PRD_000587
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C14 | sing | 1.35Å | 1.34Å | |
| N1 | C5 | sing | 1.47Å | 1.41Å | |
| N1 | C2 | sing | 1.47Å | 1.42Å | |
| C14 | O32 | doub | 1.21Å | 1.23Å | |
| C14 | C15 | sing | 1.51Å | 1.46Å | |
| C5 | C4 | sing | 1.55Å | 1.54Å | |
| C4 | C3 | sing | 1.55Å | 1.53Å | |
| C3 | C2 | sing | 1.54Å | 1.56Å | |
| C2 | C7 | sing | 1.51Å | 1.48Å | |
| C7 | N23 | sing | 1.35Å | 1.42Å | |
| C7 | O22 | doub | 1.21Å | 1.28Å | |
| N23 | C24 | sing | 1.47Å | 1.40Å | |
| C24 | C25 | sing | 1.51Å | 1.50Å | |
| C25 | C30 | doub | 1.38Å | 1.41Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.41Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.41Å | Aromatic |
| C29 | C28 | doub | 1.39Å | 1.42Å | Aromatic |
| C28 | C31 | sing | 1.48Å | 1.41Å | |
| C28 | C27 | sing | 1.39Å | 1.42Å | Aromatic |
| C31 | N49 | doub | 1.30Å | 1.28Å | |
| C31 | N48 | sing | 1.38Å | 1.29Å | |
| C27 | C26 | doub | 1.38Å | 1.41Å | Aromatic |
| C15 | N5 | sing | 1.47Å | 1.49Å | |
| N5 | C16 | sing | 1.47Å | 1.50Å | |
| C16 | C17 | sing | 1.53Å | 1.56Å | |
| C16 | C21 | sing | 1.53Å | 1.56Å | |
| C17 | C18 | sing | 1.53Å | 1.55Å | |
| C18 | C19 | sing | 1.53Å | 1.55Å | |
| C19 | C20 | sing | 1.53Å | 1.55Å | |
| C20 | C21 | sing | 1.53Å | 1.55Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H5A | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| N23 | HN23 | sing | 0.97Å | 1.00Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| N49 | HN49 | sing | 0.97Å | 1.00Å | |
| N48 | HN48 | sing | 0.97Å | 1.00Å | |
| N48 | HN4A | sing | 0.97Å | 1.00Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| N5 | H20 | sing | 1.01Å | 1.00Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H22 | sing | 1.09Å | 1.10Å | |
| C17 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H241 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H261 | sing | 1.09Å | 1.10Å | |
| C19 | H271 | sing | 1.09Å | 1.10Å | |
| C20 | H28 | sing | 1.09Å | 1.10Å | |
| C20 | H291 | sing | 1.09Å | 1.10Å | |
| C21 | H301 | sing | 1.09Å | 1.10Å | |
| C21 | H31 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C14 | N1 | C5 | 121.2° | 125.6° |
| C14 | N1 | C2 | 126.5° | 125.7° |
| N1 | C14 | O32 | 120.2° | 120.0° |
| N1 | C14 | C15 | 124.5° | 120.0° |
| C5 | N1 | C2 | 111.8° | 108.7° |
