EW9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C06 | C04 | sing | 1.53Å | 1.54Å | |
| C04 | C05 | sing | 1.53Å | 1.53Å | |
| C04 | O03 | sing | 1.45Å | 1.46Å | |
| C04 | C07 | sing | 1.53Å | 1.57Å | |
| O03 | C02 | sing | 1.35Å | 1.39Å | |
| C14 | C13 | sing | 1.53Å | 1.54Å | |
| C14 | N08 | sing | 1.47Å | 1.48Å | |
| C02 | N08 | sing | 1.35Å | 1.44Å | |
| C02 | O01 | doub | 1.22Å | 1.23Å | |
| C13 | C11 | sing | 1.53Å | 1.50Å | |
| N08 | C09 | sing | 1.47Å | 1.52Å | |
| O32 | C28 | doub | 1.21Å | 1.25Å | |
| C11 | C15 | sing | 1.53Å | 1.54Å | |
| C11 | C12 | sing | 1.53Å | 1.58Å | |
| C11 | C10 | sing | 1.53Å | 1.53Å | |
| C28 | N29 | sing | 1.34Å | 1.35Å | |
| C28 | C27 | sing | 1.51Å | 1.53Å | |
| N29 | C30 | sing | 1.47Å | 1.49Å | |
| C09 | C10 | sing | 1.53Å | 1.54Å | |
| C15 | C16 | sing | 1.54Å | 1.60Å | |
| C12 | C16 | sing | 1.54Å | 1.54Å | |
| O38 | C18 | doub | 1.22Å | 1.23Å | |
| O17 | C16 | sing | 1.45Å | 1.40Å | |
| O17 | C18 | sing | 1.35Å | 1.39Å | |
| C27 | C26 | sing | 1.53Å | 1.49Å | |
| C27 | C31 | sing | 1.55Å | 1.57Å | |
| C18 | N19 | sing | 1.35Å | 1.34Å | |
| C30 | C31 | sing | 1.54Å | 1.54Å | |
| C36 | C35 | sing | 1.53Å | 1.50Å | |
| C26 | C23 | sing | 1.53Å | 1.59Å | |
| N19 | C20 | sing | 1.46Å | 1.48Å | |
| SG | C24 | sing | 1.81Å | 1.80Å | |
| C20 | C21 | sing | 1.51Å | 1.53Å | |
| C20 | C34 | sing | 1.53Å | 1.51Å | |
| N22 | C23 | sing | 1.47Å | 1.44Å | |
| N22 | C21 | sing | 1.35Å | 1.37Å | |
| C23 | C24 | sing | 1.53Å | 1.51Å | |
| C21 | O33 | doub | 1.21Å | 1.25Å | |
| C35 | C34 | sing | 1.53Å | 1.51Å | |
| C35 | C37 | sing | 1.53Å | 1.56Å | |
| C24 | O25 | sing | 1.43Å | 1.41Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C16 | H3 | sing | 1.09Å | 1.10Å | |
| C20 | H4 | sing | 1.09Å | 1.10Å | |
| C23 | H5 | sing | 1.09Å | 1.10Å | |
| C24 | H6 | sing | 1.09Å | 1.10Å | |
| O25 | H7 | sing | 0.97Å | 0.95Å | |
| C26 | H8 | sing | 1.09Å | 1.10Å | |
| C26 | H9 | sing | 1.09Å | 1.10Å | |
| C05 | H10 | sing | 1.09Å | 1.10Å | |
| C05 | H11 | sing | 1.09Å | 1.10Å | |
| C05 | H12 | sing | 1.09Å | 1.10Å | |
| C06 | H13 | sing | 1.09Å | 1.10Å | |
| C06 | H14 | sing | 1.09Å | 1.10Å | |
| C06 | H15 | sing | 1.09Å | 1.10Å | |
| C07 | H16 | sing | 1.09Å | 1.10Å | |
| C07 | H17 | sing | 1.09Å | 1.10Å | |
| C07 | H18 | sing | 1.09Å | 1.10Å | |
| C09 | H19 | sing | 1.09Å | 1.10Å | |
| C09 | H20 | sing | 1.09Å | 1.10Å | |
| C12 | H21 | sing | 1.09Å | 1.10Å | |
| C12 | H22 | sing | 1.09Å | 1.10Å | |
| C13 | H23 | sing | 1.09Å | 1.10Å | |
| C13 | H24 | sing | 1.09Å | 1.10Å | |
| C14 | H25 | sing | 1.09Å | 1.10Å | |
| C14 | H26 | sing | 1.09Å | 1.10Å | |
| C15 | H27 | sing | 1.09Å | 1.10Å | |
| C15 | H28 | sing | 1.09Å | 1.10Å | |
| C27 | H29 | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H32 | sing | 1.09Å | 1.10Å | |
| C31 | H33 | sing | 1.09Å | 1.10Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| C34 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H36 | sing | 1.09Å | 1.10Å | |
| C36 | H37 | sing | 1.09Å | 1.10Å | |
| C36 | H38 | sing | 1.09Å | 1.10Å | |
| C36 | H39 | sing | 1.09Å | 1.10Å | |
| C37 | H40 | sing | 1.09Å | 1.10Å | |
| C37 | H41 | sing | 1.09Å | 1.10Å | |
| C37 | H42 | sing | 1.09Å | 1.10Å | |
