CNRS Nantes University US2B US2B
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Should you encounter any unexpected behaviour,
please let us know.
elNémo has been hacked on november 27th.
It has been moved away and runs again.
**Still some additional cleaning from time to time**
Sorry for the inconvenience.


***    ***

elNémo ID: 260128021931177264

Job options:

ID        	=	 260128021931177264
JOBID     	=	 
USERID    	=	 unknown
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:


ATOM      1  N   LYS     1      32.824  23.665  31.959
ATOM      2  H1  LYS     1      33.501  24.121  31.319
ATOM      3  H2  LYS     1      32.035  23.275  31.411
ATOM      4  H3  LYS     1      33.299  22.897  32.469
ATOM      5  CA  LYS     1      32.310  24.654  32.920
ATOM      6  CB  LYS     1      33.445  25.057  33.883
ATOM      7  CG  LYS     1      32.984  25.692  35.194
ATOM      8  CD  LYS     1      34.128  26.346  35.967
ATOM      9  CE  LYS     1      34.047  26.153  37.481
ATOM     10  NZ  LYS     1      33.643  27.417  38.127
ATOM     11  HZ1 LYS     1      34.231  28.196  37.774
ATOM     12  HZ2 LYS     1      32.647  27.615  37.913
ATOM     13  HZ3 LYS     1      33.763  27.341  39.154
ATOM     14  C   LYS     1      31.799  25.851  32.176
ATOM     15  O   LYS     1      30.602  26.141  32.220
ATOM     16  N   ASP     2      32.708  26.535  31.436
ATOM     17  H   ASP     2      33.663  26.250  31.399
ATOM     18  CA  ASP     2      32.404  27.712  30.668
ATOM     19  CB  ASP     2      33.666  28.421  30.090
ATOM     20  CG  ASP     2      34.514  27.535  29.166
ATOM     21  OD1 ASP     2      34.877  26.398  29.570
ATOM     22  OD2 ASP     2      34.802  27.991  28.029
ATOM     23  C   ASP     2      31.448  27.426  29.551
ATOM     24  O   ASP     2      30.487  28.171  29.369
ATOM     25  N   GLN     3      31.647  26.293  28.835
ATOM     26  H   GLN     3      32.417  25.689  29.026
ATOM     27  CA  GLN     3      30.807  25.911  27.727
ATOM     28  CB  GLN     3      31.413  24.775  26.880
ATOM     29  CG  GLN     3      32.714  25.195  26.167
ATOM     30  CD  GLN     3      32.476  26.386  25.231
ATOM     31  OE1 GLN     3      31.610  26.386  24.356
ATOM     32  NE2 GLN     3      33.258  27.474  25.456
ATOM     33 1HE2 GLN     3      33.141  28.298  24.902
ATOM     34 2HE2 GLN     3      33.924  27.467  26.203
ATOM     35  C   GLN     3      29.416  25.560  28.169
ATOM     36  O   GLN     3      28.457  25.792  27.430
ATOM     37  N   ALA     4      29.291  25.031  29.411
ATOM     38  H   ALA     4      30.090  24.882  29.988
ATOM     39  CA  ALA     4      28.039  24.643  30.001
ATOM     40  CB  ALA     4      28.212  23.967  31.371
ATOM     41  C   ALA     4      27.126  25.827  30.180
ATOM     42  O   ALA     4      25.915  25.659  30.020
ATOM     43  N   LEU     5      27.667  27.036  30.507
ATOM     44  H   LEU     5      28.649  27.181  30.614
ATOM     45  CA  LEU     5      26.819  28.192  30.670
ATOM     46  CB  LEU     5      27.040  28.941  32.011
ATOM     47  CG  LEU     5      26.144  30.184  32.251
ATOM     48  CD1 LEU     5      24.648  29.829  32.313
ATOM     49  CD2 LEU     5      26.602  30.975  33.482
ATOM     50  C   LEU     5      27.077  29.110  29.488
ATOM     51  O   LEU     5      28.087  29.818  29.464
ATOM     52  N   PRO     6      26.157  29.166  28.523
ATOM     53  CA  PRO     6      26.271  29.962  27.317
ATOM     54  CB  PRO     6      25.094  29.547  26.431
ATOM     55  CG  PRO     6      24.044  29.002  27.409
ATOM     56  CD  PRO     6      24.880  28.449  28.568
ATOM     57  C   PRO     6      26.329  31.457  27.479
ATOM     58  O   PRO     6      26.717  32.115  26.510
ATOM     59  N   TYR     7      25.869  32.006  28.626
ATOM     60  H   TYR     7      25.520  31.455  29.379
ATOM     61  CA  TYR     7      25.848  33.432  28.822
ATOM     62  CB  TYR     7      24.576  33.923  29.550
ATOM     63  CG  TYR     7      23.369  33.664  28.712
ATOM     64  CD1 TYR     7      22.524  32.584  28.993
ATOM     65  CE1 TYR     7      21.393  32.347  28.207
