E70
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAA | OAS | sing | 1.43Å | 1.45Å | |
| OAS | CAV | sing | 1.36Å | 1.37Å | |
| CAV | CAL | doub | 1.39Å | 1.41Å | Aromatic |
| CAV | CAM | sing | 1.39Å | 1.40Å | Aromatic |
| CAL | CAN | sing | 1.38Å | 1.40Å | Aromatic |
| CAN | CAW | doub | 1.38Å | 1.40Å | Aromatic |
| CAM | CAO | doub | 1.38Å | 1.39Å | Aromatic |
| CAO | CAW | sing | 1.38Å | 1.41Å | Aromatic |
| CAW | SAZ | sing | 1.76Å | 1.81Å | |
| SAZ | OAB | doub | 1.42Å | 1.58Å | |
| SAZ | OAC | doub | 1.42Å | 1.53Å | |
| SAZ | NAR | sing | 1.66Å | 1.68Å | |
| NAR | CAX | sing | 1.40Å | 1.34Å | |
| CAX | CAG | doub | 1.39Å | 1.39Å | Aromatic |
| CAX | CAY | sing | 1.40Å | 1.40Å | Aromatic |
| CAG | CAE | sing | 1.39Å | 1.40Å | Aromatic |
| CAE | CAF | doub | 1.38Å | 1.41Å | Aromatic |
| CAF | NAP | sing | 1.32Å | 1.33Å | Aromatic |
| NAP | CAY | doub | 1.32Å | 1.38Å | Aromatic |
| CAY | NAQ | sing | 1.39Å | 1.35Å | |
| NAQ | CAU | sing | 1.40Å | 1.35Å | |
| CAU | CAJ | doub | 1.39Å | 1.40Å | Aromatic |
| CAU | CAK | sing | 1.39Å | 1.42Å | Aromatic |
| CAJ | CAH | sing | 1.38Å | 1.40Å | Aromatic |
| CAH | CAT | doub | 1.39Å | 1.41Å | Aromatic |
| CAT | OAD | sing | 1.36Å | 1.38Å | |
| CAT | CAI | sing | 1.39Å | 1.41Å | Aromatic |
| CAI | CAK | doub | 1.38Å | 1.40Å | Aromatic |
| CAA | HAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAB | sing | 1.09Å | 1.10Å | |
| CAL | HAL | sing | 1.08Å | 1.08Å | |
| CAN | HAN | sing | 1.08Å | 1.08Å | |
| CAM | HAM | sing | 1.08Å | 1.08Å | |
| CAO | HAO | sing | 1.08Å | 1.08Å | |
| NAR | HNAR | sing | 0.97Å | 1.00Å | |
| CAG | HAG | sing | 1.08Å | 1.08Å | |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| NAQ | HNAQ | sing | 0.97Å | 1.00Å | |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| OAD | HOAD | sing | 0.97Å | 0.95Å | |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAA | OAS | CAV | 113.2° | 117.0° |
| OAS | CAA | HAA | 109.5° | 109.5° |
| OAS | CAA | HAAA | 109.5° | 109.4° |
| OAS | CAA | HAAB | 109.5° | 109.5° |
| OAS | CAV | CAL | 120.8° | 120.1° |
| OAS | CAV | CAM | 118.7° | 120.1° |
| CAL | CAV | CAM | 120.5° | 119.8° |
| CAV | CAL | CAN | 120.6° | 120.0° |
| CAV | CAL | HAL | 119.7° | 120.0° |
| CAV | CAM | CAO | 118.7° | 120.0° |
| CAV | CAM | HAM | 120.6° | 120.0° |
| CAL | CAN | CAW | 118.8° | 120.1° |
| CAN | CAL | HAL | 119.7° | 120.0° |
| CAL | CAN | HAN | 120.6° | 120.0° |
| CAN | CAW | CAO | 120.1° | 120.1° |
| CAN | CAW | SAZ | 118.9° | 120.0° |
| CAW | CAN | HAN | 120.6° | 120.0° |
