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***  HYDROLASE 21-FEB-23 8CMV  ***

B-factor analysis for ID 2606131810021463505

Overall B-factor prediction

Correlation= 0.780 for 268 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   ASP     36      0.0500     64.5232     49.4100
    14 CA   ASN     37      0.0145     24.9433     27.3400
    28 CA   PRO     38      0.0092     18.9957     20.8500
    42 CA   TYR     39      0.0038     12.9742     15.4800
    63 CA   ARG     40      0.0025     11.5497     15.5700
    87 CA   ARG     41      0.0027     11.7505     13.3400
   111 CA   GLY     42      0.0041     13.3165     13.6600
   118 CA   PRO     43      0.0080     17.7262     15.0700
   132 CA   ASN     44      0.0070     16.5761     15.5400
   146 CA   PRO     45      0.0043     13.5443     13.7900
   160 CA   THR     46      0.0065     16.0243     16.1100
   174 CA   ARG     47      0.0037     12.8966     17.5400
   198 CA   ASP     48      0.0076     17.2866     19.1500
   199 CA   ASP     48      0.0076     17.2965     19.2700
   218 CA   ALA     49      0.0054     14.7744     14.6600
   228 CA   LEU     50      0.0018     10.8051     11.6100
   247 CA   THR     51      0.0026     11.6821     12.7100
   261 CA   ALA     52      0.0033     12.4307     14.4400
   271 CA   ASP     53      0.0030     12.0817     12.8500
   283 CA   GLY     54      0.0031     12.2324     12.3500
   290 CA   PRO     55      0.0045     13.8369     16.0600
   304 CA   PHE     56      0.0034     12.5924     13.0800
   324 CA   LYS     57      0.0060     15.4620     13.3000
   346 CA   VAL     58      0.0026     11.7198     12.0000
   362 CA   ALA     59      0.0032     12.3675     11.4800
   372 CA   THR     60      0.0031     12.2816     12.6200
   386 CA   TYR     61      0.0028     11.9524     12.8900
   407 CA   THR     62      0.0055     14.8998     14.4000
   421 CA   VAL     63      0.0032     12.4001     13.7200
   437 CA   SER     64      0.0085     18.2287     18.5800
   448 CA   ARG     65      0.0060     15.5150     24.8000
   472 CA   LEU     66      0.0176     28.4561     31.1200
   491 CA   SER     67      0.0129     23.2167     21.2100
   502 CA   VAL     68      0.0055     14.8860     17.5000
   518 CA   SER     69      0.0115     21.6400     23.5000
   529 CA   GLY     70      0.0035     12.6360     16.4100
   536 CA   PHE     71      0.0023     11.3286     13.0600
   556 CA   GLY     72      0.0027     11.8174     12.6300
   563 CA   GLY     73      0.0023     11.3742     13.4400
   570 CA   GLY     74      0.0019     10.8496     12.2900
   577 CA   VAL     75      0.0017     10.6330     11.3500
   593 CA   ILE     76      0.0011      9.9593     10.3400
   612 CA   TYR     77      0.0012     10.0876      9.8500
   633 CA   TYR     78      0.0015     10.4543      9.9600
   654 CA   PRO     79      0.0018     10.7329     11.5400
   668 CA   THR     80      0.0054     14.8127     14.8200
   682 CA   GLY     81      0.0143     24.7446     14.4400
   689 CA   THR     82      0.0088     18.5678     12.8100
   703 CA   SER     83      0.0127     22.9324     14.2700
   714 CA   LEU     84      0.0047     14.0143     11.9100
   733 CA   THR     85      0.0031     12.2000     10.7300
   747 CA   PHE     86      0.0013     10.2363     10.3000
   767 CA   GLY     87      0.0014     10.3805      9.5200
   774 CA   GLY     88      0.0007      9.5953      9.1500
   781 CA   ILE     89      0.0007      9.5324      9.3900
   800 CA   ALA     90      0.0007      9.5404      8.8500
   810 CA   MET     91      0.0007      9.5556      9.3300
   811 CA   MET     91      0.0007      9.5561     10.3000
   840 CA   SER     92      0.0010      9.8523      9.2700
   851 CA   PRO     93      0.0012     10.0919     10.0400
   865 CA   GLY     94      0.0024     11.4028     12.6600
   872 CA   TYR     95      0.0033     12.5157     13.2500
   893 CA   THR     96      0.0060     15.4811     15.3600
   907 CA   ALA     97      0.0046     13.8589     14.8600
   917 CA   ASP     98      0.0035     12.7080     15.2100
