data_nef_c30373_6mnl save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6BNH stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 5 GLY C 1 6 ALY N 1 6 ALY C 1 7 SER N 1 8 GLY C 1 9 ALY N 1 9 ALY C 1 10 ALA N stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 ASN . . . 2 A 2 PRO . . . 3 A 3 ASP . . . 4 A 4 GLY . . . 5 A 5 GLY . -OXT . 6 A 6 ALY . -H2,-OXT . 7 A 7 SER . -H2 . 8 A 8 GLY . -OXT . 9 A 9 ALY . -H2,-OXT . 10 A 10 ALA . -H2 . 11 A 11 PRO . . . 12 A 12 ARG . . . 13 A 13 ARG . . . 14 A 14 ARG . . . 15 A 15 ALA . . . 16 A 16 VAL . . . 17 B 333 LYS . . . 18 B 334 ASP . . . 19 B 335 VAL . . . 20 B 336 PRO . . . 21 B 337 ASP . . . 22 B 338 SER . . . 23 B 339 GLN . . . 24 B 340 GLN . . . 25 B 341 HIS . . . 26 B 342 PRO . . . 27 B 343 ALA . . . 28 B 344 PRO . . . 29 B 345 GLU . . . 30 B 346 LYS . . . 31 B 347 SER . . . 32 B 348 SER . . . 33 B 349 LYS . . . 34 B 350 VAL . . . 35 B 351 SER . . . 36 B 352 GLU . . . 37 B 353 GLN . . . 38 B 354 LEU . . . 39 B 355 LYS . . . 40 B 356 CYS . . . 41 B 357 CYS . . . 42 B 358 SER . . . 43 B 359 GLY . . . 44 B 360 ILE . . . 45 B 361 LEU . . . 46 B 362 LYS . . . 47 B 363 GLU . . . 48 B 364 MET . . . 49 B 365 PHE . . . 50 B 366 ALA . . . 51 B 367 LYS . . . 52 B 368 LYS . . . 53 B 369 HIS . . . 54 B 370 ALA . . . 55 B 371 ALA . . . 56 B 372 TYR . . . 57 B 373 ALA . . . 58 B 374 TRP . . . 59 B 375 PRO . . . 60 B 376 PHE . . . 61 B 377 TYR . . . 62 B 378 LYS . . . 63 B 379 PRO . . . 64 B 380 VAL . . . 65 B 381 ASP . . . 66 B 382 VAL . . . 67 B 383 GLU . . . 68 B 384 ALA . . . 69 B 385 LEU . . . 70 B 386 GLY . . . 71 B 387 LEU . . . 72 B 388 HIS . . . 73 B 389 ASP . . . 74 B 390 TYR . . . 75 B 391 CYS . . . 76 B 392 ASP . . . 77 B 393 ILE . . . 78 B 394 ILE . . . 79 B 395 LYS . . . 80 B 396 HIS . . . 81 B 397 PRO . . . 82 B 398 MET . . . 83 B 399 ASP . . . 84 B 400 MET . . . 85 B 401 SER . . . 86 B 402 THR . . . 87 B 403 ILE . . . 88 B 404 LYS . . . 89 B 405 SER . . . 90 B 406 LYS . . . 91 B 407 LEU . . . 92 B 408 GLU . . . 93 B 409 ALA . . . 94 B 410 ARG . . . 95 B 411 GLU . . . 96 B 412 TYR . . . 97 B 413 ARG . . . 98 B 414 ASP . . . 99 B 415 ALA . . . 100 B 416 GLN . . . 101 B 417 GLU . . . 102 B 418 PHE . . . 103 B 419 GLY . . . 104 B 420 ALA . . . 105 B 421 ASP . . . 106 B 422 VAL . . . 107 B 423 ARG . . . 108 B 424 LEU . . . 109 B 425 MET . . . 110 B 426 PHE . . . 111 B 427 SER . . . 112 B 428 ASN . . . 113 B 429 CYS . . . 114 B 430 TYR . . . 115 B 431 LYS . . . 116 B 432 TYR . . . 117 B 433 ASN . . . 118 B 434 PRO . . . 119 B 435 PRO . . . 120 B 436 ASP . . . 121 B 437 HIS . . . 122 B 438 GLU . . . 123 B 439 VAL . . . 124 B 440 VAL . . . 125 B 441 ALA . . . 126 B 442 MET . . . 127 B 443 ALA . . . 128 B 444 ARG . . . 129 B 445 LYS . . . 130 B 446 LEU . . . 131 B 447 GLN . . . 132 B 448 ASP . . . 133 B 449 VAL . . . 134 B 450 PHE . . . 135 B 451 GLU . . . 136 B 452 MET . . . 137 B 453 ARG . . . 138 B 454 PHE . . . 139 B 455 ALA . . . 140 B 456 LYS . . . 141 B 457 MET . . . 142 B 458 PRO . . . 143 B 459 ASP . . . 144 B 460 GLU . . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 SER HA H 1 4.4700 0.0000 A 1 SER HBx H 1 3.8900 0.0000 A 1 SER HBy H 1 3.9600 0.0000 A 1 SER CA C 13 58.9000 0.0000 A 1 SER CB C 13 63.8600 0.0000 A 2 GLU H H 1 8.5130 0.0000 A 2 GLU HA H 1 4.2890 0.0000 A 2 GLU HBx H 1 1.9600 0.0000 A 2 GLU HBy H 1 2.0400 0.0000 A 2 GLU HGy H 1 2.2800 0.0000 A 2 GLU CA C 13 57.7600 0.0000 A 2 GLU CB C 13 30.0000 0.0000 A 2 GLU CG C 13 36.4300 0.0000 A 2 GLU N N 15 121.7890 0.0000 A 3 GLU H H 1 8.2600 0.0000 A 3 GLU HA H 1 4.2570 0.0000 A 3 GLU HBx H 1 1.9760 0.0000 A 3 GLU HBy H 1 2.0600 0.0000 A 3 GLU HGy H 1 2.2700 0.0000 A 3 GLU CA C 13 57.5000 0.0000 A 3 GLU CB C 13 30.1600 0.0000 A 3 GLU CG C 13 36.4300 0.0000 A 3 GLU N N 15 119.8330 0.0000 A 4 GLU H H 1 8.2810 0.0000 A 4 GLU HA H 1 4.2000 0.0000 A 4 GLU HBx H 1 1.9800 0.0000 A 4 GLU HBy H 1 2.0600 0.0000 A 4 GLU HGy H 1 2.2620 0.0000 A 4 GLU CA C 13 57.1700 0.0000 A 4 GLU CB C 13 30.3000 0.0000 A 4 GLU CG C 13 36.4400 0.0000 A 4 GLU N N 15 120.5930 0.0000 A 5 ASP H H 1 8.3420 0.0000 A 5 ASP HA H 1 4.5300 0.0000 A 5 ASP HBx H 1 2.6770 0.0000 A 5 ASP HBy H 1 2.7400 0.0000 A 5 ASP CA C 13 55.4300 0.0000 A 5 ASP CB C 13 41.1000 0.0000 A 5 ASP N N 15 119.9780 0.0000 A 6 LYS H H 1 8.0430 0.0000 A 6 LYS HA H 1 4.2670 0.0000 A 6 LYS HBx H 1 1.8100 0.0000 A 6 LYS HBy H 1 1.9400 0.0000 A 6 LYS HDy H 1 1.6870 0.0000 A 6 LYS HGx H 1 1.4300 0.0000 A 6 LYS HGy H 1 1.5200 0.0000 A 6 LYS CA C 13 56.9600 0.0000 A 6 LYS CB C 13 32.8000 0.0000 A 6 LYS CD C 13 29.2000 0.0000 A 6 LYS CG C 13 25.1750 0.0000 A 6 LYS N N 15 119.9720 0.0000 A 7 CYS H H 1 8.0510 0.0000 A 7 CYS HA H 1 4.3830 0.0000 A 7 CYS HBx H 1 2.8000 0.0000 A 7 CYS HBy H 1 2.8400 0.0000 A 7 CYS CA C 13 58.4040 0.0000 A 7 CYS CB C 13 28.1300 0.0000 A 7 CYS N N 15 117.6830 0.0000 A 8 LYS H H 1 8.3420 0.0000 A 8 LYS HA H 1 4.5620 0.0000 A 8 LYS HBy H 1 1.7900 0.0000 A 8 LYS HDy H 1 1.6890 0.0000 A 8 LYS HEy H 1 3.0090 0.0000 A 8 LYS HGy H 1 1.5390 0.0000 A 8 LYS CA C 13 54.4000 0.0000 A 8 LYS CB C 13 32.8700 0.0000 A 8 LYS CD C 13 29.2000 0.0000 A 8 LYS CE C 13 41.8800 0.0000 A 8 LYS CG C 13 24.7020 0.0000 A 8 LYS N N 15 125.2050 0.0000 A 9 PRO HA H 1 4.3180 0.0000 A 9 PRO HBx H 1 1.8450 0.0000 A 9 PRO HBy H 1 2.3650 0.0000 A 9 PRO HDx H 1 3.6520 0.0000 A 9 PRO HDy H 1 4.0260 0.0000 A 9 PRO HGx H 1 1.9820 0.0000 A 9 PRO HGy H 1 2.0800 0.0000 A 9 PRO CA C 13 63.4500 0.0000 A 9 PRO CB C 13 32.6000 0.0000 A 9 PRO CD C 13 51.3020 0.0000 A 9 PRO CG C 13 27.6200 0.0000 A 10 MET H H 1 8.5920 0.0000 A 10 MET HA H 1 4.5830 0.0000 A 10 MET HBx H 1 2.2500 0.0000 A 10 MET HBy H 1 2.6300 0.0000 A 10 MET HE% H 1 1.8140 0.0000 A 10 MET HGx H 1 1.7070 0.0000 A 10 MET HGy H 1 2.1050 0.0000 A 10 MET CA C 13 56.5800 0.0000 A 10 MET CB C 13 34.7800 0.0000 A 10 MET CE C 13 19.1060 0.0000 A 10 MET CG C 13 35.9140 0.0000 A 10 MET N N 15 121.5730 0.0000 A 11 SER H H 1 9.1810 0.0000 A 11 SER HA H 1 4.5240 0.0000 A 11 SER HBx H 1 4.0810 0.0000 A 11 SER HBy H 1 4.4800 0.0000 A 11 SER CA C 13 57.0600 0.0000 A 11 SER CB C 13 65.8960 0.0000 A 11 SER N N 15 119.2010 0.0000 A 12 TYR H H 1 9.1080 0.0000 A 12 TYR HA H 1 4.0800 0.0000 A 12 TYR HBx H 1 2.9600 0.0000 A 12 TYR HBy H 1 3.2970 0.0000 A 12 TYR HDx H 1 7.1500 0.0000 A 12 TYR HDy H 1 7.1500 0.0000 A 12 TYR HEx H 1 6.8300 0.0000 A 12 TYR HEy H 1 6.8300 0.0000 A 12 TYR CA C 13 62.8300 0.0000 A 12 TYR CB C 13 38.2160 0.0000 A 12 TYR CDy C 13 133.5780 0.0000 