OMI
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CA | N | sing | 1.47Å | 1.54Å | |
CA | C | sing | 1.51Å | 1.42Å | |
CAA | N | sing | 1.47Å | 1.41Å | |
O | C | doub | 1.21Å | 1.25Å | |
N | CAJ | sing | 1.39Å | 1.32Å | |
C | CAI | sing | 1.47Å | 1.36Å | |
CAJ | CAI | doub | 1.40Å | 1.33Å | Aromatic |
CAJ | CAF | sing | 1.40Å | 1.32Å | Aromatic |
CAI | CAE | sing | 1.40Å | 1.35Å | Aromatic |
CAF | CAD | doub | 1.38Å | 1.41Å | Aromatic |
CAE | CAC | doub | 1.38Å | 1.39Å | Aromatic |
CAD | CAC | sing | 1.39Å | 1.37Å | Aromatic |
CA | H1 | sing | 1.09Å | 1.10Å | |
CA | H2 | sing | 1.09Å | 1.10Å | |
CAE | H3 | sing | 1.08Å | 1.08Å | |
CAC | H4 | sing | 1.08Å | 1.08Å | |
CAD | H5 | sing | 1.08Å | 1.08Å | |
CAF | H6 | sing | 1.08Å | 1.08Å | |
CAA | H7 | sing | 1.09Å | 1.10Å | |
CAA | H8 | sing | 1.09Å | 1.10Å | |
CAA | H9 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N | CA | C | 89.8° | 105.5° |
CA | N | CAA | 132.9° | 111.0° |
CA | N | CAJ | 108.3° | 109.3° |
N | CA | H1 | 114.2° | 110.2° |
N | CA | H2 | 114.1° | 110.2° |
CA | C | O | 127.4° | 127.3° |
CA | C | CAI | 108.6° | 105.4° |
C | CA | H1 | 114.2° | 110.3° |
C | CA | H2 | 114.1° | 110.2° |
CAA | N | CAJ | 118.4° | 111.0° |
N | CAA | H7 | 109.5° | 109.5° |
N | CAA | H8 | 109.5° | 109.5° |
N | CAA | H9 | 109.5° | 109.5° |
O | C | CAI | 123.3° | 127.4° |
N | CAJ | CAI | 105.4° | 110.9° |
N | CAJ | CAF | 134.1° | 130.0° |
C | CAI | CAJ | 107.3° | 108.9° |
C | CAI | CAE | 133.3° | 131.2° |
CAI | CAJ | CAF | 120.4° | 119.0° |
CAJ | CAI | CAE | 119.3° | 120.0° |
CAJ | CAF | CAD | 120.8° | 120.3° |
CAJ | CAF | H6 | 119.6° | 119.9° |
CAI | CAE | CAC | 124.2° | 119.9° |
CAI | CAE | H3 | 117.9° | 120.1° |
CAF | CAD | CAC | 120.6° | 120.6° |
CAF | CAD | H5 | 119.7° | 119.7° |
CAD | CAF | H6 | 119.6° | 119.9° |
CAE | CAC | CAD | 114.6° | 120.2° |
CAC | CAE | H3 | 117.9° | 120.1° |
CAE | CAC | H4 | 122.7° | 119.9° |
CAD | CAC | H4 | 122.7° | 119.9° |
CAC | CAD | H5 | 119.7° | 119.7° |
H1 | CA | H2 | 109.5° | 110.3° |
H7 | CAA | H8 | 109.5° | 109.5° |
H7 | CAA | H9 | 109.5° | 109.5° |
H8 | CAA | H9 | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N | CA | C | H1 | 116.5° | 119.0° |
N | CA | C | H2 | 116.5° | 119.0° |
CA | N | CAA | CAJ | 171.3° | 121.8° |
N | CA | C | O | 129.8° | 180.0° |
N | CA | C | CAI | 41.2° | 0.0° |
