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***  1q18  ***

B-factor analysis for ID 22042405255378885

Overall B-factor prediction

Correlation= 0.782 for 316 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   THR      2      0.0987     40.9958     42.1800
     9 CA   LYS      3      0.0702     34.9905     34.9600
    18 CA   TYR      4      0.0352     27.6366     30.4400
    30 CA   ALA      5      0.0219     24.8274     24.9600
    35 CA   LEU      6      0.0135     23.0569     22.3600
    43 CA   VAL      7      0.0111     22.5522     20.0600
    50 CA   GLY      8      0.0146     23.2840     22.3400
    54 CA   ASP      9      0.0204     24.5084     26.9300
    62 CA   VAL     10      0.0342     27.4184     27.6700
    69 CA   GLY     11      0.0591     32.6544     34.5400
    73 CA   GLY     12      0.1037     42.0467     39.1700
    77 CA   THR     13      0.1099     43.3680     39.8500
    84 CA   ASN     14      0.0735     35.6937     36.0100
    92 CA   ALA     15      0.0434     29.3537     30.0600
    97 CA   ARG     16      0.0329     27.1553     28.5300
   108 CA   LEU     17      0.0229     25.0481     25.4800
   116 CA   ALA     18      0.0237     25.2152     24.3400
   121 CA   LEU     19      0.0239     25.2453     25.0500
   129 CA   CYS     20      0.0224     24.9396     26.5200
   135 CA   ASP     21      0.0365     27.8956     29.9600
   143 CA   ILE     22      0.0386     28.3544     31.5500
   151 CA   ALA     23      0.0616     33.1841     34.8700
   156 CA   SER     24      0.0625     33.3691     34.5300
   162 CA   GLY     25      0.0374     28.0875     32.0300
   166 CA   GLU     26      0.0430     29.2780     34.0500
   175 CA   ILE     27      0.0296     26.4551     31.5300
   183 CA   SER     28      0.0450     29.6942     31.7600
   189 CA   GLN     29      0.0507     30.9010     32.8200
   198 CA   ALA     30      0.0422     29.0961     33.8100
   203 CA   LYS     31      0.0496     30.6642     33.2700
   212 CA   THR     32      0.0594     32.7204     32.5900
   219 CA   TYR     33      0.0639     33.6786     34.7000
   231 CA   SER     34      0.0955     40.3202     38.9000
   237 CA   GLY     35      0.0850     38.1084     41.3100
   241 CA   LEU     36      0.1458     50.9223     43.5700
   249 CA   ASP     37      0.1335     48.3197     40.0500
   257 CA   TYR     38      0.0875     38.6463     35.5500
   269 CA   PRO     39      0.0966     40.5506     35.9000
   276 CA   SER     40      0.0614     33.1553     32.3900
   282 CA   LEU     41      0.0393     28.4887     27.5200
   290 CA   GLU     42      0.0405     28.7526     26.7900
   304 CA   ALA     43      0.0513     31.0297     29.6200
   309 CA   VAL     44      0.0421     29.0787     30.3000
   316 CA   ILE     45      0.0301     26.5598     28.9200
   324 CA   ARG     46      0.0445     29.5944     28.6900
   335 CA   VAL     47      0.0536     31.4955     29.4000
   342 CA   TYR     48      0.0406     28.7736     28.1000
   354 CA   LEU     49      0.0419     29.0505     30.5200
   362 CA   GLU     50      0.0763     36.2859     36.4900
   371 CA   GLU     51      0.0787     36.7835     36.0200
   380 CA   HIS     52      0.0679     34.5176     35.9900
   390 CA   LYS     53      0.0924     39.6680     37.4700
   399 CA   VAL     54      0.0654     33.9892     35.9500
   406 CA   GLU     55      0.0692     34.7909     31.9700
   415 CA   VAL     56      0.0405     28.7566     29.1000
   422 CA   LYS     57      0.0430     29.2632     31.1500
   431 CA   ASP     58      0.0236     25.1868     26.6700
   439 CA   GLY     59      0.0149     23.3556     21.7100
   443 CA   CYS     60      0.0103     22.3828     20.2800
   449 CA   ILE     61      0.0120     22.7384     19.1000
   457 CA   ALA     62      0.0160     23.5884     21.0400
