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.

* FXIa WT *

LOGs for ID: 2602071221493272438

Output from eigenvector calculation:


STDOUT:

CUTOFF set to default value (CUTOFF=8)
Build Tirion matrix:
 Pdbmat> Computes the Hessian matrix, using an Elastic Network Model.
 Pdbmat> Version 3.50, Fevrier 2004.    

 Pdbmat> Options to be read in pdbmat.dat file.

 Pdbmat> Coordinate filename     = 2602071221493272438.atom

 Pdbmat> Distance cutoff         =       8.00
         Force constant          =      10.00
         Origin of mass values   =       CONS
 Pdbmat> Levelshift              =    1.0E-09
         PRINTing level          =          2

 Pdbmat> Coordinate file 2602071221493272438.atom to be opened.

 Openam> File opened: 2602071221493272438.atom

 Pdbmat> Coordinate file in PDB format.

 Rdatompdb> Reading pdb file.
 Rdatompdb> End of file reached.
 Rdatompdb> Number of I/O errors:      0

 Rdatompdb> Number of residues found =    238
            First residue number     =      1
            Last  residue number     =    238
            Number of atoms found    =   1890
            Mean number per residue  =      7.9

 Pdbmat> Coordinate statistics: 
 =     1.764822 +/-     9.051115 From:   -23.253000 To:    23.047000
 =     0.608516 +/-    11.456297 From:   -23.523000 To:    29.095000
 =     0.808356 +/-     8.649698 From:   -18.933000 To:    23.148000
 Pdbmat> Masses are all set to one.

 Openam> File opened: pdbmat.xyzm
 Pdbmat> Coordinates and masses considered are saved.

 Openam> File opened: pdbmat.sdijb

 Pdbmat> Matrix statistics:

 Pdbmat> The matrix is   4.3631 % Filled.
 Pdbmat>       701467  non-zero elements.
 Pdbmat>        76698 atom-atom interactions.

 Pdbmat> Number per atom=     81.16 +/-     24.80
         Maximum number =    128
         Minimum number =     11

 Pdbmat> Matrix trace   = 1.533960E+06
 Pdbmat> Larger element =  500.128    
 Pdbmat>      0 elements larger than +/-  1.0E+10

 Pdbmat> Normal end.
automatic determination of NRBL (NRBL = nresidues/200 + 1)
238 non-zero elements, NRBL set to 2
Diagonalize Tirion matrix using diagrtb
 Diagrtb> Diagonalizes a matrix, using the RTB/BNM approximation.
 Diagrtb> Version 2.52, November 2004. 
 Diagrtb> Options to be read in diagrtb.dat file.

 Diagrtb> Options taken into account:

 MATRix filename          = pdbmat.sdijb
 COORdinates filename     = 2602071221493272438.atom
 Eigenvector OUTPut file  = matrix.eigenrtb
 Nb of VECTors required   =        106
 EigeNVALues chosen       =       LOWE
 Type of SUBStructuring   =       NONE
 Nb of residues per BLOck =          2
 Origin of MASS values    =       CONS
 MATRix FORMat            =       BINA
 Temporary files cleaning =       ALL 
 Output PRINting level    =          2

 Diagrtb> Memory allocation for Blocpdb.

 Blocpdb> Entering in.

 Openam> file on opening on unit     10:
 diagrtb_work.xyzm   

 Blocpdb> Coordinate file 2602071221493272438.atom to be opened.

 Openam> file on opening on unit     11:
 2602071221493272438.atom                                                                                                        

 Blocpdb> Coordinate file in PDB format.

 Blocpdb>  1890 atoms picked in pdb file.
 Blocpdb>   All masses set to unity.
 Blocpdb> Coordinate file is rewritten.

