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 240415125745386539

Overall B-factor prediction

Correlation= 0.259 for 213 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   HIS     88     20.3153     25.3243     42.8200
     2 CA   HIS     89     28.5960     27.0373     39.8600
     3 CA   HIS     90     57.0447     32.9222     41.5700
     4 CA   HIS     91     19.1285     25.0788     41.9200
     5 CA   HIS     92     14.8485     24.1935     32.9800
     6 CA   HIS     93      7.7658     22.7283     24.5400
     7 CA   SER     94      7.1786     22.6069     20.9500
     8 CA   SER     95     19.2286     25.0995     20.5600
     9 CA   SER     96     28.0300     26.9202     22.1800
    10 CA   VAL     97     62.4812     34.0468     23.5400
    11 CA   PRO     98    204.6297     63.4517     26.2900
    12 CA   SER     99    297.1295     82.5863     23.9100
    13 CA   GLN    100     12.3101     23.6684     23.3700
    14 CA   LYS    101     16.7274     24.5821     30.3000
    15 CA   THR    102      8.9214     22.9674     26.9500
    16 CA   TYR    103      6.6088     22.4890     27.7800
    17 CA   GLN    104      4.8369     22.1224     26.5700
    18 CA   GLY    105      5.1797     22.1934     23.5200
    19 CA   SER    106      8.0455     22.7862     26.7800
    20 CA   TYR    107      6.1353     22.3910     25.8400
    21 CA   GLY    108      6.1674     22.3977     28.5900
    22 CA   PHE    109      4.1962     21.9899     23.0500
    23 CA   ARG    110      4.7771     22.1101     27.2800
    24 CA   LEU    111      5.9236     22.3473     21.1100
    25 CA   GLY    112      6.8926     22.5477     20.7000
    26 CA   PHE    113      4.6834     22.0907     19.5400
    27 CA   LEU    114      4.5608     22.0654     23.8600
    28 CA   HIS    115      8.2021     22.8186     23.6900
    29 CA   SER    116      3.6029     21.8672     21.8000
    30 CA   GLY    117      6.2026     22.4050     21.0400
    31 CA   THR    118      3.5618     21.8587     20.1200
    32 CA   ALA    119      6.2127     22.4071     24.4500
    33 CA   LYS    120      6.8022     22.5290     33.0800
    34 CA   SER    121     14.2627     24.0723     37.2800
    35 CA   VAL    122      4.2652     22.0042     28.6000
    36 CA   THR    123      2.6321     21.6664     26.0000
    37 CA   CYS    124      2.2370     21.5846     19.1300
    38 CA   THR    125      2.2669     21.5908     18.7700
    39 CA   TYR    126      2.6686     21.6739     18.7900
    40 CA   SER    127      3.2371     21.7915     20.5500
    41 CA   PRO    128      9.3614     23.0584     26.6900
    42 CA   ALA    129     10.8742     23.3713     26.6700
    43 CA   LEU    130      8.8343     22.9494     22.1900
    44 CA   ASN    131      5.7486     22.3111     22.2100
    45 CA   LYS    132      3.1368     21.7708     18.7600
    46 CA   MET    133      2.7469     21.6901     17.0800
    47 CA   PHE    134      1.5088     21.4340     19.4300
    48 CA   CYS    135      1.4097     21.4135     18.0900
    49 CA   GLN    136      1.4959     21.4313     21.4000
    50 CA   LEU    137      1.2468     21.3798     21.1900
    51 CA   ALA    138      1.7841     21.4910     21.2800
    52 CA   LYS    139      1.7713     21.4883     19.8000
    53 CA   THR    140      2.5935     21.6584     20.9800
    54 CA   CYS    141      3.9692     21.9430     20.0400
    55 CA   PRO    142      5.4210     22.2433     20.3900
    56 CA   VAL    143      4.6389     22.0815     19.1600
    57 CA   GLN    144      4.9259     22.1409     22.6700
    58 CA   LEU    145      5.0819     22.1731     20.9000
    59 CA   TRP    146      6.4849     22.4634     22.8700
    60 CA   VAL    147      9.5332     23.0939     25.8100
    61 CA   ASP    148     12.6215     23.7328     24.7900
    62 CA   SER    149     16.6700     24.5703     24.1400
    63 CA   THR    150     28.7179     27.0625     22.3200
    64 CA   PRO    151     51.6443     31.8051     22.1100
    65 CA   PRO    152     30.2505     27.3795     25.7000
    66 CA   PRO    153     45.6960     30.5746     25.5500
    67 CA   GLY    154     17.5014     24.7423     19.9900
    68 CA   THR    155     10.1350     23.2184     17.8300
    69 CA   ARG    156      5.2901     22.2162     21.4800
