PCD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C2 | sing | 0.00Å | 1.37Å | |
| N1 | C6 | sing | 0.00Å | 1.34Å | |
| N1 | C1' | sing | 0.00Å | 1.45Å | |
| C2 | N3 | sing | 0.00Å | 1.35Å | |
| C2 | O2 | doub | 0.00Å | 1.24Å | |
| N3 | C4 | doub | 0.00Å | 1.34Å | |
| C4 | C5 | sing | 0.00Å | 1.49Å | |
| C4 | N4 | sing | 0.00Å | 1.31Å | |
| C5 | C6 | doub | 0.00Å | 1.37Å | |
| C5 | H5 | sing | 0.00Å | 1.08Å | |
| C6 | H6 | sing | 0.00Å | 1.08Å | |
| N4 | H42 | sing | 0.00Å | 1.00Å | |
| N4 | H41 | sing | 0.00Å | 1.00Å | |
| C1' | C2D | sing | 0.00Å | 1.54Å | |
| C1' | O4D | sing | 0.00Å | 1.42Å | |
| C1' | H1' | sing | 0.00Å | 1.10Å | |
| C2D | O2' | sing | 0.00Å | 1.42Å | |
| C2D | C3' | sing | 0.00Å | 1.55Å | |
| C2D | H2' | sing | 0.00Å | 1.10Å | |
| O2' | H2O1 | sing | 0.00Å | 0.95Å | |
| C3' | C4D | sing | 0.00Å | 1.58Å | |
| C3' | O3' | sing | 0.00Å | 1.40Å | |
| C3' | H3' | sing | 0.00Å | 1.10Å | |
| C4D | O4D | sing | 0.00Å | 1.44Å | |
| C4D | C5' | sing | 0.00Å | 1.56Å | |
| C4D | H4D | sing | 0.00Å | 1.10Å | |
| O3' | H3O1 | sing | 0.00Å | 0.95Å | |
| C5' | O5' | sing | 0.00Å | 1.44Å | |
| C5' | H5'2 | sing | 0.00Å | 1.10Å | |
| C5' | H5'1 | sing | 0.00Å | 1.10Å | |
| O5' | PA | sing | 0.00Å | 1.60Å | |
| PA | O1A | doub | 0.00Å | 1.59Å | |
| PA | O2A | sing | 0.00Å | 1.54Å | |
| PA | O3A | sing | 0.00Å | 1.66Å | |
| O2A | HOA2 | sing | 0.00Å | 0.95Å | |
| O3A | PB | sing | 0.00Å | 1.59Å | |
| PB | O1B | doub | 0.00Å | 1.56Å | |
| PB | O2B | sing | 0.00Å | 1.56Å | |
| PB | O3B | sing | 0.00Å | 1.56Å | |
| O2B | HOB2 | sing | 0.00Å | 0.95Å | |
| O3B | C10 | sing | 0.00Å | 1.41Å | |
| C10 | C9' | sing | 0.00Å | 1.49Å | |
| C10 | H102 | sing | 0.00Å | 1.10Å | |
| C10 | H101 | sing | 0.00Å | 1.10Å | |
| C9' | C8' | sing | 0.00Å | 1.54Å | |
| C9' | O9' | sing | 0.00Å | 1.42Å | |
| C9' | H9' | sing | 0.00Å | 1.10Å | |
| C8' | S8' | sing | 0.00Å | 1.79Å | |
| C8' | C7' | doub | 0.00Å | 1.36Å | |
| S8' | MO | sing | 0.00Å | 2.44Å | |
| C7' | S7' | sing | 0.00Å | 1.77Å | |
| C7' | C6' | sing | 0.00Å | 1.52Å | |
| S7' | MO | sing | 0.00Å | 2.32Å | |
| C6' | C7 | sing | 0.00Å | 1.54Å | |
| C6' | N5' | sing | 0.00Å | 1.49Å | |
| C6' | H6' | sing | 0.00Å | 1.10Å | |
| C7 | O9' | sing | 0.00Å | 1.43Å | |
| C7 | N8' | sing | 0.00Å | 1.45Å | |
| C7 | H7 | sing | 0.00Å | 1.10Å | |
| N5' | C4A | sing | 0.00Å | 1.41Å | |
| N5' | H5' | sing | 0.00Å | 1.00Å | |
| C4A | C4B | doub | 0.00Å | 1.42Å | Aromatic |