 Blocpdb> Substructuring:
 Blocpdb>     2 residue(s) per block.
 Blocpdb>   238 residues.
 Blocpdb>    15 atoms in block      1
 Block first atom:      1
 Blocpdb>     8 atoms in block      2
 Block first atom:     16
 Blocpdb>    12 atoms in block      3
 Block first atom:     24
 Blocpdb>    13 atoms in block      4
 Block first atom:     36
 Blocpdb>    15 atoms in block      5
 Block first atom:     49
 Blocpdb>    23 atoms in block      6
 Block first atom:     64
 Blocpdb>    21 atoms in block      7
 Block first atom:     87
 Blocpdb>    16 atoms in block      8
 Block first atom:    108
 Blocpdb>    15 atoms in block      9
 Block first atom:    124
 Blocpdb>    17 atoms in block     10
 Block first atom:    139
 Blocpdb>    13 atoms in block     11
 Block first atom:    156
 Blocpdb>    14 atoms in block     12
 Block first atom:    169
 Blocpdb>    20 atoms in block     13
 Block first atom:    183
 Blocpdb>    18 atoms in block     14
 Block first atom:    203
 Blocpdb>    10 atoms in block     15
 Block first atom:    221
 Blocpdb>    10 atoms in block     16
 Block first atom:    231
 Blocpdb>    16 atoms in block     17
 Block first atom:    241
 Blocpdb>    12 atoms in block     18
 Block first atom:    257
 Blocpdb>    23 atoms in block     19
 Block first atom:    269
 Blocpdb>    16 atoms in block     20
 Block first atom:    292
 Blocpdb>    12 atoms in block     21
 Block first atom:    308
 Blocpdb>    15 atoms in block     22
 Block first atom:    320
 Blocpdb>    17 atoms in block     23
 Block first atom:    335
 Blocpdb>    16 atoms in block     24
 Block first atom:    352
 Blocpdb>    16 atoms in block     25
 Block first atom:    368
 Blocpdb>    13 atoms in block     26
 Block first atom:    384
 Blocpdb>    17 atoms in block     27
 Block first atom:    397
 Blocpdb>    19 atoms in block     28
 Block first atom:    414
 Blocpdb>    19 atoms in block     29
 Block first atom:    433
 Blocpdb>    10 atoms in block     30
 Block first atom:    452
 Blocpdb>    16 atoms in block     31
 Block first atom:    462
 Blocpdb>    18 atoms in block     32
 Block first atom:    478
 Blocpdb>    15 atoms in block     33
 Block first atom:    496
 Blocpdb>    17 atoms in block     34
 Block first atom:    511
 Blocpdb>    17 atoms in block     35
 Block first atom:    528
 Blocpdb>    13 atoms in block     36
 Block first atom:    545
 Blocpdb>    22 atoms in block     37
 Block first atom:    558
 Blocpdb>    11 atoms in block     38
 Block first atom:    580
 Blocpdb>    18 atoms in block     39
 Block first atom:    591
 Blocpdb>    16 atoms in block     40
 Block first atom:    609
 Blocpdb>    18 atoms in block     41
 Block first atom:    625
 Blocpdb>    17 atoms in block     42
 Block first atom:    643
 Blocpdb>    21 atoms in block     43
 Block first atom:    660
 Blocpdb>    13 atoms in block     44
 Block first atom:    681
 Blocpdb>    15 atoms in block     45
 Block first atom:    694
 Blocpdb>    16 atoms in block     46
 Block first atom:    709
 Blocpdb>    16 atoms in block     47
 Block first atom:    725
 Blocpdb>    13 atoms in block     48
 Block first atom:    741
 Blocpdb>    17 atoms in block     49
 Block first atom:    754
 Blocpdb>    17 atoms in block     50
 Block first atom:    771
 Blocpdb>    14 atoms in block     51
 Block first atom:    788
 Blocpdb>    16 atoms in block     52
 Block first atom:    802
 Blocpdb>    19 atoms in block     53
 Block first atom:    818
 Blocpdb>    14 atoms in block     54
 Block first atom:    837
 Blocpdb>    20 atoms in block     55
 Block first atom:    851
 Blocpdb>    15 atoms in block     56
 Block first atom:    871
 Blocpdb>    14 atoms in block     57
 Block first atom:    886
 Blocpdb>    13 atoms in block     58
 Block first atom:    900
 Blocpdb>    13 atoms in block     59
 Block first atom:    913
 Blocpdb>    19 atoms in block     60
 Block first atom:    926
 Blocpdb>    15 atoms in block     61
 Block first atom:    945
 Blocpdb>    20 atoms in block     62
 Block first atom:    960
 Blocpdb>    15 atoms in block     63
 Block first atom:    980
 Blocpdb>    20 atoms in block     64
 Block first atom:    995
 Blocpdb>    14 atoms in block     65
 Block first atom:   1015
 Blocpdb>    18 atoms in block     66
 Block first atom:   1029
 Blocpdb>    16 atoms in block     67
 Block first atom:   1047
 Blocpdb>    20 atoms in block     68
 Block first atom:   1063
 Blocpdb>    19 atoms in block     69
 Block first atom:   1083
 Blocpdb>    17 atoms in block     70
 Block first atom:   1102
 Blocpdb>    17 atoms in block     71
 Block first atom:   1119
 Blocpdb>    15 atoms in block     72
 Block first atom:   1136
 Blocpdb>    17 atoms in block     73
 Block first atom:   1151
 Blocpdb>    14 atoms in block     74
 Block first atom:   1168
 Blocpdb>    17 atoms in block     75
 Block first atom:   1182
 Blocpdb>    15 atoms in block     76
 Block first atom:   1199
 Blocpdb>    14 atoms in block     77
 Block first atom:   1214
 Blocpdb>    17 atoms in block     78
 Block first atom:   1228
 Blocpdb>    15 atoms in block     79
 Block first atom:   1245
 Blocpdb>    18 atoms in block     80
 Block first atom:   1260
 Blocpdb>    23 atoms in block     81
 Block first atom:   1278
 Blocpdb>    15 atoms in block     82
 Block first atom:   1301
 Blocpdb>    19 atoms in block     83
 Block first atom:   1316
 Blocpdb>    15 atoms in block     84
 Block first atom:   1335
 Blocpdb>    19 atoms in block     85
 Block first atom:   1350
 Blocpdb>    16 atoms in block     86
 Block first atom:   1369
 Blocpdb>    11 atoms in block     87
 Block first atom:   1385
 Blocpdb>    16 atoms in block     88
 Block first atom:   1396
 Blocpdb>    20 atoms in block     89
 Block first atom:   1412
 Blocpdb>     8 atoms in block     90
 Block first atom:   1432
 Blocpdb>    17 atoms in block     91
 Block first atom:   1440
 Blocpdb>    11 atoms in block     92
 Block first atom:   1457
 Blocpdb>    13 atoms in block     93
 Block first atom:   1468
 Blocpdb>    14 atoms in block     94
 Block first atom:   1481
 Blocpdb>     8 atoms in block     95
 Block first atom:   1495
 Blocpdb>    15 atoms in block     96
 Block first atom:   1503
 Blocpdb>    12 atoms in block     97
 Block first atom:   1518
 Blocpdb>    19 atoms in block     98
 Block first atom:   1530
 Blocpdb>    17 atoms in block     99
 Block first atom:   1549
 Blocpdb>    21 atoms in block    100
 Block first atom:   1566
 Blocpdb>    18 atoms in block    101
 Block first atom:   1587
 Blocpdb>    11 atoms in block    102
 Block first atom:   1605
 Blocpdb>    15 atoms in block    103
 Block first atom:   1616
 Blocpdb>    20 atoms in block    104
 Block first atom:   1631
 Blocpdb>    13 atoms in block    105
 Block first atom:   1651
 Blocpdb>    10 atoms in block    106
 Block first atom:   1664
 Blocpdb>    14 atoms in block    107
 Block first atom:   1674
 Blocpdb>    20 atoms in block    108
 Block first atom:   1688
 Blocpdb>    18 atoms in block    109
 Block first atom:   1708
 Blocpdb>    11 atoms in block    110
 Block first atom:   1726
 Blocpdb>    19 atoms in block    111
 Block first atom:   1737
 Blocpdb>    15 atoms in block    112
 Block first atom:   1756
 Blocpdb>    16 atoms in block    113
 Block first atom:   1771
 Blocpdb>    19 atoms in block    114
 Block first atom:   1787
 Blocpdb>    22 atoms in block    115
 Block first atom:   1806
 Blocpdb>    16 atoms in block    116
 Block first atom:   1828
 Blocpdb>    18 atoms in block    117
 Block first atom:   1844
 Blocpdb>    16 atoms in block    118
 Block first atom:   1862
 Blocpdb>    13 atoms in block    119
 Block first atom:   1877

 Blocpdb>   119 blocks.

 Blocpdb> At most,     23 atoms in each of them.
 Blocpdb> At least,     8 atoms in each of them.

 Blocpdb> Normal end of Blocpdb.

 Diagrtb> Memory allocation for Prepmat.
 Diagrtb> Memory allocation for RTB.
 Diagrtb> Memory allocation for Diagstd.
 Diagrtb> Memory allocation for RTB_to_modes.

 Prepmat> Entering in.
 Prepmat> Rewriting of the matrix begins.

 Prepmat>       701586 matrix lines read.

 Prepmat> Matrix order    =       5670

 Prepmat> Matrix trace    =    1533960.0000
 Prepmat> Last element read:    5670   5670        21.4066
 Prepmat>         7141 lines saved.
 Prepmat>         5810 empty lines.
 Prepmat> Number of lines on output is as expected.
 Prepmat> Normal end of Prepmat.

 RTB> Entering in.
 RTB> Number of atoms found in temporary coordinate file:  1890
 RTB> Total mass =        1890.0000
 RTB> Number of atoms found in matrix:  1890
 RTB> Number of blocks =   119
 RTB> Projection begins.
 RTB> Projected matrix is being saved.
 RTB> Projected matrix trace =  163867.4776
 RTB>     46095 non-zero elements.
 RTB> Normal end of RTB.

 Diagstd> Entering in.

 Openam> file on opening on unit     10:
 diagrtb_work.sdijb                      
 Diagstd> Projected matrix to be read from file: diagrtb_work.sdijb                      
 Diagstd> CERFACS matrix format.
 Diagstd> Projected matrix order =      714
 Diagstd> Nb of non-zero elements:    46095
 Diagstd> Projected matrix trace =  163867.4776

 Openam> file on opening on unit     11:
 diagrtb_work.eigenfacs                  
 Diagstd> Diagonalization.

 Diagstd>    714 eigenvectors are computed. 
 Diagstd>    106 of them to be saved. 

 Diagstd> Sum of eigenvalues = 163867.4776
 Diagstd> Best zero-eigenvalue found  :     0.000000

 Diagstd>      6 zero-eigenvalues, that is, below or equal to:    0.0000000

 Diagstd> Selected eigenvalues: 
      0.0000000      0.0000000      0.0000000      0.0000000      0.0000000
      0.0000000      5.0630825      5.8693927      6.7255819      7.1229405
      9.0028088      9.7787303     10.9056966     11.9213546     12.5696817
     13.4142929     14.5964574     14.6612844     15.5449287     16.8841651
     18.0284708     18.4173636     19.1243556     19.2537280     20.3621434
     20.8575823     21.6851178     22.8531869     24.1519295     25.5136307
     26.0620103     26.9234838     27.8736959     28.3898581     28.7095059
     30.2733631     30.7195674     31.9585767     32.2311086     33.1506230
     33.9523603     35.2688456     35.4859591     36.8484325     36.9616823
     38.2591592     38.6715909     40.2956122     40.4216066     40.6975694
     42.3095462     43.4956177     44.0941737     44.4232809     44.9824690
     46.0601863     47.2435666     47.4282522     48.7224967     49.8161408
     50.4498770     51.7436414     53.0884767     53.9781731     54.4689749
     55.4610172     55.8622334     56.5218498     57.1016596     57.6972472
     58.4968342     59.9376291     60.4633665     61.4810238     62.2185676
     62.3500274     63.1981293     63.8809034     64.2750816     65.9201207
     66.7983608     67.0134685     67.4340567     69.5511701     70.0450465
     70.9876050     71.4065127     72.3379218     73.3993902     73.5251322
     74.1788013     75.1818477     76.5475730     77.0546419     77.4285797
     78.4419362     78.9900826     79.3868380     80.4065101     81.6881181
     82.1993816     82.4675575     84.6292753     85.3070252     85.8587250
     86.9552133

