ZVU
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
FAE | CBD | sing | 1.40Å | 1.33Å | |
CBD | FAF | sing | 1.40Å | 1.32Å | |
CBD | FAG | sing | 1.40Å | 1.32Å | |
CBD | CAY | sing | 1.51Å | 1.49Å | |
CAY | CAK | sing | 1.38Å | 1.39Å | Aromatic |
CAY | CAX | doub | 1.40Å | 1.39Å | Aromatic |
CAK | CAI | doub | 1.38Å | 1.39Å | Aromatic |
CAI | CAH | sing | 1.38Å | 1.40Å | Aromatic |
CAH | CAJ | doub | 1.38Å | 1.40Å | Aromatic |
CAJ | CAX | sing | 1.40Å | 1.39Å | Aromatic |
CAX | CAU | sing | 1.48Å | 1.50Å | |
CAU | OAC | doub | 1.22Å | 1.22Å | |
CAU | NAS | sing | 1.35Å | 1.35Å | |
NAS | CBB | sing | 1.47Å | 1.46Å | |
CBB | CAA | sing | 1.53Å | 1.54Å | |
CBB | CBA | sing | 1.51Å | 1.48Å | |
CBA | NBC | sing | 1.37Å | 1.33Å | Aromatic |
CBA | NAR | doub | 1.30Å | 1.36Å | Aromatic |
NBC | CAB | sing | 1.46Å | 1.49Å | |
NBC | CAZ | sing | 1.37Å | 1.34Å | Aromatic |
NAR | NAQ | sing | 1.28Å | 1.41Å | Aromatic |
NAQ | CAZ | doub | 1.31Å | 1.33Å | Aromatic |
CAZ | SAT | sing | 1.76Å | 1.74Å | |
SAT | CAP | sing | 1.81Å | 1.78Å | |
CAP | CAW | sing | 1.51Å | 1.51Å | |
CAW | CAN | sing | 1.38Å | 1.39Å | Aromatic |
CAW | CAO | doub | 1.38Å | 1.39Å | Aromatic |
CAN | CAL | doub | 1.38Å | 1.39Å | Aromatic |
CAO | CAM | sing | 1.38Å | 1.39Å | Aromatic |
CAM | CAV | doub | 1.38Å | 1.40Å | Aromatic |
CAV | FAD | sing | 1.35Å | 1.33Å | |
CAV | CAL | sing | 1.38Å | 1.38Å | Aromatic |
CAK | HAK | sing | 1.08Å | 1.08Å | |
CAI | HAI | sing | 1.08Å | 1.08Å | |
CAH | HAH | sing | 1.08Å | 1.08Å | |
CAJ | HAJ | sing | 1.08Å | 1.08Å | |
NAS | HAS | sing | 0.97Å | 1.00Å | |
CBB | HBB | sing | 1.09Å | 1.10Å | |
CAA | HAA1 | sing | 1.09Å | 1.10Å | |
CAA | HAA2 | sing | 1.09Å | 1.10Å | |
CAA | HAA3 | sing | 1.09Å | 1.10Å | |
CAB | HAB1 | sing | 1.09Å | 1.10Å | |
CAB | HAB2 | sing | 1.09Å | 1.10Å | |
CAB | HAB3 | sing | 1.09Å | 1.10Å | |
CAP | HAP1 | sing | 1.09Å | 1.10Å | |
CAP | HAP2 | sing | 1.09Å | 1.10Å | |
CAN | HAN | sing | 1.08Å | 1.08Å | |
CAO | HAO | sing | 1.08Å | 1.08Å | |
CAL | HAL | sing | 1.08Å | 1.08Å | |
CAM | HAM | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
FAE | CBD | FAF | 110.8° | 109.5° |
FAE | CBD | FAG | 113.2° | 109.4° |
FAE | CBD | CAY | 107.3° | 109.5° |
FAF | CBD | FAG | 107.8° | 109.4° |
FAF | CBD | CAY | 110.6° | 109.5° |
