data_nef_c18192_2lo3 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 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 18191 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 35 HIS NE2 2 1 ZN ZN 1 39 HIS ND1 2 1 ZN ZN 1 20 CYS SG 2 1 ZN ZN 1 23 CYS SG 2 1 ZN ZN 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 start . . 2 A 2 PRO middle . false 3 A 3 ASN middle . . 4 A 4 ALA middle . . 5 A 5 GLN middle . . 6 A 6 LEU middle . . 7 A 7 ILE middle . . 8 A 8 GLU middle . . 9 A 9 ASP middle . . 10 A 10 PRO middle . false 11 A 11 LEU middle . . 12 A 12 ASP middle . . 13 A 13 LYS middle . . 14 A 14 PRO middle . false 15 A 15 ILE middle . . 16 A 16 GLN middle . . 17 A 17 TYR middle . . 18 A 18 ARG middle . . 19 A 19 VAL middle . . 20 A 20 CYS middle -HG . 21 A 21 GLU middle . . 22 A 22 LYS middle . . 23 A 23 CYS middle -HG . 24 A 24 GLY middle . false 25 A 25 LYS middle . . 26 A 26 PRO middle . false 27 A 27 LEU middle . . 28 A 28 ALA middle . . 29 A 29 LEU middle . . 30 A 30 THR middle . . 31 A 31 ALA middle . . 32 A 32 ILE middle . . 33 A 33 VAL middle . . 34 A 34 ASP middle . . 35 A 35 HIS middle -HE2 . 36 A 36 LEU middle . . 37 A 37 GLU middle . . 38 A 38 ASN middle . . 39 A 39 HIS middle -HD1 . 40 A 40 CYS middle . . 41 A 41 ALA middle . . 42 A 42 GLY middle . false 43 A 43 ALA middle . . 44 A 44 SER end . . 45 B 1 ZN . . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_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 ASN HA H 1 5.0897 0.05 A 1 ASN HBy H 1 3.0268 0.05 A 1 ASN CA C 13 53.4791 0.3 A 1 ASN CB C 13 39.0592 0.3 A 2 PRO HDx H 1 4.0792 0.05 A 2 PRO C C 13 177.0374 0.3 A 2 PRO CA C 13 63.8123 0.3 A 2 PRO CB C 13 32.0896 0.3 A 2 PRO CD C 13 50.6819 0.3 A 3 ASN H H 1 8.4910 0.05 A 3 ASN HA H 1 4.8352 0.05 A 3 ASN HBy H 1 3.0189 0.05 A 3 ASN HBx H 1 2.8773 0.05 A 3 ASN C C 13 175.1897 0.3 A 3 ASN CA C 13 53.4778 0.3 A 3 ASN CB C 13 38.7208 0.3 A 3 ASN N N 15 119.7540 0.2 A 4 ALA H H 1 8.1309 0.05 A 4 ALA HA H 1 4.4133 0.05 A 4 ALA HB% H 1 1.5449 0.05 A 4 ALA C C 13 177.6219 0.3 A 4 ALA CA C 13 53.0628 0.3 A 4 ALA CB C 13 19.4908 0.3 A 4 ALA N N 15 126.2714 0.2 A 5 GLN H H 1 8.4091 0.05 A 5 GLN HA H 1 4.4418 0.05 A 5 GLN HGx H 1 2.4358 0.05 A 5 GLN C C 13 175.9011 0.3 A 5 GLN CA C 13 56.0084 0.3 A 5 GLN CB C 13 29.4004 0.3 A 5 GLN CG C 13 34.2120 0.3 A 5 GLN N N 15 121.2714 0.2 A 6 LEU H H 1 8.3350 0.05 A 6 LEU HA H 1 4.5021 0.05 A 6 LEU HBy H 1 1.7792 0.05 A 6 LEU HBx H 1 1.7284 0.05 A 6 LEU HDx% H 1 1.0638 0.05 A 6 LEU HDy% H 1 1.0036 0.05 A 6 LEU C C 13 177.0939 0.3 A 6 LEU CA C 13 55.4541 0.3 A 6 LEU CB C 13 42.4514 0.3 A 6 LEU CDy C 13 24.8771 0.3 A 6 LEU CDx C 13 23.4658 0.3 A 6 LEU N N 15 125.8192 0.2 A 7 ILE H H 1 8.2646 0.05 A 7 ILE HA H 1 4.3160 0.05 A 7 ILE HB H 1 1.9915 0.05 A 7 ILE HD1% H 1 0.9942 0.05 A 7 ILE HG1y H 1 1.5974 0.05 A 7 ILE HG1x H 1 1.3195 0.05 A 7 ILE HG2% H 1 1.0319 0.05 A 7 ILE C C 13 176.1334 0.3 A 7 ILE CA C 13 60.9846 0.3 A 7 ILE CB C 13 38.8898 0.3 A 7 ILE CD1 C 13 13.6814 0.3 A 7 ILE CG1 C 13 27.4666 0.3 A 7 ILE CG2 C 13 17.7510 0.3 A 7 ILE N N 15 124.6278 0.2 A 8 GLU H H 1 8.5780 0.05 A 8 GLU HA H 1 4.4234 0.05 A 8 GLU HBy H 1 2.1327 0.05 A 8 GLU HBx H 1 2.0279 0.05 A 8 GLU HGy H 1 2.3628 0.05 A 8 GLU HGx H 1 2.3600 0.05 A 8 GLU C C 13 175.8409 0.3 A 8 GLU CA C 13 56.3548 0.3 A 8 GLU CB C 13 30.8974 0.3 A 8 GLU CG C 13 36.5984 0.3 A 8 GLU N N 15 127.7215 0.2 A 9 ASP H H 1 8.6144 0.05 A 9 ASP HA H 1 5.0073 0.05 A 9 ASP HBy H 1 2.9204 0.05 A 9 ASP HBx H 1 2.6602 0.05 A 9 ASP C C 13 174.4445 0.3 A 9 ASP CA C 13 52.3435 0.3 A 9 ASP CB C 13 41.6260 0.3 A 9 ASP N N 15 126.1389 0.2 A 10 PRO HA H 1 4.5455 0.05 A 10 PRO HBy H 1 2.0997 0.05 A 10 PRO HDy H 1 4.0028 0.05 A 10 PRO HDx H 1 3.9444 0.05 A 10 PRO HGy H 1 2.2204 0.05 A 10 PRO HGx H 1 2.0283 0.05 A 10 PRO C C 13 177.4782 0.3 A 10 PRO CA C 13 63.7275 0.3 A 10 PRO CB C 13 32.3348 0.3 A 10 PRO CD C 13 51.0706 0.3 A 10 PRO CG C 13 27.8093 0.3 A 11 LEU H H 1 8.5266 0.05 A 11 LEU HA H 1 4.4075 0.05 A 11 LEU HBy H 1 1.8534 0.05 A 11 LEU HBx H 1 1.7022 0.05 A 11 LEU HDx% H 1 1.0739 0.05 A 11 LEU HDy% H 1 1.0077 0.05 A 11 LEU HG H 1 1.7177 0.05 A 11 LEU C C 13 177.6286 0.3 A 11 LEU CA C 13 55.6949 0.3 A 11 LEU CB C 13 42.0892 0.3 A 11 LEU CDy C 13 25.1613 0.3 A 11 LEU CDx C 13 23.7127 0.3 A 11 LEU CG C 13 27.2423 0.3 A 11 LEU N N 15 122.7157 0.2 A 12 ASP H H 1 8.2339 0.05 A 12 ASP HA H 1 4.7375 0.05 A 12 ASP HBy H 1 2.8206 0.05 A 12 ASP HBx H 1 2.7607 0.05 A 12 ASP C C 13 175.7807 0.3 A 12 ASP CA C 13 54.4163 0.3 A 12 ASP CB C 13 37.7757 0.3 A 12 ASP N N 15 122.2873 0.2 A 13 LYS H H 1 8.0469 0.05 A 13 LYS HA H 1 4.7252 0.05 A 13 LYS HBy H 1 1.9371 0.05 A 13 LYS HBx H 1 1.8541 0.05 A 13 LYS HDx H 1 1.7155 0.05 A 13 LYS HEy H 1 3.2100 0.05 A 13 LYS HEx H 1 3.1370 0.05 A 13 LYS HGy H 1 1.6126 0.05 A 13 LYS HGx H 1 1.5603 0.05 A 13 LYS CA C 13 54.4378 0.3 A 13 LYS CB C 13 32.9693 0.3 A 13 LYS CD C 13 27.2847 0.3 A 13 LYS CE C 13 42.4040 0.3 A 13 LYS CG C 13 24.7081 0.3 A 13 LYS N N 15 124.0704 0.2 A 14 PRO HA H 1 4.5859 0.05 A 14 PRO HBy H 1 2.4389 0.05 A 14 PRO HBx H 1 1.9883 0.05 A 14 PRO HDy H 1 3.9203 0.05 A 14 PRO HDx H 1 3.7425 0.05 A 14 PRO HGy H 1 2.3279 0.05 A 14 PRO HGx H 1 2.1219 0.05 A 14 PRO C C 13 177.1068 0.3 A 14 PRO CA C 13 63.2345 0.3 A 14 PRO CB C 13 32.2363 0.3 A 14 PRO CD C 13 50.7932 0.3 A 14 PRO CG C 13 29.6256 0.3 A 15 ILE H H 1 8.3868 0.05 A 15 ILE HA H 1 4.1822 0.05 A 15 ILE HB H 1 1.8982 0.05 A 15 ILE HD1% H 1 0.9948 0.05 A 15 ILE HG1y H 1 1.6485 0.05 A 15 ILE HG1x H 1 1.3163 0.05 A 15 ILE HG2% H 1 0.8636 0.05 A 15 ILE C C 13 176.1741 0.3 A 15 ILE CA C 13 61.5764 0.3 A 15 ILE CB C 13 38.9625 0.3 A 15 ILE CD1 C 13 13.0814 0.3 A 15 ILE CG1 C 13 27.5669 0.3 A 15 ILE CG2 C 13 17.7601 0.3 A 15 ILE N N 15 124.0899 0.2 A 16 GLN H H 1 8.4274 0.05 A 16 GLN HA H 1 4.5629 0.05 A 16 GLN HBy H 1 2.1808 0.05 A 16 GLN HBx H 1 2.0480 0.05 A 16 GLN HGx H 1 2.4942 0.05 A 16 GLN C C 13 174.9625 0.3 A 16 GLN CA C 13 55.5808 0.3 A 16 GLN CB C 13 30.7261 0.3 A 16 GLN CG C 13 34.1627 0.3 A 16 GLN N N 15 125.9630 0.2 A 17 TYR H H 1 8.3665 0.05 A 17 TYR HA H 1 5.1749 0.05 A 17 TYR HBy H 1 2.8798 0.05 A 17 TYR C C 13 175.5918 0.3 A 17 TYR CA C 13 57.1696 0.3 A 17 TYR CB C 13 39.0269 0.3 A 17 TYR N N 15 122.4422 0.2 A 18 ARG H H 1 9.2220 0.05 A 18 ARG HA H 1 4.7377 0.05 A 18 ARG HBy H 1 1.8929 0.05 A 18 ARG HBx H 1 1.8307 0.05 A 18 ARG HDy H 1 3.3663 0.05 A 18 ARG HDx H 1 3.3253 0.05 A 18 ARG C C 13 174.9355 0.3 A 18 ARG CA C 13 55.2070 0.3 A 18 ARG CB C 13 33.5481 0.3 A 18 ARG CD C 13 43.5539 0.3 A 18 ARG N N 15 123.3799 0.2 A 19 VAL H H 1 8.6441 0.05 A 19 VAL HA H 1 4.3060 0.05 A 19 VAL HB H 1 1.9371 0.05 A 19 VAL HGx% H 1 0.9680 0.05 A 19 VAL HGy% H 1 0.8086 0.05 A 19 VAL C C 13 176.3544 0.3 A 19 VAL CA C 13 62.0346 0.3 A 19 VAL CB C 13 32.9713 0.3 A 19 VAL CGy C 13 21.5571 0.3 A 19 VAL CGx C 13 21.2372 0.3 A 19 VAL N N 15 124.7344 0.2 A 20 CYS H H 1 8.7411 0.05 A 20 CYS HA H 1 4.3160 0.05 A 20 CYS HBy H 1 3.3968 0.05 A 20 CYS HBx H 1 2.7213 0.05 A 20 CYS C C 13 177.8630 0.3 A 20 CYS CA C 13 60.5546 0.3 A 20 CYS CB C 13 30.6448 0.3 A 20 CYS N N 15 132.1485 0.2 A 21 GLU H H 1 9.5114 0.05 A 21 GLU HA H 1 4.2646 