ZQN
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CG1 | CB | sing | 1.53Å | 1.53Å | |
CB | CG2 | sing | 1.53Å | 1.53Å | |
CB | CA | sing | 1.53Å | 1.55Å | |
CA | N | sing | 1.47Å | 1.46Å | |
N | C5 | sing | 1.35Å | 1.35Å | |
C5 | O1 | doub | 1.22Å | 1.22Å | |
C5 | O2 | sing | 1.35Å | 1.35Å | |
O2 | C6 | sing | 1.45Å | 1.48Å | |
C6 | C7 | sing | 1.53Å | 1.51Å | |
C6 | C8 | sing | 1.53Å | 1.51Å | |
C6 | C9 | sing | 1.53Å | 1.51Å | |
CA | C | sing | 1.51Å | 1.52Å | |
C | OXT | sing | 1.34Å | 1.31Å | |
C | O | doub | 1.21Å | 1.21Å | |
CG1 | HG11 | sing | 1.09Å | 1.10Å | |
CG1 | HG12 | sing | 1.09Å | 1.10Å | |
CG1 | HG13 | sing | 1.09Å | 1.10Å | |
CB | HB | sing | 1.09Å | 1.10Å | |
CG2 | HG21 | sing | 1.09Å | 1.10Å | |
CG2 | HG22 | sing | 1.09Å | 1.10Å | |
CG2 | HG23 | sing | 1.09Å | 1.10Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
N | H | sing | 0.97Å | 1.00Å | |
C7 | H10 | sing | 1.09Å | 1.10Å | |
C7 | H11 | sing | 1.09Å | 1.10Å | |
C7 | H12 | sing | 1.09Å | 1.10Å | |
C8 | H13 | sing | 1.09Å | 1.10Å | |
C8 | H14 | sing | 1.09Å | 1.10Å | |
C8 | H15 | sing | 1.09Å | 1.10Å | |
C9 | H16 | sing | 1.09Å | 1.10Å | |
C9 | H17 | sing | 1.09Å | 1.10Å | |
C9 | H18 | 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) |
CG1 | CB | CG2 | 110.4° | 109.5° |
CG1 | CB | CA | 111.9° | 109.5° |
CB | CG1 | HG11 | 109.5° | 109.5° |
CB | CG1 | HG12 | 109.5° | 109.4° |
CB | CG1 | HG13 | 109.5° | 109.4° |
CG1 | CB | HB | 107.2° | 109.5° |
CG2 | CB | CA | 113.0° | 109.5° |
CG2 | CB | HB | 107.2° | 109.5° |
CB | CG2 | HG21 | 109.5° | 109.4° |
CB | CG2 | HG22 | 109.5° | 109.5° |
CB | CG2 | HG23 | 109.4° | 109.4° |
CB | CA | N | 111.5° | 109.4° |
CB | CA | C | 113.2° | 109.5° |
CA | CB | HB | 106.9° | 109.4° |
CB | CA | HA | 106.5° | 109.5° |
CA | N | C5 | 123.3° | 120.0° |
N | CA | C | 111.0° | 109.5° |
N | CA | HA | 107.5° | 109.5° |
CA | N | H | 118.3° | 120.0° |
N | C5 | O1 | 124.1° | 120.0° |
N | C5 | O2 | 109.5° | 120.0° |
C5 | N | H | 118.4° | 120.1° |
O1 | C5 | O2 | 126.4° | 120.0° |
C5 | O2 | C6 | 124.3° | 117.1° |
O2 | C6 | C7 | 103.5° | 109.5° |
O2 | C6 | C8 | 110.5° | 109.5° |
O2 | C6 | C9 | 109.9° | 109.5° |
C7 | C6 | C8 | 110.3° | 109.5° |
C7 | C6 | C9 | 110.2° | 109.4° |
C6 | C7 | H10 | 109.5° | 109.5° |
C6 | C7 | H11 | 109.5° | 109.5° |
C6 | C7 | H12 | 109.5° | 109.5° |
C8 | C6 | C9 | 112.0° | 109.5° |
C6 | C8 | H13 | 109.5° | 109.5° |
C6 | C8 | H14 | 109.5° | 109.5° |
C6 | C8 | H15 | 109.5° | 109.5° |
C6 | C9 | H16 | 109.5° | 109.5° |
C6 | C9 | H17 | 109.4° | 109.5° |
