STN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CD1 | CG | sing | 1.53Å | 1.55Å | |
| CD1 | HD11 | sing | 1.09Å | 1.12Å | |
| CD1 | HD12 | sing | 1.09Å | 1.11Å | |
| CD1 | HD13 | sing | 1.09Å | 1.11Å | |
| CG | CB | sing | 1.53Å | 1.55Å | |
| CG | CD2 | sing | 1.53Å | 1.52Å | |
| CG | HG | sing | 1.09Å | 1.11Å | |
| CN | CA | sing | 1.53Å | 1.57Å | |
| CN | N | sing | 1.46Å | 1.46Å | |
| CN | HCN1 | sing | 1.09Å | 1.11Å | |
| CN | HCN2 | sing | 1.09Å | 1.11Å | |
| CA | CB | sing | 1.53Å | 1.58Å | |
| CA | C | sing | 1.51Å | 1.56Å | |
| CA | HA | sing | 1.09Å | 1.11Å | |
| CB | HCB1 | sing | 1.09Å | 1.12Å | |
| CB | HCB2 | sing | 1.09Å | 1.12Å | |
| CD2 | HD21 | sing | 1.09Å | 1.11Å | |
| CD2 | HD22 | sing | 1.09Å | 1.12Å | |
| CD2 | HD23 | sing | 1.09Å | 1.12Å | |
| C | O | doub | 1.21Å | 1.26Å | |
| C | OXT | sing | 1.34Å | 1.35Å | |
| CM | N | sing | 1.35Å | 1.33Å | |
| CM | OM | doub | 1.21Å | 1.18Å | |
| CM | HM | sing | 1.08Å | 1.10Å | |
| ON | N | sing | 1.41Å | 1.28Å | |
| ON | HN | sing | 0.97Å | 0.95Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CG | CD1 | HD11 | 110.4° | 109.5° |
| CG | CD1 | HD12 | 111.9° | 109.5° |
| CG | CD1 | HD13 | 111.8° | 109.4° |
| CD1 | CG | CB | 110.4° | 109.5° |
| CD1 | CG | CD2 | 105.0° | 109.5° |
| CD1 | CG | HG | 110.7° | 109.5° |
| HD11 | CD1 | HD12 | 111.9° | 109.5° |
| HD11 | CD1 | HD13 | 111.9° | 109.5° |
| HD12 | CD1 | HD13 | 98.5° | 109.5° |
| CB | CG | CD2 | 109.1° | 109.5° |
| CB | CG | HG | 110.7° | 109.4° |
| CG | CB | CA | 120.1° | 109.5° |
| CG | CB | HCB1 | 108.4° | 109.5° |
| CG | CB | HCB2 | 108.4° | 109.5° |
| CD2 | CG | HG | 110.7° | 109.5° |
| CG | CD2 | HD21 | 105.0° | 109.5° |
| CG | CD2 | HD22 | 113.9° | 109.5° |
| CG | CD2 | HD23 | 113.9° | 109.5° |
| CA | CN | N | 113.5° | 109.4° |
| CA | CN | HCN1 | 110.7° | 109.4° |
| CA | CN | HCN2 | 110.7° | 109.5° |
| CN | CA | CB | 110.5° | 109.5° |
| CN | CA | C | 105.1° | 109.5° |
| CN | CA | HA | 109.5° | 109.5° |
| N | CN | HCN1 | 110.7° | 109.5° |
| N | CN | HCN2 | 110.7° | 109.5° |
| CN | N | CM | 124.2° | 120.0° |
| CN | N | ON | 117.0° | 120.0° |
| HCN1 | CN | HCN2 | 99.6° | 109.5° |
| CB | CA | C | 112.5° | 109.5° |
| CB | CA | HA | 109.6° | 109.5° |
| CA | CB | HCB1 | 108.4° | 109.4° |
| CA | CB | HCB2 | 108.4° | 109.5° |
| C | CA | HA | 109.6° | 109.4° |
| CA | C | O | 119.6° | 120.1° |
| CA | C | OXT | 117.4° | 120.0° |
| HCB1 | CB | HCB2 | 101.6° | 109.4° |
| HD21 | CD2 | HD22 | 113.9° | 109.5° |
| HD21 | CD2 | HD23 | 113.9° | 109.4° |
| HD22 | CD2 | HD23 | 96.6° | 109.5° |
| O | C | OXT | 123.0° | 119.9° |
| C | OXT | HXT | 117.4° | 120.1° |
| N | CM | OM | 124.3° | 120.0° |
| N | CM | HM | 117.9° | 119.9° |
| CM | N | ON | 118.8° | 120.0° |
| OM | CM | HM | 117.8° | 120.1° |
| N | ON | HN | 116.9° | 106.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CG | CD1 | HD11 | HD12 | 125.3° | 120.0° |
| CG | CD1 | HD11 | HD13 | 125.2° | 120.0° |
| CG | CD1 | HD12 | HD13 | 117.8° | 120.0° |
| CD1 | CG | CB | CD2 | 114.9° | 120.0° |
| CD1 | CG | CB | HG | 123.0° | 120.0° |
| CD1 | CG | CD2 | HG | 119.6° | 120.0° |
| CD1 | CG | CB | CA | 65.7° | 174.7° |
| CD1 | CG | CB | HCB1 | 59.5° | 65.3° |
| CD1 | CG | CB | HCB2 | 169.0° | 54.6° |
| CD1 | CG | CD2 | HD21 | 180.0° | 62.4° |
| CD1 | CG | CD2 | HD22 | 54.7° | 177.5° |
