WZJ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CD1 | CG1 | sing | 1.53Å | 1.53Å | |
| CG1 | CB | sing | 1.53Å | 1.54Å | |
| CA | C | sing | 1.51Å | 1.51Å | |
| CA | CB | sing | 1.53Å | 1.56Å | |
| CA | N | sing | 1.47Å | 1.47Å | |
| C | O | doub | 1.21Å | 1.22Å | |
| CG2 | CB | sing | 1.53Å | 1.54Å | |
| N | CN | sing | 1.47Å | 1.46Å | |
| C | OXT | sing | 1.34Å | 1.33Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | H4 | sing | 1.09Å | 1.10Å | |
| CN | H5 | sing | 1.09Å | 1.10Å | |
| CN | H6 | sing | 1.09Å | 1.10Å | |
| CN | H7 | sing | 1.09Å | 1.10Å | |
| CG2 | H8 | sing | 1.09Å | 1.10Å | |
| CG2 | H9 | sing | 1.09Å | 1.10Å | |
| CG2 | H10 | sing | 1.09Å | 1.10Å | |
| CG1 | H11 | sing | 1.09Å | 1.10Å | |
| CG1 | H12 | sing | 1.09Å | 1.10Å | |
| CD1 | H13 | sing | 1.09Å | 1.10Å | |
| CD1 | H14 | sing | 1.09Å | 1.10Å | |
| CD1 | H15 | sing | 1.09Å | 1.10Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CD1 | CG1 | CB | 112.6° | 109.5° |
| CD1 | CG1 | H11 | 108.7° | 109.5° |
| CD1 | CG1 | H12 | 108.7° | 109.5° |
| CG1 | CD1 | H13 | 109.5° | 109.4° |
| CG1 | CD1 | H14 | 109.4° | 109.5° |
| CG1 | CD1 | H15 | 109.5° | 109.4° |
| CG1 | CB | CA | 108.4° | 109.5° |
| CG1 | CB | CG2 | 113.5° | 109.4° |
| CG1 | CB | H4 | 108.3° | 109.5° |
| CB | CG1 | H11 | 108.7° | 109.4° |
| CB | CG1 | H12 | 108.7° | 109.5° |
| C | CA | CB | 109.7° | 109.5° |
| C | CA | N | 111.5° | 109.4° |
| CA | C | O | 121.0° | 120.0° |
| CA | C | OXT | 114.2° | 119.9° |
| C | CA | HA | 108.7° | 109.5° |
| CB | CA | N | 109.4° | 109.5° |
| CA | CB | CG2 | 109.9° | 109.5° |
| CB | CA | HA | 108.1° | 109.5° |
| CA | CB | H4 | 108.1° | 109.5° |
| CA | N | CN | 118.8° | 111.0° |
| CA | N | H | 107.1° | 111.0° |
| N | CA | HA | 109.3° | 109.5° |
| O | C | OXT | 124.8° | 120.0° |
| CG2 | CB | H4 | 108.5° | 109.5° |
| CB | CG2 | H8 | 109.5° | 109.5° |
| CB | CG2 | H9 | 109.5° | 109.4° |
| CB | CG2 | H10 | 109.5° | 109.4° |
| CN | N | H | 107.1° | 111.0° |
| N | CN | H5 | 109.5° | 109.5° |
| N | CN | H6 | 109.5° | 109.5° |
| N | CN | H7 | 109.5° | 109.4° |
| C | OXT | HXT | 109.5° | 117.0° |
| H5 | CN | H6 | 109.4° | 109.4° |
| H5 | CN | H7 | 109.5° | 109.4° |
| H6 | CN | H7 | 109.5° | 109.5° |
| H8 | CG2 | H9 | 109.4° | 109.5° |
| H8 | CG2 | H10 | 109.5° | 109.5° |
| H9 | CG2 | H10 | 109.4° | 109.5° |
| H11 | CG1 | H12 | 109.5° | 109.5° |
| H13 | CD1 | H14 | 109.4° | 109.5° |
| H13 | CD1 | H15 | 109.5° | 109.5° |
| H14 | CD1 | H15 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CD1 | CG1 | CB | H11 | 120.5° | 120.0° |
| CD1 | CG1 | CB | H12 | 120.5° | 120.0° |
| CD1 | CG1 | CB | CA | 150.6° | 175.0° |
| CD1 | CG1 | CB | CG2 | 28.2° | 65.0° |
| CD1 | CG1 | CB | H4 | 92.3° | 55.0° |
| CD1 | CG1 | H11 | H12 | 118.6° | 120.0° |
| CG1 | CD1 | H13 | H14 | 120.0° | 120.0° |
| CG1 | CD1 | H13 | H15 | 120.0° | 120.0° |
| CG1 | CD1 | H14 | H15 | 120.0° | 120.0° |
