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B-factor analysis for ID 22122720105119216

Overall B-factor prediction

Correlation= 0.787 for 350 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   MET      1      0.0670     53.1179     51.5900
    10 CA   GLU      2      0.0478     44.2892     39.7000
    19 CA   LEU      3      0.0200     31.5559     32.0700
    27 CA   ARG      4      0.0243     33.5267     34.9100
    38 CA   HIS      5      0.0345     38.2221     38.2300
    48 CA   THR      6      0.0244     33.5802     29.8500
    55 CA   PRO      7      0.0237     33.2627     29.7300
    62 CA   ALA      8      0.0193     31.2305     32.0900
    67 CA   ARG      9      0.0388     40.1688     28.6800
    78 CA   ASP     10      0.0291     35.7378     25.2200
    86 CA   LEU     11      0.0142     28.9060     25.5300
    94 CA   ASP     12      0.0178     30.5466     30.9000
   102 CA   LYS     13      0.0314     36.7735     26.8800
   111 CA   PHE     14      0.0208     31.9355     26.9100
   122 CA   ILE     15      0.0148     29.1608     25.4300
   130 CA   GLU     16      0.0283     35.3450     29.5700
   139 CA   ASP     17      0.0348     38.3280     27.1900
   147 CA   HIS     18      0.0256     34.1049     26.4300
   157 CA   LEU     19      0.0156     29.5386     27.7800
   165 CA   LEU     20      0.0194     31.2855     25.8600
   173 CA   PRO     21      0.0255     34.0572     27.1300
   180 CA   ASN     22      0.0384     39.9988     32.0000
   188 CA   THR     23      0.0654     52.3697     38.1500
   195 CA   CYS     24      0.0547     47.4667     36.3800
   201 CA   PHE     25      0.0273     34.8970     38.2200
   212 CA   ARG     26      0.0305     36.3852     42.7800
   223 CA   THR     27      0.0345     38.2168     37.2800
   230 CA   GLN     28      0.0262     34.3801     35.5800
   239 CA   VAL     29      0.0173     30.3304     28.9200
   246 CA   LYS     30      0.0230     32.9494     28.4700
   255 CA   GLU     31      0.0235     33.1615     33.0100
   264 CA   ALA     32      0.0165     29.9486     32.3700
   269 CA   ILE     33      0.0135     28.5739     38.9800
   277 CA   ASP     34      0.0208     31.9164     39.8900
   285 CA   ILE     35      0.0166     29.9920     38.8600
   293 CA   VAL     36      0.0118     27.7899     33.8200
   300 CA   CYS     37      0.0150     29.2789     36.1800
   306 CA   ARG     38      0.0234     33.0914     33.6200
   317 CA   PHE     39      0.0161     29.7497     31.0300
   328 CA   LEU     40      0.0133     28.5048     31.7800
   336 CA   LYS     41      0.0232     33.0196     38.7000
   345 CA   GLU     42      0.0327     37.3951     39.2600
   354 CA   ARG     43      0.0288     35.5874     35.9700
   365 CA   CYS     44      0.0209     31.9851     35.8200
   371 CA   PHE     45      0.0241     33.4343     52.2900
   382 CA   GLN     46      0.0422     41.7248     64.3100
   391 CA   GLY     47      0.0794     58.8073     74.2000
   395 CA   THR     48      0.0887     63.0681     73.9100
   402 CA   ALA     49      0.2413    133.0036     54.3000
   407 CA   ASP     50      0.1372     85.2868     59.3600
   415 CA   PRO     51      0.0647     52.0332     65.9800
   422 CA   VAL     52      0.0324     37.2218     59.8400
   429 CA   ARG     53      0.0248     33.7633     38.7700
   440 CA   VAL     54      0.0172     30.2720     27.8200
   447 CA   SER     55      0.0155     29.4715     30.3800
   453 CA   LYS     56      0.0139     28.7513     30.8600
