BGV
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAA | CAN | doub | 1.33Å | 1.37Å | |
CAB | CAM | sing | 1.51Å | 1.47Å | |
CAC | CAQ | sing | 1.53Å | 1.50Å | |
CAD | CAV | sing | 1.53Å | 1.51Å | |
OAE | CAM | doub | 1.21Å | 1.19Å | |
OAF | CAO | doub | 1.21Å | 1.19Å | |
OAG | CAP | doub | 1.22Å | 1.21Å | |
CAH | CAI | doub | 1.33Å | 1.29Å | |
CAH | CAO | sing | 1.47Å | 1.28Å | |
CAI | CAS | sing | 1.51Å | 1.53Å | |
CAJ | CAQ | sing | 1.48Å | 1.50Å | |
CAJ | CAR | sing | 1.52Å | 1.46Å | |
OAK | CAM | sing | 1.34Å | 1.29Å | |
OAK | CAT | sing | 1.45Å | 1.42Å | |
OAL | CAP | sing | 1.35Å | 1.29Å | |
OAL | CAR | sing | 1.46Å | 1.38Å | |
CAN | CAP | sing | 1.48Å | 1.37Å | |
CAN | CAU | sing | 1.52Å | 1.48Å | |
CAO | CAV | sing | 1.52Å | 1.46Å | |
CAQ | CAS | sing | 1.53Å | 1.48Å | |
CAR | CAU | sing | 1.50Å | 1.48Å | |
CAS | CAV | sing | 1.50Å | 1.46Å | |
CAT | CAU | sing | 1.54Å | 1.57Å | |
CAT | CAV | sing | 1.54Å | 1.48Å | |
CAA | HAA | sing | 1.08Å | 1.08Å | |
CAA | HAAA | sing | 1.08Å | 1.08Å | |
CAB | HAB | sing | 1.09Å | 1.10Å | |
CAB | HABA | sing | 1.09Å | 1.10Å | |
CAB | HABB | sing | 1.09Å | 1.10Å | |
CAC | HAC | sing | 1.09Å | 1.10Å | |
CAC | HACA | sing | 1.09Å | 1.10Å | |
CAC | HACB | sing | 1.09Å | 1.10Å | |
CAD | HAD | sing | 1.09Å | 1.10Å | |
CAD | HADA | sing | 1.09Å | 1.10Å | |
CAD | HADB | sing | 1.09Å | 1.10Å | |
CAH | HAH | sing | 1.08Å | 1.08Å | |
CAI | HAI | sing | 1.08Å | 1.08Å | |
CAJ | HAJ | sing | 1.09Å | 1.10Å | |
CAJ | HAJA | sing | 1.09Å | 1.10Å | |
CAQ | HAQ | sing | 1.09Å | 1.10Å | |
CAR | HAR | sing | 1.09Å | 1.10Å | |
CAS | HAS | sing | 1.09Å | 1.10Å | |
CAT | HAT | sing | 1.09Å | 1.10Å | |
CAU | HAU | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CAA | CAN | CAP | 126.3° | 127.3° |
CAA | CAN | CAU | 123.1° | 127.4° |
CAN | CAA | HAA | 120.0° | 120.0° |
CAN | CAA | HAAA | 120.0° | 120.0° |
CAB | CAM | OAE | 120.6° | 120.0° |
CAB | CAM | OAK | 117.7° | 120.0° |
CAM | CAB | HAB | 109.5° | 109.5° |
CAM | CAB | HABA | 109.5° | 109.5° |
CAM | CAB | HABB | 109.5° | 109.5° |
CAC | CAQ | CAJ | 112.3° | 109.4° |
CAC | CAQ | CAS | 110.5° | 109.4° |
CAQ | CAC | HAC | 109.5° | 109.5° |
CAQ | CAC | HACA | 109.4° | 109.5° |
CAQ | CAC | HACB | 109.5° | 109.5° |
CAC | CAQ | HAQ | 106.7° | 109.4° |
CAD | CAV | CAO | 105.5° | 109.2° |
CAD | CAV | CAS | 113.4° | 109.3° |
CAD | CAV | CAT | 107.5° | 109.3° |
CAV | CAD | HAD | 109.5° | 109.5° |