| N19 | H43 | sing | 0.97Å | 1.00Å | |
| N22 | H44 | sing | 0.97Å | 1.00Å | |
| N29 | H45 | sing | 0.97Å | 1.00Å | |
| SG | O2 | sing | 1.52Å | 33.62Å | |
| SG | O3 | doub | 1.42Å | 33.62Å | |
| SG | O1 | doub | 1.42Å | 1.79Å | |
| O2 | H46 | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C06 | C04 | C05 | 111.3° | 109.4° |
| C06 | C04 | O03 | 106.1° | 109.5° |
| C06 | C04 | C07 | 108.5° | 109.5° |
| C04 | C06 | H13 | 109.5° | 109.5° |
| C04 | C06 | H14 | 109.5° | 109.4° |
| C04 | C06 | H15 | 109.5° | 109.4° |
| C05 | C04 | O03 | 111.5° | 109.5° |
| C05 | C04 | C07 | 107.9° | 109.4° |
| C04 | C05 | H10 | 109.5° | 109.5° |
| C04 | C05 | H11 | 109.5° | 109.5° |
| C04 | C05 | H12 | 109.5° | 109.5° |
| O03 | C04 | C07 | 111.5° | 109.5° |
| C04 | O03 | C02 | 123.5° | 117.0° |
| C04 | C07 | H16 | 109.5° | 109.5° |
| C04 | C07 | H17 | 109.5° | 109.4° |
| C04 | C07 | H18 | 109.4° | 109.5° |
| O03 | C02 | N08 | 120.3° | 120.0° |
| O03 | C02 | O01 | 119.6° | 120.0° |
| C13 | C14 | N08 | 115.3° | 108.8° |
| C14 | C13 | C11 | 114.7° | 109.1° |
| C14 | C13 | H23 | 108.1° | 109.5° |
| C14 | C13 | H24 | 108.1° | 109.6° |
| C13 | C14 | H25 | 108.0° | 109.6° |
| C13 | C14 | H26 | 108.0° | 109.6° |
| C14 | N08 | C02 | 117.5° | 120.5° |
| C14 | N08 | C09 | 111.2° | 119.0° |
| N08 | C14 | H25 | 108.0° | 109.6° |
| N08 | C14 | H26 | 108.0° | 109.5° |
| N08 | C02 | O01 | 120.1° | 120.0° |
| C02 | N08 | C09 | 119.2° | 120.5° |
| C13 | C11 | C15 | 123.4° | 113.5° |
| C13 | C11 | C12 | 112.3° | 113.5° |
| C13 | C11 | C10 | 108.0° | 113.0° |
| C11 | C13 | H23 | 108.2° | 109.5° |
| C11 | C13 | H24 | 108.1° | 109.5° |
| N08 | C09 | C10 | 117.3° | 108.7° |
| N08 | C09 | H19 | 107.5° | 109.6° |
| N08 | C09 | H20 | 107.5° | 109.7° |
| O32 | C28 | N29 | 124.7° | 124.9° |
| O32 | C28 | C27 | 121.3° | 125.0° |
| C15 | C11 | C12 | 87.5° | 87.5° |
| C15 | C11 | C10 | 111.1° | 113.5° |
| C11 | C15 | C16 | 91.2° | 86.9° |
| C11 | C15 | H27 | 113.8° | 113.6° |
| C11 | C15 | H28 | 113.8° | 113.7° |
| C12 | C11 | C10 | 113.4° | 113.6° |
| C11 | C12 | C16 | 91.7° | 87.0° |
| C11 | C12 | H21 | 113.7° | 113.6° |
| C11 | C12 | H22 | 113.7° | 113.6° |
| C11 | C10 | C09 | 116.2° | 109.2° |
| C11 | C10 | H1 | 107.7° | 109.6° |
| C11 | C10 | H2 | 107.7° | 109.5° |
| N29 | C28 | C27 | 114.1° | 110.1° |
| C28 | N29 | C30 | 110.1° | 111.3° |
| C28 | N29 | H45 | 124.9° | 124.3° |
| C28 | C27 | C26 | 114.3° | 110.5° |
| C28 | C27 | C31 | 100.2° | 104.2° |
| C28 | C27 | H29 | 110.3° | 110.6° |
| N29 | C30 | C31 | 104.4° | 105.5° |
| N29 | C30 | H30 | 110.8° | 110.2° |
| N29 | C30 | H31 | 110.7° | 110.3° |
| C30 | N29 | H45 | 124.9° | 124.4° |
| C09 | C10 | H1 | 107.8° | 109.5° |
| C09 | C10 | H2 | 107.8° | 109.5° |
| C10 | C09 | H19 | 107.5° | 109.6° |
| C10 | C09 | H20 | 107.5° | 109.6° |
| C15 | C16 | C12 | 86.7° | 87.1° |
| C15 | C16 | O17 | 112.8° | 113.7° |
| C15 | C16 | H3 | 110.1° | 113.6° |
| C16 | C15 | H27 | 113.8° | 113.6° |
| C16 | C15 | H28 | 113.8° | 113.6° |
| C12 | C16 | O17 | 120.0° | 113.7° |
| C12 | C16 | H3 | 111.0° | 113.7° |
| C16 | C12 | H21 | 113.7° | 113.6° |
| C16 | C12 | H22 | 113.7° | 113.6° |
| O38 | C18 | O17 | 118.2° | 120.0° |
