data_nef_c26045_2nd2 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 26046 PDB 2ND2 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 3 CYS SG 1 27 CYS SG 1 19 CYS SG 1 42 CYS SG 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 ALA start . . 2 A 2 PRO middle . false 3 A 3 CYS middle -HG . 4 A 4 GLU middle . . 5 A 5 ASP middle . . 6 A 6 LEU middle . . 7 A 7 LYS middle . . 8 A 8 GLU middle . . 9 A 9 ARG middle . . 10 A 10 LEU middle . . 11 A 11 LYS middle . . 12 A 12 LYS middle . . 13 A 13 LEU middle . . 14 A 14 GLY middle . false 15 A 15 MET middle . . 16 A 16 SER middle . . 17 A 17 GLU middle . . 18 A 18 GLU middle . . 19 A 19 CYS middle -HG . 20 A 20 ARG middle . . 21 A 21 GLN middle . . 22 A 22 ARG middle . . 23 A 23 LEU middle . . 24 A 24 GLU middle . . 25 A 25 LYS middle . . 26 A 26 MET middle . . 27 A 27 CYS middle -HG . 28 A 28 LYS middle . . 29 A 29 GLU middle . . 30 A 30 GLY middle . false 31 A 31 THR middle . . 32 A 32 SER middle . . 33 A 33 GLU middle . . 34 A 34 ASP middle . . 35 A 35 ALA middle . . 36 A 36 GLU middle . . 37 A 37 ARG middle . . 38 A 38 MET middle . . 39 A 39 ALA middle . . 40 A 40 ARG middle . . 41 A 41 ASN middle . . 42 A 42 CYS middle -HG . 43 A 43 GLU middle . . 44 A 44 SER end . . 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 ALA HA H 1 4.406 0.030 A 1 ALA HB% H 1 1.590 0.030 A 1 ALA CA C 13 51.011 0.400 A 1 ALA CB C 13 18.000 0.400 A 2 PRO HA H 1 4.501 0.030 A 2 PRO HBx H 1 1.993 0.030 A 2 PRO HBy H 1 2.411 0.030 A 2 PRO HDx H 1 3.748 0.030 A 2 PRO HDy H 1 3.786 0.030 A 2 PRO HGy H 1 2.142 0.030 A 2 PRO HGx H 1 2.069 0.030 A 2 PRO C C 13 178.016 0.400 A 2 PRO CA C 13 64.811 0.400 A 2 PRO CB C 13 32.260 0.400 A 2 PRO CD C 13 50.708 0.400 A 2 PRO CG C 13 27.742 0.400 A 3 CYS H H 1 9.130 0.030 A 3 CYS HA H 1 4.510 0.030 A 3 CYS HBx H 1 3.188 0.030 A 3 CYS HBy H 1 3.188 0.030 A 3 CYS C C 13 176.295 0.400 A 3 CYS CA C 13 57.465 0.400 A 3 CYS CB C 13 39.971 0.400 A 3 CYS N N 15 117.098 0.400 A 4 GLU H H 1 8.177 0.030 A 4 GLU HA H 1 4.074 0.030 A 4 GLU HBx H 1 2.113 0.030 A 4 GLU HBy H 1 2.113 0.030 A 4 GLU HGx H 1 2.318 0.030 A 4 GLU HGy H 1 2.364 0.030 A 4 GLU C C 13 178.196 0.400 A 4 GLU CA C 13 59.542 0.400 A 4 GLU CG C 13 36.471 0.400 A 4 GLU N N 15 121.091 0.400 A 5 ASP H H 1 8.064 0.030 A 5 ASP HA H 1 4.461 0.030 A 5 ASP HBx H 1 2.715 0.030 A 5 ASP HBy H 1 2.715 0.030 A 5 ASP C C 13 178.273 0.400 A 5 ASP CA C 13 56.425 0.400 A 5 ASP CB C 13 40.172 0.400 A 5 ASP N N 15 119.768 0.400 A 6 LEU H H 1 7.785 0.030 A 6 LEU HA H 1 4.028 0.030 A 6 LEU HB2 H 1 1.730 0.030 A 6 LEU HB3 H 1 1.810 0.030 A 6 LEU HDx% H 1 0.877 0.030 A 6 LEU HDy% H 1 0.911 0.030 A 6 LEU HG H 1 1.561 0.030 A 6 LEU C C 13 177.811 0.400 A 6 LEU CA C 13 57.926 0.400 A 6 LEU CB C 13 41.879 0.400 A 6 LEU CD2 C 13 24.125 0.400 A 6 LEU CG C 13 27.095 0.400 A 6 LEU N N 15 121.053 0.400 A 7 LYS H H 1 7.995 0.030 A 7 LYS HA H 1 3.795 0.030 A 7 LYS HBx H 1 1.915 0.030 A 7 LYS HBy H 1 1.915 0.030 A 7 LYS HDx H 1 1.691 0.030 A 7 LYS HDy H 1 1.691 0.030 A 7 LYS HEx H 1 2.942 0.030 A 7 LYS HEy H 1 2.942 0.030 A 7 LYS HGx H 1 1.362 0.030 A 7 LYS HGy H 1 1.566 0.030 A 7 LYS C C 13 178.710 0.400 A 7 LYS CA C 13 60.304 0.400 A 7 LYS CB C 13 32.284 0.400 A 7 LYS CE C 13 41.846 0.400 A 7 LYS CG C 13 25.231 0.400 A 7 LYS N N 15 117.877 0.400 A 8 GLU H H 1 7.760 0.030 A 8 GLU HA H 1 4.097 0.030 A 8 GLU HBx H 1 2.112 0.030 A 8 GLU HBy H 1 2.112 0.030 A 8 GLU HGx H 1 2.369 0.030 A 8 GLU HGy H 1 2.369 0.030 A 8 GLU C C 13 178.916 0.400 A 8 GLU CA C 13 58.689 0.400 A 8 GLU N N 15 117.399 0.400 A 9 ARG H H 1 7.996 0.030 A 9 ARG HA H 1 4.058 0.030 A 9 ARG HB2 H 1 1.893 0.030 A 9 ARG HB3 H 1 1.956 0.030 A 9 ARG HDx H 1 3.185 0.030 A 9 ARG HDy H 1 3.185 0.030 A 9 ARG HE H 1 7.473 0.030 A 9 ARG HGx H 1 1.600 0.030 A 9 ARG HGy H 1 1.772 0.030 A 9 ARG C C 13 178.967 0.400 A 9 ARG CA C 13 59.329 0.400 A 9 ARG CB C 13 30.356 0.400 A 9 ARG CD C 13 43.645 0.400 A 9 ARG CG C 13 27.783 0.400 A 9 ARG N N 15 120.362 0.400 A 9 ARG NE N 15 84.229 0.400 A 10 LEU H H 1 8.341 0.030 A 10 LEU HA H 1 4.086 0.030 A 10 LEU HB2 H 1 1.862 0.030 A 10 LEU HB3 H 1 1.469 0.030 A 10 LEU HDx% H 1 0.868 0.030 A 10 LEU HDy% H 1 0.837 0.030 A 10 LEU HG H 1 1.962 0.030 A 10 LEU C C 13 177.566 0.400 A 10 LEU CA C 13 57.122 0.400 A 10 LEU CB C 13 41.386 0.400 A 10 LEU CD2 C 13 22.628 0.400 A 10 LEU CG C 13 26.789 0.400 A 10 LEU N N 15 117.258 0.400 A 11 LYS H H 1 7.707 0.030 A 11 LYS HA H 1 4.039 0.030 A 11 LYS HBx H 1 1.895 0.030 A 11 LYS HBy H 1 1.962 0.030 A 11 LYS HDx H 1 1.686 0.030 A 11 LYS HDy H 1 1.686 0.030 A 11 LYS HEx H 1 2.915 0.030 A 11 LYS HEy H 1 2.957 0.030 A 11 LYS HGx H 1 1.395 0.030 A 11 LYS HGy H 1 1.561 0.030 A 11 LYS C C 13 178.736 0.400 A 11 LYS CA C 13 59.135 0.400 A 11 LYS CE C 13 41.975 0.400 A 11 LYS N N 15 119.034 0.400 A 12 LYS H H 1 7.709 0.030 A 12 LYS HA H 1 4.188 0.030 A 12 LYS HBx H 1 1.895 0.030 A 12 LYS HBy H 1 1.965 0.030 A 12 LYS HDx H 1 1.699 0.030 A 12 LYS HDy H 1 1.699 0.030 A 12 LYS HEx H 1 2.998 0.030 A 12 LYS HEy H 1 2.998 0.030 A 12 LYS HGx H 1 1.470 0.030 A 12 LYS HGy H 1 1.573 0.030 A 12 LYS C C 13 178.960 0.400 A 12 LYS CA C 13 57.815 0.400 A 12 LYS CG C 13 25.236 0.400 A 12 LYS N N 15 119.013 0.400 A 13 LEU H H 1 7.705 0.030 A 13 LEU HA H 1 4.310 0.030 A 13 LEU HBx H 1 1.644 0.030 A 13 LEU HBy H 1 1.777 0.030 A 13 LEU HDx% H 1 0.886 0.030 A 13 LEU HDy% H 1 0.896 0.030 A 13 LEU HG H 1 1.787 0.030 A 13 LEU C C 13 177.606 0.400 A 13 LEU CA C 13 55.418 0.400 A 13 LEU CB C 13 42.881 0.400 A 13 LEU CG C 13 26.864 0.400 A 13 LEU N N 15 119.078 0.400 A 14 GLY H H 1 8.107 0.030 A 14 GLY HAx H 1 3.890 0.030 A 14 GLY HAy H 1 3.956 0.030 A 14 GLY C C 13 174.367 0.400 A 14 GLY CA C 13 45.958 0.400 A 14 GLY N N 15 108.342 0.400 A 15 MET H H 1 7.686 0.030 A 15 MET HA H 1 4.512 0.030 A 15 MET HBx H 1 1.949 0.030 A 15 MET HBy H 1 2.005 0.030 A 15 MET HE% H 1 2.029 0.030 A 15 MET HGx H 1 2.555 0.030 A 15 MET HGy H 1 2.590 0.030 A 15 MET C C 13 175.916 0.400 A 15 MET CA C 13 55.467 0.400 A 15 MET CB C 13 34.560 0.400 A 15 MET CE C 13 17.759 0.400 A 15 MET CG C 13 32.078 0.400 A 15 MET N N 15 119.054 0.400 A 16 SER H H 1 8.948 0.030 A 16 SER HA H 1 4.400 0.030 A 16 SER HB2 H 1 4.127 0.030 A 16 SER HB3 H 1 4.366 0.030 A 16 SER C C 13 174.742 0.400 A 16 SER CA C 13 57.747 0.400 A 16 SER CB C 13 64.785 0.400 A 16 SER N N 15 120.057 0.400 A 17 GLU H H 1 9.035 0.030 A 17 GLU HA H 1 3.991 0.030 A 17 GLU HBx H 1 2.009 0.030 A 17 GLU HBy H 1 2.086 0.030 A 17 GLU HGx H 1 2.325 0.030 A 17 GLU HGy H 1 2.325 0.030 A 17 GLU C C 13 178.556 0.400 A 17 GLU CA C 13 59.710 0.400 A 17 GLU CB C 13 29.226 0.400 A 17 GLU CG C 13 35.866 0.400 A 17 GLU N N 15 123.142 0.400 A 18 GLU H H 1 8.790 0.030 A 18 GLU HA H 1 4.029 0.030 A 18 GLU HB2 H 1 1.921 0.030 A 18 GLU HB3 H 1 2.092 0.030 A 18 GLU HGx H 1 2.307 0.030 A 18 GLU HGy H 1 2.307 0.030 A 18 GLU C C 13 179.173 0.400 A 18 GLU CA C 13 59.921 0.400 A 18 GLU CB C 13 28.980 0.400 A 18 GLU N N 15 118.705 0.400 A 19 CYS H H 1 7.875 0.030 A 19 CYS HA H 1 4.291 0.030 A 19 CYS HB2 H 1 3.125 0.030 A 19 CYS HB3 H 1 3.308 0.030 A 19 CYS C C 13 176.295 0.400 A 19 CYS CA C 13 59.285 0.400 A 19 CYS CB C 13 40.375 0.400 A 19 CYS N N 15 118.720 0.400 A 20 ARG H H 1 8.507 0.030 A 20 ARG HA H 1 3.854 0.030 A 20 ARG HBx H 1 1.904 0.030 A 20 ARG HBy H 1 1.904 0.030 A 20 ARG HDx H 1 3.119 0.030 A 20 ARG HDy H 1 3.228 0.030 A 20 ARG HE H 1 7.387 0.030 A 20 ARG HGx H 1 1.541 0.030 A 20 ARG HGy H 1 1.704 0.030 A 20 ARG C C 13 178.633 0.400 A 20 ARG CA C 13 60.628 0.400 A 20 ARG CB C 13 29.851 0.400 A 20 ARG CD C 13 43.365 0.400 A 20 ARG CG C 13 28.359 0.400 A 20 ARG N N 15 120.027 0.400 A 20 ARG NE N 15 83.255 0.400 A 21 GLN H H 1 8.379 0.030 A 21 GLN HA H 1 4.024 0.030 A 21 GLN HB2 H 1 2.170 0.030 A 21 GLN HB3 H 1 2.109 0.030 A 21 GLN HE21 H 1 7.576 0.030 A 21 GLN HE22 H 1 6.810 0.030 A 21 GLN HGx H 1 2.422 0.030 A 21 GLN HGy H 1 2.605 0.030 A 21 GLN C C 13 179.122 0.400 A 21 GLN CA C 13 59.044 0.400 A 21 GLN CB C 13 28.281 0.400 A 21 GLN CG C 13 34.138 0.400 A 21 GLN N N 15 117.558 0.400 A 21 GLN NE2 N 15 111.586 0.400 A 22 ARG H H 1 7.859 0.030 A 22 ARG HA H 1 4.059 0.030 A 22 ARG HB2 H 1 1.957 0.030 A 22 ARG HB3 H 1 2.011 0.030 A 22 ARG HDx H 1 3.187 0.030 A 22 ARG HDy H 1 3.219 0.030 A 22 ARG HE H 1 7.459 0.030 A 22 ARG HGx H 1 1.641 0.030 A 22 ARG HGy H 1 1.878 0.030 A 22 ARG C C 13 178.967 0.400 A 22 ARG CA C 13 59.416 0.400 A 22 ARG CD C 13 43.845 0.400 A 22 ARG CG C 13 27.655 0.400 A 22 ARG N N 15 120.355 0.400 A 22 ARG NE N 15 84.466 0.400 A 23 LEU H H 1 8.332 0.030 A 23 LEU HA H 1 4.048 0.030 A 23 LEU HB2 H 1 1.569 0.030 A 23 LEU HB3 H 1 1.760 0.030 A 23 LEU HDx% H 1 0.844 0.030 A 23 LEU HDy% H 1 0.872 0.030 A 23 LEU HG H 1 1.826 0.030 A 23 LEU C C 13 178.890 0.400 A 23 LEU CA C 13 58.018 