BNO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.48Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CA | B | sing | 1.57Å | 1.57Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | CG | sing | 1.53Å | 1.51Å | |
| CB | HB1 | sing | 1.09Å | 1.10Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| CG | CD | sing | 1.53Å | 1.54Å | |
| CG | HG1 | sing | 1.09Å | 1.10Å | |
| CG | HG2 | sing | 1.09Å | 1.10Å | |
| CD | CE | sing | 1.53Å | 1.53Å | |
| CD | HD1 | sing | 1.09Å | 1.10Å | |
| CD | HD2 | sing | 1.09Å | 1.10Å | |
| CE | HE1 | sing | 1.09Å | 1.10Å | |
| CE | HE2 | sing | 1.09Å | 1.10Å | |
| CE | HE3 | sing | 1.09Å | 1.10Å | |
| B | O1 | sing | 1.42Å | 1.47Å | |
| B | O2 | sing | 1.42Å | 1.52Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| O2 | HO2 | 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 | 109.5° | 110.9° |
| N | CA | CB | 108.5° | 109.4° |
| N | CA | B | 110.0° | 109.5° |
| N | CA | HA | 111.0° | 109.5° |
| H | N | H2 | 109.4° | 111.1° |
| CB | CA | B | 112.9° | 109.4° |
| CB | CA | HA | 108.0° | 109.5° |
| CA | CB | CG | 115.0° | 109.5° |
| CA | CB | HB1 | 107.7° | 109.4° |
| CA | CB | HB2 | 107.6° | 109.5° |
| B | CA | HA | 106.4° | 109.5° |
| CA | B | O1 | 115.4° | 120.0° |
| CA | B | O2 | 111.7° | 120.0° |
| CG | CB | HB1 | 107.7° | 109.5° |
| CG | CB | HB2 | 107.7° | 109.5° |
| CB | CG | CD | 107.0° | 109.5° |
| CB | CG | HG1 | 110.3° | 109.5° |
| CB | CG | HG2 | 110.3° | 109.5° |
| HB1 | CB | HB2 | 111.2° | 109.4° |
| CD | CG | HG1 | 110.3° | 109.5° |
| CD | CG | HG2 | 110.3° | 109.5° |
| CG | CD | CE | 113.8° | 109.5° |
| CG | CD | HD1 | 108.1° | 109.4° |
| CG | CD | HD2 | 108.1° | 109.5° |
| HG1 | CG | HG2 | 108.7° | 109.4° |
| CE | CD | HD1 | 108.1° | 109.5° |
| CE | CD | HD2 | 108.1° | 109.5° |
| CD | CE | HE1 | 109.5° | 109.4° |
| CD | CE | HE2 | 109.5° | 109.5° |
| CD | CE | HE3 | 109.5° | 109.5° |
| HD1 | CD | HD2 | 110.8° | 109.5° |
| HE1 | CE | HE2 | 109.5° | 109.5° |
| HE1 | CE | HE3 | 109.5° | 109.5° |
| HE2 | CE | HE3 | 109.5° | 109.5° |
| O1 | B | O2 | 112.8° | 120.0° |
| B | O1 | HO1 | 109.5° | 114.0° |
| B | O2 | HO2 | 109.5° | 114.0° |
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 | B | 122.2° | 120.0° |
| N | CA | CB | HA | 120.4° | 120.0° |
| N | CA | B | HA | 120.3° | 120.0° |
| N | CA | CB | CG | 64.4° | 180.0° |
| N | CA | CB | HB1 | 55.6° | 60.0° |
| N | CA | CB | HB2 | 175.6° | 60.0° |
| N | CA | B | O1 | 169.6° | 150.0° |
| N | CA | B | O2 | 59.9° | 29.9° |
| H | N | CA | CB | 180.0° | 176.0° |
