CUG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAL | CAX | sing | 1.50Å | 1.51Å | |
| CAL | SAT | sing | 1.82Å | 1.76Å | |
| CAK | CAX | sing | 1.51Å | 1.51Å | |
| CAK | O2 | sing | 1.43Å | 1.43Å | |
| CAX | CBA | doub | 1.31Å | 1.33Å | |
| OAE | CAW | doub | 1.22Å | 1.22Å | |
| SAT | CB | sing | 1.82Å | 1.76Å | |
| NBI | CB | sing | 1.47Å | 1.46Å | |
| NBI | CBA | sing | 1.39Å | 1.34Å | |
| CB | CA | sing | 1.53Å | 1.56Å | |
| CBA | CAV | sing | 1.47Å | 1.46Å | |
| OAI | CAV | doub | 1.22Å | 1.25Å | |
| CAW | N | sing | 1.35Å | 1.34Å | |
| CAW | CAZ | sing | 1.48Å | 1.47Å | |
| N | CA | sing | 1.46Å | 1.60Å | |
| CAV | OAD | sing | 1.35Å | 1.25Å | |
| CA | C | sing | 1.51Å | 1.67Å | |
| C | O | doub | 1.21Å | 1.10Å | |
| CAZ | NAM | doub | 1.30Å | 1.27Å | |
| CAZ | CBC | sing | 1.48Å | 1.50Å | |
| NAM | OAR | sing | 1.42Å | 1.26Å | |
| CAJ | CBC | doub | 1.35Å | 1.41Å | Aromatic |
| CAJ | SAU | sing | 1.76Å | 1.74Å | Aromatic |
| CBC | NAN | sing | 1.33Å | 1.38Å | Aromatic |
| CAA | OAR | sing | 1.43Å | 1.43Å | |
| SAU | CBB | sing | 1.76Å | 1.72Å | Aromatic |
| NAN | CBB | doub | 1.30Å | 1.35Å | Aromatic |
| CBB | NAC | sing | 1.39Å | 1.35Å | |
| N | H1 | sing | 0.97Å | 1.00Å | |
| CA | H2 | sing | 1.09Å | 1.10Å | |
| CB | H4 | sing | 1.09Å | 1.10Å | |
| CAA | H5 | sing | 1.09Å | 1.10Å | |
| CAA | H6 | sing | 1.09Å | 1.10Å | |
| CAA | H7 | sing | 1.09Å | 1.10Å | |
| CAJ | H8 | sing | 1.08Å | 1.08Å | |
| CAK | H9 | sing | 1.09Å | 1.10Å | |
| CAK | H10 | sing | 1.09Å | 1.10Å | |
| CAL | H11 | sing | 1.09Å | 1.10Å | |
| CAL | H12 | sing | 1.09Å | 1.10Å | |
| NAC | H15 | sing | 0.97Å | 1.00Å | |
| NAC | H16 | sing | 0.97Å | 1.00Å | |
| NBI | H17 | sing | 0.97Å | 1.00Å | |
| O2 | H19 | sing | 0.97Å | 0.95Å | |
| OAD | H20 | sing | 0.97Å | 0.95Å | |
| C | O1 | sing | 1.34Å | 1.60Å | |
| O1 | H3 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAX | CAL | SAT | 109.4° | 109.4° |
| CAL | CAX | CAK | 118.4° | 117.2° |
| CAL | CAX | CBA | 120.9° | 125.7° |
| CAX | CAL | H11 | 109.5° | 109.4° |
| CAX | CAL | H12 | 109.5° | 109.5° |
| CAL | SAT | CB | 105.2° | 101.2° |
| SAT | CAL | H11 | 109.5° | 109.4° |
| SAT | CAL | H12 | 109.5° | 109.6° |
| CAX | CAK | O2 | 108.5° | 109.4° |
| CAK | CAX | CBA | 120.8° | 117.1° |
| CAX | CAK | H9 | 109.7° | 109.5° |
| CAX | CAK | H10 | 109.7° | 109.5° |
| O2 | CAK | H9 | 109.7° | 109.5° |
| O2 | CAK | H10 | 109.7° | 109.4° |
| CAK | O2 | H19 | 109.5° | 114.0° |
| CAX | CBA | NBI | 121.0° | 127.2° |