| N1 | C5 | C4 | 107.7° | 104.8° |
| N1 | C5 | H5 | 110.1° | 110.4° |
| N1 | C5 | H5A | 110.1° | 110.4° |
| N1 | C2 | C3 | 105.7° | 107.3° |
| N1 | C2 | C7 | 118.1° | 109.9° |
| N1 | C2 | H2 | 107.1° | 109.9° |
| O32 | C14 | C15 | 115.2° | 120.0° |
| C14 | C15 | N5 | 115.0° | 109.5° |
| C14 | C15 | H15 | 107.7° | 109.5° |
| C14 | C15 | H15A | 107.7° | 109.5° |
| C5 | C4 | C3 | 104.8° | 101.6° |
| C4 | C5 | H5 | 110.1° | 110.4° |
| C4 | C5 | H5A | 110.1° | 110.4° |
| C5 | C4 | H4 | 111.0° | 111.0° |
| C5 | C4 | H4A | 111.0° | 111.0° |
| C4 | C3 | C2 | 105.5° | 103.0° |
| C3 | C4 | H4 | 111.1° | 111.0° |
| C3 | C4 | H4A | 111.1° | 111.0° |
| C4 | C3 | H3 | 110.8° | 110.7° |
| C4 | C3 | H3A | 110.8° | 110.7° |
| C3 | C2 | C7 | 111.8° | 110.0° |
| C2 | C3 | H3 | 110.8° | 110.8° |
| C2 | C3 | H3A | 110.8° | 110.5° |
| C3 | C2 | H2 | 114.0° | 109.8° |
| C2 | C7 | N23 | 114.6° | 120.0° |
| C2 | C7 | O22 | 111.6° | 120.0° |
| C7 | C2 | H2 | 100.3° | 110.0° |
| N23 | C7 | O22 | 133.7° | 120.0° |
| C7 | N23 | C24 | 123.5° | 120.0° |
| C7 | N23 | HN23 | 118.3° | 120.0° |
| N23 | C24 | C25 | 114.6° | 109.5° |
| C24 | N23 | HN23 | 118.3° | 120.0° |
| N23 | C24 | H24 | 107.8° | 109.5° |
| N23 | C24 | H24A | 107.8° | 109.5° |
| C24 | C25 | C30 | 121.6° | 119.8° |
| C24 | C25 | C26 | 120.8° | 119.9° |
| C25 | C24 | H24 | 107.8° | 109.5° |
| C25 | C24 | H24A | 107.8° | 109.5° |
| C30 | C25 | C26 | 117.5° | 120.3° |
| C25 | C30 | C29 | 121.1° | 120.2° |
| C25 | C30 | H30 | 119.4° | 120.0° |
| C25 | C26 | C27 | 121.3° | 120.1° |
| C25 | C26 | H26 | 119.4° | 119.9° |
| C30 | C29 | C28 | 121.7° | 119.8° |
| C29 | C30 | H30 | 119.5° | 119.9° |
| C30 | C29 | H29 | 119.2° | 120.1° |
| C29 | C28 | C31 | 122.2° | 120.1° |
| C29 | C28 | C27 | 116.5° | 119.8° |
| C28 | C29 | H29 | 119.1° | 120.1° |
| C31 | C28 | C27 | 121.3° | 120.1° |
| C28 | C31 | N49 | 123.4° | 120.0° |
| C28 | C31 | N48 | 123.8° | 120.0° |
| C28 | C27 | C26 | 121.8° | 119.9° |
| C28 | C27 | H27 | 119.1° | 120.1° |
| N49 | C31 | N48 | 112.9° | 120.0° |
| C31 | N49 | HN49 | 112.0° | 120.0° |
| C31 | N48 | HN48 | 120.0° | 120.0° |
| C31 | N48 | HN4A | 120.0° | 120.0° |
| C26 | C27 | H27 | 119.1° | 120.0° |
| C27 | C26 | H26 | 119.4° | 120.0° |
| C15 | N5 | C16 | 115.2° | 111.0° |
| N5 | C15 | H15 | 107.7° | 109.5° |
