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 2402181556423325144

Overall B-factor prediction

Correlation= 0.583 for 197 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     96      0.0429     25.4395     29.6200
     8 CA   VAL     97      0.0106     18.3080     22.3300
    15 CA   PRO     98      0.0076     17.6405     21.0800
    22 CA   SER     99      0.0164     19.5820     21.9300
    28 CA   GLN    100      0.0063     17.3566     24.1200
    37 CA   LYS    101      0.0187     20.0901     20.5300
    46 CA   THR    102      0.0091     17.9710     17.7400
    53 CA   TYR    103      0.0085     17.8402     18.8300
    65 CA   GLN    104      0.0080     17.7267     17.5300
    74 CA   GLY    105      0.0098     18.1394     17.6500
    78 CA   SER    106      0.0165     19.6183     20.0200
    84 CA   TYR    107      0.0075     17.6161     17.9100
    96 CA   GLY    108      0.0080     17.7343     16.5500
   100 CA   PHE    109      0.0040     16.8439     15.4000
   111 CA   ARG    110      0.0052     17.1199     16.2200
   122 CA   LEU    111      0.0031     16.6449     12.4900
   130 CA   GLY    112      0.0041     16.8749     12.5300
   134 CA   PHE    113      0.0039     16.8266     12.5400
   145 CA   LEU    114      0.0057     17.2208     13.3600
   153 CA   HIS    115      0.0186     20.0741     13.4800
   163 CA   SER    116      0.0099     18.1493     12.9700
   169 CA   GLY    117      0.0105     18.2882     12.6000
   173 CA   THR    118      0.0085     17.8332     13.6700
   180 CA   ALA    119      0.0168     19.6845     15.4400
   185 CA   LYS    120      0.0196     20.3042     23.9700
   194 CA   SER    121      0.0332     23.3014     26.9600
   200 CA   VAL    122      0.0094     18.0421     21.8800
   207 CA   THR    123      0.0053     17.1303     23.0600
   214 CA   CYS    124      0.0030     16.6252     19.1900
   220 CA   THR    125      0.0031     16.6590     13.3300
   227 CA   TYR    126      0.0028     16.5907     10.9000
   239 CA   SER    127      0.0042     16.9020     12.1400
   245 CA   PRO    128      0.0100     18.1814     12.2700
   252 CA   ALA    129      0.0327     23.1788     13.7100
   257 CA   LEU    130      0.0076     17.6432     13.7300
   265 CA   ASN    131      0.0042     16.8882     12.8100
   273 CA   LYS    132      0.0030     16.6311     12.3700
   282 CA   MET    133      0.0019     16.3894     12.6900
   283 CA   MET    133      0.0019     16.3897     13.0400
   295 CA   PHE    134      0.0022     16.4466     11.2100
   306 CA   CYS    135      0.0020     16.4139     17.2600
   312 CA   GLN    136      0.0030     16.6266     19.0200
   321 CA   LEU    137      0.0029     16.6160     19.7900
   329 CA   ALA    138      0.0028     16.5870     19.5200
   334 CA   LYS    139      0.0040     16.8460     19.0500
   343 CA   THR    140      0.0037     16.7758     16.7400
   350 CA   CYS    141      0.0024     16.5050     14.9000
   351 CA   CYS    141      0.0024     16.5045     15.5300
   359 CA   PRO    142      0.0032     16.6613     14.4100
   366 CA   VAL    143      0.0025     16.5184     13.8100
   373 CA   GLN    144      0.0037     16.7831     13.5800
   382 CA   LEU    145      0.0027     16.5666     13.9000
   390 CA   TRP    146      0.0045     16.9607     15.4500
   404 CA   VAL    147      0.0055     17.1768     18.7100
   411 CA   ASP    148      0.0166     19.6377     22.4300
   419 CA   SER    149      0.0160     19.4959     24.5200
   425 CA   THR    150      0.0105     18.2769     25.4200
   432 CA   PRO    151      0.0071     17.5410     24.4600
   439 CA   PRO    152      0.0123     18.6758     26.6500
   446 CA   PRO    153      0.0278     22.1149     28.3000
   453 CA   GLY    154      0.0114     18.4902     19.8500
   457 CA   THR    155      0.0054     17.1474     15.7300
   464 CA   ARG    156      0.0037     16.7856     13.9800
   475 CA   PHE    157      0.0022     16.4425     11.7400
