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

* Psychrophile *

B-factor analysis for ID 22042311551780060

Overall B-factor prediction

Correlation= 0.540 for 322 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 GLN 7 0.1768 69.9269 68.6700
11 CA PHE 8 0.0736 40.7248 46.7500
22 CA ASP 9 0.0439 32.3134 42.5800
30 CA PRO 10 0.0292 28.1699 37.5300
37 CA ILE 11 0.0151 24.1556 30.9400
45 CA LEU 12 0.0128 23.5136 26.7200
53 CA VAL 13 0.0089 22.4242 26.8100
60 CA ALA 14 0.0129 23.5543 26.4400
65 CA ASP 15 0.0207 25.7624 25.6500
73 CA ILE 16 0.0288 28.0541 31.0800
81 CA GLY 17 0.0552 35.5050 43.9000
85 CA GLY 18 0.0801 42.5727 44.6900
89 CA THR 19 0.1150 52.4249 53.5600
96 CA ASN 20 0.0777 41.8691 48.1900
104 CA ALA 21 0.0412 31.5375 37.6900
109 CA ARG 22 0.0299 28.3485 31.7200
120 CA PHE 23 0.0218 26.0581 26.5400
131 CA ALA 24 0.0199 25.5340 24.5000
136 CA LEU 25 0.0193 25.3627 25.8500
144 CA ILE 26 0.0176 24.8766 28.6400
152 CA THR 27 0.0308 28.6109 33.3400
159 CA ALA 28 0.0350 29.7940 38.7300
164 CA PHE 29 0.0370 30.3616 32.8400
175 CA ASP 30 0.0518 34.5580 38.2300
183 CA ALA 31 0.1201 53.8914 46.9700
188 CA ALA 32 0.1600 65.1645 51.0600
193 CA LYS 33 0.0812 42.8843 34.9500
202 CA ASN 34 0.0470 33.1879 30.6200
210 CA GLU 35 0.0266 27.4195 33.4500
219 CA PHE 36 0.0211 25.8588 27.6100
230 CA VAL 37 0.0286 27.9752 27.9600
237 CA ILE 38 0.0231 26.4354 28.6300
245 CA GLU 39 0.0384 30.7606 27.3400
254 CA TYR 40 0.0443 32.4254 28.0700
266 CA ASN 41 0.0360 30.0795 35.3400
274 CA HIS 42 0.0444 32.4488 38.1300
284 CA THR 43 0.0588 36.5292 32.9200
291 CA PHE 44 0.0718 40.2060 41.0300
302 CA PRO 45 0.0960 47.0625 39.9300
309 CA SER 46 0.0763 41.4936 34.0600
315 CA ALA 47 0.1210 54.1251 46.4700
320 CA ASP 48 0.1164 52.8274 42.7000
328 CA PHE 49 0.0829 43.3531 39.7900
339 CA GLY 50 0.0924 46.0420 47.5000
343 CA SER 51 0.0632 37.7836 33.1700
349 CA LEU 52 0.0406 31.3931 38.3800
357 CA GLN 53 0.0442 32.4004 35.4200
366 CA ASN 54 0.0585 36.4570 33.4700
374 CA ALA 55 0.0469 33.1597 27.6100
379 CA THR 56 0.0346 29.6968 31.3600
386 CA ARG 57 0.0527 34.8090 34.3800
397 CA HIS 58 0.0603 36.9509 25.3000
407 CA TYR 59 0.0437 32.2725 25.7400
419 CA LEU 60 0.0430 32.0477 26.1400
427 CA SER 61 0.0803 42.6275 30.4900
433 CA THR 62 0.0799 42.4994 23.0000
440 CA VAL 63 0.0643 38.0838 27.0700
447 CA PRO 64 0.0845 43.7973 24.2000
454 CA HIS 65 0.0980 47.6251 26.3900
464 CA ILE 66 0.0623 37.5342 29.7600
472 CA LYS 67 0.0549 35.4246 39.9800
481 CA PRO 68 0.0339 29.4894 38.0900
488 CA VAL 69 0.0366 30.2559 33.3400