| CG1 | CB | CA | C | 51.5° | 175.0° |
| CG1 | CB | CA | CG2 | 124.5° | 119.9° |
| CG1 | CB | CA | H4 | 117.2° | 120.1° |
| CG1 | CB | CA | N | 174.2° | 65.0° |
| CG1 | CB | CG2 | H4 | 120.5° | 120.1° |
| CG1 | CB | CA | HA | 66.9° | 55.0° |
| CG1 | CB | CG2 | H8 | 180.0° | 61.9° |
| CG1 | CB | CG2 | H9 | 60.0° | 178.1° |
| CG1 | CB | CG2 | H10 | 60.0° | 58.1° |
| CB | CG1 | H11 | H12 | 118.5° | 120.0° |
| CB | CG1 | CD1 | H13 | 180.0° | 60.0° |
| CB | CG1 | CD1 | H14 | 60.0° | 60.0° |
| CB | CG1 | CD1 | H15 | 60.0° | 180.0° |
| C | CA | CB | N | 122.7° | 120.0° |
| C | CA | CB | HA | 118.4° | 120.0° |
| C | CA | N | HA | 120.2° | 120.0° |
| CA | C | O | OXT | 179.0° | 180.0° |
| C | CA | CB | CG2 | 176.0° | 65.1° |
| C | CA | N | CN | 72.4° | 86.5° |
| C | CA | N | H | 166.3° | 37.5° |
| C | CA | CB | H4 | 65.7° | 54.9° |
| CA | C | OXT | HXT | 179.1° | 180.0° |
| CB | CA | N | HA | 118.2° | 120.0° |
| CB | CA | C | O | 65.1° | 98.7° |
| CA | CB | CG2 | H4 | 118.0° | 120.0° |
| CB | CA | N | CN | 49.2° | 153.5° |
| CB | CA | C | OXT | 114.0° | 81.3° |
| CB | CA | N | H | 72.1° | 82.5° |
| CA | CB | CG2 | H8 | 58.5° | 58.0° |
| CA | CB | CG2 | H9 | 178.5° | 62.0° |
| CA | CB | CG2 | H10 | 61.5° | 178.0° |
| CA | CB | CG1 | H11 | 30.1° | 55.0° |
| CA | CB | CG1 | H12 | 88.9° | 65.0° |
| N | CA | C | O | 56.3° | 21.3° |
| N | CA | CB | CG2 | 61.3° | 54.9° |
| CA | N | CN | H | 121.3° | 124.0° |
| N | CA | C | OXT | 124.6° | 158.7° |
| N | CA | CB | H4 | 56.9° | 174.9° |
| CA | N | CN | H5 | 180.0° | 175.2° |
| CA | N | CN | H6 | 60.0° | 64.8° |
| CA | N | CN | H7 | 60.0° | 55.3° |
| O | C | CA | HA | 176.9° | 141.3° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| CG2 | CB | CA | HA | 57.6° | 174.9° |
| CB | CG2 | H8 | H9 | 120.0° | 120.0° |
| CB | CG2 | H8 | H10 | 120.0° | 120.0° |
| CB | CG2 | H9 | H10 | 120.0° | 120.0° |
| CG2 | CB | CG1 | H11 | 92.2° | 175.0° |
| CG2 | CB | CG1 | H12 | 148.7° | 55.0° |
| CN | N | CA | HA | 167.3° | 33.5° |
| N | CN | H5 | H6 | 120.0° | 120.0° |
| N | CN | H5 | H7 | 120.0° | 119.9° |
| N | CN | H6 | H7 | 120.0° | 120.0° |
| OXT | C | CA | HA | 4.0° | 38.7° |
| H | N | CA | HA | 46.0° | 157.5° |
| H | N | CN | H5 | 58.7° | 51.3° |
| H | N | CN | H6 | 178.7° | 171.3° |
| H | N | CN | H7 | 61.3° | 68.6° |
| HA | CA | CB | H4 | 175.9° | 65.1° |
| H4 | CB | CG2 | H8 | 59.5° | 178.0° |
| H4 | CB | CG2 | H9 | 60.5° | 58.0° |
| H4 | CB | CG2 | H10 | 179.6° | 62.0° |
| H4 | CB | CG1 | H11 | 147.2° | 65.0° |
| H4 | CB | CG1 | H12 | 28.2° | 175.0° |
| H5 | CN | H6 | H7 | 120.0° | 120.0° |
| H8 | CG2 | H9 | H10 | 120.0° | 120.1° |
| H11 | CG1 | CD1 | H13 | 59.5° | 180.0° |
| H11 | CG1 | CD1 | H14 | 60.5° | 60.0° |
| H11 | CG1 | CD1 | H15 | 179.6° | 60.0° |
| H12 | CG1 | CD1 | H13 | 59.6° | 60.0° |
| H12 | CG1 | CD1 | H14 | 179.6° | 180.0° |
| H12 | CG1 | CD1 | H15 | 60.5° | 60.0° |
| H13 | CD1 | H14 | H15 | 120.0° | 120.1° |
