KYB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C09 | N10 | doub | 1.32Å | 1.32Å | Aromatic |
| C09 | N08 | sing | 1.32Å | 1.33Å | Aromatic |
| N10 | C11 | sing | 1.33Å | 1.28Å | Aromatic |
| N08 | C07 | doub | 1.33Å | 1.33Å | Aromatic |
| C11 | N12 | sing | 1.38Å | 1.44Å | |
| C11 | C13 | doub | 1.41Å | 1.43Å | Aromatic |
| C07 | C13 | sing | 1.40Å | 1.34Å | Aromatic |
| C07 | N06 | sing | 1.37Å | 1.36Å | Aromatic |
| O04 | C03 | sing | 1.43Å | 1.44Å | |
| C13 | N14 | sing | 1.35Å | 1.31Å | Aromatic |
| O01 | C02 | sing | 1.43Å | 1.48Å | |
| C05 | N06 | sing | 1.47Å | 1.30Å | |
| C05 | C03 | sing | 1.55Å | 1.55Å | |
| C05 | O16 | sing | 1.45Å | 1.56Å | |
| N06 | C15 | sing | 1.36Å | 1.29Å | Aromatic |
| C03 | C02 | sing | 1.55Å | 1.33Å | |
| O16 | C17 | sing | 1.44Å | 1.27Å | |
| N23 | C22 | sing | 1.47Å | 1.52Å | |
| C02 | C17 | sing | 1.55Å | 1.66Å | |
| C17 | C18 | sing | 1.53Å | 1.54Å | |
| N14 | C15 | doub | 1.30Å | 1.33Å | Aromatic |
| C22 | C21 | sing | 1.53Å | 1.57Å | |
| C20 | C21 | sing | 1.53Å | 1.58Å | |
| C20 | N19 | sing | 1.47Å | 1.50Å | |
| C18 | N19 | sing | 1.47Å | 1.46Å | |
| N19 | C24 | sing | 1.47Å | 1.49Å | |
| C24 | C25 | sing | 1.53Å | 1.53Å | |
| C25 | C26 | sing | 1.53Å | 1.63Å | |
| C26 | C27 | sing | 1.53Å | 1.55Å | |
| C28 | C27 | sing | 1.53Å | 1.57Å | |
| C28 | N29 | sing | 1.47Å | 1.44Å | |
| N29 | C30 | sing | 1.37Å | 1.32Å | |
| C30 | N32 | doub | 1.30Å | 1.37Å | |
| C30 | N31 | sing | 1.38Å | 1.35Å | |
| C15 | H1 | sing | 1.08Å | 1.08Å | |
| C17 | H2 | sing | 1.09Å | 1.10Å | |
| C18 | H3 | sing | 1.09Å | 1.10Å | |
| C18 | H4 | sing | 1.09Å | 1.10Å | |
| C20 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C21 | H7 | sing | 1.09Å | 1.10Å | |
| C21 | H8 | sing | 1.09Å | 1.10Å | |
| C22 | H9 | sing | 1.09Å | 1.10Å | |
| C22 | H10 | sing | 1.09Å | 1.10Å | |
| C28 | H11 | sing | 1.09Å | 1.10Å | |
| C28 | H12 | sing | 1.09Å | 1.10Å | |
| N32 | H13 | sing | 0.97Å | 1.00Å | |
| C02 | H14 | sing | 1.09Å | 1.10Å | |
| C03 | H15 | sing | 1.09Å | 1.10Å | |
| C05 | H16 | sing | 1.09Å | 1.10Å | |
| C09 | H17 | sing | 1.08Å | 1.08Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C24 | H19 | sing | 1.09Å | 1.10Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C26 | H22 | sing | 1.09Å | 1.10Å | |
| C26 | H23 | sing | 1.09Å | 1.10Å | |
| C27 | H24 | sing | 1.09Å | 1.10Å | |
| C27 | H25 | sing | 1.09Å | 1.10Å | |
| N12 | H26 | sing | 0.97Å | 1.00Å | |
| N12 | H27 | sing | 0.97Å | 1.00Å | |
| N23 | H29 | sing | 1.01Å | 1.00Å | |
| N23 | H30 | sing | 1.01Å | 1.00Å | |