| C4A | C4' | sing | 0.00Å | 1.37Å | Aromatic |
| N8' | C4B | sing | 0.00Å | 1.42Å | |
| N8' | H8' | sing | 0.00Å | 1.00Å | |
| C4B | N1' | sing | 0.00Å | 1.34Å | Aromatic |
| N1' | C2' | doub | 0.00Å | 1.38Å | Aromatic |
| C2' | N2' | sing | 0.00Å | 1.35Å | |
| C2' | N3' | sing | 0.00Å | 1.36Å | Aromatic |
| N2' | H2'2 | sing | 0.00Å | 1.00Å | |
| N2' | H2'1 | sing | 0.00Å | 1.00Å | |
| N3' | C4' | doub | 0.00Å | 1.35Å | Aromatic |
| C4' | O4' | sing | 0.00Å | 1.38Å | |
| O4' | H4' | sing | 0.00Å | 0.95Å | |
| MO | OR1 | sing | 0.00Å | 2.28Å | |
| MO | OM2 | doub | 0.00Å | 1.70Å | |
| MO | OM1 | doub | 0.00Å | 1.68Å | |
| OR1 | HR11 | sing | 0.00Å | 0.95Å | |
| OR1 | HR12 | sing | 0.00Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | N1 | C6 | 123.6° | 90.0° |
| C2 | N1 | C1' | 118.1° | 90.0° |
| N1 | C2 | N3 | 118.2° | 90.0° |
| N1 | C2 | O2 | 126.4° | 90.0° |
| C6 | N1 | C1' | 118.3° | 90.0° |
| N1 | C6 | C5 | 117.8° | 90.0° |
| N1 | C6 | H6 | 121.1° | 90.0° |
| N1 | C1' | C2D | 123.1° | 90.0° |
| N1 | C1' | O4D | 120.6° | 90.0° |
| N1 | C1' | H1' | 106.0° | 90.0° |
| N3 | C2 | O2 | 115.4° | 90.0° |
| C2 | N3 | C4 | 125.3° | 90.0° |
| N3 | C4 | C5 | 113.7° | 90.0° |
| N3 | C4 | N4 | 123.4° | 90.0° |
| C5 | C4 | N4 | 123.0° | 90.0° |
| C4 | C5 | C6 | 121.5° | 90.0° |
| C4 | C5 | H5 | 119.3° | 90.0° |
| C4 | N4 | H42 | 120.0° | 90.0° |
| C4 | N4 | H41 | 120.0° | 90.0° |
| C6 | C5 | H5 | 119.3° | 90.0° |
| C5 | C6 | H6 | 121.1° | 90.0° |
| H42 | N4 | H41 | 120.0° | 90.0° |
| C2D | C1' | O4D | 93.9° | 90.0° |
| C2D | C1' | H1' | 105.1° | 90.0° |
| C1' | C2D | O2' | 116.0° | 90.0° |
| C1' | C2D | C3' | 124.5° | 90.0° |
| C1' | C2D | H2' | 90.8° | 90.0° |
| O4D | C1' | H1' | 106.3° | 90.0° |
| C1' | O4D | C4D | 117.5° | 90.0° |
| O2' | C2D | C3' | 119.4° | 90.0° |
| O2' | C2D | H2' | 90.9° | 90.0° |
| C2D | O2' | H2O1 | 109.5° | 90.0° |
| C3' | C2D | H2' | 90.8° | 90.0° |
| C2D | C3' | C4D | 89.9° | 90.0° |
| C2D | C3' | O3' | 89.5° | 90.0° |
| C2D | C3' | H3' | 119.2° | 90.0° |
| C4D | C3' | O3' | 108.9° | 90.0° |
| C4D | C3' | H3' | 118.7° | 90.0° |
| C3' | C4D | O4D | 113.4° | 90.0° |
| C3' | C4D | C5' | 112.7° | 90.0° |
| C3' | C4D | H4D | 105.0° | 90.0° |
| O3' | C3' | H3' | 122.7° | 90.0° |
| C3' | O3' | H3O1 | 109.5° | 90.0° |
| O4D | C4D | C5' | 113.3° | 90.0° |
| O4D | C4D | H4D | 106.5° | 90.0° |
| C5' | C4D | H4D | 105.1° | 90.0° |
| C4D | C5' | O5' | 95.4° | 90.0° |
| C4D | C5' | H5'2 | 112.8° | 90.0° |
| C4D | C5' | H5'1 | 112.9° | 90.0° |
