TE1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAA | CAF | sing | 1.53Å | 1.58Å | |
| OAB | CAH | sing | 1.43Å | 1.34Å | |
| OAC | CAD | sing | 1.43Å | 1.32Å | |
| OAC | CAJ | sing | 1.36Å | 1.34Å | |
| CAE | CAF | sing | 1.53Å | 1.54Å | |
| CAF | CAG | sing | 1.53Å | 1.57Å | |
| CAG | CAH | sing | 1.53Å | 1.61Å | |
| CAH | CAI | sing | 1.51Å | 1.53Å | |
| CAI | CAJ | doub | 1.39Å | 1.39Å | Aromatic |
| CAI | CAO | sing | 1.37Å | 1.38Å | Aromatic |
| CAJ | CAK | sing | 1.39Å | 1.36Å | Aromatic |
| CAK | CAQ | doub | 1.38Å | 1.37Å | Aromatic |
| OAL | CAN | sing | 1.35Å | 1.23Å | |
| OAM | CAN | doub | 1.22Å | 1.20Å | |
| CAN | CAS | sing | 1.42Å | 1.42Å | |
| CAO | CAP | doub | 1.40Å | 1.37Å | Aromatic |
| CAP | CAQ | sing | 1.41Å | 1.34Å | Aromatic |
| CAP | CAT | sing | 1.47Å | 1.41Å | |
| CAQ | OAR | sing | 1.36Å | 1.32Å | |
| CAS | CAT | doub | 1.35Å | 1.43Å | |
| CAA | HAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAB | sing | 1.09Å | 1.10Å | |
| OAB | HOAB | sing | 0.97Å | 0.95Å | |
| CAD | HAD | sing | 1.09Å | 1.10Å | |
| CAD | HADA | sing | 1.09Å | 1.10Å | |
| CAD | HADB | sing | 1.09Å | 1.10Å | |
| CAE | HAE | sing | 1.09Å | 1.10Å | |
| CAE | HAEA | sing | 1.09Å | 1.10Å | |
| CAE | HAEB | sing | 1.09Å | 1.10Å | |
| CAF | HAF | sing | 1.09Å | 1.10Å | |
| CAG | HAG | sing | 1.09Å | 1.10Å | |
| CAG | HAGA | sing | 1.09Å | 1.10Å | |
| CAH | HAH | sing | 1.09Å | 1.10Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CAO | HAO | sing | 1.08Å | 1.08Å | |
| OAR | HOAR | sing | 0.97Å | 0.95Å | |
| CAS | HAS | sing | 1.08Å | 1.08Å | |
| CAT | HAT | sing | 1.08Å | 1.08Å | |
| OAL | HOAL | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAA | CAF | CAE | 108.2° | 109.5° |
| CAA | CAF | CAG | 112.4° | 109.5° |
| CAF | CAA | HAA | 109.5° | 109.5° |
| CAF | CAA | HAAA | 109.5° | 109.5° |
| CAF | CAA | HAAB | 109.4° | 109.5° |
| CAA | CAF | HAF | 109.6° | 109.5° |
| OAB | CAH | CAG | 110.2° | 109.5° |
| OAB | CAH | CAI | 97.9° | 109.5° |
| CAH | OAB | HOAB | 109.5° | 114.0° |
| OAB | CAH | HAH | 120.7° | 109.5° |
| CAD | OAC | CAJ | 118.2° | 117.0° |
| OAC | CAD | HAD | 109.5° | 109.5° |
| OAC | CAD | HADA | 109.5° | 109.5° |
| OAC | CAD | HADB | 109.5° | 109.5° |
| OAC | CAJ | CAI | 120.8° | 119.9° |
| OAC | CAJ | CAK | 121.1° | 119.9° |
| CAE | CAF | CAG | 112.7° | 109.4° |
| CAF | CAE | HAE | 109.5° | 109.5° |
| CAF | CAE | HAEA | 109.4° | 109.5° |
