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***  ca_my_3  ***

elNémo ID: 21011507564389824

Job options:

ID        	=	 21011507564389824
JOBID     	=	 ca_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 ca_my_3

REMARK    GENERATED BY TRJCONV
TITLE     Protein in water t= 700000.00000 step= 350000000
REMARK    THIS IS A SIMULATION BOX
CRYST1   83.458   83.458   83.458  60.00  60.00  90.00 P 1           1
MODEL        1
ATOM      1  CA  ALA     2     152.270-129.020-119.530  1.00  0.00           C
ATOM      2  CA  CYS     3     154.420-130.800-116.890  1.00  0.00           C
ATOM      3  CA  PRO     4     152.610-133.760-115.350  1.00  0.00           C
ATOM      4  CA  LEU     5     152.950-132.060-111.830  1.00  0.00           C
ATOM      5  CA  GLU     6     151.690-128.690-113.310  1.00  0.00           C
ATOM      6  CA  LYS     7     148.700-130.590-114.970  1.00  0.00           C
ATOM      7  CA  ALA     8     148.130-132.450-111.650  1.00  0.00           C
ATOM      8  CA  LEU     9     148.020-128.920-110.120  1.00  0.00           C
ATOM      9  CA  ASP    10     145.480-127.870-112.900  1.00  0.00           C
ATOM     10  CA  VAL    11     143.140-130.870-111.980  1.00  0.00           C
ATOM     11  CA  MET    12     143.310-129.710-108.310  1.00  0.00           C
ATOM     12  CA  VAL    13     142.280-126.170-109.460  1.00  0.00           C
ATOM     13  CA  SER    14     139.650-127.580-111.870  1.00  0.00           C
ATOM     14  CA  THR    15     137.980-129.630-109.190  1.00  0.00           C
ATOM     15  CA  PHE    16     136.950-126.540-107.050  1.00  0.00           C
ATOM     16  CA  HIS    17     135.340-124.580-109.940  1.00  0.00           C
ATOM     17  CA  LYS    18     133.430-127.830-110.640  1.00  0.00           C
ATOM     18  CA  TYR    19     131.350-127.140-107.430  1.00  0.00           C
ATOM     19  CA  SER    20     131.840-123.590-106.000  1.00  0.00           C
ATOM     20  CA  GLY    21     128.900-122.460-108.110  1.00  0.00           C
ATOM     21  CA  LYS    22     126.440-125.320-107.600  1.00  0.00           C
ATOM     22  CA  GLU    23     124.600-123.210-104.950  1.00  0.00           C
ATOM     23  CA  GLY    24     124.320-119.370-105.200  1.00  0.00           C
ATOM     24  CA  ASP    25     127.470-117.360-106.220  1.00  0.00           C
ATOM     25  CA  LYS    26     130.740-119.140-107.530  1.00  0.00           C
ATOM     26  CA  PHE    27     133.490-117.730-105.120  1.00  0.00           C
ATOM     27  CA  LYS    28     133.530-120.660-102.520  1.00  0.00           C
ATOM     28  CA  LEU    29     132.120-123.950-101.270  1.00  0.00           C
ATOM     29  CA  ASN    30     128.820-124.320 -99.380  1.00  0.00           C
ATOM     30  CA  LYS    31     128.180-127.410 -97.100  1.00  0.00           C
ATOM     31  CA  SER    32     125.770-128.650 -99.900  1.00  0.00           C
ATOM     32  CA  GLU    33     128.290-128.070-102.820  1.00  0.00           C
ATOM     33  CA  LEU    34     131.060-129.640-100.530  1.00  0.00           C
ATOM     34  CA  LYS    35     128.860-132.830 -99.980  1.00  0.00           C
ATOM     35  CA  GLU    36     128.660-133.140-103.820  1.00  0.00           C
ATOM     36  CA  LEU    37     132.410-132.780-104.160  1.00  0.00           C
ATOM     37  CA  LEU    38     133.050-135.370-101.340  1.00  0.00           C
ATOM     38  CA  THR    39     130.360-137.910-102.560  1.00  0.00           C
ATOM     39  CA  ARG    40     131.560-137.620-106.330  1.00  0.00           C
ATOM     40  CA  GLU    41     135.220-136.660-106.770  1.00  0.00           C
ATOM     41  CA  LEU    42     136.420-138.180-103.390  1.00  0.00           C