 Diagstd> Frequencies (cm-1, if the input matrix is a hessian in CHARMM units):
      0.0034317      0.0034327      0.0034330      0.0034331      0.0034342
      0.0034344    244.3446197    263.0824429    281.6178714    289.8177220
    325.8249173    339.5756297    358.6096619    374.9368123    384.9970672
    397.7215950    414.8766693    415.7969405    428.1437877    446.2056610
    461.0783448    466.0247810    474.8852554    476.4887995    490.0123500
    495.9378599    505.6804610    519.1210813    533.6680425    548.5060378
    554.3693822    563.4571677    573.3140157    578.5979506    581.8461152
    597.4830856    601.8701821    613.8877891    616.4997458    625.2318987
    632.7472488    644.8978110    646.8797471    659.1811648    660.1933500
    671.6808878    675.2915252    689.3252059    690.4020394    692.7547570
    706.3410783    716.1731450    721.0840421    723.7700297    728.3110935
    736.9841124    746.3913861    747.8488676    757.9840165    766.4438085
    771.3035603    781.1308214    791.2166400    797.8189934    801.4379089
    808.7032633    811.6231535    816.4008793    820.5775777    824.8459124
    830.5417368    840.7077677    844.3868137    851.4630881    856.5550594
    857.4594768    863.2714771    867.9222157    870.5958619    881.6663732
    887.5200702    888.9479418    891.7331746    905.6231189    908.8328037
    914.9272068    917.6227920    923.5880266    930.3395981    931.1361491
    935.2660842    941.5681895    950.0817876    953.2233749    955.5335201
    961.7660279    965.1205525    967.5413452    973.7352381    981.4647942
    984.5313627    986.1360744    998.9772346   1002.9693905   1006.2073785
   1012.6120533

 Diagstd> Normal end.

 Rtb_to_modes> Entering in.

 Rtb_to_modes> Number of atoms in temporary block-file =   1890
 Rtb_to_modes> Number of blocs =    119

 Openam> file on opening on unit     10:
 diagrtb_work.eigenfacs                  

 Openam> file on opening on unit     11:
 matrix.eigenrtb                         

 Rdmodfacs> Entering in.

 Rdmodfacs> Old Blzpack file format detected.

 Rdmodfacs> Eigenvector number:     1
 Rdmodfacs> Corresponding eigenvalue:  9.9870E-10

 Rdmodfacs> Eigenvector number:     2
 Rdmodfacs> Corresponding eigenvalue:  9.9925E-10

 Rdmodfacs> Eigenvector number:     3
 Rdmodfacs> Corresponding eigenvalue:  9.9944E-10

 Rdmodfacs> Eigenvector number:     4
 Rdmodfacs> Corresponding eigenvalue:  9.9949E-10

 Rdmodfacs> Eigenvector number:     5
 Rdmodfacs> Corresponding eigenvalue:  1.0002E-09

 Rdmodfacs> Eigenvector number:     6
 Rdmodfacs> Corresponding eigenvalue:  1.0003E-09

 Rdmodfacs> Eigenvector number:     7
 Rdmodfacs> Corresponding eigenvalue:   5.063    

 Rdmodfacs> Eigenvector number:     8
 Rdmodfacs> Corresponding eigenvalue:   5.869    

 Rdmodfacs> Eigenvector number:     9
 Rdmodfacs> Corresponding eigenvalue:   6.726    

 Rdmodfacs> Eigenvector number:    10
 Rdmodfacs> Corresponding eigenvalue:   7.123    

 Rdmodfacs> Eigenvector number:    11
 Rdmodfacs> Corresponding eigenvalue:   9.003    

 Rdmodfacs> Eigenvector number:    12
 Rdmodfacs> Corresponding eigenvalue:   9.779    

 Rdmodfacs> Eigenvector number:    13
 Rdmodfacs> Corresponding eigenvalue:   10.91    

 Rdmodfacs> Eigenvector number:    14
 Rdmodfacs> Corresponding eigenvalue:   11.92    

 Rdmodfacs> Eigenvector number:    15
 Rdmodfacs> Corresponding eigenvalue:   12.57    

 Rdmodfacs> Eigenvector number:    16
 Rdmodfacs> Corresponding eigenvalue:   13.41    

 Rdmodfacs> Eigenvector number:    17
 Rdmodfacs> Corresponding eigenvalue:   14.60    

 Rdmodfacs> Eigenvector number:    18
 Rdmodfacs> Corresponding eigenvalue:   14.66    

 Rdmodfacs> Eigenvector number:    19
 Rdmodfacs> Corresponding eigenvalue:   15.54    

 Rdmodfacs> Eigenvector number:    20
 Rdmodfacs> Corresponding eigenvalue:   16.88    

 Rdmodfacs> Eigenvector number:    21
 Rdmodfacs> Corresponding eigenvalue:   18.03    

 Rdmodfacs> Eigenvector number:    22
 Rdmodfacs> Corresponding eigenvalue:   18.42    

 Rdmodfacs> Eigenvector number:    23
 Rdmodfacs> Corresponding eigenvalue:   19.12    

 Rdmodfacs> Eigenvector number:    24
 Rdmodfacs> Corresponding eigenvalue:   19.25    

 Rdmodfacs> Eigenvector number:    25
 Rdmodfacs> Corresponding eigenvalue:   20.36    

 Rdmodfacs> Eigenvector number:    26
 Rdmodfacs> Corresponding eigenvalue:   20.86    

 Rdmodfacs> Eigenvector number:    27
 Rdmodfacs> Corresponding eigenvalue:   21.69    

 Rdmodfacs> Eigenvector number:    28
 Rdmodfacs> Corresponding eigenvalue:   22.85    

 Rdmodfacs> Eigenvector number:    29
 Rdmodfacs> Corresponding eigenvalue:   24.15    

 Rdmodfacs> Eigenvector number:    30
 Rdmodfacs> Corresponding eigenvalue:   25.51    

 Rdmodfacs> Eigenvector number:    31
 Rdmodfacs> Corresponding eigenvalue:   26.06    

 Rdmodfacs> Eigenvector number:    32
 Rdmodfacs> Corresponding eigenvalue:   26.92    

 Rdmodfacs> Eigenvector number:    33
 Rdmodfacs> Corresponding eigenvalue:   27.87    

 Rdmodfacs> Eigenvector number:    34
 Rdmodfacs> Corresponding eigenvalue:   28.39    

 Rdmodfacs> Eigenvector number:    35
 Rdmodfacs> Corresponding eigenvalue:   28.71    

 Rdmodfacs> Eigenvector number:    36
 Rdmodfacs> Corresponding eigenvalue:   30.27    

 Rdmodfacs> Eigenvector number:    37
 Rdmodfacs> Corresponding eigenvalue:   30.72    

 Rdmodfacs> Eigenvector number:    38
 Rdmodfacs> Corresponding eigenvalue:   31.96    

 Rdmodfacs> Eigenvector number:    39
 Rdmodfacs> Corresponding eigenvalue:   32.23    

 Rdmodfacs> Eigenvector number:    40
 Rdmodfacs> Corresponding eigenvalue:   33.15    

 Rdmodfacs> Eigenvector number:    41
 Rdmodfacs> Corresponding eigenvalue:   33.95    

 Rdmodfacs> Eigenvector number:    42
 Rdmodfacs> Corresponding eigenvalue:   35.27    

 Rdmodfacs> Eigenvector number:    43
 Rdmodfacs> Corresponding eigenvalue:   35.49    

 Rdmodfacs> Eigenvector number:    44
 Rdmodfacs> Corresponding eigenvalue:   36.85    

 Rdmodfacs> Eigenvector number:    45
 Rdmodfacs> Corresponding eigenvalue:   36.96    

