############################## # Heteronuclear NOE values # ############################## save_WT_TDP-43_267-414_850_MHz_HetNOE _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode WT_TDP-43_267-414_850_MHz_HetNOE _Heteronucl_NOE_list.Entry_ID 26823 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $283_K _Heteronucl_NOE_list.Spectrometer_frequency_1H 850 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'relative intensities' _Heteronucl_NOE_list.NOE_ref_val 0 _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 12 hsqcnoef3gpsi . . . 26823 1 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 4 4 ASN N N 15 . 1 1 4 4 ASN H H 1 0.188852 0.0758604 . . . 267 ASN N . 267 ASN H 26823 1 2 . 1 1 6 6 GLN N N 15 . 1 1 6 6 GLN H H 1 0.514044 0.0601132 . . . 269 GLN N . 269 GLN H 26823 1 3 . 1 1 7 7 LEU N N 15 . 1 1 7 7 LEU H H 1 0.575106 0.0692789 . . . 270 LEU N . 270 LEU H 26823 1 4 . 1 1 8 8 GLU N N 15 . 1 1 8 8 GLU H H 1 0.394885 0.0605043 . . . 271 GLU N . 271 GLU H 26823 1 5 . 1 1 9 9 ARG N N 15 . 1 1 9 9 ARG H H 1 0.483474 0.0446668 . . . 272 ARG N . 272 ARG H 26823 1 6 . 1 1 10 10 SER N N 15 . 1 1 10 10 SER H H 1 0.386435 0.0696266 . . . 273 SER N . 273 SER H 26823 1 7 . 1 1 12 12 ARG N N 15 . 1 1 12 12 ARG H H 1 0.516201 0.0870248 . . . 275 ARG N . 275 ARG H 26823 1 8 . 1 1 13 13 PHE N N 15 . 1 1 13 13 PHE H H 1 0.513953 0.101402 . . . 276 PHE N . 276 PHE H 26823 1 9 . 1 1 15 15 GLY N N 15 . 1 1 15 15 GLY H H 1 0.299744 0.0753746 . . . 278 GLY N . 278 GLY H 26823 1 10 . 1 1 16 16 ASN N N 15 . 1 1 16 16 ASN H H 1 0.502433 0.0804647 . . . 279 ASN N . 279 ASN H 26823 1 11 . 1 1 18 18 GLY N N 15 . 1 1 18 18 GLY H H 1 0.491919 0.069849 . . . 281 GLY N . 281 GLY H 26823 1 12 . 1 1 19 19 GLY N N 15 . 1 1 19 19 GLY H H 1 0.575168 0.0859521 . . . 282 GLY N . 282 GLY H 26823 1 13 . 1 1 23 23 GLN N N 15 . 1 1 23 23 GLN H H 1 0.371797 0.0637635 . . . 286 GLN N . 286 GLN H 26823 1 14 . 1 1 25 25 GLY N N 15 . 1 1 25 25 GLY H H 1 0.51997 0.0862134 . . . 288 GLY N . 288 GLY H 26823 1 15 . 1 1 29 29 SER N N 15 . 1 1 29 29 SER H H 1 0.347559 0.0651948 . . . 292 SER N . 292 SER H 26823 1 16 . 1 1 30 30 ARG N N 15 . 1 1 30 30 ARG H H 1 0.404744 0.0645383 . . . 293 ARG N . 293 ARG H 26823 1 17 . 1 1 31 31 GLY N N 15 . 1 1 31 31 GLY H H 1 0.394205 0.0749063 . . . 294 GLY N . 294 GLY H 26823 1 18 . 1 1 32 32 GLY N N 15 . 1 1 32 32 GLY H H 1 0.519047 0.0712058 . . . 295 GLY N . 295 GLY H 26823 1 19 . 1 1 33 33 GLY N N 15 . 1 1 33 33 GLY H H 1 0.44402 0.0617978 . . . 296 GLY N . 296 GLY H 26823 1 20 . 1 1 35 35 GLY N N 15 . 1 1 35 35 GLY H H 1 0.306768 0.0618717 . . . 298 GLY N . 298 GLY H 26823 1 21 . 1 1 37 37 GLY N N 15 . 1 1 37 37 GLY H H 1 0.470653 0.062503 . . . 300 GLY N . 