NLF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CB | CG | sing | 1.51Å | 1.58Å | |
| CB | CA | sing | 1.53Å | 1.57Å | |
| C | O | doub | 1.21Å | 1.16Å | |
| C | CA | sing | 1.51Å | 1.55Å | |
| CD1 | CG | doub | 1.34Å | 1.38Å | Aromatic |
| CD1 | NE1 | sing | 1.37Å | 1.38Å | Aromatic |
| CG | CD2 | sing | 1.47Å | 1.36Å | Aromatic |
| CA | N | sing | 1.47Å | 1.41Å | |
| NE1 | CE2 | sing | 1.38Å | 1.36Å | Aromatic |
| N | C22 | sing | 1.35Å | 1.44Å | |
| CD2 | CE2 | doub | 1.41Å | 1.39Å | Aromatic |
| CD2 | CE3 | sing | 1.40Å | 1.56Å | Aromatic |
| CE2 | CZ2 | sing | 1.39Å | 1.56Å | Aromatic |
| CE3 | CZ3 | doub | 1.37Å | 1.49Å | Aromatic |
| C22 | O23 | doub | 1.21Å | 1.17Å | |
| CZ2 | CH2 | doub | 1.38Å | 1.50Å | Aromatic |
| CZ3 | CH2 | sing | 1.39Å | 1.47Å | Aromatic |
| C | OXT | sing | 1.34Å | 1.52Å | |
| CE3 | HE3 | sing | 1.08Å | 1.08Å | |
| CZ3 | HZ3 | sing | 1.08Å | 1.08Å | |
| CH2 | HH2 | sing | 1.08Å | 1.08Å | |
| CZ2 | HZ2 | sing | 1.08Å | 1.08Å | |
| CD1 | HD1 | sing | 1.08Å | 1.08Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| CB | HB3 | sing | 1.09Å | 1.10Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| N | H | sing | 0.97Å | 1.00Å | |
| NE1 | HE1 | sing | 0.97Å | 1.00Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CG | CB | CA | 107.6° | 109.5° |
| CB | CG | CD1 | 126.4° | 126.5° |
| CB | CG | CD2 | 125.7° | 126.5° |
| CG | CB | HB2 | 109.9° | 109.5° |
| CG | CB | HB3 | 109.9° | 109.5° |
| CB | CA | C | 111.2° | 109.5° |
| CB | CA | N | 112.4° | 109.5° |
| CA | CB | HB2 | 109.9° | 109.5° |
| CA | CB | HB3 | 109.9° | 109.4° |
| CB | CA | HA | 107.4° | 109.5° |
| O | C | CA | 117.4° | 120.0° |
| O | C | OXT | 121.2° | 120.0° |
| C | CA | N | 108.7° | 109.5° |
| CA | C | OXT | 121.4° | 120.0° |
| C | CA | HA | 107.6° | 109.5° |
| CG | CD1 | NE1 | 108.1° | 109.9° |
| CD1 | CG | CD2 | 107.9° | 107.0° |
| CG | CD1 | HD1 | 126.0° | 125.1° |
| CD1 | NE1 | CE2 | 107.9° | 109.9° |
| NE1 | CD1 | HD1 | 125.9° | 125.0° |
| CD1 | NE1 | HE1 | 126.0° | 125.0° |
| CG | CD2 | CE2 | 107.7° | 106.1° |
| CG | CD2 | CE3 | 131.5° | 134.0° |
| CA | N | C22 | 122.2° | 120.0° |
| N | CA | HA | 109.5° | 109.5° |
| CA | N | H | 118.9° | 120.0° |
| NE1 | CE2 | CD2 | 108.4° | 107.2° |
| NE1 | CE2 | CZ2 | 131.7° | 133.5° |
