***    ***
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 = 2605022033524035196.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 2605022033524035196.atom to be opened.
Openam> File opened: 2605022033524035196.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 = 134
First residue number = 11
Last residue number = 144
Number of atoms found = 1024
Mean number per residue = 7.6
Pdbmat> Coordinate statistics:
= 1.559474 +/- 8.047903 From: -18.804000 To: 21.762000
= 0.409567 +/- 8.408445 From: -20.399000 To: 22.657000
= 1.052662 +/- 8.255538 From: -15.957000 To: 20.147000
Pdbmat> Masses are all set to one.
Openam> File opened: pdbmat.xyzm
Pdbmat> Coordinates and masses considered are saved.
Openam> File opened: pdbmat.sdijb
Pdbmat> Matrix statistics:
Pdbmat> The matrix is 7.2063 % Filled.
Pdbmat> 340145 non-zero elements.
Pdbmat> 37114 atom-atom interactions.
Pdbmat> Number per atom= 72.49 +/- 21.31
Maximum number = 121
Minimum number = 14
Pdbmat> Matrix trace = 742280.
Pdbmat> Larger element = 465.722
Pdbmat> 0 elements larger than +/- 1.0E+10
Pdbmat> Normal end.
automatic determination of NRBL (NRBL = nresidues/200 + 1)
134 non-zero elements, NRBL set to 1
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 = 2605022033524035196.atom
Eigenvector OUTPut file = matrix.eigenrtb
Nb of VECTors required = 106
EigeNVALues chosen = LOWE
Type of SUBStructuring = NONE
Nb of residues per BLOck = 1
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 2605022033524035196.atom to be opened.
Openam> file on opening on unit 11:
2605022033524035196.atom
Blocpdb> Coordinate file in PDB format.
Blocpdb> 1024 atoms picked in pdb file.
Blocpdb> All masses set to unity.
Blocpdb> Coordinate file is rewritten.
Blocpdb> Substructuring:
Blocpdb> 1 residue(s) per block.
Blocpdb> 134 residues.
Blocpdb> 9 atoms in block 1
Block first atom: 1
Blocpdb> 9 atoms in block 2
Block first atom: 10
Blocpdb> 5 atoms in block 3
Block first atom: 19
Blocpdb> 7 atoms in block 4
Block first atom: 24
Blocpdb> 4 atoms in block 5
Block first atom: 31
Blocpdb> 7 atoms in block 6
Block first atom: 35
Blocpdb> 14 atoms in block 7
Block first atom: 42
Blocpdb> 9 atoms in block 8
Block first atom: 56
Blocpdb> 8 atoms in block 9
Block first atom: 65
Blocpdb> 5 atoms in block 10
Block first atom: 73
Blocpdb> 8 atoms in block 11
Block first atom: 78
Blocpdb> 6 atoms in block 12
Block first atom: 86
Blocpdb> 10 atoms in block 13
Block first atom: 92
Blocpdb> 8 atoms in block 14
Block first atom: 102
Blocpdb> 9 atoms in block 15
Block first atom: 110
Blocpdb> 4 atoms in block 16
Block first atom: 119
Blocpdb> 9 atoms in block 17
Block first atom: 123
Blocpdb> 6 atoms in block 18
Block first atom: 132
Blocpdb> 7 atoms in block 19
Block first atom: 138
Blocpdb> 9 atoms in block 20
Block first atom: 145
Blocpdb> 5 atoms in block 21
Block first atom: 154
Blocpdb> 8 atoms in block 22
Block first atom: 159
Blocpdb> 4 atoms in block 23
Block first atom: 167
Blocpdb> 5 atoms in block 24
Block first atom: 171
Blocpdb> 7 atoms in block 25
Block first atom: 176
Blocpdb> 9 atoms in block 26
Block first atom: 183
Blocpdb> 9 atoms in block 27
Block first atom: 192
Blocpdb> 6 atoms in block 28
Block first atom: 201
Blocpdb> 6 atoms in block 29
Block first atom: 207
Blocpdb> 8 atoms in block 30
Block first atom: 213
Blocpdb> 4 atoms in block 31
Block first atom: 221
Blocpdb> 7 atoms in block 32
Block first atom: 225
Blocpdb> 8 atoms in block 33
Block first atom: 232
Blocpdb> 5 atoms in block 34
Block first atom: 240
Blocpdb> 8 atoms in block 35
Block first atom: 245
Blocpdb> 7 atoms in block 36
Block first atom: 253
Blocpdb> 9 atoms in block 37
Block first atom: 260
Blocpdb> 7 atoms in block 38
Block first atom: 269
Blocpdb> 6 atoms in block 39
Block first atom: 276
Blocpdb> 12 atoms in block 40
Block first atom: 282
Blocpdb> 7 atoms in block 41
Block first atom: 294
Blocpdb> 6 atoms in block 42
Block first atom: 301
Blocpdb> 9 atoms in block 43
Block first atom: 307
Blocpdb> 9 atoms in block 44
Block first atom: 316
Blocpdb> 8 atoms in block 45
Block first atom: 325
Blocpdb> 4 atoms in block 46
Block first atom: 333
Blocpdb> 8 atoms in block 47
Block first atom: 337
Blocpdb> 9 atoms in block 48
Block first atom: 345
Blocpdb> 7 atoms in block 49
Block first atom: 354
Blocpdb> 7 atoms in block 50
Block first atom: 361
Blocpdb> 8 atoms in block 51
Block first atom: 368
Blocpdb> 9 atoms in block 52
Block first atom: 376
Blocpdb> 6 atoms in block 53
Block first atom: 385
Blocpdb> 9 atoms in block 54
Block first atom: 391
Blocpdb> 7 atoms in block 55
Block first atom: 400
Blocpdb> 4 atoms in block 56
Block first atom: 407
Blocpdb> 7 atoms in block 57
Block first atom: 411
Blocpdb> 7 atoms in block 58
Block first atom: 418
Blocpdb> 8 atoms in block 59
Block first atom: 425
Blocpdb> 8 atoms in block 60
Block first atom: 433
Blocpdb> 11 atoms in block 61
Block first atom: 441
Blocpdb> 4 atoms in block 62
Block first atom: 452
Blocpdb> 8 atoms in block 63
Block first atom: 456
Blocpdb> 9 atoms in block 64
Block first atom: 464
Blocpdb> 6 atoms in block 65
Block first atom: 473
Blocpdb> 9 atoms in block 66
Block first atom: 479
Blocpdb> 11 atoms in block 67
Block first atom: 488
Blocpdb> 9 atoms in block 68
Block first atom: 499
Blocpdb> 8 atoms in block 69
Block first atom: 508
Blocpdb> 4 atoms in block 70
Block first atom: 516
Blocpdb> 9 atoms in block 71
Block first atom: 520
Blocpdb> 9 atoms in block 72
Block first atom: 529
Blocpdb> 7 atoms in block 73
Block first atom: 538
Blocpdb> 8 atoms in block 74
Block first atom: 545
Blocpdb> 9 atoms in block 75
Block first atom: 553
Blocpdb> 8 atoms in block 76
Block first atom: 562
Blocpdb> 7 atoms in block 77
Block first atom: 570
Blocpdb> 5 atoms in block 78
Block first atom: 577
Blocpdb> 8 atoms in block 79
Block first atom: 582
Blocpdb> 8 atoms in block 80
Block first atom: 590
Blocpdb> 6 atoms in block 81
Block first atom: 598
Blocpdb> 9 atoms in block 82
Block first atom: 604
Blocpdb> 4 atoms in block 83
Block first atom: 613
Blocpdb> 7 atoms in block 84
Block first atom: 617
