HTY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | O | doub | 1.21Å | 1.22Å | |
| C | CA | sing | 1.51Å | 1.54Å | |
| C | OXT | sing | 1.34Å | 1.43Å | |
| N | CA | sing | 1.47Å | 1.47Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| CA | CB | sing | 1.53Å | 1.54Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | OB | sing | 1.43Å | 1.43Å | |
| CB | CG | sing | 1.51Å | 1.52Å | |
| CB | HB | sing | 1.09Å | 1.10Å | |
| OB | HOB | sing | 0.97Å | 0.95Å | |
| CG | CD1 | doub | 1.38Å | 1.38Å | Aromatic |
| CG | CD2 | sing | 1.38Å | 1.39Å | Aromatic |
| OH | CZ | sing | 1.36Å | 1.35Å | |
| OH | HOH | sing | 0.97Å | 0.95Å | |
| CZ | CE1 | doub | 1.39Å | 1.39Å | Aromatic |
| CZ | CE2 | sing | 1.39Å | 1.38Å | Aromatic |
| CD1 | CE1 | sing | 1.38Å | 1.39Å | Aromatic |
| CD1 | HD1 | sing | 1.08Å | 1.08Å | |
| CD2 | CE2 | doub | 1.38Å | 1.38Å | Aromatic |
| 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) |
| O | C | CA | 119.7° | 120.1° |
| O | C | OXT | 120.2° | 120.0° |
| CA | C | OXT | 120.2° | 119.9° |
| C | CA | N | 109.8° | 109.4° |
| C | CA | CB | 110.3° | 109.4° |
| C | CA | HA | 107.8° | 109.5° |
| C | OXT | HXT | 109.5° | 117.0° |
| CA | N | H2 | 109.5° | 111.0° |
| CA | N | H | 109.5° | 111.1° |
| N | CA | CB | 112.6° | 109.5° |
| N | CA | HA | 108.6° | 109.5° |
| H2 | N | H | 109.5° | 111.0° |
| CB | CA | HA | 107.7° | 109.5° |
| CA | CB | OB | 107.3° | 109.5° |
| CA | CB | CG | 108.9° | 109.4° |
| CA | CB | HB | 109.5° | 109.5° |
| OB | CB | CG | 110.0° | 109.5° |
| OB | CB | HB | 111.2° | 109.5° |
| CB | OB | HOB | 109.5° | 114.0° |
| CG | CB | HB | 109.9° | 109.5° |
| CB | CG | CD1 | 123.6° | 119.9° |
| CB | CG | CD2 | 116.1° | 120.0° |
| CD1 | CG | CD2 | 120.3° | 120.1° |
| CG | CD1 | CE1 | 119.4° | 120.1° |
| CG | CD1 | HD1 | 120.3° | 120.0° |
| CG | CD2 | CE2 | 120.6° | 120.1° |
| CG | CD2 | HD2 | 119.7° | 120.0° |
| CZ | OH | HOH | 109.5° | 114.0° |
| OH | CZ | CE1 | 120.9° | 120.0° |
| OH | CZ | CE2 | 118.3° | 120.1° |
| CE1 | CZ | CE2 | 120.7° | 119.9° |
| CZ | CE1 | CD1 | 119.7° | 119.9° |
| CZ | CE1 | HE1 | 120.2° | 120.1° |
| CZ | CE2 | CD2 | 119.4° | 119.9° |
| CZ | CE2 | HE2 | 120.3° | 120.0° |
| CE1 | CD1 | HD1 | 120.3° | 120.0° |
| CD1 | CE1 | HE1 | 120.2° | 120.0° |
| CE2 | CD2 | HD2 | 119.7° | 119.9° |
| CD2 | CE2 | HE2 | 120.3° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | CA | OXT | 180.0° | 179.7° |
| O | C | CA | N | 171.1° | 20.0° |
| O | C | CA | CB | 64.3° | 100.0° |
| O | C | CA | HA | 53.0° | 140.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| C | CA | N | CB | 123.3° | 119.9° |
| C | CA | N | HA | 117.6° | 120.0° |
| C | CA | N | H2 | 180.0° | 176.1° |
