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.


***    ***

B-factor analysis for ID 2404140326584161007

Overall B-factor prediction

Correlation= 0.400 for 208 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
     1 CA   SER     963424792.8398     99.9441     55.3600
     2 CA   VAL     972536730.3765     78.6384     38.3800
     3 CA   PRO     981273761.0602     48.3383     27.6600
     4 CA   SER     99 275625.2946     24.3919     22.2600
     5 CA   GLN    100    563.2167     17.7928     20.5000
     6 CA   LYS    101    696.4810     17.7960     15.4900
     7 CA   THR    102    684.1733     17.7957     15.2600
     8 CA   TYR    103    783.3249     17.7981     17.2600
     9 CA   GLN    104    803.1464     17.7986     16.4800
    10 CA   GLY    105    903.8074     17.8010     15.9500
    11 CA   SER    106    999.9179     17.8033     22.5100
    12 CA   TYR    107    892.1319     17.8007     19.2900
    13 CA   GLY    108    875.5009     17.8003     19.7500
    14 CA   PHE    109    707.4513     17.7963     12.6900
    15 CA   ARG    110    628.7040     17.7944     13.4800
    16 CA   LEU    111    493.5879     17.7911     15.3800
    17 CA   GLY    112    462.3722     17.7904      9.6000
    18 CA   PHE    113    361.4532     17.7880     14.5200
    19 CA   LEU    114    350.4627     17.7877     14.5700
    20 CA   HIS    115    363.5031     17.7880     14.1500
    21 CA   SER    116    272.2878     17.7858     12.9600
    22 CA   SER    116    273.0797     17.7858     12.9500
    23 CA   GLY    117    245.5384     17.7852     11.4800
    24 CA   THR    118    162.9213     17.7832     13.6900
    25 CA   ALA    119    149.2859     17.7829     13.6300
    26 CA   LYS    120     93.5497     17.7815     15.4900
    27 CA   SER    121    123.5417     17.7823     18.5000
    28 CA   VAL    122    128.6094     17.7824     14.9700
    29 CA   VAL    122    128.9463     17.7824     15.7800
    30 CA   THR    123     95.1653     17.7816     19.2600
    31 CA   CYS    124    137.9106     17.7826     13.5300
    32 CA   CYS    124    136.6724     17.7826     13.9200
    33 CA   THR    125    181.5095     17.7836     15.3400
    34 CA   TYR    126    245.4124     17.7852     14.7900
    35 CA   SER    127    278.2398     17.7860     19.1200
    36 CA   PRO    128    394.7854     17.7888     17.1300
    37 CA   ALA    129    396.3439     17.7888     19.0100
    38 CA   LEU    130    338.7155     17.7874     21.1100
    39 CA   ASN    131    362.5590     17.7880     18.8500
    40 CA   LYS    132    257.2446     17.7855     18.7300
    41 CA   MET    133    196.8635     17.7840     14.9600
    42 CA   MET    133    196.4170     17.7840     14.8400
    43 CA   PHE    134    125.1095     17.7823     15.9800
    44 CA   CYS    135     88.8665     17.7814     14.0900
    45 CA   GLN    136     45.6687     17.7804     13.6700
    46 CA   LEU    137     28.7446     17.7800     17.2900
    47 CA   ALA    138     35.8834     17.7802     15.4800
    48 CA   LYS    139     65.9023     17.7809     11.7400
    49 CA   THR    140    120.6717     17.7822     14.4900
    50 CA   CYS    141    157.5422     17.7831     14.4000
    51 CA   CYS    141    157.4299     17.7831     14.3600
    52 CA   PRO    142    240.3484     17.7851     16.4400
    53 CA   VAL    143    301.9502     17.7865     14.0100
    54 CA   GLN    144    412.2362     17.7892     10.6200
    55 CA   LEU    145    500.9947     17.7913     12.2400
    56 CA   TRP    146    635.6836     17.7945     11.7100
    57 CA   VAL    147    764.4750     17.7976     15.8400
    58 CA   ASP    148    939.2109     17.8018     17.2500
    59 CA   SER    149    960.2630     17.8023     20.2400
    60 CA   THR    150    854.2762     17.7998     25.2300
    61 CA   PRO    151    783.6073     17.7981     26.3600
    62 CA   PRO    152    787.0895     17.7982     31.8900
    63 CA   PRO    153    641.3858     17.7947     34.9300
    64 CA   GLY    154    559.2585     17.7927     18.1600
    65 CA   THR    155    564.8665     17.7928     12.9300
    66 CA   ARG    156    447.5312     17.7900     12.5800
    67 CA   VAL    157    398.1040     17.7888     11.2600
