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B-factor analysis for ID 22011415395742824

Overall B-factor prediction

Correlation= 0.601 for 333 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
     3 CA   MET      1      0.0014      7.2411     11.0700
     4 CA   MET      1      0.0014      7.2115     11.9900
    40 CA   ILE      2      0.0006      6.2407      8.3100
    60 CA   SER      3      0.0004      6.0427      5.8700
    72 CA   LEU      4      0.0004      5.9952      5.5600
    73 CA   LEU      4      0.0004      5.9961      5.6600
   110 CA   ILE      5      0.0003      5.9858      5.0600
   111 CA   ILE      5      0.0003      5.9864      4.4700
   147 CA   ALA      6      0.0003      5.9827      4.6200
   159 CA   ALA      7      0.0005      6.1390      4.7900
   160 CA   ALA      7      0.0005      6.1364      4.8300
   179 CA   LEU      8      0.0005      6.1157      5.5000
   180 CA   LEU      8      0.0005      6.1137      5.1400
   216 CA   ALA      9      0.0006      6.2614      7.0200
   230 CA   VAL     10      0.0012      6.9122      7.2100
   231 CA   VAL     10      0.0012      6.9291      7.4500
   232 CA   VAL     10      0.0012      6.9540      7.5100
   233 CA   VAL     10      0.0012      6.9274      7.6000
   294 CA   ASP     11      0.0016      7.3821      6.4400
   295 CA   ASP     11      0.0016      7.4150      7.3500
   296 CA   ASP     11      0.0016      7.4134      7.5900
   297 CA   ASP     11      0.0016      7.4011      7.2900
   342 CA   ARG     12      0.0007      6.4284      6.0200
   343 CA   ARG     12      0.0007      6.4215      5.3000
   344 CA   ARG     12      0.0007      6.4244      6.2200
   345 CA   ARG     12      0.0007      6.4182      6.2400
   438 CA   VAL     13      0.0007      6.4420      5.8300
   439 CA   VAL     13      0.0007      6.4443      5.2200
   440 CA   VAL     13      0.0007      6.4359      5.4800
   441 CA   VAL     13      0.0007      6.4400      5.0000
   502 CA   ILE     14      0.0007      6.3692      5.9800
   503 CA   ILE     14      0.0007      6.3678      5.8400
   504 CA   ILE     14      0.0007      6.3683      5.9800
   505 CA   ILE     14      0.0007      6.3671      5.7300
   575 CA   GLY     15      0.0011      6.8086      7.0800
   585 CA   MET     16      0.0022      8.1137      8.7300
   602 CA   GLU     17      0.0107     17.9379      9.5700
   627 CA   ASN     18      0.0026      8.6050     12.3900
   628 CA   ASN     18      0.0027      8.6366     11.3700
   655 CA   ALA     19      0.0028      8.8464     10.2600
   656 CA   ALA     19      0.0029      8.9334     10.7500
   675 CA   MET     20      0.0012      6.9738      8.9000
   676 CA   MET     20      0.0012      7.0184     11.5800
   709 CA   PRO     21      0.0013      7.0883     11.3800
   710 CA   PRO     21      0.0014      7.2517     13.2100
   737 CA   TRP     22      0.0011      6.8001     10.7800
   738 CA   TRP     22      0.0011      6.8486     10.3400
   785 CA   ASN     23      0.0018      7.6774     11.6700
   786 CA   ASN     23      0.0019      7.8012     11.3200
   813 CA   LEU     24      0.0010      6.7913      8.4400
   814 CA   LEU     24      0.0011      6.7996      7.8600
   851 CA   PRO     25      0.0021      8.0592      7.9400
   852 CA   PRO     25      0.0022      8.0793      8.2400
