0FW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAA | CAX | doub | 1.22Å | 1.26Å | |
| CAY | OAB | sing | 1.35Å | 1.25Å | |
| OAB | HOAB | sing | 0.97Å | 0.95Å | |
| OAC | CAZ | doub | 1.22Å | 1.25Å | |
| CAX | OAD | sing | 1.35Å | 1.26Å | |
| OAD | HOAD | sing | 0.97Å | 0.95Å | |
| OAE | CAY | doub | 1.21Å | 1.26Å | |
| CAH | CAF | doub | 1.38Å | 1.39Å | Aromatic |
| CAF | CAG | sing | 1.38Å | 1.40Å | Aromatic |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAG | CAL | doub | 1.38Å | 1.40Å | Aromatic |
| CAG | HAG | sing | 1.08Å | 1.08Å | |
| CAH | CAM | sing | 1.38Å | 1.39Å | Aromatic |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAK | CAI | doub | 1.38Å | 1.40Å | Aromatic |
| CAJ | CAI | sing | 1.38Å | 1.40Å | Aromatic |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CBA | CAJ | doub | 1.39Å | 1.39Å | Aromatic |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CBB | CAK | sing | 1.39Å | 1.39Å | Aromatic |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CBE | CAL | sing | 1.39Å | 1.39Å | Aromatic |
| CAL | HAL | sing | 1.08Å | 1.08Å | |
| CAM | CBE | doub | 1.39Å | 1.40Å | Aromatic |
| CAM | HAM | sing | 1.08Å | 1.08Å | |
| CBC | CAN | doub | 1.39Å | 1.39Å | Aromatic |
| CAN | CAS | sing | 1.38Å | 1.39Å | Aromatic |
| CAN | HAN | sing | 1.08Å | 1.08Å | |
| CAQ | CAO | doub | 1.38Å | 1.37Å | Aromatic |
| CAO | CBD | sing | 1.40Å | 1.37Å | Aromatic |
| CAO | HAO | sing | 1.08Å | 1.08Å | |
| CAR | CAP | sing | 1.38Å | 1.41Å | Aromatic |
| CAP | CBD | doub | 1.40Å | 1.41Å | Aromatic |
| CAP | HAP | sing | 1.08Å | 1.08Å | |
| CBF | CAQ | sing | 1.39Å | 1.39Å | Aromatic |
| CAQ | HAQ | sing | 1.08Å | 1.08Å | |
| CBF | CAR | doub | 1.39Å | 1.40Å | Aromatic |
| CAR | HAR | sing | 1.08Å | 1.08Å | |
| CAS | CBG | doub | 1.39Å | 1.40Å | Aromatic |
| CAS | HAS | sing | 1.08Å | 1.08Å | |
| CAT | CBB | doub | 1.39Å | 1.40Å | Aromatic |
| CAT | CBA | sing | 1.39Å | 1.40Å | Aromatic |
| CAT | HAT | sing | 1.08Å | 1.08Å | |
| CBC | CAU | sing | 1.39Å | 1.41Å | Aromatic |
| CAU | CBH | doub | 1.39Å | 1.41Å | Aromatic |
| CAU | HAU | sing | 1.08Å | 1.08Å | |
| CAZ | NAV | sing | 1.35Å | 1.33Å | |
| NAV | CBA | sing | 1.40Å | 1.34Å | |
| NAV | HNAV | sing | 0.97Å | 1.00Å | |
| OAW | CBC | sing | 1.36Å | 1.36Å | |
| OAW | CBB | sing | 1.36Å | 1.38Å | |
| CBG | CAX | sing | 1.48Å | 1.54Å | |
| CBH | CAY | sing | 1.48Å | 1.56Å | |
| CBD | CAZ | sing | 1.48Å | 1.52Å | |
| CBE | CBF | sing | 1.48Å | 1.39Å | |
