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***  Pepstr23710-test  ***

elNémo ID: 20072719543847030

Job options:

ID        	=	 20072719543847030
JOBID     	=	 Pepstr23710-test
USERID    	=	 Pepstr23710-test
PRIVAT    	=	 0

NMODES    	=	 5
DQMIN     	=	 -100
DQMAX     	=	 100
DQSTEP    	=	 20
DOGRAPHS  	=	 on

DOPROJMODS	=	 0
DORMSD    	=	 0

NRBL      	=	 0
CUTOFF    	=	 0
CAONLY    	=	 0


Input data for this run:

HEADER Pepstr23710-test

HEADER PEPstrMOD
ATOM      1  N   ASP A   1      -0.678 -14.470  -3.174  1.00  0.00           N  
ATOM      2  CA  ASP A   1      -1.285 -13.697  -2.067  1.00  0.00           C  
ATOM      3  CB  ASP A   1      -2.650 -14.267  -1.700  1.00  0.00           C  
ATOM      4  CG  ASP A   1      -3.353 -13.634  -0.499  1.00  0.00           C  
ATOM      5  OD1 ASP A   1      -3.486 -12.385  -0.463  1.00  0.00           O  
ATOM      6  OD2 ASP A   1      -3.839 -14.369   0.396  1.00  0.00           O  
ATOM      7  C   ASP A   1      -0.418 -13.741  -0.784  1.00  0.00           C  
ATOM      8  O   ASP A   1       0.118 -14.823  -0.414  1.00  0.00           O  
ATOM      9  N   ALA A   2      -0.397 -12.600  -0.073  1.00  0.00           N  
ATOM     10  CA  ALA A   2      -0.235 -12.637   1.396  1.00  0.00           C  
ATOM     11  CB  ALA A   2      -0.215 -11.216   1.918  1.00  0.00           C  
ATOM     12  C   ALA A   2      -1.249 -13.531   2.124  1.00  0.00           C  
ATOM     13  O   ALA A   2      -2.343 -13.047   2.496  1.00  0.00           O  
ATOM     14  N   LYS A   3      -0.864 -14.815   2.389  1.00  0.00           N  
ATOM     15  CA  LYS A   3      -1.807 -15.896   2.728  1.00  0.00           C  
ATOM     16  CB  LYS A   3      -0.995 -17.159   2.895  1.00  0.00           C  
ATOM     17  CG  LYS A   3      -0.696 -17.913   1.531  1.00  0.00           C  
ATOM     18  CD  LYS A   3      -1.278 -19.310   1.246  1.00  0.00           C  
ATOM     19  CE  LYS A   3      -2.800 -19.451   0.942  1.00  0.00           C  
ATOM     20  NZ  LYS A   3      -3.501 -19.175   2.224  1.00  0.00           N  
ATOM     21  C   LYS A   3      -2.750 -15.728   3.994  1.00  0.00           C  
ATOM     22  O   LYS A   3      -3.616 -16.576   4.245  1.00  0.00           O  
ATOM     23  N   ALA A   4      -2.734 -14.648   4.787  1.00  0.00           N  
ATOM     24  CA  ALA A   4      -3.826 -14.290   5.714  1.00  0.00           C  
ATOM     25  CB  ALA A   4      -3.234 -13.066   6.440  1.00  0.00           C  
ATOM     26  C   ALA A   4      -5.130 -14.023   4.906  1.00  0.00           C  
ATOM     27  O   ALA A   4      -5.277 -13.213   3.954  1.00  0.00           O  
ATOM     28  N   VAL A   5      -6.224 -14.794   5.161  1.00  0.00           N  
ATOM     29  CA  VAL A   5      -7.506 -15.113   4.446  1.00  0.00           C  
ATOM     30  CB  VAL A   5      -7.494 -14.693   2.940  1.00  0.00           C  
ATOM     31  CG1 VAL A   5      -6.507 -15.388   2.003  1.00  0.00           C  
ATOM     32  CG2 VAL A   5      -8.885 -14.624   2.318  1.00  0.00           C  
ATOM     33  C   VAL A   5      -7.855 -16.561   4.762  1.00  0.00           C  
ATOM     34  O   VAL A   5      -7.571 -17.001   5.871  1.00  0.00           O  
ATOM     35  N   LEU A   6      -8.414 -17.377   3.876  1.00  0.00           N  
