BPB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C1 | sing | 1.51Å | 1.52Å | |
| C3 | C2 | doub | 1.31Å | 1.40Å | |
| C3 | C4 | sing | 1.51Å | 1.53Å | |
| C5 | C3 | sing | 1.51Å | 1.54Å | |
| C6 | C5 | sing | 1.53Å | 1.52Å | |
| C7 | C6 | sing | 1.53Å | 1.53Å | |
| C8 | C7 | sing | 1.53Å | 1.54Å | |
| C9 | C8 | sing | 1.53Å | 1.54Å | |
| NB | C4B | sing | 1.37Å | 1.38Å | Aromatic |
| NC | C1C | sing | 1.31Å | 1.38Å | Aromatic |
| NC | C4C | doub | 1.33Å | 1.40Å | Aromatic |
| ND | C1D | sing | 1.38Å | 1.37Å | Aromatic |
| C10 | C8 | sing | 1.53Å | 1.54Å | |
| C11 | C10 | sing | 1.53Å | 1.54Å | |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| C13 | C12 | sing | 1.53Å | 1.54Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C15 | C13 | sing | 1.53Å | 1.53Å | |
| C16 | C15 | sing | 1.53Å | 1.52Å | |
| C17 | C16 | sing | 1.53Å | 1.52Å | |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| C19 | C18 | sing | 1.53Å | 1.52Å | |
| C1A | NA | doub | 1.32Å | 1.39Å | Aromatic |
| C1A | CHA | sing | 1.39Å | 1.41Å | Aromatic |
| C1B | NB | sing | 1.38Å | 1.40Å | Aromatic |
| C1B | C2B | doub | 1.40Å | 1.45Å | Aromatic |
| C1C | C2C | sing | 1.52Å | 1.50Å | |
| C1D | CHD | doub | 1.39Å | 1.40Å | Aromatic |
| O1D | CGD | doub | 1.21Å | 1.24Å | |
| C20 | C18 | sing | 1.53Å | 1.52Å | |
| C2A | C1A | sing | 1.51Å | 1.51Å | |
| C2A | CAA | sing | 1.53Å | 1.53Å | |
| O2A | C1 | sing | 1.45Å | 1.46Å | |
| O2A | CGA | sing | 1.34Å | 1.45Å | |
| C2B | C3B | sing | 1.39Å | 1.34Å | Aromatic |
| C2C | CMC | sing | 1.53Å | 1.54Å | |
| C2D | C1D | sing | 1.39Å | 1.45Å | Aromatic |
| C2D | CMD | sing | 1.51Å | 1.49Å | |
| O2D | CGD | sing | 1.34Å | 1.45Å | |
| C3A | C2A | sing | 1.54Å | 1.50Å | |
| C3A | C4A | sing | 1.52Å | 1.52Å | |
| C3B | C4B | doub | 1.43Å | 1.46Å | Aromatic |
| C3B | CAB | sing | 1.46Å | 1.44Å | |
| C3C | C2C | sing | 1.51Å | 1.51Å | |
| C3C | CAC | doub | 1.33Å | 1.40Å | |
| C3D | C2D | doub | 1.40Å | 1.36Å | Aromatic |
| C4A | NA | sing | 1.32Å | 1.39Å | Aromatic |
| C4A | CHB | doub | 1.38Å | 1.40Å | Aromatic |
| C4B | CHC | sing | 1.39Å | 1.40Å | Aromatic |
| C4C | C3C | sing | 1.48Å | 1.42Å | |
| C4D | ND | sing | 1.38Å | 1.38Å | Aromatic |
| C4D | C3D | sing | 1.41Å | 1.42Å | Aromatic |
| CAB | CBB | sing | 1.51Å | 1.50Å | |
| CAB | OBB | doub | 1.21Å | 1.23Å | |
| CAC | CBC | sing | 1.51Å | 1.53Å | |
| CAD | C3D | sing | 1.47Å | 1.45Å | |
| CBA | CAA | sing | 1.53Å | 1.51Å | |
| CBA | CGA | sing | 1.51Å | 1.52Å | |
| CBD | CAD | sing | 1.51Å | 1.54Å | |
| CBD | CHA | sing | 1.51Å | 1.53Å | |
| OBD | CAD | doub | 1.21Å | 1.22Å | |
| CED | O2D | sing | 1.45Å | 1.39Å | |
| CGA | O1A | doub | 1.21Å | 1.23Å | |
| CGD | CBD | sing | 1.51Å | 1.53Å | |
| CHA | C4D | doub | 1.40Å | 1.41Å | Aromatic |
| CHB | C1B | sing | 1.40Å | 1.41Å | Aromatic |
| CHC | C1C | doub | 1.38Å | 1.38Å | Aromatic |
| CHD | C4C | sing | 1.40Å | 1.41Å | Aromatic |
| CMA | C3A | sing | 1.53Å | 1.54Å | |
| CMB | C2B | sing | 1.51Å | 1.51Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| C4 | H4B | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H5A | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C9 | H9B | sing | 1.09Å | 1.10Å | |
| NB | H171 | sing | 0.97Å | 1.00Å | |
| ND | H181 | sing | 0.97Å | 1.00Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C14 | H14B | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C19 | H19B | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C20 | H20B | sing | 1.09Å | 1.10Å | |
| C2A | H42 | sing | 1.09Å | 1.10Å | |
| C2C | H43 | sing | 1.09Å | 1.10Å | |
| C3A | H44 | sing | 1.09Å | 1.10Å | |
| CAA | HAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAA | sing | 1.09Å | 1.10Å | |
| CAC | HAC | sing | 1.08Å | 1.08Å | |
| CBA | HBA | sing | 1.09Å | 1.10Å | |
| CBA | HBAA | sing | 1.09Å | 1.10Å | |
| CBB | HBB | sing | 1.09Å | 1.10Å | |
| CBB | HBBA | sing | 1.09Å | 1.10Å | |
| CBB | HBBB | sing | 1.09Å | 1.10Å | |
| CBC | HBC | sing | 1.09Å | 1.10Å | |
| CBC | HBCA | sing | 1.09Å | 1.10Å | |
| CBC | H55 | sing | 1.09Å | 1.10Å | |
| CBD | HBD | sing | 1.09Å | 1.10Å | |
| CED | HED | sing | 1.09Å | 1.10Å | |
| CED | HEDA | sing | 1.09Å | 1.10Å | |
| CED | HEDB | sing | 1.09Å | 1.10Å | |
| CHB | HHB | sing | 1.09Å | 1.08Å | |
| CHC | HHC | sing | 1.10Å | 1.08Å | |
| CHD | HHD | sing | 1.08Å | 1.08Å | |
| CMA | HMA | sing | 1.09Å | 1.10Å | |
| CMA | HMAA | sing | 1.09Å | 1.10Å | |
| CMA | HMAB | sing | 1.09Å | 1.10Å | |
| CMB | HMB | sing | 1.09Å | 1.10Å | |
| CMB | HMBA | sing | 1.09Å | 1.10Å | |
| CMB | HMBB | sing | 1.09Å | 1.10Å | |
| CMC | HMC | sing | 1.09Å | 1.10Å | |
| CMC | HMCA | sing | 1.09Å | 1.10Å | |
| CMC | HMCB | sing | 1.09Å | 1.10Å | |
