PRD_900092
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1X | O5X | sing | 1.43Å | 1.47Å | |
| C1X | O6Y | sing | 1.43Å | 1.41Å | |
| C1X | C2X | sing | 1.53Å | 1.55Å | |
| O5X | C5X | sing | 1.43Å | 1.45Å | |
| C5X | C6X | sing | 1.53Å | 1.54Å | |
| C5X | C4X | sing | 1.53Å | 1.52Å | |
| C6X | O6X | sing | 1.43Å | 1.43Å | |
| C4X | O4X | sing | 1.43Å | 1.44Å | |
| C4X | C3X | sing | 1.53Å | 1.57Å | |
| C3X | O3X | sing | 1.43Å | 1.42Å | |
| C3X | C2X | sing | 1.53Å | 1.53Å | |
| C2X | O2X | sing | 1.43Å | 1.43Å | |
| C1Y | O5Y | sing | 1.43Å | 1.45Å | |
| C1Y | O6 | sing | 1.43Å | 1.44Å | |
| C1Y | C2Y | sing | 1.53Å | 1.56Å | |
| O5Y | C5Y | sing | 1.43Å | 1.45Å | |
| C5Y | C4Y | sing | 1.53Å | 1.55Å | |
| C5Y | C6Y | sing | 1.53Å | 1.52Å | |
| C6Y | O6Y | sing | 1.43Å | 1.43Å | |
| C4Y | O4Y | sing | 1.43Å | 1.43Å | |
| C4Y | C3Y | sing | 1.53Å | 1.54Å | |
| C3Y | O3Y | sing | 1.43Å | 1.45Å | |
| C3Y | C2Y | sing | 1.53Å | 1.57Å | |
| C2Y | O2Y | sing | 1.43Å | 1.43Å | |
| C1 | O5 | sing | 1.43Å | 1.46Å | |
| C1 | O1 | sing | 1.43Å | 1.46Å | |
| C1 | C2 | sing | 1.53Å | 1.55Å | |
| O1 | C2' | sing | 1.43Å | 1.48Å | |
| C2' | C1' | sing | 1.53Å | 1.55Å | |
| C2' | O2' | sing | 1.43Å | 1.49Å | |
| C2' | C3' | sing | 1.54Å | 1.56Å | |
| C1' | O1' | sing | 1.43Å | 1.43Å | |
| O2' | C5' | sing | 1.44Å | 1.47Å | |
| C5' | C6' | sing | 1.53Å | 1.52Å | |
| C5' | C4' | sing | 1.55Å | 1.51Å | |
| C4' | O4' | sing | 1.43Å | 1.44Å | |
| C4' | C3' | sing | 1.56Å | 1.55Å | |
| C3' | O3' | sing | 1.43Å | 1.46Å | |
| C6' | O6' | sing | 1.43Å | 1.43Å | |
| O5 | C5 | sing | 1.43Å | 1.45Å | |
| C5 | C6 | sing | 1.53Å | 1.51Å | |
| C5 | C4 | sing | 1.53Å | 1.55Å | |
| C6 | O6 | sing | 1.43Å | 1.42Å | |
| C4 | O4 | sing | 1.43Å | 1.44Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| C3 | C2 | sing | 1.53Å | 1.53Å | |
| C3 | O3 | sing | 1.43Å | 1.44Å | |
| C2 | O2 | sing | 1.43Å | 1.40Å | |
| C1X | H1 | sing | 1.09Å | 1.10Å | |
| C5X | H2 | sing | 1.09Å | 1.10Å | |
| C6X | H3 | sing | 1.09Å | 1.10Å | |
| C6X | H4 | sing | 1.09Å | 1.10Å | |
| O6X | H5 | sing | 0.97Å | 0.95Å | |
| C4X | H6 | sing | 1.09Å | 1.10Å | |
| O4X | H7 | sing | 0.97Å | 0.95Å | |
| C3X | H8 | sing | 1.09Å | 1.10Å | |
| O3X | H9 | sing | 0.97Å | 0.95Å | |
| C2X | H10 | sing | 1.09Å | 1.10Å | |
| O2X | H11 | sing | 0.97Å | 0.95Å | |
| C1Y | H12 | sing | 1.09Å | 1.10Å | |
| C5Y | H13 | sing | 1.09Å | 1.10Å | |
| C6Y | H14 | sing | 1.09Å | 1.10Å | |
| C6Y | H15 | sing | 1.09Å | 1.10Å | |
| C4Y | H16 | sing | 1.09Å | 1.10Å | |
| O4Y | H17 | sing | 0.97Å | 0.95Å | |
| C3Y | H18 | sing | 1.09Å | 1.10Å | |
| O3Y | H19 | sing | 0.97Å | 0.95Å | |
| C2Y | H20 | sing | 1.09Å | 1.10Å | |
| O2Y | H21 | sing | 0.97Å | 0.95Å | |
| C1 | H22 | sing | 1.09Å | 1.10Å | |
| C1' | H23 | sing | 1.09Å | 1.10Å | |
| C1' | H24 | sing | 1.09Å | 1.10Å | |
| O1' | H25 | sing | 0.97Å | 0.95Å | |
| C5' | H26 | sing | 1.09Å | 1.10Å | |
| C4' | H27 | sing | 1.09Å | 1.10Å | |
| O4' | H28 | sing | 0.97Å | 0.95Å | |
| C3' | H29 | sing | 1.09Å | 1.10Å | |
| O3' | H30 | sing | 0.97Å | 0.95Å | |
| C6' | H31 | sing | 1.09Å | 1.10Å | |
