Should you encounter any unexpected behaviour,
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* 1NL2 *

B-factor analysis for ID 22031018430786271

Overall B-factor prediction

Correlation= 0.563 for 136 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 ALA 1 0.1908 47.1935 40.6100
7 CA ASN 2 0.3694 57.4897 51.6200
15 CA LYS 3 0.5908 70.2589 68.3100
24 CA GLY 4 0.8544 85.4574 76.1600
28 CA PHE 5 0.8899 87.5046 69.0700
39 CA LEU 6 0.8211 83.5378 42.9400
47 CA VAL 9 0.8356 84.3733 42.8900
54 CA ARG 10 0.4639 62.9426 53.8200
65 CA LYS 11 0.3917 58.7800 56.3700
74 CA GLY 12 0.2265 49.2529 47.4400
78 CA ASN 13 0.1258 43.4483 39.0300
86 CA LEU 14 0.0680 40.1158 36.8600
94 CA ARG 16 0.1221 43.2353 37.8900
105 CA CYS 18 0.0452 38.7966 36.6500
111 CA LEU 19 0.0564 39.4472 35.3100
119 CA PRO 22 0.0762 40.5863 32.9300
126 CA CYS 23 0.0608 39.6981 34.2300
132 CA SER 24 0.1052 42.2606 38.4700
138 CA ARG 25 0.0714 40.3117 41.2400
149 CA ALA 28 0.0524 39.2132 28.3600
154 CA PHE 29 0.0863 41.1675 31.1300
165 CA ALA 31 0.1131 42.7160 42.4000
170 CA LEU 32 0.1031 42.1400 45.5900
178 CA SER 34 0.1817 46.6680 59.2500
184 CA LEU 35 0.1371 44.0961 50.3000
192 CA SER 36 0.1426 44.4180 46.1700
198 CA ALA 37 0.0996 41.9360 36.0200
203 CA THR 38 0.0647 39.9230 34.9300
210 CA ASP 39 0.0667 40.0408 30.2600
218 CA ALA 40 0.0514 39.1559 27.4100
223 CA PHE 41 0.0437 38.7145 31.5200
234 CA TRP 42 0.0430 38.6749 40.7700
248 CA ALA 43 0.0405 38.5303 38.8300
253 CA LYS 44 0.0306 37.9575 36.9400
262 CA TYR 45 0.0346 38.1882 31.7300
274 CA THR 46 0.0408 38.5449 34.7800
281 CA ALA 47 0.0306 37.9563 32.2200
286 CA CYS 48 0.0297 37.9060 30.8000
292 CA GLU 49 0.0458 38.8311 63.1300
301 CA SER 50 0.0553 39.3800 51.3500
307 CA ALA 51 0.0429 38.6639 36.1900
312 CA ARG 52 0.0475 38.9319 50.3500
323 CA ASN 53 0.0894 41.3482 48.0300
331 CA PRO 54 0.1069 42.3583 47.2200
338 CA ARG 55 0.0745 40.4888 46.1800
349 CA GLU 56 0.0791 40.7539 46.3700
362 CA LYS 57 0.0474 38.9253 42.7600
371 CA LEU 58 0.0364 38.2900 40.6400
379 CA ASN 59 0.0443 38.7470 41.0100
387 CA GLU 60 0.0348 38.1977 38.5300
396 CA CYS 61 0.0239 37.5690 41.2800
402 CA LEU 62 0.0265 37.7227 41.1700
410 CA GLU 63 0.0392 38.4532 38.5600
419 CA GLY 64 0.0224 37.4863 35.2700
423 CA ASN 65 0.0290 37.8634 38.1600
431 CA CYS 66 0.0231 37.5244 35.8900
437 CA ALA 67 0.0198 37.3351 40.0300
442 CA GLU 68 0.0233 37.5350 40.3300
451 CA GLY 69 0.0418 38.6028 39.3200
455 CA VAL 70 0.0392 38.4518 45.4700
462 CA GLY 71 0.0189 37.2843 45.8100
466 CA MET 72 0.0214 37.4291 41.9300
474 CA ASN 73 0.0204 37.3702 37.9300
482 CA TYR 74 0.0169 37.1656 41.7100
494 CA ARG 75 0.0214 37.4282 41.2100
505 CA GLY 76 0.0252 37.6481 39.0500
509 CA ASN 77 0.0371 38.3311 43.2300
