X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=blobdiff_plain;f=examples%2Funres%2FCSA%2FGAB%2Fglobal%2Frestrained%2Foutputs%2F1l2y_csa%40019.pdb;fp=examples%2Funres%2FCSA%2FGAB%2Fglobal%2Frestrained%2Foutputs%2F1l2y_csa%40019.pdb;h=2a06e1f34f4875da8cd1c81eed2fafdacbdb3bc7;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/GAB/global/restrained/outputs/1l2y_csa@019.pdb b/examples/unres/CSA/GAB/global/restrained/outputs/1l2y_csa@019.pdb new file mode 100644 index 0000000..2a06e1f --- /dev/null +++ b/examples/unres/CSA/GAB/global/restrained/outputs/1l2y_csa@019.pdb @@ -0,0 +1,60 @@ +REMARK GM 19 e 513323 m 1495 ENERGY -8.55893E+01 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 4.242 1.453 0.728 0.000 +ATOM 3 CA LEU 2 4.040 -3.792 0.000 0.000 +ATOM 4 CB LEU 2 4.324 -5.559 0.747 0.000 +ATOM 5 CA TYR 3 1.505 -4.140 -2.809 0.000 +ATOM 6 CB TYR 3 0.061 -2.410 -3.855 0.000 +ATOM 7 CA ILE 4 2.195 -7.859 -3.174 0.000 +ATOM 8 CB ILE 4 3.852 -8.499 -3.214 0.000 +ATOM 9 CA GLN 5 -0.115 -8.585 -0.245 0.000 +ATOM 10 CB GLN 5 0.031 -6.671 0.910 0.000 +ATOM 11 CA TRP 6 -2.903 -6.675 -1.984 0.000 +ATOM 12 CB TRP 6 -5.396 -5.958 -1.756 0.000 +ATOM 13 CA LEU 7 -2.169 -8.527 -5.220 0.000 +ATOM 14 CB LEU 7 -0.747 -8.925 -6.477 0.000 +ATOM 15 CA LYS 8 -2.585 -11.858 -3.439 0.000 +ATOM 16 CB LYS 8 -0.134 -12.126 -2.828 0.000 +ATOM 17 CA ASP 9 -6.177 -11.004 -2.541 0.000 +ATOM 18 CB ASP 9 -7.386 -9.859 -2.155 0.000 +ATOM 19 CA GLY 10 -7.474 -13.340 -5.243 0.000 +ATOM 20 CA GLY 11 -4.564 -13.276 -7.685 0.000 +ATOM 21 CA PRO 12 -5.003 -9.752 -9.036 0.000 +ATOM 22 CB PRO 12 -3.816 -9.817 -9.664 0.000 +ATOM 23 CA SER 13 -8.698 -9.660 -8.154 0.000 +ATOM 24 CB SER 13 -9.173 -10.589 -7.670 0.000 +ATOM 25 CA SER 14 -8.166 -7.552 -5.037 0.000 +ATOM 26 CB SER 14 -7.038 -7.328 -5.062 0.000 +ATOM 27 CA GLY 15 -9.533 -4.040 -4.548 0.000 +ATOM 28 CA ARG 16 -6.260 -2.284 -5.350 0.000 +ATOM 29 CB ARG 16 -3.740 -3.905 -4.971 0.000 +ATOM 30 CA PRO 17 -4.303 -2.476 -8.602 0.000 +ATOM 31 CB PRO 17 -4.096 -1.188 -8.273 0.000 +ATOM 32 CA PRO 18 -1.861 -5.365 -8.961 0.000 +ATOM 33 CB PRO 18 -2.505 -5.580 -10.123 0.000 +ATOM 34 CA PRO 19 1.885 -4.732 -8.984 0.000 +ATOM 35 CB PRO 19 1.817 -5.055 -7.680 0.000 +ATOM 36 CA SER 20 2.509 -7.563 -11.441 0.000 +ATOM 37 CB SER 20 1.607 -8.276 -11.428 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