***  sec_alpha_ABC  ***
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 = 2607192210472627078.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 2607192210472627078.atom to be opened.
Openam> File opened: 2607192210472627078.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 = 612
First residue number = 1
Last residue number = 612
Number of atoms found = 9634
Mean number per residue = 15.7
Pdbmat> Coordinate statistics:
= 0.706844 +/- 13.820978 From: -30.885000 To: 43.051000
= 0.619004 +/- 13.789378 From: -44.471000 To: 38.277000
= -2.341424 +/- 19.980981 From: -63.680000 To: 42.593000
Pdbmat> Masses are all set to one.
%Pdbmat-W> residue:'HSD ' is not a well known amino-acid.
%Pdbmat-W> residue:'HSD ' is not a well known amino-acid.
%Pdbmat-W> residue:'HSD ' is not a well known amino-acid.
%Pdbmat-W> 3 residue(s) not known.
Openam> File opened: pdbmat.xyzm
Pdbmat> Coordinates and masses considered are saved.
Openam> File opened: pdbmat.sdijb
Pdbmat> Matrix statistics:
Pdbmat> The matrix is 1.5947 % Filled.
Pdbmat> 6660562 non-zero elements.
Pdbmat> 733757 atom-atom interactions.
Pdbmat> Number per atom= 152.33 +/- 49.80
Maximum number = 246
Minimum number = 17
Pdbmat> Matrix trace = 1.467514E+07
Pdbmat> Larger element = 886.694
Pdbmat> 0 elements larger than +/- 1.0E+10
Pdbmat> Normal end.
automatic determination of NRBL (NRBL = nresidues/200 + 1)
612 non-zero elements, NRBL set to 4
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 = 2607192210472627078.atom
Eigenvector OUTPut file = matrix.eigenrtb
Nb of VECTors required = 106
EigeNVALues chosen = LOWE
Type of SUBStructuring = NONE
Nb of residues per BLOck = 4
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 2607192210472627078.atom to be opened.
Openam> file on opening on unit 11:
2607192210472627078.atom
Blocpdb> Coordinate file in PDB format.
Blocpdb> 9634 atoms picked in pdb file.
Blocpdb> All masses set to unity.
Blocpdb> Coordinate file is rewritten.
Blocpdb> Substructuring:
Blocpdb> 4 residue(s) per block.
Blocpdb> 612 residues.
Blocpdb> 56 atoms in block 1
Block first atom: 1
Blocpdb> 55 atoms in block 2
Block first atom: 57
Blocpdb> 56 atoms in block 3
Block first atom: 112
Blocpdb> 75 atoms in block 4
Block first atom: 168
Blocpdb> 72 atoms in block 5
Block first atom: 243
Blocpdb> 64 atoms in block 6
Block first atom: 315
Blocpdb> 71 atoms in block 7
Block first atom: 379
Blocpdb> 68 atoms in block 8
Block first atom: 450
Blocpdb> 56 atoms in block 9
Block first atom: 518
Blocpdb> 55 atoms in block 10
Block first atom: 574
Blocpdb> 62 atoms in block 11
Block first atom: 629
Blocpdb> 58 atoms in block 12
Block first atom: 691
Blocpdb> 47 atoms in block 13
Block first atom: 749
Blocpdb> 65 atoms in block 14
Block first atom: 796
Blocpdb> 61 atoms in block 15
Block first atom: 861
Blocpdb> 43 atoms in block 16
Block first atom: 922
Blocpdb> 62 atoms in block 17
Block first atom: 965
Blocpdb> 68 atoms in block 18
Block first atom: 1027
Blocpdb> 61 atoms in block 19
Block first atom: 1095
Blocpdb> 67 atoms in block 20
Block first atom: 1156
Blocpdb> 65 atoms in block 21
Block first atom: 1223
Blocpdb> 66 atoms in block 22
Block first atom: 1288
Blocpdb> 59 atoms in block 23
Block first atom: 1354
Blocpdb> 62 atoms in block 24
Block first atom: 1413
Blocpdb> 70 atoms in block 25
Block first atom: 1475
Blocpdb> 48 atoms in block 26
Block first atom: 1545
Blocpdb> 80 atoms in block 27
Block first atom: 1593
Blocpdb> 60 atoms in block 28
Block first atom: 1673
Blocpdb> 75 atoms in block 29
Block first atom: 1733
Blocpdb> 57 atoms in block 30
Block first atom: 1808
Blocpdb> 53 atoms in block 31
Block first atom: 1865
Blocpdb> 73 atoms in block 32
Block first atom: 1918
Blocpdb> 60 atoms in block 33
Block first atom: 1991
Blocpdb> 66 atoms in block 34
Block first atom: 2051
Blocpdb> 60 atoms in block 35
Block first atom: 2117
Blocpdb> 65 atoms in block 36
Block first atom: 2177
Blocpdb> 57 atoms in block 37
Block first atom: 2242
Blocpdb> 76 atoms in block 38
Block first atom: 2299
Blocpdb> 48 atoms in block 39
Block first atom: 2375
Blocpdb> 55 atoms in block 40
Block first atom: 2423
Blocpdb> 70 atoms in block 41
Block first atom: 2478
Blocpdb> 69 atoms in block 42
Block first atom: 2548
Blocpdb> 72 atoms in block 43
Block first atom: 2617
Blocpdb> 58 atoms in block 44
Block first atom: 2689
Blocpdb> 47 atoms in block 45
Block first atom: 2747
Blocpdb> 68 atoms in block 46
Block first atom: 2794
Blocpdb> 62 atoms in block 47
Block first atom: 2862
Blocpdb> 64 atoms in block 48
Block first atom: 2924
Blocpdb> 55 atoms in block 49
Block first atom: 2988
Blocpdb> 58 atoms in block 50
Block first atom: 3043
Blocpdb> 67 atoms in block 51
Block first atom: 3101
Blocpdb> 52 atoms in block 52
Block first atom: 3168
Blocpdb> 53 atoms in block 53
Block first atom: 3220
Blocpdb> 63 atoms in block 54
Block first atom: 3273
Blocpdb> 68 atoms in block 55
Block first atom: 3336
Blocpdb> 69 atoms in block 56
Block first atom: 3404
Blocpdb> 76 atoms in block 57
Block first atom: 3473
Blocpdb> 79 atoms in block 58
Block first atom: 3549
Blocpdb> 78 atoms in block 59
Block first atom: 3628
Blocpdb> 69 atoms in block 60
Block first atom: 3706
Blocpdb> 81 atoms in block 61
Block first atom: 3775
Blocpdb> 45 atoms in block 62
Block first atom: 3856
Blocpdb> 79 atoms in block 63
Block first atom: 3901
Blocpdb> 45 atoms in block 64
Block first atom: 3980
Blocpdb> 73 atoms in block 65
Block first atom: 4025
Blocpdb> 69 atoms in block 66
Block first atom: 4098
Blocpdb> 52 atoms in block 67
Block first atom: 4167
Blocpdb> 67 atoms in block 68
Block first atom: 4219
Blocpdb> 53 atoms in block 69
Block first atom: 4286
Blocpdb> 60 atoms in block 70
Block first atom: 4339
Blocpdb> 65 atoms in block 71
Block first atom: 4399
Blocpdb> 72 atoms in block 72
Block first atom: 4464
Blocpdb> 57 atoms in block 73
Block first atom: 4536
Blocpdb> 57 atoms in block 74
Block first atom: 4593
Blocpdb> 83 atoms in block 75
Block first atom: 4650
Blocpdb> 44 atoms in block 76
Block first atom: 4733
Blocpdb> 75 atoms in block 77
Block first atom: 4777
Blocpdb> 67 atoms in block 78
Block first atom: 4852
Blocpdb> 65 atoms in block 79
Block first atom: 4919
Blocpdb> 74 atoms in block 80
Block first atom: 4984
Blocpdb> 66 atoms in block 81
Block first atom: 5058
Blocpdb> 67 atoms in block 82
Block first atom: 5124
Blocpdb> 65 atoms in block 83
Block first atom: 5191
Blocpdb> 62 atoms in block 84
Block first atom: 5256
Blocpdb> 65 atoms in block 85
Block first atom: 5318
Blocpdb> 57 atoms in block 86
Block first atom: 5383
Blocpdb> 67 atoms in block 87
Block first atom: 5440
Blocpdb> 53 atoms in block 88
Block first atom: 5507
Blocpdb> 78 atoms in block 89
Block first atom: 5560
Blocpdb> 64 atoms in block 90
Block first atom: 5638
Blocpdb> 64 atoms in block 91
Block first atom: 5702
Blocpdb> 52 atoms in block 92
