***  FXIa WT  ***
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 = 2602060425492843205.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 2602060425492843205.atom to be opened.
Openam> File opened: 2602060425492843205.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 = 3741
Mean number per residue = 15.7
Pdbmat> Coordinate statistics:
= -1.065520 +/- 10.062157 From: -26.255000 To: 22.605000
= -0.059434 +/- 9.351784 From: -20.269000 To: 21.662000
= -0.495196 +/- 10.058477 From: -28.051000 To: 22.314000
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 21.3966 % Filled.
Pdbmat> 13476297 non-zero elements.
Pdbmat> 1495004 atom-atom interactions.
Pdbmat> Number per atom= 799.25 +/- 286.42
Maximum number = 1451
Minimum number = 139
Pdbmat> Matrix trace = 2.990008E+07
Pdbmat> Larger element = 5095.84
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 = 2602060425492843205.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 2602060425492843205.atom to be opened.
Openam> file on opening on unit 11:
2602060425492843205.atom
Blocpdb> Coordinate file in PDB format.
Blocpdb> 3741 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> 23 atoms in block 110
Block first atom: 3417
Blocpdb> 35 atoms in block 111
Block first atom: 3440
Blocpdb> 30 atoms in block 112
Block first atom: 3475
Blocpdb> 31 atoms in block 113
Block first atom: 3505
Blocpdb> 37 atoms in block 114
Block first atom: 3536
Blocpdb> 36 atoms in block 115
Block first atom: 3573
Blocpdb> 38 atoms in block 116
Block first atom: 3609
Blocpdb> 37 atoms in block 117
Block first atom: 3647
Blocpdb> 31 atoms in block 118
Block first atom: 3684
Blocpdb> 27 atoms in block 119
Block first atom: 3714
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> 13476416 matrix lines read.
Prepmat> Matrix order = 11223
Prepmat> Matrix trace = 29900080.0000
Prepmat> Last element read: 11223 11223 1005.7377
Prepmat> 7141 lines saved.
Prepmat> 3555 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: 3741
RTB> Total mass = 3741.0000
RTB> Number of atoms found in matrix: 3741
RTB> Number of blocks = 119
RTB> Projection begins.
RTB> Projected matrix is being saved.
RTB> Projected matrix trace = 1852447.2956
RTB> 127275 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: 127275
Diagstd> Projected matrix trace = 1852447.2956
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 =1852447.2956
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 188.5297569 209.2026715 240.8580712 286.4170237
312.3470004 362.0685286 389.7882590 401.7674271 459.7012304
465.7750088 479.5704475 507.1802398 520.4127567 537.4506646
549.5573840 569.0190535 600.4204881 612.6117563 623.1808560
633.6561891 642.5975881 646.7783886 654.2249011 659.8840326
671.3025879 682.2359008 711.2917753 717.3480617 723.2488040
731.4657940 748.0753246 763.9190469 773.1472568 790.1635214
799.2372035 810.9838200 820.6744778 840.2281259 850.6936715
864.1285385 878.1692337 892.0894264 895.5402494 900.5952499
915.8286941 924.9925642 942.4400701 946.0133386 962.7610315
967.8365344 984.7652651 990.0357715 998.8920514 1015.6198537
1019.9871388 1039.7751795 1041.2039496 1061.7126724 1068.5913873
1081.8109406 1088.0249589 1095.5075134 1102.8608977 1120.4280425
1128.6930695 1136.6450305 1147.5771732 1163.3478962 1171.6936883
1179.7359114 1182.0183332 1197.5336888 1200.8400059 1218.6979266
1229.3893600 1234.0963484 1241.6898114 1247.4564042 1254.6102941
1268.2410906 1276.0036386 1278.4886620 1289.7922927 1302.4411129
1312.3720303 1322.0568116 1326.8425741 1332.9152512 1343.6501902
1349.4373328 1354.6145972 1369.6822606 1374.7078933 1377.7842112
1392.3345045 1399.1144882 1402.3560618 1402.9869546 1408.8478374
1410.1144799
Diagstd> Frequencies (cm-1, if the input matrix is a hessian in CHARMM units):
0.0034313 0.0034315 0.0034316 0.0034340 0.0034360
0.0034401 1491.0260599 1570.6481002 1685.2948063 1837.7849642
1919.1722265 2066.2871212 2143.9253376 2176.6201342 2328.2687727
2343.5993648 2378.0527650 2445.5494148 2477.2466348 2517.4716144
2545.6682385 2590.3514085 2660.8661695 2687.7442640 2710.8303044
2733.5191505 2752.7376688 2761.6779363 2777.5303641 2789.5174989
2813.5487270 2836.3679209 2896.1374783 2908.4409105 2920.3784991
2936.9211794 2970.0786171 3001.3659381 3019.4399018 3052.4866158
3069.9628923 3092.4406620 3110.8619863 3147.7040134 3167.2466195
3192.1585529 3217.9877692 3243.3922616 3249.6593295 3258.8179985
3286.2636533 3302.6640648 3333.6665068 3339.9803383 3369.4152103
3378.2850110 3407.7022507 3416.8091668 3432.0575284 3460.6754436
3468.1081180 3501.5876620 3503.9926272 3538.3336349 3549.7773585
3571.6670304 3581.9103286 3594.2059641 3606.2484990 3634.8564596
3648.2383933 3661.0672713 3678.6310374 3703.8218097 3717.0835716
3729.8183398 3733.4246152 3757.8474866 3763.0315042 3790.9086246
3807.5008181 3814.7827831 3826.5010696 3835.3761981 3846.3579983
3867.1960574 3879.0130141 3882.7883755 3899.9152465 3918.9915640
3933.9040520 3948.3926912 3955.5327021 3964.5741858 3980.5069747
3989.0698474 3996.7147739 4018.8814532 4026.2477342 4030.7501803
4051.9779485 4061.8315366 4066.5341926 4067.4488172 4075.9357088
4077.7675580
Diagstd> Normal end.
Rtb_to_modes> Entering in.
