PRD_000369
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.48Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CA | C | sing | 1.51Å | 1.53Å | |
| CA | CB | sing | 1.53Å | 1.52Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| C | O | doub | 1.21Å | 1.24Å | |
| C | N1 | sing | 1.35Å | 1.33Å | |
| CB | CG | sing | 1.51Å | 1.50Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| CB | HB3 | sing | 1.09Å | 1.10Å | |
| CG | CD1 | doub | 1.38Å | 1.39Å | Aromatic |
| CG | CD2 | sing | 1.38Å | 1.39Å | Aromatic |
| CD1 | CE1 | sing | 1.38Å | 1.39Å | Aromatic |
| CD1 | HD1 | sing | 1.08Å | 1.08Å | |
| CD2 | CE2 | doub | 1.38Å | 1.39Å | Aromatic |
| CD2 | HD2 | sing | 1.08Å | 1.08Å | |
| CE1 | CZ | doub | 1.38Å | 1.39Å | Aromatic |
| CE1 | HE1 | sing | 1.08Å | 1.08Å | |
| CE2 | CZ | sing | 1.38Å | 1.39Å | Aromatic |
| CE2 | HE2 | sing | 1.08Å | 1.08Å | |
| CZ | HZ | sing | 1.08Å | 1.08Å | |
| N1 | CA1 | sing | 1.47Å | 1.46Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| CA1 | C1 | sing | 1.51Å | 1.50Å | |
| CA1 | CB1 | sing | 1.53Å | 1.54Å | |
| CA1 | HA1 | sing | 1.09Å | 1.10Å | |
| C1 | O1 | doub | 1.21Å | 1.23Å | |
| C1 | N2 | sing | 1.35Å | 1.32Å | |
| CB1 | CG1 | sing | 1.51Å | 1.49Å | |
| CB1 | HB21 | sing | 1.09Å | 1.10Å | |
| CB1 | HB31 | sing | 1.09Å | 1.10Å | |
| CG1 | CD11 | doub | 1.38Å | 1.39Å | Aromatic |
| CG1 | CD21 | sing | 1.38Å | 1.39Å | Aromatic |
| CD11 | CE11 | sing | 1.38Å | 1.39Å | Aromatic |
| CD11 | HD11 | sing | 1.08Å | 1.08Å | |
| CD21 | CE21 | doub | 1.38Å | 1.39Å | Aromatic |
| CD21 | HD21 | sing | 1.08Å | 1.08Å | |
| CE11 | CZ1 | doub | 1.38Å | 1.39Å | Aromatic |
| CE11 | HE11 | sing | 1.08Å | 1.08Å | |
| CE21 | CZ1 | sing | 1.38Å | 1.39Å | Aromatic |
| CE21 | HE21 | sing | 1.08Å | 1.08Å | |
| CZ1 | HZ1 | sing | 1.08Å | 1.08Å | |
| N2 | CA2 | sing | 1.47Å | 1.44Å | |
| N2 | H3 | sing | 0.97Å | 1.00Å | |
| CA2 | C2 | sing | 1.53Å | 1.53Å | |
| CA2 | CB2 | sing | 1.53Å | 1.53Å | |
| CA2 | HA2 | sing | 1.09Å | 1.10Å | |
| C2 | O2 | sing | 1.43Å | 1.24Å | |
| C2 | C3 | sing | 1.53Å | 1.57Å | |
| CB2 | CG2 | sing | 1.53Å | 1.52Å | |
| CB2 | HB22 | sing | 1.09Å | 1.10Å | |
| CB2 | HB32 | sing | 1.09Å | 1.10Å | |
| CG2 | CD | sing | 1.53Å | 1.52Å | |
