A1ESP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C38 | C36 | sing | 1.53Å | 1.54Å | |
| C36 | C35 | sing | 1.51Å | 1.54Å | |
| C35 | N18 | sing | 1.35Å | 1.44Å | |
| C35 | O37 | doub | 1.21Å | 1.18Å | |
| N18 | C16 | sing | 1.40Å | 1.46Å | |
| C16 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C15 | C14 | sing | 1.37Å | 1.40Å | Aromatic |
| C17 | C10 | doub | 1.39Å | 1.43Å | Aromatic |
| C14 | C09 | doub | 1.39Å | 1.42Å | Aromatic |
| C10 | C09 | sing | 1.41Å | 1.36Å | Aromatic |
| C10 | N11 | sing | 1.38Å | 1.35Å | Aromatic |
| C09 | C08 | sing | 1.47Å | 1.43Å | Aromatic |
| C13 | N11 | sing | 1.47Å | 1.46Å | |
| N11 | C12 | sing | 1.36Å | 1.32Å | Aromatic |
| C08 | C12 | doub | 1.36Å | 1.40Å | Aromatic |
| C08 | C04 | sing | 1.48Å | 1.51Å | |
| C04 | C05 | doub | 1.40Å | 1.39Å | Aromatic |
| C04 | N03 | sing | 1.33Å | 1.33Å | Aromatic |
| C05 | C06 | sing | 1.38Å | 1.39Å | Aromatic |
| N03 | C02 | doub | 1.32Å | 1.31Å | Aromatic |
| C06 | N01 | doub | 1.32Å | 1.33Å | Aromatic |
| C33 | N32 | sing | 1.47Å | 1.45Å | |
| C02 | N01 | sing | 1.33Å | 1.32Å | Aromatic |
| C02 | N07 | sing | 1.39Å | 1.44Å | |
| C24 | C23 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C19 | sing | 1.39Å | 1.38Å | Aromatic |
| C23 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| N32 | C31 | sing | 1.47Å | 1.45Å | |
| N32 | C34 | sing | 1.47Å | 1.46Å | |
| N07 | C19 | sing | 1.40Å | 1.45Å | |
| C19 | C20 | doub | 1.39Å | 1.38Å | Aromatic |
| C31 | C30 | sing | 1.53Å | 1.53Å | |
| O28 | S26 | doub | 1.42Å | 1.46Å | |
| N27 | C30 | sing | 1.47Å | 1.45Å | |
| N27 | S26 | sing | 1.66Å | 1.72Å | |
| C22 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
| C21 | C25 | sing | 1.51Å | 1.53Å | |
| S26 | C25 | sing | 1.81Å | 1.81Å | |
| S26 | O29 | doub | 1.42Å | 1.48Å | |
| C13 | H1 | sing | 1.09Å | 1.10Å | |
| C13 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.09Å | 1.10Å | |
| C15 | H4 | sing | 1.08Å | 1.08Å | |
| C17 | H5 | sing | 1.08Å | 1.08Å | |
| C20 | H6 | sing | 1.08Å | 1.08Å | |
| C22 | H7 | sing | 1.08Å | 1.08Å | |
| C24 | H8 | sing | 1.08Å | 1.08Å | |
| C05 | H9 | sing | 1.08Å | 1.08Å | |
| C06 | H10 | sing | 1.08Å | 1.08Å | |
| C12 | H11 | sing | 1.08Å | 1.08Å | |
| C14 | H12 | sing | 1.08Å | 1.08Å | |
