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B-factor analysis for ID 2501100054483836345

Overall B-factor prediction

Correlation= 0.228 for 191 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     96    582.3642     72.5474     40.1800
     2 CA   VAL     97    135.9464     29.5228     29.5200
     3 CA   PRO     98    721.5501     85.9618     25.1400
     4 CA   SER     99   1195.5919    131.6487     20.6900
     5 CA   GLN    100     61.7858     22.3754     25.5400
     6 CA   LYS    101     44.2823     20.6885     18.9700
     7 CA   THR    102     22.3949     18.5790     18.2900
     8 CA   TYR    103     17.8696     18.1429      9.1600
     9 CA   GLN    104     15.1945     17.8851     16.2900
    10 CA   GLY    105     16.7835     18.0382     17.5800
    11 CA   SER    106     41.6365     20.4335     22.2600
    12 CA   TYR    107     20.7444     18.4200     20.7800
    13 CA   GLY    108     18.9244     18.2446     21.5400
    14 CA   PHE    109     14.4059     17.8091     14.8400
    15 CA   ARG    110     16.4315     18.0043     14.7900
    16 CA   LEU    111     16.8205     18.0418     12.4400
    17 CA   GLY    112     17.9144     18.1472     16.7600
    18 CA   PHE    113     19.8104     18.3300     13.8100
    19 CA   LEU    114      8.6004     17.2496     35.2900
    20 CA   VAL    122     18.8003     18.2326     57.0000
    21 CA   THR    123     16.0676     17.9692     33.7300
    22 CA   CYS    124     12.0068     17.5779     20.7200
    23 CA   THR    125     12.3318     17.6092     24.3500
    24 CA   TYR    126     14.6746     17.8350     17.1800
    25 CA   SER    127     24.2429     18.7571     15.3600
    26 CA   PRO    128     40.7908     20.3520     20.2900
    27 CA   ALA    129     53.9099     21.6164     22.5400
    28 CA   LEU    130     34.6168     19.7570     17.3300
    29 CA   ASN    131     21.0969     18.4539     16.3500
    30 CA   LYS    132     10.2424     17.4078     16.2400
    31 CA   MET    133      8.3201     17.2225      9.1000
    32 CA   MET    133      8.3076     17.2213     15.4300
    33 CA   PHE    134      6.2095     17.0191     18.0700
    34 CA   CYS    135      6.0046     16.9994     17.8800
    35 CA   GLN    136      8.2055     17.2115     16.7000
    36 CA   LEU    137      5.2189     16.9237     22.0300
    37 CA   ALA    138      7.2745     17.1218     21.1200
    38 CA   LYS    139      8.3219     17.2227     21.5600
    39 CA   THR    140     13.8828     17.7587     15.9700
    40 CA   CYS    141     12.8901     17.6630     16.5400
    41 CA   CYS    141     12.5194     17.6273     17.5700
    42 CA   PRO    142     14.2661     17.7956     13.7700
    43 CA   VAL    143     13.8987     17.7602     10.9000
    44 CA   GLN    144     14.4141     17.8099     12.4200
    45 CA   LEU    145     15.5270     17.9171     11.4500
    46 CA   TRP    146     18.2760     18.1821     16.6200
    47 CA   VAL    147     23.7266     18.7074     21.7900
    48 CA   ASP    148     29.9368     19.3059     28.2500
    49 CA   SER    149     38.2267     20.1049     32.3800
    50 CA   THR    150     59.2649     22.1325     39.6900
    51 CA   PRO    151     74.6910     23.6192     26.9500
    52 CA   PRO    152     53.8527     21.6109     33.1200
    53 CA   PRO    153     82.9339     24.4136     25.4100
    54 CA   GLY    154     38.0007     20.0831     21.4900
    55 CA   THR    155     22.3403     18.5738     13.8600
    56 CA   ARG    156     13.5714     17.7287     11.8400
    57 CA   VAL    157      9.4636     17.3328     11.7200
    58 CA   ARG    158      7.6514     17.1581     10.5400
    59 CA   ALA    159      6.7777     17.0739     10.1800
    60 CA   MET    160     10.7197     17.4538     10.4800
    61 CA   ALA    161      8.0449     17.1960      9.7300
    62 CA   ILE    162      6.8139     17.0774     12.1500