CAV | CAD | HADA | 109.5° | 109.5° |
CAV | CAD | HADB | 109.5° | 109.5° |
OAE | CAM | OAK | 121.4° | 120.0° |
OAF | CAO | CAH | 122.3° | 127.4° |
OAF | CAO | CAV | 121.9° | 127.4° |
OAG | CAP | OAL | 124.0° | 124.9° |
OAG | CAP | CAN | 128.3° | 125.0° |
CAI | CAH | CAO | 109.1° | 111.4° |
CAH | CAI | CAS | 110.5° | 109.2° |
CAI | CAH | HAH | 125.4° | 124.3° |
CAH | CAI | HAI | 124.7° | 125.4° |
CAH | CAO | CAV | 115.2° | 105.3° |
CAO | CAH | HAH | 125.5° | 124.3° |
CAI | CAS | CAQ | 112.0° | 111.3° |
CAI | CAS | CAV | 103.0° | 105.4° |
CAS | CAI | HAI | 124.7° | 125.4° |
CAI | CAS | HAS | 111.2° | 109.5° |
CAQ | CAJ | CAR | 113.4° | 110.6° |
CAJ | CAQ | CAS | 109.0° | 110.0° |
CAQ | CAJ | HAJ | 108.2° | 109.2° |
CAQ | CAJ | HAJA | 108.2° | 109.3° |
CAJ | CAQ | HAQ | 108.3° | 109.3° |
CAJ | CAR | OAL | 93.1° | 111.6° |
CAJ | CAR | CAU | 95.8° | 111.3° |
CAR | CAJ | HAJ | 108.2° | 109.2° |
CAR | CAJ | HAJA | 108.2° | 109.3° |
CAJ | CAR | HAR | 125.5° | 109.5° |
CAM | OAK | CAT | 124.5° | 117.0° |
OAK | CAT | CAU | 117.9° | 109.8° |
OAK | CAT | CAV | 108.9° | 109.8° |
OAK | CAT | HAT | 100.7° | 109.7° |
CAP | OAL | CAR | 109.0° | 108.2° |
OAL | CAP | CAN | 107.7° | 110.1° |
OAL | CAR | CAU | 106.7° | 105.7° |
OAL | CAR | HAR | 116.9° | 109.7° |
CAP | CAN | CAU | 110.6° | 105.3° |
CAN | CAU | CAR | 96.2° | 104.0° |
CAN | CAU | CAT | 113.9° | 110.2° |
CAN | CAU | HAU | 118.7° | 109.3° |
CAO | CAV | CAS | 101.8° | 103.4° |
CAO | CAV | CAT | 122.0° | 110.4° |
CAQ | CAS | CAV | 106.6° | 111.9° |
CAS | CAQ | HAQ | 110.1° | 109.4° |
CAQ | CAS | HAS | 107.9° | 109.6° |
CAR | CAU | CAT | 118.1° | 114.3° |
CAU | CAR | HAR | 114.8° | 109.0° |
CAR | CAU | HAU | 114.5° | 109.6° |
CAS | CAV | CAT | 106.7° | 115.0° |
CAV | CAS | HAS | 116.2° | 109.1° |
CAU | CAT | CAV | 95.2° | 108.0° |
CAU | CAT | HAT | 113.5° | 109.8° |
CAT | CAU | HAU | 97.0° | 109.4° |
CAV | CAT | HAT | 121.8° | 109.7° |
HAA | CAA | HAAA | 120.0° | 120.0° |
HAB | CAB | HABA | 109.5° | 109.4° |
HAB | CAB | HABB | 109.4° | 109.5° |
HABA | CAB | HABB | 109.5° | 109.5° |
HAC | CAC | HACA | 109.5° | 109.5° |
HAC | CAC | HACB | 109.5° | 109.5° |
HACA | CAC | HACB | 109.5° | 109.4° |
HAD | CAD | HADA | 109.5° | 109.5° |
HAD | CAD | HADB | 109.5° | 109.5° |
HADA | CAD | HADB | 109.5° | 109.5° |
HAJ | CAJ | HAJA | 110.7° | 109.2° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CAA | CAN | CAP | OAG | 1.8° | 8.2° |
CAA | CAN | CAP | OAL | 179.6° | 171.7° |
