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elNémo has been hacked on november 27th.
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**Still some additional cleaning from time to time**
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***  LYASE (OXO-ACID) 04-MAR-94 1CRM  ***

B-factor analysis for ID 260221185340572269

Overall B-factor prediction

Correlation= 0.484 for 256 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   TRP      5      0.0254     14.7003     19.1800
    16 CA   GLY      6      0.0223     13.9622     18.6700
    20 CA   TYR      7      0.0177     12.8546     19.1400
    32 CA   ASP      8      0.0380     17.7443     26.4900
    40 CA   ASP      9      0.0953     31.6112     29.8600
    48 CA   LYS     10      0.0852     29.1517     30.7000
    57 CA   ASN     11      0.0381     17.7649     28.8200
    65 CA   GLY     12      0.0230     14.1175     24.8200
    69 CA   PRO     13      0.0169     12.6410     21.3400
    76 CA   GLU     14      0.0367     17.4317     24.5600
    85 CA   GLN     15      0.0334     16.6461     24.8900
    94 CA   TRP     16      0.0197     13.3276     23.4500
   108 CA   SER     17      0.0355     17.1534     26.4700
   114 CA   LYS     18      0.0631     23.8097     27.4900
   123 CA   LEU     19      0.0457     19.6128     27.5400
   131 CA   TYR     20      0.0304     15.9208     26.0800
   143 CA   PRO     21      0.0383     17.8133     24.5800
   150 CA   ILE     22      0.0214     13.7463     22.4600
   158 CA   ALA     23      0.0156     12.3328     20.2600
   163 CA   ASN     24      0.0283     15.4076     20.0800
   171 CA   GLY     25      0.0247     14.5417     17.8200
   175 CA   ASN     26      0.0251     14.6235     15.9500
   183 CA   ASN     27      0.0114     11.3169     12.8200
   191 CA   GLN     28      0.0085     10.6239      9.5600
   200 CA   SER     29      0.0052      9.8187      8.6200
   206 CA   PRO     30      0.0053      9.8418      7.7000
   213 CA   VAL     31      0.0086     10.6444      7.6900
   220 CA   ASP     32      0.0103     11.0448      9.6800
   228 CA   ILE     33      0.0120     11.4754     12.5400
   236 CA   LYS     34      0.0219     13.8686     16.5900
   245 CA   THR     35      0.0313     16.1276     20.2200
   252 CA   SER     36      0.0709     25.6925     23.4500
   258 CA   GLU     37      0.0431     18.9757     24.6000
   267 CA   THR     38      0.0288     15.5373     23.2600
   274 CA   LYS     39      0.0343     16.8658     21.7600
   283 CA   HIS     40      0.0306     15.9648     18.1400
   293 CA   ASP     41      0.0356     17.1741     17.3700
   301 CA   THR     42      0.0698     25.4330     15.4100
   308 CA   SER     43      0.0519     21.1102     18.3400
   314 CA   LEU     44      0.0251     14.6300     19.6500
   322 CA   LYS     45      0.0284     15.4317     21.5700
   331 CA   PRO     46      0.0263     14.9260     21.7400
   338 CA   ILE     47      0.0153     12.2683     21.4900
   346 CA   SER     48      0.0192     13.2137     19.1500
   352 CA   VAL     49      0.0150     12.1838     16.7100
   359 CA   SER     50      0.0174     12.7686     15.0200
   365 CA   TYR     51      0.0110     11.2291     12.2400
   377 CA   ASN     52      0.0153     12.2665     13.9400
   385 CA   PRO     53      0.0186     13.0526     13.5100
   392 CA   ALA     54      0.0221     13.8974     12.4300
   397 CA   THR     55      0.0127     11.6247     10.6900
   404 CA   ALA     56      0.0119     11.4452      9.5100
   409 CA   LYS     57      0.0149     12.1766     12.5300
   418 CA   GLU     58      0.0142     11.9900     12.2900
   427 CA   ILE     59      0.0106     11.1238      9.4400
   435 CA   ILE     60      0.0114     11.3121      8.6400
   443 CA   ASN     61      0.0107     11.1616      7.8500
   451 CA   VAL     62      0.0140     11.9436     10.6700
   458 CA   GLY     63      0.0124     11.5724     11.7400
