AAD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4' | O4' | sing | 1.44Å | 1.47Å | |
| C4' | C3' | sing | 1.52Å | 1.55Å | |
| C4' | C5' | sing | 1.52Å | 33.19Å | |
| C4' | HC4 | sing | 1.10Å | 1.10Å | |
| O4' | C1' | sing | 1.44Å | 1.47Å | |
| C3' | O3' | sing | 1.42Å | 1.40Å | |
| C3' | C2' | sing | 1.52Å | 1.56Å | |
| C3' | HC3 | sing | 1.09Å | 1.10Å | |
| O3' | HO3 | sing | 0.97Å | 0.95Å | |
| C2' | O2' | sing | 1.41Å | 1.37Å | |
| C2' | C1' | sing | 1.52Å | 1.51Å | |
| C2' | HC2 | sing | 1.10Å | 1.10Å | |
| O2' | HO2 | sing | 0.97Å | 0.95Å | |
| C1' | N9 | sing | 1.46Å | 1.47Å | |
| C1' | HC1 | sing | 1.09Å | 1.10Å | |
| N9 | C8 | sing | 1.37Å | 1.38Å | Aromatic |
| N9 | C4 | sing | 1.37Å | 1.41Å | Aromatic |
| C8 | N7 | doub | 1.32Å | 1.28Å | Aromatic |
| C8 | HC8 | sing | 1.08Å | 1.08Å | |
| N7 | C5 | sing | 1.37Å | 1.39Å | Aromatic |
| C5 | C6 | doub | 1.39Å | 1.46Å | Aromatic |
| C5 | C4 | sing | 1.39Å | 1.36Å | Aromatic |
| C6 | N6 | sing | 1.41Å | 1.32Å | |
| C6 | N1 | sing | 1.36Å | 1.34Å | Aromatic |
| N6 | HN61 | sing | 1.00Å | 1.00Å | |
| N6 | HN62 | sing | 1.00Å | 1.00Å | |
| N1 | C2 | doub | 1.36Å | 1.37Å | Aromatic |
| C2 | N3 | sing | 1.35Å | 1.34Å | Aromatic |
| C2 | HC2A | sing | 1.08Å | 1.08Å | |
| N3 | C4 | doub | 1.34Å | 1.36Å | Aromatic |
| N2 | O2 | sing | 1.45Å | 0.00Å | |
| N2 | HN21 | sing | 1.02Å | 0.00Å | |
| N2 | HN22 | sing | 1.02Å | 0.00Å | |
| O2 | CB | sing | 1.42Å | 0.00Å | |
| CB | CG | sing | 1.52Å | 0.00Å | |
| CB | HCB1 | sing | 1.10Å | 0.00Å | |
| CB | HCB2 | sing | 1.09Å | 0.00Å | |
| CG | SD | sing | 1.81Å | 0.00Å | |
| CG | HCG1 | sing | 1.09Å | 0.00Å | |
| CG | HCG2 | sing | 1.09Å | 0.00Å | |
| SD | CE | sing | 1.81Å | 0.00Å | |
| SD | C5' | sing | 1.82Å | 0.00Å | |
| CE | HCE1 | sing | 1.09Å | 0.00Å | |
| CE | HCE2 | sing | 1.09Å | 0.00Å | |
| CE | HCE3 | sing | 1.09Å | 0.00Å | |
| C5' | HC51 | sing | 1.09Å | 0.00Å | |
| C5' | HC52 | sing | 1.09Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4' | C4' | C3' | 105.2° | 105.7° |
| O4' | C4' | C5' | 71.5° | 109.1° |
| O4' | C4' | HC4 | 141.2° | 106.5° |
| C4' | O4' | C1' | 108.6° | 108.3° |
| C3' | C4' | C5' | 129.8° | 115.8° |
| C3' | C4' | HC4 | 94.1° | 110.1° |
| C4' | C3' | O3' | 113.7° | 111.2° |
| C4' | C3' | C2' | 104.9° | 100.6° |
| C4' | C3' | HC3 | 111.4° | 113.6° |
