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B-factor analysis for ID 22031614360810911

Overall B-factor prediction

Correlation= -0.467 for 289 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   GLY     58      0.0399     86.8535     94.7300
     6 CA   LEU     59      0.0425     87.2560     95.1000
    14 CA   PHE     60      0.0621     90.3268     96.7300
    25 CA   LEU     61      0.0358     86.2133     96.7600
    33 CA   SER     62      0.0230     84.1920     96.6600
    39 CA   CYS     63      0.0358     86.2140     97.0500
    45 CA   LEU     64      0.0381     86.5692     97.1600
    53 CA   TYR     65      0.0215     83.9560     97.7200
    65 CA   THR     66      0.0232     84.2283     96.8400
    72 CA   ILE     67      0.0393     86.7485     97.0700
    80 CA   PHE     68      0.0363     86.2879     96.3000
    91 CA   LEU     69      0.0189     83.5513     96.6000
    99 CA   PHE     70      0.0157     83.0504     97.0000
   110 CA   PRO     71      0.0202     83.7527     96.7000
   117 CA   ILE     72      0.0162     83.1259     96.1200
   125 CA   GLY     73      0.0116     82.4086     96.4800
   129 CA   PHE     74      0.0144     82.8512     96.7200
   140 CA   VAL     75      0.0194     83.6301     96.2300
   147 CA   GLY     76      0.0120     82.4653     95.3100
   151 CA   ASN     77      0.0098     82.1335     96.7400
   159 CA   ILE     78      0.0151     82.9653     96.4600
   167 CA   LEU     79      0.0139     82.7701     94.7000
   175 CA   ILE     80      0.0097     82.1139     94.0500
   183 CA   LEU     81      0.0119     82.4555     94.9500
   191 CA   VAL     82      0.0204     83.7853     94.4800
   198 CA   VAL     83      0.0158     83.0645     92.4000
   205 CA   ASN     84      0.0137     82.7452     92.4600
   213 CA   ILE     85      0.0250     84.5153     92.8900
   221 CA   SER     86      0.0303     85.3438     92.2400
   227 CA   PHE     87      0.0284     85.0435     90.8800
   238 CA   ARG     88      0.0426     87.2715     88.7600
   249 CA   GLU     89      0.0708     91.6919     86.8000
   258 CA   LYS     90      0.0364     86.3081     85.7600
   267 CA   MET     91      0.0241     84.3686     86.3600
   275 CA   THR     92      0.0163     83.1463     86.5100
   282 CA   ILE     93      0.0112     82.3411     88.0200
   290 CA   PRO     94      0.0092     82.0256     87.2900
   297 CA   ASP     95      0.0092     82.0290     89.6500
   305 CA   LEU     96      0.0099     82.1444     93.1700
   313 CA   TYR     97      0.0085     81.9249     93.7100
   325 CA   PHE     98      0.0075     81.7658     92.5700
   336 CA   ILE     99      0.0084     81.9049     94.7700
   344 CA   ASN    100      0.0091     82.0195     96.8600
   352 CA   LEU    101      0.0083     81.8861     96.2500
   360 CA   ALA    102      0.0091     82.0211     96.7900
   365 CA   VAL    103      0.0104     82.2160     97.2100
   372 CA   ALA    104      0.0088     81.9700     96.8900
   377 CA   ASP    105      0.0082     81.8712     97.4100
   385 CA   LEU    106      0.0097     82.1037     96.9500
   393 CA   ILE    107      0.0099     82.1483     94.8800
   401 CA   LEU    108      0.0085     81.9183     96.2200
   409 CA   VAL    109      0.0091     82.0132     96.7800
   416 CA   ALA    110      0.0126     82.5664     95.0800
   421 CA   ASP    111      0.0110     82.3163     92.4300
   429 CA   SER    112      0.0111     82.3351     93.8200
