L8B
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAA | CAW | sing | 1.51Å | 1.53Å | |
| CAW | CAK | sing | 1.41Å | 1.34Å | Aromatic |
| CAW | NAQ | doub | 1.30Å | 1.33Å | Aromatic |
| CAK | CAZ | doub | 1.35Å | 1.34Å | Aromatic |
| NAQ | OAT | sing | 1.21Å | 1.45Å | Aromatic |
| OAT | CAZ | sing | 1.34Å | 1.37Å | Aromatic |
| CAZ | CAM | sing | 1.51Å | 1.52Å | |
| CAM | CAU | sing | 1.51Å | 1.55Å | |
| CAU | OAB | doub | 1.21Å | 1.24Å | |
| CAU | N | sing | 1.35Å | 1.36Å | |
| N | CD2 | sing | 1.47Å | 1.47Å | |
| N | CA | sing | 1.47Å | 1.48Å | |
| CD2 | CG | sing | 1.55Å | 1.54Å | |
| CG | OD1 | sing | 1.43Å | 1.41Å | |
| CG | CB | sing | 1.55Å | 1.50Å | |
| CB | CA | sing | 1.54Å | 1.53Å | |
| CA | C | sing | 1.51Å | 1.51Å | |
| C | O | doub | 1.21Å | 1.23Å | |
| C | NAR | sing | 1.35Å | 1.33Å | |
| NAR | CAL | sing | 1.47Å | 1.47Å | |
| CAL | CAX | sing | 1.51Å | 1.53Å | |
| CAX | CAF | sing | 1.38Å | 1.40Å | Aromatic |
| CAX | CAE | doub | 1.38Å | 1.39Å | Aromatic |
| CAF | CAH | doub | 1.38Å | 1.40Å | Aromatic |
| CAH | CAY | sing | 1.40Å | 1.41Å | Aromatic |
| CAE | CAG | sing | 1.38Å | 1.39Å | Aromatic |
| CAG | CAY | doub | 1.40Å | 1.41Å | Aromatic |
| CAY | CBA | sing | 1.48Å | 1.41Å | |
| CBA | CAJ | doub | 1.36Å | 1.33Å | Aromatic |
| CBA | OAS | sing | 1.35Å | 1.36Å | Aromatic |
| CAJ | NAP | sing | 1.34Å | 1.35Å | Aromatic |
| NAP | CAI | doub | 1.30Å | 1.33Å | Aromatic |
| CAI | OAS | sing | 1.34Å | 1.36Å | Aromatic |
| CAA | HAA1 | sing | 1.09Å | 1.10Å | |
| CAA | HAA2 | sing | 1.09Å | 1.10Å | |
| CAA | HAA3 | sing | 1.09Å | 1.10Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CAM | HAM1 | sing | 1.09Å | 1.10Å | |
| CAM | HAM2 | sing | 1.09Å | 1.10Å | |
| CD2 | HD21 | sing | 1.09Å | 1.10Å | |
| CD2 | HD22 | sing | 1.09Å | 1.10Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CG | HG | sing | 1.09Å | 1.10Å | |
| OD1 | HD1 | sing | 0.97Å | 0.95Å | |
| CB | HB1C | sing | 1.09Å | 1.10Å | |
| CB | HB2C | sing | 1.09Å | 1.10Å | |
| NAR | HAR | sing | 0.97Å | 1.00Å | |
| CAL | HAL1 | sing | 1.09Å | 1.10Å | |
| CAL | HAL2 | sing | 1.09Å | 1.10Å | |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAG | HAG | sing | 1.08Å | 1.08Å | |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAI | HAI | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAA | CAW | CAK | 124.6° | 126.8° |