Block first atom: 5766
Blocpdb> 70 atoms in block 93
Block first atom: 5818
Blocpdb> 59 atoms in block 94
Block first atom: 5888
Blocpdb> 64 atoms in block 95
Block first atom: 5947
Blocpdb> 78 atoms in block 96
Block first atom: 6011
Blocpdb> 48 atoms in block 97
Block first atom: 6089
Blocpdb> 60 atoms in block 98
Block first atom: 6137
Blocpdb> 52 atoms in block 99
Block first atom: 6197
Blocpdb> 73 atoms in block 100
Block first atom: 6249
Blocpdb> 63 atoms in block 101
Block first atom: 6322
Blocpdb> 57 atoms in block 102
Block first atom: 6385
Blocpdb> 64 atoms in block 103
Block first atom: 6442
Blocpdb> 65 atoms in block 104
Block first atom: 6506
Blocpdb> 63 atoms in block 105
Block first atom: 6571
Blocpdb> 68 atoms in block 106
Block first atom: 6634
Blocpdb> 67 atoms in block 107
Block first atom: 6702
Blocpdb> 84 atoms in block 108
Block first atom: 6769
Blocpdb> 23 atoms in block 109
Block first atom: 6853
Blocpdb> 68 atoms in block 110
Block first atom: 6876
Blocpdb> 54 atoms in block 111
Block first atom: 6944
Blocpdb> 74 atoms in block 112
Block first atom: 6998
Blocpdb> 58 atoms in block 113
Block first atom: 7072
Blocpdb> 64 atoms in block 114
Block first atom: 7130
Blocpdb> 63 atoms in block 115
Block first atom: 7194
Blocpdb> 69 atoms in block 116
Block first atom: 7257
Blocpdb> 64 atoms in block 117
Block first atom: 7326
Blocpdb> 74 atoms in block 118
Block first atom: 7390
Blocpdb> 73 atoms in block 119
Block first atom: 7464
Blocpdb> 62 atoms in block 120
Block first atom: 7537
Blocpdb> 60 atoms in block 121
Block first atom: 7599
Blocpdb> 58 atoms in block 122
Block first atom: 7659
Blocpdb> 68 atoms in block 123
Block first atom: 7717
Blocpdb> 78 atoms in block 124
Block first atom: 7785
Blocpdb> 70 atoms in block 125
Block first atom: 7863
Blocpdb> 60 atoms in block 126
Block first atom: 7933
Blocpdb> 21 atoms in block 127
Block first atom: 7993
Blocpdb> 66 atoms in block 128
Block first atom: 8014
Blocpdb> 58 atoms in block 129
Block first atom: 8080
Blocpdb> 63 atoms in block 130
Block first atom: 8138
Blocpdb> 63 atoms in block 131
Block first atom: 8201
Blocpdb> 68 atoms in block 132
Block first atom: 8264
Blocpdb> 73 atoms in block 133
Block first atom: 8332
Blocpdb> 71 atoms in block 134
Block first atom: 8405
Blocpdb> 51 atoms in block 135
Block first atom: 8476
Blocpdb> 52 atoms in block 136
Block first atom: 8527
Blocpdb> 41 atoms in block 137
Block first atom: 8579
Blocpdb> 56 atoms in block 138
Block first atom: 8620
Blocpdb> 54 atoms in block 139
Block first atom: 8676
Blocpdb> 60 atoms in block 140
Block first atom: 8730
Blocpdb> 44 atoms in block 141
Block first atom: 8790
Blocpdb> 71 atoms in block 142
Block first atom: 8834
Blocpdb> 59 atoms in block 143
Block first atom: 8905
Blocpdb> 46 atoms in block 144
Block first atom: 8964
Blocpdb> 69 atoms in block 145
Block first atom: 9010
Blocpdb> 71 atoms in block 146
Block first atom: 9079
Blocpdb> 51 atoms in block 147
Block first atom: 9150
Blocpdb> 74 atoms in block 148
Block first atom: 9201
Blocpdb> 66 atoms in block 149
Block first atom: 9275
Blocpdb> 65 atoms in block 150
Block first atom: 9341
Blocpdb> 55 atoms in block 151
Block first atom: 9406
Blocpdb> 50 atoms in block 152
Block first atom: 9461
Blocpdb> 43 atoms in block 153
Block first atom: 9511
Blocpdb> 65 atoms in block 154
Block first atom: 9554
Blocpdb> 16 atoms in block 155
Block first atom: 9618
Blocpdb> 155 blocks.
Blocpdb> At most, 84 atoms in each of them.
Blocpdb> At least, 16 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> 6660717 matrix lines read.
Prepmat> Matrix order = 28902
Prepmat> Matrix trace = 14675140.0000
Prepmat> Last element read: 28902 28902 89.7431
Prepmat> 12091 lines saved.
Prepmat> 10624 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: 9634
RTB> Total mass = 9634.0000
RTB> Number of atoms found in matrix: 9634
RTB> Number of blocks = 155
RTB> Projection begins.
RTB> Projected matrix is being saved.
RTB> Projected matrix trace = 336060.7152
RTB> 50451 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 = 930
Diagstd> Nb of non-zero elements: 50451
Diagstd> Projected matrix trace = 336060.7152
Openam> file on opening on unit 11:
diagrtb_work.eigenfacs
Diagstd> Diagonalization.
Diagstd> 930 eigenvectors are computed.
Diagstd> 106 of them to be saved.
Diagstd> Sum of eigenvalues = 336060.7152
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 0.1088066 0.1512580 0.5047009 0.8275627
1.1998071 1.2853215 1.5777894 1.7343850 1.8310122
2.1444469 2.2510620 3.0617115 4.4389449 4.5751622
5.7920761 6.2068194 6.5387361 6.7334128 6.8619926
7.3249465 7.5003777 8.0355037 8.7779858 8.9424640
9.4616997 10.1434769 10.4159411 11.2477393 12.6959291
13.4413650 13.8672870 14.7651864 14.9202227 15.6744291
16.3813747 18.6671445 19.0689412 19.2028204 19.7678739
21.1575596 21.5695324 22.7632569 23.0209860 23.5499588
24.6279518 25.8367877 26.3127009 26.9800314 27.8346344
28.6944306 29.4485577 30.3120155 31.1175245 31.8858447
32.2068361 33.1351742 34.1295321 34.6025362 35.0159181
35.5483074 37.3098933 38.7355000 39.0398483 40.1265225
41.1166419 42.6646920 42.8180086 43.4452940 44.7422859
45.6331085 47.3650979 47.4259673 48.3864960 49.9393014
50.5372512 51.2961032 52.8096084 53.3934274 54.7765060
55.4079459 56.8670491 57.1924259 57.7476025 59.3307996
59.9823046 61.1464994 61.9243122 63.5782275 63.7555081
64.3701113 64.7625791 66.7669890 67.3697154 67.8838433
68.2058865 68.9449346 69.4538369 71.3603466 71.9915184
73.3013043
Diagstd> Frequencies (cm-1, if the input matrix is a hessian in CHARMM units):
0.0034292 0.0034316 0.0034330 0.0034330 0.0034337
0.0034339 35.8197741 42.2332517 77.1458026 98.7860756
118.9463159 123.1122219 136.4017027 143.0105342 146.9402913
159.0204304 162.9254807 190.0104190 228.7890082 232.2728922
261.3439248 270.5389721 277.6784559 281.7817752 284.4594744
293.8985937 297.3971803 307.8235440 321.7308575 324.7310979
334.0256831 345.8507345 350.4649081 364.1899035 386.9256530
398.1227243 404.3812697 417.2676800 419.4526411 429.9234615
439.5117117 469.1743105 474.1967464 475.8584554 482.8088936
499.4914596 504.3309782 518.0986735 521.0234148 526.9754164
538.9015442 551.9688113 557.0292421 564.0485741 572.9121613
581.6933326 589.2875895 597.8643914 605.7561053 613.1888419
616.2675663 625.0861976 634.3960163 638.7769642 642.5812358
647.4477765 663.2958552 675.8492925 678.4992012 687.8774021
696.3123518 709.2993921 710.5726911 715.7587250 726.3640889
733.5594343 747.3507934 747.8308534 755.3658853 767.3906644
771.9711821 777.7454295 789.1358139 793.4858382 803.6971783
808.3162420 818.8901109 821.2294956 825.2057765 836.4411315
841.0210273 849.1434811 854.5271706 865.8636111 867.0699513
871.2392055 873.8911637 887.3116340 891.3076553 894.7021713
896.8219089 901.6675961 904.9892108 917.3261111 921.3739873
929.7177694
Diagstd> Normal end.