| O5' | C5' | H5'2 | 112.8° | 90.0° |
| O5' | C5' | H5'1 | 112.9° | 90.0° |
| C5' | O5' | PA | 112.1° | 90.0° |
| H5'2 | C5' | H5'1 | 109.5° | 90.0° |
| O5' | PA | O1A | 110.6° | 90.0° |
| O5' | PA | O2A | 106.7° | 90.0° |
| O5' | PA | O3A | 114.6° | 90.0° |
| O1A | PA | O2A | 103.4° | 90.0° |
| O1A | PA | O3A | 111.2° | 90.0° |
| O2A | PA | O3A | 109.7° | 90.0° |
| PA | O2A | HOA2 | 109.5° | 90.0° |
| PA | O3A | PB | 135.0° | 90.0° |
| O3A | PB | O1B | 101.5° | 90.0° |
| O3A | PB | O2B | 97.5° | 90.0° |
| O3A | PB | O3B | 93.8° | 90.0° |
| O1B | PB | O2B | 136.3° | 90.0° |
| O1B | PB | O3B | 113.4° | 90.0° |
| O2B | PB | O3B | 104.0° | 90.0° |
| PB | O2B | HOB2 | 109.5° | 90.0° |
| PB | O3B | C10 | 123.0° | 90.0° |
| O3B | C10 | C9' | 113.8° | 90.0° |
| O3B | C10 | H102 | 108.4° | 90.0° |
| O3B | C10 | H101 | 108.4° | 90.0° |
| C9' | C10 | H102 | 108.4° | 90.0° |
| C9' | C10 | H101 | 108.4° | 90.0° |
| C10 | C9' | C8' | 113.6° | 90.0° |
| C10 | C9' | O9' | 104.3° | 90.0° |
| C10 | C9' | H9' | 108.9° | 90.0° |
| H102 | C10 | H101 | 109.5° | 90.0° |
| C8' | C9' | O9' | 111.7° | 90.0° |
| C8' | C9' | H9' | 108.4° | 90.0° |
| C9' | C8' | S8' | 118.4° | 90.0° |
| C9' | C8' | C7' | 121.5° | 90.0° |
| O9' | C9' | H9' | 109.9° | 90.0° |
| C9' | O9' | C7 | 113.5° | 90.0° |
| S8' | C8' | C7' | 120.1° | 90.0° |
| C8' | S8' | MO | 106.2° | 90.0° |
| C8' | C7' | S7' | 116.8° | 90.0° |
| C8' | C7' | C6' | 118.7° | 90.0° |
| S8' | MO | S7' | 80.3° | 90.0° |
| S8' | MO | OR1 | 145.7° | 90.0° |
| S8' | MO | OM2 | 85.4° | 90.0° |
| S8' | MO | OM1 | 100.6° | 90.0° |
| S7' | C7' | C6' | 124.5° | 90.0° |
| C7' | S7' | MO | 112.2° | 90.0° |
| C7' | C6' | C7 | 112.5° | 90.0° |
| C7' | C6' | N5' | 99.5° | 90.0° |
| C7' | C6' | H6' | 108.7° | 90.0° |
| S7' | MO | OR1 | 87.6° | 90.0° |
| S7' | MO | OM2 | 153.4° | 90.0° |
| S7' | MO | OM1 | 99.0° | 90.0° |
| C7 | C6' | N5' | 118.1° | 90.0° |
| C7 | C6' | H6' | 108.4° | 90.0° |
| C6' | C7 | O9' | 105.0° | 90.0° |
| C6' | C7 | N8' | 97.2° | 90.0° |
| C6' | C7 | H7 | 112.5° | 90.0° |
| N5' | C6' | H6' | 109.1° | 90.0° |
| C6' | N5' | C4A | 106.2° | 90.0° |
| C6' | N5' | H5' | 110.3° | 90.0° |
| O9' | C7 | N8' | 112.3° | 90.0° |
| O9' | C7 | H7 | 114.3° | 90.0° |
| N8' | C7 | H7 | 114.0° | 90.0° |
| C7 | N8' | C4B | 136.9° | 90.0° |
| C7 | N8' | H8' | 102.2° | 90.0° |
| C4A | N5' | H5' | 110.3° | 90.0° |
| N5' | C4A | C4B | 138.0° | 90.0° |
| N5' | C4A | C4' | 117.6° | 90.0° |