| CAA | CAW | NAQ | 124.3° | 126.8° |
| CAW | CAA | HAA1 | 109.5° | 109.5° |
| CAW | CAA | HAA2 | 109.5° | 109.5° |
| CAW | CAA | HAA3 | 109.5° | 109.5° |
| CAK | CAW | NAQ | 111.0° | 106.4° |
| CAW | CAK | CAZ | 108.2° | 104.0° |
| CAW | CAK | HAK | 125.9° | 128.0° |
| CAW | NAQ | OAT | 105.9° | 111.6° |
| CAK | CAZ | OAT | 109.6° | 106.4° |
| CAK | CAZ | CAM | 127.7° | 126.7° |
| CAZ | CAK | HAK | 125.9° | 128.1° |
| NAQ | OAT | CAZ | 105.3° | 111.6° |
| OAT | CAZ | CAM | 122.6° | 126.8° |
| CAZ | CAM | CAU | 101.5° | 109.5° |
| CAZ | CAM | HAM1 | 111.4° | 109.4° |
| CAZ | CAM | HAM2 | 111.4° | 109.5° |
| CAM | CAU | OAB | 117.4° | 120.0° |
| CAM | CAU | N | 122.0° | 120.0° |
| CAU | CAM | HAM1 | 111.4° | 109.4° |
| CAU | CAM | HAM2 | 111.4° | 109.5° |
| OAB | CAU | N | 120.4° | 120.0° |
| CAU | N | CD2 | 124.1° | 125.6° |
| CAU | N | CA | 125.9° | 125.7° |
| CD2 | N | CA | 110.0° | 108.7° |
| N | CD2 | CG | 107.0° | 104.8° |
| N | CD2 | HD21 | 110.1° | 110.4° |
| N | CD2 | HD22 | 110.1° | 110.4° |
| N | CA | CB | 106.0° | 107.3° |
| N | CA | C | 111.0° | 109.9° |
| N | CA | HA | 112.2° | 109.8° |
| CD2 | CG | OD1 | 111.3° | 111.0° |
| CD2 | CG | CB | 105.2° | 101.6° |
| CG | CD2 | HD21 | 110.1° | 110.4° |
| CG | CD2 | HD22 | 110.1° | 110.3° |
| CD2 | CG | HG | 110.5° | 111.0° |
| OD1 | CG | CB | 106.1° | 111.0° |
| OD1 | CG | HG | 112.4° | 110.9° |
| CG | OD1 | HD1 | 109.5° | 114.0° |
| CG | CB | CA | 106.7° | 103.0° |
| CB | CG | HG | 111.0° | 111.1° |
| CG | CB | HB1C | 110.1° | 110.7° |
| CG | CB | HB2C | 110.2° | 110.7° |
| CB | CA | C | 104.0° | 110.0° |
| CB | CA | HA | 111.5° | 109.8° |
| CA | CB | HB1C | 110.2° | 110.9° |
| CA | CB | HB2C | 110.2° | 110.5° |
| CA | C | O | 119.3° | 119.9° |
| CA | C | NAR | 114.5° | 120.0° |
| C | CA | HA | 111.7° | 110.0° |
| O | C | NAR | 126.1° | 120.1° |
| C | NAR | CAL | 125.3° | 120.0° |
| C | NAR | HAR | 117.3° | 120.1° |
| NAR | CAL | CAX | 109.8° | 109.4° |
| CAL | NAR | HAR | 117.4° | 120.0° |
| NAR | CAL | HAL1 | 109.4° | 109.5° |
| NAR | CAL | HAL2 | 109.4° | 109.5° |
| CAL | CAX | CAF | 122.4° | 119.8° |
| CAL | CAX | CAE | 118.3° | 119.9° |
| CAX | CAL | HAL1 | 109.4° | 109.5° |
