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*** ***elNémo ID: 230407234303110463Job options:ID = 230407234303110463 JOBID = USERID = CAH1V1CLOSED 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 50.200 50.200 106.800 90.00 90.00 90.00 P 1 1 ATOM 1 CA PRO A 1 51.842 59.784 -6.815 1.00 34.88 C ATOM 2 CA GLN A 2 51.577 59.564 -2.997 1.00 35.15 C ATOM 3 CA ILE A 3 48.107 57.932 -2.171 1.00 27.03 C ATOM 4 CA THR A 4 46.701 58.033 1.344 1.00 25.63 C ATOM 5 CA LEU A 5 44.183 55.442 2.514 1.00 22.06 C ATOM 6 CA TRP A 6 41.544 57.701 4.088 1.00 18.46 C ATOM 7 CA GLN A 7 39.388 56.510 1.115 1.00 27.79 C ATOM 8 CA ARG A 8 39.662 53.213 -0.904 1.00 20.69 C ATOM 9 CA PRO A 9 42.708 53.768 -3.078 1.00 18.91 C ATOM 10 CA LEU A 10 40.903 53.618 -6.532 1.00 25.36 C ATOM 11 CA VAL A 11 42.884 54.589 -9.625 1.00 28.60 C ATOM 12 CA THR A 12 42.251 54.709 -13.425 1.00 36.63 C ATOM 13 CA ILE A 13 43.809 51.981 -15.445 1.00 34.39 C ATOM 14 CA LYS A 14 43.975 51.774 -19.198 1.00 42.45 C ATOM 15 CA ILE A 15 43.797 48.245 -20.632 1.00 43.02 C ATOM 16 CA GLY A 16 42.521 47.316 -24.076 1.00 45.75 C ATOM 17 CA GLY A 17 41.869 50.971 -25.072 1.00 48.69 C ATOM 18 CA GLN A 18 39.188 50.443 -22.473 1.00 47.74 C ATOM 19 CA LEU A 19 39.687 52.728 -19.521 1.00 43.44 C ATOM 20 CA LYS A 20 38.532 51.307 -16.096 1.00 40.02 C ATOM 21 CA GLU A 21 39.141 52.167 -12.417 1.00 33.74 C ATOM 22 CA ALA A 22 40.640 49.603 -10.016 1.00 26.75 C ATOM 23 CA LEU A 23 41.703 49.173 -6.386 1.00 20.24 C ATOM 24 CA LEU A 24 45.477 49.089 -5.522 1.00 20.88 C ATOM 25 CA ASP A 25 45.318 46.159 -3.128 1.00 21.20 C ATOM 26 CA THR A 26 48.582 45.179 -1.430 1.00 14.97 C ATOM 27 CA GLY A 27 46.733 42.224 -0.031 1.00 8.76 C ATOM 28 CA ALA A 28 45.775 40.761 -3.455 1.00 13.46 C ATOM 29 CA ASP A 29 48.501 38.562 -4.998 1.00 22.54 C ATOM 30 CA ASP A 30 46.716 38.676 -8.410 1.00 25.44 C ATOM 31 CA THR A 31 44.915 41.225 -10.624 1.00 19.78 C ATOM 32 CA VAL A 32 41.270 40.373 -11.334 1.00 15.10 C ATOM 33 CA LEU A 33 39.440 42.554 -13.719 1.00 32.78 C ATOM 34 CA GLU A 34 35.920 42.747 -14.872 1.00 36.50 C ATOM 35 CA GLU A 35 34.897 40.976 -18.035 1.00 33.44 C ATOM 36 CA MET A 36 36.229 42.597 -21.125 1.00 41.13 C ATOM 37 CA SER A 37 37.638 41.297 -24.332 1.00 48.07 C ATOM 38 CA LEU A 38 41.219 41.024 -24.431 1.00 43.41 C ATOM 39 CA PRO A 39 42.734 39.737 -27.687 1.00 48.56 C ATOM 40 CA GLY A 40 44.704 36.743 -26.500 1.00 48.64 C ATOM 41 CA ARG A 41 45.060 33.095 -25.730 1.00 50.88 C ATOM 42 CA TRP A 42 43.813 32.352 -22.311 1.00 37.65 C ATOM 43 CA LYS A 43 44.000 29.437 -19.900 1.00 40.69 C ATOM 44 CA PRO A 44 41.164 28.670 -17.317 1.00 45.30 C ATOM 45 CA LYS A 45 41.624 29.507 -13.608 1.00 41.04 C ATOM 46 CA MET A 46 39.283 29.172 -10.580 1.00 36.04 C ATOM 47 CA ILE A 47 39.491 31.925 -7.918 1.00 30.22 C ATOM 48 CA GLY A 48 37.788 32.073 -4.568 1.00 39.99 C ATOM 49 CA GLY A 49 35.043 34.442 -3.513 