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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 2.494 1.313 0.838 1.00 0.00 H
ATOM 3 H3 ALA A 1 2.644 1.442 -0.988 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 ASP A 2 6.191 3.839 0.000 1.00 0.00 N
ATOM 14 H ASP A 2 5.715 4.730 0.000 1.00 0.00 H
ATOM 15 CA ASP A 2 7.640 3.839 0.000 1.00 0.00 C
ATOM 16 HA ASP A 2 8.004 3.325 0.890 1.00 0.00 H
ATOM 17 CB ASP A 2 8.189 3.127 -1.232 1.00 0.00 C
ATOM 18 HB2 ASP A 2 7.841 2.094 -1.241 1.00 0.00 H
ATOM 19 HB3 ASP A 2 7.841 3.636 -2.131 1.00 0.00 H
ATOM 20 CG ASP A 2 9.715 3.149 -1.195 1.00 0.00 C
ATOM 21 OD1 ASP A 2 10.291 2.187 -0.620 1.00 0.00 O
ATOM 22 OD2 ASP A 2 10.291 4.128 -1.741 1.00 0.00 O
ATOM 23 C ASP A 2 8.188 5.259 0.000 1.00 0.00 C
ATOM 24 O ASP A 2 7.425 6.222 0.000 1.00 0.00 O
ATOM 25 OXT ASP A 2 9.435 5.329 0.115 1.00 0.00 O
TER 26 ASP A 2
END
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