ILO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.48Å | |
| N | HN1 | sing | 1.01Å | 1.02Å | |
| N | HN2A | sing | 1.01Å | 1.02Å | |
| CA | CB | sing | 1.53Å | 1.56Å | |
| CA | C | sing | 1.51Å | 1.53Å | |
| CA | HCA | sing | 1.09Å | 1.12Å | |
| CB | CG | sing | 1.53Å | 1.57Å | |
| CB | HCB1 | sing | 1.09Å | 1.11Å | |
| CB | HCB2 | sing | 1.09Å | 1.11Å | |
| CG | CD | sing | 1.53Å | 1.44Å | |
| CG | HCG1 | sing | 1.09Å | 1.12Å | |
| CG | HCG2 | sing | 1.09Å | 1.11Å | |
| CD | NE | sing | 1.46Å | 1.50Å | |
| CD | HCD1 | sing | 1.09Å | 1.11Å | |
| CD | HCD2 | sing | 1.09Å | 1.11Å | |
| NE | CZ | sing | 1.37Å | 1.34Å | |
| NE | HNE | sing | 0.97Å | 1.02Å | |
| CZ | CH1 | sing | 1.51Å | 1.44Å | |
| CZ | NH2 | doub | 1.29Å | 1.28Å | |
| CH1 | HC11 | sing | 1.09Å | 1.11Å | |
| CH1 | HC12 | sing | 1.09Å | 1.12Å | |
| CH1 | HC13 | sing | 1.09Å | 1.12Å | |
| NH2 | HN2 | sing | 0.97Å | 1.02Å | |
| C | OA1 | doub | 1.21Å | 1.23Å | |
| C | OA2 | sing | 1.34Å | 1.25Å | |
| OA2 | HO2 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | HN1 | 108.7° | 106.8° |
| CA | N | HN2A | 112.5° | 106.7° |
| N | CA | CB | 108.7° | 109.5° |
| N | CA | C | 110.3° | 109.5° |
| N | CA | HCA | 110.1° | 109.5° |
| HN1 | N | HN2A | 112.4° | 106.7° |
| CB | CA | C | 111.5° | 109.5° |
| CB | CA | HCA | 108.9° | 109.4° |
| CA | CB | CG | 115.2° | 109.5° |
| CA | CB | HCB1 | 110.1° | 109.5° |
| CA | CB | HCB2 | 110.1° | 109.4° |
| C | CA | HCA | 107.3° | 109.5° |
| CA | C | OA1 | 122.3° | 120.0° |
| CA | C | OA2 | 118.3° | 120.0° |
| CG | CB | HCB1 | 110.1° | 109.4° |
| CG | CB | HCB2 | 110.1° | 109.5° |
| CB | CG | CD | 111.0° | 109.6° |
| CB | CG | HCG1 | 111.6° | 109.4° |
| CB | CG | HCG2 | 111.6° | 109.5° |
| HCB1 | CB | HCB2 | 100.2° | 109.5° |
| CD | CG | HCG1 | 111.6° | 109.5° |
| CD | CG | HCG2 | 111.7° | 109.5° |
| CG | CD | NE | 109.4° | 109.6° |
| CG | CD | HCD1 | 112.2° | 109.4° |
| CG | CD | HCD2 | 112.2° | 109.5° |
| HCG1 | CG | HCG2 | 98.7° | 109.4° |
| NE | CD | HCD1 | 112.2° | 109.5° |
| NE | CD | HCD2 | 112.2° | 109.5° |
| CD | NE | CZ | 127.0° | 120.1° |
| CD | NE | HNE | 106.0° | 120.0° |
| HCD1 | CD | HCD2 | 98.2° | 109.4° |
| CZ | NE | HNE | 106.1° | 120.0° |
| NE | CZ | CH1 | 125.3° | 120.1° |
| NE | CZ | NH2 | 116.8° | 120.0° |
| CH1 | CZ | NH2 | 117.9° | 120.0° |
| CZ | CH1 | HC11 | 125.3° | 109.5° |
| CZ | CH1 | HC12 | 106.6° | 109.5° |
| CZ | CH1 | HC13 | 106.6° | 109.4° |
| CZ | NH2 | HN2 | 111.4° | 120.0° |
| HC11 | CH1 | HC12 | 106.6° | 109.5° |
| HC11 | CH1 | HC13 | 106.7° | 109.5° |
| HC12 | CH1 | HC13 | 102.9° | 109.4° |
| OA1 | C | OA2 | 119.4° | 120.0° |
| C | OA2 | HO2 | 118.3° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | HN1 | HN2A | 125.3° | 113.8° |
| N | CA | CB | C | 121.8° | 120.0° |
| N | CA | CB | HCA | 120.0° | 120.0° |
| N | CA | C | HCA | 119.9° | 120.0° |
| N | CA | CB | CG | 46.7° | 60.0° |
| N | CA | CB | HCB1 | 78.5° | 180.0° |
| N | CA | CB | HCB2 | 171.9° | 60.0° |
| N | CA | C | OA1 | 0.4° | 30.0° |
| N | CA | C | OA2 | 179.6° | 150.0° |
