ZAL
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | C2 | sing | 1.53Å | 1.53Å | |
C1 | C6 | sing | 1.53Å | 1.53Å | |
C1 | CB | sing | 1.53Å | 1.54Å | |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C2 | C3 | sing | 1.53Å | 1.52Å | |
C2 | H2B | sing | 1.09Å | 1.10Å | |
C2 | H2A | sing | 1.09Å | 1.10Å | |
C3 | C4 | sing | 1.53Å | 1.52Å | |
C3 | H3 | sing | 1.09Å | 1.10Å | |
C3 | H3A | sing | 1.09Å | 1.10Å | |
C4 | C5 | sing | 1.53Å | 1.53Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
C4 | H4A | sing | 1.09Å | 1.10Å | |
C5 | C6 | sing | 1.53Å | 1.53Å | |
C5 | H5 | sing | 1.09Å | 1.10Å | |
C5 | H5A | sing | 1.09Å | 1.10Å | |
C6 | H6 | sing | 1.09Å | 1.10Å | |
C6 | H6A | sing | 1.09Å | 1.10Å | |
N | CA | sing | 1.47Å | 1.50Å | |
N | H | sing | 1.01Å | 1.00Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
CA | CB | sing | 1.53Å | 1.54Å | |
CA | C | sing | 1.51Å | 1.55Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
CB | HB | sing | 1.09Å | 1.10Å | |
CB | HBA | sing | 1.09Å | 1.10Å | |
C | O | doub | 1.21Å | 1.23Å | |
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) |
C2 | C1 | C6 | 108.8° | 109.4° |
C2 | C1 | CB | 109.4° | 109.5° |
C2 | C1 | H1 | 110.6° | 109.4° |
C1 | C2 | C3 | 111.7° | 109.5° |
C1 | C2 | H2B | 108.7° | 109.5° |
C1 | C2 | H2A | 108.3° | 109.4° |
C6 | C1 | CB | 111.5° | 109.5° |
C6 | C1 | H1 | 108.6° | 109.5° |
C1 | C6 | C5 | 110.3° | 109.5° |
C1 | C6 | H6 | 109.2° | 109.5° |
C1 | C6 | H6A | 109.0° | 109.4° |
CB | C1 | H1 | 107.9° | 109.5° |
C1 | CB | CA | 110.3° | 109.5° |
C1 | CB | HB | 109.2° | 109.4° |
C1 | CB | HBA | 109.0° | 109.5° |
C3 | C2 | H2B | 108.7° | 109.5° |
C3 | C2 | H2A | 108.2° | 109.5° |
C2 | C3 | C4 | 110.9° | 109.5° |
C2 | C3 | H3 | 109.0° | 109.5° |
C2 | C3 | H3A | 108.7° | 109.5° |
H2B | C2 | H2A | 111.2° | 109.4° |
C4 | C3 | H3 | 109.0° | 109.5° |
C4 | C3 | H3A | 108.6° | 109.4° |
C3 | C4 | C5 | 111.4° | 109.4° |
C3 | C4 | H4 | 108.8° | 109.5° |
C3 | C4 | H4A | 108.4° | 109.5° |
H3 | C3 | H3A | 110.6° | 109.4° |
C5 | C4 | H4 | 108.9° | 109.5° |
C5 | C4 | H4A | 108.4° | 109.5° |
C4 | C5 | C6 | 111.2° | 109.5° |
C4 | C5 | H5 | 108.9° | 109.5° |
C4 | C5 | H5A | 108.5° | 109.4° |
H4 | C4 | H4A | 111.0° | 109.5° |
C6 | C5 | H5 | 108.9° | 109.5° |
C6 | C5 | H5A | 108.5° | 109.5° |
C5 | C6 | H6 | 109.2° | 109.5° |
C5 | C6 | H6A | 109.0° | 109.5° |
H5 | C5 | H5A | 110.8° | 109.5° |
H6 | C6 | H6A | 110.1° | 109.5° |
CA | N | H | 109.5° | 111.0° |
CA | N | H2 | 109.5° | 111.0° |