C6 | C9 | H18 | 109.5° | 109.4° |
CA | C | OXT | 113.3° | 120.0° |
CA | C | O | 122.4° | 120.0° |
C | CA | HA | 106.8° | 109.5° |
OXT | C | O | 124.3° | 120.0° |
C | OXT | HXT | 109.5° | 116.9° |
HG11 | CG1 | HG12 | 109.4° | 109.6° |
HG11 | CG1 | HG13 | 109.5° | 109.5° |
HG12 | CG1 | HG13 | 109.5° | 109.5° |
HG21 | CG2 | HG22 | 109.5° | 109.5° |
HG21 | CG2 | HG23 | 109.5° | 109.5° |
HG22 | CG2 | HG23 | 109.4° | 109.5° |
H10 | C7 | H11 | 109.5° | 109.4° |
H10 | C7 | H12 | 109.5° | 109.5° |
H11 | C7 | H12 | 109.5° | 109.4° |
H13 | C8 | H14 | 109.5° | 109.4° |
H13 | C8 | H15 | 109.5° | 109.5° |
H14 | C8 | H15 | 109.4° | 109.5° |
H16 | C9 | H17 | 109.5° | 109.5° |
H16 | C9 | H18 | 109.5° | 109.5° |
H17 | C9 | H18 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CG1 | CB | CG2 | CA | 126.1° | 120.0° |
CG1 | CB | CG2 | HB | 116.4° | 120.0° |
CG1 | CB | CA | HB | 117.0° | 120.0° |
CG1 | CB | CA | N | 167.8° | 60.0° |
CG1 | CB | CA | C | 66.3° | 180.0° |
CB | CG1 | HG11 | HG12 | 120.0° | 120.0° |
CB | CG1 | HG11 | HG13 | 120.0° | 119.9° |
CB | CG1 | HG12 | HG13 | 120.0° | 119.9° |
CG1 | CB | CG2 | HG21 | 180.0° | 60.0° |
CG1 | CB | CG2 | HG22 | 60.0° | 180.0° |
CG1 | CB | CG2 | HG23 | 60.0° | 60.0° |
CG1 | CB | CA | HA | 50.8° | 60.0° |
CG2 | CB | CA | HB | 117.7° | 120.0° |
CG2 | CB | CA | N | 66.9° | 60.0° |
CG2 | CB | CA | C | 59.0° | 60.0° |
CG2 | CB | CG1 | HG11 | 180.0° | 180.0° |
CG2 | CB | CG1 | HG12 | 60.0° | 59.9° |
CG2 | CB | CG1 | HG13 | 60.0° | 60.0° |
CB | CG2 | HG21 | HG22 | 120.0° | 120.0° |
CB | CG2 | HG21 | HG23 | 120.0° | 119.9° |
CB | CG2 | HG22 | HG23 | 120.0° | 120.0° |
CG2 | CB | CA | HA | 176.1° | 180.0° |
CB | CA | N | C | 127.1° | 120.0° |
CB | CA | N | HA | 116.4° | 120.0° |
CB | CA | N | C5 | 76.4° | 85.0° |
CB | CA | C | HA | 116.8° | 120.0° |
CB | CA | C | OXT | 90.9° | 60.0° |
CB | CA | C | O | 88.8° | 120.0° |
CA | CB | CG1 | HG11 | 53.3° | 60.0° |
CA | CB | CG1 | HG12 | 173.3° | 60.1° |
CA | CB | CG1 | HG13 | 66.7° | 180.0° |
CA | CB | CG2 | HG21 | 53.9° | 60.1° |
CA | CB | CG2 | HG22 | 66.1° | 60.0° |
CA | CB | CG2 | HG23 | 173.9° | 180.0° |
CB | CA | N | H | 103.6° | 95.0° |
CA | N | C5 | H | 180.0° | 180.0° |
CA | N | C5 | O1 | 0.8° | 0.1° |
CA | N | C5 | O2 | 179.3° | 180.0° |
N | CA | C | HA | 116.9° | 120.0° |
N | CA | C | OXT | 142.8° | 180.0° |
N | CA | C | O | 37.4° | 0.0° |
N | CA | CB | HB | 50.8° | 180.0° |
N | C5 | O1 | O2 | 179.9° | 179.9° |
N | C5 | O2 | C6 | 179.6° | 180.0° |
C5 | N | CA | C | 156.4° | 155.0° |
C5 | N | CA | HA | 40.0° | 35.0° |
