SXN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O37 | C22 | doub | 1.21Å | 1.23Å | |
| C22 | O6' | sing | 1.34Å | 1.49Å | |
| C23 | C22 | sing | 1.51Å | 1.54Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C24 | C23 | sing | 1.53Å | 1.54Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C25 | C24 | sing | 1.53Å | 1.53Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C26 | C25 | sing | 1.53Å | 1.53Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| C27 | C26 | sing | 1.53Å | 1.52Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C28 | C27 | sing | 1.53Å | 1.53Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C29 | C28 | sing | 1.53Å | 1.53Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| C30 | C29 | sing | 1.53Å | 1.54Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H30A | sing | 1.09Å | 1.10Å | |
| C31 | C30 | sing | 1.53Å | 1.53Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H31A | sing | 1.09Å | 1.10Å | |
| C32 | C31 | sing | 1.53Å | 1.53Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| C33 | C32 | sing | 1.53Å | 1.53Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H33A | sing | 1.09Å | 1.10Å | |
| C34 | C33 | sing | 1.53Å | 1.53Å | |
| C34 | C38 | sing | 1.53Å | 1.52Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| C38 | H38 | sing | 1.09Å | 1.10Å | |
| C38 | H38A | sing | 1.09Å | 1.10Å | |
| C38 | H38B | sing | 1.09Å | 1.10Å | |
| C35 | C34 | sing | 1.53Å | 1.53Å | |
| C35 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H35A | sing | 1.09Å | 1.10Å | |
| C35 | H35B | sing | 1.09Å | 1.10Å | |
| O6' | C6'A | sing | 1.45Å | 1.45Å | |
| C6'A | C5'A | sing | 1.53Å | 1.55Å | |
| C6'A | H6'A | sing | 1.09Å | 1.10Å | |
| C6'A | H6AA | sing | 1.09Å | 1.10Å | |
| C5'A | O5' | sing | 1.43Å | 1.48Å | |
| C5'A | C4'A | sing | 1.53Å | 1.56Å | |
| C5'A | H5' | sing | 1.09Å | 1.10Å | |
| C4'A | C3'A | sing | 1.53Å | 1.56Å | |
| C4'A | H4'A | sing | 1.09Å | 1.10Å | |
| O4' | C4'A | sing | 1.43Å | 1.44Å | |
| O4' | HO4' | sing | 0.97Å | 0.95Å | |
| C3'A | C2'A | sing | 1.53Å | 1.57Å | |
| C3'A | O3' | sing | 1.43Å | 1.44Å | |
| C3'A | H3'A | sing | 1.09Å | 1.10Å | |
| O3' | HO3' | sing | 0.97Å | 0.95Å | |
| C2'A | O2' | sing | 1.43Å | 1.44Å | |
| C2'A | H2'A | sing | 1.09Å | 1.10Å | |
| O2' | HO2' | sing | 0.97Å | 0.95Å | |
| O5' | C1'A | sing | 1.43Å | 1.47Å | |
| C1'A | C2'A | sing | 1.53Å | 1.56Å | |
| C1'A | O1' | sing | 1.43Å | 1.50Å | |
| C1'A | H1' | sing | 1.09Å | 1.10Å | |
| C1' | O1' | sing | 1.43Å | 1.50Å | |
| C1' | C17' | sing | 1.53Å | 1.54Å | |
| C17' | H17' | sing | 1.09Å | 1.10Å | |
| C17' | H17A | sing | 1.09Å | 1.10Å | |
| C17' | H17B | sing | 1.09Å | 1.10Å | |
| C16' | C1' | sing | 1.53Å | 1.55Å | |
| C16' | H16' | sing | 1.09Å | 1.10Å | |
| C16' | H16A | sing | 1.09Å | 1.10Å | |
| C16' | H16B | sing | 1.09Å | 1.10Å | |
| C2' | C1' | sing | 1.53Å | 1.63Å | |
| C2' | O36 | sing | 1.43Å | 1.44Å | |
| C2' | H2' | sing | 1.09Å | 1.10Å | |
| O36 | HO36 | sing | 0.97Å | 0.95Å | |
| C3' | C2' | sing | 1.51Å | 1.59Å | |
| C3' | H3' | sing | 1.08Å | 1.08Å | |
| C4' | C3' | doub | 1.34Å | 1.41Å | |
| C4' | H4' | sing | 1.08Å | 1.08Å | |
| C5' | C4' | sing | 1.42Å | 1.44Å | |
| C18' | C5' | sing | 1.51Å | 1.53Å | |
| C18' | H18' | sing | 1.09Å | 1.10Å | |
| C18' | H18A | sing | 1.09Å | 1.10Å | |
| C18' | H18B | sing | 1.09Å | 1.10Å | |
| C6' | C5' | doub | 1.36Å | 1.44Å | |
| C6' | H6' | sing | 1.08Å | 1.08Å | |
| C7' | C6' | sing | 1.41Å | 1.42Å | |
| C7' | H7' | sing | 1.08Å | 1.08Å | |
| C8' | C7' | doub | 1.37Å | 1.42Å | |
| C8' | H8' | sing | 1.08Å | 1.08Å | |
| C9' | C8' | sing | 1.40Å | 1.44Å | |
| C19' | C9' | sing | 1.51Å | 1.53Å | |
| C19' | H19' | sing | 1.09Å | 1.10Å | |
| C19' | H19A | sing | 1.09Å | 1.10Å | |
| C10' | C9' | doub | 1.38Å | 1.44Å | |
| C10' | H10' | sing | 1.08Å | 1.08Å | |
| C11' | C10' | sing | 1.40Å | 1.41Å | |
| C11' | H11' | sing | 1.08Å | 1.08Å | |
| C12' | C11' | doub | 1.38Å | 1.42Å | |
| C12' | H12' | sing | 1.08Å | 1.08Å | |
| C13' | C12' | sing | 1.40Å | 1.44Å | |
| C20' | C13' | sing | 1.51Å | 1.53Å | |
| C20' | H20' | sing | 1.09Å | 1.10Å | |
| C20' | H20A | sing | 1.09Å | 1.10Å | |
| C20' | H20B | sing | 1.09Å | 1.10Å | |
| C14' | C13' | doub | 1.38Å | 1.43Å | |
| C14' | H14' | sing | 1.08Å | 1.08Å | |
| C15' | C14' | sing | 1.40Å | 1.41Å | |
| C15' | C15 | doub | 1.38Å | 1.40Å | |
| C15' | H15' | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C14 | C15 | sing | 1.39Å | 1.41Å | |
| C14 | C13 | doub | 1.38Å | 1.43Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C13 | C20 | sing | 1.51Å | 1.53Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20C | sing | 1.09Å | 1.10Å | |
| C20 | H20D | sing | 1.09Å | 1.10Å | |
| C12 | C13 | sing | 1.39Å | 1.42Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C11 | C12 | doub | 1.38Å | 1.40Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C10 | C11 | sing | 1.39Å | 1.41Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C9 | C10 | doub | 1.38Å | 1.42Å | |
| C9 | C19 | sing | 1.51Å | 1.53Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19B | sing | 1.09Å | 1.10Å | |
| C19 | H19C | sing | 1.09Å | 1.10Å | |
| C8 | C9 | sing | 1.39Å | 1.42Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C7 | C8 | doub | 1.38Å | 1.41Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C6 | C7 | sing | 1.39Å | 1.43Å | |
