KYE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N35 | C33 | doub | 1.30Å | 1.30Å | |
| C33 | N32 | sing | 1.37Å | 1.32Å | |
| C33 | N34 | sing | 1.38Å | 1.31Å | |
| N32 | C31 | sing | 1.47Å | 1.44Å | |
| C31 | C30 | sing | 1.53Å | 1.52Å | |
| C30 | C29 | sing | 1.53Å | 1.52Å | |
| C29 | C28 | sing | 1.53Å | 1.52Å | |
| C28 | C27 | sing | 1.53Å | 1.52Å | |
| C27 | N19 | sing | 1.47Å | 1.46Å | |
| N19 | C18 | sing | 1.47Å | 1.48Å | |
| N19 | C20 | sing | 1.47Å | 1.47Å | |
| C18 | C17 | sing | 1.53Å | 1.41Å | |
| C20 | C21 | sing | 1.53Å | 1.52Å | |
| C21 | C22 | sing | 1.53Å | 1.51Å | |
| C15 | N14 | doub | 1.30Å | 1.30Å | Aromatic |
| C15 | N06 | sing | 1.36Å | 1.31Å | Aromatic |
| C17 | O16 | sing | 1.44Å | 1.50Å | |
| C17 | C02 | sing | 1.54Å | 1.56Å | |
| N26 | C22 | sing | 1.47Å | 1.42Å | |
| N14 | C13 | sing | 1.35Å | 1.33Å | Aromatic |
| C22 | C23 | sing | 1.51Å | 1.53Å | |
| O24 | C23 | doub | 1.21Å | 1.31Å | |
| O16 | C05 | sing | 1.44Å | 1.25Å | |
| C02 | C03 | sing | 1.55Å | 1.24Å | |
| C02 | O01 | sing | 1.43Å | 1.49Å | |
| C23 | O25 | sing | 1.34Å | 1.32Å | |
| C03 | C05 | sing | 1.54Å | 1.64Å | |
| C03 | O04 | sing | 1.43Å | 1.47Å | |
| N06 | C05 | sing | 1.47Å | 1.43Å | |
| N06 | C07 | sing | 1.37Å | 1.33Å | Aromatic |
| C13 | C07 | doub | 1.40Å | 1.33Å | Aromatic |
| C13 | C11 | sing | 1.41Å | 1.41Å | Aromatic |
| N12 | C11 | sing | 1.38Å | 1.45Å | |
| C07 | N08 | sing | 1.33Å | 1.33Å | Aromatic |
| C11 | N10 | doub | 1.33Å | 1.31Å | Aromatic |
| N08 | C09 | doub | 1.32Å | 1.30Å | Aromatic |
| N10 | C09 | sing | 1.32Å | 1.31Å | Aromatic |
| C02 | H1 | sing | 1.09Å | 1.10Å | |
| C03 | H2 | sing | 1.09Å | 1.10Å | |
| C05 | H3 | sing | 1.09Å | 1.10Å | |
| C09 | H4 | sing | 1.08Å | 1.08Å | |
| C15 | H5 | sing | 1.08Å | 1.08Å | |
| C17 | H6 | sing | 1.09Å | 1.10Å | |
| C18 | H7 | sing | 1.09Å | 1.10Å | |
| C18 | H8 | sing | 1.09Å | 1.10Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C27 | H14 | sing | 1.09Å | 1.10Å | |
| C27 | H15 | sing | 1.09Å | 1.10Å | |
| C28 | H16 | sing | 1.09Å | 1.10Å | |
| C28 | H17 | sing | 1.09Å | 1.10Å | |
| C29 | H18 | sing | 1.09Å | 1.10Å | |
| C29 | H19 | sing | 1.09Å | 1.10Å | |
| C30 | H20 | sing | 1.09Å | 1.10Å | |
| C30 | H21 | sing | 1.09Å | 1.10Å | |
| C31 | H22 | sing | 1.09Å | 1.10Å | |