Rtb_to_modes> Number of atoms in temporary block-file = 3741
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: 9.9848E-10
Rdmodfacs> Eigenvector number: 2
Rdmodfacs> Corresponding eigenvalue: 9.9855E-10
Rdmodfacs> Eigenvector number: 3
Rdmodfacs> Corresponding eigenvalue: 9.9865E-10
Rdmodfacs> Eigenvector number: 4
Rdmodfacs> Corresponding eigenvalue: 1.0000E-09
Rdmodfacs> Eigenvector number: 5
Rdmodfacs> Corresponding eigenvalue: 1.0012E-09
Rdmodfacs> Eigenvector number: 6
Rdmodfacs> Corresponding eigenvalue: 1.0036E-09
Rdmodfacs> Eigenvector number: 7
Rdmodfacs> Corresponding eigenvalue: 188.5
Rdmodfacs> Eigenvector number: 8
Rdmodfacs> Corresponding eigenvalue: 209.2
Rdmodfacs> Eigenvector number: 9
Rdmodfacs> Corresponding eigenvalue: 240.9
Rdmodfacs> Eigenvector number: 10
Rdmodfacs> Corresponding eigenvalue: 286.4
Rdmodfacs> Eigenvector number: 11
Rdmodfacs> Corresponding eigenvalue: 312.3
Rdmodfacs> Eigenvector number: 12
Rdmodfacs> Corresponding eigenvalue: 362.1
Rdmodfacs> Eigenvector number: 13
Rdmodfacs> Corresponding eigenvalue: 389.8
Rdmodfacs> Eigenvector number: 14
Rdmodfacs> Corresponding eigenvalue: 401.8
Rdmodfacs> Eigenvector number: 15
Rdmodfacs> Corresponding eigenvalue: 459.7
Rdmodfacs> Eigenvector number: 16
Rdmodfacs> Corresponding eigenvalue: 465.8
Rdmodfacs> Eigenvector number: 17
Rdmodfacs> Corresponding eigenvalue: 479.6
Rdmodfacs> Eigenvector number: 18
Rdmodfacs> Corresponding eigenvalue: 507.2
Rdmodfacs> Eigenvector number: 19
Rdmodfacs> Corresponding eigenvalue: 520.4
Rdmodfacs> Eigenvector number: 20
Rdmodfacs> Corresponding eigenvalue: 537.5
Rdmodfacs> Eigenvector number: 21
Rdmodfacs> Corresponding eigenvalue: 549.6
Rdmodfacs> Eigenvector number: 22
Rdmodfacs> Corresponding eigenvalue: 569.0
Rdmodfacs> Eigenvector number: 23
Rdmodfacs> Corresponding eigenvalue: 600.4
Rdmodfacs> Eigenvector number: 24
Rdmodfacs> Corresponding eigenvalue: 612.6
Rdmodfacs> Eigenvector number: 25
Rdmodfacs> Corresponding eigenvalue: 623.2
Rdmodfacs> Eigenvector number: 26
Rdmodfacs> Corresponding eigenvalue: 633.7
Rdmodfacs> Eigenvector number: 27
Rdmodfacs> Corresponding eigenvalue: 642.6
Rdmodfacs> Eigenvector number: 28
Rdmodfacs> Corresponding eigenvalue: 646.8
Rdmodfacs> Eigenvector number: 29
Rdmodfacs> Corresponding eigenvalue: 654.2
Rdmodfacs> Eigenvector number: 30
Rdmodfacs> Corresponding eigenvalue: 659.9
Rdmodfacs> Eigenvector number: 31
Rdmodfacs> Corresponding eigenvalue: 671.3
Rdmodfacs> Eigenvector number: 32
Rdmodfacs> Corresponding eigenvalue: 682.2
Rdmodfacs> Eigenvector number: 33
Rdmodfacs> Corresponding eigenvalue: 711.3
Rdmodfacs> Eigenvector number: 34
Rdmodfacs> Corresponding eigenvalue: 717.3
Rdmodfacs> Eigenvector number: 35
Rdmodfacs> Corresponding eigenvalue: 723.2
Rdmodfacs> Eigenvector number: 36
Rdmodfacs> Corresponding eigenvalue: 731.5
Rdmodfacs> Eigenvector number: 37
Rdmodfacs> Corresponding eigenvalue: 748.1
Rdmodfacs> Eigenvector number: 38
Rdmodfacs> Corresponding eigenvalue: 763.9
Rdmodfacs> Eigenvector number: 39
Rdmodfacs> Corresponding eigenvalue: 773.1
Rdmodfacs> Eigenvector number: 40
Rdmodfacs> Corresponding eigenvalue: 790.2
Rdmodfacs> Eigenvector number: 41
Rdmodfacs> Corresponding eigenvalue: 799.2
Rdmodfacs> Eigenvector number: 42
Rdmodfacs> Corresponding eigenvalue: 811.0
Rdmodfacs> Eigenvector number: 43
Rdmodfacs> Corresponding eigenvalue: 820.7
Rdmodfacs> Eigenvector number: 44
Rdmodfacs> Corresponding eigenvalue: 840.2
Rdmodfacs> Eigenvector number: 45
Rdmodfacs> Corresponding eigenvalue: 850.7
Rdmodfacs> Eigenvector number: 46
Rdmodfacs> Corresponding eigenvalue: 864.1
Rdmodfacs> Eigenvector number: 47
Rdmodfacs> Corresponding eigenvalue: 878.2
Rdmodfacs> Eigenvector number: 48
Rdmodfacs> Corresponding eigenvalue: 892.1
Rdmodfacs> Eigenvector number: 49
Rdmodfacs> Corresponding eigenvalue: 895.5
Rdmodfacs> Eigenvector number: 50
Rdmodfacs> Corresponding eigenvalue: 900.6
Rdmodfacs> Eigenvector number: 51
Rdmodfacs> Corresponding eigenvalue: 915.8
Rdmodfacs> Eigenvector number: 52
Rdmodfacs> Corresponding eigenvalue: 925.0
Rdmodfacs> Eigenvector number: 53
Rdmodfacs> Corresponding eigenvalue: 942.4
Rdmodfacs> Eigenvector number: 54
Rdmodfacs> Corresponding eigenvalue: 946.0
Rdmodfacs> Eigenvector number: 55
Rdmodfacs> Corresponding eigenvalue: 962.8
Rdmodfacs> Eigenvector number: 56
Rdmodfacs> Corresponding eigenvalue: 967.8
Rdmodfacs> Eigenvector number: 57
Rdmodfacs> Corresponding eigenvalue: 984.8
Rdmodfacs> Eigenvector number: 58
Rdmodfacs> Corresponding eigenvalue: 990.0
Rdmodfacs> Eigenvector number: 59
Rdmodfacs> Corresponding eigenvalue: 998.9
Rdmodfacs> Eigenvector number: 60
Rdmodfacs> Corresponding eigenvalue: 1016.
