Obsolete: BJ3
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CBH | CBG | doub | 1.38Å | 1.39Å | Aromatic |
| CBH | CBB | sing | 1.40Å | 1.34Å | Aromatic |
| CE1 | CZ | doub | 1.38Å | 1.39Å | Aromatic |
| CE1 | CD1 | sing | 1.38Å | 1.40Å | Aromatic |
| CZ | CE2 | sing | 1.38Å | 1.38Å | Aromatic |
| CBG | CBF | sing | 1.38Å | 1.38Å | Aromatic |
| NBC | CBB | sing | 1.40Å | 1.34Å | |
| NBC | CBD | sing | 1.47Å | 1.49Å | |
| CBB | CBA | doub | 1.39Å | 1.34Å | Aromatic |
| CD1 | CG | doub | 1.38Å | 1.39Å | Aromatic |
| CE2 | CD2 | doub | 1.38Å | 1.40Å | Aromatic |
| CBF | CBE | doub | 1.38Å | 1.39Å | Aromatic |
| CBD | CAZ | sing | 1.54Å | 1.52Å | |
| CBA | CBE | sing | 1.38Å | 1.33Å | Aromatic |
| CBA | CAZ | sing | 1.51Å | 1.41Å | |
| CAZ | CAP | sing | 1.53Å | 1.51Å | |
| CG | CD2 | sing | 1.38Å | 1.40Å | Aromatic |
| CG | CB | sing | 1.51Å | 1.41Å | |
| CCR | CCM | sing | 1.53Å | 1.52Å | |
| CCR | CCQ | sing | 1.53Å | 1.50Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CA | N | sing | 1.47Å | 1.48Å | |
| CA | C | sing | 1.51Å | 1.54Å | |
| OAV | CAU | doub | 1.21Å | 1.23Å | |
| CAP | CAQ | sing | 1.53Å | 1.53Å | |
| N | CAU | sing | 1.35Å | 1.34Å | |
| NAN | C | sing | 1.35Å | 1.35Å | |
| NAN | CAL | sing | 1.46Å | 1.47Å | |
| CCM | CAK | sing | 1.53Å | 1.53Å | |
| CCM | CCN | sing | 1.53Å | 1.55Å | |
| CCQ | CCP | sing | 1.53Å | 1.53Å | |
| CAK | CAL | sing | 1.53Å | 1.55Å | |
| NAS | CAQ | sing | 1.47Å | 1.47Å | |
| NAS | CAM | sing | 1.35Å | 1.34Å | |
| CAQ | CAR | sing | 1.51Å | 1.51Å | |
| C | O | doub | 1.21Å | 1.23Å | |
| CCP | CCO | sing | 1.53Å | 1.51Å | |
| CAL | CAM | sing | 1.51Å | 1.53Å | |
| CAM | OAO | doub | 1.21Å | 1.23Å | |
| CCO | CCN | sing | 1.53Å | 1.51Å | |
| CAR | NAA | sing | 1.35Å | 1.35Å | |
| CAR | OAT | doub | 1.21Å | 1.23Å | |
| NAA | CAB | sing | 1.47Å | 1.47Å | |
| OCS | CCT | sing | 1.36Å | 1.36Å | |
| OCS | PAD | sing | 1.61Å | 1.59Å | |
| CCU | CCT | doub | 1.39Å | 1.39Å | Aromatic |
| CCU | CCV | sing | 1.38Å | 1.39Å | Aromatic |
| CCT | CCY | sing | 1.39Å | 1.40Å | Aromatic |
| CCV | CCW | doub | 1.38Å | 1.40Å | Aromatic |
| PAD | CAB | sing | 1.82Å | 1.82Å | |
| PAD | OAE | sing | 1.61Å | 1.51Å | |
| CAB | CAC | sing | 1.53Å | 1.55Å | |
| CAC | CCG | sing | 1.53Å | 1.52Å | |
| CCG | CCH | sing | 1.53Å | 1.52Å | |
| CCY | CCX | doub | 1.38Å | 1.39Å | Aromatic |
| CCH | NCI | sing | 1.47Å | 1.46Å | |
| CCW | CCX | sing | 1.38Å | 1.40Å | Aromatic |
| NCI | CCJ | sing | 1.37Å | 1.34Å | |
| NCL | CCJ | doub | 1.30Å | 1.34Å | |
| CCJ | NCK | sing | 1.37Å | 1.34Å | |
| N | H1 | sing | 0.97Å | 1.00Å | |
| CA | H2 | sing | 1.09Å | 1.10Å | |
| CB | H3 | sing | 1.09Å | 1.10Å | |
| CB | H4 | sing | 1.09Å | 1.10Å | |
| CD1 | H5 | sing | 1.08Å | 1.08Å | |
| CD2 | H6 | sing | 1.08Å | 1.08Å | |
| CE1 | H7 | sing | 1.08Å | 1.08Å | |
| CE2 | H8 | sing | 1.08Å | 1.08Å | |
| CZ | H9 | sing | 1.08Å | 1.08Å | |
| CAB | H10 | sing | 1.09Å | 1.10Å | |
| CAC | H11 | sing | 1.09Å | 1.10Å | |
| CAC | H12 | sing | 1.09Å | 1.10Å | |
| CAK | H13 | sing | 1.09Å | 1.10Å | |
| CAK | H14 | sing | 1.09Å | 1.10Å | |
| CAL | H15 | sing | 1.09Å | 1.10Å | |
| CAP | H16 | sing | 1.09Å | 1.10Å | |
| CAP | H17 | sing | 1.09Å | 1.10Å | |
| CAQ | H18 | sing | 1.09Å | 1.10Å | |
| CAZ | H20 | sing | 1.09Å | 1.10Å | |
| CBD | H21 | sing | 1.09Å | 1.10Å | |
| CBD | H22 | sing | 1.09Å | 1.10Å | |
| CBE | H23 | sing | 1.08Å | 1.08Å | |
| CBF | H24 | sing | 1.08Å | 1.08Å | |
| CBG | H25 | sing | 1.08Å | 1.08Å | |
| CBH | H26 | sing | 1.08Å | 1.08Å | |
| CCG | H27 | sing | 1.09Å | 1.10Å | |
| CCG | H28 | sing | 1.09Å | 1.10Å | |
| CCH | H29 | sing | 1.09Å | 1.10Å | |
| CCH | H30 | sing | 1.09Å | 1.10Å | |
| CCM | H31 | sing | 1.09Å | 1.10Å | |
| CCN | H32 | sing | 1.09Å | 1.10Å | |
| CCN | H33 | sing | 1.09Å | 1.10Å | |
| CCO | H34 | sing | 1.09Å | 1.10Å | |
| CCO | H35 | sing | 1.09Å | 1.10Å | |
| CCP | H36 | sing | 1.09Å | 1.10Å | |
| CCP | H37 | sing | 1.09Å | 1.10Å | |
| CCQ | H38 | sing | 1.09Å | 1.10Å | |
| CCQ | H39 | sing | 1.09Å | 1.10Å | |
| CCR | H40 | sing | 1.09Å | 1.10Å | |
| CCR | H41 | sing | 1.09Å | 1.10Å | |
| CCU | H42 | sing | 1.08Å | 1.08Å | |
| CCV | H43 | sing | 1.08Å | 1.08Å | |
| CCW | H44 | sing | 1.08Å | 1.08Å | |
| CCX | H45 | sing | 1.08Å | 1.08Å | |
| CCY | H46 | sing | 1.08Å | 1.08Å | |
| NAA | H47 | sing | 0.97Å | 1.00Å | |
| NAN | H48 | sing | 0.97Å | 1.00Å | |
| NAS | H49 | sing | 0.97Å | 1.00Å | |
| NBC | H50 | sing | 0.97Å | 1.00Å | |
| NCI | H51 | sing | 0.97Å | 1.00Å | |
| NCK | H52 | sing | 0.97Å | 1.00Å | |
| NCK | H53 | sing | 0.97Å | 1.00Å | |
| NCL | H54 | sing | 0.97Å | 1.00Å | |
| OAE | C1 | sing | 1.36Å | 47.95Å | |
| C1 | C2 | sing | 1.39Å | 0.00Å | Aromatic |
| C2 | C3 | doub | 1.38Å | 0.00Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 0.00Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 0.00Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 0.00Å | Aromatic |
| C6 | C1 | doub | 1.39Å | 0.00Å | Aromatic |
| PAD | O1 | doub | 1.48Å | 1.57Å | |
| CAU | C7 | sing | 1.51Å | 55.54Å | |
| C7 | C8 | sing | 1.53Å | 0.00Å | |
| C8 | C9 | sing | 1.53Å | 0.00Å | |
| C9 | C10 | sing | 1.53Å | 0.00Å | |
| C10 | C11 | sing | 1.53Å | 0.00Å | |
| C11 | N1 | sing | 1.46Å | 0.00Å | |
| N1 | C13 | sing | 1.35Å | 0.00Å | |
| C13 | C14 | sing | 1.51Å | 0.00Å | |
| C14 | C15 | sing | 1.53Å | 0.00Å | |
| C15 | C16 | sing | 1.53Å | 0.00Å | |
| C16 | C17 | sing | 1.53Å | 0.00Å | |
| C17 | C18 | sing | 1.53Å | 0.00Å | |
| C13 | O2 | doub | 1.21Å | 0.00Å | |
| C18 | C12 | sing | 1.54Å | 0.00Å | |
| C12 | C19 | sing | 1.53Å | 0.00Å | |
| C19 | C20 | sing | 1.54Å | 0.00Å | |
| C20 | S1 | sing | 1.84Å | 0.00Å | |
| S1 | C18 | sing | 1.84Å | 0.00Å | |
| C19 | N3 | sing | 1.47Å | 0.00Å | |
| N3 | C22 | sing | 1.34Å | 0.00Å | |
| C22 | N2 | sing | 1.34Å | 0.00Å | |
| N2 | C12 | sing | 1.47Å | 0.00Å | |