| CAF | CAE | HAEB | 109.4° | 109.5° |
| CAE | CAF | HAF | 109.2° | 109.5° |
| CAF | CAG | CAH | 118.5° | 109.5° |
| CAG | CAF | HAF | 104.7° | 109.5° |
| CAF | CAG | HAG | 106.6° | 109.5° |
| CAF | CAG | HAGA | 106.6° | 109.5° |
| CAG | CAH | CAI | 120.4° | 109.5° |
| CAH | CAG | HAG | 106.6° | 109.5° |
| CAH | CAG | HAGA | 106.6° | 109.5° |
| CAG | CAH | HAH | 98.4° | 109.5° |
| CAH | CAI | CAJ | 126.2° | 119.9° |
| CAH | CAI | CAO | 115.2° | 119.9° |
| CAI | CAH | HAH | 110.6° | 109.4° |
| CAJ | CAI | CAO | 118.7° | 120.3° |
| CAI | CAJ | CAK | 118.0° | 120.3° |
| CAI | CAO | CAP | 123.2° | 120.0° |
| CAI | CAO | HAO | 118.4° | 120.1° |
| CAJ | CAK | CAQ | 121.1° | 120.1° |
| CAJ | CAK | HAK | 119.5° | 119.9° |
| CAK | CAQ | CAP | 122.8° | 119.8° |
| CAK | CAQ | OAR | 121.1° | 120.1° |
| CAQ | CAK | HAK | 119.5° | 120.0° |
| OAL | CAN | OAM | 115.8° | 120.0° |
| OAL | CAN | CAS | 126.6° | 120.0° |
| CAN | OAL | HOAL | 109.5° | 114.0° |
| OAM | CAN | CAS | 116.9° | 119.9° |
| CAN | CAS | CAT | 136.7° | 120.0° |
| CAN | CAS | HAS | 111.7° | 120.0° |
| CAO | CAP | CAQ | 116.2° | 119.6° |
| CAO | CAP | CAT | 123.3° | 120.2° |
| CAP | CAO | HAO | 118.4° | 120.0° |
| CAQ | CAP | CAT | 120.4° | 120.2° |
| CAP | CAQ | OAR | 116.0° | 120.1° |
| CAP | CAT | CAS | 129.5° | 120.0° |
| CAP | CAT | HAT | 115.3° | 120.0° |
| CAQ | OAR | HOAR | 109.5° | 114.0° |
| CAT | CAS | HAS | 111.6° | 120.0° |
| CAS | CAT | HAT | 115.2° | 120.0° |
| HAA | CAA | HAAA | 109.4° | 109.4° |
| HAA | CAA | HAAB | 109.5° | 109.5° |
| HAAA | CAA | HAAB | 109.5° | 109.5° |
| HAD | CAD | HADA | 109.4° | 109.4° |
| HAD | CAD | HADB | 109.5° | 109.4° |
| HADA | CAD | HADB | 109.5° | 109.5° |
| HAE | CAE | HAEA | 109.5° | 109.4° |
| HAE | CAE | HAEB | 109.4° | 109.4° |
| HAEA | CAE | HAEB | 109.5° | 109.4° |
| HAG | CAG | HAGA | 112.2° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAA | CAF | CAE | CAG | 124.9° | 120.0° |
| CAA | CAF | CAE | HAF | 119.2° | 120.0° |
| CAA | CAF | CAG | HAF | 118.9° | 120.0° |
| CAA | CAF | CAG | CAH | 142.7° | 175.0° |
| CAF | CAA | HAA | HAAA | 120.0° | 120.0° |
| CAF | CAA | HAA | HAAB | 120.0° | 120.0° |
| CAF | CAA | HAAA | HAAB | 120.0° | 120.0° |
| CAA | CAF | CAE | HAE | 180.0° | 180.0° |
| CAA | CAF | CAE | HAEA | 60.0° | 60.0° |
| CAA | CAF | CAE | HAEB | 60.0° | 60.0° |
| CAA | CAF | CAG | HAG | 97.3° | 65.0° |
| CAA | CAF | CAG | HAGA | 22.7° | 55.0° |
