6DB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C | doub | 1.21Å | 1.25Å | |
| CB | CA | sing | 1.53Å | 1.49Å | |
| C | OXT | sing | 1.34Å | 1.26Å | |
| C | CA | sing | 1.51Å | 1.53Å | |
| CA | N | sing | 1.47Å | 1.47Å | |
| N | CAI | sing | 1.47Å | 1.46Å | |
| OAB | CAE | doub | 1.21Å | 1.26Å | |
| CAI | CAE | sing | 1.51Å | 1.51Å | |
| CAI | CAK | sing | 1.53Å | 1.55Å | |
| CAE | OAF | sing | 1.34Å | 1.26Å | |
| CAK | CAL | sing | 1.53Å | 1.52Å | |
| CAL | CAM | sing | 1.53Å | 1.53Å | |
| CAM | NAN | sing | 1.47Å | 1.49Å | |
| NAN | CAP | sing | 1.38Å | 1.43Å | |
| CAP | NAO | doub | 1.30Å | 1.31Å | |
| CAP | NAQ | sing | 1.38Å | 1.29Å | |
| CA | H1 | sing | 1.09Å | 1.10Å | |
| CB | H2 | sing | 1.09Å | 1.10Å | |
| CB | H3 | sing | 1.09Å | 1.10Å | |
| CB | H4 | sing | 1.09Å | 1.10Å | |
| N | H5 | sing | 1.01Å | 1.00Å | |
| CAI | H7 | sing | 1.09Å | 1.10Å | |
| OAF | H8 | sing | 0.97Å | 0.95Å | |
| CAK | H9 | sing | 1.09Å | 1.10Å | |
| CAK | H10 | sing | 1.09Å | 1.10Å | |
| CAL | H11 | sing | 1.09Å | 1.10Å | |
| CAL | H12 | sing | 1.09Å | 1.10Å | |
| CAM | H13 | sing | 1.09Å | 1.10Å | |
| CAM | H14 | sing | 1.09Å | 1.10Å | |
| NAN | H15 | sing | 0.97Å | 1.00Å | |
| NAO | H16 | sing | 0.97Å | 1.00Å | |
| NAQ | H18 | sing | 0.97Å | 1.00Å | |
| NAQ | H19 | sing | 0.97Å | 1.00Å | |
| OXT | H20 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | OXT | 120.6° | 120.0° |
| O | C | CA | 118.2° | 120.0° |
| CB | CA | C | 110.4° | 109.5° |
| CB | CA | N | 110.2° | 109.4° |
| CB | CA | H1 | 107.8° | 109.5° |
| CA | CB | H2 | 109.5° | 109.5° |
| CA | CB | H3 | 109.5° | 109.5° |
| CA | CB | H4 | 109.5° | 109.5° |
| OXT | C | CA | 121.2° | 120.0° |
| C | OXT | H20 | 109.5° | 117.0° |
| C | CA | N | 112.9° | 109.5° |
| C | CA | H1 | 107.3° | 109.5° |
| CA | N | CAI | 117.8° | 111.0° |
| N | CA | H1 | 108.1° | 109.5° |
| CA | N | H5 | 107.3° | 111.0° |
| N | CAI | CAE | 111.0° | 109.5° |
| N | CAI | CAK | 115.5° | 109.5° |
| CAI | N | H5 | 107.4° | 111.0° |
| N | CAI | H7 | 108.2° | 109.5° |
| OAB | CAE | CAI | 120.5° | 120.0° |
| OAB | CAE | OAF | 120.2° | 120.0° |
| CAE | CAI | CAK | 107.0° | 109.4° |
| CAI | CAE | OAF | 119.2° | 120.0° |
| CAE | CAI | H7 | 107.6° | 109.5° |
| CAI | CAK | CAL | 113.2° | 109.5° |
| CAK | CAI | H7 | 107.2° | 109.5° |
| CAI | CAK | H9 | 108.5° | 109.5° |
| CAI | CAK | H10 | 108.5° | 109.5° |
| CAE | OAF | H8 | 109.5° | 117.1° |
| CAK | CAL | CAM | 116.3° | 109.5° |
| CAL | CAK | H9 | 108.5° | 109.4° |
| CAL | CAK | H10 | 108.5° | 109.4° |
| CAK | CAL | H11 | 107.7° | 109.5° |
| CAK | CAL | H12 | 107.7° | 109.5° |
| CAL | CAM | NAN | 108.6° | 109.4° |
| CAM | CAL | H11 | 107.7° | 109.4° |
