data_nef_c19198_2m7o 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 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 GLY start . false 2 A 2 ASP middle . . 3 A 3 ASP middle . . 4 A 4 ARG middle . . 5 A 5 LYS middle . . 6 A 6 LEU middle . . 7 A 7 MET middle . . 8 A 8 LYS middle . . 9 A 9 THR middle . . 10 A 10 GLN middle . . 11 A 11 GLU middle . . 12 A 12 GLU middle . . 13 A 13 LEU middle . . 14 A 14 THR middle . . 15 A 15 GLU middle . . 16 A 16 ILE middle . . 17 A 17 VAL middle . . 18 A 18 ARG middle . . 19 A 19 ASP middle . . 20 A 20 HIS middle . . 21 A 21 PHE middle . . 22 A 22 SER middle . . 23 A 23 ASP middle . . 24 A 24 MET middle . . 25 A 25 GLY middle . false 26 A 26 GLU middle . . 27 A 27 ILE middle . . 28 A 28 ALA middle . . 29 A 29 THR middle . . 30 A 30 LEU middle . . 31 A 31 TYR middle . . 32 A 32 VAL middle . . 33 A 33 GLN middle . . 34 A 34 VAL middle . . 35 A 35 TYR middle . . 36 A 36 GLU middle . . 37 A 37 SER middle . . 38 A 38 SER middle . . 39 A 39 LEU middle . . 40 A 40 GLU middle . . 41 A 41 SER middle . . 42 A 42 LEU middle . . 43 A 43 VAL middle . . 44 A 44 GLY middle . false 45 A 45 GLY middle . false 46 A 46 VAL middle . . 47 A 47 ILE middle . . 48 A 48 PHE middle . . 49 A 49 GLU middle . . 50 A 50 ASP middle . . 51 A 51 GLY middle . false 52 A 52 ARG middle . . 53 A 53 HIS middle . . 54 A 54 TYR middle . . 55 A 55 THR middle . . 56 A 56 PHE middle . . 57 A 57 VAL middle . . 58 A 58 TYR middle . . 59 A 59 GLU middle . . 60 A 60 ASN middle . . 61 A 61 GLU middle . . 62 A 62 ASP middle . . 63 A 63 LEU middle . . 64 A 64 VAL middle . . 65 A 65 TYR middle . . 66 A 66 GLU middle . . 67 A 67 GLU middle . . 68 A 68 GLU middle . . 69 A 69 VAL middle . . 70 A 70 LEU 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 3 ASP H H 1 8.416 0.029 A 3 ASP HBy H 1 2.584 0.029 A 3 ASP N N 15 120.996 0.109 A 4 ARG H H 1 8.187 0.029 A 4 ARG HBy H 1 1.591 0.029 A 4 ARG N N 15 120.957 0.109 A 5 LYS H H 1 8.223 0.029 A 5 LYS HA H 1 4.209 0.029 A 5 LYS HBy H 1 1.734 0.029 A 5 LYS HBx H 1 1.693 0.029 A 5 LYS HGy H 1 1.345 0.029 A 5 LYS HGx H 1 1.308 0.029 A 5 LYS CA C 13 53.562 0.141 A 5 LYS CB C 13 30.595 0.141 A 5 LYS CG C 13 22.249 0.141 A 5 LYS N N 15 122.746 0.109 A 6 LEU H H 1 8.258 0.029 A 6 LEU HA H 1 4.345 0.029 A 6 LEU HBy H 1 1.548 0.029 A 6 LEU HBx H 1 1.522 0.029 A 6 LEU HDx% H 1 0.874 0.029 A 6 LEU HDy% H 1 0.811 0.029 A 6 LEU HG H 1 1.546 0.029 A 6 LEU CA C 13 52.051 0.141 A 6 LEU CB C 13 39.833 0.141 A 6 LEU CDy C 13 22.388 0.141 A 6 LEU CDx C 13 21.166 0.141 A 6 LEU CG C 13 24.574 0.141 A 6 LEU N N 15 124.432 0.109 A 7 MET H H 1 8.284 0.029 A 7 MET HA H 1 4.529 0.029 A 7 MET HBy H 1 2.090 0.029 A 7 MET HBx H 1 1.939 0.029 A 7 MET HE% H 1 2.032 0.029 A 7 MET HGy H 1 2.594 0.029 A 7 MET HGx H 1 2.505 0.029 A 7 MET CA C 13 52.288 0.141 A 7 MET CB C 13 30.827 0.141 A 7 MET CE C 13 15.022 0.141 A 7 MET CG C 13 29.854 0.141 A 7 MET N N 15 122.420 0.109 A 8 LYS H H 1 9.420 0.029 A 8 LYS HA H 1 4.461 0.029 A 8 LYS HBx H 1 1.642 0.029 A 8 LYS HBy H 1 1.642 0.029 A 8 LYS HDx H 1 1.471 0.029 A 8 LYS HDy H 1 1.471 0.029 A 8 LYS HEx H 1 2.937 0.029 A 8 LYS HEy H 1 2.937 0.029 A 8 LYS HGx H 1 1.429 0.029 A 8 LYS HGy H 1 1.591 0.029 A 8 LYS CA C 13 53.986 0.141 A 8 LYS CB C 13 31.771 0.141 A 8 LYS CD C 13 27.067 0.141 A 8 LYS CE C 13 39.698 0.141 A 8 LYS CG C 13 23.299 0.141 A 8 LYS N N 15 124.204 0.109 A 9 THR H H 1 8.817 0.029 A 9 THR HA H 1 4.366 0.029 A 9 THR HB H 1 4.659 0.029 A 9 THR HG2% H 1 1.314 0.029 A 9 THR CA C 13 57.964 0.141 A 9 THR CB C 13 68.912 0.141 A 9 THR CG2 C 13 19.435 0.141 A 9 THR N N 15 113.488 0.109 A 10 GLN H H 1 8.586 0.029 A 10 GLN HA H 1 3.012 0.029 A 10 GLN HBy H 1 1.319 0.029 A 10 GLN HBx H 1 0.949 0.029 A 10 GLN HE21 H 1 6.799 0.029 A 10 GLN HE22 H 1 7.403 0.029 A 10 GLN HGy H 1 1.879 0.029 A 10 GLN HGx H 1 1.552 0.029 A 10 GLN CA C 13 57.666 0.141 A 10 GLN CB C 13 24.850 0.141 A 10 GLN CG C 13 31.085 0.141 A 10 GLN N N 15 121.509 0.109 A 10 GLN NE2 N 15 110.066 0.109 A 11 GLU H H 1 8.998 0.029 A 11 GLU HA H 1 3.801 0.029 A 11 GLU HBy H 1 1.953 0.029 A 11 GLU HBx H 1 1.826 0.029 A 11 GLU HGy H 1 2.301 0.029 A 11 GLU HGx H 1 2.170 0.029 A 11 GLU CA C 13 57.739 0.141 A 11 GLU CB C 13 26.332 0.141 A 11 GLU CG C 13 34.130 0.141 A 11 GLU N N 15 121.406 0.109 A 12 GLU H H 1 7.688 0.029 A 12 GLU HA H 1 3.864 0.029 A 12 GLU HBy H 1 2.210 0.029 A 12 GLU HBx H 1 1.780 0.029 A 12 GLU HGy H 1 2.267 0.029 A 12 GLU HGx H 1 2.144 0.029 A 12 GLU CA C 13 56.542 0.141 A 12 GLU CB C 13 27.796 0.141 A 12 GLU CG C 13 35.086 0.141 A 12 GLU N N 15 120.601 0.109 A 13 LEU H H 1 8.172 0.029 A 13 LEU HA H 1 3.755 0.029 A 13 LEU HBy H 1 1.714 0.029 A 13 LEU HBx H 1 1.050 0.029 A 13 LEU HDx% H 1 0.772 0.029 A 13 LEU HDy% H 1 0.651 0.029 A 13 LEU HG H 1 1.704 0.029 A 13 LEU CA C 13 54.855 0.141 A 13 LEU CB C 13 40.140 0.141 A 13 LEU CD1 C 13 23.935 0.141 A 13 LEU CD2 C 13 21.255 0.141 A 13 LEU CG C 13 23.793 0.141 A 13 LEU N N 15 117.867 0.109 A 14 THR H H 1 8.166 0.029 A 14 THR HA H 1 3.256 0.029 A 14 THR HB H 1 4.145 0.029 A 14 THR HG2% H 1 1.005 0.029 A 14 THR CA C 13 64.768 0.141 A 14 THR CB C 13 65.545 0.141 A 14 THR CG2 C 13 18.626 0.141 A 14 THR N N 15 115.136 0.109 A 15 GLU H H 1 7.504 0.029 A 15 GLU HA H 1 3.857 0.029 A 15 GLU HBx H 1 1.949 0.029 A 15 GLU HBy H 1 1.949 0.029 A 15 GLU HGx H 1 2.221 0.029 A 15 GLU HGy H 1 2.254 0.029 A 15 GLU CA C 13 56.467 0.141 A 15 GLU CB C 13 26.370 0.141 A 15 GLU CG C 13 33.020 0.141 A 15 GLU N N 15 120.674 0.109 A 16 ILE H H 1 7.162 0.029 A 16 ILE HA H 1 3.602 0.029 A 16 ILE HB H 1 1.615 0.029 A 16 ILE HD1% H 1 0.705 0.029 A 16 ILE HG1y H 1 1.643 0.029 A 16 ILE HG1x H 1 0.950 0.029 A 16 ILE HG2% H 1 0.663 0.029 A 16 ILE CA C 13 62.428 0.141 A 16 ILE CB C 13 35.913 0.141 A 16 ILE CD1 C 13 11.226 0.141 A 16 ILE CG1 C 13 26.702 0.141 A 16 ILE CG2 C 13 14.224 0.141 A 16 ILE N N 15 119.946 0.109 A 17 VAL H H 1 7.539 0.029 A 17 VAL HA H 1 3.001 0.029 A 17 VAL HB H 1 1.580 0.029 A 17 VAL HGx% H 1 -0.071 0.029 A 17 VAL HGy% H 1 0.427 0.029 A 17 VAL CA C 13 64.706 0.141 A 17 VAL CB C 13 28.391 0.141 A 17 VAL CG1 C 13 18.652 0.141 A 17 VAL CG2 C 13 20.313 0.141 A 17 VAL N N 15 120.087 0.109 A 18 ARG H H 1 8.708 0.029 A 18 ARG HA H 1 3.438 0.029 A 18 ARG HBx H 1 1.673 0.029 A 18 ARG HBy H 1 1.756 0.029 A 18 ARG HDy H 1 3.114 0.029 A 18 ARG HDx H 1 3.079 0.029 A 18 ARG HGy H 1 1.412 0.029 A 18 ARG HGx H 1 1.373 0.029 A 18 ARG CA C 13 57.834 0.141 A 18 ARG CB C 13 27.388 0.141 A 18 ARG CD C 13 40.348 0.141 A 18 ARG CG C 13 25.073 0.141 A 18 ARG N N 15 121.099 0.109 A 19 ASP H H 1 8.286 0.029 A 19 ASP HA H 1 4.215 0.029 A 19 ASP HBy H 1 2.722 0.029 A 19 ASP HBx H 1 2.550 0.029 A 19 ASP CA C 13 54.604 0.141 A 19 ASP CB C 13 37.705 0.141 A 19 ASP N N 15 118.955 0.109 A 20 HIS H H 1 7.532 0.029 A 20 HIS HA H 1 4.147 0.029 A 20 HIS HBy H 1 2.889 0.029 A 20 HIS HBx H 1 2.688 0.029 A 20 HIS HD2 H 1 6.293 0.029 A 20 HIS HE1 H 1 8.381 0.029 A 20 HIS CA C 13 56.243 0.141 A 20 HIS CB C 13 26.196 0.141 A 20 HIS CD2 C 13 117.175 0.141 A 20 HIS CE1 C 13 134.866 0.141 A 20 HIS N N 15 116.419 0.109 A 21 PHE H H 1 7.983 0.029 A 21 PHE HA H 1 4.463 0.029 A 21 PHE HBy H 1 3.118 0.029 A 21 PHE HBx H 1 2.588 0.029 A 21 PHE HDx H 1 7.060 0.029 A 21 PHE HDy H 1 7.060 0.029 A 21 PHE HEx H 1 6.097 0.029 A 21 PHE HEy H 1 6.097 0.029 A 21 PHE CA C 13 58.279 0.141 A 21 PHE CB C 13 36.780 0.141 A 21 PHE CDy C 13 129.101 0.141 A 21 PHE CDx C 13 129.100 0.141 A 21 PHE CEy C 13 127.931 0.141 A 21 PHE CEx C 13 127.930 0.141 A 21 PHE N N 15 116.347 0.109 A 22 SER H H 1 8.578 0.029 A 22 SER HA H 1 4.541 0.029 A 22 SER HBx H 1 3.980 0.029 A 22 SER HBy H 1 4.027 0.029 A 22 SER CA C 13 59.013 0.141 A 22 SER CB C 13 60.225 0.141 A 22 SER N N 15 116.555 0.109 A 23 ASP H H 1 7.246 0.029 A 23 ASP HA H 1 4.581 0.029 A 23 ASP HBy H 1 2.603 0.029 A 23 ASP HBx H 1 2.573 0.029 A 23 ASP CA C 13 52.796 0.141 A 23 ASP CB C 13 38.460 0.141 A 23 ASP N N 15 118.564 0.109 A 24 MET H H 1 7.958 0.029 A 24 MET HA H 1 4.207 0.029 A 24 MET HBy H 1 2.219 0.029 A 24 MET HBx H 1 1.907 0.029 A 24 MET HE% H 1 1.547 0.029 A 24 MET HGx H 1 2.257 0.029 A 24 MET HGy H 1 2.443 0.029 A 24 MET CA C 13 53.696 0.141 A 24 MET CB C 13 32.101 0.141 A 24 MET CE C 13 13.396 0.141 A 24 MET CG C 13 29.069 0.141 A 24 MET N N 15 116.378 0.109 A 25 GLY H H 1 7.475 0.029 A 25 GLY HAy H 1 3.791 0.029 A 25 GLY HAx H 1 3.737 0.029 A 25 GLY CA C 13 42.230 0.141 A 25 GLY N N 15 107.470 0.109 A 26 GLU H H 1 8.397 0.029 A 26 GLU HA H 1 4.452 0.029 A 26 GLU HBx H 1 1.904 0.029 A 26 GLU HBy H 1 2.192 0.029 A 26 GLU HGx H 1 2.192 0.029 A 26 GLU HGy H 1 2.192 0.029 A 26 GLU CA C 13 52.851 0.141 A 26 GLU CB C 13 27.412 0.141 A 26 GLU CG C 13 33.243 0.141 A 26 GLU N N 15 117.869 0.109 A 27 ILE H H 1 8.980 0.029 A 27 ILE HA H 1 3.206 0.029 A 27 ILE HB H 1 1.549 0.029 A 27 ILE HD1% H 1 0.688 0.029 A 27 ILE HG1y H 1 1.589 0.029 A 27 ILE HG1x H 1 0.082 0.029 A 27 ILE HG2% H 1 0.367 0.029 A 27 ILE CA C 13 61.133 0.141 A 27 ILE CB C 13 36.987 0.141 A 27 ILE CD1 C 13 12.213 0.141 A 27 ILE CG1 C 13 25.826 0.141 A 27 ILE CG2 C 13 14.622 0.141 A 27 ILE N N 15 129.460 0.109 A 28 ALA H H 1 9.208 0.029 A 28 ALA HA H 1 4.492 0.029 A 28 ALA HB% H 1 1.092 0.029 A 28 ALA CA C 13 50.949 0.141 A 28 ALA CB C 13 17.101 0.141 A 28 ALA N N 15 131.875 0.109 A 29 THR H H 1 7.803 0.029 A 29 THR HA H 1 4.346 0.029 A 29 THR HB H 1 3.754 0.029 A 29 THR HG2% H 1 1.054 0.029 A 29 THR CA C 13 58.963 0.141 A 29 THR CB C 13 69.475 0.141 A 29 THR CG2 C 13 18.966 0.141 A 29 THR N N 15 112.070 0.109 A 30 LEU H H 1 8.388 0.029 A 30 LEU HA H 1 4.878 0.029 A 30 LEU HBy H 1 1.632 0.029 A 30 LEU HBx H 1 1.178 0.029 A 30 LEU HD1% H 1 0.667 0.029 A 30 LEU HD2% H 1 0.631 0.029 A 30 LEU HG H 1 1.519 0.029 A 30 LEU CA C 13 52.316 0.141 A 30 LEU CB C 13 42.195 0.141 A 30 LEU CD1 C 13 22.513 0.141 A 30 LEU CD2 C 13 23.738 0.141 A 30 LEU CG C 13 25.618 0.141 A 30 LEU N N 15 129.754 0.109 A 31 TYR H H 1 8.837 0.029 A 31 TYR HA H 1 5.108 0.029 A 31 TYR HBx H 1 2.670 0.029 A 31 TYR HBy H 1 2.914 0.029 A 31 TYR HDx H 1 6.630 0.029 A 31 TYR HEx H 1 6.473 0.029 A 31 TYR HEy H 1 6.473 0.029 A 31 TYR CA C 13 52.174 0.141 A 31 TYR CB C 13 38.406 0.141 A 31 TYR CDx C 13 131.194 0.141 A 31 TYR CEx C 13 114.717 0.141 A 31 TYR