FAG | CBD | CAY | 107.1° | 109.5° |
CBD | CAY | CAK | 118.6° | 120.1° |
CBD | CAY | CAX | 120.6° | 120.1° |
CAK | CAY | CAX | 120.8° | 119.8° |
CAY | CAK | CAI | 119.8° | 120.1° |
CAY | CAK | HAK | 120.1° | 119.9° |
CAY | CAX | CAJ | 119.4° | 119.7° |
CAY | CAX | CAU | 123.9° | 120.1° |
CAK | CAI | CAH | 119.6° | 120.3° |
CAI | CAK | HAK | 120.1° | 120.0° |
CAK | CAI | HAI | 120.2° | 119.8° |
CAI | CAH | CAJ | 120.5° | 120.1° |
CAH | CAI | HAI | 120.2° | 119.8° |
CAI | CAH | HAH | 119.8° | 119.9° |
CAH | CAJ | CAX | 119.9° | 119.8° |
CAJ | CAH | HAH | 119.7° | 119.9° |
CAH | CAJ | HAJ | 120.0° | 120.0° |
CAJ | CAX | CAU | 116.7° | 120.1° |
CAX | CAJ | HAJ | 120.1° | 120.1° |
CAX | CAU | OAC | 115.7° | 120.0° |
CAX | CAU | NAS | 117.7° | 120.0° |
OAC | CAU | NAS | 126.6° | 120.0° |
CAU | NAS | CBB | 127.4° | 120.0° |
CAU | NAS | HAS | 116.3° | 120.0° |
NAS | CBB | CAA | 111.3° | 109.5° |
NAS | CBB | CBA | 110.6° | 109.5° |
CBB | NAS | HAS | 116.3° | 120.0° |
NAS | CBB | HBB | 109.0° | 109.5° |
CAA | CBB | CBA | 109.2° | 109.5° |
CAA | CBB | HBB | 108.0° | 109.5° |
CBB | CAA | HAA1 | 109.5° | 109.4° |
CBB | CAA | HAA2 | 109.5° | 109.5° |
CBB | CAA | HAA3 | 109.5° | 109.5° |
CBB | CBA | NBC | 124.4° | 126.4° |
CBB | CBA | NAR | 126.7° | 126.3° |
CBA | CBB | HBB | 108.7° | 109.5° |
NBC | CBA | NAR | 108.9° | 107.4° |
CBA | NBC | CAB | 125.8° | 127.1° |
CBA | NBC | CAZ | 105.1° | 105.7° |
CBA | NAR | NAQ | 109.1° | 110.0° |
CAB | NBC | CAZ | 129.1° | 127.2° |
NBC | CAB | HAB1 | 109.5° | 109.4° |
NBC | CAB | HAB2 | 109.5° | 109.5° |
NBC | CAB | HAB3 | 109.4° | 109.5° |
NBC | CAZ | NAQ | 115.2° | 107.1° |
NBC | CAZ | SAT | 124.3° | 126.4° |
NAR | NAQ | CAZ | 101.7° | 109.9° |
NAQ | CAZ | SAT | 120.5° | 126.5° |
CAZ | SAT | CAP | 105.7° | 100.0° |
SAT | CAP | CAW | 105.7° | 109.5° |
SAT | CAP | HAP1 | 110.4° | 109.4° |
SAT | CAP | HAP2 | 110.4° | 109.5° |
CAP | CAW | CAN | 119.9° | 120.0° |
CAP | CAW | CAO | 119.1° | 119.9° |
CAW | CAP | HAP1 | 110.4° | 109.5° |
CAW | CAP | HAP2 | 110.4° | 109.5° |
CAN | CAW | CAO | 121.0° | 120.1° |
CAW | CAN | CAL | 120.2° | 120.0° |
CAW | CAN | HAN | 119.9° | 120.0° |
CAW | CAO | CAM | 119.0° | 120.0° |
CAW | CAO | HAO | 120.5° | 120.0° |
CAN | CAL | CAV | 118.6° | 120.0° |
