UXY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N08 | C07 | sing | 1.47Å | 1.45Å | |
| C07 | C06 | sing | 1.53Å | 1.52Å | |
| C06 | C04 | sing | 1.53Å | 1.52Å | |
| O05 | C04 | sing | 1.43Å | 1.40Å | |
| C03 | C04 | sing | 1.53Å | 1.52Å | |
| C03 | CA | sing | 1.53Å | 1.51Å | |
| O | C | doub | 1.21Å | 1.25Å | |
| C | CA | sing | 1.51Å | 1.55Å | |
| CA | N | sing | 1.47Å | 1.46Å | |
| C | OXT | sing | 1.34Å | 1.30Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| C03 | H5 | sing | 1.09Å | 1.10Å | |
| C03 | H6 | sing | 1.09Å | 1.10Å | |
| C04 | H7 | sing | 1.09Å | 1.10Å | |
| C06 | H8 | sing | 1.09Å | 1.10Å | |
| C06 | H9 | sing | 1.09Å | 1.10Å | |
| C07 | H10 | sing | 1.09Å | 1.10Å | |
| C07 | H11 | sing | 1.09Å | 1.10Å | |
| N08 | H12 | sing | 1.01Å | 1.00Å | |
| N08 | H13 | sing | 1.01Å | 1.00Å | |
| O05 | H15 | sing | 0.97Å | 0.95Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N08 | C07 | C06 | 108.5° | 109.5° |
| N08 | C07 | H10 | 109.7° | 109.5° |
| N08 | C07 | H11 | 109.7° | 109.4° |
| C07 | N08 | H12 | 109.5° | 111.0° |
| C07 | N08 | H13 | 109.4° | 111.0° |
| C07 | C06 | C04 | 109.1° | 109.5° |
| C07 | C06 | H8 | 109.6° | 109.5° |
| C07 | C06 | H9 | 109.6° | 109.4° |
| C06 | C07 | H10 | 109.7° | 109.5° |
| C06 | C07 | H11 | 109.7° | 109.5° |
| C06 | C04 | O05 | 104.5° | 109.5° |
| C06 | C04 | C03 | 110.7° | 109.5° |
| C06 | C04 | H7 | 109.4° | 109.4° |
| C04 | C06 | H8 | 109.5° | 109.5° |
| C04 | C06 | H9 | 109.6° | 109.5° |
| O05 | C04 | C03 | 111.8° | 109.5° |
| O05 | C04 | H7 | 111.1° | 109.5° |
| C04 | O05 | H15 | 109.5° | 114.0° |
| C04 | C03 | CA | 108.6° | 109.5° |
| C04 | C03 | H5 | 109.7° | 109.5° |
| C04 | C03 | H6 | 109.7° | 109.5° |
| C03 | C04 | H7 | 109.3° | 109.4° |
| C03 | CA | C | 112.0° | 109.4° |
| C03 | CA | N | 107.1° | 109.5° |
| C03 | CA | HA | 107.9° | 109.4° |
| CA | C03 | H5 | 109.7° | 109.5° |
| CA | C03 | H6 | 109.7° | 109.5° |
| O | C | CA | 118.1° | 120.0° |
| O | C | OXT | 125.4° | 120.0° |
| C | CA | N | 113.9° | 109.5° |
| CA | C | OXT | 116.3° | 120.0° |
| C | CA | HA | 107.3° | 109.5° |
| CA | N | H | 109.5° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| N | CA | HA | 108.5° | 109.5° |
| C | OXT | HXT | 109.5° | 117.0° |
| H | N | H2 | 109.4° | 111.0° |
| H5 | C03 | H6 | 109.5° | 109.4° |
| H8 | C06 | H9 | 109.5° | 109.4° |
| H10 | C07 | H11 | 109.5° | 109.4° |
| H12 | N08 | H13 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N08 | C07 | C06 | H10 | 119.8° | 120.0° |
| N08 | C07 | C06 | H11 | 119.8° | 120.0° |
| N08 | C07 | C06 | C04 | 176.3° | 180.0° |
| N08 | C07 | C06 | H8 | 63.8° | 60.0° |
| N08 | C07 | C06 | H9 | 56.3° | 60.0° |
| N08 | C07 | H10 | H11 | 120.4° | 120.0° |
| C07 | N08 | H12 | H13 | 120.0° | 124.0° |
| C07 | C06 | C04 | H8 | 119.9° | 120.0° |
| C07 | C06 | C04 | H9 | 119.9° | 119.9° |
| C07 | C06 | C04 | O05 | 14.5° | 65.0° |
| C07 | C06 | C04 | C03 | 106.0° | 175.0° |