   435 CA   LEU    113      0.0146     82.8741     92.1800
   443 CA   ILE    114      0.0164     83.1676     89.5300
   451 CA   GLU    115      0.0119     82.4618     89.4100
   460 CA   VAL    116      0.0143     82.8259     92.4900
   467 CA   PHE    117      0.0207     83.8339     91.5700
   478 CA   ASN    118      0.0193     83.6161     86.5900
   486 CA   LEU    119      0.0241     84.3669     82.3500
   494 CA   HIS    120      0.0465     87.8914     74.6400
   504 CA   GLU    121      0.0233     84.2390     71.2100
   513 CA   ARG    122      0.0392     86.7433     63.1000
   524 CA   TYR    123      0.0248     84.4809     69.3600
   536 CA   TYR    124      0.0201     83.7415     70.6600
   548 CA   ASP    125      0.0342     85.9475     67.4900
   556 CA   ILE    126      0.0346     86.0137     80.5200
   564 CA   ALA    127      0.0282     85.0076     77.9600
   569 CA   VAL    128      0.0371     86.4028     82.6800
   576 CA   LEU    129      0.0257     84.6160     83.8900
   584 CA   CYS    130      0.0153     82.9836     82.2500
   590 CA   THR    131      0.0159     83.0829     83.3200
   597 CA   PHE    132      0.0169     83.2449     85.0200
   608 CA   MET    133      0.0113     82.3690     87.3100
   616 CA   SER    134      0.0091     82.0158     87.2600
   622 CA   LEU    135      0.0112     82.3480     90.0800
   630 CA   PHE    136      0.0094     82.0706     92.1000
   641 CA   LEU    137      0.0074     81.7500     92.3100
   649 CA   GLN    138      0.0080     81.8417     92.6800
   658 CA   VAL    139      0.0090     81.9964     94.5700
   665 CA   ASN    140      0.0072     81.7191     96.1800
   673 CA   MET    141      0.0070     81.6821     95.6500
   681 CA   TYR    142      0.0083     81.8880     96.7300
   693 CA   SER    143      0.0084     81.9139     97.2300
   699 CA   SER    144      0.0075     81.7726     97.2000
   705 CA   VAL    145      0.0080     81.8385     97.3500
   712 CA   PHE    146      0.0086     81.9417     97.7600
   723 CA   PHE    147      0.0082     81.8748     97.1900
   734 CA   LEU    148      0.0082     81.8684     96.2800
   742 CA   THR    149      0.0093     82.0444     96.9800
   749 CA   TRP    150      0.0092     82.0258     95.8100
   763 CA   MET    151      0.0074     81.7483     93.5100
   771 CA   SER    152      0.0091     82.0119     93.9800
   777 CA   PHE    153      0.0117     82.4175     93.0300
   788 CA   ASP    154      0.0102     82.1824     90.6900
   796 CA   ARG    155      0.0095     82.0803     89.4600
   807 CA   TYR    156      0.0145     82.8677     89.2700
   819 CA   ILE    157      0.0186     83.5072     87.3600
   827 CA   ALA    158      0.0190     83.5710     84.3100
   832 CA   LEU    159      0.0177     83.3597     82.8800
   840 CA   ALA    160      0.0339     85.9029     79.8600
   845 CA   ARG    161      0.0369     86.3742     70.5900
   856 CA   ALA    162      0.0566     89.4768     66.6900
   861 CA   MET    163      0.0786     92.9172     58.6900
   869 CA   ARG    164      0.1040     96.9037     60.0600
   880 CA   CYS    165      0.1371    102.0944     52.7700
   886 CA   SER    166      0.0661     90.9538     58.8800
   892 CA   LEU    167      0.0964     95.7154     62.4100
   900 CA   PHE    168      0.0537     89.0094     65.8800
   911 CA   ARG    169      0.0295     85.2194     78.3000
   922 CA   THR    170      0.0296     85.2260     85.0500
   929 CA   LYS    171      0.0257     84.6242     86.1900