| CMD | HMD | sing | 1.09Å | 1.10Å | |
| CMD | HMDA | sing | 1.09Å | 1.10Å | |
| CMD | HMDB | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C3 | 134.1° | 120.0° |
| C2 | C1 | O2A | 108.1° | 109.4° |
| C2 | C1 | H1 | 109.8° | 109.5° |
| C2 | C1 | H1A | 109.8° | 109.5° |
| C1 | C2 | H2 | 113.0° | 120.0° |
| C2 | C3 | C4 | 122.2° | 120.0° |
| C2 | C3 | C5 | 124.0° | 120.0° |
| C3 | C2 | H2 | 113.0° | 120.0° |
| C4 | C3 | C5 | 113.8° | 120.0° |
| C3 | C4 | H4 | 109.5° | 109.5° |
| C3 | C4 | H4A | 109.4° | 109.5° |
| C3 | C4 | H4B | 109.5° | 109.5° |
| C3 | C5 | C6 | 121.5° | 109.5° |
| C3 | C5 | H5 | 106.4° | 109.5° |
| C3 | C5 | H5A | 106.4° | 109.5° |
| C5 | C6 | C7 | 111.9° | 109.5° |
| C6 | C5 | H5 | 106.4° | 109.4° |
| C6 | C5 | H5A | 106.4° | 109.5° |
| C5 | C6 | H6 | 108.9° | 109.5° |
| C5 | C6 | H6A | 108.9° | 109.5° |
| C6 | C7 | C8 | 114.8° | 109.5° |
| C7 | C6 | H6 | 108.9° | 109.5° |
| C7 | C6 | H6A | 108.9° | 109.5° |
| C6 | C7 | H7 | 108.1° | 109.5° |
| C6 | C7 | H7A | 108.1° | 109.5° |
| C7 | C8 | C9 | 111.4° | 109.5° |
| C7 | C8 | C10 | 120.8° | 109.5° |
| C8 | C7 | H7 | 108.1° | 109.4° |
| C8 | C7 | H7A | 108.1° | 109.5° |
| C7 | C8 | H8 | 103.6° | 109.5° |
| C9 | C8 | C10 | 111.4° | 109.4° |
| C9 | C8 | H8 | 103.7° | 109.5° |
| C8 | C9 | H9 | 109.5° | 109.5° |
| C8 | C9 | H9A | 109.5° | 109.5° |
| C8 | C9 | H9B | 109.5° | 109.5° |
| C4B | NB | C1B | 106.4° | 109.2° |
| NB | C4B | C3B | 109.3° | 107.5° |
| NB | C4B | CHC | 125.4° | 130.5° |
| C4B | NB | H171 | 126.8° | 125.4° |
| C1C | NC | C4C | 109.1° | 114.8° |
| NC | C1C | C2C | 108.1° | 108.2° |
| NC | C1C | CHC | 125.7° | 129.4° |
| NC | C4C | C3C | 112.3° | 109.7° |
| NC | C4C | CHD | 121.4° | 126.3° |
| ND | C1D | CHD | 123.9° | 125.3° |
| ND | C1D | C2D | 109.5° | 108.5° |
| C1D | ND | C4D | 105.9° | 108.6° |
| C1D | ND | H181 | 127.0° | 125.7° |
| C8 | C10 | C11 | 115.4° | 109.5° |
| C10 | C8 | H8 | 103.7° | 109.5° |
| C8 | C10 | H10 | 108.0° | 109.4° |
| C8 | C10 | H10A | 108.0° | 109.5° |
| C10 | C11 | C12 | 112.0° | 109.5° |
| C11 | C10 | H10 | 107.9° | 109.5° |
| C11 | C10 | H10A | 107.9° | 109.5° |
| C10 | C11 | H11 | 108.8° | 109.5° |
| C10 | C11 | H11A | 108.9° | 109.5° |
| C11 | C12 | C13 | 114.8° | 109.5° |
| C12 | C11 | H11 | 108.9° | 109.4° |
| C12 | C11 | H11A | 108.8° | 109.4° |
| C11 | C12 | H12 | 108.1° | 109.5° |
| C11 | C12 | H12A | 108.1° | 109.5° |
| C12 | C13 | C14 | 111.8° | 109.5° |
| C12 | C13 | C15 | 117.8° | 109.4° |
| C13 | C12 | H12 | 108.1° | 109.5° |
| C13 | C12 | H12A | 108.1° | 109.5° |
| C12 | C13 | H13 | 104.6° | 109.5° |
| C14 | C13 | C15 | 111.8° | 109.5° |
| C14 | C13 | H13 | 104.7° | 109.5° |
| C13 | C14 | H14 | 109.5° | 109.5° |
| C13 | C14 | H14A | 109.5° | 109.5° |
| C13 | C14 | H14B | 109.5° | 109.4° |
| C13 | C15 | C16 | 114.0° | 109.4° |
| C15 | C13 | H13 | 104.6° | 109.4° |
| C13 | C15 | H15 | 108.3° | 109.5° |
| C13 | C15 | H15A | 108.3° | 109.5° |
| C15 | C16 | C17 | 111.4° | 109.4° |
| C16 | C15 | H15 | 108.3° | 109.5° |
| C16 | C15 | H15A | 108.3° | 109.5° |
| C15 | C16 | H16 | 109.0° | 109.5° |
| C15 | C16 | H16A | 109.0° | 109.5° |
| C16 | C17 | C18 | 114.3° | 109.5° |
| C17 | C16 | H16 | 109.0° | 109.4° |
| C17 | C16 | H16A | 109.0° | 109.4° |
| C16 | C17 | H17 | 108.3° | 109.5° |
| C16 | C17 | H17A | 108.3° | 109.5° |
| C17 | C18 | C19 | 111.1° | 109.4° |
| C17 | C18 | C20 | 110.9° | 109.4° |
| C18 | C17 | H17 | 108.2° | 109.5° |
| C18 | C17 | H17A | 108.3° | 109.5° |
| C17 | C18 | H18 | 107.8° | 109.5° |
| C19 | C18 | C20 | 111.0° | 109.5° |
| C19 | C18 | H18 | 107.9° | 109.5° |
| C18 | C19 | H19 | 109.5° | 109.5° |
| C18 | C19 | H19A | 109.5° | 109.5° |
| C18 | C19 | H19B | 109.5° | 109.4° |
| NA | C1A | CHA | 122.4° | 124.2° |
| NA | C1A | C2A | 109.2° | 109.4° |
| C1A | NA | C4A | 110.7° | 115.4° |
| CHA | C1A | C2A | 128.3° | 126.5° |
| C1A | CHA | CBD | 130.5° | 127.3° |
| C1A | CHA | C4D | 123.4° | 124.3° |
| NB | C1B | C2B | 108.9° | 108.4° |
| NB | C1B | CHB | 126.3° | 128.8° |
| C1B | NB | H171 | 126.8° | 125.4° |
| C1B | C2B | C3B | 107.9° | 107.7° |
| C2B | C1B | CHB | 124.6° | 122.9° |
| C1B | C2B | CMB | 130.9° | 126.2° |
| C1C | C2C | CMC | 112.5° | 110.7° |
| C1C | C2C | C3C | 105.1° | 103.5° |
| C2C | C1C | CHC | 126.2° | 122.4° |
| C1C | C2C | H43 | 109.5° | 110.7° |
| CHD | C1D | C2D | 126.6° | 126.2° |
| C1D | CHD | C4C | 126.2° | 120.5° |
| C1D | CHD | HHD | 116.9° | 120.1° |
| O1D | CGD | O2D | 121.1° | 120.0° |
| O1D | CGD | CBD | 113.7° | 120.0° |
| C20 | C18 | H18 | 108.0° | 109.5° |
| C18 | C20 | H20 | 109.5° | 109.5° |
| C18 | C20 | H20A | 109.5° | 109.5° |
| C18 | C20 | H20B | 109.4° | 109.5° |
| C1A | C2A | CAA | 109.5° | 110.7° |
| C1A | C2A | C3A | 103.9° | 103.1° |
