4FW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.44Å | 1.45Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CA | CB | sing | 1.55Å | 1.52Å | |
| CA | C | sing | 1.52Å | 1.53Å | |
| CA | HA | sing | 1.10Å | 1.10Å | |
| CB | CG | sing | 1.48Å | 1.48Å | |
| CB | HB2 | sing | 1.11Å | 1.10Å | |
| CB | HB3 | sing | 1.11Å | 1.10Å | |
| CG | CD2 | sing | 1.42Å | 1.43Å | Aromatic |
| CG | CD1 | doub | 1.38Å | 1.36Å | Aromatic |
| CD2 | CE2 | doub | 1.40Å | 1.41Å | Aromatic |
| CD2 | CE3 | sing | 1.41Å | 1.40Å | Aromatic |
| CE2 | NE1 | sing | 1.38Å | 1.37Å | Aromatic |
| CE2 | CZ2 | sing | 1.40Å | 1.40Å | Aromatic |
| CE3 | CZ3 | doub | 1.40Å | 1.39Å | Aromatic |
| CE3 | F | sing | 1.34Å | 1.33Å | |
| CD1 | NE1 | sing | 1.37Å | 1.37Å | Aromatic |
| CD1 | HD1 | sing | 1.08Å | 1.08Å | |
| NE1 | HE1 | sing | 1.01Å | 1.00Å | |
| CZ2 | CH2 | doub | 1.40Å | 1.37Å | Aromatic |
| CZ2 | HZ2 | sing | 1.09Å | 1.08Å | |
| CZ3 | CH2 | sing | 1.39Å | 1.41Å | Aromatic |
| CZ3 | HZ3 | sing | 1.09Å | 1.08Å | |
| CH2 | HH2 | sing | 1.09Å | 1.08Å | |
| C | O | doub | 1.23Å | 1.23Å | |
| C | OXT | sing | 1.35Å | 51.40Å | |
| OXT | HXT | sing | 0.98Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | H | 109.4° | 119.0° |
| CA | N | H2 | 109.5° | 119.1° |
| N | CA | CB | 109.5° | 110.7° |
| N | CA | C | 113.1° | 111.2° |
| N | CA | HA | 107.1° | 106.2° |
| H | N | H2 | 109.5° | 120.6° |
| CB | CA | C | 109.9° | 111.0° |
| CB | CA | HA | 110.5° | 110.7° |
| CA | CB | CG | 113.7° | 114.1° |
| CA | CB | HB2 | 107.1° | 108.9° |
| CA | CB | HB3 | 108.1° | 108.6° |
| C | CA | HA | 106.7° | 106.9° |
| CA | C | O | 120.6° | 122.9° |
| CA | C | OXT | 52.0° | 114.9° |
| CG | CB | HB2 | 107.1° | 109.6° |
| CG | CB | HB3 | 108.1° | 111.3° |
| CB | CG | CD2 | 126.1° | 126.6° |
| CB | CG | CD1 | 127.3° | 125.7° |
| HB2 | CB | HB3 | 112.8° | 103.7° |
| CD2 | CG | CD1 | 106.4° | 107.7° |
| CG | CD2 | CE2 | 107.2° | 107.0° |
| CG | CD2 | CE3 | 133.9° | 134.1° |
| CG | CD1 | NE1 | 110.1° | 108.0° |
| CG | CD1 | HD1 | 124.9° | 131.6° |
| CE2 | CD2 | CE3 | 118.8° | 118.8° |
| CD2 | CE2 | NE1 | 107.3° | 107.1° |
| CD2 | CE2 | CZ2 | 122.4° | 122.6° |
