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B-factor analysis for ID 22042311551780060

Overall B-factor prediction

Correlation= 0.540 for 322 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   GLN      7      0.1768     69.9269     68.6700
    11 CA   PHE      8      0.0736     40.7248     46.7500
    22 CA   ASP      9      0.0439     32.3134     42.5800
    30 CA   PRO     10      0.0292     28.1699     37.5300
    37 CA   ILE     11      0.0151     24.1556     30.9400
    45 CA   LEU     12      0.0128     23.5136     26.7200
    53 CA   VAL     13      0.0089     22.4242     26.8100
    60 CA   ALA     14      0.0129     23.5543     26.4400
    65 CA   ASP     15      0.0207     25.7624     25.6500
    73 CA   ILE     16      0.0288     28.0541     31.0800
    81 CA   GLY     17      0.0552     35.5050     43.9000
    85 CA   GLY     18      0.0801     42.5727     44.6900
    89 CA   THR     19      0.1150     52.4249     53.5600
    96 CA   ASN     20      0.0777     41.8691     48.1900
   104 CA   ALA     21      0.0412     31.5375     37.6900
   109 CA   ARG     22      0.0299     28.3485     31.7200
   120 CA   PHE     23      0.0218     26.0581     26.5400
   131 CA   ALA     24      0.0199     25.5340     24.5000
   136 CA   LEU     25      0.0193     25.3627     25.8500
   144 CA   ILE     26      0.0176     24.8766     28.6400
   152 CA   THR     27      0.0308     28.6109     33.3400
   159 CA   ALA     28      0.0350     29.7940     38.7300
   164 CA   PHE     29      0.0370     30.3616     32.8400
   175 CA   ASP     30      0.0518     34.5580     38.2300
   183 CA   ALA     31      0.1201     53.8914     46.9700
   188 CA   ALA     32      0.1600     65.1645     51.0600
   193 CA   LYS     33      0.0812     42.8843     34.9500
   202 CA   ASN     34      0.0470     33.1879     30.6200
   210 CA   GLU     35      0.0266     27.4195     33.4500
   219 CA   PHE     36      0.0211     25.8588     27.6100
   230 CA   VAL     37      0.0286     27.9752     27.9600
   237 CA   ILE     38      0.0231     26.4354     28.6300
   245 CA   GLU     39      0.0384     30.7606     27.3400
   254 CA   TYR     40      0.0443     32.4254     28.0700
   266 CA   ASN     41      0.0360     30.0795     35.3400
   274 CA   HIS     42      0.0444     32.4488     38.1300
   284 CA   THR     43      0.0588     36.5292     32.9200
   291 CA   PHE     44      0.0718     40.2060     41.0300
   302 CA   PRO     45      0.0960     47.0625     39.9300
   309 CA   SER     46      0.0763     41.4936     34.0600
   315 CA   ALA     47      0.1210     54.1251     46.4700
   320 CA   ASP     48      0.1164     52.8274     42.7000
   328 CA   PHE     49      0.0829     43.3531     39.7900
   339 CA   GLY     50      0.0924     46.0420     47.5000
   343 CA   SER     51      0.0632     37.7836     33.1700
   349 CA   LEU     52      0.0406     31.3931     38.3800
   357 CA   GLN     53      0.0442     32.4004     35.4200
   366 CA   ASN     54      0.0585     36.4570     33.4700
   374 CA   ALA     55      0.0469     33.1597     27.6100
   379 CA   THR     56      0.0346     29.6968     31.3600
   386 CA   ARG     57      0.0527     34.8090     34.3800
   397 CA   HIS     58      0.0603     36.9509     25.3000
   407 CA   TYR     59      0.0437     32.2725     25.7400
   419 CA   LEU     60      0.0430     32.0477     26.1400
   427 CA   SER     61      0.0803     42.6275     30.4900
   433 CA   THR     62      0.0799     42.4994     23.0000
   440 CA   VAL     63      0.0643     38.0838     27.0700
   447 CA   PRO     64      0.0845     43.7973     24.2000
   454 CA   HIS     65      0.0980     47.6251     26.3900
   464 CA   ILE     66      0.0623     37.5342     29.7600
   472 CA   LYS     67      0.0549     35.4246     39.9800
   481 CA   PRO     68      0.0339     29.4894     38.0900
