EFC
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N | CA | sing | 1.47Å | 1.47Å | |
N | H | sing | 1.01Å | 0.99Å | |
N | H2 | sing | 1.01Å | 1.02Å | |
CA | CB | sing | 1.53Å | 1.54Å | |
CA | C | sing | 1.51Å | 1.51Å | |
CA | HA | sing | 1.09Å | 1.12Å | |
CB | SG | sing | 1.81Å | 1.83Å | |
CB | HB2 | sing | 1.09Å | 1.11Å | |
CB | HB3 | sing | 1.09Å | 1.12Å | |
SG | SD | sing | 2.05Å | 2.04Å | |
SD | C1 | sing | 1.81Å | 1.82Å | |
C1 | C2 | sing | 1.53Å | 1.49Å | |
C1 | H11 | sing | 1.09Å | 1.12Å | |
C1 | H12 | sing | 1.09Å | 1.12Å | |
C2 | F2 | sing | 1.40Å | 1.33Å | |
C2 | H21 | sing | 1.09Å | 1.12Å | |
C2 | H22 | sing | 1.09Å | 1.12Å | |
C | O | doub | 1.21Å | 1.23Å | |
C | OXT | sing | 1.34Å | 1.32Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CA | N | H | 117.6° | 106.7° |
CA | N | H2 | 111.8° | 106.8° |
N | CA | CB | 110.6° | 109.5° |
N | CA | C | 108.8° | 109.4° |
N | CA | HA | 108.8° | 109.5° |
H | N | H2 | 122.3° | 106.7° |
CB | CA | C | 108.4° | 109.5° |
CB | CA | HA | 109.2° | 109.4° |
CA | CB | SG | 114.1° | 109.5° |
CA | CB | HB2 | 110.5° | 109.5° |
CA | CB | HB3 | 110.5° | 109.5° |
C | CA | HA | 111.0° | 109.5° |
CA | C | O | 120.8° | 120.0° |
CA | C | OXT | 116.6° | 120.0° |
SG | CB | HB2 | 110.5° | 109.5° |
SG | CB | HB3 | 110.5° | 109.5° |
CB | SG | SD | 105.3° | 100.0° |
HB2 | CB | HB3 | 99.7° | 109.5° |
SG | SD | C1 | 105.3° | 100.0° |
SD | C1 | C2 | 114.1° | 109.5° |
SD | C1 | H11 | 110.5° | 109.4° |
SD | C1 | H12 | 110.5° | 109.4° |
C2 | C1 | H11 | 110.5° | 109.5° |
C2 | C1 | H12 | 110.5° | 109.5° |
C1 | C2 | F2 | 105.3° | 109.5° |
C1 | C2 | H21 | 113.8° | 109.5° |
C1 | C2 | H22 | 113.8° | 109.5° |
H11 | C1 | H12 | 99.7° | 109.5° |
F2 | C2 | H21 | 113.8° | 109.5° |
F2 | C2 | H22 | 113.8° | 109.4° |
H21 | C2 | H22 | 96.6° | 109.4° |
O | C | OXT | 122.6° | 120.0° |
C | OXT | HXT | 116.6° | 120.1° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CA | N | H | H2 | 145.9° | 113.9° |
N | CA | CB | C | 119.2° | 120.0° |
N | CA | CB | HA | 119.7° | 120.0° |
N | CA | C | HA | 119.7° | 120.0° |
N | CA | CB | SG | 54.3° | 178.8° |
N | CA | CB | HB2 | 179.6° | 61.2° |
N | CA | CB | HB3 | 71.0° | 58.8° |
N | CA | C | O | 14.1° | 30.0° |
N | CA | C | OXT | 166.9° | 150.1° |
H | N | CA | CB | 94.5° | 59.4° |
H | N | CA | C | 24.4° | 179.5° |
H | N | CA | HA | 145.5° | 60.6° |
H2 | N | CA | CB | 54.7° | 54.4° |
H2 | N | CA | C | 173.7° | 65.6° |
H2 | N | CA | HA | 65.3° | 174.4° |
CB | CA | C | HA | 120.0° | 120.0° |
CA | CB | SG | HB2 | 125.3° | 120.0° |
CA | CB | SG | HB3 | 125.3° | 120.0° |
CA | CB | HB2 | HB3 | 116.4° | 120.0° |
CA | CB | SG | SD | 167.5° | 75.1° |
CB | CA | C | O | 106.2° | 90.0° |
CB | CA | C | OXT | 72.8° | 89.9° |
C | CA | CB | SG | 65.0° | 58.8° |
C | CA | CB | HB2 | 60.3° | 178.8° |
C | CA | CB | HB3 | 169.8° | 61.2° |
CA | C | O | OXT | 179.0° | 179.9° |
CA | C | OXT | HXT | 180.0° | 180.0° |
HA | CA | CB | SG | 174.0° | 61.2° |
HA | CA | CB | HB2 | 60.7° | 58.8° |
HA | CA | CB | HB3 | 48.7° | 178.8° |
HA | CA | C | O | 133.8° | 150.0° |
HA | CA | C | OXT | 47.2° | 30.1° |
SG | CB | HB2 | HB3 | 116.3° | 120.0° |
CB | SG | SD | C1 | 83.9° | 90.0° |
HB2 | CB | SG | SD | 67.2° | 45.0° |
HB3 | CB | SG | SD | 42.2° | 165.0° |
SG | SD | C1 | C2 | 50.1° | 60.0° |
SG | SD | C1 | H11 | 175.4° | 180.0° |
SG | SD | C1 | H12 | 75.2° | 60.0° |
SD | C1 | C2 | H11 | 125.3° | 120.0° |
SD | C1 | C2 | H12 | 125.3° | 119.9° |
SD | C1 | H11 | H12 | 116.4° | 119.9° |
SD | C1 | C2 | F2 | 51.8° | 180.0° |
SD | C1 | C2 | H21 | 73.5° | 60.0° |
SD | C1 | C2 | H22 | 177.1° | 60.0° |
C2 | C1 | H11 | H12 | 116.3° | 120.0° |
C1 | C2 | F2 | H21 | 125.3° | 120.1° |
C1 | C2 | F2 | H22 | 125.2° | 120.0° |
C1 | C2 | H21 | H22 | 119.7° | 120.0° |
H11 | C1 | C2 | F2 | 177.1° | 60.0° |
H11 | C1 | C2 | H21 | 51.8° | 180.0° |
H11 | C1 | C2 | H22 | 57.6° | 60.0° |
H12 | C1 | C2 | F2 | 73.4° | 60.1° |
H12 | C1 | C2 | H21 | 161.2° | 60.0° |
H12 | C1 | C2 | H22 | 51.8° | 180.0° |
F2 | C2 | H21 | H22 | 119.7° | 120.0° |
O | C | OXT | HXT | 1.0° | 0.1° |