   938 CA   HIS    172      0.0421     87.1984     89.5700
   948 CA   HIS    173      0.0293     85.1892     90.3200
   958 CA   ALA    174      0.0172     83.2897     92.3700
   963 CA   ARG    175      0.0264     84.7257     94.2900
   974 CA   LEU    176      0.0358     86.1987     95.1900
   982 CA   SER    177      0.0208     83.8535     95.3000
   988 CA   CYS    178      0.0154     83.0061     97.0200
   994 CA   GLY    179      0.0242     84.3907     97.2700
   998 CA   LEU    180      0.0279     84.9627     97.3600
  1006 CA   ILE    181      0.0161     83.1110     97.7600
  1014 CA   TRP    182      0.0161     83.1113     97.7400
  1028 CA   MET    183      0.0272     84.8558     96.9500
  1036 CA   ALA    184      0.0222     84.0675     96.9100
  1041 CA   SER    185      0.0137     82.7456     96.5700
  1047 CA   VAL    186      0.0216     83.9712     94.2200
  1054 CA   SER    187      0.0304     85.3530     93.9500
  1060 CA   ALA    188      0.0164     83.1642     93.6800
  1065 CA   THR    189      0.0134     82.6922     92.0500
  1072 CA   LEU    190      0.0225     84.1233     89.4800
  1080 CA   VAL    191      0.0204     83.7837     87.3000
  1087 CA   PRO    192      0.0128     82.6018     84.1600
  1094 CA   PHE    193      0.0148     82.9053     85.0200
  1105 CA   THR    194      0.0246     84.4491     84.3100
  1112 CA   ALA    195      0.0197     83.6780     80.6800
  1117 CA   VAL    196      0.0147     82.8961     76.3700
  1124 CA   HIS    197      0.0260     84.6671     76.8900
  1134 CA   LEU    198      0.0394     86.7749     76.8000
  1142 CA   GLN    199      0.0268     84.7917     72.1500
  1151 CA   HIS    200      0.0297     85.2542     72.7900
  1161 CA   THR    201      0.0630     90.4814     68.6900
  1168 CA   ASP    202      0.1039     96.8972     63.1800
  1176 CA   GLU    203      0.0601     90.0264     61.9700
  1185 CA   ALA    204      0.0256     84.5990     60.7000
  1190 CA   CYS    205      0.0207     83.8347     63.8400
  1196 CA   PHE    206      0.0110     82.3092     68.6100
  1207 CA   CYS    207      0.0106     82.2530     71.2900
  1213 CA   PHE    208      0.0092     82.0341     73.7800
  1224 CA   ALA    209      0.0106     82.2522     67.9600
  1229 CA   ASP    210      0.0135     82.7055     74.4500
  1237 CA   VAL    211      0.0167     83.2058     80.7700
  1244 CA   ARG    212      0.0232     84.2322     83.9900
  1255 CA   GLU    213      0.0300     85.3022     86.9600
  1264 CA   VAL    214      0.0159     83.0828     87.4400
  1271 CA   GLN    215      0.0123     82.5202     88.3600
  1280 CA   TRP    216      0.0168     83.2320     90.0900
  1294 CA   LEU    217      0.0168     83.2232     92.0300
  1302 CA   GLU    218      0.0111     82.3381     92.1500
  1311 CA   VAL    219      0.0124     82.5376     94.0000
  1318 CA   THR    220      0.0160     83.0973     95.0300
  1325 CA   LEU    221      0.0143     82.8278     95.3100
  1333 CA   GLY    222      0.0107     82.2752     94.1800
  1337 CA   PHE    223      0.0115     82.3885     95.4400
  1348 CA   ILE    224      0.0211     83.9064     96.3700
  1356 CA   VAL    225      0.0242     84.3805     96.9000
  1363 CA   PRO    226      0.0145     82.8626     97.0500
  1370 CA   PHE    227      0.0175     83.3362     97.1300
  1381 CA   ALA    228      0.0265     84.7469     97.6000
  1386 CA   ILE    229      0.0226     84.1278     97.3200
  1394 CA   ILE    230      0.0147     82.9032     96.8600
