HZ2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C42 | N43 | doub | 1.32Å | 1.32Å | Aromatic |
| C42 | N41 | sing | 1.32Å | 1.33Å | Aromatic |
| N43 | C44 | sing | 1.33Å | 1.34Å | Aromatic |
| N41 | C39 | doub | 1.33Å | 1.34Å | Aromatic |
| C44 | N35 | sing | 1.37Å | 1.33Å | Aromatic |
| C44 | C38 | doub | 1.40Å | 1.41Å | Aromatic |
| C30 | O29 | sing | 1.44Å | 1.34Å | |
| C30 | N35 | sing | 1.47Å | 1.47Å | |
| C30 | C31 | sing | 1.54Å | 1.57Å | |
| O32 | C31 | sing | 1.43Å | 1.44Å | |
| C39 | C38 | sing | 1.41Å | 1.40Å | Aromatic |
| C39 | N40 | sing | 1.38Å | 1.46Å | |
| O29 | C28 | sing | 1.44Å | 1.62Å | |
| N35 | C36 | sing | 1.36Å | 1.35Å | Aromatic |
| C38 | N37 | sing | 1.35Å | 1.35Å | Aromatic |
| C31 | C33 | sing | 1.54Å | 1.53Å | |
| C07 | C06 | sing | 1.53Å | 1.57Å | |
| C07 | N08 | sing | 1.47Å | 1.49Å | |
| C06 | N05 | sing | 1.47Å | 1.53Å | |
| C36 | N37 | doub | 1.30Å | 1.33Å | Aromatic |
| N26 | C25 | doub | 1.32Å | 1.35Å | Aromatic |
| N26 | C09 | sing | 1.33Å | 1.32Å | Aromatic |
| C28 | C33 | sing | 1.54Å | 1.37Å | |
| C28 | C27 | sing | 1.53Å | 1.59Å | |
| C25 | N24 | sing | 1.32Å | 1.34Å | Aromatic |
| N08 | C09 | sing | 1.38Å | 1.50Å | |
| C09 | C10 | doub | 1.40Å | 1.45Å | Aromatic |
| C33 | O34 | sing | 1.43Å | 1.38Å | |
| O46 | C45 | doub | 1.21Å | 1.31Å | |
| N24 | C23 | doub | 1.33Å | 1.35Å | Aromatic |
| C04 | N05 | sing | 1.47Å | 1.52Å | |
| C04 | C03 | sing | 1.53Å | 1.59Å | |
| N05 | C27 | sing | 1.47Å | 1.52Å | |
| O18 | C17 | sing | 1.43Å | 1.37Å | |
| C10 | C23 | sing | 1.41Å | 1.39Å | Aromatic |
| C10 | N11 | sing | 1.35Å | 1.35Å | Aromatic |
| C23 | N13 | sing | 1.37Å | 1.36Å | Aromatic |
| C45 | C02 | sing | 1.51Å | 1.53Å | |
| C45 | O47 | sing | 1.34Å | 1.30Å | |
| N11 | C12 | doub | 1.30Å | 1.33Å | Aromatic |
| O15 | C14 | sing | 1.44Å | 1.33Å | |
| O15 | C16 | sing | 1.44Å | 1.62Å | |
| N13 | C12 | sing | 1.36Å | 1.33Å | Aromatic |
| N13 | C14 | sing | 1.47Å | 1.51Å | |
| C03 | C02 | sing | 1.53Å | 1.52Å | |
| C02 | N01 | sing | 1.47Å | 1.48Å | |
| C17 | C16 | sing | 1.53Å | 1.56Å | |
| C14 | C21 | sing | 1.55Å | 1.59Å | |
| C16 | C19 | sing | 1.54Å | 1.35Å | |
| C21 | C19 | sing | 1.55Å | 1.55Å | |
| C21 | O22 | sing | 1.43Å | 1.41Å | |
| C19 | O20 | sing | 1.43Å | 1.44Å | |
| O22 | H1 | sing | 0.97Å | 0.95Å | |
| O32 | H2 | sing | 0.97Å | 0.95Å | |
| C02 | H3 | sing | 1.09Å | 1.10Å | |
| C03 | H4 | sing | 1.09Å | 1.10Å | |
| C03 | H5 | sing | 1.09Å | 1.10Å | |
| C04 | H6 | sing | 1.09Å | 1.10Å | |
| C04 | H7 | sing | 1.09Å | 1.10Å | |
| C06 | H8 | sing | 1.09Å | 1.10Å | |
| C06 | H9 | sing | 1.09Å | 1.10Å | |
| C07 | H10 | sing | 1.09Å | 1.10Å | |
| C07 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C14 | H13 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C17 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C25 | H19 | sing | 1.08Å | 1.08Å | |