ATOM     36  CA  LEU A   6      -8.544 -18.842   4.045  1.00  0.00           C  
ATOM     37  CB  LEU A   6      -9.616 -19.246   3.063  1.00  0.00           C  
ATOM     38  CG  LEU A   6      -9.818 -20.771   3.163  1.00  0.00           C  
ATOM     39  CD1 LEU A   6     -10.588 -21.175   4.395  1.00  0.00           C  
ATOM     40  CD2 LEU A   6     -10.658 -21.075   1.893  1.00  0.00           C  
ATOM     41  C   LEU A   6      -7.213 -19.558   4.090  1.00  0.00           C  
ATOM     42  O   LEU A   6      -6.349 -19.511   3.203  1.00  0.00           O  
ATOM     43  N   GLU A   7      -7.030 -20.393   5.159  1.00  0.00           N  
ATOM     44  CA  GLU A   7      -5.783 -21.153   5.491  1.00  0.00           C  
ATOM     45  CB  GLU A   7      -4.695 -20.127   5.939  1.00  0.00           C  
ATOM     46  CG  GLU A   7      -3.368 -20.822   6.289  1.00  0.00           C  
ATOM     47  CD  GLU A   7      -2.920 -21.724   5.097  1.00  0.00           C  
ATOM     48  OE1 GLU A   7      -2.341 -21.035   4.201  1.00  0.00           O  
ATOM     49  OE2 GLU A   7      -3.062 -22.969   5.091  1.00  0.00           O  
ATOM     50  C   GLU A   7      -6.277 -22.221   6.567  1.00  0.00           C  
ATOM     51  O   GLU A   7      -7.251 -22.049   7.312  1.00  0.00           O  
ATOM     52  N   GLU A   8      -5.513 -23.298   6.594  1.00  0.00           N  
ATOM     53  CA  GLU A   8      -5.925 -24.416   7.425  1.00  0.00           C  
ATOM     54  CB  GLU A   8      -7.000 -25.220   6.705  1.00  0.00           C  
ATOM     55  CG  GLU A   8      -6.461 -25.788   5.363  1.00  0.00           C  
ATOM     56  CD  GLU A   8      -5.459 -26.891   5.532  1.00  0.00           C  
ATOM     57  OE1 GLU A   8      -4.273 -26.654   5.335  1.00  0.00           O  
ATOM     58  OE2 GLU A   8      -5.861 -28.075   5.820  1.00  0.00           O  
ATOM     59  C   GLU A   8      -4.691 -25.139   7.995  1.00  0.00           C  
ATOM     60  O   GLU A   8      -3.590 -24.685   7.795  1.00  0.00           O  
ATOM     61  N   ASP A   9      -4.884 -26.259   8.698  1.00  0.00           N  
ATOM     62  CA  ASP A   9      -3.801 -26.995   9.460  1.00  0.00           C  
ATOM     63  CB  ASP A   9      -4.412 -28.240  10.029  1.00  0.00           C  
ATOM     64  CG  ASP A   9      -3.388 -28.849  10.946  1.00  0.00           C  
ATOM     65  OD1 ASP A   9      -3.255 -28.428  12.110  1.00  0.00           O  
ATOM     66  OD2 ASP A   9      -2.600 -29.649  10.417  1.00  0.00           O  
ATOM     67  C   ASP A   9      -2.490 -27.260   8.609  1.00  0.00           C  
ATOM     68  O   ASP A   9      -2.625 -27.612   7.432  1.00  0.00           O  
ATOM     69  N   GLU A  10      -1.310 -27.226   9.248  1.00  0.00           N  
ATOM     70  CA  GLU A  10      -0.121 -27.380   8.410  1.00  0.00           C  
ATOM     71  CB  GLU A  10       1.078 -26.637   9.091  1.00  0.00           C  
ATOM     72  CG  GLU A  10       1.826 -27.480  10.123  1.00  0.00           C  
ATOM     73  CD  GLU A  10       0.963 -27.732  11.417  1.00  0.00           C  
ATOM     74  OE1 GLU A  10       1.374 -28.601  12.201  1.00  0.00           O  
ATOM     75  OE2 GLU A  10      -0.120 -27.196  11.595  1.00  0.00           O  
ATOM     76  C   GLU A  10       0.254 -28.825   8.077  1.00  0.00           C  
