G0K
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| NAD | CAF | doub | 1.32Å | 1.40Å | Aromatic |
| NAD | CAB | sing | 1.32Å | 1.40Å | Aromatic |
| CAF | CAE | sing | 1.38Å | 1.39Å | Aromatic |
| CAB | CAA | doub | 1.39Å | 1.39Å | Aromatic |
| CAE | CAC | doub | 1.38Å | 1.39Å | Aromatic |
| CAA | CAC | sing | 1.40Å | 1.39Å | Aromatic |
| CAA | C2 | sing | 1.48Å | 1.40Å | |
| C2 | N1 | doub | 1.33Å | 1.34Å | Aromatic |
| C2 | N3 | sing | 1.32Å | 1.34Å | Aromatic |
| N1 | C6 | sing | 1.33Å | 1.35Å | Aromatic |
| NAM | C6 | sing | 1.38Å | 1.35Å | |
| NAM | CAN | sing | 1.40Å | 1.35Å | |
| C6 | C5 | doub | 1.42Å | 1.41Å | Aromatic |
| N3 | C4 | doub | 1.34Å | 1.34Å | Aromatic |
| CBD | CAS | sing | 1.51Å | 1.41Å | |
| CAN | CAS | doub | 1.39Å | 1.39Å | Aromatic |
| CAN | CAP | sing | 1.39Å | 1.40Å | Aromatic |
| CAS | CAR | sing | 1.38Å | 1.40Å | Aromatic |
| C4 | C5 | sing | 1.42Å | 1.40Å | Aromatic |
| C4 | NBH | sing | 1.33Å | 1.33Å | Aromatic |
| C5 | CBG | sing | 1.40Å | 1.40Å | Aromatic |
| CAP | CAO | doub | 1.39Å | 1.39Å | Aromatic |
| CAR | CAQ | doub | 1.38Å | 1.40Å | Aromatic |
| NBH | CBF | doub | 1.31Å | 1.40Å | Aromatic |
| CBG | CBE | doub | 1.37Å | 1.40Å | Aromatic |
| CAO | CAQ | sing | 1.40Å | 1.40Å | Aromatic |
| CAO | CAT | sing | 1.48Å | 1.41Å | |
| OBC | CAT | doub | 1.22Å | 1.24Å | |
| FBK | CBB | sing | 1.40Å | 1.27Å | |
| CAT | NAU | sing | 1.35Å | 1.36Å | |
| CBF | CBE | sing | 1.39Å | 1.38Å | Aromatic |
| NAU | CAV | sing | 1.40Å | 1.37Å | |
| CAZ | CAV | doub | 1.39Å | 1.41Å | Aromatic |
| CAZ | CAX | sing | 1.38Å | 1.41Å | Aromatic |
| CBB | FBI | sing | 1.40Å | 1.33Å | |
| CBB | CAX | sing | 1.51Å | 1.42Å | |
| CBB | FBJ | sing | 1.40Å | 1.33Å | |
| CAV | CBA | sing | 1.39Å | 1.39Å | Aromatic |
| CAX | CAW | doub | 1.38Å | 1.39Å | Aromatic |
| CBA | CAY | doub | 1.38Å | 1.39Å | Aromatic |
| CAW | CAY | sing | 1.38Å | 1.39Å | Aromatic |
| CAZ | H1 | sing | 1.08Å | 1.08Å | |
| CAW | H2 | sing | 1.08Å | 1.08Å | |
| CAY | H3 | sing | 1.08Å | 1.08Å | |
| CBA | H4 | sing | 1.08Å | 1.08Å | |
| NAU | H5 | sing | 0.97Å | 1.00Å | |
| CAP | H6 | sing | 1.08Å | 1.08Å | |
| CAQ | H7 | sing | 1.08Å | 1.08Å | |
| CAR | H8 | sing | 1.08Å | 1.08Å | |
| CBD | H9 | sing | 1.09Å | 1.10Å | |
