data_nef_c18194_2lt1 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 18121 BMRB 18151 BMRB 18193 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly 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 GLY middle . false 3 A 3 HIS middle . . 4 A 4 MET middle . . 5 A 5 PRO middle . false 6 A 6 GLU middle . . 7 A 7 GLY middle . false 8 A 8 SER middle . . 9 A 9 ALA middle . . 10 A 10 SER middle . . 11 A 11 LEU middle . . 12 A 12 GLN middle . . 13 A 13 LEU middle . . 14 A 14 ALA middle . . 15 A 15 VAL middle . . 16 A 16 GLY middle . false 17 A 17 ASP middle . . 18 A 18 ARG middle . . 19 A 19 VAL middle . . 20 A 20 VAL middle . . 21 A 21 TYR middle . . 22 A 22 PRO middle . false 23 A 23 ASN middle . . 24 A 24 GLN middle . . 25 A 25 GLY middle . false 26 A 26 VAL middle . . 27 A 27 CYS middle . . 28 A 28 ARG middle . . 29 A 29 VAL middle . . 30 A 30 SER middle . . 31 A 31 ALA middle . . 32 A 32 ILE middle . . 33 A 33 ASP middle . . 34 A 34 VAL middle . . 35 A 35 LYS middle . . 36 A 36 GLU middle . . 37 A 37 VAL middle . . 38 A 38 ALA middle . . 39 A 39 GLY middle . false 40 A 40 GLN middle . . 41 A 41 LYS middle . . 42 A 42 LEU middle . . 43 A 43 THR middle . . 44 A 44 PHE middle . . 45 A 45 VAL middle . . 46 A 46 THR middle . . 47 A 47 MET middle . . 48 A 48 ARG middle . . 49 A 49 ARG middle . . 50 A 50 GLU middle . . 51 A 51 GLU middle . . 52 A 52 ASP middle . . 53 A 53 GLY middle . false 54 A 54 ALA middle . . 55 A 55 VAL middle . . 56 A 56 VAL middle . . 57 A 57 MET middle . . 58 A 58 VAL middle . . 59 A 59 PRO middle . false 60 A 60 GLU middle . . 61 A 61 GLY middle . false 62 A 62 LYS middle . . 63 A 63 VAL middle . . 64 A 64 LEU middle . . 65 A 65 ALA middle . . 66 A 66 ILE middle . . 67 A 67 GLY middle . false 68 A 68 VAL middle . . 69 A 69 ARG middle . . 70 A 70 LYS middle . . 71 A 71 VAL middle . . 72 A 72 ALA middle . . 73 A 73 SER middle . . 74 A 74 ALA middle . . 75 A 75 GLU 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 4.104 0.01 A 1 ALA HB% H 1 1.522 0.01 A 1 ALA CA C 13 51.831 0.1 A 1 ALA CB C 13 19.348 0.1 A 3 HIS HA H 1 4.642 0.01 A 3 HIS HBx H 1 3.078 0.01 A 3 HIS HBy H 1 3.105 0.01 A 3 HIS C C 13 175.186 0.1 A 3 HIS CA C 13 56.191 0.1 A 3 HIS CB C 13 30.716 0.1 A 4 MET H H 1 8.306 0.01 A 4 MET HA H 1 4.801 0.01 A 4 MET HBx H 1 1.920 0.01 A 4 MET HBy H 1 2.035 0.01 A 4 MET HGx H 1 2.477 0.01 A 4 MET HGy H 1 2.570 0.01 A 4 MET CA C 13 53.055 0.1 A 4 MET CB C 13 32.335 0.1 A 4 MET CG C 13 33.471 0.1 A 4 MET N N 15 123.356 0.1 A 5 PRO HA H 1 4.403 0.01 A 5 PRO HBx H 1 1.916 0.01 A 5 PRO HBy H 1 2.310 0.01 A 5 PRO HDx H 1 3.664 0.01 A 5 PRO HDy H 1 3.777 0.01 A 5 PRO HGx H 1 2.003 0.01 A 5 PRO HGy H 1 2.026 0.01 A 5 PRO C C 13 177.015 0.1 A 5 PRO CA C 13 63.292 0.1 A 5 PRO CB C 13 32.121 0.1 A 5 PRO CD C 13 50.781 0.1 A 5 PRO CG C 13 27.405 0.1 A 6 GLU H H 1 8.651 0.01 A 6 GLU HA H 1 4.257 0.01 A 6 GLU HBx H 1 1.979 0.01 A 6 GLU HBy H 1 2.069 0.01 A 6 GLU HGx H 1 2.301 0.01 A 6 GLU HGy H 1 2.301 0.01 A 6 GLU C C 13 177.219 0.1 A 6 GLU CA C 13 56.897 0.1 A 6 GLU CB C 13 30.184 0.1 A 6 GLU CG C 13 36.284 0.1 A 6 GLU N N 15 121.815 0.1 A 7 GLY H H 1 8.495 0.01 A 7 GLY HAx H 1 4.015 0.01 A 7 GLY HAy H 1 4.015 0.01 A 7 GLY C C 13 174.391 0.1 A 7 GLY CA C 13 45.378 0.1 A 7 GLY N N 15 110.336 0.1 A 8 SER H H 1 8.196 0.01 A 8 SER HA H 1 4.468 0.01 A 8 SER HBx H 1 3.884 0.01 A 8 SER HBy H 1 3.884 0.01 A 8 SER C C 13 174.465 0.1 A 8 SER CA C 13 58.509 0.1 A 8 SER CB C 13 64.013 0.1 A 8 SER N N 15 115.582 0.1 A 9 ALA H H 1 8.379 0.01 A 9 ALA HA H 1 4.387 0.01 A 9 ALA HB% H 1 1.418 0.01 A 9 ALA C C 13 177.602 0.1 A 9 ALA CA C 13 52.708 0.1 A 9 ALA CB C 13 19.336 0.1 A 9 ALA N N 15 125.946 0.1 A 10 SER H H 1 8.177 0.01 A 10 SER HA H 1 4.432 0.01 A 10 SER HBx H 1 3.854 0.01 A 10 SER HBy H 1 3.854 0.01 A 10 SER C C 13 174.194 0.1 A 10 SER CA C 13 58.275 0.1 A 10 SER CB C 13 64.002 0.1 A 10 SER N N 15 114.455 0.1 A 11 LEU H H 1 8.224 0.01 A 11 LEU HA H 1 4.309 0.01 A 11 LEU HBx H 1 1.577 0.01 A 11 LEU HBy H 1 1.624 0.01 A 11 LEU HDx% H 1 0.837 0.01 A 11 LEU HDy% H 1 0.891 0.01 A 11 LEU HG H 1 1.536 0.01 A 11 LEU C C 13 176.201 0.1 A 11 LEU CA C 13 55.242 0.1 A 11 LEU CB C 13 42.622 0.1 A 11 LEU CDx C 13 24.603 0.1 A 11 LEU CDy C 13 24.604 0.1 A 11 LEU CG C 13 27.104 0.1 A 11 LEU N N 15 123.992 0.1 A 12 GLN H H 1 8.377 0.01 A 12 GLN HA H 1 4.339 0.01 A 12 GLN HBx H 1 1.948 0.01 A 12 GLN HBy H 1 2.075 0.01 A 12 GLN HE2x H 1 6.841 0.01 A 12 GLN HE2y H 1 7.553 0.01 A 12 GLN HGx H 1 2.297 0.01 A 12 GLN HGy H 1 2.297 0.01 A 12 GLN C C 13 175.222 0.1 A 12 GLN CA C 13 55.390 0.1 A 12 GLN CB C 13 29.276 0.1 A 12 GLN CD C 13 180.796 0.1 A 12 GLN CG C 13 33.801 0.1 A 12 GLN N N 15 122.433 0.1 A 12 GLN NE2 N 15 112.753 0.1 A 13 LEU H H 1 8.266 0.01 A 13 LEU HA H 1 4.517 0.01 A 13 LEU HBx H 1 1.300 0.01 A 13 LEU HBy H 1 1.644 0.01 A 13 LEU HDx% H 1 0.805 0.01 A 13 LEU HDy% H 1 0.851 0.01 A 13 LEU HG H 1 1.639 0.01 A 13 LEU C C 13 174.759 0.1 A 13 LEU CA C 13 54.272 0.1 A 13 LEU CB C 13 44.677 0.1 A 13 LEU CDx C 13 23.922 0.1 A 13 LEU CDy C 13 26.011 0.1 A 13 LEU CG C 13 26.891 0.1 A 13 LEU N N 15 122.962 0.1 A 14 ALA H H 1 8.801 0.01 A 14 ALA HA H 1 4.562 0.01 A 14 ALA HB% H 1 1.307 0.01 A 14 ALA C C 13 176.764 0.1 A 14 ALA CA C 13 49.933 0.1 A 14 ALA CB C 13 22.235 0.1 A 14 ALA N N 15 124.629 0.1 A 15 VAL H H 1 8.457 0.01 A 15 VAL HA H 1 3.236 0.01 A 15 VAL HB H 1 1.891 0.01 A 15 VAL HGx% H 1 0.904 0.01 A 15 VAL HGy% H 1 0.943 0.01 A 15 VAL C C 13 177.402 0.1 A 15 VAL CA C 13 65.744 0.1 A 15 VAL CB C 13 31.033 0.1 A 15 VAL CGx C 13 21.526 0.1 A 15 VAL CGy C 13 22.599 0.1 A 15 VAL N N 15 120.179 0.1 A 16 GLY H H 1 9.043 0.01 A 16 GLY HAx H 1 3.572 0.01 A 16 GLY HAy H 1 4.591 0.01 A 16 GLY C C 13 174.693 0.1 A 16 GLY CA C 13 44.484 0.1 A 16 GLY N N 15 116.873 0.1 A 17 ASP H H 1 8.186 0.01 A 17 ASP HA H 1 4.567 0.01 A 17 ASP HBx H 1 2.418 0.01 A 17 ASP HBy H 1 2.844 0.01 A 17 ASP C C 13 175.280 0.1 A 17 ASP CA C 13 55.819 0.1 A 17 ASP CB C 13 41.373 0.1 A 17 ASP N N 15 122.053 0.1 A 18 ARG H H 1 8.716 0.01 A 18 ARG HA H 1 5.228 0.01 A 18 ARG HBx H 1 1.701 0.01 A 18 ARG HBy H 1 1.701 0.01 A 18 ARG HDx H 1 3.183 0.01 A 18 ARG HDy H 1 3.183 0.01 A 18 ARG HGx H 1 1.382 0.01 A 18 ARG HGy H 1 1.382 0.01 A 18 ARG C C 13 176.030 0.1 A 18 ARG CA C 13 55.290 0.1 A 18 ARG CB C 13 32.260 0.1 A 18 ARG CD C 13 43.712 0.1 A 18 ARG CG C 13 28.368 0.1 A 18 ARG N N 15 121.426 0.1 A 19 VAL H H 1 9.146 0.01 A 19 VAL HA H 1 5.151 0.01 A 19 VAL HB H 1 1.937 0.01 A 19 VAL HGx% H 1 0.665 0.01 A 19 VAL HGy% H 1 0.693 0.01 A 19 VAL C C 13 174.098 0.1 A 19 VAL CA C 13 58.198 0.1 A 19 VAL CB C 13 35.730 0.1 A 19 VAL CGx C 13 19.324 0.1 A 19 VAL CGy C 13 21.774 0.1 A 19 VAL N N 15 117.028 0.1 A 20 VAL H H 1 9.028 0.01 A 20 VAL HA H 1 4.287 0.01 A 20 VAL HB H 1 1.935 0.01 A 20 VAL HGx% H 1 0.802 0.01 A 20 VAL HGy% H 1 0.905 0.01 A 20 VAL C C 13 174.804 0.1 A 20 VAL CA C 13 62.158 0.1 A 20 VAL CB C 13 32.526 0.1 A 20 VAL CGx C 13 20.618 0.1 A 20 VAL CGy C 13 21.292 0.1 A 20 VAL N N 15 121.628 0.1 A 21 TYR H H 1 8.487 0.01 A 21 TYR HA H 1 4.973 0.01 A 21 TYR HBx H 1 2.607 0.01 A 21 TYR HBy H 1 3.232 0.01 A 21 TYR HDx H 1 6.902 0.01 A 21 TYR HDy H 1 6.902 0.01 A 21 TYR HEx H 1 6.672 0.01 A 21 TYR HEy H 1 6.672 0.01 A 21 TYR CA C 13 54.059 0.1 A 21 TYR CB C 13 41.433 0.1 A 21 TYR N N 15 131.627 0.1 A 22 PRO HA H 1 4.172 0.01 A 22 PRO HBx H 1 1.779 0.01 A 22 PRO HBy H 1 2.227 0.01 A 22 PRO HDx H 1 2.605 0.01 A 22 PRO HDy H 1 3.577 0.01 A 22 PRO HGx H 1 1.804 0.01 A 22 PRO HGy H 1 1.956 0.01 A 22 PRO CA C 13 64.926 0.1 A 22 PRO CB C 13 31.650 0.1 A 22 PRO CD C 13 51.120 0.1 A 22 PRO CG C 13 27.514 0.1 A 23 ASN HA H 1 4.334 0.01 A 23 ASN HBx H 1 3.032 0.01 A 23 ASN HBy H 1 3.180 0.01 A 23 ASN HD2x H 1 6.995 0.01 A 23 ASN HD2y H 1 7.523 0.01 A 23 ASN C C 13 174.799 0.1 A 23 ASN CA C 13 55.912 0.1 A 23 ASN CB C 13 38.226 0.1 A 23 ASN CG C 13 178.197 0.1 A 23 ASN ND2 N 15 113.500 0.1 A 24 GLN H H 1 8.403 0.01 A 24 GLN HA H 1 4.648 0.01 A 24 GLN HBx H 1 1.594 0.01 A 24 GLN HBy H 1 2.046 0.01 A 24 GLN HE2x H 1 6.483 0.01 A 24 GLN HE2y H 1 7.121 0.01 A 24 GLN HGx H 1 1.937 0.01 A 24 GLN HGy H 1 2.227 0.01 A 24 GLN C C 13 175.879 0.1 A 24 GLN CA C 13 55.564 0.1 A 24 GLN CB C 13 30.253 0.1 A 24 GLN CD C 13 178.293 0.1 A 24 GLN CG C 13 32.296 0.1 A 24 GLN N N 15 116.432 0.1 A 24 GLN NE2 N 15 109.215 0.1 A 25 GLY H H 1 8.186 0.01 A 25 GLY HAx H 1 3.835 0.01 A 25 GLY HAy H 1 4.323 0.01 A 25 GLY C C 13 173.476 0.1 A 25 GLY CA C 13 44.584 0.1 A 25 GLY N N 15 107.822 0.1 A 26 VAL H H 1 8.628 0.01 A 26 VAL HA H 1 4.619 0.01 A 26 VAL HB H 1 1.997 0.01 A 26 VAL HGx% H 1 0.891 0.01 A 26 VAL HGy% H 1 1.010 0.01 A 26 VAL C C 13 177.468 0.1 A 26 VAL CA C 13 63.376 0.1 A 26 VAL CB C 13 31.504 0.1 A 26 VAL CGx C 13 22.027 0.1 A 26 VAL CGy C 13 22.165 0.1 A 26 VAL N N 15 121.492 0.1 A 27 CYS H H 1 9.674 0.01 A 27 CYS HA H 1 5.373 0.01 A 27 CYS HBx H 1 2.305 0.01 A 27 CYS HBy H 1 2.781 0.01 A 27 CYS C C 13 172.549 0.1 A 27 CYS CA C 13 56.970 0.1 A 27 CYS CB C 13 33.403 0.1 A 27 CYS N N 15 125.613 0.1 A 28 ARG H H 1 8.917 0.01 A 28 ARG HA H 1 5.357 0.01 A 28 ARG HBx H 1 1.738 0.01 A 28 ARG HBy H 1 1.785 0.01 A 28 ARG HDx H 1 3.153 0.01 A 28 ARG HDy H 1 3.182 0.01 A 28 ARG HGx H 1 1.511 0.01 A 28 ARG HGy H 1 1.511 0.01 A 28 ARG C C 13 176.992 0.1 A 28 ARG CA C 13 53.643 0.1 A 28 ARG CB C 13 32.864 0.1 A 28 ARG CD C 13 43.278 0.1 A 28 ARG CG C 13 27.475 0.1 A 28 ARG N N 15 120.761 0.1 A 29 VAL H H 1 9.205 0.01 A 29 VAL HA H 1 3.959 0.01 A 29 VAL HB H 1 2.410 0.01 A 29 VAL HGx% H 1 0.792 0.01 A 29 VAL HGy% H 1 0.925 0.01 A 29 VAL C C 13 176.098 0.1 A 29 VAL CA C 13 64.300 0.1 A 29 VAL CB C 13 31.193 0.1 A 29 VAL CGx C 13 22.016 0.1 A 29 VAL CGy C 13 22.023 0.1 A 29 VAL N N 15 126.114 0.1 A 30 SER H H 1 9.690 0.01 A 