74X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAC | CAZ | doub | 1.22Å | 1.22Å | |
| CAZ | NAR | sing | 1.35Å | 1.38Å | |
| CAZ | NBD | sing | 1.35Å | 1.38Å | |
| NAR | CAY | sing | 1.35Å | 1.37Å | |
| CAY | OAB | doub | 1.22Å | 1.24Å | |
| CAY | CAU | sing | 1.42Å | 1.42Å | |
| CAU | CAA | sing | 1.51Å | 1.51Å | |
| CAU | CAM | doub | 1.35Å | 1.37Å | |
| CAM | NBD | sing | 1.37Å | 1.39Å | |
| NBD | CBC | sing | 1.47Å | 1.48Å | |
| CBC | OAS | sing | 1.43Å | 1.44Å | |
| CBC | CAO | sing | 1.54Å | 1.51Å | |
| OAS | CBB | sing | 1.44Å | 1.43Å | |
| CAO | CBA | sing | 1.55Å | 1.51Å | |
| CBA | OAD | sing | 1.43Å | 1.45Å | |
| CBA | CBB | sing | 1.55Å | 1.55Å | |
| CBB | CAN | sing | 1.53Å | 1.58Å | |
| CAN | NAP | sing | 1.46Å | 1.47Å | |
| NAP | CAT | sing | 1.35Å | 1.34Å | |
| CAT | SAE | doub | 1.71Å | 1.74Å | |
| CAT | NAQ | sing | 1.35Å | 1.33Å | |
| NAQ | CAV | sing | 1.40Å | 1.33Å | |
| CAV | CAL | sing | 1.39Å | 1.39Å | Aromatic |
| CAV | CAJ | doub | 1.39Å | 1.39Å | Aromatic |
| CAL | CAX | doub | 1.38Å | 1.39Å | Aromatic |
| CAJ | CAK | sing | 1.38Å | 1.40Å | Aromatic |
| CAK | CAW | doub | 1.38Å | 1.40Å | Aromatic |
| CAW | CLA | sing | 1.74Å | 1.73Å | |
| CAW | CAX | sing | 1.38Å | 1.40Å | Aromatic |
| CAX | CBE | sing | 1.51Å | 1.56Å | |
| CBE | FAG | sing | 1.40Å | 1.31Å | |
| CBE | FAH | sing | 1.40Å | 1.31Å | |
| CBE | FAF | sing | 1.40Å | 1.33Å | |
| NAR | HAR | sing | 0.97Å | 1.00Å | |
| CAA | HAA1 | sing | 1.09Å | 1.10Å | |
| CAA | HAA2 | sing | 1.09Å | 1.10Å | |
| CAA | HAA3 | sing | 1.09Å | 1.10Å | |
| CAM | HAM | sing | 1.08Å | 1.08Å | |
| CBC | HBC | sing | 1.09Å | 1.10Å | |
| CAO | HAO1 | sing | 1.09Å | 1.10Å | |
| CAO | HAO2 | sing | 1.09Å | 1.10Å | |
| CBB | HBB | sing | 1.09Å | 1.10Å | |
| CBA | HBA | sing | 1.09Å | 1.10Å | |
| OAD | HAD | sing | 0.97Å | 0.95Å | |
| CAN | HAN1 | sing | 1.09Å | 1.10Å | |
| CAN | HAN2 | sing | 1.09Å | 1.10Å | |
| NAP | HAP | sing | 0.97Å | 1.00Å | |
| NAQ | HAQ | sing | 0.97Å | 1.00Å | |
| CAL | HAL | sing | 1.08Å | 1.08Å | |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAC | CAZ | NAR | 120.3° | 119.5° |
| OAC | CAZ | NBD | 119.0° | 119.6° |
| NAR | CAZ | NBD | 120.7° | 120.9° |
| CAZ | NAR | CAY | 120.4° | 120.3° |
| CAZ | NAR | HAR | 119.8° | 119.8° |
| CAZ | NBD | CAM | 120.0° | 120.6° |
| CAZ | NBD | CBC | 118.2° | 119.7° |
| NAR | CAY | OAB | 118.3° | 120.3° |
| NAR | CAY | CAU | 118.9° | 119.4° |
| CAY | NAR | HAR | 119.8° | 119.9° |
| OAB | CAY | CAU | 122.8° | 120.3° |
| CAY | CAU | CAA | 121.9° | 120.5° |
| CAY | CAU | CAM | 120.5° | 119.1° |
