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

* arojo@cua.uam.mx *

B-factor analysis for ID 2504102030223723091

Overall B-factor prediction

Correlation= 0.198 for 324 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
5 CA SER 347 0.0549 352.2655 47.3900
16 CA ARG 348 0.0568 365.2471 57.6800
40 CA ALA 349 0.0537 343.9773 71.0400
50 CA SER 350 0.0388 241.8586 86.4100
61 CA LEU 351 0.0298 180.0747 70.7400
80 CA ARG 352 0.0353 217.6599 22.6000
104 CA ARG 353 0.0303 182.9243 101.1100
128 CA HIS 354 0.0196 109.5579 62.5200
146 CA TYR 355 0.0175 95.2448 59.6900
167 CA SER 356 0.0211 120.2238 39.5300
178 CA VAL 357 0.0161 85.4036 58.0400
194 CA ARG 358 0.0106 47.7947 97.1400
218 CA HIS 359 0.0108 49.2117 90.6300
236 CA LEU 360 0.0135 67.9050 60.6500
255 CA ALA 361 0.0086 34.2444 81.9900
265 CA ALA 362 0.0065 19.6425 103.7900
275 CA ARG 363 0.0100 43.7187 106.9900
299 CA GLU 364 0.0098 42.4056 85.5500
314 CA LEU 365 0.0056 13.8100 60.9900
333 CA LEU 366 0.0065 19.8607 87.9000
352 CA ASP 367 0.0098 42.6733 59.4600
364 CA THR 368 0.0080 30.0934 67.4100
378 CA GLU 369 0.0056 13.6584 35.4100
393 CA LYS 370 0.0085 33.2553 42.0900
415 CA SER 371 0.0088 35.3863 24.0800
426 CA PHE 372 0.0056 13.2899 113.4600
446 CA VAL 373 0.0059 15.3350 60.0500
462 CA GLU 374 0.0089 36.3406 59.5700
477 CA GLY 375 0.0067 20.8634 47.1700
484 CA LEU 376 0.0047 7.1562 48.8300
503 CA GLU 377 0.0070 23.0824 76.2200
518 CA PHE 378 0.0081 30.8215 66.9200
538 CA LEU 379 0.0049 8.8283 60.9300
557 CA VAL 380 0.0054 12.1154 12.4700
573 CA THR 381 0.0094 39.7491 0.0000
587 CA LYS 382 0.0081 30.7060 53.4200
609 CA TYR 383 0.0049 8.7241 0.0000
630 CA MET 384 0.0046 6.9750 60.8500
647 CA ARG 385 0.0093 39.2183 70.1300
670 CA PRO 386 0.0084 32.7703 64.9900
685 CA LEU 387 0.0072 24.6964 15.4400
704 CA ARG 388 0.0124 60.1468 44.7000
728 CA GLN 389 0.0223 128.0211 35.6600
744 CA PRO 390 0.0208 117.8076 49.2000
759 CA LEU 391 0.0350 215.3846 150.2800
778 CA GLU 392 0.0189 104.8591 173.2400
793 CA CYS 393 0.0131 64.9045 251.6900
804 CA THR 394 0.0134 67.2727 0.0000
818 CA LEU 395 0.0211 119.7582 93.1200
837 CA ILE 396 0.0161 85.8216 93.2300
856 CA GLU 397 0.0084 32.4309 114.2400
871 CA ALA 398 0.0127 61.9881 81.3500
881 CA SER 399 0.0125 61.0603 47.9000
892 CA LEU 400 0.0085 33.2953 22.9500
911 CA VAL 401 0.0054 12.2837 59.1900
927 CA ASP 402 0.0066 20.5995 52.8300
939 CA LYS 403 0.0055 12.6725 116.6400
961 CA ILE 404 0.0035 -1.1691 62.5700
980 CA PHE 405 0.0028 -5.6744 44.2400
1000 CA TYR 406 0.0041 3.1627 65.1000
1021 CA ARG 407 0.0045 5.9773 34.0200
1045 CA ILE 408 0.0035 -0.6382 64.5000