ATOM     77  O   GLU A  10       1.329 -29.037   7.469  1.00  0.00           O  
ATOM     78  N   GLU A  11      -0.458 -29.791   8.636  1.00  0.00           N  
ATOM     79  CA  GLU A  11      -0.682 -31.042   7.944  1.00  0.00           C  
ATOM     80  CB  GLU A  11      -0.237 -32.309   8.710  1.00  0.00           C  
ATOM     81  CG  GLU A  11      -0.783 -32.580  10.114  1.00  0.00           C  
ATOM     82  CD  GLU A  11       0.096 -32.126  11.285  1.00  0.00           C  
ATOM     83  OE1 GLU A  11      -0.234 -31.034  11.859  1.00  0.00           O  
ATOM     84  OE2 GLU A  11       1.212 -32.588  11.466  1.00  0.00           O  
ATOM     85  C   GLU A  11      -2.130 -31.101   7.410  1.00  0.00           C  
ATOM     86  O   GLU A  11      -2.372 -30.904   6.228  1.00  0.00           O  
ATOM     87  N   VAL A  12      -3.152 -31.390   8.251  1.00  0.00           N  
ATOM     88  CA  VAL A  12      -4.556 -31.624   7.775  1.00  0.00           C  
ATOM     89  CB  VAL A  12      -4.640 -33.014   7.094  1.00  0.00           C  
ATOM     90  CG1 VAL A  12      -4.374 -34.128   8.154  1.00  0.00           C  
ATOM     91  CG2 VAL A  12      -5.846 -33.335   6.263  1.00  0.00           C  
ATOM     92  C   VAL A  12      -5.505 -31.296   8.868  1.00  0.00           C  
ATOM     93  O   VAL A  12      -5.162 -31.424  10.033  1.00  0.00           O  
ATOM     94  N   THR A  13      -6.651 -30.729   8.496  1.00  0.00           N  
ATOM     95  CA  THR A  13      -7.674 -30.263   9.403  1.00  0.00           C  
ATOM     96  CB  THR A  13      -8.543 -29.255   8.653  1.00  0.00           C  
ATOM     97  CG2 THR A  13      -9.565 -28.587   9.507  1.00  0.00           C  
ATOM     98  OG1 THR A  13      -7.555 -28.321   8.236  1.00  0.00           O  
ATOM     99  C   THR A  13      -8.481 -31.420   9.895  1.00  0.00           C  
ATOM    100  O   THR A  13      -8.833 -32.397   9.236  1.00  0.00           O  
ATOM    101  N   GLU A  14      -8.794 -31.312  11.195  1.00  0.00           N  
ATOM    102  CA  GLU A  14      -9.757 -32.087  12.014  1.00  0.00           C  
ATOM    103  CB  GLU A  14      -9.005 -33.006  12.999  1.00  0.00           C  
ATOM    104  CG  GLU A  14      -9.848 -34.286  13.263  1.00  0.00           C  
ATOM    105  CD  GLU A  14      -9.711 -35.249  12.135  1.00  0.00           C  
ATOM    106  OE1 GLU A  14      -8.686 -35.942  11.967  1.00  0.00           O  
ATOM    107  OE2 GLU A  14     -10.511 -35.019  11.185  1.00  0.00           O  
ATOM    108  C   GLU A  14     -10.755 -31.147  12.721  1.00  0.00           C  
ATOM    109  O   GLU A  14     -10.492 -29.961  12.691  1.00  0.00           O  
ATOM    110  N   GLU A  15     -11.791 -31.667  13.366  1.00  0.00           N  
ATOM    111  CA  GLU A  15     -12.670 -30.927  14.258  1.00  0.00           C  
ATOM    112  CB  GLU A  15     -13.962 -30.459  13.586  1.00  0.00           C  
ATOM    113  CG  GLU A  15     -14.789 -29.407  14.207  1.00  0.00           C  
ATOM    114  CD  GLU A  15     -15.166 -29.682  15.620  1.00  0.00           C  
ATOM    115  OE1 GLU A  15     -14.402 -29.076  16.442  1.00  0.00           O  
ATOM    116  OE2 GLU A  15     -15.985 -30.485  16.033  1.00  0.00           O  