   929 CA   ALA     99      0.0022     11.2295     12.3200
   939 CA   SER    100      0.0055     14.9202     12.7700
   950 CA   SER    101      0.0036     12.7897     12.3200
   961 CA   LEU    102      0.0014     10.2900     10.6200
   980 CA   ALA    103      0.0017     10.7224     11.3800
   990 CA   TRP    104      0.0019     10.8503     11.2300
  1014 CA   LEU    105      0.0013     10.2356      9.4400
  1033 CA   GLY    106      0.0012     10.1378     10.0300
  1040 CA   ARG    107      0.0015     10.4234     10.5700
  1064 CA   ARG    108      0.0012     10.1148      9.8800
  1088 CA   LEU    109      0.0010      9.8810      9.5300
  1107 CA   ALA    110      0.0013     10.2004      9.7200
  1117 CA   SER    111      0.0016     10.5370      9.8500
  1128 CA   HIS    112      0.0012     10.0937     10.1100
  1146 CA   GLY    113      0.0013     10.2582      9.4000
  1153 CA   PHE    114      0.0007      9.5468      9.1400
  1173 CA   VAL    115      0.0008      9.6435      9.0000
  1189 CA   VAL    116      0.0007      9.5681      8.9300
  1205 CA   LEU    117      0.0007      9.5604      8.9500
  1224 CA   VAL    118      0.0009      9.8006      8.7300
  1240 CA   ILE    119      0.0009      9.7412     10.6200
  1259 CA   ASN    120      0.0019     10.9088     11.7600
  1273 CA   THR    121      0.0019     10.9055     12.0500
  1287 CA   ASN    122      0.0042     13.5129     15.0500
  1301 CA   SER    123      0.0060     15.4178     14.7600
  1312 CA   ARG    124      0.0062     15.6829     15.1200
  1336 CA   PHE    125      0.0077     17.3557     13.6900
  1356 CA   ASP    126      0.0035     12.6827     12.3600
  1368 CA   GLY    127      0.0034     12.5578     11.6200
  1375 CA   PRO    128      0.0020     10.9608     11.6700
  1389 CA   ASP    129      0.0022     11.1902     12.1100
  1401 CA   SER    130      0.0024     11.4055     11.4700
  1412 CA   ARG    131      0.0015     10.5034     10.7600
  1436 CA   ALA    132      0.0016     10.5113     10.6000
  1446 CA   SER    133      0.0023     11.3093     13.0500
  1447 CA   SER    133      0.0023     11.3125     13.1400
  1464 CA   GLN    134      0.0014     10.3196     11.9000
  1481 CA   LEU    135      0.0011      9.9874     10.6800
  1500 CA   SER    136      0.0018     10.7975     12.9500
  1501 CA   SER    136      0.0018     10.7970     12.4000
  1518 CA   ALA    137      0.0018     10.7781     12.4500
  1528 CA   ALA    138      0.0011      9.9906     12.1700
  1538 CA   LEU    139      0.0011     10.0068     12.0500
  1557 CA   ASN    140      0.0028     11.8817     12.9500
  1558 CA   ASN    140      0.0028     11.8828     12.9700
  1581 CA   TYR    141      0.0019     10.9405     12.8800
  1602 CA   LEU    142      0.0014     10.2937     13.1100
  1603 CA   LEU    142      0.0014     10.2945     13.2400
  1636 CA   ARG    143      0.0023     11.3630     16.9400
  1660 CA   THR    144      0.0053     14.7390     14.3300
  1674 CA   ARG    145      0.0060     15.4680     15.3700
  1698 CA   SER    146      0.0026     11.7263     13.7700
  1709 CA   PRO    147      0.0037     12.8547     14.0200
  1723 CA   SER    148      0.0110     21.0631     14.0900
  1724 CA   SER    148      0.0111     21.1661     12.8900
  1741 CA   ALA    149      0.0070     16.6350     13.3500
  1751 CA   VAL    150      0.0021     11.1160     12.3700
  1767 CA   ARG    151      0.0023     11.3721     12.3000
  1791 CA   ALA    152      0.0043     13.5581     12.4000
  1801 CA   ARG    153      0.0026     11.6747     11.9800
  1825 CA   LEU    154      0.0017     10.6780     10.5700
  1844 CA   ASP    155      0.0021     11.1520     11.2300
  1856 CA   ALA    156      0.0029     11.9939     14.7400
  1866 CA   ASN    157      0.0059     15.3399     14.5600
  1880 CA   ARG    158      0.0015     10.4883     10.9400
  1904 CA   LEU    159      0.0014     10.3583     10.3800
  1923 CA   ALA    160      0.0008      9.6814      8.8700
  1933 CA   VAL    161      0.0008      9.7042      9.3700
  1949 CA   ALA    162      0.0007      9.5387      8.8300