| N5 | C15 | H15A | 107.7° | 109.5° |
| C15 | N5 | H20 | 107.6° | 111.0° |
| N5 | C16 | C17 | 112.5° | 109.5° |
| N5 | C16 | C21 | 109.0° | 109.5° |
| C16 | N5 | H20 | 107.6° | 111.0° |
| N5 | C16 | H21 | 108.1° | 109.4° |
| C17 | C16 | C21 | 110.4° | 109.5° |
| C16 | C17 | C18 | 113.4° | 109.5° |
| C17 | C16 | H21 | 106.6° | 109.5° |
| C16 | C17 | H22 | 108.2° | 109.4° |
| C16 | C17 | H23 | 108.2° | 109.5° |
| C16 | C21 | C20 | 112.6° | 109.5° |
| C21 | C16 | H21 | 110.3° | 109.4° |
| C16 | C21 | H301 | 108.4° | 109.5° |
| C16 | C21 | H31 | 108.4° | 109.5° |
| C17 | C18 | C19 | 111.9° | 109.4° |
| C18 | C17 | H22 | 108.2° | 109.5° |
| C18 | C17 | H23 | 108.2° | 109.5° |
| C17 | C18 | H241 | 108.7° | 109.5° |
| C17 | C18 | H25 | 108.7° | 109.5° |
| C18 | C19 | C20 | 111.4° | 109.5° |
| C19 | C18 | H241 | 108.7° | 109.4° |
| C19 | C18 | H25 | 108.7° | 109.5° |
| C18 | C19 | H261 | 108.9° | 109.5° |
| C18 | C19 | H271 | 108.9° | 109.4° |
| C19 | C20 | C21 | 111.9° | 109.4° |
| C20 | C19 | H261 | 108.8° | 109.5° |
| C20 | C19 | H271 | 108.8° | 109.5° |
| C19 | C20 | H28 | 108.7° | 109.5° |
| C19 | C20 | H291 | 108.7° | 109.5° |
| C21 | C20 | H28 | 108.7° | 109.4° |
| C21 | C20 | H291 | 108.7° | 109.5° |
| C20 | C21 | H301 | 108.5° | 109.4° |
| C20 | C21 | H31 | 108.4° | 109.5° |
| H15 | C15 | H15A | 111.2° | 109.5° |
| H5 | C5 | H5A | 108.9° | 110.4° |
| H4 | C4 | H4A | 107.9° | 110.9° |
| H3 | C3 | H3A | 108.1° | 110.8° |
| H24 | C24 | H24A | 111.1° | 109.5° |
| HN48 | N48 | HN4A | 120.0° | 120.1° |
| H22 | C17 | H23 | 110.8° | 109.5° |
| H241 | C18 | H25 | 110.3° | 109.5° |
| H261 | C19 | H271 | 110.1° | 109.5° |
| H28 | C20 | H291 | 110.2° | 109.5° |
| H301 | C21 | H31 | 110.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C14 | N1 | C5 | C2 | 172.4° | 179.8° |
| N1 | C14 | O32 | C15 | 178.2° | 180.0° |
| C14 | N1 | C5 | C4 | 166.9° | 155.9° |
| C14 | N1 | C2 | C3 | 166.1° | 178.8° |
| C14 | N1 | C2 | C7 | 40.1° | 61.7° |
| N1 | C14 | C15 | N5 | 137.3° | 180.0° |
| N1 | C14 | C15 | H15 | 17.3° | 60.0° |
| N1 | C14 | C15 | H15A | 102.7° | 60.0° |
| C14 | N1 | C5 | H5 | 73.1° | 37.0° |
| C14 | N1 | C5 | H5A | 46.9° | 85.3° |
| C14 | N1 | C2 | H2 | 72.0° | 59.5° |
| C5 | N1 | C14 | O32 | 27.7° | 180.0° |
| C5 | N1 | C14 | C15 | 154.3° | 0.0° |
| N1 | C5 | C4 | H5 | 120.0° | 118.8° |
