*** ***
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 = 2608061544393157910.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 2608061544393157910.atom to be opened.
Openam> File opened: 2608061544393157910.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 = 371
First residue number = 5
Last residue number = 124
Number of atoms found = 2935
Mean number per residue = 7.9
Pdbmat> Coordinate statistics:
= 76.342858 +/- 12.800494 From: 46.359000 To: 105.370000
= 18.215996 +/- 17.668788 From: -24.702000 To: 55.306000
= 103.185837 +/- 9.198728 From: 77.931000 To: 125.839000
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 2.8301 % Filled.
Pdbmat> 1097178 non-zero elements.
Pdbmat> 119972 atom-atom interactions.
Pdbmat> Number per atom= 81.75 +/- 22.56
Maximum number = 130
Minimum number = 15
Pdbmat> Matrix trace = 2.399440E+06
Pdbmat> Larger element = 491.740
Pdbmat> 0 elements larger than +/- 1.0E+10
Pdbmat> Normal end.
automatic determination of NRBL (NRBL = nresidues/200 + 1)
371 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 = 2608061544393157910.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 2608061544393157910.atom to be opened.
Openam> file on opening on unit 11:
2608061544393157910.atom
Blocpdb> Coordinate file in PDB format.
Blocpdb> 2935 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> 371 residues.
Blocpdb> 21 atoms in block 1
Block first atom: 1
Blocpdb> 10 atoms in block 2
Block first atom: 22
Blocpdb> 11 atoms in block 3
Block first atom: 32
Blocpdb> 14 atoms in block 4
Block first atom: 43
Blocpdb> 20 atoms in block 5
Block first atom: 57
Blocpdb> 18 atoms in block 6
Block first atom: 77
Blocpdb> 16 atoms in block 7
Block first atom: 95
Blocpdb> 15 atoms in block 8
Block first atom: 111
Blocpdb> 16 atoms in block 9
Block first atom: 126
Blocpdb> 13 atoms in block 10
Block first atom: 142
Blocpdb> 21 atoms in block 11
Block first atom: 155
Blocpdb> 16 atoms in block 12
Block first atom: 176
Blocpdb> 18 atoms in block 13
Block first atom: 192
Blocpdb> 16 atoms in block 14
Block first atom: 210
Blocpdb> 19 atoms in block 15
Block first atom: 226
Blocpdb> 17 atoms in block 16
Block first atom: 245
Blocpdb> 14 atoms in block 17
Block first atom: 262
Blocpdb> 15 atoms in block 18
Block first atom: 276
Blocpdb> 21 atoms in block 19
Block first atom: 291
Blocpdb> 13 atoms in block 20
Block first atom: 312
Blocpdb> 20 atoms in block 21
Block first atom: 325
Blocpdb> 9 atoms in block 22
Block first atom: 345
Blocpdb> 19 atoms in block 23
Block first atom: 354
Blocpdb> 15 atoms in block 24
Block first atom: 373
Blocpdb> 17 atoms in block 25
Block first atom: 388
Blocpdb> 14 atoms in block 26
Block first atom: 405
Blocpdb> 15 atoms in block 27
Block first atom: 419
Blocpdb> 18 atoms in block 28
Block first atom: 434
Blocpdb> 20 atoms in block 29
Block first atom: 452
Blocpdb> 16 atoms in block 30
Block first atom: 472
Blocpdb> 16 atoms in block 31
Block first atom: 488
Blocpdb> 17 atoms in block 32
Block first atom: 504
Blocpdb> 11 atoms in block 33
Block first atom: 521
Blocpdb> 16 atoms in block 34
Block first atom: 532
Blocpdb> 14 atoms in block 35
Block first atom: 548
Blocpdb> 14 atoms in block 36
Block first atom: 562
Blocpdb> 17 atoms in block 37
Block first atom: 576
Blocpdb> 16 atoms in block 38
Block first atom: 593
Blocpdb> 20 atoms in block 39
Block first atom: 609
Blocpdb> 19 atoms in block 40
Block first atom: 629
Blocpdb> 17 atoms in block 41
Block first atom: 648
Blocpdb> 13 atoms in block 42
Block first atom: 665
Blocpdb> 19 atoms in block 43
Block first atom: 678
Blocpdb> 18 atoms in block 44
Block first atom: 697
Blocpdb> 16 atoms in block 45
Block first atom: 715
Blocpdb> 20 atoms in block 46
Block first atom: 731
Blocpdb> 16 atoms in block 47
Block first atom: 751
Blocpdb> 18 atoms in block 48
Block first atom: 767
Blocpdb> 17 atoms in block 49
Block first atom: 785
Blocpdb> 15 atoms in block 50
Block first atom: 802
Blocpdb> 16 atoms in block 51
Block first atom: 817
Blocpdb> 16 atoms in block 52
Block first atom: 833
Blocpdb> 13 atoms in block 53
Block first atom: 849
Blocpdb> 16 atoms in block 54
Block first atom: 862
Blocpdb> 15 atoms in block 55
Block first atom: 878
Blocpdb> 20 atoms in block 56
Block first atom: 893
Blocpdb> 13 atoms in block 57
Block first atom: 913
Blocpdb> 19 atoms in block 58
Block first atom: 926
Blocpdb> 13 atoms in block 59
Block first atom: 945
Blocpdb> 17 atoms in block 60
Block first atom: 958
Blocpdb> 20 atoms in block 61
Block first atom: 975
Blocpdb> 15 atoms in block 62
Block first atom: 995
Blocpdb> 13 atoms in block 63
Block first atom: 1010
Blocpdb> 22 atoms in block 64
Block first atom: 1023
Blocpdb> 20 atoms in block 65
Block first atom: 1045
Blocpdb> 14 atoms in block 66
Block first atom: 1065
Blocpdb> 14 atoms in block 67
Block first atom: 1079
Blocpdb> 15 atoms in block 68
Block first atom: 1093
Blocpdb> 13 atoms in block 69
Block first atom: 1108
Blocpdb> 18 atoms in block 70
Block first atom: 1121
Blocpdb> 23 atoms in block 71
Block first atom: 1139
Blocpdb> 14 atoms in block 72
Block first atom: 1162
Blocpdb> 17 atoms in block 73
Block first atom: 1176
Blocpdb> 22 atoms in block 74
Block first atom: 1193
Blocpdb> 14 atoms in block 75
Block first atom: 1215
Blocpdb> 10 atoms in block 76
Block first atom: 1229
Blocpdb> 14 atoms in block 77
Block first atom: 1239
Blocpdb> 14 atoms in block 78
Block first atom: 1253
Blocpdb> 17 atoms in block 79
Block first atom: 1267
Blocpdb> 16 atoms in block 80
Block first atom: 1284
Blocpdb> 12 atoms in block 81
Block first atom: 1300
Blocpdb> 17 atoms in block 82
Block first atom: 1312
Blocpdb> 15 atoms in block 83
Block first atom: 1329
Blocpdb> 19 atoms in block 84
Block first atom: 1344
Blocpdb> 17 atoms in block 85
Block first atom: 1363
Blocpdb> 14 atoms in block 86
Block first atom: 1380
Blocpdb> 18 atoms in block 87
Block first atom: 1394
Blocpdb> 10 atoms in block 88
Block first atom: 1412
Blocpdb> 16 atoms in block 89
Block first atom: 1422
Blocpdb> 17 atoms in block 90
Block first atom: 1438