| C31 | H23 | sing | 1.09Å | 1.10Å | |
| N12 | H24 | sing | 0.97Å | 1.00Å | |
| N12 | H25 | sing | 0.97Å | 1.00Å | |
| N26 | H27 | sing | 1.01Å | 1.00Å | |
| N26 | H28 | sing | 1.01Å | 1.00Å | |
| N32 | H30 | sing | 0.97Å | 1.00Å | |
| N34 | H31 | sing | 0.97Å | 1.00Å | |
| N34 | H32 | sing | 0.97Å | 1.00Å | |
| N35 | H33 | sing | 0.97Å | 1.00Å | |
| O01 | H34 | sing | 0.97Å | 0.95Å | |
| O04 | H35 | sing | 0.97Å | 0.95Å | |
| O25 | H36 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N35 | C33 | N32 | 120.8° | 120.1° |
| N35 | C33 | N34 | 117.5° | 120.0° |
| C33 | N35 | H33 | 112.0° | 120.0° |
| N32 | C33 | N34 | 121.7° | 120.0° |
| C33 | N32 | C31 | 120.1° | 120.0° |
| C33 | N32 | H30 | 120.0° | 120.0° |
| C33 | N34 | H31 | 120.0° | 120.0° |
| C33 | N34 | H32 | 120.0° | 120.0° |
| N32 | C31 | C30 | 116.1° | 109.5° |
| N32 | C31 | H22 | 107.8° | 109.4° |
| N32 | C31 | H23 | 107.8° | 109.5° |
| C31 | N32 | H30 | 120.0° | 120.0° |
| C31 | C30 | C29 | 108.4° | 109.5° |
| C31 | C30 | H20 | 109.8° | 109.5° |
| C31 | C30 | H21 | 109.8° | 109.5° |
| C30 | C31 | H22 | 107.8° | 109.5° |
| C30 | C31 | H23 | 107.8° | 109.5° |
| C30 | C29 | C28 | 115.9° | 109.4° |
| C30 | C29 | H18 | 107.9° | 109.5° |
| C30 | C29 | H19 | 107.9° | 109.4° |
| C29 | C30 | H20 | 109.7° | 109.5° |
| C29 | C30 | H21 | 109.8° | 109.4° |
| C29 | C28 | C27 | 113.5° | 109.4° |
| C29 | C28 | H16 | 108.5° | 109.5° |
| C29 | C28 | H17 | 108.4° | 109.5° |
| C28 | C29 | H18 | 107.9° | 109.5° |
| C28 | C29 | H19 | 107.8° | 109.5° |
| C28 | C27 | N19 | 111.7° | 109.5° |
| C28 | C27 | H14 | 108.9° | 109.4° |
| C28 | C27 | H15 | 108.9° | 109.5° |
| C27 | C28 | H16 | 108.4° | 109.5° |
| C27 | C28 | H17 | 108.5° | 109.4° |
| C27 | N19 | C18 | 113.9° | 111.0° |
| C27 | N19 | C20 | 103.5° | 111.0° |
| N19 | C27 | H14 | 108.9° | 109.5° |
| N19 | C27 | H15 | 108.9° | 109.4° |
| C18 | N19 | C20 | 114.6° | 111.0° |
| N19 | C18 | C17 | 116.1° | 109.5° |
| N19 | C18 | H7 | 107.8° | 109.5° |
| N19 | C18 | H8 | 107.8° | 109.4° |
| N19 | C20 | C21 | 108.4° | 109.5° |
| N19 | C20 | H9 | 109.8° | 109.5° |
| N19 | C20 | H10 | 109.7° | 109.4° |
| C18 | C17 | O16 | 115.4° | 110.4° |
| C18 | C17 | C02 | 109.0° | 110.4° |
| C18 | C17 | H6 | 110.9° | 110.4° |
| C17 | C18 | H7 | 107.8° | 109.5° |
| C17 | C18 | H8 | 107.8° | 109.4° |