30 SER HA H 1 4.656 0.01 A 30 SER HBx H 1 3.615 0.01 A 30 SER HBy H 1 3.812 0.01 A 30 SER C C 13 174.250 0.1 A 30 SER CA C 13 59.249 0.1 A 30 SER CB C 13 64.954 0.1 A 30 SER N N 15 127.526 0.1 A 31 ALA H H 1 7.983 0.01 A 31 ALA HA H 1 4.457 0.01 A 31 ALA HB% H 1 1.413 0.01 A 31 ALA C C 13 174.445 0.1 A 31 ALA CA C 13 53.115 0.1 A 31 ALA CB C 13 21.852 0.1 A 31 ALA N N 15 123.130 0.1 A 32 ILE H H 1 8.376 0.01 A 32 ILE HA H 1 4.681 0.01 A 32 ILE HB H 1 1.672 0.01 A 32 ILE HD1% H 1 0.755 0.01 A 32 ILE HG1x H 1 0.963 0.01 A 32 ILE HG1y H 1 1.405 0.01 A 32 ILE HG2% H 1 0.761 0.01 A 32 ILE C C 13 174.714 0.1 A 32 ILE CA C 13 61.613 0.1 A 32 ILE CB C 13 40.352 0.1 A 32 ILE CD1 C 13 13.736 0.1 A 32 ILE CG1 C 13 28.133 0.1 A 32 ILE CG2 C 13 17.528 0.1 A 32 ILE N N 15 121.431 0.1 A 33 ASP H H 1 8.738 0.01 A 33 ASP HA H 1 5.138 0.01 A 33 ASP HBx H 1 2.472 0.01 A 33 ASP HBy H 1 2.621 0.01 A 33 ASP C C 13 174.048 0.1 A 33 ASP CA C 13 53.207 0.1 A 33 ASP CB C 13 45.180 0.1 A 33 ASP N N 15 125.348 0.1 A 34 VAL H H 1 8.632 0.01 A 34 VAL HA H 1 4.875 0.01 A 34 VAL HB H 1 1.939 0.01 A 34 VAL HGx% H 1 0.826 0.01 A 34 VAL HGy% H 1 0.963 0.01 A 34 VAL C C 13 176.228 0.1 A 34 VAL CA C 13 61.822 0.1 A 34 VAL CB C 13 32.787 0.1 A 34 VAL CGy C 13 21.269 0.1 A 34 VAL CGx C 13 20.945 0.1 A 34 VAL N N 15 121.794 0.1 A 35 LYS H H 1 9.277 0.01 A 35 LYS HA H 1 4.692 0.01 A 35 LYS HBx H 1 1.650 0.01 A 35 LYS HBy H 1 1.752 0.01 A 35 LYS HDx H 1 1.256 0.01 A 35 LYS HDy H 1 1.391 0.01 A 35 LYS HEx H 1 2.618 0.01 A 35 LYS HEy H 1 2.675 0.01 A 35 LYS HGx H 1 1.253 0.01 A 35 LYS HGy H 1 1.302 0.01 A 35 LYS C C 13 174.355 0.1 A 35 LYS CA C 13 54.373 0.1 A 35 LYS CB C 13 36.081 0.1 A 35 LYS CD C 13 28.614 0.1 A 35 LYS CE C 13 41.816 0.1 A 35 LYS CG C 13 24.712 0.1 A 35 LYS N N 15 127.450 0.1 A 36 GLU H H 1 8.546 0.01 A 36 GLU HA H 1 5.031 0.01 A 36 GLU HBx H 1 1.809 0.01 A 36 GLU HBy H 1 1.940 0.01 A 36 GLU HGx H 1 1.928 0.01 A 36 GLU HGy H 1 2.007 0.01 A 36 GLU C C 13 176.176 0.1 A 36 GLU CA C 13 55.411 0.1 A 36 GLU CB C 13 30.614 0.1 A 36 GLU CG C 13 36.783 0.1 A 36 GLU N N 15 122.715 0.1 A 37 VAL H H 1 8.965 0.01 A 37 VAL HA H 1 4.214 0.01 A 37 VAL HB H 1 2.033 0.01 A 37 VAL HGx% H 1 0.955 0.01 A 37 VAL HGy% H 1 0.955 0.01 A 37 VAL CA C 13 61.765 0.1 A 37 VAL CB C 13 34.402 0.1 A 37 VAL CGy C 13 20.493 0.1 A 37 VAL N N 15 127.225 0.1 A 38 ALA H H 1 9.408 0.01 A 38 ALA HA H 1 4.047 0.01 A 38 ALA HB% H 1 1.433 0.01 A 38 ALA C C 13 177.380 0.1 A 38 ALA CA C 13 52.974 0.1 A 38 ALA CB C 13 17.152 0.1 A 38 ALA N N 15 120.527 0.1 A 39 GLY H H 1 8.638 0.01 A 39 GLY HAx H 1 3.670 0.01 A 39 GLY HAy H 1 4.159 0.01 A 39 GLY C C 13 173.945 0.1 A 39 GLY CA C 13 45.386 0.1 A 39 GLY N N 15 103.890 0.1 A 40 GLN H H 1 7.942 0.01 A 40 GLN HA H 1 4.651 0.01 A 40 GLN HBx H 1 2.025 0.01 A 40 GLN HBy H 1 2.104 0.01 A 40 GLN HE2x H 1 6.886 0.01 A 40 GLN HE2y H 1 7.588 0.01 A 40 GLN HGx H 1 2.302 0.01 A 40 GLN HGy H 1 2.354 0.01 A 40 GLN C C 13 174.471 0.1 A 40 GLN CA C 13 53.822 0.1 A 40 GLN CB C 13 31.315 0.1 A 40 GLN CD C 13 180.562 0.1 A 40 GLN CG C 13 33.576 0.1 A 40 GLN N N 15 119.767 0.1 A 40 GLN NE2 N 15 112.284 0.1 A 41 LYS H H 1 8.630 0.01 A 41 LYS HA H 1 4.673 0.01 A 41 LYS HBx H 1 1.582 0.01 A 41 LYS HBy H 1 1.750 0.01 A 41 LYS HDx H 1 1.599 0.01 A 41 LYS HDy H 1 1.599 0.01 A 41 LYS HEx H 1 2.930 0.01 A 41 LYS HEy H 1 2.930 0.01 A 41 LYS HGx H 1 1.221 0.01 A 41 LYS HGy H 1 1.443 0.01 A 41 LYS C C 13 175.673 0.1 A 41 LYS CA C 13 56.211 0.1 A 41 LYS CB C 13 32.462 0.1 A 41 LYS CD C 13 29.075 0.1 A 41 LYS CE C 13 41.899 0.1 A 41 LYS CG C 13 25.469 0.1 A 41 LYS N N 15 123.409 0.1 A 42 LEU H H 1 8.943 0.01 A 42 LEU HA H 1 4.686 0.01 A 42 LEU HBx H 1 1.373 0.01 A 42 LEU HBy H 1 1.701 0.01 A 42 LEU HDx% H 1 0.869 0.01 A 42 LEU HDy% H 1 0.910 0.01 A 42 LEU HG H 1 1.552 0.01 A 42 LEU C C 13 175.231 0.1 A 42 LEU CA C 13 54.006 0.1 A 42 LEU CB C 13 45.762 0.1 A 42 LEU CDx C 13 23.890 0.1 A 42 LEU CDy C 13 25.436 0.1 A 42 LEU CG C 13 27.153 0.1 A 42 LEU N N 15 127.425 0.1 A 43 THR H H 1 8.442 0.01 A 43 THR HA H 1 4.929 0.01 A 43 THR HB H 1 3.896 0.01 A 43 THR HG2% H 1 1.019 0.01 A 43 THR C C 13 174.338 0.1 A 43 THR CA C 13 62.746 0.1 A 43 THR CB C 13 68.921 0.1 A 43 THR CG2 C 13 22.435 0.1 A 43 THR N N 15 118.155 0.1 A 44 PHE H H 1 9.705 0.01 A 44 PHE HA H 1 4.799 0.01 A 44 PHE HBx H 1 2.729 0.01 A 44 PHE HBy H 1 2.863 0.01 A 44 PHE HDx H 1 6.979 0.01 A 44 PHE HDy H 1 6.979 0.01 A 44 PHE HEx H 1 7.273 0.01 A 44 PHE HEy H 1 7.273 0.01 A 44 PHE HZ H 1 7.301 0.01 A 44 PHE C C 13 174.757 0.1 A 44 PHE CA C 13 57.549 0.1 A 44 PHE CB C 13 42.832 0.1 A 44 PHE N N 15 127.256 0.1 A 45 VAL H H 1 9.393 0.01 A 45 VAL HA H 1 4.564 0.01 A 45 VAL HB H 1 2.086 0.01 A 45 VAL HGx% H 1 0.881 0.01 A 45 VAL HGy% H 1 0.939 0.01 A 45 VAL C C 13 174.882 0.1 A 45 VAL CA C 13 61.542 0.1 A 45 VAL CB C 13 33.239 0.1 A 45 VAL CGx C 13 20.862 0.1 A 45 VAL CGy C 13 22.163 0.1 A 45 VAL N N 15 124.913 0.1 A 46 THR H H 1 9.200 0.01 A 46 THR HA H 1 4.922 0.01 A 46 THR HB H 1 3.986 0.01 A 46 THR HG2% H 1 1.098 0.01 A 46 THR C C 13 174.029 0.1 A 46 THR CA C 13 62.867 0.1 A 46 THR CB C 13 68.769 0.1 A 46 THR CG2 C 13 21.790 0.1 A 46 THR N N 15 124.694 0.1 A 47 MET H H 1 9.545 0.01 A 47 MET HA H 1 5.291 0.01 A 47 MET HBx H 1 1.624 0.01 A 47 MET HBy H 1 1.885 0.01 A 47 MET HGx H 1 2.261 0.01 A 47 MET HGy H 1 2.261 0.01 A 47 MET C C 13 173.412 0.1 A 47 MET CA C 13 53.541 0.1 A 47 MET CB C 13 37.062 0.1 A 47 MET CG C 13 32.543 0.1 A 47 MET N N 15 126.319 0.1 A 48 ARG H H 1 8.901 0.01 A 48 ARG HA H 1 5.200 0.01 A 48 ARG HBx H 1 1.593 0.01 A 48 ARG HBy H 1 1.593 0.01 A 48 ARG HDx H 1 3.117 0.01 A 48 ARG HDy H 1 3.163 0.01 A 48 ARG HGx H 1 1.394 0.01 A 48 ARG HGy H 1 1.525 0.01 A 48 ARG C C 13 177.250 0.1 A 48 ARG CA C 13 53.608 0.1 A 48 ARG CB C 13 32.664 0.1 A 48 ARG CD C 13 43.186 0.1 A 48 ARG CG C 13 27.528 0.1 A 48 ARG N N 15 119.647 0.1 A 49 ARG H H 1 9.585 0.01 A 49 ARG HA H 1 4.724 0.01 A 49 ARG HBx H 1 2.041 0.01 A 49 ARG HBy H 1 2.267 0.01 A 49 ARG HDx H 1 3.355 0.01 A 49 ARG HDy H 1 3.479 0.01 A 49 ARG HE H 1 8.109 0.01 A 49 ARG HGx H 1 1.808 0.01 A 49 ARG HGy H 1 1.808 0.01 A 49 ARG C C 13 178.112 0.1 A 49 ARG CA C 13 57.627 0.1 A 49 ARG CB C 13 31.259 0.1 A 49 ARG CD C 13 44.149 0.1 A 49 ARG CG C 13 27.691 0.1 A 49 ARG CZ C 13 159.90 0.1 A 49 ARG N N 15 128.867 0.1 A 49 ARG NE N 15 84.73 0.1 A 50 GLU H H 1 8.936 0.01 A 50 GLU HA H 1 4.072 0.01 A 50 GLU HBx H 1 1.950 0.01 A 50 GLU HBy H 1 2.026 0.01 A 50 GLU HGx H 1 2.174 0.01 A 50 GLU HGy H 1 2.174 0.01 A 50 GLU C C 13 179.337 0.1 A 50 GLU CA C 13 59.693 0.1 A 50 GLU CB C 13 29.586 0.1 A 50 GLU N N 15 125.739 0.1 A 51 GLU H H 1 8.848 0.01 A 51 GLU HA H 1 4.048 0.01 A 51 GLU HBx H 1 1.806 0.01 A 51 GLU HBy H 1 2.126 0.01 A 51 GLU HGx H 1 2.218 0.01 A 51 GLU HGy H 1 2.303 0.01 A 51 GLU C C 13 177.189 0.1 A 51 GLU CA C 13 59.779 0.1 A 51 GLU CB C 13 29.955 0.1 A 51 GLU CG C 13 35.980 0.1 A 51 GLU N N 15 117.118 0.1 A 52 ASP H H 1 7.070 0.01 A 52 ASP HA H 1 4.798 0.01 A 52 ASP HBx H 1 2.531 0.01 A 52 ASP HBy H 1 3.059 0.01 A 52 ASP C C 13 177.313 0.1 A 52 ASP CA C 13 52.585 0.1 A 52 ASP CB C 13 42.077 0.1 A 52 ASP N N 15 111.283 0.1 A 53 GLY H H 1 8.246 0.01 A 53 GLY HAx H 1 3.816 0.01 A 53 GLY HAy H 1 4.125 0.01 A 53 GLY C C 13 173.887 0.1 A 53 GLY CA C 13 46.072 0.1 A 53 GLY N N 15 110.570 0.1 A 54 ALA H H 1 7.798 0.01 A 54 ALA HA H 1 4.214 0.01 A 54 ALA HB% H 1 1.384 0.01 A 54 ALA C C 13 176.901 0.1 A 54 ALA CA C 13 53.049 0.1 A 54 ALA CB C 13 19.170 0.1 A 54 ALA N N 15 123.319 0.1 A 55 VAL H H 1 8.300 0.01 A 55 VAL HA H 1 4.690 0.01 A 55 VAL HB H 1 1.896 0.01 A 55 VAL HGx% H 1 0.853 0.01 A 55 VAL HGy% H 1 0.961 0.01 A 55 VAL C C 13 176.510 0.1 A 55 VAL CA C 13 62.148 0.1 A 55 VAL CB C 13 33.131 0.1 A 55 VAL CGx C 13 21.500 0.1 A 55 VAL N N 15 120.238 0.1 A 56 VAL H H 1 8.977 0.01 A 56 VAL HA H 1 4.286 0.01 A 56 VAL HB H 1 1.760 0.01 A 56 VAL HGx% H 1 0.593 0.01 A 56 VAL HGy% H 1 0.672 0.01 A 56 VAL C C 13 173.629 0.1 A 56 VAL CA C 13 60.929 0.1 A 56 VAL CB C 13 34.888 0.1 A 56 VAL CGy C 13 20.850 0.1 A 56 VAL CGx C 13 19.822 0.1 A 56 VAL N N 15 127.216 0.1 A 57 MET H H 1 8.668 0.01 A 57 MET HA H 1 5.542 0.01 A 57 MET HBx H 1 1.845 0.01 A 57 MET HBy H 1 1.980 0.01 A 57 MET HGx H 1 2.406 0.01 A 57 MET HGy H 1 2.474 0.01 A 57 MET C C 13 175.731 0.1 A 57 MET CA C 13 54.492 0.1 A 57 MET CB C 13 35.052 0.1 A 57 MET CG C 13 31.786 0.1 A 57 MET N N 15 126.179 0.1 A 58 VAL H H 1 8.944 0.01 A 58 VAL HA H 1 4.981 0.01 A 58 VAL HB H 1 2.019 0.01 A 58 VAL HGx% H 1 0.788 0.01 A 58 VAL HGy% H 1 0.965 0.01 A 58 VAL CA C 13 57.983 0.1 A 58 VAL CB C 13 35.540 0.1 A 58 VAL CGx C 13 20.323 0.1 A 58 VAL CGy C 13 21.870 0.1 A 58 VAL N N 15 122.116 0.1 A 59 PRO HA H 1 4.244 0.01 A 59 PRO HBx H 1 1.816 0.01 A 59 PRO HBy H 1 2.042 0.01 A 59 PRO HDx H 1 3.636 0.01 A 59 PRO HDy H 1 3.991 0.01 A 59 PRO HGx H 1 1.909 0.01 A 59 PRO HGy H 1 2.079 0.01 A 59 PRO C C 13 177.940 0.1 A 59 PRO CA C 13 62.631 0.1 A 59 PRO CB C 13 31.855 0.1 A 59 PRO CD C 13 51.277 0.1 A 59 PRO CG C 13 27.885 0.1 A 60 GLU H H 1 8.642 0.01 A 60 GLU HA H 1 3.735 0.01 A 60 GLU HBx H 1 1.735 0.01 A 60 GLU HBy H 1 1.979 0.01 A 60 GLU HGx H 1 2.072 0.01 A 60 GLU HGy H 1 2.184 0.01 A 60 GLU C C 13 177.789 0.1 A 60 GLU CA C 13 59.753 0.1 A 60 GLU CB C 13 30.112 0.1 A 60 GLU CG C 13 36.061 0.1 A 60 GLU N N 15 124.895 0.1 A 61 GLY H H 1 8.922 0.01 A 61 GLY HAx H 1 3.907 0.01 A 61 GLY HAy H 1 3.907 0.01 A 61 GLY C C 13 175.711 0.1 A 61 GLY CA C 13 46.477 0.1 A 61 GLY N N 15 104.341 0.1 A 62 LYS H H 1 7.553 0.01 A 62 LYS HA H 1 4.423 0.01 A 62 LYS HBx H 1 1.827 0.01 A 62 LYS HBy H 1 2.062 0.01 A 62 LYS HDx H 1 1.686 0.01 A 62 LYS HDy H 1 1.686 0.01 A 62 LYS HEx H 1 2.981 0.01 A 62 LYS HEy H 1 2.981 0.01 A 62 LYS HGx H 1 1.436 0.01 A 62 LYS HGy H 1 1.534 0.01 