| HN1 | N | CA | CB | 179.9° | 53.7° |
| HN1 | N | CA | C | 57.6° | 173.8° |
| HN1 | N | CA | HCA | 60.7° | 66.2° |
| HN2A | N | CA | CB | 54.8° | 60.0° |
| HN2A | N | CA | C | 177.3° | 60.0° |
| HN2A | N | CA | HCA | 64.5° | 180.0° |
| CB | CA | C | HCA | 119.2° | 120.0° |
| CA | CB | CG | HCB1 | 125.3° | 120.0° |
| CA | CB | CG | HCB2 | 125.2° | 120.0° |
| CA | CB | HCB1 | HCB2 | 116.0° | 120.0° |
| CA | CB | CG | CD | 165.3° | 180.0° |
| CA | CB | CG | HCG1 | 69.5° | 60.0° |
| CA | CB | CG | HCG2 | 40.0° | 60.0° |
| CB | CA | C | OA1 | 120.4° | 90.0° |
| CB | CA | C | OA2 | 59.5° | 90.0° |
| C | CA | CB | CG | 168.5° | 180.0° |
| C | CA | CB | HCB1 | 43.3° | 60.0° |
| C | CA | CB | HCB2 | 66.3° | 60.0° |
| CA | C | OA1 | OA2 | 180.0° | 180.0° |
| CA | C | OA2 | HO2 | 180.0° | 180.0° |
| HCA | CA | CB | CG | 73.2° | 60.0° |
| HCA | CA | CB | HCB1 | 161.5° | 60.0° |
| HCA | CA | CB | HCB2 | 52.0° | NaN° |
| HCA | CA | C | OA1 | 120.4° | 150.0° |
| HCA | CA | C | OA2 | 59.7° | 30.0° |
| CG | CB | HCB1 | HCB2 | 115.9° | 120.0° |
| CB | CG | CD | HCG1 | 125.3° | 120.0° |
| CB | CG | CD | HCG2 | 125.3° | 120.1° |
| CB | CG | HCG1 | HCG2 | 117.5° | 120.0° |
| CB | CG | CD | NE | 60.0° | 180.0° |
| CB | CG | CD | HCD1 | 65.3° | 60.0° |
| CB | CG | CD | HCD2 | 174.8° | 59.9° |
| HCB1 | CB | CG | CD | 40.0° | 60.0° |
| HCB1 | CB | CG | HCG1 | 165.3° | 180.0° |
| HCB1 | CB | CG | HCG2 | 85.3° | 60.1° |
| HCB2 | CB | CG | CD | 69.5° | 60.0° |
| HCB2 | CB | CG | HCG1 | 55.8° | 60.0° |
| HCB2 | CB | CG | HCG2 | 165.2° | 180.0° |
| CD | CG | HCG1 | HCG2 | 117.6° | 120.0° |
| CG | CD | NE | HCD1 | 125.3° | 120.0° |
| CG | CD | NE | HCD2 | 125.2° | 120.0° |
| CG | CD | HCD1 | HCD2 | 118.1° | 119.9° |
| CG | CD | NE | CZ | 163.2° | 179.9° |
| CG | CD | NE | HNE | 37.9° | 0.0° |
| HCG1 | CG | CD | NE | 174.7° | 60.0° |
| HCG1 | CG | CD | HCD1 | 60.0° | 180.0° |
| HCG1 | CG | CD | HCD2 | 49.5° | 60.1° |
| HCG2 | CG | CD | NE | 65.3° | 60.0° |
| HCG2 | CG | CD | HCD1 | 169.5° | 60.1° |
| HCG2 | CG | CD | HCD2 | 60.0° | 180.0° |
| NE | CD | HCD1 | HCD2 | 118.2° | 120.0° |
| CD | NE | CZ | HNE | 125.2° | 179.9° |
| CD | NE | CZ | CH1 | 1.0° | 180.0° |
| CD | NE | CZ | NH2 | 179.8° | 0.1° |
| HCD1 | CD | NE | CZ | 37.9° | 59.9° |
| HCD1 | CD | NE | HNE | 87.4° | 120.0° |
| HCD2 | CD | NE | CZ | 71.6° | 60.0° |
| HCD2 | CD | NE | HNE | 163.1° | 120.1° |
| NE | CZ | CH1 | NH2 | 179.2° | 180.0° |
| NE | CZ | CH1 | HC11 | 179.9° | 180.0° |
| NE | CZ | CH1 | HC12 | 54.7° | 60.0° |
| NE | CZ | CH1 | HC13 | 54.7° | 59.9° |
| NE | CZ | NH2 | HN2 | 140.5° | 0.0° |
| HNE | NE | CZ | CH1 | 124.3° | 0.1° |
| HNE | NE | CZ | NH2 | 55.0° | 180.0° |
| CZ | CH1 | HC11 | HC12 | 125.2° | 120.0° |
| CZ | CH1 | HC11 | HC13 | 125.3° | 120.0° |
| CZ | CH1 | HC12 | HC13 | 112.0° | 119.9° |
| CH1 | CZ | NH2 | HN2 | 40.2° | 180.0° |
| NH2 | CZ | CH1 | HC11 | 0.7° | 0.0° |
| NH2 | CZ | CH1 | HC12 | 124.5° | 120.0° |
| NH2 | CZ | CH1 | HC13 | 126.0° | 120.1° |
| HC11 | CH1 | HC12 | HC13 | 112.1° | 120.0° |
| OA1 | C | OA2 | HO2 | 0.1° | 0.0° |