0.400 A 23 LEU CB C 13 41.428 0.400 A 23 LEU CD1 C 13 24.467 0.400 A 23 LEU N N 15 120.539 0.400 A 24 GLU H H 1 8.296 0.030 A 24 GLU HA H 1 3.858 0.030 A 24 GLU HBx H 1 2.096 0.030 A 24 GLU HBy H 1 2.096 0.030 A 24 GLU HGx H 1 2.195 0.030 A 24 GLU HGy H 1 2.371 0.030 A 24 GLU C C 13 178.762 0.400 A 24 GLU CA C 13 59.962 0.400 A 24 GLU CG C 13 36.488 0.400 A 24 GLU N N 15 119.377 0.400 A 25 LYS H H 1 7.637 0.030 A 25 LYS HA H 1 4.054 0.030 A 25 LYS HBx H 1 1.896 0.030 A 25 LYS HBy H 1 1.960 0.030 A 25 LYS HDx H 1 1.665 0.030 A 25 LYS HDy H 1 1.665 0.030 A 25 LYS HEx H 1 2.983 0.030 A 25 LYS HEy H 1 2.983 0.030 A 25 LYS HGx H 1 1.369 0.030 A 25 LYS HGy H 1 1.502 0.030 A 25 LYS C C 13 178.402 0.400 A 25 LYS CA C 13 59.370 0.400 A 25 LYS CB C 13 32.595 0.400 A 25 LYS CG C 13 25.017 0.400 A 25 LYS N N 15 118.971 0.400 A 26 MET H H 1 7.953 0.030 A 26 MET HA H 1 4.199 0.030 A 26 MET HBx H 1 2.091 0.030 A 26 MET HBy H 1 2.130 0.030 A 26 MET HE% H 1 2.042 0.030 A 26 MET HGx H 1 2.561 0.030 A 26 MET HGy H 1 2.696 0.030 A 26 MET C C 13 178.222 0.400 A 26 MET CA C 13 58.414 0.400 A 26 MET CB C 13 33.182 0.400 A 26 MET CE C 13 17.308 0.400 A 26 MET CG C 13 32.228 0.400 A 26 MET N N 15 117.688 0.400 A 27 CYS H H 1 8.264 0.030 A 27 CYS HA H 1 4.292 0.030 A 27 CYS HB2 H 1 3.052 0.030 A 27 CYS HB3 H 1 3.287 0.030 A 27 CYS C C 13 176.218 0.400 A 27 CYS CA C 13 59.277 0.400 A 27 CYS CB C 13 40.302 0.400 A 27 CYS N N 15 117.669 0.400 A 28 LYS H H 1 7.983 0.030 A 28 LYS HA H 1 4.184 0.030 A 28 LYS HBx H 1 1.958 0.030 A 28 LYS HBy H 1 1.958 0.030 A 28 LYS HDx H 1 1.692 0.030 A 28 LYS HDy H 1 1.692 0.030 A 28 LYS HEx H 1 2.980 0.030 A 28 LYS HEy H 1 2.980 0.030 A 28 LYS HGx H 1 1.457 0.030 A 28 LYS HGy H 1 1.604 0.030 A 28 LYS C C 13 177.862 0.400 A 28 LYS CA C 13 58.415 0.400 A 28 LYS CB C 13 33.096 0.400 A 28 LYS CG C 13 25.412 0.400 A 28 LYS N N 15 120.893 0.400 A 29 GLU H H 1 8.110 0.030 A 29 GLU HA H 1 4.364 0.030 A 29 GLU HBx H 1 2.016 0.030 A 29 GLU HBy H 1 2.147 0.030 A 29 GLU HGx H 1 2.303 0.030 A 29 GLU HGy H 1 2.413 0.030 A 29 GLU C C 13 176.937 0.400 A 29 GLU CA C 13 56.783 0.400 A 29 GLU CB C 13 30.340 0.400 A 29 GLU CG C 13 36.237 0.400 A 29 GLU N N 15 117.203 0.400 A 30 GLY H H 1 7.990 0.030 A 30 GLY HAx H 1 4.142 0.030 A 30 GLY HAy H 1 4.142 0.030 A 30 GLY C C 13 174.162 0.400 A 30 GLY CA C 13 45.496 0.400 A 30 GLY N N 15 109.260 0.400 A 31 THR H H 1 8.257 0.030 A 31 THR HA H 1 4.594 0.030 A 31 THR HB H 1 4.430 0.030 A 31 THR HG2% H 1 1.247 0.030 A 31 THR C C 13 175.035 0.400 A 31 THR CA C 13 60.974 0.400 A 31 THR CB C 13 70.524 0.400 A 31 THR CG2 C 13 21.630 0.400 A 31 THR N N 15 113.648 0.400 A 32 SER H H 1 8.633 0.030 A 32 SER HA H 1 4.360 0.030 A 32 SER HBx H 1 3.884 0.030 A 32 SER HBy H 1 3.950 0.030 A 32 SER C C 13 175.472 0.400 A 32 SER CA C 13 59.857 0.400 A 32 SER CB C 13 63.485 0.400 A 32 SER N N 15 118.066 0.400 A 33 GLU H H 1 8.532 0.030 A 33 GLU HA H 1 4.209 0.030 A 33 GLU HBx H 1 1.995 0.030 A 33 GLU HBy H 1 1.995 0.030 A 33 GLU HGx H 1 2.309 0.030 A 33 GLU HGy H 1 2.309 0.030 A 33 GLU C C 13 177.528 0.400 A 33 GLU CA C 13 58.406 0.400 A 33 GLU CB C 13 29.788 0.400 A 33 GLU N N 15 122.577 0.400 A 34 ASP H H 1 8.122 0.030 A 34 ASP HA H 1 4.487 0.030 A 34 ASP HBx H 1 2.716 0.030 A 34 ASP HBy H 1 2.716 0.030 A 34 ASP C C 13 177.605 0.400 A 34 ASP CA C 13 55.826 0.400 A 34 ASP CB C 13 40.979 0.400 A 34 ASP N N 15 120.121 0.400 A 35 ALA H H 1 8.107 0.030 A 35 ALA HA H 1 4.009 0.030 A 35 ALA HB% H 1 1.405 0.030 A 35 ALA C C 13 178.890 0.400 A 35 ALA CA C 13 55.190 0.400 A 35 ALA CB C 13 18.819 0.400 A 35 ALA N N 15 123.997 0.400 A 36 GLU H H 1 8.353 0.030 A 36 GLU HA H 1 3.917 0.030 A 36 GLU HBx H 1 2.077 0.030 A 36 GLU HBy H 1 2.077 0.030 A 36 GLU HGx H 1 2.270 0.030 A 36 GLU HGy H 1 2.316 0.030 A 36 GLU C C 13 178.505 0.400 A 36 GLU CA C 13 59.356 0.400 A 36 GLU CG C 13 36.309 0.400 A 36 GLU N N 15 117.393 0.400 A 37 ARG H H 1 7.779 0.030 A 37 ARG HA H 1 4.030 0.030 A 37 ARG HBx H 1 1.892 0.030 A 37 ARG HBy H 1 1.892 0.030 A 37 ARG HDx H 1 3.221 0.030 A 37 ARG HDy H 1 3.221 0.030 A 37 ARG HE H 1 7.372 0.030 A 37 ARG HGx H 1 1.601 0.030 A 37 ARG HGy H 1 1.721 0.030 A 37 ARG C C 13 178.556 0.400 A 37 ARG CA C 13 58.705 0.400 A 37 ARG CB C 13 30.225 0.400 A 37 ARG CG C 13 27.780 0.400 A 37 ARG N N 15 118.853 0.400 A 37 ARG NE N 15 84.344 0.400 A 38 MET H H 1 7.960 0.030 A 38 MET HA H 1 4.231 0.030 A 38 MET HBx H 1 2.093 0.030 A 38 MET HBy H 1 2.093 0.030 A 38 MET HE% H 1 2.043 0.030 A 38 MET HGx H 1 2.524 0.030 A 38 MET HGy H 1 2.634 0.030 A 38 MET C C 13 177.811 0.400 A 38 MET CA C 13 57.445 0.400 A 38 MET CB C 13 32.313 0.400 A 38 MET CE C 13 17.312 0.400 A 38 MET CG C 13 32.338 0.400 A 38 MET N N 15 118.299 0.400 A 39 ALA H H 1 8.125 0.030 A 39 ALA HA H 1 4.063 0.030 A 39 ALA HB% H 1 1.432 0.030 A 39 ALA C C 13 178.813 0.400 A 39 ALA CA C 13 54.480 0.400 A 39 ALA CB C 13 18.610 0.400 A 39 ALA N N 15 121.698 0.400 A 40 ARG H H 1 7.738 0.030 A 40 ARG HA H 1 4.174 0.030 A 40 ARG HBx H 1 1.874 0.030 A 40 ARG HBy H 1 1.874 0.030 A 40 ARG HDx H 1 3.206 0.030 A 40 ARG HDy H 1 3.206 0.030 A 40 ARG HE H 1 7.382 0.030 A 40 ARG HGx H 1 1.679 0.030 A 40 ARG HGy H 1 1.765 0.030 A 40 ARG C C 13 177.220 0.400 A 40 ARG CA C 13 57.811 0.400 A 40 ARG CB C 13 30.121 0.400 A 40 ARG CG C 13 27.415 0.400 A 40 ARG N N 15 116.657 0.400 A 40 ARG NE N 15 84.759 0.400 A 41 ASN H H 1 7.896 0.030 A 41 ASN HA H 1 4.734 0.030 A 41 ASN HBx H 1 2.782 0.030 A 41 ASN HBy H 1 2.908 0.030 A 41 ASN HD21 H 1 7.531 0.030 A 41 ASN HD22 H 1 6.951 0.030 A 41 ASN C C 13 175.369 0.400 A 41 ASN CA C 13 53.837 0.400 A 41 ASN CB C 13 39.136 0.400 A 41 ASN N N 15 116.193 0.400 A 41 ASN ND2 N 15 112.585 0.400 A 42 CYS H H 1 7.997 0.030 A 42 CYS HA H 1 4.563 0.030 A 42 CYS HBx H 1 3.225 0.030 A 42 CYS HBy H 1 3.334 0.030 A 42 CYS C C 13 174.213 0.400 A 42 CYS CA C 13 57.045 0.400 A 42 CYS CB C 13 41.719 0.400 A 42 CYS N N 15 118.352 0.400 A 43 GLU H H 1 8.307 0.030 A 43 GLU HA H 1 4.397 0.030 A 43 GLU HB2 H 1 2.159 0.030 A 43 GLU HB3 H 1 1.997 0.030 A 43 GLU HGx H 1 2.306 0.030 A 43 GLU HGy H 1 2.368 0.030 A 43 GLU C C 13 175.369 0.400 A 43 GLU CA C 13 56.708 0.400 A 43 GLU N N 15 122.347 0.400 A 44 SER H H 1 7.886 0.030 A 44 SER HA H 1 4.274 0.030 A 44 SER HBx H 1 3.863 0.030 A 44 SER HBy H 1 3.863 0.030 A 44 SER CA C 13 60.100 0.400 A 44 SER CB C 13 64.951 0.400 A 44 SER N N 15 121.711 0.400 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _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 3 CYS H A 4 GLU HA 1.0 0.0 5.78 2 2 A 1 ALA HB% A 4 GLU H 1.0 0.0 5.19 3 3 A 4 GLU H A 6 LEU HB2 1.0 0.0 5.78 4 4 A 4 GLU H A 4 GLU HBx 1.0 0.0 3.51 5 4 A 4 GLU H A 4 GLU HBy 1.0 0.0 3.51 6 5 A 4 GLU H A 5 ASP HBx 1.0 0.0 5.78 7 5 A 4 GLU H A 5 ASP HBy 1.0 0.0 5.78 8 6 A 4 GLU H A 5 ASP H 1.0 0.0 3.72 9 7 A 6 LEU HB2 A 5 ASP H 1.0 0.0 5.78 10 8 A 5 ASP H A 6 LEU HB3 1.0 0.0 5.78 11 9 A 5 ASP H A 8 GLU HGx 1.0 0.0 5.78 12 9 A 5 ASP H A 8 GLU HGy 1.0 0.0 5.78 13 10 A 5 ASP H A 3 CYS HBx 1.0 0.0 5.78 14 10 A 5 ASP H A 3 CYS HBy 1.0 0.0 5.78 15 11 A 6 LEU H A 6 LEU HG 1.0 0.0 4.74 16 12 A 6 LEU H A 4 GLU HBx 1.0 0.0 5.39 17 12 A 4 GLU HBy A 6 LEU H 1.0 0.0 5.39 18 13 A 6 LEU H A 8 GLU HBx 1.0 0.0 5.78 19 13 A 6 LEU H A 8 GLU HBy 1.0 0.0 5.78 20 14 A 6 LEU H A 8 GLU HGx 1.0 0.0 5.78 21 14 A 8 GLU HGy A 6 LEU H 1.0 0.0 5.78 22 15 A 6 LEU H A 7 LYS HA 1.0 0.0 5.78 23 16 A 6 LEU H A 7 LYS H 1.0 0.0 3.87 24 17 A 4 GLU H A 6 LEU H 1.0 0.0 5.33 25 18 A 3 CYS H A 5 ASP H 1.0 0.0 5.78 26 19 A 7 LYS H A 6 LEU HDx% 1.0 0.0 5.06 27 20 A 6 LEU HG A 7 LYS H 1.0 0.0 5.39 28 21 A 7 LYS H A 7 LYS HBx 1.0 0.0 3.32 29 21 A 7 LYS H A 7 LYS HBy 1.0 0.0 3.32 30 22 A 7 LYS H A 4 GLU HBx 1.0 0.0 5.78 31 22 A 4 GLU HBy A 7 LYS H 1.0 0.0 5.78 32 23 A 7 LYS H A 8 GLU HBx 1.0 0.0 5.78 33 23 A 8 GLU HBy A 7 LYS H 1.0 0.0 5.78 34 24 A 7 LYS H A 8 GLU HGx 1.0 0.0 5.78 35 24 A 8 GLU HGy A 7 LYS H 1.0 0.0 5.78 36 25 A 7 LYS H A 7 LYS HEx 1.0 0.0 5.78 37 25 A 7 LYS H A 7 LYS HEy 1.0 0.0 5.78 38 26 A 4 GLU HA A 7 LYS H 1.0 0.0 4.88 39 27 A 7 LYS H A 3 CYS HA 1.0 0.0 5.70 40 28 A 8 GLU H A 10 LEU HDx% 1.0 0.0 5.78 41 29 A 8 GLU H A 7 LYS HGx 1.0 0.0 5.32 42 30 A 8 GLU H A 7 LYS HGy 1.0 0.0 5.32 43 31 A 8 GLU H A 7 LYS HDx 1.0 0.0 5.29 44 31 A 8 GLU H A 7 LYS HDy 1.0 0.0 5.29 45 32 A 8 GLU H A 5 ASP HBx 1.0 0.0 5.69 46 32 A 5 ASP HBy A 8 GLU H 1.0 0.0 5.69 47 33 A 8 GLU H A 7 LYS HEx 1.0 0.0 5.78 48 33 A 7 LYS HEy A 8 GLU H 1.0 0.0 5.78 49 34 A 8 GLU H A 5 ASP HA 1.0 0.0 4.84 50 35 A 9 ARG H A 9 ARG HGx 1.0 0.0 4.66 51 36 A 10 LEU HDx% A 9 ARG H 1.0 0.0 5.78 52 37 A 9 ARG H A 9 ARG HB3 1.0 0.0 3.63 53 38 A 9 ARG H A 8 GLU HGx 1.0 0.0 4.96 54 38 A 8 GLU HGy A 9 ARG H 1.0 0.0 4.96 55 39 A 9 ARG H A 9 ARG HDx 1.0 0.0 5.18 56 39 A 9 ARG H A 9 ARG HDy 1.0 0.0 5.18 57 40 A 7 LYS HA A 9 