ABU
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CD | sing | 1.47Å | 1.49Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CD | CB | sing | 1.53Å | 1.52Å | |
| CD | HA1 | sing | 1.09Å | 1.10Å | |
| CD | HA2 | sing | 1.09Å | 1.10Å | |
| CB | CG | sing | 1.53Å | 1.53Å | |
| CB | HB1 | sing | 1.09Å | 1.10Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| CG | C | sing | 1.51Å | 1.53Å | |
| CG | HG1 | sing | 1.09Å | 1.10Å | |
| CG | HG2 | sing | 1.09Å | 1.10Å | |
| C | O | doub | 1.21Å | 1.23Å | |
| 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) |
| CD | N | H | 109.5° | 111.0° |
| CD | N | H2 | 109.5° | 111.0° |
| N | CD | CB | 112.6° | 109.5° |
| N | CD | HA1 | 108.4° | 109.4° |
| N | CD | HA2 | 108.4° | 109.5° |
| H | N | H2 | 109.5° | 111.0° |
| CB | CD | HA1 | 108.4° | 109.5° |
| CB | CD | HA2 | 108.4° | 109.5° |
| CD | CB | CG | 114.1° | 109.5° |
| CD | CB | HB1 | 108.0° | 109.4° |
| CD | CB | HB2 | 108.0° | 109.4° |
| HA1 | CD | HA2 | 110.5° | 109.5° |
| CG | CB | HB1 | 108.0° | 109.5° |
| CG | CB | HB2 | 108.0° | 109.5° |
| CB | CG | C | 110.4° | 109.5° |
| CB | CG | HG1 | 109.2° | 109.5° |
| CB | CG | HG2 | 109.2° | 109.4° |
| HB1 | CB | HB2 | 110.9° | 109.5° |
| C | CG | HG1 | 109.1° | 109.5° |
| C | CG | HG2 | 109.2° | 109.5° |
| CG | C | O | 120.8° | 120.0° |
| CG | C | OXT | 119.2° | 120.0° |
| HG1 | CG | HG2 | 109.8° | 109.5° |
| O | C | OXT | 120.0° | 120.0° |
| C | OXT | HXT | 109.5° | 117.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CD | N | H | H2 | 120.0° | 124.0° |
| N | CD | CB | HA1 | 120.0° | 119.9° |
| N | CD | CB | HA2 | 120.0° | 120.0° |
| N | CD | HA1 | HA2 | 118.7° | 120.0° |
| N | CD | CB | CG | 171.0° | 180.0° |
| N | CD | CB | HB1 | 51.0° | 60.0° |
| N | CD | CB | HB2 | 69.0° | 60.0° |
| H | N | CD | CB | 180.0° | 56.0° |
| H | N | CD | HA1 | 60.0° | 176.0° |
| H | N | CD | HA2 | 60.0° | 64.0° |
| H2 | N | CD | CB | 60.0° | 180.0° |
| H2 | N | CD | HA1 | 60.0° | 60.1° |
| H2 | N | CD | HA2 | 180.0° | 59.9° |
| CB | CD | HA1 | HA2 | 118.7° | 120.0° |
| CD | CB | CG | HB1 | 120.0° | 120.0° |
| CD | CB | CG | HB2 | 120.0° | 120.0° |
| CD | CB | HB1 | HB2 | 118.1° | 120.0° |
| CD | CB | CG | C | 75.1° | 180.0° |
| CD | CB | CG | HG1 | 164.9° | 60.0° |
| CD | CB | CG | HG2 | 44.9° | 60.0° |
| HA1 | CD | CB | CG | 69.0° | 60.0° |
| HA1 | CD | CB | HB1 | 171.0° | 180.0° |
| HA1 | CD | CB | HB2 | 51.0° | 60.0° |
| HA2 | CD | CB | CG | 51.0° | 60.0° |
| HA2 | CD | CB | HB1 | 69.0° | 60.0° |
| HA2 | CD | CB | HB2 | 171.0° | 180.0° |
| CG | CB | HB1 | HB2 | 118.1° | 120.1° |
| CB | CG | C | HG1 | 120.0° | 120.0° |
| CB | CG | C | HG2 | 120.0° | 119.9° |
| CB | CG | HG1 | HG2 | 119.7° | 120.0° |
| CB | CG | C | O | 51.1° | 0.0° |
| CB | CG | C | OXT | 128.6° | 180.0° |
| HB1 | CB | CG | C | 44.9° | 60.0° |
| HB1 | CB | CG | HG1 | 75.1° | 180.0° |
| HB1 | CB | CG | HG2 | 164.9° | 60.0° |
| HB2 | CB | CG | C | 164.9° | 60.1° |
| HB2 | CB | CG | HG1 | 44.9° | 60.0° |
| HB2 | CB | CG | HG2 | 75.1° | 180.0° |
| C | CG | HG1 | HG2 | 119.6° | 120.0° |
| CG | C | O | OXT | 179.7° | 180.0° |
| CG | C | OXT | HXT | 179.8° | 179.9° |
| HG1 | CG | C | O | 68.9° | 120.0° |
| HG1 | CG | C | OXT | 111.4° | 60.0° |
| HG2 | CG | C | O | 171.1° | 120.0° |
| HG2 | CG | C | OXT | 8.6° | 60.1° |
| O | C | OXT | HXT | 0.0° | 0.0° |