| C6 | C1 | sing | 1.51Å | 1.58Å | |
| C1 | C16 | sing | 1.53Å | 1.54Å | |
| C17 | C1 | sing | 1.53Å | 1.55Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17C | sing | 1.09Å | 1.10Å | |
| C17 | H17D | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16C | sing | 1.09Å | 1.10Å | |
| C16 | H16D | sing | 1.09Å | 1.10Å | |
| C5 | C6 | doub | 1.38Å | 1.42Å | |
| C5 | C18 | sing | 1.51Å | 1.53Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18C | sing | 1.09Å | 1.10Å | |
| C18 | H18D | sing | 1.09Å | 1.10Å | |
| C4 | C5 | sing | 1.39Å | 1.39Å | |
| O21 | C4 | doub | 1.22Å | 1.23Å | |
| C3 | C4 | sing | 1.51Å | 1.53Å | |
| C3 | C2 | sing | 1.53Å | 1.54Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| C2 | C1 | sing | 1.53Å | 1.56Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C19' | H92 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O37 | C22 | O6' | 120.3° | 120.0° |
| O37 | C22 | C23 | 119.7° | 120.0° |
| O6' | C22 | C23 | 120.0° | 120.0° |
| C22 | O6' | C6'A | 121.7° | 116.9° |
| C22 | C23 | H23 | 109.2° | 109.5° |
| C22 | C23 | H23A | 109.2° | 109.5° |
| C22 | C23 | C24 | 110.8° | 109.5° |
| H23 | C23 | H23A | 109.5° | 109.5° |
| H23 | C23 | C24 | 109.1° | 109.5° |
| H23A | C23 | C24 | 109.2° | 109.5° |
| C23 | C24 | H24 | 109.3° | 109.5° |
| C23 | C24 | H24A | 109.3° | 109.5° |
| C23 | C24 | C25 | 110.3° | 109.5° |
| H24 | C24 | H24A | 109.5° | 109.5° |
| H24 | C24 | C25 | 109.3° | 109.5° |
| H24A | C24 | C25 | 109.3° | 109.4° |
| C24 | C25 | H25 | 109.4° | 109.5° |
| C24 | C25 | H25A | 109.4° | 109.4° |
| C24 | C25 | C26 | 109.7° | 109.5° |
| H25 | C25 | H25A | 109.4° | 109.5° |
| H25 | C25 | C26 | 109.4° | 109.5° |
| H25A | C25 | C26 | 109.4° | 109.5° |
| C25 | C26 | H26 | 109.2° | 109.5° |
| C25 | C26 | H26A | 109.2° | 109.5° |
| C25 | C26 | C27 | 110.5° | 109.5° |
| H26 | C26 | H26A | 109.5° | 109.5° |
| H26 | C26 | C27 | 109.2° | 109.5° |
| H26A | C26 | C27 | 109.2° | 109.4° |
| C26 | C27 | H27 | 109.4° | 109.5° |
| C26 | C27 | H27A | 109.4° | 109.4° |
| C26 | C27 | C28 | 109.5° | 109.5° |
| H27 | C27 | H27A | 109.5° | 109.5° |
| H27 | C27 | C28 | 109.5° | 109.5° |
| H27A | C27 | C28 | 109.4° | 109.5° |
| C27 | C28 | H28 | 109.3° | 109.5° |
| C27 | C28 | H28A | 109.4° | 109.5° |
| C27 | C28 | C29 | 110.0° | 109.5° |
| H28 | C28 | H28A | 109.5° | 109.5° |
| H28 | C28 | C29 | 109.4° | 109.5° |
| H28A | C28 | C29 | 109.3° | 109.5° |
| C28 | C29 | H29 | 109.3° | 109.4° |
| C28 | C29 | H29A | 109.3° | 109.5° |
| C28 | C29 | C30 | 110.1° | 109.5° |
| H29 | C29 | H29A | 109.5° | 109.5° |
| H29 | C29 | C30 | 109.3° | 109.5° |
| H29A | C29 | C30 | 109.3° | 109.5° |
| C29 | C30 | H30 | 109.3° | 109.5° |
| C29 | C30 | H30A | 109.4° | 109.5° |
| C29 | C30 | C31 | 109.9° | 109.5° |
| H30 | C30 | H30A | 109.5° | 109.4° |
| H30 | C30 | C31 | 109.4° | 109.5° |
| H30A | C30 | C31 | 109.3° | 109.5° |
| C30 | C31 | H31 | 109.3° | 109.5° |
| C30 | C31 | H31A | 109.3° | 109.5° |
| C30 | C31 | C32 | 110.0° | 109.5° |
| H31 | C31 | H31A | 109.5° | 109.5° |
| H31 | C31 | C32 | 109.3° | 109.4° |
| H31A | C31 | C32 | 109.3° | 109.5° |
| C31 | C32 | H32 | 109.4° | 109.5° |
| C31 | C32 | H32A | 109.4° | 109.5° |
| C31 | C32 | C33 | 109.6° | 109.5° |
| H32 | C32 | H32A | 109.5° | 109.4° |
| H32 | C32 | C33 | 109.4° | 109.5° |
| H32A | C32 | C33 | 109.4° | 109.5° |
| C32 | C33 | H33 | 109.3° | 109.4° |
| C32 | C33 | H33A | 109.3° | 109.5° |
| C32 | C33 | C34 | 110.1° | 109.5° |
| H33 | C33 | H33A | 109.5° | 109.5° |
| H33 | C33 | C34 | 109.3° | 109.4° |
| H33A | C33 | C34 | 109.3° | 109.5° |
| C33 | C34 | C38 | 109.3° | 109.5° |
| C33 | C34 | H34 | 109.5° | 109.4° |
| C33 | C34 | C35 | 109.5° | 109.5° |
| C38 | C34 | H34 | 109.6° | 109.4° |
| C34 | C38 | H38 | 109.5° | 109.5° |
| C34 | C38 | H38A | 109.5° | 109.5° |
| C34 | C38 | H38B | 109.5° | 109.4° |
| C38 | C34 | C35 | 109.4° | 109.5° |
| H34 | C34 | C35 | 109.6° | 109.5° |
| H38 | C38 | H38A | 109.5° | 109.5° |
| H38 | C38 | H38B | 109.4° | 109.5° |
| H38A | C38 | H38B | 109.5° | 109.5° |
| C34 | C35 | H35 | 109.5° | 109.5° |
| C34 | C35 | H35A | 109.5° | 109.5° |
| C34 | C35 | H35B | 109.5° | 109.4° |
| H35 | C35 | H35A | 109.5° | 109.5° |
| H35 | C35 | H35B | 109.4° | 109.5° |
| H35A | C35 | H35B | 109.5° | 109.5° |
| O6' | C6'A | C5'A | 110.8° | 109.4° |
| O6' | C6'A | H6'A | 109.2° | 109.5° |
| O6' | C6'A | H6AA | 109.1° | 109.5° |
| C5'A | C6'A | H6'A | 109.2° | 109.4° |
| C5'A | C6'A | H6AA | 109.1° | 109.5° |
| C6'A | C5'A | O5' | 110.8° | 109.5° |
| C6'A | C5'A | C4'A | 112.2° | 109.5° |
| C6'A | C5'A | H5' | 107.7° | 109.5° |
| H6'A | C6'A | H6AA | 109.5° | 109.5° |
| O5' | C5'A | C4'A | 109.9° | 109.4° |
| O5' | C5'A | H5' | 108.6° | 109.4° |
| C5'A | O5' | C1'A | 120.7° | 114.1° |
| C4'A | C5'A | H5' | 107.5° | 109.5° |
| C5'A | C4'A | C3'A | 112.3° | 109.2° |
| C5'A | C4'A | H4'A | 107.9° | 109.5° |
| C5'A | C4'A | O4' | 110.5° | 109.5° |
| C3'A | C4'A | H4'A | 107.9° | 109.5° |
| C3'A | C4'A | O4' | 108.8° | 109.5° |
| C4'A | C3'A | C2'A | 112.6° | 109.0° |
| C4'A | C3'A | O3' | 109.7° | 109.6° |
| C4'A | C3'A | H3'A | 107.7° | 109.5° |
| H4'A | C4'A | O4' | 109.4° | 109.5° |
| C4'A | O4' | HO4' | 109.5° | 114.0° |
| C2'A | C3'A | O3' | 110.1° | 109.5° |
| C2'A | C3'A | H3'A | 107.5° | 109.5° |
| C3'A | C2'A | O2' | 109.8° | 109.5° |
| C3'A | C2'A | H2'A | 108.6° | 109.5° |