Rtb_to_modes> Entering in.
Rtb_to_modes> Number of atoms in temporary block-file = 9634
Rtb_to_modes> Number of blocs = 155
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: 9.9725E-10
Rdmodfacs> Eigenvector number: 2
Rdmodfacs> Corresponding eigenvalue: 9.9862E-10
Rdmodfacs> Eigenvector number: 3
Rdmodfacs> Corresponding eigenvalue: 9.9941E-10
Rdmodfacs> Eigenvector number: 4
Rdmodfacs> Corresponding eigenvalue: 9.9943E-10
Rdmodfacs> Eigenvector number: 5
Rdmodfacs> Corresponding eigenvalue: 9.9983E-10
Rdmodfacs> Eigenvector number: 6
Rdmodfacs> Corresponding eigenvalue: 9.9995E-10
Rdmodfacs> Eigenvector number: 7
Rdmodfacs> Corresponding eigenvalue: 0.1088
Rdmodfacs> Eigenvector number: 8
Rdmodfacs> Corresponding eigenvalue: 0.1513
Rdmodfacs> Eigenvector number: 9
Rdmodfacs> Corresponding eigenvalue: 0.5047
Rdmodfacs> Eigenvector number: 10
Rdmodfacs> Corresponding eigenvalue: 0.8276
Rdmodfacs> Eigenvector number: 11
Rdmodfacs> Corresponding eigenvalue: 1.200
Rdmodfacs> Eigenvector number: 12
Rdmodfacs> Corresponding eigenvalue: 1.285
Rdmodfacs> Eigenvector number: 13
Rdmodfacs> Corresponding eigenvalue: 1.578
Rdmodfacs> Eigenvector number: 14
Rdmodfacs> Corresponding eigenvalue: 1.734
Rdmodfacs> Eigenvector number: 15
Rdmodfacs> Corresponding eigenvalue: 1.831
Rdmodfacs> Eigenvector number: 16
Rdmodfacs> Corresponding eigenvalue: 2.144
Rdmodfacs> Eigenvector number: 17
Rdmodfacs> Corresponding eigenvalue: 2.251
Rdmodfacs> Eigenvector number: 18
Rdmodfacs> Corresponding eigenvalue: 3.062
Rdmodfacs> Eigenvector number: 19
Rdmodfacs> Corresponding eigenvalue: 4.439
Rdmodfacs> Eigenvector number: 20
Rdmodfacs> Corresponding eigenvalue: 4.575
Rdmodfacs> Eigenvector number: 21
Rdmodfacs> Corresponding eigenvalue: 5.792
Rdmodfacs> Eigenvector number: 22
Rdmodfacs> Corresponding eigenvalue: 6.207
Rdmodfacs> Eigenvector number: 23
Rdmodfacs> Corresponding eigenvalue: 6.539
Rdmodfacs> Eigenvector number: 24
Rdmodfacs> Corresponding eigenvalue: 6.733
Rdmodfacs> Eigenvector number: 25
Rdmodfacs> Corresponding eigenvalue: 6.862
Rdmodfacs> Eigenvector number: 26
Rdmodfacs> Corresponding eigenvalue: 7.325
Rdmodfacs> Eigenvector number: 27
Rdmodfacs> Corresponding eigenvalue: 7.500
Rdmodfacs> Eigenvector number: 28
Rdmodfacs> Corresponding eigenvalue: 8.036
Rdmodfacs> Eigenvector number: 29
Rdmodfacs> Corresponding eigenvalue: 8.778
Rdmodfacs> Eigenvector number: 30
Rdmodfacs> Corresponding eigenvalue: 8.942
Rdmodfacs> Eigenvector number: 31
Rdmodfacs> Corresponding eigenvalue: 9.462
Rdmodfacs> Eigenvector number: 32
Rdmodfacs> Corresponding eigenvalue: 10.14
Rdmodfacs> Eigenvector number: 33
Rdmodfacs> Corresponding eigenvalue: 10.42
Rdmodfacs> Eigenvector number: 34
Rdmodfacs> Corresponding eigenvalue: 11.25
Rdmodfacs> Eigenvector number: 35
Rdmodfacs> Corresponding eigenvalue: 12.70
Rdmodfacs> Eigenvector number: 36
Rdmodfacs> Corresponding eigenvalue: 13.44
Rdmodfacs> Eigenvector number: 37
Rdmodfacs> Corresponding eigenvalue: 13.87
Rdmodfacs> Eigenvector number: 38
Rdmodfacs> Corresponding eigenvalue: 14.77
Rdmodfacs> Eigenvector number: 39
Rdmodfacs> Corresponding eigenvalue: 14.92
Rdmodfacs> Eigenvector number: 40
Rdmodfacs> Corresponding eigenvalue: 15.67
Rdmodfacs> Eigenvector number: 41
Rdmodfacs> Corresponding eigenvalue: 16.38
Rdmodfacs> Eigenvector number: 42
Rdmodfacs> Corresponding eigenvalue: 18.67
Rdmodfacs> Eigenvector number: 43
Rdmodfacs> Corresponding eigenvalue: 19.07
Rdmodfacs> Eigenvector number: 44
Rdmodfacs> Corresponding eigenvalue: 19.20
Rdmodfacs> Eigenvector number: 45
Rdmodfacs> Corresponding eigenvalue: 19.77
Rdmodfacs> Eigenvector number: 46
Rdmodfacs> Corresponding eigenvalue: 21.16
Rdmodfacs> Eigenvector number: 47
Rdmodfacs> Corresponding eigenvalue: 21.57
Rdmodfacs> Eigenvector number: 48
Rdmodfacs> Corresponding eigenvalue: 22.76
Rdmodfacs> Eigenvector number: 49
Rdmodfacs> Corresponding eigenvalue: 23.02
Rdmodfacs> Eigenvector number: 50
Rdmodfacs> Corresponding eigenvalue: 23.55
Rdmodfacs> Eigenvector number: 51
Rdmodfacs> Corresponding eigenvalue: 24.63
Rdmodfacs> Eigenvector number: 52
Rdmodfacs> Corresponding eigenvalue: 25.84
Rdmodfacs> Eigenvector number: 53
Rdmodfacs> Corresponding eigenvalue: 26.31
Rdmodfacs> Eigenvector number: 54
Rdmodfacs> Corresponding eigenvalue: 26.98
Rdmodfacs> Eigenvector number: 55
Rdmodfacs> Corresponding eigenvalue: 27.83
Rdmodfacs> Eigenvector number: 56
Rdmodfacs> Corresponding eigenvalue: 28.69
Rdmodfacs> Eigenvector number: 57
Rdmodfacs> Corresponding eigenvalue: 29.45
Rdmodfacs> Eigenvector number: 58
Rdmodfacs> Corresponding eigenvalue: 30.31
Rdmodfacs> Eigenvector number: 59
Rdmodfacs> Corresponding eigenvalue: 31.12