Rdmodfacs> Eigenvector number: 61
Rdmodfacs> Corresponding eigenvalue: 1020.
Rdmodfacs> Eigenvector number: 62
Rdmodfacs> Corresponding eigenvalue: 1040.
Rdmodfacs> Eigenvector number: 63
Rdmodfacs> Corresponding eigenvalue: 1041.
Rdmodfacs> Eigenvector number: 64
Rdmodfacs> Corresponding eigenvalue: 1062.
Rdmodfacs> Eigenvector number: 65
Rdmodfacs> Corresponding eigenvalue: 1069.
Rdmodfacs> Eigenvector number: 66
Rdmodfacs> Corresponding eigenvalue: 1082.
Rdmodfacs> Eigenvector number: 67
Rdmodfacs> Corresponding eigenvalue: 1088.
Rdmodfacs> Eigenvector number: 68
Rdmodfacs> Corresponding eigenvalue: 1096.
Rdmodfacs> Eigenvector number: 69
Rdmodfacs> Corresponding eigenvalue: 1103.
Rdmodfacs> Eigenvector number: 70
Rdmodfacs> Corresponding eigenvalue: 1120.
Rdmodfacs> Eigenvector number: 71
Rdmodfacs> Corresponding eigenvalue: 1129.
Rdmodfacs> Eigenvector number: 72
Rdmodfacs> Corresponding eigenvalue: 1137.
Rdmodfacs> Eigenvector number: 73
Rdmodfacs> Corresponding eigenvalue: 1148.
Rdmodfacs> Eigenvector number: 74
Rdmodfacs> Corresponding eigenvalue: 1163.
Rdmodfacs> Eigenvector number: 75
Rdmodfacs> Corresponding eigenvalue: 1172.
Rdmodfacs> Eigenvector number: 76
Rdmodfacs> Corresponding eigenvalue: 1180.
Rdmodfacs> Eigenvector number: 77
Rdmodfacs> Corresponding eigenvalue: 1182.
Rdmodfacs> Eigenvector number: 78
Rdmodfacs> Corresponding eigenvalue: 1198.
Rdmodfacs> Eigenvector number: 79
Rdmodfacs> Corresponding eigenvalue: 1201.
Rdmodfacs> Eigenvector number: 80
Rdmodfacs> Corresponding eigenvalue: 1219.
Rdmodfacs> Eigenvector number: 81
Rdmodfacs> Corresponding eigenvalue: 1229.
Rdmodfacs> Eigenvector number: 82
Rdmodfacs> Corresponding eigenvalue: 1234.
Rdmodfacs> Eigenvector number: 83
Rdmodfacs> Corresponding eigenvalue: 1242.
Rdmodfacs> Eigenvector number: 84
Rdmodfacs> Corresponding eigenvalue: 1247.
Rdmodfacs> Eigenvector number: 85
Rdmodfacs> Corresponding eigenvalue: 1255.
Rdmodfacs> Eigenvector number: 86
Rdmodfacs> Corresponding eigenvalue: 1268.
Rdmodfacs> Eigenvector number: 87
Rdmodfacs> Corresponding eigenvalue: 1276.
Rdmodfacs> Eigenvector number: 88
Rdmodfacs> Corresponding eigenvalue: 1278.
Rdmodfacs> Eigenvector number: 89
Rdmodfacs> Corresponding eigenvalue: 1290.
Rdmodfacs> Eigenvector number: 90
Rdmodfacs> Corresponding eigenvalue: 1302.
Rdmodfacs> Eigenvector number: 91
Rdmodfacs> Corresponding eigenvalue: 1312.
Rdmodfacs> Eigenvector number: 92
Rdmodfacs> Corresponding eigenvalue: 1322.
Rdmodfacs> Eigenvector number: 93
Rdmodfacs> Corresponding eigenvalue: 1327.
Rdmodfacs> Eigenvector number: 94
Rdmodfacs> Corresponding eigenvalue: 1333.
Rdmodfacs> Eigenvector number: 95
Rdmodfacs> Corresponding eigenvalue: 1344.
Rdmodfacs> Eigenvector number: 96
Rdmodfacs> Corresponding eigenvalue: 1349.
Rdmodfacs> Eigenvector number: 97
Rdmodfacs> Corresponding eigenvalue: 1355.
Rdmodfacs> Eigenvector number: 98
Rdmodfacs> Corresponding eigenvalue: 1370.
Rdmodfacs> Eigenvector number: 99
Rdmodfacs> Corresponding eigenvalue: 1375.
Rdmodfacs> Eigenvector number: 100
Rdmodfacs> Corresponding eigenvalue: 1378.
Rdmodfacs> Eigenvector number: 101
Rdmodfacs> Corresponding eigenvalue: 1392.
Rdmodfacs> Eigenvector number: 102
Rdmodfacs> Corresponding eigenvalue: 1399.
Rdmodfacs> Eigenvector number: 103
Rdmodfacs> Corresponding eigenvalue: 1402.
Rdmodfacs> Eigenvector number: 104
Rdmodfacs> Corresponding eigenvalue: 1403.
Rdmodfacs> Eigenvector number: 105
Rdmodfacs> Corresponding eigenvalue: 1409.
