MSE
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 | C | sing | 1.51Å | 1.53Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CA | HA | sing | 1.09Å | 1.12Å | |
| C | O | doub | 1.21Å | 1.25Å | |
| C | OXT | sing | 1.34Å | 1.25Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å | |
| CB | CG | sing | 1.53Å | 1.52Å | |
| CB | HB2 | sing | 1.09Å | 1.11Å | |
| CB | HB3 | sing | 1.09Å | 1.12Å | |
| CG | SE | sing | 1.96Å | 1.80Å | |
| CG | HG2 | sing | 1.09Å | 1.12Å | |
| CG | HG3 | sing | 1.09Å | 1.11Å | |
| SE | CE | sing | 1.96Å | 1.79Å | |
| CE | HE1 | sing | 1.09Å | 1.11Å | |
| CE | HE2 | sing | 1.09Å | 1.11Å | |
| CE | HE3 | sing | 1.09Å | 1.12Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | H | 112.3° | 106.7° |
| CA | N | H2 | 111.2° | 106.8° |
| N | CA | C | 112.3° | 109.5° |
| N | CA | CB | 110.0° | 109.4° |
| N | CA | HA | 107.2° | 109.4° |
| H | N | H2 | 111.2° | 106.7° |
| C | CA | CB | 109.5° | 109.5° |
| C | CA | HA | 107.7° | 109.5° |
| CA | C | O | 118.4° | 120.0° |
| CA | C | OXT | 117.8° | 120.0° |
| CB | CA | HA | 110.1° | 109.4° |
| CA | CB | CG | 114.0° | 109.6° |
| CA | CB | HB2 | 110.5° | 109.5° |
| CA | CB | HB3 | 110.5° | 109.5° |
| O | C | OXT | 123.8° | 120.0° |
| C | OXT | HXT | 117.8° | 120.0° |
| CG | CB | HB2 | 110.6° | 109.4° |
| CG | CB | HB3 | 110.6° | 109.5° |
| CB | CG | SE | 112.7° | 109.5° |
| CB | CG | HG2 | 111.0° | 109.4° |
| CB | CG | HG3 | 111.0° | 109.4° |
| HB2 | CB | HB3 | 99.8° | 109.4° |
| SE | CG | HG2 | 111.1° | 109.5° |
| SE | CG | HG3 | 111.0° | 109.5° |
| CG | SE | CE | 100.8° | 95.1° |
| HG2 | CG | HG3 | 99.3° | 109.4° |
| SE | CE | HE1 | 100.8° | 109.5° |
| SE | CE | HE2 | 115.5° | 109.5° |
| SE | CE | HE3 | 115.5° | 109.4° |
| HE1 | CE | HE2 | 115.6° | 109.5° |
| HE1 | CE | HE3 | 115.5° | 109.5° |
| HE2 | CE | HE3 | 95.0° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 125.3° | 113.9° |
| N | CA | C | CB | 122.5° | 120.0° |
| N | CA | C | HA | 117.8° | 120.0° |
| N | CA | CB | HA | 117.9° | 119.9° |
| N | CA | C | O | 4.6° | 30.1° |
| N | CA | C | OXT | 175.7° | 150.0° |
| N | CA | CB | CG | 59.8° | 59.9° |
| N | CA | CB | HB2 | 65.5° | 179.9° |
| N | CA | CB | HB3 | 175.0° | 60.1° |
| H | N | CA | C | 179.9° | 60.0° |
| H | N | CA | CB | 57.8° | 60.1° |
| H | N | CA | HA | 61.9° | 180.0° |
| H2 | N | CA | C | 54.7° | 173.7° |
| H2 | N | CA | CB | 67.5° | 53.6° |
| H2 | N | CA | HA | 172.8° | 66.2° |
| C | CA | CB | HA | 118.2° | 120.0° |
| CA | C | O | OXT | 179.8° | 179.9° |
| CA | C | OXT | HXT | 179.9° | 180.0° |
| C | CA | CB | CG | 176.4° | 180.0° |
| C | CA | CB | HB2 | 58.4° | 60.0° |
| C | CA | CB | HB3 | 51.1° | 59.9° |
| CB | CA | C | O | 117.9° | 90.0° |
| CB | CA | C | OXT | 61.8° | 90.0° |
| CA | CB | CG | HB2 | 125.2° | 120.1° |
| CA | CB | CG | HB3 | 125.2° | 120.0° |
| CA | CB | HB2 | HB3 | 116.4° | 120.0° |
| CA | CB | CG | SE | 179.5° | 180.0° |
| CA | CB | CG | HG2 | 55.2° | 59.9° |
| CA | CB | CG | HG3 | 54.2° | 60.0° |
| HA | CA | C | O | 122.3° | 150.1° |
| HA | CA | C | OXT | 57.9° | 30.0° |
| HA | CA | CB | CG | 58.1° | 60.0° |
| HA | CA | CB | HB2 | 176.6° | 60.0° |
| HA | CA | CB | HB3 | 67.1° | 180.0° |
| O | C | OXT | HXT | 0.3° | 0.0° |
| CG | CB | HB2 | HB3 | 116.4° | 119.9° |
| CB | CG | SE | HG2 | 125.3° | 120.0° |
| CB | CG | SE | HG3 | 125.3° | 120.0° |
| CB | CG | HG2 | HG3 | 116.8° | 119.9° |
| CB | CG | SE | CE | 90.7° | 180.0° |
| HB2 | CB | CG | SE | 54.3° | 59.9° |
| HB2 | CB | CG | HG2 | 179.6° | 180.0° |
| HB2 | CB | CG | HG3 | 71.0° | 60.1° |
| HB3 | CB | CG | SE | 55.3° | 59.9° |
| HB3 | CB | CG | HG2 | 70.0° | 60.2° |
| HB3 | CB | CG | HG3 | 179.4° | 180.0° |
| SE | CG | HG2 | HG3 | 116.9° | 120.0° |
| CG | SE | CE | HE1 | 180.0° | 180.0° |
| CG | SE | CE | HE2 | 54.7° | 60.0° |
| CG | SE | CE | HE3 | 54.7° | 60.0° |
| HG2 | CG | SE | CE | 144.1° | 60.0° |
| HG3 | CG | SE | CE | 34.6° | 60.0° |
| SE | CE | HE1 | HE2 | 125.2° | 120.0° |
| SE | CE | HE1 | HE3 | 125.2° | 120.0° |
| SE | CE | HE2 | HE3 | 121.3° | 119.9° |
| HE1 | CE | HE2 | HE3 | 121.4° | 120.0° |