0.05 A 21 GLU HBy H 1 2.2987 0.05 A 21 GLU HBx H 1 2.2314 0.05 A 21 GLU HGy H 1 2.5384 0.05 A 21 GLU HGx H 1 2.5217 0.05 A 21 GLU C C 13 176.7349 0.3 A 21 GLU CA C 13 59.0150 0.3 A 21 GLU CB C 13 29.7577 0.3 A 21 GLU CG C 13 36.6441 0.3 A 21 GLU N N 15 133.4212 0.2 A 22 LYS H H 1 9.4324 0.05 A 22 LYS HA H 1 4.5442 0.05 A 22 LYS HBy H 1 2.1433 0.05 A 22 LYS HBx H 1 1.8374 0.05 A 22 LYS HDx H 1 1.8748 0.05 A 22 LYS HEy H 1 3.1875 0.05 A 22 LYS HEx H 1 3.1237 0.05 A 22 LYS HGy H 1 1.6255 0.05 A 22 LYS HGx H 1 1.5467 0.05 A 22 LYS C C 13 177.6842 0.3 A 22 LYS CA C 13 58.0193 0.3 A 22 LYS CB C 13 33.8424 0.3 A 22 LYS CD C 13 29.4636 0.3 A 22 LYS CE C 13 42.4299 0.3 A 22 LYS CG C 13 26.0575 0.3 A 22 LYS N N 15 123.4120 0.2 A 23 CYS H H 1 8.2991 0.05 A 23 CYS HA H 1 5.1485 0.05 A 23 CYS HBy H 1 3.4775 0.05 A 23 CYS HBx H 1 3.0021 0.05 A 23 CYS C C 13 177.1198 0.3 A 23 CYS CA C 13 58.7026 0.3 A 23 CYS CB C 13 33.2011 0.3 A 23 CYS N N 15 118.3548 0.2 A 24 GLY H H 1 8.1869 0.05 A 24 GLY HAy H 1 4.2797 0.05 A 24 GLY HAx H 1 3.8841 0.05 A 24 GLY C C 13 173.7688 0.3 A 24 GLY CA C 13 46.4990 0.3 A 24 GLY N N 15 115.0114 0.2 A 25 LYS H H 1 8.3543 0.05 A 25 LYS HA H 1 4.7411 0.05 A 25 LYS HBx H 1 1.9552 0.05 A 25 LYS HDy H 1 1.7814 0.05 A 25 LYS HEy H 1 3.2178 0.05 A 25 LYS HEx H 1 3.1537 0.05 A 25 LYS HGx H 1 1.7775 0.05 A 25 LYS C C 13 174.6087 0.3 A 25 LYS CA C 13 56.2809 0.3 A 25 LYS CB C 13 33.2941 0.3 A 25 LYS CD C 13 27.3271 0.3 A 25 LYS CE C 13 42.5746 0.3 A 25 LYS CG C 13 25.7150 0.3 A 25 LYS N N 15 125.2618 0.2 A 26 PRO HA H 1 4.8050 0.05 A 26 PRO HBy H 1 2.0836 0.05 A 26 PRO HBx H 1 1.7531 0.05 A 26 PRO HDy H 1 3.9179 0.05 A 26 PRO HDx H 1 3.7488 0.05 A 26 PRO HGy H 1 1.7503 0.05 A 26 PRO C C 13 176.6385 0.3 A 26 PRO CA C 13 62.5147 0.3 A 26 PRO CB C 13 31.7049 0.3 A 26 PRO CD C 13 50.8750 0.3 A 27 LEU H H 1 8.9738 0.05 A 27 LEU HA H 1 4.7107 0.05 A 27 LEU HBy H 1 1.6876 0.05 A 27 LEU HBx H 1 1.4575 0.05 A 27 LEU HDx% H 1 0.6475 0.05 A 27 LEU HDy% H 1 0.4080 0.05 A 27 LEU HG H 1 1.5725 0.05 A 27 LEU C C 13 175.9244 0.3 A 27 LEU CA C 13 53.1926 0.3 A 27 LEU CB C 13 45.2165 0.3 A 27 LEU CDy C 13 25.9593 0.3 A 27 LEU CDx C 13 23.5397 0.3 A 27 LEU CG C 13 26.8113 0.3 A 27 LEU N N 15 127.3321 0.2 A 28 ALA H H 1 8.6719 0.05 A 28 ALA HA H 1 4.5675 0.05 A 28 ALA HB% H 1 1.4709 0.05 A 28 ALA C C 13 179.6663 0.3 A 28 ALA CA C 13 52.2054 0.3 A 28 ALA CB C 13 18.8522 0.3 A 28 ALA N N 15 126.4966 0.2 A 29 LEU H H 1 8.5256 0.05 A 29 LEU HA H 1 4.1152 0.05 A 29 LEU HBy H 1 1.8359 0.05 A 29 LEU HBx H 1 1.7877 0.05 A 29 LEU HDx% H 1 1.0356 0.05 A 29 LEU HDy% H 1 0.9686 0.05 A 29 LEU HG H 1 1.7934 0.05 A 29 LEU C C 13 179.3318 0.3 A 29 LEU CA C 13 58.1176 0.3 A 29 LEU CB C 13 41.7107 0.3 A 29 LEU CDy C 13 25.0030 0.3 A 29 LEU CDx C 13 23.7456 0.3 A 29 LEU CG C 13 27.0971 0.3 A 29 LEU N N 15 123.8946 0.2 A 30 THR H H 1 7.6564 0.05 A 30 THR HA H 1 4.3418 0.05 A 30 THR HB H 1 4.5982 0.05 A 30 THR HG2% H 1 1.4259 0.05 A 30 THR C C 13 174.9897 0.3 A 30 THR CA C 13 62.6290 0.3 A 30 THR CB C 13 69.1413 0.3 A 30 THR CG2 C 13 22.3157 0.3 A 30 THR N N 15 107.5869 0.2 A 31 ALA H H 1 8.1438 0.05 A 31 ALA HA H 1 4.4060 0.05 A 31 ALA HB% H 1 1.7054 0.05 A 31 ALA C C 13 178.6202 0.3 A 31 ALA CA C 13 52.1915 0.3 A 31 ALA CB C 13 21.2999 0.3 A 31 ALA N N 15 126.3193 0.2 A 32 ILE H H 1 7.5262 0.05 A 32 ILE HA H 1 3.9988 0.05 A 32 ILE HB H 1 1.9915 0.05 A 32 ILE HD1% H 1 1.0785 0.05 A 32 ILE HG1y H 1 1.8294 0.05 A 32 ILE HG1x H 1 1.3896 0.05 A 32 ILE HG2% H 1 1.1844 0.05 A 32 ILE C C 13 176.4774 0.3 A 32 ILE CA C 13 65.1268 0.3 A 32 ILE CB C 13 36.3727 0.3 A 32 ILE CD1 C 13 14.0149 0.3 A 32 ILE CG1 C 13 29.2821 0.3 A 32 ILE CG2 C 13 17.7470 0.3 A 32 ILE N N 15 122.3316 0.2 A 33 VAL H H 1 8.2947 0.05 A 33 VAL HA H 1 3.8498 0.05 A 33 VAL HB H 1 2.1764 0.05 A 33 VAL HGx% H 1 1.2114 0.05 A 33 VAL HGy% H 1 1.0880 0.05 A 33 VAL C C 13 178.3657 0.3 A 33 VAL CA C 13 67.4178 0.3 A 33 VAL CB C 13 31.2871 0.3 A 33 VAL CGy C 13 23.0117 0.3 A 33 VAL CGx C 13 21.1713 0.3 A 33 VAL N N 15 123.6282 0.2 A 34 ASP H H 1 8.4140 0.05 A 34 ASP HA H 1 4.5583 0.05 A 34 ASP HBy H 1 2.9458 0.05 A 34 ASP HBx H 1 2.7623 0.05 A 34 ASP CA C 13 57.2874 0.3 A 34 ASP CB C 13 42.3361 0.3 A 34 ASP N N 15 121.3744 0.2 A 35 HIS H H 1 8.3976 0.05 A 35 HIS HA H 1 4.3094 0.05 A 35 HIS HBy H 1 3.7477 0.05 A 35 HIS HBx H 1 3.4044 0.05 A 35 HIS HD1 H 1 7.1472 0.05 A 35 HIS HE1 H 1 8.0013 0.05 A 35 HIS C C 13 177.2967 0.3 A 35 HIS CA C 13 60.5845 0.3 A 35 HIS CB C 13 28.9108 0.3 A 35 HIS N N 15 119.9599 0.2 A 35 HIS ND1 N 15 218.4424 0.2 A 35 HIS NE2 N 15 172.4578 0.2 A 36 LEU H H 1 8.7431 0.05 A 36 LEU HA H 1 4.1152 0.05 A 36 LEU HBy H 1 2.1414 0.05 A 36 LEU HBx H 1 1.7108 0.05 A 36 LEU HDx% H 1 1.1427 0.05 A 36 LEU HDy% H 1 1.2437 0.05 A 36 LEU HG H 1 1.7814 0.05 A 36 LEU C C 13 179.8979 0.3 A 36 LEU CA C 13 58.1176 0.3 A 36 LEU CB C 13 42.4565 0.3 A 36 LEU CDy C 13 26.0922 0.3 A 36 LEU CDx C 13 24.2041 0.3 A 36 LEU CG C 13 27.3271 0.3 A 36 LEU N N 15 121.8214 0.2 A 37 GLU H H 1 8.4260 0.05 A 37 GLU HA H 1 4.1904 0.05 A 37 GLU HBy H 1 2.1618 0.05 A 37 GLU HBx H 1 2.0770 0.05 A 37 GLU HGy H 1 2.5248 0.05 A 37 GLU HGx H 1 2.3393 0.05 A 37 GLU CA C 13 59.0978 0.3 A 37 GLU CB C 13 30.6067 0.3 A 37 GLU CG C 13 36.6345 0.3 A 37 GLU N N 15 119.7790 0.2 A 38 ASN H H 1 7.8582 0.05 A 38 ASN HBy H 1 2.4086 0.05 A 38 ASN HD2y H 1 7.7901 0.05 A 38 ASN HD2x H 1 7.2324 0.05 A 38 ASN C C 13 176.8308 0.3 A 38 ASN CA C 13 54.0687 0.3 A 38 ASN CB C 13 41.3740 0.3 A 38 ASN N N 15 113.8674 0.2 A 38 ASN ND2 N 15 118.7732 0.2 A 39 HIS H H 1 8.0939 0.05 A 39 HIS HA H 1 4.9795 0.05 A 39 HIS HBy H 1 3.5094 0.05 A 39 HIS HBx H 1 3.0118 0.05 A 39 HIS HD2 H 1 7.1684 0.05 A 39 HIS HE1 H 1 8.1905 0.05 A 39 HIS C C 13 174.1976 0.3 A 39 HIS CA C 13 56.2962 0.3 A 39 HIS CB C 13 32.3667 0.3 A 39 HIS N N 15 118.3938 0.2 A 39 HIS ND1 N 15 194.4283 0.2 A 39 HIS NE2 N 15 175.0535 0.2 A 40 CYS H H 1 8.0116 0.05 A 40 CYS HA H 1 3.8537 0.05 A 40 CYS HBx H 1 2.8579 0.05 A 40 CYS C C 13 176.0377 0.3 A 40 CYS CA C 13 61.5304 0.3 A 40 CYS CB C 13 29.5522 0.3 A 40 CYS N N 15 124.4024 0.2 A 41 ALA H H 1 8.8249 0.05 A 41 ALA HA H 1 4.5209 0.05 A 41 ALA HB% H 1 1.6009 0.05 A 41 ALA C C 13 178.3633 0.3 A 41 ALA CA C 13 53.0102 0.3 A 41 ALA CB C 13 19.5139 0.3 A 41 ALA N N 15 132.2163 0.2 A 42 GLY H H 1 8.8793 0.05 A 42 GLY HAy H 1 4.0320 0.05 A 42 GLY HAx H 1 3.9922 0.05 A 42 GLY C C 13 173.2343 0.3 A 42 GLY CA C 13 45.0716 0.3 A 42 GLY N N 15 111.3881 0.2 A 43 ALA H H 1 8.1999 0.05 A 43 ALA HA H 1 4.5675 0.05 A 43 ALA HB% H 1 1.5663 0.05 A 43 ALA C C 13 177.1649 0.3 A 43 ALA CA C 13 52.6254 0.3 A 43 ALA CB C 13 19.9636 0.3 A 43 ALA N N 15 125.7891 0.2 A 44 SER H H 1 8.1312 0.05 A 44 SER HA H 1 4.4194 0.05 A 44 SER HBy H 1 3.9882 0.05 A 44 SER C C 13 178.9531 0.3 A 44 SER CA C 13 60.2508 0.3 A 44 SER CB C 13 64.1255 0.3 A 44 SER N N 15 123.2298 0.2 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin noe _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 A 4 ALA HB% A 5 GLN HA 1.0 1.8 5.0 2 2 A 5 GLN HA A 5 GLN HGx 1.0 1.8 5.0 3 2 A 5 GLN HA A 5 GLN HGy 1.0 1.8 5.0 4 3 A 5 GLN HBy A 5 GLN HGx 1.0 1.8 5.0 5 3 A 5 GLN HGy A 5 GLN HBy 1.0 