KAI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CD | sing | 1.48Å | 1.51Å | |
| N | CA | sing | 1.48Å | 1.44Å | |
| N | HN1 | sing | 1.01Å | 1.00Å | |
| CD | CG | sing | 1.55Å | 1.59Å | |
| CD | HD1 | sing | 1.09Å | 1.10Å | |
| CD | HD2 | sing | 1.09Å | 1.10Å | |
| CD1 | CG2 | doub | 1.31Å | 1.28Å | |
| CD1 | HD11 | sing | 1.08Å | 1.08Å | |
| CD1 | HD12 | sing | 1.08Å | 1.08Å | |
| CD2 | CG2 | sing | 1.51Å | 1.48Å | |
| CD2 | HD21 | sing | 1.09Å | 1.10Å | |
| CD2 | HD22 | sing | 1.09Å | 1.10Å | |
| CD2 | HD23 | sing | 1.09Å | 1.10Å | |
| CA | CB | sing | 1.54Å | 1.51Å | |
| CA | C | sing | 1.51Å | 1.55Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | CB1 | sing | 1.53Å | 1.60Å | |
| CB | CG | sing | 1.55Å | 1.50Å | |
| CB | HB | sing | 1.09Å | 1.10Å | |
| CB1 | CG1 | sing | 1.51Å | 1.54Å | |
| CB1 | HB11 | sing | 1.09Å | 1.10Å | |
| CB1 | HB12 | sing | 1.09Å | 1.10Å | |
| CG | CG2 | sing | 1.51Å | 1.53Å | |
| CG | HG | sing | 1.09Å | 1.10Å | |
| CG1 | OD1 | sing | 1.34Å | 1.24Å | |
| CG1 | OD2 | doub | 1.21Å | 1.24Å | |
| C | O | doub | 1.21Å | 1.25Å | |
| C | OXT | sing | 1.34Å | 1.25Å | |
| OD1 | HOD1 | 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) |
| CD | N | CA | 107.9° | 105.8° |
| CD | N | HN1 | 110.0° | 111.0° |
| N | CD | CG | 101.2° | 103.2° |
| N | CD | HD1 | 112.3° | 110.7° |
| N | CD | HD2 | 114.0° | 110.7° |
| CA | N | HN1 | 110.0° | 111.0° |
| N | CA | CB | 110.4° | 107.1° |
| N | CA | C | 111.6° | 109.9° |
| N | CA | HA | 108.5° | 109.9° |
| CG | CD | HD1 | 112.3° | 110.6° |
| CG | CD | HD2 | 114.1° | 110.7° |
| CD | CG | CB | 104.6° | 103.0° |
| CD | CG | CG2 | 118.5° | 110.8° |
| CD | CG | HG | 112.7° | 110.7° |
| HD1 | CD | HD2 | 103.3° | 110.7° |
| CG2 | CD1 | HD11 | 110.5° | 120.0° |
| CG2 | CD1 | HD12 | 124.7° | 120.0° |
| CD1 | CG2 | CD2 | 125.2° | 120.0° |
| CD1 | CG2 | CG | 116.4° | 120.0° |
| HD11 | CD1 | HD12 | 124.8° | 119.9° |
| CG2 | CD2 | HD21 | 109.5° | 109.5° |
| CG2 | CD2 | HD22 | 109.5° | 109.4° |
| CG2 | CD2 | HD23 | 109.5° | 109.5° |
| CD2 | CG2 | CG | 118.2° | 120.0° |
| HD21 | CD2 | HD22 | 109.4° | 109.5° |
| HD21 | CD2 | HD23 | 109.4° | 109.5° |
| HD22 | CD2 | HD23 | 109.5° | 109.5° |
| CB | CA | C | 112.7° | 109.9° |
| CB | CA | HA | 107.3° | 109.9° |
| CA | CB | CB1 | 117.5° | 110.3° |
| CA | CB | CG | 100.0° | 105.1° |
| CA | CB | HB | 109.7° | 110.3° |
| C | CA | HA | 106.1° | 110.0° |
| CA | C | O | 115.6° | 120.0° |
| CA | C | OXT | 116.1° | 120.1° |
| CB1 | CB | CG | 106.2° | 110.3° |
| CB1 | CB | HB | 103.9° | 110.3° |
