ODA
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N | CA | sing | 1.47Å | 1.44Å | |
N | H | sing | 1.01Å | 1.00Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
CA | CB | sing | 1.60Å | 1.53Å | |
CA | C2 | sing | 1.49Å | 1.53Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
CB | CG | sing | 1.60Å | 1.50Å | |
CB | HB2 | sing | 1.09Å | 1.10Å | |
CB | HB3 | sing | 1.09Å | 1.10Å | |
CG | CD | sing | 1.49Å | 1.54Å | |
CG | HG2 | sing | 1.09Å | 1.10Å | |
CG | HG3 | sing | 1.09Å | 1.10Å | |
CD | OE1 | doub | 1.21Å | 1.25Å | |
CD | NE2 | sing | 1.29Å | 1.35Å | |
NE2 | N2 | sing | 1.46Å | 1.45Å | |
NE2 | CD2 | sing | 1.45Å | 1.47Å | |
C2 | O2 | doub | 1.21Å | 1.25Å | |
C2 | N2 | sing | 1.29Å | 1.33Å | |
N2 | CA2 | sing | 1.45Å | 1.46Å | |
CA2 | CB2 | sing | 1.53Å | 1.54Å | |
CA2 | C | sing | 1.51Å | 1.52Å | |
CA2 | HA2 | sing | 1.09Å | 1.10Å | |
CB2 | CG2 | sing | 1.53Å | 1.51Å | |
CB2 | HB23 | sing | 1.09Å | 1.10Å | |
CB2 | HB22 | sing | 1.09Å | 1.10Å | |
CG2 | CD2 | sing | 1.53Å | 1.52Å | |
CG2 | HG23 | sing | 1.09Å | 1.10Å | |
CG2 | HG22 | sing | 1.09Å | 1.10Å | |
CD2 | HD22 | sing | 1.09Å | 1.10Å | |
CD2 | HD23 | sing | 1.09Å | 1.10Å | |
C | O | doub | 1.21Å | 1.22Å | |
C | OXT | sing | 1.34Å | 1.33Å | |
OXT | HXT | 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 | CB | 112.9° | 109.8° |
N | CA | C2 | 103.5° | 109.8° |
N | CA | HA | 111.9° | 109.8° |
H | N | H2 | 109.5° | 111.0° |
CB | CA | C2 | 111.5° | 107.8° |
CB | CA | HA | 104.0° | 109.8° |
CA | CB | CG | 112.6° | 94.6° |
CA | CB | HB2 | 108.5° | 112.3° |
CA | CB | HB3 | 108.4° | 112.3° |
C2 | CA | HA | 113.3° | 109.8° |
CA | C2 | O2 | 121.9° | 117.7° |
CA | C2 | N2 | 116.6° | 124.6° |
CG | CB | HB2 | 108.4° | 112.3° |
CG | CB | HB3 | 108.5° | 112.3° |
CB | CG | CD | 113.5° | 108.1° |
CB | CG | HG2 | 108.2° | 109.8° |
CB | CG | HG3 | 108.2° | 109.7° |
HB2 | CB | HB3 | 110.4° | 111.9° |
CD | CG | HG2 | 108.2° | 109.7° |
CD | CG | HG3 | 108.1° | 109.7° |
CG | CD | OE1 | 118.6° | 118.3° |
CG | CD | NE2 | 118.2° | 123.4° |
HG2 | CG | HG3 | 110.7° | 109.8° |
OE1 | CD | NE2 | 123.1° | 118.3° |
CD | NE2 | N2 | 122.9° | 112.2° |
CD | NE2 | CD2 | 123.2° | 129.5° |
N2 | NE2 | CD2 | 113.8° | 118.3° |
NE2 | N2 | C2 | 123.1° | 112.9° |
NE2 | N2 | CA2 | 117.9° | 118.1° |
NE2 | CD2 | CG2 | 109.9° | 109.7° |
NE2 | CD2 | HD22 | 109.3° | 109.4° |
NE2 | CD2 | HD23 | 109.3° | 109.4° |
O2 | C2 | N2 | 121.5° | 117.7° |
C2 | N2 | CA2 | 119.0° | 129.0° |
N2 | CA2 | CB2 | 110.8° | 109.7° |
N2 | CA2 | C | 113.4° | 109.4° |
N2 | CA2 | HA2 | 106.7° | 109.4° |
CB2 | CA2 | C | 111.9° | 109.4° |
CB2 | CA2 | HA2 | 108.3° | 109.4° |
CA2 | CB2 | CG2 | 115.0° | 109.2° |
CA2 | CB2 | HB23 | 107.7° | 109.5° |
CA2 | CB2 | HB22 | 107.7° | 109.5° |
C | CA2 | HA2 | 105.3° | 109.4° |
CA2 | C | O | 120.6° | 120.0° |