   486 CA   ARG    158      0.0023     16.4829     10.9100
   497 CA   ALA    159      0.0018     16.3648      9.7600
   502 CA   MET    160      0.0018     16.3640     12.8300
   510 CA   ALA    161      0.0018     16.3528     13.0500
   515 CA   ILE    162      0.0027     16.5672     13.2800
   523 CA   TYR    163      0.0037     16.7757     15.7400
   535 CA   LYS    164      0.0050     17.0705     19.8700
   544 CA   GLN    165      0.0096     18.0939     23.5700
   553 CA   SER    166      0.0261     21.7361     27.0800
   559 CA   GLN    167      0.0319     23.0185     28.8600
   568 CA   HIS    168      0.0081     17.7599     23.6600
   578 CA   MET    169      0.0064     17.3762     24.0600
   586 CA   THR    170      0.0100     18.1826     21.4600
   593 CA   GLU    171      0.0063     17.3487     21.1700
   602 CA   VAL    172      0.0039     16.8242     17.7900
   609 CA   VAL    173      0.0022     16.4614     15.0700
   616 CA   ARG    174      0.0027     16.5586     19.4800
   627 CA   ARG    175      0.0032     16.6785     18.8100
   638 CA   CYS    176      0.0053     17.1455     20.3600
   644 CA   PRO    177      0.0117     18.5555     22.4800
   651 CA   HIS    178      0.0133     18.9002     18.9800
   661 CA   HIS    179      0.0055     17.1726     18.9900
   671 CA   GLU    180      0.0064     17.3803     25.1100
   680 CA   ARG    181      0.0224     20.9074     34.9100
   691 CA   CYS    182      0.0156     19.4168     35.2200
   697 CA   SER    183      0.0668     30.7144     36.4100
   703 CA   ASP    184      0.0108     18.3486     29.4900
   711 CA   SER    185      0.0239     21.2438     28.6300
   717 CA   ASP    186      0.0137     18.9970     25.2500
   725 CA   GLY    187      0.0865     35.0632     22.6500
   729 CA   LEU    188      0.0108     18.3520     19.5400
   737 CA   ALA    189      0.0041     16.8706     16.6600
   742 CA   PRO    190      0.0042     16.8820     16.3700
   749 CA   PRO    191      0.0048     17.0250     18.3600
   756 CA   GLN    192      0.0036     16.7646     17.3000
   765 CA   HIS    193      0.0022     16.4612     11.5100
   775 CA   LEU    194      0.0015     16.3059     12.1100
   783 CA   ILE    195      0.0016     16.3212     12.9600
   791 CA   ARG    196      0.0024     16.4854     13.0900
   802 CA   VAL    197      0.0028     16.5887     14.3800
   809 CA   GLU    198      0.0043     16.9179     19.6600
   818 CA   GLY    199      0.0250     21.4803     19.6500
   822 CA   ASN    200      0.0075     17.6173     17.8700
   830 CA   LEU    201      0.0209     20.5810     21.9400
   838 CA   ARG    202      0.0122     18.6705     17.5300
   849 CA   VAL    203      0.0048     17.0205     11.3800
   856 CA   GLU    204      0.0043     16.9189     11.1200
   865 CA   TYR    205      0.0033     16.7019     11.8300
   877 CA   LEU    206      0.0055     17.1702     11.4500
   885 CA   ASP    207      0.0067     17.4400     13.5800
   893 CA   ASP    208      0.0148     19.2273     17.3600
   901 CA   ARG    209      0.0569     28.5280     25.7200
   912 CA   ASN    210      0.0538     27.8432     25.3400
   920 CA   THR    211      0.0180     19.9491     22.1000
   927 CA   PHE    212      0.0099     18.1531     19.4900
   938 CA   ARG    213      0.0045     16.9558     17.3700
   949 CA   HIS    214      0.0027     16.5641     12.5700
   959 CA   SER    215      0.0026     16.5352     10.2600
   965 CA   VAL    216      0.0021     16.4390     10.6500
   972 CA   VAL    217      0.0029     16.5963     13.0800
   979 CA   VAL    218      0.0029     16.6123     13.8300
   986 CA   PRO    219      0.0046     16.9756     16.2700
   993 CA   TYR    220      0.0041     16.8762     17.7700
  1005 CA   GLU    221      0.0069     17.4943     25.8300
  1014 CA   PRO    222      0.0098     18.1269     27.4800
  1021 CA   PRO    223      0.0182     19.9958     29.5400
  1028 CA   GLU    224      0.0775     33.0837     36.5500