| O38 | C18 | N19 | 120.2° | 120.0° |
| C16 | O17 | C18 | 121.9° | 117.1° |
| O17 | C16 | H3 | 113.2° | 112.8° |
| O17 | C18 | N19 | 121.6° | 120.0° |
| C26 | C27 | C31 | 110.7° | 110.5° |
| C27 | C26 | C23 | 112.9° | 109.5° |
| C27 | C26 | H8 | 108.6° | 109.5° |
| C27 | C26 | H9 | 108.6° | 109.4° |
| C26 | C27 | H29 | 110.9° | 110.4° |
| C27 | C31 | C30 | 106.3° | 101.8° |
| C31 | C27 | H29 | 109.8° | 110.5° |
| C27 | C31 | H32 | 110.2° | 111.0° |
| C27 | C31 | H33 | 110.2° | 111.0° |
| C18 | N19 | C20 | 123.1° | 120.0° |
| C18 | N19 | H43 | 118.5° | 120.0° |
| C31 | C30 | H30 | 110.7° | 110.3° |
| C31 | C30 | H31 | 110.7° | 110.3° |
| C30 | C31 | H32 | 110.3° | 111.0° |
| C30 | C31 | H33 | 110.3° | 111.0° |
| C36 | C35 | C34 | 111.7° | 109.5° |
| C36 | C35 | C37 | 109.9° | 109.5° |
| C36 | C35 | H36 | 108.1° | 109.5° |
| C35 | C36 | H37 | 109.5° | 109.5° |
| C35 | C36 | H38 | 109.4° | 109.5° |
| C35 | C36 | H39 | 109.5° | 109.5° |
| C26 | C23 | N22 | 109.5° | 109.5° |
| C26 | C23 | C24 | 111.2° | 109.5° |
| C26 | C23 | H5 | 107.4° | 109.4° |
| C23 | C26 | H8 | 108.6° | 109.5° |
| C23 | C26 | H9 | 108.6° | 109.5° |
| N19 | C20 | C21 | 109.1° | 109.5° |
| N19 | C20 | C34 | 114.0° | 109.5° |
| N19 | C20 | H4 | 108.6° | 109.5° |
| C20 | N19 | H43 | 118.4° | 120.0° |
| SG | C24 | C23 | 110.2° | 109.5° |
| SG | C24 | O25 | 111.5° | 109.5° |
| SG | C24 | H6 | 106.3° | 109.4° |
| C24 | SG | O2 | 134.8° | 104.4° |
| C24 | SG | O3 | 134.8° | 110.5° |
| C24 | SG | O1 | 102.3° | 110.5° |
| C21 | C20 | C34 | 108.6° | 109.4° |
| C20 | C21 | N22 | 122.5° | 120.0° |
| C20 | C21 | O33 | 116.9° | 120.0° |
| C21 | C20 | H4 | 108.0° | 109.5° |
| C20 | C34 | C35 | 114.6° | 109.5° |
| C34 | C20 | H4 | 108.3° | 109.4° |
| C20 | C34 | H34 | 108.2° | 109.5° |
| C20 | C34 | H35 | 108.2° | 109.5° |
| C23 | N22 | C21 | 123.0° | 120.0° |
| N22 | C23 | C24 | 110.8° | 109.5° |
| N22 | C23 | H5 | 109.4° | 109.5° |
| C23 | N22 | H44 | 118.5° | 120.0° |
| N22 | C21 | O33 | 120.6° | 120.0° |
| C21 | N22 | H44 | 118.6° | 120.0° |
| C23 | C24 | O25 | 108.1° | 109.5° |
| C24 | C23 | H5 | 108.4° | 109.5° |
| C23 | C24 | H6 | 109.6° | 109.5° |
| C34 | C35 | C37 | 111.6° | 109.5° |
| C35 | C34 | H34 | 108.2° | 109.5° |
| C35 | C34 | H35 | 108.2° | 109.5° |
| C34 | C35 | H36 | 107.9° | 109.5° |
| C37 | C35 | H36 | 107.4° | 109.5° |
| C35 | C37 | H40 | 109.5° | 109.5° |
| C35 | C37 | H41 | 109.5° | 109.5° |
| C35 | C37 | H42 | 109.5° | 109.5° |
| O25 | C24 | H6 | 111.1° | 109.5° |
| C24 | O25 | H7 | 109.5° | 114.0° |
| H1 | C10 | H2 | 109.5° | 109.6° |
| H8 | C26 | H9 | 109.5° | 109.5° |
| H10 | C05 | H11 | 109.4° | 109.5° |
| H10 | C05 | H12 | 109.5° | 109.5° |
| H11 | C05 | H12 | 109.5° | 109.5° |
| H13 | C06 | H14 | 109.5° | 109.5° |
| H13 | C06 | H15 | 109.5° | 109.5° |
| H14 | C06 | H15 | 109.4° | 109.5° |
| H16 | C07 | H17 | 109.5° | 109.5° |
| H16 | C07 | H18 | 109.5° | 109.5° |
| H17 | C07 | H18 | 109.5° | 109.4° |
| H19 | C09 | H20 | 109.5° | 109.6° |
| H21 | C12 | H22 | 109.5° | 112.9° |
| H23 | C13 | H24 | 109.5° | 109.6° |
| H25 | C14 | H26 | 109.4° | 109.7° |
| H27 | C15 | H28 | 109.5° | 112.9° |
| H30 | C30 | H31 | 109.4° | 110.2° |
| H32 | C31 | H33 | 109.5° | 110.8° |
