CNRS Nantes University US2B US2B
home |  start a new run |  job status |  references&downloads |  examples |  help  

Should you encounter any unexpected behaviour,
please let us know.
elNémo has been hacked on november 27th.
It has been moved away and runs again.
**Still some additional cleaning from time to time**
Sorry for the inconvenience.


***  wt  ***

B-factor analysis for ID 2601111120181872220

Overall B-factor prediction

Correlation= 0.757 for 318 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   HIS      0      0.1652    100.7234     39.7500
    12 CA   MET      1      0.0556     46.6745     42.9000
    20 CA   THR      2      0.0241     31.1050     28.7500
    27 CA   GLU      3      0.0198     28.9797     29.6100
    36 CA   TYR      4      0.0088     23.5521     23.2600
    48 CA   LYS      5      0.0093     23.7835     24.7800
    57 CA   LEU      6      0.0062     22.2685     19.4100
    65 CA   VAL      7      0.0065     22.4049     21.3700
    72 CA   VAL      8      0.0059     22.1345     20.8300
    79 CA   VAL      9      0.0064     22.3961     18.8900
    86 CA   GLY     10      0.0098     24.0333     20.5800
    90 CA   ALA     11      0.0134     25.8054     23.8400
    95 CA   GLY     12      0.0277     32.8799     25.3100
    99 CA   GLY     13      0.0282     33.1538     24.4600
   103 CA   VAL     14      0.0112     24.7467     24.2900
   110 CA   GLY     15      0.0117     25.0037     21.9600
   114 CA   LYS     16      0.0099     24.1027     19.7300
   123 CA   SER     17      0.0132     25.7398     24.3600
   129 CA   ALA     18      0.0141     26.1488     21.3900
   134 CA   LEU     19      0.0100     24.1331     19.1600
   142 CA   THR     20      0.0119     25.0975     22.9600
   149 CA   ILE     21      0.0165     27.3611     25.9300
   157 CA   GLN     22      0.0161     27.1672     25.2700
   166 CA   LEU     23      0.0147     26.4747     25.0400
   174 CA   ILE     24      0.0219     30.0437     30.2100
   182 CA   GLN     25      0.0348     36.3754     34.1400
   191 CA   ASN     26      0.0371     37.5015     35.6500
   199 CA   HIS     27      0.0432     40.5121     41.6500
   209 CA   PHE     28      0.0367     37.3372     34.0700
   220 CA   VAL     29      0.0434     40.6327     60.6700
   227 CA   ASP     30      0.1412     88.8751     78.5200
   235 CA   GLU     31      0.2201    127.8249     99.7700
   244 CA   TYR     32      0.1253     81.0428     94.9300
   256 CA   ASP     33      0.2443    139.7687    100.0600
   264 CA   GLU     37      0.1632     99.7544     89.1000
   273 CA   ASP     38      0.0694     53.4671     67.3400
   281 CA   SER     39      0.0187     28.4218     39.3700
   287 CA   TYR     40      0.0185     28.3385     30.0300
   299 CA   ARG     41      0.0163     27.2711     29.5200
   310 CA   LYS     42      0.0165     27.3779     30.4500
   319 CA   GLN     43      0.0227     30.4133     33.7400
   328 CA   VAL     44      0.0213     29.7100     32.4200
   335 CA   VAL     45      0.0178     28.0101     33.1400
   342 CA   ILE     46      0.0118     25.0521     23.7600
   350 CA   ASP     47      0.0092     23.7366     23.5400
   358 CA   GLY     48      0.0127     25.5027     33.0700
   362 CA   GLU     49      0.0191     28.6289     31.2900
   371 CA   THR     50      0.0222     30.1942     31.2500
   378 CA   CYS     51      0.0160     27.0924     26.7600
   384 CA   LEU     52      0.0161     27.1716     25.2600
   392 CA   LEU     53      0.0105     24.3894     25.4000
   400 CA   ASP     54      0.0113     24.7736     28.5100
   408 CA   ILE     55      0.0095     23.8820     23.9800
   416 CA   LEU     56      0.0107     24.5069     32.0900
   424 CA   ASP     57      0.0107     24.4785     49.0100
   432 CA   THR     58      0.0112     24.7376     61.6600
   439 CA   ASP     69      0.0681     52.7984     74.5600