| CD2 | CE3 | CZ3 | 118.8° | 119.1° |
| CD2 | CE3 | F | 121.5° | 121.0° |
| NE1 | CE2 | CZ2 | 130.3° | 130.2° |
| CE2 | NE1 | CD1 | 109.0° | 110.2° |
| CE2 | NE1 | HE1 | 125.6° | 124.9° |
| CE2 | CZ2 | CH2 | 117.7° | 117.6° |
| CE2 | CZ2 | HZ2 | 121.1° | 121.4° |
| CZ3 | CE3 | F | 119.7° | 119.8° |
| CE3 | CZ3 | CH2 | 121.0° | 120.8° |
| CE3 | CZ3 | HZ3 | 119.5° | 119.5° |
| NE1 | CD1 | HD1 | 125.0° | 120.5° |
| CD1 | NE1 | HE1 | 125.5° | 125.0° |
| CH2 | CZ2 | HZ2 | 121.2° | 121.0° |
| CZ2 | CH2 | CZ3 | 121.3° | 121.0° |
| CZ2 | CH2 | HH2 | 119.3° | 119.4° |
| CH2 | CZ3 | HZ3 | 119.5° | 119.7° |
| CZ3 | CH2 | HH2 | 119.4° | 119.6° |
| O | C | OXT | 92.0° | 122.2° |
| C | OXT | HXT | 52.0° | 114.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 120.0° | 166.4° |
| N | CA | CB | C | 124.8° | 124.0° |
| N | CA | CB | HA | 117.7° | 117.4° |
| N | CA | C | HA | 117.4° | 115.5° |
| N | CA | CB | CG | 83.2° | 157.4° |
| N | CA | CB | HB2 | 158.7° | 34.6° |
| N | CA | CB | HB3 | 36.8° | 77.8° |
| N | CA | C | O | 132.6° | 34.5° |
| N | CA | C | OXT | 161.6° | 145.1° |
| H | N | CA | CB | 50.9° | 111.6° |
| H | N | CA | C | 72.0° | 12.3° |
| H | N | CA | HA | 170.7° | 128.3° |
| H2 | N | CA | CB | 170.9° | 81.8° |
| H2 | N | CA | C | 48.0° | 154.3° |
| H2 | N | CA | HA | 69.3° | 38.3° |
| CB | CA | C | HA | 119.8° | 120.8° |
| CA | CB | CG | HB2 | 118.1° | 122.5° |
| CA | CB | CG | HB3 | 120.0° | 123.4° |
| CA | CB | HB2 | HB3 | 118.8° | 115.5° |
| CA | CB | CG | CD2 | 74.9° | 89.9° |
| CA | CB | CG | CD1 | 111.8° | 90.0° |
| CB | CA | C | O | 104.6° | 89.2° |
| CB | CA | C | OXT | 38.9° | 91.2° |
| C | CA | CB | CG | 152.0° | 78.6° |
| C | CA | CB | HB2 | 33.8° | 158.6° |
| C | CA | CB | HB3 | 88.0° | 46.2° |
| CA | C | O | OXT | 46.0° | 179.5° |
| CA | C | OXT | HXT | 180.0° | 179.6° |
| HA | CA | CB | CG | 34.5° | 40.0° |
| HA | CA | CB | HB2 | 83.6° | 82.8° |
| HA | CA | CB | HB3 | 154.5° | 164.8° |
| HA | CA | C | O | 15.2° | 150.0° |
| HA | CA | C | OXT | 80.9° | 29.6° |
| CG | CB | HB2 | HB3 | 118.8° | 119.0° |
| CB | CG | CD2 | CD1 | 174.5° | 179.9° |
| CB | CG | CD2 | CE2 | 174.1° | 180.0° |
