| REMARK 1 CREATED WITH OPENMM 7.7, 2022-11-04 | |
| ATOM 1 N CYS A 1 3.326 1.548 0.000 1.00 0.00 N | |
| ATOM 2 H2 CYS A 1 2.499 1.319 0.844 1.00 0.00 H | |
| ATOM 3 H3 CYS A 1 2.638 1.447 -0.984 1.00 0.00 H | |
| ATOM 4 H CYS A 1 3.909 0.724 0.000 1.00 0.00 H | |
| ATOM 5 CA CYS A 1 3.970 2.846 0.000 1.00 0.00 C | |
| ATOM 6 HA CYS A 1 3.672 3.400 -0.890 1.00 0.00 H | |
| ATOM 7 CB CYS A 1 3.577 3.654 1.232 1.00 0.00 C | |
| ATOM 8 HB2 CYS A 1 2.497 3.801 1.241 1.00 0.00 H | |
| ATOM 9 HB3 CYS A 1 3.877 3.116 2.131 1.00 0.00 H | |
| ATOM 10 SG CYS A 1 4.310 5.304 1.366 1.00 0.00 S | |
| ATOM 11 HG CYS A 1 3.725 5.622 2.518 1.00 0.00 H | |
| ATOM 12 C CYS A 1 5.486 2.705 0.000 1.00 0.00 C | |
| ATOM 13 O CYS A 1 6.009 1.593 0.000 1.00 0.00 O | |
| ATOM 14 N PHE A 2 6.191 3.839 0.000 1.00 0.00 N | |
| ATOM 15 H PHE A 2 5.715 4.730 0.000 1.00 0.00 H | |
| ATOM 16 CA PHE A 2 7.640 3.839 0.000 1.00 0.00 C | |
| ATOM 17 HA PHE A 2 8.004 3.325 0.890 1.00 0.00 H | |
| ATOM 18 CB PHE A 2 8.189 3.127 -1.232 1.00 0.00 C | |
| ATOM 19 HB2 PHE A 2 7.841 2.094 -1.241 1.00 0.00 H | |
| ATOM 20 HB3 PHE A 2 7.841 3.636 -2.131 1.00 0.00 H | |
| ATOM 21 CG PHE A 2 9.696 3.076 -1.321 1.00 0.00 C | |
| ATOM 22 CD1 PHE A 2 10.311 2.447 -2.410 1.00 0.00 C | |
| ATOM 23 HD1 PHE A 2 9.703 1.995 -3.193 1.00 0.00 H | |
| ATOM 24 CE1 PHE A 2 11.708 2.400 -2.492 1.00 0.00 C | |
| ATOM 25 HE1 PHE A 2 12.188 1.910 -3.340 1.00 0.00 H | |
| ATOM 26 CZ PHE A 2 12.489 2.981 -1.486 1.00 0.00 C | |
| ATOM 27 HZ PHE A 2 13.576 2.944 -1.550 1.00 0.00 H | |
| ATOM 28 CE2 PHE A 2 11.873 3.609 -0.397 1.00 0.00 C | |
| ATOM 29 HE2 PHE A 2 12.481 4.062 0.386 1.00 0.00 H | |
| ATOM 30 CD2 PHE A 2 10.476 3.657 -0.315 1.00 0.00 C | |
| ATOM 31 HD2 PHE A 2 9.997 4.146 0.533 1.00 0.00 H | |
| ATOM 32 C PHE A 2 8.188 5.259 0.000 1.00 0.00 C | |
| ATOM 33 O PHE A 2 7.425 6.222 0.000 1.00 0.00 O | |
| ATOM 34 OXT PHE A 2 9.436 5.330 0.084 1.00 0.00 O | |
| TER 35 PHE A 2 | |
| END | |