CAL | CAN | HAN | 119.9° | 120.0° |
CAN | CAL | HAL | 120.7° | 120.0° |
CAO | CAM | CAV | 119.8° | 120.0° |
CAM | CAO | HAO | 120.5° | 120.0° |
CAO | CAM | HAM | 120.1° | 120.0° |
CAM | CAV | FAD | 119.1° | 120.1° |
CAM | CAV | CAL | 121.4° | 119.9° |
CAV | CAM | HAM | 120.1° | 120.0° |
FAD | CAV | CAL | 119.4° | 120.1° |
CAV | CAL | HAL | 120.7° | 120.0° |
HAA1 | CAA | HAA2 | 109.5° | 109.5° |
HAA1 | CAA | HAA3 | 109.5° | 109.5° |
HAA2 | CAA | HAA3 | 109.5° | 109.5° |
HAB1 | CAB | HAB2 | 109.5° | 109.5° |
HAB1 | CAB | HAB3 | 109.5° | 109.5° |
HAB2 | CAB | HAB3 | 109.5° | 109.5° |
HAP1 | CAP | HAP2 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
FAE | CBD | FAF | FAG | 124.3° | 120.0° |
FAE | CBD | FAF | CAY | 118.9° | 120.0° |
FAE | CBD | FAG | CAY | 118.0° | 120.0° |
FAE | CBD | CAY | CAK | 134.8° | 0.1° |
FAE | CBD | CAY | CAX | 45.8° | 179.7° |
FAF | CBD | FAG | CAY | 119.1° | 120.0° |
FAF | CBD | CAY | CAK | 13.8° | 120.0° |
FAF | CBD | CAY | CAX | 166.8° | 59.6° |
FAG | CBD | CAY | CAK | 103.4° | 120.0° |
FAG | CBD | CAY | CAX | 76.0° | 60.3° |
CBD | CAY | CAK | CAX | 179.4° | 179.6° |
CBD | CAY | CAK | CAI | 179.6° | 180.0° |
CBD | CAY | CAX | CAJ | 179.7° | 179.7° |
CBD | CAY | CAX | CAU | 0.3° | 0.1° |
CBD | CAY | CAK | HAK | 0.4° | 0.1° |
CAY | CAK | CAI | HAK | 180.0° | 179.9° |
CAY | CAK | CAI | CAH | 0.0° | 0.0° |
CAK | CAY | CAX | CAJ | 0.3° | 0.7° |
CAK | CAY | CAX | CAU | 179.7° | 179.7° |
CAY | CAK | CAI | HAI | 180.0° | 180.0° |
CAX | CAY | CAK | CAI | 0.2° | 0.4° |
CAY | CAX | CAJ | CAH | 0.3° | 0.6° |
CAY | CAX | CAJ | CAU | 180.0° | 179.6° |
CAY | CAX | CAU | OAC | 81.1° | 0.1° |
CAY | CAX | CAU | NAS | 100.2° | 179.9° |
CAX | CAY | CAK | HAK | 179.8° | 179.7° |
CAY | CAX | CAJ | HAJ | 179.7° | 179.7° |
CAK | CAI | CAH | HAI | 180.0° | 180.0° |
CAK | CAI | CAH | CAJ | 0.0° | 0.0° |
CAK | CAI | CAH | HAH | 180.0° | 179.9° |
CAI | CAH | CAJ | HAH | 180.0° | 179.9° |
CAI | CAH | CAJ | CAX | 0.2° | 0.3° |
CAH | CAI | CAK | HAK | 179.9° | 180.0° |
CAI | CAH | CAJ | HAJ | 179.8° | 180.0° |
CAH | CAJ | CAX | HAJ | 180.0° | 179.7° |
CAH | CAJ | CAX | CAU | 179.8° | 179.8° |
CAJ | CAH | CAI | HAI | 180.0° | 180.0° |
CAJ | CAX | CAU | OAC | 98.9° | 179.7° |
CAJ | CAX | CAU | NAS | 79.7° | 0.3° |
CAX | CAJ | CAH | HAH | 179.8° | 179.6° |
