PRO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.49Å | 1.46Å | |
| N | CD | sing | 1.49Å | 1.48Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| CA | C | sing | 1.51Å | 1.51Å | |
| CA | CB | sing | 1.54Å | 1.53Å | |
| CA | HA | sing | 1.09Å | 1.11Å | |
| C | O | doub | 1.21Å | 1.25Å | |
| C | OXT | sing | 1.34Å | 1.26Å | |
| CB | CG | sing | 1.54Å | 1.52Å | |
| CB | HB2 | sing | 1.09Å | 1.12Å | |
| CB | HB3 | sing | 1.09Å | 1.11Å | |
| CG | CD | sing | 1.54Å | 1.53Å | |
| CG | HG2 | sing | 1.09Å | 1.12Å | |
| CG | HG3 | sing | 1.09Å | 1.12Å | |
| CD | HD2 | sing | 1.09Å | 1.12Å | |
| CD | HD3 | sing | 1.09Å | 1.11Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | CD | 112.4° | 104.1° |
| CA | N | H | 106.8° | 106.9° |
| N | CA | C | 108.7° | 110.4° |
| N | CA | CB | 103.3° | 104.7° |
| N | CA | HA | 114.9° | 110.4° |
| CD | N | H | 106.8° | 106.7° |
| N | CD | CG | 104.0° | 104.7° |
| N | CD | HD2 | 114.3° | 110.4° |
| N | CD | HD3 | 114.3° | 110.3° |
| C | CA | CB | 112.4° | 110.4° |
| C | CA | HA | 106.2° | 110.4° |
| CA | C | O | 118.2° | 120.0° |
| CA | C | OXT | 117.2° | 120.0° |
| CB | CA | HA | 111.4° | 110.4° |
| CA | CB | CG | 104.4° | 105.1° |
| CA | CB | HB2 | 114.1° | 110.4° |
| CA | CB | HB3 | 114.1° | 110.4° |
| O | C | OXT | 124.6° | 120.0° |
| C | OXT | HXT | 117.2° | 120.0° |
| CG | CB | HB2 | 114.1° | 110.2° |
| CG | CB | HB3 | 114.1° | 110.3° |
| CB | CG | CD | 106.8° | 105.1° |
| CB | CG | HG2 | 113.2° | 110.4° |
| CB | CG | HG3 | 113.2° | 110.4° |
| HB2 | CB | HB3 | 96.3° | 110.4° |
| CD | CG | HG2 | 113.2° | 110.3° |
| CD | CG | HG3 | 113.2° | 110.3° |
| CG | CD | HD2 | 114.2° | 110.5° |
| CG | CD | HD3 | 114.3° | 110.4° |
| HG2 | CG | HG3 | 97.2° | 110.4° |
| HD2 | CD | HD3 | 96.2° | 110.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | CD | H | 116.9° | 112.9° |
| N | CA | C | CB | 113.8° | 115.3° |
| N | CA | C | HA | 124.2° | 122.3° |
| N | CA | CB | HA | 123.9° | 118.8° |
| N | CA | C | O | 78.1° | 17.0° |
| N | CA | C | OXT | 102.4° | 163.1° |
| N | CA | CB | CG | 29.8° | 23.8° |
| N | CA | CB | HB2 | 155.0° | 95.0° |
| N | CA | CB | HB3 | 95.5° | 142.7° |
| CA | N | CD | CG | 5.9° | 39.3° |
| CA | N | CD | HD2 | 119.4° | 158.2° |
| CA | N | CD | HD3 | 131.1° | 79.5° |
| CD | N | CA | C | 97.1° | 158.1° |
| CD | N | CA | CB | 22.5° | 39.3° |
| CD | N | CA | HA | 144.1° | 79.6° |
| N | CD | CG | CB | 13.7° | 23.7° |
| N | CD | CG | HD2 | 125.3° | 118.9° |
| N | CD | CG | HD3 | 125.3° | 118.7° |
| N | CD | CG | HG2 | 111.6° | 95.2° |
| N | CD | CG | HG3 | 139.0° | 142.7° |
| N | CD | HD2 | HD3 | 120.2° | 122.2° |
| H | N | CA | C | 146.1° | 89.1° |
| H | N | CA | CB | 94.3° | 152.1° |
| H | N | CA | HA | 27.2° | 33.2° |
| H | N | CD | CG | 111.0° | 152.1° |
| H | N | CD | HD2 | 123.8° | 89.0° |
| H | N | CD | HD3 | 14.3° | 33.4° |
| C | CA | CB | HA | 119.1° | 122.3° |
| CA | C | O | OXT | 179.5° | 179.9° |
| C | CA | CB | CG | 87.3° | 142.6° |
| C | CA | CB | HB2 | 38.0° | 23.8° |
| C | CA | CB | HB3 | 147.4° | 98.5° |
| CA | C | OXT | HXT | 180.0° | 180.0° |
| CB | CA | C | O | 35.7° | 98.3° |
| CB | CA | C | OXT | 143.9° | 81.6° |
| CA | CB | CG | HB2 | 125.3° | 118.9° |
| CA | CB | CG | HB3 | 125.3° | 118.9° |
| CA | CB | HB2 | HB3 | 120.0° | 122.3° |
| CA | CB | CG | CD | 27.2° | 0.0° |
| CA | CB | CG | HG2 | 98.1° | 118.9° |
| CA | CB | CG | HG3 | 152.5° | 118.9° |
| HA | CA | C | O | 157.7° | 139.3° |
| HA | CA | C | OXT | 21.8° | 40.8° |
| HA | CA | CB | CG | 153.6° | 95.0° |
| HA | CA | CB | HB2 | 81.1° | 146.1° |
| HA | CA | CB | HB3 | 28.3° | 23.8° |
| O | C | OXT | HXT | 0.5° | 0.1° |
| CG | CB | HB2 | HB3 | 120.0° | 122.1° |
| CB | CG | CD | HG2 | 125.3° | 118.9° |
| CB | CG | CD | HG3 | 125.3° | 118.9° |
| CB | CG | HG2 | HG3 | 119.1° | 122.3° |
| CB | CG | CD | HD2 | 139.0° | 142.6° |
| CB | CG | CD | HD3 | 111.6° | 94.9° |
| HB2 | CB | CG | CD | 152.4° | 118.9° |
| HB2 | CB | CG | HG2 | 27.1° | 0.0° |
| HB2 | CB | CG | HG3 | 82.3° | 122.2° |
| HB3 | CB | CG | CD | 98.1° | 118.9° |
| HB3 | CB | CG | HG2 | 136.6° | 122.2° |
| HB3 | CB | CG | HG3 | 27.2° | 0.1° |
| CD | CG | HG2 | HG3 | 119.1° | 122.1° |
| CG | CD | HD2 | HD3 | 120.1° | 122.4° |
| HG2 | CG | CD | HD2 | 13.7° | 23.7° |
| HG2 | CG | CD | HD3 | 123.1° | 146.2° |
| HG3 | CG | CD | HD2 | 95.7° | 98.4° |
| HG3 | CG | CD | HD3 | 13.7° | 24.0° |