  1959 CA   GLY    163      0.0007      9.5301      9.0600
  1966 CA   HIS    164      0.0011     10.0361      9.3900
  1984 CA   SER    165      0.0011     10.0568     10.2200
  1995 CA   MET    166      0.0014     10.3451     10.3100
  2012 CA   GLY    167      0.0011     10.0401      9.7600
  2019 CA   GLY    168      0.0009      9.8260      9.9600
  2026 CA   GLY    169      0.0010      9.9156     10.0000
  2033 CA   GLY    170      0.0010      9.8844     10.1400
  2040 CA   THR    171      0.0008      9.7207     10.2700
  2054 CA   LEU    172      0.0011     10.0255     10.5000
  2073 CA   ARG    173      0.0015     10.4688     11.1600
  2097 CA   ILE    174      0.0014     10.2935     10.6900
  2116 CA   ALA    175      0.0014     10.3538     12.3400
  2126 CA   GLU    176      0.0027     11.8192     14.1800
  2141 CA   GLN    177      0.0032     12.3162     14.2200
  2158 CA   ASN    178      0.0037     12.9100     14.4000
  2172 CA   PRO    179      0.0057     15.1193     15.0000
  2186 CA   SER    180      0.0058     15.2876     14.0100
  2197 CA   LEU    181      0.0023     11.3222     10.7100
  2216 CA   LYS    182      0.0014     10.3478     10.2300
  2238 CA   ALA    183      0.0012     10.1246      9.2500
  2248 CA   ALA    184      0.0007      9.5565      9.0000
  2258 CA   VAL    185      0.0006      9.4865      8.2600
  2274 CA   PRO    186      0.0007      9.5147      8.0900
  2288 CA   LEU    187      0.0006      9.4973      8.9600
  2307 CA   THR    188      0.0009      9.8275      8.9100
  2321 CA   PRO    189      0.0010      9.8444      9.3500
  2335 CA   TRP    190      0.0017     10.6671     10.5200
  2359 CA   HIS    191      0.0017     10.7064     10.6800
  2377 CA   THR    192      0.0060     15.4720     13.7300
  2391 CA   ASP    193      0.0048     14.0888     12.1700
  2403 CA   LYS    194      0.0029     11.9741     12.5700
  2425 CA   THR    195      0.0036     12.7949     13.1500
  2439 CA   PHE    196      0.0025     11.5680     11.2500
  2459 CA   ASN    197      0.0046     13.9556     12.6400
  2473 CA   THR    198      0.0025     11.5686     12.2900
  2487 CA   SER    199      0.0032     12.3470     12.2400
  2498 CA   VAL    200      0.0015     10.4982     10.3100
  2514 CA   PRO    201      0.0014     10.3302      9.1200
  2528 CA   VAL    202      0.0008      9.6542      9.6600
  2544 CA   LEU    203      0.0007      9.5216      8.9700
  2563 CA   ILE    204      0.0007      9.5588      9.0800
  2582 CA   VAL    205      0.0007      9.5471      9.2200
  2598 CA   GLY    206      0.0014     10.3008      9.5300
  2605 CA   ALA    207      0.0018     10.7491      9.3400
  2615 CA   GLU    208      0.0046     13.9262     10.3300
  2630 CA   ARG    209      0.0072     16.8048     13.3000
  2654 CA   ASP    210      0.0039     13.0896     11.2400
  2666 CA   THR    211      0.0095     19.4301     13.8600
  2680 CA   VAL    212      0.0045     13.7949     13.2400
  2696 CA   ALA    213      0.0028     11.8981     11.6700
  2706 CA   PRO    214      0.0035     12.6728     10.8700
  2720 CA   VAL    215      0.0026     11.6522     10.9400
  2736 CA   SER    216      0.0073     16.8694     11.9200
  2737 CA   SER    216      0.0073     16.8679     12.9700
  2754 CA   GLN    217      0.0056     15.0396     13.2000
  2771 CA   HIS    218      0.0018     10.7652     10.4900
  2789 CA   ALA    219      0.0015     10.4833      9.4100
  2799 CA   ILE    220      0.0024     11.4320     11.5000
  2818 CA   PRO    221      0.0027     11.7593     10.8000
  2832 CA   PHE    222      0.0013     10.1807     10.8800
  2852 CA   TYR    223      0.0012     10.1129     10.7700
  2873 CA   GLN    224      0.0032     12.3274     11.5700
  2890 CA   ASN    225      0.0033     12.4899     12.4500
  2904 CA   LEU    226      0.0022     11.2828     12.7900
  2923 CA   PRO    227      0.0034     12.6272     14.1700
  2937 CA   SER    228      0.0090     18.8600     14.8900
  2938 CA   SER    228      0.0090     18.7865     13.6800
  2955 CA   THR    229      0.0086     18.3583     11.9400
