6EK
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O01 | C05 | sing | 1.43Å | 1.38Å | |
| CL | C14 | sing | 1.74Å | 1.74Å | |
| C05 | C04 | sing | 1.53Å | 1.52Å | |
| C05 | C01 | sing | 1.53Å | 1.47Å | |
| C03 | N01 | sing | 1.47Å | 1.45Å | |
| C03 | C02 | sing | 1.53Å | 1.51Å | |
| C04 | N01 | sing | 1.47Å | 1.47Å | |
| C04 | C06 | sing | 1.51Å | 1.55Å | |
| C01 | C02 | sing | 1.53Å | 1.47Å | |
| C14 | N06 | doub | 1.31Å | 1.35Å | Aromatic |
| C14 | N05 | sing | 1.35Å | 1.34Å | Aromatic |
| C | N09 | sing | 1.34Å | 1.35Å | Aromatic |
| C | C23 | doub | 1.34Å | 1.39Å | Aromatic |
| N02 | C06 | sing | 1.35Å | 1.46Å | |
| N02 | C07 | sing | 1.46Å | 1.48Å | |
| N03 | C09 | sing | 1.46Å | 1.45Å | |
| N03 | C08 | sing | 1.35Å | 1.46Å | |
| O02 | C17 | doub | 1.21Å | 1.28Å | |
| C06 | O06 | doub | 1.21Å | 1.20Å | |
| C09 | C22 | sing | 1.53Å | 1.55Å | |
| C09 | C10 | sing | 1.51Å | 1.46Å | |
| N06 | C15 | sing | 1.34Å | 1.34Å | Aromatic |
| N05 | C16 | sing | 1.37Å | 1.35Å | Aromatic |
| N09 | C24 | doub | 1.31Å | 1.35Å | Aromatic |
| C22 | C23 | sing | 1.51Å | 1.57Å | |
| N04 | C10 | sing | 1.35Å | 1.48Å | |
| N04 | C11 | sing | 1.46Å | 1.53Å | |
| C23 | N08 | sing | 1.38Å | 1.36Å | Aromatic |
| C10 | O05 | doub | 1.21Å | 1.22Å | |
| C18 | C07 | sing | 1.53Å | 1.57Å | |
| C18 | C19 | sing | 1.53Å | 1.55Å | |
| C17 | O03 | sing | 1.34Å | 1.24Å | |
| C17 | C11 | sing | 1.51Å | 1.56Å | |
| C07 | C08 | sing | 1.51Å | 1.56Å | |
| C08 | O04 | doub | 1.21Å | 1.26Å | |
| C15 | C16 | doub | 1.35Å | 1.39Å | Aromatic |
| C16 | C12 | sing | 1.51Å | 1.55Å | |
| C24 | N08 | sing | 1.36Å | 1.35Å | Aromatic |
| C24 | N | sing | 1.39Å | 1.46Å | |
| C19 | C20 | sing | 1.53Å | 1.55Å | |
| C19 | O | sing | 1.43Å | 1.37Å | |
| C11 | C12 | sing | 1.53Å | 1.52Å | |
| C20 | O07 | sing | 1.45Å | 1.41Å | |
| C12 | O09 | sing | 1.43Å | 1.39Å | |
| O07 | C21 | sing | 1.35Å | 1.40Å | |
| O08 | C21 | doub | 1.21Å | 1.21Å | |
| C21 | N07 | sing | 1.35Å | 1.45Å | |
| C15 | H1 | sing | 1.08Å | 1.08Å | |
| C20 | H2 | sing | 1.09Å | 1.10Å | |
| C20 | H3 | sing | 1.09Å | 1.10Å | |
| C22 | H4 | sing | 1.09Å | 1.10Å | |
| C22 | H5 | sing | 1.09Å | 1.10Å | |
| C01 | H6 | sing | 1.09Å | 1.10Å | |
| C01 | H7 | sing | 1.09Å | 1.10Å | |
| C02 | H8 | sing | 1.09Å | 1.10Å | |
| C02 | H9 | sing | 1.09Å | 1.10Å | |
| C03 | H10 | sing | 1.09Å | 1.10Å | |
| C03 | H11 | sing | 1.09Å | 1.10Å | |
| N01 | H12 | sing | 1.01Å | 1.00Å | |
| C04 | H14 | sing | 1.09Å | 1.10Å | |
| C05 | H15 | sing | 1.09Å | 1.10Å | |
| O01 | H16 | sing | 0.97Å | 0.95Å | |
| N02 | H17 | sing | 0.97Å | 1.00Å | |
