2HN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| FAK | CAT | sing | 1.35Å | 1.34Å | |
| CAT | CAR | sing | 1.39Å | 1.37Å | Aromatic |
| CAT | CAU | doub | 1.38Å | 1.40Å | Aromatic |
| CAR | FAI | sing | 1.35Å | 1.31Å | |
| CAR | CAP | doub | 1.39Å | 1.36Å | Aromatic |
| CAP | FAG | sing | 1.35Å | 1.33Å | |
| CAP | CAQ | sing | 1.39Å | 1.35Å | Aromatic |
| CAQ | FAH | sing | 1.35Å | 1.34Å | |
| CAQ | CAS | doub | 1.39Å | 1.38Å | Aromatic |
| CAS | FAJ | sing | 1.35Å | 1.34Å | |
| CAS | CAU | sing | 1.38Å | 1.40Å | Aromatic |
| CAU | CAL | sing | 1.51Å | 1.52Å | |
| CAL | CAX | sing | 1.53Å | 1.53Å | |
| CAX | CAY | sing | 1.53Å | 1.55Å | |
| CAX | CAO | sing | 1.51Å | 1.53Å | |
| CAY | OAF | sing | 1.43Å | 1.43Å | |
| CAY | CAN | sing | 1.51Å | 1.49Å | |
| CAY | CAM | sing | 1.53Å | 1.53Å | |
| CAN | OAC | sing | 1.34Å | 1.25Å | |
| CAN | OAA | doub | 1.21Å | 1.22Å | |
| CAO | OAB | doub | 1.21Å | 1.42Å | |
| CAO | CAW | sing | 1.51Å | 1.53Å | |
| CAW | OAE | sing | 1.43Å | 1.42Å | |
| CAW | CAV | sing | 1.53Å | 1.53Å | |
| CAV | OAD | sing | 1.43Å | 1.43Å | |
| CAV | CAM | sing | 1.53Å | 1.52Å | |
| CAL | HAL1 | sing | 1.09Å | 1.10Å | |
| CAL | HAL2 | sing | 1.09Å | 1.10Å | |
| CAX | HAX | sing | 1.09Å | 1.10Å | |
| OAF | HAF | sing | 0.97Å | 0.95Å | |
| CAM | HAM1 | sing | 1.09Å | 1.10Å | |
| CAM | HAM2 | sing | 1.09Å | 1.10Å | |
| OAC | HAC | sing | 0.97Å | 0.95Å | |
| CAW | HAW | sing | 1.09Å | 1.10Å | |
| OAE | HAE | sing | 0.97Å | 0.95Å | |
| CAV | HAV | sing | 1.09Å | 1.10Å | |
| OAD | HAD | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| FAK | CAT | CAR | 117.2° | 120.0° |
| FAK | CAT | CAU | 123.3° | 120.0° |
| CAR | CAT | CAU | 119.4° | 120.0° |
| CAT | CAR | FAI | 121.0° | 120.0° |
| CAT | CAR | CAP | 122.1° | 120.0° |
| CAT | CAU | CAS | 117.7° | 120.1° |
| CAT | CAU | CAL | 120.6° | 120.0° |
| FAI | CAR | CAP | 116.8° | 120.0° |
| CAR | CAP | FAG | 119.5° | 120.0° |
| CAR | CAP | CAQ | 119.7° | 119.9° |
| FAG | CAP | CAQ | 120.8° | 120.0° |
| CAP | CAQ | FAH | 117.3° | 120.0° |
| CAP | CAQ | CAS | 119.9° | 120.0° |
| FAH | CAQ | CAS | 122.7° | 120.0° |
| CAQ | CAS | FAJ | 116.9° | 120.0° |
| CAQ | CAS | CAU | 121.1° | 120.0° |
| FAJ | CAS | CAU | 122.1° | 120.0° |
| CAS | CAU | CAL | 121.7° | 120.0° |
| CAU | CAL | CAX | 115.8° | 109.5° |
| CAU | CAL | HAL1 | 107.9° | 109.4° |
| CAU | CAL | HAL2 | 107.9° | 109.5° |
| CAL | CAX | CAY | 112.0° | 109.6° |
| CAL | CAX | CAO | 111.7° | 109.6° |
| CAX | CAL | HAL1 | 107.9° | 109.4° |