1.8 5.0 6 4 A 5 GLN HA A 5 GLN HBx 1.0 1.8 5.0 7 5 A 5 GLN HA A 5 GLN HGx 1.0 1.8 5.0 8 5 A 5 GLN HA A 5 GLN HGy 1.0 1.8 5.0 9 6 A 7 ILE HD1% A 7 ILE HG1y 1.0 1.8 5.0 10 7 A 7 ILE HG1x A 7 ILE HG2% 1.0 1.8 5.0 11 8 A 7 ILE HG1y A 7 ILE HG2% 1.0 1.8 5.0 12 9 A 7 ILE HG2% A 7 ILE HB 1.0 1.8 5.0 13 10 A 8 GLU HA A 8 GLU HBy 1.0 1.8 5.0 14 11 A 8 GLU HA A 8 GLU HGx 1.0 1.8 5.0 15 12 A 9 ASP HA A 9 ASP HBy 1.0 1.8 5.0 16 13 A 9 ASP HA A 10 PRO HDx 1.0 1.8 5.0 17 14 A 9 ASP HA A 10 PRO HDy 1.0 1.8 5.0 18 15 A 10 PRO HA A 10 PRO HBx 1.0 1.8 5.0 19 15 A 10 PRO HA A 10 PRO HBy 1.0 1.8 5.0 20 16 A 10 PRO HA A 10 PRO HBx 1.0 1.8 5.0 21 16 A 10 PRO HA A 10 PRO HBy 1.0 1.8 5.0 22 17 A 10 PRO HGx A 10 PRO HBx 1.0 1.8 5.0 23 17 A 10 PRO HBy A 10 PRO HGx 1.0 1.8 5.0 24 18 A 9 ASP HA A 10 PRO HDx 1.0 1.8 5.0 25 19 A 10 PRO HDx A 10 PRO HGx 1.0 1.8 5.0 26 20 A 9 ASP HA A 10 PRO HDy 1.0 1.8 5.0 27 21 A 10 PRO HDy A 10 PRO HA 1.0 1.8 5.0 28 22 A 10 PRO HA A 10 PRO HGx 1.0 1.8 5.0 29 23 A 10 PRO HDx A 10 PRO HGx 1.0 1.8 5.0 30 24 A 11 LEU HBy A 11 LEU HDy% 1.0 1.8 5.0 31 25 A 11 LEU HBy A 11 LEU HDx% 1.0 1.8 5.0 32 26 A 11 LEU HG A 11 LEU HA 1.0 1.8 5.0 33 27 A 12 ASP HA A 12 ASP HBx 1.0 1.8 5.0 34 28 A 12 ASP HA A 12 ASP HBy 1.0 1.8 5.0 35 29 A 12 ASP HA A 12 ASP HBy 1.0 1.8 5.0 36 30 A 13 LYS HA A 14 PRO HDx 1.0 1.8 5.0 37 31 A 13 LYS HA A 13 LYS HBx 1.0 1.8 5.0 38 32 A 13 LYS HDy A 13 LYS HEy 1.0 1.8 5.0 39 32 A 13 LYS HDy A 13 LYS HEx 1.0 1.8 5.0 40 33 A 14 PRO HA A 14 PRO HBy 1.0 1.8 5.0 41 33 A 14 PRO HA A 14 PRO HBx 1.0 1.8 5.0 42 34 A 14 PRO HDy A 14 PRO HBy 1.0 1.8 5.0 43 34 A 14 PRO HBx A 14 PRO HDy 1.0 1.8 5.0 44 35 A 13 LYS HA A 14 PRO HDx 1.0 1.8 5.0 45 36 A 13 LYS HA A 14 PRO HDy 1.0 1.8 5.0 46 37 A 15 ILE HA A 15 ILE HD1% 1.0 1.8 5.0 47 38 A 15 ILE HA A 16 GLN HGx 1.0 1.8 5.0 48 39 A 15 ILE HD1% A 15 ILE HB 1.0 1.8 5.0 49 40 A 15 ILE HB A 15 ILE HG1y 1.0 1.8 5.0 50 41 A 15 ILE HA A 15 ILE HD1% 1.0 1.8 5.0 51 42 A 15 ILE HD1% A 15 ILE HB 1.0 1.8 5.0 52 43 A 15 ILE HD1% A 15 ILE HG1y 1.0 1.8 5.0 53 44 A 15 ILE HB A 15 ILE HG1x 1.0 1.8 5.0 54 45 A 15 ILE HB A 15 ILE HG1y 1.0 1.8 5.0 55 46 A 16 GLN HE2y A 17 TYR HE% 1.0 1.8 5.0 56 47 A 17 TYR HA A 17 TYR HBy 1.0 1.8 5.0 57 48 A 17 TYR HA A 17 TYR HBy 1.0 1.8 5.0 58 49 A 17 TYR HBy A 17 TYR HD% 1.0 1.8 5.0 59 50 A 16 GLN HE2y A 17 TYR HD% 1.0 1.8 5.0 60 51 A 18 ARG HA A 18 ARG HDy 1.0 1.8 5.0 61 52 A 18 ARG HA A 18 ARG HGx 1.0 1.8 5.0 62 52 A 18 ARG HA A 18 ARG HGy 1.0 1.8 5.0 63 53 A 18 ARG HA A 18 ARG HBx 1.0 1.8 5.0 64 54 A 18 ARG HA A 18 ARG HBy 1.0 1.8 5.0 65 55 A 18 ARG HDy A 18 ARG HBy 1.0 1.8 5.0 66 56 A 18 ARG HDy A 18 ARG HBx 1.0 1.8 5.0 67 57 A 18 ARG HA A 18 ARG HGx 1.0 1.8 5.0 68 57 A 18 ARG HA A 18 ARG HGy 1.0 1.8 5.0 69 58 A 27 LEU HDx% A 18 ARG HGx 1.0 1.8 5.0 70 58 A 18 ARG HGy A 27 LEU HDx% 1.0 1.8 5.0 71 59 A 19 VAL HA A 19 VAL HGx% 1.0 1.8 5.0 72 60 A 19 VAL HA A 19 VAL HGy% 1.0 1.8 5.0 73 61 A 19 VAL HA A 26 PRO HA 1.0 1.8 4.0 74 62 A 19 VAL HGx% A 19 VAL HB 1.0 1.8 5.0 75 63 A 19 VAL HGy% A 19 VAL HB 1.0 1.8 5.0 76 64 A 19 VAL HA A 19 VAL HGx% 1.0 1.8 5.0 77 65 A 19 VAL HGx% A 19 VAL HB 1.0 1.8 5.0 78 66 A 19 VAL HGx% A 19 VAL HGy% 1.0 1.8 5.0 79 67 A 19 VAL HGx% A 26 PRO HBy 1.0 1.8 5.0 80 68 A 19 VAL HA A 19 VAL HGy% 1.0 1.8 5.0 81 69 A 19 VAL HGy% A 19 VAL HB 1.0 1.8 5.0 82 70 A 19 VAL HGx% A 19 VAL HGy% 1.0 1.8 5.0 83 71 A 20 CYS HA A 20 CYS HBx 1.0 1.8 5.0 84 72 A 20 CYS HA A 20 CYS HBy 1.0 1.8 5.0 85 73 A 20 CYS HA A 20 CYS HBx 1.0 1.8 5.0 86 74 A 20 CYS HA A 20 CYS HBy 1.0 1.8 5.0 87 75 A 21 GLU HA A 21 GLU HBx 1.0 1.8 5.0 88 76 A 21 GLU HA A 21 GLU HBy 1.0 1.8 5.0 89 77 A 21 GLU HA A 21 GLU HBx 1.0 1.8 5.0 90 78 A 21 GLU HA A 21 GLU HBy 1.0 1.8 5.0 91 79 A 21 GLU HBy A 21 GLU HGx 1.0 1.8 5.0 92 80 A 21 GLU HBy A 21 GLU HGx 1.0 1.8 5.0 93 81 A 22 LYS HBx A 22 LYS HA 1.0 1.8 5.0 94 82 A 22 LYS HDy A 22 LYS HEy 1.0 1.8 5.0 95 82 A 22 LYS HDy A 22 LYS HEx 1.0 1.8 5.0 96 83 A 22 LYS HDx A 39 HIS HA 1.0 1.8 7.0 97 84 A 22 LYS HDy A 22 LYS HEy 1.0 1.8 5.0 98 84 A 22 LYS HDy A 22 LYS HEx 1.0 1.8 5.0 99 85 A 22 LYS HGy A 22 LYS HEy 1.0 1.8 5.0 100 85 A 22 LYS HEx A 22 LYS HGy 1.0 1.8 5.0 101 86 A 23 CYS HA A 23 CYS HBx 1.0 1.8 5.0 102 87 A 23 CYS HA A 23 CYS HBy 1.0 1.8 5.0 103 88 A 23 CYS HA A 23 CYS HBx 1.0 1.8 5.0 104 89 A 23 CYS HA A 23 CYS HBy 1.0 1.8 5.0 105 90 A 19 VAL HGx% A 24 GLY HAx 1.0 1.8 5.0 106 91 A 19 VAL HGy% A 24 GLY HAx 1.0 1.8 5.0 107 92 A 19 VAL HGy% A 24 GLY HAy 1.0 1.8 5.0 108 93 A 19 VAL HA A 25 LYS HA 1.0 1.8 5.0 109 94 A 25 LYS HA A 26 PRO HDy 1.0 1.8 5.0 110 95 A 25 LYS HA A 25 LYS HBy 1.0 1.8 5.0 111 96 A 26 PRO HDy A 25 LYS HBx 1.0 1.8 5.0 112 97 A 25 LYS HA A 25 LYS HDx 1.0 1.8 5.0 113 98 A 26 PRO HDy A 25 LYS HDx 1.0 1.8 5.0 114 99 A 25 LYS HEy A 25 LYS HGx 1.0 1.8 5.0 115 99 A 25 LYS HEx A 25 LYS HGx 1.0 1.8 5.0 116 99 A 25 LYS HGy A 25 LYS HEy 1.0 1.8 5.0 117 99 A 25 LYS HEx A 25 LYS HGy 1.0 1.8 5.0 118 100 A 19 VAL HA A 26 PRO HA 1.0 1.8 4.0 119 101 A 26 PRO HA A 26 PRO HBx 1.0 1.8 5.0 120 102 A 26 PRO HA A 26 PRO HGx 1.0 1.8 5.0 121 103 A 26 PRO HA A 26 PRO HBx 1.0 1.8 5.0 122 104 A 26 PRO HDy A 26 PRO HBx 1.0 1.8 5.0 123 105 A 17 TYR HA A 26 PRO HBy 1.0 1.8 5.0 124 106 A 26 PRO HBy A 26 PRO HDy 1.0 1.8 5.0 125 107 A 25 LYS HA A 26 PRO HDy 1.0 1.8 5.0 126 108 A 26 PRO HDy A 26 PRO HGy 1.0 1.8 5.0 127 109 A 26 PRO HDy A 26 PRO HGx 1.0 1.8 5.0 128 110 A 26 PRO HBy A 26 PRO HGy 1.0 1.8 5.0 129 111 A 26 PRO HDy A 26 PRO HGy 1.0 1.8 5.0 130 112 A 26 PRO HA A 26 PRO HGx 1.0 1.8 5.0 131 113 A 26 PRO HDy A 26 PRO HGx 1.0 1.8 5.0 132 114 A 27 LEU HBy A 27 LEU HA 1.0 1.8 5.0 133 115 A 27 LEU HDx% A 20 CYS HBy 1.0 1.8 5.0 134 116 A 27 LEU HDx% A 27 LEU HDy% 1.0 1.8 5.0 135 117 A 27 LEU HDx% A 27 LEU HG 1.0 1.8 5.0 136 118 A 27 LEU HA A 27 LEU HDy% 1.0 1.8 5.0 137 119 A 27 LEU HBy A 27 LEU HDy% 1.0 1.8 5.0 138 120 A 27 LEU HDx% A 27 LEU HDy% 1.0 1.8 5.0 139 121 A 27 LEU HDy% A 27 LEU HG 1.0 1.8 5.0 140 122 A 27 LEU HDy% A 32 ILE HA 1.0 1.8 5.0 141 123 A 27 LEU HDx% A 27 LEU HG 1.0 1.8 5.0 142 124 A 27 LEU HDy% A 27 LEU HG 1.0 1.8 5.0 143 125 A 17 TYR HA A 28 ALA HA 1.0 1.8 4.0 144 126 A 27 LEU HA A 28 ALA HA 1.0 1.8 5.0 145 127 A 28 ALA HA A 28 ALA HB% 1.0 1.8 5.0 146 128 A 28 ALA HA A 28 ALA HB% 1.0 1.8 5.0 147 129 A 29 LEU HA A 29 LEU HBy 1.0 1.8 5.0 148 130 A 29 LEU HBx A 29 LEU HDx% 1.0 1.8 5.0 149 131 A 29 LEU HBx A 29 LEU HDx% 1.0 1.8 5.0 150 132 A 28 ALA HA A 29 LEU HDy% 1.0 1.8 5.0 151 133 A 30 THR HA A 30 THR HB 1.0 1.8 5.0 152 134 A 30 THR HA A 30 THR HG2% 1.0 1.8 5.0 153 135 A 30 THR HA A 30 THR HB 1.0 1.8 5.0 154 136 A 30 THR HB A 30 THR HG2% 1.0 1.8 5.0 155 137 A 30 THR HA A 30 THR HG2% 1.0 1.8 5.0 156 138 A 30 THR HB A 30 THR HG2% 1.0 1.8 5.0 157 139 A 32 ILE HA A 32 ILE HB 1.0 1.8 5.0 158 140 A 32 ILE HA A 32 ILE HB 1.0 1.8 5.0 159 141 A 32 ILE HB A 32 ILE HD1% 1.0 1.8 5.0 160 142 A 32 ILE HB A 32 ILE HG2% 1.0 1.8 5.0 161 143 A 32 ILE HB A 32 ILE HD1% 1.0 1.8 5.0 162 144 A 32 ILE HD1% A 32 ILE HG1y 1.0 1.8 5.0 163 145 A 32 ILE HD1% A 32 ILE HG1y 1.0 1.8 5.0 164 146 A 32 ILE HG2% A 32 ILE HG1y 1.0 1.8 5.0 165 147 A 32 ILE HB A 32 ILE HG2% 1.0 1.8 5.0 166 148 A 33 VAL HA A 33 VAL HB 1.0 1.8 5.0 167 149 A 33 VAL HA