| C4B | C4A | C4' | 104.3° | 90.0° |
| C4A | C4B | N8' | 98.7° | 90.0° |
| C4A | C4B | N1' | 131.0° | 90.0° |
| C4A | C4' | N3' | 132.1° | 90.0° |
| C4A | C4' | O4' | 128.8° | 90.0° |
| C4B | N8' | H8' | 102.2° | 90.0° |
| N8' | C4B | N1' | 130.3° | 90.0° |
| C4B | N1' | C2' | 115.9° | 90.0° |
| N1' | C2' | N2' | 100.3° | 90.0° |
| N1' | C2' | N3' | 120.8° | 90.0° |
| N2' | C2' | N3' | 139.0° | 90.0° |
| C2' | N2' | H2'2 | 109.5° | 90.0° |
| C2' | N2' | H2'1 | 109.5° | 90.0° |
| C2' | N3' | C4' | 115.9° | 90.0° |
| H2'2 | N2' | H2'1 | 109.5° | 90.0° |
| N3' | C4' | O4' | 99.1° | 90.0° |
| C4' | O4' | H4' | 109.5° | 90.0° |
| OR1 | MO | OM2 | 91.9° | 90.0° |
| OR1 | MO | OM1 | 113.0° | 90.0° |
| MO | OR1 | HR11 | 109.5° | 90.0° |
| MO | OR1 | HR12 | 109.5° | 90.0° |
| OM2 | MO | OM1 | 105.6° | 90.0° |
| HR11 | OR1 | HR12 | 109.4° | 90.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | N1 | C6 | C1' | 179.1° | 90.0° |
| N1 | C2 | N3 | O2 | 179.7° | 90.0° |
| N1 | C2 | N3 | C4 | 0.1° | 90.0° |
| C2 | N1 | C6 | C5 | 0.2° | 90.0° |
| C2 | N1 | C6 | H6 | 179.8° | 90.0° |
| C2 | N1 | C1' | C2D | 106.3° | 90.0° |
| C2 | N1 | C1' | O4D | 135.0° | 90.0° |
| C2 | N1 | C1' | H1' | 14.3° | 90.0° |
| C6 | N1 | C2 | N3 | 0.4° | 90.0° |
| C6 | N1 | C2 | O2 | 179.9° | 90.0° |
| N1 | C6 | C5 | C4 | 0.3° | 90.0° |
| N1 | C6 | C5 | H6 | 180.0° | 90.0° |
| N1 | C6 | C5 | H5 | 179.7° | 90.0° |
| C6 | N1 | C1' | C2D | 72.8° | 90.0° |
| C6 | N1 | C1' | O4D | 45.9° | 90.0° |
| C6 | N1 | C1' | H1' | 166.5° | 90.0° |
| C1' | N1 | C2 | N3 | 178.7° | 90.0° |
| C1' | N1 | C2 | O2 | 1.0° | 90.0° |
| C1' | N1 | C6 | C5 | 178.9° | 90.0° |
| C1' | N1 | C6 | H6 | 1.1° | 90.0° |
| N1 | C1' | C2D | O4D | 130.9° | 90.0° |
| N1 | C1' | C2D | H1' | 121.1° | 90.0° |
| N1 | C1' | O4D | H1' | 120.4° | 90.0° |
| N1 | C1' | C2D | O2' | 52.9° | 90.0° |
| N1 | C1' | C2D | C3' | 130.0° | 90.0° |
| N1 | C1' | C2D | H2' | 38.5° | 90.0° |
| N1 | C1' | O4D | C4D | 126.1° | 90.0° |
| C2 | N3 | C4 | C5 | 0.4° | 90.0° |
| C2 | N3 | C4 | N4 | 179.8° | 90.0° |
| O2 | C2 | N3 | C4 | 179.8° | 90.0° |
| N3 | C4 | C5 | N4 | 179.8° | 90.0° |
| N3 | C4 | C5 | C6 | 0.6° | 90.0° |
| N3 | C4 | C5 | H5 | 179.4° | 90.0° |
| N3 | C4 | N4 | H42 | 0.0° | 90.0° |
| N3 | C4 | N4 | H41 | 180.0° | 90.0° |
| C4 | C5 | C6 | H5 | 180.0° | 90.0° |
| C4 | C5 | C6 | H6 | 179.7° | 90.0° |
| C5 | C4 | N4 | H42 | 179.8° | 90.0° |
| C5 | C4 | N4 | H41 | 0.2° | 90.0° |
| N4 | C4 | C5 | C6 | 179.6° | 90.0° |