    70 CA   VAL    157      3.3605     21.8171     18.1700
    71 CA   ARG    158      4.2419     21.9994     16.9000
    72 CA   ALA    159      2.5925     21.6582     18.4300
    73 CA   MET    160      2.1345     21.5634     17.1000
    74 CA   ALA    161      1.7731     21.4887     15.2400
    75 CA   ILE    162      1.9726     21.5299     16.1400
    76 CA   TYR    163      1.9341     21.5220     20.5500
    77 CA   LYS    164      2.5488     21.6491     25.3100
    78 CA   GLN    165      7.3836     22.6493     30.1800
    79 CA   SER    166     12.9570     23.8022     32.7200
    80 CA   GLN    167     19.7096     25.1990     33.9300
    81 CA   HIS    168      8.0675     22.7907     23.9900
    82 CA   MET    169      5.3106     22.2204     25.1500
    83 CA   THR    170      6.8823     22.5456     22.7700
    84 CA   GLU    171      4.3302     22.0176     17.8700
    85 CA   VAL    172      2.7612     21.6931     17.8900
    86 CA   VAL    173      1.4534     21.4226     22.3700
    87 CA   ARG    174      1.4565     21.4232     18.6300
    88 CA   ARG    175      1.1808     21.3662     22.3300
    89 CA   CYS    176      1.7075     21.4751     19.7100
    90 CA   PRO    177      3.6335     21.8735     18.7600
    91 CA   HIS    178      3.9720     21.9435     20.5700
    92 CA   HIS    179      2.4863     21.6362     20.9000
    93 CA   GLU    180      2.9638     21.7350     20.3900
    94 CA   ARG    181      6.3400     22.4334     19.5800
    95 CA   CYS    182      9.7811     23.1452     24.9100
    96 CA   SER    183     13.4533     23.9049     29.5500
    97 CA   ASP    184     15.2410     24.2747     28.4700
    98 CA   SER    185     20.3748     25.3366     34.7600
    99 CA   ASP    186     29.8798     27.3028     30.2500
   100 CA   GLY    187     25.6602     26.4300     34.4200
   101 CA   LEU    188     12.5668     23.7215     29.9000
   102 CA   ALA    189      5.1085     22.1786     25.0100
   103 CA   PRO    190      4.7316     22.1007     25.3200
   104 CA   PRO    191      4.0729     21.9644     23.6100
   105 CA   GLN    192      2.1491     21.5665     18.0800
   106 CA   HIS    193      1.4837     21.4288     18.2500
   107 CA   LEU    194      1.3303     21.3971     17.5000
   108 CA   ILE    195      1.7154     21.4767     19.7800
   109 CA   ARG    196      2.2241     21.5820     20.0600
   110 CA   VAL    197      3.0057     21.7437     19.7100
   111 CA   GLU    198      4.6755     22.0891     27.7000
   112 CA   GLY    199     12.4920     23.7060     30.0400
   113 CA   ASN    200      9.7146     23.1315     25.8000
   114 CA   LEU    201     20.2868     25.3184     27.6700
   115 CA   ARG    202      6.0111     22.3654     23.9000
   116 CA   VAL    203      3.2283     21.7897     20.9900
   117 CA   GLU    204      4.0313     21.9558     23.1000
   118 CA   TYR    205      3.9990     21.9491     20.9900
   119 CA   LEU    206      7.0008     22.5701     24.1600
   120 CA   ASP    207      8.5933     22.8995     24.4400
   121 CA   ASP    208     15.1236     24.2504     22.5300
   122 CA   ARG    209     36.1074     28.5911     31.9300
   123 CA   ASN    210     45.0625     30.4436     29.7900
   124 CA   THR    211     19.1922     25.0920     23.1000
   125 CA   PHE    212      8.6405     22.9093     24.9500
   126 CA   ARG    213      3.6250     21.8718     21.7300
   127 CA   HIS    214      1.8618     21.5070     17.9300
   128 CA   SER    215      1.6846     21.4704     14.9900
   129 CA   VAL    216      1.8261     21.4996     17.1600
   130 CA   VAL    217      4.4945     22.0516     20.2600
   131 CA   VAL    218      5.5774     22.2756     21.3900
   132 CA   PRO    219      7.2970     22.6314     17.5400
   133 CA   TYR    220      9.4783     23.0826     23.2500
   134 CA   GLU    221     19.5070     25.1571     29.9200
   135 CA   PRO    222     16.1384     24.4603     31.3100
   136 CA   PRO    223     13.9408     24.0057     25.5500
   137 CA   GLU    224     27.2047     26.7495     28.4900
   138 CA   VAL    225     63.2762     34.2113     31.3900
   139 CA   GLY    226     61.6244     33.8696     36.2800
   140 CA   SER    227     25.3516     26.3661     31.6900
   141 CA   ASP    228     24.0980     26.1068     29.8300
   142 CA   CYS    229      8.3152     22.8420     26.5500