| N29 | H32 | sing | 0.97Å | 1.00Å | |
| N31 | H33 | sing | 0.97Å | 1.00Å | |
| N31 | H34 | sing | 0.97Å | 1.00Å | |
| O01 | H35 | sing | 0.97Å | 0.95Å | |
| O04 | H36 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N10 | C09 | N08 | 121.5° | 122.5° |
| C09 | N10 | C11 | 121.0° | 121.2° |
| N10 | C09 | H17 | 119.2° | 118.7° |
| C09 | N08 | C07 | 120.4° | 120.6° |
| N08 | C09 | H17 | 119.3° | 118.8° |
| N10 | C11 | N12 | 120.0° | 120.8° |
| N10 | C11 | C13 | 119.4° | 118.4° |
| N08 | C07 | C13 | 119.4° | 119.1° |
| N08 | C07 | N06 | 133.8° | 134.9° |
| N12 | C11 | C13 | 120.7° | 120.7° |
| C11 | N12 | H26 | 109.5° | 120.0° |
| C11 | N12 | H27 | 109.5° | 119.9° |
| C11 | C13 | C07 | 118.3° | 118.2° |
| C11 | C13 | N14 | 134.3° | 134.7° |
| C13 | C07 | N06 | 106.8° | 106.0° |
| C07 | C13 | N14 | 107.4° | 107.2° |
| C07 | N06 | C05 | 127.1° | 126.3° |
| C07 | N06 | C15 | 108.1° | 107.5° |
| O04 | C03 | C05 | 108.4° | 110.6° |
| O04 | C03 | C02 | 112.1° | 110.5° |
| O04 | C03 | H15 | 110.8° | 110.5° |
| C03 | O04 | H36 | 109.5° | 114.0° |
| C13 | N14 | C15 | 109.2° | 109.4° |
| O01 | C02 | C03 | 118.9° | 110.7° |
| O01 | C02 | C17 | 101.4° | 110.5° |
| O01 | C02 | H14 | 109.0° | 110.5° |
| C02 | O01 | H35 | 109.5° | 114.1° |
| N06 | C05 | C03 | 115.4° | 110.3° |
| N06 | C05 | O16 | 107.7° | 110.4° |
| C05 | N06 | C15 | 124.7° | 126.2° |
| N06 | C05 | H16 | 112.7° | 110.3° |
| C03 | C05 | O16 | 102.9° | 104.9° |
| C05 | C03 | C02 | 103.5° | 104.0° |
| C05 | C03 | H15 | 109.2° | 110.6° |
| C03 | C05 | H16 | 108.9° | 110.4° |
| C05 | O16 | C17 | 106.9° | 105.2° |
| O16 | C05 | H16 | 108.7° | 110.4° |
| N06 | C15 | N14 | 108.5° | 109.9° |
| N06 | C15 | H1 | 125.8° | 125.0° |
| C03 | C02 | C17 | 108.3° | 104.1° |
| C03 | C02 | H14 | 111.3° | 110.4° |
| C02 | C03 | H15 | 112.6° | 110.5° |
| O16 | C17 | C02 | 106.4° | 104.9° |
| O16 | C17 | C18 | 106.2° | 110.4° |
| O16 | C17 | H2 | 113.3° | 110.4° |
| N23 | C22 | C21 | 108.6° | 109.5° |
| N23 | C22 | H9 | 109.7° | 109.4° |
| N23 | C22 | H10 | 109.7° | 109.5° |
| C22 | N23 | H29 | 109.5° | 111.0° |
| C22 | N23 | H30 | 109.5° | 111.0° |
| C02 | C17 | C18 | 114.4° | 110.4° |
| C02 | C17 | H2 | 107.7° | 110.3° |
| C17 | C02 | H14 | 106.9° | 110.5° |
| C17 | C18 | N19 | 115.2° | 109.5° |
| C18 | C17 | H2 | 109.1° | 110.4° |
| C17 | C18 | H3 | 108.0° | 109.5° |
| C17 | C18 | H4 | 108.0° | 109.5° |
| N14 | C15 | H1 | 125.8° | 125.1° |
| C22 | C21 | C20 | 112.5° | 109.4° |
| C22 | C21 | H7 | 108.7° | 109.4° |
| C22 | C21 | H8 | 108.7° | 109.5° |