| C6' | H32 | sing | 1.09Å | 1.10Å | |
| O6' | H33 | sing | 0.97Å | 0.95Å | |
| C5 | H34 | sing | 1.09Å | 1.10Å | |
| C6 | H35 | sing | 1.09Å | 1.10Å | |
| C6 | H36 | sing | 1.09Å | 1.10Å | |
| C4 | H37 | sing | 1.09Å | 1.10Å | |
| O4 | H38 | sing | 0.97Å | 0.95Å | |
| C3 | H39 | sing | 1.09Å | 1.10Å | |
| O3 | H40 | sing | 0.97Å | 0.95Å | |
| C2 | H41 | sing | 1.09Å | 1.10Å | |
| O2 | H42 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O5X | C1X | O6Y | 109.0° | 109.4° |
| O5X | C1X | C2X | 112.1° | 109.5° |
| C1X | O5X | C5X | 116.3° | 114.1° |
| O5X | C1X | H1 | 108.0° | 109.5° |
| O6Y | C1X | C2X | 111.8° | 109.5° |
| C1X | O6Y | C6Y | 106.7° | 114.0° |
| O6Y | C1X | H1 | 108.7° | 109.5° |
| C1X | C2X | C3X | 111.1° | 109.2° |
| C1X | C2X | O2X | 110.1° | 109.6° |
| C2X | C1X | H1 | 107.0° | 109.5° |
| C1X | C2X | H10 | 108.5° | 109.5° |
| O5X | C5X | C6X | 110.0° | 109.5° |
| O5X | C5X | C4X | 107.5° | 109.4° |
| O5X | C5X | H2 | 109.1° | 109.5° |
| C6X | C5X | C4X | 114.1° | 109.5° |
| C5X | C6X | O6X | 108.6° | 109.5° |
| C6X | C5X | H2 | 107.9° | 109.4° |
| C5X | C6X | H3 | 109.6° | 109.5° |
| C5X | C6X | H4 | 109.6° | 109.4° |
| C5X | C4X | O4X | 110.0° | 109.5° |
| C5X | C4X | C3X | 109.1° | 109.2° |
| C4X | C5X | H2 | 108.1° | 109.5° |
| C5X | C4X | H6 | 109.4° | 109.6° |
| O6X | C6X | H3 | 109.7° | 109.5° |
| O6X | C6X | H4 | 109.7° | 109.4° |
| C6X | O6X | H5 | 109.5° | 114.0° |
| O4X | C4X | C3X | 108.8° | 109.5° |
| O4X | C4X | H6 | 110.6° | 109.5° |
| C4X | O4X | H7 | 109.5° | 114.0° |
| C4X | C3X | O3X | 109.5° | 109.6° |
| C4X | C3X | C2X | 113.0° | 109.0° |
| C3X | C4X | H6 | 108.9° | 109.6° |
| C4X | C3X | H8 | 107.9° | 109.6° |
| O3X | C3X | C2X | 108.2° | 109.5° |
| O3X | C3X | H8 | 109.9° | 109.5° |
| C3X | O3X | H9 | 109.5° | 114.0° |
| C3X | C2X | O2X | 108.4° | 109.5° |
| C2X | C3X | H8 | 108.3° | 109.6° |
| C3X | C2X | H10 | 108.7° | 109.5° |
| O2X | C2X | H10 | 110.2° | 109.6° |
| C2X | O2X | H11 | 109.5° | 114.0° |
| O5Y | C1Y | O6 | 101.1° | 109.5° |
| O5Y | C1Y | C2Y | 112.4° | 109.4° |
| C1Y | O5Y | C5Y | 112.1° | 114.1° |
| O5Y | C1Y | H12 | 112.1° | 109.5° |
| O6 | C1Y | C2Y | 108.3° | 109.5° |
| C1Y | O6 | C6 | 113.6° | 114.0° |
| O6 | C1Y | H12 | 112.3° | 109.5° |
| C1Y | C2Y | C3Y | 115.3° | 109.2° |
| C1Y | C2Y | O2Y | 110.0° | 109.5° |
| C2Y | C1Y | H12 | 110.4° | 109.5° |
| C1Y | C2Y | H20 | 106.1° | 109.5° |
| O5Y | C5Y | C4Y | 107.7° | 109.4° |
| O5Y | C5Y | C6Y | 104.0° | 109.5° |
| O5Y | C5Y | H13 | 111.2° | 109.5° |
| C4Y | C5Y | C6Y | 113.7° | 109.4° |
| C5Y | C4Y | O4Y | 111.8° | 109.5° |
| C5Y | C4Y | C3Y | 111.4° | 109.1° |
| C4Y | C5Y | H13 | 109.8° | 109.5° |
| C5Y | C4Y | H16 | 108.4° | 109.5° |
| C5Y | C6Y | O6Y | 113.4° | 109.4° |
| C6Y | C5Y | H13 | 110.2° | 109.5° |
| C5Y | C6Y | H14 | 108.5° | 109.5° |
| C5Y | C6Y | H15 | 108.5° | 109.5° |
| O6Y | C6Y | H14 | 108.5° | 109.5° |
| O6Y | C6Y | H15 | 108.5° | 109.4° |
| O4Y | C4Y | C3Y | 106.8° | 109.5° |
| O4Y | C4Y | H16 | 109.9° | 109.6° |
| C4Y | O4Y | H17 | 109.5° | 114.0° |
| C4Y | C3Y | O3Y | 108.8° | 109.6° |
