GJB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | O | doub | 1.21Å | 1.23Å | |
| C | CA | sing | 1.52Å | 1.55Å | |
| C | NAL | sing | 1.35Å | 1.43Å | |
| CA | CB | sing | 1.52Å | 1.55Å | |
| CB | OAN | doub | 1.21Å | 1.22Å | |
| CB | NAB | sing | 1.35Å | 1.39Å | |
| OAC | CA0 | doub | 1.21Å | 1.23Å | |
| CAE | CAF | sing | 1.38Å | 1.40Å | Aromatic |
| CAE | CAG | doub | 1.38Å | 1.40Å | Aromatic |
| CAF | CAH | doub | 1.38Å | 1.40Å | Aromatic |
| CAG | CAP | sing | 1.38Å | 1.40Å | Aromatic |
| CAH | CAQ | sing | 1.51Å | 1.55Å | |
| CAH | CAO | sing | 1.38Å | 1.40Å | Aromatic |
| CA0 | NAL | sing | 1.34Å | 1.41Å | |
| CA0 | NAB | sing | 1.34Å | 1.38Å | |
| CAJ | NAL | sing | 1.47Å | 1.51Å | |
| CAJ | CAQ | sing | 1.53Å | 1.56Å | |
| CAP | CAO | doub | 1.38Å | 1.40Å | Aromatic |
| CA | HA1C | sing | 1.09Å | 1.10Å | |
| CA | HA2C | sing | 1.09Å | 1.10Å | |
| NAB | HAB | sing | 0.97Å | 1.00Å | |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAG | HAG | sing | 1.08Å | 1.08Å | |
| CAP | HAP | sing | 1.08Å | 1.08Å | |
| CAQ | HAQ1 | sing | 1.09Å | 1.10Å | |
| CAQ | HAQ2 | sing | 1.09Å | 1.10Å | |
| CAO | HAO | sing | 1.08Å | 1.08Å | |
| CAJ | HAJ1 | sing | 1.09Å | 1.10Å | |
| CAJ | HAJ2 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | CA | 117.3° | 121.2° |
| O | C | NAL | 120.1° | 121.2° |
| CA | C | NAL | 122.6° | 117.5° |
| C | CA | CB | 110.1° | 116.2° |
| C | CA | HA1C | 109.3° | 108.1° |
| C | CA | HA2C | 109.3° | 108.1° |
| C | NAL | CA0 | 120.2° | 122.0° |
| C | NAL | CAJ | 121.0° | 119.0° |
| CA | CB | OAN | 120.5° | 121.3° |
| CA | CB | NAB | 123.1° | 117.5° |
| CB | CA | HA1C | 109.3° | 108.1° |
| CB | CA | HA2C | 109.3° | 108.2° |
| OAN | CB | NAB | 116.4° | 121.2° |
| CB | NAB | CA0 | 122.1° | 122.0° |
| CB | NAB | HAB | 118.9° | 119.0° |
| OAC | CA0 | NAL | 120.9° | 117.6° |
| OAC | CA0 | NAB | 117.2° | 117.6° |
| CAF | CAE | CAG | 120.4° | 120.0° |
| CAE | CAF | CAH | 120.5° | 120.0° |
| CAF | CAE | HAE | 119.8° | 120.0° |
| CAE | CAF | HAF | 119.7° | 120.0° |
| CAE | CAG | CAP | 119.4° | 120.0° |
| CAG | CAE | HAE | 119.8° | 120.0° |
| CAE | CAG | HAG | 120.3° | 120.0° |
| CAF | CAH | CAQ | 121.7° | 120.0° |
| CAF | CAH | CAO | 118.7° | 120.0° |
| CAH | CAF | HAF | 119.8° | 120.0° |
| CAG | CAP | CAO | 120.2° | 120.0° |
| CAP | CAG | HAG | 120.3° | 120.0° |
| CAG | CAP | HAP | 119.9° | 120.0° |
| CAQ | CAH | CAO | 119.6° | 120.0° |