CEy C 13 114.717 0.141 A 31 TYR N N 15 124.642 0.109 A 32 VAL H H 1 8.684 0.029 A 32 VAL HA H 1 4.083 0.029 A 32 VAL HB H 1 1.871 0.029 A 32 VAL HGx% H 1 0.805 0.029 A 32 VAL HGy% H 1 0.864 0.029 A 32 VAL CA C 13 59.645 0.141 A 32 VAL CB C 13 32.016 0.141 A 32 VAL CG1 C 13 19.282 0.141 A 32 VAL CG2 C 13 19.591 0.141 A 32 VAL N N 15 121.165 0.109 A 33 GLN H H 1 9.633 0.029 A 33 GLN HA H 1 4.462 0.029 A 33 GLN HBy H 1 2.010 0.029 A 33 GLN HBx H 1 1.889 0.029 A 33 GLN HE21 H 1 6.796 0.029 A 33 GLN HE22 H 1 7.475 0.029 A 33 GLN HGy H 1 2.369 0.029 A 33 GLN HGx H 1 2.263 0.029 A 33 GLN CA C 13 54.266 0.141 A 33 GLN CB C 13 28.717 0.141 A 33 GLN CG C 13 31.805 0.141 A 33 GLN N N 15 126.911 0.109 A 33 GLN NE2 N 15 111.473 0.109 A 34 VAL H H 1 7.840 0.029 A 34 VAL HA H 1 4.313 0.029 A 34 VAL HB H 1 1.837 0.029 A 34 VAL HGx% H 1 0.805 0.029 A 34 VAL HGy% H 1 0.846 0.029 A 34 VAL CA C 13 59.270 0.141 A 34 VAL CB C 13 33.725 0.141 A 34 VAL CG1 C 13 19.366 0.141 A 34 VAL CG2 C 13 18.614 0.141 A 34 VAL N N 15 117.041 0.109 A 35 TYR H H 1 8.580 0.029 A 35 TYR HA H 1 5.415 0.029 A 35 TYR HBy H 1 2.849 0.029 A 35 TYR HBx H 1 2.671 0.029 A 35 TYR HDx H 1 7.151 0.029 A 35 TYR HDy H 1 7.151 0.029 A 35 TYR HEx H 1 6.641 0.029 A 35 TYR HEy H 1 6.641 0.029 A 35 TYR CA C 13 52.594 0.141 A 35 TYR CB C 13 38.583 0.141 A 35 TYR CDy C 13 131.208 0.141 A 35 TYR CEy C 13 115.435 0.141 A 35 TYR N N 15 128.263 0.109 A 36 GLU H H 1 8.118 0.029 A 36 GLU HA H 1 4.403 0.029 A 36 GLU HBx H 1 1.719 0.029 A 36 GLU HBy H 1 1.918 0.029 A 36 GLU HGx H 1 2.052 0.029 A 36 GLU HGy H 1 2.112 0.029 A 36 GLU CA C 13 51.421 0.141 A 36 GLU CB C 13 28.035 0.141 A 36 GLU CG C 13 33.103 0.141 A 36 GLU N N 15 129.574 0.109 A 37 SER H H 1 8.312 0.029 A 37 SER HA H 1 3.754 0.029 A 37 SER HBy H 1 3.913 0.029 A 37 SER HBx H 1 3.754 0.029 A 37 SER CA C 13 57.817 0.141 A 37 SER CB C 13 60.041 0.141 A 37 SER N N 15 121.805 0.109 A 38 SER H H 1 8.389 0.029 A 38 SER HA H 1 4.214 0.029 A 38 SER HBx H 1 3.861 0.029 A 38 SER HBy H 1 3.861 0.029 A 38 SER CA C 13 58.237 0.141 A 38 SER CB C 13 60.243 0.141 A 38 SER N N 15 116.337 0.109 A 39 LEU H H 1 6.905 0.029 A 39 LEU HA H 1 4.414 0.029 A 39 LEU HBy H 1 1.577 0.029 A 39 LEU HBx H 1 1.405 0.029 A 39 LEU HDx% H 1 0.764 0.029 A 39 LEU HDy% H 1 0.749 0.029 A 39 LEU HG H 1 1.468 0.029 A 39 LEU CA C 13 51.365 0.141 A 39 LEU CB C 13 40.504 0.141 A 39 LEU CDy C 13 22.752 0.141 A 39 LEU CDx C 13 20.029 0.141 A 39 LEU CG C 13 24.148 0.141 A 39 LEU N N 15 119.070 0.109 A 40 GLU H H 1 7.814 0.029 A 40 GLU HA H 1 3.781 0.029 A 40 GLU HBy H 1 2.380 0.029 A 40 GLU HBx H 1 2.186 0.029 A 40 GLU HGy H 1 2.425 0.029 A 40 GLU HGx H 1 2.380 0.029 A 40 GLU CA C 13 54.621 0.141 A 40 GLU CB C 13 26.307 0.141 A 40 GLU CG C 13 36.115 0.141 A 40 GLU N N 15 118.837 0.109 A 41 SER H H 1 7.452 0.029 A 41 SER HA H 1 5.730 0.029 A 41 SER HBx H 1 3.579 0.029 A 41 SER HBy H 1 3.803 0.029 A 41 SER CA C 13 52.696 0.141 A 41 SER CB C 13 63.820 0.141 A 41 SER N N 15 110.546 0.109 A 42 LEU H H 1 9.281 0.029 A 42 LEU HA H 1 5.384 0.029 A 42 LEU HBy H 1 2.040 0.029 A 42 LEU HBx H 1 1.590 0.029 A 42 LEU HDx% H 1 0.770 0.029 A 42 LEU HDy% H 1 0.886 0.029 A 42 LEU HG H 1 1.695 0.029 A 42 LEU CA C 13 51.231 0.141 A 42 LEU CB C 13 46.451 0.141 A 42 LEU CDy C 13 23.926 0.141 A 42 LEU CDx C 13 23.130 0.141 A 42 LEU CG C 13 25.056 0.141 A 42 LEU N N 15 124.649 0.109 A 43 VAL H H 1 8.849 0.029 A 43 VAL HA H 1 4.629 0.029 A 43 VAL HB H 1 1.852 0.029 A 43 VAL HGx% H 1 0.977 0.029 A 43 VAL HGy% H 1 0.977 0.029 A 43 VAL CA C 13 58.185 0.141 A 43 VAL CB C 13 33.136 0.141 A 43 VAL CGx C 13 18.580 0.141 A 43 VAL CGy C 13 18.580 0.141 A 43 VAL N N 15 125.093 0.109 A 44 GLY H H 1 7.156 0.029 A 44 GLY HAx H 1 3.545 0.029 A 44 GLY HAy H 1 4.053 0.029 A 44 GLY CA C 13 43.685 0.141 A 44 GLY N N 15 114.807 0.109 A 45 GLY H H 1 8.582 0.029 A 45 GLY HAx H 1 3.533 0.029 A 45 GLY HAy H 1 4.506 0.029 A 45 GLY CA C 13 43.268 0.141 A 45 GLY N N 15 117.443 0.109 A 46 VAL H H 1 8.875 0.029 A 46 VAL HA H 1 4.726 0.029 A 46 VAL HB H 1 1.129 0.029 A 46 VAL HGx% H 1 -0.093 0.029 A 46 VAL HGy% H 1 -0.184 0.029 A 46 VAL CA C 13 56.843 0.141 A 46 VAL CB C 13 33.568 0.141 A 46 VAL CGy C 13 18.814 0.141 A 46 VAL CGx C 13 17.856 0.141 A 46 VAL N N 15 117.075 0.109 A 47 ILE H H 1 8.765 0.029 A 47 ILE HA H 1 4.778 0.029 A 47 ILE HB H 1 1.479 0.029 A 47 ILE HD1% H 1 0.594 0.029 A 47 ILE HG1y H 1 1.296 0.029 A 47 ILE HG1x H 1 0.286 0.029 A 47 ILE HG2% H 1 0.680 0.029 A 47 ILE CB C 13 37.664 0.141 A 47 ILE CD1 C 13 10.904 0.141 A 47 ILE CG1 C 13 25.232 0.141 A 47 ILE CG2 C 13 14.728 0.141 A 47 ILE N N 15 125.899 0.109 A 48 PHE H H 1 9.269 0.029 A 48 PHE HA H 1 4.777 0.029 A 48 PHE HBx H 1 3.091 0.029 A 48 PHE HBy H 1 3.430 0.029 A 48 PHE HDx H 1 6.938 0.029 A 48 PHE HDy H 1 6.938 0.029 A 48 PHE HEx H 1 6.884 0.029 A 48 PHE HEy H 1 6.884 0.029 A 48 PHE HZ H 1 6.785 0.029 A 48 PHE CA C 13 56.162 0.141 A 48 PHE CB C 13 38.742 0.141 A 48 PHE CDx C 13 128.007 0.141 A 48 PHE CDy C 13 128.010 0.141 A 48 PHE CEx C 13 128.750 0.141 A 48 PHE CEy C 13 128.753 0.141 A 48 PHE CZ C 13 125.760 0.141 A 48 PHE N N 15 126.624 0.109 A 49 GLU H H 1 9.331 0.029 A 49 GLU HA H 1 4.021 0.029 A 49 GLU HBy H 1 2.123 0.029 A 49 GLU HBx H 1 1.915 0.029 A 49 GLU HGy H 1 2.256 0.029 A 49 GLU HGx H 1 2.116 0.029 A 49 GLU CA C 13 56.574 0.141 A 49 GLU CB C 13 26.939 0.141 A 49 GLU CG C 13 32.882 0.141 A 49 GLU N N 15 123.550 0.109 A 50 ASP H H 1 7.674 0.029 A 50 ASP HA H 1 4.443 0.029 A 50 ASP HBy H 1 3.103 0.029 A 50 ASP HBx H 1 2.561 0.029 A 50 ASP CA C 13 51.307 0.141 A 50 ASP CB C 13 38.062 0.141 A 50 ASP N N 15 113.383 0.109 A 51 GLY H H 1 7.884 0.029 A 51 GLY HAx H 1 3.571 0.029 A 51 GLY HAy H 1 4.502 0.029 A 51 GLY CA C 13 42.245 0.141 A 51 GLY N N 15 107.745 0.109 A 52 ARG H H 1 7.880 0.029 A 52 ARG HA H 1 4.292 0.029 A 52 ARG HBy H 1 2.061 0.029 A 52 ARG HBx H 1 1.617 0.029 A 52 ARG HDx H 1 3.138 0.029 A 52 ARG HDy H 1 3.258 0.029 A 52 ARG HGy H 1 1.735 0.029 A 52 ARG HGx H 1 1.685 0.029 A 52 ARG CA C 13 55.314 0.141 A 52 ARG CB C 13 29.759 0.141 A 52 ARG CD C 13 41.278 0.141 A 52 ARG CG C 13 24.456 0.141 A 52 ARG N N 15 120.713 0.109 A 53 HIS H H 1 8.961 0.029 A 53 HIS HA H 1 5.671 0.029 A 53 HIS HBy H 1 3.343 0.029 A 53 HIS HBx H 1 3.129 0.029 A 53 HIS HD2 H 1 7.353 0.029 A 53 HIS HE1 H 1 8.423 0.029 A 53 HIS CA C 13 50.579 0.141 A 53 HIS CB C 13 29.165 0.141 A 53 HIS CD2 C 13 117.936 0.141 A 53 HIS CE1 C 13 133.977 0.141 A 53 HIS N N 15 120.216 0.109 A 54 TYR H H 1 9.259 0.029 A 54 TYR HA H 1 5.574 0.029 A 54 TYR HBx H 1 2.589 0.029 A 54 TYR HBy H 1 3.069 0.029 A 54 TYR HDx H 1 6.955 0.029 A 54 TYR HDy H 1 6.955 0.029 A 54 TYR HEx H 1 6.736 0.029 A 54 TYR HEy H 1 6.736 0.029 A 54 TYR CA C 13 53.397 0.141 A 54 TYR CB C 13 39.788 0.141 A 54 TYR CDx C 13 129.970 0.141 A 54 TYR CDy C 13 129.970 0.141 A 54 TYR CEx C 13 115.787 0.141 A 54 TYR CEy C 13 115.788 0.141 A 54 TYR N N 15 121.480 0.109 A 55 THR H H 1 9.242 0.029 A 55 THR HA H 1 5.013 0.029 A 55 THR HB H 1 4.344 0.029 A 55 THR HG2% H 1 1.142 0.029 A 55 THR CA C 13 57.994 0.141 A 55 THR CB C 13 67.733 0.141 A 55 THR CG2 C 13 19.383 0.141 A 55 THR N N 15 113.818 0.109 A 56 PHE HA H 1 5.987 0.029 A 56 PHE HBy H 1 3.427 0.029 A 56 PHE HBx H 1 2.857 0.029 A 56 PHE HDx H 1 6.628 0.029 A 56 PHE HDy H 1 6.628 0.029 A 56 PHE HEx H 1 6.100 0.029 A 56 PHE HEy H 1 6.100 0.029 A 56 PHE HZ H 1 7.151 0.029 A 56 PHE CA C 13 53.946 0.141 A 56 PHE CB C 13 42.416 0.141 A 56 PHE CDy C 13 126.087 0.141 A 56 PHE CEx C 13 127.894 0.141 A 56 PHE CZ C 13 127.158 0.141 A 57 VAL H H 1 9.076 0.029 A 57 VAL HA H 1 4.683 0.029 A 57 VAL HB H 1 1.971 0.029 A 57 VAL HGx% H 1 0.952 0.029 A 57 VAL HGy% H 1 0.868 0.029 A 57 VAL CA C 13 59.696 0.141 A 57 VAL CB C 13 33.227 0.141 A 57 VAL CGy C 13 18.967 0.141 A 57 VAL CGx C 13 18.357 0.141 A 57 VAL N N 15 120.407 0.109 A 58 TYR H H 1 9.821 0.029 A 58 TYR HA H 1 5.504 0.029 A 58 TYR HBy H 1 3.246 0.029 A 58 TYR HBx H 1 2.529 0.029 A 58 TYR HDx H 1 6.788 0.029 A 58 TYR HDy H 1 6.788 0.029 A 58 TYR HEx H 1 6.551 0.029 A 58 TYR HEy H 1 6.551 0.029 A 58 TYR CA C 13 53.883 0.141 A 58 TYR CB C 13 38.558 0.141 A 58 TYR CDy C 13 129.950 0.141 A 58 TYR CDx C 13 129.949 0.141 A 58 TYR CEx C 13 115.170 0.141 A 58 TYR CEy C 13 115.175 0.141 A 58 TYR N N 15 131.325 0.109 A 59 GLU H H 1 8.182 0.029 A 59 GLU HA H 1 4.519 0.029 A 59 GLU HBy H 1 1.915 0.029 A 59 GLU HBx H 1 1.883 0.029 A 59 GLU HGx H 1 2.063 0.029 A 59 GLU HGy H 1 2.163 0.029 A 59 GLU CA C 13 52.718 0.141 A 59 GLU CB C 13 29.084 0.141 A 59 GLU CG C 13 32.416 0.141 A 59 GLU N N 15 123.904 0.109 A 60 ASN H H 1 9.566 0.029 A 60 ASN HA H 1 4.247 0.029 A 60 ASN HBy H 1 2.828 0.029 A 60 ASN HBx H 1 2.674 0.029 A 60 ASN HD21 H 1 6.794 0.029 A 60 ASN HD22 H 1 7.640 0.029 A 60 ASN CA C 13 51.876 0.141 A 60 ASN CB C 13 34.949 0.141 A 60 ASN N N 15 123.227 0.109 A 60 ASN ND2 N 15 114.088 0.109 A 61 GLU H H 1 8.387 0.029 A 61 GLU HA H 1 3.500 0.029 A 61 GLU HBy H 1 2.182 0.029 A 61 GLU HBx H 1 2.123 0.029 A 61 GLU HGx H 1 2.116 0.029 A 61 GLU HGy H 1 2.191 0.029 A 61 GLU CA C 13 54.765 0.141 A 61 GLU CB C 13 25.167 0.141 A 61 GLU CG C 13 34.770 0.141 A 61 GLU N N 15 107.647 0.109 A 62 ASP H H 1 7.314 0.029 A 62 ASP HA H 1 4.724 0.029 A 62 ASP HBx H 1 2.382 0.029 A 62 ASP HBy H 1 2.521 0.029 A 62 ASP CB C 13 41.251 0.141 A 62 ASP N N 15 119.350 0.109 A 63 LEU H H 1 8.226 0.029 A 63 LEU HA H 1 5.037 0.029 A 63 LEU HBy H 1 1.707 0.029 A 63 LEU HBx H 1 1.030 0.029 A 63 LEU HDx% H 1 0.823 0.029 A 63 LEU HDy% H 1 0.181 0.029 A 63 LEU CA C 13 51.075 0.141 A 63 LEU CB C 13 42.312 0.141 A 63 LEU CDx C 13 22.528 0.141 A 63 LEU CDy C 13 23.573 0.141 A 63 LEU CG C 13 25.296 0.141 A 63 LEU N N 15 123.998 0.109 A 64 VAL H H 1 8.915 0.029 A 64 VAL HA H 1 4.361 0.029 A 64 VAL HB H 1 2.026 0.029 A 64 VAL HGx% H 1 0.873 0.029 A 64 VAL HGy% H 1 0.873 0.029 A 64 VAL CA C 13 58.470 0.141 A 64 VAL CB C 13 31.939 0.141 A 64 VAL CGx C 13 18.466 0.141 A 64 VAL CGy C 13 18.466 0.141 A 64 VAL N N 15 127.167 0.109 A 65 TYR H H 1 8.207 0.029 A 65 TYR HA H 1 5.893 0.029 A 65 TYR HBx H 1 3.075 0.029 A 65 TYR HBy H 1 3.351 0.029 A 65 TYR HDx H 1 6.665 0.029 A 65 TYR HDy H 1 6.665 0.029 A 65 TYR HEx H 1 6.577 0.029 A 65 TYR HEy H 1 6.577 0.029 A 65 TYR CA C 13 53.115 