2QY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C | doub | 1.22Å | 1.26Å | |
| C | CA | sing | 1.47Å | 1.53Å | |
| CN | N | sing | 1.46Å | 1.46Å | |
| CA | N | sing | 1.40Å | 1.48Å | |
| CA | CB | doub | 1.35Å | 1.38Å | |
| CB | CG | sing | 1.47Å | 1.51Å | |
| CG | CD1 | doub | 1.40Å | 1.38Å | Aromatic |
| CG | CD2 | sing | 1.40Å | 1.40Å | Aromatic |
| CD1 | CE1 | sing | 1.38Å | 1.37Å | Aromatic |
| CD2 | CE2 | doub | 1.38Å | 1.38Å | Aromatic |
| CE1 | CZ | doub | 1.39Å | 1.39Å | Aromatic |
| CE2 | CZ | sing | 1.39Å | 1.37Å | Aromatic |
| CZ | OH | sing | 1.36Å | 1.36Å | |
| CN | H82 | sing | 1.09Å | 1.10Å | |
| CN | H83 | sing | 1.09Å | 1.10Å | |
| CN | H84 | sing | 1.09Å | 1.10Å | |
| CB | H85 | sing | 1.08Å | 1.08Å | |
| CD2 | H86 | sing | 1.08Å | 1.08Å | |
| CD1 | H87 | sing | 1.08Å | 1.08Å | |
| CE2 | H88 | sing | 1.08Å | 1.08Å | |
| CE1 | H89 | sing | 1.08Å | 1.08Å | |
| N | H | sing | 0.97Å | 1.00Å | |
| OH | H3 | sing | 0.97Å | 0.95Å | |
| C | OXT | sing | 1.35Å | 98.19Å | |
| OXT | HXT | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | CA | 119.5° | 119.9° |
| O | C | OXT | 29.7° | 120.1° |
| C | CA | N | 113.4° | 120.0° |
| C | CA | CB | 114.1° | 120.0° |
| CA | C | OXT | 145.8° | 120.0° |
| CN | N | CA | 109.3° | 120.0° |
| N | CN | H82 | 109.5° | 109.5° |
| N | CN | H83 | 109.4° | 109.5° |
| N | CN | H84 | 109.5° | 109.5° |
| CN | N | H | 109.5° | 120.0° |
| N | CA | CB | 132.6° | 120.0° |
| CA | N | H | 109.5° | 120.0° |
| CA | CB | CG | 126.7° | 120.0° |
| CA | CB | H85 | 116.7° | 120.0° |
| CB | CG | CD1 | 118.7° | 120.1° |
| CB | CG | CD2 | 120.3° | 120.1° |
| CG | CB | H85 | 116.6° | 120.0° |
| CD1 | CG | CD2 | 120.9° | 119.8° |
| CG | CD1 | CE1 | 118.6° | 119.9° |
| CG | CD1 | H87 | 120.7° | 120.1° |
| CG | CD2 | CE2 | 120.3° | 119.9° |
| CG | CD2 | H86 | 119.9° | 120.1° |
| CD1 | CE1 | CZ | 120.4° | 120.1° |
| CE1 | CD1 | H87 | 120.7° | 120.1° |
| CD1 | CE1 | H89 | 119.8° | 119.9° |
| CD2 | CE2 | CZ | 118.3° | 120.1° |
| CE2 | CD2 | H86 | 119.9° | 120.0° |
| CD2 | CE2 | H88 | 120.9° | 119.9° |
| CE1 | CZ | CE2 | 121.4° | 120.3° |
| CE1 | CZ | OH | 121.5° | 119.9° |
| CZ | CE1 | H89 | 119.8° | 120.0° |
| CE2 | CZ | OH | 117.0° | 119.9° |
| CZ | CE2 | H88 | 120.8° | 119.9° |
| CZ | OH | H3 | 109.5° | 114.0° |
| H82 | CN | H83 | 109.5° | 109.4° |
| H82 | CN | H84 | 109.5° | 109.5° |
| H83 | CN | H84 | 109.5° | 109.5° |
| C | OXT | HXT | 90.0° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | CA | OXT | 19.3° | 179.9° |
