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timewarp / 2AA-complete /test /DK-traj-state0.pdb
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MODEL 0
ATOM 1 N ASP A 1 3.326 1.548 0.000 1.00 0.00 N
ATOM 2 H2 ASP A 1 2.633 1.451 -0.981 1.00 0.00 H
ATOM 3 H3 ASP A 1 2.507 1.317 0.852 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 LYS A 2 6.191 3.839 0.000 1.00 0.00 N
ATOM 16 H LYS A 2 5.715 4.730 0.000 1.00 0.00 H
ATOM 17 CA LYS A 2 7.640 3.839 0.000 1.00 0.00 C
ATOM 18 HA LYS A 2 8.004 3.325 0.890 1.00 0.00 H
ATOM 19 CB LYS A 2 8.189 3.127 -1.232 1.00 0.00 C
ATOM 20 HB2 LYS A 2 7.841 2.094 -1.241 1.00 0.00 H
ATOM 21 HB3 LYS A 2 7.841 3.636 -2.131 1.00 0.00 H
ATOM 22 CG LYS A 2 9.713 3.149 -1.195 1.00 0.00 C
ATOM 23 HG2 LYS A 2 10.062 4.181 -1.186 1.00 0.00 H
ATOM 24 HG3 LYS A 2 10.062 2.640 -0.296 1.00 0.00 H
ATOM 25 CD LYS A 2 10.262 2.438 -2.427 1.00 0.00 C
ATOM 26 HD2 LYS A 2 9.914 1.405 -2.436 1.00 0.00 H
ATOM 27 HD3 LYS A 2 9.914 2.946 -3.326 1.00 0.00 H
ATOM 28 CE LYS A 2 11.787 2.459 -2.389 1.00 0.00 C
ATOM 29 HE2 LYS A 2 12.136 3.492 -2.380 1.00 0.00 H
ATOM 30 HE3 LYS A 2 12.136 1.951 -1.491 1.00 0.00 H
ATOM 31 NZ LYS A 2 12.316 1.773 -3.577 1.00 0.00 N
ATOM 32 HZ1 LYS A 2 11.993 2.245 -4.410 1.00 0.00 H
ATOM 33 HZ2 LYS A 2 13.326 1.788 -3.552 1.00 0.00 H
ATOM 34 HZ3 LYS A 2 11.993 0.817 -3.585 1.00 0.00 H
ATOM 35 C LYS A 2 8.188 5.259 0.000 1.00 0.00 C
ATOM 36 O LYS A 2 7.425 6.222 0.000 1.00 0.00 O
ATOM 37 OXT LYS A 2 9.441 5.327 0.055 1.00 0.00 O
TER 38 LYS A 2
ENDMDL
END