###################### # Order parameters # ###################### save_order_parameters_1 _Order_parameter_list.Sf_category order_parameters _Order_parameter_list.Sf_framecode order_parameters_1 _Order_parameter_list.Entry_ID 51413 _Order_parameter_list.ID 1 _Order_parameter_list.Name 'BRD4 15N-S2' _Order_parameter_list.Sample_condition_list_ID 1 _Order_parameter_list.Sample_condition_list_label $sample_conditions_1 _Order_parameter_list.Tau_e_val_units ns _Order_parameter_list.Tau_f_val_units ns _Order_parameter_list.Tau_s_val_units ns _Order_parameter_list.Rex_field_strength . _Order_parameter_list.Rex_val_units . _Order_parameter_list.Details 'Standard relax MF suite' _Order_parameter_list.Text_data_format . _Order_parameter_list.Text_data . loop_ _Order_parameter_software.Software_ID _Order_parameter_software.Software_label _Order_parameter_software.Method_ID _Order_parameter_software.Method_label _Order_parameter_software.Entry_ID _Order_parameter_software.Order_parameter_list_ID 3 $software_3 . . 51413 1 stop_ loop_ _Order_param.ID _Order_param.Assembly_atom_ID _Order_param.Entity_assembly_ID _Order_param.Entity_ID _Order_param.Comp_index_ID _Order_param.Seq_ID _Order_param.Comp_ID _Order_param.Atom_ID _Order_param.Atom_type _Order_param.Atom_isotope_number _Order_param.Order_param_val _Order_param.Order_param_val_fit_err _Order_param.Tau_e_val _Order_param.Tau_e_val_fit_err _Order_param.Tau_f_val _Order_param.Tau_f_val_fit_err _Order_param.Tau_s_val _Order_param.Tau_s_val_fit_err _Order_param.Rex_val _Order_param.Rex_val_fit_err _Order_param.Model_free_sum_squared_errs _Order_param.Model_fit _Order_param.Sf2_val _Order_param.Sf2_val_fit_err _Order_param.Ss2_val _Order_param.Ss2_val_fit_err _Order_param.SH2_val _Order_param.SH2_val_fit_err _Order_param.SN2_val _Order_param.SN2_val_fit_err _Order_param.Resonance_ID _Order_param.Auth_entity_assembly_ID _Order_param.Auth_seq_ID _Order_param.Auth_comp_ID _Order_param.Auth_atom_ID _Order_param.Entry_ID _Order_param.Order_parameter_list_ID 1 . 1 1 291 291 ASP N N 15 0.053142 0.001338 . . 3.3247e-11 6.0176e-12 3.3247e-11 6.0176e-12 . . 0.60761 0.020024 0.08746 0.0033478 . . . . . . . . 334 ASP N 51413 1 2 . 1 1 292 292 VAL N N 15 0.068503 0.00060781 . . 2.6697e-11 1.7855e-12 2.6697e-11 1.7855e-12 . . 0.49465 0.0074615 0.13849 0.0019991 . . . . . . . . 335 VAL N 51413 1 3 . 1 1 294 294 ASP N N 15 0.045733 0.0008261 . . 5.4884e-11 2.2032e-12 5.4884e-11 2.2032e-12 . . 0.47036 0.010707 0.097231 0.0020739 . . . . . . . . 337 ASP N 51413 1 4 . 1 1 295 295 SER N N 15 0.052795 0.0022632 . . 