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

* EXP_1DQZ_unrelaxed_rank_001_alphafold2_ptm_model_3_seed_000 *

B-factor analysis for ID 24021912402138273

Overall B-factor prediction

Correlation= -0.541 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 0.1551 134.3891 77.3100
13 CA PRO 2 0.2170 151.9340 82.8100
20 CA GLY 3 0.1010 119.0180 88.4400
24 CA LEU 4 0.0395 101.5790 94.6200
32 CA PRO 5 0.0265 97.9057 96.6200
39 CA VAL 6 0.0183 95.5636 98.0600
46 CA GLU 7 0.0155 94.7822 98.1200
55 CA TYR 8 0.0171 95.2166 98.0600
67 CA LEU 9 0.0135 94.2169 98.6200
75 CA GLN 10 0.0160 94.9085 98.6200
84 CA VAL 11 0.0133 94.1528 98.7500
91 CA PRO 12 0.0169 95.1811 98.6900
98 CA SER 13 0.0169 95.1638 98.6900
104 CA ALA 14 0.0377 101.0692 98.5000
109 CA SER 15 0.0181 95.5178 98.4400
115 CA MET 16 0.0151 94.6683 98.3100
123 CA GLY 17 0.0301 98.9217 98.1200
127 CA ARG 18 0.0262 97.8003 97.5600
138 CA ASP 19 0.0205 96.2023 98.4400
146 CA ILE 20 0.0131 94.0826 98.6200
154 CA LYS 21 0.0105 93.3592 98.8100
163 CA VAL 22 0.0076 92.5403 98.8800
170 CA GLN 23 0.0067 92.2907 98.8100
179 CA PHE 24 0.0069 92.3376 98.8100
190 CA GLN 25 0.0100 93.2211 98.6200
199 CA GLY 26 0.0117 93.6849 98.1900
203 CA GLY 27 0.0168 95.1442 96.5600
207 CA GLY 28 0.0167 95.1110 95.9400
211 CA PRO 29 0.0154 94.7505 97.3100
218 CA HIS 30 0.0100 93.2283 98.5000
228 CA ALA 31 0.0053 91.8910 98.7500
233 CA VAL 32 0.0048 91.7286 98.8800
240 CA TYR 33 0.0034 91.3439 98.9400
252 CA LEU 34 0.0038 91.4706 98.9400
260 CA LEU 35 0.0037 91.4401 98.7500
268 CA ASP 36 0.0043 91.5996 98.0600
276 CA GLY 37 0.0078 92.5838 96.3100
280 CA LEU 38 0.0081 92.6811 95.8800
288 CA ARG 39 0.0187 95.6943 95.1200
299 CA ALA 40 0.0142 94.4019 97.1900
304 CA GLN 41 0.0177 95.3973 96.7500
313 CA ASP 42 0.0219 96.5931 95.8100
321 CA ASP 43 0.0271 98.0659 97.5600
329 CA TYR 44 0.0119 93.7448 98.0600
341 CA ASN 45 0.0065 92.2325 98.3800
349 CA GLY 46 0.0079 92.6218 98.2500
353 CA TRP 47 0.0058 92.0146 98.4400
367 CA ASP 48 0.0079 92.6224 97.7500
375 CA ILE 49 0.0148 94.5751 97.4400
383 CA ASN 50 0.0153 94.7133 97.6900
391 CA THR 51 0.0111 93.5241 97.7500
398 CA PRO 52 0.0136 94.2361 97.5600
405 CA ALA 53 0.0094 93.0455 98.3100
410 CA PHE 54 0.0080 92.6401 98.2500
421 CA GLU 55 0.0161 94.9596 97.9400
430 CA GLU 56 0.0142 94.4074 97.7500
439 CA TYR 57 0.0102 93.2681 98.0600
451 CA TYR 58 0.0160 94.9288 97.5600
463 CA GLN 59 0.0426 102.4641 96.0000
472 CA SER 60 0.0219 96.5897 97.0600
478 CA GLY 61 0.0167 95.1253 97.2500
482 CA LEU 62 0.0107 93.4281 98.4400
490 CA SER 63 0.0073 92.4499 98.6900
496 CA VAL 64 0.0062 92.1429 98.8800
503 CA ILE 65 0.0044 91.6165 98.9400
511 CA MET 66 0.0047 91.7034 98.8800
519 CA PRO 67 0.0051 91.8217 98.6900
526 CA VAL 68 0.0064 92.2086 98.6900