ATOM    117  C   GLU A  15     -12.747 -31.768  15.502  1.00  0.00           C  
ATOM    118  O   GLU A  15     -13.606 -32.675  15.515  1.00  0.00           O  
ATOM    119  N   ALA A  16     -11.900 -31.531  16.489  1.00  0.00           N  
ATOM    120  CA  ALA A  16     -11.809 -32.141  17.814  1.00  0.00           C  
ATOM    121  CB  ALA A  16     -10.520 -31.805  18.561  1.00  0.00           C  
ATOM    122  C   ALA A  16     -13.061 -31.891  18.662  1.00  0.00           C  
ATOM    123  O   ALA A  16     -13.957 -31.207  18.260  1.00  0.00           O  
ATOM    124  N   GLU A  17     -13.082 -32.461  19.844  1.00  0.00           N  
ATOM    125  CA  GLU A  17     -14.226 -32.359  20.778  1.00  0.00           C  
ATOM    126  CB  GLU A  17     -14.914 -33.717  20.950  1.00  0.00           C  
ATOM    127  CG  GLU A  17     -16.409 -33.625  20.656  1.00  0.00           C  
ATOM    128  CD  GLU A  17     -16.679 -33.312  19.251  1.00  0.00           C  
ATOM    129  OE1 GLU A  17     -16.991 -32.131  18.982  1.00  0.00           O  
ATOM    130  OE2 GLU A  17     -16.411 -34.121  18.337  1.00  0.00           O  
ATOM    131  C   GLU A  17     -13.763 -31.699  22.058  1.00  0.00           C  
ATOM    132  O   GLU A  17     -13.017 -32.290  22.806  1.00  0.00           O  
ATOM    133  N   MET A  18     -14.345 -30.505  22.341  1.00  0.00           N  
ATOM    134  CA  MET A  18     -14.056 -29.628  23.475  1.00  0.00           C  
ATOM    135  CB  MET A  18     -13.011 -28.610  23.109  1.00  0.00           C  
ATOM    136  CG  MET A  18     -11.626 -29.157  22.875  1.00  0.00           C  
ATOM    137  SD  MET A  18     -10.365 -27.875  22.584  1.00  0.00           S  
ATOM    138  CE  MET A  18      -9.083 -28.894  21.893  1.00  0.00           C  
ATOM    139  C   MET A  18     -15.340 -29.036  24.012  1.00  0.00           C  
ATOM    140  O   MET A  18     -15.377 -28.374  25.078  1.00  0.00           O  
ATOM    141  N   GLU A  19     -16.479 -29.269  23.308  1.00  0.00           N  
ATOM    142  CA  GLU A  19     -17.817 -28.610  23.357  1.00  0.00           C  
ATOM    143  CB  GLU A  19     -17.789 -27.254  22.629  1.00  0.00           C  
ATOM    144  CG  GLU A  19     -16.924 -27.166  21.352  1.00  0.00           C  
ATOM    145  CD  GLU A  19     -17.008 -28.304  20.305  1.00  0.00           C  
ATOM    146  OE1 GLU A  19     -17.822 -28.366  19.327  1.00  0.00           O  
ATOM    147  OE2 GLU A  19     -16.206 -29.279  20.457  1.00  0.00           O  
ATOM    148  C   GLU A  19     -18.836 -29.481  22.668  1.00  0.00           C  
ATOM    149  O   GLU A  19     -18.471 -30.258  21.820  1.00  0.00           O  
ATOM    150  N   PRO A  20     -20.209 -29.336  22.858  1.00  0.00           N  
ATOM    151  CD  PRO A  20     -20.811 -28.541  23.904  1.00  0.00           C  
ATOM    152  CG  PRO A  20     -22.313 -28.428  23.461  1.00  0.00           C  
ATOM    153  CB  PRO A  20     -22.621 -29.654  22.709  1.00  0.00           C  
ATOM    154  CA  PRO A  20     -21.274 -30.003  22.076  1.00  0.00           C  
ATOM    155  C   PRO A  20     -21.178 -29.586  20.608  1.00  0.00           C  
ATOM    156  O   PRO A  20     -20.992 -30.420  19.776  1.00  0.00           O  
ATOM    157  N   GLU A  21     -21.104 -28.282  20.339  1.00  0.00           N  
