DVY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O32 | C30 | doub | 1.21Å | 1.25Å | |
| O31 | C30 | sing | 1.35Å | 1.24Å | |
| N11 | S10 | sing | 1.66Å | 1.63Å | |
| C30 | C29 | sing | 1.48Å | 1.52Å | |
| C29 | C33 | doub | 1.39Å | 1.40Å | Aromatic |
| C29 | N28 | sing | 1.33Å | 1.36Å | Aromatic |
| C34 | C35 | doub | 1.38Å | 1.39Å | Aromatic |
| C34 | C24 | sing | 1.39Å | 1.41Å | Aromatic |
| C33 | C25 | sing | 1.40Å | 1.37Å | Aromatic |
| O13 | S10 | doub | 1.42Å | 1.42Å | |
| S10 | O12 | doub | 1.42Å | 1.42Å | |
| S10 | C09 | sing | 1.76Å | 1.69Å | |
| C35 | C21 | sing | 1.39Å | 1.41Å | Aromatic |
| C08 | C09 | doub | 1.38Å | 1.40Å | Aromatic |
| C08 | C07 | sing | 1.38Å | 1.39Å | Aromatic |
| C09 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| N28 | C27 | doub | 1.32Å | 1.35Å | Aromatic |
| C25 | C24 | sing | 1.48Å | 1.44Å | |
| C25 | C26 | doub | 1.40Å | 1.40Å | Aromatic |
| C24 | C23 | doub | 1.39Å | 1.37Å | Aromatic |
| C07 | C06 | doub | 1.39Å | 1.41Å | Aromatic |
| C21 | N20 | sing | 1.40Å | 1.36Å | |
| C21 | C22 | doub | 1.39Å | 1.38Å | Aromatic |
| C14 | C15 | doub | 1.38Å | 1.38Å | Aromatic |
| N20 | C18 | sing | 1.35Å | 1.38Å | |
| C27 | C26 | sing | 1.38Å | 1.40Å | Aromatic |
| C06 | C15 | sing | 1.39Å | 1.41Å | Aromatic |
| C06 | N05 | sing | 1.40Å | 1.40Å | |
| N16 | N17 | sing | 1.40Å | 1.39Å | Aromatic |
| N16 | C04 | doub | 1.31Å | 1.36Å | Aromatic |
| C23 | C22 | sing | 1.38Å | 1.36Å | Aromatic |
| C18 | N17 | sing | 1.35Å | 1.39Å | |
| C18 | O19 | doub | 1.21Å | 1.22Å | |
| N05 | C04 | sing | 1.39Å | 1.38Å | |
| N17 | C02 | sing | 1.36Å | 1.41Å | Aromatic |
| C04 | N03 | sing | 1.34Å | 1.40Å | Aromatic |
| C02 | N03 | doub | 1.32Å | 1.34Å | Aromatic |
| C02 | N01 | sing | 1.38Å | 1.35Å | |
| C15 | H1 | sing | 1.08Å | 1.08Å | |
| C22 | H2 | sing | 1.08Å | 1.08Å | |
| C26 | H3 | sing | 1.08Å | 1.08Å | |
| C07 | H4 | sing | 1.08Å | 1.08Å | |
| C08 | H5 | sing | 1.08Å | 1.08Å | |
| C14 | H6 | sing | 1.08Å | 1.08Å | |
| C23 | H7 | sing | 1.08Å | 1.08Å | |
| C27 | H8 | sing | 1.08Å | 1.08Å | |
| C33 | H9 | sing | 1.08Å | 1.08Å | |
| C34 | H10 | sing | 1.08Å | 1.08Å | |
| C35 | H11 | sing | 1.08Å | 1.08Å | |
| N01 | H12 | sing | 0.97Å | 1.00Å | |
| N01 | H13 | sing | 0.97Å | 1.00Å | |
| N05 | H14 | sing | 0.97Å | 1.00Å | |
| N11 | H15 | sing | 0.97Å | 1.00Å | |
| N11 | H16 | sing | 0.97Å | 1.00Å | |
| N20 | H17 | sing | 0.97Å | 1.00Å | |
| O31 | H18 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O32 | C30 | O31 | 129.4° | 120.0° |