| CAX | CAL | HAL2 | 109.4° | 109.4° |
| CAF | CAX | CAE | 119.3° | 120.3° |
| CAX | CAF | CAH | 120.9° | 120.1° |
| CAX | CAF | HAF | 119.6° | 120.0° |
| CAX | CAE | CAG | 120.4° | 120.1° |
| CAX | CAE | HAE | 119.8° | 119.9° |
| CAF | CAH | CAY | 119.8° | 119.9° |
| CAH | CAF | HAF | 119.5° | 119.9° |
| CAF | CAH | HAH | 120.1° | 120.1° |
| CAH | CAY | CAG | 118.5° | 119.7° |
| CAH | CAY | CBA | 123.9° | 120.2° |
| CAY | CAH | HAH | 120.1° | 120.0° |
| CAE | CAG | CAY | 121.1° | 119.9° |
| CAG | CAE | HAE | 119.8° | 119.9° |
| CAE | CAG | HAG | 119.5° | 120.1° |
| CAG | CAY | CBA | 117.6° | 120.1° |
| CAY | CAG | HAG | 119.4° | 120.0° |
| CAY | CBA | CAJ | 130.0° | 126.6° |
| CAY | CBA | OAS | 123.4° | 126.5° |
| CAJ | CBA | OAS | 106.5° | 106.9° |
| CBA | CAJ | NAP | 109.2° | 107.5° |
| CBA | CAJ | HAJ | 125.4° | 126.3° |
| CBA | OAS | CAI | 108.8° | 107.7° |
| CAJ | NAP | CAI | 108.9° | 108.9° |
| NAP | CAJ | HAJ | 125.4° | 126.3° |
| NAP | CAI | OAS | 106.5° | 109.1° |
| NAP | CAI | HAI | 126.7° | 125.4° |
| OAS | CAI | HAI | 126.8° | 125.5° |
| HAA1 | CAA | HAA2 | 109.5° | 109.5° |
| HAA1 | CAA | HAA3 | 109.5° | 109.4° |
| HAA2 | CAA | HAA3 | 109.5° | 109.5° |
| HAM1 | CAM | HAM2 | 109.5° | 109.5° |
| HD21 | CD2 | HD22 | 109.4° | 110.4° |
| HB1C | CB | HB2C | 109.5° | 110.8° |
| HAL1 | CAL | HAL2 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAA | CAW | CAK | NAQ | 179.8° | 179.8° |
| CAA | CAW | CAK | CAZ | 179.8° | 180.0° |
| CAA | CAW | NAQ | OAT | 179.3° | 180.0° |
| CAW | CAA | HAA1 | HAA2 | 120.0° | 120.0° |
| CAW | CAA | HAA1 | HAA3 | 120.0° | 120.0° |
| CAW | CAA | HAA2 | HAA3 | 120.0° | 120.0° |
| CAA | CAW | CAK | HAK | 0.1° | 0.0° |
| CAW | CAK | CAZ | HAK | 180.0° | 180.0° |
| CAK | CAW | NAQ | OAT | 0.6° | 0.2° |
| CAW | CAK | CAZ | OAT | 1.2° | 0.2° |
| CAW | CAK | CAZ | CAM | 177.7° | 180.0° |
| CAK | CAW | CAA | HAA1 | 179.9° | 89.9° |
| CAK | CAW | CAA | HAA2 | 59.8° | 150.1° |
| CAK | CAW | CAA | HAA3 | 60.2° | 30.0° |
| NAQ | CAW | CAK | CAZ | 0.3° | 0.2° |
| CAW | NAQ | OAT | CAZ | 1.2° | 0.1° |
| NAQ | CAW | CAA | HAA1 | 0.0° | 90.3° |
| NAQ | CAW | CAA | HAA2 | 120.0° | 29.7° |
| NAQ | CAW | CAA | HAA3 | 120.0° | 149.7° |
| NAQ | CAW | CAK | HAK | 179.7° | 179.8° |
