X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=blobdiff_plain;f=examples%2Funres%2FCSA%2FGAB%2Fglobal%2Funrestrained%2Foutputs%2F1l2y_csa%40008.pdb;fp=examples%2Funres%2FCSA%2FGAB%2Fglobal%2Funrestrained%2Foutputs%2F1l2y_csa%40008.pdb;h=5206dc25703f9c7aa3dada7bd0445d853a6221eb;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@008.pdb b/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@008.pdb new file mode 100644 index 0000000..5206dc2 --- /dev/null +++ b/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@008.pdb @@ -0,0 +1,60 @@ +REMARK GM 8 e 60048 m 119 ENERGY -6.92484E+01 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 5.309 0.712 0.230 0.000 +ATOM 3 CA LEU 2 5.605 -3.344 0.000 0.000 +ATOM 4 CB LEU 2 5.809 -5.078 -0.844 0.000 +ATOM 5 CA TYR 3 9.251 -3.143 1.051 0.000 +ATOM 6 CB TYR 3 10.242 -2.992 3.324 0.000 +ATOM 7 CA ILE 4 10.421 -3.340 -2.559 0.000 +ATOM 8 CB ILE 4 10.234 -4.920 -3.349 0.000 +ATOM 9 CA GLN 5 9.171 0.196 -3.169 0.000 +ATOM 10 CB GLN 5 7.060 -0.542 -3.033 0.000 +ATOM 11 CA TRP 6 10.302 1.247 0.304 0.000 +ATOM 12 CB TRP 6 10.796 3.211 1.942 0.000 +ATOM 13 CA LEU 7 13.846 0.027 -0.320 0.000 +ATOM 14 CB LEU 7 13.665 -1.851 0.129 0.000 +ATOM 15 CA LYS 8 14.501 2.921 -2.694 0.000 +ATOM 16 CB LYS 8 11.964 2.913 -2.823 0.000 +ATOM 17 CA ASP 9 16.529 4.842 -0.117 0.000 +ATOM 18 CB ASP 9 17.968 5.684 0.260 0.000 +ATOM 19 CA GLY 10 14.668 6.200 2.905 0.000 +ATOM 20 CA GLY 11 12.024 8.927 3.006 0.000 +ATOM 21 CA PRO 12 10.750 10.584 6.180 0.000 +ATOM 22 CB PRO 12 10.432 11.656 5.434 0.000 +ATOM 23 CA SER 13 10.487 7.296 8.067 0.000 +ATOM 24 CB SER 13 10.224 6.437 7.349 0.000 +ATOM 25 CA SER 14 13.219 5.359 9.865 0.000 +ATOM 26 CB SER 14 12.830 4.825 10.806 0.000 +ATOM 27 CA GLY 15 14.909 2.311 8.351 0.000 +ATOM 28 CA ARG 16 13.128 -1.043 8.496 0.000 +ATOM 29 CB ARG 16 11.464 0.982 6.997 0.000 +ATOM 30 CA PRO 17 14.363 -4.471 7.418 0.000 +ATOM 31 CB PRO 17 13.762 -4.764 8.585 0.000 +ATOM 32 CA PRO 18 14.065 -5.340 3.731 0.000 +ATOM 33 CB PRO 18 15.340 -5.747 3.866 0.000 +ATOM 34 CA PRO 19 11.557 -7.903 2.474 0.000 +ATOM 35 CB PRO 19 10.863 -7.179 1.577 0.000 +ATOM 36 CA SER 20 13.043 -9.654 -0.553 0.000 +ATOM 37 CB SER 20 12.689 -9.222 -1.559 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