| C22 | O3 | doub | 1.22Å | 0.00Å | |
| C2 | H19 | sing | 1.08Å | 0.00Å | |
| C3 | H55 | sing | 1.08Å | 0.00Å | |
| C4 | H56 | sing | 1.08Å | 0.00Å | |
| C5 | H57 | sing | 1.08Å | 0.00Å | |
| C6 | H58 | sing | 1.08Å | 0.00Å | |
| C7 | H59 | sing | 1.09Å | 0.00Å | |
| C7 | H60 | sing | 1.09Å | 0.00Å | |
| C8 | H61 | sing | 1.09Å | 0.00Å | |
| C8 | H62 | sing | 1.09Å | 0.00Å | |
| C9 | H63 | sing | 1.09Å | 0.00Å | |
| C9 | H64 | sing | 1.09Å | 0.00Å | |
| C10 | H65 | sing | 1.09Å | 0.00Å | |
| C10 | H66 | sing | 1.09Å | 0.00Å | |
| C11 | H67 | sing | 1.09Å | 0.00Å | |
| C11 | H68 | sing | 1.09Å | 0.00Å | |
| N1 | H69 | sing | 0.97Å | 0.00Å | |
| C14 | H70 | sing | 1.09Å | 0.00Å | |
| C14 | H71 | sing | 1.09Å | 0.00Å | |
| C15 | H72 | sing | 1.09Å | 0.00Å | |
| C15 | H73 | sing | 1.09Å | 0.00Å | |
| C16 | H74 | sing | 1.09Å | 0.00Å | |
| C16 | H75 | sing | 1.09Å | 0.00Å | |
| C17 | H76 | sing | 1.09Å | 0.00Å | |
| C17 | H77 | sing | 1.09Å | 0.00Å | |
| C18 | H78 | sing | 1.09Å | 0.00Å | |
| C12 | H79 | sing | 1.09Å | 0.00Å | |
| C19 | H80 | sing | 1.09Å | 0.00Å | |
| C20 | H81 | sing | 1.09Å | 0.00Å | |
| C20 | H82 | sing | 1.09Å | 0.00Å | |
| N3 | H83 | sing | 0.97Å | 0.00Å | |
| N2 | H84 | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CBG | CBH | CBB | 121.6° | 120.3° |
| CBH | CBG | CBF | 117.7° | 120.2° |
| CBH | CBG | H25 | 121.1° | 119.9° |
| CBG | CBH | H26 | 119.2° | 119.8° |
| CBH | CBB | NBC | 130.0° | 129.3° |
| CBH | CBB | CBA | 120.6° | 119.0° |
| CBB | CBH | H26 | 119.2° | 119.9° |
| CZ | CE1 | CD1 | 120.7° | 120.0° |
| CE1 | CZ | CE2 | 120.0° | 120.0° |
| CZ | CE1 | H7 | 119.7° | 120.0° |
| CE1 | CZ | H9 | 120.0° | 120.0° |
| CE1 | CD1 | CG | 119.6° | 120.0° |
| CE1 | CD1 | H5 | 120.2° | 120.0° |
| CD1 | CE1 | H7 | 119.6° | 120.0° |
| CZ | CE2 | CD2 | 119.5° | 120.0° |
| CZ | CE2 | H8 | 120.3° | 120.0° |
| CE2 | CZ | H9 | 120.0° | 120.0° |
| CBG | CBF | CBE | 118.4° | 119.8° |
| CBG | CBF | H24 | 120.8° | 120.1° |
| CBF | CBG | H25 | 121.1° | 119.9° |
| CBB | NBC | CBD | 108.9° | 110.1° |
| NBC | CBB | CBA | 109.4° | 111.7° |
| CBB | NBC | H50 | 109.6° | 125.0° |
| NBC | CBD | CAZ | 97.3° | 105.0° |
| NBC | CBD | H21 | 112.4° | 110.3° |
| NBC | CBD | H22 | 112.4° | 110.4° |
| CBD | NBC | H50 | 109.6° | 124.9° |
| CBB | CBA | CBE | 119.9° | 120.5° |
| CBB | CBA | CAZ | 109.6° | 108.5° |
| CD1 | CG | CD2 | 119.4° | 120.0° |
| CD1 | CG | CB | 119.5° | 120.0° |
| CG | CD1 | H5 | 120.2° | 120.0° |
| CE2 | CD2 | CG | 120.9° | 120.0° |
| CE2 | CD2 | H6 | 119.6° | 120.0° |
| CD2 | CE2 | H8 | 120.3° | 120.0° |
| CBF | CBE | CBA | 121.7° | 120.1° |
| CBF | CBE | H23 | 119.1° | 119.9° |
| CBE | CBF | H24 | 120.8° | 120.1° |
| CBD | CAZ | CBA | 104.6° | 104.7° |
| CBD | CAZ | CAP | 109.6° | 110.4° |
| CBD | CAZ | H20 | 110.3° | 110.4° |
| CAZ | CBD | H21 | 112.4° | 110.4° |
| CAZ | CBD | H22 | 112.4° | 110.3° |
| CBE | CBA | CAZ | 130.5° | 131.0° |
| CBA | CBE | H23 | 119.2° | 119.9° |
| CBA | CAZ | CAP | 109.8° | 110.4° |
| CBA | CAZ | H20 | 112.0° | 110.4° |
| CAZ | CAP | CAQ | 110.0° | 109.5° |
| CAZ | CAP | H16 | 109.3° | 109.5° |
| CAZ | CAP | H17 | 109.4° | 109.5° |
| CAP | CAZ | H20 | 110.4° | 110.4° |
| CD2 | CG | CB | 121.1° | 120.0° |
| CG | CD2 | H6 | 119.6° | 120.0° |
| CG | CB | CA | 110.6° | 109.5° |
| CG | CB | H3 | 109.2° | 109.5° |
| CG | CB | H4 | 109.2° | 109.4° |
| CCM | CCR | CCQ | 111.5° | 109.5° |
| CCR | CCM | CAK | 108.3° | 109.5° |
| CCR | CCM | CCN | 110.8° | 109.5° |
| CCR | CCM | H31 | 109.5° | 109.5° |
| CCM | CCR | H40 | 109.0° | 109.5° |
| CCM | CCR | H41 | 109.0° | 109.5° |
| CCR | CCQ | CCP | 112.6° | 109.4° |
| CCR | CCQ | H38 | 108.7° | 109.5° |
| CCR | CCQ | H39 | 108.7° | 109.5° |
| CCQ | CCR | H40 | 109.0° | 109.4° |
| CCQ | CCR | H41 | 109.0° | 109.5° |
| CB | CA | N | 107.8° | 109.5° |
| CB | CA | C | 107.1° | 109.5° |
| CB | CA | H2 | 110.7° | 109.5° |
| CA | CB | H3 | 109.2° | 109.5° |
| CA | CB | H4 | 109.2° | 109.5° |
| N | CA | C | 108.9° | 109.5° |
| CA | N | CAU | 123.3° | 120.0° |
| CA | N | H1 | 118.4° | 120.0° |
| N | CA | H2 | 111.5° | 109.4° |
| CA | C | NAN | 115.5° | 120.0° |
| CA | C | O | 120.6° | 120.0° |
| C | CA | H2 | 110.7° | 109.5° |
| OAV | CAU | N | 122.8° | 120.0° |
| OAV | CAU | C7 | 67.7° | 120.0° |
| CAP | CAQ | NAS | 109.9° | 109.5° |
| CAP | CAQ | CAR | 104.9° | 109.5° |
| CAQ | CAP | H16 | 109.4° | 109.5° |
| CAQ | CAP | H17 | 109.3° | 109.5° |
| CAP | CAQ | H18 | 109.9° | 109.5° |
| CAU | N | H1 | 118.3° | 120.0° |
| N | CAU | C7 | 109.6° | 120.0° |
| C | NAN | CAL | 122.0° | 120.0° |
| NAN | C | O | 123.7° | 120.0° |
| C | NAN | H48 | 119.0° | 120.0° |
| NAN | CAL | CAK | 109.2° | 109.5° |
| NAN | CAL | CAM | 110.4° | 109.5° |
| NAN | CAL | H15 | 110.6° | 109.5° |
| CAL | NAN | H48 | 119.0° | 120.0° |
| CAK | CCM | CCN | 109.5° | 109.5° |
| CCM | CAK | CAL | 111.8° | 109.4° |
| CCM | CAK | H13 | 108.9° | 109.5° |
| CCM | CAK | H14 | 108.9° | 109.5° |
| CAK | CCM | H31 | 109.5° | 109.5° |
| CCM | CCN | CCO | 109.0° | 109.5° |
| CCN | CCM | H31 | 109.3° | 109.5° |
| CCM | CCN | H32 | 109.6° | 109.4° |
| CCM | CCN | H33 | 109.6° | 109.4° |
| CCQ | CCP | CCO | 111.9° | 109.5° |
| CCQ | CCP | H36 | 108.9° | 109.5° |
| CCQ | CCP | H37 | 108.9° | 109.5° |
| CCP | CCQ | H38 | 108.7° | 109.4° |
| CCP | CCQ | H39 | 108.7° | 109.5° |
| CAK | CAL | CAM | 107.3° | 109.5° |
| CAL | CAK | H13 | 108.9° | 109.5° |
| CAL | CAK | H14 | 108.9° | 109.5° |
| CAK | CAL | H15 | 109.5° | 109.5° |
| CAQ | NAS | CAM | 120.3° | 120.0° |
| NAS | CAQ | CAR | 111.1° | 109.4° |
| NAS | CAQ | H18 | 110.6° | 109.5° |
| CAQ | NAS | H49 | 119.9° | 120.0° |
| NAS | CAM | CAL | 116.5° | 120.0° |
| NAS | CAM | OAO | 123.6° | 120.0° |
| CAM | NAS | H49 | 119.9° | 120.0° |
| CAQ | CAR | NAA | 114.8° | 119.9° |
| CAQ | CAR | OAT | 121.4° | 120.0° |
| CAR | CAQ | H18 | 110.2° | 109.4° |
