4NG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAG | CAA | doub | 1.21Å | 1.23Å | |
| CAA | CAE | sing | 1.51Å | 1.39Å | |
| CAA | NAB | sing | 1.34Å | 1.33Å | |
| CAE | CAD | sing | 1.55Å | 1.52Å | |
| CAE | PAI | sing | 1.82Å | 1.82Å | |
| OAK | PAI | doub | 1.48Å | 1.62Å | |
| CAD | CAC | sing | 1.54Å | 1.51Å | |
| NAB | OAF | sing | 1.42Å | 1.42Å | |
| NAB | CAC | sing | 1.47Å | 1.48Å | |
| PAI | OAL | sing | 1.61Å | 1.48Å | |
| PAI | OAJ | sing | 1.61Å | 1.62Å | |
| OAH | CAC | sing | 1.43Å | 1.43Å | |
| CAC | H1 | sing | 1.09Å | 1.10Å | |
| CAD | H2 | sing | 1.09Å | 1.10Å | |
| CAD | H3 | sing | 1.09Å | 1.10Å | |
| CAE | H4 | sing | 1.09Å | 1.10Å | |
| OAF | H5 | sing | 0.97Å | 0.95Å | |
| OAH | H6 | sing | 0.97Å | 0.95Å | |
| OAJ | H7 | sing | 0.97Å | 0.95Å | |
| OAL | H8 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAG | CAA | CAE | 123.4° | 124.9° |
| OAG | CAA | NAB | 123.5° | 124.9° |
| CAE | CAA | NAB | 113.2° | 110.1° |
| CAA | CAE | CAD | 104.7° | 104.2° |
| CAA | CAE | PAI | 109.5° | 110.5° |
| CAA | CAE | H4 | 113.6° | 110.5° |
| CAA | NAB | OAF | 125.4° | 124.4° |
| CAA | NAB | CAC | 109.2° | 111.3° |
| CAD | CAE | PAI | 109.5° | 110.5° |
| CAE | CAD | CAC | 103.0° | 101.8° |
| CAE | CAD | H2 | 111.0° | 111.0° |
| CAE | CAD | H3 | 111.0° | 111.0° |
| CAD | CAE | H4 | 111.6° | 110.5° |
| CAE | PAI | OAK | 105.4° | 109.5° |
| CAE | PAI | OAL | 113.3° | 109.5° |
| CAE | PAI | OAJ | 105.4° | 109.5° |
| PAI | CAE | H4 | 107.8° | 110.5° |
| OAK | PAI | OAL | 113.3° | 109.5° |
| OAK | PAI | OAJ | 105.4° | 109.5° |
| CAD | CAC | NAB | 103.2° | 105.5° |
| CAD | CAC | OAH | 109.5° | 110.2° |
| CAD | CAC | H1 | 110.8° | 110.2° |
| CAC | CAD | H2 | 111.1° | 111.0° |
| CAC | CAD | H3 | 111.1° | 111.0° |
| OAF | NAB | CAC | 125.4° | 124.4° |
| NAB | OAF | H5 | 109.5° | 114.1° |
| NAB | CAC | OAH | 109.5° | 110.3° |
| NAB | CAC | H1 | 111.3° | 110.3° |
| OAL | PAI | OAJ | 113.3° | 109.5° |
| PAI | OAL | H8 | 109.5° | 114.0° |
| PAI | OAJ | H7 | 109.5° | 114.0° |
| OAH | CAC | H1 | 112.1° | 110.2° |
| CAC | OAH | H6 | 109.5° | 114.0° |
| H2 | CAD | H3 | 109.5° | 110.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAG | CAA | CAE | NAB | 179.9° | 179.8° |
| OAG | CAA | CAE | CAD | 164.1° | 163.5° |
| OAG | CAA | CAE | PAI | 78.6° | 44.8° |
| OAG | CAA | NAB | OAF | 0.1° | 0.3° |
| OAG | CAA | NAB | CAC | 180.0° | 179.9° |
| OAG | CAA | CAE | H4 | 42.1° | 77.8° |
| CAA | CAE | CAD | PAI | 117.4° | 118.6° |
| CAA | CAE | CAD | H4 | 123.3° | 118.7° |
| CAA | CAE | PAI | H4 | 124.1° | 122.6° |
| CAA | CAE | PAI | OAK | 59.9° | 178.5° |
