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

* EXP_1PC3_unrelaxed_rank_001_alphafold2_ptm_model_3_seed_000 *

B-factor analysis for ID 24021912472146850

Overall B-factor prediction

Correlation= -0.619 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-SCALED	B-OBS
2 CA VAL 1 0.0204 98.0508 91.6200
9 CA ALA 2 0.0201 98.0276 96.4400
14 CA THR 3 0.0257 98.4474 97.0600
21 CA THR 4 0.0250 98.3938 98.0600
28 CA PRO 5 0.0207 98.0726 98.5600
35 CA ALA 6 0.0288 98.6783 98.1900
40 CA SER 7 0.0892 103.1937 97.4400
46 CA SER 8 0.0678 101.5951 97.8100
52 CA PRO 9 0.0499 100.2530 98.3800
59 CA VAL 10 0.0276 98.5923 98.5000
66 CA THR 11 0.0187 97.9282 98.5000
73 CA LEU 12 0.0126 97.4676 98.7500
81 CA ALA 13 0.0131 97.5057 98.6900
86 CA GLU 14 0.0088 97.1886 98.6200
95 CA THR 15 0.0093 97.2258 98.6200
102 CA GLY 16 0.0088 97.1858 98.3100
106 CA SER 17 0.0072 97.0665 98.6200
112 CA THR 18 0.0077 97.1043 98.6200
119 CA LEU 19 0.0061 96.9856 98.7500
127 CA LEU 20 0.0054 96.9298 98.7500
135 CA TYR 21 0.0080 97.1273 98.7500
147 CA PRO 22 0.0098 97.2635 98.6900
154 CA LEU 23 0.0081 97.1344 98.8100
162 CA PHE 24 0.0070 97.0519 98.7500
173 CA ASN 25 0.0131 97.5089 98.5600
181 CA LEU 26 0.0129 97.4937 98.6900
189 CA TRP 27 0.0093 97.2250 98.8100
203 CA GLY 28 0.0124 97.4545 98.6200
207 CA PRO 29 0.0263 98.4972 98.6200
214 CA ALA 30 0.0233 98.2692 98.6200
219 CA PHE 31 0.0159 97.7149 98.6900
230 CA HIS 32 0.0226 98.2199 98.5600
240 CA GLU 33 0.0488 100.1737 98.3800
249 CA ARG 34 0.0370 99.2913 98.0000
260 CA TYR 35 0.0294 98.7232 98.4400
272 CA PRO 36 0.0425 99.7070 98.4400
279 CA ASN 37 0.0340 99.0661 98.4400
287 CA VAL 38 0.0216 98.1444 98.7500
294 CA THR 39 0.0190 97.9512 98.6200
301 CA ILE 40 0.0137 97.5501 98.6200
309 CA THR 41 0.0184 97.9044 98.1200
316 CA ALA 42 0.0138 97.5568 98.1900
321 CA GLN 43 0.0161 97.7307 96.7500
330 CA GLY 44 0.0155 97.6888 94.6900
334 CA THR 45 0.0120 97.4263 97.7500
341 CA GLY 46 0.0110 97.3497 98.1200
345 CA SER 47 0.0085 97.1634 98.6200
351 CA GLY 48 0.0124 97.4539 98.1900
355 CA ALA 49 0.0147 97.6275 98.4400
360 CA GLY 50 0.0102 97.2942 98.4400
364 CA ILE 51 0.0116 97.3980 98.2500
372 CA ALA 52 0.0195 97.9825 97.9400
377 CA GLN 53 0.0173 97.8208 98.3800
386 CA ALA 54 0.0131 97.5089 98.0600
391 CA ALA 55 0.0238 98.3048 97.0600
396 CA ALA 56 0.0536 100.5310 96.5000
401 CA GLY 57 0.0447 99.8676 95.9400
405 CA THR 58 0.0474 100.0699 97.1200
412 CA VAL 59 0.0133 97.5264 98.4400
419 CA ASN 60 0.0109 97.3434 98.5600
427 CA ILE 61 0.0059 96.9717 98.8100
435 CA GLY 62 0.0067 97.0279 98.6900
439 CA ALA 63 0.0057 96.9527 98.7500
444 CA SER 64 0.0059 96.9710 98.6900