Blocpdb> 9 atoms in block 85
Block first atom: 624
Blocpdb> 6 atoms in block 86
Block first atom: 633
Blocpdb> 7 atoms in block 87
Block first atom: 639
Blocpdb> 7 atoms in block 88
Block first atom: 646
Blocpdb> 8 atoms in block 89
Block first atom: 653
Blocpdb> 8 atoms in block 90
Block first atom: 661
Blocpdb> 7 atoms in block 91
Block first atom: 669
Blocpdb> 4 atoms in block 92
Block first atom: 676
Blocpdb> 9 atoms in block 93
Block first atom: 680
Blocpdb> 9 atoms in block 94
Block first atom: 689
Blocpdb> 10 atoms in block 95
Block first atom: 698
Blocpdb> 7 atoms in block 96
Block first atom: 708
Blocpdb> 9 atoms in block 97
Block first atom: 715
Blocpdb> 7 atoms in block 98
Block first atom: 724
Blocpdb> 9 atoms in block 99
Block first atom: 731
Blocpdb> 9 atoms in block 100
Block first atom: 740
Blocpdb> 14 atoms in block 101
Block first atom: 749
Blocpdb> 8 atoms in block 102
Block first atom: 763
Blocpdb> 4 atoms in block 103
Block first atom: 771
Blocpdb> 9 atoms in block 104
Block first atom: 775
Blocpdb> 9 atoms in block 105
Block first atom: 784
Blocpdb> 7 atoms in block 106
Block first atom: 793
Blocpdb> 7 atoms in block 107
Block first atom: 800
Blocpdb> 11 atoms in block 108
Block first atom: 807
Blocpdb> 7 atoms in block 109
Block first atom: 818
Blocpdb> 8 atoms in block 110
Block first atom: 825
Blocpdb> 9 atoms in block 111
Block first atom: 833
Blocpdb> 8 atoms in block 112
Block first atom: 842
Blocpdb> 9 atoms in block 113
Block first atom: 850
Blocpdb> 8 atoms in block 114
Block first atom: 859
Blocpdb> 4 atoms in block 115
Block first atom: 867
Blocpdb> 9 atoms in block 116
Block first atom: 871
Blocpdb> 8 atoms in block 117
Block first atom: 880
Blocpdb> 7 atoms in block 118
Block first atom: 888
Blocpdb> 12 atoms in block 119
Block first atom: 895
Blocpdb> 7 atoms in block 120
Block first atom: 907
Blocpdb> 10 atoms in block 121
Block first atom: 914
Blocpdb> 7 atoms in block 122
Block first atom: 924
Blocpdb> 8 atoms in block 123
Block first atom: 931
Blocpdb> 4 atoms in block 124
Block first atom: 939
Blocpdb> 8 atoms in block 125
Block first atom: 943
Blocpdb> 7 atoms in block 126
Block first atom: 951
Blocpdb> 7 atoms in block 127
Block first atom: 958
Blocpdb> 5 atoms in block 128
Block first atom: 965
Blocpdb> 7 atoms in block 129
Block first atom: 970
Blocpdb> 8 atoms in block 130
Block first atom: 977
Blocpdb> 6 atoms in block 131
Block first atom: 985
Blocpdb> 12 atoms in block 132
Block first atom: 991
Blocpdb> 11 atoms in block 133
Block first atom: 1003
Blocpdb> 11 atoms in block 134
Block first atom: 1013
Blocpdb> 134 blocks.
Blocpdb> At most, 14 atoms in each of them.
Blocpdb> At least, 4 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> 340279 matrix lines read.
Prepmat> Matrix order = 3072
Prepmat> Matrix trace = 742280.0000
Prepmat> Last element read: 3072 3072 248.3176
Prepmat> 9046 lines saved.
Prepmat> 7528 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: 1024
RTB> Total mass = 1024.0000
RTB> Number of atoms found in matrix: 1024
RTB> Number of blocks = 134
RTB> Projection begins.
RTB> Projected matrix is being saved.
RTB> Projected matrix trace = 177730.3143
RTB> 52602 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 = 804
Diagstd> Nb of non-zero elements: 52602
Diagstd> Projected matrix trace = 177730.3143
Openam> file on opening on unit 11:
diagrtb_work.eigenfacs
Diagstd> Diagonalization.
Diagstd> 804 eigenvectors are computed.
Diagstd> 106 of them to be saved.
Diagstd> Sum of eigenvalues = 177730.3143
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 6.0879557 7.6712164 9.2681533 9.8100757
10.7077770 11.1126263 12.2497208 12.7369419 13.5008350
14.0160447 15.7554700 16.6710750 16.9450296 17.4868965
18.8452615 19.6617273 21.0322199 21.1957818 22.0045594
23.1766758 24.2368231 24.3799377 25.9991655 26.3996663
27.7732506 29.8180773 30.8065635 31.3040185 32.1043314
33.9708409 36.1433150 36.4301032 37.2511918 37.6496075
38.6956283 39.7918329 40.1882238 40.8385510 41.5895723
43.2793859 43.6777968 44.3881965 45.6638158 46.0915921
46.5597229 47.1262135 47.5516440 48.9641732 50.2580900
50.9604195 51.5855372 52.3967095 53.4718349 53.8606213
54.4886436 55.6003925 56.9526018 58.4830762 60.1685989
60.6494772 60.9691052 62.2633889 63.7729295 64.9377239
65.0725899 65.4452090 66.3322936 67.4990265 68.4129011
69.7332678 69.8896256 71.0219104 71.8947074 72.8346869
73.1810921 74.0430179 74.4091019 75.2051688 75.7485093
75.7706765 76.4414922 78.1371649 79.3687523 80.5311943
80.9454193 81.3203265 82.1470893 82.7293548 83.0584550
85.1752523 85.5844769 86.0510574 86.6825968 87.4540139
88.3411776 88.6941170 90.1201927 90.2589722 90.9710026
92.2144931
Diagstd> Frequencies (cm-1, if the input matrix is a hessian in CHARMM units):
0.0034319 0.0034331 0.0034333 0.0034336 0.0034339
0.0034343 267.9359712 300.7650699 330.5916539 340.1194437
355.3406876 361.9958868 380.0654363 387.5501095 399.0024806
406.5444313 431.0334377 443.3810039 447.0091847 454.1001552
471.4073661 481.5108911 498.0097410 499.9424345 509.3914115
522.7822736 534.6051365 536.1811927 553.7005880 557.9489938
572.2800898 592.9732449 602.7218109 607.5686071 615.2860878
632.9194305 652.8437818 655.4287400 662.7738519 666.3087352
675.5013663 685.0026511 688.4060624 693.9536153 700.3054523
714.3907539 717.6714041 723.4841651 733.8062054 737.2353231
740.9697424 745.4637907 748.8210568 759.8615919 769.8360955
775.1964543 779.9365249 786.0447786 794.0682357 796.9497888
801.5825950 809.7187742 819.5058624 830.4440629 842.3260454
845.6853577 847.9108468 856.8635281 867.1884079 875.0720479
875.9802733 878.4847158 884.4184367 892.1626441 898.1818691
906.8078874 907.8239523 915.1482537 920.7542675 926.7538716
928.9551003 934.4096954 936.7168047 941.7142134 945.1099283
945.2482081 949.4232406 959.8958301 967.4311273 974.4899179
976.9929251 979.2528338 984.2181510 987.7001024 989.6627049
1002.1944532 1004.5990900 1007.3337521 1011.0234689 1015.5122201
1020.6500761 1022.6868873 1030.8757796 1031.6692168 1035.7305125
1042.7852316
Diagstd> Normal end.
Rtb_to_modes> Entering in.