533 CA GLY 69 0.0078 92.5841 96.9400
537 CA GLY 70 0.0067 92.2864 95.8100
541 CA GLN 71 0.0090 92.9334 97.6200
550 CA SER 72 0.0075 92.4939 97.4400
556 CA SER 73 0.0044 91.6377 97.6900
562 CA PHE 74 0.0042 91.5698 98.1900
573 CA TYR 75 0.0036 91.4084 98.5600
585 CA THR 76 0.0041 91.5573 98.6200
592 CA ASP 77 0.0068 92.3010 98.7500
600 CA TRP 78 0.0068 92.3179 98.6900
614 CA TYR 79 0.0155 94.7631 98.3800
626 CA GLN 80 0.0179 95.4581 98.1900
635 CA PRO 81 0.0173 95.2752 97.8800
642 CA SER 82 0.0153 94.7123 96.5000
648 CA GLN 83 0.0326 99.6174 91.0600
657 CA SER 84 0.0371 100.8944 88.9400
663 CA ASN 85 0.0391 101.4769 92.8100
671 CA GLY 86 0.0770 112.2084 90.9400
675 CA GLN 87 0.0306 99.0735 93.8100
684 CA ASN 88 0.0562 106.3189 94.3100
692 CA TYR 89 0.0203 96.1422 96.6200
704 CA THR 90 0.0143 94.4507 98.3100
711 CA TYR 91 0.0069 92.3302 98.5600
723 CA LYS 92 0.0074 92.4911 98.8800
732 CA TRP 93 0.0044 91.6165 98.8800
746 CA GLU 94 0.0053 91.8819 98.8800
755 CA THR 95 0.0087 92.8446 98.8800
762 CA PHE 96 0.0069 92.3500 98.9400
773 CA LEU 97 0.0055 91.9516 98.8800
781 CA THR 98 0.0073 92.4443 98.8800
788 CA ARG 99 0.0158 94.8679 98.7500
799 CA GLU 100 0.0119 93.7486 98.8800
808 CA MET 101 0.0086 92.8077 98.8100
816 CA PRO 102 0.0096 93.0998 98.7500
823 CA ALA 103 0.0203 96.1455 98.7500
828 CA TRP 104 0.0166 95.0955 98.8100
842 CA LEU 105 0.0120 93.7749 98.8100
850 CA GLN 106 0.0193 95.8601 98.6200
859 CA ALA 107 0.0374 100.9911 98.5000
864 CA ASN 108 0.0349 100.2935 98.5600
872 CA LYS 109 0.0195 95.9087 98.3800
881 CA GLY 110 0.0243 97.2768 97.8800
885 CA VAL 111 0.0115 93.6299 98.4400
892 CA SER 112 0.0129 94.0308 98.3800
898 CA PRO 113 0.0118 93.7211 98.5000
905 CA THR 114 0.0125 93.9245 98.5000
912 CA GLY 115 0.0089 92.9170 98.4400
916 CA ASN 116 0.0071 92.3986 98.8800
924 CA ALA 117 0.0045 91.6535 98.9400
929 CA ALA 118 0.0042 91.5609 98.9400
934 CA VAL 119 0.0034 91.3537 98.9400
941 CA GLY 120 0.0036 91.4149 98.6200
945 CA LEU 121 0.0045 91.6494 98.1200
953 CA SER 122 0.0047 91.7154 96.2500
959 CA MET 123 0.0043 91.6119 96.2500
967 CA SER 124 0.0039 91.4920 98.2500
973 CA GLY 125 0.0042 91.5756 98.0000
977 CA GLY 126 0.0038 91.4661 97.7500
981 CA SER 127 0.0036 91.3969 98.5000
987 CA ALA 128 0.0038 91.4581 98.8800
992 CA LEU 129 0.0046 91.6854 98.9400
1000 CA ILE 130 0.0051 91.8371 98.8800
1008 CA LEU 131 0.0053 91.8897 98.9400
1016 CA ALA 132 0.0060 92.0689 98.8100
1021 CA ALA 133 0.0081 92.6799 98.8100
1026 CA TYR 134 0.0096 93.0896 98.8800
1038 CA TYR 135 0.0083 92.7240 98.8800
1050 CA PRO 136 0.0106 93.3922 98.6200
1057 CA GLN 137 0.0252 97.5170 98.4400
1066 CA GLN 138 0.0092 92.9888 98.8100
1075 CA PHE 139 0.0061 92.1105 98.8800
1086 CA PRO 140 0.0074 92.4695 98.7500
1093 CA TYR 141 0.0051 91.8139 98.8800
