Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.47Å | |
| N | H | sing | 1.01Å | 1.02Å | |
| N | H2 | sing | 1.01Å | 1.02Å | |
| CA | C | sing | 1.53Å | 1.53Å | |
| CA | CB | sing | 1.53Å | 1.55Å | |
| CA | HA | sing | 1.09Å | 1.11Å | |
| C | O | sing | 1.43Å | 1.24Å | |
| C | HC1 | sing | 1.09Å | 1.12Å | |
| C | HC2 | sing | 1.09Å | 1.11Å | |
| O | HO | sing | 0.97Å | 0.95Å | |
| CB | CG | sing | 1.53Å | 1.55Å | |
| CB | HB2 | sing | 1.09Å | 1.12Å | |
| CB | HB3 | sing | 1.09Å | 1.12Å | |
| CG | CD | sing | 1.53Å | 1.52Å | |
| CG | HG2 | sing | 1.09Å | 1.11Å | |
| CG | HG3 | sing | 1.09Å | 1.11Å | |
| CD | CE | sing | 1.53Å | 1.52Å | |
| CD | HD2 | sing | 1.09Å | 1.12Å | |
| CD | HD3 | sing | 1.09Å | 1.12Å | |
| CE | NZ | sing | 1.46Å | 1.47Å | |
| CE | HE2 | sing | 1.09Å | 1.11Å | |
| CE | HE3 | sing | 1.09Å | 1.11Å | |
| NZ | CX | sing | 1.35Å | 1.49Å | |
| NZ | HZ | sing | 0.97Å | 1.02Å | |
| CX | OX1 | sing | 1.35Å | 1.21Å | |
| CX | OX2 | doub | 1.21Å | 1.30Å | |
| OX1 | HX1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | H | 109.7° | 106.7° |
| CA | N | H2 | 112.1° | 106.7° |
| N | CA | C | 109.7° | 109.4° |
| N | CA | CB | 110.5° | 109.5° |
| N | CA | HA | 109.6° | 109.4° |
| H | N | H2 | 112.1° | 106.7° |
| C | CA | CB | 112.4° | 109.5° |
| C | CA | HA | 107.7° | 109.5° |
| CA | C | O | 120.6° | 109.5° |
| CA | C | HC1 | 108.2° | 109.4° |
| CA | C | HC2 | 108.3° | 109.5° |
| CB | CA | HA | 106.8° | 109.5° |
| CA | CB | CG | 119.3° | 109.5° |
| CA | CB | HB2 | 108.6° | 109.5° |
| CA | CB | HB3 | 108.6° | 109.5° |
| O | C | HC1 | 108.3° | 109.4° |
| O | C | HC2 | 108.2° | 109.5° |
| C | O | HO | 120.6° | 106.9° |
| HC1 | C | HC2 | 101.7° | 109.4° |
| CG | CB | HB2 | 108.7° | 109.4° |
| CG | CB | HB3 | 108.7° | 109.5° |
| CB | CG | CD | 114.5° | 109.5° |
| CB | CG | HG2 | 110.3° | 109.4° |
| CB | CG | HG3 | 110.3° | 109.5° |
| HB2 | CB | HB3 | 101.3° | 109.4° |
| CD | CG | HG2 | 110.4° | 109.5° |
| CD | CG | HG3 | 110.4° | 109.5° |
| CG | CD | CE | 112.3° | 109.5° |
| CG | CD | HD2 | 111.1° | 109.5° |
| CG | CD | HD3 | 111.1° | 109.4° |
| HG2 | CG | HG3 | 99.9° | 109.4° |
| CE | CD | HD2 | 111.2° | 109.5° |
| CE | CD | HD3 | 111.2° | 109.5° |
| CD | CE | NZ | 112.6° | 109.5° |
| CD | CE | HE2 | 111.0° | 109.5° |
| CD | CE | HE3 | 111.0° | 109.5° |
| HD2 | CD | HD3 | 99.2° | 109.4° |
| NZ | CE | HE2 | 111.0° | 109.4° |
| NZ | CE | HE3 | 111.1° | 109.4° |
| CE | NZ | CX | 117.3° | 120.1° |
| CE | NZ | HZ | 120.9° | 119.9° |
| HE2 | CE | HE3 | 99.4° | 109.4° |
| CX | NZ | HZ | 121.8° | 120.0° |
| NZ | CX | OX1 | 123.4° | 120.0° |
| NZ | CX | OX2 | 112.5° | 120.0° |
| OX1 | CX | OX2 | 124.1° | 120.0° |
| CX | OX1 | HX1 | 123.4° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 125.3° | 113.7° |
| N | CA | C | CB | 123.4° | 120.0° |
| N | CA | C | HA | 119.2° | 119.9° |
| N | CA | CB | HA | 119.2° | 120.0° |
| N | CA | C | O | 50.2° | 60.0° |
| N | CA | C | HC1 | 75.1° | 180.0° |
| N | CA | C | HC2 | 175.4° | 60.1° |
| N | CA | CB | CG | 164.8° | 60.0° |
| N | CA | CB | HB2 | 69.9° | 60.0° |
| N | CA | CB | HB3 | 39.5° | 180.0° |
| H | N | CA | C | 180.0° | 60.0° |
| H | N | CA | CB | 55.4° | 60.0° |
| H | N | CA | HA | 62.0° | 180.0° |