N | CA | CB | 107.8° | 109.5° |
N | CA | C | 106.4° | 109.5° |
N | CA | HA | 113.0° | 109.5° |
H | N | H2 | 109.5° | 111.1° |
CB | CA | C | 110.9° | 109.4° |
CB | CA | HA | 108.7° | 109.4° |
CA | CB | HB | 109.2° | 109.4° |
CA | CB | HBA | 109.0° | 109.5° |
C | CA | HA | 110.0° | 109.5° |
CA | C | O | 119.9° | 120.0° |
CA | C | OXT | 120.0° | 120.0° |
HB | CB | HBA | 110.1° | 109.5° |
O | C | OXT | 120.0° | 120.0° |
C | OXT | HXT | 109.5° | 116.9° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | C6 | CB | 120.8° | 120.0° |
C2 | C1 | C6 | H1 | 120.5° | 119.9° |
C2 | C1 | CB | H1 | 120.5° | 120.0° |
C1 | C2 | C3 | H2B | 120.0° | 120.0° |
C1 | C2 | C3 | H2A | 119.1° | 120.0° |
C1 | C2 | H2B | H2A | 119.1° | 119.9° |
C1 | C2 | C3 | C4 | 56.6° | 60.0° |
C1 | C2 | C3 | H3 | 63.4° | 60.0° |
C1 | C2 | C3 | H3A | 176.0° | 180.0° |
C2 | C1 | C6 | C5 | 58.6° | 60.0° |
C2 | C1 | C6 | H6 | 61.4° | 60.1° |
C2 | C1 | C6 | H6A | 178.2° | 180.0° |
C2 | C1 | CB | CA | 172.2° | 65.7° |
C2 | C1 | CB | HB | 67.7° | 174.4° |
C2 | C1 | CB | HBA | 52.5° | 54.3° |
C6 | C1 | CB | H1 | 119.1° | 120.0° |
C6 | C1 | C2 | C3 | 58.6° | 59.9° |
C6 | C1 | C2 | H2B | 178.6° | 180.0° |
C6 | C1 | C2 | H2A | 60.5° | 60.1° |
C1 | C6 | C5 | C4 | 57.6° | 60.1° |
C1 | C6 | C5 | H6 | 120.0° | 120.0° |
C1 | C6 | C5 | H6A | 119.7° | 119.9° |
C1 | C6 | C5 | H5 | 62.4° | 59.9° |
C1 | C6 | C5 | H5A | 176.9° | 180.0° |
C1 | C6 | H6 | H6A | 119.7° | 119.9° |
C6 | C1 | CB | CA | 67.4° | 174.3° |
C6 | C1 | CB | HB | 52.6° | 54.4° |
C6 | C1 | CB | HBA | 172.9° | 65.7° |
CB | C1 | C2 | C3 | 179.4° | 180.0° |
CB | C1 | C2 | H2B | 59.4° | 60.0° |
CB | C1 | C2 | H2A | 61.5° | 60.0° |
CB | C1 | C6 | C5 | 179.3° | 180.0° |
CB | C1 | C6 | H6 | 59.3° | 59.9° |
CB | C1 | C6 | H6A | 61.0° | 60.0° |
C1 | CB | CA | N | 171.7° | 64.1° |
C1 | CB | CA | HB | 120.0° | 120.0° |
C1 | CB | CA | HBA | 119.7° | 120.0° |
C1 | CB | CA | C | 72.1° | 175.8° |
C1 | CB | CA | HA | 48.9° | 55.9° |
C1 | CB | HB | HBA | 119.7° | 120.0° |
H1 | C1 | C2 | C3 | 60.6° | 60.0° |
H1 | C1 | C2 | H2B | 59.4° | 60.1° |
H1 | C1 | C2 | H2A | 179.7° | NaN° |
H1 | C1 | C6 | C5 | 61.9° | 59.9° |
H1 | C1 | C6 | H6 | 178.1° | 180.0° |
H1 | C1 | C6 | H6A | 57.7° | 60.1° |
H1 | C1 | CB | CA | 51.8° | 54.3° |
H1 | C1 | CB | HB | 171.8° | 65.7° |
H1 | C1 | CB | HBA | 67.9° | 174.3° |
C3 | C2 | H2B | H2A | 119.1° | 120.0° |
C2 | C3 | C4 | H3 | 120.0° | 120.1° |
C2 | C3 | C4 | H3A | 119.4° | 120.0° |
C2 | C3 | H3 | H3A | 119.4° | 120.0° |