Blocpdb> 16 atoms in block 91
Block first atom: 1455
Blocpdb> 16 atoms in block 92
Block first atom: 1471
Blocpdb> 18 atoms in block 93
Block first atom: 1487
Blocpdb> 16 atoms in block 94
Block first atom: 1505
Blocpdb> 15 atoms in block 95
Block first atom: 1521
Blocpdb> 14 atoms in block 96
Block first atom: 1536
Blocpdb> 21 atoms in block 97
Block first atom: 1550
Blocpdb> 18 atoms in block 98
Block first atom: 1571
Blocpdb> 8 atoms in block 99
Block first atom: 1589
Blocpdb> 20 atoms in block 100
Block first atom: 1597
Blocpdb> 14 atoms in block 101
Block first atom: 1617
Blocpdb> 19 atoms in block 102
Block first atom: 1631
Blocpdb> 14 atoms in block 103
Block first atom: 1650
Blocpdb> 17 atoms in block 104
Block first atom: 1664
Blocpdb> 14 atoms in block 105
Block first atom: 1681
Blocpdb> 17 atoms in block 106
Block first atom: 1695
Blocpdb> 17 atoms in block 107
Block first atom: 1712
Blocpdb> 15 atoms in block 108
Block first atom: 1729
Blocpdb> 16 atoms in block 109
Block first atom: 1744
Blocpdb> 15 atoms in block 110
Block first atom: 1760
Blocpdb> 19 atoms in block 111
Block first atom: 1775
Blocpdb> 17 atoms in block 112
Block first atom: 1794
Blocpdb> 17 atoms in block 113
Block first atom: 1811
Blocpdb> 15 atoms in block 114
Block first atom: 1828
Blocpdb> 16 atoms in block 115
Block first atom: 1843
Blocpdb> 23 atoms in block 116
Block first atom: 1859
Blocpdb> 15 atoms in block 117
Block first atom: 1882
Blocpdb> 20 atoms in block 118
Block first atom: 1897
Blocpdb> 17 atoms in block 119
Block first atom: 1917
Blocpdb> 13 atoms in block 120
Block first atom: 1934
Blocpdb> 17 atoms in block 121
Block first atom: 1947
Blocpdb> 16 atoms in block 122
Block first atom: 1964
Blocpdb> 14 atoms in block 123
Block first atom: 1980
Blocpdb> 13 atoms in block 124
Block first atom: 1994
Blocpdb> 16 atoms in block 125
Block first atom: 2007
Blocpdb> 17 atoms in block 126
Block first atom: 2023
Blocpdb> 15 atoms in block 127
Block first atom: 2040
Blocpdb> 8 atoms in block 128
Block first atom: 2055
Blocpdb> 12 atoms in block 129
Block first atom: 2063
Blocpdb> 16 atoms in block 130
Block first atom: 2075
Blocpdb> 9 atoms in block 131
Block first atom: 2091
Blocpdb> 10 atoms in block 132
Block first atom: 2100
Blocpdb> 19 atoms in block 133
Block first atom: 2110
Blocpdb> 14 atoms in block 134
Block first atom: 2129
Blocpdb> 13 atoms in block 135
Block first atom: 2143
Blocpdb> 10 atoms in block 136
Block first atom: 2156
Blocpdb> 15 atoms in block 137
Block first atom: 2166
Blocpdb> 18 atoms in block 138
Block first atom: 2181
Blocpdb> 19 atoms in block 139
Block first atom: 2199
Blocpdb> 19 atoms in block 140
Block first atom: 2218
Blocpdb> 13 atoms in block 141
Block first atom: 2237
Blocpdb> 25 atoms in block 142
Block first atom: 2250
Blocpdb> 20 atoms in block 143
Block first atom: 2275
Blocpdb> 12 atoms in block 144
Block first atom: 2295
Blocpdb> 13 atoms in block 145
Block first atom: 2307
Blocpdb> 20 atoms in block 146
Block first atom: 2320
Blocpdb> 20 atoms in block 147
Block first atom: 2340
Blocpdb> 12 atoms in block 148
Block first atom: 2360
Blocpdb> 12 atoms in block 149
Block first atom: 2372
Blocpdb> 21 atoms in block 150
Block first atom: 2384
Blocpdb> 11 atoms in block 151
Block first atom: 2405
Blocpdb> 11 atoms in block 152
Block first atom: 2416
Blocpdb> 15 atoms in block 153
Block first atom: 2427
Blocpdb> 17 atoms in block 154
Block first atom: 2442
Blocpdb> 19 atoms in block 155
Block first atom: 2459
Blocpdb> 14 atoms in block 156
Block first atom: 2478
Blocpdb> 15 atoms in block 157
Block first atom: 2492
Blocpdb> 18 atoms in block 158
Block first atom: 2507
Blocpdb> 14 atoms in block 159
Block first atom: 2525
Blocpdb> 19 atoms in block 160
Block first atom: 2539
Blocpdb> 13 atoms in block 161
Block first atom: 2558
Blocpdb> 17 atoms in block 162
Block first atom: 2571
Blocpdb> 14 atoms in block 163
Block first atom: 2588
Blocpdb> 20 atoms in block 164
Block first atom: 2602
Blocpdb> 17 atoms in block 165
Block first atom: 2622
Blocpdb> 14 atoms in block 166
Block first atom: 2639
Blocpdb> 17 atoms in block 167
Block first atom: 2653
Blocpdb> 16 atoms in block 168
Block first atom: 2670
Blocpdb> 15 atoms in block 169
Block first atom: 2686
Blocpdb> 12 atoms in block 170
Block first atom: 2701
Blocpdb> 18 atoms in block 171
Block first atom: 2713
Blocpdb> 11 atoms in block 172
Block first atom: 2731
Blocpdb> 9 atoms in block 173
Block first atom: 2742
Blocpdb> 15 atoms in block 174
Block first atom: 2751
Blocpdb> 15 atoms in block 175
Block first atom: 2766
Blocpdb> 9 atoms in block 176
Block first atom: 2781
Blocpdb> 19 atoms in block 177
Block first atom: 2790
Blocpdb> 12 atoms in block 178
Block first atom: 2809
Blocpdb> 21 atoms in block 179
Block first atom: 2821
Blocpdb> 13 atoms in block 180
Block first atom: 2842
Blocpdb> 18 atoms in block 181
Block first atom: 2855
Blocpdb> 13 atoms in block 182
Block first atom: 2873
Blocpdb> 16 atoms in block 183
Block first atom: 2886
Blocpdb> 14 atoms in block 184
Block first atom: 2902
Blocpdb> 13 atoms in block 185
Block first atom: 2916
Blocpdb> 7 atoms in block 186
Block first atom: 2928
Blocpdb> 186 blocks.
Blocpdb> At most, 25 atoms in each of them.
Blocpdb> At least, 7 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> 1097364 matrix lines read.
Prepmat> Matrix order = 8805
Prepmat> Matrix trace = 2399440.0000
Prepmat> Last element read: 8805 8805 74.4211
Prepmat> 17392 lines saved.
Prepmat> 15355 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: 2935
RTB> Total mass = 2935.0000
RTB> Number of atoms found in matrix: 2935
RTB> Number of blocks = 186
RTB> Projection begins.
RTB> Projected matrix is being saved.
RTB> Projected matrix trace = 257010.0357
RTB> 70506 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 = 1116
Diagstd> Nb of non-zero elements: 70506
Diagstd> Projected matrix trace = 257010.0357
Openam> file on opening on unit 11:
diagrtb_work.eigenfacs
Diagstd> Diagonalization.
Diagstd> 1116 eigenvectors are computed.
Diagstd> 106 of them to be saved.