| CAA | CAU | CAM | 117.6° | 120.4° |
| CAU | CAA | HAA1 | 109.5° | 109.5° |
| CAU | CAA | HAA2 | 109.5° | 109.5° |
| CAU | CAA | HAA3 | 109.5° | 109.5° |
| CAU | CAM | NBD | 119.5° | 119.7° |
| CAU | CAM | HAM | 120.3° | 120.2° |
| CAM | NBD | CBC | 121.9° | 119.7° |
| NBD | CAM | HAM | 120.2° | 120.1° |
| NBD | CBC | OAS | 109.1° | 109.8° |
| NBD | CBC | CAO | 115.2° | 109.8° |
| NBD | CBC | HBC | 107.0° | 109.8° |
| OAS | CBC | CAO | 111.2° | 107.6° |
| CBC | OAS | CBB | 106.8° | 110.0° |
| OAS | CBC | HBC | 107.3° | 109.9° |
| CBC | CAO | CBA | 99.4° | 102.2° |
| CAO | CBC | HBC | 106.5° | 109.9° |
| CBC | CAO | HAO1 | 111.9° | 110.8° |
| CBC | CAO | HAO2 | 111.9° | 110.8° |
| OAS | CBB | CBA | 105.0° | 105.1° |
| OAS | CBB | CAN | 110.3° | 110.3° |
| OAS | CBB | HBB | 110.1° | 110.3° |
| CAO | CBA | OAD | 108.8° | 111.1° |
| CAO | CBA | CBB | 103.8° | 100.9° |
| CBA | CAO | HAO1 | 111.9° | 110.9° |
| CBA | CAO | HAO2 | 111.9° | 110.9° |
| CAO | CBA | HBA | 110.9° | 111.1° |
| OAD | CBA | CBB | 110.9° | 111.1° |
| OAD | CBA | HBA | 111.8° | 111.1° |
| CBA | OAD | HAD | 109.5° | 114.0° |
| CBA | CBB | CAN | 114.9° | 110.3° |
| CBA | CBB | HBB | 108.4° | 110.3° |
| CBB | CBA | HBA | 110.3° | 111.2° |
| CBB | CAN | NAP | 103.2° | 109.5° |
| CAN | CBB | HBB | 108.1° | 110.4° |
| CBB | CAN | HAN1 | 111.0° | 109.5° |
| CBB | CAN | HAN2 | 111.0° | 109.5° |
| CAN | NAP | CAT | 123.4° | 120.0° |
| NAP | CAN | HAN1 | 111.0° | 109.5° |
| NAP | CAN | HAN2 | 111.0° | 109.4° |
| CAN | NAP | HAP | 118.3° | 120.0° |
| NAP | CAT | SAE | 122.7° | 120.0° |
| NAP | CAT | NAQ | 116.9° | 120.0° |
| CAT | NAP | HAP | 118.3° | 119.9° |
| SAE | CAT | NAQ | 120.0° | 120.0° |
| CAT | NAQ | CAV | 124.3° | 120.0° |
| CAT | NAQ | HAQ | 117.9° | 120.0° |
| NAQ | CAV | CAL | 115.5° | 120.1° |
| NAQ | CAV | CAJ | 124.8° | 120.0° |
| CAV | NAQ | HAQ | 117.8° | 120.0° |
| CAL | CAV | CAJ | 119.6° | 119.9° |
| CAV | CAL | CAX | 122.6° | 119.9° |
| CAV | CAL | HAL | 118.7° | 120.0° |
| CAV | CAJ | CAK | 118.9° | 119.9° |
| CAV | CAJ | HAJ | 120.6° | 120.0° |
| CAL | CAX | CAW | 117.3° | 120.1° |
| CAL | CAX | CBE | 120.6° | 119.9° |
| CAX | CAL | HAL | 118.7° | 120.1° |
| CAJ | CAK | CAW | 120.6° | 120.1° |
| CAK | CAJ | HAJ | 120.6° | 120.0° |
| CAJ | CAK | HAK | 119.7° | 120.0° |
| CAK | CAW | CLA | 118.1° | 120.0° |
| CAK | CAW | CAX | 121.0° | 120.1° |
| CAW | CAK | HAK | 119.7° | 120.0° |
| CLA | CAW | CAX | 120.9° | 119.9° |
| CAW | CAX | CBE | 122.1° | 120.0° |
| CAX | CBE | FAG | 112.7° | 109.5° |
| CAX | CBE | FAH | 109.9° | 109.5° |
| CAX | CBE | FAF | 111.3° | 109.4° |