Rdmodfacs> Eigenvector number: 106
Rdmodfacs> Corresponding eigenvalue: 1410.
Rtb_to_modes> 106 vectors, with 714 coordinates in vector file.
Norm of eigenvectors in projected coordinates (one expected):
0.99998 0.99998 1.00001 0.99999 1.00000
1.00000 1.00000 1.00001 0.99999 1.00004
0.99999 0.99999 1.00003 0.99998 0.99999
0.99998 1.00001 1.00001 1.00001 1.00001
0.99999 0.99995 1.00001 1.00000 0.99998
1.00000 0.99999 0.99995 1.00002 1.00004
1.00000 0.99998 1.00002 1.00001 0.99999
1.00001 1.00003 1.00000 0.99999 1.00002
1.00002 1.00000 0.99998 0.99998 0.99994
1.00000 0.99998 0.99997 0.99998 1.00000
1.00000 1.00002 1.00001 1.00000 1.00004
1.00000 1.00000 0.99995 0.99998 0.99999
0.99997 0.99997 1.00002 1.00002 1.00000
1.00000 1.00002 1.00002 1.00001 0.99996
0.99998 1.00003 1.00002 0.99999 1.00003
1.00004 0.99998 1.00001 1.00000 1.00000
0.99996 1.00001 1.00001 0.99997 0.99999
0.99999 1.00005 1.00001 0.99998 1.00002
1.00002 0.99998 1.00000 0.99999 1.00002
1.00001 0.99998 1.00001 0.99994 1.00001
1.00000 0.99999 1.00001 1.00000 1.00001
0.99999
Rtb_to_modes> RTB block-file is being read.
Rtb_to_modes> 67338 lines found in RTB file.
Norm of eigenvectors in cartesian coordinates (one expected):
0.99998 0.99998 1.00001 0.99999 1.00000
1.00000 1.00000 1.00001 0.99999 1.00004
0.99999 0.99999 1.00003 0.99998 0.99999
0.99998 1.00001 1.00001 1.00001 1.00001
0.99999 0.99995 1.00001 1.00000 0.99998
1.00000 0.99999 0.99995 1.00002 1.00004
1.00000 0.99998 1.00002 1.00001 0.99999
1.00001 1.00003 1.00000 0.99999 1.00002
1.00002 1.00000 0.99998 0.99998 0.99994
1.00000 0.99998 0.99997 0.99998 1.00000
1.00000 1.00002 1.00001 1.00000 1.00004
1.00000 1.00000 0.99995 0.99998 0.99999
0.99997 0.99997 1.00002 1.00002 1.00000
1.00000 1.00002 1.00002 1.00001 0.99996
0.99998 1.00003 1.00002 0.99999 1.00003
1.00004 0.99998 1.00001 1.00000 1.00000
0.99996 1.00001 1.00001 0.99997 0.99999
0.99999 1.00005 1.00001 0.99998 1.00002
1.00002 0.99998 1.00000 0.99999 1.00002
1.00001 0.99998 1.00001 0.99994 1.00001
1.00000 0.99999 1.00001 1.00000 1.00001
0.99999
Orthogonality of first eigenvectors (zero expected):
Vector 2:-0.000
Vector 3:-0.000 0.000
Vector 4:-0.000-0.000-0.000
Vector 5:-0.000 0.000 0.000-0.000
Vector 6: 0.000 0.000-0.000-0.000-0.000
Vector 7: 0.000-0.000 0.000 0.000-0.000-0.000
Vector 8:-0.000-0.000 0.000-0.000-0.000-0.000 0.000
Vector 9:-0.000 0.000 0.000 0.000-0.000 0.000 0.000 0.000
Vector 10: 0.000-0.000 0.000 0.000 0.000 0.000-0.000-0.000-0.000
Rtb_to_modes> 106 eigenvectors saved.
Rtb_to_modes> Normal end.
Diagrtb> Normal end.
B-factor analysis
Bfactors> Version 1.22, Bordeaux.
Getnam> Eigenvector filename ?
Getnam> 2602060425492843205.eigenfacs
Openam> file on opening on unit 10:
2602060425492843205.eigenfacs
Getnam> Corresponding pdb filename ?
Getnam> 2602060425492843205.atom
Openam> file on opening on unit 11:
2602060425492843205.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 = 3741
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: 9.9848E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 2
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9855E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 3
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9865E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 4
Rdmodfacs> Valeur propre du vecteur en lecture: 1.0000E-09
Rdmodfacs> Numero du vecteur CERFACS en lecture: 5
Rdmodfacs> Valeur propre du vecteur en lecture: 1.0012E-09
Rdmodfacs> Numero du vecteur CERFACS en lecture: 6
Rdmodfacs> Valeur propre du vecteur en lecture: 1.0036E-09
Rdmodfacs> Numero du vecteur CERFACS en lecture: 7
Rdmodfacs> Valeur propre du vecteur en lecture: 188.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 8
Rdmodfacs> Valeur propre du vecteur en lecture: 209.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 9
Rdmodfacs> Valeur propre du vecteur en lecture: 240.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 10
Rdmodfacs> Valeur propre du vecteur en lecture: 286.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 11
Rdmodfacs> Valeur propre du vecteur en lecture: 312.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 12
Rdmodfacs> Valeur propre du vecteur en lecture: 362.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 13
Rdmodfacs> Valeur propre du vecteur en lecture: 389.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 14
Rdmodfacs> Valeur propre du vecteur en lecture: 401.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 15
Rdmodfacs> Valeur propre du vecteur en lecture: 459.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 16
Rdmodfacs> Valeur propre du vecteur en lecture: 465.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 17
Rdmodfacs> Valeur propre du vecteur en lecture: 479.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 18
Rdmodfacs> Valeur propre du vecteur en lecture: 507.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 19
Rdmodfacs> Valeur propre du vecteur en lecture: 520.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 20
Rdmodfacs> Valeur propre du vecteur en lecture: 537.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 21
Rdmodfacs> Valeur propre du vecteur en lecture: 549.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 22
Rdmodfacs> Valeur propre du vecteur en lecture: 569.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 23
Rdmodfacs> Valeur propre du vecteur en lecture: 600.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 24
Rdmodfacs> Valeur propre du vecteur en lecture: 612.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 25
Rdmodfacs> Valeur propre du vecteur en lecture: 623.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 26
Rdmodfacs> Valeur propre du vecteur en lecture: 633.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 27
Rdmodfacs> Valeur propre du vecteur en lecture: 642.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 28
Rdmodfacs> Valeur propre du vecteur en lecture: 646.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 29
Rdmodfacs> Valeur propre du vecteur en lecture: 654.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 30
Rdmodfacs> Valeur propre du vecteur en lecture: 659.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 31
Rdmodfacs> Valeur propre du vecteur en lecture: 671.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 32
Rdmodfacs> Valeur propre du vecteur en lecture: 682.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 33
Rdmodfacs> Valeur propre du vecteur en lecture: 711.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 34
Rdmodfacs> Valeur propre du vecteur en lecture: 717.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 35
Rdmodfacs> Valeur propre du vecteur en lecture: 723.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 36
Rdmodfacs> Valeur propre du vecteur en lecture: 731.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 37
Rdmodfacs> Valeur propre du vecteur en lecture: 748.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 38
Rdmodfacs> Valeur propre du vecteur en lecture: 763.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 39
Rdmodfacs> Valeur propre du vecteur en lecture: 773.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 40