   462 CA   ILE     63      0.0269     25.8860     25.6500
   470 CA   ALA     64      0.0491     30.5628     31.8200
   475 CA   CYS     65      0.0601     32.8691     39.7700
   482 CA   PRO     66      0.0727     35.5245     41.6300
   489 CA   ILE     67      0.0574     32.2954     41.1900
   497 CA   THR     68      0.1544     52.7303     39.5200
   504 CA   GLY     69      0.1475     51.2806     31.7300
   508 CA   ASP     70      0.0889     38.9406     26.7100
   516 CA   TRP     71      0.0842     37.9492     25.4100
   530 CA   VAL     72      0.0590     32.6385     30.2100
   537 CA   ALA     73      0.0849     38.0964     37.6600
   542 CA   THR     75      0.1253     46.5957     55.4600
   549 CA   ASN     76      0.1137     44.1680     56.5300
   557 CA   HIS     77      0.1419     50.0939     53.3700
   567 CA   THR     78      0.1372     49.1061     46.0400
   574 CA   TRP     79      0.0752     36.0485     37.0200
   588 CA   ALA     80      0.0794     36.9353     29.2100
   593 CA   PHE     81      0.0610     33.0655     22.5600
   604 CA   SER     82      0.0641     33.7201     22.5200
   610 CA   ILE     83      0.0472     30.1501     23.1300
   618 CA   ALA     84      0.0658     34.0821     26.7200
   623 CA   GLU     85      0.0694     34.8290     31.2400
   632 CA   LYS     87      0.0447     29.6227     29.8700
   641 CA   LYS     88      0.0747     35.9441     33.2500
   650 CA   ASN     89      0.0629     33.4564     32.3900
   658 CA   LEU     90      0.0494     30.6275     33.1400
   666 CA   GLY     91      0.0572     32.2601     34.1100
   670 CA   PHE     92      0.0418     29.0139     32.0400
   681 CA   SER     93      0.0519     31.1545     30.4100
   687 CA   HIS     94      0.0355     27.6847     27.3400
   697 CA   LEU     95      0.0228     25.0167     23.5800
   705 CA   GLU     96      0.0195     24.3158     22.1600
   715 CA   ILE     97      0.0186     24.1301     23.0000
   716 CA   ILE     97      0.0189     24.2017     21.9700
   730 CA   ILE     98      0.0197     24.3649     22.3200
   738 CA   ASN     99      0.0259     25.6668     22.4600
   746 CA   ASP    100      0.0242     25.3112     24.3900
   754 CA   PHE    101      0.0193     24.2802     25.0800
   765 CA   THR    102      0.0181     24.0231     24.1300
   772 CA   ALA    103      0.0148     23.3301     22.8400
   777 CA   VAL    104      0.0158     23.5505     24.0500
   784 CA   SER    105      0.0145     23.2668     23.2300
   790 CA   ALA    107      0.0149     23.3541     25.6700
   795 CA   ILE    108      0.0127     22.8949     29.1800
   803 CA   PRO    109      0.0212     24.6840     31.7100
   810 CA   LEU    111      0.0303     26.5931     36.7400
   818 CA   LYS    112      0.0452     29.7428     41.0700
   827 CA   LYS    113      0.0488     30.4859     41.4000
   836 CA   GLU    114      0.0589     32.6197     38.4400
   845 CA   HIS    115      0.0263     25.7630     34.6600
   855 CA   LEU    116      0.0215     24.7425     31.0300
   863 CA   ILE    117      0.0196     24.3429     27.7600
   871 CA   GLN    118      0.0173     23.8680     24.4300
   880 CA   PHE    119      0.0144     23.2415     23.6200
   891 CA   GLY    120      0.0181     24.0296     22.3800
   895 CA   GLY    121      0.0226     24.9761     25.3600
   899 CA   ALA    122      0.0326     27.0853     30.3200
   904 CA   GLU    123      0.0372     28.0613     34.2500
   913 CA   PRO    124      0.0306     26.6542     31.3000
   920 CA   VAL    125      0.0410     28.8544     31.9000
   927 CA   GLU    126      0.0570     32.2287     34.7500
   936 CA   GLY    127      0.0391     28.4552     30.0600
   940 CA   LYS    128      0.0277     26.0439     26.0600
   949 CA   PRO    129      0.0186     24.1255     22.1800
