7BV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAG | CAI | sing | 1.54Å | 1.50Å | |
| CAG | CAF | sing | 1.54Å | 1.51Å | |
| CAI | CAK | sing | 1.51Å | 1.46Å | |
| CAF | CAH | sing | 1.51Å | 1.43Å | |
| CAK | NAW | sing | 1.48Å | 1.42Å | |
| CAH | CAJ | sing | 1.54Å | 1.52Å | |
| CAE | CAV | doub | 1.39Å | 1.34Å | Aromatic |
| CAE | CAS | sing | 1.38Å | 1.40Å | Aromatic |
| O | C | doub | 1.21Å | 1.21Å | |
| SAP | CAV | sing | 1.76Å | 1.43Å | Aromatic |
| SAP | CAT | sing | 1.76Å | 1.54Å | Aromatic |
| NAW | CAS | sing | 1.40Å | 1.34Å | |
| NAW | CAJ | sing | 1.40Å | 1.49Å | |
| CAV | CAU | sing | 1.40Å | 1.31Å | Aromatic |
| CAS | CAC | doub | 1.39Å | 1.36Å | Aromatic |
| N | CAR | doub | 1.28Å | 1.32Å | |
| N | CA | sing | 1.45Å | 1.49Å | |
| C | OXT | sing | 1.34Å | 1.26Å | |
| C | CA | sing | 1.51Å | 1.37Å | |
| CAT | CAR | sing | 1.48Å | 1.32Å | |
| CAT | NAN | doub | 1.29Å | 1.28Å | Aromatic |
| CAR | SAO | sing | 1.77Å | 1.55Å | |
| CAU | NAN | sing | 1.34Å | 1.30Å | Aromatic |
| CAU | CAD | doub | 1.41Å | 1.27Å | Aromatic |
| CAC | CAD | sing | 1.36Å | 1.35Å | Aromatic |
| CA | CB | sing | 1.54Å | 1.46Å | |
| CB | SAO | sing | 1.82Å | 1.73Å | |
| OXT | H1 | sing | 0.97Å | 0.95Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| CB | HB1 | sing | 1.09Å | 1.10Å | |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| CAD | HAD | sing | 1.08Å | 1.08Å | |
| CAC | HAC | sing | 1.08Å | 1.08Å | |
| CAJ | HAN | sing | 1.09Å | 1.10Å | |
| CAJ | HAO | sing | 1.09Å | 1.10Å | |
| CAH | HAJ | sing | 1.09Å | 1.10Å | |
| CAH | HAK | sing | 1.09Å | 1.10Å | |
| CAF | HAF | sing | 1.09Å | 1.10Å | |
| CAF | HAG | sing | 1.09Å | 1.10Å | |
| CAG | HAI | sing | 1.09Å | 1.10Å | |
| CAG | HAH | sing | 1.09Å | 1.10Å | |
| CAI | HAL | sing | 1.09Å | 1.10Å | |
| CAI | HAM | sing | 1.09Å | 1.10Å | |
| CAK | HAP | sing | 1.09Å | 1.10Å | |
| CAK | HAQ | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAI | CAG | CAF | 116.9° | 111.9° |
| CAG | CAI | CAK | 114.5° | 111.7° |
| CAI | CAG | HAI | 107.6° | 108.9° |
| CAI | CAG | HAH | 107.6° | 108.9° |
| CAG | CAI | HAL | 108.2° | 109.0° |
| CAG | CAI | HAM | 108.2° | 109.0° |
| CAG | CAF | CAH | 109.2° | 112.6° |
| CAG | CAF | HAF | 109.6° | 108.8° |
| CAG | CAF | HAG | 109.5° | 108.7° |
| CAF | CAG | HAI | 107.6° | 109.0° |
| CAF | CAG | HAH | 107.6° | 109.0° |
| CAI | CAK | NAW | 107.5° | 108.0° |
| CAK | CAI | HAL | 108.2° | 109.1° |