Diagstd> Sum of eigenvalues = 257010.0357
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 0.6897973 0.8341352 1.3648003 2.4636030
3.2249205 3.5962140 5.2636536 5.5465797 7.1413503
8.2061640 8.7675162 9.4783678 10.1439043 10.8877573
12.0002189 12.7325321 14.3603114 15.1756298 16.0359264
16.5313877 17.5235076 18.1254129 18.8736034 20.0455547
20.7175148 22.1840500 22.7544612 23.1806483 23.9127550
24.4995533 25.1324915 25.8077814 27.3782709 28.0416473
28.5629247 28.9278154 29.9796474 30.6174410 31.3829121
31.9207653 32.1910634 33.0888871 34.2505871 34.3282589
34.5896794 35.6675790 36.2163969 37.2506460 37.4184390
37.9674842 38.2166498 39.0249686 39.5186797 39.9733066
40.2051243 40.5599136 41.6284018 42.2433131 42.3273426
42.8992526 44.0207655 44.4853845 45.9241727 46.3144441
46.5052860 47.3564793 47.8864037 48.3420451 50.0110506
50.1760264 50.7283623 50.7481267 51.4283324 51.8466421
52.1917903 53.1024343 53.7513040 54.2319156 54.8886279
55.5107018 55.6464090 56.8418238 57.4807285 58.0085718
58.1309703 58.7877155 59.4142096 60.0757148 60.6085825
61.5511132 61.7538060 62.9389325 63.4011298 63.8420477
64.3114211 64.5268566 64.9399467 65.2699924 65.7924210
66.5721683
Diagstd> Frequencies (cm-1, if the input matrix is a hessian in CHARMM units):
0.0034309 0.0034327 0.0034332 0.0034335 0.0034335
0.0034341 90.1895078 99.1775772 126.8614968 170.4435783
195.0090580 205.9292530 249.1374024 255.7454466 290.1920086
311.0751912 321.5389349 334.3197697 345.8580214 358.3145929
376.1749430 387.4830149 411.5069822 423.0275401 434.8528361
441.5195481 454.5752657 462.3163307 471.7617142 486.1880936
494.2698375 511.4647390 517.9985669 522.8270743 531.0190325
537.4949195 544.3936521 551.6588839 568.1961521 575.0386574
580.3588585 584.0541300 594.5775962 600.8688985 608.3337344
613.5245253 616.1166449 624.6494479 635.5200994 636.2402918
638.6582820 648.5330247 653.5034740 662.7689967 664.2600183
669.1156548 671.3076347 678.3698871 682.6474834 686.5628777
688.5507964 691.5821742 700.6322904 705.7879942 706.4896140
711.2465011 720.4835602 724.2757669 735.8951674 739.0154333
740.5364501 747.2827957 751.4522542 755.0188417 767.9417324
769.2073275 773.4294434 773.5800977 778.7472059 781.9078936
784.5061954 791.3206437 796.1406202 799.6920023 804.5193008
809.0654194 810.0537780 818.7084675 823.2967713 827.0682837
827.9403840 832.6041517 837.0288789 841.6756317 845.4001951
851.9482914 853.3499055 861.4993749 864.6568347 867.6582179
870.8419338 872.2993220 875.0870243 877.3079429 880.8119822
886.0161368
Diagstd> Normal end.
Rtb_to_modes> Entering in.
Rtb_to_modes> Number of atoms in temporary block-file = 2935
Rtb_to_modes> Number of blocs = 186
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: 9.9820E-10
Rdmodfacs> Eigenvector number: 2
Rdmodfacs> Corresponding eigenvalue: 9.9924E-10
Rdmodfacs> Eigenvector number: 3
Rdmodfacs> Corresponding eigenvalue: 9.9956E-10
Rdmodfacs> Eigenvector number: 4
Rdmodfacs> Corresponding eigenvalue: 9.9971E-10
Rdmodfacs> Eigenvector number: 5
Rdmodfacs> Corresponding eigenvalue: 9.9975E-10
Rdmodfacs> Eigenvector number: 6
Rdmodfacs> Corresponding eigenvalue: 1.0001E-09
Rdmodfacs> Eigenvector number: 7
Rdmodfacs> Corresponding eigenvalue: 0.6898
Rdmodfacs> Eigenvector number: 8
Rdmodfacs> Corresponding eigenvalue: 0.8341
Rdmodfacs> Eigenvector number: 9
Rdmodfacs> Corresponding eigenvalue: 1.365
Rdmodfacs> Eigenvector number: 10
Rdmodfacs> Corresponding eigenvalue: 2.464
Rdmodfacs> Eigenvector number: 11
Rdmodfacs> Corresponding eigenvalue: 3.225
Rdmodfacs> Eigenvector number: 12
Rdmodfacs> Corresponding eigenvalue: 3.596
Rdmodfacs> Eigenvector number: 13
Rdmodfacs> Corresponding eigenvalue: 5.264
Rdmodfacs> Eigenvector number: 14
Rdmodfacs> Corresponding eigenvalue: 5.547
Rdmodfacs> Eigenvector number: 15
Rdmodfacs> Corresponding eigenvalue: 7.141
Rdmodfacs> Eigenvector number: 16
Rdmodfacs> Corresponding eigenvalue: 8.206
Rdmodfacs> Eigenvector number: 17
Rdmodfacs> Corresponding eigenvalue: 8.768
Rdmodfacs> Eigenvector number: 18
Rdmodfacs> Corresponding eigenvalue: 9.478
Rdmodfacs> Eigenvector number: 19
Rdmodfacs> Corresponding eigenvalue: 10.14
Rdmodfacs> Eigenvector number: 20
Rdmodfacs> Corresponding eigenvalue: 10.89
Rdmodfacs> Eigenvector number: 21
Rdmodfacs> Corresponding eigenvalue: 12.00
Rdmodfacs> Eigenvector number: 22
Rdmodfacs> Corresponding eigenvalue: 12.73
Rdmodfacs> Eigenvector number: 23
Rdmodfacs> Corresponding eigenvalue: 14.36
Rdmodfacs> Eigenvector number: 24
Rdmodfacs> Corresponding eigenvalue: 15.18
Rdmodfacs> Eigenvector number: 25
Rdmodfacs> Corresponding eigenvalue: 16.04
Rdmodfacs> Eigenvector number: 26
Rdmodfacs> Corresponding eigenvalue: 16.53
Rdmodfacs> Eigenvector number: 27
Rdmodfacs> Corresponding eigenvalue: 17.52
Rdmodfacs> Eigenvector number: 28
Rdmodfacs> Corresponding eigenvalue: 18.13
Rdmodfacs> Eigenvector number: 29
Rdmodfacs> Corresponding eigenvalue: 18.87
Rdmodfacs> Eigenvector number: 30
Rdmodfacs> Corresponding eigenvalue: 20.05
Rdmodfacs> Eigenvector number: 31
Rdmodfacs> Corresponding eigenvalue: 20.72
Rdmodfacs> Eigenvector number: 32
Rdmodfacs> Corresponding eigenvalue: 22.18
Rdmodfacs> Eigenvector number: 33
Rdmodfacs> Corresponding eigenvalue: 22.75
Rdmodfacs> Eigenvector number: 34
Rdmodfacs> Corresponding eigenvalue: 23.18
Rdmodfacs> Eigenvector number: 35
Rdmodfacs> Corresponding eigenvalue: 23.91
Rdmodfacs> Eigenvector number: 36
Rdmodfacs> Corresponding eigenvalue: 24.50
Rdmodfacs> Eigenvector number: 37
Rdmodfacs> Corresponding eigenvalue: 25.13
Rdmodfacs> Eigenvector number: 38
Rdmodfacs> Corresponding eigenvalue: 25.81
Rdmodfacs> Eigenvector number: 39
Rdmodfacs> Corresponding eigenvalue: 27.38
Rdmodfacs> Eigenvector number: 40
Rdmodfacs> Corresponding eigenvalue: 28.04
Rdmodfacs> Eigenvector number: 41
Rdmodfacs> Corresponding eigenvalue: 28.56
Rdmodfacs> Eigenvector number: 42
Rdmodfacs> Corresponding eigenvalue: 28.93
Rdmodfacs> Eigenvector number: 43