A 12 TYR CDx C 13 133.5000 0.0000 A 12 TYR CEy C 13 118.3130 0.0000 A 12 TYR CEx C 13 118.3000 0.0000 A 12 TYR N N 15 121.5020 0.0000 A 13 GLU H H 1 8.9020 0.0000 A 13 GLU HA H 1 3.8800 0.0000 A 13 GLU HBx H 1 1.9800 0.0000 A 13 GLU HBy H 1 2.1100 0.0000 A 13 GLU HGx H 1 2.3320 0.0000 A 13 GLU HGy H 1 2.5360 0.0000 A 13 GLU CA C 13 60.3200 0.0000 A 13 GLU CB C 13 29.0600 0.0000 A 13 GLU CG C 13 36.7800 0.0000 A 13 GLU N N 15 117.8070 0.0000 A 14 GLU H H 1 7.8300 0.0000 A 14 GLU HA H 1 3.9680 0.0000 A 14 GLU HBx H 1 1.9920 0.0000 A 14 GLU HBy H 1 2.2650 0.0000 A 14 GLU HGx H 1 2.2200 0.0000 A 14 GLU HGy H 1 2.4400 0.0000 A 14 GLU CA C 13 59.6130 0.0000 A 14 GLU CB C 13 30.6000 0.0000 A 14 GLU CG C 13 38.2270 0.0000 A 14 GLU N N 15 119.8340 0.0000 A 15 LYS H H 1 8.1890 0.0000 A 15 LYS HA H 1 3.7150 0.0000 A 15 LYS HBx H 1 1.4560 0.0000 A 15 LYS HBy H 1 1.7510 0.0000 A 15 LYS HDx H 1 1.5100 0.0000 A 15 LYS HDy H 1 1.6350 0.0000 A 15 LYS HEx H 1 2.7270 0.0000 A 15 LYS HEy H 1 2.7910 0.0000 A 15 LYS HGx H 1 1.1290 0.0000 A 15 LYS HGy H 1 1.4900 0.0000 A 15 LYS CA C 13 60.4200 0.0000 A 15 LYS CB C 13 33.3900 0.0000 A 15 LYS CD C 13 29.8480 0.0000 A 15 LYS CE C 13 41.8730 0.0000 A 15 LYS CG C 13 27.8600 0.0000 A 15 LYS N N 15 120.8050 0.0000 A 16 ARG H H 1 8.3150 0.0000 A 16 ARG HA H 1 3.6300 0.0000 A 16 ARG HBx H 1 1.3910 0.0000 A 16 ARG HBy H 1 1.7760 0.0000 A 16 ARG HDx H 1 3.0600 0.0000 A 16 ARG HDy H 1 3.1920 0.0000 A 16 ARG HGx H 1 1.2910 0.0000 A 16 ARG HGy H 1 1.4570 0.0000 A 16 ARG CA C 13 59.1400 0.0000 A 16 ARG CB C 13 29.7600 0.0000 A 16 ARG CD C 13 43.2530 0.0000 A 16 ARG CG C 13 26.9180 0.0000 A 16 ARG N N 15 120.0420 0.0000 A 17 GLN H H 1 8.0800 0.0000 A 17 GLN HA H 1 3.7800 0.0000 A 17 GLN HBx H 1 2.0460 0.0000 A 17 GLN HBy H 1 2.1520 0.0000 A 17 GLN HE2y H 1 7.9100 0.0000 A 17 GLN HE2x H 1 6.8060 0.0000 A 17 GLN HGy H 1 2.3720 0.0000 A 17 GLN CA C 13 58.6830 0.0000 A 17 GLN CB C 13 28.5900 0.0000 A 17 GLN CG C 13 33.5470 0.0000 A 17 GLN N N 15 118.7760 0.0000 A 17 GLN NE2 N 15 116.0850 0.0000 A 18 LEU H H 1 7.9520 0.0000 A 18 LEU HA H 1 4.3000 0.0000 A 18 LEU HBx H 1 1.5000 0.0000 A 18 LEU HBy H 1 1.9200 0.0000 A 18 LEU HDx% H 1 0.7400 0.0000 A 18 LEU HDy% H 1 0.9300 0.0000 A 18 LEU HG H 1 1.5300 0.0000 A 18 LEU CA C 13 58.0870 0.0000 A 18 LEU CB C 13 41.3580 0.0000 A 18 LEU CD1 C 13 27.1550 0.0000 A 18 LEU CD2 C 13 23.3670 0.0000 A 18 LEU CG C 13 27.0000 0.0000 A 18 LEU N N 15 119.3420 0.0000 A 19 SER H H 1 7.9270 0.0000 A 19 SER HA H 1 3.9240 0.0000 A 19 SER HBy H 1 3.6800 0.0000 A 19 SER CA C 13 61.7200 0.0000 A 19 SER CB C 13 62.9330 0.0000 A 19 SER N N 15 112.7340 0.0000 A 20 LEU H H 1 7.7390 0.0000 A 20 LEU HA H 1 4.0480 0.0000 A 20 LEU HBx H 1 1.4240 0.0000 A 20 LEU HBy H 1 1.9560 0.0000 A 20 LEU HDx% H 1 0.8160 0.0000 A 20 LEU HDy% H 1 0.8400 0.0000 A 20 LEU HG H 1 1.7600 0.0000 A 20 LEU CA C 13 58.0480 0.0000 A 20 LEU CB C 13 41.8590 0.0000 A 20 LEU CD1 C 13 25.2610 0.0000 A 20 LEU CD2 C 13 23.1610 0.0000 A 20 LEU CG C 13 26.6820 0.0000 A 20 LEU N N 15 121.5740 0.0000 A 21 ASP H H 1 8.6150 0.0000 A 21 ASP HA H 1 4.3030 0.0000 A 21 ASP HBx H 1 2.3800 0.0000 A 21 ASP HBy H 1 2.8020 0.0000 A 21 ASP CA C 13 57.9120 0.0000 A 21 ASP CB C 13 40.4000 0.0000 A 21 ASP N N 15 121.2220 0.0000 A 22 ILE H H 1 8.6350 0.0000 A 22 ILE HA H 1 3.6300 0.0000 A 22 ILE HB H 1 1.9480 0.0000 A 22 ILE HD1% H 1 0.9250 0.0000 A 22 ILE HG12 H 1 1.0120 0.0000 A 22 ILE HG13 H 1 2.0200 0.0000 A 22 ILE HG2% H 1 0.8400 0.0000 A 22 ILE CA C 13 65.6150 0.0000 A 22 ILE CB C 13 37.8080 0.0000 A 22 ILE CD1 C 13 14.3900 0.0000 A 22 ILE CG1 C 13 31.6500 0.0000 A 22 ILE CG2 C 13 17.5930 0.0000 A 22 ILE N N 15 119.7630 0.0000 A 23 ASN H H 1 7.4410 0.0000 A 23 ASN HA H 1 4.5800 0.0000 A 23 ASN HBy H 1 2.9100 0.0000 A 23 ASN HD2y H 1 7.5780 0.0000 A 23 ASN HD2x H 1 6.8050 0.0000 A 23 ASN CA C 13 55.3570 0.0000 A 23 ASN CB C 13 38.9000 0.0000 A 23 ASN N N 15 115.2880 0.0000 A 23 ASN ND2 N 15 111.2710 0.0000 A 24 LYS H H 1 7.5880 0.0000 A 24 LYS HA H 1 4.3380 0.0000 A 24 LYS HBx H 1 1.9900 0.0000 A 24 LYS HBy H 1 2.0580 0.0000 A 24 LYS HDx H 1 1.6750 0.0000 A 24 LYS HDy H 1 1.7540 0.0000 A 24 LYS HEx H 1 2.9030 0.0000 A 24 LYS HEy H 1 2.9740 0.0000 A 24 LYS HGx H 1 1.4700 0.0000 A 24 LYS HGy H 1 1.7210 0.0000 A 24 LYS CA C 13 56.5190 0.0000 A 24 LYS CB C 13 33.7230 0.0000 A 24 LYS CD C 13 29.7000 0.0000 A 24 LYS CE C 13 42.0690 0.0000 A 24 LYS CG C 13 25.2690 0.0000 A 24 LYS N N 15 116.9560 0.0000 A 25 LEU H H 1 7.4490 0.0000 A 25 LEU HA H 1 4.3240 0.0000 A 25 LEU HBx H 1 1.3730 0.0000 A 25 LEU HBy H 1 1.9760 0.0000 A 25 LEU HDx% H 1 1.0000 0.0000 A 25 LEU HDy% H 1 0.8440 0.0000 A 25 LEU HG H 1 2.1200 0.0000 A 25 LEU CA C 13 53.6440 0.0000 A 25 LEU CB C 13 41.5920 0.0000 A 25 LEU CD1 C 13 26.8670 0.0000 A 25 LEU CD2 C 13 23.6360 0.0000 A 25 LEU CG C 13 26.4230 0.0000 A 25 LEU N N 15 120.1130 0.0000 A 26 PRO HA H 1 4.6300 0.0000 A 26 PRO HBx H 1 2.0500 0.0000 A 26 PRO HBy H 1 2.5100 0.0000 A 26 PRO HDx H 1 3.4100 0.0000 A 26 PRO HDy H 1 3.9500 0.0000 A 26 PRO HGx H 1 2.0490 0.0000 A 26 PRO HGy H 1 2.1900 0.0000 A 26 PRO CA C 13 62.4000 0.0000 A 26 PRO CB C 13 32.8300 0.0000 A 26 PRO CD C 13 50.5560 0.0000 A 26 PRO CG C 13 28.0380 0.0000 A 27 GLY H H 1 8.9830 0.0000 A 27 GLY HAx H 1 3.7530 0.0000 A 27 GLY HAy H 1 4.1000 0.0000 A 27 GLY CA C 13 48.0900 0.0000 A 27 GLY N N 15 109.9210 0.0000 A 28 GLU H H 1 9.4730 0.0000 A 28 GLU HA H 1 4.3260 0.0000 A 28 GLU HBx H 1 2.1100 0.0000 A 28 GLU HBy H 1 2.1700 0.0000 A 28 GLU HGx H 1 2.2800 0.0000 A 28 GLU HGy H 1 2.3570 0.0000 A 28 GLU CA C 13 59.2000 0.0000 A 28 GLU CB C 13 28.9500 0.0000 A 28 GLU CG C 13 36.3060 0.0000 A 28 GLU N N 15 118.9250 0.0000 A 29 LYS H H 1 7.8640 0.0000 A 29 LYS HA H 1 4.6450 0.0000 A 29 LYS HBx H 1 1.9800 0.0000 A 29 LYS HBy H 1 2.4210 0.0000 A 29 LYS HDx H 1 1.7600 0.0000 A 29 LYS HDy H 1 1.8200 0.0000 A 29 LYS HEx H 1 2.9850 0.0000 A 29 LYS HEy H 1 3.0810 0.0000 A 29 LYS HGx H 1 1.5200 0.0000 A 29 LYS HGy H 1 1.5900 0.0000 A 29 LYS CA C 13 56.0000 0.0000 A 29 LYS CB C 13 33.0700 0.0000 A 29 LYS CD C 13 28.2500 0.0000 A 29 LYS CE C 13 42.5400 0.0000 A 29 LYS CG C 13 25.7350 0.0000 A 29 LYS N N 15 116.2020 0.0000 A 30 LEU H H 1 7.8870 0.0000 A 30 LEU HA H 1 4.1100 0.0000 A 30 LEU HBx H 1 1.6000 0.0000 A 30 LEU HBy H 1 1.8500 0.0000 A 30 LEU HDx% H 1 0.9240 0.0000 A 30 LEU HDy% H 1 0.8860 0.0000 A 30 LEU HG H 1 1.7200 0.0000 A 30 LEU CA C 13 57.9700 0.0000 A 30 LEU CB C 13 42.0700 0.0000 A 30 LEU