08M
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | CA | sing | 1.47Å | 1.48Å | |
| O | C | doub | 1.21Å | 1.25Å | |
| C | CA | sing | 1.51Å | 1.53Å | |
| CA | C31 | sing | 1.53Å | 1.49Å | |
| C31 | C32 | sing | 1.53Å | 1.53Å | |
| C32 | C33 | sing | 1.53Å | 1.50Å | |
| C33 | N34 | sing | 1.47Å | 1.45Å | |
| N34 | C35 | sing | 1.35Å | 1.46Å | |
| N38 | C39 | doub | 1.32Å | 1.32Å | Aromatic |
| N38 | C37 | sing | 1.33Å | 1.35Å | Aromatic |
| C39 | C40 | sing | 1.39Å | 1.38Å | Aromatic |
| C35 | C37 | sing | 1.48Å | 1.51Å | |
| C35 | O36 | doub | 1.21Å | 1.20Å | |
| C37 | C42 | doub | 1.39Å | 1.38Å | Aromatic |
| C40 | N41 | doub | 1.32Å | 1.33Å | Aromatic |
| C42 | N41 | sing | 1.32Å | 1.36Å | Aromatic |
| CA | HA | sing | 1.09Å | 1.10Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| C31 | H24 | sing | 1.09Å | 1.10Å | |
| C31 | H25 | sing | 1.09Å | 1.10Å | |
| C32 | H26 | sing | 1.09Å | 1.10Å | |
| C32 | H27 | sing | 1.09Å | 1.10Å | |
| C33 | H28 | sing | 1.09Å | 1.10Å | |
| C33 | H29 | sing | 1.09Å | 1.10Å | |
| N34 | H30 | sing | 0.97Å | 1.00Å | |
| C39 | H31 | sing | 1.08Å | 1.08Å | |
| C40 | H32 | sing | 1.08Å | 1.08Å | |
| C42 | H33 | sing | 1.08Å | 1.08Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| C | OXT | sing | 1.34Å | 73.29Å | |
| OXT | HXT | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N | CA | C | 107.6° | 109.4° |
| N | CA | C31 | 110.0° | 109.5° |
| N | CA | HA | 109.7° | 109.4° |
| CA | N | H | 109.5° | 111.0° |
| CA | N | H2 | 109.4° | 111.0° |
| O | C | CA | 106.5° | 120.0° |
| O | C | OXT | 80.2° | 120.0° |
| C | CA | C31 | 111.0° | 109.5° |
| C | CA | HA | 109.0° | 109.5° |
| CA | C | OXT | 28.4° | 120.0° |
| CA | C31 | C32 | 110.7° | 109.5° |
| C31 | CA | HA | 109.5° | 109.5° |
| CA | C31 | H24 | 109.2° | 109.5° |
| CA | C31 | H25 | 109.1° | 109.5° |
| C31 | C32 | C33 | 107.4° | 109.5° |
| C32 | C31 | H24 | 109.2° | 109.4° |
| C32 | C31 | H25 | 109.2° | 109.5° |
| C31 | C32 | H26 | 110.0° | 109.5° |
| C31 | C32 | H27 | 110.0° | 109.4° |
| C32 | C33 | N34 | 109.2° | 109.5° |
| C33 | C32 | H26 | 110.0° | 109.4° |
| C33 | C32 | H27 | 110.0° | 109.5° |
| C32 | C33 | H28 | 109.5° | 109.5° |
| C32 | C33 | H29 | 109.5° | 109.5° |
| C33 | N34 | C35 | 121.2° | 120.0° |
| N34 | C33 | H28 | 109.5° | 109.5° |
| N34 | C33 | H29 | 109.5° | 109.5° |
| C33 | N34 | H30 | 119.4° | 120.0° |
| N34 | C35 | C37 | 117.0° | 119.9° |
