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

* 1DQZ_unrelaxed_rank_001_alphafold2_ptm_model_3_seed_000 *

B-factor analysis for ID 240220092131172147

Overall B-factor prediction

Correlation= -0.490 for 280 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 ARG 1 0.2320 163.3550 58.5600
13 CA PRO 2 0.3480 200.8432 70.8800
20 CA GLY 3 0.1140 125.1959 81.8100
24 CA LEU 4 0.0386 100.7859 90.8100
32 CA PRO 5 0.0274 97.1626 94.7500
39 CA VAL 6 0.0186 94.3294 97.5000
46 CA GLU 7 0.0152 93.2190 97.8800
55 CA TYR 8 0.0163 93.5871 97.8100
67 CA LEU 9 0.0131 92.5461 98.5600
75 CA GLN 10 0.0155 93.3150 98.5600
84 CA VAL 11 0.0132 92.5775 98.7500
91 CA PRO 12 0.0168 93.7500 98.6200
98 CA SER 13 0.0167 93.7006 98.5600
104 CA ALA 14 0.0374 100.3918 98.3800
109 CA SER 15 0.0179 94.0902 98.2500
115 CA MET 16 0.0149 93.1164 98.0000
123 CA GLY 17 0.0294 97.8212 97.7500
127 CA ARG 18 0.0253 96.4837 97.1900
138 CA ASP 19 0.0202 94.8329 98.3100
146 CA ILE 20 0.0128 92.4359 98.5600
154 CA LYS 21 0.0104 91.6624 98.7500
163 CA VAL 22 0.0075 90.7477 98.8800
170 CA GLN 23 0.0067 90.4803 98.7500
179 CA PHE 24 0.0069 90.5336 98.7500
190 CA GLN 25 0.0100 91.5511 98.5000
199 CA GLY 26 0.0119 92.1541 98.0000
203 CA GLY 27 0.0165 93.6515 96.3100
207 CA GLY 28 0.0162 93.5539 95.8800
211 CA PRO 29 0.0152 93.2358 97.3100
218 CA HIS 30 0.0100 91.5341 98.5000
228 CA ALA 31 0.0053 90.0401 98.7500
233 CA VAL 32 0.0047 89.8436 98.8800
240 CA TYR 33 0.0034 89.4069 98.9400
252 CA LEU 34 0.0038 89.5495 98.9400
260 CA LEU 35 0.0037 89.4943 98.7500
268 CA ASP 36 0.0042 89.6743 97.6900
276 CA GLY 37 0.0075 90.7267 95.4400
280 CA LEU 38 0.0078 90.8335 94.1900
288 CA ARG 39 0.0186 94.3204 93.8800
299 CA ALA 40 0.0137 92.7291 96.5000
304 CA GLN 41 0.0169 93.7917 96.1200
313 CA ASP 42 0.0204 94.9157 95.5600
321 CA ASP 43 0.0267 96.9428 97.3100
329 CA TYR 44 0.0117 92.1009 98.0000
341 CA ASN 45 0.0064 90.3814 98.3100
349 CA GLY 46 0.0078 90.8297 97.9400
353 CA TRP 47 0.0057 90.1438 98.3800
367 CA ASP 48 0.0077 90.7922 97.4400
375 CA ILE 49 0.0145 92.9947 97.1200
383 CA ASN 50 0.0152 93.2244 97.2500
391 CA THR 51 0.0105 91.7035 97.3800
398 CA PRO 52 0.0129 92.4889 97.2500
405 CA ALA 53 0.0092 91.2742 98.1200
410 CA PHE 54 0.0080 90.8905 98.0000
421 CA GLU 55 0.0140 92.8390 97.1200
430 CA GLU 56 0.0126 92.3909 97.1900
439 CA TYR 57 0.0103 91.6492 97.8100
451 CA TYR 58 0.0173 93.9160 97.1200
463 CA GLN 59 0.0424 102.0358 95.5600
472 CA SER 60 0.0216 95.2963 96.9400
478 CA GLY 61 0.0164 93.6192 97.2500
482 CA LEU 62 0.0107 91.7616 98.4400
490 CA SER 63 0.0073 90.6870 98.6200
496 CA VAL 64 0.0062 90.3325 98.8100
503 CA ILE 65 0.0044 89.7321 98.8800
511 CA MET 66 0.0047 89.8285 98.8800
519 CA PRO 67 0.0050 89.9290 98.6200
526 CA VAL 68 0.0064 90.3692 98.6200