0.141 A 65 TYR CB C 13 39.948 0.141 A 65 TYR CDx C 13 131.072 0.141 A 65 TYR CDy C 13 131.072 0.141 A 65 TYR CEx C 13 115.370 0.141 A 65 TYR CEy C 13 115.373 0.141 A 65 TYR N N 15 121.421 0.109 A 66 GLU H H 1 8.875 0.029 A 66 GLU HA H 1 4.793 0.029 A 66 GLU HBx H 1 1.890 0.029 A 66 GLU HBy H 1 2.053 0.029 A 66 GLU HGx H 1 2.189 0.029 A 66 GLU HGy H 1 2.189 0.029 A 66 GLU CB C 13 30.949 0.141 A 66 GLU CG C 13 32.628 0.141 A 66 GLU N N 15 117.842 0.109 A 67 GLU H H 1 9.033 0.029 A 67 GLU HA H 1 4.084 0.029 A 67 GLU HBy H 1 1.847 0.029 A 67 GLU HBx H 1 1.774 0.029 A 67 GLU HGx H 1 1.931 0.029 A 67 GLU HGy H 1 2.051 0.029 A 67 GLU CA C 13 54.157 0.141 A 67 GLU CB C 13 27.697 0.141 A 67 GLU CG C 13 33.723 0.141 A 67 GLU N N 15 125.220 0.109 A 68 GLU H H 1 8.546 0.029 A 68 GLU HA H 1 4.358 0.029 A 68 GLU HBy H 1 1.821 0.029 A 68 GLU HBx H 1 1.643 0.029 A 68 GLU HGy H 1 2.037 0.029 A 68 GLU HGx H 1 1.964 0.029 A 68 GLU CA C 13 53.193 0.141 A 68 GLU CB C 13 28.405 0.141 A 68 GLU CG C 13 33.556 0.141 A 68 GLU N N 15 127.058 0.109 A 69 VAL H H 1 8.422 0.029 A 69 VAL HA H 1 4.046 0.029 A 69 VAL HB H 1 1.974 0.029 A 69 VAL HG2% H 1 0.843 0.029 A 69 VAL CA C 13 59.775 0.141 A 69 VAL CB C 13 30.174 0.141 A 69 VAL CG2 C 13 18.010 0.141 A 69 VAL N N 15 125.782 0.109 A 70 LEU H H 1 7.956 0.029 A 70 LEU HA H 1 4.128 0.029 A 70 LEU HBx H 1 1.461 0.029 A 70 LEU HBy H 1 1.461 0.029 A 70 LEU HDx% H 1 0.690 0.029 A 70 LEU HDy% H 1 0.715 0.029 A 70 LEU HG H 1 1.450 0.029 A 70 LEU CA C 13 53.892 0.141 A 70 LEU CB C 13 40.926 0.141 A 70 LEU CDx C 13 20.942 0.141 A 70 LEU CDy C 13 22.588 0.141 A 70 LEU CG C 13 24.827 0.141 A 70 LEU N N 15 132.607 0.109 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 69 VAL H A 70 LEU H 1.0 . 4.34 2 2 A 70 LEU H A 68 GLU HA 1.0 . 5.41 3 3 A 70 LEU H A 69 VAL HB 1.0 . 4.72 4 4 A 70 LEU H A 70 LEU HBx 1.0 . 3.24 5 4 A 70 LEU H A 70 LEU HBy 1.0 . 3.24 6 5 A 70 LEU H A 69 VAL HG2% 1.0 . 4.29 7 6 A 70 LEU H A 68 GLU HBx 1.0 . 5.50 8 7 A 28 ALA H A 29 THR H 1.0 . 3.18 9 8 A 28 ALA H A 48 PHE HD% 1.0 . 5.21 10 9 A 28 ALA H A 48 PHE HA 1.0 . 3.40 11 10 A 28 ALA H A 49 GLU HA 1.0 . 5.50 12 11 A 28 ALA H A 48 PHE HBy 1.0 . 5.03 13 12 A 28 ALA H A 27 ILE HB 1.0 . 4.38 14 13 A 28 ALA H A 47 ILE HG2% 1.0 . 5.22 15 14 A 28 ALA H A 46 VAL HGx% 1.0 . 5.50 16 15 A 17 VAL HGx% A 58 TYR H 1.0 . 5.50 17 16 A 58 TYR H A 41 SER HA 1.0 . 5.28 18 17 A 58 TYR H A 57 VAL HA 1.0 . 3.12 19 18 A 58 TYR H A 59 GLU H 1.0 . 5.42 20 19 A 58 TYR H A 57 VAL HB 1.0 . 4.45 21 20 A 58 TYR H A 42 LEU HBx 1.0 . 5.50 22 21 A 30 LEU H A 31 TYR H 1.0 . 4.98 23 22 A 29 THR H A 30 LEU H 1.0 . 4.80 24 23 A 30 LEU H A 31 TYR HDx 1.0 . 5.50 25 24 A 30 LEU H A 30 LEU HBy 1.0 . 3.33 26 25 A 30 LEU H A 30 LEU HD1% 1.0 . 4.71 27 26 A 46 VAL HGx% A 30 LEU H 1.0 . 5.50 28 27 A 36 GLU H A 37 SER H 1.0 . 4.73 29 28 A 36 GLU H A 35 TYR HE% 1.0 . 5.40 30 29 A 36 GLU H A 41 SER HBy 1.0 . 5.16 31 30 A 36 GLU H A 35 TYR HBy 1.0 . 4.46 32 31 A 36 GLU H A 35 TYR HBx 1.0 . 4.71 33 32 A 36 GLU H A 41 SER H 1.0 . 4.29 34 33 A 36 GLU H A 35 TYR HA 1.0 . 2.89 35 34 A 36 GLU H A 36 GLU HBy 1.0 . 3.87 36 35 A 36 GLU H A 36 GLU HBx 1.0 . 3.63 37 36 A 36 GLU H A 13 LEU HBx 1.0 . 5.38 38 37 A 28 ALA H A 27 ILE H 1.0 . 4.72 39 38 A 48 PHE HD% A 27 ILE H 1.0 . 4.96 40 39 A 48 PHE HA A 27 ILE H 1.0 . 5.50 41 40 A 27 ILE H A 26 GLU HBy 1.0 . 4.12 42 41 A 27 ILE HB A 27 ILE H 1.0 . 2.81 43 42 A 27 ILE H A 27 ILE HG1x 1.0 . 3.97 44 43 A 27 ILE H A 25 GLY HAx 1.0 . 5.50 45 43 A 27 ILE H A 25 GLY HAy 1.0 . 5.50 46 44 A 36 GLU H A 35 TYR H 1.0 . 5.34 47 45 A 35 TYR HBx A 35 TYR H 1.0 . 3.40 48 46 A 35 TYR H A 34 VAL HB 1.0 . 4.48 49 47 A 64 VAL H A 65 TYR H 1.0 . 4.69 50 48 A 54 TYR H A 68 GLU H 1.0 . 4.99 51 49 A 68 GLU H A 67 GLU HA 1.0 . 3.14 52 50 A 68 GLU H A 53 HIS HBy 1.0 . 5.40 53 51 A 68 GLU H A 53 HIS HBx 1.0 . 5.50 54 52 A 68 GLU H A 68 GLU HBy 1.0 . 3.55 55 53 A 68 GLU HBx A 68 GLU H 1.0 . 3.77 56 54 A 68 GLU H A 55 THR HG2% 1.0 . 5.50 57 55 A 33 GLN H A 43 VAL H 1.0 . 4.87 58 56 A 31 TYR HDx A 33 GLN H 1.0 . 5.50 59 57 A 33 GLN H A 34 VAL HA 1.0 . 5.27 60 58 A 33 GLN H A 33 GLN HBx 1.0 . 3.42 61 59 A 47 ILE H A 48 PHE H 1.0 . 5.50 62 60 A 48 PHE H A 50 ASP H 1.0 . 5.50 63 61 A 48 PHE H A 53 HIS HA 1.0 . 4.77 64 62 A 48 PHE H A 47 ILE HA 1.0 . 3.28 65 63 A 48 PHE HBy A 48 PHE H 1.0 . 4.17 66 64 A 48 PHE H A 52 ARG HBy 1.0 . 5.41 67 65 A 48 PHE H A 47 ILE HG1x 1.0 . 5.50 68 66 A 48 PHE HD% A 47 ILE H 1.0 . 5.50 69 67 A 54 TYR H A 47 ILE H 1.0 . 5.50 70 68 A 29 THR H A 47 ILE H 1.0 . 3.93 71 69 A 31 TYR HDx A 47 ILE H 1.0 . 5.50 72 70 A 47 ILE H A 46 VAL HA 1.0 . 2.97 73 71 A 47 ILE H A 47 ILE HG1y 1.0 . 4.27 74 72 A 47 ILE H A 53 HIS HA 1.0 . 5.50 75 73 A 69 VAL H A 68 GLU HBx 1.0 . 5.38 76 74 A 54 TYR HE% A 67 GLU H 1.0 . 5.50 77 75 A 67 GLU H A 55 THR H 1.0 . 5.50 78 76 A 67 GLU H A 54 TYR HD% 1.0 . 5.50 79 77 A 67 GLU H A 66 GLU HA 1.0 . 3.52 80 78 A 43 VAL H A 44 GLY HAx 1.0 . 5.50 81 79 A 36 GLU H A 43 VAL H 1.0 . 5.50 82 80 A 43 VAL H A 44 GLY H 1.0 . 4.76 83 81 A 43 VAL H A 43 VAL HB 1.0 . 3.23 84 82 A 58 TYR H A 42 LEU H 1.0 . 3.99 85 83 A 41 SER H A 42 LEU H 1.0 . 5.19 86 84 A 42 LEU H A 58 TYR HD% 1.0 . 4.59 87 85 A 57 VAL HA A 42 LEU H 1.0 . 5.15 88 86 A 42 LEU H A 59 GLU HA 1.0 . 4.92 89 87 A 41 SER HBy A 42 LEU H 1.0 . 3.93 90 88 A 42 LEU H A 41 SER HBx 1.0 . 4.38 91 89 A 42 LEU H A 58 TYR HBy 1.0 . 3.91 92 90 A 42 LEU HBx A 42 LEU H 1.0 . 4.10 93 91 A 42 LEU H A 42 LEU HDy% 1.0 . 4.85 94 92 A 31 TYR H A 32 VAL HA 1.0 . 4.94 95 93 A 31 TYR H A 44 GLY HAx 1.0 . 5.25 96 94 A 46 VAL HGx% A 31 TYR H 1.0 . 5.25 97 95 A 5 LYS HA A 6 LEU H 1.0 . 2.78 98 96 A 6 LEU H A 6 LEU HG 1.0 . 3.00 99 97 A 6 LEU H A 5 LYS HGx 1.0 . 4.39 100 98 A 6 LEU H A 7 MET HA 1.0 . 5.50 101 99 A 8 LYS H A 13 LEU HDy% 1.0 . 5.50 102 100 A 64 VAL H A 63 LEU H 1.0 . 5.20 103 101 A 63 LEU H A 62 ASP H 1.0 . 4.79 104 102 A 58 TYR HD% A 63 LEU H 1.0 . 4.88 105 103 A 63 LEU H A 62 ASP HA 1.0 . 2.95 106 104 A 63 LEU H A 62 ASP HBy 1.0 . 4.15 107 105 A 63 LEU H A 63 LEU HBy 1.0 . 3.33 108 106 A 63 LEU H A 63 LEU HBx 1.0 . 3.55 109 107 A 63 LEU H A 64 VAL HGx% 1.0 . 5.00 110 107 A 63 LEU H A 64 VAL HGy% 1.0 . 5.00 111 108 A 63 LEU H A 63 LEU HDy% 1.0 . 5.06 112 109 A 59 GLU H A 61 GLU H 1.0 . 5.09 113 110 A 59 GLU H A 58 TYR HE% 1.0 . 5.50 114 111 A 59 GLU H A 63 LEU HA 1.0 . 4.77 115 112 A 59 GLU H A 58 TYR HBy 1.0 . 5.50 116 113 A 59 GLU H A 59 GLU HGy 1.0 . 5.25 117 114 A 59 GLU H A 57 VAL HGy% 1.0 . 5.07 118 115 A 27 ILE H A 49 GLU H 1.0 . 5.50 119 116 A 48 PHE HD% A 49 GLU H 1.0 . 4.51 120 117 A 48 PHE HA A 49 GLU H 1.0 . 3.15 121 118 A 49 GLU H A 28 ALA HA 1.0 . 5.50 122 119 A 49 GLU H A 27 ILE HA 1.0 . 4.23 123 120 A 49 GLU H A 49 GLU HBy 1.0 . 3.16 124 121 A 49 GLU H A 49 GLU HBx 1.0 . 3.44 125 122 A 49 GLU H A 28 ALA HB% 1.0 . 4.38 126 123 A 47 ILE HG2% A 49 GLU H 1.0 . 5.50 127 124 A 49 GLU H A 27 ILE HG2% 1.0 . 5.50 128 125 A 59 GLU HGy A 60 ASN H 1.0 . 4.89 129 126 A 60 ASN H A 59 GLU HBy 1.0 . 4.33 130 127 A 59 GLU H A 60 ASN H 1.0 . 5.50 131 128 A 5 LYS HA A 5 LYS H 1.0 . 2.78 132 129 A 5 LYS H A 5 LYS HBy 1.0 . 3.02 133 130 A 8 LYS H A 7 MET H 1.0 . 4.41 134 131 A 7 MET H A 7 MET HGx 1.0 . 3.53 135 132 A 7 MET H A 7 MET HBx 1.0 . 3.12 136 133 A 7 MET H A 6 LEU HBy 1.0 . 3.52 137 133 A 7 MET H A 6 LEU HBx 1.0 . 3.52 138 134 A 37 SER H A 35 TYR HD% 1.0 . 5.38 139 135 A 37 SER H A 39 LEU H 1.0 . 5.50 140 136 A 37 SER H A 35 TYR HE% 1.0 . 4.95 141 137 A 37 SER H A 38 SER HA 1.0 . 5.33 142 138 A 37 SER H A 37 SER HBx 1.0 . 3.08 143 139 A 37 SER H A 36 GLU HBy 1.0 . 4.50 144 140 A 37 SER H A 36 GLU HBx 1.0 . 4.72 145 141 A 54 TYR H A 47 ILE HA 1.0 . 5.41 146 142 A 54 TYR H A 55 THR HG2% 1.0 . 5.50 147 143 A 35 TYR HD% A 10 GLN H 1.0 . 5.50 148 144 A 10 GLN H A 11 GLU HA 1.0 . 5.42 149 145 A 10 GLN H A 10 GLN HGy 1.0 . 4.59 150 146 A 10 GLN H A 10 GLN HGx 1.0 . 4.45 151 147 A 10 GLN H A 10 GLN HBy 1.0 . 3.09 152 148 A 10 GLN H A 10 GLN HBx 1.0 . 3.26 153 149 A 9 THR HA A 11 GLU H 1.0 . 4.48 154 150 A 11 GLU H A 14 THR HB 1.0 . 5.33 155 151 A 11 GLU H A 11 GLU HGx 1.0 . 3.98 156 152 A 11 GLU H A 11 GLU HBy 1.0 . 3.17 157 153 A 10 GLN HGx A 11 GLU H 1.0 . 5.03 158 154 A 10 GLN HBy A 11 GLU H 1.0 . 3.38 159 155 A 10 GLN HBx A 11 GLU H 1.0 . 4.14 160 156 A 10 GLN H A 11 GLU H 1.0 . 3.65 161 157 A 31 TYR HDx A 32 VAL H 1.0 . 4.68 162 158 A 32 VAL H A 31 TYR HBx 1.0 . 3.88 163 159 A 33 GLN H A 32 VAL H 1.0 . 5.04 164 160 A 18 ARG H A 19 ASP H 1.0 . 3.63 165 161 A 18 ARG H A 17 VAL H 1.0 . 3.31 166 162 A 18 ARG H A 18 ARG HBx 1.0 . 2.95 167 163 A 18 ARG H A 18 ARG HGy 1.0 . 4.53 168 164 A 30 LEU HD1% A 18 ARG H 1.0 . 4.24 169 165 A 17 VAL HGx% A 18 ARG H 1.0 . 4.44 170 166 A 3 ASP H A 4 ARG H 1.0 . 3.73 171 167 A 3 ASP H A 3 ASP HBy 1.0 . 3.76 172 168 A 3 ASP H A 4 ARG HBy 1.0 . 5.50 173 169 A 4 ARG H A 3 ASP HBy 1.0 . 4.69 174 170 A 5 LYS HBy A 4 ARG H 1.0 . 3.41 175 171 A 4 ARG H A 4 ARG HBy 1.0 . 3.77 176 172 A 54 TYR HE% A 52 ARG H 1.0 . 5.50 177 173 A 48 PHE H A 52 ARG H 1.0 . 4.45 178 174 A 52 ARG H A 53 HIS H 1.0 . 4.95 179 175 A 50 ASP H A 52 ARG H 1.0 . 4.66 180 176 A 48 PHE HD% A 52 ARG H 1.0 . 4.78 181 177 A 48 PHE HA A 52 ARG H 1.0 . 5.50 182 178 A 52 ARG H A 48 PHE HBx 1.0 . 3.53 183 179 A 52 ARG HBy A 52 ARG H 1.0 . 3.36 184 180 A 52 ARG H A 52 ARG HGx 1.0 . 3.34 185 181 A 47 ILE HG2% A 52 ARG H 1.0 . 5.50 186 182 A 14 THR HB A 15 GLU H 1.0 . 3.46 187 183 A 15 GLU H A 15 GLU HBx 1.0 . 2.96 188 183 A 15 GLU H A 15 GLU HBy 1.0 . 2.96 189 184 A 11 GLU H A 12 GLU H 1.0 . 3.46 190 185 A 12 GLU H A 9 THR H 1.0 . 4.00 191 186 A 10 GLN H A 12 GLU H 1.0 . 4.72 192 187 A 12 GLU H A 13 LEU H 1.0 . 3.23 193 188 A 14 THR HB A 12 GLU H 1.0 . 5.50 194 189 A 12 GLU H A 10 GLN HA 1.0 . 5.32 195 190 A 12 GLU H A 12 GLU HBy 1.0 . 2.88 196 191 A 12 GLU H A 12 GLU HBx 1.0 . 3.71 197 192 A 15 GLU H A 16 ILE HG1y 1.0 . 4.82 198 193 A 56 PHE HBy A 57 VAL H 1.0 . 4.07 199 194 A 57 VAL H A 56 PHE HBx 1.0 . 4.64 200 195 A 58 TYR H A 57 VAL H 1.0 . 5.50 201 196 A 67 GLU HA A 53 HIS H 1.0 . 5.50 202 197 A 48 PHE H A 53 HIS H 1.0 . 5.35 203 198 A 53 HIS H A 53 HIS HD2 1.0 . 5.42 204 199 A 53 HIS H A 51 GLY HAy 1.0 . 5.50 205 200 A 53 HIS HBx A 53 HIS H 1.0 . 3.74 206 201 A 52 ARG HBy A 53 HIS H 1.0 . 4.45 207 202 A 53 HIS H A 52 ARG HBx 1.0 . 