Obsolete: PKR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.48Å | 1.46Å | |
| CA | CB | sing | 1.55Å | 1.53Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| C | CA | sing | 1.51Å | 1.53Å | |
| C | OXT | sing | 1.34Å | 1.32Å | |
| O | C | doub | 1.21Å | 1.25Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| CB | HB3 | sing | 1.09Å | 1.10Å | |
| CG | CB | sing | 1.55Å | 1.49Å | |
| CG | HG2 | sing | 1.09Å | 1.10Å | |
| CG | HG3 | sing | 1.09Å | 1.10Å | |
| CD | N | sing | 1.47Å | 1.48Å | |
| CD | CG | sing | 1.54Å | 1.51Å | |
| CD | HD2 | sing | 1.09Å | 1.10Å | |
| CD | HD3 | sing | 1.09Å | 1.10Å | |
| N | C6 | sing | 1.47Å | 1.47Å | |
| C6 | HC | sing | 1.09Å | 1.10Å | |
| C6 | HE | sing | 1.09Å | 1.10Å | |
| C6 | HF | 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) |
| N | CA | CB | 102.3° | 104.8° |
| N | CA | HA | 110.2° | 110.4° |
| N | CA | C | 116.2° | 110.4° |
| CA | N | CD | 111.1° | 108.5° |
| CA | N | C6 | 121.5° | 111.0° |
| CB | CA | HA | 116.2° | 110.4° |
| CB | CA | C | 110.2° | 110.4° |
| CA | CB | HB2 | 112.2° | 111.0° |
| CA | CB | HB3 | 112.2° | 110.9° |
| CA | CB | CG | 101.7° | 101.7° |
| HA | CA | C | 102.3° | 110.4° |
| CA | C | OXT | 113.9° | 120.0° |
| CA | C | O | 122.4° | 120.0° |
| OXT | C | O | 123.6° | 120.0° |
| C | OXT | HXT | 109.5° | 117.0° |
| HB2 | CB | HB3 | 106.6° | 110.9° |
| HB2 | CB | CG | 112.2° | 111.0° |
| HB3 | CB | CG | 112.2° | 111.0° |
| CB | CG | HG2 | 111.3° | 110.7° |
| CB | CG | HG3 | 111.3° | 110.7° |
| CB | CG | CD | 104.1° | 103.0° |
| HG2 | CG | HG3 | 107.5° | 110.7° |
| HG2 | CG | CD | 111.3° | 110.7° |
| HG3 | CG | CD | 111.3° | 110.8° |
| N | CD | CG | 102.6° | 107.3° |
| N | CD | HD2 | 111.8° | 109.9° |
| N | CD | HD3 | 111.8° | 109.9° |
| CD | N | C6 | 124.7° | 111.0° |
| CG | CD | HD2 | 111.8° | 109.9° |
| CG | CD | HD3 | 111.8° | 109.9° |
| HD2 | CD | HD3 | 107.0° | 110.0° |
| N | C6 | HC | 109.5° | 109.4° |
| N | C6 | HE | 109.5° | 109.5° |
| N | C6 | HF | 109.5° | 109.5° |
| HC | C6 | HE | 109.5° | 109.4° |
| HC | C6 | HF | 109.5° | 109.5° |
| HE | C6 | HF | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N | CA | CB | HA | 120.1° | 118.8° |
| N | CA | CB | C | 124.2° | 118.9° |
| N | CA | HA | C | 124.2° | 122.3° |
| N | CA | C | OXT | 161.3° | 161.5° |
| N | CA | C | O | 15.0° | 18.6° |
| N | CA | CB | HB2 | 157.8° | 81.1° |
| N | CA | CB | HB3 | 82.3° | 155.2° |
| N | CA | CB | CG | 37.7° | 37.1° |
| CA | N | CD | C6 | 161.5° | 122.3° |
| CA | N | CD | CG | 6.1° | 0.9° |
| CA | N | CD | HD2 | 113.9° | 118.5° |
