QLG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | CA1 | doub | 1.29Å | 1.39Å | |
| N1 | H | sing | 1.03Å | 1.00Å | |
| CA1 | C1 | sing | 1.49Å | 1.50Å | |
| CA1 | CB1 | sing | 1.50Å | 1.49Å | |
| CA2 | CB2 | doub | 1.33Å | 1.52Å | |
| CA2 | N2 | sing | 1.38Å | 1.37Å | |
| CA2 | C2 | sing | 1.49Å | 1.49Å | |
| CA3 | N3 | sing | 1.45Å | 1.45Å | |
| CA3 | C3 | sing | 1.50Å | 1.51Å | |
| CA3 | HA31 | sing | 1.09Å | 1.10Å | |
| CA3 | HA32 | sing | 1.09Å | 1.10Å | |
| C3 | OXT | sing | 1.36Å | 72.97Å | |
| C3 | O3 | doub | 1.22Å | 1.23Å | |
| CB1 | CG1 | sing | 1.53Å | 1.50Å | |
| CB1 | HB11 | sing | 1.10Å | 1.10Å | |
| CB1 | HB12 | sing | 1.10Å | 1.10Å | |
| CB2 | CG2 | sing | 1.51Å | 1.51Å | |
| CB2 | HB2 | sing | 1.09Å | 1.08Å | |
| CG1 | CD3 | sing | 1.52Å | 1.51Å | |
| CG1 | HG11 | sing | 1.10Å | 1.10Å | |
| CG1 | HG12 | sing | 1.10Å | 1.10Å | |
| CG2 | CD1 | sing | 1.53Å | 1.50Å | |
| CG2 | CD2 | sing | 1.53Å | 1.52Å | |
| CG2 | HG2 | sing | 1.10Å | 1.10Å | |
| CD1 | HD11 | sing | 1.09Å | 1.10Å | |
| CD1 | HD12 | sing | 1.10Å | 1.10Å | |
| CD1 | HD13 | sing | 1.10Å | 1.10Å | |
| CD2 | HD21 | sing | 1.10Å | 1.10Å | |
| CD2 | HD22 | sing | 1.09Å | 1.10Å | |
| CD2 | HD23 | sing | 1.10Å | 1.10Å | |
| CD3 | NE1 | sing | 1.38Å | 1.31Å | |
| CD3 | OE1 | doub | 1.23Å | 1.31Å | |
| NE1 | HE11 | sing | 1.01Å | 1.00Å | |
| NE1 | HE12 | sing | 1.01Å | 1.00Å | |
| C1 | N2 | doub | 1.30Å | 1.33Å | |
| C1 | N3 | sing | 1.36Å | 1.43Å | |
| C2 | N3 | sing | 1.37Å | 1.43Å | |
| C2 | O2 | doub | 1.22Å | 1.23Å | |
| OXT | HXT | sing | 0.98Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA1 | N1 | H | 105.6° | 110.4° |
| N1 | CA1 | C1 | 95.4° | 117.9° |
| N1 | CA1 | CB1 | 89.2° | 123.9° |
| C1 | CA1 | CB1 | 124.7° | 118.2° |
| CA1 | C1 | N2 | 97.5° | 121.8° |
| CA1 | C1 | N3 | 109.7° | 121.4° |
| CA1 | CB1 | CG1 | 151.3° | 111.1° |
| CA1 | CB1 | HB11 | 97.3° | 109.6° |
| CA1 | CB1 | HB12 | 89.7° | 107.6° |
| CB2 | CA2 | N2 | 116.5° | 126.7° |
| CB2 | CA2 | C2 | 135.4° | 123.2° |
| CA2 | CB2 | CG2 | 121.2° | 124.1° |
| CA2 | CB2 | HB2 | 119.4° | 118.5° |
| N2 | CA2 | C2 | 107.1° | 110.2° |
| CA2 | N2 | C1 | 111.2° | 103.5° |
| CA2 | C2 | N3 | 105.1° | 102.5° |
| CA2 | C2 | O2 | 127.3° | 126.6° |
| N3 | CA3 | C3 | 119.0° | 108.7° |
| N3 | CA3 | HA31 | 106.4° | 109.0° |
| N3 | CA3 | HA32 | 104.2° | 109.1° |