| CAX | CAL | HAL2 | 107.9° | 109.5° |
| CAL | CAX | HAX | 109.0° | 109.7° |
| CAY | CAX | CAO | 106.4° | 108.5° |
| CAX | CAY | OAF | 107.3° | 109.5° |
| CAX | CAY | CAN | 110.9° | 109.5° |
| CAX | CAY | CAM | 112.8° | 109.4° |
| CAY | CAX | HAX | 108.7° | 109.6° |
| CAX | CAO | OAB | 118.6° | 120.9° |
| CAX | CAO | CAW | 112.3° | 118.3° |
| CAO | CAX | HAX | 108.9° | 109.8° |
| OAF | CAY | CAN | 108.6° | 109.5° |
| OAF | CAY | CAM | 108.7° | 109.4° |
| CAY | OAF | HAF | 109.5° | 114.0° |
| CAN | CAY | CAM | 108.4° | 109.5° |
| CAY | CAN | OAC | 122.6° | 120.0° |
| CAY | CAN | OAA | 115.2° | 120.0° |
| CAY | CAM | CAV | 111.0° | 109.9° |
| CAY | CAM | HAM1 | 109.1° | 109.4° |
| CAY | CAM | HAM2 | 109.1° | 109.4° |
| OAC | CAN | OAA | 122.2° | 120.0° |
| CAN | OAC | HAC | 109.5° | 117.0° |
| OAB | CAO | CAW | 115.3° | 120.8° |
| CAO | CAW | OAE | 107.9° | 109.6° |
| CAO | CAW | CAV | 107.3° | 108.5° |
| CAO | CAW | HAW | 108.7° | 109.6° |
| OAE | CAW | CAV | 113.8° | 109.6° |
| OAE | CAW | HAW | 110.2° | 109.6° |
| CAW | OAE | HAE | 109.5° | 114.0° |
| CAW | CAV | OAD | 113.1° | 109.5° |
| CAW | CAV | CAM | 108.5° | 109.4° |
| CAV | CAW | HAW | 108.7° | 109.8° |
| CAW | CAV | HAV | 109.1° | 109.5° |
| OAD | CAV | CAM | 106.1° | 109.5° |
| OAD | CAV | HAV | 110.7° | 109.5° |
| CAV | OAD | HAD | 109.5° | 114.0° |
| CAV | CAM | HAM1 | 109.1° | 109.5° |
| CAV | CAM | HAM2 | 109.1° | 109.4° |
| CAM | CAV | HAV | 109.3° | 109.4° |
| HAL1 | CAL | HAL2 | 109.5° | 109.5° |
| HAM1 | CAM | HAM2 | 109.5° | 109.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| FAK | CAT | CAR | CAU | 178.2° | 179.7° |
| FAK | CAT | CAR | FAI | 1.2° | 0.1° |
| FAK | CAT | CAR | CAP | 179.9° | 180.0° |
| FAK | CAT | CAU | CAS | 179.9° | 179.8° |
| FAK | CAT | CAU | CAL | 2.3° | 0.0° |
| CAT | CAR | FAI | CAP | 178.8° | 180.0° |
| CAT | CAR | CAP | FAG | 179.3° | 180.0° |
| CAT | CAR | CAP | CAQ | 1.0° | 0.0° |
| CAR | CAT | CAU | CAS | 1.8° | 0.5° |
| CAR | CAT | CAU | CAL | 179.6° | 179.7° |
| CAU | CAT | CAR | FAI | 179.4° | 179.7° |
| CAU | CAT | CAR | CAP | 1.8° | 0.3° |
| CAT | CAU | CAS | CAQ | 1.1° | 0.5° |
| CAT | CAU | CAS | FAJ | 179.8° | 179.8° |
| CAT | CAU | CAS | CAL | 177.7° | 179.8° |
| CAT | CAU | CAL | CAX | 94.1° | 90.0° |
| CAT | CAU | CAL | HAL1 | 145.0° | 150.0° |
| CAT | CAU | CAL | HAL2 | 26.9° | 30.0° |
| FAI | CAR | CAP | FAG | 0.5° | 0.0° |
| FAI | CAR | CAP | CAQ | 179.8° | 180.0° |
| CAR | CAP | FAG | CAQ | 179.7° | 180.0° |
