CNRS Nantes University US2B US2B
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Should you encounter any unexpected behaviour,
please let us know.
elNémo has been hacked on november 27th.
It has been moved away and runs again.
**Still some additional cleaning from time to time**
Sorry for the inconvenience.


***  FXIa G226A  ***

LOGs for ID: 2602051428002699079

Output from eigenvector calculation:


STDOUT:
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 = 2602051428002699079.atom Pdbmat> Distance cutoff = 15.00 Force constant = 10.00 Origin of mass values = CONS Pdbmat> Levelshift = 1.0E-09 PRINTing level = 2 Pdbmat> Coordinate file 2602051428002699079.atom to be opened. Openam> File opened: 2602051428002699079.atom Pdbmat> Coordinate file in PDB format. Rdatompdb> Reading pdb file. Rdatompdb> End of file reached. Rdatompdb> Number of I/O errors: 0 Rdatompdb> Number of residues found = 238 First residue number = 1 Last residue number = 238 Number of atoms found = 3744 Mean number per residue = 15.7 Pdbmat> Coordinate statistics: = -1.232503 +/- 10.097900 From: -26.545000 To: 22.525000 = 0.064659 +/- 9.376603 From: -21.917000 To: 21.938000 = -0.468634 +/- 10.012134 From: -27.667000 To: 22.199000 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 21.3867 % Filled. Pdbmat> 13491682 non-zero elements. Pdbmat> 1496727 atom-atom interactions. Pdbmat> Number per atom= 799.53 +/- 287.25 Maximum number = 1452 Minimum number = 139 Pdbmat> Matrix trace = 2.993454E+07 Pdbmat> Larger element = 5084.50 Pdbmat> 0 elements larger than +/- 1.0E+10 Pdbmat> Normal end. automatic determination of NRBL (NRBL = nresidues/200 + 1) 238 non-zero elements, NRBL set to 2 Diagonalize Tirion matrix using diagrtb Diagrtb> Diagonalizes a matrix, using the RTB/BNM approximation. Diagrtb> Version 2.52, November 2004. Diagrtb> Options to be read in diagrtb.dat file. Diagrtb> Options taken into account: MATRix filename = pdbmat.sdijb COORdinates filename = 2602051428002699079.atom Eigenvector OUTPut file = matrix.eigenrtb Nb of VECTors required = 106 EigeNVALues chosen = LOWE Type of SUBStructuring = NONE Nb of residues per BLOck = 2 Origin of MASS values = CONS MATRix FORMat = BINA Temporary files cleaning = ALL Output PRINting level = 2 Diagrtb> Memory allocation for Blocpdb. Blocpdb> Entering in. Openam> file on opening on unit 10: diagrtb_work.xyzm Blocpdb> Coordinate file 2602051428002699079.atom to be opened. Openam> file on opening on unit 11: 2602051428002699079.atom Blocpdb> Coordinate file in PDB format. Blocpdb> 3744 atoms picked in pdb file. Blocpdb> All masses set to unity. Blocpdb> Coordinate file is rewritten. Blocpdb> Substructuring: Blocpdb> 2 residue(s) per block. Blocpdb> 238 residues. Blocpdb> 37 atoms in block 1 Block first atom: 1 Blocpdb> 14 atoms in block 2 Block first atom: 38 Blocpdb> 24 atoms in block 3 Block first atom: 52 Blocpdb> 27 atoms in block 4 Block first atom: 76 Blocpdb> 31 atoms in block 5 Block first atom: 103 Blocpdb> 39 atoms in block 6 Block first atom: 134 Blocpdb> 38 atoms in block 7 Block first atom: 173 Blocpdb> 33 atoms in block 8 Block first atom: 211 Blocpdb> 33 atoms in block 9 Block first atom: 244 Blocpdb> 31 atoms in block 10 Block first atom: 277 Blocpdb> 25 atoms in block 11 Block first atom: 308 Blocpdb> 28 atoms in block 12 Block first atom: 333 Blocpdb> 41 atoms in block 13 Block first atom: 361 Blocpdb> 36 atoms in block 14 Block first atom: 402 Blocpdb> 17 atoms in block 15 Block first atom: 438 Blocpdb> 18 atoms in block 16 Block first atom: 455 Blocpdb> 38 atoms in block 17 Block first atom: 473 Blocpdb> 21 atoms in block 18 Block first atom: 511 Blocpdb> 41 atoms in block 19 Block first atom: 532 Blocpdb> 38 atoms in block 20 Block first atom: 573 Blocpdb> 24 atoms in block 21 Block first atom: 611 Blocpdb> 27 atoms in block 22 Block first atom: 635 Blocpdb> 30 atoms in block 23 Block first atom: 662 Blocpdb> 28 atoms in block 24 Block first atom: 692 Blocpdb> 31 atoms in block 25 Block first atom: 720 Blocpdb> 25 atoms in block 26 Block first atom: 751 Blocpdb> 41 atoms in block 27 Block first atom: 776 Blocpdb> 43 atoms in block 28 Block first atom: 817 Blocpdb> 37 atoms in block 29 Block first atom: 860 Blocpdb> 18 atoms in block 30 Block first atom: 897 Blocpdb> 38 atoms in block 31 Block first atom: 915 Blocpdb> 31 atoms in block 32 Block first atom: 953 Blocpdb> 26 atoms in block 33 Block first atom: 984 Blocpdb> 41 atoms in block 34 Block first atom: 1010 Blocpdb> 27 atoms in block 35 Block first atom: 1051 Blocpdb> 25 atoms in block 36 Block first atom: 1078 Blocpdb> 40 atoms in block 37 Block first atom: 1103 Blocpdb> 23 atoms in block 38 Block first atom: 1143 Blocpdb> 32 atoms in block 39 Block first atom: 1166 Blocpdb> 38 atoms in block 40 Block first atom: 1198 Blocpdb> 36 atoms in block 41 Block first atom: 1236 Blocpdb> 29 atoms in block 42 Block first atom: 1272 Blocpdb> 43 atoms in block 43 Block first atom: 1301 Blocpdb> 27 atoms in block 44 Block first atom: 1344 Blocpdb> 26 atoms in block 45 Block first atom: 1371 Blocpdb> 28 atoms in block 46 Block first atom: 1397 Blocpdb> 31 atoms in block 47 Block first atom: 1425 Blocpdb> 29 atoms in block 48 Block first atom: 1456 Blocpdb> 41 atoms in block 49 Block first atom: 1485 Blocpdb> 34 atoms in block 50 Block first atom: 1526 Blocpdb> 28 atoms in block 51 Block first atom: 1560 Blocpdb> 30 atoms in block 52 Block first atom: 1588 Blocpdb> 35 atoms in block 53 Block first atom: 1618 Blocpdb> 23 atoms in block 54 Block first atom: 1653 Blocpdb> 41 atoms in block 55 Block first atom: 1676 Blocpdb> 33 atoms in block 56 Block first atom: 1717 Blocpdb> 30 atoms in block 57 Block first atom: 1750 Blocpdb> 25 atoms in block 58 Block first atom: 1780 Blocpdb> 29 atoms in block 59 Block first atom: 1805 Blocpdb> 36 atoms in block 60 Block first atom: 1834 Blocpdb> 30 atoms in block 61 Block first atom: 1870 Blocpdb> 40 atoms in block 62 Block first atom: 1900 Blocpdb> 26 atoms in block 63 Block first atom: 1940 Blocpdb> 34 atoms in block 64 Block first atom: 1966 Blocpdb> 30 atoms in block 65 Block first atom: 2000 Blocpdb> 31 atoms in block 66 Block first atom: 2030 Blocpdb> 28 atoms in block 67 Block first atom: 2061 Blocpdb> 46 atoms in block 68 Block first atom: 2089 Blocpdb> 43 atoms in block 69 Block first atom: 2135 Blocpdb> 34 atoms in block 70 Block first atom: 2178 Blocpdb> 36 atoms in block 71 Block first atom: 2212 Blocpdb> 28 atoms in block 72 Block first atom: 2248 Blocpdb> 36 atoms in block 73 Block first atom: 2276 Blocpdb> 32 atoms in block 74 Block first atom: 2312 Blocpdb> 41 atoms in block 75 Block first atom: 2344 Blocpdb> 33 atoms in block 76 Block first atom: 2385 Blocpdb> 30 atoms in block 77 Block first atom: 2418 Blocpdb> 29 atoms in block 78 Block first atom: 2448 Blocpdb> 25 atoms in block 79 Block first atom: 2477 Blocpdb> 39 atoms in block 80 Block first atom: 2502 Blocpdb> 45 atoms in block 81 Block first atom: 2541 Blocpdb> 31 atoms in block 82 Block first atom: 2586 Blocpdb> 39 atoms in block 83 Block first atom: 2617 Blocpdb> 33 atoms in block 84 Block first atom: 2656 Blocpdb> 39 atoms in block 85 Block first atom: 2689 Blocpdb> 36 atoms in block 86 Block first atom: 2728 Blocpdb> 20 atoms in block 87 Block first atom: 2764 Blocpdb> 28 atoms in block 88 Block first atom: 2784 Blocpdb> 39 atoms in block 89 Block first atom: 2812 Blocpdb> 14 atoms in block 90 Block first atom: 2851 Blocpdb> 34 atoms in block 91 Block first atom: 2865 Blocpdb> 20 atoms in