TS9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.47Å | |
| CA | C | sing | 1.51Å | 1.52Å | |
| CA | CB | sing | 1.53Å | 1.56Å | |
| C | OXT | sing | 1.34Å | 1.75Å | |
| C | O | doub | 1.21Å | 1.28Å | |
| CB | OG3 | sing | 1.43Å | 1.42Å | |
| CB | CG2 | sing | 1.53Å | 1.50Å | |
| CB | CG1 | sing | 1.53Å | 1.55Å | |
| CG1 | OD2 | sing | 1.43Å | 1.45Å | |
| CG1 | CD1 | sing | 1.53Å | 1.53Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å | |
| OG3 | HG3 | sing | 0.97Å | 0.95Å | |
| CG2 | HG21 | sing | 1.09Å | 1.10Å | |
| CG2 | HG22 | sing | 1.09Å | 1.10Å | |
| CG2 | HG23 | sing | 1.09Å | 1.10Å | |
| CG1 | HG1 | sing | 1.09Å | 1.10Å | |
| OD2 | HD2 | sing | 0.97Å | 0.95Å | |
| CD1 | HD11 | sing | 1.09Å | 1.10Å | |
| CD1 | HD12 | sing | 1.09Å | 1.10Å | |
| CD1 | HD13 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N | CA | C | 108.5° | 109.5° |
| N | CA | CB | 111.2° | 109.5° |
| CA | N | H | 109.5° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| N | CA | HA | 109.7° | 109.4° |
| C | CA | CB | 111.5° | 109.5° |
| CA | C | OXT | 118.7° | 120.0° |
| CA | C | O | 126.1° | 120.0° |
| C | CA | HA | 109.3° | 109.5° |
| CA | CB | OG3 | 109.5° | 109.4° |
| CA | CB | CG2 | 109.9° | 109.5° |
| CA | CB | CG1 | 108.7° | 109.4° |
| CB | CA | HA | 106.6° | 109.5° |
| OXT | C | O | 114.8° | 120.0° |
| C | OXT | HXT | 109.5° | 117.0° |
| OG3 | CB | CG2 | 111.1° | 109.5° |
| OG3 | CB | CG1 | 105.7° | 109.5° |
| CB | OG3 | HG3 | 109.5° | 114.0° |
| CG2 | CB | CG1 | 111.9° | 109.5° |
| CB | CG2 | HG21 | 109.5° | 109.5° |
| CB | CG2 | HG22 | 109.5° | 109.5° |
| CB | CG2 | HG23 | 109.5° | 109.5° |
| CB | CG1 | OD2 | 106.2° | 109.5° |
| CB | CG1 | CD1 | 115.0° | 109.4° |
| CB | CG1 | HG1 | 108.6° | 109.5° |
| OD2 | CG1 | CD1 | 111.2° | 109.5° |
| OD2 | CG1 | HG1 | 112.6° | 109.5° |
| CG1 | OD2 | HD2 | 109.5° | 114.0° |
| CD1 | CG1 | HG1 | 103.3° | 109.4° |
| CG1 | CD1 | HD11 | 109.5° | 109.5° |
| CG1 | CD1 | HD12 | 109.5° | 109.5° |
| CG1 | CD1 | HD13 | 109.4° | 109.5° |
| H | N | H2 | 109.4° | 111.0° |
| HG21 | CG2 | HG22 | 109.4° | 109.4° |
| HG21 | CG2 | HG23 | 109.5° | 109.5° |
| HG22 | CG2 | HG23 | 109.4° | 109.5° |
| HD11 | CD1 | HD12 | 109.4° | 109.4° |
| HD11 | CD1 | HD13 | 109.4° | 109.5° |
| HD12 | CD1 | HD13 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N | CA | C | CB | 122.8° | 120.0° |
| N | CA | C | HA | 119.6° | 120.0° |
| N | CA | CB | HA | 119.5° | 120.0° |
| N | CA | C | OXT | 107.6° | 160.0° |
| N | CA | C | O | 65.5° | 20.0° |
| N | CA | CB | OG3 | 49.5° | 65.0° |
| N | CA | CB | CG2 | 171.8° | 175.0° |
| N | CA | CB | CG1 | 65.4° | 55.0° |
| CA | N | H | H2 | 120.0° | 123.9° |
| C | CA | CB | HA | 119.3° | 120.0° |
| CA | C | OXT | O | 173.9° | 180.0° |
| C | CA | CB | OG3 | 71.7° | 55.0° |