| N1 | C5 | C4 | H5A | 120.0° | 118.8° |
| N1 | C5 | C4 | C3 | 10.1° | 37.0° |
| C5 | N1 | C2 | C3 | 22.0° | 1.4° |
| C5 | N1 | C2 | C7 | 147.9° | 118.1° |
| N1 | C5 | H5 | H5A | 120.7° | 122.3° |
| N1 | C5 | C4 | H4 | 130.1° | 81.1° |
| N1 | C5 | C4 | H4A | 109.9° | 155.1° |
| C5 | N1 | C2 | H2 | 99.9° | 120.7° |
| C2 | N1 | C14 | O32 | 161.0° | 0.2° |
| C2 | N1 | C14 | C15 | 17.0° | 179.7° |
| C2 | N1 | C5 | C4 | 20.7° | 24.4° |
| N1 | C2 | C3 | C4 | 14.2° | 21.9° |
| N1 | C2 | C3 | C7 | 129.7° | 119.5° |
| N1 | C2 | C3 | H2 | 117.4° | 119.4° |
| N1 | C2 | C7 | H2 | 115.9° | 121.2° |
| N1 | C2 | C7 | N23 | 122.1° | 180.0° |
| N1 | C2 | C7 | O22 | 57.2° | 0.0° |
| C2 | N1 | C5 | H5 | 99.4° | 143.2° |
| C2 | N1 | C5 | H5A | 140.7° | 94.5° |
| N1 | C2 | C3 | H3 | 134.2° | 140.3° |
| N1 | C2 | C3 | H3A | 105.8° | 96.4° |
| O32 | C14 | C15 | N5 | 44.6° | 0.0° |
| O32 | C14 | C15 | H15 | 164.6° | 120.0° |
| O32 | C14 | C15 | H15A | 75.4° | 120.0° |
| C14 | C15 | N5 | H15 | 120.0° | 120.0° |
| C14 | C15 | N5 | H15A | 120.0° | 120.0° |
| C14 | C15 | N5 | C16 | 179.7° | 180.0° |
| C14 | C15 | H15 | H15A | 117.7° | 120.0° |
| C14 | C15 | N5 | H20 | 59.7° | 56.0° |
| C5 | C4 | C3 | H4 | 120.0° | 118.1° |
| C5 | C4 | C3 | H4A | 120.0° | 118.0° |
| C5 | C4 | C3 | C2 | 2.6° | 35.3° |
| C4 | C5 | H5 | H5A | 120.7° | 122.3° |
| C5 | C4 | H4 | H4A | 121.9° | 123.9° |
| C5 | C4 | C3 | H3 | 122.6° | 153.8° |
| C5 | C4 | C3 | H3A | 117.4° | 82.9° |
| C4 | C3 | C2 | H3 | 120.0° | 118.5° |
| C4 | C3 | C2 | H3A | 120.0° | 118.3° |
| C4 | C3 | C2 | C7 | 143.9° | 141.4° |
| C3 | C4 | C5 | H5 | 109.8° | 155.9° |
| C3 | C4 | C5 | H5A | 130.2° | 81.8° |
| C3 | C4 | H4 | H4A | 121.9° | 124.0° |
| C4 | C3 | H3 | H3A | 121.6° | 123.2° |
| C4 | C3 | C2 | H2 | 103.1° | 97.5° |
| C3 | C2 | C7 | H2 | 121.2° | 121.0° |
| C3 | C2 | C7 | N23 | 115.0° | 62.1° |
| C3 | C2 | C7 | O22 | 65.7° | 117.9° |
| C2 | C3 | C4 | H4 | 117.4° | 82.8° |
| C2 | C3 | C4 | H4A | 122.6° | 153.4° |
| C2 | C3 | H3 | H3A | 121.6° | 123.1° |
| C2 | C7 | N23 | O22 | 179.1° | 180.0° |
| C2 | C7 | N23 | C24 | 175.3° | 180.0° |
| C7 | C2 | C3 | H3 | 96.1° | 100.2° |
| C7 | C2 | C3 | H3A | 23.9° | 23.0° |
| C2 | C7 | N23 | HN23 | 4.7° | 0.0° |
| C7 | N23 | C24 | HN23 | 180.0° | 180.0° |
| C7 | N23 | C24 | C25 | 158.4° | 180.0° |