  1402 CA   GLY    231      0.0253     84.5534     96.5000
  1406 CA   LEU    232      0.0344     85.9865     96.6800
  1414 CA   CYS    233      0.0185     83.4894     95.1700
  1420 CA   TYR    234      0.0177     83.3673     93.3100
  1432 CA   SER    235      0.0324     85.6755     94.0100
  1438 CA   LEU    236      0.0272     84.8546     92.9800
  1446 CA   ILE    237      0.0192     83.5985     90.7100
  1454 CA   VAL    238      0.0416     87.1107     89.3900
  1461 CA   ARG    239      0.0498     88.4033     89.6100
  1472 CA   VAL    240      0.0321     85.6271     85.8700
  1479 CA   LEU    241      0.0368     86.3708     84.3700
  1487 CA   VAL    242      0.0784     92.8932     84.2400
  1494 CA   ARG    243      0.0823     93.5088     83.1800
  1505 CA   ALA    244      0.0727     91.9949     78.3400
  1510 CA   HIS    245      0.1032     96.7753     70.6100
  1520 CA   ARG    246      0.2000    111.9679     60.2900
  1531 CA   HIS    247      0.2368    117.7499     54.0400
  1541 CA   ARG    248      0.2030    112.4492     58.8900
  1552 CA   GLY    249      0.1894    110.3030     59.2300
  1556 CA   LEU    250      0.0639     90.6195     61.6500
  1564 CA   ARG    251      0.0679     91.2371     66.4800
  1575 CA   PRO    252      0.0647     90.7376     68.2200
  1582 CA   ARG    253      0.0544     89.1327     67.5600
  1593 CA   ARG    254      0.0282     85.0215     72.9900
  1604 CA   GLN    255      0.0297     85.2540     77.8200
  1613 CA   LYS    256      0.0221     84.0584     78.9400
  1622 CA   ALA    257      0.0164     83.1699     81.5300
  1627 CA   LEU    258      0.0124     82.5297     86.2200
  1635 CA   ARG    259      0.0147     82.8981     87.0400
  1646 CA   MET    260      0.0092     82.0380     88.9800
  1654 CA   ILE    261      0.0087     81.9492     89.6000
  1662 CA   LEU    262      0.0121     82.4917     92.5200
  1670 CA   ALA    263      0.0122     82.5052     94.0900
  1675 CA   VAL    264      0.0090     81.9954     93.9300
  1682 CA   VAL    265      0.0098     82.1267     95.4600
  1689 CA   LEU    266      0.0124     82.5332     96.4700
  1697 CA   VAL    267      0.0108     82.2869     96.7400
  1704 CA   PHE    268      0.0098     82.1343     96.9600
  1715 CA   PHE    269      0.0110     82.3148     97.1800
  1726 CA   VAL    270      0.0131     82.6518     97.5700
  1733 CA   CYS    271      0.0102     82.1852     97.4800
  1739 CA   TRP    272      0.0088     81.9755     97.0100
  1753 CA   LEU    273      0.0123     82.5220     96.9000
  1761 CA   PRO    274      0.0134     82.6928     96.4200
  1768 CA   GLU    275      0.0107     82.2631     93.3700
  1777 CA   ASN    276      0.0119     82.4632     94.7700
  1785 CA   VAL    277      0.0171     83.2745     94.9800
  1792 CA   PHE    278      0.0145     82.8594     92.7600
  1803 CA   ILE    279      0.0123     82.5241     90.1900
  1811 CA   SER    280      0.0206     83.8241     91.6400
  1817 CA   VAL    281      0.0249     84.5011     91.1100
  1824 CA   HIS    282      0.0183     83.4576     86.2900
  1834 CA   LEU    283      0.0201     83.7432     85.2000
  1842 CA   LEU    284      0.0431     87.3506     86.8500
  1850 CA   GLN    285      0.0477     88.0659     83.1700
  1859 CA   ARG    286      0.0444     87.5488     71.4200
  1870 CA   THR    287      0.0980     95.9654     58.5200
  1877 CA   GLN    288      0.1632    106.1933     56.5100
  1886 CA   PRO    289      0.2606    121.4862     57.0400