ARG H 1.0 0.0 5.78 58 41 A 10 LEU H A 10 LEU HB2 1.0 0.0 3.51 59 42 A 9 ARG H A 10 LEU H 1.0 0.0 3.84 60 43 A 13 LEU H A 13 LEU HBx 1.0 0.0 3.96 61 44 A 13 LEU H A 13 LEU HBy 1.0 0.0 3.96 62 45 A 14 GLY H A 13 LEU HDx% 1.0 0.0 5.78 63 46 A 14 GLY H A 13 LEU HDy% 1.0 0.0 5.78 64 47 A 14 GLY H A 11 LYS HBy 1.0 0.0 5.78 65 48 A 14 GLY H A 12 LYS HBy 1.0 0.0 5.78 66 49 A 14 GLY H A 11 LYS HBx 1.0 0.0 5.78 67 50 A 14 GLY H A 12 LYS HBx 1.0 0.0 5.78 68 51 A 14 GLY H A 11 LYS HA 1.0 0.0 5.30 69 52 A 14 GLY H A 12 LYS HA 1.0 0.0 5.53 70 53 A 13 LEU H A 14 GLY H 1.0 0.0 3.76 71 54 A 15 MET H A 15 MET HGx 1.0 0.0 4.30 72 55 A 15 MET H A 19 CYS HB2 1.0 0.0 5.78 73 56 A 16 SER H A 15 MET HBy 1.0 0.0 4.36 74 57 A 19 CYS HB2 A 18 GLU H 1.0 0.0 5.78 75 58 A 18 GLU H A 19 CYS HB3 1.0 0.0 5.78 76 59 A 19 CYS H A 23 LEU HDx% 1.0 0.0 5.78 77 60 A 19 CYS H A 20 ARG HGx 1.0 0.0 5.78 78 61 A 19 CYS H A 20 ARG HGy 1.0 0.0 5.78 79 62 A 19 CYS H A 18 GLU HGx 1.0 0.0 4.65 80 62 A 19 CYS H A 18 GLU HGy 1.0 0.0 4.65 81 63 A 19 CYS H A 15 MET HGx 1.0 0.0 5.78 82 64 A 19 CYS H A 15 MET HGy 1.0 0.0 5.78 83 65 A 19 CYS H A 20 ARG HA 1.0 0.0 5.78 84 66 A 19 CYS H A 16 SER HB2 1.0 0.0 5.30 85 67 A 19 CYS H A 16 SER HB3 1.0 0.0 4.87 86 68 A 19 CYS H A 17 GLU H 1.0 0.0 5.67 87 69 A 20 ARG H A 20 ARG HGx 1.0 0.0 4.50 88 70 A 20 ARG H A 17 GLU HGx 1.0 0.0 5.78 89 70 A 20 ARG H A 17 GLU HGy 1.0 0.0 5.78 90 71 A 20 ARG H A 16 SER HA 1.0 0.0 5.78 91 72 A 16 SER HB3 A 20 ARG H 1.0 0.0 5.78 92 73 A 20 ARG H A 20 ARG HE 1.0 0.0 5.78 93 74 A 21 GLN H A 20 ARG HGx 1.0 0.0 5.24 94 75 A 21 GLN H A 20 ARG HGy 1.0 0.0 5.24 95 76 A 21 GLN H A 20 ARG HDx 1.0 0.0 5.78 96 77 A 21 GLN H A 20 ARG HDy 1.0 0.0 5.78 97 78 A 19 CYS HB3 A 21 GLN H 1.0 0.0 5.78 98 79 A 23 LEU HDx% A 22 ARG H 1.0 0.0 5.58 99 80 A 22 ARG H A 18 GLU HGx 1.0 0.0 5.73 100 80 A 18 GLU HGy A 22 ARG H 1.0 0.0 5.73 101 81 A 22 ARG H A 21 GLN HGx 1.0 0.0 5.63 102 82 A 22 ARG H A 21 GLN HGy 1.0 0.0 5.63 103 83 A 22 ARG H A 22 ARG HDx 1.0 0.0 5.55 104 84 A 20 ARG HA A 22 ARG H 1.0 0.0 5.53 105 85 A 22 ARG H A 19 CYS HA 1.0 0.0 4.61 106 86 A 23 LEU H A 23 LEU HG 1.0 0.0 3.90 107 87 A 23 LEU H A 22 ARG HB2 1.0 0.0 4.14 108 88 A 23 LEU H A 22 ARG HB3 1.0 0.0 4.14 109 89 A 23 LEU H A 22 ARG HDx 1.0 0.0 5.78 110 90 A 23 LEU H A 22 ARG HDy 1.0 0.0 5.78 111 91 A 24 GLU H A 20 ARG HBx 1.0 0.0 5.71 112 91 A 20 ARG HBy A 24 GLU H 1.0 0.0 5.71 113 92 A 24 GLU H A 25 LYS HBx 1.0 0.0 5.78 114 93 A 24 GLU H A 10 LEU HG 1.0 0.0 5.78 115 94 A 24 GLU H A 25 LYS HBy 1.0 0.0 5.78 116 95 A 24 GLU H A 24 GLU HBx 1.0 0.0 3.44 117 95 A 24 GLU H A 24 GLU HBy 1.0 0.0 3.44 118 96 A 24 GLU H A 24 GLU HGx 1.0 0.0 4.60 119 97 A 24 GLU H A 24 GLU HGy 1.0 0.0 4.60 120 98 A 22 ARG H A 24 GLU H 1.0 0.0 5.70 121 99 A 24 GLU H A 26 MET H 1.0 0.0 5.71 122 100 A 10 LEU HDx% A 25 LYS H 1.0 0.0 5.78 123 101 A 25 LYS H A 25 LYS HDx 1.0 0.0 5.01 124 101 A 25 LYS H A 25 LYS HDy 1.0 0.0 5.01 125 102 A 25 LYS H A 23 LEU HB3 1.0 0.0 5.34 126 103 A 25 LYS H A 24 GLU HBx 1.0 0.0 3.70 127 103 A 24 GLU HBy A 25 LYS H 1.0 0.0 3.70 128 104 A 25 LYS H A 24 GLU HGy 1.0 0.0 5.55 129 105 A 25 LYS H A 26 MET HGx 1.0 0.0 5.78 130 106 A 25 LYS H A 26 MET HGy 1.0 0.0 5.78 131 107 A 25 LYS H A 25 LYS HEx 1.0 0.0 5.78 132 107 A 25 LYS H A 25 LYS HEy 1.0 0.0 5.78 133 108 A 25 LYS H A 28 LYS HEx 1.0 0.0 5.78 134 108 A 25 LYS H A 28 LYS HEy 1.0 0.0 5.78 135 109 A 25 LYS H A 27 CYS HB2 1.0 0.0 5.78 136 110 A 25 LYS H A 26 MET HA 1.0 0.0 5.50 137 111 A 26 MET H A 25 LYS H 1.0 0.0 3.93 138 112 A 26 MET H A 23 LEU HDy% 1.0 0.0 5.78 139 113 A 26 MET H A 35 ALA HB% 1.0 0.0 5.78 140 114 A 26 MET H A 23 LEU HB2 1.0 0.0 5.60 141 115 A 26 MET H A 25 LYS HDx 1.0 0.0 5.46 142 115 A 26 MET H A 25 LYS HDy 1.0 0.0 5.46 143 116 A 26 MET H A 27 CYS HB2 1.0 0.0 5.78 144 117 A 26 MET H A 27 CYS HB3 1.0 0.0 5.78 145 118 A 26 MET H A 24 GLU HA 1.0 0.0 5.67 146 119 A 26 MET H A 27 CYS H 1.0 0.0 4.07 147 120 A 23 LEU HDy% A 27 CYS H 1.0 0.0 5.78 148 121 A 23 LEU HB2 A 27 CYS H 1.0 0.0 5.78 149 122 A 27 CYS H A 28 LYS HBx 1.0 0.0 5.78 150 122 A 27 CYS H A 28 LYS HBy 1.0 0.0 5.78 151 123 A 27 CYS H A 26 MET HBx 1.0 0.0 4.69 152 124 A 27 CYS H A 26 MET HGx 1.0 0.0 5.78 153 125 A 27 CYS H A 26 MET HGy 1.0 0.0 5.78 154 126 A 28 LYS H A 28 LYS HGx 1.0 0.0 4.86 155 127 A 28 LYS H A 28 LYS HGy 1.0 0.0 4.86 156 128 A 28 LYS H A 29 GLU HGx 1.0 0.0 5.78 157 129 A 28 LYS H A 29 GLU HGy 1.0 0.0 5.78 158 130 A 24 GLU HA A 28 LYS H 1.0 0.0 5.78 159 131 A 27 CYS H A 28 LYS H 1.0 0.0 4.17 160 132 A 29 GLU H A 28 LYS HGx 1.0 0.0 5.78 161 133 A 29 GLU H A 28 LYS HGy 1.0 0.0 5.78 162 134 A 29 GLU H A 28 LYS HDx 1.0 0.0 5.78 163 134 A 29 GLU H A 28 LYS HDy 1.0 0.0 5.78 164 135 A 29 GLU H A 29 GLU HBx 1.0 0.0 4.15 165 136 A 29 GLU H A 29 GLU HGy 1.0 0.0 4.43 166 137 A 29 GLU H A 25 LYS HA 1.0 0.0 5.78 167 138 A 28 LYS H A 29 GLU H 1.0 0.0 3.55 168 139 A 30 GLY H A 29 GLU HBx 1.0 0.0 5.12 169 140 A 30 GLY H A 29 GLU HBy 1.0 0.0 5.12 170 141 A 30 GLY H A 29 GLU HGx 1.0 0.0 5.78 171 142 A 30 GLY H A 29 GLU HGy 1.0 0.0 5.78 172 143 A 29 GLU H A 30 GLY H 1.0 0.0 3.81 173 144 A 30 GLY H A 31 THR H 1.0 0.0 4.79 174 145 A 31 THR H A 26 MET HE% 1.0 0.0 5.63 175 146 A 32 SER H A 33 GLU HBx 1.0 0.0 5.78 176 146 A 32 SER H A 33 GLU HBy 1.0 0.0 5.78 177 147 A 32 SER H A 33 GLU HGx 1.0 0.0 5.78 178 147 A 32 SER H A 33 GLU HGy 1.0 0.0 5.78 179 148 A 32 SER H A 34 ASP H 1.0 0.0 5.78 180 149 A 32 SER H A 35 ALA H 1.0 0.0 5.78 181 150 A 31 THR H A 32 SER H 1.0 0.0 4.98 182 151 A 35 ALA HB% A 33 GLU H 1.0 0.0 5.78 183 152 A 33 GLU H A 34 ASP HBx 1.0 0.0 5.78 184 152 A 33 GLU H A 34 ASP HBy 1.0 0.0 5.78 185 153 A 33 GLU H A 31 THR HA 1.0 0.0 5.53 186 154 A 34 ASP H A 31 THR HG2% 1.0 0.0 5.78 187 155 A 35 ALA HB% A 34 ASP H 1.0 0.0 5.63 188 156 A 34 ASP H A 33 GLU HBx 1.0 0.0 3.82 189 156 A 33 GLU HBy A 34 ASP H 1.0 0.0 3.82 190 157 A 34 ASP H A 33 GLU HGx 1.0 0.0 4.82 191 157 A 33 GLU HGy A 34 ASP H 1.0 0.0 4.82 192 158 A 23 LEU HDy% A 35 ALA H 1.0 0.0 5.78 193 159 A 35 ALA H A 36 GLU HBx 1.0 0.0 5.33 194 159 A 35 ALA H A 36 GLU HBy 1.0 0.0 5.33 195 160 A 35 ALA H A 34 ASP HBx 1.0 0.0 3.94 196 160 A 35 ALA H A 34 ASP HBy 1.0 0.0 3.94 197 161 A 35 ALA H A 33 GLU HA 1.0 0.0 5.78 198 162 A 36 GLU H A 34 ASP HBx 1.0 0.0 5.40 199 162 A 34 ASP HBy A 36 GLU H 1.0 0.0 5.40 200 163 A 10 LEU H A 9 ARG HDx 1.0 0.0 5.78 201 163 A 9 ARG HDy A 10 LEU H 1.0 0.0 5.78 202 164 A 36 GLU H A 32 SER HA 1.0 0.0 5.78 203 165 A 35 ALA H A 36 GLU H 1.0 0.0 3.89 204 166 A 23 LEU HDy% A 37 ARG H 1.0 0.0 5.78 205 167 A 37 ARG H A 37 ARG HGy 1.0 0.0 4.85 206 168 A 37 ARG H A 37 ARG HBx 1.0 0.0 3.28 207 168 A 37 ARG H A 37 ARG HBy 1.0 0.0 3.28 208 169 A 37 ARG H A 34 ASP HBx 1.0 0.0 5.30 209 169 A 34 ASP HBy A 37 ARG H 1.0 0.0 5.30 210 170 A 37 ARG H A 37 ARG HDx 1.0 0.0 5.18 211 170 A 37 ARG H A 37 ARG HDy 1.0 0.0 5.18 212 171 A 33 GLU HA A 37 ARG H 1.0 0.0 5.39 213 172 A 35 ALA HB% A 38 MET H 1.0 0.0 5.45 214 173 A 38 MET H A 39 ALA HB% 1.0 0.0 5.72 215 174 A 38 MET H A 37 ARG HGx 1.0 0.0 5.78 216 175 A 38 MET H A 37 ARG HGy 1.0 0.0 5.78 217 176 A 38 MET H A 38 MET HBx 1.0 0.0 3.31 218 176 A 38 MET H A 38 MET HBy 1.0 0.0 3.31 219 177 A 38 MET H A 38 MET HGx 1.0 0.0 4.36 220 178 A 38 MET H A 37 ARG HDx 1.0 0.0 5.59 221 178 A 37 ARG HDy A 38 MET H 1.0 0.0 5.59 222 179 A 38 MET H A 36 GLU HA 1.0 0.0 5.50 223 180 A 38 MET H A 35 ALA HA 1.0 0.0 4.47 224 181 A 38 MET H A 34 ASP HA 1.0 0.0 5.78 225 182 A 37 ARG H A 38 MET H 1.0 0.0 3.73 226 183 A 39 ALA HB% A 39 ALA H 1.0 0.0 3.26 227 184 A 39 ALA H A 37 ARG HBx 1.0 0.0 5.39 228 184 A 37 ARG HBy A 39 ALA H 1.0 0.0 5.39 229 185 A 39 ALA H A 40 ARG HBx 1.0 0.0 5.78 230 185 A 39 ALA H A 40 ARG HBy 1.0 0.0 5.78 231 186 A 39 ALA H A 38 MET HGx 1.0 0.0 5.67 232 187 A 39 ALA H A 38 MET HGy 1.0 0.0 5.67 233 188 A 39 ALA H A 40 ARG HDx 1.0 0.0 5.78 234 188 A 39 ALA H A 40 ARG HDy 1.0 0.0 5.78 235 189 A 36 GLU HA A 39 ALA H 1.0 0.0 4.83 236 190 A 38 MET H A 39 ALA H 1.0 0.0 3.85 237 191 A 23 LEU HDx% A 40 ARG H 1.0 0.0 5.78 238 192 A 23 LEU HDy% A 40 ARG H 1.0 0.0 5.78 239 193 A 40 ARG H A 40 ARG HBx 1.0 0.0 3.45 240 193 A 40 ARG HBy A 40 ARG H 1.0 0.0 3.45 241 194 A 40 ARG H A 38 MET HBx 1.0 0.0 5.50 242 194 A 38 MET HBy A 40 ARG H 1.0 0.0 5.50 243 195 A 40 ARG H A 40 ARG HDx 1.0 0.0 5.09 244 195 A 40 ARG HDy A 40 ARG H 1.0 0.0 5.09 245 196 A 40 ARG H A 41 ASN H 1.0 0.0 4.05 246 197 A 23 LEU HDx% A 41 ASN H 1.0 0.0 5.78 247 198 A 41 ASN H A 40 ARG HGx 1.0 0.0 5.68 248 199 A 41 ASN H A 40 ARG HGy 1.0 0.0 5.68 249 200 A 41 ASN H A 41 ASN HBx 1.0 0.0 4.28 250 201 A 41 ASN H A 41 ASN HBy 1.0 0.0 4.28 251 202 A 41 ASN H A 40 ARG HDx 1.0 0.0 5.78 252 202 A 40 ARG HDy A 41 ASN H 1.0 0.0 5.78 253 203 A 41 ASN H A 42 CYS HBy 1.0 0.0 5.78 254 204 A 41 ASN H A 37 ARG HA 1.0 0.0 5.71 255 205 A 41 ASN H A 39 ALA