MIR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CA | N | sing | 1.47Å | 1.44Å | |
| N | HN | sing | 1.01Å | 1.00Å | |
| N | HNA | sing | 1.01Å | 1.00Å | |
| C | CA | sing | 1.51Å | 1.48Å | |
| CB | CA | sing | 1.53Å | 1.53Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| CB | OG | sing | 1.43Å | 1.45Å | |
| CB | HB | sing | 1.09Å | 1.10Å | |
| CB | HBA | sing | 1.09Å | 1.10Å | |
| OG | P | sing | 1.61Å | 1.56Å | |
| O2P | P | doub | 1.48Å | 1.56Å | |
| P | O1P | sing | 1.61Å | 1.62Å | |
| P | O3P | sing | 1.61Å | 1.55Å | |
| O1P | HO1P | sing | 0.97Å | 0.95Å | |
| O3P | C1 | sing | 1.43Å | 1.43Å | |
| C1 | C2 | sing | 1.53Å | 1.54Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C2 | H2B | sing | 1.09Å | 1.10Å | |
| O | C | doub | 1.21Å | 1.23Å | |
| C | OXT | sing | 1.34Å | 1.34Å | |
| OXT | HOXT | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA | N | HN | 109.5° | 111.0° |
| CA | N | HNA | 109.5° | 111.0° |
| N | CA | C | 115.1° | 109.5° |
| N | CA | CB | 113.3° | 109.5° |
| N | CA | HA | 102.0° | 109.5° |
| HN | N | HNA | 109.5° | 111.1° |
| C | CA | CB | 108.0° | 109.4° |
| C | CA | HA | 108.1° | 109.5° |
| CA | C | O | 117.3° | 120.0° |
| CA | C | OXT | 119.2° | 120.0° |
| CB | CA | HA | 110.1° | 109.5° |
| CA | CB | OG | 109.5° | 109.5° |
| CA | CB | HB | 109.4° | 109.5° |
| CA | CB | HBA | 109.5° | 109.5° |
| OG | CB | HB | 109.4° | 109.5° |
| OG | CB | HBA | 109.4° | 109.4° |
| CB | OG | P | 117.6° | 123.0° |
| HB | CB | HBA | 109.5° | 109.5° |
| OG | P | O2P | 104.2° | 109.5° |
| OG | P | O1P | 113.8° | 109.4° |
| OG | P | O3P | 105.0° | 109.5° |
| O2P | P | O1P | 113.5° | 109.5° |
| O2P | P | O3P | 103.1° | 109.5° |
| O1P | P | O3P | 115.9° | 109.5° |
| P | O1P | HO1P | 109.5° | 114.0° |
| P | O3P | C1 | 120.3° | 123.0° |
| O3P | C1 | C2 | 104.1° | 109.5° |
| O3P | C1 | H1 | 111.3° | 109.5° |
| O3P | C1 | H1A | 112.5° | 109.5° |
| C2 | C1 | H1 | 111.3° | 109.5° |
| C2 | C1 | H1A | 112.5° | 109.4° |
| C1 | C2 | H2 | 109.5° | 109.5° |
| C1 | C2 | H2A | 109.4° | 109.5° |
| C1 | C2 | H2B | 109.4° | 109.5° |
| H1 | C1 | H1A | 105.4° | 109.5° |
| H2 | C2 | H2A | 109.5° | 109.5° |
| H2 | C2 | H2B | 109.5° | 109.5° |
| H2A | C2 | H2B | 109.5° | 109.5° |
| O | C | OXT | 123.4° | 120.0° |
| C | OXT | HOXT | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA | N | HN | HNA | 120.0° | 124.0° |
| N | CA | C | CB | 127.7° | 120.0° |
| N | CA | C | HA | 113.3° | 120.1° |
| N | CA | CB | HA | 113.5° | 120.0° |
| N | CA | CB | OG | 60.8° | 65.1° |