533 CA GLY 69 0.0075 90.7394 96.5000
537 CA GLY 70 0.0066 90.4395 95.4400
541 CA GLN 71 0.0088 91.1570 97.1900
550 CA SER 72 0.0072 90.6485 96.6200
556 CA SER 73 0.0044 89.7221 97.6200
562 CA PHE 74 0.0041 89.6373 98.1200
573 CA TYR 75 0.0036 89.4740 98.5600
585 CA THR 76 0.0041 89.6530 98.6900
592 CA ASP 77 0.0067 90.4738 98.7500
600 CA TRP 78 0.0067 90.4646 98.6200
614 CA TYR 79 0.0150 93.1507 98.2500
626 CA GLN 80 0.0176 94.0005 98.0000
635 CA PRO 81 0.0169 93.7723 97.5600
642 CA SER 82 0.0149 93.1152 95.9400
648 CA GLN 83 0.0307 98.2382 90.1200
657 CA SER 84 0.0357 99.8521 89.5600
663 CA ASN 85 0.0370 100.2772 91.3800
671 CA GLY 86 0.0704 111.0774 89.0600
675 CA GLN 87 0.0305 98.1690 92.6200
684 CA ASN 88 0.0568 106.6882 92.8100
692 CA TYR 89 0.0199 94.7447 95.1900
704 CA THR 90 0.0141 92.8571 98.0600
711 CA TYR 91 0.0068 90.5053 98.4400
723 CA LYS 92 0.0074 90.6993 98.8100
732 CA TRP 93 0.0044 89.7202 98.8100
746 CA GLU 94 0.0053 90.0359 98.8100
755 CA THR 95 0.0086 91.1038 98.8800
762 CA PHE 96 0.0069 90.5391 98.9400
773 CA LEU 97 0.0054 90.0705 98.8800
781 CA THR 98 0.0072 90.6260 98.8800
788 CA ARG 99 0.0152 93.2366 98.7500
799 CA GLU 100 0.0117 92.0800 98.8800
808 CA MET 101 0.0084 91.0369 98.8100
816 CA PRO 102 0.0094 91.3643 98.7500
823 CA ALA 103 0.0200 94.7890 98.6900
828 CA TRP 104 0.0165 93.6343 98.8100
842 CA LEU 105 0.0118 92.1218 98.8100
850 CA GLN 106 0.0192 94.5082 98.5600
859 CA ALA 107 0.0370 100.2802 98.4400
864 CA ASN 108 0.0345 99.4620 98.5000
872 CA LYS 109 0.0192 94.5093 98.3100
881 CA GLY 110 0.0240 96.0863 97.6900
885 CA VAL 111 0.0113 91.9660 98.4400
892 CA SER 112 0.0127 92.4172 98.3800
898 CA PRO 113 0.0117 92.0995 98.5000
905 CA THR 114 0.0123 92.2973 98.5000
912 CA GLY 115 0.0088 91.1730 98.5000
916 CA ASN 116 0.0070 90.5727 98.8800
924 CA ALA 117 0.0044 89.7382 98.9400
929 CA ALA 118 0.0041 89.6400 98.9400
934 CA VAL 119 0.0034 89.4023 98.9400
941 CA GLY 120 0.0036 89.4636 98.5600
945 CA LEU 121 0.0043 89.6994 97.3800
953 CA SER 122 0.0045 89.7658 94.8800
959 CA MET 123 0.0042 89.6595 95.1900
967 CA SER 124 0.0038 89.5374 98.0600
973 CA GLY 125 0.0041 89.6330 97.7500
977 CA GLY 126 0.0038 89.5342 97.5600
981 CA SER 127 0.0036 89.4602 98.5000
987 CA ALA 128 0.0038 89.5249 98.8800
992 CA LEU 129 0.0045 89.7815 98.9400
1000 CA ILE 130 0.0051 89.9515 98.8800
1008 CA LEU 131 0.0053 90.0378 98.9400
1016 CA ALA 132 0.0059 90.2182 98.8100
1021 CA ALA 133 0.0080 90.8856 98.8100
1026 CA TYR 134 0.0094 91.3596 98.8800
1038 CA TYR 135 0.0083 90.9801 98.8800
1050 CA PRO 136 0.0105 91.7147 98.6200
1057 CA GLN 137 0.0249 96.3690 98.4400
1066 CA GLN 138 0.0090 91.2167 98.8100
1075 CA PHE 139 0.0060 90.2601 98.8800
1086 CA PRO 140 0.0073 90.6803 98.7500
1093 CA TYR 141 0.0050 89.9378 98.8800
