X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2Funres%2FCSA%2F4P%2FCSA%2Foutput%2F1l2y_csa%40034.pdb;fp=examples%2Funres%2FCSA%2F4P%2FCSA%2Foutput%2F1l2y_csa%40034.pdb;h=919bb280fc7eae393baff50915a0faba0e9665a2;hb=c5370e6422f68c03f5801e5e8b127a5ba478695b;hp=0000000000000000000000000000000000000000;hpb=866c6bb3445c32af6d43b6eea1c565ae7d78e7f2;p=unres.git diff --git a/examples/unres/CSA/4P/CSA/output/1l2y_csa@034.pdb b/examples/unres/CSA/4P/CSA/output/1l2y_csa@034.pdb new file mode 100644 index 0000000..919bb28 --- /dev/null +++ b/examples/unres/CSA/4P/CSA/output/1l2y_csa@034.pdb @@ -0,0 +1,62 @@ +REMARK GM 34 e 5800855 m 23285 ENERGY -1.86488E+02 +HELIX 1 H1 LEU 2 GLY 10 1 8 +HELIX 2 H2 GLY 11 PRO 17 1 6 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 4.371 0.265 1.562 0.000 +ATOM 3 CA LEU 2 4.041 -3.792 0.000 0.000 +ATOM 4 CB LEU 2 3.825 -5.685 0.361 0.000 +ATOM 5 CA TYR 3 1.499 -4.087 -2.809 0.000 +ATOM 6 CB TYR 3 0.611 -1.767 -2.855 0.000 +ATOM 7 CA ILE 4 4.068 -3.183 -5.458 0.000 +ATOM 8 CB ILE 4 4.239 -1.530 -6.085 0.000 +ATOM 9 CA GLN 5 6.640 -5.552 -3.970 0.000 +ATOM 10 CB GLN 5 7.404 -4.246 -2.319 0.000 +ATOM 11 CA TRP 6 3.981 -8.213 -3.428 0.000 +ATOM 12 CB TRP 6 3.103 -10.370 -2.262 0.000 +ATOM 13 CA LEU 7 2.500 -7.613 -6.876 0.000 +ATOM 14 CB LEU 7 0.962 -6.571 -6.324 0.000 +ATOM 15 CA LYS 8 5.954 -7.573 -8.461 0.000 +ATOM 16 CB LYS 8 6.765 -5.166 -8.392 0.000 +ATOM 17 CA ASP 9 6.877 -10.920 -6.915 0.000 +ATOM 18 CB ASP 9 6.998 -10.434 -5.281 0.000 +ATOM 19 CA GLY 10 4.870 -12.910 -9.454 0.000 +ATOM 20 CA GLY 11 1.481 -14.630 -9.461 0.000 +ATOM 21 CA PRO 12 2.407 -17.022 -6.657 0.000 +ATOM 22 CB PRO 12 3.534 -17.303 -7.335 0.000 +ATOM 23 CA SER 13 3.418 -14.124 -4.417 0.000 +ATOM 24 CB SER 13 3.963 -13.285 -4.985 0.000 +ATOM 25 CA SER 14 -0.007 -12.524 -4.807 0.000 +ATOM 26 CB SER 14 0.505 -11.598 -5.256 0.000 +ATOM 27 CA GLY 15 -1.833 -15.742 -3.939 0.000 +ATOM 28 CA ARG 16 0.276 -16.509 -0.873 0.000 +ATOM 29 CB ARG 16 2.789 -16.845 -2.514 0.000 +ATOM 30 CA PRO 17 0.308 -14.406 2.292 0.000 +ATOM 31 CB PRO 17 0.609 -15.626 2.773 0.000 +ATOM 32 CA PRO 18 2.065 -11.039 2.163 0.000 +ATOM 33 CB PRO 18 0.929 -10.613 2.742 0.000 +ATOM 34 CA PRO 19 5.429 -10.728 3.903 0.000 +ATOM 35 CB PRO 19 5.865 -10.451 2.661 0.000 +ATOM 36 CA SER 20 4.445 -7.503 5.655 0.000 +ATOM 37 CB SER 20 3.879 -6.744 5.002 0.000 +TER +CONECT 1 3 2 +CONECT 3 5 4 +CONECT 5 7 6 +CONECT 7 9 8 +CONECT 9 11 10 +CONECT 11 13 12 +CONECT 13 15 14 +CONECT 15 17 16 +CONECT 17 19 18 +CONECT 19 20 +CONECT 20 21 +CONECT 21 23 22 +CONECT 23 25 24 +CONECT 25 27 26 +CONECT 27 28 +CONECT 28 30 29 +CONECT 30 32 31 +CONECT 32 34 33 +CONECT 34 36 35 +CONECT 36 37 +ENDMDL