| CAH | CAQ | CAJ | 117.1° | 109.5° |
| CAH | CAQ | HAQ1 | 107.5° | 109.5° |
| CAH | CAQ | HAQ2 | 107.5° | 109.5° |
| CAH | CAO | CAP | 120.9° | 120.1° |
| CAH | CAO | HAO | 119.5° | 119.9° |
| NAL | CA0 | NAB | 121.9° | 124.7° |
| CA0 | NAL | CAJ | 118.8° | 119.0° |
| CA0 | NAB | HAB | 118.9° | 119.1° |
| NAL | CAJ | CAQ | 110.7° | 109.5° |
| NAL | CAJ | HAJ1 | 109.2° | 109.5° |
| NAL | CAJ | HAJ2 | 109.2° | 109.5° |
| CAJ | CAQ | HAQ1 | 107.5° | 109.5° |
| CAJ | CAQ | HAQ2 | 107.5° | 109.5° |
| CAQ | CAJ | HAJ1 | 109.2° | 109.5° |
| CAQ | CAJ | HAJ2 | 109.2° | 109.5° |
| CAO | CAP | HAP | 119.9° | 120.0° |
| CAP | CAO | HAO | 119.6° | 120.0° |
| HA1C | CA | HA2C | 109.5° | 107.8° |
| HAQ1 | CAQ | HAQ2 | 109.5° | 109.4° |
| HAJ1 | CAJ | HAJ2 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | CA | NAL | 179.8° | 179.7° |
| O | C | CA | CB | 178.9° | 180.0° |
| O | C | NAL | CA0 | 178.3° | 180.0° |
| O | C | NAL | CAJ | 0.2° | 0.0° |
| O | C | CA | HA1C | 61.0° | 58.3° |
| O | C | CA | HA2C | 58.8° | 58.2° |
| C | CA | CB | HA1C | 120.1° | 121.7° |
| C | CA | CB | HA2C | 120.1° | 121.8° |
| C | CA | CB | OAN | 179.1° | 180.0° |
| C | CA | CB | NAB | 0.0° | 0.0° |
| CA | C | NAL | CA0 | 1.9° | 0.3° |
| CA | C | NAL | CAJ | 179.9° | 179.7° |
| C | CA | HA1C | HA2C | 119.7° | 116.7° |
| NAL | C | CA | CB | 1.3° | 0.3° |
| C | NAL | CA0 | OAC | 177.7° | 180.0° |
| C | NAL | CA0 | CAJ | 178.1° | 180.0° |
| C | NAL | CA0 | NAB | 1.2° | 0.0° |
| C | NAL | CAJ | CAQ | 117.1° | 90.0° |
| NAL | C | CA | HA1C | 118.8° | 122.0° |
| NAL | C | CA | HA2C | 121.4° | 121.5° |
| C | NAL | CAJ | HAJ1 | 122.7° | 150.0° |
| C | NAL | CAJ | HAJ2 | 3.0° | 30.0° |
| CA | CB | OAN | NAB | 179.1° | 180.0° |
| CA | CB | NAB | CA0 | 0.7° | 0.3° |
| CB | CA | HA1C | HA2C | 119.7° | 116.7° |
| CA | CB | NAB | HAB | 179.3° | 180.0° |
| OAN | CB | NAB | CA0 | 178.4° | 179.7° |
| OAN | CB | CA | HA1C | 59.0° | 58.3° |
| OAN | CB | CA | HA2C | 60.8° | 58.2° |
| OAN | CB | NAB | HAB | 1.6° | 0.1° |
| CB | NAB | CA0 | OAC | 179.0° | 179.7° |
| CB | NAB | CA0 | NAL | 0.1° | 0.3° |
| CB | NAB | CA0 | HAB | 180.0° | 179.8° |
| NAB | CB | CA | HA1C | 120.1° | 121.7° |
| NAB | CB | CA | HA2C | 120.1° | 121.8° |
| OAC | CA0 | NAL | NAB | 178.9° | 179.9° |
| OAC | CA0 | NAL | CAJ | 0.4° | 0.0° |
| OAC | CA0 | NAB | HAB | 1.0° | 0.1° |
| CAF | CAE | CAG | HAE | 180.0° | 179.7° |
| CAE | CAF | CAH | HAF | 180.0° | 180.0° |
