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***  my_3  ***

elNémo ID: 21011507593397909

Job options:

ID        	=	 21011507593397909
JOBID     	=	 my_3
USERID    	=	 unknown
PRIVAT    	=	 0

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

DOPROJMODS	=	 0
DORMSD    	=	 0

NRBL      	=	 0
CUTOFF    	=	 12
CAONLY    	=	 0


Input data for this run:

HEADER my_3

REMARK    GENERATED BY TRJCONV
TITLE     Protein in water t= 700000.00000 step= 350000000
REMARK    THIS IS A SIMULATION BOX
CRYST1   83.503   83.503   83.503  60.00  60.00  90.00 P 1           1
MODEL        1
ATOM      1  CA  ALA     2     140.770 123.800-122.330  1.00  0.00           C
ATOM      2  CA  CYS     3     138.780 126.880-123.240  1.00  0.00           C
ATOM      3  CA  PRO     4     139.960 130.420-124.380  1.00  0.00           C
ATOM      4  CA  LEU     5     139.350 131.860-120.790  1.00  0.00           C
ATOM      5  CA  GLU     6     141.740 129.110-119.390  1.00  0.00           C
ATOM      6  CA  LYS     7     144.130 129.910-122.230  1.00  0.00           C
ATOM      7  CA  ALA     8     144.300 133.520-121.160  1.00  0.00           C
ATOM      8  CA  LEU     9     144.700 132.420-117.450  1.00  0.00           C
ATOM      9  CA  ASP    10     147.920 130.370-118.560  1.00  0.00           C
ATOM     10  CA  VAL    11     149.540 133.760-119.620  1.00  0.00           C
ATOM     11  CA  MET    12     148.660 135.410-116.260  1.00  0.00           C
ATOM     12  CA  VAL    13     149.940 132.440-114.270  1.00  0.00           C
ATOM     13  CA  SER    14     152.990 132.050-116.570  1.00  0.00           C
ATOM     14  CA  THR    15     153.920 135.800-116.390  1.00  0.00           C
ATOM     15  CA  PHE    16     154.070 135.540-112.510  1.00  0.00           C
ATOM     16  CA  HIS    17     156.440 132.430-112.910  1.00  0.00           C
ATOM     17  CA  LYS    18     158.550 134.450-115.440  1.00  0.00           C
ATOM     18  CA  TYR    19     159.780 136.490-112.370  1.00  0.00           C
ATOM     19  CA  SER    20     158.830 134.470-109.120  1.00  0.00           C
ATOM     20  CA  GLY    21     161.080 133.400-106.230  1.00  0.00           C
ATOM     21  CA  LYS    22     164.540 134.740-105.300  1.00  0.00           C
ATOM     22  CA  GLU    23     165.710 131.650-103.540  1.00  0.00           C
ATOM     23  CA  GLY    24     163.220 128.880-104.390  1.00  0.00           C
ATOM     24  CA  ASP    25     160.220 130.890-103.030  1.00  0.00           C
ATOM     25  CA  LYS    26     158.080 130.420-106.260  1.00  0.00           C
ATOM     26  CA  PHE    27     154.700 131.060-104.430  1.00  0.00           C
ATOM     27  CA  LYS    28     155.460 134.890-104.220  1.00  0.00           C
ATOM     28  CA  LEU    29     156.940 137.700-106.370  1.00  0.00           C
ATOM     29  CA  ASN    30     159.680 139.960-105.000  1.00  0.00           C
ATOM     30  CA  LYS    31     160.390 143.650-105.650  1.00  0.00           C
ATOM     31  CA  SER    32     163.690 143.270-107.530  1.00  0.00           C
ATOM     32  CA  GLU    33     161.870 141.280-110.340  1.00  0.00           C
ATOM     33  CA  LEU    34     158.450 142.880-110.010  1.00  0.00           C
ATOM     34  CA  LYS    35     160.090 146.170-111.240  1.00  0.00           C
ATOM     35  CA  GLU    36     161.030 144.280-114.550  1.00  0.00           C
ATOM     36  CA  LEU    37     157.510 142.850-115.030  1.00  0.00           C
ATOM     37  CA  LEU    38     155.820 146.350-114.580  1.00  0.00           C
ATOM     38  CA  THR    39     158.290 147.660-117.360  1.00  0.00           C
ATOM     39  CA  ARG    40     158.440 144.660-119.860  1.00  0.00           C
ATOM     40  CA  GLU    41     155.100 142.860-119.840  1.00  0.00           C
