DGF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAH | CAW | sing | 1.43Å | 1.43Å | |
| SAQ | CAZ | sing | 1.84Å | 1.76Å | |
| SAQ | CAV | sing | 1.84Å | 1.66Å | |
| CAZ | NAN | sing | 1.47Å | 1.48Å | |
| CAZ | CBA | sing | 1.53Å | 1.53Å | |
| CAI | CAK | sing | 1.55Å | 1.52Å | |
| CAI | CAJ | sing | 1.54Å | 1.52Å | |
| NAN | CAU | doub | 1.26Å | 1.35Å | |
| CAC | CAW | sing | 1.53Å | 1.53Å | |
| CAK | CAY | sing | 1.55Å | 1.52Å | |
| CAV | CAU | sing | 1.52Å | 1.33Å | |
| CAV | CAY | sing | 1.53Å | 1.52Å | |
| CAU | CAS | sing | 1.48Å | 1.33Å | |
| CAW | CBA | sing | 1.53Å | 1.53Å | |
| OAP | CAJ | sing | 1.43Å | 1.43Å | |
| OAP | CAY | sing | 1.44Å | 1.43Å | |
| CAS | OAG | doub | 1.21Å | 1.25Å | |
| CAS | OAE | sing | 1.35Å | 1.25Å | |
| CBA | CAT | sing | 1.51Å | 1.53Å | |
| CAT | OAF | doub | 1.21Å | 1.23Å | |
| CAK | H1 | sing | 1.09Å | 1.10Å | |
| CAK | H2 | sing | 1.09Å | 1.10Å | |
| CAI | H3 | sing | 1.09Å | 1.10Å | |
| CAI | H4 | sing | 1.09Å | 1.10Å | |
| CAJ | H5 | sing | 1.09Å | 1.10Å | |
| CAJ | H6 | sing | 1.09Å | 1.10Å | |
| CAY | H7 | sing | 1.09Å | 1.10Å | |
| OAE | H8 | sing | 0.97Å | 0.95Å | |
| CAZ | H10 | sing | 1.09Å | 1.10Å | |
| CBA | H11 | sing | 1.09Å | 1.10Å | |
| CAW | H12 | sing | 1.09Å | 1.10Å | |
| CAC | H13 | sing | 1.09Å | 1.10Å | |
| CAC | H14 | sing | 1.09Å | 1.10Å | |
| CAC | H15 | sing | 1.09Å | 1.10Å | |
| OAH | H16 | sing | 0.97Å | 0.95Å | |
| CAT | H17 | sing | 1.08Å | 1.08Å | |
| CAV | H18 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAH | CAW | CAC | 109.5° | 109.5° |
| OAH | CAW | CBA | 109.4° | 109.5° |
| OAH | CAW | H12 | 110.4° | 109.5° |
| CAW | OAH | H16 | 109.5° | 114.0° |
| CAZ | SAQ | CAV | 94.8° | 93.4° |
| SAQ | CAZ | NAN | 102.9° | 102.5° |
| SAQ | CAZ | CBA | 110.9° | 110.8° |
| SAQ | CAZ | H10 | 108.6° | 110.8° |
| SAQ | CAV | CAU | 110.0° | 101.7° |
| SAQ | CAV | CAY | 124.6° | 111.0° |
| SAQ | CAV | H18 | 90.4° | 111.0° |
| NAN | CAZ | CBA | 110.3° | 110.8° |
| CAZ | NAN | CAU | 111.0° | 119.3° |
| NAN | CAZ | H10 | 112.3° | 110.8° |
| CAZ | CBA | CAW | 109.7° | 109.4° |
| CAZ | CBA | CAT | 108.5° | 109.5° |
| CBA | CAZ | H10 | 111.6° | 110.9° |
| CAZ | CBA | H11 | 109.8° | 109.5° |
| CAK | CAI | CAJ | 103.8° | 102.3° |
| CAI | CAK | CAY | 104.3° | 100.9° |
| CAI | CAK | H1 | 110.7° | 111.1° |
| CAI | CAK | H2 | 110.7° | 111.2° |
| CAK | CAI | H3 | 110.8° | 110.8° |
| CAK | CAI | H4 | 110.8° | 110.8° |
| CAI | CAJ | OAP | 103.6° | 107.6° |
| CAJ | CAI | H3 | 110.9° | 110.9° |
| CAJ | CAI | H4 | 110.9° | 110.9° |
