OTY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CD2 | CE2 | doub | 1.38Å | 1.39Å | Aromatic |
| CD2 | CG | sing | 1.38Å | 1.41Å | Aromatic |
| CE2 | CZ | sing | 1.39Å | 1.41Å | Aromatic |
| O | C | doub | 1.21Å | 1.23Å | |
| CB | CG | sing | 1.51Å | 1.52Å | |
| CB | CA | sing | 1.53Å | 1.54Å | |
| CG | CD1 | doub | 1.39Å | 1.39Å | Aromatic |
| CZ | OH | sing | 1.36Å | 1.38Å | |
| CZ | CE1 | doub | 1.39Å | 1.40Å | Aromatic |
| CD1 | CE1 | sing | 1.39Å | 1.40Å | Aromatic |
| CD1 | OD1 | sing | 1.36Å | 1.36Å | |
| C | CA | sing | 1.51Å | 1.52Å | |
| CA | N | sing | 1.47Å | 1.47Å | |
| C | OXT | sing | 1.34Å | 1.33Å | |
| OD1 | H1 | sing | 0.97Å | 0.95Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | H6 | sing | 1.09Å | 1.10Å | |
| CB | H7 | sing | 1.09Å | 1.10Å | |
| CD2 | H8 | sing | 1.08Å | 1.08Å | |
| CE1 | H9 | sing | 1.08Å | 1.08Å | |
| CE2 | H10 | sing | 1.08Å | 1.08Å | |
| OH | H11 | sing | 0.97Å | 0.95Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CE2 | CD2 | CG | 121.0° | 120.1° |
| CD2 | CE2 | CZ | 119.6° | 120.1° |
| CE2 | CD2 | H8 | 119.5° | 120.0° |
| CD2 | CE2 | H10 | 120.2° | 120.0° |
| CD2 | CG | CB | 119.1° | 119.9° |
| CD2 | CG | CD1 | 119.8° | 120.0° |
| CG | CD2 | H8 | 119.5° | 119.9° |
| CE2 | CZ | OH | 121.5° | 120.0° |
| CE2 | CZ | CE1 | 119.1° | 120.0° |
| CZ | CE2 | H10 | 120.2° | 120.0° |
| O | C | CA | 120.7° | 120.0° |
| O | C | OXT | 122.1° | 120.0° |
| CG | CB | CA | 116.6° | 109.4° |
| CB | CG | CD1 | 121.2° | 120.0° |
| CG | CB | H6 | 107.7° | 109.5° |
| CG | CB | H7 | 107.7° | 109.5° |
| CB | CA | C | 106.1° | 109.4° |
| CB | CA | N | 107.9° | 109.5° |
| CB | CA | HA | 109.4° | 109.4° |
| CA | CB | H6 | 107.7° | 109.4° |
| CA | CB | H7 | 107.7° | 109.4° |
| CG | CD1 | CE1 | 119.2° | 119.9° |
| CG | CD1 | OD1 | 115.8° | 120.0° |
| OH | CZ | CE1 | 119.3° | 120.0° |
| CZ | OH | H11 | 109.5° | 114.0° |
| CZ | CE1 | CD1 | 121.3° | 119.9° |
| CZ | CE1 | H9 | 119.4° | 120.1° |
| CE1 | CD1 | OD1 | 125.0° | 120.1° |
| CD1 | CE1 | H9 | 119.4° | 120.0° |
| CD1 | OD1 | H1 | 109.5° | 114.0° |
| C | CA | N | 113.3° | 109.5° |
| CA | C | OXT | 117.2° | 120.0° |
| C | CA | HA | 109.7° | 109.5° |
| CA | N | H2 | 109.5° | 111.0° |
| CA | N | H | 109.5° | 111.0° |
| N | CA | HA | 110.3° | 109.5° |
| C | OXT | HXT | 109.5° | 117.0° |
| H2 | N | H | 109.5° | 111.0° |
| H6 | CB | H7 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CE2 | CD2 | CG | H8 | 180.0° | 180.0° |
| CD2 | CE2 | CZ | H10 | 180.0° | 180.0° |
| CE2 | CD2 | CG | CB | 179.9° | 179.9° |
| CE2 | CD2 | CG | CD1 | 0.3° | 0.3° |
| CD2 | CE2 | CZ | OH | 179.6° | 179.9° |
| CD2 | CE2 | CZ | CE1 | 2.7° | 0.3° |
