1KM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C | doub | 1.21Å | 1.26Å | |
| OXT | C | sing | 1.34Å | 1.26Å | |
| C | CA | sing | 1.51Å | 1.53Å | |
| OAH | PAO | doub | 1.48Å | 1.60Å | |
| OAG | PAO | sing | 1.61Å | 1.59Å | |
| CA | N | sing | 1.47Å | 1.49Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CB | SAJ | sing | 1.81Å | 1.85Å | |
| PAO | OAF | sing | 1.61Å | 1.60Å | |
| PAO | CAN | sing | 1.82Å | 1.91Å | |
| SAJ | CAN | sing | 1.81Å | 1.84Å | |
| CAN | CAL | sing | 1.53Å | 1.54Å | |
| CAA | CAL | sing | 1.53Å | 1.54Å | |
| CAL | OAE | sing | 1.43Å | 1.44Å | |
| OXT | H1 | sing | 0.97Å | 0.95Å | |
| CA | H2 | sing | 1.09Å | 1.10Å | |
| N | H3 | sing | 1.01Å | 1.00Å | |
| N | H4 | sing | 1.01Å | 1.00Å | |
| CB | H6 | sing | 1.09Å | 1.10Å | |
| CB | H7 | sing | 1.09Å | 1.10Å | |
| CAN | H8 | sing | 1.09Å | 1.10Å | |
| OAG | H9 | sing | 0.97Å | 0.95Å | |
| OAF | H10 | sing | 0.97Å | 0.95Å | |
| CAL | H11 | sing | 1.09Å | 1.10Å | |
| CAA | H12 | sing | 1.09Å | 1.10Å | |
| CAA | H13 | sing | 1.09Å | 1.10Å | |
| CAA | H14 | sing | 1.09Å | 1.10Å | |
| OAE | H15 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | OXT | 125.2° | 120.0° |
| O | C | CA | 116.5° | 120.0° |
| OXT | C | CA | 116.9° | 120.0° |
| C | OXT | H1 | 109.5° | 117.0° |
| C | CA | N | 109.4° | 109.4° |
| C | CA | CB | 111.0° | 109.5° |
| C | CA | H2 | 107.5° | 109.5° |
| OAH | PAO | OAG | 113.1° | 109.5° |
| OAH | PAO | OAF | 108.7° | 109.5° |
| OAH | PAO | CAN | 103.2° | 109.5° |
| OAG | PAO | OAF | 112.2° | 109.5° |
| OAG | PAO | CAN | 109.8° | 109.5° |
| PAO | OAG | H9 | 109.5° | 114.0° |
| N | CA | CB | 113.4° | 109.5° |
| N | CA | H2 | 107.9° | 109.5° |
| CA | N | H3 | 109.5° | 111.0° |
| CA | N | H4 | 109.4° | 110.9° |
| CA | CB | SAJ | 108.6° | 109.5° |
| CB | CA | H2 | 107.4° | 109.5° |
| CA | CB | H6 | 109.7° | 109.5° |
| CA | CB | H7 | 109.7° | 109.4° |
| CB | SAJ | CAN | 112.8° | 103.0° |
| SAJ | CB | H6 | 109.7° | 109.5° |
| SAJ | CB | H7 | 109.7° | 109.5° |
| OAF | PAO | CAN | 109.4° | 109.5° |
| PAO | OAF | H10 | 109.5° | 114.0° |
| PAO | CAN | SAJ | 113.7° | 109.5° |
| PAO | CAN | CAL | 113.8° | 109.4° |
| PAO | CAN | H8 | 106.3° | 109.5° |
| SAJ | CAN | CAL | 105.7° | 109.5° |
| SAJ | CAN | H8 | 106.9° | 109.5° |
| CAN | CAL | CAA | 114.8° | 109.5° |
| CAN | CAL | OAE | 108.4° | 109.5° |
| CAL | CAN | H8 | 110.3° | 109.4° |
| CAN | CAL | H11 | 107.7° | 109.4° |
| CAA | CAL | OAE | 109.1° | 109.5° |
| CAA | CAL | H11 | 107.7° | 109.5° |
| CAL | CAA | H12 | 109.5° | 109.5° |
| CAL | CAA | H13 | 109.5° | 109.4° |
| CAL | CAA | H14 | 109.5° | 109.5° |
| OAE | CAL | H11 | 109.0° | 109.5° |
| CAL | OAE | H15 | 109.5° | 114.0° |
| H3 | N | H4 | 109.4° | 111.0° |
| H6 | CB | H7 | 109.4° | 109.4° |
| H12 | CAA | H13 | 109.4° | 109.5° |
| H12 | CAA | H14 | 109.5° | 109.5° |
| H13 | CAA | H14 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | OXT | CA | 166.6° | 179.7° |
| O | C | CA | N | 25.5° | 20.0° |
| O | C | CA | CB | 151.3° | 100.0° |
| O | C | OXT | H1 | 0.0° | 0.0° |
| O | C | CA | H2 | 91.4° | 140.0° |
| OXT | C | CA | N | 166.8° | 159.7° |
| OXT | C | CA | CB | 40.9° | 80.3° |
| OXT | C | CA | H2 | 76.3° | 39.7° |
| C | CA | N | CB | 124.5° | 120.0° |
| C | CA | N | H2 | 116.6° | 120.0° |
| C | CA | CB | H2 | 117.2° | 120.0° |
