1HP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAD | CAF | doub | 1.38Å | 1.39Å | Aromatic |
| CAD | CAL | sing | 1.39Å | 1.40Å | Aromatic |
| CAF | CAN | sing | 1.39Å | 1.39Å | Aromatic |
| OAC | CAL | sing | 1.36Å | 1.35Å | |
| CAL | CAE | doub | 1.39Å | 1.39Å | Aromatic |
| CAH | NAJ | doub | 1.31Å | 1.32Å | Aromatic |
| CAH | CAO | sing | 1.40Å | 1.40Å | Aromatic |
| CAN | CAO | sing | 1.48Å | 1.38Å | Aromatic |
| CAN | CAG | doub | 1.39Å | 1.39Å | Aromatic |
| NAJ | CAP | sing | 1.33Å | 1.35Å | Aromatic |
| CAO | CAI | doub | 1.40Å | 1.39Å | Aromatic |
| CAE | CAG | sing | 1.38Å | 1.38Å | Aromatic |
| CAP | CAQ | doub | 1.41Å | 1.40Å | Aromatic |
| CAP | NAK | sing | 1.36Å | 1.34Å | Aromatic |
| CAI | CAQ | sing | 1.38Å | 1.38Å | Aromatic |
| CAQ | NAR | sing | 1.38Å | 1.32Å | Aromatic |
| NAK | CAM | doub | 1.31Å | 1.33Å | Aromatic |
| NAR | CAM | sing | 1.36Å | 1.33Å | Aromatic |
| NAR | CAA | sing | 1.47Å | 1.48Å | |
| CAM | NAB | sing | 1.38Å | 1.32Å | |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAA | HAA1 | sing | 1.09Å | 1.10Å | |
| CAA | HAA2 | sing | 1.09Å | 1.10Å | |
| CAA | HAA3 | sing | 1.09Å | 1.10Å | |
| NAB | HAB1 | sing | 0.97Å | 1.00Å | |
| NAB | HAB2 | sing | 0.97Å | 1.00Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAD | HAD | sing | 1.08Å | 1.08Å | |
| OAC | HOAC | sing | 0.97Å | 0.95Å | |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| CAG | HAG | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAF | CAD | CAL | 119.6° | 120.1° |
| CAD | CAF | CAN | 119.4° | 119.9° |
| CAD | CAF | HAF | 120.3° | 120.1° |
| CAF | CAD | HAD | 120.2° | 119.9° |
| CAD | CAL | OAC | 121.6° | 119.9° |
| CAD | CAL | CAE | 120.6° | 120.1° |
| CAL | CAD | HAD | 120.2° | 120.0° |
| CAF | CAN | CAO | 122.9° | 120.0° |
| CAF | CAN | CAG | 120.7° | 119.9° |
| CAN | CAF | HAF | 120.3° | 120.0° |
| OAC | CAL | CAE | 117.8° | 119.9° |
| CAL | OAC | HOAC | 109.5° | 114.0° |
| CAL | CAE | CAG | 120.0° | 120.1° |
| CAL | CAE | HAE | 120.0° | 120.0° |
| NAJ | CAH | CAO | 121.0° | 121.2° |
| CAH | NAJ | CAP | 120.3° | 121.7° |
| NAJ | CAH | HAH | 119.5° | 119.4° |
| CAH | CAO | CAN | 119.8° | 120.4° |
| CAH | CAO | CAI | 120.5° | 119.2° |
| CAO | CAH | HAH | 119.5° | 119.4° |
| CAO | CAN | CAG | 116.3° | 120.1° |
| CAN | CAO | CAI | 119.6° | 120.4° |
| CAN | CAG | CAE | 119.8° | 119.9° |
| CAN | CAG | HAG | 120.1° | 120.1° |
| NAJ | CAP | CAQ | 120.7° | 120.1° |
