OUR
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
NH2 | CZ | doub | 1.33Å | 1.34Å | |
NH1 | CZ | sing | 1.33Å | 1.33Å | |
CZ | NE | sing | 1.37Å | 1.34Å | |
NE | CD | sing | 1.47Å | 1.47Å | |
CD | CG | sing | 1.53Å | 1.55Å | |
CG | CB | sing | 1.53Å | 1.56Å | |
CB | CA | sing | 1.53Å | 1.55Å | |
N | CA | sing | 1.47Å | 1.47Å | |
CA | CM | sing | 1.53Å | 1.55Å | |
CM | N2 | sing | 1.46Å | 1.47Å | |
N2 | C | sing | 1.35Å | 1.40Å | |
C | O | doub | 1.22Å | 1.22Å | |
C | OXT | sing | 1.35Å | 1.38Å | |
N | H | sing | 1.01Å | 1.00Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
CB | HB3 | sing | 1.09Å | 1.10Å | |
CB | HB2 | sing | 1.09Å | 1.10Å | |
CG | HG3 | sing | 1.09Å | 1.10Å | |
CG | HG2 | sing | 1.09Å | 1.10Å | |
CD | HD3 | sing | 1.09Å | 1.10Å | |
CD | HD2 | sing | 1.09Å | 1.10Å | |
NE | HE | sing | 0.97Å | 1.00Å | |
NH1 | HH12 | sing | 0.97Å | 1.00Å | |
NH1 | HH11 | sing | 0.97Å | 1.00Å | |
NH2 | HH22 | sing | 0.97Å | 1.00Å | |
CM | HM2 | sing | 1.09Å | 1.10Å | |
CM | HM3 | sing | 1.09Å | 1.10Å | |
N2 | HN2 | sing | 0.97Å | 1.00Å | |
OXT | HXT | sing | 0.97Å | 0.95Å | |
NH2 | HH21 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
NH2 | CZ | NH1 | 119.9° | 120.0° |
NH2 | CZ | NE | 119.1° | 120.0° |
CZ | NH2 | HH22 | 120.0° | 120.0° |
CZ | NH2 | HH21 | 120.0° | 120.0° |
NH1 | CZ | NE | 120.9° | 120.0° |
CZ | NH1 | HH12 | 120.0° | 120.0° |
CZ | NH1 | HH11 | 120.0° | 120.0° |
CZ | NE | CD | 127.4° | 120.0° |
CZ | NE | HE | 116.3° | 120.0° |
NE | CD | CG | 112.6° | 109.5° |
NE | CD | HD3 | 108.7° | 109.4° |
NE | CD | HD2 | 108.7° | 109.5° |
CD | NE | HE | 116.3° | 120.0° |
CD | CG | CB | 116.6° | 109.5° |
CD | CG | HG3 | 107.6° | 109.5° |
CD | CG | HG2 | 107.7° | 109.4° |
CG | CD | HD3 | 108.7° | 109.5° |
CG | CD | HD2 | 108.7° | 109.5° |
CG | CB | CA | 115.6° | 109.5° |
CG | CB | HB3 | 107.9° | 109.4° |
CG | CB | HB2 | 107.9° | 109.5° |
CB | CG | HG3 | 107.7° | 109.5° |
CB | CG | HG2 | 107.6° | 109.5° |
CB | CA | N | 111.4° | 109.5° |
CB | CA | CM | 109.1° | 109.5° |
CB | CA | HA | 108.0° | 109.5° |
CA | CB | HB3 | 107.9° | 109.5° |
CA | CB | HB2 | 107.9° | 109.5° |
N | CA | CM | 111.3° | 109.5° |
CA | N | H | 109.5° | 111.0° |
CA | N | H2 | 109.5° | 111.0° |
N | CA | HA | 108.9° | 109.5° |