| C21 | C22 | H9 | 109.7° | 109.5° |
| C21 | C22 | H10 | 109.7° | 109.5° |
| C21 | C20 | N19 | 115.4° | 109.4° |
| C21 | C20 | H5 | 108.0° | 109.5° |
| C21 | C20 | H6 | 108.0° | 109.5° |
| C20 | C21 | H7 | 108.7° | 109.5° |
| C20 | C21 | H8 | 108.7° | 109.5° |
| C20 | N19 | C18 | 111.4° | 111.0° |
| C20 | N19 | C24 | 109.5° | 111.0° |
| N19 | C20 | H5 | 108.0° | 109.5° |
| N19 | C20 | H6 | 108.0° | 109.4° |
| C18 | N19 | C24 | 112.9° | 111.0° |
| N19 | C18 | H3 | 108.0° | 109.5° |
| N19 | C18 | H4 | 108.0° | 109.4° |
| N19 | C24 | C25 | 117.7° | 109.5° |
| N19 | C24 | H18 | 107.4° | 109.4° |
| N19 | C24 | H19 | 107.4° | 109.5° |
| C24 | C25 | C26 | 110.6° | 109.4° |
| C25 | C24 | H18 | 107.4° | 109.5° |
| C25 | C24 | H19 | 107.4° | 109.5° |
| C24 | C25 | H20 | 109.2° | 109.5° |
| C24 | C25 | H21 | 109.2° | 109.5° |
| C25 | C26 | C27 | 115.3° | 109.4° |
| C26 | C25 | H20 | 109.2° | 109.5° |
| C26 | C25 | H21 | 109.2° | 109.5° |
| C25 | C26 | H22 | 108.0° | 109.5° |
| C25 | C26 | H23 | 108.0° | 109.5° |
| C26 | C27 | C28 | 111.2° | 109.5° |
| C27 | C26 | H22 | 108.0° | 109.5° |
| C27 | C26 | H23 | 108.0° | 109.5° |
| C26 | C27 | H24 | 109.0° | 109.4° |
| C26 | C27 | H25 | 109.0° | 109.5° |
| C27 | C28 | N29 | 114.0° | 109.4° |
| C27 | C28 | H11 | 108.3° | 109.4° |
| C27 | C28 | H12 | 108.3° | 109.5° |
| C28 | C27 | H24 | 109.0° | 109.4° |
| C28 | C27 | H25 | 109.0° | 109.5° |
| C28 | N29 | C30 | 125.7° | 120.0° |
| N29 | C28 | H11 | 108.3° | 109.5° |
| N29 | C28 | H12 | 108.3° | 109.5° |
| C28 | N29 | H32 | 117.2° | 120.0° |
| N29 | C30 | N32 | 127.6° | 120.0° |
| N29 | C30 | N31 | 114.4° | 120.0° |
| C30 | N29 | H32 | 117.2° | 120.0° |
| N32 | C30 | N31 | 118.0° | 120.0° |
| C30 | N32 | H13 | 112.0° | 120.0° |
| C30 | N31 | H33 | 120.0° | 120.0° |
| C30 | N31 | H34 | 120.0° | 120.0° |
| H3 | C18 | H4 | 109.4° | 109.5° |
| H5 | C20 | H6 | 109.4° | 109.5° |
| H7 | C21 | H8 | 109.4° | 109.5° |
| H9 | C22 | H10 | 109.5° | 109.5° |
| H11 | C28 | H12 | 109.4° | 109.5° |
| H18 | C24 | H19 | 109.5° | 109.5° |
| H20 | C25 | H21 | 109.4° | 109.5° |
| H22 | C26 | H23 | 109.5° | 109.5° |
| H24 | C27 | H25 | 109.5° | 109.5° |
| H26 | N12 | H27 | 109.5° | 120.1° |
| H29 | N23 | H30 | 109.5° | 111.0° |
| H33 | N31 | H34 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N10 | C09 | N08 | H17 | 180.0° | 179.8° |
| N10 | C09 | N08 | C07 | 0.2° | 0.2° |
| C09 | N10 | C11 | N12 | 179.5° | 179.9° |
| C09 | N10 | C11 | C13 | 1.1° | 0.1° |
| N08 | C09 | N10 | C11 | 0.3° | 0.2° |
| C09 | N08 | C07 | C13 | 0.1° | 0.0° |