| C23 | H13 | sing | 1.08Å | 1.08Å | |
| C25 | H14 | sing | 1.09Å | 1.10Å | |
| C25 | H15 | sing | 1.09Å | 1.10Å | |
| C30 | H16 | sing | 1.09Å | 1.10Å | |
| C30 | H17 | sing | 1.09Å | 1.10Å | |
| C31 | H18 | sing | 1.09Å | 1.10Å | |
| C31 | H19 | sing | 1.09Å | 1.10Å | |
| C33 | H20 | sing | 1.09Å | 1.10Å | |
| C33 | H21 | sing | 1.09Å | 1.10Å | |
| C33 | H22 | sing | 1.09Å | 1.10Å | |
| C34 | H23 | sing | 1.09Å | 1.10Å | |
| C34 | H24 | sing | 1.09Å | 1.10Å | |
| C34 | H25 | sing | 1.09Å | 1.10Å | |
| C36 | H26 | sing | 1.09Å | 1.10Å | |
| C36 | H27 | sing | 1.09Å | 1.10Å | |
| C38 | H28 | sing | 1.09Å | 1.10Å | |
| C38 | H29 | sing | 1.09Å | 1.10Å | |
| C38 | H30 | sing | 1.09Å | 1.10Å | |
| N07 | H31 | sing | 0.97Å | 1.00Å | |
| N18 | H32 | sing | 0.97Å | 1.00Å | |
| N27 | H33 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C38 | C36 | C35 | 113.6° | 109.5° |
| C38 | C36 | H26 | 108.4° | 109.5° |
| C38 | C36 | H27 | 108.5° | 109.5° |
| C36 | C38 | H28 | 109.5° | 109.4° |
| C36 | C38 | H29 | 109.5° | 109.5° |
| C36 | C38 | H30 | 109.5° | 109.5° |
| C36 | C35 | N18 | 118.3° | 120.0° |
| C36 | C35 | O37 | 121.2° | 120.0° |
| C35 | C36 | H26 | 108.4° | 109.4° |
| C35 | C36 | H27 | 108.4° | 109.4° |
| N18 | C35 | O37 | 120.5° | 120.0° |
| C35 | N18 | C16 | 127.1° | 120.0° |
| C35 | N18 | H32 | 116.4° | 120.0° |
| N18 | C16 | C15 | 118.1° | 119.7° |
| N18 | C16 | C17 | 121.4° | 119.7° |
| C16 | N18 | H32 | 116.5° | 120.1° |
| C15 | C16 | C17 | 120.4° | 120.5° |
| C16 | C15 | C14 | 120.3° | 120.4° |
| C16 | C15 | H4 | 119.8° | 119.8° |
| C16 | C17 | C10 | 118.9° | 119.7° |
| C16 | C17 | H5 | 120.5° | 120.2° |
| C15 | C14 | C09 | 119.1° | 119.9° |
| C14 | C15 | H4 | 119.8° | 119.8° |
| C15 | C14 | H12 | 120.4° | 120.0° |
| C17 | C10 | C09 | 120.8° | 119.4° |
| C17 | C10 | N11 | 130.5° | 133.3° |
| C10 | C17 | H5 | 120.6° | 120.1° |
| C14 | C09 | C10 | 120.4° | 120.1° |
| C14 | C09 | C08 | 132.8° | 133.9° |
| C09 | C14 | H12 | 120.5° | 120.1° |
| C09 | C10 | N11 | 108.6° | 107.4° |
| C10 | C09 | C08 | 106.8° | 106.0° |
| C10 | N11 | C13 | 124.0° | 124.9° |
| C10 | N11 | C12 | 110.3° | 110.3° |
| C09 | C08 | C12 | 105.6° | 106.7° |
| C09 | C08 | C04 | 128.3° | 126.7° |
| C13 | N11 | C12 | 125.7° | 124.8° |