| NAJ | CAP | NAK | 131.9° | 133.0° |
| CAO | CAI | CAQ | 116.9° | 118.2° |
| CAO | CAI | HAI | 121.5° | 120.9° |
| CAG | CAE | HAE | 120.0° | 119.9° |
| CAE | CAG | HAG | 120.1° | 120.0° |
| CAQ | CAP | NAK | 107.4° | 106.9° |
| CAP | CAQ | CAI | 120.5° | 119.6° |
| CAP | CAQ | NAR | 106.9° | 106.3° |
| CAP | NAK | CAM | 107.1° | 109.8° |
| CAI | CAQ | NAR | 132.6° | 134.1° |
| CAQ | CAI | HAI | 121.5° | 120.9° |
| CAQ | NAR | CAM | 108.2° | 107.1° |
| CAQ | NAR | CAA | 124.8° | 126.4° |
| NAK | CAM | NAR | 110.5° | 109.9° |
| NAK | CAM | NAB | 123.9° | 125.1° |
| CAM | NAR | CAA | 127.0° | 126.4° |
| NAR | CAM | NAB | 125.6° | 125.0° |
| NAR | CAA | HAA1 | 109.5° | 109.5° |
| NAR | CAA | HAA2 | 109.5° | 109.5° |
| NAR | CAA | HAA3 | 109.5° | 109.5° |
| CAM | NAB | HAB1 | 109.5° | 120.0° |
| CAM | NAB | HAB2 | 109.5° | 120.0° |
| HAA1 | CAA | HAA2 | 109.5° | 109.5° |
| HAA1 | CAA | HAA3 | 109.4° | 109.5° |
| HAA2 | CAA | HAA3 | 109.5° | 109.5° |
| HAB1 | NAB | HAB2 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAF | CAD | CAL | HAD | 180.0° | 179.9° |
| CAD | CAF | CAN | HAF | 180.0° | 180.0° |
| CAF | CAD | CAL | OAC | 179.9° | 179.9° |
| CAF | CAD | CAL | CAE | 0.2° | 0.1° |
| CAD | CAF | CAN | CAO | 178.1° | 179.9° |
| CAD | CAF | CAN | CAG | 1.1° | 0.2° |
| CAL | CAD | CAF | CAN | 0.3° | 0.1° |
| CAD | CAL | OAC | CAE | 179.7° | 180.0° |
| CAD | CAL | CAE | CAG | 0.1° | 0.2° |
| CAL | CAD | CAF | HAF | 179.7° | 179.9° |
| CAD | CAL | OAC | HOAC | 5.7° | 90.0° |
| CAD | CAL | CAE | HAE | 179.9° | 179.9° |
| CAF | CAN | CAO | CAH | 43.4° | 179.8° |
| CAF | CAN | CAO | CAG | 177.1° | 179.7° |
| CAF | CAN | CAO | CAI | 140.8° | 0.2° |
| CAF | CAN | CAG | CAE | 1.4° | 0.6° |
| CAN | CAF | CAD | HAD | 179.7° | 180.0° |
| CAF | CAN | CAG | HAG | 178.6° | 179.7° |
| OAC | CAL | CAE | CAG | 179.7° | 179.8° |
| OAC | CAL | CAD | HAD | 0.1° | 0.0° |
| OAC | CAL | CAE | HAE | 0.4° | 0.1° |
| CAL | CAE | CAG | CAN | 0.9° | 0.6° |
| CAL | CAE | CAG | HAE | 180.0° | 179.7° |
| CAE | CAL | CAD | HAD | 179.8° | 180.0° |
| CAE | CAL | OAC | HOAC | 174.6° | 90.0° |
| CAL | CAE | CAG | HAG | 179.1° | 179.7° |
| NAJ | CAH | CAO | HAH | 180.0° | 179.7° |
| NAJ | CAH | CAO | CAN | 178.1° | 180.0° |
| NAJ | CAH | CAO | CAI | 2.3° | 0.5° |
| CAH | NAJ | CAP | CAQ | 0.0° | 0.1° |
| CAH | NAJ | CAP | NAK | 179.6° | 179.9° |
| CAH | CAO | CAN | CAI | 175.8° | 179.5° |
| CAH | CAO | CAN | CAG | 133.7° | 0.1° |
