OUI
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CD1 | CG1 | sing | 1.53Å | 1.54Å | |
CG1 | CB | sing | 1.53Å | 1.56Å | |
CG2 | CB | sing | 1.53Å | 1.55Å | |
CB | CA | sing | 1.53Å | 1.56Å | |
N | CA | sing | 1.47Å | 1.47Å | |
CA | CM | sing | 1.53Å | 1.55Å | |
CM | N2 | sing | 1.47Å | 1.47Å | |
N2 | C | sing | 1.35Å | 1.40Å | |
C | O | doub | 1.22Å | 1.23Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
N | H | sing | 1.01Å | 1.00Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
CB | HB | sing | 1.09Å | 1.10Å | |
CG1 | HG13 | sing | 1.09Å | 1.10Å | |
CG1 | HG12 | 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 | |
CD1 | HD12 | sing | 1.09Å | 1.10Å | |
CD1 | HD13 | sing | 1.09Å | 1.10Å | |
CD1 | HD11 | sing | 1.09Å | 1.10Å | |
CM | HM2 | sing | 1.09Å | 1.10Å | |
CM | HM3 | sing | 1.09Å | 1.10Å | |
N2 | HN2 | sing | 0.97Å | 1.00Å | |
C | OXT | sing | 1.35Å | 1.39Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CD1 | CG1 | CB | 113.5° | 109.5° |
CD1 | CG1 | HG13 | 108.5° | 109.4° |
CD1 | CG1 | HG12 | 108.5° | 109.5° |
CG1 | CD1 | HD12 | 109.5° | 109.5° |
CG1 | CD1 | HD13 | 109.5° | 109.5° |
CG1 | CD1 | HD11 | 109.4° | 109.5° |
CG1 | CB | CG2 | 111.3° | 109.5° |
CG1 | CB | CA | 113.0° | 109.5° |
CG1 | CB | HB | 107.3° | 109.5° |
CB | CG1 | HG13 | 108.5° | 109.5° |
CB | CG1 | HG12 | 108.5° | 109.5° |
CG2 | CB | CA | 110.1° | 109.5° |
CG2 | CB | HB | 107.5° | 109.4° |
CB | CG2 | HG21 | 109.5° | 109.4° |
CB | CG2 | HG22 | 109.4° | 109.5° |
CB | CG2 | HG23 | 109.5° | 109.5° |
CB | CA | N | 112.0° | 109.5° |
CB | CA | CM | 111.8° | 109.5° |
CB | CA | HA | 106.8° | 109.4° |
CA | CB | HB | 107.4° | 109.5° |
N | CA | CM | 111.1° | 109.5° |
CA | N | H2 | 109.5° | 111.0° |
CA | N | H | 109.5° | 111.0° |
N | CA | HA | 107.8° | 109.5° |
CA | CM | N2 | 112.2° | 109.4° |
CM | CA | HA | 106.9° | 109.5° |
CA | CM | HM2 | 108.8° | 109.5° |
CA | CM | HM3 | 108.8° | 109.4° |
CM | N2 | C | 119.9° | 120.0° |
N2 | CM | HM2 | 108.8° | 109.5° |
N2 | CM | HM3 | 108.8° | 109.5° |
CM | N2 | HN2 | 120.0° | 120.0° |
N2 | C | O | 118.9° | 120.0° |
C | N2 | HN2 | 120.1° | 120.1° |
N2 | C | OXT | 112.3° | 120.0° |
O | C | OXT | 118.6° | 120.0° |
H2 | N | H | 109.4° | 111.0° |
HG13 | CG1 | HG12 | 109.5° | 109.5° |
HG21 | CG2 | HG22 | 109.5° | 109.4° |
HG21 | CG2 | HG23 | 109.5° | 109.5° |
HG22 | CG2 | HG23 | 109.4° | 109.5° |
HD12 | CD1 | HD13 | 109.4° | 109.5° |
HD12 | CD1 | HD11 | 109.5° | 109.4° |
HD13 | CD1 | HD11 | 109.5° | 109.5° |
HM2 | CM | HM3 | 109.5° | 109.5° |
C | OXT | HXT | 109.5° | 117.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CD1 | CG1 | CB | HG13 | 120.6° | 119.9° |
CD1 | CG1 | CB | HG12 | 120.6° | 120.0° |
CD1 | CG1 | CB | CG2 | 56.9° | 65.0° |
CD1 | CG1 | CB | CA | 178.6° | 175.0° |
CD1 | CG1 | CB | HB | 60.5° | 55.0° |
CD1 | CG1 | HG13 | HG12 | 118.2° | 120.0° |
CG1 | CD1 | HD12 | HD13 | 120.0° | 120.0° |
CG1 | CD1 | HD12 | HD11 | 120.0° | 120.0° |
CG1 | CD1 | HD13 | HD11 | 120.0° | 120.0° |
CG1 | CB | CG2 | CA | 126.1° | 120.0° |
CG1 | CB | CG2 | HB | 117.3° | 120.0° |
