 179.7° |
| O02 | C03 | C04 | C05 | 179.9° | 180.0° |
| C03 | O02 | C01 | H10 | 180.0° | 180.0° |
| C03 | O02 | C01 | H11 | 60.0° | 60.0° |
| C03 | O02 | C01 | H12 | 60.0° | 60.0° |
| O02 | C03 | C04 | H13 | 0.1° | 0.0° |
| C10 | O09 | C08 | C03 | 179.1° | 180.0° |
| C10 | O09 | C08 | C07 | 1.2° | 0.2° |
| O09 | C10 | H1 | H2 | 120.0° | 119.9° |
| O09 | C10 | H1 | H3 | 120.0° | 120.0° |
| O09 | C10 | H2 | H3 | 120.0° | 120.0° |
| O09 | C08 | C03 | C07 | 179.8° | 179.7° |
| O09 | C08 | C03 | C04 | 179.2° | 179.7° |
| O09 | C08 | C07 | C06 | 179.9° | 179.8° |
| C08 | O09 | C10 | H1 | 180.0° | 60.0° |
| C08 | O09 | C10 | H2 | 60.0° | 180.0° |
| C08 | O09 | C10 | H3 | 60.0° | 60.0° |
| O09 | C08 | C07 | H15 | 0.1° | 0.0° |
| C08 | C03 | C04 | C05 | 0.4° | 0.3° |
| C03 | C08 | C07 | C06 | 0.3° | 0.5° |
| C08 | C03 | C04 | H13 | 179.6° | 179.7° |
| C03 | C08 | C07 | H15 | 179.7° | 179.7° |
| C04 | C03 | C08 | C07 | 1.1° | 0.5° |
| C03 | C04 | C05 | H13 | 180.0° | 180.0° |
| C03 | C04 | C05 | C06 | 2.6° | 0.1° |
| C03 | C04 | C05 | H14 | 177.3° | 180.0° |
| C08 | C07 | C06 | H15 | 180.0° | 179.8° |
| C08 | C07 | C06 | C05 | 1.9° | 0.1° |
| C08 | C07 | C06 | C11 | 175.7° | 179.8° |
| C04 | C05 | C06 | C07 | 3.3° | 0.1° |
| C04 | C05 | C06 | H14 | 180.0° | 179.9° |
| C04 | C05 | C06 | C11 | 177.5° | 179.9° |
| C07 | C06 | C05 | C11 | 174.1° | 179.9° |
| C07 | C06 | C11 | N12 | 144.4° | 0.3° |
| C07 | C06 | C11 | N15 | 32.6° | 180.0° |
| C07 | C06 | C05 | H14 | 176.7° | 180.0° |
| C05 | C06 | C11 | N12 | 29.5° | 179.8° |
| C05 | C06 | C11 | N15 | 153.6° | 0.0° |
| C06 | C05 | C04 | H13 | 177.4° | 180.0° |
| C05 | C06 | C07 | H15 | 178.1° | 179.9° |
| C06 | C11 | N12 | N15 | 177.6° | 179.8° |
| C06 | C11 | N12 | O13 | 178.6° | 179.7° |
| C06 | C11 | N15 | C14 | 179.1° | 179.7° |
| C11 | C06 | C05 | H14 | 2.5° | 0.0° |
| C11 | C06 | C07 | H15 | 4.3° | 0.0° |
| C11 | N12 | O13 | C14 | 0.3° | 0.0° |
| N12 | C11 | N15 | C14 | 1.9° | 0.0° |
| O13 | N12 | C11 | N15 | 1.0° | 0.0° |
| N12 | O13 | C14 | N15 | 1.6° | 0.0° |
| N12 | O13 | C14 | C16 | 176.3° | 180.0° |
| C11 | N15 | C14 | O13 | 2.1° | 0.0° |
| C11 | N15 | C14 | C16 | 176.2° | 180.0° |
| O13 | C14 | N15 | C16 | 174.1° | 180.0° |
| O13 | C14 | C16 | O17 | 4.2° | 179.9° |
| O13 | C14 | C16 | N18 | 172.3° | 0.0° |
| N15 | C14 | C16 | O17 | 177.7° | 0.1° |
| N15 | C14 | C16 | N18 | 1.2° | 180.0° |
| C14 | C16 | O17 | N18 | 176.3° | 180.0° |
| C14 | C16 | N18 | C19 | 173.5° | 180.0° |
