data_nef_c19034_2m52 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 PDB 1O0P PDB 1OPI PDB 2M0G PDB 3V4M PDB 4FXW BMRB 19033 BMRB 19012 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 GLY start . false 2 A 2 GLY middle . false 3 A 3 HIS middle . . 4 A 4 PRO middle . false 5 A 5 THR middle . . 6 A 6 GLU middle . . 7 A 7 VAL middle . . 8 A 8 LEU middle . . 9 A 9 CYS middle . . 10 A 10 LEU middle . . 11 A 11 MET middle . . 12 A 12 ASN middle . . 13 A 13 MET middle . . 14 A 14 VAL middle . . 15 A 15 LEU middle . . 16 A 16 PRO middle . false 17 A 17 GLU middle . . 18 A 18 GLU middle . . 19 A 19 LEU middle . . 20 A 20 LEU middle . . 21 A 21 ASP middle . . 22 A 22 ASP middle . . 23 A 23 GLU middle . . 24 A 24 GLU middle . . 25 A 25 TYR middle . . 26 A 26 GLU middle . . 27 A 27 GLU middle . . 28 A 28 ILE middle . . 29 A 29 VAL middle . . 30 A 30 GLU middle . . 31 A 31 ASP middle . . 32 A 32 VAL middle . . 33 A 33 ARG middle . . 34 A 34 ASP middle . . 35 A 35 GLU middle . . 36 A 36 CYS middle . . 37 A 37 SER middle . . 38 A 38 LYS middle . . 39 A 39 TYR middle . . 40 A 40 GLY middle . false 41 A 41 LEU middle . . 42 A 42 VAL middle . . 43 A 43 LYS middle . . 44 A 44 SER middle . . 45 A 45 ILE middle . . 46 A 46 GLU middle . . 47 A 47 ILE middle . . 48 A 48 PRO middle . false 49 A 49 ARG middle . . 50 A 50 PRO middle . false 51 A 51 VAL middle . . 52 A 52 ASP middle . . 53 A 53 GLY middle . false 54 A 54 VAL middle . . 55 A 55 GLU middle . . 56 A 56 VAL middle . . 57 A 57 PRO middle . false 58 A 58 GLY middle . false 59 A 59 CYS middle . . 60 A 60 GLY middle . false 61 A 61 LYS middle . . 62 A 62 ILE middle . . 63 A 63 PHE middle . . 64 A 64 VAL middle . . 65 A 65 GLU middle . . 66 A 66 PHE middle . . 67 A 67 THR middle . . 68 A 68 SER middle . . 69 A 69 VAL middle . . 70 A 70 PHE middle . . 71 A 71 ASP middle . . 72 A 72 CYS middle . . 73 A 73 GLN middle . . 74 A 74 LYS middle . . 75 A 75 ALA middle . . 76 A 76 MET middle . . 77 A 77 GLN middle . . 78 A 78 GLY middle . false 79 A 79 LEU middle . . 80 A 80 THR middle . . 81 A 81 GLY middle . false 82 A 82 ARG middle . . 83 A 83 LYS middle . . 84 A 84 PHE middle . . 85 A 85 ALA middle . . 86 A 86 ASN middle . . 87 A 87 ARG middle . . 88 A 88 VAL middle . . 89 A 89 VAL middle . . 90 A 90 VAL middle . . 