74P
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2 | CX2 | doub | 1.21Å | 1.21Å | |
| O6 | CX2 | sing | 1.35Å | 1.21Å | |
| CX2 | CX1 | sing | 1.48Å | 1.47Å | |
| O4 | C2 | doub | 1.21Å | 1.51Å | |
| CX1 | NZ | doub | 1.28Å | 1.25Å | |
| CX1 | C1 | sing | 1.51Å | 1.48Å | |
| NZ | CE | sing | 1.46Å | 1.42Å | |
| C2 | C1 | sing | 1.51Å | 1.50Å | |
| C2 | C3 | sing | 1.51Å | 1.52Å | |
| CD | CE | sing | 1.53Å | 1.52Å | |
| CD | CG | sing | 1.53Å | 1.53Å | |
| CB | CG | sing | 1.53Å | 1.48Å | |
| CB | CA | sing | 1.53Å | 1.53Å | |
| N | CA | sing | 1.47Å | 1.43Å | |
| CA | C | sing | 1.51Å | 1.50Å | |
| O | C | doub | 1.21Å | 1.23Å | |
| C | OXT | sing | 1.34Å | 1.43Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | H7 | sing | 1.09Å | 1.10Å | |
| CB | H8 | sing | 1.09Å | 1.10Å | |
| CG | H9 | sing | 1.09Å | 1.10Å | |
| CG | H10 | sing | 1.09Å | 1.10Å | |
| CD | H11 | sing | 1.09Å | 1.10Å | |
| CD | H12 | sing | 1.09Å | 1.10Å | |
| CE | H13 | sing | 1.09Å | 1.10Å | |
| CE | H14 | sing | 1.09Å | 1.10Å | |
| C1 | H15 | sing | 1.09Å | 1.10Å | |
| C1 | H16 | sing | 1.09Å | 1.10Å | |
| O6 | H17 | sing | 0.97Å | 0.95Å | |
| C3 | H18 | sing | 1.09Å | 1.10Å | |
| C3 | H19 | sing | 1.09Å | 1.10Å | |
| C3 | H20 | sing | 1.09Å | 1.10Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | CX2 | O6 | 115.4° | 120.0° |
| O2 | CX2 | CX1 | 123.0° | 120.0° |
| O6 | CX2 | CX1 | 121.5° | 120.0° |
| CX2 | O6 | H17 | 109.5° | 117.0° |
| CX2 | CX1 | NZ | 115.6° | 120.0° |
| CX2 | CX1 | C1 | 126.8° | 120.0° |
| O4 | C2 | C1 | 116.7° | 120.0° |
| O4 | C2 | C3 | 119.0° | 120.0° |
| NZ | CX1 | C1 | 117.6° | 120.0° |
| CX1 | NZ | CE | 131.3° | 120.0° |
| CX1 | C1 | C2 | 109.5° | 109.4° |
| CX1 | C1 | H15 | 109.5° | 109.5° |
| CX1 | C1 | H16 | 109.5° | 109.5° |
| NZ | CE | CD | 104.8° | 109.5° |
| NZ | CE | H13 | 110.6° | 109.5° |
| NZ | CE | H14 | 110.6° | 109.5° |
| C1 | C2 | C3 | 103.3° | 120.0° |
| C2 | C1 | H15 | 109.5° | 109.4° |
| C2 | C1 | H16 | 109.4° | 109.5° |
| C2 | C3 | H18 | 109.5° | 109.5° |
| C2 | C3 | H19 | 109.5° | 109.5° |
| C2 | C3 | H20 | 109.4° | 109.5° |
| CE | CD | CG | 109.6° | 109.5° |
| CE | CD | H11 | 109.4° | 109.4° |
| CE | CD | H12 | 109.5° | 109.4° |
| CD | CE | H13 | 110.6° | 109.5° |
| CD | CE | H14 | 110.6° | 109.5° |
| CD | CG | CB | 109.4° | 109.5° |
| CD | CG | H9 | 109.5° | 109.5° |
| CD | CG | H10 | 109.5° | 109.4° |
| CG | CD | H11 | 109.4° | 109.5° |
| CG | CD | H12 | 109.5° | 109.5° |
| CG | CB | CA | 111.2° | 109.5° |
| CG | CB | H7 | 109.0° | 109.4° |
| CG | CB | H8 | 109.0° | 109.4° |
| CB | CG | H9 | 109.5° | 109.5° |
| CB | CG | H10 | 109.5° | 109.5° |