| C4Y | C3Y | C2Y | 114.5° | 109.0° |
| C3Y | C4Y | H16 | 108.4° | 109.5° |
| C4Y | C3Y | H18 | 107.6° | 109.5° |
| O3Y | C3Y | C2Y | 109.4° | 109.6° |
| O3Y | C3Y | H18 | 108.9° | 109.6° |
| C3Y | O3Y | H19 | 109.5° | 114.0° |
| C3Y | C2Y | O2Y | 111.5° | 109.6° |
| C2Y | C3Y | H18 | 107.4° | 109.6° |
| C3Y | C2Y | H20 | 106.0° | 109.5° |
| O2Y | C2Y | H20 | 107.5° | 109.5° |
| C2Y | O2Y | H21 | 109.5° | 114.0° |
| O5 | C1 | O1 | 113.9° | 109.5° |
| O5 | C1 | C2 | 110.7° | 109.4° |
| C1 | O5 | C5 | 114.5° | 114.1° |
| O5 | C1 | H22 | 107.4° | 109.5° |
| O1 | C1 | C2 | 110.8° | 109.5° |
| C1 | O1 | C2' | 119.2° | 114.0° |
| O1 | C1 | H22 | 107.4° | 109.5° |
| C1 | C2 | C3 | 112.2° | 109.2° |
| C1 | C2 | O2 | 109.8° | 109.5° |
| C2 | C1 | H22 | 106.3° | 109.5° |
| C1 | C2 | H41 | 108.2° | 109.5° |
| O1 | C2' | C1' | 109.0° | 109.9° |
| O1 | C2' | O2' | 116.9° | 109.8° |
| O1 | C2' | C3' | 105.8° | 109.8° |
| C1' | C2' | O2' | 107.6° | 109.8° |
| C1' | C2' | C3' | 111.6° | 109.8° |
| C2' | C1' | O1' | 111.1° | 109.5° |
| C2' | C1' | H23 | 109.1° | 109.4° |
| C2' | C1' | H24 | 109.1° | 109.5° |
| O2' | C2' | C3' | 105.9° | 107.6° |
| C2' | O2' | C5' | 110.5° | 110.0° |
| C2' | C3' | C4' | 103.9° | 102.2° |
| C2' | C3' | O3' | 112.9° | 110.8° |
| C2' | C3' | H29 | 108.3° | 110.8° |
| O1' | C1' | H23 | 109.1° | 109.5° |
| O1' | C1' | H24 | 109.1° | 109.5° |
| C1' | O1' | H25 | 109.5° | 114.0° |
| O2' | C5' | C6' | 109.5° | 110.3° |
| O2' | C5' | C4' | 106.6° | 105.1° |
| O2' | C5' | H26 | 111.9° | 110.3° |
| C6' | C5' | C4' | 106.3° | 110.3° |
| C5' | C6' | O6' | 111.6° | 109.5° |
| C6' | C5' | H26 | 111.0° | 110.3° |
| C5' | C6' | H31 | 108.9° | 109.5° |
| C5' | C6' | H32 | 108.9° | 109.5° |
| C5' | C4' | O4' | 110.0° | 111.1° |
| C5' | C4' | C3' | 105.7° | 100.9° |
| C4' | C5' | H26 | 111.2° | 110.4° |
| C5' | C4' | H27 | 108.6° | 111.1° |
| O4' | C4' | C3' | 114.6° | 111.1° |
| O4' | C4' | H27 | 109.6° | 111.0° |
| C4' | O4' | H28 | 109.5° | 114.0° |
| C4' | C3' | O3' | 113.3° | 110.9° |
| C3' | C4' | H27 | 108.2° | 111.2° |
| C4' | C3' | H29 | 108.5° | 110.9° |
| O3' | C3' | H29 | 109.7° | 110.9° |
| C3' | O3' | H30 | 109.5° | 114.0° |
| O6' | C6' | H31 | 108.9° | 109.5° |
| O6' | C6' | H32 | 108.9° | 109.5° |
| C6' | O6' | H33 | 109.5° | 114.1° |
| O5 | C5 | C6 | 108.7° | 109.4° |
| O5 | C5 | C4 | 112.4° | 109.4° |
| O5 | C5 | H34 | 109.0° | 109.5° |
| C6 | C5 | C4 | 110.7° | 109.5° |
| C5 | C6 | O6 | 104.8° | 109.5° |
| C6 | C5 | H34 | 108.2° | 109.4° |
| C5 | C6 | H35 | 110.6° | 109.4° |
| C5 | C6 | H36 | 110.6° | 109.4° |
| C5 | C4 | O4 | 111.0° | 109.5° |
| C5 | C4 | C3 | 108.8° | 109.2° |
| C4 | C5 | H34 | 107.7° | 109.5° |
| C5 | C4 | H37 | 109.2° | 109.5° |
| O6 | C6 | H35 | 110.6° | 109.5° |
| O6 | C6 | H36 | 110.6° | 109.5° |
| O4 | C4 | C3 | 107.4° | 109.6° |
| O4 | C4 | H37 | 110.7° | 109.5° |
| C4 | O4 | H38 | 109.5° | 113.9° |
| C4 | C3 | C2 | 111.2° | 109.1° |
| C4 | C3 | O3 | 110.0° | 109.5° |
| C3 | C4 | H37 | 109.5° | 109.6° |
| C4 | C3 | H39 | 108.2° | 109.5° |
| C2 | C3 | O3 | 109.9° | 109.6° |
| C3 | C2 | O2 | 108.0° | 109.5° |
| C2 | C3 | H39 | 108.1° | 109.6° |