Rtb_to_modes> Number of atoms in temporary block-file = 1024
Rtb_to_modes> Number of blocs = 134
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: 9.9880E-10
Rdmodfacs> Eigenvector number: 2
Rdmodfacs> Corresponding eigenvalue: 9.9947E-10
Rdmodfacs> Eigenvector number: 3
Rdmodfacs> Corresponding eigenvalue: 9.9964E-10
Rdmodfacs> Eigenvector number: 4
Rdmodfacs> Corresponding eigenvalue: 9.9978E-10
Rdmodfacs> Eigenvector number: 5
Rdmodfacs> Corresponding eigenvalue: 9.9995E-10
Rdmodfacs> Eigenvector number: 6
Rdmodfacs> Corresponding eigenvalue: 1.0002E-09
Rdmodfacs> Eigenvector number: 7
Rdmodfacs> Corresponding eigenvalue: 6.088
Rdmodfacs> Eigenvector number: 8
Rdmodfacs> Corresponding eigenvalue: 7.671
Rdmodfacs> Eigenvector number: 9
Rdmodfacs> Corresponding eigenvalue: 9.268
Rdmodfacs> Eigenvector number: 10
Rdmodfacs> Corresponding eigenvalue: 9.810
Rdmodfacs> Eigenvector number: 11
Rdmodfacs> Corresponding eigenvalue: 10.71
Rdmodfacs> Eigenvector number: 12
Rdmodfacs> Corresponding eigenvalue: 11.11
Rdmodfacs> Eigenvector number: 13
Rdmodfacs> Corresponding eigenvalue: 12.25
Rdmodfacs> Eigenvector number: 14
Rdmodfacs> Corresponding eigenvalue: 12.74
Rdmodfacs> Eigenvector number: 15
Rdmodfacs> Corresponding eigenvalue: 13.50
Rdmodfacs> Eigenvector number: 16
Rdmodfacs> Corresponding eigenvalue: 14.02
Rdmodfacs> Eigenvector number: 17
Rdmodfacs> Corresponding eigenvalue: 15.76
Rdmodfacs> Eigenvector number: 18
Rdmodfacs> Corresponding eigenvalue: 16.67
Rdmodfacs> Eigenvector number: 19
Rdmodfacs> Corresponding eigenvalue: 16.95
Rdmodfacs> Eigenvector number: 20
Rdmodfacs> Corresponding eigenvalue: 17.49
Rdmodfacs> Eigenvector number: 21
Rdmodfacs> Corresponding eigenvalue: 18.85
Rdmodfacs> Eigenvector number: 22
Rdmodfacs> Corresponding eigenvalue: 19.66
Rdmodfacs> Eigenvector number: 23
Rdmodfacs> Corresponding eigenvalue: 21.03
Rdmodfacs> Eigenvector number: 24
Rdmodfacs> Corresponding eigenvalue: 21.20
Rdmodfacs> Eigenvector number: 25
Rdmodfacs> Corresponding eigenvalue: 22.00
Rdmodfacs> Eigenvector number: 26
Rdmodfacs> Corresponding eigenvalue: 23.18
Rdmodfacs> Eigenvector number: 27
Rdmodfacs> Corresponding eigenvalue: 24.24
Rdmodfacs> Eigenvector number: 28
Rdmodfacs> Corresponding eigenvalue: 24.38
Rdmodfacs> Eigenvector number: 29
Rdmodfacs> Corresponding eigenvalue: 26.00
Rdmodfacs> Eigenvector number: 30
Rdmodfacs> Corresponding eigenvalue: 26.40
Rdmodfacs> Eigenvector number: 31
Rdmodfacs> Corresponding eigenvalue: 27.77
Rdmodfacs> Eigenvector number: 32
Rdmodfacs> Corresponding eigenvalue: 29.82
Rdmodfacs> Eigenvector number: 33
Rdmodfacs> Corresponding eigenvalue: 30.81
Rdmodfacs> Eigenvector number: 34
Rdmodfacs> Corresponding eigenvalue: 31.30
Rdmodfacs> Eigenvector number: 35
Rdmodfacs> Corresponding eigenvalue: 32.10
Rdmodfacs> Eigenvector number: 36
Rdmodfacs> Corresponding eigenvalue: 33.97
Rdmodfacs> Eigenvector number: 37
Rdmodfacs> Corresponding eigenvalue: 36.14
Rdmodfacs> Eigenvector number: 38
Rdmodfacs> Corresponding eigenvalue: 36.43
Rdmodfacs> Eigenvector number: 39
Rdmodfacs> Corresponding eigenvalue: 37.25
Rdmodfacs> Eigenvector number: 40
Rdmodfacs> Corresponding eigenvalue: 37.65
Rdmodfacs> Eigenvector number: 41
Rdmodfacs> Corresponding eigenvalue: 38.70
Rdmodfacs> Eigenvector number: 42
Rdmodfacs> Corresponding eigenvalue: 39.79
Rdmodfacs> Eigenvector number: 43
Rdmodfacs> Corresponding eigenvalue: 40.19
Rdmodfacs> Eigenvector number: 44
Rdmodfacs> Corresponding eigenvalue: 40.84
Rdmodfacs> Eigenvector number: 45
Rdmodfacs> Corresponding eigenvalue: 41.59
Rdmodfacs> Eigenvector number: 46
Rdmodfacs> Corresponding eigenvalue: 43.28
Rdmodfacs> Eigenvector number: 47
Rdmodfacs> Corresponding eigenvalue: 43.68
Rdmodfacs> Eigenvector number: 48
Rdmodfacs> Corresponding eigenvalue: 44.39
Rdmodfacs> Eigenvector number: 49
Rdmodfacs> Corresponding eigenvalue: 45.66
Rdmodfacs> Eigenvector number: 50
Rdmodfacs> Corresponding eigenvalue: 46.09
Rdmodfacs> Eigenvector number: 51
Rdmodfacs> Corresponding eigenvalue: 46.56
Rdmodfacs> Eigenvector number: 52
Rdmodfacs> Corresponding eigenvalue: 47.13
Rdmodfacs> Eigenvector number: 53
Rdmodfacs> Corresponding eigenvalue: 47.55
Rdmodfacs> Eigenvector number: 54
Rdmodfacs> Corresponding eigenvalue: 48.96
Rdmodfacs> Eigenvector number: 55
Rdmodfacs> Corresponding eigenvalue: 50.26
Rdmodfacs> Eigenvector number: 56
Rdmodfacs> Corresponding eigenvalue: 50.96
Rdmodfacs> Eigenvector number: 57
Rdmodfacs> Corresponding eigenvalue: 51.59
Rdmodfacs> Eigenvector number: 58
Rdmodfacs> Corresponding eigenvalue: 52.40
Rdmodfacs> Eigenvector number: 59
Rdmodfacs> Corresponding eigenvalue: 53.47
Rdmodfacs> Eigenvector number: 60
Rdmodfacs> Corresponding eigenvalue: 53.86
Rdmodfacs> Eigenvector number: 61
Rdmodfacs> Corresponding eigenvalue: 54.49
Rdmodfacs> Eigenvector number: 62
Rdmodfacs> Corresponding eigenvalue: 55.60
Rdmodfacs> Eigenvector number: 63
Rdmodfacs> Corresponding eigenvalue: 56.95
Rdmodfacs> Eigenvector number: 64
Rdmodfacs> Corresponding eigenvalue: 58.48
Rdmodfacs> Eigenvector number: 65
Rdmodfacs> Corresponding eigenvalue: 60.17
Rdmodfacs> Eigenvector number: 66
Rdmodfacs> Corresponding eigenvalue: 60.65
Rdmodfacs> Eigenvector number: 67
Rdmodfacs> Corresponding eigenvalue: 60.97
Rdmodfacs> Eigenvector number: 68
Rdmodfacs> Corresponding eigenvalue: 62.26
Rdmodfacs> Eigenvector number: 69
Rdmodfacs> Corresponding eigenvalue: 63.77
Rdmodfacs> Eigenvector number: 70
Rdmodfacs> Corresponding eigenvalue: 64.94