 Rdmodfacs> Eigenvector number:    46
 Rdmodfacs> Corresponding eigenvalue:   38.26    

 Rdmodfacs> Eigenvector number:    47
 Rdmodfacs> Corresponding eigenvalue:   38.67    

 Rdmodfacs> Eigenvector number:    48
 Rdmodfacs> Corresponding eigenvalue:   40.30    

 Rdmodfacs> Eigenvector number:    49
 Rdmodfacs> Corresponding eigenvalue:   40.42    

 Rdmodfacs> Eigenvector number:    50
 Rdmodfacs> Corresponding eigenvalue:   40.70    

 Rdmodfacs> Eigenvector number:    51
 Rdmodfacs> Corresponding eigenvalue:   42.31    

 Rdmodfacs> Eigenvector number:    52
 Rdmodfacs> Corresponding eigenvalue:   43.50    

 Rdmodfacs> Eigenvector number:    53
 Rdmodfacs> Corresponding eigenvalue:   44.09    

 Rdmodfacs> Eigenvector number:    54
 Rdmodfacs> Corresponding eigenvalue:   44.42    

 Rdmodfacs> Eigenvector number:    55
 Rdmodfacs> Corresponding eigenvalue:   44.98    

 Rdmodfacs> Eigenvector number:    56
 Rdmodfacs> Corresponding eigenvalue:   46.06    

 Rdmodfacs> Eigenvector number:    57
 Rdmodfacs> Corresponding eigenvalue:   47.24    

 Rdmodfacs> Eigenvector number:    58
 Rdmodfacs> Corresponding eigenvalue:   47.43    

 Rdmodfacs> Eigenvector number:    59
 Rdmodfacs> Corresponding eigenvalue:   48.72    

 Rdmodfacs> Eigenvector number:    60
 Rdmodfacs> Corresponding eigenvalue:   49.82    

 Rdmodfacs> Eigenvector number:    61
 Rdmodfacs> Corresponding eigenvalue:   50.45    

 Rdmodfacs> Eigenvector number:    62
 Rdmodfacs> Corresponding eigenvalue:   51.74    

 Rdmodfacs> Eigenvector number:    63
 Rdmodfacs> Corresponding eigenvalue:   53.09    

 Rdmodfacs> Eigenvector number:    64
 Rdmodfacs> Corresponding eigenvalue:   53.98    

 Rdmodfacs> Eigenvector number:    65
 Rdmodfacs> Corresponding eigenvalue:   54.47    

 Rdmodfacs> Eigenvector number:    66
 Rdmodfacs> Corresponding eigenvalue:   55.46    

 Rdmodfacs> Eigenvector number:    67
 Rdmodfacs> Corresponding eigenvalue:   55.86    

 Rdmodfacs> Eigenvector number:    68
 Rdmodfacs> Corresponding eigenvalue:   56.52    

 Rdmodfacs> Eigenvector number:    69
 Rdmodfacs> Corresponding eigenvalue:   57.10    

 Rdmodfacs> Eigenvector number:    70
 Rdmodfacs> Corresponding eigenvalue:   57.70    

 Rdmodfacs> Eigenvector number:    71
 Rdmodfacs> Corresponding eigenvalue:   58.50    

 Rdmodfacs> Eigenvector number:    72
 Rdmodfacs> Corresponding eigenvalue:   59.94    

 Rdmodfacs> Eigenvector number:    73
 Rdmodfacs> Corresponding eigenvalue:   60.46    

 Rdmodfacs> Eigenvector number:    74
 Rdmodfacs> Corresponding eigenvalue:   61.48    

 Rdmodfacs> Eigenvector number:    75
 Rdmodfacs> Corresponding eigenvalue:   62.22    

 Rdmodfacs> Eigenvector number:    76
 Rdmodfacs> Corresponding eigenvalue:   62.35    

 Rdmodfacs> Eigenvector number:    77
 Rdmodfacs> Corresponding eigenvalue:   63.20    

 Rdmodfacs> Eigenvector number:    78
 Rdmodfacs> Corresponding eigenvalue:   63.88    

 Rdmodfacs> Eigenvector number:    79
 Rdmodfacs> Corresponding eigenvalue:   64.28    

 Rdmodfacs> Eigenvector number:    80
 Rdmodfacs> Corresponding eigenvalue:   65.92    

 Rdmodfacs> Eigenvector number:    81
 Rdmodfacs> Corresponding eigenvalue:   66.80    

 Rdmodfacs> Eigenvector number:    82
 Rdmodfacs> Corresponding eigenvalue:   67.01    

 Rdmodfacs> Eigenvector number:    83
 Rdmodfacs> Corresponding eigenvalue:   67.43    

 Rdmodfacs> Eigenvector number:    84
 Rdmodfacs> Corresponding eigenvalue:   69.55    

 Rdmodfacs> Eigenvector number:    85
 Rdmodfacs> Corresponding eigenvalue:   70.05    

 Rdmodfacs> Eigenvector number:    86
 Rdmodfacs> Corresponding eigenvalue:   70.99    

 Rdmodfacs> Eigenvector number:    87
 Rdmodfacs> Corresponding eigenvalue:   71.41    

 Rdmodfacs> Eigenvector number:    88
 Rdmodfacs> Corresponding eigenvalue:   72.34    

 Rdmodfacs> Eigenvector number:    89
 Rdmodfacs> Corresponding eigenvalue:   73.40    

 Rdmodfacs> Eigenvector number:    90
 Rdmodfacs> Corresponding eigenvalue:   73.53    

 Rdmodfacs> Eigenvector number:    91
 Rdmodfacs> Corresponding eigenvalue:   74.18    

 Rdmodfacs> Eigenvector number:    92
 Rdmodfacs> Corresponding eigenvalue:   75.18    

 Rdmodfacs> Eigenvector number:    93
 Rdmodfacs> Corresponding eigenvalue:   76.55    

 Rdmodfacs> Eigenvector number:    94
 Rdmodfacs> Corresponding eigenvalue:   77.05    

 Rdmodfacs> Eigenvector number:    95
 Rdmodfacs> Corresponding eigenvalue:   77.43    

 Rdmodfacs> Eigenvector number:    96
 Rdmodfacs> Corresponding eigenvalue:   78.44    

 Rdmodfacs> Eigenvector number:    97
 Rdmodfacs> Corresponding eigenvalue:   78.99    

 Rdmodfacs> Eigenvector number:    98
 Rdmodfacs> Corresponding eigenvalue:   79.39    

 Rdmodfacs> Eigenvector number:    99
 Rdmodfacs> Corresponding eigenvalue:   80.41    

 Rdmodfacs> Eigenvector number:   100
 Rdmodfacs> Corresponding eigenvalue:   81.69    

 Rdmodfacs> Eigenvector number:   101
 Rdmodfacs> Corresponding eigenvalue:   82.20    

 Rdmodfacs> Eigenvector number:   102
 Rdmodfacs> Corresponding eigenvalue:   82.47    

 Rdmodfacs> Eigenvector number:   103
 Rdmodfacs> Corresponding eigenvalue:   84.63    

 Rdmodfacs> Eigenvector number:   104
 Rdmodfacs> Corresponding eigenvalue:   85.31    

 Rdmodfacs> Eigenvector number:   105
 Rdmodfacs> Corresponding eigenvalue:   85.86    

 Rdmodfacs> Eigenvector number:   106
 Rdmodfacs> Corresponding eigenvalue:   86.96    

 Rtb_to_modes>  106 vectors, with    714 coordinates in vector file.