A 62 LYS C C 13 177.170 0.1 A 62 LYS CA C 13 56.699 0.1 A 62 LYS CB C 13 32.971 0.1 A 62 LYS CD C 13 28.925 0.1 A 62 LYS CE C 13 41.943 0.1 A 62 LYS CG C 13 24.928 0.1 A 62 LYS N N 15 118.819 0.1 A 63 VAL H H 1 7.370 0.01 A 63 VAL HA H 1 3.587 0.01 A 63 VAL HB H 1 2.199 0.01 A 63 VAL HGx% H 1 0.902 0.01 A 63 VAL HGy% H 1 0.980 0.01 A 63 VAL C C 13 177.079 0.1 A 63 VAL CA C 13 66.328 0.1 A 63 VAL CB C 13 31.671 0.1 A 63 VAL CGx C 13 22.172 0.1 A 63 VAL CGy C 13 23.045 0.1 A 63 VAL N N 15 118.112 0.1 A 64 LEU H H 1 8.055 0.01 A 64 LEU HA H 1 4.195 0.01 A 64 LEU HBx H 1 1.576 0.01 A 64 LEU HBy H 1 1.710 0.01 A 64 LEU HDx% H 1 0.856 0.01 A 64 LEU HDy% H 1 0.885 0.01 A 64 LEU HG H 1 1.695 0.01 A 64 LEU C C 13 179.226 0.1 A 64 LEU CA C 13 56.850 0.1 A 64 LEU CB C 13 41.565 0.1 A 64 LEU CDx C 13 23.341 0.1 A 64 LEU CDy C 13 25.135 0.1 A 64 LEU CG C 13 27.056 0.1 A 64 LEU N N 15 118.147 0.1 A 65 ALA H H 1 7.758 0.01 A 65 ALA HA H 1 4.195 0.01 A 65 ALA HB% H 1 1.491 0.01 A 65 ALA C C 13 179.602 0.1 A 65 ALA CA C 13 54.245 0.1 A 65 ALA CB C 13 18.945 0.1 A 65 ALA N N 15 122.048 0.1 A 66 ILE H H 1 7.897 0.01 A 66 ILE HA H 1 4.163 0.01 A 66 ILE HB H 1 1.940 0.01 A 66 ILE HD1% H 1 0.722 0.01 A 66 ILE HG1x H 1 1.331 0.01 A 66 ILE HG1y H 1 1.380 0.01 A 66 ILE HG2% H 1 0.816 0.01 A 66 ILE C C 13 176.533 0.1 A 66 ILE CA C 13 62.197 0.1 A 66 ILE CB C 13 38.825 0.1 A 66 ILE CD1 C 13 13.836 0.1 A 66 ILE CG1 C 13 27.453 0.1 A 66 ILE CG2 C 13 17.367 0.1 A 66 ILE N N 15 114.096 0.1 A 67 GLY H H 1 7.792 0.01 A 67 GLY HAx H 1 3.825 0.01 A 67 GLY HAy H 1 4.077 0.01 A 67 GLY C C 13 174.567 0.1 A 67 GLY CA C 13 45.417 0.1 A 67 GLY N N 15 108.221 0.1 A 68 VAL H H 1 7.573 0.01 A 68 VAL HA H 1 4.192 0.01 A 68 VAL HB H 1 1.949 0.01 A 68 VAL HGx% H 1 0.811 0.01 A 68 VAL HGy% H 1 0.811 0.01 A 68 VAL C C 13 175.066 0.1 A 68 VAL CA C 13 62.886 0.1 A 68 VAL CB C 13 31.990 0.1 A 68 VAL CGx C 13 21.729 0.1 A 68 VAL N N 15 119.944 0.1 A 69 ARG H H 1 7.939 0.01 A 69 ARG HA H 1 4.694 0.01 A 69 ARG HBx H 1 1.691 0.01 A 69 ARG HBy H 1 1.834 0.01 A 69 ARG HDx H 1 3.183 0.01 A 69 ARG HDy H 1 3.183 0.01 A 69 ARG HGx H 1 1.594 0.01 A 69 ARG HGy H 1 1.594 0.01 A 69 ARG C C 13 175.337 0.1 A 69 ARG CA C 13 54.312 0.1 A 69 ARG CB C 13 32.839 0.1 A 69 ARG CD C 13 43.317 0.1 A 69 ARG CG C 13 26.782 0.1 A 69 ARG N N 15 123.919 0.1 A 70 LYS H H 1 8.773 0.01 A 70 LYS HA H 1 4.562 0.01 A 70 LYS HBx H 1 1.658 0.01 A 70 LYS HBy H 1 1.882 0.01 A 70 LYS HDx H 1 1.698 0.01 A 70 LYS HDy H 1 1.698 0.01 A 70 LYS HEx H 1 2.934 0.01 A 70 LYS HEy H 1 2.934 0.01 A 70 LYS HGx H 1 1.329 0.01 A 70 LYS HGy H 1 1.491 0.01 A 70 LYS C C 13 176.703 0.1 A 70 LYS CA C 13 56.845 0.1 A 70 LYS CB C 13 33.096 0.1 A 70 LYS CD C 13 29.183 0.1 A 70 LYS CE C 13 41.925 0.1 A 70 LYS CG C 13 25.845 0.1 A 70 LYS N N 15 123.368 0.1 A 71 VAL H H 1 8.347 0.01 A 71 VAL HA H 1 4.117 0.01 A 71 VAL HB H 1 1.997 0.01 A 71 VAL HGx% H 1 0.840 0.01 A 71 VAL HGy% H 1 0.918 0.01 A 71 VAL C C 13 175.543 0.1 A 71 VAL CA C 13 62.132 0.1 A 71 VAL CB C 13 32.803 0.1 A 71 VAL CGx C 13 20.710 0.1 A 71 VAL N N 15 122.535 0.1 A 72 ALA H H 1 8.462 0.01 A 72 ALA HA H 1 4.412 0.01 A 72 ALA HB% H 1 1.440 0.01 A 72 ALA C C 13 177.495 0.1 A 72 ALA CA C 13 52.370 0.1 A 72 ALA CB C 13 19.565 0.1 A 72 ALA N N 15 127.534 0.1 A 73 SER H H 1 8.334 0.01 A 73 SER HA H 1 4.471 0.01 A 73 SER HBx H 1 3.898 0.01 A 73 SER HBy H 1 3.898 0.01 A 73 SER C C 13 174.127 0.1 A 73 SER CA C 13 58.457 0.1 A 73 SER CB C 13 63.988 0.1 A 73 SER N N 15 115.660 0.1 A 74 ALA H H 1 8.408 0.01 A 74 ALA HA H 1 4.377 0.01 A 74 ALA HB% H 1 1.412 0.01 A 74 ALA C C 13 176.642 0.1 A 74 ALA CA C 13 52.625 0.1 A 74 ALA CB C 13 19.417 0.1 A 74 ALA N N 15 126.311 0.1 A 75 GLU H H 1 7.924 0.01 A 75 GLU HA H 1 4.102 0.01 A 75 GLU HBx H 1 1.887 0.01 A 75 GLU HBy H 1 2.045 0.01 A 75 GLU HGx H 1 2.198 0.01 A 75 GLU HGy H 1 2.198 0.01 A 75 GLU CA C 13 57.971 0.1 A 75 GLU CB C 13 31.215 0.1 A 75 GLU CG C 13 36.741 0.1 A 75 GLU N N 15 125.171 0.1 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-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 36 GLU HA A 41 LYS HA 1.0 . 2.74 2 2 A 46 THR HA A 57 MET HA 1.0 . 3.30 3 3 A 18 ARG HA A 28 ARG HA 1.0 . 3.61 4 4 A 44 PHE HA A 59 PRO HA 1.0 . 3.14 5 5 A 48 ARG HA A 55 VAL HA 1.0 . 3.45 6 6 A 35 LYS H A 42 LEU H 1.0 . 2.96 7 7 A 36 GLU HA A 40 GLN H 1.0 . 3.67 8 8 A 19 VAL H A 27 CYS H 1.0 . 3.52 9 9 A 45 VAL H A 58 VAL H 1.0 . 3.95 10 10 A 47 MET H A 56 VAL H 1.0 . 3.17 11 11 A 31 ALA H A 46 THR H 1.0 . 3.76 12 12 A 57 MET HA A 47 MET H 1.0 . 3.70 13 13 A 30 SER H A 47 MET HA 1.0 . 3.33 14 14 A 18 ARG HA A 29 VAL H 1.0 . 4.07 15 15 A 62 LYS HA A 65 ALA H 1.0 . 4.42 16 16 A 60 GLU HA A 63 VAL H 1.0 . 3.84 17 17 A 33 ASP H A 44 PHE H 1.0 . 3.67 18 18 A 20 VAL HA A 26 VAL HA 1.0 . 3.39 19 19 A 19 VAL HA A 70 LYS HA 1.0 . 3.24 20 20 A 27 CYS HA A 49 ARG HA 1.0 . 3.21 21 21 A 47 MET HA A 29 VAL HA 1.0 . 3.39 22 22 A 21 TYR HA A 68 VAL HA 1.0 . 3.90 23 23 A 58 VAL HA A 59 PRO HDy 1.0 . 3.46 24 24 A 21 TYR HE% A 56 VAL HGy% 1.0 . 4.99 25 25 A 34 VAL HA A 34 VAL HGy% 1.0 . 3.29 26 26 A 34 VAL HA A 34 VAL HGx% 1.0 . 3.29 27 27 A 44 PHE HA A 42 LEU HDx% 1.0 . 4.03 28 28 A 15 VAL HGy% A 30 SER HA 1.0 . 5.50 29 29 A 41 LYS HA A 37 VAL HGx% 1.0 . 5.50 30 29 A 41 LYS HA A 37 VAL HGy% 1.0 . 5.50 31 30 A 41 LYS HA A 36 GLU HGx 1.0 . 3.81 32 31 A 41 LYS HA A 36 GLU HGy 1.0 . 4.63 33 32 A 62 LYS HA A 59 PRO HBx 1.0 . 4.24 34 33 A 71 VAL HB A 74 ALA HA 1.0 . 4.57 35 34 A 63 VAL HGx% A 64 LEU HA 1.0 . 5.50 36 35 A 68 VAL HA A 63 VAL HGx% 1.0 . 5.50 37 36 A 39 GLY HAy A 37 VAL HGx% 1.0 . 5.50 38 36 A 37 VAL HGy% A 39 GLY HAy 1.0 . 5.50 39 37 A 38 ALA HA A 37 VAL HGx% 1.0 . 4.49 40 37 A 37 VAL HGy% A 38 ALA HA 1.0 . 4.49 41 38 A 31 ALA HB% A 46 THR HB 1.0 . 3.10 42 39 A 29 VAL HA A 32 ILE HG1y 1.0 . 5.50 43 40 A 29 VAL HA A 29 VAL HGy% 1.0 . 3.15 44 41 A 64 LEU HG A 61 GLY HAx 1.0 . 4.65 45 41 A 61 GLY HAy A 64 LEU HG 1.0 . 4.65 46 42 A 43 THR HB A 45 VAL HGx% 1.0 . 4.97 47 43 A 64 LEU HDx% A 61 GLY HAx 1.0 . 5.19 48 43 A 61 GLY HAy A 64 LEU HDx% 1.0 . 5.19 49 44 A 43 THR HB A 60 GLU HGy 1.0 . 4.69 50 45 A 60 GLU HA A 63 VAL HGy% 1.0 . 3.49 51 46 A 60 GLU HA A 63 VAL HGx% 1.0 . 3.26 52 47 A 21 TYR HE% A 22 PRO HDx 1.0 . 4.19 53 48 A 15 VAL HA A 32 ILE HD1% 1.0 . 4.08 54 49 A 6 GLU HA A 6 GLU HGx 1.0 . 3.36 55 49 A 6 GLU HA A 6 GLU HGy 1.0 . 3.36 56 50 A 27 CYS HBy A 49 ARG HGx 1.0 . 5.50 57 50 A 27 CYS HBy A 49 ARG HGy 1.0 . 5.50 58 51 A 29 VAL HA A 47 MET HGx 1.0 . 3.75 59 51 A 29 VAL HA A 47 MET HGy 1.0 . 3.75 60 52 A 21 TYR HD% A 24 GLN HGy 1.0 . 4.18 61 53 A 59 PRO HGx A 63 VAL HB 1.0 . 5.50 62 54 A 63 VAL HB A 68 VAL HB 1.0 . 5.50 63 55 A 63 VAL HB A 58 VAL HB 1.0 . 5.50 64 56 A 64 LEU HG A 63 VAL HB 1.0 . 5.50 65 57 A 63 VAL HB A 68 VAL HGx% 1.0 . 4.28 66 57 A 63 VAL HB A 68 VAL HGy% 1.0 . 4.28 67 58 A 32 ILE HG2% A 45 VAL HB 1.0 . 5.50 68 59 A 45 VAL HB A 29 VAL HGx% 1.0 . 5.50 69 60 A 59 PRO HGx A 58 VAL HGy% 1.0 . 5.50 70 61 A 58 VAL HA A 59 PRO HBy 1.0 . 4.88 71 62 A 63 VAL HGy% A 66 ILE HB 1.0 . 5.50 72 63 A 26 VAL HA A 20 VAL HB 1.0 . 3.95 73 64 A 44 PHE HZ A 59 PRO HGy 1.0 . 5.25 74 65 A 59 PRO HGy A 42 LEU HDy% 1.0 . 5.50 75 66 A 59 PRO HBx A 58 VAL HB 1.0 . 5.50 76 67 A 35 LYS HA A 36 GLU HBx 1.0 . 4.40 77 68 A 59 PRO HBx A 58 VAL HGy% 1.0 . 5.50 78 69 A 44 PHE HZ A 42 LEU HBy 1.0 . 4.85 79 70 A 62 LYS HDx A 62 LYS HEx 1.0 . 2.50 80 70 A 62 LYS HDy A 62 LYS HEx 1.0 . 2.50 81 70 A 62 LYS HEy A 62 LYS HDx 1.0 . 2.50 82 70 A 62 LYS HDy A 62 LYS HEy 1.0 . 2.50 83 71 A 35 LYS HBx A 37 VAL HGx% 1.0 . 5.50 84 71 A 37 VAL HGy% A 35 LYS HBx 1.0 . 5.50 85 72 A 13 LEU HG A 70 LYS HEx 1.0 . 5.50 86 72 A 13 LEU HG A 70 LYS HEy 1.0 . 5.50 87 73 A 36 GLU HA A 41 LYS HDx 1.0 . 5.50 88 73 A 36 GLU HA A 41 LYS HDy 1.0 . 5.50 89 74 A 36 GLU HBx A 41 LYS HDx 1.0 . 5.50 90 74 A 36 GLU HBx A 41 LYS HDy 1.0 . 5.50 91 75 A 42 LEU HA A 42 LEU HG 1.0 . 3.84 92 76 A 74 ALA HB% A 71 VAL HGx% 1.0 . 5.50 93 77 A 74 ALA HB% A 71 VAL HGy% 1.0 . 5.50 94 78 A 28 ARG HA A 18 ARG HGx 1.0 . 4.92 95 78 A 28 ARG HA A 18 ARG HGy 1.0 . 4.92 96 79 A 32 ILE HG1x A 45 VAL HGy% 1.0 . 5.50 97 80 A 42 LEU HA A 42 LEU HBx 1.0 . 2.56 98 81 A 14 ALA HB% A 17 ASP HBx 1.0 . 3.50 99 82 A 44 PHE HE% A 35 LYS HGy 1.0 . 4.09 100 83 A 43 THR HA A 43 THR HG2% 1.0 . 3.12 101 84 A 26 VAL HA A 26 VAL HGy% 1.0 . 3.48 102 85 A 62 LYS HA A 63 VAL HGy% 1.0 . 4.38 103 86 A 63 VAL HGy% A 64 LEU HDy% 1.0 . 5.50 104 87 A 44 PHE HD% A 58 VAL HGx% 1.0 . 5.50 105 88 A 44 PHE HE% A 37 VAL HGx% 1.0 . 3.73 106 88 A 37 VAL HGy% A 44 PHE HE% 1.0 . 3.73 107 89 A 37 VAL HA A 37 VAL HGx% 1.0 . 2.75 108 89 A 37 VAL HGy% A 37 VAL HA 1.0 . 2.75 109 90 A 36 GLU HA A 37 VAL HGx% 1.0 . 3.81 110 90 A 36 GLU HA A 37 VAL HGy% 1.0 . 3.81 111 91 A 15 VAL HGy% A 15 VAL HA 1.0 . 2.78 112 92 A 71 VAL HA A 71 VAL HGy% 1.0 . 3.10 113 93 A 29 VAL HGy% A 15 VAL HA 1.0 . 5.43 114 94 A 30 SER HA A 15 VAL HGx% 1.0 . 3.98 115 95 A 26 VAL HA A 26 VAL HGx% 1.0 . 3.48 116 96 A 45 VAL HGx% A 45 VAL HA 1.0 . 4.13 117 97 A 63 VAL HGx% A 63 VAL HA 1.0 . 3.26 118 98 A 63 VAL HGx% A 59 PRO HGx 1.0 . 5.50 119 99 A 42 LEU HDx% A 44 PHE HBy 1.0 . 4.81 120 100 A 42 LEU HDx% A 44 PHE HD% 1.0 . 3.53 121 101 A 66 ILE HA A 66 ILE HG2% 1.0 . 2.89 122 102 A 29 VAL HA A 29 VAL HGx% 1.0 . 3.05 123 103 A 22 PRO HDx A 68 VAL HGx% 1.0 . 3.67 124 103 A 22 PRO HDx A 68 VAL HGy% 1.0 . 3.67 125 104 A 15 VAL HA A 29 VAL HGx% 1.0 . 2.98 126 105 A 45 VAL HGx% A 29 VAL HGx% 1.0 . 5.50 127 106 A 58 VAL HGy% A 45 VAL HGy% 1.0 . 5.50 128 107 A 42 LEU HDx% A 58 VAL HGy% 1.0 . 5.50 129 108 A 32 ILE HG2% A 43 THR HG2% 1.0 . 3.04 130 109 A 32 ILE HG2% A 32 ILE HA 1.0 . 3.32 131 110 A 43 THR HB A 32 ILE HG2% 1.0 . 4.83 132 111 A 32 ILE HD1% A 14 ALA HB% 1.0 . 5.50 133 112 A 42 LEU HDy% A 66 ILE HD1% 1.0 . 