X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=blobdiff_plain;f=examples%2Funres%2FCSA%2F4P%2Foutputs%2F1l2y_csa%40015.pdb;fp=examples%2Funres%2FCSA%2F4P%2Foutputs%2F1l2y_csa%40015.pdb;h=ae26438fa21019868216046cef2234ec78b4cfb0;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/4P/outputs/1l2y_csa@015.pdb b/examples/unres/CSA/4P/outputs/1l2y_csa@015.pdb new file mode 100644 index 0000000..ae26438 --- /dev/null +++ b/examples/unres/CSA/4P/outputs/1l2y_csa@015.pdb @@ -0,0 +1,64 @@ +REMARK GM 15 e 612853 m 2321 ENERGY -2.04363E+02 +SHEET 1 B1 2 GLN 5 LEU 7 0 +SHEET 2 B1 2 GLY 10 PRO 12 -1 N PRO 12 O GLN 5 +SHEET 1 B2 2 ASP 9 GLY 11 0 +SHEET 2 B2 2 SER 14 ARG 16 -1 N ARG 16 O ASP 9 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 4.262 1.424 0.771 0.000 +ATOM 3 CA LEU 2 4.039 -3.792 0.000 0.000 +ATOM 4 CB LEU 2 5.074 -4.992 1.118 0.000 +ATOM 5 CA TYR 3 1.468 -4.133 -2.777 0.000 +ATOM 6 CB TYR 3 -0.097 -2.513 -3.826 0.000 +ATOM 7 CA ILE 4 2.455 -7.737 -3.464 0.000 +ATOM 8 CB ILE 4 3.743 -8.578 -2.576 0.000 +ATOM 9 CA GLN 5 0.556 -9.024 -0.434 0.000 +ATOM 10 CB GLN 5 0.718 -8.414 1.715 0.000 +ATOM 11 CA TRP 6 -2.327 -6.636 -1.093 0.000 +ATOM 12 CB TRP 6 -3.758 -4.472 -0.862 0.000 +ATOM 13 CA LEU 7 -2.763 -7.830 -4.674 0.000 +ATOM 14 CB LEU 7 -2.349 -6.305 -5.798 0.000 +ATOM 15 CA LYS 8 -2.952 -11.479 -3.629 0.000 +ATOM 16 CB LYS 8 -0.931 -11.354 -2.094 0.000 +ATOM 17 CA ASP 9 -6.589 -11.663 -4.715 0.000 +ATOM 18 CB ASP 9 -7.871 -11.764 -3.589 0.000 +ATOM 19 CA GLY 10 -7.069 -7.977 -3.924 0.000 +ATOM 20 CA GLY 11 -5.925 -8.336 -0.318 0.000 +ATOM 21 CA PRO 12 -4.416 -11.772 0.280 0.000 +ATOM 22 CB PRO 12 -3.519 -11.173 1.084 0.000 +ATOM 23 CA SER 13 -7.784 -13.297 -0.597 0.000 +ATOM 24 CB SER 13 -8.202 -14.035 0.180 0.000 +ATOM 25 CA SER 14 -9.697 -10.253 0.636 0.000 +ATOM 26 CB SER 14 -8.897 -10.187 1.460 0.000 +ATOM 27 CA GLY 15 -11.154 -9.313 -2.745 0.000 +ATOM 28 CA ARG 16 -11.924 -12.874 -3.827 0.000 +ATOM 29 CB ARG 16 -10.694 -11.552 -6.248 0.000 +ATOM 30 CA PRO 17 -14.854 -14.753 -2.304 0.000 +ATOM 31 CB PRO 17 -14.810 -15.285 -3.539 0.000 +ATOM 32 CA PRO 18 -14.400 -16.242 1.163 0.000 +ATOM 33 CB PRO 18 -15.504 -15.513 1.408 0.000 +ATOM 34 CA PRO 19 -14.084 -20.017 1.456 0.000 +ATOM 35 CB PRO 19 -12.811 -19.829 1.848 0.000 +ATOM 36 CA SER 20 -16.332 -20.176 4.515 0.000 +ATOM 37 CB SER 20 -16.161 -19.378 5.325 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