HA 1.0 0.0 5.78 256 206 A 23 LEU HDx% A 42 CYS H 1.0 0.0 5.39 257 207 A 39 ALA HB% A 42 CYS H 1.0 0.0 5.55 258 208 A 42 CYS H A 38 MET HBx 1.0 0.0 5.48 259 208 A 38 MET HBy A 42 CYS H 1.0 0.0 5.48 260 209 A 42 CYS H A 41 ASN HBy 1.0 0.0 5.13 261 210 A 39 ALA HA A 42 CYS H 1.0 0.0 4.88 262 211 A 42 CYS H A 40 ARG HA 1.0 0.0 5.61 263 212 A 42 CYS H A 38 MET HA 1.0 0.0 5.78 264 213 A 42 CYS H A 43 GLU H 1.0 0.0 4.18 265 214 A 43 GLU H A 43 GLU HB3 1.0 0.0 3.98 266 215 A 43 GLU H A 43 GLU HGy 1.0 0.0 4.79 267 216 A 43 GLU H A 42 CYS HBx 1.0 0.0 5.05 268 217 A 43 GLU HB3 A 44 SER H 1.0 0.0 4.83 269 218 A 44 SER H A 43 GLU HB2 1.0 0.0 4.78 270 219 A 44 SER H A 43 GLU HGy 1.0 0.0 5.78 271 220 A 44 SER H A 42 CYS HBy 1.0 0.0 5.78 272 221 A 43 GLU H A 44 SER H 1.0 0.0 4.20 273 222 A 8 GLU H A 10 LEU H 1.0 0.0 5.48 274 223 A 12 LYS H A 12 LYS HBx 1.0 0.0 3.70 275 224 A 11 LYS H A 8 GLU HGx 1.0 0.0 5.78 276 224 A 8 GLU HGy A 11 LYS H 1.0 0.0 5.78 277 225 A 21 GLN HE22 A 17 GLU HBx 1.0 0.0 5.78 278 226 A 21 GLN HE22 A 17 GLU HBy 1.0 0.0 5.78 279 227 A 21 GLN HB3 A 21 GLN HE21 1.0 0.0 5.78 280 228 A 21 GLN HE21 A 18 GLU HA 1.0 0.0 5.78 281 229 A 28 LYS H A 26 MET HBx 1.0 0.0 5.78 282 230 A 28 LYS H A 26 MET HBy 1.0 0.0 5.78 283 231 A 27 CYS HB3 A 29 GLU H 1.0 0.0 5.78 284 232 A 30 GLY H A 31 THR HG2% 1.0 0.0 5.78 285 233 A 30 GLY H A 31 THR HA 1.0 0.0 5.78 286 234 A 32 SER H A 30 GLY HAx 1.0 0.0 5.78 287 234 A 32 SER H A 30 GLY HAy 1.0 0.0 5.78 288 235 A 38 MET H A 36 GLU HGx 1.0 0.0 5.78 289 236 A 38 MET H A 36 GLU HGy 1.0 0.0 5.78 290 237 A 41 ASN H A 15 MET HE% 1.0 0.0 5.78 291 238 A 41 ASN H A 38 MET HE% 1.0 0.0 5.78 292 239 A 41 ASN H A 38 MET HBx 1.0 0.0 5.78 293 239 A 38 MET HBy A 41 ASN H 1.0 0.0 5.78 294 240 A 41 ASN HD22 A 37 ARG HBx 1.0 0.0 5.78 295 240 A 37 ARG HBy A 41 ASN HD22 1.0 0.0 5.78 296 241 A 41 ASN HD22 A 40 ARG HBx 1.0 0.0 5.78 297 241 A 40 ARG HBy A 41 ASN HD22 1.0 0.0 5.78 298 242 A 38 MET HE% A 41 ASN HD22 1.0 0.0 5.78 299 243 A 41 ASN HD21 A 37 ARG HBx 1.0 0.0 5.78 300 243 A 37 ARG HBy A 41 ASN HD21 1.0 0.0 5.78 301 244 A 41 ASN HD21 A 40 ARG HBx 1.0 0.0 5.78 302 244 A 40 ARG HBy A 41 ASN HD21 1.0 0.0 5.78 303 245 A 38 MET HE% A 41 ASN HD21 1.0 0.0 5.78 304 246 A 41 ASN HD21 A 37 ARG HDx 1.0 0.0 5.78 305 246 A 37 ARG HDy A 41 ASN HD21 1.0 0.0 5.78 306 247 A 41 ASN HD21 A 40 ARG HDx 1.0 0.0 5.78 307 247 A 40 ARG HDy A 41 ASN HD21 1.0 0.0 5.78 308 248 A 40 ARG HA A 43 GLU H 1.0 0.0 5.78 309 249 A 44 SER H A 42 CYS HBx 1.0 0.0 5.78 310 250 A 9 ARG HB3 A 9 ARG HE 1.0 0.0 5.69 311 251 A 22 ARG HB2 A 22 ARG HE 1.0 0.0 5.78 312 252 A 22 ARG HB3 A 22 ARG HE 1.0 0.0 5.70 313 253 A 22 ARG HE A 18 GLU HGx 1.0 0.0 5.78 314 253 A 18 GLU HGy A 22 ARG HE 1.0 0.0 5.78 315 254 A 20 ARG HE A 20 ARG HBx 1.0 0.0 5.04 316 254 A 20 ARG HE A 20 ARG HBy 1.0 0.0 5.04 317 255 A 20 ARG HE A 18 GLU HA 1.0 0.0 5.78 318 256 A 20 ARG HE A 21 GLN HA 1.0 0.0 5.78 319 257 A 40 ARG HE A 40 ARG HBx 1.0 0.0 5.72 320 257 A 40 ARG HBy A 40 ARG HE 1.0 0.0 5.72 321 258 A 37 ARG HE A 37 ARG HBx 1.0 0.0 5.46 322 258 A 37 ARG HBy A 37 ARG HE 1.0 0.0 5.46 323 259 A 4 GLU H A 7 LYS H 1.0 0.0 5.50 324 260 A 3 CYS H A 6 LEU H 1.0 0.0 5.78 325 261 A 3 CYS H A 7 LYS H 1.0 0.0 5.78 326 262 A 9 ARG H A 9 ARG HE 1.0 0.0 5.78 327 263 A 16 SER H A 23 LEU HDx% 1.0 0.0 5.78 328 264 A 19 CYS HB2 A 17 GLU H 1.0 0.0 5.78 329 265 A 17 GLU H A 17 GLU HBx 1.0 0.0 3.63 330 266 A 17 GLU H A 17 GLU HBy 1.0 0.0 3.63 331 267 A 17 GLU H A 17 GLU HGx 1.0 0.0 3.99 332 267 A 17 GLU H A 17 GLU HGy 1.0 0.0 3.99 333 268 A 18 GLU H A 18 GLU HB2 1.0 0.0 3.68 334 269 A 18 GLU H A 17 GLU HBx 1.0 0.0 3.93 335 270 A 18 GLU H A 17 GLU HBy 1.0 0.0 3.93 336 271 A 18 GLU H A 18 GLU HB3 1.0 0.0 3.87 337 272 A 18 GLU H A 18 GLU HGx 1.0 0.0 4.28 338 272 A 18 GLU H A 18 GLU HGy 1.0 0.0 4.28 339 273 A 24 GLU H A 10 LEU HDy% 1.0 0.0 5.23 340 274 A 23 LEU HDx% A 24 GLU H 1.0 0.0 5.70 341 275 A 10 LEU HDx% A 24 GLU H 1.0 0.0 4.27 342 276 A 6 LEU H A 6 LEU HDx% 1.0 0.0 4.96 343 277 A 6 LEU H A 6 LEU HDy% 1.0 0.0 4.96 344 278 A 7 LYS H A 6 LEU HDy% 1.0 0.0 5.06 345 279 A 7 LYS H A 10 LEU HDx% 1.0 0.0 5.78 346 280 A 9 ARG H A 10 LEU HDy% 1.0 0.0 5.78 347 281 A 31 THR H A 31 THR HG2% 1.0 0.0 3.81 348 282 A 35 ALA HB% A 35 ALA H 1.0 0.0 3.24 349 283 A 35 ALA HB% A 36 GLU H 1.0 0.0 3.48 350 284 A 23 LEU H A 23 LEU HB2 1.0 0.0 3.71 351 285 A 20 ARG H A 20 ARG HGy 1.0 0.0 4.50 352 286 A 20 ARG H A 20 ARG HBx 1.0 0.0 3.20 353 286 A 20 ARG H A 20 ARG HBy 1.0 0.0 3.20 354 287 A 33 GLU H A 33 GLU HBx 1.0 0.0 3.48 355 287 A 33 GLU HBy A 33 GLU H 1.0 0.0 3.48 356 288 A 23 LEU H A 23 LEU HB3 1.0 0.0 3.46 357 289 A 21 GLN H A 21 GLN HB2 1.0 0.0 3.45 358 290 A 36 GLU H A 36 GLU HBx 1.0 0.0 3.15 359 290 A 36 GLU HBy A 36 GLU H 1.0 0.0 3.15 360 291 A 4 GLU H A 4 GLU HGy 1.0 0.0 4.84 361 292 A 10 LEU H A 10 LEU HG 1.0 0.0 3.20 362 293 A 21 GLN H A 20 ARG HBx 1.0 0.0 3.73 363 293 A 21 GLN H A 20 ARG HBy 1.0 0.0 3.73 364 294 A 5 ASP H A 4 GLU HBx 1.0 0.0 3.89 365 294 A 4 GLU HBy A 5 ASP H 1.0 0.0 3.89 366 295 A 9 ARG H A 9 ARG HB2 1.0 0.0 3.66 367 296 A 28 LYS H A 28 LYS HBx 1.0 0.0 3.28 368 296 A 28 LYS HBy A 28 LYS H 1.0 0.0 3.28 369 297 A 42 CYS H A 15 MET HE% 1.0 0.0 5.78 370 298 A 29 GLU H A 28 LYS HBx 1.0 0.0 3.86 371 298 A 28 LYS HBy A 29 GLU H 1.0 0.0 3.86 372 299 A 39 ALA H A 38 MET HBx 1.0 0.0 3.52 373 299 A 38 MET HBy A 39 ALA H 1.0 0.0 3.52 374 300 A 26 MET H A 26 MET HBx 1.0 0.0 3.82 375 301 A 38 MET H A 37 ARG HBx 1.0 0.0 3.41 376 301 A 37 ARG HBy A 38 MET H 1.0 0.0 3.41 377 302 A 27 CYS HB3 A 27 CYS H 1.0 0.0 3.96 378 303 A 27 CYS HB2 A 27 CYS H 1.0 0.0 3.77 379 304 A 34 ASP H A 34 ASP HBx 1.0 0.0 3.30 380 304 A 34 ASP H A 34 ASP HBy 1.0 0.0 3.30 381 305 A 4 GLU H A 3 CYS HBx 1.0 0.0 4.25 382 305 A 4 GLU H A 3 CYS HBy 1.0 0.0 4.25 383 306 A 7 LYS HA A 10 LEU H 1.0 0.0 4.36 384 307 A 20 ARG HA A 23 LEU H 1.0 0.0 4.07 385 308 A 24 GLU H A 21 GLN HA 1.0 0.0 4.41 386 309 A 33 GLU HA A 36 GLU H 1.0 0.0 4.55 387 310 A 36 GLU H A 34 ASP HA 1.0 0.0 5.05 388 311 A 19 CYS HA A 23 LEU H 1.0 0.0 4.64 389 312 A 21 GLN H A 19 CYS HA 1.0 0.0 5.09 390 313 A 21 GLN H A 17 GLU HA 1.0 0.0 5.70 391 314 A 5 ASP HA A 9 ARG H 1.0 0.0 4.69 392 315 A 28 LYS H A 25 LYS HA 1.0 0.0 4.38 393 316 A 27 CYS H A 23 LEU HA 1.0 0.0 4.90 394 317 A 27 CYS H A 25 LYS HA 1.0 0.0 5.19 395 318 A 6 LEU H A 3 CYS HA 1.0 0.0 4.39 396 319 A 37 ARG H A 34 ASP HA 1.0 0.0 4.83 397 320 A 11 LYS H A 8 GLU HA 1.0 0.0 4.07 398 321 A 40 ARG H A 37 ARG HA 1.0 0.0 4.33 399 322 A 3 CYS H A 1 ALA HB% 1.0 0.0 5.12 400 323 A 16 SER H A 15 MET HGx 1.0 0.0 4.90 401 324 A 16 SER H A 15 MET HGy 1.0 0.0 4.90 402 325 A 16 SER H A 15 MET HBx 1.0 0.0 4.36 403 326 A 3 CYS H A 3 CYS HBx 1.0 0.0 3.79 404 326 A 3 CYS H A 3 CYS HBy 1.0 0.0 3.79 405 327 A 16 SER H A 19 CYS HB3 1.0 0.0 4.50 406 328 A 19 CYS HB2 A 16 SER H 1.0 0.0 4.61 407 329 A 19 CYS HB2 A 20 ARG H 1.0 0.0 3.90 408 330 A 19 CYS HB3 A 20 ARG H 1.0 0.0 4.05 409 331 A 16 SER HB2 A 17 GLU H 1.0 0.0 4.25 410 332 A 16 SER HB3 A 17 GLU H 1.0 0.0 3.40 411 333 A 16 SER H A 15 MET HA 1.0 0.0 3.00 412 334 A 16 SER H A 16 SER HB3 1.0 0.0 4.23 413 335 A 16 SER H A 16 SER HB2 1.0 0.0 3.54 414 336 A 18 GLU H A 16 SER HB2 1.0 0.0 4.55 415 337 A 18 GLU H A 16 SER HB3 1.0 0.0 3.91 416 338 A 32 SER H A 31 THR HA 1.0 0.0 3.33 417 339 A 32 SER H A 31 THR HB 1.0 0.0 3.89 418 340 A 32 SER H A 32 SER HBy 1.0 0.0 4.23 419 341 A 32 SER H A 32 SER HBx 1.0 0.0 4.23 420 342 A 33 GLU H A 32 SER HBy 1.0 0.0 4.76 421 343 A 33 GLU H A 31 THR HB 1.0 0.0 4.32 422 344 A 20 ARG H A 17 GLU HA 1.0 0.0 4.15 423 345 A 20 ARG H A 18 GLU HA 1.0 0.0 5.12 424 346 A 23 LEU HDx% A 39 ALA H 1.0 0.0 4.43 425 347 A 23 LEU HDy% A 39 ALA H 1.0 0.0 4.59 426 348 A 23 LEU HDx% A 38 MET H 1.0 0.0 5.28 427 349 A 23 LEU HDy% A 38 MET H 1.0 0.0 4.97 428 350 A 11 LYS H A 10 LEU HDy% 1.0 0.0 4.85 429 351 A 11 LYS H A 10 LEU HB3 1.0 0.0 4.17 430 352 A 12 LYS H A 12 LYS HGx 1.0 0.0 5.06 431 353 A 12 LYS H A 12 LYS HBy 1.0 0.0 3.70 432 354 A 25 LYS H A 25 LYS HBx 1.0 0.0 3.49 433 355 A 25 LYS H A 25 LYS HBy 1.0 0.0 3.49 434 356 A 25 LYS H A 25 LYS HGy 1.0 0.0 4.97 435 357 A 25 LYS H A 25 LYS HGx 1.0 0.0 4.97 436 358 A 39 ALA HB% A 40 ARG H 1.0 0.0 3.64 437 359 A 40 ARG H A 40 ARG HGx 1.0 0.0 4.33 438 360 A 40 ARG H A 40 ARG HGy 1.0 0.0 4.33 439 361 A 6 LEU HB2 A 6 LEU H 1.0 0.0 3.29 440 362 A 6 LEU HB3 A 6 LEU H 1.0 0.0 3.41 441 363 A 8 GLU H A 7 LYS HBx 1.0 0.0 3.57 442 363 A 7 LYS HBy A 8 GLU H 1.0 0.0 3.57 443 364 A 37 ARG H A 37 ARG HGx 1.0 0.0 4.85 444 365 A 35 ALA HB% A 37 ARG H 1.0 0.0 5.35 445 366 A 37 ARG H A 39 ALA HB% 1.0 0.0 5.78 446 367 A 39 ALA HB% A 41 ASN H 1.0 0.0 4.96 447 368 A 41 ASN H A 40 ARG HBx 1.0 0.0 4.18 448 368 A 40 ARG HBy A 41 ASN H 1.0 0.0 4.18 449 369 A 22 ARG H A 22 ARG HB3 1.0 0.0 3.52 450 370 A 22 ARG H A 