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%40025.pdb;fp=examples%2Funres%2FCSA%2FGAB%2Fglobal%2Funrestrained%2Foutputs%2F1l2y_csa%40025.pdb;h=1a48b12a125162bb637cf3839198704a74efb3aa;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@025.pdb b/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@025.pdb new file mode 100644 index 0000000..1a48b12 --- /dev/null +++ b/examples/unres/CSA/GAB/global/unrestrained/outputs/1l2y_csa@025.pdb @@ -0,0 +1,61 @@ +REMARK GM 25 e 1849635 m 5670 ENERGY -8.96862E+01 +HELIX 1 H1 LEU 2 GLY 10 1 8 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 5.425 0.406 0.179 0.000 +ATOM 3 CA LEU 2 4.055 -3.791 0.000 0.000 +ATOM 4 CB LEU 2 3.298 -5.573 0.119 0.000 +ATOM 5 CA TYR 3 4.892 -3.829 -3.706 0.000 +ATOM 6 CB TYR 3 4.037 -6.116 -4.164 0.000 +ATOM 7 CA ILE 4 8.349 -2.404 -3.030 0.000 +ATOM 8 CB ILE 4 8.716 -0.666 -3.023 0.000 +ATOM 9 CA GLN 5 8.828 -4.878 -0.186 0.000 +ATOM 10 CB GLN 5 7.793 -3.469 1.215 0.000 +ATOM 11 CA TRP 6 7.500 -7.665 -2.402 0.000 +ATOM 12 CB TRP 6 6.208 -9.819 -3.092 0.000 +ATOM 13 CA LEU 7 9.709 -6.521 -5.275 0.000 +ATOM 14 CB LEU 7 8.239 -5.918 -6.386 0.000 +ATOM 15 CA LYS 8 12.683 -6.171 -2.936 0.000 +ATOM 16 CB LYS 8 12.741 -3.659 -2.561 0.000 +ATOM 17 CA ASP 9 11.989 -9.537 -1.314 0.000 +ATOM 18 CB ASP 9 10.649 -8.912 -0.457 0.000 +ATOM 19 CA GLY 10 13.318 -11.323 -4.394 0.000 +ATOM 20 CA GLY 11 10.845 -10.655 -7.200 0.000 +ATOM 21 CA PRO 12 7.935 -12.783 -5.999 0.000 +ATOM 22 CB PRO 12 7.142 -12.258 -6.951 0.000 +ATOM 23 CA SER 13 10.151 -15.062 -3.917 0.000 +ATOM 24 CB SER 13 11.276 -14.829 -3.884 0.000 +ATOM 25 CA SER 14 9.140 -13.431 -0.637 0.000 +ATOM 26 CB SER 14 8.766 -12.353 -0.780 0.000 +ATOM 27 CA GLY 15 6.158 -14.423 1.499 0.000 +ATOM 28 CA ARG 16 3.768 -11.930 -0.086 0.000 +ATOM 29 CB ARG 16 5.569 -9.625 0.665 0.000 +ATOM 30 CA PRO 17 1.402 -12.119 -3.054 0.000 +ATOM 31 CB PRO 17 0.986 -10.978 -2.476 0.000 +ATOM 32 CA PRO 18 2.785 -12.191 -6.592 0.000 +ATOM 33 CB PRO 18 1.967 -13.246 -6.749 0.000 +ATOM 34 CA PRO 19 2.255 -9.252 -8.942 0.000 +ATOM 35 CB PRO 19 3.411 -8.870 -8.368 0.000 +ATOM 36 CA SER 20 1.238 -9.987 -12.528 0.000 +ATOM 37 CB SER 20 0.285 -9.417 -12.826 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