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***  8d9p  ***

B-factor analysis for ID 22100401063033404

Overall B-factor prediction

Correlation= 0.639 for 195 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      2      0.1383     58.1501     71.0800
     8 CA   PRO      3      0.1404     58.8085     92.5100
    15 CA   GLU      4      0.1085     48.8706    108.3000
    24 CA   LEU      5      0.0568     32.7847     49.0500
    32 CA   ARG      6      0.0517     31.1771     40.4900
    43 CA   GLN      7      0.0685     36.4143     50.9400
    52 CA   GLU      8      0.0448     29.0412     38.3600
    61 CA   HIS      9      0.0257     23.1017     38.3700
    71 CA   GLN     10      0.0413     27.9598     28.9800
    80 CA   GLN     11      0.0457     29.3021     43.0500
    89 CA   LEU     12      0.0276     23.6675     25.2100
    97 CA   ALA     13      0.0242     22.6224     20.4300
   102 CA   GLN     14      0.0378     26.8555     25.1700
   111 CA   GLU     15      0.0338     25.6195     28.4900
   120 CA   PHE     16      0.0229     22.2292     22.2000
   131 CA   GLN     17      0.0257     23.0887     28.8800
   140 CA   GLN     18      0.0368     26.5463     19.7100
   149 CA   LEU     19      0.0297     24.3342     20.7300
   157 CA   LEU     20      0.0263     23.2629     22.8200
   165 CA   GLN     21      0.0335     25.5237     18.9800
   174 CA   GLU     22      0.0348     25.9329     23.7500
   183 CA   ILE     23      0.0286     23.9820     15.6200
   191 CA   GLN     24      0.0301     24.4430     14.5100
   200 CA   GLN     25      0.0391     27.2581     17.9800
   209 CA   LEU     26      0.0314     24.8598     28.2200
   217 CA   GLY     27      0.0286     24.0050     28.2200
   221 CA   ARG     28      0.0369     26.5724     27.5600
   232 CA   GLU     29      0.0397     27.4392     21.8800
   241 CA   LEU     30      0.0281     23.8331     19.6100
   249 CA   LEU     31      0.0308     24.6613     21.9200
   257 CA   LYS     32      0.0546     32.0985     24.8600
   266 CA   GLY     33      0.0444     28.9261     22.1000
   270 CA   GLU     34      0.0246     22.7502     22.4900
   279 CA   LEU     35      0.0372     26.6694     27.2000
   287 CA   GLN     36      0.0684     36.3728     31.6200
   296 CA   GLY     37      0.0548     32.1643     42.7400
   300 CA   ILE     38      0.0297     24.3415     39.8800
   308 CA   LYS     39      0.0519     31.2541     39.8700
   317 CA   GLN     40      0.0435     28.6434     39.2100
   326 CA   LEU     41      0.0247     22.7727     27.4000
   334 CA   ARG     42      0.0392     27.2936     29.8900
   345 CA   GLU     43      0.0609     34.0399     44.3800
   354 CA   ALA     44      0.0415     28.0116     24.0400
   359 CA   SER     45      0.0389     27.1982     21.0800
   365 CA   GLU     46      0.0792     39.7376     41.1400
   374 CA   LYS     47      0.1070     48.3921     40.3500
   383 CA   ALA     48      0.0770     39.0725     28.3900
   388 CA   ARG     49      0.1475     61.0276     25.3100
   399 CA   ASN     50      0.1301     55.5821     28.8900
   407 CA   PRO     51      0.1226     53.2584     23.6100
   414 CA   GLU     52      0.0926     43.9085     32.4600
   423 CA   LYS     53      0.0511     30.9950     26.5200
   432 CA   LYS     54      0.0524     31.3882     37.1800
   441 CA   SER     55      0.0637     34.9303     23.1500
   447 CA   VAL     56      0.0332     25.4132     35.2100
   454 CA   LEU     57      0.0217     21.8549     27.7800
   462 CA   GLN     58      0.0326     25.2244     30.8400
   471 CA   LYS     59      0.0303     24.5290     23.6600
   480 CA   ILE     60      0.0154     19.8762     20.9500
   488 CA   LEU     61      0.0194     21.1327     22.9100
   496 CA   GLU     62      0.0326     25.2426     21.2700
   505 CA   ASP     63      0.0221     21.9716     22.5400
   513 CA   GLU     64      0.0173     20.4668     14.7100