    63 CA   TYR    163      7.9775     17.1895     12.7200
    64 CA   LYS    164     10.2658     17.4101     14.4300
    65 CA   GLN    165     33.7102     19.6696     23.1500
    66 CA   SER    166     65.1566     22.7003     23.4100
    67 CA   SER    166     64.9975     22.6850     23.8500
    68 CA   GLN    167     92.6117     25.3464     29.7400
    69 CA   HIS    168     53.3487     21.5623     18.6100
    70 CA   MET    169     35.9233     19.8829     21.5000
    71 CA   THR    170     63.6018     22.5505     23.1300
    72 CA   GLU    171     43.3240     20.5961     17.8700
    73 CA   VAL    172     16.7201     18.0321     14.1600
    74 CA   VAL    173     15.6313     17.9272     13.2900
    75 CA   ARG    174     21.5277     18.4955     15.7700
    76 CA   ARG    175     12.4618     17.6217     19.3000
    77 CA   CYS    176     21.4748     18.4904     23.4100
    78 CA   PRO    177     42.8733     20.5527     31.5600
    79 CA   HIS    178     49.9430     21.2341     25.4600
    80 CA   HIS    179     31.6446     19.4705     28.3700
    81 CA   GLU    180     29.7229     19.2853     30.9300
    82 CA   ARG    181     54.8436     21.7064     41.7300
    83 CA   SER    185     61.6573     22.3630     61.7100
    84 CA   ASP    186     73.6145     23.5155     51.3600
    85 CA   GLY    187     85.1410     24.6263     54.0900
    86 CA   LEU    188     58.8748     22.0949     30.9400
    87 CA   ALA    189     28.2790     19.1461     26.2100
    88 CA   PRO    190     42.0811     20.4763     28.0600
    89 CA   PRO    191     47.5018     20.9988     24.6500
    90 CA   GLN    192     20.4352     18.3902     18.1900
    91 CA   HIS    193     16.9955     18.0587     15.4900
    92 CA   LEU    194     12.9564     17.6694     11.9500
    93 CA   ILE    195     12.9343     17.6672     13.4400
    94 CA   ARG    196     10.7175     17.4536     14.8300
    95 CA   VAL    197     14.8133     17.8483     14.5200
    96 CA   GLU    198     17.3111     18.0891     26.5900
    97 CA   GLY    199     30.8914     19.3979     22.9200
    98 CA   ASN    200     27.6150     19.0821     16.4100
    99 CA   LEU    201     44.6476     20.7237     19.4800
   100 CA   ARG    202     23.8187     18.7163     15.5700
   101 CA   VAL    203     15.1474     17.8805     13.0500
   102 CA   GLU    204     16.7615     18.0361     15.3300
   103 CA   TYR    205     23.5932     18.6945     12.2900
   104 CA   LEU    206     37.5966     20.0441     15.0400
   105 CA   ASP    207     54.2999     21.6540     20.0800
   106 CA   ASP    208    136.9570     29.6202     20.5500
   107 CA   ARG    209    349.3644     50.0915     34.4200
   108 CA   ASN    210    457.5734     60.5204     34.1200
   109 CA   THR    211    249.5986     40.4763     28.5600
   110 CA   PHE    212    139.8901     29.9029     15.9300
   111 CA   ARG    213     40.1443     20.2897     13.6600
   112 CA   HIS    214     12.8400     17.6582     11.0200
   113 CA   SER    215     16.4252     18.0037     14.6200
   114 CA   VAL    216      8.8859     17.2771     10.2600
   115 CA   VAL    217      9.2732     17.3144     10.9700
   116 CA   VAL    218     13.6272     17.7340     12.8300
   117 CA   PRO    219     18.7632     18.2290     14.4800
   118 CA   TYR    220     25.0103     18.8311     10.2400
   119 CA   GLU    221     50.2681     21.2654     18.7500
   120 CA   PRO    222     58.3874     22.0479     24.4600
   121 CA   PRO    223     38.5380     20.1349     19.4500
   122 CA   GLU    224    211.1251     36.7684     25.1000
   123 CA   VAL    225    252.2720     40.7340     20.7500
   124 CA   GLY    226    134.1433     29.3491     33.2000
   125 CA   SER    227    388.8886     53.9008     22.0900
   126 CA   ASP    228    197.5315     35.4583     23.2200
   127 CA   CYS    229     21.7614     18.5180     20.9900
   128 CA   THR    230     24.2439     18.7572     12.3900