   462 CA   VAL     57      0.0090     26.5216     26.5200
   469 CA   VAL     58      0.0091     26.5601     29.1900
   476 CA   LYS     59      0.0105     27.1982     18.6500
   485 CA   GLY     60      0.0107     27.3058     24.9200
   489 CA   GLY     61      0.0125     28.0972     27.4800
   493 CA   SER     62      0.0128     28.2765     22.2000
   499 CA   SER     63      0.0129     28.2951     29.1600
   505 CA   GLY     64      0.0122     27.9829     23.7000
   509 CA   LYS     65      0.0107     27.2788     26.1700
   518 CA   GLY     66      0.0125     28.1269     28.3100
   522 CA   THR     67      0.0109     27.3620     28.4500
   529 CA   THR     68      0.0130     28.3293     25.4800
   536 CA   LEU     69      0.0139     28.7742     23.9900
   544 CA   ARG     70      0.0196     31.3752     28.0600
   555 CA   GLY     71      0.0228     32.8302     34.1400
   559 CA   ARG     72      0.0205     31.7798     28.6900
   570 CA   SER     73      0.0152     29.3656     27.8500
   576 CA   ASP     74      0.0142     28.8836     28.7800
   584 CA   ALA     75      0.0117     27.7563     29.3300
   589 CA   ASP     76      0.0122     27.9637     30.7000
   597 CA   LEU     77      0.0082     26.1360     23.9400
   605 CA   VAL     78      0.0076     25.8624     29.9300
   612 CA   VAL     79      0.0080     26.0718     25.7100
   619 CA   PHE     80      0.0082     26.1384     27.8300
   630 CA   LEU     81      0.0126     28.1692     29.9000
   638 CA   THR     82      0.0200     31.5378     42.7400
   645 CA   LYS     83      0.0216     32.2780     42.1800
   654 CA   LEU     84      0.0156     29.5528     33.8100
   662 CA   THR     85      0.0196     31.3921     39.3600
   669 CA   SER     86      0.0166     29.9995     38.4900
   675 CA   PHE     87      0.0126     28.1585     36.0700
   686 CA   GLU     88      0.0189     31.0316     35.7700
   695 CA   ASP     89      0.0182     30.7107     34.4400
   703 CA   GLN     90      0.0127     28.2070     31.5900
   712 CA   LEU     91      0.0170     30.1715     33.7900
   720 CA   ARG     92      0.0246     33.6736     35.9600
   731 CA   ARG     93      0.0195     31.3408     37.9700
   742 CA   ARG     94      0.0152     29.3395     38.2100
   753 CA   GLY     95      0.0234     33.1310     33.7400
   757 CA   GLU     96      0.0254     34.0427     46.5700
   766 CA   PHE     97      0.0155     29.4694     35.5900
   777 CA   ILE     98      0.0163     29.8566     37.9000
   785 CA   GLN     99      0.0251     33.8962     46.9000
   794 CA   GLU    100      0.0216     32.3012     46.9200
   803 CA   ILE    101      0.0153     29.4025     42.5400
   811 CA   ARG    102      0.0201     31.5903     41.0100
   822 CA   ARG    103      0.0288     35.5951     41.0000
   833 CA   GLN    104      0.0237     33.2481     36.4500
   842 CA   LEU    105      0.0204     31.7474     40.8600
   850 CA   GLU    106      0.0319     37.0277     49.1400
   859 CA   ALA    107      0.0406     40.9956     39.9900
   864 CA   CYS    108      0.0341     38.0173     45.5500
   870 CA   GLN    109      0.0395     40.5122     53.0200
   879 CA   ARG    110      0.0641     51.7681     55.0700
   890 CA   GLU    111      0.0729     55.8061     41.6400
   899 CA   GLN    112      0.0779     58.1083     50.4700
   908 CA   LYS    113      0.0460     43.4556     47.9900
   917 CA   PHE    114      0.0343     38.0898     42.1700
   928 CA   LYS    115      0.0338     37.8692     46.2300