| C20 | C21 | C22 | 114.4° | 109.5° |
| C21 | C20 | H9 | 109.7° | 109.5° |
| C21 | C20 | H10 | 109.7° | 109.5° |
| C20 | C21 | H11 | 108.2° | 109.4° |
| C20 | C21 | H12 | 108.2° | 109.5° |
| C21 | C22 | N26 | 106.8° | 109.4° |
| C21 | C22 | C23 | 110.6° | 109.5° |
| C22 | C21 | H11 | 108.2° | 109.5° |
| C22 | C21 | H12 | 108.2° | 109.5° |
| C21 | C22 | H13 | 109.7° | 109.5° |
| N14 | C15 | N06 | 108.6° | 110.0° |
| C15 | N14 | C13 | 108.3° | 109.4° |
| N14 | C15 | H5 | 125.7° | 125.0° |
| C15 | N06 | C05 | 124.6° | 126.3° |
| C15 | N06 | C07 | 108.4° | 107.5° |
| N06 | C15 | H5 | 125.7° | 125.0° |
| O16 | C17 | C02 | 102.6° | 104.8° |
| C17 | O16 | C05 | 107.9° | 105.3° |
| O16 | C17 | H6 | 109.7° | 110.3° |
| C17 | C02 | C03 | 106.5° | 104.1° |
| C17 | C02 | O01 | 105.0° | 110.5° |
| C17 | C02 | H1 | 107.6° | 110.6° |
| C02 | C17 | H6 | 108.8° | 110.4° |
| N26 | C22 | C23 | 109.1° | 109.5° |
| N26 | C22 | H13 | 111.0° | 109.5° |
| C22 | N26 | H27 | 109.5° | 110.9° |
| C22 | N26 | H28 | 109.5° | 111.0° |
| N14 | C13 | C07 | 107.7° | 107.1° |
| N14 | C13 | C11 | 134.1° | 134.7° |
| C22 | C23 | O24 | 120.0° | 120.0° |
| C22 | C23 | O25 | 121.7° | 120.0° |
| C23 | C22 | H13 | 109.5° | 109.5° |
| O24 | C23 | O25 | 117.7° | 120.0° |
| O16 | C05 | C03 | 103.3° | 104.8° |
| O16 | C05 | N06 | 107.4° | 110.5° |
| O16 | C05 | H3 | 113.6° | 110.4° |
| C03 | C02 | O01 | 116.3° | 110.5° |
| C02 | C03 | C05 | 103.5° | 104.0° |
| C02 | C03 | O04 | 115.2° | 110.5° |
| C03 | C02 | H1 | 112.3° | 110.5° |
| C02 | C03 | H2 | 111.8° | 110.5° |
| O01 | C02 | H1 | 108.5° | 110.4° |
| C02 | O01 | H34 | 109.5° | 114.1° |
| C23 | O25 | H36 | 109.5° | 117.0° |
| C05 | C03 | O04 | 111.3° | 110.6° |
| C03 | C05 | N06 | 114.0° | 110.4° |
| C05 | C03 | H2 | 106.4° | 110.5° |
| C03 | C05 | H3 | 107.8° | 110.3° |
| O04 | C03 | H2 | 108.3° | 110.6° |
| C03 | O04 | H35 | 109.5° | 114.1° |
| C05 | N06 | C07 | 126.8° | 126.3° |
| N06 | C05 | H3 | 110.5° | 110.4° |
| N06 | C07 | C13 | 106.9° | 106.0° |
| N06 | C07 | N08 | 133.2° | 134.9° |
| C07 | C13 | C11 | 118.2° | 118.2° |
| C13 | C07 | N08 | 119.9° | 119.1° |
| C13 | C11 | N12 | 119.9° | 120.8° |
| C13 | C11 | N10 | 118.3° | 118.5° |
| N12 | C11 | N10 | 121.8° | 120.8° |
| C11 | N12 | H24 | 109.5° | 119.9° |