1105 CA ALA 142 0.0050 89.9270 98.9400
1110 CA ALA 143 0.0038 89.5449 98.8800
1115 CA SER 144 0.0036 89.4635 98.6900
1121 CA LEU 145 0.0039 89.5673 98.1900
1129 CA SER 146 0.0041 89.6420 95.4400
1135 CA GLY 147 0.0048 89.8750 94.1900
1139 CA PHE 148 0.0048 89.8653 89.3800
1150 CA LEU 149 0.0062 90.3039 96.0000
1158 CA ASN 150 0.0074 90.7032 95.2500
1166 CA PRO 151 0.0083 91.0013 95.1200
1173 CA SER 152 0.0104 91.6640 97.0000
1179 CA GLU 153 0.0258 96.6510 93.4400
1188 CA SER 154 0.0472 103.5790 89.3100
1194 CA TRP 155 0.0366 100.1536 88.0600
1208 CA TRP 156 0.0148 93.0846 91.0000
1222 CA PRO 157 0.0153 93.2679 94.6200
1229 CA THR 158 0.0247 96.3096 91.3800
1236 CA LEU 159 0.0180 94.1236 89.6900
1244 CA ILE 160 0.0128 92.4572 93.1200
1252 CA GLY 161 0.0301 98.0437 94.0000
1256 CA LEU 162 0.0363 100.0668 91.0000
1264 CA ALA 163 0.0219 95.4094 91.3100
1269 CA MET 164 0.0132 92.5963 94.3100
1277 CA ASN 165 0.0253 96.4961 93.7500
1285 CA ASP 166 0.0432 102.2705 90.7500
1293 CA SER 167 0.0216 95.3013 91.0000
1299 CA GLY 168 0.0235 95.9006 93.5600
1303 CA GLY 169 0.0219 95.3899 95.4400
1307 CA TYR 170 0.0142 92.8949 96.6200
1319 CA ASN 171 0.0136 92.7230 96.3800
1327 CA ALA 172 0.0115 92.0264 96.3800
1332 CA ASN 173 0.0170 93.7981 97.1900
1340 CA SER 174 0.0125 92.3694 98.1900
1346 CA MET 175 0.0075 90.7447 98.3100
1354 CA TRP 176 0.0082 90.9691 98.4400
1368 CA GLY 177 0.0211 95.1429 97.9400
1372 CA PRO 178 0.0380 100.6145 97.1900
1379 CA SER 179 0.0322 98.7256 96.0000
1385 CA SER 180 0.0545 105.9393 96.7500
1391 CA ASP 181 0.0277 97.2666 98.4400
1399 CA PRO 182 0.0305 98.1775 98.3800
1406 CA ALA 183 0.0120 92.1948 98.5600
1411 CA TRP 184 0.0094 91.3431 98.5000
1425 CA LYS 185 0.0115 92.0286 98.5000
1434 CA ARG 186 0.0087 91.1146 98.5600
1445 CA ASN 187 0.0060 90.2660 98.6200
1453 CA ASP 188 0.0067 90.4794 98.5600
1461 CA PRO 189 0.0067 90.4815 98.5600
1468 CA MET 190 0.0070 90.5736 98.4400
1476 CA VAL 191 0.0104 91.6647 98.6900
1483 CA GLN 192 0.0094 91.3658 98.8100
1492 CA ILE 193 0.0114 91.9971 98.8800
1500 CA PRO 194 0.0154 93.2987 98.7500
1507 CA ARG 195 0.0134 92.6577 98.7500
1518 CA LEU 196 0.0094 91.3397 98.8800
1526 CA VAL 197 0.0157 93.3733 98.8100
1533 CA ALA 198 0.0265 96.8757 98.7500
1538 CA ASN 199 0.0172 93.8857 98.6200
1546 CA ASN 200 0.0192 94.5078 98.5000
1554 CA THR 201 0.0088 91.1566 98.5600
1561 CA ARG 202 0.0076 90.7782 98.8800
1572 CA ILE 203 0.0059 90.2148 98.8800
1580 CA TRP 204 0.0053 90.0378 98.8800
1594 CA VAL 205 0.0055 90.0971 98.7500
1601 CA TYR 206 0.0046 89.8079 98.1200
1613 CA CYS 207 0.0067 90.4796 94.8100
1619 CA GLY 208 0.0083 90.9928 90.5000
1623 CA ASN 209 0.0163 93.5685 85.4400
1631 CA GLY 210 0.0166 93.6938 81.3800
1635 CA THR 211 0.0276 97.2250 79.3100