| CBH | CBG | sing | 1.41Å | 1.42Å | Aromatic |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAA | CAX | OAD | 124.4° | 120.0° |
| OAA | CAX | CBG | 115.0° | 120.0° |
| CAY | OAB | HOAB | 109.5° | 117.0° |
| OAB | CAY | OAE | 123.0° | 120.0° |
| OAB | CAY | CBH | 117.7° | 120.0° |
| OAC | CAZ | NAV | 125.0° | 120.0° |
| OAC | CAZ | CBD | 118.5° | 120.0° |
| CAX | OAD | HOAD | 109.5° | 117.0° |
| OAD | CAX | CBG | 120.5° | 120.0° |
| OAE | CAY | CBH | 119.3° | 120.0° |
| CAH | CAF | CAG | 119.9° | 120.3° |
| CAH | CAF | HAF | 120.1° | 119.9° |
| CAF | CAH | CAM | 118.9° | 120.1° |
| CAF | CAH | HAH | 120.5° | 119.9° |
| CAG | CAF | HAF | 120.1° | 119.8° |
| CAF | CAG | CAL | 121.2° | 120.1° |
| CAF | CAG | HAG | 119.4° | 119.9° |
| CAL | CAG | HAG | 119.4° | 120.0° |
| CAG | CAL | CBE | 119.0° | 119.9° |
| CAG | CAL | HAL | 120.5° | 120.1° |
| CAM | CAH | HAH | 120.6° | 120.0° |
| CAH | CAM | CBE | 121.6° | 119.8° |
| CAH | CAM | HAM | 119.2° | 120.0° |
| CAK | CAI | CAJ | 121.3° | 120.1° |
| CAK | CAI | HAI | 119.4° | 120.0° |
| CAI | CAK | CBB | 120.1° | 120.1° |
| CAI | CAK | HAK | 120.0° | 119.9° |
| CAJ | CAI | HAI | 119.4° | 119.9° |
| CAI | CAJ | CBA | 119.5° | 120.0° |
| CAI | CAJ | HAJ | 120.2° | 120.0° |
| CBA | CAJ | HAJ | 120.3° | 120.0° |
| CAJ | CBA | CAT | 118.9° | 119.9° |
| CAJ | CBA | NAV | 117.8° | 120.0° |
| CBB | CAK | HAK | 120.0° | 120.0° |
| CAK | CBB | CAT | 118.4° | 119.9° |
| CAK | CBB | OAW | 122.4° | 120.0° |
| CBE | CAL | HAL | 120.5° | 120.1° |
| CAL | CBE | CAM | 119.5° | 119.8° |
| CAL | CBE | CBF | 122.1° | 120.1° |
| CBE | CAM | HAM | 119.2° | 120.1° |
| CAM | CBE | CBF | 118.3° | 120.1° |
| CBC | CAN | CAS | 119.2° | 120.4° |
| CBC | CAN | HAN | 120.4° | 119.8° |
| CAN | CBC | CAU | 120.4° | 120.2° |
| CAN | CBC | OAW | 118.5° | 119.9° |
| CAS | CAN | HAN | 120.4° | 119.9° |
| CAN | CAS | CBG | 121.4° | 120.1° |
| CAN | CAS | HAS | 119.3° | 120.0° |
| CAQ | CAO | CBD | 119.6° | 119.9° |
| CAQ | CAO | HAO | 120.2° | 120.0° |
| CAO | CAQ | CBF | 121.6° | 120.1° |
| CAO | CAQ | HAQ | 119.2° | 120.0° |
| CBD | CAO | HAO | 120.2° | 120.0° |
| CAO | CBD | CAP | 120.3° | 119.9° |
| CAO | CBD | CAZ | 111.0° | 120.0° |
| CAR | CAP | CBD | 120.4° | 120.0° |
| CAR | CAP | HAP | 119.8° | 120.0° |
| CAP | CAR | CBF | 117.9° | 120.0° |
| CAP | CAR | HAR | 121.0° | 120.0° |
| CBD | CAP | HAP | 119.8° | 120.0° |
| CAP | CBD | CAZ | 128.7° | 120.0° |
| CBF | CAQ | HAQ | 119.2° | 120.0° |
| CAQ | CBF | CAR | 120.2° | 120.1° |
| CAQ | CBF | CBE | 111.8° | 120.0° |
| CBF | CAR | HAR | 121.1° | 120.0° |