| N11 | C13 | H1 | 109.5° | 109.5° |
| N11 | C13 | H2 | 109.5° | 109.5° |
| N11 | C13 | H3 | 109.5° | 109.4° |
| N11 | C12 | C08 | 108.6° | 109.7° |
| N11 | C12 | H11 | 125.7° | 125.2° |
| C12 | C08 | C04 | 126.1° | 126.7° |
| C08 | C12 | H11 | 125.7° | 125.1° |
| C08 | C04 | C05 | 121.9° | 120.5° |
| C08 | C04 | N03 | 118.2° | 120.5° |
| C05 | C04 | N03 | 119.8° | 119.0° |
| C04 | C05 | C06 | 119.0° | 118.4° |
| C04 | C05 | H9 | 120.5° | 120.8° |
| C04 | N03 | C02 | 119.3° | 120.6° |
| C05 | C06 | N01 | 117.8° | 119.3° |
| C06 | C05 | H9 | 120.5° | 120.8° |
| C05 | C06 | H10 | 121.1° | 120.3° |
| N03 | C02 | N01 | 123.4° | 121.7° |
| N03 | C02 | N07 | 120.8° | 119.2° |
| C06 | N01 | C02 | 120.8° | 121.0° |
| N01 | C06 | H10 | 121.1° | 120.4° |
| C33 | N32 | C31 | 110.6° | 111.0° |
| C33 | N32 | C34 | 110.1° | 111.0° |
| N32 | C33 | H20 | 109.5° | 109.5° |
| N32 | C33 | H21 | 109.5° | 109.5° |
| N32 | C33 | H22 | 109.4° | 109.5° |
| N01 | C02 | N07 | 115.8° | 119.1° |
| C02 | N07 | C19 | 126.3° | 120.0° |
| C02 | N07 | H31 | 116.8° | 120.0° |
| C23 | C24 | C19 | 120.1° | 119.9° |
| C24 | C23 | C22 | 120.1° | 120.0° |
| C23 | C24 | H8 | 120.0° | 120.0° |
| C24 | C23 | H13 | 119.9° | 120.0° |
| C24 | C19 | N07 | 125.2° | 120.1° |
| C24 | C19 | C20 | 119.6° | 119.9° |
| C19 | C24 | H8 | 119.9° | 120.1° |
| C23 | C22 | C21 | 119.8° | 120.1° |
| C23 | C22 | H7 | 120.1° | 119.9° |
| C22 | C23 | H13 | 120.0° | 120.0° |
| C31 | N32 | C34 | 108.4° | 111.0° |
| N32 | C31 | C30 | 108.8° | 109.5° |
| N32 | C31 | H18 | 109.6° | 109.5° |
| N32 | C31 | H19 | 109.6° | 109.5° |
| N32 | C34 | H23 | 109.5° | 109.5° |
| N32 | C34 | H24 | 109.5° | 109.5° |
| N32 | C34 | H25 | 109.5° | 109.4° |
| N07 | C19 | C20 | 115.3° | 120.0° |
| C19 | N07 | H31 | 116.9° | 120.0° |
| C19 | C20 | C21 | 120.5° | 119.9° |
| C19 | C20 | H6 | 119.7° | 120.1° |
| C31 | C30 | N27 | 107.7° | 109.5° |
| C31 | C30 | H16 | 109.9° | 109.5° |
| C31 | C30 | H17 | 109.9° | 109.5° |
| C30 | C31 | H18 | 109.6° | 109.5° |
| C30 | C31 | H19 | 109.6° | 109.4° |
| O28 | S26 | N27 | 107.0° | 104.3° |
| O28 | S26 | C25 | 108.9° | 110.5° |
| O28 | S26 | O29 | 103.1° | 121.1° |
| C30 | N27 | S26 | 123.9° | 120.0° |
| N27 | C30 | H16 | 109.9° | 109.4° |
