AEW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAV | CAU | sing | 1.53Å | 1.53Å | |
| CAU | CAT | sing | 1.53Å | 1.52Å | |
| CAT | CAS | sing | 1.53Å | 1.52Å | |
| CAS | CAR | sing | 1.53Å | 1.53Å | |
| CAR | CAQ | sing | 1.53Å | 1.52Å | |
| CAQ | CAM | sing | 1.51Å | 1.51Å | |
| CAM | CAH | doub | 1.36Å | 1.39Å | |
| CAM | CAN | sing | 1.40Å | 1.39Å | |
| CAH | CAC | sing | 1.41Å | 1.39Å | |
| CAC | OAA | doub | 1.22Å | 1.25Å | |
| CAC | NAD | sing | 1.35Å | 1.41Å | |
| CAN | CAI | doub | 1.35Å | 1.39Å | |
| CAI | NAD | sing | 1.36Å | 1.41Å | |
| NAD | CAE | sing | 1.46Å | 1.48Å | |
| CAE | CAF | sing | 1.51Å | 1.53Å | |
| CAF | CAG | sing | 1.38Å | 1.41Å | Aromatic |
| CAF | CAJ | doub | 1.38Å | 1.40Å | Aromatic |
| CAG | CAB | sing | 1.51Å | 1.55Å | |
| CAG | CAK | doub | 1.39Å | 1.41Å | Aromatic |
| CAJ | CAO | sing | 1.38Å | 1.39Å | Aromatic |
| CAO | CAP | doub | 1.38Å | 1.40Å | Aromatic |
| CAP | CAK | sing | 1.39Å | 1.40Å | Aromatic |
| CAK | NAL | sing | 1.40Å | 1.34Å | |
| CAV | HAV1 | sing | 1.09Å | 1.10Å | |
| CAV | HAV2 | sing | 1.09Å | 1.10Å | |
| CAV | HAV3 | sing | 1.09Å | 1.10Å | |
| CAU | HAU1 | sing | 1.09Å | 1.10Å | |
| CAU | HAU2 | sing | 1.09Å | 1.10Å | |
| CAT | HAT1 | sing | 1.09Å | 1.10Å | |
| CAT | HAT2 | sing | 1.09Å | 1.10Å | |
| CAS | HAS1 | sing | 1.09Å | 1.10Å | |
| CAS | HAS2 | sing | 1.09Å | 1.10Å | |
| CAR | HAR1 | sing | 1.09Å | 1.10Å | |
| CAR | HAR2 | sing | 1.09Å | 1.10Å | |
| CAQ | HAQ1 | sing | 1.09Å | 1.10Å | |
| CAQ | HAQ2 | sing | 1.09Å | 1.10Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAN | HAN | sing | 1.08Å | 1.08Å | |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAE | HAE1 | sing | 1.09Å | 1.10Å | |
| CAE | HAE2 | sing | 1.09Å | 1.10Å | |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAB | HAB1 | sing | 1.09Å | 1.10Å | |
| CAB | HAB2 | sing | 1.09Å | 1.10Å | |
| CAB | HAB3 | sing | 1.09Å | 1.10Å | |
| CAO | HAO | sing | 1.08Å | 1.08Å | |
| CAP | HAP | sing | 1.08Å | 1.08Å | |
| NAL | HAL1 | sing | 0.97Å | 1.00Å | |
| NAL | HAL2 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAV | CAU | CAT | 106.0° | 109.4° |
| CAU | CAV | HAV1 | 109.5° | 109.5° |
| CAU | CAV | HAV2 | 109.5° | 109.5° |
| CAU | CAV | HAV3 | 109.5° | 109.4° |
| CAV | CAU | HAU1 | 110.3° | 109.5° |
| CAV | CAU | HAU2 | 110.3° | 109.5° |
| CAU | CAT | CAS | 111.8° | 109.5° |
| CAT | CAU | HAU1 | 110.3° | 109.5° |
| CAT | CAU | HAU2 | 110.4° | 109.5° |
| CAU | CAT | HAT1 | 108.9° | 109.5° |
| CAU | CAT | HAT2 | 108.9° | 109.5° |
| CAT | CAS | CAR | 106.7° | 109.5° |