| H34 | C34 | H35 | 109.5° | 109.5° |
| H37 | C36 | H38 | 109.5° | 109.5° |
| H37 | C36 | H39 | 109.5° | 109.5° |
| H38 | C36 | H39 | 109.5° | 109.4° |
| H40 | C37 | H41 | 109.5° | 109.5° |
| H40 | C37 | H42 | 109.5° | 109.5° |
| H41 | C37 | H42 | 109.4° | 109.4° |
| O2 | SG | O3 | 0.0° | 104.2° |
| O2 | SG | O1 | 83.8° | 104.3° |
| SG | O2 | H46 | 90.0° | 114.0° |
| O3 | SG | O1 | 83.8° | 121.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C06 | C04 | C05 | O03 | 118.3° | 120.0° |
| C06 | C04 | C05 | C07 | 119.0° | 120.0° |
| C06 | C04 | O03 | C07 | 118.0° | 120.0° |
| C06 | C04 | O03 | C02 | 178.2° | 60.0° |
| C06 | C04 | C05 | H10 | 180.0° | 180.0° |
| C06 | C04 | C05 | H11 | 60.0° | 60.0° |
| C06 | C04 | C05 | H12 | 60.0° | 60.1° |
| C04 | C06 | H13 | H14 | 120.0° | 120.0° |
| C04 | C06 | H13 | H15 | 120.0° | 120.0° |
| C04 | C06 | H14 | H15 | 120.0° | 119.9° |
| C06 | C04 | C07 | H16 | 180.0° | 180.0° |
| C06 | C04 | C07 | H17 | 60.0° | 60.0° |
| C06 | C04 | C07 | H18 | 60.0° | 59.9° |
| C05 | C04 | O03 | C07 | 120.7° | 120.0° |
| C05 | C04 | O03 | C02 | 56.8° | 60.0° |
| C04 | C05 | H10 | H11 | 120.0° | 120.0° |
| C04 | C05 | H10 | H12 | 120.0° | 120.0° |
| C04 | C05 | H11 | H12 | 120.0° | 120.0° |
| C05 | C04 | C06 | H13 | 180.0° | 60.0° |
| C05 | C04 | C06 | H14 | 60.0° | 180.0° |
| C05 | C04 | C06 | H15 | 60.0° | 60.1° |
| C05 | C04 | C07 | H16 | 59.2° | 60.0° |
| C05 | C04 | C07 | H17 | 60.8° | 179.9° |
| C05 | C04 | C07 | H18 | 179.3° | 60.1° |
| C04 | O03 | C02 | N08 | 166.5° | 180.0° |
| C04 | O03 | C02 | O01 | 14.3° | 0.1° |
| O03 | C04 | C05 | H10 | 61.8° | 60.0° |
| O03 | C04 | C05 | H11 | 58.2° | 180.0° |
| O03 | C04 | C05 | H12 | 178.2° | 60.0° |
| O03 | C04 | C06 | H13 | 58.6° | 180.0° |
| O03 | C04 | C06 | H14 | 178.6° | 60.0° |
| O03 | C04 | C06 | H15 | 61.5° | 60.0° |
| O03 | C04 | C07 | H16 | 63.5° | 60.0° |
| O03 | C04 | C07 | H17 | 176.5° | 60.1° |
| O03 | C04 | C07 | H18 | 56.5° | 179.9° |
| C07 | C04 | O03 | C02 | 63.9° | 179.9° |
| C07 | C04 | C05 | H10 | 61.0° | 60.0° |
| C07 | C04 | C05 | H11 | 179.0° | 60.0° |
| C07 | C04 | C05 | H12 | 59.0° | 180.0° |
| C07 | C04 | C06 | H13 | 61.4° | 60.0° |
| C07 | C04 | C06 | H14 | 58.6° | 60.1° |
| C07 | C04 | C06 | H15 | 178.6° | 180.0° |
| C04 | C07 | H16 | H17 | 120.0° | 120.0° |
| C04 | C07 | H16 | H18 | 120.0° | 120.0° |
| C04 | C07 | H17 | H18 | 120.0° | 119.9° |
| O03 | C02 | N08 | C14 | 18.4° | 180.0° |
| O03 | C02 | N08 | O01 | 179.2° | 179.9° |
| O03 | C02 | N08 | C09 | 157.6° | 0.0° |
| C13 | C14 | N08 | H25 | 120.8° | 119.8° |
| C13 | C14 | N08 | H26 | 120.9° | 119.8° |
| C13 | C14 | N08 | C02 | 97.1° | 124.5° |
| C14 | C13 | C11 | H23 | 120.8° | 119.9° |
| C14 | C13 | C11 | H24 | 120.7° | 119.9° |
| C13 | C14 | N08 | C09 | 45.2° | 55.5° |
| C14 | C13 | C11 | C15 | 78.9° | 171.3° |
| C14 | C13 | C11 | C12 | 178.8° | 73.5° |
| C14 | C13 | C11 | C10 | 53.0° | 57.7° |
| C14 | C13 | H23 | H24 | 117.6° | 120.2° |
| C13 | C14 | H25 | H26 | 117.4° | 120.4° |
| C14 | N08 | C02 | C09 | 139.3° | 180.0° |
| C14 | N08 | C02 | O01 | 160.8° | 0.0° |
| N08 | C14 | C13 | C11 | 56.0° | 52.5° |
| C14 | N08 | C09 | C10 | 39.0° | 55.5° |
| C14 | N08 | C09 | H19 | 82.1° | 64.3° |