| C3 | C2 | H41 | 108.4° | 109.5° |
| O3 | C3 | H39 | 109.3° | 109.6° |
| C3 | O3 | H40 | 109.5° | 114.0° |
| O2 | C2 | H41 | 110.2° | 109.5° |
| C2 | O2 | H42 | 109.5° | 114.0° |
| H3 | C6X | H4 | 109.5° | 109.5° |
| H14 | C6Y | H15 | 109.4° | 109.5° |
| H23 | C1' | H24 | 109.5° | 109.5° |
| H31 | C6' | H32 | 109.5° | 109.5° |
| H35 | C6 | H36 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O5X | C1X | O6Y | C2X | 124.5° | 120.0° |
| O5X | C1X | O6Y | H1 | 117.6° | 120.0° |
| O5X | C1X | C2X | H1 | 118.2° | 120.0° |
| C1X | O5X | C5X | C6X | 172.7° | 178.9° |
| C1X | O5X | C5X | C4X | 62.5° | 61.1° |
| O5X | C1X | C2X | C3X | 44.7° | 57.5° |
| O5X | C1X | C2X | O2X | 164.7° | 177.5° |
| O5X | C1X | O6Y | C6Y | 71.0° | 70.0° |
| C1X | O5X | C5X | H2 | 54.5° | 58.9° |
| O5X | C1X | C2X | H10 | 74.7° | 62.3° |
| O6Y | C1X | C2X | H1 | 119.0° | 120.0° |
| O6Y | C1X | O5X | C5X | 69.4° | 58.9° |
| O6Y | C1X | C2X | C3X | 78.1° | 62.4° |
| O6Y | C1X | C2X | O2X | 41.9° | 57.5° |
| C1X | O6Y | C6Y | C5Y | 143.9° | 180.0° |
| O6Y | C1X | C2X | H10 | 162.5° | 177.8° |
| C1X | O6Y | C6Y | H14 | 23.3° | 59.9° |
| C1X | O6Y | C6Y | H15 | 95.5° | 60.1° |
| C2X | C1X | O5X | C5X | 55.0° | 61.1° |
| C1X | C2X | C3X | C4X | 47.0° | 56.9° |
| C1X | C2X | C3X | O3X | 168.5° | 176.8° |
| C1X | C2X | C3X | O2X | 121.0° | 120.0° |
| C1X | C2X | C3X | H10 | 119.3° | 119.9° |
| C1X | C2X | O2X | H10 | 119.6° | 120.2° |
| C2X | C1X | O6Y | C6Y | 164.5° | 170.0° |
| C1X | C2X | C3X | H8 | 72.4° | 63.0° |
| C1X | C2X | O2X | H11 | 180.0° | 60.0° |
| O5X | C5X | C6X | C4X | 120.9° | 120.0° |
| O5X | C5X | C6X | H2 | 118.9° | 120.0° |
| O5X | C5X | C4X | H2 | 117.7° | 120.0° |
| O5X | C5X | C6X | O6X | 58.5° | 64.9° |
| O5X | C5X | C4X | O4X | 59.4° | 62.3° |
| O5X | C5X | C4X | C3X | 59.8° | 57.6° |
| C5X | O5X | C1X | H1 | 172.6° | 178.9° |
| O5X | C5X | C6X | H3 | 178.4° | 175.0° |
| O5X | C5X | C6X | H4 | 61.4° | 55.0° |
| O5X | C5X | C4X | H6 | 178.8° | 177.6° |
| C6X | C5X | C4X | H2 | 120.1° | 120.0° |
| C5X | C6X | O6X | H3 | 119.8° | 120.0° |
| C5X | C6X | O6X | H4 | 119.8° | 119.9° |
| C6X | C5X | C4X | O4X | 62.8° | 57.7° |
| C6X | C5X | C4X | C3X | 177.9° | 177.6° |
| C5X | C6X | H3 | H4 | 120.4° | 120.0° |
| C5X | C6X | O6X | H5 | 180.0° | 180.0° |
| C6X | C5X | C4X | H6 | 58.9° | 62.4° |
| C4X | C5X | C6X | O6X | 179.4° | 175.1° |
| C5X | C4X | O4X | C3X | 119.4° | 119.7° |
| C5X | C4X | O4X | H6 | 121.0° | 120.1° |
| C5X | C4X | C3X | H6 | 119.4° | 120.0° |
| C5X | C4X | C3X | O3X | 176.2° | 176.8° |
| C5X | C4X | C3X | C2X | 55.5° | 57.0° |
| C4X | C5X | C6X | H3 | 60.7° | 55.0° |
| C4X | C5X | C6X | H4 | 59.5° | 65.0° |
| C5X | C4X | O4X | H7 | 180.0° | 179.9° |
| C5X | C4X | C3X | H8 | 64.2° | 63.0° |
| O6X | C6X | C5X | H2 | 60.4° | 55.1° |
| O6X | C6X | H3 | H4 | 120.4° | 120.0° |
| O4X | C4X | C3X | H6 | 120.6° | 120.1° |
| O4X | C4X | C3X | O3X | 56.3° | 56.9° |
| O4X | C4X | C3X | C2X | 64.4° | 63.0° |
| O4X | C4X | C5X | H2 | 177.1° | 177.7° |
| O4X | C4X | C3X | H8 | 175.8° | 177.1° |
| C4X | C3X | O3X | C2X | 123.6° | 119.6° |
