QUW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| NAA | CAX | sing | 1.37Å | 1.33Å | |
| OAB | CAU | doub | 1.22Å | 1.23Å | |
| OAC | CBB | doub | 1.22Å | 1.23Å | |
| OAD | CAM | sing | 1.43Å | 1.42Å | |
| OAE | NBE | sing | 1.42Å | 1.32Å | |
| FAF | CAV | sing | 1.35Å | 1.33Å | |
| FAG | CAY | sing | 1.35Å | 1.30Å | |
| CAH | CAI | doub | 1.38Å | 1.39Å | Aromatic |
| CAH | CAV | sing | 1.39Å | 1.39Å | Aromatic |
| CAI | CAZ | sing | 1.38Å | 1.39Å | Aromatic |
| CAJ | NAS | doub | 1.32Å | 1.43Å | Aromatic |
| CAJ | CAW | sing | 1.39Å | 1.40Å | Aromatic |
| CAK | CAV | doub | 1.38Å | 1.39Å | Aromatic |
| CAK | CAY | sing | 1.38Å | 1.39Å | Aromatic |
| CAL | CAW | doub | 1.38Å | 1.37Å | Aromatic |
| CAL | CBC | sing | 1.40Å | 1.38Å | Aromatic |
| CAM | CAN | sing | 1.53Å | 1.52Å | |
| CAN | CAO | sing | 1.53Å | 1.53Å | |
| CAO | CAP | sing | 1.53Å | 1.52Å | |
| CAP | CAQ | sing | 1.53Å | 1.56Å | |
| CAQ | CAW | sing | 1.51Å | 1.42Å | |
| CAR | NAT | sing | 1.46Å | 1.48Å | |
| CAR | CAZ | sing | 1.51Å | 1.39Å | |
| NAS | CBD | sing | 1.33Å | 1.36Å | Aromatic |
| NAT | CAU | sing | 1.35Å | 1.34Å | |
| CAU | CBA | sing | 1.47Å | 1.39Å | |
| CAX | CBA | doub | 1.40Å | 1.38Å | |
| CAX | CBC | sing | 1.47Å | 1.38Å | |
| CAY | CAZ | doub | 1.38Å | 1.39Å | Aromatic |
| CBA | CBB | sing | 1.42Å | 1.39Å | |
| CBB | NBE | sing | 1.34Å | 1.36Å | |
| CBC | CBD | doub | 1.41Å | 1.39Å | Aromatic |
| CBD | NBE | sing | 1.38Å | 1.35Å | |
| NAA | HNAA | sing | 0.97Å | 1.00Å | |
| NAA | HNAB | sing | 0.97Å | 1.00Å | |
| OAD | HOAD | sing | 0.97Å | 0.95Å | |
| OAE | HOAE | sing | 0.97Å | 0.95Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CAL | HAL | sing | 1.08Å | 1.08Å | |
| CAM | HAM | sing | 1.09Å | 1.10Å | |
| CAM | HAMA | sing | 1.09Å | 1.10Å | |
| CAN | HAN | sing | 1.09Å | 1.10Å | |
| CAN | HANA | sing | 1.09Å | 1.10Å | |
| CAO | HAO | sing | 1.09Å | 1.10Å | |
| CAO | HAOA | sing | 1.09Å | 1.10Å | |
| CAP | HAP | sing | 1.09Å | 1.10Å | |
| CAP | HAPA | sing | 1.09Å | 1.10Å | |
| CAQ | HAQ | sing | 1.09Å | 1.10Å | |
| CAQ | HAQA | sing | 1.09Å | 1.10Å | |
| CAR | HAR | sing | 1.09Å | 1.10Å | |
| CAR | HARA | sing | 1.09Å | 1.10Å | |
| NAT | HNAT | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| NAA | CAX | CBA | 119.4° | 121.0° |