300 GLY H 26823 1 22 . 1 1 39 39 ASN N N 15 . 1 1 39 39 ASN H H 1 0.593028 0.0757453 . . . 302 ASN N . 302 ASN H 26823 1 23 . 1 1 40 40 GLN N N 15 . 1 1 40 40 GLN H H 1 0.344025 0.0601344 . . . 303 GLN N . 303 GLN H 26823 1 24 . 1 1 43 43 ASN N N 15 . 1 1 43 43 ASN H H 1 0.302564 0.0722713 . . . 306 ASN N . 306 ASN H 26823 1 25 . 1 1 44 44 MET N N 15 . 1 1 44 44 MET H H 1 0.400126 0.07004 . . . 307 MET N . 307 MET H 26823 1 26 . 1 1 46 46 GLY N N 15 . 1 1 46 46 GLY H H 1 0.434888 0.0683052 . . . 309 GLY N . 309 GLY H 26823 1 27 . 1 1 47 47 GLY N N 15 . 1 1 47 47 GLY H H 1 0.327083 0.0566703 . . . 310 GLY N . 310 GLY H 26823 1 28 . 1 1 49 49 ASN N N 15 . 1 1 49 49 ASN H H 1 0.532276 0.0774309 . . . 312 ASN N . 312 ASN H 26823 1 29 . 1 1 50 50 PHE N N 15 . 1 1 50 50 PHE H H 1 0.477075 0.08295 . . . 313 PHE N . 313 PHE H 26823 1 30 . 1 1 51 51 GLY N N 15 . 1 1 51 51 GLY H H 1 0.515052 0.0761301 . . . 314 GLY N . 314 GLY H 26823 1 31 . 1 1 52 52 ALA N N 15 . 1 1 52 52 ALA H H 1 0.402808 0.073381 . . . 315 ALA N . 315 ALA H 26823 1 32 . 1 1 53 53 PHE N N 15 . 1 1 53 53 PHE H H 1 0.422217 0.0792579 . . . 316 PHE N . 316 PHE H 26823 1 33 . 1 1 54 54 SER N N 15 . 1 1 54 54 SER H H 1 0.444621 0.0899658 . . . 317 SER N . 317 SER H 26823 1 34 . 1 1 55 55 ILE N N 15 . 1 1 55 55 ILE H H 1 0.695943 0.148871 . . . 318 ILE N . 318 ILE H 26823 1 35 . 1 1 59 59 MET N N 15 . 1 1 59 59 MET H H 1 0.614691 0.121594 . . . 322 MET N . 322 MET H 26823 1 36 . 1 1 60 60 MET N N 15 . 1 1 60 60 MET H H 1 0.531823 0.126355 . . . 323 MET N . 323 MET H 26823 1 37 . 1 1 61 61 ALA N N 15 . 1 1 61 61 ALA H H 1 0.542782 0.0926515 . . . 324 ALA N . 324 ALA H 26823 1 38 . 1 1 62 62 ALA N N 15 . 1 1 62 62 ALA H H 1 0.480579 0.121545 . . . 325 ALA N . 325 ALA H 26823 1 39 . 1 1 63 63 ALA N N 15 . 1 1 63 63 ALA H H 1 0.56095 0.126054 . . . 326 ALA N . 326 ALA H 26823 1 40 . 1 1 65 65 ALA N N 15 . 1 1 65 65 ALA H H 1 0.640515 0.143806 . . . 328 ALA N . 328 ALA H 26823 1 41 . 1 1 66 66 ALA N N 15 . 1 1 66 66 ALA H H 1 0.607199 0.142004 . . . 329 ALA N . 329 ALA H 26823 1 42 . 1 1 67 67 LEU N N 15 . 1 1 67 67 LEU H H 1 0.586993 0.149025 . . . 330 LEU N . 330 LEU H 26823 1 43 . 1 1 68 68 GLN N N 15 . 1 1 68 68 GLN H H 1 0.63452 0.165584 . . . 331 GLN N . 331 GLN H 26823 1 44 . 1 1 70 70 SER N N 15 . 1 1 70 70 SER H H 1 0.493455 0.113208 . . . 333 SER N . 333 SER H 26823 1 45 . 1 1 71 71 TRP N N 15 . 1 1 71 71 TRP H H 1 0.61286 0.123139 . . . 334 TRP N . 334 TRP H 26823 1 46 . 1 1 72 72 GLY N N 15 . 1 1 72 72 GLY H H 1 0.803407 0.141225 . . . 335 GLY N . 335 GLY H 26823 1 47 . 1 1 74 74 MET N N 15 . 1 1 74 74 MET H H 1 0.447243 0.0951196 . . . 337 MET N . 337 MET H 26823 1 48 . 1 1 75 75 GLY N N 15 . 