| C4X | C3X | O3X | H8 | 118.3° | 120.3° |
| C4X | C3X | C2X | H8 | 119.5° | 119.9° |
| C4X | C3X | C2X | O2X | 168.1° | 176.9° |
| C3X | C4X | C5X | H2 | 57.8° | 62.4° |
| C3X | C4X | O4X | H7 | 60.6° | 60.2° |
| C4X | C3X | O3X | H9 | 180.0° | 180.0° |
| C4X | C3X | C2X | H10 | 72.2° | 62.9° |
| O3X | C3X | C2X | H8 | 119.1° | 120.1° |
| O3X | C3X | C2X | O2X | 70.5° | 63.2° |
| O3X | C3X | C4X | H6 | 64.4° | 63.2° |
| O3X | C3X | C2X | H10 | 49.2° | 57.0° |
| C3X | C2X | O2X | H10 | 118.8° | 120.1° |
| C3X | C2X | C1X | H1 | 162.9° | 177.6° |
| C2X | C3X | C4X | H6 | 174.9° | 176.9° |
| C2X | C3X | O3X | H9 | 56.4° | 60.4° |
| C3X | C2X | O2X | H11 | 58.4° | 179.7° |
| O2X | C2X | C1X | H1 | 77.1° | 62.5° |
| O2X | C2X | C3X | H8 | 48.6° | 56.9° |
| O5Y | C1Y | O6 | C2Y | 118.2° | 119.9° |
| O5Y | C1Y | O6 | H12 | 119.6° | 120.0° |
| O5Y | C1Y | C2Y | H12 | 126.0° | 120.0° |
| C1Y | O5Y | C5Y | C4Y | 76.1° | 61.2° |
| C1Y | O5Y | C5Y | C6Y | 162.8° | 178.9° |
| O5Y | C1Y | C2Y | C3Y | 15.9° | 57.6° |
| O5Y | C1Y | C2Y | O2Y | 142.9° | 62.3° |
| O5Y | C1Y | O6 | C6 | 125.7° | 61.5° |
| C1Y | O5Y | C5Y | H13 | 44.2° | 58.8° |
| O5Y | C1Y | C2Y | H20 | 101.1° | 177.5° |
| O6 | C1Y | C2Y | H12 | 123.3° | 120.0° |
| O6 | C1Y | O5Y | C5Y | 74.7° | 58.8° |
| O6 | C1Y | C2Y | C3Y | 126.6° | 62.3° |
| O6 | C1Y | C2Y | O2Y | 106.3° | 177.7° |
| C1Y | O6 | C6 | C5 | 144.4° | 175.1° |
| O6 | C1Y | C2Y | H20 | 9.7° | 57.6° |
| C1Y | O6 | C6 | H35 | 25.1° | 64.9° |
| C1Y | O6 | C6 | H36 | 96.3° | 55.1° |
| C2Y | C1Y | O5Y | C5Y | 40.5° | 61.1° |
| C1Y | C2Y | C3Y | C4Y | 38.1° | 57.0° |
| C1Y | C2Y | C3Y | O3Y | 160.5° | 62.9° |
| C1Y | C2Y | C3Y | O2Y | 126.3° | 120.0° |
| C1Y | C2Y | C3Y | H20 | 117.0° | 119.9° |
| C1Y | C2Y | O2Y | H20 | 115.1° | 120.1° |
| C2Y | C1Y | O6 | C6 | 116.1° | 178.6° |
| C1Y | C2Y | C3Y | H18 | 81.4° | 176.9° |
| C1Y | C2Y | O2Y | H21 | 180.0° | 60.0° |
| O5Y | C5Y | C4Y | C6Y | 114.7° | 120.0° |
| O5Y | C5Y | C4Y | H13 | 121.2° | 120.0° |
| O5Y | C5Y | C6Y | H13 | 119.3° | 120.1° |
| O5Y | C5Y | C6Y | O6Y | 173.0° | 65.0° |
| O5Y | C5Y | C4Y | O4Y | 70.6° | 62.3° |
| O5Y | C5Y | C4Y | C3Y | 48.9° | 57.7° |
| C5Y | O5Y | C1Y | H12 | 165.5° | 178.8° |
| O5Y | C5Y | C6Y | H14 | 66.4° | 175.0° |
| O5Y | C5Y | C6Y | H15 | 52.4° | 54.9° |
| O5Y | C5Y | C4Y | H16 | 168.1° | 177.5° |
| C4Y | C5Y | C6Y | H13 | 123.8° | 120.0° |
| C4Y | C5Y | C6Y | O6Y | 70.1° | 175.1° |
| C5Y | C4Y | O4Y | C3Y | 122.1° | 119.7° |
| C5Y | C4Y | O4Y | H16 | 120.4° | 120.2° |
| C5Y | C4Y | C3Y | H16 | 119.2° | 119.9° |
| C5Y | C4Y | C3Y | O3Y | 127.7° | 62.9° |
| C5Y | C4Y | C3Y | C2Y | 4.9° | 57.0° |
| C4Y | C5Y | C6Y | H14 | 50.5° | 55.1° |
| C4Y | C5Y | C6Y | H15 | 169.3° | 65.0° |
| C5Y | C4Y | O4Y | H17 | 180.0° | 180.0° |
| C5Y | C4Y | C3Y | H18 | 114.4° | 176.9° |
| C5Y | C6Y | O6Y | H14 | 120.6° | 120.1° |
| C5Y | C6Y | O6Y | H15 | 120.6° | 119.9° |
| C6Y | C5Y | C4Y | O4Y | 44.1° | 57.7° |
| C6Y | C5Y | C4Y | C3Y | 163.6° | 177.6° |
| C5Y | C6Y | H14 | H15 | 118.2° | 120.0° |
| C6Y | C5Y | C4Y | H16 | 77.2° | 62.5° |
| C6Y | O6Y | C1X | H1 | 46.5° | 49.9° |