| C5' | C4' | HC4 | 120.0° | 109.2° |
| C4' | C5' | SD | 90.0° | 111.5° |
| C4' | C5' | HC51 | 90.0° | 110.5° |
| C4' | C5' | HC52 | 90.0° | 110.5° |
| O4' | C1' | C2' | 107.6° | 106.6° |
| O4' | C1' | N9 | 101.2° | 109.3° |
| O4' | C1' | HC1 | 118.0° | 108.7° |
| O3' | C3' | C2' | 113.8° | 109.6° |
| O3' | C3' | HC3 | 102.1° | 108.1° |
| C3' | O3' | HO3 | 109.5° | 106.6° |
| C2' | C3' | HC3 | 111.3° | 113.5° |
| C3' | C2' | O2' | 120.7° | 113.1° |
| C3' | C2' | C1' | 100.0° | 101.8° |
| C3' | C2' | HC2 | 111.9° | 110.3° |
| O2' | C2' | C1' | 117.4° | 111.8° |
| O2' | C2' | HC2 | 92.0° | 108.7° |
| C2' | O2' | HO2 | 109.5° | 107.3° |
| C1' | C2' | HC2 | 115.7° | 111.0° |
| C2' | C1' | N9 | 115.4° | 113.9° |
| C2' | C1' | HC1 | 104.5° | 112.8° |
| N9 | C1' | HC1 | 110.6° | 105.4° |
| C1' | N9 | C8 | 122.1° | 126.1° |
| C1' | N9 | C4 | 129.4° | 126.9° |
| C8 | N9 | C4 | 108.4° | 107.0° |
| N9 | C8 | N7 | 111.4° | 112.2° |
| N9 | C8 | HC8 | 124.3° | 122.2° |
| N9 | C4 | C5 | 101.9° | 105.2° |
| N9 | C4 | N3 | 130.2° | 127.5° |
| N7 | C8 | HC8 | 124.3° | 125.6° |
| C8 | N7 | C5 | 105.5° | 104.9° |
| N7 | C5 | C6 | 130.4° | 132.4° |
| N7 | C5 | C4 | 112.9° | 110.7° |
| C6 | C5 | C4 | 116.7° | 116.9° |
| C5 | C6 | N6 | 121.1° | 120.7° |
| C5 | C6 | N1 | 114.0° | 119.1° |
| C5 | C4 | N3 | 127.9° | 127.3° |
| N6 | C6 | N1 | 124.9° | 120.2° |
| C6 | N6 | HN61 | 109.5° | 119.5° |
| C6 | N6 | HN62 | 109.4° | 119.4° |
| C6 | N1 | C2 | 125.3° | 117.5° |
| HN61 | N6 | HN62 | 109.5° | 120.8° |
| N1 | C2 | N3 | 122.5° | 128.9° |
| N1 | C2 | HC2A | 118.8° | 115.5° |
| N3 | C2 | HC2A | 118.7° | 115.6° |
| C2 | N3 | C4 | 113.6° | 110.4° |
| O2 | N2 | HN21 | 90.0° | 100.5° |
| O2 | N2 | HN22 | 90.0° | 100.5° |
| N2 | O2 | CB | 90.0° | 107.4° |
| HN21 | N2 | HN22 | 90.0° | 106.5° |
| O2 | CB | CG | 90.0° | 109.7° |
| O2 | CB | HCB1 | 90.0° | 107.6° |
| O2 | CB | HCB2 | 90.0° | 108.9° |
| CG | CB | HCB1 | 90.0° | 109.7° |
| CG | CB | HCB2 | 90.0° | 112.1° |
| CB | CG | SD | 90.0° | 111.1° |
| CB | CG | HCG1 | 90.0° | 110.5° |
| CB | CG | HCG2 | 90.0° | 111.5° |
| HCB1 | CB | HCB2 | 90.0° | 108.7° |
| SD | CG | HCG1 | 90.0° | 106.8° |
| SD | CG | HCG2 | 90.0° | 107.3° |
| CG | SD | CE | 90.0° | 96.6° |
| CG | SD | C5' | 90.0° | 96.3° |
| HCG1 | CG | HCG2 | 90.0° | 109.4° |
| CE | SD | C5' | 90.0° | 96.3° |
