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_021.pdb;fp=examples%2Funres%2FCSA%2FGAB%2FCSA%2Fglobal%2Funrestrained%2FCLUSTER%2F1l2y_csa_GB0000001_021.pdb;h=5fc44aeb261b5ccc681bc747bede132f9360d703;hb=47f77d0040bb7b3315692741301cc67b5c6d481b;hp=0000000000000000000000000000000000000000;hpb=c6e5cc1ecf0804cd5d7fe0f5d4d9ba18aee74e30;p=unres.git diff --git a/examples/unres/CSA/GAB/CSA/global/unrestrained/CLUSTER/1l2y_csa_GB0000001_021.pdb b/examples/unres/CSA/GAB/CSA/global/unrestrained/CLUSTER/1l2y_csa_GB0000001_021.pdb new file mode 100644 index 0000000..5fc44ae --- /dev/null +++ b/examples/unres/CSA/GAB/CSA/global/unrestrained/CLUSTER/1l2y_csa_GB0000001_021.pdb @@ -0,0 +1,59 @@ +REMARK 1l2y ENERGY -8.82700E+01 +ATOM 1 CA ASN 1 3.800 0.000 0.000 +ATOM 2 CB ASN 1 4.359 0.236 1.571 +ATOM 3 CA LEU 2 4.046 -3.792 0.000 +ATOM 4 CB LEU 2 4.194 -5.639 0.571 +ATOM 5 CA TYR 3 1.396 -4.161 -2.699 +ATOM 6 CB TYR 3 -0.601 -2.685 -2.637 +ATOM 7 CA ILE 4 2.010 -7.900 -2.979 +ATOM 8 CB ILE 4 3.599 -8.566 -3.407 +ATOM 9 CA GLN 5 -0.038 -8.463 0.172 +ATOM 10 CB GLN 5 0.239 -7.207 2.005 +ATOM 11 CA TRP 6 -2.789 -6.281 -1.279 +ATOM 12 CB TRP 6 -4.447 -4.281 -1.476 +ATOM 13 CA LEU 7 -2.482 -8.054 -4.626 +ATOM 14 CB LEU 7 -1.987 -6.389 -5.486 +ATOM 15 CA LYS 8 -2.833 -11.426 -2.910 +ATOM 16 CB LYS 8 -0.709 -11.122 -1.548 +ATOM 17 CA ASP 9 -5.580 -10.113 -0.636 +ATOM 18 CB ASP 9 -4.499 -9.255 0.370 +ATOM 19 CA GLY 10 -8.038 -10.067 -3.534 +ATOM 20 CA GLY 11 -6.707 -7.788 -6.268 +ATOM 21 CA PRO 12 -7.091 -4.367 -4.659 +ATOM 22 CB PRO 12 -6.249 -3.780 -5.528 +ATOM 23 CA SER 13 -9.941 -5.516 -2.424 +ATOM 24 CB SER 13 -10.262 -6.610 -2.573 +ATOM 25 CA SER 14 -7.673 -5.946 0.594 +ATOM 26 CB SER 14 -7.257 -6.609 -0.248 +ATOM 27 CA GLY 15 -7.508 -3.565 3.551 +ATOM 28 CA ARG 16 -4.953 -1.218 2.001 +ATOM 29 CB ARG 16 -2.468 -2.770 1.272 +ATOM 30 CA PRO 17 -5.671 1.363 -0.694 +ATOM 31 CB PRO 17 -4.636 1.940 -0.058 +ATOM 32 CA PRO 18 -5.951 0.276 -4.325 +ATOM 33 CB PRO 18 -7.067 1.027 -4.323 +ATOM 34 CA PRO 19 -3.268 1.315 -6.807 +ATOM 35 CB PRO 19 -2.781 0.115 -6.445 +ATOM 36 CA SER 20 -4.361 2.657 -10.190 +ATOM 37 CB SER 20 -3.891 3.683 -10.413 +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