 Norm of eigenvectors in projected coordinates (one expected):
 0.99997 0.99997 0.99998 1.00001 1.00000
 1.00000 1.00002 1.00002 1.00000 0.99998
 0.99998 1.00000 0.99999 1.00001 0.99998
 0.99999 1.00000 1.00001 0.99999 1.00003
 1.00001 1.00000 1.00001 0.99999 1.00001
 1.00000 1.00001 1.00001 1.00002 1.00003
 0.99995 1.00003 1.00001 1.00004 1.00001
 0.99999 1.00001 0.99999 1.00002 1.00001
 1.00000 0.99999 1.00001 1.00000 0.99999
 1.00001 0.99999 0.99997 1.00000 1.00000
 0.99999 1.00002 0.99999 0.99999 1.00000
 1.00000 0.99999 0.99998 1.00001 0.99999
 0.99997 0.99996 1.00001 0.99997 0.99998
 0.99997 1.00001 1.00000 1.00001 1.00000
 1.00001 0.99998 1.00002 1.00000 0.99998
 1.00002 1.00001 1.00001 0.99999 1.00000
 0.99999 1.00000 1.00001 1.00002 0.99996
 0.99999 0.99998 0.99998 1.00003 1.00000
 0.99998 1.00000 1.00002 1.00001 1.00001
 0.99998 0.99999 0.99999 0.99996 1.00002
 0.99999 1.00001 0.99998 1.00000 1.00001
 0.99999

 Rtb_to_modes> RTB block-file is being read.
 Rtb_to_modes>    34020 lines found in RTB file.

 Norm of eigenvectors in cartesian coordinates (one expected):
 0.99997 0.99997 0.99998 1.00001 1.00000
 1.00000 1.00002 1.00002 1.00000 0.99998
 0.99998 1.00000 0.99999 1.00001 0.99998
 0.99999 1.00000 1.00001 0.99999 1.00003
 1.00001 1.00000 1.00001 0.99999 1.00001
 1.00000 1.00001 1.00001 1.00002 1.00003
 0.99995 1.00003 1.00001 1.00004 1.00001
 0.99999 1.00001 0.99999 1.00002 1.00001
 1.00000 0.99999 1.00001 1.00000 0.99999
 1.00001 0.99999 0.99997 1.00000 1.00000
 0.99999 1.00002 0.99999 0.99999 1.00000
 1.00000 0.99999 0.99998 1.00001 0.99999
 0.99997 0.99996 1.00001 0.99997 0.99998
 0.99997 1.00001 1.00000 1.00001 1.00000
 1.00001 0.99998 1.00002 1.00000 0.99998
 1.00002 1.00001 1.00001 0.99999 1.00000
 0.99999 1.00000 1.00001 1.00002 0.99996
 0.99999 0.99998 0.99998 1.00003 1.00000
 0.99998 1.00000 1.00002 1.00001 1.00001
 0.99998 0.99999 0.99999 0.99996 1.00002
 0.99999 1.00001 0.99998 1.00000 1.00001
 0.99999

 Orthogonality of first eigenvectors (zero expected):
 Vector   2:-0.000
 Vector   3:-0.000-0.000
 Vector   4:-0.000 0.000 0.000
 Vector   5: 0.000-0.000 0.000 0.000
 Vector   6: 0.000-0.000 0.000 0.000-0.000
 Vector   7:-0.000-0.000-0.000 0.000-0.000 0.000
 Vector   8: 0.000-0.000 0.000 0.000 0.000-0.000 0.000
 Vector   9: 0.000-0.000 0.000 0.000-0.000-0.000 0.000-0.000
 Vector  10: 0.000 0.000-0.000-0.000 0.000 0.000-0.000-0.000-0.000

 Rtb_to_modes>   106 eigenvectors saved.

 Rtb_to_modes> Normal end.

 Diagrtb> Normal end.
B-factor analysis
 Bfactors> Version 1.22, Bordeaux.                
 Getnam> Eigenvector filename ?
 Getnam> 2602071221493272438.eigenfacs

 Openam> file on opening on unit     10:
 2602071221493272438.eigenfacs                                   
 Getnam> Corresponding pdb filename ?
 Getnam> 2602071221493272438.atom

 Openam> file on opening on unit     11:
 2602071221493272438.atom                                        
 Getnum> Number of skipped eigenvectors ?
 Getnum>            0
 Getnum> Number of usefull eigenvectors ?
 Getnum>        10000
%Getnum-Err: number larger than    106 This is not allowed. Sorry.

 Rdatompdb> Reading pdb file.
 Rdatompdb> End of file reached.
 Rdatompdb> Number of I/O errors:            0

 Rdatompdb> Number of residues found =    238
            First residue number     =      1
            Last  residue number     =    238
            Number of atoms found    =   1890
            Mean number per residue  =      7.9

 Rdmodfacs> Old Blzpack file format detected.

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     1
 Rdmodfacs> Valeur propre du vecteur en lecture:  9.9870E-10

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     2
 Rdmodfacs> Valeur propre du vecteur en lecture:  9.9925E-10

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     3
 Rdmodfacs> Valeur propre du vecteur en lecture:  9.9944E-10

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     4
 Rdmodfacs> Valeur propre du vecteur en lecture:  9.9949E-10

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     5
 Rdmodfacs> Valeur propre du vecteur en lecture:  1.0002E-09

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     6
 Rdmodfacs> Valeur propre du vecteur en lecture:  1.0003E-09