Rdmodfacs> Eigenvector number: 60
Rdmodfacs> Corresponding eigenvalue: 31.89
Rdmodfacs> Eigenvector number: 61
Rdmodfacs> Corresponding eigenvalue: 32.21
Rdmodfacs> Eigenvector number: 62
Rdmodfacs> Corresponding eigenvalue: 33.14
Rdmodfacs> Eigenvector number: 63
Rdmodfacs> Corresponding eigenvalue: 34.13
Rdmodfacs> Eigenvector number: 64
Rdmodfacs> Corresponding eigenvalue: 34.60
Rdmodfacs> Eigenvector number: 65
Rdmodfacs> Corresponding eigenvalue: 35.02
Rdmodfacs> Eigenvector number: 66
Rdmodfacs> Corresponding eigenvalue: 35.55
Rdmodfacs> Eigenvector number: 67
Rdmodfacs> Corresponding eigenvalue: 37.31
Rdmodfacs> Eigenvector number: 68
Rdmodfacs> Corresponding eigenvalue: 38.74
Rdmodfacs> Eigenvector number: 69
Rdmodfacs> Corresponding eigenvalue: 39.04
Rdmodfacs> Eigenvector number: 70
Rdmodfacs> Corresponding eigenvalue: 40.13
Rdmodfacs> Eigenvector number: 71
Rdmodfacs> Corresponding eigenvalue: 41.12
Rdmodfacs> Eigenvector number: 72
Rdmodfacs> Corresponding eigenvalue: 42.66
Rdmodfacs> Eigenvector number: 73
Rdmodfacs> Corresponding eigenvalue: 42.82
Rdmodfacs> Eigenvector number: 74
Rdmodfacs> Corresponding eigenvalue: 43.45
Rdmodfacs> Eigenvector number: 75
Rdmodfacs> Corresponding eigenvalue: 44.74
Rdmodfacs> Eigenvector number: 76
Rdmodfacs> Corresponding eigenvalue: 45.63
Rdmodfacs> Eigenvector number: 77
Rdmodfacs> Corresponding eigenvalue: 47.37
Rdmodfacs> Eigenvector number: 78
Rdmodfacs> Corresponding eigenvalue: 47.43
Rdmodfacs> Eigenvector number: 79
Rdmodfacs> Corresponding eigenvalue: 48.39
Rdmodfacs> Eigenvector number: 80
Rdmodfacs> Corresponding eigenvalue: 49.94
Rdmodfacs> Eigenvector number: 81
Rdmodfacs> Corresponding eigenvalue: 50.54
Rdmodfacs> Eigenvector number: 82
Rdmodfacs> Corresponding eigenvalue: 51.30
Rdmodfacs> Eigenvector number: 83
Rdmodfacs> Corresponding eigenvalue: 52.81
Rdmodfacs> Eigenvector number: 84
Rdmodfacs> Corresponding eigenvalue: 53.39
Rdmodfacs> Eigenvector number: 85
Rdmodfacs> Corresponding eigenvalue: 54.78
Rdmodfacs> Eigenvector number: 86
Rdmodfacs> Corresponding eigenvalue: 55.41
Rdmodfacs> Eigenvector number: 87
Rdmodfacs> Corresponding eigenvalue: 56.87
Rdmodfacs> Eigenvector number: 88
Rdmodfacs> Corresponding eigenvalue: 57.19
Rdmodfacs> Eigenvector number: 89
Rdmodfacs> Corresponding eigenvalue: 57.75
Rdmodfacs> Eigenvector number: 90
Rdmodfacs> Corresponding eigenvalue: 59.33
Rdmodfacs> Eigenvector number: 91
Rdmodfacs> Corresponding eigenvalue: 59.98
Rdmodfacs> Eigenvector number: 92
Rdmodfacs> Corresponding eigenvalue: 61.15
Rdmodfacs> Eigenvector number: 93
Rdmodfacs> Corresponding eigenvalue: 61.92
Rdmodfacs> Eigenvector number: 94
Rdmodfacs> Corresponding eigenvalue: 63.58
Rdmodfacs> Eigenvector number: 95
Rdmodfacs> Corresponding eigenvalue: 63.76
Rdmodfacs> Eigenvector number: 96
Rdmodfacs> Corresponding eigenvalue: 64.37
Rdmodfacs> Eigenvector number: 97
Rdmodfacs> Corresponding eigenvalue: 64.76
Rdmodfacs> Eigenvector number: 98
Rdmodfacs> Corresponding eigenvalue: 66.77
Rdmodfacs> Eigenvector number: 99
Rdmodfacs> Corresponding eigenvalue: 67.37
Rdmodfacs> Eigenvector number: 100
Rdmodfacs> Corresponding eigenvalue: 67.88
Rdmodfacs> Eigenvector number: 101
Rdmodfacs> Corresponding eigenvalue: 68.21
Rdmodfacs> Eigenvector number: 102
Rdmodfacs> Corresponding eigenvalue: 68.94
Rdmodfacs> Eigenvector number: 103
Rdmodfacs> Corresponding eigenvalue: 69.45
Rdmodfacs> Eigenvector number: 104
Rdmodfacs> Corresponding eigenvalue: 71.36
Rdmodfacs> Eigenvector number: 105
Rdmodfacs> Corresponding eigenvalue: 71.99
Rdmodfacs> Eigenvector number: 106
Rdmodfacs> Corresponding eigenvalue: 73.30
Rtb_to_modes> 106 vectors, with 930 coordinates in vector file.
Norm of eigenvectors in projected coordinates (one expected):
1.00000 1.00000 0.99998 0.99999 1.00001
1.00000 0.99999 0.99999 1.00002 1.00001
1.00001 0.99993 0.99996 1.00000 0.99996
0.99999 1.00000 0.99997 1.00001 0.99997
1.00000 0.99999 0.99997 0.99998 1.00002
1.00000 1.00002 1.00002 1.00001 1.00003
1.00001 1.00004 0.99997 0.99999 1.00000
0.99998 0.99997 0.99999 0.99997 0.99999
0.99999 1.00003 1.00004 1.00001 1.00000
1.00002 0.99998 1.00000 1.00000 0.99999
1.00002 1.00000 1.00000 1.00000 1.00001
0.99999 1.00001 1.00002 1.00000 1.00001
1.00001 0.99999 1.00001 1.00000 0.99999
1.00001 1.00001 1.00002 0.99999 0.99998
1.00000 1.00000 0.99995 0.99998 0.99999
1.00000 0.99999 0.99999 1.00000 0.99999
1.00000 1.00001 1.00000 0.99999 0.99999
1.00000 1.00000 0.99998 1.00001 1.00003
0.99998 1.00001 0.99999 0.99999 0.99998
0.99999 1.00000 0.99998 1.00000 1.00001
1.00000 1.00002 1.00002 1.00001 1.00000
1.00000
Rtb_to_modes> RTB block-file is being read.
Rtb_to_modes> 173412 lines found in RTB file.