CD1 C 13 24.9000 0.0000 A 30 LEU CD2 C 13 24.0660 0.0000 A 30 LEU CG C 13 27.2540 0.0000 A 30 LEU N N 15 120.6740 0.0000 A 31 GLY H H 1 8.3200 0.0000 A 31 GLY HAx H 1 3.6800 0.0000 A 31 GLY HAy H 1 3.9270 0.0000 A 31 GLY CA C 13 47.4200 0.0000 A 31 GLY N N 15 106.2820 0.0000 A 32 ARG H H 1 7.6090 0.0000 A 32 ARG HA H 1 4.0700 0.0000 A 32 ARG HBx H 1 1.6050 0.0000 A 32 ARG HBy H 1 1.8250 0.0000 A 32 ARG HDx H 1 2.9910 0.0000 A 32 ARG HDy H 1 3.0900 0.0000 A 32 ARG HGx H 1 1.2720 0.0000 A 32 ARG HGy H 1 1.3630 0.0000 A 32 ARG CA C 13 57.6500 0.0000 A 32 ARG CB C 13 29.2800 0.0000 A 32 ARG CD C 13 42.5430 0.0000 A 32 ARG CG C 13 26.6800 0.0000 A 32 ARG N N 15 120.3230 0.0000 A 33 VAL H H 1 7.3820 0.0000 A 33 VAL HA H 1 3.3370 0.0000 A 33 VAL HB H 1 2.6300 0.0000 A 33 VAL HGx% H 1 1.1420 0.0000 A 33 VAL HGy% H 1 0.9010 0.0000 A 33 VAL CA C 13 67.0500 0.0000 A 33 VAL CB C 13 31.2300 0.0000 A 33 VAL CG1 C 13 23.5570 0.0000 A 33 VAL CG2 C 13 21.1010 0.0000 A 33 VAL N N 15 118.6430 0.0000 A 34 VAL H H 1 7.4410 0.0000 A 34 VAL HA H 1 3.3550 0.0000 A 34 VAL HB H 1 2.0400 0.0000 A 34 VAL HGx% H 1 0.8380 0.0000 A 34 VAL HGy% H 1 0.8420 0.0000 A 34 VAL CA C 13 67.1000 0.0000 A 34 VAL CB C 13 31.5900 0.0000 A 34 VAL CG1 C 13 22.9400 0.0000 A 34 VAL CG2 C 13 21.5710 0.0000 A 34 VAL N N 15 116.4820 0.0000 A 35 HIS H H 1 7.7680 0.0000 A 35 HIS HA H 1 4.3200 0.0000 A 35 HIS HBx H 1 3.1700 0.0000 A 35 HIS HBy H 1 3.1700 0.0000 A 35 HIS HD2 H 1 6.8680 0.0000 A 35 HIS HE1 H 1 7.9100 0.0000 A 35 HIS CA C 13 60.1100 0.0000 A 35 HIS CB C 13 30.3200 0.0000 A 35 HIS CD2 C 13 119.7900 0.0000 A 35 HIS CE1 C 13 138.1600 0.0000 A 35 HIS N N 15 118.3610 0.0000 A 36 ILE H H 1 8.4630 0.0000 A 36 ILE HA H 1 3.4400 0.0000 A 36 ILE HB H 1 1.8870 0.0000 A 36 ILE HD1% H 1 0.5200 0.0000 A 36 ILE HG12 H 1 0.9600 0.0000 A 36 ILE HG13 H 1 1.7410 0.0000 A 36 ILE HG2% H 1 0.7300 0.0000 A 36 ILE CA C 13 66.1600 0.0000 A 36 ILE CB C 13 38.2900 0.0000 A 36 ILE CD1 C 13 14.1700 0.0000 A 36 ILE CG1 C 13 29.5300 0.0000 A 36 ILE CG2 C 13 17.1060 0.0000 A 36 ILE N N 15 121.2270 0.0000 A 37 ILE H H 1 7.5940 0.0000 A 37 ILE HA H 1 3.3940 0.0000 A 37 ILE HB H 1 1.8510 0.0000 A 37 ILE HD1% H 1 0.7600 0.0000 A 37 ILE HG12 H 1 0.7800 0.0000 A 37 ILE HG13 H 1 1.8960 0.0000 A 37 ILE HG2% H 1 0.8100 0.0000 A 37 ILE CA C 13 66.6300 0.0000 A 37 ILE CB C 13 38.3000 0.0000 A 37 ILE CD1 C 13 14.5200 0.0000 A 37 ILE CG1 C 13 29.9900 0.0000 A 37 ILE CG2 C 13 18.0600 0.0000 A 37 ILE N N 15 117.1730 0.0000 A 38 GLN H H 1 8.7100 0.0000 A 38 GLN HA H 1 3.7980 0.0000 A 38 GLN HBx H 1 1.9400 0.0000 A 38 GLN HBy H 1 2.0800 0.0000 A 38 GLN HE2y H 1 7.2600 0.0000 A 38 GLN HE2x H 1 6.5860 0.0000 A 38 GLN HGx H 1 2.1500 0.0000 A 38 GLN HGy H 1 2.4980 0.0000 A 38 GLN CA C 13 59.8500 0.0000 A 38 GLN CB C 13 29.2000 0.0000 A 38 GLN CG C 13 35.3760 0.0000 A 38 GLN N N 15 115.5020 0.0000 A 38 GLN NE2 N 15 110.4710 0.0000 A 39 SER H H 1 7.9570 0.0000 A 39 SER HA H 1 4.1390 0.0000 A 39 SER HBx H 1 3.6750 0.0000 A 39 SER HBy H 1 3.8240 0.0000 A 39 SER CA C 13 60.6960 0.0000 A 39 SER CB C 13 63.5350 0.0000 A 39 SER N N 15 110.4750 0.0000 A 40 ARG H H 1 7.4210 0.0000 A 40 ARG HA H 1 4.3820 0.0000 A 40 ARG HBx H 1 1.8430 0.0000 A 40 ARG HBy H 1 2.0490 0.0000 A 40 ARG HDy H 1 3.0950 0.0000 A 40 ARG HGx H 1 1.6840 0.0000 A 40 ARG HGy H 1 1.7820 0.0000 A 40 ARG CA C 13 56.2250 0.0000 A 40 ARG CB C 13 33.1600 0.0000 A 40 ARG CD C 13 42.3930 0.0000 A 40 ARG CG C 13 27.8040 0.0000 A 40 ARG N N 15 118.2080 0.0000 A 41 GLU H H 1 7.7090 0.0000 A 41 GLU HA H 1 4.8750 0.0000 A 41 GLU HBx H 1 1.9360 0.0000 A 41 GLU HBy H 1 2.0410 0.0000 A 41 GLU HGx H 1 2.2000 0.0000 A 41 GLU HGy H 1 2.2490 0.0000 A 41 GLU CA C 13 53.2500 0.0000 A 41 GLU CB C 13 29.0700 0.0000 A 41 GLU CG C 13 35.6780 0.0000 A 41 GLU N N 15 118.1530 0.0000 A 42 PRO HA H 1 4.3400 0.0000 A 42 PRO HBx H 1 1.9910 0.0000 A 42 PRO HBy H 1 2.3610 0.0000 A 42 PRO HDx H 1 3.7350 0.0000 A 42 PRO HDy H 1 3.8300 0.0000 A 42 PRO HGx H 1 2.0000 0.0000 A 42 PRO HGy H 1 2.0750 0.0000 A 42 PRO CA C 13 64.7300 0.0000 A 42 PRO CB C 13 32.3030 0.0000 A 42 PRO CD C 13 50.8800 0.0000 A 42 PRO CG C 13 27.7770 0.0000 A 43 SER H H 1 8.3860 0.0000 A 43 SER HA H 1 4.3480 0.0000 A 43 SER HBx H 1 3.9100 0.0000 A 43 SER HBy H 1 3.9610 0.0000 A 43 SER CA C 13 60.0350 0.0000 A 43 SER CB C 13 63.2400 0.0000 A 43 SER N N 15 112.0800 0.0000 A 44 LEU H H 1 7.9680 0.0000 A 44 LEU HA H 1 4.5700 0.0000 A 44 LEU HBx H 1 1.6200 0.0000 A 44 LEU HBy H 1 1.7060 0.0000 A 44 LEU HDx% H 1 0.8360 0.0000 A 44 LEU HDy% H 1 0.8520 0.0000 A 44 LEU HG H 1 1.6360 0.0000 A 44 LEU CA C 13 54.5600 0.0000 A 44 LEU CB C 13 42.3600 0.0000 A 44 LEU CD1 C 13 25.9710 0.0000 A 44 LEU CD2 C 13 23.1310 0.0000 A 44 LEU CG C 13 26.9180 0.0000 A 44 LEU N N 15 121.5780 0.0000 A 45 LYS H H 1 7.7130 0.0000 A 45 LYS HA H 1 4.1100 0.0000 A 45 LYS HBx H 1 1.7950 0.0000 A 45 LYS HBy H 1 1.9070 0.0000 A 45 LYS HDy H 1 1.6600 0.0000 A 45 LYS HEy H 1 2.9700 0.0000 A 45 LYS HGy H 1 1.4230 0.0000 A 45 LYS CA C 13 58.5000 0.0000 A 45 LYS CB C 13 33.1700 0.0000 A 45 LYS CD C 13 28.9600 0.0000 A 45 LYS CE C 13 42.3000 0.0000 A 45 LYS CG C 13 24.7800 0.0000 A 45 LYS N N 15 121.4550 0.0000 A 45 LYS HGx H 1 1.3690 0.0000 A 46 ASN H H 1 8.3700 0.0000 A 46 ASN HA H 1 4.8310 0.0000 A 46 ASN HBx H 1 2.7050 0.0000 A 46 ASN HBy H 1 2.9150 0.0000 A 46 ASN HD2x H 1 7.6290 0.0000 A 46 ASN HD2y H 1 6.9570 0.0000 A 46 ASN CA C 13 53.4000 0.0000 A 46 ASN CB C 13 38.9400 0.0000 A 46 ASN N N 15 116.2710 0.0000 A 46 ASN ND2 N 15 112.5550 0.0000 A 46 LEU HD11 H 1 0.9390 0.0000 A 46 LEU HD12 H 1 0.9390 0.0000 A 46 LEU HD13 H 1 0.9390 0.0000 A 46 LEU HD23 H 1 0.8830 0.0000 A 46 LEU HG H 1 1.5530 0.0000 A 46 LEU CD1 C 13 24.7210 0.0000 A 46 LEU CD2 C 13 24.0450 0.0000 A 46 LEU CG C 13 27.0770 0.0000 A 47 SER H H 1 7.7900 0.0000 A 47 SER HA H 1 4.3900 0.0000 A 47 SER HBx H 1 3.7600 0.0000 A 47 SER HBy H 1 3.8300 0.0000 A 47 SER CA C 13 59.1200 0.0000 A 47 SER CB C 13 64.1300 0.0000 A 47 SER N N 15 115.5680 0.0000 A 47 ARG HD3 H 1 3.1550 0.0000 A 47 ARG HE H 1 7.3700 0.0000 A 47 ARG HG3 H 1 1.5850 0.0000 A 47 ARG CD C 13 43.3000 0.0000 A 48 ASN H H 1 8.6600 0.0000 A 48 ASN HA H 1 4.9400 0.0000 A 48 ASN HBx H 1 2.7700 0.0000 A 48 ASN HBy H 1 2.9400 0.0000 A 48 ASN HD2y H 1 7.7290 0.0000 A 48 ASN HD2x H 1 7.1330 0.0000 A 48 ASN CA C 13 51.4500 0.0000 A 48 ASN CB C 13 39.2800 0.0000 A 48 ASN N N 15 122.0000 0.0000 A 48 ASN ND2 N 15 112.8120 0.0000 A 49 PRO HA H 1 4.2200 0.0000 A 49 