5.50 134 113 A 66 ILE HD1% A 68 VAL HGx% 1.0 . 5.50 135 113 A 68 VAL HGy% A 66 ILE HD1% 1.0 . 5.50 136 114 A 56 VAL HA A 56 VAL HGx% 1.0 . 4.01 137 115 A 28 ARG HA A 27 CYS HBy 1.0 . 4.71 138 116 A 20 VAL HA A 20 VAL HGy% 1.0 . 3.75 139 117 A 42 LEU HBy A 44 PHE HE% 1.0 . 4.60 140 118 A 45 VAL HGy% A 44 PHE HD% 1.0 . 5.50 141 119 A 21 TYR HA A 22 PRO HDy 1.0 . 3.59 142 120 A 21 TYR HA A 21 TYR HD% 1.0 . 4.13 143 121 A 57 MET HA A 58 VAL H 1.0 . 3.42 144 122 A 40 GLN H A 39 GLY H 1.0 . 3.80 145 123 A 40 GLN H A 40 GLN HBx 1.0 . 4.06 146 124 A 40 GLN H A 40 GLN HBy 1.0 . 4.06 147 125 A 40 GLN H A 40 GLN HGx 1.0 . 4.75 148 126 A 40 GLN H A 40 GLN HGy 1.0 . 4.75 149 127 A 40 GLN HA A 40 GLN HGy 1.0 . 4.03 150 128 A 40 GLN H A 37 VAL H 1.0 . 3.66 151 129 A 36 GLU HA A 37 VAL H 1.0 . 2.83 152 130 A 35 LYS HA A 36 GLU H 1.0 . 2.93 153 131 A 31 ALA H A 30 SER H 1.0 . 3.71 154 132 A 31 ALA HA A 32 ILE H 1.0 . 2.83 155 133 A 58 VAL HA A 44 PHE HE% 1.0 . 4.77 156 134 A 44 PHE H A 43 THR HA 1.0 . 3.01 157 135 A 30 SER H A 29 VAL HA 1.0 . 3.48 158 136 A 21 TYR HA A 22 PRO HDx 1.0 . 2.55 159 137 A 46 THR HA A 47 MET H 1.0 . 3.46 160 138 A 33 ASP HA A 34 VAL H 1.0 . 3.38 161 139 A 15 VAL HA A 15 VAL HGx% 1.0 . 3.16 162 140 A 59 PRO HGy A 37 VAL HGx% 1.0 . 5.50 163 140 A 37 VAL HGy% A 59 PRO HGy 1.0 . 5.50 164 141 A 59 PRO HGy A 58 VAL HGx% 1.0 . 5.50 165 142 A 44 PHE H A 44 PHE HD% 1.0 . 3.81 166 143 A 35 LYS H A 44 PHE HD% 1.0 . 4.22 167 144 A 16 GLY H A 17 ASP H 1.0 . 3.05 168 145 A 51 GLU H A 52 ASP H 1.0 . 4.47 169 146 A 24 GLN H A 25 GLY H 1.0 . 3.37 170 147 A 54 ALA H A 55 VAL H 1.0 . 5.05 171 148 A 65 ALA H A 64 LEU H 1.0 . 4.16 172 149 A 66 ILE H A 67 GLY H 1.0 . 4.36 173 150 A 65 ALA H A 66 ILE H 1.0 . 4.35 174 151 A 54 ALA H A 53 GLY H 1.0 . 4.22 175 152 A 67 GLY H A 68 VAL H 1.0 . 2.90 176 153 A 63 VAL H A 62 LYS H 1.0 . 3.23 177 154 A 63 VAL H A 64 LEU H 1.0 . 4.16 178 155 A 35 LYS H A 44 PHE HE% 1.0 . 3.89 179 156 A 52 ASP H A 53 GLY H 1.0 . 3.63 180 157 A 44 PHE HZ A 44 PHE HD% 1.0 . 3.91 181 158 A 28 ARG HA A 29 VAL H 1.0 . 3.06 182 159 A 18 ARG HA A 19 VAL H 1.0 . 3.46 183 160 A 48 ARG HA A 56 VAL H 1.0 . 4.51 184 161 A 48 ARG HA A 49 ARG H 1.0 . 3.46 185 162 A 35 LYS H A 34 VAL HA 1.0 . 3.41 186 163 A 44 PHE HA A 45 VAL H 1.0 . 3.34 187 164 A 69 ARG HA A 70 LYS H 1.0 . 2.57 188 165 A 55 VAL HA A 49 ARG H 1.0 . 4.11 189 166 A 42 LEU HA A 43 THR H 1.0 . 2.94 190 167 A 40 GLN HA A 41 LYS H 1.0 . 2.93 191 168 A 27 CYS H A 26 VAL HA 1.0 . 3.48 192 169 A 19 VAL H A 26 VAL HA 1.0 . 5.20 193 170 A 46 THR H A 45 VAL HA 1.0 . 3.51 194 171 A 17 ASP HA A 18 ARG H 1.0 . 3.18 195 172 A 14 ALA HA A 15 VAL H 1.0 . 3.02 196 173 A 70 LYS HA A 71 VAL H 1.0 . 3.47 197 174 A 13 LEU HA A 14 ALA H 1.0 . 2.96 198 175 A 10 SER HA A 11 LEU H 1.0 . 3.51 199 176 A 12 GLN HA A 13 LEU H 1.0 . 3.50 200 177 A 27 CYS H A 20 VAL HA 1.0 . 4.31 201 178 A 56 VAL HA A 57 MET H 1.0 . 3.32 202 179 A 20 VAL HA A 21 TYR H 1.0 . 3.34 203 180 A 59 PRO HA A 44 PHE HD% 1.0 . 4.03 204 181 A 55 VAL H A 54 ALA HA 1.0 . 3.21 205 182 A 43 THR HB A 43 THR H 1.0 . 3.33 206 183 A 9 ALA H A 8 SER HBx 1.0 . 3.76 207 183 A 8 SER HBy A 9 ALA H 1.0 . 3.76 208 184 A 22 PRO HDx A 21 TYR HD% 1.0 . 4.24 209 185 A 33 ASP H A 44 PHE HBy 1.0 . 5.50 210 186 A 14 ALA H A 17 ASP HBy 1.0 . 3.73 211 187 A 18 ARG H A 17 ASP HBy 1.0 . 3.62 212 188 A 17 ASP H A 17 ASP HBy 1.0 . 3.78 213 189 A 27 CYS H A 27 CYS HBx 1.0 . 3.18 214 190 A 27 CYS HBx A 28 ARG H 1.0 . 3.97 215 191 A 21 TYR HE% A 22 PRO HDy 1.0 . 5.50 216 192 A 34 VAL H A 33 ASP HBx 1.0 . 4.33 217 193 A 29 VAL H A 29 VAL HB 1.0 . 3.36 218 194 A 17 ASP HBx A 18 ARG H 1.0 . 4.60 219 195 A 17 ASP HBx A 17 ASP H 1.0 . 3.61 220 196 A 30 SER H A 29 VAL HB 1.0 . 4.39 221 197 A 20 VAL H A 5 PRO HBy 1.0 . 5.50 222 198 A 12 GLN H A 12 GLN HGx 1.0 . 4.36 223 198 A 12 GLN H A 12 GLN HGy 1.0 . 4.36 224 199 A 51 GLU H A 51 GLU HGy 1.0 . 4.65 225 200 A 49 ARG HE A 49 ARG HBy 1.0 . 4.56 226 201 A 54 ALA H A 49 ARG HBy 1.0 . 4.80 227 202 A 47 MET H A 47 MET HGx 1.0 . 3.68 228 202 A 47 MET H A 47 MET HGy 1.0 . 3.68 229 203 A 65 ALA H A 63 VAL HB 1.0 . 5.40 230 204 A 51 GLU H A 51 GLU HBy 1.0 . 3.95 231 205 A 45 VAL H A 45 VAL HB 1.0 . 4.04 232 206 A 63 VAL H A 59 PRO HGx 1.0 . 5.50 233 207 A 12 GLN H A 12 GLN HBy 1.0 . 3.98 234 208 A 49 ARG HE A 49 ARG HBx 1.0 . 4.56 235 209 A 54 ALA H A 49 ARG HBx 1.0 . 4.80 236 210 A 59 PRO HBy A 44 PHE HE% 1.0 . 2.89 237 211 A 51 GLU H A 50 GLU HBy 1.0 . 5.01 238 212 A 71 VAL HB A 72 ALA H 1.0 . 4.28 239 213 A 71 VAL HB A 74 ALA H 1.0 . 4.06 240 214 A 71 VAL HB A 73 SER H 1.0 . 5.14 241 215 A 42 LEU H A 34 VAL HB 1.0 . 5.50 242 216 A 12 GLN H A 12 GLN HBx 1.0 . 3.98 243 217 A 21 TYR HD% A 24 GLN HGx 1.0 . 4.18 244 218 A 21 TYR HD% A 68 VAL HB 1.0 . 4.71 245 219 A 51 GLU H A 50 GLU HBx 1.0 . 5.01 246 220 A 36 GLU HGy A 41 LYS H 1.0 . 4.43 247 221 A 36 GLU H A 36 GLU HBy 1.0 . 3.23 248 222 A 66 ILE HB A 68 VAL H 1.0 . 4.17 249 223 A 20 VAL H A 19 VAL HB 1.0 . 5.50 250 224 A 36 GLU HGy A 37 VAL H 1.0 . 5.50 251 225 A 40 GLN H A 36 GLU HBy 1.0 . 4.90 252 226 A 68 VAL HB A 69 ARG H 1.0 . 5.07 253 227 A 59 PRO HGy A 44 PHE HE% 1.0 . 3.73 254 228 A 15 VAL H A 15 VAL HB 1.0 . 3.12 255 229 A 63 VAL H A 59 PRO HBx 1.0 . 4.71 256 230 A 49 ARG H A 49 ARG HGx 1.0 . 4.05 257 230 A 49 ARG HGy A 49 ARG H 1.0 . 4.05 258 231 A 51 GLU H A 51 GLU HBx 1.0 . 3.95 259 232 A 52 ASP H A 51 GLU HBx 1.0 . 4.11 260 233 A 35 LYS H A 35 LYS HBy 1.0 . 4.00 261 234 A 41 LYS H A 41 LYS HBy 1.0 . 3.81 262 235 A 18 ARG H A 18 ARG HBx 1.0 . 3.63 263 235 A 18 ARG H A 18 ARG HBy 1.0 . 3.63 264 236 A 42 LEU HBy A 43 THR H 1.0 . 4.32 265 237 A 64 LEU HG A 64 LEU H 1.0 . 3.58 266 238 A 65 ALA H A 64 LEU HBy 1.0 . 5.24 267 239 A 65 ALA H A 64 LEU HG 1.0 . 5.24 268 240 A 62 LYS H A 62 LYS HDx 1.0 . 4.89 269 240 A 62 LYS HDy A 62 LYS H 1.0 . 4.89 270 241 A 44 PHE HZ A 62 LYS HDx 1.0 . 4.27 271 241 A 44 PHE HZ A 62 LYS HDy 1.0 . 4.27 272 242 A 44 PHE HE% A 62 LYS HDx 1.0 . 3.87 273 242 A 62 LYS HDy A 44 PHE HE% 1.0 . 3.87 274 243 A 35 LYS HBx A 36 GLU H 1.0 . 3.05 275 244 A 48 ARG H A 48 ARG HBx 1.0 . 3.69 276 244 A 48 ARG H A 48 ARG HBy 1.0 . 3.69 277 245 A 65 ALA H A 64 LEU HBx 1.0 . 5.24 278 246 A 41 LYS H A 41 LYS HBx 1.0 . 3.81 279 247 A 42 LEU H A 42 LEU HG 1.0 . 3.78 280 248 A 28 ARG H A 28 ARG HGx 1.0 . 5.03 281 248 A 28 ARG H A 28 ARG HGy 1.0 . 5.03 282 249 A 29 VAL H A 28 ARG HGx 1.0 . 4.66 283 249 A 29 VAL H A 28 ARG HGy 1.0 . 4.66 284 250 A 39 GLY H A 38 ALA HB% 1.0 . 3.79 285 251 A 74 ALA HB% A 75 GLU H 1.0 . 3.97 286 252 A 74 ALA HB% A 74 ALA H 1.0 . 3.65 287 253 A 42 LEU HBx A 43 THR H 1.0 . 4.26 288 254 A 54 ALA H A 54 ALA HB% 1.0 . 3.40 289 255 A 55 VAL H A 54 ALA HB% 1.0 . 3.40 290 256 A 44 PHE HZ A 42 LEU HBx 1.0 . 5.50 291 257 A 14 ALA HB% A 14 ALA H 1.0 . 3.11 292 258 A 14 ALA HB% A 15 VAL H 1.0 . 3.22 293 259 A 14 ALA HB% A 17 ASP H 1.0 . 5.04 294 260 A 35 LYS H A 35 LYS HGx 1.0 . 3.98 295 261 A 44 PHE HE% A 35 LYS HGx 1.0 . 4.09 296 262 A 47 MET H A 46 THR HG2% 1.0 . 3.86 297 263 A 31 ALA H A 46 THR HG2% 1.0 . 4.75 298 264 A 46 THR H A 46 THR HG2% 1.0 . 4.05 299 265 A 33 ASP H A 43 THR HG2% 1.0 . 4.53 300 266 A 26 VAL H A 26 VAL HGy% 1.0 . 4.78 301 267 A 63 VAL HGy% A 64 LEU H 1.0 . 5.18 302 268 A 63 VAL H A 63 VAL HGy% 1.0 . 3.33 303 269 A 38 ALA H A 37 VAL HGx% 1.0 . 5.14 304 269 A 37 VAL HGy% A 38 ALA H 1.0 . 5.14 305 270 A 58 VAL HGx% A 57 MET H 1.0 . 3.81 306 271 A 55 VAL H A 55 VAL HGy% 1.0 . 3.51 307 272 A 40 GLN H A 37 VAL HGx% 1.0 . 4.04 308 272 A 40 GLN H A 37 VAL HGy% 1.0 . 4.04 309 273 A 21 TYR HD% A 58 VAL HGx% 1.0 . 4.63 310 274 A 44 PHE HD% A 37 VAL HGx% 1.0 . 5.12 311 274 A 37 VAL HGy% A 44 PHE HD% 1.0 . 5.12 312 275 A 32 ILE HG1y A 32 ILE H 1.0 . 3.32 313 276 A 42 LEU HDy% A 44 PHE HE% 1.0 . 3.22 314 277 A 31 ALA H A 29 VAL HGy% 1.0 . 5.38 315 278 A 44 PHE HZ A 42 LEU HDy% 1.0 . 4.12 316 279 A 20 VAL H A 20 VAL HGy% 1.0 . 4.07 317 280 A 27 CYS H A 26 VAL HGx% 1.0 . 4.11 318 281 A 42 LEU H A 42 LEU HDx% 1.0 . 4.33 319 282 A 63 VAL HGx% A 64 LEU H 1.0 . 5.50 320 283 A 45 VAL H A 45 VAL HGx% 1.0 . 4.06 321 284 A 42 LEU HDx% A 43 THR H 1.0 . 5.01 322 285 A 20 VAL H A 20 VAL HGx% 1.0 . 4.07 323 286 A 34 VAL H A 34 VAL HGx% 1.0 . 4.95 324 287 A 69 ARG H A 68 VAL HGx% 1.0 . 4.12 325 287 A 68 VAL HGy% A 69 ARG H 1.0 . 4.12 326 288 A 66 ILE HG2% A 66 ILE H 1.0 . 3.89 327 289 A 68 VAL H A 68 VAL HGx% 1.0 . 3.76 328 289 A 68 VAL HGy% A 68 VAL H 1.0 . 3.76 329 290 A 21 TYR HD% A 68 VAL HGx% 1.0 . 3.84 330 290 A 21 TYR HD% A 68 VAL HGy% 1.0 . 3.84 331 291 A 21 TYR H A 20 VAL HGx% 1.0 . 5.50 332 292 A 30 SER H A 29 VAL HGx% 1.0 . 3.79 333 293 A 29 VAL H A 29 VAL HGx% 1.0 . 4.05 334 294 A 46 THR H A 29 VAL HGx% 1.0 . 4.40 335 295 A 31 ALA H A 29 VAL HGx% 1.0 . 4.11 336 296 A 32 ILE HG2% A 32 ILE H 1.0 . 4.00 337 297 A 33 ASP H A 32 ILE HG2% 1.0 . 3.95 338 298 A 32 ILE HD1% A 15 VAL H 1.0 . 3.88 339 299 A 56 VAL H A 56 VAL HGy% 1.0 . 4.33 340 300 A 21 TYR HD% A 56 VAL HGy% 1.0 . 5.50 341 301 A 19 VAL H A 19 VAL HGx% 1.0 . 4.56 342 302 A 20 VAL H A 19 VAL HGx% 1.0 . 5.41 343 303 A 21 TYR HE% A 56 VAL HGx% 1.0 . 4.99 344 304 A 44 PHE H A 44 PHE HBy 1.0 . 3.72 345 305 A 44 PHE H A 44 PHE HBx 1.0 . 4.19 346 306 A 44 PHE H A 43 THR HG2% 1.0 . 3.65 347 307 A 49 ARG H A 54 ALA HB% 1.0 . 4.08 348 308 A 47 MET H A 47 MET HBy 1.0 . 4.10 349 309 A 45 VAL H A 45 VAL HGy% 1.0 . 3.80 350 310 A 35 LYS H A 34 VAL HB 1.0 . 4.44 351 311 A 35 LYS H A 34 VAL HGy% 1.0 . 3.99 352 312 A 35 LYS H A 35 LYS HBx 1.0 . 3.99 353 313 A 35 LYS H A 35 LYS HGy 1.0 . 3.98 354 314 A 35 LYS H A 34 VAL HGx% 1.0 . 3.99 355 315 A 29 VAL H A 29 VAL HGy% 1.0 . 3.26 356 316 A 19 VAL H A 19 VAL HGy% 1.0 . 4.56 357 317 A 15 VAL HGy% A 16 GLY H 1.0 . 4.27 358 318 A 15 VAL HA A 16 GLY H 1.0 . 