X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?p=unres.git;a=blobdiff_plain;f=examples%2Funres%2FCSA%2F4P%2Foutputs%2F1l2y_csa%40008.pdb;fp=examples%2Funres%2FCSA%2F4P%2Foutputs%2F1l2y_csa%40008.pdb;h=3fe2b1afd610d6b5b2c616278a81dc4f1fe1085b;hp=0000000000000000000000000000000000000000;hb=2a226bfc86eabc6e4eae0c3ad1cbc3cb5417a05a;hpb=a0e685f844163003749ba91dfbf4644bcc8cfa30 diff --git a/examples/unres/CSA/4P/outputs/1l2y_csa@008.pdb b/examples/unres/CSA/4P/outputs/1l2y_csa@008.pdb new file mode 100644 index 0000000..3fe2b1a --- /dev/null +++ b/examples/unres/CSA/4P/outputs/1l2y_csa@008.pdb @@ -0,0 +1,62 @@ +REMARK GM 8 e 137870 m 423 ENERGY -1.72909E+02 +SHEET 1 B1 2 ASN 1 ILE 4 0 +SHEET 2 B1 2 LEU 7 GLY 10 -1 N GLY 10 O ASN 1 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 5.220 0.872 0.244 0.000 +ATOM 3 CA LEU 2 5.587 -3.354 0.000 0.000 +ATOM 4 CB LEU 2 6.628 -4.606 -1.052 0.000 +ATOM 5 CA TYR 3 6.899 -4.980 3.173 0.000 +ATOM 6 CB TYR 3 5.474 -4.351 5.108 0.000 +ATOM 7 CA ILE 4 10.066 -7.079 3.097 0.000 +ATOM 8 CB ILE 4 10.969 -6.781 1.597 0.000 +ATOM 9 CA GLN 5 10.622 -9.351 6.093 0.000 +ATOM 10 CB GLN 5 9.931 -10.498 7.888 0.000 +ATOM 11 CA TRP 6 9.256 -12.313 4.143 0.000 +ATOM 12 CB TRP 6 10.250 -14.354 2.866 0.000 +ATOM 13 CA LEU 7 7.795 -10.128 1.398 0.000 +ATOM 14 CB LEU 7 8.537 -10.169 -0.392 0.000 +ATOM 15 CA LYS 8 4.769 -8.113 2.503 0.000 +ATOM 16 CB LYS 8 5.810 -8.490 4.790 0.000 +ATOM 17 CA ASP 9 2.340 -6.105 0.379 0.000 +ATOM 18 CB ASP 9 0.868 -6.972 0.417 0.000 +ATOM 19 CA GLY 10 0.087 -3.743 2.324 0.000 +ATOM 20 CA GLY 11 -1.902 -6.577 3.892 0.000 +ATOM 21 CA PRO 12 -0.051 -9.673 5.086 0.000 +ATOM 22 CB PRO 12 -1.128 -9.807 5.881 0.000 +ATOM 23 CA SER 13 0.661 -12.560 2.719 0.000 +ATOM 24 CB SER 13 -0.217 -13.278 2.526 0.000 +ATOM 25 CA SER 14 -0.087 -10.472 -0.366 0.000 +ATOM 26 CB SER 14 -0.498 -11.073 -1.256 0.000 +ATOM 27 CA GLY 15 -3.450 -9.409 1.051 0.000 +ATOM 28 CA ARG 16 -4.788 -10.928 4.267 0.000 +ATOM 29 CB ARG 16 -5.322 -7.988 4.700 0.000 +ATOM 30 CA PRO 17 -3.580 -14.280 5.587 0.000 +ATOM 31 CB PRO 17 -3.945 -13.659 6.723 0.000 +ATOM 32 CA PRO 18 -4.800 -17.418 3.826 0.000 +ATOM 33 CB PRO 18 -3.480 -17.649 3.710 0.000 +ATOM 34 CA PRO 19 -7.203 -19.693 5.695 0.000 +ATOM 35 CB PRO 19 -8.050 -19.158 4.798 0.000 +ATOM 36 CA SER 20 -6.026 -23.207 6.535 0.000 +ATOM 37 CB SER 20 -5.640 -23.397 7.601 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