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***  01-JUL-21  ***

B-factor analysis for ID 22031613451271437

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      0.0401     86.8104     94.7300
     6 CA   LEU     59      0.0428     87.2340     95.1000
    14 CA   PHE     60      0.0630     90.3979     96.7300
    25 CA   LEU     61      0.0365     86.2463     96.7600
    33 CA   SER     62      0.0235     84.2037     96.6600
    39 CA   CYS     63      0.0367     86.2701     97.0500
    45 CA   LEU     64      0.0391     86.6484     97.1600
    53 CA   TYR     65      0.0222     83.9920     97.7200
    65 CA   THR     66      0.0240     84.2816     96.8400
    72 CA   ILE     67      0.0404     86.8560     97.0700
    80 CA   PHE     68      0.0374     86.3843     96.3000
    91 CA   LEU     69      0.0199     83.6299     96.6000
    99 CA   PHE     70      0.0165     83.1059     97.0000
   110 CA   PRO     71      0.0212     83.8400     96.7000
   117 CA   ILE     72      0.0173     83.2255     96.1200
   125 CA   GLY     73      0.0123     82.4432     96.4800
   129 CA   PHE     74      0.0150     82.8687     96.7200
   140 CA   VAL     75      0.0200     83.6491     96.2300
   147 CA   GLY     76      0.0126     82.4861     95.3100
   151 CA   ASN     77      0.0103     82.1279     96.7400
   159 CA   ILE     78      0.0154     82.9245     96.4600
   167 CA   LEU     79      0.0141     82.7284     94.7000
   175 CA   ILE     80      0.0100     82.0892     94.0500
   183 CA   LEU     81      0.0122     82.4306     94.9500
   191 CA   VAL     82      0.0207     83.7629     94.4800
   198 CA   VAL     83      0.0162     83.0498     92.4000
   205 CA   ASN     84      0.0141     82.7277     92.4600
   213 CA   ILE     85      0.0256     84.5257     92.8900
   221 CA   SER     86      0.0310     85.3746     92.2400
   227 CA   PHE     87      0.0291     85.0827     90.8800
   238 CA   ARG     88      0.0433     87.3031     88.7600
   249 CA   GLU     89      0.0717     91.7654     86.8000
   258 CA   LYS     90      0.0373     86.3568     85.7600
   267 CA   MET     91      0.0245     84.3561     86.3600
   275 CA   THR     92      0.0165     83.1094     86.5100
   282 CA   ILE     93      0.0113     82.2827     88.0200
   290 CA   PRO     94      0.0093     81.9796     87.2900
   297 CA   ASP     95      0.0094     81.9936     89.6500
   305 CA   LEU     96      0.0101     82.0978     93.1700
   313 CA   TYR     97      0.0087     81.8735     93.7100
   325 CA   PHE     98      0.0078     81.7337     92.5700
   336 CA   ILE     99      0.0086     81.8689     94.7700
   344 CA   ASN    100      0.0093     81.9743     96.8600
   352 CA   LEU    101      0.0085     81.8432     96.2500
   360 CA   ALA    102      0.0094     81.9856     96.7900
   365 CA   VAL    103      0.0106     82.1807     97.2100
   372 CA   ALA    104      0.0091     81.9432     96.8900
   377 CA   ASP    105      0.0085     81.8521     97.4100
   385 CA   LEU    106      0.0100     82.0876     96.9500
   393 CA   ILE    107      0.0103     82.1295     94.8800
   401 CA   LEU    108      0.0088     81.8907     96.2200
   409 CA   VAL    109      0.0095     82.0069     96.7800
   416 CA   ALA    110      0.0131     82.5713     95.0800
   421 CA   ASP    111      0.0113     82.2913     92.4300
   429 CA   SER    112      0.0114     82.3074     93.8200
   435 CA   LEU    113      0.0150     82.8726     92.1800