| CAM | CAO | CAW | 121.3° | 120.1° |
| CAO | CAM | HAM | 120.7° | 120.0° |
| CAM | CAO | HAO | 119.4° | 120.0° |
| CAO | CAW | SAZ | 120.9° | 119.9° |
| CAW | CAO | HAO | 119.4° | 120.0° |
| CAW | SAZ | OAB | 114.2° | 106.4° |
| CAW | SAZ | OAC | 105.6° | 106.4° |
| CAW | SAZ | NAR | 111.2° | 107.2° |
| OAB | SAZ | OAC | 110.1° | 123.1° |
| OAB | SAZ | NAR | 110.9° | 106.4° |
| OAC | SAZ | NAR | 104.4° | 106.4° |
| SAZ | NAR | CAX | 127.7° | 120.0° |
| SAZ | NAR | HNAR | 103.8° | 120.0° |
| NAR | CAX | CAG | 120.7° | 120.5° |
| NAR | CAX | CAY | 119.7° | 120.5° |
| CAX | NAR | HNAR | 103.8° | 120.0° |
| CAG | CAX | CAY | 119.5° | 119.0° |
| CAX | CAG | CAE | 117.7° | 118.5° |
| CAX | CAG | HAG | 121.1° | 120.8° |
| CAX | CAY | NAP | 120.4° | 120.5° |
| CAX | CAY | NAQ | 117.7° | 119.8° |
| CAG | CAE | CAF | 121.9° | 119.4° |
| CAE | CAG | HAG | 121.1° | 120.8° |
| CAG | CAE | HAE | 119.0° | 120.3° |
| CAE | CAF | NAP | 118.5° | 121.0° |
| CAF | CAE | HAE | 119.1° | 120.3° |
| CAE | CAF | HAF | 120.8° | 119.5° |
| CAF | NAP | CAY | 122.0° | 121.6° |
| NAP | CAF | HAF | 120.8° | 119.4° |
| NAP | CAY | NAQ | 121.9° | 119.7° |
| CAY | NAQ | CAU | 124.4° | 120.0° |
| CAY | NAQ | HNAQ | 117.8° | 119.9° |
| NAQ | CAU | CAJ | 117.6° | 120.0° |
| NAQ | CAU | CAK | 122.4° | 120.0° |
| CAU | NAQ | HNAQ | 117.8° | 120.0° |
| CAJ | CAU | CAK | 120.0° | 120.0° |
| CAU | CAJ | CAH | 119.5° | 120.0° |
| CAU | CAJ | HAJ | 120.3° | 120.1° |
| CAU | CAK | CAI | 120.4° | 120.0° |
| CAU | CAK | HAK | 119.8° | 120.0° |
| CAJ | CAH | CAT | 120.8° | 120.0° |
| CAH | CAJ | HAJ | 120.2° | 120.0° |
| CAJ | CAH | HAH | 119.6° | 120.0° |
| CAH | CAT | OAD | 120.0° | 120.0° |
| CAH | CAT | CAI | 119.7° | 120.0° |
| CAT | CAH | HAH | 119.6° | 120.0° |
| OAD | CAT | CAI | 120.2° | 120.0° |
| CAT | OAD | HOAD | 109.5° | 114.0° |
| CAT | CAI | CAK | 119.7° | 120.0° |
| CAT | CAI | HAI | 120.2° | 120.0° |
| CAK | CAI | HAI | 120.2° | 120.0° |
| CAI | CAK | HAK | 119.8° | 119.9° |
| HAA | CAA | HAAA | 109.4° | 109.5° |
| HAA | CAA | HAAB | 109.4° | 109.5° |
| HAAA | CAA | HAAB | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAA | OAS | CAV | CAL | 75.5° | 180.0° |
| CAA | OAS | CAV | CAM | 104.8° | 0.3° |
| OAS | CAA | HAA | HAAA | 120.0° | 119.9° |
| OAS | CAA | HAA | HAAB | 120.0° | 120.0° |
| OAS | CAA | HAAA | HAAB | 120.0° | 120.0° |
| OAS | CAV | CAL | CAM | 179.6° | 179.7° |
| OAS | CAV | CAL | CAN | 179.8° | 180.0° |
| OAS | CAV | CAM | CAO | 179.8° | 180.0° |