1063 CA PRO 409 0.0050 9.4105 80.1000
1078 CA GLU 410 0.0058 14.7868 67.5500
1093 CA ILE 411 0.0043 4.5771 56.3900
1112 CA LEU 412 0.0049 8.7906 0.0000
1131 CA ALA 413 0.0074 25.8125 62.5700
1141 CA HIS 414 0.0059 15.7836 62.4000
1159 CA HIS 415 0.0050 9.3544 25.5100
1176 CA GLN 416 0.0074 25.9751 62.4100
1193 CA VAL 417 0.0114 53.2492 0.0000
1209 CA LEU 418 0.0086 34.4310 0.0000
1228 CA LEU 419 0.0056 13.3788 59.7000
1247 CA THR 420 0.0059 15.9206 97.9200
1261 CA THR 421 0.0097 41.4637 43.9300
1275 CA LEU 422 0.0081 30.9428 54.1900
1294 CA SER 423 0.0058 15.0008 29.4200
1305 CA GLN 424 0.0087 34.8596 19.2500
1322 CA ARG 425 0.0120 57.3921 49.1000
1346 CA ILE 426 0.0080 30.0888 0.0000
1365 CA ASP 427 0.0094 39.3189 94.9400
1377 CA GLN 428 0.0135 67.9726 154.8400
1394 CA TRP 429 0.0183 100.5005 498.1600
1418 CA HIS 430 0.0117 55.5635 488.7500
1436 CA LYS 431 0.0086 34.0444 187.9500
1458 CA ASP 432 0.0064 18.9149 30.8000
1470 CA ALA 433 0.0076 27.2082 25.5200
1480 CA ILE 434 0.0075 26.6209 29.5600
1499 CA LEU 435 0.0050 9.5240 116.3600
1518 CA GLY 436 0.0062 17.3408 99.6000
1525 CA ASP 437 0.0080 29.7510 52.9600
1537 CA VAL 438 0.0067 20.8709 67.8800
1553 CA LEU 439 0.0057 14.0404 74.8900
1572 CA LEU 440 0.0088 35.5950 14.1600
1591 CA ALA 441 0.0102 45.1416 48.3700
1601 CA HIS 442 0.0084 32.7863 14.8100
1619 CA PHE 443 0.0085 33.5385 0.0000
1639 CA SER 444 0.0122 58.8783 53.1400
1650 CA LYS 445 0.0086 33.8932 51.7000
1672 CA GLN 446 0.0056 13.3505 92.1300
1689 CA SER 447 0.0065 19.5266 107.1600
1700 CA MET 448 0.0056 13.7108 83.1500
1717 CA ILE 449 0.0045 5.8193 0.0000
1736 CA GLU 450 0.0058 14.7646 70.2400
1751 CA THR 451 0.0060 16.1450 72.9700
1765 CA TYR 452 0.0044 5.5699 53.6900
1786 CA ILE 453 0.0056 13.7231 45.2200
1805 CA SER 454 0.0062 17.4146 84.4600
1816 CA PHE 455 0.0057 14.3117 65.9900
1836 CA VAL 456 0.0056 13.4079 73.7300
1852 CA ASP 457 0.0080 30.0139 77.7000
1864 CA ASN 458 0.0072 24.5854 105.1800
1878 CA PHE 459 0.0049 8.5852 76.9700
1898 CA LYS 460 0.0066 20.1974 80.1000
1920 CA PHE 461 0.0110 50.4574 0.0000
1940 CA ALA 462 0.0082 31.5881 55.6800
1950 CA LYS 463 0.0069 22.3231 0.0000
1972 CA ALA 464 0.0121 58.2927 59.8800
1982 CA SER 465 0.0164 87.6348 54.9500
1993 CA ILE 466 0.0130 64.4373 99.7600
2012 CA ILE 467 0.0152 79.5010 346.2000
2031 CA GLN 468 0.0254 149.4747 407.7200
2048 CA ALA 469 0.0264 156.1880 303.6600
2058 CA ARG 470 0.0231 133.9498 280.8000
2082 CA GLN 471 0.0324 197.5447 344.9000
2099 CA LYS 472 0.0473 299.8790 265.0300
2121 CA HIS 473 0.0538 344.7604 146.3200
2139 CA ALA 474 0.0569 366.0340 174.8300
2149 CA PHE 475 0.0299 180.1791 0.0000