| NAA | CAX | CBC | 118.9° | 121.0° |
| CAX | NAA | HNAA | 109.5° | 120.0° |
| CAX | NAA | HNAB | 109.4° | 120.0° |
| OAB | CAU | NAT | 121.9° | 120.0° |
| OAB | CAU | CBA | 121.2° | 120.0° |
| OAC | CBB | CBA | 120.1° | 119.2° |
| OAC | CBB | NBE | 119.1° | 119.2° |
| OAD | CAM | CAN | 109.6° | 109.5° |
| CAM | OAD | HOAD | 109.5° | 114.0° |
| OAD | CAM | HAM | 109.5° | 109.5° |
| OAD | CAM | HAMA | 109.4° | 109.5° |
| OAE | NBE | CBB | 119.0° | 119.0° |
| OAE | NBE | CBD | 118.7° | 119.1° |
| NBE | OAE | HOAE | 109.5° | 114.0° |
| FAF | CAV | CAH | 119.7° | 120.0° |
| FAF | CAV | CAK | 119.8° | 120.0° |
| FAG | CAY | CAK | 119.2° | 120.1° |
| FAG | CAY | CAZ | 120.5° | 120.0° |
| CAI | CAH | CAV | 119.9° | 120.0° |
| CAH | CAI | CAZ | 119.8° | 120.0° |
| CAI | CAH | HAH | 120.0° | 120.0° |
| CAH | CAI | HAI | 120.1° | 119.9° |
| CAH | CAV | CAK | 120.5° | 120.0° |
| CAV | CAH | HAH | 120.1° | 120.0° |
| CAI | CAZ | CAR | 119.2° | 120.0° |
| CAI | CAZ | CAY | 120.0° | 120.1° |
| CAZ | CAI | HAI | 120.1° | 120.0° |
| NAS | CAJ | CAW | 120.4° | 121.6° |
| CAJ | NAS | CBD | 119.7° | 121.7° |
| NAS | CAJ | HAJ | 119.8° | 119.2° |
| CAJ | CAW | CAL | 118.5° | 119.4° |
| CAJ | CAW | CAQ | 127.8° | 120.3° |
| CAW | CAJ | HAJ | 119.8° | 119.2° |
| CAV | CAK | CAY | 119.5° | 120.0° |
| CAV | CAK | HAK | 120.2° | 120.0° |
| CAK | CAY | CAZ | 120.2° | 119.9° |
| CAY | CAK | HAK | 120.3° | 120.0° |
| CAW | CAL | CBC | 120.5° | 118.0° |
| CAL | CAW | CAQ | 113.7° | 120.3° |
| CAW | CAL | HAL | 119.8° | 121.0° |
| CAL | CBC | CAX | 119.1° | 121.1° |
| CAL | CBC | CBD | 121.6° | 119.5° |
| CBC | CAL | HAL | 119.7° | 121.0° |
| CAM | CAN | CAO | 105.6° | 109.5° |
| CAN | CAM | HAM | 109.4° | 109.5° |
| CAN | CAM | HAMA | 109.4° | 109.5° |
| CAM | CAN | HAN | 110.4° | 109.5° |
| CAM | CAN | HANA | 110.4° | 109.5° |
| CAN | CAO | CAP | 113.5° | 109.4° |
| CAO | CAN | HAN | 110.4° | 109.5° |
| CAO | CAN | HANA | 110.4° | 109.5° |
| CAN | CAO | HAO | 108.5° | 109.4° |
| CAN | CAO | HAOA | 108.4° | 109.5° |
| CAO | CAP | CAQ | 108.9° | 109.5° |
| CAP | CAO | HAO | 108.5° | 109.5° |
| CAP | CAO | HAOA | 108.5° | 109.5° |
| CAO | CAP | HAP | 109.6° | 109.5° |
| CAO | CAP | HAPA | 109.6° | 109.5° |