| CAK | CAI | HAM | 108.2° | 109.1° |
| CAI | CAK | HAP | 109.9° | 109.7° |
| CAI | CAK | HAQ | 110.0° | 109.8° |
| CAF | CAH | CAJ | 112.4° | 109.0° |
| CAF | CAH | HAJ | 108.7° | 109.6° |
| CAF | CAH | HAK | 108.8° | 109.6° |
| CAH | CAF | HAF | 109.5° | 108.9° |
| CAH | CAF | HAG | 109.6° | 108.9° |
| CAK | NAW | CAS | 119.3° | 111.0° |
| CAK | NAW | CAJ | 121.8° | 114.8° |
| NAW | CAK | HAP | 110.0° | 109.7° |
| NAW | CAK | HAQ | 110.0° | 109.8° |
| CAH | CAJ | NAW | 117.8° | 111.8° |
| CAH | CAJ | HAN | 107.3° | 109.0° |
| CAH | CAJ | HAO | 107.4° | 109.0° |
| CAJ | CAH | HAJ | 108.7° | 109.5° |
| CAJ | CAH | HAK | 108.7° | 109.6° |
| CAV | CAE | CAS | 119.9° | 120.0° |
| CAE | CAV | SAP | 134.1° | 131.3° |
| CAE | CAV | CAU | 121.8° | 120.4° |
| CAV | CAE | HAE | 120.0° | 120.0° |
| CAE | CAS | NAW | 127.9° | 120.1° |
| CAE | CAS | CAC | 115.1° | 119.9° |
| CAS | CAE | HAE | 120.0° | 120.0° |
| O | C | OXT | 125.2° | 120.0° |
| O | C | CA | 112.1° | 120.0° |
| CAV | SAP | CAT | 103.2° | 90.3° |
| SAP | CAV | CAU | 104.1° | 108.3° |
| SAP | CAT | CAR | 135.8° | 124.9° |
| SAP | CAT | NAN | 105.6° | 110.3° |
| CAS | NAW | CAJ | 118.9° | 111.0° |
| NAW | CAS | CAC | 116.9° | 120.1° |
| NAW | CAJ | HAN | 107.4° | 109.0° |
| NAW | CAJ | HAO | 107.3° | 109.0° |
| CAV | CAU | NAN | 116.5° | 112.9° |
| CAV | CAU | CAD | 119.8° | 118.4° |
| CAS | CAC | CAD | 121.0° | 120.8° |
| CAS | CAC | HAC | 119.5° | 119.6° |
| CAR | N | CA | 113.7° | 119.8° |
| N | CAR | CAT | 128.1° | 125.0° |
| N | CAR | SAO | 110.3° | 110.0° |
| N | CA | C | 110.8° | 109.1° |
| N | CA | CB | 106.9° | 111.2° |
| N | CA | HA | 107.1° | 109.1° |
| OXT | C | CA | 121.9° | 120.0° |
| C | OXT | H1 | 109.5° | 117.0° |
| C | CA | CB | 115.2° | 109.1° |
| C | CA | HA | 108.8° | 109.1° |
| CAR | CAT | NAN | 118.2° | 124.9° |
| CAT | CAR | SAO | 120.7° | 125.0° |
| CAT | NAN | CAU | 110.4° | 118.2° |
| CAR | SAO | CB | 99.7° | 95.7° |
| NAN | CAU | CAD | 123.6° | 128.7° |
| CAU | CAD | CAC | 122.3° | 120.6° |
| CAU | CAD | HAD | 118.9° | 119.7° |
| CAC | CAD | HAD | 118.8° | 119.7° |
| CAD | CAC | HAC | 119.5° | 119.6° |
| CA | CB | SAO | 100.9° | 103.3° |
| CB | CA | HA | 107.6° | 109.2° |
| CA | CB | HB2 | 111.6° | 110.6° |
| CA | CB | HB1 | 111.6° | 110.6° |
| SAO | CB | HB2 | 111.6° | 110.7° |
| SAO | CB | HB1 | 111.6° | 110.7° |
| HB2 | CB | HB1 | 109.4° | 110.7° |
| HAN | CAJ | HAO | 109.5° | 109.1° |