| CCP | CCO | CCN | 109.9° | 109.5° |
| CCP | CCO | H34 | 109.4° | 109.5° |
| CCP | CCO | H35 | 109.4° | 109.5° |
| CCO | CCP | H36 | 108.9° | 109.5° |
| CCO | CCP | H37 | 108.9° | 109.5° |
| CAL | CAM | OAO | 119.8° | 120.0° |
| CAM | CAL | H15 | 109.8° | 109.5° |
| CCO | CCN | H32 | 109.6° | 109.5° |
| CCO | CCN | H33 | 109.6° | 109.5° |
| CCN | CCO | H34 | 109.4° | 109.4° |
| CCN | CCO | H35 | 109.4° | 109.5° |
| NAA | CAR | OAT | 123.7° | 120.0° |
| CAR | NAA | CAB | 119.9° | 120.0° |
| CAR | NAA | H47 | 120.0° | 120.0° |
| NAA | CAB | PAD | 108.8° | 109.5° |
| NAA | CAB | CAC | 107.8° | 109.5° |
| NAA | CAB | H10 | 112.4° | 109.5° |
| CAB | NAA | H47 | 120.1° | 120.0° |
| CCT | OCS | PAD | 125.9° | 114.0° |
| OCS | CCT | CCU | 118.9° | 120.0° |
| OCS | CCT | CCY | 120.1° | 120.1° |
| OCS | PAD | CAB | 104.6° | 109.5° |
| OCS | PAD | OAE | 112.7° | 109.5° |
| OCS | PAD | O1 | 102.8° | 109.5° |
| CCT | CCU | CCV | 119.3° | 119.9° |
| CCU | CCT | CCY | 121.0° | 119.9° |
| CCT | CCU | H42 | 120.4° | 120.0° |
| CCU | CCV | CCW | 119.8° | 120.1° |
| CCV | CCU | H42 | 120.4° | 120.0° |
| CCU | CCV | H43 | 120.1° | 120.0° |
| CCT | CCY | CCX | 119.7° | 119.9° |
| CCT | CCY | H46 | 120.2° | 120.0° |
| CCV | CCW | CCX | 121.0° | 120.1° |
| CCW | CCV | H43 | 120.1° | 119.9° |
| CCV | CCW | H44 | 119.5° | 119.9° |
| CAB | PAD | OAE | 111.5° | 109.5° |
| PAD | CAB | CAC | 108.9° | 109.5° |
| PAD | CAB | H10 | 107.8° | 109.5° |
| CAB | PAD | O1 | 107.3° | 109.4° |
| PAD | OAE | C1 | 144.8° | 114.0° |
| OAE | PAD | O1 | 116.9° | 109.5° |
| CAB | CAC | CCG | 106.6° | 109.5° |
| CAC | CAB | H10 | 111.1° | 109.4° |
| CAB | CAC | H11 | 110.2° | 109.4° |
| CAB | CAC | H12 | 110.2° | 109.5° |
| CAC | CCG | CCH | 109.8° | 109.5° |
| CCG | CAC | H11 | 110.2° | 109.5° |
| CCG | CAC | H12 | 110.2° | 109.5° |
| CAC | CCG | H27 | 109.4° | 109.5° |
| CAC | CCG | H28 | 109.4° | 109.5° |
| CCG | CCH | NCI | 105.5° | 109.5° |
| CCH | CCG | H27 | 109.4° | 109.5° |
| CCH | CCG | H28 | 109.4° | 109.5° |
| CCG | CCH | H29 | 110.5° | 109.5° |
| CCG | CCH | H30 | 110.4° | 109.5° |
| CCY | CCX | CCW | 119.2° | 120.1° |
| CCY | CCX | H45 | 120.4° | 120.0° |
| CCX | CCY | H46 | 120.1° | 120.0° |
| CCH | NCI | CCJ | 124.1° | 120.0° |
| NCI | CCH | H29 | 110.5° | 109.5° |
| NCI | CCH | H30 | 110.5° | 109.5° |
| CCH | NCI | H51 | 118.0° | 120.0° |
| CCX | CCW | H44 | 119.5° | 120.0° |
| CCW | CCX | H45 | 120.4° | 119.9° |
| NCI | CCJ | NCL | 120.8° | 120.0° |
| NCI | CCJ | NCK | 118.0° | 120.0° |
| CCJ | NCI | H51 | 118.0° | 120.0° |
| NCL | CCJ | NCK | 121.2° | 120.0° |
| CCJ | NCL | H54 | 112.0° | 120.0° |
| CCJ | NCK | H52 | 120.0° | 120.0° |
| CCJ | NCK | H53 | 120.0° | 120.0° |
| H3 | CB | H4 | 109.5° | 109.4° |
| H11 | CAC | H12 | 109.5° | 109.5° |
| H13 | CAK | H14 | 109.5° | 109.5° |
| H16 | CAP | H17 | 109.4° | 109.4° |
| H21 | CBD | H22 | 109.5° | 110.3° |
| H27 | CCG | H28 | 109.5° | 109.5° |
| H29 | CCH | H30 | 109.5° | 109.5° |
| H32 | CCN | H33 | 109.4° | 109.5° |
| H34 | CCO | H35 | 109.4° | 109.4° |
| H36 | CCP | H37 | 109.5° | 109.4° |
| H38 | CCQ | H39 | 109.5° | 109.5° |
| H40 | CCR | H41 | 109.4° | 109.4° |
| H52 | NCK | H53 | 120.0° | 119.9° |
| OAE | C1 | C2 | 90.0° | 120.1° |
| OAE | C1 | C6 | 90.0° | 120.1° |
| C1 | C2 | C3 | 90.0° | 119.9° |
| C2 | C1 | C6 | 90.0° | 119.9° |
| C1 | C2 | H19 | 90.0° | 120.0° |
| C2 | C3 | C4 | 90.0° | 120.1° |
| C3 | C2 | H19 | 90.0° | 120.1° |
| C2 | C3 | H55 | 90.0° | 119.9° |
| C3 | C4 | C5 | 90.0° | 120.1° |
| C4 | C3 | H55 | 90.0° | 119.9° |
| C3 | C4 | H56 | 90.0° | 120.0° |
| C4 | C5 | C6 | 90.0° | 120.1° |
| C5 | C4 | H56 | 90.0° | 119.9° |
| C4 | C5 | H57 | 90.0° | 120.0° |
| C5 | C6 | C1 | 90.0° | 119.9° |
| C6 | C5 | H57 | 90.0° | 119.9° |
| C5 | C6 | H58 | 90.0° | 120.1° |
| C1 | C6 | H58 | 90.0° | 120.0° |
| CAU | C7 | C8 | 90.0° | 109.5° |
| CAU | C7 | H59 | 90.0° | 109.5° |
| CAU | C7 | H60 | 90.0° | 109.5° |
| C7 | C8 | C9 | 90.0° | 109.5° |
| C8 | C7 | H59 | 90.0° | 109.5° |
| C8 | C7 | H60 | 90.0° | 109.5° |
| C7 | C8 | H61 | 90.0° | 109.4° |
| C7 | C8 | H62 | 90.0° | 109.4° |
| C8 | C9 | C10 | 90.0° | 109.5° |
| C9 | C8 | H61 | 90.0° | 109.5° |
| C9 | C8 | H62 | 90.0° | 109.5° |
| C8 | C9 | H63 | 90.0° | 109.5° |
| C8 | C9 | H64 | 90.0° | 109.5° |
| C9 | C10 | C11 | 90.0° | 109.5° |
| C10 | C9 | H63 | 90.0° | 109.5° |
| C10 | C9 | H64 | 90.0° | 109.5° |
| C9 | C10 | H65 | 90.0° | 109.5° |
| C9 | C10 | H66 | 90.0° | 109.5° |
| C10 | C11 | N1 | 90.0° | 109.5° |
| C11 | C10 | H65 | 90.0° | 109.5° |
| C11 | C10 | H66 | 90.0° | 109.5° |
| C10 | C11 | H67 | 90.0° | 109.5° |
| C10 | C11 | H68 | 90.0° | 109.5° |
| C11 | N1 | C13 | 90.0° | 120.0° |
| N1 | C11 | H67 | 90.0° | 109.5° |
| N1 | C11 | H68 | 90.0° | 109.5° |
| C11 | N1 | H69 | 90.0° | 120.0° |
| N1 | C13 | C14 | 90.0° | 120.0° |
| N1 | C13 | O2 | 90.0° | 120.0° |
| C13 | N1 | H69 | 90.0° | 120.0° |
| C13 | C14 | C15 | 90.0° | 109.4° |
| C14 | C13 | O2 | 90.0° | 120.0° |
| C13 | C14 | H70 | 90.0° | 109.5° |
| C13 | C14 | H71 | 90.0° | 109.5° |
| C14 | C15 | C16 | 90.0° | 109.5° |
| C15 | C14 | H70 | 90.0° | 109.5° |
| C15 | C14 | H71 | 90.0° | 109.5° |
| C14 | C15 | H72 | 90.0° | 109.5° |
| C14 | C15 | H73 | 90.0° | 109.5° |
| C15 | C16 | C17 | 90.0° | 109.5° |
| C16 | C15 | H72 | 90.0° | 109.5° |
| C16 | C15 | H73 | 90.0° | 109.5° |
| C15 | C16 | H74 | 90.0° | 109.5° |
| C15 | C16 | H75 | 90.0° | 109.5° |
| C16 | C17 | C18 | 90.0° | 109.5° |
| C17 | C16 | H74 | 90.0° | 109.5° |
| C17 | C16 | H75 | 90.0° | 109.5° |
| C16 | C17 | H76 | 90.0° | 109.5° |
| C16 | C17 | H77 | 90.0° | 109.5° |
| C17 | C18 | C12 | 90.0° | 110.8° |
| C17 | C18 | S1 | 90.0° | 110.8° |
| C18 | C17 | H76 | 90.0° | 109.5° |
| C18 | C17 | H77 | 90.0° | 109.5° |
| C17 | C18 | H78 | 90.0° | 110.7° |
| C18 | C12 | C19 | 90.0° | 112.3° |