| N4 | C4 | C5 | H5 | 0.4° | 90.0° |
| C4 | N4 | H42 | H41 | 180.0° | 90.0° |
| H5 | C5 | C6 | H6 | 0.3° | 90.0° |
| C2D | C1' | O4D | H1' | 107.0° | 90.0° |
| C1' | C2D | O2' | C3' | 177.2° | 90.0° |
| C1' | C2D | O2' | H2' | 91.4° | 90.0° |
| C1' | C2D | C3' | H2' | 91.6° | 90.0° |
| C1' | C2D | O2' | H2O1 | 180.0° | 90.0° |
| C1' | C2D | C3' | C4D | 4.1° | 90.0° |
| C1' | C2D | C3' | O3' | 104.7° | 90.0° |
| C1' | C2D | C3' | H3' | 127.4° | 90.0° |
| C2D | C1' | O4D | C4D | 6.5° | 90.0° |
| O4D | C1' | C2D | O2' | 176.2° | 90.0° |
| O4D | C1' | C2D | C3' | 0.8° | 90.0° |
| O4D | C1' | C2D | H2' | 92.4° | 90.0° |
| C1' | O4D | C4D | C3' | 10.6° | 90.0° |
| C1' | O4D | C4D | C5' | 119.5° | 90.0° |
| C1' | O4D | C4D | H4D | 125.5° | 90.0° |
| H1' | C1' | C2D | O2' | 68.1° | 90.0° |
| H1' | C1' | C2D | C3' | 108.9° | 90.0° |
| H1' | C1' | C2D | H2' | 159.5° | 90.0° |
| H1' | C1' | O4D | C4D | 113.5° | 90.0° |
| O2' | C2D | C3' | H2' | 91.5° | 90.0° |
| O2' | C2D | C3' | C4D | 179.0° | 90.0° |
| O2' | C2D | C3' | O3' | 72.2° | 90.0° |
| O2' | C2D | C3' | H3' | 55.7° | 90.0° |
| C3' | C2D | O2' | H2O1 | 2.9° | 90.0° |
| C2D | C3' | C4D | O3' | 89.4° | 90.0° |
| C2D | C3' | C4D | H3' | 123.7° | 90.0° |
| C2D | C3' | O3' | H3' | 125.0° | 90.0° |
| C2D | C3' | C4D | O4D | 7.6° | 90.0° |
| C2D | C3' | C4D | C5' | 122.7° | 90.0° |
| C2D | C3' | C4D | H4D | 123.4° | 90.0° |
| C2D | C3' | O3' | H3O1 | 180.0° | 90.0° |
| H2' | C2D | O2' | H2O1 | 88.6° | 90.0° |
| H2' | C2D | C3' | C4D | 87.5° | 90.0° |
| H2' | C2D | C3' | O3' | 163.7° | 90.0° |
| H2' | C2D | C3' | H3' | 35.8° | 90.0° |
| C4D | C3' | O3' | H3' | 145.3° | 90.0° |
| C3' | C4D | O4D | C5' | 130.0° | 90.0° |
| C3' | C4D | O4D | H4D | 114.9° | 90.0° |
| C3' | C4D | C5' | H4D | 113.8° | 90.0° |
| C4D | C3' | O3' | H3O1 | 90.3° | 90.0° |
| C3' | C4D | C5' | O5' | 61.1° | 90.0° |
| C3' | C4D | C5' | H5'2 | 178.7° | 90.0° |
| C3' | C4D | C5' | H5'1 | 56.5° | 90.0° |
| O3' | C3' | C4D | O4D | 81.8° | 90.0° |
| O3' | C3' | C4D | C5' | 147.9° | 90.0° |
| O3' | C3' | C4D | H4D | 34.1° | 90.0° |
| H3' | C3' | C4D | O4D | 131.3° | 90.0° |
| H3' | C3' | C4D | C5' | 0.9° | 90.0° |
| H3' | C3' | C4D | H4D | 112.9° | 90.0° |
| H3' | C3' | O3' | H3O1 | 55.0° | 90.0° |
| O4D | C4D | C5' | H4D | 115.8° | 90.0° |
| O4D | C4D | C5' | O5' | 69.3° | 90.0° |
| O4D | C4D | C5' | H5'2 | 48.2° | 90.0° |
| O4D | C4D | C5' | H5'1 | 173.0° | 90.0° |
| C4D | C5' | O5' | H5'2 | 117.6° | 90.0° |