CA | CM | N2 | 113.2° | 109.5° |
CM | CA | HA | 108.0° | 109.4° |
CA | CM | HM2 | 108.5° | 109.5° |
CA | CM | HM3 | 108.5° | 109.5° |
CM | N2 | C | 124.2° | 120.1° |
N2 | CM | HM2 | 108.5° | 109.4° |
N2 | CM | HM3 | 108.5° | 109.5° |
CM | N2 | HN2 | 117.9° | 120.0° |
N2 | C | O | 118.6° | 120.0° |
N2 | C | OXT | 110.7° | 120.0° |
C | N2 | HN2 | 117.9° | 120.0° |
O | C | OXT | 121.0° | 120.0° |
C | OXT | HXT | 109.5° | 117.0° |
H | N | H2 | 109.5° | 111.0° |
HB3 | CB | HB2 | 109.4° | 109.5° |
HG3 | CG | HG2 | 109.5° | 109.5° |
HD3 | CD | HD2 | 109.4° | 109.5° |
HH12 | NH1 | HH11 | 120.1° | 120.0° |
HH22 | NH2 | HH21 | 120.0° | 119.9° |
HM2 | CM | HM3 | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
NH2 | CZ | NH1 | NE | 179.9° | 180.0° |
NH2 | CZ | NE | CD | 143.0° | 180.0° |
NH2 | CZ | NE | HE | 37.0° | 0.1° |
NH2 | CZ | NH1 | HH12 | 179.9° | 180.0° |
NH2 | CZ | NH1 | HH11 | 0.1° | 0.1° |
CZ | NH2 | HH22 | HH21 | 180.0° | 179.9° |
NH1 | CZ | NE | CD | 36.9° | 0.1° |
NH1 | CZ | NE | HE | 143.1° | 180.0° |
CZ | NH1 | HH12 | HH11 | 180.0° | 179.9° |
NH1 | CZ | NH2 | HH22 | 179.9° | 179.9° |
NH1 | CZ | NH2 | HH21 | 0.1° | 0.0° |
CZ | NE | CD | HE | 180.0° | 179.9° |
CZ | NE | CD | CG | 69.0° | 180.0° |
CZ | NE | CD | HD3 | 170.5° | 60.0° |
CZ | NE | CD | HD2 | 51.5° | 59.9° |
NE | CZ | NH1 | HH12 | 0.0° | 0.1° |
NE | CZ | NH1 | HH11 | 180.0° | 180.0° |
NE | CZ | NH2 | HH22 | 0.0° | 0.0° |
NE | CZ | NH2 | HH21 | 180.0° | 179.9° |
NE | CD | CG | HD3 | 120.5° | 120.0° |
NE | CD | CG | HD2 | 120.5° | 120.0° |
NE | CD | CG | CB | 50.8° | 180.0° |
NE | CD | CG | HG3 | 171.9° | 60.0° |
NE | CD | CG | HG2 | 70.2° | 60.0° |
NE | CD | HD3 | HD2 | 118.6° | 120.0° |
CD | CG | CB | HG3 | 121.0° | 120.0° |
CD | CG | CB | HG2 | 121.0° | 119.9° |
CD | CG | CB | CA | 68.7° | 180.0° |
CD | CG | CB | HB3 | 170.4° | 60.0° |
CD | CG | CB | HB2 | 52.2° | 60.0° |
CD | CG | HG3 | HG2 | 116.8° | 120.0° |
CG | CD | HD3 | HD2 | 118.6° | 120.1° |
CG | CD | NE | HE | 111.0° | 0.1° |
CG | CB | CA | HB3 | 120.9° | 120.0° |
CG | CB | CA | HB2 | 120.9° | 120.0° |
CG | CB | CA | N | 67.9° | 65.0° |
CG | CB | CA | CM | 168.8° | 175.0° |
CG | CB | CA | HA | 51.7° | 55.0° |
CG | CB | HB3 | HB2 | 117.2° | 120.0° |