| C12 | C18 | S1 | 90.0° | 102.7° |
| C18 | C12 | N2 | 90.0° | 109.2° |
| C12 | C18 | H78 | 90.0° | 110.7° |
| C18 | C12 | H79 | 90.0° | 110.2° |
| C12 | C19 | C20 | 90.0° | 112.4° |
| C12 | C19 | N3 | 90.0° | 104.0° |
| C19 | C12 | N2 | 90.0° | 104.0° |
| C19 | C12 | H79 | 90.0° | 110.3° |
| C12 | C19 | H80 | 90.0° | 110.3° |
| C19 | C20 | S1 | 90.0° | 102.7° |
| C20 | C19 | N3 | 90.0° | 109.2° |
| C20 | C19 | H80 | 90.0° | 110.3° |
| C19 | C20 | H81 | 90.0° | 110.8° |
| C19 | C20 | H82 | 90.0° | 110.8° |
| C20 | S1 | C18 | 90.0° | 94.8° |
| S1 | C20 | H81 | 90.0° | 110.8° |
| S1 | C20 | H82 | 90.0° | 110.7° |
| S1 | C18 | H78 | 90.0° | 110.9° |
| C19 | N3 | C22 | 90.0° | 109.1° |
| N3 | C19 | H80 | 90.0° | 110.5° |
| C19 | N3 | H83 | 90.0° | 125.5° |
| N3 | C22 | N2 | 90.0° | 113.8° |
| N3 | C22 | O3 | 90.0° | 123.1° |
| C22 | N3 | H83 | 90.0° | 125.4° |
| C22 | N2 | C12 | 90.0° | 109.1° |
| N2 | C22 | O3 | 90.0° | 123.1° |
| C22 | N2 | H84 | 90.0° | 125.5° |
| N2 | C12 | H79 | 90.0° | 110.6° |
| C12 | N2 | H84 | 90.0° | 125.5° |
| H59 | C7 | H60 | 90.0° | 109.5° |
| H61 | C8 | H62 | 90.0° | 109.5° |
| H63 | C9 | H64 | 90.0° | 109.5° |
| H65 | C10 | H66 | 90.0° | 109.5° |
| H67 | C11 | H68 | 90.0° | 109.5° |
| H70 | C14 | H71 | 90.0° | 109.5° |
| H72 | C15 | H73 | 90.0° | 109.5° |
| H74 | C16 | H75 | 90.0° | 109.5° |
| H76 | C17 | H77 | 90.0° | 109.5° |
| H81 | C20 | H82 | 90.0° | 110.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CBG | CBH | CBB | H26 | 180.0° | 180.0° |
| CBH | CBG | CBF | H25 | 180.0° | 180.0° |
| CBG | CBH | CBB | NBC | 179.4° | 179.9° |
| CBG | CBH | CBB | CBA | 0.8° | 0.0° |
| CBH | CBG | CBF | CBE | 0.8° | 0.0° |
| CBH | CBG | CBF | H24 | 179.2° | 180.0° |
| CBB | CBH | CBG | CBF | 0.9° | 0.0° |
| CBH | CBB | NBC | CBA | 179.8° | 179.9° |
| CBH | CBB | NBC | CBD | 160.1° | 180.0° |
| CBH | CBB | CBA | CBE | 0.5° | 0.0° |
| CBH | CBB | CBA | CAZ | 179.0° | 179.9° |
| CBB | CBH | CBG | H25 | 179.1° | 180.0° |
| CBH | CBB | NBC | H50 | 80.0° | 0.0° |
| CZ | CE1 | CD1 | H7 | 180.0° | 179.8° |
| CE1 | CZ | CE2 | H9 | 180.0° | 179.8° |
| CZ | CE1 | CD1 | CG | 0.4° | 0.0° |
| CE1 | CZ | CE2 | CD2 | 0.6° | 0.4° |
| CZ | CE1 | CD1 | H5 | 179.6° | 179.9° |
| CE1 | CZ | CE2 | H8 | 179.3° | 179.9° |
| CD1 | CE1 | CZ | CE2 | 0.3° | 0.2° |
| CE1 | CD1 | CG | H5 | 180.0° | 179.9° |
| CE1 | CD1 | CG | CD2 | 0.6° | 0.1° |
| CE1 | CD1 | CG | CB | 180.0° | 179.7° |
| CD1 | CE1 | CZ | H9 | 179.7° | 180.0° |
| CZ | CE2 | CD2 | H8 | 180.0° | 179.6° |
| CZ | CE2 | CD2 | CG | 0.4° | 0.4° |
| CZ | CE2 | CD2 | H6 | 179.6° | 179.5° |
| CE2 | CZ | CE1 | H7 | 179.7° | 180.0° |
| CBG | CBF | CBE | H24 | 180.0° | 179.9° |
| CBG | CBF | CBE | CBA | 0.5° | 0.0° |
| CBG | CBF | CBE | H23 | 179.6° | 180.0° |
| CBF | CBG | CBH | H26 | 179.1° | 180.0° |
| CBB | NBC | CBD | H50 | 119.9° | 180.0° |
| CBB | NBC | CBD | CAZ | 30.1° | 0.1° |
| NBC | CBB | CBA | CBE | 179.7° | 180.0° |
| NBC | CBB | CBA | CAZ | 0.9° | 0.0° |
| CBB | NBC | CBD | H21 | 148.1° | 119.0° |
| CBB | NBC | CBD | H22 | 87.9° | 118.8° |
| NBC | CBB | CBH | H26 | 0.6° | 0.0° |
| CBD | NBC | CBB | CBA | 20.1° | 0.0° |
| NBC | CBD | CAZ | H21 | 118.0° | 118.9° |
| NBC | CBD | CAZ | H22 | 118.0° | 118.9° |
| NBC | CBD | CAZ | CBA | 29.2° | 0.1° |
| NBC | CBD | CAZ | CAP | 146.8° | 118.8° |
| NBC | CBD | CAZ | H20 | 91.4° | 118.9° |
| NBC | CBD | H21 | H22 | 125.7° | 122.3° |
| CBB | CBA | CBE | CBF | 0.3° | 0.0° |
| CBB | CBA | CAZ | CBD | 20.5° | 0.0° |
| CBB | CBA | CBE | CAZ | 179.3° | 180.0° |
| CBB | CBA | CAZ | CAP | 138.0° | 118.8° |
| CBB | CBA | CAZ | H20 | 99.0° | 118.9° |
| CBB | CBA | CBE | H23 | 179.7° | 180.0° |
| CBA | CBB | CBH | H26 | 179.2° | 180.0° |
| CBA | CBB | NBC | H50 | 99.8° | 179.9° |
| CD1 | CG | CD2 | CE2 | 0.2° | 0.3° |
| CD1 | CG | CD2 | CB | 179.4° | 179.6° |
| CD1 | CG | CB | CA | 87.4° | 89.7° |
| CD1 | CG | CB | H3 | 152.4° | 150.3° |
| CD1 | CG | CB | H4 | 32.8° | 30.4° |
| CD1 | CG | CD2 | H6 | 179.8° | 179.7° |
| CG | CD1 | CE1 | H7 | 179.6° | 179.8° |
| CE2 | CD2 | CG | H6 | 180.0° | 180.0° |
| CE2 | CD2 | CG | CB | 179.6° | 179.9° |
| CD2 | CE2 | CZ | H9 | 179.3° | 179.8° |
| CBF | CBE | CBA | H23 | 180.0° | 180.0° |
| CBF | CBE | CBA | CAZ | 179.0° | 179.9° |
| CBE | CBF | CBG | H25 | 179.2° | 179.9° |
| CBD | CAZ | CBA | CBE | 160.2° | 180.0° |
| CBD | CAZ | CBA | CAP | 117.5° | 118.8° |
| CBD | CAZ | CBA | H20 | 119.5° | 118.9° |
| CBD | CAZ | CAP | H20 | 121.7° | 122.4° |
| CBD | CAZ | CAP | CAQ | 76.1° | 70.7° |
| CBD | CAZ | CAP | H16 | 44.0° | 169.3° |
| CBD | CAZ | CAP | H17 | 163.8° | 49.3° |
| CAZ | CBD | H21 | H22 | 125.7° | 122.2° |
| CAZ | CBD | NBC | H50 | 89.8° | 179.9° |
| CBE | CBA | CAZ | CAP | 42.7° | 61.2° |
| CBE | CBA | CAZ | H20 | 80.3° | 61.1° |
| CBA | CBE | CBF | H24 | 179.5° | 180.0° |
| CBA | CAZ | CAP | H20 | 124.0° | 122.3° |
| CBA | CAZ | CAP | CAQ | 169.6° | 174.0° |
| CBA | CAZ | CAP | H16 | 70.3° | 54.0° |
| CBA | CAZ | CAP | H17 | 49.5° | 66.0° |
| CBA | CAZ | CBD | H21 | 147.2° | 118.9° |
| CBA | CAZ | CBD | H22 | 88.8° | 118.9° |
| CAZ | CBA | CBE | H23 | 1.0° | 0.0° |
| CAZ | CAP | CAQ | H16 | 120.1° | 120.0° |
| CAZ | CAP | CAQ | H17 | 120.1° | 120.0° |
| CAZ | CAP | CAQ | NAS | 75.8° | 65.8° |
| CAZ | CAP | CAQ | CAR | 164.6° | 174.3° |
| CAZ | CAP | H16 | H17 | 119.8° | 120.0° |
| CAZ | CAP | CAQ | H18 | 46.2° | 54.2° |
| CAP | CAZ | CBD | H21 | 95.2° | 0.1° |
| CAP | CAZ | CBD | H22 | 28.9° | 122.3° |
| CD2 | CG | CB | CA | 93.2° | 90.0° |
| CD2 | CG | CB | H3 | 27.0° | 30.1° |
| CD2 | CG | CB | H4 | 146.6° | 150.0° |
| CD2 | CG | CD1 | H5 | 179.4° | 180.0° |
| CG | CD2 | CE2 | H8 | 179.6° | 180.0° |
| CG | CB | CA | H3 | 120.2° | 120.0° |
| CG | CB | CA | H4 | 120.2° | 120.0° |
| CG | CB | CA | N | 77.5° | 65.0° |
| CG | CB | CA | C | 165.6° | 175.0° |
| CG | CB | CA | H2 | 44.8° | 55.0° |