| C | CA | CB | CG2 | 50.5° | 65.0° |
| C | CA | CB | CG1 | 173.3° | 175.0° |
| C | CA | N | H | 180.0° | 63.9° |
| C | CA | N | H2 | 60.0° | 60.0° |
| CA | C | OXT | HXT | 173.8° | 179.9° |
| CB | CA | C | OXT | 129.6° | 80.0° |
| CB | CA | C | O | 57.3° | 100.0° |
| CA | CB | OG3 | CG2 | 121.5° | 120.0° |
| CA | CB | OG3 | CG1 | 116.9° | 119.9° |
| CA | CB | CG2 | CG1 | 120.9° | 120.0° |
| CA | CB | CG1 | OD2 | 58.3° | 55.0° |
| CA | CB | CG1 | CD1 | 178.2° | 175.0° |
| CB | CA | N | H | 57.0° | 176.0° |
| CB | CA | N | H2 | 177.0° | 60.1° |
| CA | CB | OG3 | HG3 | 180.0° | 60.0° |
| CA | CB | CG2 | HG21 | 180.0° | 60.0° |
| CA | CB | CG2 | HG22 | 60.0° | 180.0° |
| CA | CB | CG2 | HG23 | 60.0° | 60.0° |
| CA | CB | CG1 | HG1 | 63.0° | 65.0° |
| OXT | C | CA | HA | 12.0° | 40.0° |
| O | C | CA | HA | 174.9° | 140.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| OG3 | CB | CG2 | CG1 | 117.9° | 120.1° |
| OG3 | CB | CG1 | OD2 | 175.7° | 175.0° |
| OG3 | CB | CG1 | CD1 | 60.8° | 65.0° |
| OG3 | CB | CA | HA | 169.0° | 175.0° |
| OG3 | CB | CG2 | HG21 | 58.7° | 180.0° |
| OG3 | CB | CG2 | HG22 | 61.3° | 60.1° |
| OG3 | CB | CG2 | HG23 | 178.8° | 60.0° |
| OG3 | CB | CG1 | HG1 | 54.4° | 54.9° |
| CG2 | CB | CG1 | OD2 | 63.2° | 65.0° |
| CG2 | CB | CG1 | CD1 | 60.2° | 55.0° |
| CG2 | CB | CA | HA | 68.7° | 55.0° |
| CG2 | CB | OG3 | HG3 | 58.5° | 180.0° |
| CB | CG2 | HG21 | HG22 | 120.0° | 120.0° |
| CB | CG2 | HG21 | HG23 | 120.0° | 120.0° |
| CB | CG2 | HG22 | HG23 | 120.0° | 120.0° |
| CG2 | CB | CG1 | HG1 | 175.4° | 175.0° |
| CB | CG1 | OD2 | CD1 | 125.8° | 119.9° |
| CB | CG1 | OD2 | HG1 | 118.7° | 120.1° |
| CB | CG1 | CD1 | HG1 | 118.2° | 120.0° |
| CG1 | CB | CA | HA | 54.1° | 65.0° |
| CG1 | CB | OG3 | HG3 | 63.1° | 59.9° |
| CG1 | CB | CG2 | HG21 | 59.1° | 59.9° |
| CG1 | CB | CG2 | HG22 | 179.1° | 60.0° |
| CG1 | CB | CG2 | HG23 | 60.9° | 180.0° |
| CB | CG1 | OD2 | HD2 | 180.0° | 60.0° |
| CB | CG1 | CD1 | HD11 | 180.0° | 60.0° |
| CB | CG1 | CD1 | HD12 | 60.0° | 180.0° |
| CB | CG1 | CD1 | HD13 | 60.0° | 60.0° |
| OD2 | CG1 | CD1 | HG1 | 121.1° | 120.0° |
| OD2 | CG1 | CD1 | HD11 | 59.2° | 60.0° |
| OD2 | CG1 | CD1 | HD12 | 179.2° | 60.0° |
| OD2 | CG1 | CD1 | HD13 | 60.8° | 180.0° |
| CD1 | CG1 | OD2 | HD2 | 54.2° | 59.9° |
| CG1 | CD1 | HD11 | HD12 | 120.0° | 120.0° |
| CG1 | CD1 | HD11 | HD13 | 120.0° | 120.0° |
| CG1 | CD1 | HD12 | HD13 | 120.0° | 120.0° |
| H | N | CA | HA | 60.6° | 56.1° |
| H2 | N | CA | HA | 59.4° | 180.0° |
| HG21 | CG2 | HG22 | HG23 | 120.0° | 120.0° |
| HG1 | CG1 | OD2 | HD2 | 61.2° | 179.9° |
| HG1 | CG1 | CD1 | HD11 | 61.8° | 180.0° |
| HG1 | CG1 | CD1 | HD12 | 58.1° | 60.0° |
| HG1 | CG1 | CD1 | HD13 | 178.2° | 60.0° |
| HD11 | CD1 | HD12 | HD13 | 120.0° | 120.0° |