| C14 | N08 | C09 | H20 | 160.1° | 175.3° |
| N08 | C14 | C13 | H23 | 64.8° | 67.4° |
| N08 | C14 | C13 | H24 | 176.7° | 172.4° |
| N08 | C14 | H25 | H26 | 117.3° | 120.3° |
| C02 | N08 | C09 | C10 | 102.6° | 124.5° |
| C02 | N08 | C09 | H19 | 136.3° | 115.7° |
| C02 | N08 | C09 | H20 | 18.5° | 4.7° |
| C02 | N08 | C14 | H25 | 142.1° | 4.7° |
| C02 | N08 | C14 | H26 | 23.8° | 115.7° |
| O01 | C02 | N08 | C09 | 21.6° | 180.0° |
| C13 | C11 | C15 | C12 | 115.2° | 114.6° |
| C13 | C11 | C15 | C10 | 130.7° | 130.7° |
| C13 | C11 | C12 | C10 | 122.8° | 130.9° |
| C13 | C11 | C10 | C09 | 46.4° | 57.8° |
| C13 | C11 | C15 | C16 | 128.1° | 89.4° |
| C13 | C11 | C12 | C16 | 138.7° | 89.3° |
| C13 | C11 | C10 | H1 | 74.6° | 62.2° |
| C13 | C11 | C10 | H2 | 167.4° | 177.6° |
| C13 | C11 | C12 | H21 | 104.5° | 25.2° |
| C13 | C11 | C12 | H22 | 21.8° | 156.2° |
| C11 | C13 | H23 | H24 | 117.6° | 120.1° |
| C11 | C13 | C14 | H25 | 64.8° | 172.3° |
| C11 | C13 | C14 | H26 | 176.9° | 67.2° |
| C13 | C11 | C15 | H27 | 11.3° | 156.1° |
| C13 | C11 | C15 | H28 | 115.1° | 25.1° |
| N08 | C09 | C10 | C11 | 41.7° | 52.6° |
| N08 | C09 | C10 | H19 | 121.1° | 119.8° |
| N08 | C09 | C10 | H20 | 121.1° | 119.9° |
| N08 | C09 | C10 | H1 | 79.2° | 67.4° |
| N08 | C09 | C10 | H2 | 162.7° | 172.5° |
| N08 | C09 | H19 | H20 | 116.5° | 120.4° |
| C09 | N08 | C14 | H25 | 75.6° | 175.3° |
| C09 | N08 | C14 | H26 | 166.1° | 64.3° |
| O32 | C28 | N29 | C27 | 178.7° | 180.0° |
| O32 | C28 | N29 | C30 | 180.0° | 179.6° |
| O32 | C28 | C27 | C26 | 48.0° | 45.1° |
| O32 | C28 | C27 | C31 | 166.5° | 163.8° |
| O32 | C28 | C27 | H29 | 77.8° | 77.5° |
| O32 | C28 | N29 | H45 | 0.0° | 0.4° |
| C15 | C11 | C12 | C10 | 111.9° | 114.6° |
| C15 | C11 | C10 | C09 | 91.9° | 171.3° |
| C11 | C15 | C16 | H27 | 116.8° | 114.5° |
| C11 | C15 | C16 | H28 | 116.8° | 114.5° |
| C15 | C11 | C12 | C16 | 13.4° | 25.3° |
| C11 | C15 | C16 | O17 | 134.5° | 89.5° |
| C15 | C11 | C10 | H1 | 147.2° | 68.8° |
| C15 | C11 | C10 | H2 | 29.1° | 51.4° |
| C11 | C15 | C16 | H3 | 97.9° | 139.8° |
| C15 | C11 | C12 | H21 | 130.3° | 139.7° |
| C15 | C11 | C12 | H22 | 103.5° | 89.3° |
| C15 | C11 | C13 | H23 | 160.3° | 68.8° |
| C15 | C11 | C13 | H24 | 41.8° | 51.4° |
| C11 | C15 | H27 | H28 | 128.6° | 131.4° |
| C12 | C11 | C10 | C09 | 171.5° | 73.4° |
| C11 | C12 | C16 | H21 | 116.9° | 114.5° |
| C11 | C12 | C16 | H22 | 116.9° | 114.5° |
| C11 | C12 | C16 | O17 | 127.4° | 89.5° |
| C12 | C11 | C10 | H1 | 50.6° | 166.6° |
| C12 | C11 | C10 | H2 | 67.5° | 46.5° |
| C11 | C12 | C16 | H3 | 97.5° | 139.7° |
| C11 | C12 | H21 | H22 | 128.4° | 131.3° |
| C12 | C11 | C13 | H23 | 58.0° | 166.6° |
| C12 | C11 | C13 | H24 | 60.5° | 46.5° |
| C12 | C11 | C15 | H27 | 103.9° | 89.3° |
| C12 | C11 | C15 | H28 | 129.7° | 139.7° |
| C11 | C10 | C09 | H1 | 121.0° | 120.0° |
| C11 | C10 | C09 | H2 | 121.0° | 119.9° |
| C10 | C11 | C15 | C16 | 101.2° | 139.9° |
| C10 | C11 | C12 | C16 | 98.5° | 139.8° |
| C11 | C10 | H1 | H2 | 116.9° | 120.1° |
| C11 | C10 | C09 | H19 | 79.4° | 67.2° |
| C11 | C10 | C09 | H20 | 162.9° | 172.5° |
| C10 | C11 | C12 | H21 | 18.3° | 105.7° |
| C10 | C11 | C12 | H22 | 144.6° | 25.3° |
| C10 | C11 | C13 | H23 | 67.8° | 62.2° |
