WLU
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4 | CG1 | sing | 1.43Å | 1.44Å | |
| CG1 | CG | sing | 1.53Å | 1.52Å | |
| CG | CB | sing | 1.53Å | 1.51Å | |
| CG | CG2 | sing | 1.53Å | 1.53Å | |
| O | C | doub | 1.21Å | 1.22Å | |
| CB | CA | sing | 1.53Å | 1.52Å | |
| C | CA | sing | 1.51Å | 1.53Å | |
| C | OXT | sing | 1.34Å | 1.32Å | |
| CA | N | sing | 1.47Å | 1.51Å | |
| CN | N | sing | 1.47Å | 1.46Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| CN | H3 | sing | 1.09Å | 1.10Å | |
| CN | H4 | sing | 1.09Å | 1.10Å | |
| CN | H5 | sing | 1.09Å | 1.10Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | H7 | sing | 1.09Å | 1.10Å | |
| CB | H8 | sing | 1.09Å | 1.10Å | |
| CG | H9 | sing | 1.09Å | 1.10Å | |
| CG1 | H10 | sing | 1.09Å | 1.10Å | |
| CG1 | H11 | sing | 1.09Å | 1.10Å | |
| O4 | H12 | sing | 0.97Å | 0.95Å | |
| CG2 | H13 | sing | 1.09Å | 1.10Å | |
| CG2 | H14 | sing | 1.09Å | 1.10Å | |
| CG2 | 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) |
| O4 | CG1 | CG | 106.8° | 109.5° |
| O4 | CG1 | H10 | 110.1° | 109.4° |
| O4 | CG1 | H11 | 110.1° | 109.4° |
| CG1 | O4 | H12 | 109.5° | 114.0° |
| CG1 | CG | CB | 109.8° | 109.5° |
| CG1 | CG | CG2 | 111.0° | 109.5° |
| CG1 | CG | H9 | 107.6° | 109.5° |
| CG | CG1 | H10 | 110.2° | 109.5° |
| CG | CG1 | H11 | 110.1° | 109.5° |
| CB | CG | CG2 | 112.9° | 109.4° |
| CG | CB | CA | 113.6° | 109.5° |
| CG | CB | H7 | 108.4° | 109.5° |
| CG | CB | H8 | 108.4° | 109.5° |
| CB | CG | H9 | 107.7° | 109.4° |
| CG2 | CG | H9 | 107.5° | 109.5° |
| CG | CG2 | H13 | 109.5° | 109.5° |
| CG | CG2 | H14 | 109.5° | 109.5° |
| CG | CG2 | H15 | 109.5° | 109.5° |
| O | C | CA | 122.1° | 120.1° |
| O | C | OXT | 122.8° | 119.9° |
| CB | CA | C | 112.3° | 109.5° |
| CB | CA | N | 107.4° | 109.5° |
| CB | CA | HA | 109.4° | 109.5° |
| CA | CB | H7 | 108.4° | 109.5° |
| CA | CB | H8 | 108.4° | 109.4° |
| CA | C | OXT | 115.0° | 120.0° |
| C | CA | N | 108.9° | 109.5° |
| C | CA | HA | 109.3° | 109.5° |
| C | OXT | HXT | 109.5° | 117.0° |
| CA | N | CN | 117.8° | 111.0° |
| CA | N | H | 107.3° | 110.9° |
| N | CA | HA | 109.6° | 109.4° |
| CN | N | H | 107.3° | 111.0° |
| N | CN | H3 | 109.5° | 109.4° |
| N | CN | H4 | 109.5° | 109.4° |
| N | CN | H5 | 109.5° | 109.5° |
| H3 | CN | H4 | 109.4° | 109.4° |
| H3 | CN | H5 | 109.5° | 109.6° |
| H4 | CN | H5 | 109.5° | 109.5° |
| H7 | CB | H8 | 109.5° | 109.5° |
| H10 | CG1 | H11 | 109.5° | 109.5° |
| H13 | CG2 | H14 | 109.5° | 109.5° |
| H13 | CG2 | H15 | 109.4° | 109.4° |
| H14 | CG2 | H15 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4 | CG1 | CG | H10 | 119.6° | 120.0° |
| O4 | CG1 | CG | H11 | 119.6° | 120.0° |
| O4 | CG1 | CG | CB | 61.1° | 175.0° |
| O4 | CG1 | CG | CG2 | 173.4° | 65.0° |
| O4 | CG1 | CG | H9 | 55.9° | 55.0° |
| O4 | CG1 | H10 | H11 | 121.2° | 119.9° |
| CG1 | CG | CB | CG2 | 124.5° | 120.0° |
| CG1 | CG | CB | H9 | 117.0° | 120.0° |
| CG1 | CG | CG2 | H9 | 117.5° | 120.1° |
| CG1 | CG | CB | CA | 175.5° | 65.5° |