| C3'A | C2'A | C1'A | 110.1° | 109.2° |
| O3' | C3'A | H3'A | 109.1° | 109.6° |
| C3'A | O3' | HO3' | 109.5° | 113.9° |
| O2' | C2'A | H2'A | 110.3° | 109.5° |
| C2'A | O2' | HO2' | 109.5° | 114.0° |
| O2' | C2'A | C1'A | 109.4° | 109.5° |
| H2'A | C2'A | C1'A | 108.6° | 109.6° |
| O5' | C1'A | C2'A | 110.4° | 109.4° |
| O5' | C1'A | O1' | 109.3° | 109.5° |
| O5' | C1'A | H1' | 109.6° | 109.5° |
| C2'A | C1'A | O1' | 109.9° | 109.5° |
| C2'A | C1'A | H1' | 108.4° | 109.5° |
| O1' | C1'A | H1' | 109.2° | 109.5° |
| C1'A | O1' | C1' | 123.0° | 114.0° |
| O1' | C1' | C17' | 108.1° | 109.4° |
| O1' | C1' | C16' | 110.3° | 109.5° |
| O1' | C1' | C2' | 107.6° | 109.5° |
| C1' | C17' | H17' | 109.5° | 109.4° |
| C1' | C17' | H17A | 109.4° | 109.5° |
| C1' | C17' | H17B | 109.5° | 109.5° |
| C17' | C1' | C16' | 108.3° | 109.5° |
| C17' | C1' | C2' | 110.3° | 109.5° |
| H17' | C17' | H17A | 109.4° | 109.4° |
| H17' | C17' | H17B | 109.5° | 109.5° |
| H17A | C17' | H17B | 109.5° | 109.5° |
| C1' | C16' | H16' | 109.5° | 109.4° |
| C1' | C16' | H16A | 109.4° | 109.5° |
| C1' | C16' | H16B | 109.5° | 109.5° |
| C16' | C1' | C2' | 112.1° | 109.5° |
| H16' | C16' | H16A | 109.5° | 109.5° |
| H16' | C16' | H16B | 109.5° | 109.5° |
| H16A | C16' | H16B | 109.5° | 109.5° |
| C1' | C2' | O36 | 112.0° | 109.5° |
| C1' | C2' | H2' | 105.4° | 109.5° |
| C1' | C2' | C3' | 115.1° | 109.5° |
| O36 | C2' | H2' | 107.6° | 109.4° |
| C2' | O36 | HO36 | 109.5° | 113.9° |
| O36 | C2' | C3' | 110.2° | 109.5° |
| H2' | C2' | C3' | 105.9° | 109.5° |
| C2' | C3' | H3' | 120.3° | 120.0° |
| C2' | C3' | C4' | 119.5° | 120.0° |
| H3' | C3' | C4' | 120.2° | 120.0° |
| C3' | C4' | H4' | 117.8° | 120.0° |
| C3' | C4' | C5' | 124.3° | 120.0° |
| H4' | C4' | C5' | 117.9° | 120.0° |
| C4' | C5' | C18' | 121.5° | 120.0° |
| C4' | C5' | C6' | 117.4° | 120.0° |
| C5' | C18' | H18' | 109.5° | 109.5° |
| C5' | C18' | H18A | 109.5° | 109.5° |
| C5' | C18' | H18B | 109.5° | 109.4° |
| C18' | C5' | C6' | 121.1° | 120.0° |
| H18' | C18' | H18A | 109.4° | 109.4° |
| H18' | C18' | H18B | 109.5° | 109.6° |
| H18A | C18' | H18B | 109.4° | 109.5° |
| C5' | C6' | H6' | 117.4° | 120.0° |
| C5' | C6' | C7' | 125.3° | 120.0° |
| H6' | C6' | C7' | 117.3° | 120.0° |
| C6' | C7' | H7' | 121.7° | 120.0° |
| C6' | C7' | C8' | 116.6° | 120.0° |
| H7' | C7' | C8' | 121.7° | 120.1° |
| C7' | C8' | H8' | 116.8° | 120.0° |
| C7' | C8' | C9' | 126.3° | 120.0° |
| H8' | C8' | C9' | 116.9° | 120.0° |
| C8' | C9' | C19' | 121.7° | 120.0° |
| C8' | C9' | C10' | 116.8° | 120.0° |
| C9' | C19' | H19' | 109.5° | 109.4° |
| C9' | C19' | H19A | 109.5° | 109.5° |
| C19' | C9' | C10' | 121.5° | 120.0° |
| C9' | C19' | H92 | 109.5° | 109.5° |
| H19' | C19' | H19A | 109.5° | 109.5° |
| H19' | C19' | H92 | 109.4° | 109.5° |
| H19A | C19' | H92 | 109.4° | 109.5° |
| C9' | C10' | H10' | 117.8° | 120.0° |
| C9' | C10' | C11' | 124.4° | 120.0° |
| H10' | C10' | C11' | 117.8° | 120.0° |
| C10' | C11' | H11' | 120.6° | 120.0° |
| C10' | C11' | C12' | 118.7° | 120.0° |
| H11' | C11' | C12' | 120.7° | 120.0° |
| C11' | C12' | H12' | 118.5° | 120.0° |
| C11' | C12' | C13' | 123.1° | 120.0° |
| H12' | C12' | C13' | 118.5° | 120.0° |
| C12' | C13' | C20' | 120.9° | 120.0° |
| C12' | C13' | C14' | 118.0° | 120.0° |
| C13' | C20' | H20' | 109.5° | 109.5° |
| C13' | C20' | H20A | 109.4° | 109.5° |
| C13' | C20' | H20B | 109.5° | 109.5° |
| C20' | C13' | C14' | 121.1° | 120.0° |
| H20' | C20' | H20A | 109.5° | 109.5° |
| H20' | C20' | H20B | 109.5° | 109.5° |
| H20A | C20' | H20B | 109.5° | 109.4° |
| C13' | C14' | H14' | 118.5° | 120.0° |
| C13' | C14' | C15' | 123.1° | 120.0° |
| H14' | C14' | C15' | 118.4° | 120.0° |
| C14' | C15' | C15 | 119.2° | 120.0° |
| C14' | C15' | H15' | 120.4° | 120.0° |
| C15 | C15' | H15' | 120.4° | 120.0° |
| C15' | C15 | H15 | 119.8° | 120.0° |
| C15' | C15 | C14 | 120.4° | 120.0° |
| H15 | C15 | C14 | 119.8° | 120.0° |
| C15 | C14 | C13 | 122.7° | 120.0° |
| C15 | C14 | H14 | 118.7° | 120.0° |
| C13 | C14 | H14 | 118.6° | 120.0° |
| C14 | C13 | C20 | 120.9° | 120.0° |
| C14 | C13 | C12 | 118.4° | 120.0° |
| C13 | C20 | H20 | 109.5° | 109.5° |
| C13 | C20 | H20C | 109.5° | 109.5° |
| C13 | C20 | H20D | 109.5° | 109.4° |
| C20 | C13 | C12 | 120.7° | 120.0° |
| H20 | C20 | H20C | 109.4° | 109.5° |
| H20 | C20 | H20D | 109.5° | 109.4° |
| H20C | C20 | H20D | 109.5° | 109.5° |
| C13 | C12 | H12 | 118.5° | 120.0° |
| C13 | C12 | C11 | 122.9° | 120.0° |
| H12 | C12 | C11 | 118.6° | 120.0° |
| C12 | C11 | H11 | 119.7° | 120.0° |
| C12 | C11 | C10 | 120.7° | 120.0° |
| H11 | C11 | C10 | 119.7° | 120.1° |
| C11 | C10 | H10 | 119.4° | 120.0° |
| C11 | C10 | C9 | 121.3° | 120.0° |
| H10 | C10 | C9 | 119.3° | 120.0° |
| C10 | C9 | C19 | 120.1° | 120.0° |
| C10 | C9 | C8 | 119.8° | 120.0° |
| C9 | C19 | H19 | 109.5° | 109.4° |
| C9 | C19 | H19B | 109.5° | 109.5° |
| C9 | C19 | H19C | 109.5° | 109.4° |
| C19 | C9 | C8 | 120.1° | 120.0° |
| H19 | C19 | H19B | 109.4° | 109.5° |
| H19 | C19 | H19C | 109.5° | 109.4° |
| H19B | C19 | H19C | 109.4° | 109.5° |
| C9 | C8 | H8 | 119.7° | 120.0° |
| C9 | C8 | C7 | 120.7° | 119.9° |
| H8 | C8 | C7 | 119.6° | 120.0° |
| C8 | C7 | H7 | 118.1° | 120.0° |
| C8 | C7 | C6 | 123.8° | 119.9° |
| H7 | C7 | C6 | 118.1° | 120.0° |
| C7 | C6 | C1 | 118.1° | 119.6° |
| C7 | C6 | C5 | 120.9° | 119.6° |
| C6 | C1 | C16 | 110.8° | 109.5° |
