CNRS Nantes University US2B US2B
home |  start a new run |  job status |  references&downloads |  examples |  help  

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


***  CELL INVASION 16-SEP-16 5TCX  ***

B-factor analysis for ID 260209051925111772

Overall B-factor prediction

Correlation= 0.382 for 208 C-alpha atoms.

B-factors for all residues

Residue-by-residue B-factor prediction for CA atoms

B-factors are computed based on the first 100 normal modes (B-PREDICT) and are scaled to match the overall B-factors in the submitted model (B-SCALED). A high correlation with the observations is an indicator that the normal modes capture well the overall flexibility features of the model. Comparison of the observed (B-OBS, blue) and the computed (B-SCALED, red) B-factors for all C-alpha atoms is presented below. Differences between B-factors from normal mode analysis and from X-ray crystallographic data may for example indicate regions where the protein flexibility is modified due to external factors such as tight crystall-packing.

  ATOM TYP  RES  RESID   B-PREDICT    B-SCALED      B-OBS
B-SCALEDB-OBS
     2 CA   SER      6      0.1810     96.2528     71.2200
     8 CA   THR      7      0.2476    116.3005     85.8700
    15 CA   LYS      8      0.1540     88.1326     78.2400
    24 CA   SER      9      0.1453     85.5190    105.1200
    30 CA   ILE     10      0.0942     70.1600    109.9200
    38 CA   LYS     11      0.0621     60.5042     78.0500
    47 CA   TYR     12      0.0828     66.7132     90.8100
    59 CA   LEU     13      0.0794     65.7003    101.2700
    67 CA   LEU     14      0.0395     53.7057     68.6400
    75 CA   PHE     15      0.0442     55.1142     81.7300
    86 CA   VAL     16      0.0679     62.2268     76.9300
    93 CA   PHE     17      0.0549     58.3412     74.2500
   104 CA   ASN     18      0.0344     52.1454     61.4600
   112 CA   PHE     19      0.0520     57.4563     51.7700
   123 CA   VAL     20      0.0711     63.2048     57.7300
   130 CA   PHE     21      0.0511     57.1958     50.0200
   141 CA   TRP     22      0.0471     55.9807     61.0000
   155 CA   LEU     23      0.0767     64.8914     61.4300
   163 CA   ALA     24      0.0753     64.4662     45.2400
   168 CA   GLY     25      0.0541     58.0835     61.8500
   172 CA   GLY     26      0.0710     63.1642     44.3600
   176 CA   VAL     27      0.0927     69.6860     43.5000
   183 CA   ILE     28      0.0589     59.5307     45.8400
   191 CA   LEU     29      0.0527     57.6560     40.7300
   199 CA   GLY     30      0.0752     64.4197     22.1900
   203 CA   VAL     31      0.0693     62.6580     44.2200
   210 CA   ALA     32      0.0453     55.4312     48.1200
   215 CA   LEU     33      0.0562     58.7044     44.5100
   223 CA   TRP     34      0.0565     58.7942     65.1800
   237 CA   LEU     35      0.0361     52.6667     54.3500
   245 CA   ARG     36      0.0443     55.1460     57.0700
   253 CA   HIS     37      0.0591     59.5960     90.4700
   263 CA   PRO     55      0.1194     77.7200     94.3300
   270 CA   ASN     56      0.0633     60.8418     56.5300
   278 CA   THR     57      0.0353     52.4195     71.0700
   285 CA   PHE     58      0.0232     48.7789     53.1400
   296 CA   TYR     59      0.0346     52.2204     56.4000
   308 CA   VAL     60      0.0432     54.8118     61.4400
   315 CA   GLY     61      0.0330     51.7426     57.0600
   319 CA   ILE     62      0.0315     51.3003     59.9100
   327 CA   TYR     63      0.0440     55.0419     48.1400
   339 CA   ILE     64      0.0474     56.0759     45.9000
   347 CA   LEU     65      0.0417     54.3475     37.5600
   355 CA   ILE     66      0.0455     55.4896     33.8300
   363 CA   ALA     67      0.0543     58.1394     38.4000
   368 CA   VAL     68      0.0516     57.3243     43.4000
   375 CA   GLY     69      0.0494     56.6841     51.4600
   379 CA   ALA     70      0.0490     56.5493     46.0800
   384 CA   VAL     71      0.0459     55.6304     48.3600
   391 CA   MET     72      0.0407     54.0522     55.5000
   399 CA   MET     73      0.0409     54.1053     69.5600
   407 CA   PHE     74      0.0377     53.1452     48.4100
   418 CA   VAL     75      0.0260     49.6381     51.3600
   425 CA   GLY     76      0.0279     50.2060     54.0300
   429 CA   PHE     77      0.0350     52.3433     52.5300
   440 CA   LEU     78      0.0254     49.4561     53.8900
   448 CA   GLY     79      0.0197     47.7264     70.1500
