A1EAT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O6M | C6M | sing | 1.43Å | 1.43Å | |
| C6M | C5M | sing | 1.53Å | 1.52Å | |
| O2M | C2M | sing | 1.43Å | 1.43Å | |
| O5M | C5M | sing | 1.43Å | 1.47Å | |
| O5M | C1M | sing | 1.43Å | 1.48Å | |
| C4M | C5M | sing | 1.53Å | 1.56Å | |
| C4M | O4M | sing | 1.43Å | 1.43Å | |
| C4M | C3M | sing | 1.53Å | 1.54Å | |
| O3M | C3M | sing | 1.43Å | 1.45Å | |
| C2M | C3M | sing | 1.53Å | 1.57Å | |
| C2M | C1M | sing | 1.53Å | 1.52Å | |
| C1M | O1M | sing | 1.43Å | 1.43Å | |
| O1M | C23 | sing | 1.43Å | 1.45Å | |
| C23 | C16 | sing | 1.53Å | 1.52Å | |
| C16 | N2 | sing | 1.47Å | 1.44Å | |
| N2 | C15 | sing | 1.35Å | 1.31Å | |
| O | C15 | doub | 1.22Å | 1.20Å | |
| C15 | C | sing | 1.48Å | 1.49Å | |
| C | C1 | doub | 1.40Å | 1.36Å | Aromatic |
| C | C5 | sing | 1.40Å | 1.40Å | Aromatic |
| C1 | C2 | sing | 1.38Å | 1.42Å | Aromatic |
| C5 | C4 | doub | 1.38Å | 1.42Å | Aromatic |
| C2 | C3 | doub | 1.39Å | 1.43Å | Aromatic |
| C4 | C3 | sing | 1.39Å | 1.40Å | Aromatic |
| C3 | NE2 | sing | 1.39Å | 1.40Å | |
| NE2 | CE1 | sing | 1.33Å | 1.36Å | Aromatic |
| NE2 | CD2 | sing | 1.36Å | 1.41Å | Aromatic |
| CE1 | ND1 | doub | 1.33Å | 1.36Å | Aromatic |
| CD2 | CG | doub | 1.35Å | 1.45Å | Aromatic |
| ND1 | CG | sing | 1.36Å | 1.41Å | Aromatic |
| ND1 | C9 | sing | 1.39Å | 1.39Å | |
| C10 | C9 | doub | 1.39Å | 1.43Å | Aromatic |
| C10 | C11 | sing | 1.38Å | 1.40Å | Aromatic |
| C9 | C14 | sing | 1.39Å | 1.41Å | Aromatic |
| C11 | C12 | doub | 1.40Å | 1.38Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.42Å | Aromatic |
| C12 | C13 | sing | 1.40Å | 1.41Å | Aromatic |
| C12 | C24 | sing | 1.48Å | 1.52Å | |
| C24 | N3 | sing | 1.35Å | 1.33Å | |
| C24 | O7 | doub | 1.22Å | 1.23Å | |
| N3 | C25 | sing | 1.47Å | 1.46Å | |
| C25 | C32 | sing | 1.53Å | 1.54Å | |
| C32 | O1M2 | sing | 1.43Å | 1.45Å | |
| O1M2 | C1M2 | sing | 1.43Å | 1.43Å | |
| C3M2 | O3M2 | sing | 1.43Å | 1.44Å | |
| C3M2 | C2M2 | sing | 1.53Å | 1.53Å | |
| C3M2 | C4M2 | sing | 1.53Å | 1.54Å | |
| C1M2 | C2M2 | sing | 1.53Å | 1.51Å | |
| C1M2 | O5M2 | sing | 1.43Å | 1.45Å | |
| O4M2 | C4M2 | sing | 1.43Å | 1.41Å | |
| C2M2 | O2M2 | sing | 1.43Å | 1.41Å | |
| C5M2 | C4M2 | sing | 1.53Å | 1.54Å | |
| C5M2 | O5M2 | sing | 1.43Å | 1.42Å | |
| C5M2 | C6M2 | sing | 1.53Å | 1.52Å | |
| C6M2 | O6M2 | sing | 1.43Å | 1.42Å | |
| C14 | H1 | sing | 1.08Å | 1.08Å | |
| C16 | H2 | sing | 1.09Å | 1.10Å | |
| C16 | H3 | sing | 1.09Å | 1.10Å | |
| C10 | H4 | sing | 1.08Å | 1.08Å | |
| C11 | H5 | sing | 1.08Å | 1.08Å | |
| C13 | H6 | sing | 1.08Å | 1.08Å | |
| N3 | H7 | sing | 0.97Å | 1.00Å | |
| C25 | H8 | sing | 1.09Å | 1.10Å | |
| C25 | H9 | sing | 1.09Å | 1.10Å | |
| C32 | H10 | sing | 1.09Å | 1.10Å | |
| C32 | H11 | sing | 1.09Å | 1.10Å | |
| C1M2 | H12 | sing | 1.09Å | 1.10Å | |
| C5M2 | H13 | sing | 1.09Å | 1.10Å | |
| C6M2 | H14 | sing | 1.09Å | 1.10Å | |
| C6M2 | H15 | sing | 1.09Å | 1.10Å | |
| O6M2 | H16 | sing | 0.97Å | 0.95Å | |
| C4M2 | H17 | sing | 1.09Å | 1.10Å | |
| O4M2 | H18 | sing | 0.97Å | 0.95Å | |
| C3M2 | H19 | sing | 1.09Å | 1.10Å | |
| O3M2 | H20 | sing | 0.97Å | 0.95Å | |
| C2M2 | H21 | sing | 1.09Å | 1.10Å | |