| C07 | H18 | sing | 1.09Å | 1.10Å | |
| N03 | H19 | sing | 0.97Å | 1.00Å | |
| C09 | H20 | sing | 1.09Å | 1.10Å | |
| N04 | H21 | sing | 0.97Å | 1.00Å | |
| C11 | H22 | sing | 1.09Å | 1.10Å | |
| C12 | H23 | sing | 1.09Å | 1.10Å | |
| O09 | H24 | sing | 0.97Å | 0.95Å | |
| N05 | H25 | sing | 0.97Å | 1.00Å | |
| O03 | H27 | sing | 0.97Å | 0.95Å | |
| C18 | H28 | sing | 1.09Å | 1.10Å | |
| C18 | H29 | sing | 1.09Å | 1.10Å | |
| C19 | H30 | sing | 1.09Å | 1.10Å | |
| N07 | H31 | sing | 0.97Å | 1.00Å | |
| N07 | H32 | sing | 0.97Å | 1.00Å | |
| O | H33 | sing | 0.97Å | 0.95Å | |
| N08 | H34 | sing | 0.97Å | 1.00Å | |
| C | H35 | sing | 1.08Å | 1.08Å | |
| N | H37 | sing | 0.97Å | 1.00Å | |
| N | H38 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | C05 | C04 | 111.5° | 109.5° |
| O01 | C05 | C01 | 104.2° | 109.5° |
| O01 | C05 | H15 | 108.9° | 109.5° |
| C05 | O01 | H16 | 109.5° | 114.0° |
| CL | C14 | N06 | 125.0° | 125.7° |
| CL | C14 | N05 | 125.4° | 125.6° |
| C04 | C05 | C01 | 117.1° | 109.3° |
| C05 | C04 | N01 | 115.6° | 109.5° |
| C05 | C04 | C06 | 111.8° | 109.4° |
| C05 | C04 | H14 | 105.8° | 109.5° |
| C04 | C05 | H15 | 107.1° | 109.5° |
| C05 | C01 | C02 | 116.5° | 109.1° |
| C05 | C01 | H6 | 107.7° | 109.5° |
| C05 | C01 | H7 | 107.7° | 109.7° |
| C01 | C05 | H15 | 107.8° | 109.5° |
| N01 | C03 | C02 | 111.3° | 109.5° |
| C03 | N01 | C04 | 115.0° | 111.2° |
| N01 | C03 | H10 | 109.0° | 109.4° |
| N01 | C03 | H11 | 109.0° | 109.4° |
| C03 | N01 | H12 | 108.1° | 111.0° |
| C03 | C02 | C01 | 112.7° | 109.3° |
| C03 | C02 | H8 | 108.7° | 109.5° |
| C03 | C02 | H9 | 108.7° | 109.5° |
| C02 | C03 | H10 | 109.0° | 109.5° |
| C02 | C03 | H11 | 109.0° | 109.5° |
| N01 | C04 | C06 | 110.9° | 109.5° |
| C04 | N01 | H12 | 108.0° | 111.0° |
| N01 | C04 | H14 | 106.4° | 109.5° |
| C04 | C06 | N02 | 122.0° | 120.0° |
| C04 | C06 | O06 | 118.2° | 120.0° |
| C06 | C04 | H14 | 105.6° | 109.5° |
| C02 | C01 | H6 | 107.7° | 109.5° |
| C02 | C01 | H7 | 107.7° | 109.5° |
| C01 | C02 | H8 | 108.6° | 109.5° |
| C01 | C02 | H9 | 108.6° | 109.5° |
| N06 | C14 | N05 | 109.7° | 108.7° |
| C14 | N06 | C15 | 107.4° | 109.3° |
| C14 | N05 | C16 | 107.9° | 107.2° |
| C14 | N05 | H25 | 126.0° | 126.4° |
| N09 | C | C23 | 108.2° | 108.3° |
| C | N09 | C24 | 108.2° | 109.3° |
| N09 | C | H35 | 125.9° | 125.8° |
| C | C23 | C22 | 127.0° | 126.5° |
| C | C23 | N08 | 106.0° | 106.9° |
| C23 | C | H35 | 125.9° | 125.8° |
| C06 | N02 | C07 | 123.0° | 120.0° |
| N02 | C06 | O06 | 119.8° | 120.0° |
| C06 | N02 | H17 | 118.5° | 120.0° |
| N02 | C07 | C18 | 114.6° | 109.5° |
| N02 | C07 | C08 | 111.2° | 109.5° |