| O6Y | C6Y | C5Y | H13 | 53.7° | 55.1° |
| O6Y | C6Y | H14 | H15 | 118.2° | 120.0° |
| O4Y | C4Y | C3Y | H16 | 118.5° | 120.2° |
| O4Y | C4Y | C3Y | O3Y | 109.9° | 177.2° |
| O4Y | C4Y | C3Y | C2Y | 127.3° | 62.9° |
| O4Y | C4Y | C5Y | H13 | 168.2° | 177.7° |
| O4Y | C4Y | C3Y | H18 | 8.0° | 57.0° |
| C4Y | C3Y | O3Y | C2Y | 125.8° | 119.5° |
| C4Y | C3Y | O3Y | H18 | 117.1° | 120.2° |
| C4Y | C3Y | C2Y | H18 | 119.5° | 119.8° |
| C4Y | C3Y | C2Y | O2Y | 164.4° | 62.9° |
| C3Y | C4Y | C5Y | H13 | 72.4° | 62.4° |
| C3Y | C4Y | O4Y | H17 | 57.9° | 60.3° |
| C4Y | C3Y | O3Y | H19 | 180.0° | 166.1° |
| C4Y | C3Y | C2Y | H20 | 78.9° | 176.9° |
| O3Y | C3Y | C2Y | H18 | 118.1° | 120.3° |
| O3Y | C3Y | C2Y | O2Y | 73.2° | 177.2° |
| O3Y | C3Y | C4Y | H16 | 8.5° | 57.0° |
| O3Y | C3Y | C2Y | H20 | 43.5° | 57.1° |
| C3Y | C2Y | O2Y | H20 | 115.7° | 120.1° |
| C3Y | C2Y | C1Y | H12 | 110.1° | 177.6° |
| C2Y | C3Y | C4Y | H16 | 114.3° | 176.9° |
| C2Y | C3Y | O3Y | H19 | 54.2° | 74.4° |
| C3Y | C2Y | O2Y | H21 | 50.8° | 179.7° |
| O2Y | C2Y | C1Y | H12 | 17.0° | 57.7° |
| O2Y | C2Y | C3Y | H18 | 44.9° | 56.9° |
| O5 | C1 | O1 | C2 | 125.6° | 119.9° |
| O5 | C1 | O1 | H22 | 118.8° | 120.0° |
| O5 | C1 | C2 | H22 | 116.3° | 120.0° |
| O5 | C1 | O1 | C2' | 73.8° | 44.8° |
| C1 | O5 | C5 | C6 | 179.6° | 178.8° |
| C1 | O5 | C5 | C4 | 57.4° | 61.2° |
| O5 | C1 | C2 | C3 | 51.4° | 57.6° |
| O5 | C1 | C2 | O2 | 171.6° | 177.5° |
| C1 | O5 | C5 | H34 | 61.9° | 58.9° |
| O5 | C1 | C2 | H41 | 68.1° | 62.3° |
| O1 | C1 | C2 | H22 | 116.4° | 120.0° |
| C1 | O1 | C2' | C1' | 105.9° | 54.8° |
| C1 | O1 | C2' | O2' | 16.4° | 66.1° |
| C1 | O1 | C2' | C3' | 134.0° | 175.7° |
| O1 | C1 | O5 | C5 | 71.7° | 58.8° |
| O1 | C1 | C2 | C3 | 76.0° | 62.4° |
| O1 | C1 | C2 | O2 | 44.2° | 57.5° |
| O1 | C1 | C2 | H41 | 164.5° | 177.7° |
| C2 | C1 | O1 | C2' | 160.7° | 164.8° |
| C2 | C1 | O5 | C5 | 53.9° | 61.2° |
| C1 | C2 | C3 | C4 | 53.2° | 57.0° |
| C1 | C2 | C3 | O2 | 121.2° | 119.9° |
| C1 | C2 | C3 | H41 | 119.4° | 119.9° |
| C1 | C2 | C3 | O3 | 175.2° | 176.9° |
| C1 | C2 | O2 | H41 | 119.1° | 120.2° |
| C1 | C2 | C3 | H39 | 65.5° | 62.9° |
| C1 | C2 | O2 | H42 | 180.0° | 60.0° |
| O1 | C2' | C1' | O2' | 127.7° | 120.9° |
| O1 | C2' | C1' | C3' | 116.6° | 120.9° |
| O1 | C2' | O2' | C3' | 117.5° | 119.6° |
| O1 | C2' | C1' | O1' | 69.9° | 66.4° |
| O1 | C2' | O2' | C5' | 113.5° | 121.2° |
| O1 | C2' | C3' | C4' | 105.8° | 98.1° |
| O1 | C2' | C3' | O3' | 131.0° | 143.6° |
| C2' | O1 | C1 | H22 | 45.0° | 75.2° |
| O1 | C2' | C1' | H23 | 50.3° | 53.6° |
| O1 | C2' | C1' | H24 | 169.8° | 173.6° |
| O1 | C2' | C3' | H29 | 9.4° | 20.1° |
| C1' | C2' | O2' | C3' | 119.5° | 119.5° |
| C2' | C1' | O1' | H23 | 120.2° | 119.9° |
| C2' | C1' | O1' | H24 | 120.3° | 120.0° |
| C1' | C2' | O2' | C5' | 123.5° | 117.9° |
| C1' | C2' | C3' | C4' | 135.7° | 140.9° |
| C1' | C2' | C3' | O3' | 12.5° | 22.7° |
| C2' | C1' | H23 | H24 | 119.3° | 120.0° |
| C2' | C1' | O1' | H25 | 180.0° | 180.0° |
| C1' | C2' | C3' | H29 | 109.1° | 100.8° |
| O2' | C2' | C1' | O1' | 57.8° | 54.5° |
