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

* EXP_1AOL_unrelaxed_rank_001_alphafold2_ptm_model_2_seed_000 *

B-factor analysis for ID 24021912362632576

Overall B-factor prediction

Correlation= -0.532 for 228 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 1 0.0890 93.5010 78.1900
11 CA VAL 2 0.0524 92.1049 88.1900
18 CA TYR 3 0.0314 91.3063 91.3800
30 CA ASN 4 0.0324 91.3447 93.4400
38 CA ILE 5 0.0175 90.7765 93.5000
46 CA THR 6 0.0172 90.7644 95.5600
53 CA TRP 7 0.0107 90.5176 96.9400
67 CA GLU 8 0.0121 90.5682 98.1200
76 CA VAL 9 0.0105 90.5086 98.6200
83 CA THR 10 0.0106 90.5135 98.5000
90 CA ASN 11 0.0109 90.5218 97.6900
98 CA GLY 12 0.0153 90.6911 95.2500
102 CA ASP 13 0.0289 91.2105 95.1900
110 CA ARG 14 0.0218 90.9376 96.2500
121 CA GLU 15 0.0185 90.8152 97.0600
130 CA THR 16 0.0170 90.7556 98.1200
137 CA VAL 17 0.0136 90.6269 98.1200
144 CA TRP 18 0.0132 90.6097 98.3800
158 CA ALA 19 0.0174 90.7700 97.6900
163 CA ILE 20 0.0180 90.7945 96.6200
171 CA SER 21 0.0279 91.1704 95.3100
177 CA GLY 22 0.0316 91.3112 93.1900
181 CA ASN 23 0.0383 91.5687 93.5000
189 CA HIS 24 0.0323 91.3395 89.6900
199 CA PRO 25 0.0379 91.5531 89.0000
206 CA LEU 26 0.0339 91.4002 83.0000
214 CA TRP 27 0.0307 91.2771 81.5600
228 CA THR 28 0.0301 91.2564 85.6900
235 CA TRP 29 0.0191 90.8380 85.2500
249 CA TRP 30 0.0209 90.9054 83.1900
263 CA PRO 31 0.0188 90.8244 88.2500
270 CA VAL 32 0.0168 90.7480 96.7500
277 CA LEU 33 0.0118 90.5594 98.3100
285 CA THR 34 0.0139 90.6366 98.2500
292 CA PRO 35 0.0112 90.5349 98.1900
299 CA ASP 36 0.0091 90.4542 98.1200
307 CA LEU 37 0.0070 90.3752 97.7500
315 CA CYS 38 0.0066 90.3609 97.3100
321 CA MET 39 0.0084 90.4270 97.7500
329 CA LEU 40 0.0078 90.4054 98.0600
337 CA ALA 41 0.0101 90.4931 96.6900
342 CA LEU 42 0.0120 90.5662 96.4400
350 CA SER 43 0.0195 90.8510 92.4400
356 CA GLY 44 0.0190 90.8310 88.6900
360 CA PRO 45 0.0270 91.1381 89.3800
367 CA PRO 46 0.0293 91.2250 90.3100
374 CA HIS 47 0.0153 90.6922 90.7500
384 CA TRP 48 0.0101 90.4948 93.1900
398 CA GLY 49 0.0139 90.6366 91.8100
402 CA LEU 50 0.0134 90.6192 94.4400
410 CA GLU 51 0.0312 91.2982 92.8800
419 CA TYR 52 0.0564 92.2581 92.4400
431 CA GLN 53 0.0248 91.0518 95.1200
440 CA ALA 54 0.0303 91.2630 95.1200
445 CA PRO 55 0.0230 90.9867 95.2500
452 CA TYR 56 0.0303 91.2613 94.3100
464 CA SER 57 0.0276 91.1615 94.9400
470 CA SER 58 0.0388 91.5856 94.5000
476 CA PRO 59 0.0185 90.8117 93.9400
483 CA PRO 60 0.0192 90.8390 90.6900
490 CA GLY 61 0.0276 91.1619 83.0600
494 CA PRO 62 0.0331 91.3715 79.1900
501 CA PRO 63 0.0254 91.0772 79.5600
508 CA CYS 64 0.0300 91.2511 82.1200
514 CA CYS 65 0.0351 91.4462 84.1900
520 CA SER 66 0.0569 92.2770 83.7500
526 CA GLY 67 0.0781 93.0837 80.2500
530 CA SER 68 0.1357 95.2794 73.1900
536 CA SER 69 0.2545 99.8050 76.8100
542 CA GLY 70 0.1602 96.2138 74.6200
546 CA SER 71 0.1700 96.5856 74.3100
552 CA SER 72 0.1205 94.6985 83.6200
558 CA ALA 73 0.1730 96.6995 81.0000
563 CA GLY 74 0.0874 93.4399 78.8800