Rdmodfacs> Eigenvector number: 71
Rdmodfacs> Corresponding eigenvalue: 65.07
Rdmodfacs> Eigenvector number: 72
Rdmodfacs> Corresponding eigenvalue: 65.45
Rdmodfacs> Eigenvector number: 73
Rdmodfacs> Corresponding eigenvalue: 66.33
Rdmodfacs> Eigenvector number: 74
Rdmodfacs> Corresponding eigenvalue: 67.50
Rdmodfacs> Eigenvector number: 75
Rdmodfacs> Corresponding eigenvalue: 68.41
Rdmodfacs> Eigenvector number: 76
Rdmodfacs> Corresponding eigenvalue: 69.73
Rdmodfacs> Eigenvector number: 77
Rdmodfacs> Corresponding eigenvalue: 69.89
Rdmodfacs> Eigenvector number: 78
Rdmodfacs> Corresponding eigenvalue: 71.02
Rdmodfacs> Eigenvector number: 79
Rdmodfacs> Corresponding eigenvalue: 71.89
Rdmodfacs> Eigenvector number: 80
Rdmodfacs> Corresponding eigenvalue: 72.83
Rdmodfacs> Eigenvector number: 81
Rdmodfacs> Corresponding eigenvalue: 73.18
Rdmodfacs> Eigenvector number: 82
Rdmodfacs> Corresponding eigenvalue: 74.04
Rdmodfacs> Eigenvector number: 83
Rdmodfacs> Corresponding eigenvalue: 74.41
Rdmodfacs> Eigenvector number: 84
Rdmodfacs> Corresponding eigenvalue: 75.21
Rdmodfacs> Eigenvector number: 85
Rdmodfacs> Corresponding eigenvalue: 75.75
Rdmodfacs> Eigenvector number: 86
Rdmodfacs> Corresponding eigenvalue: 75.77
Rdmodfacs> Eigenvector number: 87
Rdmodfacs> Corresponding eigenvalue: 76.44
Rdmodfacs> Eigenvector number: 88
Rdmodfacs> Corresponding eigenvalue: 78.14
Rdmodfacs> Eigenvector number: 89
Rdmodfacs> Corresponding eigenvalue: 79.37
Rdmodfacs> Eigenvector number: 90
Rdmodfacs> Corresponding eigenvalue: 80.53
Rdmodfacs> Eigenvector number: 91
Rdmodfacs> Corresponding eigenvalue: 80.95
Rdmodfacs> Eigenvector number: 92
Rdmodfacs> Corresponding eigenvalue: 81.32
Rdmodfacs> Eigenvector number: 93
Rdmodfacs> Corresponding eigenvalue: 82.15
Rdmodfacs> Eigenvector number: 94
Rdmodfacs> Corresponding eigenvalue: 82.73
Rdmodfacs> Eigenvector number: 95
Rdmodfacs> Corresponding eigenvalue: 83.06
Rdmodfacs> Eigenvector number: 96
Rdmodfacs> Corresponding eigenvalue: 85.18
Rdmodfacs> Eigenvector number: 97
Rdmodfacs> Corresponding eigenvalue: 85.58
Rdmodfacs> Eigenvector number: 98
Rdmodfacs> Corresponding eigenvalue: 86.05
Rdmodfacs> Eigenvector number: 99
Rdmodfacs> Corresponding eigenvalue: 86.68
Rdmodfacs> Eigenvector number: 100
Rdmodfacs> Corresponding eigenvalue: 87.45
Rdmodfacs> Eigenvector number: 101
Rdmodfacs> Corresponding eigenvalue: 88.34
Rdmodfacs> Eigenvector number: 102
Rdmodfacs> Corresponding eigenvalue: 88.69
Rdmodfacs> Eigenvector number: 103
Rdmodfacs> Corresponding eigenvalue: 90.12
Rdmodfacs> Eigenvector number: 104
Rdmodfacs> Corresponding eigenvalue: 90.26
Rdmodfacs> Eigenvector number: 105
Rdmodfacs> Corresponding eigenvalue: 90.97
Rdmodfacs> Eigenvector number: 106
Rdmodfacs> Corresponding eigenvalue: 92.21
Rtb_to_modes> 106 vectors, with 804 coordinates in vector file.
Norm of eigenvectors in projected coordinates (one expected):
0.99999 1.00001 1.00000 1.00002 1.00000
0.99998 1.00001 0.99996 0.99995 1.00003
0.99999 0.99997 0.99999 1.00001 0.99999
1.00001 0.99997 1.00001 0.99999 1.00000
1.00001 1.00001 0.99999 0.99999 1.00002
1.00002 1.00001 1.00000 0.99998 1.00003
0.99998 1.00000 1.00001 0.99997 1.00000
1.00000 0.99997 1.00001 0.99998 1.00000
0.99998 1.00003 1.00001 0.99998 1.00002
1.00000 1.00000 1.00002 1.00001 1.00001
0.99998 1.00001 1.00000 0.99998 1.00000
1.00001 0.99999 1.00000 0.99999 0.99998
1.00000 1.00000 1.00001 1.00001 1.00002
0.99999 1.00002 1.00001 1.00002 1.00000
0.99998 1.00000 1.00001 0.99999 0.99999
0.99999 0.99999 1.00005 1.00001 1.00000
1.00001 1.00001 1.00002 1.00001 1.00000
0.99998 0.99998 1.00003 0.99998 0.99997
0.99998 0.99998 1.00002 1.00000 1.00001
1.00000 1.00001 1.00000 0.99996 1.00000
0.99999 0.99998 1.00001 0.99999 0.99999
1.00002
Rtb_to_modes> RTB block-file is being read.
Rtb_to_modes> 18432 lines found in RTB file.
Norm of eigenvectors in cartesian coordinates (one expected):
0.99999 1.00001 1.00000 1.00002 1.00000
0.99998 1.00001 0.99996 0.99995 1.00003
0.99999 0.99997 0.99999 1.00001 0.99999
1.00001 0.99997 1.00001 0.99999 1.00000
1.00001 1.00001 0.99999 0.99999 1.00002
1.00002 1.00001 1.00000 0.99998 1.00003
0.99998 1.00000 1.00001 0.99997 1.00000
1.00000 0.99997 1.00001 0.99998 1.00000
0.99998 1.00003 1.00001 0.99998 1.00002
1.00000 1.00000 1.00002 1.00001 1.00001
0.99998 1.00001 1.00000 0.99998 1.00000
1.00001 0.99999 1.00000 0.99999 0.99998
1.00000 1.00000 1.00001 1.00001 1.00002
0.99999 1.00002 1.00001 1.00002 1.00000
0.99998 1.00000 1.00001 0.99999 0.99999
0.99999 0.99999 1.00005 1.00001 1.00000
1.00001 1.00001 1.00002 1.00001 1.00000
0.99998 0.99998 1.00003 0.99998 0.99997
0.99998 0.99998 1.00002 1.00000 1.00001
1.00000 1.00001 1.00000 0.99996 1.00000
0.99999 0.99998 1.00001 0.99999 0.99999
1.00002
Orthogonality of first eigenvectors (zero expected):
Vector 2:-0.000
Vector 3:-0.000-0.000
Vector 4:-0.000 0.000 0.000
Vector 5: 0.000 0.000-0.000 0.000
Vector 6:-0.000 0.000 0.000-0.000 0.000
Vector 7: 0.000-0.000 0.000 0.000-0.000 0.000
Vector 8: 0.000-0.000-0.000 0.000 0.000-0.000 0.000
Vector 9: 0.000-0.000 0.000 0.000-0.000-0.000-0.000-0.000
Vector 10:-0.000-0.000-0.000-0.000-0.000-0.000-0.000-0.000 0.000
Rtb_to_modes> 106 eigenvectors saved.
Rtb_to_modes> Normal end.
Diagrtb> Normal end.
B-factor analysis
Bfactors> Version 1.22, Bordeaux.
Getnam> Eigenvector filename ?
Getnam> 2605022033524035196.eigenfacs
Openam> file on opening on unit 10:
2605022033524035196.eigenfacs
Getnam> Corresponding pdb filename ?
