X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=blobdiff_plain;f=examples%2Funres%2FCSA%2FGAB%2Fglobal%2Funrestrained%2Foutputs%2F1l2y_csa%40011.pdb;fp=examples%2Funres%2FCSA%2FGAB%2Fglobal%2Funrestrained%2Foutputs%2F1l2y_csa%40011.pdb;h=886c9d24fd4861aae4058d19e49c07b871d40ddf;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@011.pdb b/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@011.pdb new file mode 100644 index 0000000..886c9d2 --- /dev/null +++ b/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@011.pdb @@ -0,0 +1,60 @@ +REMARK GM 11 e 237337 m 583 ENERGY -7.17417E+01 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 5.398 0.373 0.379 0.000 +ATOM 3 CA LEU 2 4.056 -3.791 0.000 0.000 +ATOM 4 CB LEU 2 3.607 -5.381 1.015 0.000 +ATOM 5 CA TYR 3 5.224 -5.026 -3.399 0.000 +ATOM 6 CB TYR 3 5.644 -3.723 -5.471 0.000 +ATOM 7 CA ILE 4 5.375 -8.648 -2.258 0.000 +ATOM 8 CB ILE 4 6.397 -9.132 -0.888 0.000 +ATOM 9 CA GLN 5 1.689 -9.100 -3.062 0.000 +ATOM 10 CB GLN 5 0.633 -7.673 -1.695 0.000 +ATOM 11 CA TRP 6 2.190 -7.309 -6.376 0.000 +ATOM 12 CB TRP 6 3.630 -6.093 -8.174 0.000 +ATOM 13 CA LEU 7 4.540 -10.029 -7.606 0.000 +ATOM 14 CB LEU 7 5.578 -10.872 -6.202 0.000 +ATOM 15 CA LYS 8 2.166 -10.843 -10.459 0.000 +ATOM 16 CB LYS 8 0.679 -10.313 -8.469 0.000 +ATOM 17 CA ASP 9 3.828 -8.292 -12.734 0.000 +ATOM 18 CB ASP 9 3.084 -6.770 -12.510 0.000 +ATOM 19 CA GLY 10 7.008 -7.957 -10.681 0.000 +ATOM 20 CA GLY 11 8.286 -5.065 -8.574 0.000 +ATOM 21 CA PRO 12 8.097 -2.206 -11.070 0.000 +ATOM 22 CB PRO 12 9.356 -1.767 -10.895 0.000 +ATOM 23 CA SER 13 9.238 -4.431 -13.932 0.000 +ATOM 24 CB SER 13 9.910 -3.931 -14.720 0.000 +ATOM 25 CA SER 14 12.008 -5.983 -11.844 0.000 +ATOM 26 CB SER 14 12.133 -5.313 -10.918 0.000 +ATOM 27 CA GLY 15 11.954 -9.283 -9.961 0.000 +ATOM 28 CA ARG 16 10.337 -10.140 -6.630 0.000 +ATOM 29 CB ARG 16 10.180 -10.982 -3.734 0.000 +ATOM 30 CA PRO 17 10.069 -7.275 -4.148 0.000 +ATOM 31 CB PRO 17 8.874 -7.201 -4.760 0.000 +ATOM 32 CA PRO 18 11.141 -7.894 -0.556 0.000 +ATOM 33 CB PRO 18 12.419 -7.526 -0.758 0.000 +ATOM 34 CA PRO 19 9.746 -4.837 1.218 0.000 +ATOM 35 CB PRO 19 8.764 -5.053 0.325 0.000 +ATOM 36 CA SER 20 10.885 -4.316 4.806 0.000 +ATOM 37 CB SER 20 11.963 -4.643 5.036 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