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

* esp *

B-factor analysis for ID 2402122212402551674

Overall B-factor prediction

Correlation= 0.512 for 246 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 GLY 484 0.0857 156.0032 136.9300
6 CA ASP 485 0.0754 145.8054 170.0800
14 CA ALA 486 0.0381 109.0067 164.7200
19 CA LEU 487 0.0291 100.1277 123.3900
27 CA ARG 488 0.0416 112.5213 154.3100
38 CA LEU 489 0.0306 101.6074 164.7000
46 CA ALA 490 0.0173 88.4614 145.1400
51 CA ARG 491 0.0174 88.5837 110.5400
62 CA ARG 492 0.0263 97.3725 117.5900
73 CA ILE 493 0.0157 86.8965 118.3100
81 CA ALA 494 0.0130 84.2441 88.6600
86 CA ALA 495 0.0176 88.7998 96.7500
91 CA ALA 496 0.0181 89.3199 114.0600
96 CA LEU 497 0.0130 84.2236 116.2400
104 CA ASN 498 0.0168 88.0133 107.1700
112 CA ALA 499 0.0275 98.5140 118.8500
117 CA SER 500 0.0476 118.4133 155.0500
123 CA ASP 501 0.0608 131.4102 176.3300
131 CA ASN 502 0.0299 100.8945 175.1300
139 CA ASN 503 0.0244 95.5136 173.6100
147 CA ALA 504 0.0825 152.8706 135.8600
152 CA GLY 505 0.0870 157.2771 114.7200
156 CA ASP 506 0.0224 93.4839 90.6300
164 CA TYR 507 0.0298 100.8373 75.2600
176 CA GLY 508 0.0145 85.7423 60.7300
180 CA PHE 509 0.0105 81.8062 73.4800
191 CA PHE 510 0.0076 78.9068 60.4600
202 CA TRP 511 0.0063 77.6205 59.6000
216 CA ILE 512 0.0060 77.3202 77.1900
224 CA THR 513 0.0058 77.1347 99.7200
231 CA ALA 514 0.0082 79.5577 118.0100
236 CA VAL 515 0.0108 82.1054 114.9600
243 CA THR 516 0.0181 89.2973 135.4300
250 CA THR 517 0.0354 106.3246 134.6400
257 CA ASP 518 0.0475 118.2680 163.0500
265 CA GLY 519 0.0294 100.3920 140.7200
269 CA SER 520 0.0163 87.5074 123.0800
275 CA ILE 521 0.0118 83.0675 126.5900
283 CA VAL 522 0.0071 78.4025 98.9400
290 CA VAL 523 0.0061 77.4492 96.1300
297 CA ALA 524 0.0057 77.0355 90.4100
302 CA ASN 525 0.0055 76.8102 67.6900
310 CA SER 526 0.0069 78.2132 66.0800
316 CA TYR 527 0.0066 77.9262 61.6600
328 CA GLY 528 0.0062 77.5874 53.9300
332 CA LEU 529 0.0069 78.2365 63.4000
340 CA ALA 530 0.0078 79.1039 71.9700
345 CA TYR 531 0.0074 78.7231 77.9000
357 CA ILE 532 0.0097 81.0393 78.8700
365 CA PRO 533 0.0120 83.2624 78.3300
372 CA ASP 534 0.0158 86.9851 100.4700
380 CA GLY 535 0.0232 94.2979 103.4100
384 CA MET 536 0.0194 90.5422 86.8800
392 CA GLU 537 0.0200 91.1839 107.4900
401 CA LEU 538 0.0165 87.7272 117.3900
409 CA PRO 539 0.0213 92.4212 132.5900
416 CA ASN 540 0.0411 111.9702 122.8200
424 CA LYS 541 0.0234 94.4659 125.2500
433 CA VAL 542 0.0128 84.0804 131.7500