   447 CA   GLN     70      0.0556     46.6464     81.1300
   456 CA   TYR     71      0.0147     26.4563     62.0400
   468 CA   MET     72      0.0158     27.0027     51.5500
   476 CA   ARG     73      0.0294     33.7248     49.0800
   487 CA   THR     74      0.0268     32.4634     37.7800
   494 CA   GLY     75      0.0101     24.2083     26.1100
   498 CA   GLU     76      0.0089     23.6012     22.4600
   507 CA   GLY     77      0.0061     22.2406     19.1800
   511 CA   PHE     78      0.0052     21.7726     17.5500
   522 CA   LEU     79      0.0041     21.2144     17.8200
   530 CA   CYS     80      0.0043     21.3375     21.4500
   536 CA   VAL     81      0.0060     22.1627     16.1600
   543 CA   PHE     82      0.0066     22.4821     14.2000
   554 CA   ALA     83      0.0113     24.7817     15.4300
   559 CA   ILE     84      0.0125     25.4028     19.4600
   567 CA   ASN     85      0.0210     29.5943     23.1400
   575 CA   ASN     86      0.0194     28.7640     22.5800
   583 CA   THR     87      0.0220     30.0605     21.6200
   590 CA   LYS     88      0.0290     33.5147     24.5900
   599 CA   SER     89      0.0134     25.8386     20.3400
   605 CA   PHE     90      0.0111     24.6765     21.5300
   616 CA   GLU     91      0.0224     30.2499     28.0500
   625 CA   ASP     92      0.0174     27.8176     26.1200
   633 CA   ILE     93      0.0103     24.2987     21.6000
   641 CA   HIS     94      0.0159     27.0434     28.2500
   652 CA   HIS     95      0.0202     29.1671     30.1100
   653 CA   HIS     95      0.0202     29.1689     29.8700
   671 CA   TYR     96      0.0139     26.0704     28.7400
   683 CA   ARG     97      0.0129     25.5595     28.2600
   694 CA   GLU     98      0.0176     27.8855     33.1300
   703 CA   GLN     99      0.0178     28.0223     34.3700
   712 CA   ILE    100      0.0139     26.0759     35.1400
   720 CA   LYS    101      0.0212     29.6722     40.7100
   729 CA   ARG    102      0.0321     35.0330     57.3500
   740 CA   VAL    103      0.0278     32.9462     53.1100
   747 CA   LYS    104      0.0258     31.9501     59.3200
   756 CA   ASP    105      0.0617     49.6600     66.0300
   764 CA   SER    106      0.0422     40.0385     55.7100
   770 CA   GLU    107      0.0363     37.1071     65.5100
   779 CA   ASP    108      0.0280     33.0451     56.5100
   787 CA   VAL    109      0.0099     24.1156     30.6800
   794 CA   PRO    110      0.0080     23.1527     23.1900
   801 CA   MET    111      0.0049     21.6085     20.3600
   809 CA   VAL    112      0.0046     21.4978     15.1600
   816 CA   LEU    113      0.0048     21.5922     15.9100
   824 CA   VAL    114      0.0049     21.6310     13.9000
   831 CA   GLY    115      0.0070     22.6747     12.8700
   835 CA   ASN    116      0.0080     23.1606     15.1800
   843 CA   LYS    117      0.0144     26.3391     17.9900
   852 CA   SER    118      0.0176     27.8925     23.8600
   858 CA   ASP    119      0.0367     37.3400     25.0800
   866 CA   LEU    120      0.0400     38.9435     24.6800
   874 CA   PRO    121      0.0908     64.0126     30.4400
   881 CA   SER    122      0.0637     50.6257     43.5800
   887 CA   ARG    123      0.0274     32.7168     39.0900
   898 CA   THR    124      0.0275     32.7788     32.2600
   905 CA   VAL    125      0.0168     27.5058     25.8900
   912 CA   ASP    126      0.0225     30.3127     31.3600
   920 CA   THR    127      0.0140     26.1334     32.6800
   927 CA   LYS    128      0.0181     28.1474     36.4700
   936 CA   GLN    129      0.0148     26.5277     27.1300
   945 CA   ALA    130      0.0094     23.8670     23.3700
   950 CA   GLN    131      0.0092     23.7631     25.6200
   959 CA   ASP    132      0.0125     25.3662     28.0500
   967 CA   LEU    133      0.0100     24.1621     20.3900
   975 CA   ALA    134      0.0091     23.7154     18.8500
