TR7
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 | 1.51Å | 1.53Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| C | O | sing | 1.34Å | 1.36Å | |
| C | OXT | doub | 1.21Å | 1.23Å | |
| O | CAJ | sing | 1.45Å | 1.43Å | |
| CB | CG | sing | 1.51Å | 1.54Å | |
| CG | CD1 | doub | 1.34Å | 1.34Å | Aromatic |
| CG | CD2 | sing | 1.46Å | 1.39Å | Aromatic |
| CD1 | NE1 | sing | 1.37Å | 1.34Å | Aromatic |
| CD2 | CE2 | sing | 1.41Å | 1.39Å | Aromatic |
| CD2 | CE3 | doub | 1.40Å | 1.39Å | Aromatic |
| NE1 | CE2 | sing | 1.38Å | 1.33Å | Aromatic |
| CE2 | CZ2 | doub | 1.39Å | 1.38Å | Aromatic |
| CE3 | CZ3 | sing | 1.37Å | 1.39Å | Aromatic |
| CZ2 | CH2 | sing | 1.38Å | 1.38Å | Aromatic |
| CZ3 | CH2 | doub | 1.39Å | 1.38Å | Aromatic |
| N | HN1 | sing | 1.01Å | 1.00Å | |
| N | HN2 | sing | 1.01Å | 1.00Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | HB1C | sing | 1.09Å | 1.10Å | |
| CB | HB2C | sing | 1.09Å | 1.10Å | |
| CAJ | HAJ1 | sing | 1.09Å | 1.10Å | |
| CAJ | HAJ2 | sing | 1.09Å | 1.10Å | |
| CAJ | HAJ3 | sing | 1.09Å | 1.10Å | |
| CD1 | HD1 | sing | 1.08Å | 1.08Å | |
| NE1 | HE1 | sing | 0.97Å | 1.00Å | |
| CE3 | HE3 | sing | 1.08Å | 1.08Å | |
| CZ2 | HZ2 | sing | 1.08Å | 1.08Å | |
| CZ3 | HZ3 | sing | 1.08Å | 1.08Å | |
| CH2 | HH2 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N | CA | C | 110.2° | 109.5° |
| N | CA | CB | 109.6° | 109.5° |
| CA | N | HN1 | 109.5° | 111.0° |
| CA | N | HN2 | 109.5° | 111.0° |
| N | CA | HA | 110.0° | 109.4° |
| C | CA | CB | 108.7° | 109.5° |
| CA | C | O | 119.1° | 120.0° |
| CA | C | OXT | 120.9° | 120.0° |
| C | CA | HA | 109.1° | 109.4° |
| CA | CB | CG | 111.2° | 109.5° |
| CB | CA | HA | 109.2° | 109.5° |
| CA | CB | HB1C | 109.0° | 109.5° |
| CA | CB | HB2C | 109.0° | 109.5° |
| O | C | OXT | 120.0° | 120.0° |
| C | O | CAJ | 110.6° | 117.0° |
| O | CAJ | HAJ1 | 109.5° | 109.5° |
| O | CAJ | HAJ2 | 109.4° | 109.5° |
| O | CAJ | HAJ3 | 109.5° | 109.5° |
| CB | CG | CD1 | 127.2° | 126.5° |
| CB | CG | CD2 | 125.7° | 126.5° |
| CG | CB | HB1C | 109.0° | 109.4° |
| CG | CB | HB2C | 109.0° | 109.5° |
| CD1 | CG | CD2 | 107.1° | 107.0° |
| CG | CD1 | NE1 | 110.1° | 109.9° |
| CG | CD1 | HD1 | 125.0° | 125.0° |
| CG | CD2 | CE2 | 106.1° | 106.1° |
| CG | CD2 | CE3 | 133.3° | 134.0° |
| CD1 | NE1 | CE2 | 108.3° | 109.9° |
| NE1 | CD1 | HD1 | 125.0° | 125.0° |
| CD1 | NE1 | HE1 | 125.9° | 125.0° |