Norm of eigenvectors in cartesian coordinates (one expected):
1.00000 1.00000 0.99998 0.99999 1.00001
1.00000 0.99999 0.99999 1.00002 1.00001
1.00001 0.99993 0.99996 1.00000 0.99996
0.99999 1.00000 0.99997 1.00001 0.99997
1.00000 0.99999 0.99997 0.99998 1.00002
1.00000 1.00002 1.00002 1.00001 1.00003
1.00001 1.00004 0.99997 0.99999 1.00000
0.99998 0.99997 0.99999 0.99997 0.99999
0.99999 1.00003 1.00004 1.00001 1.00000
1.00002 0.99998 1.00000 1.00000 0.99999
1.00002 1.00000 1.00000 1.00000 1.00001
0.99999 1.00001 1.00002 1.00000 1.00001
1.00001 0.99999 1.00001 1.00000 0.99999
1.00001 1.00001 1.00002 0.99999 0.99998
1.00000 1.00000 0.99995 0.99998 0.99999
1.00000 0.99999 0.99999 1.00000 0.99999
1.00000 1.00001 1.00000 0.99999 0.99999
1.00000 1.00000 0.99998 1.00001 1.00003
0.99998 1.00001 0.99999 0.99999 0.99998
0.99999 1.00000 0.99998 1.00000 1.00001
1.00000 1.00002 1.00002 1.00001 1.00000
1.00000
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> 2607192210472627078.eigenfacs
Openam> file on opening on unit 10:
2607192210472627078.eigenfacs
Getnam> Corresponding pdb filename ?
Getnam> 2607192210472627078.atom
Openam> file on opening on unit 11:
2607192210472627078.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 = 612
First residue number = 1
Last residue number = 612
Number of atoms found = 9634
Mean number per residue = 15.7
Rdmodfacs> Old Blzpack file format detected.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 1
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9725E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 2
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9862E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 3
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9941E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 4
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9943E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 5
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9983E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 6
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9995E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 7
Rdmodfacs> Valeur propre du vecteur en lecture: 0.1088
Rdmodfacs> Numero du vecteur CERFACS en lecture: 8
Rdmodfacs> Valeur propre du vecteur en lecture: 0.1513
Rdmodfacs> Numero du vecteur CERFACS en lecture: 9
Rdmodfacs> Valeur propre du vecteur en lecture: 0.5047
Rdmodfacs> Numero du vecteur CERFACS en lecture: 10
Rdmodfacs> Valeur propre du vecteur en lecture: 0.8276
Rdmodfacs> Numero du vecteur CERFACS en lecture: 11
Rdmodfacs> Valeur propre du vecteur en lecture: 1.200
Rdmodfacs> Numero du vecteur CERFACS en lecture: 12
Rdmodfacs> Valeur propre du vecteur en lecture: 1.285
Rdmodfacs> Numero du vecteur CERFACS en lecture: 13
Rdmodfacs> Valeur propre du vecteur en lecture: 1.578
Rdmodfacs> Numero du vecteur CERFACS en lecture: 14
Rdmodfacs> Valeur propre du vecteur en lecture: 1.734
Rdmodfacs> Numero du vecteur CERFACS en lecture: 15
Rdmodfacs> Valeur propre du vecteur en lecture: 1.831
Rdmodfacs> Numero du vecteur CERFACS en lecture: 16
Rdmodfacs> Valeur propre du vecteur en lecture: 2.144
Rdmodfacs> Numero du vecteur CERFACS en lecture: 17
Rdmodfacs> Valeur propre du vecteur en lecture: 2.251
Rdmodfacs> Numero du vecteur CERFACS en lecture: 18
Rdmodfacs> Valeur propre du vecteur en lecture: 3.062
Rdmodfacs> Numero du vecteur CERFACS en lecture: 19
Rdmodfacs> Valeur propre du vecteur en lecture: 4.439
Rdmodfacs> Numero du vecteur CERFACS en lecture: 20
Rdmodfacs> Valeur propre du vecteur en lecture: 4.575
Rdmodfacs> Numero du vecteur CERFACS en lecture: 21
Rdmodfacs> Valeur propre du vecteur en lecture: 5.792
Rdmodfacs> Numero du vecteur CERFACS en lecture: 22
Rdmodfacs> Valeur propre du vecteur en lecture: 6.207
Rdmodfacs> Numero du vecteur CERFACS en lecture: 23
Rdmodfacs> Valeur propre du vecteur en lecture: 6.539
Rdmodfacs> Numero du vecteur CERFACS en lecture: 24
Rdmodfacs> Valeur propre du vecteur en lecture: 6.733
Rdmodfacs> Numero du vecteur CERFACS en lecture: 25
Rdmodfacs> Valeur propre du vecteur en lecture: 6.862
Rdmodfacs> Numero du vecteur CERFACS en lecture: 26
Rdmodfacs> Valeur propre du vecteur en lecture: 7.325
Rdmodfacs> Numero du vecteur CERFACS en lecture: 27
Rdmodfacs> Valeur propre du vecteur en lecture: 7.500
Rdmodfacs> Numero du vecteur CERFACS en lecture: 28
Rdmodfacs> Valeur propre du vecteur en lecture: 8.036
Rdmodfacs> Numero du vecteur CERFACS en lecture: 29
Rdmodfacs> Valeur propre du vecteur en lecture: 8.778
Rdmodfacs> Numero du vecteur CERFACS en lecture: 30
Rdmodfacs> Valeur propre du vecteur en lecture: 8.942
Rdmodfacs> Numero du vecteur CERFACS en lecture: 31
Rdmodfacs> Valeur propre du vecteur en lecture: 9.462
Rdmodfacs> Numero du vecteur CERFACS en lecture: 32
Rdmodfacs> Valeur propre du vecteur en lecture: 10.14
Rdmodfacs> Numero du vecteur CERFACS en lecture: 33
Rdmodfacs> Valeur propre du vecteur en lecture: 10.42
Rdmodfacs> Numero du vecteur CERFACS en lecture: 34
Rdmodfacs> Valeur propre du vecteur en lecture: 11.25
Rdmodfacs> Numero du vecteur CERFACS en lecture: 35
Rdmodfacs> Valeur propre du vecteur en lecture: 12.70
Rdmodfacs> Numero du vecteur CERFACS en lecture: 36
Rdmodfacs> Valeur propre du vecteur en lecture: 13.44
Rdmodfacs> Numero du vecteur CERFACS en lecture: 37
Rdmodfacs> Valeur propre du vecteur en lecture: 13.87
Rdmodfacs> Numero du vecteur CERFACS en lecture: 38
Rdmodfacs> Valeur propre du vecteur en lecture: 14.77
Rdmodfacs> Numero du vecteur CERFACS en lecture: 39
Rdmodfacs> Valeur propre du vecteur en lecture: 14.92
Rdmodfacs> Numero du vecteur CERFACS en lecture: 40
Rdmodfacs> Valeur propre du vecteur en lecture: 15.67
Rdmodfacs> Numero du vecteur CERFACS en lecture: 41
Rdmodfacs> Valeur propre du vecteur en lecture: 16.38
Rdmodfacs> Numero du vecteur CERFACS en lecture: 42
Rdmodfacs> Valeur propre du vecteur en lecture: 18.67
Rdmodfacs> Numero du vecteur CERFACS en lecture: 43
Rdmodfacs> Valeur propre du vecteur en lecture: 19.07
Rdmodfacs> Numero du vecteur CERFACS en lecture: 44
Rdmodfacs> Valeur propre du vecteur en lecture: 19.20
Rdmodfacs> Numero du vecteur CERFACS en lecture: 45
Rdmodfacs> Valeur propre du vecteur en lecture: 19.77
Rdmodfacs> Numero du vecteur CERFACS en lecture: 46
Rdmodfacs> Valeur propre du vecteur en lecture: 21.16
Rdmodfacs> Numero du vecteur CERFACS en lecture: 47
Rdmodfacs> Valeur propre du vecteur en lecture: 21.57