   879 CA   ALA     26      0.0013      7.0549      6.9300
   880 CA   ALA     26      0.0013      7.0785      6.4100
   899 CA   ASP     27      0.0007      6.4383      6.1600
   900 CA   ASP     27      0.0007      6.4405      5.9400
   922 CA   LEU     28      0.0013      7.0966      7.2700
   968 CA   ALA     29      0.0014      7.2092      7.3800
   978 CA   TRP     30      0.0007      6.3928      6.3600
  1002 CA   PHE     31      0.0006      6.2713      5.6100
  1022 CA   LYS     32      0.0011      6.8004      6.8300
  1078 CA   ARG     33      0.0013      7.0520      7.8500
  1079 CA   ARG     33      0.0012      7.0022      8.0700
  1080 CA   ARG     33      0.0013      7.0302      7.8600
  1150 CA   ASN     34      0.0008      6.4570      6.2300
  1151 CA   ASN     34      0.0008      6.4545      6.0000
  1152 CA   ASN     34      0.0008      6.4549      6.3000
  1192 CA   THR     35      0.0006      6.2609      5.6700
  1193 CA   THR     35      0.0006      6.2573      5.6800
  1194 CA   THR     35      0.0006      6.2594      5.9200
  1232 CA   LEU     36      0.0009      6.6165      6.4200
  1255 CA   ASN     37      0.0019      7.7159      6.9100
  1256 CA   ASN     37      0.0019      7.7314      6.9300
  1257 CA   ASN     37      0.0019      7.7199      7.3400
  1297 CA   LYS     38      0.0008      6.4704      6.9900
  1298 CA   LYS     38      0.0008      6.4651      7.3100
  1299 CA   LYS     38      0.0008      6.4704      6.7700
  1361 CA   PRO     39      0.0005      6.1955      6.0400
  1386 CA   VAL     40      0.0003      5.9846      5.4800
  1387 CA   VAL     40      0.0003      5.9864      5.1100
  1388 CA   VAL     40      0.0003      5.9850      5.5400
  1434 CA   ILE     41      0.0003      5.9225      4.4100
  1435 CA   ILE     41      0.0003      5.9240      4.8700
  1436 CA   ILE     41      0.0003      5.9226      4.7400
  1489 CA   MET     42      0.0003      5.9378      4.7500
  1508 CA   GLY     43      0.0004      6.0864      5.2800
  1517 CA   ARG     44      0.0008      6.4676      6.6800
  1518 CA   ARG     44      0.0008      6.4668      6.4500
  1519 CA   ARG     44      0.0008      6.4636      6.3200
  1589 CA   HIS     45      0.0010      6.7662      5.9300
  1590 CA   HIS     45      0.0010      6.7754      5.9200
  1591 CA   HIS     45      0.0010      6.7705      6.0000
  1640 CA   THR     46      0.0007      6.3598      6.0600
  1641 CA   THR     46      0.0007      6.3538      5.4900
  1642 CA   THR     46      0.0007      6.3636      5.6400
  1682 CA   TRP     47      0.0006      6.3170      5.8100
  1683 CA   TRP     47      0.0006      6.3082      6.4500
  1684 CA   TRP     47      0.0006      6.3183      5.1800
  1754 CA   GLU     48      0.0010      6.7627      7.1400
  1755 CA   GLU     48      0.0010      6.7687      7.0400
  1756 CA   GLU     48      0.0010      6.7721      7.1500
  1799 CA   SER     49      0.0014      7.1705      7.6800
  1800 CA   SER     49      0.0014      7.1556      7.6700
  1801 CA   SER     49      0.0014      7.1836      8.2000
  1832 CA   ILE     50      0.0011      6.8365      6.6600
  1833 CA   ILE     50      0.0011      6.8234      6.8700
  1834 CA   ILE     50      0.0011      6.8215      6.7100
  1887 CA   GLY     51      0.0015      7.3133      8.7400