   937 CA   VAL    116      0.0280     35.2293     40.3300
   944 CA   THR    117      0.0347     38.2786     49.8900
   951 CA   PHE    118      0.0349     38.3653     47.7600
   962 CA   GLU    119      0.0600     49.8898     69.6200
   971 CA   VAL    120      0.1220     78.2933     98.6500
   978 CA   GLN    121      0.1399     86.5069    106.9400
   987 CA   SER    122      0.2420    133.3432    122.2800
   993 CA   PRO    123      0.2245    125.2834    123.7800
  1000 CA   ARG    124      0.1589     95.2341    108.6700
  1011 CA   ARG    125      0.1095     72.5779    103.6500
  1022 CA   GLU    126      0.1153     75.2188     93.2200
  1031 CA   ASN    127      0.0369     39.3028     65.8700
  1039 CA   PRO    128      0.0322     37.1686     62.0200
  1046 CA   ARG    129      0.0157     29.5717     41.7800
  1057 CA   ALA    130      0.0177     30.5031     42.7500
  1062 CA   LEU    131      0.0170     30.1773     34.8600
  1070 CA   SER    132      0.0205     31.8041     34.5200
  1076 CA   PHE    133      0.0209     31.9751     40.5000
  1087 CA   VAL    134      0.0231     32.9530     33.0700
  1094 CA   LEU    135      0.0212     32.1244     38.0300
  1102 CA   SER    136      0.0290     35.6925     43.3200
  1108 CA   SER    137      0.0360     38.8693     44.3100
  1114 CA   PRO    138      0.0727     55.7094     60.2500
  1121 CA   GLN    139      0.0607     50.2108     62.1100
  1130 CA   LEU    140      0.0375     39.5980     56.9200
  1138 CA   GLN    141      0.0567     48.4011     56.5000
  1147 CA   GLN    142      0.0439     42.5306     53.2400
  1156 CA   GLU    143      0.0291     35.7090     39.1400
  1165 CA   VAL    144      0.0203     31.6947     29.6700
  1172 CA   GLU    145      0.0162     29.8057     36.7600
  1181 CA   PHE    146      0.0132     28.4154     28.8300
  1192 CA   ASP    147      0.0135     28.5809     30.9000
  1200 CA   VAL    148      0.0099     26.9312     30.6000
  1207 CA   LEU    149      0.0097     26.8329     32.7300
  1215 CA   PRO    150      0.0088     26.4191     33.8100
  1222 CA   ALA    151      0.0086     26.3132     31.0600
  1227 CA   PHE    152      0.0091     26.5691     34.0900
  1238 CA   ASP    153      0.0104     27.1428     30.3800
  1246 CA   ALA    154      0.0104     27.1534     27.3600
  1251 CA   LEU    155      0.0124     28.0755     26.8400
  1259 CA   GLY    156      0.0182     30.7073     34.0000
  1263 CA   GLN    157      0.0546     47.3932     40.5100
  1272 CA   TRP    158      0.0279     35.1850     45.3500
  1286 CA   THR    159      0.0455     43.2316     55.6800
  1293 CA   PRO    160      0.0436     42.3754     62.1100
  1300 CA   GLY    161      0.0569     48.4743     56.9800
  1304 CA   TYR    162      0.0394     40.4678     39.3000
  1316 CA   LYS    163      0.0185     30.8817     29.5100
  1325 CA   PRO    164      0.0166     30.0146     31.0000
  1332 CA   ASN    165      0.0257     34.1639     25.8700
  1340 CA   PRO    166      0.0171     30.2051     30.1100
  1347 CA   GLU    167      0.0225     32.7127     30.8000
  1356 CA   ILE    168      0.0148     29.1723     29.7500
  1364 CA   TYR    169      0.0100     26.9522     27.9800
  1376 CA   VAL    170      0.0150     29.2580     32.6900
  1383 CA   GLN    171      0.0153     29.4115     30.3400
  1392 CA   LEU    172      0.0110     27.4131     26.7400
  1400 CA   ILE    173      0.0145     29.0213     24.5600
  1408 CA   LYS    174      0.0263     34.4586     29.0700