| N | CA | CB | HB | 179.2° | 54.9° |
| N | CA | CB | HBA | 59.1° | 175.0° |
| N | CA | C | O | 158.9° | 20.0° |
| N | CA | C | OXT | 19.4° | 160.0° |
| HN | N | CA | C | 78.3° | 64.0° |
| HN | N | CA | CB | 46.6° | 176.0° |
| HN | N | CA | HA | 164.9° | 56.0° |
| HNA | N | CA | C | 161.7° | 60.0° |
| HNA | N | CA | CB | 73.4° | 59.9° |
| HNA | N | CA | HA | 44.9° | 180.0° |
| C | CA | CB | HA | 117.8° | 120.0° |
| C | CA | CB | OG | 67.8° | 175.0° |
| C | CA | CB | HB | 52.1° | 65.1° |
| C | CA | CB | HBA | 172.2° | 55.0° |
| CA | C | O | OXT | 178.2° | 180.0° |
| CA | C | OXT | HOXT | 178.1° | 180.0° |
| CA | CB | OG | HB | 120.0° | 120.0° |
| CA | CB | OG | HBA | 120.0° | 120.0° |
| CA | CB | HB | HBA | 120.0° | 120.0° |
| CA | CB | OG | P | 106.2° | 180.0° |
| CB | CA | C | O | 73.5° | 100.0° |
| CB | CA | C | OXT | 108.3° | 80.0° |
| HA | CA | CB | OG | 174.4° | 55.0° |
| HA | CA | CB | HB | 65.6° | 175.0° |
| HA | CA | CB | HBA | 54.4° | 64.9° |
| HA | CA | C | O | 45.6° | 140.0° |
| HA | CA | C | OXT | 132.6° | 39.9° |
| OG | CB | HB | HBA | 120.0° | 120.0° |
| CB | OG | P | O2P | 76.8° | 55.0° |
| CB | OG | P | O1P | 47.4° | 65.1° |
| CB | OG | P | O3P | 175.2° | 175.0° |
| HB | CB | OG | P | 133.8° | 60.0° |
| HBA | CB | OG | P | 13.8° | 60.1° |
| OG | P | O2P | O1P | 124.4° | 120.0° |
| OG | P | O2P | O3P | 109.4° | 120.0° |
| OG | P | O1P | O3P | 121.9° | 120.0° |
| OG | P | O1P | HO1P | 146.5° | 60.0° |
| OG | P | O3P | C1 | 78.2° | 175.0° |
| O2P | P | O1P | O3P | 119.1° | 120.1° |
| O2P | P | O1P | HO1P | 94.4° | 180.0° |
| O2P | P | O3P | C1 | 172.9° | 55.0° |
| O1P | P | O3P | C1 | 48.3° | 65.1° |
| O3P | P | O1P | HO1P | 24.6° | 59.9° |
| P | O3P | C1 | C2 | 154.0° | 180.0° |
| P | O3P | C1 | H1 | 86.1° | 60.0° |
| P | O3P | C1 | H1A | 31.9° | 60.0° |
| O3P | C1 | C2 | H1 | 120.0° | 120.0° |
| O3P | C1 | C2 | H1A | 122.0° | 120.0° |
| O3P | C1 | H1 | H1A | 122.2° | 120.0° |
| O3P | C1 | C2 | H2 | 56.3° | 60.0° |
| O3P | C1 | C2 | H2A | 63.7° | 60.0° |
| O3P | C1 | C2 | H2B | 176.3° | 179.9° |
| C2 | C1 | H1 | H1A | 122.2° | 120.0° |
| C1 | C2 | H2 | H2A | 120.0° | 120.0° |
| C1 | C2 | H2 | H2B | 120.0° | 120.0° |
| C1 | C2 | H2A | H2B | 120.0° | 120.0° |
| H1 | C1 | C2 | H2 | 176.3° | 180.0° |
| H1 | C1 | C2 | H2A | 56.3° | 60.0° |
| H1 | C1 | C2 | H2B | 63.7° | 60.0° |
| H1A | C1 | C2 | H2 | 65.8° | 60.0° |
| H1A | C1 | C2 | H2A | 174.3° | 180.0° |
| H1A | C1 | C2 | H2B | 54.2° | 59.9° |
| H2 | C2 | H2A | H2B | 120.1° | 120.0° |
| O | C | OXT | HOXT | 0.0° | 0.0° |