| CD1 | CG | CD2 | HD23 | 54.7° | 57.5° |
| HD11 | CD1 | HD12 | HD13 | 117.8° | 120.0° |
| HD11 | CD1 | CG | CB | 180.0° | 179.9° |
| HD11 | CD1 | CG | CD2 | 62.5° | 60.0° |
| HD11 | CD1 | CG | HG | 57.0° | 60.0° |
| HD12 | CD1 | CG | CB | 54.7° | 59.9° |
| HD12 | CD1 | CG | CD2 | 62.7° | 180.0° |
| HD12 | CD1 | CG | HG | 177.7° | 60.0° |
| HD13 | CD1 | CG | CB | 54.7° | 60.1° |
| HD13 | CD1 | CG | CD2 | 172.2° | 60.0° |
| HD13 | CD1 | CG | HG | 68.3° | 180.0° |
| CB | CG | CD2 | HG | 122.1° | 119.9° |
| CG | CB | CA | CN | 179.0° | 65.9° |
| CG | CB | CA | HCB1 | 125.2° | 120.0° |
| CG | CB | CA | HCB2 | 125.3° | 120.0° |
| CG | CB | CA | C | 63.9° | 174.2° |
| CG | CB | CA | HA | 58.2° | 54.2° |
| CG | CB | HCB1 | HCB2 | 114.0° | 120.0° |
| CB | CG | CD2 | HD21 | 61.7° | 57.6° |
| CB | CG | CD2 | HD22 | 63.6° | 62.4° |
| CB | CG | CD2 | HD23 | 173.1° | 177.5° |
| CD2 | CG | CB | CA | 179.4° | 65.3° |
| CD2 | CG | CB | HCB1 | 55.4° | 54.7° |
| CD2 | CG | CB | HCB2 | 54.1° | 174.7° |
| CG | CD2 | HD21 | HD22 | 125.3° | 120.0° |
| CG | CD2 | HD21 | HD23 | 125.2° | 120.0° |
| CG | CD2 | HD22 | HD23 | 119.8° | 120.0° |
| HG | CG | CB | CA | 57.3° | 54.7° |
| HG | CG | CB | HCB1 | 177.5° | 174.7° |
| HG | CG | CB | HCB2 | 68.0° | 65.3° |
| HG | CG | CD2 | HD21 | 60.4° | 177.5° |
| HG | CG | CD2 | HD22 | 174.3° | 57.5° |
| HG | CG | CD2 | HD23 | 64.8° | 62.5° |
| CA | CN | N | HCN1 | 125.3° | 120.0° |
| CA | CN | N | HCN2 | 125.3° | 120.0° |
| CA | CN | HCN1 | HCN2 | 116.6° | 120.0° |
| CN | CA | CB | C | 117.1° | 120.0° |
| CN | CA | CB | HA | 120.8° | 120.1° |
| CN | CA | C | HA | 117.6° | 120.0° |
| CN | CA | CB | HCB1 | 53.8° | 174.1° |
| CN | CA | CB | HCB2 | 55.7° | 54.2° |
| CN | CA | C | O | 55.6° | 84.2° |
| CN | CA | C | OXT | 124.3° | 95.9° |
| CA | CN | N | CM | 104.9° | 90.0° |
| CA | CN | N | ON | 74.4° | 90.1° |
| N | CN | HCN1 | HCN2 | 116.6° | 120.0° |
| N | CN | CA | CB | 60.1° | 180.0° |
| N | CN | CA | C | 178.3° | 60.1° |
| N | CN | CA | HA | 60.7° | 59.9° |
| CN | N | CM | ON | 179.2° | 179.9° |
| CN | N | CM | OM | 179.1° | 180.0° |
| CN | N | CM | HM | 0.9° | 0.0° |
| CN | N | ON | HN | 180.0° | 180.0° |
| HCN1 | CN | CA | CB | 65.1° | 60.0° |
| HCN1 | CN | CA | C | 56.4° | 60.0° |
| HCN1 | CN | CA | HA | 174.0° | 180.0° |
| HCN1 | CN | N | CM | 20.4° | 30.0° |
| HCN1 | CN | N | ON | 160.3° | 150.0° |
| HCN2 | CN | CA | CB | 174.6° | 60.0° |
| HCN2 | CN | CA | C | 53.1° | 180.0° |
| HCN2 | CN | CA | HA | 64.6° | 60.0° |
| HCN2 | CN | N | CM | 129.9° | 150.0° |
| HCN2 | CN | N | ON | 50.9° | 29.9° |
| CB | CA | C | HA | 122.2° | 120.0° |
| CA | CB | HCB1 | HCB2 | 114.1° | 120.0° |
| CB | CA | C | O | 64.6° | 35.8° |
| CB | CA | C | OXT | 115.5° | 144.1° |
| C | CA | CB | HCB1 | 170.9° | 54.2° |
| C | CA | CB | HCB2 | 61.4° | 65.8° |
| CA | C | O | OXT | 179.9° | 180.0° |
| CA | C | OXT | HXT | 180.0° | 180.0° |
| HA | CA | CB | HCB1 | 67.0° | 65.8° |
| HA | CA | CB | HCB2 | 176.5° | 174.2° |
| HA | CA | C | O | 173.2° | 155.8° |
| HA | CA | C | OXT | 6.6° | 24.2° |
| HD21 | CD2 | HD22 | HD23 | 119.8° | 119.9° |
| O | C | OXT | HXT | 0.2° | 0.0° |
| N | CM | OM | HM | 180.0° | 180.0° |
| CM | N | ON | HN | 0.7° | 0.1° |
| OM | CM | N | ON | 0.2° | 0.1° |
| HM | CM | N | ON | 179.8° | 179.9° |
