FQW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAI | CAE | sing | 1.38Å | 1.38Å | Aromatic |
| CAI | CAR | doub | 1.38Å | 1.40Å | Aromatic |
| CAE | CAC | doub | 1.38Å | 1.42Å | Aromatic |
| CAC | CAF | sing | 1.38Å | 1.41Å | Aromatic |
| CAF | CAJ | doub | 1.38Å | 1.40Å | Aromatic |
| CAJ | CAR | sing | 1.38Å | 1.43Å | Aromatic |
| CAR | CAM | sing | 1.51Å | 1.49Å | |
| CAM | CAN | sing | 1.53Å | 1.49Å | |
| CAN | CAU | sing | 1.51Å | 1.50Å | |
| CAU | CAY | sing | 1.42Å | 1.37Å | Aromatic |
| CAU | CAV | doub | 1.36Å | 1.39Å | Aromatic |
| CAY | CAW | sing | 1.42Å | 1.40Å | |
| CAY | CAX | doub | 1.40Å | 1.37Å | Aromatic |
| CAW | OAB | doub | 1.22Å | 1.23Å | |
| CAW | NAP | sing | 1.35Å | 1.37Å | |
| NAP | CAS | sing | 1.36Å | 1.34Å | |
| CAS | NAA | sing | 1.37Å | 1.40Å | |
| CAS | NAO | doub | 1.31Å | 1.36Å | |
| NAO | CAX | sing | 1.34Å | 1.35Å | |
| CAX | NAQ | sing | 1.37Å | 1.37Å | Aromatic |
| NAQ | CAV | sing | 1.38Å | 1.39Å | Aromatic |
| CAV | CAT | sing | 1.48Å | 1.49Å | |
| CAT | CAK | sing | 1.40Å | 1.40Å | Aromatic |
| CAT | CAL | doub | 1.40Å | 1.39Å | Aromatic |
| CAK | CAG | doub | 1.38Å | 1.38Å | Aromatic |
| CAG | CAD | sing | 1.38Å | 1.39Å | Aromatic |
| CAD | CAH | doub | 1.38Å | 1.37Å | Aromatic |
| CAH | CAL | sing | 1.38Å | 1.39Å | Aromatic |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| CAC | HAC | sing | 1.08Å | 1.08Å | |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAM | HAM1 | sing | 1.09Å | 1.10Å | |
| CAM | HAM2 | sing | 1.09Å | 1.10Å | |
| CAN | HAN1 | sing | 1.09Å | 1.10Å | |
| CAN | HAN2 | sing | 1.09Å | 1.10Å | |
| NAP | HAP | sing | 0.97Å | 1.00Å | |
| NAA | HAA1 | sing | 0.97Å | 1.00Å | |
| NAA | HAA2 | sing | 0.97Å | 1.00Å | |
| NAQ | HAQ | sing | 0.97Å | 1.00Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CAL | HAL | sing | 1.08Å | 1.08Å | |
| CAG | HAG | sing | 1.08Å | 1.08Å | |
| CAD | HAD | sing | 1.08Å | 1.08Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAE | CAI | CAR | 118.4° | 120.0° |
| CAI | CAE | CAC | 119.3° | 120.0° |
| CAE | CAI | HAI | 120.8° | 120.0° |
| CAI | CAE | HAE | 120.3° | 120.0° |
| CAI | CAR | CAJ | 122.9° | 120.0° |
| CAI | CAR | CAM | 118.4° | 120.0° |
| CAR | CAI | HAI | 120.8° | 120.0° |
| CAE | CAC | CAF | 123.1° | 119.9° |
| CAC | CAE | HAE | 120.3° | 120.0° |
| CAE | CAC | HAC | 118.5° | 120.0° |
| CAC | CAF | CAJ | 117.3° | 120.0° |
| CAF | CAC | HAC | 118.5° | 120.0° |
| CAC | CAF | HAF | 121.3° | 120.0° |
| CAF | CAJ | CAR | 119.0° | 120.0° |
| CAJ | CAF | HAF | 121.3° | 120.0° |
| CAF | CAJ | HAJ | 120.5° | 120.0° |
| CAJ | CAR | CAM | 118.7° | 120.0° |
| CAR | CAJ | HAJ | 120.5° | 120.0° |
| CAR | CAM | CAN | 110.3° | 109.5° |
| CAR | CAM | HAM1 | 109.3° | 109.5° |
| CAR | CAM | HAM2 | 109.3° | 109.5° |