567 CA CYS 75 0.0361 91.4835 83.9400
573 CA SER 76 0.0243 91.0341 84.0000
579 CA ARG 77 0.0421 91.7129 82.8800
590 CA ASP 78 0.0328 91.3600 80.3100
598 CA CYS 79 0.0322 91.3365 82.6200
604 CA ASP 80 0.0681 92.7048 82.0000
612 CA GLU 81 0.0519 92.0847 83.4400
621 CA PRO 82 0.0526 92.1113 84.1200
628 CA LEU 83 0.0160 90.7167 88.2500
636 CA THR 84 0.0192 90.8394 86.6200
643 CA SER 85 0.0221 90.9494 82.1200
649 CA LEU 86 0.0311 91.2923 81.3100
657 CA THR 87 0.0164 90.7324 81.8100
664 CA PRO 88 0.0109 90.5219 79.8800
671 CA ARG 89 0.0086 90.4353 86.5000
682 CA CYS 90 0.0079 90.4105 93.0600
688 CA ASN 91 0.0124 90.5798 89.5000
696 CA THR 92 0.0116 90.5491 90.8100
703 CA ALA 93 0.0130 90.6039 91.3800
708 CA TRP 94 0.0113 90.5406 90.3100
722 CA ASN 95 0.0074 90.3919 91.6200
730 CA ARG 96 0.0075 90.3938 93.5600
741 CA LEU 97 0.0095 90.4704 91.9400
749 CA LYS 98 0.0094 90.4680 91.6900
758 CA LEU 99 0.0070 90.3764 94.5000
766 CA ASP 100 0.0082 90.4226 94.5000
774 CA GLN 101 0.0114 90.5440 92.5600
783 CA VAL 102 0.0109 90.5235 94.1200
790 CA THR 103 0.0101 90.4938 95.5600
797 CA HIS 104 0.0139 90.6382 93.9400
807 CA LYS 105 0.0270 91.1353 91.6900
816 CA SER 106 0.0383 91.5664 82.3800
822 CA SER 107 0.0331 91.3714 89.5600
828 CA GLU 108 0.0155 90.6995 93.6900
837 CA GLY 109 0.0082 90.4198 96.0600
841 CA PHE 110 0.0070 90.3736 97.6900
852 CA TYR 111 0.0065 90.3549 98.1200
864 CA VAL 112 0.0061 90.3426 98.6200
871 CA CYS 113 0.0064 90.3533 98.2500
877 CA PRO 114 0.0073 90.3871 97.6900
884 CA GLY 115 0.0106 90.5112 96.3800
888 CA SER 116 0.0170 90.7543 91.1200
894 CA HIS 117 0.0177 90.7846 92.7500
904 CA ARG 118 0.0168 90.7497 90.2500
915 CA PRO 119 0.0644 92.5624 86.5600
922 CA ARG 120 0.0948 93.7192 81.4400
933 CA GLU 121 0.0968 93.7978 79.5000
942 CA ALA 122 0.0465 91.8822 83.5000
947 CA LYS 123 0.0579 92.3136 80.5600
956 CA SER 124 0.0541 92.1706 92.3800
962 CA CYS 125 0.0194 90.8481 94.7500
968 CA GLY 126 0.0249 91.0566 94.5600
972 CA GLY 127 0.0273 91.1479 95.5000
976 CA PRO 128 0.0279 91.1717 95.0000
983 CA ASP 129 0.0684 92.7151 94.6900
991 CA SER 130 0.0248 91.0524 95.5000
997 CA PHE 131 0.0096 90.4734 96.6900
1008 CA TYR 132 0.0095 90.4720 97.3100
1020 CA CYS 133 0.0108 90.5180 96.7500
1026 CA ALA 134 0.0214 90.9240 95.9400
1031 CA SER 135 0.0307 91.2800 94.4400
1037 CA TRP 136 0.0280 91.1754 94.3100
1051 CA GLY 137 0.0266 91.1202 93.8800
1055 CA CYS 138 0.0139 90.6372 96.0600
1061 CA GLU 139 0.0086 90.4358 97.3100
1070 CA THR 140 0.0099 90.4858 97.9400
1077 CA THR 141 0.0092 90.4582 98.5000
1084 CA GLY 142 0.0096 90.4724 97.2500
1088 CA ARG 143 0.0114 90.5435 95.8100
1099 CA VAL 144 0.0122 90.5738 95.6200
1106 CA TYR 145 0.0300 91.2521 95.1900
1118 CA TRP 146 0.0302 91.2604 95.1200
1132 CA LYS 147 0.0292 91.2226 96.2500
1141 CA PRO 148 0.0237 91.0110 96.3100
1148 CA SER 149 0.0502 92.0217 96.5000
1154 CA SER 150 0.0263 91.1092 95.1200
1160 CA SER 151 0.0462 91.8674 94.8100
1166 CA TRP 152 0.0261 91.1023 95.1900
1180 CA ASP 153 0.0108 90.5181 97.5000
