*** ***
output from eigenvector calculation:
STDOUT:
CUTOFF set to default value (CUTOFF=8)
Build Tirion matrix:
Pdbmat> Computes the Hessian matrix, using an Elastic Network Model.
Pdbmat> Version 3.50, Fevrier 2004.
Pdbmat> Options to be read in pdbmat.dat file.
Pdbmat> Coordinate filename = 240415152934446788.atom
Pdbmat> Distance cutoff = 8.00
Force constant = 10.00
Origin of mass values = CONS
Pdbmat> Levelshift = 1.0E-09
PRINTing level = 2
Pdbmat> Coordinate file 240415152934446788.atom to be opened.
Openam> File opened: 240415152934446788.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 = 313
First residue number = 1
Last residue number = 313
Number of atoms found = 4965
Mean number per residue = 15.9
Pdbmat> Coordinate statistics:
= 66.101605 +/- 12.710594 From: 35.530000 To: 98.550000
= 45.455827 +/- 9.357394 From: 21.400000 To: 66.090000
= 59.061166 +/- 11.647569 From: 35.870000 To: 85.950000
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 3.1906 % Filled.
Pdbmat> 3539609 non-zero elements.
Pdbmat> 390585 atom-atom interactions.
Pdbmat> Number per atom= 157.34 +/- 47.47
Maximum number = 250
Minimum number = 29
Pdbmat> Matrix trace = 7.811700E+06
Pdbmat> Larger element = 898.205
Pdbmat> 0 elements larger than +/- 1.0E+10
Pdbmat> Normal end.
automatic determination of NRBL (NRBL = nresidues/200 + 1)
313 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 = 240415152934446788.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 240415152934446788.atom to be opened.
Openam> file on opening on unit 11:
240415152934446788.atom
Blocpdb> Coordinate file in PDB format.
Blocpdb> 4965 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> 313 residues.
Blocpdb> 26 atoms in block 1
Block first atom: 1
Blocpdb> 24 atoms in block 2
Block first atom: 27
Blocpdb> 27 atoms in block 3
Block first atom: 51
Blocpdb> 21 atoms in block 4
Block first atom: 78
Blocpdb> 25 atoms in block 5
Block first atom: 99
Blocpdb> 31 atoms in block 6
Block first atom: 124
Blocpdb> 43 atoms in block 7
Block first atom: 155
Blocpdb> 28 atoms in block 8
Block first atom: 198
Blocpdb> 38 atoms in block 9
Block first atom: 226
Blocpdb> 24 atoms in block 10
Block first atom: 264
Blocpdb> 27 atoms in block 11
Block first atom: 288
Blocpdb> 41 atoms in block 12
Block first atom: 315
Blocpdb> 21 atoms in block 13
Block first atom: 356
Blocpdb> 30 atoms in block 14
Block first atom: 377
Blocpdb> 38 atoms in block 15
Block first atom: 407
Blocpdb> 43 atoms in block 16
Block first atom: 445
Blocpdb> 28 atoms in block 17
Block first atom: 488
Blocpdb> 33 atoms in block 18
Block first atom: 516
Blocpdb> 34 atoms in block 19
Block first atom: 549
Blocpdb> 30 atoms in block 20
Block first atom: 583
Blocpdb> 33 atoms in block 21
Block first atom: 613
Blocpdb> 18 atoms in block 22
Block first atom: 646
Blocpdb> 29 atoms in block 23
Block first atom: 664
Blocpdb> 31 atoms in block 24
Block first atom: 693
Blocpdb> 35 atoms in block 25
Block first atom: 724
Blocpdb> 30 atoms in block 26
Block first atom: 759
Blocpdb> 36 atoms in block 27
Block first atom: 789
Blocpdb> 33 atoms in block 28
Block first atom: 825
Blocpdb> 33 atoms in block 29
Block first atom: 858
Blocpdb> 28 atoms in block 30
Block first atom: 891
Blocpdb> 30 atoms in block 31
Block first atom: 919
Blocpdb> 35 atoms in block 32
Block first atom: 949
Blocpdb> 38 atoms in block 33
Block first atom: 984
Blocpdb> 36 atoms in block 34
Block first atom: 1022
Blocpdb> 33 atoms in block 35
Block first atom: 1058
Blocpdb> 32 atoms in block 36
Block first atom: 1091
Blocpdb> 33 atoms in block 37
Block first atom: 1123
Blocpdb> 30 atoms in block 38
Block first atom: 1156
Blocpdb> 38 atoms in block 39
Block first atom: 1186
Blocpdb> 30 atoms in block 40
Block first atom: 1224
Blocpdb> 35 atoms in block 41
Block first atom: 1254
Blocpdb> 46 atoms in block 42
Block first atom: 1289
Blocpdb> 27 atoms in block 43
Block first atom: 1335
Blocpdb> 31 atoms in block 44
Block first atom: 1362
Blocpdb> 29 atoms in block 45
Block first atom: 1393
Blocpdb> 28 atoms in block 46
Block first atom: 1422
Blocpdb> 29 atoms in block 47
Block first atom: 1450
Blocpdb> 36 atoms in block 48
Block first atom: 1479
Blocpdb> 22 atoms in block 49
Block first atom: 1515
Blocpdb> 23 atoms in block 50
Block first atom: 1537
Blocpdb> 45 atoms in block 51
Block first atom: 1560
Blocpdb> 31 atoms in block 52
Block first atom: 1605
Blocpdb> 43 atoms in block 53
Block first atom: 1636
Blocpdb> 29 atoms in block 54
Block first atom: 1679
Blocpdb> 34 atoms in block 55
Block first atom: 1708
Blocpdb> 34 atoms in block 56
Block first atom: 1742
Blocpdb> 18 atoms in block 57
Block first atom: 1776
Blocpdb> 37 atoms in block 58
Block first atom: 1794
Blocpdb> 33 atoms in block 59
Block first atom: 1831
Blocpdb> 37 atoms in block 60
Block first atom: 1864
Blocpdb> 33 atoms in block 61
Block first atom: 1901
Blocpdb> 33 atoms in block 62
Block first atom: 1934
Blocpdb> 35 atoms in block 63
Block first atom: 1967
Blocpdb> 24 atoms in block 64