| CA3 | N3 | C1 | 113.8° | 128.0° |
| CA3 | N3 | C2 | 123.0° | 124.9° |
| C3 | CA3 | HA31 | 106.4° | 109.6° |
| C3 | CA3 | HA32 | 104.2° | 109.9° |
| CA3 | C3 | OXT | 49.3° | 109.9° |
| CA3 | C3 | O3 | 111.0° | 126.4° |
| HA31 | CA3 | HA32 | 117.3° | 110.5° |
| OXT | C3 | O3 | 63.4° | 123.7° |
| C3 | OXT | HXT | 90.0° | 111.9° |
| CG1 | CB1 | HB11 | 97.3° | 111.9° |
| CG1 | CB1 | HB12 | 89.8° | 109.5° |
| CB1 | CG1 | CD3 | 123.0° | 113.3° |
| CB1 | CG1 | HG11 | 105.2° | 111.4° |
| CB1 | CG1 | HG12 | 102.0° | 108.7° |
| HB11 | CB1 | HB12 | 150.3° | 107.1° |
| CG2 | CB2 | HB2 | 119.4° | 117.4° |
| CB2 | CG2 | CD1 | 116.5° | 110.3° |
| CB2 | CG2 | CD2 | 114.3° | 110.4° |
| CB2 | CG2 | HG2 | 97.2° | 109.7° |
| CD3 | CG1 | HG11 | 105.2° | 108.6° |
| CD3 | CG1 | HG12 | 102.0° | 106.8° |
| CG1 | CD3 | NE1 | 120.8° | 112.3° |
| CG1 | CD3 | OE1 | 119.1° | 124.1° |
| HG11 | CG1 | HG12 | 120.8° | 107.7° |
| CD1 | CG2 | CD2 | 90.4° | 110.5° |
| CD1 | CG2 | HG2 | 119.0° | 107.9° |
| CG2 | CD1 | HD11 | 109.5° | 110.7° |
| CG2 | CD1 | HD12 | 109.5° | 111.0° |
| CG2 | CD1 | HD13 | 109.5° | 111.5° |
| CD2 | CG2 | HG2 | 121.0° | 107.9° |
| CG2 | CD2 | HD21 | 109.5° | 111.6° |
| CG2 | CD2 | HD22 | 109.5° | 110.7° |
| CG2 | CD2 | HD23 | 109.4° | 111.0° |
| HD11 | CD1 | HD12 | 109.5° | 107.8° |
| HD11 | CD1 | HD13 | 109.4° | 107.8° |
| HD12 | CD1 | HD13 | 109.5° | 107.9° |
| HD21 | CD2 | HD22 | 109.5° | 107.9° |
| HD21 | CD2 | HD23 | 109.5° | 107.9° |
| HD22 | CD2 | HD23 | 109.5° | 107.7° |
| NE1 | CD3 | OE1 | 120.0° | 123.6° |
| CD3 | NE1 | HE11 | 108.7° | 122.3° |
| CD3 | NE1 | HE12 | 125.7° | 120.9° |
| HE11 | NE1 | HE12 | 125.6° | 116.8° |
| N2 | C1 | N3 | 110.2° | 116.8° |
| C1 | N3 | C2 | 106.4° | 107.1° |
| N3 | C2 | O2 | 127.6° | 130.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | CA1 | C1 | CB1 | 92.8° | 178.8° |
| N1 | CA1 | CB1 | CG1 | 171.5° | 92.8° |
| N1 | CA1 | CB1 | HB11 | 51.5° | 31.3° |
| N1 | CA1 | CB1 | HB12 | 99.5° | 147.3° |
| N1 | CA1 | C1 | N2 | 173.8° | 88.8° |
| N1 | CA1 | C1 | N3 | 71.5° | 91.1° |
| H | N1 | CA1 | C1 | 0.0° | 0.0° |
| H | N1 | CA1 | CB1 | 124.7° | 178.7° |
| CA1 | C1 | N2 | CA2 | 112.7° | 179.9° |
| CA1 | C1 | N3 | CA3 | 117.0° | 0.3° |
| C1 | CA1 | CB1 | CG1 | 75.5° | 85.9° |
| C1 | CA1 | CB1 | HB11 | 44.5° | 150.0° |
| C1 | CA1 | CB1 | HB12 | 164.5° | 33.9° |
