Should you encounter any unexpected behaviour,
please let us know.

* CME2 *

B-factor analysis for ID 240123140906140714

Overall B-factor prediction

Correlation= 0.043 for 165 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-SCALED	B-OBS
2 CA MET 1 25.3774 33.7929 26.1900
10 CA GLY 2 15.2466 31.8599 24.0600
14 CA GLY 3 12.7776 31.3888 23.1100
18 CA SER 4 8.8464 30.6387 26.9700
24 CA ALA 5 8.1880 30.5131 25.1900
29 CA SER 6 6.0835 30.1116 28.8800
35 CA LEU 7 5.4841 29.9972 28.3800
43 CA GLN 8 4.3730 29.7852 28.8600
52 CA HIS 9 4.1774 29.7479 28.0200
62 CA THR 10 3.6734 29.6517 29.9500
69 CA ALA 11 3.9722 29.7087 29.0600
74 CA PRO 12 3.8329 29.6821 31.2000
81 CA PHE 13 3.4915 29.6170 28.5900
92 CA GLY 14 3.8884 29.6927 27.5600
96 CA CYS 15 2.7660 29.4786 31.4200
102 CA GLN 16 3.9414 29.7029 28.6200
111 CA ILE 17 2.9560 29.5148 31.5500
119 CA ALA 18 4.8228 29.8710 29.2500
124 CA THR 19 4.6449 29.8371 28.6100
131 CA ASN 20 7.0231 30.2909 27.4100
139 CA GLY 21 8.0021 30.4776 24.5300
143 CA GLY 22 11.6466 31.1730 25.0900
147 CA GLY 23 12.4080 31.3183 23.4700
151 CA GLY 24 11.7343 31.1898 27.9200
155 CA GLY 25 8.2785 30.5304 27.3300
159 CA ASN 26 6.3358 30.1597 31.3100
167 CA TYR 27 4.8569 29.8775 33.0000
179 CA PRO 28 2.9886 29.5211 34.9100
186 CA ALA 29 2.8951 29.5032 36.0900
191 CA SER 30 1.7028 29.2757 39.7800
197 CA HIS 31 1.6695 29.2694 38.1600
207 CA THR 32 1.2149 29.1826 41.3800
214 CA THR 33 1.5751 29.2514 37.8100
221 CA LEU 34 1.5113 29.2392 39.7500
229 CA GLY 35 2.2258 29.3755 34.6600
233 CA VAL 36 2.6689 29.4601 35.1900
240 CA GLN 37 3.8585 29.6870 34.1200
249 CA ASP 38 4.9085 29.8874 34.8400
257 CA ILE 39 5.6318 30.0254 38.1600
265 CA GLY 40 7.7683 30.4330 32.4700
269 CA GLY 41 8.8728 30.6438 40.0000
273 CA GLY 42 7.4244 30.3674 34.4100
277 CA GLY 43 4.8200 29.8705 35.0600
281 CA GLY 44 3.5224 29.6229 36.2800
285 CA ILE 45 2.8064 29.4863 34.5900
293 CA GLN 46 2.2602 29.3821 36.5000
302 CA VAL 47 1.3018 29.1992 38.5000
309 CA SER 48 1.1192 29.1644 39.1900
315 CA LEU 49 0.5375 29.0534 43.9100
323 CA GLN 50 0.7745 29.0986 39.6900
332 CA ILE 51 0.5594 29.0576 43.2800
340 CA GLY 52 1.0512 29.1514 37.1200
344 CA ILE 53 1.2223 29.1840 40.0900
352 CA LYS 54 2.0146 29.3352 34.6900
361 CA THR 55 2.5754 29.4422 38.5300
368 CA ASP 56 3.4302 29.6053 33.9700
376 CA ASP 57 4.5752 29.8238 39.6200
384 CA SER 58 4.6361 29.8354 36.0000
390 CA HIS 59 5.3246 29.9668 37.8100
400 CA ASP 60 5.4023 29.9816 35.7500
408 CA TRP 61 4.3403 29.7790 40.1600
422 CA THR 62 6.0140 30.0983 32.3400
429 CA GLY 63 6.5426 30.1992 26.8100
433 CA GLY 64 7.2518 30.3345 34.0000
437 CA GLY 65 5.6957 30.0376 30.9100
441 CA GLY 66 4.5164 29.8126 30.6400
445 CA GLY 67 3.2198 29.5652 31.7200
449 CA THR 68 2.3578 29.4007 30.9700
456 CA SER 69 1.9245 29.3180 34.6600
462 CA ALA 70 2.2359 29.3774 32.6200
467 CA PRO 71 1.4522 29.2279 34.5300
474 CA CYS 72 0.9474 29.1316 33.0600
480 CA THR 73 1.0657 29.1542 34.5000
487 CA ILE 74 0.5314 29.0522 36.4400
495 CA THR 75 1.1352 29.1674 33.5900
502 CA GLY 76 0.9182 29.1260 34.7200
506 CA THR 77 1.6853 29.2724 31.2000
513 CA MET 78 1.5468 29.2460 32.9400
521 CA GLY 79 2.4573 29.4197 27.2200
525 CA HIS 80 3.5797 29.6338 25.1200
535 CA PHE 81 4.1163 29.7362 27.9200
546 CA GLY 82 5.9351 30.0832 21.8800
550 CA GLY 83 8.5918 30.5902 26.8400
554 CA GLY 84 11.3877 31.1236 22.1400
558 CA GLY 85 14.1959 31.6594 27.4100
562 CA GLY 86 10.6412 30.9812 22.0600
566 CA HIS 87 8.2755 30.5298 22.4500
576 CA ALA 88 5.3228 29.9664 24.4100
581 CA ALA 89 5.0112 29.9070 22.0600