| N27 | C30 | H17 | 109.9° | 109.4° |
| C30 | N27 | H33 | 105.7° | 119.9° |
| N27 | S26 | C25 | 111.9° | 104.4° |
| N27 | S26 | O29 | 115.6° | 104.3° |
| S26 | N27 | H33 | 105.8° | 120.0° |
| C22 | C21 | C20 | 119.9° | 120.1° |
| C22 | C21 | C25 | 121.4° | 119.9° |
| C21 | C22 | H7 | 120.1° | 119.9° |
| C20 | C21 | C25 | 118.7° | 120.0° |
| C21 | C20 | H6 | 119.8° | 120.0° |
| C21 | C25 | S26 | 114.5° | 109.5° |
| C21 | C25 | H14 | 108.2° | 109.5° |
| C21 | C25 | H15 | 108.2° | 109.4° |
| C25 | S26 | O29 | 109.8° | 110.5° |
| S26 | C25 | H14 | 108.2° | 109.5° |
| S26 | C25 | H15 | 108.2° | 109.5° |
| H1 | C13 | H2 | 109.4° | 109.5° |
| H1 | C13 | H3 | 109.5° | 109.5° |
| H2 | C13 | H3 | 109.5° | 109.4° |
| H14 | C25 | H15 | 109.5° | 109.5° |
| H16 | C30 | H17 | 109.4° | 109.5° |
| H18 | C31 | H19 | 109.5° | 109.5° |
| H20 | C33 | H21 | 109.5° | 109.4° |
| H20 | C33 | H22 | 109.5° | 109.5° |
| H21 | C33 | H22 | 109.5° | 109.5° |
| H23 | C34 | H24 | 109.4° | 109.5° |
| H23 | C34 | H25 | 109.5° | 109.5° |
| H24 | C34 | H25 | 109.5° | 109.5° |
| H26 | C36 | H27 | 109.5° | 109.5° |
| H28 | C38 | H29 | 109.5° | 109.4° |
| H28 | C38 | H30 | 109.4° | 109.5° |
| H29 | C38 | H30 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C38 | C36 | C35 | H26 | 120.6° | 120.0° |
| C38 | C36 | C35 | H27 | 120.6° | 120.0° |
| C38 | C36 | C35 | N18 | 134.3° | 180.0° |
| C38 | C36 | C35 | O37 | 46.7° | 0.0° |
| C38 | C36 | H26 | H27 | 118.1° | 120.0° |
| C36 | C38 | H28 | H29 | 120.0° | 120.0° |
| C36 | C38 | H28 | H30 | 120.0° | 120.0° |
| C36 | C38 | H29 | H30 | 120.0° | 120.0° |
| C36 | C35 | N18 | O37 | 179.1° | 180.0° |
| C36 | C35 | N18 | C16 | 178.6° | 174.9° |
| C35 | C36 | H26 | H27 | 118.1° | 119.9° |
| C35 | C36 | C38 | H28 | 180.0° | 180.0° |
| C35 | C36 | C38 | H29 | 60.0° | 60.0° |
| C35 | C36 | C38 | H30 | 60.0° | 60.0° |
| C36 | C35 | N18 | H32 | 1.4° | 5.1° |
| C35 | N18 | C16 | H32 | 180.0° | 180.0° |
| C35 | N18 | C16 | C15 | 152.9° | 145.5° |
| C35 | N18 | C16 | C17 | 30.0° | 35.1° |
| N18 | C35 | C36 | H26 | 105.1° | 60.0° |
| N18 | C35 | C36 | H27 | 13.6° | 60.0° |
| O37 | C35 | N18 | C16 | 2.3° | 5.1° |
| O37 | C35 | C36 | H26 | 73.9° | 120.0° |
| O37 | C35 | C36 | H27 | 167.3° | 120.0° |
| O37 | C35 | N18 | H32 | 177.7° | 175.0° |
