DTE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.47Å | |
| CA | C | sing | 1.53Å | 1.53Å | |
| CA | CB | sing | 1.54Å | 1.54Å | |
| C | OXT | sing | 1.23Å | 1.23Å | |
| C | O | doub | 1.22Å | 1.22Å | |
| CB | CG | sing | 1.54Å | 1.54Å | |
| CG | CD2 | sing | 1.39Å | 1.39Å | Aromatic |
| CG | CD1 | doub | 1.33Å | 1.33Å | Aromatic |
| CD2 | CE2 | sing | 1.39Å | 1.39Å | Aromatic |
| CD2 | CE3 | doub | 1.40Å | 1.40Å | Aromatic |
| CD1 | NE1 | sing | 1.33Å | 1.33Å | Aromatic |
| NE1 | CE2 | sing | 1.33Å | 1.33Å | Aromatic |
| CE2 | CZ2 | doub | 1.39Å | 1.39Å | Aromatic |
| CZ2 | CH2 | sing | 1.40Å | 1.40Å | Aromatic |
| CZ2 | CL | sing | 1.73Å | 1.73Å | |
| CH2 | CZ3 | doub | 1.40Å | 1.40Å | Aromatic |
| CZ3 | CE3 | sing | 1.40Å | 1.40Å | Aromatic |
| N | HN1 | sing | 1.00Å | 1.00Å | |
| N | HN2 | sing | 1.00Å | 1.00Å | |
| CA | HA | sing | 1.10Å | 1.10Å | |
| CB | HBC1 | sing | 1.10Å | 1.10Å | |
| CB | HBC2 | sing | 1.10Å | 1.10Å | |
| OXT | HXT | sing | 0.95Å | 0.95Å | |
| CD1 | HD1 | sing | 1.08Å | 1.08Å | |
| CE3 | HE3 | sing | 1.08Å | 1.08Å | |
| NE1 | HE1 | sing | 1.00Å | 1.00Å | |
| CH2 | HH2 | sing | 1.08Å | 1.08Å | |
| CZ3 | HZ3 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N | CA | C | 110.9° | 110.9° |
| N | CA | CB | 111.9° | 111.9° |
| CA | N | HN1 | 109.5° | 109.5° |
| CA | N | HN2 | 109.5° | 109.5° |
| N | CA | HA | 107.1° | 107.1° |
| C | CA | CB | 110.4° | 110.4° |
| CA | C | OXT | 120.7° | 120.7° |
| CA | C | O | 120.0° | 120.0° |
| C | CA | HA | 108.7° | 108.7° |
| CA | CB | CG | 115.1° | 115.1° |
| CB | CA | HA | 107.7° | 107.7° |
| CA | CB | HBC1 | 107.6° | 107.6° |
| CA | CB | HBC2 | 106.3° | 106.3° |
| OXT | C | O | 119.3° | 119.3° |
| C | OXT | HXT | 109.5° | 109.5° |
| CB | CG | CD2 | 127.0° | 127.0° |
| CB | CG | CD1 | 125.9° | 125.9° |
| CG | CB | HBC1 | 107.7° | 107.7° |
| CG | CB | HBC2 | 106.4° | 106.4° |
| CD2 | CG | CD1 | 107.2° | 107.2° |
| CG | CD2 | CE2 | 105.9° | 105.9° |
| CG | CD2 | CE3 | 133.9° | 133.9° |
| CG | CD1 | NE1 | 110.3° | 110.3° |
| CG | CD1 | HD1 | 124.9° | 124.9° |
| CE2 | CD2 | CE3 | 120.2° | 120.2° |
| CD2 | CE2 | NE1 | 108.2° | 108.2° |
| CD2 | CE2 | CZ2 | 120.3° | 120.3° |
