ZKO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| NE2 | CD | sing | 1.35Å | 1.33Å | |
| CD | OE1 | doub | 1.21Å | 1.24Å | |
| CD | CG | sing | 1.51Å | 1.51Å | |
| CG | CB | sing | 1.53Å | 1.53Å | |
| CB | CA | sing | 1.53Å | 1.54Å | |
| CA | N | sing | 1.47Å | 1.45Å | |
| N | C5 | sing | 1.35Å | 1.35Å | |
| C5 | O2 | doub | 1.21Å | 1.24Å | |
| C5 | C6 | sing | 1.51Å | 1.51Å | |
| C6 | C7 | sing | 1.53Å | 1.51Å | |
| C7 | C8 | sing | 1.51Å | 1.50Å | |
| C8 | O3 | sing | 1.34Å | 1.31Å | |
| C8 | O4 | doub | 1.21Å | 1.22Å | |
| CA | C | sing | 1.51Å | 1.53Å | |
| C | OXT | sing | 1.34Å | 1.31Å | |
| C | O | doub | 1.21Å | 1.21Å | |
| NE2 | HE21 | sing | 0.97Å | 1.00Å | |
| NE2 | HE22 | sing | 0.97Å | 1.00Å | |
| CG | HG2 | sing | 1.09Å | 1.10Å | |
| CG | HG3 | sing | 1.09Å | 1.10Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| CB | HB3 | sing | 1.09Å | 1.10Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| N | H | sing | 0.97Å | 1.00Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C7 | H11 | sing | 1.09Å | 1.10Å | |
| C7 | H12 | sing | 1.09Å | 1.10Å | |
| O3 | H13 | 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) |
| NE2 | CD | OE1 | 122.3° | 120.0° |
| NE2 | CD | CG | 116.3° | 120.0° |
| CD | NE2 | HE21 | 120.0° | 120.0° |
| CD | NE2 | HE22 | 120.0° | 120.0° |
| OE1 | CD | CG | 121.3° | 120.0° |
| CD | CG | CB | 113.2° | 109.5° |
| CD | CG | HG2 | 108.5° | 109.5° |
| CD | CG | HG3 | 108.5° | 109.5° |
| CG | CB | CA | 114.0° | 109.5° |
| CB | CG | HG2 | 108.6° | 109.5° |
| CB | CG | HG3 | 108.6° | 109.5° |
| CG | CB | HB2 | 108.3° | 109.5° |
| CG | CB | HB3 | 108.3° | 109.5° |
| CB | CA | N | 112.8° | 109.5° |
| CB | CA | C | 110.4° | 109.5° |
| CA | CB | HB2 | 108.3° | 109.4° |
| CA | CB | HB3 | 108.3° | 109.5° |
| CB | CA | HA | 107.5° | 109.5° |
| CA | N | C5 | 125.3° | 120.0° |
| N | CA | C | 109.8° | 109.4° |
| N | CA | HA | 108.5° | 109.5° |
| CA | N | H | 117.3° | 120.0° |
| N | C5 | O2 | 122.3° | 120.0° |
| N | C5 | C6 | 116.6° | 120.0° |
| C5 | N | H | 117.4° | 120.0° |
| O2 | C5 | C6 | 121.1° | 120.1° |
| C5 | C6 | C7 | 111.7° | 109.5° |
| C5 | C6 | H9 | 108.9° | 109.5° |
| C5 | C6 | H10 | 108.9° | 109.5° |
| C6 | C7 | C8 | 113.3° | 109.5° |
| C7 | C6 | H9 | 108.9° | 109.4° |
| C7 | C6 | H10 | 108.9° | 109.5° |
| C6 | C7 | H11 | 108.5° | 109.4° |
| C6 | C7 | H12 | 108.5° | 109.5° |
| C7 | C8 | O3 | 113.3° | 120.0° |
| C7 | C8 | O4 | 123.7° | 120.0° |
| C8 | C7 | H11 | 108.5° | 109.5° |
| C8 | C7 | H12 | 108.5° | 109.5° |
| O3 | C8 | O4 | 123.0° | 120.0° |
| C8 | O3 | H13 | 109.5° | 117.0° |
| CA | C | OXT | 112.2° | 120.0° |
| CA | C | O | 123.2° | 120.0° |
| C | CA | HA | 107.6° | 109.5° |
| OXT | C | O | 124.6° | 120.0° |
| C | OXT | HXT | 109.5° | 117.0° |
| HE21 | NE2 | HE22 | 120.0° | 120.0° |
| HG2 | CG | HG3 | 109.5° | 109.5° |
| HB2 | CB | HB3 | 109.5° | 109.5° |
| H9 | C6 | H10 | 109.4° | 109.5° |
| H11 | C7 | H12 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| NE2 | CD | OE1 | CG | 180.0° | 179.9° |
| NE2 | CD | CG | CB | 77.8° | 180.0° |
| CD | NE2 | HE21 | HE22 | 180.0° | 179.8° |
| NE2 | CD | CG | HG2 | 161.6° | 59.9° |
| NE2 | CD | CG | HG3 | 42.8° | 60.1° |
| OE1 | CD | CG | CB | 102.2° | 0.1° |
| OE1 | CD | NE2 | HE21 | 0.0° | 0.0° |
| OE1 | CD | NE2 | HE22 | 180.0° | 179.8° |
| OE1 | CD | CG | HG2 | 18.3° | 120.0° |