ATOM     66  CZ  TYR     7      21.100  33.192  27.133
ATOM     67  OH  TYR     7      19.959  32.963  26.334
ATOM     68  HH  TYR     7      19.492  32.202  26.692
ATOM     69  CE2 TYR     7      21.939  34.271  26.846
ATOM     70  CD2 TYR     7      23.068  34.504  27.633
ATOM     71  C   TYR     7      27.000  33.960  29.629
ATOM     72  O   TYR     7      27.418  35.101  29.428
ATOM     73  N   GLY     8      27.579  33.126  30.519
ATOM     74  H   GLY     8      27.275  32.183  30.629
ATOM     75  CA  GLY     8      28.648  33.538  31.388
ATOM     76  C   GLY     8      30.016  33.147  30.953
ATOM     77  O   GLY     8      30.902  33.088  31.802
ATOM     78  N   VAL     9      30.228  32.903  29.639
ATOM     79  H   VAL     9      29.486  32.997  28.980
ATOM     80  CA  VAL     9      31.497  32.476  29.085
ATOM     81  CB  VAL     9      31.386  32.204  27.583
ATOM     82  CG1 VAL     9      32.759  31.921  26.933
ATOM     83  CG2 VAL     9      30.403  31.040  27.361
ATOM     84  C   VAL     9      32.579  33.500  29.374
ATOM     85  O   VAL     9      33.685  33.118  29.752
ATOM     86  N   ASN    10      32.255  34.813  29.282
ATOM     87  H   ASN    10      31.338  35.094  29.011
ATOM     88  CA  ASN    10      33.180  35.891  29.529
ATOM     89  CB  ASN    10      32.618  37.278  29.143
ATOM     90  CG  ASN    10      32.563  37.454  27.622
ATOM     91  OD1 ASN    10      33.223  36.783  26.829
ATOM     92  ND2 ASN    10      31.734  38.436  27.186
ATOM     93 1HD2 ASN    10      31.655  38.625  26.208
ATOM     94 2HD2 ASN    10      31.212  38.983  27.842
ATOM     95  C   ASN    10      33.605  35.960  30.970
ATOM     96  O   ASN    10      34.720  36.399  31.254
ATOM     97  N   ARG    11      32.704  35.572  31.907
ATOM     98  H   ARG    11      31.812  35.210  31.651
ATOM     99  CA  ARG    11      32.967  35.578  33.324
ATOM    100  CB  ARG    11      31.679  35.529  34.173
ATOM    101  CG  ARG    11      30.836  36.807  34.126
ATOM    102  CD  ARG    11      29.702  36.847  35.160
ATOM    103  NE  ARG    11      28.658  35.829  34.809
ATOM    104  HE  ARG    11      28.724  34.920  35.220
ATOM    105  CZ  ARG    11      27.613  36.096  33.961
ATOM    106  NH1 ARG    11      27.466  37.310  33.351
ATOM    107 1HH1 ARG    11      28.128  38.039  33.520
ATOM    108 2HH1 ARG    11      26.697  37.475  32.735
ATOM    109  NH2 ARG    11      26.692  35.119  33.721
ATOM    110 1HH2 ARG    11      26.773  34.230  34.171
ATOM    111 2HH2 ARG    11      25.919  35.299  33.114
ATOM    112  C   ARG    11      33.805  34.401  33.741
ATOM    113  O   ARG    11      34.748  34.567  34.516
ATOM    114  N   PHE    12      33.477  33.190  33.221
ATOM    115  H   PHE    12      32.725  33.098  32.574
ATOM    116  CA  PHE    12      34.165  31.959  33.531
ATOM    117  CB  PHE    12      33.392  30.694  33.110
ATOM    118  CG  PHE    12      32.333  30.394  34.123
ATOM    119  CD1 PHE    12      30.989  30.679  33.862
ATOM    120  CE1 PHE    12      30.003  30.397  34.811
ATOM    121  CZ  PHE    12      30.354  29.822  36.033
ATOM    122  CE2 PHE    12      31.690  29.531  36.305
ATOM    123  CD2 PHE    12      32.673  29.816  35.353
ATOM    124  C   PHE    12      35.541  31.893  32.944
ATOM    125  O   PHE    12      36.442  31.331  33.567
ATOM    126  N   HIS    13      35.716  32.437  31.721
ATOM    127  H   HIS    13      34.965  32.872  31.232
ATOM    128  CA  HIS    13      36.982  32.471  31.052
ATOM    129  CB  HIS    13      37.069  31.485  29.864
ATOM    130  CG  HIS    13      38.417  30.835  29.767
ATOM    131  ND1 HIS    13      39.553  31.469  29.311
ATOM    132  CE1 HIS    13      40.563  30.567  29.389
ATOM    133  NE2 HIS    13      40.159  29.402  29.861
ATOM    134  CD2 HIS    13      38.806  29.572  30.098
ATOM    135  C   HIS    13      37.118  33.925  30.575
ATOM    136  O   HIS    13      37.218  34.796  31.477
ATOM    137  OXT HIS    13      37.108  34.210  29.347
TER
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).
Between 2015 and 2025, it was hosted by US2B (Nantes).
Last modification: december 26th, 2025.