I1L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAI | CAG | doub | 1.21Å | 1.19Å | |
| CAF | CAG | sing | 1.51Å | 1.54Å | |
| CAF | CAE | sing | 1.51Å | 1.49Å | |
| CAG | N | sing | 1.35Å | 1.30Å | |
| NAC | CAE | sing | 1.33Å | 1.31Å | Aromatic |
| NAC | NAA | doub | 1.29Å | 1.29Å | Aromatic |
| CAE | NAD | doub | 1.31Å | 1.27Å | Aromatic |
| N | NAJ | sing | 1.37Å | 1.32Å | |
| NAD | NAB | sing | 1.29Å | 1.33Å | Aromatic |
| NAA | NAB | sing | 1.29Å | 1.27Å | Aromatic |
| NAB | HAB | sing | 0.97Å | 1.00Å | |
| CAF | HAF | sing | 1.09Å | 1.10Å | |
| CAF | HAG | sing | 1.09Å | 1.10Å | |
| N | H | sing | 0.97Å | 1.00Å | |
| NAJ | HAJ | sing | 1.01Å | 1.00Å | |
| NAJ | HAK | sing | 1.01Å | 1.00Å | |
| NAJ | HAL | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAI | CAG | CAF | 124.3° | 120.0° |
| OAI | CAG | N | 125.5° | 120.0° |
| CAG | CAF | CAE | 113.8° | 109.5° |
| CAF | CAG | N | 110.2° | 120.1° |
| CAG | CAF | HAF | 108.4° | 109.4° |
| CAG | CAF | HAG | 108.4° | 109.4° |
| CAF | CAE | NAC | 122.6° | 126.5° |
| CAF | CAE | NAD | 127.3° | 126.6° |
| CAE | CAF | HAF | 108.4° | 109.5° |
| CAE | CAF | HAG | 108.4° | 109.5° |
| CAG | N | NAJ | 117.0° | 120.0° |
| CAG | N | H | 121.5° | 120.0° |
| CAE | NAC | NAA | 105.8° | 107.4° |
| NAC | CAE | NAD | 109.7° | 106.9° |
| NAC | NAA | NAB | 109.8° | 108.7° |
| CAE | NAD | NAB | 106.5° | 107.9° |
| NAJ | N | H | 121.5° | 120.0° |
| N | NAJ | HAJ | 109.5° | 109.4° |
| N | NAJ | HAK | 109.5° | 109.5° |
| N | NAJ | HAL | 109.5° | 109.4° |
| NAD | NAB | NAA | 108.0° | 109.1° |
| NAD | NAB | HAB | 126.0° | 125.5° |
| NAA | NAB | HAB | 126.0° | 125.4° |
| HAF | CAF | HAG | 109.5° | 109.5° |
| HAJ | NAJ | HAK | 109.5° | 109.5° |
| HAJ | NAJ | HAL | 109.4° | 109.5° |
| HAK | NAJ | HAL | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAI | CAG | CAF | N | 179.8° | 179.9° |
| OAI | CAG | CAF | CAE | 58.6° | 0.0° |
| OAI | CAG | N | NAJ | 1.4° | 0.1° |
| OAI | CAG | CAF | HAF | 62.0° | 120.0° |
| OAI | CAG | CAF | HAG | 179.3° | 120.0° |
| OAI | CAG | N | H | 178.6° | 180.0° |
| CAG | CAF | CAE | HAF | 120.6° | 119.9° |
| CAG | CAF | CAE | HAG | 120.7° | 120.0° |
| CAG | CAF | CAE | NAC | 176.4° | 90.0° |
| CAG | CAF | CAE | NAD | 10.7° | 90.1° |
| CAF | CAG | N | NAJ | 178.4° | 180.0° |
| CAG | CAF | HAF | HAG | 118.0° | 119.9° |
| CAF | CAG | N | H | 1.6° | 0.1° |
| CAE | CAF | CAG | N | 121.5° | 180.0° |
| CAF | CAE | NAC | NAD | 174.0° | 180.0° |
| CAF | CAE | NAC | NAA | 177.6° | 179.9° |
| CAF | CAE | NAD | NAB | 176.8° | 180.0° |
| CAE | CAF | HAF | HAG | 118.0° | 120.1° |
| CAG | N | NAJ | H | 180.0° | 179.9° |
| N | CAG | CAF | HAF | 117.8° | 60.0° |
| N | CAG | CAF | HAG | 0.9° | 59.9° |
| CAG | N | NAJ | HAJ | 180.0° | 60.1° |
| CAG | N | NAJ | HAK | 60.0° | 59.9° |
| CAG | N | NAJ | HAL | 60.0° | 180.0° |
| NAC | CAE | NAD | NAB | 3.2° | 0.0° |
| CAE | NAC | NAA | NAB | 2.6° | 0.0° |
| NAC | CAE | CAF | HAF | 62.9° | 150.1° |
| NAC | CAE | CAF | HAG | 55.8° | 30.0° |
| NAA | NAC | CAE | NAD | 3.6° | 0.0° |
| NAC | NAA | NAB | NAD | 0.7° | 0.1° |
| NAC | NAA | NAB | HAB | 179.3° | 180.0° |
| CAE | NAD | NAB | NAA | 1.6° | 0.0° |
| CAE | NAD | NAB | HAB | 178.5° | 180.0° |
| NAD | CAE | CAF | HAF | 109.9° | 29.9° |
| NAD | CAE | CAF | HAG | 131.4° | 150.0° |
| N | NAJ | HAJ | HAK | 120.0° | 120.0° |
| N | NAJ | HAJ | HAL | 120.0° | 119.9° |
| N | NAJ | HAK | HAL | 120.0° | 120.0° |
| NAD | NAB | NAA | HAB | 180.0° | 179.9° |
| H | N | NAJ | HAJ | 0.0° | 120.1° |
| H | N | NAJ | HAK | 120.0° | 119.9° |
| H | N | NAJ | HAL | 120.0° | 0.1° |
| HAJ | NAJ | HAK | HAL | 120.0° | 120.1° |