| C27 | H20 | sing | 1.09Å | 1.10Å | |
| C27 | H21 | sing | 1.09Å | 1.10Å | |
| C28 | H22 | sing | 1.09Å | 1.10Å | |
| C30 | H23 | sing | 1.09Å | 1.10Å | |
| C31 | H24 | sing | 1.09Å | 1.10Å | |
| C33 | H25 | sing | 1.09Å | 1.10Å | |
| C36 | H26 | sing | 1.08Å | 1.08Å | |
| C42 | H27 | sing | 1.08Å | 1.08Å | |
| N01 | H28 | sing | 1.01Å | 1.00Å | |
| N01 | H29 | sing | 1.01Å | 1.00Å | |
| N08 | H32 | sing | 0.97Å | 1.00Å | |
| N40 | H33 | sing | 0.97Å | 1.00Å | |
| N40 | H34 | sing | 0.97Å | 1.00Å | |
| O18 | H35 | sing | 0.97Å | 0.95Å | |
| O20 | H36 | sing | 0.97Å | 0.95Å | |
| O34 | H37 | sing | 0.97Å | 0.95Å | |
| O47 | H38 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N43 | C42 | N41 | 121.5° | 122.5° |
| C42 | N43 | C44 | 119.6° | 120.6° |
| N43 | C42 | H27 | 119.3° | 118.8° |
| C42 | N41 | C39 | 122.1° | 121.2° |
| N41 | C42 | H27 | 119.3° | 118.7° |
| N43 | C44 | N35 | 131.7° | 134.9° |
| N43 | C44 | C38 | 121.2° | 119.1° |
| N41 | C39 | C38 | 119.1° | 118.4° |
| N41 | C39 | N40 | 119.1° | 120.8° |
| N35 | C44 | C38 | 107.1° | 106.0° |
| C44 | N35 | C30 | 124.5° | 126.3° |
| C44 | N35 | C36 | 108.5° | 107.4° |
| C44 | C38 | C39 | 116.5° | 118.1° |
| C44 | C38 | N37 | 106.9° | 107.2° |
| O29 | C30 | N35 | 109.7° | 110.4° |
| O29 | C30 | C31 | 105.8° | 104.8° |
| C30 | O29 | C28 | 108.3° | 105.3° |
| O29 | C30 | H23 | 110.7° | 110.4° |
| N35 | C30 | C31 | 114.4° | 110.4° |
| C30 | N35 | C36 | 126.9° | 126.3° |
| N35 | C30 | H23 | 108.6° | 110.3° |
| C30 | C31 | O32 | 109.0° | 110.5° |
| C30 | C31 | C33 | 100.5° | 104.1° |
| C31 | C30 | H23 | 107.5° | 110.5° |
| C30 | C31 | H24 | 110.6° | 110.5° |
| O32 | C31 | C33 | 112.4° | 110.6° |
| C31 | O32 | H2 | 109.5° | 114.0° |
| O32 | C31 | H24 | 112.5° | 110.4° |
| C38 | C39 | N40 | 121.9° | 120.8° |
| C39 | C38 | N37 | 136.6° | 134.7° |
| C39 | N40 | H33 | 109.5° | 120.0° |
| C39 | N40 | H34 | 109.5° | 120.0° |
| O29 | C28 | C33 | 104.3° | 104.8° |
| O29 | C28 | C27 | 109.7° | 110.4° |
| O29 | C28 | H22 | 108.9° | 110.4° |
| N35 | C36 | N37 | 109.5° | 109.9° |
| N35 | C36 | H26 | 125.3° | 125.0° |
| C38 | N37 | C36 | 108.0° | 109.5° |
| C31 | C33 | C28 | 106.2° | 104.1° |
| C31 | C33 | O34 | 110.1° | 110.5° |
| C33 | C31 | H24 | 111.1° | 110.6° |
| C31 | C33 | H25 | 107.6° | 110.5° |
| C06 | C07 | N08 | 118.1° | 109.4° |
| C07 | C06 | N05 | 113.5° | 109.5° |
| C07 | C06 | H8 | 108.5° | 109.5° |
| C07 | C06 | H9 | 108.5° | 109.5° |
| C06 | C07 | H10 | 107.3° | 109.5° |
| C06 | C07 | H11 | 107.3° | 109.4° |
| C07 | N08 | C09 | 121.7° | 120.0° |
| N08 | C07 | H10 | 107.3° | 109.5° |
| N08 | C07 | H11 | 107.2° | 109.5° |
| C07 | N08 | H32 | 106.3° | 120.0° |
| C06 | N05 | C04 | 111.3° | 111.0° |
| C06 | N05 | C27 | 114.8° | 111.1° |
| N05 | C06 | H8 | 108.5° | 109.5° |
| N05 | C06 | H9 | 108.4° | 109.4° |
| N37 | C36 | H26 | 125.2° | 125.0° |
| C25 | N26 | C09 | 123.0° | 121.2° |