| CB | CA | N | 107.9° | 109.5° |
| CB | CA | C | 114.8° | 109.4° |
| CB | CA | HA | 110.1° | 109.5° |
| CA | CB | H7 | 109.0° | 109.5° |
| CA | CB | H8 | 109.0° | 109.5° |
| N | CA | C | 101.5° | 109.5° |
| CA | N | H | 109.5° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| N | CA | HA | 111.6° | 109.5° |
| CA | C | O | 121.7° | 120.0° |
| CA | C | OXT | 111.1° | 120.0° |
| C | CA | HA | 110.6° | 109.5° |
| O | C | OXT | 127.0° | 120.0° |
| C | OXT | HXT | 109.5° | 117.0° |
| H | N | H2 | 109.5° | 111.0° |
| H7 | CB | H8 | 109.5° | 109.5° |
| H9 | CG | H10 | 109.5° | 109.5° |
| H11 | CD | H12 | 109.4° | 109.5° |
| H13 | CE | H14 | 109.5° | 109.4° |
| H15 | C1 | H16 | 109.5° | 109.5° |
| H18 | C3 | H19 | 109.4° | 109.5° |
| H18 | C3 | H20 | 109.5° | 109.4° |
| H19 | C3 | H20 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | CX2 | O6 | CX1 | 176.8° | 180.0° |
| O2 | CX2 | CX1 | NZ | 74.0° | 180.0° |
| O2 | CX2 | CX1 | C1 | 107.3° | 0.0° |
| O2 | CX2 | O6 | H17 | 0.0° | 0.1° |
| O6 | CX2 | CX1 | NZ | 102.6° | 0.0° |
| O6 | CX2 | CX1 | C1 | 76.1° | 180.0° |
| CX2 | CX1 | NZ | C1 | 178.8° | 180.0° |
| CX2 | CX1 | NZ | CE | 178.5° | 174.4° |
| CX2 | CX1 | C1 | C2 | 4.7° | 93.8° |
| CX2 | CX1 | C1 | H15 | 115.3° | 146.3° |
| CX2 | CX1 | C1 | H16 | 124.7° | 26.2° |
| CX1 | CX2 | O6 | H17 | 176.8° | 180.0° |
| O4 | C2 | C1 | CX1 | 17.3° | 0.3° |
| O4 | C2 | C1 | C3 | 132.5° | 179.7° |
| O4 | C2 | C1 | H15 | 102.7° | 119.7° |
| O4 | C2 | C1 | H16 | 137.3° | 120.3° |
| O4 | C2 | C3 | H18 | 0.0° | 179.7° |
| O4 | C2 | C3 | H19 | 120.0° | 59.7° |
| O4 | C2 | C3 | H20 | 120.0° | 60.3° |
| NZ | CX1 | C1 | C2 | 176.7° | 86.2° |
| CX1 | NZ | CE | CD | 167.3° | 175.5° |
| CX1 | NZ | CE | H13 | 48.0° | 55.5° |
| CX1 | NZ | CE | H14 | 73.5° | 64.5° |
| NZ | CX1 | C1 | H15 | 63.3° | 33.7° |
| NZ | CX1 | C1 | H16 | 56.7° | 153.8° |
| C1 | CX1 | NZ | CE | 0.3° | 5.6° |
| CX1 | C1 | C2 | H15 | 120.0° | 120.0° |
| CX1 | C1 | C2 | H16 | 120.0° | 120.0° |
| CX1 | C1 | C2 | C3 | 149.8° | 180.0° |
| CX1 | C1 | H15 | H16 | 120.0° | 120.1° |
| NZ | CE | CD | H13 | 119.3° | 120.0° |
| NZ | CE | CD | H14 | 119.3° | 120.0° |
| NZ | CE | CD | CG | 175.1° | 180.0° |
| NZ | CE | CD | H11 | 55.1° | 60.0° |
| NZ | CE | CD | H12 | 64.8° | 60.0° |
| NZ | CE | H13 | H14 | 122.2° | 120.0° |
| C2 | C1 | H15 | H16 | 120.0° | 120.0° |
| C1 | C2 | C3 | H18 | 131.1° | 0.0° |
| C1 | C2 | C3 | H19 | 11.2° | 120.0° |
| C1 | C2 | C3 | H20 | 108.9° | 120.0° |
| C3 | C2 | C1 | H15 | 29.8° | 60.0° |
| C3 | C2 | C1 | H16 | 90.2° | 60.0° |
| C2 | C3 | H18 | H19 | 120.0° | 120.0° |
| C2 | C3 | H18 | H20 | 120.0° | 120.0° |
| C2 | C3 | H19 | H20 | 120.0° | 120.0° |