2169 CA GLU 476 0.0244 142.9127 0.0000
2184 CA LYS 477 0.0149 77.1183 0.0000
2206 CA TYR 478 0.0101 44.7827 0.0000
2227 CA TYR 479 0.0071 23.6925 12.3400
2248 CA ASN 480 0.0125 61.1186 95.8200
2262 CA ARG 481 0.0165 88.6919 71.8300
2286 CA CYS 482 0.0123 59.4841 36.9000
2297 CA CYS 483 0.0146 75.2385 0.0000
2308 CA ARG 484 0.0246 144.0437 0.0000
2332 CA ASP 485 0.0249 146.2397 37.7900
2344 CA HIS 486 0.0219 125.5819 73.8600
2360 CA PRO 487 0.0323 197.1887 40.0700
2375 CA ASN 488 0.0225 129.3684 123.8900
2389 CA LYS 489 0.0324 197.6401 80.6900
2411 CA LEU 490 0.0148 76.9542 82.4500
2430 CA ASP 491 0.0088 35.6194 60.5300
2442 CA LEU 492 0.0050 9.5802 73.7300
2461 CA ASP 493 0.0059 15.3061 0.0000
2473 CA SER 494 0.0078 28.7896 46.4700
2484 CA LEU 495 0.0051 10.3320 65.8100
2503 CA LEU 496 0.0039 1.6410 65.5000
2522 CA ILE 497 0.0050 9.7494 70.7900
2541 CA SER 498 0.0048 8.1089 94.6900
2551 CA PRO 499 0.0038 1.2131 67.7700
2566 CA ILE 500 0.0051 9.8499 58.0300
2585 CA GLN 501 0.0061 17.1521 119.2900
2602 CA ARG 502 0.0046 6.6030 81.3100
2626 CA VAL 503 0.0047 7.3983 83.5900
2641 CA PRO 504 0.0066 20.3909 43.4100
2656 CA ARG 505 0.0065 20.0567 111.4800
2680 CA TYR 506 0.0047 7.6452 101.0900
2701 CA GLU 507 0.0071 23.6067 86.3900
2716 CA LEU 508 0.0089 36.1325 67.1800
2735 CA ILE 509 0.0069 22.2590 48.8400
2754 CA VAL 510 0.0064 18.8123 84.6800
2770 CA LYS 511 0.0102 45.1771 58.6800
2792 CA GLN 512 0.0112 51.9088 111.8200
2809 CA MET 513 0.0083 31.8631 54.1600
2826 CA LEU 514 0.0100 43.7484 55.0100
2845 CA LYS 515 0.0159 84.1303 25.8000
2867 CA HIS 516 0.0132 65.5308 53.1700
2885 CA THR 517 0.0123 59.4783 89.2700
2898 CA PRO 518 0.0195 109.1980 241.0400
2913 CA VAL 519 0.0273 162.4316 373.9700
2929 CA GLU 520 0.0219 125.3167 296.6000
2944 CA HIS 521 0.0281 167.8075 359.3600
2962 CA GLU 522 0.0397 247.6593 463.2000
2977 CA ASP 523 0.0362 223.9283 466.1800
2989 CA ARG 524 0.0378 234.8424 420.0400
3013 CA GLU 525 0.0243 141.9497 282.7500
3028 CA ARG 526 0.0286 171.4068 223.4200
3052 CA LEU 527 0.0298 179.8814 428.6900
3071 CA LEU 528 0.0236 137.1444 195.1400
3090 CA ARG 529 0.0133 66.6710 0.0000
3114 CA ALA 530 0.0136 68.2609 40.4900
3124 CA GLN 531 0.0163 87.1940 59.8700
3141 CA ARG 532 0.0107 48.2393 77.3400
3165 CA HIS 533 0.0084 32.7028 64.4400
3183 CA ILE 534 0.0129 63.3345 77.7800
3202 CA HIS 535 0.0122 59.2129 39.2600
3220 CA CYS 536 0.0077 27.7191 0.0000
3231 CA LEU 537 0.0087 35.1614 43.3400
3250 CA ALA 538 0.0120 57.5821 32.2300
3260 CA VAL 539 0.0087 34.7491 48.4100
3276 CA ALA 540 0.0068 21.6067 13.3300
3286 CA ILE 541 0.0094 39.5116 56.7600
