GSC
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N | CA | sing | 1.47Å | 1.45Å | |
N | H | sing | 1.01Å | 1.02Å | |
N | H2 | sing | 1.01Å | 1.02Å | |
CA | C | sing | 1.51Å | 1.53Å | |
CA | S | sing | 1.81Å | 1.80Å | |
CA | HA | sing | 1.09Å | 1.12Å | |
C | O | doub | 1.21Å | 1.23Å | |
C | OXT | sing | 1.34Å | 1.33Å | |
S | C1 | sing | 1.81Å | 1.80Å | |
C1 | C2 | sing | 1.53Å | 1.54Å | |
C1 | H11 | sing | 1.09Å | 1.12Å | |
C1 | H12 | sing | 1.09Å | 1.12Å | |
C2 | H21 | sing | 1.09Å | 1.11Å | |
C2 | H22 | sing | 1.09Å | 1.11Å | |
C2 | H23 | sing | 1.09Å | 1.11Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CA | N | H | 107.9° | 106.8° |
CA | N | H2 | 112.8° | 106.7° |
N | CA | C | 107.9° | 109.5° |
N | CA | S | 111.8° | 109.5° |
N | CA | HA | 113.2° | 109.4° |
H | N | H2 | 112.8° | 106.7° |
C | CA | S | 119.3° | 109.5° |
C | CA | HA | 104.5° | 109.4° |
CA | C | O | 120.5° | 120.0° |
CA | C | OXT | 116.5° | 120.1° |
S | CA | HA | 99.9° | 109.4° |
CA | S | C1 | 101.0° | 100.0° |
O | C | OXT | 123.0° | 119.9° |
C | OXT | HXT | 116.5° | 120.1° |
S | C1 | C2 | 111.2° | 109.5° |
S | C1 | H11 | 111.6° | 109.5° |
S | C1 | H12 | 111.5° | 109.4° |
C2 | C1 | H11 | 111.6° | 109.5° |
C2 | C1 | H12 | 111.6° | 109.5° |
C1 | C2 | H21 | 111.2° | 109.6° |
C1 | C2 | H22 | 111.5° | 109.5° |
C1 | C2 | H23 | 111.5° | 109.5° |
H11 | C1 | H12 | 98.7° | 109.4° |
H21 | C2 | H22 | 111.5° | 109.5° |
H21 | C2 | H23 | 111.6° | 109.4° |
H22 | C2 | H23 | 98.9° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CA | N | H | H2 | 125.3° | 113.8° |
N | CA | C | S | 128.9° | 120.1° |
N | CA | C | HA | 120.7° | 119.9° |
N | CA | S | HA | 120.0° | 119.9° |
N | CA | C | O | 82.7° | 120.1° |
N | CA | C | OXT | 96.0° | 60.0° |
N | CA | S | C1 | 164.7° | 59.9° |
H | N | CA | C | 180.0° | 173.8° |
H | N | CA | S | 47.0° | 53.8° |
H | N | CA | HA | 64.8° | 66.2° |
H2 | N | CA | C | 54.8° | 60.0° |
H2 | N | CA | S | 78.2° | 60.1° |
H2 | N | CA | HA | 169.9° | 180.0° |
C | CA | S | HA | 112.9° | 120.0° |
CA | C | O | OXT | 178.6° | 180.0° |
C | CA | S | C1 | 68.2° | 180.0° |
CA | C | OXT | HXT | 180.0° | 180.0° |
S | CA | C | O | 46.2° | 0.0° |
S | CA | C | OXT | 135.1° | 180.0° |
CA | S | C1 | C2 | 130.1° | 180.0° |
CA | S | C1 | H11 | 4.8° | 59.9° |
CA | S | C1 | H12 | 104.6° | 60.0° |
HA | CA | C | O | 156.6° | 120.0° |
HA | CA | C | OXT | 24.8° | 60.0° |
HA | CA | S | C1 | 44.7° | 60.0° |
O | C | OXT | HXT | 1.4° | 0.1° |
S | C1 | C2 | H11 | 125.3° | 120.1° |
S | C1 | C2 | H12 | 125.3° | 120.0° |
S | C1 | H11 | H12 | 117.4° | 119.9° |
S | C1 | C2 | H21 | 180.0° | 179.9° |
S | C1 | C2 | H22 | 54.8° | 60.0° |
S | C1 | C2 | H23 | 54.7° | 60.0° |
C2 | C1 | H11 | H12 | 117.5° | 120.0° |
C1 | C2 | H21 | H22 | 125.2° | 120.1° |
C1 | C2 | H21 | H23 | 125.3° | 120.0° |
C1 | C2 | H22 | H23 | 117.5° | 120.0° |
H11 | C1 | C2 | H21 | 54.7° | 60.0° |
H11 | C1 | C2 | H22 | 179.9° | 60.1° |
H11 | C1 | C2 | H23 | 70.6° | 180.0° |
H12 | C1 | C2 | H21 | 54.7° | 59.9° |
H12 | C1 | C2 | H22 | 70.5° | 180.0° |
H12 | C1 | C2 | H23 | 180.0° | 60.0° |
H21 | C2 | H22 | H23 | 117.5° | 119.9° |