| CBD | H10 | sing | 1.09Å | 1.10Å | |
| CBD | H11 | sing | 1.09Å | 1.10Å | |
| NAM | H12 | sing | 0.97Å | 1.00Å | |
| CBG | H13 | sing | 1.08Å | 1.08Å | |
| CBE | H14 | sing | 1.08Å | 1.08Å | |
| CBF | H15 | sing | 1.08Å | 1.08Å | |
| CAC | H16 | sing | 1.08Å | 1.08Å | |
| CAE | H17 | sing | 1.08Å | 1.08Å | |
| CAF | H18 | sing | 1.08Å | 1.08Å | |
| CAB | H19 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAF | NAD | CAB | 119.3° | 121.9° |
| NAD | CAF | CAE | 120.7° | 121.0° |
| NAD | CAF | H18 | 119.7° | 119.4° |
| NAD | CAB | CAA | 119.8° | 120.6° |
| NAD | CAB | H19 | 120.1° | 119.8° |
| CAF | CAE | CAC | 119.8° | 119.3° |
| CAF | CAE | H17 | 120.1° | 120.3° |
| CAE | CAF | H18 | 119.6° | 119.5° |
| CAB | CAA | CAC | 120.4° | 118.9° |
| CAB | CAA | C2 | 120.4° | 120.5° |
| CAA | CAB | H19 | 120.1° | 119.6° |
| CAE | CAC | CAA | 119.9° | 118.3° |
| CAE | CAC | H16 | 120.1° | 120.8° |
| CAC | CAE | H17 | 120.1° | 120.4° |
| CAC | CAA | C2 | 119.1° | 120.6° |
| CAA | CAC | H16 | 120.0° | 120.9° |
| CAA | C2 | N1 | 120.3° | 118.6° |
| CAA | C2 | N3 | 120.8° | 118.6° |
| N1 | C2 | N3 | 118.9° | 122.8° |
| C2 | N1 | C6 | 123.3° | 121.2° |
| C2 | N3 | C4 | 121.4° | 120.5° |
| N1 | C6 | NAM | 114.6° | 120.9° |
| N1 | C6 | C5 | 119.2° | 118.3° |
| C6 | NAM | CAN | 128.0° | 120.0° |
| NAM | C6 | C5 | 126.1° | 120.8° |
| C6 | NAM | H12 | 116.0° | 120.0° |
| NAM | CAN | CAS | 117.5° | 120.0° |
| NAM | CAN | CAP | 122.1° | 120.0° |
| CAN | NAM | H12 | 116.0° | 120.0° |
| C6 | C5 | C4 | 116.0° | 118.5° |
| C6 | C5 | CBG | 125.5° | 122.2° |
| N3 | C4 | C5 | 121.3° | 118.5° |
| N3 | C4 | NBH | 117.6° | 121.7° |
| CBD | CAS | CAN | 120.6° | 119.9° |
| CBD | CAS | CAR | 120.7° | 119.9° |
| CAS | CBD | H9 | 109.5° | 109.4° |
| CAS | CBD | H10 | 109.5° | 109.4° |
| CAS | CBD | H11 | 109.4° | 109.5° |
| CAS | CAN | CAP | 120.4° | 120.0° |
| CAN | CAS | CAR | 118.7° | 120.2° |
| CAN | CAP | CAO | 121.1° | 119.8° |
| CAN | CAP | H6 | 119.4° | 120.1° |
| CAS | CAR | CAQ | 120.8° | 120.2° |
| CAS | CAR | H8 | 119.6° | 119.9° |
| C5 | C4 | NBH | 121.1° | 119.8° |
| C4 | C5 | CBG | 118.5° | 119.3° |
| C4 | NBH | CBF | 120.8° | 121.2° |
| C5 | CBG | CBE | 120.3° | 118.0° |
| C5 | CBG | H13 | 119.9° | 120.9° |
