XCP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CB | N | sing | 1.47Å | 1.47Å | |
| CB | CG | sing | 1.54Å | 1.53Å | |
| CG | HGA | sing | 1.09Å | 1.10Å | |
| CD | CG | sing | 1.54Å | 1.53Å | |
| CD | HD | sing | 1.09Å | 1.10Å | |
| CE | CD | sing | 1.55Å | 1.56Å | |
| CE | CA | sing | 1.55Å | 1.54Å | |
| CE | HE | sing | 1.09Å | 1.10Å | |
| CA | CB | sing | 1.54Å | 1.57Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| C | CA | sing | 1.51Å | 1.53Å | |
| C | OXT | sing | 1.34Å | 1.43Å | |
| O | C | doub | 1.21Å | 1.20Å | |
| HB | CB | sing | 1.09Å | 1.10Å | |
| HG | CG | sing | 1.09Å | 1.10Å | |
| HDA | CD | sing | 1.09Å | 1.10Å | |
| HEA | CE | 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) |
| H | N | H2 | 109.5° | 111.0° |
| H | N | CB | 109.5° | 111.0° |
| H2 | N | CB | 109.5° | 111.0° |
| N | CB | CG | 114.7° | 110.1° |
| N | CB | CA | 111.1° | 110.0° |
| N | CB | HB | 109.8° | 110.0° |
| CB | CG | HGA | 110.5° | 110.0° |
| CB | CG | CD | 105.3° | 106.6° |
| CG | CB | CA | 103.5° | 106.6° |
| CG | CB | HB | 109.0° | 110.0° |
| CB | CG | HG | 110.5° | 110.1° |
| HGA | CG | CD | 110.5° | 110.0° |
| HGA | CG | HG | 109.5° | 110.0° |
| CG | CD | HD | 110.2° | 110.5° |
| CG | CD | CE | 106.5° | 104.2° |
| CD | CG | HG | 110.5° | 110.1° |
| CG | CD | HDA | 110.2° | 110.5° |
| HD | CD | CE | 110.2° | 110.5° |
| HD | CD | HDA | 109.5° | 110.4° |
| CD | CE | CA | 106.6° | 102.8° |
| CD | CE | HE | 110.2° | 110.8° |
| CE | CD | HDA | 110.2° | 110.6° |
| CD | CE | HEA | 110.2° | 110.8° |
| CA | CE | HE | 110.2° | 110.7° |
| CE | CA | CB | 104.0° | 104.2° |
| CE | CA | HA | 108.6° | 110.4° |
| CE | CA | C | 111.6° | 110.5° |
| CA | CE | HEA | 110.2° | 110.8° |
| HE | CE | HEA | 109.5° | 110.8° |
| CB | CA | HA | 108.4° | 110.5° |
| CB | CA | C | 115.2° | 110.5° |
| CA | CB | HB | 108.5° | 110.0° |
| HA | CA | C | 108.8° | 110.6° |
| CA | C | OXT | 119.3° | 120.0° |
| CA | C | O | 121.4° | 120.0° |
| OXT | C | O | 119.3° | 120.0° |
| C | OXT | HXT | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| H | N | H2 | CB | 120.0° | 123.9° |
| H | N | CB | CG | 180.0° | 61.4° |
| H | N | CB | CA | 63.1° | 178.6° |
| H | N | CB | HB | 56.9° | 60.0° |
| H2 | N | CB | CG | 60.0° | 174.6° |
| H2 | N | CB | CA | 56.9° | 57.4° |
| H2 | N | CB | HB | 176.9° | 64.0° |
| N | CB | CG | CA | 121.2° | 119.3° |
| N | CB | CG | HB | 123.5° | 121.4° |
| N | CB | CG | HGA | 82.7° | 0.0° |
| N | CB | CG | CD | 157.9° | 119.3° |
| N | CB | CA | CE | 159.5° | 142.9° |
| N | CB | CA | HB | 120.7° | 121.3° |
| N | CB | CA | HA | 44.0° | 24.3° |
| N | CB | CA | C | 78.1° | 98.4° |