| N26 | C25 | N24 | 122.9° | 122.5° |
| N26 | C25 | H19 | 118.5° | 118.8° |
| N26 | C09 | N08 | 122.7° | 120.8° |
| N26 | C09 | C10 | 115.5° | 118.4° |
| C33 | C28 | C27 | 111.8° | 110.4° |
| C28 | C33 | O34 | 113.6° | 110.5° |
| C33 | C28 | H22 | 112.5° | 110.4° |
| C28 | C33 | H25 | 109.6° | 110.5° |
| C28 | C27 | N05 | 114.6° | 109.5° |
| C28 | C27 | H20 | 108.2° | 109.5° |
| C28 | C27 | H21 | 108.1° | 109.5° |
| C27 | C28 | H22 | 109.4° | 110.3° |
| C25 | N24 | C23 | 118.2° | 120.6° |
| N24 | C25 | H19 | 118.6° | 118.7° |
| N08 | C09 | C10 | 121.8° | 120.8° |
| C09 | N08 | H32 | 106.3° | 120.0° |
| C09 | C10 | C23 | 120.1° | 118.2° |
| C09 | C10 | N11 | 133.2° | 134.7° |
| O34 | C33 | H25 | 109.5° | 110.5° |
| C33 | O34 | H37 | 109.5° | 114.0° |
| O46 | C45 | C02 | 119.9° | 120.0° |
| O46 | C45 | O47 | 119.9° | 120.1° |
| N24 | C23 | C10 | 120.2° | 119.1° |
| N24 | C23 | N13 | 133.0° | 134.9° |
| N05 | C04 | C03 | 109.2° | 109.5° |
| C04 | N05 | C27 | 113.1° | 111.0° |
| N05 | C04 | H6 | 109.5° | 109.5° |
| N05 | C04 | H7 | 109.5° | 109.5° |
| C04 | C03 | C02 | 113.3° | 109.5° |
| C04 | C03 | H4 | 108.5° | 109.5° |
| C04 | C03 | H5 | 108.5° | 109.5° |
| C03 | C04 | H6 | 109.5° | 109.5° |
| C03 | C04 | H7 | 109.5° | 109.4° |
| N05 | C27 | H20 | 108.2° | 109.5° |
| N05 | C27 | H21 | 108.2° | 109.5° |
| O18 | C17 | C16 | 107.5° | 109.5° |
| O18 | C17 | H15 | 110.0° | 109.5° |
| O18 | C17 | H16 | 110.0° | 109.5° |
| C17 | O18 | H35 | 109.5° | 114.0° |
| C23 | C10 | N11 | 106.6° | 107.1° |
| C10 | C23 | N13 | 106.8° | 106.0° |
| C10 | N11 | C12 | 108.9° | 109.5° |
| C23 | N13 | C12 | 108.3° | 107.4° |
| C23 | N13 | C14 | 123.7° | 126.3° |
| C02 | C45 | O47 | 120.2° | 120.0° |
| C45 | C02 | C03 | 112.4° | 109.4° |
| C45 | C02 | N01 | 109.8° | 109.5° |
| C45 | C02 | H3 | 108.4° | 109.5° |
| C45 | O47 | H38 | 109.5° | 117.0° |
| N11 | C12 | N13 | 109.3° | 110.0° |
| N11 | C12 | H12 | 125.3° | 125.0° |
| C14 | O15 | C16 | 109.0° | 107.0° |
| O15 | C14 | N13 | 127.7° | 110.8° |
| O15 | C14 | C21 | 104.3° | 103.5° |
| O15 | C14 | H13 | 110.5° | 110.6° |
| O15 | C16 | C17 | 108.8° | 110.0° |
| O15 | C16 | C19 | 103.8° | 107.3° |
| O15 | C16 | H14 | 109.7° | 109.9° |
| C12 | N13 | C14 | 127.8° | 126.3° |
| N13 | C12 | H12 | 125.4° | 125.0° |
| N13 | C14 | C21 | 97.0° | 110.6° |
| N13 | C14 | H13 | 107.9° | 110.5° |
| C03 | C02 | N01 | 108.6° | 109.5° |
| C03 | C02 | H3 | 108.5° | 109.5° |
| C02 | C03 | H4 | 108.5° | 109.5° |
| C02 | C03 | H5 | 108.5° | 109.5° |
| N01 | C02 | H3 | 109.1° | 109.5° |
| C02 | N01 | H28 | 109.5° | 111.0° |
| C02 | N01 | H29 | 109.4° | 111.0° |
| C17 | C16 | C19 | 109.8° | 109.9° |
| C17 | C16 | H14 | 110.5° | 109.9° |
| C16 | C17 | H15 | 109.9° | 109.4° |
| C16 | C17 | H16 | 110.0° | 109.5° |
| C14 | C21 | C19 | 101.6° | 102.1° |
| C14 | C21 | O22 | 113.9° | 110.9° |
| C21 | C14 | H13 | 106.9° | 110.6° |