3.01 359 319 A 16 GLY H A 29 VAL HB 1.0 . 3.55 360 320 A 29 VAL HGx% A 16 GLY H 1.0 . 3.58 361 321 A 15 VAL HGx% A 16 GLY H 1.0 . 3.21 362 322 A 20 VAL H A 5 PRO HBx 1.0 . 5.50 363 323 A 20 VAL H A 19 VAL HGy% 1.0 . 5.41 364 324 A 37 VAL H A 36 GLU HBy 1.0 . 5.50 365 325 A 42 LEU HG A 37 VAL H 1.0 . 5.50 366 326 A 37 VAL H A 37 VAL HGx% 1.0 . 3.19 367 326 A 37 VAL HGy% A 37 VAL H 1.0 . 3.19 368 327 A 36 GLU HGx A 37 VAL H 1.0 . 5.50 369 328 A 50 GLU H A 49 ARG HGx 1.0 . 5.50 370 328 A 49 ARG HGy A 50 GLU H 1.0 . 5.50 371 329 A 59 PRO HBx A 61 GLY H 1.0 . 5.50 372 330 A 58 VAL H A 58 VAL HGy% 1.0 . 3.77 373 331 A 14 ALA H A 13 LEU HDy% 1.0 . 4.21 374 332 A 14 ALA H A 13 LEU HDx% 1.0 . 4.21 375 333 A 34 VAL H A 33 ASP HBy 1.0 . 4.33 376 334 A 34 VAL H A 34 VAL HB 1.0 . 3.85 377 335 A 42 LEU HDx% A 60 GLU H 1.0 . 4.44 378 336 A 42 LEU HG A 60 GLU H 1.0 . 4.90 379 337 A 15 VAL HGy% A 15 VAL H 1.0 . 3.12 380 338 A 43 THR HG2% A 43 THR H 1.0 . 3.81 381 339 A 9 ALA H A 9 ALA HB% 1.0 . 3.23 382 340 A 32 ILE H A 32 ILE HB 1.0 . 3.11 383 341 A 15 VAL HGy% A 32 ILE H 1.0 . 3.98 384 342 A 32 ILE HD1% A 32 ILE H 1.0 . 5.01 385 343 A 55 VAL H A 55 VAL HB 1.0 . 3.86 386 344 A 55 VAL H A 55 VAL HGx% 1.0 . 3.51 387 345 A 13 LEU H A 13 LEU HBy 1.0 . 3.54 388 346 A 13 LEU H A 13 LEU HBx 1.0 . 3.54 389 347 A 15 VAL HA A 17 ASP H 1.0 . 3.72 390 348 A 17 ASP H A 29 VAL HB 1.0 . 3.75 391 349 A 29 VAL HGy% A 17 ASP H 1.0 . 3.56 392 350 A 29 VAL HGx% A 17 ASP H 1.0 . 4.52 393 351 A 49 ARG HE A 54 ALA HB% 1.0 . 3.87 394 352 A 63 VAL HB A 64 LEU H 1.0 . 3.65 395 353 A 64 LEU HDx% A 64 LEU H 1.0 . 4.07 396 354 A 40 GLN H A 36 GLU HGx 1.0 . 3.56 397 355 A 66 ILE HB A 66 ILE H 1.0 . 3.40 398 356 A 59 PRO HGy A 66 ILE H 1.0 . 5.45 399 357 A 66 ILE H A 65 ALA HB% 1.0 . 4.08 400 358 A 66 ILE HD1% A 66 ILE H 1.0 . 3.70 401 359 A 65 ALA H A 65 ALA HB% 1.0 . 3.61 402 360 A 63 VAL HGx% A 68 VAL H 1.0 . 4.29 403 361 A 59 PRO HBx A 62 LYS H 1.0 . 3.93 404 362 A 63 VAL H A 63 VAL HB 1.0 . 3.59 405 363 A 63 VAL H A 63 VAL HGx% 1.0 . 4.01 406 364 A 44 PHE HZ A 37 VAL HGx% 1.0 . 3.48 407 364 A 37 VAL HGy% A 44 PHE HZ 1.0 . 3.48 408 365 A 44 PHE HD% A 34 VAL HB 1.0 . 5.26 409 366 A 21 TYR HE% A 58 VAL HGx% 1.0 . 3.88 410 367 A 21 TYR HE% A 68 VAL HGx% 1.0 . 5.50 411 367 A 21 TYR HE% A 68 VAL HGy% 1.0 . 5.50 412 368 A 21 TYR HE% A 58 VAL HGy% 1.0 . 3.35 413 369 A 44 PHE H A 43 THR HB 1.0 . 4.38 414 370 A 46 THR H A 46 THR HB 1.0 . 3.62 415 371 A 37 VAL HA A 39 GLY H 1.0 . 4.45 416 372 A 71 VAL H A 75 GLU HA 1.0 . 4.73 417 373 A 31 ALA H A 29 VAL HA 1.0 . 4.18 418 374 A 68 VAL HA A 69 ARG H 1.0 . 3.52 419 375 A 28 ARG HA A 29 VAL HGy% 1.0 . 4.52 420 376 A 33 ASP HA A 32 ILE HB 1.0 . 4.78 421 377 A 46 THR HA A 46 THR HG2% 1.0 . 3.80 422 378 A 44 PHE HA A 44 PHE HBy 1.0 . 2.60 423 379 A 69 ARG HA A 69 ARG HDx 1.0 . 4.27 424 379 A 69 ARG HA A 69 ARG HDy 1.0 . 4.27 425 380 A 36 GLU HGy A 35 LYS HA 1.0 . 5.50 426 381 A 55 VAL HA A 55 VAL HB 1.0 . 2.67 427 382 A 35 LYS HA A 35 LYS HBy 1.0 . 2.73 428 383 A 32 ILE HG1x A 32 ILE HA 1.0 . 2.75 429 384 A 42 LEU HDy% A 42 LEU HA 1.0 . 5.50 430 385 A 32 ILE HG1x A 45 VAL HA 1.0 . 5.50 431 386 A 15 VAL HA A 14 ALA HA 1.0 . 4.43 432 387 A 62 LYS HA A 42 LEU HDy% 1.0 . 5.50 433 388 A 62 LYS HA A 65 ALA HB% 1.0 . 3.96 434 389 A 37 VAL HA A 38 ALA HB% 1.0 . 4.38 435 390 A 66 ILE HA A 66 ILE HD1% 1.0 . 3.87 436 391 A 42 LEU HDx% A 43 THR HB 1.0 . 3.65 437 392 A 60 GLU HA A 45 VAL HGx% 1.0 . 3.86 438 393 A 60 GLU HA A 43 THR HG2% 1.0 . 5.50 439 394 A 63 VAL HA A 66 ILE HD1% 1.0 . 3.39 440 395 A 18 ARG HBy A 18 ARG HDx 1.0 . 2.61 441 395 A 18 ARG HBx A 18 ARG HDx 1.0 . 2.61 442 395 A 18 ARG HDy A 18 ARG HBx 1.0 . 2.61 443 395 A 18 ARG HBy A 18 ARG HDy 1.0 . 2.61 444 396 A 74 ALA HB% A 69 ARG HDx 1.0 . 5.50 445 396 A 74 ALA HB% A 69 ARG HDy 1.0 . 5.50 446 397 A 15 VAL HA A 29 VAL HB 1.0 . 3.31 447 398 A 15 VAL HGy% A 29 VAL HB 1.0 . 5.50 448 399 A 32 ILE HD1% A 45 VAL HB 1.0 . 5.50 449 400 A 59 PRO HGx A 66 ILE HD1% 1.0 . 5.50 450 401 A 59 PRO HBy A 42 LEU HG 1.0 . 3.80 451 402 A 19 VAL HB A 13 LEU HDy% 1.0 . 5.50 452 403 A 59 PRO HGy A 66 ILE HD1% 1.0 . 5.50 453 404 A 32 ILE HD1% A 15 VAL HB 1.0 . 5.50 454 405 A 36 GLU HGx A 36 GLU HBx 1.0 . 3.00 455 406 A 42 LEU HDx% A 59 PRO HBx 1.0 . 5.50 456 407 A 42 LEU HBy A 37 VAL HGx% 1.0 . 5.50 457 407 A 37 VAL HGy% A 42 LEU HBy 1.0 . 5.50 458 408 A 59 PRO HBx A 62 LYS HDx 1.0 . 3.34 459 408 A 59 PRO HBx A 62 LYS HDy 1.0 . 3.34 460 409 A 15 VAL HGy% A 32 ILE HB 1.0 . 5.50 461 410 A 29 VAL HGy% A 13 LEU HG 1.0 . 5.50 462 411 A 71 VAL HB A 74 ALA HB% 1.0 . 2.72 463 412 A 32 ILE HG2% A 32 ILE HG1x 1.0 . 3.13 464 413 A 42 LEU HDx% A 42 LEU HBx 1.0 . 3.60 465 414 A 14 ALA HB% A 15 VAL HB 1.0 . 4.13 466 415 A 43 THR HB A 60 GLU HGx 1.0 . 4.69 467 416 A 37 VAL HA A 37 VAL HB 1.0 . 2.55 468 417 A 39 GLY HAy A 36 GLU HBy 1.0 . 4.68 469 418 A 42 LEU HDx% A 61 GLY HAx 1.0 . 4.00 470 418 A 42 LEU HDx% A 61 GLY HAy 1.0 . 4.00 471 419 A 29 VAL HGy% A 47 MET HGx 1.0 . 4.12 472 419 A 29 VAL HGy% A 47 MET HGy 1.0 . 4.12 473 420 A 63 VAL HGx% A 66 ILE HD1% 1.0 . 3.30 474 421 A 52 ASP H A 51 GLU HBy 1.0 . 4.11 475 422 A 15 VAL HGx% A 15 VAL H 1.0 . 4.08 476 423 A 16 GLY H A 15 VAL HB 1.0 . 5.50 477 424 A 45 VAL H A 44 PHE HBx 1.0 . 4.42 478 425 A 31 ALA HB% A 32 ILE H 1.0 . 3.78 479 426 A 33 ASP H A 45 VAL HA 1.0 . 3.94 480 427 A 17 ASP HBx A 14 ALA H 1.0 . 4.16 481 428 A 11 LEU H A 11 LEU HG 1.0 . 5.50 482 429 A 69 ARG H A 69 ARG HGx 1.0 . 4.76 483 429 A 69 ARG H A 69 ARG HGy 1.0 . 4.76 484 430 A 30 SER H A 29 VAL HGy% 1.0 . 4.06 485 431 A 27 CYS H A 26 VAL HGy% 1.0 . 4.11 486 432 A 47 MET H A 29 VAL HA 1.0 . 5.40 487 433 A 47 MET H A 46 THR HB 1.0 . 5.50 488 434 A 43 THR HA A 44 PHE HBx 1.0 . 4.76 489 435 A 30 SER H A 47 MET HGx 1.0 . 4.97 490 435 A 30 SER H A 47 MET HGy 1.0 . 4.97 491 436 A 27 CYS HBy A 28 ARG H 1.0 . 3.82 492 437 A 47 MET H A 47 MET HBx 1.0 . 4.10 493 438 A 36 GLU HGx A 36 GLU H 1.0 . 4.49 494 439 A 29 VAL HA A 48 ARG H 1.0 . 5.09 495 440 A 21 TYR H A 20 VAL HGy% 1.0 . 5.50 496 441 A 26 VAL H A 26 VAL HGx% 1.0 . 4.78 497 442 A 34 VAL H A 34 VAL HGy% 1.0 . 4.95 498 443 A 21 TYR HD% A 56 VAL HGx% 1.0 . 5.50 499 444 A 56 VAL H A 56 VAL HGx% 1.0 . 4.33 500 445 A 42 LEU H A 42 LEU HDy% 1.0 . 5.50 501 446 A 42 LEU HDy% A 61 GLY H 1.0 . 5.50 502 447 A 42 LEU HG A 43 THR H 1.0 . 5.05 503 448 A 13 LEU H A 13 LEU HDx% 1.0 . 5.50 504 449 A 13 LEU H A 13 LEU HDy% 1.0 . 5.50 505 450 A 12 GLN HA A 12 GLN HGx 1.0 . 2.79 506 450 A 12 GLN HA A 12 GLN HGy 1.0 . 2.79 507 451 A 21 TYR HE% A 58 VAL HB 1.0 . 4.82 508 452 A 35 LYS HA A 44 PHE HD% 1.0 . 4.92 509 453 A 59 PRO HA A 44 PHE HE% 1.0 . 3.60 510 454 A 42 LEU HDx% A 44 PHE HE% 1.0 . 4.09 511 455 A 42 LEU HDx% A 44 PHE HZ 1.0 . 4.13 512 456 A 42 LEU HG A 44 PHE HE% 1.0 . 4.58 513 457 A 11 LEU H A 11 LEU HDy% 1.0 . 4.69 514 458 A 11 LEU H A 11 LEU HDx% 1.0 . 4.69 515 459 A 64 LEU HDy% A 64 LEU H 1.0 . 5.50 516 460 A 64 LEU HA A 64 LEU HDx% 1.0 . 5.50 517 461 A 36 GLU H A 35 LYS HBy 1.0 . 5.50 518 462 A 15 VAL HA A 14 ALA HB% 1.0 . 4.57 519 463 A 36 GLU HGx A 41 LYS H 1.0 . 4.04 520 464 A 49 ARG HA A 50 GLU H 1.0 . 3.09 521 465 A 51 GLU H A 51 GLU HGx 1.0 . 4.65 522 466 A 63 VAL HGy% A 63 VAL HA 1.0 . 3.41 523 467 A 68 VAL HA A 68 VAL HGx% 1.0 . 3.30 524 467 A 68 VAL HA A 68 VAL HGy% 1.0 . 3.30 525 468 A 71 VAL HA A 71 VAL HGx% 1.0 . 3.10 526 469 A 55 VAL HA A 55 VAL HGy% 1.0 . 3.67 527 470 A 55 VAL HA A 55 VAL HGx% 1.0 . 3.67 528 471 A 45 VAL HGy% A 45 VAL HA 1.0 . 3.64 529 472 A 58 VAL HA A 58 VAL HGx% 1.0 . 4.02 530 473 A 58 VAL HA A 58 VAL HGy% 1.0 . 4.13 531 474 A 49 ARG HA A 49 ARG HGx 1.0 . 3.64 532 474 A 49 ARG HA A 49 ARG HGy 1.0 . 3.64 533 475 A 64 LEU HA A 64 LEU HDy% 1.0 . 3.46 534 476 A 62 LYS HA A 62 LYS HDx 1.0 . 4.32 535 476 A 62 LYS HA A 62 LYS HDy 1.0 . 4.32 536 477 A 11 LEU HA A 11 LEU HDx% 1.0 . 3.84 537 478 A 18 ARG HA A 18 ARG HGx 1.0 . 3.92 538 478 A 18 ARG HA A 18 ARG HGy 1.0 . 3.92 539 479 A 40 GLN HA A 40 GLN HGx 1.0 . 4.03 540 480 A 42 LEU HDx% A 42 LEU HA 1.0 . 3.51 541 481 A 28 ARG HA A 18 ARG HDx 1.0 . 5.03 542 481 A 28 ARG HA A 18 ARG HDy 1.0 . 5.03 543 482 A 47 MET HA A 47 MET HGx 1.0 . 3.90 544 482 A 47 MET HA A 47 MET HGy 1.0 . 3.90 545 483 A 15 VAL HGy% A 31 ALA HA 1.0 . 3.42 546 484 A 58 VAL HA A 59 PRO HDx 1.0 . 3.46 547 485 A 32 ILE HD1% A 14 ALA HA 1.0 . 3.75 548 486 A 42 LEU HDy% A 42 LEU HBy 1.0 . 3.75 549 487 A 42 LEU HDy% A 42 LEU HBx 1.0 . 3.32 550 488 A 64 LEU HDy% A 69 ARG HDx 1.0 . 3.98 551 488 A 64 LEU HDy% A 69 ARG HDy 1.0 . 3.98 552 489 A 66 ILE HB A 68 VAL HGx% 1.0 . 5.50 553 489 A 68 VAL HGy% A 66 ILE HB 1.0 . 5.50 554 490 A 36 GLU HA A 36 GLU HGx 1.0 . 2.77 555 491 A 27 CYS HA A 27 CYS HBy 1.0 . 2.86 556 492 A 36 GLU HA A 36 GLU HBy 1.0 . 3.00 557 493 A 42 LEU HDy% A 62 LYS HDx 1.0 . 5.50 558 493 A 42 LEU HDy% A 62 LYS HDy 1.0 . 5.50 559 494 A 59 PRO HBy A 42 LEU HDy% 1.0 . 5.50 560 495 A 56 VAL HA A 56 VAL HGy% 1.0 . 4.01 561 496 A 38 ALA HB% A 37 VAL HGx% 1.0 . 3.68 562 496 A 37 VAL HGy% A 38 ALA HB% 1.0 . 3.68 563 497 A 32 ILE HD1% A 32 ILE HB 1.0 . 3.70 564 498 A 66 ILE HB A 63 VAL HA 1.0 . 3.73 565 499 A 36 GLU HA A 36 GLU HGy 1.0 . 3.20 566 500 A 22 PRO HDy A 68 VAL HGx% 1.0 . 3.53 567 500 A 68 VAL HGy% A 22 PRO HDy 1.0 . 3.53 568 501 A 20 VAL HA A 20 VAL HGx% 1.0 . 3.75 569 502 A 29 VAL HGx% A 32 ILE HG1x 1.0 . 5.50 570 503 A 32 ILE HG2% A 45 VAL HA 1.0 . 2.83 571 504 A 32 ILE HG1y A 32 ILE HA 1.0 . 3.56 572 505 A 21 TYR HA A 68 VAL HGx% 1.0 . 3.94 573 505 A 21 TYR HA A 68 VAL HGy% 1.0 . 3.94 574 506 A 11 LEU HA A 11 LEU HDy% 1.0 . 3.84 575 507 A 64 LEU HDx% A 64 LEU HBy 1.0 . 3.63 576 508 A 64 LEU HDx% A 64 LEU HBx 1.0 . 3.63 577 509 A 62 LYS HEy A 62 LYS HGy 1.0 . 4.16 578 509 A 62 LYS HEx A 62 LYS HGy 1.0 . 4.16 579 510 A 70 LYS HA A 70 LYS HEx 1.0 . 