| FAG | CBE | FAH | 104.6° | 109.5° |
| FAG | CBE | FAF | 109.0° | 109.5° |
| FAH | CBE | FAF | 109.2° | 109.5° |
| HAA1 | CAA | HAA2 | 109.4° | 109.4° |
| HAA1 | CAA | HAA3 | 109.4° | 109.5° |
| HAA2 | CAA | HAA3 | 109.5° | 109.4° |
| HAO1 | CAO | HAO2 | 109.5° | 110.9° |
| HAN1 | CAN | HAN2 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAC | CAZ | NAR | NBD | 179.6° | 179.8° |
| OAC | CAZ | NAR | CAY | 179.6° | 180.0° |
| OAC | CAZ | NBD | CAM | 179.6° | 179.7° |
| OAC | CAZ | NBD | CBC | 1.4° | 0.1° |
| OAC | CAZ | NAR | HAR | 0.4° | 0.1° |
| CAZ | NAR | CAY | HAR | 180.0° | 180.0° |
| CAZ | NAR | CAY | OAB | 179.4° | 180.0° |
| CAZ | NAR | CAY | CAU | 1.6° | 0.0° |
| NAR | CAZ | NBD | CAM | 0.9° | 0.4° |
| NAR | CAZ | NBD | CBC | 178.2° | 179.8° |
| NBD | CAZ | NAR | CAY | 0.0° | 0.2° |
| CAZ | NBD | CAM | CAU | 0.1° | 0.5° |
| CAZ | NBD | CAM | CBC | 179.0° | 179.8° |
| CAZ | NBD | CBC | OAS | 155.5° | 178.5° |
| CAZ | NBD | CBC | CAO | 78.6° | 60.4° |
| NBD | CAZ | NAR | HAR | 180.0° | 179.8° |
| CAZ | NBD | CAM | HAM | 180.0° | 179.8° |
| CAZ | NBD | CBC | HBC | 39.6° | 60.6° |
| NAR | CAY | OAB | CAU | 179.0° | 180.0° |
| NAR | CAY | CAU | CAA | 178.8° | 180.0° |
| NAR | CAY | CAU | CAM | 2.5° | 0.0° |
| OAB | CAY | CAU | CAA | 0.2° | 0.0° |
| OAB | CAY | CAU | CAM | 178.5° | 180.0° |
| OAB | CAY | NAR | HAR | 0.7° | 0.0° |
| CAY | CAU | CAA | CAM | 178.7° | 179.9° |
| CAY | CAU | CAM | NBD | 1.7° | 0.3° |
| CAU | CAY | NAR | HAR | 178.4° | 180.0° |
| CAY | CAU | CAA | HAA1 | 180.0° | 0.0° |
| CAY | CAU | CAA | HAA2 | 60.0° | 120.0° |
| CAY | CAU | CAA | HAA3 | 60.0° | 120.0° |
| CAY | CAU | CAM | HAM | 178.3° | 180.0° |
| CAA | CAU | CAM | NBD | 179.6° | 179.8° |
| CAU | CAA | HAA1 | HAA2 | 120.0° | 120.0° |
| CAU | CAA | HAA1 | HAA3 | 120.0° | 120.1° |
| CAU | CAA | HAA2 | HAA3 | 120.0° | 120.1° |
| CAA | CAU | CAM | HAM | 0.4° | 0.0° |
| CAU | CAM | NBD | HAM | 180.0° | 179.7° |
| CAU | CAM | NBD | CBC | 179.1° | 179.7° |
| CAM | CAU | CAA | HAA1 | 1.3° | 180.0° |
| CAM | CAU | CAA | HAA2 | 118.7° | 60.0° |
| CAM | CAU | CAA | HAA3 | 121.3° | 60.0° |
| CAM | NBD | CBC | OAS | 23.6° | 1.7° |
| CAM | NBD | CBC | CAO | 102.4° | 119.8° |
| CAM | NBD | CBC | HBC | 139.4° | 119.2° |
| NBD | CBC | OAS | CAO | 128.2° | 119.5° |
| NBD | CBC | OAS | HBC | 115.6° | 120.8° |
| NBD | CBC | CAO | HBC | 118.5° | 120.9° |
| NBD | CBC | OAS | CBB | 125.0° | 117.8° |
| NBD | CBC | CAO | CBA | 100.2° | 140.9° |
| CBC | NBD | CAM | HAM | 0.9° | 0.0° |
| NBD | CBC | CAO | HAO1 | 18.1° | 22.7° |
| NBD | CBC | CAO | HAO2 | 141.4° | 100.9° |