| OAB | CAH | CAG | CAF | 15.7° | 65.0° |
| OAB | CAH | CAG | CAI | 112.8° | 120.0° |
| OAB | CAH | CAG | HAH | 127.2° | 120.0° |
| OAB | CAH | CAI | HAH | 127.1° | 120.0° |
| OAB | CAH | CAI | CAJ | 177.8° | 155.0° |
| OAB | CAH | CAI | CAO | 2.0° | 25.3° |
| OAB | CAH | CAG | HAG | 135.7° | 175.0° |
| OAB | CAH | CAG | HAGA | 104.3° | 55.0° |
| CAD | OAC | CAJ | CAI | 155.5° | 180.0° |
| CAD | OAC | CAJ | CAK | 26.5° | 0.0° |
| OAC | CAD | HAD | HADA | 120.0° | 120.0° |
| OAC | CAD | HAD | HADB | 120.0° | 120.1° |
| OAC | CAD | HADA | HADB | 120.0° | 120.0° |
| OAC | CAJ | CAI | CAH | 2.1° | 0.0° |
| OAC | CAJ | CAI | CAK | 178.0° | 180.0° |
| OAC | CAJ | CAI | CAO | 178.1° | 179.7° |
| OAC | CAJ | CAK | CAQ | 177.4° | 180.0° |
| CAJ | OAC | CAD | HAD | 180.0° | 180.0° |
| CAJ | OAC | CAD | HADA | 60.0° | 60.0° |
| CAJ | OAC | CAD | HADB | 60.0° | 60.0° |
| OAC | CAJ | CAK | HAK | 2.6° | 0.0° |
| CAE | CAF | CAG | HAF | 118.6° | 120.0° |
| CAE | CAF | CAG | CAH | 94.8° | 65.0° |
| CAE | CAF | CAA | HAA | 180.0° | 60.0° |
| CAE | CAF | CAA | HAAA | 60.0° | 180.0° |
| CAE | CAF | CAA | HAAB | 60.0° | 60.0° |
| CAF | CAE | HAE | HAEA | 120.0° | 120.0° |
| CAF | CAE | HAE | HAEB | 120.0° | 120.0° |
| CAF | CAE | HAEA | HAEB | 120.0° | 120.0° |
| CAE | CAF | CAG | HAG | 25.2° | 55.0° |
| CAE | CAF | CAG | HAGA | 145.2° | 175.0° |
| CAF | CAG | CAH | HAG | 120.0° | 120.0° |
| CAF | CAG | CAH | HAGA | 120.0° | 120.0° |
| CAF | CAG | CAH | CAI | 128.4° | 175.0° |
| CAG | CAF | CAA | HAA | 54.9° | 180.0° |
| CAG | CAF | CAA | HAAA | 65.0° | 60.0° |
| CAG | CAF | CAA | HAAB | 174.9° | 60.0° |
| CAG | CAF | CAE | HAE | 55.1° | 60.0° |
| CAG | CAF | CAE | HAEA | 175.1° | 180.0° |
| CAG | CAF | CAE | HAEB | 64.8° | 60.0° |
| CAF | CAG | HAG | HAGA | 116.3° | 120.0° |
| CAF | CAG | CAH | HAH | 111.6° | 55.0° |
| CAG | CAH | CAI | HAH | 113.8° | 120.0° |
| CAG | CAH | CAI | CAJ | 63.1° | 85.0° |
| CAG | CAH | CAI | CAO | 117.1° | 94.7° |
| CAG | CAH | OAB | HOAB | 180.0° | 60.0° |
| CAH | CAG | CAF | HAF | 23.8° | 55.0° |
| CAH | CAG | HAG | HAGA | 116.3° | 120.0° |
| CAH | CAI | CAJ | CAO | 179.8° | 179.7° |
| CAH | CAI | CAJ | CAK | 179.9° | 180.0° |
| CAH | CAI | CAO | CAP | 179.0° | 180.0° |
| CAI | CAH | OAB | HOAB | 53.4° | 60.0° |
| CAI | CAH | CAG | HAG | 111.6° | 55.0° |
| CAI | CAH | CAG | HAGA | 8.4° | 65.0° |
| CAH | CAI | CAO | HAO | 1.0° | 0.0° |