| C14 | C16 | N18 | H16 | 6.5° | 0.1° |
| O17 | C16 | N18 | C19 | 3.0° | 0.0° |
| O17 | C16 | N18 | H16 | 177.0° | 180.0° |
| C16 | N18 | C19 | H16 | 180.0° | 179.9° |
| C16 | N18 | C19 | C20 | 83.9° | 180.0° |
| C16 | N18 | C19 | H7 | 35.8° | 60.0° |
| C16 | N18 | C19 | H8 | 156.4° | 60.0° |
| N18 | C19 | C20 | H7 | 119.6° | 120.0° |
| N18 | C19 | C20 | H8 | 119.7° | 120.0° |
| N18 | C19 | C20 | C21 | 176.0° | 180.0° |
| N18 | C19 | C20 | H4 | 63.9° | 60.0° |
| N18 | C19 | C20 | H5 | 55.9° | 60.0° |
| N18 | C19 | H7 | H8 | 120.9° | 120.0° |
| C19 | C20 | C21 | H4 | 120.1° | 120.0° |
| C19 | C20 | C21 | H5 | 120.1° | 120.0° |
| C19 | C20 | C21 | C26 | 97.3° | 90.0° |
| C19 | C20 | C21 | C22 | 84.1° | 89.7° |
| C19 | C20 | H4 | H5 | 119.7° | 120.0° |
| C20 | C19 | H7 | H8 | 121.0° | 120.0° |
| C20 | C19 | N18 | H16 | 96.1° | 0.0° |
| C20 | C21 | C26 | C22 | 178.6° | 179.7° |
| C20 | C21 | C26 | C25 | 179.9° | 180.0° |
| C20 | C21 | C22 | C23 | 179.2° | 180.0° |
| C21 | C20 | H4 | H5 | 119.7° | 120.0° |
| C20 | C21 | C22 | H6 | 0.8° | 0.0° |
| C21 | C20 | C19 | H7 | 56.3° | 60.0° |
| C21 | C20 | C19 | H8 | 64.4° | 60.0° |
| C20 | C21 | C26 | H18 | 0.1° | 0.1° |
| C21 | C26 | C25 | H18 | 180.0° | 180.0° |
| C26 | C21 | C22 | C23 | 0.7° | 0.3° |
| C21 | C26 | C25 | C24 | 1.8° | 0.0° |
| C26 | C21 | C20 | H4 | 142.6° | 150.0° |
| C26 | C21 | C20 | H5 | 22.8° | 30.0° |
| C26 | C21 | C22 | H6 | 179.4° | 179.7° |
| C21 | C26 | C25 | H17 | 178.2° | 180.0° |
| C22 | C21 | C26 | C25 | 1.5° | 0.3° |
| C21 | C22 | C23 | H6 | 180.0° | 180.0° |
| C21 | C22 | C23 | C24 | 0.1° | 0.0° |
| C22 | C21 | C20 | H4 | 36.0° | 30.3° |
| C22 | C21 | C20 | H5 | 155.8° | 150.3° |
| C21 | C22 | C23 | H9 | 179.9° | 180.0° |
| C22 | C21 | C26 | H18 | 178.5° | 179.8° |
| C26 | C25 | C24 | H17 | 180.0° | 180.0° |
| C26 | C25 | C24 | C23 | 1.3° | 0.3° |
| C26 | C25 | C24 | C27 | 171.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.4° | 0.3° |
| C22 | C23 | C24 | H9 | 180.0° | 180.0° |
| C22 | C23 | C24 | C27 | 171.9° | 180.0° |
| C25 | C24 | C23 | C27 | 172.3° | 179.8° |
| C25 | C24 | C27 | N29 | 147.9° | 7.1° |
| C25 | C24 | C27 | O28 | 42.2° | 172.9° |
| C25 | C24 | C23 | H9 | 179.6° | 179.8° |
| C24 | C25 | C26 | H18 | 178.2° | 180.0° |
| C23 | C24 | C27 | N29 | 39.6° | 173.1° |
| C23 | C24 | C27 | O28 | 130.2° | 6.9° |
| C24 | C23 | C22 | H6 | 179.9° | 180.0° |
| C23 | C24 | C25 | H17 | 178.7° | 179.7° |
| C24 | C27 | N29 | C30 | 10.9° | 5.9° |