| CD2 | CE3 | CZ3 | 119.5° | 119.5° |
| CD2 | CE3 | HE3 | 120.2° | 120.2° |
| CD1 | NE1 | CE2 | 108.5° | 108.5° |
| NE1 | CD1 | HD1 | 124.8° | 124.8° |
| CD1 | NE1 | HE1 | 125.8° | 125.8° |
| NE1 | CE2 | CZ2 | 131.5° | 131.5° |
| CE2 | NE1 | HE1 | 125.8° | 125.8° |
| CE2 | CZ2 | CH2 | 120.0° | 120.0° |
| CE2 | CZ2 | CL | 117.9° | 117.9° |
| CH2 | CZ2 | CL | 122.0° | 122.0° |
| CZ2 | CH2 | CZ3 | 119.6° | 119.6° |
| CZ2 | CH2 | HH2 | 120.2° | 120.2° |
| CH2 | CZ3 | CE3 | 120.3° | 120.3° |
| CZ3 | CH2 | HH2 | 120.2° | 120.2° |
| CH2 | CZ3 | HZ3 | 119.8° | 119.8° |
| CZ3 | CE3 | HE3 | 120.3° | 120.3° |
| CE3 | CZ3 | HZ3 | 119.9° | 119.9° |
| HN1 | N | HN2 | 109.4° | 109.4° |
| HBC1 | CB | HBC2 | 114.0° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N | CA | C | CB | 124.6° | 124.6° |
| N | CA | C | HA | 117.5° | 117.5° |
| N | CA | CB | HA | 117.4° | 117.4° |
| N | CA | C | OXT | 178.0° | 178.0° |
| N | CA | C | O | 1.3° | 1.3° |
| N | CA | CB | CG | 61.1° | 61.1° |
| CA | N | HN1 | HN2 | 120.0° | 120.0° |
| N | CA | CB | HBC1 | 58.9° | 58.9° |
| N | CA | CB | HBC2 | 178.6° | 178.6° |
| C | CA | CB | HA | 118.5° | 118.5° |
| CA | C | OXT | O | 179.3° | 179.3° |
| C | CA | CB | CG | 63.0° | 63.0° |
| C | CA | N | HN1 | 100.0° | 100.0° |
| C | CA | N | HN2 | 20.0° | 20.0° |
| C | CA | CB | HBC1 | 177.0° | 177.0° |
| C | CA | CB | HBC2 | 54.5° | 54.5° |
| CA | C | OXT | HXT | 179.3° | 179.3° |
| CB | CA | C | OXT | 57.4° | 57.4° |
| CB | CA | C | O | 123.3° | 123.3° |
| CA | CB | CG | HBC1 | 120.0° | 120.0° |
| CA | CB | CG | HBC2 | 117.4° | 117.4° |
| CA | CB | CG | CD2 | 106.2° | 106.2° |
| CA | CB | CG | CD1 | 75.4° | 75.4° |
| CB | CA | N | HN1 | 23.8° | 23.8° |
| CB | CA | N | HN2 | 143.8° | 143.8° |
| CA | CB | HBC1 | HBC2 | 117.7° | 117.7° |
| OXT | C | CA | HA | 60.5° | 60.5° |
| O | C | CA | HA | 118.8° | 118.8° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| CB | CG | CD2 | CD1 | 178.6° | 178.6° |
| CB | CG | CD2 | CE2 | 179.1° | 179.1° |
| CB | CG | CD2 | CE3 | 0.9° | 0.9° |
| CB | CG | CD1 | NE1 | 178.9° | 178.9° |
| CG | CB | CA | HA | 178.5° | 178.5° |
| CG | CB | HBC1 | HBC2 | 117.7° | 117.7° |
| CB | CG | CD1 | HD1 | 1.1° | 1.1° |