4.77 580 510 A 70 LYS HA A 70 LYS HEy 1.0 . 4.77 581 511 A 62 LYS HGx A 62 LYS HEx 1.0 . 4.16 582 511 A 62 LYS HEy A 62 LYS HGx 1.0 . 4.16 583 512 A 22 PRO HA A 68 VAL HGx% 1.0 . 5.39 584 512 A 68 VAL HGy% A 22 PRO HA 1.0 . 5.39 585 513 A 28 ARG HA A 28 ARG HGx 1.0 . 3.09 586 513 A 28 ARG HA A 28 ARG HGy 1.0 . 3.09 587 514 A 19 VAL HB A 13 LEU HDx% 1.0 . 5.50 588 515 A 4 MET HA A 4 MET HGx 1.0 . 3.64 589 515 A 4 MET HA A 4 MET HGy 1.0 . 3.64 590 516 A 4 MET HA A 5 PRO HDx 1.0 . 2.46 591 516 A 4 MET HA A 5 PRO HDy 1.0 . 2.46 592 517 A 4 MET HBy A 5 PRO HDx 1.0 . 4.76 593 517 A 5 PRO HDy A 4 MET HBx 1.0 . 4.76 594 517 A 5 PRO HDy A 4 MET HBy 1.0 . 4.76 595 517 A 4 MET HBx A 5 PRO HDx 1.0 . 4.76 596 518 A 5 PRO HBy A 18 ARG HDx 1.0 . 4.26 597 518 A 5 PRO HBx A 18 ARG HDx 1.0 . 4.26 598 518 A 18 ARG HDy A 5 PRO HBy 1.0 . 4.26 599 518 A 18 ARG HDy A 5 PRO HBx 1.0 . 4.26 600 519 A 19 VAL H A 5 PRO HBy 1.0 . 5.34 601 519 A 19 VAL H A 5 PRO HBx 1.0 . 5.34 602 520 A 5 PRO HBx A 19 VAL HGy% 1.0 . 5.28 603 520 A 5 PRO HBy A 19 VAL HGy% 1.0 . 5.28 604 520 A 19 VAL HGx% A 5 PRO HBy 1.0 . 5.28 605 520 A 5 PRO HBx A 19 VAL HGx% 1.0 . 5.28 606 521 A 20 VAL H A 5 PRO HBy 1.0 . 4.69 607 521 A 20 VAL H A 5 PRO HBx 1.0 . 4.69 608 522 A 20 VAL HA A 5 PRO HBy 1.0 . 5.29 609 522 A 20 VAL HA A 5 PRO HBx 1.0 . 5.29 610 523 A 20 VAL H A 5 PRO HGx 1.0 . 5.18 611 523 A 20 VAL H A 5 PRO HGy 1.0 . 5.18 612 524 A 5 PRO HGy A 26 VAL HGy% 1.0 . 5.28 613 524 A 5 PRO HGx A 26 VAL HGy% 1.0 . 5.28 614 524 A 26 VAL HGx% A 5 PRO HGx 1.0 . 5.28 615 524 A 5 PRO HGy A 26 VAL HGx% 1.0 . 5.28 616 525 A 26 VAL HB A 5 PRO HDx 1.0 . 5.35 617 525 A 5 PRO HDy A 26 VAL HB 1.0 . 5.35 618 526 A 9 ALA HB% A 11 LEU HDy% 1.0 . 5.44 619 526 A 9 ALA HB% A 11 LEU HDx% 1.0 . 5.44 620 527 A 10 SER HA A 11 LEU HDy% 1.0 . 3.55 621 527 A 10 SER HA A 11 LEU HDx% 1.0 . 3.55 622 528 A 10 SER HBy A 11 LEU HDy% 1.0 . 4.25 623 528 A 10 SER HBx A 11 LEU HDy% 1.0 . 4.25 624 528 A 11 LEU HDx% A 10 SER HBx 1.0 . 4.25 625 528 A 11 LEU HDx% A 10 SER HBy 1.0 . 4.25 626 529 A 11 LEU H A 11 LEU HBx 1.0 . 3.51 627 529 A 11 LEU H A 11 LEU HBy 1.0 . 3.51 628 530 A 11 LEU H A 11 LEU HDy% 1.0 . 4.05 629 530 A 11 LEU H A 11 LEU HDx% 1.0 . 4.05 630 531 A 11 LEU HA A 11 LEU HDy% 1.0 . 3.10 631 531 A 11 LEU HA A 11 LEU HDx% 1.0 . 3.10 632 532 A 11 LEU HBy A 11 LEU HDy% 1.0 . 2.61 633 532 A 11 LEU HDx% A 11 LEU HBx 1.0 . 2.61 634 532 A 11 LEU HDx% A 11 LEU HBy 1.0 . 2.61 635 532 A 11 LEU HBx A 11 LEU HDy% 1.0 . 2.61 636 533 A 12 GLN H A 12 GLN HBx 1.0 . 3.25 637 533 A 12 GLN H A 12 GLN HBy 1.0 . 3.25 638 534 A 13 LEU H A 13 LEU HBy 1.0 . 3.05 639 534 A 13 LEU H A 13 LEU HBx 1.0 . 3.05 640 535 A 13 LEU HA A 13 LEU HDy% 1.0 . 3.22 641 535 A 13 LEU HA A 13 LEU HDx% 1.0 . 3.22 642 536 A 13 LEU HBx A 13 LEU HDy% 1.0 . 2.77 643 536 A 13 LEU HBy A 13 LEU HDy% 1.0 . 2.77 644 536 A 13 LEU HDx% A 13 LEU HBy 1.0 . 2.77 645 536 A 13 LEU HBx A 13 LEU HDx% 1.0 . 2.77 646 537 A 14 ALA H A 13 LEU HBy 1.0 . 3.72 647 537 A 14 ALA H A 13 LEU HBx 1.0 . 3.72 648 538 A 29 VAL HGy% A 13 LEU HBy 1.0 . 5.34 649 538 A 29 VAL HGy% A 13 LEU HBx 1.0 . 5.34 650 539 A 32 ILE HD1% A 13 LEU HBy 1.0 . 5.34 651 539 A 32 ILE HD1% A 13 LEU HBx 1.0 . 5.34 652 540 A 13 LEU HBx A 70 LYS HBx 1.0 . 5.18 653 540 A 13 LEU HBy A 70 LYS HBx 1.0 . 5.18 654 540 A 70 LYS HBy A 13 LEU HBy 1.0 . 5.18 655 540 A 13 LEU HBx A 70 LYS HBy 1.0 . 5.18 656 541 A 13 LEU HG A 70 LYS HBx 1.0 . 5.34 657 541 A 13 LEU HG A 70 LYS HBy 1.0 . 5.34 658 542 A 14 ALA H A 13 LEU HDy% 1.0 . 3.67 659 542 A 14 ALA H A 13 LEU HDx% 1.0 . 3.67 660 543 A 17 ASP HBy A 13 LEU HDy% 1.0 . 4.25 661 543 A 17 ASP HBy A 13 LEU HDx% 1.0 . 4.25 662 544 A 19 VAL HA A 13 LEU HDy% 1.0 . 4.00 663 544 A 19 VAL HA A 13 LEU HDx% 1.0 . 4.00 664 545 A 13 LEU HDx% A 19 VAL HGy% 1.0 . 5.37 665 545 A 19 VAL HGx% A 13 LEU HDy% 1.0 . 5.37 666 545 A 19 VAL HGx% A 13 LEU HDx% 1.0 . 5.37 667 545 A 13 LEU HDy% A 19 VAL HGy% 1.0 . 5.37 668 546 A 29 VAL HGx% A 13 LEU HDy% 1.0 . 5.44 669 546 A 29 VAL HGx% A 13 LEU HDx% 1.0 . 5.44 670 547 A 32 ILE HD1% A 13 LEU HDy% 1.0 . 5.44 671 547 A 32 ILE HD1% A 13 LEU HDx% 1.0 . 5.44 672 548 A 13 LEU HDx% A 70 LYS HBx 1.0 . 5.28 673 548 A 13 LEU HDy% A 70 LYS HBx 1.0 . 5.28 674 548 A 70 LYS HBy A 13 LEU HDy% 1.0 . 5.28 675 548 A 13 LEU HDx% A 70 LYS HBy 1.0 . 5.28 676 549 A 13 LEU HDx% A 70 LYS HGx 1.0 . 5.28 677 549 A 13 LEU HDy% A 70 LYS HGx 1.0 . 5.28 678 549 A 70 LYS HGy A 13 LEU HDy% 1.0 . 5.28 679 549 A 13 LEU HDx% A 70 LYS HGy 1.0 . 5.28 680 550 A 71 VAL HA A 13 LEU HDy% 1.0 . 5.44 681 550 A 71 VAL HA A 13 LEU HDx% 1.0 . 5.44 682 551 A 19 VAL H A 19 VAL HGy% 1.0 . 3.37 683 551 A 19 VAL H A 19 VAL HGx% 1.0 . 3.37 684 552 A 19 VAL H A 26 VAL HGy% 1.0 . 5.44 685 552 A 19 VAL H A 26 VAL HGx% 1.0 . 5.44 686 553 A 19 VAL HA A 70 LYS HBx 1.0 . 5.34 687 553 A 19 VAL HA A 70 LYS HBy 1.0 . 5.34 688 554 A 20 VAL H A 19 VAL HGy% 1.0 . 4.03 689 554 A 20 VAL H A 19 VAL HGx% 1.0 . 4.03 690 555 A 21 TYR HD% A 19 VAL HGy% 1.0 . 5.28 691 555 A 21 TYR HD% A 19 VAL HGx% 1.0 . 5.28 692 556 A 21 TYR HE% A 19 VAL HGy% 1.0 . 5.44 693 556 A 21 TYR HE% A 19 VAL HGx% 1.0 . 5.44 694 557 A 26 VAL HA A 19 VAL HGy% 1.0 . 4.42 695 557 A 26 VAL HA A 19 VAL HGx% 1.0 . 4.42 696 558 A 27 CYS H A 19 VAL HGy% 1.0 . 4.62 697 558 A 27 CYS H A 19 VAL HGx% 1.0 . 4.62 698 559 A 27 CYS HBx A 19 VAL HGy% 1.0 . 3.12 699 559 A 27 CYS HBx A 19 VAL HGx% 1.0 . 3.12 700 560 A 32 ILE HD1% A 19 VAL HGy% 1.0 . 5.44 701 560 A 32 ILE HD1% A 19 VAL HGx% 1.0 . 5.44 702 561 A 19 VAL HGx% A 68 VAL HGx% 1.0 . 5.44 703 561 A 19 VAL HGy% A 68 VAL HGx% 1.0 . 5.44 704 561 A 68 VAL HGy% A 19 VAL HGy% 1.0 . 5.44 705 561 A 68 VAL HGy% A 19 VAL HGx% 1.0 . 5.44 706 562 A 70 LYS HA A 19 VAL HGy% 1.0 . 3.05 707 562 A 70 LYS HA A 19 VAL HGx% 1.0 . 3.05 708 563 A 19 VAL HGy% A 70 LYS HBx 1.0 . 4.30 709 563 A 19 VAL HGx% A 70 LYS HBx 1.0 . 4.30 710 563 A 70 LYS HBy A 19 VAL HGy% 1.0 . 4.30 711 563 A 19 VAL HGx% A 70 LYS HBy 1.0 . 4.30 712 564 A 71 VAL H A 19 VAL HGy% 1.0 . 4.75 713 564 A 71 VAL H A 19 VAL HGx% 1.0 . 4.75 714 565 A 20 VAL H A 20 VAL HGy% 1.0 . 3.56 715 565 A 20 VAL H A 20 VAL HGx% 1.0 . 3.56 716 566 A 20 VAL HA A 26 VAL HGy% 1.0 . 3.85 717 566 A 20 VAL HA A 26 VAL HGx% 1.0 . 3.85 718 567 A 21 TYR H A 20 VAL HGy% 1.0 . 4.08 719 567 A 21 TYR H A 20 VAL HGx% 1.0 . 4.08 720 568 A 20 VAL HGx% A 25 GLY HAx 1.0 . 4.98 721 568 A 20 VAL HGy% A 25 GLY HAx 1.0 . 4.98 722 568 A 25 GLY HAy A 20 VAL HGy% 1.0 . 4.98 723 568 A 20 VAL HGx% A 25 GLY HAy 1.0 . 4.98 724 569 A 26 VAL HA A 20 VAL HGy% 1.0 . 5.44 725 569 A 26 VAL HA A 20 VAL HGx% 1.0 . 5.44 726 570 A 20 VAL HGy% A 26 VAL HGy% 1.0 . 4.54 727 570 A 26 VAL HGx% A 20 VAL HGy% 1.0 . 4.54 728 570 A 26 VAL HGx% A 20 VAL HGx% 1.0 . 4.54 729 570 A 20 VAL HGx% A 26 VAL HGy% 1.0 . 4.54 730 571 A 21 TYR H A 21 TYR HBx 1.0 . 3.69 731 571 A 21 TYR H A 21 TYR HBy 1.0 . 3.69 732 572 A 21 TYR HD% A 24 GLN HBx 1.0 . 4.21 733 572 A 21 TYR HD% A 24 GLN HBy 1.0 . 4.21 734 573 A 21 TYR HD% A 24 GLN HGy 1.0 . 3.56 735 573 A 21 TYR HD% A 24 GLN HGx 1.0 . 3.56 736 574 A 21 TYR HD% A 56 VAL HGy% 1.0 . 4.70 737 574 A 21 TYR HD% A 56 VAL HGx% 1.0 . 4.70 738 575 A 21 TYR HD% A 70 LYS HBx 1.0 . 4.89 739 575 A 21 TYR HD% A 70 LYS HBy 1.0 . 4.89 740 576 A 21 TYR HE% A 22 PRO HGx 1.0 . 5.35 741 576 A 21 TYR HE% A 22 PRO HGy 1.0 . 5.35 742 577 A 21 TYR HE% A 24 GLN HGy 1.0 . 3.83 743 577 A 21 TYR HE% A 24 GLN HGx 1.0 . 3.83 744 578 A 21 TYR HE% A 56 VAL HGy% 1.0 . 4.13 745 578 A 21 TYR HE% A 56 VAL HGx% 1.0 . 4.13 746 579 A 21 TYR HE% A 70 LYS HBx 1.0 . 4.98 747 579 A 21 TYR HE% A 70 LYS HBy 1.0 . 4.98 748 580 A 23 ASN HBy A 23 ASN HD2y 1.0 . 2.93 749 580 A 23 ASN HBx A 23 ASN HD2y 1.0 . 2.93 750 580 A 23 ASN HD2x A 23 ASN HBx 1.0 . 2.93 751 580 A 23 ASN HBy A 23 ASN HD2x 1.0 . 2.93 752 581 A 24 GLN H A 24 GLN HBx 1.0 . 3.64 753 581 A 24 GLN H A 24 GLN HBy 1.0 . 3.64 754 582 A 24 GLN H A 24 GLN HGy 1.0 . 4.59 755 582 A 24 GLN H A 24 GLN HGx 1.0 . 4.59 756 583 A 26 VAL H A 26 VAL HGy% 1.0 . 3.72 757 583 A 26 VAL H A 26 VAL HGx% 1.0 . 3.72 758 584 A 26 VAL HA A 26 VAL HGy% 1.0 . 2.98 759 584 A 26 VAL HA A 26 VAL HGx% 1.0 . 2.98 760 585 A 27 CYS HBy A 47 MET HBy 1.0 . 5.34 761 585 A 27 CYS HBy A 47 MET HBx 1.0 . 5.34 762 586 A 28 ARG HA A 28 ARG HDx 1.0 . 3.86 763 586 A 28 ARG HA A 28 ARG HDy 1.0 . 3.86 764 587 A 28 ARG HBx A 28 ARG HGx 1.0 . 2.51 765 587 A 28 ARG HBy A 28 ARG HGx 1.0 . 2.51 766 587 A 28 ARG HGy A 28 ARG HBx 1.0 . 2.51 767 587 A 28 ARG HGy A 28 ARG HBy 1.0 . 2.51 768 588 A 28 ARG HBx A 28 ARG HDx 1.0 . 2.56 769 588 A 28 ARG HBy A 28 ARG HDx 1.0 . 2.56 770 588 A 28 ARG HDy A 28 ARG HBx 1.0 . 2.56 771 588 A 28 ARG HDy A 28 ARG HBy 1.0 . 2.56 772 589 A 28 ARG HBy A 50 GLU HGx 1.0 . 5.34 773 589 A 28 ARG HBx A 50 GLU HGx 1.0 . 5.34 774 589 A 50 GLU HGy A 28 ARG HBx 1.0 . 5.34 775 589 A 28 ARG HBy A 50 GLU HGy 1.0 . 5.34 776 590 A 29 VAL HGy% A 56 VAL HGy% 1.0 . 5.44 777 590 A 29 VAL HGy% A 56 VAL HGx% 1.0 . 5.44 778 591 A 30 SER H A 30 SER HBx 1.0 . 3.07 779 591 A 30 SER H A 30 SER HBy 1.0 . 3.07 780 592 A 46 THR HG2% A 30 SER HBx 1.0 . 4.41 781 592 A 46 THR HG2% A 30 SER HBy 1.0 . 4.41 782 593 A 31 ALA HB% A 48 ARG HDx 1.0 . 5.34 783 593 A 31 ALA HB% A 48 ARG HDy 1.0 . 5.34 784 594 A 33 ASP HA A 34 VAL HGy% 1.0 . 4.31 785 594 A 33 ASP HA A 34 VAL HGx% 1.0 . 4.31 786 595 A 34 VAL H A 34 VAL HGy% 1.0 . 3.82 787 595 A 34 VAL H A 34 VAL HGx% 1.0 . 3.82 788 596 A 34 VAL HA A 34 VAL HGy% 1.0 . 2.87 789 596 A 34 VAL HA A 34 VAL HGx% 1.0 . 2.87 790 597 A 35 LYS H A 34 VAL HGy% 1.0 . 3.39 791 597 A 35 LYS H A 34 VAL HGx% 1.0 . 3.39 792 598 A 41 LYS HA A 34 VAL HGy% 1.0 . 5.44 793 598 A 41 LYS HA A 34 VAL HGx% 1.0 . 5.44 794 599 A 34 VAL HGy% A 41 LYS HEx 1.0 . 3.00 795 599 A 34 VAL HGx% A 41 LYS HEx 1.0 . 