450 CA ASP 65 0.0055 96.9430 98.3100
458 CA ALA 66 0.0058 96.9620 98.2500
463 CA TYR 67 0.0082 97.1422 97.8100
475 CA LEU 68 0.0104 97.3035 97.1900
483 CA SER 69 0.0537 100.5372 93.8800
489 CA GLU 70 0.0807 102.5568 92.5000
498 CA GLY 71 0.0711 101.8414 93.0600
502 CA ASP 72 0.0399 99.5074 93.4400
510 CA MET 73 0.0337 99.0432 93.1900
518 CA ALA 74 0.0622 101.1727 93.5600
523 CA ALA 75 0.0602 101.0219 95.3100
528 CA HIS 76 0.0452 99.9066 94.8800
538 CA LYS 77 0.0716 101.8725 91.9400
547 CA GLY 78 0.0464 99.9955 94.1200
551 CA LEU 79 0.0130 97.4980 97.6200
559 CA MET 80 0.0109 97.3430 98.0000
567 CA ASN 81 0.0060 96.9775 97.4400
575 CA ILE 82 0.0054 96.9316 98.7500
583 CA ALA 83 0.0049 96.8936 98.7500
588 CA LEU 84 0.0044 96.8593 98.8800
596 CA ALA 85 0.0057 96.9560 98.8100
601 CA ILE 86 0.0061 96.9877 98.8800
609 CA SER 87 0.0055 96.9438 98.7500
615 CA ALA 88 0.0053 96.9250 98.8800
620 CA GLN 89 0.0046 96.8739 98.8100
629 CA GLN 90 0.0044 96.8560 98.7500
638 CA VAL 91 0.0045 96.8628 98.9400
645 CA ASN 92 0.0051 96.9144 98.8800
653 CA TYR 93 0.0085 97.1642 98.8800
665 CA ASN 94 0.0111 97.3611 98.8100
673 CA LEU 95 0.0201 98.0334 98.5600
681 CA PRO 96 0.0458 99.9479 95.8800
688 CA GLY 97 0.0778 102.3356 94.8800
692 CA VAL 98 0.0369 99.2881 97.4400
699 CA SER 99 0.0725 101.9442 94.6900
705 CA GLU 100 0.0386 99.4147 97.1200
714 CA HIS 101 0.0161 97.7313 98.5000
724 CA LEU 102 0.0123 97.4502 98.8800
732 CA LYS 103 0.0104 97.3068 98.9400
741 CA LEU 104 0.0077 97.1022 98.9400
749 CA ASN 105 0.0084 97.1594 98.8800
757 CA GLY 106 0.0079 97.1185 98.7500
761 CA LYS 107 0.0136 97.5462 98.5000
770 CA VAL 108 0.0107 97.3257 98.8800
777 CA LEU 109 0.0062 96.9927 98.9400
785 CA ALA 110 0.0084 97.1561 98.8100
790 CA ALA 111 0.0122 97.4424 98.6900
795 CA MET 112 0.0092 97.2143 98.8800
803 CA TYR 113 0.0079 97.1173 98.7500
815 CA GLN 114 0.0126 97.4733 98.1200
824 CA GLY 115 0.0220 98.1739 98.0600
828 CA THR 116 0.0284 98.6486 98.2500
835 CA ILE 117 0.0196 97.9916 98.6900
843 CA LYS 118 0.0230 98.2439 98.6200
852 CA THR 119 0.0201 98.0300 98.7500
859 CA TRP 120 0.0146 97.6219 98.8100
873 CA ASP 121 0.0268 98.5277 98.6200
881 CA ASP 122 0.0257 98.4521 98.8100
889 CA PRO 123 0.0399 99.5115 98.6900
896 CA GLN 124 0.0283 98.6451 98.7500
905 CA ILE 125 0.0180 97.8763 98.8800
913 CA ALA 126 0.0275 98.5843 98.6900
918 CA ALA 127 0.0390 99.4392 98.6900
923 CA LEU 128 0.0243 98.3481 98.6900
931 CA ASN 129 0.0319 98.9133 98.6900
939 CA PRO 130 0.0769 102.2683 98.0600
946 CA GLY 131 0.1262 105.9533 96.5000
950 CA VAL 132 0.0540 100.5640 97.9400
957 CA ASN 133 0.0654 101.4117 96.9400
