BYH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAA | NAV | sing | 1.47Å | 1.51Å | |
| SAB | CAQ | doub | 1.71Å | 1.75Å | |
| CAC | CAD | sing | 1.39Å | 1.43Å | Aromatic |
| CAC | CAG | doub | 1.38Å | 1.43Å | Aromatic |
| CAD | CAH | doub | 1.38Å | 1.42Å | Aromatic |
| CAE | CAF | sing | 1.38Å | 1.43Å | Aromatic |
| CAE | CAI | doub | 1.38Å | 1.41Å | Aromatic |
| CAF | CAJ | doub | 1.38Å | 1.42Å | Aromatic |
| CAG | CAR | sing | 1.39Å | 1.43Å | Aromatic |
| CAH | CAS | sing | 1.40Å | 1.42Å | Aromatic |
| CAI | CAT | sing | 1.39Å | 1.45Å | Aromatic |
| CAJ | CAU | sing | 1.39Å | 1.42Å | Aromatic |
| CAK | CAL | sing | 1.53Å | 1.56Å | |
| CAK | SAO | sing | 1.81Å | 1.84Å | |
| CAL | NAW | sing | 1.46Å | 1.53Å | |
| NAM | CAP | sing | 1.37Å | 1.34Å | Aromatic |
| NAM | CAR | sing | 1.38Å | 1.34Å | Aromatic |
| NAN | CAP | doub | 1.31Å | 1.33Å | Aromatic |
| NAN | CAS | sing | 1.36Å | 1.31Å | Aromatic |
| SAO | CAP | sing | 1.76Å | 1.75Å | |
| CAQ | NAV | sing | 1.35Å | 1.36Å | |
| CAQ | NAW | sing | 1.35Å | 1.38Å | |
| CAR | CAS | doub | 1.41Å | 1.43Å | Aromatic |
| CAT | CAU | doub | 1.40Å | 1.44Å | Aromatic |
| CAT | NAV | sing | 1.39Å | 1.32Å | |
| CAU | NAW | sing | 1.39Å | 1.35Å | |
| CAA | HAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAB | sing | 1.09Å | 1.10Å | |
| CAC | HAC | sing | 1.08Å | 1.08Å | |
| CAD | HAD | sing | 1.08Å | 1.08Å | |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAG | HAG | sing | 1.08Å | 1.08Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAK | HAK | sing | 1.09Å | 1.10Å | |
| CAK | HAKA | sing | 1.09Å | 1.10Å | |
| CAL | HAL | sing | 1.09Å | 1.10Å | |
| CAL | HALA | sing | 1.09Å | 1.10Å | |
| NAM | HNAM | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAA | NAV | CAQ | 125.2° | 125.8° |
| CAA | NAV | CAT | 125.1° | 125.8° |
| NAV | CAA | HAA | 109.5° | 109.4° |
| NAV | CAA | HAAA | 109.4° | 109.4° |
| NAV | CAA | HAAB | 109.5° | 109.5° |
| SAB | CAQ | NAV | 122.0° | 125.2° |
| SAB | CAQ | NAW | 128.6° | 125.1° |
| CAD | CAC | CAG | 121.2° | 120.5° |
| CAC | CAD | CAH | 120.4° | 120.5° |
| CAD | CAC | HAC | 119.4° | 119.7° |
| CAC | CAD | HAD | 119.8° | 119.8° |
| CAC | CAG | CAR | 117.9° | 119.8° |
| CAG | CAC | HAC | 119.4° | 119.8° |
| CAC | CAG | HAG | 121.1° | 120.1° |
| CAD | CAH | CAS | 118.9° | 119.8° |
| CAH | CAD | HAD | 119.8° | 119.7° |
| CAD | CAH | HAH | 120.6° | 120.2° |
| CAF | CAE | CAI | 120.9° | 120.3° |
| CAE | CAF | CAJ | 120.8° | 120.3° |
| CAF | CAE | HAE | 119.6° | 119.9° |
| CAE | CAF | HAF | 119.6° | 119.9° |