| CAP | CAQ | CAW | 110.4° | 109.5° |
| CAQ | CAP | HAP | 109.6° | 109.4° |
| CAQ | CAP | HAPA | 109.6° | 109.4° |
| CAP | CAQ | HAQ | 109.2° | 109.4° |
| CAP | CAQ | HAQA | 109.2° | 109.5° |
| CAW | CAQ | HAQ | 109.2° | 109.5° |
| CAW | CAQ | HAQA | 109.2° | 109.5° |
| NAT | CAR | CAZ | 113.5° | 109.5° |
| CAR | NAT | CAU | 120.3° | 120.0° |
| NAT | CAR | HAR | 108.4° | 109.5° |
| NAT | CAR | HARA | 108.4° | 109.5° |
| CAR | NAT | HNAT | 119.8° | 120.0° |
| CAR | CAZ | CAY | 120.7° | 120.0° |
| CAZ | CAR | HAR | 108.5° | 109.4° |
| CAZ | CAR | HARA | 108.5° | 109.5° |
| NAS | CBD | CBC | 119.3° | 119.8° |
| NAS | CBD | NBE | 121.9° | 120.4° |
| NAT | CAU | CBA | 116.8° | 120.0° |
| CAU | NAT | HNAT | 119.8° | 120.0° |
| CAU | CBA | CAX | 119.5° | 120.3° |
| CAU | CBA | CBB | 123.4° | 120.3° |
| CBA | CAX | CBC | 121.8° | 118.0° |
| CAX | CBA | CBB | 117.1° | 119.4° |
| CAX | CBC | CBD | 119.3° | 119.3° |
| CBA | CBB | NBE | 120.8° | 121.7° |
| CBB | NBE | CBD | 122.3° | 121.8° |
| CBC | CBD | NBE | 118.8° | 119.8° |
| HNAA | NAA | HNAB | 109.5° | 120.0° |
| HAM | CAM | HAMA | 109.5° | 109.4° |
| HAN | CAN | HANA | 109.5° | 109.4° |
| HAO | CAO | HAOA | 109.4° | 109.5° |
| HAP | CAP | HAPA | 109.4° | 109.5° |
| HAQ | CAQ | HAQA | 109.5° | 109.4° |
| HAR | CAR | HARA | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| NAA | CAX | CBC | CAL | 0.7° | 0.0° |
| NAA | CAX | CBA | CAU | 1.2° | 0.0° |
| NAA | CAX | CBA | CBC | 178.6° | 180.0° |
| NAA | CAX | CBA | CBB | 179.7° | 179.9° |
| NAA | CAX | CBC | CBD | 179.5° | 179.9° |
| CAX | NAA | HNAA | HNAB | 120.0° | 179.7° |
| OAB | CAU | NAT | CAR | 2.6° | 5.5° |
| OAB | CAU | NAT | CBA | 177.4° | 179.9° |
| OAB | CAU | CBA | CAX | 4.0° | 6.7° |
| OAB | CAU | CBA | CBB | 175.1° | 173.3° |
| OAB | CAU | NAT | HNAT | 177.4° | 174.5° |
| OAC | CBB | NBE | OAE | 0.6° | 0.0° |
| OAC | CBB | CBA | CAU | 0.4° | 0.0° |
| OAC | CBB | CBA | CAX | 179.4° | 180.0° |
| OAC | CBB | CBA | NBE | 179.8° | 179.9° |
| OAC | CBB | NBE | CBD | 180.0° | 180.0° |
| OAD | CAM | CAN | HAM | 120.1° | 120.0° |
| OAD | CAM | CAN | HAMA | 120.0° | 120.0° |
| OAD | CAM | CAN | CAO | 179.2° | 180.0° |
| OAD | CAM | HAM | HAMA | 119.9° | 120.0° |
| OAD | CAM | CAN | HAN | 59.8° | 60.0° |