| CAS | CAT | HAT1 | 108.9° | 109.5° |
| CAS | CAT | HAT2 | 108.9° | 109.4° |
| CAT | CAS | HAS1 | 110.1° | 109.5° |
| CAT | CAS | HAS2 | 110.2° | 109.4° |
| CAS | CAR | CAQ | 111.1° | 109.5° |
| CAR | CAS | HAS1 | 110.1° | 109.5° |
| CAR | CAS | HAS2 | 110.2° | 109.5° |
| CAS | CAR | HAR1 | 109.0° | 109.5° |
| CAS | CAR | HAR2 | 109.1° | 109.5° |
| CAR | CAQ | CAM | 112.1° | 109.5° |
| CAQ | CAR | HAR1 | 109.1° | 109.5° |
| CAQ | CAR | HAR2 | 109.1° | 109.5° |
| CAR | CAQ | HAQ1 | 108.8° | 109.4° |
| CAR | CAQ | HAQ2 | 108.8° | 109.5° |
| CAQ | CAM | CAH | 118.1° | 120.4° |
| CAQ | CAM | CAN | 121.0° | 120.4° |
| CAM | CAQ | HAQ1 | 108.8° | 109.5° |
| CAM | CAQ | HAQ2 | 108.8° | 109.5° |
| CAH | CAM | CAN | 120.9° | 119.2° |
| CAM | CAH | CAC | 121.4° | 119.3° |
| CAM | CAH | HAH | 119.3° | 120.4° |
| CAM | CAN | CAI | 119.2° | 119.9° |
| CAM | CAN | HAN | 120.4° | 120.0° |
| CAH | CAC | OAA | 121.5° | 119.9° |
| CAH | CAC | NAD | 117.8° | 120.0° |
| CAC | CAH | HAH | 119.3° | 120.3° |
| OAA | CAC | NAD | 120.7° | 120.0° |
| CAC | NAD | CAI | 120.9° | 120.8° |
| CAC | NAD | CAE | 118.5° | 119.6° |
| CAN | CAI | NAD | 119.9° | 120.7° |
| CAI | CAN | HAN | 120.4° | 120.0° |
| CAN | CAI | HAI | 120.0° | 119.6° |
| CAI | NAD | CAE | 120.6° | 119.6° |
| NAD | CAI | HAI | 120.1° | 119.7° |
| NAD | CAE | CAF | 108.4° | 109.5° |
| NAD | CAE | HAE1 | 109.7° | 109.5° |
| NAD | CAE | HAE2 | 109.7° | 109.5° |
| CAE | CAF | CAG | 123.4° | 120.0° |
| CAE | CAF | CAJ | 117.2° | 119.9° |
| CAF | CAE | HAE1 | 109.7° | 109.5° |
| CAF | CAE | HAE2 | 109.7° | 109.4° |
| CAG | CAF | CAJ | 119.5° | 120.1° |
| CAF | CAG | CAB | 120.0° | 120.0° |
| CAF | CAG | CAK | 120.0° | 119.9° |
| CAF | CAJ | CAO | 120.7° | 120.2° |
| CAF | CAJ | HAJ | 119.6° | 120.0° |
| CAB | CAG | CAK | 120.0° | 120.1° |
| CAG | CAB | HAB1 | 109.5° | 109.4° |
| CAG | CAB | HAB2 | 109.5° | 109.5° |
| CAG | CAB | HAB3 | 109.5° | 109.5° |
| CAG | CAK | CAP | 119.5° | 119.9° |
| CAG | CAK | NAL | 121.1° | 120.1° |
| CAJ | CAO | CAP | 119.7° | 120.0° |
| CAO | CAJ | HAJ | 119.6° | 119.9° |
| CAJ | CAO | HAO | 120.2° | 120.0° |
| CAO | CAP | CAK | 120.6° | 120.0° |
| CAP | CAO | HAO | 120.2° | 120.0° |
| CAO | CAP | HAP | 119.7° | 120.0° |
| CAP | CAK | NAL | 119.3° | 120.1° |
| CAK | CAP | HAP | 119.7° | 120.0° |
| CAK | NAL | HAL1 | 109.5° | 120.0° |
| CAK | NAL | HAL2 | 109.5° | 120.0° |
| HAV1 | CAV | HAV2 | 109.4° | 109.5° |
| HAV1 | CAV | HAV3 | 109.5° | 109.5° |
| HAV2 | CAV | HAV3 | 109.4° | 109.5° |
| HAU1 | CAU | HAU2 | 109.5° | 109.5° |