CG1 | CB | CA | HB | 118.1° | 120.0° |
CG1 | CB | CA | N | 68.7° | 60.0° |
CG1 | CB | CA | CM | 56.8° | 180.0° |
CG1 | CB | CA | HA | 173.4° | 60.0° |
CB | CG1 | HG13 | HG12 | 118.2° | 120.1° |
CG1 | CB | CG2 | HG21 | 180.0° | 60.0° |
CG1 | CB | CG2 | HG22 | 60.0° | 60.0° |
CG1 | CB | CG2 | HG23 | 60.0° | 180.0° |
CB | CG1 | CD1 | HD12 | 180.0° | 60.1° |
CB | CG1 | CD1 | HD13 | 60.0° | 60.0° |
CB | CG1 | CD1 | HD11 | 60.0° | 180.0° |
CG2 | CB | CA | HB | 116.7° | 120.0° |
CG2 | CB | CA | N | 56.5° | 180.0° |
CG2 | CB | CA | CM | 178.1° | 60.0° |
CG2 | CB | CA | HA | 61.4° | 60.1° |
CG2 | CB | CG1 | HG13 | 177.5° | 55.0° |
CG2 | CB | CG1 | HG12 | 63.7° | 175.0° |
CB | CG2 | HG21 | HG22 | 120.0° | 120.0° |
CB | CG2 | HG21 | HG23 | 120.0° | 120.0° |
CB | CG2 | HG22 | HG23 | 120.0° | 120.0° |
CB | CA | N | CM | 125.9° | 120.0° |
CB | CA | N | HA | 117.2° | 119.9° |
CB | CA | CM | HA | 116.6° | 120.0° |
CB | CA | CM | N2 | 177.0° | 175.0° |
CB | CA | N | H2 | 180.0° | 176.0° |
CB | CA | N | H | 60.0° | 60.1° |
CA | CB | CG1 | HG13 | 58.0° | 65.1° |
CA | CB | CG1 | HG12 | 60.8° | 55.0° |
CA | CB | CG2 | HG21 | 53.9° | 60.1° |
CA | CB | CG2 | HG22 | 66.1° | 180.0° |
CA | CB | CG2 | HG23 | 173.9° | 59.9° |
CB | CA | CM | HM2 | 56.6° | 65.0° |
CB | CA | CM | HM3 | 62.6° | 55.0° |
N | CA | CM | HA | 117.4° | 120.0° |
N | CA | CM | N2 | 57.0° | 55.0° |
CA | N | H2 | H | 120.0° | 124.0° |
N | CA | CB | HB | 173.2° | 60.0° |
N | CA | CM | HM2 | 177.4° | 175.0° |
N | CA | CM | HM3 | 63.4° | 65.0° |
CA | CM | N2 | HM2 | 120.4° | 120.0° |
CA | CM | N2 | HM3 | 120.4° | 119.9° |
CA | CM | N2 | C | 85.3° | 180.0° |
CM | CA | N | H2 | 54.1° | 64.0° |
CM | CA | N | H | 65.9° | 60.0° |
CM | CA | CB | HB | 61.4° | 60.0° |
CA | CM | HM2 | HM3 | 118.8° | 120.0° |
CA | CM | N2 | HN2 | 94.7° | 0.1° |
CM | N2 | C | HN2 | 180.0° | 179.9° |
CM | N2 | C | O | 58.1° | 0.1° |
N2 | CM | CA | HA | 60.4° | 65.0° |
N2 | CM | HM2 | HM3 | 118.7° | 120.1° |
CM | N2 | C | OXT | 157.0° | 180.0° |
N2 | C | O | OXT | 142.7° | 179.9° |
C | N2 | CM | HM2 | 35.1° | 60.0° |
C | N2 | CM | HM3 | 154.3° | 60.1° |
N2 | C | OXT | HXT | 145.0° | 180.0° |
O | C | N2 | HN2 | 121.9° | 180.0° |
O | C | OXT | HXT | 0.0° | 0.0° |
H2 | N | CA | HA | 62.8° | 56.0° |
H | N | CA | HA | 177.2° | 180.0° |
HA | CA | CB | HB | 55.3° | 180.0° |
HA | CA | CM | HM2 | 60.0° | 54.9° |
HA | CA | CM | HM3 | 179.2° | 175.0° |
HB | CB | CG1 | HG13 | 60.1° | 174.9° |
HB | CB | CG1 | HG12 | 178.9° | 65.0° |
HB | CB | CG2 | HG21 | 62.8° | 179.9° |
HB | CB | CG2 | HG22 | 177.2° | 60.0° |
HB | CB | CG2 | HG23 | 57.3° | 60.0° |
HG13 | CG1 | CD1 | HD12 | 59.4° | 180.0° |
HG13 | CG1 | CD1 | HD13 | 60.6° | 60.0° |
HG13 | CG1 | CD1 | HD11 | 179.4° | 60.0° |
HG12 | CG1 | CD1 | HD12 | 59.4° | 60.0° |
HG12 | CG1 | CD1 | HD13 | 179.4° | 180.0° |
HG12 | CG1 | CD1 | HD11 | 60.6° | 60.0° |
HG21 | CG2 | HG22 | HG23 | 120.0° | 120.0° |
HD12 | CD1 | HD13 | HD11 | 120.0° | 120.0° |
HM2 | CM | N2 | HN2 | 144.9° | 119.9° |
HM3 | CM | N2 | HN2 | 25.7° | 120.0° |
HN2 | N2 | C | OXT | 23.1° | 0.1° |