22 ARG HB2 1.0 0.0 3.59 451 371 A 19 CYS H A 18 GLU HB2 1.0 0.0 4.13 452 372 A 35 ALA HB% A 27 CYS H 1.0 0.0 4.64 453 373 A 6 LEU HB2 A 7 LYS H 1.0 0.0 4.11 454 374 A 9 ARG H A 9 ARG HGy 1.0 0.0 4.66 455 375 A 6 LEU HB3 A 7 LYS H 1.0 0.0 3.75 456 376 A 14 GLY H A 13 LEU HBy 1.0 0.0 4.71 457 377 A 14 GLY H A 13 LEU HBx 1.0 0.0 4.71 458 378 A 24 GLU H A 23 LEU HB2 1.0 0.0 4.13 459 379 A 24 GLU H A 23 LEU HB3 1.0 0.0 4.08 460 380 A 38 MET H A 38 MET HGy 1.0 0.0 4.36 461 381 A 26 MET H A 26 MET HGx 1.0 0.0 4.33 462 382 A 26 MET H A 26 MET HGy 1.0 0.0 4.33 463 383 A 42 CYS H A 42 CYS HBx 1.0 0.0 3.73 464 384 A 42 CYS H A 41 ASN HBx 1.0 0.0 5.13 465 385 A 7 LYS H A 5 ASP HBx 1.0 0.0 5.78 466 385 A 5 ASP HBy A 7 LYS H 1.0 0.0 5.78 467 386 A 9 ARG H A 5 ASP HBx 1.0 0.0 5.78 468 386 A 5 ASP HBy A 9 ARG H 1.0 0.0 5.78 469 387 A 19 CYS HB3 A 19 CYS H 1.0 0.0 3.51 470 388 A 19 CYS HB2 A 19 CYS H 1.0 0.0 3.72 471 389 A 6 LEU H A 3 CYS HBx 1.0 0.0 4.89 472 389 A 3 CYS HBy A 6 LEU H 1.0 0.0 4.89 473 390 A 27 CYS HB3 A 28 LYS H 1.0 0.0 4.18 474 391 A 27 CYS HB2 A 28 LYS H 1.0 0.0 4.54 475 392 A 19 CYS H A 18 GLU HB3 1.0 0.0 4.14 476 393 A 22 ARG H A 21 GLN HB2 1.0 0.0 3.96 477 394 A 44 SER H A 43 GLU HGx 1.0 0.0 5.78 478 395 A 37 ARG H A 36 GLU HBx 1.0 0.0 3.65 479 395 A 36 GLU HBy A 37 ARG H 1.0 0.0 3.65 480 396 A 8 GLU H A 8 GLU HBx 1.0 0.0 3.13 481 396 A 8 GLU HBy A 8 GLU H 1.0 0.0 3.13 482 397 A 15 MET H A 15 MET HGy 1.0 0.0 4.30 483 398 A 21 GLN HE21 A 17 GLU HGx 1.0 0.0 4.56 484 398 A 17 GLU HGy A 21 GLN HE21 1.0 0.0 4.56 485 399 A 38 MET HA A 41 ASN HD22 1.0 0.0 5.31 486 400 A 21 GLN HE22 A 18 GLU HA 1.0 0.0 5.19 487 401 A 22 ARG H A 23 LEU H 1.0 0.0 3.34 488 402 A 10 LEU H A 11 LYS H 1.0 0.0 3.38 489 403 A 18 GLU H A 19 CYS H 1.0 0.0 3.51 490 404 A 19 CYS H A 20 ARG H 1.0 0.0 3.35 491 405 A 21 GLN H A 22 ARG H 1.0 0.0 3.38 492 406 A 36 GLU H A 37 ARG H 1.0 0.0 3.45 493 407 A 15 MET H A 16 SER H 1.0 0.0 4.69 494 408 A 16 SER H A 19 CYS H 1.0 0.0 4.83 495 409 A 3 CYS H A 4 GLU H 1.0 0.0 4.04 496 410 A 34 ASP H A 33 GLU H 1.0 0.0 3.94 497 411 A 31 THR H A 31 THR HB 1.0 0.0 4.32 498 412 A 17 GLU H A 16 SER HA 1.0 0.0 2.76 499 413 A 18 GLU H A 16 SER HA 1.0 0.0 4.61 500 414 A 33 GLU H A 32 SER HBx 1.0 0.0 4.76 501 415 A 24 GLU HA A 27 CYS H 1.0 0.0 4.34 502 416 A 44 SER H A 44 SER HBx 1.0 0.0 4.23 503 416 A 44 SER H A 44 SER HBy 1.0 0.0 4.23 504 417 A 7 LYS HA A 11 LYS H 1.0 0.0 5.74 505 418 A 7 LYS H A 5 ASP HA 1.0 0.0 5.61 506 419 A 14 GLY H A 13 LEU HA 1.0 0.0 3.70 507 420 A 35 ALA H A 32 SER HA 1.0 0.0 4.24 508 421 A 31 THR H A 30 GLY HAx 1.0 0.0 3.32 509 421 A 31 THR H A 30 GLY HAy 1.0 0.0 3.32 510 422 A 26 MET H A 23 LEU HA 1.0 0.0 4.09 511 423 A 38 MET HA A 41 ASN HD21 1.0 0.0 4.85 512 424 A 40 ARG H A 38 MET HA 1.0 0.0 5.02 513 425 A 18 GLU H A 17 GLU H 1.0 0.0 3.42 514 426 A 35 ALA HB% A 32 SER HA 1.0 0.0 3.76 515 427 A 13 LEU HA A 13 LEU HG 1.0 0.0 4.24 516 428 A 5 ASP HA A 8 GLU HGx 1.0 0.0 4.77 517 428 A 8 GLU HGy A 5 ASP HA 1.0 0.0 4.77 518 429 A 20 ARG HA A 10 LEU HDy% 1.0 0.0 4.44 519 430 A 23 LEU HDx% A 20 ARG HA 1.0 0.0 4.68 520 431 A 24 GLU HA A 6 LEU HDx% 1.0 0.0 5.06 521 432 A 7 LYS HA A 10 LEU HDx% 1.0 0.0 3.81 522 433 A 7 LYS HA A 10 LEU HDy% 1.0 0.0 4.42 523 434 A 23 LEU HDy% A 36 GLU HA 1.0 0.0 4.25 524 435 A 23 LEU HDx% A 36 GLU HA 1.0 0.0 5.78 525 436 A 6 LEU HA A 6 LEU HDx% 1.0 0.0 4.25 526 437 A 10 LEU HDy% A 10 LEU HA 1.0 0.0 3.31 527 438 A 23 LEU HDy% A 39 ALA HA 1.0 0.0 4.20 528 439 A 23 LEU HDx% A 23 LEU HA 1.0 0.0 4.18 529 440 A 23 LEU HDy% A 23 LEU HA 1.0 0.0 3.89 530 441 A 13 LEU HA A 13 LEU HDx% 1.0 0.0 4.04 531 442 A 13 LEU HA A 13 LEU HDy% 1.0 0.0 4.04 532 443 A 7 LYS HA A 7 LYS HGx 1.0 0.0 4.15 533 444 A 7 LYS HA A 10 LEU HB3 1.0 0.0 5.44 534 445 A 20 ARG HA A 23 LEU HB2 1.0 0.0 5.05 535 446 A 23 LEU HB2 A 24 GLU HA 1.0 0.0 5.07 536 447 A 20 ARG HA A 23 LEU HB3 1.0 0.0 4.09 537 448 A 24 GLU HA A 24 GLU HGx 1.0 0.0 4.36 538 449 A 24 GLU HA A 24 GLU HGy 1.0 0.0 4.36 539 450 A 7 LYS HA A 10 LEU HB2 1.0 0.0 4.27 540 451 A 1 ALA HB% A 2 PRO HDy 1.0 0.0 3.90 541 452 A 7 LYS HA A 7 LYS HGy 1.0 0.0 4.15 542 453 A 39 ALA HB% A 36 GLU HA 1.0 0.0 3.78 543 454 A 36 GLU HA A 36 GLU HGx 1.0 0.0 4.34 544 455 A 35 ALA HB% A 36 GLU HA 1.0 0.0 5.78 545 456 A 23 LEU HG A 23 LEU HA 1.0 0.0 4.35 546 457 A 17 GLU HA A 20 ARG HBx 1.0 0.0 4.43 547 457 A 20 ARG HBy A 17 GLU HA 1.0 0.0 4.43 548 458 A 39 ALA HA A 15 MET HE% 1.0 0.0 4.07 549 459 A 9 ARG HA A 9 ARG HGy 1.0 0.0 4.22 550 460 A 19 CYS HA A 22 ARG HB2 1.0 0.0 4.05 551 461 A 19 CYS HA A 22 ARG HB3 1.0 0.0 4.33 552 462 A 26 MET HA A 26 MET HGx 1.0 0.0 4.30 553 463 A 19 CYS HA A 18 GLU HGx 1.0 0.0 5.04 554 463 A 18 GLU HGy A 19 CYS HA 1.0 0.0 5.04 555 464 A 30 GLY HAx A 34 ASP HBx 1.0 0.0 5.08 556 464 A 30 GLY HAy A 34 ASP HBx 1.0 0.0 5.08 557 464 A 34 ASP HBy A 30 GLY HAx 1.0 0.0 5.08 558 464 A 34 ASP HBy A 30 GLY HAy 1.0 0.0 5.08 559 465 A 23 LEU HA A 26 MET HGy 1.0 0.0 4.97 560 466 A 21 GLN HA A 21 GLN HGy 1.0 0.0 4.42 561 467 A 18 GLU HA A 18 GLU HGx 1.0 0.0 3.65 562 467 A 18 GLU HGy A 18 GLU HA 1.0 0.0 3.65 563 468 A 4 GLU HA A 4 GLU HGy 1.0 0.0 3.92 564 469 A 8 GLU HA A 8 GLU HGx 1.0 0.0 4.18 565 469 A 8 GLU HGy A 8 GLU HA 1.0 0.0 4.18 566 470 A 10 LEU HG A 10 LEU HA 1.0 0.0 3.71 567 471 A 19 CYS HB3 A 23 LEU HDx% 1.0 0.0 4.69 568 472 A 3 CYS HBy A 6 LEU HDx% 1.0 0.0 5.78 569 472 A 6 LEU HDx% A 3 CYS HBx 1.0 0.0 5.78 570 473 A 10 LEU HDy% A 9 ARG HDx 1.0 0.0 5.24 571 473 A 9 ARG HDy A 10 LEU HDy% 1.0 0.0 5.24 572 474 A 31 THR HG2% A 30 GLY HAx 1.0 0.0 4.53 573 474 A 31 THR HG2% A 30 GLY HAy 1.0 0.0 4.53 574 475 A 12 LYS HA A 12 LYS HGx 1.0 0.0 4.30 575 476 A 12 LYS HA A 12 LYS HGy 1.0 0.0 4.30 576 477 A 12 LYS HA A 12 LYS HDx 1.0 0.0 4.20 577 477 A 12 LYS HA A 12 LYS HDy 1.0 0.0 4.20 578 478 A 19 CYS HA A 22 ARG HDx 1.0 0.0 4.79 579 479 A 19 CYS HA A 22 ARG HDy 1.0 0.0 4.79 580 480 A 40 ARG HA A 40 ARG HDx 1.0 0.0 4.49 581 480 A 40 ARG HDy A 40 ARG HA 1.0 0.0 4.49 582 481 A 9 ARG HA A 9 ARG HDx 1.0 0.0 4.09 583 481 A 9 ARG HDy A 9 ARG HA 1.0 0.0 4.09 584 482 A 27 CYS HB2 A 24 GLU HA 1.0 0.0 4.20 585 483 A 19 CYS HB3 A 20 ARG HA 1.0 0.0 4.57 586 484 A 27 CYS HB3 A 24 GLU HA 1.0 0.0 4.97 587 485 A 20 ARG HA A 20 ARG HDy 1.0 0.0 5.44 588 486 A 24 GLU HA A 3 CYS HBx 1.0 0.0 5.70 589 486 A 3 CYS HBy A 24 GLU HA 1.0 0.0 5.70 590 487 A 38 MET HA A 38 MET HE% 1.0 0.0 4.21 591 488 A 37 ARG HBx A 37 ARG HDx 1.0 0.0 3.54 592 488 A 37 ARG HBy A 37 ARG HDx 1.0 0.0 3.54 593 488 A 37 ARG HDy A 37 ARG HBx 1.0 0.0 3.54 594 488 A 37 ARG HBy A 37 ARG HDy 1.0 0.0 3.54 595 489 A 40 ARG HBx A 40 ARG HDx 1.0 0.0 3.57 596 489 A 40 ARG HBy A 40 ARG HDx 1.0 0.0 3.57 597 489 A 40 ARG HDy A 40 ARG HBx 1.0 0.0 3.57 598 489 A 40 ARG HBy A 40 ARG HDy 1.0 0.0 3.57 599 490 A 22 ARG HB3 A 22 ARG HDy 1.0 0.0 4.25 600 491 A 22 ARG HB3 A 22 ARG HDx 1.0 0.0 4.25 601 492 A 9 ARG HB3 A 9 ARG HDx 1.0 0.0 3.91 602 492 A 9 ARG HB3 A 9 ARG HDy 1.0 0.0 3.91 603 493 A 7 LYS HEy A 7 LYS HGx 1.0 0.0 4.40 604 493 A 7 LYS HGx A 7 LYS HEx 1.0 0.0 4.40 605 494 A 7 LYS HEx A 7 LYS HGy 1.0 0.0 4.40 606 494 A 7 LYS HEy A 7 LYS HGy 1.0 0.0 4.40 607 495 A 7 LYS HBy A 7 LYS HEx 1.0 0.0 4.23 608 495 A 7 LYS HBx A 7 LYS HEx 1.0 0.0 4.23 609 495 A 7 LYS HEy A 7 LYS HBx 1.0 0.0 4.23 610 495 A 7 LYS HBy A 7 LYS HEy 1.0 0.0 4.23 611 496 A 28 LYS HBx A 28 LYS HEx 1.0 0.0 4.76 612 496 A 28 LYS HBy A 28 LYS HEx 1.0 0.0 4.76 613 496 A 28 LYS HEy A 28 LYS HBx 1.0 0.0 4.76 614 496 A 28 LYS HEy A 28 LYS HBy 1.0 0.0 4.76 615 497 A 24 GLU HBy A 28 LYS HEx 1.0 0.0 4.98 616 497 A 24 GLU HBx A 28 LYS HEx 1.0 0.0 4.98 617 497 A 28 LYS HEy A 24 GLU HBx 1.0 0.0 4.98 618 497 A 24 GLU HBy A 28 LYS HEy 1.0 0.0 4.98 619 498 A 23 LEU HDx% A 38 MET HBx 1.0 0.0 3.94 620 498 A 23 LEU HDx% A 38 MET HBy 1.0 0.0 3.94 621 499 A 10 LEU HDx% A 24 GLU HBx 1.0 0.0 4.38 622 499 A 10 LEU HDx% A 24 GLU HBy 1.0 0.0 4.38 623 500 A 23 LEU HDy% A 38 MET HBx 1.0 0.0 4.88 624 500 A 23 LEU HDy% A 38 MET HBy 1.0 0.0 4.88 625 501 A 10 LEU HB2 A 10 LEU HDy% 1.0 0.0 3.93 626 502 A 10 LEU HDx% A 10 LEU HB2 1.0 0.0 3.74 627 503 A 23 LEU HDx% A 39 ALA HB% 1.0 0.0 3.78 628 504 A 23 LEU HDy% A 39 ALA HB% 1.0 0.0 3.76 629 505 A 23 LEU HB2 A 10 LEU HDy% 1.0 0.0 3.75 630 506 A 10 LEU HDx% A 23 LEU HB2 1.0 0.0 4.19 631 507 A 28 LYS HBx A 28 LYS HDx 1.0 0.0 4.14 632 507 A 28 LYS HDy A 28 LYS HBx 1.0 0.0 4.14 633 507 A 28 LYS HBy A 28 LYS HDy 1.0 0.0 4.14 634 507 A 28 LYS HBy A 28 LYS HDx 1.0 0.0 4.14 635 508 A 7 LYS HBy A 7 LYS HDx 1.0 0.0 3.13 636 508 A 7 LYS HBx A 7 LYS HDx 1.0 0.0 3.13 637 508 A 7 LYS HDy A 7 LYS HBx 1.0 0.0 3.13 638 508 A 7 LYS HBy A 7 LYS HDy 1.0 0.0 3.13 639 509 A 19 CYS HB2 A 15 MET HBx 1.0 0.0 5.10 640 510 A 19 CYS HB2 A 15 MET HBy 1.0 0.0 5.10 641 511 A 5 ASP HA A 5 ASP HBx 1.0 0.0 3.14 642 511 A 5 ASP HBy A 5 ASP HA 