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%40024.pdb;fp=examples%2Funres%2FCSA%2FGAB%2Flocal%2Foutputs%2F1l2y_csa%40024.pdb;h=1ea1a7c1dc1a7cc0380457a7a963d456d6b47896;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/GAB/local/outputs/1l2y_csa@024.pdb b/examples/unres/CSA/GAB/local/outputs/1l2y_csa@024.pdb new file mode 100644 index 0000000..1ea1a7c --- /dev/null +++ b/examples/unres/CSA/GAB/local/outputs/1l2y_csa@024.pdb @@ -0,0 +1,61 @@ +REMARK GM 24 e 1646163 m 4845 rms 2.31 %NC 53.3 ENERGY -9.08499E+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 5.415 0.457 0.138 0.000 +ATOM 3 CA LEU 2 4.056 -3.791 0.000 0.000 +ATOM 4 CB LEU 2 3.503 -5.588 -0.478 0.000 +ATOM 5 CA TYR 3 6.087 -3.751 -3.211 0.000 +ATOM 6 CB TYR 3 5.991 -1.301 -3.612 0.000 +ATOM 7 CA ILE 4 9.312 -3.099 -1.310 0.000 +ATOM 8 CB ILE 4 9.983 -1.465 -1.132 0.000 +ATOM 9 CA GLN 5 8.388 -5.710 1.292 0.000 +ATOM 10 CB GLN 5 7.070 -4.369 2.510 0.000 +ATOM 11 CA TRP 6 7.266 -8.067 -1.470 0.000 +ATOM 12 CB TRP 6 5.618 -9.883 -2.347 0.000 +ATOM 13 CA LEU 7 10.313 -7.172 -3.558 0.000 +ATOM 14 CB LEU 7 9.085 -6.466 -4.883 0.000 +ATOM 15 CA LYS 8 12.595 -7.970 -0.627 0.000 +ATOM 16 CB LYS 8 11.711 -6.058 0.793 0.000 +ATOM 17 CA ASP 9 10.741 -11.213 0.072 0.000 +ATOM 18 CB ASP 9 9.402 -10.395 0.749 0.000 +ATOM 19 CA GLY 10 12.370 -12.830 -2.957 0.000 +ATOM 20 CA GLY 11 10.960 -10.843 -5.873 0.000 +ATOM 21 CA PRO 12 7.322 -11.900 -5.588 0.000 +ATOM 22 CB PRO 12 6.855 -10.799 -6.203 0.000 +ATOM 23 CA SER 13 8.228 -15.343 -4.259 0.000 +ATOM 24 CB SER 13 9.351 -15.509 -4.074 0.000 +ATOM 25 CA SER 14 7.286 -14.526 -0.669 0.000 +ATOM 26 CB SER 14 7.071 -13.411 -0.490 0.000 +ATOM 27 CA GLY 15 4.043 -15.703 0.923 0.000 +ATOM 28 CA ARG 16 2.147 -12.495 0.180 0.000 +ATOM 29 CB ARG 16 4.118 -10.393 1.083 0.000 +ATOM 30 CA PRO 17 0.436 -11.297 -2.994 0.000 +ATOM 31 CB PRO 17 0.013 -10.339 -2.151 0.000 +ATOM 32 CA PRO 18 2.570 -10.369 -5.998 0.000 +ATOM 33 CB PRO 18 1.672 -11.113 -6.668 0.000 +ATOM 34 CA PRO 19 2.908 -6.696 -6.912 0.000 +ATOM 35 CB PRO 19 3.701 -6.748 -5.826 0.000 +ATOM 36 CA SER 20 2.805 -5.807 -10.605 0.000 +ATOM 37 CB SER 20 2.020 -4.998 -10.829 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