05O
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.49Å | |
| C | CA | sing | 1.51Å | 1.53Å | |
| C | O | doub | 1.21Å | 1.25Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CB | CG | sing | 1.51Å | 1.51Å | |
| CG | CD1 | doub | 1.38Å | 1.39Å | Aromatic |
| CG | CD2 | sing | 1.38Å | 1.38Å | Aromatic |
| CD1 | CE1 | sing | 1.38Å | 1.39Å | Aromatic |
| CD2 | CE2 | doub | 1.38Å | 1.38Å | Aromatic |
| CE1 | CZ | doub | 1.39Å | 1.38Å | Aromatic |
| CE2 | CZ | sing | 1.39Å | 1.38Å | Aromatic |
| CZ | OH | sing | 1.36Å | 1.37Å | |
| OH | CT | sing | 1.43Å | 1.43Å | |
| F1 | CT | sing | 1.40Å | 1.35Å | |
| CT | F2 | sing | 1.40Å | 1.35Å | |
| CT | F3 | sing | 1.40Å | 1.35Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CD1 | H4 | sing | 1.08Å | 1.08Å | |
| CE1 | H5 | sing | 1.08Å | 1.08Å | |
| CE2 | H6 | sing | 1.08Å | 1.08Å | |
| CD2 | H7 | sing | 1.08Å | 1.08Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | H10 | sing | 1.09Å | 1.10Å | |
| CB | H11 | sing | 1.09Å | 1.10Å | |
| C | OXT | sing | 1.34Å | 16.82Å | |
| OXT | HXT | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N | CA | C | 109.9° | 109.5° |
| N | CA | CB | 109.8° | 109.5° |
| CA | N | H | 109.5° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| N | CA | HA | 108.9° | 109.5° |
| CA | C | O | 118.2° | 120.0° |
| C | CA | CB | 111.7° | 109.4° |
| C | CA | HA | 108.2° | 109.5° |
| CA | C | OXT | 30.7° | 120.0° |
| O | C | OXT | 94.8° | 120.0° |
| CA | CB | CG | 115.7° | 109.5° |
| CB | CA | HA | 108.3° | 109.5° |
| CA | CB | H10 | 107.9° | 109.5° |
| CA | CB | H11 | 107.9° | 109.5° |
| CB | CG | CD1 | 121.5° | 120.0° |
| CB | CG | CD2 | 120.3° | 119.9° |
| CG | CB | H10 | 107.9° | 109.4° |
| CG | CB | H11 | 107.9° | 109.4° |
| CD1 | CG | CD2 | 118.1° | 120.2° |
| CG | CD1 | CE1 | 121.5° | 120.0° |
| CG | CD1 | H4 | 119.2° | 119.9° |
| CG | CD2 | CE2 | 121.6° | 120.0° |
| CG | CD2 | H7 | 119.2° | 120.0° |
| CD1 | CE1 | CZ | 118.9° | 120.0° |
| CE1 | CD1 | H4 | 119.3° | 120.0° |
| CD1 | CE1 | H5 | 120.5° | 120.0° |
| CD2 | CE2 | CZ | 118.9° | 119.9° |
| CD2 | CE2 | H6 | 120.5° | 120.0° |
| CE2 | CD2 | H7 | 119.2° | 119.9° |
| CE1 | CZ | CE2 | 120.9° | 119.9° |
| CE1 | CZ | OH | 118.5° | 120.1° |
| CZ | CE1 | H5 | 120.6° | 120.0° |
| CE2 | CZ | OH | 120.6° | 120.0° |
| CZ | CE2 | H6 | 120.5° | 120.0° |
| CZ | OH | CT | 119.9° | 117.0° |
| OH | CT | F1 | 114.1° | 109.5° |
| OH | CT | F2 | 110.2° | 109.5° |
| OH | CT | F3 | 109.6° | 109.4° |
| F1 | CT | F2 | 107.8° | 109.5° |
| F1 | CT | F3 | 107.1° | 109.5° |
| F2 | CT | F3 | 107.8° | 109.5° |
| H | N | H2 | 109.5° | 111.0° |
| H10 | CB | H11 | 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) |
| N | CA | C | CB | 122.1° | 120.0° |
| N | CA | C | HA | 118.8° | 120.0° |
| N | CA | C | O | 130.5° | 20.0° |
| N | CA | CB | HA | 118.7° | 120.0° |
| N | CA | CB | CG | 163.6° | 65.0° |