Rdmodfacs> Valeur propre du vecteur en lecture: 790.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 41
Rdmodfacs> Valeur propre du vecteur en lecture: 799.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 42
Rdmodfacs> Valeur propre du vecteur en lecture: 811.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 43
Rdmodfacs> Valeur propre du vecteur en lecture: 820.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 44
Rdmodfacs> Valeur propre du vecteur en lecture: 840.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 45
Rdmodfacs> Valeur propre du vecteur en lecture: 850.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 46
Rdmodfacs> Valeur propre du vecteur en lecture: 864.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 47
Rdmodfacs> Valeur propre du vecteur en lecture: 878.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 48
Rdmodfacs> Valeur propre du vecteur en lecture: 892.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 49
Rdmodfacs> Valeur propre du vecteur en lecture: 895.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 50
Rdmodfacs> Valeur propre du vecteur en lecture: 900.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 51
Rdmodfacs> Valeur propre du vecteur en lecture: 915.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 52
Rdmodfacs> Valeur propre du vecteur en lecture: 925.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 53
Rdmodfacs> Valeur propre du vecteur en lecture: 942.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 54
Rdmodfacs> Valeur propre du vecteur en lecture: 946.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 55
Rdmodfacs> Valeur propre du vecteur en lecture: 962.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 56
Rdmodfacs> Valeur propre du vecteur en lecture: 967.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 57
Rdmodfacs> Valeur propre du vecteur en lecture: 984.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 58
Rdmodfacs> Valeur propre du vecteur en lecture: 990.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 59
Rdmodfacs> Valeur propre du vecteur en lecture: 998.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 60
Rdmodfacs> Valeur propre du vecteur en lecture: 1016.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 61
Rdmodfacs> Valeur propre du vecteur en lecture: 1020.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 62
Rdmodfacs> Valeur propre du vecteur en lecture: 1040.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 63
Rdmodfacs> Valeur propre du vecteur en lecture: 1041.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 64
Rdmodfacs> Valeur propre du vecteur en lecture: 1062.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 65
Rdmodfacs> Valeur propre du vecteur en lecture: 1069.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 66
Rdmodfacs> Valeur propre du vecteur en lecture: 1082.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 67
Rdmodfacs> Valeur propre du vecteur en lecture: 1088.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 68
Rdmodfacs> Valeur propre du vecteur en lecture: 1096.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 69
Rdmodfacs> Valeur propre du vecteur en lecture: 1103.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 70
Rdmodfacs> Valeur propre du vecteur en lecture: 1120.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 71
Rdmodfacs> Valeur propre du vecteur en lecture: 1129.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 72
Rdmodfacs> Valeur propre du vecteur en lecture: 1137.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 73
Rdmodfacs> Valeur propre du vecteur en lecture: 1148.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 74
Rdmodfacs> Valeur propre du vecteur en lecture: 1163.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 75
Rdmodfacs> Valeur propre du vecteur en lecture: 1172.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 76
Rdmodfacs> Valeur propre du vecteur en lecture: 1180.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 77
Rdmodfacs> Valeur propre du vecteur en lecture: 1182.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 78
Rdmodfacs> Valeur propre du vecteur en lecture: 1198.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 79
Rdmodfacs> Valeur propre du vecteur en lecture: 1201.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 80
Rdmodfacs> Valeur propre du vecteur en lecture: 1219.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 81
Rdmodfacs> Valeur propre du vecteur en lecture: 1229.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 82
Rdmodfacs> Valeur propre du vecteur en lecture: 1234.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 83
Rdmodfacs> Valeur propre du vecteur en lecture: 1242.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 84
Rdmodfacs> Valeur propre du vecteur en lecture: 1247.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 85
Rdmodfacs> Valeur propre du vecteur en lecture: 1255.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 86
Rdmodfacs> Valeur propre du vecteur en lecture: 1268.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 87
Rdmodfacs> Valeur propre du vecteur en lecture: 1276.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 88
Rdmodfacs> Valeur propre du vecteur en lecture: 1278.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 89
Rdmodfacs> Valeur propre du vecteur en lecture: 1290.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 90
Rdmodfacs> Valeur propre du vecteur en lecture: 1302.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 91
Rdmodfacs> Valeur propre du vecteur en lecture: 1312.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 92
Rdmodfacs> Valeur propre du vecteur en lecture: 1322.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 93
Rdmodfacs> Valeur propre du vecteur en lecture: 1327.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 94
Rdmodfacs> Valeur propre du vecteur en lecture: 1333.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 95
Rdmodfacs> Valeur propre du vecteur en lecture: 1344.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 96
Rdmodfacs> Valeur propre du vecteur en lecture: 1349.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 97
Rdmodfacs> Valeur propre du vecteur en lecture: 1355.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 98
Rdmodfacs> Valeur propre du vecteur en lecture: 1370.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 99
Rdmodfacs> Valeur propre du vecteur en lecture: 1375.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 100
Rdmodfacs> Valeur propre du vecteur en lecture: 1378.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 101
Rdmodfacs> Valeur propre du vecteur en lecture: 1392.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 102
Rdmodfacs> Valeur propre du vecteur en lecture: 1399.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 103
Rdmodfacs> Valeur propre du vecteur en lecture: 1402.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 104
Rdmodfacs> Valeur propre du vecteur en lecture: 1403.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 105
Rdmodfacs> Valeur propre du vecteur en lecture: 1409.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 106
Rdmodfacs> Valeur propre du vecteur en lecture: 1410.
