7VU
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CE2 | CD2 | doub | 1.38Å | 1.38Å | Aromatic |
| CE2 | CZ | sing | 1.38Å | 1.38Å | Aromatic |
| CH | CZ | sing | 1.51Å | 1.51Å | |
| CD2 | CG | sing | 1.38Å | 1.39Å | Aromatic |
| CZ | CE1 | doub | 1.38Å | 1.38Å | Aromatic |
| CG | CB | sing | 1.51Å | 1.51Å | |
| CG | CD1 | doub | 1.38Å | 1.39Å | Aromatic |
| CB | CA | sing | 1.53Å | 1.53Å | |
| CE1 | CD1 | sing | 1.38Å | 1.39Å | Aromatic |
| O | C | doub | 1.21Å | 1.23Å | |
| C | CA | sing | 1.51Å | 1.55Å | |
| CA | N | sing | 1.47Å | 1.46Å | |
| N | C1 | sing | 1.47Å | 1.48Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C | OXT | sing | 1.34Å | 1.35Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | H4 | sing | 1.09Å | 1.10Å | |
| CB | H5 | sing | 1.09Å | 1.10Å | |
| CD1 | H6 | sing | 1.08Å | 1.08Å | |
| CD2 | H7 | sing | 1.08Å | 1.08Å | |
| CE1 | H8 | sing | 1.08Å | 1.08Å | |
| CE2 | H9 | sing | 1.08Å | 1.08Å | |
| CH | H10 | sing | 1.09Å | 1.10Å | |
| CH | H11 | sing | 1.09Å | 1.10Å | |
| CH | H12 | sing | 1.09Å | 1.10Å | |
| C1 | H13 | sing | 1.09Å | 1.10Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C2 | H15 | sing | 1.09Å | 1.10Å | |
| C2 | H16 | sing | 1.09Å | 1.10Å | |
| C2 | H17 | sing | 1.09Å | 1.10Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CD2 | CE2 | CZ | 121.2° | 120.0° |
| CE2 | CD2 | CG | 121.1° | 120.0° |
| CE2 | CD2 | H7 | 119.5° | 120.0° |
| CD2 | CE2 | H9 | 119.4° | 120.1° |
| CE2 | CZ | CH | 121.3° | 119.9° |
| CE2 | CZ | CE1 | 117.7° | 120.0° |
| CZ | CE2 | H9 | 119.4° | 120.0° |
| CH | CZ | CE1 | 121.0° | 120.1° |
| CZ | CH | H10 | 109.5° | 109.5° |
| CZ | CH | H11 | 109.5° | 109.4° |
| CZ | CH | H12 | 109.4° | 109.6° |
| CD2 | CG | CB | 121.2° | 120.0° |
| CD2 | CG | CD1 | 117.8° | 120.0° |
| CG | CD2 | H7 | 119.5° | 120.0° |
| CZ | CE1 | CD1 | 121.3° | 120.0° |
| CZ | CE1 | H8 | 119.4° | 120.0° |
| CB | CG | CD1 | 120.9° | 120.0° |
| CG | CB | CA | 112.5° | 109.5° |
| CG | CB | H4 | 108.7° | 109.5° |
| CG | CB | H5 | 108.7° | 109.5° |
| CG | CD1 | CE1 | 120.9° | 120.0° |
| CG | CD1 | H6 | 119.5° | 120.0° |
| CB | CA | C | 110.7° | 109.5° |
| CB | CA | N | 116.1° | 109.5° |
| CB | CA | HA | 105.9° | 109.5° |
| CA | CB | H4 | 108.7° | 109.5° |
| CA | CB | H5 | 108.7° | 109.5° |
| CE1 | CD1 | H6 | 119.5° | 120.0° |
| CD1 | CE1 | H8 | 119.3° | 120.0° |
| O | C | CA | 119.5° | 120.0° |
| O | C | OXT | 122.2° | 120.0° |
| C | CA | N | 111.1° | 109.5° |