| CE | CD | CG | H11 | 120.0° | 120.0° |
| CE | CD | CG | H12 | 120.1° | 119.9° |
| CE | CD | CG | CB | 169.8° | 180.0° |
| CE | CD | CG | H9 | 70.2° | 60.0° |
| CE | CD | CG | H10 | 49.8° | 60.0° |
| CE | CD | H11 | H12 | 119.9° | 119.9° |
| CD | CE | H13 | H14 | 122.1° | 120.0° |
| CD | CG | CB | H9 | 120.0° | 120.0° |
| CD | CG | CB | H10 | 120.0° | 120.0° |
| CD | CG | CB | CA | 172.6° | 180.0° |
| CD | CG | CB | H7 | 52.4° | 59.9° |
| CD | CG | CB | H8 | 67.1° | 60.0° |
| CD | CG | H9 | H10 | 120.0° | 120.0° |
| CG | CD | H11 | H12 | 119.9° | 120.1° |
| CG | CD | CE | H13 | 65.6° | 60.0° |
| CG | CD | CE | H14 | 55.9° | 60.0° |
| CG | CB | CA | H7 | 120.3° | 120.0° |
| CG | CB | CA | H8 | 120.3° | 119.9° |
| CG | CB | CA | N | 179.5° | 65.0° |
| CG | CB | CA | C | 68.2° | 175.0° |
| CG | CB | CA | HA | 57.4° | 55.0° |
| CG | CB | H7 | H8 | 119.2° | 119.9° |
| CB | CG | H9 | H10 | 120.0° | 120.0° |
| CB | CG | CD | H11 | 49.8° | 60.0° |
| CB | CG | CD | H12 | 70.1° | 60.1° |
| CB | CA | N | C | 121.0° | 119.9° |
| CB | CA | N | HA | 121.1° | 120.1° |
| CB | CA | C | HA | 125.4° | 120.0° |
| CB | CA | C | O | 43.0° | 100.0° |
| CB | CA | C | OXT | 131.7° | 80.0° |
| CB | CA | N | H | 180.0° | 176.1° |
| CB | CA | N | H2 | 60.0° | 60.0° |
| CA | CB | H7 | H8 | 119.2° | 120.1° |
| CA | CB | CG | H9 | 67.4° | 60.0° |
| CA | CB | CG | H10 | 52.7° | 60.0° |
| N | CA | C | HA | 118.6° | 120.0° |
| N | CA | C | O | 73.0° | 19.9° |
| N | CA | C | OXT | 112.3° | 160.0° |
| CA | N | H | H2 | 120.0° | 123.9° |
| N | CA | CB | H7 | 60.3° | 55.0° |
| N | CA | CB | H8 | 59.2° | 175.0° |
| CA | C | O | OXT | 173.8° | 179.9° |
| C | CA | N | H | 59.0° | 64.0° |
| C | CA | N | H2 | 61.0° | 59.9° |
| C | CA | CB | H7 | 52.0° | 65.0° |
| C | CA | CB | H8 | 171.5° | 55.1° |
| CA | C | OXT | HXT | 174.4° | 179.9° |
| O | C | CA | HA | 168.4° | 140.0° |
| O | C | OXT | HXT | 0.0° | 0.0° |
| OXT | C | CA | HA | 6.3° | 40.0° |
| H | N | CA | HA | 58.9° | 56.0° |
| H2 | N | CA | HA | 178.9° | 179.9° |
| HA | CA | CB | H7 | 177.7° | 175.0° |
| HA | CA | CB | H8 | 62.9° | 64.9° |
| H7 | CB | CG | H9 | 172.3° | 180.0° |
| H7 | CB | CG | H10 | 67.6° | 60.0° |
| H8 | CB | CG | H9 | 52.9° | 60.0° |
| H8 | CB | CG | H10 | 172.9° | 180.0° |
| H9 | CG | CD | H11 | 169.8° | 180.0° |
| H9 | CG | CD | H12 | 49.8° | 60.0° |
| H10 | CG | CD | H11 | 70.2° | 60.0° |
| H10 | CG | CD | H12 | 169.8° | 180.0° |
| H11 | CD | CE | H13 | 174.4° | 180.0° |
| H11 | CD | CE | H14 | 64.1° | 60.1° |
| H12 | CD | CE | H13 | 54.4° | 60.0° |
| H12 | CD | CE | H14 | 175.9° | 180.0° |
| H18 | C3 | H19 | H20 | 120.0° | 120.0° |
