X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2Funres%2FCSA%2F4P%2FCSA%2Foutput%2F1l2y_csa%40025.pdb;fp=examples%2Funres%2FCSA%2F4P%2FCSA%2Foutput%2F1l2y_csa%40025.pdb;h=fc74ee24ec8512cea8ef867604a6255f99ad7626;hb=6c23f8d4f1fe8f0479fb8c6b16ff17e6c59c03d2;hp=0000000000000000000000000000000000000000;hpb=c6cc12f77df252d56c9480ce4822c58fc8981c32;p=unres.git diff --git a/examples/unres/CSA/4P/CSA/output/1l2y_csa@025.pdb b/examples/unres/CSA/4P/CSA/output/1l2y_csa@025.pdb new file mode 100644 index 0000000..fc74ee2 --- /dev/null +++ b/examples/unres/CSA/4P/CSA/output/1l2y_csa@025.pdb @@ -0,0 +1,61 @@ +REMARK GM 25 e 2229133 m 8565 ENERGY -1.81572E+02 +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 5.362 0.488 0.398 0.000 +ATOM 3 CA LEU 2 4.043 -3.792 0.000 0.000 +ATOM 4 CB LEU 2 3.839 -5.700 0.281 0.000 +ATOM 5 CA TYR 3 1.606 -4.079 -2.901 0.000 +ATOM 6 CB TYR 3 0.834 -1.718 -2.936 0.000 +ATOM 7 CA ILE 4 4.258 -3.130 -5.452 0.000 +ATOM 8 CB ILE 4 4.474 -1.463 -6.025 0.000 +ATOM 9 CA GLN 5 6.810 -5.454 -3.864 0.000 +ATOM 10 CB GLN 5 7.371 -3.903 -2.348 0.000 +ATOM 11 CA TRP 6 4.174 -8.158 -3.440 0.000 +ATOM 12 CB TRP 6 2.961 -10.247 -2.466 0.000 +ATOM 13 CA LEU 7 2.841 -7.567 -6.949 0.000 +ATOM 14 CB LEU 7 1.173 -6.976 -6.156 0.000 +ATOM 15 CA LYS 8 6.362 -7.425 -8.371 0.000 +ATOM 16 CB LYS 8 6.897 -4.950 -8.578 0.000 +ATOM 17 CA ASP 9 7.370 -10.665 -6.662 0.000 +ATOM 18 CB ASP 9 6.741 -10.800 -5.078 0.000 +ATOM 19 CA GLY 10 4.906 -12.730 -8.688 0.000 +ATOM 20 CA GLY 11 1.181 -12.404 -8.008 0.000 +ATOM 21 CA PRO 12 -0.467 -12.748 -4.602 0.000 +ATOM 22 CB PRO 12 -0.977 -11.506 -4.533 0.000 +ATOM 23 CA SER 13 0.513 -16.406 -4.282 0.000 +ATOM 24 CB SER 13 0.588 -16.999 -5.264 0.000 +ATOM 25 CA SER 14 4.211 -15.622 -3.900 0.000 +ATOM 26 CB SER 14 4.335 -14.479 -3.937 0.000 +ATOM 27 CA GLY 15 6.179 -16.212 -0.703 0.000 +ATOM 28 CA ARG 16 5.166 -12.924 0.910 0.000 +ATOM 29 CB ARG 16 6.204 -10.422 -0.425 0.000 +ATOM 30 CA PRO 17 1.793 -12.006 2.399 0.000 +ATOM 31 CB PRO 17 2.553 -11.045 2.953 0.000 +ATOM 32 CA PRO 18 -1.104 -11.286 0.046 0.000 +ATOM 33 CB PRO 18 -1.710 -12.203 0.821 0.000 +ATOM 34 CA PRO 19 -2.213 -7.672 -0.337 0.000 +ATOM 35 CB PRO 19 -1.056 -7.515 -1.005 0.000 +ATOM 36 CA SER 20 -5.894 -8.552 0.000 0.000 +ATOM 37 CB SER 20 -6.213 -9.522 -0.528 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