3.6756e-11 5.3408e-12 3.6756e-11 5.3408e-12 . . 0.51056 0.024031 0.10341 0.0056883 . . . . . . . . 338 SER N 51413 1 5 . 1 1 296 296 GLN N N 15 0.12757 0.001623 . . . . . . . . 0.48022 0.0051237 0.26565 0.0041363 . . . . . . . . 339 GLN N 51413 1 6 . 1 1 300 300 ALA N N 15 0.096807 0.001369 . . 4.4132e-11 2.7652e-12 4.4132e-11 2.7652e-12 . . 0.48628 0.013095 0.19908 0.0048841 . . . . . . . . 343 ALA N 51413 1 7 . 1 1 302 302 GLU N N 15 0.13361 0.0015434 . . 3.4213e-11 2.9144e-12 3.4213e-11 2.9144e-12 . . 0.52286 0.013012 0.25554 0.005412 . . . . . . . . 345 GLU N 51413 1 8 . 1 1 304 304 SER N N 15 0.12677 0.038098 . . . . . . . . 0.58453 0.036054 0.21688 0.055681 . . . . . . . . 347 SER N 51413 1 9 . 1 1 307 307 VAL N N 15 0.87328 0.0090755 7.1131e-10 4.9817e-11 . . . . . . . . . . . . . . . . . . 350 VAL N 51413 1 10 . 1 1 308 308 SER N N 15 0.91338 0.015534 1.249e-09 1.1395e-09 . . . . . . . . . . . . . . . . . . 351 SER N 51413 1 11 . 1 1 309 309 GLU N N 15 0.93082 0.052901 . . . . . . . . . . . . . . . . . . . . 352 GLU N 51413 1 12 . 1 1 310 310 GLN N N 15 0.97693 0.028297 1.3228e-10 6.862e-10 . . . . . . . . . . . . . . . . . . 353 GLN N 51413 1 13 . 1 1 312 312 LYS N N 15 0.97186 0.023908 4.7146e-11 5.3324e-10 . . . . . . . . . . . . . . . . . . 355 LYS N 51413 1 14 . 1 1 315 315 SER N N 15 0.95224 0.010794 1.0482e-09 4.1077e-10 . . . . . . . . . . . . . . . . . . 358 SER N 51413 1 15 . 1 1 316 316 GLY N N 15 0.95639 0.032581 . . . . . . . . . . . . . . . . . . . . 359 GLY N 51413 1 16 . 1 1 317 317 ILE N N 15 0.25987 0.034751 . . . . . . . . . . . . . . . . . . . . 360 ILE N 51413 1 17 . 1 1 320 320 GLU N N 15 0.97813 0.024479 . . . . . . . . . . . . . . . . . . . . 363 GLU N 51413 1 18 . 1 1 321 321 MET N N 15 0.9906 0.031532 . . . . . . . . . . . . . . . . . . . . 364 MET N 51413 1 19 . 1 1 322 322 PHE N N 15 0.95273 0.031467 . . . . . . . . . . . . . . . . . . . . 365 PHE N 51413 1 20 . 1 1 327 327 ALA N N 15 1 0.017554 . . . . . . . . . . . . . . . . . . . . 370 ALA N 51413 1 21 . 1 1 328 328 ALA N N 15 0.90635 0.037854 . . . . . . . . . . . . . . . . . . . . 371 ALA N 51413 1 22 . 1 1 329 329 TYR N N 15 0.95592 0.046906 5.4067e-10 4.5779e-10 . . . . . . . . . . . . . . . . . . 372 TYR N 51413 1 23 . 1 1 331 331 TRP N N 15 0.99758 0.013198 . . . . . . . . . . . . . . . . . . . . 374 TRP N 51413 1 24 . 1 1 334 334 TYR N N 15 0.92685 0.030147 . . . . . . . . . . . . . . . . . . . . 377 TYR N 51413 1 25 . 1 1 335 335 LYS N N 15 0.99626 0.010638 . . . . . . . . . . . . . . . . . . . . 378 LYS N 51413 1 26 . 