 |
| home | start a new run | job status | references&downloads | examples | help |
Should you encounter any unexpected behaviour,
|
*** ***elNémo ID: 230406222549123681Job options:ID = 230406222549123681 JOBID = USERID = unknown PRIVAT = 0 NMODES = 5 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = -1 CUTOFF = 10 CAONLY = 0 Input data for this run:CRYST1 59.000 86.800 46.800 90.00 90.00 90.00 P 1 1 ATOM 1 CA PRO A 1 51.943 59.700 -5.687 1.00 31.10 C ATOM 2 CA GLN A 2 51.404 59.150 -1.985 1.00 27.74 C ATOM 3 CA ILE A 3 47.990 57.647 -1.502 1.00 22.14 C ATOM 4 CA THR A 4 46.053 57.927 1.802 1.00 20.83 C ATOM 5 CA LEU A 5 43.537 55.204 2.712 1.00 16.47 C ATOM 6 CA TRP A 6 40.782 57.372 4.113 1.00 17.03 C ATOM 7 CA GLN A 7 38.965 56.339 0.959 1.00 13.81 C ATOM 8 CA ARG A 8 39.319 53.323 -1.373 1.00 14.40 C ATOM 9 CA PRO A 9 42.477 53.756 -3.468 1.00 13.64 C ATOM 10 CA LEU A 10 40.843 53.886 -6.908 1.00 18.78 C ATOM 11 CA VAL A 11 42.948 54.868 -9.902 1.00 21.04 C ATOM 12 CA THR A 12 42.383 54.952 -13.712 1.00 23.55 C ATOM 13 CA ILE A 13 43.931 52.284 -15.772 1.00 19.80 C ATOM 14 CA LYS A 14 44.200 52.019 -19.595 1.00 23.86 C ATOM 15 CA ILE A 15 43.925 48.506 -20.911 1.00 26.62 C ATOM 16 CA GLY A 16 42.867 47.265 -24.348 1.00 36.09 C ATOM 17 CA GLY A 17 42.762 50.872 -25.308 1.00 38.57 C ATOM 18 CA GLN A 18 39.984 51.229 -22.747 1.00 35.97 C ATOM 19 CA LEU A 19 39.968 53.469 -19.663 1.00 32.56 C ATOM 20 CA LYS A 20 38.705 51.852 -16.448 1.00 26.87 C ATOM 21 CA GLU A 21 38.602 52.474 -12.694 1.00 23.95 C ATOM 22 CA ALA A 22 40.479 50.004 -10.454 1.00 13.92 C ATOM 23 CA LEU A 23 41.374 49.458 -6.892 1.00 13.69 C ATOM 24 CA LEU A 24 45.140 49.214 -5.785 1.00 12.55 C ATOM 25 CA ASP A 25 44.948 46.033 -3.719 1.00 12.57 C ATOM 26 CA THR A 26 47.934 44.869 -1.684 1.00 8.74 C ATOM 27 CA GLY A 27 46.036 41.887 -0.323 1.00 9.80 C ATOM 28 CA ALA A 28 45.453 40.485 -3.847 1.00 12.30 C ATOM 29 CA ASP A 29 48.144 38.241 -5.374 1.00 16.13 C ATOM 30 CA ASP A 30 46.671 38.727 -8.946 1.00 15.40 C ATOM 31 CA THR A 31 45.002 41.365 -10.997 1.00 10.39 C ATOM 32 CA VAL A 32 41.378 40.616 -11.788 1.00 16.49 C ATOM 33 CA LEU A 33 39.144 42.679 -14.029 1.00 14.42 C ATOM 34 CA GLU A 34 35.458 42.433 -14.857 1.00 19.00 C ATOM 35 CA GLU A 35 34.361 40.692 -18.071 1.00 18.91 C ATOM 36 CA MET A 36 36.067 42.095 -21.219 1.00 20.96 C ATOM 37 CA SER A 37 37.734 40.656 -24.203 1.00 28.77 C ATOM 38 CA LEU A 38 41.400 40.564 -24.706 1.00 27.71 C ATOM 39 CA PRO A 39 43.154 39.041 -27.615 1.00 34.84 C ATOM 40 CA GLY A 40 45.082 35.916 -27.077 1.00 36.49 C ATOM 41 CA ARG A 41 44.978 32.424 -25.885 1.00 38.25 C ATOM 42 CA TRP A 42 43.646 32.057 -22.354 1.00 29.99 C ATOM 43 CA LYS A 43 43.647 29.381 -19.614 1.00 26.94 C ATOM 44 CA PRO A 44 40.799 28.704 -17.075 1.00 22.19 C ATOM 45 CA LYS A 45 41.625 29.403 -13.424 1.00 18.93 C ATOM 46 CA MET A 46 39.672 29.452 -10.157 1.00 15.66 C ATOM 47 CA ILE A 47 40.498 32.199 -7.669 1.00 17.38 C ATOM 48 CA