495 CA ARG 70 0.0232 26.4652 36.4700
506 CA ALA 71 0.0129 23.5373 30.3100
511 CA CYS 72 0.0096 22.5963 21.7700
517 CA LEU 73 0.0106 22.8783 22.9000
525 CA ALA 74 0.0146 24.0204 21.7700
530 CA VAL 75 0.0252 27.0218 30.5500
537 CA ALA 76 0.0417 31.7019 36.8400
542 CA GLY 77 0.0590 36.5768 46.4200
546 CA PRO 78 0.0736 40.7160 60.8300
553 CA ILE 79 0.0647 38.1912 46.9200
561 CA LYS 80 0.1086 50.6242 71.5400
570 CA ALA 81 0.1886 73.2696 84.3600
575 CA GLY 82 0.0932 46.2713 81.6200
579 CA GLN 83 0.0689 39.4031 55.9400
588 CA VAL 84 0.0540 35.1728 42.5800
595 CA HIS 85 0.0748 41.0510 51.3300
605 CA LEU 86 0.0746 41.0094 48.5000
613 CA THR 87 0.1293 56.4730 61.2900
620 CA ASN 88 0.1506 62.4979 56.1300
628 CA LEU 89 0.0975 47.4957 50.6900
636 CA GLY 90 0.1046 49.5000 51.0900
640 CA TRP 91 0.0674 38.9552 46.1900
654 CA HIS 92 0.0709 39.9656 48.9300
664 CA PHE 93 0.0553 35.5395 48.3100
675 CA SER 94 0.0596 36.7711 58.9800
681 CA VAL 95 0.0441 32.3610 55.7700
688 CA SER 96 0.0646 38.1816 62.2500
694 CA GLU 97 0.0648 38.2175 51.6600
703 CA PHE 98 0.0405 31.3624 45.6700
714 CA LYS 99 0.0413 31.5702 43.9100
723 CA GLN 100 0.0694 39.5303 61.7200
732 CA ALA 101 0.0581 36.3427 45.0500
737 CA PHE 102 0.0476 33.3511 39.3700
748 CA SER 103 0.0598 36.8098 43.8400
754 CA PHE 104 0.0404 31.3328 35.6700
765 CA LEU 105 0.0546 35.3328 40.2400
773 CA GLN 106 0.0348 29.7336 45.5200
782 CA LEU 107 0.0218 26.0589 41.7200
790 CA GLU 108 0.0189 25.2532 34.9700
799 CA VAL 109 0.0162 24.4629 27.0800
806 CA ILE 110 0.0174 24.8253 27.7900
814 CA ASN 111 0.0235 26.5434 25.2100
822 CA ASP 112 0.0227 26.3022 29.9100
830 CA PHE 113 0.0186 25.1541 25.4400
841 CA ALA 114 0.0182 25.0358 25.1700
846 CA ALA 115 0.0151 24.1744 22.0800
851 CA PHE 116 0.0143 23.9506 22.3500
862 CA ALA 117 0.0165 24.5618 24.5900
867 CA TYR 118 0.0141 23.8911 24.1100
879 CA ALA 119 0.0143 23.9510 23.8900
884 CA ALA 120 0.0147 24.0502 26.9700
889 CA PRO 121 0.0205 25.6826 28.4300
896 CA TYR 122 0.0183 25.0804 32.0800
908 CA LEU 123 0.0235 26.5311 34.5000
916 CA ASP 124 0.0343 29.6061 55.7300
924 CA SER 125 0.0731 40.5686 76.0400
930 CA ASN 126 0.1017 48.6590 75.8800
938 CA GLN 127 0.0396 31.1065 43.0300
947 CA ASN 128 0.0323 29.0324 31.3400
955 CA VAL 129 0.0254 27.0804 29.3700
962 CA VAL 130 0.0233 26.4793 30.8700
969 CA ILE 131 0.0161 24.4422 25.7800
977 CA LYS 132 0.0171 24.7327 26.9600
986 CA ALA 133 0.0401 31.2435 31.8200
991 CA GLY 134 0.0494 33.8725 48.5300
995 CA GLN 135 0.0520 34.6166 45.0700
1004 CA ALA 136 0.0463 32.9845 33.8900