| C11 | N12 | H25 | 109.5° | 120.0° |
| C07 | N08 | C09 | 121.1° | 120.7° |
| C11 | N10 | C09 | 121.1° | 121.2° |
| N08 | C09 | N10 | 121.4° | 122.5° |
| N08 | C09 | H4 | 119.3° | 118.8° |
| N10 | C09 | H4 | 119.3° | 118.7° |
| H7 | C18 | H8 | 109.5° | 109.5° |
| H9 | C20 | H10 | 109.5° | 109.4° |
| H11 | C21 | H12 | 109.4° | 109.4° |
| H14 | C27 | H15 | 109.5° | 109.5° |
| H16 | C28 | H17 | 109.5° | 109.5° |
| H18 | C29 | H19 | 109.4° | 109.5° |
| H20 | C30 | H21 | 109.4° | 109.5° |
| H22 | C31 | H23 | 109.5° | 109.4° |
| H24 | N12 | H25 | 109.5° | 120.0° |
| H27 | N26 | H28 | 109.4° | 111.0° |
| H31 | N34 | H32 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N35 | C33 | N32 | N34 | 179.8° | 180.0° |
| N35 | C33 | N32 | C31 | 178.6° | 0.0° |
| N35 | C33 | N32 | H30 | 1.4° | 180.0° |
| N35 | C33 | N34 | H31 | 179.8° | 180.0° |
| N35 | C33 | N34 | H32 | 0.2° | 0.1° |
| C33 | N32 | C31 | H30 | 180.0° | 180.0° |
| C33 | N32 | C31 | C30 | 141.8° | 180.0° |
| C33 | N32 | C31 | H22 | 20.9° | 60.0° |
| C33 | N32 | C31 | H23 | 97.2° | 60.0° |
| N32 | C33 | N34 | H31 | 0.0° | 0.0° |
| N32 | C33 | N34 | H32 | 180.0° | 180.0° |
| N32 | C33 | N35 | H33 | 179.8° | 180.0° |
| N34 | C33 | N32 | C31 | 1.2° | 180.0° |
| N34 | C33 | N32 | H30 | 178.8° | 0.0° |
| C33 | N34 | H31 | H32 | 180.0° | 179.9° |
| N34 | C33 | N35 | H33 | 0.0° | 0.0° |
| N32 | C31 | C30 | H22 | 120.9° | 120.0° |
| N32 | C31 | C30 | H23 | 121.0° | 120.0° |
| N32 | C31 | C30 | C29 | 175.6° | 180.0° |
| N32 | C31 | C30 | H20 | 64.5° | 60.0° |
| N32 | C31 | C30 | H21 | 55.8° | 60.0° |
| N32 | C31 | H22 | H23 | 117.0° | 120.0° |
| C31 | C30 | C29 | H20 | 119.9° | 120.0° |
| C31 | C30 | C29 | H21 | 119.8° | 120.0° |
| C31 | C30 | C29 | C28 | 147.6° | 180.0° |
| C31 | C30 | C29 | H18 | 26.6° | 60.0° |
| C31 | C30 | C29 | H19 | 91.5° | 60.0° |
| C31 | C30 | H20 | H21 | 120.5° | 120.0° |
| C30 | C31 | H22 | H23 | 117.0° | 120.0° |
| C30 | C31 | N32 | H30 | 38.2° | 0.0° |
| C30 | C29 | C28 | H18 | 121.0° | 120.1° |
| C30 | C29 | C28 | H19 | 120.9° | 119.9° |
| C30 | C29 | C28 | C27 | 75.5° | 180.0° |
| C30 | C29 | C28 | H16 | 163.9° | 60.0° |
| C30 | C29 | C28 | H17 | 45.1° | 60.1° |
| C30 | C29 | H18 | H19 | 117.1° | 120.0° |
| C29 | C30 | H20 | H21 | 120.5° | 120.0° |
| C29 | C30 | C31 | H22 | 54.7° | 60.0° |
