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REMARK 1 CREATED WITH OPENMM 7.7, 2022-09-01
ATOM 1 N ALA A 1 3.326 1.548 0.000 1.00 0.00 N
ATOM 2 H2 ALA A 1 2.644 1.447 -0.988 1.00 0.00 H
ATOM 3 H3 ALA A 1 2.499 1.305 0.840 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 PHE A 2 6.191 3.839 0.000 1.00 0.00 N
ATOM 14 H PHE A 2 5.715 4.730 0.000 1.00 0.00 H
ATOM 15 CA PHE A 2 7.640 3.839 0.000 1.00 0.00 C
ATOM 16 HA PHE A 2 8.004 3.325 0.890 1.00 0.00 H
ATOM 17 CB PHE A 2 8.189 3.127 -1.232 1.00 0.00 C
ATOM 18 HB2 PHE A 2 7.841 2.094 -1.241 1.00 0.00 H
ATOM 19 HB3 PHE A 2 7.841 3.636 -2.131 1.00 0.00 H
ATOM 20 CG PHE A 2 9.696 3.076 -1.321 1.00 0.00 C
ATOM 21 CD1 PHE A 2 10.311 2.447 -2.410 1.00 0.00 C
ATOM 22 HD1 PHE A 2 9.703 1.995 -3.193 1.00 0.00 H
ATOM 23 CE1 PHE A 2 11.708 2.400 -2.492 1.00 0.00 C
ATOM 24 HE1 PHE A 2 12.188 1.910 -3.340 1.00 0.00 H
ATOM 25 CZ PHE A 2 12.489 2.981 -1.486 1.00 0.00 C
ATOM 26 HZ PHE A 2 13.576 2.944 -1.550 1.00 0.00 H
ATOM 27 CE2 PHE A 2 11.873 3.609 -0.397 1.00 0.00 C
ATOM 28 HE2 PHE A 2 12.481 4.062 0.386 1.00 0.00 H
ATOM 29 CD2 PHE A 2 10.476 3.657 -0.315 1.00 0.00 C
ATOM 30 HD2 PHE A 2 9.997 4.146 0.533 1.00 0.00 H
ATOM 31 C PHE A 2 8.188 5.259 0.000 1.00 0.00 C
ATOM 32 O PHE A 2 7.425 6.222 0.000 1.00 0.00 O
ATOM 33 N PRO A 3 9.517 5.386 0.000 1.00 0.00 N
ATOM 34 CD PRO A 3 10.402 4.228 0.000 1.00 0.00 C
ATOM 35 HD2 PRO A 3 10.493 3.840 -1.014 1.00 0.00 H
ATOM 36 HD3 PRO A 3 9.990 3.455 0.649 1.00 0.00 H
ATOM 37 CG PRO A 3 11.694 4.785 0.522 1.00 0.00 C
ATOM 38 HG2 PRO A 3 12.522 4.324 -0.016 1.00 0.00 H
ATOM 39 HG3 PRO A 3 11.789 4.570 1.586 1.00 0.00 H
ATOM 40 CB PRO A 3 11.636 6.273 0.276 1.00 0.00 C
ATOM 41 HB2 PRO A 3 12.257 6.519 -0.586 1.00 0.00 H
ATOM 42 HB3 PRO A 3 12.011 6.797 1.155 1.00 0.00 H
ATOM 43 CA PRO A 3 10.162 6.686 0.000 1.00 0.00 C
ATOM 44 HA PRO A 3 9.895 7.263 0.886 1.00 0.00 H
ATOM 45 C PRO A 3 9.798 7.477 -1.248 1.00 0.00 C
ATOM 46 O PRO A 3 8.999 7.022 -2.064 1.00 0.00 O
ATOM 47 N ASN A 4 10.388 8.665 -1.396 1.00 0.00 N
ATOM 48 H ASN A 4 11.039 8.997 -0.698 1.00 0.00 H
ATOM 49 CA ASN A 4 10.125 9.514 -2.541 1.00 0.00 C
ATOM 50 HA ASN A 4 10.403 8.988 -3.455 1.00 0.00 H
ATOM 51 CB ASN A 4 8.648 9.884 -2.622 1.00 0.00 C
ATOM 52 HB2 ASN A 4 8.050 8.978 -2.716 1.00 0.00 H
ATOM 53 HB3 ASN A 4 8.357 10.419 -1.718 1.00 0.00 H
ATOM 54 CG ASN A 4 8.372 10.775 -3.825 1.00 0.00 C
ATOM 55 OD1 ASN A 4 9.284 11.104 -4.581 1.00 0.00 O
ATOM 56 ND2 ASN A 4 7.108 11.166 -4.002 1.00 0.00 N
ATOM 57 HD21 ASN A 4 6.870 11.759 -4.784 1.00 0.00 H
ATOM 58 HD22 ASN A 4 6.395 10.868 -3.351 1.00 0.00 H
ATOM 59 C ASN A 4 10.925 10.806 -2.461 1.00 0.00 C
ATOM 60 O ASN A 4 11.674 11.018 -1.510 1.00 0.00 O
ATOM 61 OXT ASN A 4 10.723 11.504 -3.523 1.00 0.00 O
TER 62 ASN A 4
END
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