   443 CA   ILE    114      0.0168     83.1576     89.5300
   451 CA   GLU    115      0.0122     82.4255     89.4100
   460 CA   VAL    116      0.0146     82.8040     92.4900
   467 CA   PHE    117      0.0210     83.8078     91.5700
   478 CA   ASN    118      0.0194     83.5562     86.5900
   486 CA   LEU    119      0.0242     84.3115     82.3500
   494 CA   HIS    120      0.0468     87.8606     74.6400
   504 CA   GLU    121      0.0234     84.1832     71.2100
   513 CA   ARG    122      0.0395     86.7097     63.1000
   524 CA   TYR    123      0.0250     84.4350     69.3600
   536 CA   TYR    124      0.0203     83.6932     70.6600
   548 CA   ASP    125      0.0345     85.9302     67.4900
   556 CA   ILE    126      0.0350     86.0118     80.5200
   564 CA   ALA    127      0.0286     85.0012     77.9600
   569 CA   VAL    128      0.0380     86.4729     82.6800
   576 CA   LEU    129      0.0261     84.6041     83.8900
   584 CA   CYS    130      0.0154     82.9365     82.2500
   590 CA   THR    131      0.0162     83.0525     83.3200
   597 CA   PHE    132      0.0172     83.2107     85.0200
   608 CA   MET    133      0.0115     82.3120     87.3100
   616 CA   SER    134      0.0092     81.9522     87.2600
   622 CA   LEU    135      0.0113     82.2915     90.0800
   630 CA   PHE    136      0.0095     82.0127     92.1000
   641 CA   LEU    137      0.0074     81.6825     92.3100
   649 CA   GLN    138      0.0080     81.7782     92.6800
   658 CA   VAL    139      0.0091     81.9396     94.5700
   665 CA   ASN    140      0.0073     81.6653     96.1800
   673 CA   MET    141      0.0071     81.6262     95.6500
   681 CA   TYR    142      0.0084     81.8336     96.7300
   693 CA   SER    143      0.0086     81.8624     97.2300
   699 CA   SER    144      0.0077     81.7229     97.2000
   705 CA   VAL    145      0.0082     81.7948     97.3500
   712 CA   PHE    146      0.0088     81.8912     97.7600
   723 CA   PHE    147      0.0084     81.8258     97.1900
   734 CA   LEU    148      0.0085     81.8510     96.2800
   742 CA   THR    149      0.0096     82.0241     96.9800
   749 CA   TRP    150      0.0093     81.9825     95.8100
   763 CA   MET    151      0.0076     81.7019     93.5100
   771 CA   SER    152      0.0093     81.9749     93.9800
   777 CA   PHE    153      0.0119     82.3777     93.0300
   788 CA   ASP    154      0.0103     82.1335     90.6900
   796 CA   ARG    155      0.0097     82.0365     89.4600
   807 CA   TYR    156      0.0147     82.8165     89.2700
   819 CA   ILE    157      0.0188     83.4671     87.3600
   827 CA   ALA    158      0.0193     83.5363     84.3100
   832 CA   LEU    159      0.0181     83.3536     82.8800
   840 CA   ALA    160      0.0343     85.8970     79.8600
   845 CA   ARG    161      0.0374     86.3766     70.5900
   856 CA   ALA    162      0.0573     89.5045     66.6900
   861 CA   MET    163      0.0795     92.9799     58.6900
   869 CA   ARG    164      0.1049     96.9688     60.0600
   880 CA   CYS    165      0.1379    102.1390     52.7700
   886 CA   SER    166      0.0665     90.9379     58.8800
   892 CA   LEU    167      0.0968     95.6989     62.4100
   900 CA   PHE    168      0.0539     88.9652     65.8800
   911 CA   ARG    169      0.0296     85.1498     78.3000
   922 CA   THR    170      0.0296     85.1612     85.0500
   929 CA   LYS    171      0.0258     84.5617     86.1900
   938 CA   HIS    172      0.0423     87.1483     89.5700