| CAE | CAI | CAT | 118.4° | 119.8° |
| CAI | CAE | HAE | 119.6° | 119.8° |
| CAE | CAI | HAI | 120.8° | 120.2° |
| CAF | CAJ | CAU | 120.1° | 119.9° |
| CAJ | CAF | HAF | 119.6° | 119.9° |
| CAF | CAJ | HAJ | 120.0° | 120.1° |
| CAG | CAR | NAM | 132.5° | 133.9° |
| CAG | CAR | CAS | 120.7° | 120.0° |
| CAR | CAG | HAG | 121.0° | 120.1° |
| CAH | CAS | NAN | 131.7° | 133.4° |
| CAH | CAS | CAR | 120.9° | 119.5° |
| CAS | CAH | HAH | 120.6° | 120.0° |
| CAI | CAT | CAU | 120.7° | 119.9° |
| CAI | CAT | NAV | 133.2° | 133.3° |
| CAT | CAI | HAI | 120.8° | 120.0° |
| CAJ | CAU | CAT | 119.1° | 119.8° |
| CAJ | CAU | NAW | 132.8° | 133.3° |
| CAU | CAJ | HAJ | 120.0° | 120.0° |
| CAL | CAK | SAO | 109.5° | 109.5° |
| CAK | CAL | NAW | 121.8° | 109.4° |
| CAL | CAK | HAK | 109.5° | 109.5° |
| CAL | CAK | HAKA | 109.4° | 109.5° |
| CAK | CAL | HAL | 105.6° | 109.5° |
| CAK | CAL | HALA | 105.5° | 109.4° |
| CAK | SAO | CAP | 103.8° | 100.0° |
| SAO | CAK | HAK | 109.5° | 109.5° |
| SAO | CAK | HAKA | 109.4° | 109.4° |
| CAL | NAW | CAQ | 131.6° | 125.8° |
| CAL | NAW | CAU | 121.6° | 125.9° |
| NAW | CAL | HAL | 105.5° | 109.5° |
| NAW | CAL | HALA | 105.6° | 109.5° |
| CAP | NAM | CAR | 106.6° | 107.3° |
| NAM | CAP | NAN | 111.8° | 109.8° |
| NAM | CAP | SAO | 123.2° | 125.1° |
| CAP | NAM | HNAM | 126.7° | 126.4° |
| NAM | CAR | CAS | 106.8° | 106.1° |
| CAR | NAM | HNAM | 126.7° | 126.4° |
| CAP | NAN | CAS | 107.5° | 109.6° |
| NAN | CAP | SAO | 125.0° | 125.1° |
| NAN | CAS | CAR | 107.4° | 107.1° |
| NAV | CAQ | NAW | 109.3° | 109.7° |
| CAQ | NAV | CAT | 109.6° | 108.4° |
| CAQ | NAW | CAU | 106.8° | 108.3° |
| CAU | CAT | NAV | 106.1° | 106.8° |
| CAT | CAU | NAW | 108.1° | 106.8° |
| HAA | CAA | HAAA | 109.5° | 109.5° |
| HAA | CAA | HAAB | 109.4° | 109.5° |
| HAAA | CAA | HAAB | 109.5° | 109.5° |
| HAK | CAK | HAKA | 109.5° | 109.5° |
| HAL | CAL | HALA | 113.1° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAA | NAV | CAQ | SAB | 0.1° | 0.1° |
| CAA | NAV | CAT | CAI | 0.0° | 0.1° |
| CAA | NAV | CAQ | CAT | 179.9° | 179.9° |
| CAA | NAV | CAQ | NAW | 179.9° | 179.9° |
| CAA | NAV | CAT | CAU | 180.0° | 180.0° |
| NAV | CAA | HAA | HAAA | 120.0° | 120.0° |
| NAV | CAA | HAA | HAAB | 120.0° | 120.0° |
| NAV | CAA | HAAA | HAAB | 120.0° | 120.0° |
| SAB | CAQ | NAW | CAL | 0.0° | 0.0° |
| SAB | CAQ | NAV | NAW | 179.7° | 180.0° |
| SAB | CAQ | NAV | CAT | 179.8° | 180.0° |
| SAB | CAQ | NAW | CAU | 179.9° | 179.9° |
| CAD | CAC | CAG | HAC | 180.0° | 179.7° |