| OE1 | CD | CG | HG3 | 137.2° | 120.1° |
| CD | CG | CB | HG2 | 120.5° | 120.1° |
| CD | CG | CB | HG3 | 120.5° | 120.0° |
| CD | CG | CB | CA | 172.3° | 179.9° |
| CG | CD | NE2 | HE21 | 180.0° | 179.9° |
| CG | CD | NE2 | HE22 | 0.1° | 0.3° |
| CD | CG | HG2 | HG3 | 118.3° | 120.0° |
| CD | CG | CB | HB2 | 67.1° | 60.0° |
| CD | CG | CB | HB3 | 51.6° | 60.0° |
| CG | CB | CA | HB2 | 120.7° | 120.0° |
| CG | CB | CA | HB3 | 120.6° | 120.0° |
| CG | CB | CA | N | 162.7° | 65.1° |
| CG | CB | CA | C | 74.0° | 175.0° |
| CB | CG | HG2 | HG3 | 118.4° | 120.0° |
| CG | CB | HB2 | HB3 | 117.9° | 120.0° |
| CG | CB | CA | HA | 43.1° | 55.0° |
| CB | CA | N | C | 123.7° | 119.9° |
| CB | CA | N | HA | 119.0° | 120.0° |
| CB | CA | N | C5 | 162.1° | 155.0° |
| CB | CA | C | HA | 117.0° | 120.0° |
| CB | CA | C | OXT | 95.7° | 60.0° |
| CB | CA | C | O | 84.0° | 119.9° |
| CA | CB | CG | HG2 | 51.7° | 60.0° |
| CA | CB | CG | HG3 | 67.2° | 60.0° |
| CA | CB | HB2 | HB3 | 118.0° | 120.0° |
| CB | CA | N | H | 17.9° | 24.9° |
| CA | N | C5 | H | 180.0° | 179.9° |
| CA | N | C5 | O2 | 0.4° | 0.1° |
| CA | N | C5 | C6 | 179.5° | 180.0° |
| N | CA | C | HA | 117.9° | 120.0° |
| N | CA | C | OXT | 139.3° | 180.0° |
| N | CA | C | O | 41.0° | 0.0° |
| N | CA | CB | HB2 | 76.6° | 175.0° |
| N | CA | CB | HB3 | 42.1° | 55.0° |
| N | C5 | O2 | C6 | 179.9° | 179.9° |
| N | C5 | C6 | C7 | 82.9° | 179.9° |
| C5 | N | CA | C | 74.3° | 85.1° |
| C5 | N | CA | HA | 43.0° | 34.9° |
| N | C5 | C6 | H9 | 156.7° | 60.0° |
| N | C5 | C6 | H10 | 37.4° | 60.1° |
| O2 | C5 | C6 | C7 | 97.2° | 0.0° |
| O2 | C5 | N | H | 179.6° | 180.0° |
| O2 | C5 | C6 | H9 | 23.2° | 119.9° |
| O2 | C5 | C6 | H10 | 142.5° | 120.0° |
| C5 | C6 | C7 | H9 | 120.3° | 120.0° |
| C5 | C6 | C7 | H10 | 120.3° | 120.0° |
| C5 | C6 | C7 | C8 | 174.4° | 180.0° |
| C6 | C5 | N | H | 0.5° | 0.1° |
| C5 | C6 | H9 | H10 | 118.9° | 120.0° |
| C5 | C6 | C7 | H11 | 65.0° | 60.0° |
| C5 | C6 | C7 | H12 | 53.9° | 60.0° |
| C6 | C7 | C8 | H11 | 120.6° | 119.9° |
| C6 | C7 | C8 | H12 | 120.6° | 120.0° |
| C6 | C7 | C8 | O3 | 79.5° | 180.0° |
| C6 | C7 | C8 | O4 | 100.5° | 0.0° |
| C7 | C6 | H9 | H10 | 119.0° | 120.0° |
| C6 | C7 | H11 | H12 | 118.3° | 120.0° |
| C7 | C8 | O3 | O4 | 180.0° | 180.0° |
| C8 | C7 | C6 | H9 | 54.1° | 60.0° |
| C8 | C7 | C6 | H10 | 65.2° | 60.0° |
| C8 | C7 | H11 | H12 | 118.2° | 120.0° |
| C7 | C8 | O3 | H13 | 179.9° | 180.0° |
| O3 | C8 | C7 | H11 | 41.1° | 60.0° |
| O3 | C8 | C7 | H12 | 159.9° | 60.0° |
| O4 | C8 | C7 | H11 | 139.0° | 120.0° |
| O4 | C8 | C7 | H12 | 20.1° | 120.0° |
| O4 | C8 | O3 | H13 | 0.0° | 0.1° |
| CA | C | OXT | O | 179.7° | 180.0° |
| C | CA | CB | HB2 | 46.7° | 55.1° |
| C | CA | CB | HB3 | 165.4° | 64.9° |
| C | CA | N | H | 105.7° | 95.0° |
| CA | C | OXT | HXT | 179.6° | 180.0° |
| OXT | C | CA | HA | 21.4° | 60.0° |
| O | C | CA | HA | 159.0° | 120.0° |
| O | C | OXT | HXT | 0.0° | 0.1° |
| HG2 | CG | CB | HB2 | 172.4° | 180.0° |
| HG2 | CG | CB | HB3 | 68.9° | 60.0° |
| HG3 | CG | CB | HB2 | 53.5° | 60.0° |
| HG3 | CG | CB | HB3 | 172.1° | 180.0° |
| HB2 | CB | CA | HA | 163.8° | 65.0° |
| HB3 | CB | CA | HA | 77.5° | 175.0° |
| HA | CA | N | H | 137.0° | 145.0° |
| H9 | C6 | C7 | H11 | 174.6° | 180.0° |
| H9 | C6 | C7 | H12 | 66.5° | 60.0° |
| H10 | C6 | C7 | H11 | 55.3° | 60.0° |
| H10 | C6 | C7 | H12 | 174.2° | 180.0° |