| HAJ | CAH | HAK | 109.4° | 109.5° |
| HAF | CAF | HAG | 109.5° | 108.9° |
| HAI | CAG | HAH | 109.4° | 109.0° |
| HAL | CAI | HAM | 109.5° | 109.0° |
| HAP | CAK | HAQ | 109.5° | 109.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAI | CAG | CAF | HAI | 121.1° | 120.6° |
| CAI | CAG | CAF | HAH | 121.1° | 120.6° |
| CAG | CAI | CAK | HAL | 120.7° | 120.5° |
| CAG | CAI | CAK | HAM | 120.7° | 120.5° |
| CAI | CAG | CAF | CAH | 50.3° | 41.5° |
| CAG | CAI | CAK | NAW | 88.8° | 95.0° |
| CAI | CAG | CAF | HAF | 170.2° | 162.3° |
| CAI | CAG | CAF | HAG | 69.7° | 79.2° |
| CAI | CAG | HAI | HAH | 116.6° | 118.7° |
| CAG | CAI | HAL | HAM | 117.7° | 118.9° |
| CAG | CAI | CAK | HAP | 30.9° | 24.6° |
| CAG | CAI | CAK | HAQ | 151.5° | 145.3° |
| CAF | CAG | CAI | CAK | 36.8° | 41.0° |
| CAG | CAF | CAH | HAF | 120.0° | 120.8° |
| CAG | CAF | CAH | HAG | 119.9° | 120.7° |
| CAG | CAF | CAH | CAJ | 88.9° | 93.1° |
| CAG | CAF | CAH | HAJ | 31.5° | 26.8° |
| CAG | CAF | CAH | HAK | 150.6° | 147.0° |
| CAG | CAF | HAF | HAG | 120.1° | 118.3° |
| CAF | CAG | HAI | HAH | 116.6° | 118.9° |
| CAF | CAG | CAI | HAL | 157.5° | 79.6° |
| CAF | CAG | CAI | HAM | 83.9° | 161.5° |
| CAI | CAK | NAW | HAP | 119.7° | 119.6° |
| CAI | CAK | NAW | HAQ | 119.7° | 119.7° |
| CAI | CAK | NAW | CAS | 112.1° | 150.4° |
| CAI | CAK | NAW | CAJ | 67.9° | 82.8° |
| CAK | CAI | CAG | HAI | 157.9° | 161.6° |
| CAK | CAI | CAG | HAH | 84.3° | 79.7° |
| CAK | CAI | HAL | HAM | 117.7° | 119.0° |
| CAI | CAK | HAP | HAQ | 120.9° | 120.7° |
| CAF | CAH | CAJ | HAJ | 120.4° | 119.9° |
| CAF | CAH | CAJ | HAK | 120.5° | 120.0° |
| CAF | CAH | CAJ | NAW | 59.9° | 77.4° |
| CAF | CAH | CAJ | HAN | 179.0° | 162.0° |
| CAF | CAH | CAJ | HAO | 61.3° | 43.1° |
| CAF | CAH | HAJ | HAK | 118.7° | 120.3° |
| CAH | CAF | HAF | HAG | 120.2° | 118.6° |
| CAH | CAF | CAG | HAI | 70.8° | 79.0° |
| CAH | CAF | CAG | HAH | 171.4° | 162.1° |
| CAK | NAW | CAJ | CAH | 41.3° | 62.3° |
| CAK | NAW | CAS | CAE | 34.2° | 51.1° |
| CAK | NAW | CAS | CAJ | 180.0° | 128.9° |
| CAK | NAW | CAS | CAC | 146.8° | 128.8° |
| CAK | NAW | CAJ | HAN | 162.5° | 177.2° |
| CAK | NAW | CAJ | HAO | 79.9° | 58.2° |
| NAW | CAK | CAI | HAL | 150.5° | 25.5° |
| NAW | CAK | CAI | HAM | 31.9° | 144.4° |
| NAW | CAK | HAP | HAQ | 120.9° | 120.7° |
| CAH | CAJ | NAW | CAS | 138.7° | 170.9° |
| CAH | CAJ | NAW | HAN | 121.2° | 120.6° |