91 A 91 THR middle . . 92 A 92 LYS middle . . 93 A 93 TYR middle . . 94 A 94 CYS middle . . 95 A 95 ASP middle . . 96 A 96 PRO middle . false 97 A 97 ASP middle . . 98 A 98 SER middle . . 99 A 99 TYR middle . . 100 A 100 HIS middle . . 101 A 101 ARG middle . . 102 A 102 ARG middle . . 103 A 103 ASP middle . . 104 A 104 PHE middle . . 105 A 105 TRP 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 2 GLY HAx H 1 4.006 0.006 A 2 GLY HAy H 1 4.006 0.006 A 2 GLY CA C 13 42.457 0.156 A 3 HIS H H 1 8.079 0.006 A 3 HIS HA H 1 4.833 0.006 A 3 HIS HBy H 1 3.091 0.006 A 3 HIS HBx H 1 2.992 0.006 A 3 HIS HD2 H 1 7.100 0.006 A 3 HIS HE1 H 1 8.336 0.006 A 3 HIS CA C 13 50.518 0.156 A 3 HIS CB C 13 26.412 0.156 A 3 HIS CD2 C 13 118.006 0.156 A 3 HIS CE1 C 13 134.435 0.156 A 3 HIS N N 15 118.891 0.125 A 4 PRO HA H 1 2.016 0.006 A 4 PRO HBx H 1 1.293 0.006 A 4 PRO HBy H 1 1.618 0.006 A 4 PRO HDy H 1 3.700 0.006 A 4 PRO HDx H 1 3.280 0.006 A 4 PRO HGx H 1 1.620 0.006 A 4 PRO HGy H 1 1.734 0.006 A 4 PRO CA C 13 59.967 0.156 A 4 PRO CB C 13 29.938 0.156 A 4 PRO CD C 13 47.739 0.156 A 4 PRO CG C 13 25.031 0.156 A 5 THR H H 1 6.242 0.006 A 5 THR HA H 1 4.430 0.006 A 5 THR HB H 1 4.399 0.006 A 5 THR HG2% H 1 1.137 0.006 A 5 THR CA C 13 56.748 0.156 A 5 THR CB C 13 69.859 0.156 A 5 THR CG2 C 13 19.049 0.156 A 5 THR N N 15 113.236 0.125 A 6 GLU H H 1 10.185 0.006 A 6 GLU HA H 1 4.175 0.006 A 6 GLU HBy H 1 2.158 0.006 A 6 GLU HBx H 1 1.950 0.006 A 6 GLU HGx H 1 2.263 0.006 A 6 GLU HGy H 1 2.263 0.006 A 6 GLU CA C 13 55.424 0.156 A 6 GLU CB C 13 26.129 0.156 A 6 GLU CG C 13 34.395 0.156 A 6 GLU N N 15 114.417 0.125 A 7 VAL H H 1 8.270 0.006 A 7 VAL HA H 1 5.038 0.006 A 7 VAL HB H 1 1.795 0.006 A 7 VAL HGx% H 1 0.268 0.006 A 7 VAL HGy% H 1 0.422 0.006 A 7 VAL CA C 13 58.276 0.156 A 7 VAL CB C 13 30.522 0.156 A 7 VAL CGy C 13 18.492 0.156 A 7 VAL CGx C 13 18.443 0.156 A 7 VAL N N 15 119.290 0.125 A 8 LEU H H 1 9.316 0.006 A 8 LEU HA H 1 4.641 0.006 A 8 LEU HBx H 1 1.827 0.006 A 8 LEU HBy H 1 1.953 0.006 A 8 LEU HDx% H 1 0.566 0.006 A 8 LEU HDy% H 1 0.681 0.006 A 8 LEU HG H 1 1.335 0.006 A 8 LEU CA C 13 49.788 0.156 A 8 LEU CB C 13 43.885 0.156 A 8 LEU CDx C 13 21.087 0.156 A 8 LEU CDy C 13 24.423 0.156 A 8 LEU CG C 13 24.557 0.156 A 8 LEU N N 15 130.138 0.125 A 9 CYS H H 1 8.902 