| CA | N | H | H2 | 120.0° | 124.0° |
| N | CA | CB | H10 | 75.5° | 55.0° |
| N | CA | CB | H11 | 42.7° | 175.0° |
| N | CA | C | OXT | 86.3° | 160.0° |
| CA | C | O | OXT | 21.0° | 179.9° |
| C | CA | CB | HA | 119.1° | 120.0° |
| C | CA | CB | CG | 41.4° | 175.0° |
| C | CA | N | H | 180.0° | 60.0° |
| C | CA | N | H2 | 60.0° | 176.1° |
| C | CA | CB | H10 | 162.3° | 65.0° |
| C | CA | CB | H11 | 79.5° | 55.0° |
| CA | C | OXT | HXT | 90.0° | 180.0° |
| O | C | CA | CB | 107.4° | 100.0° |
| O | C | CA | HA | 11.8° | 140.0° |
| O | C | OXT | HXT | 90.0° | 0.0° |
| CA | CB | CG | H10 | 120.9° | 120.0° |
| CA | CB | CG | H11 | 120.9° | 120.0° |
| CA | CB | CG | CD1 | 50.3° | 90.0° |
| CA | CB | CG | CD2 | 129.3° | 90.0° |
| CB | CA | N | H | 56.8° | 60.0° |
| CB | CA | N | H2 | 176.8° | 64.0° |
| CA | CB | H10 | H11 | 117.2° | 120.1° |
| CB | CA | C | OXT | 151.6° | 80.0° |
| CB | CG | CD1 | CD2 | 179.6° | 180.0° |
| CB | CG | CD1 | CE1 | 179.8° | 180.0° |
| CB | CG | CD2 | CE2 | 179.9° | 179.5° |
| CB | CG | CD1 | H4 | 0.2° | 0.3° |
| CB | CG | CD2 | H7 | 0.1° | 0.3° |
| CG | CB | CA | HA | 77.7° | 55.0° |
| CG | CB | H10 | H11 | 117.2° | 119.9° |
| CG | CD1 | CE1 | H4 | 180.0° | 179.7° |
| CD1 | CG | CD2 | CE2 | 0.3° | 0.6° |
| CG | CD1 | CE1 | CZ | 0.3° | 0.3° |
| CG | CD1 | CE1 | H5 | 179.7° | 179.8° |
| CD1 | CG | CD2 | H7 | 179.7° | 179.7° |
| CD1 | CG | CB | H10 | 70.6° | 30.0° |
| CD1 | CG | CB | H11 | 171.1° | 150.0° |
| CD2 | CG | CD1 | CE1 | 0.2° | 0.0° |
| CG | CD2 | CE2 | H7 | 180.0° | 179.1° |
| CG | CD2 | CE2 | CZ | 0.1° | 0.8° |
| CD2 | CG | CD1 | H4 | 179.8° | 179.7° |
| CG | CD2 | CE2 | H6 | 179.9° | 179.8° |
| CD2 | CG | CB | H10 | 109.8° | 150.0° |
| CD2 | CG | CB | H11 | 8.5° | 30.0° |
| CD1 | CE1 | CZ | H5 | 180.0° | 179.9° |
| CD1 | CE1 | CZ | CE2 | 0.7° | 0.0° |
| CD1 | CE1 | CZ | OH | 179.6° | 180.0° |
| CD2 | CE2 | CZ | CE1 | 0.6° | 0.5° |
| CD2 | CE2 | CZ | H6 | 180.0° | 179.4° |
| CD2 | CE2 | CZ | OH | 179.5° | 179.5° |
| CE1 | CZ | CE2 | OH | 178.9° | 180.0° |
| CE1 | CZ | OH | CT | 159.6° | 180.0° |
| CZ | CE1 | CD1 | H4 | 179.7° | 180.0° |
| CE1 | CZ | CE2 | H6 | 179.4° | 179.9° |
| CE2 | CZ | OH | CT | 21.5° | 0.0° |
| CE2 | CZ | CE1 | H5 | 179.3° | 179.9° |
| CZ | CE2 | CD2 | H7 | 179.9° | 180.0° |
| CZ | OH | CT | F1 | 60.3° | 60.0° |
| CZ | OH | CT | F2 | 61.1° | 60.0° |
| CZ | OH | CT | F3 | 179.7° | 180.0° |
| OH | CZ | CE1 | H5 | 0.4° | 0.1° |
| OH | CZ | CE2 | H6 | 0.5° | 0.1° |
| OH | CT | F1 | F2 | 122.7° | 120.0° |
| OH | CT | F1 | F3 | 121.4° | 120.0° |
| OH | CT | F2 | F3 | 119.6° | 120.0° |
| F1 | CT | F2 | F3 | 115.3° | 120.0° |
| H | N | CA | HA | 61.6° | 180.0° |
| H2 | N | CA | HA | 58.4° | 56.1° |
| H4 | CD1 | CE1 | H5 | 0.3° | 0.1° |
| H6 | CE2 | CD2 | H7 | 0.1° | 0.7° |
| HA | CA | CB | H10 | 43.2° | 175.0° |
| HA | CA | CB | H11 | 161.4° | 65.0° |
| HA | CA | C | OXT | 32.5° | 40.0° |