Block first atom: 2002
Blocpdb> 35 atoms in block 65
Block first atom: 2026
Blocpdb> 27 atoms in block 66
Block first atom: 2061
Blocpdb> 33 atoms in block 67
Block first atom: 2088
Blocpdb> 29 atoms in block 68
Block first atom: 2121
Blocpdb> 30 atoms in block 69
Block first atom: 2150
Blocpdb> 39 atoms in block 70
Block first atom: 2180
Blocpdb> 34 atoms in block 71
Block first atom: 2219
Blocpdb> 41 atoms in block 72
Block first atom: 2253
Blocpdb> 38 atoms in block 73
Block first atom: 2294
Blocpdb> 31 atoms in block 74
Block first atom: 2332
Blocpdb> 35 atoms in block 75
Block first atom: 2363
Blocpdb> 29 atoms in block 76
Block first atom: 2398
Blocpdb> 35 atoms in block 77
Block first atom: 2427
Blocpdb> 34 atoms in block 78
Block first atom: 2462
Blocpdb> 22 atoms in block 79
Block first atom: 2496
Blocpdb> 30 atoms in block 80
Block first atom: 2518
Blocpdb> 27 atoms in block 81
Block first atom: 2548
Blocpdb> 36 atoms in block 82
Block first atom: 2575
Blocpdb> 36 atoms in block 83
Block first atom: 2611
Blocpdb> 35 atoms in block 84
Block first atom: 2647
Blocpdb> 21 atoms in block 85
Block first atom: 2682
Blocpdb> 41 atoms in block 86
Block first atom: 2703
Blocpdb> 33 atoms in block 87
Block first atom: 2744
Blocpdb> 27 atoms in block 88
Block first atom: 2777
Blocpdb> 29 atoms in block 89
Block first atom: 2804
Blocpdb> 30 atoms in block 90
Block first atom: 2833
Blocpdb> 38 atoms in block 91
Block first atom: 2863
Blocpdb> 22 atoms in block 92
Block first atom: 2901
Blocpdb> 30 atoms in block 93
Block first atom: 2923
Blocpdb> 33 atoms in block 94
Block first atom: 2953
Blocpdb> 41 atoms in block 95
Block first atom: 2986
Blocpdb> 43 atoms in block 96
Block first atom: 3027
Blocpdb> 35 atoms in block 97
Block first atom: 3070
Blocpdb> 24 atoms in block 98
Block first atom: 3105
Blocpdb> 33 atoms in block 99
Block first atom: 3129
Blocpdb> 35 atoms in block 100
Block first atom: 3162
Blocpdb> 32 atoms in block 101
Block first atom: 3197
Blocpdb> 27 atoms in block 102
Block first atom: 3229
Blocpdb> 26 atoms in block 103
Block first atom: 3256
Blocpdb> 30 atoms in block 104
Block first atom: 3282
Blocpdb> 48 atoms in block 105
Block first atom: 3312
Blocpdb> 34 atoms in block 106
Block first atom: 3360
Blocpdb> 34 atoms in block 107
Block first atom: 3394
Blocpdb> 38 atoms in block 108
Block first atom: 3428
Blocpdb> 23 atoms in block 109
Block first atom: 3466
Blocpdb> 35 atoms in block 110
Block first atom: 3489
Blocpdb> 48 atoms in block 111
Block first atom: 3524
Blocpdb> 21 atoms in block 112
Block first atom: 3572
Blocpdb> 40 atoms in block 113
Block first atom: 3593
Blocpdb> 36 atoms in block 114
Block first atom: 3633
Blocpdb> 25 atoms in block 115
Block first atom: 3669
Blocpdb> 38 atoms in block 116
Block first atom: 3694
Blocpdb> 45 atoms in block 117
Block first atom: 3732
Blocpdb> 34 atoms in block 118
Block first atom: 3777
Blocpdb> 31 atoms in block 119
Block first atom: 3811
Blocpdb> 33 atoms in block 120
Block first atom: 3842
Blocpdb> 18 atoms in block 121
Block first atom: 3875
Blocpdb> 38 atoms in block 122
Block first atom: 3893
Blocpdb> 14 atoms in block 123
Block first atom: 3931
Blocpdb> 39 atoms in block 124
Block first atom: 3945
Blocpdb> 26 atoms in block 125
Block first atom: 3984
Blocpdb> 26 atoms in block 126
Block first atom: 4010
Blocpdb> 33 atoms in block 127
Block first atom: 4036
Blocpdb> 25 atoms in block 128
Block first atom: 4069
Blocpdb> 26 atoms in block 129
Block first atom: 4094
Blocpdb> 34 atoms in block 130
Block first atom: 4120
Blocpdb> 39 atoms in block 131
Block first atom: 4154
Blocpdb> 33 atoms in block 132
Block first atom: 4193
Blocpdb> 28 atoms in block 133
Block first atom: 4226
Blocpdb> 33 atoms in block 134
Block first atom: 4254
Blocpdb> 43 atoms in block 135
Block first atom: 4287
Blocpdb> 21 atoms in block 136
Block first atom: 4330
Blocpdb> 40 atoms in block 137
Block first atom: 4351
Blocpdb> 39 atoms in block 138
Block first atom: 4391
Blocpdb> 28 atoms in block 139
Block first atom: 4430
Blocpdb> 21 atoms in block 140
Block first atom: 4458
Blocpdb> 21 atoms in block 141
Block first atom: 4479
Blocpdb> 35 atoms in block 142
Block first atom: 4500
Blocpdb> 25 atoms in block 143
Block first atom: 4535
Blocpdb> 33 atoms in block 144
Block first atom: 4560
Blocpdb> 29 atoms in block 145
Block first atom: 4593
Blocpdb> 19 atoms in block 146
Block first atom: 4622
Blocpdb> 39 atoms in block 147
Block first atom: 4641
Blocpdb> 17 atoms in block 148
Block first atom: 4680
Blocpdb> 19 atoms in block 149
Block first atom: 4697
Blocpdb> 36 atoms in block 150
Block first atom: 4716
Blocpdb> 23 atoms in block 151
Block first atom: 4752
Blocpdb> 35 atoms in block 152
Block first atom: 4775
Blocpdb> 29 atoms in block 153
Block first atom: 4810
Blocpdb> 31 atoms in block 154
Block first atom: 4839
Blocpdb> 41 atoms in block 155
Block first atom: 4870
Blocpdb> 43 atoms in block 156
Block first atom: 4911
Blocpdb> 12 atoms in block 157
Block first atom: 4953
Blocpdb> 157 blocks.