| CAP | CAO | CAQ | 118.5° | 119.8° |
| CAP | CAO | CAT | 118.0° | 120.1° |
| CAO | CAP | H6 | 119.4° | 120.1° |
| CAR | CAQ | CAO | 120.4° | 120.0° |
| CAR | CAQ | H7 | 119.8° | 120.0° |
| CAQ | CAR | H8 | 119.6° | 119.9° |
| NBH | CBF | CBE | 120.0° | 121.8° |
| NBH | CBF | H15 | 120.0° | 119.0° |
| CBG | CBE | CBF | 119.3° | 119.9° |
| CBE | CBG | H13 | 119.9° | 121.0° |
| CBG | CBE | H14 | 120.3° | 120.1° |
| CAQ | CAO | CAT | 123.3° | 120.1° |
| CAO | CAQ | H7 | 119.8° | 120.0° |
| CAO | CAT | OBC | 117.9° | 120.0° |
| CAO | CAT | NAU | 117.4° | 120.0° |
| OBC | CAT | NAU | 124.3° | 120.0° |
| FBK | CBB | FBI | 108.7° | 109.4° |
| FBK | CBB | CAX | 110.6° | 109.5° |
| FBK | CBB | FBJ | 108.1° | 109.5° |
| CAT | NAU | CAV | 124.1° | 120.0° |
| CAT | NAU | H5 | 118.0° | 120.0° |
| CBF | CBE | H14 | 120.4° | 120.0° |
| CBE | CBF | H15 | 120.0° | 119.2° |
| NAU | CAV | CAZ | 125.5° | 120.1° |
| NAU | CAV | CBA | 117.1° | 120.0° |
| CAV | NAU | H5 | 117.9° | 120.0° |
| CAV | CAZ | CAX | 122.5° | 119.9° |
| CAZ | CAV | CBA | 117.3° | 119.9° |
| CAV | CAZ | H1 | 118.7° | 120.0° |
| CAZ | CAX | CBB | 121.7° | 120.0° |
| CAZ | CAX | CAW | 118.6° | 120.1° |
| CAX | CAZ | H1 | 118.7° | 120.0° |
| FBI | CBB | CAX | 110.7° | 109.5° |
| FBI | CBB | FBJ | 108.1° | 109.4° |
| CAX | CBB | FBJ | 110.6° | 109.5° |
| CBB | CAX | CAW | 119.7° | 119.9° |
| CAV | CBA | CAY | 120.6° | 119.9° |
| CAV | CBA | H4 | 119.7° | 120.1° |
| CAX | CAW | CAY | 119.5° | 120.1° |
| CAX | CAW | H2 | 120.2° | 120.0° |
| CBA | CAY | CAW | 121.5° | 120.1° |
| CBA | CAY | H3 | 119.2° | 120.0° |
| CAY | CBA | H4 | 119.7° | 120.0° |
| CAY | CAW | H2 | 120.3° | 119.9° |
| CAW | CAY | H3 | 119.2° | 119.9° |
| H9 | CBD | H10 | 109.5° | 109.4° |
| H9 | CBD | H11 | 109.5° | 109.5° |
| H10 | CBD | H11 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| NAD | CAF | CAE | H18 | 180.0° | 179.9° |
| CAF | NAD | CAB | CAA | 0.6° | 0.5° |
| NAD | CAF | CAE | CAC | 0.2° | 0.0° |
| NAD | CAF | CAE | H17 | 179.8° | 180.0° |
| CAF | NAD | CAB | H19 | 179.4° | 180.0° |
| CAB | NAD | CAF | CAE | 0.4° | 0.3° |
| NAD | CAB | CAA | H19 | 180.0° | 179.5° |
| NAD | CAB | CAA | CAC | 0.7° | 0.5° |
| NAD | CAB | CAA | C2 | 179.9° | 179.7° |
| CAB | NAD | CAF | H18 | 179.7° | 179.7° |