| O2M2 | H22 | sing | 0.97Å | 0.95Å | |
| CG | H23 | sing | 1.08Å | 1.08Å | |
| CD2 | H24 | sing | 1.08Å | 1.08Å | |
| CE1 | H25 | sing | 1.08Å | 1.08Å | |
| C1 | H26 | sing | 1.08Å | 1.08Å | |
| C2 | H27 | sing | 1.08Å | 1.08Å | |
| C4 | H28 | sing | 1.08Å | 1.08Å | |
| C5 | H29 | sing | 1.08Å | 1.08Å | |
| N2 | H30 | sing | 0.97Å | 1.00Å | |
| C23 | H31 | sing | 1.09Å | 1.10Å | |
| C23 | H32 | sing | 1.09Å | 1.10Å | |
| C1M | H33 | sing | 1.09Å | 1.10Å | |
| C5M | H34 | sing | 1.09Å | 1.10Å | |
| C6M | H35 | sing | 1.09Å | 1.10Å | |
| C6M | H36 | sing | 1.09Å | 1.10Å | |
| O6M | H37 | sing | 0.97Å | 0.95Å | |
| C4M | H38 | sing | 1.09Å | 1.10Å | |
| O4M | H39 | sing | 0.97Å | 0.95Å | |
| C3M | H40 | sing | 1.09Å | 1.10Å | |
| O3M | H41 | sing | 0.97Å | 0.95Å | |
| C2M | H42 | sing | 1.09Å | 1.10Å | |
| O2M | H43 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O6M | C6M | C5M | 108.5° | 109.5° |
| O6M | C6M | H35 | 109.7° | 109.5° |
| O6M | C6M | H36 | 109.7° | 109.4° |
| C6M | O6M | H37 | 109.5° | 114.0° |
| C6M | C5M | O5M | 110.4° | 109.5° |
| C6M | C5M | C4M | 115.5° | 109.5° |
| C6M | C5M | H34 | 107.0° | 109.5° |
| C5M | C6M | H35 | 109.7° | 109.5° |
| C5M | C6M | H36 | 109.7° | 109.5° |
| O2M | C2M | C3M | 112.0° | 109.5° |
| O2M | C2M | C1M | 102.6° | 109.5° |
| O2M | C2M | H42 | 111.0° | 109.6° |
| C2M | O2M | H43 | 109.5° | 114.0° |
| C5M | O5M | C1M | 114.0° | 114.1° |
| O5M | C5M | C4M | 109.6° | 109.4° |
| O5M | C5M | H34 | 107.6° | 109.5° |
| O5M | C1M | C2M | 107.3° | 109.4° |
| O5M | C1M | O1M | 113.7° | 109.5° |
| O5M | C1M | H33 | 108.7° | 109.5° |
| C5M | C4M | O4M | 109.2° | 109.5° |
| C5M | C4M | C3M | 113.9° | 109.2° |
| C4M | C5M | H34 | 106.4° | 109.5° |
| C5M | C4M | H38 | 108.3° | 109.5° |
| O4M | C4M | C3M | 106.6° | 109.5° |
| O4M | C4M | H38 | 110.2° | 109.5° |
| C4M | O4M | H39 | 109.5° | 114.0° |
| C4M | C3M | O3M | 111.0° | 109.7° |
| C4M | C3M | C2M | 112.1° | 109.0° |
| C3M | C4M | H38 | 108.6° | 109.6° |
| C4M | C3M | H40 | 106.8° | 109.6° |
| O3M | C3M | C2M | 112.4° | 109.5° |
| O3M | C3M | H40 | 107.8° | 109.6° |
| C3M | O3M | H41 | 109.5° | 114.0° |
| C3M | C2M | C1M | 112.2° | 109.2° |
| C2M | C3M | H40 | 106.4° | 109.5° |
| C3M | C2M | H42 | 109.1° | 109.5° |
| C2M | C1M | O1M | 109.4° | 109.4° |
| C2M | C1M | H33 | 108.1° | 109.5° |
| C1M | C2M | H42 | 109.8° | 109.5° |
| C1M | O1M | C23 | 113.9° | 114.0° |
| O1M | C1M | H33 | 109.4° | 109.6° |
| O1M | C23 | C16 | 111.4° | 109.5° |
| O1M | C23 | H31 | 109.0° | 109.5° |
| O1M | C23 | H32 | 109.0° | 109.4° |
| C23 | C16 | N2 | 114.6° | 109.4° |
| C23 | C16 | H2 | 108.2° | 109.5° |
| C23 | C16 | H3 | 108.2° | 109.5° |
| C16 | C23 | H31 | 109.0° | 109.5° |
| C16 | C23 | H32 | 109.0° | 109.5° |
| C16 | N2 | C15 | 121.6° | 119.9° |
| N2 | C16 | H2 | 108.1° | 109.5° |
| N2 | C16 | H3 | 108.2° | 109.5° |
| C16 | N2 | H30 | 119.2° | 120.0° |
| N2 | C15 | O | 118.5° | 120.1° |
| N2 | C15 | C | 123.8° | 120.0° |
| C15 | N2 | H30 | 119.2° | 120.1° |
| O | C15 | C | 117.5° | 120.0° |
| C15 | C | C1 | 122.3° | 120.1° |
| C15 | C | C5 | 121.3° | 120.1° |
| C1 | C | C5 | 116.0° | 119.9° |
| C | C1 | C2 | 119.5° | 120.0° |