1.0 0.0 3.14 643 512 A 26 MET HA A 26 MET HGy 1.0 0.0 4.30 644 513 A 21 GLN HA A 21 GLN HGx 1.0 0.0 4.42 645 514 A 23 LEU HA A 26 MET HGx 1.0 0.0 4.97 646 515 A 33 GLU HA A 33 GLU HGx 1.0 0.0 3.39 647 515 A 33 GLU HGy A 33 GLU HA 1.0 0.0 3.39 648 516 A 36 GLU HA A 36 GLU HGy 1.0 0.0 4.34 649 517 A 17 GLU HA A 17 GLU HGx 1.0 0.0 3.98 650 517 A 17 GLU HGy A 17 GLU HA 1.0 0.0 3.98 651 518 A 4 GLU HA A 4 GLU HGx 1.0 0.0 3.92 652 519 A 37 ARG HA A 37 ARG HDx 1.0 0.0 4.42 653 519 A 37 ARG HDy A 37 ARG HA 1.0 0.0 4.42 654 520 A 39 ALA HA A 42 CYS HBx 1.0 0.0 4.80 655 521 A 37 ARG HA A 40 ARG HDx 1.0 0.0 4.45 656 521 A 40 ARG HDy A 37 ARG HA 1.0 0.0 4.45 657 522 A 20 ARG HA A 20 ARG HDx 1.0 0.0 5.44 658 523 A 39 ALA HA A 42 CYS HBy 1.0 0.0 4.80 659 524 A 34 ASP HBx A 37 ARG HBx 1.0 0.0 4.87 660 524 A 34 ASP HBy A 37 ARG HBx 1.0 0.0 4.87 661 524 A 37 ARG HBy A 34 ASP HBx 1.0 0.0 4.87 662 524 A 34 ASP HBy A 37 ARG HBy 1.0 0.0 4.87 663 525 A 31 THR HA A 31 THR HG2% 1.0 0.0 3.60 664 526 A 26 MET HA A 35 ALA HB% 1.0 0.0 5.78 665 527 A 39 ALA HB% A 40 ARG HA 1.0 0.0 5.78 666 528 A 39 ALA HB% A 37 ARG HA 1.0 0.0 5.02 667 529 A 13 LEU HA A 12 LYS HDx 1.0 0.0 4.82 668 529 A 13 LEU HA A 12 LYS HDy 1.0 0.0 4.82 669 530 A 7 LYS HA A 7 LYS HDx 1.0 0.0 4.54 670 530 A 7 LYS HA A 7 LYS HDy 1.0 0.0 4.54 671 531 A 1 ALA HB% A 2 PRO HDx 1.0 0.0 3.90 672 532 A 9 ARG HA A 9 ARG HGx 1.0 0.0 4.22 673 533 A 6 LEU HB3 A 3 CYS HA 1.0 0.0 4.51 674 534 A 6 LEU HB2 A 3 CYS HA 1.0 0.0 4.47 675 535 A 10 LEU H A 10 LEU HB3 1.0 0.0 4.04 676 536 A 7 LYS H A 7 LYS HDx 1.0 0.0 4.92 677 536 A 7 LYS H A 7 LYS HDy 1.0 0.0 4.92 678 537 A 28 LYS H A 28 LYS HDx 1.0 0.0 5.19 679 537 A 28 LYS H A 28 LYS HDy 1.0 0.0 5.19 680 538 A 6 LEU H A 5 ASP HBx 1.0 0.0 3.52 681 538 A 5 ASP HBy A 6 LEU H 1.0 0.0 3.52 682 539 A 5 ASP H A 5 ASP HBx 1.0 0.0 3.45 683 539 A 5 ASP HBy A 5 ASP H 1.0 0.0 3.45 684 540 A 31 THR H A 34 ASP HBx 1.0 0.0 3.52 685 540 A 31 THR H A 34 ASP HBy 1.0 0.0 3.52 686 541 A 42 CYS H A 42 CYS HBy 1.0 0.0 3.73 687 542 A 43 GLU H A 42 CYS HBy 1.0 0.0 5.05 688 543 A 41 ASN H A 42 CYS HBx 1.0 0.0 5.78 689 544 A 8 GLU H A 8 GLU HGx 1.0 0.0 3.46 690 544 A 8 GLU HGy A 8 GLU H 1.0 0.0 3.46 691 545 A 33 GLU H A 33 GLU HGx 1.0 0.0 3.87 692 545 A 33 GLU HGy A 33 GLU H 1.0 0.0 3.87 693 546 A 36 GLU H A 36 GLU HGy 1.0 0.0 4.24 694 547 A 43 GLU H A 43 GLU HGx 1.0 0.0 4.79 695 548 A 4 GLU H A 4 GLU HGx 1.0 0.0 4.84 696 549 A 36 GLU H A 36 GLU HGx 1.0 0.0 4.24 697 550 A 10 LEU H A 9 ARG HB2 1.0 0.0 4.49 698 551 A 21 GLN H A 21 GLN HB3 1.0 0.0 3.79 699 552 A 27 CYS H A 26 MET HBy 1.0 0.0 4.69 700 553 A 13 LEU H A 13 LEU HG 1.0 0.0 4.48 701 554 A 25 LYS H A 24 GLU HGx 1.0 0.0 5.55 702 555 A 9 ARG H A 8 GLU HBx 1.0 0.0 3.74 703 555 A 8 GLU HBy A 9 ARG H 1.0 0.0 3.74 704 556 A 26 MET H A 26 MET HBy 1.0 0.0 3.82 705 557 A 29 GLU H A 29 GLU HBy 1.0 0.0 4.15 706 558 A 35 ALA H A 37 ARG HBx 1.0 0.0 5.78 707 558 A 35 ALA H A 37 ARG HBy 1.0 0.0 5.78 708 559 A 12 LYS H A 12 LYS HGy 1.0 0.0 5.06 709 560 A 11 LYS H A 11 LYS HDx 1.0 0.0 5.10 710 560 A 11 LYS H A 11 LYS HDy 1.0 0.0 5.10 711 561 A 13 LEU H A 12 LYS HDx 1.0 0.0 5.67 712 561 A 13 LEU H A 12 LYS HDy 1.0 0.0 5.67 713 562 A 23 LEU HDx% A 23 LEU H 1.0 0.0 3.66 714 563 A 10 LEU H A 10 LEU HDy% 1.0 0.0 3.75 715 564 A 23 LEU HDy% A 23 LEU HB2 1.0 0.0 3.57 716 565 A 6 LEU HB2 A 6 LEU HDy% 1.0 0.0 3.90 717 566 A 10 LEU HDx% A 10 LEU HB3 1.0 0.0 3.73 718 567 A 15 MET HE% A 10 LEU HDy% 1.0 0.0 3.55 719 568 A 10 LEU HDy% A 10 LEU HB3 1.0 0.0 3.79 720 569 A 6 LEU HB2 A 6 LEU HDx% 1.0 0.0 3.90 721 570 A 23 LEU HDx% A 15 MET HE% 1.0 0.0 3.51 722 571 A 23 LEU HDx% A 23 LEU HB3 1.0 0.0 3.97 723 572 A 23 LEU HDy% A 15 MET HE% 1.0 0.0 4.50 724 573 A 6 LEU HA A 6 LEU HDy% 1.0 0.0 4.25 725 574 A 23 LEU HDx% A 39 ALA HA 1.0 0.0 3.52 726 575 A 3 CYS HA A 6 LEU HDx% 1.0 0.0 5.41 727 576 A 3 CYS HA A 6 LEU HDy% 1.0 0.0 5.41 728 577 A 24 GLU HA A 6 LEU HDy% 1.0 0.0 5.06 729 578 A 10 LEU HDx% A 20 ARG HA 1.0 0.0 3.54 730 579 A 10 LEU HDx% A 10 LEU HA 1.0 0.0 4.60 731 580 A 24 GLU H A 25 LYS H 1.0 0.0 3.55 732 581 A 23 LEU H A 25 LYS H 1.0 0.0 4.62 733 582 A 39 ALA H A 40 ARG H 1.0 0.0 3.50 734 583 A 35 ALA H A 37 ARG H 1.0 0.0 4.82 735 584 A 37 ARG H A 39 ALA H 1.0 0.0 5.23 736 585 A 5 ASP H A 6 LEU H 1.0 0.0 3.46 737 586 A 7 LYS H A 8 GLU H 1.0 0.0 3.30 738 587 A 8 GLU H A 9 ARG H 1.0 0.0 3.50 739 588 A 16 SER HB2 A 15 MET HA 1.0 0.0 5.53 740 589 A 1 ALA HA A 2 PRO HDx 1.0 0.0 3.46 741 590 A 1 ALA HA A 2 PRO HDy 1.0 0.0 3.46 742 591 A 38 MET HE% A 38 MET HGy 1.0 0.0 4.37 743 592 A 38 MET HE% A 38 MET HGx 1.0 0.0 4.37 744 593 A 33 GLU HBx A 34 ASP HBx 1.0 0.0 5.00 745 593 A 33 GLU HBy A 34 ASP HBx 1.0 0.0 5.00 746 593 A 34 ASP HBy A 33 GLU HBx 1.0 0.0 5.00 747 593 A 33 GLU HBy A 34 ASP HBy 1.0 0.0 5.00 748 594 A 18 GLU HA A 21 GLN HB2 1.0 0.0 3.63 749 595 A 5 ASP HA A 4 GLU HBx 1.0 0.0 4.63 750 595 A 4 GLU HBy A 5 ASP HA 1.0 0.0 4.63 751 596 A 5 ASP HA A 8 GLU HBx 1.0 0.0 4.79 752 596 A 8 GLU HBy A 5 ASP HA 1.0 0.0 4.79 753 597 A 34 ASP HA A 37 ARG HBx 1.0 0.0 4.48 754 597 A 37 ARG HBy A 34 ASP HA 1.0 0.0 4.48 755 598 A 3 CYS HBx A 6 LEU HDy% 1.0 0.0 5.78 756 598 A 3 CYS HBy A 6 LEU HDy% 1.0 0.0 5.78 757 599 A 19 CYS HB2 A 23 LEU HDx% 1.0 0.0 5.10 758 600 A 19 CYS HB3 A 15 MET HBy 1.0 0.0 5.06 759 601 A 19 CYS HB3 A 15 MET HE% 1.0 0.0 5.66 760 602 A 19 CYS HB3 A 15 MET HBx 1.0 0.0 5.06 761 603 A 27 CYS HB3 A 6 LEU HDy% 1.0 0.0 5.78 762 604 A 27 CYS HB3 A 6 LEU HDx% 1.0 0.0 5.78 763 605 A 17 GLU HA A 20 ARG HDx 1.0 0.0 5.18 764 606 A 17 GLU HA A 20 ARG HDy 1.0 0.0 5.18 765 607 A 17 GLU HA A 20 ARG HGy 1.0 0.0 4.80 766 608 A 17 GLU HA A 20 ARG HGx 1.0 0.0 4.80 767 609 A 16 SER HA A 17 GLU HA 1.0 0.0 4.84 768 610 A 20 ARG HE A 17 GLU HA 1.0 0.0 5.42 769 611 A 1 ALA HA A 4 GLU HBx 1.0 0.0 5.78 770 611 A 4 GLU HBy A 1 ALA HA 1.0 0.0 5.78 771 612 A 15 MET H A 15 MET HE% 1.0 0.0 4.56 772 613 A 38 MET H A 38 MET HE% 1.0 0.0 3.95 773 614 A 18 GLU H A 17 GLU HGx 1.0 0.0 5.34 774 614 A 18 GLU H A 17 GLU HGy 1.0 0.0 5.34 775 615 A 29 GLU H A 29 GLU HGx 1.0 0.0 4.43 776 616 A 21 GLN HE22 A 17 GLU HGx 1.0 0.0 4.98 777 616 A 17 GLU HGy A 21 GLN HE22 1.0 0.0 4.98 778 617 A 20 ARG H A 15 MET HGy 1.0 0.0 5.78 779 618 A 20 ARG H A 15 MET HGx 1.0 0.0 5.78 780 619 A 20 ARG H A 18 GLU HB3 1.0 0.0 5.74 781 620 A 16 SER H A 20 ARG H 1.0 0.0 5.66 782 621 A 10 LEU HDx% A 20 ARG H 1.0 0.0 5.78 783 622 A 23 LEU HDx% A 20 ARG H 1.0 0.0 5.78 784 623 A 33 GLU H A 31 THR HG2% 1.0 0.0 4.89 785 624 A 32 SER H A 31 THR HG2% 1.0 0.0 4.46 786 625 A 35 ALA HB% A 32 SER H 1.0 0.0 5.32 787 626 A 20 ARG HA A 15 MET HE% 1.0 0.0 4.55 788 627 A 6 LEU HG A 6 LEU HA 1.0 0.0 3.96 789 628 A 19 CYS HB2 A 15 MET HGx 1.0 0.0 5.78 790 629 A 19 CYS HB2 A 15 MET HGy 1.0 0.0 5.78 791 630 A 25 LYS HA A 28 LYS HEx 1.0 0.0 4.60 792 630 A 28 LYS HEy A 25 LYS HA 1.0 0.0 4.60 793 631 A 22 ARG H A 22 ARG HDy 1.0 0.0 5.55 794 632 A 1 ALA HB% A 5 ASP H 1.0 0.0 5.22 795 633 A 35 ALA HB% A 27 CYS HA 1.0 0.0 4.57 796 634 A 1 ALA HA A 2 PRO HGy 1.0 0.0 5.19 797 634 A 1 ALA HA A 2 PRO HGx 1.0 0.0 5.19 798 635 A 1 ALA HA A 2 PRO HDy 1.0 0.0 2.94 799 635 A 1 ALA HA A 2 PRO HDx 1.0 0.0 2.94 800 636 A 1 ALA HB% A 2 PRO HDy 1.0 0.0 3.31 801 636 A 1 ALA HB% A 2 PRO HDx 1.0 0.0 3.31 802 637 A 1 ALA HB% A 4 GLU HGy 1.0 0.0 4.60 803 637 A 1 ALA HB% A 4 GLU HGx 1.0 0.0 4.60 804 638 A 3 CYS H A 2 PRO HBx 1.0 0.0 4.27 805 638 A 3 CYS H A 2 PRO HBy 1.0 0.0 4.27 806 639 A 2 PRO HBy A 3 CYS HBx 1.0 0.0 5.55 807 639 A 2 PRO HBx A 3 CYS HBx 1.0 0.0 5.55 808 639 A 3 CYS HBy A 2 PRO HBx 1.0 0.0 5.55 809 639 A 3 CYS HBy A 2 PRO HBy 1.0 0.0 5.55 810 640 A 3 CYS H A 2 PRO HGy 1.0 0.0 5.06 811 640 A 3 CYS H A 2 PRO HGx 1.0 0.0 5.06 812 641 A 4 GLU H A 2 PRO HGy 1.0 0.0 5.15 813 641 A 4 GLU H A 2 PRO HGx 1.0 0.0 5.15 814 642 A 3 CYS H A 2 PRO HDy 1.0 0.0 5.04 815 642 A 3 CYS H A 2 PRO HDx 1.0 0.0 5.04 816 643 A 3 CYS H A 6 LEU HDy% 1.0 0.0 5.71 817 643 A 3 CYS H A 6 LEU HDx% 1.0 0.0 5.71 818 644 A 3 CYS HA A 6 LEU HDy% 1.0 0.0 4.27 819 644 A 3 CYS HA A 6 LEU HDx% 1.0 0.0 4.27 820 645 A 3 CYS HBx A 6 LEU HDy% 1.0 0.0 4.47 821 645 A 3 CYS HBy A 6 LEU HDy% 1.0 0.0 4.47 822 645 A 6 LEU HDx% A 3 CYS HBx 1.0 0.0 4.47 823 645 A 3 CYS HBy A 6 LEU HDx% 1.0 0.0 4.47 824 646 A 5 ASP H A 4 GLU HGy 1.0 0.0 5.61 825 646 A 5 ASP H A 4 GLU HGx 1.0 0.0 5.61 826 647 A 5 ASP H A 6 LEU HDy% 1.0 0.0 5.71 827 647 A 5 ASP H A 6 LEU HDx% 1.0 0.0 5.71 828 648 A 6 LEU H A 6 LEU HDy% 1.0 0.0 3.91 829 648 A 6 LEU H A 6 LEU HDx% 1.0 0.0 3.91 830 649 A 6 LEU HA A 6 LEU HDy% 1.0 0.0 3.63 831 649 A 6 LEU HA A 6 LEU HDx% 1.0 0.0 3.63 832 650 A 8 GLU H A 6 LEU HDy% 1.0 0.0 5.71 833 650 A 8 GLU H A 6 LEU HDx% 1.0 0.0 5.71 834 651 A 9 ARG H A 6 LEU HDy% 1.0 0.0 5.71 835 651 A 9 ARG H A 6 LEU HDx% 1.0 0.0 5.71 836 652 A 25 LYS H A 6 LEU HDy% 1.0 0.0 