| CAV | OAS | CAA | HAA | 100.2° | 180.0° |
| CAV | OAS | CAA | HAAA | 139.8° | 60.0° |
| CAV | OAS | CAA | HAAB | 19.8° | 60.0° |
| OAS | CAV | CAL | HAL | 0.2° | 0.1° |
| OAS | CAV | CAM | HAM | 0.2° | 0.0° |
| CAV | CAL | CAN | HAL | 180.0° | 179.9° |
| CAV | CAL | CAN | CAW | 0.0° | 0.1° |
| CAL | CAV | CAM | CAO | 0.6° | 0.3° |
| CAV | CAL | CAN | HAN | 180.0° | 180.0° |
| CAL | CAV | CAM | HAM | 179.4° | 179.7° |
| CAM | CAV | CAL | CAN | 0.6° | 0.3° |
| CAV | CAM | CAO | HAM | 180.0° | 180.0° |
| CAV | CAM | CAO | CAW | 0.1° | 0.0° |
| CAM | CAV | CAL | HAL | 179.4° | 179.7° |
| CAV | CAM | CAO | HAO | 179.9° | 180.0° |
| CAL | CAN | CAW | HAN | 180.0° | 180.0° |
| CAL | CAN | CAW | CAO | 0.6° | 0.2° |
| CAL | CAN | CAW | SAZ | 179.3° | 180.0° |
| CAN | CAW | CAO | CAM | 0.6° | 0.2° |
| CAN | CAW | CAO | SAZ | 178.7° | 179.8° |
| CAN | CAW | SAZ | OAB | 162.3° | 156.4° |
| CAN | CAW | SAZ | OAC | 41.3° | 23.5° |
| CAN | CAW | SAZ | NAR | 71.3° | 90.0° |
| CAW | CAN | CAL | HAL | 180.0° | 180.0° |
| CAN | CAW | CAO | HAO | 179.3° | 179.7° |
| CAM | CAO | CAW | HAO | 180.0° | 180.0° |
| CAM | CAO | CAW | SAZ | 179.3° | 180.0° |
| CAO | CAW | SAZ | OAB | 16.3° | 23.8° |
| CAO | CAW | SAZ | OAC | 137.4° | 156.7° |
| CAO | CAW | SAZ | NAR | 110.0° | 89.8° |
| CAO | CAW | CAN | HAN | 179.4° | 179.8° |
| CAW | CAO | CAM | HAM | 179.9° | 180.0° |
| CAW | SAZ | OAB | OAC | 118.5° | 123.0° |
| CAW | SAZ | OAB | NAR | 126.5° | 114.1° |
| CAW | SAZ | OAC | NAR | 117.3° | 114.1° |
| CAW | SAZ | NAR | CAX | 8.5° | 65.0° |
| SAZ | CAW | CAN | HAN | 0.7° | 0.1° |
| SAZ | CAW | CAO | HAO | 0.7° | 0.1° |
| CAW | SAZ | NAR | HNAR | 111.5° | 115.0° |
| OAB | SAZ | OAC | NAR | 119.0° | 123.0° |
| OAB | SAZ | NAR | CAX | 136.7° | 48.5° |
| OAB | SAZ | NAR | HNAR | 16.7° | 131.4° |
| OAC | SAZ | NAR | CAX | 104.8° | 178.6° |
| OAC | SAZ | NAR | HNAR | 135.2° | 1.5° |
| SAZ | NAR | CAX | HNAR | 120.0° | 180.0° |
| SAZ | NAR | CAX | CAG | 65.0° | 35.0° |
| SAZ | NAR | CAX | CAY | 117.3° | 145.3° |
| NAR | CAX | CAG | CAY | 177.8° | 179.6° |
| NAR | CAX | CAG | CAE | 179.3° | 180.0° |
| NAR | CAX | CAY | NAP | 179.3° | 179.7° |
| NAR | CAX | CAY | NAQ | 0.4° | 0.0° |
| NAR | CAX | CAG | HAG | 0.7° | 0.1° |
| CAX | CAG | CAE | HAG | 180.0° | 179.9° |
| CAX | CAG | CAE | CAF | 0.9° | 0.1° |
| CAG | CAX | CAY | NAP | 1.5° | 0.6° |
| CAG | CAX | CAY | NAQ | 178.2° | 179.7° |
| CAG | CAX | NAR | HNAR | 55.0° | 144.9° |
| CAX | CAG | CAE | HAE | 179.2° | 179.9° |
| CAY | CAX | CAG | CAE | 1.6° | 0.4° |