| OAS | CBC | CAO | HBC | 116.7° | 119.6° |
| OAS | CBC | CAO | CBA | 24.7° | 21.4° |
| CBC | OAS | CBB | CBA | 19.5° | 24.4° |
| CBC | OAS | CBB | CAN | 104.9° | 143.3° |
| OAS | CBC | CAO | HAO1 | 143.0° | 96.8° |
| OAS | CBC | CAO | HAO2 | 93.7° | 139.6° |
| CBC | OAS | CBB | HBB | 135.9° | 94.5° |
| CAO | CBC | OAS | CBB | 3.2° | 1.7° |
| CBC | CAO | CBA | HAO1 | 118.4° | 118.2° |
| CBC | CAO | CBA | HAO2 | 118.4° | 118.2° |
| CBC | CAO | CBA | OAD | 83.4° | 152.0° |
| CBC | CAO | CBA | CBB | 34.8° | 34.2° |
| CBC | CAO | HAO1 | HAO2 | 124.7° | 123.6° |
| CBC | CAO | CBA | HBA | 153.2° | 83.8° |
| OAS | CBB | CBA | CAO | 35.4° | 36.5° |
| OAS | CBB | CBA | OAD | 81.4° | 154.3° |
| OAS | CBB | CBA | CAN | 121.4° | 118.9° |
| OAS | CBB | CBA | HBB | 117.6° | 118.9° |
| OAS | CBB | CAN | HBB | 120.4° | 122.2° |
| OAS | CBB | CAN | NAP | 169.1° | 66.4° |
| CBB | OAS | CBC | HBC | 119.4° | 121.3° |
| OAS | CBB | CBA | HBA | 154.2° | 81.5° |
| OAS | CBB | CAN | HAN1 | 71.9° | 173.6° |
| OAS | CBB | CAN | HAN2 | 50.1° | 53.5° |
| CAO | CBA | OAD | CBB | 113.7° | 111.5° |
| CAO | CBA | OAD | HBA | 122.8° | 124.2° |
| CAO | CBA | CBB | HBA | 118.8° | 117.9° |
| CAO | CBA | CBB | CAN | 86.0° | 155.4° |
| CBA | CAO | CBC | HBC | 141.3° | 98.2° |
| CBA | CAO | HAO1 | HAO2 | 124.7° | 123.6° |
| CAO | CBA | CBB | HBB | 152.9° | 82.4° |
| CAO | CBA | OAD | HAD | 180.0° | 61.5° |
| OAD | CBA | CBB | HBA | 124.4° | 124.2° |
| OAD | CBA | CBB | CAN | 157.2° | 86.8° |
| OAD | CBA | CAO | HAO1 | 34.9° | 33.8° |
| OAD | CBA | CAO | HAO2 | 158.2° | 89.8° |
| OAD | CBA | CBB | HBB | 36.2° | 35.4° |
| CBA | CBB | CAN | HBB | 121.2° | 122.2° |
| CBA | CBB | CAN | NAP | 72.5° | 177.9° |
| CBB | CBA | CAO | HAO1 | 153.2° | 84.0° |
| CBB | CBA | CAO | HAO2 | 83.6° | 152.4° |
| CBB | CBA | OAD | HAD | 66.3° | 173.0° |
| CBA | CBB | CAN | HAN1 | 46.5° | 57.9° |
| CBA | CBB | CAN | HAN2 | 168.5° | 62.2° |
| CBB | CAN | NAP | HAN1 | 119.0° | 120.0° |
| CBB | CAN | NAP | HAN2 | 119.0° | 119.9° |
| CBB | CAN | NAP | CAT | 95.2° | 180.0° |
| CAN | CBB | CBA | HBA | 32.8° | 37.4° |
| CBB | CAN | HAN1 | HAN2 | 122.9° | 120.0° |
| CBB | CAN | NAP | HAP | 84.8° | 0.1° |
| CAN | NAP | CAT | HAP | 180.0° | 179.9° |
| CAN | NAP | CAT | SAE | 13.2° | 0.0° |
| CAN | NAP | CAT | NAQ | 174.6° | 179.9° |
| NAP | CAN | CBB | HBB | 48.7° | 55.7° |
| NAP | CAN | HAN1 | HAN2 | 122.9° | 120.0° |
| NAP | CAT | SAE | NAQ | 172.0° | 180.0° |
| NAP | CAT | NAQ | CAV | 176.7° | 175.8° |
| CAT | NAP | CAN | HAN1 | 23.8° | 60.0° |
| CAT | NAP | CAN | HAN2 | 145.8° | 60.0° |
| NAP | CAT | NAQ | HAQ | 3.4° | 4.2° |