Getnam> 2605022033524035196.atom
Openam> file on opening on unit 11:
2605022033524035196.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 = 134
First residue number = 11
Last residue number = 144
Number of atoms found = 1024
Mean number per residue = 7.6
Rdmodfacs> Old Blzpack file format detected.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 1
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9880E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 2
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9947E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 3
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9964E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 4
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9978E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 5
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9995E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 6
Rdmodfacs> Valeur propre du vecteur en lecture: 1.0002E-09
Rdmodfacs> Numero du vecteur CERFACS en lecture: 7
Rdmodfacs> Valeur propre du vecteur en lecture: 6.088
Rdmodfacs> Numero du vecteur CERFACS en lecture: 8
Rdmodfacs> Valeur propre du vecteur en lecture: 7.671
Rdmodfacs> Numero du vecteur CERFACS en lecture: 9
Rdmodfacs> Valeur propre du vecteur en lecture: 9.268
Rdmodfacs> Numero du vecteur CERFACS en lecture: 10
Rdmodfacs> Valeur propre du vecteur en lecture: 9.810
Rdmodfacs> Numero du vecteur CERFACS en lecture: 11
Rdmodfacs> Valeur propre du vecteur en lecture: 10.71
Rdmodfacs> Numero du vecteur CERFACS en lecture: 12
Rdmodfacs> Valeur propre du vecteur en lecture: 11.11
Rdmodfacs> Numero du vecteur CERFACS en lecture: 13
Rdmodfacs> Valeur propre du vecteur en lecture: 12.25
Rdmodfacs> Numero du vecteur CERFACS en lecture: 14
Rdmodfacs> Valeur propre du vecteur en lecture: 12.74
Rdmodfacs> Numero du vecteur CERFACS en lecture: 15
Rdmodfacs> Valeur propre du vecteur en lecture: 13.50
Rdmodfacs> Numero du vecteur CERFACS en lecture: 16
Rdmodfacs> Valeur propre du vecteur en lecture: 14.02
Rdmodfacs> Numero du vecteur CERFACS en lecture: 17
Rdmodfacs> Valeur propre du vecteur en lecture: 15.76
Rdmodfacs> Numero du vecteur CERFACS en lecture: 18
Rdmodfacs> Valeur propre du vecteur en lecture: 16.67
Rdmodfacs> Numero du vecteur CERFACS en lecture: 19
Rdmodfacs> Valeur propre du vecteur en lecture: 16.95
Rdmodfacs> Numero du vecteur CERFACS en lecture: 20
Rdmodfacs> Valeur propre du vecteur en lecture: 17.49
Rdmodfacs> Numero du vecteur CERFACS en lecture: 21
Rdmodfacs> Valeur propre du vecteur en lecture: 18.85
Rdmodfacs> Numero du vecteur CERFACS en lecture: 22
Rdmodfacs> Valeur propre du vecteur en lecture: 19.66
Rdmodfacs> Numero du vecteur CERFACS en lecture: 23
Rdmodfacs> Valeur propre du vecteur en lecture: 21.03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 24
Rdmodfacs> Valeur propre du vecteur en lecture: 21.20
Rdmodfacs> Numero du vecteur CERFACS en lecture: 25
Rdmodfacs> Valeur propre du vecteur en lecture: 22.00
Rdmodfacs> Numero du vecteur CERFACS en lecture: 26
Rdmodfacs> Valeur propre du vecteur en lecture: 23.18
Rdmodfacs> Numero du vecteur CERFACS en lecture: 27
Rdmodfacs> Valeur propre du vecteur en lecture: 24.24
Rdmodfacs> Numero du vecteur CERFACS en lecture: 28
Rdmodfacs> Valeur propre du vecteur en lecture: 24.38
Rdmodfacs> Numero du vecteur CERFACS en lecture: 29
Rdmodfacs> Valeur propre du vecteur en lecture: 26.00
Rdmodfacs> Numero du vecteur CERFACS en lecture: 30
Rdmodfacs> Valeur propre du vecteur en lecture: 26.40
Rdmodfacs> Numero du vecteur CERFACS en lecture: 31
Rdmodfacs> Valeur propre du vecteur en lecture: 27.77
Rdmodfacs> Numero du vecteur CERFACS en lecture: 32
Rdmodfacs> Valeur propre du vecteur en lecture: 29.82
Rdmodfacs> Numero du vecteur CERFACS en lecture: 33
Rdmodfacs> Valeur propre du vecteur en lecture: 30.81
Rdmodfacs> Numero du vecteur CERFACS en lecture: 34
Rdmodfacs> Valeur propre du vecteur en lecture: 31.30
Rdmodfacs> Numero du vecteur CERFACS en lecture: 35
Rdmodfacs> Valeur propre du vecteur en lecture: 32.10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 36
Rdmodfacs> Valeur propre du vecteur en lecture: 33.97
Rdmodfacs> Numero du vecteur CERFACS en lecture: 37
Rdmodfacs> Valeur propre du vecteur en lecture: 36.14
Rdmodfacs> Numero du vecteur CERFACS en lecture: 38
Rdmodfacs> Valeur propre du vecteur en lecture: 36.43
Rdmodfacs> Numero du vecteur CERFACS en lecture: 39
Rdmodfacs> Valeur propre du vecteur en lecture: 37.25
Rdmodfacs> Numero du vecteur CERFACS en lecture: 40
Rdmodfacs> Valeur propre du vecteur en lecture: 37.65
Rdmodfacs> Numero du vecteur CERFACS en lecture: 41
Rdmodfacs> Valeur propre du vecteur en lecture: 38.70
Rdmodfacs> Numero du vecteur CERFACS en lecture: 42
Rdmodfacs> Valeur propre du vecteur en lecture: 39.79
Rdmodfacs> Numero du vecteur CERFACS en lecture: 43
Rdmodfacs> Valeur propre du vecteur en lecture: 40.19
Rdmodfacs> Numero du vecteur CERFACS en lecture: 44
Rdmodfacs> Valeur propre du vecteur en lecture: 40.84
Rdmodfacs> Numero du vecteur CERFACS en lecture: 45
Rdmodfacs> Valeur propre du vecteur en lecture: 41.59
Rdmodfacs> Numero du vecteur CERFACS en lecture: 46
Rdmodfacs> Valeur propre du vecteur en lecture: 43.28
Rdmodfacs> Numero du vecteur CERFACS en lecture: 47
Rdmodfacs> Valeur propre du vecteur en lecture: 43.68
Rdmodfacs> Numero du vecteur CERFACS en lecture: 48
Rdmodfacs> Valeur propre du vecteur en lecture: 44.39
Rdmodfacs> Numero du vecteur CERFACS en lecture: 49
Rdmodfacs> Valeur propre du vecteur en lecture: 45.66
Rdmodfacs> Numero du vecteur CERFACS en lecture: 50
Rdmodfacs> Valeur propre du vecteur en lecture: 46.09
Rdmodfacs> Numero du vecteur CERFACS en lecture: 51
Rdmodfacs> Valeur propre du vecteur en lecture: 46.56
Rdmodfacs> Numero du vecteur CERFACS en lecture: 52
Rdmodfacs> Valeur propre du vecteur en lecture: 47.13
Rdmodfacs> Numero du vecteur CERFACS en lecture: 53
Rdmodfacs> Valeur propre du vecteur en lecture: 47.55
Rdmodfacs> Numero du vecteur CERFACS en lecture: 54