| N18 | C16 | C15 | C17 | 177.1° | 179.3° |
| N18 | C16 | C15 | C14 | 178.4° | 180.0° |
| N18 | C16 | C17 | C10 | 178.5° | 179.8° |
| N18 | C16 | C15 | H4 | 1.6° | 0.5° |
| N18 | C16 | C17 | H5 | 1.5° | 0.3° |
| C16 | C15 | C14 | H4 | 180.0° | 179.5° |
| C15 | C16 | C17 | C10 | 1.5° | 0.5° |
| C16 | C15 | C14 | C09 | 0.5° | 0.5° |
| C15 | C16 | C17 | H5 | 178.5° | 179.6° |
| C16 | C15 | C14 | H12 | 179.4° | 180.0° |
| C15 | C16 | N18 | H32 | 27.0° | 34.5° |
| C17 | C16 | C15 | C14 | 1.3° | 0.7° |
| C16 | C17 | C10 | H5 | 180.0° | 179.9° |
| C16 | C17 | C10 | C09 | 1.0° | 0.1° |
| C16 | C17 | C10 | N11 | 179.8° | 179.7° |
| C17 | C16 | C15 | H4 | 178.7° | 179.8° |
| C17 | C16 | N18 | H32 | 150.0° | 144.8° |
| C15 | C14 | C09 | H12 | 180.0° | 179.5° |
| C15 | C14 | C09 | C10 | 0.1° | 0.1° |
| C15 | C14 | C09 | C08 | 179.8° | 180.0° |
| C17 | C10 | C09 | C14 | 0.3° | 0.1° |
| C17 | C10 | C09 | N11 | 179.1° | 179.9° |
| C17 | C10 | C09 | C08 | 179.6° | 179.8° |
| C17 | C10 | N11 | C13 | 0.6° | 0.1° |
| C17 | C10 | N11 | C12 | 178.9° | 179.8° |
| C14 | C09 | C10 | C08 | 179.9° | 179.9° |
| C14 | C09 | C10 | N11 | 179.4° | 180.0° |
| C14 | C09 | C08 | C12 | 179.0° | 179.9° |
| C14 | C09 | C08 | C04 | 0.3° | 0.1° |
| C09 | C14 | C15 | H4 | 179.5° | 180.0° |
| C09 | C10 | N11 | C13 | 179.5° | 180.0° |
| C09 | C10 | N11 | C12 | 0.1° | 0.1° |
| C10 | C09 | C08 | C12 | 1.0° | 0.1° |
| C10 | C09 | C08 | C04 | 179.8° | 180.0° |
| C09 | C10 | C17 | H5 | 179.0° | 180.0° |
| C10 | C09 | C14 | H12 | 179.9° | 179.6° |
| N11 | C10 | C09 | C08 | 0.6° | 0.1° |
| C10 | N11 | C13 | C12 | 179.4° | 179.9° |
| C10 | N11 | C12 | C08 | 0.7° | 0.1° |
| C10 | N11 | C13 | H1 | 180.0° | 89.9° |
| C10 | N11 | C13 | H2 | 60.0° | 150.0° |
| C10 | N11 | C13 | H3 | 60.0° | 30.1° |
| N11 | C10 | C17 | H5 | 0.2° | 0.1° |
| C10 | N11 | C12 | H11 | 179.3° | 179.9° |
| C09 | C08 | C12 | N11 | 1.0° | 0.0° |
| C09 | C08 | C12 | C04 | 179.3° | 179.9° |
| C09 | C08 | C04 | C05 | 26.8° | 180.0° |
| C09 | C08 | C04 | N03 | 152.8° | 0.1° |
| C09 | C08 | C12 | H11 | 179.0° | 180.0° |
| C08 | C09 | C14 | H12 | 0.2° | 0.6° |
| C13 | N11 | C12 | C08 | 179.9° | 179.9° |
| N11 | C13 | H1 | H2 | 120.0° | 120.0° |
| N11 | C13 | H1 | H3 | 120.0° | 120.0° |