| SAE | CAT | NAQ | CAV | 10.9° | 4.2° |
| SAE | CAT | NAP | HAP | 166.8° | 180.0° |
| SAE | CAT | NAQ | HAQ | 169.1° | 175.8° |
| CAT | NAQ | CAV | HAQ | 180.0° | 180.0° |
| CAT | NAQ | CAV | CAL | 106.6° | 45.4° |
| CAT | NAQ | CAV | CAJ | 74.9° | 134.8° |
| NAQ | CAT | NAP | HAP | 5.4° | 0.0° |
| NAQ | CAV | CAL | CAJ | 178.5° | 179.7° |
| NAQ | CAV | CAL | CAX | 179.3° | 180.0° |
| NAQ | CAV | CAJ | CAK | 179.1° | 180.0° |
| NAQ | CAV | CAL | HAL | 0.7° | 0.0° |
| NAQ | CAV | CAJ | HAJ | 0.9° | 0.0° |
| CAV | CAL | CAX | HAL | 180.0° | 180.0° |
| CAL | CAV | CAJ | CAK | 0.7° | 0.2° |
| CAV | CAL | CAX | CAW | 0.7° | 0.0° |
| CAV | CAL | CAX | CBE | 179.6° | 180.0° |
| CAL | CAV | NAQ | HAQ | 73.4° | 134.5° |
| CAL | CAV | CAJ | HAJ | 179.3° | 179.7° |
| CAJ | CAV | CAL | CAX | 0.8° | 0.2° |
| CAV | CAJ | CAK | HAJ | 180.0° | 180.0° |
| CAV | CAJ | CAK | CAW | 0.5° | 0.0° |
| CAJ | CAV | NAQ | HAQ | 105.1° | 45.2° |
| CAJ | CAV | CAL | HAL | 179.2° | 179.8° |
| CAV | CAJ | CAK | HAK | 179.5° | 180.0° |
| CAL | CAX | CAW | CAK | 0.5° | 0.2° |
| CAL | CAX | CAW | CLA | 178.7° | 180.0° |
| CAL | CAX | CAW | CBE | 178.9° | 180.0° |
| CAL | CAX | CBE | FAG | 126.6° | 0.0° |
| CAL | CAX | CBE | FAH | 117.2° | 120.0° |
| CAL | CAX | CBE | FAF | 3.9° | 120.0° |
| CAJ | CAK | CAW | HAK | 180.0° | 180.0° |
| CAJ | CAK | CAW | CLA | 178.8° | 180.0° |
| CAJ | CAK | CAW | CAX | 0.5° | 0.3° |
| CAK | CAW | CLA | CAX | 179.3° | 179.7° |
| CAK | CAW | CAX | CBE | 179.4° | 179.7° |
| CAW | CAK | CAJ | HAJ | 179.4° | 180.0° |
| CLA | CAW | CAX | CBE | 0.1° | 0.0° |
| CLA | CAW | CAK | HAK | 1.2° | 0.0° |
| CAW | CAX | CBE | FAG | 54.5° | 180.0° |
| CAW | CAX | CBE | FAH | 61.7° | 60.0° |
| CAW | CAX | CBE | FAF | 177.3° | 60.0° |
| CAW | CAX | CAL | HAL | 179.3° | 180.0° |
| CAX | CAW | CAK | HAK | 179.6° | 179.8° |
| CAX | CBE | FAG | FAH | 119.3° | 120.0° |
| CAX | CBE | FAG | FAF | 124.0° | 119.9° |
| CAX | CBE | FAH | FAF | 122.3° | 119.9° |
| CBE | CAX | CAL | HAL | 0.4° | 0.0° |
| FAG | CBE | FAH | FAF | 116.5° | 120.0° |
| HAA1 | CAA | HAA2 | HAA3 | 119.9° | 119.9° |
| HBC | CBC | CAO | HAO1 | 100.3° | 143.6° |
| HBC | CBC | CAO | HAO2 | 23.0° | 20.0° |
| HAO1 | CAO | CBA | HBA | 88.4° | 158.0° |
| HAO2 | CAO | CBA | HBA | 34.9° | 34.4° |
| HBB | CBB | CBA | HBA | 88.2° | 159.6° |
| HBB | CBB | CAN | HAN1 | 167.7° | 64.3° |
| HBB | CBB | CAN | HAN2 | 70.3° | 175.6° |
| HBA | CBA | OAD | HAD | 57.2° | 62.7° |
| HAN1 | CAN | NAP | HAP | 156.2° | 120.0° |
| HAN2 | CAN | NAP | HAP | 34.2° | 120.0° |
| HAJ | CAJ | CAK | HAK | 0.5° | 0.0° |