586 CA VAL 90 3.6299 29.6434 27.4800
593 CA THR 91 3.1355 29.5491 21.5300
600 CA ASN 92 3.0812 29.5387 25.1100
608 CA HIS 93 2.7662 29.4786 28.1900
618 CA LYS 94 2.5551 29.4383 25.0800
627 CA LYS 95 2.2833 29.3865 29.2500
636 CA TRP 96 1.3149 29.2017 30.6600
650 CA GLN 97 2.4017 29.4091 27.5200
659 CA TYR 98 2.1714 29.3651 26.9100
671 CA ASN 99 3.8440 29.6843 24.6900
679 CA SER 100 3.8464 29.6847 27.3400
685 CA PRO 101 6.1563 30.1255 27.1200
692 CA LEU 102 4.9653 29.8982 25.6900
700 CA VAL 103 3.8866 29.6924 29.8800
707 CA PRO 104 5.4369 29.9882 26.9800
714 CA ARG 105 6.4264 30.1770 28.7800
725 CA ASN 106 7.1085 30.3071 28.8300
733 CA ALA 107 8.2924 30.5330 29.7500
738 CA GLU 108 9.9199 30.8436 28.6700
747 CA LEU 109 8.9631 30.6610 29.6600
755 CA GLY 110 9.3276 30.7306 27.3000
759 CA ASP 111 7.1909 30.3229 27.8100
767 CA ARG 112 6.1788 30.1298 27.0000
778 CA GLN 113 5.7568 30.0492 28.1100
787 CA GLY 114 5.0514 29.9146 26.8900
791 CA LYS 115 6.1399 30.1223 26.7200
800 CA ILE 116 4.8640 29.8789 30.3300
808 CA HIS 117 6.9446 30.2759 27.4800
818 CA ILE 118 6.1239 30.1193 29.9500
826 CA PRO 119 8.7238 30.6153 25.0900
833 CA PHE 120 9.1616 30.6989 24.6900
844 CA GLY 121 10.1966 30.8964 22.6600
848 CA GLY 122 10.0420 30.8669 25.8400
852 CA GLY 123 7.3535 30.3539 28.6700
856 CA GLY 124 5.6483 30.0285 28.9400
860 CA GLY 125 3.5481 29.6278 31.1700
864 CA LEU 126 2.6012 29.4471 33.5000
872 CA LEU 127 3.0927 29.5409 34.6200
880 CA SER 128 2.4833 29.4246 36.3800
886 CA MET 129 1.0951 29.1598 36.0600
894 CA VAL 130 1.1495 29.1701 37.6200
901 CA GLY 131 1.8897 29.3114 36.1600
905 CA MET 132 1.0961 29.1600 35.7200
913 CA ALA 133 0.3584 29.0192 35.5600
918 CA VAL 134 0.8690 29.1166 35.5300
925 CA GLY 135 1.5525 29.2470 33.0900
929 CA MET 136 0.9670 29.1353 33.2800
937 CA CYS 137 0.7872 29.1010 31.7800
943 CA MET 138 1.7862 29.2916 32.2800
951 CA GLY 139 2.5895 29.4449 28.0800
955 CA GLY 140 3.7192 29.6605 27.9400
959 CA GLY 141 4.3202 29.7751 26.7700
963 CA GLY 142 4.3198 29.7750 27.8800
967 CA GLY 143 4.4252 29.7952 28.4200
971 CA VAL 144 5.3714 29.9757 29.0300
978 CA VAL 145 4.8204 29.8706 31.2300
985 CA ASP 146 7.4395 30.3703 26.3400
993 CA THR 147 7.4930 30.3805 29.4700
1000 CA THR 148 10.9501 31.0401 23.8600
1007 CA GLY 149 13.3892 31.5055 25.0500
1011 CA SER 150 14.1741 31.6553 23.3900
1017 CA THR 151 17.8617 32.3589 23.4100
1024 CA LYS 152 21.1234 32.9812 24.8100
1033 CA PRO 153 15.5327 31.9145 25.7000
1040 CA ASP 154 33.1203 35.2703 28.0200
1048 CA PRO 155 39.4469 36.4774 33.0600
1055 CA GLY 156 39.6693 36.5198 32.8100
1059 CA ASP 157 20.9365 32.9456 30.7000
1067 CA ARG 158 21.8839 33.1263 38.4400
1078 CA SER 159 21.2572 33.0067 31.8000
1084 CA HIS 160 29.1440 34.5116 40.2800
1094 CA HIS 161 44.6561 37.4713 31.9800
1104 CA HIS 162 73.7293 43.0185 33.0900
1114 CA HIS 163 116.9522 51.2656 30.4200
1124 CA HIS 164 178.5222 63.0132 33.0600
1134 CA HIS 165 254.0086 77.4162 38.2800

If you find results from this site helpful for your research, please cite one of our papers:

K. Suhre & Y.H. Sanejouand, ElNemo: a normal mode web-server for protein movement analysis and the generation of templates for molecular replacement. Nucleic Acids Research, 32, W610-W614, 2004.
K. Suhre & Y.H. Sanejouand, On the potential of normal mode analysis for solving difficult molecular replacement problems. Acta Cryst. D vol.60, p796-799, 2004 © International Union of Crystallography.

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.

Should you encounter any unexpected behaviour, please let us know.