| C6 | C1 | C17 | 109.4° | 109.5° |
| C1 | C6 | C5 | 120.9° | 120.8° |
| C6 | C1 | C2 | 111.2° | 109.4° |
| C16 | C1 | C17 | 108.6° | 109.5° |
| C1 | C16 | H16 | 109.5° | 109.5° |
| C1 | C16 | H16C | 109.5° | 109.5° |
| C1 | C16 | H16D | 109.5° | 109.5° |
| C16 | C1 | C2 | 106.9° | 109.5° |
| C1 | C17 | H17 | 109.5° | 109.4° |
| C1 | C17 | H17C | 109.5° | 109.5° |
| C1 | C17 | H17D | 109.4° | 109.5° |
| C17 | C1 | C2 | 109.9° | 109.5° |
| H17 | C17 | H17C | 109.4° | 109.5° |
| H17 | C17 | H17D | 109.5° | 109.4° |
| H17C | C17 | H17D | 109.5° | 109.5° |
| H16 | C16 | H16C | 109.5° | 109.5° |
| H16 | C16 | H16D | 109.5° | 109.4° |
| H16C | C16 | H16D | 109.4° | 109.5° |
| C6 | C5 | C18 | 120.4° | 119.3° |
| C6 | C5 | C4 | 121.0° | 121.3° |
| C5 | C18 | H18 | 109.5° | 109.5° |
| C5 | C18 | H18C | 109.5° | 109.5° |
| C5 | C18 | H18D | 109.5° | 109.4° |
| C18 | C5 | C4 | 118.5° | 119.3° |
| H18 | C18 | H18C | 109.4° | 109.5° |
| H18 | C18 | H18D | 109.5° | 109.4° |
| H18C | C18 | H18D | 109.5° | 109.5° |
| C5 | C4 | O21 | 120.9° | 119.6° |
| C5 | C4 | C3 | 121.4° | 120.7° |
| O21 | C4 | C3 | 117.6° | 119.7° |
| C4 | C3 | C2 | 110.9° | 109.4° |
| C4 | C3 | H3 | 109.1° | 109.5° |
| C4 | C3 | H3A | 109.1° | 109.5° |
| C2 | C3 | H3 | 109.1° | 109.3° |
| C2 | C3 | H3A | 109.1° | 109.6° |
| C3 | C2 | C1 | 111.3° | 109.0° |
| C3 | C2 | H2 | 109.0° | 109.5° |
| C3 | C2 | H2A | 109.0° | 109.6° |
| H3 | C3 | H3A | 109.5° | 109.5° |
| C1 | C2 | H2 | 109.0° | 109.4° |
| C1 | C2 | H2A | 109.0° | 109.7° |
| H2 | C2 | H2A | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O37 | C22 | O6' | C23 | 178.3° | 179.7° |
| O37 | C22 | C23 | H23 | 179.9° | 120.0° |
| O37 | C22 | C23 | H23A | 60.2° | 120.0° |
| O37 | C22 | C23 | C24 | 60.0° | 0.0° |
| O37 | C22 | O6' | C6'A | 10.4° | 0.0° |
| O6' | C22 | C23 | H23 | 1.6° | 59.7° |
| O6' | C22 | C23 | H23A | 118.0° | 60.2° |
| O6' | C22 | C23 | C24 | 121.8° | 179.7° |
| C22 | O6' | C6'A | C5'A | 86.7° | 180.0° |
| C22 | O6' | C6'A | H6'A | 153.1° | 60.0° |
| C22 | O6' | C6'A | H6AA | 33.5° | 60.0° |
| C22 | C23 | H23 | H23A | 119.4° | 120.0° |
| C22 | C23 | H23 | C24 | 121.2° | 120.0° |
| C22 | C23 | H23A | C24 | 121.2° | 120.0° |
| C22 | C23 | C24 | H24 | 29.8° | 60.0° |
| C22 | C23 | C24 | H24A | 90.0° | 60.0° |
| C22 | C23 | C24 | C25 | 149.9° | 180.0° |
| C23 | C22 | O6' | C6'A | 167.9° | 179.7° |
| H23 | C23 | H23A | C24 | 119.4° | 120.0° |
| H23 | C23 | C24 | H24 | 150.0° | 180.0° |
| H23 | C23 | C24 | H24A | 30.3° | 60.0° |
| H23 | C23 | C24 | C25 | 89.9° | 60.0° |
| H23A | C23 | C24 | H24 | 90.4° | 60.0° |
| H23A | C23 | C24 | H24A | 149.8° | 180.0° |
| H23A | C23 | C24 | C25 | 29.7° | 60.0° |
| C23 | C24 | H24 | H24A | 119.7° | 120.0° |
| C23 | C24 | H24 | C25 | 120.7° | 120.0° |
| C23 | C24 | H24A | C25 | 120.7° | 120.0° |
| C23 | C24 | C25 | H25 | 103.7° | 60.0° |
| C23 | C24 | C25 | H25A | 16.2° | 60.0° |
| C23 | C24 | C25 | C26 | 136.2° | NaN° |
| H24 | C24 | H24A | C25 | 119.6° | 120.0° |
| H24 | C24 | C25 | H25 | 136.2° | 180.0° |
| H24 | C24 | C25 | H25A | 103.9° | 60.0° |
| H24 | C24 | C25 | C26 | 16.1° | 60.0° |
| H24A | C24 | C25 | H25 | 16.4° | 60.0° |
| H24A | C24 | C25 | H25A | 136.3° | 180.0° |
| H24A | C24 | C25 | C26 | 103.7° | 60.0° |
| C24 | C25 | H25 | H25A | 119.9° | 120.0° |
| C24 | C25 | H25 | C26 | 120.2° | 120.0° |
| C24 | C25 | H25A | C26 | 120.2° | 120.0° |
| C24 | C25 | C26 | H26 | 118.5° | 60.0° |
| C24 | C25 | C26 | H26A | 1.2° | 60.1° |
| C24 | C25 | C26 | C27 | 121.3° | NaN° |
| H25 | C25 | H25A | C26 | 119.9° | 120.0° |
| H25 | C25 | C26 | H26 | 121.4° | 180.0° |
| H25 | C25 | C26 | H26A | 118.9° | 59.9° |
| H25 | C25 | C26 | C27 | 1.3° | 60.0° |
| H25A | C25 | C26 | H26 | 1.5° | 60.0° |
| H25A | C25 | C26 | H26A | 121.2° | 180.0° |
| H25A | C25 | C26 | C27 | 118.6° | 60.0° |
| C25 | C26 | H26 | H26A | 119.6° | 120.1° |
| C25 | C26 | H26 | C27 | 120.9° | 120.0° |
| C25 | C26 | H26A | C27 | 120.9° | 120.0° |
| C25 | C26 | C27 | H27 | 49.9° | 60.0° |
| C25 | C26 | C27 | H27A | 70.1° | 60.0° |
| C25 | C26 | C27 | C28 | 169.9° | NaN° |
| H26 | C26 | H26A | C27 | 119.5° | 120.0° |
| H26 | C26 | C27 | H27 | 170.1° | 180.0° |
| H26 | C26 | C27 | H27A | 50.1° | 60.0° |
| H26 | C26 | C27 | C28 | 69.9° | 60.0° |
| H26A | C26 | C27 | H27 | 70.3° | 60.0° |
| H26A | C26 | C27 | H27A | 169.7° | 180.0° |
| H26A | C26 | C27 | C28 | 49.7° | 60.0° |
| C26 | C27 | H27 | H27A | 120.0° | 120.0° |
| C26 | C27 | H27 | C28 | 120.1° | 120.0° |
| C26 | C27 | H27A | C28 | 120.1° | 120.0° |
| C26 | C27 | C28 | H28 | 92.6° | 60.0° |
| C26 | C27 | C28 | H28A | 27.2° | 60.0° |
| C26 | C27 | C28 | C29 | 147.3° | 180.0° |
| H27 | C27 | H27A | C28 | 120.0° | 120.0° |
| H27 | C27 | C28 | H28 | 147.4° | 180.0° |
| H27 | C27 | C28 | H28A | 92.8° | 60.0° |
| H27 | C27 | C28 | C29 | 27.3° | 60.0° |
| H27A | C27 | C28 | H28 | 27.4° | 60.0° |
| H27A | C27 | C28 | H28A | 147.2° | 180.0° |
| H27A | C27 | C28 | C29 | 92.7° | 60.0° |
| C27 | C28 | H28 | H28A | 119.8° | 120.0° |
| C27 | C28 | H28 | C29 | 120.5° | 120.0° |
| C27 | C28 | H28A | C29 | 120.5° | 120.0° |
| C27 | C28 | C29 | H29 | 76.4° | 60.0° |
| C27 | C28 | C29 | H29A | 43.4° | 60.0° |
| C27 | C28 | C29 | C30 | 163.5° | NaN° |
| H28 | C28 | H28A | C29 | 119.8° | 120.0° |
| H28 | C28 | C29 | H29 | 163.6° | 180.0° |
| H28 | C28 | C29 | H29A | 76.6° | 60.0° |