Rdmodfacs> Valeur propre du vecteur en lecture: 48.96
Rdmodfacs> Numero du vecteur CERFACS en lecture: 55
Rdmodfacs> Valeur propre du vecteur en lecture: 50.26
Rdmodfacs> Numero du vecteur CERFACS en lecture: 56
Rdmodfacs> Valeur propre du vecteur en lecture: 50.96
Rdmodfacs> Numero du vecteur CERFACS en lecture: 57
Rdmodfacs> Valeur propre du vecteur en lecture: 51.59
Rdmodfacs> Numero du vecteur CERFACS en lecture: 58
Rdmodfacs> Valeur propre du vecteur en lecture: 52.40
Rdmodfacs> Numero du vecteur CERFACS en lecture: 59
Rdmodfacs> Valeur propre du vecteur en lecture: 53.47
Rdmodfacs> Numero du vecteur CERFACS en lecture: 60
Rdmodfacs> Valeur propre du vecteur en lecture: 53.86
Rdmodfacs> Numero du vecteur CERFACS en lecture: 61
Rdmodfacs> Valeur propre du vecteur en lecture: 54.49
Rdmodfacs> Numero du vecteur CERFACS en lecture: 62
Rdmodfacs> Valeur propre du vecteur en lecture: 55.60
Rdmodfacs> Numero du vecteur CERFACS en lecture: 63
Rdmodfacs> Valeur propre du vecteur en lecture: 56.95
Rdmodfacs> Numero du vecteur CERFACS en lecture: 64
Rdmodfacs> Valeur propre du vecteur en lecture: 58.48
Rdmodfacs> Numero du vecteur CERFACS en lecture: 65
Rdmodfacs> Valeur propre du vecteur en lecture: 60.17
Rdmodfacs> Numero du vecteur CERFACS en lecture: 66
Rdmodfacs> Valeur propre du vecteur en lecture: 60.65
Rdmodfacs> Numero du vecteur CERFACS en lecture: 67
Rdmodfacs> Valeur propre du vecteur en lecture: 60.97
Rdmodfacs> Numero du vecteur CERFACS en lecture: 68
Rdmodfacs> Valeur propre du vecteur en lecture: 62.26
Rdmodfacs> Numero du vecteur CERFACS en lecture: 69
Rdmodfacs> Valeur propre du vecteur en lecture: 63.77
Rdmodfacs> Numero du vecteur CERFACS en lecture: 70
Rdmodfacs> Valeur propre du vecteur en lecture: 64.94
Rdmodfacs> Numero du vecteur CERFACS en lecture: 71
Rdmodfacs> Valeur propre du vecteur en lecture: 65.07
Rdmodfacs> Numero du vecteur CERFACS en lecture: 72
Rdmodfacs> Valeur propre du vecteur en lecture: 65.45
Rdmodfacs> Numero du vecteur CERFACS en lecture: 73
Rdmodfacs> Valeur propre du vecteur en lecture: 66.33
Rdmodfacs> Numero du vecteur CERFACS en lecture: 74
Rdmodfacs> Valeur propre du vecteur en lecture: 67.50
Rdmodfacs> Numero du vecteur CERFACS en lecture: 75
Rdmodfacs> Valeur propre du vecteur en lecture: 68.41
Rdmodfacs> Numero du vecteur CERFACS en lecture: 76
Rdmodfacs> Valeur propre du vecteur en lecture: 69.73
Rdmodfacs> Numero du vecteur CERFACS en lecture: 77
Rdmodfacs> Valeur propre du vecteur en lecture: 69.89
Rdmodfacs> Numero du vecteur CERFACS en lecture: 78
Rdmodfacs> Valeur propre du vecteur en lecture: 71.02
Rdmodfacs> Numero du vecteur CERFACS en lecture: 79
Rdmodfacs> Valeur propre du vecteur en lecture: 71.89
Rdmodfacs> Numero du vecteur CERFACS en lecture: 80
Rdmodfacs> Valeur propre du vecteur en lecture: 72.83
Rdmodfacs> Numero du vecteur CERFACS en lecture: 81
Rdmodfacs> Valeur propre du vecteur en lecture: 73.18
Rdmodfacs> Numero du vecteur CERFACS en lecture: 82
Rdmodfacs> Valeur propre du vecteur en lecture: 74.04
Rdmodfacs> Numero du vecteur CERFACS en lecture: 83
Rdmodfacs> Valeur propre du vecteur en lecture: 74.41
Rdmodfacs> Numero du vecteur CERFACS en lecture: 84
Rdmodfacs> Valeur propre du vecteur en lecture: 75.21
Rdmodfacs> Numero du vecteur CERFACS en lecture: 85
Rdmodfacs> Valeur propre du vecteur en lecture: 75.75
Rdmodfacs> Numero du vecteur CERFACS en lecture: 86
Rdmodfacs> Valeur propre du vecteur en lecture: 75.77
Rdmodfacs> Numero du vecteur CERFACS en lecture: 87
Rdmodfacs> Valeur propre du vecteur en lecture: 76.44
Rdmodfacs> Numero du vecteur CERFACS en lecture: 88
Rdmodfacs> Valeur propre du vecteur en lecture: 78.14
Rdmodfacs> Numero du vecteur CERFACS en lecture: 89
Rdmodfacs> Valeur propre du vecteur en lecture: 79.37
Rdmodfacs> Numero du vecteur CERFACS en lecture: 90
Rdmodfacs> Valeur propre du vecteur en lecture: 80.53
Rdmodfacs> Numero du vecteur CERFACS en lecture: 91
Rdmodfacs> Valeur propre du vecteur en lecture: 80.95
Rdmodfacs> Numero du vecteur CERFACS en lecture: 92
Rdmodfacs> Valeur propre du vecteur en lecture: 81.32
Rdmodfacs> Numero du vecteur CERFACS en lecture: 93
Rdmodfacs> Valeur propre du vecteur en lecture: 82.15
Rdmodfacs> Numero du vecteur CERFACS en lecture: 94
Rdmodfacs> Valeur propre du vecteur en lecture: 82.73
Rdmodfacs> Numero du vecteur CERFACS en lecture: 95
Rdmodfacs> Valeur propre du vecteur en lecture: 83.06
Rdmodfacs> Numero du vecteur CERFACS en lecture: 96
Rdmodfacs> Valeur propre du vecteur en lecture: 85.18
Rdmodfacs> Numero du vecteur CERFACS en lecture: 97
Rdmodfacs> Valeur propre du vecteur en lecture: 85.58
Rdmodfacs> Numero du vecteur CERFACS en lecture: 98
Rdmodfacs> Valeur propre du vecteur en lecture: 86.05
Rdmodfacs> Numero du vecteur CERFACS en lecture: 99
Rdmodfacs> Valeur propre du vecteur en lecture: 86.68
Rdmodfacs> Numero du vecteur CERFACS en lecture: 100
Rdmodfacs> Valeur propre du vecteur en lecture: 87.45
Rdmodfacs> Numero du vecteur CERFACS en lecture: 101
Rdmodfacs> Valeur propre du vecteur en lecture: 88.34
Rdmodfacs> Numero du vecteur CERFACS en lecture: 102
Rdmodfacs> Valeur propre du vecteur en lecture: 88.69
Rdmodfacs> Numero du vecteur CERFACS en lecture: 103
Rdmodfacs> Valeur propre du vecteur en lecture: 90.12
Rdmodfacs> Numero du vecteur CERFACS en lecture: 104
Rdmodfacs> Valeur propre du vecteur en lecture: 90.26
Rdmodfacs> Numero du vecteur CERFACS en lecture: 105
Rdmodfacs> Valeur propre du vecteur en lecture: 90.97
Rdmodfacs> Numero du vecteur CERFACS en lecture: 106
Rdmodfacs> Valeur propre du vecteur en lecture: 92.21
Bfactors> 106 vectors, 3072 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 : 6.088000
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= -0.126 for 134 C-alpha atoms.
Bfactors> = 0.034 +/- 0.03
Bfactors> = 79.261 +/- 11.91
Bfactors> Shiftng-fct= 79.226
Bfactors> Scaling-fct= 372.264
Bfactors> Predicted, Scaled and Experimental B-factors are saved.
Bfactors> Normal end.
check_modes
Chkmod> Version 1.00, Bordeaux.
Getnam> Eigenvector filename ?