A 33 VAL HGx% 1.0 1.8 5.0 168 150 A 33 VAL HB A 33 VAL HGx% 1.0 1.8 5.0 169 151 A 33 VAL HB A 33 VAL HGy% 1.0 1.8 5.0 170 152 A 33 VAL HA A 33 VAL HGx% 1.0 1.8 5.0 171 153 A 33 VAL HB A 33 VAL HGx% 1.0 1.8 5.0 172 154 A 33 VAL HA A 33 VAL HGy% 1.0 1.8 5.0 173 155 A 33 VAL HB A 33 VAL HGy% 1.0 1.8 5.0 174 156 A 34 ASP HA A 34 ASP HBx 1.0 1.8 5.0 175 157 A 35 HIS HA A 35 HIS HBy 1.0 1.8 5.0 176 158 A 32 ILE HA A 35 HIS HBx 1.0 1.8 5.0 177 159 A 35 HIS HA A 35 HIS HBy 1.0 1.8 5.0 178 160 A 36 LEU HA A 36 LEU HG 1.0 1.8 5.0 179 161 A 36 LEU HA A 36 LEU HBx 1.0 1.8 5.0 180 162 A 36 LEU HBx A 36 LEU HDx% 1.0 1.8 5.0 181 162 A 36 LEU HBx A 36 LEU HDy% 1.0 1.8 5.0 182 163 A 36 LEU HG A 36 LEU HBx 1.0 1.8 5.0 183 164 A 35 HIS HD2 A 36 LEU HDx% 1.0 1.8 5.0 184 164 A 36 LEU HDy% A 35 HIS HD2 1.0 1.8 5.0 185 165 A 36 LEU HA A 36 LEU HDx% 1.0 1.8 5.0 186 165 A 36 LEU HA A 36 LEU HDy% 1.0 1.8 5.0 187 166 A 36 LEU HBx A 36 LEU HDx% 1.0 1.8 5.0 188 166 A 36 LEU HBx A 36 LEU HDy% 1.0 1.8 5.0 189 167 A 36 LEU HG A 36 LEU HDx% 1.0 1.8 5.0 190 167 A 36 LEU HG A 36 LEU HDy% 1.0 1.8 5.0 191 168 A 36 LEU HA A 36 LEU HG 1.0 1.8 5.0 192 169 A 36 LEU HG A 36 LEU HBx 1.0 1.8 5.0 193 170 A 41 ALA HA A 41 ALA HB% 1.0 1.8 5.0 194 171 A 41 ALA HA A 41 ALA HB% 1.0 1.8 5.0 195 172 A 43 ALA HB% A 43 ALA HA 1.0 1.8 5.0 196 173 A 44 SER HA A 44 SER HBx 1.0 1.8 5.0 197 173 A 44 SER HA A 44 SER HBy 1.0 1.8 5.0 198 174 A 44 SER HA A 44 SER HBx 1.0 1.8 5.0 199 174 A 44 SER HA A 44 SER HBy 1.0 1.8 5.0 200 175 A 5 GLN HBx A 5 GLN HGx 1.0 1.8 4.0 201 175 A 5 GLN HGy A 5 GLN HBx 1.0 1.8 4.0 202 176 A 5 GLN HBy A 5 GLN HGx 1.0 1.8 4.0 203 176 A 5 GLN HGy A 5 GLN HBy 1.0 1.8 4.0 204 177 A 6 LEU HBx A 6 LEU HDy% 1.0 1.8 4.0 205 178 A 6 LEU HBx A 6 LEU HDy% 1.0 1.8 4.0 206 179 A 6 LEU HG A 6 LEU HDx% 1.0 1.8 4.0 207 180 A 7 ILE HD1% A 7 ILE HA 1.0 1.8 4.0 208 181 A 7 ILE HD1% A 7 ILE HA 1.0 1.8 4.0 209 182 A 10 PRO HDx A 10 PRO HGy 1.0 1.8 4.0 210 183 A 10 PRO HDy A 10 PRO HGy 1.0 1.8 4.0 211 184 A 10 PRO HDy A 10 PRO HGy 1.0 1.8 4.0 212 185 A 13 LYS HDy A 13 LYS HEy 1.0 1.8 4.0 213 185 A 13 LYS HDy A 13 LYS HEx 1.0 1.8 4.0 214 186 A 13 LYS HA A 14 PRO HBy 1.0 1.8 4.0 215 186 A 13 LYS HA A 14 PRO HBx 1.0 1.8 4.0 216 187 A 14 PRO HA A 14 PRO HBy 1.0 1.8 4.0 217 187 A 14 PRO HA A 14 PRO HBx 1.0 1.8 4.0 218 188 A 13 LYS HDy A 15 ILE HD1% 1.0 1.8 5.0 219 189 A 15 ILE HG1x A 15 ILE HG2% 1.0 1.8 4.0 220 190 A 15 ILE HB A 15 ILE HG2% 1.0 1.8 4.0 221 191 A 18 ARG HA A 18 ARG HBx 1.0 1.8 4.0 222 192 A 18 ARG HBy A 18 ARG HDx 1.0 1.8 4.0 223 193 A 18 ARG HBx A 18 ARG HDx 1.0 1.8 4.0 224 194 A 21 GLU HA A 21 GLU HGx 1.0 1.8 4.0 225 195 A 21 GLU HBx A 21 GLU HGx 1.0 1.8 4.0 226 196 A 25 LYS HA A 25 LYS HDx 1.0 1.8 4.0 227 197 A 25 LYS HDx A 25 LYS HGx 1.0 1.8 4.0 228 197 A 25 LYS HDx A 25 LYS HGy 1.0 1.8 4.0 229 198 A 26 PRO HBy A 26 PRO HGx 1.0 1.8 4.0 230 199 A 33 VAL HGx% A 33 VAL HGy% 1.0 1.8 4.0 231 200 A 32 ILE HD1% A 36 LEU HBx 1.0 1.8 4.0 232 201 A 36 LEU HA A 36 LEU HBy 1.0 1.8 4.0 233 202 A 36 LEU HG A 36 LEU HBy 1.0 1.8 4.0 234 203 A 1 ASN HA A 1 ASN HBy 1.0 1.8 7.0 235 204 A 1 ASN HA A 1 ASN HBx 1.0 1.8 7.0 236 205 A 1 ASN HA A 1 ASN HBy 1.0 1.8 7.0 237 206 A 1 ASN HA A 1 ASN HBx 1.0 1.8 7.0 238 207 A 2 PRO HA A 2 PRO HDy 1.0 1.8 7.0 239 208 A 2 PRO HA A 2 PRO HBx 1.0 1.8 7.0 240 208 A 2 PRO HA A 2 PRO HBy 1.0 1.8 7.0 241 209 A 2 PRO HA A 2 PRO HDy 1.0 1.8 7.0 242 210 A 3 ASN HA A 3 ASN HBx 1.0 1.8 7.0 243 211 A 3 ASN HA A 3 ASN HBy 1.0 1.8 7.0 244 212 A 3 ASN HA A 3 ASN HBx 1.0 1.8 7.0 245 213 A 3 ASN HA A 3 ASN HBy 1.0 1.8 7.0 246 214 A 5 GLN HA A 5 GLN HBx 1.0 1.8 7.0 247 215 A 6 LEU HBx A 6 LEU HA 1.0 1.8 7.0 248 216 A 7 ILE HB A 7 ILE HA 1.0 1.8 7.0 249 217 A 7 ILE HG1x A 7 ILE HA 1.0 1.8 7.0 250 218 A 7 ILE HG2% A 7 ILE HA 1.0 1.8 7.0 251 219 A 7 ILE HB A 7 ILE HA 1.0 1.8 7.0 252 220 A 7 ILE HD1% A 7 ILE HB 1.0 1.8 7.0 253 221 A 7 ILE HG1x A 7 ILE HB 1.0 1.8 7.0 254 222 A 7 ILE HG1y A 7 ILE HA 1.0 1.8 7.0 255 223 A 7 ILE HD1% A 7 ILE HG1y 1.0 1.8 7.0 256 224 A 7 ILE HG2% A 7 ILE HA 1.0 1.8 7.0 257 225 A 9 ASP HA A 9 ASP HBx 1.0 1.8 7.0 258 226 A 9 ASP HBy A 10 PRO HDy 1.0 1.8 7.0 259 227 A 10 PRO HDy A 10 PRO HA 1.0 1.8 7.0 260 228 A 10 PRO HDy A 10 PRO HBx 1.0 1.8 7.0 261 228 A 10 PRO HDy A 10 PRO HBy 1.0 1.8 7.0 262 229 A 10 PRO HDx A 10 PRO HA 1.0 1.8 7.0 263 230 A 9 ASP HBy A 10 PRO HDy 1.0 1.8 7.0 264 231 A 10 PRO HDy A 10 PRO HGx 1.0 1.8 7.0 265 232 A 11 LEU HA A 11 LEU HBx 1.0 1.8 7.0 266 233 A 11 LEU HA A 11 LEU HBx 1.0 1.8 7.0 267 234 A 12 ASP HA A 12 ASP HBx 1.0 1.8 7.0 268 235 A 13 LYS HBx A 14 PRO HDy 1.0 1.8 7.0 269 236 A 15 ILE HB A 13 LYS HEy 1.0 1.8 7.0 270 236 A 13 LYS HEx A 15 ILE HB 1.0 1.8 7.0 271 237 A 14 PRO HDx A 14 PRO HA 1.0 1.8 7.0 272 238 A 14 PRO HA A 14 PRO HDy 1.0 1.8 7.0 273 239 A 14 PRO HDx A 14 PRO HA 1.0 1.8 7.0 274 240 A 14 PRO HA A 14 PRO HDy 1.0 1.8 7.0 275 241 A 15 ILE HA A 15 ILE HB 1.0 1.8 7.0 276 242 A 15 ILE HA A 15 ILE HG1x 1.0 1.8 7.0 277 243 A 15 ILE HA A 15 ILE HG1y 1.0 1.8 7.0 278 244 A 15 ILE HA A 15 ILE HG2% 1.0 1.8 7.0 279 245 A 15 ILE HB A 13 LYS HEy 1.0 1.8 7.0 280 245 A 13 LYS HEx A 15 ILE HB 1.0 1.8 7.0 281 246 A 15 ILE HB A 17 TYR HE% 1.0 1.8 7.0 282 247 A 13 LYS HA A 15 ILE HD1% 1.0 1.8 7.0 283 248 A 15 ILE HD1% A 17 TYR HD% 1.0 1.8 7.0 284 249 A 15 ILE HD1% A 17 TYR HE% 1.0 1.8 7.0 285 250 A 15 ILE HA A 15 ILE HG1x 1.0 1.8 7.0 286 251 A 15 ILE HA A 15 ILE HG2% 1.0 1.8 7.0 287 252 A 16 GLN HE2y A 16 GLN HBx 1.0 1.8 7.0 288 253 A 16 GLN HGx A 16 GLN HE2y 1.0 1.8 7.0 289 254 A 17 TYR HA A 17 TYR HD% 1.0 1.8 7.0 290 255 A 17 TYR HE% A 17 TYR HBy 1.0 1.8 7.0 291 256 A 16 GLN HE2y A 17 TYR HE% 1.0 1.8 7.0 292 257 A 18 ARG HA A 18 ARG HDx 1.0 1.8 7.0 293 258 A 18 ARG HBx A 18 ARG HDx 1.0 1.8 7.0 294 259 A 18 ARG HDy A 18 ARG HBx 1.0 1.8 7.0 295 260 A 18 ARG HBx A 29 LEU HDy% 1.0 1.8 7.0 296 261 A 18 ARG HA A 18 ARG HDx 1.0 1.8 7.0 297 262 A 18 ARG HBy A 18 ARG HDx 1.0 1.8 7.0 298 263 A 18 ARG HA A 18 ARG HDy 1.0 1.8 7.0 299 264 A 19 VAL HA A 18 ARG HGx 1.0 1.8 7.0 300 264 A 18 ARG HGy A 19 VAL HA 1.0 1.8 7.0 301 265 A 19 VAL HA A 25 LYS HA 1.0 1.8 7.0 302 266 A 19 VAL HA A 26 PRO HBy 1.0 1.8 7.0 303 267 A 19 VAL HA A 27 LEU HDy% 1.0 1.8 7.0 304 268 A 19 VAL HA A 19 VAL HB 1.0 1.8 7.0 305 269 A 17 TYR HD% A 19 VAL HGx% 1.0 1.8 7.0 306 270 A 19 VAL HGx% A 24 GLY HAy 1.0 1.8 7.0 307 271 A 19 VAL HGx% A 25 LYS HA 1.0 1.8 7.0 308 272 A 19 VAL HGx% A 25 LYS HBx 1.0 1.8 7.0 309 273 A 19 VAL HGx% A 26 PRO HA 1.0 1.8 7.0 310 274 A 19 VAL HGx% A 26 PRO HDx 1.0 1.8 7.0 311 275 A 18 ARG HA A 19 VAL HGy% 1.0 1.8 7.0 312 276 A 19 VAL HGy% A 24 GLY HAx 1.0 1.8 7.0 313 277 A 19 VAL HGy% A 26 PRO HA 1.0 1.8 7.0 314 278 A 27 LEU HDx% A 20 CYS HA 1.0 1.8 7.0 315 279 A 27 LEU HDx% A 20 CYS HBy 1.0 1.8 7.0 316 280 A 20 CYS HBy A 27 LEU HDy% 1.0 1.8 7.0 317 281 A 22 LYS HGx A 22 LYS HEy 1.0 1.8 7.0 318 281 A 22 LYS HEx A 22 LYS HGx 1.0 1.8 7.0 319 282 A 22 LYS HGx A 22 LYS HEy 1.0 1.8 7.0 320 282 A 22 LYS HEx A 22 LYS HGx 1.0 1.8 7.0 321 283 A 19 VAL HGx% A 25 LYS HA 1.0 1.8 7.0 322 284 A 25 LYS HA A 26 PRO HGx 1.0 1.8 7.0 323 285 A 26 PRO HDy A 25 LYS HBy 1.0 1.8 7.0 324 286 A 25 LYS HBy A 27 LEU HDy% 1.0 1.8 7.0 325 287 