| C1A | C2A | H42 | 110.9° | 110.7° |
| CAA | C2A | C3A | 110.9° | 110.7° |
| C2A | CAA | CBA | 113.3° | 109.4° |
| CAA | C2A | H42 | 110.6° | 110.7° |
| C2A | CAA | HAA | 108.5° | 109.5° |
| C2A | CAA | HAAA | 108.5° | 109.5° |
| C1 | O2A | CGA | 117.5° | 117.0° |
| O2A | C1 | H1 | 109.8° | 109.5° |
| O2A | C1 | H1A | 109.8° | 109.5° |
| O2A | CGA | CBA | 115.7° | 120.0° |
| O2A | CGA | O1A | 123.0° | 120.0° |
| C2B | C3B | C4B | 107.6° | 107.3° |
| C2B | C3B | CAB | 132.4° | 126.3° |
| C3B | C2B | CMB | 121.2° | 126.2° |
| CMC | C2C | C3C | 111.5° | 110.7° |
| CMC | C2C | H43 | 109.0° | 110.5° |
| C2C | CMC | HMC | 109.5° | 109.5° |
| C2C | CMC | HMCA | 109.4° | 109.5° |
| C2C | CMC | HMCB | 109.5° | 109.4° |
| C1D | C2D | CMD | 125.3° | 126.2° |
| C1D | C2D | C3D | 106.5° | 107.7° |
| CMD | C2D | C3D | 128.2° | 126.1° |
| C2D | CMD | HMD | 109.5° | 109.5° |
| C2D | CMD | HMDA | 109.5° | 109.5° |
| C2D | CMD | HMDB | 109.5° | 109.5° |
| CGD | O2D | CED | 126.4° | 117.0° |
| O2D | CGD | CBD | 125.2° | 120.0° |
| C2A | C3A | C4A | 104.2° | 103.0° |
| C2A | C3A | CMA | 110.9° | 110.8° |
| C3A | C2A | H42 | 110.9° | 110.7° |
| C2A | C3A | H44 | 111.9° | 110.7° |
| C3A | C4A | NA | 108.2° | 109.1° |
| C3A | C4A | CHB | 126.2° | 124.2° |
| C4A | C3A | CMA | 106.4° | 110.7° |
| C4A | C3A | H44 | 111.7° | 110.7° |
| C4B | C3B | CAB | 120.0° | 126.4° |
| C3B | C4B | CHC | 125.3° | 122.1° |
| C3B | CAB | CBB | 108.8° | 119.9° |
| C3B | CAB | OBB | 130.4° | 120.0° |
| C2C | C3C | CAC | 129.9° | 128.1° |
| C2C | C3C | C4C | 104.3° | 103.8° |
| C3C | C2C | H43 | 109.3° | 110.6° |
| CAC | C3C | C4C | 125.7° | 128.0° |
| C3C | CAC | CBC | 126.0° | 120.0° |
| C3C | CAC | HAC | 117.0° | 120.0° |
| C2D | C3D | C4D | 107.4° | 107.2° |
| C2D | C3D | CAD | 145.6° | 143.4° |
| NA | C4A | CHB | 125.4° | 126.7° |
| C4A | CHB | C1B | 126.7° | 123.6° |
| C4A | CHB | HHB | 116.7° | 118.3° |
| C4B | CHC | C1C | 128.7° | 127.0° |
| C4B | CHC | HHC | 115.7° | 116.5° |
| C3C | C4C | CHD | 126.3° | 124.0° |
| ND | C4D | C3D | 110.4° | 108.1° |
| ND | C4D | CHA | 135.3° | 141.1° |
| C4D | ND | H181 | 127.0° | 125.7° |
| C4D | C3D | CAD | 107.0° | 109.5° |
| C3D | C4D | CHA | 114.3° | 110.9° |
| CBB | CAB | OBB | 118.1° | 120.0° |
| CAB | CBB | HBB | 109.5° | 109.5° |
| CAB | CBB | HBBA | 109.4° | 109.5° |
| CAB | CBB | HBBB | 109.5° | 109.4° |
| CBC | CAC | HAC | 117.0° | 120.0° |
| CAC | CBC | HBC | 109.5° | 109.4° |
| CAC | CBC | HBCA | 109.5° | 109.5° |
| CAC | CBC | H55 | 109.4° | 109.5° |
| C3D | CAD | CBD | 108.3° | 106.0° |
| C3D | CAD | OBD | 130.6° | 127.0° |
| CAA | CBA | CGA | 113.4° | 109.4° |
| CBA | CAA | HAA | 108.5° | 109.5° |
| CBA | CAA | HAAA | 108.5° | 109.5° |
| CAA | CBA | HBA | 108.5° | 109.5° |
| CAA | CBA | HBAA | 108.5° | 109.5° |
| CBA | CGA | O1A | 121.1° | 120.0° |
| CGA | CBA | HBA | 108.5° | 109.5° |
| CGA | CBA | HBAA | 108.5° | 109.5° |
| CAD | CBD | CHA | 104.1° | 105.1° |
| CBD | CAD | OBD | 120.9° | 127.0° |
| CAD | CBD | CGD | 106.1° | 110.4° |
| CAD | CBD | HBD | 113.3° | 110.3° |
| CHA | CBD | CGD | 105.5° | 110.3° |
| CBD | CHA | C4D | 106.0° | 108.4° |
| CHA | CBD | HBD | 113.5° | 110.3° |
| O2D | CED | HED | 109.5° | 109.5° |
| O2D | CED | HEDA | 109.5° | 109.5° |
| O2D | CED | HEDB | 109.5° | 109.5° |
| CGD | CBD | HBD | 113.5° | 110.3° |
| C1B | CHB | HHB | 116.6° | 118.0° |
| C1C | CHC | HHC | 115.7° | 116.5° |
| C4C | CHD | HHD | 116.9° | 119.4° |
| CMA | C3A | H44 | 111.4° | 110.7° |
| C3A | CMA | HMA | 109.5° | 109.5° |
| C3A | CMA | HMAA | 109.5° | 109.5° |
| C3A | CMA | HMAB | 109.5° | 109.5° |
| C2B | CMB | HMB | 109.5° | 109.5° |
| C2B | CMB | HMBA | 109.5° | 109.5° |
| C2B | CMB | HMBB | 109.5° | 109.5° |
| H1 | C1 | H1A | 109.5° | 109.5° |
| H4 | C4 | H4A | 109.5° | 109.5° |
| H4 | C4 | H4B | 109.4° | 109.4° |
| H4A | C4 | H4B | 109.5° | 109.4° |
| H5 | C5 | H5A | 109.5° | 109.5° |
| H6 | C6 | H6A | 109.5° | 109.5° |
| H7 | C7 | H7A | 109.5° | 109.4° |
| H9 | C9 | H9A | 109.5° | 109.5° |
| H9 | C9 | H9B | 109.5° | 109.4° |
| H9A | C9 | H9B | 109.5° | 109.5° |
| H10 | C10 | H10A | 109.5° | 109.5° |
| H11 | C11 | H11A | 109.4° | 109.5° |
| H12 | C12 | H12A | 109.5° | 109.5° |
| H14 | C14 | H14A | 109.5° | 109.5° |
| H14 | C14 | H14B | 109.5° | 109.4° |
| H14A | C14 | H14B | 109.5° | 109.5° |
| H15 | C15 | H15A | 109.5° | 109.5° |
| H16 | C16 | H16A | 109.5° | 109.5° |
| H17 | C17 | H17A | 109.5° | 109.5° |
| H19 | C19 | H19A | 109.5° | 109.5° |
| H19 | C19 | H19B | 109.5° | 109.5° |
| H19A | C19 | H19B | 109.5° | 109.4° |
| H20 | C20 | H20A | 109.4° | 109.5° |
| H20 | C20 | H20B | 109.5° | 109.5° |
| H20A | C20 | H20B | 109.5° | 109.5° |
| HAA | CAA | HAAA | 109.5° | 109.5° |
