4LT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C | doub | 1.21Å | 1.23Å | |
| C | CA | sing | 1.51Å | 1.51Å | |
| F | CA | sing | 1.40Å | 1.39Å | |
| CA | CB | sing | 1.53Å | 1.52Å | |
| C | O1 | sing | 1.34Å | 1.33Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | HB3 | sing | 1.09Å | 1.10Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| CB | HB1 | sing | 1.09Å | 1.10Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | CA | 117.0° | 120.0° |
| O | C | O1 | 123.0° | 120.0° |
| C | CA | F | 109.5° | 109.4° |
| C | CA | CB | 109.5° | 109.5° |
| CA | C | O1 | 120.0° | 120.0° |
| C | CA | HA | 109.0° | 109.5° |
| F | CA | CB | 109.4° | 109.4° |
| F | CA | HA | 110.7° | 109.5° |
| CB | CA | HA | 108.8° | 109.5° |
| CA | CB | HB3 | 109.5° | 109.4° |
| CA | CB | HB2 | 109.4° | 109.4° |
| CA | CB | HB1 | 109.5° | 109.4° |
| C | O1 | H1 | 109.5° | 117.0° |
| HB3 | CB | HB2 | 109.5° | 109.5° |
| HB3 | CB | HB1 | 109.5° | 109.5° |
| HB2 | CB | HB1 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | CA | O1 | 180.0° | 179.7° |
| O | C | CA | F | 15.3° | 74.7° |
| O | C | CA | CB | 104.7° | 45.3° |
| O | C | CA | HA | 136.4° | 165.3° |
| O | C | O1 | H1 | 0.0° | 0.2° |
| C | CA | F | CB | 120.0° | 120.0° |
| C | CA | F | HA | 120.1° | 120.0° |
| C | CA | CB | HA | 119.0° | 120.0° |
| C | CA | CB | HB3 | 180.0° | 59.9° |
| C | CA | CB | HB2 | 60.0° | 180.0° |
| C | CA | CB | HB1 | 60.0° | 60.0° |
| CA | C | O1 | H1 | 180.0° | 180.0° |
| F | CA | CB | HA | 121.0° | 120.0° |
| F | CA | C | O1 | 164.7° | 105.0° |
| F | CA | CB | HB3 | 60.1° | 60.0° |
| F | CA | CB | HB2 | 180.0° | 60.0° |
| F | CA | CB | HB1 | 60.0° | 180.0° |
| CB | CA | C | O1 | 75.3° | 135.0° |
| CA | CB | HB3 | HB2 | 120.0° | 120.0° |
| CA | CB | HB3 | HB1 | 120.0° | 119.9° |
| CA | CB | HB2 | HB1 | 120.0° | 119.9° |
| O1 | C | CA | HA | 43.6° | 15.0° |
| HA | CA | CB | HB3 | 61.0° | 180.0° |
| HA | CA | CB | HB2 | 59.0° | 60.0° |
| HA | CA | CB | HB1 | 179.0° | 60.0° |
| HB3 | CB | HB2 | HB1 | 120.0° | 120.1° |