440 CA TYR 543 0.0125 83.7531 125.5000
452 CA LEU 544 0.0074 78.6974 80.2500
460 CA ALA 545 0.0073 78.6175 74.1500
465 CA SER 546 0.0069 78.2542 70.0200
471 CA ALA 547 0.0088 80.0570 78.4700
476 CA ASP 548 0.0154 86.6265 73.4800
484 CA HIS 549 0.0202 91.3680 76.5900
494 CA ALA 550 0.0303 101.2909 80.3500
499 CA ILE 551 0.0210 92.0991 82.5600
507 CA PRO 552 0.0264 97.5047 55.7000
514 CA VAL 553 0.0227 93.8261 58.4800
521 CA ASP 554 0.0284 99.4770 77.1200
529 CA GLU 555 0.0217 92.8155 73.5600
538 CA ILE 556 0.0124 83.6854 75.4400
546 CA ALA 557 0.0145 85.7616 70.5700
551 CA ARG 558 0.0230 94.1283 62.5900
562 CA CYS 559 0.0132 84.4165 59.8700
568 CA ALA 560 0.0095 80.8288 54.5700
573 CA THR 561 0.0082 79.4941 68.1600
580 CA TYR 562 0.0085 79.8109 73.7000
592 CA PRO 563 0.0078 79.0726 71.5400
599 CA VAL 564 0.0102 81.4975 81.5800
606 CA LEU 565 0.0112 82.4984 88.9500
614 CA ALA 566 0.0079 79.1765 87.4300
619 CA VAL 567 0.0074 78.6920 103.9400
626 CA GLN 568 0.0129 84.1260 99.3800
635 CA ALA 569 0.0144 85.6230 111.9000
640 CA TRP 570 0.0129 84.1587 108.1700
654 CA ALA 571 0.0147 85.9091 108.9400
659 CA ALA 572 0.0287 99.7590 117.2800
664 CA PHE 573 0.0282 99.2386 124.3400
675 CA HIS 574 0.0282 99.2282 95.9500
685 CA ASP 575 0.0509 121.6696 125.7900
693 CA MET 576 0.0302 101.1970 148.2000
701 CA THR 577 0.0349 105.8875 143.9400
708 CA LEU 578 0.0180 89.2108 143.3700
716 CA ARG 579 0.0218 92.8943 147.5400
727 CA ALA 580 0.0154 86.6222 142.1900
732 CA VAL 581 0.0115 82.7632 143.6200
739 CA ILE 582 0.0121 83.3520 142.8300
747 CA GLY 583 0.0150 86.2731 147.2000
751 CA THR 584 0.0289 99.9594 132.6300
758 CA ALA 585 0.0371 108.0260 119.9300
763 CA GLU 586 0.0692 139.7101 148.1800
772 CA GLN 587 0.0317 102.6579 129.8500
781 CA LEU 588 0.0300 101.0051 127.9700
789 CA ALA 589 0.0586 129.2281 133.7700
794 CA SER 590 0.0543 125.0060 133.9800
800 CA SER 591 0.0496 120.3425 155.4400
806 CA ASP 592 0.0674 137.9426 170.3500
814 CA PRO 593 0.0957 165.8761 170.3500
821 CA GLY 594 0.0922 162.4107 152.2300
825 CA VAL 595 0.0462 117.0179 154.6700
832 CA ALA 596 0.0389 109.7801 168.4600
837 CA LYS 597 0.0312 102.2553 142.3900
846 CA ILE 598 0.0254 96.4701 126.7800
854 CA VAL 599 0.0299 100.9457 139.7400
861 CA LEU 600 0.0357 106.6912 158.1500
869 CA GLU 601 0.0702 140.7432 158.5300
878 CA PRO 602 0.1164 186.2925 157.9000
885 CA ASP 603 0.1259 195.6358 171.7400
893 CA ASP 604 0.0518 122.5893 182.7000
901 CA ILE 605 0.0413 112.1751 197.8400
909 CA PRO 606 0.0503 121.0133 171.9100