| CAX | CAY | NAP | CAF | 0.7° | 0.6° |
| CAX | CAY | NAP | NAQ | 179.7° | 179.7° |
| CAX | CAY | NAQ | CAU | 159.6° | 174.4° |
| CAY | CAX | NAR | HNAR | 122.8° | 34.7° |
| CAY | CAX | CAG | HAG | 178.5° | 179.8° |
| CAX | CAY | NAQ | HNAQ | 20.4° | 5.6° |
| CAG | CAE | CAF | HAE | 180.0° | 180.0° |
| CAG | CAE | CAF | NAP | 0.0° | 0.1° |
| CAG | CAE | CAF | HAF | 180.0° | 180.0° |
| CAE | CAF | NAP | HAF | 180.0° | 179.9° |
| CAE | CAF | NAP | CAY | 0.1° | 0.3° |
| CAF | CAE | CAG | HAG | 179.2° | 180.0° |
| CAF | NAP | CAY | NAQ | 179.0° | 179.7° |
| NAP | CAF | CAE | HAE | 180.0° | 180.0° |
| NAP | CAY | NAQ | CAU | 20.7° | 5.2° |
| CAY | NAP | CAF | HAF | 179.9° | 179.7° |
| NAP | CAY | NAQ | HNAQ | 159.3° | 174.7° |
| CAY | NAQ | CAU | HNAQ | 180.0° | 179.9° |
| CAY | NAQ | CAU | CAJ | 178.5° | 146.9° |
| CAY | NAQ | CAU | CAK | 1.4° | 33.5° |
| NAQ | CAU | CAJ | CAK | 179.9° | 179.7° |
| NAQ | CAU | CAJ | CAH | 179.5° | 180.0° |
| NAQ | CAU | CAK | CAI | 179.3° | 179.8° |
| NAQ | CAU | CAJ | HAJ | 0.5° | 0.1° |
| NAQ | CAU | CAK | HAK | 0.7° | 0.1° |
| CAU | CAJ | CAH | HAJ | 180.0° | 179.9° |
| CAU | CAJ | CAH | CAT | 0.3° | 0.0° |
| CAJ | CAU | CAK | CAI | 0.5° | 0.6° |
| CAJ | CAU | NAQ | HNAQ | 1.5° | 33.1° |
| CAU | CAJ | CAH | HAH | 179.7° | 179.9° |
| CAJ | CAU | CAK | HAK | 179.5° | 179.7° |
| CAK | CAU | CAJ | CAH | 0.4° | 0.3° |
| CAU | CAK | CAI | CAT | 0.0° | 0.5° |
| CAU | CAK | CAI | HAK | 180.0° | 179.7° |
| CAK | CAU | NAQ | HNAQ | 178.6° | 146.6° |
| CAK | CAU | CAJ | HAJ | 179.6° | 179.7° |
| CAU | CAK | CAI | HAI | 179.9° | 179.7° |
| CAJ | CAH | CAT | HAH | 180.0° | 179.9° |
| CAJ | CAH | CAT | OAD | 179.3° | 180.0° |
| CAJ | CAH | CAT | CAI | 0.8° | 0.0° |
| CAH | CAT | OAD | CAI | 179.8° | 180.0° |
| CAH | CAT | CAI | CAK | 0.6° | 0.2° |
| CAT | CAH | CAJ | HAJ | 179.7° | 180.0° |
| CAH | CAT | OAD | HOAD | 14.4° | 90.1° |
| CAH | CAT | CAI | HAI | 179.4° | 180.0° |
| OAD | CAT | CAI | CAK | 179.5° | 179.8° |
| OAD | CAT | CAH | HAH | 0.6° | 0.1° |
| OAD | CAT | CAI | HAI | 0.5° | 0.0° |
| CAT | CAI | CAK | HAI | 180.0° | 179.8° |
| CAI | CAT | CAH | HAH | 179.2° | 179.9° |
| CAI | CAT | OAD | HOAD | 165.7° | 89.9° |
| CAT | CAI | CAK | HAK | 180.0° | 179.8° |
| HAA | CAA | HAAA | HAAB | 120.0° | 120.1° |
| HAL | CAL | CAN | HAN | 0.0° | 0.0° |
| HAM | CAM | CAO | HAO | 0.1° | 0.0° |
| HAG | CAG | CAE | HAE | 0.8° | 0.1° |
| HAE | CAE | CAF | HAF | 0.0° | 0.0° |
| HAJ | CAJ | CAH | HAH | 0.3° | 0.0° |
| HAI | CAI | CAK | HAK | 0.0° | 0.0° |