| C4D | C5' | O5' | H5'1 | 117.6° | 90.0° |
| C4D | C5' | H5'2 | H5'1 | 126.6° | 90.0° |
| C4D | C5' | O5' | PA | 173.8° | 90.0° |
| H4D | C4D | C5' | O5' | 174.8° | 90.0° |
| H4D | C4D | C5' | H5'2 | 67.6° | 90.0° |
| H4D | C4D | C5' | H5'1 | 57.2° | 90.0° |
| O5' | C5' | H5'2 | H5'1 | 126.6° | 90.0° |
| C5' | O5' | PA | O1A | 156.6° | 90.0° |
| C5' | O5' | PA | O2A | 91.7° | 90.0° |
| C5' | O5' | PA | O3A | 30.0° | 90.0° |
| H5'2 | C5' | O5' | PA | 68.6° | 90.0° |
| H5'1 | C5' | O5' | PA | 56.2° | 90.0° |
| O5' | PA | O1A | O2A | 113.8° | 90.0° |
| O5' | PA | O1A | O3A | 128.5° | 90.0° |
| O5' | PA | O2A | O3A | 124.7° | 90.0° |
| O5' | PA | O2A | HOA2 | 116.7° | 90.0° |
| O5' | PA | O3A | PB | 72.4° | 90.0° |
| O1A | PA | O2A | O3A | 118.7° | 90.0° |
| O1A | PA | O2A | HOA2 | 0.0° | 90.0° |
| O1A | PA | O3A | PB | 53.9° | 90.0° |
| O2A | PA | O3A | PB | 167.7° | 90.0° |
| O3A | PA | O2A | HOA2 | 118.6° | 90.0° |
| PA | O3A | PB | O1B | 94.0° | 90.0° |
| PA | O3A | PB | O2B | 46.4° | 90.0° |
| PA | O3A | PB | O3B | 151.1° | 90.0° |
| O3A | PB | O1B | O2B | 113.9° | 90.0° |
| O3A | PB | O1B | O3B | 99.4° | 90.0° |
| O3A | PB | O2B | O3B | 95.9° | 90.0° |
| O3A | PB | O2B | HOB2 | 115.4° | 90.0° |
| O3A | PB | O3B | C10 | 95.3° | 90.0° |
| O1B | PB | O2B | O3B | 148.7° | 90.0° |
| O1B | PB | O2B | HOB2 | 0.0° | 90.0° |
| O1B | PB | O3B | C10 | 9.0° | 90.0° |
| O2B | PB | O3B | C10 | 166.0° | 90.0° |
| O3B | PB | O2B | HOB2 | 148.7° | 90.0° |
| PB | O3B | C10 | C9' | 128.8° | 90.0° |
| PB | O3B | C10 | H102 | 110.5° | 90.0° |
| PB | O3B | C10 | H101 | 8.2° | 90.0° |
| O3B | C10 | C9' | H102 | 120.6° | 90.0° |
| O3B | C10 | C9' | H101 | 120.7° | 90.0° |
| O3B | C10 | H102 | H101 | 118.1° | 90.0° |
| O3B | C10 | C9' | C8' | 170.0° | 90.0° |
| O3B | C10 | C9' | O9' | 48.2° | 90.0° |
| O3B | C10 | C9' | H9' | 69.1° | 90.0° |
| C9' | C10 | H102 | H101 | 118.0° | 90.0° |
| C10 | C9' | C8' | O9' | 117.6° | 90.0° |
| C10 | C9' | C8' | H9' | 121.2° | 90.0° |
| C10 | C9' | O9' | H9' | 116.6° | 90.0° |
| C10 | C9' | C8' | S8' | 56.8° | 90.0° |
| C10 | C9' | C8' | C7' | 124.6° | 90.0° |
| C10 | C9' | O9' | C7 | 171.2° | 90.0° |
| H102 | C10 | C9' | C8' | 49.4° | 90.0° |
| H102 | C10 | C9' | O9' | 72.4° | 90.0° |
| H102 | C10 | C9' | H9' | 170.3° | 90.0° |
| H101 | C10 | C9' | C8' | 69.3° | 90.0° |
| H101 | C10 | C9' | O9' | 168.9° | 90.0° |
| H101 | C10 | C9' | H9' | 51.6° | 90.0° |
| C8' | C9' | O9' | H9' | 120.3° | 90.0° |