| CAK | CAZ | OAT | NAQ | 1.5° | 0.0° |
| CAK | CAZ | OAT | CAM | 176.7° | 179.8° |
| CAK | CAZ | CAM | CAU | 71.4° | 90.0° |
| CAK | CAZ | CAM | HAM1 | 169.9° | 150.0° |
| CAK | CAZ | CAM | HAM2 | 47.3° | 30.0° |
| NAQ | OAT | CAZ | CAM | 178.2° | 179.8° |
| OAT | CAZ | CAM | CAU | 104.7° | 89.8° |
| OAT | CAZ | CAK | HAK | 178.9° | 179.9° |
| OAT | CAZ | CAM | HAM1 | 13.9° | 30.2° |
| OAT | CAZ | CAM | HAM2 | 136.6° | 150.2° |
| CAZ | CAM | CAU | HAM1 | 118.7° | 119.9° |
| CAZ | CAM | CAU | HAM2 | 118.7° | 120.0° |
| CAZ | CAM | CAU | OAB | 81.8° | 0.1° |
| CAZ | CAM | CAU | N | 93.4° | 180.0° |
| CAM | CAZ | CAK | HAK | 2.3° | 0.1° |
| CAZ | CAM | HAM1 | HAM2 | 123.7° | 120.0° |
| CAM | CAU | OAB | N | 175.3° | 179.9° |
| CAM | CAU | N | CD2 | 3.3° | 0.0° |
| CAM | CAU | N | CA | 178.5° | 179.7° |
| CAU | CAM | HAM1 | HAM2 | 123.7° | 120.1° |
| OAB | CAU | N | CD2 | 178.4° | 179.9° |
| OAB | CAU | N | CA | 3.4° | 0.3° |
| OAB | CAU | CAM | HAM1 | 159.5° | 120.0° |
| OAB | CAU | CAM | HAM2 | 36.9° | 119.9° |
| CAU | N | CD2 | CA | 178.5° | 179.7° |
| CAU | N | CD2 | CG | 175.9° | 155.9° |
| CAU | N | CA | CB | 169.8° | 178.8° |
| CAU | N | CA | C | 57.5° | 61.5° |
| N | CAU | CAM | HAM1 | 25.3° | 60.1° |
| N | CAU | CAM | HAM2 | 147.9° | 60.0° |
| CAU | N | CD2 | HD21 | 56.3° | 37.1° |
| CAU | N | CD2 | HD22 | 64.5° | 85.3° |
| CAU | N | CA | HA | 68.3° | 59.6° |
| N | CD2 | CG | HD21 | 119.6° | 118.8° |
| N | CD2 | CG | HD22 | 119.6° | 118.8° |
| N | CD2 | CG | OD1 | 96.7° | 81.1° |
| N | CD2 | CG | CB | 17.8° | 37.0° |
| CD2 | N | CA | CB | 8.6° | 1.5° |
| CD2 | N | CA | C | 121.0° | 118.1° |
| N | CD2 | HD21 | HD22 | 121.1° | 122.3° |
| CD2 | N | CA | HA | 113.3° | 120.7° |
| N | CD2 | CG | HG | 137.6° | 155.1° |
| CA | N | CD2 | CG | 5.6° | 24.4° |
| N | CA | CB | CG | 19.8° | 21.8° |
| N | CA | CB | C | 117.1° | 119.5° |
| N | CA | CB | HA | 122.4° | 119.3° |
| N | CA | C | HA | 126.0° | 121.0° |
| N | CA | C | O | 37.4° | 18.6° |
| N | CA | C | NAR | 145.5° | 161.4° |
| CA | N | CD2 | HD21 | 125.2° | 143.2° |
| CA | N | CD2 | HD22 | 114.0° | 94.4° |
| N | CA | CB | HB1C | 139.4° | 140.3° |
| N | CA | CB | HB2C | 99.7° | 96.5° |
| CD2 | CG | OD1 | CB | 113.9° | 112.2° |
| CD2 | CG | OD1 | HG | 124.6° | 123.9° |