Rdmodfacs> Numero du vecteur CERFACS en lecture: 48
Rdmodfacs> Valeur propre du vecteur en lecture: 22.76
Rdmodfacs> Numero du vecteur CERFACS en lecture: 49
Rdmodfacs> Valeur propre du vecteur en lecture: 23.02
Rdmodfacs> Numero du vecteur CERFACS en lecture: 50
Rdmodfacs> Valeur propre du vecteur en lecture: 23.55
Rdmodfacs> Numero du vecteur CERFACS en lecture: 51
Rdmodfacs> Valeur propre du vecteur en lecture: 24.63
Rdmodfacs> Numero du vecteur CERFACS en lecture: 52
Rdmodfacs> Valeur propre du vecteur en lecture: 25.84
Rdmodfacs> Numero du vecteur CERFACS en lecture: 53
Rdmodfacs> Valeur propre du vecteur en lecture: 26.31
Rdmodfacs> Numero du vecteur CERFACS en lecture: 54
Rdmodfacs> Valeur propre du vecteur en lecture: 26.98
Rdmodfacs> Numero du vecteur CERFACS en lecture: 55
Rdmodfacs> Valeur propre du vecteur en lecture: 27.83
Rdmodfacs> Numero du vecteur CERFACS en lecture: 56
Rdmodfacs> Valeur propre du vecteur en lecture: 28.69
Rdmodfacs> Numero du vecteur CERFACS en lecture: 57
Rdmodfacs> Valeur propre du vecteur en lecture: 29.45
Rdmodfacs> Numero du vecteur CERFACS en lecture: 58
Rdmodfacs> Valeur propre du vecteur en lecture: 30.31
Rdmodfacs> Numero du vecteur CERFACS en lecture: 59
Rdmodfacs> Valeur propre du vecteur en lecture: 31.12
Rdmodfacs> Numero du vecteur CERFACS en lecture: 60
Rdmodfacs> Valeur propre du vecteur en lecture: 31.89
Rdmodfacs> Numero du vecteur CERFACS en lecture: 61
Rdmodfacs> Valeur propre du vecteur en lecture: 32.21
Rdmodfacs> Numero du vecteur CERFACS en lecture: 62
Rdmodfacs> Valeur propre du vecteur en lecture: 33.14
Rdmodfacs> Numero du vecteur CERFACS en lecture: 63
Rdmodfacs> Valeur propre du vecteur en lecture: 34.13
Rdmodfacs> Numero du vecteur CERFACS en lecture: 64
Rdmodfacs> Valeur propre du vecteur en lecture: 34.60
Rdmodfacs> Numero du vecteur CERFACS en lecture: 65
Rdmodfacs> Valeur propre du vecteur en lecture: 35.02
Rdmodfacs> Numero du vecteur CERFACS en lecture: 66
Rdmodfacs> Valeur propre du vecteur en lecture: 35.55
Rdmodfacs> Numero du vecteur CERFACS en lecture: 67
Rdmodfacs> Valeur propre du vecteur en lecture: 37.31
Rdmodfacs> Numero du vecteur CERFACS en lecture: 68
Rdmodfacs> Valeur propre du vecteur en lecture: 38.74
Rdmodfacs> Numero du vecteur CERFACS en lecture: 69
Rdmodfacs> Valeur propre du vecteur en lecture: 39.04
Rdmodfacs> Numero du vecteur CERFACS en lecture: 70
Rdmodfacs> Valeur propre du vecteur en lecture: 40.13
Rdmodfacs> Numero du vecteur CERFACS en lecture: 71
Rdmodfacs> Valeur propre du vecteur en lecture: 41.12
Rdmodfacs> Numero du vecteur CERFACS en lecture: 72
Rdmodfacs> Valeur propre du vecteur en lecture: 42.66
Rdmodfacs> Numero du vecteur CERFACS en lecture: 73
Rdmodfacs> Valeur propre du vecteur en lecture: 42.82
Rdmodfacs> Numero du vecteur CERFACS en lecture: 74
Rdmodfacs> Valeur propre du vecteur en lecture: 43.45
Rdmodfacs> Numero du vecteur CERFACS en lecture: 75
Rdmodfacs> Valeur propre du vecteur en lecture: 44.74
Rdmodfacs> Numero du vecteur CERFACS en lecture: 76
Rdmodfacs> Valeur propre du vecteur en lecture: 45.63
Rdmodfacs> Numero du vecteur CERFACS en lecture: 77
Rdmodfacs> Valeur propre du vecteur en lecture: 47.37
Rdmodfacs> Numero du vecteur CERFACS en lecture: 78
Rdmodfacs> Valeur propre du vecteur en lecture: 47.43
Rdmodfacs> Numero du vecteur CERFACS en lecture: 79
Rdmodfacs> Valeur propre du vecteur en lecture: 48.39
Rdmodfacs> Numero du vecteur CERFACS en lecture: 80
Rdmodfacs> Valeur propre du vecteur en lecture: 49.94
Rdmodfacs> Numero du vecteur CERFACS en lecture: 81
Rdmodfacs> Valeur propre du vecteur en lecture: 50.54
Rdmodfacs> Numero du vecteur CERFACS en lecture: 82
Rdmodfacs> Valeur propre du vecteur en lecture: 51.30
Rdmodfacs> Numero du vecteur CERFACS en lecture: 83
Rdmodfacs> Valeur propre du vecteur en lecture: 52.81
Rdmodfacs> Numero du vecteur CERFACS en lecture: 84
Rdmodfacs> Valeur propre du vecteur en lecture: 53.39
Rdmodfacs> Numero du vecteur CERFACS en lecture: 85
Rdmodfacs> Valeur propre du vecteur en lecture: 54.78
Rdmodfacs> Numero du vecteur CERFACS en lecture: 86
Rdmodfacs> Valeur propre du vecteur en lecture: 55.41
Rdmodfacs> Numero du vecteur CERFACS en lecture: 87
Rdmodfacs> Valeur propre du vecteur en lecture: 56.87
Rdmodfacs> Numero du vecteur CERFACS en lecture: 88
Rdmodfacs> Valeur propre du vecteur en lecture: 57.19
Rdmodfacs> Numero du vecteur CERFACS en lecture: 89
Rdmodfacs> Valeur propre du vecteur en lecture: 57.75
Rdmodfacs> Numero du vecteur CERFACS en lecture: 90
Rdmodfacs> Valeur propre du vecteur en lecture: 59.33
Rdmodfacs> Numero du vecteur CERFACS en lecture: 91
Rdmodfacs> Valeur propre du vecteur en lecture: 59.98
Rdmodfacs> Numero du vecteur CERFACS en lecture: 92
Rdmodfacs> Valeur propre du vecteur en lecture: 61.15
Rdmodfacs> Numero du vecteur CERFACS en lecture: 93
Rdmodfacs> Valeur propre du vecteur en lecture: 61.92
Rdmodfacs> Numero du vecteur CERFACS en lecture: 94
Rdmodfacs> Valeur propre du vecteur en lecture: 63.58
Rdmodfacs> Numero du vecteur CERFACS en lecture: 95
Rdmodfacs> Valeur propre du vecteur en lecture: 63.76
Rdmodfacs> Numero du vecteur CERFACS en lecture: 96
Rdmodfacs> Valeur propre du vecteur en lecture: 64.37
Rdmodfacs> Numero du vecteur CERFACS en lecture: 97
Rdmodfacs> Valeur propre du vecteur en lecture: 64.76
Rdmodfacs> Numero du vecteur CERFACS en lecture: 98
Rdmodfacs> Valeur propre du vecteur en lecture: 66.77
Rdmodfacs> Numero du vecteur CERFACS en lecture: 99
Rdmodfacs> Valeur propre du vecteur en lecture: 67.37
Rdmodfacs> Numero du vecteur CERFACS en lecture: 100
Rdmodfacs> Valeur propre du vecteur en lecture: 67.88
Rdmodfacs> Numero du vecteur CERFACS en lecture: 101
Rdmodfacs> Valeur propre du vecteur en lecture: 68.21
Rdmodfacs> Numero du vecteur CERFACS en lecture: 102
Rdmodfacs> Valeur propre du vecteur en lecture: 68.94
Rdmodfacs> Numero du vecteur CERFACS en lecture: 103
Rdmodfacs> Valeur propre du vecteur en lecture: 69.45
Rdmodfacs> Numero du vecteur CERFACS en lecture: 104
Rdmodfacs> Valeur propre du vecteur en lecture: 71.36
Rdmodfacs> Numero du vecteur CERFACS en lecture: 105
Rdmodfacs> Valeur propre du vecteur en lecture: 71.99
Rdmodfacs> Numero du vecteur CERFACS en lecture: 106
Rdmodfacs> Valeur propre du vecteur en lecture: 73.30
Bfactors> 106 vectors, 28902 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 : 0.108800
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= -0.396 for 612 C-alpha atoms.