CA | N | CAJ | CAI | 27.0° | 0.0° |
CA | N | CAJ | CAF | 156.8° | 180.0° |
N | CA | H1 | H2 | 129.3° | 121.9° |
CA | N | CAA | H7 | 180.0° | 60.1° |
CA | N | CAA | H8 | 60.0° | 179.8° |
CA | N | CAA | H9 | 60.0° | 59.9° |
C | CA | N | CAA | 130.6° | 122.7° |
CA | C | O | CAI | 169.8° | 180.0° |
C | CA | N | CAJ | 41.3° | 0.0° |
CA | C | CAI | CAJ | 31.3° | 0.0° |
CA | C | CAI | CAE | 151.7° | 180.0° |
C | CA | H1 | H2 | 129.3° | 122.0° |
CAA | N | CAJ | CAI | 146.3° | 122.7° |
CAA | N | CAJ | CAF | 29.9° | 57.3° |
CAA | N | CA | H1 | 14.1° | 118.2° |
CAA | N | CA | H2 | 112.9° | 3.7° |
N | CAA | H7 | H8 | 120.0° | 120.0° |
N | CAA | H7 | H9 | 120.0° | 120.0° |
N | CAA | H8 | H9 | 120.0° | 120.0° |
O | C | CAI | CAJ | 140.1° | 180.0° |
O | C | CAI | CAE | 36.9° | 0.0° |
O | C | CA | H1 | 13.2° | 61.0° |
O | C | CA | H2 | 113.7° | 61.0° |
N | CAJ | CAI | C | 1.0° | 0.0° |
N | CAJ | CAI | CAF | 176.9° | 180.0° |
N | CAJ | CAI | CAE | 178.5° | 180.0° |
N | CAJ | CAF | CAD | 177.8° | 180.0° |
CAJ | N | CA | H1 | 157.9° | 119.0° |
CAJ | N | CA | H2 | 75.2° | 119.0° |
N | CAJ | CAF | H6 | 2.1° | 0.1° |
CAJ | N | CAA | H7 | 8.7° | 61.6° |
CAJ | N | CAA | H8 | 128.7° | 58.4° |
CAJ | N | CAA | H9 | 111.3° | 178.4° |
C | CAI | CAJ | CAE | 177.5° | 180.0° |
C | CAI | CAJ | CAF | 175.9° | 180.0° |
C | CAI | CAE | CAC | 176.0° | 180.0° |
CAI | C | CA | H1 | 157.7° | 119.0° |
CAI | C | CA | H2 | 75.3° | 119.0° |
C | CAI | CAE | H3 | 4.0° | 0.0° |
CAI | CAJ | CAF | CAD | 2.1° | 0.0° |
CAJ | CAI | CAE | CAC | 0.8° | 0.1° |
CAJ | CAI | CAE | H3 | 179.2° | 180.0° |
CAI | CAJ | CAF | H6 | 177.9° | 179.9° |
CAF | CAJ | CAI | CAE | 1.6° | 0.0° |
CAJ | CAF | CAD | H6 | 180.0° | 179.9° |
CAJ | CAF | CAD | CAC | 1.6° | 0.0° |
CAJ | CAF | CAD | H5 | 178.4° | 180.0° |
CAI | CAE | CAC | H3 | 180.0° | 180.0° |
CAI | CAE | CAC | CAD | 0.3° | 0.1° |
CAI | CAE | CAC | H4 | 179.7° | 180.0° |
CAF | CAD | CAC | CAE | 0.7° | 0.0° |
CAF | CAD | CAC | H5 | 180.0° | 180.0° |
CAF | CAD | CAC | H4 | 179.3° | 180.0° |
CAE | CAC | CAD | H4 | 180.0° | 179.9° |
CAE | CAC | CAD | H5 | 179.3° | 180.0° |
CAD | CAC | CAE | H3 | 179.6° | 180.0° |
CAC | CAD | CAF | H6 | 178.4° | 179.9° |
H3 | CAE | CAC | H4 | 0.4° | 0.0° |
H4 | CAC | CAD | H5 | 0.7° | 0.1° |
H5 | CAD | CAF | H6 | 1.7° | 0.1° |
H7 | CAA | H8 | H9 | 120.0° | 120.0° |