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     7
 Rdmodfacs> Valeur propre du vecteur en lecture:   5.063    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     8
 Rdmodfacs> Valeur propre du vecteur en lecture:   5.869    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     9
 Rdmodfacs> Valeur propre du vecteur en lecture:   6.726    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    10
 Rdmodfacs> Valeur propre du vecteur en lecture:   7.123    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    11
 Rdmodfacs> Valeur propre du vecteur en lecture:   9.003    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    12
 Rdmodfacs> Valeur propre du vecteur en lecture:   9.779    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    13
 Rdmodfacs> Valeur propre du vecteur en lecture:   10.91    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    14
 Rdmodfacs> Valeur propre du vecteur en lecture:   11.92    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    15
 Rdmodfacs> Valeur propre du vecteur en lecture:   12.57    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    16
 Rdmodfacs> Valeur propre du vecteur en lecture:   13.41    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    17
 Rdmodfacs> Valeur propre du vecteur en lecture:   14.60    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    18
 Rdmodfacs> Valeur propre du vecteur en lecture:   14.66    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    19
 Rdmodfacs> Valeur propre du vecteur en lecture:   15.54    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    20
 Rdmodfacs> Valeur propre du vecteur en lecture:   16.88    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    21
 Rdmodfacs> Valeur propre du vecteur en lecture:   18.03    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    22
 Rdmodfacs> Valeur propre du vecteur en lecture:   18.42    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    23
 Rdmodfacs> Valeur propre du vecteur en lecture:   19.12    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    24
 Rdmodfacs> Valeur propre du vecteur en lecture:   19.25    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    25
 Rdmodfacs> Valeur propre du vecteur en lecture:   20.36    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    26
 Rdmodfacs> Valeur propre du vecteur en lecture:   20.86    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    27
 Rdmodfacs> Valeur propre du vecteur en lecture:   21.69    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    28
 Rdmodfacs> Valeur propre du vecteur en lecture:   22.85    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    29
 Rdmodfacs> Valeur propre du vecteur en lecture:   24.15    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    30
 Rdmodfacs> Valeur propre du vecteur en lecture:   25.51    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    31
 Rdmodfacs> Valeur propre du vecteur en lecture:   26.06    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    32
 Rdmodfacs> Valeur propre du vecteur en lecture:   26.92    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    33
 Rdmodfacs> Valeur propre du vecteur en lecture:   27.87    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    34
 Rdmodfacs> Valeur propre du vecteur en lecture:   28.39    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    35
 Rdmodfacs> Valeur propre du vecteur en lecture:   28.71    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    36
 Rdmodfacs> Valeur propre du vecteur en lecture:   30.27    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    37
 Rdmodfacs> Valeur propre du vecteur en lecture:   30.72    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    38
 Rdmodfacs> Valeur propre du vecteur en lecture:   31.96    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    39
 Rdmodfacs> Valeur propre du vecteur en lecture:   32.23    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    40
 Rdmodfacs> Valeur propre du vecteur en lecture:   33.15    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    41
 Rdmodfacs> Valeur propre du vecteur en lecture:   33.95    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    42
 Rdmodfacs> Valeur propre du vecteur en lecture:   35.27    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    43
 Rdmodfacs> Valeur propre du vecteur en lecture:   35.49    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    44
 Rdmodfacs> Valeur propre du vecteur en lecture:   36.85    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    45
 Rdmodfacs> Valeur propre du vecteur en lecture:   36.96    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    46
 Rdmodfacs> Valeur propre du vecteur en lecture:   38.26    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    47
 Rdmodfacs> Valeur propre du vecteur en lecture:   38.67    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    48
 Rdmodfacs> Valeur propre du vecteur en lecture:   40.30    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    49
 Rdmodfacs> Valeur propre du vecteur en lecture:   40.42    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    50
 Rdmodfacs> Valeur propre du vecteur en lecture:   40.70    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    51
 Rdmodfacs> Valeur propre du vecteur en lecture:   42.31    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    52
 Rdmodfacs> Valeur propre du vecteur en lecture:   43.50    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    53
 Rdmodfacs> Valeur propre du vecteur en lecture:   44.09    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    54
 Rdmodfacs> Valeur propre du vecteur en lecture:   44.42    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    55
 Rdmodfacs> Valeur propre du vecteur en lecture:   44.98    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    56
 Rdmodfacs> Valeur propre du vecteur en lecture:   46.06    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    57
 Rdmodfacs> Valeur propre du vecteur en lecture:   47.24    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    58
 Rdmodfacs> Valeur propre du vecteur en lecture:   47.43    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    59
 Rdmodfacs> Valeur propre du vecteur en lecture:   48.72    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    60
 Rdmodfacs> Valeur propre du vecteur en lecture:   49.82    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    61
 Rdmodfacs> Valeur propre du vecteur en lecture:   50.45    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    62
 Rdmodfacs> Valeur propre du vecteur en lecture:   51.74    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    63
 Rdmodfacs> Valeur propre du vecteur en lecture:   53.09    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    64
 Rdmodfacs> Valeur propre du vecteur en lecture:   53.98    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    65
 Rdmodfacs> Valeur propre du vecteur en lecture:   54.47    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    66
 Rdmodfacs> Valeur propre du vecteur en lecture:   55.46    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    67
 Rdmodfacs> Valeur propre du vecteur en lecture:   55.86    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    68
 Rdmodfacs> Valeur propre du vecteur en lecture:   56.52    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    69
 Rdmodfacs> Valeur propre du vecteur en lecture:   57.10    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    70
 Rdmodfacs> Valeur propre du vecteur en lecture:   57.70    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    71
 Rdmodfacs> Valeur propre du vecteur en lecture:   58.50    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    72
 Rdmodfacs> Valeur propre du vecteur en lecture:   59.94    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    73
 Rdmodfacs> Valeur propre du vecteur en lecture:   60.46    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    74
 Rdmodfacs> Valeur propre du vecteur en lecture:   61.48    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    75
 Rdmodfacs> Valeur propre du vecteur en lecture:   62.22    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    76
 Rdmodfacs> Valeur propre du vecteur en lecture:   62.35    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    77
 Rdmodfacs> Valeur propre du vecteur en lecture:   63.20    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    78
 Rdmodfacs> Valeur propre du vecteur en lecture:   63.88    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    79
 Rdmodfacs> Valeur propre du vecteur en lecture:   64.28    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    80
 Rdmodfacs> Valeur propre du vecteur en lecture:   65.92    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    81
 Rdmodfacs> Valeur propre du vecteur en lecture:   66.80    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    82
 Rdmodfacs> Valeur propre du vecteur en lecture:   67.01    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    83
 Rdmodfacs> Valeur propre du vecteur en lecture:   67.43    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    84
 Rdmodfacs> Valeur propre du vecteur en lecture:   69.55    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    85
 Rdmodfacs> Valeur propre du vecteur en lecture:   70.05    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    86
 Rdmodfacs> Valeur propre du vecteur en lecture:   70.99    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    87
 Rdmodfacs> Valeur propre du vecteur en lecture:   71.41    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    88
 Rdmodfacs> Valeur propre du vecteur en lecture:   72.34    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    89
 Rdmodfacs> Valeur propre du vecteur en lecture:   73.40    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    90
 Rdmodfacs> Valeur propre du vecteur en lecture:   73.53    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    91
 Rdmodfacs> Valeur propre du vecteur en lecture:   74.18    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    92
 Rdmodfacs> Valeur propre du vecteur en lecture:   75.18    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    93
 Rdmodfacs> Valeur propre du vecteur en lecture:   76.55    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    94
 Rdmodfacs> Valeur propre du vecteur en lecture:   77.05    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    95
 Rdmodfacs> Valeur propre du vecteur en lecture:   77.43    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    96
 Rdmodfacs> Valeur propre du vecteur en lecture:   78.44    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    97
 Rdmodfacs> Valeur propre du vecteur en lecture:   78.99    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    98
 Rdmodfacs> Valeur propre du vecteur en lecture:   79.39    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    99
 Rdmodfacs> Valeur propre du vecteur en lecture:   80.41    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:   100
 Rdmodfacs> Valeur propre du vecteur en lecture:   81.69    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:   101
 Rdmodfacs> Valeur propre du vecteur en lecture:   82.20    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:   102
 Rdmodfacs> Valeur propre du vecteur en lecture:   82.47    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:   103
 Rdmodfacs> Valeur propre du vecteur en lecture:   84.63    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:   104
 Rdmodfacs> Valeur propre du vecteur en lecture:   85.31    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:   105
 Rdmodfacs> Valeur propre du vecteur en lecture:   85.86    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:   106
 Rdmodfacs> Valeur propre du vecteur en lecture:   86.96    

 Bfactors>  106 vectors,   5670 coordinates in file.

 Openam> file on opening on unit     12:
 bfactors.pred                                                   

 Bfactors> Best zero-eigenvalue found  :     0.000000
 Bfactors>     6 eigenvalues less than :     0.000000
 Bfactors> Lowest non-zero eigenvalue  :     5.063000
 Bfactors>   100 eigenvectors will be considered.
 Bfactors> Rotation-Tranlation modes are skipped.

 Bfactors> Mass-weighted B-factors are computed.
          (CHARMM units assumed for eigenvalues)

 Bfactors> Correlation=     -0.582 for    238 C-alpha atoms.
 Bfactors> =      0.021 +/-   0.02
 Bfactors> =     97.899 +/-   2.98
 Bfactors> Shiftng-fct=     97.878
 Bfactors> Scaling-fct=    131.712

 Bfactors> Predicted, Scaled and Experimental B-factors are saved.

 Bfactors> Normal end.
check_modes
 Chkmod> Version 1.00, Bordeaux.                
 Getnam> Eigenvector filename ?
 Getnam> 2602071221493272438.eigenfacs

 Openam> file on opening on unit     10:
 2602071221493272438.eigenfacs                                   

 Rdmodfacs> Old Blzpack file format detected.

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     1
 Rdmodfacs> Frequence du vecteur en lecture:  3.4316E-03

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     2
 Rdmodfacs> Frequence du vecteur en lecture:  3.4325E-03

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     3
 Rdmodfacs> Frequence du vecteur en lecture:  3.4329E-03

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     4
 Rdmodfacs> Frequence du vecteur en lecture:  3.4329E-03

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     5
 Rdmodfacs> Frequence du vecteur en lecture:  3.4342E-03

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     6
 Rdmodfacs> Frequence du vecteur en lecture:  3.4343E-03