| C29 | C30 | C31 | H23 | 63.4° | 60.0° |
| C29 | C28 | C27 | H16 | 120.6° | 120.0° |
| C29 | C28 | C27 | H17 | 120.6° | 119.9° |
| C29 | C28 | C27 | N19 | 154.6° | 180.0° |
| C29 | C28 | C27 | H14 | 85.0° | 60.1° |
| C29 | C28 | C27 | H15 | 34.3° | 60.0° |
| C29 | C28 | H16 | H17 | 118.2° | 120.0° |
| C28 | C29 | H18 | H19 | 117.1° | 120.0° |
| C28 | C29 | C30 | H20 | 92.6° | 60.0° |
| C28 | C29 | C30 | H21 | 27.7° | 60.1° |
| C28 | C27 | N19 | H14 | 120.3° | 120.0° |
| C28 | C27 | N19 | H15 | 120.3° | 120.0° |
| C28 | C27 | N19 | C18 | 63.5° | 171.4° |
| C28 | C27 | N19 | C20 | 171.4° | 64.6° |
| C28 | C27 | H14 | H15 | 119.0° | 120.0° |
| C27 | C28 | H16 | H17 | 118.1° | 120.0° |
| C27 | C28 | C29 | H18 | 45.4° | 59.9° |
| C27 | C28 | C29 | H19 | 163.5° | 60.1° |
| C27 | N19 | C18 | C20 | 119.0° | 124.0° |
| C27 | N19 | C18 | C17 | 164.3° | 78.1° |
| C27 | N19 | C20 | C21 | 88.0° | 164.2° |
| C27 | N19 | C18 | H7 | 74.8° | 161.9° |
| C27 | N19 | C18 | H8 | 43.3° | 41.9° |
| C27 | N19 | C20 | H9 | 152.1° | 44.1° |
| C27 | N19 | C20 | H10 | 31.8° | 75.9° |
| N19 | C27 | H14 | H15 | 119.0° | 120.0° |
| N19 | C27 | C28 | H16 | 34.0° | 60.0° |
| N19 | C27 | C28 | H17 | 84.8° | 60.0° |
| N19 | C18 | C17 | H7 | 120.9° | 120.1° |
| N19 | C18 | C17 | H8 | 120.9° | 119.9° |
| C18 | N19 | C20 | C21 | 147.3° | 71.8° |
| N19 | C18 | C17 | O16 | 98.7° | 68.0° |
| N19 | C18 | C17 | C02 | 146.6° | 176.7° |
| N19 | C18 | C17 | H6 | 26.8° | 54.3° |
| N19 | C18 | H7 | H8 | 117.0° | 120.0° |
| C18 | N19 | C20 | H9 | 27.5° | 168.1° |
| C18 | N19 | C20 | H10 | 92.9° | 48.1° |
| C18 | N19 | C27 | H14 | 56.8° | 51.4° |
| C18 | N19 | C27 | H15 | 176.2° | 68.6° |
| C20 | N19 | C18 | C17 | 45.3° | 158.0° |
| N19 | C20 | C21 | H9 | 119.9° | 120.1° |
| N19 | C20 | C21 | H10 | 119.9° | 119.9° |
| N19 | C20 | C21 | C22 | 154.2° | 174.6° |
| C20 | N19 | C18 | H7 | 166.2° | 37.9° |
| C20 | N19 | C18 | H8 | 75.6° | 82.1° |
| N19 | C20 | H9 | H10 | 120.5° | 120.0° |
| N19 | C20 | C21 | H11 | 85.0° | 54.6° |
| N19 | C20 | C21 | H12 | 33.5° | 65.3° |
| C20 | N19 | C27 | H14 | 68.3° | 175.4° |
| C20 | N19 | C27 | H15 | 51.1° | 55.4° |
| C18 | C17 | O16 | C02 | 118.4° | 118.9° |
| C18 | C17 | O16 | H6 | 126.0° | 122.3° |
| C18 | C17 | C02 | H6 | 121.0° | 122.4° |