| C | CA | N | H | 60.0° | 60.0° |
| C | CA | CB | HA | 117.3° | 120.0° |
| C | CA | CB | OB | 176.8° | 60.1° |
| C | CA | CB | CG | 57.8° | 180.0° |
| C | CA | CB | HB | 62.3° | 60.0° |
| CA | C | OXT | HXT | 180.0° | 179.7° |
| OXT | C | CA | N | 9.0° | 159.8° |
| OXT | C | CA | CB | 115.7° | 80.3° |
| OXT | C | CA | HA | 127.0° | 39.8° |
| CA | N | H2 | H | 120.0° | 124.0° |
| N | CA | CB | HA | 119.6° | 120.1° |
| N | CA | CB | OB | 53.8° | 180.0° |
| N | CA | CB | CG | 65.2° | 60.1° |
| N | CA | CB | HB | 174.7° | 59.9° |
| H2 | N | CA | CB | 56.7° | 64.0° |
| H2 | N | CA | HA | 62.4° | 56.1° |
| H | N | CA | CB | 63.3° | 60.0° |
| H | N | CA | HA | 177.6° | 180.0° |
| CA | CB | OB | CG | 118.3° | 119.9° |
| CA | CB | OB | HB | 119.8° | 120.0° |
| CA | CB | CG | HB | 119.9° | 120.0° |
| CA | CB | OB | HOB | 180.0° | 60.0° |
| CA | CB | CG | CD1 | 79.2° | 95.0° |
| CA | CB | CG | CD2 | 99.7° | 84.7° |
| HA | CA | CB | OB | 65.8° | 60.0° |
| HA | CA | CB | CG | 175.2° | 60.0° |
| HA | CA | CB | HB | 55.0° | 180.0° |
| OB | CB | CG | HB | 122.7° | 120.0° |
| OB | CB | CG | CD1 | 38.2° | 145.0° |
| OB | CB | CG | CD2 | 143.0° | 35.3° |
| CG | CB | OB | HOB | 61.6° | 59.9° |
| CB | CG | CD1 | CD2 | 178.8° | 179.7° |
| CB | CG | CD1 | CE1 | 178.4° | 180.0° |
| CB | CG | CD1 | HD1 | 1.6° | 0.1° |
| CB | CG | CD2 | CE2 | 178.6° | 180.0° |
| CB | CG | CD2 | HD2 | 1.4° | 0.0° |
| HB | CB | OB | HOB | 60.3° | 180.0° |
| HB | CB | CG | CD1 | 160.9° | 25.0° |
| HB | CB | CG | CD2 | 20.3° | 155.3° |
| CG | CD1 | CE1 | CZ | 0.3° | 0.0° |
| CG | CD1 | CE1 | HD1 | 180.0° | 179.9° |
| CD1 | CG | CD2 | CE2 | 0.3° | 0.3° |
| CD1 | CG | CD2 | HD2 | 179.6° | 179.7° |
| CG | CD1 | CE1 | HE1 | 179.7° | 179.7° |
| CG | CD2 | CE2 | CZ | 0.1° | 0.0° |
| CD2 | CG | CD1 | CE1 | 0.4° | 0.3° |
| CD2 | CG | CD1 | HD1 | 179.5° | 179.8° |
| CG | CD2 | CE2 | HD2 | 180.0° | 180.0° |
| CG | CD2 | CE2 | HE2 | 180.0° | 179.8° |
| OH | CZ | CE1 | CE2 | 179.7° | 179.7° |
| OH | CZ | CE1 | CD1 | 179.7° | 180.0° |
| OH | CZ | CE2 | CD2 | 179.6° | 180.0° |
| OH | CZ | CE1 | HE1 | 0.3° | 0.3° |
| OH | CZ | CE2 | HE2 | 0.5° | 0.2° |
| HOH | OH | CZ | CE1 | 180.0° | 90.0° |
| HOH | OH | CZ | CE2 | 0.3° | 89.7° |
| CZ | CE1 | CD1 | HE1 | 180.0° | 179.7° |
| CZ | CE1 | CD1 | HD1 | 179.7° | 179.9° |
| CE1 | CZ | CE2 | CD2 | 0.1° | 0.3° |
| CE1 | CZ | CE2 | HE2 | 179.9° | 180.0° |
| CE2 | CZ | CE1 | CD1 | 0.0° | 0.3° |
| CZ | CE2 | CD2 | HE2 | 180.0° | 179.8° |
| CZ | CE2 | CD2 | HD2 | 179.9° | 180.0° |
| CE2 | CZ | CE1 | HE1 | 180.0° | 180.0° |
| HD1 | CD1 | CE1 | HE1 | 0.3° | 0.2° |
| HD2 | CD2 | CE2 | HE2 | 0.1° | 0.2° |
