EAT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAC | CAA | sing | 1.43Å | 1.40Å | |
| OAD | CAG | sing | 1.43Å | 1.45Å | |
| CAA | CAG | sing | 1.55Å | 1.53Å | |
| CAA | CAF | sing | 1.55Å | 1.53Å | |
| CAE | CAG | sing | 1.54Å | 1.49Å | |
| CAE | NAH | sing | 1.48Å | 1.57Å | |
| CAE | CAP | sing | 1.51Å | 1.56Å | |
| CAB | CAF | sing | 1.53Å | 1.52Å | |
| NAH | CAF | sing | 1.48Å | 1.47Å | |
| NAQ | CAP | sing | 1.36Å | 1.34Å | Aromatic |
| NAQ | CAM | sing | 1.38Å | 1.35Å | Aromatic |
| CAP | NAO | doub | 1.30Å | 1.31Å | Aromatic |
| CAM | CAN | sing | 1.39Å | 1.36Å | Aromatic |
| CAM | CAL | doub | 1.41Å | 1.34Å | Aromatic |
| CAN | CAI | doub | 1.38Å | 1.41Å | Aromatic |
| NAO | CAL | sing | 1.36Å | 1.33Å | Aromatic |
| CAL | CAK | sing | 1.40Å | 1.35Å | Aromatic |
| CAI | CAJ | sing | 1.39Å | 1.39Å | Aromatic |
| CAK | CAJ | doub | 1.37Å | 1.40Å | Aromatic |
| OAD | H1 | sing | 0.97Å | 0.95Å | |
| CAG | H2 | sing | 1.09Å | 1.10Å | |
| CAA | H3 | sing | 1.09Å | 1.10Å | |
| OAC | H4 | sing | 0.97Å | 0.95Å | |
| CAF | H5 | sing | 1.09Å | 1.10Å | |
| CAB | H6 | sing | 1.09Å | 1.10Å | |
| CAB | H7 | sing | 1.09Å | 1.10Å | |
| CAB | H8 | sing | 1.09Å | 1.10Å | |
| NAH | H9 | sing | 1.01Å | 1.00Å | |
| CAE | H11 | sing | 1.09Å | 1.10Å | |
| NAQ | H12 | sing | 0.97Å | 1.00Å | |
| CAN | H13 | sing | 1.08Å | 1.08Å | |
| CAI | H14 | sing | 1.08Å | 1.08Å | |
| CAJ | H15 | sing | 1.08Å | 1.08Å | |
| CAK | H16 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAC | CAA | CAG | 112.0° | 111.0° |
| OAC | CAA | CAF | 111.9° | 111.0° |
| OAC | CAA | H3 | 111.9° | 110.9° |
| CAA | OAC | H4 | 109.5° | 113.9° |
| OAD | CAG | CAA | 116.0° | 110.7° |
| OAD | CAG | CAE | 111.7° | 110.7° |
| CAG | OAD | H1 | 109.5° | 114.0° |
| OAD | CAG | H2 | 110.2° | 110.6° |
| CAG | CAA | CAF | 100.6° | 101.7° |
| CAA | CAG | CAE | 99.7° | 103.2° |
| CAA | CAG | H2 | 109.2° | 110.7° |
| CAG | CAA | H3 | 109.9° | 111.0° |
| CAA | CAF | CAB | 110.8° | 110.4° |
| CAA | CAF | NAH | 101.4° | 104.8° |
| CAF | CAA | H3 | 110.0° | 111.0° |
| CAA | CAF | H5 | 108.4° | 110.4° |
| CAG | CAE | NAH | 104.1° | 107.1° |
| CAG | CAE | CAP | 113.6° | 109.9° |
| CAE | CAG | H2 | 109.7° | 110.7° |
| CAG | CAE | H11 | 110.3° | 109.9° |
| NAH | CAE | CAP | 109.9° | 110.0° |