3.00 796 599 A 41 LYS HEy A 34 VAL HGy% 1.0 . 3.00 797 599 A 34 VAL HGx% A 41 LYS HEy 1.0 . 3.00 798 600 A 44 PHE HD% A 34 VAL HGy% 1.0 . 5.44 799 600 A 44 PHE HD% A 34 VAL HGx% 1.0 . 5.44 800 601 A 35 LYS H A 35 LYS HGy 1.0 . 3.32 801 601 A 35 LYS H A 35 LYS HGx 1.0 . 3.32 802 602 A 35 LYS HA A 35 LYS HGy 1.0 . 3.52 803 602 A 35 LYS HA A 35 LYS HGx 1.0 . 3.52 804 603 A 35 LYS HEx A 35 LYS HGy 1.0 . 2.76 805 603 A 35 LYS HGx A 35 LYS HEx 1.0 . 2.76 806 603 A 35 LYS HGx A 35 LYS HEy 1.0 . 2.76 807 603 A 35 LYS HEy A 35 LYS HGy 1.0 . 2.76 808 604 A 44 PHE HD% A 35 LYS HGy 1.0 . 3.37 809 604 A 44 PHE HD% A 35 LYS HGx 1.0 . 3.37 810 605 A 35 LYS HDx A 35 LYS HEx 1.0 . 2.44 811 605 A 35 LYS HDy A 35 LYS HEx 1.0 . 2.44 812 605 A 35 LYS HEy A 35 LYS HDx 1.0 . 2.44 813 605 A 35 LYS HEy A 35 LYS HDy 1.0 . 2.44 814 606 A 37 VAL H A 35 LYS HEx 1.0 . 4.18 815 606 A 37 VAL H A 35 LYS HEy 1.0 . 4.18 816 607 A 35 LYS HEx A 37 VAL HGx% 1.0 . 3.61 817 607 A 35 LYS HEy A 37 VAL HGx% 1.0 . 3.61 818 607 A 37 VAL HGy% A 35 LYS HEx 1.0 . 3.61 819 607 A 37 VAL HGy% A 35 LYS HEy 1.0 . 3.61 820 608 A 44 PHE HD% A 35 LYS HEx 1.0 . 4.44 821 608 A 44 PHE HD% A 35 LYS HEy 1.0 . 4.44 822 609 A 36 GLU HA A 41 LYS HBy 1.0 . 5.02 823 609 A 36 GLU HA A 41 LYS HBx 1.0 . 5.02 824 610 A 36 GLU HA A 41 LYS HGx 1.0 . 3.77 825 610 A 36 GLU HA A 41 LYS HGy 1.0 . 3.77 826 611 A 37 VAL H A 40 GLN HBx 1.0 . 5.34 827 611 A 37 VAL H A 40 GLN HBy 1.0 . 5.34 828 612 A 40 GLN HA A 40 GLN HGy 1.0 . 3.50 829 612 A 40 GLN HA A 40 GLN HGx 1.0 . 3.50 830 613 A 40 GLN HBy A 40 GLN HE2x 1.0 . 4.41 831 613 A 40 GLN HBx A 40 GLN HE2x 1.0 . 4.41 832 613 A 40 GLN HE2y A 40 GLN HBx 1.0 . 4.41 833 613 A 40 GLN HBy A 40 GLN HE2y 1.0 . 4.41 834 614 A 41 LYS H A 40 GLN HBx 1.0 . 4.33 835 614 A 41 LYS H A 40 GLN HBy 1.0 . 4.33 836 615 A 42 LEU HDy% A 40 GLN HBx 1.0 . 5.34 837 615 A 42 LEU HDy% A 40 GLN HBy 1.0 . 5.34 838 616 A 41 LYS H A 40 GLN HGy 1.0 . 4.16 839 616 A 41 LYS H A 40 GLN HGx 1.0 . 4.16 840 617 A 40 GLN HGx A 41 LYS HBy 1.0 . 5.18 841 617 A 40 GLN HGy A 41 LYS HBy 1.0 . 5.18 842 617 A 41 LYS HBx A 40 GLN HGy 1.0 . 5.18 843 617 A 41 LYS HBx A 40 GLN HGx 1.0 . 5.18 844 618 A 41 LYS H A 41 LYS HBy 1.0 . 3.15 845 618 A 41 LYS H A 41 LYS HBx 1.0 . 3.15 846 619 A 41 LYS H A 41 LYS HGx 1.0 . 4.44 847 619 A 41 LYS H A 41 LYS HGy 1.0 . 4.44 848 620 A 41 LYS HA A 41 LYS HGx 1.0 . 3.35 849 620 A 41 LYS HA A 41 LYS HGy 1.0 . 3.35 850 621 A 41 LYS HEy A 41 LYS HGx 1.0 . 2.57 851 621 A 41 LYS HEx A 41 LYS HGx 1.0 . 2.57 852 621 A 41 LYS HGy A 41 LYS HEx 1.0 . 2.57 853 621 A 41 LYS HEy A 41 LYS HGy 1.0 . 2.57 854 622 A 42 LEU HBy A 62 LYS HBx 1.0 . 5.34 855 622 A 42 LEU HBy A 62 LYS HBy 1.0 . 5.34 856 623 A 42 LEU HDx% A 59 PRO HDy 1.0 . 5.01 857 623 A 42 LEU HDx% A 59 PRO HDx 1.0 . 5.01 858 624 A 42 LEU HDy% A 62 LYS HBx 1.0 . 5.34 859 624 A 42 LEU HDy% A 62 LYS HBy 1.0 . 5.34 860 625 A 43 THR HB A 60 GLU HBx 1.0 . 2.58 861 625 A 43 THR HB A 60 GLU HBy 1.0 . 2.58 862 626 A 43 THR HB A 60 GLU HGy 1.0 . 3.87 863 626 A 43 THR HB A 60 GLU HGx 1.0 . 3.87 864 627 A 43 THR HG2% A 60 GLU HBx 1.0 . 5.34 865 627 A 43 THR HG2% A 60 GLU HBy 1.0 . 5.34 866 628 A 43 THR HG2% A 60 GLU HGy 1.0 . 5.34 867 628 A 43 THR HG2% A 60 GLU HGx 1.0 . 5.34 868 629 A 44 PHE HD% A 59 PRO HDy 1.0 . 4.47 869 629 A 44 PHE HD% A 59 PRO HDx 1.0 . 4.47 870 630 A 44 PHE HE% A 59 PRO HDy 1.0 . 4.27 871 630 A 44 PHE HE% A 59 PRO HDx 1.0 . 4.27 872 631 A 44 PHE HE% A 62 LYS HBx 1.0 . 4.56 873 631 A 44 PHE HE% A 62 LYS HBy 1.0 . 4.56 874 632 A 44 PHE HZ A 62 LYS HBx 1.0 . 5.34 875 632 A 44 PHE HZ A 62 LYS HBy 1.0 . 5.34 876 633 A 45 VAL H A 60 GLU HGy 1.0 . 4.40 877 633 A 45 VAL H A 60 GLU HGx 1.0 . 4.40 878 634 A 45 VAL HA A 60 GLU HGy 1.0 . 4.52 879 634 A 45 VAL HA A 60 GLU HGx 1.0 . 4.52 880 635 A 45 VAL HGx% A 60 GLU HGy 1.0 . 2.96 881 635 A 45 VAL HGx% A 60 GLU HGx 1.0 . 2.96 882 636 A 45 VAL HGy% A 70 LYS HBx 1.0 . 5.34 883 636 A 45 VAL HGy% A 70 LYS HBy 1.0 . 5.34 884 637 A 47 MET H A 47 MET HBy 1.0 . 3.35 885 637 A 47 MET H A 47 MET HBx 1.0 . 3.35 886 638 A 48 ARG HBy A 48 ARG HDx 1.0 . 3.44 887 638 A 48 ARG HBx A 48 ARG HDx 1.0 . 3.44 888 638 A 48 ARG HDy A 48 ARG HBx 1.0 . 3.44 889 638 A 48 ARG HBy A 48 ARG HDy 1.0 . 3.44 890 639 A 49 ARG H A 53 GLY HAx 1.0 . 4.87 891 639 A 49 ARG H A 53 GLY HAy 1.0 . 4.87 892 640 A 49 ARG H A 55 VAL HGy% 1.0 . 5.04 893 640 A 49 ARG H A 55 VAL HGx% 1.0 . 5.04 894 641 A 50 GLU H A 49 ARG HBy 1.0 . 4.30 895 641 A 50 GLU H A 49 ARG HBx 1.0 . 4.30 896 642 A 49 ARG HBx A 50 GLU HGx 1.0 . 5.34 897 642 A 49 ARG HBy A 50 GLU HGx 1.0 . 5.34 898 642 A 50 GLU HGy A 49 ARG HBy 1.0 . 5.34 899 642 A 50 GLU HGy A 49 ARG HBx 1.0 . 5.34 900 643 A 54 ALA H A 49 ARG HBy 1.0 . 4.09 901 643 A 54 ALA H A 49 ARG HBx 1.0 . 4.09 902 644 A 54 ALA HB% A 49 ARG HDx 1.0 . 3.77 903 644 A 54 ALA HB% A 49 ARG HDy 1.0 . 3.77 904 645 A 51 GLU H A 50 GLU HBy 1.0 . 4.32 905 645 A 51 GLU H A 50 GLU HBx 1.0 . 4.32 906 646 A 51 GLU HA A 51 GLU HGy 1.0 . 3.18 907 646 A 51 GLU HA A 51 GLU HGx 1.0 . 3.18 908 647 A 52 ASP H A 51 GLU HBy 1.0 . 3.58 909 647 A 52 ASP H A 51 GLU HBx 1.0 . 3.58 910 648 A 52 ASP H A 51 GLU HGy 1.0 . 4.20 911 648 A 52 ASP H A 51 GLU HGx 1.0 . 4.20 912 649 A 52 ASP H A 52 ASP HBx 1.0 . 3.59 913 649 A 52 ASP H A 52 ASP HBy 1.0 . 3.59 914 650 A 54 ALA H A 53 GLY HAx 1.0 . 2.99 915 650 A 54 ALA H A 53 GLY HAy 1.0 . 2.99 916 651 A 54 ALA HB% A 55 VAL HGy% 1.0 . 5.44 917 651 A 54 ALA HB% A 55 VAL HGx% 1.0 . 5.44 918 652 A 55 VAL H A 55 VAL HGy% 1.0 . 3.00 919 652 A 55 VAL H A 55 VAL HGx% 1.0 . 3.00 920 653 A 55 VAL HA A 55 VAL HGy% 1.0 . 2.98 921 653 A 55 VAL HA A 55 VAL HGx% 1.0 . 2.98 922 654 A 56 VAL H A 55 VAL HGy% 1.0 . 3.82 923 654 A 56 VAL H A 55 VAL HGx% 1.0 . 3.82 924 655 A 56 VAL H A 56 VAL HGy% 1.0 . 3.77 925 655 A 56 VAL H A 56 VAL HGx% 1.0 . 3.77 926 656 A 57 MET H A 56 VAL HGy% 1.0 . 4.17 927 656 A 57 MET H A 56 VAL HGx% 1.0 . 4.17 928 657 A 56 VAL HGx% A 68 VAL HGx% 1.0 . 5.44 929 657 A 56 VAL HGy% A 68 VAL HGx% 1.0 . 5.44 930 657 A 68 VAL HGy% A 56 VAL HGy% 1.0 . 5.44 931 657 A 68 VAL HGy% A 56 VAL HGx% 1.0 . 5.44 932 658 A 56 VAL HGy% A 70 LYS HBx 1.0 . 5.28 933 658 A 56 VAL HGx% A 70 LYS HBx 1.0 . 5.28 934 658 A 70 LYS HBy A 56 VAL HGy% 1.0 . 5.28 935 658 A 70 LYS HBy A 56 VAL HGx% 1.0 . 5.28 936 659 A 57 MET H A 57 MET HBx 1.0 . 2.90 937 659 A 57 MET H A 57 MET HBy 1.0 . 2.90 938 660 A 57 MET HA A 57 MET HGx 1.0 . 3.23 939 660 A 57 MET HA A 57 MET HGy 1.0 . 3.23 940 661 A 58 VAL HA A 59 PRO HDy 1.0 . 2.87 941 661 A 58 VAL HA A 59 PRO HDx 1.0 . 2.87 942 662 A 58 VAL HB A 59 PRO HDy 1.0 . 2.93 943 662 A 58 VAL HB A 59 PRO HDx 1.0 . 2.93 944 663 A 58 VAL HGx% A 59 PRO HDy 1.0 . 4.33 945 663 A 58 VAL HGx% A 59 PRO HDx 1.0 . 4.33 946 664 A 58 VAL HGx% A 70 LYS HBx 1.0 . 5.34 947 664 A 58 VAL HGx% A 70 LYS HBy 1.0 . 5.34 948 665 A 58 VAL HGy% A 70 LYS HBx 1.0 . 5.34 949 665 A 58 VAL HGy% A 70 LYS HBy 1.0 . 5.34 950 666 A 59 PRO HBx A 62 LYS HBx 1.0 . 2.61 951 666 A 59 PRO HBx A 62 LYS HBy 1.0 . 2.61 952 667 A 59 PRO HGy A 62 LYS HGy 1.0 . 4.03 953 667 A 59 PRO HGy A 62 LYS HGx 1.0 . 4.03 954 668 A 60 GLU H A 60 GLU HBx 1.0 . 3.55 955 668 A 60 GLU H A 60 GLU HBy 1.0 . 3.55 956 669 A 60 GLU HA A 60 GLU HGy 1.0 . 2.84 957 669 A 60 GLU HA A 60 GLU HGx 1.0 . 2.84 958 670 A 63 VAL HGy% A 60 GLU HBx 1.0 . 5.34 959 670 A 63 VAL HGy% A 60 GLU HBy 1.0 . 5.34 960 671 A 61 GLY H A 60 GLU HGy 1.0 . 4.83 961 671 A 61 GLY H A 60 GLU HGx 1.0 . 4.83 962 672 A 61 GLY H A 62 LYS HBx 1.0 . 5.34 963 672 A 61 GLY H A 62 LYS HBy 1.0 . 5.34 964 673 A 62 LYS H A 62 LYS HBx 1.0 . 2.72 965 673 A 62 LYS H A 62 LYS HBy 1.0 . 2.72 966 674 A 62 LYS HA A 62 LYS HGy 1.0 . 3.45 967 674 A 62 LYS HA A 62 LYS HGx 1.0 . 3.45 968 675 A 62 LYS HBx A 62 LYS HDx 1.0 . 3.34 969 675 A 62 LYS HBy A 62 LYS HDx 1.0 . 3.34 970 675 A 62 LYS HDy A 62 LYS HBx 1.0 . 3.34 971 675 A 62 LYS HDy A 62 LYS HBy 1.0 . 3.34 972 676 A 62 LYS HEy A 62 LYS HGy 1.0 . 3.34 973 676 A 62 LYS HEx A 62 LYS HGy 1.0 . 3.34 974 676 A 62 LYS HGx A 62 LYS HEx 1.0 . 3.34 975 676 A 62 LYS HEy A 62 LYS HGx 1.0 . 3.34 976 677 A 64 LEU H A 64 LEU HBy 1.0 . 3.47 977 677 A 64 LEU H A 64 LEU HBx 1.0 . 3.47 978 678 A 64 LEU HDx% A 64 LEU HBy 1.0 . 3.06 979 678 A 64 LEU HDx% A 64 LEU HBx 1.0 . 3.06 980 679 A 65 ALA H A 64 LEU HBy 1.0 . 4.46 981 679 A 65 ALA H A 64 LEU HBx 1.0 . 4.46 982 680 A 66 ILE H A 64 LEU HBy 1.0 . 5.34 983 680 A 66 ILE H A 64 LEU HBx 1.0 . 5.34 984 681 A 66 ILE H A 66 ILE HG1x 1.0 . 3.60 985 681 A 66 ILE H A 66 ILE HG1y 1.0 . 3.60 986 682 A 66 ILE H A 67 GLY HAx 1.0 . 5.23 987 682 A 66 ILE H A 67 GLY HAy 1.0 . 5.23 988 683 A 66 ILE HA A 66 ILE HG1x 1.0 . 2.81 989 683 A 66 ILE HA A 66 ILE HG1y 1.0 . 2.81 990 684 A 67 GLY HAx A 68 VAL HGx% 1.0 . 5.31 991 684 A 67 GLY HAy A 68 VAL HGx% 1.0 . 5.31 992 684 A 68 VAL HGy% A 67 GLY HAx 1.0 . 5.31 993 684 A 68 VAL HGy% A 67 GLY HAy 1.0 . 5.31 994 685 A 68 VAL HGx% A 70 LYS HGx 1.0 . 5.34 995 685 A 68 VAL HGy% A 70 LYS HGx 1.0 . 5.34 996 685 A 70 LYS HGy A 68 VAL HGx% 1.0 . 5.34 997 685 A 68 VAL HGy% A 70 LYS HGy 1.0 . 5.34 998 686 A 69 ARG HBx A 69 ARG HDx 1.0 . 3.16 999 686 A 69 ARG HBy A 69 ARG HDx 1.0 . 3.16 1000 686 A 69 ARG HDy A 69 ARG HBx 1.0 . 3.16 1001 686 A 69 ARG HDy A 69 ARG HBy 1.0 . 3.16 1002 687 A 74 ALA HA A 69 ARG HBx 1.0 . 3.90 1003 687 A 74 ALA HA A 69 ARG HBy 1.0 . 3.90 1004 688 A 74 ALA HB% A 69 ARG HBx 1.0 . 5.34 1005 688 A 74 ALA HB% A 69 ARG HBy 1.0 . 5.34 1006 689 A 69 ARG HDx A 71 VAL HGy% 1.0 . 4.68 1007 689 A 69 ARG HDy A 71 VAL HGy% 1.0 . 4.68 1008 689 A 71 VAL HGx% A 69 ARG HDx 1.0 . 4.68 1009 689 A 69 ARG HDy A 71 VAL HGx% 1.0 . 4.68 1010 690 A 70 LYS H A 70 LYS HBx 1.0 . 3.13 1011 690 A 70 LYS H A 70 LYS HBy 1.0 . 3.13 1012 691 A 70 LYS H A 70 LYS HGx 1.0 . 4.08 1013 691 A 70 LYS H A 70 LYS HGy 1.0 . 4.08 1014 692 A 70 LYS HA A 70 LYS HGx 1.0 . 