MPT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CA | C | sing | 1.51Å | 1.51Å | |
| CA | CB | sing | 1.53Å | 1.45Å | |
| CA | HA1 | sing | 1.09Å | 1.10Å | |
| CA | HA2 | sing | 1.09Å | 1.10Å | |
| C | O | doub | 1.21Å | 1.20Å | |
| C | OXT | sing | 1.34Å | 20.70Å | |
| CB | SG | sing | 1.81Å | 1.89Å | |
| CB | HB1 | sing | 1.09Å | 1.10Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| SG | HG | sing | 1.34Å | 1.30Å | |
| OXT | HXT | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | CA | CB | 114.0° | 109.5° |
| C | CA | HA1 | 108.3° | 109.4° |
| C | CA | HA2 | 108.3° | 109.4° |
| CA | C | O | 127.4° | 120.0° |
| CA | C | OXT | 169.9° | 120.0° |
| CB | CA | HA1 | 108.3° | 109.5° |
| CB | CA | HA2 | 108.3° | 109.5° |
| CA | CB | SG | 113.4° | 109.5° |
| CA | CB | HB1 | 108.5° | 109.5° |
| CA | CB | HB2 | 108.5° | 109.5° |
| HA1 | CA | HA2 | 109.5° | 109.5° |
| O | C | OXT | 60.7° | 120.0° |
| C | OXT | HXT | 90.0° | 117.0° |
| SG | CB | HB1 | 108.5° | 109.4° |
| SG | CB | HB2 | 108.5° | 109.4° |
| CB | SG | HG | 102.0° | 103.0° |
| HB1 | CB | HB2 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | CA | CB | HA1 | 120.7° | 120.0° |
| C | CA | CB | HA2 | 120.6° | 120.0° |
| C | CA | HA1 | HA2 | 117.9° | 119.9° |
| CA | C | O | OXT | 172.7° | 180.0° |
| C | CA | CB | SG | 132.0° | 180.0° |
| C | CA | CB | HB1 | 107.4° | 60.0° |
| C | CA | CB | HB2 | 11.4° | 60.0° |
| CA | C | OXT | HXT | 90.0° | 180.0° |
| CB | CA | HA1 | HA2 | 117.9° | 120.1° |
| CB | CA | C | O | 66.0° | 0.0° |
| CB | CA | C | OXT | 152.8° | 180.0° |
| CA | CB | SG | HB1 | 120.6° | 120.0° |
| CA | CB | SG | HB2 | 120.6° | 120.0° |
| CA | CB | HB1 | HB2 | 118.2° | 120.1° |
| CA | CB | SG | HG | 180.0° | 180.0° |
| HA1 | CA | C | O | 173.3° | 120.0° |
| HA1 | CA | C | OXT | 32.1° | 60.0° |
| HA1 | CA | CB | SG | 11.3° | 60.0° |
| HA1 | CA | CB | HB1 | 131.9° | 180.0° |
| HA1 | CA | CB | HB2 | 109.3° | 59.9° |
| HA2 | CA | C | O | 54.6° | 120.0° |
| HA2 | CA | C | OXT | 86.6° | 60.0° |
| HA2 | CA | CB | SG | 107.4° | 60.0° |
| HA2 | CA | CB | HB1 | 13.2° | 59.9° |
| HA2 | CA | CB | HB2 | 132.0° | 180.0° |
| O | C | OXT | HXT | 90.0° | 0.0° |
| SG | CB | HB1 | HB2 | 118.2° | 119.9° |
| HB1 | CB | SG | HG | 59.4° | 60.0° |
| HB2 | CB | SG | HG | 59.4° | 60.0° |