   452 CA   YCM     80      0.0322     51.4867     62.7900
   462 CA   TYR     81      0.0426     54.6251     59.1900
   474 CA   GLY     82      0.0318     51.3837     43.7100
   478 CA   ALA     83      0.0542     58.1095     63.1100
   483 CA   ILE     84      0.0777     65.1813     58.4900
   491 CA   GLN     85      0.0682     62.3399     66.8100
   500 CA   GLN     88      0.1015     72.3395     49.2500
   509 CA   YCM     89      0.1077     74.1975     48.1900
   519 CA   LEU     90      0.0483     56.3379     78.5600
   527 CA   LEU     91      0.0325     51.5858     43.5800
   535 CA   GLY     92      0.0519     57.4301     42.1000
   539 CA   THR     93      0.0486     56.4446     57.5900
   546 CA   PHE     94      0.0241     49.0542     47.0100
   557 CA   PHE     95      0.0282     50.2989     63.7000
   568 CA   THR     96      0.0485     56.4057     39.6700
   575 CA   CYS     97      0.0379     53.2016     48.1600
   581 CA   LEU     98      0.0310     51.1302     52.3600
   589 CA   VAL     99      0.0519     57.4099     50.0500
   596 CA   ILE    100      0.0717     63.3941     41.3400
   604 CA   LEU    101      0.0541     58.0845     46.4500
   612 CA   PHE    102      0.0540     58.0617     47.1600
   623 CA   ALA    103      0.0788     65.5021     45.6600
   628 CA   CYS    104      0.0939     70.0724     43.7900
   634 CA   GLU    105      0.0702     62.9180     40.4900
   643 CA   VAL    106      0.0947     70.3046     41.6800
   650 CA   ALA    107      0.1066     73.8916     53.3000
   655 CA   ALA    108      0.1060     73.6933     52.1300
   660 CA   GLY    109      0.0982     71.3464     46.7700
   664 CA   ILE    110      0.0858     67.6164     41.2000
   672 CA   TRP    111      0.0679     62.2229     43.2300
   686 CA   GLY    112      0.0560     58.6478     44.0300
   690 CA   PHE    113      0.0645     61.2276     60.2500
   701 CA   VAL    114      0.0718     63.4014     50.4900
   708 CA   ASN    115      0.0577     59.1617     55.6800
   716 CA   LYS    116      0.0430     54.7404     43.6500
   725 CA   ASP    117      0.0442     55.1006     64.2100
   733 CA   GLN    118      0.0522     57.5138     60.1800
   742 CA   ILE    119      0.0402     53.8999     51.7000
   750 CA   ALA    120      0.0289     50.5178     38.7200
   755 CA   LYS    121      0.0339     51.9994     45.3000
   764 CA   ASP    122      0.0339     52.0228     47.8600
   772 CA   VAL    123      0.0233     48.8221     45.3200
   779 CA   LYS    124      0.0173     47.0129     37.2800
   788 CA   GLN    125      0.0217     48.3302     63.5900
   797 CA   PHE    126      0.0167     46.8206     53.5400
   808 CA   TYR    127      0.0108     45.0634     49.2200
   820 CA   ASP    128      0.0144     46.1314     57.5700
   828 CA   GLN    129      0.0174     47.0587     51.5200
   837 CA   ALA    130      0.0141     46.0443     57.7600
   842 CA   LEU    131      0.0130     45.7089     43.6100
   850 CA   GLN    132      0.0330     51.7361     45.6200
   859 CA   GLN    133      0.0265     49.7822     39.6400
   868 CA   ALA    134      0.0229     48.6907     42.8200
   873 CA   VAL    135      0.0332     51.7918     54.0300
   880 CA   VAL    136      0.0689     62.5258     50.3400
   887 CA   ASP    137      0.0591     59.5864     68.6100
   895 CA   ASP    138      0.0667     61.8745     50.3500
   903 CA   ASP    139      0.0804     66.0016     70.2700
   911 CA   ALA    140      0.0413     54.2287     52.2400
   916 CA   ASN    141      0.0465     55.8002     55.1000
   924 CA   ASN    142      0.0295     50.6768     55.8300
   932 CA   ALA    143      0.0207     48.0397     42.8300
   937 CA   LYS    144      0.0277     50.1345     54.8700
   946 CA   ALA    145      0.0378     53.1774     40.8900
   951 CA   VAL    146      0.0263     49.7169     39.3600
   958 CA   VAL    147      0.0192     47.5828     44.9300
   965 CA   LYS    148      0.0374     53.0603     46.8200
   974 CA   THR    149      0.0515     57.3053     54.7700
   981 CA   PHE    150      0.0307     51.0472     52.6400
   992 CA   HIS    151      0.0347     52.2543     59.8300
  1002 CA   GLU    152      0.0712     63.2423     65.7800
  1011 CA   THR    153      0.0807     66.0882     80.7200
  1018 CA   LEU    154      0.0520     57.4482     70.7700
  1026 CA   ASP    155      0.0587     59.4839     80.3300
  1034 CA   CYS    156      0.0333     51.8194     70.3300
  1040 CA   CYS    157      0.0257     49.5429     66.5000