| CG2 | HG2 | sing | 1.09Å | 1.10Å | |
| CG2 | HG3 | sing | 1.09Å | 1.10Å | |
| CD | NE | sing | 1.46Å | 1.46Å | |
| CD | HD22 | sing | 1.09Å | 1.10Å | |
| CD | HD3 | sing | 1.09Å | 1.10Å | |
| NE | CZ2 | sing | 1.37Å | 1.33Å | |
| NE | HE | sing | 0.97Å | 1.00Å | |
| CZ2 | NH1 | sing | 1.33Å | 1.32Å | |
| CZ2 | NH2 | doub | 1.33Å | 1.33Å | |
| NH1 | HH11 | sing | 0.97Å | 1.00Å | |
| NH1 | HH12 | sing | 0.97Å | 1.00Å | |
| NH2 | HH21 | sing | 0.97Å | 1.00Å | |
| NH2 | HH22 | sing | 0.97Å | 1.00Å | |
| C3 | H11 | sing | 1.09Å | 1.10Å | |
| C3 | H21 | sing | 1.09Å | 1.10Å | |
| C3 | CL | sing | 1.80Å | 1.49Å | |
| C2 | H35 | sing | 1.09Å | 1.10Å | |
| O2 | H36 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | H | 109.5° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| N | CA | C | 111.0° | 109.5° |
| N | CA | CB | 109.4° | 109.5° |
| N | CA | HA | 108.8° | 109.5° |
| H | N | H2 | 109.5° | 111.0° |
| C | CA | CB | 110.3° | 109.5° |
| C | CA | HA | 107.8° | 109.4° |
| CA | C | O | 120.7° | 119.9° |
| CA | C | N1 | 115.8° | 120.0° |
| CB | CA | HA | 109.5° | 109.4° |
| CA | CB | CG | 113.8° | 109.5° |
| CA | CB | HB2 | 108.1° | 109.5° |
| CA | CB | HB3 | 108.1° | 109.5° |
| O | C | N1 | 123.5° | 120.0° |
| C | N1 | CA1 | 122.6° | 120.0° |
| C | N1 | H1 | 118.7° | 120.0° |
| CG | CB | HB2 | 108.1° | 109.4° |
| CG | CB | HB3 | 108.0° | 109.5° |
| CB | CG | CD1 | 120.4° | 120.0° |
| CB | CG | CD2 | 120.7° | 120.0° |
| HB2 | CB | HB3 | 110.8° | 109.4° |
| CD1 | CG | CD2 | 118.9° | 120.0° |
| CG | CD1 | CE1 | 120.7° | 120.0° |
| CG | CD1 | HD1 | 119.6° | 120.0° |
| CG | CD2 | CE2 | 121.0° | 120.0° |
| CG | CD2 | HD2 | 119.5° | 120.0° |
| CE1 | CD1 | HD1 | 119.6° | 120.0° |
| CD1 | CE1 | CZ | 119.7° | 120.0° |
| CD1 | CE1 | HE1 | 120.1° | 120.0° |
| CE2 | CD2 | HD2 | 119.5° | 120.0° |
| CD2 | CE2 | CZ | 119.5° | 120.0° |
| CD2 | CE2 | HE2 | 120.2° | 120.1° |
| CZ | CE1 | HE1 | 120.1° | 120.0° |
| CE1 | CZ | CE2 | 120.1° | 120.0° |
| CE1 | CZ | HZ | 120.0° | 120.0° |
| CZ | CE2 | HE2 | 120.2° | 120.0° |
| CE2 | CZ | HZ | 119.9° | 120.0° |
| CA1 | N1 | H1 | 118.7° | 120.0° |
| N1 | CA1 | C1 | 103.9° | 109.5° |
| N1 | CA1 | CB1 | 111.0° | 109.4° |