ATOM     42  CA  PRO    43     134.030-141.000-102.100  1.00  0.00           C
ATOM     43  CA  SER    44     137.100-143.200-101.850  1.00  0.00           C
ATOM     44  CA  PHE    45     138.130-140.700 -99.070  1.00  0.00           C
ATOM     45  CA  LEU    46     134.560-140.540 -97.540  1.00  0.00           C
ATOM     46  CA  GLY    47     133.990-144.270 -97.050  1.00  0.00           C
ATOM     47  CA  LYS    48     130.740-146.150 -96.270  1.00  0.00           C
ATOM     48  CA  ARG    49     129.380-143.440 -93.960  1.00  0.00           C
ATOM     49  CA  THR    50     126.140-141.290 -94.250  1.00  0.00           C
ATOM     50  CA  ASP    51     126.630-138.520 -91.570  1.00  0.00           C
ATOM     51  CA  GLU    52     127.380-134.690 -92.240  1.00  0.00           C
ATOM     52  CA  ALA    53     130.280-134.070 -89.760  1.00  0.00           C
ATOM     53  CA  ALA    54     133.360-134.470 -91.970  1.00  0.00           C
ATOM     54  CA  PHE    55     131.810-131.510 -93.880  1.00  0.00           C
ATOM     55  CA  GLN    56     131.060-129.540 -90.630  1.00  0.00           C
ATOM     56  CA  LYS    57     134.820-129.740 -89.730  1.00  0.00           C
ATOM     57  CA  LEU    58     135.980-128.460 -93.210  1.00  0.00           C
ATOM     58  CA  MET    59     133.350-125.630 -92.960  1.00  0.00           C
ATOM     59  CA  SER    60     133.950-124.560 -89.410  1.00  0.00           C
ATOM     60  CA  ASN    61     137.180-125.820 -87.730  1.00  0.00           C
ATOM     61  CA  LEU    62     139.740-124.990 -90.530  1.00  0.00           C
ATOM     62  CA  ASP    63     139.310-121.190 -89.870  1.00  0.00           C
ATOM     63  CA  SER    64     137.790-118.840 -87.210  1.00  0.00           C
ATOM     64  CA  ASN    65     136.140-116.340 -89.550  1.00  0.00           C
ATOM     65  CA  ARG    66     132.540-117.740 -89.440  1.00  0.00           C
ATOM     66  CA  ASP    67     131.970-116.940 -93.220  1.00  0.00           C
ATOM     67  CA  ASN    68     130.070-120.240 -93.730  1.00  0.00           C
ATOM     68  CA  GLU    69     131.920-121.190 -96.980  1.00  0.00           C
ATOM     69  CA  VAL    70     135.310-123.170 -97.590  1.00  0.00           C
ATOM     70  CA  ASP    71     137.570-121.070 -99.780  1.00  0.00           C
ATOM     71  CA  PHE    72     139.980-122.270-102.500  1.00  0.00           C
ATOM     72  CA  GLN    73     142.640-120.840-100.140  1.00  0.00           C
ATOM     73  CA  GLU    74     141.410-123.330 -97.560  1.00  0.00           C
ATOM     74  CA  TYR    75     140.560-126.380 -99.860  1.00  0.00           C
ATOM     75  CA  CYS    76     144.160-126.400-101.280  1.00  0.00           C
ATOM     76  CA  VAL    77     145.900-126.950 -97.740  1.00  0.00           C
ATOM     77  CA  PHE    78     143.150-129.710 -97.270  1.00  0.00           C
ATOM     78  CA  LEU    79     144.010-131.470-100.570  1.00  0.00           C
ATOM     79  CA  SER    80     147.770-131.190 -99.720  1.00  0.00           C
ATOM     80  CA  CYS    81     146.800-133.150 -96.580  1.00  0.00           C
ATOM     81  CA  ILE    82     144.890-135.670 -98.870  1.00  0.00           C
ATOM     82  CA  ALA    83     148.350-135.790-100.710  1.00  0.00           C
ATOM     83  CA  MET    84     150.120-136.580 -97.490  1.00  0.00           C
ATOM     84  CA  MET    85     147.530-139.230 -96.320  1.00  0.00           C
ATOM     85  CA  CYS    86     148.650-141.210 -99.390  1.00  0.00           C
ATOM     86  CA  ASN    87     152.510-140.640 -98.980  1.00  0.00           C
ATOM     87  CA  GLU    88     152.760-143.930 -96.940  1.00  0.00           C
ATOM     88  CA  PHE    89     152.410-146.030-100.220  1.00  0.00           C