| CG | CD2 | CE2 | CZ | 1.8° | 0.0° |
| CD2 | CG | CB | CD1 | 179.7° | 179.7° |
| CD2 | CG | CB | CA | 94.0° | 95.3° |
| CD2 | CG | CD1 | CE1 | 0.1° | 0.3° |
| CD2 | CG | CD1 | OD1 | 179.3° | 179.8° |
| CD2 | CG | CB | H6 | 27.1° | 144.8° |
| CD2 | CG | CB | H7 | 145.0° | 24.7° |
| CG | CD2 | CE2 | H10 | 178.2° | 180.0° |
| CE2 | CZ | OH | CE1 | 177.6° | 179.8° |
| CE2 | CZ | CE1 | CD1 | 2.3° | 0.2° |
| CZ | CE2 | CD2 | H8 | 178.2° | 180.0° |
| CE2 | CZ | CE1 | H9 | 177.7° | 179.8° |
| CE2 | CZ | OH | H11 | 180.0° | 90.0° |
| O | C | CA | CB | 70.2° | 100.1° |
| O | C | CA | OXT | 177.9° | 179.9° |
| O | C | CA | N | 171.6° | 19.9° |
| O | C | CA | HA | 47.8° | 140.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| CG | CB | CA | H6 | 121.0° | 120.0° |
| CG | CB | CA | H7 | 121.0° | 120.0° |
| CB | CG | CD1 | CE1 | 179.6° | 180.0° |
| CB | CG | CD1 | OD1 | 1.0° | 0.1° |
| CG | CB | CA | C | 176.3° | 175.0° |
| CG | CB | CA | N | 62.0° | 65.0° |
| CG | CB | CA | HA | 58.0° | 55.0° |
| CG | CB | H6 | H7 | 116.8° | 120.1° |
| CB | CG | CD2 | H8 | 0.0° | 0.1° |
| CA | CB | CG | CD1 | 86.3° | 85.0° |
| CB | CA | C | N | 118.2° | 120.0° |
| CB | CA | C | HA | 118.0° | 120.0° |
| CB | CA | N | HA | 119.4° | 120.0° |
| CB | CA | C | OXT | 107.7° | 80.0° |
| CB | CA | N | H2 | 180.0° | 176.0° |
| CB | CA | N | H | 60.0° | 60.0° |
| CA | CB | H6 | H7 | 116.8° | 120.0° |
| CG | CD1 | CE1 | CZ | 0.9° | 0.1° |
| CG | CD1 | CE1 | OD1 | 179.4° | 179.9° |
| CG | CD1 | OD1 | H1 | 180.0° | 90.0° |
| CD1 | CG | CB | H6 | 152.6° | 34.9° |
| CD1 | CG | CB | H7 | 34.7° | 155.0° |
| CD1 | CG | CD2 | H8 | 179.7° | 179.7° |
| CG | CD1 | CE1 | H9 | 179.1° | 180.0° |
| OH | CZ | CE1 | CD1 | 180.0° | 180.0° |
| OH | CZ | CE1 | H9 | 0.0° | 0.0° |
| OH | CZ | CE2 | H10 | 0.3° | 0.0° |
| CZ | CE1 | CD1 | H9 | 180.0° | 180.0° |
| CZ | CE1 | CD1 | OD1 | 179.8° | 180.0° |
| CE1 | CZ | CE2 | H10 | 177.3° | 179.8° |
| CE1 | CZ | OH | H11 | 2.4° | 90.2° |
| CE1 | CD1 | OD1 | H1 | 0.6° | 90.1° |
| OD1 | CD1 | CE1 | H9 | 0.2° | 0.0° |
| C | CA | N | HA | 123.4° | 120.1° |
| C | CA | N | H2 | 62.8° | 64.0° |
| C | CA | N | H | 57.2° | 60.0° |
| C | CA | CB | H6 | 55.2° | 65.0° |
| C | CA | CB | H7 | 62.7° | 55.0° |
| CA | C | OXT | HXT | 177.9° | 180.0° |
| N | CA | C | OXT | 10.5° | 160.0° |
| CA | N | H2 | H | 120.0° | 124.0° |
| N | CA | CB | H6 | 177.0° | 55.0° |
| N | CA | CB | H7 | 59.1° | 175.0° |
| OXT | C | CA | HA | 134.3° | 39.9° |
| H2 | N | CA | HA | 60.6° | 56.1° |
| H | N | CA | HA | 179.4° | 179.9° |
| HA | CA | CB | H6 | 63.0° | 175.0° |
| HA | CA | CB | H7 | 179.1° | 65.0° |
| H8 | CD2 | CE2 | H10 | 1.8° | 0.0° |
