3PX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | O | doub | 1.21Å | 1.23Å | |
| C | OXT | sing | 1.34Å | 1.43Å | |
| N | CD | sing | 1.48Å | 1.48Å | |
| N | CA | sing | 1.48Å | 1.47Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| CA | C | sing | 1.51Å | 1.50Å | |
| CA | CB | sing | 1.55Å | 1.51Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | CG | sing | 1.55Å | 1.52Å | |
| CB | HB | sing | 1.09Å | 1.10Å | |
| CD | CG | sing | 1.54Å | 1.52Å | |
| CD | HD | sing | 1.09Å | 1.10Å | |
| CD | HDA | sing | 1.09Å | 1.10Å | |
| CG | HG | sing | 1.09Å | 1.10Å | |
| CG | HGA | sing | 1.09Å | 1.10Å | |
| OB1 | CB | sing | 1.43Å | 1.42Å | |
| CB2 | OB1 | sing | 1.43Å | 1.43Å | |
| CB2 | CB4 | sing | 1.53Å | 1.52Å | |
| CB2 | HB2 | sing | 1.09Å | 1.10Å | |
| CB3 | CB2 | sing | 1.53Å | 1.53Å | |
| CB3 | HB3 | sing | 1.09Å | 1.10Å | |
| CB3 | HB3A | sing | 1.09Å | 1.10Å | |
| CB3 | HB3B | sing | 1.09Å | 1.10Å | |
| CB4 | HB4 | sing | 1.09Å | 1.10Å | |
| CB4 | HB4A | sing | 1.09Å | 1.10Å | |
| CB4 | HB4B | 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) |
| O | C | OXT | 119.6° | 120.0° |
| O | C | CA | 120.7° | 120.0° |
| OXT | C | CA | 119.6° | 120.0° |
| C | OXT | HXT | 109.5° | 117.0° |
| CD | N | CA | 109.5° | 105.9° |
| CD | N | H | 109.5° | 111.0° |
| N | CD | CG | 106.6° | 107.0° |
| N | CD | HD | 110.5° | 109.9° |
| N | CD | HDA | 110.4° | 109.9° |
| CA | N | H | 109.5° | 111.0° |
| N | CA | C | 114.7° | 110.7° |
| N | CA | CB | 106.5° | 103.2° |
| N | CA | HA | 107.9° | 110.7° |
| C | CA | CB | 109.0° | 110.6° |
| C | CA | HA | 105.3° | 110.6° |
| CB | CA | HA | 113.7° | 110.8° |
| CA | CB | CG | 105.5° | 102.9° |
| CA | CB | HB | 117.7° | 110.7° |
| CA | CB | OB1 | 103.5° | 110.7° |
| CG | CB | HB | 106.9° | 110.8° |
| CB | CG | CD | 105.4° | 105.2° |
| CB | CG | HG | 110.8° | 110.3° |
| CB | CG | HGA | 110.8° | 110.3° |
| CG | CB | OB1 | 114.8° | 110.7° |
| HB | CB | OB1 | 108.8° | 110.8° |
| CG | CD | HD | 110.4° | 109.9° |
| CG | CD | HDA | 110.4° | 109.9° |
| CD | CG | HG | 110.8° | 110.3° |
| CD | CG | HGA | 110.8° | 110.3° |
| HD | CD | HDA | 108.5° | 110.1° |
| HG | CG | HGA | 108.1° | 110.3° |
| CB | OB1 | CB2 | 117.1° | 114.0° |
| OB1 | CB2 | CB4 | 112.0° | 109.5° |
| OB1 | CB2 | HB2 | 110.5° | 109.4° |
| OB1 | CB2 | CB3 | 106.5° | 109.5° |
| CB4 | CB2 | HB2 | 105.3° | 109.5° |