| N1 | CA1 | HA1 | 112.4° | 109.5° |
| C1 | CA1 | CB1 | 110.3° | 109.5° |
| C1 | CA1 | HA1 | 113.1° | 109.5° |
| CA1 | C1 | O1 | 120.3° | 120.0° |
| CA1 | C1 | N2 | 116.6° | 120.0° |
| CB1 | CA1 | HA1 | 106.2° | 109.5° |
| CA1 | CB1 | CG1 | 113.3° | 109.5° |
| CA1 | CB1 | HB21 | 108.2° | 109.4° |
| CA1 | CB1 | HB31 | 108.2° | 109.5° |
| O1 | C1 | N2 | 123.1° | 120.0° |
| C1 | N2 | CA2 | 120.5° | 120.0° |
| C1 | N2 | H3 | 119.8° | 120.0° |
| CG1 | CB1 | HB21 | 108.2° | 109.5° |
| CG1 | CB1 | HB31 | 108.2° | 109.5° |
| CB1 | CG1 | CD11 | 120.2° | 120.0° |
| CB1 | CG1 | CD21 | 120.7° | 120.0° |
| HB21 | CB1 | HB31 | 110.7° | 109.5° |
| CD11 | CG1 | CD21 | 119.0° | 120.0° |
| CG1 | CD11 | CE11 | 120.7° | 120.0° |
| CG1 | CD11 | HD11 | 119.6° | 120.0° |
| CG1 | CD21 | CE21 | 120.5° | 120.0° |
| CG1 | CD21 | HD21 | 119.7° | 120.0° |
| CE11 | CD11 | HD11 | 119.6° | 120.0° |
| CD11 | CE11 | CZ1 | 120.0° | 120.0° |
| CD11 | CE11 | HE11 | 120.0° | 120.0° |
| CE21 | CD21 | HD21 | 119.7° | 120.0° |
| CD21 | CE21 | CZ1 | 119.8° | 120.0° |
| CD21 | CE21 | HE21 | 120.1° | 120.0° |
| CZ1 | CE11 | HE11 | 120.0° | 120.0° |
| CE11 | CZ1 | CE21 | 119.9° | 120.0° |
| CE11 | CZ1 | HZ1 | 120.1° | 120.0° |
| CZ1 | CE21 | HE21 | 120.1° | 120.0° |
| CE21 | CZ1 | HZ1 | 120.1° | 120.0° |
| CA2 | N2 | H3 | 119.7° | 120.0° |
| N2 | CA2 | C2 | 115.0° | 109.5° |
| N2 | CA2 | CB2 | 108.5° | 109.5° |
| N2 | CA2 | HA2 | 106.9° | 109.5° |
| C2 | CA2 | CB2 | 111.1° | 109.4° |
| C2 | CA2 | HA2 | 104.1° | 109.5° |
| CA2 | C2 | O2 | 104.5° | 109.5° |
| CA2 | C2 | C3 | 118.5° | 109.5° |
| CA2 | C2 | H35 | 106.1° | 109.5° |
| CB2 | CA2 | HA2 | 111.1° | 109.4° |
| CA2 | CB2 | CG2 | 112.7° | 109.5° |
| CA2 | CB2 | HB22 | 108.4° | 109.5° |
| CA2 | CB2 | HB32 | 108.4° | 109.5° |
| O2 | C2 | C3 | 106.8° | 109.4° |
| O2 | C2 | H35 | 118.0° | 109.5° |
| C2 | O2 | H36 | 109.5° | 114.0° |
| C2 | C3 | H11 | 107.0° | 109.4° |
| C2 | C3 | H21 | 107.0° | 109.5° |
| C2 | C3 | CL | 117.2° | 109.5° |
| C3 | C2 | H35 | 103.8° | 109.5° |
| CG2 | CB2 | HB22 | 108.4° | 109.4° |
| CG2 | CB2 | HB32 | 108.4° | 109.5° |
| CB2 | CG2 | CD | 111.9° | 109.5° |
| CB2 | CG2 | HG2 | 108.7° | 109.4° |
| CB2 | CG2 | HG3 | 108.7° | 109.5° |
| HB22 | CB2 | HB32 | 110.5° | 109.5° |