   488 CA   VAL     69      0.0366     30.2559     33.3400
   495 CA   ARG     70      0.0232     26.4652     36.4700
   506 CA   ALA     71      0.0129     23.5373     30.3100
   511 CA   CYS     72      0.0096     22.5963     21.7700
   517 CA   LEU     73      0.0106     22.8783     22.9000
   525 CA   ALA     74      0.0146     24.0204     21.7700
   530 CA   VAL     75      0.0252     27.0218     30.5500
   537 CA   ALA     76      0.0417     31.7019     36.8400
   542 CA   GLY     77      0.0590     36.5768     46.4200
   546 CA   PRO     78      0.0736     40.7160     60.8300
   553 CA   ILE     79      0.0647     38.1912     46.9200
   561 CA   LYS     80      0.1086     50.6242     71.5400
   570 CA   ALA     81      0.1886     73.2696     84.3600
   575 CA   GLY     82      0.0932     46.2713     81.6200
   579 CA   GLN     83      0.0689     39.4031     55.9400
   588 CA   VAL     84      0.0540     35.1728     42.5800
   595 CA   HIS     85      0.0748     41.0510     51.3300
   605 CA   LEU     86      0.0746     41.0094     48.5000
   613 CA   THR     87      0.1293     56.4730     61.2900
   620 CA   ASN     88      0.1506     62.4979     56.1300
   628 CA   LEU     89      0.0975     47.4957     50.6900
   636 CA   GLY     90      0.1046     49.5000     51.0900
   640 CA   TRP     91      0.0674     38.9552     46.1900
   654 CA   HIS     92      0.0709     39.9656     48.9300
   664 CA   PHE     93      0.0553     35.5395     48.3100
   675 CA   SER     94      0.0596     36.7711     58.9800
   681 CA   VAL     95      0.0441     32.3610     55.7700
   688 CA   SER     96      0.0646     38.1816     62.2500
   694 CA   GLU     97      0.0648     38.2175     51.6600
   703 CA   PHE     98      0.0405     31.3624     45.6700
   714 CA   LYS     99      0.0413     31.5702     43.9100
   723 CA   GLN    100      0.0694     39.5303     61.7200
   732 CA   ALA    101      0.0581     36.3427     45.0500
   737 CA   PHE    102      0.0476     33.3511     39.3700
   748 CA   SER    103      0.0598     36.8098     43.8400
   754 CA   PHE    104      0.0404     31.3328     35.6700
   765 CA   LEU    105      0.0546     35.3328     40.2400
   773 CA   GLN    106      0.0348     29.7336     45.5200
   782 CA   LEU    107      0.0218     26.0589     41.7200
   790 CA   GLU    108      0.0189     25.2532     34.9700
   799 CA   VAL    109      0.0162     24.4629     27.0800
   806 CA   ILE    110      0.0174     24.8253     27.7900
   814 CA   ASN    111      0.0235     26.5434     25.2100
   822 CA   ASP    112      0.0227     26.3022     29.9100
   830 CA   PHE    113      0.0186     25.1541     25.4400
   841 CA   ALA    114      0.0182     25.0358     25.1700
   846 CA   ALA    115      0.0151     24.1744     22.0800
   851 CA   PHE    116      0.0143     23.9506     22.3500
   862 CA   ALA    117      0.0165     24.5618     24.5900
   867 CA   TYR    118      0.0141     23.8911     24.1100
   879 CA   ALA    119      0.0143     23.9510     23.8900
   884 CA   ALA    120      0.0147     24.0502     26.9700
   889 CA   PRO    121      0.0205     25.6826     28.4300
   896 CA   TYR    122      0.0183     25.0804     32.0800
   908 CA   LEU    123      0.0235     26.5311     34.5000
   916 CA   ASP    124      0.0343     29.6061     55.7300
   924 CA   SER    125      0.0731     40.5686     76.0400
   930 CA   ASN    126      0.1017     48.6590     75.8800
   938 CA   GLN    127      0.0396     31.1065     43.0300
   947 CA   ASN    128      0.0323     29.0324     31.3400
   955 CA   VAL    129      0.0254     27.0804     29.3700
   962 CA   VAL    130      0.0233     26.4793     30.8700
   969 CA   ILE    131      0.0161     24.4422     25.7800
   977 CA   LYS    132      0.0171     24.7327     26.9600
   986 CA   ALA    133      0.0401     31.2435     31.8200
   991 CA   GLY    134      0.0494     33.8725     48.5300