GLY A 48 39.000 32.333 -4.186 1.00 23.77 C ATOM 49 CA GLY A 49 38.542 34.829 -1.505 1.00 26.63 C ATOM 50 CA ILE A 50 36.044 36.008 1.012 1.00 28.61 C ATOM 51 CA GLY A 51 32.918 34.380 -0.181 1.00 27.77 C ATOM 52 CA GLY A 52 34.501 31.488 -2.050 1.00 24.16 C ATOM 53 CA PHE A 53 35.934 30.953 -5.510 1.00 19.37 C ATOM 54 CA ILE A 54 35.199 32.356 -8.970 1.00 18.48 C ATOM 55 CA LYS A 55 36.245 31.036 -12.390 1.00 18.88 C ATOM 56 CA VAL A 56 38.298 33.458 -14.485 1.00 15.63 C ATOM 57 CA ARG A 57 40.157 33.431 -17.789 1.00 15.35 C ATOM 58 CA GLN A 58 43.932 34.001 -17.400 1.00 12.99 C ATOM 59 CA TYR A 59 45.649 36.099 -20.017 1.00 18.09 C ATOM 60 CA ASP A 60 49.444 36.505 -19.917 1.00 23.37 C ATOM 61 CA GLN A 61 51.688 39.268 -21.133 1.00 24.84 C ATOM 62 CA ILE A 62 49.075 41.962 -21.077 1.00 21.42 C ATOM 63 CA LEU A 63 50.088 45.560 -21.152 1.00 22.08 C ATOM 64 CA ILE A 64 48.475 47.960 -18.724 1.00 25.19 C ATOM 65 CA GLU A 65 49.007 51.559 -17.906 1.00 28.13 C ATOM 66 CA ILE A 66 48.507 52.443 -14.243 1.00 28.61 C ATOM 67 CA CYS A 67 48.451 56.136 -13.578 1.00 39.18 C ATOM 68 CA GLY A 68 50.808 56.573 -16.458 1.00 42.45 C ATOM 69 CA HIS A 69 53.301 53.825 -15.595 1.00 39.82 C ATOM 70 CA LYS A 70 53.251 51.042 -18.113 1.00 33.47 C ATOM 71 CA ALA A 71 53.347 47.495 -16.680 1.00 26.21 C ATOM 72 CA ILE A 72 53.209 44.013 -18.199 1.00 23.15 C ATOM 73 CA GLY A 73 51.684 40.971 -16.603 1.00 16.23 C ATOM 74 CA THR A 74 49.041 38.351 -16.254 1.00 14.90 C ATOM 75 CA VAL A 75 45.495 39.583 -16.025 1.00 14.31 C ATOM 76 CA LEU A 76 42.514 37.450 -14.891 1.00 14.31 C ATOM 77 CA VAL A 77 39.089 38.309 -16.399 1.00 13.61 C ATOM 78 CA GLY A 78 35.881 37.242 -14.791 1.00 13.86 C ATOM 79 CA PRO A 79 32.844 38.088 -12.764 1.00 17.06 C ATOM 80 CA THR A 80 34.671 40.217 -10.177 1.00 19.48 C ATOM 81 CA PRO A 81 32.629 42.939 -8.350 1.00 23.43 C ATOM 82 CA VAL A 82 35.383 45.629 -8.806 1.00 18.64 C ATOM 83 CA ASN A 83 38.485 45.892 -10.989 1.00 13.90 C ATOM 84 CA ILE A 84 41.456 44.921 -8.781 1.00 10.35 C ATOM 85 CA ILE A 85 45.165 45.622 -9.392 1.00 9.87 C ATOM 86 CA GLY A 86 47.108 43.039 -7.380 1.00 9.13 C ATOM 87 CA ARG A 87 50.729 42.570 -6.372 1.00 9.88 C ATOM 88 CA ASN A 88 51.848 41.082 -9.690 1.00 12.64 C ATOM 89 CA LEU A 89 51.400 44.599 -11.326 1.00 12.95 C ATOM 90 CA LEU A 90 51.890 46.949 -8.299 1.00 12.11 C ATOM 91 CA THR A 91 55.449 45.681 -7.921 1.00 12.71 C ATOM 92 CA GLN A 92 56.148 46.735 -11.561 1.00 11.49 C ATOM 93 CA ILE A 93 55.135 50.350 -10.939 1.00 13.77 C ATOM 94 CA GLY A 94 57.197 50.512 -7.825 1.00 15.64 C ATOM 95 CA CYS A 95 54.318 50.764 -5.339 1.00 16.34 C ATOM 96 CA THR A 96 55.218 50.203 -1.633 1.00 14.04 C ATOM 97 CA LEU A 97 53.266 50.335 1.702 1.00 17.79 C ATOM 98 CA ASN A 98 54.730 52.821 4.167 1.00 20.38 C ATOM 99 CA PHE A 99 54.114 53.568 7.923 1.00 25.37 C END If you find results from this site helpful for your research, please cite one of our papers:
elNémo
is maintained by Yves-Henri Sanejouand. |