| O32 | C30 | C29 | 116.8° | 119.9° |
| O31 | C30 | C29 | 113.8° | 120.0° |
| C30 | O31 | H18 | 109.5° | 117.0° |
| N11 | S10 | O13 | 105.7° | 106.4° |
| N11 | S10 | O12 | 105.6° | 106.4° |
| N11 | S10 | C09 | 109.3° | 107.2° |
| S10 | N11 | H15 | 109.5° | 120.0° |
| S10 | N11 | H16 | 109.5° | 120.0° |
| C30 | C29 | C33 | 120.8° | 119.7° |
| C30 | C29 | N28 | 116.3° | 119.6° |
| C33 | C29 | N28 | 122.9° | 120.6° |
| C29 | C33 | C25 | 119.6° | 118.9° |
| C29 | C33 | H9 | 120.2° | 120.6° |
| C29 | N28 | C27 | 116.9° | 121.9° |
| C35 | C34 | C24 | 121.4° | 119.9° |
| C34 | C35 | C21 | 119.3° | 120.1° |
| C35 | C34 | H10 | 119.3° | 120.1° |
| C34 | C35 | H11 | 120.4° | 119.9° |
| C34 | C24 | C25 | 124.1° | 120.0° |
| C34 | C24 | C23 | 117.2° | 119.9° |
| C24 | C34 | H10 | 119.3° | 120.0° |
| C33 | C25 | C24 | 120.7° | 120.9° |
| C33 | C25 | C26 | 118.5° | 118.2° |
| C25 | C33 | H9 | 120.2° | 120.5° |
| O13 | S10 | O12 | 118.3° | 123.1° |
| O13 | S10 | C09 | 108.8° | 106.4° |
| O12 | S10 | C09 | 108.8° | 106.4° |
| S10 | C09 | C08 | 124.0° | 119.9° |
| S10 | C09 | C14 | 122.8° | 120.0° |
| C35 | C21 | N20 | 122.5° | 120.0° |
| C35 | C21 | C22 | 118.0° | 120.1° |
| C21 | C35 | H11 | 120.4° | 120.0° |
| C09 | C08 | C07 | 123.9° | 120.1° |
| C08 | C09 | C14 | 113.1° | 120.1° |
| C09 | C08 | H5 | 118.0° | 120.0° |
| C08 | C07 | C06 | 121.7° | 120.0° |
| C08 | C07 | H4 | 119.2° | 120.0° |
| C07 | C08 | H5 | 118.0° | 120.0° |
| C09 | C14 | C15 | 124.4° | 120.1° |
| C09 | C14 | H6 | 117.8° | 119.9° |
| N28 | C27 | C26 | 123.2° | 121.1° |
| N28 | C27 | H8 | 118.4° | 119.5° |
| C24 | C25 | C26 | 120.8° | 120.9° |
| C25 | C24 | C23 | 118.6° | 120.1° |
| C25 | C26 | C27 | 118.9° | 119.2° |
| C25 | C26 | H3 | 120.5° | 120.3° |
| C24 | C23 | C22 | 122.0° | 119.9° |
| C24 | C23 | H7 | 119.0° | 120.0° |
| C07 | C06 | C15 | 115.2° | 119.8° |
| C07 | C06 | N05 | 121.2° | 120.1° |
| C06 | C07 | H4 | 119.1° | 120.1° |
| N20 | C21 | C22 | 119.4° | 120.0° |
| C21 | N20 | C18 | 124.4° | 120.0° |
| C21 | N20 | H17 | 117.8° | 120.0° |
| C21 | C22 | C23 | 122.1° | 120.1° |
| C21 | C22 | H2 | 119.0° | 120.0° |
| C14 | C15 | C06 | 121.6° | 119.9° |
| C14 | C15 | H1 | 119.2° | 120.0° |
| C15 | C14 | H6 | 117.8° | 120.0° |
| N20 | C18 | N17 | 119.3° | 120.0° |
| N20 | C18 | O19 | 123.4° | 120.0° |
| C18 | N20 | H17 | 117.8° | 120.0° |
| C27 | C26 | H3 | 120.5° | 120.5° |
| C26 | C27 | H8 | 118.4° | 119.4° |
| C15 | C06 | N05 | 123.6° | 120.1° |