5.71 837 652 A 25 LYS H A 6 LEU HDx% 1.0 0.0 5.71 838 653 A 26 MET H A 6 LEU HDy% 1.0 0.0 5.71 839 653 A 26 MET H A 6 LEU HDx% 1.0 0.0 5.71 840 654 A 27 CYS H A 6 LEU HDy% 1.0 0.0 5.71 841 654 A 27 CYS H A 6 LEU HDx% 1.0 0.0 5.71 842 655 A 27 CYS HB2 A 6 LEU HDy% 1.0 0.0 4.46 843 655 A 27 CYS HB2 A 6 LEU HDx% 1.0 0.0 4.46 844 656 A 27 CYS HB3 A 6 LEU HDy% 1.0 0.0 5.05 845 656 A 27 CYS HB3 A 6 LEU HDx% 1.0 0.0 5.05 846 657 A 35 ALA H A 6 LEU HDy% 1.0 0.0 5.71 847 657 A 35 ALA H A 6 LEU HDx% 1.0 0.0 5.71 848 658 A 35 ALA HB% A 6 LEU HDy% 1.0 0.0 4.32 849 658 A 35 ALA HB% A 6 LEU HDx% 1.0 0.0 4.32 850 659 A 36 GLU H A 6 LEU HDy% 1.0 0.0 4.76 851 659 A 36 GLU H A 6 LEU HDx% 1.0 0.0 4.76 852 660 A 36 GLU HA A 6 LEU HDy% 1.0 0.0 4.69 853 660 A 36 GLU HA A 6 LEU HDx% 1.0 0.0 4.69 854 661 A 6 LEU HDx% A 36 GLU HBx 1.0 0.0 4.84 855 661 A 6 LEU HDy% A 36 GLU HBx 1.0 0.0 4.84 856 661 A 36 GLU HBy A 6 LEU HDy% 1.0 0.0 4.84 857 661 A 36 GLU HBy A 6 LEU HDx% 1.0 0.0 4.84 858 662 A 7 LYS H A 7 LYS HGy 1.0 0.0 4.37 859 662 A 7 LYS H A 7 LYS HGx 1.0 0.0 4.37 860 663 A 8 GLU H A 7 LYS HGy 1.0 0.0 4.61 861 663 A 8 GLU H A 7 LYS HGx 1.0 0.0 4.61 862 664 A 8 GLU HA A 11 LYS HBy 1.0 0.0 4.18 863 664 A 8 GLU HA A 11 LYS HBx 1.0 0.0 4.18 864 665 A 8 GLU HA A 11 LYS HGx 1.0 0.0 4.75 865 665 A 8 GLU HA A 11 LYS HGy 1.0 0.0 4.75 866 666 A 9 ARG H A 9 ARG HGy 1.0 0.0 3.83 867 666 A 9 ARG H A 9 ARG HGx 1.0 0.0 3.83 868 667 A 9 ARG HA A 9 ARG HGy 1.0 0.0 3.65 869 667 A 9 ARG HA A 9 ARG HGx 1.0 0.0 3.65 870 668 A 9 ARG HB2 A 9 ARG HGy 1.0 0.0 2.73 871 668 A 9 ARG HB2 A 9 ARG HGx 1.0 0.0 2.73 872 669 A 9 ARG HB2 A 13 LEU HDy% 1.0 0.0 5.71 873 669 A 9 ARG HB2 A 13 LEU HDx% 1.0 0.0 5.71 874 670 A 9 ARG HB3 A 13 LEU HDy% 1.0 0.0 4.46 875 670 A 9 ARG HB3 A 13 LEU HDx% 1.0 0.0 4.46 876 671 A 10 LEU H A 9 ARG HGy 1.0 0.0 5.61 877 671 A 10 LEU H A 9 ARG HGx 1.0 0.0 5.61 878 672 A 9 ARG HDx A 13 LEU HDy% 1.0 0.0 5.13 879 672 A 9 ARG HDy A 13 LEU HDy% 1.0 0.0 5.13 880 672 A 13 LEU HDx% A 9 ARG HDx 1.0 0.0 5.13 881 672 A 9 ARG HDy A 13 LEU HDx% 1.0 0.0 5.13 882 673 A 9 ARG HE A 13 LEU HDy% 1.0 0.0 5.71 883 673 A 9 ARG HE A 13 LEU HDx% 1.0 0.0 5.71 884 674 A 10 LEU H A 11 LYS HGx 1.0 0.0 5.61 885 674 A 10 LEU H A 11 LYS HGy 1.0 0.0 5.61 886 675 A 10 LEU HDx% A 20 ARG HDy 1.0 0.0 5.02 887 675 A 10 LEU HDx% A 20 ARG HDx 1.0 0.0 5.02 888 676 A 11 LYS H A 11 LYS HBy 1.0 0.0 3.35 889 676 A 11 LYS H A 11 LYS HBx 1.0 0.0 3.35 890 677 A 11 LYS H A 11 LYS HGx 1.0 0.0 3.34 891 677 A 11 LYS H A 11 LYS HGy 1.0 0.0 3.34 892 678 A 11 LYS H A 11 LYS HEx 1.0 0.0 5.61 893 678 A 11 LYS H A 11 LYS HEy 1.0 0.0 5.61 894 679 A 11 LYS HBy A 11 LYS HDx 1.0 0.0 3.53 895 679 A 11 LYS HBx A 11 LYS HDx 1.0 0.0 3.53 896 679 A 11 LYS HDy A 11 LYS HBy 1.0 0.0 3.53 897 679 A 11 LYS HDy A 11 LYS HBx 1.0 0.0 3.53 898 680 A 11 LYS HBx A 11 LYS HEx 1.0 0.0 5.31 899 680 A 11 LYS HBy A 11 LYS HEx 1.0 0.0 5.31 900 680 A 11 LYS HEy A 11 LYS HBy 1.0 0.0 5.31 901 680 A 11 LYS HBx A 11 LYS HEy 1.0 0.0 5.31 902 681 A 12 LYS H A 12 LYS HBy 1.0 0.0 3.14 903 681 A 12 LYS H A 12 LYS HBx 1.0 0.0 3.14 904 682 A 12 LYS H A 12 LYS HGy 1.0 0.0 4.29 905 682 A 12 LYS H A 12 LYS HGx 1.0 0.0 4.29 906 683 A 12 LYS HA A 12 LYS HGy 1.0 0.0 3.63 907 683 A 12 LYS HA A 12 LYS HGx 1.0 0.0 3.63 908 684 A 12 LYS HBy A 12 LYS HEx 1.0 0.0 5.61 909 684 A 12 LYS HBx A 12 LYS HEx 1.0 0.0 5.61 910 684 A 12 LYS HEy A 12 LYS HBy 1.0 0.0 5.61 911 684 A 12 LYS HBx A 12 LYS HEy 1.0 0.0 5.61 912 685 A 13 LEU H A 12 LYS HBy 1.0 0.0 3.60 913 685 A 13 LEU H A 12 LYS HBx 1.0 0.0 3.60 914 686 A 13 LEU HA A 12 LYS HBy 1.0 0.0 5.61 915 686 A 13 LEU HA A 12 LYS HBx 1.0 0.0 5.61 916 687 A 12 LYS HBy A 13 LEU HDy% 1.0 0.0 4.50 917 687 A 13 LEU HDx% A 12 LYS HBy 1.0 0.0 4.50 918 687 A 13 LEU HDx% A 12 LYS HBx 1.0 0.0 4.50 919 687 A 12 LYS HBx A 13 LEU HDy% 1.0 0.0 4.50 920 688 A 13 LEU H A 13 LEU HBx 1.0 0.0 3.42 921 688 A 13 LEU H A 13 LEU HBy 1.0 0.0 3.42 922 689 A 13 LEU H A 13 LEU HDy% 1.0 0.0 4.40 923 689 A 13 LEU H A 13 LEU HDx% 1.0 0.0 4.40 924 690 A 13 LEU HA A 13 LEU HDy% 1.0 0.0 3.38 925 690 A 13 LEU HA A 13 LEU HDx% 1.0 0.0 3.38 926 691 A 14 GLY H A 13 LEU HBx 1.0 0.0 4.13 927 691 A 14 GLY H A 13 LEU HBy 1.0 0.0 4.13 928 692 A 14 GLY H A 15 MET HGy 1.0 0.0 5.61 929 692 A 14 GLY H A 15 MET HGx 1.0 0.0 5.61 930 693 A 15 MET H A 15 MET HBy 1.0 0.0 3.77 931 693 A 15 MET H A 15 MET HBx 1.0 0.0 3.77 932 694 A 15 MET H A 15 MET HGy 1.0 0.0 3.77 933 694 A 15 MET H A 15 MET HGx 1.0 0.0 3.77 934 695 A 19 CYS HB2 A 15 MET HBy 1.0 0.0 4.39 935 695 A 19 CYS HB2 A 15 MET HBx 1.0 0.0 4.39 936 696 A 16 SER H A 15 MET HGy 1.0 0.0 4.32 937 696 A 16 SER H A 15 MET HGx 1.0 0.0 4.32 938 697 A 19 CYS HB3 A 15 MET HGy 1.0 0.0 5.49 939 697 A 19 CYS HB3 A 15 MET HGx 1.0 0.0 5.49 940 698 A 16 SER HA A 17 GLU HBy 1.0 0.0 5.61 941 698 A 16 SER HA A 17 GLU HBx 1.0 0.0 5.61 942 699 A 17 GLU H A 17 GLU HBy 1.0 0.0 3.15 943 699 A 17 GLU H A 17 GLU HBx 1.0 0.0 3.15 944 700 A 17 GLU H A 20 ARG HDy 1.0 0.0 5.61 945 700 A 17 GLU H A 20 ARG HDx 1.0 0.0 5.61 946 701 A 17 GLU HA A 20 ARG HDy 1.0 0.0 4.56 947 701 A 17 GLU HA A 20 ARG HDx 1.0 0.0 4.56 948 702 A 18 GLU H A 17 GLU HBy 1.0 0.0 3.41 949 702 A 18 GLU H A 17 GLU HBx 1.0 0.0 3.41 950 703 A 21 GLN HE21 A 17 GLU HBy 1.0 0.0 5.61 951 703 A 21 GLN HE21 A 17 GLU HBx 1.0 0.0 5.61 952 704 A 17 GLU HGx A 20 ARG HGy 1.0 0.0 4.57 953 704 A 17 GLU HGy A 20 ARG HGy 1.0 0.0 4.57 954 704 A 20 ARG HGx A 17 GLU HGx 1.0 0.0 4.57 955 704 A 17 GLU HGy A 20 ARG HGx 1.0 0.0 4.57 956 705 A 19 CYS HA A 22 ARG HGx 1.0 0.0 5.61 957 705 A 19 CYS HA A 22 ARG HGy 1.0 0.0 5.61 958 706 A 20 ARG H A 20 ARG HGy 1.0 0.0 3.63 959 706 A 20 ARG H A 20 ARG HGx 1.0 0.0 3.63 960 707 A 20 ARG H A 20 ARG HDy 1.0 0.0 5.58 961 707 A 20 ARG H A 20 ARG HDx 1.0 0.0 5.58 962 708 A 20 ARG HA A 20 ARG HGy 1.0 0.0 3.69 963 708 A 20 ARG HA A 20 ARG HGx 1.0 0.0 3.69 964 709 A 20 ARG HA A 20 ARG HDy 1.0 0.0 4.60 965 709 A 20 ARG HA A 20 ARG HDx 1.0 0.0 4.60 966 710 A 20 ARG HBx A 20 ARG HDy 1.0 0.0 3.75 967 710 A 20 ARG HBy A 20 ARG HDy 1.0 0.0 3.75 968 710 A 20 ARG HDx A 20 ARG HBx 1.0 0.0 3.75 969 710 A 20 ARG HBy A 20 ARG HDx 1.0 0.0 3.75 970 711 A 22 ARG H A 20 ARG HGy 1.0 0.0 5.61 971 711 A 22 ARG H A 20 ARG HGx 1.0 0.0 5.61 972 712 A 21 GLN HA A 20 ARG HDy 1.0 0.0 5.42 973 712 A 21 GLN HA A 20 ARG HDx 1.0 0.0 5.42 974 713 A 20 ARG HDx A 21 GLN HGy 1.0 0.0 5.15 975 713 A 21 GLN HGx A 20 ARG HDy 1.0 0.0 5.15 976 713 A 20 ARG HDx A 21 GLN HGx 1.0 0.0 5.15 977 713 A 20 ARG HDy A 21 GLN HGy 1.0 0.0 5.15 978 714 A 23 LEU H A 20 ARG HDy 1.0 0.0 5.61 979 714 A 23 LEU H A 20 ARG HDx 1.0 0.0 5.61 980 715 A 21 GLN H A 21 GLN HGy 1.0 0.0 3.68 981 715 A 21 GLN H A 21 GLN HGx 1.0 0.0 3.68 982 716 A 21 GLN HA A 21 GLN HGy 1.0 0.0 3.85 983 716 A 21 GLN HA A 21 GLN HGx 1.0 0.0 3.85 984 717 A 22 ARG H A 21 GLN HGy 1.0 0.0 4.89 985 717 A 22 ARG H A 21 GLN HGx 1.0 0.0 4.89 986 718 A 22 ARG H A 22 ARG HGx 1.0 0.0 3.71 987 718 A 22 ARG H A 22 ARG HGy 1.0 0.0 3.71 988 719 A 22 ARG H A 22 ARG HDy 1.0 0.0 4.87 989 719 A 22 ARG H A 22 ARG HDx 1.0 0.0 4.87 990 720 A 22 ARG HA A 22 ARG HGx 1.0 0.0 3.68 991 720 A 22 ARG HGy A 22 ARG HA 1.0 0.0 3.68 992 721 A 22 ARG HB3 A 22 ARG HDy 1.0 0.0 3.72 993 721 A 22 ARG HB3 A 22 ARG HDx 1.0 0.0 3.72 994 722 A 23 LEU H A 24 GLU HGy 1.0 0.0 5.61 995 722 A 23 LEU H A 24 GLU HGx 1.0 0.0 5.61 996 723 A 23 LEU H A 26 MET HGy 1.0 0.0 5.61 997 723 A 23 LEU H A 26 MET HGx 1.0 0.0 5.61 998 724 A 23 LEU HA A 26 MET HBy 1.0 0.0 3.15 999 724 A 23 LEU HA A 26 MET HBx 1.0 0.0 3.15 1000 725 A 23 LEU HDx% A 42 CYS HBy 1.0 0.0 4.26 1001 725 A 23 LEU HDx% A 42 CYS HBx 1.0 0.0 4.26 1002 726 A 24 GLU H A 24 GLU HGy 1.0 0.0 3.97 1003 726 A 24 GLU H A 24 GLU HGx 1.0 0.0 3.97 1004 727 A 24 GLU HA A 24 GLU HGy 1.0 0.0 3.80 1005 727 A 24 GLU HA A 24 GLU HGx 1.0 0.0 3.80 1006 728 A 25 LYS H A 24 GLU HGy 1.0 0.0 4.65 1007 728 A 25 LYS H A 24 GLU HGx 1.0 0.0 4.65 1008 729 A 24 GLU HGy A 28 LYS HEx 1.0 0.0 4.32 1009 729 A 24 GLU HGx A 28 LYS HEx 1.0 0.0 4.32 1010 729 A 28 LYS HEy A 24 GLU HGy 1.0 0.0 4.32 1011 729 A 28 LYS HEy A 24 GLU HGx 1.0 0.0 4.32 1012 730 A 25 LYS H A 25 LYS HGy 1.0 0.0 4.24 1013 730 A 25 LYS H A 25 LYS HGx 1.0 0.0 4.24 1014 731 A 25 LYS H A 26 MET HGy 1.0 0.0 5.07 1015 731 A 25 LYS H A 26 MET HGx 1.0 0.0 5.07 1016 732 A 25 LYS HA A 25 LYS HGy 1.0 0.0 3.74 1017 732 A 25 LYS HA A 25 LYS HGx 1.0 0.0 3.74 1018 733 A 25 LYS HBx A 25 LYS HEx 1.0 0.0 5.61 1019 733 A 25 LYS HBy A 25 LYS HEx 1.0 0.0 5.61 1020 733 A 25 LYS HEy A 25 LYS HBy 1.0 0.0 5.61 1021 733 A 25 LYS HEy A 25 LYS HBx 1.0 0.0 5.61 1022 734 A 26 MET H A 25 LYS HBy 1.0 0.0 3.80 1023 734 A 26 MET H A 25 LYS HBx 1.0 0.0 3.80 1024 735 A 27 CYS H A 25 LYS HBy 1.0 0.0 5.61 1025 735 A 27 CYS H A 25 LYS HBx 1.0 0.0 5.61 1026 736 A 25 LYS HEy A 25 LYS HGy 1.0 0.0 3.81 1027 736 