L37
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N2A | C2 | sing | 1.39Å | 1.32Å | |
| N2A | HN21 | sing | 0.97Å | 1.02Å | |
| N2A | HN22 | sing | 0.97Å | 1.02Å | |
| N1 | C2 | doub | 1.32Å | 1.45Å | Aromatic |
| N1 | C6 | sing | 1.33Å | 1.39Å | Aromatic |
| C2 | N3 | sing | 1.32Å | 1.39Å | Aromatic |
| N3 | C4 | doub | 1.33Å | 1.34Å | Aromatic |
| C4 | O4A | sing | 1.36Å | 1.25Å | |
| C4 | C5 | sing | 1.39Å | 1.54Å | Aromatic |
| O4A | HO4 | sing | 0.97Å | 0.95Å | |
| N5A | C5 | sing | 1.41Å | 1.31Å | |
| N5A | HN51 | sing | 0.97Å | 1.02Å | |
| N5A | HN52 | sing | 0.97Å | 1.02Å | |
| C5 | C6 | doub | 1.40Å | 1.48Å | Aromatic |
| C6 | N7 | sing | 1.39Å | 1.42Å | |
| N7 | C8 | sing | 1.35Å | 1.35Å | |
| N7 | HN7 | sing | 0.97Å | 1.02Å | |
| C8 | O8A | doub | 1.21Å | 1.21Å | |
| C8 | N9 | sing | 1.35Å | 1.33Å | |
| N9 | C1B | sing | 1.39Å | 1.40Å | |
| N9 | HN9 | sing | 0.97Å | 1.02Å | |
| C1B | C2B | doub | 1.39Å | 1.40Å | Aromatic |
| C1B | C6B | sing | 1.39Å | 1.39Å | Aromatic |
| C2B | C3B | sing | 1.38Å | 1.41Å | Aromatic |
| C2B | H2B | sing | 1.08Å | 1.10Å | |
| C3B | C4B | doub | 1.40Å | 1.42Å | Aromatic |
| C3B | H3B | sing | 1.08Å | 1.10Å | |
| C4B | C5B | sing | 1.40Å | 1.37Å | Aromatic |
| C4B | C7B | sing | 1.48Å | 1.52Å | |
| C5B | C6B | doub | 1.38Å | 1.35Å | Aromatic |
| C5B | H5B | sing | 1.08Å | 1.10Å | |
| C6B | H6B | sing | 1.08Å | 1.10Å | |
| C7B | O7B | doub | 1.22Å | 1.22Å | |
| C7B | N | sing | 1.35Å | 1.34Å | |
| N | CA | sing | 1.46Å | 1.48Å | |
| N | HN | sing | 0.97Å | 1.02Å | |
| CA | CB | sing | 1.53Å | 1.52Å | |
| CA | C | sing | 1.51Å | 1.52Å | |
| CA | HA | sing | 1.09Å | 1.11Å | |
| CB | CG | sing | 1.53Å | 1.48Å | |
| CB | HB1 | sing | 1.09Å | 1.11Å | |
| CB | HB2 | sing | 1.09Å | 1.11Å | |
| CG | CD | sing | 1.51Å | 1.51Å | |
| CG | HG1 | sing | 1.09Å | 1.11Å | |
| CG | HG2 | sing | 1.09Å | 1.12Å | |
| CD | OE1 | doub | 1.21Å | 1.25Å | |
| CD | OE2 | sing | 1.34Å | 1.25Å | |
| OE2 | HE2 | sing | 0.97Å | 0.95Å | |
| C | O | doub | 1.21Å | 1.24Å | |
| C | OXT | sing | 1.34Å | 1.25Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | N2A | HN21 | 119.5° | 120.0° |
| C2 | N2A | HN22 | 108.6° | 120.0° |
| N2A | C2 | N1 | 119.5° | 119.1° |
| N2A | C2 | N3 | 118.7° | 119.1° |
| HN21 | N2A | HN22 | 108.6° | 120.0° |
| C2 | N1 | C6 | 121.7° | 120.8° |
| N1 | C2 | N3 | 120.9° | 121.8° |
| N1 | C6 | C5 | 116.6° | 119.1° |
| N1 | C6 | N7 | 116.0° | 120.5° |
| C2 | N3 | C4 | 121.1° | 120.9° |
| N3 | C4 | O4A | 120.1° | 120.4° |
| N3 | C4 | C5 | 120.0° | 119.1° |
| O4A | C4 | C5 | 119.8° | 120.5° |
| C4 | O4A | HO4 | 120.1° | 106.8° |
| C4 | C5 | N5A | 116.1° | 120.8° |
| C4 | C5 | C6 | 118.4° | 118.3° |
| C5 | N5A | HN51 | 116.0° | 120.1° |