   981 CA   ARG    135      0.0111     24.7094     20.8200
   982 CA   ARG    135      0.0111     24.7106     22.4000
  1002 CA   SER    136      0.0158     26.9897     22.8200
  1008 CA   TYR    137      0.0124     25.3223     20.4400
  1020 CA   GLY    138      0.0128     25.5344     19.5000
  1024 CA   ILE    139      0.0069     22.6353     17.5000
  1032 CA   PRO    140      0.0061     22.2235     17.6900
  1039 CA   PHE    141      0.0057     22.0257     16.6200
  1050 CA   ILE    142      0.0058     22.0618     17.5000
  1058 CA   GLU    143      0.0080     23.1734     19.7600
  1067 CA   THR    144      0.0088     23.5792     15.7400
  1074 CA   SER    145      0.0146     26.4264     17.2600
  1080 CA   ALA    146      0.0140     26.1463     23.8300
  1085 CA   LYS    147      0.0294     33.7124     27.6300
  1094 CA   THR    148      0.0328     35.4033     25.4900
  1101 CA   ARG    149      0.0177     27.9465     25.4800
  1112 CA   GLN    150      0.0185     28.3245     24.7600
  1121 CA   GLY    151      0.0116     24.9364     19.2100
  1125 CA   VAL    152      0.0100     24.1309     18.7000
  1132 CA   ASP    153      0.0095     23.9037     20.3200
  1140 CA   ASP    154      0.0073     22.8130     20.3400
  1148 CA   ALA    155      0.0060     22.1940     16.5700
  1153 CA   PHE    156      0.0057     22.0244     15.9900
  1164 CA   TYR    157      0.0063     22.3138     20.1800
  1176 CA   THR    158      0.0057     22.0261     17.2600
  1183 CA   LEU    159      0.0053     21.8531     14.7900
  1191 CA   VAL    160      0.0058     22.0652     15.5500
  1198 CA   ARG    161      0.0056     21.9568     17.5100
  1209 CA   GLU    162      0.0063     22.3038     18.5800
  1218 CA   ILE    163      0.0075     22.9374     19.0200
  1226 CA   ARG    164      0.0076     22.9781     20.6100
  1237 CA   LYS    165      0.0096     23.9307     29.5600
  1247 CA   HIS    166      0.0125     25.3597     32.1600
  1248 CA   HIS    166      0.0123     25.3056     38.2100
  1266 CA   LYS    167      0.0166     27.3842     43.8200
  1275 CA   GLU    168      0.0266     32.3282     55.9900
  1284 CA   HIS      0      0.1688    102.5361     38.3100
  1294 CA   MET      1      0.0563     46.9748     43.5200
  1302 CA   THR      2      0.0244     31.2394     30.4600
  1309 CA   GLU      3      0.0196     28.9083     29.8700
  1318 CA   TYR      4      0.0088     23.5753     23.5200
  1330 CA   LYS      5      0.0093     23.7882     23.7200
  1339 CA   LEU      6      0.0062     22.2569     18.6900
  1347 CA   VAL      7      0.0064     22.3698     22.2300
  1354 CA   VAL      8      0.0058     22.0944     20.8500
  1361 CA   VAL      9      0.0064     22.3519     19.4700
  1368 CA   GLY     10      0.0098     24.0694     20.4600
  1372 CA   ALA     11      0.0131     25.6985     24.3600
  1377 CA   GLY     12      0.0262     32.1299     25.9200
  1381 CA   GLY     13      0.0263     32.2128     22.2900
  1385 CA   VAL     14      0.0111     24.6954     23.5200
  1392 CA   GLY     15      0.0116     24.9453     20.9600
  1396 CA   LYS     16      0.0097     24.0232     20.9400
  1405 CA   SER     17      0.0131     25.7036     24.7700
  1411 CA   ALA     18      0.0140     26.1369     21.4900
  1416 CA   LEU     19      0.0100     24.1252     20.5300
  1424 CA   THR     20      0.0119     25.0927     23.0500
  1431 CA   ILE     21      0.0166     27.4041     26.6400
  1439 CA   GLN     22      0.0162     27.1897     25.7300
  1448 CA   LEU     23      0.0147     26.4759     26.1700
  1456 CA   ILE     24      0.0220     30.0862     30.4100
  1464 CA   GLN     25      0.0349     36.4364     36.0400
  1473 CA   ASN     26      0.0368     37.3626     35.4000
  1481 CA   HIS     27      0.0427     40.2788     42.2100
  1491 CA   PHE     28      0.0365     37.2036     36.4800
  1502 CA   VAL     29      0.0432     40.5234     63.6100