| OAD | CAM | CAN | HANA | 61.4° | 60.0° |
| OAE | NBE | CBD | NAS | 0.7° | 0.1° |
| OAE | NBE | CBB | CBA | 179.5° | 179.9° |
| OAE | NBE | CBB | CBD | 179.4° | 180.0° |
| OAE | NBE | CBD | CBC | 179.3° | 180.0° |
| FAF | CAV | CAH | CAI | 180.0° | 180.0° |
| FAF | CAV | CAH | CAK | 180.0° | 180.0° |
| FAF | CAV | CAK | CAY | 179.9° | 180.0° |
| FAF | CAV | CAH | HAH | 0.1° | 0.3° |
| FAF | CAV | CAK | HAK | 0.1° | 0.0° |
| FAG | CAY | CAZ | CAI | 179.8° | 180.0° |
| FAG | CAY | CAK | CAV | 179.8° | 180.0° |
| FAG | CAY | CAK | CAZ | 179.3° | 180.0° |
| FAG | CAY | CAZ | CAR | 1.4° | 0.0° |
| FAG | CAY | CAK | HAK | 0.2° | 0.0° |
| CAI | CAH | CAV | HAH | 180.0° | 179.7° |
| CAH | CAI | CAZ | HAI | 180.0° | 179.9° |
| CAI | CAH | CAV | CAK | 0.0° | 0.1° |
| CAH | CAI | CAZ | CAR | 179.3° | 180.0° |
| CAH | CAI | CAZ | CAY | 0.9° | 0.0° |
| CAV | CAH | CAI | CAZ | 0.5° | 0.0° |
| CAH | CAV | CAK | CAY | 0.0° | 0.1° |
| CAV | CAH | CAI | HAI | 179.5° | 180.0° |
| CAH | CAV | CAK | HAK | 180.0° | 180.0° |
| CAI | CAZ | CAY | CAK | 0.9° | 0.1° |
| CAI | CAZ | CAR | NAT | 121.6° | 105.0° |
| CAI | CAZ | CAR | CAY | 178.4° | 179.9° |
| CAZ | CAI | CAH | HAH | 179.5° | 179.7° |
| CAI | CAZ | CAR | HAR | 117.8° | 15.0° |
| CAI | CAZ | CAR | HARA | 1.1° | 135.0° |
| NAS | CAJ | CAW | HAJ | 180.0° | 179.6° |
| NAS | CAJ | CAW | CAL | 0.8° | 0.1° |
| NAS | CAJ | CAW | CAQ | 179.5° | 179.9° |
| CAJ | NAS | CBD | CBC | 0.0° | 0.0° |
| CAJ | NAS | CBD | NBE | 180.0° | 180.0° |
| CAJ | CAW | CAL | CAQ | 178.9° | 180.0° |
| CAJ | CAW | CAL | CBC | 0.8° | 0.1° |
| CAJ | CAW | CAQ | CAP | 92.6° | 90.0° |
| CAW | CAJ | NAS | CBD | 0.4° | 0.1° |
| CAJ | CAW | CAL | HAL | 179.3° | 180.0° |
| CAJ | CAW | CAQ | HAQ | 27.5° | 30.0° |
| CAJ | CAW | CAQ | HAQA | 147.2° | 150.0° |
| CAV | CAK | CAY | HAK | 180.0° | 180.0° |
| CAV | CAK | CAY | CAZ | 0.5° | 0.1° |
| CAK | CAV | CAH | HAH | 180.0° | 179.7° |
| CAK | CAY | CAZ | CAR | 179.3° | 180.0° |
| CAW | CAL | CBC | HAL | 180.0° | 180.0° |
| CAL | CAW | CAQ | CAP | 88.6° | 90.0° |
| CAW | CAL | CBC | CAX | 179.4° | 180.0° |
| CAW | CAL | CBC | CBD | 0.4° | 0.0° |
| CAL | CAW | CAJ | HAJ | 179.2° | 179.7° |
| CAL | CAW | CAQ | HAQ | 151.3° | 150.0° |