| C14 | C21 | H18 | 109.5° | 110.9° |
| C16 | C19 | C21 | 101.9° | 104.2° |
| C16 | C19 | O20 | 109.5° | 110.5° |
| C19 | C16 | H14 | 113.9° | 109.9° |
| C16 | C19 | H17 | 113.0° | 110.5° |
| C19 | C21 | O22 | 108.7° | 111.0° |
| C21 | C19 | O20 | 110.6° | 110.5° |
| C21 | C19 | H17 | 110.0° | 110.6° |
| C19 | C21 | H18 | 110.2° | 110.9° |
| C21 | O22 | H1 | 109.5° | 113.9° |
| O22 | C21 | H18 | 112.3° | 110.8° |
| O20 | C19 | H17 | 111.4° | 110.4° |
| C19 | O20 | H36 | 109.5° | 114.0° |
| H4 | C03 | H5 | 109.5° | 109.4° |
| H6 | C04 | H7 | 109.5° | 109.5° |
| H8 | C06 | H9 | 109.4° | 109.4° |
| H10 | C07 | H11 | 109.5° | 109.5° |
| H15 | C17 | H16 | 109.5° | 109.5° |
| H20 | C27 | H21 | 109.5° | 109.4° |
| H28 | N01 | H29 | 109.5° | 111.0° |
| H33 | N40 | H34 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N43 | C42 | N41 | H27 | 180.0° | 179.0° |
| N43 | C42 | N41 | C39 | 0.6° | 0.7° |
| C42 | N43 | C44 | N35 | 180.0° | 179.2° |
| C42 | N43 | C44 | C38 | 0.1° | 0.4° |
| N41 | C42 | N43 | C44 | 0.5° | 0.9° |
| C42 | N41 | C39 | C38 | 0.1° | 0.1° |
| C42 | N41 | C39 | N40 | 179.1° | 180.0° |
| N43 | C44 | N35 | C38 | 179.9° | 179.7° |
| N43 | C44 | N35 | C30 | 1.6° | 0.1° |
| N43 | C44 | C38 | C39 | 0.6° | 0.2° |
| N43 | C44 | N35 | C36 | 179.6° | 179.9° |
| N43 | C44 | C38 | N37 | 180.0° | 179.9° |
| C44 | N43 | C42 | H27 | 179.5° | 179.9° |
| N41 | C39 | C38 | C44 | 0.5° | 0.4° |
| N41 | C39 | C38 | N40 | 179.1° | 180.0° |
| N41 | C39 | C38 | N37 | 179.6° | 180.0° |
| C39 | N41 | C42 | H27 | 179.4° | 179.7° |
| N41 | C39 | N40 | H33 | 0.0° | 180.0° |
| N41 | C39 | N40 | H34 | 120.0° | 0.0° |
| C44 | N35 | C30 | O29 | 59.9° | 156.2° |
| C44 | N35 | C30 | C36 | 177.6° | 180.0° |
| C44 | N35 | C30 | C31 | 178.7° | 88.4° |
| N35 | C44 | C38 | C39 | 179.5° | 179.9° |
| N35 | C44 | C38 | N37 | 0.1° | 0.4° |
| C44 | N35 | C36 | N37 | 0.6° | 0.0° |
| C44 | N35 | C30 | H23 | 61.2° | 33.9° |
| C44 | N35 | C36 | H26 | 179.4° | 179.7° |
| C38 | C44 | N35 | C30 | 178.2° | 179.8° |
| C44 | C38 | C39 | N37 | 179.1° | 179.6° |
| C44 | C38 | C39 | N40 | 179.6° | 179.6° |
| C38 | C44 | N35 | C36 | 0.3° | 0.2° |
| C44 | C38 | N37 | C36 | 0.5° | 0.4° |
| O29 | C30 | N35 | C31 | 118.7° | 115.4° |
| O29 | C30 | N35 | H23 | 121.1° | 122.2° |
| O29 | C30 | C31 | H23 | 118.3° | 118.9° |
| O29 | C30 | C31 | O32 | 84.1° | 142.7° |
| O29 | C30 | N35 | C36 | 122.5° | 23.8° |
| O29 | C30 | C31 | C33 | 34.2° | 24.0° |
| C30 | O29 | C28 | C33 | 5.5° | 40.5° |
| C30 | O29 | C28 | C27 | 125.5° | 159.4° |
| C30 | O29 | C28 | H22 | 114.8° | 78.4° |
| O29 | C30 | C31 | H24 | 151.6° | 94.8° |
| N35 | C30 | C31 | H23 | 120.8° | 122.3° |
| N35 | C30 | C31 | O32 | 155.0° | 98.5° |
| N35 | C30 | O29 | C28 | 105.4° | 159.3° |
| N35 | C30 | C31 | C33 | 86.7° | 142.8° |
| C30 | N35 | C36 | N37 | 178.5° | 180.0° |
| N35 | C30 | C31 | H24 | 30.7° | 24.0° |
