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***  7RE6-AK  ***

B-factor analysis for ID 22100400203998843

Overall B-factor prediction

Correlation= 0.737 for 348 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   SER      1      0.0254     39.5041     32.0500
    12 CA   VAL      2      0.0114     24.3291     20.4600
    28 CA   ASP      3      0.0214     35.2294     18.9700
    40 CA   GLN      4      0.0227     36.6088     20.3800
    57 CA   ALA      5      0.0196     33.2795     21.6300
    67 CA   THR      6      0.0103     23.1733     17.1100
    81 CA   LEU      7      0.0092     22.0337     17.2200
   100 CA   ASP      8      0.0135     26.6741     22.0000
   112 CA   LYS      9      0.0101     22.9627     20.8200
   134 CA   LEU     10      0.0059     18.3976     17.6200
   153 CA   GLU     11      0.0082     20.9184     21.0800
   168 CA   ALA     12      0.0103     23.1440     23.4400
   178 CA   GLY     13      0.0065     19.1223     23.2400
   185 CA   PHE     14      0.0061     18.6028     21.9000
   205 CA   LYS     15      0.0119     24.9004     25.9900
   227 CA   LYS     16      0.0104     23.2499     27.2800
   249 CA   LEU     17      0.0076     20.2535     23.9100
   268 CA   GLN     18      0.0109     23.8802     27.0600
   285 CA   ASP     19      0.0183     31.8703     32.3100
   297 CA   ALA     20      0.0160     29.3957     38.6300
   307 CA   LYS     21      0.0270     41.2516     35.7400
   329 CA   ASP     22      0.0315     46.1133     44.1600
   341 CA   CYS     23      0.0134     26.5314     34.4800
   352 CA   LYS     24      0.0156     28.8639     30.6800
   374 CA   SER     25      0.0066     19.1775     19.7700
   385 CA   LEU     26      0.0050     17.4815     16.1300
   404 CA   LEU     27      0.0039     16.2924     18.9500
   423 CA   LYS     28      0.0054     17.9124     20.9300
   445 CA   LYS     29      0.0069     19.5157     19.7600
   467 CA   TYR     30      0.0050     17.4604     19.7200
   488 CA   LEU     31      0.0041     16.5221     19.5100
   507 CA   THR     32      0.0066     19.2252     25.0500
   521 CA   LYS     33      0.0099     22.7070     21.5100
   543 CA   GLU     34      0.0112     24.2072     21.4000
   558 CA   ILE     35      0.0053     17.8063     17.4500
   577 CA   PHE     36      0.0043     16.7307     17.5900
   597 CA   ASP     37      0.0076     20.2995     18.7700
   609 CA   ARG     38      0.0077     20.3556     20.4900
   633 CA   LEU     39      0.0041     16.4639     18.1500
   652 CA   LYS     40      0.0046     17.0371     15.8100
   674 CA   THR     41      0.0068     19.3541     18.0500
   688 CA   ARG     42      0.0056     18.1233     17.5000
   712 CA   LYS     43      0.0055     17.9803     19.2400
   734 CA   THR     44      0.0050     17.4523     15.9100
   748 CA   ALA     45      0.0115     24.5235     22.4400
   758 CA   MET     46      0.0072     19.8522     18.5400
   775 CA   GLY     47      0.0071     19.7748     20.1600
   782 CA   ALA     48      0.0036     15.8917     16.4900
   792 CA   THR     49      0.0033     15.6286     16.1600
   806 CA   LEU     50      0.0024     14.5949     15.1500
   825 CA   LEU     51      0.0028     15.0799     16.0200
   844 CA   ASP     52      0.0025     14.6958     14.9000
   856 CA   VAL     53      0.0017     13.8752     14.1700
   872 CA   ILE     54      0.0021     14.3569     15.3100
   891 CA   GLN     55      0.0031     15.3870     17.6300