ATOM     89  CA  PHE    90     155.620-144.390-101.560  1.00  0.00           C
ATOM     90  CA  GLU    91     157.660-143.650 -98.440  1.00  0.00           C
ATOM     91  CA  GLY    92     157.430-147.260 -97.100  1.00  0.00           C
ATOM     92  CA  PHE    93     158.510-148.700-100.580  1.00  0.00           C
ATOM     93  CA  PRO    94     161.310-149.000-103.380  1.00  0.00           C
ATOM     94  CA  ALA     2     140.100-143.700-110.000  1.00  0.00           C
ATOM     95  CA  CYS     3     138.980-140.250-110.980  1.00  0.00           C
ATOM     96  CA  PRO     4     141.080-137.410-112.450  1.00  0.00           C
ATOM     97  CA  LEU     5     141.790-135.780-109.040  1.00  0.00           C
ATOM     98  CA  GLU     6     142.890-139.180-107.700  1.00  0.00           C
ATOM     99  CA  LYS     7     145.150-139.620-110.820  1.00  0.00           C
ATOM    100  CA  ALA     8     146.560-136.100-110.000  1.00  0.00           C
ATOM    101  CA  LEU     9     147.210-136.860-106.230  1.00  0.00           C
ATOM    102  CA  ASP    10     149.050-140.030-107.220  1.00  0.00           C
ATOM    103  CA  VAL    11     151.490-138.030-109.460  1.00  0.00           C
ATOM    104  CA  MET    12     151.750-135.020-106.930  1.00  0.00           C
ATOM    105  CA  VAL    13     152.950-137.550-104.310  1.00  0.00           C
ATOM    106  CA  SER    14     154.990-139.540-106.980  1.00  0.00           C
ATOM    107  CA  THR    15     157.080-136.450-108.030  1.00  0.00           C
ATOM    108  CA  PHE    16     158.330-136.120-104.380  1.00  0.00           C
ATOM    109  CA  HIS    17     159.520-139.830-104.620  1.00  0.00           C
ATOM    110  CA  LYS    18     161.020-139.480-108.110  1.00  0.00           C
ATOM    111  CA  TYR    19     163.970-137.770-106.250  1.00  0.00           C
ATOM    112  CA  SER    20     163.580-137.890-102.380  1.00  0.00           C
ATOM    113  CA  GLY    21     165.280-141.410-102.080  1.00  0.00           C
ATOM    114  CA  LYS    22     168.280-140.800-104.610  1.00  0.00           C
ATOM    115  CA  GLU    23     170.950-139.820-102.080  1.00  0.00           C
ATOM    116  CA  GLY    24     169.270-142.160 -99.510  1.00  0.00           C
ATOM    117  CA  ASP    25     166.450-141.290 -96.890  1.00  0.00           C
ATOM    118  CA  LYS    26     163.370-141.280 -99.000  1.00  0.00           C
ATOM    119  CA  PHE    27     161.490-139.810 -96.070  1.00  0.00           C
ATOM    120  CA  LYS    28     163.200-136.470 -96.720  1.00  0.00           C
ATOM    121  CA  LEU    29     164.300-134.120 -99.500  1.00  0.00           C
ATOM    122  CA  ASN    30     167.800-132.800 -99.720  1.00  0.00           C
ATOM    123  CA  LYS    31     169.270-129.830-101.670  1.00  0.00           C
ATOM    124  CA  SER    32     170.630-132.070-104.550  1.00  0.00           C
ATOM    125  CA  GLU    33     167.180-133.870-104.990  1.00  0.00           C
ATOM    126  CA  LEU    34     165.150-130.680-104.530  1.00  0.00           C
ATOM    127  CA  LYS    35     166.990-129.020-107.520  1.00  0.00           C
ATOM    128  CA  GLU    36     165.890-131.970-109.750  1.00  0.00           C
ATOM    129  CA  LEU    37     162.260-131.290-108.790  1.00  0.00           C
ATOM    130  CA  LEU    38     162.880-127.570-109.380  1.00  0.00           C
ATOM    131  CA  THR    39     164.510-128.390-112.890  1.00  0.00           C
ATOM    132  CA  ARG    40     162.420-131.270-114.350  1.00  0.00           C
ATOM    133  CA  GLU    41     159.010-130.840-112.560  1.00  0.00           C
ATOM    134  CA  LEU    42     158.820-127.060-111.800  1.00  0.00           C
ATOM    135  CA  PRO    43     161.410-125.280-114.180  1.00  0.00           C