| C30 | N35 | C36 | H26 | 1.5° | 0.3° |
| C30 | C31 | O32 | C33 | 110.6° | 114.7° |
| C30 | C31 | O32 | H24 | 123.1° | 122.6° |
| C31 | C30 | O29 | C28 | 18.6° | 40.5° |
| C31 | C30 | N35 | C36 | 3.7° | 91.5° |
| C30 | C31 | C33 | H24 | 117.1° | 118.7° |
| C30 | C31 | C33 | C28 | 38.3° | 0.0° |
| C30 | C31 | C33 | O34 | 161.6° | 118.6° |
| C30 | C31 | O32 | H2 | 180.0° | 179.9° |
| C30 | C31 | C33 | H25 | 79.1° | 118.7° |
| O32 | C31 | C33 | H24 | 127.2° | 122.6° |
| O32 | C31 | C33 | C28 | 77.5° | 118.7° |
| O32 | C31 | C33 | O34 | 45.9° | 0.0° |
| O32 | C31 | C30 | H23 | 34.2° | 23.8° |
| O32 | C31 | C33 | H25 | 165.1° | 122.7° |
| C39 | C38 | N37 | C36 | 179.7° | 180.0° |
| C38 | C39 | N40 | H33 | 179.1° | 0.0° |
| C38 | C39 | N40 | H34 | 60.9° | 180.0° |
| N40 | C39 | C38 | N37 | 1.3° | 0.0° |
| C39 | N40 | H33 | H34 | 120.0° | 180.0° |
| O29 | C28 | C33 | C31 | 27.7° | 24.0° |
| O29 | C28 | C33 | C27 | 118.5° | 118.9° |
| O29 | C28 | C33 | H22 | 117.9° | 118.9° |
| O29 | C28 | C27 | H22 | 119.4° | 122.3° |
| O29 | C28 | C33 | O34 | 148.8° | 142.6° |
| O29 | C28 | C27 | N05 | 88.5° | 67.6° |
| O29 | C28 | C27 | H20 | 150.7° | 172.4° |
| O29 | C28 | C27 | H21 | 32.3° | 52.4° |
| C28 | O29 | C30 | H23 | 134.8° | 78.5° |
| O29 | C28 | C33 | H25 | 88.3° | 94.7° |
| N35 | C36 | N37 | C38 | 0.7° | 0.3° |
| N35 | C36 | N37 | H26 | 180.0° | 179.7° |
| C36 | N35 | C30 | H23 | 116.4° | 146.1° |
| C38 | N37 | C36 | H26 | 179.3° | 179.9° |
| C31 | C33 | C28 | O34 | 121.2° | 118.6° |
| C31 | C33 | C28 | H25 | 116.0° | 118.7° |
| C31 | C33 | C28 | C27 | 146.2° | 142.8° |
| C31 | C33 | O34 | H25 | 118.1° | 122.7° |
| C33 | C31 | O32 | H2 | 69.5° | 65.3° |
| C31 | C33 | C28 | H22 | 90.2° | 94.9° |
| C33 | C31 | C30 | H23 | 152.5° | 94.9° |
| C31 | C33 | O34 | H37 | 180.0° | 65.4° |
| C06 | C07 | N08 | H10 | 121.2° | 120.0° |
| C06 | C07 | N08 | H11 | 121.2° | 119.9° |
| C07 | C06 | N05 | H8 | 120.6° | 120.1° |
| C07 | C06 | N05 | H9 | 120.6° | 120.0° |
| C06 | C07 | N08 | C09 | 156.5° | 180.0° |
| C07 | C06 | N05 | C04 | 162.3° | 66.0° |
| C07 | C06 | N05 | C27 | 32.1° | 170.0° |
| C07 | C06 | H8 | H9 | 118.2° | 120.0° |
| C06 | C07 | H10 | H11 | 116.1° | 120.0° |
| C06 | C07 | N08 | H32 | 81.8° | 0.0° |
| N08 | C07 | C06 | N05 | 85.2° | 180.0° |
| C07 | N08 | C09 | N26 | 113.0° | 0.3° |
| C07 | N08 | C09 | H32 | 121.7° | 180.0° |
| C07 | N08 | C09 | C10 | 67.4° | 180.0° |
| N08 | C07 | C06 | H8 | 35.4° | 60.0° |
| N08 | C07 | C06 | H9 | 154.2° | 60.0° |
| N08 | C07 | H10 | H11 | 116.1° | 120.1° |
| C06 | N05 | C27 | C28 | 76.2° | 72.4° |
| C06 | N05 | C04 | C27 | 131.0° | 124.0° |
| C06 | N05 | C04 | C03 | 158.2° | 163.6° |
| C06 | N05 | C04 | H6 | 38.3° | 76.4° |
| C06 | N05 | C04 | H7 | 81.8° | 43.6° |
| N05 | C06 | H8 | H9 | 118.1° | 119.9° |
| N05 | C06 | C07 | H10 | 36.0° | 60.0° |
| N05 | C06 | C07 | H11 | 153.5° | 60.0° |
