GAU
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 | 1.54Å | |
| CA | C | sing | 1.53Å | 1.52Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | CG | sing | 1.53Å | 1.53Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| CB | HB3 | sing | 1.09Å | 1.10Å | |
| CG | CD | sing | 1.51Å | 1.52Å | |
| CG | HG2 | sing | 1.09Å | 1.10Å | |
| CG | HG3 | sing | 1.09Å | 1.10Å | |
| CD | OE2 | sing | 1.34Å | 1.26Å | |
| CD | OE1 | doub | 1.21Å | 1.24Å | |
| OE2 | HE2 | sing | 0.97Å | 0.95Å | |
| C | O | sing | 1.43Å | 1.41Å | |
| C | HO1 | sing | 1.09Å | 1.10Å | |
| C | HO2 | sing | 1.09Å | 1.10Å | |
| O | OH | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | H | 109.5° | 106.7° |
| CA | N | H2 | 109.5° | 106.7° |
| N | CA | CB | 110.2° | 109.5° |
| N | CA | C | 109.1° | 109.4° |
| N | CA | HA | 109.3° | 109.5° |
| H | N | H2 | 109.4° | 106.7° |
| CB | CA | C | 109.8° | 109.5° |
| CB | CA | HA | 108.6° | 109.5° |
| CA | CB | CG | 114.8° | 109.5° |
| CA | CB | HB2 | 106.5° | 109.4° |
| CA | CB | HB3 | 107.7° | 109.5° |
| C | CA | HA | 109.7° | 109.5° |
| CA | C | O | 110.5° | 109.5° |
| CA | C | HO1 | 108.9° | 109.5° |
| CA | C | HO2 | 109.2° | 109.5° |
| CG | CB | HB2 | 106.5° | 109.5° |
| CG | CB | HB3 | 107.7° | 109.5° |
| CB | CG | CD | 113.1° | 109.5° |
| CB | CG | HG2 | 107.5° | 109.5° |
| CB | CG | HG3 | 108.3° | 109.5° |
| HB2 | CB | HB3 | 113.7° | 109.5° |
| CD | CG | HG2 | 107.4° | 109.4° |
| CD | CG | HG3 | 108.3° | 109.5° |
| CG | CD | OE2 | 120.5° | 120.0° |
| CG | CD | OE1 | 117.0° | 120.0° |
| HG2 | CG | HG3 | 112.3° | 109.5° |
| OE2 | CD | OE1 | 122.5° | 120.0° |
| CD | OE2 | HE2 | 109.5° | 120.0° |
| O | C | HO1 | 108.9° | 109.4° |
| O | C | HO2 | 109.2° | 109.5° |
| C | O | OH | 109.5° | 106.8° |
| HO1 | C | HO2 | 110.2° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 120.0° | 113.8° |
| N | CA | CB | C | 120.2° | 120.0° |
| N | CA | CB | HA | 119.8° | 120.0° |
| N | CA | C | HA | 119.8° | 120.0° |
| N | CA | CB | CG | 170.9° | 65.0° |
| N | CA | CB | HB2 | 71.5° | 55.0° |
| N | CA | CB | HB3 | 50.9° | 175.0° |
| N | CA | C | O | 154.6° | 65.0° |
| N | CA | C | HO1 | 35.0° | 175.0° |
| N | CA | C | HO2 | 85.4° | 55.0° |
| H | N | CA | CB | 106.4° | 173.8° |
| H | N | CA | C | 133.0° | 53.8° |
| H | N | CA | HA | 12.9° | 66.2° |
| H2 | N | CA | CB | 13.6° | 60.0° |
| H2 | N | CA | C | 107.1° | 60.0° |
| H2 | N | CA | HA | 132.9° | 180.0° |
| CB | CA | C | HA | 119.3° | 120.0° |
| CA | CB | CG | HB2 | 117.6° | 119.9° |
| CA | CB | CG | HB3 | 120.0° | 120.0° |
| CA | CB | HB2 | HB3 | 118.5° | 120.0° |
| CA | CB | CG | CD | 167.3° | 180.0° |
| CA | CB | CG | HG2 | 48.8° | 60.0° |
| CA | CB | CG | HG3 | 72.7° | 60.0° |
| CB | CA | C | O | 84.5° | 175.0° |
| CB | CA | C | HO1 | 155.9° | 55.0° |
| CB | CA | C | HO2 | 35.5° | 65.0° |
| C | CA | CB | CG | 68.9° | 175.0° |
| C | CA | CB | HB2 | 48.7° | 65.0° |
| C | CA | CB | HB3 | 171.1° | 55.0° |
| CA | C | O | HO1 | 119.6° | 120.0° |
| CA | C | O | HO2 | 120.0° | 120.1° |
| CA | C | HO1 | HO2 | 119.7° | 120.1° |
| CA | C | O | OH | 102.4° | 180.0° |
| HA | CA | CB | CG | 51.1° | 55.0° |
| HA | CA | CB | HB2 | 168.8° | 174.9° |
| HA | CA | CB | HB3 | 68.9° | 65.0° |
| HA | CA | C | O | 34.8° | 55.0° |
| HA | CA | C | HO1 | 84.7° | 65.0° |
| HA | CA | C | HO2 | 154.9° | 175.0° |
| CG | CB | HB2 | HB3 | 118.5° | 120.0° |
| CB | CG | CD | HG2 | 118.4° | 120.0° |
| CB | CG | CD | HG3 | 120.0° | 120.0° |
| CB | CG | HG2 | HG3 | 119.0° | 120.0° |
| CB | CG | CD | OE2 | 78.1° | 180.0° |
| CB | CG | CD | OE1 | 101.5° | 0.0° |
| HB2 | CB | CG | CD | 75.1° | 60.1° |
| HB2 | CB | CG | HG2 | 166.5° | 180.0° |
| HB2 | CB | CG | HG3 | 44.9° | 59.9° |
| HB3 | CB | CG | CD | 47.3° | 60.0° |
| HB3 | CB | CG | HG2 | 71.1° | 60.0° |
| HB3 | CB | CG | HG3 | 167.3° | 180.0° |
| CD | CG | HG2 | HG3 | 119.0° | 120.0° |
| CG | CD | OE2 | OE1 | 179.6° | 180.0° |
| CG | CD | OE2 | HE2 | 179.6° | 179.9° |
| HG2 | CG | CD | OE2 | 40.3° | 60.0° |
| HG2 | CG | CD | OE1 | 140.1° | 120.0° |
| HG3 | CG | CD | OE2 | 161.8° | 60.0° |
| HG3 | CG | CD | OE1 | 18.5° | 120.0° |
| OE1 | CD | OE2 | HE2 | 0.0° | 0.1° |
| O | C | HO1 | HO2 | 119.7° | 119.9° |
| HO1 | C | O | OH | 17.1° | 60.0° |
| HO2 | C | O | OH | 137.5° | 59.9° |