| CE2 | NE1 | HE1 | 126.0° | 125.1° |
| N | C22 | O23 | 122.0° | 120.0° |
| N | C22 | H221 | 119.0° | 120.0° |
| C22 | N | H | 118.9° | 120.0° |
| CE2 | CD2 | CE3 | 120.8° | 119.9° |
| CD2 | CE2 | CZ2 | 119.9° | 119.3° |
| CD2 | CE3 | CZ3 | 119.9° | 119.8° |
| CD2 | CE3 | HE3 | 120.0° | 120.1° |
| CE2 | CZ2 | CH2 | 119.1° | 119.8° |
| CE2 | CZ2 | HZ2 | 120.4° | 120.1° |
| CE3 | CZ3 | CH2 | 119.2° | 120.5° |
| CZ3 | CE3 | HE3 | 120.1° | 120.1° |
| CE3 | CZ3 | HZ3 | 120.4° | 119.8° |
| O23 | C22 | H221 | 119.0° | 119.9° |
| CZ2 | CH2 | CZ3 | 121.0° | 120.6° |
| CZ2 | CH2 | HH2 | 119.5° | 119.7° |
| CH2 | CZ2 | HZ2 | 120.4° | 120.1° |
| CH2 | CZ3 | HZ3 | 120.4° | 119.7° |
| CZ3 | CH2 | HH2 | 119.5° | 119.7° |
| C | OXT | HXT | 109.5° | 117.0° |
| HB2 | CB | HB3 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CG | CB | CA | HB2 | 119.7° | 120.0° |
| CG | CB | CA | HB3 | 119.7° | 120.0° |
| CG | CB | CA | C | 178.4° | 175.0° |
| CB | CG | CD1 | CD2 | 179.0° | 180.0° |
| CB | CG | CD1 | NE1 | 179.3° | 180.0° |
| CG | CB | CA | N | 56.3° | 65.0° |
| CB | CG | CD2 | CE2 | 179.4° | 179.9° |
| CB | CG | CD2 | CE3 | 0.9° | 0.6° |
| CB | CG | CD1 | HD1 | 0.7° | 0.0° |
| CG | CB | HB2 | HB3 | 120.9° | 120.0° |
| CG | CB | CA | HA | 64.2° | 55.0° |
| CB | CA | C | O | 83.1° | 120.0° |
| CB | CA | C | N | 124.3° | 120.0° |
| CB | CA | C | HA | 117.3° | 120.0° |
| CA | CB | CG | CD1 | 111.5° | 95.0° |
| CA | CB | CG | CD2 | 67.4° | 85.0° |
| CB | CA | N | HA | 119.2° | 120.0° |
| CB | CA | N | C22 | 152.2° | 155.0° |
| CB | CA | C | OXT | 98.1° | 60.0° |
| CA | CB | HB2 | HB3 | 120.9° | 120.0° |
| CB | CA | N | H | 27.8° | 25.0° |
| O | C | CA | OXT | 178.8° | 180.0° |
| O | C | CA | N | 152.7° | 0.0° |
| O | C | CA | HA | 34.2° | 120.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| C | CA | N | HA | 117.2° | 120.0° |
| C | CA | N | C22 | 84.2° | 85.0° |
| C | CA | CB | HB2 | 61.9° | 65.0° |
| C | CA | CB | HB3 | 58.7° | 55.0° |
| C | CA | N | H | 95.8° | 95.0° |
| CA | C | OXT | HXT | 178.7° | 180.0° |
| CG | CD1 | NE1 | HD1 | 180.0° | 180.0° |
| CG | CD1 | NE1 | CE2 | 0.1° | 0.2° |
| CD1 | CG | CD2 | CE2 | 0.4° | 0.1° |
| CD1 | CG | CD2 | CE3 | 179.9° | 179.4° |
| CD1 | CG | CB | HB2 | 128.8° | 144.9° |
| CD1 | CG | CB | HB3 | 8.2° | 25.0° |
| CG | CD1 | NE1 | HE1 | 179.9° | 180.0° |