965 CA LEU 134 0.0308 98.8288 98.3800
973 CA PRO 135 0.0317 98.8941 98.1900
980 CA GLY 136 0.0359 99.2115 98.4400
984 CA THR 137 0.0242 98.3404 98.4400
991 CA ALA 138 0.0233 98.2685 98.6200
996 CA VAL 139 0.0124 97.4593 98.8100
1003 CA VAL 140 0.0121 97.4370 98.8100
1010 CA PRO 141 0.0082 97.1406 98.8100
1017 CA LEU 142 0.0082 97.1441 98.8800
1025 CA HIS 143 0.0085 97.1655 98.6900
1035 CA ARG 144 0.0086 97.1717 98.5600
1046 CA SER 145 0.0180 97.8717 98.0600
1052 CA ASP 146 0.0166 97.7665 98.0600
1060 CA GLY 147 0.0117 97.4056 98.2500
1064 CA SER 148 0.0085 97.1677 98.7500
1070 CA GLY 149 0.0065 97.0171 98.6900
1074 CA ASP 150 0.0055 96.9381 98.8100
1082 CA THR 151 0.0068 97.0340 98.8800
1089 CA PHE 152 0.0071 97.0571 98.8100
1100 CA LEU 153 0.0054 96.9317 98.9400
1108 CA PHE 154 0.0043 96.8511 98.9400
1119 CA THR 155 0.0068 97.0346 98.8800
1126 CA GLN 156 0.0074 97.0821 98.7500
1135 CA TYR 157 0.0066 97.0211 98.9400
1147 CA LEU 158 0.0063 96.9997 98.8800
1155 CA SER 159 0.0120 97.4280 98.7500
1161 CA LYS 160 0.0122 97.4400 98.5600
1170 CA GLN 161 0.0119 97.4187 98.6200
1179 CA ASP 162 0.0150 97.6498 98.5600
1187 CA PRO 163 0.0413 99.6104 98.1900
1194 CA GLU 164 0.0689 101.6740 97.4400
1203 CA GLY 165 0.0260 98.4712 96.8800
1207 CA TRP 166 0.0151 97.6554 98.3100
1221 CA GLY 167 0.0283 98.6440 97.8800
1225 CA LYS 168 0.0603 101.0341 96.8800
1234 CA SER 169 0.0393 99.4658 96.5600
1240 CA PRO 170 0.0260 98.4749 96.7500
1247 CA GLY 171 0.0156 97.6962 97.9400
1251 CA PHE 172 0.0132 97.5137 98.1200
1262 CA GLY 173 0.0124 97.4569 97.8100
1266 CA THR 174 0.0105 97.3175 98.0000
1273 CA THR 175 0.0194 97.9817 97.3800
1280 CA VAL 176 0.0168 97.7873 96.7500
1287 CA ASP 177 0.0429 99.7329 96.5600
1295 CA PHE 178 0.0180 97.8764 97.6900
1306 CA PRO 179 0.0294 98.7284 96.6200
1313 CA ALA 180 0.0655 101.4207 95.9400
1318 CA VAL 181 0.0317 98.8951 97.5600
1325 CA PRO 182 0.0574 100.8192 93.4400
1332 CA GLY 183 0.0455 99.9242 95.3800
1336 CA ALA 184 0.0236 98.2891 98.0600
1341 CA LEU 185 0.0178 97.8601 98.3100
1349 CA GLY 186 0.0189 97.9383 98.3100
1353 CA GLU 187 0.0131 97.5074 98.5600
1362 CA ASN 188 0.0161 97.7350 98.3100
1370 CA GLY 189 0.0107 97.3278 98.4400
1374 CA ASN 190 0.0087 97.1804 98.6900
1382 CA GLY 191 0.0157 97.7021 98.4400
1386 CA GLY 192 0.0160 97.7278 98.6200
1390 CA MET 193 0.0092 97.2181 98.8800
1398 CA VAL 194 0.0112 97.3653 98.8800
1405 CA THR 195 0.0230 98.2440 98.7500
1412 CA GLY 196 0.0187 97.9261 98.7500
1416 CA CYS 197 0.0111 97.3566 98.8100
1422 CA ALA 198 0.0166 97.7669 98.6900
1427 CA GLU 199 0.0348 99.1309 98.5000
1436 CA THR 200 0.0201 98.0338 98.6200