| C9' | C8' | S8' | C7' | 178.6° | 90.0° |
| C9' | C8' | S8' | MO | 161.1° | 90.0° |
| C9' | C8' | C7' | S7' | 172.8° | 90.0° |
| C9' | C8' | C7' | C6' | 6.4° | 90.0° |
| C8' | C9' | O9' | C7 | 48.1° | 90.0° |
| O9' | C9' | C8' | S8' | 174.4° | 90.0° |
| O9' | C9' | C8' | C7' | 7.1° | 90.0° |
| C9' | O9' | C7 | C6' | 71.0° | 90.0° |
| C9' | O9' | C7 | N8' | 175.5° | 90.0° |
| C9' | O9' | C7 | H7 | 52.7° | 90.0° |
| H9' | C9' | C8' | S8' | 64.4° | 90.0° |
| H9' | C9' | C8' | C7' | 114.1° | 90.0° |
| H9' | C9' | O9' | C7 | 72.2° | 90.0° |
| S8' | C8' | C7' | S7' | 8.7° | 90.0° |
| S8' | C8' | C7' | C6' | 172.2° | 90.0° |
| C8' | S8' | MO | S7' | 17.7° | 90.0° |
| C8' | S8' | MO | OR1 | 88.7° | 90.0° |
| C8' | S8' | MO | OM2 | 175.2° | 90.0° |
| C8' | S8' | MO | OM1 | 79.8° | 90.0° |
| C7' | C8' | S8' | MO | 20.3° | 90.0° |
| C8' | C7' | S7' | C6' | 179.1° | 90.0° |
| C8' | C7' | S7' | MO | 8.4° | 90.0° |
| C8' | C7' | C6' | C7 | 17.4° | 90.0° |
| C8' | C7' | C6' | N5' | 108.6° | 90.0° |
| C8' | C7' | C6' | H6' | 137.4° | 90.0° |
| S8' | MO | S7' | C7' | 15.1° | 90.0° |
| S8' | MO | S7' | OR1 | 147.8° | 90.0° |
| S8' | MO | S7' | OM2 | 58.4° | 90.0° |
| S8' | MO | S7' | OM1 | 99.3° | 90.0° |
| S8' | MO | OR1 | OM2 | 84.6° | 90.0° |
| S8' | MO | OR1 | OM1 | 167.6° | 90.0° |
| S8' | MO | OM2 | OM1 | 99.7° | 90.0° |
| S8' | MO | OR1 | HR11 | 84.5° | 90.0° |
| S8' | MO | OR1 | HR12 | 35.4° | 90.0° |
| S7' | C7' | C6' | C7 | 163.5° | 90.0° |
| S7' | C7' | C6' | N5' | 70.5° | 90.0° |
| S7' | C7' | C6' | H6' | 43.5° | 90.0° |
| C7' | S7' | MO | OR1 | 162.9° | 90.0° |
| C7' | S7' | MO | OM2 | 73.4° | 90.0° |
| C7' | S7' | MO | OM1 | 84.2° | 90.0° |
| C6' | C7' | S7' | MO | 170.7° | 90.0° |
| C7' | C6' | C7 | N5' | 115.1° | 90.0° |
| C7' | C6' | C7 | H6' | 120.2° | 90.0° |
| C7' | C6' | N5' | H6' | 113.7° | 90.0° |
| C7' | C6' | C7 | O9' | 53.2° | 90.0° |
| C7' | C6' | C7 | N8' | 168.7° | 90.0° |
| C7' | C6' | C7 | H7 | 71.6° | 90.0° |
| C7' | C6' | N5' | C4A | 162.8° | 90.0° |
| C7' | C6' | N5' | H5' | 43.3° | 90.0° |
| S7' | MO | OR1 | OM2 | 153.4° | 90.0° |
| S7' | MO | OR1 | OM1 | 98.8° | 90.0° |
| S7' | MO | OM2 | OM1 | 157.0° | 90.0° |
| S7' | MO | OR1 | HR11 | 153.4° | 90.0° |
| S7' | MO | OR1 | HR12 | 33.4° | 90.0° |
| C7 | C6' | N5' | H6' | 124.3° | 90.0° |
| C6' | C7 | O9' | N8' | 104.5° | 90.0° |
| C6' | C7 | O9' | H7 | 123.7° | 90.0° |
| C6' | C7 | N8' | H7 | 118.5° | 90.0° |
| C7 | C6' | N5' | C4A | 40.8° | 90.0° |