   948 CA   HIS    173      0.0295     85.1352     90.3200
   958 CA   ALA    174      0.0173     83.2320     92.3700
   963 CA   ARG    175      0.0265     84.6741     94.2900
   974 CA   LEU    176      0.0359     86.1476     95.1900
   982 CA   SER    177      0.0210     83.8122     95.3000
   988 CA   CYS    178      0.0156     82.9553     97.0200
   994 CA   GLY    179      0.0243     84.3277     97.2700
   998 CA   LEU    180      0.0280     84.9080     97.3600
  1006 CA   ILE    181      0.0162     83.0609     97.7600
  1014 CA   TRP    182      0.0162     83.0534     97.7400
  1028 CA   MET    183      0.0273     84.8039     96.9500
  1036 CA   ALA    184      0.0223     84.0146     96.9100
  1041 CA   SER    185      0.0139     82.6911     96.5700
  1047 CA   VAL    186      0.0217     83.9131     94.2200
  1054 CA   SER    187      0.0304     85.2815     93.9500
  1060 CA   ALA    188      0.0166     83.1193     93.6800
  1065 CA   THR    189      0.0136     82.6422     92.0500
  1072 CA   LEU    190      0.0227     84.0816     89.4800
  1080 CA   VAL    191      0.0206     83.7473     87.3000
  1087 CA   PRO    192      0.0129     82.5450     84.1600
  1094 CA   PHE    193      0.0149     82.8583     85.0200
  1105 CA   THR    194      0.0249     84.4188     84.3100
  1112 CA   ALA    195      0.0199     83.6430     80.6800
  1117 CA   VAL    196      0.0149     82.8523     76.3700
  1124 CA   HIS    197      0.0263     84.6423     76.8900
  1134 CA   LEU    198      0.0398     86.7533     76.8000
  1142 CA   GLN    199      0.0271     84.7608     72.1500
  1151 CA   HIS    200      0.0300     85.2217     72.7900
  1161 CA   THR    201      0.0634     90.4554     68.6900
  1168 CA   ASP    202      0.1043     96.8656     63.1800
  1176 CA   GLU    203      0.0599     89.9149     61.9700
  1185 CA   ALA    204      0.0257     84.5452     60.7000
  1190 CA   CYS    205      0.0208     83.7783     63.8400
  1196 CA   PHE    206      0.0110     82.2439     68.6100
  1207 CA   CYS    207      0.0107     82.1879     71.2900
  1213 CA   PHE    208      0.0092     81.9641     73.7800
  1224 CA   ALA    209      0.0107     82.1981     67.9600
  1229 CA   ASP    210      0.0136     82.6502     74.4500
  1237 CA   VAL    211      0.0169     83.1714     80.7700
  1244 CA   ARG    212      0.0234     84.1842     83.9900
  1255 CA   GLU    213      0.0305     85.2950     86.9600
  1264 CA   VAL    214      0.0162     83.0568     87.4400
  1271 CA   GLN    215      0.0125     82.4813     88.3600
  1280 CA   TRP    216      0.0172     83.2078     90.0900
  1294 CA   LEU    217      0.0172     83.2073     92.0300
  1302 CA   GLU    218      0.0114     82.3008     92.1500
  1311 CA   VAL    219      0.0127     82.5080     94.0000
  1318 CA   THR    220      0.0163     83.0759     95.0300
  1325 CA   LEU    221      0.0145     82.7911     95.3100
  1333 CA   GLY    222      0.0110     82.2427     94.1800
  1337 CA   PHE    223      0.0118     82.3714     95.4400
  1348 CA   ILE    224      0.0216     83.9082     96.3700
  1356 CA   VAL    225      0.0246     84.3785     96.9000
  1363 CA   PRO    226      0.0148     82.8369     97.0500
  1370 CA   PHE    227      0.0179     83.3230     97.1300
  1381 CA   ALA    228      0.0270     84.7530     97.6000
  1386 CA   ILE    229      0.0229     84.1046     97.3200
  1394 CA   ILE    230      0.0151     82.8839     96.8600