916 CA GLU 607 0.0549 125.6017 190.4100
925 CA SER 608 0.0602 130.8397 185.7300
931 CA GLY 609 0.0467 117.4758 176.3100
935 CA LYS 610 0.0848 155.0954 164.1400
944 CA MET 611 0.0431 113.9910 160.9400
952 CA THR 612 0.0537 124.3904 140.1900
959 CA GLY 613 0.0347 105.6174 122.2100
963 CA ARG 614 0.0208 91.9529 89.7600
974 CA SER 615 0.0212 92.3410 88.7200
980 CA ARG 616 0.0128 84.0262 101.9800
991 CA LEU 617 0.0123 83.5866 76.4200
999 CA GLU 618 0.0183 89.4749 89.5700
1008 CA VAL 619 0.0154 86.5914 87.3400
1015 CA VAL 620 0.0142 85.4608 77.1100
1022 CA ASP 621 0.0161 87.2948 79.7600
1030 CA PRO 622 0.0321 103.0691 85.6600
1037 CA SER 623 0.0585 129.1502 85.7400
1043 CA ALA 624 0.0303 101.3672 99.1100
1048 CA ALA 625 0.0302 101.2026 93.8100
1053 CA ALA 626 0.0619 132.5194 111.7200
1058 CA GLN 627 0.0568 127.4764 102.0900
1067 CA LEU 628 0.0347 105.6646 112.8600
1075 CA ALA 629 0.0635 134.1187 107.4600
1080 CA ASP 630 0.1026 172.7039 112.7100
1088 CA THR 631 0.0624 133.0437 132.0600
1095 CA THR 632 0.0890 159.2592 143.5200
1102 CA ASP 633 0.0813 151.6386 126.1300
1110 CA GLN 634 0.1229 192.7327 131.1900
1119 CA ARG 635 0.0785 148.9038 154.1900
1130 CA LEU 636 0.0355 106.4787 105.5500
1138 CA LEU 637 0.0370 107.9399 113.4700
1146 CA ASP 638 0.0587 129.3851 124.5000
1154 CA LEU 639 0.0342 105.1642 113.1300
1162 CA LEU 640 0.0254 96.4701 95.9800
1170 CA PRO 641 0.0436 114.4942 117.2300
1177 CA PRO 642 0.0979 168.0464 125.3400
1184 CA ALA 643 0.0780 148.3673 138.7900
1189 CA PRO 644 0.1116 181.5642 168.5000
1196 CA VAL 645 0.2781 345.8841 169.0100
1203 CA ASP 646 0.1836 252.5776 175.1800
1211 CA VAL 647 0.1642 233.4893 169.2700
1218 CA ASN 648 0.1435 212.9965 171.3400
1226 CA PRO 649 0.0841 154.4315 153.1300
1233 CA PRO 650 0.0534 124.1494 127.9700
1240 CA GLY 651 0.0670 137.4958 123.8500
1244 CA ASP 652 0.0485 119.2656 107.0000
1252 CA GLU 653 0.0433 114.1966 119.0300
1261 CA ARG 654 0.0227 93.8629 101.4300
1272 CA HIS 655 0.0408 111.7096 106.9500
1282 CA MET 656 0.0384 109.2694 96.2200
1290 CA LEU 657 0.0198 90.9393 80.6100
1298 CA TRP 658 0.0160 87.2452 76.2800
1312 CA PHE 659 0.0239 95.0299 78.2800
1323 CA GLU 660 0.0219 93.0524 72.3200
1332 CA LEU 661 0.0132 84.4332 60.4300
1340 CA MET 662 0.0154 86.6549 67.5700
1348 CA LYS 663 0.0225 93.6725 58.9700
1357 CA PRO 664 0.0179 89.0426 50.9500
1364 CA MET 665 0.0163 87.4888 65.3900
1372 CA THR 666 0.0379 108.8352 55.6500
1379 CA SER 667 0.0492 119.9889 59.0800
1385 CA THR 668 0.0772 147.5885 64.6200