   956 CA   ILE    130      0.0147     23.3135     21.8200
   964 CA   ALA    131      0.0125     22.8554     22.5600
   969 CA   VAL    132      0.0120     22.7558     22.2000
   976 CA   TYR    133      0.0128     22.9228     21.1400
   988 CA   GLY    134      0.0148     23.3343     23.9500
   992 CA   ALA    135      0.0206     24.5597     27.7000
   997 CA   GLY    136      0.0335     27.2712     29.5000
  1001 CA   THR    137      0.0735     35.7038     30.5600
  1008 CA   GLY    138      0.0412     28.9007     28.8000
  1012 CA   LEU    139      0.0222     24.8890     27.0000
  1020 CA   GLY    140      0.0232     25.0990     22.3900
  1024 CA   VAL    141      0.0166     23.7134     20.5000
  1031 CA   ALA    142      0.0165     23.6984     18.7900
  1036 CA   HIS    143      0.0174     23.8772     21.4300
  1046 CA   LEU    144      0.0174     23.8843     22.6700
  1054 CA   VAL    145      0.0270     25.9077     26.4700
  1061 CA   HIS    146      0.0291     26.3419     31.5200
  1071 CA   VAL    147      0.0615     33.1720     35.2600
  1078 CA   ASP    148      0.1002     41.3147     39.7000
  1086 CA   LYS    149      0.0651     33.9283     39.0300
  1095 CA   ARG    150      0.0353     27.6566     35.2900
  1106 CA   TRP    151      0.0241     25.2949     30.8100
  1120 CA   VAL    152      0.0312     26.7894     29.4600
  1127 CA   SER    153      0.0250     25.4766     30.4400
  1133 CA   LEU    154      0.0296     26.4457     25.9000
  1141 CA   PRO    155      0.0354     27.6719     24.7600
  1148 CA   GLY    156      0.0536     31.5019     23.6200
  1152 CA   GLU    157      0.0575     32.3192     26.2700
  1161 CA   GLY    158      0.0348     27.5512     25.5300
  1165 CA   GLY    159      0.0275     26.0044     25.2300
  1169 CA   HIS    160      0.0366     27.9227     25.3600
  1179 CA   VAL    161      0.0396     28.5669     23.8600
  1186 CA   ASP    162      0.0439     29.4727     25.0600
  1194 CA   PHE    163      0.0266     25.8281     27.6600
  1205 CA   ALA    164      0.0271     25.9230     26.9000
  1210 CA   PRO    165      0.0307     26.6930     27.5100
  1217 CA   ASN    166      0.0448     29.6465     31.6300
  1225 CA   SER    167      0.0734     35.6782     35.8800
  1231 CA   GLU    168      0.0934     39.8794     38.5000
  1240 CA   GLU    169      0.0438     29.4337     35.0800
  1249 CA   GLU    170      0.0295     26.4391     32.4000
  1258 CA   ALA    171      0.0453     29.7663     31.9200
  1263 CA   ILE    172      0.0500     30.7366     31.2800
  1271 CA   ILE    173      0.0311     26.7626     29.1000
  1279 CA   LEU    174      0.0346     27.4982     29.8800
  1287 CA   GLU    175      0.0566     32.1305     34.6400
  1296 CA   ILE    176      0.0501     30.7686     33.8900
  1304 CA   LEU    177      0.0432     29.3073     34.6200
  1312 CA   ARG    178      0.0629     33.4724     36.3200
  1323 CA   ALA    179      0.0910     39.3769     39.5900
  1328 CA   GLU    180      0.0928     39.7639     43.9600
  1337 CA   ILE    181      0.0911     39.3933     43.4200
  1345 CA   GLY    182      0.0977     40.7962     40.0000
  1349 CA   HIS    183      0.0726     35.5033     35.4900
  1359 CA   VAL    184      0.0407     28.7802     30.1600
  1366 CA   SER    185      0.0301     26.5629     28.8000
  1372 CA   ALA    186      0.0198     24.3778     26.0100
  1377 CA   GLU    187      0.0235     25.1756     26.7400
  1386 CA   ARG    188      0.0257     25.6396     30.1700
  1397 CA   VAL    189      0.0160     23.5817     30.7600
  1404 CA   LEU    190      0.0144     23.2430     25.2700
  1412 CA   SER    191      0.0229     25.0422     23.9300
  1418 CA   GLY    192      0.0317     26.8949     25.4100
  1422 CA   PRO    193      0.0370     28.0158     27.3500
