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%40004.pdb;fp=examples%2Funres%2FCSA%2FGAB%2Fglobal%2Frestrained%2Foutputs%2F1l2y_csa%40004.pdb;h=7dc7eb0c6260b23c6ca6f70f9f6652bf5de38cc5;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/GAB/global/restrained/outputs/1l2y_csa@004.pdb b/examples/unres/CSA/GAB/global/restrained/outputs/1l2y_csa@004.pdb new file mode 100644 index 0000000..7dc7eb0 --- /dev/null +++ b/examples/unres/CSA/GAB/global/restrained/outputs/1l2y_csa@004.pdb @@ -0,0 +1,60 @@ +REMARK GM 4 e 7670 m 16 ENERGY -7.14006E+01 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 4.281 1.404 0.796 0.000 +ATOM 3 CA LEU 2 4.038 -3.793 0.000 0.000 +ATOM 4 CB LEU 2 4.748 -4.746 1.532 0.000 +ATOM 5 CA TYR 3 1.459 -4.078 -2.776 0.000 +ATOM 6 CB TYR 3 -0.899 -4.441 -3.467 0.000 +ATOM 7 CA ILE 4 4.092 -3.703 -5.491 0.000 +ATOM 8 CB ILE 4 4.363 -2.075 -6.148 0.000 +ATOM 9 CA GLN 5 6.595 -5.813 -3.562 0.000 +ATOM 10 CB GLN 5 7.088 -3.936 -2.443 0.000 +ATOM 11 CA TRP 6 5.311 -9.016 -5.153 0.000 +ATOM 12 CB TRP 6 4.278 -11.166 -6.200 0.000 +ATOM 13 CA LEU 7 1.695 -8.384 -4.174 0.000 +ATOM 14 CB LEU 7 2.100 -8.097 -2.299 0.000 +ATOM 15 CA LYS 8 0.912 -6.888 -7.578 0.000 +ATOM 16 CB LYS 8 0.391 -4.428 -7.212 0.000 +ATOM 17 CA ASP 9 3.448 -9.077 -9.370 0.000 +ATOM 18 CB ASP 9 4.968 -9.725 -9.806 0.000 +ATOM 19 CA GLY 10 1.052 -12.011 -9.674 0.000 +ATOM 20 CA GLY 11 -2.688 -12.115 -9.009 0.000 +ATOM 21 CA PRO 12 -3.856 -15.713 -8.648 0.000 +ATOM 22 CB PRO 12 -4.552 -15.618 -9.795 0.000 +ATOM 23 CA SER 13 -0.439 -17.078 -9.595 0.000 +ATOM 24 CB SER 13 0.303 -16.272 -9.945 0.000 +ATOM 25 CA SER 14 0.927 -16.627 -6.078 0.000 +ATOM 26 CB SER 14 2.053 -16.851 -6.014 0.000 +ATOM 27 CA GLY 15 1.101 -13.438 -4.019 0.000 +ATOM 28 CA ARG 16 3.395 -13.396 -0.990 0.000 +ATOM 29 CB ARG 16 4.728 -14.411 -3.503 0.000 +ATOM 30 CA PRO 17 4.341 -10.582 1.382 0.000 +ATOM 31 CB PRO 17 4.190 -11.577 2.274 0.000 +ATOM 32 CA PRO 18 7.616 -8.737 0.824 0.000 +ATOM 33 CB PRO 18 7.002 -8.417 -0.329 0.000 +ATOM 34 CA PRO 19 9.063 -6.575 3.595 0.000 +ATOM 35 CB PRO 19 10.043 -7.493 3.532 0.000 +ATOM 36 CA SER 20 9.274 -2.803 3.192 0.000 +ATOM 37 CB SER 20 8.611 -2.410 2.339 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