| C2' | O2' | C5' | C6' | 127.7° | 143.3° |
| C2' | O2' | C5' | C4' | 13.1° | 24.4° |
| O2' | C2' | C3' | C4' | 18.9° | 21.4° |
| O2' | C2' | C3' | O3' | 104.3° | 96.8° |
| O2' | C2' | C1' | H23 | 178.0° | 174.5° |
| O2' | C2' | C1' | H24 | 62.5° | 65.5° |
| C2' | O2' | C5' | H26 | 108.7° | 94.6° |
| O2' | C2' | C3' | H29 | 134.1° | 139.7° |
| C3' | C2' | C1' | O1' | 173.5° | 172.7° |
| C3' | C2' | O2' | C5' | 4.0° | 1.7° |
| C2' | C3' | C4' | C5' | 26.8° | 34.2° |
| C2' | C3' | C4' | O4' | 148.1° | 152.1° |
| C2' | C3' | C4' | O3' | 123.0° | 118.2° |
| C2' | C3' | C4' | H29 | 115.0° | 118.1° |
| C2' | C3' | O3' | H29 | 120.8° | 123.5° |
| C3' | C2' | C1' | H23 | 66.2° | 67.3° |
| C3' | C2' | C1' | H24 | 53.3° | 52.7° |
| C2' | C3' | C4' | H27 | 89.4° | 83.8° |
| C2' | C3' | O3' | H30 | 180.0° | 180.0° |
| O1' | C1' | H23 | H24 | 119.3° | 120.0° |
| O2' | C5' | C6' | C4' | 114.9° | 115.7° |
| O2' | C5' | C6' | H26 | 124.0° | 122.1° |
| O2' | C5' | C4' | H26 | 122.2° | 119.0° |
| O2' | C5' | C4' | O4' | 149.2° | 154.4° |
| O2' | C5' | C4' | C3' | 25.0° | 36.5° |
| O2' | C5' | C6' | O6' | 74.9° | 65.4° |
| O2' | C5' | C4' | H27 | 91.0° | 81.5° |
| O2' | C5' | C6' | H31 | 164.8° | 174.6° |
| O2' | C5' | C6' | H32 | 45.4° | 54.6° |
| C6' | C5' | C4' | H26 | 121.0° | 122.1° |
| C6' | C5' | C4' | O4' | 94.0° | 86.7° |
| C6' | C5' | C4' | C3' | 141.7° | 155.4° |
| C5' | C6' | O6' | H31 | 120.3° | 120.0° |
| C5' | C6' | O6' | H32 | 120.3° | 120.0° |
| C6' | C5' | C4' | H27 | 25.8° | 37.4° |
| C5' | C6' | H31 | H32 | 119.0° | 120.0° |
| C5' | C6' | O6' | H33 | 180.0° | 175.1° |
| C5' | C4' | O4' | C3' | 118.9° | 111.5° |
| C5' | C4' | O4' | H27 | 119.3° | 124.2° |
| C5' | C4' | C3' | H27 | 116.2° | 118.0° |
| C5' | C4' | C3' | O3' | 96.2° | 84.0° |
| C4' | C5' | C6' | O6' | 170.2° | 178.9° |
| C5' | C4' | O4' | H28 | 180.0° | 61.5° |
| C5' | C4' | C3' | H29 | 141.8° | 152.3° |
| C4' | C5' | C6' | H31 | 49.9° | 58.9° |
| C4' | C5' | C6' | H32 | 69.5° | 61.1° |
| O4' | C4' | C3' | H27 | 122.6° | 124.2° |
| O4' | C4' | C3' | O3' | 25.1° | 33.9° |
| O4' | C4' | C5' | H26 | 26.9° | 35.4° |
| O4' | C4' | C3' | H29 | 96.9° | 89.8° |
| C4' | C3' | O3' | H29 | 121.3° | 123.7° |
| C3' | C4' | C5' | H26 | 97.3° | 82.5° |
| C3' | C4' | O4' | H28 | 61.1° | 173.1° |
| C4' | C3' | O3' | H30 | 62.2° | 67.3° |
| O3' | C3' | C4' | H27 | 147.7° | 158.1° |
| O6' | C6' | C5' | H26 | 49.1° | 56.8° |
| O6' | C6' | H31 | H32 | 119.0° | 120.0° |
| O5 | C5 | C6 | C4 | 124.0° | 119.9° |
| O5 | C5 | C6 | H34 | 118.2° | 120.0° |
| O5 | C5 | C4 | H34 | 120.1° | 120.0° |
| O5 | C5 | C6 | O6 | 147.9° | 51.5° |
| O5 | C5 | C4 | O4 | 173.8° | 177.5° |
| O5 | C5 | C4 | C3 | 55.8° | 57.6° |
| C5 | O5 | C1 | H22 | 169.5° | 178.9° |
| O5 | C5 | C6 | H35 | 92.8° | 171.5° |
| O5 | C5 | C6 | H36 | 28.6° | 68.5° |
| O5 | C5 | C4 | H37 | 63.8° | 62.4° |
| C6 | C5 | C4 | H34 | 118.1° | 120.0° |
| C5 | C6 | O6 | H35 | 119.3° | 120.0° |
| C5 | C6 | O6 | H36 | 119.3° | 119.9° |
| C6 | C5 | C4 | O4 | 64.3° | 62.5° |
| C6 | C5 | C4 | C3 | 177.6° | 177.6° |
| C5 | C6 | H35 | H36 | 122.1° | 119.9° |
| C6 | C5 | C4 | H37 | 58.1° | 57.6° |