block 92 Block first atom: 2899 Blocpdb> 29 atoms in block 93 Block first atom: 2919 Blocpdb> 23 atoms in block 94 Block first atom: 2948 Blocpdb> 14 atoms in block 95 Block first atom: 2971 Blocpdb> 33 atoms in block 96 Block first atom: 2985 Blocpdb> 21 atoms in block 97 Block first atom: 3018 Blocpdb> 39 atoms in block 98 Block first atom: 3039 Blocpdb> 29 atoms in block 99 Block first atom: 3078 Blocpdb> 40 atoms in block 100 Block first atom: 3107 Blocpdb> 36 atoms in block 101 Block first atom: 3147 Blocpdb> 23 atoms in block 102 Block first atom: 3183 Blocpdb> 33 atoms in block 103 Block first atom: 3206 Blocpdb> 35 atoms in block 104 Block first atom: 3239 Blocpdb> 22 atoms in block 105 Block first atom: 3274 Blocpdb> 17 atoms in block 106 Block first atom: 3296 Blocpdb> 27 atoms in block 107 Block first atom: 3313 Blocpdb> 39 atoms in block 108 Block first atom: 3340 Blocpdb> 38 atoms in block 109 Block first atom: 3379 Blocpdb> 26 atoms in block 110 Block first atom: 3417 Blocpdb> 35 atoms in block 111 Block first atom: 3443 Blocpdb> 30 atoms in block 112 Block first atom: 3478 Blocpdb> 31 atoms in block 113 Block first atom: 3508 Blocpdb> 37 atoms in block 114 Block first atom: 3539 Blocpdb> 36 atoms in block 115 Block first atom: 3576 Blocpdb> 38 atoms in block 116 Block first atom: 3612 Blocpdb> 37 atoms in block 117 Block first atom: 3650 Blocpdb> 31 atoms in block 118 Block first atom: 3687 Blocpdb> 27 atoms in block 119 Block first atom: 3717 Blocpdb> 119 blocks. Blocpdb> At most, 46 atoms in each of them. Blocpdb> At least, 14 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> 13491801 matrix lines read. Prepmat> Matrix order = 11232 Prepmat> Matrix trace = 29934540.0000 Prepmat> Last element read: 11232 11232 1041.6003 Prepmat> 7141 lines saved. Prepmat> 3549 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: 3744 RTB> Total mass = 3744.0000 RTB> Number of atoms found in matrix: 3744 RTB> Number of blocks = 119 RTB> Projection begins. RTB> Projected matrix is being saved. RTB> Projected matrix trace = 1852356.9130 RTB> 127491 non-zero elements. RTB> Normal end of RTB. Diagstd> Entering in. Openam> file on opening on unit 10: diagrtb_work.sdijb Diagstd> Projected matrix to be read from file: diagrtb_work.sdijb Diagstd> CERFACS matrix format. Diagstd> Projected matrix order = 714 Diagstd> Nb of non-zero elements: 127491 Diagstd> Projected matrix trace = 1852356.9130 Openam> file on opening on unit 11: diagrtb_work.eigenfacs Diagstd> Diagonalization. Diagstd> 714 eigenvectors are computed. Diagstd> 106 of them to be saved. Diagstd> Sum of eigenvalues =1852356.9130 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 187.1806366 208.2958805 239.1049925 282.4986573 310.7952256 354.4173703 384.1920362 396.0886118 435.8814922 457.7936901 467.8006312 474.6988307 516.2360386 533.6600095 541.1032964 563.7347464 587.1818511 599.0758250 617.4415441 630.5920406 635.2326171 640.5026400 645.1391141 654.1216698 663.5806624 671.0347557 680.6195272 716.4171998 721.2628375 727.1628038 744.1639166 762.8250467 771.0789837 784.3669736 793.5398596 808.9826456 817.9009188 833.6003023 847.7595034 856.2157932 870.2475412 885.9067919 889.8033679 894.9787616 910.0890961 920.9373728 932.7117224 942.7759396 961.4730300 966.1545078 981.7744227 986.9981629 996.7679572 1003.9376870 1016.0355759 1021.2699555 1038.6214606 1052.7208457 1055.5992508 1060.8767654 1079.7430189 1087.0783331 1091.2900431 1115.6618155 1125.2126624 1128.1139741 1135.3888081 1143.6295251 1166.6488611 1171.3041301 1176.5711541 1179.2966674 1195.3443079 1201.1992636 1223.9273696 1230.7134895 1234.4291651 1243.9314973 1251.3263441 1267.3011167 1269.4529049 1278.5678326 1287.4923292 1294.0591872 1309.4587333 1319.8961984 1322.0143631 1325.4245082 1339.6070739 1345.7688584 1352.9212904 1362.4676472 1371.3736544 1372.4792307 1388.3379821 1394.4641401 1398.4760514 1400.2451629 1404.2866220 1407.5889238 Diagstd> Frequencies (cm-1, if the input matrix is a hessian in CHARMM units): 0.0034202 0.0034217 0.0034243 0.0034250 0.0034261 0.0034423 1485.6815846 1567.2404089 1679.1504200 1825.1706409 1914.3989597 2044.3383688 2128.4794396 2161.1825797 2267.1460312 2323.4331500 2348.6899097 2365.9434565 2467.2856908 2508.5780048 2526.0117715 2578.2954499 2631.3680193 2657.8849469 2698.3184563 2726.9019509 2736.9173020 2748.2468719 2758.1759483 2777.3112197 2797.3199398 2812.9874047 2833.0059247 2906.5532385 2916.3662141 2928.2699316 2962.3037218 2999.2160563 3015.3984928 3041.2696627 3059.0012427 3088.6228697 3105.6007885 3135.2646946 3161.7797506 3177.5097909 3203.4406535 3232.1335397 3239.2338553 3248.6404304 3275.9497826 3295.4166303 3316.4159700 3334.2604846 3367.1606196 3375.3481328 3402.5235289 3411.5634462 3428.4065368 3440.7146694 3461.3836478 3470.2883167 3499.6444683 3523.3183984 3528.1319321 3536.9404613 3568.2517106 3580.3517859 3587.2808293 3627.1170002 3642.6092463 3647.3023775 3659.0436026 3672.2983691 3709.0728292 3716.4656026 3724.8121784 3729.1239248 3754.4107886 3763.5943588 3799.0333285 3809.5507250 3815.2971424 3829.9536007 3841.3207673 3865.7626797 3869.0431844 3882.9085947 3896.4365218 3906.3607755 3929.5352458 3945.1649791 3948.3293034 3953.4183949 3974.5136821 3983.6439713 3994.2159891 4008.2830249 4021.3621066 4022.9827541 4046.1584209 4055.0756019 4060.9046937 4063.4724612 4069.3323368 4074.1142212 Diagstd> Normal end. Rtb_to_modes> Entering in. Rtb_to_modes> Number of atoms in temporary block-file = 3744 Rtb_to_modes> Number of blocs = 119 Openam> file on opening on unit 10: diagrtb_work.eigenfacs Openam> file on opening on unit 11: matrix.eigenrtb Rdmodfacs> Entering in. Rdmodfacs> Old Blzpack file format detected. Rdmodfacs> Eigenvector number: 1 Rdmodfacs> Corresponding eigenvalue: 9.9199E-10 Rdmodfacs> Eigenvector number: 2 Rdmodfacs> Corresponding eigenvalue: 9.9288E-10 Rdmodfacs> Eigenvector number: 3 Rdmodfacs> Corresponding eigenvalue: 9.9437E-10 Rdmodfacs> Eigenvector number: 4 Rdmodfacs> Corresponding eigenvalue: 9.9477E-10 Rdmodfacs> Eigenvector number: 5 Rdmodfacs> Corresponding eigenvalue: 9.9543E-10 Rdmodfacs> Eigenvector number: 6 Rdmodfacs> Corresponding eigenvalue: 1.0049E-09 Rdmodfacs> Eigenvector number: 7 Rdmodfacs> Corresponding eigenvalue: 187.2 Rdmodfacs> Eigenvector number: 8 Rdmodfacs> Corresponding eigenvalue: 208.3 Rdmodfacs> Eigenvector number: 9 Rdmodfacs> Corresponding eigenvalue: 239.1 Rdmodfacs> Eigenvector number: 10 Rdmodfacs> Corresponding eigenvalue: 282.5 Rdmodfacs> Eigenvector number: 11 Rdmodfacs> Corresponding eigenvalue: 310.8 Rdmodfacs> Eigenvector number: 12 Rdmodfacs> Corresponding eigenvalue: 354.4 Rdmodfacs> Eigenvector number: 13 Rdmodfacs> Corresponding eigenvalue: 384.2 Rdmodfacs> Eigenvector number: 14 Rdmodfacs> Corresponding eigenvalue: 396.1 Rdmodfacs> Eigenvector number: 15 Rdmodfacs> Corresponding eigenvalue: 435.9 Rdmodfacs> Eigenvector number: 16 Rdmodfacs> Corresponding eigenvalue: 457.8 Rdmodfacs> Eigenvector number: 17 Rdmodfacs> Corresponding eigenvalue: 467.8 Rdmodfacs> Eigenvector number: 18 Rdmodfacs> Corresponding eigenvalue: 474.7 Rdmodfacs> Eigenvector number: 19 Rdmodfacs> Corresponding eigenvalue: 516.2 Rdmodfacs> Eigenvector number: 20 Rdmodfacs> Corresponding eigenvalue: 533.7 Rdmodfacs> Eigenvector number: 21 Rdmodfacs> Corresponding eigenvalue: 541.1 Rdmodfacs> Eigenvector number: 22 Rdmodfacs> Corresponding eigenvalue: 563.7 Rdmodfacs> Eigenvector number: 23 Rdmodfacs> Corresponding eigenvalue: 587.2 Rdmodfacs> Eigenvector number: 24 