1.00 47.57 C ATOM 50 CA ILE A 50 32.347 35.074 -0.949 1.00 54.24 C ATOM 51 CA GLY A 51 29.854 32.271 -1.556 1.00 52.49 C ATOM 52 CA GLY A 52 32.385 30.105 -3.553 1.00 43.73 C ATOM 53 CA PHE A 53 34.898 29.701 -6.356 1.00 40.92 C ATOM 54 CA ILE A 54 34.222 31.428 -9.650 1.00 33.43 C ATOM 55 CA LYS A 55 36.012 30.468 -12.945 1.00 30.62 C ATOM 56 CA VAL A 56 37.951 33.331 -14.627 1.00 27.74 C ATOM 57 CA ARG A 57 40.195 33.474 -17.711 1.00 26.88 C ATOM 58 CA GLN A 58 43.958 34.040 -17.315 1.00 26.05 C ATOM 59 CA TYR A 59 45.679 36.355 -19.847 1.00 29.17 C ATOM 60 CA ASP A 60 49.549 36.399 -19.405 1.00 27.75 C ATOM 61 CA GLN A 61 51.715 39.205 -20.715 1.00 26.68 C ATOM 62 CA ILE A 62 48.974 41.895 -20.905 1.00 28.35 C ATOM 63 CA LEU A 63 50.169 45.531 -20.985 1.00 31.02 C ATOM 64 CA ILE A 64 48.156 47.683 -18.627 1.00 31.95 C ATOM 65 CA GLU A 65 48.817 51.312 -17.679 1.00 35.74 C ATOM 66 CA ILE A 66 48.259 52.150 -13.988 1.00 35.28 C ATOM 67 CA CYS A 67 48.343 55.819 -13.081 1.00 44.44 C ATOM 68 CA GLY A 68 50.240 56.475 -16.154 1.00 45.45 C ATOM 69 CA HIS A 69 52.828 53.643 -15.720 1.00 40.20 C ATOM 70 CA LYS A 70 53.041 50.890 -18.295 1.00 40.48 C ATOM 71 CA ALA A 71 53.222 47.514 -16.704 1.00 37.00 C ATOM 72 CA ILE A 72 53.255 44.000 -18.230 1.00 28.66 C ATOM 73 CA GLY A 73 51.697 41.280 -16.224 1.00 22.09 C ATOM 74 CA THR A 74 49.054 38.652 -16.082 1.00 23.11 C ATOM 75 CA VAL A 75 45.485 39.767 -15.462 1.00 27.03 C ATOM 76 CA LEU A 76 42.659 37.379 -14.574 1.00 24.93 C ATOM 77 CA VAL A 77 39.347 38.530 -16.381 1.00 18.76 C ATOM 78 CA GLY A 78 36.102 37.372 -14.768 1.00 22.24 C ATOM 79 CA PRO A 79 32.810 38.262 -12.975 1.00 25.97 C ATOM 80 CA THR A 80 34.467 40.006 -10.125 1.00 31.28 C ATOM 81 CA PRO A 81 32.448 42.646 -8.163 1.00 28.82 C ATOM 82 CA VAL A 82 35.612 44.765 -8.065 1.00 28.83 C ATOM 83 CA ASN A 83 38.639 45.443 -10.272 1.00 28.94 C ATOM 84 CA ILE A 84 41.739 44.698 -8.177 1.00 20.90 C ATOM 85 CA ILE A 85 45.407 45.630 -9.031 1.00 17.90 C ATOM 86 CA GLY A 86 47.282 43.168 -6.872 1.00 18.81 C ATOM 87 CA ARG A 87 50.954 42.682 -6.044 1.00 22.16 C ATOM 88 CA ASN A 88 51.888 40.981 -9.300 1.00 20.95 C ATOM 89 CA LEU A 89 51.485 44.433 -11.016 1.00 16.67 C ATOM 90 CA LEU A 90 52.110 46.793 -8.029 1.00 19.58 C ATOM 91 CA THR A 91 55.719 45.544 -8.243 1.00 17.45 C ATOM 92 CA GLN A 92 56.232 46.651 -11.858 1.00 20.97 C ATOM 93 CA ILE A 93 55.001 50.180 -11.313 1.00 23.58 C ATOM 94 CA GLY A 94 57.347 50.391 -8.267 1.00 27.50 C ATOM 95 CA CYS A 95 54.716 50.613 -5.473 1.00 27.44 C ATOM 96 CA THR A 96 55.903 50.713 -1.945 1.00 24.82 C ATOM 97 CA LEU A 97 54.052 51.039 1.392 1.00 24.24 C ATOM 98 CA ASN A 98 55.612 53.860 3.315 1.00 28.65 C ATOM 99 CA PHE A 99 55.232 55.089 6.899 1.00 33.20 C END If you find results from this site helpful for your research, please cite one of our papers:
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