| CAF | CAE | CAC | H17 | 180.0° | 179.9° |
| CAF | CAE | CAC | CAA | 0.3° | 0.0° |
| CAF | CAE | CAC | H16 | 179.7° | 179.9° |
| CAB | CAA | CAC | CAE | 0.6° | 0.2° |
| CAB | CAA | CAC | C2 | 179.4° | 179.8° |
| CAB | CAA | C2 | N1 | 2.4° | 5.0° |
| CAB | CAA | C2 | N3 | 176.6° | 175.0° |
| CAB | CAA | CAC | H16 | 179.4° | 179.8° |
| CAE | CAC | CAA | H16 | 180.0° | 180.0° |
| CAE | CAC | CAA | C2 | 180.0° | 180.0° |
| CAC | CAE | CAF | H18 | 179.8° | 180.0° |
| CAC | CAA | C2 | N1 | 178.2° | 174.8° |
| CAC | CAA | C2 | N3 | 2.8° | 5.2° |
| CAA | CAC | CAE | H17 | 179.7° | 180.0° |
| CAC | CAA | CAB | H19 | 179.3° | 180.0° |
| CAA | C2 | N1 | N3 | 179.0° | 180.0° |
| CAA | C2 | N1 | C6 | 179.8° | 180.0° |
| CAA | C2 | N3 | C4 | 179.9° | 179.7° |
| C2 | CAA | CAC | H16 | 0.0° | 0.0° |
| C2 | CAA | CAB | H19 | 0.1° | 0.3° |
| C2 | N1 | C6 | NAM | 178.4° | 180.0° |
| C2 | N1 | C6 | C5 | 1.0° | 0.2° |
| N1 | C2 | N3 | C4 | 0.9° | 0.3° |
| N3 | C2 | N1 | C6 | 1.2° | 0.0° |
| C2 | N3 | C4 | C5 | 0.5° | 0.2° |
| C2 | N3 | C4 | NBH | 179.8° | 179.8° |
| N1 | C6 | NAM | C5 | 179.3° | 179.7° |
| N1 | C6 | NAM | CAN | 157.8° | 7.0° |
| N1 | C6 | C5 | C4 | 0.4° | 0.3° |
| N1 | C6 | C5 | CBG | 179.8° | 179.8° |
| N1 | C6 | NAM | H12 | 22.1° | 173.1° |
| C6 | NAM | CAN | H12 | 180.0° | 180.0° |
| C6 | NAM | CAN | CAS | 107.6° | 156.3° |
| C6 | NAM | CAN | CAP | 73.9° | 24.5° |
| NAM | C6 | C5 | C4 | 178.8° | 180.0° |
| NAM | C6 | C5 | CBG | 1.0° | 0.1° |
| CAN | NAM | C6 | C5 | 22.8° | 173.3° |
| NAM | CAN | CAS | CBD | 1.9° | 0.5° |
| NAM | CAN | CAS | CAP | 178.6° | 179.2° |
| NAM | CAN | CAS | CAR | 178.6° | 180.0° |
| NAM | CAN | CAP | CAO | 178.8° | 179.7° |
| NAM | CAN | CAP | H6 | 1.2° | 0.2° |
| C6 | C5 | C4 | N3 | 0.2° | 0.0° |
| C6 | C5 | C4 | CBG | 179.8° | 179.9° |
| C6 | C5 | C4 | NBH | 179.9° | 180.0° |
| C6 | C5 | CBG | CBE | 179.9° | 180.0° |
| C5 | C6 | NAM | H12 | 157.2° | 6.7° |
| C6 | C5 | CBG | H13 | 0.1° | 0.1° |
| N3 | C4 | C5 | NBH | 179.7° | 180.0° |
| N3 | C4 | C5 | CBG | 180.0° | 180.0° |
| N3 | C4 | NBH | CBF | 179.8° | 180.0° |
| CBD | CAS | CAN | CAR | 179.5° | 179.5° |
| CBD | CAS | CAN | CAP | 179.6° | 179.7° |
| CBD | CAS | CAR | CAQ | 179.9° | 180.0° |