| NE1 | CD1 | CG | CD2 | 0.3° | 0.0° |
| CD1 | NE1 | CE2 | HE1 | 180.0° | 179.8° |
| CD1 | NE1 | CE2 | CD2 | 0.1° | 0.2° |
| CD1 | NE1 | CE2 | CZ2 | 179.8° | 179.9° |
| CG | CD2 | CE2 | NE1 | 0.3° | 0.2° |
| CG | CD2 | CE2 | CE3 | 179.8° | 179.4° |
| CG | CD2 | CE2 | CZ2 | 179.6° | 180.0° |
| CG | CD2 | CE3 | CZ3 | 179.9° | 179.9° |
| CG | CD2 | CE3 | HE3 | 0.1° | 0.4° |
| CD2 | CG | CD1 | HD1 | 179.7° | 179.9° |
| CD2 | CG | CB | HB2 | 52.3° | 35.1° |
| CD2 | CG | CB | HB3 | 172.9° | 155.1° |
| CA | N | C22 | H | 180.0° | 180.0° |
| CA | N | C22 | O23 | 1.5° | 0.0° |
| N | CA | C | OXT | 26.1° | 180.0° |
| N | CA | CB | HB2 | 176.0° | 55.0° |
| N | CA | CB | HB3 | 63.4° | 175.0° |
| CA | N | C22 | H221 | 178.5° | 180.0° |
| NE1 | CE2 | CD2 | CZ2 | 179.9° | 179.8° |
| NE1 | CE2 | CD2 | CE3 | 179.9° | 179.6° |
| NE1 | CE2 | CZ2 | CH2 | 179.8° | 180.0° |
| NE1 | CE2 | CZ2 | HZ2 | 0.3° | 0.1° |
| CE2 | NE1 | CD1 | HD1 | 179.9° | 179.8° |
| N | C22 | O23 | H221 | 180.0° | 180.0° |
| C22 | N | CA | HA | 33.0° | 35.0° |
| CE2 | CD2 | CE3 | CZ3 | 0.2° | 0.6° |
| CD2 | CE2 | CZ2 | CH2 | 0.3° | 0.3° |
| CE2 | CD2 | CE3 | HE3 | 179.8° | 179.7° |
| CD2 | CE2 | CZ2 | HZ2 | 179.7° | 179.8° |
| CD2 | CE2 | NE1 | HE1 | 179.9° | 180.0° |
| CE3 | CD2 | CE2 | CZ2 | 0.1° | 0.6° |
| CD2 | CE3 | CZ3 | HE3 | 180.0° | 179.7° |
| CD2 | CE3 | CZ3 | CH2 | 0.2° | 0.3° |
| CD2 | CE3 | CZ3 | HZ3 | 179.7° | 179.8° |
| CE2 | CZ2 | CH2 | HZ2 | 180.0° | 179.9° |
| CE2 | CZ2 | CH2 | CZ3 | 0.2° | 0.0° |
| CE2 | CZ2 | CH2 | HH2 | 179.7° | 180.0° |
| CZ2 | CE2 | NE1 | HE1 | 0.2° | 0.3° |
| CE3 | CZ3 | CH2 | CZ2 | 0.0° | 0.0° |
| CE3 | CZ3 | CH2 | HZ3 | 180.0° | 179.9° |
| CE3 | CZ3 | CH2 | HH2 | 180.0° | 180.0° |
| O23 | C22 | N | H | 178.5° | 180.0° |
| CZ2 | CH2 | CZ3 | HH2 | 180.0° | 180.0° |
| CZ2 | CH2 | CZ3 | HZ3 | 180.0° | 179.9° |
| CH2 | CZ3 | CE3 | HE3 | 179.7° | 180.0° |
| CZ3 | CH2 | CZ2 | HZ2 | 179.7° | 179.9° |
| OXT | C | CA | HA | 144.6° | 60.0° |
| HE3 | CE3 | CZ3 | HZ3 | 0.3° | 0.0° |
| HZ3 | CZ3 | CH2 | HH2 | 0.0° | 0.0° |
| HH2 | CH2 | CZ2 | HZ2 | 0.3° | 0.0° |
| HD1 | CD1 | NE1 | HE1 | 0.1° | 0.0° |
| HB2 | CB | CA | HA | 55.5° | 175.0° |
| HB3 | CB | CA | HA | 176.1° | 65.0° |
| HA | CA | N | H | 147.0° | 145.0° |
| H221 | C22 | N | H | 1.5° | 0.0° |