4.26 208 203 A 47 ILE HG2% A 53 HIS H 1.0 . 5.50 209 204 A 17 VAL H A 16 ILE H 1.0 . 3.57 210 205 A 17 VAL H A 14 THR HA 1.0 . 4.55 211 206 A 17 VAL H A 17 VAL HB 1.0 . 2.99 212 207 A 17 VAL H A 13 LEU HA 1.0 . 4.87 213 208 A 18 ARG H A 16 ILE H 1.0 . 4.87 214 209 A 16 ILE H A 14 THR H 1.0 . 4.85 215 210 A 15 GLU H A 16 ILE H 1.0 . 3.11 216 211 A 16 ILE H A 13 LEU HA 1.0 . 3.92 217 212 A 16 ILE H A 15 GLU HGx 1.0 . 5.29 218 213 A 16 ILE HG1y A 16 ILE H 1.0 . 2.94 219 214 A 16 ILE H A 16 ILE HG1x 1.0 . 3.88 220 215 A 16 ILE H A 16 ILE HD1% 1.0 . 3.90 221 216 A 16 ILE H A 17 VAL HGy% 1.0 . 5.50 222 217 A 62 ASP H A 60 ASN H 1.0 . 5.41 223 218 A 62 ASP H A 61 GLU H 1.0 . 3.53 224 219 A 59 GLU H A 62 ASP H 1.0 . 3.62 225 220 A 62 ASP H A 58 TYR HE% 1.0 . 5.50 226 221 A 62 ASP H A 58 TYR HA 1.0 . 4.99 227 222 A 59 GLU HA A 62 ASP H 1.0 . 5.26 228 223 A 62 ASP H A 60 ASN HA 1.0 . 5.23 229 224 A 62 ASP H A 62 ASP HBy 1.0 . 3.64 230 225 A 62 ASP H A 59 GLU HGy 1.0 . 4.34 231 226 A 62 ASP H A 64 VAL HGx% 1.0 . 5.50 232 226 A 62 ASP H A 64 VAL HGy% 1.0 . 5.50 233 227 A 39 LEU H A 39 LEU HDy% 1.0 . 4.87 234 227 A 39 LEU H A 39 LEU HDx% 1.0 . 4.87 235 228 A 19 ASP H A 20 HIS H 1.0 . 3.49 236 229 A 19 ASP H A 15 GLU HA 1.0 . 4.55 237 230 A 19 ASP H A 16 ILE HA 1.0 . 4.17 238 231 A 19 ASP H A 18 ARG HDx 1.0 . 4.84 239 232 A 19 ASP H A 19 ASP HBy 1.0 . 3.11 240 233 A 19 ASP H A 18 ARG HBy 1.0 . 3.35 241 234 A 19 ASP H A 16 ILE HG2% 1.0 . 5.06 242 235 A 41 SER H A 40 GLU H 1.0 . 3.45 243 236 A 41 SER HA A 40 GLU H 1.0 . 5.50 244 237 A 40 GLU H A 40 GLU HA 1.0 . 2.87 245 238 A 41 SER HBx A 40 GLU H 1.0 . 5.29 246 239 A 40 GLU H A 40 GLU HBy 1.0 . 3.53 247 240 A 40 GLU H A 40 GLU HBx 1.0 . 4.17 248 241 A 40 GLU H A 39 LEU HBx 1.0 . 4.14 249 242 A 40 GLU H A 39 LEU HDy% 1.0 . 4.59 250 242 A 39 LEU HDx% A 40 GLU H 1.0 . 4.59 251 243 A 23 ASP H A 24 MET H 1.0 . 3.39 252 244 A 23 ASP H A 21 PHE HD% 1.0 . 4.69 253 245 A 23 ASP H A 20 HIS HA 1.0 . 4.77 254 246 A 23 ASP H A 22 SER HBx 1.0 . 4.27 255 247 A 23 ASP H A 23 ASP HBx 1.0 . 3.18 256 248 A 23 ASP H A 24 MET HBy 1.0 . 4.78 257 249 A 55 THR H A 66 GLU H 1.0 . 4.72 258 250 A 66 GLU H A 65 TYR HD% 1.0 . 5.50 259 251 A 54 TYR HD% A 66 GLU H 1.0 . 5.50 260 252 A 66 GLU H A 54 TYR HA 1.0 . 5.50 261 253 A 49 GLU H A 26 GLU H 1.0 . 4.94 262 254 A 27 ILE H A 26 GLU H 1.0 . 4.78 263 255 A 48 PHE HD% A 26 GLU H 1.0 . 4.14 264 256 A 48 PHE HA A 26 GLU H 1.0 . 5.50 265 257 A 26 GLU H A 25 GLY HAx 1.0 . 2.91 266 257 A 25 GLY HAy A 26 GLU H 1.0 . 2.91 267 258 A 48 PHE HBy A 26 GLU H 1.0 . 5.50 268 259 A 26 GLU H A 26 GLU HBx 1.0 . 2.91 269 260 A 11 GLU H A 13 LEU H 1.0 . 4.85 270 261 A 9 THR H A 13 LEU H 1.0 . 4.52 271 262 A 15 GLU H A 13 LEU H 1.0 . 4.50 272 263 A 35 TYR HE% A 13 LEU H 1.0 . 5.50 273 264 A 14 THR HB A 13 LEU H 1.0 . 5.39 274 265 A 13 LEU H A 14 THR HA 1.0 . 5.49 275 266 A 13 LEU H A 12 GLU HBy 1.0 . 3.42 276 267 A 13 LEU H A 13 LEU HBy 1.0 . 2.77 277 268 A 13 LEU HBx A 13 LEU H 1.0 . 3.63 278 269 A 66 GLU H A 64 VAL HGx% 1.0 . 5.50 279 269 A 64 VAL HGy% A 66 GLU H 1.0 . 5.50 280 270 A 45 GLY H A 55 THR HB 1.0 . 4.47 281 271 A 55 THR HG2% A 45 GLY H 1.0 . 5.07 282 272 A 45 GLY H A 46 VAL H 1.0 . 5.50 283 273 A 45 GLY H A 56 PHE HA 1.0 . 5.21 284 274 A 56 PHE HBx A 45 GLY H 1.0 . 5.40 285 275 A 45 GLY H A 43 VAL HGx% 1.0 . 5.50 286 275 A 45 GLY H A 43 VAL HGy% 1.0 . 5.50 287 276 A 54 TYR H A 46 VAL H 1.0 . 4.23 288 277 A 46 VAL H A 46 VAL HGy% 1.0 . 4.27 289 278 A 53 HIS HA A 46 VAL H 1.0 . 5.50 290 279 A 33 GLN H A 34 VAL H 1.0 . 3.08 291 280 A 43 VAL H A 34 VAL H 1.0 . 4.32 292 281 A 35 TYR H A 34 VAL H 1.0 . 4.61 293 282 A 35 TYR HA A 34 VAL H 1.0 . 4.99 294 283 A 44 GLY HAx A 34 VAL H 1.0 . 4.84 295 284 A 34 VAL H A 32 VAL HB 1.0 . 3.49 296 285 A 21 PHE H A 22 SER H 1.0 . 3.43 297 286 A 20 HIS H A 22 SER H 1.0 . 4.81 298 287 A 23 ASP H A 22 SER H 1.0 . 3.75 299 288 A 22 SER H A 19 ASP HA 1.0 . 4.06 300 289 A 22 SER HBx A 22 SER H 1.0 . 3.17 301 290 A 22 SER H A 18 ARG HA 1.0 . 5.08 302 291 A 22 SER H A 21 PHE HBy 1.0 . 4.57 303 292 A 22 SER H A 21 PHE HBx 1.0 . 4.00 304 293 A 22 SER H A 27 ILE HD1% 1.0 . 4.33 305 294 A 20 HIS H A 20 HIS HD2 1.0 . 5.24 306 295 A 20 HIS H A 16 ILE HA 1.0 . 5.20 307 296 A 20 HIS H A 20 HIS HBy 1.0 . 3.26 308 297 A 20 HIS H A 20 HIS HBx 1.0 . 3.64 309 298 A 18 ARG HBx A 20 HIS H 1.0 . 5.36 310 299 A 20 HIS H A 16 ILE HG2% 1.0 . 5.35 311 300 A 63 LEU HDy% A 20 HIS H 1.0 . 5.50 312 301 A 17 VAL HGx% A 20 HIS H 1.0 . 5.50 313 302 A 36 GLU HBx A 38 SER H 1.0 . 5.50 314 303 A 39 LEU H A 38 SER H 1.0 . 3.42 315 304 A 38 SER H A 36 GLU HA 1.0 . 4.24 316 305 A 38 SER H A 38 SER HBx 1.0 . 3.01 317 305 A 38 SER H A 38 SER HBy 1.0 . 3.01 318 306 A 38 SER H A 39 LEU HG 1.0 . 5.50 319 307 A 38 SER H A 39 LEU HDy% 1.0 . 5.46 320 307 A 39 LEU HDx% A 38 SER H 1.0 . 5.46 321 308 A 20 HIS H A 21 PHE H 1.0 . 3.30 322 309 A 21 PHE HD% A 21 PHE H 1.0 . 4.12 323 310 A 21 PHE H A 20 HIS HD2 1.0 . 5.50 324 311 A 21 PHE H A 18 ARG HA 1.0 . 4.37 325 312 A 21 PHE H A 21 PHE HBy 1.0 . 3.62 326 313 A 21 PHE H A 20 HIS HBy 1.0 . 3.82 327 314 A 21 PHE H A 21 PHE HBx 1.0 . 3.17 328 315 A 21 PHE H A 27 ILE HD1% 1.0 . 4.78 329 316 A 63 LEU HDy% A 21 PHE H 1.0 . 5.50 330 317 A 17 VAL HGx% A 21 PHE H 1.0 . 5.26 331 318 A 24 MET H A 22 SER HA 1.0 . 3.90 332 319 A 24 MET H A 25 GLY HAx 1.0 . 5.01 333 319 A 25 GLY HAy A 24 MET H 1.0 . 5.01 334 320 A 24 MET H A 24 MET HBy 1.0 . 3.20 335 321 A 24 MET H A 24 MET HBx 1.0 . 3.98 336 322 A 20 HIS H A 21 PHE HA 1.0 . 5.50 337 323 A 11 GLU H A 14 THR H 1.0 . 5.50 338 324 A 12 GLU H A 14 THR H 1.0 . 4.42 339 325 A 15 GLU H A 14 THR H 1.0 . 3.43 340 326 A 14 THR HB A 14 THR H 1.0 . 3.18 341 327 A 10 GLN HA A 14 THR H 1.0 . 5.04 342 328 A 12 GLU HBy A 14 THR H 1.0 . 5.23 343 329 A 14 THR H A 13 LEU HBy 1.0 . 3.46 344 330 A 14 THR H A 14 THR HG2% 1.0 . 3.81 345 331 A 13 LEU HDy% A 14 THR H 1.0 . 5.13 346 332 A 33 GLN H A 44 GLY H 1.0 . 5.02 347 333 A 44 GLY H A 45 GLY H 1.0 . 3.83 348 334 A 44 GLY H A 55 THR HA 1.0 . 5.11 349 335 A 44 GLY H A 43 VAL HB 1.0 . 4.43 350 336 A 60 ASN H A 60 ASN HD22 1.0 . 5.50 351 337 A 60 ASN HA A 60 ASN HD22 1.0 . 5.50 352 338 A 60 ASN HD22 A 61 GLU HGx 1.0 . 4.98 353 339 A 60 ASN HA A 60 ASN HD21 1.0 . 5.50 354 340 A 61 GLU HGx A 60 ASN HD21 1.0 . 5.29 355 341 A 68 GLU H A 55 THR H 1.0 . 4.88 356 342 A 55 THR H A 54 TYR HD% 1.0 . 4.95 357 343 A 67 GLU HA A 55 THR H 1.0 . 4.25 358 344 A 55 THR H A 54 TYR HBy 1.0 . 3.64 359 345 A 55 THR H A 54 TYR HBx 1.0 . 4.17 360 346 A 55 THR H A 65 TYR HA 1.0 . 5.50 361 347 A 55 THR H A 66 GLU HA 1.0 . 5.50 362 348 A 55 THR H A 65 TYR HBy 1.0 . 5.50 363 349 A 8 LYS H A 9 THR H 1.0 . 5.06 364 350 A 9 THR H A 12 GLU HA 1.0 . 5.19 365 351 A 9 THR H A 12 GLU HBy 1.0 . 3.18 366 352 A 9 THR H A 8 LYS HBx 1.0 . 3.32 367 352 A 9 THR H A 8 LYS HBy 1.0 . 3.32 368 353 A 13 LEU HDy% A 9 THR H 1.0 . 5.50 369 354 A 50 ASP H A 49 GLU H 1.0 . 3.39 370 355 A 50 ASP H A 51 GLY H 1.0 . 3.39 371 356 A 48 PHE HD% A 50 ASP H 1.0 . 5.06 372 357 A 48 PHE HA A 50 ASP H 1.0 . 4.47 373 358 A 48 PHE HBy A 50 ASP H 1.0 . 3.30 374 359 A 50 ASP H A 50 ASP HBx 1.0 . 3.50 375 360 A 50 ASP H A 49 GLU HBy 1.0 . 3.81 376 361 A 50 ASP H A 49 GLU HBx 1.0 . 3.77 377 362 A 50 ASP H A 28 ALA HB% 1.0 . 5.50 378 363 A 29 THR H A 48 PHE HA 1.0 . 5.16 379 364 A 29 THR H A 47 ILE HG2% 1.0 . 4.73 380 365 A 29 THR H A 46 VAL HGx% 1.0 . 5.50 381 366 A 33 GLN HGy A 33 GLN HE22 1.0 . 3.66 382 367 A 31 TYR HE% A 33 GLN HE21 1.0 . 5.16 383 368 A 33 GLN HE22 A 31 TYR HE% 1.0 . 5.15 384 369 A 41 SER H A 39 LEU H 1.0 . 5.46 385 370 A 41 SER H A 41 SER HBx 1.0 . 3.88 386 371 A 41 SER H A 40 GLU HBy 1.0 . 4.80 387 372 A 41 SER H A 13 LEU HDx% 1.0 . 4.85 388 373 A 35 TYR HE% A 41 SER H 1.0 . 5.50 389 374 A 41 SER H A 35 TYR HA 1.0 . 5.33 390 375 A 41 SER H A 39 LEU HA 1.0 . 5.43 391 376 A 41 SER H A 40 GLU HBx 1.0 . 5.12 392 377 A 10 GLN HGy A 10 GLN HE22 1.0 . 3.50 393 378 A 10 GLN HGy A 10 GLN HE21 1.0 . 3.88 394 379 A 10 GLN HBy A 10 GLN HE21 1.0 . 5.50 395 380 A 28 ALA HB% A 51 GLY H 1.0 . 5.50 396 381 A 51 GLY H A 50 ASP HBx 1.0 . 5.44 397 382 A 52 ARG HGx A 51 GLY H 1.0 . 5.50 398 383 A 61 GLU H A 60 ASN H 1.0 . 4.27 399 384 A 48 PHE H A 51 GLY H 1.0 . 5.04 400 385 A 47 ILE HG2% A 51 GLY H 1.0 . 5.14 401 386 A 61 GLU H A 60 ASN HD21 1.0 . 5.50 402 387 A 59 GLU HA A 61 GLU H 1.0 . 5.27 403 388 A 61 GLU H A 59 GLU HGy 1.0 . 3.90 404 389 A 26 GLU H A 25 GLY H 1.0 . 4.68 405 390 A 24 MET H A 25 GLY H 1.0 . 3.11 406 391 A 23 ASP H A 25 GLY H 1.0 . 5.21 407 392 A 24 MET HBx A 25 GLY H 1.0 . 4.72 408 393 A 25 GLY H A 23 ASP HBy 1.0 . 5.50 409 394 A 33 GLN HBx A 44 GLY HAy 1.0 . 4.38 410 395 A 44 GLY HAy A 33 GLN HGx 1.0 . 4.76 411 396 A 33 GLN H A 44 GLY HAy 1.0 . 3.57 412 397 A 33 GLN HE21 A 44 GLY HAy 1.0 . 4.70 413 398 A 33 GLN H A 44 GLY HAx 1.0 . 3.39 414 399 A 44 GLY HAx A 33 GLN HGx 1.0 . 4.27 415 400 A 44 GLY HAx A 34 VAL HGy% 1.0 . 4.76 416 401 A 44 GLY HAx A 31 TYR HE% 1.0 . 4.40 417 402 A 46 VAL H A 45 GLY HAy 1.0 . 3.45 418 403 A 46 VAL HGy% A 45 GLY HAx 1.0 . 5.50 419 404 A 46 VAL H A 45 GLY HAx 1.0 . 3.44 420 405 A 55 THR HA A 45 GLY HAx 1.0 . 3.49 421 406 A 55 THR HG2% A 45 GLY HAy 1.0 . 4.82 422 407 A 56 PHE HBy A 45 GLY H 1.0 . 5.01 423 408 A 25 GLY HAy A 26 GLU HA 1.0 . 4.78 424 409 A 50 ASP H A 51 GLY HAx 1.0 . 4.88 425 410 A 56 PHE HBx A 63 LEU HDx% 1.0 . 4.44 426 411 A 62 ASP HA A 63 LEU HBx 1.0 . 5.45 427 412 A 64 VAL H A 63 LEU HBx 1.0 . 5.19 428 413 A 25 GLY HAy A 26 GLU H 1.0 . 3.20 429 414 A 25 GLY HAy A 26 GLU HGy 1.0 . 4.95 430 414 A 25 GLY HAy A 26 GLU HGx 1.0 . 4.95 431 415 A 24 MET HBy A 25 GLY HAx 1.0 . 5.41 432 416 A 47 ILE HG2% A 51 GLY HAx 1.0 . 4.64 433 417 A 58 TYR HD% A 63 LEU HBy 1.0 . 4.51 434 418 A 30 LEU HBy A 29 THR HA 1.0 . 4.69 435 419 A 31 TYR H A 30 LEU HBy 1.0 . 5.46 436 420 A 30 LEU HBy A 27 ILE HG2% 1.0 . 4.43 437 421 A 30 LEU H A 30 LEU HBx 1.0 . 3.76 438 422 A 29 THR HA A 30 LEU HBx 1.0 . 4.90 439 423 A 25 GLY HAy A 26 GLU HBx 1.0 . 4.81 440 424 A 48 PHE HD% A 25 GLY HAx 1.0 . 4.32 441 425 A 26 GLU H A 25 GLY HAx 1.0 . 3.23 442 426 A 31 TYR H A 30 LEU HBx 1.0 . 4.80 443 427 A 46 VAL HGx% A 30 LEU HBx 1.0 . 4.40 444 428 A 52 ARG H A 52 ARG HDy 1.0 . 5.50 445 429 A 62 ASP H A 62 ASP HBx 1.0 . 