X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2Funres%2FCSA%2F4P%2Foutputs%2F1l2y_csa%40016.pdb;fp=examples%2Funres%2FCSA%2F4P%2Foutputs%2F1l2y_csa%40016.pdb;h=15f3642479f821424a88afa7c9783b69d2b835ce;hb=973e30c3fc3444f4e49450c68a510ce149896509;hp=0000000000000000000000000000000000000000;hpb=e1f58c94091d831b301f5c3400202bb180284f72;p=unres.git diff --git a/examples/unres/CSA/4P/outputs/1l2y_csa@016.pdb b/examples/unres/CSA/4P/outputs/1l2y_csa@016.pdb new file mode 100644 index 0000000..15f3642 --- /dev/null +++ b/examples/unres/CSA/4P/outputs/1l2y_csa@016.pdb @@ -0,0 +1,62 @@ +REMARK GM 16 e 450602 m 1665 ENERGY -1.72075E+02 +SHEET 1 B1 2 ASN 1 TYR 3 0 +SHEET 2 B1 2 TRP 6 LYS 8 -1 N LYS 8 O ASN 1 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 4.242 1.461 0.711 0.000 +ATOM 3 CA LEU 2 4.040 -3.792 0.000 0.000 +ATOM 4 CB LEU 2 3.515 -5.511 0.728 0.000 +ATOM 5 CA TYR 3 5.112 -5.328 -3.306 0.000 +ATOM 6 CB TYR 3 7.524 -5.173 -3.880 0.000 +ATOM 7 CA ILE 4 5.856 -8.688 -1.696 0.000 +ATOM 8 CB ILE 4 7.508 -9.131 -1.217 0.000 +ATOM 9 CA GLN 5 2.212 -9.763 -1.716 0.000 +ATOM 10 CB GLN 5 0.260 -8.856 -1.096 0.000 +ATOM 11 CA TRP 6 1.342 -7.223 -4.404 0.000 +ATOM 12 CB TRP 6 3.602 -7.612 -5.641 0.000 +ATOM 13 CA LEU 7 -0.174 -4.758 -1.941 0.000 +ATOM 14 CB LEU 7 -0.857 -4.034 -0.277 0.000 +ATOM 15 CA LYS 8 0.984 -1.788 -4.009 0.000 +ATOM 16 CB LYS 8 3.471 -1.623 -3.514 0.000 +ATOM 17 CA ASP 9 -1.205 -2.735 -6.967 0.000 +ATOM 18 CB ASP 9 -1.619 -4.298 -6.415 0.000 +ATOM 19 CA GLY 10 -4.209 -0.877 -5.566 0.000 +ATOM 20 CA GLY 11 -5.595 -3.892 -3.715 0.000 +ATOM 21 CA PRO 12 -3.789 -6.936 -2.333 0.000 +ATOM 22 CB PRO 12 -4.896 -6.955 -1.570 0.000 +ATOM 23 CA SER 13 -2.027 -9.118 -4.898 0.000 +ATOM 24 CB SER 13 -1.509 -8.764 -5.862 0.000 +ATOM 25 CA SER 14 -0.087 -12.345 -4.383 0.000 +ATOM 26 CB SER 14 -0.749 -13.275 -4.518 0.000 +ATOM 27 CA GLY 15 2.756 -13.534 -6.607 0.000 +ATOM 28 CA ARG 16 4.246 -16.932 -7.427 0.000 +ATOM 29 CB ARG 16 1.667 -17.001 -8.997 0.000 +ATOM 30 CA PRO 17 7.476 -18.405 -6.073 0.000 +ATOM 31 CB PRO 17 6.704 -19.505 -6.127 0.000 +ATOM 32 CA PRO 18 10.712 -17.573 -7.883 0.000 +ATOM 33 CB PRO 18 11.051 -17.134 -6.657 0.000 +ATOM 34 CA PRO 19 12.370 -20.331 -9.904 0.000 +ATOM 35 CB PRO 19 12.213 -19.573 -11.004 0.000 +ATOM 36 CA SER 20 15.814 -19.578 -8.486 0.000 +ATOM 37 CB SER 20 16.065 -18.462 -8.365 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