| C07 | N02 | H17 | 118.5° | 120.0° |
| N02 | C07 | H18 | 106.5° | 109.5° |
| C09 | N03 | C08 | 124.4° | 120.0° |
| N03 | C09 | C22 | 110.4° | 109.5° |
| N03 | C09 | C10 | 106.7° | 109.5° |
| C09 | N03 | H19 | 117.8° | 120.1° |
| N03 | C09 | H20 | 109.0° | 109.5° |
| N03 | C08 | C07 | 121.2° | 120.0° |
| N03 | C08 | O04 | 120.3° | 120.0° |
| C08 | N03 | H19 | 117.8° | 120.0° |
| O02 | C17 | O03 | 120.0° | 120.0° |
| O02 | C17 | C11 | 119.7° | 120.0° |
| C22 | C09 | C10 | 114.2° | 109.5° |
| C09 | C22 | C23 | 116.4° | 109.5° |
| C09 | C22 | H4 | 107.7° | 109.5° |
| C09 | C22 | H5 | 107.7° | 109.5° |
| C22 | C09 | H20 | 107.8° | 109.5° |
| C09 | C10 | N04 | 122.2° | 120.0° |
| C09 | C10 | O05 | 119.0° | 120.0° |
| C10 | C09 | H20 | 108.8° | 109.4° |
| N06 | C15 | C16 | 108.1° | 108.0° |
| N06 | C15 | H1 | 126.0° | 126.0° |
| N05 | C16 | C15 | 106.9° | 106.9° |
| N05 | C16 | C12 | 127.5° | 126.6° |
| C16 | N05 | H25 | 126.0° | 126.4° |
| N09 | C24 | N08 | 108.3° | 108.4° |
| N09 | C24 | N | 126.0° | 125.8° |
| C22 | C23 | N08 | 127.0° | 126.5° |
| C23 | C22 | H4 | 107.7° | 109.5° |
| C23 | C22 | H5 | 107.7° | 109.5° |
| C10 | N04 | C11 | 118.6° | 120.0° |
| N04 | C10 | O05 | 118.8° | 119.9° |
| C10 | N04 | H21 | 120.7° | 120.0° |
| N04 | C11 | C17 | 110.6° | 109.4° |
| N04 | C11 | C12 | 118.2° | 109.5° |
| C11 | N04 | H21 | 120.7° | 120.0° |
| N04 | C11 | H22 | 105.7° | 109.5° |
| C23 | N08 | C24 | 109.2° | 107.0° |
| C23 | N08 | H34 | 125.4° | 126.5° |
| C07 | C18 | C19 | 115.5° | 109.5° |
| C18 | C07 | C08 | 112.7° | 109.5° |
| C18 | C07 | H18 | 105.5° | 109.5° |
| C07 | C18 | H28 | 108.0° | 109.4° |
| C07 | C18 | H29 | 107.9° | 109.5° |
| C18 | C19 | C20 | 115.4° | 109.5° |
| C18 | C19 | O | 109.5° | 109.5° |
| C19 | C18 | H28 | 108.0° | 109.5° |
| C19 | C18 | H29 | 108.0° | 109.5° |
| C18 | C19 | H30 | 106.2° | 109.5° |
| O03 | C17 | C11 | 120.3° | 120.0° |
| C17 | O03 | H27 | 109.5° | 117.0° |
| C17 | C11 | C12 | 110.1° | 109.4° |
| C17 | C11 | H22 | 105.4° | 109.4° |
| C07 | C08 | O04 | 118.5° | 120.0° |
| C08 | C07 | H18 | 105.6° | 109.5° |
| C15 | C16 | C12 | 125.6° | 126.6° |
| C16 | C15 | H1 | 125.9° | 126.0° |
| C16 | C12 | C11 | 111.3° | 109.5° |
| C16 | C12 | O09 | 109.8° | 109.5° |
| C16 | C12 | H23 | 106.6° | 109.4° |
| N08 | C24 | N | 125.7° | 125.8° |
| C24 | N08 | H34 | 125.4° | 126.5° |
| C24 | N | H37 | 109.5° | 120.0° |
| C24 | N | H38 | 109.5° | 120.0° |
| C20 | C19 | O | 111.0° | 109.4° |
| C19 | C20 | O07 | 114.5° | 109.5° |
| C19 | C20 | H2 | 108.2° | 109.5° |
| C19 | C20 | H3 | 108.2° | 109.5° |
| C20 | C19 | H30 | 106.1° | 109.5° |