1 1 75 75 GLY H H 1 0.445976 0.0836087 . . . 338 GLY N . 338 GLY H 26823 1 49 . 1 1 77 77 LEU N N 15 . 1 1 77 77 LEU H H 1 0.630765 0.101301 . . . 340 LEU N . 340 LEU H 26823 1 50 . 1 1 78 78 ALA N N 15 . 1 1 78 78 ALA H H 1 0.425894 0.0726438 . . . 341 ALA N . 341 ALA H 26823 1 51 . 1 1 79 79 SER N N 15 . 1 1 79 79 SER H H 1 0.400793 0.077929 . . . 342 SER N . 342 SER H 26823 1 52 . 1 1 80 80 GLN N N 15 . 1 1 80 80 GLN H H 1 0.482165 0.0871307 . . . 343 GLN N . 343 GLN H 26823 1 53 . 1 1 81 81 GLN N N 15 . 1 1 81 81 GLN H H 1 0.685286 0.102481 . . . 344 GLN N . 344 GLN H 26823 1 54 . 1 1 83 83 GLN N N 15 . 1 1 83 83 GLN H H 1 0.451996 0.0696964 . . . 346 GLN N . 346 GLN H 26823 1 55 . 1 1 84 84 SER N N 15 . 1 1 84 84 SER H H 1 0.331183 0.0585697 . . . 347 SER N . 347 SER H 26823 1 56 . 1 1 85 85 GLY N N 15 . 1 1 85 85 GLY H H 1 0.406481 0.0634637 . . . 348 GLY N . 348 GLY H 26823 1 57 . 1 1 87 87 SER N N 15 . 1 1 87 87 SER H H 1 0.389205 0.0675562 . . . 350 SER N . 350 SER H 26823 1 58 . 1 1 88 88 GLY N N 15 . 1 1 88 88 GLY H H 1 0.306445 0.0683419 . . . 351 GLY N . 351 GLY H 26823 1 59 . 1 1 94 94 GLY N N 15 . 1 1 94 94 GLY H H 1 0.557017 0.0697017 . . . 357 GLY N . 357 GLY H 26823 1 60 . 1 1 97 97 GLN N N 15 . 1 1 97 97 GLN H H 1 0.280008 0.0612859 . . . 360 GLN N . 360 GLN H 26823 1 61 . 1 1 98 98 ARG N N 15 . 1 1 98 98 ARG H H 1 0.406346 0.0732784 . . . 361 ARG N . 361 ARG H 26823 1 62 . 1 1 99 99 GLU N N 15 . 1 1 99 99 GLU H H 1 0.603224 0.0811291 . . . 362 GLU N . 362 GLU H 26823 1 63 . 1 1 101 101 ASN N N 15 . 1 1 101 101 ASN H H 1 0.592197 0.0896042 . . . 364 ASN N . 364 ASN H 26823 1 64 . 1 1 102 102 GLN N N 15 . 1 1 102 102 GLN H H 1 0.543345 0.0941813 . . . 365 GLN N . 365 GLN H 26823 1 65 . 1 1 103 103 ALA N N 15 . 1 1 103 103 ALA H H 1 0.485361 0.0677657 . . . 366 ALA N . 366 ALA H 26823 1 66 . 1 1 106 106 SER N N 15 . 1 1 106 106 SER H H 1 0.484621 0.0631196 . . . 369 SER N . 369 SER H 26823 1 67 . 1 1 107 107 GLY N N 15 . 1 1 107 107 GLY H H 1 0.452329 0.0669372 . . . 370 GLY N . 370 GLY H 26823 1 68 . 1 1 111 111 TYR N N 15 . 1 1 111 111 TYR H H 1 0.462553 0.0693787 . . . 374 TYR N . 374 TYR H 26823 1 69 . 1 1 112 112 SER N N 15 . 1 1 112 112 SER H H 1 0.527576 0.0706071 . . . 375 SER N . 375 SER H 26823 1 70 . 1 1 113 113 GLY N N 15 . 1 1 113 113 GLY H H 1 0.434792 0.0751619 . . . 376 GLY N . 376 GLY H 26823 1 71 . 1 1 115 115 ASN N N 15 . 1 1 115 115 ASN H H 1 0.347115 0.0767125 . . . 378 ASN N . 378 ASN H 26823 1 72 . 1 1 116 116 SER N N 15 . 1 1 116 116 SER H H 1 0.395521 0.0574733 . . . 379 SER N . 379 SER H 26823 1 73 . 1 1 117 117 GLY N N 15 . 1 1 117 117 GLY H H 1 0.415417 0.0637843 . . . 380 GLY N . 380 GLY H 26823 1 74 . 1 1 118 118 ALA N N 15 . 