| CB4 | CB2 | CB3 | 111.6° | 109.5° |
| CB2 | CB4 | HB4 | 109.5° | 109.5° |
| CB2 | CB4 | HB4A | 109.5° | 109.5° |
| CB2 | CB4 | HB4B | 109.5° | 109.5° |
| HB2 | CB2 | CB3 | 111.0° | 109.5° |
| CB2 | CB3 | HB3 | 109.5° | 109.4° |
| CB2 | CB3 | HB3A | 109.5° | 109.5° |
| CB2 | CB3 | HB3B | 109.5° | 109.5° |
| HB3 | CB3 | HB3A | 109.5° | 109.5° |
| HB3 | CB3 | HB3B | 109.4° | 109.4° |
| HB3A | CB3 | HB3B | 109.5° | 109.5° |
| HB4 | CB4 | HB4A | 109.4° | 109.5° |
| HB4 | CB4 | HB4B | 109.5° | 109.5° |
| HB4A | CB4 | HB4B | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | OXT | CA | 180.0° | 179.7° |
| O | C | CA | N | 30.7° | 18.5° |
| O | C | CA | CB | 88.5° | 95.2° |
| O | C | CA | HA | 149.1° | 141.6° |
| O | C | OXT | HXT | 0.0° | 0.1° |
| OXT | C | CA | N | 149.3° | 161.8° |
| OXT | C | CA | CB | 91.5° | 84.5° |
| OXT | C | CA | HA | 30.9° | 38.7° |
| CD | N | CA | H | 120.0° | 120.5° |
| CD | N | CA | C | 106.4° | 157.6° |
| CD | N | CA | CB | 14.3° | 39.2° |
| CD | N | CA | HA | 136.7° | 79.4° |
| N | CD | CG | CB | 16.7° | 1.2° |
| N | CD | CG | HD | 120.0° | 119.3° |
| N | CD | CG | HDA | 120.0° | 119.4° |
| N | CD | HD | HDA | 121.2° | 121.2° |
| N | CD | CG | HG | 103.3° | 117.7° |
| N | CD | CG | HGA | 136.6° | 120.1° |
| N | CA | C | CB | 119.2° | 113.7° |
| N | CA | C | HA | 118.4° | 123.1° |
| N | CA | CB | HA | 118.7° | 118.5° |
| N | CA | CB | CG | 24.4° | 37.4° |
| N | CA | CB | HB | 143.5° | 81.0° |
| CA | N | CD | CG | 1.6° | 25.3° |
| CA | N | CD | HD | 118.4° | 94.0° |
| CA | N | CD | HDA | 121.6° | 144.7° |
| N | CA | CB | OB1 | 96.6° | 155.8° |
| H | N | CA | C | 13.6° | 37.1° |
| H | N | CA | CB | 134.3° | 81.3° |
| H | N | CA | HA | 103.3° | 160.1° |
| H | N | CD | CG | 118.4° | 95.2° |
| H | N | CD | HD | 121.6° | 145.4° |
| H | N | CD | HDA | 1.6° | 24.1° |
| C | CA | CB | HA | 117.1° | 123.1° |
| C | CA | CB | CG | 99.8° | 155.8° |
| C | CA | CB | HB | 19.3° | 37.4° |
| C | CA | CB | OB1 | 139.2° | 85.8° |
| CA | C | OXT | HXT | 180.0° | 179.8° |
| CA | CB | CG | HB | 126.0° | 118.4° |
| CA | CB | CG | OB1 | 113.2° | 118.4° |
| CA | CB | HB | OB1 | 117.1° | 123.2° |
| CA | CB | CG | CD | 25.2° | 22.0° |
| CA | CB | CG | HG | 94.8° | 140.9° |
| CA | CB | CG | HGA | 145.1° | 97.0° |
| CA | CB | OB1 | CB2 | 175.5° | 150.0° |
| HA | CA | CB | CG | 143.1° | 81.1° |
