IL0
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N | CA | sing | 1.47Å | 1.47Å | |
N | H | sing | 1.01Å | 1.00Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
CA | C | sing | 1.53Å | 1.52Å | |
CA | CB | sing | 1.53Å | 1.57Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
C | O | sing | 1.43Å | 1.25Å | |
C | OXT | sing | 1.43Å | 1.25Å | |
CB | CG1 | sing | 1.53Å | 1.54Å | |
CB | CG2 | sing | 1.53Å | 1.53Å | |
CB | HB | sing | 1.09Å | 1.10Å | |
CG1 | CD1 | sing | 1.53Å | 1.53Å | |
CG1 | HG12 | sing | 1.09Å | 1.10Å | |
CG1 | HG13 | 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 | HD11 | sing | 1.09Å | 1.10Å | |
CD1 | HD12 | sing | 1.09Å | 1.10Å | |
CD1 | HD13 | sing | 1.09Å | 1.10Å | |
OXT | HXT | sing | 0.97Å | 0.95Å | |
C | H14 | sing | 1.09Å | 1.10Å | |
O | H15 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CA | N | H | 109.5° | 111.0° |
CA | N | H2 | 109.5° | 111.0° |
N | CA | C | 111.2° | 109.4° |
N | CA | CB | 112.2° | 109.5° |
N | CA | HA | 105.8° | 109.5° |
H | N | H2 | 109.4° | 111.0° |
C | CA | CB | 107.5° | 109.4° |
C | CA | HA | 110.6° | 109.5° |
CA | C | O | 117.8° | 109.5° |
CA | C | OXT | 117.6° | 109.5° |
CA | C | H14 | 160.2° | 109.4° |
CB | CA | HA | 109.6° | 109.5° |
CA | CB | CG1 | 110.3° | 109.5° |
CA | CB | CG2 | 110.3° | 109.5° |
CA | CB | HB | 108.5° | 109.5° |
O | C | OXT | 124.6° | 109.5° |
O | C | H14 | 62.7° | 109.5° |
C | O | H15 | 109.5° | 114.0° |
C | OXT | HXT | 109.5° | 114.0° |
OXT | C | H14 | 65.9° | 109.5° |
CG1 | CB | CG2 | 110.1° | 109.5° |
CG1 | CB | HB | 108.8° | 109.5° |
CB | CG1 | CD1 | 113.1° | 109.5° |
CB | CG1 | HG12 | 108.3° | 109.4° |
CB | CG1 | HG13 | 108.3° | 109.5° |
CG2 | CB | HB | 108.8° | 109.5° |
CB | CG2 | HG21 | 109.5° | 109.5° |
CB | CG2 | HG22 | 109.4° | 109.5° |
CB | CG2 | HG23 | 109.5° | 109.5° |
CD1 | CG1 | HG12 | 108.3° | 109.5° |
CD1 | CG1 | HG13 | 108.3° | 109.5° |
CG1 | CD1 | HD11 | 109.5° | 109.5° |
CG1 | CD1 | HD12 | 109.5° | 109.5° |
CG1 | CD1 | HD13 | 109.4° | 109.5° |
HG12 | CG1 | HG13 | 110.6° | 109.5° |
HG21 | CG2 | HG22 | 109.5° | 109.4° |
HG21 | CG2 | HG23 | 109.5° | 109.5° |
HG22 | CG2 | HG23 | 109.5° | 109.5° |
HD11 | CD1 | HD12 | 109.4° | 109.5° |
HD11 | CD1 | HD13 | 109.5° | 109.5° |
HD12 | CD1 | HD13 | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CA | N | H | H2 | 120.0° | 123.9° |
N | CA | C | CB | 123.2° | 120.0° |
N | CA | C | HA | 117.2° | 120.0° |
N | CA | CB | HA | 117.2° | 120.0° |
N | CA | C | O | 38.4° | 55.0° |
N | CA | C | OXT | 143.2° | 65.0° |
N | CA | CB | CG1 | 163.6° | 60.0° |
N | CA | CB | CG2 | 74.6° | 180.0° |
N | CA | CB | HB | 44.5° | 60.0° |
N | CA | C | H14 | 47.9° | 175.0° |
H | N | CA | C | 180.0° | 60.0° |
H | N | CA | CB | 59.6° | 60.0° |