| CA | C | OXT | 118.3° | 120.0° |
| C | CA | HA | 105.7° | 109.4° |
| CA | N | C1 | 116.4° | 111.0° |
| CA | N | H | 107.7° | 111.0° |
| N | CA | HA | 106.7° | 109.5° |
| N | C1 | C2 | 114.4° | 109.4° |
| C1 | N | H | 107.7° | 111.0° |
| N | C1 | H13 | 108.2° | 109.6° |
| N | C1 | H14 | 108.2° | 109.5° |
| C2 | C1 | H13 | 108.3° | 109.5° |
| C2 | C1 | H14 | 108.2° | 109.4° |
| C1 | C2 | H15 | 109.5° | 109.5° |
| C1 | C2 | H16 | 109.5° | 109.5° |
| C1 | C2 | H17 | 109.5° | 109.5° |
| C | OXT | HXT | 109.5° | 116.9° |
| H4 | CB | H5 | 109.5° | 109.4° |
| H10 | CH | H11 | 109.5° | 109.4° |
| H10 | CH | H12 | 109.5° | 109.5° |
| H11 | CH | H12 | 109.5° | 109.5° |
| H13 | C1 | H14 | 109.4° | 109.4° |
| H15 | C2 | H16 | 109.4° | 109.4° |
| H15 | C2 | H17 | 109.5° | 109.4° |
| H16 | C2 | H17 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CD2 | CE2 | CZ | H9 | 180.0° | 180.0° |
| CD2 | CE2 | CZ | CH | 179.8° | 180.0° |
| CE2 | CD2 | CG | H7 | 180.0° | 180.0° |
| CD2 | CE2 | CZ | CE1 | 0.8° | 0.4° |
| CE2 | CD2 | CG | CB | 179.1° | 180.0° |
| CE2 | CD2 | CG | CD1 | 2.7° | 0.3° |
| CE2 | CZ | CH | CE1 | 179.3° | 179.6° |
| CZ | CE2 | CD2 | CG | 1.1° | 0.0° |
| CE2 | CZ | CE1 | CD1 | 1.1° | 0.4° |
| CZ | CE2 | CD2 | H7 | 178.9° | 179.9° |
| CE2 | CZ | CE1 | H8 | 178.9° | 179.7° |
| CE2 | CZ | CH | H10 | 90.4° | 90.0° |
| CE2 | CZ | CH | H11 | 149.6° | 150.1° |
| CE2 | CZ | CH | H12 | 29.7° | 30.0° |
| CH | CZ | CE1 | CD1 | 179.5° | 180.0° |
| CH | CZ | CE1 | H8 | 0.5° | 0.1° |
| CH | CZ | CE2 | H9 | 0.2° | 0.0° |
| CZ | CH | H10 | H11 | 120.0° | 119.9° |
| CZ | CH | H10 | H12 | 120.0° | 120.1° |
| CZ | CH | H11 | H12 | 120.0° | 120.1° |
| CD2 | CG | CB | CD1 | 176.3° | 179.7° |
| CD2 | CG | CB | CA | 128.1° | 90.3° |
| CD2 | CG | CD1 | CE1 | 2.4° | 0.3° |
| CD2 | CG | CB | H4 | 111.5° | 149.7° |
| CD2 | CG | CB | H5 | 7.6° | 29.7° |
| CD2 | CG | CD1 | H6 | 177.7° | 179.7° |
| CG | CD2 | CE2 | H9 | 178.9° | 180.0° |
| CZ | CE1 | CD1 | CG | 0.5° | 0.0° |
| CZ | CE1 | CD1 | H8 | 180.0° | 179.9° |
| CZ | CE1 | CD1 | H6 | 179.6° | 180.0° |
| CE1 | CZ | CE2 | H9 | 179.2° | 179.7° |
| CE1 | CZ | CH | H10 | 90.3° | 90.3° |
| CE1 | CZ | CH | H11 | 29.7° | 29.6° |
| CE1 | CZ | CH | H12 | 149.7° | 149.6° |
| CG | CB | CA | H4 | 120.4° | 120.0° |
| CG | CB | CA | H5 | 120.4° | 120.0° |
| CB | CG | CD1 | CE1 | 178.8° | 180.0° |
| CG | CB | CA | C | 175.9° | 175.0° |
| CG | CB | CA | N | 56.3° | 65.0° |