| C06 | C15 | H1 | 119.2° | 120.0° |
| C06 | N05 | C04 | 129.1° | 120.0° |
| C06 | N05 | H14 | 115.4° | 120.0° |
| N17 | N16 | C04 | 104.5° | 107.0° |
| N16 | N17 | C18 | 120.3° | 126.9° |
| N16 | N17 | C02 | 107.9° | 106.2° |
| N16 | C04 | N05 | 128.0° | 125.4° |
| N16 | C04 | N03 | 113.0° | 109.2° |
| C23 | C22 | H2 | 119.0° | 119.9° |
| C22 | C23 | H7 | 119.0° | 120.0° |
| N17 | C18 | O19 | 117.3° | 120.0° |
| C18 | N17 | C02 | 131.6° | 126.9° |
| N05 | C04 | N03 | 119.0° | 125.4° |
| C04 | N05 | H14 | 115.5° | 120.0° |
| N17 | C02 | N03 | 110.2° | 107.8° |
| N17 | C02 | N01 | 124.7° | 126.1° |
| C04 | N03 | C02 | 104.3° | 109.7° |
| N03 | C02 | N01 | 125.1° | 126.1° |
| C02 | N01 | H12 | 109.5° | 120.0° |
| C02 | N01 | H13 | 109.5° | 120.1° |
| H12 | N01 | H13 | 109.4° | 120.0° |
| H15 | N11 | H16 | 109.4° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O32 | C30 | O31 | C29 | 177.8° | 179.9° |
| O32 | C30 | C29 | C33 | 28.9° | 0.1° |
| O32 | C30 | C29 | N28 | 152.4° | 179.7° |
| O32 | C30 | O31 | H18 | 0.0° | 0.0° |
| O31 | C30 | C29 | C33 | 149.2° | 180.0° |
| O31 | C30 | C29 | N28 | 29.5° | 0.2° |
| N11 | S10 | O13 | O12 | 118.0° | 122.9° |
| N11 | S10 | O13 | C09 | 117.3° | 114.1° |
| N11 | S10 | O12 | C09 | 117.2° | 114.1° |
| N11 | S10 | C09 | C08 | 42.7° | 90.1° |
| N11 | S10 | C09 | C14 | 139.4° | 89.8° |
| S10 | N11 | H15 | H16 | 120.0° | 179.9° |
| C30 | C29 | C33 | N28 | 178.6° | 179.8° |
| C30 | C29 | C33 | C25 | 178.6° | 180.0° |
| C30 | C29 | N28 | C27 | 179.1° | 179.9° |
| C30 | C29 | C33 | H9 | 1.4° | 0.2° |
| C29 | C30 | O31 | H18 | 177.8° | 179.9° |
| C29 | C33 | C25 | H9 | 180.0° | 179.8° |
| C33 | C29 | N28 | C27 | 0.5° | 0.3° |
| C29 | C33 | C25 | C24 | 180.0° | 180.0° |
| C29 | C33 | C25 | C26 | 0.9° | 0.1° |
| N28 | C29 | C33 | C25 | 0.0° | 0.2° |
| C29 | N28 | C27 | C26 | 0.1° | 0.1° |
| C29 | N28 | C27 | H8 | 179.9° | 180.0° |
| N28 | C29 | C33 | H9 | 180.0° | 180.0° |
| C35 | C34 | C24 | H10 | 180.0° | 180.0° |
| C34 | C35 | C21 | H11 | 180.0° | 179.9° |
| C35 | C34 | C24 | C25 | 179.5° | 180.0° |
| C35 | C34 | C24 | C23 | 0.6° | 0.3° |
| C34 | C35 | C21 | N20 | 178.2° | 180.0° |
| C34 | C35 | C21 | C22 | 1.6° | 0.2° |
| C34 | C24 | C25 | C33 | 45.3° | 0.2° |
| C24 | C34 | C35 | C21 | 0.5° | 0.0° |
| C34 | C24 | C25 | C23 | 178.9° | 179.8° |
| C34 | C24 | C25 | C26 | 135.6° | 179.7° |
| C34 | C24 | C23 | C22 | 0.6° | 0.2° |
| C34 | C24 | C23 | H7 | 179.3° | 179.8° |
| C24 | C34 | C35 | H11 | 179.5° | 180.0° |