ATOM     41  CA  LEU    42     152.360 145.680-119.730  1.00  0.00           C
ATOM     42  CA  PRO    43     153.810 148.390-122.220  1.00  0.00           C
ATOM     43  CA  SER    44     150.550 149.980-123.620  1.00  0.00           C
ATOM     44  CA  PHE    45     149.210 150.270-120.020  1.00  0.00           C
ATOM     45  CA  LEU    46     152.390 151.050-117.960  1.00  0.00           C
ATOM     46  CA  GLY    47     155.220 151.630-120.430  1.00  0.00           C
ATOM     47  CA  LYS    48     158.850 151.590-119.370  1.00  0.00           C
ATOM     48  CA  ARG    49     159.330 155.390-118.260  1.00  0.00           C
ATOM     49  CA  THR    50     158.260 157.330-115.140  1.00  0.00           C
ATOM     50  CA  ASP    51     156.170 159.850-117.140  1.00  0.00           C
ATOM     51  CA  GLU    52     154.380 156.730-118.320  1.00  0.00           C
ATOM     52  CA  ALA    53     154.300 154.780-114.920  1.00  0.00           C
ATOM     53  CA  ALA    54     156.300 154.920-111.630  1.00  0.00           C
ATOM     54  CA  PHE    55     156.730 152.200-108.910  1.00  0.00           C
ATOM     55  CA  GLN    56     155.570 153.680-105.550  1.00  0.00           C
ATOM     56  CA  LYS    57     151.840 154.300-106.310  1.00  0.00           C
ATOM     57  CA  LEU    58     151.570 150.910-108.110  1.00  0.00           C
ATOM     58  CA  MET    59     153.140 149.180-104.940  1.00  0.00           C
ATOM     59  CA  SER    60     150.670 151.010-102.590  1.00  0.00           C
ATOM     60  CA  ASN    61     147.870 149.470-104.750  1.00  0.00           C
ATOM     61  CA  LEU    62     149.560 145.970-105.160  1.00  0.00           C
ATOM     62  CA  ASP    63     150.320 145.250-101.450  1.00  0.00           C
ATOM     63  CA  SER    64     146.650 144.590-100.240  1.00  0.00           C
ATOM     64  CA  ASN    65     148.010 142.570 -97.220  1.00  0.00           C
ATOM     65  CA  ARG    66     150.690 145.000 -96.370  1.00  0.00           C
ATOM     66  CA  ASP    67     153.860 142.890 -96.250  1.00  0.00           C
ATOM     67  CA  ASN    68     155.990 144.700 -99.000  1.00  0.00           C
ATOM     68  CA  GLU    69     155.960 141.660-101.290  1.00  0.00           C
ATOM     69  CA  VAL    70     153.390 140.150-103.720  1.00  0.00           C
ATOM     70  CA  ASP    71     151.460 136.920-103.220  1.00  0.00           C
ATOM     71  CA  PHE    72     149.610 135.490-106.230  1.00  0.00           C
ATOM     72  CA  GLN    73     146.290 136.670-104.540  1.00  0.00           C
ATOM     73  CA  GLU    74     147.710 140.210-104.560  1.00  0.00           C
ATOM     74  CA  TYR    75     148.460 139.650-108.310  1.00  0.00           C
ATOM     75  CA  CYS    76     144.990 138.420-109.260  1.00  0.00           C
ATOM     76  CA  VAL    77     143.130 141.580-108.000  1.00  0.00           C
ATOM     77  CA  PHE    78     145.620 144.130-109.580  1.00  0.00           C
ATOM     78  CA  LEU    79     145.300 142.540-112.990  1.00  0.00           C
ATOM     79  CA  SER    80     141.430 142.670-112.400  1.00  0.00           C
ATOM     80  CA  CYS    81     141.800 146.490-111.940  1.00  0.00           C
ATOM     81  CA  ILE    82     143.630 146.670-115.380  1.00  0.00           C
ATOM     82  CA  ALA    83     140.680 144.620-116.870  1.00  0.00           C
ATOM     83  CA  MET    84     137.980 146.670-114.970  1.00  0.00           C
ATOM     84  CA  MET    85     139.530 149.930-116.330  1.00  0.00           C
ATOM     85  CA  CYS    86     139.810 148.910-120.010  1.00  0.00           C
ATOM     86  CA  ASN    87     136.220 147.610-119.950  1.00  0.00           C
ATOM     87  CA  GLU    88     135.280 151.390-120.110  1.00  0.00           C
ATOM     88  CA  PHE    89     136.240 151.510-123.860  1.00  0.00           C