| N34 | C35 | O36 | 120.8° | 120.0° |
| C35 | N34 | H30 | 119.4° | 120.1° |
| C39 | N38 | C37 | 116.8° | 120.0° |
| N38 | C39 | C40 | 119.4° | 120.1° |
| N38 | C39 | H31 | 120.3° | 120.0° |
| N38 | C37 | C35 | 117.9° | 120.1° |
| N38 | C37 | C42 | 122.3° | 119.8° |
| C39 | C40 | N41 | 119.7° | 120.2° |
| C40 | C39 | H31 | 120.3° | 119.9° |
| C39 | C40 | H32 | 120.2° | 119.9° |
| C37 | C35 | O36 | 120.1° | 120.0° |
| C35 | C37 | C42 | 119.2° | 120.1° |
| C37 | C42 | N41 | 117.4° | 119.8° |
| C37 | C42 | H33 | 121.3° | 120.1° |
| C40 | N41 | C42 | 119.7° | 120.1° |
| N41 | C40 | H32 | 120.2° | 119.9° |
| N41 | C42 | H33 | 121.3° | 120.1° |
| H | N | H2 | 109.5° | 111.0° |
| H24 | C31 | H25 | 109.5° | 109.4° |
| H26 | C32 | H27 | 109.5° | 109.5° |
| H28 | C33 | H29 | 109.5° | 109.4° |
| C | OXT | HXT | 90.0° | 117.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N | CA | C | O | 48.0° | 20.4° |
| N | CA | C | C31 | 120.3° | 120.0° |
| N | CA | C | HA | 118.9° | 119.9° |
| N | CA | C31 | HA | 120.6° | 120.0° |
| N | CA | C31 | C32 | 65.2° | 65.0° |
| CA | N | H | H2 | 120.0° | 124.0° |
| N | CA | C31 | H24 | 55.0° | 55.0° |
| N | CA | C31 | H25 | 174.6° | 175.0° |
| N | CA | C | OXT | 24.9° | 160.0° |
| O | C | CA | OXT | 23.1° | 179.7° |
| O | C | CA | C31 | 72.4° | 99.7° |
| O | C | CA | HA | 166.9° | 140.3° |
| O | C | OXT | HXT | 90.0° | 0.3° |
| C | CA | C31 | HA | 120.5° | 120.0° |
| C | CA | C31 | C32 | 175.9° | 175.0° |
| C | CA | N | H | 180.0° | 63.9° |
| C | CA | C31 | H24 | 63.9° | 65.0° |
| C | CA | C31 | H25 | 55.7° | 55.0° |
| C | CA | N | H2 | 60.0° | 60.1° |
| CA | C | OXT | HXT | 90.0° | 180.0° |
| CA | C31 | C32 | H24 | 120.2° | 120.1° |
| CA | C31 | C32 | H25 | 120.2° | 120.0° |
| CA | C31 | C32 | C33 | 158.8° | 180.0° |
| C31 | CA | N | H | 59.0° | 176.1° |
| CA | C31 | H24 | H25 | 119.4° | 120.0° |
| CA | C31 | C32 | H26 | 39.1° | 60.0° |
| CA | C31 | C32 | H27 | 81.6° | 60.0° |
| C31 | CA | N | H2 | 179.0° | 60.0° |
| C31 | CA | C | OXT | 95.4° | 80.0° |
| C31 | C32 | C33 | H26 | 119.7° | 120.0° |
| C31 | C32 | C33 | H27 | 119.7° | 120.0° |
| C31 | C32 | C33 | N34 | 145.5° | 180.0° |
| C32 | C31 | CA | HA | 55.4° | 55.0° |
| C32 | C31 | H24 | H25 | 119.5° | 119.9° |
| C31 | C32 | H26 | H27 | 120.9° | 120.0° |
| C31 | C32 | C33 | H28 | 25.6° | 59.9° |
| C31 | C32 | C33 | H29 | 94.5° | 60.0° |
| C32 | C33 | N34 | H28 | 119.9° | 120.0° |