| H28 | C28 | C29 | C30 | 43.5° | 60.0° |
| H28A | C28 | C29 | H29 | 43.7° | 60.0° |
| H28A | C28 | C29 | H29A | 163.5° | 180.0° |
| H28A | C28 | C29 | C30 | 76.4° | 60.0° |
| C28 | C29 | H29 | H29A | 119.7° | 120.0° |
| C28 | C29 | H29 | C30 | 120.6° | 120.0° |
| C28 | C29 | H29A | C30 | 120.6° | 120.0° |
| C28 | C29 | C30 | H30 | 17.6° | 60.0° |
| C28 | C29 | C30 | H30A | 137.5° | 60.0° |
| C28 | C29 | C30 | C31 | 102.5° | 180.0° |
| H29 | C29 | H29A | C30 | 119.7° | 120.0° |
| H29 | C29 | C30 | H30 | 102.5° | 180.0° |
| H29 | C29 | C30 | H30A | 17.4° | 60.0° |
| H29 | C29 | C30 | C31 | 137.4° | 60.0° |
| H29A | C29 | C30 | H30 | 137.7° | 60.0° |
| H29A | C29 | C30 | H30A | 102.4° | 180.0° |
| H29A | C29 | C30 | C31 | 17.6° | 60.0° |
| C29 | C30 | H30 | H30A | 119.8° | 120.0° |
| C29 | C30 | H30 | C31 | 120.4° | 120.0° |
| C29 | C30 | H30A | C31 | 120.4° | 120.0° |
| C29 | C30 | C31 | H31 | 7.8° | 60.0° |
| C29 | C30 | C31 | H31A | 127.6° | 60.0° |
| C29 | C30 | C31 | C32 | 112.3° | 180.0° |
| H30 | C30 | H30A | C31 | 119.8° | 120.0° |
| H30 | C30 | C31 | H31 | 112.3° | 179.9° |
| H30 | C30 | C31 | H31A | 7.6° | 60.0° |
| H30 | C30 | C31 | C32 | 127.6° | 60.0° |
| H30A | C30 | C31 | H31 | 127.9° | 60.0° |
| H30A | C30 | C31 | H31A | 112.3° | 180.0° |
| H30A | C30 | C31 | C32 | 7.8° | 60.0° |
| C30 | C31 | H31 | H31A | 119.8° | 120.0° |
| C30 | C31 | H31 | C32 | 120.5° | 120.0° |
| C30 | C31 | H31A | C32 | 120.5° | 120.0° |
| C30 | C31 | C32 | H32 | 35.8° | 60.0° |
| C30 | C31 | C32 | H32A | 84.2° | 60.0° |
| C30 | C31 | C32 | C33 | 155.8° | 180.0° |
| H31 | C31 | H31A | C32 | 119.8° | 120.0° |
| H31 | C31 | C32 | H32 | 155.8° | 180.0° |
| H31 | C31 | C32 | H32A | 35.9° | 60.0° |
| H31 | C31 | C32 | C33 | 84.1° | 60.0° |
| H31A | C31 | C32 | H32 | 84.3° | 60.0° |
| H31A | C31 | C32 | H32A | 155.7° | 180.0° |
| H31A | C31 | C32 | C33 | 35.7° | 60.0° |
| C31 | C32 | H32 | H32A | 120.0° | 120.0° |
| C31 | C32 | H32 | C33 | 120.1° | 120.0° |
| C31 | C32 | H32A | C33 | 120.1° | 120.0° |
| C31 | C32 | C33 | H33 | 16.9° | 60.0° |
| C31 | C32 | C33 | H33A | 103.0° | 60.0° |
| C31 | C32 | C33 | C34 | 136.9° | 180.0° |
| H32 | C32 | H32A | C33 | 119.9° | 120.0° |
| H32 | C32 | C33 | H33 | 136.9° | 180.0° |
| H32 | C32 | C33 | H33A | 17.0° | 60.0° |
| H32 | C32 | C33 | C34 | 103.1° | 60.0° |
| H32A | C32 | C33 | H33 | 103.2° | 60.0° |
| H32A | C32 | C33 | H33A | 137.0° | 180.0° |
| H32A | C32 | C33 | C34 | 16.9° | 59.9° |
| C32 | C33 | H33 | H33A | 119.7° | 120.0° |
| C32 | C33 | H33 | C34 | 120.5° | 120.0° |
| C32 | C33 | H33A | C34 | 120.5° | 120.0° |
| C32 | C33 | C34 | C38 | 111.9° | 65.0° |
| C32 | C33 | C34 | H34 | 8.1° | 55.0° |
| C32 | C33 | C34 | C35 | 128.3° | 175.0° |
| H33 | C33 | H33A | C34 | 119.7° | 120.0° |
| H33 | C33 | C34 | C38 | 8.1° | 55.0° |
| H33 | C33 | C34 | H34 | 128.2° | 175.0° |
| H33 | C33 | C34 | C35 | 111.7° | 65.1° |
| H33A | C33 | C34 | C38 | 128.0° | 175.0° |
| H33A | C33 | C34 | H34 | 112.0° | 65.0° |
| H33A | C33 | C34 | C35 | 8.2° | 55.0° |
| C33 | C34 | C38 | H34 | 120.0° | 120.0° |
| C33 | C34 | C38 | C35 | 119.9° | 120.0° |
| C33 | C34 | H34 | C35 | 120.1° | 120.0° |
| C33 | C34 | C38 | H38 | 180.0° | 180.0° |
| C33 | C34 | C38 | H38A | 60.0° | 60.0° |
| C33 | C34 | C38 | H38B | 60.0° | 60.0° |
| C33 | C34 | C35 | H35 | 180.0° | 60.0° |
| C33 | C34 | C35 | H35A | 60.0° | 179.9° |
| C33 | C34 | C35 | H35B | 60.0° | 60.1° |
| C38 | C34 | H34 | C35 | 120.0° | 120.0° |
| C34 | C38 | H38 | H38A | 120.0° | 120.0° |
| C34 | C38 | H38 | H38B | 120.0° | 120.0° |
| C34 | C38 | H38A | H38B | 120.0° | 120.0° |
| C38 | C34 | C35 | H35 | 60.2° | 180.0° |
| C38 | C34 | C35 | H35A | 59.8° | 60.0° |
| C38 | C34 | C35 | H35B | 179.8° | 60.0° |
| H34 | C34 | C38 | H38 | 60.0° | 60.0° |
| H34 | C34 | C38 | H38A | 60.0° | 60.0° |
| H34 | C34 | C38 | H38B | 180.0° | 180.0° |
| H34 | C34 | C35 | H35 | 59.9° | 60.0° |
| H34 | C34 | C35 | H35A | 179.9° | 60.0° |
| H34 | C34 | C35 | H35B | 60.1° | 180.0° |
| H38 | C38 | H38A | H38B | 120.0° | 120.0° |
| H38 | C38 | C34 | C35 | 60.1° | 60.0° |
| H38A | C38 | C34 | C35 | 179.9° | 180.0° |
| H38B | C38 | C34 | C35 | 59.9° | 60.0° |
| C34 | C35 | H35 | H35A | 120.0° | 120.0° |
| C34 | C35 | H35 | H35B | 120.0° | 120.0° |
| C34 | C35 | H35A | H35B | 120.0° | 120.0° |
| H35 | C35 | H35A | H35B | 120.0° | 120.0° |
| O6' | C6'A | C5'A | H6'A | 120.2° | 120.0° |
| O6' | C6'A | C5'A | H6AA | 120.2° | 120.0° |
| O6' | C6'A | H6'A | H6AA | 119.4° | 120.1° |
| O6' | C6'A | C5'A | O5' | 110.6° | 65.0° |
| O6' | C6'A | C5'A | C4'A | 126.2° | 175.1° |
| O6' | C6'A | C5'A | H5' | 8.0° | 55.0° |
| C5'A | C6'A | H6'A | H6AA | 119.4° | 120.0° |
| C6'A | C5'A | O5' | C4'A | 124.6° | 120.0° |
| C6'A | C5'A | O5' | H5' | 118.1° | 120.1° |
| C6'A | C5'A | C4'A | H5' | 118.2° | 120.1° |
| C6'A | C5'A | C4'A | C3'A | 150.6° | 177.6° |
| C6'A | C5'A | C4'A | H4'A | 90.6° | 62.5° |
| C6'A | C5'A | C4'A | O4' | 28.9° | 57.7° |
| C6'A | C5'A | O5' | C1'A | 175.7° | 178.8° |
| H6'A | C6'A | C5'A | O5' | 129.2° | 175.0° |
| H6'A | C6'A | C5'A | C4'A | 6.0° | 55.1° |
| H6'A | C6'A | C5'A | H5' | 112.2° | 65.0° |
| H6AA | C6'A | C5'A | O5' | 9.6° | 55.0° |
| H6AA | C6'A | C5'A | C4'A | 113.6° | 64.9° |
| H6AA | C6'A | C5'A | H5' | 128.2° | 175.0° |
| O5' | C5'A | C4'A | H5' | 118.0° | 119.9° |
| O5' | C5'A | C4'A | C3'A | 26.8° | 57.6° |