ATOM    136  CA  SER    44     158.500-122.910-115.150  1.00  0.00           C
ATOM    137  CA  PHE    45     158.700-121.540-111.440  1.00  0.00           C
ATOM    138  CA  LEU    46     162.470-120.750-111.470  1.00  0.00           C
ATOM    139  CA  GLY    47     163.130-117.050-110.680  1.00  0.00           C
ATOM    140  CA  LYS    48     165.520-114.100-111.380  1.00  0.00           C
ATOM    141  CA  ARG    49     168.360-115.670-109.250  1.00  0.00           C
ATOM    142  CA  THR    50     170.520-118.720-109.920  1.00  0.00           C
ATOM    143  CA  ASP    51     173.220-118.610-107.190  1.00  0.00           C
ATOM    144  CA  GLU    52     173.460-120.880-104.210  1.00  0.00           C
ATOM    145  CA  ALA    53     172.780-117.940-101.750  1.00  0.00           C
ATOM    146  CA  ALA    54     169.230-117.500-103.110  1.00  0.00           C
ATOM    147  CA  PHE    55     168.830-121.300-103.250  1.00  0.00           C
ATOM    148  CA  GLN    56     170.080-121.480 -99.530  1.00  0.00           C
ATOM    149  CA  LYS    57     167.370-118.770 -98.680  1.00  0.00           C
ATOM    150  CA  LEU    58     164.620-120.670-100.490  1.00  0.00           C
ATOM    151  CA  MET    59     165.530-123.950 -98.660  1.00  0.00           C
ATOM    152  CA  SER    60     165.850-122.280 -95.170  1.00  0.00           C
ATOM    153  CA  ASN    61     162.240-121.060 -95.660  1.00  0.00           C
ATOM    154  CA  LEU    62     160.940-124.590 -96.900  1.00  0.00           C
ATOM    155  CA  ASP    63     162.420-126.420 -93.800  1.00  0.00           C
ATOM    156  CA  SER    64     160.570-125.340 -90.460  1.00  0.00           C
ATOM    157  CA  ASN    65     163.150-126.270 -87.750  1.00  0.00           C
ATOM    158  CA  ARG    66     166.650-125.040 -89.120  1.00  0.00           C
ATOM    159  CA  ASP    67     168.250-128.390 -90.390  1.00  0.00           C
ATOM    160  CA  ASN    68     168.240-127.600 -94.120  1.00  0.00           C
ATOM    161  CA  GLU    69     166.120-130.720 -95.070  1.00  0.00           C
ATOM    162  CA  VAL    70     162.410-131.010 -96.110  1.00  0.00           C
ATOM    163  CA  ASP    71     159.960-133.560 -94.820  1.00  0.00           C
ATOM    164  CA  PHE    72     156.780-134.060 -96.890  1.00  0.00           C
ATOM    165  CA  GLN    73     154.800-132.220 -94.160  1.00  0.00           C
ATOM    166  CA  GLU    74     157.250-129.130 -94.830  1.00  0.00           C
ATOM    167  CA  TYR    75     156.930-129.660 -98.630  1.00  0.00           C
ATOM    168  CA  CYS    76     153.100-129.480 -98.210  1.00  0.00           C
ATOM    169  CA  VAL    77     153.560-125.800 -97.400  1.00  0.00           C
ATOM    170  CA  PHE    78     155.370-125.240-100.710  1.00  0.00           C
ATOM    171  CA  LEU    79     152.720-127.400-102.570  1.00  0.00           C
ATOM    172  CA  SER    80     149.680-125.520-101.150  1.00  0.00           C
ATOM    173  CA  CYS    81     151.280-122.100-102.040  1.00  0.00           C
ATOM    174  CA  ILE    82     151.850-123.030-105.830  1.00  0.00           C
ATOM    175  CA  ALA    83     148.290-124.500-106.170  1.00  0.00           C
ATOM    176  CA  MET    84     147.100-121.010-104.850  1.00  0.00           C
ATOM    177  CA  MET    85     149.570-119.410-107.420  1.00  0.00           C
ATOM    178  CA  CYS    86     147.820-121.580-110.120  1.00  0.00           C
ATOM    179  CA  ASN    87     144.410-120.560-108.870  1.00  0.00           C
ATOM    180  CA  GLU    88     145.240-116.870-109.310  1.00  0.00           C
ATOM    181  CA  PHE    89     146.130-117.660-112.960  1.00  0.00           C
ATOM    182  CA  PHE    90     142.990-119.690-113.780  1.00  0.00           C