   129 CA   THR    231     20.0223     18.3504     17.3500
   130 CA   ILE    232     23.8441     18.7187     14.2700
   131 CA   HIS    233     16.3796     17.9993     15.6700
   132 CA   TYR    234     11.2416     17.5041     16.1100
   133 CA   ASN    235     10.5623     17.4386     15.4500
   134 CA   TYR    236      7.2601     17.1204     18.2200
   135 CA   MET    237      8.3655     17.2269     16.2000
   136 CA   CYS    238     11.0355     17.4843     16.4400
   137 CA   CYS    238     11.1334     17.4937     20.4900
   138 CA   ASN    239      7.3657     17.1306     20.2300
   139 CA   SER    240     11.5400     17.5329     21.2100
   140 CA   SER    241     16.2522     17.9870     30.8300
   141 CA   CYS    242     12.7255     17.6471     35.2500
   142 CA   MET    243     15.7185     17.9356     55.7000
   143 CA   GLY    244     21.2210     18.4659     61.3600
   144 CA   GLY    245     78.6458     24.0004     71.1900
   145 CA   MET    246    130.2510     28.9739     66.4400
   146 CA   ASN    247     82.0671     24.3301     48.7900
   147 CA   ARG    248     32.3500     19.5385     62.7200
   148 CA   ARG    249     19.8550     18.3343      0.0000
   149 CA   PRO    250      9.7811     17.3634     18.1300
   150 CA   ILE    251      6.3559     17.0332     14.5900
   151 CA   LEU    252      5.5894     16.9594     14.7100
   152 CA   THR    253      5.5081     16.9515     11.8300
   153 CA   ILE    254      6.0313     17.0020      6.9100
   154 CA   ILE    254      6.0321     17.0020      6.6600
   155 CA   ILE    255      5.6811     16.9682     10.6400
   156 CA   THR    256      7.6566     17.1586      9.2600
   157 CA   THR    256      7.7004     17.1628     11.7700
   158 CA   LEU    257      8.0478     17.1963     10.6300
   159 CA   GLU    258     13.2991     17.7024     11.2600
   160 CA   ASP    259     23.4734     18.6830     17.0700
   161 CA   SER    260     39.5480     20.2322     23.1300
   162 CA   SER    261     65.9421     22.7760     29.8000
   163 CA   GLY    262     46.3987     20.8925     20.3500
   164 CA   ASN    263     42.7809     20.5438     20.8500
   165 CA   LEU    264     28.3524     19.1532     13.8300
   166 CA   LEU    265     18.4973     18.2034     13.1500
   167 CA   GLY    266     10.3135     17.4147     10.0900
   168 CA   ARG    267     10.9070     17.4719      9.6000
   169 CA   ASN    268      7.8812     17.1802     14.7100
   170 CA   SER    269      8.7292     17.2620     12.1200
   171 CA   PHE    270      9.3333     17.3202      9.7100
   172 CA   GLU    271      7.2814     17.1224     12.6800
   173 CA   VAL    272      7.5612     17.1494     13.3100
   174 CA   VAL    272      7.5342     17.1468     14.3900
   175 CA   ARG    273      5.1088     16.9130     14.3900
   176 CA   VAL    274      3.9908     16.8053     17.4000
   177 CA   CYS    275      5.5685     16.9574     28.0000
   178 CA   ALA    276     13.6324     17.7345     23.6300
   179 CA   CYS    277     25.6348     18.8913     28.0600
   180 CA   CYS    277     25.7765     18.9050     29.5100
   181 CA   PRO    278      6.9954     17.0949     19.4500
   182 CA   GLY    279     15.7445     17.9381     28.2100
   183 CA   ARG    280     23.6687     18.7018     27.0300
   184 CA   ASP    281     32.4006     19.5434     18.7100
   185 CA   ARG    282     38.8238     20.1624     22.5300
   186 CA   ARG    283     54.1326     21.6378     29.3900
   187 CA   THR    284     91.0272     25.1936     36.2100
   188 CA   GLU    285    125.9414     28.5586     26.8800
   189 CA   GLU    286    145.2760     30.4220     28.4400
   190 CA   GLU    287    180.9336     33.8586     41.4400
   191 CA   ASN    288    258.6084     41.3447     48.8100

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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: April 25th, 2023.