  1509 CA   ASP     30      0.1394     87.9826     76.6800
  1517 CA   GLU     31      0.2183    126.9150     99.7400
  1526 CA   TYR     32      0.1267     81.7284     97.1400
  1538 CA   ASP     33      0.2627    148.8488     97.1500
  1546 CA   GLU     37      0.1606     98.4646     87.9900
  1555 CA   ASP     38      0.0696     53.5534     65.8900
  1563 CA   SER     39      0.0186     28.3764     39.4000
  1569 CA   TYR     40      0.0185     28.3378     30.1300
  1581 CA   ARG     41      0.0165     27.3767     28.6000
  1592 CA   LYS     42      0.0168     27.4821     30.0700
  1601 CA   GLN     43      0.0229     30.5159     31.4800
  1610 CA   VAL     44      0.0214     29.7962     31.3100
  1617 CA   VAL     45      0.0178     28.0053     29.7400
  1624 CA   ILE     46      0.0117     24.9789     24.2200
  1632 CA   ASP     47      0.0091     23.7231     23.1400
  1640 CA   GLY     48      0.0126     25.4559     33.5200
  1644 CA   GLU     49      0.0191     28.6561     32.4500
  1653 CA   THR     50      0.0221     30.1414     32.8700
  1660 CA   CYS     51      0.0161     27.1388     27.3500
  1666 CA   LEU     52      0.0162     27.2133     24.6300
  1674 CA   LEU     53      0.0105     24.4078     24.6600
  1682 CA   ASP     54      0.0113     24.7965     28.0900
  1690 CA   ILE     55      0.0094     23.8589     25.8800
  1698 CA   LEU     56      0.0106     24.4661     33.3500
  1706 CA   ASP     57      0.0106     24.4688     47.9000
  1714 CA   THR     58      0.0112     24.7190     58.3300
  1721 CA   ASP     69      0.0668     52.1842     74.0700
  1729 CA   GLN     70      0.0548     46.2793     81.1500
  1738 CA   TYR     71      0.0145     26.3667     60.9100
  1750 CA   MET     72      0.0155     26.8863     51.6500
  1758 CA   ARG     73      0.0292     33.6382     47.2200
  1769 CA   THR     74      0.0266     32.3170     38.1300
  1776 CA   GLY     75      0.0100     24.1251     25.6800
  1780 CA   GLU     76      0.0089     23.6091     22.2800
  1789 CA   GLY     77      0.0062     22.2569     19.8800
  1793 CA   PHE     78      0.0052     21.7788     16.9700
  1804 CA   LEU     79      0.0040     21.1979     17.3600
  1812 CA   CYS     80      0.0043     21.3199     22.1300
  1818 CA   VAL     81      0.0060     22.1667     16.2500
  1825 CA   PHE     82      0.0067     22.4970     13.9500
  1836 CA   ALA     83      0.0114     24.8319     15.3700
  1841 CA   ILE     84      0.0126     25.4170     19.2500
  1849 CA   ASN     85      0.0210     29.5755     22.9800
  1857 CA   ASN     86      0.0195     28.8275     22.1900
  1865 CA   THR     87      0.0219     30.0113     22.1100
  1872 CA   LYS     88      0.0298     33.9116     24.8800
  1881 CA   SER     89      0.0134     25.8404     19.7800
  1887 CA   PHE     90      0.0112     24.7219     20.2800
  1898 CA   GLU     91      0.0225     30.3333     26.3700
  1907 CA   ASP     92      0.0173     27.7624     24.7000
  1915 CA   ILE     93      0.0103     24.3123     21.9500
  1923 CA   HIS     94      0.0155     26.8572     27.6800
  1934 CA   HIS     95      0.0199     29.0175     26.4900
  1935 CA   HIS     95      0.0198     29.0060     25.6100
  1953 CA   TYR     96      0.0135     25.8560     27.7900
  1965 CA   ARG     97      0.0127     25.4660     27.3800
  1976 CA   GLU     98      0.0175     27.8462     34.3200
  1985 CA   GLN     99      0.0175     27.8388     35.4400
  1994 CA   ILE    100      0.0137     25.9949     33.8300
  2002 CA   LYS    101      0.0209     29.5270     39.1200
  2011 CA   ARG    102      0.0306     34.3114     57.6000
  2022 CA   VAL    103      0.0270     32.5246     53.1800
  2029 CA   LYS    104      0.0250     31.5415     62.0800
  2038 CA   ASP    105      0.0607     49.1545     66.5000
  2046 CA   SER    106      0.0411     39.5029     51.1900
  2052 CA   GLU    107      0.0366     37.2815     64.6200