1443 CA PRO 201 0.0212 98.1103 98.3100
1450 CA GLY 202 0.0135 97.5417 98.6900
1454 CA CYS 203 0.0083 97.1469 98.8100
1460 CA VAL 204 0.0061 96.9854 98.9400
1467 CA ALA 205 0.0045 96.8656 98.9400
1472 CA TYR 206 0.0046 96.8704 98.8800
1484 CA ILE 207 0.0052 96.9160 98.8800
1492 CA GLY 208 0.0061 96.9866 98.8100
1496 CA ILE 209 0.0067 97.0277 98.8100
1504 CA SER 210 0.0074 97.0815 98.8100
1510 CA PHE 211 0.0092 97.2160 98.8100
1521 CA LEU 212 0.0101 97.2876 98.6200
1529 CA ASP 213 0.0251 98.4031 98.5000
1537 CA GLN 214 0.0212 98.1103 98.6200
1546 CA ALA 215 0.0137 97.5533 98.6900
1551 CA SER 216 0.0234 98.2805 98.0600
1557 CA GLN 217 0.0445 99.8490 98.2500
1566 CA ARG 218 0.0342 99.0827 98.1900
1577 CA GLY 219 0.0242 98.3392 97.6900
1581 CA LEU 220 0.0142 97.5887 98.8100
1589 CA GLY 221 0.0107 97.3312 98.6900
1593 CA GLU 222 0.0085 97.1633 98.6900
1602 CA ALA 223 0.0077 97.1066 98.8800
1607 CA GLN 224 0.0085 97.1650 98.9400
1616 CA LEU 225 0.0065 97.0142 98.9400
1624 CA GLY 226 0.0077 97.1058 98.8100
1628 CA ASN 227 0.0112 97.3646 98.6900
1636 CA SER 228 0.0208 98.0835 97.5600
1642 CA SER 229 0.0324 98.9517 97.8100
1648 CA GLY 230 0.0430 99.7430 97.6200
1652 CA ASN 231 0.0184 97.9033 98.6200
1660 CA PHE 232 0.0124 97.4581 98.8100
1671 CA LEU 233 0.0095 97.2399 98.8100
1679 CA LEU 234 0.0103 97.2984 98.8800
1687 CA PRO 235 0.0082 97.1455 98.4400
1694 CA ASP 236 0.0157 97.7017 98.4400
1702 CA ALA 237 0.0248 98.3827 98.3800
1707 CA GLN 238 0.0299 98.7621 98.3800
1716 CA SER 239 0.0121 97.4312 98.7500
1722 CA ILE 240 0.0097 97.2535 98.7500
1730 CA GLN 241 0.0158 97.7107 98.1200
1739 CA ALA 242 0.0162 97.7376 98.1900
1744 CA ALA 243 0.0116 97.3924 98.3100
1749 CA ALA 244 0.0120 97.4267 98.0000
1754 CA ALA 245 0.0336 99.0415 96.0600
1759 CA GLY 246 0.0313 98.8680 93.7500
1763 CA PHE 247 0.0141 97.5791 96.6900
1774 CA ALA 248 0.0182 97.8881 94.3800
1779 CA SER 249 0.0567 100.7604 94.8100
1785 CA LYS 250 0.0409 99.5840 96.2500
1794 CA THR 251 0.0167 97.7777 98.0000
1801 CA PRO 252 0.0223 98.1933 97.6900
1808 CA ALA 253 0.0220 98.1724 96.8100
1813 CA ASN 254 0.0158 97.7078 96.0600
1821 CA GLN 255 0.0090 97.2052 97.6900
1830 CA ALA 256 0.0118 97.4131 97.0000
1835 CA ILE 257 0.0100 97.2779 97.4400
1843 CA SER 258 0.0090 97.2047 97.9400
1849 CA MET 259 0.0068 97.0363 98.4400
1857 CA ILE 260 0.0068 97.0379 98.6900
1865 CA ASP 261 0.0093 97.2277 98.1900
1873 CA GLY 262 0.0125 97.4635 96.9400
1877 CA PRO 263 0.0252 98.4148 96.0000
1884 CA ALA 264 0.0226 98.2182 97.7500
1889 CA PRO 265 0.0275 98.5868 98.0600
1896 CA ASP 266 0.0218 98.1561 98.3800
1904 CA GLY 267 0.0101 97.2854 98.6200
