ZNY
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CD | N | sing | 1.49Å | 1.45Å | |
CD | CG | sing | 1.55Å | 1.53Å | |
C50 | C49 | sing | 1.53Å | 1.55Å | |
O48 | CG | sing | 1.43Å | 1.40Å | |
O48 | C49 | sing | 1.43Å | 1.42Å | |
N | CA | sing | 1.48Å | 1.45Å | |
CG | CB | sing | 1.55Å | 1.56Å | |
CA | CB | sing | 1.54Å | 1.55Å | |
CA | C | sing | 1.51Å | 1.48Å | |
O | C | doub | 1.21Å | 1.18Å | |
C | OXT | sing | 1.34Å | 1.35Å | |
CB | H1 | sing | 1.09Å | 1.10Å | |
CB | H5 | sing | 1.09Å | 1.10Å | |
CD | H3 | sing | 1.09Å | 1.10Å | |
CD | H4 | sing | 1.09Å | 1.10Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
CG | H6 | sing | 1.09Å | 1.10Å | |
N | H | sing | 1.01Å | 1.00Å | |
C49 | H9 | sing | 1.09Å | 1.10Å | |
C49 | H10 | sing | 1.09Å | 1.10Å | |
C50 | H11 | sing | 1.09Å | 1.10Å | |
C50 | H12 | sing | 1.09Å | 1.10Å | |
C50 | H13 | sing | 1.09Å | 1.10Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N | CD | CG | 101.0° | 103.2° |
CD | N | CA | 114.7° | 105.8° |
N | CD | H3 | 111.6° | 110.6° |
N | CD | H4 | 111.5° | 110.7° |
CD | N | H | 108.2° | 111.0° |
CD | CG | O48 | 110.4° | 110.7° |
CD | CG | CB | 99.8° | 102.9° |
CG | CD | H3 | 111.5° | 110.7° |
CG | CD | H4 | 111.5° | 110.6° |
CD | CG | H6 | 111.8° | 110.7° |
C50 | C49 | O48 | 107.3° | 109.5° |
C50 | C49 | H9 | 110.0° | 109.5° |
C50 | C49 | H10 | 110.0° | 109.5° |
C49 | C50 | H11 | 109.5° | 109.5° |
C49 | C50 | H12 | 109.5° | 109.4° |
C49 | C50 | H13 | 109.5° | 109.4° |
CG | O48 | C49 | 116.5° | 114.0° |
O48 | CG | CB | 108.6° | 110.8° |
O48 | CG | H6 | 114.0° | 110.8° |
O48 | C49 | H9 | 110.0° | 109.5° |
O48 | C49 | H10 | 110.0° | 109.4° |
N | CA | CB | 101.1° | 107.1° |
N | CA | C | 118.1° | 109.9° |
N | CA | HA | 107.7° | 110.0° |
CA | N | H | 108.2° | 110.9° |
CG | CB | CA | 104.8° | 105.2° |
CG | CB | H1 | 110.6° | 110.3° |
CG | CB | H5 | 110.6° | 110.3° |
CB | CG | H6 | 111.3° | 110.7° |
CB | CA | C | 115.3° | 109.9° |
CA | CB | H1 | 110.6° | 110.3° |
CA | CB | H5 | 110.6° | 110.3° |
CB | CA | HA | 106.5° | 110.0° |
CA | C | O | 119.5° | 120.0° |
CA | C | OXT | 111.5° | 120.0° |
C | CA | HA | 107.3° | 109.9° |
O | C | OXT | 129.0° | 120.0° |
C | OXT | HXT | 109.5° | 117.0° |
H1 | CB | H5 | 109.5° | 110.3° |
H3 | CD | H4 | 109.4° | 110.7° |
H9 | C49 | H10 | 109.5° | 109.5° |
H11 | C50 | H12 | 109.5° | 109.5° |
H11 | C50 | H13 | 109.5° | 109.5° |
H12 | C50 | H13 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N | CD | CG | H3 | 118.7° | 118.4° |
N | CD | CG | H4 | 118.6° | 118.5° |
N | CD | CG | O48 | 73.6° | 155.8° |
CD | N | CA | H | 120.8° | 120.5° |
N | CD | CG | CB | 40.6° | 37.4° |
CD | N | CA | CB | 4.7° | 25.3° |
CD | N | CA | C | 122.2° | 144.7° |
N | CD | H3 | H4 | 123.9° | 123.1° |
CD | N | CA | HA | 116.2° | 94.2° |
N | CD | CG | H6 | 158.4° | 80.9° |
CD | CG | O48 | CB | 108.4° | 113.5° |
CD | CG | O48 | H6 | 126.8° | 123.2° |