| C5 | N5A | HN52 | 109.8° | 119.9° |
| N5A | C5 | C6 | 125.4° | 120.9° |
| HN51 | N5A | HN52 | 109.8° | 120.0° |
| C5 | C6 | N7 | 127.4° | 120.4° |
| C6 | N7 | C8 | 122.6° | 120.0° |
| C6 | N7 | HN7 | 107.6° | 120.0° |
| C8 | N7 | HN7 | 107.6° | 120.0° |
| N7 | C8 | O8A | 115.9° | 120.0° |
| N7 | C8 | N9 | 121.1° | 120.0° |
| O8A | C8 | N9 | 122.1° | 120.0° |
| C8 | N9 | C1B | 121.2° | 120.0° |
| C8 | N9 | HN9 | 117.0° | 120.0° |
| C1B | N9 | HN9 | 121.8° | 120.0° |
| N9 | C1B | C2B | 123.8° | 119.9° |
| N9 | C1B | C6B | 116.9° | 119.9° |
| C2B | C1B | C6B | 119.3° | 120.2° |
| C1B | C2B | C3B | 119.6° | 120.1° |
| C1B | C2B | H2B | 119.7° | 120.0° |
| C1B | C6B | C5B | 121.5° | 120.1° |
| C1B | C6B | H6B | 120.6° | 120.0° |
| C3B | C2B | H2B | 120.6° | 119.9° |
| C2B | C3B | C4B | 118.9° | 119.9° |
| C2B | C3B | H3B | 120.2° | 120.0° |
| C4B | C3B | H3B | 120.9° | 120.1° |
| C3B | C4B | C5B | 119.7° | 119.9° |
| C3B | C4B | C7B | 123.8° | 120.1° |
| C5B | C4B | C7B | 116.3° | 120.1° |
| C4B | C5B | C6B | 120.9° | 119.9° |
| C4B | C5B | H5B | 120.3° | 120.0° |
| C4B | C7B | O7B | 120.1° | 120.0° |
| C4B | C7B | N | 118.0° | 120.0° |
| C6B | C5B | H5B | 118.7° | 120.1° |
| C5B | C6B | H6B | 117.9° | 120.0° |
| O7B | C7B | N | 121.2° | 120.0° |
| C7B | N | CA | 122.2° | 120.0° |
| C7B | N | HN | 113.8° | 120.0° |
| CA | N | HN | 123.9° | 120.0° |
| N | CA | CB | 112.7° | 109.5° |
| N | CA | C | 113.7° | 109.5° |
| N | CA | HA | 102.8° | 109.5° |
| CB | CA | C | 104.7° | 109.5° |
| CB | CA | HA | 112.1° | 109.5° |
| CA | CB | CG | 118.3° | 109.5° |
| CA | CB | HB1 | 109.0° | 109.4° |
| CA | CB | HB2 | 109.0° | 109.5° |
| C | CA | HA | 111.2° | 109.4° |
| CA | C | O | 118.5° | 120.0° |
| CA | C | OXT | 117.6° | 120.0° |
| CG | CB | HB1 | 109.0° | 109.5° |
| CG | CB | HB2 | 109.0° | 109.5° |
| CB | CG | CD | 109.4° | 109.5° |
| CB | CG | HG1 | 112.3° | 109.5° |
| CB | CG | HG2 | 112.2° | 109.5° |
| HB1 | CB | HB2 | 101.1° | 109.5° |
| CD | CG | HG1 | 112.2° | 109.4° |
| CD | CG | HG2 | 112.2° | 109.5° |
| CG | CD | OE1 | 118.2° | 120.0° |
| CG | CD | OE2 | 118.5° | 120.0° |
| HG1 | CG | HG2 | 98.1° | 109.5° |
| OE1 | CD | OE2 | 123.2° | 120.0° |
| CD | OE2 | HE2 | 118.5° | 120.0° |
| O | C | OXT | 123.7° | 120.0° |
| C | OXT | HXT | 117.5° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | N2A | HN21 | HN22 | 125.2° | 179.7° |
| N2A | C2 | N1 | N3 | 168.6° | 179.8° |
| N2A | C2 | N1 | C6 | 177.7° | 179.7° |
| N2A | C2 | N3 | C4 | 175.2° | 180.0° |
| HN21 | N2A | C2 | N1 | 180.0° | 0.5° |
| HN21 | N2A | C2 | N3 | 11.1° | 179.7° |
| HN22 | N2A | C2 | N1 | 54.7° | 179.7° |
| HN22 | N2A | C2 | N3 | 114.2° | 0.0° |
| N1 | C2 | N3 | C4 | 6.5° | 0.2° |
| C2 | N1 | C6 | C5 | 11.4° | 0.5° |