| CAO | CAH | NAJ | CAP | 1.3° | 0.2° |
| CAH | CAO | CAI | CAQ | 2.1° | 0.5° |
| CAH | CAO | CAI | HAI | 177.9° | 179.8° |
| CAO | CAN | CAG | CAE | 178.6° | 179.8° |
| CAN | CAO | CAI | CAQ | 177.8° | 180.0° |
| CAN | CAO | CAI | HAI | 2.2° | 0.2° |
| CAN | CAO | CAH | HAH | 1.8° | 0.2° |
| CAO | CAN | CAF | HAF | 1.9° | 0.1° |
| CAO | CAN | CAG | HAG | 1.4° | 0.0° |
| CAG | CAN | CAO | CAI | 42.1° | 179.4° |
| CAN | CAG | CAE | HAG | 180.0° | 179.7° |
| CAG | CAN | CAF | HAF | 178.9° | 179.7° |
| CAN | CAG | CAE | HAE | 179.1° | 179.7° |
| NAJ | CAP | CAQ | NAK | 179.7° | 179.9° |
| NAJ | CAP | CAQ | CAI | 0.2° | 0.1° |
| NAJ | CAP | CAQ | NAR | 179.8° | 179.9° |
| NAJ | CAP | NAK | CAM | 179.8° | 179.9° |
| CAP | NAJ | CAH | HAH | 178.7° | 179.9° |
| CAO | CAI | CAQ | CAP | 0.8° | 0.1° |
| CAO | CAI | CAQ | HAI | 180.0° | 179.8° |
| CAO | CAI | CAQ | NAR | 179.2° | 179.8° |
| CAI | CAO | CAH | HAH | 177.6° | 179.8° |
| CAP | CAQ | CAI | NAR | 180.0° | 179.9° |
| CAQ | CAP | NAK | CAM | 0.1° | 0.1° |
| CAP | CAQ | NAR | CAM | 0.0° | 0.0° |
| CAP | CAQ | NAR | CAA | 179.8° | 179.9° |
| CAP | CAQ | CAI | HAI | 179.2° | 179.9° |
| NAK | CAP | CAQ | CAI | 179.9° | 180.0° |
| NAK | CAP | CAQ | NAR | 0.1° | 0.1° |
| CAP | NAK | CAM | NAR | 0.2° | 0.1° |
| CAP | NAK | CAM | NAB | 179.6° | 180.0° |
| CAI | CAQ | NAR | CAM | 180.0° | 179.9° |
| CAI | CAQ | NAR | CAA | 0.2° | 0.0° |
| CAQ | NAR | CAM | NAK | 0.1° | 0.0° |
| CAQ | NAR | CAM | CAA | 179.8° | 179.9° |
| CAQ | NAR | CAM | NAB | 179.6° | 180.0° |
| NAR | CAQ | CAI | HAI | 0.8° | 0.0° |
| CAQ | NAR | CAA | HAA1 | 112.8° | 90.0° |
| CAQ | NAR | CAA | HAA2 | 7.2° | 150.0° |
| CAQ | NAR | CAA | HAA3 | 127.2° | 30.0° |
| NAK | CAM | NAR | NAB | 179.7° | 179.9° |
| NAK | CAM | NAR | CAA | 179.9° | 180.0° |
| NAK | CAM | NAB | HAB1 | 131.2° | 180.0° |
| NAK | CAM | NAB | HAB2 | 108.7° | 0.1° |
| CAM | NAR | CAA | HAA1 | 67.4° | 89.9° |
| CAM | NAR | CAA | HAA2 | 172.6° | 30.1° |
| CAM | NAR | CAA | HAA3 | 52.6° | 150.0° |
| NAR | CAM | NAB | HAB1 | 49.1° | 0.1° |
| NAR | CAM | NAB | HAB2 | 71.0° | 180.0° |
| CAA | NAR | CAM | NAB | 0.2° | 0.1° |
| NAR | CAA | HAA1 | HAA2 | 120.0° | 120.0° |
| NAR | CAA | HAA1 | HAA3 | 120.0° | 120.0° |
| NAR | CAA | HAA2 | HAA3 | 120.0° | 120.0° |
| CAM | NAB | HAB1 | HAB2 | 120.0° | 179.9° |
| HAA1 | CAA | HAA2 | HAA3 | 120.0° | 120.0° |
| HAF | CAF | CAD | HAD | 0.3° | 0.1° |
| HAE | CAE | CAG | HAG | 0.9° | 0.0° |