| CBD | CAS | CAR | H8 | 0.1° | 0.0° |
| CAS | CBD | H9 | H10 | 120.0° | 119.9° |
| CAS | CBD | H9 | H11 | 120.0° | 120.0° |
| CAS | CBD | H10 | H11 | 120.0° | 120.1° |
| CAS | CAN | CAP | CAO | 0.3° | 0.5° |
| CAN | CAS | CAR | CAQ | 0.4° | 0.5° |
| CAS | CAN | CAP | H6 | 179.7° | 179.4° |
| CAN | CAS | CAR | H8 | 179.6° | 179.4° |
| CAN | CAS | CBD | H9 | 89.8° | 90.5° |
| CAN | CAS | CBD | H10 | 150.2° | 29.4° |
| CAN | CAS | CBD | H11 | 30.2° | 149.5° |
| CAS | CAN | NAM | H12 | 72.5° | 23.7° |
| CAP | CAN | CAS | CAR | 0.0° | 0.8° |
| CAN | CAP | CAO | H6 | 180.0° | 179.9° |
| CAN | CAP | CAO | CAQ | 1.0° | 0.0° |
| CAN | CAP | CAO | CAT | 176.7° | 179.8° |
| CAP | CAN | NAM | H12 | 106.1° | 155.5° |
| CAS | CAR | CAQ | H8 | 180.0° | 180.0° |
| CAS | CAR | CAQ | CAO | 1.0° | 0.0° |
| CAS | CAR | CAQ | H7 | 179.0° | 180.0° |
| CAR | CAS | CBD | H9 | 89.8° | 90.1° |
| CAR | CAS | CBD | H10 | 30.2° | 150.1° |
| CAR | CAS | CBD | H11 | 150.3° | 30.0° |
| C5 | C4 | NBH | CBF | 0.1° | 0.1° |
| C4 | C5 | CBG | CBE | 0.3° | 0.0° |
| C4 | C5 | CBG | H13 | 179.7° | 180.0° |
| NBH | C4 | C5 | CBG | 0.3° | 0.1° |
| C4 | NBH | CBF | CBE | 0.0° | 0.0° |
| C4 | NBH | CBF | H15 | 180.0° | 180.0° |
| C5 | CBG | CBE | H13 | 180.0° | 180.0° |
| C5 | CBG | CBE | CBF | 0.2° | 0.0° |
| C5 | CBG | CBE | H14 | 179.7° | 179.9° |
| CAP | CAO | CAQ | CAR | 1.3° | 0.3° |
| CAP | CAO | CAQ | CAT | 175.4° | 179.8° |
| CAP | CAO | CAT | OBC | 7.5° | 5.5° |
| CAP | CAO | CAT | NAU | 179.4° | 174.5° |
| CAP | CAO | CAQ | H7 | 178.7° | 179.7° |
| CAR | CAQ | CAO | H7 | 180.0° | 180.0° |
| CAR | CAQ | CAO | CAT | 176.8° | 180.0° |
| NBH | CBF | CBE | CBG | 0.1° | 0.0° |
| NBH | CBF | CBE | H15 | 180.0° | 180.0° |
| NBH | CBF | CBE | H14 | 179.9° | 179.9° |
| CBG | CBE | CBF | H14 | 180.0° | 179.9° |
| CBG | CBE | CBF | H15 | 179.9° | 180.0° |
| CAQ | CAO | CAT | OBC | 167.9° | 174.8° |
| CAQ | CAO | CAT | NAU | 5.2° | 5.3° |
| CAQ | CAO | CAP | H6 | 179.0° | 179.9° |
| CAO | CAQ | CAR | H8 | 179.0° | 180.0° |
| CAO | CAT | OBC | NAU | 172.6° | 180.0° |
| CAO | CAT | NAU | CAV | 171.2° | 174.7° |
| CAO | CAT | NAU | H5 | 8.7° | 5.3° |
| CAT | CAO | CAP | H6 | 3.3° | 0.3° |
| CAT | CAO | CAQ | H7 | 3.3° | 0.1° |
| OBC | CAT | NAU | CAV | 1.4° | 5.3° |
