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.


***    ***

B-factor analysis for ID 2403301542001583632

Overall B-factor prediction

Correlation= 0.023 for 202 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   LEU     89      0.0377      1.0055      0.0000
    10 CA   GLU     90      0.0336      0.6372      3.0000
    19 CA   LEU     91      0.0221     -0.4082      0.0000
    27 CA   GLN     92      0.0255     -0.1037      0.0000
    36 CA   GLY     93      0.0303      0.3338      0.0000
    40 CA   LEU     94      0.0410      1.2998      0.0000
    48 CA   GLN     95      0.0743      4.3157      9.0000
    57 CA   LYS     96      0.1006      6.6995      3.0000
    66 CA   ASN     97      0.0570      2.7509     52.0000
    74 CA   MET     98      0.0476      1.8998     14.0000
    82 CA   THR     99      0.0256     -0.0919      0.0000
    89 CA   ARG    100      0.0259     -0.0623     11.0000
   100 CA   PHE    101      0.0209     -0.5171      1.0000
   111 CA   ARG    102      0.0299      0.2966     11.0000
   122 CA   ILE    103      0.0326      0.5420      0.0000
   130 CA   ASP    104      0.0370      0.9409      0.0000
   138 CA   GLU    105      0.0775      4.6077      6.0000
   147 CA   LEU    106      0.1846     14.3037      4.0000
   155 CA   GLU    107      0.1758     13.5134      3.0000
   164 CA   PRO    108      0.0867      5.4384      0.0000
   171 CA   ARG    109      0.1036      6.9683      3.0000
   182 CA   ARG    110      0.0855      5.3295      3.0000
   193 CA   PRO    111      0.0777      4.6264     12.0000
   200 CA   ARG    112      0.0509      2.2023      0.0000
   211 CA   TYR    113      0.0606      3.0777      5.0000
   223 CA   ARG    114      0.0515      2.2544     17.0000
   234 CA   VAL    115      0.0647      3.4482      0.0000
   241 CA   PRO    116      0.1167      8.1615      6.0000
   248 CA   ASP    117      0.1743     13.3747      3.0000
   256 CA   VAL    118      0.0928      5.9921      2.0000
   263 CA   LEU    119      0.1016      6.7861      5.0000
   271 CA   VAL    120      0.2453     19.8067      4.0000
   278 CA   ALA    121      0.2046     16.1153      3.0000
   283 CA   ASP    122      0.1207      8.5181      7.0000
   291 CA   PRO    123      0.0788      4.7254     11.0000
   298 CA   PRO    124      0.0883      5.5838      4.0000
   305 CA   ILE    125      0.0591      2.9412      0.0000
   313 CA   ALA    126      0.0530      2.3927      6.0000
   318 CA   ARG    127      0.0593      2.9557      9.0000
   329 CA   LEU    128      0.0405      1.2612      0.0000
   337 CA   SER    129      0.0593      2.9558      5.0000
   343 CA   VAL    130      0.0651      3.4884      0.0000
   350 CA   SER    131      0.0644      3.4220      3.0000
   356 CA   GLY    132      0.0808      4.9105      2.0000
   360 CA   ARG    133      0.1221      8.6499     40.0000
   371 CA   ASP    134      0.1506     11.2300      4.0000
   379 CA   GLU    135      0.2460     19.8688      3.0000
   388 CA   ASN    136      0.1275      9.1374      7.0000
   396 CA   SER    137      0.0650      3.4748     23.0000
   402 CA   VAL    138      0.0504      2.1517      0.0000
   409 CA   GLU    139      0.0324      0.5241      0.0000
   418 CA   LEU    140      0.0282      0.1408      0.0000
   426 CA   THR    141      0.0290      0.2146      0.0000
   433 CA   MET    142      0.0268      0.0147      0.0000
   441 CA   ALA    143      0.0580      2.8437      6.0000
   446 CA   GLU    144      0.0937      6.0762      6.0000
   455 CA   GLY    145      0.0615      3.1623      9.0000
   459 CA   PRO    146      0.0488      2.0133      6.0000
   466 CA   TYR    147      0.0247     -0.1706      0.0000
   478 CA   LYS    148      0.0215     -0.4620      0.0000
   487 CA   ILE    149      0.0152     -1.0377      0.0000
   495 CA   ILE    150      0.0204     -0.5593      0.0000
   503 CA   LEU    151      0.0257     -0.0835      0.0000
   511 CA   THR    152      0.0380      1.0273      0.0000
   518 CA   ALA    153      0.0857      5.3499      5.0000
