Datasets:

ArXiv:
License:
timewarp / 2AA-1-big /test /EK-traj-state0.pdb
andrewfoong's picture
Upload folder using huggingface_hub
729697e verified
raw
history blame
3.29 kB
MODEL 0
ATOM 1 N GLU A 1 3.326 1.548 0.000 1.00 0.00 N
ATOM 2 H2 GLU A 1 2.641 1.438 -0.986 1.00 0.00 H
ATOM 3 H3 GLU A 1 2.499 1.306 0.842 1.00 0.00 H
ATOM 4 H GLU A 1 3.909 0.724 0.000 1.00 0.00 H
ATOM 5 CA GLU A 1 3.970 2.846 0.000 1.00 0.00 C
ATOM 6 HA GLU A 1 3.672 3.400 -0.890 1.00 0.00 H
ATOM 7 CB GLU A 1 3.577 3.654 1.232 1.00 0.00 C
ATOM 8 HB2 GLU A 1 2.497 3.801 1.241 1.00 0.00 H
ATOM 9 HB3 GLU A 1 3.877 3.116 2.131 1.00 0.00 H
ATOM 10 CG GLU A 1 4.267 4.996 1.195 1.00 0.00 C
ATOM 11 HG2 GLU A 1 5.347 4.850 1.186 1.00 0.00 H
ATOM 12 HG3 GLU A 1 3.967 5.535 0.296 1.00 0.00 H
ATOM 13 CD GLU A 1 3.874 5.805 2.429 1.00 0.00 C
ATOM 14 OE1 GLU A 1 4.595 5.679 3.454 1.00 0.00 O
ATOM 15 OE2 GLU A 1 2.856 6.542 2.334 1.00 0.00 O
ATOM 16 C GLU A 1 5.486 2.705 0.000 1.00 0.00 C
ATOM 17 O GLU A 1 6.009 1.593 0.000 1.00 0.00 O
ATOM 18 N LYS A 2 6.191 3.839 0.000 1.00 0.00 N
ATOM 19 H LYS A 2 5.715 4.730 0.000 1.00 0.00 H
ATOM 20 CA LYS A 2 7.640 3.839 0.000 1.00 0.00 C
ATOM 21 HA LYS A 2 8.004 3.325 0.890 1.00 0.00 H
ATOM 22 CB LYS A 2 8.189 3.127 -1.232 1.00 0.00 C
ATOM 23 HB2 LYS A 2 7.841 2.094 -1.241 1.00 0.00 H
ATOM 24 HB3 LYS A 2 7.841 3.636 -2.131 1.00 0.00 H
ATOM 25 CG LYS A 2 9.713 3.149 -1.195 1.00 0.00 C
ATOM 26 HG2 LYS A 2 10.062 4.181 -1.186 1.00 0.00 H
ATOM 27 HG3 LYS A 2 10.062 2.640 -0.296 1.00 0.00 H
ATOM 28 CD LYS A 2 10.262 2.438 -2.427 1.00 0.00 C
ATOM 29 HD2 LYS A 2 9.914 1.405 -2.436 1.00 0.00 H
ATOM 30 HD3 LYS A 2 9.914 2.946 -3.326 1.00 0.00 H
ATOM 31 CE LYS A 2 11.787 2.459 -2.389 1.00 0.00 C
ATOM 32 HE2 LYS A 2 12.136 3.492 -2.380 1.00 0.00 H
ATOM 33 HE3 LYS A 2 12.136 1.951 -1.491 1.00 0.00 H
ATOM 34 NZ LYS A 2 12.316 1.773 -3.577 1.00 0.00 N
ATOM 35 HZ1 LYS A 2 11.993 2.245 -4.410 1.00 0.00 H
ATOM 36 HZ2 LYS A 2 13.326 1.788 -3.552 1.00 0.00 H
ATOM 37 HZ3 LYS A 2 11.993 0.817 -3.585 1.00 0.00 H
ATOM 38 C LYS A 2 8.188 5.259 0.000 1.00 0.00 C
ATOM 39 O LYS A 2 7.425 6.222 0.000 1.00 0.00 O
ATOM 40 OXT LYS A 2 9.440 5.325 0.059 1.00 0.00 O
TER 41 LYS A 2
ENDMDL
END