| CD | CG2 | HG2 | 108.7° | 109.5° |
| CD | CG2 | HG3 | 108.7° | 109.5° |
| CG2 | CD | NE | 109.6° | 109.4° |
| CG2 | CD | HD22 | 109.4° | 109.4° |
| CG2 | CD | HD3 | 109.4° | 109.5° |
| HG2 | CG2 | HG3 | 110.2° | 109.5° |
| NE | CD | HD22 | 109.5° | 109.5° |
| NE | CD | HD3 | 109.4° | 109.5° |
| CD | NE | CZ2 | 125.2° | 120.0° |
| CD | NE | HE | 117.4° | 120.0° |
| HD22 | CD | HD3 | 109.5° | 109.5° |
| CZ2 | NE | HE | 117.4° | 120.0° |
| NE | CZ2 | NH1 | 120.8° | 120.0° |
| NE | CZ2 | NH2 | 119.4° | 120.0° |
| NH1 | CZ2 | NH2 | 119.8° | 120.0° |
| CZ2 | NH1 | HH11 | 120.0° | 120.0° |
| CZ2 | NH1 | HH12 | 120.0° | 120.0° |
| CZ2 | NH2 | HH21 | 120.0° | 120.0° |
| CZ2 | NH2 | HH22 | 120.0° | 120.0° |
| HH11 | NH1 | HH12 | 120.0° | 120.0° |
| HH21 | NH2 | HH22 | 120.0° | 120.0° |
| H11 | C3 | H21 | 111.8° | 109.5° |
| H11 | C3 | CL | 107.0° | 109.5° |
| H21 | C3 | CL | 107.0° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | H | H2 | 120.0° | 124.0° |
| N | CA | C | CB | 121.4° | 120.1° |
| N | CA | C | HA | 119.1° | 120.0° |
| N | CA | CB | HA | 119.1° | 120.0° |
| N | CA | C | O | 10.4° | 20.0° |
| N | CA | C | N1 | 169.8° | 160.0° |
| N | CA | CB | CG | 53.3° | 65.0° |
| N | CA | CB | HB2 | 66.7° | 175.0° |
| N | CA | CB | HB3 | 173.3° | 55.0° |
| H | N | CA | C | 180.0° | 176.0° |
| H | N | CA | CB | 58.0° | 64.0° |
| H | N | CA | HA | 61.5° | 56.0° |
| H2 | N | CA | C | 60.0° | 60.0° |
| H2 | N | CA | CB | 62.0° | 60.0° |
| H2 | N | CA | HA | 178.4° | 180.0° |
| C | CA | CB | HA | 118.5° | 119.9° |
| CA | C | O | N1 | 179.8° | 180.0° |
| C | CA | CB | CG | 69.0° | 175.0° |
| C | CA | CB | HB2 | 170.9° | 55.0° |
| C | CA | CB | HB3 | 51.0° | 65.0° |
| CA | C | N1 | CA1 | 178.2° | 180.0° |
| CA | C | N1 | H1 | 1.8° | 0.0° |
| CB | CA | C | O | 111.0° | 100.0° |
| CB | CA | C | N1 | 68.8° | 80.0° |
| CA | CB | CG | HB2 | 120.0° | 120.1° |
| CA | CB | CG | HB3 | 120.0° | 120.0° |
| CA | CB | HB2 | HB3 | 118.3° | 120.0° |
| CA | CB | CG | CD1 | 95.8° | 90.0° |
| CA | CB | CG | CD2 | 85.1° | 90.3° |
| HA | CA | C | O | 129.5° | 140.0° |
| HA | CA | C | N1 | 50.7° | 40.0° |
| HA | CA | CB | CG | 172.5° | 55.0° |
| HA | CA | CB | HB2 | 52.4° | 65.0° |