| O5' | C5'A | C4'A | H4'A | 145.6° | 177.5° |
| O5' | C5'A | C4'A | O4' | 94.9° | 62.3° |
| C5'A | O5' | C1'A | C2'A | 26.9° | 61.1° |
| C5'A | O5' | C1'A | O1' | 94.1° | 58.8° |
| C5'A | O5' | C1'A | H1' | 146.2° | 178.9° |
| C5'A | C4'A | C3'A | H4'A | 118.8° | 119.9° |
| C5'A | C4'A | C3'A | O4' | 122.6° | 119.9° |
| C5'A | C4'A | H4'A | O4' | 120.3° | 120.2° |
| C5'A | C4'A | O4' | HO4' | 180.0° | 180.0° |
| C5'A | C4'A | C3'A | C2'A | 28.6° | 57.0° |
| C5'A | C4'A | C3'A | O3' | 151.6° | 62.9° |
| C5'A | C4'A | C3'A | H3'A | 89.8° | 176.8° |
| C4'A | C5'A | O5' | C1'A | 59.7° | 61.2° |
| H5' | C5'A | C4'A | C3'A | 91.2° | 62.3° |
| H5' | C5'A | C4'A | H4'A | 27.6° | 57.6° |
| H5' | C5'A | C4'A | O4' | 147.2° | 177.8° |
| H5' | C5'A | O5' | C1'A | 57.6° | 58.8° |
| C3'A | C4'A | H4'A | O4' | 118.2° | 120.1° |
| C3'A | C4'A | O4' | HO4' | 56.3° | 60.3° |
| C4'A | C3'A | C2'A | O3' | 122.8° | 119.9° |
| C4'A | C3'A | C2'A | H3'A | 118.4° | 119.8° |
| C4'A | C3'A | O3' | H3'A | 117.8° | 120.2° |
| C4'A | C3'A | O3' | HO3' | 180.0° | 180.0° |
| C4'A | C3'A | C2'A | O2' | 178.6° | 62.9° |
| C4'A | C3'A | C2'A | H2'A | 57.8° | 177.0° |
| C4'A | C3'A | C2'A | C1'A | 60.9° | 57.0° |
| H4'A | C4'A | O4' | HO4' | 61.4° | 59.9° |
| H4'A | C4'A | C3'A | C2'A | 90.2° | 176.9° |
| H4'A | C4'A | C3'A | O3' | 32.8° | 57.0° |
| H4'A | C4'A | C3'A | H3'A | 151.5° | 63.2° |
| O4' | C4'A | C3'A | C2'A | 151.2° | 63.0° |
| O4' | C4'A | C3'A | O3' | 85.8° | 177.2° |
| O4' | C4'A | C3'A | H3'A | 32.8° | 56.9° |
| C2'A | C3'A | O3' | H3'A | 117.7° | 120.2° |
| C2'A | C3'A | O3' | HO3' | 55.5° | 60.4° |
| C3'A | C2'A | O2' | H2'A | 119.7° | 120.2° |
| C3'A | C2'A | O2' | C1'A | 120.9° | 119.7° |
| C3'A | C2'A | H2'A | C1'A | 119.7° | 119.7° |
| C3'A | C2'A | O2' | HO2' | 180.0° | 180.0° |
| C3'A | C2'A | C1'A | O5' | 32.9° | 57.6° |
| C3'A | C2'A | C1'A | O1' | 153.5° | 62.4° |
| C3'A | C2'A | C1'A | H1' | 87.2° | 177.6° |
| O3' | C3'A | C2'A | O2' | 55.7° | 177.2° |
| O3' | C3'A | C2'A | H2'A | 65.0° | 57.1° |
| O3' | C3'A | C2'A | C1'A | 176.2° | 62.9° |
| H3'A | C3'A | O3' | HO3' | 62.2° | 59.8° |
| H3'A | C3'A | C2'A | O2' | 63.0° | 56.9° |
| H3'A | C3'A | C2'A | H2'A | 176.3° | 63.2° |
| H3'A | C3'A | C2'A | C1'A | 57.5° | 176.8° |
| O2' | C2'A | H2'A | C1'A | 119.9° | 120.1° |
| O2' | C2'A | C1'A | O5' | 153.7° | 62.3° |
| O2' | C2'A | C1'A | O1' | 85.8° | 177.7° |
| O2' | C2'A | C1'A | H1' | 33.6° | 57.7° |
| H2'A | C2'A | O2' | HO2' | 60.4° | 59.8° |
| H2'A | C2'A | C1'A | O5' | 85.9° | 177.6° |
| H2'A | C2'A | C1'A | O1' | 34.7° | 57.6° |
| H2'A | C2'A | C1'A | H1' | 154.0° | 62.5° |
| HO2' | O2' | C2'A | C1'A | 59.0° | 60.3° |
| O5' | C1'A | C2'A | O1' | 120.6° | 120.0° |
| O5' | C1'A | C2'A | H1' | 120.1° | 120.0° |
| O5' | C1'A | O1' | H1' | 119.9° | 120.0° |
| O5' | C1'A | O1' | C1' | 103.9° | 78.4° |
| C2'A | C1'A | O1' | H1' | 118.8° | 120.1° |
| C2'A | C1'A | O1' | C1' | 134.8° | 161.7° |
| C1'A | O1' | C1' | C17' | 76.5° | 59.2° |
| C1'A | O1' | C1' | C16' | 41.8° | 60.8° |
| C1'A | O1' | C1' | C2' | 164.4° | 179.1° |
| H1' | C1'A | O1' | C1' | 16.0° | 41.6° |
| O1' | C1' | C17' | C16' | 119.6° | 120.0° |
| O1' | C1' | C17' | C2' | 117.4° | 120.0° |
| O1' | C1' | C17' | H17' | 180.0° | 60.0° |
| O1' | C1' | C17' | H17A | 60.0° | 180.0° |
| O1' | C1' | C17' | H17B | 60.0° | 60.0° |
| O1' | C1' | C16' | C2' | 120.0° | 120.0° |
| O1' | C1' | C16' | H16' | 180.0° | 57.6° |
| O1' | C1' | C16' | H16A | 60.0° | 177.6° |
| O1' | C1' | C16' | H16B | 60.0° | 62.4° |
| O1' | C1' | C2' | O36 | 107.9° | 180.0° |
| O1' | C1' | C2' | H2' | 8.9° | 60.0° |
| O1' | C1' | C2' | C3' | 125.2° | 60.0° |
| C1' | C17' | H17' | H17A | 120.0° | 120.0° |
| C1' | C17' | H17' | H17B | 120.0° | 120.0° |
| C1' | C17' | H17A | H17B | 120.0° | 120.1° |
| C17' | C1' | C16' | C2' | 121.9° | 120.0° |
| C17' | C1' | C16' | H16' | 61.8° | 177.5° |
| C17' | C1' | C16' | H16A | 58.2° | 62.5° |
| C17' | C1' | C16' | H16B | 178.2° | 57.6° |
| C17' | C1' | C2' | O36 | 9.9° | 60.0° |
| C17' | C1' | C2' | H2' | 126.7° | 59.9° |
| C17' | C1' | C2' | C3' | 117.0° | 180.0° |
| H17' | C17' | H17A | H17B | 120.0° | 120.0° |
| H17' | C17' | C1' | C16' | 60.4° | 60.0° |
| H17' | C17' | C1' | C2' | 62.5° | 180.0° |
| H17A | C17' | C1' | C16' | 179.6° | 60.0° |
| H17A | C17' | C1' | C2' | 57.4° | 60.0° |
| H17B | C17' | C1' | C16' | 59.6° | 180.0° |
| H17B | C17' | C1' | C2' | 177.4° | 60.0° |
| C1' | C16' | H16' | H16A | 120.0° | 120.0° |
| C1' | C16' | H16' | H16B | 120.0° | 120.0° |
| C1' | C16' | H16A | H16B | 120.0° | 120.0° |
| C16' | C1' | C2' | O36 | 130.6° | 60.0° |
| C16' | C1' | C2' | H2' | 112.6° | 180.0° |
| C16' | C1' | C2' | C3' | 3.7° | 60.0° |
| H16' | C16' | H16A | H16B | 120.0° | 120.0° |
| H16' | C16' | C1' | C2' | 60.0° | 62.4° |
| H16A | C16' | C1' | C2' | 180.0° | 57.5° |
| H16B | C16' | C1' | C2' | 59.9° | 177.6° |
| C1' | C2' | O36 | H2' | 115.5° | 120.0° |
| C1' | C2' | O36 | C3' | 129.6° | 120.1° |
| C1' | C2' | H2' | C3' | 122.5° | 120.1° |
| C1' | C2' | O36 | HO36 | 180.0° | 60.0° |
| C1' | C2' | C3' | H3' | 39.7° | 60.0° |
| C1' | C2' | C3' | C4' | 140.3° | 120.0° |
| O36 | C2' | H2' | C3' | 117.8° | 120.0° |
| O36 | C2' | C3' | H3' | 88.2° | 60.1° |
| O36 | C2' | C3' | C4' | 91.8° | 120.0° |
| H2' | C2' | O36 | HO36 | 64.5° | 180.0° |
| H2' | C2' | C3' | H3' | 155.7° | 180.0° |