  1893 CA   GLY    290      0.3521    135.8341     58.6900
  1897 CA   ALA    291      0.1553    104.9636     56.4700
  1902 CA   ALA    292      0.0973     95.8513     58.2000
  1907 CA   PRO    293      0.0560     89.3726     58.2300
  1914 CA   CYS    294      0.0467     87.9232     57.5500
  1920 CA   LYS    295      0.0577     89.6363     53.2100
  1929 CA   GLN    296      0.0278     84.9544     56.1100
  1938 CA   SER    297      0.0171     83.2685     66.2200
  1944 CA   PHE    298      0.0161     83.1118     75.6200
  1955 CA   ARG    299      0.0136     82.7200     77.8100
  1966 CA   HIS    300      0.0214     83.9457     75.2600
  1976 CA   ALA    301      0.0293     85.1825     79.8900
  1981 CA   HIS    302      0.0266     84.7634     87.0200
  1991 CA   PRO    303      0.0249     84.4999     86.9700
  1998 CA   LEU    304      0.0344     85.9931     90.8000
  2006 CA   THR    305      0.0245     84.4366     92.2500
  2013 CA   GLY    306      0.0162     83.1368     90.9700
  2017 CA   HIS    307      0.0140     82.7864     92.3900
  2027 CA   ILE    308      0.0173     83.3048     95.0000
  2035 CA   VAL    309      0.0135     82.7134     94.9100
  2042 CA   ASN    310      0.0098     82.1192     93.4700
  2050 CA   LEU    311      0.0113     82.3580     96.5000
  2058 CA   ALA    312      0.0106     82.2459     97.2400
  2063 CA   ALA    313      0.0086     81.9305     96.7100
  2068 CA   PHE    314      0.0080     81.8385     96.8100
  2079 CA   SER    315      0.0095     82.0726     97.2300
  2085 CA   ASN    316      0.0080     81.8434     96.9700
  2093 CA   SER    317      0.0079     81.8226     97.0900
  2099 CA   CYS    318      0.0103     82.2016     96.5900
  2105 CA   LEU    319      0.0107     82.2707     95.9800
  2113 CA   ASN    320      0.0088     81.9723     91.7900
  2121 CA   PRO    321      0.0100     82.1652     92.2500
  2128 CA   LEU    322      0.0134     82.6845     91.6000
  2136 CA   ILE    323      0.0108     82.2838     90.8100
  2144 CA   TYR    324      0.0100     82.1549     84.9000
  2156 CA   SER    325      0.0132     82.6657     85.0300
  2162 CA   PHE    326      0.0194     83.6314     84.3000
  2173 CA   LEU    327      0.0146     82.8796     82.8500
  2181 CA   GLY    328      0.0151     82.9533     80.0300
  2185 CA   GLU    329      0.0212     83.9139     79.5700
  2194 CA   THR    330      0.0185     83.4840     80.7500
  2201 CA   PHE    331      0.0133     82.6756     83.1900
  2212 CA   ARG    332      0.0202     83.7561     86.7900
  2223 CA   ASP    333      0.0280     84.9775     86.3000
  2231 CA   LYS    334      0.0203     83.7698     85.9300
  2240 CA   LEU    335      0.0214     83.9506     88.8400
  2248 CA   ARG    336      0.0491     88.2961     89.6100
  2259 CA   LEU    337      0.0447     87.6050     90.0500
  2267 CA   TYR    338      0.0366     86.3246     89.2000
  2279 CA   ILE    339      0.0609     90.1502     89.2800
  2287 CA   GLU    340      0.0948     95.4687     87.9800
  2296 CA   GLN    341      0.0982     95.9962     85.3900
  2305 CA   LYS    342      0.1419    102.8485     82.5400
  2314 CA   THR    343      0.2129    114.0027     79.7300
  2321 CA   ASN    344      0.2878    125.7533     68.2100
  2329 CA   LEU    345      0.3708    138.7716     66.1400
  2337 CA   PRO    346      1.0167    240.1214     61.5800

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: October 18th, 2018.