| HAT1 | CAT | HAT2 | 109.5° | 109.5° |
| HAS1 | CAS | HAS2 | 109.5° | 109.4° |
| HAR1 | CAR | HAR2 | 109.4° | 109.4° |
| HAQ1 | CAQ | HAQ2 | 109.5° | 109.5° |
| HAE1 | CAE | HAE2 | 109.4° | 109.5° |
| HAB1 | CAB | HAB2 | 109.4° | 109.4° |
| HAB1 | CAB | HAB3 | 109.5° | 109.5° |
| HAB2 | CAB | HAB3 | 109.5° | 109.5° |
| HAL1 | NAL | HAL2 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAV | CAU | CAT | HAU1 | 119.4° | 120.0° |
| CAV | CAU | CAT | HAU2 | 119.5° | 120.0° |
| CAV | CAU | CAT | CAS | 122.4° | 180.0° |
| CAU | CAV | HAV1 | HAV2 | 120.0° | 120.0° |
| CAU | CAV | HAV1 | HAV3 | 120.0° | 120.0° |
| CAU | CAV | HAV2 | HAV3 | 120.0° | 120.0° |
| CAV | CAU | HAU1 | HAU2 | 121.6° | 120.0° |
| CAV | CAU | CAT | HAT1 | 117.2° | 60.0° |
| CAV | CAU | CAT | HAT2 | 2.1° | 60.0° |
| CAU | CAT | CAS | HAT1 | 120.3° | 120.0° |
| CAU | CAT | CAS | HAT2 | 120.3° | 120.0° |
| CAU | CAT | CAS | CAR | 84.9° | 180.0° |
| CAT | CAU | CAV | HAV1 | 180.0° | 60.0° |
| CAT | CAU | CAV | HAV2 | 60.0° | 60.0° |
| CAT | CAU | CAV | HAV3 | 60.0° | 180.0° |
| CAT | CAU | HAU1 | HAU2 | 121.6° | 120.0° |
| CAU | CAT | HAT1 | HAT2 | 119.0° | 120.0° |
| CAU | CAT | CAS | HAS1 | 155.5° | 59.9° |
| CAU | CAT | CAS | HAS2 | 34.7° | 60.0° |
| CAT | CAS | CAR | HAS1 | 119.5° | 120.1° |
| CAT | CAS | CAR | HAS2 | 119.6° | 120.0° |
| CAT | CAS | CAR | CAQ | 142.1° | 180.0° |
| CAS | CAT | CAU | HAU1 | 3.0° | 60.0° |
| CAS | CAT | CAU | HAU2 | 118.1° | 60.0° |
| CAS | CAT | HAT1 | HAT2 | 118.9° | 120.0° |
| CAT | CAS | HAS1 | HAS2 | 121.3° | 119.9° |
| CAT | CAS | CAR | HAR1 | 97.6° | 59.9° |
| CAT | CAS | CAR | HAR2 | 21.9° | 60.0° |
| CAS | CAR | CAQ | HAR1 | 120.2° | 120.0° |
| CAS | CAR | CAQ | HAR2 | 120.3° | 120.0° |
| CAS | CAR | CAQ | CAM | 77.2° | 180.0° |
| CAR | CAS | CAT | HAT1 | 35.4° | 60.0° |
| CAR | CAS | CAT | HAT2 | 154.8° | 60.0° |
| CAR | CAS | HAS1 | HAS2 | 121.3° | 120.0° |
| CAS | CAR | HAR1 | HAR2 | 119.2° | 120.0° |
| CAS | CAR | CAQ | HAQ1 | 162.4° | 60.0° |
| CAS | CAR | CAQ | HAQ2 | 43.2° | 60.0° |
| CAR | CAQ | CAM | HAQ1 | 120.4° | 120.0° |
| CAR | CAQ | CAM | HAQ2 | 120.4° | 120.0° |
| CAR | CAQ | CAM | CAH | 137.4° | 95.0° |
| CAR | CAQ | CAM | CAN | 44.6° | 85.3° |
| CAQ | CAR | CAS | HAS1 | 22.6° | 60.0° |
| CAQ | CAR | CAS | HAS2 | 98.3° | 60.0° |
| CAQ | CAR | HAR1 | HAR2 | 119.2° | 120.0° |
| CAR | CAQ | HAQ1 | HAQ2 | 118.8° | 120.0° |
| CAQ | CAM | CAH | CAN | 177.9° | 179.7° |
| CAQ | CAM | CAH | CAC | 178.5° | 180.0° |
| CAQ | CAM | CAN | CAI | 178.0° | 180.0° |
| CAM | CAQ | CAR | HAR1 | 43.0° | 60.0° |