| CAL | CAW | CAQ | HAQA | 31.5° | 30.0° |
| CBC | CAL | CAW | CAQ | 179.6° | 179.9° |
| CAL | CBC | CBD | NAS | 0.0° | 0.0° |
| CAL | CBC | CAX | CBA | 179.3° | 180.0° |
| CAL | CBC | CAX | CBD | 179.7° | 179.9° |
| CAL | CBC | CBD | NBE | 180.0° | 180.0° |
| CAM | CAN | CAO | HAN | 119.4° | 120.0° |
| CAM | CAN | CAO | HANA | 119.4° | 120.0° |
| CAM | CAN | CAO | CAP | 63.5° | 180.0° |
| CAN | CAM | OAD | HOAD | 180.0° | 180.0° |
| CAN | CAM | HAM | HAMA | 119.9° | 120.0° |
| CAM | CAN | HAN | HANA | 121.8° | 120.0° |
| CAM | CAN | CAO | HAO | 57.2° | 60.0° |
| CAM | CAN | CAO | HAOA | 175.9° | 60.0° |
| CAN | CAO | CAP | HAO | 120.6° | 119.9° |
| CAN | CAO | CAP | HAOA | 120.6° | 120.0° |
| CAN | CAO | CAP | CAQ | 176.2° | 180.0° |
| CAO | CAN | CAM | HAM | 60.8° | 60.0° |
| CAO | CAN | CAM | HAMA | 59.2° | 60.0° |
| CAO | CAN | HAN | HANA | 121.8° | 120.0° |
| CAN | CAO | HAO | HAOA | 118.1° | 120.1° |
| CAN | CAO | CAP | HAP | 63.8° | 60.1° |
| CAN | CAO | CAP | HAPA | 56.3° | 60.0° |
| CAO | CAP | CAQ | HAP | 119.9° | 120.0° |
| CAO | CAP | CAQ | HAPA | 119.9° | 120.0° |
| CAO | CAP | CAQ | CAW | 66.2° | 180.0° |
| CAP | CAO | CAN | HAN | 177.2° | 60.0° |
| CAP | CAO | CAN | HANA | 55.9° | 60.0° |
| CAP | CAO | HAO | HAOA | 118.1° | 120.0° |
| CAO | CAP | HAP | HAPA | 120.3° | 120.1° |
| CAO | CAP | CAQ | HAQ | 53.9° | 60.0° |
| CAO | CAP | CAQ | HAQA | 173.6° | 59.9° |
| CAP | CAQ | CAW | HAQ | 120.1° | 120.0° |
| CAP | CAQ | CAW | HAQA | 120.1° | 120.0° |
| CAQ | CAP | CAO | HAO | 55.6° | 60.1° |
| CAQ | CAP | CAO | HAOA | 63.1° | 60.0° |
| CAQ | CAP | HAP | HAPA | 120.3° | 119.9° |
| CAP | CAQ | HAQ | HAQA | 119.6° | 119.9° |
| CAQ | CAW | CAJ | HAJ | 0.5° | 0.3° |
| CAQ | CAW | CAL | HAL | 0.4° | 0.0° |
| CAW | CAQ | CAP | HAP | 173.8° | 60.0° |
| CAW | CAQ | CAP | HAPA | 53.7° | 60.0° |
| CAW | CAQ | HAQ | HAQA | 119.6° | 120.0° |
| NAT | CAR | CAZ | HAR | 120.6° | 120.0° |
| NAT | CAR | CAZ | HARA | 120.6° | 120.0° |
| CAR | NAT | CAU | HNAT | 180.0° | 180.0° |
| CAR | NAT | CAU | CBA | 180.0° | 174.6° |
| NAT | CAR | CAZ | CAY | 60.0° | 74.9° |
| NAT | CAR | HAR | HARA | 118.2° | 120.0° |
| CAZ | CAR | NAT | CAU | 104.8° | 180.0° |
| CAR | CAZ | CAI | HAI | 0.7° | 0.1° |
| CAZ | CAR | HAR | HARA | 118.2° | 120.0° |