3.58 446 430 A 52 ARG HDy A 52 ARG HA 1.0 . 5.50 447 431 A 63 LEU H A 62 ASP HBx 1.0 . 4.71 448 432 A 62 ASP HBx A 64 VAL HGx% 1.0 . 4.57 449 432 A 64 VAL HGy% A 62 ASP HBx 1.0 . 4.57 450 433 A 41 SER H A 39 LEU HBy 1.0 . 5.39 451 434 A 40 GLU H A 39 LEU HBy 1.0 . 4.57 452 435 A 39 LEU H A 39 LEU HBy 1.0 . 3.82 453 436 A 41 SER HBx A 39 LEU HBy 1.0 . 4.18 454 437 A 39 LEU HBy A 39 LEU HDy% 1.0 . 3.31 455 438 A 39 LEU H A 39 LEU HBx 1.0 . 3.59 456 439 A 41 SER HBx A 39 LEU HBx 1.0 . 4.13 457 440 A 39 LEU HDx% A 39 LEU HBx 1.0 . 3.37 458 441 A 41 SER H A 39 LEU HBx 1.0 . 4.41 459 442 A 30 LEU HD1% A 18 ARG HDy 1.0 . 4.77 460 443 A 13 LEU HBy A 13 LEU HDx% 1.0 . 3.55 461 444 A 13 LEU HBx A 14 THR H 1.0 . 3.60 462 445 A 13 LEU HBx A 10 GLN HA 1.0 . 4.67 463 446 A 13 LEU HBx A 35 TYR HD% 1.0 . 5.11 464 447 A 54 TYR HD% A 65 TYR HBy 1.0 . 5.50 465 448 A 54 TYR HBx A 65 TYR HBy 1.0 . 4.88 466 449 A 66 GLU H A 65 TYR HBy 1.0 . 4.27 467 450 A 66 GLU H A 54 TYR HBy 1.0 . 4.16 468 451 A 6 LEU H A 6 LEU HBy 1.0 . 3.27 469 451 A 6 LEU H A 6 LEU HBx 1.0 . 3.27 470 452 A 8 LYS H A 8 LYS HEx 1.0 . 4.66 471 452 A 8 LYS H A 8 LYS HEy 1.0 . 4.66 472 453 A 8 LYS HGy A 8 LYS HEx 1.0 . 3.04 473 453 A 8 LYS HEy A 8 LYS HGy 1.0 . 3.04 474 454 A 8 LYS HDx A 8 LYS HEx 1.0 . 2.75 475 454 A 8 LYS HDy A 8 LYS HEx 1.0 . 2.75 476 454 A 8 LYS HEy A 8 LYS HDx 1.0 . 2.75 477 454 A 8 LYS HEy A 8 LYS HDy 1.0 . 2.75 478 455 A 46 VAL H A 54 TYR HBx 1.0 . 4.53 479 456 A 54 TYR H A 54 TYR HBx 1.0 . 3.54 480 457 A 55 THR HG2% A 54 TYR HBy 1.0 . 5.50 481 458 A 65 TYR HBx A 64 VAL HGx% 1.0 . 5.50 482 458 A 64 VAL HGy% A 65 TYR HBx 1.0 . 5.50 483 459 A 7 MET HE% A 8 LYS HEx 1.0 . 5.50 484 459 A 8 LYS HEy A 7 MET HE% 1.0 . 5.50 485 460 A 48 PHE HBy A 49 GLU H 1.0 . 3.34 486 461 A 48 PHE HBy A 52 ARG H 1.0 . 3.85 487 462 A 48 PHE HBy A 52 ARG HBy 1.0 . 4.23 488 463 A 48 PHE H A 48 PHE HBx 1.0 . 3.32 489 464 A 48 PHE HBx A 52 ARG HBx 1.0 . 4.30 490 465 A 58 TYR H A 58 TYR HBy 1.0 . 3.72 491 466 A 58 TYR HBy A 63 LEU HDx% 1.0 . 4.46 492 467 A 58 TYR HBy A 17 VAL HGy% 1.0 . 4.66 493 468 A 35 TYR HBy A 35 TYR H 1.0 . 3.63 494 469 A 35 TYR HBy A 10 GLN HGx 1.0 . 4.62 495 470 A 35 TYR HBx A 32 VAL HGx% 1.0 . 4.05 496 471 A 42 LEU H A 58 TYR HBx 1.0 . 4.46 497 472 A 58 TYR H A 58 TYR HBx 1.0 . 4.00 498 473 A 29 THR HG2% A 31 TYR HBy 1.0 . 4.63 499 474 A 31 TYR H A 31 TYR HBx 1.0 . 4.07 500 475 A 23 ASP H A 23 ASP HBx 1.0 . 3.29 501 475 A 23 ASP H A 23 ASP HBy 1.0 . 3.29 502 476 A 24 MET H A 23 ASP HBx 1.0 . 4.21 503 476 A 24 MET H A 23 ASP HBy 1.0 . 4.21 504 477 A 59 GLU H A 58 TYR HBx 1.0 . 4.62 505 478 A 17 VAL HGx% A 58 TYR HBx 1.0 . 5.14 506 479 A 32 VAL H A 31 TYR HBy 1.0 . 3.52 507 480 A 31 TYR HBy A 32 VAL HGy% 1.0 . 5.50 508 481 A 50 ASP H A 50 ASP HBy 1.0 . 3.70 509 482 A 19 ASP HBy A 16 ILE HG2% 1.0 . 5.25 510 483 A 28 ALA H A 47 ILE HB 1.0 . 5.17 511 484 A 20 HIS H A 19 ASP HBy 1.0 . 3.86 512 485 A 19 ASP H A 19 ASP HBx 1.0 . 3.25 513 486 A 16 ILE HA A 19 ASP HBx 1.0 . 3.92 514 487 A 47 ILE H A 47 ILE HB 1.0 . 3.41 515 488 A 29 THR H A 47 ILE HB 1.0 . 3.60 516 489 A 27 ILE HB A 26 GLU HA 1.0 . 4.71 517 490 A 27 ILE HB A 27 ILE HD1% 1.0 . 3.60 518 491 A 46 VAL HGx% A 21 PHE HBy 1.0 . 5.28 519 492 A 40 GLU HA A 40 GLU HGy 1.0 . 3.85 520 493 A 8 LYS H A 40 GLU HGy 1.0 . 4.53 521 494 A 40 GLU H A 40 GLU HGy 1.0 . 4.57 522 495 A 7 MET HA A 40 GLU HGy 1.0 . 5.50 523 496 A 40 GLU HGx A 8 LYS HBx 1.0 . 4.34 524 496 A 8 LYS HBy A 40 GLU HGx 1.0 . 4.34 525 497 A 8 LYS H A 40 GLU HGx 1.0 . 4.38 526 498 A 40 GLU H A 40 GLU HGx 1.0 . 4.20 527 499 A 7 MET HA A 40 GLU HGx 1.0 . 4.97 528 500 A 17 VAL H A 16 ILE HB 1.0 . 3.34 529 501 A 16 ILE H A 16 ILE HB 1.0 . 3.12 530 502 A 13 LEU HA A 16 ILE HB 1.0 . 3.50 531 503 A 17 VAL HGy% A 16 ILE HB 1.0 . 4.79 532 504 A 16 ILE HB A 15 GLU HBx 1.0 . 4.93 533 504 A 15 GLU HBy A 16 ILE HB 1.0 . 4.93 534 505 A 9 THR H A 12 GLU HGy 1.0 . 4.66 535 506 A 13 LEU H A 12 GLU HGy 1.0 . 5.50 536 507 A 12 GLU H A 12 GLU HGy 1.0 . 3.72 537 508 A 12 GLU HA A 12 GLU HGy 1.0 . 3.55 538 509 A 9 THR H A 12 GLU HGx 1.0 . 4.71 539 510 A 60 ASN HD22 A 60 ASN HBy 1.0 . 3.89 540 511 A 62 ASP H A 60 ASN HBy 1.0 . 5.22 541 512 A 61 GLU H A 60 ASN HBy 1.0 . 4.84 542 513 A 61 GLU HGx A 60 ASN HBy 1.0 . 5.40 543 514 A 61 GLU H A 60 ASN HBx 1.0 . 4.66 544 515 A 60 ASN HD22 A 60 ASN HBx 1.0 . 3.62 545 516 A 61 GLU HGx A 60 ASN HBx 1.0 . 5.50 546 517 A 16 ILE HD1% A 12 GLU HGy 1.0 . 5.50 547 518 A 13 LEU H A 12 GLU HGx 1.0 . 4.91 548 519 A 12 GLU H A 12 GLU HGx 1.0 . 3.89 549 520 A 12 GLU HA A 12 GLU HGx 1.0 . 3.56 550 521 A 62 ASP HBx A 60 ASN HBy 1.0 . 5.20 551 522 A 59 GLU HBy A 60 ASN HBx 1.0 . 4.91 552 523 A 62 ASP H A 61 GLU HGy 1.0 . 5.36 553 524 A 61 GLU H A 61 GLU HGy 1.0 . 4.07 554 525 A 61 GLU HGy A 61 GLU HA 1.0 . 3.71 555 526 A 61 GLU HGy A 61 GLU HBy 1.0 . 2.40 556 527 A 61 GLU H A 61 GLU HGx 1.0 . 4.05 557 528 A 61 GLU HGx A 61 GLU HA 1.0 . 3.66 558 529 A 60 ASN HA A 61 GLU HGx 1.0 . 4.78 559 530 A 11 GLU H A 11 GLU HGy 1.0 . 4.39 560 531 A 11 GLU HA A 11 GLU HGy 1.0 . 3.71 561 532 A 12 GLU H A 11 GLU HGy 1.0 . 5.13 562 533 A 67 GLU H A 67 GLU HGy 1.0 . 4.49 563 534 A 68 GLU H A 67 GLU HGy 1.0 . 3.89 564 535 A 67 GLU HA A 67 GLU HGy 1.0 . 3.89 565 536 A 54 TYR HE% A 67 GLU HGy 1.0 . 5.26 566 537 A 67 GLU HA A 67 GLU HGx 1.0 . 4.24 567 538 A 34 VAL HB A 34 VAL H 1.0 . 3.93 568 539 A 47 ILE H A 29 THR HB 1.0 . 4.41 569 540 A 47 ILE HB A 29 THR HB 1.0 . 3.26 570 541 A 47 ILE HG1y A 29 THR HB 1.0 . 4.70 571 542 A 29 THR H A 29 THR HB 1.0 . 3.74 572 543 A 55 THR HG2% A 68 GLU HGy 1.0 . 4.96 573 544 A 68 GLU HA A 68 GLU HGx 1.0 . 4.11 574 545 A 55 THR HG2% A 68 GLU HGx 1.0 . 4.56 575 546 A 67 GLU H A 67 GLU HGx 1.0 . 4.76 576 547 A 68 GLU H A 67 GLU HGx 1.0 . 4.25 577 548 A 54 TYR H A 46 VAL HB 1.0 . 5.45 578 549 A 46 VAL H A 46 VAL HB 1.0 . 3.92 579 550 A 46 VAL HB A 21 PHE HE% 1.0 . 5.28 580 551 A 46 VAL HB A 30 LEU HD2% 1.0 . 3.79 581 552 A 31 TYR HDx A 29 THR HB 1.0 . 5.36 582 553 A 68 GLU HA A 68 GLU HGy 1.0 . 4.06 583 554 A 27 ILE H A 26 GLU HGx 1.0 . 3.96 584 554 A 27 ILE H A 26 GLU HGy 1.0 . 3.96 585 555 A 26 GLU H A 26 GLU HGx 1.0 . 3.60 586 555 A 26 GLU H A 26 GLU HGy 1.0 . 3.60 587 556 A 26 GLU HA A 26 GLU HGx 1.0 . 3.34 588 556 A 26 GLU HA A 26 GLU HGy 1.0 . 3.34 589 557 A 26 GLU HBx A 26 GLU HGx 1.0 . 2.58 590 557 A 26 GLU HBx A 26 GLU HGy 1.0 . 2.58 591 558 A 57 VAL HB A 57 VAL H 1.0 . 3.65 592 559 A 38 SER H A 36 GLU HGx 1.0 . 4.89 593 559 A 38 SER H A 36 GLU HGy 1.0 . 4.89 594 560 A 39 LEU H A 36 GLU HGx 1.0 . 4.46 595 560 A 39 LEU H A 36 GLU HGy 1.0 . 4.46 596 561 A 36 GLU H A 36 GLU HGx 1.0 . 5.00 597 561 A 36 GLU H A 36 GLU HGy 1.0 . 5.00 598 562 A 36 GLU HA A 36 GLU HGx 1.0 . 3.97 599 562 A 36 GLU HA A 36 GLU HGy 1.0 . 3.97 600 563 A 33 GLN H A 43 VAL HB 1.0 . 5.04 601 564 A 10 GLN H A 9 THR HB 1.0 . 3.18 602 565 A 50 ASP H A 49 GLU HGy 1.0 . 5.03 603 566 A 28 ALA HA A 49 GLU HGy 1.0 . 4.75 604 567 A 49 GLU HA A 49 GLU HGy 1.0 . 3.88 605 568 A 15 GLU HA A 15 GLU HGy 1.0 . 3.76 606 569 A 15 GLU HGy A 15 GLU HBx 1.0 . 2.66 607 569 A 15 GLU HBy A 15 GLU HGy 1.0 . 2.66 608 570 A 28 ALA HB% A 49 GLU HGy 1.0 . 4.51 609 571 A 15 GLU H A 15 GLU HGy 1.0 . 3.88 610 572 A 15 GLU H A 15 GLU HGx 1.0 . 3.91 611 573 A 15 GLU HGx A 15 GLU HA 1.0 . 3.77 612 574 A 43 VAL HB A 42 LEU HA 1.0 . 4.80 613 575 A 11 GLU H A 9 THR HB 1.0 . 3.02 614 576 A 49 GLU H A 49 GLU HGy 1.0 . 3.81 615 577 A 48 PHE HA A 49 GLU HGy 1.0 . 5.25 616 578 A 50 ASP H A 49 GLU HGx 1.0 . 5.50 617 579 A 49 GLU HA A 49 GLU HGx 1.0 . 3.89 618 580 A 66 GLU H A 66 GLU HGx 1.0 . 4.26 619 580 A 66 GLU H A 66 GLU HGy 1.0 . 4.26 620 581 A 66 GLU HA A 66 GLU HGx 1.0 . 3.86 621 581 A 66 GLU HA A 66 GLU HGy 1.0 . 3.86 622 582 A 66 GLU HBx A 66 GLU HGx 1.0 . 2.88 623 582 A 66 GLU HGy A 66 GLU HBx 1.0 . 2.88 624 583 A 62 ASP HBx A 59 GLU HGx 1.0 . 4.84 625 584 A 59 GLU H A 59 GLU HGx 1.0 . 4.88 626 585 A 33 GLN H A 32 VAL HB 1.0 . 4.89 627 586 A 32 VAL HB A 10 GLN HE22 1.0 . 4.47 628 587 A 24 MET HBy A 21 PHE HBy 1.0 . 5.21 629 588 A 64 VAL H A 64 VAL HB 1.0 . 3.64 630 589 A 63 LEU HA A 64 VAL HB 1.0 . 4.91 631 590 A 32 VAL H A 32 VAL HB 1.0 . 3.02 632 591 A 32 VAL HB A 10 GLN HE21 1.0 . 4.43 633 592 A 55 THR H A 55 THR HB 1.0 . 4.03 634 593 A 33 GLN H A 33 GLN HGy 1.0 . 4.31 635 594 A 33 GLN HGy A 31 TYR HE% 1.0 . 4.68 636 595 A 33 GLN HGy A 44 GLY HAy 1.0 . 4.73 637 596 A 33 GLN HGy A 33 GLN HA 1.0 . 3.73 638 597 A 44 GLY HAx A 33 GLN HGy 1.0 . 4.37 639 598 A 33 GLN HGx A 34 VAL HGy% 1.0 . 4.72 640 599 A 33 GLN H A 33 GLN HGx 1.0 . 4.17 641 600 A 33 GLN HE22 A 33 GLN HGx 1.0 . 3.96 642 601 A 33 GLN HGx A 33 GLN HA 1.0 . 3.75 643 602 A 65 TYR H A 64 VAL HB 1.0 . 4.00 644 603 A 8 LYS HBx A 8 LYS HEx 1.0 . 4.48 645 603 A 8 LYS HBy A 8 LYS HEx 1.0 . 4.48 646 603 A 8 LYS HEy A 8 LYS HBx 1.0 . 4.48 647 603 A 8 LYS HBy A 8 LYS HEy 1.0 . 4.48 648 604 A 32 VAL HA A 33 GLN HGx 1.0 . 5.29 649 605 A 13 LEU H A 8 LYS HBx 1.0 . 4.53 650 605 A 13 LEU H A 8 LYS HBy 1.0 . 4.53 651 606 A 40 GLU HA A 8 LYS HBx 1.0 . 5.27 652 606 A 40 GLU HA A 8 LYS HBy 1.0 . 5.27 653 607 A 8 LYS H A 8 LYS HBx 1.0 . 3.27 654 607 A 8 LYS H A 8 LYS HBy 1.0 . 3.27 655 608 A 8 LYS HGx A 8 LYS HBx 1.0 . 2.84 656 608 A 8 LYS HBy A 8 LYS HGx 1.0 . 2.84 657 609 A 67 GLU H A 66 GLU HBy 1.0 . 4.27 658 610 A 65 TYR HD% A 66 GLU HBy 1.0 . 4.73 659 611 A 67 GLU H A 66 GLU HBx 1.0 . 4.35 660 612 A 10 GLN HGy A 10 GLN HA 1.0 . 3.90 661 613 A 35 TYR HD% A 10 GLN HGx 1.0 . 5.33 662 614 A 35 TYR HE% A 10 GLN HGx 1.0 . 5.33 663 615 A 8 LYS H A 7 MET HBy 1.0 . 4.08 664 616 A 7 MET H A 7 MET HBy 1.0 . 3.63 665 617 A 8 LYS H A 7 MET HBx 1.0 . 4.13 666 618 A 7 MET HBx A 6 LEU HA 1.0 . 5.14 667 619 A 35 TYR HBy A 10 GLN HGy 1.0 . 5.27 668 620 A 5 LYS H A 5 LYS HBx 1.0 . 3.46 669 621 A 69 VAL H A 69 VAL HB 1.0 . 3.74 670 622 A 5 LYS HBx A 6 LEU HDy% 1.0 . 4.78 671 623 A 8 LYS H A 7 MET HGy 1.0 . 5.13 672 624 A 7 MET H A 7 MET HGy 1.0 . 3.77 673 625 A 7 MET HA A 7 MET HGy 1.0 . 4.11 674 626 A 7 MET HA A 7 MET HGx 1.0 . 4.15 675 627 A 8 LYS H A 7 MET HGx 1.0 . 4.95 676 628 A 14 THR HB A 15 GLU HBx 1.0 . 5.20 677 628 A 14 THR HB A 15 GLU HBy 1.0 . 5.20 678 629 A 48 PHE HD% A 52 ARG HBy 1.0 . 4.01 679 630 A 52 ARG HBy A 48 PHE HBx 1.0 . 