YGF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N15 | C13 | sing | 1.37Å | 1.40Å | |
| C13 | N14 | doub | 1.30Å | 1.39Å | |
| C13 | N12 | sing | 1.37Å | 1.44Å | |
| N14 | C07 | sing | 1.47Å | 1.47Å | |
| C06 | C07 | sing | 1.53Å | 1.59Å | |
| C06 | C16 | sing | 1.53Å | 1.57Å | |
| C06 | N05 | sing | 1.47Å | 1.48Å | |
| N12 | C08 | sing | 1.46Å | 1.47Å | |
| C07 | C08 | sing | 1.53Å | 1.58Å | |
| C16 | O17 | sing | 1.43Å | 1.41Å | |
| N05 | C04 | doub | 1.32Å | 1.30Å | |
| C08 | N03 | sing | 1.47Å | 1.45Å | |
| C08 | C09 | sing | 1.53Å | 1.62Å | |
| C04 | N03 | sing | 1.38Å | 1.43Å | |
| C04 | N18 | sing | 1.37Å | 1.43Å | |
| N03 | C02 | sing | 1.46Å | 1.44Å | |
| O10 | C09 | sing | 1.43Å | 1.40Å | |
| C09 | O11 | sing | 1.43Å | 1.40Å | |
| C09 | C01 | sing | 1.56Å | 1.58Å | |
| C02 | C01 | sing | 1.55Å | 1.57Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C02 | H3 | sing | 1.09Å | 1.10Å | |
| C02 | H4 | sing | 1.09Å | 1.10Å | |
| C06 | H5 | sing | 1.09Å | 1.10Å | |
| C07 | H6 | sing | 1.09Å | 1.10Å | |
| C16 | H7 | sing | 1.09Å | 1.10Å | |
| C16 | H8 | sing | 1.09Å | 1.10Å | |
| N12 | H9 | sing | 0.97Å | 1.00Å | |
| N15 | H10 | sing | 0.97Å | 1.00Å | |
| N15 | H11 | sing | 0.97Å | 1.00Å | |
| N18 | H12 | sing | 0.97Å | 1.00Å | |
| N18 | H13 | sing | 0.97Å | 1.00Å | |
| O10 | H14 | sing | 0.97Å | 0.95Å | |
| O11 | H15 | sing | 0.97Å | 0.95Å | |
| O17 | H16 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N15 | C13 | N14 | 125.4° | 122.9° |
| N15 | C13 | N12 | 125.8° | 122.9° |
| C13 | N15 | H10 | 120.0° | 120.0° |
| C13 | N15 | H11 | 120.0° | 120.0° |
| N14 | C13 | N12 | 108.7° | 114.2° |
| C13 | N14 | C07 | 110.3° | 109.8° |
| C13 | N12 | C08 | 112.6° | 107.9° |
| C13 | N12 | H9 | 123.7° | 126.1° |
| N14 | C07 | C06 | 105.9° | 110.4° |
| N14 | C07 | C08 | 107.0° | 103.9° |
| N14 | C07 | H6 | 110.3° | 111.1° |
| C07 | C06 | C16 | 108.1° | 109.0° |
| C07 | C06 | N05 | 117.2° | 112.1° |
| C06 | C07 | C08 | 115.9° | 110.5° |
| C07 | C06 | H5 | 107.6° | 109.0° |
| C06 | C07 | H6 | 108.8° | 110.3° |
| C16 | C06 | N05 | 107.1° | 108.9° |
| C06 | C16 | O17 | 111.1° | 109.5° |
| C16 | C06 | H5 | 107.7° | 108.9° |
| C06 | C16 | H7 | 109.0° | 109.4° |
| C06 | C16 | H8 | 109.1° | 109.5° |
| C06 | N05 | C04 | 123.1° | 118.0° |
| N05 | C06 | H5 | 108.8° | 108.8° |
| N12 | C08 | C07 | 101.3° | 104.0° |
| N12 | C08 | N03 | 105.7° | 110.8° |
| N12 | C08 | C09 | 111.1° | 111.9° |
| C08 | N12 | H9 | 123.7° | 126.0° |