  1429 CA   GLY    194      0.0238     25.2234     25.4700
  1433 CA   LEU    195      0.0223     24.9172     26.2200
  1441 CA   VAL    196      0.0329     27.1512     25.8900
  1448 CA   ASN    197      0.0285     26.2112     26.6200
  1456 CA   LEU    198      0.0206     24.5500     24.8500
  1464 CA   TYR    199      0.0306     26.6718     27.3700
  1476 CA   ARG    200      0.0399     28.6247     29.3300
  1487 CA   ALA    201      0.0361     27.8232     29.5400
  1492 CA   ILE    202      0.0348     27.5503     28.7900
  1500 CA   VAL    203      0.0541     31.6181     31.2100
  1507 CA   LYS    204      0.0656     34.0216     35.0600
  1516 CA   ALA    205      0.0813     37.3285     34.3800
  1521 CA   ASP    206      0.1025     41.8011     34.2900
  1529 CA   ASN    207      0.1413     49.9627     34.9400
  1537 CA   ARG    208      0.1224     45.9872     33.1000
  1548 CA   LEU    209      0.1222     45.9425     35.9600
  1556 CA   PRO    210      0.0821     37.5078     37.3500
  1563 CA   GLU    211      0.1069     42.7369     38.4400
  1572 CA   ASN    212      0.1233     46.1902     39.3400
  1580 CA   LEU    213      0.0720     35.3786     35.8600
  1588 CA   LYS    214      0.0745     35.8987     34.9800
  1597 CA   PRO    215      0.0483     30.3975     31.5400
  1604 CA   LYS    216      0.0600     32.8425     32.5700
  1613 CA   ASP    217      0.0606     32.9727     30.5800
  1621 CA   ILE    218      0.0380     28.2238     28.0500
  1629 CA   THR    219      0.0365     27.9101     29.0500
  1636 CA   GLU    220      0.0579     32.4083     31.6700
  1645 CA   ARG    221      0.0561     32.0337     31.5400
  1656 CA   ALA    222      0.0411     28.8631     31.1400
  1661 CA   LEU    223      0.0508     30.9048     34.6300
  1669 CA   ALA    224      0.0824     37.5674     35.1100
  1674 CA   ASP    225      0.0845     38.0198     34.2500
  1682 CA   SER    226      0.0955     40.3330     32.2700
  1688 CA   CYS    227      0.0659     34.0900     30.7700
  1694 CA   THR    228      0.0597     32.7786     30.5400
  1701 CA   ASP    229      0.0405     28.7501     29.2000
  1709 CA   CYS    230      0.0343     27.4391     28.3300
  1715 CA   ARG    231      0.0326     27.0742     29.1100
  1726 CA   ARG    232      0.0287     26.2715     28.3200
  1737 CA   ALA    233      0.0196     24.3436     27.0400
  1742 CA   LEU    234      0.0175     23.9021     23.7800
  1750 CA   SER    235      0.0175     23.9122     22.8800
  1756 CA   LEU    236      0.0137     23.0991     22.6300
  1764 CA   PHE    237      0.0108     22.4928     21.7700
  1775 CA   CYS    238      0.0106     22.4484     21.6300
  1781 CA   VAL    239      0.0107     22.4752     21.0600
  1788 CA   ILE    240      0.0096     22.2444     21.1600
  1796 CA   GLY    242      0.0100     22.3300     21.1400
  1800 CA   ARG    243      0.0106     22.4458     23.2200
  1811 CA   PHE    244      0.0101     22.3536     20.7300
  1822 CA   GLY    245      0.0101     22.3540     20.3300
  1826 CA   GLY    246      0.0116     22.6651     19.7600
  1830 CA   ASN    247      0.0158     23.5524     19.3400
  1838 CA   LEU    248      0.0145     23.2681     18.5700
  1846 CA   ALA    249      0.0136     23.0879     19.6600
  1851 CA   LEU    250      0.0230     25.0725     21.0700
  1859 CA   ASN    251      0.0354     27.6707     22.1500
  1867 CA   LEU    252      0.0262     25.7279     23.1900
  1875 CA   GLY    253      0.0245     25.3814     23.3000
  1879 CA   THR    254      0.0172     23.8329     24.0800
  1886 CA   PHE    255      0.0199     24.4046     24.2100
  1897 CA   GLY    256      0.0181     24.0392     23.6000
  1901 CA   GLY    257      0.0139     23.1493     22.3000
  1905 CA   VAL    258      0.0101     22.3530     21.4400
  1912 CA   PHE    259      0.0110     22.5293     22.7400