  2969 CA   THR    230      0.0025     11.5307     11.9500
  2983 CA   PRO    231      0.0020     11.0003     10.5400
  2997 CA   LYS    232      0.0013     10.2700     10.3500
  3019 CA   VAL    233      0.0012     10.0940      9.3600
  3035 CA   TYR    234      0.0011     10.0329      9.7800
  3056 CA   VAL    235      0.0011      9.9938     10.6500
  3072 CA   GLU    236      0.0018     10.8133     11.2200
  3087 CA   LEU    237      0.0018     10.8108     10.4700
  3106 CA   CYS    238      0.0067     16.2711     12.8000
  3117 CA   ASN    239      0.0102     20.1185     13.5700
  3118 CA   ASN    239      0.0098     19.7502     13.9100
  3141 CA   ALA    240      0.0045     13.8001     11.2600
  3151 CA   SER    241      0.0041     13.3982     11.5600
  3162 CA   HIS    242      0.0028     11.9099     10.1300
  3180 CA   ILE    243      0.0044     13.6618     11.9100
  3199 CA   ALA    244      0.0022     11.2489     10.7500
  3209 CA   PRO    245      0.0016     10.5976     10.0800
  3223 CA   ASN    246      0.0027     11.7934     10.7500
  3237 CA   SER    247      0.0043     13.6225     14.0500
  3248 CA   ASN    248      0.0041     13.3063     12.6800
  3262 CA   ASN    249      0.0028     11.8537     11.7000
  3276 CA   ALA    250      0.0022     11.2147     11.9900
  3286 CA   ALA    251      0.0018     10.8166     11.0700
  3296 CA   ILE    252      0.0011     10.0058     10.5800
  3315 CA   SER    253      0.0011     10.0213     10.2900
  3326 CA   VAL    254      0.0012     10.1455      9.8600
  3342 CA   TYR    255      0.0011      9.9619      9.9400
  3363 CA   THR    256      0.0008      9.6236      9.6600
  3377 CA   ILE    257      0.0008      9.6363      9.4400
  3396 CA   SER    258      0.0009      9.7624      8.9900
  3407 CA   TRP    259      0.0008      9.6303      8.4600
  3431 CA   MET    260      0.0007      9.6041      9.0300
  3448 CA   LYS    261      0.0008      9.6608      9.5500
  3470 CA   LEU    262      0.0013     10.1943     10.0200
  3489 CA   TRP    263      0.0013     10.2680      9.8700
  3513 CA   VAL    264      0.0012     10.1284      9.6800
  3529 CA   ASP    265      0.0014     10.3350     10.3400
  3541 CA   ASN    266      0.0026     11.7191     13.4300
  3555 CA   ASP    267      0.0021     11.1716     11.5700
  3567 CA   THR    268      0.0034     12.5414     14.9600
  3581 CA   ARG    269      0.0029     12.0660     12.3100
  3605 CA   TYR    270      0.0016     10.5364     10.8300
  3626 CA   ARG    271      0.0023     11.3929     13.5500
  3650 CA   GLN    272      0.0028     11.9263     14.5600
  3667 CA   PHE    273      0.0021     11.0861     12.3100
  3687 CA   LEU    274      0.0016     10.5408     11.4900
  3706 CA   CYS    275      0.0027     11.7357     14.9300
  3717 CA   ASP    276      0.0129     23.2052     16.7900
  3729 CA   VAL    277      0.0049     14.2721     15.9800
  3745 CA   LYS    278      0.0124     22.6293     15.3100
  3767 CA   ASP    279      0.0070     16.5708     14.6200
  3779 CA   PRO    280      0.0170     27.7940     19.0000
  3793 CA   ALA    281      0.0066     16.1284     15.2100
  3803 CA   LEU    282      0.0032     12.3027     14.2700
  3822 CA   CYS    283      0.0049     14.2973     17.0300
  3833 CA   ASP    284      0.0031     12.2720     20.0400
  3845 CA   PHE    285      0.0022     11.2482     22.1700
  3865 CA   ARG    286      0.0024     11.4415     15.9100
  3889 CA   THR    287      0.0022     11.2465     11.6400
  3903 CA   ASN    288      0.0035     12.6791     12.5400
  3917 CA   ASN    289      0.0037     12.8964     13.3800
  3931 CA   ARG    290      0.0039     13.0944     15.4300
  3955 CA   HIS    291      0.0031     12.1982     16.3800
  3973 CA   CYS    292      0.0076     17.2317     20.3800
  3984 CA   LYS    293      0.0174     28.2040     57.2000

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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).
Between 2015 and 2025, it was hosted by US2B (Nantes).
Last modification: april 24th, 2026.