| C7 | C6' | N5' | H5' | 78.7° | 90.0° |
| C6' | C7 | N8' | C4B | 51.2° | 90.0° |
| C6' | C7 | N8' | H8' | 72.2° | 90.0° |
| N5' | C6' | C7 | O9' | 61.9° | 90.0° |
| N5' | C6' | C7 | N8' | 53.5° | 90.0° |
| N5' | C6' | C7 | H7 | 173.2° | 90.0° |
| C6' | N5' | C4A | H5' | 119.5° | 90.0° |
| C6' | N5' | C4A | C4B | 9.9° | 90.0° |
| C6' | N5' | C4A | C4' | 170.3° | 90.0° |
| H6' | C6' | C7 | O9' | 173.4° | 90.0° |
| H6' | C6' | C7 | N8' | 71.2° | 90.0° |
| H6' | C6' | C7 | H7 | 48.6° | 90.0° |
| H6' | C6' | N5' | C4A | 83.6° | 90.0° |
| H6' | C6' | N5' | H5' | 157.0° | 90.0° |
| O9' | C7 | N8' | H7 | 132.0° | 90.0° |
| O9' | C7 | N8' | C4B | 58.3° | 90.0° |
| O9' | C7 | N8' | H8' | 178.4° | 90.0° |
| C7 | N8' | C4B | C4A | 26.1° | 90.0° |
| C7 | N8' | C4B | H8' | 123.4° | 90.0° |
| C7 | N8' | C4B | N1' | 153.5° | 90.0° |
| H7 | C7 | N8' | C4B | 169.7° | 90.0° |
| H7 | C7 | N8' | H8' | 46.4° | 90.0° |
| N5' | C4A | C4B | C4' | 179.9° | 90.0° |
| N5' | C4A | C4B | N8' | 0.5° | 90.0° |
| N5' | C4A | C4B | N1' | 179.8° | 90.0° |
| N5' | C4A | C4' | N3' | 179.8° | 90.0° |
| N5' | C4A | C4' | O4' | 0.3° | 90.0° |
| H5' | N5' | C4A | C4B | 109.6° | 90.0° |
| H5' | N5' | C4A | C4' | 70.2° | 90.0° |
| C4A | C4B | N8' | N1' | 179.7° | 90.0° |
| C4A | C4B | N8' | H8' | 97.2° | 90.0° |
| C4A | C4B | N1' | C2' | 0.1° | 90.0° |
| C4B | C4A | C4' | N3' | 0.3° | 90.0° |
| C4B | C4A | C4' | O4' | 179.6° | 90.0° |
| C4' | C4A | C4B | N8' | 179.3° | 90.0° |
| C4' | C4A | C4B | N1' | 0.4° | 90.0° |
| C4A | C4' | N3' | C2' | 0.0° | 90.0° |
| C4A | C4' | N3' | O4' | 180.0° | 90.0° |
| C4A | C4' | O4' | H4' | 180.0° | 90.0° |
| N8' | C4B | N1' | C2' | 179.5° | 90.0° |
| H8' | N8' | C4B | N1' | 83.1° | 90.0° |
| C4B | N1' | C2' | N2' | 179.8° | 90.0° |
| C4B | N1' | C2' | N3' | 0.3° | 90.0° |
| N1' | C2' | N2' | N3' | 179.8° | 90.0° |
| N1' | C2' | N2' | H2'2 | 0.0° | 90.0° |
| N1' | C2' | N2' | H2'1 | 120.0° | 90.0° |
| N1' | C2' | N3' | C4' | 0.4° | 90.0° |
| C2' | N2' | H2'2 | H2'1 | 120.0° | 90.0° |
| N2' | C2' | N3' | C4' | 179.8° | 90.0° |
| N3' | C2' | N2' | H2'2 | 179.9° | 90.0° |
| N3' | C2' | N2' | H2'1 | 59.8° | 90.0° |
| C2' | N3' | C4' | O4' | 180.0° | 90.0° |
| N3' | C4' | O4' | H4' | 0.0° | 90.0° |
| OR1 | MO | OM2 | OM1 | 114.5° | 90.0° |
| MO | OR1 | HR11 | HR12 | 120.0° | 90.0° |
| OM2 | MO | OR1 | HR11 | 0.0° | 90.0° |
| OM2 | MO | OR1 | HR12 | 120.0° | 90.0° |
| OM1 | MO | OR1 | HR11 | 107.8° | 90.0° |
| OM1 | MO | OR1 | HR12 | 132.2° | 90.0° |