Blocpdb> At most, 48 atoms in each of them.
Blocpdb> At least, 12 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> 3539766 matrix lines read.
Prepmat> Matrix order = 14895
Prepmat> Matrix trace = 7811700.0000
Prepmat> Last element read: 14895 14895 96.9014
Prepmat> 12404 lines saved.
Prepmat> 10387 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: 4965
RTB> Total mass = 4965.0000
RTB> Number of atoms found in matrix: 4965
RTB> Number of blocks = 157
RTB> Projection begins.
RTB> Projected matrix is being saved.
RTB> Projected matrix trace = 415564.4546
RTB> 70221 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 = 942
Diagstd> Nb of non-zero elements: 70221
Diagstd> Projected matrix trace = 415564.4546
Openam> file on opening on unit 11:
diagrtb_work.eigenfacs
Diagstd> Diagonalization.
Diagstd> 942 eigenvectors are computed.
Diagstd> 106 of them to be saved.
Diagstd> Sum of eigenvalues = 415564.4546
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 5.7333920 7.7055033 11.3244798 13.4608681
16.1773051 18.9604007 21.2252360 24.9298681 25.0261219
25.9471897 27.3855153 29.6485538 30.7531605 32.3874452
33.7816534 35.8517792 36.8554310 39.9324476 42.2538910
43.1732809 43.2871276 44.7522121 46.8423809 49.1441748
50.0526108 51.3064799 54.0565712 55.6353939 56.4454708
59.3285775 59.4581965 61.1986008 61.6439686 63.0016773
64.3276260 66.8946176 68.2699541 69.5124966 70.0921360
70.8089251 71.1938248 71.9816776 74.5757436 76.0655837
76.8933195 77.7734485 79.2617453 80.5968959 82.3622809
84.2101464 86.4182030 88.5802537 89.4112879 90.1075064
91.8396358 94.1066172 95.2662229 95.6163011 96.6971058
98.3897701 100.2245359 100.9737064 101.9555124 103.5374654
107.2776032 109.4276515 110.1524390 110.5343300 111.5399589
112.4958860 114.0951071 114.9658443 117.3080694 118.0126407
119.0573489 119.8298168 120.9995731 122.9506526 123.6414988
124.1657037 126.0543398 127.8308169 128.5441565 129.0638467
130.5513237 131.7035970 132.9491241 134.6816669 136.0056836
136.5758632 138.4136290 138.6040421 139.8126957 142.0553007
143.4756852 145.1306530 145.8494766 146.8174778 148.1282514
148.5170419
Diagstd> Frequencies (cm-1, if the input matrix is a hessian in CHARMM units):
0.0034326 0.0034329 0.0034335 0.0034346 0.0034360
0.0034383 260.0166141 301.4364630 365.4301786 398.4114539
436.7655427 472.8452556 500.2896801 542.1947036 543.2403972
553.1468507 568.2713211 591.2852389 602.1991766 617.9930999
631.1545698 650.2054969 659.2437596 686.2119003 705.8763545
713.5145060 714.4546457 726.4446571 743.2155039 761.2570085
768.2607536 777.8240908 798.3981609 809.9735998 815.8490839
836.4254678 837.3386664 849.5051711 852.5906695 861.9286885
870.9516420 888.1593008 897.2430145 905.3713004 909.1382451
913.7750192 916.2551802 921.3110122 937.7651231 947.0859228
952.2250130 957.6591408 966.7787494 974.8873567 985.5064313
996.5004325 1009.4804110 1022.0302263 1026.8132298 1030.8032187
1040.6635822 1053.4292220 1059.8996617 1061.8453017 1067.8297545
1077.1352857 1087.1320693 1091.1876179 1096.4798023 1104.9536092
1124.7339674 1135.9489632 1139.7046998 1141.6786294 1146.8603026
1151.7642670 1159.9220129 1164.3396763 1176.1405515 1179.6673090
1184.8773131 1188.7149591 1194.5028746 1204.0948515 1207.4729511
1210.0299154 1219.1978308 1227.7588194 1231.1797100 1233.6659632
1240.7546743 1246.2182256 1252.0971311 1260.2291523 1266.4084777
1269.0602971 1277.5700085 1278.4484714 1284.0105288 1294.2673699
1300.7218447 1308.2021391 1311.4378617 1315.7826630 1321.6432078
1323.3765221
Diagstd> Normal end.
Rtb_to_modes> Entering in.
Rtb_to_modes> Number of atoms in temporary block-file = 4965
Rtb_to_modes> Number of blocs = 157
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: 9.9919E-10
Rdmodfacs> Eigenvector number: 2
Rdmodfacs> Corresponding eigenvalue: 9.9939E-10
Rdmodfacs> Eigenvector number: 3
Rdmodfacs> Corresponding eigenvalue: 9.9976E-10
Rdmodfacs> Eigenvector number: 4
Rdmodfacs> Corresponding eigenvalue: 1.0003E-09
Rdmodfacs> Eigenvector number: 5
Rdmodfacs> Corresponding eigenvalue: 1.0012E-09
Rdmodfacs> Eigenvector number: 6
Rdmodfacs> Corresponding eigenvalue: 1.0025E-09
Rdmodfacs> Eigenvector number: 7
Rdmodfacs> Corresponding eigenvalue: 5.733
Rdmodfacs> Eigenvector number: 8
Rdmodfacs> Corresponding eigenvalue: 7.706
Rdmodfacs> Eigenvector number: 9
Rdmodfacs> Corresponding eigenvalue: 11.32
Rdmodfacs> Eigenvector number: 10
Rdmodfacs> Corresponding eigenvalue: 13.46
Rdmodfacs> Eigenvector number: 11
Rdmodfacs> Corresponding eigenvalue: 16.18
Rdmodfacs> Eigenvector number: 12
Rdmodfacs> Corresponding eigenvalue: 18.96
Rdmodfacs> Eigenvector number: 13
Rdmodfacs> Corresponding eigenvalue: 21.23