| CB | CB1 | CG1 | 110.8° | 109.5° |
| CB | CB1 | HB11 | 109.1° | 109.5° |
| CB | CB1 | HB12 | 108.7° | 109.5° |
| CG | CB | HB | 120.4° | 110.4° |
| CB | CG | CG2 | 121.6° | 110.7° |
| CB | CG | HG | 108.6° | 110.7° |
| CG1 | CB1 | HB11 | 109.0° | 109.5° |
| CG1 | CB1 | HB12 | 108.8° | 109.4° |
| CB1 | CG1 | OD1 | 115.3° | 120.0° |
| CB1 | CG1 | OD2 | 118.8° | 119.9° |
| HB11 | CB1 | HB12 | 110.5° | 109.4° |
| CG2 | CG | HG | 89.9° | 110.8° |
| OD1 | CG1 | OD2 | 125.9° | 120.0° |
| CG1 | OD1 | HOD1 | 109.5° | 117.0° |
| O | C | OXT | 128.3° | 119.9° |
| C | OXT | HXT | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CD | N | CA | HN1 | 120.0° | 120.5° |
| N | CD | CG | HD1 | 120.0° | 118.4° |
| N | CD | CG | HD2 | 122.9° | 118.5° |
| N | CD | HD1 | HD2 | 123.3° | 123.1° |
| CD | N | CA | CB | 10.3° | 25.3° |
| CD | N | CA | C | 115.9° | 144.7° |
| CD | N | CA | HA | 127.6° | 94.1° |
| N | CD | CG | CB | 34.1° | 37.4° |
| N | CD | CG | CG2 | 173.3° | 155.8° |
| N | CD | CG | HG | 83.6° | 81.0° |
| CA | N | CD | CG | 14.3° | 39.2° |
| CA | N | CD | HD1 | 105.7° | 79.2° |
| CA | N | CD | HD2 | 137.2° | 157.6° |
| N | CA | CB | C | 125.5° | 119.4° |
| N | CA | CB | HA | 118.1° | 119.4° |
| N | CA | C | HA | 118.0° | 121.2° |
| N | CA | CB | CB1 | 82.7° | 120.1° |
| N | CA | CB | CG | 31.6° | 1.2° |
| N | CA | CB | HB | 159.1° | 117.8° |
| N | CA | C | O | 11.9° | 18.6° |
| N | CA | C | OXT | 167.5° | 161.4° |
| HN1 | N | CD | CG | 105.7° | 81.3° |
| HN1 | N | CD | HD1 | 134.3° | 160.3° |
| HN1 | N | CD | HD2 | 17.2° | 37.2° |
| HN1 | N | CA | CB | 130.3° | 95.1° |
| HN1 | N | CA | C | 4.1° | 24.2° |
| HN1 | N | CA | HA | 112.4° | 145.5° |
| CG | CD | HD1 | HD2 | 123.3° | 123.1° |
| CD | CG | CG2 | CD1 | 11.6° | 16.3° |
| CD | CG | CG2 | CD2 | 173.2° | 163.7° |
| CD | CG | CB | CA | 39.3° | 21.9° |
| CD | CG | CB | CB1 | 83.4° | 96.9° |
| CD | CG | CB | CG2 | 137.6° | 118.4° |
| CD | CG | CB | HG | 120.5° | 118.4° |
| CD | CG | CB | HB | 159.3° | 140.9° |
| CD | CG | CG2 | HG | 116.0° | 123.3° |
| HD1 | CD | CG | CB | 85.9° | 81.0° |
| HD1 | CD | CG | CG2 | 53.3° | 37.3° |
| HD1 | CD | CG | HG | 156.3° | 160.6° |
| HD2 | CD | CG | CB | 157.0° | 155.9° |
| HD2 | CD | CG | CG2 | 63.8° | 85.8° |
| HD2 | CD | CG | HG | 39.2° | 37.5° |
| CG2 | CD1 | HD11 | HD12 | 180.0° | 179.9° |
| CD1 | CG2 | CD2 | CG | 174.7° | 180.0° |
| CD1 | CG2 | CD2 | HD21 | 67.9° | 94.9° |
| CD1 | CG2 | CD2 | HD22 | 172.1° | 145.1° |
| CD1 | CG2 | CD2 | HD23 | 52.1° | 25.1° |
| CD1 | CG2 | CG | CB | 120.5° | 97.2° |