| H | N | CA | B | 56.1° | 64.0° |
| H | N | CA | HA | 61.5° | 56.1° |
| H2 | N | CA | CB | 60.0° | 60.0° |
| H2 | N | CA | B | 63.9° | 60.0° |
| H2 | N | CA | HA | 178.5° | 180.0° |
| CB | CA | B | HA | 118.3° | 120.0° |
| CA | CB | CG | HB1 | 120.0° | 120.0° |
| CA | CB | CG | HB2 | 120.0° | 120.0° |
| CA | CB | HB1 | HB2 | 117.7° | 120.0° |
| CA | CB | CG | CD | 175.0° | 180.0° |
| CA | CB | CG | HG1 | 65.0° | 60.0° |
| CA | CB | CG | HG2 | 55.0° | 60.0° |
| CB | CA | B | O1 | 48.3° | 90.0° |
| CB | CA | B | O2 | 178.7° | 90.0° |
| B | CA | CB | CG | 173.4° | 60.0° |
| B | CA | CB | HB1 | 66.6° | 180.0° |
| B | CA | CB | HB2 | 53.4° | 60.0° |
| CA | B | O1 | O2 | 129.9° | 180.0° |
| CA | B | O1 | HO1 | 180.0° | 180.0° |
| CA | B | O2 | HO2 | 180.0° | 180.0° |
| HA | CA | CB | CG | 56.0° | 60.0° |
| HA | CA | CB | HB1 | 176.0° | 60.0° |
| HA | CA | CB | HB2 | 64.0° | 179.9° |
| HA | CA | B | O1 | 70.1° | 30.0° |
| HA | CA | B | O2 | 60.4° | 150.0° |
| CG | CB | HB1 | HB2 | 117.8° | 120.0° |
| CB | CG | CD | HG1 | 120.0° | 120.1° |
| CB | CG | CD | HG2 | 120.0° | 120.0° |
| CB | CG | HG1 | HG2 | 121.0° | 120.0° |
| CB | CG | CD | CE | 173.1° | 180.0° |
| CB | CG | CD | HD1 | 53.0° | 60.0° |
| CB | CG | CD | HD2 | 67.0° | 60.0° |
| HB1 | CB | CG | CD | 55.0° | 60.0° |
| HB1 | CB | CG | HG1 | 175.0° | 180.0° |
| HB1 | CB | CG | HG2 | 65.0° | 60.0° |
| HB2 | CB | CG | CD | 65.0° | 60.0° |
| HB2 | CB | CG | HG1 | 55.0° | 60.1° |
| HB2 | CB | CG | HG2 | 175.0° | 180.0° |
| CD | CG | HG1 | HG2 | 121.0° | 120.0° |
| CG | CD | CE | HD1 | 120.0° | 120.0° |
| CG | CD | CE | HD2 | 120.0° | 120.0° |
| CG | CD | HD1 | HD2 | 118.2° | 120.0° |
| CG | CD | CE | HE1 | 180.0° | 60.0° |
| CG | CD | CE | HE2 | 60.0° | 60.0° |
| CG | CD | CE | HE3 | 60.0° | 180.0° |
| HG1 | CG | CD | CE | 67.0° | 60.0° |
| HG1 | CG | CD | HD1 | 173.0° | 179.9° |
| HG1 | CG | CD | HD2 | 53.0° | 60.0° |
| HG2 | CG | CD | CE | 53.1° | 59.9° |
| HG2 | CG | CD | HD1 | 66.9° | 60.0° |
| HG2 | CG | CD | HD2 | 173.0° | 179.9° |
| CE | CD | HD1 | HD2 | 118.2° | 120.0° |
| CD | CE | HE1 | HE2 | 120.0° | 120.0° |
| CD | CE | HE1 | HE3 | 120.0° | 120.0° |
| CD | CE | HE2 | HE3 | 120.0° | 120.0° |
| HD1 | CD | CE | HE1 | 60.0° | 180.0° |
| HD1 | CD | CE | HE2 | 180.0° | 60.0° |
| HD1 | CD | CE | HE3 | 60.0° | 60.0° |
| HD2 | CD | CE | HE1 | 60.0° | 60.0° |
| HD2 | CD | CE | HE2 | 60.0° | 180.0° |
| HD2 | CD | CE | HE3 | 180.0° | 60.0° |
| HE1 | CE | HE2 | HE3 | 120.0° | 120.0° |
| O1 | B | O2 | HO2 | 48.2° | 0.1° |
| O2 | B | O1 | HO1 | 50.1° | 0.0° |