1188 CA TYR 154 0.0105 90.5101 97.8800
1200 CA ILE 155 0.0093 90.4628 98.4400
1208 CA THR 156 0.0108 90.5202 98.5600
1215 CA VAL 157 0.0105 90.5081 98.6200
1222 CA ASP 158 0.0118 90.5597 97.9400
1230 CA ASN 159 0.0129 90.5999 97.6200
1238 CA ASN 160 0.0173 90.7691 97.3800
1246 CA LEU 161 0.0252 91.0679 95.8800
1254 CA THR 162 0.0341 91.4093 94.6200
1261 CA THR 163 0.0288 91.2072 90.5000
1268 CA SER 164 0.0438 91.7766 93.1900
1274 CA GLN 165 0.0379 91.5538 96.0600
1283 CA ALA 166 0.0200 90.8720 94.0000
1288 CA VAL 167 0.0275 91.1543 92.1900
1295 CA GLN 168 0.0400 91.6329 92.8800
1304 CA VAL 169 0.0253 91.0738 95.0000
1311 CA CYS 170 0.0168 90.7475 92.3800
1317 CA LYS 171 0.0315 91.3086 89.7500
1326 CA ASP 172 0.0402 91.6400 91.9400
1334 CA ASN 173 0.0213 90.9187 92.3100
1342 CA LYS 174 0.0239 91.0201 94.8100
1351 CA TRP 175 0.0124 90.5822 96.0600
1365 CA CYS 176 0.0121 90.5707 95.9400
1371 CA ASN 177 0.0084 90.4285 97.2500
1379 CA PRO 178 0.0116 90.5498 98.0600
1386 CA LEU 179 0.0098 90.4834 98.6200
1394 CA ALA 180 0.0114 90.5415 98.3800
1399 CA ILE 181 0.0108 90.5216 98.6900
1407 CA GLN 182 0.0142 90.6476 98.1900
1416 CA PHE 183 0.0129 90.5990 97.7500
1427 CA THR 184 0.0164 90.7336 97.5000
1434 CA ASN 185 0.0471 91.9027 96.1900
1442 CA ALA 186 0.0301 91.2536 96.0600
1447 CA GLY 187 0.0158 90.7100 95.9400
1451 CA LYS 188 0.0192 90.8393 95.3800
1460 CA GLN 189 0.0375 91.5373 94.0000
1469 CA VAL 190 0.0234 90.9992 93.3100
1476 CA THR 191 0.0347 91.4309 91.6200
1483 CA SER 192 0.0256 91.0855 94.5600
1489 CA TRP 193 0.0127 90.5939 95.0600
1503 CA THR 194 0.0189 90.8299 94.7500
1510 CA THR 195 0.0318 91.3190 95.1900
1517 CA GLY 196 0.0136 90.6261 96.3800
1521 CA HIS 197 0.0094 90.4677 98.1200
1531 CA TYR 198 0.0092 90.4588 98.2500
1543 CA TRP 199 0.0059 90.3344 98.6900
1557 CA GLY 200 0.0066 90.3596 98.3800
1561 CA LEU 201 0.0060 90.3383 98.4400
1569 CA ARG 202 0.0064 90.3535 97.5600
1580 CA LEU 203 0.0076 90.3978 97.2500
1588 CA TYR 204 0.0098 90.4820 95.9400
1600 CA VAL 205 0.0178 90.7855 93.6200
1607 CA SER 206 0.0406 91.6551 88.5000
1613 CA GLY 207 0.0734 92.9043 88.8800
1617 CA ARG 208 0.0395 91.6143 90.9400
1628 CA ASP 209 0.0121 90.5687 94.9400
1636 CA PRO 210 0.0117 90.5542 95.3100
1643 CA GLY 211 0.0081 90.4164 95.7500
1647 CA LEU 212 0.0073 90.3864 97.0600
1655 CA THR 213 0.0080 90.4138 98.2500
1662 CA PHE 214 0.0077 90.4033 98.6900
1673 CA GLY 215 0.0083 90.4261 98.5000
1677 CA ILE 216 0.0081 90.4160 98.5000
1685 CA ARG 217 0.0106 90.5124 97.2500
1696 CA LEU 218 0.0110 90.5271 95.8100
1704 CA ARG 219 0.0181 90.7986 94.8100
1715 CA TYR 220 0.0246 91.0459 92.9400
1727 CA GLN 221 0.0576 92.3036 91.6900
1736 CA ASN 222 0.0616 92.4561 86.7500
1744 CA LEU 223 0.0832 93.2785 82.3100
1752 CA GLY 224 0.1372 95.3360 72.3800
1756 CA PRO 225 0.2931 101.2757 68.1200
1763 CA ARG 226 0.3125 102.0168 60.4100
1774 CA VAL 227 1.0875 131.5507 55.7200
1781 CA PRO 228 2.6735 191.9884 58.6200

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.