| O | C | CA | N | 132.9° | 0.1° |
| O | C | CA | CB | 46.6° | 180.0° |
| O | C | OXT | HXT | 90.0° | 0.0° |
| C | CA | N | CN | 81.2° | 6.1° |
| C | CA | N | CB | 179.5° | 180.0° |
| C | CA | CB | CG | 179.7° | 171.1° |
| C | CA | CB | H85 | 0.3° | 9.0° |
| C | CA | N | H | 38.8° | 173.9° |
| CA | C | OXT | HXT | 90.0° | 180.0° |
| CN | N | CA | H | 120.0° | 180.0° |
| CN | N | CA | CB | 99.4° | 173.8° |
| N | CN | H82 | H83 | 120.0° | 120.0° |
| N | CN | H82 | H84 | 120.0° | 120.0° |
| N | CN | H83 | H84 | 120.0° | 120.1° |
| N | CA | CB | CG | 0.3° | 8.9° |
| CA | N | CN | H82 | 180.0° | 60.0° |
| CA | N | CN | H83 | 60.0° | 60.0° |
| CA | N | CN | H84 | 60.0° | 180.0° |
| N | CA | CB | H85 | 179.7° | 171.1° |
| N | CA | C | OXT | 113.6° | 180.0° |
| CA | CB | CG | H85 | 180.0° | 180.0° |
| CA | CB | CG | CD1 | 100.0° | 148.9° |
| CA | CB | CG | CD2 | 81.1° | 31.4° |
| CB | CA | N | H | 140.6° | 6.2° |
| CB | CA | C | OXT | 65.9° | 0.0° |
| CB | CG | CD1 | CD2 | 178.9° | 179.8° |
| CB | CG | CD1 | CE1 | 179.9° | 180.0° |
| CB | CG | CD2 | CE2 | 177.9° | 180.0° |
| CB | CG | CD2 | H86 | 2.1° | 0.1° |
| CB | CG | CD1 | H87 | 0.1° | 0.1° |
| CG | CD1 | CE1 | H87 | 180.0° | 179.9° |
| CD1 | CG | CD2 | CE2 | 3.2° | 0.3° |
| CG | CD1 | CE1 | CZ | 1.7° | 0.0° |
| CD1 | CG | CB | H85 | 80.0° | 31.1° |
| CD1 | CG | CD2 | H86 | 176.8° | 179.8° |
| CG | CD1 | CE1 | H89 | 178.3° | 180.0° |
| CD2 | CG | CD1 | CE1 | 1.1° | 0.3° |
| CG | CD2 | CE2 | H86 | 180.0° | 179.9° |
| CG | CD2 | CE2 | CZ | 2.5° | 0.0° |
| CD2 | CG | CB | H85 | 98.9° | 148.7° |
| CD2 | CG | CD1 | H87 | 179.0° | 179.7° |
| CG | CD2 | CE2 | H88 | 177.5° | 179.9° |
| CD1 | CE1 | CZ | H89 | 180.0° | 180.0° |
| CD1 | CE1 | CZ | CE2 | 2.4° | 0.3° |
| CD1 | CE1 | CZ | OH | 177.8° | 180.0° |
| CD2 | CE2 | CZ | CE1 | 0.2° | 0.3° |
| CD2 | CE2 | CZ | H88 | 180.0° | 179.9° |
| CD2 | CE2 | CZ | OH | 179.9° | 180.0° |
| CE1 | CZ | CE2 | OH | 179.8° | 179.7° |
| CZ | CE1 | CD1 | H87 | 178.3° | 180.0° |
| CE1 | CZ | CE2 | H88 | 179.8° | 179.8° |
| CE1 | CZ | OH | H3 | 180.0° | 89.8° |
| CZ | CE2 | CD2 | H86 | 177.5° | 179.9° |
| CE2 | CZ | CE1 | H89 | 177.6° | 179.7° |
| CE2 | CZ | OH | H3 | 0.2° | 90.0° |
| OH | CZ | CE2 | H88 | 0.1° | 0.0° |
| OH | CZ | CE1 | H89 | 2.2° | 0.0° |
| H82 | CN | H83 | H84 | 120.0° | 120.0° |
| H82 | CN | N | H | 60.0° | 120.1° |
| H83 | CN | N | H | 60.0° | 120.0° |
| H84 | CN | N | H | 180.0° | 0.0° |
| H86 | CD2 | CE2 | H88 | 2.5° | 0.0° |
| H87 | CD1 | CE1 | H89 | 1.7° | 0.1° |