   908 CA   SER     56      0.0036     15.9465     16.6000
   919 CA   GLY     57      0.0043     16.6736     17.6200
   926 CA   VAL     58      0.0049     17.3115     19.0300
   942 CA   GLU     59      0.0071     19.7597     21.6200
   957 CA   ASN     60      0.0080     20.6715     20.6700
   971 CA   LEU     61      0.0090     21.7639     22.6600
   990 CA   ASP     62      0.0120     24.9939     22.9900
  1002 CA   SER     63      0.0079     20.5542     20.7200
  1013 CA   GLY     64      0.0089     21.6281     18.1500
  1020 CA   VAL     65      0.0044     16.7499     17.5800
  1036 CA   GLY     66      0.0035     15.8731     18.0000
  1043 CA   VAL     67      0.0020     14.1575     16.5600
  1059 CA   TYR     68      0.0018     13.9537     12.6000
  1080 CA   ALA     69      0.0015     13.6904     14.4400
  1090 CA   PRO     70      0.0016     13.7540     14.9100
  1104 CA   ASP     71      0.0019     14.1186     14.9500
  1116 CA   ALA     72      0.0021     14.2715     15.2800
  1126 CA   GLU     73      0.0036     15.9853     15.1900
  1141 CA   SER     74      0.0022     14.4220     12.6100
  1152 CA   TYR     75      0.0020     14.1886     12.6900
  1173 CA   THR     76      0.0033     15.5740     14.1100
  1187 CA   VAL     77      0.0036     15.9336     13.6900
  1203 CA   PHE     78      0.0027     14.9612     14.4600
  1223 CA   ALA     79      0.0032     15.5541     13.3200
  1233 CA   ASP     80      0.0038     16.1541     16.2100
  1245 CA   LEU     81      0.0023     14.5268     14.4700
  1264 CA   PHE     82      0.0022     14.4523     14.9100
  1284 CA   ASP     83      0.0036     15.9497     14.8700
  1296 CA   PRO     84      0.0044     16.7640     14.3000
  1310 CA   VAL     85      0.0033     15.5980     13.7600
  1326 CA   ILE     86      0.0033     15.5934     14.3800
  1345 CA   GLU     87      0.0059     18.4403     16.8700
  1360 CA   ASP     88      0.0071     19.6943     15.2900
  1372 CA   TYR     89      0.0050     17.4408     15.3300
  1393 CA   HIS     90      0.0049     17.3671     17.3300
  1410 CA   GLY     91      0.0133     26.4412     25.3900
  1417 CA   GLY     92      0.0131     26.2541     21.3100
  1424 CA   PHE     93      0.0072     19.8418     18.8900
  1444 CA   LYS     94      0.0094     22.2205     19.3100
  1466 CA   PRO     95      0.0094     22.1809     18.8800
  1480 CA   THR     96      0.0168     30.2400     21.3400
  1494 CA   ASP     97      0.0090     21.7307     15.6600
  1506 CA   LYS     98      0.0068     19.3554     16.1300
  1528 CA   HIS     99      0.0038     16.1711     14.5300
  1545 CA   PRO    100      0.0047     17.0825     17.1200
  1559 CA   PRO    101      0.0065     19.0853     16.6600
  1573 CA   THR    102      0.0040     16.3692     17.9400
  1587 CA   ASP    103      0.0033     15.6268     16.9400
  1599 CA   PHE    104      0.0026     14.8993     16.3600
  1619 CA   GLY    105      0.0050     17.4580     21.7000
  1626 CA   ASP    106      0.0084     21.1300     24.5700
  1638 CA   MET    107      0.0054     17.8343     22.6200
  1655 CA   ASN    108      0.0106     23.5319     23.8300
  1669 CA   THR    109      0.0067     19.3368     20.0200
  1683 CA   ILE    110      0.0038     16.1251     18.6800
  1702 CA   VAL    111      0.0044     16.7787     16.7800
  1718 CA   ASN    112      0.0045     16.9294     17.6900
  1732 CA   VAL    113      0.0039     16.2466     16.0400
  1748 CA   ASP    114      0.0055     17.9523     17.5000