| CAM | CAQ | CAR | HAR2 | 162.5° | 60.0° |
| CAM | CAQ | HAQ1 | HAQ2 | 118.8° | 120.0° |
| CAQ | CAM | CAH | HAH | 1.5° | 0.1° |
| CAQ | CAM | CAN | HAN | 1.9° | 0.0° |
| CAM | CAH | CAC | HAH | 180.0° | 179.9° |
| CAM | CAH | CAC | OAA | 179.0° | 180.0° |
| CAM | CAH | CAC | NAD | 0.5° | 0.1° |
| CAH | CAM | CAN | CAI | 0.2° | 0.3° |
| CAH | CAM | CAQ | HAQ1 | 102.2° | 24.9° |
| CAH | CAM | CAQ | HAQ2 | 17.0° | 144.9° |
| CAH | CAM | CAN | HAN | 179.8° | 179.7° |
| CAN | CAM | CAH | CAC | 0.5° | 0.3° |
| CAM | CAN | CAI | HAN | 180.0° | 180.0° |
| CAM | CAN | CAI | NAD | 0.3° | 0.0° |
| CAN | CAM | CAQ | HAQ1 | 75.8° | 154.7° |
| CAN | CAM | CAQ | HAQ2 | 165.0° | 34.7° |
| CAN | CAM | CAH | HAH | 179.5° | 179.8° |
| CAM | CAN | CAI | HAI | 179.8° | 180.0° |
| CAH | CAC | OAA | NAD | 179.4° | 180.0° |
| CAH | CAC | NAD | CAI | 0.0° | 0.3° |
| CAH | CAC | NAD | CAE | 178.7° | 179.9° |
| OAA | CAC | NAD | CAI | 179.4° | 179.7° |
| OAA | CAC | NAD | CAE | 0.7° | 0.0° |
| OAA | CAC | CAH | HAH | 1.0° | 0.1° |
| CAC | NAD | CAI | CAN | 0.3° | 0.3° |
| CAC | NAD | CAI | CAE | 178.7° | 179.7° |
| CAC | NAD | CAE | CAF | 96.3° | 85.7° |
| NAD | CAC | CAH | HAH | 179.5° | 180.0° |
| CAC | NAD | CAI | HAI | 179.7° | 179.8° |
| CAC | NAD | CAE | HAE1 | 143.8° | 154.3° |
| CAC | NAD | CAE | HAE2 | 23.5° | 34.3° |
| CAN | CAI | NAD | HAI | 180.0° | 179.9° |
| CAN | CAI | NAD | CAE | 178.3° | 180.0° |
| CAI | NAD | CAE | CAF | 82.3° | 94.0° |
| NAD | CAI | CAN | HAN | 179.7° | 180.0° |
| CAI | NAD | CAE | HAE1 | 37.5° | 26.0° |
| CAI | NAD | CAE | HAE2 | 157.8° | 146.0° |
| NAD | CAE | CAF | HAE1 | 119.8° | 120.0° |
| NAD | CAE | CAF | HAE2 | 119.9° | 120.0° |
| NAD | CAE | CAF | CAG | 170.1° | 173.9° |
| NAD | CAE | CAF | CAJ | 9.8° | 5.9° |
| CAE | NAD | CAI | HAI | 1.6° | 0.1° |
| NAD | CAE | HAE1 | HAE2 | 120.5° | 120.0° |
| CAE | CAF | CAG | CAJ | 179.9° | 179.8° |
| CAE | CAF | CAG | CAB | 0.3° | 0.0° |
| CAE | CAF | CAG | CAK | 179.6° | 180.0° |
| CAE | CAF | CAJ | CAO | 179.6° | 179.9° |
| CAF | CAE | HAE1 | HAE2 | 120.5° | 119.9° |
| CAE | CAF | CAJ | HAJ | 0.4° | 0.0° |
| CAF | CAG | CAB | CAK | 179.9° | 180.0° |
| CAG | CAF | CAJ | CAO | 0.3° | 0.2° |
| CAF | CAG | CAK | CAP | 0.4° | 0.1° |
| CAF | CAG | CAK | NAL | 179.9° | 180.0° |
| CAG | CAF | CAE | HAE1 | 50.3° | 66.1° |
| CAG | CAF | CAE | HAE2 | 70.0° | 53.8° |
| CAG | CAF | CAJ | HAJ | 179.7° | 179.7° |
| CAF | CAG | CAB | HAB1 | 90.1° | 95.3° |
| CAF | CAG | CAB | HAB2 | 150.0° | 144.8° |
| CAF | CAG | CAB | HAB3 | 30.0° | 24.7° |