| CAZ | CAR | NAT | HNAT | 75.2° | 0.0° |
| NAS | CBD | CBC | CAX | 179.7° | 180.0° |
| NAS | CBD | NBE | CBB | 179.9° | 180.0° |
| NAS | CBD | CBC | NBE | 180.0° | 180.0° |
| CBD | NAS | CAJ | HAJ | 179.6° | 179.7° |
| NAT | CAU | CBA | CAX | 178.6° | 173.2° |
| NAT | CAU | CBA | CBB | 2.4° | 6.8° |
| CAU | NAT | CAR | HAR | 134.6° | 60.0° |
| CAU | NAT | CAR | HARA | 15.8° | 60.0° |
| CAU | CBA | CAX | CBB | 179.1° | 180.0° |
| CAU | CBA | CAX | CBC | 179.7° | 180.0° |
| CAU | CBA | CBB | NBE | 179.8° | 180.0° |
| CBA | CAU | NAT | HNAT | 0.0° | 5.4° |
| CAX | CBA | CBB | NBE | 0.8° | 0.0° |
| CBA | CAX | CBC | CBD | 0.9° | 0.0° |
| CBA | CAX | NAA | HNAA | 180.0° | 5.3° |
| CBA | CAX | NAA | HNAB | 60.0° | 174.4° |
| CBC | CAX | CBA | CBB | 1.2° | 0.1° |
| CAX | CBC | CBD | NBE | 0.3° | 0.0° |
| CBC | CAX | NAA | HNAA | 1.4° | 174.7° |
| CBC | CAX | NAA | HNAB | 121.4° | 5.6° |
| CAX | CBC | CAL | HAL | 0.6° | 0.1° |
| CAY | CAZ | CAI | HAI | 179.1° | 180.0° |
| CAZ | CAY | CAK | HAK | 179.5° | 180.0° |
| CAY | CAZ | CAR | HAR | 60.5° | 165.1° |
| CAY | CAZ | CAR | HARA | 179.4° | 45.1° |
| CBA | CBB | NBE | CBD | 0.1° | 0.0° |
| CBB | NBE | CBD | CBC | 0.2° | 0.0° |
| CBB | NBE | OAE | HOAE | 0.3° | 0.0° |
| CBD | CBC | CAL | HAL | 179.7° | 180.0° |
| CBD | NBE | OAE | HOAE | 179.8° | 180.0° |
| HOAD | OAD | CAM | HAM | 59.9° | 60.0° |
| HOAD | OAD | CAM | HAMA | 60.0° | 60.0° |
| HAH | CAH | CAI | HAI | 0.5° | 0.3° |
| HAM | CAM | CAN | HAN | 179.9° | 180.0° |
| HAM | CAM | CAN | HANA | 58.7° | 60.0° |
| HAMA | CAM | CAN | HAN | 60.2° | 60.0° |
| HAMA | CAM | CAN | HANA | 178.6° | NaN° |
| HAN | CAN | CAO | HAO | 62.2° | 180.0° |
| HAN | CAN | CAO | HAOA | 56.6° | 60.0° |
| HANA | CAN | CAO | HAO | 176.6° | 60.0° |
| HANA | CAN | CAO | HAOA | 64.7° | 180.0° |
| HAO | CAO | CAP | HAP | 175.5° | 180.0° |
| HAO | CAO | CAP | HAPA | 64.3° | 59.9° |
| HAOA | CAO | CAP | HAP | 56.8° | 59.9° |
| HAOA | CAO | CAP | HAPA | 176.9° | 180.0° |
| HAP | CAP | CAQ | HAQ | 66.0° | 180.0° |
| HAP | CAP | CAQ | HAQA | 53.7° | 60.0° |
| HAPA | CAP | CAQ | HAQ | 173.8° | 60.1° |
| HAPA | CAP | CAQ | HAQA | 66.5° | 180.0° |
| HAR | CAR | NAT | HNAT | 45.4° | 120.0° |
| HARA | CAR | NAT | HNAT | 164.2° | 120.0° |