1105 CA ALA 142 0.0050 91.8078 98.9400
1110 CA ALA 143 0.0039 91.4750 98.8800
1115 CA SER 144 0.0036 91.4094 98.8100
1121 CA LEU 145 0.0040 91.5017 98.5600
1129 CA SER 146 0.0042 91.5768 97.0600
1135 CA GLY 147 0.0052 91.8426 95.0600
1139 CA PHE 148 0.0053 91.8759 88.0000
1150 CA LEU 149 0.0063 92.1660 96.2500
1158 CA ASN 150 0.0077 92.5615 95.4400
1166 CA PRO 151 0.0087 92.8565 95.5000
1173 CA SER 152 0.0107 93.4216 96.6200
1179 CA GLU 153 0.0260 97.7661 92.7500
1188 CA SER 154 0.0477 103.9016 88.8800
1194 CA TRP 155 0.0377 101.0605 87.3100
1208 CA TRP 156 0.0157 94.8276 90.9400
1222 CA PRO 157 0.0162 94.9772 94.6900
1229 CA THR 158 0.0264 97.8785 92.1900
1236 CA LEU 159 0.0216 96.5107 90.3100
1244 CA ILE 160 0.0148 94.5826 94.0000
1252 CA GLY 161 0.0314 99.2745 94.9400
1256 CA LEU 162 0.0379 101.1205 92.8100
1264 CA ALA 163 0.0240 97.1782 92.0600
1269 CA MET 164 0.0141 94.3724 95.5000
1277 CA ASN 165 0.0260 97.7519 95.1900
1285 CA ASP 166 0.0443 102.9449 93.0600
1293 CA SER 167 0.0224 96.7383 93.1900
1299 CA GLY 168 0.0243 97.2819 94.8100
1303 CA GLY 169 0.0226 96.7778 96.1900
1307 CA TYR 170 0.0145 94.5023 97.1200
1319 CA ASN 171 0.0140 94.3513 96.4400
1327 CA ALA 172 0.0119 93.7633 96.5000
1332 CA ASN 173 0.0173 95.2826 97.1900
1340 CA SER 174 0.0127 93.9791 98.2500
1346 CA MET 175 0.0077 92.5734 98.3100
1354 CA TRP 176 0.0084 92.7577 98.4400
1368 CA GLY 177 0.0213 96.4272 97.8800
1372 CA PRO 178 0.0383 101.2585 96.9400
1379 CA SER 179 0.0322 99.4999 95.6200
1385 CA SER 180 0.0548 105.9117 96.3800
1391 CA ASP 181 0.0279 98.2927 98.4400
1399 CA PRO 182 0.0313 99.2471 98.3100
1406 CA ALA 183 0.0122 93.8418 98.5000
1411 CA TRP 184 0.0096 93.0961 98.3800
1425 CA LYS 185 0.0122 93.8508 98.4400
1434 CA ARG 186 0.0089 92.8936 98.5000
1445 CA ASN 187 0.0061 92.1170 98.5600
1453 CA ASP 188 0.0069 92.3262 98.5000
1461 CA PRO 189 0.0068 92.3175 98.5600
1468 CA MET 190 0.0072 92.4090 98.3800
1476 CA VAL 191 0.0104 93.3405 98.6200
1483 CA GLN 192 0.0095 93.0779 98.8100
1492 CA ILE 193 0.0115 93.6377 98.8100
1500 CA PRO 194 0.0155 94.7860 98.7500
1507 CA ARG 195 0.0135 94.2210 98.7500
1518 CA LEU 196 0.0095 93.0612 98.8800
1526 CA VAL 197 0.0157 94.8396 98.8100
1533 CA ALA 198 0.0264 97.8561 98.7500
1538 CA ASN 199 0.0171 95.2252 98.6200
1546 CA ASN 200 0.0191 95.8099 98.5000
1554 CA THR 201 0.0089 92.8942 98.5000
1561 CA ARG 202 0.0077 92.5608 98.8100
1572 CA ILE 203 0.0059 92.0655 98.8100
1580 CA TRP 204 0.0054 91.9100 98.8800
1594 CA VAL 205 0.0056 91.9703 98.7500
1601 CA TYR 206 0.0047 91.7045 98.4400
1613 CA CYS 207 0.0070 92.3543 96.3100
1619 CA GLY 208 0.0087 92.8604 92.1900
1623 CA ASN 209 0.0171 95.2412 87.4400
1631 CA GLY 210 0.0172 95.2716 82.8100
1635 CA THR 211 0.0279 98.2802 81.6200