  1760 CA   PRO    115      0.0160     29.3762     22.5900
  1774 CA   GLU    116      0.0198     33.4685     21.7700
  1789 CA   ASN    117      0.0123     25.2913     20.5000
  1803 CA   LYS    118      0.0135     26.6900     16.8400
  1825 CA   TYR    119      0.0072     19.8115     16.3900
  1846 CA   VAL    120      0.0055     17.9428     17.1200
  1862 CA   VAL    121      0.0072     19.8012     17.3800
  1878 CA   SER    122      0.0055     18.0149     15.7500
  1889 CA   THR    123      0.0024     14.6886     15.8400
  1903 CA   ARG    124      0.0020     14.2269     16.2100
  1927 CA   VAL    125      0.0016     13.7367     16.2000
  1943 CA   ARG    126      0.0017     13.9105     15.1100
  1967 CA   CYS    127      0.0016     13.8086     13.6900
  1978 CA   GLY    128      0.0016     13.7417     14.5300
  1985 CA   ARG    129      0.0015     13.6417     14.1200
  2009 CA   SER    130      0.0016     13.7228     14.2600
  2020 CA   LEU    131      0.0022     14.4403     14.6900
  2039 CA   GLN    132      0.0035     15.7944     19.1500
  2056 CA   GLY    133      0.0039     16.2725     19.5800
  2063 CA   TYR    134      0.0030     15.2945     17.9800
  2084 CA   PRO    135      0.0022     14.4671     14.3000
  2098 CA   PHE    136      0.0019     14.0557     14.3700
  2118 CA   ASN    137      0.0019     14.0467     15.7100
  2132 CA   PRO    138      0.0021     14.3469     14.6100
  2146 CA   CYS    139      0.0027     15.0060     16.4600
  2157 CA   LEU    140      0.0028     15.0289     16.4700
  2176 CA   THR    141      0.0062     18.7664     19.0600
  2190 CA   GLU    142      0.0065     19.0709     20.3200
  2205 CA   ALA    143      0.0075     20.1677     18.5600
  2215 CA   GLN    144      0.0046     17.0531     18.2100
  2232 CA   TYR    145      0.0034     15.7137     16.3700
  2253 CA   LYS    146      0.0054     17.8520     17.0300
  2275 CA   GLU    147      0.0046     17.0005     18.0800
  2290 CA   MET    148      0.0028     15.0769     19.6600
  2307 CA   GLU    149      0.0026     14.8505     18.3500
  2322 CA   ASP    150      0.0037     16.0210     21.2600
  2334 CA   LYS    151      0.0031     15.3914     18.4500
  2356 CA   VAL    152      0.0022     14.3994     16.3400
  2372 CA   SER    153      0.0028     15.0489     18.8700
  2384 CA   SER    154      0.0040     16.3769     21.7300
  2385 CA   SER    154      0.0040     16.3774     21.7300
  2405 CA   GLN    155      0.0029     15.2274     19.1500
  2423 CA   LEU    156      0.0024     14.6366     18.9300
  2442 CA   LYS    157      0.0040     16.3625     21.8400
  2464 CA   GLY    158      0.0056     18.0850     21.0400
  2471 CA   MET    159      0.0054     17.8794     22.2000
  2488 CA   THR    160      0.0097     22.5379     21.3900
  2502 CA   GLY    161      0.0172     30.6542     23.4700
  2509 CA   ASP    162      0.0072     19.8121     21.9100
  2521 CA   LEU    163      0.0036     15.8979     18.4100
  2540 CA   LYS    164      0.0051     17.5343     19.0800
  2562 CA   GLY    165      0.0039     16.3122     17.6400
  2569 CA   THR    166      0.0036     15.9698     18.6600
  2583 CA   TYR    167      0.0027     14.9129     15.1300
  2604 CA   TYR    168      0.0031     15.3423     15.4700
  2625 CA   PRO    169      0.0036     15.9612     14.2500
  2639 CA   LEU    170      0.0038     16.1384     14.2100
  2658 CA   THR    171      0.0072     19.8658     14.5300
  2672 CA   GLY    172      0.0232     37.1647     17.3200
