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REMARK 1 CREATED WITH OPENMM 7.7, 2022-11-04
ATOM 1 N ALA A 1 3.326 1.548 0.000 1.00 0.00 N
ATOM 2 H2 ALA A 1 2.492 1.304 0.834 1.00 0.00 H
ATOM 3 H3 ALA A 1 2.645 1.443 -0.989 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 PRO A 2 6.191 3.839 0.000 1.00 0.00 N
ATOM 14 CD PRO A 2 5.547 5.147 0.000 1.00 0.00 C
ATOM 15 HD2 PRO A 2 5.240 5.401 1.014 1.00 0.00 H
ATOM 16 HD3 PRO A 2 4.672 5.121 -0.649 1.00 0.00 H
ATOM 17 CG PRO A 2 6.620 6.056 -0.522 1.00 0.00 C
ATOM 18 HG2 PRO A 2 6.576 7.003 0.016 1.00 0.00 H
ATOM 19 HG3 PRO A 2 6.470 6.237 -1.586 1.00 0.00 H
ATOM 20 CB PRO A 2 7.927 5.342 -0.276 1.00 0.00 C
ATOM 21 HB2 PRO A 2 8.424 5.789 0.586 1.00 0.00 H
ATOM 22 HB3 PRO A 2 8.564 5.445 -1.155 1.00 0.00 H
ATOM 23 CA PRO A 2 7.642 3.839 0.000 1.00 0.00 C
ATOM 24 HA PRO A 2 8.040 3.343 -0.886 1.00 0.00 H
ATOM 25 C PRO A 2 8.189 3.161 1.248 1.00 0.00 C
ATOM 26 O PRO A 2 7.426 2.647 2.064 1.00 0.00 O
ATOM 27 OXT PRO A 2 9.443 3.188 1.323 1.00 0.00 O
TER 28 PRO A 2
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