| C18 | C17 | O16 | C05 | 133.5° | 159.4° |
| C18 | C17 | C02 | C03 | 108.3° | 142.8° |
| C18 | C17 | C02 | O01 | 127.8° | 98.5° |
| C18 | C17 | C02 | H1 | 12.3° | 24.1° |
| C17 | C18 | H7 | H8 | 117.0° | 120.0° |
| C20 | C21 | C22 | H11 | 120.8° | 120.0° |
| C20 | C21 | C22 | H12 | 120.7° | 120.0° |
| C20 | C21 | C22 | N26 | 174.9° | 65.0° |
| C20 | C21 | C22 | C23 | 56.2° | 175.0° |
| C21 | C20 | H9 | H10 | 120.4° | 120.0° |
| C20 | C21 | H11 | H12 | 117.8° | 120.0° |
| C20 | C21 | C22 | H13 | 64.7° | 55.0° |
| C21 | C22 | N26 | C23 | 119.6° | 120.0° |
| C21 | C22 | N26 | H13 | 119.6° | 120.0° |
| C21 | C22 | C23 | H13 | 121.0° | 120.0° |
| C21 | C22 | C23 | O24 | 46.5° | 100.0° |
| C21 | C22 | C23 | O25 | 124.0° | 80.0° |
| C22 | C21 | C20 | H9 | 34.4° | 54.6° |
| C22 | C21 | C20 | H10 | 85.9° | 65.4° |
| C22 | C21 | H11 | H12 | 117.7° | 120.0° |
| C21 | C22 | N26 | H27 | 180.0° | 60.0° |
| C21 | C22 | N26 | H28 | 60.0° | 63.9° |
| N14 | C15 | N06 | H5 | 180.0° | 179.9° |
| N14 | C15 | N06 | C05 | 178.1° | 180.0° |
| N14 | C15 | N06 | C07 | 1.1° | 0.2° |
| C15 | N14 | C13 | C07 | 0.1° | 0.1° |
| C15 | N14 | C13 | C11 | 179.8° | 179.9° |
| N06 | C15 | N14 | C13 | 0.7° | 0.1° |
| C15 | N06 | C05 | O16 | 55.7° | 20.4° |
| C15 | N06 | C05 | C03 | 58.1° | 95.1° |
| C15 | N06 | C05 | C07 | 176.5° | 179.8° |
| C15 | N06 | C07 | C13 | 1.0° | 0.2° |
| C15 | N06 | C07 | N08 | 180.0° | 180.0° |
| C15 | N06 | C05 | H3 | 179.8° | 142.8° |
| O16 | C17 | C02 | H6 | 116.2° | 118.7° |
| O16 | C17 | C02 | C03 | 14.5° | 24.0° |
| O16 | C17 | C02 | O01 | 109.4° | 142.6° |
| C17 | O16 | C05 | C03 | 31.8° | 40.5° |
| C17 | O16 | C05 | N06 | 152.6° | 159.4° |
| O16 | C17 | C02 | H1 | 135.1° | 94.8° |
| C17 | O16 | C05 | H3 | 84.8° | 78.3° |
| O16 | C17 | C18 | H7 | 22.3° | 172.0° |
| O16 | C17 | C18 | H8 | 140.4° | 52.0° |
| C02 | C17 | O16 | C05 | 15.1° | 40.5° |
| C17 | C02 | C03 | O01 | 116.6° | 118.7° |
| C17 | C02 | C03 | H1 | 117.6° | 118.8° |
| C17 | C02 | O01 | H1 | 114.9° | 122.7° |
| C17 | C02 | C03 | C05 | 31.1° | 0.0° |
| C17 | C02 | C03 | O04 | 152.8° | 118.7° |
| C17 | C02 | C03 | H2 | 83.0° | 118.6° |
| C02 | C17 | C18 | H7 | 92.5° | 56.6° |
| C02 | C17 | C18 | H8 | 25.6° | 63.4° |
| C17 | C02 | O01 | H34 | 180.0° | 176.2° |
| N26 | C22 | C23 | H13 | 121.7° | 120.0° |