| CA | N | CD | HD3 | 126.1° | 120.4° |
| CA | N | C6 | HC | 180.0° | 60.0° |
| CA | N | C6 | HE | 60.0° | 179.9° |
| CA | N | C6 | HF | 60.0° | 60.0° |
| CB | CA | HA | C | 120.1° | 122.3° |
| CB | CA | C | OXT | 83.0° | 83.1° |
| CB | CA | C | O | 100.7° | 96.8° |
| CA | CB | HB2 | HB3 | 123.2° | 123.8° |
| CA | CB | HB2 | CG | 113.7° | 112.3° |
| CA | CB | HB3 | CG | 113.7° | 112.3° |
| CA | CB | CG | HG2 | 77.4° | 154.0° |
| CA | CB | CG | HG3 | 162.6° | 82.8° |
| CB | CA | N | CD | 19.7° | 24.0° |
| CA | CB | CG | CD | 42.6° | 35.7° |
| CB | CA | N | C6 | 142.5° | 146.4° |
| HA | CA | C | OXT | 41.1° | 39.2° |
| HA | CA | C | O | 135.1° | 140.9° |
| HA | CA | CB | HB2 | 82.1° | 160.1° |
| HA | CA | CB | HB3 | 37.8° | 36.4° |
| HA | CA | CB | CG | 157.8° | 81.7° |
| HA | CA | N | CD | 143.9° | 94.8° |
| HA | CA | N | C6 | 18.3° | 27.6° |
| CA | C | OXT | O | 176.2° | 179.9° |
| C | CA | CB | HB2 | 33.6° | 37.8° |
| C | CA | CB | HB3 | 153.6° | 86.0° |
| C | CA | CB | CG | 86.4° | 155.9° |
| C | CA | N | CD | 100.4° | 142.9° |
| C | CA | N | C6 | 97.4° | 94.8° |
| CA | C | OXT | HXT | 176.2° | 180.0° |
| O | C | OXT | HXT | 0.0° | 0.1° |
| HB2 | CB | HB3 | CG | 123.1° | 123.9° |
| HB2 | CB | CG | HG2 | 42.6° | 35.9° |
| HB2 | CB | CG | HG3 | 77.4° | 159.0° |
| HB2 | CB | CG | CD | 162.6° | 82.5° |
| HB3 | CB | CG | HG2 | 162.6° | 87.9° |
| HB3 | CB | CG | HG3 | 42.6° | 35.2° |
| HB3 | CB | CG | CD | 77.4° | 153.7° |
| CB | CG | HG2 | HG3 | 122.2° | 123.1° |
| CB | CG | HG2 | CD | 115.7° | 113.6° |
| CB | CG | HG3 | CD | 115.7° | 113.6° |
| CB | CG | CD | N | 30.3° | 22.3° |
| CB | CG | CD | HD2 | 89.7° | 141.7° |
| CB | CG | CD | HD3 | 150.3° | 97.1° |
| HG2 | CG | HG3 | CD | 122.1° | 123.2° |
| HG2 | CG | CD | N | 89.7° | 140.7° |
| HG2 | CG | CD | HD2 | 150.3° | 99.9° |
| HG2 | CG | CD | HD3 | 30.3° | 21.2° |
| HG3 | CG | CD | N | 150.4° | 96.1° |
| HG3 | CG | CD | HD2 | 30.4° | 23.3° |
| HG3 | CG | CD | HD3 | 89.6° | 144.4° |
| N | CD | CG | HD2 | 120.0° | 119.4° |
| N | CD | CG | HD3 | 120.0° | 119.5° |
| N | CD | HD2 | HD3 | 122.8° | 121.1° |
| CD | N | C6 | HC | 20.3° | 179.2° |
| CD | N | C6 | HE | 99.7° | 59.2° |
| CD | N | C6 | HF | 140.3° | 60.8° |
| CG | CD | HD2 | HD3 | 122.8° | 121.1° |
| CG | CD | N | C6 | 167.6° | 123.2° |
| HD2 | CD | N | C6 | 47.6° | 3.8° |
| HD3 | CD | N | C6 | 72.4° | 117.3° |
| N | C6 | HC | HE | 120.0° | 120.0° |
| N | C6 | HC | HF | 120.0° | 120.0° |
| N | C6 | HE | HF | 120.0° | 120.0° |
| HC | C6 | HE | HF | 120.0° | 120.0° |