ATOM     89  CA  PHE    90     135.180 147.900-124.740  1.00  0.00           C
ATOM     90  CA  GLU    91     133.230 147.550-128.180  1.00  0.00           C
ATOM     91  CA  GLY    92     133.310 143.720-129.070  1.00  0.00           C
ATOM     92  CA  PHE    93     131.410 140.630-128.030  1.00  0.00           C
ATOM     93  CA  PRO    94     127.560 141.170-128.360  1.00  0.00           C
ATOM     94  CA  ALA     2     153.280 142.720-128.600  1.00  0.00           C
ATOM     95  CA  CYS     3     153.140 141.460-124.910  1.00  0.00           C
ATOM     96  CA  PRO     4     150.980 138.180-124.470  1.00  0.00           C
ATOM     97  CA  LEU     5     149.500 139.520-121.110  1.00  0.00           C
ATOM     98  CA  GLU     6     148.010 142.640-122.780  1.00  0.00           C
ATOM     99  CA  LYS     7     146.180 140.210-125.180  1.00  0.00           C
ATOM    100  CA  ALA     8     144.990 137.850-122.230  1.00  0.00           C
ATOM    101  CA  LEU     9     143.610 141.020-120.440  1.00  0.00           C
ATOM    102  CA  ASP    10     141.440 141.550-123.630  1.00  0.00           C
ATOM    103  CA  VAL    11     140.050 137.910-123.190  1.00  0.00           C
ATOM    104  CA  MET    12     139.390 138.360-119.380  1.00  0.00           C
ATOM    105  CA  VAL    13     137.230 141.400-120.180  1.00  0.00           C
ATOM    106  CA  SER    14     135.660 139.820-123.340  1.00  0.00           C
ATOM    107  CA  THR    15     134.400 136.510-121.790  1.00  0.00           C
ATOM    108  CA  PHE    16     131.950 138.480-119.620  1.00  0.00           C
ATOM    109  CA  HIS    17     130.310 140.160-122.530  1.00  0.00           C
ATOM    110  CA  LYS    18     130.520 136.870-124.660  1.00  0.00           C
ATOM    111  CA  TYR    19     127.520 135.440-122.680  1.00  0.00           C
ATOM    112  CA  SER    20     125.890 138.700-121.380  1.00  0.00           C
ATOM    113  CA  GLY    21     123.060 140.690-122.990  1.00  0.00           C
ATOM    114  CA  LYS    22     121.340 137.510-124.400  1.00  0.00           C
ATOM    115  CA  GLU    23     118.800 137.180-121.410  1.00  0.00           C
ATOM    116  CA  GLY    24     119.710 140.150-119.240  1.00  0.00           C
ATOM    117  CA  ASP    25     120.220 143.790-120.370  1.00  0.00           C
ATOM    118  CA  LYS    26     124.000 143.740-120.610  1.00  0.00           C
ATOM    119  CA  PHE    27     124.590 146.410-117.840  1.00  0.00           C
ATOM    120  CA  LYS    28     125.730 143.210-115.890  1.00  0.00           C
ATOM    121  CA  LEU    29     125.890 139.310-116.340  1.00  0.00           C
ATOM    122  CA  ASN    30     122.460 137.730-115.630  1.00  0.00           C
ATOM    123  CA  LYS    31     122.090 134.600-113.500  1.00  0.00           C
ATOM    124  CA  SER    32     120.910 132.670-116.620  1.00  0.00           C
ATOM    125  CA  GLU    33     124.010 133.720-118.470  1.00  0.00           C
ATOM    126  CA  LEU    34     126.490 133.060-115.690  1.00  0.00           C
ATOM    127  CA  LYS    35     125.250 129.380-115.720  1.00  0.00           C
ATOM    128  CA  GLU    36     125.800 129.370-119.530  1.00  0.00           C
ATOM    129  CA  LEU    37     129.450 130.590-119.080  1.00  0.00           C
ATOM    130  CA  LEU    38     129.990 127.870-116.330  1.00  0.00           C
ATOM    131  CA  THR    39     128.400 125.160-118.450  1.00  0.00           C
ATOM    132  CA  ARG    40     129.870 126.020-121.940  1.00  0.00           C
ATOM    133  CA  GLU    41     133.250 127.890-121.190  1.00  0.00           C
ATOM    134  CA  LEU    42     134.250 126.520-117.600  1.00  0.00           C
ATOM    135  CA  PRO    43     132.970 122.860-117.550  1.00  0.00           C