| N26 | C22 | C23 | O24 | 163.8° | 20.0° |
| N26 | C22 | C23 | O25 | 6.7° | 160.0° |
| N26 | C22 | C21 | H11 | 54.1° | 175.0° |
| N26 | C22 | C21 | H12 | 64.4° | 55.0° |
| C22 | N26 | H27 | H28 | 120.0° | 124.0° |
| N14 | C13 | C07 | N06 | 0.6° | 0.2° |
| N14 | C13 | C07 | C11 | 179.8° | 180.0° |
| N14 | C13 | C11 | N12 | 0.4° | 0.0° |
| N14 | C13 | C07 | N08 | 179.7° | 180.0° |
| N14 | C13 | C11 | N10 | 179.4° | 180.0° |
| C13 | N14 | C15 | H5 | 179.2° | 180.0° |
| C22 | C23 | O24 | O25 | 170.9° | 180.0° |
| C23 | C22 | C21 | H11 | 64.5° | 55.0° |
| C23 | C22 | C21 | H12 | 177.0° | 65.0° |
| C23 | C22 | N26 | H27 | 60.3° | 60.0° |
| C23 | C22 | N26 | H28 | 59.6° | 176.0° |
| C22 | C23 | O25 | H36 | 170.7° | 180.0° |
| O24 | C23 | C22 | H13 | 74.5° | 140.0° |
| O24 | C23 | O25 | H36 | 0.0° | 0.0° |
| O16 | C05 | C03 | C02 | 42.8° | 23.9° |
| O16 | C05 | C03 | N06 | 116.3° | 119.0° |
| O16 | C05 | C03 | H3 | 120.6° | 118.8° |
| O16 | C05 | C03 | O04 | 167.1° | 142.6° |
| O16 | C05 | N06 | H3 | 124.5° | 122.3° |
| O16 | C05 | N06 | C07 | 120.7° | 159.8° |
| O16 | C05 | C03 | H2 | 75.1° | 94.7° |
| C05 | O16 | C17 | H6 | 100.5° | 78.4° |
| C03 | C02 | O01 | H1 | 127.8° | 122.6° |
| C02 | C03 | C05 | O04 | 124.3° | 118.7° |
| C02 | C03 | C05 | H2 | 117.9° | 118.6° |
| C02 | C03 | O04 | H2 | 126.0° | 122.6° |
| C02 | C03 | C05 | N06 | 159.1° | 142.9° |
| C02 | C03 | C05 | H3 | 77.7° | 94.9° |
| C03 | C02 | C17 | H6 | 130.6° | 94.8° |
| C03 | C02 | O01 | H34 | 62.6° | 61.5° |
| C02 | C03 | O04 | H35 | 180.0° | 61.5° |
| O01 | C02 | C03 | C05 | 85.5° | 118.7° |
| O01 | C02 | C03 | O04 | 36.3° | 0.0° |
| O01 | C02 | C03 | H2 | 160.5° | 122.7° |
| O01 | C02 | C17 | H6 | 6.7° | 23.9° |
| O25 | C23 | C22 | H13 | 115.0° | 40.0° |
| C05 | C03 | O04 | H2 | 116.6° | 122.7° |
| C03 | C05 | N06 | H3 | 121.7° | 122.2° |
| C03 | C05 | N06 | C07 | 125.4° | 84.7° |
| C05 | C03 | C02 | H1 | 148.7° | 118.8° |
| C05 | C03 | O04 | H35 | 62.6° | 176.1° |
| O04 | C03 | C05 | N06 | 76.6° | 98.4° |
| O04 | C03 | C02 | H1 | 89.6° | 122.5° |
| O04 | C03 | C05 | H3 | 46.6° | 23.8° |
| C05 | N06 | C07 | C13 | 178.0° | 179.9° |
| C05 | N06 | C07 | N08 | 3.0° | 0.2° |
| N06 | C05 | C03 | H2 | 41.2° | 24.3° |
| C05 | N06 | C15 | H5 | 1.9° | 0.1° |
| N06 | C07 | C13 | N08 | 179.2° | 179.8° |
