CSU
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.44Å | 1.46Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CA | C | sing | 1.52Å | 1.53Å | |
| CA | HA | sing | 1.10Å | 1.10Å | |
| CB | SG | sing | 1.82Å | 1.81Å | |
| CB | HB2 | sing | 1.10Å | 1.10Å | |
| CB | HB3 | sing | 1.09Å | 1.10Å | |
| SG | S | sing | 2.09Å | 2.03Å | |
| S | OD1 | doub | 1.45Å | 1.45Å | |
| S | OD2 | sing | 1.63Å | 1.45Å | |
| S | OD3 | doub | 1.45Å | 1.50Å | |
| C | O | doub | 1.22Å | 1.23Å | |
| C | OXT | sing | 1.36Å | 11.43Å | |
| OXT | HXT | sing | 0.98Å | 0.95Å | |
| OD2 | HD2 | sing | 0.99Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | H | 109.5° | 119.0° |
| CA | N | H2 | 109.5° | 118.9° |
| N | CA | CB | 110.3° | 112.0° |
| N | CA | C | 111.4° | 111.9° |
| N | CA | HA | 108.1° | 105.3° |
| H | N | H2 | 109.5° | 120.6° |
| CB | CA | C | 110.9° | 112.4° |
| CB | CA | HA | 108.6° | 108.8° |
| CA | CB | SG | 108.2° | 113.7° |
| CA | CB | HB2 | 110.2° | 109.9° |
| CA | CB | HB3 | 109.9° | 110.4° |
| C | CA | HA | 107.4° | 106.1° |
| CA | C | O | 120.2° | 123.8° |
| CA | C | OXT | 150.0° | 113.3° |
| SG | CB | HB2 | 110.2° | 107.3° |
| SG | CB | HB3 | 109.9° | 107.6° |
| CB | SG | S | 97.7° | 102.1° |
| HB2 | CB | HB3 | 108.5° | 107.7° |
| SG | S | OD1 | 109.5° | 107.5° |
| SG | S | OD2 | 109.0° | 104.0° |
| SG | S | OD3 | 99.5° | 107.5° |
| OD1 | S | OD2 | 121.1° | 107.9° |
| OD1 | S | OD3 | 108.4° | 120.8° |
| OD2 | S | OD3 | 107.2° | 107.9° |
| S | OD2 | HD2 | 109.5° | 115.3° |
| O | C | OXT | 30.6° | 123.0° |
| C | OXT | HXT | 150.0° | 111.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 120.1° | 166.4° |
| N | CA | CB | C | 124.0° | 127.0° |
| N | CA | CB | HA | 118.2° | 115.9° |
| N | CA | C | HA | 118.2° | 114.3° |
| N | CA | CB | SG | 177.8° | 67.2° |
| N | CA | CB | HB2 | 57.3° | 53.0° |
| N | CA | CB | HB3 | 62.2° | 171.6° |
| N | CA | C | O | 124.7° | 5.8° |
| N | CA | C | OXT | 134.5° | 174.9° |
| H | N | CA | CB | 149.3° | 114.3° |
| H | N | CA | C | 25.6° | 12.9° |
| H | N | CA | HA | 92.1° | 127.7° |
| H2 | N | CA | CB | 90.6° | 79.1° |
| H2 | N | CA | C | 145.7° | 153.7° |
| H2 | N | CA | HA | 27.9° | 39.0° |
| CB | CA | C | HA | 118.5° | 118.7° |
| CA | CB | SG | HB2 | 120.5° | 121.7° |
| CA | CB | SG | HB3 | 120.0° | 122.7° |
| CA | CB | HB2 | HB3 | 120.4° | 120.3° |
| CA | CB | SG | S | 179.7° | 180.0° |
| CB | CA | C | O | 111.9° | 121.3° |
| CB | CA | C | OXT | 102.1° | 58.0° |
| C | CA | CB | SG | 53.8° | 59.7° |
| C | CA | CB | HB2 | 66.7° | 180.0° |
| C | CA | CB | HB3 | 173.8° | 61.4° |
| CA | C | O | OXT | 170.3° | 179.2° |
| CA | C | OXT | HXT | 180.0° | 179.3° |
| HA | CA | CB | SG | 64.0° | 176.9° |
| HA | CA | CB | HB2 | 175.6° | 62.9° |
| HA | CA | CB | HB3 | 56.1° | 55.7° |
| HA | CA | C | O | 6.6° | 120.0° |
| HA | CA | C | OXT | 16.4° | 60.7° |
| SG | CB | HB2 | HB3 | 120.3° | 115.6° |
| CB | SG | S | OD1 | 68.5° | 65.7° |
| CB | SG | S | OD2 | 66.1° | 180.0° |
| CB | SG | S | OD3 | 178.1° | 65.8° |
| HB2 | CB | SG | S | 59.8° | 58.3° |
| HB3 | CB | SG | S | 59.7° | 57.3° |
| SG | S | OD1 | OD2 | 128.1° | 111.6° |
| SG | S | OD1 | OD3 | 107.6° | 123.7° |
| SG | S | OD2 | OD3 | 106.8° | 113.9° |
| SG | S | OD2 | HD2 | 28.6° | 59.4° |
| OD1 | S | OD2 | OD3 | 124.9° | 132.1° |
| OD1 | S | OD2 | HD2 | 156.9° | 173.4° |
| OD3 | S | OD2 | HD2 | 78.2° | 54.5° |
| O | C | OXT | HXT | 163.2° | 0.0° |