ATOM    136  CA  SER    44     136.090 121.200-116.030  1.00  0.00           C
ATOM    137  CA  PHE    45     135.220 123.390-112.950  1.00  0.00           C
ATOM    138  CA  LEU    46     131.420 122.450-112.850  1.00  0.00           C
ATOM    139  CA  GLY    47     130.150 120.570-109.750  1.00  0.00           C
ATOM    140  CA  LYS    48     128.180 117.240-110.050  1.00  0.00           C
ATOM    141  CA  ARG    49     125.270 118.940-108.310  1.00  0.00           C
ATOM    142  CA  THR    50     123.740 121.580-110.700  1.00  0.00           C
ATOM    143  CA  ASP    51     120.240 122.030-109.230  1.00  0.00           C
ATOM    144  CA  GLU    52     119.100 125.640-108.350  1.00  0.00           C
ATOM    145  CA  ALA    53     119.890 125.720-104.510  1.00  0.00           C
ATOM    146  CA  ALA    54     123.350 124.760-105.350  1.00  0.00           C
ATOM    147  CA  PHE    55     123.420 127.750-107.830  1.00  0.00           C
ATOM    148  CA  GLN    56     121.700 130.090-105.350  1.00  0.00           C
ATOM    149  CA  LYS    57     124.270 129.210-102.540  1.00  0.00           C
ATOM    150  CA  LEU    58     127.000 130.460-104.970  1.00  0.00           C
ATOM    151  CA  MET    59     124.910 133.490-106.050  1.00  0.00           C
ATOM    152  CA  SER    60     124.760 134.870-102.400  1.00  0.00           C
ATOM    153  CA  ASN    61     128.440 135.920-102.800  1.00  0.00           C
ATOM    154  CA  LEU    62     127.540 137.410-106.350  1.00  0.00           C
ATOM    155  CA  ASP    63     124.000 139.100-106.320  1.00  0.00           C
ATOM    156  CA  SER    64     125.560 141.980-104.230  1.00  0.00           C
ATOM    157  CA  ASN    65     122.610 144.470-105.070  1.00  0.00           C
ATOM    158  CA  ARG    66     119.640 141.900-104.930  1.00  0.00           C
ATOM    159  CA  ASP    67     118.690 142.290-108.580  1.00  0.00           C
ATOM    160  CA  ASN    68     119.740 138.790-109.860  1.00  0.00           C
ATOM    161  CA  GLU    69     122.480 140.430-112.150  1.00  0.00           C
ATOM    162  CA  VAL    70     126.360 140.190-111.480  1.00  0.00           C
ATOM    163  CA  ASP    71     128.720 143.050-111.850  1.00  0.00           C
ATOM    164  CA  PHE    72     132.220 143.000-113.350  1.00  0.00           C
ATOM    165  CA  GLN    73     133.630 143.470-109.740  1.00  0.00           C
ATOM    166  CA  GLU    74     131.970 140.280-108.390  1.00  0.00           C
ATOM    167  CA  TYR    75     132.940 138.610-111.620  1.00  0.00           C
ATOM    168  CA  CYS    76     136.580 139.740-111.030  1.00  0.00           C
ATOM    169  CA  VAL    77     136.500 138.640-107.290  1.00  0.00           C
ATOM    170  CA  PHE    78     135.200 135.090-108.250  1.00  0.00           C
ATOM    171  CA  LEU    79     137.440 134.690-111.390  1.00  0.00           C
ATOM    172  CA  SER    80     140.580 135.350-109.020  1.00  0.00           C
ATOM    173  CA  CYS    81     139.870 132.070-107.090  1.00  0.00           C
ATOM    174  CA  ILE    82     139.630 130.420-110.570  1.00  0.00           C
ATOM    175  CA  ALA    83     143.270 131.490-111.320  1.00  0.00           C
ATOM    176  CA  MET    84     144.020 130.160-107.860  1.00  0.00           C
ATOM    177  CA  MET    85     142.630 126.770-108.740  1.00  0.00           C
ATOM    178  CA  CYS    86     144.720 126.820-111.900  1.00  0.00           C
ATOM    179  CA  ASN    87     148.120 128.050-110.310  1.00  0.00           C
ATOM    180  CA  GLU    88     147.820 124.850-108.090  1.00  0.00           C
ATOM    181  CA  PHE    89     148.520 122.690-111.180  1.00  0.00           C
ATOM    182  CA  PHE    90     149.610 124.850-114.260  1.00  0.00           C
ATOM    183  CA  GLU    91     153.220 124.600-115.600  1.00  0.00           C