| N23 | C7 | C2 | H2 | 6.3° | 58.9° |
| C7 | N23 | C24 | H24 | 81.6° | 60.0° |
| C7 | N23 | C24 | H24A | 38.4° | 60.0° |
| O22 | C7 | N23 | C24 | 5.6° | 0.0° |
| O22 | C7 | C2 | H2 | 173.0° | 121.1° |
| O22 | C7 | N23 | HN23 | 174.4° | 180.0° |
| N23 | C24 | C25 | H24 | 120.0° | 120.0° |
| N23 | C24 | C25 | H24A | 120.0° | 120.0° |
| N23 | C24 | C25 | C30 | 72.1° | 90.0° |
| N23 | C24 | C25 | C26 | 111.4° | 90.3° |
| N23 | C24 | H24 | H24A | 117.9° | 120.0° |
| C24 | C25 | C30 | C26 | 176.6° | 179.8° |
| C24 | C25 | C30 | C29 | 173.1° | 180.0° |
| C24 | C25 | C26 | C27 | 173.4° | 179.8° |
| C25 | C24 | N23 | HN23 | 21.6° | 0.0° |
| C25 | C24 | H24 | H24A | 117.9° | 120.0° |
| C24 | C25 | C30 | H30 | 6.9° | 0.0° |
| C24 | C25 | C26 | H26 | 6.6° | 0.0° |
| C25 | C30 | C29 | H30 | 180.0° | 180.0° |
| C25 | C30 | C29 | C28 | 0.3° | 0.0° |
| C30 | C25 | C26 | C27 | 3.3° | 0.5° |
| C30 | C25 | C24 | H24 | 47.9° | 30.0° |
| C30 | C25 | C24 | H24A | 167.9° | 150.1° |
| C25 | C30 | C29 | H29 | 179.7° | 180.0° |
| C30 | C25 | C26 | H26 | 176.8° | 179.8° |
| C26 | C25 | C30 | C29 | 3.5° | 0.3° |
| C25 | C26 | C27 | C28 | 0.2° | 0.5° |
| C25 | C26 | C27 | H26 | 180.0° | 179.8° |
| C26 | C25 | C24 | H24 | 128.6° | 149.7° |
| C26 | C25 | C24 | H24A | 8.6° | 29.7° |
| C26 | C25 | C30 | H30 | 176.5° | 179.7° |
| C25 | C26 | C27 | H27 | 179.8° | 179.7° |
| C30 | C29 | C28 | H29 | 180.0° | 180.0° |
| C30 | C29 | C28 | C31 | 175.8° | 180.0° |
| C30 | C29 | C28 | C27 | 3.0° | 0.0° |
| C29 | C28 | C31 | C27 | 178.8° | 180.0° |
| C29 | C28 | C31 | N49 | 177.5° | 0.0° |
| C29 | C28 | C31 | N48 | 1.3° | 180.0° |
| C29 | C28 | C27 | C26 | 3.3° | 0.2° |
| C28 | C29 | C30 | H30 | 179.7° | 179.9° |
| C29 | C28 | C27 | H27 | 176.7° | 179.9° |
| C28 | C31 | N49 | N48 | 179.0° | 180.0° |
| C31 | C28 | C27 | C26 | 175.6° | 179.8° |
| C31 | C28 | C29 | H29 | 4.2° | 0.0° |
| C28 | C31 | N49 | HN49 | 179.0° | 180.0° |
| C28 | C31 | N48 | HN48 | 178.9° | 0.0° |
| C28 | C31 | N48 | HN4A | 1.1° | 180.0° |
| C31 | C28 | C27 | H27 | 4.4° | 0.1° |
| C27 | C28 | C31 | N49 | 1.3° | 180.0° |
| C27 | C28 | C31 | N48 | 179.8° | 0.0° |
| C28 | C27 | C26 | H27 | 180.0° | 179.8° |
| C27 | C28 | C29 | H29 | 177.0° | 180.0° |
| C28 | C27 | C26 | H26 | 179.8° | 179.8° |
| N49 | C31 | N48 | HN48 | 0.0° | 180.0° |