| HBA | CBA | HBAA | 109.5° | 109.5° |
| HBB | CBB | HBBA | 109.5° | 109.5° |
| HBB | CBB | HBBB | 109.4° | 109.5° |
| HBBA | CBB | HBBB | 109.5° | 109.4° |
| HBC | CBC | HBCA | 109.5° | 109.5° |
| HBC | CBC | H55 | 109.5° | 109.4° |
| HBCA | CBC | H55 | 109.5° | 109.5° |
| HED | CED | HEDA | 109.5° | 109.4° |
| HED | CED | HEDB | 109.5° | 109.5° |
| HEDA | CED | HEDB | 109.5° | 109.5° |
| HMA | CMA | HMAA | 109.5° | 109.5° |
| HMA | CMA | HMAB | 109.5° | 109.4° |
| HMAA | CMA | HMAB | 109.4° | 109.5° |
| HMB | CMB | HMBA | 109.5° | 109.5° |
| HMB | CMB | HMBB | 109.4° | 109.4° |
| HMBA | CMB | HMBB | 109.5° | 109.5° |
| HMC | CMC | HMCA | 109.5° | 109.4° |
| HMC | CMC | HMCB | 109.5° | 109.5° |
| HMCA | CMC | HMCB | 109.5° | 109.5° |
| HMD | CMD | HMDA | 109.5° | 109.4° |
| HMD | CMD | HMDB | 109.4° | 109.5° |
| HMDA | CMD | HMDB | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C3 | H2 | 180.0° | 180.0° |
| C1 | C2 | C3 | C4 | 0.3° | 5.8° |
| C1 | C2 | C3 | C5 | 178.5° | 174.3° |
| C2 | C1 | O2A | H1 | 119.8° | 120.0° |
| C2 | C1 | O2A | H1A | 119.8° | 120.0° |
| C2 | C1 | O2A | CGA | 164.8° | 180.0° |
| C2 | C1 | H1 | H1A | 120.7° | 120.0° |
| C2 | C3 | C4 | C5 | 178.9° | 180.0° |
| C2 | C3 | C5 | C6 | 176.3° | 95.0° |
| C3 | C2 | C1 | O2A | 101.5° | 135.1° |
| C3 | C2 | C1 | H1 | 18.2° | 15.1° |
| C3 | C2 | C1 | H1A | 138.7° | 104.9° |
| C2 | C3 | C4 | H4 | 180.0° | 84.8° |
| C2 | C3 | C4 | H4A | 60.0° | 155.1° |
| C2 | C3 | C4 | H4B | 60.0° | 35.1° |
| C2 | C3 | C5 | H5 | 54.5° | 145.0° |
| C2 | C3 | C5 | H5A | 62.1° | 25.0° |
| C4 | C3 | C5 | C6 | 4.9° | 85.0° |
| C4 | C3 | C2 | H2 | 179.7° | 174.3° |
| C3 | C4 | H4 | H4A | 120.0° | 120.0° |
| C3 | C4 | H4 | H4B | 120.0° | 120.0° |
| C3 | C4 | H4A | H4B | 120.0° | 120.0° |
| C4 | C3 | C5 | H5 | 126.6° | 35.0° |
| C4 | C3 | C5 | H5A | 116.8° | 155.0° |
| C3 | C5 | C6 | H5 | 121.7° | 120.0° |
| C3 | C5 | C6 | H5A | 121.6° | 120.0° |
| C3 | C5 | C6 | C7 | 88.8° | 180.0° |
| C5 | C3 | C2 | H2 | 1.5° | 5.7° |
| C5 | C3 | C4 | H4 | 1.1° | 95.2° |
| C5 | C3 | C4 | H4A | 118.9° | 24.9° |
| C5 | C3 | C4 | H4B | 121.1° | 144.9° |
| C3 | C5 | H5 | H5A | 114.6° | 120.0° |
| C3 | C5 | C6 | H6 | 150.8° | 60.0° |
| C3 | C5 | C6 | H6A | 31.5° | 60.0° |
| C5 | C6 | C7 | H6 | 120.4° | 120.0° |
| C5 | C6 | C7 | H6A | 120.4° | 120.0° |
| C5 | C6 | C7 | C8 | 139.8° | 180.0° |
| C6 | C5 | H5 | H5A | 114.6° | 120.0° |
| C5 | C6 | H6 | H6A | 118.9° | 120.0° |
| C5 | C6 | C7 | H7 | 99.5° | 60.0° |
| C5 | C6 | C7 | H7A | 19.0° | 59.9° |
| C6 | C7 | C8 | H7 | 120.8° | 120.0° |
| C6 | C7 | C8 | H7A | 120.8° | 120.1° |
| C6 | C7 | C8 | C9 | 174.0° | 65.0° |
| C6 | C7 | C8 | C10 | 52.2° | 175.0° |
| C7 | C6 | C5 | H5 | 32.9° | 60.0° |
| C7 | C6 | C5 | H5A | 149.5° | 60.0° |
| C7 | C6 | H6 | H6A | 118.9° | 120.0° |
| C6 | C7 | H7 | H7A | 117.6° | 120.0° |
| C6 | C7 | C8 | H8 | 63.1° | 55.0° |
| C7 | C8 | C9 | C10 | 138.2° | 120.0° |
| C7 | C8 | C9 | H8 | 110.9° | 120.0° |
| C7 | C8 | C10 | H8 | 115.3° | 120.0° |
| C7 | C8 | C10 | C11 | 159.7° | 175.0° |
| C8 | C7 | C6 | H6 | 19.4° | 60.0° |
| C8 | C7 | C6 | H6A | 99.9° | 60.0° |
| C8 | C7 | H7 | H7A | 117.5° | 120.0° |
| C7 | C8 | C9 | H9 | 180.0° | 60.0° |
| C7 | C8 | C9 | H9A | 60.0° | 180.0° |
| C7 | C8 | C9 | H9B | 60.0° | 59.9° |
| C7 | C8 | C10 | H10 | 38.8° | 55.0° |
| C7 | C8 | C10 | H10A | 79.5° | 65.0° |
| C9 | C8 | C10 | H8 | 110.9° | 120.0° |
| C9 | C8 | C10 | C11 | 66.6° | 65.0° |
| C9 | C8 | C7 | H7 | 65.2° | 175.0° |
| C9 | C8 | C7 | H7A | 53.2° | 55.0° |
| C8 | C9 | H9 | H9A | 120.0° | 120.0° |
| C8 | C9 | H9 | H9B | 120.0° | 119.9° |
| C8 | C9 | H9A | H9B | 120.0° | 120.0° |
| C9 | C8 | C10 | H10 | 172.6° | 175.0° |
| C9 | C8 | C10 | H10A | 54.3° | 55.0° |
| C4B | NB | C1B | H171 | 180.0° | 180.0° |
| C4B | NB | C1B | C2B | 2.1° | 1.6° |
| NB | C4B | C3B | C2B | 0.5° | 1.2° |
| NB | C4B | C3B | CHC | 179.3° | 179.9° |
| NB | C4B | C3B | CAB | 179.1° | 178.7° |
| C4B | NB | C1B | CHB | 172.3° | 178.0° |
| NB | C4B | CHC | C1C | 0.0° | 3.2° |
| NB | C4B | CHC | HHC | 180.0° | 176.6° |
| NC | C1C | C2C | CHC | 179.2° | 179.5° |
| NC | C1C | C2C | CMC | 131.7° | 119.7° |
| NC | C1C | C2C | C3C | 10.2° | 1.1° |
| NC | C1C | CHC | C4B | 0.8° | 2.1° |
| C1C | NC | C4C | C3C | 0.2° | 1.1° |
| C1C | NC | C4C | CHD | 178.1° | 178.9° |
| NC | C1C | C2C | H43 | 107.1° | 117.4° |
| NC | C1C | CHC | HHC | 179.2° | 178.1° |
| C4C | NC | C1C | C2C | 6.4° | 1.4° |
| NC | C4C | CHD | C1D | 1.3° | 1.7° |
| NC | C4C | C3C | C2C | 6.6° | 0.3° |
| NC | C4C | C3C | CAC | 169.7° | 179.8° |
| NC | C4C | C3C | CHD | 178.3° | 180.0° |
| C4C | NC | C1C | CHC | 172.8° | 178.1° |
| NC | C4C | CHD | HHD | 178.7° | 178.4° |
