IMT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.35Å | 1.38Å | |
| N | HN2 | sing | 1.03Å | 1.02Å | |
| N | H | sing | 1.03Å | 1.02Å | |
| CA | NB1 | sing | 1.37Å | 1.41Å | Aromatic |
| CA | CB | doub | 1.37Å | 1.40Å | Aromatic |
| NB1 | CG1 | doub | 1.31Å | 1.39Å | Aromatic |
| CB | NG2 | sing | 1.37Å | 1.41Å | Aromatic |
| CB | HB | sing | 1.08Å | 1.10Å | |
| CG1 | NG2 | sing | 1.37Å | 1.42Å | Aromatic |
| CG1 | C | sing | 1.43Å | 1.47Å | |
| NG2 | CD | sing | 1.44Å | 1.48Å | |
| CD | HD1 | sing | 1.09Å | 1.11Å | |
| CD | HD2 | sing | 1.09Å | 1.11Å | |
| CD | HD3 | sing | 1.09Å | 1.11Å | |
| C | O | doub | 1.25Å | 1.23Å | |
| C | OXT | sing | 1.37Å | 99.57Å | |
| OXT | HXT | sing | 0.98Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | HN2 | 128.0° | 122.1° |
| CA | N | H | 105.8° | 122.1° |
| N | CA | NB1 | 128.0° | 123.1° |
| N | CA | CB | 125.3° | 125.8° |
| HN2 | N | H | 105.8° | 115.5° |
| NB1 | CA | CB | 106.7° | 111.2° |
| CA | NB1 | CG1 | 108.8° | 104.7° |
| CA | CB | NG2 | 109.7° | 104.8° |
| CA | CB | HB | 124.9° | 132.8° |
| NB1 | CG1 | NG2 | 108.2° | 111.8° |
| NB1 | CG1 | C | 131.3° | 122.1° |
| NG2 | CB | HB | 125.4° | 122.4° |
| CB | NG2 | CG1 | 106.5° | 107.5° |
| CB | NG2 | CD | 122.4° | 125.8° |
| NG2 | CG1 | C | 120.5° | 126.1° |
| CG1 | NG2 | CD | 131.1° | 126.7° |
| CG1 | C | O | 114.2° | 126.4° |
| CG1 | C | OXT | 120.7° | 113.5° |
| NG2 | CD | HD1 | 122.4° | 108.1° |
| NG2 | CD | HD2 | 107.6° | 109.4° |
| NG2 | CD | HD3 | 107.6° | 109.3° |
| HD1 | CD | HD2 | 107.6° | 110.5° |
| HD1 | CD | HD3 | 107.6° | 110.5° |
| HD2 | CD | HD3 | 102.3° | 109.1° |
| O | C | OXT | 124.0° | 120.1° |
| C | OXT | HXT | 120.7° | 114.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | HN2 | H | 125.4° | 174.1° |
| N | CA | NB1 | CB | 178.9° | 179.9° |
| N | CA | NB1 | CG1 | 178.6° | 179.9° |
| N | CA | CB | NG2 | 178.8° | 179.9° |
| N | CA | CB | HB | 1.3° | 0.0° |
| HN2 | N | CA | NB1 | 180.0° | 73.8° |
| HN2 | N | CA | CB | 1.4° | 106.3° |
| H | N | CA | NB1 | 54.7° | 112.5° |
| H | N | CA | CB | 124.0° | 67.5° |
| NB1 | CA | CB | NG2 | 0.1° | 0.1° |
| NB1 | CA | CB | HB | 179.8° | 180.0° |
| CA | NB1 | CG1 | NG2 | 0.2° | 0.0° |
| CA | NB1 | CG1 | C | 179.7° | 179.9° |
| CB | CA | NB1 | CG1 | 0.2° | 0.0° |
| CA | CB | NG2 | HB | 180.0° | 179.9° |
| CA | CB | NG2 | CG1 | 0.0° | 0.1° |
| CA | CB | NG2 | CD | 179.9° | 179.9° |
| NB1 | CG1 | NG2 | CB | 0.1° | 0.1° |
| NB1 | CG1 | NG2 | C | 179.9° | 179.9° |
| NB1 | CG1 | NG2 | CD | 179.9° | 179.9° |
| NB1 | CG1 | C | O | 177.7° | 179.9° |
| NB1 | CG1 | C | OXT | 9.2° | 0.1° |
| CB | NG2 | CG1 | CD | 179.9° | 179.9° |
| CB | NG2 | CG1 | C | 179.8° | 180.0° |
| CB | NG2 | CD | HD1 | 180.0° | 108.4° |
| CB | NG2 | CD | HD2 | 54.8° | 12.0° |
| CB | NG2 | CD | HD3 | 54.8° | 131.3° |
| HB | CB | NG2 | CG1 | 180.0° | 180.0° |
| HB | CB | NG2 | CD | 0.1° | 0.0° |
| CG1 | NG2 | CD | HD1 | 0.1° | 71.7° |
| CG1 | NG2 | CD | HD2 | 125.3° | 168.0° |
| CG1 | NG2 | CD | HD3 | 125.2° | 48.6° |
| NG2 | CG1 | C | O | 2.4° | 0.2° |
| NG2 | CG1 | C | OXT | 170.9° | 179.8° |
| C | CG1 | NG2 | CD | 0.2° | 0.0° |
| CG1 | C | O | OXT | 168.0° | 180.0° |
| CG1 | C | OXT | HXT | 180.0° | 180.0° |
| NG2 | CD | HD1 | HD2 | 125.2° | 119.7° |
| NG2 | CD | HD1 | HD3 | 125.3° | 119.5° |
| NG2 | CD | HD2 | HD3 | 113.2° | 119.5° |
| HD1 | CD | HD2 | HD3 | 113.2° | 121.6° |
| O | C | OXT | HXT | 12.7° | 0.0° |