| CAM | CAL | H12 | 107.7° | 109.5° |
| CAL | CAM | H13 | 109.7° | 109.4° |
| CAL | CAM | H14 | 109.7° | 109.5° |
| CAM | NAN | CAP | 124.8° | 120.0° |
| NAN | CAM | H13 | 109.7° | 109.5° |
| NAN | CAM | H14 | 109.7° | 109.5° |
| CAM | NAN | H15 | 117.6° | 120.0° |
| NAN | CAP | NAO | 120.0° | 120.0° |
| NAN | CAP | NAQ | 117.7° | 119.9° |
| CAP | NAN | H15 | 117.6° | 120.0° |
| NAO | CAP | NAQ | 122.2° | 120.1° |
| CAP | NAO | H16 | 112.0° | 120.0° |
| CAP | NAQ | H18 | 120.0° | 120.0° |
| CAP | NAQ | H19 | 120.0° | 120.0° |
| H2 | CB | H3 | 109.5° | 109.4° |
| H2 | CB | H4 | 109.5° | 109.4° |
| H3 | CB | H4 | 109.4° | 109.5° |
| H9 | CAK | H10 | 109.4° | 109.5° |
| H11 | CAL | H12 | 109.5° | 109.5° |
| H13 | CAM | H14 | 109.5° | 109.5° |
| H18 | NAQ | H19 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | CA | CB | 97.1° | 120.0° |
| O | C | OXT | CA | 179.4° | 179.7° |
| O | C | CA | N | 26.8° | 0.0° |
| O | C | CA | H1 | 145.7° | 120.0° |
| O | C | OXT | H20 | 0.0° | 0.0° |
| CB | CA | C | OXT | 83.5° | 60.3° |
| CB | CA | C | N | 123.9° | 120.0° |
| CB | CA | C | H1 | 117.2° | 120.0° |
| CB | CA | N | H1 | 117.5° | 120.0° |
| CB | CA | N | CAI | 177.8° | 85.0° |
| CA | CB | H2 | H3 | 120.0° | 120.0° |
| CA | CB | H2 | H4 | 120.0° | 120.0° |
| CA | CB | H3 | H4 | 120.0° | 120.1° |
| CB | CA | N | H5 | 61.0° | 38.9° |
| OXT | C | CA | N | 152.6° | 179.7° |
| OXT | C | CA | H1 | 33.7° | 59.7° |
| C | CA | N | H1 | 118.5° | 120.1° |
| C | CA | N | CAI | 53.8° | 155.0° |
| C | CA | CB | H2 | 180.0° | 60.0° |
| C | CA | CB | H3 | 60.0° | 180.0° |
| C | CA | CB | H4 | 60.0° | 60.0° |
| C | CA | N | H5 | 175.0° | 81.0° |
| CA | C | OXT | H20 | 179.3° | 179.7° |
| CA | N | CAI | H5 | 121.2° | 124.0° |
| CA | N | CAI | CAE | 170.1° | 85.0° |
| CA | N | CAI | CAK | 48.1° | 155.0° |
| N | CA | CB | H2 | 54.6° | 60.0° |
| N | CA | CB | H3 | 174.6° | 60.0° |
| N | CA | CB | H4 | 65.4° | 180.0° |
| CA | N | CAI | H7 | 72.0° | 35.0° |
| N | CAI | CAE | OAB | 5.2° | 0.0° |
| N | CAI | CAE | CAK | 126.8° | 120.0° |
| N | CAI | CAE | H7 | 118.3° | 120.0° |
| N | CAI | CAK | H7 | 120.7° | 120.0° |
| N | CAI | CAE | OAF | 176.2° | 180.0° |
| N | CAI | CAK | CAL | 62.6° | 65.0° |
| CAI | N | CA | H1 | 64.7° | 35.0° |
| N | CAI | CAK | H9 | 176.9° | 55.0° |
| N | CAI | CAK | H10 | 58.0° | 175.0° |
| OAB | CAE | CAI | OAF | 178.6° | 180.0° |
| OAB | CAE | CAI | CAK | 121.6° | 120.0° |
| OAB | CAE | CAI | H7 | 123.5° | 120.0° |
| OAB | CAE | OAF | H8 | 0.0° | 0.0° |
| CAE | CAI | CAK | H7 | 115.2° | 120.0° |
| CAE | CAI | CAK | CAL | 61.6° | 175.0° |
| CAE | CAI | N | H5 | 48.9° | 151.1° |
| CAI | CAE | OAF | H8 | 178.6° | 180.0° |