Bfactors> 106 vectors, 11223 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 : 188.500000
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= -0.571 for 238 C-alpha atoms.
Bfactors> = 0.000 +/- 0.00
Bfactors> = 97.290 +/- 4.52
Bfactors> Shiftng-fct= 97.289
Bfactors> Scaling-fct= 7727.046
Bfactors> Predicted, Scaled and Experimental B-factors are saved.
Bfactors> Normal end.
check_modes
Chkmod> Version 1.00, Bordeaux.
Getnam> Eigenvector filename ?
Getnam> 2602060425492843205.eigenfacs
Openam> file on opening on unit 10:
2602060425492843205.eigenfacs
Rdmodfacs> Old Blzpack file format detected.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 1
Rdmodfacs> Frequence du vecteur en lecture: 3.4312E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 2
Rdmodfacs> Frequence du vecteur en lecture: 3.4313E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 3
Rdmodfacs> Frequence du vecteur en lecture: 3.4315E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 4
Rdmodfacs> Frequence du vecteur en lecture: 3.4338E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 5
Rdmodfacs> Frequence du vecteur en lecture: 3.4359E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 6
Rdmodfacs> Frequence du vecteur en lecture: 3.4400E-03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 7
Rdmodfacs> Frequence du vecteur en lecture: 1491.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 8
Rdmodfacs> Frequence du vecteur en lecture: 1571.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 9
Rdmodfacs> Frequence du vecteur en lecture: 1685.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 10
Rdmodfacs> Frequence du vecteur en lecture: 1838.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 11
Rdmodfacs> Frequence du vecteur en lecture: 1919.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 12
Rdmodfacs> Frequence du vecteur en lecture: 2066.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 13
Rdmodfacs> Frequence du vecteur en lecture: 2144.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 14
Rdmodfacs> Frequence du vecteur en lecture: 2177.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 15
Rdmodfacs> Frequence du vecteur en lecture: 2328.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 16
Rdmodfacs> Frequence du vecteur en lecture: 2344.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 17
Rdmodfacs> Frequence du vecteur en lecture: 2378.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 18
Rdmodfacs> Frequence du vecteur en lecture: 2445.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 19
Rdmodfacs> Frequence du vecteur en lecture: 2477.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 20
Rdmodfacs> Frequence du vecteur en lecture: 2517.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 21
Rdmodfacs> Frequence du vecteur en lecture: 2546.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 22
Rdmodfacs> Frequence du vecteur en lecture: 2590.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 23
Rdmodfacs> Frequence du vecteur en lecture: 2661.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 24
Rdmodfacs> Frequence du vecteur en lecture: 2688.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 25
Rdmodfacs> Frequence du vecteur en lecture: 2711.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 26
Rdmodfacs> Frequence du vecteur en lecture: 2733.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 27
Rdmodfacs> Frequence du vecteur en lecture: 2753.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 28
Rdmodfacs> Frequence du vecteur en lecture: 2762.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 29
Rdmodfacs> Frequence du vecteur en lecture: 2777.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 30
Rdmodfacs> Frequence du vecteur en lecture: 2789.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 31
Rdmodfacs> Frequence du vecteur en lecture: 2813.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 32
Rdmodfacs> Frequence du vecteur en lecture: 2836.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 33
Rdmodfacs> Frequence du vecteur en lecture: 2896.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 34
Rdmodfacs> Frequence du vecteur en lecture: 2908.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 35
Rdmodfacs> Frequence du vecteur en lecture: 2920.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 36
Rdmodfacs> Frequence du vecteur en lecture: 2937.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 37
Rdmodfacs> Frequence du vecteur en lecture: 2970.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 38
Rdmodfacs> Frequence du vecteur en lecture: 3001.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 39
Rdmodfacs> Frequence du vecteur en lecture: 3019.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 40
Rdmodfacs> Frequence du vecteur en lecture: 3052.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 41
Rdmodfacs> Frequence du vecteur en lecture: 3070.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 42
Rdmodfacs> Frequence du vecteur en lecture: 3092.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 43
Rdmodfacs> Frequence du vecteur en lecture: 3111.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 44
Rdmodfacs> Frequence du vecteur en lecture: 3148.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 45
Rdmodfacs> Frequence du vecteur en lecture: 3167.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 46
Rdmodfacs> Frequence du vecteur en lecture: 3192.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 47
Rdmodfacs> Frequence du vecteur en lecture: 3218.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 48
Rdmodfacs> Frequence du vecteur en lecture: 3243.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 49
Rdmodfacs> Frequence du vecteur en lecture: 3249.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 50
Rdmodfacs> Frequence du vecteur en lecture: 3259.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 51
Rdmodfacs> Frequence du vecteur en lecture: 3286.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 52
Rdmodfacs> Frequence du vecteur en lecture: 3303.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 53