Rdmodfacs> Corresponding eigenvalue: 29.98
Rdmodfacs> Eigenvector number: 44
Rdmodfacs> Corresponding eigenvalue: 30.62
Rdmodfacs> Eigenvector number: 45
Rdmodfacs> Corresponding eigenvalue: 31.38
Rdmodfacs> Eigenvector number: 46
Rdmodfacs> Corresponding eigenvalue: 31.92
Rdmodfacs> Eigenvector number: 47
Rdmodfacs> Corresponding eigenvalue: 32.19
Rdmodfacs> Eigenvector number: 48
Rdmodfacs> Corresponding eigenvalue: 33.09
Rdmodfacs> Eigenvector number: 49
Rdmodfacs> Corresponding eigenvalue: 34.25
Rdmodfacs> Eigenvector number: 50
Rdmodfacs> Corresponding eigenvalue: 34.33
Rdmodfacs> Eigenvector number: 51
Rdmodfacs> Corresponding eigenvalue: 34.59
Rdmodfacs> Eigenvector number: 52
Rdmodfacs> Corresponding eigenvalue: 35.67
Rdmodfacs> Eigenvector number: 53
Rdmodfacs> Corresponding eigenvalue: 36.22
Rdmodfacs> Eigenvector number: 54
Rdmodfacs> Corresponding eigenvalue: 37.25
Rdmodfacs> Eigenvector number: 55
Rdmodfacs> Corresponding eigenvalue: 37.42
Rdmodfacs> Eigenvector number: 56
Rdmodfacs> Corresponding eigenvalue: 37.97
Rdmodfacs> Eigenvector number: 57
Rdmodfacs> Corresponding eigenvalue: 38.22
Rdmodfacs> Eigenvector number: 58
Rdmodfacs> Corresponding eigenvalue: 39.02
Rdmodfacs> Eigenvector number: 59
Rdmodfacs> Corresponding eigenvalue: 39.52
Rdmodfacs> Eigenvector number: 60
Rdmodfacs> Corresponding eigenvalue: 39.97
Rdmodfacs> Eigenvector number: 61
Rdmodfacs> Corresponding eigenvalue: 40.21
Rdmodfacs> Eigenvector number: 62
Rdmodfacs> Corresponding eigenvalue: 40.56
Rdmodfacs> Eigenvector number: 63
Rdmodfacs> Corresponding eigenvalue: 41.63
Rdmodfacs> Eigenvector number: 64
Rdmodfacs> Corresponding eigenvalue: 42.24
Rdmodfacs> Eigenvector number: 65
Rdmodfacs> Corresponding eigenvalue: 42.33
Rdmodfacs> Eigenvector number: 66
Rdmodfacs> Corresponding eigenvalue: 42.90
Rdmodfacs> Eigenvector number: 67
Rdmodfacs> Corresponding eigenvalue: 44.02
Rdmodfacs> Eigenvector number: 68
Rdmodfacs> Corresponding eigenvalue: 44.49
Rdmodfacs> Eigenvector number: 69
Rdmodfacs> Corresponding eigenvalue: 45.92
Rdmodfacs> Eigenvector number: 70
Rdmodfacs> Corresponding eigenvalue: 46.31
Rdmodfacs> Eigenvector number: 71
Rdmodfacs> Corresponding eigenvalue: 46.51
Rdmodfacs> Eigenvector number: 72
Rdmodfacs> Corresponding eigenvalue: 47.36
Rdmodfacs> Eigenvector number: 73
Rdmodfacs> Corresponding eigenvalue: 47.89
Rdmodfacs> Eigenvector number: 74
Rdmodfacs> Corresponding eigenvalue: 48.34
Rdmodfacs> Eigenvector number: 75
Rdmodfacs> Corresponding eigenvalue: 50.01
Rdmodfacs> Eigenvector number: 76
Rdmodfacs> Corresponding eigenvalue: 50.18
Rdmodfacs> Eigenvector number: 77
Rdmodfacs> Corresponding eigenvalue: 50.73
Rdmodfacs> Eigenvector number: 78
Rdmodfacs> Corresponding eigenvalue: 50.75
Rdmodfacs> Eigenvector number: 79
Rdmodfacs> Corresponding eigenvalue: 51.43
Rdmodfacs> Eigenvector number: 80
Rdmodfacs> Corresponding eigenvalue: 51.85
Rdmodfacs> Eigenvector number: 81
Rdmodfacs> Corresponding eigenvalue: 52.19
Rdmodfacs> Eigenvector number: 82
Rdmodfacs> Corresponding eigenvalue: 53.10
Rdmodfacs> Eigenvector number: 83
Rdmodfacs> Corresponding eigenvalue: 53.75
Rdmodfacs> Eigenvector number: 84
Rdmodfacs> Corresponding eigenvalue: 54.23
Rdmodfacs> Eigenvector number: 85
Rdmodfacs> Corresponding eigenvalue: 54.89
Rdmodfacs> Eigenvector number: 86
Rdmodfacs> Corresponding eigenvalue: 55.51
Rdmodfacs> Eigenvector number: 87
Rdmodfacs> Corresponding eigenvalue: 55.65
Rdmodfacs> Eigenvector number: 88
Rdmodfacs> Corresponding eigenvalue: 56.84
Rdmodfacs> Eigenvector number: 89
Rdmodfacs> Corresponding eigenvalue: 57.48
Rdmodfacs> Eigenvector number: 90
Rdmodfacs> Corresponding eigenvalue: 58.01
Rdmodfacs> Eigenvector number: 91
Rdmodfacs> Corresponding eigenvalue: 58.13
Rdmodfacs> Eigenvector number: 92
Rdmodfacs> Corresponding eigenvalue: 58.79
Rdmodfacs> Eigenvector number: 93
Rdmodfacs> Corresponding eigenvalue: 59.41
Rdmodfacs> Eigenvector number: 94
Rdmodfacs> Corresponding eigenvalue: 60.08
Rdmodfacs> Eigenvector number: 95
Rdmodfacs> Corresponding eigenvalue: 60.61
Rdmodfacs> Eigenvector number: 96
Rdmodfacs> Corresponding eigenvalue: 61.55
Rdmodfacs> Eigenvector number: 97
Rdmodfacs> Corresponding eigenvalue: 61.75
Rdmodfacs> Eigenvector number: 98
Rdmodfacs> Corresponding eigenvalue: 62.94
Rdmodfacs> Eigenvector number: 99
Rdmodfacs> Corresponding eigenvalue: 63.40
Rdmodfacs> Eigenvector number: 100
Rdmodfacs> Corresponding eigenvalue: 63.84
Rdmodfacs> Eigenvector number: 101
Rdmodfacs> Corresponding eigenvalue: 64.31
Rdmodfacs> Eigenvector number: 102
Rdmodfacs> Corresponding eigenvalue: 64.53
Rdmodfacs> Eigenvector number: 103
Rdmodfacs> Corresponding eigenvalue: 64.94
Rdmodfacs> Eigenvector number: 104
Rdmodfacs> Corresponding eigenvalue: 65.27
Rdmodfacs> Eigenvector number: 105
Rdmodfacs> Corresponding eigenvalue: 65.79
Rdmodfacs> Eigenvector number: 106
Rdmodfacs> Corresponding eigenvalue: 66.57
Rtb_to_modes> 106 vectors, with 1116 coordinates in vector file.
Norm of eigenvectors in projected coordinates (one expected):
1.00000 1.00000 0.99999 1.00000 1.00001
1.00001 0.99999 0.99999 1.00001 0.99999
0.99999 0.99999 1.00000 1.00002 1.00000
1.00001 0.99999 1.00000 1.00002 1.00000
0.99996 0.99999 1.00000 0.99999 0.99997
1.00000 0.99998 0.99999 1.00002 1.00001
1.00003 0.99998 1.00000 1.00000 0.99999
0.99998 1.00001 1.00002 1.00000 1.00002
0.99997 0.99998 1.00001 1.00000 0.99999
1.00002 1.00001 1.00000 1.00001 0.99997
1.00001 1.00000 1.00001 1.00000 1.00003
1.00002 1.00000 0.99999 0.99999 1.00000
1.00002 1.00004 1.00000 1.00000 0.99998
1.00000 1.00000 1.00000 1.00000 1.00000
1.00000 1.00001 0.99998 0.99999 1.00000
0.99999 0.99997 1.00001 1.00000 0.99998
1.00000 0.99998 1.00001 1.00001 1.00000
1.00000 0.99998 1.00001 1.00002 0.99998
0.99999 0.99999 1.00000 1.00000 1.00002
1.00001 1.00000 1.00000 0.99998 0.99999
1.00001 0.99997 1.00000 1.00000 0.99999
1.00002
Rtb_to_modes> RTB block-file is being read.
Rtb_to_modes> 52830 lines found in RTB file.