O1 | C5 | O2 | C6 | 0.3° | 0.1° |
O1 | C5 | N | H | 179.2° | 180.0° |
C5 | O2 | C6 | C7 | 179.8° | 59.9° |
C5 | O2 | C6 | C8 | 61.7° | 180.0° |
C5 | O2 | C6 | C9 | 62.5° | 60.0° |
O2 | C5 | N | H | 0.7° | 0.1° |
O2 | C6 | C7 | C8 | 118.3° | 120.0° |
O2 | C6 | C7 | C9 | 117.5° | 120.0° |
O2 | C6 | C8 | C9 | 123.0° | 120.0° |
O2 | C6 | C7 | H10 | 180.0° | 60.1° |
O2 | C6 | C7 | H11 | 60.0° | 180.0° |
O2 | C6 | C7 | H12 | 60.0° | 60.0° |
O2 | C6 | C8 | H13 | 180.0° | 60.0° |
O2 | C6 | C8 | H14 | 60.0° | 180.0° |
O2 | C6 | C8 | H15 | 60.0° | 60.0° |
O2 | C6 | C9 | H16 | 180.0° | 59.9° |
O2 | C6 | C9 | H17 | 60.0° | 180.0° |
O2 | C6 | C9 | H18 | 60.0° | 60.0° |
C7 | C6 | C8 | C9 | 123.2° | 120.0° |
C6 | C7 | H10 | H11 | 120.0° | 120.0° |
C6 | C7 | H10 | H12 | 120.0° | 120.1° |
C6 | C7 | H11 | H12 | 120.0° | 120.0° |
C7 | C6 | C8 | H13 | 66.2° | 180.0° |
C7 | C6 | C8 | H14 | 173.8° | 60.0° |
C7 | C6 | C8 | H15 | 53.9° | 60.0° |
C7 | C6 | C9 | H16 | 66.5° | 60.0° |
C7 | C6 | C9 | H17 | 53.5° | 60.0° |
C7 | C6 | C9 | H18 | 173.5° | 180.0° |
C8 | C6 | C7 | H10 | 61.7° | 59.9° |
C8 | C6 | C7 | H11 | 58.3° | 60.0° |
C8 | C6 | C7 | H12 | 178.3° | 180.0° |
C6 | C8 | H13 | H14 | 120.0° | 120.0° |
C6 | C8 | H13 | H15 | 120.0° | 120.0° |
C6 | C8 | H14 | H15 | 120.0° | 120.0° |
C8 | C6 | C9 | H16 | 56.7° | 180.0° |
C8 | C6 | C9 | H17 | 176.7° | 60.0° |
C8 | C6 | C9 | H18 | 63.3° | 60.0° |
C9 | C6 | C7 | H10 | 62.5° | 179.9° |
C9 | C6 | C7 | H11 | 177.5° | 60.0° |
C9 | C6 | C7 | H12 | 57.5° | 60.0° |
C9 | C6 | C8 | H13 | 57.0° | 60.0° |
C9 | C6 | C8 | H14 | 63.0° | 60.0° |
C9 | C6 | C8 | H15 | 177.0° | 180.0° |
C6 | C9 | H16 | H17 | 120.0° | 120.0° |
C6 | C9 | H16 | H18 | 120.0° | 119.9° |
C6 | C9 | H17 | H18 | 120.0° | 120.0° |
CA | C | OXT | O | 179.7° | 179.9° |
C | CA | CB | HB | 176.7° | 60.0° |
C | CA | N | H | 23.5° | 25.0° |
CA | C | OXT | HXT | 179.7° | 180.0° |
OXT | C | CA | HA | 25.9° | 60.0° |
O | C | CA | HA | 154.4° | 120.0° |
O | C | OXT | HXT | 0.0° | 0.0° |
HG11 | CG1 | HG12 | HG13 | 120.0° | 120.1° |
HG11 | CG1 | CB | HB | 63.6° | 59.9° |
HG12 | CG1 | CB | HB | 56.4° | 180.0° |
HG13 | CG1 | CB | HB | 176.4° | 60.0° |
HB | CB | CG2 | HG21 | 63.6° | 180.0° |
HB | CB | CG2 | HG22 | 176.4° | 60.0° |
HB | CB | CG2 | HG23 | 56.4° | 60.0° |
HB | CB | CA | HA | 66.2° | 60.0° |
HG21 | CG2 | HG22 | HG23 | 120.0° | 120.0° |
HA | CA | N | H | 140.0° | 145.0° |
H10 | C7 | H11 | H12 | 120.0° | 120.0° |
H13 | C8 | H14 | H15 | 120.0° | 120.0° |
H16 | C9 | H17 | H18 | 120.0° | 120.0° |