| CG | CB | H3 | H4 | 119.5° | 119.9° |
| CB | CG | CD1 | H5 | 0.0° | 0.4° |
| CB | CG | CD2 | H6 | 0.4° | 0.0° |
| CCM | CCR | CCQ | H40 | 120.3° | 120.0° |
| CCM | CCR | CCQ | H41 | 120.3° | 120.1° |
| CCR | CCM | CAK | CCN | 120.8° | 120.0° |
| CCR | CCM | CAK | H31 | 119.4° | 120.0° |
| CCR | CCM | CCN | H31 | 120.8° | 120.0° |
| CCM | CCR | CCQ | CCP | 56.9° | 60.0° |
| CCR | CCM | CAK | CAL | 173.6° | 65.1° |
| CCR | CCM | CCN | CCO | 53.0° | 60.0° |
| CCR | CCM | CAK | H13 | 66.1° | 54.8° |
| CCR | CCM | CAK | H14 | 53.3° | 174.9° |
| CCR | CCM | CCN | H32 | 66.9° | 60.0° |
| CCR | CCM | CCN | H33 | 173.0° | 180.0° |
| CCM | CCR | CCQ | H38 | 177.4° | 180.0° |
| CCM | CCR | CCQ | H39 | 63.5° | 60.0° |
| CCM | CCR | H40 | H41 | 119.1° | 120.0° |
| CCQ | CCR | CCM | CAK | 113.1° | NaN° |
| CCQ | CCR | CCM | CCN | 6.9° | 60.0° |
| CCR | CCQ | CCP | H38 | 120.5° | 119.9° |
| CCR | CCQ | CCP | H39 | 120.5° | 120.0° |
| CCR | CCQ | CCP | CCO | 44.9° | 60.0° |
| CCQ | CCR | CCM | H31 | 127.6° | 60.0° |
| CCR | CCQ | CCP | H36 | 75.4° | 60.0° |
| CCR | CCQ | CCP | H37 | 165.3° | 180.0° |
| CCR | CCQ | H38 | H39 | 118.6° | 120.0° |
| CCQ | CCR | H40 | H41 | 119.1° | 120.0° |
| CB | CA | N | C | 115.8° | 120.0° |
| CB | CA | N | H2 | 121.8° | 120.0° |
| CB | CA | C | H2 | 120.8° | 120.0° |
| CB | CA | N | CAU | 177.0° | 85.0° |
| CB | CA | C | NAN | 110.4° | 60.0° |
| CB | CA | C | O | 72.6° | 120.0° |
| CB | CA | N | H1 | 3.0° | 94.8° |
| CA | CB | H3 | H4 | 119.5° | 120.0° |
| N | CA | C | H2 | 122.9° | 119.9° |
| CA | N | CAU | OAV | 1.2° | 0.3° |
| CA | N | CAU | H1 | 180.0° | 179.8° |
| N | CA | C | NAN | 133.4° | 180.0° |
| N | CA | C | O | 43.7° | 0.0° |
| N | CA | CB | H3 | 42.7° | 175.0° |
| N | CA | CB | H4 | 162.4° | 55.0° |
| CA | N | CAU | C7 | 74.3° | 179.7° |
| C | CA | N | CAU | 61.2° | 155.0° |
| CA | C | NAN | O | 177.0° | 180.0° |
| CA | C | NAN | CAL | 179.2° | 175.0° |
| C | CA | N | H1 | 118.8° | 25.3° |
| C | CA | CB | H3 | 74.3° | 55.0° |
| C | CA | CB | H4 | 45.4° | 65.0° |
| CA | C | NAN | H48 | 0.8° | 5.0° |
| OAV | CAU | N | C7 | 75.5° | 180.0° |
| OAV | CAU | N | H1 | 178.8° | 180.0° |
| OAV | CAU | C7 | C8 | 90.0° | 0.0° |
| OAV | CAU | C7 | H59 | 90.0° | 120.0° |
| OAV | CAU | C7 | H60 | 90.0° | 120.0° |
| CAP | CAQ | NAS | CAR | 115.7° | 120.0° |
| CAP | CAQ | NAS | H18 | 121.5° | 120.0° |
| CAP | CAQ | NAS | CAM | 176.1° | 85.0° |
| CAP | CAQ | CAR | H18 | 118.2° | 120.0° |
| CAP | CAQ | CAR | NAA | 92.6° | 66.1° |
| CAP | CAQ | CAR | OAT | 84.2° | 113.8° |
| CAQ | CAP | H16 | H17 | 119.7° | 120.0° |
| CAQ | CAP | CAZ | H20 | 45.6° | 51.7° |
| CAP | CAQ | NAS | H49 | 3.9° | 95.0° |
| CAU | N | CA | H2 | 61.2° | 35.0° |
| N | CAU | C7 | C8 | 90.0° | 180.0° |
| N | CAU | C7 | H59 | 90.0° | 60.0° |
| N | CAU | C7 | H60 | 90.0° | 60.0° |
| C | NAN | CAL | H48 | 180.0° | 180.0° |
| C | NAN | CAL | CAK | 142.5° | 88.3° |
| C | NAN | CAL | CAM | 99.8° | 151.7° |
| NAN | C | CA | H2 | 10.5° | 60.0° |
| C | NAN | CAL | H15 | 21.9° | 31.7° |
| NAN | CAL | CAK | CCM | 64.4° | 179.3° |
| NAN | CAL | CAK | CAM | 119.6° | 120.0° |
| NAN | CAL | CAK | H15 | 121.2° | 120.0° |
| NAN | CAL | CAM | NAS | 5.5° | 158.3° |
| CAL | NAN | C | O | 2.2° | 5.0° |
| NAN | CAL | CAM | H15 | 122.2° | 120.0° |
| NAN | CAL | CAM | OAO | 171.2° | 21.7° |
| NAN | CAL | CAK | H13 | 175.3° | 59.4° |
| NAN | CAL | CAK | H14 | 55.9° | 60.7° |
| CAK | CCM | CCN | H31 | 119.9° | 120.0° |
| CCM | CAK | CAL | H13 | 120.3° | 120.0° |
| CCM | CAK | CAL | H14 | 120.3° | 120.0° |
| CCM | CAK | CAL | CAM | 175.9° | 60.6° |
| CAK | CCM | CCN | CCO | 172.4° | 180.0° |
| CCM | CAK | H13 | H14 | 118.9° | 120.0° |
| CCM | CAK | CAL | H15 | 56.8° | 59.4° |
| CAK | CCM | CCN | H32 | 52.4° | 60.0° |
| CAK | CCM | CCN | H33 | 67.7° | 60.0° |
| CAK | CCM | CCR | H40 | 126.6° | 60.0° |
| CAK | CCM | CCR | H41 | 7.2° | 60.0° |
| CCN | CCM | CAK | CAL | 65.6° | 174.9° |
| CCM | CCN | CCO | CCP | 65.2° | 60.0° |
| CCM | CCN | CCO | H32 | 119.9° | 120.0° |
| CCM | CCN | CCO | H33 | 119.9° | 120.0° |
| CCN | CCM | CAK | H13 | 54.8° | 65.2° |
| CCN | CCM | CAK | H14 | 174.1° | 54.9° |
| CCM | CCN | H32 | H33 | 120.2° | 119.9° |
| CCM | CCN | CCO | H34 | 54.9° | 180.0° |
| CCM | CCN | CCO | H35 | 174.7° | 60.0° |
| CCN | CCM | CCR | H40 | 113.4° | 180.0° |
| CCN | CCM | CCR | H41 | 127.2° | 60.0° |
| CCQ | CCP | CCO | H36 | 120.4° | 120.1° |
| CCQ | CCP | CCO | H37 | 120.4° | 120.0° |
| CCQ | CCP | CCO | CCN | 15.7° | 60.0° |
| CCQ | CCP | CCO | H34 | 104.4° | 180.0° |
| CCQ | CCP | CCO | H35 | 135.7° | 60.0° |
| CCQ | CCP | H36 | H37 | 118.9° | 120.0° |
| CCP | CCQ | H38 | H39 | 118.6° | 120.0° |
| CCP | CCQ | CCR | H40 | 63.4° | 179.9° |
| CCP | CCQ | CCR | H41 | 177.3° | 60.0° |
| CAK | CAL | CAM | NAS | 124.4° | 81.7° |
| CAK | CAL | CAM | H15 | 119.0° | 120.0° |
| CAK | CAL | CAM | OAO | 52.4° | 98.3° |
| CAL | CAK | H13 | H14 | 118.9° | 120.0° |
| CAL | CAK | CCM | H31 | 54.2° | 54.9° |
| CAK | CAL | NAN | H48 | 37.5° | 91.7° |
| CAQ | NAS | CAM | H49 | 180.0° | 180.0° |
| NAS | CAQ | CAR | H18 | 123.0° | 119.9° |
| CAQ | NAS | CAM | CAL | 175.9° | 175.3° |
| CAQ | NAS | CAM | OAO | 0.8° | 4.7° |
| NAS | CAQ | CAR | NAA | 148.6° | 173.9° |
| NAS | CAQ | CAR | OAT | 34.6° | 6.2° |
| NAS | CAQ | CAP | H16 | 164.1° | 54.3° |
| NAS | CAQ | CAP | H17 | 44.3° | 174.2° |
| CAM | NAS | CAQ | CAR | 60.4° | 155.0° |
| NAS | CAM | CAL | OAO | 176.8° | 180.0° |
| NAS | CAM | CAL | H15 | 116.7° | 38.3° |
| CAM | NAS | CAQ | H18 | 62.3° | 35.1° |
| CAQ | CAR | NAA | OAT | 176.7° | 179.9° |
| CAQ | CAR | NAA | CAB | 178.2° | 174.2° |
| CAR | CAQ | CAP | H16 | 44.5° | 65.7° |
| CAR | CAQ | CAP | H17 | 75.3° | 54.3° |
| CAQ | CAR | NAA | H47 | 1.8° | 5.8° |
| CAR | CAQ | NAS | H49 | 119.6° | 25.0° |
| O | C | CA | H2 | 166.6° | 120.0° |
| O | C | NAN | H48 | 177.8° | 175.0° |