| CAE | NAH | CAF | 106.4° | 108.6° |
| CAE | NAH | H9 | 110.3° | 110.9° |
| NAH | CAE | H11 | 109.2° | 109.8° |
| CAE | CAP | NAQ | 128.3° | 125.0° |
| CAE | CAP | NAO | 122.5° | 124.9° |
| CAP | CAE | H11 | 109.5° | 110.0° |
| CAB | CAF | NAH | 117.9° | 110.5° |
| CAB | CAF | H5 | 108.6° | 110.4° |
| CAF | CAB | H6 | 109.5° | 109.5° |
| CAF | CAB | H7 | 109.5° | 109.5° |
| CAF | CAB | H8 | 109.4° | 109.5° |
| NAH | CAF | H5 | 109.3° | 110.3° |
| CAF | NAH | H9 | 110.2° | 111.0° |
| CAP | NAQ | CAM | 106.7° | 107.3° |
| NAQ | CAP | NAO | 109.0° | 110.1° |
| CAP | NAQ | H12 | 126.6° | 126.3° |
| NAQ | CAM | CAN | 133.0° | 134.2° |
| NAQ | CAM | CAL | 107.8° | 106.0° |
| CAM | NAQ | H12 | 126.7° | 126.3° |
| CAP | NAO | CAL | 108.6° | 109.7° |
| CAN | CAM | CAL | 119.2° | 119.8° |
| CAM | CAN | CAI | 121.3° | 119.7° |
| CAM | CAN | H13 | 119.3° | 120.1° |
| CAM | CAL | NAO | 107.8° | 106.9° |
| CAM | CAL | CAK | 121.9° | 119.5° |
| CAN | CAI | CAJ | 118.6° | 120.5° |
| CAI | CAN | H13 | 119.3° | 120.2° |
| CAN | CAI | H14 | 120.7° | 119.7° |
| NAO | CAL | CAK | 130.2° | 133.6° |
| CAL | CAK | CAJ | 121.3° | 119.9° |
| CAL | CAK | H16 | 119.4° | 120.1° |
| CAI | CAJ | CAK | 117.7° | 120.7° |
| CAJ | CAI | H14 | 120.7° | 119.8° |
| CAI | CAJ | H15 | 121.1° | 119.7° |
| CAK | CAJ | H15 | 121.1° | 119.6° |
| CAJ | CAK | H16 | 119.4° | 120.0° |
| H6 | CAB | H7 | 109.5° | 109.5° |
| H6 | CAB | H8 | 109.5° | 109.5° |
| H7 | CAB | H8 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAC | CAA | CAG | OAD | 52.5° | 35.9° |
| OAC | CAA | CAG | CAF | 119.0° | 118.1° |
| OAC | CAA | CAG | H3 | 125.0° | 123.8° |
| OAC | CAA | CAF | H3 | 125.0° | 123.8° |
| OAC | CAA | CAG | CAE | 67.4° | 82.5° |
| OAC | CAA | CAF | CAB | 54.7° | 37.9° |
| OAC | CAA | CAF | NAH | 71.3° | 81.1° |
| OAC | CAA | CAG | H2 | 177.6° | 159.0° |
| OAC | CAA | CAF | H5 | 173.7° | 160.2° |
| OAD | CAG | CAA | CAE | 120.0° | 118.5° |
| OAD | CAG | CAA | H2 | 125.1° | 123.0° |
| OAD | CAG | CAA | CAF | 171.6° | 154.1° |
| OAD | CAG | CAE | H2 | 122.4° | 123.0° |
| OAD | CAG | CAE | NAH | 158.2° | 140.5° |
| OAD | CAG | CAE | CAP | 82.3° | 99.9° |
| OAD | CAG | CAA | H3 | 72.5° | 87.9° |
| OAD | CAG | CAE | H11 | 41.1° | 21.3° |
| CAG | CAA | CAF | H3 | 115.9° | 118.1° |
