J3K
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C3 | C1 | sing | 1.53Å | 1.32Å | |
| CA | C1 | sing | 1.53Å | 1.51Å | |
| CA | N | sing | 1.47Å | 1.47Å | |
| C1 | O1 | sing | 1.43Å | 1.52Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| CA | HA2 | sing | 1.09Å | 1.10Å | |
| CA | HA3 | sing | 1.09Å | 1.10Å | |
| C1 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H31 | sing | 1.09Å | 1.10Å | |
| C3 | H32 | sing | 1.09Å | 1.10Å | |
| O1 | H7 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C3 | C1 | CA | 120.0° | 109.5° |
| C3 | C1 | O1 | 88.2° | 109.5° |
| C3 | C1 | H5 | 105.7° | 109.5° |
| C1 | C3 | H6 | 109.5° | 109.5° |
| C1 | C3 | H31 | 109.5° | 109.5° |
| C1 | C3 | H32 | 109.5° | 109.5° |
| C1 | CA | N | 109.7° | 109.5° |
| CA | C1 | O1 | 132.6° | 109.5° |
| C1 | CA | HA2 | 109.4° | 109.5° |
| C1 | CA | HA3 | 109.4° | 109.5° |
| CA | C1 | H5 | 103.7° | 109.4° |
| CA | N | H2 | 109.5° | 111.0° |
| CA | N | H | 109.5° | 111.0° |
| N | CA | HA2 | 109.4° | 109.5° |
| N | CA | HA3 | 109.4° | 109.4° |
| O1 | C1 | H5 | 103.6° | 109.5° |
| C1 | O1 | H7 | 109.5° | 114.0° |
| H2 | N | H | 109.5° | 111.0° |
| HA2 | CA | HA3 | 109.5° | 109.5° |
| H6 | C3 | H31 | 109.5° | 109.4° |
| H6 | C3 | H32 | 109.4° | 109.5° |
| H31 | C3 | H32 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C3 | C1 | CA | O1 | 118.9° | 120.0° |
| C3 | C1 | CA | H5 | 117.6° | 120.0° |
| C3 | C1 | CA | N | 120.1° | 180.0° |
| C3 | C1 | O1 | H5 | 105.7° | 120.0° |
| C3 | C1 | CA | HA2 | 119.9° | 60.0° |
| C3 | C1 | CA | HA3 | 0.1° | 60.0° |
| C1 | C3 | H6 | H31 | 120.0° | 120.0° |
| C1 | C3 | H6 | H32 | 120.0° | 120.0° |
| C1 | C3 | H31 | H32 | 120.0° | 120.0° |
| C3 | C1 | O1 | H7 | 180.0° | 60.0° |
| C1 | CA | N | HA2 | 120.1° | 120.1° |
| C1 | CA | N | HA3 | 120.0° | 120.0° |
| CA | C1 | O1 | H5 | 123.6° | 119.9° |
| C1 | CA | N | H2 | 180.0° | 56.0° |
| C1 | CA | N | H | 60.0° | 180.0° |
| C1 | CA | HA2 | HA3 | 119.9° | 120.0° |
| CA | C1 | C3 | H6 | 180.0° | 180.0° |
| CA | C1 | C3 | H31 | 60.0° | 60.0° |
| CA | C1 | C3 | H32 | 60.0° | 60.0° |
| CA | C1 | O1 | H7 | 49.3° | 179.9° |
| N | CA | C1 | O1 | 121.0° | 60.0° |
| CA | N | H2 | H | 120.0° | 124.0° |
| N | CA | HA2 | HA3 | 119.9° | 119.9° |
| N | CA | C1 | H5 | 2.5° | 60.0° |
| O1 | C1 | CA | HA2 | 1.0° | 180.0° |
| O1 | C1 | CA | HA3 | 118.9° | 60.0° |
| O1 | C1 | C3 | H6 | 40.1° | 60.0° |
| O1 | C1 | C3 | H31 | 160.1° | 180.0° |
| O1 | C1 | C3 | H32 | 79.8° | 60.0° |
| H2 | N | CA | HA2 | 60.0° | 176.1° |
| H2 | N | CA | HA3 | 59.9° | 64.0° |
| H | N | CA | HA2 | 179.9° | 59.9° |
| H | N | CA | HA3 | 60.0° | 60.0° |
| HA2 | CA | C1 | H5 | 122.6° | 60.0° |
| HA3 | CA | C1 | H5 | 117.5° | 180.0° |
| H5 | C1 | C3 | H6 | 63.5° | 60.0° |
| H5 | C1 | C3 | H31 | 56.5° | 59.9° |
| H5 | C1 | C3 | H32 | 176.6° | 180.0° |
| H5 | C1 | O1 | H7 | 74.3° | 60.0° |
| H6 | C3 | H31 | H32 | 120.0° | 120.0° |
