| 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 2.640 1.449 -0.986 1.00 0.00 H | |
| ATOM 3 H3 CYS A 1 2.495 1.310 0.838 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 LEU A 2 6.191 3.839 0.000 1.00 0.00 N | |
| ATOM 15 H LEU A 2 5.715 4.730 0.000 1.00 0.00 H | |
| ATOM 16 CA LEU A 2 7.640 3.839 0.000 1.00 0.00 C | |
| ATOM 17 HA LEU A 2 8.004 3.325 0.890 1.00 0.00 H | |
| ATOM 18 CB LEU A 2 8.189 3.127 -1.232 1.00 0.00 C | |
| ATOM 19 HB2 LEU A 2 7.841 2.094 -1.241 1.00 0.00 H | |
| ATOM 20 HB3 LEU A 2 7.841 3.636 -2.131 1.00 0.00 H | |
| ATOM 21 CG LEU A 2 9.713 3.149 -1.195 1.00 0.00 C | |
| ATOM 22 HG LEU A 2 10.062 4.181 -1.186 1.00 0.00 H | |
| ATOM 23 CD1 LEU A 2 10.201 2.437 0.063 1.00 0.00 C | |
| ATOM 24 HD11 LEU A 2 9.853 1.404 0.055 1.00 0.00 H | |
| ATOM 25 HD12 LEU A 2 11.291 2.452 0.090 1.00 0.00 H | |
| ATOM 26 HD13 LEU A 2 9.809 2.945 0.944 1.00 0.00 H | |
| ATOM 27 CD2 LEU A 2 10.262 2.438 -2.427 1.00 0.00 C | |
| ATOM 28 HD21 LEU A 2 9.914 2.946 -3.326 1.00 0.00 H | |
| ATOM 29 HD22 LEU A 2 11.352 2.453 -2.400 1.00 0.00 H | |
| ATOM 30 HD23 LEU A 2 9.914 1.405 -2.436 1.00 0.00 H | |
| ATOM 31 C LEU A 2 8.188 5.259 0.000 1.00 0.00 C | |
| ATOM 32 O LEU A 2 7.425 6.222 0.000 1.00 0.00 O | |
| ATOM 33 OXT LEU A 2 9.439 5.337 0.060 1.00 0.00 O | |
| TER 34 LEU A 2 | |
| END | |