| N | CB | CG | HG | 38.6° | 121.3° |
| CB | CG | HGA | CD | 116.1° | 117.2° |
| CB | CG | HGA | HG | 121.9° | 121.4° |
| CB | CG | CD | HG | 119.3° | 119.4° |
| CB | CG | CD | HD | 96.1° | 142.3° |
| CB | CG | CD | CE | 23.5° | 23.6° |
| CG | CB | CA | CE | 35.8° | 23.5° |
| CG | CB | CA | HB | 115.6° | 119.3° |
| CG | CB | CA | HA | 79.6° | 95.1° |
| CG | CB | CA | C | 158.3° | 142.3° |
| CB | CG | CD | HDA | 143.0° | 95.2° |
| HGA | CG | CD | HG | 121.4° | 121.3° |
| HGA | CG | CD | HD | 23.3° | 98.4° |
| HGA | CG | CD | CE | 142.8° | 142.9° |
| HGA | CG | CB | CA | 156.1° | 119.3° |
| HGA | CG | CB | HB | 40.8° | 121.4° |
| HGA | CG | CD | HDA | 97.7° | 24.1° |
| CG | CD | HD | CE | 117.3° | 114.8° |
| CG | CD | HD | HDA | 121.4° | 122.5° |
| CG | CD | CE | HDA | 119.5° | 118.8° |
| CG | CD | CE | CA | 0.8° | 37.9° |
| CG | CD | CE | HE | 120.3° | 80.3° |
| CD | CG | CB | CA | 36.7° | 0.0° |
| CD | CG | CB | HB | 78.6° | 119.4° |
| CG | CD | CE | HEA | 118.8° | 156.3° |
| HD | CD | CE | HDA | 120.9° | 122.5° |
| HD | CD | CE | CA | 118.8° | 156.6° |
| HD | CD | CE | HE | 0.8° | 38.4° |
| HD | CD | CG | HG | 144.6° | 22.9° |
| HD | CD | CE | HEA | 121.7° | 85.0° |
| CD | CE | CA | HE | 119.5° | 118.3° |
| CD | CE | CA | HEA | 119.6° | 118.4° |
| CD | CE | HE | HEA | 121.4° | 123.4° |
| CD | CE | CA | CB | 21.5° | 37.9° |
| CD | CE | CA | HA | 93.7° | 80.7° |
| CD | CE | CA | C | 146.3° | 156.6° |
| CE | CD | CG | HG | 95.9° | 95.8° |
| CA | CE | HE | HEA | 121.3° | 123.3° |
| CE | CA | CB | HA | 115.4° | 118.6° |
| CE | CA | CB | C | 122.5° | 118.7° |
| CE | CA | HA | C | 121.7° | 122.6° |
| CE | CA | C | OXT | 130.4° | 61.5° |
| CE | CA | C | O | 49.7° | 118.6° |
| CE | CA | CB | HB | 79.8° | 95.8° |
| CA | CE | CD | HDA | 120.3° | 80.8° |
| HE | CE | CA | CB | 98.1° | 80.4° |
| HE | CE | CA | HA | 146.7° | 161.0° |
| HE | CE | CA | C | 26.7° | 38.3° |
| HE | CE | CD | HDA | 120.1° | 160.9° |
| CB | CA | HA | C | 125.9° | 122.7° |
| CB | CA | C | OXT | 111.3° | 176.3° |
| CB | CA | C | O | 68.6° | 3.8° |
| CA | CB | CG | HG | 82.6° | 119.3° |
| CB | CA | CE | HEA | 141.0° | 156.3° |
| HA | CA | C | OXT | 10.5° | 61.1° |
| HA | CA | C | O | 169.5° | 118.8° |
| HA | CA | CB | HB | 164.8° | 145.6° |
| HA | CA | CE | HEA | 25.8° | 37.6° |
| CA | C | OXT | O | 179.9° | 179.9° |
| C | CA | CB | HB | 42.7° | 22.9° |
| C | CA | CE | HEA | 94.2° | 85.0° |
| CA | C | OXT | HXT | 179.9° | 180.0° |
| O | C | OXT | HXT | 0.0° | 0.1° |
| HB | CB | CG | HG | 162.1° | 0.0° |
| HG | CG | CD | HDA | 23.7° | 145.4° |
| HDA | CD | CE | HEA | 0.8° | 37.5° |
