66E
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CG2 | CB | sing | 1.53Å | 1.52Å | |
C2 | C1 | sing | 1.53Å | 1.55Å | |
CB | CG1 | sing | 1.53Å | 1.52Å | |
CB | CA | sing | 1.53Å | 1.57Å | |
C1 | N | sing | 1.47Å | 1.52Å | |
CA | N | sing | 1.47Å | 1.45Å | |
CA | C | sing | 1.51Å | 1.50Å | |
O | C | doub | 1.21Å | 1.23Å | |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C1 | H3 | sing | 1.09Å | 1.10Å | |
N | H | sing | 1.01Å | 1.00Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
CB | H6 | sing | 1.09Å | 1.10Å | |
CG1 | H7 | sing | 1.09Å | 1.10Å | |
CG1 | H8 | sing | 1.09Å | 1.10Å | |
CG1 | H9 | sing | 1.09Å | 1.10Å | |
CG2 | H10 | sing | 1.09Å | 1.10Å | |
CG2 | H11 | sing | 1.09Å | 1.10Å | |
CG2 | H12 | sing | 1.09Å | 1.10Å | |
C2 | H14 | sing | 1.09Å | 1.10Å | |
C2 | H15 | sing | 1.09Å | 1.10Å | |
C2 | H16 | sing | 1.09Å | 1.10Å | |
C | OXT | sing | 1.34Å | 1.34Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CG2 | CB | CG1 | 110.2° | 109.5° |
CG2 | CB | CA | 109.4° | 109.4° |
CG2 | CB | H6 | 108.9° | 109.5° |
CB | CG2 | H10 | 109.5° | 109.5° |
CB | CG2 | H11 | 109.5° | 109.5° |
CB | CG2 | H12 | 109.5° | 109.5° |
C2 | C1 | N | 112.2° | 109.5° |
C2 | C1 | H1 | 108.8° | 109.4° |
C2 | C1 | H3 | 108.8° | 109.4° |
C1 | C2 | H14 | 109.5° | 109.5° |
C1 | C2 | H15 | 109.4° | 109.5° |
C1 | C2 | H16 | 109.5° | 109.5° |
CG1 | CB | CA | 111.4° | 109.5° |
CG1 | CB | H6 | 108.8° | 109.5° |
CB | CG1 | H7 | 109.5° | 109.5° |
CB | CG1 | H8 | 109.5° | 109.4° |
CB | CG1 | H9 | 109.5° | 109.5° |
CB | CA | N | 111.1° | 109.4° |
CB | CA | C | 111.6° | 109.4° |
CB | CA | HA | 106.9° | 109.5° |
CA | CB | H6 | 108.2° | 109.5° |
C1 | N | CA | 117.1° | 110.9° |
N | C1 | H1 | 108.8° | 109.5° |
N | C1 | H3 | 108.8° | 109.5° |
C1 | N | H | 107.5° | 111.0° |
N | CA | C | 110.9° | 109.5° |
CA | N | H | 107.5° | 111.1° |
N | CA | HA | 108.4° | 109.5° |
CA | C | O | 121.7° | 120.0° |
C | CA | HA | 107.7° | 109.5° |
CA | C | OXT | 116.4° | 120.0° |
O | C | OXT | 121.9° | 120.0° |
H1 | C1 | H3 | 109.4° | 109.5° |
H7 | CG1 | H8 | 109.5° | 109.4° |
H7 | CG1 | H9 | 109.4° | 109.5° |
H8 | CG1 | H9 | 109.5° | 109.5° |
H10 | CG2 | H11 | 109.5° | 109.5° |
H10 | CG2 | H12 | 109.5° | 109.5° |
H11 | CG2 | H12 | 109.4° | 109.4° |
H14 | C2 | H15 | 109.5° | 109.4° |
H14 | C2 | H16 | 109.5° | 109.5° |
H15 | C2 | H16 | 109.4° | 109.4° |
C | OXT | HXT | 109.5° | 117.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CG2 | CB | CG1 | CA | 121.5° | 120.0° |
CG2 | CB | CG1 | H6 | 119.3° | 120.0° |
CG2 | CB | CA | H6 | 118.5° | 120.0° |
CG2 | CB | CA | N | 61.8° | 56.9° |
CG2 | CB | CA | C | 173.8° | 176.9° |
CG2 | CB | CA | HA | 56.2° | 63.2° |
CG2 | CB | CG1 | H7 | 180.0° | 60.0° |
CG2 | CB | CG1 | H8 | 60.0° | 60.0° |