Getnam> 2605022033524035196.eigenfacs
Openam> file on opening on unit 10:
2605022033524035196.eigenfacs
Rdmodfacs> Old Blzpack file format detected.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 1
Rdmodfacs> Frequence du vecteur en lecture: 3.4318E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 2
Rdmodfacs> Frequence du vecteur en lecture: 3.4329E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 3
Rdmodfacs> Frequence du vecteur en lecture: 3.4332E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 4
Rdmodfacs> Frequence du vecteur en lecture: 3.4334E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 5
Rdmodfacs> Frequence du vecteur en lecture: 3.4337E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 6
Rdmodfacs> Frequence du vecteur en lecture: 3.4342E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 7
Rdmodfacs> Frequence du vecteur en lecture: 267.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 8
Rdmodfacs> Frequence du vecteur en lecture: 300.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 9
Rdmodfacs> Frequence du vecteur en lecture: 330.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 10
Rdmodfacs> Frequence du vecteur en lecture: 340.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 11
Rdmodfacs> Frequence du vecteur en lecture: 355.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 12
Rdmodfacs> Frequence du vecteur en lecture: 361.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 13
Rdmodfacs> Frequence du vecteur en lecture: 380.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 14
Rdmodfacs> Frequence du vecteur en lecture: 387.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 15
Rdmodfacs> Frequence du vecteur en lecture: 399.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 16
Rdmodfacs> Frequence du vecteur en lecture: 406.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 17
Rdmodfacs> Frequence du vecteur en lecture: 431.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 18
Rdmodfacs> Frequence du vecteur en lecture: 443.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 19
Rdmodfacs> Frequence du vecteur en lecture: 447.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 20
Rdmodfacs> Frequence du vecteur en lecture: 454.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 21
Rdmodfacs> Frequence du vecteur en lecture: 471.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 22
Rdmodfacs> Frequence du vecteur en lecture: 481.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 23
Rdmodfacs> Frequence du vecteur en lecture: 498.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 24
Rdmodfacs> Frequence du vecteur en lecture: 500.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 25
Rdmodfacs> Frequence du vecteur en lecture: 509.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 26
Rdmodfacs> Frequence du vecteur en lecture: 522.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 27
Rdmodfacs> Frequence du vecteur en lecture: 534.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 28
Rdmodfacs> Frequence du vecteur en lecture: 536.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 29
Rdmodfacs> Frequence du vecteur en lecture: 553.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 30
Rdmodfacs> Frequence du vecteur en lecture: 557.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 31
Rdmodfacs> Frequence du vecteur en lecture: 572.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 32
Rdmodfacs> Frequence du vecteur en lecture: 593.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 33
Rdmodfacs> Frequence du vecteur en lecture: 602.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 34
Rdmodfacs> Frequence du vecteur en lecture: 607.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 35
Rdmodfacs> Frequence du vecteur en lecture: 615.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 36
Rdmodfacs> Frequence du vecteur en lecture: 632.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 37
Rdmodfacs> Frequence du vecteur en lecture: 652.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 38
Rdmodfacs> Frequence du vecteur en lecture: 655.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 39
Rdmodfacs> Frequence du vecteur en lecture: 662.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 40
Rdmodfacs> Frequence du vecteur en lecture: 666.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 41
Rdmodfacs> Frequence du vecteur en lecture: 675.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 42
Rdmodfacs> Frequence du vecteur en lecture: 685.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 43
Rdmodfacs> Frequence du vecteur en lecture: 688.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 44
Rdmodfacs> Frequence du vecteur en lecture: 693.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 45
Rdmodfacs> Frequence du vecteur en lecture: 700.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 46
Rdmodfacs> Frequence du vecteur en lecture: 714.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 47
Rdmodfacs> Frequence du vecteur en lecture: 717.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 48
Rdmodfacs> Frequence du vecteur en lecture: 723.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 49
Rdmodfacs> Frequence du vecteur en lecture: 733.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 50
Rdmodfacs> Frequence du vecteur en lecture: 737.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 51
Rdmodfacs> Frequence du vecteur en lecture: 740.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 52
Rdmodfacs> Frequence du vecteur en lecture: 745.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 53
Rdmodfacs> Frequence du vecteur en lecture: 748.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 54
Rdmodfacs> Frequence du vecteur en lecture: 759.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 55
Rdmodfacs> Frequence du vecteur en lecture: 769.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 56
Rdmodfacs> Frequence du vecteur en lecture: 775.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 57
Rdmodfacs> Frequence du vecteur en lecture: 779.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 58
Rdmodfacs> Frequence du vecteur en lecture: 786.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 59
Rdmodfacs> Frequence du vecteur en lecture: 794.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 60
Rdmodfacs> Frequence du vecteur en lecture: 796.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 61
Rdmodfacs> Frequence du vecteur en lecture: 801.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 62
Rdmodfacs> Frequence du vecteur en lecture: 809.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 63
Rdmodfacs> Frequence du vecteur en lecture: 819.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 64
Rdmodfacs> Frequence du vecteur en lecture: 830.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 65
Rdmodfacs> Frequence du vecteur en lecture: 842.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 66
Rdmodfacs> Frequence du vecteur en lecture: 845.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 67
Rdmodfacs> Frequence du vecteur en lecture: 847.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 68
Rdmodfacs> Frequence du vecteur en lecture: 856.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 69
Rdmodfacs> Frequence du vecteur en lecture: 867.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 70
Rdmodfacs> Frequence du vecteur en lecture: 875.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 71
Rdmodfacs> Frequence du vecteur en lecture: 875.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 72
Rdmodfacs> Frequence du vecteur en lecture: 878.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 73
Rdmodfacs> Frequence du vecteur en lecture: 884.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 74
Rdmodfacs> Frequence du vecteur en lecture: 892.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 75
Rdmodfacs> Frequence du vecteur en lecture: 898.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 76
Rdmodfacs> Frequence du vecteur en lecture: 906.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 77
Rdmodfacs> Frequence du vecteur en lecture: 907.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 78
Rdmodfacs> Frequence du vecteur en lecture: 915.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 79
Rdmodfacs> Frequence du vecteur en lecture: 920.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 80
Rdmodfacs> Frequence du vecteur en lecture: 926.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 81
Rdmodfacs> Frequence du vecteur en lecture: 928.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 82
Rdmodfacs> Frequence du vecteur en lecture: 934.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 83
Rdmodfacs> Frequence du vecteur en lecture: 936.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 84
Rdmodfacs> Frequence du vecteur en lecture: 941.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 85
Rdmodfacs> Frequence du vecteur en lecture: 945.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 86
Rdmodfacs> Frequence du vecteur en lecture: 945.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 87
Rdmodfacs> Frequence du vecteur en lecture: 949.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 88
Rdmodfacs> Frequence du vecteur en lecture: 959.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 89
Rdmodfacs> Frequence du vecteur en lecture: 967.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 90
Rdmodfacs> Frequence du vecteur en lecture: 974.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 91
Rdmodfacs> Frequence du vecteur en lecture: 977.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 92
Rdmodfacs> Frequence du vecteur en lecture: 979.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 93
Rdmodfacs> Frequence du vecteur en lecture: 984.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 94
Rdmodfacs> Frequence du vecteur en lecture: 987.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 95
Rdmodfacs> Frequence du vecteur en lecture: 989.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 96
Rdmodfacs> Frequence du vecteur en lecture: 1002.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 97
Rdmodfacs> Frequence du vecteur en lecture: 1005.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 98
Rdmodfacs> Frequence du vecteur en lecture: 1007.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 99
Rdmodfacs> Frequence du vecteur en lecture: 1011.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 100
Rdmodfacs> Frequence du vecteur en lecture: 1015.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 101
Rdmodfacs> Frequence du vecteur en lecture: 1021.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 102
Rdmodfacs> Frequence du vecteur en lecture: 1023.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 103
Rdmodfacs> Frequence du vecteur en lecture: 1031.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 104
Rdmodfacs> Frequence du vecteur en lecture: 1032.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 105
Rdmodfacs> Frequence du vecteur en lecture: 1036.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 106
Rdmodfacs> Frequence du vecteur en lecture: 1043.
Chkmod> 106 vectors, 3072 coordinates in file.
Chkmod> That is: 1024 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 8 is: 0.9999 (instead of 1.0000).
%Chkmod-Wn> Norm of vector 9 is: 0.9999 (instead of 1.0000).
%Chkmod-Wn> Norm of vector 78 is: 1.0001 (instead of 1.0000).
Chkmod> Normal end.