Norm of eigenvectors in cartesian coordinates (one expected):
1.00000 1.00000 0.99999 1.00000 1.00001
1.00001 0.99999 0.99999 1.00001 0.99999
0.99999 0.99999 1.00000 1.00002 1.00000
1.00001 0.99999 1.00000 1.00002 1.00000
0.99996 0.99999 1.00000 0.99999 0.99997
1.00000 0.99998 0.99999 1.00002 1.00001
1.00003 0.99998 1.00000 1.00000 0.99999
0.99998 1.00001 1.00002 1.00000 1.00002
0.99997 0.99998 1.00001 1.00000 0.99999
1.00002 1.00001 1.00000 1.00001 0.99997
1.00001 1.00000 1.00001 1.00000 1.00003
1.00002 1.00000 0.99999 0.99999 1.00000
1.00002 1.00004 1.00000 1.00000 0.99998
1.00000 1.00000 1.00000 1.00000 1.00000
1.00000 1.00001 0.99998 0.99999 1.00000
0.99999 0.99997 1.00001 1.00000 0.99998
1.00000 0.99998 1.00001 1.00001 1.00000
1.00000 0.99998 1.00001 1.00002 0.99998
0.99999 0.99999 1.00000 1.00000 1.00002
1.00001 1.00000 1.00000 0.99998 0.99999
1.00001 0.99997 1.00000 1.00000 0.99999
1.00002
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> 2608061544393157910.eigenfacs
Openam> file on opening on unit 10:
2608061544393157910.eigenfacs
Getnam> Corresponding pdb filename ?
Getnam> 2608061544393157910.atom
Openam> file on opening on unit 11:
2608061544393157910.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 = 371
First residue number = 5
Last residue number = 124
Number of atoms found = 2935
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: 9.9820E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 2
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9924E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 3
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9956E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 4
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9971E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 5
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9975E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 6
Rdmodfacs> Valeur propre du vecteur en lecture: 1.0001E-09
Rdmodfacs> Numero du vecteur CERFACS en lecture: 7
Rdmodfacs> Valeur propre du vecteur en lecture: 0.6898
Rdmodfacs> Numero du vecteur CERFACS en lecture: 8
Rdmodfacs> Valeur propre du vecteur en lecture: 0.8341
Rdmodfacs> Numero du vecteur CERFACS en lecture: 9
Rdmodfacs> Valeur propre du vecteur en lecture: 1.365
Rdmodfacs> Numero du vecteur CERFACS en lecture: 10
Rdmodfacs> Valeur propre du vecteur en lecture: 2.464
Rdmodfacs> Numero du vecteur CERFACS en lecture: 11
Rdmodfacs> Valeur propre du vecteur en lecture: 3.225
Rdmodfacs> Numero du vecteur CERFACS en lecture: 12
Rdmodfacs> Valeur propre du vecteur en lecture: 3.596
Rdmodfacs> Numero du vecteur CERFACS en lecture: 13
Rdmodfacs> Valeur propre du vecteur en lecture: 5.264
Rdmodfacs> Numero du vecteur CERFACS en lecture: 14
Rdmodfacs> Valeur propre du vecteur en lecture: 5.547
Rdmodfacs> Numero du vecteur CERFACS en lecture: 15
Rdmodfacs> Valeur propre du vecteur en lecture: 7.141
Rdmodfacs> Numero du vecteur CERFACS en lecture: 16
Rdmodfacs> Valeur propre du vecteur en lecture: 8.206
Rdmodfacs> Numero du vecteur CERFACS en lecture: 17
Rdmodfacs> Valeur propre du vecteur en lecture: 8.768
Rdmodfacs> Numero du vecteur CERFACS en lecture: 18
Rdmodfacs> Valeur propre du vecteur en lecture: 9.478
Rdmodfacs> Numero du vecteur CERFACS en lecture: 19
Rdmodfacs> Valeur propre du vecteur en lecture: 10.14
Rdmodfacs> Numero du vecteur CERFACS en lecture: 20
Rdmodfacs> Valeur propre du vecteur en lecture: 10.89
Rdmodfacs> Numero du vecteur CERFACS en lecture: 21
Rdmodfacs> Valeur propre du vecteur en lecture: 12.00
Rdmodfacs> Numero du vecteur CERFACS en lecture: 22
Rdmodfacs> Valeur propre du vecteur en lecture: 12.73
Rdmodfacs> Numero du vecteur CERFACS en lecture: 23
Rdmodfacs> Valeur propre du vecteur en lecture: 14.36
Rdmodfacs> Numero du vecteur CERFACS en lecture: 24
Rdmodfacs> Valeur propre du vecteur en lecture: 15.18
Rdmodfacs> Numero du vecteur CERFACS en lecture: 25
Rdmodfacs> Valeur propre du vecteur en lecture: 16.04
Rdmodfacs> Numero du vecteur CERFACS en lecture: 26
Rdmodfacs> Valeur propre du vecteur en lecture: 16.53
Rdmodfacs> Numero du vecteur CERFACS en lecture: 27
Rdmodfacs> Valeur propre du vecteur en lecture: 17.52
Rdmodfacs> Numero du vecteur CERFACS en lecture: 28
Rdmodfacs> Valeur propre du vecteur en lecture: 18.13
Rdmodfacs> Numero du vecteur CERFACS en lecture: 29
Rdmodfacs> Valeur propre du vecteur en lecture: 18.87
Rdmodfacs> Numero du vecteur CERFACS en lecture: 30
Rdmodfacs> Valeur propre du vecteur en lecture: 20.05
Rdmodfacs> Numero du vecteur CERFACS en lecture: 31
Rdmodfacs> Valeur propre du vecteur en lecture: 20.72
Rdmodfacs> Numero du vecteur CERFACS en lecture: 32
Rdmodfacs> Valeur propre du vecteur en lecture: 22.18
Rdmodfacs> Numero du vecteur CERFACS en lecture: 33
Rdmodfacs> Valeur propre du vecteur en lecture: 22.75
Rdmodfacs> Numero du vecteur CERFACS en lecture: 34
Rdmodfacs> Valeur propre du vecteur en lecture: 23.18
Rdmodfacs> Numero du vecteur CERFACS en lecture: 35
Rdmodfacs> Valeur propre du vecteur en lecture: 23.91
Rdmodfacs> Numero du vecteur CERFACS en lecture: 36
Rdmodfacs> Valeur propre du vecteur en lecture: 24.50
Rdmodfacs> Numero du vecteur CERFACS en lecture: 37
Rdmodfacs> Valeur propre du vecteur en lecture: 25.13
Rdmodfacs> Numero du vecteur CERFACS en lecture: 38
Rdmodfacs> Valeur propre du vecteur en lecture: 25.81
Rdmodfacs> Numero du vecteur CERFACS en lecture: 39
Rdmodfacs> Valeur propre du vecteur en lecture: 27.38
Rdmodfacs> Numero du vecteur CERFACS en lecture: 40
Rdmodfacs> Valeur propre du vecteur en lecture: 28.04
Rdmodfacs> Numero du vecteur CERFACS en lecture: 41
Rdmodfacs> Valeur propre du vecteur en lecture: 28.56
Rdmodfacs> Numero du vecteur CERFACS en lecture: 42
Rdmodfacs> Valeur propre du vecteur en lecture: 28.93
Rdmodfacs> Numero du vecteur CERFACS en lecture: 43
Rdmodfacs> Valeur propre du vecteur en lecture: 29.98
Rdmodfacs> Numero du vecteur CERFACS en lecture: 44
Rdmodfacs> Valeur propre du vecteur en lecture: 30.62
Rdmodfacs> Numero du vecteur CERFACS en lecture: 45
Rdmodfacs> Valeur propre du vecteur en lecture: 31.38
Rdmodfacs> Numero du vecteur CERFACS en lecture: 46
Rdmodfacs> Valeur propre du vecteur en lecture: 31.92
Rdmodfacs> Numero du vecteur CERFACS en lecture: 47
Rdmodfacs> Valeur propre du vecteur en lecture: 32.19
Rdmodfacs> Numero du vecteur CERFACS en lecture: 48