   462 CA   HIS     64      0.0097     10.9006     10.0500
   472 CA   SER     65      0.0067     10.1954      7.9400
   478 CA   PHE     66      0.0058      9.9755      6.0000
   489 CA   HIS     67      0.0071     10.2925      6.7000
   499 CA   VAL     68      0.0070     10.2491      8.7500
   506 CA   ASN     69      0.0085     10.6291     10.7200
   514 CA   PHE     70      0.0083     10.5805     12.6900
   525 CA   GLU     71      0.0148     12.1411     17.0500
   534 CA   ASP     72      0.0135     11.8175     19.1700
   542 CA   ASN     73      0.0467     19.8459     23.5100
   550 CA   GLN     74      0.0357     17.2056     24.8500
   559 CA   ASP     75      0.0185     13.0364     21.8400
   567 CA   ARG     76      0.0198     13.3542     18.7100
   578 CA   SER     77      0.0095     10.8737     13.3400
   584 CA   VAL     78      0.0096     10.8847     12.3000
   591 CA   LEU     79      0.0090     10.7521     11.8000
   599 CA   LYS     80      0.0129     11.6918     15.1800
   608 CA   GLY     81      0.0168     12.6251     13.2000
   612 CA   GLY     82      0.0153     12.2601     14.8600
   616 CA   PRO     83      0.0155     12.3044     15.7000
   623 CA   PHE     84      0.0146     12.0863     16.6600
   634 CA   SER     85      0.0521     21.1555     21.0300
   640 CA   ASP     86      0.0214     13.7442     21.3600
   648 CA   SER     87      0.0101     11.0148     17.0200
   654 CA   TYR     88      0.0074     10.3598     12.8600
   666 CA   ARG     89      0.0076     10.4102     10.8600
   677 CA   LEU     90      0.0061     10.0450      6.7700
   685 CA   PHE     91      0.0063     10.0862      4.8400
   696 CA   GLN     92      0.0061     10.0313      6.6800
   705 CA   PHE     93      0.0049      9.7433      7.3400
   716 CA   HIS     94      0.0048      9.7259      5.6000
   726 CA   PHE     95      0.0039      9.5166      4.0400
   737 CA   HIS     96      0.0041      9.5489      5.0100
   747 CA   TRP     97      0.0058      9.9634      6.5100
   761 CA   GLY     98      0.0073     10.3367      8.0800
   765 CA   SER     99      0.0196     13.3080     10.8100
   771 CA   THR    100      0.0229     14.0965     11.1700
   778 CA   ASN    101      0.0154     12.2923     11.3500
   786 CA   GLU    102      0.0198     13.3431     12.4700
   795 CA   HIS    103      0.0175     12.8028     12.5700
   805 CA   GLY    104      0.0087     10.6760      8.2200
   809 CA   SER    105      0.0056      9.9271      7.0800
   815 CA   GLU    106      0.0049      9.7419      7.6000
   824 CA   HIS    107      0.0057      9.9405      7.2400
   834 CA   THR    108      0.0083     10.5666      8.3300
   841 CA   VAL    109      0.0152     12.2513     11.0400
   848 CA   ASP    110      0.0303     15.8829     14.7000
   856 CA   GLY    111      0.0389     17.9719     14.0400
   860 CA   VAL    112      0.0318     16.2635     14.3800
   867 CA   LYS    113      0.0104     11.0764     13.2400
   876 CA   TYR    114      0.0096     10.8976     11.0500
   888 CA   SER    115      0.0076     10.4001      8.6200
   894 CA   ALA    116      0.0060     10.0068      5.5800
   899 CA   GLU    117      0.0041      9.5592      4.4600
   908 CA   LEU    118      0.0043      9.5962      4.7800
   916 CA   HIS    119      0.0037      9.4667      4.4300
   926 CA   VAL    120      0.0042      9.5834      5.6200
   933 CA   ALA    121      0.0059      9.9857      5.9800
   938 CA   HIS    122      0.0054      9.8702      6.7100
   948 CA   TRP    123      0.0088     10.6815     10.7200
   962 CA   ASN    124      0.0098     10.9320     14.3200
   970 CA   SER    125      0.0139     11.9203     18.5700
   976 CA   ALA    126      0.0215     13.7550     23.4100
   981 CA   LYS    127      0.0288     15.5242     24.6500
   990 CA   TYR    128      0.0245     14.4786     24.4600
  1002 CA   SER    129      0.0480     20.1785     24.5700
