BHD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.45Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CA | CB | sing | 1.53Å | 1.58Å | |
| CA | C | sing | 1.51Å | 1.56Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | OB | sing | 1.43Å | 1.17Å | |
| CB | CG | sing | 1.51Å | 1.49Å | |
| CB | HB | sing | 1.09Å | 1.10Å | |
| OB | HOB | sing | 0.97Å | 0.95Å | |
| CG | OD1 | doub | 1.21Å | 1.19Å | |
| CG | OD2 | sing | 1.34Å | 1.33Å | |
| OD2 | HD2 | sing | 0.97Å | 0.95Å | |
| C | O | doub | 1.21Å | 1.22Å | |
| C | OXT | sing | 1.34Å | 1.34Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | H | 109.5° | 110.9° |
| CA | N | H2 | 109.5° | 111.0° |
| N | CA | CB | 102.1° | 109.4° |
| N | CA | C | 113.3° | 109.5° |
| N | CA | HA | 107.5° | 109.5° |
| H | N | H2 | 109.5° | 111.1° |
| CB | CA | C | 121.0° | 109.5° |
| CB | CA | HA | 106.0° | 109.4° |
| CA | CB | OB | 113.2° | 109.5° |
| CA | CB | CG | 111.2° | 109.5° |
| CA | CB | HB | 106.9° | 109.4° |
| C | CA | HA | 106.2° | 109.5° |
| CA | C | O | 120.3° | 120.0° |
| CA | C | OXT | 118.2° | 120.0° |
| OB | CB | CG | 104.5° | 109.5° |
| OB | CB | HB | 113.0° | 109.5° |
| CB | OB | HOB | 109.5° | 114.0° |
| CG | CB | HB | 107.9° | 109.5° |
| CB | CG | OD1 | 113.6° | 120.0° |
| CB | CG | OD2 | 119.2° | 120.0° |
| OD1 | CG | OD2 | 125.3° | 120.0° |
| CG | OD2 | HD2 | 109.5° | 117.0° |
| O | C | OXT | 121.5° | 120.0° |
| C | OXT | HXT | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 120.0° | 124.0° |
| N | CA | CB | C | 126.9° | 120.0° |
| N | CA | CB | HA | 112.4° | 119.9° |
| N | CA | C | HA | 117.7° | 120.0° |
| N | CA | CB | OB | 63.0° | 65.0° |
| N | CA | CB | CG | 179.6° | 55.0° |
| N | CA | CB | HB | 62.0° | 175.0° |
| N | CA | C | O | 49.3° | 19.9° |
| N | CA | C | OXT | 130.8° | 160.0° |
| H | N | CA | CB | 180.0° | 176.0° |
| H | N | CA | C | 48.2° | 64.0° |
| H | N | CA | HA | 68.7° | 56.1° |
| H2 | N | CA | CB | 60.0° | 60.0° |
| H2 | N | CA | C | 71.8° | 60.0° |
| H2 | N | CA | HA | 171.3° | 179.9° |
| CB | CA | C | HA | 120.6° | 120.0° |
| CA | CB | OB | CG | 121.2° | 120.0° |
| CA | CB | OB | HB | 121.7° | 120.0° |
| CA | CB | CG | HB | 117.0° | 120.0° |
| CA | CB | OB | HOB | 149.8° | 60.0° |
| CA | CB | CG | OD1 | 158.6° | 115.0° |
| CA | CB | CG | OD2 | 6.5° | 65.0° |
| CB | CA | C | O | 72.5° | 100.0° |
| CB | CA | C | OXT | 107.5° | 80.0° |
| C | CA | CB | OB | 170.0° | 55.0° |
| C | CA | CB | CG | 52.7° | 175.0° |
| C | CA | CB | HB | 64.9° | 65.0° |
| CA | C | O | OXT | 180.0° | 180.0° |
| CA | C | OXT | HXT | 180.0° | 179.9° |
| HA | CA | CB | OB | 49.3° | 175.1° |
| HA | CA | CB | CG | 68.0° | 65.0° |
| HA | CA | CB | HB | 174.4° | 55.1° |
| HA | CA | C | O | 166.9° | 140.0° |
| HA | CA | C | OXT | 13.1° | 40.0° |
| OB | CB | CG | HB | 120.5° | 120.0° |
| OB | CB | CG | OD1 | 78.9° | 5.0° |
| OB | CB | CG | OD2 | 116.0° | 175.0° |
| CG | CB | OB | HOB | 28.6° | 60.0° |
| CB | CG | OD1 | OD2 | 164.0° | 180.0° |
| CB | CG | OD2 | HD2 | 163.2° | 179.9° |
| HB | CB | OB | HOB | 88.4° | 179.9° |
| HB | CB | CG | OD1 | 41.6° | 125.0° |
| HB | CB | CG | OD2 | 123.5° | 55.0° |
| OD1 | CG | OD2 | HD2 | 0.0° | 0.1° |
| O | C | OXT | HXT | 0.0° | 0.0° |