Bfactors> = 0.043 +/- 0.23
Bfactors> = 78.859 +/- 13.39
Bfactors> Shiftng-fct= 78.816
Bfactors> Scaling-fct= 58.584
Bfactors> Predicted, Scaled and Experimental B-factors are saved.
Bfactors> Normal end.
check_modes
Chkmod> Version 1.00, Bordeaux.
Getnam> Eigenvector filename ?
Getnam> 2607192210472627078.eigenfacs
Openam> file on opening on unit 10:
2607192210472627078.eigenfacs
Rdmodfacs> Old Blzpack file format detected.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 1
Rdmodfacs> Frequence du vecteur en lecture: 3.4291E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 2
Rdmodfacs> Frequence du vecteur en lecture: 3.4314E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 3
Rdmodfacs> Frequence du vecteur en lecture: 3.4328E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 4
Rdmodfacs> Frequence du vecteur en lecture: 3.4328E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 5
Rdmodfacs> Frequence du vecteur en lecture: 3.4335E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 6
Rdmodfacs> Frequence du vecteur en lecture: 3.4337E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 7
Rdmodfacs> Frequence du vecteur en lecture: 35.82
Rdmodfacs> Numero du vecteur CERFACS en lecture: 8
Rdmodfacs> Frequence du vecteur en lecture: 42.24
Rdmodfacs> Numero du vecteur CERFACS en lecture: 9
Rdmodfacs> Frequence du vecteur en lecture: 77.14
Rdmodfacs> Numero du vecteur CERFACS en lecture: 10
Rdmodfacs> Frequence du vecteur en lecture: 98.78
Rdmodfacs> Numero du vecteur CERFACS en lecture: 11
Rdmodfacs> Frequence du vecteur en lecture: 119.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 12
Rdmodfacs> Frequence du vecteur en lecture: 123.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 13
Rdmodfacs> Frequence du vecteur en lecture: 136.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 14
Rdmodfacs> Frequence du vecteur en lecture: 143.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 15
Rdmodfacs> Frequence du vecteur en lecture: 146.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 16
Rdmodfacs> Frequence du vecteur en lecture: 159.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 17
Rdmodfacs> Frequence du vecteur en lecture: 162.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 18
Rdmodfacs> Frequence du vecteur en lecture: 190.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 19
Rdmodfacs> Frequence du vecteur en lecture: 228.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 20
Rdmodfacs> Frequence du vecteur en lecture: 232.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 21
Rdmodfacs> Frequence du vecteur en lecture: 261.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 22
Rdmodfacs> Frequence du vecteur en lecture: 270.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 23
Rdmodfacs> Frequence du vecteur en lecture: 277.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 24
Rdmodfacs> Frequence du vecteur en lecture: 281.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 25
Rdmodfacs> Frequence du vecteur en lecture: 284.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 26
Rdmodfacs> Frequence du vecteur en lecture: 293.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 27
Rdmodfacs> Frequence du vecteur en lecture: 297.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 28
Rdmodfacs> Frequence du vecteur en lecture: 307.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 29
Rdmodfacs> Frequence du vecteur en lecture: 321.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 30
Rdmodfacs> Frequence du vecteur en lecture: 324.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 31
Rdmodfacs> Frequence du vecteur en lecture: 334.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 32
Rdmodfacs> Frequence du vecteur en lecture: 345.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 33
Rdmodfacs> Frequence du vecteur en lecture: 350.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 34
Rdmodfacs> Frequence du vecteur en lecture: 364.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 35
Rdmodfacs> Frequence du vecteur en lecture: 387.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 36
Rdmodfacs> Frequence du vecteur en lecture: 398.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 37
Rdmodfacs> Frequence du vecteur en lecture: 404.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 38
Rdmodfacs> Frequence du vecteur en lecture: 417.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 39
Rdmodfacs> Frequence du vecteur en lecture: 419.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 40
Rdmodfacs> Frequence du vecteur en lecture: 429.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 41
Rdmodfacs> Frequence du vecteur en lecture: 439.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 42
Rdmodfacs> Frequence du vecteur en lecture: 469.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 43
Rdmodfacs> Frequence du vecteur en lecture: 474.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 44
Rdmodfacs> Frequence du vecteur en lecture: 475.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 45
Rdmodfacs> Frequence du vecteur en lecture: 482.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 46
Rdmodfacs> Frequence du vecteur en lecture: 499.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 47
Rdmodfacs> Frequence du vecteur en lecture: 504.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 48
Rdmodfacs> Frequence du vecteur en lecture: 518.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 49
Rdmodfacs> Frequence du vecteur en lecture: 521.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 50
Rdmodfacs> Frequence du vecteur en lecture: 527.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 51
Rdmodfacs> Frequence du vecteur en lecture: 538.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 52
Rdmodfacs> Frequence du vecteur en lecture: 552.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 53
Rdmodfacs> Frequence du vecteur en lecture: 557.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 54
Rdmodfacs> Frequence du vecteur en lecture: 564.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 55
Rdmodfacs> Frequence du vecteur en lecture: 572.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 56
Rdmodfacs> Frequence du vecteur en lecture: 581.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 57
Rdmodfacs> Frequence du vecteur en lecture: 589.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 58
Rdmodfacs> Frequence du vecteur en lecture: 597.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 59
Rdmodfacs> Frequence du vecteur en lecture: 605.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 60
Rdmodfacs> Frequence du vecteur en lecture: 613.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 61
Rdmodfacs> Frequence du vecteur en lecture: 616.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 62
Rdmodfacs> Frequence du vecteur en lecture: 625.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 63
Rdmodfacs> Frequence du vecteur en lecture: 634.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 64
Rdmodfacs> Frequence du vecteur en lecture: 638.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 65
Rdmodfacs> Frequence du vecteur en lecture: 642.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 66
Rdmodfacs> Frequence du vecteur en lecture: 647.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 67
Rdmodfacs> Frequence du vecteur en lecture: 663.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 68
Rdmodfacs> Frequence du vecteur en lecture: 675.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 69
Rdmodfacs> Frequence du vecteur en lecture: 678.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 70
Rdmodfacs> Frequence du vecteur en lecture: 687.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 71
Rdmodfacs> Frequence du vecteur en lecture: 696.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 72
Rdmodfacs> Frequence du vecteur en lecture: 709.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 73
Rdmodfacs> Frequence du vecteur en lecture: 710.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 74
Rdmodfacs> Frequence du vecteur en lecture: 715.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 75
Rdmodfacs> Frequence du vecteur en lecture: 726.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 76
Rdmodfacs> Frequence du vecteur en lecture: 733.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 77
Rdmodfacs> Frequence du vecteur en lecture: 747.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 78
Rdmodfacs> Frequence du vecteur en lecture: 747.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 79
Rdmodfacs> Frequence du vecteur en lecture: 755.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 80
Rdmodfacs> Frequence du vecteur en lecture: 767.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 81
Rdmodfacs> Frequence du vecteur en lecture: 772.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 82
Rdmodfacs> Frequence du vecteur en lecture: 777.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 83
Rdmodfacs> Frequence du vecteur en lecture: 789.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 84
Rdmodfacs> Frequence du vecteur en lecture: 793.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 85
Rdmodfacs> Frequence du vecteur en lecture: 803.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 86
Rdmodfacs> Frequence du vecteur en lecture: 808.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 87
Rdmodfacs> Frequence du vecteur en lecture: 818.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 88
Rdmodfacs> Frequence du vecteur en lecture: 821.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 89
Rdmodfacs> Frequence du vecteur en lecture: 825.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 90
Rdmodfacs> Frequence du vecteur en lecture: 836.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 91
Rdmodfacs> Frequence du vecteur en lecture: 841.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 92
Rdmodfacs> Frequence du vecteur en lecture: 849.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 93
Rdmodfacs> Frequence du vecteur en lecture: 854.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 94
Rdmodfacs> Frequence du vecteur en lecture: 865.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 95
Rdmodfacs> Frequence du vecteur en lecture: 867.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 96
Rdmodfacs> Frequence du vecteur en lecture: 871.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 97
Rdmodfacs> Frequence du vecteur en lecture: 873.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 98
Rdmodfacs> Frequence du vecteur en lecture: 887.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 99
Rdmodfacs> Frequence du vecteur en lecture: 891.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 100
Rdmodfacs> Frequence du vecteur en lecture: 894.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 101
Rdmodfacs> Frequence du vecteur en lecture: 896.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 102
Rdmodfacs> Frequence du vecteur en lecture: 901.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 103
Rdmodfacs> Frequence du vecteur en lecture: 904.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 104
Rdmodfacs> Frequence du vecteur en lecture: 917.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 105
Rdmodfacs> Frequence du vecteur en lecture: 921.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 106
Rdmodfacs> Frequence du vecteur en lecture: 929.7
Chkmod> 106 vectors, 28902 coordinates in file.
