CNRS Nantes University US2B US2B
home |  start a new run |  job status |  references&downloads |  examples |  help  

Should you encounter any unexpected behaviour,
please let us know.


***    ***

elNémo ID: 24041412352388206

Job options:

ID        	=	 24041412352388206
JOBID     	=	 
USERID    	=	 unknown
PRIVAT    	=	 0

NMODES    	=	 10
DQMIN     	=	 -100
DQMAX     	=	 100
DQSTEP    	=	 20
DOGRAPHS  	=	 on

DOPROJMODS	=	 0
DORMSD    	=	 0

NRBL      	=	 -1
CUTOFF    	=	 8
CAONLY    	=	 0


Input data for this run:


CRYST1    0.000    0.000    0.000  90.00  90.00  90.00 P 1           1
ATOM      1  CA  SER A  96      12.255 -17.300  32.999  1.00 71.26           C
ATOM      2  CA  VAL A  97       9.072 -15.197  33.108  1.00 49.22           C
ATOM      3  CA  PRO A  98       8.110 -12.448  35.610  1.00 40.30           C
ATOM      4  CA  SER A  99       4.905 -13.036  37.618  1.00 47.78           C
ATOM      5  CA  GLN A 100       1.639 -11.381  36.600  1.00 48.96           C
ATOM      6  CA  LYS A 101      -0.461 -12.504  39.544  1.00 36.35           C
ATOM      7  CA  THR A 102      -2.508  -9.666  40.983  1.00 40.15           C
ATOM      8  CA  TYR A 103      -1.490  -8.801  44.581  1.00 37.61           C
ATOM      9  CA  GLN A 104      -3.103  -5.953  46.493  1.00 38.77           C
ATOM     10  CA  GLY A 105      -0.813  -6.427  49.484  1.00 37.36           C
ATOM     11  CA  SER A 106      -0.827  -4.601  52.804  1.00 37.27           C
ATOM     12  CA  TYR A 107      -1.602  -1.280  51.191  1.00 32.58           C
ATOM     13  CA  GLY A 108      -4.582  -2.282  49.087  1.00 26.35           C
ATOM     14  CA  PHE A 109      -2.833  -1.555  45.787  1.00 33.94           C
ATOM     15  CA  ARG A 110      -5.159  -1.123  42.772  1.00 36.97           C
ATOM     16  CA  LEU A 111      -4.947   0.405  39.272  1.00 35.91           C
ATOM     17  CA  GLY A 112      -7.250   3.091  37.861  1.00 38.82           C
ATOM     18  CA  PHE A 113      -7.832   4.799  34.488  1.00 32.47           C
ATOM     19  CA  LEU A 114      -9.490   7.770  32.833  1.00 35.96           C
ATOM     20  CA  HIS A 115     -13.005   6.909  31.589  1.00 36.12           C
ATOM     21  CA  SER A 116     -12.338   8.486  28.155  1.00 37.64           C
ATOM     22  CA  GLY A 117     -14.858   6.829  25.811  1.00 35.76           C
ATOM     23  CA  THR A 118     -14.311   5.817  22.188  1.00 34.98           C
ATOM     24  CA  ALA A 119     -14.761   9.015  20.212  1.00 42.35           C
ATOM     25  CA  LYS A 120     -12.505   9.090  17.127  1.00 49.87           C
ATOM     26  CA  SER A 121     -10.194  11.804  18.523  1.00 54.08           C
ATOM     27  CA  VAL A 122      -9.216  10.265  21.897  1.00 47.80           C
ATOM     28  CA  THR A 123      -5.500   9.562  22.300  1.00 43.11           C
ATOM     29  CA  CYS A 124      -5.869   7.044  25.085  1.00 35.97           C
ATOM     30  CA  THR A 125      -8.726   4.905  26.373  1.00 32.08           C
ATOM     31  CA  TYR A 126      -9.275   1.952  28.680  1.00 27.65           C
ATOM     32  CA  SER A 127     -11.632  -1.010  28.432  1.00 29.72           C
ATOM     33  CA  PRO A 128     -12.952  -2.388  31.753  1.00 26.44           C