PRO HBx H 1 1.9870 0.0000 A 49 PRO HBy H 1 2.2620 0.0000 A 49 PRO HDx H 1 3.8490 0.0000 A 49 PRO HDy H 1 3.9260 0.0000 A 49 PRO HGy H 1 2.0200 0.0000 A 49 PRO CA C 13 64.8000 0.0000 A 49 PRO CB C 13 32.0500 0.0000 A 49 PRO CD C 13 51.0650 0.0000 A 49 PRO CG C 13 27.2600 0.0000 A 50 ASP H H 1 8.1340 0.0000 A 50 ASP HA H 1 4.5720 0.0000 A 50 ASP HBx H 1 2.6190 0.0000 A 50 ASP HBy H 1 2.7290 0.0000 A 50 ASP CA C 13 55.1000 0.0000 A 50 ASP CB C 13 41.6000 0.0000 A 50 ASP N N 15 114.7510 0.0000 A 51 GLU H H 1 7.7340 0.0000 A 51 GLU HA H 1 4.5600 0.0000 A 51 GLU HBx H 1 1.8620 0.0000 A 51 GLU HBy H 1 2.1100 0.0000 A 51 GLU HGy H 1 2.1200 0.0000 A 51 GLU CA C 13 55.7040 0.0000 A 51 GLU CB C 13 32.0680 0.0000 A 51 GLU CG C 13 36.3800 0.0000 A 51 GLU N N 15 117.0320 0.0000 A 52 ILE H H 1 7.6200 0.0000 A 52 ILE HA H 1 4.1800 0.0000 A 52 ILE HB H 1 1.7900 0.0000 A 52 ILE HD1% H 1 0.7870 0.0000 A 52 ILE HG12 H 1 1.0930 0.0000 A 52 ILE HG13 H 1 1.5240 0.0000 A 52 ILE HG2% H 1 0.8220 0.0000 A 52 ILE CA C 13 61.1500 0.0000 A 52 ILE CB C 13 39.9000 0.0000 A 52 ILE CD1 C 13 14.4200 0.0000 A 52 ILE CG1 C 13 27.8400 0.0000 A 52 ILE CG2 C 13 17.2600 0.0000 A 52 ILE N N 15 120.3250 0.0000 A 53 GLU H H 1 8.3310 0.0000 A 53 GLU HA H 1 4.6400 0.0000 A 53 GLU HBx H 1 1.8080 0.0000 A 53 GLU HBy H 1 1.8900 0.0000 A 53 GLU HGx H 1 1.9920 0.0000 A 53 GLU HGy H 1 2.1200 0.0000 A 53 GLU CA C 13 55.0400 0.0000 A 53 GLU CB C 13 31.4200 0.0000 A 53 GLU CG C 13 36.7900 0.0000 A 53 GLU N N 15 125.8400 0.0000 A 54 ILE H H 1 8.5490 0.0000 A 54 ILE HA H 1 3.8850 0.0000 A 54 ILE HB H 1 1.5930 0.0000 A 54 ILE HD1% H 1 0.6650 0.0000 A 54 ILE HG12 H 1 0.8340 0.0000 A 54 ILE HG13 H 1 1.4500 0.0000 A 54 ILE HG2% H 1 0.4100 0.0000 A 54 ILE CA C 13 61.0600 0.0000 A 54 ILE CB C 13 39.3600 0.0000 A 54 ILE CD1 C 13 13.5130 0.0000 A 54 ILE CG1 C 13 27.3000 0.0000 A 54 ILE CG2 C 13 17.6000 0.0000 A 54 ILE N N 15 124.1610 0.0000 A 55 ASP H H 1 8.6750 0.0000 A 55 ASP HA H 1 4.8300 0.0000 A 55 ASP HBx H 1 2.3540 0.0000 A 55 ASP HBy H 1 2.9870 0.0000 A 55 ASP CA C 13 52.0190 0.0000 A 55 ASP CB C 13 41.2410 0.0000 A 55 ASP N N 15 126.1100 0.0000 A 56 PHE H H 1 8.8930 0.0000 A 56 PHE HA H 1 4.1200 0.0000 A 56 PHE HBx H 1 2.9400 0.0000 A 56 PHE HBy H 1 3.0800 0.0000 A 56 PHE HDx H 1 7.1100 0.0000 A 56 PHE HEx H 1 7.0500 0.0000 A 56 PHE HZ H 1 6.9700 0.0000 A 56 PHE CA C 13 59.7400 0.0000 A 56 PHE CB C 13 38.8200 0.0000 A 56 PHE CDx C 13 131.6000 0.0000 A 56 PHE CEx C 13 130.8900 0.0000 A 56 PHE CZ C 13 128.6640 0.0000 A 56 PHE N N 15 123.8110 0.0000 A 57 GLU H H 1 8.5170 0.0000 A 57 GLU HA H 1 4.2790 0.0000 A 57 GLU HBx H 1 2.2050 0.0000 A 57 GLU HBy H 1 2.2210 0.0000 A 57 GLU HGx H 1 2.3950 0.0000 A 57 GLU HGy H 1 2.4820 0.0000 A 57 GLU CA C 13 57.8500 0.0000 A 57 GLU CB C 13 29.6000 0.0000 A 57 GLU CG C 13 36.9550 0.0000 A 57 GLU N N 15 113.9620 0.0000 A 58 THR H H 1 7.5070 0.0000 A 58 THR HA H 1 4.5060 0.0000 A 58 THR HB H 1 4.4460 0.0000 A 58 THR HG2% H 1 1.1380 0.0000 A 58 THR CA C 13 61.4500 0.0000 A 58 THR CB C 13 69.8400 0.0000 A 58 THR CG2 C 13 21.7820 0.0000 A 58 THR N N 15 106.1320 0.0000 A 59 LEU H H 1 6.7510 0.0000 A 59 LEU HA H 1 4.3820 0.0000 A 59 LEU HBx H 1 1.2910 0.0000 A 59 LEU HBy H 1 1.5740 0.0000 A 59 LEU HDx% H 1 0.6250 0.0000 A 59 LEU HDy% H 1 0.7700 0.0000 A 59 LEU HG H 1 1.9110 0.0000 A 59 LEU CA C 13 54.3500 0.0000 A 59 LEU CB C 13 43.5000 0.0000 A 59 LEU CD1 C 13 26.1740 0.0000 A 59 LEU CD2 C 13 23.6000 0.0000 A 59 LEU CG C 13 26.4370 0.0000 A 59 LEU N N 15 120.6000 0.0000 A 60 LYS H H 1 10.0710 0.0000 A 60 LYS HA H 1 4.4500 0.0000 A 60 LYS HBx H 1 1.8640 0.0000 A 60 LYS HBy H 1 2.0400 0.0000 A 60 LYS HDx H 1 1.6900 0.0000 A 60 LYS HDy H 1 1.8040 0.0000 A 60 LYS HEx H 1 3.0400 0.0000 A 60 LYS HEy H 1 3.0790 0.0000 A 60 LYS HGx H 1 1.7040 0.0000 A 60 LYS HGy H 1 2.0600 0.0000 A 60 LYS CA C 13 55.8060 0.0000 A 60 LYS CB C 13 32.1050 0.0000 A 60 LYS CD C 13 29.5950 0.0000 A 60 LYS CE C 13 42.3800 0.0000 A 60 LYS CG C 13 25.6460 0.0000 A 60 LYS N N 15 123.2590 0.0000 A 61 PRO HA H 1 4.1830 0.0000 A 61 PRO HBx H 1 1.9560 0.0000 A 61 PRO HBy H 1 2.1340 0.0000 A 61 PRO HDx H 1 3.9100 0.0000 A 61 PRO HDy H 1 4.0200 0.0000 A 61 PRO HGx H 1 2.1350 0.0000 A 61 PRO HGy H 1 2.2720 0.0000 A 61 PRO CA C 13 66.4200 0.0000 A 61 PRO CB C 13 32.1100 0.0000 A 61 PRO CD C 13 50.5600 0.0000 A 61 PRO CG C 13 27.9690 0.0000 A 62 SER H H 1 8.5630 0.0000 A 62 SER HA H 1 4.3140 0.0000 A 62 SER HBx H 1 3.9600 0.0000 A 62 SER HBy H 1 4.0300 0.0000 A 62 SER CA C 13 60.7200 0.0000 A 62 SER CB C 13 61.9600 0.0000 A 62 SER N N 15 109.5750 0.0000 A 63 THR H H 1 7.4330 0.0000 A 63 THR HA H 1 3.7870 0.0000 A 63 THR HB H 1 4.5150 0.0000 A 63 THR HG2% H 1 1.1900 0.0000 A 63 THR CA C 13 65.9600 0.0000 A 63 THR CB C 13 67.3500 0.0000 A 63 THR CG2 C 13 24.5510 0.0000 A 63 THR N N 15 122.1450 0.0000 A 63 LYS HB3 H 1 1.6450 0.0000 A 63 LYS HD3 H 1 1.5780 0.0000 A 63 LYS HE3 H 1 2.9390 0.0000 A 63 THR HG2% H 1 1.1900 0.0000 A 63 LYS HG3 H 1 1.2660 0.0000 A 63 LYS CD C 13 29.2120 0.0000 A 63 LYS CG% C 13 24.7650 0.0000 A 64 LEU H H 1 7.8790 0.0000 A 64 LEU HA H 1 3.7700 0.0000 A 64 LEU HBx H 1 1.6150 0.0000 A 64 LEU HBy H 1 1.9700 0.0000 A 64 LEU HDx% H 1 0.9090 0.0000 A 64 LEU HDy% H 1 0.6800 0.0000 A 64 LEU HG H 1 1.5400 0.0000 A 64 LEU CA C 13 58.7200 0.0000 A 64 LEU CB C 13 41.1220 0.0000 A 64 LEU CD1 C 13 26.4220 0.0000 A 64 LEU CD2 C 13 24.5510 0.0000 A 64 LEU CG C 13 26.9640 0.0000 A 64 LEU N N 15 120.3400 0.0000 A 65 ARG H H 1 8.3640 0.0000 A 65 ARG HA H 1 4.1920 0.0000 A 65 ARG HBx H 1 1.9700 0.0000 A 65 ARG HBy H 1 2.0820 0.0000 A 65 ARG HDx H 1 3.1390 0.0000 A 65 ARG HDy H 1 3.1730 0.0000 A 65 ARG HGx H 1 1.7800 0.0000 A 65 ARG HGy H 1 1.8530 0.0000 A 65 ARG CA C 13 57.8500 0.0000 A 65 ARG CB C 13 29.2400 0.0000 A 65 ARG CD C 13 42.7800 0.0000 A 65 ARG CG C 13 26.4620 0.0000 A 65 ARG N N 15 115.4320 0.0000 A 65 ARG HE H 1 7.3280 0.0000 A 66 GLU H H 1 7.8550 0.0000 A 66 GLU HA H 1 4.2370 0.0000 A 66 GLU HBx H 1 2.0650 0.0000 A 66 GLU HBy H 1 2.1490 0.0000 A 66 GLU HGy H 1 2.2860 0.0000 A 66 GLU CA C 13 59.7450 0.0000 A 66 GLU CB C 13 29.0200 0.0000 A 66 GLU CG C 13 35.9200 0.0000 A 66 GLU N N 15 122.2050 0.0000 A 66 TYR HD1 H 1 7.0620 0.0000 A 66 TYR HD2 H 1 7.0690 0.0000 A 66 TYR HE1 H 1 6.7910 0.0000 A 66 TYR HE2 H 1 6.7950 0.0000 A 66 TYR CD1 C 13 133.2800 0.0000 A 66 TYR CE1 C 13 118.1900 0.0000 A 67 LEU H H 1 8.4500 0.0000 A 67 LEU HA H 1 4.1580 0.0000 A 67 LEU HBx H 1 1.3890 0.0000 A 67 LEU HBy H 1 