    68 CA   ARG    158    342.6822     17.7875     13.1300
    69 CA   ALA    159    282.3140     17.7861     15.5800
    70 CA   MET    160    274.5386     17.7859     15.5800
    71 CA   ALA    161    244.9867     17.7852     11.8000
    72 CA   ILE    162    308.6336     17.7867     16.4700
    73 CA   TYR    163    309.9034     17.7867     17.1700
    74 CA   LYS    164    357.2219     17.7879     21.8100
    75 CA   GLN    165    410.9815     17.7892     22.7400
    76 CA   SER    166    534.1443     17.7921     24.1900
    77 CA   GLN    167    527.4952     17.7919     22.5600
    78 CA   HIS    168    411.1681     17.7892     22.2500
    79 CA   MET    169    452.6290     17.7902     22.8300
    80 CA   MET    169    437.5363     17.7898     22.7300
    81 CA   THR    170    487.0729     17.7910     21.3000
    82 CA   GLU    171    374.1332     17.7883     19.7800
    83 CA   VAL    172    295.6855     17.7864     18.4800
    84 CA   VAL    173    215.6974     17.7845     14.4800
    85 CA   ARG    174    152.0793     17.7829     15.6200
    86 CA   ARG    175     91.9093     17.7815     16.3100
    87 CA   CYS    176     94.4171     17.7816     19.0000
    88 CA   PRO    177    107.9686     17.7819     24.3100
    89 CA   HIS    178     69.7168     17.7810     22.6000
    90 CA   HIS    179     36.7232     17.7802     19.4600
    91 CA   GLU    180     58.3194     17.7807     22.1600
    92 CA   ARG    181     58.1758     17.7807     35.5000
    93 CA   CYS    182     34.6411     17.7801     45.2700
    94 CA   SER    183     26.9583     17.7799     56.1400
    95 CA   ASP    184     22.7867     17.7798     43.5900
    96 CA   SER    185     34.1046     17.7801     45.5700
    97 CA   ASP    186     52.5089     17.7806     33.9300
    98 CA   GLY    187     45.5820     17.7804     31.8100
    99 CA   LEU    188     65.0882     17.7809     28.0700
   100 CA   ALA    189     66.1491     17.7809     19.6600
   101 CA   PRO    190     72.5054     17.7810     17.7600
   102 CA   PRO    191     50.8556     17.7805     19.6000
   103 CA   GLN    192     91.6492     17.7815     18.1900
   104 CA   GLN    192     92.0053     17.7815     18.4600
   105 CA   HIS    193    102.0281     17.7817     13.3900
   106 CA   LEU    194     97.3068     17.7816     13.9500
   107 CA   ILE    195    118.5106     17.7821     13.5600
   108 CA   ARG    196    102.1631     17.7817     13.0000
   109 CA   VAL    197    138.3702     17.7826     15.3200
   110 CA   GLU    198    122.6026     17.7822     20.7300
   111 CA   GLY    199    175.3255     17.7835     20.4100
   112 CA   ASN    200    196.5799     17.7840     19.1200
   113 CA   LEU    201    178.8155     17.7836     22.5400
   114 CA   ARG    202    215.3627     17.7845     19.1900
   115 CA   VAL    203    180.2940     17.7836     14.6400
   116 CA   GLU    204    188.9623     17.7838     14.5300
   117 CA   TYR    205    169.6254     17.7834     11.0200
   118 CA   LEU    206    231.3514     17.7848     11.6000
   119 CA   ASP    207    253.4022     17.7854     15.1300
   120 CA   ASP    208    376.9824     17.7883     18.4600
   121 CA   ARG    209    484.1942     17.7909     24.9400
   122 CA   ASN    210    617.5303     17.7941     24.5600
   123 CA   THR    211    518.7828     17.7917     21.0200
   124 CA   PHE    212    365.8068     17.7881     19.9000
   125 CA   ARG    213    307.6376     17.7867     18.2500
   126 CA   HIS    214    221.7687     17.7846     15.1500
   127 CA   SER    215    235.7373     17.7849     10.3800
   128 CA   VAL    216    205.7516     17.7842     14.6400
   129 CA   VAL    217    270.8007     17.7858     13.8900
   130 CA   VAL    217    269.8838     17.7858     13.1900
   131 CA   VAL    218    289.4448     17.7862     15.6900
   132 CA   PRO    219    380.9342     17.7884     18.5300
   133 CA   TYR    220    469.7148     17.7906     17.7200
   134 CA   GLU    221    511.3183     17.7916     18.3700
   135 CA   PRO    222    627.1734     17.7943     19.7200
   136 CA   PRO    223    617.7121     17.7941     20.6700
   137 CA   GLU    224    594.1146     17.7935     22.2700
   138 CA   VAL    225    738.8665     17.7970     24.9100