| C | CA | CB | SAJ | 165.3° | 180.0° |
| CA | C | OXT | H1 | 166.6° | 179.7° |
| C | CA | N | H3 | 180.0° | 60.0° |
| C | CA | N | H4 | 60.0° | 176.0° |
| C | CA | CB | H6 | 74.8° | 60.0° |
| C | CA | CB | H7 | 45.4° | 60.0° |
| OAH | PAO | OAG | OAF | 123.4° | 120.0° |
| OAH | PAO | OAG | CAN | 114.7° | 120.0° |
| OAH | PAO | OAF | CAN | 112.0° | 120.0° |
| OAH | PAO | CAN | SAJ | 78.4° | 75.3° |
| OAH | PAO | CAN | CAL | 160.4° | 164.7° |
| OAH | PAO | CAN | H8 | 38.9° | 44.7° |
| OAH | PAO | OAG | H9 | 0.0° | 60.0° |
| OAH | PAO | OAF | H10 | 0.0° | 173.2° |
| OAG | PAO | OAF | CAN | 122.2° | 120.0° |
| OAG | PAO | CAN | SAJ | 42.4° | 164.6° |
| OAG | PAO | CAN | CAL | 78.7° | 44.6° |
| OAG | PAO | CAN | H8 | 159.8° | 75.3° |
| OAG | PAO | OAF | H10 | 125.8° | 53.2° |
| N | CA | CB | H2 | 119.1° | 120.0° |
| N | CA | CB | SAJ | 71.1° | 60.0° |
| CA | N | H3 | H4 | 120.0° | 123.9° |
| N | CA | CB | H6 | 48.8° | 60.0° |
| N | CA | CB | H7 | 169.1° | 180.0° |
| CA | CB | SAJ | H6 | 119.9° | 120.0° |
| CA | CB | SAJ | H7 | 119.9° | 120.0° |
| CA | CB | SAJ | CAN | 86.0° | 175.3° |
| CB | CA | N | H3 | 55.5° | 60.0° |
| CB | CA | N | H4 | 175.5° | 64.0° |
| CA | CB | H6 | H7 | 120.4° | 120.0° |
| CB | SAJ | CAN | PAO | 32.6° | 166.6° |
| CB | SAJ | CAN | CAL | 158.1° | 73.4° |
| SAJ | CB | CA | H2 | 48.0° | 60.0° |
| SAJ | CB | H6 | H7 | 120.4° | 120.0° |
| CB | SAJ | CAN | H8 | 84.4° | 46.6° |
| OAF | PAO | CAN | SAJ | 166.0° | 44.6° |
| OAF | PAO | CAN | CAL | 44.9° | 75.4° |
| OAF | PAO | CAN | H8 | 76.7° | 164.7° |
| OAF | PAO | OAG | H9 | 123.4° | 60.0° |
| PAO | CAN | SAJ | CAL | 125.5° | 120.0° |
| PAO | CAN | SAJ | H8 | 117.0° | 120.0° |
| PAO | CAN | CAL | H8 | 119.3° | 119.9° |
| PAO | CAN | CAL | CAA | 56.0° | 53.8° |
| PAO | CAN | CAL | OAE | 66.3° | 66.2° |
| CAN | PAO | OAG | H9 | 114.6° | 180.0° |
| CAN | PAO | OAF | H10 | 112.0° | 66.8° |
| PAO | CAN | CAL | H11 | 175.9° | 173.8° |
| SAJ | CAN | CAL | H8 | 115.2° | 120.0° |
| SAJ | CAN | CAL | CAA | 69.5° | 66.2° |
| SAJ | CAN | CAL | OAE | 168.2° | 173.8° |
| CAN | SAJ | CB | H6 | 33.9° | 55.3° |
| CAN | SAJ | CB | H7 | 154.1° | 64.7° |
| SAJ | CAN | CAL | H11 | 50.4° | 53.8° |
| CAN | CAL | CAA | OAE | 122.0° | 120.0° |
| CAN | CAL | CAA | H11 | 119.9° | 120.0° |
| CAN | CAL | OAE | H11 | 116.9° | 120.0° |
| CAN | CAL | CAA | H12 | 180.0° | 51.2° |
| CAN | CAL | CAA | H13 | 60.0° | 171.2° |
| CAN | CAL | CAA | H14 | 60.0° | 68.9° |
| CAN | CAL | OAE | H15 | 180.0° | 55.6° |
| CAA | CAL | OAE | H11 | 117.3° | 120.0° |
| CAA | CAL | CAN | H8 | 175.3° | 173.7° |
| CAL | CAA | H12 | H13 | 120.0° | 120.0° |
| CAL | CAA | H12 | H14 | 120.0° | 120.1° |
| CAL | CAA | H13 | H14 | 120.0° | 120.0° |
| CAA | CAL | OAE | H15 | 54.3° | 175.6° |
| OAE | CAL | CAN | H8 | 52.9° | 53.7° |
| OAE | CAL | CAA | H12 | 58.0° | 171.3° |
| OAE | CAL | CAA | H13 | 62.0° | 68.7° |
| OAE | CAL | CAA | H14 | 178.1° | 51.2° |
| H2 | CA | N | H3 | 63.3° | 180.0° |
| H2 | CA | N | H4 | 56.6° | 56.1° |
| H2 | CA | CB | H6 | 167.9° | 180.0° |
| H2 | CA | CB | H7 | 71.8° | 60.0° |
| H8 | CAN | CAL | H11 | 64.8° | 66.3° |
| H11 | CAL | CAA | H12 | 60.1° | 68.7° |
| H11 | CAL | CAA | H13 | 179.9° | 51.3° |
| H11 | CAL | CAA | H14 | 59.9° | 171.2° |
| H11 | CAL | OAE | H15 | 63.0° | 64.4° |
| H12 | CAA | H13 | H14 | 120.0° | 120.0° |