3.78 680 631 A 54 TYR HD% A 52 ARG HBx 1.0 . 4.35 681 632 A 52 ARG HBx A 52 ARG HDx 1.0 . 4.21 682 633 A 30 LEU HD1% A 14 THR HB 1.0 . 5.44 683 634 A 53 HIS HBy A 68 GLU HBy 1.0 . 4.50 684 635 A 54 TYR H A 53 HIS HBy 1.0 . 4.54 685 636 A 53 HIS HBy A 53 HIS H 1.0 . 3.78 686 637 A 47 ILE HG2% A 53 HIS HBy 1.0 . 5.47 687 638 A 53 HIS HBy A 47 ILE HG1x 1.0 . 5.50 688 639 A 53 HIS HBy A 52 ARG HA 1.0 . 5.50 689 640 A 54 TYR H A 53 HIS HBx 1.0 . 5.11 690 641 A 53 HIS HBx A 52 ARG HA 1.0 . 4.84 691 642 A 68 GLU HBx A 53 HIS HBx 1.0 . 4.52 692 643 A 47 ILE HG2% A 53 HIS HBx 1.0 . 5.22 693 644 A 68 GLU HBx A 53 HIS HBy 1.0 . 4.46 694 645 A 53 HIS HBx A 68 GLU HBy 1.0 . 4.58 695 646 A 53 HIS HBx A 47 ILE HG1x 1.0 . 4.88 696 647 A 24 MET H A 24 MET HGy 1.0 . 4.19 697 648 A 21 PHE HA A 24 MET HGy 1.0 . 5.09 698 649 A 24 MET H A 24 MET HGx 1.0 . 3.91 699 650 A 21 PHE HA A 24 MET HGx 1.0 . 5.40 700 651 A 30 LEU HD1% A 14 THR HA 1.0 . 5.50 701 652 A 17 VAL HGx% A 14 THR HA 1.0 . 5.27 702 653 A 33 GLN HBx A 34 VAL HGy% 1.0 . 3.99 703 654 A 20 HIS HD2 A 17 VAL HA 1.0 . 5.50 704 655 A 31 TYR HE% A 33 GLN HBy 1.0 . 5.50 705 656 A 33 GLN H A 33 GLN HBy 1.0 . 3.67 706 657 A 34 VAL HGy% A 33 GLN HBy 1.0 . 4.23 707 658 A 33 GLN HE22 A 33 GLN HBy 1.0 . 5.11 708 659 A 33 GLN HBx A 34 VAL H 1.0 . 4.08 709 660 A 33 GLN HBx A 44 GLY HAx 1.0 . 4.29 710 661 A 19 ASP H A 17 VAL HA 1.0 . 5.28 711 662 A 68 GLU HBx A 69 VAL HA 1.0 . 5.33 712 663 A 17 VAL HB A 30 LEU HD2% 1.0 . 4.68 713 664 A 18 ARG H A 17 VAL HB 1.0 . 3.48 714 665 A 14 THR HA A 17 VAL HB 1.0 . 3.54 715 666 A 68 GLU HBy A 55 THR HG2% 1.0 . 5.50 716 667 A 41 SER HBy A 36 GLU HBy 1.0 . 4.41 717 668 A 41 SER H A 36 GLU HBy 1.0 . 4.59 718 669 A 36 GLU HBy A 39 LEU H 1.0 . 4.31 719 670 A 36 GLU HBy A 41 SER HBx 1.0 . 4.05 720 671 A 36 GLU HBy A 13 LEU HDx% 1.0 . 4.13 721 672 A 13 LEU H A 12 GLU HBx 1.0 . 3.60 722 673 A 36 GLU HBx A 39 LEU H 1.0 . 4.59 723 674 A 41 SER HBy A 39 LEU HBy 1.0 . 5.40 724 675 A 41 SER HBy A 39 LEU HBx 1.0 . 4.55 725 676 A 36 GLU H A 41 SER HBx 1.0 . 5.03 726 677 A 12 GLU HBy A 8 LYS HA 1.0 . 4.68 727 678 A 36 GLU HBy A 39 LEU HBx 1.0 . 3.46 728 679 A 69 VAL HG2% A 67 GLU HBx 1.0 . 4.63 729 680 A 41 SER H A 36 GLU HBx 1.0 . 4.35 730 681 A 35 TYR HA A 36 GLU HBx 1.0 . 4.67 731 682 A 36 GLU HBx A 41 SER HBx 1.0 . 3.99 732 683 A 36 GLU HBx A 39 LEU HBx 1.0 . 4.04 733 684 A 36 GLU HBy A 40 GLU HA 1.0 . 5.09 734 685 A 54 TYR HE% A 67 GLU HBy 1.0 . 4.91 735 686 A 67 GLU H A 67 GLU HBy 1.0 . 3.51 736 687 A 67 GLU H A 67 GLU HBx 1.0 . 3.63 737 688 A 9 THR H A 12 GLU HBx 1.0 . 4.56 738 689 A 66 GLU HA A 67 GLU HBx 1.0 . 4.99 739 690 A 12 GLU HBy A 9 THR HG2% 1.0 . 4.91 740 691 A 69 VAL HG2% A 67 GLU HBy 1.0 . 4.92 741 692 A 66 GLU HA A 67 GLU HBy 1.0 . 5.11 742 693 A 54 TYR HE% A 67 GLU HBx 1.0 . 4.60 743 694 A 13 LEU HDy% A 12 GLU HBy 1.0 . 4.94 744 695 A 18 ARG HDx A 18 ARG HBy 1.0 . 3.93 745 696 A 13 LEU HDy% A 12 GLU HBx 1.0 . 4.18 746 697 A 26 GLU HBx A 26 GLU HA 1.0 . 2.93 747 698 A 18 ARG H A 18 ARG HBy 1.0 . 3.46 748 699 A 18 ARG HBy A 14 THR HG2% 1.0 . 4.99 749 700 A 18 ARG HBx A 15 GLU HA 1.0 . 3.58 750 701 A 18 ARG HBx A 18 ARG HDx 1.0 . 3.86 751 702 A 19 ASP H A 18 ARG HBx 1.0 . 3.83 752 703 A 40 GLU HGy A 8 LYS HDx 1.0 . 4.99 753 703 A 8 LYS HDy A 40 GLU HGy 1.0 . 4.99 754 704 A 8 LYS H A 8 LYS HDx 1.0 . 4.41 755 704 A 8 LYS H A 8 LYS HDy 1.0 . 4.41 756 705 A 8 LYS HA A 8 LYS HDx 1.0 . 3.98 757 705 A 8 LYS HDy A 8 LYS HA 1.0 . 3.98 758 706 A 12 GLU HBy A 8 LYS HDx 1.0 . 4.35 759 706 A 12 GLU HBy A 8 LYS HDy 1.0 . 4.35 760 707 A 9 THR H A 8 LYS HDx 1.0 . 4.95 761 707 A 9 THR H A 8 LYS HDy 1.0 . 4.95 762 708 A 40 GLU HA A 8 LYS HDx 1.0 . 5.50 763 708 A 40 GLU HA A 8 LYS HDy 1.0 . 5.50 764 709 A 49 GLU HBy A 28 ALA HB% 1.0 . 4.75 765 710 A 48 PHE HA A 49 GLU HBy 1.0 . 5.16 766 711 A 17 VAL H A 16 ILE HG1y 1.0 . 4.94 767 712 A 16 ILE HG1y A 13 LEU HA 1.0 . 5.16 768 713 A 12 GLU H A 8 LYS HDx 1.0 . 5.50 769 713 A 12 GLU H A 8 LYS HDy 1.0 . 5.50 770 714 A 13 LEU HA A 16 ILE HG1x 1.0 . 4.82 771 715 A 18 ARG H A 16 ILE HA 1.0 . 5.50 772 716 A 16 ILE HA A 19 ASP HBy 1.0 . 3.81 773 717 A 16 ILE HG1y A 16 ILE HA 1.0 . 3.24 774 718 A 16 ILE HG1x A 16 ILE HA 1.0 . 3.28 775 719 A 58 TYR HE% A 40 GLU HBx 1.0 . 5.34 776 720 A 11 GLU HBy A 9 THR HB 1.0 . 4.57 777 721 A 14 THR HG2% A 15 GLU HBx 1.0 . 5.00 778 721 A 15 GLU HBy A 14 THR HG2% 1.0 . 5.00 779 722 A 16 ILE H A 15 GLU HBx 1.0 . 3.54 780 722 A 15 GLU HBy A 16 ILE H 1.0 . 3.54 781 723 A 15 GLU HA A 15 GLU HBx 1.0 . 2.71 782 723 A 15 GLU HBy A 15 GLU HA 1.0 . 2.71 783 724 A 15 GLU HGx A 15 GLU HBx 1.0 . 2.76 784 724 A 15 GLU HBy A 15 GLU HGx 1.0 . 2.76 785 725 A 16 ILE HG2% A 15 GLU HBx 1.0 . 5.29 786 725 A 15 GLU HBy A 16 ILE HG2% 1.0 . 5.29 787 726 A 11 GLU HBy A 12 GLU H 1.0 . 3.74 788 727 A 12 GLU HGy A 11 GLU HBx 1.0 . 3.96 789 728 A 11 GLU H A 11 GLU HBx 1.0 . 3.47 790 729 A 12 GLU H A 11 GLU HBx 1.0 . 3.82 791 730 A 63 LEU HDy% A 20 HIS HBy 1.0 . 4.22 792 731 A 17 VAL HGx% A 20 HIS HBy 1.0 . 5.50 793 732 A 21 PHE H A 20 HIS HBx 1.0 . 4.17 794 733 A 63 LEU HDy% A 20 HIS HBx 1.0 . 4.40 795 734 A 58 TYR HE% A 40 GLU HBy 1.0 . 5.50 796 735 A 40 GLU HBy A 8 LYS HBx 1.0 . 4.62 797 735 A 40 GLU HBy A 8 LYS HBy 1.0 . 4.62 798 736 A 40 GLU HBx A 13 LEU HDx% 1.0 . 4.55 799 737 A 16 ILE HG1y A 15 GLU HBx 1.0 . 4.47 800 737 A 15 GLU HBy A 16 ILE HG1y 1.0 . 4.47 801 738 A 46 VAL HB A 27 ILE HG1y 1.0 . 5.50 802 739 A 27 ILE H A 27 ILE HG1y 1.0 . 3.43 803 740 A 28 ALA H A 27 ILE HG1x 1.0 . 5.08 804 741 A 27 ILE HG1x A 21 PHE HBx 1.0 . 5.50 805 742 A 48 PHE HD% A 27 ILE HG1x 1.0 . 4.64 806 743 A 48 PHE HA A 27 ILE HG1x 1.0 . 5.34 807 744 A 30 LEU HBx A 27 ILE HG1y 1.0 . 5.29 808 745 A 27 ILE HG1x A 46 VAL HB 1.0 . 5.50 809 746 A 30 LEU H A 30 LEU HG 1.0 . 4.82 810 747 A 46 VAL HGx% A 30 LEU HG 1.0 . 4.10 811 748 A 28 ALA H A 27 ILE HA 1.0 . 2.93 812 749 A 29 THR H A 27 ILE HA 1.0 . 4.28 813 750 A 48 PHE HD% A 27 ILE HA 1.0 . 4.10 814 751 A 48 PHE HA A 27 ILE HA 1.0 . 3.08 815 752 A 27 ILE HA A 26 GLU HA 1.0 . 5.02 816 753 A 27 ILE HA A 27 ILE HG1y 1.0 . 3.48 817 754 A 27 ILE HA A 27 ILE HD1% 1.0 . 4.70 818 755 A 27 ILE HG1x A 27 ILE HA 1.0 . 3.59 819 756 A 60 ASN HBy A 61 GLU HBy 1.0 . 5.02 820 757 A 62 ASP H A 61 GLU HBx 1.0 . 5.28 821 758 A 58 TYR HE% A 61 GLU HBx 1.0 . 5.50 822 759 A 47 ILE HA A 47 ILE HG1y 1.0 . 4.04 823 760 A 47 ILE H A 47 ILE HG1x 1.0 . 4.55 824 761 A 47 ILE HG1x A 53 HIS HD2 1.0 . 5.15 825 762 A 47 ILE HG1x A 31 TYR HE% 1.0 . 4.96 826 763 A 53 HIS HA A 47 ILE HG1x 1.0 . 4.70 827 764 A 47 ILE HA A 47 ILE HG1x 1.0 . 3.82 828 765 A 47 ILE HG1x A 28 ALA HB% 1.0 . 5.50 829 766 A 54 TYR H A 47 ILE HG1x 1.0 . 5.08 830 767 A 32 VAL HGy% A 42 LEU HG 1.0 . 3.60 831 768 A 42 LEU H A 42 LEU HG 1.0 . 5.31 832 769 A 18 ARG H A 18 ARG HGx 1.0 . 4.75 833 770 A 19 ASP H A 18 ARG HGy 1.0 . 5.07 834 771 A 30 LEU HD1% A 18 ARG HGx 1.0 . 3.82 835 772 A 47 ILE HG1x A 29 THR HB 1.0 . 5.28 836 773 A 17 VAL HGy% A 42 LEU HG 1.0 . 5.50 837 774 A 42 LEU HA A 42 LEU HG 1.0 . 4.01 838 775 A 13 LEU HBx A 42 LEU HG 1.0 . 3.45 839 776 A 70 LEU HA A 70 LEU HG 1.0 . 4.25 840 777 A 70 LEU H A 70 LEU HG 1.0 . 4.07 841 778 A 10 GLN HBy A 10 GLN HE22 1.0 . 4.92 842 779 A 10 GLN HBy A 9 THR HA 1.0 . 5.50 843 780 A 35 TYR HD% A 10 GLN HBy 1.0 . 5.25 844 781 A 10 GLN HBx A 9 THR HA 1.0 . 4.99 845 782 A 35 TYR HD% A 10 GLN HBx 1.0 . 4.87 846 783 A 53 HIS H A 52 ARG HGy 1.0 . 5.05 847 784 A 5 LYS HA A 6 LEU HG 1.0 . 4.11 848 785 A 6 LEU HG A 6 LEU HA 1.0 . 4.11 849 786 A 22 SER H A 22 SER HBy 1.0 . 3.60 850 787 A 18 ARG HGy A 22 SER HBy 1.0 . 5.50 851 788 A 23 ASP H A 22 SER HBy 1.0 . 4.81 852 789 A 18 ARG HGy A 22 SER HBx 1.0 . 5.33 853 790 A 22 SER HBx A 27 ILE HD1% 1.0 . 4.52 854 791 A 52 ARG H A 52 ARG HGy 1.0 . 4.03 855 792 A 52 ARG HA A 52 ARG HGy 1.0 . 3.93 856 793 A 27 ILE HD1% A 22 SER HBy 1.0 . 4.73 857 794 A 39 LEU H A 38 SER HBx 1.0 . 3.88 858 794 A 39 LEU H A 38 SER HBy 1.0 . 3.88 859 795 A 39 LEU HG A 38 SER HBx 1.0 . 4.34 860 795 A 38 SER HBy A 39 LEU HG 1.0 . 4.34 861 796 A 54 TYR HE% A 52 ARG HGy 1.0 . 5.50 862 797 A 37 SER H A 37 SER HBy 1.0 . 3.56 863 798 A 35 TYR HE% A 37 SER HBy 1.0 . 3.94 864 799 A 35 TYR HE% A 37 SER HBx 1.0 . 3.87 865 800 A 39 LEU H A 39 LEU HG 1.0 . 3.90 866 801 A 39 LEU HG A 39 LEU HA 1.0 . 4.00 867 802 A 57 VAL HA A 57 VAL HGx% 1.0 . 3.69 868 803 A 70 LEU H A 69 VAL HA 1.0 . 2.79 869 804 A 35 TYR HE% A 13 LEU HG 1.0 . 5.26 870 805 A 35 TYR HA A 13 LEU HDx% 1.0 . 5.50 871 806 A 40 GLU HA A 13 LEU HDx% 1.0 . 3.46 872 807 A 10 GLN HA A 13 LEU HDx% 1.0 . 4.41 873 808 A 33 GLN H A 32 VAL HA 1.0 . 2.87 874 809 A 32 VAL HA A 34 VAL H 1.0 . 3.76 875 810 A 44 GLY HAx A 32 VAL HA 1.0 . 3.62 876 811 A 69 VAL HA A 70 LEU HBx 1.0 . 4.79 877 811 A 70 LEU HBy A 69 VAL HA 1.0 . 4.79 878 812 A 69 VAL HG2% A 69 VAL HA 1.0 . 3.33 879 813 A 13 LEU HA A 13 LEU HG 1.0 . 4.14 880 814 A 13 LEU H A 13 LEU HDx% 1.0 . 3.69 881 815 A 35 TYR HD% A 13 LEU HDx% 1.0 . 3.98 882 816 A 13 LEU HBx A 13 LEU HDx% 1.0 . 3.27 883 817 A 14 THR HA A 42 LEU HDx% 1.0 . 5.50 884 818 A 21 PHE HE% A 30 LEU HD2% 1.0 . 5.50 885 819 A 30 LEU HD2% A 30 LEU HA 1.0 . 3.93 886 820 A 18 ARG HA A 30 LEU HD2% 1.0 . 3.64 887 821 A 21 PHE HBx A 30 LEU HD2% 1.0 . 5.50 888 822 A 30 LEU HBy A 30 LEU HD2% 1.0 . 3.33 889 823 A 30 LEU HBx A 30 LEU HD2% 1.0 . 3.06 890 824 A 46 VAL HGx% A 30 LEU HD2% 1.0 . 3.33 891 825 A 63 LEU HDy% A 56 PHE HE% 1.0 . 5.50 892 826 A 63 LEU HDy% A 63 LEU HA 1.0 . 5.50 893 827 A 63 LEU HBy A 63 LEU HDy% 1.0 . 3.77 894 828 A 63 LEU HBx A 63 LEU HDy% 1.0 . 3.87 895 829 A 35 TYR H A 34 VAL HA 1.0 . 2.57 896 830 A 34 VAL HA A 34 VAL HGx% 1.0 . 3.08 897 831 A 35 TYR HA A 34 VAL HA 1.0 . 4.95 898 832 A 8 LYS H A 8 LYS HGy 1.0 . 3.94 899 833 A 8 LYS HGy A 8 LYS HA 1.0 . 3.83 900 834 A 13 LEU HDy% A 8 LYS HGy 1.0 . 4.65 901 835 A 9 THR H A 8 LYS HGy 1.0 . 4.93 902 836 A 40 GLU HA A 8 LYS HGy 1.0 . 5.00 903 837 A 8 LYS HGy A 40 GLU HGy 1.0 . 5.50 904 838 A 8 LYS H A 8 LYS HGx 1.0 . 4.10 905 839 A 8 LYS HGx A 8 LYS HEx 1.0 . 4.19 906 839 A 8 LYS HEy A 8 LYS HGx 1.0 . 4.19 907 840 A 35 TYR HBy A 42 LEU HDy% 1.0 . 5.44 908 841 A 22 SER HBx A 22 SER HA 1.0 . 2.86 909 842 A 30 LEU H A 29 THR HA 1.0 . 2.59 910 843 A 42 LEU HDy% A 14 THR H 1.0 . 