  1898 CA   ARG     52      0.0017      7.5230      6.9600
  1899 CA   ARG     52      0.0017      7.5244      6.9000
  1900 CA   ARG     52      0.0017      7.5276      6.7900
  1968 CA   PRO     53      0.0010      6.7406      6.2900
  1984 CA   LEU     54      0.0008      6.4945      6.1200
  1985 CA   LEU     54      0.0008      6.4982      5.9600
  1986 CA   LEU     54      0.0008      6.4992      6.2800
  2041 CA   PRO     55      0.0022      8.1154      6.9500
  2042 CA   PRO     55      0.0022      8.1006      6.4400
  2043 CA   PRO     55      0.0022      8.1522      6.1600
  2081 CA   GLY     56      0.0023      8.1924      8.7900
  2091 CA   ARG     57      0.0008      6.5368      6.7600
  2092 CA   ARG     57      0.0008      6.5401      6.5500
  2138 CA   LYS     58      0.0006      6.2876      6.4800
  2162 CA   ASN     59      0.0004      6.0871      5.8100
  2163 CA   ASN     59      0.0004      6.0877      5.1300
  2189 CA   ILE     60      0.0003      5.9689      6.2100
  2210 CA   ILE     61      0.0004      6.0303      5.1400
  2211 CA   ILE     61      0.0004      6.0302      5.3800
  2247 CA   LEU     62      0.0005      6.1204      6.7100
  2267 CA   SER     63      0.0011      6.9072      8.3800
  2279 CA   SER     64      0.0035      9.6569     12.4900
  2280 CA   SER     64      0.0035      9.6456     12.8800
  2301 CA   GLN     65      0.0031      9.2006     12.9100
  2302 CA   GLN     65      0.0031      9.1475     13.2000
  2335 CA   PRO     66      0.0038      9.9734     12.6000
  2336 CA   PRO     66      0.0037      9.7954     12.7300
  2362 CA   GLY     67      0.0016      7.4282     12.1400
  2372 CA   THR     68      0.0023      8.2229     10.8700
  2373 CA   THR     68      0.0023      8.2399     10.7700
  2374 CA   THR     68      0.0022      8.1406     10.3200
  2414 CA   ASP     69      0.0017      7.5482      8.4900
  2415 CA   ASP     69      0.0017      7.5746      7.9900
  2416 CA   ASP     69      0.0017      7.5440      6.5700
  2450 CA   ASP     70      0.0028      8.7769      7.1800
  2451 CA   ASP     70      0.0028      8.7725      6.9800
  2452 CA   ASP     70      0.0028      8.7855      6.2700
  2486 CA   ARG     71      0.0024      8.2912      7.1100
  2487 CA   ARG     71      0.0023      8.2513      7.3800
  2488 CA   ARG     71      0.0023      8.2675      6.2800
  2558 CA   VAL     72      0.0009      6.6230      6.7100
  2559 CA   VAL     72      0.0009      6.5820      5.9800
  2560 CA   VAL     72      0.0009      6.6060      5.5600
  2606 CA   THR     73      0.0008      6.4572      6.2000
  2607 CA   THR     73      0.0008      6.4495      5.7100
  2608 CA   THR     73      0.0007      6.4481      5.3600
  2648 CA   TRP     74      0.0008      6.4941      6.5900
  2649 CA   TRP     74      0.0008      6.4799      6.2000
  2650 CA   TRP     74      0.0008      6.4806      5.9800
  2720 CA   VAL     75      0.0009      6.6010      6.6800
  2721 CA   VAL     75      0.0009      6.6033      6.8500
  2722 CA   VAL     75      0.0009      6.5993      6.2800
  2768 CA   LYS     76      0.0020      7.8938      8.2500
  2769 CA   LYS     76      0.0020      7.9239      8.8500
  2770 CA   LYS     76      0.0021      7.9579      7.8600
  2834 CA   SER     77      0.0020      7.9018      7.1800
  2835 CA   SER     77      0.0020      7.8371      8.1100
