F7W
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O | C | doub | 1.21Å | 1.24Å | |
C | CA | sing | 1.51Å | 1.51Å | |
NE1 | CD1 | sing | 1.37Å | 1.37Å | Aromatic |
NE1 | CE2 | sing | 1.38Å | 1.35Å | Aromatic |
CD1 | CG | doub | 1.34Å | 1.37Å | Aromatic |
F1 | CZ2 | sing | 1.35Å | 1.34Å | |
CE2 | CZ2 | doub | 1.39Å | 1.43Å | Aromatic |
CE2 | CD2 | sing | 1.41Å | 1.44Å | Aromatic |
CA | N | sing | 1.47Å | 1.45Å | |
CA | CB | sing | 1.53Å | 1.52Å | |
CG | CB | sing | 1.51Å | 1.49Å | |
CG | CD2 | sing | 1.46Å | 1.46Å | Aromatic |
CZ2 | CH2 | sing | 1.38Å | 1.36Å | Aromatic |
CD2 | CE3 | doub | 1.40Å | 1.40Å | Aromatic |
CH2 | CZ3 | doub | 1.39Å | 1.41Å | Aromatic |
CE3 | CZ3 | sing | 1.37Å | 1.40Å | Aromatic |
CH2 | H1 | sing | 1.08Å | 1.08Å | |
CZ3 | H8 | sing | 1.08Å | 1.08Å | |
CE3 | H3 | sing | 1.08Å | 1.08Å | |
NE1 | H4 | sing | 0.97Å | 1.00Å | |
CD1 | H5 | sing | 1.08Å | 1.08Å | |
CB | H6 | sing | 1.09Å | 1.10Å | |
CB | H7 | sing | 1.09Å | 1.10Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
N | H | sing | 1.01Å | 1.00Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
C | OXT | sing | 1.34Å | 1.33Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O | C | CA | 121.8° | 120.0° |
O | C | OXT | 123.7° | 120.0° |
C | CA | N | 111.7° | 109.5° |
C | CA | CB | 110.7° | 109.5° |
C | CA | HA | 107.4° | 109.4° |
CA | C | OXT | 114.5° | 120.0° |
CD1 | NE1 | CE2 | 108.7° | 109.9° |
NE1 | CD1 | CG | 110.9° | 109.9° |
CD1 | NE1 | H4 | 125.6° | 125.1° |
NE1 | CD1 | H5 | 124.5° | 125.1° |
NE1 | CE2 | CZ2 | 132.1° | 133.5° |
NE1 | CE2 | CD2 | 109.4° | 107.1° |
CE2 | NE1 | H4 | 125.7° | 125.1° |
CD1 | CG | CB | 129.3° | 126.5° |
CD1 | CG | CD2 | 106.5° | 107.0° |
CG | CD1 | H5 | 124.6° | 125.0° |
F1 | CZ2 | CE2 | 116.5° | 120.2° |
F1 | CZ2 | CH2 | 122.2° | 120.1° |
CZ2 | CE2 | CD2 | 118.5° | 119.4° |
CE2 | CZ2 | CH2 | 121.3° | 119.7° |
CE2 | CD2 | CG | 104.5° | 106.1° |
CE2 | CD2 | CE3 | 120.6° | 119.9° |
N | CA | CB | 111.4° | 109.5° |
N | CA | HA | 108.2° | 109.5° |
CA | N | H | 109.5° | 110.9° |
CA | N | H2 | 109.5° | 111.0° |
CA | CB | CG | 115.9° | 109.5° |
CA | CB | H6 | 107.9° | 109.4° |
CA | CB | H7 | 107.8° | 109.5° |
CB | CA | HA | 107.3° | 109.5° |
CB | CG | CD2 | 124.2° | 126.5° |
CG | CB | H6 | 107.8° | 109.5° |
CG | CB | H7 | 107.9° | 109.5° |
CG | CD2 | CE3 | 134.9° | 134.0° |
CZ2 | CH2 | CZ3 | 118.9° | 120.7° |
CZ2 | CH2 | H1 | 120.6° | 119.7° |
CD2 | CE3 | CZ3 | 117.9° | 119.8° |
CD2 | CE3 | H3 | 121.0° | 120.1° |
CH2 | CZ3 | CE3 | 122.9° | 120.5° |
CZ3 | CH2 | H1 | 120.6° | 119.6° |
CH2 | CZ3 | H8 | 118.5° | 119.8° |
CE3 | CZ3 | H8 | 118.6° | 119.7° |
CZ3 | CE3 | H3 | 121.1° | 120.1° |
H6 | CB | H7 | 109.5° | 109.4° |
H | N | H2 | 109.5° | 111.0° |
C | OXT | HXT | 109.5° | 117.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O | C | CA | OXT | 178.3° | 179.9° |
O | C | CA | N | 24.8° | 20.0° |
O | C | CA | CB | 99.9° | 100.0° |
O | C | CA | HA | 143.2° | 140.0° |
O | C | OXT | HXT | 0.0° | 0.0° |
C | CA | N | CB | 124.3° | 120.0° |
C | CA | N | HA | 118.0° | 120.0° |
C | CA | CB | HA | 116.9° | 119.9° |