| CE2 | CD2 | CE3 | 120.6° | 119.9° |
| CD2 | CE2 | NE1 | 108.5° | 107.1° |
| CD2 | CE2 | CZ2 | 119.9° | 119.4° |
| CD2 | CE3 | CZ3 | 119.4° | 119.8° |
| CD2 | CE3 | HE3 | 120.3° | 120.2° |
| NE1 | CE2 | CZ2 | 131.6° | 133.5° |
| CE2 | NE1 | HE1 | 125.8° | 125.1° |
| CE2 | CZ2 | CH2 | 119.3° | 119.8° |
| CE2 | CZ2 | HZ2 | 120.4° | 120.1° |
| CE3 | CZ3 | CH2 | 119.3° | 120.5° |
| CZ3 | CE3 | HE3 | 120.3° | 120.1° |
| CE3 | CZ3 | HZ3 | 120.3° | 119.7° |
| CZ2 | CH2 | CZ3 | 121.4° | 120.7° |
| CH2 | CZ2 | HZ2 | 120.3° | 120.1° |
| CZ2 | CH2 | HH2 | 119.3° | 119.7° |
| CH2 | CZ3 | HZ3 | 120.3° | 119.8° |
| CZ3 | CH2 | HH2 | 119.3° | 119.6° |
| HN1 | N | HN2 | 109.5° | 111.0° |
| HB1C | CB | HB2C | 109.5° | 109.4° |
| HAJ1 | CAJ | HAJ2 | 109.5° | 109.5° |
| HAJ1 | CAJ | HAJ3 | 109.5° | 109.4° |
| HAJ2 | CAJ | HAJ3 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N | CA | C | CB | 120.2° | 120.0° |
| N | CA | C | HA | 120.8° | 119.9° |
| N | CA | CB | HA | 120.5° | 120.0° |
| N | CA | C | O | 150.7° | 160.0° |
| N | CA | C | OXT | 29.1° | 20.1° |
| N | CA | CB | CG | 179.5° | 65.0° |
| CA | N | HN1 | HN2 | 120.0° | 123.9° |
| N | CA | CB | HB1C | 59.2° | 55.0° |
| N | CA | CB | HB2C | 60.3° | 175.0° |
| C | CA | CB | HA | 119.0° | 120.0° |
| CA | C | O | OXT | 179.8° | 179.9° |
| CA | C | O | CAJ | 180.0° | 180.0° |
| C | CA | CB | CG | 60.0° | 175.0° |
| C | CA | N | HN1 | 180.0° | 60.1° |
| C | CA | N | HN2 | 60.0° | 176.0° |
| C | CA | CB | HB1C | 179.7° | 65.0° |
| C | CA | CB | HB2C | 60.3° | 54.9° |
| CB | CA | C | O | 89.2° | 79.9° |
| CB | CA | C | OXT | 91.1° | 100.0° |
| CA | CB | CG | HB1C | 120.3° | 120.0° |
| CA | CB | CG | HB2C | 120.3° | 120.1° |
| CA | CB | CG | CD1 | 99.4° | 94.9° |
| CA | CB | CG | CD2 | 80.5° | 84.6° |
| CB | CA | N | HN1 | 60.4° | 60.0° |
| CB | CA | N | HN2 | 179.6° | 63.9° |
| CA | CB | HB1C | HB2C | 119.2° | 120.0° |
| O | C | CA | HA | 29.9° | 40.1° |
| C | O | CAJ | HAJ1 | 180.0° | 179.9° |
| C | O | CAJ | HAJ2 | 60.0° | 60.0° |
| C | O | CAJ | HAJ3 | 60.0° | 60.0° |
| OXT | C | O | CAJ | 0.2° | 0.1° |
| OXT | C | CA | HA | 149.9° | 140.0° |
| O | CAJ | HAJ1 | HAJ2 | 120.0° | 120.1° |
| O | CAJ | HAJ1 | HAJ3 | 120.0° | 120.0° |
| O | CAJ | HAJ2 | HAJ3 | 120.0° | 120.0° |
| CB | CG | CD1 | CD2 | 179.9° | 179.6° |
| CB | CG | CD1 | NE1 | 179.8° | 179.9° |
| CB | CG | CD2 | CE2 | 179.6° | 179.9° |