Rdmodfacs> Eigenvector number: 14
Rdmodfacs> Corresponding eigenvalue: 24.93
Rdmodfacs> Eigenvector number: 15
Rdmodfacs> Corresponding eigenvalue: 25.03
Rdmodfacs> Eigenvector number: 16
Rdmodfacs> Corresponding eigenvalue: 25.95
Rdmodfacs> Eigenvector number: 17
Rdmodfacs> Corresponding eigenvalue: 27.39
Rdmodfacs> Eigenvector number: 18
Rdmodfacs> Corresponding eigenvalue: 29.65
Rdmodfacs> Eigenvector number: 19
Rdmodfacs> Corresponding eigenvalue: 30.75
Rdmodfacs> Eigenvector number: 20
Rdmodfacs> Corresponding eigenvalue: 32.39
Rdmodfacs> Eigenvector number: 21
Rdmodfacs> Corresponding eigenvalue: 33.78
Rdmodfacs> Eigenvector number: 22
Rdmodfacs> Corresponding eigenvalue: 35.85
Rdmodfacs> Eigenvector number: 23
Rdmodfacs> Corresponding eigenvalue: 36.86
Rdmodfacs> Eigenvector number: 24
Rdmodfacs> Corresponding eigenvalue: 39.93
Rdmodfacs> Eigenvector number: 25
Rdmodfacs> Corresponding eigenvalue: 42.25
Rdmodfacs> Eigenvector number: 26
Rdmodfacs> Corresponding eigenvalue: 43.17
Rdmodfacs> Eigenvector number: 27
Rdmodfacs> Corresponding eigenvalue: 43.29
Rdmodfacs> Eigenvector number: 28
Rdmodfacs> Corresponding eigenvalue: 44.75
Rdmodfacs> Eigenvector number: 29
Rdmodfacs> Corresponding eigenvalue: 46.84
Rdmodfacs> Eigenvector number: 30
Rdmodfacs> Corresponding eigenvalue: 49.14
Rdmodfacs> Eigenvector number: 31
Rdmodfacs> Corresponding eigenvalue: 50.05
Rdmodfacs> Eigenvector number: 32
Rdmodfacs> Corresponding eigenvalue: 51.31
Rdmodfacs> Eigenvector number: 33
Rdmodfacs> Corresponding eigenvalue: 54.06
Rdmodfacs> Eigenvector number: 34
Rdmodfacs> Corresponding eigenvalue: 55.64
Rdmodfacs> Eigenvector number: 35
Rdmodfacs> Corresponding eigenvalue: 56.45
Rdmodfacs> Eigenvector number: 36
Rdmodfacs> Corresponding eigenvalue: 59.33
Rdmodfacs> Eigenvector number: 37
Rdmodfacs> Corresponding eigenvalue: 59.46
Rdmodfacs> Eigenvector number: 38
Rdmodfacs> Corresponding eigenvalue: 61.20
Rdmodfacs> Eigenvector number: 39
Rdmodfacs> Corresponding eigenvalue: 61.64
Rdmodfacs> Eigenvector number: 40
Rdmodfacs> Corresponding eigenvalue: 63.00
Rdmodfacs> Eigenvector number: 41
Rdmodfacs> Corresponding eigenvalue: 64.33
Rdmodfacs> Eigenvector number: 42
Rdmodfacs> Corresponding eigenvalue: 66.89
Rdmodfacs> Eigenvector number: 43
Rdmodfacs> Corresponding eigenvalue: 68.27
Rdmodfacs> Eigenvector number: 44
Rdmodfacs> Corresponding eigenvalue: 69.51
Rdmodfacs> Eigenvector number: 45
Rdmodfacs> Corresponding eigenvalue: 70.09
Rdmodfacs> Eigenvector number: 46
Rdmodfacs> Corresponding eigenvalue: 70.81
Rdmodfacs> Eigenvector number: 47
Rdmodfacs> Corresponding eigenvalue: 71.19
Rdmodfacs> Eigenvector number: 48
Rdmodfacs> Corresponding eigenvalue: 71.98
Rdmodfacs> Eigenvector number: 49
Rdmodfacs> Corresponding eigenvalue: 74.58
Rdmodfacs> Eigenvector number: 50
Rdmodfacs> Corresponding eigenvalue: 76.07
Rdmodfacs> Eigenvector number: 51
Rdmodfacs> Corresponding eigenvalue: 76.89
Rdmodfacs> Eigenvector number: 52
Rdmodfacs> Corresponding eigenvalue: 77.77
Rdmodfacs> Eigenvector number: 53
Rdmodfacs> Corresponding eigenvalue: 79.26
Rdmodfacs> Eigenvector number: 54
Rdmodfacs> Corresponding eigenvalue: 80.60
Rdmodfacs> Eigenvector number: 55
Rdmodfacs> Corresponding eigenvalue: 82.36
Rdmodfacs> Eigenvector number: 56
Rdmodfacs> Corresponding eigenvalue: 84.21
Rdmodfacs> Eigenvector number: 57
Rdmodfacs> Corresponding eigenvalue: 86.42
Rdmodfacs> Eigenvector number: 58
Rdmodfacs> Corresponding eigenvalue: 88.58
Rdmodfacs> Eigenvector number: 59
Rdmodfacs> Corresponding eigenvalue: 89.41
Rdmodfacs> Eigenvector number: 60
Rdmodfacs> Corresponding eigenvalue: 90.11
Rdmodfacs> Eigenvector number: 61
Rdmodfacs> Corresponding eigenvalue: 91.84
Rdmodfacs> Eigenvector number: 62
Rdmodfacs> Corresponding eigenvalue: 94.11
Rdmodfacs> Eigenvector number: 63
Rdmodfacs> Corresponding eigenvalue: 95.27
Rdmodfacs> Eigenvector number: 64
Rdmodfacs> Corresponding eigenvalue: 95.62
Rdmodfacs> Eigenvector number: 65
Rdmodfacs> Corresponding eigenvalue: 96.70
Rdmodfacs> Eigenvector number: 66
Rdmodfacs> Corresponding eigenvalue: 98.39
Rdmodfacs> Eigenvector number: 67
Rdmodfacs> Corresponding eigenvalue: 100.2
Rdmodfacs> Eigenvector number: 68
Rdmodfacs> Corresponding eigenvalue: 101.0
Rdmodfacs> Eigenvector number: 69
Rdmodfacs> Corresponding eigenvalue: 102.0
Rdmodfacs> Eigenvector number: 70
Rdmodfacs> Corresponding eigenvalue: 103.5
Rdmodfacs> Eigenvector number: 71
Rdmodfacs> Corresponding eigenvalue: 107.3
Rdmodfacs> Eigenvector number: 72
Rdmodfacs> Corresponding eigenvalue: 109.4
Rdmodfacs> Eigenvector number: 73
Rdmodfacs> Corresponding eigenvalue: 110.2
Rdmodfacs> Eigenvector number: 74