| CAJ | CAF | CAG | CAB | 179.8° | 179.8° |
| CAJ | CAF | CAG | CAK | 0.3° | 0.2° |
| CAF | CAJ | CAO | HAJ | 180.0° | 179.9° |
| CAF | CAJ | CAO | CAP | 0.4° | 0.1° |
| CAJ | CAF | CAE | HAE1 | 129.7° | 114.1° |
| CAJ | CAF | CAE | HAE2 | 110.0° | 125.9° |
| CAF | CAJ | CAO | HAO | 179.6° | 179.9° |
| CAB | CAG | CAK | CAP | 179.7° | 179.9° |
| CAB | CAG | CAK | NAL | 0.0° | 0.0° |
| CAG | CAB | HAB1 | HAB2 | 120.0° | 120.0° |
| CAG | CAB | HAB1 | HAB3 | 120.0° | 120.0° |
| CAG | CAB | HAB2 | HAB3 | 120.0° | 120.1° |
| CAG | CAK | CAP | CAO | 0.5° | 0.2° |
| CAG | CAK | CAP | NAL | 179.7° | 179.9° |
| CAK | CAG | CAB | HAB1 | 90.0° | 84.7° |
| CAK | CAG | CAB | HAB2 | 29.9° | 35.2° |
| CAK | CAG | CAB | HAB3 | 149.9° | 155.3° |
| CAG | CAK | CAP | HAP | 179.5° | 180.0° |
| CAG | CAK | NAL | HAL1 | 180.0° | 0.0° |
| CAG | CAK | NAL | HAL2 | 60.0° | 179.9° |
| CAJ | CAO | CAP | HAO | 180.0° | 180.0° |
| CAJ | CAO | CAP | CAK | 0.5° | 0.2° |
| CAJ | CAO | CAP | HAP | 179.5° | 179.9° |
| CAO | CAP | CAK | HAP | 180.0° | 179.9° |
| CAO | CAP | CAK | NAL | 179.8° | 179.8° |
| CAP | CAO | CAJ | HAJ | 179.6° | 180.0° |
| CAK | CAP | CAO | HAO | 179.5° | 179.8° |
| CAP | CAK | NAL | HAL1 | 0.3° | 179.9° |
| CAP | CAK | NAL | HAL2 | 120.3° | 0.0° |
| NAL | CAK | CAP | HAP | 0.2° | 0.1° |
| CAK | NAL | HAL1 | HAL2 | 120.0° | 179.9° |
| HAV1 | CAV | HAV2 | HAV3 | 120.0° | 120.0° |
| HAV1 | CAV | CAU | HAU1 | 60.5° | 60.0° |
| HAV1 | CAV | CAU | HAU2 | 60.5° | 180.0° |
| HAV2 | CAV | CAU | HAU1 | 59.5° | 180.0° |
| HAV2 | CAV | CAU | HAU2 | 179.5° | 60.0° |
| HAV3 | CAV | CAU | HAU1 | 179.4° | 60.1° |
| HAV3 | CAV | CAU | HAU2 | 59.5° | 60.0° |
| HAU1 | CAU | CAT | HAT1 | 123.3° | 180.0° |
| HAU1 | CAU | CAT | HAT2 | 117.4° | 60.0° |
| HAU2 | CAU | CAT | HAT1 | 2.2° | 60.0° |
| HAU2 | CAU | CAT | HAT2 | 121.5° | 180.0° |
| HAT1 | CAT | CAS | HAS1 | 84.1° | 180.0° |
| HAT1 | CAT | CAS | HAS2 | 155.0° | 60.1° |
| HAT2 | CAT | CAS | HAS1 | 35.2° | 60.0° |
| HAT2 | CAT | CAS | HAS2 | 85.7° | 179.9° |
| HAS1 | CAS | CAR | HAR1 | 142.8° | 180.0° |
| HAS1 | CAS | CAR | HAR2 | 97.7° | 60.1° |
| HAS2 | CAS | CAR | HAR1 | 22.0° | 60.0° |
| HAS2 | CAS | CAR | HAR2 | 141.4° | 180.0° |
| HAR1 | CAR | CAQ | HAQ1 | 77.3° | 180.0° |
| HAR1 | CAR | CAQ | HAQ2 | 163.4° | 60.1° |
| HAR2 | CAR | CAQ | HAQ1 | 42.1° | 60.0° |
| HAR2 | CAR | CAQ | HAQ2 | 77.1° | NaN° |
| HAN | CAN | CAI | HAI | 0.2° | 0.1° |
| HAJ | CAJ | CAO | HAO | 0.4° | 0.0° |
| HAB1 | CAB | HAB2 | HAB3 | 120.0° | 120.0° |
| HAO | CAO | CAP | HAP | 0.5° | 0.1° |