| H2 | N | CA | C | 54.7° | 173.8° |
| H2 | N | CA | CB | 69.8° | 53.7° |
| H2 | N | CA | HA | 172.7° | 66.3° |
| C | CA | CB | HA | 117.9° | 120.1° |
| CA | C | O | HC1 | 125.2° | 119.9° |
| CA | C | O | HC2 | 125.3° | 120.1° |
| CA | C | HC1 | HC2 | 113.9° | 120.0° |
| CA | C | O | HO | 179.9° | 179.9° |
| C | CA | CB | CG | 41.9° | 180.0° |
| C | CA | CB | HB2 | 167.2° | 59.9° |
| C | CA | CB | HB3 | 83.4° | 60.0° |
| CB | CA | C | O | 73.3° | 180.0° |
| CB | CA | C | HC1 | 161.5° | 60.0° |
| CB | CA | C | HC2 | 52.0° | 59.9° |
| CA | CB | CG | HB2 | 125.3° | 120.1° |
| CA | CB | CG | HB3 | 125.3° | 120.0° |
| CA | CB | HB2 | HB3 | 114.3° | 120.0° |
| CA | CB | CG | CD | 57.1° | 180.0° |
| CA | CB | CG | HG2 | 177.6° | 59.9° |
| CA | CB | CG | HG3 | 68.2° | 60.0° |
| HA | CA | C | O | 169.4° | 59.9° |
| HA | CA | C | HC1 | 44.1° | 60.1° |
| HA | CA | C | HC2 | 65.4° | 180.0° |
| HA | CA | CB | CG | 76.0° | 60.0° |
| HA | CA | CB | HB2 | 49.3° | NaN° |
| HA | CA | CB | HB3 | 158.7° | 60.1° |
| O | C | HC1 | HC2 | 113.9° | 120.0° |
| HC1 | C | O | HO | 54.7° | 60.0° |
| HC2 | C | O | HO | 54.8° | 59.9° |
| CG | CB | HB2 | HB3 | 114.4° | 119.9° |
| CB | CG | CD | HG2 | 125.2° | 120.0° |
| CB | CG | CD | HG3 | 125.2° | 120.0° |
| CB | CG | HG2 | HG3 | 116.1° | 119.9° |
| CB | CG | CD | CE | 176.6° | 180.0° |
| CB | CG | CD | HD2 | 58.2° | 59.9° |
| CB | CG | CD | HD3 | 51.3° | 60.0° |
| HB2 | CB | CG | CD | 68.2° | 59.9° |
| HB2 | CB | CG | HG2 | 57.1° | 180.0° |
| HB2 | CB | CG | HG3 | 166.5° | 60.1° |
| HB3 | CB | CG | CD | 177.7° | 60.0° |
| HB3 | CB | CG | HG2 | 52.4° | 60.1° |
| HB3 | CB | CG | HG3 | 57.1° | 180.0° |
| CD | CG | HG2 | HG3 | 116.3° | 120.0° |
| CG | CD | CE | HD2 | 125.2° | 120.0° |
| CG | CD | CE | HD3 | 125.3° | 120.0° |
| CG | CD | HD2 | HD3 | 117.0° | 119.9° |
| CG | CD | CE | NZ | 60.7° | 180.0° |
| CG | CD | CE | HE2 | 64.5° | 60.0° |
| CG | CD | CE | HE3 | 174.0° | 60.0° |
| HG2 | CG | CD | CE | 51.3° | 60.0° |
| HG2 | CG | CD | HD2 | 176.6° | 180.0° |
| HG2 | CG | CD | HD3 | 74.0° | 60.0° |
| HG3 | CG | CD | CE | 58.2° | 60.0° |
| HG3 | CG | CD | HD2 | 67.1° | 60.1° |
| HG3 | CG | CD | HD3 | 176.5° | 180.0° |
| CE | CD | HD2 | HD3 | 117.1° | 120.0° |
| CD | CE | NZ | HE2 | 125.2° | 120.1° |
| CD | CE | NZ | HE3 | 125.2° | 120.1° |
| CD | CE | HE2 | HE3 | 116.9° | 120.0° |
| CD | CE | NZ | CX | 163.5° | 180.0° |
| CD | CE | NZ | HZ | 16.5° | 0.0° |
| HD2 | CD | CE | NZ | 174.1° | 60.0° |
| HD2 | CD | CE | HE2 | 60.7° | NaN° |
| HD2 | CD | CE | HE3 | 48.8° | 60.0° |
| HD3 | CD | CE | NZ | 64.5° | 60.0° |
| HD3 | CD | CE | HE2 | 170.2° | 60.0° |
| HD3 | CD | CE | HE3 | 60.7° | 180.0° |
| NZ | CE | HE2 | HE3 | 117.0° | 119.9° |
| CE | NZ | CX | HZ | 180.0° | 180.0° |
| CE | NZ | CX | OX1 | 3.6° | 180.0° |
| CE | NZ | CX | OX2 | 175.1° | 0.0° |
| HE2 | CE | NZ | CX | 71.3° | 60.0° |
| HE2 | CE | NZ | HZ | 108.7° | 120.0° |
| HE3 | CE | NZ | CX | 38.3° | 59.9° |
| HE3 | CE | NZ | HZ | 141.7° | 120.1° |
| NZ | CX | OX1 | OX2 | 178.5° | 180.0° |
| NZ | CX | OX1 | HX1 | 180.0° | 179.9° |
| HZ | NZ | CX | OX1 | 176.4° | 0.0° |
| HZ | NZ | CX | OX2 | 5.0° | 180.0° |
| OX2 | CX | OX1 | HX1 | 1.5° | 0.0° |