| O | C19 | H30 | 108.3° | 109.5° |
| C19 | O | H33 | 109.5° | 114.0° |
| C11 | C12 | O09 | 113.4° | 109.5° |
| C12 | C11 | H22 | 105.8° | 109.5° |
| C11 | C12 | H23 | 107.0° | 109.5° |
| C20 | O07 | C21 | 120.8° | 117.0° |
| O07 | C20 | H2 | 108.2° | 109.4° |
| O07 | C20 | H3 | 108.2° | 109.5° |
| O09 | C12 | H23 | 108.5° | 109.5° |
| C12 | O09 | H24 | 109.5° | 114.0° |
| O07 | C21 | O08 | 119.6° | 120.0° |
| O07 | C21 | N07 | 119.9° | 119.9° |
| O08 | C21 | N07 | 118.5° | 120.0° |
| C21 | N07 | H31 | 120.0° | 120.1° |
| C21 | N07 | H32 | 120.0° | 119.9° |
| H2 | C20 | H3 | 109.5° | 109.4° |
| H4 | C22 | H5 | 109.5° | 109.5° |
| H6 | C01 | H7 | 109.5° | 109.5° |
| H8 | C02 | H9 | 109.5° | 109.5° |
| H10 | C03 | H11 | 109.5° | 109.5° |
| H28 | C18 | H29 | 109.4° | 109.5° |
| H31 | N07 | H32 | 120.0° | 120.0° |
| H37 | N | H38 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | C05 | C04 | C01 | 119.9° | 119.9° |
| O01 | C05 | C04 | H15 | 119.1° | 120.1° |
| O01 | C05 | C01 | H15 | 115.6° | 120.1° |
| O01 | C05 | C04 | N01 | 87.5° | 179.1° |
| O01 | C05 | C04 | C06 | 144.4° | 60.9° |
| O01 | C05 | C01 | C02 | 100.5° | 177.6° |
| O01 | C05 | C01 | H6 | 138.5° | 57.7° |
| O01 | C05 | C01 | H7 | 20.6° | 62.4° |
| O01 | C05 | C04 | H14 | 30.0° | 59.1° |
| CL | C14 | N06 | N05 | 180.0° | 179.7° |
| CL | C14 | N06 | C15 | 179.9° | 180.0° |
| CL | C14 | N05 | C16 | 179.8° | 179.8° |
| CL | C14 | N05 | H25 | 0.3° | 0.3° |
| C04 | C05 | C01 | H15 | 120.7° | 120.0° |
| C05 | C04 | N01 | C03 | 5.2° | 61.8° |
| C05 | C04 | N01 | C06 | 128.5° | 120.0° |
| C05 | C04 | N01 | H14 | 117.1° | 120.0° |
| C05 | C04 | C06 | H14 | 114.6° | 120.0° |
| C04 | C05 | C01 | C02 | 23.2° | 57.7° |
| C05 | C04 | C06 | N02 | 147.9° | 80.0° |
| C05 | C04 | C06 | O06 | 31.7° | 100.1° |
| C04 | C05 | C01 | H6 | 97.8° | 62.2° |
| C04 | C05 | C01 | H7 | 144.2° | 177.6° |
| C05 | C04 | N01 | H12 | 115.6° | 62.3° |
| C04 | C05 | O01 | H16 | 180.0° | 179.9° |
| C05 | C01 | C02 | C03 | 21.2° | 57.6° |
| C01 | C05 | C04 | N01 | 32.4° | 59.2° |
| C01 | C05 | C04 | C06 | 95.7° | 179.2° |
| C05 | C01 | C02 | H6 | 121.0° | 119.9° |
| C05 | C01 | C02 | H7 | 121.0° | 120.0° |
| C05 | C01 | H6 | H7 | 116.8° | 120.3° |
| C05 | C01 | C02 | H8 | 141.7° | 62.3° |
| C05 | C01 | C02 | H9 | 99.2° | 177.6° |
| C01 | C05 | C04 | H14 | 149.8° | 60.8° |
| C01 | C05 | O01 | H16 | 52.9° | 60.1° |
| N01 | C03 | C02 | H10 | 120.3° | 120.0° |
| N01 | C03 | C02 | H11 | 120.2° | 120.0° |
| C03 | N01 | C04 | H12 | 120.8° | 124.1° |
| C03 | N01 | C04 | C06 | 133.7° | 178.3° |
| N01 | C03 | C02 | C01 | 58.9° | 59.2° |
