File size: 2,670 Bytes
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REMARK 1 CREATED WITH OPENMM 7.7, 2022-11-04
ATOM 1 N ASP A 1 3.326 1.548 0.000 1.00 0.00 N
ATOM 2 H2 ASP A 1 2.642 1.446 -0.987 1.00 0.00 H
ATOM 3 H3 ASP A 1 2.495 1.309 0.838 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 GLN A 2 6.191 3.839 0.000 1.00 0.00 N
ATOM 16 H GLN A 2 5.715 4.730 0.000 1.00 0.00 H
ATOM 17 CA GLN A 2 7.640 3.839 0.000 1.00 0.00 C
ATOM 18 HA GLN A 2 8.004 3.325 0.890 1.00 0.00 H
ATOM 19 CB GLN A 2 8.189 3.127 -1.232 1.00 0.00 C
ATOM 20 HB2 GLN A 2 7.841 2.094 -1.241 1.00 0.00 H
ATOM 21 HB3 GLN A 2 7.841 3.636 -2.131 1.00 0.00 H
ATOM 22 CG GLN A 2 9.713 3.149 -1.195 1.00 0.00 C
ATOM 23 HG2 GLN A 2 10.062 4.181 -1.186 1.00 0.00 H
ATOM 24 HG3 GLN A 2 10.062 2.640 -0.296 1.00 0.00 H
ATOM 25 CD GLN A 2 10.301 2.447 -2.410 1.00 0.00 C
ATOM 26 OE1 GLN A 2 9.566 1.955 -3.263 1.00 0.00 O
ATOM 27 NE2 GLN A 2 11.633 2.402 -2.488 1.00 0.00 N
ATOM 28 HE21 GLN A 2 12.075 1.948 -3.275 1.00 0.00 H
ATOM 29 HE22 GLN A 2 12.193 2.822 -1.760 1.00 0.00 H
ATOM 30 C GLN A 2 8.188 5.259 0.000 1.00 0.00 C
ATOM 31 O GLN A 2 7.425 6.222 0.000 1.00 0.00 O
ATOM 32 OXT GLN A 2 9.440 5.329 0.058 1.00 0.00 O
TER 33 GLN A 2
END
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