  1923 CA   ILE    260      0.0117     22.6883     24.2500
  1931 CA   ALA    261      0.0149     23.3668     29.9400
  1936 CA   GLY    262      0.0196     24.3547     33.2400
  1940 CA   GLY    263      0.0275     26.0108     29.7500
  1944 CA   ILE    264      0.0272     25.9534     28.1400
  1952 CA   VAL    265      0.0211     24.6712     29.4700
  1959 CA   PRO    266      0.0334     27.2425     33.3300
  1966 CA   ARG    267      0.0372     28.0615     36.6300
  1977 CA   PHE    268      0.0296     26.4418     32.0600
  1988 CA   LEU    269      0.0286     26.2374     30.5200
  1996 CA   GLU    270      0.0438     29.4353     30.8300
  2005 CA   PHE    271      0.0293     26.3909     26.8700
  2016 CA   PHE    272      0.0189     24.2037     25.2600
  2027 CA   LYS    273      0.0288     26.2928     24.4600
  2036 CA   ALA    274      0.0437     29.4207     23.8400
  2041 CA   SER    275      0.0237     25.1994     21.3800
  2047 CA   GLY    276      0.0171     23.8110     20.2600
  2051 CA   PHE    277      0.0114     22.6186     21.1000
  2062 CA   ARG    278      0.0145     23.2636     20.0700
  2073 CA   ALA    279      0.0197     24.3568     21.3400
  2078 CA   ALA    280      0.0147     23.3208     20.5300
  2083 CA   PHE    281      0.0110     22.5317     19.7000
  2094 CA   GLU    282      0.0205     24.5304     21.7900
  2103 CA   ASP    283      0.0295     26.4293     24.1300
  2111 CA   LYS    284      0.0378     28.1884     24.8600
  2120 CA   GLY    285      0.0708     35.1294     27.0700
  2124 CA   ARG    286      0.1129     43.9871     29.9600
  2135 CA   PHE    287      0.0529     31.3485     25.7000
  2146 CA   LYS    288      0.0387     28.3593     28.1300
  2155 CA   GLU    289      0.0495     30.6342     31.1000
  2164 CA   TYR    290      0.0320     26.9648     26.8200
  2176 CA   VAL    291      0.0210     24.6467     26.4300
  2183 CA   HIS    292      0.0263     25.7594     28.7000
  2193 CA   ASP    293      0.0285     26.2234     28.4900
  2201 CA   ILE    294      0.0156     23.4996     24.0400
  2209 CA   PRO    295      0.0154     23.4542     21.0600
  2216 CA   VAL    296      0.0115     22.6485     20.6700
  2223 CA   TYR    297      0.0134     23.0403     23.9100
  2235 CA   LEU    298      0.0143     23.2353     24.8900
  2243 CA   ILE    299      0.0159     23.5728     24.1200
  2251 CA   VAL    300      0.0242     25.3234     28.9100
  2258 CA   HIS    301      0.0233     25.1352     33.9300
  2268 CA   ASP    302      0.0670     34.3253     36.8000
  2276 CA   ASN    303      0.0309     26.7212     31.2900
  2284 CA   PRO    304      0.0183     24.0633     27.5200
  2291 CA   GLY    305      0.0176     23.9159     24.8300
  2295 CA   LEU    306      0.0155     23.4860     23.4800
  2303 CA   LEU    307      0.0149     23.3511     22.9700
  2311 CA   GLY    308      0.0132     22.9920     21.0400
  2315 CA   SER    309      0.0099     22.2981     21.8300
  2321 CA   GLY    310      0.0121     22.7609     21.6400
  2325 CA   ALA    311      0.0155     23.4828     22.5300
  2330 CA   HIS    312      0.0164     23.6797     23.2000
  2340 CA   LEU    313      0.0152     23.4167     22.9100
  2348 CA   ARG    314      0.0239     25.2608     25.5600
  2359 CA   GLN    315      0.0251     25.5068     27.3600
  2368 CA   THR    316      0.0347     27.5349     30.0100
  2375 CA   LEU    317      0.0421     29.0799     32.5300
  2383 CA   GLY    318      0.0580     32.4256     34.0100
  2387 CA   HIS    319      0.0447     29.6244     33.1700
  2397 CA   ILE    320      0.0480     30.3330     33.5300
  2405 CA   LEU    321      0.0420     29.0699     32.1100

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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.