Rdmodfacs> Corresponding eigenvalue: 110.5
Rdmodfacs> Eigenvector number: 75
Rdmodfacs> Corresponding eigenvalue: 111.5
Rdmodfacs> Eigenvector number: 76
Rdmodfacs> Corresponding eigenvalue: 112.5
Rdmodfacs> Eigenvector number: 77
Rdmodfacs> Corresponding eigenvalue: 114.1
Rdmodfacs> Eigenvector number: 78
Rdmodfacs> Corresponding eigenvalue: 115.0
Rdmodfacs> Eigenvector number: 79
Rdmodfacs> Corresponding eigenvalue: 117.3
Rdmodfacs> Eigenvector number: 80
Rdmodfacs> Corresponding eigenvalue: 118.0
Rdmodfacs> Eigenvector number: 81
Rdmodfacs> Corresponding eigenvalue: 119.1
Rdmodfacs> Eigenvector number: 82
Rdmodfacs> Corresponding eigenvalue: 119.8
Rdmodfacs> Eigenvector number: 83
Rdmodfacs> Corresponding eigenvalue: 121.0
Rdmodfacs> Eigenvector number: 84
Rdmodfacs> Corresponding eigenvalue: 123.0
Rdmodfacs> Eigenvector number: 85
Rdmodfacs> Corresponding eigenvalue: 123.6
Rdmodfacs> Eigenvector number: 86
Rdmodfacs> Corresponding eigenvalue: 124.2
Rdmodfacs> Eigenvector number: 87
Rdmodfacs> Corresponding eigenvalue: 126.1
Rdmodfacs> Eigenvector number: 88
Rdmodfacs> Corresponding eigenvalue: 127.8
Rdmodfacs> Eigenvector number: 89
Rdmodfacs> Corresponding eigenvalue: 128.5
Rdmodfacs> Eigenvector number: 90
Rdmodfacs> Corresponding eigenvalue: 129.1
Rdmodfacs> Eigenvector number: 91
Rdmodfacs> Corresponding eigenvalue: 130.6
Rdmodfacs> Eigenvector number: 92
Rdmodfacs> Corresponding eigenvalue: 131.7
Rdmodfacs> Eigenvector number: 93
Rdmodfacs> Corresponding eigenvalue: 132.9
Rdmodfacs> Eigenvector number: 94
Rdmodfacs> Corresponding eigenvalue: 134.7
Rdmodfacs> Eigenvector number: 95
Rdmodfacs> Corresponding eigenvalue: 136.0
Rdmodfacs> Eigenvector number: 96
Rdmodfacs> Corresponding eigenvalue: 136.6
Rdmodfacs> Eigenvector number: 97
Rdmodfacs> Corresponding eigenvalue: 138.4
Rdmodfacs> Eigenvector number: 98
Rdmodfacs> Corresponding eigenvalue: 138.6
Rdmodfacs> Eigenvector number: 99
Rdmodfacs> Corresponding eigenvalue: 139.8
Rdmodfacs> Eigenvector number: 100
Rdmodfacs> Corresponding eigenvalue: 142.1
Rdmodfacs> Eigenvector number: 101
Rdmodfacs> Corresponding eigenvalue: 143.5
Rdmodfacs> Eigenvector number: 102
Rdmodfacs> Corresponding eigenvalue: 145.1
Rdmodfacs> Eigenvector number: 103
Rdmodfacs> Corresponding eigenvalue: 145.8
Rdmodfacs> Eigenvector number: 104
Rdmodfacs> Corresponding eigenvalue: 146.8
Rdmodfacs> Eigenvector number: 105
Rdmodfacs> Corresponding eigenvalue: 148.1
Rdmodfacs> Eigenvector number: 106
Rdmodfacs> Corresponding eigenvalue: 148.5
Rtb_to_modes> 106 vectors, with 942 coordinates in vector file.
Norm of eigenvectors in projected coordinates (one expected):
0.99999 1.00000 1.00000 1.00000 0.99998
0.99999 0.99999 1.00003 1.00003 0.99999
1.00001 1.00000 1.00002 1.00001 0.99998
1.00001 0.99999 1.00003 1.00000 0.99999
1.00002 0.99998 0.99997 0.99999 1.00000
0.99999 0.99999 1.00001 1.00001 1.00000
0.99999 1.00000 1.00001 0.99999 1.00003
1.00002 1.00001 0.99997 1.00002 1.00001
0.99999 0.99999 1.00002 0.99999 0.99997
0.99999 0.99996 1.00002 0.99998 1.00002
0.99998 0.99996 0.99998 0.99997 0.99999
1.00001 1.00001 0.99999 1.00004 1.00000
1.00001 1.00002 0.99998 0.99998 1.00000
1.00002 0.99997 1.00003 0.99998 1.00000
0.99999 1.00000 0.99999 1.00000 0.99999
1.00001 1.00001 0.99999 1.00002 0.99998
1.00000 1.00000 0.99999 0.99999 0.99999
0.99998 0.99999 1.00000 1.00000 0.99998
1.00001 0.99999 0.99998 0.99998 1.00002
0.99999 1.00001 1.00004 0.99999 1.00002
1.00000 1.00000 0.99999 1.00000 1.00003
0.99999
Rtb_to_modes> RTB block-file is being read.
Rtb_to_modes> 89370 lines found in RTB file.
Norm of eigenvectors in cartesian coordinates (one expected):
0.99999 1.00000 1.00000 1.00000 0.99998
0.99999 0.99999 1.00003 1.00003 0.99999
1.00001 1.00000 1.00002 1.00001 0.99998
1.00001 0.99999 1.00003 1.00000 0.99999
1.00002 0.99998 0.99997 0.99999 1.00000
0.99999 0.99999 1.00001 1.00001 1.00000
0.99999 1.00000 1.00001 0.99999 1.00003
1.00002 1.00001 0.99997 1.00002 1.00001
0.99999 0.99999 1.00002 0.99999 0.99997
0.99999 0.99996 1.00002 0.99998 1.00002
0.99998 0.99996 0.99998 0.99997 0.99999
1.00001 1.00001 0.99999 1.00004 1.00000
1.00001 1.00002 0.99998 0.99998 1.00000
1.00002 0.99997 1.00003 0.99998 1.00000
0.99999 1.00000 0.99999 1.00000 0.99999
1.00001 1.00001 0.99999 1.00002 0.99998
1.00000 1.00000 0.99999 0.99999 0.99999
0.99998 0.99999 1.00000 1.00000 0.99998
1.00001 0.99999 0.99998 0.99998 1.00002
0.99999 1.00001 1.00004 0.99999 1.00002
1.00000 1.00000 0.99999 1.00000 1.00003
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> 240415152934446788.eigenfacs
Openam> file on opening on unit 10:
240415152934446788.eigenfacs
Getnam> Corresponding pdb filename ?