| N01 | C03 | C02 | H8 | 179.4° | 60.8° |
| N01 | C03 | C02 | H9 | 61.5° | 179.2° |
| N01 | C03 | H10 | H11 | 119.2° | 120.0° |
| C03 | N01 | C04 | H14 | 111.9° | 58.3° |
| C02 | C03 | N01 | C04 | 49.8° | 61.8° |
| C03 | C02 | C01 | H8 | 120.5° | 120.0° |
| C03 | C02 | C01 | H9 | 120.5° | 120.0° |
| C03 | C02 | C01 | H6 | 142.3° | 62.2° |
| C03 | C02 | C01 | H7 | 99.8° | 177.7° |
| C03 | C02 | H8 | H9 | 118.6° | 120.1° |
| C02 | C03 | H10 | H11 | 119.2° | 120.0° |
| C02 | C03 | N01 | H12 | 71.0° | 62.3° |
| N01 | C04 | C06 | H14 | 114.8° | 120.0° |
| N01 | C04 | C06 | N02 | 81.5° | 160.0° |
| N01 | C04 | C06 | O06 | 98.8° | 19.9° |
| C04 | N01 | C03 | H10 | 70.5° | 178.2° |
| C04 | N01 | C03 | H11 | 170.0° | 58.2° |
| N01 | C04 | C05 | H15 | 153.4° | 60.7° |
| C04 | C06 | N02 | O06 | 179.6° | 179.9° |
| C04 | C06 | N02 | C07 | 179.7° | 180.0° |
| C06 | C04 | N01 | H12 | 12.9° | 57.6° |
| C06 | C04 | C05 | H15 | 25.3° | 59.2° |
| C04 | C06 | N02 | H17 | 0.3° | 0.0° |
| C02 | C01 | H6 | H7 | 116.8° | 120.1° |
| C01 | C02 | H8 | H9 | 118.5° | 120.1° |
| C01 | C02 | C03 | H10 | 61.4° | 179.2° |
| C01 | C02 | C03 | H11 | 179.2° | 60.8° |
| C02 | C01 | C05 | H15 | 143.9° | 62.3° |
| N06 | C14 | N05 | C16 | 0.2° | 0.5° |
| C14 | N06 | C15 | C16 | 0.1° | 0.0° |
| C14 | N06 | C15 | H1 | 179.9° | 179.7° |
| N06 | C14 | N05 | H25 | 179.7° | 180.0° |
| N05 | C14 | N06 | C15 | 0.1° | 0.3° |
| C14 | N05 | C16 | H25 | 180.0° | 179.5° |
| C14 | N05 | C16 | C15 | 0.3° | 0.5° |
| C14 | N05 | C16 | C12 | 179.7° | 179.6° |
| N09 | C | C23 | H35 | 180.0° | 179.8° |
| N09 | C | C23 | C22 | 179.0° | 180.0° |
| N09 | C | C23 | N08 | 1.2° | 0.4° |
| C | N09 | C24 | N08 | 0.2° | 0.0° |
| C | N09 | C24 | N | 179.8° | 179.8° |
| C | C23 | C22 | C09 | 104.1° | 84.5° |
| C23 | C | N09 | C24 | 0.8° | 0.2° |
| C | C23 | C22 | N08 | 177.4° | 179.5° |
| C | C23 | N08 | C24 | 1.1° | 0.4° |
| C | C23 | C22 | H4 | 16.9° | 155.5° |
| C | C23 | C22 | H5 | 134.9° | 35.5° |
| C | C23 | N08 | H34 | 178.9° | 179.6° |
| C06 | N02 | C07 | H17 | 180.0° | 180.0° |
| C06 | N02 | C07 | C18 | 164.8° | 85.0° |
| C06 | N02 | C07 | C08 | 66.0° | 155.0° |
| N02 | C06 | C04 | H14 | 33.3° | 40.0° |
| C06 | N02 | C07 | H18 | 48.5° | 35.0° |
| N02 | C07 | C08 | N03 | 58.0° | 180.0° |
| C07 | N02 | C06 | O06 | 0.7° | 0.0° |
| N02 | C07 | C18 | C08 | 128.5° | 120.0° |
| N02 | C07 | C18 | H18 | 116.8° | 120.0° |
| N02 | C07 | C18 | C19 | 81.6° | 65.0° |
| N02 | C07 | C08 | H18 | 115.1° | 120.0° |
| N02 | C07 | C08 | O04 | 122.7° | 0.0° |
| N02 | C07 | C18 | H28 | 39.3° | 55.0° |
| N02 | C07 | C18 | H29 | 157.5° | 175.0° |