CD | CG | O48 | C49 | 174.9° | 91.5° |
CG | CD | N | CA | 30.0° | 39.2° |
CD | CG | CB | H6 | 118.2° | 118.3° |
CD | CG | CB | CA | 39.7° | 21.9° |
CD | CG | CB | H1 | 158.9° | 140.9° |
CD | CG | CB | H5 | 79.6° | 97.0° |
CG | CD | H3 | H4 | 123.9° | 123.1° |
CG | CD | N | H | 150.8° | 81.2° |
C50 | C49 | O48 | CG | 176.9° | 179.9° |
C50 | C49 | O48 | H9 | 119.6° | 120.1° |
C50 | C49 | O48 | H10 | 119.6° | 120.0° |
C50 | C49 | H9 | H10 | 121.0° | 120.0° |
C49 | C50 | H11 | H12 | 120.0° | 120.0° |
C49 | C50 | H11 | H13 | 120.0° | 120.0° |
C49 | C50 | H12 | H13 | 120.0° | 119.9° |
O48 | CG | CB | H6 | 126.3° | 123.3° |
O48 | CG | CB | CA | 75.9° | 140.3° |
O48 | CG | CB | H1 | 43.4° | 100.8° |
O48 | CG | CB | H5 | 164.9° | 21.4° |
O48 | CG | CD | H3 | 45.1° | 85.8° |
O48 | CG | CD | H4 | 167.8° | 37.3° |
CG | O48 | C49 | H9 | 57.3° | 60.0° |
CG | O48 | C49 | H10 | 63.4° | 60.0° |
C49 | O48 | CG | CB | 76.6° | 155.0° |
C49 | O48 | CG | H6 | 48.1° | 31.8° |
O48 | C49 | H9 | H10 | 121.0° | 119.9° |
O48 | C49 | C50 | H11 | 180.0° | 59.9° |
O48 | C49 | C50 | H12 | 60.0° | 60.0° |
O48 | C49 | C50 | H13 | 60.0° | 180.0° |
N | CA | CB | CG | 22.3° | 1.2° |
N | CA | CB | C | 128.7° | 119.4° |
N | CA | CB | HA | 112.4° | 119.5° |
N | CA | C | HA | 121.8° | 121.2° |
N | CA | C | O | 30.1° | 17.6° |
N | CA | C | OXT | 150.9° | 162.4° |
N | CA | CB | H1 | 141.6° | 117.8° |
N | CA | CB | H5 | 96.9° | 120.2° |
CA | N | CD | H3 | 148.6° | 157.6° |
CA | N | CD | H4 | 88.6° | 79.3° |
CG | CB | CA | H1 | 119.2° | 119.0° |
CG | CB | CA | H5 | 119.3° | 119.0° |
CG | CB | CA | C | 151.0° | 120.6° |
CG | CB | H1 | H5 | 122.1° | 122.1° |
CB | CG | CD | H3 | 159.3° | 155.8° |
CB | CG | CD | H4 | 78.0° | 81.1° |
CG | CB | CA | HA | 90.1° | 118.3° |
CB | CA | C | HA | 118.5° | 121.2° |
CB | CA | C | O | 89.6° | 100.0° |
CB | CA | C | OXT | 89.4° | 80.0° |
CA | CB | H1 | H5 | 122.2° | 122.0° |
CA | CB | CG | H6 | 157.9° | 96.4° |
CB | CA | N | H | 125.5° | 95.2° |
CA | C | O | OXT | 178.8° | 180.0° |
C | CA | CB | H1 | 89.8° | 1.6° |
C | CA | CB | H5 | 31.7° | 120.4° |
C | CA | N | H | 1.4° | 24.2° |
CA | C | OXT | HXT | 178.8° | 179.9° |
O | C | CA | HA | 151.9° | 138.8° |
O | C | OXT | HXT | 0.0° | 0.1° |
OXT | C | CA | HA | 29.1° | 41.1° |
H1 | CB | CA | HA | 29.2° | 122.7° |
H1 | CB | CG | H6 | 82.9° | 22.6° |
H5 | CB | CA | HA | 150.6° | 0.7° |
H5 | CB | CG | H6 | 38.6° | 144.7° |
H3 | CD | CG | H6 | 82.9° | 37.5° |
H3 | CD | N | H | 90.6° | 37.3° |
H4 | CD | CG | H6 | 39.8° | 160.6° |
H4 | CD | N | H | 32.1° | 160.4° |
HA | CA | N | H | 123.0° | 145.4° |
H9 | C49 | C50 | H11 | 60.3° | 180.0° |
H9 | C49 | C50 | H12 | 59.7° | 60.0° |
H9 | C49 | C50 | H13 | 179.7° | 60.0° |
H10 | C49 | C50 | H11 | 60.4° | 60.0° |
H10 | C49 | C50 | H12 | 179.6° | 180.0° |
H10 | C49 | C50 | H13 | 59.6° | 60.0° |
H11 | C50 | H12 | H13 | 120.0° | 120.1° |