| CAI | CAJ | H5 | 110.9° | 109.8° |
| CAI | CAJ | H6 | 110.9° | 109.8° |
| NAN | CAU | CAV | 117.2° | 117.5° |
| NAN | CAU | CAS | 123.5° | 121.2° |
| CAC | CAW | CBA | 109.6° | 109.5° |
| CAC | CAW | H12 | 109.0° | 109.5° |
| CAW | CAC | H13 | 109.5° | 109.5° |
| CAW | CAC | H14 | 109.5° | 109.5° |
| CAW | CAC | H15 | 109.5° | 109.5° |
| CAK | CAY | CAV | 109.3° | 110.3° |
| CAK | CAY | OAP | 104.1° | 105.2° |
| CAY | CAK | H1 | 110.8° | 111.1° |
| CAY | CAK | H2 | 110.8° | 111.2° |
| CAK | CAY | H7 | 110.9° | 110.3° |
| CAU | CAV | CAY | 125.4° | 111.0° |
| CAV | CAU | CAS | 119.3° | 121.3° |
| CAU | CAV | H18 | 90.5° | 111.0° |
| CAV | CAY | OAP | 109.2° | 110.3° |
| CAV | CAY | H7 | 110.9° | 110.3° |
| CAY | CAV | H18 | 90.4° | 110.9° |
| CAU | CAS | OAG | 119.9° | 120.0° |
| CAU | CAS | OAE | 120.4° | 120.0° |
| CAW | CBA | CAT | 109.3° | 109.5° |
| CAW | CBA | H11 | 109.8° | 109.5° |
| CBA | CAW | H12 | 109.0° | 109.5° |
| CAJ | OAP | CAY | 104.2° | 110.0° |
| OAP | CAJ | H5 | 110.9° | 109.9° |
| OAP | CAJ | H6 | 110.9° | 109.9° |
| OAP | CAY | H7 | 112.2° | 110.3° |
| OAG | CAS | OAE | 119.8° | 120.0° |
| CAS | OAE | H8 | 109.5° | 117.0° |
| CBA | CAT | OAF | 121.1° | 120.0° |
| CAT | CBA | H11 | 109.8° | 109.5° |
| CBA | CAT | H17 | 119.4° | 120.0° |
| OAF | CAT | H17 | 119.4° | 120.0° |
| H1 | CAK | H2 | 109.5° | 111.0° |
| H3 | CAI | H4 | 109.5° | 110.9° |
| H5 | CAJ | H6 | 109.5° | 109.9° |
| H13 | CAC | H14 | 109.4° | 109.4° |
| H13 | CAC | H15 | 109.5° | 109.5° |
| H14 | CAC | H15 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAH | CAW | CBA | CAZ | 50.0° | 60.0° |
| OAH | CAW | CAC | CBA | 120.0° | 120.0° |
| OAH | CAW | CAC | H12 | 120.8° | 120.0° |
| OAH | CAW | CBA | H12 | 120.8° | 120.0° |
| OAH | CAW | CBA | CAT | 68.9° | 180.0° |
| OAH | CAW | CBA | H11 | 170.7° | 60.0° |
| OAH | CAW | CAC | H13 | 180.0° | 60.0° |
| OAH | CAW | CAC | H14 | 60.0° | 60.0° |
| OAH | CAW | CAC | H15 | 60.0° | 180.0° |
| SAQ | CAZ | NAN | CBA | 118.3° | 118.2° |
| SAQ | CAZ | NAN | H10 | 116.6° | 118.2° |
| SAQ | CAZ | CBA | H10 | 121.2° | 123.5° |
| SAQ | CAZ | NAN | CAU | 20.6° | 16.0° |
| CAZ | SAQ | CAV | CAU | 10.0° | 20.5° |
| CAZ | SAQ | CAV | CAY | 168.6° | 138.6° |
| SAQ | CAZ | CBA | CAW | 104.2° | 65.0° |
| SAQ | CAZ | CBA | CAT | 136.4° | 175.0° |
| SAQ | CAZ | CBA | H11 | 16.5° | 54.9° |
| CAZ | SAQ | CAV | H18 | 100.6° | 97.6° |
| CAV | SAQ | CAZ | NAN | 17.1° | 20.8° |
| CAV | SAQ | CAZ | CBA | 100.8° | 139.0° |
| SAQ | CAV | CAU | NAN | 1.8° | 15.9° |