| C10 | C11 | C13 | H24 | 173.8° | 177.6° |
| C10 | C11 | C15 | H27 | 142.0° | 25.4° |
| C10 | C11 | C15 | H28 | 15.6° | 105.6° |
| C28 | N29 | C30 | H45 | 180.0° | 180.0° |
| N29 | C28 | C27 | C26 | 130.7° | 134.9° |
| N29 | C28 | C27 | C31 | 12.3° | 16.3° |
| C28 | N29 | C30 | C31 | 14.7° | 17.0° |
| N29 | C28 | C27 | H29 | 103.4° | 102.5° |
| C28 | N29 | C30 | H30 | 104.5° | 136.1° |
| C28 | N29 | C30 | H31 | 133.9° | 102.0° |
| C27 | C28 | N29 | C30 | 1.2° | 0.4° |
| C28 | C27 | C26 | C31 | 112.2° | 114.8° |
| C28 | C27 | C26 | H29 | 125.5° | 122.7° |
| C28 | C27 | C31 | H29 | 116.1° | 118.8° |
| C28 | C27 | C31 | C30 | 20.4° | 24.8° |
| C28 | C27 | C26 | C23 | 178.1° | 179.6° |
| C28 | C27 | C26 | H8 | 61.4° | 59.6° |
| C28 | C27 | C26 | H9 | 57.6° | 60.3° |
| C28 | C27 | C31 | H32 | 99.1° | 93.3° |
| C28 | C27 | C31 | H33 | 139.9° | 143.0° |
| C27 | C28 | N29 | H45 | 178.8° | 179.6° |
| N29 | C30 | C31 | C27 | 21.9° | 25.4° |
| N29 | C30 | C31 | H30 | 119.2° | 119.0° |
| N29 | C30 | C31 | H31 | 119.2° | 119.1° |
| N29 | C30 | H30 | H31 | 122.4° | 122.0° |
| N29 | C30 | C31 | H32 | 97.5° | 92.7° |
| N29 | C30 | C31 | H33 | 141.4° | 143.6° |
| C09 | C10 | H1 | H2 | 117.0° | 120.1° |
| C10 | C09 | H19 | H20 | 116.4° | 120.3° |
| C15 | C16 | C12 | O17 | 114.6° | 114.6° |
| C15 | C16 | C12 | H3 | 110.3° | 114.5° |
| C15 | C16 | O17 | H3 | 125.9° | 131.1° |
| C15 | C16 | O17 | C18 | 159.0° | 110.9° |
| C15 | C16 | C12 | H21 | 129.7° | 139.7° |
| C15 | C16 | C12 | H22 | 104.1° | 89.4° |
| C16 | C15 | H27 | H28 | 128.7° | 131.3° |
| C12 | C16 | O17 | H3 | 134.2° | 131.3° |
| C12 | C16 | O17 | C18 | 59.2° | 151.5° |
| C16 | C12 | H21 | H22 | 128.4° | 131.3° |
| C12 | C16 | C15 | H27 | 103.5° | 89.4° |
| C12 | C16 | C15 | H28 | 130.0° | 139.7° |
| O38 | C18 | O17 | C16 | 65.7° | 0.0° |
| O38 | C18 | O17 | N19 | 179.0° | 180.0° |
| O38 | C18 | N19 | C20 | 0.7° | 5.0° |
| O38 | C18 | N19 | H43 | 179.3° | 175.0° |
| C16 | O17 | C18 | N19 | 115.4° | 180.0° |
| O17 | C16 | C12 | H21 | 115.7° | 25.1° |
| O17 | C16 | C12 | H22 | 10.5° | 156.0° |
| O17 | C16 | C15 | H27 | 17.8° | 156.0° |
| O17 | C16 | C15 | H28 | 108.7° | 25.1° |
| O17 | C18 | N19 | C20 | 178.2° | 175.0° |
| C18 | O17 | C16 | H3 | 75.0° | 20.3° |
| O17 | C18 | N19 | H43 | 1.8° | 5.1° |
| C26 | C27 | C31 | H29 | 122.9° | 122.5° |
| C26 | C27 | C31 | C30 | 141.4° | 143.5° |
| C27 | C26 | C23 | H8 | 120.5° | 120.0° |
| C27 | C26 | C23 | H9 | 120.5° | 120.0° |
| C27 | C26 | C23 | N22 | 64.4° | 66.0° |
| C27 | C26 | C23 | C24 | 172.7° | 174.0° |
| C27 | C26 | C23 | H5 | 54.3° | 54.1° |
| C27 | C26 | H8 | H9 | 118.4° | 120.0° |
| C26 | C27 | C31 | H32 | 21.9° | 25.3° |
| C26 | C27 | C31 | H33 | 99.1° | 98.4° |
| C27 | C31 | C30 | H32 | 119.5° | 118.1° |
| C27 | C31 | C30 | H33 | 119.5° | 118.1° |
| C31 | C27 | C26 | C23 | 69.6° | 65.6° |
| C31 | C27 | C26 | H8 | 50.9° | 174.4° |
| C31 | C27 | C26 | H9 | 169.8° | 54.4° |
| C27 | C31 | C30 | H30 | 97.3° | 144.4° |
| C27 | C31 | C30 | H31 | 141.1° | 93.7° |
| C27 | C31 | H32 | H33 | 121.4° | 123.8° |
| C18 | N19 | C20 | H43 | 180.0° | 180.0° |
| C18 | N19 | C20 | C21 | 63.9° | 152.4° |
| C18 | N19 | C20 | C34 | 174.6° | 87.7° |