   522 CA   GLU     65      0.0282     23.8714     26.5600
   531 CA   LYS     66      0.0333     25.4674     19.1900
   540 CA   HIS     67      0.0223     22.0427     25.2300
   550 CA   ILE     68      0.0262     23.2471     22.0600
   558 CA   GLU     69      0.0405     27.7034     24.0700
   567 CA   LEU     70      0.0298     24.3632     16.2500
   575 CA   LEU     71      0.0257     23.0970     15.1900
   583 CA   GLU     72      0.0338     25.6038     23.4100
   592 CA   THR     73      0.0350     25.9977     21.9000
   599 CA   LEU     74      0.0285     23.9609     29.6000
   607 CA   GLN     75      0.0299     24.3962     33.2800
   616 CA   GLN     76      0.0370     26.6123     28.6900
   625 CA   THR     77      0.0291     24.1429     20.5200
   632 CA   GLY     78      0.0275     23.6465     26.3400
   636 CA   GLN     79      0.0319     25.0260     19.4500
   645 CA   GLU     80      0.0318     24.9980     18.4400
   654 CA   ALA     81      0.0248     22.8129     22.5600
   659 CA   GLN     82      0.0265     23.3453     27.2600
   668 CA   GLN     83      0.0346     25.8616     39.4100
   677 CA   LEU     84      0.0248     22.8053     30.5000
   685 CA   LEU     85      0.0214     21.7365     21.5500
   693 CA   GLN     86      0.0332     25.4309     18.8800
   702 CA   GLU     87      0.0310     24.7248     19.7000
   711 CA   LEU     88      0.0213     21.7142     21.6800
   719 CA   GLN     89      0.0349     25.9613     25.0300
   728 CA   GLN     90      0.0521     31.3001     17.5000
   737 CA   THR     91      0.0352     26.0375     24.5300
   744 CA   GLY     92      0.0359     26.2730     21.1400
   748 CA   GLN     93      0.0637     34.9147     32.0700
   757 CA   GLU     94      0.0627     34.6230     28.8100
   766 CA   LEU     95      0.0518     31.2055     25.2000
   774 CA   TRP     96      0.0753     38.5183     21.8600
   788 CA   GLN     97      0.1020     46.8402     28.8200
   797 CA   LEU     98      0.1150     50.8876     29.1200
   805 CA   GLY     99      0.1397     58.5740     36.3100
   809 CA   GLY    100      0.1208     52.7004     33.9300
   813 CA   SER    101      0.2020     77.9896     38.9500
   819 CA   GLY    102      0.2559     94.7832     32.7500
   823 CA   GLY    103      0.1996     77.2486     34.4800
   827 CA   PRO    104      0.1047     47.6722     37.3600
   834 CA   GLU    105      0.0995     46.0804     23.9000
   843 CA   LEU    106      0.0556     32.4001     21.9400
   851 CA   ARG    107      0.0433     28.5766     30.4900
   862 CA   GLN    108      0.0502     30.7023     43.0900
   871 CA   LYS    109      0.0406     27.7347     36.8700
   880 CA   HIS    110      0.0236     22.4319     38.2300
   890 CA   GLN    111      0.0306     24.6049     32.8800
   899 CA   GLN    112      0.0394     27.3417     26.8900
   908 CA   LEU    113      0.0263     23.2847     21.4200
   916 CA   ALA    114      0.0218     21.8659     23.5400
   921 CA   GLN    115      0.0316     24.9209     33.4400
   930 CA   LYS    116      0.0310     24.7360     28.3900
   939 CA   ILE    117      0.0219     21.8961     29.6800
   947 CA   GLN    118      0.0255     23.0367     32.2900
   956 CA   GLN    119      0.0355     26.1349     30.1400
   965 CA   LEU    120      0.0297     24.3257     26.6300
   973 CA   LEU    121      0.0258     23.1349     29.2700
   981 CA   GLN    122      0.0337     25.5646     27.2800
   990 CA   LYS    123      0.0337     25.5813     22.8000
   999 CA   HIS    124      0.0279     23.7810     25.8800
  1009 CA   GLN    125      0.0308     24.6907     22.4900
  1018 CA   GLN    126      0.0380     26.9307     28.9700
  1027 CA   LEU    127      0.0301     24.4571     21.7700
  1035 CA   GLY    128      0.0288     24.0662     25.8300
  1039 CA   ALA    129      0.0331     25.3833     24.9400
  1044 CA   LYS    130      0.0333     25.4438     24.5800
  1053 CA   ILE    131      0.0226     22.1306     17.8700