  1417 CA   GLU    175      0.0191     31.1398     34.4400
  1426 CA   CYS    176      0.0195     31.3396     35.0700
  1432 CA   LYS    177      0.0439     42.5311     41.9300
  1441 CA   SER    178      0.0498     45.2015     34.8400
  1447 CA   ARG    179      0.0408     41.0903     35.6200
  1458 CA   GLY    180      0.0488     44.7554     36.7400
  1462 CA   LYS    181      0.0208     31.9165     47.1900
  1471 CA   GLU    182      0.0162     29.8115     40.4900
  1480 CA   GLY    183      0.0146     29.0981     34.9200
  1484 CA   GLU    184      0.0141     28.8632     36.9300
  1493 CA   PHE    185      0.0091     26.5508     30.4000
  1504 CA   SER    186      0.0088     26.4247     26.3700
  1510 CA   THR    187      0.0081     26.1145     28.0300
  1517 CA   CYS    188      0.0072     25.6745     27.2100
  1523 CA   PHE    189      0.0059     25.1023     25.1500
  1534 CA   THR    190      0.0072     25.6721     28.0100
  1541 CA   GLU    191      0.0081     26.1170     23.4400
  1550 CA   LEU    192      0.0078     25.9800     19.8900
  1558 CA   GLN    193      0.0077     25.9100     24.1600
  1567 CA   ARG    194      0.0087     26.3532     24.7500
  1568 CA   ARG    194      0.0087     26.3537     24.7100
  1586 CA   ASP    195      0.0101     27.0180     27.8800
  1594 CA   PHE    196      0.0085     26.2778     25.8500
  1605 CA   LEU    197      0.0088     26.4051     26.7600
  1613 CA   ARG    198      0.0113     27.5820     26.3500
  1624 CA   ASN    199      0.0203     31.7125     29.8600
  1632 CA   ARG    200      0.0151     29.2893     24.5000
  1643 CA   PRO    201      0.0201     31.5785     23.0700
  1650 CA   THR    202      0.0215     32.2641     22.3600
  1657 CA   LYS    203      0.0147     29.1023     25.0800
  1666 CA   LEU    204      0.0100     26.9619     20.1100
  1674 CA   LYS    205      0.0092     26.5892     21.2400
  1683 CA   SER    206      0.0096     26.7888     24.2700
  1689 CA   LEU    207      0.0062     25.2459     20.1500
  1697 CA   ILE    208      0.0065     25.3729     22.4100
  1705 CA   ARG    209      0.0083     26.2000     25.3000
  1716 CA   LEU    210      0.0072     25.7094     19.9500
  1724 CA   VAL    211      0.0065     25.3747     25.0500
  1731 CA   LYS    212      0.0087     26.3529     25.6000
  1740 CA   HIS    213      0.0123     28.0068     20.4900
  1750 CA   TRP    214      0.0103     27.0920     17.7600
  1764 CA   TYR    215      0.0134     28.5338     22.9700
  1776 CA   GLN    216      0.0193     31.2409     25.3800
  1785 CA   THR    217      0.0230     32.9268     31.5100
  1792 CA   CYS    218      0.0236     33.2058     30.8600
  1798 CA   LYS    219      0.0369     39.2909     40.0900
  1807 CA   LYS    220      0.0564     48.2499     48.9800
  1816 CA   THR    221      0.0556     47.8663     41.8400
  1823 CA   HIS    222      0.0494     45.0372     43.8300
  1833 CA   GLY    223      0.0679     53.5077     41.6600
  1837 CA   ASN    224      0.0721     55.4372     43.4300
  1845 CA   LYS    225      0.0498     45.2270     39.8700
  1854 CA   LEU    226      0.0304     36.3052     28.4500
  1862 CA   PRO    227      0.0195     31.3288     20.7900
  1869 CA   PRO    228      0.0187     30.9426     24.5100
  1876 CA   GLN    229      0.0117     27.7302     29.3700
  1885 CA   TYR    230      0.0092     26.5893     23.1600
  1897 CA   ALA    231      0.0091     26.5781     23.6500
  1902 CA   LEU    232      0.0071     25.6639     24.0300