Chkmod> That is: 9634 cartesian points.
Openam> file on opening on unit 11:
Chkmod.res
Chkmod> Collectivity=f(frequency) to be written in this file.
%Chkmod-Wn> Norm of vector 12 is: 0.9999 (instead of 1.0000).
%Chkmod-Wn> Norm of vector 73 is: 0.9999 (instead of 1.0000).
Chkmod> Normal end.
0.0034 0.9506
0.0034 0.6259
0.0034 0.7947
0.0034 0.7487
0.0034 0.6740
0.0034 0.6518
35.8172 0.0310
42.2373 0.0311
77.1424 0.0665
98.7841 0.0794
118.9508 0.1703
123.0915 0.0409
136.4050 0.0642
142.9885 0.0969
146.9335 0.0798
158.9970 0.0325
162.9162 0.1029
190.0112 0.0416
228.7806 0.3779
232.2588 0.3561
261.3310 0.2178
270.5313 0.2125
277.6721 0.1810
281.7610 0.2709
284.4474 0.1753
293.8871 0.1929
297.3769 0.1765
307.8198 0.1236
321.7173 0.2492
324.7087 0.2782
334.0166 0.2534
345.7766 0.2286
350.5181 0.1993
364.2109 0.3600
386.9711 0.1389
398.0854 0.3509
404.4035 0.3414
417.3178 0.2223
419.4315 0.1447
429.8443 0.2412
439.4744 0.0883
469.1901 0.3522
474.1896 0.2966
475.8031 0.2141
482.8141 0.2519
499.4988 0.3828
504.3148 0.4396
518.0394 0.2213
520.9899 0.3950
526.9533 0.1506
538.9008 0.4913
551.9794 0.4137
556.9767 0.4840
564.0240 0.4151
572.8399 0.4056
581.6235 0.5205
589.2767 0.3655
597.8189 0.1187
605.7542 0.2500
613.2025 0.4413
616.2714 0.2414
625.1049 0.3916
634.3731 0.4058
638.7261 0.3511
642.5911 0.3203
647.4354 0.4834
663.2683 0.4138
675.8595 0.4438
678.4714 0.3730
687.8777 0.4230
696.3109 0.4497
709.2299 0.4135
710.5587 0.1072
715.7668 0.3730
726.3144 0.3192
733.5030 0.3972
747.3574 0.3379
747.8305 0.2971
755.3608 0.3581
767.3631 0.2216
771.9590 0.3144
777.7416 0.3297
789.1049 0.5523
793.4263 0.4110
803.6883 0.3892
808.2965 0.1907
818.8762 0.4565
821.1768 0.4444
825.1875 0.4563
836.3996 0.4749
840.9688 0.2618
849.1313 0.2591
854.4607 0.2441
865.8385 0.4041
867.0633 0.0898
871.2011 0.3455
873.8362 0.2310
887.2936 0.3953
891.2713 0.4854
894.6384 0.1621
896.8105 0.4292
901.5966 0.2078
904.9254 0.3157
917.2845 0.4993
921.3247 0.2952
929.6696 0.4370
getting mode 7
running: ../../bin/get_modes.sh 2607192210472627078 7 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 7
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.7.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 2607192210472627078.7.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 2607192210472627078.7.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 2607192210472627078 8 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 8
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.8.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 2607192210472627078.8.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 2607192210472627078.8.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 2607192210472627078 9 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 9
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.9.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 2607192210472627078.9.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 2607192210472627078.9.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 2607192210472627078 10 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 10
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.10.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 2607192210472627078.10.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 2607192210472627078.10.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 2607192210472627078 11 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 11
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.11.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 2607192210472627078.11.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 2607192210472627078.11.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 2607192210472627078 12 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 12
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.12.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 2607192210472627078.12.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 2607192210472627078.12.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 2607192210472627078 13 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 13
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.13.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 2607192210472627078.13.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 2607192210472627078.13.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 2607192210472627078 14 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 14
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.14.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 2607192210472627078.14.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 2607192210472627078.14.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 2607192210472627078 15 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 15
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.15.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 2607192210472627078.15.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 2607192210472627078.15.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 2607192210472627078 16 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 16
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.16.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 2607192210472627078.16.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 2607192210472627078.16.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 2607192210472627078 17 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 17
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.17.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 2607192210472627078.17.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 2607192210472627078.17.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 2607192210472627078 18 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 18
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.18.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 2607192210472627078.18.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 2607192210472627078.18.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 2607192210472627078 19 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 19
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.19.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 2607192210472627078.19.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 2607192210472627078.19.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 2607192210472627078 20 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 20
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.20.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 2607192210472627078.20.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 2607192210472627078.20.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 2607192210472627078 21 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 21
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.21.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 2607192210472627078.21.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 2607192210472627078.21.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 2607192210472627078 22 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 22
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.22.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 2607192210472627078.22.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 2607192210472627078.22.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 2607192210472627078 23 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 23
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.23.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 2607192210472627078.23.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 2607192210472627078.23.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 2607192210472627078 24 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 24
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.24.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 2607192210472627078.24.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 2607192210472627078.24.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 2607192210472627078 25 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 25
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.25.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 2607192210472627078.25.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 2607192210472627078.25.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 2607192210472627078 26 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 26
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.26.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 2607192210472627078.26.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 2607192210472627078.26.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 2607192210472627078 27 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 27
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.27.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 2607192210472627078.27.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 2607192210472627078.27.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 2607192210472627078 28 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 28
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.28.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 2607192210472627078.28.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 2607192210472627078.28.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 2607192210472627078 29 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 29
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.29.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 2607192210472627078.29.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 2607192210472627078.29.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 2607192210472627078 30 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 30
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.30.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 2607192210472627078.30.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 2607192210472627078.30.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 2607192210472627078 31 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 31
calculating perturbed structure for DQ=-100
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=-20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=0
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=20
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=40
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=60
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=80
2607192210472627078.eigenfacs
2607192210472627078.atom
calculating perturbed structure for DQ=100
2607192210472627078.eigenfacs
2607192210472627078.atom
making animated gifs
11 models are in 2607192210472627078.31.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 2607192210472627078.31.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 2607192210472627078.31.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
2607192210472627078.10.pdb
2607192210472627078.11.pdb
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2607192210472627078.31.pdb
2607192210472627078.7.pdb
2607192210472627078.8.pdb
2607192210472627078.9.pdb
STDERR:
Note: The following floating-point exceptions are signalling: IEEE_DENORMAL
real 0m54.940s
user 0m54.382s
sys 0m0.533s
rm: cannot remove '2607192210472627078.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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