| CAA | CAG | CAE | H2 | 114.5° | 118.5° |
| CAA | CAG | CAE | NAH | 35.1° | 22.1° |
| CAA | CAG | CAE | CAP | 154.6° | 141.6° |
| CAG | CAA | CAF | CAB | 173.7° | 156.0° |
| CAG | CAA | CAF | NAH | 47.7° | 37.1° |
| CAA | CAG | OAD | H1 | 180.0° | 63.8° |
| CAG | CAA | OAC | H4 | 180.0° | 61.4° |
| CAG | CAA | CAF | H5 | 67.2° | 81.7° |
| CAA | CAG | CAE | H11 | 82.0° | 97.2° |
| CAF | CAA | CAG | CAE | 51.6° | 35.6° |
| CAA | CAF | NAH | CAE | 25.4° | 24.2° |
| CAA | CAF | CAB | NAH | 116.1° | 115.4° |
| CAA | CAF | CAB | H5 | 119.0° | 122.3° |
| CAA | CAF | NAH | H5 | 114.3° | 118.8° |
| CAF | CAA | CAG | H2 | 63.3° | 82.9° |
| CAF | CAA | OAC | H4 | 67.9° | 173.8° |
| CAA | CAF | CAB | H6 | 180.0° | 60.0° |
| CAA | CAF | CAB | H7 | 60.0° | 180.0° |
| CAA | CAF | CAB | H8 | 60.0° | 60.0° |
| CAA | CAF | NAH | H9 | 144.9° | 146.4° |
| CAG | CAE | NAH | CAP | 122.0° | 119.4° |
| CAG | CAE | NAH | H11 | 117.8° | 119.3° |
| CAG | CAE | CAP | H11 | 123.9° | 121.2° |
| CAG | CAE | NAH | CAF | 6.4° | 1.2° |
| CAG | CAE | CAP | NAQ | 124.7° | 125.3° |
| CAG | CAE | CAP | NAO | 59.7° | 55.0° |
| CAE | CAG | OAD | H1 | 66.8° | 177.7° |
| CAE | CAG | CAA | H3 | 167.5° | 153.7° |
| CAG | CAE | NAH | H9 | 113.2° | 123.5° |
| NAH | CAE | CAP | H11 | 120.0° | 121.1° |
| CAE | NAH | CAF | CAB | 146.5° | 143.1° |
| CAE | NAH | CAF | H9 | 119.5° | 122.2° |
| NAH | CAE | CAP | NAQ | 119.2° | 117.0° |
| NAH | CAE | CAP | NAO | 56.4° | 62.7° |
| NAH | CAE | CAG | H2 | 79.4° | 96.4° |
| CAE | NAH | CAF | H5 | 89.0° | 94.6° |
| CAP | CAE | NAH | CAF | 128.4° | 118.2° |
| CAE | CAP | NAQ | NAO | 176.1° | 179.7° |
| CAE | CAP | NAQ | CAM | 175.5° | 180.0° |
| CAE | CAP | NAO | CAL | 176.5° | 179.8° |
| CAP | CAE | CAG | H2 | 40.1° | 23.1° |
| CAP | CAE | NAH | H9 | 8.8° | 4.0° |
| CAE | CAP | NAQ | H12 | 4.5° | 0.1° |
| CAB | CAF | NAH | H5 | 124.6° | 122.3° |
| CAB | CAF | CAA | H3 | 70.3° | 85.9° |
| CAF | CAB | H6 | H7 | 120.0° | 120.0° |
| CAF | CAB | H6 | H8 | 120.0° | 120.0° |
| CAF | CAB | H7 | H8 | 120.0° | 120.0° |
| CAB | CAF | NAH | H9 | 94.0° | 94.7° |
| NAH | CAF | CAA | H3 | 163.7° | 155.2° |
| NAH | CAF | CAB | H6 | 63.9° | 175.4° |
| NAH | CAF | CAB | H7 | 56.1° | 64.6° |
| NAH | CAF | CAB | H8 | 176.1° | 55.4° |