CAX | CAU | OAC | NAS | 178.5° | 180.0° |
CAX | CAU | NAS | CBB | 177.6° | 180.0° |
CAU | CAX | CAJ | HAJ | 0.3° | 0.1° |
CAX | CAU | NAS | HAS | 2.4° | 0.0° |
OAC | CAU | NAS | CBB | 0.8° | 0.0° |
OAC | CAU | NAS | HAS | 179.2° | 180.0° |
CAU | NAS | CBB | HAS | 180.0° | 180.0° |
CAU | NAS | CBB | CAA | 136.5° | 85.0° |
CAU | NAS | CBB | CBA | 101.8° | 155.0° |
CAU | NAS | CBB | HBB | 17.6° | 35.0° |
NAS | CBB | CAA | CBA | 122.4° | 120.0° |
NAS | CBB | CAA | HBB | 119.6° | 120.0° |
NAS | CBB | CBA | HBB | 119.5° | 120.0° |
NAS | CBB | CBA | NBC | 110.7° | 135.0° |
NAS | CBB | CBA | NAR | 69.4° | 45.3° |
NAS | CBB | CAA | HAA1 | 180.0° | 60.0° |
NAS | CBB | CAA | HAA2 | 60.0° | 180.0° |
NAS | CBB | CAA | HAA3 | 60.0° | 60.0° |
CAA | CBB | CBA | HBB | 117.6° | 120.0° |
CAA | CBB | CBA | NBC | 126.4° | 105.0° |
CAA | CBB | CBA | NAR | 53.5° | 74.7° |
CAA | CBB | NAS | HAS | 43.5° | 95.0° |
CBB | CAA | HAA1 | HAA2 | 120.0° | 120.0° |
CBB | CAA | HAA1 | HAA3 | 120.0° | 120.0° |
CBB | CAA | HAA2 | HAA3 | 120.0° | 120.0° |
CBB | CBA | NBC | NAR | 179.9° | 179.8° |
CBB | CBA | NBC | CAB | 0.6° | 0.0° |
CBB | CBA | NBC | CAZ | 180.0° | 180.0° |
CBB | CBA | NAR | NAQ | 179.9° | 180.0° |
CBA | CBB | NAS | HAS | 78.2° | 25.0° |
CBA | CBB | CAA | HAA1 | 57.6° | 60.0° |
CBA | CBB | CAA | HAA2 | 177.6° | 60.0° |
CBA | CBB | CAA | HAA3 | 62.4° | 180.0° |
CBA | NBC | CAB | CAZ | 179.2° | 180.0° |
NBC | CBA | NAR | NAQ | 0.2° | 0.3° |
CBA | NBC | CAZ | NAQ | 0.0° | 0.2° |
CBA | NBC | CAZ | SAT | 180.0° | 180.0° |
NBC | CBA | CBB | HBB | 8.8° | 15.0° |
CBA | NBC | CAB | HAB1 | 180.0° | 90.0° |
CBA | NBC | CAB | HAB2 | 60.0° | 150.0° |
CBA | NBC | CAB | HAB3 | 60.0° | 30.0° |
NAR | CBA | NBC | CAB | 179.3° | 179.8° |
NAR | CBA | NBC | CAZ | 0.1° | 0.3° |
CBA | NAR | NAQ | CAZ | 0.2° | 0.2° |
NAR | CBA | CBB | HBB | 171.1° | 165.3° |
CAB | NBC | CAZ | NAQ | 179.3° | 179.9° |
CAB | NBC | CAZ | SAT | 0.6° | 0.0° |
NBC | CAB | HAB1 | HAB2 | 120.0° | 120.0° |
NBC | CAB | HAB1 | HAB3 | 120.0° | 120.0° |
NBC | CAB | HAB2 | HAB3 | 120.0° | 120.0° |
NBC | CAZ | NAQ | NAR | 0.1° | 0.0° |
NBC | CAZ | NAQ | SAT | 180.0° | 179.8° |
NBC | CAZ | SAT | CAP | 67.1° | 180.0° |
CAZ | NBC | CAB | HAB1 | 0.8° | 90.0° |
CAZ | NBC | CAB | HAB2 | 120.8° | 30.0° |