| CAC | CAD | CAH | HAD | 180.0° | 179.9° |
| CAD | CAC | CAG | CAR | 0.3° | 0.0° |
| CAC | CAD | CAH | CAS | 0.1° | 0.0° |
| CAD | CAC | CAG | HAG | 179.7° | 179.9° |
| CAC | CAD | CAH | HAH | 179.8° | 179.9° |
| CAG | CAC | CAD | CAH | 0.5° | 0.0° |
| CAC | CAG | CAR | HAG | 180.0° | 179.9° |
| CAC | CAG | CAR | NAM | 179.9° | 180.0° |
| CAC | CAG | CAR | CAS | 0.3° | 0.0° |
| CAG | CAC | CAD | HAD | 179.5° | 180.0° |
| CAD | CAH | CAS | HAH | 180.0° | 179.9° |
| CAD | CAH | CAS | NAN | 179.6° | 180.0° |
| CAD | CAH | CAS | CAR | 0.5° | 0.0° |
| CAH | CAD | CAC | HAC | 179.5° | 179.7° |
| CAF | CAE | CAI | HAE | 180.0° | 179.8° |
| CAE | CAF | CAJ | HAF | 180.0° | 179.9° |
| CAF | CAE | CAI | CAT | 0.1° | 0.0° |
| CAE | CAF | CAJ | CAU | 0.1° | 0.1° |
| CAF | CAE | CAI | HAI | 179.9° | 180.0° |
| CAE | CAF | CAJ | HAJ | 179.8° | 180.0° |
| CAI | CAE | CAF | CAJ | 0.1° | 0.0° |
| CAE | CAI | CAT | HAI | 180.0° | 180.0° |
| CAE | CAI | CAT | CAU | 0.0° | 0.0° |
| CAE | CAI | CAT | NAV | 180.0° | 180.0° |
| CAI | CAE | CAF | HAF | 179.8° | 180.0° |
| CAF | CAJ | CAU | HAJ | 180.0° | 180.0° |
| CAF | CAJ | CAU | CAT | 0.1° | 0.1° |
| CAF | CAJ | CAU | NAW | 179.8° | 180.0° |
| CAJ | CAF | CAE | HAE | 179.8° | 179.8° |
| CAG | CAR | CAS | CAH | 0.7° | 0.0° |
| CAG | CAR | NAM | CAP | 179.2° | 180.0° |
| CAG | CAR | NAM | CAS | 179.6° | 180.0° |
| CAG | CAR | CAS | NAN | 179.4° | 180.0° |
| CAR | CAG | CAC | HAC | 179.7° | 179.7° |
| CAG | CAR | NAM | HNAM | 0.8° | 0.0° |
| CAH | CAS | CAR | NAM | 179.7° | 180.0° |
| CAH | CAS | NAN | CAP | 179.9° | 179.9° |
| CAH | CAS | NAN | CAR | 180.0° | 180.0° |
| CAS | CAH | CAD | HAD | 179.9° | 179.9° |
| CAI | CAT | CAU | CAJ | 0.0° | 0.0° |
| CAI | CAT | NAV | CAQ | 179.9° | 180.0° |
| CAI | CAT | CAU | NAV | 180.0° | 180.0° |
| CAI | CAT | CAU | NAW | 179.8° | 180.0° |
| CAT | CAI | CAE | HAE | 179.9° | 179.8° |
| CAJ | CAU | NAW | CAL | 0.1° | 0.1° |
| CAJ | CAU | NAW | CAQ | 180.0° | 180.0° |
| CAJ | CAU | CAT | NAW | 179.8° | 179.9° |
| CAJ | CAU | CAT | NAV | 180.0° | 180.0° |
| CAU | CAJ | CAF | HAF | 179.9° | 180.0° |
| CAL | CAK | SAO | HAK | 120.0° | 120.0° |
| CAL | CAK | SAO | HAKA | 120.0° | 120.0° |
| CAK | CAL | NAW | HAL | 120.0° | 120.0° |
| CAK | CAL | NAW | HALA | 120.0° | 119.9° |
| CAL | CAK | SAO | CAP | 89.0° | 180.0° |
| CAK | CAL | NAW | CAQ | 29.1° | 90.1° |
| CAK | CAL | NAW | CAU | 151.1° | 90.0° |
| CAL | CAK | HAK | HAKA | 120.0° | 120.1° |
| CAK | CAL | HAL | HALA | 114.9° | 119.9° |
| SAO | CAK | CAL | NAW | 98.3° | 180.0° |
