X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=blobdiff_plain;f=examples%2Funres%2FCSA%2F4P%2Foutputs%2F1l2y_csa%40001.pdb;fp=examples%2Funres%2FCSA%2F4P%2Foutputs%2F1l2y_csa%40001.pdb;h=76ad71647ea1f2ef5b8a6316c5c34a496ede827a;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/4P/outputs/1l2y_csa@001.pdb b/examples/unres/CSA/4P/outputs/1l2y_csa@001.pdb new file mode 100644 index 0000000..76ad716 --- /dev/null +++ b/examples/unres/CSA/4P/outputs/1l2y_csa@001.pdb @@ -0,0 +1,60 @@ +REMARK GM 1 e 212 m 1 ENERGY -3.48581E+01 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 5.251 0.829 0.205 0.000 +ATOM 3 CA LEU 2 5.371 -3.460 0.000 0.000 +ATOM 4 CB LEU 2 7.152 -3.352 -0.760 0.000 +ATOM 5 CA TYR 3 2.855 -4.779 2.523 0.000 +ATOM 6 CB TYR 3 2.481 -4.340 4.939 0.000 +ATOM 7 CA ILE 4 1.122 -7.017 -0.012 0.000 +ATOM 8 CB ILE 4 1.212 -6.808 -1.774 0.000 +ATOM 9 CA GLN 5 2.961 -10.112 -1.226 0.000 +ATOM 10 CB GLN 5 3.440 -10.811 0.848 0.000 +ATOM 11 CA TRP 6 1.929 -11.892 -4.421 0.000 +ATOM 12 CB TRP 6 -0.064 -11.651 -6.081 0.000 +ATOM 13 CA LEU 7 3.845 -14.863 -5.816 0.000 +ATOM 14 CB LEU 7 5.291 -15.447 -6.968 0.000 +ATOM 15 CA LYS 8 4.764 -16.149 -2.360 0.000 +ATOM 16 CB LYS 8 7.069 -15.535 -1.486 0.000 +ATOM 17 CA ASP 9 2.470 -18.087 -0.031 0.000 +ATOM 18 CB ASP 9 2.116 -19.636 -0.661 0.000 +ATOM 19 CA GLY 10 4.073 -19.892 2.903 0.000 +ATOM 20 CA GLY 11 7.672 -19.362 4.003 0.000 +ATOM 21 CA PRO 12 10.334 -17.242 2.313 0.000 +ATOM 22 CB PRO 12 10.922 -17.506 3.493 0.000 +ATOM 23 CA SER 13 11.234 -17.867 -1.326 0.000 +ATOM 24 CB SER 13 11.971 -18.734 -1.493 0.000 +ATOM 25 CA SER 14 8.898 -19.443 -3.875 0.000 +ATOM 26 CB SER 14 8.145 -18.628 -4.177 0.000 +ATOM 27 CA GLY 15 9.580 -22.508 -6.016 0.000 +ATOM 28 CA ARG 16 8.000 -24.067 -9.099 0.000 +ATOM 29 CB ARG 16 10.012 -22.169 -10.309 0.000 +ATOM 30 CA PRO 17 5.171 -26.597 -9.294 0.000 +ATOM 31 CB PRO 17 4.653 -25.553 -9.964 0.000 +ATOM 32 CA PRO 18 6.019 -30.242 -9.954 0.000 +ATOM 33 CB PRO 18 5.931 -29.874 -11.245 0.000 +ATOM 34 CA PRO 19 9.475 -29.925 -8.406 0.000 +ATOM 35 CB PRO 19 9.191 -28.629 -8.629 0.000 +ATOM 36 CA SER 20 10.280 -31.597 -5.090 0.000 +ATOM 37 CB SER 20 9.759 -31.277 -4.116 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