   143 CA   THR    230     11.4187     23.4840     23.7600
   144 CA   THR    231      7.8590     22.7476     20.1400
   145 CA   ILE    232      7.7476     22.7246     17.8000
   146 CA   HIS    233      3.7431     21.8962     16.6100
   147 CA   TYR    234      2.7621     21.6933     18.7900
   148 CA   ASN    235      2.7293     21.6865     20.2500
   149 CA   TYR    236      1.5686     21.4464     19.7800
   150 CA   MET    237      1.2442     21.3793     18.5000
   151 CA   CYS    238      1.2061     21.3714     19.4500
   152 CA   ASN    239      1.2821     21.3871     16.2700
   153 CA   ASN    239      1.2817     21.3870     24.4100
   154 CA   SER    240      1.4669     21.4253     15.3100
   155 CA   SER    240      1.2837     21.3874     27.1800
   156 CA   SER    241      2.1357     21.5637     19.9400
   157 CA   SER    241      1.6818     21.4698     31.0800
   158 CA   CYS    242      1.7501     21.4839     18.2800
   159 CA   CYS    242      1.6221     21.4574     28.8400
   160 CA   MET    243      2.6351     21.6670     24.3200
   161 CA   MET    243      2.5518     21.6498     29.4200
   162 CA   GLY    244      2.5017     21.6394     22.0800
   163 CA   GLY    244      2.6647     21.6731     28.5800
   164 CA   GLY    245      1.7266     21.4791     26.0000
   165 CA   GLY    245      1.6294     21.4589     26.7800
   166 CA   MET    246      1.5460     21.4417     24.0300
   167 CA   MET    246      1.5296     21.4383     20.3400
   168 CA   ASN    247      2.1317     21.5629     29.3800
   169 CA   ARG    248      2.1077     21.5579     33.2400
   170 CA   ARG    249      2.1492     21.5665     22.0600
   171 CA   PRO    250      1.7503     21.4840     26.3100
   172 CA   ILE    251      1.4273     21.4172     19.7500
   173 CA   LEU    252      1.7132     21.4763     19.0400
   174 CA   THR    253      2.0756     21.5513     15.9600
   175 CA   ILE    254      2.7549     21.6918     15.6500
   176 CA   ILE    255      3.2658     21.7975     18.9400
   177 CA   THR    256      3.7600     21.8997     19.9800
   178 CA   LEU    257      2.6576     21.6717     20.9700
   179 CA   GLU    258      5.4611     22.2516     21.9300
   180 CA   ASP    259     10.0985     23.2109     20.7800
   181 CA   SER    260     23.1692     25.9147     26.2100
   182 CA   SER    261     37.6046     28.9008     21.9300
   183 CA   GLY    262     26.2693     26.5560     18.7900
   184 CA   ASN    263     19.2557     25.1051     22.0900
   185 CA   LEU    264      7.7898     22.7333     24.9600
   186 CA   LEU    265      4.4577     22.0440     19.2200
   187 CA   GLY    266      2.9525     21.7327     21.9000
   188 CA   ARG    267      3.1659     21.7768     19.6900
   189 CA   ASN    268      3.3839     21.8219     22.9500
   190 CA   SER    269      4.0814     21.9662     18.9900
   191 CA   PHE    270      5.0297     22.1623     19.3900
   192 CA   GLU    271      1.9473     21.5247     20.4800
   193 CA   VAL    272      2.1462     21.5659     18.7400
   194 CA   ARG    273      1.6417     21.4615     18.1100
   195 CA   VAL    274      1.2756     21.3858     17.6400
   196 CA   CYS    275      1.5244     21.4372     21.9000
   197 CA   ALA    276      4.0438     21.9584     25.3600
   198 CA   CYS    277      3.2492     21.7940     29.8500
   199 CA   PRO    278      1.6167     21.4563     21.1700
   200 CA   GLY    279      2.4552     21.6298     21.2800
   201 CA   ARG    280      3.8070     21.9094     24.0800
   202 CA   ASP    281      4.3262     22.0168     23.5000
   203 CA   ARG    282      3.3914     21.8234      0.0000
   204 CA   ARG    283      6.5124     22.4691     24.2500
   205 CA   THR    284     10.2770     23.2478     31.3200
   206 CA   GLU    285     13.0942     23.8306     24.2800
   207 CA   GLU    286     12.3508     23.6768     19.9600
   208 CA   GLU    287     19.1730     25.0880     35.0000
   209 CA   ASN    288     26.8345     26.6729     35.9700
   210 CA   LEU    289     31.3535     27.6077     29.3200
   211 CA   ARG    290     44.9361     30.4174     29.9600
   212 CA   LYS    291     57.3892     32.9935     29.9000
   213 CA   LYS    292     69.3723     35.4723     31.0500

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.