X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=blobdiff_plain;f=examples%2Funres%2FCSA%2F4P%2Foutputs%2F1l2y_csa%40011.pdb;fp=examples%2Funres%2FCSA%2F4P%2Foutputs%2F1l2y_csa%40011.pdb;h=ad1cf9490471ffdf9142bef00f6c3b3ac2aa1207;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/4P/outputs/1l2y_csa@011.pdb b/examples/unres/CSA/4P/outputs/1l2y_csa@011.pdb new file mode 100644 index 0000000..ad1cf94 --- /dev/null +++ b/examples/unres/CSA/4P/outputs/1l2y_csa@011.pdb @@ -0,0 +1,62 @@ +REMARK GM 11 e 284089 m 1014 ENERGY -1.87340E+02 +SHEET 1 B1 2 ASN 1 TYR 3 0 +SHEET 2 B1 2 TRP 6 LYS 8 -1 N LYS 8 O ASN 1 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 4.341 0.212 1.580 0.000 +ATOM 3 CA LEU 2 4.041 -3.792 0.000 0.000 +ATOM 4 CB LEU 2 3.718 -4.927 1.539 0.000 +ATOM 5 CA TYR 3 4.962 -5.463 -3.287 0.000 +ATOM 6 CB TYR 3 5.153 -4.798 -5.672 0.000 +ATOM 7 CA ILE 4 5.495 -8.849 -1.647 0.000 +ATOM 8 CB ILE 4 5.518 -9.185 0.097 0.000 +ATOM 9 CA GLN 5 1.898 -9.965 -2.156 0.000 +ATOM 10 CB GLN 5 1.518 -11.147 -0.291 0.000 +ATOM 11 CA TRP 6 1.049 -7.026 -4.410 0.000 +ATOM 12 CB TRP 6 1.429 -4.992 -5.993 0.000 +ATOM 13 CA LEU 7 -0.319 -4.879 -1.589 0.000 +ATOM 14 CB LEU 7 -0.644 -5.886 0.036 0.000 +ATOM 15 CA LYS 8 0.620 -1.674 -3.403 0.000 +ATOM 16 CB LYS 8 3.153 -1.635 -3.600 0.000 +ATOM 17 CA ASP 9 -2.181 -2.088 -5.938 0.000 +ATOM 18 CB ASP 9 -3.435 -2.610 -6.975 0.000 +ATOM 19 CA GLY 10 -4.598 0.114 -4.002 0.000 +ATOM 20 CA GLY 11 -1.997 2.655 -2.898 0.000 +ATOM 21 CA PRO 12 -0.117 5.336 -4.826 0.000 +ATOM 22 CB PRO 12 0.641 5.504 -3.727 0.000 +ATOM 23 CA SER 13 1.529 2.761 -7.085 0.000 +ATOM 24 CB SER 13 1.600 1.764 -6.516 0.000 +ATOM 25 CA SER 14 -1.758 1.907 -8.790 0.000 +ATOM 26 CB SER 14 -2.424 1.407 -7.997 0.000 +ATOM 27 CA GLY 15 -3.296 5.356 -8.364 0.000 +ATOM 28 CA ARG 16 -6.029 4.273 -5.957 0.000 +ATOM 29 CB ARG 16 -4.162 5.562 -3.965 0.000 +ATOM 30 CA PRO 17 -7.858 6.358 -3.359 0.000 +ATOM 31 CB PRO 17 -8.889 5.656 -3.861 0.000 +ATOM 32 CA PRO 18 -6.490 6.371 0.186 0.000 +ATOM 33 CB PRO 18 -5.883 7.486 -0.260 0.000 +ATOM 34 CA PRO 19 -8.517 4.585 2.857 0.000 +ATOM 35 CB PRO 19 -7.504 3.738 3.115 0.000 +ATOM 36 CA SER 20 -8.040 7.380 5.387 0.000 +ATOM 37 CB SER 20 -6.981 7.816 5.486 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