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_028.pdb;fp=examples%2Funres%2FCSA%2FGAB%2FCSA%2Fglobal%2Funrestrained%2FCLUSTER%2F1l2y_csa_GB0000001_028.pdb;h=9c9b6b6944a510b8e077577e082b1d4400f37494;hb=47f77d0040bb7b3315692741301cc67b5c6d481b;hp=0000000000000000000000000000000000000000;hpb=c6e5cc1ecf0804cd5d7fe0f5d4d9ba18aee74e30;p=unres.git diff --git a/examples/unres/CSA/GAB/CSA/global/unrestrained/CLUSTER/1l2y_csa_GB0000001_028.pdb b/examples/unres/CSA/GAB/CSA/global/unrestrained/CLUSTER/1l2y_csa_GB0000001_028.pdb new file mode 100644 index 0000000..9c9b6b6 --- /dev/null +++ b/examples/unres/CSA/GAB/CSA/global/unrestrained/CLUSTER/1l2y_csa_GB0000001_028.pdb @@ -0,0 +1,59 @@ +REMARK 1l2y ENERGY -8.77000E+01 +ATOM 1 CA ASN 1 3.800 0.000 0.000 +ATOM 2 CB ASN 1 4.328 0.358 1.558 +ATOM 3 CA LEU 2 5.624 -3.333 0.000 +ATOM 4 CB LEU 2 6.643 -4.671 -0.966 +ATOM 5 CA TYR 3 6.272 -4.612 3.519 +ATOM 6 CB TYR 3 6.315 -2.666 5.063 +ATOM 7 CA ILE 4 8.711 -7.283 2.355 +ATOM 8 CB ILE 4 8.216 -8.728 1.448 +ATOM 9 CA GLN 5 11.222 -4.594 1.401 +ATOM 10 CB GLN 5 10.552 -2.925 0.067 +ATOM 11 CA TRP 6 10.658 -2.913 4.762 +ATOM 12 CB TRP 6 10.060 -0.971 6.392 +ATOM 13 CA LEU 7 10.918 -6.266 6.530 +ATOM 14 CB LEU 7 9.113 -6.017 7.193 +ATOM 15 CA LYS 8 14.197 -6.994 4.752 +ATOM 16 CB LYS 8 13.112 -6.982 2.455 +ATOM 17 CA ASP 9 15.391 -3.417 5.223 +ATOM 18 CB ASP 9 14.381 -2.802 3.990 +ATOM 19 CA GLY 10 15.949 -4.025 8.933 +ATOM 20 CA GLY 11 12.642 -4.992 10.535 +ATOM 21 CA PRO 12 10.740 -1.707 10.370 +ATOM 22 CB PRO 12 9.567 -2.318 10.613 +ATOM 23 CA SER 13 13.920 0.372 10.373 +ATOM 24 CB SER 13 14.895 -0.233 10.451 +ATOM 25 CA SER 14 13.822 0.910 6.613 +ATOM 26 CB SER 14 13.821 -0.223 6.807 +ATOM 27 CA GLY 15 12.787 4.113 4.849 +ATOM 28 CA ARG 16 9.083 3.275 4.705 +ATOM 29 CB ARG 16 8.655 0.595 3.380 +ATOM 30 CA PRO 17 6.632 3.535 7.598 +ATOM 31 CB PRO 17 5.777 3.536 6.559 +ATOM 32 CA PRO 18 6.606 0.894 10.330 +ATOM 33 CB PRO 18 6.639 1.954 11.158 +ATOM 34 CA PRO 19 3.613 -1.425 10.653 +ATOM 35 CB PRO 19 4.384 -2.179 9.850 +ATOM 36 CA SER 20 2.195 -2.065 14.120 +ATOM 37 CB SER 20 1.067 -1.845 14.166 +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