2.2530 0.0000 A 67 LEU HDx% H 1 0.8390 0.0000 A 67 LEU HDy% H 1 0.9940 0.0000 A 67 LEU HG H 1 1.9360 0.0000 A 67 LEU CA C 13 58.1860 0.0000 A 67 LEU CB C 13 42.9200 0.0000 A 67 LEU CD1 C 13 25.7300 0.0000 A 67 LEU CD2 C 13 24.9800 0.0000 A 67 LEU CG C 13 26.6800 0.0000 A 67 LEU N N 15 119.4600 0.0000 A 68 GLU H H 1 8.6240 0.0000 A 68 GLU HA H 1 3.8400 0.0000 A 68 GLU HBx H 1 1.9520 0.0000 A 68 GLU HBy H 1 2.4280 0.0000 A 68 GLU HGx H 1 2.1270 0.0000 A 68 GLU HGy H 1 2.2450 0.0000 A 68 GLU CA C 13 59.9820 0.0000 A 68 GLU CB C 13 30.3900 0.0000 A 68 GLU CG C 13 36.1800 0.0000 A 68 GLU N N 15 119.8380 0.0000 A 69 ARG H H 1 8.1010 0.0000 A 69 ARG HA H 1 4.0200 0.0000 A 69 ARG HBx H 1 1.9590 0.0000 A 69 ARG HBy H 1 2.0590 0.0000 A 69 ARG HDx H 1 3.2500 0.0000 A 69 ARG HDy H 1 3.3180 0.0000 A 69 ARG HGx H 1 1.6200 0.0000 A 69 ARG HGy H 1 1.9150 0.0000 A 69 ARG CA C 13 60.0600 0.0000 A 69 ARG CB C 13 30.5800 0.0000 A 69 ARG CD C 13 43.6380 0.0000 A 69 ARG CG C 13 28.0380 0.0000 A 69 ARG N N 15 119.9560 0.0000 A 69 ARG HE H 1 7.3080 0.0000 A 70 TYR H H 1 8.1560 0.0000 A 70 TYR HA H 1 4.3410 0.0000 A 70 TYR HBx H 1 2.9580 0.0000 A 70 TYR HBy H 1 3.3760 0.0000 A 70 TYR HDy H 1 6.9480 0.0000 A 70 LYS HDx H 1 1.6500 0.0000 A 70 TYR HEx H 1 6.7400 0.0000 A 70 TYR CA C 13 61.6100 0.0000 A 70 TYR CB C 13 38.4560 0.0000 A 70 TYR CDx C 13 132.5200 0.0000 A 70 TYR CEx C 13 118.4400 0.0000 A 70 TYR N N 15 120.0870 0.0000 A 70 LYS HD3 H 1 1.6370 0.0000 A 70 LYS HE3 H 1 2.9520 0.0000 A 70 LYS HG3 H 1 1.3340 0.0000 A 70 LYS CD% C 13 29.2420 0.0000 A 70 LYS CG C 13 23.8870 0.0000 A 71 VAL H H 1 9.2230 0.0000 A 71 VAL HA H 1 3.2240 0.0000 A 71 VAL HB H 1 2.1440 0.0000 A 71 VAL HGx% H 1 1.1600 0.0000 A 71 VAL HGy% H 1 0.9300 0.0000 A 71 VAL CA C 13 67.5500 0.0000 A 71 VAL CB C 13 31.5200 0.0000 A 71 VAL CG1 C 13 23.9640 0.0000 A 71 VAL CG2 C 13 22.4200 0.0000 A 71 VAL N N 15 120.3130 0.0000 A 72 THR H H 1 8.3730 0.0000 A 72 THR HA H 1 3.7980 0.0000 A 72 THR HB H 1 4.2320 0.0000 A 72 THR HG2% H 1 1.2290 0.0000 A 72 THR CA C 13 67.0950 0.0000 A 72 THR CB C 13 68.6250 0.0000 A 72 THR CG2 C 13 21.8600 0.0000 A 72 THR N N 15 114.7150 0.0000 A 73 SER H H 1 7.6130 0.0000 A 73 SER HA H 1 4.2350 0.0000 A 73 SER HBy H 1 4.0230 0.0000 A 73 SER CA C 13 61.3050 0.0000 A 73 SER CB C 13 62.9440 0.0000 A 73 SER N N 15 116.1270 0.0000 A 73 TRP HD1 H 1 7.2570 0.0000 A 73 TRP HE3 H 1 7.5400 0.0000 A 73 TRP HH2 H 1 7.1350 0.0000 A 73 TRP HZ2 H 1 7.4140 0.0000 A 73 TRP HZ3 H 1 7.0100 0.0000 A 73 TRP CD1 C 13 127.2530 0.0000 A 73 TRP CE3 C 13 120.7620 0.0000 A 73 TRP CH2 C 13 124.6980 0.0000 A 73 TRP CZ2 C 13 114.7320 0.0000 A 73 TRP CZ3 C 13 121.9800 0.0000 A 74 CYS H H 1 7.6220 0.0000 A 74 CYS HA H 1 4.1590 0.0000 A 74 CYS HBx H 1 2.4200 0.0000 A 74 CYS HBy H 1 2.8630 0.0000 A 74 CYS CA C 13 62.1200 0.0000 A 74 CYS CB C 13 27.8400 0.0000 A 74 CYS N N 15 118.0120 0.0000 A 75 LEU H H 1 7.7380 0.0000 A 75 LEU HA H 1 4.2840 0.0000 A 75 LEU HBx H 1 1.5170 0.0000 A 75 LEU HBy H 1 1.6770 0.0000 A 75 LEU HDx% H 1 0.8050 0.0000 A 75 LEU HDy% H 1 0.7610 0.0000 A 75 LEU HG H 1 1.6750 0.0000 A 75 LEU CA C 13 55.7000 0.0000 A 75 LEU CB C 13 42.3000 0.0000 A 75 LEU CD1 C 13 26.0350 0.0000 A 75 LEU CD2 C 13 22.6400 0.0000 A 75 LEU CG C 13 26.9180 0.0000 A 75 LEU N N 15 117.8730 0.0000 A 76 ARG H H 1 7.8140 0.0000 A 76 ARG HA H 1 4.2260 0.0000 A 76 ARG HBy H 1 1.8600 0.0000 A 76 ARG HDx H 1 3.1500 0.0000 A 76 ARG HDy H 1 3.1900 0.0000 A 76 ARG HGy H 1 1.6500 0.0000 A 76 ARG CA C 13 57.1500 0.0000 A 76 ARG CB C 13 30.2700 0.0000 A 76 ARG CD C 13 43.5240 0.0000 A 76 ARG CG C 13 27.3660 0.0000 A 76 ARG N N 15 118.7170 0.0000 A 77 LYS H H 1 7.9440 0.0000 A 77 LYS HA H 1 4.2500 0.0000 A 77 LYS HBx H 1 1.7450 0.0000 A 77 LYS HBy H 1 1.8260 0.0000 A 77 LYS HDy H 1 1.6980 0.0000 A 77 LYS HEy H 1 2.9680 0.0000 A 77 LYS HGy H 1 1.4400 0.0000 A 77 LYS CA C 13 56.4800 0.0000 A 77 LYS CB C 13 33.1900 0.0000 A 77 LYS CD C 13 29.4300 0.0000 A 77 LYS CG C 13 24.7880 0.0000 A 77 LYS N N 15 120.3210 0.0000 A 78 LYS H H 1 8.2150 0.0000 A 78 LYS HA H 1 4.2600 0.0000 A 78 LYS HBy H 1 1.7600 0.0000 A 78 LYS HDy H 1 1.7010 0.0000 A 78 LYS HEy H 1 2.9700 0.0000 A 78 LYS HGy H 1 1.4670 0.0000 A 78 LYS CA C 13 56.5500 0.0000 A 78 LYS CB C 13 33.2100 0.0000 A 78 LYS CD C 13 29.2860 0.0000 A 78 LYS CG C 13 25.0250 0.0000 A 78 LYS N N 15 121.7830 0.0000 A 79 ARG H H 1 8.3440 0.0000 A 79 ARG HA H 1 4.3000 0.0000 A 79 ARG HBx H 1 1.7420 0.0000 A 79 ARG HBy H 1 1.8200 0.0000 A 79 ARG HDy H 1 3.1730 0.0000 A 79 ARG HGy H 1 1.6270 0.0000 A 79 ARG CA C 13 56.3100 0.0000 A 79 ARG CB C 13 31.1100 0.0000 A 79 ARG CD C 13 43.4000 0.0000 A 79 ARG CG C 13 27.6300 0.0000 A 79 ARG N N 15 122.3460 0.0000 A 80 LYS H H 1 8.4290 0.0000 A 80 LYS HA H 1 4.5820 0.0000 A 80 LYS HBy H 1 1.7200 0.0000 A 80 LYS HEy H 1 2.9950 0.0000 A 80 LYS HGy H 1 1.5800 0.0000 A 80 LYS CA C 13 54.6400 0.0000 A 80 LYS CB C 13 32.6000 0.0000 A 80 LYS CD C 13 29.2000 0.0000 A 80 LYS CG C 13 27.3300 0.0000 A 80 LYS N N 15 123.9610 0.0000 A 81 PRO HA H 1 4.4080 0.0000 A 81 PRO HBx H 1 1.9360 0.0000 A 81 PRO HBy H 1 2.3050 0.0000 A 81 PRO HDx H 1 3.6570 0.0000 A 81 PRO HDy H 1 3.8290 0.0000 A 81 PRO HGy H 1 2.0070 0.0000 A 81 PRO CA C 13 63.3600 0.0000 A 81 PRO CB C 13 32.1600 0.0000 A 81 PRO CD C 13 50.8200 0.0000 A 81 PRO CG C 13 27.7800 0.0000 A 82 GLN H H 1 8.4450 0.0000 A 82 GLN HA H 1 4.4070 0.0000 A 82 GLN HBx H 1 1.7520 0.0000 A 82 GLN HBy H 1 2.1120 0.0000 A 82 GLN HGy H 1 1.9100 0.0000 A 82 GLN CA C 13 56.0600 0.0000 A 82 GLN CB C 13 29.8300 0.0000 A 82 GLN CG C 13 35.0000 0.0000 A 82 GLN N N 15 120.4630 0.0000 A 83 ALA H H 1 8.0070 0.0000 A 83 ALA HA H 1 4.1300 0.0000 A 83 ALA HB% H 1 1.3280 0.0000 A 83 ALA CA C 13 54.2200 0.0000 A 83 ALA CB C 13 20.3700 0.0000 A 83 ALA N N 15 130.7910 0.0000 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 B 353 GLN H B 349 LYS O 1.0 1.3 2.3 2 2 B 349 LYS O B 353 GLN N 1.0 2.3 3.3 3 3 B 354 LEU H B 350 VAL O 1.0 1.3 2.3 4 4 B 350 VAL O B 354 LEU N 1.0 2.3 3.3 5 5 B 355 LYS H B 351 SER O 1.0 1.3 2.4 6 6 B 351 SER O B 355 LYS N 1.0 2.3 3.3 7 7 B 356 CYS H B 352 GLU O 1.0 1.3 2.4 8 8 B 352 GLU O B 356 CYS N 1.0 2.3 3.3 9 9 B 357 CYS H B 353 GLN O 1.0 1.3 2.3 10 10 B 353 GLN O B 357 CYS N 1.0 2.3 3.3 11 11 B 358 SER H B 354 LEU O 1.0 1.3 2.3 12 12 B 354 LEU O B 358 SER N 1.0 2.3 3.3 13 13 B 359 GLY H B 355 LYS O 1.0 1.3 2.4 14 14 B 355 LYS O B 359 GLY N 1.0 2.3 3.4 15 15 B 360 ILE H B 356 CYS O 1.0 1.3 2.3 16 16 B 356 CYS O B 