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REMARK 1 CREATED WITH OPENMM 7.7, 2022-09-08
ATOM 1 N ALA A 1 3.326 1.548 0.000 1.00 0.00 N
ATOM 2 H2 ALA A 1 2.645 1.448 -0.989 1.00 0.00 H
ATOM 3 H3 ALA A 1 2.492 1.311 0.836 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 LEU A 2 6.191 3.839 0.000 1.00 0.00 N
ATOM 14 H LEU A 2 5.715 4.730 0.000 1.00 0.00 H
ATOM 15 CA LEU A 2 7.640 3.839 0.000 1.00 0.00 C
ATOM 16 HA LEU A 2 8.004 3.325 0.890 1.00 0.00 H
ATOM 17 CB LEU A 2 8.189 3.127 -1.232 1.00 0.00 C
ATOM 18 HB2 LEU A 2 7.841 2.094 -1.241 1.00 0.00 H
ATOM 19 HB3 LEU A 2 7.841 3.636 -2.131 1.00 0.00 H
ATOM 20 CG LEU A 2 9.713 3.149 -1.195 1.00 0.00 C
ATOM 21 HG LEU A 2 10.062 4.181 -1.186 1.00 0.00 H
ATOM 22 CD1 LEU A 2 10.201 2.437 0.063 1.00 0.00 C
ATOM 23 HD11 LEU A 2 9.853 1.404 0.055 1.00 0.00 H
ATOM 24 HD12 LEU A 2 11.291 2.452 0.090 1.00 0.00 H
ATOM 25 HD13 LEU A 2 9.809 2.945 0.944 1.00 0.00 H
ATOM 26 CD2 LEU A 2 10.262 2.438 -2.427 1.00 0.00 C
ATOM 27 HD21 LEU A 2 9.914 2.946 -3.326 1.00 0.00 H
ATOM 28 HD22 LEU A 2 11.352 2.453 -2.400 1.00 0.00 H
ATOM 29 HD23 LEU A 2 9.914 1.405 -2.436 1.00 0.00 H
ATOM 30 C LEU A 2 8.188 5.259 0.000 1.00 0.00 C
ATOM 31 O LEU A 2 7.425 6.222 0.000 1.00 0.00 O
ATOM 32 N LEU A 3 9.517 5.386 0.000 1.00 0.00 N
ATOM 33 H LEU A 3 10.103 4.564 0.000 1.00 0.00 H
ATOM 34 CA LEU A 3 10.161 6.684 0.000 1.00 0.00 C
ATOM 35 HA LEU A 3 9.863 7.239 -0.890 1.00 0.00 H
ATOM 36 CB LEU A 3 9.768 7.492 1.232 1.00 0.00 C
ATOM 37 HB2 LEU A 3 8.688 7.640 1.241 1.00 0.00 H
ATOM 38 HB3 LEU A 3 10.068 6.954 2.131 1.00 0.00 H
ATOM 39 CG LEU A 3 10.465 8.848 1.195 1.00 0.00 C
ATOM 40 HG LEU A 3 11.545 8.702 1.186 1.00 0.00 H
ATOM 41 CD1 LEU A 3 10.044 9.601 -0.063 1.00 0.00 C
ATOM 42 HD11 LEU A 3 8.964 9.749 -0.055 1.00 0.00 H
ATOM 43 HD12 LEU A 3 10.543 10.571 -0.090 1.00 0.00 H
ATOM 44 HD13 LEU A 3 10.325 9.024 -0.944 1.00 0.00 H
ATOM 45 CD2 LEU A 3 10.072 9.656 2.427 1.00 0.00 C
ATOM 46 HD21 LEU A 3 10.373 9.118 3.326 1.00 0.00 H
ATOM 47 HD22 LEU A 3 10.570 10.625 2.400 1.00 0.00 H
ATOM 48 HD23 LEU A 3 8.992 9.803 2.436 1.00 0.00 H
ATOM 49 C LEU A 3 11.677 6.544 0.000 1.00 0.00 C
ATOM 50 O LEU A 3 12.200 5.432 0.000 1.00 0.00 O
ATOM 51 N PHE A 4 12.382 7.677 0.000 1.00 0.00 N
ATOM 52 H PHE A 4 11.906 8.568 0.000 1.00 0.00 H
ATOM 53 CA PHE A 4 13.831 7.677 0.000 1.00 0.00 C
ATOM 54 HA PHE A 4 14.195 7.163 0.890 1.00 0.00 H
ATOM 55 CB PHE A 4 14.380 6.966 -1.232 1.00 0.00 C
ATOM 56 HB2 PHE A 4 14.032 5.933 -1.241 1.00 0.00 H
ATOM 57 HB3 PHE A 4 14.032 7.474 -2.131 1.00 0.00 H
ATOM 58 CG PHE A 4 15.887 6.914 -1.321 1.00 0.00 C
ATOM 59 CD1 PHE A 4 16.502 6.286 -2.410 1.00 0.00 C
ATOM 60 HD1 PHE A 4 15.894 5.833 -3.193 1.00 0.00 H
ATOM 61 CE1 PHE A 4 17.899 6.238 -2.492 1.00 0.00 C
ATOM 62 HE1 PHE A 4 18.379 5.749 -3.340 1.00 0.00 H
ATOM 63 CZ PHE A 4 18.680 6.819 -1.486 1.00 0.00 C
ATOM 64 HZ PHE A 4 19.768 6.782 -1.550 1.00 0.00 H
ATOM 65 CE2 PHE A 4 18.064 7.448 -0.397 1.00 0.00 C
ATOM 66 HE2 PHE A 4 18.672 7.900 0.386 1.00 0.00 H
ATOM 67 CD2 PHE A 4 16.667 7.495 -0.315 1.00 0.00 C
ATOM 68 HD2 PHE A 4 16.188 7.985 0.533 1.00 0.00 H
ATOM 69 C PHE A 4 14.379 9.097 0.000 1.00 0.00 C
ATOM 70 O PHE A 4 13.616 10.060 0.000 1.00 0.00 O
ATOM 71 OXT PHE A 4 15.661 9.067 0.070 1.00 0.00 O
TER 72 PHE A 4
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