| CAM | CAN | CAU | 111.3° | 109.5° |
| CAN | CAM | HAM1 | 109.2° | 109.5° |
| CAN | CAM | HAM2 | 109.3° | 109.5° |
| CAM | CAN | HAN1 | 109.0° | 109.5° |
| CAM | CAN | HAN2 | 109.0° | 109.5° |
| CAN | CAU | CAY | 127.2° | 126.2° |
| CAN | CAU | CAV | 125.7° | 126.3° |
| CAU | CAN | HAN1 | 109.0° | 109.5° |
| CAU | CAN | HAN2 | 109.0° | 109.4° |
| CAY | CAU | CAV | 107.1° | 107.5° |
| CAU | CAY | CAW | 136.2° | 134.0° |
| CAU | CAY | CAX | 107.7° | 107.1° |
| CAU | CAV | NAQ | 109.1° | 109.1° |
| CAU | CAV | CAT | 130.2° | 125.5° |
| CAW | CAY | CAX | 116.0° | 118.9° |
| CAY | CAW | OAB | 123.5° | 120.9° |
| CAY | CAW | NAP | 119.6° | 118.3° |
| CAY | CAX | NAO | 124.3° | 119.3° |
| CAY | CAX | NAQ | 110.4° | 107.4° |
| OAB | CAW | NAP | 117.0° | 120.9° |
| CAW | NAP | CAS | 121.4° | 120.2° |
| CAW | NAP | HAP | 119.3° | 119.8° |
| NAP | CAS | NAA | 119.5° | 118.9° |
| NAP | CAS | NAO | 120.4° | 122.1° |
| CAS | NAP | HAP | 119.3° | 119.9° |
| NAA | CAS | NAO | 120.0° | 118.9° |
| CAS | NAA | HAA1 | 120.0° | 120.1° |
| CAS | NAA | HAA2 | 120.0° | 120.0° |
| CAS | NAO | CAX | 118.3° | 121.2° |
| NAO | CAX | NAQ | 125.3° | 133.3° |
| CAX | NAQ | CAV | 105.6° | 109.0° |
| CAX | NAQ | HAQ | 127.2° | 125.5° |
| NAQ | CAV | CAT | 120.4° | 125.5° |
| CAV | NAQ | HAQ | 127.2° | 125.6° |
| CAV | CAT | CAK | 115.6° | 120.2° |
| CAV | CAT | CAL | 125.2° | 120.2° |
| CAK | CAT | CAL | 118.9° | 119.7° |
| CAT | CAK | CAG | 121.5° | 119.8° |
| CAT | CAK | HAK | 119.3° | 120.1° |
| CAT | CAL | CAH | 119.9° | 119.9° |
| CAT | CAL | HAL | 120.1° | 120.0° |
| CAK | CAG | CAD | 118.2° | 120.2° |
| CAG | CAK | HAK | 119.3° | 120.1° |
| CAK | CAG | HAG | 120.9° | 119.9° |
| CAG | CAD | CAH | 121.3° | 120.3° |
| CAD | CAG | HAG | 120.9° | 119.9° |
| CAG | CAD | HAD | 119.4° | 119.9° |
| CAD | CAH | CAL | 120.2° | 120.2° |
| CAH | CAD | HAD | 119.3° | 119.8° |
| CAD | CAH | HAH | 119.9° | 119.9° |
| CAH | CAL | HAL | 120.0° | 120.1° |
| CAL | CAH | HAH | 119.9° | 119.9° |
| HAM1 | CAM | HAM2 | 109.5° | 109.4° |
| HAN1 | CAN | HAN2 | 109.4° | 109.4° |
| HAA1 | NAA | HAA2 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAE | CAI | CAR | HAI | 180.0° | 179.8° |
| CAI | CAE | CAC | HAE | 180.0° | 180.0° |
| CAI | CAE | CAC | CAF | 0.4° | 0.0° |
| CAE | CAI | CAR | CAJ | 1.4° | 0.1° |
| CAE | CAI | CAR | CAM | 179.5° | 180.0° |
| CAI | CAE | CAC | HAC | 179.6° | 180.0° |
| CAR | CAI | CAE | CAC | 1.5° | 0.0° |
| CAI | CAR | CAJ | CAF | 0.1° | 0.1° |
| CAI | CAR | CAJ | CAM | 178.2° | 179.8° |
| CAI | CAR | CAM | CAN | 95.6° | 90.0° |
| CAR | CAI | CAE | HAE | 178.5° | 180.0° |
| CAI | CAR | CAJ | HAJ | 179.9° | 180.0° |
| CAI | CAR | CAM | HAM1 | 144.3° | 149.9° |
| CAI | CAR | CAM | HAM2 | 24.5° | 30.0° |
