| REMARK 1 CREATED WITH OPENMM 7.7, 2022-11-04 | |
| ATOM 1 N ASP A 1 3.326 1.548 0.000 1.00 0.00 N | |
| ATOM 2 H2 ASP A 1 2.640 1.443 -0.986 1.00 0.00 H | |
| ATOM 3 H3 ASP A 1 2.492 1.313 0.835 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 ILE A 2 6.191 3.839 0.000 1.00 0.00 N | |
| ATOM 16 H ILE A 2 5.715 4.730 0.000 1.00 0.00 H | |
| ATOM 17 CA ILE A 2 7.640 3.839 0.000 1.00 0.00 C | |
| ATOM 18 HA ILE A 2 8.004 3.325 0.890 1.00 0.00 H | |
| ATOM 19 CB ILE A 2 8.148 3.120 -1.245 1.00 0.00 C | |
| ATOM 20 HB ILE A 2 7.785 2.092 -1.246 1.00 0.00 H | |
| ATOM 21 CG2 ILE A 2 7.640 3.839 -2.490 1.00 0.00 C | |
| ATOM 22 HG21 ILE A 2 8.003 4.866 -2.491 1.00 0.00 H | |
| ATOM 23 HG22 ILE A 2 8.003 3.325 -3.381 1.00 0.00 H | |
| ATOM 24 HG23 ILE A 2 6.550 3.839 -2.491 1.00 0.00 H | |
| ATOM 25 CG1 ILE A 2 9.673 3.120 -1.245 1.00 0.00 C | |
| ATOM 26 HG12 ILE A 2 10.037 4.147 -1.245 1.00 0.00 H | |
| ATOM 27 HG13 ILE A 2 10.037 2.606 -0.355 1.00 0.00 H | |
| ATOM 28 CD1 ILE A 2 10.182 2.401 -2.490 1.00 0.00 C | |
| ATOM 29 HD11 ILE A 2 9.819 2.914 -3.381 1.00 0.00 H | |
| ATOM 30 HD12 ILE A 2 11.272 2.401 -2.491 1.00 0.00 H | |
| ATOM 31 HD13 ILE A 2 9.819 1.373 -2.491 1.00 0.00 H | |
| ATOM 32 C ILE A 2 8.188 5.259 0.000 1.00 0.00 C | |
| ATOM 33 O ILE A 2 7.425 6.222 0.000 1.00 0.00 O | |
| ATOM 34 OXT ILE A 2 9.441 5.330 0.063 1.00 0.00 O | |
| TER 35 ILE A 2 | |
| END | |