1 1 118 118 ALA H H 1 0.40644 0.0520911 . . . 381 ALA N . 381 ALA H 26823 1 75 . 1 1 119 119 ALA N N 15 . 1 1 119 119 ALA H H 1 0.397051 0.0585936 . . . 382 ALA N . 382 ALA H 26823 1 76 . 1 1 120 120 ILE N N 15 . 1 1 120 120 ILE H H 1 0.36131 0.076061 . . . 383 ILE N . 383 ILE H 26823 1 77 . 1 1 121 121 GLY N N 15 . 1 1 121 121 GLY H H 1 0.419854 0.0684464 . . . 384 GLY N . 384 GLY H 26823 1 78 . 1 1 122 122 TRP N N 15 . 1 1 122 122 TRP H H 1 0.488485 0.0668248 . . . 385 TRP N . 385 TRP H 26823 1 79 . 1 1 125 125 ALA N N 15 . 1 1 125 125 ALA H H 1 0.498195 0.0625662 . . . 388 ALA N . 388 ALA H 26823 1 80 . 1 1 126 126 SER N N 15 . 1 1 126 126 SER H H 1 0.361587 0.052366 . . . 389 SER N . 389 SER H 26823 1 81 . 1 1 128 128 ALA N N 15 . 1 1 128 128 ALA H H 1 0.547023 0.0549715 . . . 391 ALA N . 391 ALA H 26823 1 82 . 1 1 129 129 GLY N N 15 . 1 1 129 129 GLY H H 1 0.237256 0.0604244 . . . 392 GLY N . 392 GLY H 26823 1 83 . 1 1 131 131 GLY N N 15 . 1 1 131 131 GLY H H 1 0.277433 0.0555496 . . . 394 GLY N . 394 GLY H 26823 1 84 . 1 1 132 132 SER N N 15 . 1 1 132 132 SER H H 1 0.433508 0.0656465 . . . 395 SER N . 395 SER H 26823 1 85 . 1 1 134 134 PHE N N 15 . 1 1 134 134 PHE H H 1 0.468916 0.0649474 . . . 397 PHE N . 397 PHE H 26823 1 86 . 1 1 135 135 ASN N N 15 . 1 1 135 135 ASN H H 1 0.439071 0.0721847 . . . 398 ASN N . 398 ASN H 26823 1 87 . 1 1 136 136 GLY N N 15 . 1 1 136 136 GLY H H 1 0.399477 0.0873428 . . . 399 GLY N . 399 GLY H 26823 1 88 . 1 1 137 137 GLY N N 15 . 1 1 137 137 GLY H H 1 0.503667 0.0749303 . . . 400 GLY N . 400 GLY H 26823 1 89 . 1 1 138 138 PHE N N 15 . 1 1 138 138 PHE H H 1 0.454453 0.0691381 . . . 401 PHE N . 401 PHE H 26823 1 90 . 1 1 139 139 GLY N N 15 . 1 1 139 139 GLY H H 1 0.38494 0.0667549 . . . 402 GLY N . 402 GLY H 26823 1 91 . 1 1 141 141 SER N N 15 . 1 1 141 141 SER H H 1 0.510756 0.0742006 . . . 404 SER N . 404 SER H 26823 1 92 . 1 1 142 142 MET N N 15 . 1 1 142 142 MET H H 1 0.295745 0.0559548 . . . 405 MET N . 405 MET H 26823 1 93 . 1 1 143 143 ASP N N 15 . 1 1 143 143 ASP H H 1 0.664845 0.0727225 . . . 406 ASP N . 406 ASP H 26823 1 94 . 1 1 144 144 SER N N 15 . 1 1 144 144 SER H H 1 0.56463 0.0659788 . . . 407 SER N . 407 SER H 26823 1 95 . 1 1 145 145 LYS N N 15 . 1 1 145 145 LYS H H 1 0.451872 0.0621829 . . . 408 LYS N . 408 LYS H 26823 1 96 . 1 1 146 146 SER N N 15 . 1 1 146 146 SER H H 1 0.388399 0.0610915 . . . 409 SER N . 409 SER H 26823 1 97 . 1 1 147 147 SER N N 15 . 1 1 147 147 SER H H 1 0.436769 0.0599626 . . . 410 SER N . 410 SER H 26823 1 98 . 1 1 148 148 GLY N N 15 . 1 1 148 148 GLY H H 1 0.443209 0.0725889 . . . 411 GLY N . 411 GLY H 26823 1 99 . 1 1 149 149 TRP N N 15 . 1 1 149 149 TRP H H 1 0.517553 0.0607119 . . . 412 TRP N . 