| SD | CE | HCE1 | 90.0° | 109.3° |
| SD | CE | HCE2 | 90.0° | 109.0° |
| SD | CE | HCE3 | 90.0° | 109.0° |
| SD | C5' | HC51 | 90.0° | 107.7° |
| SD | C5' | HC52 | 90.0° | 107.8° |
| HCE1 | CE | HCE2 | 90.0° | 109.8° |
| HCE1 | CE | HCE3 | 90.0° | 109.8° |
| HCE2 | CE | HCE3 | 90.0° | 109.8° |
| HC51 | C5' | HC52 | 90.0° | 108.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4' | C4' | C3' | C5' | 78.4° | 120.9° |
| O4' | C4' | C3' | HC4 | 146.1° | 114.6° |
| O4' | C4' | C5' | HC4 | 139.2° | 116.0° |
| O4' | C4' | C3' | O3' | 101.8° | 79.0° |
| O4' | C4' | C3' | C2' | 23.0° | 37.1° |
| O4' | C4' | C3' | HC3 | 143.5° | 158.7° |
| C4' | O4' | C1' | C2' | 22.3° | 6.7° |
| C4' | O4' | C1' | N9 | 143.7° | 130.3° |
| C4' | O4' | C1' | HC1 | 95.5° | 115.1° |
| O4' | C4' | C5' | SD | 90.0° | 61.1° |
| O4' | C4' | C5' | HC51 | 90.0° | 179.1° |
| O4' | C4' | C5' | HC52 | 90.0° | 58.7° |
| C3' | C4' | C5' | HC4 | 126.2° | 124.9° |
| C3' | C4' | O4' | C1' | 1.1° | 19.2° |
| C4' | C3' | O3' | C2' | 120.0° | 110.4° |
| C4' | C3' | O3' | HC3 | 120.0° | 125.4° |
| C4' | C3' | C2' | HC3 | 120.5° | 121.7° |
| C4' | C3' | O3' | HO3 | 162.4° | 81.6° |
| C4' | C3' | C2' | O2' | 165.4° | 159.7° |
| C4' | C3' | C2' | C1' | 35.0° | 39.6° |
| C4' | C3' | C2' | HC2 | 88.1° | 78.3° |
| C3' | C4' | C5' | SD | 90.0° | 179.8° |
| C3' | C4' | C5' | HC51 | 90.0° | 60.0° |
| C3' | C4' | C5' | HC52 | 90.0° | 60.4° |
| C5' | C4' | O4' | C1' | 128.6° | 144.4° |
| C5' | C4' | C3' | O3' | 23.5° | 41.9° |
| C5' | C4' | C3' | C2' | 101.4° | 158.0° |
| C5' | C4' | C3' | HC3 | 138.1° | 80.3° |
| C4' | C5' | SD | CG | 90.0° | 82.6° |
| C4' | C5' | SD | CE | 90.0° | 180.0° |
| C4' | C5' | SD | HC51 | 90.0° | 121.4° |
| C4' | C5' | SD | HC52 | 90.0° | 121.5° |
| C4' | C5' | HC51 | HC52 | 90.0° | 121.4° |
| HC4 | C4' | O4' | C1' | 116.2° | 97.9° |
| HC4 | C4' | C3' | O3' | 112.1° | 166.4° |
| HC4 | C4' | C3' | C2' | 123.1° | 77.6° |
| HC4 | C4' | C3' | HC3 | 2.6° | 44.1° |
| HC4 | C4' | C5' | SD | 90.0° | 54.9° |
| HC4 | C4' | C5' | HC51 | 90.0° | 64.9° |
| HC4 | C4' | C5' | HC52 | 90.0° | 174.7° |
| O4' | C1' | C2' | C3' | 35.1° | 29.7° |
| O4' | C1' | C2' | O2' | 167.6° | 150.8° |
| O4' | C1' | C2' | N9 | 112.1° | 120.7° |
| O4' | C1' | C2' | HC1 | 126.2° | 119.2° |
| O4' | C1' | C2' | HC2 | 85.3° | 87.6° |