| CG | CB | CA | HA | 61.8° | 55.0° |
| CG | CB | H4 | H5 | 118.6° | 120.0° |
| CB | CG | CD1 | H6 | 1.3° | 0.0° |
| CB | CG | CD2 | H7 | 1.0° | 0.0° |
| CD1 | CG | CB | CA | 48.2° | 90.0° |
| CG | CD1 | CE1 | H6 | 180.0° | 180.0° |
| CD1 | CG | CB | H4 | 72.2° | 30.0° |
| CD1 | CG | CB | H5 | 168.7° | 150.0° |
| CD1 | CG | CD2 | H7 | 177.4° | 179.7° |
| CG | CD1 | CE1 | H8 | 179.5° | 180.0° |
| CB | CA | C | O | 54.0° | 120.0° |
| CB | CA | C | N | 130.4° | 120.0° |
| CB | CA | C | HA | 114.2° | 120.0° |
| CB | CA | N | HA | 117.7° | 120.0° |
| CB | CA | N | C1 | 50.8° | 155.0° |
| CB | CA | C | OXT | 125.4° | 59.9° |
| CB | CA | N | H | 70.2° | 81.1° |
| CA | CB | H4 | H5 | 118.7° | 119.9° |
| O | C | CA | OXT | 179.4° | 179.9° |
| O | C | CA | N | 76.5° | 0.1° |
| O | C | CA | HA | 168.2° | 120.0° |
| O | C | OXT | HXT | 0.0° | 0.1° |
| C | CA | N | HA | 114.8° | 120.0° |
| C | CA | N | C1 | 76.8° | 85.0° |
| C | CA | N | H | 162.2° | 39.0° |
| C | CA | CB | H4 | 55.5° | 65.0° |
| C | CA | CB | H5 | 63.7° | 54.9° |
| CA | C | OXT | HXT | 179.3° | 180.0° |
| CA | N | C1 | H | 121.0° | 123.9° |
| CA | N | C1 | C2 | 103.9° | 180.0° |
| N | CA | C | OXT | 104.2° | 180.0° |
| N | CA | CB | H4 | 176.8° | 55.1° |
| N | CA | CB | H5 | 64.1° | 175.0° |
| CA | N | C1 | H13 | 16.8° | 60.0° |
| CA | N | C1 | H14 | 135.3° | 60.0° |
| N | C1 | C2 | H13 | 120.7° | 120.1° |
| N | C1 | C2 | H14 | 120.7° | 120.0° |
| C1 | N | CA | HA | 168.5° | 35.0° |
| N | C1 | H13 | H14 | 117.7° | 120.1° |
| N | C1 | C2 | H15 | 180.0° | 180.0° |
| N | C1 | C2 | H16 | 60.0° | 60.0° |
| N | C1 | C2 | H17 | 60.0° | 60.0° |
| C2 | C1 | N | H | 135.0° | 56.0° |
| C2 | C1 | H13 | H14 | 117.8° | 119.9° |
| C1 | C2 | H15 | H16 | 120.0° | 120.0° |
| C1 | C2 | H15 | H17 | 120.0° | 120.0° |
| C1 | C2 | H16 | H17 | 120.0° | 120.1° |
| OXT | C | CA | HA | 11.2° | 60.1° |
| H | N | CA | HA | 47.5° | 158.9° |
| H | N | C1 | H13 | 104.2° | 176.0° |
| H | N | C1 | H14 | 14.3° | 63.9° |
| HA | CA | CB | H4 | 58.7° | 175.1° |
| HA | CA | CB | H5 | 177.8° | 65.0° |
| H6 | CD1 | CE1 | H8 | 0.4° | 0.0° |
| H7 | CD2 | CE2 | H9 | 1.1° | 0.0° |
| H10 | CH | H11 | H12 | 120.0° | 120.0° |
| H13 | C1 | C2 | H15 | 59.3° | 59.9° |
| H13 | C1 | C2 | H16 | 179.3° | 179.9° |
| H13 | C1 | C2 | H17 | 60.7° | 60.0° |
| H14 | C1 | C2 | H15 | 59.2° | 60.0° |
| H14 | C1 | C2 | H16 | 60.7° | 60.0° |
| H14 | C1 | C2 | H17 | 179.3° | 179.9° |
| H15 | C2 | H16 | H17 | 120.0° | 120.0° |
