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REMARK 1 CREATED WITH OPENMM 7.7, 2022-09-13
ATOM 1 N ALA A 1 3.326 1.548 0.000 1.00 0.00 N
ATOM 2 H2 ALA A 1 2.494 1.318 0.838 1.00 0.00 H
ATOM 3 H3 ALA A 1 2.643 1.448 -0.987 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 ALA A 2 6.191 3.839 0.000 1.00 0.00 N
ATOM 14 H ALA A 2 5.715 4.730 0.000 1.00 0.00 H
ATOM 15 CA ALA A 2 7.640 3.839 0.000 1.00 0.00 C
ATOM 16 HA ALA A 2 8.004 3.325 0.890 1.00 0.00 H
ATOM 17 CB ALA A 2 8.189 3.127 -1.232 1.00 0.00 C
ATOM 18 HB1 ALA A 2 7.841 3.636 -2.131 1.00 0.00 H
ATOM 19 HB2 ALA A 2 9.279 3.142 -1.206 1.00 0.00 H
ATOM 20 HB3 ALA A 2 7.841 2.094 -1.241 1.00 0.00 H
ATOM 21 C ALA A 2 8.188 5.259 0.000 1.00 0.00 C
ATOM 22 O ALA A 2 7.425 6.222 0.000 1.00 0.00 O
ATOM 23 N LYS A 3 9.517 5.386 0.000 1.00 0.00 N
ATOM 24 H LYS A 3 10.103 4.564 0.000 1.00 0.00 H
ATOM 25 CA LYS A 3 10.161 6.684 0.000 1.00 0.00 C
ATOM 26 HA LYS A 3 9.863 7.239 -0.890 1.00 0.00 H
ATOM 27 CB LYS A 3 9.768 7.492 1.232 1.00 0.00 C
ATOM 28 HB2 LYS A 3 8.688 7.640 1.241 1.00 0.00 H
ATOM 29 HB3 LYS A 3 10.068 6.954 2.131 1.00 0.00 H
ATOM 30 CG LYS A 3 10.465 8.848 1.195 1.00 0.00 C
ATOM 31 HG2 LYS A 3 11.545 8.702 1.186 1.00 0.00 H
ATOM 32 HG3 LYS A 3 10.165 9.387 0.296 1.00 0.00 H
ATOM 33 CD LYS A 3 10.072 9.656 2.427 1.00 0.00 C
ATOM 34 HD2 LYS A 3 8.992 9.803 2.436 1.00 0.00 H
ATOM 35 HD3 LYS A 3 10.373 9.118 3.326 1.00 0.00 H
ATOM 36 CE LYS A 3 10.769 11.012 2.389 1.00 0.00 C
ATOM 37 HE2 LYS A 3 11.849 10.866 2.380 1.00 0.00 H
ATOM 38 HE3 LYS A 3 10.469 11.551 1.491 1.00 0.00 H
ATOM 39 NZ LYS A 3 10.390 11.791 3.577 1.00 0.00 N
ATOM 40 HZ1 LYS A 3 10.669 11.292 4.410 1.00 0.00 H
ATOM 41 HZ2 LYS A 3 10.852 12.689 3.552 1.00 0.00 H
ATOM 42 HZ3 LYS A 3 9.390 11.927 3.585 1.00 0.00 H
ATOM 43 C LYS A 3 11.677 6.544 0.000 1.00 0.00 C
ATOM 44 O LYS A 3 12.200 5.432 0.000 1.00 0.00 O
ATOM 45 N GLY A 4 12.382 7.677 0.000 1.00 0.00 N
ATOM 46 H GLY A 4 11.906 8.568 0.000 1.00 0.00 H
ATOM 47 CA GLY A 4 13.831 7.677 0.000 1.00 0.00 C
ATOM 48 HA2 GLY A 4 14.195 7.163 0.890 1.00 0.00 H
ATOM 49 HA3 GLY A 4 14.195 7.163 -0.890 1.00 0.00 H
ATOM 50 C GLY A 4 14.362 9.104 0.000 1.00 0.00 C
ATOM 51 O GLY A 4 13.586 10.057 0.000 1.00 0.00 O
ATOM 52 OXT GLY A 4 15.647 9.042 -0.022 1.00 0.00 O
TER 53 GLY A 4
END
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