KYQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CA | N | sing | 1.47Å | 1.47Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CB | CA | sing | 1.53Å | 1.52Å | |
| CA | C | sing | 1.51Å | 1.50Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CG | CB | sing | 1.53Å | 1.53Å | |
| CB | HB | sing | 1.09Å | 1.10Å | |
| CB | HBA | sing | 1.09Å | 1.10Å | |
| CD | CG | sing | 1.53Å | 1.52Å | |
| CG | HG | sing | 1.09Å | 1.10Å | |
| CG | HGA | sing | 1.09Å | 1.10Å | |
| CE | CD | sing | 1.53Å | 1.53Å | |
| CD | HD | sing | 1.09Å | 1.10Å | |
| CD | HDA | sing | 1.09Å | 1.10Å | |
| NZ | CE | sing | 1.47Å | 1.47Å | |
| CE | HE | sing | 1.09Å | 1.10Å | |
| CE | HEA | sing | 1.09Å | 1.10Å | |
| C11 | NZ | doub | 1.28Å | 1.28Å | |
| C12 | C11 | sing | 1.48Å | 1.47Å | |
| C13 | C11 | sing | 1.51Å | 1.51Å | |
| O15 | C12 | doub | 1.21Å | 1.27Å | |
| C12 | O16 | sing | 1.35Å | 1.27Å | |
| O16 | HO16 | sing | 0.97Å | 0.95Å | |
| O14 | C13 | sing | 1.43Å | 1.44Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| O14 | HO14 | sing | 0.97Å | 0.95Å | |
| C | O | doub | 1.21Å | 1.25Å | |
| C | OXT | sing | 1.34Å | 1.33Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | H | 109.5° | 110.9° |
| CA | N | H2 | 109.4° | 111.0° |
| N | CA | CB | 110.3° | 109.4° |
| N | CA | C | 107.0° | 109.5° |
| N | CA | HA | 110.6° | 109.5° |
| H | N | H2 | 109.5° | 111.0° |
| CB | CA | C | 109.7° | 109.5° |
| CB | CA | HA | 108.0° | 109.4° |
| CA | CB | CG | 113.3° | 109.5° |
| CA | CB | HB | 108.2° | 109.4° |
| CA | CB | HBA | 107.3° | 109.5° |
| C | CA | HA | 111.2° | 109.5° |
| CA | C | O | 121.4° | 120.0° |
| CA | C | OXT | 115.7° | 120.0° |
| CG | CB | HB | 108.2° | 109.5° |
| CG | CB | HBA | 107.4° | 109.5° |
| CB | CG | CD | 113.1° | 109.5° |
| CB | CG | HG | 108.3° | 109.5° |
| CB | CG | HGA | 107.5° | 109.5° |
| HB | CB | HBA | 112.5° | 109.5° |
| CD | CG | HG | 108.3° | 109.5° |
| CD | CG | HGA | 107.5° | 109.5° |
| CG | CD | CE | 109.1° | 109.5° |
| CG | CD | HD | 109.6° | 109.5° |
| CG | CD | HDA | 109.7° | 109.5° |
| HG | CG | HGA | 112.3° | 109.5° |
| CE | CD | HD | 109.6° | 109.5° |
| CE | CD | HDA | 109.7° | 109.5° |
| CD | CE | NZ | 104.0° | 109.5° |
| CD | CE | HE | 111.4° | 109.4° |
| CD | CE | HEA | 112.6° | 109.5° |
| HD | CD | HDA | 109.2° | 109.4° |
| NZ | CE | HE | 111.3° | 109.4° |
| NZ | CE | HEA | 112.5° | 109.5° |
| CE | NZ | C11 | 131.6° | 120.0° |
| HE | CE | HEA | 105.3° | 109.5° |
| NZ | C11 | C12 | 121.0° | 120.0° |
| NZ | C11 | C13 | 119.5° | 120.0° |
| C12 | C11 | C13 | 119.4° | 120.0° |
| C11 | C12 | O15 | 117.0° | 120.0° |
| C11 | C12 | O16 | 119.2° | 120.0° |
| C11 | C13 | O14 | 110.0° | 109.5° |
| C11 | C13 | H13 | 109.3° | 109.5° |
| C11 | C13 | H13A | 109.2° | 109.5° |
| O15 | C12 | O16 | 123.7° | 120.0° |
| C12 | O16 | HO16 | 109.5° | 117.0° |
| O14 | C13 | H13 | 109.3° | 109.5° |
| O14 | C13 | H13A | 109.2° | 109.4° |
| C13 | O14 | HO14 | 109.5° | 114.0° |
| H13 | C13 | H13A | 109.9° | 109.4° |
| O | C | OXT | 122.8° | 120.0° |
| C | OXT | HXT | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 120.0° | 123.9° |
| N | CA | CB | C | 117.6° | 120.0° |
| N | CA | CB | HA | 121.0° | 120.0° |
| N | CA | C | HA | 120.9° | 120.1° |
| N | CA | CB | CG | 179.2° | 65.0° |
| N | CA | CB | HB | 60.8° | 55.0° |
| N | CA | CB | HBA | 60.9° | 175.0° |
| N | CA | C | O | 71.1° | 19.9° |
| N | CA | C | OXT | 107.2° | 160.0° |
| H | N | CA | CB | 140.2° | 176.0° |
| H | N | CA | C | 20.9° | 64.0° |
| H | N | CA | HA | 100.4° | 56.1° |