  2679 CA   MET    173      0.0111     24.0731     15.4800
  2696 CA   ASP    174      0.0190     32.6304     18.7700
  2708 CA   LYS    175      0.0252     39.2835     18.0600
  2730 CA   LYS    176      0.0241     38.1214     15.7500
  2752 CA   THR    177      0.0106     23.4672     17.9600
  2766 CA   GLN    178      0.0096     22.4153     18.7300
  2783 CA   GLN    179      0.0142     27.4253     18.2800
  2800 CA   GLN    180      0.0114     24.3993     18.2500
  2817 CA   LEU    181      0.0066     19.2128     14.7100
  2836 CA   ILE    182      0.0103     23.2238     18.6800
  2855 CA   ASP    183      0.0151     28.3859     23.5800
  2867 CA   ASP    184      0.0107     23.6351     23.5900
  2879 CA   HIS    185      0.0116     24.5455     20.3400
  2896 CA   PHE    186      0.0052     17.6912     16.3500
  2916 CA   LEU    187      0.0049     17.3677     14.2300
  2935 CA   PHE    188      0.0046     17.0568     17.2100
  2955 CA   LYS    189      0.0071     19.6943     24.3200
  2977 CA   GLU    190      0.0068     19.3611     23.3300
  2992 CA   GLY    191      0.0079     20.6324     20.8200
  2999 CA   ASP    192      0.0125     25.5104     17.5700
  3011 CA   ARG    193      0.0115     24.4611     17.4000
  3035 CA   PHE    194      0.0070     19.5619     18.4300
  3055 CA   LEU    195      0.0046     17.0432     16.7000
  3074 CA   GLN    196      0.0055     18.0115     18.8400
  3091 CA   ALA    197      0.0050     17.4529     16.5300
  3101 CA   ALA    198      0.0033     15.6480     15.8400
  3111 CA   ASN    199      0.0035     15.7970     14.9400
  3125 CA   ALA    200      0.0030     15.3386     17.1200
  3135 CA   CYS    201      0.0043     16.7145     16.4600
  3146 CA   ARG    202      0.0048     17.1874     16.2100
  3170 CA   TYR    203      0.0061     18.6570     16.6000
  3191 CA   TRP    204      0.0054     17.9243     19.4500
  3215 CA   PRO    205      0.0051     17.5172     17.9400
  3229 CA   THR    206      0.0046     17.0609     15.0000
  3243 CA   GLY    207      0.0028     15.0976     16.0300
  3250 CA   ARG    208      0.0026     14.8946     15.2100
  3274 CA   GLY    209      0.0022     14.4321     16.1100
  3281 CA   ILE    210      0.0021     14.2900     12.3300
  3300 CA   TYR    211      0.0021     14.3199     13.7300
  3321 CA   HIS    212      0.0025     14.7382     15.1200
  3338 CA   ASN    213      0.0034     15.7686     16.5400
  3352 CA   ASP    214      0.0060     18.5120     21.7500
  3364 CA   ALA    215      0.0057     18.1872     20.6900
  3374 CA   LYS    216      0.0046     16.9706     15.9700
  3396 CA   THR    217      0.0032     15.4586     14.9900
  3410 CA   PHE    218      0.0022     14.4459     14.8900
  3430 CA   LEU    219      0.0018     13.9830     15.8400
  3449 CA   VAL    220      0.0015     13.6514     15.3300
  3465 CA   TRP    221      0.0015     13.7150     11.3800
  3489 CA   VAL    222      0.0015     13.6126     12.1000
  3505 CA   ASN    223      0.0017     13.8529     13.9900
  3519 CA   GLU    224      0.0020     14.1865     15.2800
  3534 CA   GLU    225      0.0017     13.9318     17.5900
  3549 CA   ASP    226      0.0015     13.6098     12.6800
  3561 CA   HIS    227      0.0013     13.4675     14.3000
  3578 CA   LEU    228      0.0013     13.4848     11.9800
  3597 CA   ARG    229      0.0015     13.6280     12.9100
  3621 CA   ILE    230      0.0014     13.5475     13.1200