| CAK | SAO | CAP | NAM | 178.0° | 180.0° |
| CAK | SAO | CAP | NAN | 1.4° | 0.1° |
| SAO | CAK | HAK | HAKA | 120.0° | 120.0° |
| SAO | CAK | CAL | HAL | 141.7° | 60.0° |
| SAO | CAK | CAL | HALA | 21.7° | 60.0° |
| CAL | NAW | CAQ | NAV | 179.7° | 179.9° |
| CAL | NAW | CAQ | CAU | 179.9° | 179.9° |
| CAL | NAW | CAU | CAT | 179.6° | 180.0° |
| NAW | CAL | CAK | HAK | 141.7° | 60.0° |
| NAW | CAL | CAK | HAKA | 21.7° | 60.0° |
| NAW | CAL | HAL | HALA | 114.9° | 120.1° |
| CAP | NAM | CAR | HNAM | 180.0° | 180.0° |
| NAM | CAP | NAN | SAO | 179.5° | 179.9° |
| NAM | CAP | NAN | CAS | 0.2° | 0.0° |
| CAP | NAM | CAR | CAS | 0.4° | 0.0° |
| CAR | NAM | CAP | NAN | 0.3° | 0.0° |
| NAM | CAR | CAS | NAN | 0.3° | 0.0° |
| CAR | NAM | CAP | SAO | 179.2° | 179.9° |
| NAM | CAR | CAG | HAG | 0.2° | 0.1° |
| CAP | NAN | CAS | CAR | 0.1° | 0.0° |
| NAN | CAP | NAM | HNAM | 179.6° | 180.0° |
| CAS | NAN | CAP | SAO | 179.4° | 180.0° |
| NAN | CAS | CAH | HAH | 0.4° | 0.1° |
| CAP | SAO | CAK | HAK | 150.9° | 60.0° |
| CAP | SAO | CAK | HAKA | 30.9° | 60.0° |
| SAO | CAP | NAM | HNAM | 0.9° | 0.1° |
| CAQ | NAV | CAT | CAU | 0.1° | 0.0° |
| NAV | CAQ | NAW | CAU | 0.2° | 0.0° |
| CAQ | NAV | CAA | HAA | 180.0° | 0.1° |
| CAQ | NAV | CAA | HAAA | 60.0° | 120.1° |
| CAQ | NAV | CAA | HAAB | 60.0° | 120.0° |
| CAQ | NAW | CAU | CAT | 0.2° | 0.0° |
| NAW | CAQ | NAV | CAT | 0.0° | 0.0° |
| CAQ | NAW | CAL | HAL | 90.9° | 29.9° |
| CAQ | NAW | CAL | HALA | 149.1° | 150.0° |
| CAS | CAR | CAG | HAG | 179.7° | 179.9° |
| CAR | CAS | CAH | HAH | 179.6° | 179.9° |
| CAS | CAR | NAM | HNAM | 179.6° | 180.0° |
| CAU | CAT | CAI | HAI | 180.0° | 180.0° |
| CAT | CAU | CAJ | HAJ | 179.9° | 180.0° |
| NAV | CAT | CAU | NAW | 0.2° | 0.1° |
| CAT | NAV | CAA | HAA | 0.1° | 180.0° |
| CAT | NAV | CAA | HAAA | 120.1° | 60.0° |
| CAT | NAV | CAA | HAAB | 119.9° | 59.9° |
| NAV | CAT | CAI | HAI | 0.0° | 0.0° |
| NAW | CAU | CAJ | HAJ | 0.2° | 0.1° |
| CAU | NAW | CAL | HAL | 88.9° | 150.0° |
| CAU | NAW | CAL | HALA | 31.1° | 29.9° |
| HAA | CAA | HAAA | HAAB | 120.0° | 120.1° |
| HAC | CAC | CAD | HAD | 0.5° | 0.4° |
| HAC | CAC | CAG | HAG | 0.3° | 0.2° |
| HAD | CAD | CAH | HAH | 0.1° | 0.0° |
| HAE | CAE | CAF | HAF | 0.2° | 0.3° |
| HAE | CAE | CAI | HAI | 0.1° | 0.2° |
| HAF | CAF | CAJ | HAJ | 0.2° | 0.0° |
| HAK | CAK | CAL | HAL | 21.7° | 60.0° |
| HAK | CAK | CAL | HALA | 98.3° | 180.0° |
| HAKA | CAK | CAL | HAL | 98.3° | 180.0° |
| HAKA | CAK | CAL | HALA | 141.7° | 60.0° |