| CAR | CBF | CBE | 128.0° | 120.0° |
| CBG | CAS | HAS | 119.3° | 120.0° |
| CAS | CBG | CAX | 113.7° | 120.1° |
| CAS | CBG | CBH | 120.1° | 119.7° |
| CBB | CAT | CBA | 122.0° | 119.9° |
| CBB | CAT | HAT | 119.0° | 120.1° |
| CAT | CBB | OAW | 119.2° | 120.0° |
| CBA | CAT | HAT | 119.0° | 120.0° |
| CAT | CBA | NAV | 123.4° | 120.1° |
| CBC | CAU | CBH | 121.0° | 119.9° |
| CBC | CAU | HAU | 119.5° | 120.0° |
| CAU | CBC | OAW | 121.1° | 119.9° |
| CBH | CAU | HAU | 119.5° | 120.0° |
| CAU | CBH | CAY | 118.5° | 120.2° |
| CAU | CBH | CBG | 117.9° | 119.7° |
| CAZ | NAV | CBA | 121.7° | 120.0° |
| CAZ | NAV | HNAV | 119.1° | 120.0° |
| NAV | CAZ | CBD | 116.2° | 120.0° |
| CBA | NAV | HNAV | 119.1° | 120.0° |
| CBC | OAW | CBB | 119.6° | 118.0° |
| CAX | CBG | CBH | 126.1° | 120.2° |
| CAY | CBH | CBG | 123.7° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAA | CAX | OAD | CBG | 179.4° | 180.0° |
| OAA | CAX | OAD | HOAD | 0.0° | 0.0° |
| OAA | CAX | CBG | CAS | 0.4° | 124.3° |
| OAA | CAX | CBG | CBH | 179.5° | 55.6° |
| OAB | CAY | OAE | CBH | 178.3° | 179.9° |
| OAB | CAY | CBH | CAU | 45.2° | 4.5° |
| OAB | CAY | CBH | CBG | 135.0° | 176.3° |
| HOAB | OAB | CAY | OAE | 0.0° | 0.0° |
| HOAB | OAB | CAY | CBH | 178.3° | 180.0° |
| OAC | CAZ | CBD | CAO | 33.3° | 0.0° |
| OAC | CAZ | CBD | CAP | 147.7° | 180.0° |
| OAC | CAZ | NAV | CBD | 173.6° | 180.0° |
| OAC | CAZ | NAV | CBA | 0.3° | 6.0° |
| OAC | CAZ | NAV | HNAV | 179.7° | 174.0° |
| OAD | CAX | CBG | CAS | 179.8° | 55.7° |
| OAD | CAX | CBG | CBH | 0.1° | 124.4° |
| HOAD | OAD | CAX | CBG | 179.3° | 180.0° |
| OAE | CAY | CBH | CAU | 133.2° | 175.6° |
| OAE | CAY | CBH | CBG | 46.6° | 3.6° |
| CAH | CAF | CAG | HAF | 180.0° | 179.7° |
| CAH | CAF | CAG | CAL | 0.8° | 0.3° |
| CAH | CAF | CAG | HAG | 179.1° | 179.8° |
| CAF | CAH | CAM | HAH | 180.0° | 179.9° |
| CAF | CAH | CAM | CBE | 1.0° | 0.6° |
| CAF | CAH | CAM | HAM | 179.0° | 180.0° |
| CAF | CAG | CAL | HAG | 180.0° | 179.9° |
| CAG | CAF | CAH | CAM | 0.5° | 0.1° |
| CAG | CAF | CAH | HAH | 179.5° | 180.0° |
| CAF | CAG | CAL | CBE | 1.6° | 0.0° |
| CAF | CAG | CAL | HAL | 178.5° | 179.9° |
| HAF | CAF | CAG | CAL | 179.2° | 180.0° |
| HAF | CAF | CAG | HAG | 0.8° | 0.1° |
| HAF | CAF | CAH | CAM | 179.5° | 179.7° |
| HAF | CAF | CAH | HAH | 0.5° | 0.2° |
| CAG | CAL | CBE | HAL | 180.0° | 180.0° |
| CAG | CAL | CBE | CAM | 2.0° | 0.6° |
| CAG | CAL | CBE | CBF | 176.9° | 179.7° |
| HAG | CAG | CAL | CBE | 178.4° | 179.9° |