   995 CA   GLN    135      0.0520     34.6166     45.0700
  1004 CA   ALA    136      0.0463     32.9845     33.8900
  1009 CA   ASP    137      0.0453     32.7191     33.5400
  1017 CA   GLU    138      0.0510     34.3264     42.4900
  1026 CA   ASN    139      0.0581     36.3324     36.4500
  1034 CA   SER    140      0.0315     28.8092     25.9300
  1040 CA   ASN    141      0.0199     25.5357     20.1600
  1048 CA   ILE    142      0.0152     24.1849     20.5400
  1056 CA   ALA    143      0.0126     23.4465     23.4400
  1061 CA   VAL    144      0.0126     23.4686     23.3600
  1068 CA   MET    145      0.0135     23.7070     22.4600
  1076 CA   GLY    146      0.0163     24.5087     26.3400
  1080 CA   PRO    147      0.0199     25.5215     25.7700
  1087 CA   GLY    148      0.0331     29.2472     33.5800
  1091 CA   THR    149      0.0763     41.4853     32.3900
  1098 CA   GLY    150      0.0453     32.7237     25.1700
  1102 CA   PHE    151      0.0236     26.5768     21.4500
  1113 CA   GLY    152      0.0244     26.7891     24.5400
  1117 CA   ALA    153      0.0176     24.8595     18.1500
  1122 CA   ALA    154      0.0170     24.7021     20.4200
  1127 CA   CYS    155      0.0180     24.9914     18.8100
  1133 CA   LEU    156      0.0181     25.0042     24.6900
  1141 CA   VAL    157      0.0321     28.9722     22.1400
  1148 CA   ARG    158      0.0377     30.5748     22.3100
  1159 CA   THR    159      0.1169     52.9635     23.3000
  1166 CA   ALA    160      0.2800     99.1148     33.3500
  1171 CA   GLN    161      0.3477    118.2773     30.5100
  1180 CA   SER    162      0.2636     94.4792     26.2500
  1186 CA   SER    163      0.0717     40.1696     23.2000
  1192 CA   ALA    164      0.0604     36.9774     21.0800
  1197 CA   VAL    165      0.0246     26.8680     23.2500
  1204 CA   LEU    166      0.0272     27.5835     19.6200
  1212 CA   SER    167      0.0299     28.3421     23.7600
  1218 CA   SER    168      0.0348     29.7267     23.6600
  1224 CA   GLU    169      0.0708     39.9209     21.7700
  1233 CA   GLY    170      0.0344     29.6386     21.7100
  1237 CA   GLY    171      0.0304     28.4899     21.9500
  1241 CA   HIS    172      0.0407     31.4130     21.5500
  1251 CA   ILE    173      0.0390     30.9293     21.1000
  1259 CA   SER    174      0.0421     31.7984     23.6500
  1265 CA   LEU    175      0.0252     27.0296     23.1100
  1273 CA   ALA    176      0.0277     27.7387     22.1500
  1278 CA   ALA    177      0.0332     29.2745     29.4900
  1283 CA   VAL    178      0.0376     30.5231     27.7400
  1290 CA   THR    179      0.0530     34.8897     32.6600
  1297 CA   ASP    180      0.0822     43.1454     29.7100
  1305 CA   LEU    181      0.0395     31.0745     33.1300
  1313 CA   ASP    182      0.0269     27.5168     31.4100
  1321 CA   ALA    183      0.0456     32.7937     33.4800
  1326 CA   LYS    184      0.0513     34.4233     34.8000
  1335 CA   LEU    185      0.0303     28.4578     31.2800
  1343 CA   LEU    186      0.0343     29.5882     30.5600
  1351 CA   ILE    187      0.0559     35.7050     30.3200
  1359 CA   GLU    188      0.0498     33.9761     34.7700
  1368 CA   LEU    189      0.0384     30.7495     30.9800
  1376 CA   ARG    190      0.0564     35.8399     34.1300
  1387 CA   LYS    191      0.0815     42.9602     40.9300
  1396 CA   GLU    192      0.0793     42.3275     36.3500
  1405 CA   HIS    193      0.0676     39.0157     33.9300
  1415 CA   PRO    194      0.0903     45.4378     32.1600
  1422 CA   HIS    195      0.0654     38.3966     27.4900
  1432 CA   VAL    196      0.0388     30.8686     26.0100
  1439 CA   SER    197      0.0290     28.0939     24.0300
  1445 CA   LEU    198      0.0194     25.3900     22.2300
  1453 CA   GLU    199      0.0254     27.0825     22.6600