CA2 | C | OXT | 116.7° | 120.0° |
CG2 | CB2 | HB23 | 107.7° | 109.5° |
CG2 | CB2 | HB22 | 107.7° | 109.5° |
CB2 | CG2 | CD2 | 110.0° | 109.1° |
CB2 | CG2 | HG23 | 109.3° | 109.6° |
CB2 | CG2 | HG22 | 109.3° | 109.6° |
HB23 | CB2 | HB22 | 111.2° | 109.5° |
CD2 | CG2 | HG23 | 109.3° | 109.5° |
CD2 | CG2 | HG22 | 109.3° | 109.5° |
CG2 | CD2 | HD22 | 109.3° | 109.4° |
CG2 | CD2 | HD23 | 109.3° | 109.4° |
HG23 | CG2 | HG22 | 109.7° | 109.5° |
HD22 | CD2 | HD23 | 109.6° | 109.4° |
O | C | OXT | 122.1° | 120.0° |
C | OXT | HXT | 109.5° | 117.0° |
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 | CB | C2 | 116.1° | 119.6° |
N | CA | CB | HA | 121.5° | 120.7° |
N | CA | C2 | HA | 121.4° | 120.8° |
N | CA | CB | CG | 165.3° | 75.5° |
N | CA | CB | HB2 | 74.7° | 168.1° |
N | CA | CB | HB3 | 45.2° | 40.9° |
N | CA | C2 | O2 | 17.2° | 156.9° |
N | CA | C2 | N2 | 162.3° | 23.2° |
H | N | CA | CB | 180.0° | 54.9° |
H | N | CA | C2 | 59.3° | 173.3° |
H | N | CA | HA | 63.1° | 65.8° |
H2 | N | CA | CB | 60.0° | 178.9° |
H2 | N | CA | C2 | 60.7° | 62.7° |
H2 | N | CA | HA | 176.9° | 58.1° |
CB | CA | C2 | HA | 116.9° | 119.6° |
CA | CB | CG | HB2 | 120.0° | 116.4° |
CA | CB | CG | HB3 | 120.0° | 116.4° |
CA | CB | HB2 | HB3 | 118.7° | 127.4° |
CA | CB | CG | CD | 36.7° | 44.4° |
CA | CB | CG | HG2 | 156.8° | 75.2° |
CA | CB | CG | HG3 | 83.2° | 164.0° |
CB | CA | C2 | O2 | 104.5° | 83.5° |
CB | CA | C2 | N2 | 76.0° | 96.4° |
C2 | CA | CB | CG | 49.2° | 44.1° |
C2 | CA | CB | HB2 | 169.2° | 72.2° |
C2 | CA | CB | HB3 | 70.9° | 160.5° |
CA | C2 | N2 | NE2 | 2.8° | 13.5° |
CA | C2 | O2 | N2 | 179.5° | 180.0° |
CA | C2 | N2 | CA2 | 177.7° | 167.3° |
HA | CA | CB | CG | 73.3° | 163.7° |
HA | CA | CB | HB2 | 46.7° | 47.4° |
HA | CA | CB | HB3 | 166.7° | 79.8° |
HA | CA | C2 | O2 | 138.6° | 36.1° |
HA | CA | C2 | N2 | 40.9° | 144.0° |
CG | CB | HB2 | HB3 | 118.7° | 127.4° |
CB | CG | CD | HG2 | 120.0° | 119.7° |
CB | CG | CD | HG3 | 120.0° | 119.6° |
CB | CG | HG2 | HG3 | 118.4° | 120.7° |
CB | CG | CD | OE1 | 106.3° | 80.8° |
CB | CG | CD | NE2 | 71.5° | 99.2° |
HB2 | CB | CG | CD | 83.3° | 160.8° |
HB2 | CB | CG | HG2 | 36.7° | 41.2° |
HB2 | CB | CG | HG3 | 156.7° | 79.6° |
HB3 | CB | CG | CD | 156.7° | 72.0° |
HB3 | CB | CG | HG2 | 83.2° | 168.3° |
HB3 | CB | CG | HG3 | 36.8° | 47.6° |
CD | CG | HG2 | HG3 | 118.3° | 120.6° |
CG | CD | OE1 | NE2 | 177.6° | 180.0° |
CG | CD | NE2 | N2 | 5.0° | 16.2° |
CG | CD | NE2 | CD2 | 179.0° | 164.5° |
HG2 | CG | CD | OE1 | 13.7° | 159.5° |
HG2 | CG | CD | NE2 | 168.5° | 20.4° |
HG3 | CG | CD | OE1 | 133.7° | 38.8° |
HG3 | CG | CD | NE2 | 48.5° | 141.1° |
OE1 | CD | NE2 | N2 | 172.7° | 163.8° |
OE1 | CD | NE2 | CD2 | 3.3° | 15.5° |
CD | NE2 | N2 | CD2 | 176.4° | 179.4° |
CD | NE2 | N2 | C2 | 46.2° | 38.1° |
CD | NE2 | N2 | CA2 | 133.3° | 141.3° |