  1910 CA   GLU    233      0.0063     25.2664     23.6600
  1919 CA   LEU    234      0.0059     25.0835     18.5700
  1927 CA   LEU    235      0.0060     25.1425     22.5900
  1935 CA   THR    236      0.0052     24.7577     24.6200
  1942 CA   VAL    237      0.0073     25.7329     22.6500
  1949 CA   TYR    238      0.0073     25.7323     27.2300
  1961 CA   ALA    239      0.0092     26.5972     24.4100
  1966 CA   TRP    240      0.0095     26.7440     27.3000
  1980 CA   GLU    241      0.0139     28.7702     24.1800
  1989 CA   GLN    242      0.0173     30.3015     28.2400
  1998 CA   GLY    243      0.0182     30.7432     31.0700
  2002 CA   SER    244      0.0200     31.5364     31.1000
  2008 CA   ARG    245      0.0263     34.4584     28.6900
  2019 CA   LYS    246      0.0367     39.2290     31.4300
  2028 CA   THR    247      0.0366     39.1622     34.6000
  2035 CA   ASP    248      0.0449     42.9752     35.5900
  2043 CA   PHE    249      0.0201     31.5981     27.4200
  2054 CA   SER    250      0.0180     30.6250     24.9700
  2060 CA   THR    251      0.0106     27.2473     26.2000
  2067 CA   ALA    252      0.0105     27.2200     23.8300
  2072 CA   GLN    253      0.0125     28.1247     23.3700
  2081 CA   GLY    254      0.0090     26.5218     23.6700
  2085 CA   PHE    255      0.0071     25.6485     18.5400
  2096 CA   GLN    256      0.0093     26.6496     23.1900
  2105 CA   THR    257      0.0093     26.6629     25.6500
  2112 CA   VAL    258      0.0075     25.8040     24.0400
  2119 CA   LEU    259      0.0101     27.0048     27.8500
  2127 CA   GLU    260      0.0132     28.4224     26.7800
  2136 CA   LEU    261      0.0107     27.3102     23.8500
  2144 CA   VAL    262      0.0120     27.9010     25.6500
  2151 CA   LEU    263      0.0182     30.7325     28.1700
  2159 CA   LYS    264      0.0207     31.8774     26.0200
  2168 CA   HIS    265      0.0173     30.3320     32.8800
  2178 CA   GLN    266      0.0260     34.3100     35.6000
  2187 CA   LYS    267      0.0337     37.8206     35.0000
  2196 CA   LEU    268      0.0176     30.4416     25.8900
  2204 CA   CYS    269      0.0122     27.9897     29.6400
  2210 CA   ILE    270      0.0097     26.8447     24.0900
  2218 CA   PHE    271      0.0090     26.5051     28.2300
  2229 CA   TRP    272      0.0083     26.2048     26.6600
  2243 CA   GLU    273      0.0117     27.7324     30.6400
  2252 CA   ALA    274      0.0122     27.9605     23.7500
  2257 CA   TYR    275      0.0091     26.5558     28.5400
  2269 CA   TYR    276      0.0095     26.7607     29.0300
  2281 CA   ASP    277      0.0183     30.7569     36.1700
  2289 CA   PHE    278      0.0227     32.7815     38.3100
  2300 CA   THR    279      0.0436     42.3840     47.1700
  2307 CA   ASN    280      0.0330     37.5167     35.5300
  2315 CA   PRO    281      0.0395     40.4790     41.5600
  2322 CA   VAL    282      0.0285     35.4670     35.5400
  2329 CA   VAL    283      0.0152     29.3325     24.1400
  2336 CA   GLY    284      0.0194     31.2942     31.4900
  2340 CA   ARG    285      0.0278     35.1455     36.4500
  2351 CA   CYS    286      0.0185     30.8641     31.5500
  2357 CA   MET    287      0.0141     28.8636     29.1800
  2365 CA   LEU    288      0.0218     32.3822     33.9000
  2373 CA   GLN    289      0.0225     32.6839     34.9100
  2382 CA   GLN    290      0.0153     29.3972     32.1000
  2391 CA   LEU    291      0.0176     30.4433     30.4100