  1061 CA   LEU    132      0.0254     22.9852     19.2800
  1069 CA   GLU    133      0.0372     26.6554     27.2000
  1078 CA   ASP    134      0.0236     22.4375     17.5600
  1086 CA   GLU    135      0.0178     20.6424     15.0900
  1095 CA   GLU    136      0.0279     23.7845     23.9000
  1104 CA   LYS    137      0.0326     25.2324     30.5700
  1113 CA   HIS    138      0.0182     20.7617     20.2900
  1123 CA   ILE    139      0.0257     23.0898     25.5200
  1131 CA   GLU    140      0.0499     30.6335     21.4300
  1140 CA   LEU    141      0.0325     25.2056     17.6800
  1148 CA   LEU    142      0.0269     23.4647     11.4500
  1156 CA   GLU    143      0.0524     31.3921     15.4900
  1165 CA   THR    144      0.0702     36.9526     25.9100
  1172 CA   ILE    145      0.0580     33.1361     22.4900
  1180 CA   LEU    146      0.0732     37.8899     45.1600
  1188 CA   GLY    147      0.1941     75.5373     78.6000
  1192 CA   GLY    148      0.4592    158.0789     97.4000
  1196 CA   SER    149      0.2490     92.6292    106.8500
  1202 CA   GLY    150      0.1744     69.3913     99.0200
  1206 CA   GLY    151      0.0986     45.7904     59.6600
  1210 CA   ASP    152      0.1146     50.7611     35.3100
  1218 CA   GLU    153      0.0620     34.3914     39.0200
  1227 CA   LEU    154      0.0391     27.2762     49.0400
  1235 CA   ARG    155      0.0545     32.0415     37.0900
  1246 CA   GLU    156      0.0538     31.8486     30.9000
  1255 CA   LEU    157      0.0275     23.6459     30.8200
  1263 CA   LEU    158      0.0297     24.3297     23.5800
  1271 CA   LYS    159      0.0555     32.3720     33.4800
  1280 CA   GLY    160      0.0463     29.5055     30.3100
  1284 CA   GLU    161      0.0213     21.7305     20.3400
  1293 CA   LEU    162      0.0331     25.3894     34.9600
  1301 CA   GLN    163      0.0522     31.3408     35.6300
  1310 CA   GLY    164      0.0294     24.2464     21.4600
  1314 CA   ILE    165      0.0270     23.4865     27.3300
  1322 CA   LYS    166      0.0422     28.2164     27.7100
  1331 CA   GLN    167      0.0320     25.0648     27.2000
  1340 CA   TYR    168      0.0264     23.2927     17.7300
  1352 CA   ARG    169      0.0359     26.2720     30.1600
  1363 CA   GLU    170      0.0369     26.5704     23.0300
  1372 CA   LEU    171      0.0301     24.4585     23.4700
  1380 CA   GLN    172      0.0336     25.5361     21.9100
  1389 CA   GLN    173      0.0424     28.2731     33.1600
  1398 CA   LEU    174      0.0341     25.7033     26.6700
  1406 CA   GLY    175      0.0308     24.6786     23.9800
  1410 CA   GLN    176      0.0371     26.6292     34.0500
  1419 CA   LYS    177      0.0365     26.4443     29.2700
  1428 CA   ALA    178      0.0270     23.5008     26.6100
  1433 CA   GLN    179      0.0286     23.9934     30.8700
  1442 CA   GLN    180      0.0360     26.2909     41.1100
  1451 CA   LEU    181      0.0247     22.7894     33.6900
  1459 CA   VAL    182      0.0206     21.5112     32.9200
  1466 CA   GLN    183      0.0309     24.7036     43.5700
  1475 CA   LYS    184      0.0298     24.3707     26.8300
  1484 CA   LEU    185      0.0200     21.3120     25.9800
  1492 CA   GLN    186      0.0276     23.6687     39.5500
  1501 CA   GLN    187      0.0395     27.3994     37.9800
  1510 CA   THR    188      0.0316     24.9374     24.9900
  1517 CA   GLY    189      0.0299     24.4012     37.4900
  1521 CA   GLN    190      0.0489     30.3097     50.9900
  1530 CA   LYS    191      0.0597     33.6871     46.0600
  1539 CA   LEU    192      0.0516     31.1681     60.1600
  1547 CA   TRP    193      0.0616     34.2643     41.8400
  1561 CA   GLN    194      0.0946     44.5290     79.1200
  1570 CA   LEU    195      0.1248     53.9308     40.2500
  1578 CA   GLY    196      0.1537     62.9555     71.2800

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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.