| C07 | C06 | C04 | H7 | 133.5° | 55.1° |
| C07 | C06 | H8 | H9 | 120.2° | 119.9° |
| C06 | C07 | H10 | H11 | 120.5° | 120.0° |
| C06 | C07 | N08 | H12 | 180.0° | 56.0° |
| C06 | C07 | N08 | H13 | 60.0° | 180.0° |
| C06 | C04 | O05 | C03 | 119.7° | 120.0° |
| C06 | C04 | O05 | H7 | 117.8° | 120.0° |
| C06 | C04 | C03 | H7 | 120.5° | 119.9° |
| C06 | C04 | C03 | CA | 162.4° | 174.9° |
| C06 | C04 | C03 | H5 | 77.8° | 54.9° |
| C06 | C04 | C03 | H6 | 42.5° | 65.1° |
| C04 | C06 | H8 | H9 | 120.2° | 120.0° |
| C04 | C06 | C07 | H10 | 56.4° | 59.9° |
| C04 | C06 | C07 | H11 | 63.9° | 60.0° |
| C06 | C04 | O05 | H15 | 180.0° | 60.0° |
| O05 | C04 | C03 | H7 | 123.4° | 120.1° |
| O05 | C04 | C03 | CA | 81.5° | 65.0° |
| O05 | C04 | C03 | H5 | 38.3° | 175.0° |
| O05 | C04 | C03 | H6 | 158.6° | 55.0° |
| O05 | C04 | C06 | H8 | 134.4° | 175.0° |
| O05 | C04 | C06 | H9 | 105.5° | 55.0° |
| C04 | C03 | CA | H5 | 119.8° | 120.0° |
| C04 | C03 | CA | H6 | 119.9° | 120.0° |
| C04 | C03 | CA | C | 171.4° | 175.0° |
| C04 | C03 | CA | N | 63.0° | 65.0° |
| C04 | C03 | CA | HA | 53.6° | 55.0° |
| C04 | C03 | H5 | H6 | 120.4° | 120.0° |
| C03 | C04 | C06 | H8 | 13.9° | 55.0° |
| C03 | C04 | C06 | H9 | 134.0° | 65.1° |
| C03 | C04 | O05 | H15 | 60.3° | 60.0° |
| C03 | CA | C | O | 88.0° | 100.1° |
| C03 | CA | C | N | 121.7° | 120.0° |
| C03 | CA | C | HA | 118.2° | 119.9° |
| C03 | CA | N | HA | 116.2° | 120.0° |
| C03 | CA | C | OXT | 97.2° | 80.0° |
| C03 | CA | N | H | 180.0° | 60.0° |
| C03 | CA | N | H2 | 60.0° | 63.9° |
| CA | C03 | H5 | H6 | 120.4° | 120.0° |
| CA | C03 | C04 | H7 | 41.9° | 55.0° |
| O | C | CA | OXT | 174.8° | 179.9° |
| O | C | CA | N | 150.3° | 19.9° |
| O | C | CA | HA | 30.2° | 140.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| C | CA | N | HA | 119.4° | 120.1° |
| C | CA | N | H | 55.5° | 60.0° |
| C | CA | N | H2 | 64.4° | 176.1° |
| C | CA | C03 | H5 | 51.6° | 65.0° |
| C | CA | C03 | H6 | 68.7° | 55.0° |
| CA | C | OXT | HXT | 174.3° | 179.9° |
| N | CA | C | OXT | 24.5° | 160.0° |
| CA | N | H | H2 | 120.0° | 123.9° |
| N | CA | C03 | H5 | 177.1° | 55.0° |
| N | CA | C03 | H6 | 56.8° | 175.0° |
| OXT | C | CA | HA | 144.6° | 39.9° |
| H | N | CA | HA | 63.8° | 180.0° |
| H2 | N | CA | HA | 176.2° | 56.0° |
| HA | CA | C03 | H5 | 66.3° | 175.1° |
| HA | CA | C03 | H6 | 173.4° | 65.0° |
| H5 | C03 | C04 | H7 | 161.7° | 65.0° |
| H6 | C03 | C04 | H7 | 78.0° | 175.0° |
| H7 | C04 | C06 | H8 | 106.6° | 64.9° |
| H7 | C04 | C06 | H9 | 13.5° | 175.0° |
| H7 | C04 | O05 | H15 | 62.1° | 180.0° |
| H8 | C06 | C07 | H10 | 176.4° | 180.0° |
| H8 | C06 | C07 | H11 | 56.0° | 60.0° |
| H9 | C06 | C07 | H10 | 63.5° | 60.1° |
| H9 | C06 | C07 | H11 | 176.1° | 180.0° |
| H10 | C07 | N08 | H12 | 60.2° | 64.0° |
| H10 | C07 | N08 | H13 | 59.9° | 60.0° |
| H11 | C07 | N08 | H12 | 60.2° | 176.0° |
| H11 | C07 | N08 | H13 | 179.8° | 60.0° |
