BOR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | B | sing | 1.42Å | 1.45Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| B | O2 | sing | 1.42Å | 1.49Å | |
| B | CA | sing | 1.57Å | 1.70Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| CA | N | sing | 1.47Å | 1.46Å | |
| CA | CB | sing | 1.53Å | 1.54Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CB | CG | sing | 1.53Å | 1.55Å | |
| CB | HB1 | sing | 1.09Å | 1.10Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| CG | CD | sing | 1.53Å | 1.55Å | |
| CG | HG1 | sing | 1.09Å | 1.10Å | |
| CG | HG2 | sing | 1.09Å | 1.10Å | |
| CD | NE | sing | 1.47Å | 1.47Å | |
| CD | HD1 | sing | 1.09Å | 1.10Å | |
| CD | HD2 | sing | 1.09Å | 1.10Å | |
| NE | CZ | sing | 1.37Å | 1.33Å | |
| NE | HNE | sing | 0.97Å | 1.00Å | |
| CZ | NH1 | doub | 1.30Å | 1.33Å | |
| CZ | NH2 | sing | 1.37Å | 1.33Å | |
| NH1 | HH1 | sing | 0.97Å | 1.00Å | |
| NH2 | HH21 | sing | 0.97Å | 1.00Å | |
| NH2 | HH22 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| B | O1 | HO1 | 109.5° | 114.0° |
| O1 | B | O2 | 106.8° | 120.0° |
| O1 | B | CA | 108.0° | 120.0° |
| O2 | B | CA | 105.2° | 120.0° |
| B | O2 | HO2 | 109.5° | 114.0° |
| B | CA | N | 115.2° | 109.5° |
| B | CA | CB | 115.7° | 109.4° |
| B | CA | HA | 99.6° | 109.5° |
| N | CA | CB | 106.7° | 109.5° |
| N | CA | HA | 110.0° | 109.5° |
| CA | N | H | 109.5° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| CB | CA | HA | 109.4° | 109.4° |
| CA | CB | CG | 111.2° | 109.5° |
| CA | CB | HB1 | 108.9° | 109.5° |
| CA | CB | HB2 | 108.9° | 109.5° |
| H | N | H2 | 109.4° | 111.0° |
| CG | CB | HB1 | 108.9° | 109.5° |
| CG | CB | HB2 | 108.9° | 109.5° |
| CB | CG | CD | 120.1° | 109.5° |
| CB | CG | HG1 | 106.1° | 109.4° |
| CB | CG | HG2 | 106.1° | 109.4° |
| HB1 | CB | HB2 | 110.0° | 109.4° |
| CD | CG | HG1 | 106.1° | 109.5° |
| CD | CG | HG2 | 106.1° | 109.4° |
| CG | CD | NE | 111.2° | 109.4° |
| CG | CD | HD1 | 108.9° | 109.5° |
| CG | CD | HD2 | 108.9° | 109.4° |
| HG1 | CG | HG2 | 112.6° | 109.5° |
| NE | CD | HD1 | 108.9° | 109.5° |
| NE | CD | HD2 | 108.9° | 109.5° |
| CD | NE | CZ | 124.7° | 120.0° |
| CD | NE | HNE | 117.7° | 120.1° |
| HD1 | CD | HD2 | 110.0° | 109.5° |
| CZ | NE | HNE | 117.7° | 120.0° |
| NE | CZ | NH1 | 119.8° | 120.0° |
| NE | CZ | NH2 | 120.3° | 120.0° |
| NH1 | CZ | NH2 | 119.9° | 120.0° |
| CZ | NH1 | HH1 | 112.0° | 120.1° |
| CZ | NH2 | HH21 | 120.0° | 120.0° |
| CZ | NH2 | HH22 | 120.0° | 120.0° |
| HH21 | NH2 | HH22 | 120.0° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | B | O2 | CA | 114.6° | 179.9° |
| O1 | B | O2 | HO2 | 180.0° | 0.0° |
| O1 | B | CA | N | 141.2° | 150.0° |
| O1 | B | CA | CB | 93.5° | 90.0° |
| O1 | B | CA | HA | 23.6° | 29.9° |
| HO1 | O1 | B | O2 | 180.0° | 180.0° |
| HO1 | O1 | B | CA | 67.2° | 0.1° |
| O2 | B | CA | N | 27.4° | 29.9° |