| C18 | N19 | C20 | H4 | 53.6° | 32.3° |
| C30 | C31 | C27 | H29 | 95.8° | 94.0° |
| C31 | C30 | H30 | H31 | 122.4° | 122.0° |
| C30 | C31 | H32 | H33 | 121.5° | 123.8° |
| C31 | C30 | N29 | H45 | 165.4° | 163.0° |
| C36 | C35 | C34 | C20 | 59.8° | 63.9° |
| C36 | C35 | C34 | C37 | 123.5° | 120.0° |
| C36 | C35 | C34 | H36 | 118.7° | 120.0° |
| C36 | C35 | C37 | H36 | 117.3° | 120.0° |
| C36 | C35 | C34 | H34 | 179.5° | 56.1° |
| C36 | C35 | C34 | H35 | 61.0° | 176.1° |
| C35 | C36 | H37 | H38 | 120.0° | 120.0° |
| C35 | C36 | H37 | H39 | 120.0° | 120.0° |
| C35 | C36 | H38 | H39 | 120.0° | 120.0° |
| C36 | C35 | C37 | H40 | 180.0° | 180.0° |
| C36 | C35 | C37 | H41 | 60.0° | 60.0° |
| C36 | C35 | C37 | H42 | 60.0° | 59.9° |
| C26 | C23 | C24 | SG | 66.0° | 65.0° |
| C26 | C23 | N22 | C24 | 123.0° | 120.0° |
| C26 | C23 | N22 | H5 | 117.5° | 120.0° |
| C26 | C23 | N22 | C21 | 121.1° | 173.6° |
| C26 | C23 | C24 | H5 | 117.9° | 120.0° |
| C26 | C23 | C24 | O25 | 56.0° | 55.0° |
| C26 | C23 | C24 | H6 | 177.3° | 175.0° |
| C23 | C26 | H8 | H9 | 118.4° | 120.0° |
| C23 | C26 | C27 | H29 | 52.6° | 56.9° |
| C26 | C23 | N22 | H44 | 58.9° | 6.3° |
| N19 | C20 | C21 | C34 | 124.8° | 120.0° |
| N19 | C20 | C21 | H4 | 117.9° | 120.1° |
| N19 | C20 | C34 | H4 | 121.1° | 120.0° |
| N19 | C20 | C21 | N22 | 131.0° | 171.4° |
| N19 | C20 | C21 | O33 | 47.8° | 8.5° |
| N19 | C20 | C34 | C35 | 59.3° | 171.5° |
| N19 | C20 | C34 | H34 | 61.5° | 51.5° |
| N19 | C20 | C34 | H35 | 180.0° | 68.5° |
| SG | C24 | C23 | N22 | 56.0° | 55.0° |
| SG | C24 | C23 | O25 | 122.1° | 120.0° |
| SG | C24 | C23 | H6 | 116.7° | 120.0° |
| SG | C24 | O25 | H6 | 118.4° | 119.9° |
| SG | C24 | C23 | H5 | 176.1° | 175.0° |
| SG | C24 | O25 | H7 | 180.0° | 60.0° |
| C24 | SG | O2 | O3 | 90.0° | 116.0° |
| C24 | SG | O2 | O1 | 101.2° | 116.1° |
| C24 | SG | O3 | O1 | 101.2° | 131.5° |
| C24 | SG | O2 | H46 | 90.0° | 180.0° |
| C21 | C20 | C34 | H4 | 117.1° | 120.0° |
| C20 | C21 | N22 | C23 | 179.7° | 177.4° |
| C20 | C21 | N22 | O33 | 178.8° | 179.9° |
| C21 | C20 | C34 | C35 | 178.9° | 68.4° |
| C21 | C20 | C34 | H34 | 60.3° | 171.5° |
| C21 | C20 | C34 | H35 | 58.2° | 51.6° |
| C21 | C20 | N19 | H43 | 116.1° | 27.6° |
| C20 | C21 | N22 | H44 | 0.3° | 2.6° |
| C34 | C20 | C21 | N22 | 104.2° | 68.6° |
| C34 | C20 | C21 | O33 | 77.0° | 111.5° |
| C20 | C34 | C35 | H34 | 120.7° | 120.0° |
| C20 | C34 | C35 | H35 | 120.7° | 120.0° |
| C20 | C34 | C35 | C37 | 176.7° | 176.1° |
| C20 | C34 | H34 | H35 | 117.7° | 120.0° |
| C20 | C34 | C35 | H36 | 58.9° | 56.1° |
| C34 | C20 | N19 | H43 | 5.4° | 92.4° |
| C23 | N22 | C21 | H44 | 180.0° | 180.0° |
| N22 | C23 | C24 | H5 | 120.0° | 120.1° |
| C23 | N22 | C21 | O33 | 0.9° | 2.7° |
| N22 | C23 | C24 | O25 | 178.1° | 175.0° |
| N22 | C23 | C24 | H6 | 60.6° | 65.0° |
| N22 | C23 | C26 | H8 | 175.0° | 54.0° |
| N22 | C23 | C26 | H9 | 56.1° | 174.0° |
| C21 | N22 | C23 | C24 | 115.9° | 66.4° |
| N22 | C21 | C20 | H4 | 13.1° | 51.3° |
| C21 | N22 | C23 | H5 | 3.6° | 53.7° |
| C23 | C24 | O25 | H6 | 120.3° | 120.1° |
| C23 | C24 | O25 | H7 | 58.7° | 60.0° |
| C24 | C23 | C26 | H8 | 52.2° | 65.9° |
| C24 | C23 | C26 | H9 | 66.7° | 54.1° |