| C07 | C08 | N03 | 115.9° | 109.1° |
| C07 | C08 | C09 | 122.9° | 113.5° |
| C08 | C07 | H6 | 108.9° | 110.4° |
| O17 | C16 | H7 | 109.1° | 109.5° |
| O17 | C16 | H8 | 109.0° | 109.5° |
| C16 | O17 | H16 | 109.5° | 114.0° |
| N05 | C04 | N03 | 124.0° | 112.8° |
| N05 | C04 | N18 | 121.7° | 123.6° |
| N03 | C08 | C09 | 99.1° | 107.4° |
| C08 | N03 | C04 | 123.7° | 121.3° |
| C08 | N03 | C02 | 110.8° | 109.1° |
| C08 | C09 | O10 | 108.3° | 110.9° |
| C08 | C09 | O11 | 108.1° | 110.9° |
| C08 | C09 | C01 | 103.4° | 102.1° |
| N03 | C04 | N18 | 114.4° | 123.6° |
| C04 | N03 | C02 | 125.5° | 129.5° |
| C04 | N18 | H12 | 120.0° | 120.0° |
| C04 | N18 | H13 | 120.0° | 120.0° |
| N03 | C02 | C01 | 103.7° | 105.7° |
| N03 | C02 | H3 | 110.9° | 110.2° |
| N03 | C02 | H4 | 110.9° | 110.3° |
| O10 | C09 | O11 | 110.3° | 110.8° |
| O10 | C09 | C01 | 114.4° | 111.0° |
| C09 | O10 | H14 | 109.5° | 114.0° |
| O11 | C09 | C01 | 111.9° | 110.9° |
| C09 | O11 | H15 | 109.5° | 113.9° |
| C09 | C01 | C02 | 104.6° | 102.1° |
| C09 | C01 | H1 | 110.7° | 110.9° |
| C09 | C01 | H2 | 110.7° | 110.9° |
| C02 | C01 | H1 | 110.7° | 111.0° |
| C02 | C01 | H2 | 110.7° | 110.9° |
| C01 | C02 | H3 | 110.9° | 110.2° |
| C01 | C02 | H4 | 110.9° | 110.2° |
| H1 | C01 | H2 | 109.5° | 110.8° |
| H3 | C02 | H4 | 109.5° | 110.2° |
| H7 | C16 | H8 | 109.5° | 109.4° |
| H10 | N15 | H11 | 120.0° | 120.0° |
| H12 | N18 | H13 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N15 | C13 | N14 | N12 | 178.3° | 179.9° |
| N15 | C13 | N14 | C07 | 178.6° | 179.4° |
| N15 | C13 | N12 | C08 | 179.5° | 178.2° |
| N15 | C13 | N12 | H9 | 0.6° | 1.7° |
| C13 | N15 | H10 | H11 | 180.0° | 179.9° |
| C13 | N14 | C07 | C06 | 120.5° | 121.0° |
| N14 | C13 | N12 | C08 | 1.2° | 1.7° |
| C13 | N14 | C07 | C08 | 3.7° | 2.5° |
| C13 | N14 | C07 | H6 | 121.9° | 116.2° |
| N14 | C13 | N12 | H9 | 178.9° | 178.3° |
| N14 | C13 | N15 | H10 | 0.0° | 0.1° |
| N14 | C13 | N15 | H11 | 180.0° | 180.0° |
| N12 | C13 | N14 | C07 | 3.0° | 0.6° |
| C13 | N12 | C08 | H9 | 180.0° | 180.0° |
| C13 | N12 | C08 | C07 | 1.0° | 3.1° |
| C13 | N12 | C08 | N03 | 122.3° | 114.0° |
| C13 | N12 | C08 | C09 | 131.1° | 126.1° |
| N12 | C13 | N15 | H10 | 178.0° | 180.0° |
| N12 | C13 | N15 | H11 | 2.0° | 0.1° |
| N14 | C07 | C06 | C08 | 118.4° | 114.4° |
| N14 | C07 | C06 | H6 | 118.5° | 123.2° |
| N14 | C07 | C06 | C16 | 124.7° | 171.4° |
| N14 | C07 | C06 | N05 | 114.3° | 67.9° |
| N14 | C07 | C08 | N12 | 2.7° | 3.3° |