| C | C1 | H26 | 120.3° | 120.0° |
| C | C5 | C4 | 122.9° | 120.0° |
| C | C5 | H29 | 118.6° | 120.0° |
| C1 | C2 | C3 | 128.0° | 120.1° |
| C2 | C1 | H26 | 120.2° | 120.0° |
| C1 | C2 | H27 | 116.0° | 120.0° |
| C5 | C4 | C3 | 124.4° | 120.1° |
| C5 | C4 | H28 | 117.8° | 120.0° |
| C4 | C5 | H29 | 118.5° | 120.1° |
| C2 | C3 | C4 | 109.0° | 120.1° |
| C2 | C3 | NE2 | 122.8° | 120.0° |
| C3 | C2 | H27 | 116.1° | 119.9° |
| C4 | C3 | NE2 | 128.1° | 120.0° |
| C3 | C4 | H28 | 117.8° | 119.9° |
| C3 | NE2 | CE1 | 115.6° | 125.9° |
| C3 | NE2 | CD2 | 133.0° | 125.9° |
| CE1 | NE2 | CD2 | 111.4° | 108.2° |
| NE2 | CE1 | ND1 | 106.3° | 108.8° |
| NE2 | CE1 | H25 | 126.8° | 125.6° |
| NE2 | CD2 | CG | 105.4° | 107.4° |
| NE2 | CD2 | H24 | 127.3° | 126.3° |
| CE1 | ND1 | CG | 112.4° | 108.2° |
| CE1 | ND1 | C9 | 115.4° | 125.9° |
| ND1 | CE1 | H25 | 126.8° | 125.6° |
| CD2 | CG | ND1 | 104.4° | 107.4° |
| CD2 | CG | H23 | 127.8° | 126.3° |
| CG | CD2 | H24 | 127.3° | 126.3° |
| CG | ND1 | C9 | 132.1° | 125.9° |
| ND1 | CG | H23 | 127.8° | 126.3° |
| ND1 | C9 | C10 | 121.5° | 119.9° |
| ND1 | C9 | C14 | 126.2° | 119.9° |
| C9 | C10 | C11 | 126.5° | 120.0° |
| C10 | C9 | C14 | 112.3° | 120.2° |
| C9 | C10 | H4 | 116.7° | 120.0° |
| C10 | C11 | C12 | 119.3° | 120.0° |
| C11 | C10 | H4 | 116.7° | 120.0° |
| C10 | C11 | H5 | 120.4° | 120.0° |
| C9 | C14 | C13 | 122.1° | 120.0° |
| C9 | C14 | H1 | 118.9° | 120.0° |
| C11 | C12 | C13 | 117.4° | 119.9° |
| C11 | C12 | C24 | 120.0° | 120.1° |
| C12 | C11 | H5 | 120.4° | 120.0° |
| C14 | C13 | C12 | 122.2° | 120.0° |
| C13 | C14 | H1 | 118.9° | 120.0° |
| C14 | C13 | H6 | 118.9° | 120.0° |
| C13 | C12 | C24 | 122.6° | 120.1° |
| C12 | C13 | H6 | 118.9° | 120.0° |
| C12 | C24 | N3 | 120.3° | 120.0° |
| C12 | C24 | O7 | 119.5° | 120.0° |
| N3 | C24 | O7 | 120.1° | 120.1° |
| C24 | N3 | C25 | 122.3° | 120.0° |
| C24 | N3 | H7 | 118.9° | 120.0° |
| N3 | C25 | C32 | 113.1° | 109.5° |
| C25 | N3 | H7 | 118.8° | 120.0° |
| N3 | C25 | H8 | 108.6° | 109.4° |
| N3 | C25 | H9 | 108.6° | 109.5° |
| C25 | C32 | O1M2 | 108.6° | 109.5° |
| C32 | C25 | H8 | 108.5° | 109.5° |
| C32 | C25 | H9 | 108.6° | 109.5° |
| C25 | C32 | H10 | 109.7° | 109.5° |
| C25 | C32 | H11 | 109.7° | 109.5° |
| C32 | O1M2 | C1M2 | 112.6° | 114.0° |
| O1M2 | C32 | H10 | 109.7° | 109.5° |
| O1M2 | C32 | H11 | 109.7° | 109.4° |
| O1M2 | C1M2 | C2M2 | 108.9° | 109.5° |
| O1M2 | C1M2 | O5M2 | 112.7° | 109.5° |
| O1M2 | C1M2 | H12 | 108.6° | 109.5° |
| O3M2 | C3M2 | C2M2 | 111.4° | 109.5° |
| O3M2 | C3M2 | C4M2 | 112.8° | 109.5° |
| O3M2 | C3M2 | H19 | 107.7° | 109.5° |
| C3M2 | O3M2 | H20 | 109.5° | 114.1° |
| C2M2 | C3M2 | C4M2 | 111.3° | 109.1° |
| C3M2 | C2M2 | C1M2 | 110.0° | 109.1° |
| C3M2 | C2M2 | O2M2 | 111.0° | 109.5° |
| C2M2 | C3M2 | H19 | 106.7° | 109.5° |
| C3M2 | C2M2 | H21 | 109.3° | 109.6° |
| C3M2 | C4M2 | O4M2 | 107.1° | 109.6° |
| C3M2 | C4M2 | C5M2 | 113.7° | 109.1° |
| C3M2 | C4M2 | H17 | 109.3° | 109.5° |
| C4M2 | C3M2 | H19 | 106.5° | 109.6° |
| C2M2 | C1M2 | O5M2 | 110.4° | 109.4° |
| C1M2 | C2M2 | O2M2 | 105.9° | 109.5° |
| C2M2 | C1M2 | H12 | 107.7° | 109.5° |
| C1M2 | C2M2 | H21 | 109.6° | 109.5° |