| C09 | N03 | C08 | H19 | 180.0° | 179.9° |
| N03 | C09 | C22 | C10 | 120.2° | 120.0° |
| N03 | C09 | C22 | H20 | 118.9° | 120.1° |
| N03 | C09 | C10 | H20 | 117.4° | 120.0° |
| N03 | C09 | C22 | C23 | 174.0° | 65.0° |
| N03 | C09 | C10 | N04 | 81.3° | 179.7° |
| N03 | C09 | C10 | O05 | 98.8° | 0.1° |
| C09 | N03 | C08 | C07 | 179.9° | 180.0° |
| C09 | N03 | C08 | O04 | 0.5° | 0.0° |
| N03 | C09 | C22 | H4 | 65.0° | 55.0° |
| N03 | C09 | C22 | H5 | 53.0° | 175.0° |
| C08 | N03 | C09 | C22 | 59.1° | 85.0° |
| C08 | N03 | C09 | C10 | 65.4° | 155.0° |
| N03 | C08 | C07 | C18 | 72.3° | 60.0° |
| N03 | C08 | C07 | O04 | 179.4° | 180.0° |
| N03 | C08 | C07 | H18 | 173.1° | 60.0° |
| C08 | N03 | C09 | H20 | 177.3° | 35.1° |
| O02 | C17 | C11 | N04 | 17.1° | 0.0° |
| O02 | C17 | O03 | C11 | 179.9° | 179.9° |
| O02 | C17 | C11 | C12 | 149.6° | 120.0° |
| O02 | C17 | C11 | H22 | 96.7° | 120.0° |
| O02 | C17 | O03 | H27 | 0.0° | 0.1° |
| O06 | C06 | C04 | H14 | 146.3° | 140.0° |
| O06 | C06 | N02 | H17 | 179.3° | 180.0° |
| C22 | C09 | C10 | H20 | 120.4° | 120.0° |
| C09 | C22 | C23 | H4 | 121.0° | 120.0° |
| C09 | C22 | C23 | H5 | 121.0° | 120.0° |
| C22 | C09 | C10 | N04 | 156.5° | 59.7° |
| C09 | C22 | C23 | N08 | 78.5° | 95.0° |
| C22 | C09 | C10 | O05 | 23.5° | 120.0° |
| C09 | C22 | H4 | H5 | 116.9° | 120.0° |
| C22 | C09 | N03 | H19 | 120.9° | 94.9° |
| C10 | C09 | C22 | C23 | 53.8° | 175.0° |
| C09 | C10 | N04 | O05 | 180.0° | 179.7° |
| C09 | C10 | N04 | C11 | 179.0° | 179.7° |
| C10 | C09 | C22 | H4 | 174.8° | 65.0° |
| C10 | C09 | C22 | H5 | 67.2° | 55.0° |
| C10 | C09 | N03 | H19 | 114.5° | 25.1° |
| C09 | C10 | N04 | H21 | 1.0° | 0.3° |
| N06 | C15 | C16 | N05 | 0.2° | 0.3° |
| N06 | C15 | C16 | H1 | 180.0° | 179.7° |
| N06 | C15 | C16 | C12 | 179.7° | 179.8° |
| N05 | C16 | C15 | C12 | 179.5° | 179.9° |
| N05 | C16 | C12 | C11 | 79.1° | 94.9° |
| N05 | C16 | C12 | O09 | 154.5° | 145.0° |
| N05 | C16 | C15 | H1 | 179.8° | 180.0° |
| N05 | C16 | C12 | H23 | 37.2° | 25.1° |
| N09 | C24 | N08 | C23 | 0.6° | 0.3° |
| N09 | C24 | N08 | N | 179.9° | 179.8° |
| N09 | C24 | N08 | H34 | 179.4° | 179.8° |
| C24 | N09 | C | H35 | 179.1° | 180.0° |
| N09 | C24 | N | H37 | 0.0° | 179.7° |
| N09 | C24 | N | H38 | 120.0° | 0.3° |
| C22 | C23 | N08 | C24 | 179.0° | 180.0° |
| C23 | C22 | H4 | H5 | 116.8° | 120.0° |
| C23 | C22 | C09 | H20 | 67.1° | 55.0° |
| C22 | C23 | N08 | H34 | 1.0° | 0.0° |
| C22 | C23 | C | H35 | 0.9° | 0.3° |
| C10 | N04 | C11 | H21 | 180.0° | 180.0° |
| C10 | N04 | C11 | C17 | 125.3° | 85.0° |
| C10 | N04 | C11 | C12 | 106.5° | 155.0° |