| H2' | C2' | C3' | C4' | 24.3° | 0.1° |
| HO36 | O36 | C2' | C3' | 50.5° | 60.0° |
| C2' | C3' | H3' | C4' | 180.0° | 179.9° |
| C2' | C3' | C4' | H4' | 0.7° | 0.1° |
| C2' | C3' | C4' | C5' | 179.4° | 180.0° |
| H3' | C3' | C4' | H4' | 179.3° | 180.0° |
| H3' | C3' | C4' | C5' | 0.6° | 0.1° |
| C3' | C4' | H4' | C5' | 180.0° | 179.9° |
| C3' | C4' | C5' | C18' | 0.1° | 0.1° |
| C3' | C4' | C5' | C6' | 179.4° | 180.0° |
| H4' | C4' | C5' | C18' | 179.9° | 180.0° |
| H4' | C4' | C5' | C6' | 0.6° | 0.0° |
| C4' | C5' | C18' | C6' | 179.3° | 179.9° |
| C4' | C5' | C18' | H18' | 180.0° | 90.0° |
| C4' | C5' | C18' | H18A | 60.0° | 150.0° |
| C4' | C5' | C18' | H18B | 60.0° | 30.1° |
| C4' | C5' | C6' | H6' | 1.0° | 0.0° |
| C4' | C5' | C6' | C7' | 179.0° | 180.0° |
| C5' | C18' | H18' | H18A | 120.0° | 120.0° |
| C5' | C18' | H18' | H18B | 120.0° | 120.0° |
| C5' | C18' | H18A | H18B | 120.0° | 120.0° |
| C18' | C5' | C6' | H6' | 179.6° | 180.0° |
| C18' | C5' | C6' | C7' | 0.3° | 0.0° |
| H18' | C18' | H18A | H18B | 120.0° | 120.1° |
| H18' | C18' | C5' | C6' | 0.7° | 89.9° |
| H18A | C18' | C5' | C6' | 120.7° | 30.0° |
| H18B | C18' | C5' | C6' | 119.4° | 150.0° |
| C5' | C6' | H6' | C7' | 180.0° | 180.0° |
| C5' | C6' | C7' | H7' | 0.4° | 0.0° |
| C5' | C6' | C7' | C8' | 179.6° | 180.0° |
| H6' | C6' | C7' | H7' | 179.5° | 180.0° |
| H6' | C6' | C7' | C8' | 0.5° | 0.0° |
| C6' | C7' | H7' | C8' | 180.0° | 180.0° |
| C6' | C7' | C8' | H8' | 2.0° | 0.0° |
| C6' | C7' | C8' | C9' | 178.0° | 180.0° |
| H7' | C7' | C8' | H8' | 178.0° | 180.0° |
| H7' | C7' | C8' | C9' | 2.0° | 0.0° |
| C7' | C8' | H8' | C9' | 180.0° | 180.0° |
| C7' | C8' | C9' | C19' | 0.2° | 0.0° |
| C7' | C8' | C9' | C10' | 179.2° | 179.9° |
| H8' | C8' | C9' | C19' | 179.8° | 180.0° |
| H8' | C8' | C9' | C10' | 0.9° | 0.0° |
| C8' | C9' | C19' | C10' | 178.9° | 179.9° |
| C8' | C9' | C19' | H19' | 180.0° | 90.0° |
| C8' | C9' | C19' | H19A | 60.0° | 150.0° |
| C8' | C9' | C10' | H10' | 1.9° | 0.0° |
| C8' | C9' | C10' | C11' | 178.1° | 180.0° |
| C8' | C9' | C19' | H92 | 60.0° | 30.0° |
| C9' | C19' | H19' | H19A | 120.0° | 120.0° |
| C9' | C19' | H19' | H92 | 120.0° | 120.0° |
| C9' | C19' | H19A | H92 | 120.0° | 120.0° |
| C19' | C9' | C10' | H10' | 179.1° | 180.0° |
| C19' | C9' | C10' | C11' | 0.9° | 0.1° |
| H19' | C19' | H19A | H92 | 120.0° | 120.0° |
| H19' | C19' | C9' | C10' | 1.1° | 90.1° |
| H19A | C19' | C9' | C10' | 121.1° | 30.0° |
| C9' | C10' | H10' | C11' | 180.0° | 179.9° |
| C9' | C10' | C11' | H11' | 0.6° | 0.1° |
| C9' | C10' | C11' | C12' | 179.4° | 180.0° |
| C10' | C9' | C19' | H92 | 118.9° | 150.0° |
| H10' | C10' | C11' | H11' | 179.4° | 180.0° |
| H10' | C10' | C11' | C12' | 0.6° | 0.1° |
| C10' | C11' | H11' | C12' | 180.0° | 179.9° |
| C10' | C11' | C12' | H12' | 1.7° | 0.1° |
| C10' | C11' | C12' | C13' | 178.3° | 180.0° |
| H11' | C11' | C12' | H12' | 178.3° | 180.0° |
| H11' | C11' | C12' | C13' | 1.7° | 0.0° |
| C11' | C12' | H12' | C13' | 180.0° | 180.0° |
| C11' | C12' | C13' | C20' | 0.6° | 0.0° |
| C11' | C12' | C13' | C14' | 179.2° | 180.0° |
| H12' | C12' | C13' | C20' | 179.4° | 180.0° |
| H12' | C12' | C13' | C14' | 0.8° | 0.0° |
| C12' | C13' | C20' | C14' | 179.8° | 180.0° |
| C12' | C13' | C20' | H20' | 180.0° | 90.0° |
| C12' | C13' | C20' | H20A | 60.0° | 150.0° |
| C12' | C13' | C20' | H20B | 60.0° | 30.0° |
| C12' | C13' | C14' | H14' | 0.0° | 0.0° |
| C12' | C13' | C14' | C15' | 180.0° | 180.0° |
| C13' | C20' | H20' | H20A | 120.0° | 120.0° |
| C13' | C20' | H20' | H20B | 120.0° | 120.0° |
| C13' | C20' | H20A | H20B | 120.0° | 120.0° |
| C20' | C13' | C14' | H14' | 179.8° | 180.0° |
| C20' | C13' | C14' | C15' | 0.2° | 0.0° |
| H20' | C20' | H20A | H20B | 120.0° | 120.0° |
| H20' | C20' | C13' | C14' | 0.2° | 90.0° |
| H20A | C20' | C13' | C14' | 119.8° | 30.0° |
| H20B | C20' | C13' | C14' | 120.2° | 150.0° |
| C13' | C14' | H14' | C15' | 180.0° | 180.0° |
| C13' | C14' | C15' | C15 | 178.3° | 180.0° |
| C13' | C14' | C15' | H15' | 1.8° | 0.0° |
| H14' | C14' | C15' | C15 | 1.7° | 0.0° |
| H14' | C14' | C15' | H15' | 178.2° | 180.0° |
| C14' | C15' | C15 | H15' | 180.0° | 180.0° |
| C14' | C15' | C15 | H15 | 0.9° | 0.1° |
| C14' | C15' | C15 | C14 | 179.1° | 180.0° |
| C15' | C15 | H15 | C14 | 180.0° | 179.9° |
| C15' | C15 | C14 | C13 | 178.4° | 180.0° |
| C15' | C15 | C14 | H14 | 1.6° | 0.1° |
| H15' | C15' | C15 | H15 | 179.1° | 179.9° |
| H15' | C15' | C15 | C14 | 0.9° | 0.1° |
| H15 | C15 | C14 | C13 | 1.6° | 0.1° |
| H15 | C15 | C14 | H14 | 178.4° | 179.9° |
| C15 | C14 | C13 | H14 | 180.0° | 179.9° |
| C15 | C14 | C13 | C20 | 0.1° | 0.1° |
| C15 | C14 | C13 | C12 | 179.5° | 179.9° |
| C14 | C13 | C20 | C12 | 179.4° | 180.0° |
| C14 | C13 | C20 | H20 | 180.0° | 89.9° |
| C14 | C13 | C20 | H20C | 60.0° | 150.0° |
| C14 | C13 | C20 | H20D | 60.0° | 30.0° |
| C14 | C13 | C12 | H12 | 0.6° | 0.0° |
| C14 | C13 | C12 | C11 | 179.4° | 180.0° |
| H14 | C14 | C13 | C20 | 180.0° | 180.0° |
| H14 | C14 | C13 | C12 | 0.5° | 0.0° |
| C13 | C20 | H20 | H20C | 120.0° | 120.1° |
| C13 | C20 | H20 | H20D | 120.0° | 119.9° |
| C13 | C20 | H20C | H20D | 120.0° | 119.9° |
| C20 | C13 | C12 | H12 | 180.0° | 180.0° |
| C20 | C13 | C12 | C11 | 0.0° | 0.0° |
| H20 | C20 | H20C | H20D | 120.0° | 120.0° |
| H20 | C20 | C13 | C12 | 0.6° | 90.0° |