ATOM    184  CA  GLY    92     154.410 128.220-114.990  1.00  0.00           C
ATOM    185  CA  PHE    93     157.290 129.310-117.340  1.00  0.00           C
ATOM    186  CA  PRO    94     160.650 127.620-118.180  1.00  0.00           C
ATOM    187  CA  TYR  1893     142.180 153.000-127.670  1.00  0.00           C
ATOM    188  CA  ARG  1894     145.320 155.260-127.040  1.00  0.00           C
ATOM    189  CA  LYS  1895     148.570 154.390-125.110  1.00  0.00           C
ATOM    190  CA  LEU  1896     148.300 155.220-121.380  1.00  0.00           C
ATOM    191  CA  GLN  1897     150.120 157.490-118.910  1.00  0.00           C
ATOM    192  CA  ARG  1898     150.110 157.740-115.060  1.00  0.00           C
ATOM    193  CA  GLU  1899     146.330 156.570-114.920  1.00  0.00           C
ATOM    194  CA  LEU  1900     146.730 152.870-114.130  1.00  0.00           C
ATOM    195  CA  GLU  1901     148.410 154.160-110.940  1.00  0.00           C
ATOM    196  CA  ASP  1902     144.780 155.440-110.260  1.00  0.00           C
ATOM    197  CA  ALA  1903     142.340 152.820-111.570  1.00  0.00           C
ATOM    198  CA  THR  1904     144.420 150.070-109.730  1.00  0.00           C
ATOM    199  CA  GLU  1905     143.400 151.570-106.330  1.00  0.00           C
ATOM    200  CA  THR  1906     140.400 149.120-106.310  1.00  0.00           C
ATOM    201  CA  ALA  1907     142.610 146.150-105.520  1.00  0.00           C
ATOM    202  CA  ASP  1908     142.060 146.300-101.720  1.00  0.00           C
ATOM    203  CA  ALA  1909     138.250 146.210-102.340  1.00  0.00           C
ATOM    204  CA  MET  1910     138.510 142.950-104.380  1.00  0.00           C
ATOM    205  CA  ASN  1911     141.340 141.540-102.160  1.00  0.00           C
ATOM    206  CA  ARG  1912     139.090 141.900 -98.950  1.00  0.00           C
ATOM    207  CA  GLU  1913     136.520 139.480-100.390  1.00  0.00           C
ATOM    208  CA  VAL  1914     139.090 137.130-102.190  1.00  0.00           C
ATOM    209  CA  SER  1915     140.820 136.700 -98.760  1.00  0.00           C
ATOM    210  CA  SER  1916     137.730 134.910 -97.380  1.00  0.00           C
ATOM    211  CA  LEU  1917     136.400 133.310-100.750  1.00  0.00           C
ATOM    212  CA  LYS  1918     139.710 131.260-101.120  1.00  0.00           C
ATOM    213  CA  ASN  1919     138.780 129.260 -97.940  1.00  0.00           C
ATOM    214  CA  LYS  1920     134.960 128.950 -98.400  1.00  0.00           C
ATOM    215  CA  LEU  1921     135.780 127.480-101.870  1.00  0.00           C
ATOM    216  CA  ARG  1922     138.500 124.970-100.720  1.00  0.00           C
ATOM    217  CA  ARG  1923     136.460 123.800 -97.610  1.00  0.00           C
ATOM    218  CA  GLY  1924     133.360 122.850 -99.710  1.00  0.00           C
ATOM    219  CA  ASP  1925     130.930 125.900 -99.090  1.00  0.00           C
ATOM    220  CA  LEU  1926     129.810 126.560-102.750  1.00  0.00           C
ATOM    221  CA  PRO  1927     128.120 123.460-104.300  1.00  0.00           C
ATOM    222  CA  PHE  1928     128.030 124.340-108.010  1.00  0.00           C
ATOM    223  CA  VAL  1929     131.880 124.180-108.530  1.00  0.00           C
ATOM    224  CA  VAL  1930     134.700 121.830-107.650  1.00  0.00           C
ATOM    225  CA  PRO  1931     136.920 123.040-104.680  1.00  0.00           C
ATOM    226  CA  ARG  1932     140.200 122.010-106.400  1.00  0.00           C
ATOM    227  CA  ARG  1933     141.740 120.440-109.590  1.00  0.00           C
ATOM    228  CA  MET  1934     144.610 118.130-110.580  1.00  0.00           C
ATOM    229  CA  ALA  1935     143.960 118.500-114.450  1.00  0.00           C
TER
ENDMDL



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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.