Rdmodfacs> Corresponding eigenvalue: 599.1 Rdmodfacs> Eigenvector number: 25 Rdmodfacs> Corresponding eigenvalue: 617.4 Rdmodfacs> Eigenvector number: 26 Rdmodfacs> Corresponding eigenvalue: 630.6 Rdmodfacs> Eigenvector number: 27 Rdmodfacs> Corresponding eigenvalue: 635.2 Rdmodfacs> Eigenvector number: 28 Rdmodfacs> Corresponding eigenvalue: 640.5 Rdmodfacs> Eigenvector number: 29 Rdmodfacs> Corresponding eigenvalue: 645.1 Rdmodfacs> Eigenvector number: 30 Rdmodfacs> Corresponding eigenvalue: 654.1 Rdmodfacs> Eigenvector number: 31 Rdmodfacs> Corresponding eigenvalue: 663.6 Rdmodfacs> Eigenvector number: 32 Rdmodfacs> Corresponding eigenvalue: 671.0 Rdmodfacs> Eigenvector number: 33 Rdmodfacs> Corresponding eigenvalue: 680.6 Rdmodfacs> Eigenvector number: 34 Rdmodfacs> Corresponding eigenvalue: 716.4 Rdmodfacs> Eigenvector number: 35 Rdmodfacs> Corresponding eigenvalue: 721.3 Rdmodfacs> Eigenvector number: 36 Rdmodfacs> Corresponding eigenvalue: 727.2 Rdmodfacs> Eigenvector number: 37 Rdmodfacs> Corresponding eigenvalue: 744.2 Rdmodfacs> Eigenvector number: 38 Rdmodfacs> Corresponding eigenvalue: 762.8 Rdmodfacs> Eigenvector number: 39 Rdmodfacs> Corresponding eigenvalue: 771.1 Rdmodfacs> Eigenvector number: 40 Rdmodfacs> Corresponding eigenvalue: 784.4 Rdmodfacs> Eigenvector number: 41 Rdmodfacs> Corresponding eigenvalue: 793.5 Rdmodfacs> Eigenvector number: 42 Rdmodfacs> Corresponding eigenvalue: 809.0 Rdmodfacs> Eigenvector number: 43 Rdmodfacs> Corresponding eigenvalue: 817.9 Rdmodfacs> Eigenvector number: 44 Rdmodfacs> Corresponding eigenvalue: 833.6 Rdmodfacs> Eigenvector number: 45 Rdmodfacs> Corresponding eigenvalue: 847.8 Rdmodfacs> Eigenvector number: 46 Rdmodfacs> Corresponding eigenvalue: 856.2 Rdmodfacs> Eigenvector number: 47 Rdmodfacs> Corresponding eigenvalue: 870.2 Rdmodfacs> Eigenvector number: 48 Rdmodfacs> Corresponding eigenvalue: 885.9 Rdmodfacs> Eigenvector number: 49 Rdmodfacs> Corresponding eigenvalue: 889.8 Rdmodfacs> Eigenvector number: 50 Rdmodfacs> Corresponding eigenvalue: 895.0 Rdmodfacs> Eigenvector number: 51 Rdmodfacs> Corresponding eigenvalue: 910.1 Rdmodfacs> Eigenvector number: 52 Rdmodfacs> Corresponding eigenvalue: 920.9 Rdmodfacs> Eigenvector number: 53 Rdmodfacs> Corresponding eigenvalue: 932.7 Rdmodfacs> Eigenvector number: 54 Rdmodfacs> Corresponding eigenvalue: 942.8 Rdmodfacs> Eigenvector number: 55 Rdmodfacs> Corresponding eigenvalue: 961.5 Rdmodfacs> Eigenvector number: 56 Rdmodfacs> Corresponding eigenvalue: 966.2 Rdmodfacs> Eigenvector number: 57 Rdmodfacs> Corresponding eigenvalue: 981.8 Rdmodfacs> Eigenvector number: 58 Rdmodfacs> Corresponding eigenvalue: 987.0 Rdmodfacs> Eigenvector number: 59 Rdmodfacs> Corresponding eigenvalue: 996.8 Rdmodfacs> Eigenvector number: 60 Rdmodfacs> Corresponding eigenvalue: 1004. Rdmodfacs> Eigenvector number: 61 Rdmodfacs> Corresponding eigenvalue: 1016. Rdmodfacs> Eigenvector number: 62 Rdmodfacs> Corresponding eigenvalue: 1021. Rdmodfacs> Eigenvector number: 63 Rdmodfacs> Corresponding eigenvalue: 1039. Rdmodfacs> Eigenvector number: 64 Rdmodfacs> Corresponding eigenvalue: 1053. Rdmodfacs> Eigenvector number: 65 Rdmodfacs> Corresponding eigenvalue: 1056. Rdmodfacs> Eigenvector number: 66 Rdmodfacs> Corresponding eigenvalue: 1061. Rdmodfacs> Eigenvector number: 67 Rdmodfacs> Corresponding eigenvalue: 1080. Rdmodfacs> Eigenvector number: 68 Rdmodfacs> Corresponding eigenvalue: 1087. Rdmodfacs> Eigenvector number: 69 Rdmodfacs> Corresponding eigenvalue: 1091. Rdmodfacs> Eigenvector number: 70 Rdmodfacs> Corresponding eigenvalue: 1116. Rdmodfacs> Eigenvector number: 71 Rdmodfacs> Corresponding eigenvalue: 1125. Rdmodfacs> Eigenvector number: 72 Rdmodfacs> Corresponding eigenvalue: 1128. Rdmodfacs> Eigenvector number: 73 Rdmodfacs> Corresponding eigenvalue: 1135. Rdmodfacs> Eigenvector number: 74 Rdmodfacs> Corresponding eigenvalue: 1144. Rdmodfacs> Eigenvector number: 75 Rdmodfacs> Corresponding eigenvalue: 1167. Rdmodfacs> Eigenvector number: 76 Rdmodfacs> Corresponding eigenvalue: 1171. Rdmodfacs> Eigenvector number: 77 Rdmodfacs> Corresponding eigenvalue: 1177. Rdmodfacs> Eigenvector number: 78 Rdmodfacs> Corresponding eigenvalue: 1179. Rdmodfacs> Eigenvector number: 79 Rdmodfacs> Corresponding eigenvalue: 1195. Rdmodfacs> Eigenvector number: 80 Rdmodfacs> Corresponding eigenvalue: 1201. Rdmodfacs> Eigenvector number: 81 Rdmodfacs> Corresponding eigenvalue: 1224. Rdmodfacs> Eigenvector number: 82 Rdmodfacs> Corresponding eigenvalue: 1231. Rdmodfacs> Eigenvector number: 83 Rdmodfacs> Corresponding eigenvalue: 1234. Rdmodfacs> Eigenvector number: 84 Rdmodfacs> Corresponding eigenvalue: 1244. Rdmodfacs> Eigenvector number: 85 Rdmodfacs> Corresponding eigenvalue: 1251. Rdmodfacs> Eigenvector number: 86 Rdmodfacs> Corresponding eigenvalue: 1267. Rdmodfacs> Eigenvector number: 87 Rdmodfacs> Corresponding eigenvalue: 1269. Rdmodfacs> Eigenvector number: 88 Rdmodfacs> Corresponding eigenvalue: 1279. Rdmodfacs> Eigenvector number: 89 Rdmodfacs> Corresponding eigenvalue: 1287. Rdmodfacs> Eigenvector number: 90 Rdmodfacs> Corresponding eigenvalue: 1294. Rdmodfacs> Eigenvector number: 91 Rdmodfacs> Corresponding eigenvalue: 1309. Rdmodfacs> Eigenvector number: 92 Rdmodfacs> Corresponding eigenvalue: 1320. Rdmodfacs> Eigenvector number: 93 Rdmodfacs> Corresponding eigenvalue: 1322. Rdmodfacs> Eigenvector number: 94 Rdmodfacs> Corresponding eigenvalue: 1325. Rdmodfacs> Eigenvector number: 95 Rdmodfacs> Corresponding eigenvalue: 1340. Rdmodfacs> Eigenvector number: 96 Rdmodfacs> Corresponding eigenvalue: 1346. Rdmodfacs> Eigenvector number: 97 Rdmodfacs> Corresponding eigenvalue: 1353. Rdmodfacs> Eigenvector number: 98 Rdmodfacs> Corresponding eigenvalue: 1362. Rdmodfacs> Eigenvector number: 99 Rdmodfacs> Corresponding eigenvalue: 1371. Rdmodfacs> Eigenvector number: 100 Rdmodfacs> Corresponding eigenvalue: 1372. Rdmodfacs> Eigenvector number: 101 Rdmodfacs> Corresponding eigenvalue: 1388. Rdmodfacs> Eigenvector number: 102 Rdmodfacs> Corresponding eigenvalue: 1394. Rdmodfacs> Eigenvector number: 103 Rdmodfacs> Corresponding eigenvalue: 1398. Rdmodfacs> Eigenvector number: 104 Rdmodfacs> Corresponding eigenvalue: 1400. Rdmodfacs> Eigenvector number: 105 Rdmodfacs> Corresponding eigenvalue: 1404. Rdmodfacs> Eigenvector number: 106 Rdmodfacs> Corresponding eigenvalue: 1408. Rtb_to_modes> 106 vectors, with 714 coordinates in vector file. Norm of eigenvectors in projected coordinates (one expected): 1.00001 1.00001 1.00002 0.99999 0.99999 1.00002 1.00001 0.99995 0.99996 0.99999 0.99999 1.00003 1.00000 1.00002 0.99999 1.00002 1.00003 0.99999 0.99999 0.99998 1.00002 0.99997 1.00002 1.00002 0.99999 1.00001 0.99996 1.00002 1.00001 1.00001 0.99999 1.00000 1.00002 0.99999 1.00001 0.99997 0.99999 1.00001 1.00001 1.00001 1.00005 1.00000 1.00002 1.00001 1.00005 1.00001 0.99998 1.00003 1.00000 1.00001 1.00000 1.00000 1.00000 1.00003 0.99998 0.99997 1.00004 0.99999 0.99999 0.99999 1.00000 0.99997 0.99999 1.00000 1.00001 0.99997 1.00001 0.99999 1.00001 1.00002 1.00005 1.00003 0.99998 1.00001 1.00000 1.00003 1.00000 1.00001 1.00001 1.00001 1.00002 1.00001 1.00000 1.00002 1.00002 1.00004 1.00001 0.99996 1.00000 0.99998 1.00003 1.00000 0.99997 0.99998 1.00000 1.00001 1.00002 0.99999 1.00003 0.99997 1.00000 0.99999 1.00004 0.99999 1.00002 1.00001 Rtb_to_modes> RTB block-file is being read. Rtb_to_modes> 67392 lines found in RTB file. Norm of eigenvectors in cartesian coordinates (one expected): 1.00001 1.00001 1.00002 0.99999 0.99999 1.00002 1.00001 