| C1M2 | O5M2 | C5M2 | 113.5° | 114.1° |
| O5M2 | C1M2 | H12 | 108.4° | 109.5° |
| O4M2 | C4M2 | C5M2 | 106.1° | 109.6° |
| O4M2 | C4M2 | H17 | 111.2° | 109.5° |
| C4M2 | O4M2 | H18 | 109.5° | 114.0° |
| O2M2 | C2M2 | H21 | 110.9° | 109.6° |
| C2M2 | O2M2 | H22 | 109.5° | 113.9° |
| C4M2 | C5M2 | O5M2 | 108.9° | 109.4° |
| C4M2 | C5M2 | C6M2 | 114.4° | 109.5° |
| C4M2 | C5M2 | H13 | 106.8° | 109.4° |
| C5M2 | C4M2 | H17 | 109.4° | 109.5° |
| O5M2 | C5M2 | C6M2 | 111.1° | 109.5° |
| O5M2 | C5M2 | H13 | 108.3° | 109.5° |
| C5M2 | C6M2 | O6M2 | 111.2° | 109.5° |
| C6M2 | C5M2 | H13 | 107.1° | 109.5° |
| C5M2 | C6M2 | H14 | 109.0° | 109.5° |
| C5M2 | C6M2 | H15 | 109.0° | 109.5° |
| O6M2 | C6M2 | H14 | 109.0° | 109.5° |
| O6M2 | C6M2 | H15 | 109.0° | 109.5° |
| C6M2 | O6M2 | H16 | 109.5° | 114.0° |
| H2 | C16 | H3 | 109.5° | 109.5° |
| H8 | C25 | H9 | 109.5° | 109.5° |
| H10 | C32 | H11 | 109.5° | 109.4° |
| H14 | C6M2 | H15 | 109.5° | 109.4° |
| H31 | C23 | H32 | 109.5° | 109.4° |
| H35 | C6M | H36 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O6M | C6M | C5M | H35 | 119.9° | 120.0° |
| O6M | C6M | C5M | H36 | 119.9° | 120.0° |
| O6M | C6M | C5M | O5M | 52.0° | 65.0° |
| O6M | C6M | C5M | C4M | 72.9° | 175.0° |
| O6M | C6M | C5M | H34 | 168.8° | 55.0° |
| O6M | C6M | H35 | H36 | 120.4° | 119.9° |
| C6M | C5M | O5M | C4M | 128.2° | 120.0° |
| C6M | C5M | O5M | H34 | 116.4° | 120.1° |
| C6M | C5M | O5M | C1M | 171.5° | 178.9° |
| C6M | C5M | C4M | H34 | 118.6° | 120.0° |
| C6M | C5M | C4M | O4M | 68.6° | 62.5° |
| C6M | C5M | C4M | C3M | 172.4° | 177.6° |
| C5M | C6M | H35 | H36 | 120.4° | 120.0° |
| C5M | C6M | O6M | H37 | 180.0° | 180.0° |
| C6M | C5M | C4M | H38 | 51.4° | 57.6° |
| O2M | C2M | C1M | O5M | 62.5° | 62.3° |
| O2M | C2M | C3M | C4M | 66.5° | 63.0° |
| O2M | C2M | C3M | O3M | 59.2° | 57.0° |
| O2M | C2M | C3M | C1M | 114.8° | 119.9° |
| O2M | C2M | C3M | H42 | 123.3° | 120.2° |
| O2M | C2M | C1M | H42 | 118.1° | 120.2° |
| O2M | C2M | C1M | O1M | 173.6° | 177.8° |
| O2M | C2M | C1M | H33 | 54.5° | 57.7° |
| O2M | C2M | C3M | H40 | 177.0° | 177.2° |
| O5M | C5M | C4M | H34 | 116.1° | 120.0° |
| O5M | C5M | C4M | O4M | 166.1° | 177.5° |
| O5M | C5M | C4M | C3M | 47.1° | 57.6° |
| C5M | O5M | C1M | C2M | 66.2° | 61.2° |
| C5M | O5M | C1M | O1M | 55.0° | 58.8° |
| C5M | O5M | C1M | H33 | 177.1° | 178.9° |
| O5M | C5M | C6M | H35 | 171.9° | 174.9° |
| O5M | C5M | C6M | H36 | 67.9° | 54.9° |
| O5M | C5M | C4M | H38 | 74.0° | 62.4° |
| C1M | O5M | C5M | C4M | 60.2° | 61.2° |
| O5M | C1M | C2M | C3M | 57.9° | 57.6° |
| O5M | C1M | C2M | O1M | 123.9° | 119.9° |
| O5M | C1M | C2M | H33 | 117.1° | 120.0° |
| O5M | C1M | O1M | H33 | 121.7° | 120.1° |
| O5M | C1M | O1M | C23 | 76.4° | 70.1° |
| C1M | O5M | C5M | H34 | 55.1° | 58.8° |
| O5M | C1M | C2M | H42 | 179.4° | 177.5° |
| C5M | C4M | O4M | C3M | 123.5° | 119.7° |
| C5M | C4M | O4M | H38 | 118.8° | 120.1° |
| C5M | C4M | C3M | H38 | 120.9° | 120.0° |
| C5M | C4M | C3M | O3M | 168.7° | 176.9° |
| C5M | C4M | C3M | C2M | 42.2° | 57.0° |
| C4M | C5M | C6M | H35 | 46.9° | 55.0° |
| C4M | C5M | C6M | H36 | 167.2° | 65.0° |
| C5M | C4M | O4M | H39 | 180.0° | 179.9° |
