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REMARK 1 CREATED WITH OPENMM 7.7, 2022-11-05
ATOM 1 N ASP A 1 3.326 1.548 0.000 1.00 0.00 N
ATOM 2 H2 ASP A 1 2.497 1.307 0.839 1.00 0.00 H
ATOM 3 H3 ASP A 1 2.642 1.445 -0.987 1.00 0.00 H
ATOM 4 H ASP A 1 3.909 0.724 0.000 1.00 0.00 H
ATOM 5 CA ASP A 1 3.970 2.846 0.000 1.00 0.00 C
ATOM 6 HA ASP A 1 3.672 3.400 -0.890 1.00 0.00 H
ATOM 7 CB ASP A 1 3.577 3.654 1.232 1.00 0.00 C
ATOM 8 HB2 ASP A 1 2.497 3.801 1.241 1.00 0.00 H
ATOM 9 HB3 ASP A 1 3.877 3.116 2.131 1.00 0.00 H
ATOM 10 CG ASP A 1 4.275 5.011 1.195 1.00 0.00 C
ATOM 11 OD1 ASP A 1 3.669 5.955 0.620 1.00 0.00 O
ATOM 12 OD2 ASP A 1 5.408 5.092 1.741 1.00 0.00 O
ATOM 13 C ASP A 1 5.486 2.705 0.000 1.00 0.00 C
ATOM 14 O ASP A 1 6.009 1.593 0.000 1.00 0.00 O
ATOM 15 N ARG A 2 6.191 3.839 0.000 1.00 0.00 N
ATOM 16 H ARG A 2 5.715 4.730 0.000 1.00 0.00 H
ATOM 17 CA ARG A 2 7.640 3.839 0.000 1.00 0.00 C
ATOM 18 HA ARG A 2 8.004 3.325 0.890 1.00 0.00 H
ATOM 19 CB ARG A 2 8.189 3.127 -1.232 1.00 0.00 C
ATOM 20 HB2 ARG A 2 7.841 2.094 -1.241 1.00 0.00 H
ATOM 21 HB3 ARG A 2 7.841 3.636 -2.131 1.00 0.00 H
ATOM 22 CG ARG A 2 9.713 3.149 -1.195 1.00 0.00 C
ATOM 23 HG2 ARG A 2 10.062 4.181 -1.186 1.00 0.00 H
ATOM 24 HG3 ARG A 2 10.062 2.640 -0.296 1.00 0.00 H
ATOM 25 CD ARG A 2 10.262 2.438 -2.427 1.00 0.00 C
ATOM 26 HD2 ARG A 2 9.914 1.405 -2.436 1.00 0.00 H
ATOM 27 HD3 ARG A 2 9.914 2.946 -3.326 1.00 0.00 H
ATOM 28 NE ARG A 2 11.742 2.439 -2.424 1.00 0.00 N
ATOM 29 HE ARG A 2 12.223 2.883 -1.655 1.00 0.00 H
ATOM 30 CZ ARG A 2 12.469 1.882 -3.389 1.00 0.00 C
ATOM 31 NH1 ARG A 2 11.909 1.279 -4.434 1.00 0.00 N
ATOM 32 HH11 ARG A 2 10.902 1.235 -4.509 1.00 0.00 H
ATOM 33 HH12 ARG A 2 12.492 0.866 -5.148 1.00 0.00 H
ATOM 34 NH2 ARG A 2 13.793 1.941 -3.287 1.00 0.00 N
ATOM 35 HH21 ARG A 2 14.215 2.400 -2.492 1.00 0.00 H
ATOM 36 HH22 ARG A 2 14.371 1.527 -4.004 1.00 0.00 H
ATOM 37 C ARG A 2 8.188 5.259 0.000 1.00 0.00 C
ATOM 38 O ARG A 2 7.425 6.222 0.000 1.00 0.00 O
ATOM 39 OXT ARG A 2 9.440 5.328 0.056 1.00 0.00 O
TER 40 ARG A 2
END
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