0.99995 0.99996 0.99999 0.99999 1.00003 1.00000 1.00002 0.99999 1.00002 1.00003 0.99999 0.99999 0.99998 1.00002 0.99997 1.00002 1.00002 0.99999 1.00001 0.99996 1.00002 1.00001 1.00001 0.99999 1.00000 1.00002 0.99999 1.00001 0.99997 0.99999 1.00001 1.00001 1.00001 1.00005 1.00000 1.00002 1.00001 1.00005 1.00001 0.99998 1.00003 1.00000 1.00001 1.00000 1.00000 1.00000 1.00003 0.99998 0.99997 1.00004 0.99999 0.99999 0.99999 1.00000 0.99997 0.99999 1.00000 1.00001 0.99997 1.00001 0.99999 1.00001 1.00002 1.00005 1.00003 0.99998 1.00001 1.00000 1.00003 1.00000 1.00001 1.00001 1.00001 1.00002 1.00001 1.00000 1.00002 1.00002 1.00004 1.00001 0.99996 1.00000 0.99998 1.00003 1.00000 0.99997 0.99998 1.00000 1.00001 1.00002 0.99999 1.00003 0.99997 1.00000 0.99999 1.00004 0.99999 1.00002 1.00001 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> 2602051428002699079.eigenfacs Openam> file on opening on unit 10: 2602051428002699079.eigenfacs Getnam> Corresponding pdb filename ? Getnam> 2602051428002699079.atom Openam> file on opening on unit 11: 2602051428002699079.atom Getnum> Number of skipped eigenvectors ? Getnum> 0 Getnum> Number of usefull eigenvectors ? Getnum> 10000 %Getnum-Err: number larger than 106 This is not allowed. Sorry. Rdatompdb> Reading pdb file. Rdatompdb> End of file reached. Rdatompdb> Number of I/O errors: 0 Rdatompdb> Number of residues found = 238 First residue number = 1 Last residue number = 238 Number of atoms found = 3744 Mean number per residue = 15.7 Rdmodfacs> Old Blzpack file format detected. Rdmodfacs> Numero du vecteur CERFACS en lecture: 1 Rdmodfacs> Valeur propre du vecteur en lecture: 9.9199E-10 Rdmodfacs> Numero du vecteur CERFACS en lecture: 2 Rdmodfacs> Valeur propre du vecteur en lecture: 9.9288E-10 Rdmodfacs> Numero du vecteur CERFACS en lecture: 3 Rdmodfacs> Valeur propre du vecteur en lecture: 9.9437E-10 Rdmodfacs> Numero du vecteur CERFACS en lecture: 4 Rdmodfacs> Valeur propre du vecteur en lecture: 9.9477E-10 Rdmodfacs> Numero du vecteur CERFACS en lecture: 5 Rdmodfacs> Valeur propre du vecteur en lecture: 9.9543E-10 Rdmodfacs> Numero du vecteur CERFACS en lecture: 6 Rdmodfacs> Valeur propre du vecteur en lecture: 1.0049E-09 Rdmodfacs> Numero du vecteur CERFACS en lecture: 7 Rdmodfacs> Valeur propre du vecteur en lecture: 187.2 Rdmodfacs> Numero du vecteur CERFACS en lecture: 8 Rdmodfacs> Valeur propre du vecteur en lecture: 208.3 Rdmodfacs> Numero du vecteur CERFACS en lecture: 9 Rdmodfacs> Valeur propre du vecteur en lecture: 239.1 Rdmodfacs> Numero du vecteur CERFACS en lecture: 10 Rdmodfacs> Valeur propre du vecteur en lecture: 282.5 Rdmodfacs> Numero du vecteur CERFACS en lecture: 11 Rdmodfacs> Valeur propre du vecteur en lecture: 310.8 Rdmodfacs> Numero du vecteur CERFACS en lecture: 12 Rdmodfacs> Valeur propre du vecteur en lecture: 354.4 Rdmodfacs> Numero du vecteur CERFACS en lecture: 13 Rdmodfacs> Valeur propre du vecteur en lecture: 384.2 Rdmodfacs> Numero du vecteur CERFACS en lecture: 14 Rdmodfacs> Valeur propre du vecteur en lecture: 396.1 Rdmodfacs> Numero du vecteur CERFACS en lecture: 15 Rdmodfacs> Valeur propre du vecteur en lecture: 435.9 Rdmodfacs> Numero du vecteur CERFACS en lecture: 16 Rdmodfacs> Valeur propre du vecteur en lecture: 457.8 Rdmodfacs> Numero du vecteur CERFACS en lecture: 17 Rdmodfacs> Valeur propre du vecteur en lecture: 467.8 Rdmodfacs> Numero du vecteur CERFACS en lecture: 18 Rdmodfacs> Valeur propre du vecteur en lecture: 474.7 Rdmodfacs> Numero du vecteur CERFACS en lecture: 19 Rdmodfacs> Valeur propre du vecteur en lecture: 516.2 Rdmodfacs> Numero du vecteur CERFACS en lecture: 20 Rdmodfacs> Valeur propre du vecteur en lecture: 533.7 Rdmodfacs> Numero du vecteur CERFACS en lecture: 21 Rdmodfacs> Valeur propre du vecteur en lecture: 541.1 Rdmodfacs> Numero du vecteur CERFACS en lecture: 22 Rdmodfacs> Valeur propre du vecteur en lecture: 563.7 Rdmodfacs> Numero du vecteur CERFACS en lecture: 23 Rdmodfacs> Valeur propre du vecteur en lecture: 587.2 Rdmodfacs> Numero du vecteur CERFACS en lecture: 24 Rdmodfacs> Valeur propre du vecteur en lecture: 599.1 Rdmodfacs> Numero du vecteur CERFACS en lecture: 25 Rdmodfacs> Valeur propre du vecteur en lecture: 617.4 Rdmodfacs> Numero du vecteur CERFACS en lecture: 26 Rdmodfacs> Valeur propre du vecteur en lecture: 630.6 Rdmodfacs> Numero du vecteur CERFACS en lecture: 27 Rdmodfacs> Valeur propre du vecteur en lecture: 635.2 Rdmodfacs> Numero du vecteur CERFACS en lecture: 28 Rdmodfacs> Valeur propre du vecteur en lecture: 640.5 Rdmodfacs> Numero du vecteur CERFACS en lecture: 29 Rdmodfacs> Valeur propre du vecteur en lecture: 645.1 Rdmodfacs> Numero du vecteur CERFACS en lecture: 30 Rdmodfacs> Valeur propre du vecteur en lecture: 654.1 Rdmodfacs> Numero du vecteur CERFACS en lecture: 31 Rdmodfacs> Valeur propre du vecteur en lecture: 663.6 Rdmodfacs> Numero du vecteur CERFACS en lecture: 32 Rdmodfacs> Valeur propre du vecteur en lecture: 671.0 Rdmodfacs> Numero du vecteur CERFACS en lecture: 33 Rdmodfacs> Valeur propre du vecteur en lecture: 680.6 Rdmodfacs> Numero du vecteur CERFACS en lecture: 34 Rdmodfacs> Valeur propre du vecteur en lecture: 716.4 Rdmodfacs> Numero du vecteur CERFACS en lecture: 35 Rdmodfacs> Valeur propre du vecteur en lecture: 721.3 Rdmodfacs> Numero du vecteur CERFACS en lecture: 36 Rdmodfacs> Valeur propre du vecteur en lecture: 727.2 Rdmodfacs> Numero du vecteur CERFACS en lecture: 37 Rdmodfacs> Valeur propre du vecteur en lecture: 744.2 Rdmodfacs> Numero du vecteur CERFACS en lecture: 38 Rdmodfacs> Valeur propre du vecteur en lecture: 762.8 Rdmodfacs> Numero du vecteur CERFACS en lecture: 39 Rdmodfacs> Valeur propre du vecteur en lecture: 771.1 Rdmodfacs> Numero du vecteur CERFACS en lecture: 40 Rdmodfacs> Valeur propre du vecteur en lecture: 784.4 Rdmodfacs> Numero du vecteur CERFACS en lecture: 41 Rdmodfacs> Valeur propre du vecteur en lecture: 793.5 Rdmodfacs> Numero du vecteur CERFACS en lecture: 42 Rdmodfacs> Valeur propre du vecteur en lecture: 809.0 Rdmodfacs> Numero du vecteur CERFACS en lecture: 43 Rdmodfacs> Valeur propre du vecteur en lecture: 817.9 Rdmodfacs> Numero du vecteur CERFACS en lecture: 44 Rdmodfacs> Valeur propre du vecteur en lecture: 833.6 Rdmodfacs> Numero du vecteur CERFACS en lecture: 45 Rdmodfacs> Valeur propre du vecteur en lecture: 847.8 Rdmodfacs> Numero du vecteur CERFACS en lecture: 46 Rdmodfacs> Valeur propre du vecteur en lecture: 856.2 Rdmodfacs> Numero du vecteur CERFACS en lecture: 47 Rdmodfacs> Valeur propre du vecteur en lecture: 870.2 Rdmodfacs> Numero du vecteur CERFACS en lecture: 48 Rdmodfacs> Valeur propre du vecteur en lecture: 885.9 Rdmodfacs> Numero du vecteur CERFACS en lecture: 49 Rdmodfacs> Valeur propre du vecteur en lecture: 889.8 Rdmodfacs> Numero du vecteur CERFACS en lecture: 50 Rdmodfacs> Valeur propre du vecteur en lecture: 895.0 Rdmodfacs> Numero du vecteur CERFACS en lecture: 51 Rdmodfacs> Valeur propre du vecteur en lecture: 910.1 Rdmodfacs> Numero du vecteur CERFACS en lecture: 52 Rdmodfacs> Valeur propre du vecteur en lecture: 920.9 Rdmodfacs> Numero du vecteur CERFACS en lecture: 53 Rdmodfacs> Valeur propre du vecteur en lecture: 932.7 Rdmodfacs> Numero du vecteur CERFACS en lecture: 54 Rdmodfacs> Valeur propre du vecteur en lecture: 942.8 Rdmodfacs> Numero du vecteur CERFACS en lecture: 55 Rdmodfacs> Valeur propre du vecteur en lecture: 961.5 Rdmodfacs> Numero du vecteur CERFACS en lecture: 56 Rdmodfacs> Valeur propre du vecteur en lecture: 966.2 Rdmodfacs> Numero du vecteur CERFACS en