| C09 | N08 | C07 | N06 | 179.7° | 180.0° |
| N10 | C11 | N12 | C13 | 179.4° | 180.0° |
| N10 | C11 | C13 | C07 | 1.4° | 0.3° |
| N10 | C11 | C13 | N14 | 178.7° | 180.0° |
| C11 | N10 | C09 | H17 | 179.7° | 180.0° |
| N10 | C11 | N12 | H26 | 0.0° | 180.0° |
| N10 | C11 | N12 | H27 | 120.0° | 0.0° |
| N08 | C07 | C13 | C11 | 0.9° | 0.2° |
| N08 | C07 | C13 | N06 | 179.9° | 180.0° |
| N08 | C07 | C13 | N14 | 179.2° | 180.0° |
| N08 | C07 | N06 | C05 | 3.1° | 0.0° |
| N08 | C07 | N06 | C15 | 179.3° | 180.0° |
| C07 | N08 | C09 | H17 | 179.8° | 180.0° |
| N12 | C11 | C13 | C07 | 179.2° | 179.7° |
| N12 | C11 | C13 | N14 | 0.7° | 0.0° |
| C11 | N12 | H26 | H27 | 120.0° | 180.0° |
| C11 | C13 | C07 | N14 | 179.9° | 179.8° |
| C11 | C13 | C07 | N06 | 179.0° | 179.8° |
| C11 | C13 | N14 | C15 | 179.2° | 179.7° |
| C13 | C11 | N12 | H26 | 179.5° | 0.0° |
| C13 | C11 | N12 | H27 | 59.4° | 180.0° |
| C13 | C07 | N06 | C05 | 177.0° | 180.0° |
| C13 | C07 | N06 | C15 | 0.8° | 0.0° |
| C07 | C13 | N14 | C15 | 0.7° | 0.0° |
| N06 | C07 | C13 | N14 | 0.9° | 0.0° |
| C07 | N06 | C05 | C15 | 175.6° | 180.0° |
| C07 | N06 | C05 | C03 | 135.1° | 85.0° |
| C07 | N06 | C05 | O16 | 110.7° | 159.5° |
| C07 | N06 | C15 | N14 | 0.4° | 0.0° |
| C07 | N06 | C15 | H1 | 179.6° | 179.9° |
| C07 | N06 | C05 | H16 | 9.1° | 37.2° |
| O04 | C03 | C02 | O01 | 23.5° | 0.0° |
| O04 | C03 | C05 | N06 | 90.9° | 98.5° |
| O04 | C03 | C05 | C02 | 119.1° | 118.7° |
| O04 | C03 | C05 | H15 | 120.7° | 122.7° |
| O04 | C03 | C05 | O16 | 152.2° | 142.6° |
| O04 | C03 | C02 | H15 | 125.7° | 122.6° |
| O04 | C03 | C02 | C17 | 138.4° | 118.8° |
| O04 | C03 | C02 | H14 | 104.4° | 122.6° |
| O04 | C03 | C05 | H16 | 37.0° | 23.7° |
| C13 | N14 | C15 | N06 | 0.2° | 0.0° |
| C13 | N14 | C15 | H1 | 179.8° | 179.9° |
| O01 | C02 | C03 | C05 | 93.1° | 118.7° |
| O01 | C02 | C03 | C17 | 114.9° | 118.7° |
| O01 | C02 | C03 | H14 | 127.9° | 122.7° |
| O01 | C02 | C17 | O16 | 124.6° | 142.7° |
| O01 | C02 | C17 | H14 | 114.1° | 122.6° |
| O01 | C02 | C17 | C18 | 118.5° | 98.4° |
| O01 | C02 | C17 | H2 | 2.9° | 23.8° |
| O01 | C02 | C03 | H15 | 149.2° | 122.6° |
| N06 | C05 | C03 | O16 | 117.0° | 118.9° |
| N06 | C05 | C03 | H16 | 127.9° | 122.2° |
| N06 | C05 | O16 | H16 | 122.3° | 122.3° |
| N06 | C05 | C03 | C02 | 150.0° | 142.9° |
| N06 | C05 | O16 | C17 | 155.9° | 159.3° |
| C05 | N06 | C15 | N14 | 176.8° | 180.0° |
| C05 | N06 | C15 | H1 | 3.2° | 0.0° |
| N06 | C05 | C03 | H15 | 29.9° | 24.2° |
| C03 | C05 | O16 | H16 | 115.3° | 118.9° |