360 ILE N 1.0 2.3 3.3 17 17 B 361 LEU H B 357 CYS O 1.0 1.3 2.3 18 18 B 357 CYS O B 361 LEU N 1.0 2.3 3.3 19 19 B 362 LYS H B 358 SER O 1.0 1.3 2.3 20 20 B 358 SER O B 362 LYS N 1.0 2.3 3.3 21 21 B 363 GLU H B 359 GLY O 1.0 1.4 2.5 22 22 B 359 GLY O B 363 GLU N 1.0 2.3 3.4 23 23 B 364 MET H B 360 ILE O 1.0 1.3 2.4 24 24 B 360 ILE O B 364 MET N 1.0 2.3 3.3 25 25 B 365 PHE H B 361 LEU O 1.0 1.3 2.3 26 26 B 361 LEU O B 365 PHE N 1.0 2.3 3.3 27 27 B 403 ILE H B 399 ASP O 1.0 1.3 2.3 28 28 B 399 ASP O B 403 ILE N 1.0 2.3 3.3 29 29 B 404 LYS H B 400 MET O 1.0 1.6 2.6 30 30 B 400 MET O B 404 LYS N 1.0 2.3 3.3 31 31 B 405 SER H B 401 SER O 1.0 1.3 2.3 32 32 B 401 SER O B 405 SER N 1.0 2.3 3.3 33 33 B 406 LYS H B 402 THR O 1.0 1.3 2.4 34 34 B 402 THR O B 406 LYS N 1.0 2.3 3.3 35 35 B 407 LEU H B 403 ILE O 1.0 1.3 2.3 36 36 B 403 ILE O B 407 LEU N 1.0 2.3 3.3 37 37 B 408 GLU H B 404 LYS O 1.0 1.3 2.3 38 38 B 404 LYS O B 408 GLU N 1.0 2.3 3.3 39 39 B 409 ALA H B 405 SER O 1.0 1.3 2.3 40 40 B 405 SER O B 409 ALA N 1.0 2.3 3.3 41 41 B 410 ARG H B 406 LYS O 1.0 1.3 2.3 42 42 B 406 LYS O B 410 ARG N 1.0 2.3 3.3 43 43 B 418 PHE H B 414 ASP O 1.0 1.3 2.5 44 44 B 414 ASP O B 418 PHE N 1.0 2.3 3.5 45 45 B 419 GLY H B 415 ALA O 1.0 1.3 2.3 46 46 B 415 ALA O B 419 GLY N 1.0 2.3 3.3 47 47 B 420 ALA H B 416 GLN O 1.0 1.3 2.5 48 48 B 416 GLN O B 420 ALA N 1.0 2.3 3.3 49 49 B 421 ASP H B 417 GLU O 1.0 1.3 2.4 50 50 B 417 GLU O B 421 ASP N 1.0 2.3 3.3 51 51 B 422 VAL H B 418 PHE O 1.0 1.3 2.3 52 52 B 418 PHE O B 422 VAL N 1.0 2.3 3.3 53 53 B 423 ARG H B 419 GLY O 1.0 1.4 2.5 54 54 B 419 GLY O B 423 ARG N 1.0 2.3 3.4 55 55 B 424 LEU H B 420 ALA O 1.0 1.3 2.4 56 56 B 420 ALA O B 424 LEU N 1.0 2.3 3.3 57 57 B 425 MET H B 421 ASP O 1.0 1.5 2.5 58 58 B 421 ASP O B 425 MET N 1.0 2.5 3.5 59 59 B 426 PHE H B 422 VAL O 1.0 1.3 2.3 60 60 B 422 VAL O B 426 PHE N 1.0 2.3 3.3 61 61 B 427 SER H B 423 ARG O 1.0 1.3 2.3 62 62 B 423 ARG O B 427 SER N 1.0 2.3 3.3 63 63 B 428 ASN H B 424 LEU O 1.0 1.3 2.3 64 64 B 424 LEU O B 428 ASN N 1.0 2.3 3.3 65 65 B 429 CYS H B 425 MET O 1.0 1.7 2.7 66 66 B 425 MET O B 429 CYS N 1.0 2.7 3.7 67 67 B 430 TYR H B 426 PHE O 1.0 1.6 2.6 68 68 B 426 PHE O B 430 TYR N 1.0 2.6 3.6 69 69 B 431 LYS H B 427 SER O 1.0 1.4 2.7 70 70 B 427 SER O B 431 LYS N 1.0 2.3 3.3 71 71 B 432 TYR H B 428 ASN O 1.0 1.3 2.4 72 72 B 428 ASN O B 432 TYR N 1.0 2.3 3.4 73 73 B 433 ASN H B 429 CYS O 1.0 1.3 2.5 74 74 B 429 CYS O B 433 ASN N 1.0 2.3 3.4 75 75 B 441 ALA H B 437 HIS O 1.0 1.3 2.4 76 76 B 437 HIS O B 441 ALA N 1.0 2.3 3.3 77 77 B 442 MET H B 438 GLU O 1.0 1.3 2.3 78 78 B 438 GLU O B 442 MET N 1.0 2.3 3.3 79 79 B 443 ALA H B 439 VAL O 1.0 1.3 2.3 80 80 B 439 VAL O B 443 ALA N 1.0 2.3 3.3 81 81 B 444 ARG H B 440 VAL O 1.0 1.3 2.3 82 82 B 440 VAL O B 444 ARG N 1.0 2.3 3.3 83 83 B 445 LYS H B 441 ALA O 1.0 1.7 2.7 84 84 B 441 ALA O B 445 LYS N 1.0 2.7 3.7 85 85 B 446 LEU H B 442 MET O 1.0 1.3 2.3 86 86 B 442 MET O B 446 LEU N 1.0 2.3 3.3 87 87 B 447 GLN H B 443 ALA O 1.0 1.3 2.4 88 88 B 443 ALA O B 447 GLN N 1.0 2.3 3.4 89 89 B 448 ASP H B 444 ARG O 1.0 1.3 2.6 90 90 B 444 ARG O B 448 ASP N 1.0 2.3 3.3 91 91 B 449 VAL H B 445 LYS O 1.0 1.3 2.4 92 92 B 445 LYS O B 449 VAL N 1.0 2.3 3.4 93 93 B 450 PHE H B 446 LEU O 1.0 1.3 2.3 94 94 B 446 LEU O B 450 PHE N 1.0 2.3 3.3 95 95 B 451 GLU H B 447 GLN O 1.0 1.3 2.3 96 96 B 447 GLN O B 451 GLU N 1.0 2.3 3.3 97 97 B 452 MET H B 448 ASP O 1.0 1.3 2.4 98 98 B 448 ASP O B 452 MET N 1.0 2.3 3.3 99 99 B 453 ARG H B 449 VAL O 1.0 1.3 2.3 100 100 B 449 VAL O B 453 ARG N 1.0 2.3 3.3 101 101 B 454 PHE H B 450 PHE O 1.0 1.3 2.3 102 102 B 450 PHE O B 454 PHE N 1.0 2.3 3.3 103 103 B 455 ALA H B 451 GLU O 1.0 1.3 2.4 104 104 B 451 GLU O B 455 ALA N 1.0 2.3 3.3 105 105 B 456 LYS H B 452 MET O 1.0 1.5 2.9 106 106 B 452 MET O B 456 LYS N 1.0 2.3 3.7 107 107 B 377 TYR H B 373 ALA O 1.0 1.3 2.3 108 108 B 373 ALA O B 377 TYR N 1.0 2.3 3.3 109 109 B 394 ILE H B 390 TYR O 1.0 1.3 2.3 110 110 B 390 TYR O B 394 ILE N 1.0 2.3 3.3 111 111 B 400 MET H B 376 PHE O 1.0 1.3 2.3 112 112 B 376 PHE O B 400 MET N 1.0 2.3 3.3 113 113 B 401 SER N B 377 TYR O 1.0 2.3 3.6 114 114 B 453 ARG NHy B 363 GLU OE2 1.0 2.3 3.5 115 115 B 412 TYR OH B 421 ASP OD2 1.0 2.5 3.6 116 116 B 430 TYR OH B 447 GLN OE1 1.0 2.3 3.5 117 117 B 432 TYR OH B 389 ASP OD2 1.0 2.3 3.5 118 118 B 389 ASP OD2 B 432 TYR HH 1.0 1.3 2.5 119 119 B 428 ASN HD2y B 396 HIS O 1.0 1.5 2.7 120 120 B 353 GLN HE2y B 458 PRO O 1.0 1.5 2.7 121 121 B 377 TYR HH B 365 PHE O 1.0 1.5 2.7 122 122 B 402 THR HG1 B 399 ASP OD2 1.0 1.5 2.7 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 B 349 LYS N B 349 LYS CA B 349 LYS C B 350 VAL N 1.0 -64.0 6.0 PSI 2 2 B 349 LYS C B 350 VAL N B 350 VAL CA B 350 VAL C 1.0 -94.0 -34.0 PHI 3 3 B 350 VAL N B 350 VAL CA B 350 VAL C B 351 SER N 1.0 -79.0 -19.0 PSI 4 4 B 350 VAL C B 351 SER N B 351 SER CA B 351 SER C 1.0 -96.0 -36.0 PHI 5 5 B 351 SER N B 351 SER CA B 351 SER C B 352 GLU N 1.0 -69.0 -9.0 PSI 6 6 B 351 SER C B 352 GLU N B 352 GLU CA B 352 GLU C 1.0 -95.0 -35.0 PHI 7 7 B 352 GLU N B 352 GLU CA B 352 GLU C B 353 GLN N 1.0 -71.0 -11.0 PSI 8 8 B 352 GLU C B 353 GLN N B 353 GLN CA B 353 GLN C 1.0 -95.0 -35.0 PHI 9 9 B 353 GLN N B 353 GLN CA B 353 GLN C B 354 LEU N 1.0 -70.0 -10.0 PSI 10 10 B 353 GLN C B 354 LEU N B 354 LEU CA B 354 LEU C 1.0 -97.0 -37.0 PHI 11 11 B 354 LEU N B 354 LEU CA B 354 LEU C B 355 LYS N 1.0 -65.0 -5.0 PSI 12 12 B 354 LEU C B 355 LYS N B 355 LYS CA B 355 LYS C 1.0 -95.0 -35.0 PHI 13 13 B 355 LYS N B 355 LYS CA B 355 LYS C B 356 CYS N 1.0 -72.0 -12.0 PSI 14 14 B 355 LYS C B 356 CYS N B 356 CYS CA B 356 CYS C 1.0 -96.0 -36.0 PHI 15 15 B 356 CYS N B 356 CYS CA B 356 CYS C B 357 CYS N 1.0 -74.0 -14.0 PSI 16 16 B 356 CYS C B 357 CYS N B 357 CYS CA B 357 CYS C 1.0 -91.0 -31.0 PHI 17 17 B 357 CYS N B 357 CYS CA B 357 CYS C B 358 SER N 1.0 -73.0 -13.0 PSI 18 18 B 357 CYS C B 358 SER N B 358 SER CA B 358 SER C 1.0 -92.0 -32.0 PHI 19 19 B 358 SER N B 358 SER CA B 358 SER C B 359 GLY N 1.0 -74.0 -14.0 PSI 20 20 B 358 SER C B 359 GLY N B 359 GLY CA B 359 GLY C 1.0 -94.0 -34.0 PHI 21 21 B 359 GLY N B 359 GLY CA B 359 GLY C B 360 ILE N 1.0 -72.0 -12.0 PSI 22 22 B 359 GLY C B 360 ILE N B 360 ILE CA B 360 ILE C 1.0 -96.0 -36.0 PHI 23 23 B 360 ILE N B 360 ILE CA B 360 ILE C B 361 LEU N 1.0 -71.0 -11.0 PSI 24 24 B 360 ILE C B 361 LEU N B 361 LEU CA B 361 LEU C 1.0 -95.0 -35.0 PHI 25 25 B 361 LEU N B 361 LEU CA B 361 LEU C B 362 LYS N 1.0 -73.0 -13.0 PSI 26 26 B 361 