0.006 A 9 CYS HA H 1 5.039 0.006 A 9 CYS HBy H 1 2.452 0.006 A 9 CYS HBx H 1 2.421 0.006 A 9 CYS CA C 13 53.248 0.156 A 9 CYS CB C 13 26.228 0.156 A 9 CYS N N 15 123.769 0.125 A 10 LEU H H 1 9.203 0.006 A 10 LEU HA H 1 4.584 0.006 A 10 LEU HBy H 1 1.573 0.006 A 10 LEU HBx H 1 1.138 0.006 A 10 LEU HDx% H 1 0.570 0.006 A 10 LEU HDy% H 1 0.591 0.006 A 10 LEU HG H 1 1.270 0.006 A 10 LEU CA C 13 51.368 0.156 A 10 LEU CB C 13 40.709 0.156 A 10 LEU CDx C 13 23.080 0.156 A 10 LEU CDy C 13 23.447 0.156 A 10 LEU CG C 13 24.973 0.156 A 10 LEU N N 15 127.313 0.125 A 11 MET H H 1 9.161 0.006 A 11 MET HA H 1 4.481 0.006 A 11 MET HBy H 1 1.959 0.006 A 11 MET HBx H 1 1.778 0.006 A 11 MET HE% H 1 1.794 0.006 A 11 MET HGx H 1 2.165 0.006 A 11 MET HGy H 1 2.282 0.006 A 11 MET CA C 13 52.655 0.156 A 11 MET CB C 13 33.156 0.156 A 11 MET CE C 13 14.427 0.156 A 11 MET CG C 13 30.506 0.156 A 11 MET N N 15 124.158 0.125 A 12 ASN H H 1 8.842 0.006 A 12 ASN HA H 1 4.281 0.006 A 12 ASN HBx H 1 3.113 0.006 A 12 ASN HBy H 1 3.113 0.006 A 12 ASN HD2x H 1 6.918 0.006 A 12 ASN HD2y H 1 7.625 0.006 A 12 ASN CA C 13 51.685 0.156 A 12 ASN CB C 13 35.314 0.156 A 12 ASN N N 15 114.067 0.125 A 12 ASN ND2 N 15 112.266 0.125 A 13 MET H H 1 8.519 0.006 A 13 MET HA H 1 3.952 0.006 A 13 MET HBx H 1 1.421 0.006 A 13 MET HBy H 1 1.729 0.006 A 13 MET HE% H 1 1.343 0.006 A 13 MET HGx H 1 1.800 0.006 A 13 MET HGy H 1 1.800 0.006 A 13 MET CA C 13 55.132 0.156 A 13 MET CB C 13 31.944 0.156 A 13 MET CE C 13 14.424 0.156 A 13 MET CG C 13 30.185 0.156 A 13 MET N N 15 118.202 0.125 A 14 VAL H H 1 6.949 0.006 A 14 VAL HA H 1 4.452 0.006 A 14 VAL HB H 1 1.844 0.006 A 14 VAL HGx% H 1 0.688 0.006 A 14 VAL HGy% H 1 0.668 0.006 A 14 VAL CA C 13 55.821 0.156 A 14 VAL CB C 13 32.754 0.156 A 14 VAL CGy C 13 19.145 0.156 A 14 VAL CGx C 13 17.027 0.156 A 14 VAL N N 15 110.436 0.125 A 15 LEU H H 1 8.346 0.006 A 15 LEU HA H 1 4.779 0.006 A 15 LEU HBy H 1 1.640 0.006 A 15 LEU HBx H 1 1.348 0.006 A 15 LEU HDx% H 1 0.780 0.006 A 15 LEU HDy% H 1 0.807 0.006 A 15 LEU HG H 1 1.468 0.006 A 15 LEU CA C 13 48.881 0.156 A 15 LEU CB C 13 39.500 0.156 A 15 LEU CDx C 13 19.720 0.156 A 15 LEU CDy C 13 23.050 0.156 A 15 LEU CG C 13 24.466 0.156 A 15 LEU N N 15 123.248 0.125 A 16 PRO HA H 1 3.883 0.006 A 16 PRO HBx H 1 1.901 0.006 A 16 