CG2 | CB | CG1 | H9 | 60.0° | 180.0° |
CB | CG2 | H10 | H11 | 120.0° | 120.0° |
CB | CG2 | H10 | H12 | 120.0° | 120.0° |
CB | CG2 | H11 | H12 | 120.0° | 120.0° |
C2 | C1 | N | H1 | 120.4° | 119.9° |
C2 | C1 | N | H3 | 120.4° | 120.0° |
C2 | C1 | N | CA | 106.7° | 174.8° |
C2 | C1 | H1 | H3 | 118.7° | 120.0° |
C2 | C1 | N | H | 132.3° | 61.2° |
C1 | C2 | H14 | H15 | 120.0° | 120.1° |
C1 | C2 | H14 | H16 | 120.0° | 120.0° |
C1 | C2 | H15 | H16 | 120.0° | 120.0° |
CG1 | CB | CA | H6 | 119.5° | 120.0° |
CG1 | CB | CA | N | 176.2° | 176.9° |
CG1 | CB | CA | C | 51.8° | 63.2° |
CG1 | CB | CA | HA | 65.7° | 56.8° |
CB | CG1 | H7 | H8 | 120.0° | 120.0° |
CB | CG1 | H7 | H9 | 120.0° | 120.0° |
CB | CG1 | H8 | H9 | 120.0° | 120.0° |
CG1 | CB | CG2 | H10 | 180.0° | 67.4° |
CG1 | CB | CG2 | H11 | 60.0° | 172.6° |
CG1 | CB | CG2 | H12 | 60.0° | 52.6° |
CB | CA | N | C1 | 60.6° | 152.7° |
CB | CA | N | C | 124.8° | 119.9° |
CB | CA | N | HA | 117.1° | 120.0° |
CB | CA | C | HA | 117.0° | 120.0° |
CB | CA | C | O | 51.1° | 120.1° |
CB | CA | N | H | 178.3° | 28.7° |
CA | CB | CG1 | H7 | 58.5° | 60.0° |
CA | CB | CG1 | H8 | 61.5° | 179.9° |
CA | CB | CG1 | H9 | 178.5° | 60.0° |
CA | CB | CG2 | H10 | 57.3° | 52.5° |
CA | CB | CG2 | H11 | 177.3° | 67.5° |
CA | CB | CG2 | H12 | 62.7° | 172.6° |
CB | CA | C | OXT | 128.2° | 60.0° |
C1 | N | CA | H | 121.1° | 123.9° |
C1 | N | CA | C | 64.2° | 87.4° |
N | C1 | H1 | H3 | 118.8° | 120.1° |
C1 | N | CA | HA | 177.8° | 32.7° |
N | C1 | C2 | H14 | 180.0° | 60.0° |
N | C1 | C2 | H15 | 60.0° | 180.0° |
N | C1 | C2 | H16 | 60.0° | 60.0° |
N | CA | C | HA | 118.4° | 120.1° |
N | CA | C | O | 73.4° | 0.1° |
CA | N | C1 | H1 | 13.8° | 65.3° |
CA | N | C1 | H3 | 132.9° | 54.8° |
N | CA | CB | H6 | 56.7° | 63.1° |
N | CA | C | OXT | 107.3° | 180.0° |
CA | C | O | OXT | 179.3° | 179.9° |
C | CA | N | H | 56.9° | 148.6° |
C | CA | CB | H6 | 67.7° | 56.9° |
CA | C | OXT | HXT | 179.3° | 179.9° |
O | C | CA | HA | 168.2° | 120.0° |
O | C | OXT | HXT | 0.0° | 0.0° |
H1 | C1 | N | H | 107.3° | 58.7° |
H1 | C1 | C2 | H14 | 59.6° | 60.0° |
H1 | C1 | C2 | H15 | 60.5° | 60.0° |
H1 | C1 | C2 | H16 | 179.6° | 180.0° |
H3 | C1 | N | H | 11.9° | 178.8° |
H3 | C1 | C2 | H14 | 59.6° | 180.0° |
H3 | C1 | C2 | H15 | 179.6° | 60.0° |
H3 | C1 | C2 | H16 | 60.5° | 60.0° |
H | N | CA | HA | 61.1° | 91.3° |
HA | CA | CB | H6 | 174.7° | 176.9° |
HA | CA | C | OXT | 11.1° | 59.9° |
H6 | CB | CG1 | H7 | 60.7° | 179.9° |
H6 | CB | CG1 | H8 | 179.3° | 60.0° |
H6 | CB | CG1 | H9 | 59.3° | 60.0° |
H6 | CB | CG2 | H10 | 60.8° | 172.6° |
H6 | CB | CG2 | H11 | 59.2° | 52.6° |
H6 | CB | CG2 | H12 | 179.2° | 67.4° |
H7 | CG1 | H8 | H9 | 119.9° | 120.1° |
H10 | CG2 | H11 | H12 | 120.0° | 120.0° |
H14 | C2 | H15 | H16 | 120.0° | 119.9° |