| C2 | N1 | C6 | N7 | 168.6° | 179.8° |
| C6 | N1 | C2 | N3 | 13.7° | 0.5° |
| N1 | C6 | C5 | C4 | 3.2° | 0.3° |
| N1 | C6 | C5 | N5A | 179.8° | 179.7° |
| N1 | C6 | C5 | N7 | 180.0° | 179.7° |
| N1 | C6 | N7 | C8 | 171.9° | 0.3° |
| N1 | C6 | N7 | HN7 | 62.8° | 179.7° |
| C2 | N3 | C4 | O4A | 179.0° | 180.0° |
| C2 | N3 | C4 | C5 | 1.7° | 0.0° |
| N3 | C4 | O4A | C5 | 179.3° | 180.0° |
| N3 | C4 | O4A | HO4 | 180.0° | 90.0° |
| N3 | C4 | C5 | N5A | 173.5° | 179.9° |
| N3 | C4 | C5 | C6 | 3.4° | 0.0° |
| O4A | C4 | C5 | N5A | 5.8° | 0.1° |
| O4A | C4 | C5 | C6 | 177.3° | 180.0° |
| C5 | C4 | O4A | HO4 | 0.7° | 90.0° |
| C4 | C5 | N5A | C6 | 176.7° | 179.9° |
| C4 | C5 | N5A | HN51 | 180.0° | 0.1° |
| C4 | C5 | N5A | HN52 | 54.8° | 179.9° |
| C4 | C5 | C6 | N7 | 176.8° | 179.9° |
| C5 | N5A | HN51 | HN52 | 125.2° | 179.9° |
| N5A | C5 | C6 | N7 | 0.2° | 0.0° |
| HN51 | N5A | C5 | C6 | 3.4° | 180.0° |
| HN52 | N5A | C5 | C6 | 128.6° | 0.1° |
| C5 | C6 | N7 | C8 | 8.1° | 180.0° |
| C5 | C6 | N7 | HN7 | 117.2° | 0.1° |
| C6 | N7 | C8 | HN7 | 125.3° | 179.9° |
| C6 | N7 | C8 | O8A | 177.7° | 0.0° |
| C6 | N7 | C8 | N9 | 13.1° | 180.0° |
| N7 | C8 | O8A | N9 | 169.2° | 180.0° |
| N7 | C8 | N9 | C1B | 175.6° | 174.3° |
| N7 | C8 | N9 | HN9 | 4.4° | 5.7° |
| HN7 | N7 | C8 | O8A | 52.3° | 180.0° |
| HN7 | N7 | C8 | N9 | 138.4° | 0.0° |
| O8A | C8 | N9 | C1B | 15.8° | 5.7° |
| O8A | C8 | N9 | HN9 | 164.2° | 174.3° |
| C8 | N9 | C1B | HN9 | 180.0° | 180.0° |
| C8 | N9 | C1B | C2B | 23.8° | 146.5° |
| C8 | N9 | C1B | C6B | 155.7° | 33.7° |
| N9 | C1B | C2B | C6B | 179.5° | 179.8° |
| N9 | C1B | C2B | C3B | 179.1° | 180.0° |
| N9 | C1B | C2B | H2B | 1.0° | 0.0° |
| N9 | C1B | C6B | C5B | 178.8° | 179.7° |
| N9 | C1B | C6B | H6B | 1.1° | 0.2° |
| HN9 | N9 | C1B | C2B | 156.2° | 33.5° |
| HN9 | N9 | C1B | C6B | 24.3° | 146.3° |
| C1B | C2B | C3B | H2B | 180.0° | 180.0° |
| C1B | C2B | C3B | C4B | 0.9° | 0.0° |
| C1B | C2B | C3B | H3B | 179.2° | 180.0° |
| C2B | C1B | C6B | C5B | 1.6° | 0.5° |
| C2B | C1B | C6B | H6B | 178.4° | 179.9° |
| C6B | C1B | C2B | C3B | 1.4° | 0.2° |
| C6B | C1B | C2B | H2B | 178.6° | 179.8° |
| C1B | C6B | C5B | C4B | 1.2° | 0.5° |
| C1B | C6B | C5B | H6B | 180.0° | 179.6° |
| C1B | C6B | C5B | H5B | 178.8° | 179.8° |
| C2B | C3B | C4B | H3B | 180.0° | 180.0° |
| C2B | C3B | C4B | C5B | 0.5° | 0.0° |
| C2B | C3B | C4B | C7B | 175.6° | 180.0° |
| H2B | C2B | C3B | C4B | 179.1° | 180.0° |
| H2B | C2B | C3B | H3B | 0.9° | 0.0° |
| C3B | C4B | C5B | C7B | 175.5° | 180.0° |
| C3B | C4B | C5B | C6B | 0.7° | 0.2° |
| C3B | C4B | C5B | H5B | 179.4° | 179.9° |
| C3B | C4B | C7B | O7B | 2.2° | 0.0° |
| C3B | C4B | C7B | N | 168.4° | 179.9° |
| H3B | C3B | C4B | C5B | 179.5° | 180.0° |