| CAE | CAC | CAF | HAC | 180.0° | 180.0° |
| CAE | CAC | CAF | CAJ | 1.1° | 0.0° |
| CAC | CAE | CAI | HAI | 178.4° | 179.7° |
| CAE | CAC | CAF | HAF | 178.9° | 180.0° |
| CAC | CAF | CAJ | HAF | 180.0° | 179.9° |
| CAC | CAF | CAJ | CAR | 1.3° | 0.1° |
| CAF | CAC | CAE | HAE | 179.6° | 179.9° |
| CAC | CAF | CAJ | HAJ | 178.7° | 179.9° |
| CAF | CAJ | CAR | HAJ | 180.0° | 179.9° |
| CAF | CAJ | CAR | CAM | 178.1° | 180.0° |
| CAJ | CAF | CAC | HAC | 179.0° | 180.0° |
| CAJ | CAR | CAM | CAN | 82.6° | 90.1° |
| CAJ | CAR | CAI | HAI | 178.6° | 179.6° |
| CAR | CAJ | CAF | HAF | 178.8° | 179.9° |
| CAJ | CAR | CAM | HAM1 | 37.5° | 29.9° |
| CAJ | CAR | CAM | HAM2 | 157.2° | 149.9° |
| CAR | CAM | CAN | HAM1 | 120.1° | 120.1° |
| CAR | CAM | CAN | HAM2 | 120.1° | 120.0° |
| CAR | CAM | CAN | CAU | 56.5° | 180.0° |
| CAM | CAR | CAI | HAI | 0.4° | 0.2° |
| CAM | CAR | CAJ | HAJ | 1.9° | 0.2° |
| CAR | CAM | HAM1 | HAM2 | 119.6° | 120.0° |
| CAR | CAM | CAN | HAN1 | 176.8° | 59.9° |
| CAR | CAM | CAN | HAN2 | 63.8° | 60.0° |
| CAM | CAN | CAU | HAN1 | 120.3° | 120.1° |
| CAM | CAN | CAU | HAN2 | 120.3° | 120.0° |
| CAM | CAN | CAU | CAY | 76.8° | 90.1° |
| CAM | CAN | CAU | CAV | 105.7° | 90.3° |
| CAN | CAM | HAM1 | HAM2 | 119.6° | 120.0° |
| CAM | CAN | HAN1 | HAN2 | 119.2° | 120.0° |
| CAN | CAU | CAY | CAV | 177.9° | 179.7° |
| CAN | CAU | CAY | CAW | 1.5° | 0.1° |
| CAN | CAU | CAY | CAX | 179.8° | 179.9° |
| CAN | CAU | CAV | NAQ | 179.7° | 179.9° |
| CAN | CAU | CAV | CAT | 6.5° | 0.1° |
| CAU | CAN | CAM | HAM1 | 63.6° | 59.9° |
| CAU | CAN | CAM | HAM2 | 176.6° | 60.0° |
| CAU | CAN | HAN1 | HAN2 | 119.1° | 120.0° |
| CAU | CAY | CAW | CAX | 178.2° | 180.0° |
| CAU | CAY | CAW | OAB | 0.1° | 0.0° |
| CAU | CAY | CAW | NAP | 179.8° | 180.0° |
| CAU | CAY | CAX | NAO | 179.7° | 180.0° |
| CAU | CAY | CAX | NAQ | 1.4° | 0.0° |
| CAY | CAU | CAV | NAQ | 2.3° | 0.4° |
| CAY | CAU | CAV | CAT | 175.6° | 179.7° |
| CAY | CAU | CAN | HAN1 | 43.5° | 30.0° |
| CAY | CAU | CAN | HAN2 | 162.9° | 150.0° |
| CAV | CAU | CAY | CAW | 179.5° | 179.7° |
| CAV | CAU | CAY | CAX | 2.3° | 0.3° |
| CAU | CAV | NAQ | CAX | 1.5° | 0.4° |
| CAU | CAV | NAQ | CAT | 174.0° | 179.8° |
| CAU | CAV | CAT | CAK | 151.9° | 134.9° |
| CAU | CAV | CAT | CAL | 20.7° | 45.3° |
| CAV | CAU | CAN | HAN1 | 134.1° | 149.6° |
| CAV | CAU | CAN | HAN2 | 14.7° | 29.7° |
| CAU | CAV | NAQ | HAQ | 178.5° | 179.8° |
| CAY | CAW | OAB | NAP | 179.7° | 179.9° |
| CAY | CAW | NAP | CAS | 1.8° | 0.0° |
| CAW | CAY | CAX | NAO | 1.6° | 0.0° |
| CAW | CAY | CAX | NAQ | 180.0° | 180.0° |
| CAY | CAW | NAP | HAP | 178.2° | 180.0° |
| CAX | CAY | CAW | OAB | 178.3° | 180.0° |
| CAX | CAY | CAW | NAP | 2.1° | 0.0° |