| CAE | CAI | CAK | H9 | 59.0° | 65.0° |
| CAE | CAI | CAK | H10 | 177.8° | 55.0° |
| CAK | CAI | CAE | OAF | 57.0° | 60.0° |
| CAI | CAK | CAL | H9 | 120.6° | 120.0° |
| CAI | CAK | CAL | H10 | 120.6° | 120.0° |
| CAI | CAK | CAL | CAM | 178.4° | 180.0° |
| CAK | CAI | N | H5 | 73.1° | 31.1° |
| CAI | CAK | H9 | H10 | 118.3° | 120.1° |
| CAI | CAK | CAL | H11 | 60.6° | 60.0° |
| CAI | CAK | CAL | H12 | 57.4° | 60.0° |
| OAF | CAE | CAI | H7 | 57.9° | 60.0° |
| CAK | CAL | CAM | H11 | 121.0° | 120.0° |
| CAK | CAL | CAM | H12 | 121.0° | 120.0° |
| CAK | CAL | CAM | NAN | 159.2° | 180.0° |
| CAL | CAK | CAI | H7 | 176.8° | 55.0° |
| CAL | CAK | H9 | H10 | 118.3° | 119.9° |
| CAK | CAL | H11 | H12 | 116.9° | 120.0° |
| CAK | CAL | CAM | H13 | 81.0° | 60.0° |
| CAK | CAL | CAM | H14 | 39.3° | 60.0° |
| CAL | CAM | NAN | H13 | 119.9° | 119.9° |
| CAL | CAM | NAN | H14 | 119.9° | 120.0° |
| CAL | CAM | NAN | CAP | 167.6° | 180.0° |
| CAM | CAL | CAK | H9 | 57.8° | 60.0° |
| CAM | CAL | CAK | H10 | 61.0° | 60.0° |
| CAM | CAL | H11 | H12 | 116.9° | 120.0° |
| CAL | CAM | H13 | H14 | 120.4° | 120.0° |
| CAL | CAM | NAN | H15 | 12.4° | 0.0° |
| CAM | NAN | CAP | H15 | 180.0° | 180.0° |
| CAM | NAN | CAP | NAO | 179.2° | 0.0° |
| CAM | NAN | CAP | NAQ | 4.7° | 180.0° |
| NAN | CAM | CAL | H11 | 38.2° | 60.0° |
| NAN | CAM | CAL | H12 | 79.9° | 60.0° |
| NAN | CAM | H13 | H14 | 120.4° | 120.1° |
| NAN | CAP | NAO | NAQ | 176.0° | 180.0° |
| CAP | NAN | CAM | H13 | 72.5° | 60.0° |
| CAP | NAN | CAM | H14 | 47.7° | 60.0° |
| NAN | CAP | NAO | H16 | 176.0° | 180.0° |
| NAN | CAP | NAQ | H18 | 176.0° | 0.0° |
| NAN | CAP | NAQ | H19 | 4.0° | 180.0° |
| NAO | CAP | NAN | H15 | 0.8° | 180.0° |
| NAO | CAP | NAQ | H18 | 0.0° | 180.0° |
| NAO | CAP | NAQ | H19 | 180.0° | 0.1° |
| NAQ | CAP | NAN | H15 | 175.3° | 0.0° |
| NAQ | CAP | NAO | H16 | 0.0° | 0.1° |
| CAP | NAQ | H18 | H19 | 180.0° | 180.0° |
| H1 | CA | CB | H2 | 63.1° | 180.0° |
| H1 | CA | CB | H3 | 56.9° | 60.0° |
| H1 | CA | CB | H4 | 176.9° | 60.0° |
| H1 | CA | N | H5 | 56.5° | 158.9° |
| H2 | CB | H3 | H4 | 120.0° | 119.9° |
| H5 | N | CAI | H7 | 166.8° | 88.9° |
| H7 | CAI | CAK | H9 | 56.2° | 175.0° |
| H7 | CAI | CAK | H10 | 62.6° | 65.0° |
| H9 | CAK | CAL | H11 | 178.8° | 180.0° |
| H9 | CAK | CAL | H12 | 63.2° | 60.0° |
| H10 | CAK | CAL | H11 | 60.0° | 60.0° |
| H10 | CAK | CAL | H12 | 178.0° | 180.0° |
| H11 | CAL | CAM | H13 | 158.0° | 180.0° |
| H11 | CAL | CAM | H14 | 81.7° | 60.0° |
| H12 | CAL | CAM | H13 | 40.0° | 60.0° |
| H12 | CAL | CAM | H14 | 160.3° | NaN° |
| H13 | CAM | NAN | H15 | 107.5° | 120.0° |
| H14 | CAM | NAN | H15 | 132.3° | 120.0° |