Rdmodfacs> Frequence du vecteur en lecture: 3333.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 54
Rdmodfacs> Frequence du vecteur en lecture: 3340.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 55
Rdmodfacs> Frequence du vecteur en lecture: 3369.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 56
Rdmodfacs> Frequence du vecteur en lecture: 3378.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 57
Rdmodfacs> Frequence du vecteur en lecture: 3408.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 58
Rdmodfacs> Frequence du vecteur en lecture: 3417.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 59
Rdmodfacs> Frequence du vecteur en lecture: 3432.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 60
Rdmodfacs> Frequence du vecteur en lecture: 3461.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 61
Rdmodfacs> Frequence du vecteur en lecture: 3468.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 62
Rdmodfacs> Frequence du vecteur en lecture: 3502.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 63
Rdmodfacs> Frequence du vecteur en lecture: 3503.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 64
Rdmodfacs> Frequence du vecteur en lecture: 3539.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 65
Rdmodfacs> Frequence du vecteur en lecture: 3550.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 66
Rdmodfacs> Frequence du vecteur en lecture: 3572.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 67
Rdmodfacs> Frequence du vecteur en lecture: 3582.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 68
Rdmodfacs> Frequence du vecteur en lecture: 3595.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 69
Rdmodfacs> Frequence du vecteur en lecture: 3606.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 70
Rdmodfacs> Frequence du vecteur en lecture: 3634.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 71
Rdmodfacs> Frequence du vecteur en lecture: 3649.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 72
Rdmodfacs> Frequence du vecteur en lecture: 3661.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 73
Rdmodfacs> Frequence du vecteur en lecture: 3679.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 74
Rdmodfacs> Frequence du vecteur en lecture: 3703.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 75
Rdmodfacs> Frequence du vecteur en lecture: 3717.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 76
Rdmodfacs> Frequence du vecteur en lecture: 3730.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 77
Rdmodfacs> Frequence du vecteur en lecture: 3733.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 78
Rdmodfacs> Frequence du vecteur en lecture: 3758.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 79
Rdmodfacs> Frequence du vecteur en lecture: 3763.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 80
Rdmodfacs> Frequence du vecteur en lecture: 3791.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 81
Rdmodfacs> Frequence du vecteur en lecture: 3807.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 82
Rdmodfacs> Frequence du vecteur en lecture: 3814.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 83
Rdmodfacs> Frequence du vecteur en lecture: 3827.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 84
Rdmodfacs> Frequence du vecteur en lecture: 3835.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 85
Rdmodfacs> Frequence du vecteur en lecture: 3847.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 86
Rdmodfacs> Frequence du vecteur en lecture: 3867.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 87
Rdmodfacs> Frequence du vecteur en lecture: 3879.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 88
Rdmodfacs> Frequence du vecteur en lecture: 3882.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 89
Rdmodfacs> Frequence du vecteur en lecture: 3900.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 90
Rdmodfacs> Frequence du vecteur en lecture: 3918.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 91
Rdmodfacs> Frequence du vecteur en lecture: 3933.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 92
Rdmodfacs> Frequence du vecteur en lecture: 3948.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 93
Rdmodfacs> Frequence du vecteur en lecture: 3956.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 94
Rdmodfacs> Frequence du vecteur en lecture: 3965.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 95
Rdmodfacs> Frequence du vecteur en lecture: 3981.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 96
Rdmodfacs> Frequence du vecteur en lecture: 3988.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 97
Rdmodfacs> Frequence du vecteur en lecture: 3997.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 98
Rdmodfacs> Frequence du vecteur en lecture: 4019.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 99
Rdmodfacs> Frequence du vecteur en lecture: 4027.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 100
Rdmodfacs> Frequence du vecteur en lecture: 4031.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 101
Rdmodfacs> Frequence du vecteur en lecture: 4051.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 102
Rdmodfacs> Frequence du vecteur en lecture: 4061.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 103
Rdmodfacs> Frequence du vecteur en lecture: 4066.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 104
Rdmodfacs> Frequence du vecteur en lecture: 4067.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 105
Rdmodfacs> Frequence du vecteur en lecture: 4076.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 106
Rdmodfacs> Frequence du vecteur en lecture: 4077.
Chkmod> 106 vectors, 11223 coordinates in file.
Chkmod> That is: 3741 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 10 is: 1.0002 (instead of 1.0000).
%Chkmod-Wn> Norm of vector 22 is: 0.9999 (instead of 1.0000).
%Chkmod-Wn> Norm of vector 28 is: 0.9999 (instead of 1.0000).
%Chkmod-Wn> Norm of vector 45 is: 0.9999 (instead of 1.0000).
%Chkmod-Wn> Norm of vector 87 is: 1.0001 (instead of 1.0000).
%Chkmod-Wn> Norm of vector 99 is: 0.9999 (instead of 1.0000).
Chkmod> Normal end.