  1462 CA   THR    200      0.0272     27.5871     26.9300
  1469 CA   VAL    201      0.0168     24.6349     24.0300
  1476 CA   PHE    202      0.0151     24.1710     23.7900
  1487 CA   SER    203      0.0256     27.1311     22.0100
  1493 CA   GLY    204      0.0379     30.6290     29.1200
  1497 CA   PRO    205      0.0439     32.3275     26.2700
  1504 CA   GLY    206      0.0279     27.7948     26.2000
  1508 CA   ILE    207      0.0260     27.2588     22.0000
  1516 CA   ALA    208      0.0376     30.5465     27.8600
  1521 CA   HIS    209      0.0324     29.0691     28.4600
  1531 CA   LEU    210      0.0221     26.1440     21.7600
  1539 CA   TYR    211      0.0320     28.9408     29.0500
  1551 CA   LYS    212      0.0437     32.2546     31.9500
  1560 CA   ALA    213      0.0367     30.2919     34.6000
  1565 CA   MET    214      0.0329     29.2127     28.1800
  1573 CA   ALA    215      0.0524     34.7208     41.0900
  1578 CA   ALA    216      0.0652     38.3315     38.6500
  1583 CA   VAL    217      0.0586     36.4711     50.3500
  1590 CA   ASN    218      0.0764     41.5204     43.2600
  1598 CA   GLY    219      0.1350     58.1087     51.1100
  1602 CA   ILE    220      0.1138     52.0970     65.5300
  1610 CA   THR    221      0.1563     64.1171     73.6900
  1617 CA   ALA    222      0.0867     44.4231     59.6400
  1622 CA   LYS    223      0.1151     52.4775     66.5000
  1631 CA   HIS    224      0.1433     60.4415     64.2500
  1641 CA   LEU    225      0.0838     43.5938     38.2300
  1649 CA   ASP    226      0.0826     43.2689     39.3100
  1657 CA   ALA    227      0.0591     36.6178     33.9600
  1662 CA   ALA    228      0.0929     46.1816     41.8300
  1667 CA   GLN    229      0.0917     45.8522     40.8900
  1676 CA   ILE    230      0.0554     35.5794     32.2300
  1684 CA   SER    231      0.0627     37.6316     41.1400
  1690 CA   ASN    232      0.0964     47.1650     43.4000
  1698 CA   LEU    233      0.0871     44.5313     38.3600
  1706 CA   ALA    234      0.0675     38.9933     36.9400
  1711 CA   ASN    235      0.1130     51.8566     47.7000
  1719 CA   THR    236      0.1634     66.1392     43.7100
  1726 CA   GLY    237      0.1451     60.9394     50.9000
  1730 CA   GLU    238      0.1498     62.2826     48.2700
  1739 CA   CYS    239      0.0819     43.0767     41.7900
  1745 CA   GLU    240      0.0789     42.2152     50.9500
  1754 CA   VAL    241      0.0466     33.0723     41.2200
  1761 CA   CYS    242      0.0402     31.2733     37.3400
  1767 CA   ASP    243      0.0396     31.1089     34.1900
  1775 CA   ALA    244      0.0331     29.2514     35.6100
  1780 CA   THR    245      0.0212     25.9006     34.4000
  1787 CA   LEU    246      0.0204     25.6616     28.0500
  1795 CA   ASN    247      0.0173     24.7934     30.6700
  1803 CA   GLN    248      0.0134     23.6872     32.3700
  1812 CA   PHE    249      0.0104     22.8380     26.1100
  1823 CA   CYS    250      0.0103     22.8003     26.6600
  1829 CA   ASP    251      0.0113     23.0801     23.1200
  1837 CA   TRP    252      0.0098     22.6652     27.3800
  1851 CA   LEU    253      0.0078     22.0930     21.3400
  1859 CA   GLY    254      0.0090     22.4404     22.0300
  1863 CA   SER    255      0.0109     22.9884     21.8700
  1869 CA   ALA    256      0.0105     22.8642     18.8500
  1874 CA   ALA    257      0.0096     22.6213     25.1800
  1879 CA   GLY    258      0.0111     23.0267     20.2000
  1883 CA   ASP    259      0.0128     23.5215     20.9400
  1891 CA   LEU    260      0.0127     23.4907     19.7000
  1899 CA   ALA    261      0.0131     23.5867     22.4100
  1904 CA   LEU    262      0.0187     25.1741     22.1600
  1912 CA   ALA    263      0.0209     25.7988     15.8300
  1917 CA   TYR    264      0.0182     25.0313     22.4800
