| REMARK 1 CREATED WITH OPENMM 7.7, 2022-11-04 | |
| ATOM 1 N ALA A 1 3.326 1.548 0.000 1.00 0.00 N | |
| ATOM 2 H2 ALA A 1 2.504 1.304 0.845 1.00 0.00 H | |
| ATOM 3 H3 ALA A 1 2.633 1.444 -0.981 1.00 0.00 H | |
| ATOM 4 H ALA A 1 3.909 0.724 0.000 1.00 0.00 H | |
| ATOM 5 CA ALA A 1 3.970 2.846 0.000 1.00 0.00 C | |
| ATOM 6 HA ALA A 1 3.672 3.400 -0.890 1.00 0.00 H | |
| ATOM 7 CB ALA A 1 3.577 3.654 1.232 1.00 0.00 C | |
| ATOM 8 HB1 ALA A 1 3.877 3.116 2.131 1.00 0.00 H | |
| ATOM 9 HB2 ALA A 1 4.075 4.623 1.206 1.00 0.00 H | |
| ATOM 10 HB3 ALA A 1 2.497 3.801 1.241 1.00 0.00 H | |
| ATOM 11 C ALA A 1 5.486 2.705 0.000 1.00 0.00 C | |
| ATOM 12 O ALA A 1 6.009 1.593 0.000 1.00 0.00 O | |
| ATOM 13 N LYS A 2 6.191 3.839 0.000 1.00 0.00 N | |
| ATOM 14 H LYS A 2 5.715 4.730 0.000 1.00 0.00 H | |
| ATOM 15 CA LYS A 2 7.640 3.839 0.000 1.00 0.00 C | |
| ATOM 16 HA LYS A 2 8.004 3.325 0.890 1.00 0.00 H | |
| ATOM 17 CB LYS A 2 8.189 3.127 -1.232 1.00 0.00 C | |
| ATOM 18 HB2 LYS A 2 7.841 2.094 -1.241 1.00 0.00 H | |
| ATOM 19 HB3 LYS A 2 7.841 3.636 -2.131 1.00 0.00 H | |
| ATOM 20 CG LYS A 2 9.713 3.149 -1.195 1.00 0.00 C | |
| ATOM 21 HG2 LYS A 2 10.062 4.181 -1.186 1.00 0.00 H | |
| ATOM 22 HG3 LYS A 2 10.062 2.640 -0.296 1.00 0.00 H | |
| ATOM 23 CD LYS A 2 10.262 2.438 -2.427 1.00 0.00 C | |
| ATOM 24 HD2 LYS A 2 9.914 1.405 -2.436 1.00 0.00 H | |
| ATOM 25 HD3 LYS A 2 9.914 2.946 -3.326 1.00 0.00 H | |
| ATOM 26 CE LYS A 2 11.787 2.459 -2.389 1.00 0.00 C | |
| ATOM 27 HE2 LYS A 2 12.136 3.492 -2.380 1.00 0.00 H | |
| ATOM 28 HE3 LYS A 2 12.136 1.951 -1.491 1.00 0.00 H | |
| ATOM 29 NZ LYS A 2 12.316 1.773 -3.577 1.00 0.00 N | |
| ATOM 30 HZ1 LYS A 2 11.993 2.245 -4.410 1.00 0.00 H | |
| ATOM 31 HZ2 LYS A 2 13.326 1.788 -3.552 1.00 0.00 H | |
| ATOM 32 HZ3 LYS A 2 11.993 0.817 -3.585 1.00 0.00 H | |
| ATOM 33 C LYS A 2 8.188 5.259 0.000 1.00 0.00 C | |
| ATOM 34 O LYS A 2 7.425 6.222 0.000 1.00 0.00 O | |
| ATOM 35 OXT LYS A 2 9.439 5.324 0.074 1.00 0.00 O | |
| TER 36 LYS A 2 | |
| END | |