C | CA | CB | CG | 59.8° | 175.0° |
C | CA | CB | H6 | 61.2° | 54.9° |
C | CA | CB | H7 | 179.3° | 65.0° |
C | CA | N | H | 180.0° | 60.0° |
C | CA | N | H2 | 60.0° | 176.1° |
CA | C | OXT | HXT | 178.3° | 180.0° |
CD1 | NE1 | CE2 | H4 | 180.0° | 179.5° |
NE1 | CD1 | CG | H5 | 180.0° | 179.4° |
CD1 | NE1 | CE2 | CZ2 | 179.1° | 179.9° |
CD1 | NE1 | CE2 | CD2 | 0.2° | 0.2° |
NE1 | CD1 | CG | CB | 178.1° | 180.0° |
NE1 | CD1 | CG | CD2 | 0.7° | 0.7° |
CE2 | NE1 | CD1 | CG | 0.5° | 0.6° |
NE1 | CE2 | CZ2 | F1 | 1.3° | 0.1° |
NE1 | CE2 | CZ2 | CD2 | 179.2° | 179.8° |
NE1 | CE2 | CD2 | CG | 0.2° | 0.2° |
NE1 | CE2 | CZ2 | CH2 | 179.6° | 179.7° |
NE1 | CE2 | CD2 | CE3 | 179.4° | 179.6° |
CE2 | NE1 | CD1 | H5 | 179.5° | 180.0° |
CD1 | CG | CD2 | CE2 | 0.6° | 0.5° |
CD1 | CG | CB | CA | 90.6° | 95.0° |
CD1 | CG | CB | CD2 | 178.6° | 179.2° |
CD1 | CG | CD2 | CE3 | 179.6° | 179.2° |
CG | CD1 | NE1 | H4 | 179.4° | 179.9° |
CD1 | CG | CB | H6 | 30.4° | 25.0° |
CD1 | CG | CB | H7 | 148.5° | 145.0° |
F1 | CZ2 | CE2 | CH2 | 178.3° | 179.8° |
F1 | CZ2 | CE2 | CD2 | 179.4° | 179.7° |
F1 | CZ2 | CH2 | CZ3 | 178.7° | 180.0° |
F1 | CZ2 | CH2 | H1 | 1.3° | 0.0° |
CZ2 | CE2 | CD2 | CG | 179.6° | 179.7° |
CZ2 | CE2 | CD2 | CE3 | 1.2° | 0.5° |
CE2 | CZ2 | CH2 | CZ3 | 0.5° | 0.2° |
CE2 | CZ2 | CH2 | H1 | 179.5° | 179.8° |
CZ2 | CE2 | NE1 | H4 | 0.9° | 0.5° |
CE2 | CD2 | CG | CB | 178.3° | 179.9° |
CE2 | CD2 | CG | CE3 | 179.0° | 179.8° |
CD2 | CE2 | CZ2 | CH2 | 1.1° | 0.5° |
CE2 | CD2 | CE3 | CZ3 | 0.6° | 0.3° |
CE2 | CD2 | CE3 | H3 | 179.4° | 179.8° |
CD2 | CE2 | NE1 | H4 | 179.8° | 179.7° |
N | CA | CB | HA | 118.2° | 120.0° |
N | CA | CB | CG | 65.1° | 65.0° |
N | CA | CB | H6 | 174.0° | 175.0° |
N | CA | CB | H7 | 55.8° | 55.1° |
CA | N | H | H2 | 120.0° | 123.9° |
N | CA | C | OXT | 156.9° | 160.0° |
CA | CB | CG | H6 | 120.9° | 120.0° |
CA | CB | CG | H7 | 120.9° | 120.0° |
CA | CB | CG | CD2 | 90.9° | 84.2° |
CA | CB | H6 | H7 | 117.1° | 119.9° |
CB | CA | N | H | 55.7° | 60.0° |
CB | CA | N | H2 | 175.7° | 63.9° |
CB | CA | C | OXT | 78.4° | 80.0° |
CB | CG | CD2 | CE3 | 0.7° | 0.1° |
CB | CG | CD1 | H5 | 1.9° | 0.6° |
CG | CB | H6 | H7 | 117.1° | 120.1° |
CG | CB | CA | HA | 176.7° | 55.0° |
CG | CD2 | CE3 | CZ3 | 179.5° | 180.0° |
CG | CD2 | CE3 | H3 | 0.5° | 0.1° |
CD2 | CG | CD1 | H5 | 179.3° | 179.9° |
CD2 | CG | CB | H6 | 148.2° | 155.8° |
CD2 | CG | CB | H7 | 30.1° | 35.8° |
CZ2 | CH2 | CZ3 | H1 | 180.0° | 180.0° |
CZ2 | CH2 | CZ3 | CE3 | 0.1° | 0.0° |
CZ2 | CH2 | CZ3 | H8 | 179.9° | 180.0° |
CD2 | CE3 | CZ3 | CH2 | 0.1° | 0.0° |
CD2 | CE3 | CZ3 | H3 | 180.0° | 179.9° |
CD2 | CE3 | CZ3 | H8 | 179.9° | 180.0° |
CH2 | CZ3 | CE3 | H8 | 180.0° | 180.0° |
CH2 | CZ3 | CE3 | H3 | 179.9° | 179.9° |
CE3 | CZ3 | CH2 | H1 | 179.8° | 180.0° |
H1 | CH2 | CZ3 | H8 | 0.1° | 0.0° |
H8 | CZ3 | CE3 | H3 | 0.1° | 0.1° |
H4 | NE1 | CD1 | H5 | 0.6° | 0.5° |
H6 | CB | CA | HA | 55.8° | 65.0° |
H7 | CB | CA | HA | 62.4° | 175.1° |
HA | CA | N | H | 62.0° | 180.0° |
HA | CA | N | H2 | 58.0° | 56.1° |
HA | CA | C | OXT | 38.5° | 39.9° |