4.27 911 844 A 42 LEU HDy% A 35 TYR HD% 1.0 . 4.47 912 845 A 42 LEU HDy% A 42 LEU HA 1.0 . 3.83 913 846 A 42 LEU HDy% A 14 THR HA 1.0 . 3.49 914 847 A 42 LEU HDy% A 42 LEU HBy 1.0 . 3.47 915 848 A 13 LEU HBx A 42 LEU HDy% 1.0 . 2.64 916 849 A 42 LEU HDy% A 17 VAL HGy% 1.0 . 3.82 917 850 A 27 ILE HG2% A 29 THR HA 1.0 . 4.14 918 851 A 41 SER HBx A 39 LEU HDx% 1.0 . 4.55 919 852 A 65 TYR H A 64 VAL HA 1.0 . 3.05 920 853 A 39 LEU HDx% A 40 GLU H 1.0 . 4.97 921 854 A 36 GLU HBy A 39 LEU HDx% 1.0 . 4.27 922 855 A 39 LEU H A 39 LEU HDx% 1.0 . 4.55 923 856 A 39 LEU HDx% A 39 LEU HA 1.0 . 4.11 924 857 A 64 VAL H A 63 LEU HDx% 1.0 . 3.96 925 858 A 58 TYR HD% A 63 LEU HDx% 1.0 . 3.77 926 859 A 63 LEU HA A 63 LEU HDx% 1.0 . 3.68 927 860 A 63 LEU HDx% A 58 TYR HBx 1.0 . 3.94 928 861 A 17 VAL HGy% A 63 LEU HDx% 1.0 . 4.06 929 862 A 17 VAL HGx% A 63 LEU HDx% 1.0 . 4.21 930 863 A 70 LEU H A 70 LEU HDy% 1.0 . 5.29 931 864 A 70 LEU HDy% A 70 LEU HBx 1.0 . 3.35 932 864 A 70 LEU HBy A 70 LEU HDy% 1.0 . 3.35 933 865 A 21 PHE HD% A 21 PHE HA 1.0 . 3.41 934 866 A 24 MET HBy A 21 PHE HA 1.0 . 4.43 935 867 A 38 SER HA A 7 MET HGy 1.0 . 4.77 936 868 A 38 SER HA A 38 SER HBx 1.0 . 2.78 937 868 A 38 SER HA A 38 SER HBy 1.0 . 2.78 938 869 A 56 PHE HBy A 63 LEU HDx% 1.0 . 3.95 939 870 A 30 LEU HD1% A 31 TYR HA 1.0 . 4.35 940 871 A 46 VAL HGx% A 30 LEU HD1% 1.0 . 4.98 941 872 A 31 TYR H A 30 LEU HD1% 1.0 . 3.69 942 873 A 30 LEU HD1% A 30 LEU HA 1.0 . 4.17 943 874 A 30 LEU HD1% A 18 ARG HA 1.0 . 4.09 944 875 A 30 LEU HBy A 30 LEU HD1% 1.0 . 3.12 945 876 A 30 LEU HD1% A 30 LEU HBx 1.0 . 3.61 946 877 A 30 LEU HD1% A 14 THR HG2% 1.0 . 3.06 947 878 A 44 GLY H A 43 VAL HA 1.0 . 2.87 948 879 A 24 MET HBx A 21 PHE HA 1.0 . 5.02 949 880 A 5 LYS H A 5 LYS HGy 1.0 . 5.50 950 881 A 6 LEU H A 6 LEU HDx% 1.0 . 4.07 951 882 A 6 LEU HA A 6 LEU HDx% 1.0 . 3.98 952 883 A 6 LEU HDx% A 6 LEU HBy 1.0 . 2.94 953 883 A 6 LEU HBx A 6 LEU HDx% 1.0 . 2.94 954 884 A 46 VAL H A 55 THR HA 1.0 . 4.53 955 885 A 45 GLY H A 55 THR HA 1.0 . 2.93 956 886 A 55 THR HA A 45 GLY HAy 1.0 . 3.31 957 887 A 9 THR HA A 10 GLN HA 1.0 . 4.54 958 888 A 10 GLN H A 9 THR HA 1.0 . 2.83 959 889 A 9 THR HA A 9 THR HB 1.0 . 2.87 960 890 A 5 LYS HGx A 5 LYS H 1.0 . 5.50 961 891 A 5 LYS HGx A 6 LEU HA 1.0 . 5.24 962 892 A 18 ARG HA A 21 PHE HBx 1.0 . 3.91 963 893 A 18 ARG HGy A 18 ARG HA 1.0 . 3.30 964 894 A 17 VAL HGx% A 18 ARG HA 1.0 . 4.61 965 895 A 11 GLU HA A 14 THR H 1.0 . 4.23 966 896 A 11 GLU HA A 15 GLU H 1.0 . 4.50 967 897 A 11 GLU HA A 11 GLU HGx 1.0 . 3.42 968 898 A 11 GLU HA A 14 THR HG2% 1.0 . 4.56 969 899 A 11 GLU HA A 14 THR HB 1.0 . 3.26 970 900 A 35 TYR HD% A 37 SER HA 1.0 . 5.04 971 901 A 20 HIS H A 18 ARG HA 1.0 . 4.59 972 902 A 35 TYR HD% A 10 GLN HA 1.0 . 4.53 973 903 A 36 GLU HA A 37 SER HA 1.0 . 4.56 974 904 A 13 LEU H A 10 GLN HA 1.0 . 4.09 975 905 A 10 GLN HA A 13 LEU HBy 1.0 . 3.81 976 906 A 10 GLN HGx A 10 GLN HA 1.0 . 3.59 977 907 A 35 TYR HE% A 10 GLN HA 1.0 . 4.35 978 908 A 13 LEU HDy% A 13 LEU H 1.0 . 3.94 979 909 A 13 LEU HDy% A 16 ILE H 1.0 . 5.36 980 910 A 58 TYR HD% A 13 LEU HDy% 1.0 . 4.04 981 911 A 13 LEU HDy% A 58 TYR HE% 1.0 . 3.69 982 912 A 13 LEU HDy% A 13 LEU HA 1.0 . 2.93 983 913 A 41 SER HBx A 13 LEU HDy% 1.0 . 5.50 984 914 A 13 LEU HDy% A 8 LYS HEx 1.0 . 4.31 985 914 A 13 LEU HDy% A 8 LYS HEy 1.0 . 4.31 986 915 A 13 LEU HDy% A 40 GLU HBy 1.0 . 3.47 987 916 A 13 LEU HDy% A 8 LYS HBx 1.0 . 2.71 988 916 A 13 LEU HDy% A 8 LYS HBy 1.0 . 2.71 989 917 A 13 LEU HDy% A 8 LYS HDx 1.0 . 3.20 990 917 A 13 LEU HDy% A 8 LYS HDy 1.0 . 3.20 991 918 A 13 LEU HBx A 13 LEU HDy% 1.0 . 3.45 992 919 A 13 LEU HDy% A 40 GLU HBx 1.0 . 4.31 993 920 A 6 LEU H A 6 LEU HDy% 1.0 . 4.08 994 921 A 6 LEU HA A 6 LEU HDy% 1.0 . 3.25 995 922 A 13 LEU HDy% A 8 LYS HA 1.0 . 4.80 996 923 A 69 VAL H A 70 LEU HDx% 1.0 . 4.80 997 924 A 70 LEU HA A 70 LEU HDx% 1.0 . 3.63 998 925 A 46 VAL HA A 46 VAL HGy% 1.0 . 3.45 999 926 A 49 GLU HA A 51 GLY H 1.0 . 4.31 1000 927 A 48 PHE HA A 49 GLU HA 1.0 . 4.91 1001 928 A 49 GLU HA A 49 GLU HBy 1.0 . 2.84 1002 929 A 15 GLU HA A 18 ARG HA 1.0 . 5.50 1003 930 A 15 GLU HA A 18 ARG HBy 1.0 . 2.83 1004 931 A 15 GLU HA A 14 THR HG2% 1.0 . 5.43 1005 932 A 16 ILE HD1% A 12 GLU HA 1.0 . 5.50 1006 933 A 18 ARG H A 15 GLU HA 1.0 . 3.85 1007 934 A 20 HIS HA A 22 SER H 1.0 . 5.38 1008 935 A 63 LEU HDy% A 20 HIS HA 1.0 . 5.28 1009 936 A 15 GLU HA A 18 ARG HDx 1.0 . 4.40 1010 937 A 17 VAL HGy% A 58 TYR HBx 1.0 . 3.99 1011 938 A 58 TYR HD% A 17 VAL HGy% 1.0 . 3.90 1012 939 A 58 TYR HE% A 17 VAL HGy% 1.0 . 5.50 1013 940 A 17 VAL HGy% A 56 PHE HE% 1.0 . 5.50 1014 941 A 18 ARG H A 17 VAL HGy% 1.0 . 4.45 1015 942 A 17 VAL H A 17 VAL HGy% 1.0 . 3.36 1016 943 A 13 LEU HA A 17 VAL HGy% 1.0 . 5.50 1017 944 A 14 THR HA A 17 VAL HGy% 1.0 . 3.80 1018 945 A 17 VAL HGy% A 17 VAL HA 1.0 . 3.39 1019 946 A 13 LEU HBx A 17 VAL HGy% 1.0 . 4.22 1020 947 A 41 SER HBx A 39 LEU HDy% 1.0 . 5.50 1021 948 A 39 LEU H A 39 LEU HDy% 1.0 . 4.28 1022 949 A 39 LEU HA A 39 LEU HDy% 1.0 . 2.88 1023 950 A 38 SER HBy A 39 LEU HDy% 1.0 . 4.29 1024 950 A 38 SER HBx A 39 LEU HDy% 1.0 . 4.29 1025 951 A 31 TYR HBx A 32 VAL HGy% 1.0 . 5.34 1026 952 A 43 VAL H A 32 VAL HGy% 1.0 . 5.44 1027 953 A 32 VAL H A 32 VAL HGy% 1.0 . 3.49 1028 954 A 34 VAL H A 32 VAL HGy% 1.0 . 5.35 1029 955 A 10 GLN HE22 A 32 VAL HGy% 1.0 . 4.16 1030 956 A 10 GLN HE21 A 32 VAL HGy% 1.0 . 3.64 1031 957 A 32 VAL HGy% A 31 TYR HA 1.0 . 4.30 1032 958 A 32 VAL HA A 32 VAL HGy% 1.0 . 3.07 1033 959 A 10 GLN HGx A 32 VAL HGy% 1.0 . 4.43 1034 960 A 33 GLN H A 32 VAL HGy% 1.0 . 4.34 1035 961 A 53 HIS H A 52 ARG HA 1.0 . 2.78 1036 962 A 54 TYR HD% A 52 ARG HA 1.0 . 5.12 1037 963 A 52 ARG HGx A 52 ARG HA 1.0 . 3.22 1038 964 A 11 GLU H A 9 THR HG2% 1.0 . 4.28 1039 965 A 9 THR H A 9 THR HG2% 1.0 . 3.05 1040 966 A 10 GLN H A 9 THR HG2% 1.0 . 3.95 1041 967 A 12 GLU H A 9 THR HG2% 1.0 . 4.60 1042 968 A 9 THR HA A 9 THR HG2% 1.0 . 3.11 1043 969 A 55 THR HG2% A 46 VAL H 1.0 . 5.50 1044 970 A 30 LEU HD1% A 32 VAL HGy% 1.0 . 3.62 1045 971 A 55 THR HG2% A 55 THR H 1.0 . 3.81 1046 972 A 55 THR HG2% A 54 TYR HA 1.0 . 4.78 1047 973 A 55 THR HG2% A 55 THR HA 1.0 . 3.29 1048 974 A 55 THR HG2% A 45 GLY HAx 1.0 . 4.58 1049 975 A 33 GLN H A 32 VAL HGx% 1.0 . 3.50 1050 976 A 43 VAL H A 32 VAL HGx% 1.0 . 4.55 1051 977 A 32 VAL H A 32 VAL HGx% 1.0 . 4.75 1052 978 A 34 VAL H A 32 VAL HGx% 1.0 . 3.52 1053 979 A 35 TYR HD% A 32 VAL HGx% 1.0 . 5.30 1054 980 A 10 GLN HE21 A 32 VAL HGx% 1.0 . 4.17 1055 981 A 35 TYR HA A 32 VAL HGx% 1.0 . 4.07 1056 982 A 34 VAL HA A 32 VAL HGx% 1.0 . 4.84 1057 983 A 32 VAL HA A 32 VAL HGx% 1.0 . 3.21 1058 984 A 44 GLY HAx A 32 VAL HGx% 1.0 . 5.38 1059 985 A 35 TYR HBy A 32 VAL HGx% 1.0 . 3.78 1060 986 A 58 TYR H A 57 VAL HGx% 1.0 . 4.18 1061 987 A 56 PHE HA A 57 VAL HGx% 1.0 . 4.70 1062 988 A 58 TYR HD% A 61 GLU HA 1.0 . 5.46 1063 989 A 61 GLU HA A 61 GLU HBy 1.0 . 2.96 1064 990 A 30 LEU H A 29 THR HG2% 1.0 . 3.55 1065 991 A 29 THR H A 29 THR HG2% 1.0 . 4.10 1066 992 A 29 THR HG2% A 30 LEU HA 1.0 . 4.40 1067 993 A 31 TYR HBx A 29 THR HG2% 1.0 . 3.84 1068 994 A 29 THR HG2% A 47 ILE HB 1.0 . 3.85 1069 995 A 29 THR HA A 29 THR HG2% 1.0 . 3.39 1070 996 A 29 THR HG2% A 47 ILE HD1% 1.0 . 3.41 1071 997 A 57 VAL H A 57 VAL HGx% 1.0 . 4.11 1072 998 A 19 ASP HA A 19 ASP HBx 1.0 . 3.02 1073 999 A 18 ARG HGy A 19 ASP HA 1.0 . 5.45 1074 1000 A 41 SER H A 40 GLU HA 1.0 . 3.18 1075 1001 A 40 GLU HA A 40 GLU HGx 1.0 . 3.04 1076 1002 A 17 VAL HGx% A 21 PHE HBx 1.0 . 4.13 1077 1003 A 46 VAL HGx% A 47 ILE H 1.0 . 3.87 1078 1004 A 46 VAL HGx% A 46 VAL HA 1.0 . 3.62 1079 1005 A 41 SER HA A 40 GLU HA 1.0 . 4.90 1080 1006 A 18 ARG HDx A 14 THR HG2% 1.0 . 5.21 1081 1007 A 18 ARG H A 14 THR HG2% 1.0 . 4.79 1082 1008 A 15 GLU H A 14 THR HG2% 1.0 . 4.01 1083 1009 A 14 THR HA A 14 THR HG2% 1.0 . 3.16 1084 1010 A 17 VAL HGx% A 14 THR HG2% 1.0 . 5.50 1085 1011 A 42 LEU H A 43 VAL HGx% 1.0 . 5.31 1086 1011 A 42 LEU H A 43 VAL HGy% 1.0 . 5.31 1087 1012 A 43 VAL H A 43 VAL HGx% 1.0 . 3.41 1088 1012 A 43 VAL H A 43 VAL HGy% 1.0 . 3.41 1089 1013 A 42 LEU HA A 43 VAL HGx% 1.0 . 4.16 1090 1013 A 43 VAL HGy% A 42 LEU HA 1.0 . 4.16 1091 1014 A 58 TYR H A 43 VAL HGx% 1.0 . 4.30 1092 1014 A 58 TYR H A 43 VAL HGy% 1.0 . 4.30 1093 1015 A 33 GLN H A 43 VAL HGx% 1.0 . 4.60 1094 1015 A 33 GLN H A 43 VAL HGy% 1.0 . 4.60 1095 1016 A 44 GLY H A 43 VAL HGx% 1.0 . 3.32 1096 1016 A 44 GLY H A 43 VAL HGy% 1.0 . 3.32 1097 1017 A 43 VAL HA A 43 VAL HGx% 1.0 . 2.85 1098 1017 A 43 VAL HGy% A 43 VAL HA 1.0 . 2.85 1099 1018 A 65 TYR H A 64 VAL HGx% 1.0 . 3.51 1100 1018 A 65 TYR H A 64 VAL HGy% 1.0 . 3.51 1101 1019 A 64 VAL HA A 64 VAL HGx% 1.0 . 3.24 1102 1019 A 64 VAL HGy% A 64 VAL HA 1.0 . 3.24 1103 1020 A 44 GLY HAy A 34 VAL HGy% 1.0 . 3.75 1104 1021 A 43 VAL H A 34 VAL HGy% 1.0 . 4.75 1105 1022 A 17 VAL HGx% A 17 VAL H 1.0 . 4.00 1106 1023 A 17 VAL HGx% A 21 PHE HD% 1.0 . 3.64 1107 1024 A 17 VAL HGx% A 56 PHE HE% 1.0 . 3.66 1108 1025 A 17 VAL HGx% A 17 VAL HA 1.0 . 3.40 1109 1026 A 32 VAL HGx% A 33 GLN HA 1.0 . 4.15 1110 1027 A 44 GLY HAx A 43 VAL HGx% 1.0 . 4.20 1111 1027 A 44 GLY HAx A 43 VAL HGy% 1.0 . 4.20 1112 1028 A 33 GLN H A 34 VAL HGy% 1.0 . 4.66 1113 1029 A 34 VAL H A 34 VAL HGy% 1.0 . 3.56 1114 1030 A 62 ASP HBy A 64 VAL HGx% 1.0 . 4.98 1115 1030 A 62 ASP HBy A 64 VAL HGy% 1.0 . 4.98 1116 1031 A 64 VAL H A 64 VAL HGx% 1.0 . 3.57 1117 1031 A 64 VAL H A 64 VAL HGy% 1.0 . 3.57 1118 1032 A 57 VAL HGy% A 57 VAL H 1.0 . 4.11 1119 1033 A 58 TYR H A 57 VAL HGy% 1.0 . 3.62 1120 1034 A 57 VAL HGy% A 58 TYR HA 1.0 . 5.10 1121 1035 A 58 TYR H A 56 PHE HA 1.0 . 5.50 1122 1036 A 58 TYR HA A 63 LEU HDx% 1.0 . 4.24 1123 1037 A 8 LYS HA A 8 LYS HBx 1.0 . 2.88 1124 1037 A 8 LYS HBy A 8 LYS HA 1.0 . 2.88 1125 1038 A 8 LYS HGx A 8 LYS HA 1.0 . 3.36 1126 1039 A 57 VAL HA A 57 VAL HGy% 1.0 . 3.49 1127 1040 A 57 VAL H A 56 PHE HA 1.0 . 2.95 1128 1041 A 56 PHE HA A 65 TYR HBx 1.0 . 3.94 1129 1042 A 57 VAL HB A 56 PHE HA 1.0 . 4.69 1130 1043 A 59 GLU H A 58 TYR HA 1.0 . 3.01 1131 1044 A 63 LEU HA A 58 TYR HA 1.0 . 3.43 1132 1045 A 9 THR H A 8 LYS HA 1.0 . 2.71 1133 1046 A 64 VAL H A 58 TYR HA 1.0 . 4.24 1134 1047 A 69 VAL H A 69 VAL HG2% 1.0 . 4.01 1135 1048 A 46 VAL HGy% A 21 PHE HE% 1.0 . 4.95 1136 1049 A 24 MET HGy A 24 MET HA 1.0 . 