   523 CA   ARG    154      0.1272      9.1108      6.0000
   534 CA   PRO    155      0.0705      3.9710      4.0000
   541 CA   PHE    156      0.0404      1.2451      0.0000
   552 CA   ARG    157      0.0252     -0.1264      0.0000
   563 CA   LEU    158      0.0169     -0.8804      0.0000
   571 CA   ASP    159      0.0160     -0.9633      0.0000
   579 CA   LEU    160      0.0135     -1.1881      0.0000
   587 CA   LEU    161      0.0218     -0.4396      0.0000
   595 CA   GLU    162      0.0304      0.3474      0.0000
   604 CA   ASP    163      0.0604      3.0598     21.0000
   612 CA   ARG    164      0.0845      5.2450      6.0000
   623 CA   SER    165      0.0476      1.8971      3.0000
   629 CA   LEU    166      0.0297      0.2761      0.0000
   637 CA   LEU    167      0.0208     -0.5224     55.0000
   645 CA   LEU    168      0.0185     -0.7356      0.0000
   653 CA   SER    169      0.0184     -0.7437      0.0000
   659 CA   VAL    170      0.0188     -0.7102      0.0000
   666 CA   ASN    171      0.0251     -0.1400      0.0000
   674 CA   ALA    172      0.0297      0.2767      0.0000
   679 CA   ARG    173      0.0507      2.1821      2.0000
   690 CA   GLY    174      0.0553      2.6022      5.0000
   694 CA   LEU    175      0.0485      1.9862      4.0000
   702 CA   LEU    176      0.0368      0.9258      0.0000
   710 CA   GLU    177      0.0487      1.9987      5.0000
   719 CA   PHE    178      0.0373      0.9711      0.0000
   730 CA   GLU    179      0.0467      1.8208     11.0000
   739 CA   HIS    180      0.0495      2.0717      0.0000
   749 CA   GLN    181      0.0520      2.2971      0.0000
   758 CA   ARG    182      0.0785      4.6995      9.0000
   769 CA   ALA    183      0.1380     10.0833      6.0000
   774 CA   PRO    184      0.1613     12.1991     48.0000
   781 CA   ARG    185      0.1816     14.0394      3.0000
   792 CA   VAL    186      0.1781     13.7179      2.0000
   799 CA   ASP    221      0.4700     40.1491      5.0000
   807 CA   GLU    222      0.3665     30.7755      6.0000
   816 CA   PRO    223      0.3814     32.1295      6.0000
   823 CA   GLY    224      0.2618     21.2952      4.0000
   827 CA   ALA    225      0.1394     10.2114      8.0000
   832 CA   TRP    226      0.1219      8.6293      0.0000
   846 CA   GLU    227      0.1818     14.0564      0.0000
   855 CA   GLU    228      0.2447     19.7468      5.0000
   864 CA   THR    229      0.3761     31.6449     48.0000
   871 CA   PHE    230      0.5026     43.1017      4.0000
   882 CA   LYS    231      0.7621     66.6027      3.0000
   891 CA   THR    232      0.8282     72.5878      4.0000
   898 CA   HIS    233      0.6707     58.3246      3.0000
   908 CA   SER    234      0.4527     38.5840      0.0000
   914 CA   ASP    235      0.2922     24.0509      3.0000
   922 CA   SER    236      0.2221     17.7053      0.0000
   928 CA   LYS    237      0.1321      9.5499      6.0000
   937 CA   PRO    238      0.1323      9.5741      7.0000
   944 CA   TYR    239      0.0708      3.9976     60.0000
   956 CA   GLY    240      0.0665      3.6135      0.0000
   960 CA   PRO    241      0.0538      2.4582     10.0000
   967 CA   MET    242      0.0375      0.9852      0.0000
   975 CA   SER    243      0.0500      2.1170      6.0000
   981 CA   VAL    244      0.0384      1.0666      0.0000
   988 CA   GLY    245      0.0380      1.0269      6.0000
   992 CA   LEU    246      0.0284      0.1591      0.0000
  1000 CA   ASP    247      0.0303      0.3348     11.0000
  1008 CA   PHE    248      0.0240     -0.2331      1.0000
  1019 CA   SER    249      0.0265     -0.0139      5.0000
  1025 CA   LEU    250      0.0229     -0.3356      0.0000
  1033 CA   PRO    251      0.0350      0.7628      3.0000
  1040 CA   GLY    252      0.0488      2.0115      3.0000
  1044 CA   MET    253      0.0438      1.5574      0.0000
  1052 CA   GLU    254      0.0646      3.4429      5.0000
  1061 CA   HIS    255      0.0457      1.7246      0.0000
  1071 CA   VAL    256      0.0339      0.6634      0.0000
  1078 CA   TYR    257      0.0315      0.4395      0.0000