  1037 CA   VAL    225      0.1407     47.0459     38.4900
  1044 CA   GLY    226      0.3407     91.2231     38.3300
  1048 CA   SER    227      0.0654     30.4030     37.4800
  1054 CA   ASP    228      0.0231     21.0772     33.2800
  1062 CA   CYS    229      0.0075     17.6244     23.4800
  1068 CA   THR    230      0.0049     17.0529     19.6500
  1075 CA   THR    231      0.0041     16.8726     18.6700
  1082 CA   ILE    232      0.0028     16.5846     18.9400
  1090 CA   HIS    233      0.0033     16.6991     14.2100
  1100 CA   TYR    234      0.0020     16.4119     11.1900
  1112 CA   ASN    235      0.0024     16.4943     13.6200
  1120 CA   TYR    236      0.0018     16.3633     11.8900
  1132 CA   MET    237      0.0027     16.5508     14.3200
  1140 CA   CYS    238      0.0025     16.5224     16.8700
  1146 CA   ASN    239      0.0029     16.6150     17.3200
  1154 CA   SER    240      0.0030     16.6275     17.0300
  1160 CA   SER    241      0.0064     17.3814     21.7500
  1166 CA   CYS    242      0.0056     17.1973     22.4400
  1172 CA   MET    243      0.0158     19.4523     23.2600
  1180 CA   GLY    244      0.0098     18.1335     23.6400
  1184 CA   GLY    245      0.0045     16.9632     24.7200
  1188 CA   MET    246      0.0034     16.7051     22.1000
  1196 CA   ASN    247      0.0075     17.6309     27.1600
  1204 CA   ARG    248      0.0081     17.7534     27.2900
  1215 CA   ARG    249      0.0054     17.1541     22.9000
  1226 CA   PRO    250      0.0040     16.8385     19.5400
  1233 CA   ILE    251      0.0022     16.4521     15.4300
  1241 CA   LEU    252      0.0023     16.4808     15.4600
  1249 CA   THR    253      0.0017     16.3494     12.8100
  1256 CA   ILE    254      0.0022     16.4551     11.7000
  1264 CA   ILE    255      0.0020     16.4030     10.9200
  1272 CA   THR    256      0.0027     16.5598     13.8000
  1279 CA   LEU    257      0.0030     16.6170     14.1700
  1287 CA   GLU    258      0.0046     16.9711     16.4100
  1296 CA   ASP    259      0.0082     17.7734     17.8300
  1304 CA   SER    260      0.0212     20.6504     20.5200
  1310 CA   SER    261      0.0521     27.4816     20.8600
  1316 CA   GLY    262      0.0139     19.0421     19.8700
  1320 CA   ASN    263      0.0260     21.6993     20.1100
  1328 CA   LEU    264      0.0091     17.9760     18.3500
  1336 CA   LEU    265      0.0060     17.2992     13.6300
  1344 CA   GLY    266      0.0044     16.9345     12.2000
  1348 CA   ARG    267      0.0040     16.8592     12.5900
  1359 CA   ASN    268      0.0034     16.7068     14.6800
  1367 CA   SER    269      0.0027     16.5616     12.6300
  1373 CA   PHE    270      0.0022     16.4516      9.9700
  1384 CA   GLU    271      0.0026     16.5322     12.9000
  1393 CA   VAL    272      0.0017     16.3467     14.4800
  1400 CA   ARG    273      0.0022     16.4467     13.6000
  1411 CA   VAL    274      0.0021     16.4231     13.8600
  1418 CA   CYS    275      0.0037     16.7855     17.7700
  1424 CA   ALA    276      0.0069     17.4834     19.6700
  1429 CA   CYS    277      0.0071     17.5356     20.3700
  1430 CA   CYS    277      0.0071     17.5323     19.9700
  1438 CA   PRO    278      0.0034     16.7260     15.1600
  1445 CA   GLY    279      0.0051     17.0845     16.2800
  1449 CA   ARG    280      0.0087     17.8768     20.3800
  1460 CA   ASP    281      0.0057     17.2325     17.0600
  1468 CA   ARG    282      0.0045     16.9503     12.5100
  1479 CA   ARG    283      0.0106     18.3031     16.6100
  1490 CA   THR    284      0.0169     19.6968     19.9200
  1497 CA   GLU    285      0.0109     18.3829     24.5800
  1506 CA   GLU    286      0.0163     19.5734     25.8500
  1515 CA   GLU    287      0.0608     29.3865     37.5500
  1524 CA   ASN    288      0.0813     33.9279     43.3500
  1532 CA   LEU    289      0.1032     38.7535     38.1900

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.