1009 CA ASP 137 0.0453 32.7191 33.5400
1017 CA GLU 138 0.0510 34.3264 42.4900
1026 CA ASN 139 0.0581 36.3324 36.4500
1034 CA SER 140 0.0315 28.8092 25.9300
1040 CA ASN 141 0.0199 25.5357 20.1600
1048 CA ILE 142 0.0152 24.1849 20.5400
1056 CA ALA 143 0.0126 23.4465 23.4400
1061 CA VAL 144 0.0126 23.4686 23.3600
1068 CA MET 145 0.0135 23.7070 22.4600
1076 CA GLY 146 0.0163 24.5087 26.3400
1080 CA PRO 147 0.0199 25.5215 25.7700
1087 CA GLY 148 0.0331 29.2472 33.5800
1091 CA THR 149 0.0763 41.4853 32.3900
1098 CA GLY 150 0.0453 32.7237 25.1700
1102 CA PHE 151 0.0236 26.5768 21.4500
1113 CA GLY 152 0.0244 26.7891 24.5400
1117 CA ALA 153 0.0176 24.8595 18.1500
1122 CA ALA 154 0.0170 24.7021 20.4200
1127 CA CYS 155 0.0180 24.9914 18.8100
1133 CA LEU 156 0.0181 25.0042 24.6900
1141 CA VAL 157 0.0321 28.9722 22.1400
1148 CA ARG 158 0.0377 30.5748 22.3100
1159 CA THR 159 0.1169 52.9635 23.3000
1166 CA ALA 160 0.2800 99.1148 33.3500
1171 CA GLN 161 0.3477 118.2773 30.5100
1180 CA SER 162 0.2636 94.4792 26.2500
1186 CA SER 163 0.0717 40.1696 23.2000
1192 CA ALA 164 0.0604 36.9774 21.0800
1197 CA VAL 165 0.0246 26.8680 23.2500
1204 CA LEU 166 0.0272 27.5835 19.6200
1212 CA SER 167 0.0299 28.3421 23.7600
1218 CA SER 168 0.0348 29.7267 23.6600
1224 CA GLU 169 0.0708 39.9209 21.7700
1233 CA GLY 170 0.0344 29.6386 21.7100
1237 CA GLY 171 0.0304 28.4899 21.9500
1241 CA HIS 172 0.0407 31.4130 21.5500
1251 CA ILE 173 0.0390 30.9293 21.1000
1259 CA SER 174 0.0421 31.7984 23.6500
1265 CA LEU 175 0.0252 27.0296 23.1100
1273 CA ALA 176 0.0277 27.7387 22.1500
1278 CA ALA 177 0.0332 29.2745 29.4900
1283 CA VAL 178 0.0376 30.5231 27.7400
1290 CA THR 179 0.0530 34.8897 32.6600
1297 CA ASP 180 0.0822 43.1454 29.7100
1305 CA LEU 181 0.0395 31.0745 33.1300
1313 CA ASP 182 0.0269 27.5168 31.4100
1321 CA ALA 183 0.0456 32.7937 33.4800
1326 CA LYS 184 0.0513 34.4233 34.8000
1335 CA LEU 185 0.0303 28.4578 31.2800
1343 CA LEU 186 0.0343 29.5882 30.5600
1351 CA ILE 187 0.0559 35.7050 30.3200
1359 CA GLU 188 0.0498 33.9761 34.7700
1368 CA LEU 189 0.0384 30.7495 30.9800
1376 CA ARG 190 0.0564 35.8399 34.1300
1387 CA LYS 191 0.0815 42.9602 40.9300
1396 CA GLU 192 0.0793 42.3275 36.3500
1405 CA HIS 193 0.0676 39.0157 33.9300
1415 CA PRO 194 0.0903 45.4378 32.1600
1422 CA HIS 195 0.0654 38.3966 27.4900
1432 CA VAL 196 0.0388 30.8686 26.0100
1439 CA SER 197 0.0290 28.0939 24.0300
1445 CA LEU 198 0.0194 25.3900 22.2300
1453 CA GLU 199 0.0254 27.0825 22.6600
1462 CA THR 200 0.0272 27.5871 26.9300