  2836 CA   SER     77      0.0019      7.7915      6.8100
  2867 CA   VAL     78      0.0009      6.5841      7.4500
  2868 CA   VAL     78      0.0009      6.5760      7.8600
  2869 CA   VAL     78      0.0009      6.5659      7.1600
  2915 CA   ASP     79      0.0014      7.2225      8.6100
  2916 CA   ASP     79      0.0014      7.2287      8.9500
  2917 CA   ASP     79      0.0015      7.2967      8.5900
  2949 CA   GLU     80      0.0012      6.9595      7.0800
  2966 CA   ALA     81      0.0006      6.2538      6.2500
  2978 CA   ILE     82      0.0008      6.4629      6.6100
  2979 CA   ILE     82      0.0008      6.4613      6.6400
  2980 CA   ILE     82      0.0008      6.4601      6.4700
  3035 CA   ALA     83      0.0021      7.9531      7.7500
  3036 CA   ALA     83      0.0020      7.9286      7.0300
  3037 CA   ALA     83      0.0020      7.9290      7.8500
  3063 CA   ALA     84      0.0010      6.7921      7.7700
  3076 CA   CYS     85      0.0010      6.6979      9.6900
  3077 CA   CYS     85      0.0010      6.7032      9.2900
  3097 CA   GLY     86      0.0082     15.0230     12.4800
  3106 CA   ASP     87      0.0125     19.9265     12.9400
  3107 CA   ASP     87      0.0138     21.4379     13.9600
  3130 CA   VAL     88      0.0026      8.6212     11.2400
  3131 CA   VAL     88      0.0026      8.6301     11.9000
  3162 CA   PRO     89      0.0037      9.8198     11.9700
  3163 CA   PRO     89      0.0035      9.6653     10.4400
  3189 CA   GLU     90      0.0008      6.4971      8.2900
  3207 CA   ILE     91      0.0005      6.1829      6.3600
  3208 CA   ILE     91      0.0005      6.1824      6.2400
  3209 CA   ILE     91      0.0005      6.1827      6.3500
  3262 CA   MET     92      0.0003      5.9781      5.0000
  3283 CA   VAL     93      0.0003      5.9632      4.7600
  3284 CA   VAL     93      0.0003      5.9634      4.5300
  3285 CA   VAL     93      0.0003      5.9652      4.7900
  3331 CA   ILE     94      0.0004      6.0274      5.0900
  3332 CA   ILE     94      0.0004      6.0248      4.4400
  3333 CA   ILE     94      0.0004      6.0276      4.1900
  3386 CA   GLY     95      0.0004      6.0373      5.0500
  3395 CA   GLY     96      0.0005      6.1876      5.1500
  3402 CA   GLY     97      0.0007      6.3493      6.1800
  3411 CA   ARG     98      0.0011      6.8587      5.9800
  3412 CA   ARG     98      0.0011      6.8636      6.4100
  3413 CA   ARG     98      0.0011      6.8714      6.6500
  3483 CA   VAL     99      0.0005      6.1293      5.5900
  3484 CA   VAL     99      0.0005      6.1303      5.6000
  3485 CA   VAL     99      0.0005      6.1286      5.5000
  3529 CA   TYR    100      0.0004      6.0488      5.4900
  3552 CA   GLU    101      0.0007      6.4188      6.9800
  3585 CA   GLN    102      0.0008      6.4724      8.0100
  3614 CA   PHE    103      0.0005      6.1171      7.1800
  3615 CA   PHE    103      0.0005      6.1194      6.8000
  3654 CA   LEU    104      0.0006      6.2645      6.8100
  3655 CA   LEU    104      0.0006      6.2567      7.2400
  3692 CA   PRO    105      0.0018      7.6797      7.5000
  3693 CA   PRO    105      0.0018      7.6298      7.8400
  3720 CA   LYS    106      0.0012      6.9149     10.4100
  3721 CA   LYS    106      0.0012      6.9490      8.6400