| O2 | B | CA | CB | 152.7° | 90.0° |
| O2 | B | CA | HA | 90.2° | 150.0° |
| CA | B | O2 | HO2 | 65.3° | 179.9° |
| B | CA | N | CB | 129.9° | 120.0° |
| B | CA | N | HA | 111.6° | 120.1° |
| B | CA | CB | HA | 111.5° | 120.0° |
| B | CA | N | H | 180.0° | 59.9° |
| B | CA | N | H2 | 60.0° | 176.1° |
| B | CA | CB | CG | 157.5° | 60.0° |
| B | CA | CB | HB1 | 82.5° | 180.0° |
| B | CA | CB | HB2 | 37.5° | 60.0° |
| N | CA | CB | HA | 119.0° | 120.0° |
| CA | N | H | H2 | 120.0° | 124.0° |
| N | CA | CB | CG | 72.9° | 180.0° |
| N | CA | CB | HB1 | 47.1° | 60.0° |
| N | CA | CB | HB2 | 167.1° | 60.0° |
| CB | CA | N | H | 50.1° | 60.0° |
| CB | CA | N | H2 | 170.1° | 63.9° |
| CA | CB | CG | HB1 | 120.0° | 120.0° |
| CA | CB | CG | HB2 | 120.0° | 120.0° |
| CA | CB | HB1 | HB2 | 119.3° | 120.0° |
| CA | CB | CG | CD | 178.6° | 180.0° |
| CA | CB | CG | HG1 | 61.4° | 60.0° |
| CA | CB | CG | HG2 | 58.6° | 60.0° |
| HA | CA | N | H | 68.4° | 180.0° |
| HA | CA | N | H2 | 51.6° | 56.1° |
| HA | CA | CB | CG | 46.1° | 60.0° |
| HA | CA | CB | HB1 | 166.1° | 60.0° |
| HA | CA | CB | HB2 | 74.0° | 180.0° |
| CG | CB | HB1 | HB2 | 119.3° | 120.0° |
| CB | CG | CD | HG1 | 120.0° | 120.0° |
| CB | CG | CD | HG2 | 120.0° | 119.9° |
| CB | CG | HG1 | HG2 | 115.6° | 120.0° |
| CB | CG | CD | NE | 179.1° | 180.0° |
| CB | CG | CD | HD1 | 60.9° | 60.0° |
| CB | CG | CD | HD2 | 59.1° | 60.1° |
| HB1 | CB | CG | CD | 58.6° | 59.9° |
| HB1 | CB | CG | HG1 | 178.6° | 179.9° |
| HB1 | CB | CG | HG2 | 61.4° | 60.0° |
| HB2 | CB | CG | CD | 61.4° | 60.0° |
| HB2 | CB | CG | HG1 | 58.6° | 60.0° |
| HB2 | CB | CG | HG2 | 178.6° | 180.0° |
| CD | CG | HG1 | HG2 | 115.6° | 120.0° |
| CG | CD | NE | HD1 | 120.0° | 120.0° |
| CG | CD | NE | HD2 | 120.0° | 119.9° |
| CG | CD | HD1 | HD2 | 119.2° | 120.0° |
| CG | CD | NE | CZ | 167.9° | 179.9° |
| CG | CD | NE | HNE | 12.1° | 0.0° |
| HG1 | CG | CD | NE | 59.1° | 60.0° |
| HG1 | CG | CD | HD1 | 179.1° | 179.9° |
| HG1 | CG | CD | HD2 | 61.0° | 59.9° |
| HG2 | CG | CD | NE | 60.9° | 60.1° |
| HG2 | CG | CD | HD1 | 59.1° | 60.0° |
| HG2 | CG | CD | HD2 | 179.1° | 180.0° |
| NE | CD | HD1 | HD2 | 119.3° | 120.0° |
| CD | NE | CZ | HNE | 180.0° | 179.9° |
| CD | NE | CZ | NH1 | 0.1° | 0.1° |
| CD | NE | CZ | NH2 | 179.4° | 180.0° |
| HD1 | CD | NE | CZ | 47.9° | 60.1° |
| HD1 | CD | NE | HNE | 132.1° | 120.0° |
| HD2 | CD | NE | CZ | 72.1° | 60.0° |
| HD2 | CD | NE | HNE | 107.9° | 119.9° |
| NE | CZ | NH1 | NH2 | 179.5° | 179.9° |
| NE | CZ | NH1 | HH1 | 179.4° | 179.9° |
| NE | CZ | NH2 | HH21 | 179.5° | 0.1° |
| NE | CZ | NH2 | HH22 | 0.6° | 180.0° |
| HNE | NE | CZ | NH1 | 179.9° | 180.0° |
| HNE | NE | CZ | NH2 | 0.6° | 0.1° |
| NH1 | CZ | NH2 | HH21 | 0.0° | 180.0° |
| NH1 | CZ | NH2 | HH22 | 180.0° | 0.1° |
| NH2 | CZ | NH1 | HH1 | 0.0° | 0.0° |
| CZ | NH2 | HH21 | HH22 | 180.0° | 180.0° |