3.70 1015 692 A 70 LYS HA A 70 LYS HGy 1.0 . 3.70 1016 693 A 70 LYS HA A 71 VAL HGy% 1.0 . 5.44 1017 693 A 70 LYS HA A 71 VAL HGx% 1.0 . 5.44 1018 694 A 70 LYS HBx A 70 LYS HEx 1.0 . 3.91 1019 694 A 70 LYS HBy A 70 LYS HEx 1.0 . 3.91 1020 694 A 70 LYS HEy A 70 LYS HBx 1.0 . 3.91 1021 694 A 70 LYS HEy A 70 LYS HBy 1.0 . 3.91 1022 695 A 71 VAL H A 70 LYS HBx 1.0 . 4.38 1023 695 A 71 VAL H A 70 LYS HBy 1.0 . 4.38 1024 696 A 70 LYS HEy A 70 LYS HGx 1.0 . 3.43 1025 696 A 70 LYS HGy A 70 LYS HEx 1.0 . 3.43 1026 696 A 70 LYS HEy A 70 LYS HGy 1.0 . 3.43 1027 696 A 70 LYS HEx A 70 LYS HGx 1.0 . 3.43 1028 697 A 71 VAL H A 70 LYS HGx 1.0 . 4.60 1029 697 A 71 VAL H A 70 LYS HGy 1.0 . 4.60 1030 698 A 72 ALA H A 71 VAL HGy% 1.0 . 4.34 1031 698 A 72 ALA H A 71 VAL HGx% 1.0 . 4.34 1032 699 A 73 SER H A 71 VAL HGy% 1.0 . 4.21 1033 699 A 73 SER H A 71 VAL HGx% 1.0 . 4.21 1034 700 A 74 ALA H A 71 VAL HGy% 1.0 . 3.48 1035 700 A 74 ALA H A 71 VAL HGx% 1.0 . 3.48 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_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 2 GLY C A 3 HIS N A 3 HIS CA A 3 HIS C 1.0 -137.0 -23.0 PHI 2 2 A 3 HIS N A 3 HIS CA A 3 HIS C A 4 MET N 1.0 105.9 168.6 PSI 3 3 A 3 HIS C A 4 MET N A 4 MET CA A 4 MET C 1.0 -116.9 -44.1 PHI 4 4 A 4 MET N A 4 MET CA A 4 MET C A 5 PRO N 1.0 121.0 172.7 PSI 5 5 A 5 PRO C A 6 GLU N A 6 GLU CA A 6 GLU C 1.0 -202.2 -33.7 PHI 6 6 A 7 GLY C A 8 SER N A 8 SER CA A 8 SER C 1.0 -190.0 -20.0 PHI 7 7 A 8 SER C A 9 ALA N A 9 ALA CA A 9 ALA C 1.0 -190.0 -20.0 PHI 8 8 A 9 ALA C A 10 SER N A 10 SER CA A 10 SER C 1.0 -184.5 -26.9 PHI 9 9 A 10 SER C A 11 LEU N A 11 LEU CA A 11 LEU C 1.0 -190.0 -20.0 PHI 10 10 A 11 LEU C A 12 GLN N A 12 GLN CA A 12 GLN C 1.0 -190.0 -20.0 PHI 11 11 A 12 GLN C A 13 LEU N A 13 LEU CA A 13 LEU C 1.0 -145.7 -71.5 PHI 12 12 A 13 LEU N A 13 LEU CA A 13 LEU C A 14 ALA N 1.0 107.4 173.4 PSI 13 13 A 13 LEU C A 14 ALA N A 14 ALA CA A 14 ALA C 1.0 -148.2 -51.0 PHI 14 14 A 14 ALA N A 14 ALA CA A 14 ALA C A 15 VAL N 1.0 136.2 179.1 PSI 15 15 A 14 ALA C A 15 VAL N A 15 VAL CA A 15 VAL C 1.0 -70.9 -40.2 PHI 16 16 A 15 VAL N A 15 VAL CA A 15 VAL C A 16 GLY N 1.0 121.5 142.4 PSI 17 17 A 15 VAL C A 16 GLY N A 16 GLY CA A 16 GLY C 1.0 85.3 105.7 PHI 18 18 A 16 GLY N A 16 GLY CA A 16 GLY C A 17 ASP N 1.0 -29.5 0.3 PSI 19 19 A 16 GLY C A 17 ASP N A 17 ASP CA A 17 ASP C 1.0 -78.6 -58.6 PHI 20 20 A 17 ASP N A 17 ASP CA A 17 ASP C A 18 ARG N 1.0 135.6 175.6 PSI 21 21 A 17 ASP C A 18 ARG N A 18 ARG CA A 18 ARG C 1.0 -144.1 -72.0 PHI 22 22 A 18 ARG N A 18 ARG CA A 18 ARG C A 19 VAL N 1.0 108.1 175.4 PSI 23 23 A 18 ARG C A 19 VAL N A 19 VAL CA A 19 VAL C 1.0 -161.1 -109.2 PHI 24 24 A 19 VAL N A 19 VAL CA A 19 VAL C A 20 VAL N 1.0 122.0 175.1 PSI 25 25 A 19 VAL C A 20 VAL N A 20 VAL CA A 20 VAL C 1.0 -137.1 -67.1 PHI 26 26 A 20 VAL N A 20 VAL CA A 20 VAL C A 21 TYR N 1.0 94.6 151.7 PSI 27 27 A 20 VAL C A 21 TYR N A 21 TYR CA A 21 TYR C 1.0 -144.0 -47.5 PHI 28 28 A 21 TYR N A 21 TYR CA A 21 TYR C A 22 PRO N 1.0 95.2 169.1 PSI 29 29 A 22 PRO C A 23 ASN N A 23 ASN CA A 23 ASN C 1.0 -190.0 20.0 PHI 30 30 A 23 ASN C A 24 GLN N A 24 GLN CA A 24 GLN C 1.0 -190.0 20.0 PHI 31 31 A 25 GLY C A 26 VAL N A 26 VAL CA A 26 VAL C 1.0 -129.4 -48.3 PHI 32 32 A 26 VAL N A 26 VAL CA A 26 VAL C A 27 CYS N 1.0 112.9 144.6 PSI 33 33 A 26 VAL C A 27 CYS N A 27 CYS CA A 27 CYS C 1.0 -165.6 -93.5 PHI 34 34 A 27 CYS N A 27 CYS CA A 27 CYS C A 28 ARG N 1.0 138.3 175.4 PSI 35 35 A 27 CYS C A 28 ARG N A 28 ARG CA A 28 ARG C 1.0 -149.4 -90.5 PHI 36 36 A 28 ARG N A 28 ARG CA A 28 ARG C A 29 VAL N 1.0 92.9 159.7 PSI 37 37 A 28 ARG C A 29 VAL N A 29 VAL CA A 29 VAL C 1.0 -80.6 -54.3 PHI 38 38 A 29 VAL N A 29 VAL CA A 29 VAL C A 30 SER N 1.0 109.7 152.2 PSI 39 39 A 29 VAL C A 30 SER N A 30 SER CA A 30 SER C 1.0 -118.0 -86.2 PHI 40 40 A 30 SER N A 30 SER CA A 30 SER C A 31 ALA N 1.0 -55.2 -0.5 PSI 41 41 A 30 SER C A 31 ALA N A 31 ALA CA A 31 ALA C 1.0 -188.8 -72.1 PHI 42 42 A 31 ALA N A 31 ALA CA A 31 ALA C A 32 ILE N 1.0 113.2 167.4 PSI 43 43 A 31 ALA C A 32 ILE N A 32 ILE CA A 32 ILE C 1.0 -147.5 -58.6 PHI 44 44 A 32 ILE N A 32 ILE CA A 32 ILE C A 33 ASP N 1.0 112.9 148.9 PSI 45 45 A 32 ILE C A 33 ASP N A 33 ASP CA A 33 ASP C 1.0 -160.3 -99.4 PHI 46 46 A 33 ASP N A 33 ASP CA A 33 ASP C A 34 VAL N 1.0 121.4 166.9 PSI 47 47 A 33 ASP C A 34 VAL N A 34 VAL CA A 34 VAL C 1.0 -129.8 -74.2 PHI 48 48 A 34 VAL N A 34 VAL CA A 34 VAL C A 35 LYS N 1.0 118.8 143.0 PSI 49 49 A 34 VAL C A 35 LYS N A 35 LYS CA A 35 LYS C 1.0 -170.3 -65.4 PHI 50 50 A 35 LYS N A 35 LYS CA A 35 LYS C A 36 GLU N 1.0 105.2 176.5 PSI 51 51 A 35 LYS C A 36 GLU N A 36 GLU CA A 36 GLU C 1.0 -126.5 -77.2 PHI 52 52 A 36 GLU N A 36 GLU CA A 36 GLU C A 37 VAL N 1.0 114.9 134.9 PSI 53 53 A 36 GLU C A 37 VAL N A 37 VAL CA A 37 VAL C 1.0 -155.4 -78.7 PHI 54 54 A 37 VAL N A 37 VAL CA A 37 VAL C A 38 ALA N 1.0 111.0 141.9 PSI 55 55 A 37 VAL C A 38 ALA N A 38 ALA CA A 38 ALA C 1.0 42.2 62.3 PHI 56 56 A 38 ALA N A 38 ALA CA A 38 ALA C A 39 GLY N 1.0 29.0 53.4 PSI 57 57 A 38 ALA C A 39 GLY N A 39 GLY CA A 39 GLY C 1.0 60.9 99.0 PHI 58 58 A 39 GLY N A 39 GLY CA A 39 GLY C A 40 GLN N 1.0 -30.9 32.9 PSI 59 59 A 39 GLY C A 40 GLN N A 40 GLN CA A 40 GLN C 1.0 -147.9 -65.0 PHI 60 60 A 40 GLN N A 40 GLN CA A 40 GLN C A 41 LYS N 1.0 113.5 181.7 PSI 61 61 A 40 GLN C A 41 LYS N A 41 LYS CA A 41 LYS C 1.0 -131.0 -57.5 PHI 62 62 A 41 LYS N A 41 LYS CA A 41 LYS C A 42 LEU N 1.0 91.3 154.4 PSI 63 63 A 41 LYS C A 42 LEU N A 42 LEU CA A 42 LEU C 1.0 -160.3 -65.9 PHI 64 64 A 42 LEU N A 42 LEU CA A 42 LEU C A 43 THR N 1.0 112.5 179.5 PSI 65 65 A 42 LEU C A 43 THR N A 43 THR CA A 43 THR C 1.0 -134.4 -70.3 PHI 66 66 A 43 THR N A 43 THR CA A 43 THR C A 44 PHE N 1.0 116.4 138.5 PSI 67 67 A 43 THR C A 44 PHE N A 44 PHE CA A 44 PHE C 1.0 -168.4 -50.1 PHI 68 68 A 44 PHE N A 44 PHE CA A 44 PHE C A 45 VAL N 1.0 113.2 153.1 PSI 69 69 A 44 PHE C A 45 VAL N A 45 VAL CA A 45 VAL C 1.0 -151.9 -61.2 PHI 70 70 A 45 VAL N A 45 VAL CA A 45 VAL C A 46 THR N 1.0 103.4 152.5 PSI 71 71 A 45 VAL C A 46 THR N A 46 THR CA A 46 THR C 1.0 -126.5 -75.1 PHI 72 72 A 46 THR N A 46 THR CA A 46 THR C A 47 MET N 1.0 109.9 139.2 PSI 73 73 A 46 THR C A 47 MET N A 47 MET CA A 47 MET C 1.0 -167.9 -84.8 PHI 74 74 A 47 MET N A 47 MET CA A 47 MET C A 48 ARG N 1.0 138.3 169.6 PSI 75 75 A 47 MET C A 48 ARG N A 48 ARG CA A 48 ARG C 1.0 -146.8 -85.8 PHI 76 76 A 48 ARG N A 48 ARG CA A 48 ARG C A 49 ARG N 1.0 93.2 155.2 PSI 77 77 A 48 ARG C A 49 ARG N A 49 ARG CA A 49 ARG C 1.0 -128.0 -38.4 PHI 78 78 A 49 ARG N A 49 ARG CA A 49 ARG C A 50 GLU N 1.0 109.1 188.5 PSI 79 79 A 49 ARG C A 50 GLU N A 50 GLU CA A 50 GLU C 1.0 -70.2 -48.9 PHI 80 80 A 50 GLU N A 50 GLU CA A 50 GLU C A 51 GLU N 1.0 -57.0 -7.8 PSI 81 81 A 50 GLU C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -95.6 -38.3 PHI 82 82 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 ASP N 1.0 -46.8 -12.1 PSI 83 83 A 51 GLU C A 52 ASP N A 52 ASP CA A 52 ASP C 1.0 -128.6 -69.1 PHI 84 84 A 52 ASP N A 52 ASP CA A 52 ASP C A 53 GLY N 1.0 -27.9 35.5 PSI 85 85 A 52 ASP C A 53 GLY N A 53 GLY CA A 53 GLY C 1.0 -33.5 186.2 PHI 86 86 A 53 GLY N A 53 GLY CA A 53 GLY C A 54 ALA N 1.0 -132.6 100.8 PSI 87 87 A 53 GLY C A 54 ALA N A 54 ALA CA A 54 ALA C 1.0 -140.9 -22.0 PHI 88 88 A 54 ALA N A 54 ALA CA A 54 ALA C A 55 VAL N 1.0 114.6 167.7 PSI 89 89 A 54 ALA C A 55 VAL N A 55 VAL CA A 55 VAL C 1.0 -145.2 -44.8 PHI 90 90 A 55 VAL N A 55 VAL CA A 55 VAL C A 56 VAL N 1.0 98.2 161.6 PSI 91 91 A 55 VAL C A 56 VAL N A 56 VAL CA A 56 VAL C 1.0 -158.0 -82.8 PHI 92 92 A 56 VAL N A 56 VAL CA A 56 VAL C A 57 MET N 1.0 112.1 149.4 PSI 93 93 A 56 VAL C A 57 MET N A 57 MET CA A 57 MET C 1.0 -145.0 -79.6 PHI 94 94 A 57 MET N A 57 MET CA A 57 MET C A 58 VAL N 1.0 97.0 166.5 PSI 95 95 A 57 MET C A 58 VAL N A 58 VAL CA A 58 VAL C 1.0 -157.3 -97.4 PHI 96 96 A 58 VAL N A 58 VAL CA A 58 VAL C A 59 PRO N 1.0 99.1 178.3 PSI 97 97 A 59 PRO C A 60 GLU N A 60 GLU CA A 60 GLU C 1.0 -67.1 -47.1 PHI 98 98 A 60 GLU N A 60 GLU CA A 60 GLU C A 61 GLY N 1.0 -54.4 -10.5 PSI 99 99 A 60 GLU C A 61 GLY N A 61 GLY CA A 61 GLY C 1.0 -92.2 -66.3 PHI 100 100 A 61 GLY N A 61 GLY CA A 61 GLY C A 62 LYS N 1.0 -26.2 10.4 PSI 101 101 A 61 GLY C A 62 LYS N A 62 LYS CA A 62 LYS C 1.0 -190.0 -20.0 PHI 102 102 A 62 LYS C A 63 VAL N A 63 VAL CA A 63 VAL C 1.0 -70.2 -48.3 PHI 103 103 A 63 VAL N A 63 VAL CA A 63 VAL C A 64 LEU N 1.0 -55.0 -28.6 PSI 104 104 A 63 VAL C A 64 LEU N A 64 LEU CA A 64 LEU C 1.0 -82.2 -43.7 PHI 105 105 A 64 LEU N A 64 LEU CA A 64 LEU C A 65 ALA N 1.0 -58.4 -19.4 PSI 106 106 A 64 LEU C A 65 ALA N A 65 ALA CA A 65 ALA C 1.0 -81.6 -51.2 PHI 107 107 A 65 ALA N A 65 ALA CA A 65 ALA C A 66 ILE N 1.0 -53.3 -17.8 PSI 108 108 A 65 ALA C A 66 ILE N A 66 ILE CA A 66 ILE C 1.0 -118.5 -62.5 PHI 109 109 A 66 ILE N A 66 ILE CA A 66 ILE C A 67 GLY N 1.0 -33.6 32.0 PSI 110 110 A 66 ILE C A 67 GLY N A 67 GLY CA A 67 GLY C 1.0 61.5 109.0 PHI 111 111 A 67 GLY N A 67 GLY CA A 67 GLY C A 68 VAL N 1.0 -15.5 30.6 PSI 112 112 A 67 GLY C A 68 VAL N A 68 VAL CA A 68 VAL C 1.0 -140.2 -52.8 PHI 113 113 A 68 VAL N A 68 VAL CA A 68 VAL C A 69 ARG N 1.0 123.2 151.4 PSI 114 114 A 68 VAL C A 69 ARG N A 69 ARG CA A 69 ARG C 1.0 -143.9 -75.1 PHI 115 115 A 69 ARG N A 69 ARG CA A 69 ARG C A 70 LYS N 1.0 109.3 176.5 PSI 116 116 A 69 ARG C A 70 LYS N A 70 LYS CA A 70 LYS C 1.0 -153.0 -35.2 PHI 117 117 A 70 LYS N A 70 LYS CA A 70 LYS C A 71 VAL N 1.0 106.6 173.6 PSI 118 118 A 70 LYS C A 71 VAL N A 71 VAL CA A 71 VAL C 1.0 -187.7 -24.0 PHI 119 119 A 71 VAL C A 72 ALA N A 72 ALA CA A 72 ALA C 1.0 -190.0 -20.0 PHI 120 120 A 72 ALA C A 73 SER N A 73 SER CA A 73 SER C 1.0 -185.9 -31.5 PHI 121 121 A 73 SER C A 74 ALA N A 74 ALA CA A 74 ALA C 1.0 -190.0 -20.0 PHI stop_ save_