  3764 CA   ALA    107      0.0007      6.3634      7.3600
  3765 CA   ALA    107      0.0007      6.3498      7.7700
  3784 CA   GLN    108      0.0010      6.7212      7.9100
  3785 CA   GLN    108      0.0010      6.7362      7.8700
  3818 CA   LYS    109      0.0007      6.3756      7.6600
  3819 CA   LYS    109      0.0007      6.3784      5.8000
  3862 CA   LEU    110      0.0005      6.1293      6.1700
  3863 CA   LEU    110      0.0005      6.1288      6.3200
  3900 CA   TYR    111      0.0004      6.0589      5.2700
  3901 CA   TYR    111      0.0004      6.0591      5.2600
  3941 CA   LEU    112      0.0004      6.0179      5.2200
  3964 CA   THR    113      0.0005      6.1610      5.4400
  3965 CA   THR    113      0.0005      6.1612      5.2600
  3966 CA   THR    113      0.0005      6.1609      4.5100
  3967 CA   THR    113      0.0005      6.1612      5.6100
  4020 CA   HIS    114      0.0006      6.2398      5.3300
  4021 CA   HIS    114      0.0006      6.2385      5.2600
  4022 CA   HIS    114      0.0006      6.2400      4.7700
  4023 CA   HIS    114      0.0006      6.2396      5.6200
  4085 CA   ILE    115      0.0006      6.2384      5.8500
  4121 CA   ASP    116      0.0013      7.0676      6.4200
  4122 CA   ASP    116      0.0013      7.0659      5.9500
  4145 CA   ALA    117      0.0012      6.9246      7.3500
  4146 CA   ALA    117      0.0012      6.9526      8.2100
  4165 CA   GLU    118      0.0021      8.0040      9.4600
  4166 CA   GLU    118      0.0021      8.0368      9.1900
  4195 CA   VAL    119      0.0015      7.3504     11.2000
  4196 CA   VAL    119      0.0015      7.3340     12.2300
  4227 CA   GLU    120      0.0039     10.0965     10.4800
  4228 CA   GLU    120      0.0039     10.0488      9.7300
  4256 CA   GLY    121      0.0019      7.7598      9.3300
  4264 CA   ASP    122      0.0050     11.3453      6.4800
  4277 CA   THR    123      0.0014      7.1435      5.5300
  4278 CA   THR    123      0.0013      7.1264      5.7100
  4304 CA   HIS    124      0.0008      6.4567      5.4500
  4322 CA   PHE    125      0.0005      6.1536      5.3000
  4345 CA   PRO    126      0.0007      6.3566      6.0700
  4346 CA   PRO    126      0.0007      6.3485      6.0700
  4347 CA   PRO    126      0.0007      6.3563      6.6700
  4348 CA   PRO    126      0.0007      6.3637      6.7400
  4401 CA   ASP    127      0.0011      6.8115      7.1700
  4402 CA   ASP    127      0.0010      6.7653      7.0400
  4403 CA   ASP    127      0.0010      6.7890      7.3300
  4404 CA   ASP    127      0.0011      6.7991      8.6800
  4449 CA   TYR    128      0.0008      6.5419      7.4600
  4450 CA   TYR    128      0.0008      6.5165      8.3800
  4451 CA   TYR    128      0.0008      6.5069      8.0400
  4452 CA   TYR    128      0.0008      6.5343      8.0600
  4530 CA   GLU    129      0.0023      8.2708      9.4800
  4559 CA   PRO    130      0.0026      8.6314      9.1400
  4560 CA   PRO    130      0.0026      8.5499      8.8900
  4561 CA   PRO    130      0.0025      8.5036      8.7700
  4601 CA   ASP    131      0.0057     12.0909      7.8700
  4602 CA   ASP    131      0.0055     11.8840      8.6800
  4603 CA   ASP    131      0.0051     11.4973      8.6200
  4637 CA   ASP    132      0.0028      8.8608      9.6000