| CAA | CAE | CAD | CAC | 24.5° | 24.8° |
| CAE | CAA | NAB | OAF | 180.0° | 179.5° |
| CAE | CAA | NAB | CAC | 0.0° | 0.3° |
| CAA | CAE | PAI | OAL | 175.7° | 61.5° |
| CAA | CAE | PAI | OAJ | 51.2° | 58.5° |
| CAA | CAE | CAD | H2 | 94.5° | 93.3° |
| CAA | CAE | CAD | H3 | 143.5° | 143.0° |
| NAB | CAA | CAE | CAD | 16.0° | 16.3° |
| NAB | CAA | CAE | PAI | 101.4° | 135.0° |
| CAA | NAB | CAC | CAD | 15.8° | 17.0° |
| CAA | NAB | OAF | CAC | 179.9° | 179.9° |
| CAA | NAB | CAC | OAH | 132.4° | 102.1° |
| CAA | NAB | CAC | H1 | 103.1° | 136.0° |
| NAB | CAA | CAE | H4 | 138.0° | 102.4° |
| CAA | NAB | OAF | H5 | 0.0° | 0.1° |
| CAD | CAE | PAI | H4 | 121.6° | 122.7° |
| CAD | CAE | PAI | OAK | 174.2° | 63.8° |
| CAE | CAD | CAC | H2 | 118.9° | 118.1° |
| CAE | CAD | CAC | H3 | 118.9° | 118.1° |
| CAE | CAD | CAC | NAB | 24.0° | 25.4° |
| CAD | CAE | PAI | OAL | 61.4° | 176.2° |
| CAD | CAE | PAI | OAJ | 63.1° | 56.2° |
| CAE | CAD | CAC | OAH | 140.6° | 93.7° |
| CAE | CAD | CAC | H1 | 95.2° | 144.4° |
| CAE | CAD | H2 | H3 | 123.0° | 123.8° |
| CAE | PAI | OAK | OAL | 124.4° | 120.0° |
| CAE | PAI | OAK | OAJ | 111.1° | 120.0° |
| PAI | CAE | CAD | CAC | 92.9° | 143.5° |
| CAE | PAI | OAL | OAJ | 120.0° | 120.0° |
| PAI | CAE | CAD | H2 | 148.2° | 25.3° |
| PAI | CAE | CAD | H3 | 26.1° | 98.4° |
| CAE | PAI | OAJ | H7 | 111.1° | 59.9° |
| CAE | PAI | OAL | H8 | 120.0° | 180.0° |
| OAK | PAI | OAL | OAJ | 120.0° | 120.0° |
| OAK | PAI | CAE | H4 | 64.2° | 58.9° |
| OAK | PAI | OAJ | H7 | 0.0° | 179.9° |
| OAK | PAI | OAL | H8 | 0.0° | 60.0° |
| CAD | CAC | NAB | OAF | 164.1° | 162.9° |
| CAD | CAC | NAB | OAH | 116.5° | 119.0° |
| CAD | CAC | NAB | H1 | 118.9° | 119.0° |
| CAD | CAC | OAH | H1 | 123.4° | 121.9° |
| CAC | CAD | H2 | H3 | 123.0° | 123.8° |
| CAC | CAD | CAE | H4 | 147.8° | 93.9° |
| CAD | CAC | OAH | H6 | 180.0° | 178.7° |
| OAF | NAB | CAC | OAH | 47.5° | 78.1° |
| OAF | NAB | CAC | H1 | 77.0° | 43.9° |
| NAB | CAC | OAH | H1 | 124.1° | 122.0° |
| NAB | CAC | CAD | H2 | 94.9° | 92.7° |
| NAB | CAC | CAD | H3 | 143.0° | 143.6° |
| CAC | NAB | OAF | H5 | 179.9° | 180.0° |
| NAB | CAC | OAH | H6 | 67.4° | 62.6° |
| OAL | PAI | CAE | H4 | 60.2° | 61.1° |
| OAL | PAI | OAJ | H7 | 124.4° | 60.0° |
| OAJ | PAI | CAE | H4 | 175.3° | 178.9° |
| OAJ | PAI | OAL | H8 | 120.0° | 60.0° |
| OAH | CAC | CAD | H2 | 21.6° | 148.2° |
| OAH | CAC | CAD | H3 | 100.5° | 24.5° |
| H1 | CAC | CAD | H2 | 145.8° | 26.3° |
| H1 | CAC | CAD | H3 | 23.7° | 97.4° |
| H1 | CAC | OAH | H6 | 56.6° | 59.4° |
| H2 | CAD | CAE | H4 | 28.9° | 148.0° |
| H3 | CAD | CAE | H4 | 93.2° | 24.3° |