| CD2 | CG | CB | HG | 119.5° | 118.1° |
| CD2 | CG | CB | CA | 23.0° | 35.3° |
| CG | CD2 | HD21 | HD22 | 121.1° | 122.3° |
| CD2 | CG | OD1 | HD1 | 180.0° | 61.4° |
| CD2 | CG | CB | HB1C | 142.5° | 153.9° |
| CD2 | CG | CB | HB2C | 96.6° | 82.9° |
| OD1 | CG | CB | HG | 122.4° | 123.8° |
| OD1 | CG | CB | CA | 95.1° | 82.8° |
| OD1 | CG | CD2 | HD21 | 22.9° | 37.8° |
| OD1 | CG | CD2 | HD22 | 143.6° | 160.1° |
| OD1 | CG | CB | HB1C | 24.5° | 35.8° |
| OD1 | CG | CB | HB2C | 145.3° | 159.1° |
| CG | CB | CA | HB1C | 119.5° | 118.5° |
| CG | CB | CA | HB2C | 119.6° | 118.3° |
| CG | CB | CA | C | 136.9° | 141.4° |
| CB | CG | CD2 | HD21 | 137.4° | 155.9° |
| CB | CG | CD2 | HD22 | 101.9° | 81.8° |
| CG | CB | CA | HA | 102.6° | 97.5° |
| CB | CG | OD1 | HD1 | 66.1° | 173.6° |
| CG | CB | HB1C | HB2C | 121.3° | 123.2° |
| CB | CA | C | HA | 120.4° | 121.0° |
| CB | CA | C | O | 76.2° | 99.4° |
| CB | CA | C | NAR | 100.9° | 80.6° |
| CA | CB | CG | HG | 142.5° | 153.4° |
| CA | CB | HB1C | HB2C | 121.3° | 123.1° |
| CA | C | O | NAR | 176.7° | 180.0° |
| CA | C | NAR | CAL | 178.9° | 180.0° |
| C | CA | CB | HB1C | 103.5° | 100.2° |
| C | CA | CB | HB2C | 17.3° | 23.1° |
| CA | C | NAR | HAR | 1.1° | 0.1° |
| O | C | NAR | CAL | 2.0° | 0.0° |
| O | C | CA | HA | 163.5° | 139.6° |
| O | C | NAR | HAR | 178.0° | 179.9° |
| C | NAR | CAL | HAR | 180.0° | 179.9° |
| C | NAR | CAL | CAX | 83.0° | 180.0° |
| NAR | C | CA | HA | 19.4° | 40.4° |
| C | NAR | CAL | HAL1 | 37.0° | 60.0° |
| C | NAR | CAL | HAL2 | 157.0° | 60.0° |
| NAR | CAL | CAX | HAL1 | 120.0° | 120.0° |
| NAR | CAL | CAX | HAL2 | 120.0° | 120.0° |
| NAR | CAL | CAX | CAF | 20.9° | 90.1° |
| NAR | CAL | CAX | CAE | 159.4° | 90.3° |
| NAR | CAL | HAL1 | HAL2 | 119.9° | 120.0° |
| CAL | CAX | CAF | CAE | 179.7° | 179.6° |
| CAL | CAX | CAF | CAH | 179.5° | 180.0° |
| CAL | CAX | CAE | CAG | 179.5° | 180.0° |
| CAX | CAL | NAR | HAR | 97.0° | 0.0° |
| CAX | CAL | HAL1 | HAL2 | 119.9° | 120.0° |
| CAL | CAX | CAF | HAF | 0.5° | 0.1° |
| CAL | CAX | CAE | HAE | 0.5° | 0.0° |
| CAX | CAF | CAH | HAF | 180.0° | 179.9° |
| CAX | CAF | CAH | CAY | 0.9° | 0.1° |
| CAF | CAX | CAE | CAG | 0.8° | 0.3° |
| CAF | CAX | CAL | HAL1 | 140.9° | 30.0° |
| CAF | CAX | CAL | HAL2 | 99.1° | 150.0° |