Getnam> 240415152934446788.atom
Openam> file on opening on unit 11:
240415152934446788.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 = 313
First residue number = 1
Last residue number = 313
Number of atoms found = 4965
Mean number per residue = 15.9
Rdmodfacs> Old Blzpack file format detected.
Rdmodfacs> Numero du vecteur CERFACS en lecture: 1
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9919E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 2
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9939E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 3
Rdmodfacs> Valeur propre du vecteur en lecture: 9.9976E-10
Rdmodfacs> Numero du vecteur CERFACS en lecture: 4
Rdmodfacs> Valeur propre du vecteur en lecture: 1.0003E-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: 1.0025E-09
Rdmodfacs> Numero du vecteur CERFACS en lecture: 7
Rdmodfacs> Valeur propre du vecteur en lecture: 5.733
Rdmodfacs> Numero du vecteur CERFACS en lecture: 8
Rdmodfacs> Valeur propre du vecteur en lecture: 7.706
Rdmodfacs> Numero du vecteur CERFACS en lecture: 9
Rdmodfacs> Valeur propre du vecteur en lecture: 11.32
Rdmodfacs> Numero du vecteur CERFACS en lecture: 10
Rdmodfacs> Valeur propre du vecteur en lecture: 13.46
Rdmodfacs> Numero du vecteur CERFACS en lecture: 11
Rdmodfacs> Valeur propre du vecteur en lecture: 16.18
Rdmodfacs> Numero du vecteur CERFACS en lecture: 12
Rdmodfacs> Valeur propre du vecteur en lecture: 18.96
Rdmodfacs> Numero du vecteur CERFACS en lecture: 13
Rdmodfacs> Valeur propre du vecteur en lecture: 21.23
Rdmodfacs> Numero du vecteur CERFACS en lecture: 14
Rdmodfacs> Valeur propre du vecteur en lecture: 24.93
Rdmodfacs> Numero du vecteur CERFACS en lecture: 15
Rdmodfacs> Valeur propre du vecteur en lecture: 25.03
Rdmodfacs> Numero du vecteur CERFACS en lecture: 16
Rdmodfacs> Valeur propre du vecteur en lecture: 25.95
Rdmodfacs> Numero du vecteur CERFACS en lecture: 17
Rdmodfacs> Valeur propre du vecteur en lecture: 27.39
Rdmodfacs> Numero du vecteur CERFACS en lecture: 18
Rdmodfacs> Valeur propre du vecteur en lecture: 29.65
Rdmodfacs> Numero du vecteur CERFACS en lecture: 19
Rdmodfacs> Valeur propre du vecteur en lecture: 30.75
Rdmodfacs> Numero du vecteur CERFACS en lecture: 20
Rdmodfacs> Valeur propre du vecteur en lecture: 32.39
Rdmodfacs> Numero du vecteur CERFACS en lecture: 21
Rdmodfacs> Valeur propre du vecteur en lecture: 33.78
Rdmodfacs> Numero du vecteur CERFACS en lecture: 22
Rdmodfacs> Valeur propre du vecteur en lecture: 35.85
Rdmodfacs> Numero du vecteur CERFACS en lecture: 23
Rdmodfacs> Valeur propre du vecteur en lecture: 36.86
Rdmodfacs> Numero du vecteur CERFACS en lecture: 24
Rdmodfacs> Valeur propre du vecteur en lecture: 39.93
Rdmodfacs> Numero du vecteur CERFACS en lecture: 25
Rdmodfacs> Valeur propre du vecteur en lecture: 42.25
Rdmodfacs> Numero du vecteur CERFACS en lecture: 26
Rdmodfacs> Valeur propre du vecteur en lecture: 43.17
Rdmodfacs> Numero du vecteur CERFACS en lecture: 27
Rdmodfacs> Valeur propre du vecteur en lecture: 43.29
Rdmodfacs> Numero du vecteur CERFACS en lecture: 28
Rdmodfacs> Valeur propre du vecteur en lecture: 44.75
Rdmodfacs> Numero du vecteur CERFACS en lecture: 29
Rdmodfacs> Valeur propre du vecteur en lecture: 46.84
Rdmodfacs> Numero du vecteur CERFACS en lecture: 30
Rdmodfacs> Valeur propre du vecteur en lecture: 49.14
Rdmodfacs> Numero du vecteur CERFACS en lecture: 31
Rdmodfacs> Valeur propre du vecteur en lecture: 50.05
Rdmodfacs> Numero du vecteur CERFACS en lecture: 32
Rdmodfacs> Valeur propre du vecteur en lecture: 51.31
Rdmodfacs> Numero du vecteur CERFACS en lecture: 33
Rdmodfacs> Valeur propre du vecteur en lecture: 54.06
Rdmodfacs> Numero du vecteur CERFACS en lecture: 34
Rdmodfacs> Valeur propre du vecteur en lecture: 55.64
Rdmodfacs> Numero du vecteur CERFACS en lecture: 35
Rdmodfacs> Valeur propre du vecteur en lecture: 56.45
Rdmodfacs> Numero du vecteur CERFACS en lecture: 36
Rdmodfacs> Valeur propre du vecteur en lecture: 59.33
Rdmodfacs> Numero du vecteur CERFACS en lecture: 37
Rdmodfacs> Valeur propre du vecteur en lecture: 59.46
Rdmodfacs> Numero du vecteur CERFACS en lecture: 38
Rdmodfacs> Valeur propre du vecteur en lecture: 61.20
Rdmodfacs> Numero du vecteur CERFACS en lecture: 39
Rdmodfacs> Valeur propre du vecteur en lecture: 61.64
Rdmodfacs> Numero du vecteur CERFACS en lecture: 40
Rdmodfacs> Valeur propre du vecteur en lecture: 63.00
Rdmodfacs> Numero du vecteur CERFACS en lecture: 41
Rdmodfacs> Valeur propre du vecteur en lecture: 64.33
Rdmodfacs> Numero du vecteur CERFACS en lecture: 42
Rdmodfacs> Valeur propre du vecteur en lecture: 66.89
Rdmodfacs> Numero du vecteur CERFACS en lecture: 43
Rdmodfacs> Valeur propre du vecteur en lecture: 68.27
Rdmodfacs> Numero du vecteur CERFACS en lecture: 44
Rdmodfacs> Valeur propre du vecteur en lecture: 69.51
Rdmodfacs> Numero du vecteur CERFACS en lecture: 45
Rdmodfacs> Valeur propre du vecteur en lecture: 70.09
Rdmodfacs> Numero du vecteur CERFACS en lecture: 46
Rdmodfacs> Valeur propre du vecteur en lecture: 70.81
Rdmodfacs> Numero du vecteur CERFACS en lecture: 47
Rdmodfacs> Valeur propre du vecteur en lecture: 71.19
Rdmodfacs> Numero du vecteur CERFACS en lecture: 48
Rdmodfacs> Valeur propre du vecteur en lecture: 71.98
Rdmodfacs> Numero du vecteur CERFACS en lecture: 49
Rdmodfacs> Valeur propre du vecteur en lecture: 74.58
Rdmodfacs> Numero du vecteur CERFACS en lecture: 50
Rdmodfacs> Valeur propre du vecteur en lecture: 76.07
Rdmodfacs> Numero du vecteur CERFACS en lecture: 51
Rdmodfacs> Valeur propre du vecteur en lecture: 76.89
Rdmodfacs> Numero du vecteur CERFACS en lecture: 52
Rdmodfacs> Valeur propre du vecteur en lecture: 77.77
Rdmodfacs> Numero du vecteur CERFACS en lecture: 53
Rdmodfacs> Valeur propre du vecteur en lecture: 79.26
Rdmodfacs> Numero du vecteur CERFACS en lecture: 54