| CAR | CAP | CAQ | FAH | 179.7° | 180.0° |
| CAR | CAP | CAQ | CAS | 0.2° | 0.0° |
| FAG | CAP | CAQ | FAH | 0.6° | 0.0° |
| FAG | CAP | CAQ | CAS | 179.9° | 180.0° |
| CAP | CAQ | FAH | CAS | 179.5° | 180.0° |
| CAP | CAQ | CAS | FAJ | 179.1° | 180.0° |
| CAP | CAQ | CAS | CAU | 0.3° | 0.2° |
| FAH | CAQ | CAS | FAJ | 1.5° | 0.0° |
| FAH | CAQ | CAS | CAU | 179.7° | 179.8° |
| CAQ | CAS | FAJ | CAU | 178.8° | 179.8° |
| CAQ | CAS | CAU | CAL | 178.8° | 179.7° |
| FAJ | CAS | CAU | CAL | 2.4° | 0.0° |
| CAS | CAU | CAL | CAX | 88.3° | 89.8° |
| CAS | CAU | CAL | HAL1 | 32.6° | 30.2° |
| CAS | CAU | CAL | HAL2 | 150.8° | 150.2° |
| CAU | CAL | CAX | HAL1 | 120.9° | 119.9° |
| CAU | CAL | CAX | HAL2 | 120.9° | 120.0° |
| CAU | CAL | CAX | CAY | 170.7° | 173.6° |
| CAU | CAL | CAX | CAO | 70.0° | 67.4° |
| CAU | CAL | HAL1 | HAL2 | 117.1° | 120.0° |
| CAU | CAL | CAX | HAX | 50.4° | 53.2° |
| CAL | CAX | CAY | CAO | 122.4° | 119.7° |
| CAL | CAX | CAY | HAX | 120.4° | 120.4° |
| CAL | CAX | CAO | HAX | 120.4° | 120.5° |
| CAL | CAX | CAY | OAF | 171.9° | 175.0° |
| CAL | CAX | CAY | CAN | 53.4° | 55.0° |
| CAL | CAX | CAY | CAM | 68.5° | 65.1° |
| CAL | CAX | CAO | OAB | 75.1° | 111.7° |
| CAL | CAX | CAO | CAW | 63.5° | 68.3° |
| CAX | CAL | HAL1 | HAL2 | 117.2° | 120.0° |
| CAY | CAX | CAO | HAX | 117.0° | 119.8° |
| CAX | CAY | OAF | CAN | 120.0° | 120.0° |
| CAX | CAY | OAF | CAM | 122.2° | 119.9° |
| CAX | CAY | CAN | CAM | 124.3° | 120.0° |
| CAX | CAY | CAN | OAC | 104.7° | 84.1° |
| CAX | CAY | CAN | OAA | 76.5° | 96.0° |
| CAY | CAX | CAO | OAB | 162.4° | 128.6° |
| CAY | CAX | CAO | CAW | 59.0° | 51.3° |
| CAX | CAY | CAM | CAV | 56.4° | 63.6° |
| CAY | CAX | CAL | HAL1 | 49.8° | 53.7° |
| CAY | CAX | CAL | HAL2 | 68.4° | 66.4° |
| CAX | CAY | OAF | HAF | 101.4° | 180.0° |
| CAX | CAY | CAM | HAM1 | 176.6° | 176.2° |
| CAX | CAY | CAM | HAM2 | 63.9° | 56.5° |
| CAO | CAX | CAY | OAF | 65.7° | 65.4° |
| CAO | CAX | CAY | CAN | 175.8° | 174.6° |
| CAO | CAX | CAY | CAM | 53.9° | 54.6° |
| CAX | CAO | OAB | CAW | 137.4° | 179.9° |
| CAX | CAO | CAW | OAE | 172.2° | 171.1° |
| CAX | CAO | CAW | CAV | 64.8° | 51.3° |
| CAO | CAX | CAL | HAL1 | 169.1° | 172.7° |
| CAO | CAX | CAL | HAL2 | 50.9° | 52.6° |
| CAX | CAO | CAW | HAW | 52.6° | 68.5° |
| OAF | CAY | CAN | CAM | 117.9° | 120.0° |
| OAF | CAY | CAN | OAC | 137.6° | 35.9° |
| OAF | CAY | CAN | OAA | 41.3° | 144.0° |
| OAF | CAY | CAM | CAV | 62.5° | 56.4° |
| OAF | CAY | CAX | HAX | 51.5° | 54.5° |