CB | CG | HG3 | HG2 | 116.7° | 120.0° |
CB | CG | CD | HD3 | 69.7° | 60.0° |
CB | CG | CD | HD2 | 171.3° | 60.0° |
CB | CA | N | CM | 122.0° | 120.0° |
CB | CA | N | HA | 119.0° | 120.0° |
CB | CA | CM | HA | 117.1° | 120.0° |
CB | CA | CM | N2 | 162.6° | 175.0° |
CB | CA | N | H | 180.0° | 60.0° |
CB | CA | N | H2 | 60.0° | 63.9° |
CA | CB | HB3 | HB2 | 117.2° | 120.0° |
CA | CB | CG | HG3 | 52.3° | 60.0° |
CA | CB | CG | HG2 | 170.2° | 60.0° |
CB | CA | CM | HM2 | 76.8° | 65.0° |
CB | CA | CM | HM3 | 42.0° | 55.0° |
N | CA | CM | HA | 119.5° | 120.0° |
N | CA | CM | N2 | 39.2° | 55.0° |
CA | N | H | H2 | 120.0° | 123.9° |
N | CA | CB | HB3 | 171.2° | 55.0° |
N | CA | CB | HB2 | 53.0° | 175.0° |
N | CA | CM | HM2 | 159.8° | 175.0° |
N | CA | CM | HM3 | 81.3° | 65.1° |
CA | CM | N2 | HM2 | 120.6° | 120.1° |
CA | CM | N2 | HM3 | 120.6° | 120.0° |
CA | CM | N2 | C | 131.1° | 179.9° |
CM | CA | N | H | 58.0° | 60.0° |
CM | CA | N | H2 | 62.1° | 176.1° |
CM | CA | CB | HB3 | 47.9° | 65.1° |
CM | CA | CB | HB2 | 70.3° | 55.0° |
CA | CM | HM2 | HM3 | 118.3° | 120.0° |
CA | CM | N2 | HN2 | 48.9° | 0.0° |
CM | N2 | C | HN2 | 180.0° | 180.0° |
CM | N2 | C | O | 47.8° | 0.0° |
CM | N2 | C | OXT | 165.9° | 180.0° |
N2 | CM | CA | HA | 80.3° | 65.0° |
N2 | CM | HM2 | HM3 | 118.3° | 119.9° |
N2 | C | O | OXT | 142.7° | 180.0° |
C | N2 | CM | HM2 | 10.5° | 60.0° |
C | N2 | CM | HM3 | 108.3° | 59.9° |
N2 | C | OXT | HXT | 145.3° | 180.0° |
O | C | N2 | HN2 | 132.2° | 180.0° |
O | C | OXT | HXT | 0.0° | 0.0° |
OXT | C | N2 | HN2 | 14.1° | 0.0° |
H | N | CA | HA | 61.0° | 180.0° |
H2 | N | CA | HA | 179.0° | 56.1° |
HA | CA | CB | HB3 | 69.2° | 175.0° |
HA | CA | CB | HB2 | 172.6° | 65.0° |
HA | CA | CM | HM2 | 40.3° | 55.0° |
HA | CA | CM | HM3 | 159.2° | 175.0° |
HB3 | CB | CG | HG3 | 68.6° | 180.0° |
HB3 | CB | CG | HG2 | 49.3° | 60.0° |
HB2 | CB | CG | HG3 | 173.2° | 60.0° |
HB2 | CB | CG | HG2 | 68.9° | 180.0° |
HG3 | CG | CD | HD3 | 51.4° | 180.0° |
HG3 | CG | CD | HD2 | 67.6° | 60.0° |
HG2 | CG | CD | HD3 | 169.3° | 59.9° |
HG2 | CG | CD | HD2 | 50.3° | 180.0° |
HD3 | CD | NE | HE | 9.5° | 120.1° |
HD2 | CD | NE | HE | 128.5° | 120.0° |
HM2 | CM | N2 | HN2 | 169.5° | 120.0° |
HM3 | CM | N2 | HN2 | 71.7° | 120.1° |