| CCP | CCO | CCN | H34 | 120.1° | 120.0° |
| CCP | CCO | CCN | H35 | 120.1° | 120.1° |
| CCP | CCO | CCN | H32 | 54.7° | 60.0° |
| CCP | CCO | CCN | H33 | 174.8° | 180.0° |
| CCP | CCO | H34 | H35 | 119.8° | 120.0° |
| CCO | CCP | H36 | H37 | 118.9° | 120.0° |
| CCO | CCP | CCQ | H38 | 165.4° | 180.0° |
| CCO | CCP | CCQ | H39 | 75.5° | 60.0° |
| CAM | CAL | CAK | H13 | 55.6° | 179.4° |
| CAM | CAL | CAK | H14 | 63.7° | 59.3° |
| CAM | CAL | NAN | H48 | 80.2° | 28.3° |
| CAL | CAM | NAS | H49 | 4.1° | 4.7° |
| OAO | CAM | CAL | H15 | 66.6° | 141.7° |
| OAO | CAM | NAS | H49 | 179.2° | 175.3° |
| CCO | CCN | CCM | H31 | 67.8° | 60.0° |
| CCO | CCN | H32 | H33 | 120.2° | 120.1° |
| CCN | CCO | H34 | H35 | 119.8° | 119.9° |
| CCN | CCO | CCP | H36 | 136.0° | 60.0° |
| CCN | CCO | CCP | H37 | 104.7° | 180.0° |
| CAR | NAA | CAB | H47 | 180.0° | 180.0° |
| CAR | NAA | CAB | PAD | 117.1° | 105.0° |
| CAR | NAA | CAB | CAC | 125.0° | 134.9° |
| CAR | NAA | CAB | H10 | 2.2° | 14.9° |
| NAA | CAR | CAQ | H18 | 25.6° | 53.9° |
| OAT | CAR | NAA | CAB | 5.1° | 5.7° |
| OAT | CAR | CAQ | H18 | 157.6° | 126.2° |
| OAT | CAR | NAA | H47 | 174.9° | 174.3° |
| NAA | CAB | PAD | OCS | 44.2° | 73.8° |
| NAA | CAB | PAD | CAC | 117.2° | 120.1° |
| NAA | CAB | PAD | H10 | 122.1° | 120.0° |
| NAA | CAB | PAD | OAE | 166.3° | 166.1° |
| NAA | CAB | CAC | H10 | 123.5° | 120.0° |
| NAA | CAB | CAC | CCG | 76.2° | 65.2° |
| NAA | CAB | CAC | H11 | 43.3° | 54.8° |
| NAA | CAB | CAC | H12 | 164.2° | 174.7° |
| NAA | CAB | PAD | O1 | 64.5° | 46.1° |
| OCS | CCT | CCU | CCY | 177.4° | 179.8° |
| OCS | CCT | CCU | CCV | 179.0° | 179.8° |
| CCT | OCS | PAD | CAB | 113.7° | 81.4° |
| CCT | OCS | PAD | OAE | 7.6° | 158.5° |
| OCS | CCT | CCY | CCX | 179.4° | 179.8° |
| OCS | CCT | CCU | H42 | 1.0° | 0.3° |
| OCS | CCT | CCY | H46 | 0.6° | 0.2° |
| CCT | OCS | PAD | O1 | 134.3° | 38.5° |
| PAD | OCS | CCT | CCU | 109.2° | 95.0° |
| PAD | OCS | CCT | CCY | 73.3° | 84.8° |
| OCS | PAD | CAB | OAE | 122.2° | 120.0° |
| OCS | PAD | CAB | O1 | 108.7° | 120.0° |
| OCS | PAD | OAE | O1 | 118.7° | 120.0° |
| OCS | PAD | CAB | CAC | 161.4° | 46.2° |
| OCS | PAD | CAB | H10 | 78.0° | 166.2° |
| OCS | PAD | OAE | C1 | 169.3° | 62.2° |
| CCT | CCU | CCV | H42 | 180.0° | 180.0° |
| CCT | CCU | CCV | CCW | 0.5° | 0.0° |
| CCU | CCT | CCY | CCX | 2.0° | 0.0° |
| CCT | CCU | CCV | H43 | 179.6° | 180.0° |
| CCU | CCT | CCY | H46 | 178.0° | 180.0° |
| CCV | CCU | CCT | CCY | 1.6° | 0.0° |
| CCU | CCV | CCW | H43 | 180.0° | 180.0° |
| CCU | CCV | CCW | CCX | 0.2° | 0.0° |
| CCU | CCV | CCW | H44 | 179.8° | 180.0° |
| CCT | CCY | CCX | H46 | 180.0° | 179.9° |
| CCT | CCY | CCX | CCW | 1.3° | 0.0° |
| CCY | CCT | CCU | H42 | 178.4° | 180.0° |
| CCT | CCY | CCX | H45 | 178.7° | 180.0° |
| CCV | CCW | CCX | CCY | 0.2° | 0.1° |
| CCV | CCW | CCX | H44 | 180.0° | 179.9° |
| CCW | CCV | CCU | H42 | 179.5° | 180.0° |
| CCV | CCW | CCX | H45 | 179.8° | 180.0° |
| CAB | PAD | OAE | O1 | 123.9° | 120.0° |
| PAD | CAB | CAC | H10 | 118.6° | 120.0° |
| PAD | CAB | CAC | CCG | 165.9° | 174.7° |
| PAD | CAB | CAC | H11 | 74.6° | 65.3° |
| PAD | CAB | CAC | H12 | 46.3° | 54.7° |
| PAD | CAB | NAA | H47 | 62.9° | 75.0° |
| CAB | PAD | OAE | C1 | 52.0° | 177.8° |
| OAE | PAD | CAB | CAC | 76.5° | 73.8° |
| OAE | PAD | CAB | H10 | 44.2° | 46.2° |
| PAD | OAE | C1 | C2 | 90.0° | 85.8° |
| PAD | OAE | C1 | C6 | 90.0° | 94.6° |
| CAB | CAC | CCG | H11 | 119.5° | 120.0° |
| CAB | CAC | CCG | H12 | 119.6° | 120.0° |
| CAB | CAC | CCG | CCH | 173.8° | 175.0° |
| CAB | CAC | H11 | H12 | 121.3° | 120.0° |
| CAB | CAC | CCG | H27 | 66.2° | 55.0° |
| CAB | CAC | CCG | H28 | 53.8° | 65.0° |
| CAC | CAB | NAA | H47 | 55.0° | 45.0° |
| CAC | CAB | PAD | O1 | 52.7° | 166.2° |
| CAC | CCG | CCH | H27 | 120.0° | 120.0° |
| CAC | CCG | CCH | H28 | 120.0° | 120.0° |
| CAC | CCG | CCH | NCI | 173.6° | 180.0° |
| CCG | CAC | CAB | H10 | 47.3° | 54.7° |
| CCG | CAC | H11 | H12 | 121.3° | 120.1° |
| CAC | CCG | H27 | H28 | 119.9° | 120.0° |
| CAC | CCG | CCH | H29 | 67.1° | 60.0° |
| CAC | CCG | CCH | H30 | 54.2° | 60.0° |
| CCG | CCH | NCI | H29 | 119.4° | 120.0° |
| CCG | CCH | NCI | H30 | 119.4° | 120.0° |
| CCG | CCH | NCI | CCJ | 176.6° | 180.0° |
| CCH | CCG | CAC | H11 | 54.3° | 65.0° |
| CCH | CCG | CAC | H12 | 66.6° | 55.0° |
| CCH | CCG | H27 | H28 | 119.8° | 120.0° |
| CCG | CCH | H29 | H30 | 121.8° | 120.0° |
| CCG | CCH | NCI | H51 | 3.4° | 0.1° |
| CCY | CCX | CCW | H45 | 180.0° | 180.0° |
| CCY | CCX | CCW | H44 | 179.8° | 180.0° |
| CCH | NCI | CCJ | H51 | 180.0° | 179.9° |
| CCH | NCI | CCJ | NCL | 3.2° | 179.9° |
| CCH | NCI | CCJ | NCK | 179.3° | 0.0° |
| NCI | CCH | CCG | H27 | 53.5° | 59.9° |
| NCI | CCH | CCG | H28 | 66.4° | 60.0° |
| NCI | CCH | H29 | H30 | 121.8° | 120.0° |
| CCX | CCW | CCV | H43 | 179.8° | 179.9° |
| CCW | CCX | CCY | H46 | 178.7° | 179.9° |
| NCI | CCJ | NCL | NCK | 177.5° | 179.9° |
| CCJ | NCI | CCH | H29 | 64.0° | 60.0° |
| CCJ | NCI | CCH | H30 | 57.2° | 60.0° |
| NCI | CCJ | NCK | H52 | 177.5° | 0.1° |
| NCI | CCJ | NCK | H53 | 2.4° | 180.0° |
| NCI | CCJ | NCL | H54 | 177.5° | 180.0° |
| NCL | CCJ | NCI | H51 | 176.8° | 0.0° |
| NCL | CCJ | NCK | H52 | 0.0° | 180.0° |
| NCL | CCJ | NCK | H53 | 180.0° | 0.1° |
| NCK | CCJ | NCI | H51 | 0.7° | 179.9° |
| CCJ | NCK | H52 | H53 | 180.0° | 179.9° |
| NCK | CCJ | NCL | H54 | 0.0° | 0.1° |
| H1 | N | CA | H2 | 118.8° | 145.2° |
| H1 | N | CAU | C7 | 105.7° | 0.0° |
| H2 | CA | CB | H3 | 164.9° | 65.1° |
| H2 | CA | CB | H4 | 75.4° | 175.0° |
| H5 | CD1 | CE1 | H7 | 0.4° | 0.3° |
| H6 | CD2 | CE2 | H8 | 0.5° | 0.0° |
| H7 | CE1 | CZ | H9 | 0.3° | 0.2° |
| H8 | CE2 | CZ | H9 | 0.7° | 0.2° |
| H10 | CAB | CAC | H11 | 166.8° | 174.7° |
| H10 | CAB | CAC | H12 | 72.3° | 65.3° |
| H10 | CAB | NAA | H47 | 177.8° | 165.0° |
