A1D5P
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OH | CZ | sing | 1.36Å | 1.37Å | |
| CE2 | CZ | doub | 1.39Å | 1.39Å | Aromatic |
| CE2 | CD2 | sing | 1.38Å | 1.38Å | Aromatic |
| CZ | CE1 | sing | 1.39Å | 1.39Å | Aromatic |
| CD2 | CG | doub | 1.38Å | 1.39Å | Aromatic |
| O | C | doub | 1.21Å | 1.23Å | |
| CE1 | CD1 | doub | 1.38Å | 1.39Å | Aromatic |
| CG | CD1 | sing | 1.38Å | 1.39Å | Aromatic |
| CG | CB | sing | 1.51Å | 1.51Å | |
| CA | C | sing | 1.51Å | 1.53Å | |
| CA | N | sing | 1.47Å | 1.45Å | |
| CA | CB | sing | 1.53Å | 1.54Å | |
| CB | OB | sing | 1.43Å | 1.42Å | |
| C | OXT | sing | 1.34Å | 1.34Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| OB | HOB | sing | 0.97Å | 0.95Å | |
| OH | HH | sing | 0.97Å | 0.95Å | |
| CD1 | HD1 | sing | 1.08Å | 1.08Å | |
| CD2 | HD2 | sing | 1.08Å | 1.08Å | |
| CE1 | HE1 | sing | 1.08Å | 1.08Å | |
| CE2 | HE2 | sing | 1.08Å | 1.08Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OH | CZ | CE2 | 118.5° | 120.0° |
| OH | CZ | CE1 | 121.7° | 120.1° |
| CZ | OH | HH | 109.5° | 114.0° |
| CZ | CE2 | CD2 | 119.9° | 119.9° |
| CE2 | CZ | CE1 | 119.7° | 119.9° |
| CZ | CE2 | HE2 | 120.0° | 120.0° |
| CE2 | CD2 | CG | 121.2° | 120.1° |
| CE2 | CD2 | HD2 | 119.4° | 120.0° |
| CD2 | CE2 | HE2 | 120.1° | 120.1° |
| CZ | CE1 | CD1 | 119.8° | 120.0° |
| CZ | CE1 | HE1 | 120.1° | 120.0° |
| CD2 | CG | CD1 | 118.4° | 120.1° |
| CD2 | CG | CB | 120.4° | 120.0° |
| CG | CD2 | HD2 | 119.4° | 120.0° |
| O | C | CA | 120.6° | 120.0° |
| O | C | OXT | 123.0° | 120.0° |
| CE1 | CD1 | CG | 121.1° | 120.0° |
| CE1 | CD1 | HD1 | 119.4° | 120.0° |
| CD1 | CE1 | HE1 | 120.1° | 120.0° |
| CD1 | CG | CB | 121.1° | 119.9° |
| CG | CD1 | HD1 | 119.5° | 119.9° |
| CG | CB | CA | 112.0° | 109.5° |
| CG | CB | OB | 111.0° | 109.4° |
| CG | CB | HB2 | 108.8° | 109.5° |
| C | CA | N | 111.8° | 109.5° |
| C | CA | CB | 107.8° | 109.5° |
| CA | C | OXT | 116.4° | 120.0° |
| C | CA | HA | 108.5° | 109.5° |
| N | CA | CB | 110.8° | 109.5° |
| CA | N | H2 | 109.5° | 111.0° |
| CA | N | H | 109.4° | 111.0° |
| N | CA | HA | 109.5° | 109.5° |
| CA | CB | OB | 106.5° | 109.5° |
| CB | CA | HA | 108.3° | 109.5° |
| CA | CB | HB2 | 108.4° | 109.5° |
| OB | CB | HB2 | 110.0° | 109.5° |
| CB | OB | HOB | 109.5° | 114.0° |
| C | OXT | HXT | 109.5° | 117.0° |
| H2 | N | H | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OH | CZ | CE2 | CE1 | 175.9° | 179.5° |
| OH | CZ | CE2 | CD2 | 175.7° | 179.7° |
| OH | CZ | CE1 | CD1 | 175.6° | 180.0° |
| OH | CZ | CE1 | HE1 | 4.4° | 0.5° |
| OH | CZ | CE2 | HE2 | 4.4° | 0.6° |
| CZ | CE2 | CD2 | HE2 | 180.0° | 179.1° |
| CZ | CE2 | CD2 | CG | 0.0° | 0.6° |