412 TRP H 26823 1 100 . 1 1 150 150 GLY N N 15 . 1 1 150 150 GLY H H 1 0.249187 0.0520062 . . . 413 GLY N . 413 GLY H 26823 1 101 . 1 1 151 151 MET N N 15 . 1 1 151 151 MET H H 1 -0.06942 -0.0558437 . . . 414 MET N . 414 MET H 26823 1 stop_ save_ ############################## # Heteronuclear NOE values # ############################## save_WT_TDP-43_267-414_500_MHz_HetNOE _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode WT_TDP-43_267-414_500_MHz_HetNOE _Heteronucl_NOE_list.Entry_ID 26823 _Heteronucl_NOE_list.ID 2 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $283_K _Heteronucl_NOE_list.Spectrometer_frequency_1H 500 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'relative intensities' _Heteronucl_NOE_list.NOE_ref_val 0 _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 12 hsqcnoef3gpsi . . . 26823 2 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 4 4 ASN N N 15 . 1 1 4 4 ASN H H 1 -0.278665 -0.0726276 . . . 267 ASN N . 267 ASN H 26823 2 2 . 1 1 6 6 GLN N N 15 . 1 1 6 6 GLN H H 1 -0.114276 -0.0499826 . . . 269 GLN N . 269 GLN H 26823 2 3 . 1 1 7 7 LEU N N 15 . 1 1 7 7 LEU H H 1 0.132665 0.0532943 . . . 270 LEU N . 270 LEU H 26823 2 4 . 1 1 8 8 GLU N N 15 . 1 1 8 8 GLU H H 1 0.0441663 0.0478331 . . . 271 GLU N . 271 GLU H 26823 2 5 . 1 1 9 9 ARG N N 15 . 1 1 9 9 ARG H H 1 -0.11795 -0.0336161 . . . 272 ARG N . 272 ARG H 26823 2 6 . 1 1 10 10 SER N N 15 . 1 1 10 10 SER H H 1 0.107516 0.070118 . . . 273 SER N . 273 SER H 26823 2 7 . 1 1 12 12 ARG N N 15 . 1 1 12 12 ARG H H 1 0.0596667 0.0621432 . . . 275 ARG N . 275 ARG H 26823 2 8 . 1 1 13 13 PHE N N 15 . 1 1 13 13 PHE H H 1 -0.0584987 -0.0586101 . . . 276 PHE N . 276 PHE H 26823 2 9 . 1 1 15 15 GLY N N 15 . 1 1 15 15 GLY H H 1 0.0957489 0.0536538 . . . 278 GLY N . 278 GLY H 26823 2 10 . 1 1 16 16 ASN N N 15 . 1 1 16 16 ASN H H 1 0.0647521 0.071111 . . . 279 ASN N . 279 ASN H 26823 2 11 . 1 1 18 18 GLY N N 15 . 1 1 18 18 GLY H H 1 -0.0407116 -0.0585816 . . . 281 GLY N . 281 GLY H 26823 2 12 . 1 1 19 19 GLY N N 15 . 1 1 19 19 GLY H H 1 -0.0114028 -0.0502069 . . . 282 GLY N . 282 GLY H 26823 2 13 . 1 1 24 24 GLY N N 15 . 1 1 24 24 GLY H H 1 -0.0476029 -0.0481187 . . . 287 GLY N . 287 GLY H 26823 2 14 . 1 1 25 25 GLY N N 15 . 1 1 25 25 GLY H H 1 -0.0830472 -0.0423866 . . . 288 GLY N . 288 GLY H 26823 2 15 . 1 1 29 29 SER N N 15 . 1 1 29 29 SER H H 1 -0.0815668 -0.0625779 . . . 292 SER N . 292 SER H 26823 2 16 . 1 1 30 30 ARG N N 15 . 1 1 30 30 ARG H H 1 -0.159565 -0.0595899 . . . 293 ARG N . 293 ARG H 26823 2 17 . 1 1 31 31 GLY N N 15 . 1 1 31 31 GLY H H 1 -0.0900238 -0.0592944 . . . 294 GLY N . 294 GLY H 26823 2 18 . 1 1 32 32 GLY N N 15 . 1 1 32 32 GLY H H 1 -0.0411096 -0.0376607 . . . 295 GLY N . 