| HAG | CAG | CAL | HAL | 1.6° | 0.1° |
| CAH | CAM | CBE | CAL | 1.8° | 0.9° |
| CAH | CAM | CBE | HAM | 180.0° | 179.3° |
| CAH | CAM | CBE | CBF | 176.9° | 179.9° |
| HAH | CAH | CAM | CBE | 179.0° | 179.5° |
| HAH | CAH | CAM | HAM | 1.0° | 0.1° |
| CAK | CAI | CAJ | HAI | 180.0° | 179.8° |
| CAK | CAI | CAJ | CBA | 0.7° | 0.3° |
| CAK | CAI | CAJ | HAJ | 179.3° | 179.8° |
| CAI | CAK | CBB | HAK | 180.0° | 180.0° |
| CAI | CAK | CBB | CAT | 0.4° | 0.1° |
| CAI | CAK | CBB | OAW | 179.2° | 179.8° |
| CAI | CAJ | CBA | HAJ | 180.0° | 180.0° |
| CAJ | CAI | CAK | CBB | 0.5° | 0.3° |
| CAJ | CAI | CAK | HAK | 179.5° | 179.8° |
| CAI | CAJ | CBA | CAT | 0.9° | 0.0° |
| CAI | CAJ | CBA | NAV | 179.7° | 179.7° |
| HAI | CAI | CAJ | CBA | 179.3° | 180.0° |
| HAI | CAI | CAJ | HAJ | 0.8° | 0.0° |
| HAI | CAI | CAK | CBB | 179.5° | 180.0° |
| HAI | CAI | CAK | HAK | 0.5° | 0.0° |
| CAJ | CBA | CAT | CBB | 0.9° | 0.2° |
| CAJ | CBA | CAT | NAV | 178.7° | 179.7° |
| CAJ | CBA | CAT | HAT | 179.1° | 179.7° |
| CAJ | CBA | NAV | CAZ | 150.8° | 153.6° |
| CAJ | CBA | NAV | HNAV | 29.2° | 26.4° |
| HAJ | CAJ | CBA | CAT | 179.1° | 180.0° |
| HAJ | CAJ | CBA | NAV | 0.3° | 0.2° |
| CAK | CBB | CAT | OAW | 178.8° | 179.8° |
| CAK | CBB | CAT | CBA | 0.7° | 0.2° |
| CAK | CBB | CAT | HAT | 179.3° | 179.7° |
| CAK | CBB | OAW | CBC | 19.6° | 174.9° |
| HAK | CAK | CBB | CAT | 179.6° | 180.0° |
| HAK | CAK | CBB | OAW | 0.8° | 0.2° |
| CAL | CBE | CAM | CBF | 175.1° | 179.2° |
| CAL | CBE | CAM | HAM | 178.3° | 179.8° |
| CAL | CBE | CBF | CAQ | 146.5° | 0.8° |
| CAL | CBE | CBF | CAR | 30.2° | 179.2° |
| HAL | CAL | CBE | CAM | 178.0° | 179.5° |
| HAL | CAL | CBE | CBF | 3.1° | 0.3° |
| CAM | CBE | CBF | CAQ | 28.5° | 180.0° |
| CAM | CBE | CBF | CAR | 154.8° | 0.0° |
| HAM | CAM | CBE | CBF | 3.1° | 0.6° |
| CBC | CAN | CAS | HAN | 180.0° | 179.7° |
| CBC | CAN | CAS | CBG | 0.6° | 0.3° |
| CBC | CAN | CAS | HAS | 179.5° | 179.8° |
| CAN | CBC | CAU | OAW | 179.0° | 179.9° |
| CAN | CBC | CAU | CBH | 1.1° | 0.5° |
| CAN | CBC | CAU | HAU | 178.9° | 179.5° |
| CAN | CBC | OAW | CBB | 56.1° | 75.4° |
| CAN | CAS | CBG | HAS | 180.0° | 179.9° |
| CAS | CAN | CBC | CAU | 1.0° | 0.0° |
| CAS | CAN | CBC | OAW | 180.0° | 179.9° |
| CAN | CAS | CBG | CAX | 179.7° | 180.0° |
| CAN | CAS | CBG | CBH | 0.2° | 0.1° |
| HAN | CAN | CAS | CBG | 179.5° | 180.0° |
| HAN | CAN | CAS | HAS | 0.5° | 0.1° |
| HAN | CAN | CBC | CAU | 179.1° | 179.7° |
| HAN | CAN | CBC | OAW | 0.0° | 0.2° |