CAA | CAN | CAP | CAU | 178.8° | 180.0° |
CAA | CAN | CAU | CAR | 162.5° | 171.6° |
CAA | CAN | CAU | CAT | 38.0° | 48.8° |
CAN | CAA | HAA | HAAA | 180.0° | 179.8° |
CAA | CAN | CAU | HAU | 75.2° | 71.5° |
CAB | CAM | OAE | OAK | 173.9° | 180.0° |
CAB | CAM | OAK | CAT | 126.8° | 174.2° |
CAM | CAB | HAB | HABA | 120.0° | 120.0° |
CAM | CAB | HAB | HABB | 120.0° | 120.0° |
CAM | CAB | HABA | HABB | 120.0° | 120.0° |
CAC | CAQ | CAS | CAI | 39.7° | 43.5° |
CAC | CAQ | CAJ | CAS | 122.8° | 120.2° |
CAC | CAQ | CAJ | HAQ | 117.5° | 119.7° |
CAC | CAQ | CAJ | CAR | 178.3° | 179.0° |
CAC | CAQ | CAS | HAQ | 117.6° | 119.8° |
CAC | CAQ | CAS | CAV | 151.6° | 161.2° |
CAQ | CAC | HAC | HACA | 120.0° | 120.1° |
CAQ | CAC | HAC | HACB | 120.0° | 120.0° |
CAQ | CAC | HACA | HACB | 120.0° | 120.0° |
CAC | CAQ | CAJ | HAJ | 58.3° | 58.8° |
CAC | CAQ | CAJ | HAJA | 61.7° | 60.6° |
CAC | CAQ | CAS | HAS | 83.0° | 77.8° |
CAD | CAV | CAO | OAF | 58.3° | 86.2° |
CAD | CAV | CAO | CAH | 113.2° | 93.8° |
CAD | CAV | CAS | CAI | 111.0° | 94.9° |
CAD | CAV | CAT | OAK | 157.6° | 158.5° |
CAD | CAV | CAO | CAS | 118.7° | 116.3° |
CAD | CAV | CAO | CAT | 122.8° | 120.2° |
CAD | CAV | CAS | CAQ | 7.0° | 26.2° |
CAD | CAV | CAS | CAT | 118.2° | 123.4° |
CAD | CAV | CAT | CAU | 80.6° | 81.9° |
CAV | CAD | HAD | HADA | 120.0° | 120.0° |
CAV | CAD | HAD | HADB | 120.0° | 120.0° |
CAV | CAD | HADA | HADB | 120.0° | 120.0° |
CAD | CAV | CAS | HAS | 127.2° | 147.5° |
CAD | CAV | CAT | HAT | 41.2° | 37.8° |
OAE | CAM | OAK | CAT | 59.1° | 5.8° |
OAE | CAM | CAB | HAB | 0.0° | 90.0° |
OAE | CAM | CAB | HABA | 120.0° | 150.0° |
OAE | CAM | CAB | HABB | 120.0° | 30.0° |
OAF | CAO | CAH | CAI | 178.4° | 164.3° |
OAF | CAO | CAH | CAV | 171.4° | 180.0° |
OAF | CAO | CAV | CAS | 177.0° | 157.5° |
OAF | CAO | CAV | CAT | 64.5° | 34.0° |
OAF | CAO | CAH | HAH | 1.5° | 16.0° |
OAG | CAP | OAL | CAN | 178.7° | 179.9° |
OAG | CAP | OAL | CAR | 162.9° | 157.8° |
OAG | CAP | CAN | CAU | 177.0° | 171.8° |
CAI | CAH | CAO | HAH | 180.0° | 179.7° |
CAH | CAI | CAS | HAI | 180.0° | 179.9° |
CAI | CAH | CAO | CAV | 7.0° | 15.7° |
CAH | CAI | CAS | CAQ | 112.3° | 134.4° |
CAH | CAI | CAS | CAV | 1.9° | 12.9° |
CAH | CAI | CAS | HAS | 127.0° | 104.3° |
CAO | CAH | CAI | CAS | 5.3° | 1.9° |
CAH | CAO | CAV | CAS | 5.5° | 22.4° |
CAH | CAO | CAV | CAT | 124.0° | 146.0° |
CAO | CAH | CAI | HAI | 174.7° | 178.1° |