| CA1 | C1 | N2 | N3 | 114.2° | 179.9° |
| CA1 | C1 | N3 | C2 | 104.5° | 179.9° |
| CA1 | CB1 | CG1 | HB11 | 120.0° | 122.8° |
| CA1 | CB1 | CG1 | HB12 | 88.9° | 118.7° |
| CA1 | CB1 | HB11 | HB12 | 102.3° | 116.4° |
| CA1 | CB1 | CG1 | CD3 | 75.8° | 177.2° |
| CA1 | CB1 | CG1 | HG11 | 44.2° | 60.0° |
| CA1 | CB1 | CG1 | HG12 | 171.1° | 58.6° |
| CB1 | CA1 | C1 | N2 | 81.1° | 90.0° |
| CB1 | CA1 | C1 | N3 | 164.2° | 90.1° |
| CB2 | CA2 | N2 | C2 | 170.5° | 180.0° |
| CA2 | CB2 | CG2 | HB2 | 180.0° | 179.9° |
| CA2 | CB2 | CG2 | CD1 | 66.5° | 118.8° |
| CA2 | CB2 | CG2 | CD2 | 37.1° | 118.8° |
| CA2 | CB2 | CG2 | HG2 | 165.9° | 0.1° |
| CB2 | CA2 | N2 | C1 | 169.9° | 179.9° |
| CB2 | CA2 | C2 | N3 | 168.3° | 180.0° |
| CB2 | CA2 | C2 | O2 | 11.5° | 0.1° |
| N2 | CA2 | CB2 | CG2 | 140.2° | 0.0° |
| N2 | CA2 | CB2 | HB2 | 39.8° | 179.9° |
| CA2 | N2 | C1 | N3 | 1.5° | 0.1° |
| N2 | CA2 | C2 | N3 | 0.4° | 0.0° |
| N2 | CA2 | C2 | O2 | 179.4° | 180.0° |
| CA2 | C2 | N3 | CA3 | 132.5° | 179.7° |
| C2 | CA2 | CB2 | CG2 | 52.7° | 180.0° |
| C2 | CA2 | CB2 | HB2 | 127.3° | 0.0° |
| C2 | CA2 | N2 | C1 | 0.7° | 0.1° |
| CA2 | C2 | N3 | C1 | 1.3° | 0.1° |
| CA2 | C2 | N3 | O2 | 179.9° | 180.0° |
| N3 | CA3 | C3 | HA31 | 120.0° | 119.0° |
| N3 | CA3 | C3 | HA32 | 115.4° | 119.3° |
| N3 | CA3 | HA31 | HA32 | 116.0° | 119.9° |
| N3 | CA3 | C3 | OXT | 172.4° | 151.0° |
| N3 | CA3 | C3 | O3 | 171.6° | 28.9° |
| CA3 | N3 | C1 | N2 | 136.8° | 179.7° |
| CA3 | N3 | C1 | C2 | 138.6° | 179.8° |
| CA3 | N3 | C2 | O2 | 47.6° | 0.2° |
| C3 | CA3 | HA31 | HA32 | 116.1° | 121.3° |
| CA3 | C3 | OXT | O3 | 163.3° | 179.9° |
| C3 | CA3 | N3 | C1 | 20.5° | 90.8° |
| C3 | CA3 | N3 | C2 | 110.3° | 89.4° |
| CA3 | C3 | OXT | HXT | 90.0° | 180.0° |
| HA31 | CA3 | C3 | OXT | 67.6° | 90.0° |
| HA31 | CA3 | C3 | O3 | 51.6° | 90.0° |
| HA31 | CA3 | N3 | C1 | 140.5° | 149.8° |
| HA31 | CA3 | N3 | C2 | 9.7° | 30.0° |
| HA32 | CA3 | C3 | OXT | 57.0° | 31.7° |
| HA32 | CA3 | C3 | O3 | 73.0° | 148.3° |
| HA32 | CA3 | N3 | C1 | 95.0° | 29.0° |
| HA32 | CA3 | N3 | C2 | 134.2° | 150.7° |
| O3 | C3 | OXT | HXT | 90.0° | 0.0° |
| CG1 | CB1 | HB11 | HB12 | 102.4° | 119.9° |
| CB1 | CG1 | CD3 | HG11 | 120.0° | 124.3° |
| CB1 | CG1 | CD3 | HG12 | 113.1° | 119.7° |
| CB1 | CG1 | HG11 | HG12 | 114.4° | 119.1° |
| CB1 | CG1 | CD3 | NE1 | 40.8° | 180.0° |
