X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=examples%2Funres%2FCSA%2F4P%2Foutputs%2F1l2y_csa%40022.pdb;fp=examples%2Funres%2FCSA%2F4P%2Foutputs%2F1l2y_csa%40022.pdb;h=ed826d5e140f27fa9cf7b57939a6a030cb714a9d;hb=fe9e3a2f1191191edd529c64aba73f2b98723a47;hp=0000000000000000000000000000000000000000;hpb=c89d7d207940ebb57e0042cb35ab65d0f8a4b55e;p=unres.git diff --git a/examples/unres/CSA/4P/outputs/1l2y_csa@022.pdb b/examples/unres/CSA/4P/outputs/1l2y_csa@022.pdb new file mode 100644 index 0000000..ed826d5 --- /dev/null +++ b/examples/unres/CSA/4P/outputs/1l2y_csa@022.pdb @@ -0,0 +1,61 @@ +REMARK GM 22 e 1397464 m 5292 ENERGY -1.81419E+02 +HELIX 1 H1 LEU 2 GLY 11 1 9 +ATOM 1 CA ASN 1 3.800 0.000 0.000 0.000 +ATOM 2 CB ASN 1 5.355 0.499 0.410 0.000 +ATOM 3 CA LEU 2 4.042 -3.792 0.000 0.000 +ATOM 4 CB LEU 2 3.991 -5.730 0.021 0.000 +ATOM 5 CA TYR 3 1.545 -4.079 -2.850 0.000 +ATOM 6 CB TYR 3 0.518 -1.823 -2.684 0.000 +ATOM 7 CA ILE 4 4.137 -3.072 -5.441 0.000 +ATOM 8 CB ILE 4 4.301 -1.417 -6.063 0.000 +ATOM 9 CA GLN 5 6.699 -5.468 -3.979 0.000 +ATOM 10 CB GLN 5 7.499 -4.079 -2.414 0.000 +ATOM 11 CA TRP 6 4.047 -8.158 -3.568 0.000 +ATOM 12 CB TRP 6 4.758 -10.647 -3.280 0.000 +ATOM 13 CA LEU 7 2.614 -7.442 -7.015 0.000 +ATOM 14 CB LEU 7 1.096 -6.364 -6.474 0.000 +ATOM 15 CA LYS 8 6.094 -7.359 -8.540 0.000 +ATOM 16 CB LYS 8 6.412 -4.873 -8.956 0.000 +ATOM 17 CA ASP 9 7.129 -10.476 -6.628 0.000 +ATOM 18 CB ASP 9 7.934 -9.759 -5.302 0.000 +ATOM 19 CA GLY 10 4.517 -12.646 -8.335 0.000 +ATOM 20 CA GLY 11 5.137 -11.331 -11.846 0.000 +ATOM 21 CA PRO 12 8.168 -11.636 -14.117 0.000 +ATOM 22 CB PRO 12 7.653 -10.686 -14.917 0.000 +ATOM 23 CA SER 13 10.420 -9.831 -11.645 0.000 +ATOM 24 CB SER 13 9.904 -9.069 -10.955 0.000 +ATOM 25 CA SER 14 10.451 -12.731 -9.190 0.000 +ATOM 26 CB SER 14 9.976 -12.467 -8.177 0.000 +ATOM 27 CA GLY 15 8.587 -16.026 -9.520 0.000 +ATOM 28 CA ARG 16 8.130 -16.506 -5.778 0.000 +ATOM 29 CB ARG 16 8.670 -14.034 -4.131 0.000 +ATOM 30 CA PRO 17 5.081 -17.654 -3.822 0.000 +ATOM 31 CB PRO 17 6.066 -18.292 -3.164 0.000 +ATOM 32 CA PRO 18 2.530 -15.042 -2.770 0.000 +ATOM 33 CB PRO 18 1.686 -15.907 -3.359 0.000 +ATOM 34 CA PRO 19 2.422 -14.032 0.892 0.000 +ATOM 35 CB PRO 19 2.752 -12.790 0.497 0.000 +ATOM 36 CA SER 20 -1.370 -14.223 1.040 0.000 +ATOM 37 CB SER 20 -1.919 -13.806 0.119 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