295 GLY H 26823 2 19 . 1 1 33 33 GLY N N 15 . 1 1 33 33 GLY H H 1 -0.00161925 -0.039585 . . . 296 GLY N . 296 GLY H 26823 2 20 . 1 1 35 35 GLY N N 15 . 1 1 35 35 GLY H H 1 -0.326614 -0.048951 . . . 298 GLY N . 298 GLY H 26823 2 21 . 1 1 39 39 ASN N N 15 . 1 1 39 39 ASN H H 1 -0.0815799 -0.0525593 . . . 302 ASN N . 302 ASN H 26823 2 22 . 1 1 40 40 GLN N N 15 . 1 1 40 40 GLN H H 1 -0.0457644 -0.0488399 . . . 303 GLN N . 303 GLN H 26823 2 23 . 1 1 43 43 ASN N N 15 . 1 1 43 43 ASN H H 1 0.13407 0.05067 . . . 306 ASN N . 306 ASN H 26823 2 24 . 1 1 44 44 MET N N 15 . 1 1 44 44 MET H H 1 0.0272984 0.049521 . . . 307 MET N . 307 MET H 26823 2 25 . 1 1 47 47 GLY N N 15 . 1 1 47 47 GLY H H 1 -0.199847 -0.0465001 . . . 310 GLY N . 310 GLY H 26823 2 26 . 1 1 49 49 ASN N N 15 . 1 1 49 49 ASN H H 1 -0.0149801 -0.0592266 . . . 312 ASN N . 312 ASN H 26823 2 27 . 1 1 50 50 PHE N N 15 . 1 1 50 50 PHE H H 1 0.165371 0.0555907 . . . 313 PHE N . 313 PHE H 26823 2 28 . 1 1 51 51 GLY N N 15 . 1 1 51 51 GLY H H 1 0.0634536 0.0681491 . . . 314 GLY N . 314 GLY H 26823 2 29 . 1 1 52 52 ALA N N 15 . 1 1 52 52 ALA H H 1 0.175216 0.0532865 . . . 315 ALA N . 315 ALA H 26823 2 30 . 1 1 54 54 SER N N 15 . 1 1 54 54 SER H H 1 0.18282 0.0609654 . . . 317 SER N . 317 SER H 26823 2 31 . 1 1 55 55 ILE N N 15 . 1 1 55 55 ILE H H 1 0.273472 0.0929514 . . . 318 ILE N . 318 ILE H 26823 2 32 . 1 1 59 59 MET N N 15 . 1 1 59 59 MET H H 1 0.200434 0.0774497 . . . 322 MET N . 322 MET H 26823 2 33 . 1 1 60 60 MET N N 15 . 1 1 60 60 MET H H 1 0.285033 0.0820178 . . . 323 MET N . 323 MET H 26823 2 34 . 1 1 61 61 ALA N N 15 . 1 1 61 61 ALA H H 1 0.359714 0.0904104 . . . 324 ALA N . 324 ALA H 26823 2 35 . 1 1 62 62 ALA N N 15 . 1 1 62 62 ALA H H 1 0.443495 0.0795038 . . . 325 ALA N . 325 ALA H 26823 2 36 . 1 1 63 63 ALA N N 15 . 1 1 63 63 ALA H H 1 0.301364 0.0662799 . . . 326 ALA N . 326 ALA H 26823 2 37 . 1 1 65 65 ALA N N 15 . 1 1 65 65 ALA H H 1 0.426949 0.122544 . . . 328 ALA N . 328 ALA H 26823 2 38 . 1 1 66 66 ALA N N 15 . 1 1 66 66 ALA H H 1 0.30008 0.083367 . . . 329 ALA N . 329 ALA H 26823 2 39 . 1 1 67 67 LEU N N 15 . 1 1 67 67 LEU H H 1 0.338858 0.0930419 . . . 330 LEU N . 330 LEU H 26823 2 40 . 1 1 68 68 GLN N N 15 . 1 1 68 68 GLN H H 1 0.427766 0.114114 . . . 331 GLN N . 331 GLN H 26823 2 41 . 1 1 69 69 SER N N 15 . 1 1 69 69 SER H H 1 0.272129 0.0812925 . . . 332 SER N . 332 SER H 26823 2 42 . 1 1 70 70 SER N N 15 . 1 1 70 70 SER H H 1 0.16531 0.0835546 . . . 333 SER N . 333 SER H 26823 2 43 . 1 1 71 71 TRP N N 15 . 1 1 71 71 TRP H H 1 0.289252 0.0843439 . . . 334 TRP N . 334 TRP H 26823 2 44 . 1 1 72 72 GLY N N 15 . 1 1 72 72 GLY H H 1 0.347582 0.0983563 . . . 335 GLY N . 335 GLY H 26823 2 45 . 1 1 74 74 MET N N 15 . 