| C06 | N05 | C27 | H20 | 163.1° | 47.6° |
| C06 | N05 | C27 | H21 | 44.6° | 167.6° |
| N26 | C25 | N24 | H19 | 180.0° | 179.8° |
| C25 | N26 | C09 | N08 | 179.7° | 179.8° |
| C25 | N26 | C09 | C10 | 0.7° | 0.4° |
| N26 | C25 | N24 | C23 | 0.2° | 0.2° |
| C09 | N26 | C25 | N24 | 0.6° | 0.4° |
| N26 | C09 | N08 | C10 | 179.6° | 179.8° |
| N26 | C09 | C10 | C23 | 0.2° | 0.2° |
| N26 | C09 | C10 | N11 | 179.9° | 179.8° |
| C09 | N26 | C25 | H19 | 179.4° | 179.8° |
| N26 | C09 | N08 | H32 | 8.6° | 179.8° |
| C33 | C28 | C27 | H22 | 125.3° | 122.3° |
| C28 | C33 | O34 | H25 | 122.9° | 122.6° |
| C33 | C28 | C27 | N05 | 156.3° | 177.0° |
| C33 | C28 | C27 | H20 | 35.5° | 57.0° |
| C33 | C28 | C27 | H21 | 82.9° | 63.0° |
| C28 | C33 | C31 | H24 | 155.3° | 118.7° |
| C28 | C33 | O34 | H37 | 61.0° | 180.0° |
| C27 | C28 | C33 | O34 | 92.7° | 98.5° |
| C28 | C27 | N05 | C04 | 53.1° | 163.6° |
| C28 | C27 | N05 | H20 | 120.8° | 120.0° |
| C28 | C27 | N05 | H21 | 120.7° | 120.0° |
| C28 | C27 | H20 | H21 | 117.6° | 120.0° |
| C27 | C28 | C33 | H25 | 30.2° | 24.1° |
| C25 | N24 | C23 | C10 | 0.7° | 0.0° |
| C25 | N24 | C23 | N13 | 179.0° | 180.0° |
| N08 | C09 | C10 | C23 | 179.8° | 180.0° |
| N08 | C09 | C10 | N11 | 0.5° | 0.1° |
| C09 | N08 | C07 | H10 | 35.3° | 60.0° |
| C09 | N08 | C07 | H11 | 82.2° | 60.1° |
| C09 | C10 | C23 | N24 | 0.5° | 0.0° |
| C09 | C10 | C23 | N11 | 179.8° | 179.9° |
| C09 | C10 | C23 | N13 | 179.3° | 180.0° |
| C09 | C10 | N11 | C12 | 179.6° | 179.9° |
| C10 | C09 | N08 | H32 | 170.9° | 0.0° |
| O34 | C33 | C28 | H22 | 30.9° | 23.7° |
| O34 | C33 | C31 | H24 | 81.3° | 122.7° |
| O46 | C45 | C02 | O47 | 179.9° | 179.9° |
| O46 | C45 | C02 | C03 | 86.7° | 101.1° |
| O46 | C45 | C02 | N01 | 152.2° | 18.9° |
| O46 | C45 | C02 | H3 | 33.2° | 138.9° |
| O46 | C45 | O47 | H38 | 0.0° | 5.0° |
| N24 | C23 | C10 | N13 | 179.8° | 180.0° |
| N24 | C23 | C10 | N11 | 179.2° | 180.0° |
| N24 | C23 | N13 | C12 | 178.6° | 179.9° |
| N24 | C23 | N13 | C14 | 2.4° | 0.0° |
| C23 | N24 | C25 | H19 | 179.8° | 180.0° |
| N05 | C04 | C03 | H6 | 120.0° | 120.0° |
| N05 | C04 | C03 | H7 | 119.9° | 120.0° |
| N05 | C04 | C03 | C02 | 178.0° | 178.8° |
| N05 | C04 | C03 | H4 | 57.5° | 61.2° |
| N05 | C04 | C03 | H5 | 61.4° | 58.8° |
| N05 | C04 | H6 | H7 | 120.1° | 120.0° |
| C04 | N05 | C06 | H8 | 77.1° | 54.0° |
| C04 | N05 | C06 | H9 | 41.6° | 173.9° |
| C04 | N05 | C27 | H20 | 67.7° | 76.4° |
| C04 | N05 | C27 | H21 | 173.8° | 43.6° |
| C03 | C04 | N05 | C27 | 70.7° | 72.4° |
| C04 | C03 | C02 | C45 | 78.8° | 174.7° |
| C04 | C03 | C02 | H4 | 120.6° | 120.0° |
| C04 | C03 | C02 | H5 | 120.6° | 120.0° |
| C04 | C03 | C02 | N01 | 159.5° | 65.3° |
| C04 | C03 | C02 | H3 | 41.1° | 54.7° |
| C04 | C03 | H4 | H5 | 118.2° | 120.0° |
| C03 | C04 | H6 | H7 | 120.1° | 120.0° |
| C27 | N05 | C04 | H6 | 169.3° | 47.6° |