| CE2 | CZ | CE1 | CD1 | 0.2° | 0.5° |
| CE2 | CZ | OH | HH | 180.0° | 89.4° |
| CZ | CE2 | CD2 | HD2 | 180.0° | 179.4° |
| CE2 | CZ | CE1 | HE1 | 179.8° | 179.9° |
| CD2 | CE2 | CZ | CE1 | 0.2° | 0.8° |
| CE2 | CD2 | CG | HD2 | 180.0° | 180.0° |
| CE2 | CD2 | CG | CD1 | 0.3° | 0.0° |
| CE2 | CD2 | CG | CB | 175.2° | 179.7° |
| CZ | CE1 | CD1 | HE1 | 180.0° | 179.6° |
| CZ | CE1 | CD1 | CG | 0.1° | 0.1° |
| CE1 | CZ | OH | HH | 4.2° | 90.0° |
| CZ | CE1 | CD1 | HD1 | 179.9° | 179.9° |
| CE1 | CZ | CE2 | HE2 | 179.7° | 180.0° |
| CD2 | CG | CD1 | CE1 | 0.4° | 0.3° |
| CD2 | CG | CD1 | CB | 175.4° | 179.7° |
| CD2 | CG | CB | CA | 80.8° | 80.3° |
| CD2 | CG | CB | OB | 38.2° | 39.7° |
| CD2 | CG | CB | HB2 | 159.4° | 159.7° |
| CD2 | CG | CD1 | HD1 | 179.6° | 179.7° |
| CG | CD2 | CE2 | HE2 | 180.0° | 179.7° |
| O | C | CA | OXT | 179.5° | 179.7° |
| O | C | CA | N | 131.6° | 19.7° |
| O | C | CA | CB | 106.3° | 100.3° |
| O | C | CA | HA | 10.8° | 139.7° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| CE1 | CD1 | CG | HD1 | 180.0° | 180.0° |
| CE1 | CD1 | CG | CB | 175.1° | 180.0° |
| CD1 | CG | CB | CA | 103.9° | 100.0° |
| CD1 | CG | CB | OB | 137.2° | 140.0° |
| CD1 | CG | CB | HB2 | 16.0° | 20.0° |
| CD1 | CG | CD2 | HD2 | 179.7° | 180.0° |
| CG | CD1 | CE1 | HE1 | 179.9° | 179.5° |
| CG | CB | CA | C | 68.6° | 180.0° |
| CG | CB | CA | N | 168.7° | 60.0° |
| CG | CB | CA | OB | 121.6° | 120.0° |
| CG | CB | CA | HB2 | 120.0° | 120.0° |
| CG | CB | OB | HB2 | 120.5° | 120.0° |
| CG | CB | CA | HA | 48.6° | 60.0° |
| CG | CB | OB | HOB | 180.0° | 60.0° |
| CB | CG | CD1 | HD1 | 4.9° | 0.0° |
| CB | CG | CD2 | HD2 | 4.8° | 0.3° |
| C | CA | N | CB | 120.3° | 120.0° |
| C | CA | N | HA | 120.3° | 120.1° |
| C | CA | CB | HA | 117.2° | 120.0° |
| C | CA | CB | OB | 169.8° | 60.0° |
| C | CA | N | H2 | 180.0° | 176.0° |
| C | CA | N | H | 60.0° | 60.0° |
| C | CA | CB | HB2 | 51.4° | 60.0° |
| CA | C | OXT | HXT | 179.5° | 179.7° |
| N | CA | CB | HA | 120.1° | 120.0° |
| N | CA | CB | OB | 47.1° | 60.0° |
| N | CA | C | OXT | 47.8° | 160.0° |
| CA | N | H2 | H | 120.0° | 124.0° |
| N | CA | CB | HB2 | 71.2° | 180.0° |
| CA | CB | OB | HB2 | 117.4° | 120.1° |
| CB | CA | C | OXT | 74.2° | 80.0° |
| CB | CA | N | H2 | 59.7° | 64.0° |
| CB | CA | N | H | 60.3° | 60.0° |
| CA | CB | OB | HOB | 57.8° | 60.0° |
| OB | CB | CA | HA | 73.0° | 180.0° |
| OXT | C | CA | HA | 168.7° | 40.0° |
| H2 | N | CA | HA | 59.7° | 56.0° |
| H | N | CA | HA | 179.7° | 180.0° |
| HA | CA | CB | HB2 | 168.7° | 60.0° |
| HB2 | CB | OB | HOB | 59.5° | 179.9° |
| HD1 | CD1 | CE1 | HE1 | 0.1° | 0.5° |
| HD2 | CD2 | CE2 | HE2 | 0.0° | 0.3° |