0.0034 0.7754
0.0034 0.7688
0.0034 0.8981
0.0034 0.7399
0.0034 0.9430
0.0034 0.8667
267.9254 0.4821
300.7479 0.4154
330.5747 0.0610
340.1035 0.0515
355.3623 0.1648
361.9376 0.3473
380.0535 0.4418
387.5800 0.2651
398.9730 0.3066
406.5843 0.2587
431.0769 0.5627
443.3477 0.7146
447.0555 0.4121
454.1210 0.5723
471.4464 0.5652
481.4691 0.5646
497.9621 0.5372
499.9707 0.4069
509.3168 0.1442
522.7973 0.3248
534.6172 0.4273
536.1589 0.0492
553.6857 0.1818
557.9286 0.2738
572.2220 0.3561
592.9669 0.3763
602.7296 0.3382
607.5035 0.3908
615.2182 0.3488
632.8844 0.3771
652.7858 0.3151
655.3997 0.4881
662.7348 0.5948
666.2836 0.4473
675.5105 0.4824
684.9575 0.4234
688.3917 0.3746
693.9361 0.3887
700.2790 0.4001
714.3652 0.3031
717.6587 0.1466
723.4678 0.4325
733.7440 0.3122
737.1909 0.4427
740.9401 0.3442
745.4617 0.1725
748.7760 0.3303
759.7966 0.4252
769.8177 0.4658
775.1600 0.2890
779.9368 0.5776
786.0357 0.4009
794.0205 0.4607
796.9110 0.4459
801.5582 0.3121
809.6812 0.3789
819.4520 0.3240
830.3866 0.4427
842.2997 0.5250
845.6527 0.4020
847.8807 0.3105
856.8034 0.5302
867.1313 0.4790
875.0498 0.4519
875.9252 0.2673
878.4792 0.2816
884.3652 0.3762
892.1308 0.5295
898.1243 0.3671
906.7477 0.2419
907.7874 0.3984
915.0967 0.2636
920.6846 0.3799
926.6843 0.2370
928.9083 0.3101
934.3505 0.5409
936.6822 0.3886
941.7040 0.4133
945.0787 0.3429
945.2034 0.4561
949.3732 0.4649
959.8720 0.4214
967.3972 0.4897
974.4409 0.2877
976.9786 0.4872
979.2088 0.4018
984.1933 0.4864
987.6616 0.3223
989.6294 0.4723
1002.1794 0.4132
1004.5297 0.3091
1007.2843 0.3240
1010.9649 0.1831
1015.4453 0.3108
1020.5995 0.4357
1022.6193 0.4071
1030.8304 0.4605
1031.6308 0.2104
1035.6803 0.2200
1042.7151 0.2653
getting mode 7
running: ../../bin/get_modes.sh 2605022033524035196 7 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 7
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.7.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 2605022033524035196.7.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 2605022033524035196.7.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 2605022033524035196 8 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 8
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.8.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 2605022033524035196.8.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 2605022033524035196.8.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 2605022033524035196 9 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 9
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.9.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 2605022033524035196.9.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 2605022033524035196.9.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 2605022033524035196 10 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 10
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.10.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 2605022033524035196.10.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 2605022033524035196.10.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 2605022033524035196 11 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 11
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.11.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 2605022033524035196.11.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 2605022033524035196.11.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 2605022033524035196 12 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 12
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.12.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 2605022033524035196.12.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 2605022033524035196.12.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 2605022033524035196 13 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 13
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.13.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 2605022033524035196.13.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 2605022033524035196.13.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 2605022033524035196 14 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 14
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.14.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 2605022033524035196.14.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 2605022033524035196.14.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 2605022033524035196 15 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 15
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.15.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 2605022033524035196.15.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 2605022033524035196.15.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 2605022033524035196 16 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 16
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.16.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 2605022033524035196.16.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 2605022033524035196.16.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 2605022033524035196 17 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 17
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.17.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 2605022033524035196.17.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 2605022033524035196.17.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 2605022033524035196 18 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 18
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.18.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 2605022033524035196.18.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 2605022033524035196.18.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 2605022033524035196 19 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 19
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.19.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 2605022033524035196.19.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 2605022033524035196.19.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 2605022033524035196 20 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 20
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.20.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 2605022033524035196.20.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 2605022033524035196.20.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 2605022033524035196 21 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 21
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.21.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 2605022033524035196.21.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 2605022033524035196.21.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 2605022033524035196 22 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 22
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.22.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 2605022033524035196.22.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 2605022033524035196.22.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 2605022033524035196 23 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 23
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.23.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 2605022033524035196.23.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 2605022033524035196.23.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 2605022033524035196 24 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 24
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.24.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 2605022033524035196.24.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 2605022033524035196.24.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 2605022033524035196 25 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 25
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.25.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 2605022033524035196.25.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 2605022033524035196.25.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 2605022033524035196 26 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 26
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.26.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 2605022033524035196.26.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 2605022033524035196.26.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 2605022033524035196 27 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 27
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.27.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 2605022033524035196.27.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 2605022033524035196.27.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 2605022033524035196 28 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 28
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.28.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 2605022033524035196.28.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 2605022033524035196.28.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 2605022033524035196 29 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 29
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.29.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 2605022033524035196.29.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 2605022033524035196.29.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 2605022033524035196 30 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 30
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.30.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 2605022033524035196.30.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 2605022033524035196.30.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 2605022033524035196 31 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 31
calculating perturbed structure for DQ=-100
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=-20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=0
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=20
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=40
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=60
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=80
2605022033524035196.eigenfacs
2605022033524035196.atom
calculating perturbed structure for DQ=100
2605022033524035196.eigenfacs
2605022033524035196.atom
making animated gifs
11 models are in 2605022033524035196.31.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 2605022033524035196.31.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 2605022033524035196.31.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
2605022033524035196.10.pdb
2605022033524035196.11.pdb
2605022033524035196.12.pdb
2605022033524035196.13.pdb
2605022033524035196.14.pdb
2605022033524035196.15.pdb
2605022033524035196.16.pdb
2605022033524035196.17.pdb
2605022033524035196.18.pdb
2605022033524035196.19.pdb
2605022033524035196.20.pdb
2605022033524035196.21.pdb
2605022033524035196.22.pdb
2605022033524035196.23.pdb
2605022033524035196.24.pdb
2605022033524035196.25.pdb
2605022033524035196.26.pdb
2605022033524035196.27.pdb
2605022033524035196.28.pdb
2605022033524035196.29.pdb
2605022033524035196.30.pdb
2605022033524035196.31.pdb
2605022033524035196.7.pdb
2605022033524035196.8.pdb
2605022033524035196.9.pdb
STDERR:
Note: The following floating-point exceptions are signalling: IEEE_DENORMAL
real 0m7.318s
user 0m7.275s
sys 0m0.037s
rm: cannot remove '2605022033524035196.sdijf': No such file or directory
pstopnm: Writing ppmraw format
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pstopnm: Writing ppmraw format
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pstopnm: Writing ppmraw format
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pstopnm: Writing ppmraw format
pstopnm: Writing ppmraw format
pstopnm: Writing ppmraw format
pstopnm: Writing ppmraw format
pstopnm: Writing ppmraw format
pstopnm: Writing ppmraw format
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pstopnm: Writing ppmraw format
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pstopnm: Writing ppmraw format
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pstopnm: Writing ppmraw format
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pstopnm: Writing ppmraw format
pstopnm: Writing ppmraw format
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pstopnm: Writing ppmraw format
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pstopnm: Writing ppmraw format
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pstopnm: Writing ppmraw format
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pstopnm: Writing ppmraw format
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pstopnm: Writing ppmraw format
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pstopnm: Writing ppmraw format
pstopnm: Writing ppmraw format
pstopnm: Writing ppmraw format
pstopnm: Writing ppmraw format
pstopnm: Writing ppmraw format
pstopnm: Writing ppmraw format
pstopnm: Writing ppmraw format
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pstopnm: Writing ppmraw format
If you find results from this site helpful for your research, please cite one of our papers:
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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