  4638 CA   ASP    132      0.0029      8.9023      9.2500
  4639 CA   ASP    132      0.0028      8.7703      8.7200
  4671 CA   TRP    133      0.0012      6.9582      7.6900
  4697 CA   GLU    134      0.0032      9.2387      7.7700
  4712 CA   SER    135      0.0022      8.0935      8.3400
  4725 CA   VAL    136      0.0026      8.5681      9.1500
  4726 CA   VAL    136      0.0026      8.6134      8.9700
  4727 CA   VAL    136      0.0026      8.5881      8.4000
  4773 CA   PHE    137      0.0020      7.8445      8.2400
  4774 CA   PHE    137      0.0020      7.8868      8.4600
  4775 CA   PHE    137      0.0019      7.7633      8.3400
  4833 CA   SER    138      0.0019      7.7831      8.6800
  4834 CA   SER    138      0.0018      7.6393      8.7700
  4835 CA   SER    138      0.0018      7.6742      9.1700
  4866 CA   GLU    139      0.0018      7.6569      7.1500
  4867 CA   GLU    139      0.0018      7.6198      8.1300
  4868 CA   GLU    139      0.0018      7.6160      8.0200
  4909 CA   PHE    140      0.0027      8.6389      6.9600
  4933 CA   HIS    141      0.0019      7.8066      7.5400
  4934 CA   HIS    141      0.0019      7.8054      6.8700
  4935 CA   HIS    141      0.0019      7.7704      7.2100
  4984 CA   ASP    142      0.0035      9.6345      8.4700
  4985 CA   ASP    142      0.0036      9.6972      8.3200
  4986 CA   ASP    142      0.0035      9.6347      8.0400
  5018 CA   ALA    143      0.0024      8.3146      8.6000
  5032 CA   ASP    144      0.0046     10.8899      9.6400
  5033 CA   ASP    144      0.0046     10.9123      9.0000
  5034 CA   ASP    144      0.0046     10.9162      9.9000
  5068 CA   ALA    145      0.0088     15.7147      9.9700
  5069 CA   ALA    145      0.0088     15.7580      8.3500
  5070 CA   ALA    145      0.0086     15.4609      9.5400
  5098 CA   GLN    146      0.0042     10.4755      8.4300
  5099 CA   GLN    146      0.0043     10.5619      8.6900
  5100 CA   GLN    146      0.0043     10.5085      9.0500
  5149 CA   ASN    147      0.0018      7.6612      6.6100
  5150 CA   ASN    147      0.0018      7.6693      8.1600
  5151 CA   ASN    147      0.0018      7.6285      8.0000
  5191 CA   SER    148      0.0024      8.4032      8.5100
  5192 CA   SER    148      0.0024      8.4013      8.7800
  5193 CA   SER    148      0.0024      8.3947      8.8800
  5223 CA   HIS    149      0.0013      7.0992      6.2900
  5224 CA   HIS    149      0.0013      7.1135      7.6800
  5256 CA   SER    150      0.0014      7.2245      7.1800
  5269 CA   TYR    151      0.0008      6.5115      6.8700
  5270 CA   TYR    151      0.0008      6.5069      6.7200
  5311 CA   PHE    153      0.0007      6.3670      5.8700
  5312 CA   PHE    153      0.0007      6.3642      5.3500
  5350 CA   GLU    154      0.0007      6.4313      6.9600
  5366 CA   ILE    155      0.0008      6.5089      6.2400
  5386 CA   LEU    156      0.0008      6.4535      7.3600
  5387 CA   LEU    156      0.0008      6.4548      6.3700
  5424 CA   GLU    157      0.0013      7.1038      6.8300
  5425 CA   GLU    157      0.0013      7.0845      7.4100
  5453 CA   ARG    158      0.0014      7.1954      7.7600
  5478 CA   ARG    159      0.0086     15.4602     11.2300

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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.