A 25 LYS HBy A 35 HIS HE1 1.0 1.8 7.0 326 288 A 24 GLY HAx A 25 LYS HBx 1.0 1.8 7.0 327 289 A 25 LYS HDx A 35 HIS HE1 1.0 1.8 7.0 328 290 A 25 LYS HDx A 25 LYS HEy 1.0 1.8 7.0 329 290 A 25 LYS HDx A 25 LYS HEx 1.0 1.8 7.0 330 291 A 25 LYS HA A 25 LYS HGx 1.0 1.8 7.0 331 291 A 25 LYS HA A 25 LYS HGy 1.0 1.8 7.0 332 292 A 25 LYS HEy A 25 LYS HGx 1.0 1.8 7.0 333 292 A 25 LYS HEx A 25 LYS HGx 1.0 1.8 7.0 334 292 A 25 LYS HGy A 25 LYS HEy 1.0 1.8 7.0 335 292 A 25 LYS HEx A 25 LYS HGy 1.0 1.8 7.0 336 293 A 26 PRO HDy A 25 LYS HGx 1.0 1.8 7.0 337 293 A 26 PRO HDy A 25 LYS HGy 1.0 1.8 7.0 338 294 A 17 TYR HD% A 26 PRO HA 1.0 1.8 7.0 339 295 A 19 VAL HGx% A 26 PRO HA 1.0 1.8 7.0 340 296 A 19 VAL HGy% A 26 PRO HA 1.0 1.8 7.0 341 297 A 26 PRO HA A 25 LYS HA 1.0 1.8 7.0 342 298 A 26 PRO HA A 26 PRO HDy 1.0 1.8 7.0 343 299 A 26 PRO HA A 26 PRO HGy 1.0 1.8 7.0 344 300 A 17 TYR HD% A 26 PRO HBx 1.0 1.8 7.0 345 301 A 19 VAL HA A 26 PRO HBx 1.0 1.8 7.0 346 302 A 17 TYR HD% A 26 PRO HBy 1.0 1.8 7.0 347 303 A 17 TYR HE% A 26 PRO HBy 1.0 1.8 7.0 348 304 A 19 VAL HA A 26 PRO HBy 1.0 1.8 7.0 349 305 A 26 PRO HA A 26 PRO HBy 1.0 1.8 7.0 350 306 A 19 VAL HGx% A 26 PRO HDx 1.0 1.8 7.0 351 307 A 26 PRO HDy A 26 PRO HBx 1.0 1.8 7.0 352 308 A 25 LYS HA A 26 PRO HGy 1.0 1.8 7.0 353 309 A 26 PRO HA A 26 PRO HGy 1.0 1.8 7.0 354 310 A 25 LYS HA A 26 PRO HGx 1.0 1.8 7.0 355 311 A 27 LEU HDx% A 27 LEU HA 1.0 1.8 7.0 356 312 A 27 LEU HA A 28 ALA HA 1.0 1.8 7.0 357 313 A 32 ILE HA A 27 LEU HBx 1.0 1.8 7.0 358 314 A 35 HIS HD2 A 27 LEU HBx 1.0 1.8 7.0 359 315 A 27 LEU HBy A 27 LEU HDy% 1.0 1.8 7.0 360 316 A 27 LEU HBy A 32 ILE HA 1.0 1.8 7.0 361 317 A 27 LEU HDx% A 20 CYS HA 1.0 1.8 7.0 362 318 A 27 LEU HDx% A 27 LEU HA 1.0 1.8 7.0 363 319 A 27 LEU HDx% A 32 ILE HA 1.0 1.8 7.0 364 320 A 27 LEU HDx% A 35 HIS HBx 1.0 1.8 7.0 365 321 A 27 LEU HDx% A 35 HIS HD2 1.0 1.8 7.0 366 322 A 27 LEU HDx% A 35 HIS HE1 1.0 1.8 7.0 367 323 A 20 CYS HBy A 27 LEU HDy% 1.0 1.8 7.0 368 324 A 25 LYS HBy A 27 LEU HDy% 1.0 1.8 7.0 369 325 A 25 LYS HDx A 27 LEU HDy% 1.0 1.8 7.0 370 326 A 27 LEU HDy% A 35 HIS HBx 1.0 1.8 7.0 371 327 A 27 LEU HDy% A 35 HIS HD2 1.0 1.8 7.0 372 328 A 27 LEU HDy% A 35 HIS HE1 1.0 1.8 7.0 373 329 A 17 TYR HD% A 28 ALA HA 1.0 1.8 7.0 374 330 A 17 TYR HE% A 28 ALA HA 1.0 1.8 7.0 375 331 A 28 ALA HA A 29 LEU HDy% 1.0 1.8 7.0 376 332 A 17 TYR HA A 28 ALA HB% 1.0 1.8 7.0 377 333 A 17 TYR HD% A 28 ALA HB% 1.0 1.8 7.0 378 334 A 17 TYR HE% A 28 ALA HB% 1.0 1.8 7.0 379 335 A 29 LEU HA A 32 ILE HD1% 1.0 1.8 7.0 380 336 A 29 LEU HA A 32 ILE HG2% 1.0 1.8 7.0 381 337 A 16 GLN HE2y A 29 LEU HDx% 1.0 1.8 7.0 382 338 A 29 LEU HA A 29 LEU HDy% 1.0 1.8 7.0 383 339 A 32 ILE HA A 31 ALA HB% 1.0 1.8 7.0 384 340 A 32 ILE HA A 27 LEU HBx 1.0 1.8 7.0 385 341 A 27 LEU HBy A 32 ILE HA 1.0 1.8 7.0 386 342 A 27 LEU HDx% A 32 ILE HA 1.0 1.8 7.0 387 343 A 27 LEU HDy% A 32 ILE HA 1.0 1.8 7.0 388 344 A 32 ILE HA A 31 ALA HB% 1.0 1.8 7.0 389 345 A 32 ILE HA A 32 ILE HG1y 1.0 1.8 7.0 390 346 A 32 ILE HA A 32 ILE HG2% 1.0 1.8 7.0 391 347 A 32 ILE HA A 35 HIS HBy 1.0 1.8 7.0 392 348 A 32 ILE HA A 35 HIS HD2 1.0 1.8 7.0 393 349 A 27 LEU HDx% A 32 ILE HD1% 1.0 1.8 7.0 394 350 A 29 LEU HA A 32 ILE HD1% 1.0 1.8 7.0 395 351 A 32 ILE HG1x A 36 LEU HDx% 1.0 1.8 7.0 396 351 A 36 LEU HDy% A 32 ILE HG1x 1.0 1.8 7.0 397 352 A 36 LEU HG A 32 ILE HG1x 1.0 1.8 7.0 398 353 A 32 ILE HA A 32 ILE HG1y 1.0 1.8 7.0 399 354 A 32 ILE HB A 32 ILE HG1y 1.0 1.8 7.0 400 355 A 33 VAL HA A 36 LEU HDx% 1.0 1.8 7.0 401 355 A 33 VAL HA A 36 LEU HDy% 1.0 1.8 7.0 402 356 A 35 HIS HA A 35 HIS HBx 1.0 1.8 7.0 403 357 A 35 HIS HA A 35 HIS HD2 1.0 1.8 7.0 404 358 A 27 LEU HDx% A 35 HIS HBx 1.0 1.8 7.0 405 359 A 27 LEU HDy% A 35 HIS HBx 1.0 1.8 7.0 406 360 A 35 HIS HA A 35 HIS HBx 1.0 1.8 7.0 407 361 A 35 HIS HBx A 35 HIS HD2 1.0 1.8 7.0 408 362 A 32 ILE HA A 35 HIS HBy 1.0 1.8 7.0 409 363 A 35 HIS HBy A 35 HIS HE1 1.0 1.8 7.0 410 364 A 36 LEU HA A 35 HIS HD2 1.0 1.8 7.0 411 365 A 36 LEU HA A 36 LEU HDx% 1.0 1.8 7.0 412 365 A 36 LEU HA A 36 LEU HDy% 1.0 1.8 7.0 413 366 A 35 HIS HD2 A 36 LEU HBy 1.0 1.8 7.0 414 367 A 33 VAL HA A 36 LEU HDx% 1.0 1.8 7.0 415 367 A 33 VAL HA A 36 LEU HDy% 1.0 1.8 7.0 416 368 A 38 ASN HA A 39 HIS HD2 1.0 1.8 7.0 417 369 A 40 CYS HA A 40 CYS HBy 1.0 1.8 7.0 418 370 A 40 CYS HA A 40 CYS HBx 1.0 1.8 7.0 419 371 A 4 ALA HA A 3 ASN H 1.0 1.8 5.0 420 372 A 6 LEU HA A 7 ILE H 1.0 1.8 5.0 421 373 A 6 LEU HBx A 6 LEU H 1.0 1.8 5.0 422 374 A 7 ILE HG1y A 7 ILE HA 1.0 1.8 5.0 423 375 A 7 ILE HA A 8 GLU H 1.0 1.8 5.0 424 376 A 7 ILE HG2% A 7 ILE HB 1.0 1.8 5.0 425 377 A 7 ILE HD1% A 7 ILE HB 1.0 1.8 5.0 426 378 A 7 ILE HG1x A 7 ILE HB 1.0 1.8 5.0 427 379 A 7 ILE HG1x A 7 ILE HG2% 1.0 1.8 5.0 428 380 A 8 GLU HA A 8 GLU HBx 1.0 1.8 5.0 429 381 A 8 GLU HA A 8 GLU H 1.0 1.8 5.0 430 382 A 8 GLU HA A 8 GLU HBx 1.0 1.8 5.0 431 383 A 8 GLU HBy A 8 GLU HGy 1.0 1.8 5.0 432 384 A 8 GLU HBy A 8 GLU H 1.0 1.8 5.0 433 385 A 9 ASP HA A 9 ASP HBx 1.0 1.8 5.0 434 386 A 10 PRO HA A 11 LEU H 1.0 1.8 5.0 435 387 A 11 LEU H A 10 PRO HBx 1.0 1.8 5.0 436 387 A 10 PRO HBy A 11 LEU H 1.0 1.8 5.0 437 388 A 11 LEU HBy A 11 LEU HA 1.0 1.8 5.0 438 389 A 11 LEU HG A 11 LEU HA 1.0 1.8 5.0 439 390 A 11 LEU HA A 12 ASP H 1.0 1.8 5.0 440 391 A 11 LEU HBy A 11 LEU HA 1.0 1.8 5.0 441 392 A 11 LEU HBy A 11 LEU HDx% 1.0 1.8 5.0 442 393 A 11 LEU HBy A 11 LEU H 1.0 1.8 5.0 443 394 A 11 LEU HDy% A 11 LEU HA 1.0 1.8 5.0 444 395 A 12 ASP HBy A 13 LYS H 1.0 1.8 5.0 445 396 A 13 LYS HA A 13 LYS H 1.0 1.8 5.0 446 397 A 13 LYS HBx A 13 LYS HEy 1.0 1.8 5.0 447 397 A 13 LYS HBx A 13 LYS HEx 1.0 1.8 5.0 448 398 A 13 LYS HBx A 15 ILE H 1.0 1.8 5.0 449 399 A 13 LYS H A 13 LYS HBy 1.0 1.8 5.0 450 400 A 15 ILE HG1y A 13 LYS HGy 1.0 1.8 7.0 451 401 A 15 ILE HA A 16 GLN H 1.0 1.8 5.0 452 402 A 15 ILE HA A 15 ILE HB 1.0 1.8 5.0 453 403 A 15 ILE HD1% A 15 ILE HG1x 1.0 1.8 5.0 454 404 A 15 ILE HD1% A 15 ILE HG1x 1.0 1.8 5.0 455 405 A 15 ILE HG1x A 15 ILE H 1.0 1.8 5.0 456 406 A 15 ILE HA A 15 ILE HG1y 1.0 1.8 5.0 457 407 A 15 ILE HD1% A 15 ILE HG1y 1.0 1.8 5.0 458 408 A 17 TYR HE% A 15 ILE HG2% 1.0 1.8 5.0 459 409 A 16 GLN HA A 17 TYR H 1.0 1.8 5.0 460 410 A 16 GLN HGx A 16 GLN HBx 1.0 1.8 5.0 461 411 A 15 ILE HA A 16 GLN HBy 1.0 1.8 5.0 462 412 A 16 GLN HBy A 16 GLN HGy 1.0 1.8 5.0 463 413 A 16 GLN HGx A 16 GLN HBy 1.0 1.8 5.0 464 414 A 16 GLN HE2y A 17 TYR HD% 1.0 1.8 5.0 465 415 A 15 ILE HA A 16 GLN HGx 1.0 1.8 5.0 466 416 A 16 GLN HGx A 16 GLN HBx 1.0 1.8 5.0 467 417 A 17 TYR HA A 18 ARG H 1.0 1.8 5.0 468 418 A 17 TYR HA A 28 ALA HA 1.0 1.8 4.0 469 419 A 17 TYR HBy A 17 TYR H 1.0 1.8 5.0 470 420 A 17 TYR HBy A 18 ARG H 1.0 1.8 5.0 471 421 A 18 ARG HA A 19 VAL H 1.0 1.8 5.0 472 422 A 18 ARG HDx A 18 ARG HGx 1.0 1.8 5.0 473 422 A 18 ARG HGy A 18 ARG HDx 1.0 1.8 5.0 474 423 A 18 ARG HDy A 18 ARG HBy 1.0 1.8 5.0 475 424 A 18 ARG HDy A 18 ARG HGx 1.0 1.8 5.0 476 424 A 18 ARG HDy A 18 ARG HGy 1.0 1.8 5.0 477 425 A 18 ARG HDy A 18 ARG HGx 1.0 1.8 5.0 478 425 A 18 ARG HDy A 18 ARG HGy 1.0 1.8 5.0 479 426 A 19 VAL H A 18 ARG HGx 1.0 1.8 5.0 480 426 A 18 ARG HGy A 19 VAL H 1.0 1.8 5.0 481 427 A 27 LEU H A 18 ARG HGx 1.0 1.8 5.0 482 427 A 18 ARG HGy A 27 LEU H 1.0 