| C5M | C4M | C3M | H40 | 74.0° | 62.9° |
| O4M | C4M | C3M | H38 | 118.7° | 120.1° |
| O4M | C4M | C3M | O3M | 70.8° | 63.2° |
| O4M | C4M | C3M | C2M | 162.7° | 176.9° |
| O4M | C4M | C5M | H34 | 50.0° | 57.5° |
| O4M | C4M | C3M | H40 | 46.4° | 57.1° |
| C4M | C3M | O3M | C2M | 126.4° | 119.6° |
| C4M | C3M | O3M | H40 | 116.6° | 120.3° |
| C4M | C3M | C2M | H40 | 116.4° | 119.8° |
| C4M | C3M | C2M | C1M | 48.3° | 56.9° |
| C3M | C4M | C5M | H34 | 69.0° | 62.4° |
| C3M | C4M | O4M | H39 | 56.5° | 60.3° |
| C4M | C3M | O3M | H41 | 180.0° | 179.6° |
| C4M | C3M | C2M | H42 | 170.2° | 176.8° |
| O3M | C3M | C2M | H40 | 117.8° | 120.2° |
| O3M | C3M | C2M | C1M | 174.0° | 176.9° |
| O3M | C3M | C4M | H38 | 47.9° | 56.9° |
| O3M | C3M | C2M | H42 | 64.1° | 63.2° |
| C3M | C2M | C1M | H42 | 121.5° | 119.9° |
| C3M | C2M | C1M | O1M | 66.0° | 62.3° |
| C3M | C2M | C1M | H33 | 174.9° | 177.6° |
| C2M | C3M | C4M | H38 | 78.6° | 63.0° |
| C2M | C3M | O3M | H41 | 53.7° | 60.0° |
| C3M | C2M | O2M | H43 | 180.0° | 180.0° |
| C2M | C1M | O1M | H33 | 118.3° | 120.0° |
| C2M | C1M | O1M | C23 | 163.6° | 170.0° |
| C1M | C2M | C3M | H40 | 68.1° | 62.9° |
| C1M | C2M | O2M | H43 | 59.4° | 60.3° |
| C1M | O1M | C23 | C16 | 146.7° | 180.0° |
| C1M | O1M | C23 | H31 | 26.4° | 59.9° |
| C1M | O1M | C23 | H32 | 93.0° | 60.0° |
| O1M | C1M | C2M | H42 | 55.5° | 57.6° |
| O1M | C23 | C16 | H31 | 120.3° | 120.1° |
| O1M | C23 | C16 | H32 | 120.3° | 119.9° |
| O1M | C23 | C16 | N2 | 63.7° | 65.0° |
| O1M | C23 | C16 | H2 | 57.0° | 55.0° |
| O1M | C23 | C16 | H3 | 175.6° | 175.0° |
| O1M | C23 | H31 | H32 | 119.1° | 119.9° |
| C23 | O1M | C1M | H33 | 45.3° | 50.0° |
| C23 | C16 | N2 | H2 | 120.8° | 120.0° |
| C23 | C16 | N2 | H3 | 120.7° | 120.0° |
| C23 | C16 | N2 | C15 | 155.4° | 180.0° |
| C23 | C16 | H2 | H3 | 117.7° | 120.0° |
| C23 | C16 | N2 | H30 | 24.6° | 0.0° |
| C16 | C23 | H31 | H32 | 119.1° | 120.0° |
| C16 | N2 | C15 | H30 | 180.0° | 179.9° |
| C16 | N2 | C15 | O | 1.4° | 0.0° |
| C16 | N2 | C15 | C | 177.1° | 180.0° |
| N2 | C16 | H2 | H3 | 117.6° | 120.0° |
| N2 | C16 | C23 | H31 | 176.0° | 175.0° |
| N2 | C16 | C23 | H32 | 56.6° | 55.0° |
| N2 | C15 | O | C | 176.0° | 179.9° |
| N2 | C15 | C | C1 | 4.8° | 179.9° |
| N2 | C15 | C | C5 | 177.0° | 0.2° |
| C15 | N2 | C16 | H2 | 34.6° | 60.0° |
| C15 | N2 | C16 | H3 | 83.9° | 60.0° |
| O | C15 | C | C1 | 170.9° | 0.0° |
| O | C15 | C | C5 | 1.3° | 179.7° |
| O | C15 | N2 | H30 | 178.6° | 180.0° |
| C15 | C | C1 | C5 | 172.5° | 179.7° |
| C15 | C | C1 | C2 | 176.9° | 180.0° |
| C15 | C | C5 | C4 | 174.1° | 179.7° |
| C15 | C | C1 | H26 | 3.1° | 0.0° |
| C15 | C | C5 | H29 | 5.9° | 0.0° |
| C | C15 | N2 | H30 | 2.9° | 0.1° |
| C | C1 | C2 | H26 | 180.0° | 179.9° |
| C1 | C | C5 | C4 | 1.5° | 0.6° |
| C | C1 | C2 | C3 | 4.2° | 0.0° |
| C | C1 | C2 | H27 | 175.9° | 179.9° |
| C1 | C | C5 | H29 | 178.5° | 179.7° |
| C5 | C | C1 | C2 | 4.3° | 0.3° |
| C | C5 | C4 | H29 | 180.0° | 179.7° |
| C | C5 | C4 | C3 | 2.3° | 0.6° |
| C5 | C | C1 | H26 | 175.7° | 179.7° |
| C | C5 | C4 | H28 | 177.7° | 179.7° |
| C1 | C2 | C3 | H27 | 180.0° | 179.9° |
| C1 | C2 | C3 | C4 | 0.5° | 0.0° |