| OBC | CAT | NAU | H5 | 178.6° | 174.6° |
| FBK | CBB | CAX | CAZ | 44.9° | 59.8° |
| FBK | CBB | FBI | CAX | 121.6° | 120.0° |
| FBK | CBB | FBI | FBJ | 117.1° | 120.0° |
| FBK | CBB | CAX | FBJ | 119.7° | 120.0° |
| FBK | CBB | CAX | CAW | 135.5° | 120.0° |
| CAT | NAU | CAV | H5 | 180.0° | 179.9° |
| CAT | NAU | CAV | CAZ | 25.2° | 152.4° |
| CAT | NAU | CAV | CBA | 158.8° | 27.7° |
| CBF | CBE | CBG | H13 | 179.8° | 179.9° |
| NAU | CAV | CAZ | CBA | 176.0° | 179.9° |
| NAU | CAV | CAZ | CAX | 178.7° | 179.9° |
| NAU | CAV | CBA | CAY | 178.5° | 179.7° |
| NAU | CAV | CAZ | H1 | 1.2° | 0.0° |
| NAU | CAV | CBA | H4 | 1.5° | 0.0° |
| CAV | CAZ | CAX | H1 | 180.0° | 179.9° |
| CAV | CAZ | CAX | CBB | 177.8° | 180.0° |
| CAV | CAZ | CAX | CAW | 1.8° | 0.2° |
| CAZ | CAV | CBA | CAY | 2.2° | 0.3° |
| CAZ | CAV | CBA | H4 | 177.8° | 180.0° |
| CAZ | CAV | NAU | H5 | 154.8° | 27.6° |
| CAZ | CAX | CBB | FBI | 75.6° | 179.8° |
| CAZ | CAX | CBB | CAW | 179.6° | 179.8° |
| CAZ | CAX | CBB | FBJ | 164.6° | 60.2° |
| CAX | CAZ | CAV | CBA | 2.7° | 0.0° |
| CAZ | CAX | CAW | CAY | 0.3° | 0.2° |
| CAZ | CAX | CAW | H2 | 179.7° | 179.8° |
| FBI | CBB | CAX | FBJ | 119.8° | 120.0° |
| FBI | CBB | CAX | CAW | 104.0° | 0.0° |
| CBB | CAX | CAW | CAY | 179.3° | 180.0° |
| CBB | CAX | CAZ | H1 | 2.2° | 0.1° |
| CBB | CAX | CAW | H2 | 0.7° | 0.0° |
| FBJ | CBB | CAX | CAW | 15.8° | 120.0° |
| CAV | CBA | CAY | H4 | 180.0° | 179.7° |
| CAV | CBA | CAY | CAW | 0.9° | 0.3° |
| CBA | CAV | CAZ | H1 | 177.2° | 180.0° |
| CAV | CBA | CAY | H3 | 179.1° | 179.7° |
| CBA | CAV | NAU | H5 | 21.2° | 152.4° |
| CAX | CAW | CAY | CBA | 0.1° | 0.0° |
| CAX | CAW | CAY | H2 | 180.0° | 180.0° |
| CAW | CAX | CAZ | H1 | 178.1° | 179.7° |
| CAX | CAW | CAY | H3 | 179.9° | 180.0° |
| CBA | CAY | CAW | H3 | 180.0° | 180.0° |
| CBA | CAY | CAW | H2 | 179.9° | 180.0° |
| CAW | CAY | CBA | H4 | 179.1° | 180.0° |
| H2 | CAW | CAY | H3 | 0.1° | 0.0° |
| H3 | CAY | CBA | H4 | 0.9° | 0.0° |
| H7 | CAQ | CAR | H8 | 1.0° | 0.0° |
| H9 | CBD | H10 | H11 | 120.0° | 120.0° |
| H13 | CBG | CBE | H14 | 0.3° | 0.0° |
| H14 | CBE | CBF | H15 | 0.1° | 0.1° |
| H16 | CAC | CAE | H17 | 0.3° | 0.0° |
| H17 | CAE | CAF | H18 | 0.2° | 0.1° |