Rdmodfacs> Valeur propre du vecteur en lecture: 33.09
Rdmodfacs> Numero du vecteur CERFACS en lecture: 49
Rdmodfacs> Valeur propre du vecteur en lecture: 34.25
Rdmodfacs> Numero du vecteur CERFACS en lecture: 50
Rdmodfacs> Valeur propre du vecteur en lecture: 34.33
Rdmodfacs> Numero du vecteur CERFACS en lecture: 51
Rdmodfacs> Valeur propre du vecteur en lecture: 34.59
Rdmodfacs> Numero du vecteur CERFACS en lecture: 52
Rdmodfacs> Valeur propre du vecteur en lecture: 35.67
Rdmodfacs> Numero du vecteur CERFACS en lecture: 53
Rdmodfacs> Valeur propre du vecteur en lecture: 36.22
Rdmodfacs> Numero du vecteur CERFACS en lecture: 54
Rdmodfacs> Valeur propre du vecteur en lecture: 37.25
Rdmodfacs> Numero du vecteur CERFACS en lecture: 55
Rdmodfacs> Valeur propre du vecteur en lecture: 37.42
Rdmodfacs> Numero du vecteur CERFACS en lecture: 56
Rdmodfacs> Valeur propre du vecteur en lecture: 37.97
Rdmodfacs> Numero du vecteur CERFACS en lecture: 57
Rdmodfacs> Valeur propre du vecteur en lecture: 38.22
Rdmodfacs> Numero du vecteur CERFACS en lecture: 58
Rdmodfacs> Valeur propre du vecteur en lecture: 39.02
Rdmodfacs> Numero du vecteur CERFACS en lecture: 59
Rdmodfacs> Valeur propre du vecteur en lecture: 39.52
Rdmodfacs> Numero du vecteur CERFACS en lecture: 60
Rdmodfacs> Valeur propre du vecteur en lecture: 39.97
Rdmodfacs> Numero du vecteur CERFACS en lecture: 61
Rdmodfacs> Valeur propre du vecteur en lecture: 40.21
Rdmodfacs> Numero du vecteur CERFACS en lecture: 62
Rdmodfacs> Valeur propre du vecteur en lecture: 40.56
Rdmodfacs> Numero du vecteur CERFACS en lecture: 63
Rdmodfacs> Valeur propre du vecteur en lecture: 41.63
Rdmodfacs> Numero du vecteur CERFACS en lecture: 64
Rdmodfacs> Valeur propre du vecteur en lecture: 42.24
Rdmodfacs> Numero du vecteur CERFACS en lecture: 65
Rdmodfacs> Valeur propre du vecteur en lecture: 42.33
Rdmodfacs> Numero du vecteur CERFACS en lecture: 66
Rdmodfacs> Valeur propre du vecteur en lecture: 42.90
Rdmodfacs> Numero du vecteur CERFACS en lecture: 67
Rdmodfacs> Valeur propre du vecteur en lecture: 44.02
Rdmodfacs> Numero du vecteur CERFACS en lecture: 68
Rdmodfacs> Valeur propre du vecteur en lecture: 44.49
Rdmodfacs> Numero du vecteur CERFACS en lecture: 69
Rdmodfacs> Valeur propre du vecteur en lecture: 45.92
Rdmodfacs> Numero du vecteur CERFACS en lecture: 70
Rdmodfacs> Valeur propre du vecteur en lecture: 46.31
Rdmodfacs> Numero du vecteur CERFACS en lecture: 71
Rdmodfacs> Valeur propre du vecteur en lecture: 46.51
Rdmodfacs> Numero du vecteur CERFACS en lecture: 72
Rdmodfacs> Valeur propre du vecteur en lecture: 47.36
Rdmodfacs> Numero du vecteur CERFACS en lecture: 73
Rdmodfacs> Valeur propre du vecteur en lecture: 47.89
Rdmodfacs> Numero du vecteur CERFACS en lecture: 74
Rdmodfacs> Valeur propre du vecteur en lecture: 48.34
Rdmodfacs> Numero du vecteur CERFACS en lecture: 75
Rdmodfacs> Valeur propre du vecteur en lecture: 50.01
Rdmodfacs> Numero du vecteur CERFACS en lecture: 76
Rdmodfacs> Valeur propre du vecteur en lecture: 50.18
Rdmodfacs> Numero du vecteur CERFACS en lecture: 77
Rdmodfacs> Valeur propre du vecteur en lecture: 50.73
Rdmodfacs> Numero du vecteur CERFACS en lecture: 78
Rdmodfacs> Valeur propre du vecteur en lecture: 50.75
Rdmodfacs> Numero du vecteur CERFACS en lecture: 79
Rdmodfacs> Valeur propre du vecteur en lecture: 51.43
Rdmodfacs> Numero du vecteur CERFACS en lecture: 80
Rdmodfacs> Valeur propre du vecteur en lecture: 51.85
Rdmodfacs> Numero du vecteur CERFACS en lecture: 81
Rdmodfacs> Valeur propre du vecteur en lecture: 52.19
Rdmodfacs> Numero du vecteur CERFACS en lecture: 82
Rdmodfacs> Valeur propre du vecteur en lecture: 53.10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 83
Rdmodfacs> Valeur propre du vecteur en lecture: 53.75
Rdmodfacs> Numero du vecteur CERFACS en lecture: 84
Rdmodfacs> Valeur propre du vecteur en lecture: 54.23
Rdmodfacs> Numero du vecteur CERFACS en lecture: 85
Rdmodfacs> Valeur propre du vecteur en lecture: 54.89
Rdmodfacs> Numero du vecteur CERFACS en lecture: 86
Rdmodfacs> Valeur propre du vecteur en lecture: 55.51
Rdmodfacs> Numero du vecteur CERFACS en lecture: 87
Rdmodfacs> Valeur propre du vecteur en lecture: 55.65
Rdmodfacs> Numero du vecteur CERFACS en lecture: 88
Rdmodfacs> Valeur propre du vecteur en lecture: 56.84
Rdmodfacs> Numero du vecteur CERFACS en lecture: 89
Rdmodfacs> Valeur propre du vecteur en lecture: 57.48
Rdmodfacs> Numero du vecteur CERFACS en lecture: 90
Rdmodfacs> Valeur propre du vecteur en lecture: 58.01
Rdmodfacs> Numero du vecteur CERFACS en lecture: 91
Rdmodfacs> Valeur propre du vecteur en lecture: 58.13
Rdmodfacs> Numero du vecteur CERFACS en lecture: 92
Rdmodfacs> Valeur propre du vecteur en lecture: 58.79
Rdmodfacs> Numero du vecteur CERFACS en lecture: 93
Rdmodfacs> Valeur propre du vecteur en lecture: 59.41
Rdmodfacs> Numero du vecteur CERFACS en lecture: 94
Rdmodfacs> Valeur propre du vecteur en lecture: 60.08
Rdmodfacs> Numero du vecteur CERFACS en lecture: 95
Rdmodfacs> Valeur propre du vecteur en lecture: 60.61
Rdmodfacs> Numero du vecteur CERFACS en lecture: 96
Rdmodfacs> Valeur propre du vecteur en lecture: 61.55
Rdmodfacs> Numero du vecteur CERFACS en lecture: 97
Rdmodfacs> Valeur propre du vecteur en lecture: 61.75
Rdmodfacs> Numero du vecteur CERFACS en lecture: 98
Rdmodfacs> Valeur propre du vecteur en lecture: 62.94
Rdmodfacs> Numero du vecteur CERFACS en lecture: 99
Rdmodfacs> Valeur propre du vecteur en lecture: 63.40
Rdmodfacs> Numero du vecteur CERFACS en lecture: 100
Rdmodfacs> Valeur propre du vecteur en lecture: 63.84
Rdmodfacs> Numero du vecteur CERFACS en lecture: 101
Rdmodfacs> Valeur propre du vecteur en lecture: 64.31
Rdmodfacs> Numero du vecteur CERFACS en lecture: 102
Rdmodfacs> Valeur propre du vecteur en lecture: 64.53
Rdmodfacs> Numero du vecteur CERFACS en lecture: 103
Rdmodfacs> Valeur propre du vecteur en lecture: 64.94
Rdmodfacs> Numero du vecteur CERFACS en lecture: 104
Rdmodfacs> Valeur propre du vecteur en lecture: 65.27
Rdmodfacs> Numero du vecteur CERFACS en lecture: 105
Rdmodfacs> Valeur propre du vecteur en lecture: 65.79
Rdmodfacs> Numero du vecteur CERFACS en lecture: 106
Rdmodfacs> Valeur propre du vecteur en lecture: 66.57
Bfactors> 106 vectors, 8805 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 : 0.689800
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= -0.185 for 371 C-alpha atoms.