1642 CA PRO 212 0.0266 97.9230 76.1900
1649 CA SER 213 0.0489 104.2613 82.5600
1655 CA ASP 214 0.1112 121.9325 78.6200
1663 CA LEU 215 0.0393 101.5360 70.0000
1671 CA GLY 216 0.0396 101.6171 80.8100
1675 CA GLY 217 0.0335 99.8898 74.5600
1679 CA ASP 218 0.0509 104.8050 78.7500
1687 CA ASN 219 0.0733 111.1707 81.3100
1695 CA ILE 220 0.0806 113.2306 68.9400
1703 CA PRO 221 0.0621 108.0015 77.1200
1710 CA ALA 222 0.0292 98.6617 70.7500
1715 CA LYS 223 0.0252 97.5228 74.8800
1724 CA PHE 224 0.0371 100.9162 73.5000
1735 CA LEU 225 0.0203 96.1311 77.2500
1743 CA GLU 226 0.0113 93.5883 80.5600
1752 CA GLY 227 0.0179 95.4486 70.7500
1756 CA LEU 228 0.0228 96.8376 76.0000
1764 CA THR 229 0.0093 93.0278 84.8100
1771 CA LEU 230 0.0096 93.0941 89.3800
1779 CA ARG 231 0.0239 97.1550 89.5600
1790 CA THR 232 0.0119 93.7510 92.7500
1797 CA ASN 233 0.0077 92.5711 97.3100
1805 CA GLN 234 0.0117 93.7120 97.1900
1814 CA THR 235 0.0134 94.1923 97.0000
1821 CA PHE 236 0.0090 92.9226 98.4400
1832 CA ARG 237 0.0121 93.8205 98.6200
1843 CA ASP 238 0.0195 95.9235 98.5000
1851 CA THR 239 0.0166 95.0801 98.5600
1858 CA TYR 240 0.0117 93.6909 98.8100
1870 CA ALA 241 0.0274 98.1518 98.6200
1875 CA ALA 242 0.0502 104.6292 98.5600
1880 CA ASP 243 0.0311 99.2140 98.4400
1888 CA GLY 244 0.0376 101.0417 98.5000
1892 CA GLY 245 0.0270 98.0326 98.6200
1896 CA ARG 246 0.0393 101.5232 98.5000
1907 CA ASN 247 0.0139 94.3095 98.5600
1915 CA GLY 248 0.0127 93.9773 98.3800
1919 CA VAL 249 0.0094 93.0544 98.5600
1926 CA PHE 250 0.0091 92.9488 98.5000
1937 CA ASN 251 0.0094 93.0341 98.0600
1945 CA PHE 252 0.0103 93.3092 97.0600
1956 CA PRO 253 0.0297 98.8156 94.5600
1963 CA PRO 254 0.0492 104.3445 91.1900
1970 CA ASN 255 0.0220 96.6088 89.9400
1978 CA GLY 256 0.0133 94.1629 91.0000
1982 CA THR 257 0.0105 93.3653 91.8100
1989 CA HIS 258 0.0094 93.0375 92.8800
1999 CA SER 259 0.0110 93.4868 94.5000
2005 CA TRP 260 0.0078 92.6004 96.1200
2019 CA PRO 261 0.0138 94.2973 96.8100
2026 CA TYR 262 0.0097 93.1325 96.9400
2038 CA TRP 263 0.0064 92.1884 98.0600
2052 CA ASN 264 0.0075 92.5150 98.4400
2060 CA GLU 265 0.0100 93.2290 97.8800
2069 CA GLN 266 0.0077 92.5643 98.5600
2078 CA LEU 267 0.0074 92.4747 98.6900
2086 CA VAL 268 0.0092 92.9766 98.5000
2093 CA ALA 269 0.0103 93.3109 98.4400
2098 CA MET 270 0.0082 92.6971 98.6200
2106 CA LYS 271 0.0111 93.5293 98.5000
2115 CA ALA 272 0.0149 94.6089 98.1200
2120 CA ASP 273 0.0105 93.3704 98.5600
2128 CA ILE 274 0.0089 92.8939 98.6900
2136 CA GLN 275 0.0154 94.7483 98.1900
2145 CA HIS 276 0.0272 98.1073 97.7500
2155 CA VAL 277 0.0146 94.5123 98.0000
2162 CA LEU 278 0.0135 94.2048 97.6200
2170 CA ASN 279 0.0335 99.8800 89.1200
2178 CA GLY 280 0.1018 119.2446 78.3800

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.