| HA | CA | CB | HB | 97.9° | 160.5° |
| HA | CA | CB | OB1 | 22.1° | 37.3° |
| CG | CB | HB | OB1 | 124.6° | 123.3° |
| CB | CG | CD | HG | 120.0° | 118.9° |
| CB | CG | CD | HGA | 120.0° | 118.9° |
| CB | CG | CD | HD | 103.4° | 118.1° |
| CB | CG | CD | HDA | 136.6° | 120.6° |
| CB | CG | HG | HGA | 121.7° | 122.1° |
| CG | CB | OB1 | CB2 | 70.1° | 96.5° |
| HB | CB | CG | CD | 151.2° | 96.4° |
| HB | CB | CG | HG | 31.2° | 22.5° |
| HB | CB | CG | HGA | 88.9° | 144.7° |
| HB | CB | OB1 | CB2 | 49.6° | 26.8° |
| CG | CD | HD | HDA | 121.2° | 121.2° |
| CD | CG | HG | HGA | 121.6° | 122.1° |
| CD | CG | CB | OB1 | 88.1° | 140.3° |
| HD | CD | CG | HG | 136.7° | 123.0° |
| HD | CD | CG | HGA | 16.6° | 0.8° |
| HDA | CD | CG | HG | 16.7° | 1.6° |
| HDA | CD | CG | HGA | 103.4° | 120.5° |
| HG | CG | CB | OB1 | 152.0° | 100.7° |
| HGA | CG | CB | OB1 | 31.9° | 21.4° |
| CB | OB1 | CB2 | CB4 | 52.2° | 150.0° |
| CB | OB1 | CB2 | HB2 | 64.9° | 30.0° |
| CB | OB1 | CB2 | CB3 | 174.4° | 90.0° |
| OB1 | CB2 | CB4 | HB2 | 120.2° | 120.0° |
| OB1 | CB2 | CB4 | CB3 | 119.3° | 120.0° |
| OB1 | CB2 | HB2 | CB3 | 117.9° | 119.9° |
| OB1 | CB2 | CB3 | HB3 | 180.0° | 180.0° |
| OB1 | CB2 | CB3 | HB3A | 60.0° | 59.9° |
| OB1 | CB2 | CB3 | HB3B | 60.0° | 60.1° |
| OB1 | CB2 | CB4 | HB4 | 180.0° | 60.0° |
| OB1 | CB2 | CB4 | HB4A | 60.0° | 180.0° |
| OB1 | CB2 | CB4 | HB4B | 60.0° | 60.1° |
| CB4 | CB2 | HB2 | CB3 | 120.9° | 120.1° |
| CB4 | CB2 | CB3 | HB3 | 57.5° | 60.0° |
| CB4 | CB2 | CB3 | HB3A | 62.5° | 180.0° |
| CB4 | CB2 | CB3 | HB3B | 177.5° | 60.0° |
| CB2 | CB4 | HB4 | HB4A | 120.0° | 120.0° |
| CB2 | CB4 | HB4 | HB4B | 120.0° | 120.1° |
| CB2 | CB4 | HB4A | HB4B | 120.0° | 119.9° |
| HB2 | CB2 | CB3 | HB3 | 59.7° | 60.1° |
| HB2 | CB2 | CB3 | HB3A | 179.7° | 60.0° |
| HB2 | CB2 | CB3 | HB3B | 60.3° | NaN° |
| HB2 | CB2 | CB4 | HB4 | 59.8° | 60.0° |
| HB2 | CB2 | CB4 | HB4A | 60.2° | 60.1° |
| HB2 | CB2 | CB4 | HB4B | 179.8° | 180.0° |
| CB2 | CB3 | HB3 | HB3A | 120.0° | 120.0° |
| CB2 | CB3 | HB3 | HB3B | 120.0° | 119.9° |
| CB2 | CB3 | HB3A | HB3B | 120.0° | 120.0° |
| CB3 | CB2 | CB4 | HB4 | 60.8° | 180.0° |
| CB3 | CB2 | CB4 | HB4A | 179.3° | 59.9° |
| CB3 | CB2 | CB4 | HB4B | 59.3° | 59.9° |
| HB3 | CB3 | HB3A | HB3B | 120.0° | 120.0° |
| HB4 | CB4 | HB4A | HB4B | 120.0° | 120.0° |