1392 CA ALA 669 0.1053 175.2887 61.8700
1397 CA THR 670 0.1292 198.8988 54.5400
1404 CA GLY 671 0.0938 163.9417 47.6900
1408 CA ARG 672 0.0224 93.4889 62.8100
1419 CA GLU 673 0.0187 89.8928 53.6200
1428 CA ALA 674 0.0246 95.7242 45.4600
1433 CA ALA 675 0.0200 91.1534 56.6200
1438 CA HIS 676 0.0102 81.5084 55.1300
1448 CA LEU 677 0.0100 81.2924 48.1100
1456 CA ARG 678 0.0162 87.4151 52.9600
1467 CA ALA 679 0.0136 84.8889 75.8200
1472 CA PHE 680 0.0090 80.3094 69.3700
1483 CA ARG 681 0.0100 81.3381 70.5100
1494 CA ALA 682 0.0136 84.8600 76.7900
1499 CA TYR 683 0.0114 82.6656 83.1500
1511 CA ALA 684 0.0104 81.6830 72.4700
1516 CA ALA 685 0.0121 83.3700 77.5600
1521 CA HIS 686 0.0162 87.3681 100.8100
1531 CA SER 687 0.0132 84.4609 90.2500
1537 CA GLN 688 0.0105 81.7455 93.9800
1546 CA GLU 689 0.0140 85.2725 93.9900
1555 CA ILE 690 0.0165 87.6634 101.0200
1563 CA ALA 691 0.0138 85.0810 96.0100
1568 CA LEU 692 0.0157 86.9209 97.0600
1576 CA HIS 693 0.0243 95.3727 138.3500
1586 CA GLN 694 0.0258 96.9020 125.7600
1595 CA ALA 695 0.0212 92.3438 126.5600
1600 CA HIS 696 0.0343 105.2871 115.7300
1610 CA THR 697 0.0557 126.3561 133.7500
1617 CA ALA 698 0.0820 152.3787 140.4000
1622 CA THR 699 0.1468 216.2673 159.1500
1629 CA ASP 700 0.1235 193.3333 145.2100
1637 CA ALA 701 0.0954 165.5512 149.9200
1642 CA ALA 702 0.0953 165.4593 129.7600
1647 CA VAL 703 0.0719 142.4150 141.5500
1654 CA GLN 704 0.0339 104.8721 141.5200
1663 CA ARG 705 0.0356 106.5746 133.2800
1674 CA VAL 706 0.0390 109.8834 111.2800
1681 CA ALA 707 0.0193 90.4607 116.2300
1686 CA VAL 708 0.0105 81.7667 113.3100
1693 CA ALA 709 0.0138 85.0471 88.8700
1698 CA ASP 710 0.0113 82.5513 86.5000
1706 CA TRP 711 0.0089 80.2223 72.9000
1720 CA LEU 712 0.0097 81.0363 86.2700
1728 CA TYR 713 0.0088 80.0766 79.9900
1740 CA TRP 714 0.0090 80.2581 79.3300
1754 CA GLN 715 0.0111 82.3343 71.9200
1763 CA TYR 716 0.0105 81.7757 58.6200
1775 CA VAL 717 0.0095 80.8195 67.9000
1782 CA THR 718 0.0116 82.8594 56.2900
1789 CA GLY 719 0.0152 86.4671 64.8600
1793 CA LEU 720 0.0115 82.8127 57.0500
1801 CA LEU 721 0.0109 82.1814 55.5300
1809 CA ASP 722 0.0213 92.4565 59.7800
1817 CA ARG 723 0.0228 93.8924 55.7200
1828 CA ALA 724 0.0193 90.4686 70.4400
1833 CA LEU 725 0.0222 93.3454 67.2500
1841 CA ALA 726 0.0631 133.7014 75.4900
1846 CA ALA 727 0.0721 142.5620 114.4200
1851 CA ALA 728 0.1274 197.1562 136.8600
1856 CA CYS 729 0.1808 249.7989 135.9700

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.