| C4 | C5 | C6 | O6 | 88.1° | 171.4° |
| C5 | C4 | O4 | C3 | 118.9° | 119.7° |
| C5 | C4 | O4 | H37 | 121.5° | 120.1° |
| C5 | C4 | C3 | H37 | 119.4° | 119.9° |
| C5 | C4 | C3 | C2 | 53.8° | 57.0° |
| C5 | C4 | C3 | O3 | 175.8° | 176.9° |
| C4 | C5 | C6 | H35 | 31.1° | 68.5° |
| C4 | C5 | C6 | H36 | 152.6° | 51.4° |
| C5 | C4 | O4 | H38 | 180.0° | 180.0° |
| C5 | C4 | C3 | H39 | 64.8° | 62.9° |
| C6 | O6 | C1Y | H12 | 6.0° | 58.5° |
| O6 | C6 | C5 | H34 | 29.6° | 68.5° |
| O6 | C6 | H35 | H36 | 122.1° | 120.1° |
| O4 | C4 | C3 | H37 | 120.3° | 120.2° |
| O4 | C4 | C3 | C2 | 174.1° | 176.9° |
| O4 | C4 | C3 | O3 | 63.9° | 63.2° |
| O4 | C4 | C5 | H34 | 53.7° | 57.5° |
| O4 | C4 | C3 | H39 | 55.5° | 57.0° |
| C4 | C3 | C2 | O3 | 122.1° | 119.9° |
| C4 | C3 | C2 | H39 | 118.7° | 119.9° |
| C4 | C3 | O3 | H39 | 118.7° | 120.2° |
| C4 | C3 | C2 | O2 | 174.4° | 176.9° |
| C3 | C4 | C5 | H34 | 64.3° | 62.4° |
| C3 | C4 | O4 | H38 | 61.1° | 60.3° |
| C4 | C3 | O3 | H40 | 180.0° | 180.0° |
| C4 | C3 | C2 | H41 | 66.2° | 62.9° |
| C2 | C3 | O3 | H39 | 118.5° | 120.2° |
| C3 | C2 | O2 | H41 | 118.3° | 120.1° |
| C3 | C2 | C1 | H22 | 167.7° | 177.6° |
| C2 | C3 | C4 | H37 | 65.6° | 62.9° |
| C2 | C3 | O3 | H40 | 57.3° | 60.4° |
| C3 | C2 | O2 | H42 | 57.3° | 179.7° |
| O3 | C3 | C2 | O2 | 63.6° | 63.2° |
| O3 | C3 | C4 | H37 | 56.5° | 57.0° |
| O3 | C3 | C2 | H41 | 55.9° | 57.0° |
| O2 | C2 | C1 | H22 | 72.2° | 62.5° |
| O2 | C2 | C3 | H39 | 55.7° | 57.0° |
| H1 | C1X | C2X | H10 | 43.5° | 57.7° |
| H2 | C5X | C6X | H3 | 59.5° | 65.0° |
| H2 | C5X | C6X | H4 | 179.7° | 175.0° |
| H2 | C5X | C4X | H6 | 61.2° | 57.6° |
| H3 | C6X | O6X | H5 | 60.2° | 60.0° |
| H4 | C6X | O6X | H5 | 60.2° | 60.1° |
| H6 | C4X | O4X | H7 | 59.0° | 59.9° |
| H6 | C4X | C3X | H8 | 55.2° | 57.0° |
| H8 | C3X | O3X | H9 | 61.6° | 59.7° |
| H8 | C3X | C2X | H10 | 168.3° | 177.1° |
| H10 | C2X | O2X | H11 | 60.4° | 60.2° |
| H12 | C1Y | C2Y | H20 | 133.0° | 62.5° |
| H13 | C5Y | C6Y | H14 | 174.3° | 64.9° |
| H13 | C5Y | C6Y | H15 | 66.8° | 175.0° |
| H13 | C5Y | C4Y | H16 | 46.9° | 57.5° |
| H16 | C4Y | O4Y | H17 | 59.6° | 59.8° |
| H16 | C4Y | C3Y | H18 | 126.4° | 63.2° |
| H18 | C3Y | O3Y | H19 | 62.9° | 45.9° |
| H18 | C3Y | C2Y | H20 | 161.6° | 63.2° |
| H20 | C2Y | O2Y | H21 | 64.9° | 60.2° |
| H22 | C1 | C2 | H41 | 48.2° | 57.7° |
| H23 | C1' | O1' | H25 | 59.7° | 60.0° |
| H24 | C1' | O1' | H25 | 59.8° | 60.0° |
| H26 | C5' | C4' | H27 | 146.8° | 159.5° |
| H26 | C5' | C6' | H31 | 71.2° | 63.2° |
| H26 | C5' | C6' | H32 | 169.4° | 176.8° |
| H27 | C4' | O4' | H28 | 60.7° | 62.7° |
| H27 | C4' | C3' | H29 | 25.7° | 34.4° |
| H29 | C3' | O3' | H30 | 59.2° | 56.5° |
| H31 | C6' | O6' | H33 | 59.7° | 64.9° |
| H32 | C6' | O6' | H33 | 59.7° | 55.2° |
| H34 | C5 | C6 | H35 | 148.9° | 51.5° |
| H34 | C5 | C6 | H36 | 89.6° | 171.5° |
| H34 | C5 | C4 | H37 | 176.1° | 177.6° |
| H37 | C4 | O4 | H38 | 58.5° | 59.9° |
| H37 | C4 | C3 | H39 | 175.8° | 177.2° |
| H39 | C3 | O3 | H40 | 61.3° | 59.9° |
| H39 | C3 | C2 | H41 | 175.1° | 177.2° |
| H41 | C2 | O2 | H42 | 61.0° | 60.2° |