| H2 | N | CA | CB | 20.2° | 60.1° |
| H2 | N | CA | C | 99.1° | 59.9° |
| H2 | N | CA | HA | 139.6° | 180.0° |
| CB | CA | C | HA | 119.4° | 120.0° |
| CA | CB | CG | HB | 120.0° | 119.9° |
| CA | CB | CG | HBA | 118.3° | 120.0° |
| CA | CB | HB | HBA | 118.4° | 120.0° |
| CA | CB | CG | CD | 177.2° | 180.0° |
| CA | CB | CG | HG | 57.2° | 60.0° |
| CA | CB | CG | HGA | 64.3° | 60.0° |
| CB | CA | C | O | 48.6° | 100.0° |
| CB | CA | C | OXT | 133.1° | 80.0° |
| C | CA | CB | CG | 61.5° | 175.0° |
| C | CA | CB | HB | 178.4° | 65.0° |
| C | CA | CB | HBA | 56.8° | 55.0° |
| CA | C | O | OXT | 178.1° | 179.9° |
| CA | C | OXT | HXT | 178.2° | 179.9° |
| HA | CA | CB | CG | 59.8° | 55.0° |
| HA | CA | CB | HB | 60.2° | 175.0° |
| HA | CA | CB | HBA | 178.1° | 65.1° |
| HA | CA | C | O | 168.0° | 140.0° |
| HA | CA | C | OXT | 13.7° | 39.9° |
| CG | CB | HB | HBA | 118.5° | 120.1° |
| CB | CG | CD | HG | 120.0° | 120.0° |
| CB | CG | CD | HGA | 118.5° | 120.0° |
| CB | CG | HG | HGA | 118.5° | 120.0° |
| CB | CG | CD | CE | 174.9° | 180.0° |
| CB | CG | CD | HD | 65.1° | 60.0° |
| CB | CG | CD | HDA | 54.8° | 60.0° |
| HB | CB | CG | CD | 62.8° | 60.1° |
| HB | CB | CG | HG | 177.2° | 179.9° |
| HB | CB | CG | HGA | 55.6° | 59.9° |
| HBA | CB | CG | CD | 58.9° | 60.0° |
| HBA | CB | CG | HG | 61.1° | 60.0° |
| HBA | CB | CG | HGA | 177.3° | 180.0° |
| CD | CG | HG | HGA | 118.5° | 120.0° |
| CG | CD | CE | HD | 120.0° | 120.0° |
| CG | CD | CE | HDA | 120.2° | 120.0° |
| CG | CD | HD | HDA | 120.1° | 120.0° |
| CG | CD | CE | NZ | 178.7° | 180.0° |
| CG | CD | CE | HE | 58.7° | 60.0° |
| CG | CD | CE | HEA | 59.3° | 60.0° |
| HG | CG | CD | CE | 54.9° | 60.0° |
| HG | CG | CD | HD | 174.9° | 180.0° |
| HG | CG | CD | HDA | 65.2° | 60.0° |
| HGA | CG | CD | CE | 66.6° | 60.0° |
| HGA | CG | CD | HD | 53.4° | 60.0° |
| HGA | CG | CD | HDA | 173.2° | 179.9° |
| CE | CD | HD | HDA | 120.2° | 120.0° |
| CD | CE | NZ | HE | 120.0° | 120.0° |
| CD | CE | NZ | HEA | 122.1° | 120.0° |
| CD | CE | HE | HEA | 122.3° | 120.0° |
| CD | CE | NZ | C11 | 174.2° | 114.8° |
| HD | CD | CE | NZ | 61.3° | 60.0° |
| HD | CD | CE | HE | 178.7° | 180.0° |
| HD | CD | CE | HEA | 60.7° | 60.0° |
| HDA | CD | CE | NZ | 58.5° | 60.0° |
| HDA | CD | CE | HE | 61.4° | 60.0° |
| HDA | CD | CE | HEA | 179.4° | 180.0° |
| NZ | CE | HE | HEA | 122.2° | 120.0° |
| CE | NZ | C11 | C12 | 178.1° | 175.2° |
| CE | NZ | C11 | C13 | 0.2° | 4.8° |
| HE | CE | NZ | C11 | 54.2° | 5.2° |
| HEA | CE | NZ | C11 | 63.8° | 125.2° |
| NZ | C11 | C12 | C13 | 177.9° | 180.0° |
| NZ | C11 | C12 | O15 | 175.2° | 180.0° |
| NZ | C11 | C12 | O16 | 6.9° | 0.0° |
| NZ | C11 | C13 | O14 | 72.3° | 174.5° |
| NZ | C11 | C13 | H13 | 167.7° | 54.5° |
| NZ | C11 | C13 | H13A | 47.5° | 65.5° |
| C11 | C12 | O15 | O16 | 177.8° | 180.0° |
| C11 | C12 | O16 | HO16 | 177.7° | 180.0° |
| C12 | C11 | C13 | O14 | 109.8° | 5.5° |
| C12 | C11 | C13 | H13 | 10.2° | 125.5° |
| C12 | C11 | C13 | H13A | 130.4° | 114.5° |
| C13 | C11 | C12 | O15 | 6.9° | 0.0° |
| C13 | C11 | C12 | O16 | 170.9° | 180.0° |
| C11 | C13 | O14 | H13 | 120.0° | 120.1° |
| C11 | C13 | O14 | H13A | 119.8° | 120.0° |
| C11 | C13 | H13 | H13A | 119.8° | 120.0° |
| C11 | C13 | O14 | HO14 | 95.8° | 180.0° |
| O15 | C12 | O16 | HO16 | 0.0° | 0.0° |
| O14 | C13 | H13 | H13A | 119.8° | 119.9° |
| H13 | C13 | O14 | HO14 | 24.2° | 59.9° |
| H13A | C13 | O14 | HO14 | 144.4° | 60.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
