BR5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CA1 | CB2 | sing | 1.51Å | 1.44Å | |
| CA1 | HA11 | sing | 1.09Å | 1.12Å | |
| CA1 | HA12 | sing | 1.10Å | 1.11Å | |
| CA1 | HA13 | sing | 1.09Å | 1.12Å | |
| CB2 | O | sing | 1.42Å | 1.42Å | |
| CB2 | HB21 | sing | 1.09Å | 1.11Å | |
| CB2 | HB22 | sing | 1.09Å | 1.12Å | |
| O | CZ2 | sing | 1.42Å | 1.39Å | |
| CZ2 | CA2 | sing | 1.52Å | 1.53Å | |
| CZ2 | HZ21 | sing | 1.09Å | 1.11Å | |
| CZ2 | HZ22 | sing | 1.09Å | 1.11Å | |
| CA2 | P | sing | 1.81Å | 1.75Å | |
| CA2 | HA21 | sing | 1.09Å | 1.12Å | |
| CA2 | HA22 | sing | 1.09Å | 1.12Å | |
| P | OP1 | sing | 1.52Å | 1.53Å | |
| P | OP2 | doub | 1.52Å | 1.50Å | |
| HP1 | P | sing | 1.42Å | 1.42Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CB2 | CA1 | HA11 | 100.4° | 110.9° |
| CB2 | CA1 | HA12 | 115.7° | 110.7° |
| CB2 | CA1 | HA13 | 115.7° | 110.6° |
| CA1 | CB2 | O | 100.4° | 109.0° |
| CA1 | CB2 | HB21 | 115.7° | 110.5° |
| CA1 | CB2 | HB22 | 115.6° | 110.5° |
| HA11 | CA1 | HA12 | 115.7° | 108.8° |
| HA11 | CA1 | HA13 | 115.6° | 108.9° |
| HA12 | CA1 | HA13 | 94.7° | 106.9° |
| O | CB2 | HB21 | 115.7° | 108.8° |
| O | CB2 | HB22 | 115.7° | 108.8° |
| CB2 | O | CZ2 | 124.7° | 111.5° |
| HB21 | CB2 | HB22 | 94.8° | 109.2° |
| O | CZ2 | CA2 | 120.1° | 109.0° |
| O | CZ2 | HZ21 | 108.4° | 108.4° |
| O | CZ2 | HZ22 | 108.4° | 108.7° |
| CA2 | CZ2 | HZ21 | 108.4° | 110.5° |
| CA2 | CZ2 | HZ22 | 108.4° | 110.9° |
| CZ2 | CA2 | P | 115.5° | 112.4° |
| CZ2 | CA2 | HA21 | 110.0° | 110.6° |
| CZ2 | CA2 | HA22 | 110.0° | 110.0° |
| HZ21 | CZ2 | HZ22 | 101.6° | 109.4° |
| P | CA2 | HA21 | 110.0° | 107.4° |
| P | CA2 | HA22 | 110.0° | 107.7° |
| CA2 | P | OP1 | 111.4° | 105.6° |
| CA2 | P | OP2 | 113.6° | 105.6° |
| CA2 | P | HP1 | 106.6° | 104.1° |
| HA21 | CA2 | HA22 | 100.2° | 108.6° |
| OP1 | P | OP2 | 113.5° | 118.5° |
| OP1 | P | HP1 | 106.7° | 110.9° |
| OP2 | P | HP1 | 104.2° | 110.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CB2 | CA1 | HA11 | HA12 | 125.3° | 121.9° |
| CB2 | CA1 | HA11 | HA13 | 125.2° | 122.0° |
| CB2 | CA1 | HA12 | HA13 | 121.5° | 120.5° |