| CAX | CBA | CAV | 119.8° | 116.4° |
| OAE | CAW | N | 119.8° | 120.0° |
| OAE | CAW | CAZ | 116.9° | 120.1° |
| SAT | CB | NBI | 109.6° | 107.2° |
| SAT | CB | CA | 122.8° | 109.9° |
| SAT | CB | H4 | 108.5° | 109.9° |
| CB | NBI | CBA | 125.2° | 120.9° |
| NBI | CB | CA | 91.4° | 109.9° |
| NBI | CB | H4 | 112.5° | 110.0° |
| CB | NBI | H17 | 105.4° | 119.6° |
| NBI | CBA | CAV | 119.1° | 116.4° |
| CBA | NBI | H17 | 105.4° | 119.6° |
| CB | CA | N | 77.6° | 109.5° |
| CB | CA | C | 123.2° | 109.4° |
| CB | CA | H2 | 99.9° | 109.4° |
| CA | CB | H4 | 111.0° | 109.9° |
| CBA | CAV | OAI | 119.2° | 120.0° |
| CBA | CAV | OAD | 119.6° | 120.0° |
| OAI | CAV | OAD | 121.3° | 120.0° |
| N | CAW | CAZ | 123.3° | 120.0° |
| CAW | N | CA | 168.3° | 120.0° |
| CAW | N | H1 | 95.9° | 120.0° |
| CAW | CAZ | NAM | 113.2° | 120.0° |
| CAW | CAZ | CBC | 125.3° | 120.0° |
| N | CA | C | 148.6° | 109.5° |
| CA | N | H1 | 95.8° | 120.0° |
| N | CA | H2 | 99.6° | 109.5° |
| CAV | OAD | H20 | 109.5° | 117.0° |
| CA | C | O | 116.8° | 120.0° |
| C | CA | H2 | 99.2° | 109.5° |
| CA | C | O1 | 132.5° | 120.0° |
| O | C | O1 | 110.4° | 120.0° |
| NAM | CAZ | CBC | 121.5° | 120.0° |
| CAZ | NAM | OAR | 124.0° | 120.0° |
| CAZ | CBC | CAJ | 121.8° | 122.4° |
| CAZ | CBC | NAN | 124.0° | 122.4° |
| NAM | OAR | CAA | 120.1° | 114.0° |
| CBC | CAJ | SAU | 108.7° | 108.3° |
| CAJ | CBC | NAN | 114.1° | 115.2° |
| CBC | CAJ | H8 | 125.7° | 125.9° |
| CAJ | SAU | CBB | 91.7° | 90.1° |
| SAU | CAJ | H8 | 125.7° | 125.8° |
| CBC | NAN | CBB | 112.9° | 116.9° |
| OAR | CAA | H5 | 109.5° | 109.5° |
| OAR | CAA | H6 | 109.5° | 109.5° |
| OAR | CAA | H7 | 109.5° | 109.5° |
| SAU | CBB | NAN | 112.6° | 109.5° |
| SAU | CBB | NAC | 124.0° | 125.2° |
| NAN | CBB | NAC | 123.4° | 125.2° |
| CBB | NAC | H15 | 109.5° | 120.0° |
| CBB | NAC | H16 | 109.4° | 119.9° |
| H5 | CAA | H6 | 109.5° | 109.4° |
| H5 | CAA | H7 | 109.4° | 109.5° |
| H6 | CAA | H7 | 109.5° | 109.5° |
| H9 | CAK | H10 | 109.5° | 109.5° |
| H11 | CAL | H12 | 109.5° | 109.6° |
| H15 | NAC | H16 | 109.5° | 120.1° |
| C | O1 | H3 | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAX | CAL | SAT | H11 | 120.0° | 119.9° |
| CAX | CAL | SAT | H12 | 120.0° | 120.0° |
| CAL | CAX | CAK | CBA | 179.7° | 179.9° |
| CAL | CAX | CAK | O2 | 59.9° | 60.4° |
| CAX | CAL | SAT | CB | 48.6° | 45.2° |
| CAL | CAX | CBA | NBI | 19.2° | 1.0° |
| CAL | CAX | CBA | CAV | 163.2° | 179.0° |
| CAL | CAX | CAK | H9 | 179.8° | 59.6° |