LEU C B 362 LYS N B 362 LYS CA B 362 LYS C 1.0 -93.0 -33.0 PHI 27 27 B 362 LYS N B 362 LYS CA B 362 LYS C B 363 GLU N 1.0 -71.0 -11.0 PSI 28 28 B 362 LYS C B 363 GLU N B 363 GLU CA B 363 GLU C 1.0 -97.0 -37.0 PHI 29 29 B 363 GLU N B 363 GLU CA B 363 GLU C B 364 MET N 1.0 -69.0 -9.0 PSI 30 30 B 363 GLU C B 364 MET N B 364 MET CA B 364 MET C 1.0 -93.0 -33.0 PHI 31 31 B 364 MET N B 364 MET CA B 364 MET C B 365 PHE N 1.0 -73.0 -13.0 PSI 32 32 B 364 MET C B 365 PHE N B 365 PHE CA B 365 PHE C 1.0 -112.0 -52.0 PHI 33 33 B 365 PHE N B 365 PHE CA B 365 PHE C B 366 ALA N 1.0 -54.0 6.0 PSI 34 34 B 365 PHE C B 366 ALA N B 366 ALA CA B 366 ALA C 1.0 -170.0 -30.0 PHI 35 35 B 366 ALA N B 366 ALA CA B 366 ALA C B 367 LYS N 1.0 71.0 167.0 PSI 36 36 B 366 ALA C B 367 LYS N B 367 LYS CA B 367 LYS C 1.0 -87.0 -27.0 PHI 37 37 B 367 LYS N B 367 LYS CA B 367 LYS C B 368 LYS N 1.0 -82.0 6.0 PSI 38 38 B 367 LYS C B 368 LYS N B 368 LYS CA B 368 LYS C 1.0 -103.0 -43.0 PHI 39 39 B 368 LYS N B 368 LYS CA B 368 LYS C B 369 HIS N 1.0 -47.0 23.0 PSI 40 40 B 368 LYS C B 369 HIS N B 369 HIS CA B 369 HIS C 1.0 -141.0 -53.0 PHI 41 41 B 369 HIS N B 369 HIS CA B 369 HIS C B 370 ALA N 1.0 -55.0 33.0 PSI 42 42 B 369 HIS C B 370 ALA N B 370 ALA CA B 370 ALA C 1.0 -92.0 -22.0 PHI 43 43 B 370 ALA N B 370 ALA CA B 370 ALA C B 371 ALA N 1.0 -81.0 -1.0 PSI 44 44 B 370 ALA C B 371 ALA N B 371 ALA CA B 371 ALA C 1.0 -104.0 -44.0 PHI 45 45 B 371 ALA N B 371 ALA CA B 371 ALA C B 372 TYR N 1.0 -58.0 2.0 PSI 46 46 B 373 ALA C B 374 TRP N B 374 TRP CA B 374 TRP C 1.0 -95.0 -27.0 PHI 47 47 B 374 TRP N B 374 TRP CA B 374 TRP C B 375 PRO N 1.0 -72.0 8.0 PSI 48 48 B 374 TRP C B 375 PRO N B 375 PRO CA B 375 PRO C 1.0 -88.0 -28.0 PHI 49 49 B 375 PRO N B 375 PRO CA B 375 PRO C B 376 PHE N 1.0 -57.0 3.0 PSI 50 50 B 375 PRO C B 376 PHE N B 376 PHE CA B 376 PHE C 1.0 -127.0 -39.0 PHI 51 51 B 376 PHE N B 376 PHE CA B 376 PHE C B 377 TYR N 1.0 -45.0 23.0 PSI 52 52 B 376 PHE C B 377 TYR N B 377 TYR CA B 377 TYR C 1.0 -126.0 -46.0 PHI 53 53 B 377 TYR N B 377 TYR CA B 377 TYR C B 378 LYS N 1.0 -42.0 38.0 PSI 54 54 B 378 LYS C B 379 PRO N B 379 PRO CA B 379 PRO C 1.0 -96.0 -36.0 PHI 55 55 B 379 PRO N B 379 PRO CA B 379 PRO C B 380 VAL N 1.0 108.0 178.0 PSI 56 56 B 379 PRO C B 380 VAL N B 380 VAL CA B 380 VAL C 1.0 -166.0 -22.0 PHI 57 57 B 380 VAL N B 380 VAL CA B 380 VAL C B 381 ASP N 1.0 99.0 159.0 PSI 58 58 B 380 VAL C B 381 ASP N B 381 ASP CA B 381 ASP C 1.0 -149.0 -41.0 PHI 59 59 B 381 ASP N B 381 ASP CA B 381 ASP C B 382 VAL N 1.0 77.0 217.0 PSI 60 60 B 381 ASP C B 382 VAL N B 382 VAL CA B 382 VAL C 1.0 -89.0 -29.0 PHI 61 61 B 382 VAL N B 382 VAL CA B 382 VAL C B 383 GLU N 1.0 -67.0 -7.0 PSI 62 62 B 382 VAL C B 383 GLU N B 383 GLU CA B 383 GLU C 1.0 -93.0 -33.0 PHI 63 63 B 383 GLU N B 383 GLU CA B 383 GLU C B 384 ALA N 1.0 -72.0 -12.0 PSI 64 64 B 383 GLU C B 384 ALA N B 384 ALA CA B 384 ALA C 1.0 -96.0 -36.0 PHI 65 65 B 384 ALA N B 384 ALA CA B 384 ALA C B 385 LEU N 1.0 -75.0 5.0 PSI 66 66 B 384 ALA C B 385 LEU N B 385 LEU CA B 385 LEU C 1.0 -126.0 -62.0 PHI 67 67 B 385 LEU N B 385 LEU CA B 385 LEU C B 386 GLY N 1.0 -27.0 33.0 PSI 68 68 B 385 LEU C B 386 GLY N B 386 GLY CA B 386 GLY C 1.0 31.0 91.0 PHI 69 69 B 386 GLY N B 386 GLY CA B 386 GLY C B 387 LEU N 1.0 11.0 71.0 PSI 70 70 B 389 ASP C B 390 TYR N B 390 TYR CA B 390 TYR C 1.0 -94.0 -14.0 PHI 71 71 B 390 TYR N B 390 TYR CA B 390 TYR C B 391 CYS N 1.0 -67.0 -7.0 PSI 72 72 B 390 TYR C B 391 CYS N B 391 CYS CA B 391 CYS C 1.0 -92.0 -32.0 PHI 73 73 B 391 CYS N B 391 CYS CA B 391 CYS C B 392 ASP N 1.0 -58.0 2.0 PSI 74 74 B 391 CYS C B 392 ASP N B 392 ASP CA B 392 ASP C 1.0 -109.0 -29.0 PHI 75 75 B 392 ASP N B 392 ASP CA B 392 ASP C B 393 ILE N 1.0 -70.0 -10.0 PSI 76 76 B 392 ASP C B 393 ILE N B 393 ILE CA B 393 ILE C 1.0 -112.0 -52.0 PHI 77 77 B 393 ILE N B 393 ILE CA B 393 ILE C B 394 ILE N 1.0 -66.0 6.0 PSI 78 78 B 393 ILE C B 394 ILE N B 394 ILE CA B 394 ILE C 1.0 -139.0 -59.0 PHI 79 79 B 394 ILE N B 394 ILE CA B 394 ILE C B 395 LYS N 1.0 40.0 160.0 PSI 80 80 B 394 ILE C B 395 LYS N B 395 LYS CA B 395 LYS C 1.0 -120.0 -40.0 PHI 81 81 B 395 LYS N B 395 LYS CA B 395 LYS C B 396 HIS N 1.0 -56.0 8.0 PSI 82 82 B 395 LYS C B 396 HIS N B 396 HIS CA B 396 HIS C 1.0 -171.0 -75.0 PHI 83 83 B 396 HIS N B 396 HIS CA B 396 HIS C B 397 PRO N 1.0 48.0 200.0 PSI 84 84 B 396 HIS C B 397 PRO N B 397 PRO CA B 397 PRO C 1.0 -95.0 -35.0 PHI 85 85 B 397 PRO N B 397 PRO CA B 397 PRO C B 398 MET N 1.0 121.0 181.0 PSI 86 86 B 397 PRO C B 398 MET N B 398 MET CA B 398 MET C 1.0 -142.0 -62.0 PHI 87 87 B 398 MET N B 398 MET CA B 398 MET C B 399 ASP N 1.0 79.0 183.0 PSI 88 88 B 398 MET C B 399 ASP N B 399 ASP CA B 399 ASP C 1.0 -151.0 -31.0 PHI 89 89 B 399 ASP N B 399 ASP CA B 399 ASP C B 400 MET N 1.0 131.0 191.0 PSI 90 90 B 399 ASP C B 400 MET N B 400 MET CA B 400 MET C 1.0 -103.0 -31.0 PHI 91 91 B 400 MET N B 400 MET CA B 400 MET C B 401 SER N 1.0 -73.0 -9.0 PSI 92 92 B 400 MET C B 401 SER N B 401 SER CA B 401 SER C 1.0 -96.0 -36.0 PHI 93 93 B 401 SER N B 401 SER CA B 401 SER C B 402 THR N 1.0 -66.0 -6.0 PSI 94 94 B 401 SER C B 402 THR N B 402 THR CA B 402 THR C 1.0 -96.0 -36.0 PHI 95 95 B 402 THR N B 402 THR CA B 402 THR C B 403 ILE N 1.0 -69.0 -9.0 PSI 96 96 B 402 THR C B 403 ILE N B 403 ILE CA B 403 ILE C 1.0 -95.0 -35.0 PHI 97 97 B 403 ILE N B 403 ILE CA B 403 ILE C B 404 LYS N 1.0 -71.0 -11.0 PSI 98 98 B 403 ILE C B 404 LYS N B 404 LYS CA B 404 LYS C 1.0 -93.0 -33.0 PHI 99 99 B 404 LYS N B 404 LYS CA B 404 LYS C B 405 SER N 1.0 -72.0 -12.0 PSI 100 100 B 404 LYS C B 405 SER N B 405 SER CA B 405 SER C 1.0 -94.0 -34.0 PHI 101 101 B 405 SER N B 405 SER CA B 405 SER C B 406 LYS N 1.0 -70.0 -10.0 PSI 102 102 B 405 SER C B 406 LYS N B 406 LYS CA B 406 LYS C 1.0 -93.0 -33.0 PHI 103 103 B 406 LYS N B 406 LYS CA B 406 LYS C B 407 LEU N 1.0 -72.0 -12.0 PSI 104 104 B 406 LYS C B 407 LEU N B 407 LEU CA B 407 LEU C 1.0 -95.0 -35.0 PHI 105 105 B 407 LEU N B 407 LEU CA B 407 LEU C B 408 GLU N 1.0 -69.0 -9.0 PSI 106 106 B 407 LEU C B 408 GLU N B 408 GLU CA B 408 GLU C 1.0 -94.0 -34.0 PHI 107 107 B 408 GLU N B 408 GLU CA B 408 GLU C B 409 ALA N 1.0 -56.0 4.0 PSI 108 108 B 408 GLU C B 409 ALA N B 409 ALA CA B 409 ALA C 1.0 -115.0 -55.0 PHI 109 109 B 409 ALA N B 409 ALA CA B 409 ALA C B 410 ARG N 1.0 -29.0 31.0 PSI 110 110 B 409 ALA C B 410 ARG N B 410 ARG CA B 410 ARG C 1.0 29.0 89.0 PHI 111 111 B 410 ARG N B 410 ARG CA B 410 ARG C B 411 GLU N 1.0 5.0 65.0 PSI 112 112 B 410 ARG C B 411 GLU N