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%40037.pdb;fp=examples%2Funres%2FCSA%2FGAB%2Fglobal%2Funrestrained%2Foutputs%2F1l2y_csa%40037.pdb;h=fee2658207dd11169306d7a3bdce2ef8c5b629a2;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@037.pdb b/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@037.pdb new file mode 100644 index 0000000..fee2658 --- /dev/null +++ b/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@037.pdb @@ -0,0 +1,61 @@ +REMARK GM 37 e 8749202 m 28778 ENERGY -9.23023E+01 +HELIX 1 H1 TYR 3 GLY 10 1 7 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 5.418 0.441 0.152 0.000 +ATOM 3 CA LEU 2 4.056 -3.791 0.000 0.000 +ATOM 4 CB LEU 2 3.630 -5.640 -0.401 0.000 +ATOM 5 CA TYR 3 6.054 -3.754 -3.232 0.000 +ATOM 6 CB TYR 3 5.893 -1.304 -3.605 0.000 +ATOM 7 CA ILE 4 9.298 -3.212 -1.329 0.000 +ATOM 8 CB ILE 4 10.000 -1.616 -0.993 0.000 +ATOM 9 CA GLN 5 8.313 -5.876 1.196 0.000 +ATOM 10 CB GLN 5 7.184 -4.403 2.451 0.000 +ATOM 11 CA TRP 6 7.144 -8.134 -1.628 0.000 +ATOM 12 CB TRP 6 5.708 -10.172 -2.383 0.000 +ATOM 13 CA LEU 7 10.213 -7.234 -3.680 0.000 +ATOM 14 CB LEU 7 8.996 -6.654 -5.075 0.000 +ATOM 15 CA LYS 8 12.461 -7.938 -0.699 0.000 +ATOM 16 CB LYS 8 12.897 -5.584 0.154 0.000 +ATOM 17 CA ASP 9 10.722 -11.244 -0.002 0.000 +ATOM 18 CB ASP 9 9.263 -10.594 0.605 0.000 +ATOM 19 CA GLY 10 12.575 -12.836 -2.913 0.000 +ATOM 20 CA GLY 11 11.155 -10.923 -5.873 0.000 +ATOM 21 CA PRO 12 7.579 -12.186 -5.625 0.000 +ATOM 22 CB PRO 12 7.026 -11.092 -6.178 0.000 +ATOM 23 CA SER 13 8.675 -15.599 -4.365 0.000 +ATOM 24 CB SER 13 9.803 -15.702 -4.167 0.000 +ATOM 25 CA SER 14 7.634 -14.916 -0.774 0.000 +ATOM 26 CB SER 14 7.278 -13.837 -0.599 0.000 +ATOM 27 CA GLY 15 4.473 -16.479 0.641 0.000 +ATOM 28 CA ARG 16 2.290 -13.445 -0.049 0.000 +ATOM 29 CB ARG 16 3.968 -11.104 0.858 0.000 +ATOM 30 CA PRO 17 0.558 -12.229 -3.204 0.000 +ATOM 31 CB PRO 17 0.562 -11.055 -2.548 0.000 +ATOM 32 CA PRO 18 2.846 -10.888 -5.926 0.000 +ATOM 33 CB PRO 18 2.208 -11.823 -6.652 0.000 +ATOM 34 CA PRO 19 2.711 -7.151 -6.603 0.000 +ATOM 35 CB PRO 19 3.615 -7.054 -5.612 0.000 +ATOM 36 CA SER 20 4.450 -7.431 -9.971 0.000 +ATOM 37 CB SER 20 5.568 -7.679 -9.869 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