1.8 5.0 483 428 A 19 VAL HA A 19 VAL HB 1.0 1.8 5.0 484 429 A 19 VAL HA A 20 CYS H 1.0 1.8 5.0 485 430 A 19 VAL HB A 19 VAL H 1.0 1.8 5.0 486 431 A 19 VAL HGx% A 19 VAL H 1.0 1.8 5.0 487 432 A 19 VAL H A 20 CYS H 1.0 1.8 5.0 488 433 A 20 CYS HA A 21 GLU H 1.0 1.8 5.0 489 434 A 20 CYS HBx A 24 GLY H 1.0 1.8 5.0 490 435 A 20 CYS HBx A 25 LYS H 1.0 1.8 5.0 491 436 A 20 CYS HBy A 20 CYS H 1.0 1.8 5.0 492 437 A 20 CYS HBy A 24 GLY H 1.0 1.8 5.0 493 438 A 21 GLU HBx A 22 LYS H 1.0 1.8 5.0 494 439 A 22 LYS HA A 23 CYS H 1.0 1.8 5.0 495 440 A 22 LYS HBx A 22 LYS H 1.0 1.8 5.0 496 441 A 22 LYS HBx A 23 CYS H 1.0 1.8 5.0 497 442 A 22 LYS HDy A 22 LYS H 1.0 1.8 5.0 498 443 A 22 LYS HGy A 22 LYS HEy 1.0 1.8 5.0 499 443 A 22 LYS HEx A 22 LYS HGy 1.0 1.8 5.0 500 444 A 21 GLU H A 22 LYS H 1.0 1.8 5.0 501 445 A 22 LYS H A 23 CYS H 1.0 1.8 5.0 502 446 A 22 LYS H A 23 CYS H 1.0 1.8 5.0 503 447 A 24 GLY H A 23 CYS H 1.0 1.8 5.0 504 448 A 24 GLY HAx A 24 GLY H 1.0 1.8 5.0 505 449 A 24 GLY HAy A 24 GLY H 1.0 1.8 5.0 506 450 A 24 GLY HAy A 25 LYS H 1.0 1.8 5.0 507 451 A 24 GLY H A 23 CYS H 1.0 1.8 5.0 508 452 A 24 GLY H A 25 LYS H 1.0 1.8 5.0 509 453 A 25 LYS HBy A 25 LYS HGx 1.0 1.8 5.0 510 453 A 25 LYS HBy A 25 LYS HGy 1.0 1.8 5.0 511 454 A 25 LYS HBy A 25 LYS H 1.0 1.8 5.0 512 455 A 25 LYS HDx A 25 LYS HEy 1.0 1.8 5.0 513 455 A 25 LYS HDx A 25 LYS HEx 1.0 1.8 5.0 514 456 A 25 LYS HDx A 25 LYS HGx 1.0 1.8 5.0 515 456 A 25 LYS HDx A 25 LYS HGy 1.0 1.8 5.0 516 457 A 25 LYS HDx A 27 LEU HDy% 1.0 1.8 5.0 517 458 A 20 CYS H A 25 LYS H 1.0 1.8 5.0 518 459 A 26 PRO HA A 26 PRO HBy 1.0 1.8 5.0 519 460 A 26 PRO HBx A 26 PRO HDx 1.0 1.8 5.0 520 461 A 26 PRO HGy A 26 PRO HDx 1.0 1.8 5.0 521 462 A 26 PRO HGx A 26 PRO HDx 1.0 1.8 5.0 522 463 A 26 PRO HGy A 26 PRO HDx 1.0 1.8 5.0 523 464 A 26 PRO HGx A 26 PRO HDx 1.0 1.8 5.0 524 465 A 17 TYR HD% A 27 LEU HA 1.0 1.8 5.0 525 466 A 27 LEU HBy A 27 LEU HA 1.0 1.8 5.0 526 467 A 27 LEU HA A 27 LEU HDy% 1.0 1.8 5.0 527 468 A 27 LEU HA A 28 ALA H 1.0 1.8 5.0 528 469 A 27 LEU HBx A 28 ALA H 1.0 1.8 5.0 529 470 A 27 LEU HDx% A 27 LEU HBy 1.0 1.8 5.0 530 471 A 27 LEU HDx% A 18 ARG HGx 1.0 1.8 5.0 531 471 A 18 ARG HGy A 27 LEU HDx% 1.0 1.8 5.0 532 472 A 27 LEU HDx% A 27 LEU HBy 1.0 1.8 5.0 533 473 A 27 LEU HDx% A 35 HIS HBy 1.0 1.8 5.0 534 474 A 27 LEU HDy% A 18 ARG HGx 1.0 1.8 5.0 535 474 A 18 ARG HGy A 27 LEU HDy% 1.0 1.8 5.0 536 475 A 27 LEU HDy% A 35 HIS HBy 1.0 1.8 5.0 537 476 A 28 ALA HA A 28 ALA H 1.0 1.8 5.0 538 477 A 28 ALA HA A 29 LEU H 1.0 1.8 5.0 539 478 A 28 ALA HB% A 28 ALA H 1.0 1.8 5.0 540 479 A 27 LEU H A 28 ALA H 1.0 1.8 5.0 541 480 A 29 LEU HA A 29 LEU HBx 1.0 1.8 5.0 542 481 A 31 ALA HB% A 28 ALA H 1.0 1.8 5.0 543 482 A 31 ALA HB% A 31 ALA H 1.0 1.8 5.0 544 483 A 31 ALA H A 32 ILE H 1.0 1.8 5.0 545 484 A 32 ILE HB A 32 ILE HG1y 1.0 1.8 5.0 546 485 A 32 ILE HB A 32 ILE H 1.0 1.8 5.0 547 486 A 32 ILE HD1% A 32 ILE HG1x 1.0 1.8 5.0 548 487 A 32 ILE HD1% A 32 ILE H 1.0 1.8 5.0 549 488 A 32 ILE HD1% A 33 VAL H 1.0 1.8 5.0 550 489 A 32 ILE HB A 32 ILE HG1x 1.0 1.8 5.0 551 490 A 32 ILE HD1% A 32 ILE HG1x 1.0 1.8 5.0 552 491 A 29 LEU HA A 32 ILE HG2% 1.0 1.8 5.0 553 492 A 32 ILE HA A 32 ILE HG2% 1.0 1.8 5.0 554 493 A 31 ALA H A 32 ILE H 1.0 1.8 5.0 555 494 A 33 VAL HA A 33 VAL HGy% 1.0 1.8 5.0 556 495 A 33 VAL HA A 33 VAL H 1.0 1.8 5.0 557 496 A 33 VAL HB A 33 VAL H 1.0 1.8 5.0 558 497 A 33 VAL HB A 34 ASP H 1.0 1.8 5.0 559 498 A 33 VAL HGx% A 33 VAL H 1.0 1.8 5.0 560 499 A 33 VAL HGx% A 33 VAL HGy% 1.0 1.8 5.0 561 500 A 33 VAL H A 34 ASP H 1.0 1.8 5.0 562 501 A 34 ASP HA A 34 ASP HBy 1.0 1.8 5.0 563 502 A 34 ASP HA A 34 ASP H 1.0 1.8 5.0 564 503 A 34 ASP HA A 34 ASP HBx 1.0 1.8 5.0 565 504 A 34 ASP HBx A 34 ASP H 1.0 1.8 5.0 566 505 A 34 ASP H A 34 ASP HBy 1.0 1.8 5.0 567 506 A 33 VAL H A 34 ASP H 1.0 1.8 5.0 568 507 A 35 HIS HBx A 35 HIS H 1.0 1.8 5.0 569 508 A 35 HIS HBx A 36 LEU H 1.0 1.8 5.0 570 509 A 27 LEU HDx% A 35 HIS HBy 1.0 1.8 5.0 571 510 A 27 LEU HDy% A 35 HIS HBy 1.0 1.8 5.0 572 511 A 35 HIS HBy A 35 HIS HD2 1.0 1.8 5.0 573 512 A 35 HIS HBy A 35 HIS H 1.0 1.8 5.0 574 513 A 35 HIS HBy A 36 LEU H 1.0 1.8 5.0 575 514 A 35 HIS H A 36 LEU H 1.0 1.8 5.0 576 515 A 36 LEU HA A 36 LEU HBx 1.0 1.8 5.0 577 516 A 36 LEU HA A 36 LEU HBy 1.0 1.8 5.0 578 517 A 36 LEU HA A 36 LEU H 1.0 1.8 5.0 579 518 A 36 LEU HBx A 35 HIS HD2 1.0 1.8 5.0 580 519 A 36 LEU HBx A 36 LEU H 1.0 1.8 5.0 581 520 A 36 LEU HBy A 36 LEU HDx% 1.0 1.8 5.0 582 520 A 36 LEU HDy% A 36 LEU HBy 1.0 1.8 5.0 583 521 A 36 LEU HG A 36 LEU HBy 1.0 1.8 5.0 584 522 A 36 LEU HG A 35 HIS HD2 1.0 1.8 5.0 585 523 A 36 LEU HG A 36 LEU HDx% 1.0 1.8 5.0 586 523 A 36 LEU HG A 36 LEU HDy% 1.0 1.8 5.0 587 524 A 35 HIS H A 36 LEU H 1.0 1.8 5.0 588 525 A 37 GLU HGx A 37 GLU HBy 1.0 1.8 5.0 589 526 A 37 GLU HBy A 37 GLU HGy 1.0 1.8 5.0 590 527 A 38 ASN HA A 39 HIS HBx 1.0 1.8 5.0 591 527 A 38 ASN HA A 39 HIS HBy 1.0 1.8 5.0 592 528 A 38 ASN H A 37 GLU H 1.0 1.8 5.0 593 529 A 39 HIS HA A 39 HIS HBx 1.0 1.8 5.0 594 530 A 39 HIS HA A 39 HIS HBy 1.0 1.8 5.0 595 531 A 39 HIS HBy A 40 CYS H 1.0 1.8 5.0 596 532 A 35 HIS HD2 A 39 HIS HE1 1.0 1.8 7.0 597 533 A 40 CYS HA A 40 CYS HBy 1.0 1.8 5.0 598 534 A 40 CYS HBy A 40 CYS H 1.0 1.8 5.0 599 535 A 40 CYS H A 39 HIS H 1.0 1.8 5.0 600 536 A 41 ALA HB% A 41 ALA H 1.0 1.8 5.0 601 537 A 42 GLY HAy A 42 GLY H 1.0 1.8 5.0 602 538 A 43 ALA HB% A 43 ALA HA 1.0 1.8 5.0 603 539 A 5 GLN HBx A 5 GLN HGx 1.0 1.8 4.0 604 539 A 5 GLN HGy A 5 GLN HBx 1.0 1.8 4.0 605 540 A 6 LEU HG A 6 LEU HA 1.0 1.8 4.0 606 541 A 6 LEU HDy% A 6 LEU HDx% 1.0 1.8 4.0 607 542 A 7 ILE HD1% A 7 ILE HG1x 1.0 1.8 4.0 608 543 A 7 ILE HG1x A 7 ILE HA 1.0 1.8 4.0 609 544 A 7 ILE HD1% A 7 ILE HG1x 1.0 1.8 4.0 610 545 A 10 PRO HGy A 10 PRO HBx 1.0 1.8 4.0 611 545 A 10 PRO HBy A 10 PRO HGy 1.0 1.8 4.0 612 546 A 10 PRO HGy A 10 PRO HBx 1.0 1.8 4.0 613 546 A 10 PRO HBy A 10 PRO HGy 1.0 1.8 4.0 614 547 A 11 LEU HDy% A 11 LEU HA 1.0 1.8 4.0 615 548 A 13 LYS HGy A 13 LYS HDx 1.0 1.8 4.0 616 549 A 13 LYS HGy A 13 LYS HDx 1.0 1.8 4.0 617 550 A 14 PRO HA A 15 ILE H 1.0 1.8 4.0 618 551 A 15 ILE HB A 16 GLN H 1.0 1.8 4.0 619 552 A 15 ILE HG1x A 15 ILE HG2% 1.0 1.8 4.0 620 553 A 16 GLN HBx A 16 GLN HGy 1.0 1.8 4.0 621 554 A 17 TYR HE% A 17 TYR HD% 1.0 1.8 4.0 622 555 A 17 TYR HE% A 17 TYR HD% 1.0 1.8 4.0 623 556 A 18 ARG HA A 18 ARG HBy 1.0 1.8 4.0 624 557 A 18 ARG HDx A 18 ARG HGx 1.0 1.8 4.0 625 557 A 18 ARG HGy A 18 ARG HDx 1.0 1.8 4.0 626 558 A 18 ARG H A 18 ARG HGx 1.0 1.8 4.0 627 558 A 18 ARG HGy A 18 ARG H 1.0 1.8 4.0 628 559 A 19 VAL HGy% A 19 VAL H 1.0 1.8 4.0 629 560 A 19 VAL HGy% A 24 GLY HAy 1.0 1.8 4.0 630 561 A 21 GLU HA A 21 GLU HGx 1.0 1.8 4.0 631 562 A 21 GLU HBx A 21 GLU HGx 1.0 1.8 4.0 632 563 A 22 LYS HBx A 22 LYS HA 1.0 1.8 4.0 633 564 A 25 LYS HA A 25 LYS HGx 1.0 1.8 4.0 634 564 A 25 LYS HA A 25 LYS HGy 1.0 1.8 4.0 635 565 A 25 LYS HA A 26 PRO HDx 1.0 1.8 4.0 636 566 A 25 LYS HBy A 25 LYS HDx 1.0 1.8 4.0 637 567 A 25 LYS HBy A 25 LYS HDx 1.0 1.8 4.0 638 568 A 26 PRO HBx A 26 PRO HDx 1.0 1.8 4.0 639 569 A 26 PRO HBy A 26 PRO HGy 1.0 1.8 4.0 640 570 A 27 LEU HDx% A 32 ILE HD1% 1.0 1.8 4.0 641 571 A 19 VAL HA A 27 LEU HDy% 1.0 1.8 4.0 642 572 A 