| C24 | C23 | N22 | H44 | 64.2° | 113.6° |
| C23 | C24 | SG | O2 | 76.1° | 175.0° |
| C23 | C24 | SG | O3 | 76.1° | 63.4° |
| C23 | C24 | SG | O1 | 169.6° | 73.3° |
| O33 | C21 | C20 | H4 | 165.7° | 128.6° |
| O33 | C21 | N22 | H44 | 179.1° | 177.3° |
| C34 | C35 | C37 | H36 | 118.1° | 120.0° |
| C35 | C34 | C20 | H4 | 61.8° | 51.5° |
| C35 | C34 | H34 | H35 | 117.7° | 120.0° |
| C34 | C35 | C36 | H37 | 180.0° | 63.1° |
| C34 | C35 | C36 | H38 | 60.0° | 176.9° |
| C34 | C35 | C36 | H39 | 60.0° | 56.9° |
| C34 | C35 | C37 | H40 | 55.4° | 60.0° |
| C34 | C35 | C37 | H41 | 64.6° | 179.9° |
| C34 | C35 | C37 | H42 | 175.5° | 60.0° |
| C37 | C35 | C34 | H34 | 56.0° | 63.9° |
| C37 | C35 | C34 | H35 | 62.5° | 56.1° |
| C37 | C35 | C36 | H37 | 55.5° | 56.9° |
| C37 | C35 | C36 | H38 | 64.5° | 63.1° |
| C37 | C35 | C36 | H39 | 175.5° | 176.9° |
| C35 | C37 | H40 | H41 | 120.0° | 120.1° |
| C35 | C37 | H40 | H42 | 120.0° | 120.0° |
| C35 | C37 | H41 | H42 | 120.0° | 120.0° |
| O25 | C24 | C23 | H5 | 61.8° | 65.0° |
| O25 | C24 | SG | O2 | 43.9° | 54.9° |
| O25 | C24 | SG | O3 | 43.9° | 56.6° |
| O25 | C24 | SG | O1 | 49.5° | 166.6° |
| H1 | C10 | C09 | H19 | 159.6° | 172.8° |
| H1 | C10 | C09 | H20 | 41.9° | 52.5° |
| H2 | C10 | C09 | H19 | 41.6° | 52.7° |
| H2 | C10 | C09 | H20 | 76.2° | 67.7° |
| H3 | C16 | C12 | H21 | 19.4° | 105.8° |
| H3 | C16 | C12 | H22 | 145.6° | 25.2° |
| H3 | C16 | C15 | H27 | 145.3° | 25.3° |
| H3 | C16 | C15 | H28 | 18.9° | 105.7° |
| H4 | C20 | C34 | H34 | 177.4° | 68.5° |
| H4 | C20 | C34 | H35 | 58.9° | 171.5° |
| H4 | C20 | N19 | H43 | 126.4° | 147.6° |
| H5 | C23 | C24 | H6 | 59.4° | 55.1° |
| H5 | C23 | C26 | H8 | 66.3° | 174.1° |
| H5 | C23 | C26 | H9 | 174.8° | 65.9° |
| H5 | C23 | N22 | H44 | 176.4° | 126.3° |
| H6 | C24 | O25 | H7 | 61.6° | 179.9° |
| H6 | C24 | SG | O2 | 165.1° | 65.0° |
| H6 | C24 | SG | O3 | 165.1° | 176.6° |
| H6 | C24 | SG | O1 | 71.7° | 46.7° |
| H8 | C26 | C27 | H29 | 173.1° | 63.1° |
| H9 | C26 | C27 | H29 | 67.9° | 177.0° |
| H10 | C05 | H11 | H12 | 120.0° | 120.0° |
| H13 | C06 | H14 | H15 | 120.0° | 120.0° |
| H16 | C07 | H17 | H18 | 120.0° | 120.1° |
| H23 | C13 | C14 | H25 | 174.4° | 52.4° |
| H23 | C13 | C14 | H26 | 56.1° | 172.9° |
| H24 | C13 | C14 | H25 | 55.9° | 67.8° |
| H24 | C13 | C14 | H26 | 62.4° | 52.6° |
| H29 | C27 | C31 | H32 | 144.7° | 147.8° |
| H29 | C27 | C31 | H33 | 23.7° | 24.1° |
| H30 | C30 | C31 | H32 | 143.2° | 26.3° |
| H30 | C30 | C31 | H33 | 22.2° | 97.5° |
| H30 | C30 | N29 | H45 | 75.4° | 44.0° |
| H31 | C30 | C31 | H32 | 21.7° | 148.2° |
| H31 | C30 | C31 | H33 | 99.4° | 24.5° |
| H31 | C30 | N29 | H45 | 46.2° | 77.9° |
| H34 | C34 | C35 | H36 | 61.8° | 176.1° |
| H35 | C34 | C35 | H36 | 179.6° | 63.9° |
| H36 | C35 | C36 | H37 | 61.5° | 176.9° |
| H36 | C35 | C36 | H38 | 178.6° | 56.9° |
| H36 | C35 | C36 | H39 | 58.6° | 63.1° |
| H36 | C35 | C37 | H40 | 62.7° | 60.0° |
| H36 | C35 | C37 | H41 | 177.3° | 60.0° |
| H36 | C35 | C37 | H42 | 57.3° | 179.9° |
| H37 | C36 | H38 | H39 | 120.0° | 120.0° |
| H40 | C37 | H41 | H42 | 120.0° | 120.0° |
| O2 | SG | O3 | O1 | 90.0° | 116.8° |
| O3 | SG | O2 | H46 | 90.0° | 64.0° |
| O1 | SG | O2 | H46 | 90.0° | 63.9° |