1469 CA VAL 201 0.0168 24.6349 24.0300
1476 CA PHE 202 0.0151 24.1710 23.7900
1487 CA SER 203 0.0256 27.1311 22.0100
1493 CA GLY 204 0.0379 30.6290 29.1200
1497 CA PRO 205 0.0439 32.3275 26.2700
1504 CA GLY 206 0.0279 27.7948 26.2000
1508 CA ILE 207 0.0260 27.2588 22.0000
1516 CA ALA 208 0.0376 30.5465 27.8600
1521 CA HIS 209 0.0324 29.0691 28.4600
1531 CA LEU 210 0.0221 26.1440 21.7600
1539 CA TYR 211 0.0320 28.9408 29.0500
1551 CA LYS 212 0.0437 32.2546 31.9500
1560 CA ALA 213 0.0367 30.2919 34.6000
1565 CA MET 214 0.0329 29.2127 28.1800
1573 CA ALA 215 0.0524 34.7208 41.0900
1578 CA ALA 216 0.0652 38.3315 38.6500
1583 CA VAL 217 0.0586 36.4711 50.3500
1590 CA ASN 218 0.0764 41.5204 43.2600
1598 CA GLY 219 0.1350 58.1087 51.1100
1602 CA ILE 220 0.1138 52.0970 65.5300
1610 CA THR 221 0.1563 64.1171 73.6900
1617 CA ALA 222 0.0867 44.4231 59.6400
1622 CA LYS 223 0.1151 52.4775 66.5000
1631 CA HIS 224 0.1433 60.4415 64.2500
1641 CA LEU 225 0.0838 43.5938 38.2300
1649 CA ASP 226 0.0826 43.2689 39.3100
1657 CA ALA 227 0.0591 36.6178 33.9600
1662 CA ALA 228 0.0929 46.1816 41.8300
1667 CA GLN 229 0.0917 45.8522 40.8900
1676 CA ILE 230 0.0554 35.5794 32.2300
1684 CA SER 231 0.0627 37.6316 41.1400
1690 CA ASN 232 0.0964 47.1650 43.4000
1698 CA LEU 233 0.0871 44.5313 38.3600
1706 CA ALA 234 0.0675 38.9933 36.9400
1711 CA ASN 235 0.1130 51.8566 47.7000
1719 CA THR 236 0.1634 66.1392 43.7100
1726 CA GLY 237 0.1451 60.9394 50.9000
1730 CA GLU 238 0.1498 62.2826 48.2700
1739 CA CYS 239 0.0819 43.0767 41.7900
1745 CA GLU 240 0.0789 42.2152 50.9500
1754 CA VAL 241 0.0466 33.0723 41.2200
1761 CA CYS 242 0.0402 31.2733 37.3400
1767 CA ASP 243 0.0396 31.1089 34.1900
1775 CA ALA 244 0.0331 29.2514 35.6100
1780 CA THR 245 0.0212 25.9006 34.4000
1787 CA LEU 246 0.0204 25.6616 28.0500
1795 CA ASN 247 0.0173 24.7934 30.6700
1803 CA GLN 248 0.0134 23.6872 32.3700
1812 CA PHE 249 0.0104 22.8380 26.1100
1823 CA CYS 250 0.0103 22.8003 26.6600
1829 CA ASP 251 0.0113 23.0801 23.1200
1837 CA TRP 252 0.0098 22.6652 27.3800
1851 CA LEU 253 0.0078 22.0930 21.3400
1859 CA GLY 254 0.0090 22.4404 22.0300
1863 CA SER 255 0.0109 22.9884 21.8700
1869 CA ALA 256 0.0105 22.8642 18.8500
1874 CA ALA 257 0.0096 22.6213 25.1800
1879 CA GLY 258 0.0111 23.0267 20.2000
1883 CA ASP 259 0.0128 23.5215 20.9400
1891 CA LEU 260 0.0127 23.4907 19.7000
1899 CA ALA 261 0.0131 23.5867 22.4100
1904 CA LEU 262 0.0187 25.1741 22.1600
1912 CA ALA 263 0.0209 25.7988 15.8300
1917 CA TYR 264 0.0182 25.0313 22.4800
1929 CA GLY 265 0.0211 25.8520 21.4800