| ND | C1D | CHD | C2D | 178.6° | 179.7° |
| ND | C1D | C2D | CMD | 172.3° | 179.2° |
| ND | C1D | C2D | C3D | 5.4° | 0.8° |
| C1D | ND | C4D | H181 | 180.0° | 179.9° |
| C1D | ND | C4D | C3D | 2.1° | 1.3° |
| C1D | ND | C4D | CHA | 180.0° | 178.4° |
| ND | C1D | CHD | C4C | 0.1° | 0.8° |
| ND | C1D | CHD | HHD | 179.9° | 179.1° |
| C8 | C10 | C11 | H10 | 120.9° | 120.0° |
| C8 | C10 | C11 | H10A | 120.9° | 120.0° |
| C8 | C10 | C11 | C12 | 166.9° | 180.0° |
| C10 | C8 | C7 | H7 | 68.5° | 55.0° |
| C10 | C8 | C7 | H7A | 173.0° | 65.0° |
| C10 | C8 | C9 | H9 | 41.8° | 180.0° |
| C10 | C8 | C9 | H9A | 78.2° | 60.0° |
| C10 | C8 | C9 | H9B | 161.8° | 60.1° |
| C8 | C10 | H10 | H10A | 117.3° | 120.0° |
| C8 | C10 | C11 | H11 | 72.7° | 60.1° |
| C8 | C10 | C11 | H11A | 46.5° | 60.0° |
| C10 | C11 | C12 | H11 | 120.4° | 120.0° |
| C10 | C11 | C12 | H11A | 120.4° | 120.1° |
| C10 | C11 | C12 | C13 | 161.6° | 180.0° |
| C11 | C10 | C8 | H8 | 44.4° | 55.0° |
| C11 | C10 | H10 | H10A | 117.2° | 120.0° |
| C10 | C11 | H11 | H11A | 118.9° | 120.1° |
| C10 | C11 | C12 | H12 | 40.8° | 60.0° |
| C10 | C11 | C12 | H12A | 77.6° | 60.0° |
| C11 | C12 | C13 | H12 | 120.8° | 120.0° |
| C11 | C12 | C13 | H12A | 120.8° | 120.0° |
| C11 | C12 | C13 | C14 | 174.1° | 65.0° |
| C11 | C12 | C13 | C15 | 42.5° | 175.0° |
| C12 | C11 | C10 | H10 | 46.0° | 60.0° |
| C12 | C11 | C10 | H10A | 72.2° | 60.0° |
| C12 | C11 | H11 | H11A | 118.8° | 119.9° |
| C11 | C12 | H12 | H12A | 117.6° | 120.0° |
| C11 | C12 | C13 | H13 | 73.1° | 55.0° |
| C12 | C13 | C14 | C15 | 134.5° | 120.0° |
| C12 | C13 | C14 | H13 | 112.7° | 120.0° |
| C12 | C13 | C15 | H13 | 115.6° | 120.0° |
| C12 | C13 | C15 | C16 | 149.4° | 175.0° |
| C13 | C12 | C11 | H11 | 78.0° | 60.0° |
| C13 | C12 | C11 | H11A | 41.2° | 59.9° |
| C13 | C12 | H12 | H12A | 117.6° | 120.0° |
| C12 | C13 | C14 | H14 | 180.0° | 180.0° |
| C12 | C13 | C14 | H14A | 60.0° | 60.0° |
| C12 | C13 | C14 | H14B | 60.0° | 60.0° |
| C12 | C13 | C15 | H15 | 28.7° | 55.0° |
| C12 | C13 | C15 | H15A | 89.9° | 65.0° |
| C14 | C13 | C15 | H13 | 112.8° | 120.0° |
| C14 | C13 | C15 | C16 | 79.0° | 65.0° |
| C14 | C13 | C12 | H12 | 53.3° | 174.9° |
| C14 | C13 | C12 | H12A | 65.1° | 55.0° |
| C13 | C14 | H14 | H14A | 120.0° | 120.0° |
| C13 | C14 | H14 | H14B | 120.0° | 119.9° |
| C13 | C14 | H14A | H14B | 120.0° | 120.0° |
| C14 | C13 | C15 | H15 | 160.3° | 175.0° |
| C14 | C13 | C15 | H15A | 41.7° | 55.0° |
| C13 | C15 | C16 | H15 | 120.7° | 120.0° |
| C13 | C15 | C16 | H15A | 120.7° | 120.0° |
| C13 | C15 | C16 | C17 | 163.3° | 180.0° |
| C15 | C13 | C12 | H12 | 78.3° | 55.0° |
| C15 | C13 | C12 | H12A | 163.3° | 65.0° |
| C15 | C13 | C14 | H14 | 45.5° | 60.1° |
| C15 | C13 | C14 | H14A | 74.6° | 60.0° |
| C15 | C13 | C14 | H14B | 165.5° | 180.0° |
| C13 | C15 | H15 | H15A | 117.9° | 120.0° |
| C13 | C15 | C16 | H16 | 76.4° | 60.0° |
| C13 | C15 | C16 | H16A | 43.0° | 60.1° |
| C15 | C16 | C17 | H16 | 120.3° | 120.0° |
| C15 | C16 | C17 | H16A | 120.3° | 119.9° |
| C15 | C16 | C17 | C18 | 165.3° | 180.0° |
| C16 | C15 | C13 | H13 | 33.8° | 55.0° |
| C16 | C15 | H15 | H15A | 117.9° | 120.0° |
| C15 | C16 | H16 | H16A | 119.1° | 120.0° |
| C15 | C16 | C17 | H17 | 44.6° | 60.0° |
| C15 | C16 | C17 | H17A | 73.9° | 60.0° |
| C16 | C17 | C18 | H17 | 120.7° | 120.0° |
| C16 | C17 | C18 | H17A | 120.7° | 120.0° |
| C16 | C17 | C18 | C19 | 70.8° | 65.0° |
| C16 | C17 | C18 | C20 | 165.3° | 175.0° |
| C17 | C16 | C15 | H15 | 42.7° | 60.0° |
| C17 | C16 | C15 | H15A | 76.0° | 60.0° |
| C17 | C16 | H16 | H16A | 119.1° | 120.0° |
| C16 | C17 | H17 | H17A | 117.8° | 120.0° |
| C16 | C17 | C18 | H18 | 47.3° | 55.0° |
| C17 | C18 | C19 | C20 | 123.9° | 120.0° |
| C17 | C18 | C19 | H18 | 118.0° | 120.0° |
| C17 | C18 | C20 | H18 | 117.9° | 120.0° |
| C18 | C17 | C16 | H16 | 74.4° | 60.0° |
| C18 | C17 | C16 | H16A | 45.0° | 60.1° |
| C18 | C17 | H17 | H17A | 117.8° | 120.0° |
| C17 | C18 | C19 | H19 | 180.0° | 60.0° |
| C17 | C18 | C19 | H19A | 60.0° | 60.0° |
| C17 | C18 | C19 | H19B | 60.0° | 180.0° |
| C17 | C18 | C20 | H20 | 180.0° | 60.0° |
| C17 | C18 | C20 | H20A | 60.0° | 180.0° |
| C17 | C18 | C20 | H20B | 60.0° | 60.0° |
| C19 | C18 | C20 | H18 | 118.0° | 120.1° |
| C19 | C18 | C17 | H17 | 168.5° | 55.0° |
| C19 | C18 | C17 | H17A | 50.0° | 175.0° |
| C18 | C19 | H19 | H19A | 120.0° | 120.0° |
| C18 | C19 | H19 | H19B | 120.0° | 120.0° |
| C18 | C19 | H19A | H19B | 120.0° | 119.9° |
| C19 | C18 | C20 | H20 | 56.0° | 180.0° |
| C19 | C18 | C20 | H20A | 176.0° | 60.0° |
| C19 | C18 | C20 | H20B | 64.0° | 60.0° |
| NA | C1A | CHA | C2A | 175.6° | 179.9° |
| NA | C1A | C2A | CAA | 104.1° | 118.3° |
| NA | C1A | C2A | C3A | 14.4° | 0.2° |