1908 CA TYR 268 0.0073 97.0721 98.8800
1920 CA PRO 269 0.0061 96.9861 98.7500
1927 CA ILE 270 0.0054 96.9356 98.8800
1935 CA ILE 271 0.0055 96.9431 98.8800
1943 CA ASN 272 0.0051 96.9140 98.8100
1951 CA TYR 273 0.0050 96.9020 98.8100
1963 CA GLU 274 0.0047 96.8782 98.8100
1972 CA TYR 275 0.0045 96.8680 98.8800
1984 CA ALA 276 0.0044 96.8558 98.8100
1989 CA ILE 277 0.0061 96.9873 98.7500
1997 CA VAL 278 0.0066 97.0264 98.4400
2004 CA ASN 279 0.0150 97.6480 97.3100
2012 CA ASN 280 0.0168 97.7847 96.8100
2020 CA ARG 281 0.0301 98.7777 97.1900
2031 CA GLN 282 0.0247 98.3768 97.6200
2040 CA LYS 283 0.0610 101.0873 96.5600
2049 CA ASP 284 0.0505 100.3039 98.0000
2057 CA ALA 285 0.0420 99.6652 98.2500
2062 CA ALA 286 0.0337 99.0465 98.4400
2067 CA THR 287 0.0194 97.9752 98.5600
2074 CA ALA 288 0.0170 97.8010 98.6200
2079 CA GLN 289 0.0183 97.8961 98.7500
2088 CA THR 290 0.0131 97.5110 98.8100
2095 CA LEU 291 0.0081 97.1364 98.8100
2103 CA GLN 292 0.0090 97.2035 98.8800
2112 CA ALA 293 0.0093 97.2217 98.8800
2117 CA PHE 294 0.0064 97.0063 98.8800
2128 CA LEU 295 0.0058 96.9617 98.8800
2136 CA HIS 296 0.0085 97.1664 98.8100
2146 CA TRP 297 0.0092 97.2196 98.7500
2160 CA ALA 298 0.0081 97.1311 98.7500
2165 CA ILE 299 0.0082 97.1430 98.6900
2173 CA THR 300 0.0112 97.3697 98.2500
2180 CA ASP 301 0.0160 97.7262 98.3100
2188 CA GLY 302 0.0110 97.3541 98.3100
2192 CA ASN 303 0.0103 97.2961 98.1200
2200 CA LYS 304 0.0193 97.9676 98.3800
2209 CA ALA 305 0.0302 98.7853 98.1200
2214 CA SER 306 0.0343 99.0882 98.1900
2220 CA PHE 307 0.0125 97.4600 98.6900
2231 CA LEU 308 0.0113 97.3748 98.7500
2239 CA ASP 309 0.0208 98.0803 98.3100
2247 CA GLN 310 0.0223 98.1955 98.4400
2256 CA VAL 311 0.0099 97.2723 98.5600
2263 CA HIS 312 0.0101 97.2813 98.6900
2273 CA PHE 313 0.0076 97.1007 98.8100
2284 CA GLN 314 0.0089 97.1925 98.6200
2293 CA PRO 315 0.0097 97.2506 98.4400
2300 CA LEU 316 0.0093 97.2259 98.2500
2308 CA PRO 317 0.0248 98.3818 97.2500
2315 CA PRO 318 0.0457 99.9439 96.8100
2322 CA ALA 319 0.0249 98.3881 97.1200
2327 CA VAL 320 0.0135 97.5363 98.2500
2334 CA VAL 321 0.0156 97.6973 98.3100
2341 CA LYS 322 0.0266 98.5135 98.1200
2350 CA LEU 323 0.0145 97.6158 98.4400
2358 CA SER 324 0.0110 97.3497 98.6900
2364 CA ASP 325 0.0132 97.5174 98.4400
2372 CA ALA 326 0.0170 97.8015 98.5000
2377 CA LEU 327 0.0111 97.3591 98.5000
2385 CA ILE 328 0.0099 97.2660 98.7500
2393 CA ALA 329 0.0191 97.9533 98.4400
2398 CA THR 330 0.0218 98.1608 98.3100
2405 CA ILE 331 0.0154 97.6783 98.5600
2413 CA SER 332 0.0231 98.2518 97.7500
2419 CA SER 333 0.0419 99.6606 93.5600

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.