| CAH | CAJ | NAW | HAO | 121.2° | 120.5° |
| CAH | CAJ | HAN | HAO | 116.2° | 118.9° |
| CAJ | CAH | HAJ | HAK | 118.7° | 120.2° |
| CAJ | CAH | CAF | HAF | 151.1° | 146.2° |
| CAJ | CAH | CAF | HAG | 31.0° | 27.7° |
| CAV | CAE | CAS | HAE | 180.0° | 180.0° |
| CAE | CAV | SAP | CAU | 178.9° | 179.8° |
| CAE | CAV | SAP | CAT | 178.8° | 180.0° |
| CAV | CAE | CAS | NAW | 179.5° | 180.0° |
| CAV | CAE | CAS | CAC | 0.6° | 0.1° |
| CAE | CAV | CAU | NAN | 179.7° | 179.9° |
| CAE | CAV | CAU | CAD | 0.3° | 0.1° |
| CAS | CAE | CAV | SAP | 178.8° | 180.0° |
| CAE | CAS | NAW | CAC | 178.9° | 179.9° |
| CAE | CAS | NAW | CAJ | 145.8° | 180.0° |
| CAS | CAE | CAV | CAU | 0.1° | 0.2° |
| CAE | CAS | CAC | CAD | 1.1° | 0.0° |
| CAE | CAS | CAC | HAC | 178.9° | 179.9° |
| O | C | CA | N | 15.9° | 21.8° |
| O | C | OXT | CA | 168.8° | 179.7° |
| O | C | CA | CB | 137.4° | 99.9° |
| O | C | OXT | H1 | 0.0° | 0.0° |
| O | C | CA | HA | 101.7° | 140.9° |
| CAV | SAP | CAT | CAR | 175.4° | 180.0° |
| CAV | SAP | CAT | NAN | 3.4° | 0.2° |
| SAP | CAV | CAU | NAN | 0.6° | 0.1° |
| SAP | CAV | CAU | CAD | 179.3° | 180.0° |
| SAP | CAV | CAE | HAE | 1.2° | 0.0° |
| CAT | SAP | CAV | CAU | 2.3° | 0.2° |
| SAP | CAT | CAR | N | 9.7° | 179.8° |
| SAP | CAT | CAR | NAN | 171.3° | 179.7° |
| SAP | CAT | CAR | SAO | 178.2° | 0.3° |
| SAP | CAT | NAN | CAU | 3.2° | 0.2° |
| NAW | CAS | CAC | CAD | 179.8° | 179.8° |
| NAW | CAS | CAE | HAE | 0.5° | 0.0° |
| NAW | CAS | CAC | HAC | 0.2° | 0.0° |
| CAS | NAW | CAJ | HAN | 17.5° | 50.3° |
| CAS | NAW | CAJ | HAO | 100.1° | 68.6° |
| CAS | NAW | CAK | HAP | 128.2° | 90.0° |
| CAS | NAW | CAK | HAQ | 7.6° | 30.7° |
| CAJ | NAW | CAS | CAC | 33.2° | 0.1° |
| NAW | CAJ | HAN | HAO | 116.2° | 118.9° |
| NAW | CAJ | CAH | HAJ | 60.6° | 42.4° |
| NAW | CAJ | CAH | HAK | 179.7° | 162.6° |
| CAJ | NAW | CAK | HAP | 51.8° | 36.8° |
| CAJ | NAW | CAK | HAQ | 172.4° | 157.6° |
| CAV | CAU | NAN | CAT | 1.8° | 0.1° |
| CAV | CAU | NAN | CAD | 179.9° | 180.0° |
| CAV | CAU | CAD | CAC | 0.3° | 0.0° |
| CAU | CAV | CAE | HAE | 179.9° | 179.8° |
| CAV | CAU | CAD | HAD | 179.7° | 180.0° |
| CAS | CAC | CAD | CAU | 1.0° | 0.1° |
| CAS | CAC | CAD | HAC | 180.0° | 179.9° |
| CAC | CAS | CAE | HAE | 179.4° | 179.9° |
| CAS | CAC | CAD | HAD | 179.0° | 179.9° |
| CAR | N | CA | C | 148.4° | 120.5° |
| N | CAR | CAT | SAO | 168.5° | 179.9° |
