X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=blobdiff_plain;f=examples%2Funres%2FCSA%2FGAB%2Flocal%2Foutputs%2F1l2y_csa%40008.pdb;fp=examples%2Funres%2FCSA%2FGAB%2Flocal%2Foutputs%2F1l2y_csa%40008.pdb;h=c98631f6eefd5c041e9be189cbcb15beff280fe1;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/GAB/local/outputs/1l2y_csa@008.pdb b/examples/unres/CSA/GAB/local/outputs/1l2y_csa@008.pdb new file mode 100644 index 0000000..c98631f --- /dev/null +++ b/examples/unres/CSA/GAB/local/outputs/1l2y_csa@008.pdb @@ -0,0 +1,61 @@ +REMARK GM 8 e 130954 m 181 rms 2.30 %NC 53.3 ENERGY -8.91419E+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 5.128 0.923 0.470 0.000 +ATOM 3 CA LEU 2 5.226 -3.522 0.000 0.000 +ATOM 4 CB LEU 2 5.579 -5.325 -0.620 0.000 +ATOM 5 CA TYR 3 8.538 -2.332 -1.433 0.000 +ATOM 6 CB TYR 3 8.116 0.028 -2.085 0.000 +ATOM 7 CA ILE 4 9.780 -1.225 1.984 0.000 +ATOM 8 CB ILE 4 9.765 0.450 2.572 0.000 +ATOM 9 CA GLN 5 8.371 -4.361 3.603 0.000 +ATOM 10 CB GLN 5 6.352 -3.412 3.797 0.000 +ATOM 11 CA TRP 6 9.741 -6.462 0.749 0.000 +ATOM 12 CB TRP 6 9.535 -8.633 -0.676 0.000 +ATOM 13 CA LEU 7 13.001 -4.510 0.803 0.000 +ATOM 14 CB LEU 7 12.596 -3.897 -0.992 0.000 +ATOM 15 CA LYS 8 13.292 -5.014 4.558 0.000 +ATOM 16 CB LYS 8 12.483 -2.750 5.380 0.000 +ATOM 17 CA ASP 9 12.456 -8.709 4.263 0.000 +ATOM 18 CB ASP 9 10.796 -8.433 3.964 0.000 +ATOM 19 CA GLY 10 15.937 -9.413 2.911 0.000 +ATOM 20 CA GLY 11 15.940 -7.524 -0.386 0.000 +ATOM 21 CA PRO 12 13.287 -9.562 -2.188 0.000 +ATOM 22 CB PRO 12 12.932 -8.550 -3.000 0.000 +ATOM 23 CA SER 13 14.301 -12.780 -0.440 0.000 +ATOM 24 CB SER 13 15.114 -12.651 0.363 0.000 +ATOM 25 CA SER 14 11.329 -12.785 1.927 0.000 +ATOM 26 CB SER 14 10.706 -11.820 1.888 0.000 +ATOM 27 CA GLY 15 8.302 -15.038 1.471 0.000 +ATOM 28 CA ARG 16 6.237 -12.422 -0.355 0.000 +ATOM 29 CB ARG 16 6.577 -9.923 1.306 0.000 +ATOM 30 CA PRO 17 6.372 -11.321 -3.989 0.000 +ATOM 31 CB PRO 17 5.245 -10.689 -3.615 0.000 +ATOM 32 CA PRO 18 9.383 -9.349 -5.207 0.000 +ATOM 33 CB PRO 18 9.353 -10.229 -6.224 0.000 +ATOM 34 CA PRO 19 8.969 -5.660 -6.021 0.000 +ATOM 35 CB PRO 19 9.038 -5.598 -4.679 0.000 +ATOM 36 CA SER 20 10.724 -4.346 -9.124 0.000 +ATOM 37 CB SER 20 9.933 -4.442 -9.952 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