| CB1 | CG1 | CD3 | OE1 | 135.5° | 0.0° |
| HB11 | CB1 | CG1 | CD3 | 164.2° | 60.0° |
| HB11 | CB1 | CG1 | HG11 | 75.8° | 62.8° |
| HB11 | CB1 | CG1 | HG12 | 51.2° | 178.7° |
| HB12 | CB1 | CG1 | CD3 | 13.2° | 58.5° |
| HB12 | CB1 | CG1 | HG11 | 133.2° | 178.7° |
| HB12 | CB1 | CG1 | HG12 | 99.9° | 60.1° |
| CB2 | CG2 | CD1 | CD2 | 117.6° | 122.3° |
| CB2 | CG2 | CD1 | HG2 | 115.9° | 119.8° |
| CB2 | CG2 | CD2 | HG2 | 115.6° | 119.9° |
| CB2 | CG2 | CD1 | HD11 | 127.0° | 178.4° |
| CB2 | CG2 | CD1 | HD12 | 113.0° | 58.7° |
| CB2 | CG2 | CD1 | HD13 | 7.0° | 61.6° |
| CB2 | CG2 | CD2 | HD21 | 63.1° | 61.5° |
| CB2 | CG2 | CD2 | HD22 | 56.9° | 178.3° |
| CB2 | CG2 | CD2 | HD23 | 176.9° | 58.8° |
| HB2 | CB2 | CG2 | CD1 | 113.5° | 61.3° |
| HB2 | CB2 | CG2 | CD2 | 142.9° | 61.2° |
| HB2 | CB2 | CG2 | HG2 | 14.1° | 180.0° |
| CD3 | CG1 | HG11 | HG12 | 114.4° | 115.4° |
| CG1 | CD3 | NE1 | OE1 | 176.2° | 179.9° |
| CG1 | CD3 | NE1 | HE11 | 180.0° | 0.0° |
| CG1 | CD3 | NE1 | HE12 | 0.0° | 179.9° |
| HG11 | CG1 | CD3 | NE1 | 79.2° | 55.7° |
| HG11 | CG1 | CD3 | OE1 | 104.5° | 124.4° |
| HG12 | CG1 | CD3 | NE1 | 153.9° | 60.3° |
| HG12 | CG1 | CD3 | OE1 | 22.4° | 119.7° |
| CD1 | CG2 | CD2 | HG2 | 124.8° | 117.8° |
| CG2 | CD1 | HD11 | HD12 | 120.0° | 121.5° |
| CG2 | CD1 | HD11 | HD13 | 120.0° | 122.3° |
| CG2 | CD1 | HD12 | HD13 | 120.0° | 122.5° |
| CD1 | CG2 | CD2 | HD21 | 56.4° | 60.8° |
| CD1 | CG2 | CD2 | HD22 | 176.4° | 59.4° |
| CD1 | CG2 | CD2 | HD23 | 63.6° | 178.9° |
| CD2 | CG2 | CD1 | HD11 | 9.3° | 59.3° |
| CD2 | CG2 | CD1 | HD12 | 129.3° | 178.9° |
| CD2 | CG2 | CD1 | HD13 | 110.6° | 60.7° |
| CG2 | CD2 | HD21 | HD22 | 120.0° | 121.8° |
| CG2 | CD2 | HD21 | HD23 | 120.0° | 122.1° |
| CG2 | CD2 | HD22 | HD23 | 120.0° | 121.4° |
| HG2 | CG2 | CD1 | HD11 | 117.1° | 58.5° |
| HG2 | CG2 | CD1 | HD12 | 2.9° | 61.1° |
| HG2 | CG2 | CD1 | HD13 | 122.9° | 178.6° |
| HG2 | CG2 | CD2 | HD21 | 178.8° | 178.6° |
| HG2 | CG2 | CD2 | HD22 | 58.8° | 58.4° |
| HG2 | CG2 | CD2 | HD23 | 61.2° | 61.1° |
| HD11 | CD1 | HD12 | HD13 | 119.9° | 116.2° |
| HD21 | CD2 | HD22 | HD23 | 120.0° | 116.2° |
| CD3 | NE1 | HE11 | HE12 | 180.0° | 180.0° |
| OE1 | CD3 | NE1 | HE11 | 3.7° | 179.9° |
| OE1 | CD3 | NE1 | HE12 | 176.3° | 0.1° |
| N2 | C1 | N3 | C2 | 1.7° | 0.1° |
| C1 | N3 | C2 | O2 | 178.6° | 180.0° |