B 411 GLU CA B 411 GLU C 1.0 -127.0 -55.0 PHI 113 113 B 411 GLU N B 411 GLU CA B 411 GLU C B 412 TYR N 1.0 -65.0 31.0 PSI 114 114 B 412 TYR C B 413 ARG N B 413 ARG CA B 413 ARG C 1.0 -97.0 -37.0 PHI 115 115 B 413 ARG N B 413 ARG CA B 413 ARG C B 414 ASP N 1.0 -64.0 -4.0 PSI 116 116 B 414 ASP C B 415 ALA N B 415 ALA CA B 415 ALA C 1.0 -129.0 -25.0 PHI 117 117 B 415 ALA N B 415 ALA CA B 415 ALA C B 416 GLN N 1.0 -66.0 -6.0 PSI 118 118 B 415 ALA C B 416 GLN N B 416 GLN CA B 416 GLN C 1.0 -95.0 -35.0 PHI 119 119 B 416 GLN N B 416 GLN CA B 416 GLN C B 417 GLU N 1.0 -68.0 -8.0 PSI 120 120 B 416 GLN C B 417 GLU N B 417 GLU CA B 417 GLU C 1.0 -95.0 -35.0 PHI 121 121 B 417 GLU N B 417 GLU CA B 417 GLU C B 418 PHE N 1.0 -75.0 -15.0 PSI 122 122 B 417 GLU C B 418 PHE N B 418 PHE CA B 418 PHE C 1.0 -91.0 -31.0 PHI 123 123 B 418 PHE N B 418 PHE CA B 418 PHE C B 419 GLY N 1.0 -70.0 -10.0 PSI 124 124 B 418 PHE C B 419 GLY N B 419 GLY CA B 419 GLY C 1.0 -92.0 -32.0 PHI 125 125 B 419 GLY N B 419 GLY CA B 419 GLY C B 420 ALA N 1.0 -80.0 12.0 PSI 126 126 B 419 GLY C B 420 ALA N B 420 ALA CA B 420 ALA C 1.0 -94.0 -34.0 PHI 127 127 B 420 ALA N B 420 ALA CA B 420 ALA C B 421 ASP N 1.0 -67.0 -7.0 PSI 128 128 B 420 ALA C B 421 ASP N B 421 ASP CA B 421 ASP C 1.0 -94.0 -34.0 PHI 129 129 B 421 ASP N B 421 ASP CA B 421 ASP C B 422 VAL N 1.0 -74.0 -14.0 PSI 130 130 B 421 ASP C B 422 VAL N B 422 VAL CA B 422 VAL C 1.0 -95.0 -35.0 PHI 131 131 B 422 VAL N B 422 VAL CA B 422 VAL C B 423 ARG N 1.0 -77.0 -17.0 PSI 132 132 B 422 VAL C B 423 ARG N B 423 ARG CA B 423 ARG C 1.0 -93.0 -33.0 PHI 133 133 B 423 ARG N B 423 ARG CA B 423 ARG C B 424 LEU N 1.0 -71.0 -11.0 PSI 134 134 B 423 ARG C B 424 LEU N B 424 LEU CA B 424 LEU C 1.0 -97.0 -37.0 PHI 135 135 B 424 LEU N B 424 LEU CA B 424 LEU C B 425 MET N 1.0 -72.0 -12.0 PSI 136 136 B 424 LEU C B 425 MET N B 425 MET CA B 425 MET C 1.0 -90.0 -30.0 PHI 137 137 B 425 MET N B 425 MET CA B 425 MET C B 426 PHE N 1.0 -75.0 -15.0 PSI 138 138 B 425 MET C B 426 PHE N B 426 PHE CA B 426 PHE C 1.0 -93.0 -33.0 PHI 139 139 B 426 PHE N B 426 PHE CA B 426 PHE C B 427 SER N 1.0 -70.0 -10.0 PSI 140 140 B 426 PHE C B 427 SER N B 427 SER CA B 427 SER C 1.0 -95.0 -35.0 PHI 141 141 B 427 SER N B 427 SER CA B 427 SER C B 428 ASN N 1.0 -68.0 -8.0 PSI 142 142 B 427 SER C B 428 ASN N B 428 ASN CA B 428 ASN C 1.0 -95.0 -35.0 PHI 143 143 B 428 ASN N B 428 ASN CA B 428 ASN C B 429 CYS N 1.0 -70.0 -10.0 PSI 144 144 B 428 ASN C B 429 CYS N B 429 CYS CA B 429 CYS C 1.0 -94.0 -34.0 PHI 145 145 B 429 CYS N B 429 CYS CA B 429 CYS C B 430 TYR N 1.0 -75.0 -15.0 PSI 146 146 B 429 CYS C B 430 TYR N B 430 TYR CA B 430 TYR C 1.0 -95.0 -35.0 PHI 147 147 B 430 TYR N B 430 TYR CA B 430 TYR C B 431 LYS N 1.0 -68.0 4.0 PSI 148 148 B 430 TYR C B 431 LYS N B 431 LYS CA B 431 LYS C 1.0 -99.0 -39.0 PHI 149 149 B 431 LYS N B 431 LYS CA B 431 LYS C B 432 TYR N 1.0 -66.0 -6.0 PSI 150 150 B 431 LYS C B 432 TYR N B 432 TYR CA B 432 TYR C 1.0 -104.0 -40.0 PHI 151 151 B 432 TYR N B 432 TYR CA B 432 TYR C B 433 ASN N 1.0 -63.0 -3.0 PSI 152 152 B 433 ASN C B 434 PRO N B 434 PRO CA B 434 PRO C 1.0 -111.0 -27.0 PHI 153 153 B 434 PRO N B 434 PRO CA B 434 PRO C B 435 PRO N 1.0 80.0 192.0 PSI 154 154 B 434 PRO C B 435 PRO N B 435 PRO CA B 435 PRO C 1.0 -87.0 -27.0 PHI 155 155 B 435 PRO N B 435 PRO CA B 435 PRO C B 436 ASP N 1.0 -56.0 4.0 PSI 156 156 B 435 PRO C B 436 ASP N B 436 ASP CA B 436 ASP C 1.0 -119.0 -59.0 PHI 157 157 B 436 ASP N B 436 ASP CA B 436 ASP C B 437 HIS N 1.0 -33.0 27.0 PSI 158 158 B 438 GLU C B 439 VAL N B 439 VAL CA B 439 VAL C 1.0 -96.0 -36.0 PHI 159 159 B 439 VAL N B 439 VAL CA B 439 VAL C B 440 VAL N 1.0 -72.0 -12.0 PSI 160 160 B 439 VAL C B 440 VAL N B 440 VAL CA B 440 VAL C 1.0 -92.0 -32.0 PHI 161 161 B 440 VAL N B 440 VAL CA B 440 VAL C B 441 ALA N 1.0 -72.0 -12.0 PSI 162 162 B 440 VAL C B 441 ALA N B 441 ALA CA B 441 ALA C 1.0 -91.0 -31.0 PHI 163 163 B 441 ALA N B 441 ALA CA B 441 ALA C B 442 MET N 1.0 -70.0 -10.0 PSI 164 164 B 441 ALA C B 442 MET N B 442 MET CA B 442 MET C 1.0 -93.0 -33.0 PHI 165 165 B 442 MET N B 442 MET CA B 442 MET C B 443 ALA N 1.0 -75.0 -15.0 PSI 166 166 B 442 MET C B 443 ALA N B 443 ALA CA B 443 ALA C 1.0 -92.0 -32.0 PHI 167 167 B 443 ALA N B 443 ALA CA B 443 ALA C B 444 ARG N 1.0 -73.0 -13.0 PSI 168 168 B 443 ALA C B 444 ARG N B 444 ARG CA B 444 ARG C 1.0 -92.0 -32.0 PHI 169 169 B 444 ARG N B 444 ARG CA B 444 ARG C B 445 LYS N 1.0 -74.0 -14.0 PSI 170 170 B 444 ARG C B 445 LYS N B 445 LYS CA B 445 LYS C 1.0 -95.0 -35.0 PHI 171 171 B 445 LYS N B 445 LYS CA B 445 LYS C B 446 LEU N 1.0 -65.0 -5.0 PSI 172 172 B 445 LYS C B 446 LEU N B 446 LEU CA B 446 LEU C 1.0 -94.0 -34.0 PHI 173 173 B 446 LEU N B 446 LEU CA B 446 LEU C B 447 GLN N 1.0 -72.0 -12.0 PSI 174 174 B 446 LEU C B 447 GLN N B 447 GLN CA B 447 GLN C 1.0 -93.0 -33.0 PHI 175 175 B 447 GLN N B 447 GLN CA B 447 GLN C B 448 ASP N 1.0 -70.0 -10.0 PSI 176 176 B 447 GLN C B 448 ASP N B 448 ASP CA B 448 ASP C 1.0 -95.0 -35.0 PHI 177 177 B 448 ASP N B 448 ASP CA B 448 ASP C B 449 VAL N 1.0 -71.0 -11.0 PSI 178 178 B 448 ASP C B 449 VAL N B 449 VAL CA B 449 VAL C 1.0 -94.0 -34.0 PHI 179 179 B 449 VAL N B 449 VAL CA B 449 VAL C B 450 PHE N 1.0 -75.0 -15.0 PSI 180 180 B 449 VAL C B 450 PHE N B 450 PHE CA B 450 PHE C 1.0 -90.0 -30.0 PHI 181 181 B 450 PHE N B 450 PHE CA B 450 PHE C B 451 GLU N 1.0 -73.0 -13.0 PSI 182 182 B 450 PHE C B 451 GLU N B 451 GLU CA B 451 GLU C 1.0 -95.0 -35.0 PHI 183 183 B 451 GLU N B 451 GLU CA B 451 GLU C B 452 MET N 1.0 -72.0 -12.0 PSI 184 184 B 451 GLU C B 452 MET N B 452 MET CA B 452 MET C 1.0 -93.0 -33.0 PHI 185 185 B 452 MET N B 452 MET CA B 452 MET C B 453 ARG N 1.0 -68.0 -8.0 PSI 186 186 B 452 MET C B 453 ARG N B 453 ARG CA B 453 ARG C 1.0 -100.0 -40.0 PHI 187 187 B 453 ARG N B 453 ARG CA B 453 ARG C B 454 PHE N 1.0 -68.0 -8.0 PSI 188 188 B 453 ARG C B 454 PHE N B 454 PHE CA B 454 PHE C 1.0 -92.0 -32.0 PHI 189 189 B 454 PHE N B 454 PHE CA B 454 PHE C B 455 ALA N 1.0 -68.0 -8.0 PSI 190 190 B 454 PHE C B 455 ALA N B 455 ALA CA B 455 ALA C 1.0 -115.0 -55.0 PHI 191 191 B 455 ALA N B 455 ALA CA B 455 ALA C B 456 LYS N 1.0 -31.0 29.0 PSI 192 192 B 455 ALA C B 456 LYS N B 456 LYS CA B 456 LYS C 1.0 -157.0 27.0 PHI 193 193 B 456 LYS N B 456 LYS CA B 456 LYS C B 457 MET N 1.0 -90.0 38.0 PSI stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 3 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 . . . 9013.85 . . . . 2 . . . 4950.5 . . . . 3 . . . 13736.26 . . . . stop_ save_