   139 CA   GLY    226    748.4179     17.7972     26.9200
   140 CA   SER    227    655.0862     17.7950     23.9300
   141 CA   SER    227    657.9111     17.7951     23.8600
   142 CA   ASP    228    723.4822     17.7967     20.5000
   143 CA   CYS    229    588.7475     17.7934     12.5500
   144 CA   THR    230    492.1722     17.7911     15.7600
   145 CA   THR    231    374.1605     17.7883     17.7300
   146 CA   ILE    232    284.2844     17.7861     17.1000
   147 CA   HIS    233    196.9273     17.7840     15.4600
   148 CA   TYR    234    151.6205     17.7829     14.1700
   149 CA   ASN    235     88.9344     17.7814     18.6000
   150 CA   TYR    236     75.7243     17.7811     13.0400
   151 CA   MET    237     40.8724     17.7803     13.3500
   152 CA   CYS    238     46.4532     17.7804     17.1500
   153 CA   ASN    239     44.0252     17.7803     16.6300
   154 CA   SER    240     84.1676     17.7813     25.4000
   155 CA   SER    241     68.4667     17.7809     26.6700
   156 CA   CYS    242     70.3718     17.7810     26.9500
   157 CA   MET    243    118.1252     17.7821     36.0300
   158 CA   GLY    244    159.6128     17.7831     34.9200
   159 CA   GLY    245    136.9602     17.7826     25.8500
   160 CA   MET    246    151.2581     17.7829     14.4600
   161 CA   ASN    247    144.0926     17.7828     15.9400
   162 CA   ARG    248    136.9247     17.7826     20.4800
   163 CA   ARG    249    204.3001     17.7842     16.1500
   164 CA   PRO    250    214.4043     17.7844     15.0100
   165 CA   ILE    251    234.5569     17.7849     16.9100
   166 CA   LEU    252    288.5714     17.7862     20.0700
   167 CA   THR    253    277.2162     17.7859     15.0800
   168 CA   ILE    254    370.1791     17.7882     13.7000
   169 CA   ILE    255    394.4533     17.7888     10.8700
   170 CA   THR    256    483.0475     17.7909     14.1400
   171 CA   THR    256    482.3441     17.7909     13.7800
   172 CA   THR    256    483.4377     17.7909     14.5000
   173 CA   LEU    257    549.3578     17.7925     11.7900
   174 CA   GLU    258    581.8052     17.7933     16.4900
   175 CA   ASP    259    641.3027     17.7947     13.8600
   176 CA   SER    260    584.6977     17.7933     18.3500
   177 CA   SER    261    661.2902     17.7952     15.4500
   178 CA   GLY    262    609.3682     17.7939     13.4300
   179 CA   ASN    263    738.3975     17.7970     16.2400
   180 CA   LEU    264    712.7571     17.7964     18.5300
   181 CA   LEU    265    752.7778     17.7974     13.3700
   182 CA   GLY    266    693.5196     17.7959     10.3500
   183 CA   ARG    267    594.7271     17.7936     13.7700
   184 CA   ASN    268    523.5248     17.7919      9.7400
   185 CA   SER    269    421.8449     17.7894     12.2700
   186 CA   PHE    270    339.3474     17.7874     16.1000
   187 CA   GLU    271    267.2768     17.7857     16.1700
   188 CA   GLU    271    265.7339     17.7857     15.7600
   189 CA   VAL    272    180.6166     17.7836     13.6100
   190 CA   VAL    272    179.0895     17.7836     14.0600
   191 CA   ARG    273    119.3195     17.7822      0.0000
   192 CA   VAL    274     69.3288     17.7810     15.4100
   193 CA   CYS    275     37.6504     17.7802     19.6800
   194 CA   ALA    276     19.1656     17.7798     18.1300
   195 CA   CYS    277     35.6588     17.7801     19.1000
   196 CA   CYS    277     35.5427     17.7801     19.3600
   197 CA   PRO    278     74.6733     17.7811     15.0000
   198 CA   PRO    278     74.1020     17.7811     14.9400
   199 CA   GLY    279    101.3244     17.7817     12.7700
   200 CA   ARG    280     68.5806     17.7809     17.9900
   201 CA   ASP    281     81.1251     17.7812     16.9800
   202 CA   ARG    282    139.1163     17.7826     17.7700
   203 CA   ARG    283    141.8973     17.7827     16.4500
   204 CA   THR    284    116.7122     17.7821     21.0000
   205 CA   GLU    285    173.3356     17.7835     21.1000
   206 CA   GLU    286    228.3262     17.7848     23.0900
   207 CA   GLU    287    212.2341     17.7844     29.5100
   208 CA   ASN    288    234.8239     17.7849     38.5200

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: April 25th, 2023.