MSO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.46Å | |
| N | H | sing | 1.01Å | 1.02Å | |
| N | H2 | sing | 1.01Å | 1.02Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CA | C | sing | 1.51Å | 1.53Å | |
| CA | HA | sing | 1.09Å | 1.11Å | |
| CB | CG | sing | 1.53Å | 1.52Å | |
| CB | HB2 | sing | 1.09Å | 1.11Å | |
| CB | HB3 | sing | 1.09Å | 1.12Å | |
| C | O | doub | 1.21Å | 1.23Å | |
| C | OXT | sing | 1.34Å | 1.33Å | |
| CG | SE | sing | 1.96Å | 1.79Å | |
| CG | HG2 | sing | 1.09Å | 1.12Å | |
| CG | HG3 | sing | 1.09Å | 1.11Å | |
| SE | OE | doub | 1.55Å | 1.47Å | |
| SE | CE | sing | 1.96Å | 1.79Å | |
| CE | HE1 | sing | 1.09Å | 1.12Å | |
| CE | HE2 | sing | 1.09Å | 1.12Å | |
| CE | HE3 | 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 | H | 111.0° | 106.6° |
| CA | N | H2 | 111.7° | 106.7° |
| N | CA | CB | 111.0° | 109.4° |
| N | CA | C | 110.5° | 109.5° |
| N | CA | HA | 108.1° | 109.4° |
| H | N | H2 | 111.7° | 106.7° |
| CB | CA | C | 110.4° | 109.6° |
| CB | CA | HA | 108.2° | 109.5° |
| CA | CB | CG | 113.4° | 109.5° |
| CA | CB | HB2 | 110.8° | 109.4° |
| CA | CB | HB3 | 110.8° | 109.5° |
| C | CA | HA | 108.6° | 109.4° |
| CA | C | O | 120.7° | 120.0° |
| CA | C | OXT | 116.9° | 120.1° |
| CG | CB | HB2 | 110.8° | 109.4° |
| CG | CB | HB3 | 110.8° | 109.5° |
| CB | CG | SE | 108.3° | 109.5° |
| CB | CG | HG2 | 112.6° | 109.4° |
| CB | CG | HG3 | 112.7° | 109.5° |
| HB2 | CB | HB3 | 99.6° | 109.5° |
| O | C | OXT | 122.5° | 119.9° |
| C | OXT | HXT | 116.9° | 120.0° |
| SE | CG | HG2 | 112.6° | 109.4° |
| SE | CG | HG3 | 112.6° | 109.5° |
| CG | SE | OE | 108.6° | 95.0° |
| CG | SE | CE | 102.8° | 95.0° |
| HG2 | CG | HG3 | 97.8° | 109.5° |
| OE | SE | CE | 113.0° | 95.0° |
| SE | CE | HE1 | 102.9° | 109.5° |
| SE | CE | HE2 | 114.7° | 109.5° |
| SE | CE | HE3 | 114.8° | 109.5° |
| HE1 | CE | HE2 | 114.7° | 109.4° |
| HE1 | CE | HE3 | 114.7° | 109.5° |
| HE2 | CE | HE3 | 95.7° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 125.3° | 113.8° |
| N | CA | CB | C | 122.9° | 120.0° |
| N | CA | CB | HA | 118.4° | 119.9° |
| N | CA | C | HA | 118.4° | 120.0° |
| N | CA | CB | CG | 161.5° | 60.0° |
| N | CA | CB | HB2 | 36.2° | 180.0° |
| N | CA | CB | HB3 | 73.3° | 60.1° |
| N | CA | C | O | 146.9° | 30.0° |
| N | CA | C | OXT | 32.6° | 150.0° |
| H | N | CA | CB | 180.0° | 60.0° |
| H | N | CA | C | 57.2° | 60.0° |
| H | N | CA | HA | 61.6° | 180.0° |
| H2 | N | CA | CB | 54.7° | 53.8° |
| H2 | N | CA | C | 177.5° | 173.9° |
| H2 | N | CA | HA | 63.7° | 66.2° |
| CB | CA | C | HA | 118.4° | 120.1° |
| CA | CB | CG | HB2 | 125.3° | 119.9° |
| CA | CB | CG | HB3 | 125.2° | 120.1° |
| CA | CB | HB2 | HB3 | 116.7° | 120.0° |
| CB | CA | C | O | 89.9° | 89.9° |
| CB | CA | C | OXT | 90.6° | 90.0° |
| CA | CB | CG | SE | 179.5° | 180.0° |
| CA | CB | CG | HG2 | 55.3° | 60.1° |
| CA | CB | CG | HG3 | 54.2° | 59.9° |
| C | CA | CB | CG | 75.6° | 179.9° |
| C | CA | CB | HB2 | 159.1° | 60.0° |
| C | CA | CB | HB3 | 49.6° | 60.0° |
| CA | C | O | OXT | 179.5° | 179.9° |
| CA | C | OXT | HXT | 179.9° | 179.9° |
| HA | CA | CB | CG | 43.1° | 59.9° |
| HA | CA | CB | HB2 | 82.2° | 60.0° |
| HA | CA | CB | HB3 | 168.3° | 180.0° |
| HA | CA | C | O | 28.5° | 150.0° |
| HA | CA | C | OXT | 151.0° | 30.1° |
| CG | CB | HB2 | HB3 | 116.6° | 120.0° |
| CB | CG | SE | HG2 | 125.3° | 119.9° |
| CB | CG | SE | HG3 | 125.3° | 120.1° |
| CB | CG | HG2 | HG3 | 118.6° | 120.0° |
| CB | CG | SE | OE | 59.4° | 84.5° |
| CB | CG | SE | CE | 179.4° | 179.9° |
| HB2 | CB | CG | SE | 54.2° | 60.1° |
| HB2 | CB | CG | HG2 | 179.4° | NaN° |
| HB2 | CB | CG | HG3 | 71.1° | 60.0° |
| HB3 | CB | CG | SE | 55.3° | 60.0° |
| HB3 | CB | CG | HG2 | 69.9° | 60.0° |
| HB3 | CB | CG | HG3 | 179.5° | 180.0° |
| O | C | OXT | HXT | 0.6° | 0.0° |
| SE | CG | HG2 | HG3 | 118.5° | 120.0° |
| CG | SE | OE | CE | 113.4° | 95.5° |
| CG | SE | CE | HE1 | 180.0° | 180.0° |
| CG | SE | CE | HE2 | 54.8° | 60.0° |
| CG | SE | CE | HE3 | 54.7° | 60.0° |
| HG2 | CG | SE | OE | 175.3° | 35.5° |
| HG2 | CG | SE | CE | 55.4° | 60.0° |
| HG3 | CG | SE | OE | 65.8° | 155.5° |
| HG3 | CG | SE | CE | 54.1° | 60.0° |
| OE | SE | CE | HE1 | 63.1° | 84.5° |
| OE | SE | CE | HE2 | 171.7° | 155.5° |
| OE | SE | CE | HE3 | 62.2° | 35.5° |
| SE | CE | HE1 | HE2 | 125.3° | 120.0° |
| SE | CE | HE1 | HE3 | 125.3° | 120.0° |
| SE | CE | HE2 | HE3 | 120.6° | 120.0° |
| HE1 | CE | HE2 | HE3 | 120.6° | 120.0° |