| OAF | CAY | CAM | HAM1 | 57.8° | 63.8° |
| OAF | CAY | CAM | HAM2 | 177.3° | 176.5° |
| CAY | CAN | OAC | OAA | 178.7° | 180.0° |
| CAN | CAY | CAM | CAV | 179.6° | 176.4° |
| CAN | CAY | CAX | HAX | 67.0° | 65.5° |
| CAN | CAY | OAF | HAF | 18.6° | 60.0° |
| CAN | CAY | CAM | HAM1 | 60.1° | 56.2° |
| CAN | CAY | CAM | HAM2 | 59.4° | 63.5° |
| CAY | CAN | OAC | HAC | 178.7° | 180.0° |
| CAM | CAY | CAN | OAC | 19.6° | 156.0° |
| CAM | CAY | CAN | OAA | 159.2° | 24.0° |
| CAY | CAM | CAV | CAW | 59.3° | 63.6° |
| CAY | CAM | CAV | OAD | 179.0° | 176.4° |
| CAY | CAM | CAV | HAM1 | 120.3° | 120.2° |
| CAY | CAM | CAV | HAM2 | 120.2° | 120.1° |
| CAM | CAY | CAX | HAX | 171.1° | 174.5° |
| CAM | CAY | OAF | HAF | 136.4° | 60.1° |
| CAY | CAM | HAM1 | HAM2 | 119.3° | 119.8° |
| CAY | CAM | CAV | HAV | 59.6° | 56.4° |
| OAA | CAN | OAC | HAC | 0.0° | 0.0° |
| OAB | CAO | CAW | OAE | 32.1° | 8.9° |
| OAB | CAO | CAW | CAV | 155.2° | 128.6° |
| OAB | CAO | CAX | HAX | 45.4° | 8.8° |
| OAB | CAO | CAW | HAW | 87.4° | 111.5° |
| CAO | CAW | OAE | CAV | 119.0° | 119.0° |
| CAO | CAW | OAE | HAW | 118.6° | 120.4° |
| CAO | CAW | CAV | HAW | 117.4° | 119.8° |
| CAO | CAW | CAV | OAD | 179.7° | 174.6° |
| CAO | CAW | CAV | CAM | 62.3° | 54.6° |
| CAW | CAO | CAX | HAX | 176.1° | 171.1° |
| CAO | CAW | OAE | HAE | 16.0° | 60.0° |
| CAO | CAW | CAV | HAV | 56.7° | 65.4° |
| OAE | CAW | CAV | HAW | 123.3° | 120.5° |
| OAE | CAW | CAV | OAD | 61.0° | 65.7° |
| OAE | CAW | CAV | CAM | 178.5° | 174.3° |
| OAE | CAW | CAV | HAV | 62.6° | 54.4° |
| CAW | CAV | OAD | CAM | 118.8° | 119.9° |
| CAW | CAV | OAD | HAV | 122.8° | 120.1° |
| CAW | CAV | CAM | HAV | 118.9° | 120.0° |
| CAW | CAV | CAM | HAM1 | 179.5° | 176.3° |
| CAW | CAV | CAM | HAM2 | 61.0° | 56.5° |
| CAV | CAW | OAE | HAE | 135.0° | 179.1° |
| CAW | CAV | OAD | HAD | 180.0° | 60.0° |
| OAD | CAV | CAM | HAV | 119.4° | 120.0° |
| OAD | CAV | CAM | HAM1 | 58.7° | 56.3° |
| OAD | CAV | CAM | HAM2 | 60.8° | 63.5° |
| OAD | CAV | CAW | HAW | 62.2° | 54.8° |
| CAV | CAM | HAM1 | HAM2 | 119.3° | 119.8° |
| CAM | CAV | CAW | HAW | 55.2° | 65.2° |
| CAM | CAV | OAD | HAD | 61.2° | 179.9° |
| HAL1 | CAL | CAX | HAX | 70.5° | 66.7° |
| HAL2 | CAL | CAX | HAX | 171.3° | 173.2° |
| HAM1 | CAM | CAV | HAV | 60.6° | 63.7° |
| HAM2 | CAM | CAV | HAV | 179.8° | 176.5° |
| HAW | CAW | OAE | HAE | 102.6° | 60.3° |
| HAW | CAW | CAV | HAV | 174.2° | 174.9° |
| HAV | CAV | OAD | HAD | 57.2° | 60.1° |