| CB | CG | CD2 | CE3 | 0.0° | 0.1° |
| CG | CB | CA | HA | 59.0° | 55.0° |
| CG | CB | HB1C | HB2C | 119.2° | 120.0° |
| CB | CG | CD1 | HD1 | 0.1° | 0.1° |
| CG | CD1 | NE1 | HD1 | 180.0° | 179.9° |
| CD1 | CG | CD2 | CE2 | 0.4° | 0.3° |
| CD1 | CG | CD2 | CE3 | 179.9° | 179.8° |
| CG | CD1 | NE1 | CE2 | 0.1° | 0.2° |
| CD1 | CG | CB | HB1C | 140.3° | 145.1° |
| CD1 | CG | CB | HB2C | 20.9° | 25.2° |
| CG | CD1 | NE1 | HE1 | 179.9° | 179.9° |
| CD2 | CG | CD1 | NE1 | 0.2° | 0.3° |
| CG | CD2 | CE2 | CE3 | 179.7° | 179.9° |
| CG | CD2 | CE2 | NE1 | 0.5° | 0.2° |
| CG | CD2 | CE2 | CZ2 | 179.8° | 179.9° |
| CG | CD2 | CE3 | CZ3 | 179.6° | 180.0° |
| CD2 | CG | CB | HB1C | 39.8° | 35.4° |
| CD2 | CG | CB | HB2C | 159.2° | 155.3° |
| CD2 | CG | CD1 | HD1 | 179.8° | 179.8° |
| CG | CD2 | CE3 | HE3 | 0.4° | 0.1° |
| CD1 | NE1 | CE2 | CD2 | 0.3° | 0.0° |
| CD1 | NE1 | CE2 | HE1 | 180.0° | 179.9° |
| CD1 | NE1 | CE2 | CZ2 | 179.9° | 179.9° |
| CD2 | CE2 | NE1 | CZ2 | 179.7° | 179.9° |
| CE2 | CD2 | CE3 | CZ3 | 0.0° | 0.1° |
| CD2 | CE2 | CZ2 | CH2 | 0.0° | 0.0° |
| CD2 | CE2 | NE1 | HE1 | 179.6° | 179.9° |
| CE2 | CD2 | CE3 | HE3 | 180.0° | 179.9° |
| CD2 | CE2 | CZ2 | HZ2 | 180.0° | 180.0° |
| CE3 | CD2 | CE2 | NE1 | 179.8° | 179.9° |
| CE3 | CD2 | CE2 | CZ2 | 0.0° | 0.0° |
| CD2 | CE3 | CZ3 | HE3 | 180.0° | 179.9° |
| CD2 | CE3 | CZ3 | CH2 | 0.1° | 0.1° |
| CD2 | CE3 | CZ3 | HZ3 | 179.9° | 180.0° |
| NE1 | CE2 | CZ2 | CH2 | 179.7° | 179.8° |
| CE2 | NE1 | CD1 | HD1 | 179.9° | 179.9° |
| NE1 | CE2 | CZ2 | HZ2 | 0.3° | 0.2° |
| CE2 | CZ2 | CH2 | HZ2 | 180.0° | 180.0° |
| CE2 | CZ2 | CH2 | CZ3 | 0.0° | 0.0° |
| CZ2 | CE2 | NE1 | HE1 | 0.1° | 0.0° |
| CE2 | CZ2 | CH2 | HH2 | 179.9° | 180.0° |
| CE3 | CZ3 | CH2 | CZ2 | 0.1° | 0.1° |
| CE3 | CZ3 | CH2 | HZ3 | 180.0° | 179.9° |
| CE3 | CZ3 | CH2 | HH2 | 179.9° | 179.9° |
| CZ2 | CH2 | CZ3 | HH2 | 180.0° | 180.0° |
| CZ2 | CH2 | CZ3 | HZ3 | 179.9° | 180.0° |
| CH2 | CZ3 | CE3 | HE3 | 179.9° | 180.0° |
| CZ3 | CH2 | CZ2 | HZ2 | 179.9° | 180.0° |
| HN1 | N | CA | HA | 59.7° | 180.0° |
| HN2 | N | CA | HA | 60.3° | 56.1° |
| HA | CA | CB | HB1C | 61.3° | 175.0° |
| HA | CA | CB | HB2C | 179.2° | 65.1° |
| HAJ1 | CAJ | HAJ2 | HAJ3 | 120.0° | 119.9° |
| HD1 | CD1 | NE1 | HE1 | 0.1° | 0.0° |
| HE3 | CE3 | CZ3 | HZ3 | 0.1° | 0.1° |
| HZ2 | CZ2 | CH2 | HH2 | 0.1° | 0.0° |
| HZ3 | CZ3 | CH2 | HH2 | 0.1° | 0.0° |