| C32 | C33 | N34 | H29 | 120.0° | 120.0° |
| C32 | C33 | N34 | C35 | 139.8° | 180.0° |
| C33 | C32 | C31 | H24 | 81.1° | 59.9° |
| C33 | C32 | C31 | H25 | 38.6° | 60.0° |
| C33 | C32 | H26 | H27 | 120.9° | 120.0° |
| C32 | C33 | H28 | H29 | 120.1° | 120.0° |
| C32 | C33 | N34 | H30 | 40.1° | 0.0° |
| C33 | N34 | C35 | H30 | 180.0° | 180.0° |
| C33 | N34 | C35 | C37 | 175.9° | 180.0° |
| C33 | N34 | C35 | O36 | 12.4° | 0.0° |
| N34 | C33 | C32 | H26 | 94.8° | 60.0° |
| N34 | C33 | C32 | H27 | 25.9° | 60.0° |
| N34 | C33 | H28 | H29 | 120.1° | 120.0° |
| N34 | C35 | C37 | N38 | 12.5° | 0.3° |
| N34 | C35 | C37 | O36 | 163.6° | 180.0° |
| N34 | C35 | C37 | C42 | 158.9° | 180.0° |
| C35 | N34 | C33 | H28 | 100.2° | 60.0° |
| C35 | N34 | C33 | H29 | 19.9° | 60.0° |
| N38 | C39 | C40 | H31 | 180.0° | 180.0° |
| C39 | N38 | C37 | C35 | 173.8° | 180.0° |
| C39 | N38 | C37 | C42 | 15.1° | 0.3° |
| N38 | C39 | C40 | N41 | 24.2° | 0.0° |
| N38 | C39 | C40 | H32 | 155.8° | 180.0° |
| C37 | N38 | C39 | C40 | 23.0° | 0.0° |
| N38 | C37 | C35 | C42 | 171.3° | 179.7° |
| N38 | C37 | C35 | O36 | 176.1° | 179.7° |
| N38 | C37 | C42 | N41 | 7.3° | 0.5° |
| C37 | N38 | C39 | H31 | 157.0° | 180.0° |
| N38 | C37 | C42 | H33 | 172.7° | 179.7° |
| C39 | C40 | N41 | H32 | 180.0° | 179.9° |
| C39 | C40 | N41 | C42 | 15.9° | 0.3° |
| C35 | C37 | C42 | N41 | 178.2° | 179.8° |
| C37 | C35 | N34 | H30 | 4.1° | 0.0° |
| C35 | C37 | C42 | H33 | 1.8° | 0.0° |
| O36 | C35 | C37 | C42 | 4.7° | 0.0° |
| O36 | C35 | N34 | H30 | 167.6° | 180.0° |
| C37 | C42 | N41 | C40 | 7.6° | 0.5° |
| C37 | C42 | N41 | H33 | 180.0° | 179.8° |
| N41 | C40 | C39 | H31 | 155.8° | 180.0° |
| C40 | N41 | C42 | H33 | 172.4° | 179.7° |
| C42 | N41 | C40 | H32 | 164.1° | 179.8° |
| HA | CA | N | H | 61.5° | 56.0° |
| HA | CA | C31 | H24 | 175.6° | 175.0° |
| HA | CA | C31 | H25 | 64.8° | 65.0° |
| HA | CA | N | H2 | 58.5° | 180.0° |
| HA | CA | C | OXT | 143.8° | 40.0° |
| H24 | C31 | C32 | H26 | 159.3° | 179.9° |
| H24 | C31 | C32 | H27 | 38.6° | 60.1° |
| H25 | C31 | C32 | H26 | 81.1° | 60.0° |
| H25 | C31 | C32 | H27 | 158.3° | 180.0° |
| H26 | C32 | C33 | H28 | 145.3° | 180.0° |
| H26 | C32 | C33 | H29 | 25.2° | 60.0° |
| H27 | C32 | C33 | H28 | 94.1° | 60.0° |
| H27 | C32 | C33 | H29 | 145.8° | 180.0° |
| H28 | C33 | N34 | H30 | 79.8° | 120.0° |
| H29 | C33 | N34 | H30 | 160.1° | 120.0° |
| H31 | C39 | C40 | H32 | 24.2° | 0.1° |