H | N | CA | HA | 59.8° | 180.0° |
H2 | N | CA | C | 60.0° | 176.1° |
H2 | N | CA | CB | 179.6° | 64.0° |
H2 | N | CA | HA | 60.2° | 56.0° |
C | CA | CB | HA | 120.3° | 120.0° |
CA | C | O | OXT | 178.2° | 120.0° |
CA | C | O | H14 | 157.6° | 120.0° |
CA | C | OXT | H14 | 158.3° | 120.0° |
C | CA | CB | CG1 | 73.8° | 179.9° |
C | CA | CB | CG2 | 48.0° | 60.1° |
C | CA | CB | HB | 167.1° | 60.0° |
CA | C | OXT | HXT | 180.0° | 180.0° |
CA | C | O | H15 | 180.0° | 60.0° |
CB | CA | C | O | 84.7° | 65.0° |
CB | CA | C | OXT | 93.6° | 175.0° |
CA | CB | CG1 | CG2 | 121.9° | 120.0° |
CA | CB | CG1 | HB | 118.9° | 120.0° |
CA | CB | CG2 | HB | 118.9° | 120.0° |
CA | CB | CG1 | CD1 | 174.2° | 175.0° |
CA | CB | CG1 | HG12 | 54.2° | 65.0° |
CA | CB | CG1 | HG13 | 65.9° | 55.0° |
CA | CB | CG2 | HG21 | 180.0° | 60.0° |
CA | CB | CG2 | HG22 | 60.0° | 59.9° |
CA | CB | CG2 | HG23 | 60.0° | 180.0° |
CB | CA | C | H14 | 171.1° | 55.0° |
HA | CA | C | O | 155.7° | 175.0° |
HA | CA | C | OXT | 26.0° | 55.0° |
HA | CA | CB | CG1 | 46.4° | 60.0° |
HA | CA | CB | CG2 | 168.2° | 60.0° |
HA | CA | CB | HB | 72.7° | NaN° |
HA | CA | C | H14 | 69.3° | 65.0° |
O | C | OXT | H14 | 23.5° | 120.0° |
O | C | OXT | HXT | 1.8° | 60.0° |
OXT | C | O | H15 | 1.8° | 60.0° |
CG1 | CB | CG2 | HB | 119.1° | 120.0° |
CB | CG1 | CD1 | HG12 | 120.0° | 120.0° |
CB | CG1 | CD1 | HG13 | 120.0° | 120.0° |
CB | CG1 | HG12 | HG13 | 118.5° | 119.9° |
CG1 | CB | CG2 | HG21 | 58.0° | 180.0° |
CG1 | CB | CG2 | HG22 | 178.1° | 60.1° |
CG1 | CB | CG2 | HG23 | 62.0° | 60.0° |
CB | CG1 | CD1 | HD11 | 180.0° | 60.0° |
CB | CG1 | CD1 | HD12 | 60.0° | 60.0° |
CB | CG1 | CD1 | HD13 | 60.0° | 179.9° |
CG2 | CB | CG1 | CD1 | 52.2° | 65.0° |
CG2 | CB | CG1 | HG12 | 67.8° | 55.1° |
CG2 | CB | CG1 | HG13 | 172.2° | 175.0° |
CB | CG2 | HG21 | HG22 | 120.0° | 120.0° |
CB | CG2 | HG21 | HG23 | 120.0° | 120.1° |
CB | CG2 | HG22 | HG23 | 120.0° | 120.1° |
HB | CB | CG1 | CD1 | 66.9° | 55.0° |
HB | CB | CG1 | HG12 | 173.1° | 175.0° |
HB | CB | CG1 | HG13 | 53.1° | 65.0° |
HB | CB | CG2 | HG21 | 61.1° | 60.0° |
HB | CB | CG2 | HG22 | 58.9° | 179.9° |
HB | CB | CG2 | HG23 | 178.9° | 60.0° |
CD1 | CG1 | HG12 | HG13 | 118.5° | 120.1° |
CG1 | CD1 | HD11 | HD12 | 120.0° | 120.0° |
CG1 | CD1 | HD11 | HD13 | 120.0° | 120.0° |
CG1 | CD1 | HD12 | HD13 | 120.0° | 120.0° |
HG12 | CG1 | CD1 | HD11 | 60.0° | 180.0° |
HG12 | CG1 | CD1 | HD12 | 180.0° | 60.0° |
HG12 | CG1 | CD1 | HD13 | 60.0° | 60.0° |
HG13 | CG1 | CD1 | HD11 | 60.0° | 60.0° |
HG13 | CG1 | CD1 | HD12 | 60.0° | 180.0° |
HG13 | CG1 | CD1 | HD13 | 180.0° | 60.1° |
HG21 | CG2 | HG22 | HG23 | 120.0° | 120.0° |
HD11 | CD1 | HD12 | HD13 | 120.0° | 120.0° |
HXT | OXT | C | H14 | 21.7° | 60.0° |
H14 | C | O | H15 | 22.4° | 180.0° |