| C03 | C05 | N06 | C15 | 49.3° | 95.0° |
| C05 | C03 | C02 | H15 | 117.8° | 118.7° |
| C03 | C05 | O16 | C17 | 33.5° | 40.4° |
| C05 | C03 | C02 | C17 | 21.9° | 0.0° |
| C05 | C03 | C02 | H14 | 139.1° | 118.6° |
| C05 | C03 | O04 | H36 | 180.0° | 176.1° |
| O16 | C05 | N06 | C15 | 65.0° | 20.5° |
| O16 | C05 | C03 | C02 | 33.0° | 23.9° |
| C05 | O16 | C17 | C02 | 20.1° | 40.4° |
| C05 | O16 | C17 | C18 | 142.3° | 159.2° |
| C05 | O16 | C17 | H2 | 98.0° | 78.5° |
| O16 | C05 | C03 | H15 | 87.1° | 94.7° |
| N06 | C15 | N14 | H1 | 180.0° | 179.9° |
| C15 | N06 | C05 | H16 | 175.2° | 142.8° |
| C03 | C02 | C17 | O16 | 1.3° | 23.9° |
| C03 | C02 | C17 | H14 | 120.0° | 118.6° |
| C03 | C02 | C17 | C18 | 115.5° | 142.8° |
| C03 | C02 | C17 | H2 | 123.0° | 95.0° |
| C02 | C03 | C05 | H16 | 82.1° | 94.9° |
| C03 | C02 | O01 | H35 | 180.0° | 65.2° |
| C02 | C03 | O04 | H36 | 66.4° | 61.5° |
| O16 | C17 | C02 | C18 | 116.8° | 118.9° |
| O16 | C17 | C02 | H2 | 121.7° | 118.9° |
| O16 | C17 | C18 | H2 | 122.4° | 122.3° |
| O16 | C17 | C18 | N19 | 178.1° | 69.8° |
| O16 | C17 | C18 | H3 | 61.1° | 170.2° |
| O16 | C17 | C18 | H4 | 57.2° | 50.2° |
| O16 | C17 | C02 | H14 | 121.3° | 94.7° |
| C17 | O16 | C05 | H16 | 81.8° | 78.5° |
| N23 | C22 | C21 | H9 | 119.8° | 120.0° |
| N23 | C22 | C21 | H10 | 119.8° | 120.0° |
| N23 | C22 | C21 | C20 | 138.3° | 180.0° |
| N23 | C22 | C21 | H7 | 17.9° | 60.0° |
| N23 | C22 | C21 | H8 | 101.2° | 60.0° |
| N23 | C22 | H9 | H10 | 120.4° | 120.0° |
| C22 | N23 | H29 | H30 | 120.0° | 124.0° |
| C02 | C17 | C18 | H2 | 120.7° | 122.2° |
| C02 | C17 | C18 | N19 | 65.0° | 174.7° |
| C02 | C17 | C18 | H3 | 55.9° | 54.7° |
| C02 | C17 | C18 | H4 | 174.1° | 65.3° |
| C17 | C02 | C03 | H15 | 95.9° | 118.6° |
| C17 | C02 | O01 | H35 | 61.5° | 180.0° |
| C17 | C18 | N19 | C20 | 58.9° | 72.7° |
| C17 | C18 | N19 | H3 | 120.9° | 120.0° |
| C17 | C18 | N19 | H4 | 120.9° | 120.0° |
| C17 | C18 | N19 | C24 | 177.4° | 163.3° |
| C17 | C18 | H3 | H4 | 117.4° | 120.0° |
| C18 | C17 | C02 | H14 | 4.5° | 24.2° |
| C22 | C21 | C20 | H7 | 120.5° | 119.9° |
| C22 | C21 | C20 | H8 | 120.5° | 120.0° |
| C22 | C21 | C20 | N19 | 174.7° | 174.8° |
| C22 | C21 | C20 | H5 | 64.4° | 54.8° |
| C22 | C21 | C20 | H6 | 53.8° | 65.3° |
| C22 | C21 | H7 | H8 | 118.6° | 120.0° |
| C21 | C22 | H9 | H10 | 120.4° | 120.0° |
| C21 | C22 | N23 | H29 | 180.0° | 180.0° |
| C21 | C22 | N23 | H30 | 60.0° | 56.0° |
| C21 | C20 | N19 | H5 | 120.9° | 120.0° |
| C21 | C20 | N19 | H6 | 120.9° | 120.0° |
| C21 | C20 | N19 | C18 | 86.5° | 58.5° |