28 ALA HB% A 31 ALA HB% 1.0 1.8 4.0 643 573 A 17 TYR HD% A 28 ALA H 1.0 1.8 4.0 644 574 A 29 LEU HA A 29 LEU HDy% 1.0 1.8 4.0 645 575 A 29 LEU HA A 29 LEU HBy 1.0 1.8 4.0 646 576 A 28 ALA HB% A 31 ALA HB% 1.0 1.8 4.0 647 577 A 32 ILE HD1% A 32 ILE HG2% 1.0 1.8 4.0 648 578 A 32 ILE HG2% A 32 ILE HG1y 1.0 1.8 4.0 649 579 A 33 VAL HA A 33 VAL HB 1.0 1.8 4.0 650 580 A 34 ASP HA A 34 ASP HBy 1.0 1.8 4.0 651 581 A 36 LEU HBy A 36 LEU HDx% 1.0 1.8 4.0 652 581 A 36 LEU HDy% A 36 LEU HBy 1.0 1.8 4.0 653 582 A 37 GLU HA A 37 GLU HBx 1.0 1.8 4.0 654 583 A 37 GLU HGx A 37 GLU HBy 1.0 1.8 4.0 655 584 A 39 HIS HA A 38 ASN H 1.0 1.8 4.0 656 585 A 39 HIS HA A 39 HIS H 1.0 1.8 4.0 657 586 A 4 ALA HA A 4 ALA H 1.0 1.8 7.0 658 587 A 4 ALA HA A 5 GLN H 1.0 1.8 7.0 659 588 A 4 ALA HB% A 4 ALA H 1.0 1.8 7.0 660 589 A 5 GLN HA A 6 LEU H 1.0 1.8 7.0 661 590 A 5 GLN HBy A 5 GLN H 1.0 1.8 7.0 662 591 A 6 LEU HG A 6 LEU HA 1.0 1.8 7.0 663 592 A 7 ILE HA A 7 ILE H 1.0 1.8 7.0 664 593 A 7 ILE HB A 7 ILE H 1.0 1.8 7.0 665 594 A 7 ILE HD1% A 7 ILE H 1.0 1.8 7.0 666 595 A 7 ILE HG1x A 7 ILE H 1.0 1.8 7.0 667 596 A 7 ILE HG1y A 7 ILE H 1.0 1.8 7.0 668 597 A 7 ILE HG2% A 7 ILE H 1.0 1.8 7.0 669 598 A 7 ILE HG2% A 8 GLU H 1.0 1.8 7.0 670 599 A 8 GLU H A 8 GLU HBx 1.0 1.8 7.0 671 600 A 8 GLU HA A 8 GLU HBy 1.0 1.8 7.0 672 601 A 8 GLU HA A 8 GLU HGy 1.0 1.8 7.0 673 602 A 8 GLU HBy A 10 PRO HA 1.0 1.8 7.0 674 603 A 12 ASP H A 10 PRO HBx 1.0 1.8 7.0 675 603 A 10 PRO HBy A 12 ASP H 1.0 1.8 7.0 676 604 A 10 PRO HDy A 10 PRO HBx 1.0 1.8 7.0 677 604 A 10 PRO HDy A 10 PRO HBy 1.0 1.8 7.0 678 605 A 11 LEU HDy% A 11 LEU H 1.0 1.8 7.0 679 606 A 11 LEU HG A 11 LEU H 1.0 1.8 7.0 680 607 A 11 LEU HG A 12 ASP H 1.0 1.8 7.0 681 608 A 11 LEU H A 12 ASP H 1.0 1.8 7.0 682 609 A 12 ASP HA A 12 ASP H 1.0 1.8 7.0 683 610 A 12 ASP HBx A 12 ASP H 1.0 1.8 7.0 684 611 A 12 ASP HBx A 13 LYS H 1.0 1.8 7.0 685 612 A 12 ASP HBy A 12 ASP H 1.0 1.8 7.0 686 613 A 11 LEU H A 12 ASP H 1.0 1.8 7.0 687 614 A 12 ASP H A 13 LYS H 1.0 1.8 7.0 688 615 A 13 LYS HBx A 15 ILE HG1y 1.0 1.8 7.0 689 616 A 13 LYS HBx A 13 LYS HEy 1.0 1.8 7.0 690 616 A 13 LYS HBx A 13 LYS HEx 1.0 1.8 7.0 691 617 A 13 LYS H A 13 LYS HGx 1.0 1.8 7.0 692 618 A 13 LYS H A 13 LYS HGy 1.0 1.8 7.0 693 619 A 12 ASP H A 13 LYS H 1.0 1.8 7.0 694 620 A 15 ILE H A 14 PRO HBy 1.0 1.8 7.0 695 620 A 14 PRO HBx A 15 ILE H 1.0 1.8 7.0 696 621 A 15 ILE HA A 15 ILE H 1.0 1.8 7.0 697 622 A 15 ILE HB A 15 ILE HG1x 1.0 1.8 7.0 698 623 A 15 ILE HB A 15 ILE HG2% 1.0 1.8 7.0 699 624 A 15 ILE HD1% A 15 ILE H 1.0 1.8 7.0 700 625 A 15 ILE HD1% A 16 GLN H 1.0 1.8 7.0 701 626 A 13 LYS HBx A 15 ILE HG1y 1.0 1.8 7.0 702 627 A 15 ILE HG1y A 15 ILE H 1.0 1.8 7.0 703 628 A 15 ILE HG2% A 15 ILE H 1.0 1.8 7.0 704 629 A 16 GLN HBx A 17 TYR H 1.0 1.8 7.0 705 630 A 16 GLN H A 16 GLN HBy 1.0 1.8 7.0 706 631 A 17 TYR H A 16 GLN HBy 1.0 1.8 7.0 707 632 A 16 GLN HGx A 16 GLN HBy 1.0 1.8 7.0 708 633 A 16 GLN HGx A 16 GLN H 1.0 1.8 7.0 709 634 A 17 TYR HA A 17 TYR H 1.0 1.8 7.0 710 635 A 17 TYR HA A 27 LEU H 1.0 1.8 7.0 711 636 A 17 TYR HA A 29 LEU H 1.0 1.8 7.0 712 637 A 17 TYR HBy A 27 LEU H 1.0 1.8 7.0 713 638 A 17 TYR HD% A 17 TYR H 1.0 1.8 7.0 714 639 A 17 TYR HD% A 17 TYR H 1.0 1.8 7.0 715 640 A 18 ARG HA A 18 ARG H 1.0 1.8 7.0 716 641 A 18 ARG HBx A 18 ARG H 1.0 1.8 7.0 717 642 A 18 ARG HBx A 19 VAL H 1.0 1.8 7.0 718 643 A 18 ARG HBy A 18 ARG H 1.0 1.8 7.0 719 644 A 18 ARG HBy A 19 VAL H 1.0 1.8 7.0 720 645 A 27 LEU HDy% A 18 ARG HGx 1.0 1.8 7.0 721 645 A 18 ARG HGy A 27 LEU HDy% 1.0 1.8 7.0 722 646 A 18 ARG H A 27 LEU H 1.0 1.8 7.0 723 647 A 19 VAL HA A 19 VAL H 1.0 1.8 7.0 724 648 A 19 VAL HA A 27 LEU H 1.0 1.8 7.0 725 649 A 19 VAL HB A 20 CYS H 1.0 1.8 7.0 726 650 A 19 VAL HGx% A 20 CYS H 1.0 1.8 7.0 727 651 A 19 VAL HGx% A 24 GLY HAx 1.0 1.8 7.0 728 652 A 19 VAL HGy% A 20 CYS H 1.0 1.8 7.0 729 653 A 19 VAL HGy% A 24 GLY H 1.0 1.8 7.0 730 654 A 19 VAL HGy% A 25 LYS H 1.0 1.8 7.0 731 655 A 20 CYS HA A 22 LYS H 1.0 1.8 7.0 732 656 A 20 CYS HBx A 23 CYS H 1.0 1.8 7.0 733 657 A 20 CYS HBy A 23 CYS H 1.0 1.8 7.0 734 658 A 20 CYS HBy A 25 LYS H 1.0 1.8 7.0 735 659 A 19 VAL H A 20 CYS H 1.0 1.8 7.0 736 660 A 20 CYS H A 25 LYS H 1.0 1.8 4.0 737 661 A 27 LEU H A 20 CYS H 1.0 1.8 5.0 738 662 A 26 PRO HA A 20 CYS H 1.0 1.8 5.0 739 663 A 21 GLU HA A 21 GLU H 1.0 1.8 7.0 740 664 A 21 GLU HA A 22 LYS H 1.0 1.8 7.0 741 665 A 21 GLU HBx A 21 GLU H 1.0 1.8 7.0 742 666 A 21 GLU HBy A 21 GLU H 1.0 1.8 7.0 743 667 A 21 GLU HGx A 21 GLU H 1.0 1.8 7.0 744 668 A 21 GLU H A 22 LYS H 1.0 1.8 7.0 745 669 A 22 LYS HA A 22 LYS H 1.0 1.8 7.0 746 670 A 22 LYS HGx A 22 LYS H 1.0 1.8 7.0 747 671 A 22 LYS HGy A 22 LYS H 1.0 1.8 7.0 748 672 A 24 GLY H A 22 LYS H 1.0 1.8 7.0 749 673 A 23 CYS HA A 23 CYS H 1.0 1.8 7.0 750 674 A 23 CYS HA A 24 GLY H 1.0 1.8 7.0 751 675 A 23 CYS HBx A 23 CYS H 1.0 1.8 7.0 752 676 A 23 CYS HBy A 23 CYS H 1.0 1.8 7.0 753 677 A 24 GLY H A 22 LYS H 1.0 1.8 7.0 754 678 A 25 LYS HA A 20 CYS H 1.0 1.8 7.0 755 679 A 25 LYS HA A 25 LYS HBy 1.0 1.8 7.0 756 680 A 25 LYS H A 25 LYS HGx 1.0 1.8 7.0 757 680 A 25 LYS HGy A 25 LYS H 1.0 1.8 7.0 758 681 A 24 GLY H A 25 LYS H 1.0 1.8 7.0 759 682 A 26 PRO HA A 27 LEU H 1.0 1.8 7.0 760 683 A 26 PRO HBx A 27 LEU H 1.0 1.8 7.0 761 684 A 27 LEU HBy A 27 LEU H 1.0 1.8 7.0 762 685 A 27 LEU HDx% A 20 CYS H 1.0 1.8 7.0 763 686 A 27 LEU HDx% A 27 LEU H 1.0 1.8 7.0 764 687 A 27 LEU HDx% A 28 ALA H 1.0 1.8 7.0 765 688 A 27 LEU HDy% A 20 CYS H 1.0 1.8 7.0 766 689 A 27 LEU HDy% A 27 LEU H 1.0 1.8 7.0 767 690 A 27 LEU HDy% A 28 ALA H 1.0 1.8 7.0 768 691 A 27 LEU HG A 27 LEU H 1.0 1.8 7.0 769 692 A 17 TYR HD% A 27 LEU H 1.0 1.8 7.0 770 693 A 18 ARG H A 27 LEU H 1.0 1.8 7.0 771 694 A 27 LEU H A 28 ALA H 1.0 1.8 7.0 772 695 A 28 ALA HB% A 29 LEU H 1.0 1.8 7.0 773 696 A 28 ALA HB% A 31 ALA H 1.0 1.8 7.0 774 697 A 29 LEU HA A 29 LEU H 1.0 1.8 7.0 775 698 A 29 LEU HA A 32 ILE H 1.0 1.8 7.0 776 699 A 29 LEU HDx% A 29 LEU H 1.0 1.8 7.0 777 700 A 30 THR HG2% A 30 THR H 1.0 1.8 7.0 778 701 A 30 THR HG2% A 31 ALA H 1.0 1.8 7.0 779 702 A 31 ALA H A 31 ALA HA 1.0 1.8 7.0 780 703 A 31 ALA HB% A 32 ILE H 1.0 1.8 7.0 781 704 A 31 ALA H A 30 THR H 1.0 1.8 7.0 782 705 A 32 ILE HA A 32 ILE H 1.0 1.8 7.0 783 706 A 32 ILE HA A 33 VAL H 1.0 1.8 7.0 784 707 A 32 ILE HA A 35 HIS H 1.0 1.8 7.0 785 708 A 32 ILE HA A 36 LEU H 1.0 1.8 7.0 786 709 A 32 ILE HB A 27 LEU HBx 1.0 1.8 7.0 787 710 A 32 ILE HB A 33 VAL H 1.0 1.8 7.0 788 711 A 32 ILE HA A 32 ILE HG1x 1.0 1.8 7.0 789 712 A 32 ILE HG1x A 32 ILE H 1.0 1.8 7.0 790 713 A 32 ILE HG1x A 33 VAL H 1.0 1.8 7.0 791 714 A 32 ILE HG1y A 32 ILE H 1.0 1.8 7.0 792 715 A 32 ILE HG2% A 32 ILE H 1.0 1.8 7.0 793 716 A 32 ILE H A 33 VAL H 1.0 1.8 7.0 794 717 A 33 VAL HA A 34 ASP H 1.0 1.8 7.0 795 718 A 33 VAL HA A 36 LEU H 1.0 1.8 7.0 796 719 A 33 VAL HGx% A 34 ASP H 1.0 1.8 7.0 797 720 A 33 VAL HGy% A 33 VAL H 1.0 1.8 7.0 798 721 A 33 VAL HGy% A 34 ASP H 1.0 1.8 7.0 799 722 A 32 ILE H A 33 VAL H 1.0 1.8 7.0 800 723 A 35 HIS HD2 A 36 LEU H 1.0 1.8 7.0 801 724 A 35 HIS HE1 A 35 HIS HD1 1.0 1.8 7.0 802 725 A 35 HIS HD2 A 35 HIS HE1 1.0 1.8 7.0 803 726 A 36 LEU HA A 37 GLU H 1.0 1.8 7.0 804 727 A 36 LEU HBx A 37 GLU H 1.0 1.8 