CD | NE2 | CD2 | CG2 | 128.0° | 137.1° |
CD | NE2 | CD2 | HD22 | 112.0° | 17.0° |
CD | NE2 | CD2 | HD23 | 8.0° | 102.9° |
NE2 | N2 | C2 | O2 | 177.7° | 166.5° |
NE2 | N2 | C2 | CA2 | 179.5° | 179.3° |
NE2 | N2 | CA2 | CB2 | 42.1° | 43.7° |
NE2 | N2 | CA2 | C | 84.8° | 163.7° |
NE2 | N2 | CA2 | HA2 | 159.7° | 76.4° |
N2 | NE2 | CD2 | CG2 | 55.6° | 43.6° |
N2 | NE2 | CD2 | HD22 | 64.3° | 163.7° |
N2 | NE2 | CD2 | HD23 | 175.6° | 76.4° |
CD2 | NE2 | N2 | C2 | 130.1° | 141.3° |
CD2 | NE2 | N2 | CA2 | 50.4° | 39.3° |
NE2 | CD2 | CG2 | CB2 | 56.2° | 56.0° |
NE2 | CD2 | CG2 | HD22 | 120.0° | 120.1° |
NE2 | CD2 | CG2 | HD23 | 120.0° | 120.1° |
NE2 | CD2 | CG2 | HG23 | 63.8° | 176.0° |
NE2 | CD2 | CG2 | HG22 | 176.2° | 63.9° |
NE2 | CD2 | HD22 | HD23 | 119.8° | 119.9° |
O2 | C2 | N2 | CA2 | 1.8° | 12.7° |
C2 | N2 | CA2 | CB2 | 138.4° | 137.1° |
C2 | N2 | CA2 | C | 94.7° | 17.1° |
C2 | N2 | CA2 | HA2 | 20.7° | 102.8° |
N2 | CA2 | CB2 | C | 127.7° | 120.0° |
N2 | CA2 | CB2 | HA2 | 116.7° | 120.1° |
N2 | CA2 | C | HA2 | 116.3° | 119.9° |
N2 | CA2 | CB2 | CG2 | 43.5° | 56.2° |
N2 | CA2 | CB2 | HB23 | 163.5° | 63.7° |
N2 | CA2 | CB2 | HB22 | 76.5° | 176.1° |
N2 | CA2 | C | O | 22.7° | 41.5° |
N2 | CA2 | C | OXT | 148.9° | 138.5° |
CB2 | CA2 | C | HA2 | 117.5° | 119.9° |
CA2 | CB2 | CG2 | HB23 | 120.0° | 119.9° |
CA2 | CB2 | CG2 | HB22 | 120.0° | 119.9° |
CA2 | CB2 | HB23 | HB22 | 117.8° | 120.1° |
CA2 | CB2 | CG2 | CD2 | 51.7° | 63.8° |
CA2 | CB2 | CG2 | HG23 | 68.3° | 176.3° |
CA2 | CB2 | CG2 | HG22 | 171.7° | 56.0° |
CB2 | CA2 | C | O | 103.5° | 78.8° |
CB2 | CA2 | C | OXT | 84.8° | 101.2° |
C | CA2 | CB2 | CG2 | 84.2° | 176.2° |
C | CA2 | CB2 | HB23 | 35.8° | 56.3° |
C | CA2 | CB2 | HB22 | 155.8° | 63.9° |
CA2 | C | O | OXT | 171.1° | 180.0° |
CA2 | C | OXT | HXT | 171.5° | 179.9° |
HA2 | CA2 | CB2 | CG2 | 160.1° | 63.9° |
HA2 | CA2 | CB2 | HB23 | 79.9° | 176.2° |
HA2 | CA2 | CB2 | HB22 | 40.2° | 56.0° |
HA2 | CA2 | C | O | 139.0° | 161.4° |
HA2 | CA2 | C | OXT | 32.6° | 18.7° |
CG2 | CB2 | HB23 | HB22 | 117.8° | 120.1° |
CB2 | CG2 | CD2 | HG23 | 120.0° | 120.0° |
CB2 | CG2 | CD2 | HG22 | 120.0° | 119.9° |
CB2 | CG2 | HG23 | HG22 | 119.8° | 120.2° |
CB2 | CG2 | CD2 | HD22 | 63.8° | 176.1° |
CB2 | CG2 | CD2 | HD23 | 176.2° | 64.0° |
HB23 | CB2 | CG2 | CD2 | 171.7° | 56.1° |
HB23 | CB2 | CG2 | HG23 | 51.7° | 63.8° |
HB23 | CB2 | CG2 | HG22 | 68.3° | 176.0° |
HB22 | CB2 | CG2 | CD2 | 68.2° | 176.3° |
HB22 | CB2 | CG2 | HG23 | 171.8° | 56.4° |
HB22 | CB2 | CG2 | HG22 | 51.7° | 63.9° |
CD2 | CG2 | HG23 | HG22 | 119.8° | 120.1° |
CG2 | CD2 | HD22 | HD23 | 119.8° | 119.9° |
HG23 | CG2 | CD2 | HD22 | 176.2° | 63.9° |
HG23 | CG2 | CD2 | HD23 | 56.2° | 55.9° |
HG22 | CG2 | CD2 | HD22 | 56.2° | 56.2° |
HG22 | CG2 | CD2 | HD23 | 63.8° | 176.1° |
O | C | OXT | HXT | 0.0° | 0.1° |