ATOM    158  CA  GLU A  21     -21.039 -27.548  19.021  1.00  0.00           C  
ATOM    159  CB  GLU A  21     -22.318 -27.884  18.178  1.00  0.00           C  
ATOM    160  CG  GLU A  21     -22.510 -27.213  16.820  1.00  0.00           C  
ATOM    161  CD  GLU A  21     -23.448 -25.987  16.884  1.00  0.00           C  
ATOM    162  OE1 GLU A  21     -24.416 -25.922  16.079  1.00  0.00           O  
ATOM    163  OE2 GLU A  21     -23.327 -25.049  17.678  1.00  0.00           O  
ATOM    164  C   GLU A  21     -20.839 -26.045  19.395  1.00  0.00           C  
ATOM    165  O   GLU A  21     -21.586 -25.545  20.237  1.00  0.00           O  
ATOM    166  N   ASP A  22     -19.763 -25.416  18.878  1.00  0.00           N  
ATOM    167  CA  ASP A  22     -19.321 -24.090  19.411  1.00  0.00           C  
ATOM    168  CB  ASP A  22     -17.966 -23.783  18.866  1.00  0.00           C  
ATOM    169  CG  ASP A  22     -17.499 -22.496  19.457  1.00  0.00           C  
ATOM    170  OD1 ASP A  22     -17.368 -22.365  20.701  1.00  0.00           O  
ATOM    171  OD2 ASP A  22     -17.447 -21.524  18.721  1.00  0.00           O  
ATOM    172  C   ASP A  22     -20.263 -22.894  19.074  1.00  0.00           C  
ATOM    173  O   ASP A  22     -20.277 -21.958  19.848  1.00  0.00           O  
ATOM    174  N   LYS A  23     -21.024 -22.879  17.967  1.00  0.00           N  
ATOM    175  CA  LYS A  23     -22.122 -21.910  17.652  1.00  0.00           C  
ATOM    176  CB  LYS A  23     -22.578 -22.075  16.178  1.00  0.00           C  
ATOM    177  CG  LYS A  23     -23.910 -21.288  15.723  1.00  0.00           C  
ATOM    178  CD  LYS A  23     -25.015 -22.255  15.129  1.00  0.00           C  
ATOM    179  CE  LYS A  23     -26.077 -22.642  16.158  1.00  0.00           C  
ATOM    180  NZ  LYS A  23     -25.760 -23.784  17.021  1.00  0.00           N  
ATOM    181  C   LYS A  23     -23.290 -21.847  18.688  1.00  0.00           C  
ATOM    182  O   LYS A  23     -23.999 -20.864  18.724  1.00  0.00           O  
ATOM    183  N   GLY A  24     -23.514 -22.913  19.539  1.00  0.00           N  
ATOM    184  CA  GLY A  24     -24.539 -22.805  20.631  1.00  0.00           C  
ATOM    185  C   GLY A  24     -25.506 -24.025  20.709  1.00  0.00           C  
ATOM    186  O   GLY A  24     -26.584 -23.989  21.354  1.00  0.00           O  
ATOM    187  N   HIS A  25     -25.213 -25.086  19.967  1.00  0.00           N  
ATOM    188  CA  HIS A  25     -25.923 -26.307  19.758  1.00  0.00           C  
ATOM    189  CB  HIS A  25     -25.525 -27.363  20.831  1.00  0.00           C  
ATOM    190  CG  HIS A  25     -26.147 -28.716  20.526  1.00  0.00           C  
ATOM    191  ND1 HIS A  25     -27.380 -29.127  21.017  1.00  0.00           N  
ATOM    192  CE1 HIS A  25     -27.597 -30.344  20.575  1.00  0.00           C  
ATOM    193  NE2 HIS A  25     -26.620 -30.674  19.738  1.00  0.00           N  
ATOM    194  CD2 HIS A  25     -25.693 -29.681  19.614  1.00  0.00           C  
ATOM    195  C   HIS A  25     -27.422 -26.206  19.411  1.00  0.00           C  
ATOM    196  O   HIS A  25     -27.796 -25.475  18.434  1.00  0.00           O  
TER
END



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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: October 18th, 2018.