X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=blobdiff_plain;f=examples%2Funres%2FCSA%2FGAB%2Fglobal%2Frestrained%2Foutputs%2F1l2y_csa%40014.pdb;fp=examples%2Funres%2FCSA%2FGAB%2Fglobal%2Frestrained%2Foutputs%2F1l2y_csa%40014.pdb;h=1902dfcb35dc92f928ed03ab2e510d87ebe1564b;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/GAB/global/restrained/outputs/1l2y_csa@014.pdb b/examples/unres/CSA/GAB/global/restrained/outputs/1l2y_csa@014.pdb new file mode 100644 index 0000000..1902dfc --- /dev/null +++ b/examples/unres/CSA/GAB/global/restrained/outputs/1l2y_csa@014.pdb @@ -0,0 +1,60 @@ +REMARK GM 14 e 239200 m 624 ENERGY -7.85895E+01 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 4.057 1.587 0.501 0.000 +ATOM 3 CA LEU 2 5.254 -3.511 0.000 0.000 +ATOM 4 CB LEU 2 5.465 -5.413 -0.312 0.000 +ATOM 5 CA TYR 3 8.569 -2.378 -1.472 0.000 +ATOM 6 CB TYR 3 8.031 0.004 -1.017 0.000 +ATOM 7 CA ILE 4 11.887 -2.608 0.366 0.000 +ATOM 8 CB ILE 4 12.783 -4.121 0.119 0.000 +ATOM 9 CA GLN 5 11.954 1.097 1.208 0.000 +ATOM 10 CB GLN 5 10.937 3.033 0.722 0.000 +ATOM 11 CA TRP 6 8.420 0.883 2.590 0.000 +ATOM 12 CB TRP 6 7.157 3.041 3.320 0.000 +ATOM 13 CA LEU 7 9.152 -2.478 4.206 0.000 +ATOM 14 CB LEU 7 9.002 -4.128 3.200 0.000 +ATOM 15 CA LYS 8 11.995 -0.936 6.201 0.000 +ATOM 16 CB LYS 8 13.673 -1.112 4.301 0.000 +ATOM 17 CA ASP 9 9.585 1.474 7.881 0.000 +ATOM 18 CB ASP 9 8.118 1.297 7.022 0.000 +ATOM 19 CA GLY 10 8.331 -1.244 10.222 0.000 +ATOM 20 CA GLY 11 6.484 -3.204 7.541 0.000 +ATOM 21 CA PRO 12 4.555 -6.390 6.787 0.000 +ATOM 22 CB PRO 12 4.851 -6.292 5.479 0.000 +ATOM 23 CA SER 13 5.250 -10.087 7.327 0.000 +ATOM 24 CB SER 13 5.373 -10.421 8.421 0.000 +ATOM 25 CA SER 14 1.596 -11.035 6.887 0.000 +ATOM 26 CB SER 14 0.879 -10.148 6.745 0.000 +ATOM 27 CA GLY 15 1.979 -11.950 3.218 0.000 +ATOM 28 CA ARG 16 5.454 -12.529 1.793 0.000 +ATOM 29 CB ARG 16 7.579 -12.759 -0.340 0.000 +ATOM 30 CA PRO 17 7.782 -9.531 1.616 0.000 +ATOM 31 CB PRO 17 7.529 -9.524 2.937 0.000 +ATOM 32 CA PRO 18 10.035 -9.332 -1.437 0.000 +ATOM 33 CB PRO 18 9.871 -7.999 -1.355 0.000 +ATOM 34 CA PRO 19 13.734 -10.154 -1.158 0.000 +ATOM 35 CB PRO 19 13.219 -11.393 -1.260 0.000 +ATOM 36 CA SER 20 16.215 -8.023 -3.092 0.000 +ATOM 37 CB SER 20 17.105 -7.680 -2.449 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