| CB | CG | CD2 | CE3 | 6.7° | 0.1° |
| CB | CG | CD1 | NE1 | 173.7° | 180.0° |
| CB | CG | CD1 | HD1 | 6.2° | 0.1° |
| HB2 | CB | CG | CD2 | 43.3° | 32.5° |
| HB2 | CB | CG | CD1 | 130.1° | 147.6° |
| HB3 | CB | CG | CD2 | 165.1° | 146.7° |
| HB3 | CB | CG | CD1 | 8.2° | 33.4° |
| CG | CD2 | CE2 | CE3 | 179.4° | 180.0° |
| CG | CD2 | CE2 | NE1 | 0.0° | 0.0° |
| CG | CD2 | CE2 | CZ2 | 179.7° | 179.9° |
| CG | CD2 | CE3 | CZ3 | 179.8° | 180.0° |
| CG | CD2 | CE3 | F | 0.5° | 0.1° |
| CD2 | CG | CD1 | NE1 | 0.6° | 0.1° |
| CD2 | CG | CD1 | HD1 | 179.4° | 180.0° |
| CD1 | CG | CD2 | CE2 | 0.4° | 0.1° |
| CD1 | CG | CD2 | CE3 | 178.9° | 180.0° |
| CG | CD1 | NE1 | CE2 | 0.7° | 0.0° |
| CG | CD1 | NE1 | HD1 | 180.0° | 179.9° |
| CG | CD1 | NE1 | HE1 | 179.3° | 180.0° |
| CD2 | CE2 | NE1 | CZ2 | 179.7° | 179.9° |
| CE2 | CD2 | CE3 | CZ3 | 1.0° | 0.1° |
| CE2 | CD2 | CE3 | F | 179.7° | 179.9° |
| CD2 | CE2 | NE1 | CD1 | 0.4° | 0.0° |
| CD2 | CE2 | NE1 | HE1 | 179.6° | 179.9° |
| CD2 | CE2 | CZ2 | CH2 | 0.4° | 0.1° |
| CD2 | CE2 | CZ2 | HZ2 | 179.6° | 180.0° |
| CE3 | CD2 | CE2 | NE1 | 179.4° | 180.0° |
| CE3 | CD2 | CE2 | CZ2 | 0.9° | 0.1° |
| CD2 | CE3 | CZ3 | F | 179.3° | 179.9° |
| CD2 | CE3 | CZ3 | CH2 | 0.7° | 0.1° |
| CD2 | CE3 | CZ3 | HZ3 | 179.3° | 180.0° |
| CE2 | NE1 | CD1 | HE1 | 180.0° | 179.9° |
| CE2 | NE1 | CD1 | HD1 | 179.4° | 180.0° |
| NE1 | CE2 | CZ2 | CH2 | 180.0° | 180.0° |
| NE1 | CE2 | CZ2 | HZ2 | 0.0° | 0.1° |
| CZ2 | CE2 | NE1 | CD1 | 179.9° | 179.9° |
| CZ2 | CE2 | NE1 | HE1 | 0.1° | 0.0° |
| CE2 | CZ2 | CH2 | HZ2 | 180.0° | 179.9° |
| CE2 | CZ2 | CH2 | CZ3 | 0.1° | 0.1° |
| CE2 | CZ2 | CH2 | HH2 | 179.9° | 180.0° |
| CE3 | CZ3 | CH2 | CZ2 | 0.2° | 0.1° |
| CE3 | CZ3 | CH2 | HZ3 | 180.0° | 180.0° |
| CE3 | CZ3 | CH2 | HH2 | 179.7° | 180.0° |
| F | CE3 | CZ3 | CH2 | 180.0° | 179.9° |
| F | CE3 | CZ3 | HZ3 | 0.0° | 0.1° |
| HD1 | CD1 | NE1 | HE1 | 0.6° | 0.1° |
| CZ2 | CH2 | CZ3 | HH2 | 180.0° | 179.9° |
| CZ2 | CH2 | CZ3 | HZ3 | 179.7° | 179.9° |
| HZ2 | CZ2 | CH2 | CZ3 | 179.9° | 180.0° |
| HZ2 | CZ2 | CH2 | HH2 | 0.1° | 0.1° |
| HZ3 | CZ3 | CH2 | HH2 | 0.3° | 0.1° |
| O | C | OXT | HXT | 51.7° | 0.0° |