| CAQ | CAO | CBD | HAO | 180.0° | 179.8° |
| CAQ | CAO | CBD | CAP | 1.5° | 0.2° |
| CAO | CAQ | CBF | HAQ | 180.0° | 180.0° |
| CAO | CAQ | CBF | CAR | 1.0° | 0.0° |
| CAQ | CAO | CBD | CAZ | 179.4° | 179.7° |
| CAO | CAQ | CBF | CBE | 178.1° | 180.0° |
| CAO | CBD | CAP | CAR | 0.7° | 0.5° |
| CAO | CBD | CAP | CAZ | 178.9° | 179.9° |
| CAO | CBD | CAP | HAP | 179.3° | 180.0° |
| CBD | CAO | CAQ | CBF | 0.6° | 0.0° |
| CBD | CAO | CAQ | HAQ | 179.4° | 179.9° |
| CAO | CBD | CAZ | NAV | 140.7° | 180.0° |
| HAO | CAO | CBD | CAP | 178.5° | 180.0° |
| HAO | CAO | CAQ | CBF | 179.4° | 179.7° |
| HAO | CAO | CAQ | HAQ | 0.7° | 0.3° |
| HAO | CAO | CBD | CAZ | 0.6° | 0.0° |
| CAR | CAP | CBD | HAP | 180.0° | 179.4° |
| CAP | CAR | CBF | CAQ | 1.8° | 0.3° |
| CAP | CAR | CBF | HAR | 180.0° | 179.5° |
| CAR | CAP | CBD | CAZ | 179.6° | 179.4° |
| CAP | CAR | CBF | CBE | 178.3° | 179.7° |
| CBD | CAP | CAR | CBF | 0.9° | 0.6° |
| CBD | CAP | CAR | HAR | 179.1° | 180.0° |
| CAP | CBD | CAZ | NAV | 38.3° | 0.0° |
| HAP | CAP | CAR | CBF | 179.1° | 180.0° |
| HAP | CAP | CAR | HAR | 0.9° | 0.5° |
| HAP | CAP | CBD | CAZ | 0.4° | 0.0° |
| CAQ | CBF | CAR | CBE | 176.5° | 180.0° |
| CAQ | CBF | CAR | HAR | 178.2° | 179.8° |
| HAQ | CAQ | CBF | CAR | 179.0° | 180.0° |
| HAQ | CAQ | CBF | CBE | 2.0° | 0.0° |
| HAR | CAR | CBF | CBE | 1.7° | 0.2° |
| CAS | CBG | CBH | CAU | 0.3° | 0.4° |
| CAS | CBG | CAX | CBH | 179.9° | 179.9° |
| CAS | CBG | CBH | CAY | 179.9° | 179.7° |
| HAS | CAS | CBG | CAX | 0.3° | 0.1° |
| HAS | CAS | CBG | CBH | 179.8° | 179.9° |
| CBB | CAT | CBA | HAT | 180.0° | 179.9° |
| CBB | CAT | CBA | NAV | 179.7° | 180.0° |
| CAT | CBB | OAW | CBC | 161.6° | 4.9° |
| CAT | CBA | NAV | CAZ | 28.0° | 26.2° |
| CAT | CBA | NAV | HNAV | 152.1° | 153.8° |
| CBA | CAT | CBB | OAW | 179.5° | 180.0° |
| HAT | CAT | CBA | NAV | 0.4° | 0.0° |
| HAT | CAT | CBB | OAW | 0.5° | 0.1° |
| CBC | CAU | CBH | HAU | 180.0° | 180.0° |
| CAU | CBC | OAW | CBB | 124.9° | 104.7° |
| CBC | CAU | CBH | CAY | 179.5° | 180.0° |
| CBC | CAU | CBH | CBG | 0.7° | 0.7° |
| CBH | CAU | CBC | OAW | 179.9° | 179.5° |
| CAU | CBH | CBG | CAX | 179.6° | 179.5° |
| CAU | CBH | CAY | CBG | 179.8° | 179.2° |
| HAU | CAU | CBC | OAW | 0.1° | 0.5° |
| HAU | CAU | CBH | CAY | 0.5° | 0.0° |
| HAU | CAU | CBH | CBG | 179.3° | 179.2° |
| CAZ | NAV | CBA | HNAV | 180.0° | 180.0° |
| CBA | NAV | CAZ | CBD | 173.2° | 174.0° |
| HNAV | NAV | CAZ | CBD | 6.7° | 6.0° |
| CAX | CBG | CBH | CAY | 0.2° | 0.2° |