ATOM     34  CA  ALA A 129     -14.491  -5.369  29.940  1.00 31.88           C
ATOM     35  CA  LEU A 130     -11.185  -6.322  28.285  1.00 40.59           C
ATOM     36  CA  ASN A 131      -8.876  -4.966  31.031  1.00 34.22           C
ATOM     37  CA  LYS A 132      -7.091  -3.433  28.095  1.00 28.66           C
ATOM     38  CA  MET A 133      -5.473  -0.110  27.360  1.00 32.77           C
ATOM     39  CA  PHE A 134      -5.599   1.331  23.868  1.00 32.74           C
ATOM     40  CA  CYS A 135      -3.225   4.234  23.250  1.00 39.31           C
ATOM     41  CA  GLN A 136      -1.350   6.058  20.521  1.00 42.89           C
ATOM     42  CA  LEU A 137       2.374   5.856  19.755  1.00 44.61           C
ATOM     43  CA  ALA A 138       4.442   8.188  21.960  1.00 46.80           C
ATOM     44  CA  LYS A 139       1.388   9.810  23.554  1.00 44.17           C
ATOM     45  CA  THR A 140       0.768  10.195  27.280  1.00 45.36           C
ATOM     46  CA  CYS A 141      -1.120   7.278  28.757  1.00 46.88           C
ATOM     47  CA  PRO A 142      -2.214   8.066  32.340  1.00 36.82           C
ATOM     48  CA  VAL A 143      -2.256   5.196  34.817  1.00 28.29           C
ATOM     49  CA  GLN A 144      -3.731   5.689  38.281  1.00 32.78           C
ATOM     50  CA  LEU A 145      -2.353   4.230  41.478  1.00 29.86           C
ATOM     51  CA  TRP A 146      -4.959   3.634  44.231  1.00 34.10           C
ATOM     52  CA  VAL A 147      -4.146   2.588  47.820  1.00 39.44           C
ATOM     53  CA  ASP A 148      -6.165   1.863  50.980  1.00 49.74           C
ATOM     54  CA  SER A 149      -3.158   2.889  53.094  1.00 52.52           C
ATOM     55  CA  THR A 150      -0.141   5.112  52.324  1.00 45.26           C
ATOM     56  CA  PRO A 151       3.008   3.084  51.542  1.00 37.02           C
ATOM     57  CA  PRO A 152       6.258   3.998  53.399  1.00 45.43           C
ATOM     58  CA  PRO A 153       8.717   6.556  52.012  1.00 46.55           C
ATOM     59  CA  GLY A 154      11.281   5.063  49.658  1.00 41.82           C
ATOM     60  CA  THR A 155       8.571   3.028  47.965  1.00 39.55           C
ATOM     61  CA  ARG A 156       9.146   2.637  44.214  1.00 39.43           C
ATOM     62  CA  VAL A 157       6.817   1.945  41.243  1.00 36.17           C
ATOM     63  CA  ARG A 158       8.078  -0.263  38.397  1.00 28.67           C
ATOM     64  CA  ALA A 159       6.498  -0.904  34.972  1.00 34.01           C
ATOM     65  CA  MET A 160       7.460  -3.854  32.775  1.00 32.83           C
ATOM     66  CA  ALA A 161       6.195  -5.335  29.512  1.00 32.17           C
ATOM     67  CA  ILE A 162       5.743  -8.985  28.567  1.00 30.52           C
ATOM     68  CA  TYR A 163       4.013 -10.732  25.645  1.00 37.40           C
ATOM     69  CA  LYS A 164       0.509 -11.985  26.480  1.00 47.75           C
ATOM     70  CA  GLN A 165       0.570 -15.272  24.542  1.00 51.85           C
ATOM     71  CA  SER A 166       2.337 -18.048  26.433  1.00 53.96           C
ATOM     72  CA  GLN A 167       4.476 -19.122  23.458  1.00 62.18           C
ATOM     73  CA  HIS A 168       6.086 -15.667  23.406  1.00 49.36           C
ATOM     74  CA  MET A 169       6.519 -14.879  27.108  1.00 46.66           C
