| REMARK 1 CREATED WITH OPENMM 7.7, 2022-12-15 | |
| ATOM 1 N ASP A 1 3.326 1.548 0.000 1.00 0.00 N | |
| ATOM 2 H2 ASP A 1 2.483 1.311 0.827 1.00 0.00 H | |
| ATOM 3 H3 ASP A 1 2.652 1.443 -0.994 1.00 0.00 H | |
| ATOM 4 H ASP A 1 3.909 0.724 0.000 1.00 0.00 H | |
| ATOM 5 CA ASP A 1 3.970 2.846 0.000 1.00 0.00 C | |
| ATOM 6 HA ASP A 1 3.672 3.400 -0.890 1.00 0.00 H | |
| ATOM 7 CB ASP A 1 3.577 3.654 1.232 1.00 0.00 C | |
| ATOM 8 HB2 ASP A 1 2.497 3.801 1.241 1.00 0.00 H | |
| ATOM 9 HB3 ASP A 1 3.877 3.116 2.131 1.00 0.00 H | |
| ATOM 10 CG ASP A 1 4.275 5.011 1.195 1.00 0.00 C | |
| ATOM 11 OD1 ASP A 1 3.669 5.955 0.620 1.00 0.00 O | |
| ATOM 12 OD2 ASP A 1 5.408 5.092 1.741 1.00 0.00 O | |
| ATOM 13 C ASP A 1 5.486 2.705 0.000 1.00 0.00 C | |
| ATOM 14 O ASP A 1 6.009 1.593 0.000 1.00 0.00 O | |
| ATOM 15 N PRO A 2 6.191 3.839 0.000 1.00 0.00 N | |
| ATOM 16 CD PRO A 2 5.547 5.147 0.000 1.00 0.00 C | |
| ATOM 17 HD2 PRO A 2 5.240 5.401 1.014 1.00 0.00 H | |
| ATOM 18 HD3 PRO A 2 4.672 5.121 -0.649 1.00 0.00 H | |
| ATOM 19 CG PRO A 2 6.620 6.056 -0.522 1.00 0.00 C | |
| ATOM 20 HG2 PRO A 2 6.576 7.003 0.016 1.00 0.00 H | |
| ATOM 21 HG3 PRO A 2 6.470 6.237 -1.586 1.00 0.00 H | |
| ATOM 22 CB PRO A 2 7.927 5.342 -0.276 1.00 0.00 C | |
| ATOM 23 HB2 PRO A 2 8.424 5.789 0.586 1.00 0.00 H | |
| ATOM 24 HB3 PRO A 2 8.564 5.445 -1.155 1.00 0.00 H | |
| ATOM 25 CA PRO A 2 7.642 3.839 0.000 1.00 0.00 C | |
| ATOM 26 HA PRO A 2 8.040 3.343 -0.886 1.00 0.00 H | |
| ATOM 27 C PRO A 2 8.189 3.161 1.248 1.00 0.00 C | |
| ATOM 28 O PRO A 2 7.426 2.647 2.064 1.00 0.00 O | |
| ATOM 29 N ALA A 3 9.515 3.161 1.396 1.00 0.00 N | |
| ATOM 30 H ALA A 3 10.101 3.596 0.698 1.00 0.00 H | |
| ATOM 31 CA ALA A 3 10.158 2.548 2.541 1.00 0.00 C | |
| ATOM 32 HA ALA A 3 9.811 3.031 3.455 1.00 0.00 H | |
| ATOM 33 CB ALA A 3 9.833 1.060 2.622 1.00 0.00 C | |
| ATOM 34 HB1 ALA A 3 10.183 0.562 1.718 1.00 0.00 H | |
| ATOM 35 HB2 ALA A 3 10.329 0.627 3.491 1.00 0.00 H | |
| ATOM 36 HB3 ALA A 3 8.755 0.928 2.716 1.00 0.00 H | |
| ATOM 37 C ALA A 3 11.671 2.690 2.461 1.00 0.00 C | |
| ATOM 38 O ALA A 3 12.194 3.267 1.510 1.00 0.00 O | |
| ATOM 39 N SER A 4 12.375 2.162 3.465 1.00 0.00 N | |
| ATOM 40 H SER A 4 11.900 1.698 4.226 1.00 0.00 H | |
| ATOM 41 CA SER A 4 13.822 2.231 3.505 1.00 0.00 C | |
| ATOM 42 HA SER A 4 14.235 1.732 2.629 1.00 0.00 H | |
| ATOM 43 CB SER A 4 14.303 3.679 3.512 1.00 0.00 C | |
| ATOM 44 HB2 SER A 4 13.955 4.182 2.610 1.00 0.00 H | |
| ATOM 45 HB3 SER A 4 13.905 4.190 4.389 1.00 0.00 H | |
| ATOM 46 OG SER A 4 15.732 3.706 3.552 1.00 0.00 O | |
| ATOM 47 HG SER A 4 16.034 4.617 3.557 1.00 0.00 H | |
| ATOM 48 C SER A 4 14.369 1.554 4.754 1.00 0.00 C | |
| ATOM 49 O SER A 4 13.606 1.040 5.569 1.00 0.00 O | |
| ATOM 50 OXT SER A 4 15.657 1.597 4.721 1.00 0.00 O | |
| TER 51 SER A 4 | |
| END | |