  2399 CA   LYS    292      0.0334     37.6772     33.9800
  2408 CA   LYS    293      0.0236     33.1881     29.2900
  2417 CA   PRO    294      0.0303     36.2860     28.8100
  2424 CA   ARG    295      0.0208     31.9236     26.2700
  2435 CA   PRO    296      0.0163     29.8792     25.3300
  2442 CA   VAL    297      0.0120     27.9000     26.9000
  2449 CA   ILE    298      0.0095     26.7558     22.7500
  2457 CA   LEU    299      0.0080     26.0704     25.6500
  2465 CA   ASP    300      0.0074     25.7894     26.6400
  2473 CA   PRO    301      0.0068     25.4988     20.1200
  2480 CA   ALA    302      0.0063     25.2519     24.8500
  2485 CA   ASP    303      0.0068     25.5225     25.0500
  2493 CA   PRO    304      0.0075     25.8158     23.9700
  2500 CA   THR    305      0.0089     26.4469     25.0900
  2507 CA   GLY    306      0.0099     26.9468     25.2200
  2511 CA   ASN    307      0.0117     27.7504     30.7300
  2519 CA   VAL    308      0.0116     27.7025     27.0300
  2526 CA   GLY    309      0.0139     28.7744     30.0600
  2530 CA   GLY    310      0.0247     33.7000     32.3100
  2534 CA   GLY    311      0.0349     38.3690     34.6200
  2538 CA   ASP    312      0.0372     39.4475     31.1900
  2546 CA   THR    313      0.0387     40.1272     29.4800
  2553 CA   HIS    314      0.0503     45.4674     33.4600
  2563 CA   SER    315      0.0305     36.3509     33.1700
  2569 CA   TRP    316      0.0218     32.3618     28.9300
  2583 CA   GLN    317      0.0341     38.0239     27.0000
  2592 CA   ARG    318      0.0324     37.2602     30.1400
  2603 CA   LEU    319      0.0195     31.3291     30.1300
  2611 CA   ALA    320      0.0201     31.6120     26.2700
  2616 CA   GLN    321      0.0292     35.7612     37.0300
  2625 CA   GLU    322      0.0227     32.7699     32.9400
  2634 CA   ALA    323      0.0161     29.7837     33.8600
  2639 CA   ARG    324      0.0273     34.9169     34.3400
  2650 CA   VAL    325      0.0266     34.5787     33.7100
  2657 CA   TRP    326      0.0183     30.7764     26.9100
  2671 CA   LEU    327      0.0190     31.1003     34.5300
  2679 CA   GLY    328      0.0270     34.7843     33.4800
  2683 CA   TYR    329      0.0247     33.7148     28.9800
  2695 CA   PRO    330      0.0236     33.2180     32.0400
  2702 CA   CYS    331      0.0148     29.1585     29.0600
  2708 CA   CYS    332      0.0153     29.3960     29.2200
  2714 CA   LYS    333      0.0289     35.6574     36.8600
  2723 CA   ASN    334      0.0430     42.1067     26.9000
  2731 CA   LEU    335      0.1302     82.0923     36.4600
  2739 CA   ASP    336      0.1611     96.2376     43.7000
  2747 CA   GLY    337      0.0924     64.7352     38.5600
  2751 CA   SER    338      0.0777     58.0035     30.9400
  2757 CA   LEU    339      0.0330     37.5238     32.4100
  2765 CA   VAL    340      0.0291     35.7330     31.3300
  2772 CA   GLY    341      0.0244     33.5696     26.7100
  2776 CA   ALA    342      0.0177     30.5053     31.3000
  2781 CA   TRP    343      0.0224     32.6760     36.2500
  2795 CA   THR    344      0.0433     42.2536     49.8600
  2802 CA   MET    345      0.0316     36.8926     42.7000
  2810 CA   LEU    346      0.0462     43.5591     60.9200
  2818 CA   GLN    347      0.1112     73.3421     74.1500
  2827 CA   LYS    348      0.0616     50.6463     72.2700
  2836 CA   ILE    349      0.2483    136.2311     86.1900

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: October 18th, 2018.