| N14 | C07 | C08 | H6 | 119.2° | 119.2° |
| N14 | C07 | C08 | N03 | 116.6° | 115.0° |
| N14 | C07 | C08 | C09 | 121.8° | 125.2° |
| N14 | C07 | C06 | H5 | 8.6° | 52.6° |
| C07 | C06 | C16 | N05 | 127.1° | 122.6° |
| C07 | C06 | C16 | H5 | 116.0° | 118.8° |
| C07 | C06 | N05 | H5 | 122.2° | 120.6° |
| C06 | C07 | C08 | N12 | 115.1° | 121.7° |
| C06 | C07 | C08 | H6 | 123.0° | 122.4° |
| C07 | C06 | C16 | O17 | 59.7° | 175.0° |
| C07 | C06 | N05 | C04 | 4.8° | 50.4° |
| C06 | C07 | C08 | N03 | 1.2° | 3.4° |
| C06 | C07 | C08 | C09 | 120.4° | 116.4° |
| C07 | C06 | C16 | H7 | 60.5° | 65.0° |
| C07 | C06 | C16 | H8 | 180.0° | 55.0° |
| C16 | C06 | N05 | H5 | 116.2° | 118.7° |
| C16 | C06 | C07 | C08 | 116.9° | 74.2° |
| C06 | C16 | O17 | H7 | 120.2° | 120.0° |
| C06 | C16 | O17 | H8 | 120.2° | 120.1° |
| C16 | C06 | N05 | C04 | 116.7° | 70.3° |
| C16 | C06 | C07 | H6 | 6.1° | 48.2° |
| C06 | C16 | H7 | H8 | 119.2° | 120.0° |
| C06 | C16 | O17 | H16 | 180.0° | 180.0° |
| N05 | C06 | C07 | C08 | 4.1° | 46.5° |
| N05 | C06 | C16 | O17 | 67.4° | 62.3° |
| C06 | N05 | C04 | N03 | 2.4° | 4.4° |
| C06 | N05 | C04 | N18 | 178.5° | 175.6° |
| N05 | C06 | C07 | H6 | 127.1° | 168.9° |
| N05 | C06 | C16 | H7 | 172.4° | 57.7° |
| N05 | C06 | C16 | H8 | 52.9° | 177.7° |
| N12 | C08 | C07 | N03 | 113.8° | 118.3° |
| N12 | C08 | C07 | C09 | 124.6° | 121.9° |
| N12 | C08 | N03 | C09 | 115.1° | 122.6° |
| N12 | C08 | N03 | C04 | 109.9° | 68.1° |
| N12 | C08 | N03 | C02 | 70.5° | 114.8° |
| N12 | C08 | C09 | O10 | 43.3° | 24.1° |
| N12 | C08 | C09 | O11 | 162.8° | 147.7° |
| N12 | C08 | C09 | C01 | 78.5° | 94.1° |
| N12 | C08 | C07 | H6 | 121.9° | 115.9° |
| C07 | C08 | N03 | C09 | 133.6° | 123.5° |
| C07 | C08 | N03 | C04 | 1.4° | 45.8° |
| C07 | C08 | N03 | C02 | 178.2° | 131.3° |
| C07 | C08 | C09 | O10 | 76.8° | 93.2° |
| C07 | C08 | C09 | O11 | 42.7° | 30.4° |
| C07 | C08 | C09 | C01 | 161.4° | 148.5° |
| C08 | C07 | C06 | H5 | 127.0° | 167.0° |
| C07 | C08 | N12 | H9 | 178.9° | 176.9° |
| O17 | C16 | C06 | H5 | 175.7° | 56.2° |
| O17 | C16 | H7 | H8 | 119.2° | 120.0° |
| N05 | C04 | N03 | C08 | 1.0° | 47.2° |
| N05 | C04 | N03 | N18 | 179.2° | 180.0° |
| N05 | C04 | N03 | C02 | 178.5° | 129.3° |
| C04 | N05 | C06 | H5 | 127.1° | 171.1° |
| N05 | C04 | N18 | H12 | 0.0° | 180.0° |
| N05 | C04 | N18 | H13 | 180.0° | 0.0° |
| C08 | N03 | C04 | C02 | 179.5° | 176.4° |
| C08 | N03 | C04 | N18 | 178.2° | 132.8° |
| N03 | C08 | C09 | O10 | 154.1° | 146.0° |