  1046 CA   GLY    158      0.0205     47.9839     64.3800
  1050 CA   SER    159      0.0195     47.6832     41.3100
  1056 CA   SER    160      0.0435     54.9111     39.5300
  1062 CA   THR    161      0.0558     58.6077     55.8700
  1069 CA   LEU    162      0.0845     67.2355     70.2100
  1077 CA   THR    163      0.0474     56.0805     59.7800
  1084 CA   ALA    164      0.0428     54.6784     52.8200
  1089 CA   LEU    165      0.0694     62.6889     74.5800
  1097 CA   THR    166      0.0684     62.3773     64.7000
  1104 CA   THR    167      0.0432     54.8113     66.5300
  1111 CA   SER    168      0.0646     61.2550     57.6100
  1117 CA   VAL    169      0.0996     71.7703     58.7500
  1124 CA   LEU    170      0.0886     68.4686     50.6700
  1132 CA   LYS    171      0.0566     58.8434     47.8100
  1141 CA   ASN    172      0.0691     62.5875     45.5100
  1149 CA   ASN    173      0.0745     64.2293     69.3400
  1157 CA   LEU    174      0.0397     53.7482     46.2800
  1165 CA   CYS    175      0.0464     55.7582     56.1300
  1171 CA   PRO    176      0.0688     62.5128     67.8700
  1178 CA   SER    177      0.1283     80.3953     61.1400
  1184 CA   GLY    178      0.2091    104.7026     79.0900
  1188 CA   SER    179      0.1139     76.0650     79.2200
  1194 CA   ASN    180      0.1295     80.7743     92.5200
  1202 CA   ILE    181      0.1068     73.9353     97.0100
  1210 CA   ILE    182      0.1482     86.3869    113.8100
  1218 CA   SER    183      0.1214     78.3218    100.8700
  1224 CA   ASN    184      0.0714     63.2896     93.4200
  1232 CA   LEU    185      0.0914     69.3036    112.3000
  1240 CA   PHE    186      0.1145     76.2715    116.6100
  1251 CA   LYS    187      0.0841     67.1134    116.1900
  1260 CA   GLU    188      0.0512     57.2188     87.7400
  1269 CA   ASP    189      0.0300     50.8386     78.3900
  1277 CA   CYS    190      0.0201     47.8703     67.6500
  1283 CA   HIS    191      0.0204     47.9449     59.1200
  1293 CA   GLN    192      0.0318     51.3695     70.3300
  1302 CA   LYS    193      0.0340     52.0379     70.5300
  1311 CA   ILE    194      0.0259     49.6113     64.0200
  1319 CA   ASP    195      0.0309     51.1035     65.6100
  1327 CA   ASP    196      0.0515     57.2913     77.1500
  1335 CA   LEU    197      0.0445     55.2001     65.8900
  1343 CA   PHE    198      0.0364     52.7697     67.7900
  1354 CA   SER    199      0.0521     57.4963     53.0100
  1360 CA   GLY    200      0.0964     70.8239     50.4300
  1364 CA   LYS    201      0.0720     63.4596     60.4300
  1373 CA   LEU    202      0.0621     60.4941     57.6800
  1381 CA   TYR    203      0.0961     70.7168     85.3600
  1393 CA   LEU    204      0.0969     70.9481     72.0000
  1401 CA   ILE    205      0.0851     67.4101     53.3200
  1409 CA   GLY    206      0.0990     71.5977     67.0500
  1413 CA   ILE    207      0.1185     77.4643     67.7800
  1421 CA   ALA    208      0.1086     74.4892     59.4700
  1426 CA   ALA    209      0.0950     70.3997     61.2000
  1431 CA   ILE    210      0.0881     68.3142     55.2900
  1439 CA   VAL    211      0.0939     70.0449     58.5700
  1446 CA   VAL    212      0.0625     60.6024     67.5500
  1453 CA   ALA    213      0.0556     58.5374     49.0300
  1458 CA   VAL    214      0.0686     62.4488     69.7900
  1465 CA   ILE    215      0.0574     59.0740     57.0300
  1473 CA   MET    216      0.0381     53.2581     59.1700
  1481 CA   ILE    217      0.0508     57.1064     72.3000
  1489 CA   PHE    218      0.0526     57.6344     78.5100
  1500 CA   GLU    219      0.0303     50.9288     82.2700
  1509 CA   MET    220      0.0338     51.9723     75.6500
  1517 CA   ILE    221      0.0547     58.2661     83.8300
  1525 CA   LEU    222      0.0424     54.5811     83.3700
  1533 CA   SER    223      0.0304     50.9497     58.3300
  1539 CA   MET    224      0.0564     58.7676     69.6600
  1547 CA   VAL    225      0.0659     61.6466     61.7100
  1554 CA   LEU    226      0.0503     56.9555     54.9900
  1562 CA   SER    227      0.0687     62.4719     54.8900
  1568 CA   SER    228      0.1292     80.6717     87.8300
  1574 CA   GLY    229      0.1206     78.0951     79.2200
  1578 CA   ILE    230      0.1233     78.9009     88.9100
  1583 CA   ARG    231      0.2264    109.9312    109.3800
  1594 CA   ASN    232      0.7002    252.4625     90.4000

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.