Datasets:

ArXiv:
License:
timewarp / 2AA-1-big /test /FF-traj-state0.pdb
andrewfoong's picture
Upload folder using huggingface_hub
729697e verified
MODEL 0
ATOM 1 N PHE A 1 3.326 1.548 0.000 1.00 0.00 N
ATOM 2 H2 PHE A 1 2.495 1.308 0.838 1.00 0.00 H
ATOM 3 H3 PHE A 1 2.639 1.443 -0.985 1.00 0.00 H
ATOM 4 H PHE A 1 3.909 0.724 0.000 1.00 0.00 H
ATOM 5 CA PHE A 1 3.970 2.846 0.000 1.00 0.00 C
ATOM 6 HA PHE A 1 3.672 3.400 -0.890 1.00 0.00 H
ATOM 7 CB PHE A 1 3.577 3.654 1.232 1.00 0.00 C
ATOM 8 HB2 PHE A 1 2.497 3.801 1.241 1.00 0.00 H
ATOM 9 HB3 PHE A 1 3.877 3.116 2.131 1.00 0.00 H
ATOM 10 CG PHE A 1 4.201 5.026 1.321 1.00 0.00 C
ATOM 11 CD1 PHE A 1 3.912 5.857 2.410 1.00 0.00 C
ATOM 12 HD1 PHE A 1 3.236 5.514 3.193 1.00 0.00 H
ATOM 13 CE1 PHE A 1 4.490 7.130 2.492 1.00 0.00 C
ATOM 14 HE1 PHE A 1 4.265 7.777 3.340 1.00 0.00 H
ATOM 15 CZ PHE A 1 5.358 7.571 1.486 1.00 0.00 C
ATOM 16 HZ PHE A 1 5.808 8.561 1.550 1.00 0.00 H
ATOM 17 CE2 PHE A 1 5.647 6.739 0.397 1.00 0.00 C
ATOM 18 HE2 PHE A 1 6.322 7.083 -0.386 1.00 0.00 H
ATOM 19 CD2 PHE A 1 5.068 5.467 0.315 1.00 0.00 C
ATOM 20 HD2 PHE A 1 5.294 4.820 -0.533 1.00 0.00 H
ATOM 21 C PHE A 1 5.486 2.705 0.000 1.00 0.00 C
ATOM 22 O PHE A 1 6.009 1.593 0.000 1.00 0.00 O
ATOM 23 N PHE A 2 6.191 3.839 0.000 1.00 0.00 N
ATOM 24 H PHE A 2 5.715 4.730 0.000 1.00 0.00 H
ATOM 25 CA PHE A 2 7.640 3.839 0.000 1.00 0.00 C
ATOM 26 HA PHE A 2 8.004 3.325 0.890 1.00 0.00 H
ATOM 27 CB PHE A 2 8.189 3.127 -1.232 1.00 0.00 C
ATOM 28 HB2 PHE A 2 7.841 2.094 -1.241 1.00 0.00 H
ATOM 29 HB3 PHE A 2 7.841 3.636 -2.131 1.00 0.00 H
ATOM 30 CG PHE A 2 9.696 3.076 -1.321 1.00 0.00 C
ATOM 31 CD1 PHE A 2 10.311 2.447 -2.410 1.00 0.00 C
ATOM 32 HD1 PHE A 2 9.703 1.995 -3.193 1.00 0.00 H
ATOM 33 CE1 PHE A 2 11.708 2.400 -2.492 1.00 0.00 C
ATOM 34 HE1 PHE A 2 12.188 1.910 -3.340 1.00 0.00 H
ATOM 35 CZ PHE A 2 12.489 2.981 -1.486 1.00 0.00 C
ATOM 36 HZ PHE A 2 13.576 2.944 -1.550 1.00 0.00 H
ATOM 37 CE2 PHE A 2 11.873 3.609 -0.397 1.00 0.00 C
ATOM 38 HE2 PHE A 2 12.481 4.062 0.386 1.00 0.00 H
ATOM 39 CD2 PHE A 2 10.476 3.657 -0.315 1.00 0.00 C
ATOM 40 HD2 PHE A 2 9.997 4.146 0.533 1.00 0.00 H
ATOM 41 C PHE A 2 8.188 5.259 0.000 1.00 0.00 C
ATOM 42 O PHE A 2 7.425 6.222 0.000 1.00 0.00 O
ATOM 43 OXT PHE A 2 9.439 5.330 0.049 1.00 0.00 O
TER 44 PHE A 2
ENDMDL
END