  3640 CA   ILE    231      0.0018     13.9573     14.9300
  3659 CA   SER    232      0.0019     14.0461     16.3100
  3670 CA   MET    233      0.0027     14.9770     16.3400
  3687 CA   GLN    234      0.0036     15.9162     20.4800
  3704 CA   GLN    235      0.0092     21.9688     15.6100
  3721 CA   GLY    236      0.0070     19.5876     17.0000
  3728 CA   GLY    237      0.0039     16.2993     16.4800
  3735 CA   ASP    238      0.0035     15.8606     15.6700
  3747 CA   LEU    239      0.0024     14.6287     14.4600
  3766 CA   LYS    240      0.0032     15.4984     17.4000
  3788 CA   GLN    241      0.0033     15.6486     15.5200
  3805 CA   VAL    242      0.0024     14.6425     13.5500
  3821 CA   TYR    243      0.0021     14.2679     13.7600
  3842 CA   SER    244      0.0027     14.9181     16.2600
  3853 CA   ARG    245      0.0023     14.5537     17.0300
  3877 CA   MET    246      0.0019     14.0444     16.4200
  3894 CA   VAL    247      0.0022     14.4532     16.8700
  3910 CA   SER    248      0.0025     14.7900     17.6200
  3921 CA   GLY    249      0.0019     14.0944     15.7300
  3928 CA   VAL    250      0.0018     14.0240     16.1800
  3944 CA   LYS    251      0.0033     15.6275     17.1900
  3966 CA   GLU    252      0.0033     15.6062     19.1900
  3981 CA   ILE    253      0.0021     14.3508     16.6100
  4000 CA   GLU    254      0.0028     15.0929     18.9500
  4015 CA   LYS    255      0.0080     20.6639     23.5700
  4037 CA   LYS    256      0.0078     20.4572     25.7900
  4059 CA   LEU    257      0.0033     15.6305     19.0100
  4078 CA   PRO    258      0.0043     16.6487     17.2000
  4092 CA   PHE    259      0.0022     14.3995     16.8800
  4112 CA   SER    260      0.0025     14.7154     16.7900
  4123 CA   ARG    261      0.0033     15.5732     13.8700
  4147 CA   ASP    262      0.0032     15.5351     14.2000
  4159 CA   ASP    263      0.0070     19.5733     17.2400
  4171 CA   ARG    264      0.0049     17.3035     14.2000
  4195 CA   LEU    265      0.0025     14.7424     14.5800
  4214 CA   GLY    266      0.0026     14.8566     14.7300
  4221 CA   PHE    267      0.0019     14.0440     12.6100
  4241 CA   LEU    268      0.0019     14.1207     13.9700
  4260 CA   THR    269      0.0016     13.7679     14.8100
  4274 CA   PHE    270      0.0015     13.6332     13.6600
  4294 CA   CYS    271      0.0021     14.3071     14.2600
  4305 CA   PRO    272      0.0021     14.2970     12.7400
  4319 CA   THR    273      0.0026     14.8832     15.9700
  4333 CA   ASN    274      0.0022     14.4425     14.6900
  4347 CA   LEU    275      0.0020     14.2557     13.8800
  4366 CA   GLY    276      0.0022     14.3674     14.2300
  4373 CA   THR    277      0.0020     14.2182     12.0200
  4387 CA   THR    278      0.0020     14.1673     13.9000
  4401 CA   ILE    279      0.0020     14.1574     13.7400
  4420 CA   ARG    280      0.0021     14.2619     17.7100
  4444 CA   ALA    281      0.0019     14.1091     18.9500
  4454 CA   SER    282      0.0023     14.5802     19.3100
  4465 CA   VAL    283      0.0035     15.8010     14.8800
  4481 CA   HIS    284      0.0055     18.0050     16.2500
  4498 CA   ILE    285      0.0060     18.4947     15.3900
  4517 CA   LYS    286      0.0090     21.7649     17.0500
  4539 CA   LEU    287      0.0094     22.2362     20.5400
  4558 CA   PRO    288      0.0149     28.1501     25.6700
  4572 CA   LYS    289      0.0169     30.3439     21.5300