| N49 | C31 | N48 | HN4A | 180.0° | 0.0° |
| N48 | C31 | N49 | HN49 | 0.0° | 0.0° |
| C31 | N48 | HN48 | HN4A | 180.0° | 180.0° |
| C15 | N5 | C16 | H20 | 120.0° | 124.0° |
| C15 | N5 | C16 | C17 | 63.8° | 155.0° |
| C15 | N5 | C16 | C21 | 173.4° | 85.0° |
| N5 | C15 | H15 | H15A | 117.7° | 120.0° |
| C15 | N5 | C16 | H21 | 53.6° | 34.9° |
| N5 | C16 | C17 | C21 | 122.0° | 120.0° |
| N5 | C16 | C17 | H21 | 118.3° | 120.0° |
| N5 | C16 | C21 | H21 | 118.5° | 119.9° |
| N5 | C16 | C17 | C18 | 173.9° | 180.0° |
| N5 | C16 | C21 | C20 | 176.3° | 179.9° |
| C16 | N5 | C15 | H15 | 60.3° | 60.0° |
| C16 | N5 | C15 | H15A | 59.7° | 60.0° |
| N5 | C16 | C17 | H22 | 53.9° | 60.0° |
| N5 | C16 | C17 | H23 | 66.1° | 60.0° |
| N5 | C16 | C21 | H301 | 63.7° | 60.0° |
| N5 | C16 | C21 | H31 | 56.3° | 60.0° |
| C17 | C16 | C21 | H21 | 117.5° | 120.0° |
| C16 | C17 | C18 | H22 | 120.0° | 120.0° |
| C16 | C17 | C18 | H23 | 120.0° | 120.0° |
| C16 | C17 | C18 | C19 | 53.3° | 60.0° |
| C17 | C16 | C21 | C20 | 52.3° | 60.0° |
| C17 | C16 | N5 | H20 | 176.2° | 81.1° |
| C16 | C17 | H22 | H23 | 118.4° | 120.0° |
| C16 | C17 | C18 | H241 | 173.3° | 179.9° |
| C16 | C17 | C18 | H25 | 66.6° | 60.0° |
| C17 | C16 | C21 | H301 | 172.3° | 180.0° |
| C17 | C16 | C21 | H31 | 67.7° | 60.0° |
| C21 | C16 | C17 | C18 | 52.0° | 60.0° |
| C16 | C21 | C20 | C19 | 54.6° | 60.0° |
| C16 | C21 | C20 | H301 | 120.0° | 120.0° |
| C16 | C21 | C20 | H31 | 120.0° | 120.0° |
| C21 | C16 | N5 | H20 | 53.4° | 39.0° |
| C21 | C16 | C17 | H22 | 68.0° | 60.0° |
| C21 | C16 | C17 | H23 | 171.9° | 180.0° |
| C16 | C21 | C20 | H28 | 174.6° | 180.0° |
| C16 | C21 | C20 | H291 | 65.4° | 60.0° |
| C16 | C21 | H301 | H31 | 118.7° | 120.0° |
| C17 | C18 | C19 | H241 | 120.0° | 120.0° |
| C17 | C18 | C19 | H25 | 120.0° | 120.0° |
| C17 | C18 | C19 | C20 | 53.8° | 60.0° |
| C18 | C17 | C16 | H21 | 67.8° | 60.0° |
| C18 | C17 | H22 | H23 | 118.4° | 120.0° |
| C17 | C18 | H241 | H25 | 119.0° | 120.0° |
| C17 | C18 | C19 | H261 | 66.2° | 60.0° |
| C17 | C18 | C19 | H271 | 173.8° | 180.0° |
| C18 | C19 | C20 | H261 | 120.0° | 120.0° |
| C18 | C19 | C20 | H271 | 120.0° | 119.9° |
| C18 | C19 | C20 | C21 | 54.6° | 60.1° |
| C19 | C18 | C17 | H22 | 66.6° | 60.0° |
| C19 | C18 | C17 | H23 | 173.3° | 180.0° |