CAI | CAS | CAQ | CAJ | 163.5° | 163.7° |
CAI | CAS | CAV | CAO | 1.9° | 21.3° |
CAI | CAS | CAQ | CAV | 112.0° | 117.7° |
CAI | CAS | CAQ | HAS | 122.6° | 121.3° |
CAI | CAS | CAV | HAS | 121.8° | 117.5° |
CAI | CAS | CAV | CAT | 130.8° | 141.7° |
CAS | CAI | CAH | HAH | 174.7° | 177.8° |
CAI | CAS | CAQ | HAQ | 77.9° | 76.3° |
CAQ | CAJ | CAR | HAJ | 120.0° | 120.2° |
CAQ | CAJ | CAR | HAJA | 120.0° | 120.3° |
CAQ | CAJ | CAR | OAL | 174.3° | 161.4° |
CAJ | CAQ | CAS | HAQ | 118.6° | 120.0° |
CAQ | CAJ | CAR | CAU | 67.1° | 80.8° |
CAJ | CAQ | CAS | CAV | 84.6° | 78.6° |
CAJ | CAQ | CAC | HAC | 180.0° | 60.0° |
CAJ | CAQ | CAC | HACA | 60.0° | 179.9° |
CAJ | CAQ | CAC | HACB | 60.0° | 60.0° |
CAQ | CAJ | HAJ | HAJA | 118.4° | 119.4° |
CAQ | CAJ | CAR | HAR | 59.1° | 39.8° |
CAJ | CAQ | CAS | HAS | 40.9° | 42.4° |
CAJ | CAR | OAL | CAP | 128.6° | 148.4° |
CAJ | CAR | OAL | CAU | 97.0° | 121.1° |
CAJ | CAR | OAL | HAR | 132.9° | 121.5° |
CAJ | CAR | CAU | CAN | 123.7° | 142.3° |
CAR | CAJ | CAQ | CAS | 55.5° | 58.8° |
CAJ | CAR | CAU | HAR | 133.7° | 120.8° |
CAJ | CAR | CAU | CAT | 115.0° | 97.6° |
CAR | CAJ | HAJ | HAJA | 118.4° | 119.5° |
CAR | CAJ | CAQ | HAQ | 64.2° | 61.2° |
CAJ | CAR | CAU | HAU | 1.7° | 25.6° |
CAM | OAK | CAT | CAU | 153.9° | 119.4° |
CAM | OAK | CAT | CAV | 99.3° | 122.1° |
OAK | CAM | CAB | HAB | 174.1° | 90.0° |
OAK | CAM | CAB | HABA | 65.9° | 30.0° |
OAK | CAM | CAB | HABB | 54.1° | 150.0° |
CAM | OAK | CAT | HAT | 29.9° | 1.4° |
OAK | CAT | CAU | CAN | 70.8° | 83.3° |
OAK | CAT | CAV | CAO | 35.7° | 38.3° |
OAK | CAT | CAU | CAR | 177.5° | 160.2° |
OAK | CAT | CAV | CAS | 80.4° | 78.2° |
OAK | CAT | CAU | CAV | 114.6° | 119.7° |
OAK | CAT | CAU | HAT | 117.4° | 120.7° |
OAK | CAT | CAV | HAT | 116.4° | 120.7° |
OAK | CAT | CAU | HAU | 54.9° | 36.9° |
OAL | CAP | CAN | CAU | 1.6° | 8.3° |
CAP | OAL | CAR | CAU | 31.6° | 27.3° |
CAP | OAL | CAR | HAR | 98.5° | 90.1° |
CAR | OAL | CAP | CAN | 18.4° | 22.3° |
OAL | CAR | CAU | CAN | 28.7° | 20.9° |
OAL | CAR | CAU | HAR | 131.3° | 117.8° |
OAL | CAR | CAU | CAT | 150.1° | 141.1° |
OAL | CAR | CAJ | HAJ | 54.3° | 78.4° |
OAL | CAR | CAJ | HAJA | 65.7° | 41.1° |
OAL | CAR | CAU | HAU | 96.7° | 95.7° |
CAP | CAN | CAU | CAR | 18.6° | 8.4° |
CAP | CAN | CAU | CAT | 143.2° | 131.2° |
CAP | CAN | CAA | HAA | 178.6° | 3.7° |
CAP | CAN | CAA | HAAA | 1.4° | 176.1° |
CAP | CAN | CAU | HAU | 103.6° | 108.5° |