lecture: 57 Rdmodfacs> Valeur propre du vecteur en lecture: 981.8 Rdmodfacs> Numero du vecteur CERFACS en lecture: 58 Rdmodfacs> Valeur propre du vecteur en lecture: 987.0 Rdmodfacs> Numero du vecteur CERFACS en lecture: 59 Rdmodfacs> Valeur propre du vecteur en lecture: 996.8 Rdmodfacs> Numero du vecteur CERFACS en lecture: 60 Rdmodfacs> Valeur propre du vecteur en lecture: 1004. Rdmodfacs> Numero du vecteur CERFACS en lecture: 61 Rdmodfacs> Valeur propre du vecteur en lecture: 1016. Rdmodfacs> Numero du vecteur CERFACS en lecture: 62 Rdmodfacs> Valeur propre du vecteur en lecture: 1021. Rdmodfacs> Numero du vecteur CERFACS en lecture: 63 Rdmodfacs> Valeur propre du vecteur en lecture: 1039. Rdmodfacs> Numero du vecteur CERFACS en lecture: 64 Rdmodfacs> Valeur propre du vecteur en lecture: 1053. Rdmodfacs> Numero du vecteur CERFACS en lecture: 65 Rdmodfacs> Valeur propre du vecteur en lecture: 1056. Rdmodfacs> Numero du vecteur CERFACS en lecture: 66 Rdmodfacs> Valeur propre du vecteur en lecture: 1061. Rdmodfacs> Numero du vecteur CERFACS en lecture: 67 Rdmodfacs> Valeur propre du vecteur en lecture: 1080. Rdmodfacs> Numero du vecteur CERFACS en lecture: 68 Rdmodfacs> Valeur propre du vecteur en lecture: 1087. Rdmodfacs> Numero du vecteur CERFACS en lecture: 69 Rdmodfacs> Valeur propre du vecteur en lecture: 1091. Rdmodfacs> Numero du vecteur CERFACS en lecture: 70 Rdmodfacs> Valeur propre du vecteur en lecture: 1116. Rdmodfacs> Numero du vecteur CERFACS en lecture: 71 Rdmodfacs> Valeur propre du vecteur en lecture: 1125. Rdmodfacs> Numero du vecteur CERFACS en lecture: 72 Rdmodfacs> Valeur propre du vecteur en lecture: 1128. Rdmodfacs> Numero du vecteur CERFACS en lecture: 73 Rdmodfacs> Valeur propre du vecteur en lecture: 1135. Rdmodfacs> Numero du vecteur CERFACS en lecture: 74 Rdmodfacs> Valeur propre du vecteur en lecture: 1144. Rdmodfacs> Numero du vecteur CERFACS en lecture: 75 Rdmodfacs> Valeur propre du vecteur en lecture: 1167. Rdmodfacs> Numero du vecteur CERFACS en lecture: 76 Rdmodfacs> Valeur propre du vecteur en lecture: 1171. Rdmodfacs> Numero du vecteur CERFACS en lecture: 77 Rdmodfacs> Valeur propre du vecteur en lecture: 1177. Rdmodfacs> Numero du vecteur CERFACS en lecture: 78 Rdmodfacs> Valeur propre du vecteur en lecture: 1179. Rdmodfacs> Numero du vecteur CERFACS en lecture: 79 Rdmodfacs> Valeur propre du vecteur en lecture: 1195. Rdmodfacs> Numero du vecteur CERFACS en lecture: 80 Rdmodfacs> Valeur propre du vecteur en lecture: 1201. Rdmodfacs> Numero du vecteur CERFACS en lecture: 81 Rdmodfacs> Valeur propre du vecteur en lecture: 1224. Rdmodfacs> Numero du vecteur CERFACS en lecture: 82 Rdmodfacs> Valeur propre du vecteur en lecture: 1231. Rdmodfacs> Numero du vecteur CERFACS en lecture: 83 Rdmodfacs> Valeur propre du vecteur en lecture: 1234. Rdmodfacs> Numero du vecteur CERFACS en lecture: 84 Rdmodfacs> Valeur propre du vecteur en lecture: 1244. Rdmodfacs> Numero du vecteur CERFACS en lecture: 85 Rdmodfacs> Valeur propre du vecteur en lecture: 1251. Rdmodfacs> Numero du vecteur CERFACS en lecture: 86 Rdmodfacs> Valeur propre du vecteur en lecture: 1267. Rdmodfacs> Numero du vecteur CERFACS en lecture: 87 Rdmodfacs> Valeur propre du vecteur en lecture: 1269. Rdmodfacs> Numero du vecteur CERFACS en lecture: 88 Rdmodfacs> Valeur propre du vecteur en lecture: 1279. Rdmodfacs> Numero du vecteur CERFACS en lecture: 89 Rdmodfacs> Valeur propre du vecteur en lecture: 1287. Rdmodfacs> Numero du vecteur CERFACS en lecture: 90 Rdmodfacs> Valeur propre du vecteur en lecture: 1294. Rdmodfacs> Numero du vecteur CERFACS en lecture: 91 Rdmodfacs> Valeur propre du vecteur en lecture: 1309. Rdmodfacs> Numero du vecteur CERFACS en lecture: 92 Rdmodfacs> Valeur propre du vecteur en lecture: 1320. Rdmodfacs> Numero du vecteur CERFACS en lecture: 93 Rdmodfacs> Valeur propre du vecteur en lecture: 1322. Rdmodfacs> Numero du vecteur CERFACS en lecture: 94 Rdmodfacs> Valeur propre du vecteur en lecture: 1325. Rdmodfacs> Numero du vecteur CERFACS en lecture: 95 Rdmodfacs> Valeur propre du vecteur en lecture: 1340. Rdmodfacs> Numero du vecteur CERFACS en lecture: 96 Rdmodfacs> Valeur propre du vecteur en lecture: 1346. Rdmodfacs> Numero du vecteur CERFACS en lecture: 97 Rdmodfacs> Valeur propre du vecteur en lecture: 1353. Rdmodfacs> Numero du vecteur CERFACS en lecture: 98 Rdmodfacs> Valeur propre du vecteur en lecture: 1362. Rdmodfacs> Numero du vecteur CERFACS en lecture: 99 Rdmodfacs> Valeur propre du vecteur en lecture: 1371. Rdmodfacs> Numero du vecteur CERFACS en lecture: 100 Rdmodfacs> Valeur propre du vecteur en lecture: 1372. Rdmodfacs> Numero du vecteur CERFACS en lecture: 101 Rdmodfacs> Valeur propre du vecteur en lecture: 1388. Rdmodfacs> Numero du vecteur CERFACS en lecture: 102 Rdmodfacs> Valeur propre du vecteur en lecture: 1394. Rdmodfacs> Numero du vecteur CERFACS en lecture: 103 Rdmodfacs> Valeur propre du vecteur en lecture: 1398. Rdmodfacs> Numero du vecteur CERFACS en lecture: 104 Rdmodfacs> Valeur propre du vecteur en lecture: 1400. Rdmodfacs> Numero du vecteur CERFACS en lecture: 105 Rdmodfacs> Valeur propre du vecteur en lecture: 1404. Rdmodfacs> Numero du vecteur CERFACS en lecture: 106 Rdmodfacs> Valeur propre du vecteur en lecture: 1408. Bfactors> 106 vectors, 11232 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 : 187.200000 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= -0.575 for 238 C-alpha atoms. Bfactors> = 0.000 +/- 0.00 Bfactors> = 97.209 +/- 4.58 Bfactors> Shiftng-fct= 97.209 Bfactors> Scaling-fct= 7773.570 Bfactors> Predicted, Scaled and Experimental B-factors are saved. Bfactors> Normal end. check_modes Chkmod> Version 1.00, Bordeaux. Getnam> Eigenvector filename ? Getnam> 2602051428002699079.eigenfacs Openam> file on opening on unit 10: 2602051428002699079.eigenfacs Rdmodfacs> Old Blzpack file format detected. Rdmodfacs> Numero du vecteur CERFACS en lecture: 1 Rdmodfacs> Frequence du vecteur en lecture: 3.4200E-03 Rdmodfacs> Numero du vecteur CERFACS en lecture: 2 Rdmodfacs> Frequence du vecteur en lecture: 3.4216E-03 Rdmodfacs> Numero du vecteur CERFACS en lecture: 3 Rdmodfacs> Frequence du vecteur en lecture: 3.4241E-03 Rdmodfacs> Numero du vecteur CERFACS en lecture: 4 Rdmodfacs> Frequence du vecteur en lecture: 3.4248E-03 Rdmodfacs> Numero du vecteur CERFACS en lecture: 5 Rdmodfacs> Frequence du vecteur en lecture: 3.4260E-03 Rdmodfacs> Numero du vecteur CERFACS en lecture: 6 Rdmodfacs> Frequence du vecteur en lecture: 3.4422E-03 Rdmodfacs> Numero du vecteur CERFACS en lecture: 7 Rdmodfacs> Frequence du vecteur en lecture: 1486. Rdmodfacs> Numero du vecteur CERFACS en lecture: 8 Rdmodfacs> Frequence du vecteur en lecture: 1567. Rdmodfacs> Numero du vecteur CERFACS en lecture: 9 Rdmodfacs> Frequence du vecteur en lecture: 1679. Rdmodfacs> Numero du vecteur CERFACS en lecture: 10 Rdmodfacs> Frequence du vecteur en lecture: 1825. Rdmodfacs> Numero du vecteur CERFACS en lecture: 11 Rdmodfacs> Frequence du vecteur en lecture: 1914. Rdmodfacs> Numero du vecteur CERFACS en lecture: 12 Rdmodfacs> Frequence du vecteur en lecture: 2044. Rdmodfacs> Numero du vecteur CERFACS en lecture: 13 Rdmodfacs> Frequence du vecteur en lecture: 2128. Rdmodfacs> Numero du vecteur CERFACS en lecture: 14 Rdmodfacs> Frequence du vecteur en lecture: 2161. Rdmodfacs> Numero du vecteur CERFACS en lecture: 15 Rdmodfacs> Frequence du vecteur en lecture: 2267. Rdmodfacs> Numero du vecteur CERFACS en lecture: 16 Rdmodfacs> Frequence du vecteur en lecture: 2323. Rdmodfacs> Numero