  1402 CA   GLY    231      0.0256     84.5372     96.5000
  1406 CA   LEU    232      0.0349     85.9868     96.6800
  1414 CA   CYS    233      0.0188     83.4686     95.1700
  1420 CA   TYR    234      0.0182     83.3709     93.3100
  1432 CA   SER    235      0.0329     85.6755     94.0100
  1438 CA   LEU    236      0.0276     84.8412     92.9800
  1446 CA   ILE    237      0.0195     83.5775     90.7100
  1454 CA   VAL    238      0.0420     87.1053     89.3900
  1461 CA   ARG    239      0.0502     88.3886     89.6100
  1472 CA   VAL    240      0.0325     85.6130     85.8700
  1479 CA   LEU    241      0.0375     86.3948     84.3700
  1487 CA   VAL    242      0.0792     92.9303     84.2400
  1494 CA   ARG    243      0.0829     93.5163     83.1800
  1505 CA   ALA    244      0.0736     92.0594     78.3400
  1510 CA   HIS    245      0.1045     96.9014     70.6100
  1520 CA   ARG    246      0.2012    112.0585     60.2900
  1531 CA   HIS    247      0.2384    117.8875     54.0400
  1541 CA   ARG    248      0.2051    112.6676     58.8900
  1552 CA   GLY    249      0.1918    110.5862     59.2300
  1556 CA   LEU    250      0.0659     90.8413     61.6500
  1564 CA   ARG    251      0.0698     91.4604     66.4800
  1575 CA   PRO    252      0.0672     91.0491     68.2200
  1582 CA   ARG    253      0.0562     89.3277     67.5600
  1593 CA   ARG    254      0.0297     85.1714     72.9900
  1604 CA   GLN    255      0.0313     85.4166     77.8200
  1613 CA   LYS    256      0.0240     84.2761     78.9400
  1622 CA   ALA    257      0.0173     83.2317     81.5300
  1627 CA   LEU    258      0.0128     82.5169     86.2200
  1635 CA   ARG    259      0.0169     83.1635     87.0400
  1646 CA   MET    260      0.0103     82.1298     88.9800
  1654 CA   ILE    261      0.0095     82.0028     89.6000
  1662 CA   LEU    262      0.0132     82.5786     92.5200
  1670 CA   ALA    263      0.0133     82.5968     94.0900
  1675 CA   VAL    264      0.0098     82.0510     93.9300
  1682 CA   VAL    265      0.0106     82.1826     95.4600
  1689 CA   LEU    266      0.0142     82.7419     96.4700
  1697 CA   VAL    267      0.0114     82.3095     96.7400
  1704 CA   PHE    268      0.0104     82.1492     96.9600
  1715 CA   PHE    269      0.0117     82.3547     97.1800
  1726 CA   VAL    270      0.0144     82.7814     97.5700
  1733 CA   CYS    271      0.0109     82.2218     97.4800
  1739 CA   TRP    272      0.0092     81.9625     97.0100
  1753 CA   LEU    273      0.0130     82.5504     96.9000
  1761 CA   PRO    274      0.0139     82.6962     96.4200
  1768 CA   GLU    275      0.0109     82.2289     93.3700
  1777 CA   ASN    276      0.0123     82.4387     94.7700
  1785 CA   VAL    277      0.0177     83.2841     94.9800
  1792 CA   PHE    278      0.0147     82.8238     92.7600
  1803 CA   ILE    279      0.0125     82.4771     90.1900
  1811 CA   SER    280      0.0208     83.7841     91.6400
  1817 CA   VAL    281      0.0252     84.4655     91.1100
  1824 CA   HIS    282      0.0184     83.4087     86.2900
  1834 CA   LEU    283      0.0203     83.7010     85.2000
  1842 CA   LEU    284      0.0428     87.2227     86.8500
  1850 CA   GLN    285      0.0472     87.9181     83.1700
  1859 CA   ARG    286      0.0446     87.5047     71.4200
  1870 CA   THR    287      0.0984     95.9365     58.5200
  1877 CA   GLN    288      0.1631    106.0872     56.5100
  1886 CA   PRO    289      0.2607    121.3925     57.0400