| HA | CA | CB | HB3 | 67.6° | 175.0° |
| O | C | N1 | CA1 | 2.0° | 0.0° |
| O | C | N1 | H1 | 178.0° | 180.0° |
| C | N1 | CA1 | H1 | 180.0° | 179.9° |
| C | N1 | CA1 | C1 | 89.4° | 155.0° |
| C | N1 | CA1 | CB1 | 152.0° | 85.0° |
| C | N1 | CA1 | HA1 | 33.2° | 35.0° |
| CG | CB | HB2 | HB3 | 118.2° | 120.0° |
| CB | CG | CD1 | CD2 | 179.1° | 179.7° |
| CB | CG | CD1 | CE1 | 179.1° | 180.0° |
| CB | CG | CD1 | HD1 | 1.0° | 0.1° |
| CB | CG | CD2 | CE2 | 179.1° | 180.0° |
| CB | CG | CD2 | HD2 | 0.9° | 0.0° |
| HB2 | CB | CG | CD1 | 24.2° | 30.0° |
| HB2 | CB | CG | CD2 | 154.9° | 149.7° |
| HB3 | CB | CG | CD1 | 144.2° | 150.0° |
| HB3 | CB | CG | CD2 | 34.9° | 29.7° |
| CG | CD1 | CE1 | HD1 | 180.0° | 179.9° |
| CD1 | CG | CD2 | CE2 | 0.0° | 0.3° |
| CD1 | CG | CD2 | HD2 | 179.9° | 179.7° |
| CG | CD1 | CE1 | CZ | 0.0° | 0.1° |
| CG | CD1 | CE1 | HE1 | 180.0° | 179.9° |
| CD2 | CG | CD1 | CE1 | 0.1° | 0.3° |
| CD2 | CG | CD1 | HD1 | 179.9° | 179.8° |
| CG | CD2 | CE2 | HD2 | 180.0° | 180.0° |
| CG | CD2 | CE2 | CZ | 0.1° | 0.0° |
| CG | CD2 | CE2 | HE2 | 179.9° | 180.0° |
| CD1 | CE1 | CZ | HE1 | 180.0° | 180.0° |
| CD1 | CE1 | CZ | CE2 | 0.1° | 0.2° |
| CD1 | CE1 | CZ | HZ | 179.9° | 180.0° |
| HD1 | CD1 | CE1 | CZ | 180.0° | 180.0° |
| HD1 | CD1 | CE1 | HE1 | 0.0° | 0.0° |
| CD2 | CE2 | CZ | CE1 | 0.1° | 0.2° |
| CD2 | CE2 | CZ | HE2 | 180.0° | 180.0° |
| CD2 | CE2 | CZ | HZ | 179.8° | 180.0° |
| HD2 | CD2 | CE2 | CZ | 179.9° | 180.0° |
| HD2 | CD2 | CE2 | HE2 | 0.1° | 0.0° |
| CE1 | CZ | CE2 | HZ | 180.0° | 179.8° |
| CE1 | CZ | CE2 | HE2 | 179.9° | 179.7° |
| HE1 | CE1 | CZ | CE2 | 179.9° | 179.8° |
| HE1 | CE1 | CZ | HZ | 0.2° | 0.0° |
| HE2 | CE2 | CZ | HZ | 0.2° | 0.1° |
| N1 | CA1 | C1 | CB1 | 119.0° | 120.0° |
| N1 | CA1 | C1 | HA1 | 122.1° | 120.0° |
| N1 | CA1 | CB1 | HA1 | 122.5° | 120.0° |
| N1 | CA1 | C1 | O1 | 41.2° | 0.0° |
| N1 | CA1 | C1 | N2 | 138.7° | 180.0° |
| N1 | CA1 | CB1 | CG1 | 68.7° | 65.0° |
| N1 | CA1 | CB1 | HB21 | 51.3° | 55.0° |
| N1 | CA1 | CB1 | HB31 | 171.4° | 174.9° |
| H1 | N1 | CA1 | C1 | 90.5° | 24.9° |
| H1 | N1 | CA1 | CB1 | 28.0° | 95.0° |
| H1 | N1 | CA1 | HA1 | 146.9° | 145.0° |
| C1 | CA1 | CB1 | HA1 | 122.9° | 120.0° |