du vecteur CERFACS en lecture: 17 Rdmodfacs> Frequence du vecteur en lecture: 2349. Rdmodfacs> Numero du vecteur CERFACS en lecture: 18 Rdmodfacs> Frequence du vecteur en lecture: 2366. Rdmodfacs> Numero du vecteur CERFACS en lecture: 19 Rdmodfacs> Frequence du vecteur en lecture: 2467. Rdmodfacs> Numero du vecteur CERFACS en lecture: 20 Rdmodfacs> Frequence du vecteur en lecture: 2509. Rdmodfacs> Numero du vecteur CERFACS en lecture: 21 Rdmodfacs> Frequence du vecteur en lecture: 2526. Rdmodfacs> Numero du vecteur CERFACS en lecture: 22 Rdmodfacs> Frequence du vecteur en lecture: 2578. Rdmodfacs> Numero du vecteur CERFACS en lecture: 23 Rdmodfacs> Frequence du vecteur en lecture: 2631. Rdmodfacs> Numero du vecteur CERFACS en lecture: 24 Rdmodfacs> Frequence du vecteur en lecture: 2658. Rdmodfacs> Numero du vecteur CERFACS en lecture: 25 Rdmodfacs> Frequence du vecteur en lecture: 2698. Rdmodfacs> Numero du vecteur CERFACS en lecture: 26 Rdmodfacs> Frequence du vecteur en lecture: 2727. Rdmodfacs> Numero du vecteur CERFACS en lecture: 27 Rdmodfacs> Frequence du vecteur en lecture: 2737. Rdmodfacs> Numero du vecteur CERFACS en lecture: 28 Rdmodfacs> Frequence du vecteur en lecture: 2748. Rdmodfacs> Numero du vecteur CERFACS en lecture: 29 Rdmodfacs> Frequence du vecteur en lecture: 2758. Rdmodfacs> Numero du vecteur CERFACS en lecture: 30 Rdmodfacs> Frequence du vecteur en lecture: 2777. Rdmodfacs> Numero du vecteur CERFACS en lecture: 31 Rdmodfacs> Frequence du vecteur en lecture: 2797. Rdmodfacs> Numero du vecteur CERFACS en lecture: 32 Rdmodfacs> Frequence du vecteur en lecture: 2813. Rdmodfacs> Numero du vecteur CERFACS en lecture: 33 Rdmodfacs> Frequence du vecteur en lecture: 2833. Rdmodfacs> Numero du vecteur CERFACS en lecture: 34 Rdmodfacs> Frequence du vecteur en lecture: 2906. Rdmodfacs> Numero du vecteur CERFACS en lecture: 35 Rdmodfacs> Frequence du vecteur en lecture: 2916. Rdmodfacs> Numero du vecteur CERFACS en lecture: 36 Rdmodfacs> Frequence du vecteur en lecture: 2928. Rdmodfacs> Numero du vecteur CERFACS en lecture: 37 Rdmodfacs> Frequence du vecteur en lecture: 2962. Rdmodfacs> Numero du vecteur CERFACS en lecture: 38 Rdmodfacs> Frequence du vecteur en lecture: 2999. Rdmodfacs> Numero du vecteur CERFACS en lecture: 39 Rdmodfacs> Frequence du vecteur en lecture: 3015. Rdmodfacs> Numero du vecteur CERFACS en lecture: 40 Rdmodfacs> Frequence du vecteur en lecture: 3041. Rdmodfacs> Numero du vecteur CERFACS en lecture: 41 Rdmodfacs> Frequence du vecteur en lecture: 3059. Rdmodfacs> Numero du vecteur CERFACS en lecture: 42 Rdmodfacs> Frequence du vecteur en lecture: 3089. Rdmodfacs> Numero du vecteur CERFACS en lecture: 43 Rdmodfacs> Frequence du vecteur en lecture: 3105. Rdmodfacs> Numero du vecteur CERFACS en lecture: 44 Rdmodfacs> Frequence du vecteur en lecture: 3135. Rdmodfacs> Numero du vecteur CERFACS en lecture: 45 Rdmodfacs> Frequence du vecteur en lecture: 3162. Rdmodfacs> Numero du vecteur CERFACS en lecture: 46 Rdmodfacs> Frequence du vecteur en lecture: 3177. Rdmodfacs> Numero du vecteur CERFACS en lecture: 47 Rdmodfacs> Frequence du vecteur en lecture: 3203. Rdmodfacs> Numero du vecteur CERFACS en lecture: 48 Rdmodfacs> Frequence du vecteur en lecture: 3232. Rdmodfacs> Numero du vecteur CERFACS en lecture: 49 Rdmodfacs> Frequence du vecteur en lecture: 3239. Rdmodfacs> Numero du vecteur CERFACS en lecture: 50 Rdmodfacs> Frequence du vecteur en lecture: 3249. Rdmodfacs> Numero du vecteur CERFACS en lecture: 51 Rdmodfacs> Frequence du vecteur en lecture: 3276. Rdmodfacs> Numero du vecteur CERFACS en lecture: 52 Rdmodfacs> Frequence du vecteur en lecture: 3295. Rdmodfacs> Numero du vecteur CERFACS en lecture: 53 Rdmodfacs> Frequence du vecteur en lecture: 3316. Rdmodfacs> Numero du vecteur CERFACS en lecture: 54 Rdmodfacs> Frequence du vecteur en lecture: 3334. Rdmodfacs> Numero du vecteur CERFACS en lecture: 55 Rdmodfacs> Frequence du vecteur en lecture: 3367. Rdmodfacs> Numero du vecteur CERFACS en lecture: 56 Rdmodfacs> Frequence du vecteur en lecture: 3375. Rdmodfacs> Numero du vecteur CERFACS en lecture: 57 Rdmodfacs> Frequence du vecteur en lecture: 3402. Rdmodfacs> Numero du vecteur CERFACS en lecture: 58 Rdmodfacs> Frequence du vecteur en lecture: 3411. Rdmodfacs> Numero du vecteur CERFACS en lecture: 59 Rdmodfacs> Frequence du vecteur en lecture: 3428. Rdmodfacs> Numero du vecteur CERFACS en lecture: 60 Rdmodfacs> Frequence du vecteur en lecture: 3441. Rdmodfacs> Numero du vecteur CERFACS en lecture: 61 Rdmodfacs> Frequence du vecteur en lecture: 3461. Rdmodfacs> Numero du vecteur CERFACS en lecture: 62 Rdmodfacs> Frequence du vecteur en lecture: 3470. Rdmodfacs> Numero du vecteur CERFACS en lecture: 63 Rdmodfacs> Frequence du vecteur en lecture: 3500. Rdmodfacs> Numero du vecteur CERFACS en lecture: 64 Rdmodfacs> Frequence du vecteur en lecture: 3524. Rdmodfacs> Numero du vecteur CERFACS en lecture: 65 Rdmodfacs> Frequence du vecteur en lecture: 3529. Rdmodfacs> Numero du vecteur CERFACS en lecture: 66 Rdmodfacs> Frequence du vecteur en lecture: 3537. Rdmodfacs> Numero du vecteur CERFACS en lecture: 67 Rdmodfacs> Frequence du vecteur en lecture: 3569. Rdmodfacs> Numero du vecteur CERFACS en lecture: 68 Rdmodfacs> Frequence du vecteur en lecture: 3580. Rdmodfacs> Numero du vecteur CERFACS en lecture: 69 Rdmodfacs> Frequence du vecteur en lecture: 3587. Rdmodfacs> Numero du vecteur CERFACS en lecture: 70 Rdmodfacs> Frequence du vecteur en lecture: 3628. Rdmodfacs> Numero du vecteur CERFACS en lecture: 71 Rdmodfacs> Frequence du vecteur en lecture: 3642. Rdmodfacs> Numero du vecteur CERFACS en lecture: 72 Rdmodfacs> Frequence du vecteur en lecture: 3647. Rdmodfacs> Numero du vecteur CERFACS en lecture: 73 Rdmodfacs> Frequence du vecteur en lecture: 3658. Rdmodfacs> Numero du vecteur CERFACS en lecture: 74 Rdmodfacs> Frequence du vecteur en lecture: 3673. Rdmodfacs> Numero du vecteur CERFACS en lecture: 75 Rdmodfacs> Frequence du vecteur en lecture: 3709. Rdmodfacs> Numero du vecteur CERFACS en lecture: 76 Rdmodfacs> Frequence du vecteur en lecture: 3716. Rdmodfacs> Numero du vecteur CERFACS en lecture: 77 Rdmodfacs> Frequence du vecteur en lecture: 3725. Rdmodfacs> Numero du vecteur CERFACS en lecture: 78 Rdmodfacs> Frequence du vecteur en lecture: 3728. Rdmodfacs> Numero du vecteur CERFACS en lecture: 79 Rdmodfacs> Frequence du vecteur en lecture: 3754. Rdmodfacs> Numero du vecteur CERFACS en lecture: 80 Rdmodfacs> Frequence du vecteur en lecture: 3763. Rdmodfacs> Numero du vecteur CERFACS en lecture: 81 Rdmodfacs> Frequence du vecteur en lecture: 3799. Rdmodfacs> Numero du vecteur CERFACS en lecture: 82 Rdmodfacs> Frequence du vecteur en lecture: 3810. Rdmodfacs> Numero du vecteur CERFACS en lecture: 83 Rdmodfacs> Frequence du vecteur en lecture: 3814. Rdmodfacs> Numero du vecteur CERFACS en lecture: 84 Rdmodfacs> Frequence du vecteur en lecture: 3830. Rdmodfacs> Numero du vecteur CERFACS en lecture: 85 Rdmodfacs> Frequence du vecteur en lecture: 3841. Rdmodfacs> Numero du vecteur CERFACS en lecture: 86 Rdmodfacs> Frequence du vecteur en lecture: 3865. Rdmodfacs> Numero du vecteur CERFACS en lecture: 87 Rdmodfacs> Frequence du vecteur en lecture: 3868. Rdmodfacs> Numero du vecteur CERFACS en lecture: 88 Rdmodfacs> Frequence du vecteur en lecture: 3883. Rdmodfacs> Numero du vecteur CERFACS en lecture: 89 Rdmodfacs> Frequence du vecteur en lecture: 3896. Rdmodfacs> Numero du vecteur CERFACS en lecture: 90 Rdmodfacs> Frequence du vecteur en lecture: 