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     7
 Rdmodfacs> Frequence du vecteur en lecture:   244.3    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     8
 Rdmodfacs> Frequence du vecteur en lecture:   263.1    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:     9
 Rdmodfacs> Frequence du vecteur en lecture:   281.6    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    10
 Rdmodfacs> Frequence du vecteur en lecture:   289.8    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    11
 Rdmodfacs> Frequence du vecteur en lecture:   325.8    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    12
 Rdmodfacs> Frequence du vecteur en lecture:   339.6    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    13
 Rdmodfacs> Frequence du vecteur en lecture:   358.7    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    14
 Rdmodfacs> Frequence du vecteur en lecture:   374.9    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    15
 Rdmodfacs> Frequence du vecteur en lecture:   385.0    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    16
 Rdmodfacs> Frequence du vecteur en lecture:   397.6    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    17
 Rdmodfacs> Frequence du vecteur en lecture:   414.9    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    18
 Rdmodfacs> Frequence du vecteur en lecture:   415.8    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    19
 Rdmodfacs> Frequence du vecteur en lecture:   428.1    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    20
 Rdmodfacs> Frequence du vecteur en lecture:   446.1    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    21
 Rdmodfacs> Frequence du vecteur en lecture:   461.1    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    22
 Rdmodfacs> Frequence du vecteur en lecture:   466.0    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    23
 Rdmodfacs> Frequence du vecteur en lecture:   474.8    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    24
 Rdmodfacs> Frequence du vecteur en lecture:   476.4    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    25
 Rdmodfacs> Frequence du vecteur en lecture:   490.0    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    26
 Rdmodfacs> Frequence du vecteur en lecture:   495.9    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    27
 Rdmodfacs> Frequence du vecteur en lecture:   505.7    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    28
 Rdmodfacs> Frequence du vecteur en lecture:   519.1    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    29
 Rdmodfacs> Frequence du vecteur en lecture:   533.6    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    30
 Rdmodfacs> Frequence du vecteur en lecture:   548.4    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    31
 Rdmodfacs> Frequence du vecteur en lecture:   554.3    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    32
 Rdmodfacs> Frequence du vecteur en lecture:   563.4    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    33
 Rdmodfacs> Frequence du vecteur en lecture:   573.3    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    34
 Rdmodfacs> Frequence du vecteur en lecture:   578.6    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    35
 Rdmodfacs> Frequence du vecteur en lecture:   581.8    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    36
 Rdmodfacs> Frequence du vecteur en lecture:   597.4    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    37
 Rdmodfacs> Frequence du vecteur en lecture:   601.8    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    38
 Rdmodfacs> Frequence du vecteur en lecture:   613.9    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    39
 Rdmodfacs> Frequence du vecteur en lecture:   616.5    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    40
 Rdmodfacs> Frequence du vecteur en lecture:   625.2    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    41
 Rdmodfacs> Frequence du vecteur en lecture:   632.7    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    42
 Rdmodfacs> Frequence du vecteur en lecture:   644.9    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    43
 Rdmodfacs> Frequence du vecteur en lecture:   646.9    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    44
 Rdmodfacs> Frequence du vecteur en lecture:   659.2    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    45
 Rdmodfacs> Frequence du vecteur en lecture:   660.1    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    46
 Rdmodfacs> Frequence du vecteur en lecture:   671.7    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    47
 Rdmodfacs> Frequence du vecteur en lecture:   675.2    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    48
 Rdmodfacs> Frequence du vecteur en lecture:   689.3    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    49
 Rdmodfacs> Frequence du vecteur en lecture:   690.4    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    50
 Rdmodfacs> Frequence du vecteur en lecture:   692.7    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    51
 Rdmodfacs> Frequence du vecteur en lecture:   706.3    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    52
 Rdmodfacs> Frequence du vecteur en lecture:   716.2    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    53
 Rdmodfacs> Frequence du vecteur en lecture:   721.0    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    54
 Rdmodfacs> Frequence du vecteur en lecture:   723.7    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    55
 Rdmodfacs> Frequence du vecteur en lecture:   728.3    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    56
 Rdmodfacs> Frequence du vecteur en lecture:   737.0    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    57
 Rdmodfacs> Frequence du vecteur en lecture:   746.3    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    58
 Rdmodfacs> Frequence du vecteur en lecture:   747.8    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    59
 Rdmodfacs> Frequence du vecteur en lecture:   757.9    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    60
 Rdmodfacs> Frequence du vecteur en lecture:   766.4    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    61
 Rdmodfacs> Frequence du vecteur en lecture:   771.3    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    62
 Rdmodfacs> Frequence du vecteur en lecture:   781.1    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    63
 Rdmodfacs> Frequence du vecteur en lecture:   791.2    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    64
 Rdmodfacs> Frequence du vecteur en lecture:   797.8    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    65
 Rdmodfacs> Frequence du vecteur en lecture:   801.4    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    66
 Rdmodfacs> Frequence du vecteur en lecture:   808.7    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    67
 Rdmodfacs> Frequence du vecteur en lecture:   811.6    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    68
 Rdmodfacs> Frequence du vecteur en lecture:   816.4    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    69
 Rdmodfacs> Frequence du vecteur en lecture:   820.5    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    70
 Rdmodfacs> Frequence du vecteur en lecture:   824.8    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    71
 Rdmodfacs> Frequence du vecteur en lecture:   830.5    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    72
 Rdmodfacs> Frequence du vecteur en lecture:   840.7    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    73
 Rdmodfacs> Frequence du vecteur en lecture:   844.3    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    74
 Rdmodfacs> Frequence du vecteur en lecture:   851.4    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    75
 Rdmodfacs> Frequence du vecteur en lecture:   856.5    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    76
 Rdmodfacs> Frequence du vecteur en lecture:   857.4    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    77
 Rdmodfacs> Frequence du vecteur en lecture:   863.2    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    78
 Rdmodfacs> Frequence du vecteur en lecture:   867.9    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    79
 Rdmodfacs> Frequence du vecteur en lecture:   870.6    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    80
 Rdmodfacs> Frequence du vecteur en lecture:   881.6    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    81
 Rdmodfacs> Frequence du vecteur en lecture:   887.5    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    82
 Rdmodfacs> Frequence du vecteur en lecture:   888.9    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    83
 Rdmodfacs> Frequence du vecteur en lecture:   891.7    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    84
 Rdmodfacs> Frequence du vecteur en lecture:   905.6    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    85
 Rdmodfacs> Frequence du vecteur en lecture:   908.8    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    86
 Rdmodfacs> Frequence du vecteur en lecture:   914.9    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    87
 Rdmodfacs> Frequence du vecteur en lecture:   917.6    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    88
 Rdmodfacs> Frequence du vecteur en lecture:   923.6    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    89
 Rdmodfacs> Frequence du vecteur en lecture:   930.3    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    90
 Rdmodfacs> Frequence du vecteur en lecture:   931.1    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    91
 Rdmodfacs> Frequence du vecteur en lecture:   935.2    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    92
 Rdmodfacs> Frequence du vecteur en lecture:   941.5    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    93
 Rdmodfacs> Frequence du vecteur en lecture:   950.1    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    94
 Rdmodfacs> Frequence du vecteur en lecture:   953.2    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    95
 Rdmodfacs> Frequence du vecteur en lecture:   955.5    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    96
 Rdmodfacs> Frequence du vecteur en lecture:   961.7    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    97
 Rdmodfacs> Frequence du vecteur en lecture:   965.1    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    98
 Rdmodfacs> Frequence du vecteur en lecture:   967.5    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:    99
 Rdmodfacs> Frequence du vecteur en lecture:   973.7    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:   100
 Rdmodfacs> Frequence du vecteur en lecture:   981.4    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:   101
 Rdmodfacs> Frequence du vecteur en lecture:   984.5    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:   102
 Rdmodfacs> Frequence du vecteur en lecture:   986.1    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:   103
 Rdmodfacs> Frequence du vecteur en lecture:   998.9    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:   104
 Rdmodfacs> Frequence du vecteur en lecture:   1003.    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:   105
 Rdmodfacs> Frequence du vecteur en lecture:   1006.    

 Rdmodfacs> Numero du vecteur CERFACS en lecture:   106
 Rdmodfacs> Frequence du vecteur en lecture:   1013.    

 Chkmod>  106 vectors,   5670 coordinates in file.
 Chkmod>      That is:   1890 cartesian points.

 Openam> file on opening on unit     11:
 Chkmod.res                                                      
 Chkmod> Collectivity=f(frequency) to be written in this file.
%Chkmod-Wn> Norm of vector    29 is:   1.0001 (instead of 1.0000). 
%Chkmod-Wn> Norm of vector    31 is:   0.9999 (instead of 1.0000). 