| O4' | C1' | N9 | HC1 | 125.9° | 116.7° |
| O4' | C1' | N9 | C8 | 125.3° | 146.7° |
| O4' | C1' | N9 | C4 | 58.6° | 33.3° |
| O3' | C3' | C2' | HC3 | 114.6° | 121.1° |
| O3' | C3' | C2' | O2' | 40.6° | 42.5° |
| O3' | C3' | C2' | C1' | 89.8° | 77.6° |
| O3' | C3' | C2' | HC2 | 147.0° | 164.5° |
| C2' | C3' | O3' | HO3 | 42.4° | 168.1° |
| C3' | C2' | O2' | C1' | 122.4° | 114.2° |
| C3' | C2' | O2' | HC2 | 117.1° | 122.9° |
| C3' | C2' | C1' | HC2 | 120.4° | 117.4° |
| C3' | C2' | O2' | HO2 | 144.1° | 0.1° |
| C3' | C2' | C1' | N9 | 147.3° | 150.4° |
| C3' | C2' | C1' | HC1 | 91.1° | 89.5° |
| HC3 | C3' | O3' | HO3 | 77.6° | 43.8° |
| HC3 | C3' | C2' | O2' | 74.1° | 78.5° |
| HC3 | C3' | C2' | C1' | 155.6° | 161.4° |
| HC3 | C3' | C2' | HC2 | 32.4° | 43.5° |
| O2' | C2' | C1' | HC2 | 107.1° | 121.6° |
| O2' | C2' | C1' | N9 | 80.3° | 88.5° |
| O2' | C2' | C1' | HC1 | 41.4° | 31.5° |
| C1' | C2' | O2' | HO2 | 93.6° | 114.1° |
| C2' | C1' | N9 | HC1 | 118.3° | 124.1° |
| C2' | C1' | N9 | C8 | 118.9° | 94.1° |
| C2' | C1' | N9 | C4 | 57.2° | 85.8° |
| HC2 | C2' | O2' | HO2 | 26.9° | 123.0° |
| HC2 | C2' | C1' | N9 | 26.8° | 33.0° |
| HC2 | C2' | C1' | HC1 | 148.5° | 153.1° |
| C1' | N9 | C8 | C4 | 176.8° | 180.0° |
| C1' | N9 | C8 | N7 | 176.3° | 180.0° |
| C1' | N9 | C8 | HC8 | 3.7° | 0.1° |
| C1' | N9 | C4 | C5 | 176.0° | 180.0° |
| C1' | N9 | C4 | N3 | 3.6° | 0.0° |
| HC1 | C1' | N9 | C8 | 0.5° | 30.0° |
| HC1 | C1' | N9 | C4 | 175.5° | 150.0° |
| N9 | C8 | N7 | HC8 | 180.0° | 180.0° |
| N9 | C8 | N7 | C5 | 0.2° | 0.0° |
| C8 | N9 | C4 | C5 | 0.5° | 0.0° |
| C8 | N9 | C4 | N3 | 179.9° | 180.0° |
| C4 | N9 | C8 | N7 | 0.4° | 0.0° |
| C4 | N9 | C8 | HC8 | 179.5° | 180.0° |
| N9 | C4 | C5 | N7 | 0.4° | 0.0° |
| N9 | C4 | C5 | C6 | 179.6° | 180.0° |
| N9 | C4 | C5 | N3 | 179.6° | 180.0° |
| N9 | C4 | N3 | C2 | 179.6° | 180.0° |
| C8 | N7 | C5 | C6 | 179.8° | 180.0° |
| C8 | N7 | C5 | C4 | 0.1° | 0.0° |
| HC8 | C8 | N7 | C5 | 179.8° | 180.0° |
| N7 | C5 | C6 | C4 | 180.0° | 180.0° |
| N7 | C5 | C6 | N6 | 0.3° | 0.0° |
| N7 | C5 | C6 | N1 | 180.0° | 180.0° |
| N7 | C5 | C4 | N3 | 180.0° | 180.0° |
| C5 | C6 | N6 | N1 | 179.7° | 180.0° |
| C5 | C6 | N6 | HN61 | 125.9° | 22.9° |
| C5 | C6 | N6 | HN62 | 5.9° | 150.8° |
| C5 | C6 | N1 | C2 | 0.1° | 0.0° |
| C6 | C5 | C4 | N3 | 0.0° | 0.0° |