| C27 | N05 | C04 | H7 | 49.2° | 167.6° |
| C27 | N05 | C06 | H8 | 152.7° | 69.9° |
| C27 | N05 | C06 | H9 | 88.5° | 50.0° |
| N05 | C27 | H20 | H21 | 117.7° | 120.0° |
| N05 | C27 | C28 | H22 | 30.9° | 54.7° |
| O18 | C17 | C16 | O15 | 68.6° | 67.1° |
| O18 | C17 | C16 | H15 | 119.7° | 120.0° |
| O18 | C17 | C16 | H16 | 119.7° | 120.0° |
| O18 | C17 | C16 | C19 | 178.4° | 175.0° |
| O18 | C17 | C16 | H14 | 51.9° | 54.0° |
| O18 | C17 | H15 | H16 | 120.9° | 120.0° |
| C23 | C10 | N11 | C12 | 0.1° | 0.0° |
| C10 | C23 | N13 | C12 | 1.7° | 0.0° |
| C10 | C23 | N13 | C14 | 177.8° | 180.0° |
| N11 | C10 | C23 | N13 | 1.0° | 0.0° |
| C10 | N11 | C12 | N13 | 1.1° | 0.0° |
| C10 | N11 | C12 | H12 | 178.9° | 180.0° |
| C23 | N13 | C12 | N11 | 1.8° | 0.0° |
| C23 | N13 | C14 | O15 | 87.7° | 160.8° |
| C23 | N13 | C12 | C14 | 175.9° | 179.9° |
| C23 | N13 | C14 | C21 | 158.1° | 85.0° |
| C23 | N13 | C12 | H12 | 178.2° | 180.0° |
| C23 | N13 | C14 | H13 | 47.7° | 37.9° |
| C45 | C02 | C03 | N01 | 121.7° | 120.0° |
| C45 | C02 | C03 | H3 | 119.8° | 120.0° |
| C45 | C02 | N01 | H3 | 118.7° | 120.0° |
| C45 | C02 | C03 | H4 | 41.8° | 65.3° |
| C45 | C02 | C03 | H5 | 160.6° | 54.7° |
| C45 | C02 | N01 | H28 | 180.0° | 60.0° |
| C45 | C02 | N01 | H29 | 60.0° | 176.1° |
| C02 | C45 | O47 | H38 | 179.9° | 174.9° |
| O47 | C45 | C02 | C03 | 93.1° | 79.0° |
| O47 | C45 | C02 | N01 | 27.9° | 161.0° |
| O47 | C45 | C02 | H3 | 146.9° | 41.0° |
| N11 | C12 | N13 | H12 | 180.0° | 180.0° |
| N11 | C12 | N13 | C14 | 177.7° | 180.0° |
| O15 | C14 | N13 | C12 | 87.6° | 19.1° |
| O15 | C14 | N13 | C21 | 114.2° | 114.2° |
| O15 | C14 | N13 | H13 | 135.5° | 123.0° |
| C14 | O15 | C16 | C17 | 93.2° | 146.0° |
| O15 | C14 | C21 | H13 | 117.1° | 118.5° |
| C14 | O15 | C16 | C19 | 23.8° | 26.5° |
| O15 | C14 | C21 | C19 | 28.0° | 37.0° |
| O15 | C14 | C21 | O22 | 144.7° | 155.3° |
| C14 | O15 | C16 | H14 | 145.8° | 92.9° |
| O15 | C14 | C21 | H18 | 88.6° | 81.2° |
| C16 | O15 | C14 | N13 | 115.6° | 158.6° |
| O15 | C16 | C17 | C19 | 113.0° | 117.9° |
| O15 | C16 | C17 | H14 | 120.5° | 121.1° |
| C16 | O15 | C14 | C21 | 4.8° | 40.1° |
| O15 | C16 | C19 | H14 | 119.2° | 119.4° |
| O15 | C16 | C19 | C21 | 40.1° | 2.0° |
| O15 | C16 | C19 | O20 | 77.1° | 120.7° |
| C16 | O15 | C14 | H13 | 109.8° | 78.4° |
| O15 | C16 | C17 | H15 | 51.1° | 172.9° |
| O15 | C16 | C17 | H16 | 171.7° | 52.9° |
| O15 | C16 | C19 | H17 | 158.0° | 116.8° |
| C12 | N13 | C14 | C21 | 26.6° | 95.1° |
| C12 | N13 | C14 | H13 | 136.9° | 142.0° |
| N13 | C14 | C21 | H13 | 111.1° | 122.8° |
| N13 | C14 | C21 | C19 | 159.8° | 155.7° |
| N13 | C14 | C21 | O22 | 83.5° | 86.1° |
| C14 | N13 | C12 | H12 | 2.3° | 0.1° |
| N13 | C14 | C21 | H18 | 43.2° | 37.5° |
| C03 | C02 | N01 | H3 | 118.1° | 120.0° |
| C02 | C03 | H4 | H5 | 118.2° | 120.0° |
| C02 | C03 | C04 | H6 | 62.0° | 58.8° |
| C02 | C03 | C04 | H7 | 58.1° | 61.2° |