3906. Rdmodfacs> Numero du vecteur CERFACS en lecture: 91 Rdmodfacs> Frequence du vecteur en lecture: 3929. Rdmodfacs> Numero du vecteur CERFACS en lecture: 92 Rdmodfacs> Frequence du vecteur en lecture: 3945. Rdmodfacs> Numero du vecteur CERFACS en lecture: 93 Rdmodfacs> Frequence du vecteur en lecture: 3948. Rdmodfacs> Numero du vecteur CERFACS en lecture: 94 Rdmodfacs> Frequence du vecteur en lecture: 3953. Rdmodfacs> Numero du vecteur CERFACS en lecture: 95 Rdmodfacs> Frequence du vecteur en lecture: 3975. Rdmodfacs> Numero du vecteur CERFACS en lecture: 96 Rdmodfacs> Frequence du vecteur en lecture: 3984. Rdmodfacs> Numero du vecteur CERFACS en lecture: 97 Rdmodfacs> Frequence du vecteur en lecture: 3994. Rdmodfacs> Numero du vecteur CERFACS en lecture: 98 Rdmodfacs> Frequence du vecteur en lecture: 4007. Rdmodfacs> Numero du vecteur CERFACS en lecture: 99 Rdmodfacs> Frequence du vecteur en lecture: 4021. Rdmodfacs> Numero du vecteur CERFACS en lecture: 100 Rdmodfacs> Frequence du vecteur en lecture: 4022. Rdmodfacs> Numero du vecteur CERFACS en lecture: 101 Rdmodfacs> Frequence du vecteur en lecture: 4045. Rdmodfacs> Numero du vecteur CERFACS en lecture: 102 Rdmodfacs> Frequence du vecteur en lecture: 4054. Rdmodfacs> Numero du vecteur CERFACS en lecture: 103 Rdmodfacs> Frequence du vecteur en lecture: 4060. Rdmodfacs> Numero du vecteur CERFACS en lecture: 104 Rdmodfacs> Frequence du vecteur en lecture: 4063. Rdmodfacs> Numero du vecteur CERFACS en lecture: 105 Rdmodfacs> Frequence du vecteur en lecture: 4069. Rdmodfacs> Numero du vecteur CERFACS en lecture: 106 Rdmodfacs> Frequence du vecteur en lecture: 4075. Chkmod> 106 vectors, 11232 coordinates in file. Chkmod> That is: 3744 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 41 is: 1.0001 (instead of 1.0000). %Chkmod-Wn> Norm of vector 71 is: 1.0001 (instead of 1.0000). Chkmod> Normal end. 0.0034 0.8797 0.0034 0.8617 0.0034 0.7635 0.0034 0.9093 0.0034 0.9236 0.0034 0.7926 1485.6946 0.3232 1567.1886 0.3150 1679.0608 0.0936 1825.0966 0.0374 1914.3315 0.2570 2044.2005 0.1643 2128.4101 0.2687 2161.1209 0.2498 2267.0968 0.0539 2323.3494 0.1929 2348.5875 0.1778 2365.8448 0.1457 2467.0937 0.2395 2508.5643 0.1564 2525.8956 0.1495 2578.1053 0.1409 2631.2957 0.1374 2657.8245 0.2188 2698.1118 0.0585 2726.8021 0.2105 2736.7295 0.1789 2748.1232 0.0632 2757.9739 0.2240 2777.1460 0.1731 2797.2406 0.0782 2812.7938 0.2090 2832.8437 0.1685 2906.3936 0.2379 2916.3161 0.2313 2928.2191 0.2433 2962.2484 0.1036 2999.0381 0.2830 3015.3101 0.2230 3041.2031 0.1513 3058.7931 0.2274 3088.5234 0.1785 3105.4657 0.2933 3135.1295 0.3300 3161.7195 0.1591 3177.3441 0.1705 3203.2156 0.1345 3231.9824 0.2092 3239.0887 0.4140 3248.5395 0.1997 3275.8288 0.1789 3295.2083 0.1776 3316.2528 0.1607 3334.1599 0.2568 3367.0633 0.2965 3375.2827 0.3183 3402.4218 0.2764 3411.4202 0.3285 3428.3145 0.1836 3440.6737 0.1584 3461.1745 0.2402 3469.6807 0.2102 3500.1319 0.2230 3523.6342 0.1343 3528.6501 0.1964 3536.9940 0.1561 3568.5231 0.2288 3580.0691 0.3184 3586.6501 0.2155 3627.5110 0.1385 3642.1087 0.0775 3646.9616 0.1311 3658.2600 0.1813 3672.7355 0.2294 3709.4717 0.2352 3715.8236 0.1232 3725.3310 0.2079 3728.4948 0.1776 3753.7089 0.2291 3763.1206 0.2598 3798.9830 0.2469 3809.8306 0.2718 3814.4701 0.3188 3829.8946 0.1823 3840.6550 0.1117 3865.1375 0.2053 3868.1869 0.2584 3883.3981 0.2488 3895.5242 0.2215 3906.1038 0.2405 3928.6782 0.1932 3945.1507 0.2791 3948.1384 0.1922 3952.6156 0.1744 3974.9259 0.2754 3983.8150 0.1551 3994.1607 0.2966 4007.4230 0.1290 4020.6416 0.1663 4022.1077 0.2894 4045.4922 0.2174 4054.2266 0.2231 4060.0392 0.2171 4062.9423 0.2391 4068.7424 0.2259 4074.5342 0.2739 getting mode 7 running: ../../bin/get_modes.sh 2602051428002699079 7 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 7 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.7.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.7.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.7.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 8 running: ../../bin/get_modes.sh 2602051428002699079 8 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 8 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.8.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.8.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.8.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 9 running: ../../bin/get_modes.sh 2602051428002699079 9 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 9 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.9.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.9.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.9.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 10 running: ../../bin/get_modes.sh 2602051428002699079 10 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 10 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.10.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.10.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.10.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 11 running: ../../bin/get_modes.sh 2602051428002699079 11 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 11 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.11.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.11.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.11.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 12 running: ../../bin/get_modes.sh 2602051428002699079 12 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 12 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.12.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.12.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.12.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 13 running: ../../bin/get_modes.sh 2602051428002699079 13 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 13 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.13.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.13.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.13.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 14 running: ../../bin/get_modes.sh 2602051428002699079 14 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 14 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.14.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.14.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.14.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 15 running: ../../bin/get_modes.sh 2602051428002699079 15 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 15 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.15.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.15.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.15.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 16 running: ../../bin/get_modes.sh 2602051428002699079 16 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 16 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.16.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.16.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.16.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 17 running: ../../bin/get_modes.sh 2602051428002699079 17 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 17 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.17.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.17.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.17.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 18 running: ../../bin/get_modes.sh 2602051428002699079 18 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 18 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.18.