| N04 | C10 | C09 | H20 | 36.1° | 60.3° |
| C10 | N04 | C11 | H22 | 11.7° | 34.9° |
| C11 | N04 | C10 | O05 | 1.0° | 0.1° |
| N04 | C11 | C17 | O03 | 162.9° | 179.9° |
| N04 | C11 | C17 | C12 | 132.4° | 120.0° |
| N04 | C11 | C17 | H22 | 113.8° | 120.0° |
| N04 | C11 | C12 | C16 | 72.6° | 55.0° |
| N04 | C11 | C12 | H22 | 118.1° | 120.1° |
| N04 | C11 | C12 | O09 | 163.0° | 65.0° |
| N04 | C11 | C12 | H23 | 43.5° | 175.0° |
| C23 | N08 | C24 | H34 | 180.0° | 180.0° |
| C23 | N08 | C24 | N | 179.5° | 180.0° |
| N08 | C23 | C22 | H4 | 160.5° | 25.0° |
| N08 | C23 | C22 | H5 | 42.5° | 145.0° |
| N08 | C23 | C | H35 | 178.8° | 179.9° |
| O05 | C10 | C09 | H20 | 143.8° | 120.0° |
| O05 | C10 | N04 | H21 | 179.1° | 180.0° |
| C07 | C18 | C19 | H28 | 120.9° | 119.9° |
| C07 | C18 | C19 | H29 | 120.9° | 120.0° |
| C18 | C07 | C08 | H18 | 114.7° | 120.0° |
| C18 | C07 | C08 | O04 | 107.1° | 120.0° |
| C07 | C18 | C19 | C20 | 164.3° | 175.0° |
| C07 | C18 | C19 | O | 38.3° | 65.0° |
| C18 | C07 | N02 | H17 | 15.2° | 95.0° |
| C07 | C18 | H28 | H29 | 117.2° | 120.0° |
| C07 | C18 | C19 | H30 | 78.4° | 55.0° |
| C19 | C18 | C07 | C08 | 149.9° | 175.0° |
| C18 | C19 | C20 | O | 125.3° | 120.0° |
| C18 | C19 | C20 | H30 | 117.3° | 120.1° |
| C18 | C19 | O | H30 | 115.4° | 120.0° |
| C18 | C19 | C20 | O07 | 39.7° | 175.0° |
| C18 | C19 | C20 | H2 | 160.4° | 55.0° |
| C18 | C19 | C20 | H3 | 81.0° | 64.9° |
| C19 | C18 | C07 | H18 | 35.2° | 55.0° |
| C19 | C18 | H28 | H29 | 117.3° | 120.0° |
| C18 | C19 | O | H33 | 180.0° | 60.0° |
| O03 | C17 | C11 | C12 | 30.5° | 60.0° |
| O03 | C17 | C11 | H22 | 83.2° | 60.1° |
| C17 | C11 | C12 | C16 | 55.8° | 175.0° |
| C17 | C11 | C12 | H22 | 113.5° | 120.0° |
| C17 | C11 | C12 | O09 | 68.6° | 55.0° |
| C17 | C11 | N04 | H21 | 54.6° | 95.0° |
| C17 | C11 | C12 | H23 | 171.9° | 65.1° |
| C11 | C17 | O03 | H27 | 179.9° | 180.0° |
| C08 | C07 | N02 | H17 | 114.0° | 25.0° |
| C07 | C08 | N03 | H19 | 0.1° | 0.1° |
| C08 | C07 | C18 | H28 | 89.2° | 65.0° |
| C08 | C07 | C18 | H29 | 29.0° | 55.0° |
| O04 | C08 | C07 | H18 | 7.5° | 120.0° |
| O04 | C08 | N03 | H19 | 179.4° | 179.9° |
| C15 | C16 | C12 | C11 | 101.6° | 84.9° |
| C15 | C16 | C12 | O09 | 24.8° | 35.1° |
| C15 | C16 | C12 | H23 | 142.1° | 155.1° |
| C15 | C16 | N05 | H25 | 179.7° | 180.0° |
| C16 | C12 | C11 | O09 | 124.4° | 120.0° |
| C16 | C12 | C11 | H23 | 116.1° | 119.9° |
| C16 | C12 | O09 | H23 | 116.1° | 119.9° |
| C12 | C16 | C15 | H1 | 0.3° | 0.1° |
| C16 | C12 | C11 | H22 | 169.3° | 65.0° |
| C16 | C12 | O09 | H24 | 180.0° | 60.0° |
| C12 | C16 | N05 | H25 | 0.2° | 0.1° |