| CA1 | C1 | O1 | N2 | 179.9° | 179.9° |
| C1 | CA1 | CB1 | CG1 | 176.7° | 175.0° |
| C1 | CA1 | CB1 | HB21 | 63.3° | 65.0° |
| C1 | CA1 | CB1 | HB31 | 56.7° | 55.0° |
| CA1 | C1 | N2 | CA2 | 178.5° | 180.0° |
| CA1 | C1 | N2 | H3 | 1.5° | 0.0° |
| CB1 | CA1 | C1 | O1 | 77.8° | 120.0° |
| CB1 | CA1 | C1 | N2 | 102.2° | 60.0° |
| CA1 | CB1 | CG1 | HB21 | 120.0° | 120.0° |
| CA1 | CB1 | CG1 | HB31 | 120.0° | 120.0° |
| CA1 | CB1 | HB21 | HB31 | 118.4° | 120.0° |
| CA1 | CB1 | CG1 | CD11 | 83.1° | 90.0° |
| CA1 | CB1 | CG1 | CD21 | 94.8° | 90.3° |
| HA1 | CA1 | C1 | O1 | 163.3° | 120.0° |
| HA1 | CA1 | C1 | N2 | 16.6° | 60.0° |
| HA1 | CA1 | CB1 | CG1 | 53.8° | 55.0° |
| HA1 | CA1 | CB1 | HB21 | 173.8° | 175.0° |
| HA1 | CA1 | CB1 | HB31 | 66.2° | 65.0° |
| O1 | C1 | N2 | CA2 | 1.4° | 0.1° |
| O1 | C1 | N2 | H3 | 178.6° | 180.0° |
| C1 | N2 | CA2 | H3 | 180.0° | 180.0° |
| C1 | N2 | CA2 | C2 | 106.3° | 85.0° |
| C1 | N2 | CA2 | CB2 | 128.6° | 155.0° |
| C1 | N2 | CA2 | HA2 | 8.7° | 35.0° |
| CG1 | CB1 | HB21 | HB31 | 118.5° | 120.0° |
| CB1 | CG1 | CD11 | CD21 | 177.9° | 179.7° |
| CB1 | CG1 | CD11 | CE11 | 177.6° | 180.0° |
| CB1 | CG1 | CD11 | HD11 | 2.4° | 0.0° |
| CB1 | CG1 | CD21 | CE21 | 177.6° | 180.0° |
| CB1 | CG1 | CD21 | HD21 | 2.4° | 0.0° |
| HB21 | CB1 | CG1 | CD11 | 156.9° | 30.0° |
| HB21 | CB1 | CG1 | CD21 | 25.2° | 149.8° |
| HB31 | CB1 | CG1 | CD11 | 36.9° | 150.0° |
| HB31 | CB1 | CG1 | CD21 | 145.3° | 29.8° |
| CG1 | CD11 | CE11 | HD11 | 180.0° | 180.0° |
| CD11 | CG1 | CD21 | CE21 | 0.3° | 0.3° |
| CD11 | CG1 | CD21 | HD21 | 179.8° | 179.7° |
| CG1 | CD11 | CE11 | CZ1 | 0.1° | 0.0° |
| CG1 | CD11 | CE11 | HE11 | 179.9° | 180.0° |
| CD21 | CG1 | CD11 | CE11 | 0.3° | 0.3° |
| CD21 | CG1 | CD11 | HD11 | 179.7° | 179.7° |
| CG1 | CD21 | CE21 | HD21 | 180.0° | 180.0° |
| CG1 | CD21 | CE21 | CZ1 | 0.1° | 0.1° |
| CG1 | CD21 | CE21 | HE21 | 179.9° | 179.9° |
| CD11 | CE11 | CZ1 | HE11 | 180.0° | 180.0° |
| CD11 | CE11 | CZ1 | CE21 | 0.0° | 0.2° |
| CD11 | CE11 | CZ1 | HZ1 | 179.9° | 179.9° |
| HD11 | CD11 | CE11 | CZ1 | 179.9° | 180.0° |
| HD11 | CD11 | CE11 | HE11 | 0.1° | 0.0° |
| CD21 | CE21 | CZ1 | CE11 | 0.0° | 0.2° |
| CD21 | CE21 | CZ1 | HE21 | 180.0° | 179.8° |