| H10 | CAB | PAD | O1 | 173.3° | 73.9° |
| H11 | CAC | CCG | H27 | 174.3° | 175.0° |
| H11 | CAC | CCG | H28 | 65.8° | 54.9° |
| H12 | CAC | CCG | H27 | 53.4° | 65.0° |
| H12 | CAC | CCG | H28 | 173.3° | 175.0° |
| H13 | CAK | CAL | H15 | 63.5° | 60.6° |
| H13 | CAK | CCM | H31 | 174.6° | 174.8° |
| H14 | CAK | CAL | H15 | 177.1° | 179.3° |
| H14 | CAK | CCM | H31 | 66.1° | 65.1° |
| H15 | CAL | NAN | H48 | 158.1° | 148.3° |
| H16 | CAP | CAQ | H18 | 73.9° | 174.3° |
| H16 | CAP | CAZ | H20 | 165.7° | 68.3° |
| H17 | CAP | CAQ | H18 | 166.3° | 65.8° |
| H17 | CAP | CAZ | H20 | 74.5° | 171.7° |
| H18 | CAQ | NAS | H49 | 117.7° | 145.0° |
| H20 | CAZ | CBD | H21 | 26.6° | 122.2° |
| H20 | CAZ | CBD | H22 | 150.6° | 0.1° |
| H21 | CBD | NBC | H50 | 28.1° | 61.0° |
| H22 | CBD | NBC | H50 | 152.2° | 61.2° |
| H23 | CBE | CBF | H24 | 0.5° | 0.1° |
| H24 | CBF | CBG | H25 | 0.8° | 0.0° |
| H25 | CBG | CBH | H26 | 0.9° | 0.0° |
| H27 | CCG | CCH | H29 | 172.9° | 180.0° |
| H27 | CCG | CCH | H30 | 65.9° | 60.0° |
| H28 | CCG | CCH | H29 | 53.0° | 60.0° |
| H28 | CCG | CCH | H30 | 174.2° | 180.0° |
| H29 | CCH | NCI | H51 | 116.0° | 120.0° |
| H30 | CCH | NCI | H51 | 122.8° | 120.0° |
| H31 | CCM | CCN | H32 | 172.3° | 180.0° |
| H31 | CCM | CCN | H33 | 52.2° | 60.0° |
| H31 | CCM | CCR | H40 | 7.2° | 60.0° |
| H31 | CCM | CCR | H41 | 112.1° | 179.9° |
| H32 | CCN | CCO | H34 | 174.8° | 60.1° |
| H32 | CCN | CCO | H35 | 65.4° | 180.0° |
| H33 | CCN | CCO | H34 | 65.1° | 60.0° |
| H33 | CCN | CCO | H35 | 54.8° | 59.9° |
| H34 | CCO | CCP | H36 | 15.9° | 60.0° |
| H34 | CCO | CCP | H37 | 135.2° | 60.0° |
| H35 | CCO | CCP | H36 | 103.9° | 179.9° |
| H35 | CCO | CCP | H37 | 15.4° | 60.0° |
| H36 | CCP | CCQ | H38 | 45.1° | 59.9° |
| H36 | CCP | CCQ | H39 | 164.1° | 180.0° |
| H37 | CCP | CCQ | H38 | 74.2° | 60.1° |
| H37 | CCP | CCQ | H39 | 44.8° | 60.0° |
| H38 | CCQ | CCR | H40 | 57.1° | 60.0° |
| H38 | CCQ | CCR | H41 | 62.3° | 59.9° |
| H39 | CCQ | CCR | H40 | 176.1° | 60.0° |
| H39 | CCQ | CCR | H41 | 56.8° | 180.0° |
| H42 | CCU | CCV | H43 | 0.4° | 0.0° |
| H43 | CCV | CCW | H44 | 0.2° | 0.0° |
| H44 | CCW | CCX | H45 | 0.2° | 0.1° |
| H45 | CCX | CCY | H46 | 1.3° | 0.0° |
| OAE | C1 | C2 | C6 | 90.0° | 179.6° |
| OAE | C1 | C2 | C3 | 90.0° | 180.0° |
| OAE | C1 | C6 | C5 | 90.0° | 179.7° |
| C1 | OAE | PAD | O1 | 71.9° | 57.8° |
| OAE | C1 | C2 | H19 | 90.0° | 0.1° |
| OAE | C1 | C6 | H58 | 90.0° | 0.3° |
| C1 | C2 | C3 | H19 | 90.0° | 179.9° |
| C1 | C2 | C3 | C4 | 90.0° | 0.0° |
| C2 | C1 | C6 | C5 | 90.0° | 0.6° |
| C1 | C2 | C3 | H55 | 90.0° | 179.9° |
| C2 | C1 | C6 | H58 | 90.0° | 180.0° |
| C2 | C3 | C4 | H55 | 90.0° | 180.0° |
| C2 | C3 | C4 | C5 | 90.0° | 0.1° |
| C3 | C2 | C1 | C6 | 90.0° | 0.3° |
| C2 | C3 | C4 | H56 | 90.0° | 179.9° |
| C3 | C4 | C5 | H56 | 90.0° | 179.9° |
| C3 | C4 | C5 | C6 | 90.0° | 0.4° |
| C4 | C3 | C2 | H19 | 90.0° | 180.0° |
| C3 | C4 | C5 | H57 | 90.0° | 180.0° |
| C4 | C5 | C6 | H57 | 90.0° | 179.7° |
| C4 | C5 | C6 | C1 | 90.0° | 0.6° |
| C5 | C4 | C3 | H55 | 90.0° | 179.9° |
| C4 | C5 | C6 | H58 | 90.0° | 180.0° |
| C5 | C6 | C1 | H58 | 90.0° | 179.4° |
| C6 | C5 | C4 | H56 | 90.0° | 179.8° |
| C6 | C1 | C2 | H19 | 90.0° | 179.8° |
| C1 | C6 | C5 | H57 | 90.0° | 179.7° |
| CAU | C7 | C8 | H59 | 90.0° | 120.0° |
| CAU | C7 | C8 | H60 | 90.0° | 120.0° |
| CAU | C7 | C8 | C9 | 90.0° | 180.0° |
| CAU | C7 | H59 | H60 | 90.0° | 120.0° |
| CAU | C7 | C8 | H61 | 90.0° | 60.0° |
| CAU | C7 | C8 | H62 | 90.0° | 60.0° |
| C7 | C8 | C9 | H61 | 90.0° | 120.0° |
| C7 | C8 | C9 | H62 | 90.0° | 120.0° |
| C7 | C8 | C9 | C10 | 90.0° | 180.0° |
| C8 | C7 | H59 | H60 | 90.0° | 120.0° |
| C7 | C8 | H61 | H62 | 90.0° | 120.0° |
| C7 | C8 | C9 | H63 | 90.0° | 60.0° |
| C7 | C8 | C9 | H64 | 90.0° | 60.0° |
| C8 | C9 | C10 | H63 | 90.0° | 120.0° |
| C8 | C9 | C10 | H64 | 90.0° | 120.0° |
| C8 | C9 | C10 | C11 | 90.0° | 180.0° |
| C9 | C8 | C7 | H59 | 90.0° | 60.0° |
| C9 | C8 | C7 | H60 | 90.0° | 60.0° |
| C9 | C8 | H61 | H62 | 90.0° | 120.0° |
| C8 | C9 | H63 | H64 | 90.0° | 120.0° |
| C8 | C9 | C10 | H65 | 90.0° | 60.0° |
| C8 | C9 | C10 | H66 | 90.0° | 60.0° |
| C9 | C10 | C11 | H65 | 90.0° | 120.0° |
| C9 | C10 | C11 | H66 | 90.0° | 120.0° |
| C9 | C10 | C11 | N1 | 90.0° | 180.0° |
| C10 | C9 | C8 | H61 | 90.0° | 60.0° |
| C10 | C9 | C8 | H62 | 90.0° | 60.0° |
| C10 | C9 | H63 | H64 | 90.0° | 120.0° |
| C9 | C10 | H65 | H66 | 90.0° | 120.0° |
| C9 | C10 | C11 | H67 | 90.0° | 60.0° |
| C9 | C10 | C11 | H68 | 90.0° | 60.0° |
| C10 | C11 | N1 | H67 | 90.0° | 120.0° |
| C10 | C11 | N1 | H68 | 90.0° | 120.0° |
| C10 | C11 | N1 | C13 | 90.0° | 180.0° |
| C11 | C10 | C9 | H63 | 90.0° | 60.0° |
| C11 | C10 | C9 | H64 | 90.0° | 60.0° |
| C11 | C10 | H65 | H66 | 90.0° | 120.0° |
| C10 | C11 | H67 | H68 | 90.0° | 120.0° |
| C10 | C11 | N1 | H69 | 90.0° | 0.0° |
| C11 | N1 | C13 | H69 | 90.0° | 180.0° |
| C11 | N1 | C13 | C14 | 90.0° | 180.0° |
| C11 | N1 | C13 | O2 | 90.0° | 0.0° |
| N1 | C11 | C10 | H65 | 90.0° | 60.0° |
| N1 | C11 | C10 | H66 | 90.0° | 60.0° |
| N1 | C11 | H67 | H68 | 90.0° | 120.0° |
| N1 | C13 | C14 | O2 | 90.0° | 180.0° |
| N1 | C13 | C14 | C15 | 90.0° | 180.0° |
| C13 | N1 | C11 | H67 | 90.0° | 60.0° |
| C13 | N1 | C11 | H68 | 90.0° | 60.0° |
| N1 | C13 | C14 | H70 | 90.0° | 60.0° |
| N1 | C13 | C14 | H71 | 90.0° | 60.0° |
| C13 | C14 | C15 | H70 | 90.0° | 120.0° |
| C13 | C14 | C15 | H71 | 90.0° | 120.0° |
| C13 | C14 | C15 | C16 | 90.0° | 180.0° |
| C14 | C13 | N1 | H69 | 90.0° | 0.0° |
| C13 | C14 | H70 | H71 | 90.0° | 120.0° |
| C13 | C14 | C15 | H72 | 90.0° | 60.0° |
| C13 | C14 | C15 | H73 | 90.0° | 60.0° |
| C14 | C15 | C16 | H72 | 90.0° | 120.0° |
| C14 | C15 | C16 | H73 | 90.0° | 120.0° |
| C14 | C15 | C16 | C17 | 90.0° | 180.0° |
| C15 | C14 | C13 | O2 | 90.0° | 0.0° |