| N03 | C08 | C09 | O11 | 86.4° | 90.4° |
| N03 | C08 | C09 | C01 | 32.3° | 27.8° |
| C08 | N03 | C02 | C01 | 38.1° | 15.9° |
| C08 | N03 | C02 | H3 | 157.1° | 135.0° |
| C08 | N03 | C02 | H4 | 81.0° | 103.2° |
| N03 | C08 | C07 | H6 | 124.3° | 125.8° |
| N03 | C08 | N12 | H9 | 57.7° | 65.9° |
| C09 | C08 | N03 | C04 | 135.0° | 169.3° |
| C09 | C08 | N03 | C02 | 44.6° | 7.8° |
| C08 | C09 | O10 | O11 | 118.1° | 123.6° |
| C08 | C09 | O10 | C01 | 114.8° | 112.7° |
| C08 | C09 | O11 | C01 | 113.2° | 112.7° |
| C08 | C09 | C01 | C02 | 11.9° | 36.0° |
| C08 | C09 | C01 | H1 | 107.3° | 154.3° |
| C08 | C09 | C01 | H2 | 131.2° | 82.2° |
| C09 | C08 | C07 | H6 | 2.7° | 6.0° |
| C09 | C08 | N12 | H9 | 48.9° | 54.0° |
| C08 | C09 | O10 | H14 | 180.0° | 180.0° |
| C08 | C09 | O11 | H15 | 180.0° | 180.0° |
| C04 | N03 | C02 | C01 | 141.5° | 167.3° |
| C04 | N03 | C02 | H3 | 22.5° | 48.2° |
| C04 | N03 | C02 | H4 | 99.4° | 73.6° |
| N03 | C04 | N18 | H12 | 179.2° | 0.0° |
| N03 | C04 | N18 | H13 | 0.8° | 180.0° |
| N18 | C04 | N03 | C02 | 2.3° | 50.7° |
| C04 | N18 | H12 | H13 | 179.9° | 180.0° |
| N03 | C02 | C01 | C09 | 13.0° | 32.5° |
| N03 | C02 | C01 | H3 | 119.1° | 119.1° |
| N03 | C02 | C01 | H4 | 119.1° | 119.1° |
| N03 | C02 | C01 | H1 | 132.2° | 150.7° |
| N03 | C02 | C01 | H2 | 106.2° | 85.7° |
| N03 | C02 | H3 | H4 | 122.7° | 121.9° |
| O10 | C09 | O11 | C01 | 128.6° | 123.7° |
| O10 | C09 | C01 | C02 | 129.5° | 154.2° |
| O10 | C09 | C01 | H1 | 10.3° | 87.5° |
| O10 | C09 | C01 | H2 | 111.3° | 36.0° |
| O10 | C09 | O11 | H15 | 61.9° | 56.4° |
| O11 | C09 | C01 | C02 | 104.1° | 82.1° |
| O11 | C09 | C01 | H1 | 136.7° | 36.1° |
| O11 | C09 | C01 | H2 | 15.1° | 159.6° |
| O11 | C09 | O10 | H14 | 61.9° | 56.4° |
| C09 | C01 | C02 | H1 | 119.2° | 118.2° |
| C09 | C01 | C02 | H2 | 119.2° | 118.2° |
| C09 | C01 | H1 | H2 | 122.3° | 123.6° |
| C09 | C01 | C02 | H3 | 132.1° | 151.6° |
| C09 | C01 | C02 | H4 | 106.1° | 86.6° |
| C01 | C09 | O10 | H14 | 65.3° | 67.3° |
| C01 | C09 | O11 | H15 | 66.7° | 67.3° |
| C02 | C01 | H1 | H2 | 122.2° | 123.7° |
| C01 | C02 | H3 | H4 | 122.6° | 121.8° |
| H1 | C01 | C02 | H3 | 108.7° | 90.2° |
| H1 | C01 | C02 | H4 | 13.2° | 31.6° |
| H2 | C01 | C02 | H3 | 12.9° | 33.4° |
| H2 | C01 | C02 | H4 | 134.7° | 155.2° |
| H5 | C06 | C07 | H6 | 110.0° | 70.6° |
| H5 | C06 | C16 | H7 | 55.4° | 176.2° |
| H5 | C06 | C16 | H8 | 64.1° | 63.8° |
| H7 | C16 | O17 | H16 | 59.8° | 60.0° |
| H8 | C16 | O17 | H16 | 59.7° | 60.0° |






