X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2Funres%2FCSA%2F4P%2Foutputs%2F1l2y_csa%40023.pdb;fp=examples%2Funres%2FCSA%2F4P%2Foutputs%2F1l2y_csa%40023.pdb;h=bbb4fa16d1429ce81dfee30b7cf8cc2c14735707;hb=973e30c3fc3444f4e49450c68a510ce149896509;hp=0000000000000000000000000000000000000000;hpb=e1f58c94091d831b301f5c3400202bb180284f72;p=unres.git diff --git a/examples/unres/CSA/4P/outputs/1l2y_csa@023.pdb b/examples/unres/CSA/4P/outputs/1l2y_csa@023.pdb new file mode 100644 index 0000000..bbb4fa1 --- /dev/null +++ b/examples/unres/CSA/4P/outputs/1l2y_csa@023.pdb @@ -0,0 +1,61 @@ +REMARK GM 23 e 1729712 m 6621 ENERGY -1.81571E+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 5.361 0.488 0.400 0.000 +ATOM 3 CA LEU 2 4.042 -3.792 0.000 0.000 +ATOM 4 CB LEU 2 3.841 -5.699 0.288 0.000 +ATOM 5 CA TYR 3 1.600 -4.079 -2.897 0.000 +ATOM 6 CB TYR 3 0.828 -1.719 -2.935 0.000 +ATOM 7 CA ILE 4 4.248 -3.132 -5.453 0.000 +ATOM 8 CB ILE 4 4.463 -1.466 -6.027 0.000 +ATOM 9 CA GLN 5 6.803 -5.457 -3.869 0.000 +ATOM 10 CB GLN 5 7.372 -3.919 -2.343 0.000 +ATOM 11 CA TRP 6 4.166 -8.159 -3.436 0.000 +ATOM 12 CB TRP 6 2.955 -10.243 -2.449 0.000 +ATOM 13 CA LEU 7 2.824 -7.571 -6.942 0.000 +ATOM 14 CB LEU 7 1.159 -6.980 -6.144 0.000 +ATOM 15 CA LYS 8 6.342 -7.430 -8.374 0.000 +ATOM 16 CB LYS 8 6.876 -4.955 -8.585 0.000 +ATOM 17 CA ASP 9 7.356 -10.667 -6.662 0.000 +ATOM 18 CB ASP 9 6.729 -10.797 -5.077 0.000 +ATOM 19 CA GLY 10 4.886 -12.735 -8.677 0.000 +ATOM 20 CA GLY 11 1.163 -12.413 -7.985 0.000 +ATOM 21 CA PRO 12 -0.472 -12.748 -4.572 0.000 +ATOM 22 CB PRO 12 -0.985 -11.506 -4.505 0.000 +ATOM 23 CA SER 13 0.518 -16.402 -4.241 0.000 +ATOM 24 CB SER 13 0.594 -16.998 -5.222 0.000 +ATOM 25 CA SER 14 4.215 -15.607 -3.867 0.000 +ATOM 26 CB SER 14 4.337 -14.464 -3.907 0.000 +ATOM 27 CA GLY 15 6.187 -16.186 -0.670 0.000 +ATOM 28 CA ARG 16 5.163 -12.899 0.939 0.000 +ATOM 29 CB ARG 16 6.207 -10.414 -0.423 0.000 +ATOM 30 CA PRO 17 1.787 -11.988 2.426 0.000 +ATOM 31 CB PRO 17 2.545 -11.026 2.981 0.000 +ATOM 32 CA PRO 18 -1.109 -11.274 0.071 0.000 +ATOM 33 CB PRO 18 -1.716 -12.189 0.848 0.000 +ATOM 34 CA PRO 19 -2.222 -7.662 -0.319 0.000 +ATOM 35 CB PRO 19 -1.065 -7.505 -0.987 0.000 +ATOM 36 CA SER 20 -5.903 -8.545 0.016 0.000 +ATOM 37 CB SER 20 -6.220 -9.517 -0.511 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