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%40005.pdb;fp=examples%2Funres%2FCSA%2FGAB%2Flocal%2Foutputs%2F1l2y_csa%40005.pdb;h=61c5681d6ad62a8dd2a1c2f5480083b4b82beace;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/GAB/local/outputs/1l2y_csa@005.pdb b/examples/unres/CSA/GAB/local/outputs/1l2y_csa@005.pdb new file mode 100644 index 0000000..61c5681 --- /dev/null +++ b/examples/unres/CSA/GAB/local/outputs/1l2y_csa@005.pdb @@ -0,0 +1,61 @@ +REMARK GM 5 e 6753 m 9 rms 2.13 %NC 66.7 ENERGY -8.82952E+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 5.161 0.845 0.519 0.000 +ATOM 3 CA LEU 2 5.252 -3.512 0.000 0.000 +ATOM 4 CB LEU 2 5.722 -5.339 -0.446 0.000 +ATOM 5 CA TYR 3 8.536 -2.298 -1.476 0.000 +ATOM 6 CB TYR 3 8.042 0.039 -2.159 0.000 +ATOM 7 CA ILE 4 9.844 -1.332 1.958 0.000 +ATOM 8 CB ILE 4 9.876 0.312 2.630 0.000 +ATOM 9 CA GLN 5 8.441 -4.538 3.439 0.000 +ATOM 10 CB GLN 5 6.519 -3.446 3.805 0.000 +ATOM 11 CA TRP 6 9.822 -6.527 0.511 0.000 +ATOM 12 CB TRP 6 10.000 -8.762 -0.816 0.000 +ATOM 13 CA LEU 7 13.096 -4.605 0.666 0.000 +ATOM 14 CB LEU 7 12.615 -3.771 -1.017 0.000 +ATOM 15 CA LYS 8 13.302 -5.203 4.413 0.000 +ATOM 16 CB LYS 8 12.825 -2.834 5.201 0.000 +ATOM 17 CA ASP 9 12.238 -8.829 4.014 0.000 +ATOM 18 CB ASP 9 11.213 -9.936 3.212 0.000 +ATOM 19 CA GLY 10 15.613 -9.709 2.504 0.000 +ATOM 20 CA GLY 11 15.944 -8.065 -0.906 0.000 +ATOM 21 CA PRO 12 13.424 -9.317 -3.459 0.000 +ATOM 22 CB PRO 12 13.014 -8.084 -3.804 0.000 +ATOM 23 CA SER 13 14.607 -12.913 -3.124 0.000 +ATOM 24 CB SER 13 15.693 -13.047 -2.772 0.000 +ATOM 25 CA SER 14 12.968 -13.306 0.282 0.000 +ATOM 26 CB SER 14 13.056 -12.160 0.242 0.000 +ATOM 27 CA GLY 15 9.972 -15.560 0.898 0.000 +ATOM 28 CA ARG 16 7.412 -12.877 0.067 0.000 +ATOM 29 CB ARG 16 7.328 -10.204 1.469 0.000 +ATOM 30 CA PRO 17 6.710 -11.605 -3.444 0.000 +ATOM 31 CB PRO 17 5.661 -11.037 -2.823 0.000 +ATOM 32 CA PRO 18 9.208 -9.313 -5.161 0.000 +ATOM 33 CB PRO 18 9.118 -10.224 -6.147 0.000 +ATOM 34 CA PRO 19 8.276 -5.689 -5.827 0.000 +ATOM 35 CB PRO 19 8.699 -5.585 -4.555 0.000 +ATOM 36 CA SER 20 9.191 -4.218 -9.210 0.000 +ATOM 37 CB SER 20 8.283 -3.736 -9.725 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