1 1 337 337 VAL N N 15 0.85437 0.01467 . . . . . . . . . . . . . . . . . . . . 380 VAL N 51413 1 27 . 1 1 338 338 ASP N N 15 0.96628 0.0063554 8.2537e-10 1.871e-10 . . . . . . . . . . . . . . . . . . 381 ASP N 51413 1 28 . 1 1 339 339 VAL N N 15 0.89583 0.040625 . . . . . . . . 0.92919 0.040074 0.9641 0.01455 . . . . . . . . 382 VAL N 51413 1 29 . 1 1 341 341 ALA N N 15 0.80811 0.023641 1.0096e-11 3.7081e-12 . . . . . . . . . . . . . . . . . . 384 ALA N 51413 1 30 . 1 1 346 346 ASP N N 15 0.85444 0.014075 . . . . . . . . . . . . . . . . . . . . 389 ASP N 51413 1 31 . 1 1 348 348 CYS N N 15 0.76615 0.020924 4.4006e-12 2.8876e-12 . . . . . . . . . . . . . . . . . . 391 CYS N 51413 1 32 . 1 1 349 349 ASP N N 15 0.86235 0.031655 1.9657e-11 8.1354e-12 . . . . . . . . . . . . . . . . . . 392 ASP N 51413 1 33 . 1 1 350 350 ILE N N 15 0.83481 0.032227 . . . . . . . . . . . . . . . . . . . . 393 ILE N 51413 1 34 . 1 1 356 356 ASP N N 15 0.97577 0.012823 3.0932e-11 1.62e-10 . . . . . . . . . . . . . . . . . . 399 ASP N 51413 1 35 . 1 1 357 357 MET N N 15 0.90503 0.028047 . . . . . . . . . . . . . . . . . . . . 400 MET N 51413 1 36 . 1 1 358 358 SER N N 15 0.92227 0.027588 . . . . . . . . . . . . . . . . . . . . 401 SER N 51413 1 37 . 1 1 360 360 ILE N N 15 0.91597 0.037669 . . . . . . . . . . . . . . . . . . . . 403 ILE N 51413 1 38 . 1 1 361 361 LYS N N 15 0.82958 0.040182 . . . . . . . . . . . . . . . . . . . . 404 LYS N 51413 1 39 . 1 1 362 362 SER N N 15 0.81843 0.022316 . . . . . . . . 0.86971 0.018749 0.94104 0.010458 . . . . . . . . 405 SER N 51413 1 40 . 1 1 364 364 LEU N N 15 0.98997 0.015243 4.455e-10 1.3045e-09 . . . . . . . . . . . . . . . . . . 407 LEU N 51413 1 41 . 1 1 365 365 GLU N N 15 0.96721 0.01861 . . . . . . . . . . . . . . . . . . . . 408 GLU N 51413 1 42 . 1 1 366 366 ALA N N 15 0.97093 0.01581 1.2527e-09 2.3319e-09 . . . . . . . . . . . . . . . . . . 409 ALA N 51413 1 43 . 1 1 367 367 ARG N N 15 0.95647 0.015585 2.042e-09 2.0452e-09 . . . . . . . . . . . . . . . . . . 410 ARG N 51413 1 44 . 1 1 369 369 TYR N N 15 0.90026 0.012519 2.334e-11 6.6336e-12 . . . . . . . . . . . . . . . . . . 412 TYR N 51413 1 45 . 1 1 370 370 ARG N N 15 0.95685 0.018021 3.3601e-11 1.0865e-10 . . . . . . . . . . . . . . . . . . 413 ARG N 51413 1 46 . 1 1 371 371 ASP N N 15 0.40343 0.17405 . . . . . . . . 0.53796 0.11853 0.74992 0.19941 . . . . . . . . 414 ASP N 51413 1 47 . 1 1 372 372 ALA N N 15 0.89056 0.021926 . . . . . . . . . . . . . . . . . . . . 415 ALA N 51413 1 48 . 1 1 373 373 GLN N N 15 0.97303 0.018654 2.1492e-10 1.9796e-10 . . . . . . . . . . . . . . . . . . 