A 25 LYS HEx A 25 LYS HGy 1.0 0.0 3.81 1028 736 A 25 LYS HGx A 25 LYS HEx 1.0 0.0 3.81 1029 736 A 25 LYS HEy A 25 LYS HGx 1.0 0.0 3.81 1030 737 A 26 MET H A 25 LYS HGy 1.0 0.0 5.60 1031 737 A 26 MET H A 25 LYS HGx 1.0 0.0 5.60 1032 738 A 26 MET H A 26 MET HBy 1.0 0.0 3.07 1033 738 A 26 MET H A 26 MET HBx 1.0 0.0 3.07 1034 739 A 26 MET H A 26 MET HGy 1.0 0.0 3.62 1035 739 A 26 MET H A 26 MET HGx 1.0 0.0 3.62 1036 740 A 26 MET HA A 26 MET HGy 1.0 0.0 3.73 1037 740 A 26 MET HA A 26 MET HGx 1.0 0.0 3.73 1038 741 A 27 CYS H A 26 MET HBy 1.0 0.0 4.07 1039 741 A 27 CYS H A 26 MET HBx 1.0 0.0 4.07 1040 742 A 28 LYS H A 26 MET HBy 1.0 0.0 5.05 1041 742 A 28 LYS H A 26 MET HBx 1.0 0.0 5.05 1042 743 A 31 THR H A 26 MET HBy 1.0 0.0 5.61 1043 743 A 31 THR H A 26 MET HBx 1.0 0.0 5.61 1044 744 A 35 ALA H A 26 MET HBy 1.0 0.0 4.96 1045 744 A 35 ALA H A 26 MET HBx 1.0 0.0 4.96 1046 745 A 35 ALA HB% A 26 MET HBy 1.0 0.0 4.34 1047 745 A 35 ALA HB% A 26 MET HBx 1.0 0.0 4.34 1048 746 A 27 CYS H A 28 LYS HGy 1.0 0.0 5.61 1049 746 A 27 CYS H A 28 LYS HGx 1.0 0.0 5.61 1050 747 A 28 LYS H A 28 LYS HGy 1.0 0.0 4.03 1051 747 A 28 LYS H A 28 LYS HGx 1.0 0.0 4.03 1052 748 A 28 LYS HA A 28 LYS HGy 1.0 0.0 3.91 1053 748 A 28 LYS HGx A 28 LYS HA 1.0 0.0 3.91 1054 749 A 29 GLU H A 29 GLU HBy 1.0 0.0 3.53 1055 749 A 29 GLU H A 29 GLU HBx 1.0 0.0 3.53 1056 750 A 29 GLU H A 29 GLU HGy 1.0 0.0 3.86 1057 750 A 29 GLU H A 29 GLU HGx 1.0 0.0 3.86 1058 751 A 29 GLU HA A 29 GLU HGy 1.0 0.0 3.59 1059 751 A 29 GLU HGx A 29 GLU HA 1.0 0.0 3.59 1060 752 A 30 GLY H A 29 GLU HBy 1.0 0.0 4.44 1061 752 A 30 GLY H A 29 GLU HBx 1.0 0.0 4.44 1062 753 A 32 SER H A 32 SER HBy 1.0 0.0 3.69 1063 753 A 32 SER H A 32 SER HBx 1.0 0.0 3.69 1064 754 A 33 GLU H A 32 SER HBy 1.0 0.0 4.09 1065 754 A 33 GLU H A 32 SER HBx 1.0 0.0 4.09 1066 755 A 34 ASP H A 32 SER HBy 1.0 0.0 5.61 1067 755 A 34 ASP H A 32 SER HBx 1.0 0.0 5.61 1068 756 A 35 ALA HB% A 32 SER HBy 1.0 0.0 5.52 1069 756 A 35 ALA HB% A 32 SER HBx 1.0 0.0 5.52 1070 757 A 35 ALA H A 36 GLU HGy 1.0 0.0 5.61 1071 757 A 35 ALA H A 36 GLU HGx 1.0 0.0 5.61 1072 758 A 36 GLU HA A 36 GLU HGy 1.0 0.0 3.72 1073 758 A 36 GLU HA A 36 GLU HGx 1.0 0.0 3.72 1074 759 A 37 ARG H A 36 GLU HGy 1.0 0.0 5.05 1075 759 A 37 ARG H A 36 GLU HGx 1.0 0.0 5.05 1076 760 A 37 ARG H A 38 MET HGy 1.0 0.0 5.61 1077 760 A 37 ARG H A 38 MET HGx 1.0 0.0 5.61 1078 761 A 37 ARG HA A 37 ARG HGy 1.0 0.0 3.77 1079 761 A 37 ARG HA A 37 ARG HGx 1.0 0.0 3.77 1080 762 A 37 ARG HA A 40 ARG HGy 1.0 0.0 4.41 1081 762 A 37 ARG HA A 40 ARG HGx 1.0 0.0 4.41 1082 763 A 38 MET H A 37 ARG HGy 1.0 0.0 5.07 1083 763 A 38 MET H A 37 ARG HGx 1.0 0.0 5.07 1084 764 A 41 ASN HD21 A 37 ARG HGy 1.0 0.0 5.61 1085 764 A 41 ASN HD21 A 37 ARG HGx 1.0 0.0 5.61 1086 765 A 38 MET H A 40 ARG HGy 1.0 0.0 5.61 1087 765 A 38 MET H A 40 ARG HGx 1.0 0.0 5.61 1088 766 A 38 MET HA A 38 MET HGy 1.0 0.0 3.86 1089 766 A 38 MET HA A 38 MET HGx 1.0 0.0 3.86 1090 767 A 38 MET HA A 41 ASN HBy 1.0 0.0 4.89 1091 767 A 38 MET HA A 41 ASN HBx 1.0 0.0 4.89 1092 768 A 38 MET HBx A 42 CYS HBy 1.0 0.0 5.61 1093 768 A 38 MET HBy A 42 CYS HBy 1.0 0.0 5.61 1094 768 A 42 CYS HBx A 38 MET HBx 1.0 0.0 5.61 1095 768 A 38 MET HBy A 42 CYS HBx 1.0 0.0 5.61 1096 769 A 39 ALA H A 38 MET HGy 1.0 0.0 5.00 1097 769 A 39 ALA H A 38 MET HGx 1.0 0.0 5.00 1098 770 A 39 ALA H A 40 ARG HGy 1.0 0.0 5.61 1099 770 A 39 ALA H A 40 ARG HGx 1.0 0.0 5.61 1100 771 A 39 ALA H A 42 CYS HBy 1.0 0.0 5.61 1101 771 A 39 ALA H A 42 CYS HBx 1.0 0.0 5.61 1102 772 A 39 ALA HA A 42 CYS HBy 1.0 0.0 4.14 1103 772 A 39 ALA HA A 42 CYS HBx 1.0 0.0 4.14 1104 773 A 40 ARG H A 40 ARG HGy 1.0 0.0 3.70 1105 773 A 40 ARG H A 40 ARG HGx 1.0 0.0 3.70 1106 774 A 40 ARG H A 41 ASN HBy 1.0 0.0 5.61 1107 774 A 40 ARG H A 41 ASN HBx 1.0 0.0 5.61 1108 775 A 40 ARG HA A 40 ARG HGy 1.0 0.0 3.83 1109 775 A 40 ARG HA A 40 ARG HGx 1.0 0.0 3.83 1110 776 A 41 ASN H A 41 ASN HBy 1.0 0.0 3.56 1111 776 A 41 ASN H A 41 ASN HBx 1.0 0.0 3.56 1112 777 A 42 CYS H A 41 ASN HBy 1.0 0.0 4.37 1113 777 A 42 CYS H A 41 ASN HBx 1.0 0.0 4.37 1114 778 A 43 GLU H A 42 CYS HBy 1.0 0.0 4.30 1115 778 A 43 GLU H A 42 CYS HBx 1.0 0.0 4.30 1116 779 A 44 SER H A 42 CYS HBy 1.0 0.0 5.07 1117 779 A 44 SER H A 42 CYS HBx 1.0 0.0 5.07 1118 780 A 43 GLU HA A 43 GLU HGy 1.0 0.0 3.79 1119 780 A 43 GLU HA A 43 GLU HGx 1.0 0.0 3.79 1120 781 A 3 CYS SG A 27 CYS SG 1.0 0.0 2.62 1121 782 A 3 CYS SG A 27 CYS CB 1.0 0.0 3.68 1122 783 A 27 CYS SG A 3 CYS CB 1.0 0.0 3.68 1123 784 A 19 CYS SG A 42 CYS SG 1.0 0.0 2.62 1124 785 A 19 CYS SG A 42 CYS CB 1.0 0.0 3.68 1125 786 A 42 CYS SG A 19 CYS CB 1.0 0.0 3.68 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _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 3 CYS C A 4 GLU N A 4 GLU CA A 4 GLU C 1.0 -83.4 -56.0 PHI 2 2 A 4 GLU N A 4 GLU CA A 4 GLU C A 5 ASP N 1.0 -50.0 -30.0 PSI 3 3 A 4 GLU C A 5 ASP N A 5 ASP CA A 5 ASP C 1.0 -77.1 -57.1 PHI 4 4 A 5 ASP N A 5 ASP CA A 5 ASP C A 6 LEU N 1.0 -48.1 -28.1 PSI 5 5 A 5 ASP C A 6 LEU N A 6 LEU CA A 6 LEU C 1.0 -74.8 -54.8 PHI 6 6 A 6 LEU N A 6 LEU CA A 6 LEU C A 7 LYS N 1.0 -52.5 -32.5 PSI 7 7 A 6 LEU C A 7 LYS N A 7 LYS CA A 7 LYS C 1.0 -71.8 -51.8 PHI 8 8 A 7 LYS N A 7 LYS CA A 7 LYS C A 8 GLU N 1.0 -53.2 -33.2 PSI 9 9 A 7 LYS C A 8 GLU N A 8 GLU CA A 8 GLU C 1.0 -77.8 -57.8 PHI 10 10 A 8 GLU N A 8 GLU CA A 8 GLU C A 9 ARG N 1.0 -52.6 -27.0 PSI 11 11 A 8 GLU C A 9 ARG N A 9 ARG CA A 9 ARG C 1.0 -75.9 -55.9 PHI 12 12 A 9 ARG N A 9 ARG CA A 9 ARG C A 10 LEU N 1.0 -52.4 -31.2 PSI 13 13 A 9 ARG C A 10 LEU N A 10 LEU CA A 10 LEU C 1.0 -76.4 -56.4 PHI 14 14 A 10 LEU N A 10 LEU CA A 10 LEU C A 11 LYS N 1.0 -48.0 -24.6 PSI 15 15 A 10 LEU C A 11 LYS N A 11 LYS CA A 11 LYS C 1.0 -77.5 -57.5 PHI 16 16 A 11 LYS N A 11 LYS CA A 11 LYS C A 12 LYS N 1.0 -50.0 -29.6 PSI 17 17 A 11 LYS C A 12 LYS N A 12 LYS CA A 12 LYS C 1.0 -76.8 -56.8 PHI 18 18 A 12 LYS N A 12 LYS CA A 12 LYS C A 13 LEU N 1.0 -40.7 -16.7 PSI 19 19 A 12 LYS C A 13 LEU N A 13 LEU CA A 13 LEU C 1.0 -99.6 -74.0 PHI 20 20 A 13 LEU N A 13 LEU CA A 13 LEU C A 14 GLY N 1.0 -21.2 10.8 PSI 21 21 A 17 GLU C A 18 GLU N A 18 GLU CA A 18 GLU C 1.0 -74.0 -50.4 PHI 22 22 A 18 GLU N A 18 GLU CA A 18 GLU C A 19 CYS N 1.0 -52.4 -31.8 PSI 23 23 A 18 GLU C A 19 CYS N A 19 CYS CA A 19 CYS C 1.0 -77.9 -57.9 PHI 24 24 A 19 CYS N A 19 CYS CA A 19 CYS C A 20 ARG N 1.0 -50.5 -30.5 PSI 25 25 A 19 CYS C A 20 ARG N A 20 ARG CA A 20 ARG C 1.0 -71.0 -51.0 PHI 26 26 A 20 ARG N A 20 ARG CA A 20 ARG C A 21 GLN N 1.0 -53.7 -33.7 PSI 27 27 A 20 ARG C A 21 GLN N A 21 GLN CA A 21 GLN C 1.0 -76.1 -56.1 PHI 28 28 A 21 GLN N A 21 GLN CA A 21 GLN C A 22 ARG N 1.0 -49.1 -28.9 PSI 29 29 A 21 GLN C A 22 ARG N A 22 ARG CA A 22 ARG C 1.0 -75.7 -55.7 PHI 30 30 A 22 ARG N A 22 ARG CA A 22 ARG C A 23 LEU N 1.0 -52.0 -32.0 PSI 31 31 A 22 ARG C A 23 LEU N A 23 LEU CA A 23 LEU C 1.0 -74.8 -54.8 PHI 32 32 A 23 LEU N A 23 LEU CA A 23 LEU C A 24 GLU N 1.0 -51.1 -31.1 PSI 33 33 A 23 LEU C A 24 GLU N A 24 GLU CA A 24 GLU C 1.0 -73.1 -53.1 PHI 34 34 A 24 GLU N A 24 GLU CA A 24 GLU C A 25 LYS N 1.0 -52.0 -32.0 PSI 35 35 A 24 GLU C A 25 LYS N A 25 LYS CA A 25 LYS C 1.0 -75.4 -55.4 PHI 36 36 A 25 LYS N A 25 LYS CA A 25 LYS C A 26 MET N 1.0 -51.8 -31.8 PSI 37 37 A 25 LYS C A 26 MET N A 26 MET CA A 26 MET C 1.0 -75.8 -55.8 PHI 38 38 A 26 MET N A 26 MET CA A 26 MET C A 27 CYS N 1.0 -52.0 -32.0 PSI 39 39 A 26 MET C A 27 CYS N A 27 CYS CA A 27 CYS C 1.0 -74.0 -54.0 PHI 40 40 A 27 CYS N A 27 CYS CA A 27 CYS C A 28 LYS N 1.0 -49.3 -26.7 PSI 41 41 A 32 SER C A 33 GLU N A 33 GLU CA A 33 GLU C 1.0 -73.6 -53.4 PHI 42 42 A 33 GLU N A 33 GLU CA A 33 GLU C A 34 ASP N 1.0 -49.0 -23.0 PSI 43 43 A 33 GLU C A 34 ASP N A 34 ASP CA A 34 ASP C 1.0 -79.6 -56.6 PHI 44 44 A 34 ASP N A 34 ASP CA A 34 ASP C A 35 ALA N 1.0 -52.3 -26.1 PSI 45 45 A 34 ASP C A 35 ALA N A 35 ALA CA A 35 ALA C 1.0 -75.7 -55.7 PHI 46 46 A 35 ALA N A 35 ALA CA A 35 ALA C A 36 GLU N 1.0 -50.1 -29.1 PSI 47 47 A 35 ALA C A 36 GLU N A 36 GLU CA A 36 GLU C 1.0 -74.6 -54.6 PHI 48 48 A 36 GLU N A 36 GLU CA A 36 GLU C A 37 ARG N 1.0 -52.2 -32.2 PSI 49 49 A 36 GLU C A 37 ARG N A 37 ARG CA A 37 ARG C 1.0 -76.3 -56.3 PHI 50 50 A 37 ARG N A 37 ARG CA A 37 ARG C A 38 MET N 1.0 -52.6 -25.8 PSI 51 51 A 37 ARG C A 38 MET N A 38 MET CA A 38 MET C 1.0 -78.5 -58.5 PHI 52 52 A 38 MET N A 38 MET CA A 38 MET C A 39 ALA N 1.0 -49.3 -24.1 PSI 53 53 A 38 MET C A 39 ALA N A 39 ALA CA A 39 ALA C 1.0 -75.7 -55.7 PHI 54 54 A 39 ALA N A 39 ALA CA A 39 ALA C A 40 ARG N 1.0 -46.0 -26.0 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.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.folding 3 Hz 15H,N,H 7500 . stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.num_dimensions 2 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.folding 2 Hz 15H,H 7500 . stop_ save_