Rdmodfacs> Valeur propre du vecteur en lecture: 80.60
Rdmodfacs> Numero du vecteur CERFACS en lecture: 55
Rdmodfacs> Valeur propre du vecteur en lecture: 82.36
Rdmodfacs> Numero du vecteur CERFACS en lecture: 56
Rdmodfacs> Valeur propre du vecteur en lecture: 84.21
Rdmodfacs> Numero du vecteur CERFACS en lecture: 57
Rdmodfacs> Valeur propre du vecteur en lecture: 86.42
Rdmodfacs> Numero du vecteur CERFACS en lecture: 58
Rdmodfacs> Valeur propre du vecteur en lecture: 88.58
Rdmodfacs> Numero du vecteur CERFACS en lecture: 59
Rdmodfacs> Valeur propre du vecteur en lecture: 89.41
Rdmodfacs> Numero du vecteur CERFACS en lecture: 60
Rdmodfacs> Valeur propre du vecteur en lecture: 90.11
Rdmodfacs> Numero du vecteur CERFACS en lecture: 61
Rdmodfacs> Valeur propre du vecteur en lecture: 91.84
Rdmodfacs> Numero du vecteur CERFACS en lecture: 62
Rdmodfacs> Valeur propre du vecteur en lecture: 94.11
Rdmodfacs> Numero du vecteur CERFACS en lecture: 63
Rdmodfacs> Valeur propre du vecteur en lecture: 95.27
Rdmodfacs> Numero du vecteur CERFACS en lecture: 64
Rdmodfacs> Valeur propre du vecteur en lecture: 95.62
Rdmodfacs> Numero du vecteur CERFACS en lecture: 65
Rdmodfacs> Valeur propre du vecteur en lecture: 96.70
Rdmodfacs> Numero du vecteur CERFACS en lecture: 66
Rdmodfacs> Valeur propre du vecteur en lecture: 98.39
Rdmodfacs> Numero du vecteur CERFACS en lecture: 67
Rdmodfacs> Valeur propre du vecteur en lecture: 100.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 68
Rdmodfacs> Valeur propre du vecteur en lecture: 101.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 69
Rdmodfacs> Valeur propre du vecteur en lecture: 102.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 70
Rdmodfacs> Valeur propre du vecteur en lecture: 103.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 71
Rdmodfacs> Valeur propre du vecteur en lecture: 107.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 72
Rdmodfacs> Valeur propre du vecteur en lecture: 109.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 73
Rdmodfacs> Valeur propre du vecteur en lecture: 110.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 74
Rdmodfacs> Valeur propre du vecteur en lecture: 110.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 75
Rdmodfacs> Valeur propre du vecteur en lecture: 111.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 76
Rdmodfacs> Valeur propre du vecteur en lecture: 112.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 77
Rdmodfacs> Valeur propre du vecteur en lecture: 114.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 78
Rdmodfacs> Valeur propre du vecteur en lecture: 115.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 79
Rdmodfacs> Valeur propre du vecteur en lecture: 117.3
Rdmodfacs> Numero du vecteur CERFACS en lecture: 80
Rdmodfacs> Valeur propre du vecteur en lecture: 118.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 81
Rdmodfacs> Valeur propre du vecteur en lecture: 119.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 82
Rdmodfacs> Valeur propre du vecteur en lecture: 119.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 83
Rdmodfacs> Valeur propre du vecteur en lecture: 121.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 84
Rdmodfacs> Valeur propre du vecteur en lecture: 123.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 85
Rdmodfacs> Valeur propre du vecteur en lecture: 123.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 86
Rdmodfacs> Valeur propre du vecteur en lecture: 124.2
Rdmodfacs> Numero du vecteur CERFACS en lecture: 87
Rdmodfacs> Valeur propre du vecteur en lecture: 126.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 88
Rdmodfacs> Valeur propre du vecteur en lecture: 127.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 89
Rdmodfacs> Valeur propre du vecteur en lecture: 128.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 90
Rdmodfacs> Valeur propre du vecteur en lecture: 129.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 91
Rdmodfacs> Valeur propre du vecteur en lecture: 130.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 92
Rdmodfacs> Valeur propre du vecteur en lecture: 131.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 93
Rdmodfacs> Valeur propre du vecteur en lecture: 132.9
Rdmodfacs> Numero du vecteur CERFACS en lecture: 94
Rdmodfacs> Valeur propre du vecteur en lecture: 134.7
Rdmodfacs> Numero du vecteur CERFACS en lecture: 95
Rdmodfacs> Valeur propre du vecteur en lecture: 136.0
Rdmodfacs> Numero du vecteur CERFACS en lecture: 96
Rdmodfacs> Valeur propre du vecteur en lecture: 136.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 97
Rdmodfacs> Valeur propre du vecteur en lecture: 138.4
Rdmodfacs> Numero du vecteur CERFACS en lecture: 98
Rdmodfacs> Valeur propre du vecteur en lecture: 138.6
Rdmodfacs> Numero du vecteur CERFACS en lecture: 99
Rdmodfacs> Valeur propre du vecteur en lecture: 139.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 100
Rdmodfacs> Valeur propre du vecteur en lecture: 142.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 101
Rdmodfacs> Valeur propre du vecteur en lecture: 143.5
Rdmodfacs> Numero du vecteur CERFACS en lecture: 102
Rdmodfacs> Valeur propre du vecteur en lecture: 145.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 103
Rdmodfacs> Valeur propre du vecteur en lecture: 145.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 104
Rdmodfacs> Valeur propre du vecteur en lecture: 146.8
Rdmodfacs> Numero du vecteur CERFACS en lecture: 105
Rdmodfacs> Valeur propre du vecteur en lecture: 148.1
Rdmodfacs> Numero du vecteur CERFACS en lecture: 106
Rdmodfacs> Valeur propre du vecteur en lecture: 148.5
Bfactors> 106 vectors, 14895 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 : 5.733000
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-Wn> Experimental B-factors are nearly constant !