| CG1 | CG | CB | H7 | 55.0° | 174.5° |
| CG1 | CG | CB | H8 | 63.9° | 54.5° |
| CG | CG1 | H10 | H11 | 121.2° | 120.1° |
| CG | CG1 | O4 | H12 | 180.0° | 180.0° |
| CG1 | CG | CG2 | H13 | 180.0° | 65.0° |
| CG1 | CG | CG2 | H14 | 60.0° | 175.0° |
| CG1 | CG | CG2 | H15 | 60.0° | 55.0° |
| CB | CG | CG2 | H9 | 118.7° | 120.0° |
| CG | CB | CA | H7 | 120.6° | 120.0° |
| CG | CB | CA | H8 | 120.6° | 120.0° |
| CG | CB | CA | C | 63.6° | 175.7° |
| CG | CB | CA | N | 176.8° | 64.3° |
| CG | CB | CA | HA | 57.9° | 55.6° |
| CG | CB | H7 | H8 | 118.1° | 120.0° |
| CB | CG | CG1 | H10 | 58.5° | 65.0° |
| CB | CG | CG1 | H11 | 179.3° | 55.0° |
| CB | CG | CG2 | H13 | 56.2° | 175.0° |
| CB | CG | CG2 | H14 | 63.8° | 55.0° |
| CB | CG | CG2 | H15 | 176.2° | 65.0° |
| CG2 | CG | CB | CA | 60.0° | 174.5° |
| CG2 | CG | CB | H7 | 179.4° | 54.5° |
| CG2 | CG | CB | H8 | 60.6° | 65.5° |
| CG2 | CG | CG1 | H10 | 67.1° | 54.9° |
| CG2 | CG | CG1 | H11 | 53.8° | 175.0° |
| CG | CG2 | H13 | H14 | 120.0° | 120.1° |
| CG | CG2 | H13 | H15 | 120.0° | 120.0° |
| CG | CG2 | H14 | H15 | 120.0° | 120.1° |
| O | C | CA | CB | 10.8° | 94.2° |
| O | C | CA | OXT | 178.8° | 180.0° |
| O | C | CA | N | 107.9° | 25.8° |
| O | C | CA | HA | 132.4° | 145.8° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| CB | CA | C | N | 118.8° | 120.0° |
| CB | CA | C | HA | 121.6° | 120.0° |
| CB | CA | C | OXT | 168.0° | 85.8° |
| CB | CA | N | HA | 118.7° | 120.0° |
| CB | CA | N | CN | 70.8° | 158.2° |
| CB | CA | N | H | 50.4° | 77.9° |
| CA | CB | H7 | H8 | 118.1° | 119.9° |
| CA | CB | CG | H9 | 58.6° | 54.5° |
| C | CA | N | HA | 119.5° | 120.0° |
| C | CA | N | CN | 51.0° | 81.7° |
| C | CA | N | H | 172.2° | 42.1° |
| C | CA | CB | H7 | 57.0° | 64.3° |
| C | CA | CB | H8 | 175.8° | 55.7° |
| CA | C | OXT | HXT | 178.8° | 180.0° |
| OXT | C | CA | N | 73.2° | 154.2° |
| OXT | C | CA | HA | 46.4° | 34.2° |
| CA | N | CN | H | 121.2° | 123.9° |
| CA | N | CN | H3 | 180.0° | 175.1° |
| CA | N | CN | H4 | 60.0° | 65.0° |
| CA | N | CN | H5 | 60.0° | 55.0° |
| N | CA | CB | H7 | 62.6° | 55.7° |
| N | CA | CB | H8 | 56.1° | 175.7° |
| N | CN | H3 | H4 | 120.0° | 119.9° |
| N | CN | H3 | H5 | 120.0° | 120.0° |
| N | CN | H4 | H5 | 120.0° | 120.0° |
| CN | N | CA | HA | 170.5° | 38.2° |
| H | N | CN | H3 | 58.8° | 51.3° |
| H | N | CN | H4 | 178.8° | 171.2° |
| H | N | CN | H5 | 61.2° | 68.8° |
| H | N | CA | HA | 68.3° | 162.1° |
| H3 | CN | H4 | H5 | 120.0° | 120.1° |
| HA | CA | CB | H7 | 178.5° | 175.7° |
| HA | CA | CB | H8 | 62.7° | 64.4° |
| H7 | CB | CG | H9 | 62.0° | 65.5° |
| H8 | CB | CG | H9 | 179.2° | 174.5° |
| H9 | CG | CG1 | H10 | 175.5° | 175.0° |
| H9 | CG | CG1 | H11 | 63.7° | 64.9° |
| H9 | CG | CG2 | H13 | 62.5° | 55.1° |
| H9 | CG | CG2 | H14 | 177.5° | 65.0° |
| H9 | CG | CG2 | H15 | 57.5° | 175.0° |
| H10 | CG1 | O4 | H12 | 60.4° | 60.0° |
| H11 | CG1 | O4 | H12 | 60.4° | 60.0° |
| H13 | CG2 | H14 | H15 | 120.0° | 119.9° |