| CAL | CAX | CAK | H10 | 59.9° | 179.7° |
| CAX | CAL | H11 | H12 | 120.0° | 120.0° |
| SAT | CAL | CAX | CAK | 151.1° | 158.7° |
| SAT | CAL | CAX | CBA | 29.2° | 21.4° |
| CAL | SAT | CB | NBI | 27.8° | 56.3° |
| CAL | SAT | CB | CA | 132.9° | 175.7° |
| CAL | SAT | CB | H4 | 95.4° | 63.3° |
| SAT | CAL | H11 | H12 | 120.0° | 120.1° |
| CAX | CAK | O2 | H9 | 119.8° | 120.0° |
| CAX | CAK | O2 | H10 | 119.9° | 120.0° |
| CAK | CAX | CBA | NBI | 160.5° | 179.1° |
| CAK | CAX | CBA | CAV | 17.1° | 0.9° |
| CAX | CAK | H9 | H10 | 120.4° | 120.1° |
| CAK | CAX | CAL | H11 | 31.1° | 38.8° |
| CAK | CAX | CAL | H12 | 88.9° | 81.3° |
| CAX | CAK | O2 | H19 | 180.0° | 175.1° |
| O2 | CAK | CAX | CBA | 120.4° | 119.5° |
| O2 | CAK | H9 | H10 | 120.4° | 120.0° |
| CAX | CBA | NBI | CB | 48.2° | 14.8° |
| CAX | CBA | NBI | CAV | 177.6° | 180.0° |
| CAX | CBA | CAV | OAI | 117.7° | 95.3° |
| CAX | CBA | CAV | OAD | 62.5° | 84.6° |
| CBA | CAX | CAK | H9 | 0.6° | 120.5° |
| CBA | CAX | CAK | H10 | 119.8° | 0.4° |
| CBA | CAX | CAL | H11 | 149.2° | 141.3° |
| CBA | CAX | CAL | H12 | 90.8° | 98.6° |
| CAX | CBA | NBI | H17 | 170.3° | 165.1° |
| OAE | CAW | N | CAZ | 179.5° | 180.0° |
| OAE | CAW | N | CA | 91.0° | 0.0° |
| OAE | CAW | CAZ | NAM | 54.8° | 180.0° |
| OAE | CAW | CAZ | CBC | 123.9° | 0.0° |
| OAE | CAW | N | H1 | 88.9° | 179.7° |
| SAT | CB | NBI | CA | 125.7° | 119.4° |
| SAT | CB | NBI | H4 | 120.8° | 119.5° |
| SAT | CB | NBI | CBA | 17.4° | 44.7° |
| SAT | CB | CA | H4 | 130.7° | 121.1° |
| SAT | CB | CA | N | 59.7° | 53.9° |
| SAT | CB | CA | C | 146.0° | 66.2° |
| SAT | CB | CA | H2 | 38.1° | 173.9° |
| CB | SAT | CAL | H11 | 168.6° | 165.1° |
| CB | SAT | CAL | H12 | 71.3° | 74.8° |
| SAT | CB | NBI | H17 | 139.5° | 135.3° |
| CB | NBI | CBA | H17 | 122.1° | 180.0° |
| NBI | CB | CA | H4 | 114.8° | 121.2° |
| CB | NBI | CBA | CAV | 134.2° | 165.2° |
| NBI | CB | CA | N | 174.2° | 63.9° |
| NBI | CB | CA | C | 31.5° | 176.1° |
| NBI | CB | CA | H2 | 76.4° | 56.1° |
| CBA | NBI | CB | CA | 108.3° | 164.1° |
| NBI | CBA | CAV | OAI | 60.0° | 84.7° |
| NBI | CBA | CAV | OAD | 119.9° | 95.4° |
| CBA | NBI | CB | H4 | 138.2° | 74.8° |
| CB | CA | N | CAW | 137.6° | 154.7° |
| CB | CA | N | C | 135.8° | 120.0° |
| CB | CA | N | H2 | 98.1° | 120.0° |
| CB | CA | C | H2 | 108.3° | 119.9° |
| CB | CA | C | O | 150.0° | 120.0° |
| CB | CA | N | H1 | 42.4° | 25.0° |
| CA | CB | NBI | H17 | 13.8° | 15.9° |
| CB | CA | C | O1 | 37.9° | 60.0° |
| CBA | CAV | OAI | OAD | 179.8° | 179.9° |