PRO HDx H 1 3.779 0.006 A 16 PRO HGx H 1 1.758 0.006 A 16 PRO HGy H 1 2.187 0.006 A 16 PRO CA C 13 56.106 0.156 A 16 PRO CB C 13 29.513 0.156 A 16 PRO CD C 13 47.384 0.156 A 16 PRO CG C 13 25.452 0.156 A 17 GLU H H 1 7.754 0.006 A 17 GLU HA H 1 4.111 0.006 A 17 GLU HBx H 1 2.313 0.006 A 17 GLU HBy H 1 2.313 0.006 A 17 GLU HGx H 1 2.150 0.006 A 17 GLU HGy H 1 2.321 0.006 A 17 GLU CA C 13 54.495 0.156 A 17 GLU CB C 13 26.888 0.156 A 17 GLU CG C 13 34.903 0.156 A 17 GLU N N 15 119.496 0.125 A 18 GLU H H 1 8.975 0.006 A 18 GLU HA H 1 3.978 0.006 A 18 GLU HBx H 1 2.006 0.006 A 18 GLU HBy H 1 2.006 0.006 A 18 GLU HGx H 1 2.182 0.006 A 18 GLU HGy H 1 2.182 0.006 A 18 GLU CA C 13 56.285 0.156 A 18 GLU CB C 13 26.076 0.156 A 18 GLU CG C 13 33.847 0.156 A 18 GLU N N 15 112.697 0.125 A 19 LEU H H 1 7.266 0.006 A 19 LEU HA H 1 4.419 0.006 A 19 LEU HBy H 1 1.867 0.006 A 19 LEU HBx H 1 1.630 0.006 A 19 LEU HDx% H 1 0.862 0.006 A 19 LEU HDy% H 1 0.967 0.006 A 19 LEU HG H 1 1.769 0.006 A 19 LEU CA C 13 50.949 0.156 A 19 LEU CB C 13 40.343 0.156 A 19 LEU CDx C 13 20.194 0.156 A 19 LEU CDy C 13 24.353 0.156 A 19 LEU CG C 13 23.586 0.156 A 19 LEU N N 15 113.096 0.125 A 20 LEU H H 1 7.102 0.006 A 20 LEU HA H 1 4.038 0.006 A 20 LEU HBx H 1 1.492 0.006 A 20 LEU HBy H 1 1.644 0.006 A 20 LEU HDx% H 1 0.752 0.006 A 20 LEU HDy% H 1 0.880 0.006 A 20 LEU HG H 1 1.620 0.006 A 20 LEU CA C 13 54.002 0.156 A 20 LEU CB C 13 40.266 0.156 A 20 LEU CDx C 13 20.741 0.156 A 20 LEU CDy C 13 22.741 0.156 A 20 LEU CG C 13 24.834 0.156 A 20 LEU N N 15 119.130 0.125 A 21 ASP H H 1 8.071 0.006 A 21 ASP HA H 1 4.607 0.006 A 21 ASP HBy H 1 2.768 0.006 A 21 ASP HBx H 1 2.545 0.006 A 21 ASP CA C 13 50.806 0.156 A 21 ASP CB C 13 40.567 0.156 A 21 ASP N N 15 120.713 0.125 A 22 ASP H H 1 8.835 0.006 A 22 ASP HA H 1 4.242 0.006 A 22 ASP HBy H 1 2.769 0.006 A 22 ASP HBx H 1 2.663 0.006 A 22 ASP CA C 13 55.650 0.156 A 22 ASP CB C 13 38.083 0.156 A 22 ASP N N 15 126.353 0.125 A 23 GLU H H 1 8.177 0.006 A 23 GLU HA H 1 4.066 0.006 A 23 GLU HBx H 1 2.037 0.006 A 23 GLU HBy H 1 2.100 0.006 A 23 GLU HGy H 1 2.330 0.006 A 23 GLU HGx H 1 2.238 0.006 A 23 GLU CA C 13 56.840 0.156 A 23 GLU CB C 13 26.412 0.156 A 23 GLU CG C 13 34.045 0.156 A 23 GLU N N 15 119.623 0.125 A 24 GLU H H 1 8.218 0.006 A 24 GLU HA H 1 3.996 