ATOM     75  CA  THR A 170      10.256 -15.666  27.341  1.00 44.54           C
ATOM     76  CA  GLU A 171      11.105 -13.267  24.511  1.00 44.37           C
ATOM     77  CA  VAL A 172      12.053  -9.815  25.815  1.00 40.88           C
ATOM     78  CA  VAL A 173       9.718  -7.025  24.685  1.00 38.25           C
ATOM     79  CA  ARG A 174      11.843  -4.271  23.116  1.00 46.76           C
ATOM     80  CA  ARG A 175      11.500  -1.546  20.474  1.00 39.91           C
ATOM     81  CA  CYS A 176      11.767  -2.595  16.833  1.00 41.54           C
ATOM     82  CA  PRO A 177      15.011  -1.853  14.971  1.00 44.08           C
ATOM     83  CA  HIS A 178      13.600   1.249  13.286  1.00 41.49           C
ATOM     84  CA  HIS A 179      12.351   2.946  16.464  1.00 43.33           C
ATOM     85  CA  GLU A 180      15.362   1.763  18.395  1.00 42.08           C
ATOM     86  CA  ARG A 181      17.358   3.809  15.904  1.00 56.32           C
ATOM     87  CA  CYS A 182      14.958   6.787  15.941  1.00 51.18           C
ATOM     88  CA  SER A 183      15.902  10.275  17.072  1.00 59.61           C
ATOM     89  CA  ASP A 184      13.182  10.519  19.694  1.00 50.23           C
ATOM     90  CA  SER A 185      15.250  10.277  22.842  1.00 44.12           C
ATOM     91  CA  ASP A 186      14.211  12.518  25.746  1.00 37.64           C
ATOM     92  CA  GLY A 187      17.716  12.167  27.149  1.00 45.99           C
ATOM     93  CA  LEU A 188      16.748   9.702  29.851  1.00 40.19           C
ATOM     94  CA  ALA A 189      15.287   6.580  28.279  1.00 34.58           C
ATOM     95  CA  PRO A 190      17.482   3.858  26.735  1.00 34.06           C
ATOM     96  CA  PRO A 191      16.862   3.640  22.950  1.00 42.21           C
ATOM     97  CA  GLN A 192      15.575   0.019  23.098  1.00 41.51           C
ATOM     98  CA  HIS A 193      13.048   0.581  25.917  1.00 35.01           C
ATOM     99  CA  LEU A 194       9.343   0.378  24.972  1.00 27.23           C
ATOM    100  CA  ILE A 195       7.946   2.061  28.095  1.00 31.38           C
ATOM    101  CA  ARG A 196       8.983   5.573  29.177  1.00 31.51           C
ATOM    102  CA  VAL A 197       7.740   7.941  31.894  1.00 37.13           C
ATOM    103  CA  GLU A 198       7.593  11.664  31.091  1.00 48.11           C
ATOM    104  CA  GLY A 199       7.761  14.701  33.360  1.00 52.38           C
ATOM    105  CA  ASN A 200       9.759  13.083  36.163  1.00 41.45           C
ATOM    106  CA  LEU A 201      13.458  13.949  36.546  1.00 45.44           C
ATOM    107  CA  ARG A 202      13.898  11.085  39.016  1.00 42.42           C
ATOM    108  CA  VAL A 203      12.975   8.418  36.484  1.00 26.86           C
ATOM    109  CA  GLU A 204      15.251   5.380  36.404  1.00 28.91           C
ATOM    110  CA  TYR A 205      15.670   2.690  33.716  1.00 30.78           C
ATOM    111  CA  LEU A 206      16.884  -0.909  34.117  1.00 30.90           C
ATOM    112  CA  ASP A 207      18.365  -3.620  31.947  1.00 29.55           C
ATOM    113  CA  ASP A 208      18.210  -6.667  34.196  1.00 32.71           C
ATOM    114  CA  ARG A 209      21.675  -8.212  34.206  1.00 49.84           C
ATOM    115  CA  ASN A 210      20.201 -11.722  34.354  1.00 47.01           C