| CAV | CBA | NBI | H17 | 12.1° | 14.9° |
| CBA | CAV | OAD | H20 | 179.8° | 180.0° |
| OAI | CAV | OAD | H20 | 0.0° | 0.1° |
| CAW | N | CA | H1 | 180.0° | 179.7° |
| CAW | N | CA | C | 1.8° | 85.3° |
| N | CAW | CAZ | NAM | 124.7° | 0.0° |
| N | CAW | CAZ | CBC | 56.6° | 180.0° |
| CAW | N | CA | H2 | 124.3° | 34.7° |
| CAZ | CAW | N | CA | 88.5° | 180.0° |
| CAW | CAZ | NAM | CBC | 178.8° | 180.0° |
| CAW | CAZ | NAM | OAR | 179.7° | 174.0° |
| CAW | CAZ | CBC | CAJ | 2.7° | 175.3° |
| CAW | CAZ | CBC | NAN | 177.8° | 4.7° |
| CAZ | CAW | N | H1 | 91.5° | 0.3° |
| N | CA | C | H2 | 126.2° | 120.0° |
| N | CA | C | O | 84.6° | 0.0° |
| N | CA | CB | H4 | 71.0° | 175.0° |
| N | CA | C | O1 | 87.6° | 180.0° |
| CA | C | O | O1 | 173.8° | 180.0° |
| C | CA | N | H1 | 178.2° | 95.0° |
| C | CA | CB | H4 | 83.3° | 54.9° |
| CA | C | O1 | H3 | 172.5° | 180.0° |
| O | C | CA | H2 | 41.6° | 120.0° |
| O | C | O1 | H3 | 0.0° | 0.0° |
| NAM | CAZ | CBC | CAJ | 175.9° | 4.7° |
| NAM | CAZ | CBC | NAN | 3.6° | 175.3° |
| CAZ | NAM | OAR | CAA | 144.7° | 180.0° |
| CBC | CAZ | NAM | OAR | 1.0° | 6.0° |
| CAZ | CBC | CAJ | NAN | 179.6° | 180.0° |
| CAZ | CBC | CAJ | SAU | 179.7° | 180.0° |
| CAZ | CBC | NAN | CBB | 179.8° | 180.0° |
| CAZ | CBC | CAJ | H8 | 0.3° | 0.3° |
| NAM | OAR | CAA | H5 | 180.0° | 60.0° |
| NAM | OAR | CAA | H6 | 60.0° | 180.0° |
| NAM | OAR | CAA | H7 | 60.0° | 60.0° |
| CBC | CAJ | SAU | H8 | 180.0° | 179.7° |
| CBC | CAJ | SAU | CBB | 0.0° | 0.0° |
| CAJ | CBC | NAN | CBB | 0.2° | 0.0° |
| SAU | CAJ | CBC | NAN | 0.1° | 0.0° |
| CAJ | SAU | CBB | NAN | 0.1° | 0.1° |
| CAJ | SAU | CBB | NAC | 179.9° | 180.0° |
| CBC | NAN | CBB | SAU | 0.2° | 0.1° |
| CBC | NAN | CBB | NAC | 180.0° | 180.0° |
| NAN | CBC | CAJ | H8 | 179.9° | 179.7° |
| OAR | CAA | H5 | H6 | 120.0° | 120.0° |
| OAR | CAA | H5 | H7 | 120.0° | 120.0° |
| OAR | CAA | H6 | H7 | 120.0° | 120.0° |
| SAU | CBB | NAN | NAC | 179.8° | 179.9° |
| CBB | SAU | CAJ | H8 | 180.0° | 179.7° |
| SAU | CBB | NAC | H15 | 0.0° | 180.0° |
| SAU | CBB | NAC | H16 | 120.0° | 0.1° |
| NAN | CBB | NAC | H15 | 179.8° | 0.0° |
| NAN | CBB | NAC | H16 | 59.8° | 180.0° |
| CBB | NAC | H15 | H16 | 120.0° | 180.0° |
| H1 | N | CA | H2 | 55.7° | 145.0° |
| H2 | CA | CB | H4 | 168.8° | 65.0° |
| H2 | CA | C | O1 | 146.2° | 60.0° |
| H4 | CB | NBI | H17 | 99.7° | 105.2° |
| H5 | CAA | H6 | H7 | 120.0° | 120.0° |
| H9 | CAK | O2 | H19 | 60.2° | 65.0° |
| H10 | CAK | O2 | H19 | 60.1° | 55.1° |