| C21 | C20 | N19 | C24 | 39.2° | 65.5° |
| C21 | C20 | H5 | H6 | 117.3° | 120.1° |
| C20 | C21 | H7 | H8 | 118.6° | 120.1° |
| C20 | C21 | C22 | H9 | 101.8° | 60.0° |
| C20 | C21 | C22 | H10 | 18.5° | 60.0° |
| C20 | N19 | C18 | C24 | 123.7° | 124.0° |
| C20 | N19 | C24 | C25 | 169.3° | 72.0° |
| C20 | N19 | C18 | H3 | 179.7° | 167.3° |
| C20 | N19 | C18 | H4 | 62.0° | 47.3° |
| N19 | C20 | H5 | H6 | 117.3° | 119.9° |
| N19 | C20 | C21 | H7 | 54.2° | 54.9° |
| N19 | C20 | C21 | H8 | 64.9° | 65.2° |
| C20 | N19 | C24 | H18 | 69.5° | 48.0° |
| C20 | N19 | C24 | H19 | 48.2° | 168.0° |
| C18 | N19 | C24 | C25 | 65.9° | 164.0° |
| N19 | C18 | C17 | H2 | 55.7° | 52.5° |
| N19 | C18 | H3 | H4 | 117.4° | 120.0° |
| C18 | N19 | C20 | H5 | 152.6° | 178.6° |
| C18 | N19 | C20 | H6 | 34.4° | 61.4° |
| C18 | N19 | C24 | H18 | 55.3° | 76.0° |
| C18 | N19 | C24 | H19 | 173.0° | 44.0° |
| N19 | C24 | C25 | H18 | 121.1° | 119.9° |
| N19 | C24 | C25 | H19 | 121.2° | 120.0° |
| N19 | C24 | C25 | C26 | 163.8° | 175.6° |
| C24 | N19 | C18 | H3 | 56.6° | 43.3° |
| C24 | N19 | C18 | H4 | 61.7° | 76.7° |
| C24 | N19 | C20 | H5 | 81.7° | 54.6° |
| C24 | N19 | C20 | H6 | 160.0° | 174.6° |
| N19 | C24 | H18 | H19 | 116.3° | 120.0° |
| N19 | C24 | C25 | H20 | 76.1° | 55.6° |
| N19 | C24 | C25 | H21 | 43.6° | 64.4° |
| C24 | C25 | C26 | H20 | 120.2° | 120.0° |
| C24 | C25 | C26 | H21 | 120.2° | 120.0° |
| C24 | C25 | C26 | C27 | 129.7° | 180.0° |
| C25 | C24 | H18 | H19 | 116.3° | 120.0° |
| C24 | C25 | H20 | H21 | 119.5° | 120.0° |
| C24 | C25 | C26 | H22 | 109.4° | 60.0° |
| C24 | C25 | C26 | H23 | 8.8° | 60.0° |
| C25 | C26 | C27 | H22 | 120.8° | 120.0° |
| C25 | C26 | C27 | H23 | 120.9° | 120.0° |
| C25 | C26 | C27 | C28 | 48.2° | 180.0° |
| C26 | C25 | C24 | H18 | 42.6° | 55.7° |
| C26 | C25 | C24 | H19 | 75.1° | 64.4° |
| C26 | C25 | H20 | H21 | 119.4° | 120.0° |
| C25 | C26 | H22 | H23 | 117.3° | 120.0° |
| C25 | C26 | C27 | H24 | 72.0° | 60.1° |
| C25 | C26 | C27 | H25 | 168.5° | 60.0° |
| C26 | C27 | C28 | H24 | 120.2° | 119.9° |
| C26 | C27 | C28 | H25 | 120.3° | 120.0° |
| C26 | C27 | C28 | N29 | 151.8° | 180.0° |
| C26 | C27 | C28 | H11 | 31.1° | 60.0° |
| C26 | C27 | C28 | H12 | 87.5° | 60.0° |
| C27 | C26 | C25 | H20 | 9.5° | 60.0° |
| C27 | C26 | C25 | H21 | 110.1° | 60.0° |
| C27 | C26 | H22 | H23 | 117.4° | 120.0° |
| C26 | C27 | H24 | H25 | 119.2° | 120.0° |
| C27 | C28 | N29 | H11 | 120.7° | 120.0° |
| C27 | C28 | N29 | H12 | 120.7° | 120.0° |
| C27 | C28 | N29 | C30 | 52.2° | 180.0° |