Bfactors> = 0.038 +/- 0.03
Bfactors> = 0.853 +/- 0.10
Bfactors> Shiftng-fct= 0.814
Bfactors> Scaling-fct= 3.366
Bfactors> Predicted, Scaled and Experimental B-factors are saved.
Bfactors> Normal end.
check_modes
Chkmod> Version 1.00, Bordeaux.
Getnam> Eigenvector filename ?
Getnam> 2608061544393157910.eigenfacs
Openam> file on opening on unit 10:
2608061544393157910.eigenfacs
Rdmodfacs> Old Blzpack file format detected.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 1
Rdmodfacs> Frequence du vecteur en lecture: 3.4307E-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: 3.4331E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 4
Rdmodfacs> Frequence du vecteur en lecture: 3.4333E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 5
Rdmodfacs> Frequence du vecteur en lecture: 3.4334E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 6
Rdmodfacs> Frequence du vecteur en lecture: 3.4340E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 7
Rdmodfacs> Frequence du vecteur en lecture: 90.19
Rdmodfacs> Numero du vecteur CERFACS en lecture: 8
Rdmodfacs> Frequence du vecteur en lecture: 99.17
Rdmodfacs> Numero du vecteur CERFACS en lecture: 9
Rdmodfacs> Frequence du vecteur en lecture: 126.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 10
Rdmodfacs> Frequence du vecteur en lecture: 170.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 11
Rdmodfacs> Frequence du vecteur en lecture: 195.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 12
Rdmodfacs> Frequence du vecteur en lecture: 205.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 13
Rdmodfacs> Frequence du vecteur en lecture: 249.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 14
Rdmodfacs> Frequence du vecteur en lecture: 255.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 15
Rdmodfacs> Frequence du vecteur en lecture: 290.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 16
Rdmodfacs> Frequence du vecteur en lecture: 311.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 17
Rdmodfacs> Frequence du vecteur en lecture: 321.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 18
Rdmodfacs> Frequence du vecteur en lecture: 334.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 19
Rdmodfacs> Frequence du vecteur en lecture: 345.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 20
Rdmodfacs> Frequence du vecteur en lecture: 358.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 21
Rdmodfacs> Frequence du vecteur en lecture: 376.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 22
Rdmodfacs> Frequence du vecteur en lecture: 387.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 23
Rdmodfacs> Frequence du vecteur en lecture: 411.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 24
Rdmodfacs> Frequence du vecteur en lecture: 423.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 25
Rdmodfacs> Frequence du vecteur en lecture: 434.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 26
Rdmodfacs> Frequence du vecteur en lecture: 441.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 27
Rdmodfacs> Frequence du vecteur en lecture: 454.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 28
Rdmodfacs> Frequence du vecteur en lecture: 462.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 29
Rdmodfacs> Frequence du vecteur en lecture: 471.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 30
Rdmodfacs> Frequence du vecteur en lecture: 486.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 31
Rdmodfacs> Frequence du vecteur en lecture: 494.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 32
Rdmodfacs> Frequence du vecteur en lecture: 511.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 33
Rdmodfacs> Frequence du vecteur en lecture: 517.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 34
Rdmodfacs> Frequence du vecteur en lecture: 522.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 35
Rdmodfacs> Frequence du vecteur en lecture: 531.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 36
Rdmodfacs> Frequence du vecteur en lecture: 537.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 37
Rdmodfacs> Frequence du vecteur en lecture: 544.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 38
Rdmodfacs> Frequence du vecteur en lecture: 551.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 39
Rdmodfacs> Frequence du vecteur en lecture: 568.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 40
Rdmodfacs> Frequence du vecteur en lecture: 575.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 41
Rdmodfacs> Frequence du vecteur en lecture: 580.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 42
Rdmodfacs> Frequence du vecteur en lecture: 584.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 43
Rdmodfacs> Frequence du vecteur en lecture: 594.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 44
Rdmodfacs> Frequence du vecteur en lecture: 600.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 45
Rdmodfacs> Frequence du vecteur en lecture: 608.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 46
Rdmodfacs> Frequence du vecteur en lecture: 613.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 47
Rdmodfacs> Frequence du vecteur en lecture: 616.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 48
Rdmodfacs> Frequence du vecteur en lecture: 624.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 49
Rdmodfacs> Frequence du vecteur en lecture: 635.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 50
Rdmodfacs> Frequence du vecteur en lecture: 636.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 51
Rdmodfacs> Frequence du vecteur en lecture: 638.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 52
Rdmodfacs> Frequence du vecteur en lecture: 648.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 53
Rdmodfacs> Frequence du vecteur en lecture: 653.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 54
Rdmodfacs> Frequence du vecteur en lecture: 662.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 55
Rdmodfacs> Frequence du vecteur en lecture: 664.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 56
Rdmodfacs> Frequence du vecteur en lecture: 669.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 57
Rdmodfacs> Frequence du vecteur en lecture: 671.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 58
Rdmodfacs> Frequence du vecteur en lecture: 678.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 59
Rdmodfacs> Frequence du vecteur en lecture: 682.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 60
Rdmodfacs> Frequence du vecteur en lecture: 686.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 61
Rdmodfacs> Frequence du vecteur en lecture: 688.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 62
Rdmodfacs> Frequence du vecteur en lecture: 691.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 63
Rdmodfacs> Frequence du vecteur en lecture: 700.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 64
Rdmodfacs> Frequence du vecteur en lecture: 705.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 65
Rdmodfacs> Frequence du vecteur en lecture: 706.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 66
Rdmodfacs> Frequence du vecteur en lecture: 711.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 67
Rdmodfacs> Frequence du vecteur en lecture: 720.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 68
Rdmodfacs> Frequence du vecteur en lecture: 724.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 69
Rdmodfacs> Frequence du vecteur en lecture: 735.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 70
Rdmodfacs> Frequence du vecteur en lecture: 738.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 71
Rdmodfacs> Frequence du vecteur en lecture: 740.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 72
Rdmodfacs> Frequence du vecteur en lecture: 747.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 73
Rdmodfacs> Frequence du vecteur en lecture: 751.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 74
Rdmodfacs> Frequence du vecteur en lecture: 755.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 75
Rdmodfacs> Frequence du vecteur en lecture: 767.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 76
Rdmodfacs> Frequence du vecteur en lecture: 769.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 77
Rdmodfacs> Frequence du vecteur en lecture: 773.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 78
Rdmodfacs> Frequence du vecteur en lecture: 773.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 79
Rdmodfacs> Frequence du vecteur en lecture: 778.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 80
Rdmodfacs> Frequence du vecteur en lecture: 781.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 81
Rdmodfacs> Frequence du vecteur en lecture: 784.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 82
Rdmodfacs> Frequence du vecteur en lecture: 791.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 83
Rdmodfacs> Frequence du vecteur en lecture: 796.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 84
Rdmodfacs> Frequence du vecteur en lecture: 799.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 85
Rdmodfacs> Frequence du vecteur en lecture: 804.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 86
Rdmodfacs> Frequence du vecteur en lecture: 809.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 87
Rdmodfacs> Frequence du vecteur en lecture: 810.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 88
Rdmodfacs> Frequence du vecteur en lecture: 818.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 89
Rdmodfacs> Frequence du vecteur en lecture: 823.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 90
Rdmodfacs> Frequence du vecteur en lecture: 827.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 91
Rdmodfacs> Frequence du vecteur en lecture: 827.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 92
Rdmodfacs> Frequence du vecteur en lecture: 832.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 93
Rdmodfacs> Frequence du vecteur en lecture: 837.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 94
Rdmodfacs> Frequence du vecteur en lecture: 841.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 95
Rdmodfacs> Frequence du vecteur en lecture: 845.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 96
Rdmodfacs> Frequence du vecteur en lecture: 851.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 97
Rdmodfacs> Frequence du vecteur en lecture: 853.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 98
Rdmodfacs> Frequence du vecteur en lecture: 861.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 99
Rdmodfacs> Frequence du vecteur en lecture: 864.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 100
Rdmodfacs> Frequence du vecteur en lecture: 867.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 101
Rdmodfacs> Frequence du vecteur en lecture: 870.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 102
Rdmodfacs> Frequence du vecteur en lecture: 872.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 103
Rdmodfacs> Frequence du vecteur en lecture: 875.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 104
Rdmodfacs> Frequence du vecteur en lecture: 877.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 105
Rdmodfacs> Frequence du vecteur en lecture: 880.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 106
Rdmodfacs> Frequence du vecteur en lecture: 886.0
Chkmod> 106 vectors, 8805 coordinates in file.