| C1 | C2 | C3 | NE2 | 178.2° | 180.0° |
| C5 | C4 | C3 | C2 | 2.6° | 0.3° |
| C5 | C4 | C3 | H28 | 180.0° | 179.7° |
| C5 | C4 | C3 | NE2 | 178.8° | 179.7° |
| C2 | C3 | C4 | NE2 | 178.6° | 180.0° |
| C2 | C3 | NE2 | CE1 | 7.1° | 179.9° |
| C2 | C3 | NE2 | CD2 | 173.8° | 0.3° |
| C3 | C2 | C1 | H26 | 175.8° | 180.0° |
| C2 | C3 | C4 | H28 | 177.4° | 180.0° |
| C4 | C3 | NE2 | CE1 | 171.3° | 0.0° |
| C4 | C3 | NE2 | CD2 | 7.7° | 179.7° |
| C4 | C3 | C2 | H27 | 179.5° | 180.0° |
| C3 | C4 | C5 | H29 | 177.7° | 179.7° |
| C3 | NE2 | CE1 | CD2 | 179.2° | 179.7° |
| C3 | NE2 | CE1 | ND1 | 178.5° | 180.0° |
| C3 | NE2 | CD2 | CG | 179.0° | 179.8° |
| C3 | NE2 | CD2 | H24 | 1.0° | 0.2° |
| C3 | NE2 | CE1 | H25 | 1.5° | 0.3° |
| NE2 | C3 | C2 | H27 | 1.8° | 0.1° |
| NE2 | C3 | C4 | H28 | 1.2° | 0.0° |
| NE2 | CE1 | ND1 | H25 | 180.0° | 179.7° |
| CE1 | NE2 | CD2 | CG | 2.0° | 0.0° |
| NE2 | CE1 | ND1 | CG | 1.7° | 0.4° |
| NE2 | CE1 | ND1 | C9 | 179.5° | 180.0° |
| CE1 | NE2 | CD2 | H24 | 178.0° | 180.0° |
| CD2 | NE2 | CE1 | ND1 | 2.3° | 0.3° |
| NE2 | CD2 | CG | H24 | 180.0° | 180.0° |
| NE2 | CD2 | CG | ND1 | 0.8° | 0.2° |
| NE2 | CD2 | CG | H23 | 179.2° | 180.0° |
| CD2 | NE2 | CE1 | H25 | 177.7° | 180.0° |
| CE1 | ND1 | CG | CD2 | 0.5° | 0.4° |
| CE1 | ND1 | CG | C9 | 177.3° | 179.6° |
| CE1 | ND1 | C9 | C10 | 36.1° | 0.6° |
| CE1 | ND1 | C9 | C14 | 143.7° | 180.0° |
| CE1 | ND1 | CG | H23 | 179.4° | 179.9° |
| CD2 | CG | ND1 | H23 | 180.0° | 179.8° |
| CD2 | CG | ND1 | C9 | 177.8° | 180.0° |
| CG | ND1 | C9 | C10 | 141.1° | 179.0° |
| CG | ND1 | C9 | C14 | 39.1° | 0.4° |
| ND1 | CG | CD2 | H24 | 179.2° | 179.8° |
| CG | ND1 | CE1 | H25 | 178.2° | 179.9° |
| ND1 | C9 | C10 | C14 | 179.8° | 179.4° |
| ND1 | C9 | C10 | C11 | 178.4° | 179.7° |
| ND1 | C9 | C14 | C13 | 177.6° | 179.9° |
| ND1 | C9 | C14 | H1 | 2.4° | 0.0° |
| ND1 | C9 | C10 | H4 | 1.6° | 0.6° |
| C9 | ND1 | CG | H23 | 2.1° | 0.2° |
| C9 | ND1 | CE1 | H25 | 0.5° | 0.2° |
| C9 | C10 | C11 | H4 | 180.0° | 179.2° |
| C9 | C10 | C11 | C12 | 4.2° | 0.6° |
| C10 | C9 | C14 | C13 | 2.6° | 0.5° |
| C10 | C9 | C14 | H1 | 177.4° | 179.4° |
| C9 | C10 | C11 | H5 | 175.7° | 179.5° |
| C11 | C10 | C9 | C14 | 1.4° | 0.8° |
| C10 | C11 | C12 | H5 | 180.0° | 179.9° |
| C10 | C11 | C12 | C13 | 2.9° | 0.0° |
| C10 | C11 | C12 | C24 | 176.8° | 179.7° |
| C9 | C14 | C13 | H1 | 180.0° | 179.9° |
| C9 | C14 | C13 | C12 | 3.9° | 0.1° |
| C14 | C9 | C10 | H4 | 178.6° | 180.0° |
| C9 | C14 | C13 | H6 | 176.1° | 180.0° |
| C11 | C12 | C13 | C14 | 0.9° | 0.3° |
| C11 | C12 | C13 | C24 | 179.7° | 179.7° |
| C11 | C12 | C24 | N3 | 147.0° | 0.2° |
| C11 | C12 | C24 | O7 | 35.3° | 179.7° |
| C12 | C11 | C10 | H4 | 175.8° | 179.7° |
| C11 | C12 | C13 | H6 | 179.1° | 179.8° |
| C14 | C13 | C12 | H6 | 180.0° | 179.9° |
| C14 | C13 | C12 | C24 | 179.4° | 180.0° |
| C13 | C12 | C24 | N3 | 33.3° | 180.0° |
| C13 | C12 | C24 | O7 | 144.4° | 0.0° |
| C12 | C13 | C14 | H1 | 176.1° | 180.0° |
| C13 | C12 | C11 | H5 | 177.1° | 180.0° |
| C12 | C24 | N3 | O7 | 177.6° | 180.0° |
| C12 | C24 | N3 | C25 | 177.7° | 180.0° |
| C24 | C12 | C11 | H5 | 3.2° | 0.2° |
| C24 | C12 | C13 | H6 | 0.6° | 0.1° |