| N11 | C13 | H2 | H3 | 120.0° | 119.9° |
| C13 | N11 | C12 | H11 | 0.1° | 0.1° |
| N11 | C12 | C08 | H11 | 180.0° | 180.0° |
| N11 | C12 | C08 | C04 | 179.7° | 179.9° |
| C12 | N11 | C13 | H1 | 0.6° | 89.9° |
| C12 | N11 | C13 | H2 | 119.3° | 30.1° |
| C12 | N11 | C13 | H3 | 120.6° | 150.0° |
| C12 | C08 | C04 | C05 | 154.0° | 0.0° |
| C12 | C08 | C04 | N03 | 26.3° | 179.8° |
| C08 | C04 | C05 | N03 | 179.6° | 179.8° |
| C08 | C04 | C05 | C06 | 178.8° | 180.0° |
| C08 | C04 | N03 | C02 | 179.9° | 179.8° |
| C08 | C04 | C05 | H9 | 1.2° | 0.2° |
| C04 | C08 | C12 | H11 | 0.3° | 0.1° |
| C04 | C05 | C06 | H9 | 180.0° | 179.8° |
| C05 | C04 | N03 | C02 | 0.3° | 0.0° |
| C04 | C05 | C06 | N01 | 2.0° | 0.4° |
| C04 | C05 | C06 | H10 | 178.0° | 180.0° |
| N03 | C04 | C05 | C06 | 0.8° | 0.2° |
| C04 | N03 | C02 | N01 | 0.2° | 0.0° |
| C04 | N03 | C02 | N07 | 179.3° | 179.7° |
| N03 | C04 | C05 | H9 | 179.2° | 180.0° |
| C05 | C06 | N01 | H10 | 180.0° | 179.5° |
| C05 | C06 | N01 | C02 | 2.2° | 0.5° |
| N03 | C02 | N01 | C06 | 1.1° | 0.2° |
| N03 | C02 | N01 | N07 | 179.2° | 179.7° |
| N03 | C02 | N07 | C19 | 10.5° | 174.8° |
| N03 | C02 | N07 | H31 | 169.5° | 5.3° |
| C06 | N01 | C02 | N07 | 178.1° | 180.0° |
| N01 | C06 | C05 | H9 | 178.0° | 179.8° |
| C33 | N32 | C31 | C34 | 120.7° | 124.0° |
| C33 | N32 | C31 | C30 | 168.4° | 170.0° |
| C33 | N32 | C31 | H18 | 71.7° | 50.0° |
| C33 | N32 | C31 | H19 | 48.5° | 70.1° |
| N32 | C33 | H20 | H21 | 120.0° | 120.0° |
| N32 | C33 | H20 | H22 | 120.0° | 120.1° |
| N32 | C33 | H21 | H22 | 120.0° | 120.1° |
| C33 | N32 | C34 | H23 | 180.0° | 60.0° |
| C33 | N32 | C34 | H24 | 60.0° | 180.0° |
| C33 | N32 | C34 | H25 | 60.0° | 60.0° |
| N01 | C02 | N07 | C19 | 170.3° | 5.5° |
| C02 | N01 | C06 | H10 | 177.8° | 180.0° |
| N01 | C02 | N07 | H31 | 9.7° | 174.4° |
| C02 | N07 | C19 | C24 | 7.2° | 146.5° |
| C02 | N07 | C19 | H31 | 180.0° | 179.9° |
| C02 | N07 | C19 | C20 | 171.0° | 34.1° |
| C23 | C24 | C19 | H8 | 180.0° | 179.3° |
| C24 | C23 | C22 | H13 | 180.0° | 179.2° |
| C23 | C24 | C19 | N07 | 179.7° | 179.9° |
| C23 | C24 | C19 | C20 | 1.5° | 0.5° |
| C24 | C23 | C22 | C21 | 1.0° | 0.5° |
| C24 | C23 | C22 | H7 | 178.9° | 179.5° |
| C19 | C24 | C23 | C22 | 1.9° | 0.8° |