| CAY | CAX | NAO | CAS | 0.8° | 0.0° |
| CAY | CAX | NAO | NAQ | 178.1° | 179.9° |
| CAY | CAX | NAQ | CAV | 0.1° | 0.2° |
| CAY | CAX | NAQ | HAQ | 179.9° | 179.9° |
| OAB | CAW | NAP | CAS | 178.5° | 180.0° |
| OAB | CAW | NAP | HAP | 1.5° | 0.0° |
| CAW | NAP | CAS | HAP | 180.0° | 180.0° |
| CAW | NAP | CAS | NAA | 177.0° | 180.0° |
| CAW | NAP | CAS | NAO | 0.9° | 0.0° |
| NAP | CAS | NAA | NAO | 177.9° | 180.0° |
| NAP | CAS | NAO | CAX | 0.4° | 0.0° |
| NAP | CAS | NAA | HAA1 | 177.9° | 0.0° |
| NAP | CAS | NAA | HAA2 | 2.1° | 180.0° |
| NAA | CAS | NAO | CAX | 177.5° | 180.0° |
| NAA | CAS | NAP | HAP | 3.0° | 0.0° |
| CAS | NAA | HAA1 | HAA2 | 180.0° | 180.0° |
| CAS | NAO | CAX | NAQ | 178.9° | 180.0° |
| NAO | CAS | NAP | HAP | 179.1° | 180.0° |
| NAO | CAS | NAA | HAA1 | 0.0° | 180.0° |
| NAO | CAS | NAA | HAA2 | 180.0° | 0.0° |
| NAO | CAX | NAQ | CAV | 178.2° | 179.7° |
| NAO | CAX | NAQ | HAQ | 1.8° | 0.1° |
| CAX | NAQ | CAV | HAQ | 180.0° | 179.8° |
| CAX | NAQ | CAV | CAT | 175.5° | 179.8° |
| NAQ | CAV | CAT | CAK | 20.7° | 44.9° |
| NAQ | CAV | CAT | CAL | 166.7° | 134.9° |
| CAV | CAT | CAK | CAL | 173.1° | 179.8° |
| CAV | CAT | CAK | CAG | 176.7° | 180.0° |
| CAV | CAT | CAL | CAH | 175.7° | 179.8° |
| CAT | CAV | NAQ | HAQ | 4.5° | 0.1° |
| CAV | CAT | CAK | HAK | 3.3° | 0.0° |
| CAV | CAT | CAL | HAL | 4.3° | 0.0° |
| CAT | CAK | CAG | HAK | 180.0° | 180.0° |
| CAT | CAK | CAG | CAD | 2.0° | 0.0° |
| CAK | CAT | CAL | CAH | 3.3° | 0.5° |
| CAK | CAT | CAL | HAL | 176.7° | 179.8° |
| CAT | CAK | CAG | HAG | 178.0° | 180.0° |
| CAL | CAT | CAK | CAG | 3.5° | 0.2° |
| CAT | CAL | CAH | CAD | 1.5° | 0.5° |
| CAT | CAL | CAH | HAL | 180.0° | 179.8° |
| CAL | CAT | CAK | HAK | 176.5° | 179.8° |
| CAT | CAL | CAH | HAH | 178.4° | 179.8° |
| CAK | CAG | CAD | HAG | 180.0° | 180.0° |
| CAK | CAG | CAD | CAH | 0.2° | 0.0° |
| CAK | CAG | CAD | HAD | 179.8° | 180.0° |
| CAG | CAD | CAH | HAD | 180.0° | 180.0° |
| CAG | CAD | CAH | CAL | 0.1° | 0.2° |
| CAD | CAG | CAK | HAK | 178.0° | 180.0° |
| CAG | CAD | CAH | HAH | 180.0° | 180.0° |
| CAD | CAH | CAL | HAH | 180.0° | 179.8° |
| CAD | CAH | CAL | HAL | 178.5° | 179.8° |
| CAH | CAD | CAG | HAG | 179.8° | 180.0° |
| CAL | CAH | CAD | HAD | 180.0° | 179.8° |
| HAI | CAI | CAE | HAE | 1.6° | 0.3° |
| HAE | CAE | CAC | HAC | 0.4° | 0.1° |
| HAC | CAC | CAF | HAF | 1.0° | 0.1° |
| HAF | CAF | CAJ | HAJ | 1.2° | 0.0° |
| HAM1 | CAM | CAN | HAN1 | 56.7° | 180.0° |
| HAM1 | CAM | CAN | HAN2 | 176.1° | 60.0° |
| HAM2 | CAM | CAN | HAN1 | 63.1° | 60.1° |
| HAM2 | CAM | CAN | HAN2 | 56.3° | 180.0° |
| HAK | CAK | CAG | HAG | 2.0° | 0.0° |
| HAL | CAL | CAH | HAH | 1.6° | 0.0° |
| HAG | CAG | CAD | HAD | 0.2° | 0.0° |
| HAD | CAD | CAH | HAH | 0.0° | 0.0° |