  4594 CA   LEU    290      0.0131     26.2379     21.6400
  4613 CA   ALA    291      0.0167     30.1366     32.6200
  4623 CA   ALA    292      0.0273     41.5686     36.6100
  4633 CA   ASP    293      0.0229     36.7770     39.4000
  4645 CA   LYS    294      0.0192     32.7987     42.0700
  4667 CA   ALA    295      0.0242     38.1635     49.3100
  4677 CA   LYS    296      0.0180     31.4868     38.8200
  4699 CA   LEU    297      0.0111     24.0162     32.7600
  4718 CA   ASP    298      0.0131     26.2571     44.4100
  4730 CA   SER    299      0.0143     27.5553     41.1500
  4741 CA   ILE    300      0.0096     22.4079     26.7300
  4760 CA   ALA    301      0.0066     19.2292     24.7500
  4770 CA   ALA    302      0.0099     22.7768     29.3500
  4780 CA   LYS    303      0.0114     24.3408     25.7300
  4802 CA   TYR    304      0.0065     19.0753     23.9100
  4823 CA   ASN    305      0.0060     18.4956     21.5600
  4837 CA   LEU    306      0.0049     17.2892     19.5000
  4856 CA   GLN    307      0.0070     19.6264     24.9700
  4873 CA   VAL    308      0.0079     20.6229     22.5400
  4889 CA   ARG    309      0.0135     26.6652     28.9600
  4913 CA   GLY    310      0.0185     32.0053     44.1600
  4920 CA   THR    311      0.0319     46.5232     55.2600
  4934 CA   ALA    321      0.0164     29.7836     41.5000
  4943 CA   VAL    322      0.0124     25.5012     33.1800
  4959 CA   TYR    323      0.0085     21.2287     22.0300
  4980 CA   ASP    324      0.0071     19.7533     19.6600
  4992 CA   ILE    325      0.0042     16.5592     19.0800
  5011 CA   SER    326      0.0037     16.0734     19.6800
  5022 CA   ASN    327      0.0029     15.1775     18.0000
  5036 CA   LYS    328      0.0047     17.0921     20.5000
  5058 CA   ARG    329      0.0031     15.3842     16.4800
  5082 CA   ARG    330      0.0027     15.0069     16.7500
  5106 CA   MET    331      0.0029     15.2238     16.4100
  5123 CA   GLY    332      0.0035     15.8314     16.0500
  5130 CA   LEU    333      0.0035     15.8061     17.2600
  5149 CA   THR    334      0.0031     15.4074     15.3000
  5163 CA   GLU    335      0.0024     14.6118     13.3100
  5178 CA   TYR    336      0.0025     14.7116     17.5400
  5199 CA   GLN    337      0.0031     15.3743     17.0100
  5216 CA   ALA    338      0.0023     14.5701     17.7700
  5226 CA   VAL    339      0.0019     14.1484     15.2900
  5242 CA   ARG    340      0.0026     14.8782     19.5800
  5266 CA   GLU    341      0.0026     14.8583     24.2500
  5281 CA   MET    342      0.0020     14.2021     17.8700
  5298 CA   GLN    343      0.0025     14.7480     16.7200
  5315 CA   ASP    344      0.0034     15.7079     15.5400
  5327 CA   GLY    345      0.0034     15.7696     17.7200
  5334 CA   ILE    346      0.0029     15.1690     16.6100
  5353 CA   GLN    347      0.0043     16.6732     15.6600
  5370 CA   GLU    348      0.0060     18.5588     17.0000
  5385 CA   LEU    349      0.0055     17.9540     19.0800
  5404 CA   ILE    350      0.0060     18.4911     16.5200
  5423 CA   LYS    351      0.0110     23.9086     16.5700
  5445 CA   LEU    352      0.0111     24.0512     19.0700
  5464 CA   GLU    353      0.0109     23.8641     18.9700
  5479 CA   GLN    354      0.0144     27.5851     20.5500
  5496 CA   ALA    355      0.0232     37.0976     29.4000
  5506 CA   ALA    356      0.0236     37.5606     27.4900

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.