| C1A | NA | C4A | C3A | 9.4° | 0.9° |
| C1A | NA | C4A | CHB | 175.7° | 178.5° |
| NA | C1A | CHA | CBD | 174.8° | 178.1° |
| NA | C1A | CHA | C4D | 0.7° | 2.2° |
| NA | C1A | C2A | H42 | 133.6° | 118.6° |
| CHA | C1A | C2A | CAA | 79.8° | 61.6° |
| CHA | C1A | C2A | C3A | 161.7° | 179.9° |
| CHA | C1A | NA | C4A | 173.1° | 179.4° |
| C1A | CHA | C4D | ND | 5.7° | 0.7° |
| C1A | CHA | C4D | C3D | 172.1° | 179.6° |
| C1A | CHA | CBD | CAD | 170.7° | 178.1° |
| C1A | CHA | CBD | C4D | 176.1° | 179.7° |
| C1A | CHA | CBD | CGD | 59.3° | 59.1° |
| CHA | C1A | C2A | H42 | 42.5° | 61.5° |
| C1A | CHA | CBD | HBD | 65.6° | 63.0° |
| NB | C1B | C2B | CHB | 174.5° | 179.6° |
| NB | C1B | C2B | C3B | 2.5° | 0.8° |
| C1B | NB | C4B | C3B | 1.1° | 1.7° |
| NB | C1B | CHB | C4A | 1.9° | 3.9° |
| C1B | NB | C4B | CHC | 178.2° | 178.1° |
| NB | C1B | C2B | CMB | 179.6° | 179.2° |
| NB | C1B | CHB | HHB | 178.1° | 176.1° |
| C1B | C2B | C3B | CMB | 178.2° | 180.0° |
| C1B | C2B | C3B | C4B | 1.8° | 0.2° |
| C1B | C2B | C3B | CAB | 177.7° | 179.7° |
| C2B | C1B | CHB | C4A | 171.7° | 176.6° |
| C2B | C1B | NB | H171 | 177.9° | 178.4° |
| C2B | C1B | CHB | HHB | 8.3° | 3.4° |
| C1B | C2B | CMB | HMB | 88.7° | 90.0° |
| C1B | C2B | CMB | HMBA | 151.3° | 149.9° |
| C1B | C2B | CMB | HMBB | 31.3° | 29.9° |
| C1C | C2C | CMC | C3C | 117.7° | 114.1° |
| C1C | C2C | CMC | H43 | 121.5° | 123.0° |
| C1C | C2C | C3C | H43 | 117.4° | 118.5° |
| C1C | C2C | C3C | CAC | 166.1° | 179.4° |
| C2C | C1C | CHC | C4B | 178.3° | 178.5° |
| C1C | C2C | C3C | C4C | 9.9° | 0.4° |
| C2C | C1C | CHC | HHC | 1.7° | 1.3° |
| C1C | C2C | CMC | HMC | 180.0° | 61.4° |
| C1C | C2C | CMC | HMCA | 60.0° | 178.6° |
| C1C | C2C | CMC | HMCB | 60.0° | 58.6° |
| CHD | C1D | C2D | CMD | 6.4° | 1.1° |
| CHD | C1D | C2D | C3D | 175.9° | 178.9° |
| C1D | CHD | C4C | C3C | 176.8° | 178.3° |
| CHD | C1D | ND | C4D | 176.7° | 178.4° |
| C1D | CHD | C4C | HHD | 180.0° | 179.9° |
| CHD | C1D | ND | H181 | 3.3° | 1.5° |
| O1D | CGD | O2D | CBD | 178.2° | 180.0° |
| O1D | CGD | CBD | CAD | 125.8° | 118.6° |
| O1D | CGD | CBD | CHA | 124.2° | 2.8° |
| O1D | CGD | O2D | CED | 11.1° | 0.0° |
| O1D | CGD | CBD | HBD | 0.7° | 119.3° |
| C20 | C18 | C17 | H17 | 44.6° | 65.0° |
| C20 | C18 | C17 | H17A | 74.0° | 55.0° |
| C20 | C18 | C19 | H19 | 56.1° | 180.0° |
| C20 | C18 | C19 | H19A | 63.9° | 59.9° |
| C20 | C18 | C19 | H19B | 176.1° | 60.0° |
| C18 | C20 | H20 | H20A | 120.0° | 120.0° |
| C18 | C20 | H20 | H20B | 120.0° | 120.0° |
| C18 | C20 | H20A | H20B | 120.0° | 120.0° |
| C1A | C2A | CAA | C3A | 114.0° | 113.7° |
| C1A | C2A | CAA | H42 | 122.5° | 123.1° |
| C1A | C2A | C3A | H42 | 119.2° | 118.4° |
| C1A | C2A | C3A | C4A | 18.9° | 0.3° |
| C2A | C1A | NA | C4A | 3.2° | 0.7° |
| C1A | C2A | CAA | CBA | 175.2° | 175.0° |
| C2A | C1A | CHA | CBD | 0.8° | 2.0° |
| C2A | C1A | CHA | C4D | 176.3° | 177.6° |
| C1A | C2A | C3A | CMA | 95.2° | 118.7° |
| C1A | C2A | C3A | H44 | 139.7° | 118.1° |
| C1A | C2A | CAA | HAA | 54.7° | 55.0° |
| C1A | C2A | CAA | HAAA | 64.2° | 65.0° |
| CAA | C2A | C3A | H42 | 123.3° | 123.1° |
| CAA | C2A | C3A | C4A | 98.6° | 118.7° |
| C2A | CAA | CBA | HAA | 120.6° | 120.0° |
| C2A | CAA | CBA | HAAA | 120.5° | 120.0° |
| C2A | CAA | CBA | CGA | 172.9° | 175.8° |
| CAA | C2A | C3A | CMA | 147.3° | 122.9° |
| CAA | C2A | C3A | H44 | 22.2° | 0.4° |
| C2A | CAA | HAA | HAAA | 118.3° | 120.0° |
| C2A | CAA | CBA | HBA | 52.3° | 55.8° |
| C2A | CAA | CBA | HBAA | 66.5° | 64.2° |
| C1 | O2A | CGA | CBA | 155.1° | 180.0° |
| C1 | O2A | CGA | O1A | 29.2° | 0.0° |
| O2A | C1 | H1 | H1A | 120.6° | 120.0° |
| O2A | C1 | C2 | H2 | 78.5° | 44.9° |
| O2A | CGA | CBA | CAA | 179.8° | 180.0° |
| O2A | CGA | CBA | O1A | 175.8° | 180.0° |
| CGA | O2A | C1 | H1 | 45.0° | 60.0° |
| CGA | O2A | C1 | H1A | 75.4° | 60.0° |
| O2A | CGA | CBA | HBA | 59.2° | 60.0° |
| O2A | CGA | CBA | HBAA | 59.6° | 60.0° |
| C2B | C3B | C4B | CAB | 179.6° | 179.9° |
| C2B | C3B | C4B | CHC | 179.8° | 178.7° |
| C2B | C3B | CAB | CBB | 122.7° | 94.6° |
| C2B | C3B | CAB | OBB | 38.0° | 85.5° |
| C3B | C2B | C1B | CHB | 172.0° | 178.8° |
| C3B | C2B | CMB | HMB | 89.1° | 90.0° |
| C3B | C2B | CMB | HMBA | 31.0° | 30.1° |
| C3B | C2B | CMB | HMBB | 151.0° | 150.1° |
| CMC | C2C | C3C | H43 | 120.5° | 122.9° |
| CMC | C2C | C3C | CAC | 44.0° | 60.8° |
| CMC | C2C | C3C | C4C | 132.0° | 119.0° |
| CMC | C2C | C1C | CHC | 47.6° | 59.8° |
| C2C | CMC | HMC | HMCA | 120.0° | 120.1° |
| C2C | CMC | HMC | HMCB | 120.0° | 120.0° |
| C2C | CMC | HMCA | HMCB | 120.0° | 120.0° |
| C1D | C2D | CMD | C3D | 177.2° | 180.0° |
| C2D | C1D | ND | C4D | 4.5° | 1.3° |