| C15 | C14 | H70 | H71 | 90.0° | 120.0° |
| C14 | C15 | H72 | H73 | 90.0° | 120.0° |
| C14 | C15 | C16 | H74 | 90.0° | 60.0° |
| C14 | C15 | C16 | H75 | 90.0° | 60.0° |
| C15 | C16 | C17 | H74 | 90.0° | 120.0° |
| C15 | C16 | C17 | H75 | 90.0° | 120.0° |
| C15 | C16 | C17 | C18 | 90.0° | 180.0° |
| C16 | C15 | C14 | H70 | 90.0° | 60.0° |
| C16 | C15 | C14 | H71 | 90.0° | 60.0° |
| C16 | C15 | H72 | H73 | 90.0° | 120.0° |
| C15 | C16 | H74 | H75 | 90.0° | 120.0° |
| C15 | C16 | C17 | H76 | 90.0° | 60.0° |
| C15 | C16 | C17 | H77 | 90.0° | 60.0° |
| C16 | C17 | C18 | H76 | 90.0° | 120.0° |
| C16 | C17 | C18 | H77 | 90.0° | 120.0° |
| C16 | C17 | C18 | C12 | 90.0° | 175.0° |
| C16 | C17 | C18 | S1 | 90.0° | 71.7° |
| C17 | C16 | C15 | H72 | 90.0° | 60.0° |
| C17 | C16 | C15 | H73 | 90.0° | 60.0° |
| C17 | C16 | H74 | H75 | 90.0° | 120.0° |
| C16 | C17 | H76 | H77 | 90.0° | 120.0° |
| C16 | C17 | C18 | H78 | 90.0° | 51.8° |
| C17 | C18 | C12 | S1 | 90.0° | 118.4° |
| C17 | C18 | C12 | H78 | 90.0° | 123.2° |
| C17 | C18 | C12 | C19 | 90.0° | 142.9° |
| C17 | C18 | S1 | C20 | 90.0° | 153.0° |
| C17 | C18 | S1 | H78 | 90.0° | 123.3° |
| C17 | C18 | C12 | N2 | 90.0° | 102.2° |
| C18 | C17 | C16 | H74 | 90.0° | 60.0° |
| C18 | C17 | C16 | H75 | 90.0° | 60.0° |
| C18 | C17 | H76 | H77 | 90.0° | 120.0° |
| C17 | C18 | C12 | H79 | 90.0° | 19.5° |
| O2 | C13 | N1 | H69 | 90.0° | 180.0° |
| O2 | C13 | C14 | H70 | 90.0° | 120.0° |
| O2 | C13 | C14 | H71 | 90.0° | 120.0° |
| C18 | C12 | C19 | N2 | 90.0° | 118.0° |
| C18 | C12 | C19 | H79 | 90.0° | 123.4° |
| C18 | C12 | C19 | C20 | 90.0° | 0.1° |
| C12 | C18 | S1 | C20 | 90.0° | 34.7° |
| C12 | C18 | S1 | H78 | 90.0° | 118.3° |
| C18 | C12 | C19 | N3 | 90.0° | 118.1° |
| C18 | C12 | N2 | C22 | 90.0° | 120.2° |
| C18 | C12 | N2 | H79 | 90.0° | 121.4° |
| C12 | C18 | C17 | H76 | 90.0° | 55.0° |
| C12 | C18 | C17 | H77 | 90.0° | 65.0° |
| C18 | C12 | C19 | H80 | 90.0° | 123.4° |
| C18 | C12 | N2 | H84 | 90.0° | 59.9° |
| C12 | C19 | C20 | N3 | 90.0° | 114.9° |
| C12 | C19 | C20 | H80 | 90.0° | 123.5° |
| C12 | C19 | C20 | S1 | 90.0° | 24.7° |
| C19 | C12 | C18 | S1 | 90.0° | 24.6° |
| C12 | C19 | N3 | H80 | 90.0° | 118.3° |
| C12 | C19 | N3 | C22 | 90.0° | 0.0° |
| C19 | C12 | N2 | C22 | 90.0° | 0.0° |
| C19 | C12 | N2 | H79 | 90.0° | 118.4° |
| C19 | C12 | C18 | H78 | 90.0° | 93.9° |
| C12 | C19 | C20 | H81 | 90.0° | 93.6° |
| C12 | C19 | C20 | H82 | 90.0° | 142.9° |
| C12 | C19 | N3 | H83 | 90.0° | 179.9° |
| C19 | C12 | N2 | H84 | 90.0° | 179.9° |
| C19 | C20 | S1 | H81 | 90.0° | 118.3° |
| C19 | C20 | S1 | H82 | 90.0° | 118.3° |
| C19 | C20 | S1 | C18 | 90.0° | 34.7° |
| C20 | C19 | N3 | H80 | 90.0° | 121.5° |
| C20 | C19 | N3 | C22 | 90.0° | 120.2° |
| C20 | C19 | C12 | N2 | 90.0° | 117.9° |
| C20 | C19 | C12 | H79 | 90.0° | 123.5° |
| C19 | C20 | H81 | H82 | 90.0° | 123.4° |
| C20 | C19 | N3 | H83 | 90.0° | 59.8° |
| S1 | C20 | C19 | N3 | 90.0° | 139.5° |
| C20 | S1 | C18 | H78 | 90.0° | 83.7° |
| S1 | C20 | C19 | H80 | 90.0° | 98.8° |
| S1 | C20 | H81 | H82 | 90.0° | 123.3° |
| S1 | C18 | C12 | N2 | 90.0° | 139.5° |
| S1 | C18 | C17 | H76 | 90.0° | 168.3° |
| S1 | C18 | C17 | H77 | 90.0° | 48.3° |
| S1 | C18 | C12 | H79 | 90.0° | 98.9° |
| C18 | S1 | C20 | H81 | 90.0° | 83.6° |
| C18 | S1 | C20 | H82 | 90.0° | 153.0° |
| C19 | N3 | C22 | H83 | 90.0° | 179.9° |
| C19 | N3 | C22 | N2 | 90.0° | 0.0° |
| N3 | C19 | C12 | N2 | 90.0° | 0.0° |
| C19 | N3 | C22 | O3 | 90.0° | 180.0° |
| N3 | C19 | C12 | H79 | 90.0° | 118.6° |
| N3 | C19 | C20 | H81 | 90.0° | 21.2° |
| N3 | C19 | C20 | H82 | 90.0° | 102.2° |
| N3 | C22 | N2 | O3 | 90.0° | 179.9° |
| N3 | C22 | N2 | C12 | 90.0° | 0.0° |
| C22 | N3 | C19 | H80 | 90.0° | 118.3° |
| N3 | C22 | N2 | H84 | 90.0° | 179.9° |
| C22 | N2 | C12 | H84 | 90.0° | 179.9° |
| C22 | N2 | C12 | H79 | 90.0° | 118.4° |
| N2 | C22 | N3 | H83 | 90.0° | 179.9° |
| C12 | N2 | C22 | O3 | 90.0° | 180.0° |
| N2 | C12 | C18 | H78 | 90.0° | 21.0° |
| N2 | C12 | C19 | H80 | 90.0° | 118.5° |
| O3 | C22 | N3 | H83 | 90.0° | 0.0° |
| O3 | C22 | N2 | H84 | 90.0° | 0.1° |
| H19 | C2 | C3 | H55 | 90.0° | 0.0° |
| H55 | C3 | C4 | H56 | 90.0° | 0.0° |
| H56 | C4 | C5 | H57 | 90.0° | 0.1° |
| H57 | C5 | C6 | H58 | 90.0° | 0.3° |
| H59 | C7 | C8 | H61 | 90.0° | 180.0° |
| H59 | C7 | C8 | H62 | 90.0° | 60.0° |
| H60 | C7 | C8 | H61 | 90.0° | 60.0° |
| H60 | C7 | C8 | H62 | 90.0° | 180.0° |
| H61 | C8 | C9 | H63 | 90.0° | 180.0° |
| H61 | C8 | C9 | H64 | 90.0° | 60.0° |
| H62 | C8 | C9 | H63 | 90.0° | 60.0° |
| H62 | C8 | C9 | H64 | 90.0° | 180.0° |
| H63 | C9 | C10 | H65 | 90.0° | 180.0° |
| H63 | C9 | C10 | H66 | 90.0° | 60.0° |
| H64 | C9 | C10 | H65 | 90.0° | 60.0° |
| H64 | C9 | C10 | H66 | 90.0° | 180.0° |
| H65 | C10 | C11 | H67 | 90.0° | 180.0° |
| H65 | C10 | C11 | H68 | 90.0° | 60.0° |
| H66 | C10 | C11 | H67 | 90.0° | 60.0° |
| H66 | C10 | C11 | H68 | 90.0° | 180.0° |
| H67 | C11 | N1 | H69 | 90.0° | 120.0° |
| H68 | C11 | N1 | H69 | 90.0° | 120.0° |
| H70 | C14 | C15 | H72 | 90.0° | 180.0° |
| H70 | C14 | C15 | H73 | 90.0° | 60.0° |
| H71 | C14 | C15 | H72 | 90.0° | 60.0° |
| H71 | C14 | C15 | H73 | 90.0° | 180.0° |
| H72 | C15 | C16 | H74 | 90.0° | 180.0° |
| H72 | C15 | C16 | H75 | 90.0° | 60.0° |
| H73 | C15 | C16 | H74 | 90.0° | 60.0° |
| H73 | C15 | C16 | H75 | 90.0° | 180.0° |
| H74 | C16 | C17 | H76 | 90.0° | 180.0° |
| H74 | C16 | C17 | H77 | 90.0° | 60.0° |
| H75 | C16 | C17 | H76 | 90.0° | 60.0° |
| H75 | C16 | C17 | H77 | 90.0° | NaN° |
| H76 | C17 | C18 | H78 | 90.0° | 68.2° |
| H77 | C17 | C18 | H78 | 90.0° | 171.8° |
| H78 | C18 | C12 | H79 | 90.0° | 142.7° |
| H79 | C12 | C19 | H80 | 90.0° | 0.1° |
| H79 | C12 | N2 | H84 | 90.0° | 61.5° |
| H80 | C19 | C20 | H81 | 90.0° | 142.8° |
| H80 | C19 | C20 | H82 | 90.0° | 19.4° |
| H80 | C19 | N3 | H83 | 90.0° | 61.7° |