  1008 CA   SER    130      0.0352     17.0651     21.5000
  1014 CA   LEU    131      0.0207     13.5656     17.8600
  1022 CA   ALA    132      0.0363     17.3423     20.4600
  1027 CA   GLU    133      0.0360     17.2608     23.0300
  1036 CA   ALA    134      0.0183     12.9968     19.8900
  1041 CA   ALA    135      0.0197     13.3377     17.7600
  1046 CA   SER    136      0.0231     14.1495     16.6200
  1052 CA   LYS    137      0.0238     14.3237     16.3500
  1061 CA   ALA    138      0.0239     14.3397     13.8200
  1066 CA   ASP    139      0.0170     12.6695     11.6500
  1074 CA   GLY    140      0.0108     11.1877     10.1800
  1078 CA   LEU    141      0.0063     10.0857      8.4300
  1086 CA   ALA    142      0.0056      9.9265      5.9700
  1091 CA   VAL    143      0.0042      9.5867      5.3100
  1098 CA   ILE    144      0.0042      9.5790      6.0600
  1106 CA   GLY    145      0.0047      9.7026      6.6200
  1110 CA   VAL    146      0.0052      9.8174      6.4300
  1117 CA   LEU    147      0.0063     10.0792      8.4400
  1125 CA   MET    148      0.0063     10.0976      8.2600
  1133 CA   LYS    149      0.0133     11.7779     11.7400
  1142 CA   VAL    150      0.0158     12.3763     12.9500
  1149 CA   GLY    151      0.0487     20.3349     15.0900
  1153 CA   GLU    152      0.0645     24.1476     19.0300
  1162 CA   ALA    153      0.0290     15.5686     16.4000
  1167 CA   ASN    154      0.0210     13.6351     14.8400
  1175 CA   PRO    155      0.0303     15.8886     14.5500
  1182 CA   LYS    156      0.0242     14.4090     14.7800
  1191 CA   LEU    157      0.0143     12.0291     12.5900
  1199 CA   GLN    158      0.0199     13.3797     14.7800
  1208 CA   LYS    159      0.0178     12.8657     13.9400
  1217 CA   VAL    160      0.0109     11.1960     12.4000
  1224 CA   LEU    161      0.0143     12.0110     12.5900
  1232 CA   ASP    162      0.0240     14.3578     13.9500
  1240 CA   ALA    163      0.0150     12.1981     14.2500
  1245 CA   LEU    164      0.0121     11.4999     15.1400
  1253 CA   GLN    165      0.0369     17.4749     17.9700
  1262 CA   ALA    166      0.0269     15.0655     14.3100
  1267 CA   ILE    167      0.0139     11.9330     12.7300
  1275 CA   LYS    168      0.0146     12.0914     13.1500
  1284 CA   THR    169      0.0203     13.4797     10.1700
  1291 CA   LYS    170      0.0226     14.0330     12.1700
  1300 CA   GLY    171      0.0313     16.1390     12.4500
  1304 CA   LYS    172      0.0260     14.8402     13.6500
  1313 CA   ARG    173      0.0236     14.2583     15.8100
  1324 CA   ALA    174      0.0285     15.4563     14.2700
  1329 CA   PRO    175      0.0311     16.0781     13.4000
  1336 CA   PHE    176      0.0169     12.6428     12.4600
  1347 CA   THR    177      0.0237     14.3047     14.9900
  1354 CA   ASN    178      0.0272     15.1408     15.3800
  1362 CA   PHE    179      0.0126     11.6047     12.3600
  1373 CA   ASP    180      0.0117     11.4004     12.3600
  1381 CA   PRO    181      0.0093     10.8033     11.2600
  1388 CA   SER    182      0.0124     11.5597     12.4700
  1394 CA   THR    183      0.0157     12.3698     13.4400
  1401 CA   LEU    184      0.0126     11.5995     12.4000
  1409 CA   LEU    185      0.0139     11.9190     13.5100
  1417 CA   PRO    186      0.0190     13.1577     16.2200
  1424 CA   SER    187      0.0668     24.7243     21.1200
  1430 CA   SER    188      0.0345     16.9138     20.6100
  1436 CA   LEU    189      0.0248     14.5508     19.5700
  1444 CA   ASP    190      0.0166     12.5708     16.1500
  1452 CA   PHE    191      0.0081     10.5288     11.2900
  1463 CA   TRP    192      0.0074     10.3664      8.7800
  1477 CA   THR    193      0.0058      9.9762      7.6300
  1484 CA   TYR    194      0.0056      9.9085      7.3000
  1496 CA   PRO    195      0.0076     10.4057      6.7700