ATOM    183  CA  GLU    91     139.920-117.900-115.420  1.00  0.00           C
ATOM    184  CA  GLY    92     137.740-120.820-116.770  1.00  0.00           C
ATOM    185  CA  PHE    93     134.960-120.040-114.270  1.00  0.00           C
ATOM    186  CA  PRO    94     131.410-121.430-114.830  1.00  0.00           C
ATOM    187  CA  TYR  1893     142.580-146.080-101.460  1.00  0.00           C
ATOM    188  CA  ARG  1894     141.930-146.110 -97.680  1.00  0.00           C
ATOM    189  CA  LYS  1895     141.630-149.030 -95.250  1.00  0.00           C
ATOM    190  CA  LEU  1896     140.050-146.830 -92.380  1.00  0.00           C
ATOM    191  CA  GLN  1897     137.240-144.190 -92.360  1.00  0.00           C
ATOM    192  CA  ARG  1898     136.870-140.710 -90.760  1.00  0.00           C
ATOM    193  CA  GLU  1899     140.280-139.470 -92.090  1.00  0.00           C
ATOM    194  CA  LEU  1900     138.770-136.440 -93.870  1.00  0.00           C
ATOM    195  CA  GLU  1901     138.530-135.140 -90.290  1.00  0.00           C
ATOM    196  CA  ASP  1902     142.250-135.840 -89.360  1.00  0.00           C
ATOM    197  CA  ALA  1903     143.310-134.330 -92.700  1.00  0.00           C
ATOM    198  CA  THR  1904     141.180-131.210 -91.940  1.00  0.00           C
ATOM    199  CA  GLU  1905     142.990-130.960 -88.530  1.00  0.00           C
ATOM    200  CA  THR  1906     146.470-131.420 -90.260  1.00  0.00           C
ATOM    201  CA  ALA  1907     145.410-128.460 -92.580  1.00  0.00           C
ATOM    202  CA  ASP  1908     144.140-126.190 -89.710  1.00  0.00           C
ATOM    203  CA  ALA  1909     147.740-126.780 -88.240  1.00  0.00           C
ATOM    204  CA  MET  1910     149.160-125.420 -91.680  1.00  0.00           C
ATOM    205  CA  ASN  1911     146.590-122.740 -92.930  1.00  0.00           C
ATOM    206  CA  ARG  1912     148.620-119.820 -91.010  1.00  0.00           C
ATOM    207  CA  GLU  1913     152.010-121.340 -91.940  1.00  0.00           C
ATOM    208  CA  VAL  1914     150.860-121.620 -95.600  1.00  0.00           C
ATOM    209  CA  SER  1915     149.420-117.970 -95.370  1.00  0.00           C
ATOM    210  CA  SER  1916     152.820-116.750 -94.060  1.00  0.00           C
ATOM    211  CA  LEU  1917     154.830-118.600 -96.750  1.00  0.00           C
ATOM    212  CA  LYS  1918     152.330-117.450 -99.500  1.00  0.00           C
ATOM    213  CA  ASN  1919     152.710-113.950 -98.060  1.00  0.00           C
ATOM    214  CA  LYS  1920     156.560-114.180 -98.470  1.00  0.00           C
ATOM    215  CA  LEU  1921     156.430-115.420-102.170  1.00  0.00           C
ATOM    216  CA  ARG  1922     153.640-112.800-102.710  1.00  0.00           C
ATOM    217  CA  ARG  1923     156.060-110.180-101.350  1.00  0.00           C
ATOM    218  CA  GLY  1924     158.930-111.270-103.660  1.00  0.00           C
ATOM    219  CA  ASP  1925     161.150-112.450-100.640  1.00  0.00           C
ATOM    220  CA  LEU  1926     162.450-115.660-102.360  1.00  0.00           C
ATOM    221  CA  PRO  1927     163.840-114.540-105.840  1.00  0.00           C
ATOM    222  CA  PHE  1928     165.100-118.120-106.670  1.00  0.00           C
ATOM    223  CA  VAL  1929     161.410-118.560-107.690  1.00  0.00           C
ATOM    224  CA  VAL  1930     159.140-116.350-109.890  1.00  0.00           C
ATOM    225  CA  PRO  1931     157.210-113.200-108.600  1.00  0.00           C
ATOM    226  CA  ARG  1932     154.110-114.170-110.630  1.00  0.00           C
ATOM    227  CA  ARG  1933     152.660-117.240-112.450  1.00  0.00           C
ATOM    228  CA  MET  1934     153.220-114.820-115.350  1.00  0.00           C
ATOM    229  CA  ALA  1935     156.850-116.120-115.510  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.