| C24 | C27 | N29 | O28 | 169.6° | 180.0° |
| C24 | C27 | N29 | C32 | 178.9° | 174.4° |
| C27 | C24 | C23 | H9 | 8.1° | 0.0° |
| C27 | C24 | C25 | H17 | 9.0° | 0.0° |
| C31 | C30 | N29 | H19 | 116.1° | 114.3° |
| C31 | C30 | N29 | H20 | 116.1° | 114.4° |
| C31 | C30 | N29 | C27 | 161.5° | 155.4° |
| C30 | C31 | C32 | H21 | 116.7° | 114.4° |
| C30 | C31 | C32 | H22 | 116.7° | 114.3° |
| C31 | C30 | N29 | C32 | 11.0° | 24.4° |
| C31 | C30 | H19 | H20 | 130.3° | 131.8° |
| C30 | C31 | H21 | H22 | 128.9° | 131.7° |
| C30 | C31 | C32 | H23 | 127.0° | 137.7° |
| C30 | C31 | C32 | H24 | 105.2° | 91.0° |
| C30 | N29 | C27 | C32 | 170.2° | 179.7° |
| C30 | N29 | C27 | O28 | 179.5° | 174.1° |
| N29 | C30 | H19 | H20 | 130.3° | 131.8° |
| N29 | C30 | C31 | H21 | 105.7° | 138.0° |
| N29 | C30 | C31 | H22 | 127.7° | 90.7° |
| C30 | N29 | C32 | H23 | 127.2° | 138.7° |
| C30 | N29 | C32 | H24 | 105.0° | 89.9° |
| C27 | N29 | C32 | C31 | 162.3° | 155.3° |
| C27 | N29 | C30 | H19 | 82.3° | 90.3° |
| C27 | N29 | C30 | H20 | 45.4° | 41.0° |
| C27 | N29 | C32 | H23 | 46.2° | 41.1° |
| C27 | N29 | C32 | H24 | 81.6° | 90.3° |
| O28 | C27 | N29 | C32 | 9.3° | 5.6° |
| C31 | C32 | N29 | H23 | 116.1° | 114.2° |
| C31 | C32 | N29 | H24 | 116.1° | 114.4° |
| C32 | C31 | C30 | H19 | 105.1° | 90.7° |
| C32 | C31 | C30 | H20 | 127.2° | 137.9° |
| C32 | C31 | H21 | H22 | 128.9° | 131.5° |
| C31 | C32 | H23 | H24 | 130.4° | 131.7° |
| C32 | N29 | C30 | H19 | 105.1° | 89.9° |
| C32 | N29 | C30 | H20 | 127.1° | 138.8° |
| N29 | C32 | C31 | H21 | 105.8° | 137.8° |
| N29 | C32 | C31 | H22 | 127.6° | 90.9° |
| N29 | C32 | H23 | H24 | 130.4° | 131.8° |
| H1 | C10 | H2 | H3 | 120.0° | 120.1° |
| H4 | C20 | C19 | H7 | 176.4° | 180.0° |
| H4 | C20 | C19 | H8 | 55.8° | 60.0° |
| H5 | C20 | C19 | H7 | 63.7° | 60.0° |
| H5 | C20 | C19 | H8 | 175.6° | 180.0° |
| H6 | C22 | C23 | H9 | 0.1° | 0.0° |
| H7 | C19 | N18 | H16 | 144.2° | 120.0° |
| H8 | C19 | N18 | H16 | 23.6° | 119.9° |
| H10 | C01 | H11 | H12 | 120.0° | 119.9° |
| H13 | C04 | C05 | H14 | 2.7° | 0.0° |
| H17 | C25 | C26 | H18 | 1.8° | 0.0° |
| H19 | C30 | C31 | H21 | 138.2° | 23.8° |
| H19 | C30 | C31 | H22 | 11.6° | 155.2° |
| H20 | C30 | C31 | H21 | 10.4° | 107.6° |
| H20 | C30 | C31 | H22 | 116.2° | 23.8° |
| H21 | C31 | C32 | H23 | 10.3° | 107.9° |
| H21 | C31 | C32 | H24 | 138.1° | 23.4° |
| H22 | C31 | C32 | H23 | 116.4° | 23.4° |
| H22 | C31 | C32 | H24 | 11.5° | 154.7° |