  1503 CA   GLY    196      0.0064     10.1153      7.3800
  1507 CA   SER    197      0.0064     10.1128      6.9000
  1513 CA   LEU    198      0.0072     10.3016      7.2200
  1521 CA   THR    199      0.0053      9.8385      7.3800
  1528 CA   HIS    200      0.0065     10.1269     10.2700
  1538 CA   PRO    201      0.0134     11.8062     10.5200
  1545 CA   PRO    202      0.0172     12.7232     12.1900
  1552 CA   LEU    203      0.0093     10.8241     11.7400
  1560 CA   TYR    204      0.0129     11.6811     11.6800
  1572 CA   GLU    205      0.0090     10.7469     10.9300
  1581 CA   SER    206      0.0107     11.1591      8.6500
  1587 CA   VAL    207      0.0062     10.0630      5.7100
  1594 CA   THR    208      0.0057      9.9456      6.7500
  1601 CA   TRP    209      0.0038      9.4892      6.0400
  1615 CA   ILE    210      0.0043      9.6070      7.9900
  1623 CA   ILE    211      0.0051      9.8100      8.7700
  1631 CA   CYS    212      0.0066     10.1670     11.8900
  1637 CA   LYS    213      0.0135     11.8242     13.1100
  1646 CA   GLU    214      0.0156     12.3453     14.6800
  1655 CA   SER    215      0.0113     11.2942     12.7200
  1661 CA   ILE    216      0.0111     11.2422     10.2200
  1669 CA   SER    217      0.0189     13.1276     12.0800
  1675 CA   VAL    218      0.0142     11.9971     10.4800
  1682 CA   SER    219      0.0209     13.6107     11.5800
  1688 CA   SER    220      0.0208     13.5871     12.0100
  1694 CA   GLU    221      0.0345     16.9096     13.3100
  1703 CA   GLN    222      0.0155     12.3179      9.1500
  1712 CA   LEU    223      0.0099     10.9512      9.6900
  1720 CA   ALA    224      0.0132     11.7559     10.2500
  1725 CA   GLN    225      0.0097     10.9017     11.2000
  1734 CA   PHE    226      0.0079     10.4729     10.3800
  1745 CA   ARG    227      0.0093     10.8202     12.0500
  1756 CA   SER    228      0.0135     11.8408     14.2900
  1762 CA   LEU    229      0.0113     11.2892     12.0000
  1770 CA   LEU    230      0.0149     12.1575     10.2500
  1778 CA   SER    231      0.0229     14.0989     11.1700
  1784 CA   ASN    232      0.0347     16.9473     10.6500
  1792 CA   VAL    233      0.0593     22.8981     13.5100
  1799 CA   GLU    234      0.0881     29.8619     17.2900
  1808 CA   GLY    235      0.2129     60.0183     16.6400
  1812 CA   ASP    236      0.1404     42.5065     15.1500
  1820 CA   ASN    237      0.1505     44.9366     12.0600
  1828 CA   ALA    238      0.0989     32.4733     13.2200
  1833 CA   VAL    239      0.0446     19.3553     12.5200
  1840 CA   PRO    240      0.0255     14.7221     11.8900
  1847 CA   MET    241      0.0099     10.9661     11.6900
  1855 CA   GLN    242      0.0121     11.4838     14.2500
  1864 CA   HIS    243      0.0091     10.7618     11.7400
  1874 CA   ASN    244      0.0073     10.3270      8.6200
  1882 CA   ASN    245      0.0061     10.0404      8.3000
  1890 CA   ARG    246      0.0047      9.7124      9.0800
  1901 CA   PRO    247      0.0086     10.6459     10.9400
  1908 CA   THR    248      0.0081     10.5305     12.0500
  1915 CA   GLN    249      0.0126     11.6145     12.1200
  1924 CA   PRO    250      0.0210     13.6476     13.6000
  1931 CA   LEU    251      0.0190     13.1673     15.0300
  1939 CA   LYS    252      0.0308     16.0058     16.8000
  1948 CA   GLY    253      0.0687     25.1818     15.9900
  1952 CA   ARG    254      0.0325     16.4149     13.0400
  1963 CA   THR    255      0.0221     13.9070     13.4100
  1970 CA   VAL    256      0.0123     11.5322     12.8300
  1977 CA   ARG    257      0.0136     11.8487     13.1500
  1988 CA   ALA    258      0.0140     11.9390     12.6300
  1993 CA   SER    259      0.0176     12.8189     13.5300
  1999 CA   PHE    260      0.0293     15.6492     15.5000

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.