| C12 | C24 | N3 | H7 | 2.3° | 0.0° |
| C24 | N3 | C25 | H7 | 180.0° | 180.0° |
| C24 | N3 | C25 | C32 | 92.7° | 180.0° |
| C24 | N3 | C25 | H8 | 27.9° | 60.0° |
| C24 | N3 | C25 | H9 | 146.8° | 60.0° |
| O7 | C24 | N3 | C25 | 0.0° | 0.0° |
| O7 | C24 | N3 | H7 | 180.0° | 180.0° |
| N3 | C25 | C32 | H8 | 120.6° | 119.9° |
| N3 | C25 | C32 | H9 | 120.6° | 120.0° |
| N3 | C25 | C32 | O1M2 | 84.1° | 65.0° |
| N3 | C25 | H8 | H9 | 118.4° | 120.0° |
| N3 | C25 | C32 | H10 | 35.8° | 175.0° |
| N3 | C25 | C32 | H11 | 156.0° | 55.0° |
| C25 | C32 | O1M2 | H10 | 119.9° | 120.0° |
| C25 | C32 | O1M2 | H11 | 119.9° | 120.0° |
| C25 | C32 | O1M2 | C1M2 | 173.7° | 180.0° |
| C32 | C25 | N3 | H7 | 87.3° | 0.0° |
| C32 | C25 | H8 | H9 | 118.3° | 120.1° |
| C25 | C32 | H10 | H11 | 120.4° | 120.0° |
| C32 | O1M2 | C1M2 | C2M2 | 171.4° | 170.0° |
| C32 | O1M2 | C1M2 | O5M2 | 65.6° | 70.0° |
| O1M2 | C32 | C25 | H8 | 155.4° | 55.0° |
| O1M2 | C32 | C25 | H9 | 36.5° | 175.0° |
| O1M2 | C32 | H10 | H11 | 120.4° | 119.9° |
| C32 | O1M2 | C1M2 | H12 | 54.5° | 50.0° |
| O1M2 | C1M2 | C2M2 | C3M2 | 67.0° | 62.4° |
| O1M2 | C1M2 | C2M2 | O5M2 | 124.3° | 120.0° |
| O1M2 | C1M2 | C2M2 | H12 | 117.6° | 120.0° |
| O1M2 | C1M2 | O5M2 | H12 | 120.3° | 120.0° |
| O1M2 | C1M2 | C2M2 | O2M2 | 172.9° | 177.7° |
| O1M2 | C1M2 | O5M2 | C5M2 | 56.9° | 58.8° |
| C1M2 | O1M2 | C32 | H10 | 53.9° | 60.0° |
| C1M2 | O1M2 | C32 | H11 | 66.4° | 60.0° |
| O1M2 | C1M2 | C2M2 | H21 | 53.3° | 57.5° |
| O3M2 | C3M2 | C2M2 | C4M2 | 126.8° | 119.9° |
| O3M2 | C3M2 | C2M2 | H19 | 117.3° | 120.1° |
| O3M2 | C3M2 | C4M2 | H19 | 117.9° | 120.2° |
| O3M2 | C3M2 | C2M2 | C1M2 | 175.9° | 176.9° |
| O3M2 | C3M2 | C4M2 | O4M2 | 70.4° | 63.2° |
| O3M2 | C3M2 | C2M2 | O2M2 | 59.0° | 57.0° |
| O3M2 | C3M2 | C4M2 | C5M2 | 172.7° | 176.9° |
| O3M2 | C3M2 | C4M2 | H17 | 50.2° | 57.0° |
| O3M2 | C3M2 | C2M2 | H21 | 63.7° | 63.2° |
| C2M2 | C3M2 | C4M2 | H19 | 115.9° | 120.0° |
| C3M2 | C2M2 | C1M2 | O2M2 | 120.1° | 119.9° |
| C3M2 | C2M2 | C1M2 | H21 | 120.2° | 119.9° |
| C3M2 | C2M2 | C1M2 | O5M2 | 57.3° | 57.6° |
| C2M2 | C3M2 | C4M2 | O4M2 | 163.5° | 177.0° |
| C3M2 | C2M2 | O2M2 | H21 | 121.8° | 120.2° |
| C2M2 | C3M2 | C4M2 | C5M2 | 46.6° | 57.0° |
| C3M2 | C2M2 | C1M2 | H12 | 175.4° | 177.6° |
| C2M2 | C3M2 | C4M2 | H17 | 75.9° | 62.8° |
| C2M2 | C3M2 | O3M2 | H20 | 180.0° | 60.0° |
| C3M2 | C2M2 | O2M2 | H22 | 180.0° | 179.7° |
| C4M2 | C3M2 | C2M2 | C1M2 | 49.0° | 57.0° |
| C3M2 | C4M2 | O4M2 | C5M2 | 121.7° | 119.7° |
| C3M2 | C4M2 | O4M2 | H17 | 119.4° | 120.2° |
| C4M2 | C3M2 | C2M2 | O2M2 | 67.9° | 62.9° |
| C3M2 | C4M2 | C5M2 | H17 | 122.5° | 119.9° |
| C3M2 | C4M2 | C5M2 | O5M2 | 50.5° | 57.6° |
| C3M2 | C4M2 | C5M2 | C6M2 | 175.4° | 177.6° |
| C3M2 | C4M2 | C5M2 | H13 | 66.3° | 62.4° |
| C3M2 | C4M2 | O4M2 | H18 | 180.0° | 60.0° |
| C4M2 | C3M2 | O3M2 | H20 | 54.0° | 179.6° |
| C4M2 | C3M2 | C2M2 | H21 | 169.4° | 176.9° |
| C2M2 | C1M2 | O5M2 | H12 | 117.7° | 119.9° |
| C1M2 | C2M2 | O2M2 | H21 | 118.8° | 120.2° |
| C2M2 | C1M2 | O5M2 | C5M2 | 65.2° | 61.2° |
| C1M2 | C2M2 | C3M2 | H19 | 66.8° | 63.0° |
| C1M2 | C2M2 | O2M2 | H22 | 60.6° | 60.1° |
