EO2
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CE | CG | doub | 1.31Å | 1.33Å | |
CG | CD | sing | 1.51Å | 1.49Å | |
CG | CB | sing | 1.51Å | 1.47Å | |
CB | CA | sing | 1.53Å | 1.50Å | |
N | CA | sing | 1.47Å | 1.46Å | |
CA | C | sing | 1.51Å | 1.53Å | |
C | O | doub | 1.21Å | 1.25Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
N | H | sing | 1.01Å | 1.00Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
CB | H6 | sing | 1.09Å | 1.10Å | |
CB | H7 | sing | 1.09Å | 1.10Å | |
CD | H8 | sing | 1.09Å | 1.10Å | |
CD | H9 | sing | 1.09Å | 1.10Å | |
CD | H10 | sing | 1.09Å | 1.10Å | |
CE | H11 | sing | 1.08Å | 1.08Å | |
CE | H12 | sing | 1.08Å | 1.08Å | |
C | OXT | sing | 1.34Å | 1.43Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CE | CG | CD | 116.3° | 120.0° |
CE | CG | CB | 121.7° | 120.0° |
CG | CE | H11 | 120.0° | 120.0° |
CG | CE | H12 | 120.0° | 120.0° |
CD | CG | CB | 122.0° | 120.0° |
CG | CD | H8 | 109.5° | 109.5° |
CG | CD | H9 | 109.5° | 109.5° |
CG | CD | H10 | 109.5° | 109.5° |
CG | CB | CA | 114.2° | 109.4° |
CG | CB | H6 | 108.3° | 109.5° |
CG | CB | H7 | 108.3° | 109.4° |
CB | CA | N | 111.2° | 109.5° |
CB | CA | C | 111.5° | 109.4° |
CB | CA | HA | 108.6° | 109.5° |
CA | CB | H6 | 108.3° | 109.5° |
CA | CB | H7 | 108.3° | 109.5° |
N | CA | C | 108.3° | 109.4° |
CA | N | H2 | 109.5° | 111.0° |
CA | N | H | 109.5° | 111.0° |
N | CA | HA | 109.1° | 109.5° |
CA | C | O | 121.8° | 120.0° |
C | CA | HA | 108.2° | 109.4° |
CA | C | OXT | 118.9° | 120.0° |
O | C | OXT | 119.2° | 120.0° |
H2 | N | H | 109.4° | 111.0° |
H6 | CB | H7 | 109.4° | 109.5° |
H8 | CD | H9 | 109.4° | 109.5° |
H8 | CD | H10 | 109.5° | 109.5° |
H9 | CD | H10 | 109.5° | 109.4° |
H11 | CE | H12 | 120.0° | 120.0° |
C | OXT | HXT | 109.5° | 117.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CE | CG | CD | CB | 176.7° | 180.0° |
CE | CG | CB | CA | 133.1° | 95.0° |
CE | CG | CB | H6 | 106.2° | 25.0° |
CE | CG | CB | H7 | 12.4° | 145.0° |
CE | CG | CD | H8 | 180.0° | 90.0° |
CE | CG | CD | H9 | 60.0° | 30.1° |
CE | CG | CD | H10 | 60.0° | 150.0° |
CG | CE | H11 | H12 | 180.0° | 180.0° |
CD | CG | CB | CA | 50.4° | 85.0° |
CD | CG | CB | H6 | 70.3° | 155.0° |
CD | CG | CB | H7 | 171.1° | 35.0° |
CG | CD | H8 | H9 | 120.0° | 120.0° |
CG | CD | H8 | H10 | 120.0° | 120.0° |
CG | CD | H9 | H10 | 120.0° | 120.0° |
CD | CG | CE | H11 | 176.7° | 0.0° |
CD | CG | CE | H12 | 3.3° | 180.0° |
CG | CB | CA | H6 | 120.7° | 120.0° |
CG | CB | CA | H7 | 120.7° | 119.9° |
CG | CB | CA | N | 77.1° | 65.1° |
CG | CB | CA | C | 162.0° | 175.0° |
CG | CB | CA | HA | 42.9° | 55.0° |
CG | CB | H6 | H7 | 117.8° | 120.0° |
CB | CG | CD | H8 | 3.3° | 90.0° |
CB | CG | CD | H9 | 123.3° | 150.0° |
CB | CG | CD | H10 | 116.7° | 30.0° |
CB | CG | CE | H11 | 0.0° | 180.0° |
CB | CG | CE | H12 | 180.0° | 0.0° |
CB | CA | N | C | 122.8° | 119.9° |
CB | CA | N | HA | 119.7° | 120.1° |
CB | CA | C | HA | 119.3° | 120.0° |
CB | CA | C | O | 95.5° | 100.0° |
CB | CA | N | H2 | 180.0° | 59.9° |
CB | CA | N | H | 60.0° | 64.0° |
CA | CB | H6 | H7 | 117.8° | 120.1° |
CB | CA | C | OXT | 87.4° | 79.7° |
N | CA | C | HA | 118.1° | 120.0° |
N | CA | C | O | 142.0° | 20.0° |
CA | N | H2 | H | 120.0° | 123.9° |
N | CA | CB | H6 | 162.2° | 54.9° |
N | CA | CB | H7 | 43.6° | 175.0° |
N | CA | C | OXT | 35.2° | 160.3° |
CA | C | O | OXT | 177.1° | 179.7° |
C | CA | N | H2 | 57.2° | 60.0° |
C | CA | N | H | 62.7° | 176.0° |
C | CA | CB | H6 | 41.3° | 65.1° |
C | CA | CB | H7 | 77.3° | 55.0° |
CA | C | OXT | HXT | 177.2° | 179.7° |
O | C | CA | HA | 23.9° | 140.0° |
O | C | OXT | HXT | 0.0° | 0.0° |
H2 | N | CA | HA | 60.3° | 180.0° |
H | N | CA | HA | 179.8° | 56.0° |
HA | CA | CB | H6 | 77.8° | 175.0° |
HA | CA | CB | H7 | 163.6° | 64.9° |
HA | CA | C | OXT | 153.3° | 40.2° |
H8 | CD | H9 | H10 | 120.0° | 120.0° |