| C24 | C19 | N07 | C20 | 178.3° | 179.4° |
| C24 | C19 | C20 | C21 | 0.2° | 0.0° |
| C24 | C19 | C20 | H6 | 179.8° | 179.7° |
| C19 | C24 | C23 | H13 | 178.1° | 180.0° |
| C24 | C19 | N07 | H31 | 172.7° | 33.5° |
| C23 | C22 | C21 | H7 | 180.0° | 180.0° |
| C23 | C22 | C21 | C20 | 0.3° | 0.0° |
| C23 | C22 | C21 | C25 | 178.0° | 180.0° |
| C22 | C23 | C24 | H8 | 178.1° | 180.0° |
| N32 | C31 | C30 | H18 | 119.9° | 120.0° |
| N32 | C31 | C30 | H19 | 119.9° | 120.0° |
| N32 | C31 | C30 | N27 | 63.3° | 180.0° |
| N32 | C31 | C30 | H16 | 56.5° | 60.0° |
| N32 | C31 | C30 | H17 | 177.0° | 60.1° |
| N32 | C31 | H18 | H19 | 120.3° | 120.1° |
| C31 | N32 | C33 | H20 | 180.0° | 60.0° |
| C31 | N32 | C33 | H21 | 60.0° | 180.0° |
| C31 | N32 | C33 | H22 | 60.0° | 60.0° |
| C31 | N32 | C34 | H23 | 59.0° | 64.0° |
| C31 | N32 | C34 | H24 | 179.0° | 56.1° |
| C31 | N32 | C34 | H25 | 61.0° | 176.1° |
| C34 | N32 | C31 | C30 | 70.8° | 66.1° |
| C34 | N32 | C31 | H18 | 49.0° | 174.0° |
| C34 | N32 | C31 | H19 | 169.3° | 53.9° |
| C34 | N32 | C33 | H20 | 60.3° | 63.9° |
| C34 | N32 | C33 | H21 | 179.7° | 56.1° |
| C34 | N32 | C33 | H22 | 59.7° | 176.1° |
| N32 | C34 | H23 | H24 | 120.0° | 120.0° |
| N32 | C34 | H23 | H25 | 120.0° | 119.9° |
| N32 | C34 | H24 | H25 | 120.0° | 120.0° |
| N07 | C19 | C20 | C21 | 178.6° | 179.4° |
| N07 | C19 | C20 | H6 | 1.4° | 0.3° |
| N07 | C19 | C24 | H8 | 0.3° | 0.8° |
| C19 | C20 | C21 | C22 | 0.7° | 0.3° |
| C19 | C20 | C21 | H6 | 180.0° | 179.7° |
| C19 | C20 | C21 | C25 | 177.6° | 179.7° |
| C20 | C19 | C24 | H8 | 178.5° | 179.8° |
| C20 | C19 | N07 | H31 | 9.0° | 146.0° |
| C31 | C30 | N27 | H16 | 119.7° | 120.1° |
| C31 | C30 | N27 | H17 | 119.7° | 120.0° |
| C31 | C30 | N27 | S26 | 159.6° | 165.0° |
| C31 | C30 | H16 | H17 | 120.8° | 120.1° |
| C30 | C31 | H18 | H19 | 120.3° | 120.0° |
| C31 | C30 | N27 | H33 | 78.4° | 15.0° |
| O28 | S26 | N27 | C30 | 170.7° | 51.0° |
| O28 | S26 | N27 | C25 | 119.3° | 116.1° |
| O28 | S26 | N27 | O29 | 114.1° | 127.9° |
| O28 | S26 | C25 | C21 | 64.0° | 68.4° |
| O28 | S26 | C25 | O29 | 112.2° | 136.8° |
| O28 | S26 | C25 | H14 | 175.3° | 171.6° |
| O28 | S26 | C25 | H15 | 56.7° | 51.6° |
| O28 | S26 | N27 | H33 | 67.4° | 128.9° |