  2061 CA   ASP    108      0.0270     32.5164     56.1000
  2069 CA   VAL    109      0.0101     24.2103     32.3700
  2076 CA   PRO    110      0.0082     23.2629     24.3200
  2083 CA   MET    111      0.0049     21.6176     19.9300
  2091 CA   VAL    112      0.0046     21.4924     15.0000
  2098 CA   LEU    113      0.0048     21.5893     14.5900
  2106 CA   VAL    114      0.0049     21.6242     14.0700
  2113 CA   GLY    115      0.0070     22.6773     13.6500
  2117 CA   ASN    116      0.0080     23.1499     15.4100
  2125 CA   LYS    117      0.0143     26.2950     18.2900
  2134 CA   SER    118      0.0175     27.8379     24.0400
  2140 CA   ASP    119      0.0366     37.2561     24.9000
  2148 CA   LEU    120      0.0398     38.8365     23.7900
  2156 CA   PRO    121      0.0911     64.1812     31.5000
  2163 CA   SER    122      0.0640     50.7989     48.4700
  2169 CA   ARG    123      0.0275     32.8014     39.9000
  2180 CA   THR    124      0.0274     32.7288     31.0000
  2187 CA   VAL    125      0.0168     27.5039     26.2600
  2194 CA   ASP    126      0.0224     30.2515     34.7500
  2202 CA   THR    127      0.0143     26.2590     36.9100
  2209 CA   LYS    128      0.0185     28.3294     36.9300
  2218 CA   GLN    129      0.0149     26.5859     27.5800
  2227 CA   ALA    130      0.0094     23.8590     20.9300
  2232 CA   GLN    131      0.0092     23.7533     25.5500
  2241 CA   ASP    132      0.0125     25.3774     28.3000
  2249 CA   LEU    133      0.0101     24.1809     21.7800
  2257 CA   ALA    134      0.0091     23.6884     18.3800
  2263 CA   ARG    135      0.0110     24.6201     21.6900
  2264 CA   ARG    135      0.0109     24.6184     20.8800
  2284 CA   SER    136      0.0155     26.8822     22.4300
  2290 CA   TYR    137      0.0123     25.3084     20.7600
  2302 CA   GLY    138      0.0128     25.5404     19.3300
  2306 CA   ILE    139      0.0070     22.6698     17.3000
  2314 CA   PRO    140      0.0062     22.2515     16.1700
  2321 CA   PHE    141      0.0057     22.0081     15.1100
  2332 CA   ILE    142      0.0057     22.0399     16.5600
  2340 CA   GLU    143      0.0080     23.1418     20.5900
  2349 CA   THR    144      0.0088     23.5396     17.5400
  2356 CA   SER    145      0.0146     26.3977     17.3900
  2362 CA   ALA    146      0.0140     26.1239     22.2800
  2367 CA   LYS    147      0.0293     33.6849     28.3400
  2376 CA   THR    148      0.0326     35.2886     25.8500
  2383 CA   ARG    149      0.0176     27.9023     26.0300
  2394 CA   GLN    150      0.0183     28.2410     23.7100
  2403 CA   GLY    151      0.0115     24.8662     20.4400
  2407 CA   VAL    152      0.0099     24.1167     18.0500
  2414 CA   ASP    153      0.0096     23.9518     21.3300
  2422 CA   ASP    154      0.0073     22.8261     22.3000
  2430 CA   ALA    155      0.0060     22.1951     15.7700
  2435 CA   PHE    156      0.0057     22.0318     16.1300
  2446 CA   TYR    157      0.0063     22.3368     18.7500
  2458 CA   THR    158      0.0057     22.0351     15.9800
  2465 CA   LEU    159      0.0053     21.8422     14.2700
  2473 CA   VAL    160      0.0057     22.0496     17.0700
  2480 CA   ARG    161      0.0055     21.9087     17.7500
  2491 CA   GLU    162      0.0061     22.2310     18.7200
  2500 CA   ILE    163      0.0075     22.8938     18.5500
  2508 CA   ARG    164      0.0075     22.9328     22.4400
  2519 CA   LYS    165      0.0094     23.8505     30.3900
  2529 CA   HIS    166      0.0120     25.1176     37.0800
  2530 CA   HIS    166      0.0119     25.1037     28.1600
  2548 CA   LYS    167      0.0156     26.9227     41.1100
  2557 CA   GLU    168      0.0256     31.8604     54.6000

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).
Between 2015 and 2025, it was hosted by US2B (Nantes).
Last modification: december 26th, 2025.