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.18.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.18.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 19 running: ../../bin/get_modes.sh 2602051428002699079 19 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 19 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.19.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.19.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.19.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 20 running: ../../bin/get_modes.sh 2602051428002699079 20 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 20 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.20.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.20.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.20.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 21 running: ../../bin/get_modes.sh 2602051428002699079 21 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 21 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.21.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.21.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.21.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 22 running: ../../bin/get_modes.sh 2602051428002699079 22 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 22 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.22.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.22.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.22.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 23 running: ../../bin/get_modes.sh 2602051428002699079 23 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 23 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.23.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.23.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.23.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 24 running: ../../bin/get_modes.sh 2602051428002699079 24 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 24 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.24.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.24.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.24.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 25 running: ../../bin/get_modes.sh 2602051428002699079 25 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 25 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.25.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.25.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.25.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 26 running: ../../bin/get_modes.sh 2602051428002699079 26 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 26 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.26.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.26.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.26.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 27 running: ../../bin/get_modes.sh 2602051428002699079 27 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 27 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.27.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.27.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.27.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 28 running: ../../bin/get_modes.sh 2602051428002699079 28 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 28 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.28.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.28.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.28.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 29 running: ../../bin/get_modes.sh 2602051428002699079 29 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 29 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.29.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.29.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.29.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 30 running: ../../bin/get_modes.sh 2602051428002699079 30 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 30 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.30.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.30.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.30.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 getting mode 31 running: ../../bin/get_modes.sh 2602051428002699079 31 -100 100 50 on 0 normal mode computation generate a series of perturbations for mode 31 calculating perturbed structure for DQ=-100 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=-50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=0 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=50 2602051428002699079.eigenfacs 2602051428002699079.atom calculating perturbed structure for DQ=100 2602051428002699079.eigenfacs 2602051428002699079.atom making animated gifs 5 models are in 2602051428002699079.31.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.31.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 5 models are in 2602051428002699079.31.pdb, 0 models will be skipped MODEL 1 will be plotted MODEL 2 will be plotted MODEL 3 will be plotted MODEL 4 will be plotted MODEL 5 will be plotted making thumbnail 100x100 making small animated gif 100x100 making animated gif 300x300 2602051428002699079.10.pdb 2602051428002699079.11.pdb 2602051428002699079.12.pdb 2602051428002699079.13.pdb 2602051428002699079.14.pdb 2602051428002699079.15.pdb 2602051428002699079.16.pdb 2602051428002699079.17.pdb 2602051428002699079.18.pdb 2602051428002699079.19.pdb 2602051428002699079.20.pdb 2602051428002699079.21.pdb 2602051428002699079.22.pdb 2602051428002699079.23.pdb 2602051428002699079.24.pdb 2602051428002699079.25.pdb 2602051428002699079.26.pdb 2602051428002699079.27.pdb 2602051428002699079.28.pdb 2602051428002699079.29.pdb 2602051428002699079.30.pdb 2602051428002699079.31.pdb 2602051428002699079.7.pdb 2602051428002699079.8.pdb 2602051428002699079.9.pdb STDERR: Note: The following floating-point exceptions are signalling: IEEE_DENORMAL real 0m14.427s user 0m13.990s sys 0m0.427s rm: cannot remove '2602051428002699079.sdijf': No such file or directory 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 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 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 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 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 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 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 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 pstopnm: Writing ppmraw format pstopnm: Writing ppmraw format pstopnm: 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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 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 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 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 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 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 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 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 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 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 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 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 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 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: 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Last modification: december 26th, 2025.