| C19 | C18 | H241 | H25 | 119.0° | 120.0° |
| C18 | C19 | H261 | H271 | 119.2° | 120.0° |
| C18 | C19 | C20 | H28 | 174.6° | 180.0° |
| C18 | C19 | C20 | H291 | 65.5° | 60.0° |
| C19 | C20 | C21 | H28 | 120.0° | 119.9° |
| C19 | C20 | C21 | H291 | 120.0° | 120.0° |
| C20 | C19 | C18 | H241 | 173.8° | 180.0° |
| C20 | C19 | C18 | H25 | 66.2° | 59.9° |
| C20 | C19 | H261 | H271 | 119.2° | 120.0° |
| C19 | C20 | H28 | H291 | 119.0° | 120.0° |
| C19 | C20 | C21 | H301 | 174.6° | 180.0° |
| C19 | C20 | C21 | H31 | 65.4° | 60.0° |
| C20 | C21 | C16 | H21 | 65.2° | 60.0° |
| C21 | C20 | C19 | H261 | 65.4° | 60.0° |
| C21 | C20 | C19 | H271 | 174.6° | 180.0° |
| C21 | C20 | H28 | H291 | 119.0° | 120.0° |
| C20 | C21 | H301 | H31 | 118.7° | 120.0° |
| H15 | C15 | N5 | H20 | 179.7° | 176.1° |
| H15A | C15 | N5 | H20 | 60.3° | 64.0° |
| H5 | C5 | C4 | H4 | 10.1° | 37.8° |
| H5 | C5 | C4 | H4A | 130.1° | 86.1° |
| H5A | C5 | C4 | H4 | 109.9° | 160.1° |
| H5A | C5 | C4 | H4A | 10.1° | 36.3° |
| H4 | C4 | C3 | H3 | 2.6° | 35.8° |
| H4 | C4 | C3 | H3A | 122.6° | 159.1° |
| H4A | C4 | C3 | H3 | 117.4° | 88.1° |
| H4A | C4 | C3 | H3A | 2.6° | 35.2° |
| H3 | C3 | C2 | H2 | 16.9° | 20.9° |
| H3A | C3 | C2 | H2 | 136.8° | 144.2° |
| HN23 | N23 | C24 | H24 | 98.4° | 120.0° |
| HN23 | N23 | C24 | H24A | 141.6° | 120.0° |
| H30 | C30 | C29 | H29 | 0.3° | 0.0° |
| H27 | C27 | C26 | H26 | 0.2° | 0.1° |
| H20 | N5 | C16 | H21 | 66.4° | 158.9° |
| H21 | C16 | C17 | H22 | 172.2° | 180.0° |
| H21 | C16 | C17 | H23 | 52.2° | 60.0° |
| H21 | C16 | C21 | H301 | 54.8° | 60.0° |
| H21 | C16 | C21 | H31 | 174.8° | 180.0° |
| H22 | C17 | C18 | H241 | 53.4° | 60.0° |
| H22 | C17 | C18 | H25 | 173.4° | 179.9° |
| H23 | C17 | C18 | H241 | 66.7° | 60.0° |
| H23 | C17 | C18 | H25 | 53.3° | 60.0° |
| H241 | C18 | C19 | H261 | 53.8° | 60.0° |
| H241 | C18 | C19 | H271 | 66.2° | 60.0° |
| H25 | C18 | C19 | H261 | 173.8° | 180.0° |
| H25 | C18 | C19 | H271 | 53.8° | 60.0° |
| H261 | C19 | C20 | H28 | 54.6° | 59.9° |
| H261 | C19 | C20 | H291 | 174.5° | 180.0° |
| H271 | C19 | C20 | H28 | 65.4° | 60.1° |
| H271 | C19 | C20 | H291 | 54.5° | 60.0° |
| H28 | C20 | C21 | H301 | 65.4° | 60.0° |
| H28 | C20 | C21 | H31 | 54.6° | 60.0° |
| H291 | C20 | C21 | H301 | 54.6° | 60.0° |
| H291 | C20 | C21 | H31 | 174.6° | 180.0° |