| O5M2 | C1M2 | C2M2 | O2M2 | 62.8° | 62.2° |
| C1M2 | O5M2 | C5M2 | C4M2 | 59.8° | 61.2° |
| C1M2 | O5M2 | C5M2 | C6M2 | 173.3° | 178.9° |
| C1M2 | O5M2 | C5M2 | H13 | 56.1° | 58.8° |
| O5M2 | C1M2 | C2M2 | H21 | 177.5° | 177.6° |
| O4M2 | C4M2 | C5M2 | H17 | 120.1° | 120.2° |
| O4M2 | C4M2 | C5M2 | O5M2 | 167.9° | 177.6° |
| O4M2 | C4M2 | C5M2 | C6M2 | 67.2° | 62.5° |
| O4M2 | C4M2 | C5M2 | H13 | 51.2° | 57.6° |
| O4M2 | C4M2 | C3M2 | H19 | 47.6° | 57.0° |
| O2M2 | C2M2 | C1M2 | H12 | 55.3° | 57.7° |
| O2M2 | C2M2 | C3M2 | H19 | 176.3° | 177.1° |
| C4M2 | C5M2 | O5M2 | C6M2 | 126.9° | 120.0° |
| C4M2 | C5M2 | O5M2 | H13 | 115.8° | 119.9° |
| C4M2 | C5M2 | C6M2 | H13 | 118.2° | 120.0° |
| C4M2 | C5M2 | C6M2 | O6M2 | 72.3° | 175.0° |
| C4M2 | C5M2 | C6M2 | H14 | 167.4° | 55.0° |
| C4M2 | C5M2 | C6M2 | H15 | 47.9° | 64.9° |
| C5M2 | C4M2 | O4M2 | H18 | 58.3° | 179.7° |
| C5M2 | C4M2 | C3M2 | H19 | 69.3° | 62.9° |
| O5M2 | C5M2 | C6M2 | H13 | 118.0° | 120.1° |
| O5M2 | C5M2 | C6M2 | O6M2 | 51.5° | 65.1° |
| C5M2 | O5M2 | C1M2 | H12 | 177.1° | 178.9° |
| O5M2 | C5M2 | C6M2 | H14 | 68.8° | 174.9° |
| O5M2 | C5M2 | C6M2 | H15 | 171.7° | 55.0° |
| O5M2 | C5M2 | C4M2 | H17 | 72.0° | 62.3° |
| C5M2 | C6M2 | O6M2 | H14 | 120.3° | 120.0° |
| C5M2 | C6M2 | O6M2 | H15 | 120.2° | 120.0° |
| C5M2 | C6M2 | H14 | H15 | 119.2° | 120.0° |
| C5M2 | C6M2 | O6M2 | H16 | 180.0° | 180.0° |
| C6M2 | C5M2 | C4M2 | H17 | 52.9° | 57.7° |
| O6M2 | C6M2 | C5M2 | H13 | 169.5° | 55.0° |
| O6M2 | C6M2 | H14 | H15 | 119.2° | 120.0° |
| H1 | C14 | C13 | H6 | 3.9° | 0.1° |
| H2 | C16 | N2 | H30 | 145.3° | 120.0° |
| H2 | C16 | C23 | H31 | 63.2° | 65.0° |
| H2 | C16 | C23 | H32 | 177.3° | 175.0° |
| H3 | C16 | N2 | H30 | 96.2° | 119.9° |
| H3 | C16 | C23 | H31 | 55.3° | 55.0° |
| H3 | C16 | C23 | H32 | 64.1° | 65.0° |
| H4 | C10 | C11 | H5 | 4.2° | 0.3° |
| H7 | N3 | C25 | H8 | 152.1° | 120.0° |
| H7 | N3 | C25 | H9 | 33.2° | 120.0° |
| H8 | C25 | C32 | H10 | 84.8° | 65.1° |
| H8 | C25 | C32 | H11 | 35.5° | 174.9° |
| H9 | C25 | C32 | H10 | 156.3° | 55.0° |
| H9 | C25 | C32 | H11 | 83.4° | 65.0° |
| H12 | C1M2 | C2M2 | H21 | 64.3° | 62.5° |
| H13 | C5M2 | C6M2 | H14 | 49.2° | 65.0° |
| H13 | C5M2 | C6M2 | H15 | 70.3° | 175.0° |
| H13 | C5M2 | C4M2 | H17 | 171.2° | 177.7° |
| H14 | C6M2 | O6M2 | H16 | 59.8° | 60.0° |
| H15 | C6M2 | O6M2 | H16 | 59.7° | 59.9° |
| H17 | C4M2 | O4M2 | H18 | 60.6° | 60.2° |
| H17 | C4M2 | C3M2 | H19 | 168.2° | 177.2° |
| H19 | C3M2 | O3M2 | H20 | 63.3° | 60.2° |
| H19 | C3M2 | C2M2 | H21 | 53.6° | 56.9° |
| H21 | C2M2 | O2M2 | H22 | 58.2° | 60.1° |
| H23 | CG | CD2 | H24 | 0.8° | 0.0° |
| H26 | C1 | C2 | H27 | 4.2° | 0.0° |
| H28 | C4 | C5 | H29 | 2.3° | 0.0° |
| H33 | C1M | C2M | H42 | 63.6° | 62.5° |
| H34 | C5M | C6M | H35 | 71.3° | 65.0° |
| H34 | C5M | C6M | H36 | 48.9° | 175.0° |
| H34 | C5M | C4M | H38 | 169.9° | 177.6° |
| H35 | C6M | O6M | H37 | 60.2° | 59.9° |
| H36 | C6M | O6M | H37 | 60.1° | 60.0° |
| H38 | C4M | O4M | H39 | 61.2° | 59.8° |
| H38 | C4M | C3M | H40 | 165.1° | 177.2° |
| H40 | C3M | O3M | H41 | 63.3° | 60.1° |
| H40 | C3M | C2M | H42 | 53.7° | 57.0° |
| H42 | C2M | O2M | H43 | 57.8° | 59.8° |