  1929 CA   GLY    265      0.0211     25.8520     21.4800
  1933 CA   ALA    266      0.0162     24.4731     20.7500
  1938 CA   LEU    267      0.0214     25.9483     23.3600
  1946 CA   GLY    268      0.0216     26.0044     24.8600
  1950 CA   GLY    269      0.0145     23.9896     24.2300
  1954 CA   LEU    270      0.0114     23.1068     25.0000
  1962 CA   PHE    271      0.0117     23.2044     22.4800
  1973 CA   ILE    272      0.0125     23.4312     24.2400
  1981 CA   GLY    273      0.0191     25.2950     26.9200
  1985 CA   GLY    274      0.0256     27.1304     25.0600
  1989 CA   GLY    275      0.0435     32.2145     31.5900
  1993 CA   ILE    276      0.0309     28.6233     29.2700
  2001 CA   LEU    277      0.0200     25.5604     30.6100
  2009 CA   PRO    278      0.0287     28.0105     32.3000
  2016 CA   ARG    279      0.0506     34.2059     28.0900
  2027 CA   MET    280      0.0291     28.1143     34.5300
  2035 CA   GLN    281      0.0297     28.3072     34.1600
  2044 CA   SER    282      0.0363     30.1769     38.2600
  2050 CA   ARG    283      0.0237     26.5872     30.3300
  2061 CA   LEU    284      0.0170     24.6975     32.5400
  2069 CA   LEU    285      0.0270     27.5285     29.0100
  2077 CA   GLU    286      0.0398     31.1632     34.6300
  2086 CA   SER    287      0.0229     26.3752     26.8600
  2092 CA   ARG    288      0.0228     26.3324     27.5500
  2103 CA   PHE    289      0.0120     23.2835     26.2600
  2114 CA   VAL    290      0.0157     24.3430     23.8500
  2121 CA   GLU    291      0.0282     27.8705     28.8900
  2130 CA   ARG    292      0.0170     24.6987     23.1300
  2141 CA   PHE    293      0.0139     23.8243     26.1300
  2152 CA   SER    294      0.0201     25.5797     22.2500
  2158 CA   GLN    295      0.0286     27.9986     24.4800
  2167 CA   LYS    296      0.0337     29.4230     23.9200
  2176 CA   GLY    297      0.1795     70.6853     25.2000
  2180 CA   ILE    298      0.1500     62.3467     22.1500
  2188 CA   MET    299      0.0547     35.3618     23.9600
  2196 CA   SER    300      0.0435     32.1964     27.3700
  2202 CA   GLN    301      0.0545     35.3067     26.5700
  2211 CA   TYR    302      0.0347     29.7144     22.7200
  2223 CA   ASN    303      0.0204     25.6714     23.2700
  2231 CA   GLY    304      0.0285     27.9494     23.1400
  2235 CA   GLN    305      0.0308     28.5957     24.1800
  2244 CA   VAL    306      0.0190     25.2738     21.2600
  2251 CA   PRO    307      0.0179     24.9607     26.3800
  2258 CA   VAL    308      0.0135     23.7062     19.0000
  2265 CA   THR    309      0.0159     24.3804     21.6700
  2272 CA   LEU    310      0.0169     24.6645     23.4200
  2280 CA   VAL    311      0.0197     25.4540     25.6800
  2287 CA   THR    312      0.0269     27.5065     40.8400
  2294 CA   GLN    313      0.0360     30.0931     43.9200
  2303 CA   ASP    314      0.0509     34.2978     58.6500
  2311 CA   ASN    315      0.0222     26.1786     34.6000
  2319 CA   ILE    316      0.0176     24.8608     25.6600
  2327 CA   PRO    317      0.0161     24.4564     24.3800
  2334 CA   LEU    318      0.0118     23.2458     23.8800
  2342 CA   ILE    319      0.0120     23.2784     25.8500
  2350 CA   GLY    320      0.0114     23.1184     23.6200
  2354 CA   ALA    321      0.0085     22.3025     23.7400
  2359 CA   ALA    322      0.0091     22.4656     23.7400
  2364 CA   ALA    323      0.0128     23.5182     22.7800
  2369 CA   CYS    324      0.0137     23.7569     25.9000
  2375 CA   LEU    325      0.0158     24.3607     32.0000
  2383 CA   HIS    326      0.0202     25.6049     38.8700
  2393 CA   ASN    327      0.0321     28.9623     41.3100
  2401 CA   SER    328      0.0499     34.0238     35.7600

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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.