| CAF | CAX | CAE | HAE | 179.2° | 179.7° |
| CAX | CAF | CAH | HAH | 179.0° | 179.9° |
| CAE | CAX | CAF | CAH | 0.7° | 0.4° |
| CAX | CAE | CAG | HAE | 180.0° | 180.0° |
| CAX | CAE | CAG | CAY | 1.0° | 0.0° |
| CAE | CAX | CAL | HAL1 | 39.3° | 149.7° |
| CAE | CAX | CAL | HAL2 | 80.6° | 29.7° |
| CAE | CAX | CAF | HAF | 179.3° | 179.7° |
| CAX | CAE | CAG | HAG | 179.0° | 180.0° |
| CAF | CAH | CAY | HAH | 180.0° | 180.0° |
| CAF | CAH | CAY | CAG | 1.2° | 0.3° |
| CAF | CAH | CAY | CBA | 179.4° | 180.0° |
| CAH | CAY | CAG | CAE | 1.2° | 0.3° |
| CAH | CAY | CAG | CBA | 178.4° | 179.7° |
| CAH | CAY | CBA | CAJ | 51.3° | 180.0° |
| CAH | CAY | CBA | OAS | 132.9° | 0.3° |
| CAY | CAH | CAF | HAF | 179.1° | 180.0° |
| CAH | CAY | CAG | HAG | 178.8° | 179.7° |
| CAE | CAG | CAY | HAG | 180.0° | 180.0° |
| CAE | CAG | CAY | CBA | 179.6° | 179.9° |
| CAG | CAY | CBA | CAJ | 127.0° | 0.3° |
| CAG | CAY | CBA | OAS | 48.8° | 180.0° |
| CAY | CAG | CAE | HAE | 179.0° | 180.0° |
| CAG | CAY | CAH | HAH | 178.8° | 179.8° |
| CAY | CBA | CAJ | OAS | 176.3° | 179.8° |
| CAY | CBA | CAJ | NAP | 176.8° | 180.0° |
| CAY | CBA | OAS | CAI | 177.0° | 179.8° |
| CBA | CAY | CAH | HAH | 0.6° | 0.0° |
| CBA | CAY | CAG | HAG | 0.4° | 0.0° |
| CAY | CBA | CAJ | HAJ | 3.3° | 0.0° |
| CBA | CAJ | NAP | HAJ | 180.0° | 180.0° |
| CBA | CAJ | NAP | CAI | 0.3° | 0.0° |
| CAJ | CBA | OAS | CAI | 0.3° | 0.4° |
| OAS | CBA | CAJ | NAP | 0.4° | 0.3° |
| CBA | OAS | CAI | NAP | 0.1° | 0.4° |
| OAS | CBA | CAJ | HAJ | 179.6° | 179.8° |
| CBA | OAS | CAI | HAI | 179.9° | 179.8° |
| CAJ | NAP | CAI | OAS | 0.1° | 0.3° |
| CAJ | NAP | CAI | HAI | 179.9° | 180.0° |
| NAP | CAI | OAS | HAI | 180.0° | 179.8° |
| CAI | NAP | CAJ | HAJ | 179.7° | 180.0° |
| HAA1 | CAA | HAA2 | HAA3 | 120.0° | 120.0° |
| HD21 | CD2 | CG | HG | 102.8° | 86.0° |
| HD22 | CD2 | CG | HG | 18.0° | 36.3° |
| HA | CA | CB | HB1C | 17.0° | 21.0° |
| HA | CA | CB | HB2C | 137.9° | 144.2° |
| HG | CG | OD1 | HD1 | 55.4° | 62.4° |
| HG | CG | CB | HB1C | 97.9° | 88.0° |
| HG | CG | CB | HB2C | 22.9° | 35.2° |
| HAR | NAR | CAL | HAL1 | 143.0° | 120.0° |
| HAR | NAR | CAL | HAL2 | 23.0° | 119.9° |
| HAF | CAF | CAH | HAH | 1.0° | 0.0° |
| HAE | CAE | CAG | HAG | 1.0° | 0.0° |