Bfactors> = 0.005 +/- 0.01
Bfactors> = 0.000 +/- 0.00
Bfactors> Shiftng-fct= -0.005
Bfactors> Scaling-fct= 0.000
Bfactors> Predicted, Scaled and Experimental B-factors are saved.
Bfactors> Normal end.
check_modes
getting mode 7
running: ../../bin/get_modes.sh 240415152934446788 7 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 7
calculating perturbed structure for DQ=-100
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=0
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=100
240415152934446788.eigenfacs
240415152934446788.atom
making animated gifs
11 models are in 240415152934446788.7.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.7.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.7.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 8
running: ../../bin/get_modes.sh 240415152934446788 8 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 8
calculating perturbed structure for DQ=-100
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=0
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=100
240415152934446788.eigenfacs
240415152934446788.atom
making animated gifs
11 models are in 240415152934446788.8.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.8.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.8.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 9
running: ../../bin/get_modes.sh 240415152934446788 9 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 9
calculating perturbed structure for DQ=-100
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=0
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=100
240415152934446788.eigenfacs
240415152934446788.atom
making animated gifs
11 models are in 240415152934446788.9.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.9.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.9.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 10
running: ../../bin/get_modes.sh 240415152934446788 10 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 10
calculating perturbed structure for DQ=-100
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=0
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=100
240415152934446788.eigenfacs
240415152934446788.atom
making animated gifs
11 models are in 240415152934446788.10.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.10.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.10.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 11
running: ../../bin/get_modes.sh 240415152934446788 11 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 11
calculating perturbed structure for DQ=-100
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=0
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=100
240415152934446788.eigenfacs
240415152934446788.atom
making animated gifs
11 models are in 240415152934446788.11.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.11.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.11.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 12
running: ../../bin/get_modes.sh 240415152934446788 12 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 12
calculating perturbed structure for DQ=-100
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=0
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=100
240415152934446788.eigenfacs
240415152934446788.atom
making animated gifs
11 models are in 240415152934446788.12.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.12.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.12.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 13
running: ../../bin/get_modes.sh 240415152934446788 13 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 13
calculating perturbed structure for DQ=-100
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=0
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=100
240415152934446788.eigenfacs
240415152934446788.atom
making animated gifs
11 models are in 240415152934446788.13.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.13.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.13.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 14
running: ../../bin/get_modes.sh 240415152934446788 14 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 14
calculating perturbed structure for DQ=-100
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=0
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=100
240415152934446788.eigenfacs
240415152934446788.atom
making animated gifs
11 models are in 240415152934446788.14.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.14.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.14.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 15
running: ../../bin/get_modes.sh 240415152934446788 15 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 15
calculating perturbed structure for DQ=-100
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=0
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=100
240415152934446788.eigenfacs
240415152934446788.atom
making animated gifs
11 models are in 240415152934446788.15.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.15.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.15.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
getting mode 16
running: ../../bin/get_modes.sh 240415152934446788 16 -100 100 20 on 0
normal mode computation
generate a series of perturbations for mode 16
calculating perturbed structure for DQ=-100
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=-20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=0
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=20
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=40
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=60
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=80
240415152934446788.eigenfacs
240415152934446788.atom
calculating perturbed structure for DQ=100
240415152934446788.eigenfacs
240415152934446788.atom
making animated gifs
11 models are in 240415152934446788.16.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.16.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
11 models are in 240415152934446788.16.pdb, 1 models will be skipped
MODEL 1 will be plotted
MODEL 3 will be plotted
MODEL 5 will be plotted
MODEL 7 will be plotted
MODEL 9 will be plotted
MODEL 11 will be plotted
making thumbnail 100x100
making small animated gif 100x100
making animated gif 300x300
240415152934446788.10.pdb
240415152934446788.11.pdb
240415152934446788.12.pdb
240415152934446788.13.pdb
240415152934446788.14.pdb
240415152934446788.15.pdb
240415152934446788.16.pdb
240415152934446788.7.pdb
240415152934446788.8.pdb
240415152934446788.9.pdb
STDERR:
Note: The following floating-point exceptions are signalling: IEEE_DENORMAL
real 0m20.885s
user 0m20.755s
sys 0m0.096s
../../bin/check_modes: error while loading shared libraries: libgfortran.so.3: cannot open shared object file: No such file or directory
mv: cannot stat 'Chkmod.res': No such file or directory
cat: 240415152934446788.Chkmod.res: 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: 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: 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
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elNémo
is maintained by Yves-Henri Sanejouand.
It was developed
by Karsten Suhre.
Between 2003 and 2014, it was hosted by IGS (Marseille).
Last modification: April 25th, 2023.
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