| C27 | C28 | H11 | H12 | 117.9° | 120.0° |
| C28 | C27 | C26 | H22 | 169.0° | 60.0° |
| C28 | C27 | C26 | H23 | 72.7° | 60.0° |
| C28 | C27 | H24 | H25 | 119.2° | 120.0° |
| C27 | C28 | N29 | H32 | 127.7° | 0.0° |
| C28 | N29 | C30 | H32 | 180.0° | 180.0° |
| C28 | N29 | C30 | N32 | 0.6° | 0.0° |
| C28 | N29 | C30 | N31 | 179.6° | 180.0° |
| N29 | C28 | H11 | H12 | 117.9° | 120.1° |
| N29 | C28 | C27 | H24 | 87.9° | 60.0° |
| N29 | C28 | C27 | H25 | 31.6° | 60.0° |
| N29 | C30 | N32 | N31 | 179.0° | 180.0° |
| C30 | N29 | C28 | H11 | 172.9° | 60.1° |
| C30 | N29 | C28 | H12 | 68.4° | 60.0° |
| N29 | C30 | N32 | H13 | 178.9° | 180.0° |
| N29 | C30 | N31 | H33 | 179.1° | 180.0° |
| N29 | C30 | N31 | H34 | 0.9° | 0.0° |
| N32 | C30 | N29 | H32 | 179.3° | 180.0° |
| N32 | C30 | N31 | H33 | 0.0° | 0.0° |
| N32 | C30 | N31 | H34 | 180.0° | 180.0° |
| N31 | C30 | N32 | H13 | 0.0° | 0.0° |
| N31 | C30 | N29 | H32 | 0.3° | 0.0° |
| C30 | N31 | H33 | H34 | 180.0° | 180.0° |
| H2 | C17 | C18 | H3 | 176.5° | 67.5° |
| H2 | C17 | C18 | H4 | 65.2° | 172.5° |
| H2 | C17 | C02 | H14 | 117.0° | 146.4° |
| H5 | C20 | C21 | H7 | 175.1° | 65.1° |
| H5 | C20 | C21 | H8 | 56.0° | 174.8° |
| H6 | C20 | C21 | H7 | 66.7° | 174.8° |
| H6 | C20 | C21 | H8 | 174.3° | 54.7° |
| H7 | C21 | C22 | H9 | 137.7° | 180.0° |
| H7 | C21 | C22 | H10 | 102.0° | 60.0° |
| H8 | C21 | C22 | H9 | 18.7° | 60.0° |
| H8 | C21 | C22 | H10 | 139.0° | 180.0° |
| H9 | C22 | N23 | H29 | 60.2° | 60.0° |
| H9 | C22 | N23 | H30 | 59.9° | 176.0° |
| H10 | C22 | N23 | H29 | 60.1° | 60.0° |
| H10 | C22 | N23 | H30 | 179.8° | 63.9° |
| H11 | C28 | C27 | H24 | 151.4° | 59.9° |
| H11 | C28 | C27 | H25 | 89.1° | 180.0° |
| H11 | C28 | N29 | H32 | 7.0° | 120.0° |
| H12 | C28 | C27 | H24 | 32.7° | 180.0° |
| H12 | C28 | C27 | H25 | 152.2° | 60.0° |
| H12 | C28 | N29 | H32 | 111.6° | 120.0° |
| H14 | C02 | C03 | H15 | 21.3° | 0.0° |
| H14 | C02 | O01 | H35 | 51.1° | 57.4° |
| H15 | C03 | C05 | H16 | 157.8° | 146.4° |
| H15 | C03 | O04 | H36 | 60.2° | 61.2° |
| H18 | C24 | C25 | H20 | 162.8° | 64.4° |
| H18 | C24 | C25 | H21 | 77.6° | 175.6° |
| H19 | C24 | C25 | H20 | 45.1° | 175.6° |
| H19 | C24 | C25 | H21 | 164.7° | 55.6° |
| H20 | C25 | C26 | H22 | 130.4° | 180.0° |
| H20 | C25 | C26 | H23 | 111.4° | 60.0° |
| H21 | C25 | C26 | H22 | 10.8° | 60.0° |
| H21 | C25 | C26 | H23 | 129.0° | 180.0° |
| H22 | C26 | C27 | H24 | 48.8° | 60.0° |
| H22 | C26 | C27 | H25 | 70.7° | 180.0° |
| H23 | C26 | C27 | H24 | 167.1° | 180.0° |
| H23 | C26 | C27 | H25 | 47.6° | 60.0° |