| CD21 | CE21 | CZ1 | HZ1 | 179.9° | 180.0° |
| HD21 | CD21 | CE21 | CZ1 | 179.9° | 179.9° |
| HD21 | CD21 | CE21 | HE21 | 0.1° | 0.1° |
| CE11 | CZ1 | CE21 | HZ1 | 180.0° | 179.9° |
| CE11 | CZ1 | CE21 | HE21 | 180.0° | 179.7° |
| HE11 | CE11 | CZ1 | CE21 | 180.0° | 179.8° |
| HE11 | CE11 | CZ1 | HZ1 | 0.1° | 0.1° |
| HE21 | CE21 | CZ1 | HZ1 | 0.1° | 0.2° |
| N2 | CA2 | C2 | CB2 | 123.7° | 120.0° |
| N2 | CA2 | C2 | HA2 | 116.6° | 120.0° |
| N2 | CA2 | CB2 | HA2 | 117.3° | 120.0° |
| N2 | CA2 | C2 | O2 | 156.1° | 180.0° |
| N2 | CA2 | C2 | C3 | 37.5° | 60.0° |
| N2 | CA2 | CB2 | CG2 | 56.1° | 65.0° |
| N2 | CA2 | CB2 | HB22 | 63.9° | 55.0° |
| N2 | CA2 | CB2 | HB32 | 176.1° | 175.0° |
| N2 | CA2 | C2 | H35 | 78.5° | 60.0° |
| H3 | N2 | CA2 | C2 | 73.7° | 95.0° |
| H3 | N2 | CA2 | CB2 | 51.3° | 25.0° |
| H3 | N2 | CA2 | HA2 | 171.3° | 145.0° |
| C2 | CA2 | CB2 | HA2 | 115.4° | 120.0° |
| CA2 | C2 | O2 | C3 | 126.3° | 120.0° |
| CA2 | C2 | O2 | H35 | 117.5° | 120.0° |
| CA2 | C2 | C3 | H35 | 117.3° | 120.0° |
| C2 | CA2 | CB2 | CG2 | 176.6° | 175.0° |
| C2 | CA2 | CB2 | HB22 | 63.4° | 65.0° |
| C2 | CA2 | CB2 | HB32 | 56.6° | 55.0° |
| CA2 | C2 | C3 | H11 | 43.7° | 55.0° |
| CA2 | C2 | C3 | H21 | 163.7° | 65.0° |
| CA2 | C2 | C3 | CL | 76.3° | 175.0° |
| CA2 | C2 | O2 | H36 | 180.0° | 60.0° |
| CB2 | CA2 | C2 | O2 | 80.1° | 60.0° |
| CB2 | CA2 | C2 | C3 | 161.2° | 180.0° |
| CA2 | CB2 | CG2 | HB22 | 120.0° | 120.0° |
| CA2 | CB2 | CG2 | HB32 | 120.0° | 120.0° |
| CA2 | CB2 | HB22 | HB32 | 118.7° | 120.0° |
| CA2 | CB2 | CG2 | CD | 171.7° | NaN° |
| CA2 | CB2 | CG2 | HG2 | 68.3° | 60.0° |
| CA2 | CB2 | CG2 | HG3 | 51.7° | 60.0° |
| CB2 | CA2 | C2 | H35 | 45.2° | 60.0° |
| HA2 | CA2 | C2 | O2 | 39.5° | 60.0° |
| HA2 | CA2 | C2 | C3 | 79.1° | 60.0° |
| HA2 | CA2 | CB2 | CG2 | 61.2° | 55.0° |
| HA2 | CA2 | CB2 | HB22 | 178.8° | 175.0° |
| HA2 | CA2 | CB2 | HB32 | 58.8° | 65.0° |
| HA2 | CA2 | C2 | H35 | 164.9° | 179.9° |
| O2 | C2 | C3 | H35 | 125.3° | 120.0° |
| O2 | C2 | C3 | H11 | 73.8° | 175.0° |
| O2 | C2 | C3 | H21 | 46.2° | 55.0° |
| O2 | C2 | C3 | CL | 166.3° | 65.0° |
| C2 | C3 | H11 | H21 | 116.8° | 120.0° |
| C2 | C3 | H11 | CL | 126.3° | 120.0° |