| N06 | C07 | C13 | C11 | 179.2° | 179.8° |
| N06 | C07 | N08 | C09 | 179.5° | 179.7° |
| C07 | N06 | C05 | H3 | 3.7° | 37.5° |
| C07 | N06 | C15 | H5 | 178.9° | 179.9° |
| C07 | C13 | C11 | N12 | 179.4° | 180.0° |
| C07 | C13 | C11 | N10 | 0.9° | 0.0° |
| C13 | C07 | N08 | C09 | 0.6° | 0.0° |
| C13 | C11 | N12 | N10 | 179.7° | 180.0° |
| C11 | C13 | C07 | N08 | 0.1° | 0.0° |
| C13 | C11 | N10 | C09 | 1.4° | 0.0° |
| C13 | C11 | N12 | H24 | 179.8° | 180.0° |
| C13 | C11 | N12 | H25 | 59.7° | 0.1° |
| N12 | C11 | N10 | C09 | 178.9° | 180.0° |
| C11 | N12 | H24 | H25 | 120.0° | 180.0° |
| C07 | N08 | C09 | N10 | 0.1° | 0.1° |
| C07 | N08 | C09 | H4 | 179.9° | 180.0° |
| C11 | N10 | C09 | N08 | 0.9° | 0.1° |
| C11 | N10 | C09 | H4 | 179.1° | 180.0° |
| N10 | C11 | N12 | H24 | 0.0° | 0.0° |
| N10 | C11 | N12 | H25 | 120.0° | 180.0° |
| N08 | C09 | N10 | H4 | 180.0° | 179.9° |
| H1 | C02 | C03 | H2 | 34.6° | 0.2° |
| H1 | C02 | C17 | H6 | 108.7° | 146.5° |
| H1 | C02 | O01 | H34 | 65.1° | 61.1° |
| H2 | C03 | C05 | H3 | 164.4° | 146.6° |
| H2 | C03 | O04 | H35 | 54.0° | 61.2° |
| H6 | C17 | C18 | H7 | 147.7° | 65.8° |
| H6 | C17 | C18 | H8 | 94.2° | 174.2° |
| H9 | C20 | C21 | H11 | 155.1° | 65.5° |
| H9 | C20 | C21 | H12 | 86.4° | 174.6° |
| H10 | C20 | C21 | H11 | 34.8° | 174.6° |
| H10 | C20 | C21 | H12 | 153.4° | 54.6° |
| H11 | C21 | C22 | H13 | 174.6° | 65.0° |
| H12 | C21 | C22 | H13 | 56.1° | 175.0° |
| H13 | C22 | N26 | H27 | 60.4° | 180.0° |
| H13 | C22 | N26 | H28 | 179.6° | 56.0° |
| H14 | C27 | C28 | H16 | 154.4° | 60.0° |
| H14 | C27 | C28 | H17 | 35.6° | 180.0° |
| H15 | C27 | C28 | H16 | 86.3° | 180.0° |
| H15 | C27 | C28 | H17 | 154.9° | 60.0° |
| H16 | C28 | C29 | H18 | 75.1° | 180.0° |
| H16 | C28 | C29 | H19 | 42.9° | 60.0° |
| H17 | C28 | C29 | H18 | 166.0° | 60.0° |
| H17 | C28 | C29 | H19 | 75.9° | 180.0° |
| H18 | C29 | C30 | H20 | 146.5° | 180.0° |
| H18 | C29 | C30 | H21 | 93.2° | 60.0° |
| H19 | C29 | C30 | H20 | 28.4° | 60.0° |
| H19 | C29 | C30 | H21 | 148.7° | 180.0° |
| H20 | C30 | C31 | H22 | 174.5° | 180.0° |
| H20 | C30 | C31 | H23 | 56.4° | 60.0° |
| H21 | C30 | C31 | H22 | 65.1° | 60.0° |
| H21 | C30 | C31 | H23 | 176.7° | 180.0° |
| H22 | C31 | N32 | H30 | 159.2° | 120.0° |
| H23 | C31 | N32 | H30 | 82.7° | 120.0° |