ATOM    116  CA  THR A 211      16.867 -11.599  32.535  1.00 43.83           C
ATOM    117  CA  PHE A 212      17.691  -8.813  30.082  1.00 35.30           C
ATOM    118  CA  ARG A 213      14.183  -7.443  30.573  1.00 30.93           C
ATOM    119  CA  HIS A 214      13.535  -3.707  30.506  1.00 28.76           C
ATOM    120  CA  SER A 215      11.649  -1.794  33.142  1.00 25.20           C
ATOM    121  CA  VAL A 216      11.132   1.786  34.320  1.00 26.53           C
ATOM    122  CA  VAL A 217      10.812   2.804  37.946  1.00 29.41           C
ATOM    123  CA  VAL A 218       9.996   6.121  39.689  1.00 29.20           C
ATOM    124  CA  PRO A 219       9.685   7.069  43.385  1.00 37.26           C
ATOM    125  CA  TYR A 220       6.125   6.512  44.693  1.00 34.71           C
ATOM    126  CA  GLU A 221       4.437   9.817  45.503  1.00 47.47           C
ATOM    127  CA  PRO A 222       1.510  10.009  47.928  1.00 46.06           C
ATOM    128  CA  PRO A 223      -1.672  11.733  46.698  1.00 55.20           C
ATOM    129  CA  GLU A 224      -2.236  15.149  48.237  1.00 71.93           C
ATOM    130  CA  VAL A 225      -4.902  14.899  50.997  1.00 73.34           C
ATOM    131  CA  GLY A 226      -7.510  16.223  48.518  1.00 86.75           C
ATOM    132  CA  SER A 227      -6.924  13.591  45.830  1.00 83.06           C
ATOM    133  CA  ASP A 228      -7.583   9.841  45.961  1.00 73.86           C
ATOM    134  CA  CYS A 229      -4.871   8.430  43.691  1.00 45.60           C
ATOM    135  CA  THR A 230      -1.440   9.004  42.227  1.00 37.21           C
ATOM    136  CA  THR A 231      -1.031   9.488  38.465  1.00 36.93           C
ATOM    137  CA  ILE A 232       1.962   8.295  36.453  1.00 35.80           C
ATOM    138  CA  HIS A 233       2.203   9.425  32.822  1.00 40.18           C
ATOM    139  CA  TYR A 234       3.415   6.531  30.701  1.00 30.85           C
ATOM    140  CA  ASN A 235       4.508   6.498  27.042  1.00  0.00           C
ATOM    141  CA  TYR A 236       4.712   3.546  24.643  1.00 30.21           C
ATOM    142  CA  MET A 237       7.397   4.167  22.018  1.00 41.67           C
ATOM    143  CA  CYS A 238       6.674   1.482  19.452  1.00 45.98           C
ATOM    144  CA  ASN A 239       3.499   0.377  17.631  1.00 47.76           C
ATOM    145  CA  SER A 240       1.738  -2.969  18.030  1.00 45.97           C
ATOM    146  CA  SER A 241       1.928  -3.273  14.253  1.00 49.37           C
ATOM    147  CA  CYS A 242       5.682  -2.562  14.040  1.00 56.95           C
ATOM    148  CA  MET A 243       7.314  -5.264  11.966  1.00 60.55           C
ATOM    149  CA  GLY A 244      10.501  -6.463  13.640  1.00 59.67           C
ATOM    150  CA  GLY A 245       9.216  -5.652  17.087  1.00 51.49           C
ATOM    151  CA  MET A 246       6.064  -6.741  18.852  1.00 48.66           C
ATOM    152  CA  ASN A 247       4.827  -7.475  15.337  1.00 61.97           C
ATOM    153  CA  ARG A 248       1.079  -7.638  16.029  1.00 61.26           C
ATOM    154  CA  ARG A 249       1.663  -9.728  19.174  1.00 53.29           C
ATOM    155  CA  PRO A 250      -0.360  -8.514  22.192  1.00 42.02           C
ATOM    156  CA  ILE A 251       1.460  -7.438  25.385  1.00 36.21           C