416 GLN N 51413 1 49 . 1 1 374 374 GLU N N 15 0.94238 0.016707 1.1394e-09 8.1053e-10 . . . . . . . . . . . . . . . . . . 417 GLU N 51413 1 50 . 1 1 375 375 PHE N N 15 0.92379 0.051706 . . . . . . . . . . . . . . . . . . . . 418 PHE N 51413 1 51 . 1 1 376 376 GLY N N 15 0.88681 0.048998 . . . . . . . . . . . . . . . . . . . . 419 GLY N 51413 1 52 . 1 1 377 377 ALA N N 15 0.022605 0.0049299 . . . . . . . . 0.61687 0.042928 0.036645 0.0084537 . . . . . . . . 420 ALA N 51413 1 53 . 1 1 378 378 ASP N N 15 0.92686 0.045776 . . . . . . . . . . . . . . . . . . . . 421 ASP N 51413 1 54 . 1 1 379 379 VAL N N 15 0.88509 0.04375 . . . . . . . . . . . . . . . . . . . . 422 VAL N 51413 1 55 . 1 1 380 380 ARG N N 15 0.90957 0.040953 . . . . . . . . . . . . . . . . . . . . 423 ARG N 51413 1 56 . 1 1 382 382 MET N N 15 0.93796 0.040123 . . . . . . . . . . . . . . . . . . . . 425 MET N 51413 1 57 . 1 1 383 383 PHE N N 15 0.90647 0.06197 . . . . . . . . . . . . . . . . . . . . 426 PHE N 51413 1 58 . 1 1 386 386 CYS N N 15 0.88245 0.036863 . . . . . . . . . . . . . . . . . . . . 429 CYS N 51413 1 59 . 1 1 393 393 ASP N N 15 0.953 0.029501 . . . . . . . . . . . . . . . . . . . . 436 ASP N 51413 1 60 . 1 1 394 394 HIS N N 15 0.049178 0.014486 . . . . . . . . 0.55967 0.053805 0.087871 0.026253 . . . . . . . . 437 HIS N 51413 1 61 . 1 1 395 395 GLU N N 15 0.82116 0.036606 . . . . . . . . . . . . . . . . . . . . 438 GLU N 51413 1 62 . 1 1 397 397 VAL N N 15 0.93247 0.035388 . . . . . . . . . . . . . . . . . . . . 440 VAL N 51413 1 63 . 1 1 398 398 ALA N N 15 0.7403 0.040947 . . . . . . . . . . . . . . . . . . . . 441 ALA N 51413 1 64 . 1 1 402 402 LYS N N 15 0.6868 0.045609 . . . . . . . . . . . . . . . . . . . . 445 LYS N 51413 1 65 . 1 1 404 404 GLN N N 15 1 0.049782 . . . . . . . . . . . . . . . . . . . . 447 GLN N 51413 1 66 . 1 1 407 407 PHE N N 15 0.94183 0.032483 . . . . . . . . . . . . . . . . . . . . 450 PHE N 51413 1 67 . 1 1 408 408 GLU N N 15 0.86785 0.073698 . . . . . . . . . . . . . . . . . . . . 451 GLU N 51413 1 68 . 1 1 410 410 ARG N N 15 0.94471 0.052882 . . . . . . . . . . . . . . . . . . . . 453 ARG N 51413 1 69 . 1 1 411 411 PHE N N 15 0.91598 0.068938 . . . . . . . . . . . . . . . . . . . . 454 PHE N 51413 1 70 . 1 1 412 412 ALA N N 15 0.9786 0.015178 3.0247e-10 2.7186e-10 . . . . . . . . . . . . . . . . . . 455 ALA N 51413 1 71 . 1 1 417 417 GLU N N 15 0.15101 0.0018417 . . 4.0768e-11 3.5467e-12 4.0768e-11 3.5467e-12 . . 0.51748 0.014577 0.29181 0.0070756 . . . . . . . . 460 GLU N 51413 1 stop_ save_