| H20C | C20 | C13 | C12 | 120.6° | 30.1° |
| H20D | C20 | C13 | C12 | 119.4° | 150.0° |
| C13 | C12 | H12 | C11 | 180.0° | 180.0° |
| C13 | C12 | C11 | H11 | 0.0° | 0.0° |
| C13 | C12 | C11 | C10 | 180.0° | 180.0° |
| H12 | C12 | C11 | H11 | 180.0° | 180.0° |
| H12 | C12 | C11 | C10 | 0.0° | 0.0° |
| C12 | C11 | H11 | C10 | 180.0° | 180.0° |
| C12 | C11 | C10 | H10 | 0.4° | 0.0° |
| C12 | C11 | C10 | C9 | 179.6° | 180.0° |
| H11 | C11 | C10 | H10 | 179.6° | 180.0° |
| H11 | C11 | C10 | C9 | 0.4° | 0.0° |
| C11 | C10 | H10 | C9 | 180.0° | 180.0° |
| C11 | C10 | C9 | C19 | 0.1° | 0.1° |
| C11 | C10 | C9 | C8 | 179.9° | NaN° |
| H10 | C10 | C9 | C19 | 179.9° | 180.0° |
| H10 | C10 | C9 | C8 | 0.1° | 0.0° |
| C10 | C9 | C19 | C8 | 179.8° | 179.9° |
| C10 | C9 | C19 | H19 | 180.0° | 90.0° |
| C10 | C9 | C19 | H19B | 60.0° | 150.0° |
| C10 | C9 | C19 | H19C | 60.0° | 29.9° |
| C10 | C9 | C8 | H8 | 0.4° | 0.0° |
| C10 | C9 | C8 | C7 | 179.6° | 180.0° |
| C9 | C19 | H19 | H19B | 120.0° | 120.0° |
| C9 | C19 | H19 | H19C | 120.0° | 119.9° |
| C9 | C19 | H19B | H19C | 120.0° | 120.0° |
| C19 | C9 | C8 | H8 | 179.8° | 180.0° |
| C19 | C9 | C8 | C7 | 0.2° | 0.0° |
| H19 | C19 | H19B | H19C | 119.9° | 120.0° |
| H19 | C19 | C9 | C8 | 0.2° | 90.1° |
| H19B | C19 | C9 | C8 | 119.8° | 30.0° |
| H19C | C19 | C9 | C8 | 120.2° | 150.0° |
| C9 | C8 | H8 | C7 | 180.0° | 180.0° |
| C9 | C8 | C7 | H7 | 0.1° | 5.7° |
| C9 | C8 | C7 | C6 | 179.9° | 174.4° |
| H8 | C8 | C7 | H7 | 179.9° | 174.4° |
| H8 | C8 | C7 | C6 | 0.1° | 5.6° |
| C8 | C7 | H7 | C6 | 180.0° | 180.0° |
| C8 | C7 | C6 | C1 | 100.6° | 123.1° |
| C8 | C7 | C6 | C5 | 82.7° | 57.2° |
| H7 | C7 | C6 | C1 | 79.3° | 56.9° |
| H7 | C7 | C6 | C5 | 97.3° | 122.8° |
| C7 | C6 | C1 | C5 | 176.6° | 179.7° |
| C7 | C6 | C1 | C16 | 36.9° | 30.6° |
| C7 | C6 | C1 | C17 | 82.9° | 89.4° |
| C7 | C6 | C5 | C18 | 1.5° | 0.0° |
| C7 | C6 | C5 | C4 | 174.6° | 179.9° |
| C7 | C6 | C1 | C2 | 155.6° | 150.6° |
| C6 | C1 | C16 | C17 | 120.2° | 120.1° |
| C6 | C1 | C16 | C2 | 121.3° | 119.9° |
| C6 | C1 | C17 | C2 | 122.3° | 119.9° |
| C6 | C1 | C17 | H17 | 180.0° | 60.0° |
| C6 | C1 | C17 | H17C | 60.0° | 180.0° |
| C6 | C1 | C17 | H17D | 60.0° | 59.9° |
| C6 | C1 | C16 | H16 | 180.0° | 65.2° |
| C6 | C1 | C16 | H16C | 60.0° | 174.8° |
| C6 | C1 | C16 | H16D | 60.0° | 54.8° |
| C1 | C6 | C5 | C18 | 178.1° | 179.6° |
| C1 | C6 | C5 | C4 | 1.9° | 0.4° |
| C6 | C1 | C2 | C3 | 46.9° | 57.6° |
| C6 | C1 | C2 | H2 | 167.1° | 62.1° |
| C6 | C1 | C2 | H2A | 73.4° | 177.5° |
| C16 | C1 | C17 | C2 | 116.6° | 120.0° |
| C16 | C1 | C17 | H17 | 58.9° | 180.0° |
| C16 | C1 | C17 | H17C | 61.1° | 60.0° |
| C16 | C1 | C17 | H17D | 179.0° | 60.1° |
| C1 | C16 | H16 | H16C | 120.0° | 120.0° |
| C1 | C16 | H16 | H16D | 120.0° | 120.0° |
| C1 | C16 | H16C | H16D | 120.0° | 120.0° |
| C16 | C1 | C6 | C5 | 139.8° | 149.7° |
| C16 | C1 | C2 | C3 | 167.9° | 177.5° |
| C16 | C1 | C2 | H2 | 71.9° | 57.8° |
| C16 | C1 | C2 | H2A | 47.6° | 62.5° |
| C1 | C17 | H17 | H17C | 120.0° | 120.0° |
| C1 | C17 | H17 | H17D | 120.0° | 120.0° |
| C1 | C17 | H17C | H17D | 120.0° | 120.0° |
| C17 | C1 | C16 | H16 | 59.8° | 54.9° |
| C17 | C1 | C16 | H16C | 179.8° | 65.1° |
| C17 | C1 | C16 | H16D | 60.2° | 174.9° |
| C17 | C1 | C6 | C5 | 100.5° | 90.3° |
| C17 | C1 | C2 | C3 | 74.4° | 62.4° |
| C17 | C1 | C2 | H2 | 45.8° | 177.8° |
| C17 | C1 | C2 | H2A | 165.3° | 57.5° |
| H17 | C17 | H17C | H17D | 120.0° | 120.0° |
| H17 | C17 | C1 | C2 | 57.7° | 59.9° |
| H17C | C17 | C1 | C2 | 177.7° | 60.1° |
| H17D | C17 | C1 | C2 | 62.4° | 179.9° |
| H16 | C16 | H16C | H16D | 120.0° | 120.0° |
| H16 | C16 | C1 | C2 | 58.7° | 174.9° |
| H16C | C16 | C1 | C2 | 61.3° | 54.9° |
| H16D | C16 | C1 | C2 | 178.7° | 65.1° |
| C6 | C5 | C18 | C4 | 176.2° | 180.0° |
| C6 | C5 | C18 | H18 | 180.0° | 90.0° |
| C6 | C5 | C18 | H18C | 60.0° | 150.0° |
| C6 | C5 | C18 | H18D | 60.0° | 30.0° |
| C6 | C5 | C4 | O21 | 171.4° | 179.9° |
| C6 | C5 | C4 | C3 | 9.9° | 0.1° |
| C5 | C6 | C1 | C2 | 21.1° | 29.8° |
| C5 | C18 | H18 | H18C | 120.0° | 120.0° |
| C5 | C18 | H18 | H18D | 120.0° | 119.9° |
| C5 | C18 | H18C | H18D | 120.0° | 120.0° |
| C18 | C5 | C4 | O21 | 4.8° | 0.1° |
| C18 | C5 | C4 | C3 | 173.9° | 180.0° |
| H18 | C18 | H18C | H18D | 120.0° | 120.0° |
| H18 | C18 | C5 | C4 | 3.8° | 90.0° |
| H18C | C18 | C5 | C4 | 123.8° | 30.0° |
| H18D | C18 | C5 | C4 | 116.2° | 150.1° |
| C5 | C4 | O21 | C3 | 178.7° | 180.0° |
| C5 | C4 | C3 | C2 | 36.6° | 29.1° |
| C5 | C4 | C3 | H3 | 83.6° | 90.6° |
| C5 | C4 | C3 | H3A | 156.8° | 149.3° |
| O21 | C4 | C3 | C2 | 144.6° | 150.9° |
| O21 | C4 | C3 | H3 | 95.1° | 89.4° |
| O21 | C4 | C3 | H3A | 24.4° | 30.7° |
| C4 | C3 | C2 | H3 | 120.2° | 119.8° |
| C4 | C3 | C2 | H3A | 120.2° | 120.1° |
| C4 | C3 | H3 | H3A | 119.3° | 120.1° |
| C4 | C3 | C2 | C1 | 54.4° | 57.3° |
| C4 | C3 | C2 | H2 | 174.6° | 62.4° |
| C4 | C3 | C2 | H2A | 65.9° | 177.3° |
| C2 | C3 | H3 | H3A | 119.4° | 120.1° |
| C3 | C2 | C1 | H2 | 120.3° | 119.7° |
| C3 | C2 | C1 | H2A | 120.3° | 119.9° |
| C3 | C2 | H2 | H2A | 119.1° | 120.2° |
| H3 | C3 | C2 | C1 | 65.8° | 62.6° |
| H3 | C3 | C2 | H2 | 54.4° | 177.8° |
| H3 | C3 | C2 | H2A | 173.9° | 57.5° |
| H3A | C3 | C2 | C1 | 174.6° | 177.3° |
| H3A | C3 | C2 | H2 | 65.2° | 57.7° |
| H3A | C3 | C2 | H2A | 54.3° | 62.6° |
| C1 | C2 | H2 | H2A | 119.2° | 120.4° |