| C30 | N27 | S26 | H33 | 121.9° | 180.0° |
| C30 | N27 | S26 | C25 | 70.1° | 65.0° |
| C30 | N27 | S26 | O29 | 56.6° | 178.9° |
| N27 | C30 | H16 | H17 | 120.8° | 119.9° |
| N27 | C30 | C31 | H18 | 176.8° | 60.0° |
| N27 | C30 | C31 | H19 | 56.6° | 60.0° |
| N27 | S26 | C25 | C21 | 54.1° | 180.0° |
| N27 | S26 | C25 | O29 | 129.7° | 111.6° |
| N27 | S26 | C25 | H14 | 66.6° | 60.0° |
| N27 | S26 | C25 | H15 | 174.9° | 60.0° |
| S26 | N27 | C30 | H16 | 39.9° | 44.9° |
| S26 | N27 | C30 | H17 | 80.6° | 75.0° |
| C22 | C21 | C20 | C25 | 178.4° | 180.0° |
| C22 | C21 | C25 | S26 | 72.1° | 90.0° |
| C22 | C21 | C20 | H6 | 179.3° | 180.0° |
| C21 | C22 | C23 | H13 | 179.0° | 179.7° |
| C22 | C21 | C25 | H14 | 48.6° | 30.0° |
| C22 | C21 | C25 | H15 | 167.2° | 150.0° |
| C20 | C21 | C25 | S26 | 109.6° | 90.0° |
| C20 | C21 | C22 | H7 | 179.7° | 180.0° |
| C20 | C21 | C25 | H14 | 129.7° | 150.0° |
| C20 | C21 | C25 | H15 | 11.1° | 30.0° |
| C21 | C25 | S26 | H14 | 120.7° | 120.0° |
| C21 | C25 | S26 | H15 | 120.7° | 120.0° |
| C21 | C25 | S26 | O29 | 176.2° | 68.4° |
| C25 | C21 | C20 | H6 | 2.4° | 0.0° |
| C25 | C21 | C22 | H7 | 2.0° | 0.0° |
| C21 | C25 | H14 | H15 | 117.7° | 119.9° |
| S26 | C25 | H14 | H15 | 117.7° | 120.1° |
| C25 | S26 | N27 | H33 | 51.9° | 115.0° |
| O29 | S26 | C25 | H14 | 63.1° | 51.6° |
| O29 | S26 | C25 | H15 | 55.4° | 171.6° |
| O29 | S26 | N27 | H33 | 178.5° | 1.1° |
| H1 | C13 | H2 | H3 | 120.0° | 120.1° |
| H4 | C15 | C14 | H12 | 0.5° | 0.5° |
| H7 | C22 | C23 | H13 | 1.1° | 0.3° |
| H8 | C24 | C23 | H13 | 1.9° | 0.8° |
| H9 | C05 | C06 | H10 | 2.0° | 0.2° |
| H16 | C30 | C31 | H18 | 63.4° | 60.0° |
| H16 | C30 | C31 | H19 | 176.4° | 180.0° |
| H16 | C30 | N27 | H33 | 161.8° | 135.0° |
| H17 | C30 | C31 | H18 | 57.1° | 180.0° |
| H17 | C30 | C31 | H19 | 63.1° | 59.9° |
| H17 | C30 | N27 | H33 | 41.3° | 105.0° |
| H20 | C33 | H21 | H22 | 120.0° | 119.9° |
| H23 | C34 | H24 | H25 | 120.0° | 120.0° |
| H26 | C36 | C38 | H28 | 59.4° | 60.0° |
| H26 | C36 | C38 | H29 | 60.6° | 180.0° |
| H26 | C36 | C38 | H30 | 179.4° | 60.0° |
| H27 | C36 | C38 | H28 | 59.4° | 60.0° |
| H27 | C36 | C38 | H29 | 179.4° | 59.9° |
| H27 | C36 | C38 | H30 | 60.6° | 180.0° |
| H28 | C38 | H29 | H30 | 119.9° | 120.0° |