1642 CA PRO 212 0.0263 96.8132 74.9400
1649 CA SER 213 0.0482 103.8960 78.1200
1655 CA ASP 214 0.1090 123.5643 74.0600
1663 CA LEU 215 0.0382 100.6617 64.6200
1671 CA GLY 216 0.0391 100.9418 76.0000
1675 CA GLY 217 0.0342 99.3700 64.8100
1679 CA ASP 218 0.0519 105.0874 60.9100
1687 CA ASN 219 0.0708 111.2066 59.8400
1695 CA ILE 220 0.0752 112.6346 48.3400
1703 CA PRO 221 0.0608 107.9823 59.4400
1710 CA ALA 222 0.0292 97.7512 58.6900
1715 CA LYS 223 0.0253 96.4869 56.2200
1724 CA PHE 224 0.0363 100.0594 54.5900
1735 CA LEU 225 0.0184 94.2702 63.8400
1743 CA GLU 226 0.0113 91.9593 61.0300
1752 CA GLY 227 0.0177 94.0431 60.2500
1756 CA LEU 228 0.0203 94.8814 68.5600
1764 CA THR 229 0.0093 91.3059 79.6900
1771 CA LEU 230 0.0094 91.3458 86.4400
1779 CA ARG 231 0.0228 95.6758 88.2500
1790 CA THR 232 0.0117 92.1067 92.0600
1797 CA ASN 233 0.0075 90.7424 96.4400
1805 CA GLN 234 0.0115 92.0301 96.7500
1814 CA THR 235 0.0132 92.5732 96.8100
1821 CA PHE 236 0.0088 91.1499 98.4400
1832 CA ARG 237 0.0120 92.2029 98.6200
1843 CA ASP 238 0.0195 94.6199 98.5600
1851 CA THR 239 0.0165 93.6569 98.6200
1858 CA TYR 240 0.0117 92.0816 98.8100
1870 CA ALA 241 0.0277 97.2638 98.6900
1875 CA ALA 242 0.0510 104.7952 98.5600
1880 CA ASP 243 0.0318 98.5961 98.4400
1888 CA GLY 244 0.0382 100.6786 98.5000
1892 CA GLY 245 0.0273 97.1500 98.6200
1896 CA ARG 246 0.0396 101.1130 98.5000
1907 CA ASN 247 0.0137 92.7407 98.5600
1915 CA GLY 248 0.0124 92.3375 98.4400
1919 CA VAL 249 0.0093 91.3220 98.6200
1926 CA PHE 250 0.0090 91.2102 98.5000
1937 CA ASN 251 0.0092 91.2908 97.7500
1945 CA PHE 252 0.0101 91.5783 96.2500
1956 CA PRO 253 0.0296 97.8775 92.8100
1963 CA PRO 254 0.0479 103.7945 89.3100
1970 CA ASN 255 0.0225 95.5849 86.6900
1978 CA GLY 256 0.0134 92.6384 88.1200
1982 CA THR 257 0.0102 91.6165 88.1900
1989 CA HIS 258 0.0090 91.2100 90.1200
1999 CA SER 259 0.0107 91.7656 92.0000
2005 CA TRP 260 0.0078 90.8383 94.6200
2019 CA PRO 261 0.0140 92.8290 95.6900
2026 CA TYR 262 0.0097 91.4570 95.3800
2038 CA TRP 263 0.0063 90.3383 97.3100
2052 CA ASN 264 0.0074 90.7170 98.2500
2060 CA GLU 265 0.0098 91.4818 97.6900
2069 CA GLN 266 0.0076 90.7659 98.5000
2078 CA LEU 267 0.0074 90.6975 98.6200
2086 CA VAL 268 0.0091 91.2634 98.4400
2093 CA ALA 269 0.0099 91.5238 98.4400
2098 CA MET 270 0.0080 90.8845 98.5600
2106 CA LYS 271 0.0109 91.8520 98.5600
2115 CA ALA 272 0.0147 93.0695 98.2500
2120 CA ASP 273 0.0104 91.6824 98.5600
2128 CA ILE 274 0.0088 91.1583 98.6900
2136 CA GLN 275 0.0150 93.1689 98.2500
2145 CA HIS 276 0.0270 97.0376 97.8800
2155 CA VAL 277 0.0142 92.9164 98.1200
2162 CA LEU 278 0.0131 92.5432 97.8800
2170 CA ASN 279 0.0327 98.8875 91.6200
2178 CA GLY 280 0.1004 120.7933 82.4400

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.