CAZ | NBC | CAB | HAB3 | 119.2° | 150.0° |
NAR | NAQ | CAZ | SAT | 179.9° | 179.9° |
NAQ | CAZ | SAT | CAP | 113.0° | 0.2° |
CAZ | SAT | CAP | CAW | 72.2° | 180.0° |
CAZ | SAT | CAP | HAP1 | 47.2° | 60.0° |
CAZ | SAT | CAP | HAP2 | 168.4° | 59.9° |
SAT | CAP | CAW | HAP1 | 119.4° | 119.9° |
SAT | CAP | CAW | HAP2 | 119.4° | 120.1° |
SAT | CAP | CAW | CAN | 108.5° | 90.0° |
SAT | CAP | CAW | CAO | 69.5° | 90.3° |
SAT | CAP | HAP1 | HAP2 | 121.8° | 120.0° |
CAP | CAW | CAN | CAO | 178.0° | 179.7° |
CAP | CAW | CAN | CAL | 178.6° | 180.0° |
CAP | CAW | CAO | CAM | 178.3° | 179.9° |
CAW | CAP | HAP1 | HAP2 | 121.7° | 120.1° |
CAP | CAW | CAN | HAN | 1.5° | 0.0° |
CAP | CAW | CAO | HAO | 1.7° | 0.0° |
CAW | CAN | CAL | HAN | 180.0° | 180.0° |
CAN | CAW | CAO | CAM | 0.3° | 0.2° |
CAW | CAN | CAL | CAV | 0.4° | 0.0° |
CAN | CAW | CAP | HAP1 | 10.9° | 30.0° |
CAN | CAW | CAP | HAP2 | 132.1° | 150.0° |
CAN | CAW | CAO | HAO | 179.8° | 179.7° |
CAW | CAN | CAL | HAL | 179.7° | 180.0° |
CAO | CAW | CAN | CAL | 0.6° | 0.2° |
CAW | CAO | CAM | HAO | 180.0° | 179.9° |
CAW | CAO | CAM | CAV | 0.2° | 0.1° |
CAO | CAW | CAP | HAP1 | 171.1° | 149.8° |
CAO | CAW | CAP | HAP2 | 49.9° | 29.8° |
CAO | CAW | CAN | HAN | 179.4° | 179.7° |
CAW | CAO | CAM | HAM | 179.8° | 180.0° |
CAN | CAL | CAV | CAM | 0.1° | 0.2° |
CAN | CAL | CAV | FAD | 179.5° | 180.0° |
CAN | CAL | CAV | HAL | 180.0° | 180.0° |
CAO | CAM | CAV | HAM | 180.0° | 179.9° |
CAO | CAM | CAV | FAD | 179.3° | 180.0° |
CAO | CAM | CAV | CAL | 0.4° | 0.3° |
CAM | CAV | FAD | CAL | 179.7° | 179.8° |
CAV | CAM | CAO | HAO | 179.8° | 180.0° |
CAM | CAV | CAL | HAL | 179.9° | 179.8° |
FAD | CAV | CAL | HAL | 0.5° | 0.0° |
FAD | CAV | CAM | HAM | 0.7° | 0.0° |
CAV | CAL | CAN | HAN | 179.6° | 180.0° |
CAL | CAV | CAM | HAM | 179.6° | 179.8° |
HAK | CAK | CAI | HAI | 0.0° | 0.0° |
HAI | CAI | CAH | HAH | 0.0° | 0.1° |
HAH | CAH | CAJ | HAJ | 0.2° | 0.1° |
HAS | NAS | CBB | HBB | 162.4° | 145.0° |
HBB | CBB | CAA | HAA1 | 60.5° | 180.0° |
HBB | CBB | CAA | HAA2 | 59.5° | 60.0° |
HBB | CBB | CAA | HAA3 | 179.5° | 60.0° |
HAA1 | CAA | HAA2 | HAA3 | 120.0° | 120.1° |
HAB1 | CAB | HAB2 | HAB3 | 120.0° | 120.0° |
HAN | CAN | CAL | HAL | 0.3° | 0.1° |
HAO | CAO | CAM | HAM | 0.2° | 0.1° |