| CAF | CAE | CAG | CAP | 0.3° | 0.0° |
| CAE | CAF | CAH | CAQ | 179.3° | 180.0° |
| CAE | CAF | CAH | CAO | 0.1° | 0.0° |
| CAF | CAE | CAG | HAG | 179.7° | 180.0° |
| CAG | CAE | CAF | CAH | 0.4° | 0.0° |
| CAE | CAG | CAP | HAG | 180.0° | 180.0° |
| CAE | CAG | CAP | CAO | 0.2° | 0.0° |
| CAG | CAE | CAF | HAF | 179.6° | 180.0° |
| CAE | CAG | CAP | HAP | 179.9° | 180.0° |
| CAF | CAH | CAQ | CAO | 179.2° | 180.0° |
| CAF | CAH | CAQ | CAJ | 36.8° | 90.0° |
| CAF | CAH | CAO | CAP | 0.6° | 0.1° |
| CAH | CAF | CAE | HAE | 179.6° | 179.7° |
| CAF | CAH | CAQ | HAQ1 | 84.3° | 150.0° |
| CAF | CAH | CAQ | HAQ2 | 158.0° | 30.0° |
| CAF | CAH | CAO | HAO | 179.4° | 180.0° |
| CAG | CAP | CAO | CAH | 0.6° | 0.1° |
| CAG | CAP | CAO | HAP | 180.0° | 180.0° |
| CAP | CAG | CAE | HAE | 179.7° | 179.7° |
| CAG | CAP | CAO | HAO | 179.4° | 180.0° |
| CAH | CAQ | CAJ | NAL | 176.9° | 180.0° |
| CAH | CAQ | CAJ | HAQ1 | 121.1° | 120.0° |
| CAH | CAQ | CAJ | HAQ2 | 121.1° | 120.0° |
| CAQ | CAH | CAO | CAP | 179.8° | 180.0° |
| CAQ | CAH | CAF | HAF | 0.7° | 0.0° |
| CAH | CAQ | HAQ1 | HAQ2 | 116.5° | 120.0° |
| CAQ | CAH | CAO | HAO | 0.3° | 0.1° |
| CAH | CAQ | CAJ | HAJ1 | 62.9° | 60.0° |
| CAH | CAQ | CAJ | HAJ2 | 56.7° | 60.0° |
| CAO | CAH | CAQ | CAJ | 144.0° | 90.0° |
| CAH | CAO | CAP | HAO | 180.0° | 179.9° |
| CAO | CAH | CAF | HAF | 179.9° | 180.0° |
| CAH | CAO | CAP | HAP | 179.4° | 179.9° |
| CAO | CAH | CAQ | HAQ1 | 94.9° | 30.0° |
| CAO | CAH | CAQ | HAQ2 | 22.9° | 150.0° |
| CA0 | NAL | CAJ | CAQ | 64.8° | 90.0° |
| NAL | CA0 | NAB | HAB | 179.9° | 179.9° |
| CA0 | NAL | CAJ | HAJ1 | 55.4° | 30.0° |
| CA0 | NAL | CAJ | HAJ2 | 175.0° | 150.0° |
| NAB | CA0 | NAL | CAJ | 179.2° | 180.0° |
| NAL | CAJ | CAQ | HAJ1 | 120.2° | 120.0° |
| NAL | CAJ | CAQ | HAJ2 | 120.2° | 120.0° |
| NAL | CAJ | CAQ | HAQ1 | 62.0° | 60.0° |
| NAL | CAJ | CAQ | HAQ2 | 55.8° | 60.0° |
| NAL | CAJ | HAJ1 | HAJ2 | 119.5° | 120.0° |
| CAJ | CAQ | HAQ1 | HAQ2 | 116.5° | 120.0° |
| CAQ | CAJ | HAJ1 | HAJ2 | 119.5° | 120.0° |
| CAO | CAP | CAG | HAG | 179.8° | 180.0° |
| HAE | CAE | CAF | HAF | 0.4° | 0.3° |
| HAE | CAE | CAG | HAG | 0.3° | 0.3° |
| HAG | CAG | CAP | HAP | 0.2° | 0.0° |
| HAP | CAP | CAO | HAO | 0.6° | 0.0° |
| HAQ1 | CAQ | CAJ | HAJ1 | 58.1° | 60.0° |
| HAQ1 | CAQ | CAJ | HAJ2 | 177.8° | 180.0° |
| HAQ2 | CAQ | CAJ | HAJ1 | 175.9° | 180.0° |
| HAQ2 | CAQ | CAJ | HAJ2 | 64.4° | 60.0° |