1 1 74 74 MET H H 1 0.207299 0.0898607 . . . 337 MET N . 337 MET H 26823 2 46 . 1 1 75 75 GLY N N 15 . 1 1 75 75 GLY H H 1 0.278359 0.0850987 . . . 338 GLY N . 338 GLY H 26823 2 47 . 1 1 77 77 LEU N N 15 . 1 1 77 77 LEU H H 1 0.253642 0.0733668 . . . 340 LEU N . 340 LEU H 26823 2 48 . 1 1 78 78 ALA N N 15 . 1 1 78 78 ALA H H 1 0.185974 0.0551664 . . . 341 ALA N . 341 ALA H 26823 2 49 . 1 1 79 79 SER N N 15 . 1 1 79 79 SER H H 1 0.0728879 0.0527656 . . . 342 SER N . 342 SER H 26823 2 50 . 1 1 80 80 GLN N N 15 . 1 1 80 80 GLN H H 1 0.0862225 0.0677233 . . . 343 GLN N . 343 GLN H 26823 2 51 . 1 1 81 81 GLN N N 15 . 1 1 81 81 GLN H H 1 0.181226 0.0616184 . . . 344 GLN N . 344 GLN H 26823 2 52 . 1 1 83 83 GLN N N 15 . 1 1 83 83 GLN H H 1 -0.174252 -0.0555087 . . . 346 GLN N . 346 GLN H 26823 2 53 . 1 1 84 84 SER N N 15 . 1 1 84 84 SER H H 1 -0.057892 -0.0521336 . . . 347 SER N . 347 SER H 26823 2 54 . 1 1 85 85 GLY N N 15 . 1 1 85 85 GLY H H 1 -0.0463624 -0.044898 . . . 348 GLY N . 348 GLY H 26823 2 55 . 1 1 87 87 SER N N 15 . 1 1 87 87 SER H H 1 -0.227628 -0.0519521 . . . 350 SER N . 350 SER H 26823 2 56 . 1 1 88 88 GLY N N 15 . 1 1 88 88 GLY H H 1 -0.125714 -0.0549637 . . . 351 GLY N . 351 GLY H 26823 2 57 . 1 1 97 97 GLN N N 15 . 1 1 97 97 GLN H H 1 0.0157173 0.0565827 . . . 360 GLN N . 360 GLN H 26823 2 58 . 1 1 98 98 ARG N N 15 . 1 1 98 98 ARG H H 1 0.0210391 0.0548681 . . . 361 ARG N . 361 ARG H 26823 2 59 . 1 1 99 99 GLU N N 15 . 1 1 99 99 GLU H H 1 0.182015 0.061228 . . . 362 GLU N . 362 GLU H 26823 2 60 . 1 1 101 101 ASN N N 15 . 1 1 101 101 ASN H H 1 0.144425 0.0586447 . . . 364 ASN N . 364 ASN H 26823 2 61 . 1 1 102 102 GLN N N 15 . 1 1 102 102 GLN H H 1 0.197161 0.0582068 . . . 365 GLN N . 365 GLN H 26823 2 62 . 1 1 103 103 ALA N N 15 . 1 1 103 103 ALA H H 1 0.151554 0.0492733 . . . 366 ALA N . 366 ALA H 26823 2 63 . 1 1 107 107 GLY N N 15 . 1 1 107 107 GLY H H 1 -0.0654063 -0.0468143 . . . 370 GLY N . 370 GLY H 26823 2 64 . 1 1 111 111 TYR N N 15 . 1 1 111 111 TYR H H 1 0.152848 0.0633206 . . . 374 TYR N . 374 TYR H 26823 2 65 . 1 1 112 112 SER N N 15 . 1 1 112 112 SER H H 1 0.0796614 0.0640166 . . . 375 SER N . 375 SER H 26823 2 66 . 1 1 113 113 GLY N N 15 . 1 1 113 113 GLY H H 1 0.107715 0.0563569 . . . 376 GLY N . 376 GLY H 26823 2 67 . 1 1 115 115 ASN N N 15 . 1 1 115 115 ASN H H 1 -0.0607393 -0.0745022 . . . 378 ASN N . 378 ASN H 26823 2 68 . 1 1 116 116 SER N N 15 . 1 1 116 116 SER H H 1 -0.00862987 -0.0525073 . . . 379 SER N . 379 SER H 26823 2 69 . 1 1 118 118 ALA N N 15 . 1 1 118 118 ALA H H 1 0.0275187 0.0396949 . . . 381 ALA N . 381 ALA H 26823 2 70 . 1 1 119 119 ALA N N 15 . 1 1 119 119 ALA H H 1 -0.043187 -0.0422147 . . . 382 ALA N . 382 ALA H 26823 2 71 . 