| N08 | C24 | N | H37 | 179.9° | 0.1° |
| N08 | C24 | N | H38 | 59.9° | 180.0° |
| N | C24 | N08 | H34 | 0.6° | 0.0° |
| C24 | N | H37 | H38 | 120.0° | 179.9° |
| C20 | C19 | O | H30 | 116.1° | 119.9° |
| C19 | C20 | O07 | H2 | 120.7° | 120.0° |
| C19 | C20 | O07 | H3 | 120.7° | 120.0° |
| C19 | C20 | O07 | C21 | 164.1° | 180.0° |
| C19 | C20 | H2 | H3 | 117.7° | 120.0° |
| C20 | C19 | C18 | H28 | 74.8° | 55.0° |
| C20 | C19 | C18 | H29 | 43.4° | 65.0° |
| C20 | C19 | O | H33 | 51.5° | 60.0° |
| O | C19 | C20 | O07 | 85.6° | 65.0° |
| O | C19 | C20 | H2 | 35.1° | 175.0° |
| O | C19 | C20 | H3 | 153.7° | 55.1° |
| O | C19 | C18 | H28 | 159.2° | 175.0° |
| O | C19 | C18 | H29 | 82.6° | 55.0° |
| C11 | C12 | O09 | H23 | 118.7° | 120.1° |
| C12 | C11 | N04 | H21 | 73.6° | 24.9° |
| C11 | C12 | O09 | H24 | 54.8° | 60.0° |
| C20 | O07 | C21 | O08 | 116.0° | 0.0° |
| C20 | O07 | C21 | N07 | 80.3° | 180.0° |
| O07 | C20 | H2 | H3 | 117.7° | 120.0° |
| O07 | C20 | C19 | H30 | 157.0° | 55.0° |
| O09 | C12 | C11 | H22 | 44.8° | 175.0° |
| O07 | C21 | O08 | N07 | 163.9° | 180.0° |
| C21 | O07 | C20 | H2 | 43.4° | 60.0° |
| C21 | O07 | C20 | H3 | 75.2° | 60.0° |
| O07 | C21 | N07 | H31 | 163.9° | 0.0° |
| O07 | C21 | N07 | H32 | 16.1° | 180.0° |
| O08 | C21 | N07 | H31 | 0.0° | 180.0° |
| O08 | C21 | N07 | H32 | 180.0° | 0.0° |
| C21 | N07 | H31 | H32 | 180.0° | 180.0° |
| H2 | C20 | C19 | H30 | 82.3° | 65.1° |
| H3 | C20 | C19 | H30 | 36.3° | 175.0° |
| H4 | C22 | C09 | H20 | 53.9° | 175.0° |
| H5 | C22 | C09 | H20 | 171.8° | 64.9° |
| H6 | C01 | C02 | H8 | 97.3° | 177.8° |
| H6 | C01 | C02 | H9 | 21.8° | 57.7° |
| H6 | C01 | C05 | H15 | 22.9° | 177.8° |
| H7 | C01 | C02 | H8 | 20.7° | 57.7° |
| H7 | C01 | C02 | H9 | 139.7° | 62.3° |
| H7 | C01 | C05 | H15 | 95.1° | 57.6° |
| H8 | C02 | C03 | H10 | 59.1° | 59.2° |
| H8 | C02 | C03 | H11 | 60.4° | 179.3° |
| H9 | C02 | C03 | H10 | 178.2° | 60.9° |
| H9 | C02 | C03 | H11 | 58.7° | 59.2° |
| H10 | C03 | N01 | H12 | 168.7° | 57.7° |
| H11 | C03 | N01 | H12 | 49.2° | 177.7° |
| H12 | N01 | C04 | H14 | 127.2° | 177.6° |
| H14 | C04 | C05 | H15 | 89.1° | 179.2° |
| H15 | C05 | O01 | H16 | 62.0° | 60.0° |
| H17 | N02 | C07 | H18 | 131.5° | 145.0° |
| H18 | C07 | C18 | H28 | 156.1° | 175.0° |
| H18 | C07 | C18 | H29 | 85.7° | 65.0° |
| H19 | N03 | C09 | H20 | 2.8° | 145.0° |
| H21 | N04 | C11 | H22 | 168.3° | 145.0° |
| H22 | C11 | C12 | H23 | 74.7° | 54.9° |
| H23 | C12 | O09 | H24 | 63.9° | 180.0° |
| H28 | C18 | C19 | H30 | 42.5° | 65.0° |
| H29 | C18 | C19 | H30 | 160.7° | 175.0° |
| H30 | C19 | O | H33 | 64.6° | 180.0° |