1933 CA ALA 266 0.0162 24.4731 20.7500
1938 CA LEU 267 0.0214 25.9483 23.3600
1946 CA GLY 268 0.0216 26.0044 24.8600
1950 CA GLY 269 0.0145 23.9896 24.2300
1954 CA LEU 270 0.0114 23.1068 25.0000
1962 CA PHE 271 0.0117 23.2044 22.4800
1973 CA ILE 272 0.0125 23.4312 24.2400
1981 CA GLY 273 0.0191 25.2950 26.9200
1985 CA GLY 274 0.0256 27.1304 25.0600
1989 CA GLY 275 0.0435 32.2145 31.5900
1993 CA ILE 276 0.0309 28.6233 29.2700
2001 CA LEU 277 0.0200 25.5604 30.6100
2009 CA PRO 278 0.0287 28.0105 32.3000
2016 CA ARG 279 0.0506 34.2059 28.0900
2027 CA MET 280 0.0291 28.1143 34.5300
2035 CA GLN 281 0.0297 28.3072 34.1600
2044 CA SER 282 0.0363 30.1769 38.2600
2050 CA ARG 283 0.0237 26.5872 30.3300
2061 CA LEU 284 0.0170 24.6975 32.5400
2069 CA LEU 285 0.0270 27.5285 29.0100
2077 CA GLU 286 0.0398 31.1632 34.6300
2086 CA SER 287 0.0229 26.3752 26.8600
2092 CA ARG 288 0.0228 26.3324 27.5500
2103 CA PHE 289 0.0120 23.2835 26.2600
2114 CA VAL 290 0.0157 24.3430 23.8500
2121 CA GLU 291 0.0282 27.8705 28.8900
2130 CA ARG 292 0.0170 24.6987 23.1300
2141 CA PHE 293 0.0139 23.8243 26.1300
2152 CA SER 294 0.0201 25.5797 22.2500
2158 CA GLN 295 0.0286 27.9986 24.4800
2167 CA LYS 296 0.0337 29.4230 23.9200
2176 CA GLY 297 0.1795 70.6853 25.2000
2180 CA ILE 298 0.1500 62.3467 22.1500
2188 CA MET 299 0.0547 35.3618 23.9600
2196 CA SER 300 0.0435 32.1964 27.3700
2202 CA GLN 301 0.0545 35.3067 26.5700
2211 CA TYR 302 0.0347 29.7144 22.7200
2223 CA ASN 303 0.0204 25.6714 23.2700
2231 CA GLY 304 0.0285 27.9494 23.1400
2235 CA GLN 305 0.0308 28.5957 24.1800
2244 CA VAL 306 0.0190 25.2738 21.2600
2251 CA PRO 307 0.0179 24.9607 26.3800
2258 CA VAL 308 0.0135 23.7062 19.0000
2265 CA THR 309 0.0159 24.3804 21.6700
2272 CA LEU 310 0.0169 24.6645 23.4200
2280 CA VAL 311 0.0197 25.4540 25.6800
2287 CA THR 312 0.0269 27.5065 40.8400
2294 CA GLN 313 0.0360 30.0931 43.9200
2303 CA ASP 314 0.0509 34.2978 58.6500
2311 CA ASN 315 0.0222 26.1786 34.6000
2319 CA ILE 316 0.0176 24.8608 25.6600
2327 CA PRO 317 0.0161 24.4564 24.3800
2334 CA LEU 318 0.0118 23.2458 23.8800
2342 CA ILE 319 0.0120 23.2784 25.8500
2350 CA GLY 320 0.0114 23.1184 23.6200
2354 CA ALA 321 0.0085 22.3025 23.7400
2359 CA ALA 322 0.0091 22.4656 23.7400
2364 CA ALA 323 0.0128 23.5182 22.7800
2369 CA CYS 324 0.0137 23.7569 25.9000
2375 CA LEU 325 0.0158 24.3607 32.0000
2383 CA HIS 326 0.0202 25.6049 38.8700
2393 CA ASN 327 0.0321 28.9623 41.3100
2401 CA SER 328 0.0499 34.0238 35.7600

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.