| C33 | C25 | C24 | C26 | 179.1° | 179.9° |
| C33 | C25 | C24 | C23 | 135.8° | 180.0° |
| C33 | C25 | C26 | C27 | 1.2° | 0.3° |
| C33 | C25 | C26 | H3 | 178.8° | 180.0° |
| O13 | S10 | O12 | C09 | 124.7° | 123.0° |
| O13 | S10 | C09 | C08 | 157.7° | 23.5° |
| O13 | S10 | C09 | C14 | 24.5° | 156.6° |
| O13 | S10 | N11 | H15 | 180.0° | 113.5° |
| O13 | S10 | N11 | H16 | 60.0° | 66.4° |
| O12 | S10 | C09 | C08 | 72.1° | 156.4° |
| O12 | S10 | C09 | C14 | 105.7° | 23.7° |
| O12 | S10 | N11 | H15 | 53.8° | 113.6° |
| O12 | S10 | N11 | H16 | 173.8° | 66.5° |
| S10 | C09 | C08 | C14 | 178.0° | 179.8° |
| S10 | C09 | C08 | C07 | 179.4° | 180.0° |
| S10 | C09 | C14 | C15 | 179.9° | 179.7° |
| S10 | C09 | C08 | H5 | 0.6° | 0.2° |
| S10 | C09 | C14 | H6 | 0.1° | 0.2° |
| C09 | S10 | N11 | H15 | 63.1° | 0.1° |
| C09 | S10 | N11 | H16 | 56.9° | 180.0° |
| C35 | C21 | N20 | C22 | 176.6° | 179.8° |
| C35 | C21 | N20 | C18 | 132.9° | 34.9° |
| C35 | C21 | C22 | C23 | 1.6° | 0.3° |
| C35 | C21 | C22 | H2 | 178.4° | 179.8° |
| C21 | C35 | C34 | H10 | 179.5° | 180.0° |
| C35 | C21 | N20 | H17 | 47.1° | 145.1° |
| C09 | C08 | C07 | H5 | 180.0° | 179.8° |
| C09 | C08 | C07 | C06 | 0.8° | 0.0° |
| C08 | C09 | C14 | C15 | 1.9° | 0.5° |
| C09 | C08 | C07 | H4 | 179.2° | 180.0° |
| C08 | C09 | C14 | H6 | 178.2° | 180.0° |
| C07 | C08 | C09 | C14 | 1.4° | 0.2° |
| C08 | C07 | C06 | H4 | 180.0° | 180.0° |
| C08 | C07 | C06 | C15 | 0.6° | 0.1° |
| C08 | C07 | C06 | N05 | 179.5° | 180.0° |
| C09 | C14 | C15 | H6 | 180.0° | 179.6° |
| C09 | C14 | C15 | C06 | 1.8° | 0.5° |
| C09 | C14 | C15 | H1 | 178.2° | 179.8° |
| C14 | C09 | C08 | H5 | 178.6° | 180.0° |
| N28 | C27 | C26 | C25 | 0.8° | 0.3° |
| N28 | C27 | C26 | H8 | 180.0° | 180.0° |
| N28 | C27 | C26 | H3 | 179.2° | 179.9° |
| C24 | C25 | C26 | C27 | 179.7° | 179.8° |
| C25 | C24 | C23 | C22 | 179.6° | 180.0° |
| C24 | C25 | C26 | H3 | 0.3° | 0.1° |
| C25 | C24 | C23 | H7 | 0.4° | 0.0° |
| C24 | C25 | C33 | H9 | 0.0° | 0.2° |
| C25 | C24 | C34 | H10 | 0.5° | 0.0° |
| C26 | C25 | C24 | C23 | 43.3° | 0.0° |
| C25 | C26 | C27 | H3 | 180.0° | 179.7° |
| C25 | C26 | C27 | H8 | 179.2° | 179.7° |
| C26 | C25 | C33 | H9 | 179.1° | 179.7° |
| C24 | C23 | C22 | C21 | 0.5° | 0.0° |
| C24 | C23 | C22 | H7 | 180.0° | 180.0° |
| C24 | C23 | C22 | H2 | 179.5° | 180.0° |
| C23 | C24 | C34 | H10 | 179.4° | 179.8° |
| C07 | C06 | C15 | C14 | 1.0° | 0.3° |
| C07 | C06 | C15 | N05 | 179.9° | 179.9° |
| C07 | C06 | N05 | C04 | 16.2° | 146.0° |