| C2 | C3 | H21 | CL | 126.3° | 120.0° |
| C3 | C2 | O2 | H36 | 53.7° | 60.0° |
| CG2 | CB2 | HB22 | HB32 | 118.7° | 120.0° |
| CB2 | CG2 | CD | HG2 | 120.0° | 120.0° |
| CB2 | CG2 | CD | HG3 | 120.0° | 120.0° |
| CB2 | CG2 | HG2 | HG3 | 119.0° | 120.0° |
| CB2 | CG2 | CD | NE | 174.2° | 180.0° |
| CB2 | CG2 | CD | HD22 | 65.8° | 60.0° |
| CB2 | CG2 | CD | HD3 | 54.2° | 60.0° |
| HB22 | CB2 | CG2 | CD | 51.7° | 60.0° |
| HB22 | CB2 | CG2 | HG2 | 171.7° | 180.0° |
| HB22 | CB2 | CG2 | HG3 | 68.3° | 60.0° |
| HB32 | CB2 | CG2 | CD | 68.3° | 60.0° |
| HB32 | CB2 | CG2 | HG2 | 51.8° | 60.0° |
| HB32 | CB2 | CG2 | HG3 | 171.7° | NaN° |
| CD | CG2 | HG2 | HG3 | 119.0° | 120.0° |
| CG2 | CD | NE | HD22 | 120.0° | 120.0° |
| CG2 | CD | NE | HD3 | 120.0° | 120.0° |
| CG2 | CD | HD22 | HD3 | 119.9° | 120.0° |
| CG2 | CD | NE | CZ2 | 180.0° | 179.9° |
| CG2 | CD | NE | HE | 0.0° | 0.1° |
| HG2 | CG2 | CD | NE | 54.2° | 60.0° |
| HG2 | CG2 | CD | HD22 | 174.2° | 180.0° |
| HG2 | CG2 | CD | HD3 | 65.8° | 60.0° |
| HG3 | CG2 | CD | NE | 65.8° | 60.0° |
| HG3 | CG2 | CD | HD22 | 54.2° | 60.0° |
| HG3 | CG2 | CD | HD3 | 174.2° | 180.0° |
| NE | CD | HD22 | HD3 | 119.9° | 120.1° |
| CD | NE | CZ2 | HE | 180.0° | 179.9° |
| CD | NE | CZ2 | NH1 | 0.3° | 0.1° |
| CD | NE | CZ2 | NH2 | 179.5° | 180.0° |
| HD22 | CD | NE | CZ2 | 60.0° | 60.1° |
| HD22 | CD | NE | HE | 120.0° | 120.0° |
| HD3 | CD | NE | CZ2 | 60.0° | 60.0° |
| HD3 | CD | NE | HE | 120.0° | 119.9° |
| NE | CZ2 | NH1 | NH2 | 179.8° | 179.9° |
| NE | CZ2 | NH1 | HH11 | 179.8° | 0.1° |
| NE | CZ2 | NH1 | HH12 | 0.3° | 179.9° |
| NE | CZ2 | NH2 | HH21 | 179.8° | 179.9° |
| NE | CZ2 | NH2 | HH22 | 0.2° | 0.1° |
| HE | NE | CZ2 | NH1 | 179.7° | 180.0° |
| HE | NE | CZ2 | NH2 | 0.5° | 0.2° |
| CZ2 | NH1 | HH11 | HH12 | 180.0° | 180.0° |
| NH1 | CZ2 | NH2 | HH21 | 0.0° | 0.0° |
| NH1 | CZ2 | NH2 | HH22 | 180.0° | 180.0° |
| NH2 | CZ2 | NH1 | HH11 | 0.0° | 179.9° |
| NH2 | CZ2 | NH1 | HH12 | 180.0° | 0.0° |
| CZ2 | NH2 | HH21 | HH22 | 180.0° | 180.0° |
| H11 | C3 | H21 | CL | 116.8° | 120.1° |
| H11 | C3 | C2 | H35 | 160.9° | 65.0° |
| H21 | C3 | C2 | H35 | 79.1° | 175.0° |
| CL | C3 | C2 | H35 | 40.9° | 55.0° |
| H35 | C2 | O2 | H36 | 62.5° | 180.0° |