  1090 CA   GLY    258      0.0337      0.6450     10.0000
  1094 CA   ILE    259      0.0250     -0.1479      0.0000
  1102 CA   PRO    260      0.0334      0.6139     14.0000
  1109 CA   GLU    261      0.0462      1.7781      6.0000
  1118 CA   HIS    262      0.0410      1.3036      0.0000
  1128 CA   ALA    263      0.0636      3.3460      5.0000
  1133 CA   ASP    264      0.0614      3.1501     22.0000
  1141 CA   ASN    265      0.0757      4.4414      4.0000
  1149 CA   LEU    266      0.0726      4.1683      8.0000
  1157 CA   ARG    267      0.0510      2.2123      0.0000
  1168 CA   LEU    268      0.0428      1.4687      4.0000
  1176 CA   LYS    269      0.0671      3.6670      8.0000
  1185 CA   VAL    270      0.0979      6.4579     10.0000
  1192 CA   THR    271      0.0910      5.8306     14.0000
  1199 CA   GLU    272      0.1521     11.3643      6.0000
  1208 CA   GLY    273      0.3177     26.3585      2.0000
  1212 CA   GLY    274      0.2424     19.5448      4.0000
  1216 CA   GLU    275      0.1115      7.6902      5.0000
  1225 CA   PRO    276      0.0655      3.5173      0.0000
  1232 CA   TYR    277      0.0403      1.2410      0.0000
  1244 CA   ARG    278      0.0445      1.6240      0.0000
  1255 CA   LEU    279      0.0378      1.0146      1.0000
  1263 CA   TYR    280      0.0595      2.9771     28.0000
  1275 CA   ASN    281      0.0836      5.1581      0.0000
  1283 CA   LEU    282      0.1066      7.2475      4.0000
  1291 CA   ASP    283      0.1778     13.6874      0.0000
  1299 CA   VAL    284      0.1443     10.6545      5.0000
  1306 CA   PHE    285      0.2799     22.9364      7.0000
  1317 CA   GLN    286      0.2828     23.1984      4.0000
  1326 CA   TYR    287      0.1427     10.5122     15.0000
  1338 CA   GLU    288      0.1445     10.6781      4.0000
  1347 CA   LEU    289      0.1104      7.5902      0.0000
  1355 CA   TYR    290      0.0941      6.1140      0.0000
  1367 CA   ASN    291      0.0751      4.3891      7.0000
  1375 CA   PRO    292      0.0557      2.6383     60.0000
  1382 CA   MET    293      0.0633      3.3256     27.0000
  1390 CA   ALA    294      0.0532      2.4085      1.0000
  1395 CA   LEU    295      0.0633      3.3216      0.0000
  1403 CA   TYR    296      0.0875      5.5116      9.0000
  1415 CA   GLY    297      0.0610      3.1183      3.0000
  1419 CA   SER    298      0.0399      1.2079     42.0000
  1425 CA   VAL    299      0.0308      0.3762      6.0000
  1432 CA   PRO    300      0.0243     -0.2048     17.0000
  1439 CA   VAL    301      0.0246     -0.1829      0.0000
  1446 CA   LEU    302      0.0223     -0.3924      0.0000
  1454 CA   LEU    303      0.0257     -0.0846      0.0000
  1462 CA   ALA    304      0.0270      0.0394      0.0000
  1467 CA   HIS    305      0.0424      1.4319      0.0000
  1477 CA   ASN    306      0.0570      2.7511     20.0000
  1485 CA   PRO    307      0.1379     10.0797      3.0000
  1492 CA   HIS    308      0.1413     10.3883      2.0000
  1502 CA   ARG    309      0.0430      1.4858      4.0000
  1513 CA   ASP    310      0.0412      1.3206      0.0000
  1521 CA   LEU    311      0.0243     -0.2137      5.0000
  1529 CA   GLY    312      0.0261     -0.0505      5.0000
  1533 CA   ILE    313      0.0246     -0.1853     13.0000
  1541 CA   PHE    314      0.0250     -0.1494      0.0000
  1552 CA   TRP    315      0.0260     -0.0576     18.0000
  1566 CA   LEU    316      0.0309      0.3889      0.0000
  1574 CA   ASN    317      0.0373      0.9716     21.0000
  1582 CA   ALA    318      0.0524      2.3316     13.0000
  1587 CA   ALA    319      0.0824      5.0485      3.0000
  1592 CA   GLU    320      0.0658      3.5466      0.0000
  1601 CA   THR    321      0.0502      2.1319     16.0000
  1608 CA   TRP    322      0.0519      2.2929      0.0000
  1622 CA   VAL    323      0.0469      1.8371     11.0000
  1629 CA   ASP    324      0.0685      3.7969      0.0000

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).
Last modification: April 25th, 2023.