3305 CA ASN 542 0.0096 41.3401 76.9600
3319 CA GLN 543 0.0071 23.8978 83.9900
3336 CA HIS 544 0.0076 27.1987 59.0400
3354 CA LYS 545 0.0091 37.6307 34.3700
3376 CA ASP 546 0.0081 30.4518 78.6000
3388 CA GLY 547 0.0069 22.7356 75.9500
3395 CA SER 548 0.0071 24.1091 85.7000
3406 CA GLU 549 0.0062 17.7182 115.3100
3421 CA GLN 550 0.0063 18.2715 120.5300
3438 CA MET 551 0.0059 15.3019 87.5400
3455 CA GLU 552 0.0059 15.8766 72.4700
3470 CA GLN 553 0.0053 11.3676 124.5400
3487 CA ARG 554 0.0063 18.1615 131.3200
3511 CA LEU 555 0.0103 45.5564 275.3000
3530 CA ARG 556 0.0135 67.4622 365.8900
3554 CA GLU 557 0.0208 117.7258 309.3000
3569 CA ILE 558 0.0143 73.0204 178.0200
3588 CA GLU 559 0.0105 47.3994 0.0000
3603 CA ALA 560 0.0090 37.1623 0.0000
3613 CA ILE 561 0.0096 40.9550 76.3200
3632 CA VAL 562 0.0083 32.0910 0.0000
3648 CA ASP 563 0.0139 70.4039 65.4900
3660 CA GLY 564 0.0188 104.3993 25.9600
3667 CA LEU 565 0.0145 74.8684 94.5700
3686 CA ASP 566 0.0184 101.5511 184.0100
3698 CA ASP 567 0.0190 105.3810 0.0000
3710 CA LEU 568 0.0135 67.5115 103.0400
3729 CA VAL 569 0.0271 161.5109 133.3100
3745 CA THR 570 0.0255 149.9207 33.1100
3759 CA LYS 571 0.0130 64.3119 56.6100
3781 CA ASP 572 0.0153 80.2496 75.2600
3793 CA ARG 573 0.0092 38.0123 120.1000
3817 CA THR 574 0.0062 17.7161 72.7800
3831 CA LEU 575 0.0085 33.7808 74.2600
3850 CA LEU 576 0.0068 21.5070 42.4700
3869 CA ARG 577 0.0052 10.8235 0.0000
3893 CA HIS 578 0.0070 23.1121 105.4500
3911 CA ASP 579 0.0107 48.5518 129.8500
3923 CA ILE 580 0.0120 57.1622 112.4400
3942 CA ILE 581 0.0198 111.2138 56.7600
3961 CA THR 582 0.0147 75.7888 0.0000
3975 CA LEU 583 0.0216 123.4609 28.9800
3994 CA LYS 584 0.0267 158.3950 0.0000
4016 CA GLY 585 0.0487 309.8232 0.0000
4023 CA THR 586 0.0507 323.2845 10.2100
4037 CA ASP 587 0.0315 191.5868 0.0000
4049 CA ARG 588 0.0278 166.0186 44.2700
4073 CA GLU 589 0.0185 101.8786 70.0200
4088 CA ARG 590 0.0105 47.3746 40.6600
4112 CA CYS 591 0.0065 19.5047 0.0000
4123 CA ILE 592 0.0038 1.4834 43.8700
4142 CA PHE 593 0.0031 -3.6169 83.2800
4162 CA MET 594 0.0040 2.6015 43.0900
4179 CA LEU 595 0.0065 19.8781 13.2600
4198 CA SER 596 0.0112 52.1517 0.0000
4209 CA ASP 597 0.0133 66.5726 0.0000
4221 CA LEU 598 0.0080 30.2628 153.5700
4240 CA LEU 599 0.0041 3.1915 62.7600
4259 CA LEU 600 0.0039 1.5835 54.0900
4278 CA VAL 601 0.0050 9.7159 29.7500
4294 CA THR 602 0.0072 24.2745 97.8500
4308 CA SER 603 0.0134 66.7790 80.4000
4319 CA VAL 604 0.0157 82.8741 79.1300
4335 CA LYS 605 0.0275 163.7954 54.6700
4357 CA LYS 606 0.0382 237.0844 37.4800
4379 CA LYS 607 0.0329 201.1009 48.9700