| C07 | C06 | C15 | H1 | 179.0° | 180.0° |
| C06 | C07 | C08 | H5 | 179.2° | 179.8° |
| C07 | C06 | N05 | H14 | 163.8° | 34.0° |
| C21 | N20 | C18 | H17 | 180.0° | 180.0° |
| N20 | C21 | C22 | C23 | 178.3° | 180.0° |
| C21 | N20 | C18 | N17 | 175.4° | 174.3° |
| C21 | N20 | C18 | O19 | 2.1° | 5.7° |
| N20 | C21 | C22 | H2 | 1.7° | 0.0° |
| N20 | C21 | C35 | H11 | 1.8° | 0.0° |
| C22 | C21 | N20 | C18 | 50.6° | 145.4° |
| C21 | C22 | C23 | H2 | 180.0° | 180.0° |
| C21 | C22 | C23 | H7 | 179.5° | 180.0° |
| C22 | C21 | C35 | H11 | 178.4° | 179.7° |
| C22 | C21 | N20 | H17 | 129.4° | 34.6° |
| C14 | C15 | C06 | H1 | 180.0° | 179.8° |
| C14 | C15 | C06 | N05 | 179.1° | 179.8° |
| N20 | C18 | N17 | N16 | 6.4° | 0.1° |
| N20 | C18 | N17 | O19 | 177.7° | 180.0° |
| N20 | C18 | N17 | C02 | 179.3° | 180.0° |
| C15 | C06 | N05 | C04 | 163.9° | 34.1° |
| C15 | C06 | C07 | H4 | 179.4° | 180.0° |
| C06 | C15 | C14 | H6 | 178.2° | 180.0° |
| C15 | C06 | N05 | H14 | 16.1° | 145.9° |
| C06 | N05 | C04 | N16 | 1.6° | 174.2° |
| C06 | N05 | C04 | H14 | 180.0° | 180.0° |
| C06 | N05 | C04 | N03 | 178.8° | 5.3° |
| N05 | C06 | C15 | H1 | 0.9° | 0.0° |
| N05 | C06 | C07 | H4 | 0.5° | 0.1° |
| N16 | N17 | C18 | C02 | 174.3° | 179.9° |
| N16 | N17 | C18 | O19 | 171.3° | 179.9° |
| N17 | N16 | C04 | N05 | 178.6° | 180.0° |
| N17 | N16 | C04 | N03 | 1.0° | 0.4° |
| N16 | N17 | C02 | N03 | 2.2° | 0.0° |
| N16 | N17 | C02 | N01 | 179.3° | 179.8° |
| C04 | N16 | N17 | C18 | 177.4° | 179.7° |
| N16 | C04 | N05 | N03 | 179.6° | 179.5° |
| C04 | N16 | N17 | C02 | 1.9° | 0.2° |
| N16 | C04 | N03 | C02 | 0.3° | 0.4° |
| N16 | C04 | N05 | H14 | 178.4° | 5.8° |
| C18 | N17 | C02 | N03 | 177.0° | 179.9° |
| C18 | N17 | C02 | N01 | 4.5° | 0.3° |
| N17 | C18 | N20 | H17 | 4.6° | 5.6° |
| O19 | C18 | N17 | C02 | 3.0° | 0.0° |
| O19 | C18 | N20 | H17 | 177.9° | 174.4° |
| N05 | C04 | N03 | C02 | 180.0° | 180.0° |
| N17 | C02 | N03 | C04 | 1.5° | 0.2° |
| N17 | C02 | N03 | N01 | 178.5° | 179.7° |
| N17 | C02 | N01 | H12 | 178.2° | 179.7° |
| N17 | C02 | N01 | H13 | 58.3° | 0.3° |
| C04 | N03 | C02 | N01 | 180.0° | 180.0° |
| N03 | C04 | N05 | H14 | 1.2° | 174.7° |
| N03 | C02 | N01 | H12 | 0.0° | 0.0° |
| N03 | C02 | N01 | H13 | 120.0° | 180.0° |
| C02 | N01 | H12 | H13 | 120.0° | 180.0° |
| H1 | C15 | C14 | H6 | 1.8° | 0.2° |
| H2 | C22 | C23 | H7 | 0.4° | 0.0° |
| H3 | C26 | C27 | H8 | 0.8° | 0.1° |
| H4 | C07 | C08 | H5 | 0.8° | 0.2° |
| H10 | C34 | C35 | H11 | 0.5° | 0.1° |






