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%40015.pdb;fp=examples%2Funres%2FCSA%2FGAB%2Fglobal%2Funrestrained%2Foutputs%2F1l2y_csa%40015.pdb;h=c9b8170c7dc4236841ce5a2cd58f9fdf4763d334;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@015.pdb b/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@015.pdb new file mode 100644 index 0000000..c9b8170 --- /dev/null +++ b/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@015.pdb @@ -0,0 +1,61 @@ +REMARK GM 15 e 417870 m 1118 ENERGY -7.87462E+01 +HELIX 1 H1 LEU 2 ASP 9 1 7 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 5.259 0.817 0.200 0.000 +ATOM 3 CA LEU 2 5.436 -3.430 0.000 0.000 +ATOM 4 CB LEU 2 5.653 -5.221 -0.711 0.000 +ATOM 5 CA TYR 3 8.850 -1.914 -0.701 0.000 +ATOM 6 CB TYR 3 9.659 -3.818 -2.077 0.000 +ATOM 7 CA ILE 4 9.233 -0.876 2.934 0.000 +ATOM 8 CB ILE 4 8.799 0.742 3.523 0.000 +ATOM 9 CA GLN 5 8.019 -4.298 4.055 0.000 +ATOM 10 CB GLN 5 7.125 -6.226 3.347 0.000 +ATOM 11 CA TRP 6 10.525 -5.939 1.716 0.000 +ATOM 12 CB TRP 6 9.854 -7.574 -0.197 0.000 +ATOM 13 CA LEU 7 13.251 -3.553 2.865 0.000 +ATOM 14 CB LEU 7 13.505 -1.851 1.972 0.000 +ATOM 15 CA LYS 8 12.362 -4.250 6.494 0.000 +ATOM 16 CB LYS 8 10.530 -2.545 6.932 0.000 +ATOM 17 CA ASP 9 12.341 -8.004 5.904 0.000 +ATOM 18 CB ASP 9 12.457 -8.132 4.204 0.000 +ATOM 19 CA GLY 10 16.119 -8.240 6.243 0.000 +ATOM 20 CA GLY 11 16.780 -8.667 2.526 0.000 +ATOM 21 CA PRO 12 16.820 -6.906 -0.841 0.000 +ATOM 22 CB PRO 12 16.822 -8.063 -1.527 0.000 +ATOM 23 CA SER 13 14.076 -5.194 -2.835 0.000 +ATOM 24 CB SER 13 13.636 -4.432 -2.095 0.000 +ATOM 25 CA SER 14 14.102 -3.037 -5.964 0.000 +ATOM 26 CB SER 14 14.580 -3.524 -6.889 0.000 +ATOM 27 CA GLY 15 10.655 -2.460 -7.455 0.000 +ATOM 28 CA ARG 16 10.017 -6.110 -8.295 0.000 +ATOM 29 CB ARG 16 12.540 -6.689 -6.739 0.000 +ATOM 30 CA PRO 17 9.455 -8.837 -5.708 0.000 +ATOM 31 CB PRO 17 8.745 -9.398 -6.704 0.000 +ATOM 32 CA PRO 18 12.409 -10.753 -4.279 0.000 +ATOM 33 CB PRO 18 12.662 -9.679 -3.509 0.000 +ATOM 34 CA PRO 19 10.433 -13.542 -2.620 0.000 +ATOM 35 CB PRO 19 9.690 -13.348 -3.724 0.000 +ATOM 36 CA SER 20 12.432 -15.808 -0.316 0.000 +ATOM 37 CB SER 20 13.276 -15.290 0.269 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