| C03 | C02 | N01 | H28 | 56.8° | 60.0° |
| C03 | C02 | N01 | H29 | 176.8° | 63.9° |
| N01 | C02 | C03 | H4 | 79.9° | 54.7° |
| N01 | C02 | C03 | H5 | 38.9° | 174.7° |
| C02 | N01 | H28 | H29 | 120.0° | 123.9° |
| C17 | C16 | C19 | H14 | 124.6° | 121.0° |
| C17 | C16 | C19 | C21 | 76.1° | 121.6° |
| C17 | C16 | C19 | O20 | 166.8° | 119.7° |
| C16 | C17 | H15 | H16 | 120.9° | 120.0° |
| C17 | C16 | C19 | H17 | 41.9° | 2.8° |
| C16 | C17 | O18 | H35 | 180.0° | 180.0° |
| C14 | C21 | C19 | C16 | 43.5° | 20.9° |
| C14 | C21 | C19 | O22 | 120.4° | 118.2° |
| C14 | C21 | C19 | H18 | 116.1° | 118.1° |
| C14 | C21 | O22 | H18 | 125.3° | 123.6° |
| C14 | C21 | C19 | O20 | 72.8° | 97.8° |
| C14 | C21 | O22 | H1 | 180.0° | 180.0° |
| C14 | C21 | C19 | H17 | 163.6° | 139.6° |
| C16 | C19 | C21 | O20 | 116.3° | 118.7° |
| C16 | C19 | C21 | H17 | 120.1° | 118.8° |
| C16 | C19 | C21 | O22 | 163.9° | 139.0° |
| C16 | C19 | O20 | H17 | 125.8° | 122.5° |
| C19 | C16 | C17 | H15 | 61.8° | 55.0° |
| C19 | C16 | C17 | H16 | 58.8° | 65.0° |
| C16 | C19 | C21 | H18 | 72.6° | 97.3° |
| C16 | C19 | O20 | H36 | 180.0° | 61.4° |
| C19 | C21 | O22 | H18 | 122.2° | 123.7° |
| C21 | C19 | O20 | H17 | 122.7° | 122.7° |
| C19 | C21 | O22 | H1 | 67.5° | 67.3° |
| C19 | C21 | C14 | H13 | 89.1° | 81.5° |
| C21 | C19 | C16 | H14 | 159.3° | 117.4° |
| C21 | C19 | O20 | H36 | 68.5° | 176.2° |
| O22 | C21 | C19 | O20 | 47.6° | 20.4° |
| O22 | C21 | C14 | H13 | 27.6° | 36.7° |
| O22 | C21 | C19 | H17 | 76.0° | 102.2° |
| O20 | C19 | C16 | H14 | 42.2° | 1.4° |
| O20 | C19 | C21 | H18 | 171.1° | 144.0° |
| H1 | O22 | C21 | H18 | 54.7° | 56.5° |
| H2 | O32 | C31 | H24 | 56.9° | 57.5° |
| H3 | C02 | C03 | H4 | 161.6° | 174.7° |
| H3 | C02 | C03 | H5 | 79.5° | 65.3° |
| H3 | C02 | N01 | H28 | 61.3° | 180.0° |
| H3 | C02 | N01 | H29 | 58.7° | 56.1° |
| H4 | C03 | C04 | H6 | 177.4° | 178.8° |
| H4 | C03 | C04 | H7 | 62.5° | 58.8° |
| H5 | C03 | C04 | H6 | 58.6° | 61.3° |
| H5 | C03 | C04 | H7 | 178.7° | 178.8° |
| H8 | C06 | C07 | H10 | 156.6° | 60.0° |
| H8 | C06 | C07 | H11 | 85.8° | 180.0° |
| H9 | C06 | C07 | H10 | 84.6° | 180.0° |
| H9 | C06 | C07 | H11 | 33.0° | 60.0° |
| H10 | C07 | N08 | H32 | 157.0° | 120.0° |
| H11 | C07 | N08 | H32 | 39.5° | 120.0° |
| H13 | C14 | C21 | H18 | 154.4° | 160.3° |
| H14 | C16 | C17 | H15 | 171.6° | 66.0° |
| H14 | C16 | C17 | H16 | 67.8° | 174.0° |
| H14 | C16 | C19 | H17 | 82.7° | 123.8° |
| H15 | C17 | O18 | H35 | 60.3° | 60.1° |
| H16 | C17 | O18 | H35 | 60.3° | 60.0° |
| H17 | C19 | C21 | H18 | 47.5° | 21.5° |
| H17 | C19 | O20 | H36 | 54.2° | 61.1° |
| H20 | C27 | C28 | H22 | 89.8° | 65.3° |
| H21 | C27 | C28 | H22 | 151.7° | 174.7° |
| H22 | C28 | C33 | H25 | 153.8° | 146.4° |
| H23 | C30 | C31 | H24 | 90.0° | 146.3° |
| H24 | C31 | C33 | H25 | 38.0° | 0.0° |
| H25 | C33 | O34 | H37 | 61.9° | 57.3° |