| CG | CD2 | CE2 | CE3 | 180.0° | 180.0° |
| CD2 | CG | CD1 | NE1 | 0.3° | 0.3° |
| CG | CD2 | CE2 | NE1 | 0.5° | 0.5° |
| CG | CD2 | CE2 | CZ2 | 179.8° | 179.8° |
| CG | CD2 | CE3 | CZ3 | 179.7° | 179.7° |
| CD2 | CG | CB | HBC1 | 133.8° | 133.8° |
| CD2 | CG | CB | HBC2 | 11.2° | 11.2° |
| CD2 | CG | CD1 | HD1 | 179.7° | 179.7° |
| CG | CD2 | CE3 | HE3 | 0.3° | 0.3° |
| CD1 | CG | CD2 | CE2 | 0.5° | 0.5° |
| CD1 | CG | CD2 | CE3 | 179.6° | 179.6° |
| CG | CD1 | NE1 | HD1 | 180.0° | 180.0° |
| CG | CD1 | NE1 | CE2 | 0.0° | 0.0° |
| CD1 | CG | CB | HBC1 | 44.6° | 44.6° |
| CD1 | CG | CB | HBC2 | 167.2° | 167.2° |
| CG | CD1 | NE1 | HE1 | 180.0° | 180.0° |
| CD2 | CE2 | NE1 | CD1 | 0.3° | 0.3° |
| CD2 | CE2 | NE1 | CZ2 | 179.7° | 179.7° |
| CD2 | CE2 | CZ2 | CH2 | 0.0° | 0.0° |
| CD2 | CE2 | CZ2 | CL | 179.9° | 179.9° |
| CE2 | CD2 | CE3 | CZ3 | 0.3° | 0.3° |
| CE2 | CD2 | CE3 | HE3 | 179.7° | 179.7° |
| CD2 | CE2 | NE1 | HE1 | 179.7° | 179.7° |
| CE3 | CD2 | CE2 | NE1 | 179.6° | 179.6° |
| CE3 | CD2 | CE2 | CZ2 | 0.2° | 0.2° |
| CD2 | CE3 | CZ3 | CH2 | 0.2° | 0.2° |
| CD2 | CE3 | CZ3 | HE3 | 180.0° | 180.0° |
| CD2 | CE3 | CZ3 | HZ3 | 179.7° | 179.7° |
| CD1 | NE1 | CE2 | HE1 | 180.0° | 180.0° |
| CD1 | NE1 | CE2 | CZ2 | 180.0° | 180.0° |
| NE1 | CE2 | CZ2 | CH2 | 179.7° | 179.7° |
| NE1 | CE2 | CZ2 | CL | 0.2° | 0.2° |
| CE2 | NE1 | CD1 | HD1 | 180.0° | 180.0° |
| CE2 | CZ2 | CH2 | CL | 179.9° | 179.9° |
| CE2 | CZ2 | CH2 | CZ3 | 0.0° | 0.0° |
| CZ2 | CE2 | NE1 | HE1 | 0.1° | 0.1° |
| CE2 | CZ2 | CH2 | HH2 | 180.0° | 180.0° |
| CZ2 | CH2 | CZ3 | HH2 | 180.0° | 180.0° |
| CZ2 | CH2 | CZ3 | CE3 | 0.1° | 0.1° |
| CZ2 | CH2 | CZ3 | HZ3 | 179.9° | 179.9° |
| CL | CZ2 | CH2 | CZ3 | 179.8° | 179.8° |
| CL | CZ2 | CH2 | HH2 | 0.2° | 0.2° |
| CH2 | CZ3 | CE3 | HZ3 | 180.0° | 180.0° |
| CH2 | CZ3 | CE3 | HE3 | 179.8° | 179.8° |
| CE3 | CZ3 | CH2 | HH2 | 179.9° | 179.9° |
| HN1 | N | CA | HA | 141.6° | 141.6° |
| HN2 | N | CA | HA | 98.5° | 98.5° |
| HA | CA | CB | HBC1 | 58.5° | 58.5° |
| HA | CA | CB | HBC2 | 64.0° | 64.0° |
| HD1 | CD1 | NE1 | HE1 | 0.0° | 0.0° |
| HE3 | CE3 | CZ3 | HZ3 | 0.3° | 0.3° |
| HH2 | CH2 | CZ3 | HZ3 | 0.1° | 0.1° |