  1893 CA   GLY    290      0.3504    135.4572     58.6900
  1897 CA   ALA    291      0.1525    104.4178     56.4700
  1902 CA   ALA    292      0.0971     95.7416     58.2000
  1907 CA   PRO    293      0.0560     89.2954     58.2300
  1914 CA   CYS    294      0.0467     87.8371     57.5500
  1920 CA   LYS    295      0.0575     89.5264     53.2100
  1929 CA   GLN    296      0.0277     84.8553     56.1100
  1938 CA   SER    297      0.0170     83.1748     66.2200
  1944 CA   PHE    298      0.0161     83.0415     75.6200
  1955 CA   ARG    299      0.0136     82.6494     77.8100
  1966 CA   HIS    300      0.0212     83.8412     75.2600
  1976 CA   ALA    301      0.0289     85.0538     79.8900
  1981 CA   HIS    302      0.0267     84.6984     87.0200
  1991 CA   PRO    303      0.0248     84.4095     86.9700
  1998 CA   LEU    304      0.0343     85.8987     90.8000
  2006 CA   THR    305      0.0247     84.3939     92.2500
  2013 CA   GLY    306      0.0164     83.0815     90.9700
  2017 CA   HIS    307      0.0142     82.7420     92.3900
  2027 CA   ILE    308      0.0175     83.2655     95.0000
  2035 CA   VAL    309      0.0138     82.6769     94.9100
  2042 CA   ASN    310      0.0099     82.0721     93.4700
  2050 CA   LEU    311      0.0116     82.3348     96.5000
  2058 CA   ALA    312      0.0110     82.2400     97.2400
  2063 CA   ALA    313      0.0088     81.8993     96.7100
  2068 CA   PHE    314      0.0084     81.8264     96.8100
  2079 CA   SER    315      0.0100     82.0918     97.2300
  2085 CA   ASN    316      0.0084     81.8404     96.9700
  2093 CA   SER    317      0.0083     81.8121     97.0900
  2099 CA   CYS    318      0.0107     82.1929     96.5900
  2105 CA   LEU    319      0.0115     82.3265     95.9800
  2113 CA   ASN    320      0.0095     82.0093     91.7900
  2121 CA   PRO    321      0.0109     82.2197     92.2500
  2128 CA   LEU    322      0.0145     82.7857     91.6000
  2136 CA   ILE    323      0.0123     82.4385     90.8100
  2144 CA   TYR    324      0.0112     82.2648     84.9000
  2156 CA   SER    325      0.0150     82.8675     85.0300
  2162 CA   PHE    326      0.0260     84.5917     84.3000
  2173 CA   LEU    327      0.0170     83.1894     82.8500
  2181 CA   GLY    328      0.0165     83.1061     80.0300
  2185 CA   GLU    329      0.0226     84.0538     79.5700
  2194 CA   THR    330      0.0196     83.5882     80.7500
  2201 CA   PHE    331      0.0141     82.7225     83.1900
  2212 CA   ARG    332      0.0217     83.9221     86.7900
  2223 CA   ASP    333      0.0301     85.2288     86.3000
  2231 CA   LYS    334      0.0212     83.8358     85.9300
  2240 CA   LEU    335      0.0222     83.9929     88.8400
  2248 CA   ARG    336      0.0504     88.4215     89.6100
  2259 CA   LEU    337      0.0461     87.7385     90.0500
  2267 CA   TYR    338      0.0373     86.3674     89.2000
  2279 CA   ILE    339      0.0617     90.1904     89.2800
  2287 CA   GLU    340      0.0961     95.5891     87.9800
  2296 CA   GLN    341      0.0995     96.1115     85.3900
  2305 CA   LYS    342      0.1426    102.8744     82.5400
  2314 CA   THR    343      0.2138    114.0369     79.7300
  2321 CA   ASN    344      0.2892    125.8584     68.2100
  2329 CA   LEU    345      0.3719    138.8214     66.1400
  2337 CA   PRO    346      1.0178    240.0799     61.5800

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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.