ATOM    157  CA  LEU A 252       0.738  -6.876  29.069  1.00 37.42           C
ATOM    158  CA  THR A 253       2.134  -4.159  31.304  1.00 35.17           C
ATOM    159  CA  ILE A 254       2.971  -5.263  34.824  1.00 30.66           C
ATOM    160  CA  ILE A 255       2.987  -2.606  37.548  1.00 38.32           C
ATOM    161  CA  THR A 256       4.722  -3.565  40.788  1.00 29.35           C
ATOM    162  CA  LEU A 257       4.846  -1.740  44.069  1.00 36.50           C
ATOM    163  CA  GLU A 258       8.200  -2.190  45.856  1.00 32.29           C
ATOM    164  CA  ASP A 259      10.142  -0.827  48.880  1.00 34.13           C
ATOM    165  CA  SER A 260      13.540   0.931  48.793  1.00 39.29           C
ATOM    166  CA  SER A 261      15.310  -2.470  48.856  1.00 45.09           C
ATOM    167  CA  GLY A 262      13.301  -3.809  45.886  1.00 37.67           C
ATOM    168  CA  ASN A 263      11.002  -6.125  47.911  1.00 37.87           C
ATOM    169  CA  LEU A 264       7.487  -6.730  46.448  1.00 33.60           C
ATOM    170  CA  LEU A 265       4.618  -4.780  48.084  1.00 30.04           C
ATOM    171  CA  GLY A 266       1.968  -4.991  45.365  1.00 42.23           C
ATOM    172  CA  ARG A 267       1.320  -6.082  41.790  1.00 39.33           C
ATOM    173  CA  ASN A 268      -1.289  -5.413  39.120  1.00 31.25           C
ATOM    174  CA  SER A 269      -1.403  -5.746  35.352  1.00 30.79           C
ATOM    175  CA  PHE A 270      -3.280  -4.758  32.173  1.00 34.10           C
ATOM    176  CA  GLU A 271      -3.126  -5.619  28.465  1.00 30.51           C
ATOM    177  CA  VAL A 272      -1.942  -2.986  25.985  1.00 33.52           C
ATOM    178  CA  ARG A 273      -2.417  -2.194  22.317  1.00 34.24           C
ATOM    179  CA  VAL A 274      -0.459   0.720  20.826  1.00 38.64           C
ATOM    180  CA  CYS A 275      -2.203   1.830  17.655  1.00 41.67           C
ATOM    181  CA  ALA A 276      -3.535   4.641  15.546  1.00 48.45           C
ATOM    182  CA  CYS A 277      -7.046   5.571  16.671  1.00 57.91           C
ATOM    183  CA  PRO A 278      -7.555   3.737  20.025  1.00 49.51           C
ATOM    184  CA  GLY A 279     -11.175   4.878  20.140  1.00 43.95           C
ATOM    185  CA  ARG A 280     -12.087   2.949  17.006  1.00 45.16           C
ATOM    186  CA  ASP A 281     -10.060  -0.128  17.931  1.00 40.79           C
ATOM    187  CA  ARG A 282     -11.616  -0.267  21.389  1.00 41.51           C
ATOM    188  CA  ARG A 283     -15.231  -0.103  20.136  1.00 41.39           C
ATOM    189  CA  THR A 284     -14.433  -2.703  17.456  1.00 49.71           C
ATOM    190  CA  GLU A 285     -12.755  -5.161  19.808  1.00 51.29           C
ATOM    191  CA  GLU A 286     -15.575  -4.726  22.352  1.00 45.71           C
ATOM    192  CA  GLU A 287     -18.182  -5.410  19.652  1.00 67.22           C
ATOM    193  CA  ASN A 288     -17.203  -9.084  19.603  1.00 79.66           C
ATOM    194  CA  LEU A 289     -18.713  -9.483  23.035  1.00 70.28           C
ATOM    195  ZN  ZN  A 401       8.710   0.208  16.282  1.00 40.65          ZN
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.
It was developed by Karsten Suhre.
Between 2003 and 2014, it was hosted by IGS (Marseille).
Last modification: April 25th, 2023.