| SAQ | CAV | CAY | CAK | 118.5° | 62.8° |
| SAQ | CAV | CAU | CAY | 178.6° | 118.1° |
| SAQ | CAV | CAU | H18 | 90.6° | 118.1° |
| SAQ | CAV | CAY | H18 | 90.8° | 123.9° |
| SAQ | CAV | CAU | CAS | 179.9° | 164.2° |
| SAQ | CAV | CAY | OAP | 5.2° | 53.0° |
| SAQ | CAV | CAY | H7 | 118.9° | 175.1° |
| CAV | SAQ | CAZ | H10 | 136.3° | 97.5° |
| NAN | CAZ | CBA | H10 | 125.6° | 123.5° |
| CAZ | NAN | CAU | CAV | 15.7° | 0.0° |
| CAZ | NAN | CAU | CAS | 166.0° | 179.9° |
| NAN | CAZ | CBA | CAW | 142.5° | 178.1° |
| NAN | CAZ | CBA | CAT | 23.2° | 61.9° |
| NAN | CAZ | CBA | H11 | 96.8° | 58.1° |
| CBA | CAZ | NAN | CAU | 97.7° | 134.2° |
| CAZ | CBA | CAW | CAC | 70.1° | 180.0° |
| CAZ | CBA | CAW | CAT | 118.8° | 120.0° |
| CAZ | CBA | CAW | H11 | 120.7° | 120.0° |
| CAZ | CBA | CAT | H11 | 119.9° | 120.0° |
| CAZ | CBA | CAT | OAF | 108.3° | 120.0° |
| CAZ | CBA | CAW | H12 | 170.7° | 60.0° |
| CAZ | CBA | CAT | H17 | 71.7° | 59.9° |
| CAK | CAI | CAJ | H3 | 119.1° | 118.2° |
| CAK | CAI | CAJ | H4 | 119.1° | 118.2° |
| CAI | CAK | CAY | H1 | 119.2° | 117.8° |
| CAI | CAK | CAY | H2 | 119.2° | 118.0° |
| CAI | CAK | CAY | CAV | 139.2° | 155.4° |
| CAK | CAI | CAJ | OAP | 28.9° | 21.3° |
| CAI | CAK | CAY | OAP | 22.6° | 36.4° |
| CAI | CAK | H1 | H2 | 122.4° | 124.3° |
| CAK | CAI | H3 | H4 | 122.6° | 123.5° |
| CAK | CAI | CAJ | H5 | 90.2° | 140.8° |
| CAK | CAI | CAJ | H6 | 148.0° | 98.3° |
| CAI | CAK | CAY | H7 | 98.2° | 82.6° |
| CAJ | CAI | CAK | CAY | 3.7° | 34.1° |
| CAI | CAJ | OAP | H5 | 119.1° | 119.5° |
| CAI | CAJ | OAP | H6 | 119.1° | 119.5° |
| CAI | CAJ | OAP | CAY | 44.6° | 1.7° |
| CAJ | CAI | CAK | H1 | 122.9° | 83.8° |
| CAJ | CAI | CAK | H2 | 115.5° | 152.1° |
| CAJ | CAI | H3 | H4 | 122.6° | 123.6° |
| CAI | CAJ | H5 | H6 | 122.7° | 120.9° |
| NAN | CAU | CAV | CAS | 178.3° | 179.9° |
| NAN | CAU | CAV | CAY | 179.7° | 134.0° |
| NAN | CAU | CAS | OAG | 1.1° | 180.0° |
| NAN | CAU | CAS | OAE | 179.2° | 0.1° |
| CAU | NAN | CAZ | H10 | 137.2° | 102.3° |
| NAN | CAU | CAV | H18 | 88.8° | 102.3° |
| CAC | CAW | CBA | H12 | 119.2° | 120.0° |
| CAC | CAW | CBA | CAT | 171.1° | 60.0° |
| CAC | CAW | CBA | H11 | 50.6° | 60.0° |
| CAW | CAC | H13 | H14 | 120.0° | 120.0° |
| CAW | CAC | H13 | H15 | 120.0° | 120.1° |
| CAW | CAC | H14 | H15 | 120.0° | 120.0° |
| CAC | CAW | OAH | H16 | 180.0° | 60.0° |
| CAK | CAY | CAV | CAU | 63.1° | 175.1° |
| CAK | CAY | CAV | OAP | 113.3° | 115.8° |
| CAK | CAY | CAV | H7 | 122.6° | 122.1° |