| C1D | C2D | C3D | C4D | 3.9° | 0.0° |
| C1D | C2D | C3D | CAD | 178.8° | 179.8° |
| C2D | C1D | CHD | C4C | 178.7° | 179.6° |
| C2D | C1D | ND | H181 | 175.5° | 178.8° |
| C2D | C1D | CHD | HHD | 1.3° | 0.5° |
| C1D | C2D | CMD | HMD | 91.3° | 0.0° |
| C1D | C2D | CMD | HMDA | 148.6° | 120.0° |
| C1D | C2D | CMD | HMDB | 28.6° | 120.0° |
| CMD | C2D | C3D | C4D | 173.7° | 180.0° |
| CMD | C2D | C3D | CAD | 3.6° | 0.2° |
| C2D | CMD | HMD | HMDA | 120.0° | 120.0° |
| C2D | CMD | HMD | HMDB | 120.0° | 120.0° |
| C2D | CMD | HMDA | HMDB | 120.0° | 120.1° |
| O2D | CGD | CBD | CAD | 55.9° | 61.5° |
| O2D | CGD | CBD | CHA | 54.2° | 177.2° |
| O2D | CGD | CBD | HBD | 179.0° | 60.7° |
| CGD | O2D | CED | HED | 180.0° | 60.0° |
| CGD | O2D | CED | HEDA | 60.0° | 180.0° |
| CGD | O2D | CED | HEDB | 60.0° | 60.0° |
| C2A | C3A | C4A | CMA | 117.2° | 118.4° |
| C2A | C3A | C4A | H44 | 121.0° | 118.4° |
| C2A | C3A | C4A | NA | 18.0° | 0.7° |
| C2A | C3A | C4A | CHB | 167.1° | 178.7° |
| C3A | C2A | CAA | CBA | 70.7° | 71.3° |
| C2A | C3A | CMA | H44 | 125.4° | 123.2° |
| C3A | C2A | CAA | HAA | 168.7° | 168.8° |
| C3A | C2A | CAA | HAAA | 49.8° | 48.7° |
| C2A | C3A | CMA | HMA | 180.0° | 60.0° |
| C2A | C3A | CMA | HMAA | 60.0° | 180.0° |
| C2A | C3A | CMA | HMAB | 60.0° | 60.0° |
| C3A | C4A | NA | CHB | 174.9° | 179.4° |
| C3A | C4A | CHB | C1B | 172.8° | 179.4° |
| C4A | C3A | CMA | H44 | 122.0° | 123.2° |
| C4A | C3A | C2A | H42 | 138.1° | 118.2° |
| C3A | C4A | CHB | HHB | 7.2° | 0.6° |
| C4A | C3A | CMA | HMA | 67.3° | 173.6° |
| C4A | C3A | CMA | HMAA | 52.7° | 66.4° |
| C4A | C3A | CMA | HMAB | 172.6° | 53.6° |
| C4B | C3B | CAB | CBB | 57.8° | 85.5° |
| C4B | C3B | CAB | OBB | 141.4° | 94.4° |
| C3B | C4B | CHC | C1C | 179.2° | 176.9° |
| C4B | C3B | C2B | CMB | 179.9° | 179.8° |
| C3B | C4B | NB | H171 | 178.9° | 178.3° |
| C3B | C4B | CHC | HHC | 0.8° | 3.2° |
| CAB | C3B | C4B | CHC | 0.2° | 1.4° |
| C3B | CAB | CBB | OBB | 163.5° | 179.9° |
| CAB | C3B | C2B | CMB | 0.5° | 0.3° |
| C3B | CAB | CBB | HBB | 163.4° | 4.9° |
| C3B | CAB | CBB | HBBA | 76.5° | 125.0° |
| C3B | CAB | CBB | HBBB | 43.5° | 115.1° |
| C2C | C3C | CAC | C4C | 175.3° | 179.9° |
| C2C | C3C | CAC | CBC | 12.3° | 0.1° |
| C3C | C2C | C1C | CHC | 169.0° | 178.4° |
| C2C | C3C | C4C | CHD | 171.6° | 179.7° |
| C2C | C3C | CAC | HAC | 167.6° | 180.0° |
| C3C | C2C | CMC | HMC | 62.2° | 175.6° |
| C3C | C2C | CMC | HMCA | 57.8° | 64.4° |
| C3C | C2C | CMC | HMCB | 177.8° | 55.6° |
| C3C | CAC | CBC | HAC | 180.0° | 180.0° |
| CAC | C3C | C4C | CHD | 12.1° | 0.2° |
| CAC | C3C | C2C | H43 | 76.5° | 62.0° |
| C3C | CAC | CBC | HBC | 180.0° | 179.9° |
| C3C | CAC | CBC | HBCA | 60.0° | 60.0° |
| C3C | CAC | CBC | H55 | 60.0° | 60.0° |
| C2D | C3D | C4D | ND | 1.2° | 0.8° |
| C2D | C3D | C4D | CAD | 178.4° | 179.9° |
| C2D | C3D | CAD | CBD | 179.7° | 177.8° |
| C2D | C3D | CAD | OBD | 4.7° | 2.2° |
| C2D | C3D | C4D | CHA | 177.1° | 179.0° |
| C3D | C2D | CMD | HMD | 91.5° | 180.0° |
| C3D | C2D | CMD | HMDA | 28.5° | 60.0° |
| C3D | C2D | CMD | HMDB | 148.5° | 60.0° |
| NA | C4A | CHB | C1B | 1.2° | 1.3° |
| NA | C4A | C3A | CMA | 99.2° | 119.1° |
| NA | C4A | C3A | H44 | 139.0° | 117.7° |
| NA | C4A | CHB | HHB | 178.8° | 178.7° |
| C4A | CHB | C1B | HHB | 180.0° | 180.0° |
| CHB | C4A | C3A | CMA | 75.7° | 60.3° |
| CHB | C4A | C3A | H44 | 46.1° | 62.9° |
| C4B | CHC | C1C | HHC | 180.0° | 179.8° |
| CHC | C4B | NB | H171 | 1.7° | 1.9° |
| C4C | C3C | CAC | CBC | 172.4° | 179.9° |
| C4C | C3C | C2C | H43 | 107.5° | 118.1° |
| C4C | C3C | CAC | HAC | 7.6° | 0.1° |
| C3C | C4C | CHD | HHD | 3.1° | 1.6° |
| ND | C4D | C3D | CHA | 178.4° | 179.8° |
| ND | C4D | C3D | CAD | 179.7° | 179.1° |
| ND | C4D | CHA | CBD | 177.8° | 179.0° |
| C4D | C3D | CAD | CBD | 2.4° | 2.5° |
| C3D | C4D | CHA | CBD | 4.4° | 0.7° |
| C4D | C3D | CAD | OBD | 172.6° | 177.5° |
| C3D | C4D | ND | H181 | 177.9° | 178.8° |
| CAB | CBB | HBB | HBBA | 120.0° | 120.1° |
| CAB | CBB | HBB | HBBB | 120.0° | 120.0° |
| CAB | CBB | HBBA | HBBB | 120.0° | 119.9° |
| OBB | CAB | CBB | HBB | 0.0° | 175.0° |
| OBB | CAB | CBB | HBBA | 120.0° | 54.9° |
| OBB | CAB | CBB | HBBB | 120.0° | 65.0° |
| CAC | CBC | HBC | HBCA | 120.0° | 120.0° |
| CAC | CBC | HBC | H55 | 120.0° | 120.0° |
| CAC | CBC | HBCA | H55 | 120.0° | 120.0° |
| C3D | CAD | CBD | OBD | 175.6° | 180.0° |
| C3D | CAD | CBD | CHA | 4.8° | 2.8° |
| C3D | CAD | CBD | CGD | 115.8° | 121.7° |
| CAD | C3D | C4D | CHA | 1.3° | 1.1° |
| C3D | CAD | CBD | HBD | 119.0° | 116.1° |
| CAA | CBA | CGA | HBA | 120.6° | 120.0° |
| CAA | CBA | CGA | HBAA | 120.6° | 120.0° |
| CAA | CBA | CGA | O1A | 4.5° | 0.0° |
| CBA | CAA | C2A | H42 | 52.7° | 51.9° |