Chkmod> That is: 2935 cartesian points.
Openam> file on opening on unit 11:
Chkmod.res
Chkmod> Collectivity=f(frequency) to be written in this file.
Chkmod> Normal end.
0.0034 0.7014
0.0034 0.9970
0.0034 0.7591
0.0034 0.9024
0.0034 0.7144
0.0034 0.7437
90.1858 0.6161
99.1712 0.6657
126.8653 0.5955
170.4500 0.5333
195.0031 0.6076
205.9143 0.6523
249.1349 0.6260
255.7442 0.4344
290.1724 0.6746
311.0587 0.6157
321.5340 0.5061
334.2989 0.4353
345.7766 0.3853
358.3361 0.4287
376.1554 0.4072
387.4279 0.4588
411.4849 0.2448
423.0703 0.3179
434.8894 0.3146
441.4821 0.2308
454.5103 0.2774
462.3550 0.2962
471.6964 0.4815
486.2211 0.4398
494.2783 0.3271
511.3961 0.2833
517.9256 0.4157
522.7973 0.2212
530.9656 0.2283
537.4767 0.4168
544.3433 0.5452
551.6589 0.3056
568.1897 0.4902
574.9971 0.4748
580.3042 0.2228
584.0511 0.1760
594.5556 0.3956
600.8682 0.3385
608.2794 0.5329
613.4908 0.4382
616.0800 0.3893
624.6331 0.4087
635.4874 0.2708
636.2291 0.2815
638.6338 0.3000
648.5272 0.3357
653.5079 0.2902
662.7348 0.1168
664.2454 0.3709
669.1091 0.4956
671.3082 0.3604
678.2976 0.3217
682.6296 0.1931
686.5050 0.1817
688.5630 0.2833
691.5532 0.3371
700.6157 0.4087
705.7300 0.3802
706.4815 0.5319
711.2222 0.4142
720.4464 0.3820
724.2822 0.4213
735.8301 0.3782
738.9483 0.4659
740.5422 0.3322
747.2785 0.2413
751.4482 0.3233
754.9705 0.3838
767.9007 0.4262
769.2048 0.3424
773.4087 0.3123
773.5612 0.3113
778.7264 0.4953
781.8996 0.5296
784.4591 0.3951
791.2685 0.2619
796.0968 0.4307
799.6436 0.3671
804.4948 0.5588
809.0256 0.3281
810.0451 0.3052
818.6602 0.4053
823.2562 0.5065
827.0430 0.3308
827.8979 0.4450
832.5846 0.3234
836.9633 0.3526
841.6695 0.4223
845.3738 0.3874
851.9040 0.3365
853.2870 0.4037
861.4697 0.4769
864.6120 0.4302
867.6071 0.5118
870.7949 0.3753
872.2831 0.3811
875.0498 0.4734
877.2703 0.4686
880.7580 0.4227
885.9637 0.3747
getting mode 7
running: ../../bin/get_modes.sh 2608061544393157910 7 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 7
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.7.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.7.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.7.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 8
running: ../../bin/get_modes.sh 2608061544393157910 8 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 8
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.8.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.8.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.8.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 9
running: ../../bin/get_modes.sh 2608061544393157910 9 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 9
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.9.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.9.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.9.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 10
running: ../../bin/get_modes.sh 2608061544393157910 10 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 10
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.10.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.10.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.10.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 11
running: ../../bin/get_modes.sh 2608061544393157910 11 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 11
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.11.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.11.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.11.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 12
running: ../../bin/get_modes.sh 2608061544393157910 12 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 12
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.12.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.12.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.12.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 13
running: ../../bin/get_modes.sh 2608061544393157910 13 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 13
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.13.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.13.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.13.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 14
running: ../../bin/get_modes.sh 2608061544393157910 14 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 14
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.14.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.14.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.14.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 15
running: ../../bin/get_modes.sh 2608061544393157910 15 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 15
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.15.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.15.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.15.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 16
running: ../../bin/get_modes.sh 2608061544393157910 16 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 16
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.16.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.16.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.16.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 17
running: ../../bin/get_modes.sh 2608061544393157910 17 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 17
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.17.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.17.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.17.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 18
running: ../../bin/get_modes.sh 2608061544393157910 18 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 18
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.18.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.18.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.18.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 19
running: ../../bin/get_modes.sh 2608061544393157910 19 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 19
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.19.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.19.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.19.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 20
running: ../../bin/get_modes.sh 2608061544393157910 20 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 20
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.20.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.20.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.20.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 21
running: ../../bin/get_modes.sh 2608061544393157910 21 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 21
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.21.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.21.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.21.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 22
running: ../../bin/get_modes.sh 2608061544393157910 22 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 22
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.22.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.22.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.22.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 23
running: ../../bin/get_modes.sh 2608061544393157910 23 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 23
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.23.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.23.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.23.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 24
running: ../../bin/get_modes.sh 2608061544393157910 24 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 24
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.24.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.24.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.24.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 25
running: ../../bin/get_modes.sh 2608061544393157910 25 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 25
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.25.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.25.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.25.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 26
running: ../../bin/get_modes.sh 2608061544393157910 26 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 26
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.26.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.26.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.26.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 27
running: ../../bin/get_modes.sh 2608061544393157910 27 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 27
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.27.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.27.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.27.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 28
running: ../../bin/get_modes.sh 2608061544393157910 28 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 28
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.28.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.28.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.28.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 29
running: ../../bin/get_modes.sh 2608061544393157910 29 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 29
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.29.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.29.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.29.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 30
running: ../../bin/get_modes.sh 2608061544393157910 30 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 30
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.30.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.30.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.30.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 31
running: ../../bin/get_modes.sh 2608061544393157910 31 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 31
calculating perturbed structure for DQ=-100
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=-20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=0
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=20
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=40
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=60
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=80
2608061544393157910.eigenfacs
2608061544393157910.atom
calculating perturbed structure for DQ=100
2608061544393157910.eigenfacs
2608061544393157910.atom
making animated gifs
11 models are in 2608061544393157910.31.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.31.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 2608061544393157910.31.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
2608061544393157910.10.pdb
2608061544393157910.11.pdb
2608061544393157910.12.pdb
2608061544393157910.13.pdb
2608061544393157910.14.pdb
2608061544393157910.15.pdb
2608061544393157910.16.pdb
2608061544393157910.17.pdb
2608061544393157910.18.pdb
2608061544393157910.19.pdb
2608061544393157910.20.pdb
2608061544393157910.21.pdb
2608061544393157910.22.pdb
2608061544393157910.23.pdb
2608061544393157910.24.pdb
2608061544393157910.25.pdb
2608061544393157910.26.pdb
2608061544393157910.27.pdb
2608061544393157910.28.pdb
2608061544393157910.29.pdb
2608061544393157910.30.pdb
2608061544393157910.31.pdb
2608061544393157910.7.pdb
2608061544393157910.8.pdb
2608061544393157910.9.pdb
STDERR:
Note: The following floating-point exceptions are signalling: IEEE_DENORMAL
real 0m33.736s
user 0m33.559s
sys 0m0.150s
rm: cannot remove '2608061544393157910.sdijf': No such file or directory
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elNémo
is maintained by Yves-Henri Sanejouand.
It was developed
by Karsten Suhre.
Between 2003 and 2014, it was hosted by IGS (Marseille).
Between 2015 and 2025, it was hosted by US2B (Nantes).
Last modification: april 24th, 2026.
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