| H3B | C3B | C4B | C7B | 4.4° | 0.0° |
| C4B | C5B | C6B | H5B | 180.0° | 179.7° |
| C4B | C5B | C6B | H6B | 178.8° | 180.0° |
| C5B | C4B | C7B | O7B | 177.5° | 180.0° |
| C5B | C4B | C7B | N | 6.9° | 0.1° |
| C7B | C4B | C5B | C6B | 176.1° | 179.8° |
| C7B | C4B | C5B | H5B | 3.9° | 0.1° |
| C4B | C7B | O7B | N | 170.2° | 179.9° |
| C4B | C7B | N | CA | 166.8° | 180.0° |
| C4B | C7B | N | HN | 13.2° | 0.1° |
| H5B | C5B | C6B | H6B | 1.2° | 0.2° |
| O7B | C7B | N | CA | 3.7° | 0.1° |
| O7B | C7B | N | HN | 176.3° | 180.0° |
| C7B | N | CA | HN | 180.0° | 179.9° |
| C7B | N | CA | CB | 107.9° | 150.0° |
| C7B | N | CA | C | 133.2° | 90.0° |
| C7B | N | CA | HA | 12.9° | 30.0° |
| N | CA | CB | C | 124.0° | 120.0° |
| N | CA | CB | HA | 115.4° | 120.1° |
| N | CA | C | HA | 115.4° | 120.0° |
| N | CA | CB | CG | 23.1° | 60.0° |
| N | CA | CB | HB1 | 102.1° | 60.0° |
| N | CA | CB | HB2 | 148.4° | 180.0° |
| N | CA | C | O | 11.4° | 150.0° |
| N | CA | C | OXT | 174.3° | 30.0° |
| HN | N | CA | CB | 72.1° | 30.0° |
| HN | N | CA | C | 46.9° | 90.0° |
| HN | N | CA | HA | 167.1° | 150.1° |
| CB | CA | C | HA | 121.2° | 119.9° |
| CA | CB | CG | HB1 | 125.2° | 119.9° |
| CA | CB | CG | HB2 | 125.3° | 120.0° |
| CA | CB | HB1 | HB2 | 114.8° | 120.0° |
| CA | CB | CG | CD | 163.5° | 180.0° |
| CA | CB | CG | HG1 | 71.2° | 60.1° |
| CA | CB | CG | HG2 | 38.2° | 60.0° |
| CB | CA | C | O | 112.0° | 90.0° |
| CB | CA | C | OXT | 62.3° | 90.1° |
| C | CA | CB | CG | 147.1° | 180.0° |
| C | CA | CB | HB1 | 21.9° | 60.0° |
| C | CA | CB | HB2 | 87.6° | 59.9° |
| CA | C | O | OXT | 174.0° | 179.9° |
| CA | C | OXT | HXT | 180.0° | 180.0° |
| HA | CA | CB | CG | 92.3° | 60.1° |
| HA | CA | CB | HB1 | 142.5° | 180.0° |
| HA | CA | CB | HB2 | 33.0° | 60.0° |
| HA | CA | C | O | 126.8° | 30.0° |
| HA | CA | C | OXT | 58.9° | 150.0° |
| CG | CB | HB1 | HB2 | 114.7° | 120.1° |
| CB | CG | CD | HG1 | 125.3° | 119.9° |
| CB | CG | CD | HG2 | 125.3° | 120.0° |
| CB | CG | HG1 | HG2 | 118.1° | 120.0° |
| CB | CG | CD | OE1 | 102.6° | 0.1° |
| CB | CG | CD | OE2 | 74.4° | 180.0° |
| HB1 | CB | CG | CD | 38.2° | 60.1° |
| HB1 | CB | CG | HG1 | 163.5° | 180.0° |
| HB1 | CB | CG | HG2 | 87.0° | 60.0° |
| HB2 | CB | CG | CD | 71.3° | 60.0° |
| HB2 | CB | CG | HG1 | 54.0° | 60.0° |
| HB2 | CB | CG | HG2 | 163.4° | 180.0° |
| CD | CG | HG1 | HG2 | 118.1° | 120.0° |
| CG | CD | OE1 | OE2 | 176.8° | 179.9° |
| CG | CD | OE2 | HE2 | 180.0° | 180.0° |
| HG1 | CG | CD | OE1 | 132.1° | 120.0° |
| HG1 | CG | CD | OE2 | 50.9° | 60.0° |
| HG2 | CG | CD | OE1 | 22.7° | 119.9° |
| HG2 | CG | CD | OE2 | 160.3° | 60.0° |
| OE1 | CD | OE2 | HE2 | 3.2° | 0.1° |
| O | C | OXT | HXT | 6.0° | 0.0° |