7.0 805 728 A 36 LEU HBy A 36 LEU H 1.0 1.8 7.0 806 729 A 36 LEU HBy A 37 GLU H 1.0 1.8 7.0 807 730 A 36 LEU H A 36 LEU HDx% 1.0 1.8 7.0 808 730 A 36 LEU HDy% A 36 LEU H 1.0 1.8 7.0 809 731 A 36 LEU HG A 36 LEU H 1.0 1.8 7.0 810 732 A 35 HIS HD2 A 36 LEU H 1.0 1.8 7.0 811 733 A 37 GLU H A 37 GLU HA 1.0 1.8 7.0 812 734 A 37 GLU HGx A 37 GLU HA 1.0 1.8 7.0 813 735 A 37 GLU HGx A 37 GLU HBx 1.0 1.8 7.0 814 736 A 38 ASN H A 37 GLU H 1.0 1.8 7.0 815 737 A 38 ASN H A 38 ASN HBx 1.0 1.8 7.0 816 738 A 38 ASN H A 39 HIS H 1.0 1.8 7.0 817 739 A 39 HIS HA A 40 CYS H 1.0 1.8 7.0 818 740 A 38 ASN HD2x A 39 HIS HBx 1.0 1.8 7.0 819 740 A 39 HIS HBy A 38 ASN HD2x 1.0 1.8 7.0 820 741 A 39 HIS H A 39 HIS HBx 1.0 1.8 7.0 821 742 A 40 CYS H A 39 HIS HBx 1.0 1.8 7.0 822 743 A 38 ASN HD2x A 39 HIS HBx 1.0 1.8 7.0 823 743 A 39 HIS HBy A 38 ASN HD2x 1.0 1.8 7.0 824 744 A 39 HIS HBy A 39 HIS H 1.0 1.8 7.0 825 745 A 39 HIS H A 38 ASN HD2x 1.0 1.8 7.0 826 746 A 38 ASN H A 39 HIS H 1.0 1.8 7.0 827 747 A 41 ALA HA A 41 ALA H 1.0 1.8 7.0 828 748 A 42 GLY H A 42 GLY HAx 1.0 1.8 7.0 829 749 A 42 GLY HAx A 43 ALA H 1.0 1.8 7.0 830 750 A 43 ALA HA A 43 ALA H 1.0 1.8 7.0 831 751 A 43 ALA HA A 44 SER H 1.0 1.8 7.0 832 752 A 43 ALA HB% A 43 ALA H 1.0 1.8 7.0 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 A 35 HIS H A 31 ALA O 1.0 1.6 2.0 2 2 A 31 ALA O A 35 HIS N 1.0 2.2 3.0 3 3 A 36 LEU H A 32 ILE O 1.0 1.6 2.0 4 4 A 32 ILE O A 36 LEU N 1.0 2.2 3.0 5 5 A 37 GLU H A 33 VAL O 1.0 1.6 2.0 6 6 A 33 VAL O A 37 GLU N 1.0 2.2 3.0 7 7 A 38 ASN H A 34 ASP O 1.0 1.6 2.0 8 8 A 34 ASP O A 38 ASN N 1.0 2.2 3.0 9 9 A 39 HIS H A 35 HIS O 1.0 1.6 2.0 10 10 A 35 HIS O A 39 HIS N 1.0 2.2 3.0 11 11 A 29 LEU H A 16 GLN O 1.0 1.6 2.0 12 12 A 16 GLN O A 29 LEU N 1.0 2.2 3.0 13 13 A 27 LEU H A 18 ARG O 1.0 1.6 2.0 14 14 A 18 ARG O A 27 LEU N 1.0 2.2 3.0 15 15 A 18 ARG H A 27 LEU O 1.0 1.6 2.0 16 16 A 27 LEU O A 18 ARG N 1.0 2.2 3.0 17 17 A 20 CYS H A 25 LYS O 1.0 1.6 2.0 18 18 A 25 LYS O A 20 CYS N 1.0 2.2 3.0 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 A 4 ALA C A 5 GLN N A 5 GLN CA A 5 GLN C 1.0 -135.7 -37.9 PHI 2 2 A 5 GLN N A 5 GLN CA A 5 GLN C A 6 LEU N 1.0 107.9 158.1 PSI 3 3 A 5 GLN C A 6 LEU N A 6 LEU CA A 6 LEU C 1.0 -137.7 -35.9 PHI 4 4 A 6 LEU N A 6 LEU CA A 6 LEU C A 7 ILE N 1.0 115.5 155.5 PSI 5 5 A 6 LEU C A 7 ILE N A 7 ILE CA A 7 ILE C 1.0 -141.8 -66.4 PHI 6 6 A 7 ILE N A 7 ILE CA A 7 ILE C A 8 GLU N 1.0 97.1 160.9 PSI 7 7 A 7 ILE C A 8 GLU N A 8 GLU CA A 8 GLU C 1.0 -134.6 -61.0 PHI 8 8 A 8 GLU N A 8 GLU CA A 8 GLU C A 9 ASP N 1.0 113.8 166.4 PSI 9 9 A 8 GLU C A 9 ASP N A 9 ASP CA A 9 ASP C 1.0 -112.7 -47.5 PHI 10 10 A 9 ASP N A 9 ASP CA A 9 ASP C A 10 PRO N 1.0 91.8 174.2 PSI 11 11 A 9 ASP C A 10 PRO N A 10 PRO CA A 10 PRO C 1.0 -81.9 -41.9 PHI 12 12 A 10 PRO N A 10 PRO CA A 10 PRO C A 11 LEU N 1.0 124.6 164.6 PSI 13 13 A 10 PRO C A 11 LEU N A 11 LEU CA A 11 LEU C 1.0 -137.3 -60.5 PHI 14 14 A 11 LEU N A 11 LEU CA A 11 LEU C A 12 ASP N 1.0 90.8 168.2 PSI 15 15 A 12 ASP C A 13 LYS N A 13 LYS CA A 13 LYS C 1.0 -138.0 -39.8 PHI 16 16 A 13 LYS N A 13 LYS CA A 13 LYS C A 14 PRO N 1.0 99.1 181.9 PSI 17 17 A 13 LYS C A 14 PRO N A 14 PRO CA A 14 PRO C 1.0 -89.0 -49.0 PHI 18 18 A 14 PRO N A 14 PRO CA A 14 PRO C A 15 ILE N 1.0 129.6 169.6 PSI 19 19 A 14 PRO C A 15 ILE N A 15 ILE CA A 15 ILE C 1.0 -138.0 -65.0 PHI 20 20 A 15 ILE N A 15 ILE CA A 15 ILE C A 16 GLN N 1.0 95.7 158.1 PSI 21 21 A 15 ILE C A 16 GLN N A 16 GLN CA A 16 GLN C 1.0 -132.6 -46.4 PHI 22 22 A 16 GLN N A 16 GLN CA A 16 GLN C A 17 TYR N 1.0 111.8 164.0 PSI 23 23 A 16 GLN C A 17 TYR N A 17 TYR CA A 17 TYR C 1.0 -151.0 -82.2 PHI 24 24 A 17 TYR N A 17 TYR CA A 17 TYR C A 18 ARG N 1.0 115.6 173.4 PSI 25 25 A 17 TYR C A 18 ARG N A 18 ARG CA A 18 ARG C 1.0 -160.0 -101.8 PHI 26 26 A 18 ARG N A 18 ARG CA A 18 ARG C A 19 VAL N 1.0 110.6 158.8 PSI 27 27 A 18 ARG C A 19 VAL N A 19 VAL CA A 19 VAL C 1.0 -124.2 -62.6 PHI 28 28 A 19 VAL N A 19 VAL CA A 19 VAL C A 20 CYS N 1.0 90.8 154.6 PSI 29 29 A 19 VAL C A 20 CYS N A 20 CYS CA A 20 CYS C 1.0 -99.2 -43.8 PHI 30 30 A 20 CYS N A 20 CYS CA A 20 CYS C A 21 GLU N 1.0 106.3 146.3 PSI 31 31 A 20 CYS C A 21 GLU N A 21 GLU CA A 21 GLU C 1.0 -90.5 -30.5 PHI 32 32 A 21 GLU N A 21 GLU CA A 21 GLU C A 22 LYS N 1.0 -80.0 -20.0 PSI 33 33 A 21 GLU C A 22 LYS N A 22 LYS CA A 22 LYS C 1.0 -132.7 -57.3 PHI 34 34 A 22 LYS N A 22 LYS CA A 22 LYS C A 23 CYS N 1.0 -51.6 -11.6 PSI 35 35 A 24 GLY C A 25 LYS N A 25 LYS CA A 25 LYS C 1.0 -125.2 -50.2 PHI 36 36 A 25 LYS N A 25 LYS CA A 25 LYS C A 26 PRO N 1.0 95.8 171.4 PSI 37 37 A 25 LYS C A 26 PRO N A 26 PRO CA A 26 PRO C 1.0 -92.1 -41.5 PHI 38 38 A 26 PRO N A 26 PRO CA A 26 PRO C A 27 LEU N 1.0 115.2 172.4 PSI 39 39 A 26 PRO C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -149.8 -97.0 PHI 40 40 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 ALA N 1.0 104.4 168.8 PSI 41 41 A 27 LEU C A 28 ALA N A 28 ALA CA A 28 ALA C 1.0 -113.3 -55.9 PHI 42 42 A 28 ALA N A 28 ALA CA A 28 ALA C A 29 LEU N 1.0 124.9 181.5 PSI 43 43 A 28 ALA C A 29 LEU N A 29 LEU CA A 29 LEU C 1.0 -85.3 -38.9 PHI 44 44 A 29 LEU N A 29 LEU CA A 29 LEU C A 30 THR N 1.0 -53.1 -11.1 PSI 45 45 A 29 LEU C A 30 THR N A 30 THR CA A 30 THR C 1.0 -89.3 -49.3 PHI 46 46 A 30 THR N A 30 THR CA A 30 THR C A 31 ALA N 1.0 -37.0 6.2 PSI 47 47 A 30 THR C A 31 ALA N A 31 ALA CA A 31 ALA C 1.0 -136.8 -52.4 PHI 48 48 A 31 ALA N A 31 ALA CA A 31 ALA C A 32 ILE N 1.0 -65.3 5.7 PSI 49 49 A 31 ALA C A 32 ILE N A 32 ILE CA A 32 ILE C 1.0 -82.4 -42.4 PHI 50 50 A 32 ILE N A 32 ILE CA A 32 ILE C A 33 VAL N 1.0 -64.9 -9.5 PSI 51 51 A 32 ILE C A 33 VAL N A 33 VAL CA A 33 VAL C 1.0 -81.3 -41.3 PHI 52 52 A 33 VAL N A 33 VAL CA A 33 VAL C A 34 ASP N 1.0 -62.6 -22.6 PSI 53 53 A 33 VAL C A 34 ASP N A 34 ASP CA A 34 ASP C 1.0 -84.2 -44.2 PHI 54 54 A 34 ASP N A 34 ASP CA A 34 ASP C A 35 HIS N 1.0 -60.5 -20.5 PSI 55 55 A 34 ASP C A 35 HIS N A 35 HIS CA A 35 HIS C 1.0 -82.5 -42.5 PHI 56 56 A 35 HIS N A 35 HIS CA A 35 HIS C A 36 LEU N 1.0 -62.7 -22.7 PSI 57 57 A 35 HIS C A 36 LEU N A 36 LEU CA A 36 LEU C 1.0 -84.0 -44.0 PHI 58 58 A 36 LEU N A 36 LEU CA A 36 LEU C A 37 GLU N 1.0 -62.1 -22.1 PSI 59 59 A 36 LEU C A 37 GLU N A 37 GLU CA A 37 GLU C 1.0 -95.2 -54.8 PHI 60 60 A 37 GLU N A 37 GLU CA A 37 GLU C A 38 ASN N 1.0 -57.8 -17.8 PSI 61 61 A 37 GLU C A 38 ASN N A 38 ASN CA A 38 ASN C 1.0 -121.9 -66.5 PHI 62 62 A 38 ASN N A 38 ASN CA A 38 ASN C A 39 HIS N 1.0 -37.5 4.5 PSI 63 63 A 38 ASN C A 39 HIS N A 39 HIS CA A 39 HIS C 1.0 -183.2 -43.2 PHI 64 64 A 39 HIS N A 39 HIS CA A 39 HIS C A 40 CYS N 1.0 109.2 181.4 PSI 65 65 A 39 HIS C A 40 CYS N A 40 CYS CA A 40 CYS C 1.0 -106.2 -52.8 PHI 66 66 A 40 CYS N A 40 CYS CA A 40 CYS C A 41 ALA N 1.0 111.3 151.7 PSI 67 67 A 40 CYS C A 41 ALA N A 41 ALA CA A 41 ALA C 1.0 -105.0 -34.0 PHI 68 68 A 41 ALA N A 41 ALA CA A 41 ALA C A 42 GLY N 1.0 113.8 156.8 PSI 69 69 A 41 ALA C A 42 GLY N A 42 GLY CA A 42 GLY C 1.0 70.8 110.8 PHI 70 70 A 42 GLY N A 42 GLY CA A 42 GLY C A 43 ALA N 1.0 -32.7 19.7 PSI 71 71 A 42 GLY C A 43 ALA N A 43 ALA CA A 43 ALA C 1.0 -117.6 -40.8 PHI 72 72 A 43 ALA N A 43 ALA CA A 43 ALA C A 44 SER N 1.0 99.5 163.1 PSI stop_ save_