517 CA VAL 78 0.0275 37.7791 34.0800
524 CA SER 79 0.0273 37.7672 42.5200
530 CA VAL 80 0.0360 38.2692 42.5000
537 CA THR 81 0.0313 37.9949 41.4200
544 CA ARG 82 0.0566 39.4573 49.3600
555 CA SER 83 0.0999 41.9530 52.9400
561 CA GLY 84 0.0978 41.8345 43.2200
565 CA ILE 85 0.0568 39.4663 44.3900
573 CA GLU 86 0.0487 39.0019 35.8300
582 CA CYS 87 0.0221 37.4683 41.3100
588 CA GLN 88 0.0218 37.4477 34.1600
597 CA LEU 89 0.0261 37.7001 40.4500
605 CA TRP 90 0.0161 37.1229 40.0200
619 CA ARG 91 0.0478 38.9519 39.3200
630 CA SER 92 0.0472 38.9173 30.5500
636 CA ARG 93 0.0607 39.6934 38.4800
647 CA TYR 94 0.0577 39.5220 36.2600
659 CA PRO 95 0.0533 39.2648 28.1500
666 CA HIS 96 0.0348 38.1989 44.7600
676 CA LYS 97 0.0458 38.8320 47.7600
685 CA PRO 98 0.0271 37.7560 37.5500
692 CA GLU 99 0.0445 38.7579 39.1300
701 CA ILE 100 0.0301 37.9297 40.5500
709 CA ASN 101 0.0370 38.3264 53.3800
717 CA SER 102 0.0541 39.3111 48.3400
723 CA THR 103 0.1173 42.9546 52.1300
730 CA THR 104 0.0824 40.9435 52.9900
737 CA HIS 105 0.0572 39.4928 48.8300
747 CA PRO 106 0.0826 40.9578 52.7300
754 CA GLY 107 0.0572 39.4885 46.7900
758 CA ALA 108 0.0321 38.0435 34.7400
763 CA ASP 109 0.0327 38.0808 32.2400
771 CA LEU 110 0.0222 37.4725 41.2900
779 CA ARG 111 0.0362 38.2824 41.8200
790 CA GLU 112 0.0384 38.4068 30.6200
799 CA ASN 113 0.0209 37.3959 33.0100
807 CA PHE 114 0.0162 37.1281 39.2000
818 CA CYS 115 0.0089 36.7045 38.7300
824 CA ARG 116 0.0093 36.7302 27.3300
835 CA ASN 117 0.0151 37.0648 37.9300
843 CA PRO 118 0.0252 37.6466 35.0200
850 CA ASP 119 0.0409 38.5539 30.7600
858 CA GLY 120 0.0455 38.8191 31.9300
862 CA SER 121 0.0389 38.4352 41.1600
868 CA ILE 122 0.0968 41.7725 39.0900
876 CA THR 123 0.0703 40.2471 31.8100
883 CA GLY 124 0.0256 37.6700 29.9600
887 CA PRO 125 0.0116 36.8627 36.1800
894 CA TRP 126 0.0102 36.7810 34.9800
908 CA CYS 127 0.0079 36.6508 34.0400
914 CA TYR 128 0.0115 36.8576 33.6500
926 CA THR 129 0.0250 37.6354 29.7100
933 CA THR 130 0.0436 38.7065 42.6000
940 CA SER 131 0.0711 40.2945 37.4900
946 CA PRO 132 0.1058 42.2934 46.5500
953 CA THR 133 0.1616 45.5114 53.1500
960 CA LEU 134 0.0621 39.7764 44.5000
968 CA ARG 135 0.0365 38.2993 42.7200
979 CA ARG 136 0.0225 37.4911 37.5700
990 CA GLU 137 0.0278 37.7934 34.9900
999 CA GLU 138 0.0243 37.5941 32.6500
1008 CA CYS 139 0.0222 37.4740 35.5600
1014 CA SER 140 0.0525 39.2194 44.3200
1020 CA VAL 141 0.0330 38.0957 45.7100
1027 CA PRO 142 0.0527 39.2332 40.8300
1034 CA VAL 143 0.0586 39.5743 46.0900
1041 CA CYS 144 0.0393 38.4617 42.7000
1047 CA GLY 145 0.3153 54.3746 57.3800
1051 CA GLN 146 0.2866 52.7206 82.2000

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: October 18th, 2018.

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