CAN | CAU | CAR | CAT | 121.3° | 120.1° |
CAN | CAU | CAR | HAU | 125.4° | 116.7° |
CAN | CAU | CAT | HAU | 125.6° | 120.2° |
CAN | CAU | CAT | CAV | 174.6° | 157.1° |
CAU | CAN | CAA | HAA | 0.0° | 176.3° |
CAU | CAN | CAA | HAAA | 180.0° | 3.9° |
CAN | CAU | CAR | HAR | 102.6° | 96.9° |
CAN | CAU | CAT | HAT | 46.6° | 37.5° |
CAO | CAV | CAS | CAQ | 119.9° | 142.4° |
CAO | CAV | CAS | CAT | 128.9° | 120.4° |
CAO | CAV | CAT | CAU | 157.5° | 158.0° |
CAO | CAV | CAD | HAD | 180.0° | 86.9° |
CAO | CAV | CAD | HADA | 60.0° | 153.1° |
CAO | CAV | CAD | HADB | 60.0° | 33.1° |
CAV | CAO | CAH | HAH | 173.0° | 164.0° |
CAO | CAV | CAS | HAS | 119.9° | 96.2° |
CAO | CAV | CAT | HAT | 80.7° | 82.4° |
CAQ | CAS | CAV | HAS | 120.2° | 121.3° |
CAQ | CAS | CAV | CAT | 111.2° | 97.2° |
CAS | CAQ | CAC | HAC | 58.1° | 60.6° |
CAS | CAQ | CAC | HACA | 178.1° | 59.5° |
CAS | CAQ | CAC | HACB | 61.9° | 179.4° |
CAQ | CAS | CAI | HAI | 67.7° | 45.7° |
CAS | CAQ | CAJ | HAJ | 64.5° | 61.4° |
CAS | CAQ | CAJ | HAJA | 175.5° | 179.2° |
CAR | CAU | CAT | HAU | 122.6° | 123.3° |
CAR | CAU | CAT | CAV | 62.8° | 40.5° |
CAU | CAR | CAJ | HAJ | 52.9° | 39.5° |
CAU | CAR | CAJ | HAJA | 172.9° | 158.9° |
CAR | CAU | CAT | HAT | 65.2° | 79.1° |
CAS | CAV | CAT | CAU | 41.5° | 41.5° |
CAS | CAV | CAD | HAD | 69.4° | 160.6° |
CAS | CAV | CAD | HADA | 50.6° | 40.7° |
CAS | CAV | CAD | HADB | 170.6° | 79.3° |
CAV | CAS | CAI | HAI | 178.1° | 167.2° |
CAV | CAS | CAQ | HAQ | 34.1° | 41.4° |
CAS | CAV | CAT | HAT | 163.2° | 161.1° |
CAU | CAT | CAV | HAT | 121.8° | 119.7° |
CAT | CAU | CAR | HAR | 18.8° | 23.2° |
CAT | CAV | CAD | HAD | 48.4° | 34.0° |
CAT | CAV | CAD | HADA | 168.3° | 86.0° |
CAT | CAV | CAD | HADB | 71.6° | 154.0° |
CAT | CAV | CAS | HAS | 9.0° | 24.2° |
CAV | CAT | CAU | HAU | 59.8° | 82.7° |
HAB | CAB | HABA | HABB | 120.0° | 120.0° |
HAC | CAC | HACA | HACB | 120.0° | 120.0° |
HAC | CAC | CAQ | HAQ | 61.6° | 179.7° |
HACA | CAC | CAQ | HAQ | 58.4° | 60.3° |
HACB | CAC | CAQ | HAQ | 178.4° | 59.7° |
HAD | CAD | HADA | HADB | 120.0° | 120.0° |
HAH | CAH | CAI | HAI | 5.3° | 2.2° |
HAI | CAI | CAS | HAS | 53.0° | 75.6° |
HAJ | CAJ | CAQ | HAQ | 175.8° | 178.5° |
HAJ | CAJ | CAR | HAR | 179.1° | 160.0° |
HAJA | CAJ | CAQ | HAQ | 55.8° | 59.1° |
HAJA | CAJ | CAR | HAR | 60.9° | 80.5° |
HAQ | CAQ | CAS | HAS | 159.5° | 162.4° |
HAR | CAR | CAU | HAU | 132.0° | 146.4° |
HAT | CAT | CAU | HAU | 172.2° | 157.6° |