| CAI | CAJ | CAK | CAQ | 0.6° | 0.0° |
| CAJ | CAI | CAO | CAP | 1.2° | 0.4° |
| CAJ | CAI | CAH | HAH | 50.7° | 35.0° |
| CAI | CAJ | CAK | HAK | 179.4° | 180.0° |
| CAJ | CAI | CAO | HAO | 178.8° | 179.7° |
| CAO | CAI | CAJ | CAK | 0.1° | 0.3° |
| CAI | CAO | CAP | HAO | 180.0° | 180.0° |
| CAI | CAO | CAP | CAQ | 1.6° | 0.1° |
| CAI | CAO | CAP | CAT | 178.6° | 180.0° |
| CAO | CAI | CAH | HAH | 129.1° | 145.3° |
| CAJ | CAK | CAQ | HAK | 180.0° | 179.9° |
| CAJ | CAK | CAQ | CAP | 0.2° | 0.3° |
| CAJ | CAK | CAQ | OAR | 178.3° | 180.0° |
| CAK | CAQ | CAP | CAO | 0.8° | 0.2° |
| CAK | CAQ | CAP | OAR | 178.6° | 179.7° |
| CAK | CAQ | CAP | CAT | 178.0° | 179.7° |
| CAK | CAQ | OAR | HOAR | 180.0° | 90.0° |
| OAL | CAN | OAM | CAS | 170.8° | 180.0° |
| OAL | CAN | CAS | CAT | 19.5° | 173.1° |
| OAL | CAN | CAS | HAS | 160.5° | 6.8° |
| OAM | CAN | CAS | CAT | 170.8° | 6.9° |
| OAM | CAN | CAS | HAS | 9.2° | 173.2° |
| OAM | CAN | OAL | HOAL | 0.0° | 0.0° |
| CAN | CAS | CAT | CAP | 15.4° | 10.3° |
| CAN | CAS | CAT | HAS | 180.0° | 180.0° |
| CAN | CAS | CAT | HAT | 164.6° | 169.6° |
| CAS | CAN | OAL | HOAL | 169.8° | 180.0° |
| CAO | CAP | CAQ | CAT | 177.1° | 179.9° |
| CAO | CAP | CAQ | OAR | 179.4° | 179.9° |
| CAO | CAP | CAT | CAS | 13.3° | 45.7° |
| CAO | CAP | CAT | HAT | 166.7° | 134.4° |
| CAQ | CAP | CAT | CAS | 169.8° | 134.3° |
| CAP | CAQ | CAK | HAK | 179.8° | 179.8° |
| CAQ | CAP | CAO | HAO | 178.4° | 179.9° |
| CAP | CAQ | OAR | HOAR | 1.4° | 89.7° |
| CAQ | CAP | CAT | HAT | 10.2° | 45.7° |
| CAT | CAP | CAQ | OAR | 3.4° | 0.0° |
| CAP | CAT | CAS | HAT | 180.0° | 179.9° |
| CAT | CAP | CAO | HAO | 1.4° | 0.0° |
| CAP | CAT | CAS | HAS | 164.6° | 169.6° |
| OAR | CAQ | CAK | HAK | 1.7° | 0.1° |
| HAA | CAA | HAAA | HAAB | 120.0° | 120.0° |
| HAA | CAA | CAF | HAF | 61.1° | 60.0° |
| HAAA | CAA | CAF | HAF | 179.0° | 60.0° |
| HAAB | CAA | CAF | HAF | 58.9° | 180.0° |
| HOAB | OAB | CAH | HAH | 66.4° | 180.0° |
| HAD | CAD | HADA | HADB | 120.0° | 119.9° |
| HAE | CAE | HAEA | HAEB | 120.0° | 119.9° |
| HAE | CAE | CAF | HAF | 60.9° | 60.0° |
| HAEA | CAE | CAF | HAF | 59.2° | 60.0° |
| HAEB | CAE | CAF | HAF | 179.2° | 180.0° |
| HAF | CAF | CAG | HAG | 143.8° | 175.0° |
| HAF | CAF | CAG | HAGA | 96.2° | 65.0° |
| HAG | CAG | CAH | HAH | 8.4° | 65.0° |
| HAGA | CAG | CAH | HAH | 128.4° | 175.0° |
| HAS | CAS | CAT | HAT | 15.4° | 10.4° |