| CAF | NAH | CAE | H11 | 111.5° | 120.5° |
| CAP | NAQ | CAM | H12 | 180.0° | 179.9° |
| CAP | NAQ | CAM | CAN | 178.7° | 180.0° |
| CAP | NAQ | CAM | CAL | 1.1° | 0.1° |
| NAQ | CAP | NAO | CAL | 0.2° | 0.5° |
| NAQ | CAP | CAE | H11 | 0.8° | 4.2° |
| CAM | NAQ | CAP | NAO | 0.6° | 0.3° |
| NAQ | CAM | CAN | CAL | 177.4° | 180.0° |
| NAQ | CAM | CAN | CAI | 179.0° | 179.9° |
| NAQ | CAM | CAL | NAO | 1.2° | 0.2° |
| NAQ | CAM | CAL | CAK | 179.8° | 180.0° |
| NAQ | CAM | CAN | H13 | 1.0° | 0.0° |
| CAP | NAO | CAL | CAM | 0.8° | 0.4° |
| CAP | NAO | CAL | CAK | 179.3° | 179.9° |
| NAO | CAP | CAE | H11 | 176.4° | 176.2° |
| NAO | CAP | NAQ | H12 | 179.5° | 179.8° |
| CAM | CAN | CAI | H13 | 180.0° | 179.9° |
| CAN | CAM | CAL | NAO | 179.2° | 179.8° |
| CAN | CAM | CAL | CAK | 2.3° | 0.0° |
| CAM | CAN | CAI | CAJ | 0.2° | 0.1° |
| CAN | CAM | NAQ | H12 | 1.4° | 0.1° |
| CAM | CAN | CAI | H14 | 179.8° | 180.0° |
| CAL | CAM | CAN | CAI | 1.7° | 0.1° |
| CAM | CAL | NAO | CAK | 178.4° | 179.7° |
| CAM | CAL | CAK | CAJ | 1.3° | 0.0° |
| CAL | CAM | NAQ | H12 | 178.9° | 180.0° |
| CAL | CAM | CAN | H13 | 178.3° | 180.0° |
| CAM | CAL | CAK | H16 | 178.7° | 179.9° |
| CAN | CAI | CAJ | H14 | 180.0° | 179.9° |
| CAN | CAI | CAJ | CAK | 0.8° | 0.0° |
| CAN | CAI | CAJ | H15 | 179.3° | 179.9° |
| NAO | CAL | CAK | CAJ | 179.5° | 179.6° |
| NAO | CAL | CAK | H16 | 0.5° | 0.4° |
| CAL | CAK | CAJ | CAI | 0.2° | 0.0° |
| CAL | CAK | CAJ | H16 | 180.0° | 180.0° |
| CAL | CAK | CAJ | H15 | 179.8° | 180.0° |
| CAI | CAJ | CAK | H15 | 180.0° | 180.0° |
| CAJ | CAI | CAN | H13 | 179.8° | 180.0° |
| CAI | CAJ | CAK | H16 | 179.8° | 179.9° |
| CAK | CAJ | CAI | H14 | 179.2° | 179.9° |
| H1 | OAD | CAG | H2 | 55.4° | 59.3° |
| H2 | CAG | CAA | H3 | 52.6° | 35.2° |
| H2 | CAG | CAE | H11 | 163.5° | 144.3° |
| H3 | CAA | OAC | H4 | 56.1° | 62.4° |
| H3 | CAA | CAF | H5 | 48.7° | 36.4° |
| H5 | CAF | CAB | H6 | 61.0° | 62.3° |
| H5 | CAF | CAB | H7 | 179.0° | 57.7° |
| H5 | CAF | CAB | H8 | 59.0° | 177.7° |
| H5 | CAF | NAH | H9 | 30.6° | 27.6° |
| H6 | CAB | H7 | H8 | 120.0° | 120.0° |
| H9 | NAH | CAE | H11 | 129.0° | 117.2° |
| H13 | CAN | CAI | H14 | 0.2° | 0.1° |
| H14 | CAI | CAJ | H15 | 0.7° | 0.0° |
| H15 | CAJ | CAK | H16 | 0.2° | 0.0° |