| CBA | CAA | HAA | HAAA | 118.3° | 120.0° |
| CAA | CBA | HBA | HBAA | 118.2° | 120.0° |
| CGA | CBA | CAA | HAA | 66.6° | 64.2° |
| CGA | CBA | CAA | HAAA | 52.3° | 55.9° |
| CGA | CBA | HBA | HBAA | 118.2° | 120.0° |
| CAD | CBD | CHA | CGD | 111.4° | 119.0° |
| CAD | CBD | CHA | HBD | 123.7° | 118.9° |
| CAD | CBD | CGD | HBD | 125.1° | 122.2° |
| CAD | CBD | CHA | C4D | 5.4° | 2.2° |
| CHA | CBD | CAD | OBD | 170.8° | 177.2° |
| CHA | CBD | CGD | HBD | 124.9° | 122.1° |
| OBD | CAD | CBD | CGD | 59.8° | 58.3° |
| OBD | CAD | CBD | HBD | 65.4° | 63.9° |
| CED | O2D | CGD | CBD | 170.7° | 180.0° |
| O2D | CED | HED | HEDA | 120.0° | 120.0° |
| O2D | CED | HED | HEDB | 120.0° | 120.0° |
| O2D | CED | HEDA | HEDB | 120.0° | 120.0° |
| O1A | CGA | CBA | HBA | 125.0° | 120.0° |
| O1A | CGA | CBA | HBAA | 116.1° | 120.0° |
| CGD | CBD | CHA | C4D | 116.8° | 121.2° |
| CHA | C4D | ND | H181 | 0.0° | 1.5° |
| C4D | CHA | CBD | HBD | 118.3° | 116.7° |
| CHB | C1B | C2B | CMB | 5.9° | 1.2° |
| CHB | C1B | NB | H171 | 7.7° | 2.0° |
| CHC | C1C | C2C | H43 | 73.7° | 63.1° |
| CMA | C3A | C2A | H42 | 24.0° | 0.2° |
| C3A | CMA | HMA | HMAA | 120.0° | 120.0° |
| C3A | CMA | HMA | HMAB | 120.0° | 120.0° |
| C3A | CMA | HMAA | HMAB | 120.0° | 120.1° |
| C2B | CMB | HMB | HMBA | 120.0° | 120.0° |
| C2B | CMB | HMB | HMBB | 120.0° | 120.0° |
| C2B | CMB | HMBA | HMBB | 120.0° | 120.0° |
| H1 | C1 | C2 | H2 | 161.8° | 164.8° |
| H1A | C1 | C2 | H2 | 41.3° | 75.1° |
| H4 | C4 | H4A | H4B | 120.0° | 120.0° |
| H5 | C5 | C6 | H6 | 87.5° | 180.0° |
| H5 | C5 | C6 | H6A | 153.2° | 60.0° |
| H5A | C5 | C6 | H6 | 29.2° | 60.0° |
| H5A | C5 | C6 | H6A | 90.1° | 180.0° |
| H6 | C6 | C7 | H7 | 140.2° | 180.0° |
| H6 | C6 | C7 | H7A | 101.4° | 60.1° |
| H6A | C6 | C7 | H7 | 20.9° | 60.0° |
| H6A | C6 | C7 | H7A | 139.4° | 179.9° |
| H7 | C7 | C8 | H8 | 176.1° | 65.0° |
| H7A | C7 | C8 | H8 | 57.7° | 175.0° |
| H8 | C8 | C9 | H9 | 69.1° | 60.0° |
| H8 | C8 | C9 | H9A | 170.8° | 60.0° |
| H8 | C8 | C9 | H9B | 50.9° | 179.9° |
| H8 | C8 | C10 | H10 | 76.5° | 65.0° |
| H8 | C8 | C10 | H10A | 165.2° | 175.0° |
| H9 | C9 | H9A | H9B | 120.0° | 120.0° |
| H10 | C10 | C11 | H11 | 166.4° | 180.0° |
| H10 | C10 | C11 | H11A | 74.3° | 60.0° |
| H10A | C10 | C11 | H11 | 48.2° | 60.0° |
| H10A | C10 | C11 | H11A | 167.4° | 180.0° |
| H11 | C11 | C12 | H12 | 161.2° | 180.0° |
| H11 | C11 | C12 | H12A | 42.8° | 60.0° |
| H11A | C11 | C12 | H12 | 79.6° | 60.1° |
| H11A | C11 | C12 | H12A | 162.0° | 179.9° |
| H12 | C12 | C13 | H13 | 166.1° | 65.0° |
| H12A | C12 | C13 | H13 | 47.7° | 175.0° |
| H13 | C13 | C14 | H14 | 67.3° | 59.9° |
| H13 | C13 | C14 | H14A | 172.7° | 180.0° |
| H13 | C13 | C14 | H14B | 52.7° | 60.0° |
| H13 | C13 | C15 | H15 | 86.9° | 64.9° |
| H13 | C13 | C15 | H15A | 154.5° | 175.0° |
| H14 | C14 | H14A | H14B | 120.0° | 120.0° |
| H15 | C15 | C16 | H16 | 163.0° | 180.0° |
| H15 | C15 | C16 | H16A | 77.6° | 59.9° |
| H15A | C15 | C16 | H16 | 44.3° | 60.0° |
| H15A | C15 | C16 | H16A | 163.7° | 180.0° |
| H16 | C16 | C17 | H17 | 164.9° | 180.0° |
| H16 | C16 | C17 | H17A | 46.4° | 60.0° |
| H16A | C16 | C17 | H17 | 75.7° | 59.9° |
| H16A | C16 | C17 | H17A | 165.8° | 180.0° |
| H17 | C17 | C18 | H18 | 73.4° | 175.0° |
| H17A | C17 | C18 | H18 | 168.0° | 65.0° |
| H18 | C18 | C19 | H19 | 62.0° | 60.0° |
| H18 | C18 | C19 | H19A | 178.0° | 180.0° |
| H18 | C18 | C19 | H19B | 58.0° | 60.0° |
| H18 | C18 | C20 | H20 | 62.0° | 60.0° |
| H18 | C18 | C20 | H20A | 57.9° | 60.0° |
| H18 | C18 | C20 | H20B | 178.0° | 180.0° |
| H19 | C19 | H19A | H19B | 120.0° | 120.0° |
| H20 | C20 | H20A | H20B | 120.0° | 120.0° |
| H42 | C2A | C3A | H44 | 101.1° | 123.5° |
| H42 | C2A | CAA | HAA | 67.8° | 68.1° |
| H42 | C2A | CAA | HAAA | 173.3° | 171.9° |
| H43 | C2C | CMC | HMC | 58.5° | 61.5° |
| H43 | C2C | CMC | HMCA | 178.5° | 58.5° |
| H43 | C2C | CMC | HMCB | 61.5° | 178.5° |
| H44 | C3A | CMA | HMA | 54.7° | 63.3° |
| H44 | C3A | CMA | HMAA | 174.7° | 56.7° |
| H44 | C3A | CMA | HMAB | 65.4° | 176.8° |
| HAA | CAA | CBA | HBA | 172.9° | 175.8° |
| HAA | CAA | CBA | HBAA | 54.0° | 55.8° |
| HAAA | CAA | CBA | HBA | 68.3° | 64.1° |
| HAAA | CAA | CBA | HBAA | 172.9° | 175.8° |
| HAC | CAC | CBC | HBC | 0.0° | 0.0° |
| HAC | CAC | CBC | HBCA | 120.0° | 120.0° |
| HAC | CAC | CBC | H55 | 120.0° | 120.0° |
| HBB | CBB | HBBA | HBBB | 120.0° | 120.0° |
| HBC | CBC | HBCA | H55 | 120.0° | 120.0° |
| HED | CED | HEDA | HEDB | 120.0° | 120.0° |
| HMA | CMA | HMAA | HMAB | 120.0° | 120.0° |
| HMB | CMB | HMBA | HMBB | 120.0° | 120.0° |
| HMC | CMC | HMCA | HMCB | 120.0° | 120.0° |
| HMD | CMD | HMDA | HMDB | 119.9° | 120.0° |