| C4 | C5 | C6 | N6 | 179.7° | 180.0° |
| C4 | C5 | C6 | N1 | 0.0° | 0.0° |
| C5 | C4 | N3 | C2 | 0.1° | 0.0° |
| C6 | N6 | HN61 | HN62 | 120.0° | 173.6° |
| N6 | C6 | N1 | C2 | 179.8° | 180.0° |
| N1 | C6 | N6 | HN61 | 53.8° | 157.1° |
| N1 | C6 | N6 | HN62 | 173.8° | 29.2° |
| C6 | N1 | C2 | N3 | 0.2° | 0.0° |
| C6 | N1 | C2 | HC2A | 179.8° | 180.0° |
| N1 | C2 | N3 | HC2A | 180.0° | 180.0° |
| N1 | C2 | N3 | C4 | 0.2° | 0.0° |
| HC2A | C2 | N3 | C4 | 179.8° | 180.0° |
| O2 | N2 | HN21 | HN22 | 90.0° | 104.4° |
| N2 | O2 | CB | CG | 90.0° | 180.0° |
| N2 | O2 | CB | HCB1 | 90.0° | 60.7° |
| N2 | O2 | CB | HCB2 | 90.0° | 57.0° |
| HN21 | N2 | O2 | CB | 90.0° | 125.8° |
| HN22 | N2 | O2 | CB | 90.0° | 125.1° |
| O2 | CB | CG | HCB1 | 90.0° | 118.0° |
| O2 | CB | CG | HCB2 | 90.0° | 121.1° |
| O2 | CB | HCB1 | HCB2 | 90.0° | 117.8° |
| O2 | CB | CG | SD | 90.0° | 58.3° |
| O2 | CB | CG | HCG1 | 90.0° | 60.0° |
| O2 | CB | CG | HCG2 | 90.0° | 178.1° |
| CG | CB | HCB1 | HCB2 | 90.0° | 122.9° |
| CB | CG | SD | HCG1 | 90.0° | 120.6° |
| CB | CG | SD | HCG2 | 90.0° | 122.2° |
| CB | CG | HCG1 | HCG2 | 90.0° | 123.2° |
| CB | CG | SD | CE | 90.0° | 59.4° |
| CB | CG | SD | C5' | 90.0° | 156.5° |
| HCB1 | CB | CG | SD | 90.0° | 59.7° |
| HCB1 | CB | CG | HCG1 | 90.0° | 178.0° |
| HCB1 | CB | CG | HCG2 | 90.0° | 60.1° |
| HCB2 | CB | CG | SD | 90.0° | 179.4° |
| HCB2 | CB | CG | HCG1 | 90.0° | 61.0° |
| HCB2 | CB | CG | HCG2 | 90.0° | 60.9° |
| SD | CG | HCG1 | HCG2 | 90.0° | 115.8° |
| CG | SD | CE | C5' | 90.0° | 97.1° |
| CG | SD | CE | HCE1 | 90.0° | 135.5° |
| CG | SD | CE | HCE2 | 90.0° | 104.4° |
| CG | SD | CE | HCE3 | 90.0° | 15.5° |
| CG | SD | C5' | HC51 | 90.0° | 38.8° |
| CG | SD | C5' | HC52 | 90.0° | 155.9° |
| HCG1 | CG | SD | CE | 90.0° | 180.0° |
| HCG1 | CG | SD | C5' | 90.0° | 82.9° |
| HCG2 | CG | SD | CE | 90.0° | 62.8° |
| HCG2 | CG | SD | C5' | 90.0° | 34.3° |
| SD | CE | HCE1 | HCE2 | 90.0° | 119.6° |
| SD | CE | HCE1 | HCE3 | 90.0° | 119.5° |
| SD | CE | HCE2 | HCE3 | 90.0° | 119.4° |
| CE | SD | C5' | HC51 | 90.0° | 58.6° |
| CE | SD | C5' | HC52 | 90.0° | 58.5° |
| C5' | SD | CE | HCE1 | 90.0° | 38.4° |
| C5' | SD | CE | HCE2 | 90.0° | 158.5° |
| C5' | SD | CE | HCE3 | 90.0° | 81.6° |
| SD | C5' | HC51 | HC52 | 90.0° | 116.5° |
| HCE1 | CE | HCE2 | HCE3 | 90.0° | 120.9° |