1 1 120 120 ILE N N 15 . 1 1 120 120 ILE H H 1 -0.173476 -0.0541975 . . . 383 ILE N . 383 ILE H 26823 2 72 . 1 1 121 121 GLY N N 15 . 1 1 121 121 GLY H H 1 0.0244579 0.0547312 . . . 384 GLY N . 384 GLY H 26823 2 73 . 1 1 122 122 TRP N N 15 . 1 1 122 122 TRP H H 1 0.0406394 0.0474 . . . 385 TRP N . 385 TRP H 26823 2 74 . 1 1 124 124 SER N N 15 . 1 1 124 124 SER H H 1 0.0225841 0.0461973 . . . 387 SER N . 387 SER H 26823 2 75 . 1 1 125 125 ALA N N 15 . 1 1 125 125 ALA H H 1 -0.099581 -0.0464356 . . . 388 ALA N . 388 ALA H 26823 2 76 . 1 1 126 126 SER N N 15 . 1 1 126 126 SER H H 1 -0.0352558 -0.0422195 . . . 389 SER N . 389 SER H 26823 2 77 . 1 1 128 128 ALA N N 15 . 1 1 128 128 ALA H H 1 0.0582783 0.040181 . . . 391 ALA N . 391 ALA H 26823 2 78 . 1 1 129 129 GLY N N 15 . 1 1 129 129 GLY H H 1 -0.184461 -0.0481064 . . . 392 GLY N . 392 GLY H 26823 2 79 . 1 1 131 131 GLY N N 15 . 1 1 131 131 GLY H H 1 -0.200239 -0.0454458 . . . 394 GLY N . 394 GLY H 26823 2 80 . 1 1 134 134 PHE N N 15 . 1 1 134 134 PHE H H 1 -0.0339831 -0.0476002 . . . 397 PHE N . 397 PHE H 26823 2 81 . 1 1 135 135 ASN N N 15 . 1 1 135 135 ASN H H 1 -0.0713105 -0.061702 . . . 398 ASN N . 398 ASN H 26823 2 82 . 1 1 136 136 GLY N N 15 . 1 1 136 136 GLY H H 1 0.0404198 0.0539173 . . . 399 GLY N . 399 GLY H 26823 2 83 . 1 1 137 137 GLY N N 15 . 1 1 137 137 GLY H H 1 0.110709 0.0484596 . . . 400 GLY N . 400 GLY H 26823 2 84 . 1 1 138 138 PHE N N 15 . 1 1 138 138 PHE H H 1 0.0588025 0.0508824 . . . 401 PHE N . 401 PHE H 26823 2 85 . 1 1 141 141 SER N N 15 . 1 1 141 141 SER H H 1 -0.124518 -0.0521386 . . . 404 SER N . 404 SER H 26823 2 86 . 1 1 142 142 MET N N 15 . 1 1 142 142 MET H H 1 -0.0706366 -0.0471489 . . . 405 MET N . 405 MET H 26823 2 87 . 1 1 143 143 ASP N N 15 . 1 1 143 143 ASP H H 1 0.111065 0.0480418 . . . 406 ASP N . 406 ASP H 26823 2 88 . 1 1 144 144 SER N N 15 . 1 1 144 144 SER H H 1 0.0677448 0.0446901 . . . 407 SER N . 407 SER H 26823 2 89 . 1 1 145 145 LYS N N 15 . 1 1 145 145 LYS H H 1 0.0489498 0.051747 . . . 408 LYS N . 408 LYS H 26823 2 90 . 1 1 146 146 SER N N 15 . 1 1 146 146 SER H H 1 -0.0717365 -0.044999 . . . 409 SER N . 409 SER H 26823 2 91 . 1 1 147 147 SER N N 15 . 1 1 147 147 SER H H 1 -0.157156 -0.0477221 . . . 410 SER N . 410 SER H 26823 2 92 . 1 1 148 148 GLY N N 15 . 1 1 148 148 GLY H H 1 -0.212951 -0.0499073 . . . 411 GLY N . 411 GLY H 26823 2 93 . 1 1 149 149 TRP N N 15 . 1 1 149 149 TRP H H 1 -0.369653 -0.0415239 . . . 412 TRP N . 412 TRP H 26823 2 94 . 1 1 150 150 GLY N N 15 . 1 1 150 150 GLY H H 1 -0.342151 -0.0454907 . . . 413 GLY N . 413 GLY H 26823 2 95 . 1 1 151 151 MET N N 15 . 1 1 151 151 MET H H 1 -0.745793 -0.0516545 . . . 414 MET N . 414 MET H 26823 2 stop_ save_