X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2Funres%2FCSA%2FGAB%2FCSA%2Fglobal%2Funrestrained%2FCLUSTER%2F1l2y_csa_GB0000001_030.pdb;fp=examples%2Funres%2FCSA%2FGAB%2FCSA%2Fglobal%2Funrestrained%2FCLUSTER%2F1l2y_csa_GB0000001_030.pdb;h=3bfc513257f6c145dee7edffb7798a42729a5113;hb=47f77d0040bb7b3315692741301cc67b5c6d481b;hp=0000000000000000000000000000000000000000;hpb=c6e5cc1ecf0804cd5d7fe0f5d4d9ba18aee74e30;p=unres.git diff --git a/examples/unres/CSA/GAB/CSA/global/unrestrained/CLUSTER/1l2y_csa_GB0000001_030.pdb b/examples/unres/CSA/GAB/CSA/global/unrestrained/CLUSTER/1l2y_csa_GB0000001_030.pdb new file mode 100644 index 0000000..3bfc513 --- /dev/null +++ b/examples/unres/CSA/GAB/CSA/global/unrestrained/CLUSTER/1l2y_csa_GB0000001_030.pdb @@ -0,0 +1,59 @@ +REMARK 1l2y ENERGY -8.75500E+01 +ATOM 1 CA ASN 1 3.800 0.000 0.000 +ATOM 2 CB ASN 1 5.423 0.376 0.243 +ATOM 3 CA LEU 2 4.055 -3.791 0.000 +ATOM 4 CB LEU 2 3.885 -5.723 -0.003 +ATOM 5 CA TYR 3 5.556 -3.805 -3.491 +ATOM 6 CB TYR 3 4.457 -3.970 -5.713 +ATOM 7 CA ILE 4 9.077 -3.523 -2.089 +ATOM 8 CB ILE 4 9.734 -1.997 -1.460 +ATOM 9 CA GLN 5 8.197 -6.145 0.517 +ATOM 10 CB GLN 5 7.757 -4.389 1.836 +ATOM 11 CA TRP 6 6.691 -8.279 -2.243 +ATOM 12 CB TRP 6 5.553 -7.957 -4.564 +ATOM 13 CA LEU 7 9.923 -7.848 -4.195 +ATOM 14 CB LEU 7 9.669 -7.108 -5.969 +ATOM 15 CA LYS 8 11.883 -9.025 -1.161 +ATOM 16 CB LYS 8 12.548 -6.639 -0.593 +ATOM 17 CA ASP 9 9.444 -11.867 -0.515 +ATOM 18 CB ASP 9 8.019 -11.282 0.224 +ATOM 19 CA GLY 10 10.708 -13.748 -3.565 +ATOM 20 CA GLY 11 10.334 -11.595 -6.674 +ATOM 21 CA PRO 12 6.565 -11.526 -7.156 +ATOM 22 CB PRO 12 6.683 -10.553 -8.077 +ATOM 23 CA SER 13 6.055 -14.789 -5.278 +ATOM 24 CB SER 13 6.992 -15.239 -4.786 +ATOM 25 CA SER 14 4.669 -13.070 -2.186 +ATOM 26 CB SER 14 4.704 -11.923 -2.101 +ATOM 27 CA GLY 15 1.044 -13.255 -3.311 +ATOM 28 CA ARG 16 0.987 -9.768 -4.822 +ATOM 29 CB ARG 16 1.573 -6.935 -3.956 +ATOM 30 CA PRO 17 0.579 -8.558 -8.401 +ATOM 31 CB PRO 17 0.555 -7.319 -7.878 +ATOM 32 CA PRO 18 3.508 -8.859 -10.804 +ATOM 33 CB PRO 18 2.579 -9.267 -11.687 +ATOM 34 CA PRO 19 5.384 -5.707 -11.795 +ATOM 35 CB PRO 19 5.781 -5.731 -10.510 +ATOM 36 CA SER 20 5.664 -6.723 -15.446 +ATOM 37 CB SER 20 5.538 -7.854 -15.613 +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 35 +CONECT 36 37