 Chkmod> Normal end.
      0.0034      0.7451
      0.0034      0.7612
      0.0034      0.8566
      0.0034      0.9403
      0.0034      0.7683
      0.0034      0.8815
    244.3321      0.3788
    263.0623      0.3562
    281.6145      0.0149
    289.8065      0.1313
    325.8144      0.2416
    339.5657      0.3542
    358.6650      0.1924
    374.8994      0.1171
    384.9854      0.2732
    397.6409      0.1782
    414.9092      0.1586
    415.7609      0.3613
    428.0575      0.2473
    446.1315      0.5625
    461.0781      0.1323
    466.0381      0.3919
    474.8108      0.5375
    476.4222      0.2612
    489.9655      0.2945
    495.9453      0.5574
    505.7157      0.3732
    519.0626      0.3214
    533.6238      0.2293
    548.4435      0.4096
    554.3242      0.0710
    563.3965      0.2856
    573.2514      0.3450
    578.5746      0.3775
    581.8261      0.4259
    597.4243      0.3675
    601.8486      0.6512
    613.8751      0.4133
    616.4627      0.4390
    625.1992      0.3941
    632.6981      0.3010
    644.8807      0.2790
    646.8888      0.3288
    659.1669      0.2577
    660.1500      0.1776
    671.6594      0.5151
    675.2486      0.3352
    689.3331      0.3244
    690.3587      0.4839
    692.7457      0.5632
    706.3145      0.1917
    716.1785      0.4111
    721.0190      0.4784
    723.7122      0.3891
    728.2598      0.3856
    736.9510      0.4270
    746.3312      0.3816
    747.8305      0.3523
    757.9321      0.3894
    766.4406      0.4064
    771.2714      0.4526
    781.0698      0.4455
    791.1940      0.3353
    797.7982      0.3478
    801.4110      0.4163
    808.6611      0.3012
    811.5721      0.4319
    816.3525      0.5070
    820.5304      0.3980
    824.8302      0.2575
    830.5286      0.4324
    840.6883      0.4456
    844.3271      0.3667
    851.4194      0.4046
    856.5281      0.3193
    857.4225      0.3196
    863.2472      0.3241
    867.8788      0.3657
    870.5918      0.5657
    881.6277      0.4437
    887.4929      0.4650
    888.8868      0.3642
    891.6681      0.3070
    905.5766      0.3527
    908.8259      0.4805
    914.9034      0.3545
    917.6058      0.3140
    923.5616      0.3626
    930.3035      0.3699
    931.1270      0.3986
    935.2335      0.4710
    941.5162      0.4174
    950.0561      0.4569
    953.1537      0.3783
    955.5013      0.4964
    961.7129      0.5203
    965.0786      0.4193
    967.5191      0.4781
    973.7146      0.3280
    981.4340      0.4260
    984.4928      0.4094
    986.1083      0.4681
    998.9386      0.4907
   1002.9438      0.4661
   1006.1717      0.4131
   1012.5965      0.3095
getting mode 7
running: ../../bin/get_modes.sh 2602071221493272438 7 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 7
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.7.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.7.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.7.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 8
running: ../../bin/get_modes.sh 2602071221493272438 8 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 8
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.8.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.8.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.8.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 9
running: ../../bin/get_modes.sh 2602071221493272438 9 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 9
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.9.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.9.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.9.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 10
running: ../../bin/get_modes.sh 2602071221493272438 10 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 10
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.10.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.10.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.10.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 11
running: ../../bin/get_modes.sh 2602071221493272438 11 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 11
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.11.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.11.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.11.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 12
running: ../../bin/get_modes.sh 2602071221493272438 12 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 12
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.12.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.12.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.12.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 13
running: ../../bin/get_modes.sh 2602071221493272438 13 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 13
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.13.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.13.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.13.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 14
running: ../../bin/get_modes.sh 2602071221493272438 14 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 14
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.14.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.14.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.14.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 15
running: ../../bin/get_modes.sh 2602071221493272438 15 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 15
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.15.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.15.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.15.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 16
running: ../../bin/get_modes.sh 2602071221493272438 16 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 16
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.16.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.16.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.16.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 17
running: ../../bin/get_modes.sh 2602071221493272438 17 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 17
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.17.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.17.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.17.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 18
running: ../../bin/get_modes.sh 2602071221493272438 18 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 18
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.18.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.18.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.18.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 19
running: ../../bin/get_modes.sh 2602071221493272438 19 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 19
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.19.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.19.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.19.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 20
running: ../../bin/get_modes.sh 2602071221493272438 20 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 20
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.20.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.20.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.20.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 21
running: ../../bin/get_modes.sh 2602071221493272438 21 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 21
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.21.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.21.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.21.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 22
running: ../../bin/get_modes.sh 2602071221493272438 22 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 22
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.22.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.22.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.22.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 23
running: ../../bin/get_modes.sh 2602071221493272438 23 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 23
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.23.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.23.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.23.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 24
running: ../../bin/get_modes.sh 2602071221493272438 24 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 24
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.24.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.24.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.24.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 25
running: ../../bin/get_modes.sh 2602071221493272438 25 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 25
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.25.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.25.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.25.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 26
running: ../../bin/get_modes.sh 2602071221493272438 26 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 26
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.26.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.26.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.26.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 27
running: ../../bin/get_modes.sh 2602071221493272438 27 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 27
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.27.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.27.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.27.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 28
running: ../../bin/get_modes.sh 2602071221493272438 28 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 28
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.28.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.28.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.28.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 29
running: ../../bin/get_modes.sh 2602071221493272438 29 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 29
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.29.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.29.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.29.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 30
running: ../../bin/get_modes.sh 2602071221493272438 30 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 30
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.30.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.30.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.30.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 31
running: ../../bin/get_modes.sh 2602071221493272438 31 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 31
calculating perturbed structure for DQ=-100
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=-50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=0
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=50
2602071221493272438.eigenfacs
2602071221493272438.atom
calculating perturbed structure for DQ=100
2602071221493272438.eigenfacs
2602071221493272438.atom
making animated gifs
5 models are in 2602071221493272438.31.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.31.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
5 models are in 2602071221493272438.31.pdb, 0 models will be skipped
MODEL 1 will be plotted
MODEL 2 will be plotted
MODEL 3 will be plotted
MODEL 4 will be plotted
MODEL 5 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
2602071221493272438.10.pdb
2602071221493272438.11.pdb
2602071221493272438.12.pdb
2602071221493272438.13.pdb
2602071221493272438.14.pdb
2602071221493272438.15.pdb
2602071221493272438.16.pdb
2602071221493272438.17.pdb
2602071221493272438.18.pdb
2602071221493272438.19.pdb
2602071221493272438.20.pdb
2602071221493272438.21.pdb
2602071221493272438.22.pdb
2602071221493272438.23.pdb
2602071221493272438.24.pdb
2602071221493272438.25.pdb
2602071221493272438.26.pdb
2602071221493272438.27.pdb
2602071221493272438.28.pdb
2602071221493272438.29.pdb
2602071221493272438.30.pdb
2602071221493272438.31.pdb
2602071221493272438.7.pdb
2602071221493272438.8.pdb
2602071221493272438.9.pdb



STDERR:
Note: The following floating-point exceptions are signalling: IEEE_DENORMAL

real	0m6.377s
user	0m6.309s
sys	0m0.065s
rm: cannot remove '2602071221493272438.sdijf': No such file or directory
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If you find results from this site helpful for your research, please cite one of our papers:
K. Suhre & Y.H. Sanejouand, ElNemo: a normal mode web-server for protein movement analysis and the generation of templates for molecular replacement. Nucleic Acids Research, 32, W610-W614, 2004.
K. Suhre & Y.H. Sanejouand, On the potential of normal mode analysis for solving difficult molecular replacement problems. Acta Cryst. D vol.60, p796-799, 2004 © International Union of Crystallography.
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.
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.

*** FXIa WT ***

LOGs for ID: 2602071221493272438

Output from eigenvector calculation:

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.

* FXIa WT *