| N | CAR | CAT | NAN | 161.6° | 0.1° |
| CAR | N | CA | CB | 22.1° | 0.1° |
| N | CAR | SAO | CB | 14.2° | 0.0° |
| CAR | N | CA | HA | 93.1° | 120.4° |
| N | CA | C | OXT | 174.0° | 158.5° |
| N | CA | C | CB | 121.5° | 121.7° |
| N | CA | C | HA | 117.5° | 119.1° |
| CA | N | CAR | CAT | 166.8° | 180.0° |
| CA | N | CAR | SAO | 2.6° | 0.1° |
| N | CA | CB | HA | 114.8° | 120.4° |
| N | CA | CB | SAO | 28.0° | 0.0° |
| N | CA | CB | HB2 | 146.6° | 118.5° |
| N | CA | CB | HB1 | 90.6° | 118.5° |
| OXT | C | CA | CB | 52.4° | 79.8° |
| OXT | C | CA | HA | 68.5° | 39.5° |
| C | CA | CB | HA | 121.6° | 119.2° |
| C | CA | CB | SAO | 151.6° | 120.4° |
| CA | C | OXT | H1 | 168.8° | 179.7° |
| C | CA | CB | HB2 | 89.8° | 121.1° |
| C | CA | CB | HB1 | 33.0° | 1.9° |
| CAR | CAT | NAN | CAU | 176.9° | 180.0° |
| CAT | CAR | SAO | CB | 175.4° | 180.0° |
| NAN | CAT | CAR | SAO | 6.9° | 180.0° |
| CAT | NAN | CAU | CAD | 178.2° | 179.8° |
| CAR | SAO | CB | CA | 25.7° | 0.0° |
| CAR | SAO | CB | HB2 | 144.3° | 118.4° |
| CAR | SAO | CB | HB1 | 92.9° | 118.4° |
| NAN | CAU | CAD | CAC | 179.8° | 179.9° |
| NAN | CAU | CAD | HAD | 0.2° | 0.0° |
| CAU | CAD | CAC | HAD | 180.0° | 179.9° |
| CAU | CAD | CAC | HAC | 179.0° | 180.0° |
| CA | CB | SAO | HB2 | 118.6° | 118.4° |
| CA | CB | SAO | HB1 | 118.6° | 118.4° |
| CA | CB | HB2 | HB1 | 124.0° | 123.0° |
| SAO | CB | CA | HA | 86.8° | 120.4° |
| SAO | CB | HB2 | HB1 | 124.0° | 123.2° |
| HA | CA | CB | HB2 | 31.8° | 1.9° |
| HA | CA | CB | HB1 | 154.6° | 121.1° |
| HAD | CAD | CAC | HAC | 1.0° | 0.1° |
| HAN | CAJ | CAH | HAJ | 60.6° | 78.1° |
| HAN | CAJ | CAH | HAK | 58.5° | 42.1° |
| HAO | CAJ | CAH | HAJ | 178.2° | 163.0° |
| HAO | CAJ | CAH | HAK | 59.1° | 76.9° |
| HAJ | CAH | CAF | HAF | 88.4° | 93.9° |
| HAJ | CAH | CAF | HAG | 151.5° | 147.5° |
| HAK | CAH | CAF | HAF | 30.7° | 26.3° |
| HAK | CAH | CAF | HAG | 89.4° | 92.3° |
| HAF | CAF | CAG | HAI | 49.1° | 41.8° |
| HAF | CAF | CAG | HAH | 68.7° | 77.1° |
| HAG | CAF | CAG | HAI | 169.2° | 160.2° |
| HAG | CAF | CAG | HAH | 51.4° | 41.3° |
| HAI | CAG | CAI | HAL | 81.4° | 41.0° |
| HAI | CAG | CAI | HAM | 37.2° | 77.8° |
| HAH | CAG | CAI | HAL | 36.5° | 159.8° |
| HAH | CAG | CAI | HAM | 155.0° | 40.9° |
| HAL | CAI | CAK | HAP | 89.8° | 145.1° |
| HAL | CAI | CAK | HAQ | 30.8° | 94.2° |
| HAM | CAI | CAK | HAP | 151.6° | 96.0° |
| HAM | CAI | CAK | HAQ | 87.8° | 24.7° |