0.0034 0.7330
0.0034 0.7121
0.0034 0.8891
0.0034 0.7485
0.0034 0.8964
0.0034 0.9943
1490.8444 0.3228
1570.5706 0.2994
1685.3691 0.1009
1837.6515 0.0404
1918.9454 0.2670
2066.2882 0.1450
2143.8656 0.2919
2176.6149 0.2919
2328.1657 0.1797
2343.5616 0.1709
2378.0239 0.1108
2445.4921 0.0858
2477.1099 0.1957
2517.4791 0.1548
2545.6577 0.2019
2590.1968 0.1365
2660.7065 0.1854
2687.6031 0.0948
2710.7556 0.1731
2733.4963 0.2425
2752.6247 0.1655
2761.6055 0.1076
2777.3583 0.2304
2789.4315 0.0745
2813.4225 0.1275
2836.1715 0.1847
2896.0299 0.1330
2908.2186 0.2251
2920.1546 0.2507
2936.8638 0.1537
2970.0001 0.1209
3001.1997 0.2939
3019.2180 0.2267
3052.4260 0.1634
3069.7597 0.2204
3092.3388 0.2256
3110.7768 0.2218
3147.5162 0.3000
3167.1224 0.2520
3191.9688 0.1491
3217.9060 0.1415
3243.2723 0.3842
3249.4468 0.1923
3258.6867 0.2536
3286.0711 0.1843
3302.5356 0.1806
3333.4525 0.1749
3339.8134 0.2405
3369.3388 0.2760
3378.0762 0.3623
3407.6161 0.2877
3416.6008 0.2803
3431.9239 0.1483
3461.1745 0.3008
3467.9811 0.2245
3501.8159 0.1436
3503.4990 0.2691
3538.6605 0.2040
3550.3036 0.0666
3571.8258 0.1850
3581.7155 0.2516
3594.8594 0.2645
3606.3211 0.1705
3634.0061 0.1246
3648.5778 0.1064
3661.4817 0.1894
3679.1507 0.1614
3703.1090 0.2161
3717.4098 0.1410
3730.0757 0.1937
3733.2354 0.2325
3758.4177 0.2248
3763.1206 0.2665
3791.2157 0.2794
3806.7344 0.2729
3814.4701 0.2487
3826.8147 0.1413
3834.5099 0.2329
3846.7902 0.1234
3866.6625 0.2132
3878.8410 0.1958
3881.8796 0.2642
3900.0618 0.2303
3918.1597 0.2443
3933.1776 0.2388
3948.1384 0.2760
3955.5975 0.1988
3964.5300 0.2589
3980.8542 0.3036
3988.2522 0.1877
3997.1117 0.2809
4019.1750 0.1531
4026.5026 0.1195
4030.8928 0.3249
4051.3173 0.2383
4061.4910 0.1540
4065.8434 0.2819
4067.2931 0.2126
4075.9808 0.2799
4077.4270 0.2425
getting mode 7
running: ../../bin/get_modes.sh 2602060425492843205 7 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 7
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.7.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 2602060425492843205.7.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 2602060425492843205.7.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 2602060425492843205 8 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 8
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.8.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 2602060425492843205.8.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 2602060425492843205.8.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 2602060425492843205 9 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 9
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.9.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 2602060425492843205.9.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 2602060425492843205.9.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 2602060425492843205 10 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 10
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.10.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 2602060425492843205.10.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 2602060425492843205.10.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 2602060425492843205 11 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 11
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.11.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 2602060425492843205.11.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 2602060425492843205.11.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 2602060425492843205 12 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 12
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.12.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 2602060425492843205.12.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 2602060425492843205.12.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 2602060425492843205 13 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 13
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.13.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 2602060425492843205.13.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 2602060425492843205.13.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 2602060425492843205 14 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 14
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.14.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 2602060425492843205.14.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 2602060425492843205.14.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 2602060425492843205 15 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 15
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.15.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 2602060425492843205.15.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 2602060425492843205.15.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 2602060425492843205 16 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 16
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.16.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 2602060425492843205.16.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 2602060425492843205.16.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 2602060425492843205 17 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 17
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.17.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 2602060425492843205.17.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 2602060425492843205.17.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 2602060425492843205 18 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 18
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.18.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 2602060425492843205.18.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 2602060425492843205.18.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 2602060425492843205 19 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 19
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.19.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 2602060425492843205.19.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 2602060425492843205.19.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 2602060425492843205 20 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 20
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.20.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 2602060425492843205.20.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 2602060425492843205.20.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 2602060425492843205 21 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 21
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.21.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 2602060425492843205.21.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 2602060425492843205.21.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 2602060425492843205 22 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 22
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.22.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 2602060425492843205.22.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 2602060425492843205.22.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 2602060425492843205 23 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 23
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.23.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 2602060425492843205.23.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 2602060425492843205.23.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 2602060425492843205 24 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 24
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.24.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 2602060425492843205.24.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 2602060425492843205.24.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 2602060425492843205 25 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 25
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.25.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 2602060425492843205.25.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 2602060425492843205.25.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 2602060425492843205 26 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 26
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.26.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 2602060425492843205.26.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 2602060425492843205.26.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 2602060425492843205 27 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 27
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.27.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 2602060425492843205.27.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 2602060425492843205.27.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 2602060425492843205 28 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 28
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.28.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 2602060425492843205.28.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 2602060425492843205.28.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 2602060425492843205 29 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 29
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.29.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 2602060425492843205.29.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 2602060425492843205.29.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 2602060425492843205 30 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 30
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.30.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 2602060425492843205.30.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 2602060425492843205.30.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 2602060425492843205 31 -100 100 50 on 0
normal mode computation
generate a series of perturbations for mode 31
calculating perturbed structure for DQ=-100
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=-50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=0
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=50
2602060425492843205.eigenfacs
2602060425492843205.atom
calculating perturbed structure for DQ=100
2602060425492843205.eigenfacs
2602060425492843205.atom
making animated gifs
5 models are in 2602060425492843205.31.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 2602060425492843205.31.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 2602060425492843205.31.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
2602060425492843205.10.pdb
2602060425492843205.11.pdb
2602060425492843205.12.pdb
2602060425492843205.13.pdb
2602060425492843205.14.pdb
2602060425492843205.15.pdb
2602060425492843205.16.pdb
2602060425492843205.17.pdb
2602060425492843205.18.pdb
2602060425492843205.19.pdb
2602060425492843205.20.pdb
2602060425492843205.21.pdb
2602060425492843205.22.pdb
2602060425492843205.23.pdb
2602060425492843205.24.pdb
2602060425492843205.25.pdb
2602060425492843205.26.pdb
2602060425492843205.27.pdb
2602060425492843205.28.pdb
2602060425492843205.29.pdb
2602060425492843205.30.pdb
2602060425492843205.31.pdb
2602060425492843205.7.pdb
2602060425492843205.8.pdb
2602060425492843205.9.pdb
STDERR:
Note: The following floating-point exceptions are signalling: IEEE_DENORMAL
real 0m15.115s
user 0m14.641s
sys 0m0.462s
rm: cannot remove '2602060425492843205.sdijf': No such file or directory
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If you find results from this site helpful for your research, please cite one of our papers:
elNémo
is maintained by Yves-Henri Sanejouand.
It was developed
by Karsten Suhre.
Between 2003 and 2014, it was hosted by IGS (Marseille).
Between 2015 and 2025, it was hosted by US2B (Nantes).
Last modification: december 26th, 2025.
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