| CA1 | CB2 | O | HB21 | 125.3° | 120.5° |
| CA1 | CB2 | O | HB22 | 125.2° | 120.6° |
| CA1 | CB2 | HB21 | HB22 | 121.5° | 121.7° |
| CA1 | CB2 | O | CZ2 | 159.3° | 180.0° |
| HA11 | CA1 | HA12 | HA13 | 121.5° | 117.4° |
| HA11 | CA1 | CB2 | O | 180.0° | 180.0° |
| HA11 | CA1 | CB2 | HB21 | 54.8° | 60.5° |
| HA11 | CA1 | CB2 | HB22 | 54.7° | 60.4° |
| HA12 | CA1 | CB2 | O | 54.7° | 59.2° |
| HA12 | CA1 | CB2 | HB21 | 70.6° | 178.7° |
| HA12 | CA1 | CB2 | HB22 | 179.9° | 60.4° |
| HA13 | CA1 | CB2 | O | 54.8° | 59.1° |
| HA13 | CA1 | CB2 | HB21 | 180.0° | 60.4° |
| HA13 | CA1 | CB2 | HB22 | 70.5° | 178.6° |
| O | CB2 | HB21 | HB22 | 121.5° | 118.7° |
| CB2 | O | CZ2 | CA2 | 178.2° | 179.8° |
| CB2 | O | CZ2 | HZ21 | 52.9° | 59.9° |
| CB2 | O | CZ2 | HZ22 | 56.6° | 58.9° |
| HB21 | CB2 | O | CZ2 | 34.1° | 59.5° |
| HB22 | CB2 | O | CZ2 | 75.5° | 59.4° |
| O | CZ2 | CA2 | HZ21 | 125.3° | 119.0° |
| O | CZ2 | CA2 | HZ22 | 125.2° | 119.6° |
| O | CZ2 | HZ21 | HZ22 | 114.0° | 118.3° |
| O | CZ2 | CA2 | P | 73.8° | 60.1° |
| O | CZ2 | CA2 | HA21 | 160.9° | 60.0° |
| O | CZ2 | CA2 | HA22 | 51.4° | 179.9° |
| CA2 | CZ2 | HZ21 | HZ22 | 114.1° | 122.3° |
| CZ2 | CA2 | P | HA21 | 125.3° | 121.9° |
| CZ2 | CA2 | P | HA22 | 125.3° | 121.3° |
| CZ2 | CA2 | HA21 | HA22 | 115.8° | 120.8° |
| CZ2 | CA2 | P | OP1 | 34.5° | 176.8° |
| CZ2 | CA2 | P | OP2 | 164.2° | 56.9° |
| CZ2 | CA2 | P | HP1 | 81.6° | 59.9° |
| HZ21 | CZ2 | CA2 | P | 51.4° | 179.0° |
| HZ21 | CZ2 | CA2 | HA21 | 73.9° | 58.9° |
| HZ21 | CZ2 | CA2 | HA22 | 176.7° | 61.0° |
| HZ22 | CZ2 | CA2 | P | 160.9° | 59.5° |
| HZ22 | CZ2 | CA2 | HA21 | 35.6° | 179.6° |
| HZ22 | CZ2 | CA2 | HA22 | 73.8° | 60.5° |
| P | CA2 | HA21 | HA22 | 115.8° | 116.2° |
| CA2 | P | OP1 | OP2 | 129.7° | 118.0° |
| CA2 | P | OP1 | HP1 | 116.0° | 112.2° |
| CA2 | P | OP2 | HP1 | 115.6° | 112.2° |
| HA21 | CA2 | P | OP1 | 90.8° | 54.9° |
| HA21 | CA2 | P | OP2 | 38.9° | 178.8° |
| HA21 | CA2 | P | HP1 | 153.1° | 61.9° |
| HA22 | CA2 | P | OP1 | 159.8° | 61.8° |
| HA22 | CA2 | P | OP2 | 70.5° | 64.5° |
| HA22 | CA2 | P | HP1 | 43.7° | 178.7° |
| OP1 | P | OP2 | HP1 | 115.7° | 129.8° |