3.62 1137 1050 A 24 MET HGx A 24 MET HA 1.0 . 3.46 1138 1051 A 54 TYR H A 46 VAL HGy% 1.0 . 4.04 1139 1052 A 54 TYR HD% A 46 VAL HGy% 1.0 . 3.74 1140 1053 A 46 VAL HGy% A 54 TYR HBy 1.0 . 3.99 1141 1054 A 46 VAL HGy% A 54 TYR HBx 1.0 . 3.49 1142 1055 A 46 VAL HGy% A 30 LEU HD2% 1.0 . 4.42 1143 1056 A 24 MET HA A 25 GLY HAx 1.0 . 4.92 1144 1057 A 5 LYS HA A 5 LYS HBy 1.0 . 2.83 1145 1058 A 5 LYS HA A 5 LYS HGx 1.0 . 3.59 1146 1059 A 55 THR H A 54 TYR HA 1.0 . 2.82 1147 1060 A 68 GLU H A 54 TYR HA 1.0 . 3.39 1148 1061 A 54 TYR HD% A 54 TYR HA 1.0 . 4.18 1149 1062 A 67 GLU HA A 54 TYR HA 1.0 . 3.13 1150 1063 A 69 VAL H A 68 GLU HA 1.0 . 3.04 1151 1064 A 65 TYR HD% A 65 TYR HA 1.0 . 4.72 1152 1065 A 66 GLU H A 65 TYR HA 1.0 . 3.36 1153 1066 A 65 TYR HA A 66 GLU HGx 1.0 . 5.47 1154 1066 A 65 TYR HA A 66 GLU HGy 1.0 . 5.47 1155 1067 A 65 TYR HA A 64 VAL HGx% 1.0 . 5.50 1156 1067 A 64 VAL HGy% A 65 TYR HA 1.0 . 5.50 1157 1068 A 27 ILE H A 26 GLU HA 1.0 . 2.65 1158 1069 A 28 ALA H A 28 ALA HB% 1.0 . 3.12 1159 1070 A 47 ILE H A 28 ALA HB% 1.0 . 5.08 1160 1071 A 29 THR H A 28 ALA HB% 1.0 . 3.15 1161 1072 A 48 PHE HA A 28 ALA HB% 1.0 . 4.10 1162 1073 A 49 GLU HA A 28 ALA HB% 1.0 . 3.17 1163 1074 A 28 ALA HB% A 29 THR HB 1.0 . 4.68 1164 1075 A 27 ILE HA A 28 ALA HB% 1.0 . 4.37 1165 1076 A 28 ALA HB% A 49 GLU HGx 1.0 . 3.99 1166 1077 A 49 GLU HBx A 28 ALA HB% 1.0 . 4.49 1167 1078 A 47 ILE HG2% A 28 ALA HB% 1.0 . 3.53 1168 1079 A 28 ALA HB% A 27 ILE HG2% 1.0 . 4.74 1169 1080 A 41 SER HA A 13 LEU HDx% 1.0 . 5.13 1170 1081 A 23 ASP HA A 23 ASP HBx 1.0 . 2.88 1171 1081 A 23 ASP HBy A 23 ASP HA 1.0 . 2.88 1172 1082 A 41 SER HA A 59 GLU HA 1.0 . 3.99 1173 1083 A 41 SER HA A 42 LEU H 1.0 . 2.96 1174 1084 A 41 SER HA A 58 TYR HD% 1.0 . 4.46 1175 1085 A 41 SER HA A 58 TYR HBy 1.0 . 4.74 1176 1086 A 41 SER HA A 42 LEU HBx 1.0 . 5.08 1177 1087 A 35 TYR HA A 43 VAL H 1.0 . 5.18 1178 1088 A 35 TYR HA A 32 VAL HB 1.0 . 5.20 1179 1089 A 59 GLU HA A 60 ASN H 1.0 . 2.93 1180 1090 A 27 ILE HG2% A 30 LEU HA 1.0 . 4.53 1181 1091 A 58 TYR HD% A 59 GLU HA 1.0 . 5.08 1182 1092 A 32 VAL HB A 31 TYR HA 1.0 . 4.72 1183 1093 A 29 THR HG2% A 31 TYR HA 1.0 . 5.23 1184 1094 A 31 TYR HDx A 30 LEU HA 1.0 . 4.42 1185 1095 A 31 TYR H A 30 LEU HA 1.0 . 2.87 1186 1096 A 7 MET HA A 8 LYS H 1.0 . 2.66 1187 1097 A 32 VAL H A 31 TYR HA 1.0 . 2.68 1188 1098 A 31 TYR HBx A 31 TYR HA 1.0 . 2.99 1189 1099 A 31 TYR HDx A 31 TYR HA 1.0 . 4.14 1190 1100 A 6 LEU HA A 6 LEU HBy 1.0 . 2.94 1191 1100 A 6 LEU HBx A 6 LEU HA 1.0 . 2.94 1192 1101 A 7 MET H A 6 LEU HA 1.0 . 2.53 1193 1102 A 60 ASN H A 60 ASN HA 1.0 . 2.82 1194 1103 A 61 GLU H A 60 ASN HA 1.0 . 3.48 1195 1104 A 49 GLU HBy A 50 ASP HA 1.0 . 5.50 1196 1105 A 49 GLU HBx A 50 ASP HA 1.0 . 4.90 1197 1106 A 40 GLU HA A 39 LEU HA 1.0 . 4.52 1198 1107 A 37 SER H A 36 GLU HA 1.0 . 2.71 1199 1108 A 36 GLU H A 42 LEU HA 1.0 . 4.33 1200 1109 A 43 VAL H A 42 LEU HA 1.0 . 2.76 1201 1110 A 13 LEU HBx A 42 LEU HA 1.0 . 3.72 1202 1111 A 32 VAL HGy% A 42 LEU HA 1.0 . 4.51 1203 1112 A 50 ASP HBy A 50 ASP HA 1.0 . 2.94 1204 1113 A 50 ASP HBx A 50 ASP HA 1.0 . 2.94 1205 1114 A 28 ALA HA A 49 GLU HGx 1.0 . 4.26 1206 1115 A 7 MET HE% A 8 LYS HA 1.0 . 5.07 1207 1116 A 64 VAL H A 63 LEU HA 1.0 . 3.26 1208 1117 A 27 ILE H A 28 ALA HA 1.0 . 5.41 1209 1118 A 7 MET HE% A 38 SER HBx 1.0 . 5.38 1210 1118 A 38 SER HBy A 7 MET HE% 1.0 . 5.38 1211 1119 A 8 LYS H A 7 MET HE% 1.0 . 5.32 1212 1120 A 7 MET H A 7 MET HE% 1.0 . 5.17 1213 1121 A 40 GLU H A 7 MET HE% 1.0 . 4.84 1214 1122 A 38 SER HA A 7 MET HE% 1.0 . 4.15 1215 1123 A 7 MET HE% A 39 LEU HDy% 1.0 . 4.95 1216 1124 A 47 ILE HG2% A 48 PHE H 1.0 . 3.71 1217 1125 A 47 ILE HG2% A 47 ILE H 1.0 . 4.20 1218 1126 A 47 ILE HG2% A 47 ILE HA 1.0 . 3.44 1219 1127 A 49 GLU HA A 47 ILE HG2% 1.0 . 4.92 1220 1128 A 53 HIS HA A 54 TYR HD% 1.0 . 5.02 1221 1129 A 54 TYR H A 53 HIS HA 1.0 . 3.12 1222 1130 A 53 HIS HA A 47 ILE HA 1.0 . 3.62 1223 1131 A 47 ILE HG2% A 53 HIS HA 1.0 . 5.50 1224 1132 A 47 ILE HG2% A 29 THR HB 1.0 . 4.24 1225 1133 A 27 ILE HG2% A 29 THR HB 1.0 . 5.50 1226 1134 A 28 ALA H A 27 ILE HG2% 1.0 . 3.41 1227 1135 A 27 ILE H A 27 ILE HG2% 1.0 . 4.24 1228 1136 A 47 ILE H A 27 ILE HG2% 1.0 . 4.49 1229 1137 A 30 LEU H A 27 ILE HG2% 1.0 . 4.29 1230 1138 A 29 THR H A 27 ILE HG2% 1.0 . 3.43 1231 1139 A 28 ALA HA A 27 ILE HG2% 1.0 . 4.71 1232 1140 A 27 ILE HA A 27 ILE HG2% 1.0 . 3.29 1233 1141 A 27 ILE HG2% A 30 LEU HBx 1.0 . 3.50 1234 1142 A 27 ILE HG2% A 27 ILE HD1% 1.0 . 3.29 1235 1143 A 46 VAL HGx% A 27 ILE HG2% 1.0 . 3.48 1236 1144 A 16 ILE H A 16 ILE HG2% 1.0 . 4.64 1237 1145 A 16 ILE HG1x A 16 ILE HG2% 1.0 . 3.70 1238 1146 A 17 VAL H A 16 ILE HG2% 1.0 . 3.90 1239 1147 A 13 LEU HA A 16 ILE HG2% 1.0 . 4.44 1240 1148 A 16 ILE HA A 16 ILE HG2% 1.0 . 3.31 1241 1149 A 16 ILE HG2% A 17 VAL HA 1.0 . 4.87 1242 1150 A 24 MET H A 24 MET HE% 1.0 . 4.73 1243 1151 A 21 PHE HE% A 24 MET HE% 1.0 . 4.59 1244 1152 A 24 MET HA A 24 MET HE% 1.0 . 5.43 1245 1153 A 21 PHE HBy A 24 MET HE% 1.0 . 4.50 1246 1154 A 24 MET HGy A 24 MET HE% 1.0 . 4.19 1247 1155 A 24 MET HBy A 24 MET HE% 1.0 . 3.71 1248 1156 A 18 ARG HA A 27 ILE HD1% 1.0 . 3.80 1249 1157 A 27 ILE HD1% A 22 SER HA 1.0 . 3.61 1250 1158 A 21 PHE HBy A 27 ILE HD1% 1.0 . 3.81 1251 1159 A 21 PHE HBx A 27 ILE HD1% 1.0 . 3.62 1252 1160 A 27 ILE H A 27 ILE HD1% 1.0 . 4.09 1253 1161 A 17 VAL H A 16 ILE HD1% 1.0 . 5.23 1254 1162 A 12 GLU HBy A 16 ILE HD1% 1.0 . 4.32 1255 1163 A 13 LEU H A 16 ILE HD1% 1.0 . 4.63 1256 1164 A 13 LEU HA A 16 ILE HD1% 1.0 . 3.41 1257 1165 A 16 ILE HD1% A 16 ILE HA 1.0 . 4.22 1258 1166 A 53 HIS HBx A 47 ILE HD1% 1.0 . 5.50 1259 1167 A 48 PHE H A 47 ILE HD1% 1.0 . 5.31 1260 1168 A 47 ILE H A 47 ILE HD1% 1.0 . 4.88 1261 1169 A 47 ILE HD1% A 53 HIS HE1 1.0 . 5.06 1262 1170 A 53 HIS HD2 A 47 ILE HD1% 1.0 . 5.50 1263 1171 A 46 VAL HA A 47 ILE HD1% 1.0 . 4.14 1264 1172 A 29 THR HB A 47 ILE HD1% 1.0 . 3.81 1265 1173 A 47 ILE HB A 47 ILE HD1% 1.0 . 3.61 1266 1174 A 29 THR H A 47 ILE HD1% 1.0 . 5.38 1267 1175 A 58 TYR H A 42 LEU HBy 1.0 . 4.75 1268 1176 A 42 LEU H A 42 LEU HBy 1.0 . 4.00 1269 1177 A 58 TYR HBy A 42 LEU HBy 1.0 . 3.77 1270 1178 A 13 LEU HBx A 42 LEU HBy 1.0 . 3.75 1271 1179 A 42 LEU HBx A 58 TYR HBx 1.0 . 5.04 1272 1180 A 42 LEU HBx A 43 VAL H 1.0 . 4.76 1273 1181 A 42 LEU HBx A 58 TYR HBy 1.0 . 4.06 1274 1182 A 42 LEU HBx A 13 LEU HBx 1.0 . 3.61 1275 1183 A 17 VAL HGy% A 42 LEU HBy 1.0 . 5.18 1276 1184 A 43 VAL H A 42 LEU HBy 1.0 . 4.42 1277 1185 A 16 ILE HG2% A 20 HIS HE1 1.0 . 4.83 1278 1186 A 35 TYR HD% A 37 SER HBx 1.0 . 4.25 1279 1187 A 35 TYR H A 35 TYR HD% 1.0 . 4.41 1280 1188 A 36 GLU H A 35 TYR HD% 1.0 . 3.76 1281 1189 A 35 TYR HA A 35 TYR HD% 1.0 . 3.24 1282 1190 A 31 TYR H A 31 TYR HDx 1.0 . 3.60 1283 1191 A 31 TYR HDx A 31 TYR HBx 1.0 . 3.27 1284 1192 A 31 TYR HDx A 29 THR HG2% 1.0 . 3.47 1285 1193 A 31 TYR HDx A 47 ILE HD1% 1.0 . 4.22 1286 1194 A 31 TYR HDx A 32 VAL HA 1.0 . 4.46 1287 1195 A 31 TYR HDx A 44 GLY HAx 1.0 . 4.55 1288 1196 A 63 LEU HDy% A 65 TYR HD% 1.0 . 4.44 1289 1197 A 65 TYR H A 65 TYR HD% 1.0 . 4.43 1290 1198 A 65 TYR HD% A 64 VAL HA 1.0 . 5.50 1291 1199 A 54 TYR HD% A 53 HIS HD2 1.0 . 5.42 1292 1200 A 54 TYR H A 54 TYR HD% 1.0 . 4.01 1293 1201 A 54 TYR HD% A 53 HIS H 1.0 . 4.91 1294 1202 A 68 GLU H A 54 TYR HD% 1.0 . 5.50 1295 1203 A 67 GLU HA A 54 TYR HD% 1.0 . 3.98 1296 1204 A 55 THR HG2% A 54 TYR HD% 1.0 . 5.50 1297 1205 A 58 TYR HD% A 61 GLU H 1.0 . 5.50 1298 1206 A 59 GLU H A 58 TYR HD% 1.0 . 4.26 1299 1207 A 58 TYR HD% A 62 ASP HA 1.0 . 5.48 1300 1208 A 58 TYR H A 58 TYR HD% 1.0 . 5.37 1301 1209 A 58 TYR HD% A 58 TYR HA 1.0 . 3.89 1302 1210 A 58 TYR HD% A 63 LEU HA 1.0 . 3.89 1303 1211 A 58 TYR HD% A 42 LEU HBy 1.0 . 5.50 1304 1212 A 58 TYR HD% A 63 LEU HBx 1.0 . 3.56 1305 1213 A 63 LEU HDy% A 21 PHE HD% 1.0 . 5.50 1306 1214 A 24 MET H A 21 PHE HD% 1.0 . 4.45 1307 1215 A 21 PHE HD% A 24 MET HBy 1.0 . 5.46 1308 1216 A 21 PHE HD% A 24 MET HE% 1.0 . 4.62 1309 1217 A 21 PHE HD% A 46 VAL HB 1.0 . 5.50 1310 1218 A 21 PHE HD% A 30 LEU HD2% 1.0 . 4.33 1311 1219 A 46 VAL HGx% A 21 PHE HD% 1.0 . 3.45 1312 1220 A 27 ILE HG1y A 48 PHE HE% 1.0 . 4.00 1313 1221 A 48 PHE HD% A 47 ILE HG2% 1.0 . 5.48 1314 1222 A 48 PHE HD% A 46 VAL HGy% 1.0 . 4.29 1315 1223 A 48 PHE HD% A 48 PHE H 1.0 . 3.91 1316 1224 A 48 PHE HD% A 48 PHE HA 1.0 . 4.20 1317 1225 A 48 PHE HD% A 50 ASP HBx 1.0 . 5.50 1318 1226 A 48 PHE HD% A 27 ILE HG1y 1.0 . 4.20 1319 1227 A 46 VAL HGx% A 21 PHE HE% 1.0 . 3.85 1320 1228 A 63 LEU HDx% A 21 PHE HE% 1.0 . 5.25 1321 1229 A 21 PHE HA A 56 PHE HZ 1.0 . 4.66 1322 1230 A 21 PHE HBx A 56 PHE HZ 1.0 . 4.98 1323 1231 A 54 TYR HBx A 56 PHE HD% 1.0 . 5.50 1324 1232 A 65 TYR HBx A 56 PHE HD% 1.0 . 4.38 1325 1233 A 63 LEU HDy% A 56 PHE HD% 1.0 . 5.50 1326 1234 A 63 LEU HDx% A 56 PHE HD% 1.0 . 5.42 1327 1235 A 52 ARG HDy A 48 PHE HZ 1.0 . 5.50 1328 1236 A 54 TYR H A 53 HIS HD2 1.0 . 4.21 1329 1237 A 53 HIS HD2 A 46 VAL H 1.0 . 4.65 1330 1238 A 53 HIS HA A 53 HIS HD2 1.0 . 4.60 1331 1239 A 46 VAL HA A 53 HIS HD2 1.0 . 4.13 1332 1240 A 16 ILE HG2% A 20 HIS HD2 1.0 . 5.12 1333 1241 A 63 LEU HDy% A 20 HIS HD2 1.0 . 5.14 1334 1242 A 67 GLU HA A 54 TYR HE% 1.0 . 4.65 1335 1243 A 54 TYR HE% A 46 VAL HGy% 1.0 . 5.50 1336 1244 A 52 ARG HBy A 54 TYR HE% 1.0 . 3.84 1337 1245 A 54 TYR HE% A 52 ARG HBx 1.0 . 3.51 1338 1246 A 54 TYR H A 54 TYR HE% 1.0 . 5.50 1339 1247 A 35 TYR HE% A 35 TYR HA 1.0 . 4.81 1340 1248 A 35 TYR HE% A 9 THR HA 1.0 . 4.63 1341 1249 A 35 TYR HE% A 10 GLN H 1.0 . 4.58 1342 1250 A 35 TYR HE% A 37 SER HA 1.0 . 3.73 1343 1251 A 35 TYR HE% A 13 LEU HDx% 1.0 . 3.15 1344 1252 A 63 LEU HDy% A 65 TYR HE% 1.0 . 4.67 1345 1253 A 63 LEU H A 58 TYR HE% 1.0 . 4.91 1346 1254 A 61 GLU H A 58 TYR HE% 1.0 . 4.53 1347 1255 A 58 TYR HE% A 58 TYR HA 1.0 . 5.14 1348 1256 A 58 TYR HE% A 61 GLU HA 1.0 . 4.10 1349 1257 A 63 LEU HBx A 58 TYR HE% 1.0 . 4.02 1350 1258 A 58 TYR HE% A 13 LEU HA 1.0 . 5.50 1351 1259 A 31 TYR HE% A 44 GLY HAy 1.0 . 4.88 1352 1260 A 31 TYR H A 31 TYR HE% 1.0 . 4.36 1353 1261 A 31 TYR HE% A 33 GLN HGx 1.0 . 4.34 1354 1262 A 31 TYR HE% A 47 ILE HD1% 1.0 . 3.68 1355 1263 A 31 TYR HE% A 33 GLN HA 1.0 . 5.14 1356 1264 A 33 GLN HBx A 31 TYR HE% 1.0 . 5.10 1357 1265 A 31 TYR HE% A 29 THR HG2% 1.0 . 4.50 stop_ save_