| CD1 | CG2 | CG | HG | 127.6° | 139.6° |
| HD11 | CD1 | CG2 | CD2 | 0.0° | 6.0° |
| HD11 | CD1 | CG2 | CG | 174.8° | 174.0° |
| HD12 | CD1 | CG2 | CD2 | 180.0° | 174.1° |
| HD12 | CD1 | CG2 | CG | 5.2° | 6.0° |
| CG2 | CD2 | HD21 | HD22 | 120.0° | 119.9° |
| CG2 | CD2 | HD21 | HD23 | 120.0° | 120.0° |
| CG2 | CD2 | HD22 | HD23 | 120.0° | 120.0° |
| CD2 | CG2 | CG | CB | 54.7° | 82.8° |
| CD2 | CG2 | CG | HG | 57.2° | 40.4° |
| HD21 | CD2 | HD22 | HD23 | 120.0° | 120.0° |
| HD21 | CD2 | CG2 | CG | 117.4° | 85.1° |
| HD22 | CD2 | CG2 | CG | 2.6° | 34.9° |
| HD23 | CD2 | CG2 | CG | 122.7° | 155.0° |
| CB | CA | C | HA | 117.1° | 121.2° |
| CA | CB | CB1 | CG | 110.8° | 115.6° |
| CA | CB | CB1 | HB | 121.3° | 122.1° |
| CA | CB | CG | HB | 120.0° | 119.0° |
| CA | CB | CB1 | CG1 | 79.1° | 67.3° |
| CA | CB | CB1 | HB11 | 40.9° | 52.8° |
| CA | CB | CB1 | HB12 | 161.4° | 172.7° |
| CA | CB | CG | CG2 | 176.9° | 140.3° |
| CA | CB | CG | HG | 81.2° | 96.5° |
| CB | CA | C | O | 136.7° | 99.0° |
| CB | CA | C | OXT | 42.7° | 80.9° |
| C | CA | CB | CB1 | 151.8° | 120.5° |
| C | CA | CB | CG | 93.9° | 120.6° |
| C | CA | CB | HB | 33.6° | 1.6° |
| CA | C | O | OXT | 179.3° | 180.0° |
| CA | C | OXT | HXT | 179.3° | 180.0° |
| HA | CA | CB | CB1 | 35.4° | 0.7° |
| HA | CA | CB | CG | 149.7° | 118.1° |
| HA | CA | CB | HB | 82.8° | 122.8° |
| HA | CA | C | O | 106.2° | 139.8° |
| HA | CA | C | OXT | 74.5° | 40.3° |
| CB1 | CB | CG | HB | 117.4° | 122.2° |
| CB | CB1 | CG1 | HB11 | 120.0° | 120.1° |
| CB | CB1 | CG1 | HB12 | 119.5° | 120.0° |
| CB | CB1 | HB11 | HB12 | 119.5° | 120.0° |
| CB1 | CB | CG | CG2 | 54.2° | 21.5° |
| CB1 | CB | CG | HG | 156.1° | 144.7° |
| CB | CB1 | CG1 | OD1 | 168.6° | 180.0° |
| CB | CB1 | CG1 | OD2 | 12.6° | 0.0° |
| CG | CB | CB1 | CG1 | 170.1° | 177.1° |
| CG | CB | CB1 | HB11 | 69.9° | 62.9° |
| CG | CB | CB1 | HB12 | 50.6° | 57.1° |
| CB | CG | CG2 | HG | 112.0° | 123.2° |
| HB | CB | CB1 | CG1 | 42.2° | 54.9° |
| HB | CB | CB1 | HB11 | 162.2° | 174.9° |
| HB | CB | CB1 | HB12 | 77.3° | 65.1° |
| HB | CB | CG | CG2 | 63.2° | 100.7° |
| HB | CB | CG | HG | 38.7° | 22.5° |
| CG1 | CB1 | HB11 | HB12 | 119.5° | 119.9° |
| CB1 | CG1 | OD1 | OD2 | 178.7° | 180.0° |
| CB1 | CG1 | OD1 | HOD1 | 178.7° | 180.0° |
| HB11 | CB1 | CG1 | OD1 | 48.5° | 60.0° |
| HB11 | CB1 | CG1 | OD2 | 132.6° | 120.0° |
| HB12 | CB1 | CG1 | OD1 | 72.0° | 59.9° |
| HB12 | CB1 | CG1 | OD2 | 106.9° | 120.1° |
| OD2 | CG1 | OD1 | HOD1 | 0.0° | 0.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