C2 | C3 | C4 | C5 | 54.1° | 60.0° |
C2 | C3 | C4 | H4 | 174.1° | 180.0° |
C2 | C3 | C4 | H4A | 65.1° | 59.9° |
H2B | C2 | C3 | C4 | 176.6° | 180.0° |
H2B | C2 | C3 | H3 | 56.6° | 60.0° |
H2B | C2 | C3 | H3A | 64.0° | 60.0° |
H2A | C2 | C3 | C4 | 62.5° | 60.0° |
H2A | C2 | C3 | H3 | 177.5° | 180.0° |
H2A | C2 | C3 | H3A | 56.9° | 60.0° |
C4 | C3 | H3 | H3A | 119.4° | 119.9° |
C3 | C4 | C5 | H4 | 120.0° | 120.0° |
C3 | C4 | C5 | H4A | 119.2° | 119.9° |
C3 | C4 | H4 | H4A | 119.2° | 120.0° |
C3 | C4 | C5 | C6 | 54.9° | 60.0° |
C3 | C4 | C5 | H5 | 65.1° | 60.0° |
C3 | C4 | C5 | H5A | 174.2° | 180.0° |
H3 | C3 | C4 | C5 | 66.0° | 60.1° |
H3 | C3 | C4 | H4 | 54.0° | 59.9° |
H3 | C3 | C4 | H4A | 174.8° | 180.0° |
H3A | C3 | C4 | C5 | 173.4° | 180.0° |
H3A | C3 | C4 | H4 | 66.6° | 60.0° |
H3A | C3 | C4 | H4A | 54.2° | 60.1° |
C5 | C4 | H4 | H4A | 119.2° | 120.0° |
C4 | C5 | C6 | H5 | 120.0° | 120.0° |
C4 | C5 | C6 | H5A | 119.3° | 120.0° |
C4 | C5 | H5 | H5A | 119.3° | 120.0° |
C4 | C5 | C6 | H6 | 62.4° | 60.0° |
C4 | C5 | C6 | H6A | 177.3° | 180.0° |
H4 | C4 | C5 | C6 | 174.9° | 180.0° |
H4 | C4 | C5 | H5 | 54.9° | 60.0° |
H4 | C4 | C5 | H5A | 65.8° | 60.0° |
H4A | C4 | C5 | C6 | 64.3° | 59.9° |
H4A | C4 | C5 | H5 | 175.7° | 179.9° |
H4A | C4 | C5 | H5A | 55.0° | 60.1° |
C6 | C5 | H5 | H5A | 119.3° | 120.0° |
C5 | C6 | H6 | H6A | 119.6° | 120.0° |
H5 | C5 | C6 | H6 | 177.6° | 180.0° |
H5 | C5 | C6 | H6A | 57.3° | 60.0° |
H5A | C5 | C6 | H6 | 56.9° | 60.0° |
H5A | C5 | C6 | H6A | 63.5° | 60.0° |
CA | N | H | H2 | 120.0° | 123.9° |
N | CA | CB | C | 116.1° | 120.1° |
N | CA | CB | HA | 122.8° | 120.0° |
N | CA | C | HA | 122.8° | 120.0° |
N | CA | CB | HB | 51.7° | 55.8° |
N | CA | CB | HBA | 68.6° | 175.9° |
N | CA | C | O | 42.0° | 20.0° |
N | CA | C | OXT | 137.9° | 160.0° |
H | N | CA | CB | 2.9° | 60.0° |
H | N | CA | C | 116.1° | 60.0° |
H | N | CA | HA | 123.0° | 180.0° |
H2 | N | CA | CB | 122.9° | 176.0° |
H2 | N | CA | C | 3.9° | 64.0° |
H2 | N | CA | HA | 117.0° | 56.0° |
CB | CA | C | HA | 120.3° | 119.9° |
CA | CB | HB | HBA | 119.7° | 120.0° |
CB | CA | C | O | 74.9° | 100.1° |
CB | CA | C | OXT | 105.1° | 80.0° |
C | CA | CB | HB | 167.8° | 64.2° |
C | CA | CB | HBA | 47.5° | 55.8° |
CA | C | O | OXT | 180.0° | 179.9° |
CA | C | OXT | HXT | 180.0° | 180.0° |
HA | CA | CB | HB | 71.1° | 175.8° |
HA | CA | CB | HBA | 168.6° | 64.1° |
HA | CA | C | O | 164.8° | 140.0° |
HA | CA | C | OXT | 15.2° | 39.9° |
O | C | OXT | HXT | 0.0° | 0.0° |