4400 CA PRO 608 0.0242 141.2862 12.7900
4415 CA LYS 609 0.0166 88.8681 17.2800
4437 CA VAL 610 0.0113 52.4273 60.9600
4453 CA LEU 611 0.0138 70.0186 38.5900
4472 CA TYR 612 0.0116 54.6320 0.0000
4493 CA SER 613 0.0101 44.3438 19.0900
4504 CA LYS 614 0.0080 30.3376 41.8100
4526 CA MET 615 0.0079 29.3680 0.0000
4543 CA SER 616 0.0110 50.6303 33.4600
4554 CA SER 617 0.0108 49.1414 0.0000
4565 CA GLN 618 0.0123 59.2777 159.7200
4582 CA SER 619 0.0118 55.9525 218.6900
4593 CA MET 620 0.0149 77.5749 129.9000
4610 CA GLY 621 0.0213 121.2776 153.2900
4617 CA PHE 622 0.0283 169.3152 267.0500
4637 CA LEU 623 0.0427 268.5312 166.2800
4656 CA GLU 624 0.0490 311.6991 136.8800
4671 CA GLY 625 0.0673 437.0198 107.5700
4678 CA ASN 626 0.0524 335.2780 0.0000
4692 CA ARG 627 0.0488 310.0152 74.1200
4716 CA PHE 628 0.0352 216.5471 91.3900
4736 CA LYS 629 0.0251 147.1914 73.9300
4758 CA LEU 630 0.0177 96.8224 113.3300
4777 CA LEU 631 0.0136 68.6219 104.5100
4796 CA PHE 632 0.0093 38.6477 97.1700
4816 CA LYS 633 0.0144 74.0173 33.1200
4838 CA VAL 634 0.0193 107.8740 34.7900
4854 CA ALA 635 0.0417 261.5414 45.6100
4864 CA LEU 636 0.0560 359.5357 59.0900
4883 CA GLU 637 0.0517 330.0277 31.9600
4898 CA ASP 638 0.0340 208.9027 54.7400
4910 CA VAL 639 0.0420 263.2296 0.0000
4926 CA GLN 640 0.0437 275.4139 65.4100
4943 CA ILE 641 0.0537 343.8936 66.0100
4962 CA SER 642 0.0361 222.7136 28.5300
4973 CA LYS 643 0.0188 104.2950 0.0000
4995 CA ASP 644 0.0137 69.2856 32.5600
5007 CA THR 645 0.0140 71.3547 22.7200
5021 CA LEU 646 0.0087 34.6795 39.4400
5040 CA SER 647 0.0096 41.2670 264.7000
5051 CA GLN 648 0.0163 87.3480 223.8200
5068 CA LEU 649 0.0212 120.4035 87.6400
5087 CA GLU 650 0.0329 200.6901 59.6400
5102 CA GLU 651 0.0420 263.5418 82.2400
5117 CA VAL 652 0.0431 271.0957 81.1300
5133 CA GLU 653 0.0424 266.4192 69.4400
5148 CA ARG 654 0.0281 168.1626 77.0900
5172 CA LYS 655 0.0228 131.7478 64.6800
5194 CA LEU 656 0.0294 176.7683 51.0000
5213 CA GLU 657 0.0241 140.5515 91.0800
5228 CA SER 658 0.0133 66.4772 96.8600
5239 CA SER 659 0.0163 87.2329 67.5000
5250 CA ARG 660 0.0225 129.8325 50.6700
5274 CA GLU 661 0.0141 72.0204 38.4600
5289 CA ASP 662 0.0098 42.0611 64.0000
5301 CA ASP 663 0.0173 94.0339 21.6800
5313 CA ARG 664 0.0205 115.8853 47.0000
5337 CA VAL 665 0.0137 69.5053 48.6400
5353 CA LEU 666 0.0170 92.0435 0.0000
5372 CA LYS 667 0.0313 189.8205 87.9400
5394 CA LYS 668 0.0307 185.6675 118.4200
5416 CA MET 669 0.0290 174.0076 71.9200
5433 CA SER 670 0.0527 336.7320 20.4300

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 8th, 2025.

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