| CAK | CAY | OAP | CAJ | 42.1° | 24.4° |
| CAK | CAY | OAP | H7 | 120.0° | 118.9° |
| CAY | CAK | H1 | H2 | 122.4° | 124.3° |
| CAY | CAK | CAI | H3 | 122.9° | 84.1° |
| CAY | CAK | CAI | H4 | 115.3° | 152.3° |
| CAK | CAY | CAV | H18 | 27.7° | 61.1° |
| CAU | CAV | CAY | H18 | 90.9° | 123.8° |
| CAU | CAV | CAY | OAP | 176.4° | 59.3° |
| CAV | CAU | CAS | OAG | 179.4° | 0.1° |
| CAV | CAU | CAS | OAE | 1.0° | 180.0° |
| CAU | CAV | CAY | H7 | 59.4° | 62.9° |
| CAY | CAV | CAU | CAS | 1.3° | 46.1° |
| CAV | CAY | OAP | CAJ | 158.8° | 143.4° |
| CAV | CAY | OAP | H7 | 123.4° | 122.1° |
| CAV | CAY | CAK | H1 | 20.0° | 37.5° |
| CAV | CAY | CAK | H2 | 101.6° | 86.6° |
| CAU | CAS | OAG | OAE | 179.6° | 179.9° |
| CAU | CAS | OAE | H8 | 179.6° | 179.9° |
| CAS | CAU | CAV | H18 | 89.5° | 77.7° |
| CAW | CBA | CAT | H11 | 120.5° | 120.0° |
| CAW | CBA | CAT | OAF | 132.0° | 120.0° |
| CAW | CBA | CAZ | H10 | 16.9° | 58.4° |
| CBA | CAW | CAC | H13 | 59.9° | 60.0° |
| CBA | CAW | CAC | H14 | 60.0° | 180.0° |
| CBA | CAW | CAC | H15 | 180.0° | 60.0° |
| CBA | CAW | OAH | H16 | 59.9° | 60.0° |
| CAW | CBA | CAT | H17 | 48.0° | 60.0° |
| OAP | CAJ | CAI | H3 | 148.0° | 96.8° |
| OAP | CAJ | CAI | H4 | 90.2° | 139.5° |
| OAP | CAJ | H5 | H6 | 122.7° | 121.0° |
| CAJ | OAP | CAY | H7 | 77.9° | 94.5° |
| OAP | CAY | CAK | H1 | 96.5° | 81.4° |
| OAP | CAY | CAK | H2 | 141.8° | 154.4° |
| CAY | OAP | CAJ | H5 | 74.4° | 117.8° |
| CAY | OAP | CAJ | H6 | 163.7° | 121.3° |
| OAP | CAY | CAV | H18 | 85.6° | 176.9° |
| OAG | CAS | OAE | H8 | 0.0° | 0.0° |
| CBA | CAT | OAF | H17 | 180.0° | 179.9° |
| CAT | CBA | CAZ | H10 | 102.4° | 61.5° |
| CAT | CBA | CAW | H12 | 51.9° | 60.0° |
| OAF | CAT | CBA | H11 | 11.6° | 0.0° |
| H1 | CAK | CAI | H3 | 118.0° | 158.0° |
| H1 | CAK | CAI | H4 | 3.8° | 34.5° |
| H1 | CAK | CAY | H7 | 142.6° | 159.6° |
| H2 | CAK | CAI | H3 | 3.7° | 33.9° |
| H2 | CAK | CAI | H4 | 125.5° | 89.7° |
| H2 | CAK | CAY | H7 | 21.0° | 35.4° |
| H3 | CAI | CAJ | H5 | 28.9° | 22.7° |
| H3 | CAI | CAJ | H6 | 92.9° | 143.6° |
| H4 | CAI | CAJ | H5 | 150.8° | 101.0° |
| H4 | CAI | CAJ | H6 | 28.9° | 19.9° |
| H7 | CAY | CAV | H18 | 150.3° | 60.9° |
| H10 | CAZ | CBA | H11 | 137.6° | 178.4° |
| H11 | CBA | CAW | H12 | 68.6° | 180.0° |
| H11 | CBA | CAT | H17 | 168.4° | 180.0° |
| H12 | CAW | CAC | H13 | 59.2° | 179.9° |
| H12 | CAW | CAC | H14 | 179.2° | 60.0° |
| H12 | CAW | CAC | H15 | 60.8° | 60.0° |
| H12 | CAW | OAH | H16 | 60.0° | 180.0° |
| H13 | CAC | H14 | H15 | 120.0° | 119.9° |