0.006 A 24 GLU HBy H 1 2.103 0.006 A 24 GLU HBx H 1 2.032 0.006 A 24 GLU HGy H 1 2.514 0.006 A 24 GLU HGx H 1 2.454 0.006 A 24 GLU CA C 13 56.361 0.156 A 24 GLU CB C 13 26.457 0.156 A 24 GLU CG C 13 32.739 0.156 A 24 GLU N N 15 121.959 0.125 A 25 TYR H H 1 8.694 0.006 A 25 TYR HA H 1 3.951 0.006 A 25 TYR HBx H 1 3.024 0.006 A 25 TYR HBy H 1 3.024 0.006 A 25 TYR HDx H 1 6.997 0.006 A 25 TYR HDy H 1 6.997 0.006 A 25 TYR HEx H 1 6.724 0.006 A 25 TYR HEy H 1 6.724 0.006 A 25 TYR CA C 13 59.647 0.156 A 25 TYR CB C 13 36.005 0.156 A 25 TYR CDx C 13 130.278 0.156 A 25 TYR CDy C 13 130.278 0.156 A 25 TYR CEx C 13 115.694 0.156 A 25 TYR CEy C 13 115.694 0.156 A 25 TYR N N 15 119.522 0.125 A 26 GLU H H 1 7.852 0.006 A 26 GLU HA H 1 3.702 0.006 A 26 GLU HBx H 1 2.047 0.006 A 26 GLU HBy H 1 2.083 0.006 A 26 GLU HGx H 1 2.448 0.006 A 26 GLU HGy H 1 2.517 0.006 A 26 GLU CA C 13 56.329 0.156 A 26 GLU CB C 13 26.178 0.156 A 26 GLU CG C 13 32.995 0.156 A 26 GLU N N 15 116.410 0.125 A 27 GLU H H 1 7.555 0.006 A 27 GLU HA H 1 3.921 0.006 A 27 GLU HBy H 1 2.095 0.006 A 27 GLU HBx H 1 2.022 0.006 A 27 GLU HGy H 1 2.454 0.006 A 27 GLU HGx H 1 2.265 0.006 A 27 GLU CA C 13 56.445 0.156 A 27 GLU CB C 13 26.240 0.156 A 27 GLU CG C 13 32.930 0.156 A 27 GLU N N 15 118.895 0.125 A 28 ILE H H 1 7.918 0.006 A 28 ILE HA H 1 3.642 0.006 A 28 ILE HB H 1 1.833 0.006 A 28 ILE HD1% H 1 0.749 0.006 A 28 ILE HG1x H 1 1.019 0.006 A 28 ILE HG1y H 1 1.670 0.006 A 28 ILE HG2% H 1 0.609 0.006 A 28 ILE CA C 13 62.355 0.156 A 28 ILE CB C 13 35.066 0.156 A 28 ILE CD1 C 13 11.595 0.156 A 28 ILE CG1 C 13 27.031 0.156 A 28 ILE CG2 C 13 14.601 0.156 A 28 ILE N N 15 121.720 0.125 A 29 VAL H H 1 7.832 0.006 A 29 VAL HA H 1 3.035 0.006 A 29 VAL HB H 1 1.830 0.006 A 29 VAL HGx% H 1 0.687 0.006 A 29 VAL HGy% H 1 0.397 0.006 A 29 VAL CA C 13 64.607 0.156 A 29 VAL CB C 13 29.064 0.156 A 29 VAL CGx C 13 18.877 0.156 A 29 VAL CGy C 13 19.934 0.156 A 29 VAL N N 15 119.336 0.125 A 30 GLU H H 1 7.405 0.006 A 30 GLU HA H 1 3.877 0.006 A 30 GLU HBx H 1 1.976 0.006 A 30 GLU HBy H 1 2.027 0.006 A 30 GLU HGy H 1 2.371 0.006 A 30 GLU HGx H 1 2.307 0.006 A 30 GLU CA C 13 56.061 0.156 A 30 GLU CB C 13 26.111 0.156 A 30 GLU CG C 13 32.880 0.156 A 30 GLU N N 15 116.291 0.125 A 31 ASP H H 1 8.471 0.006 A 31 ASP HA H 1 4.374 0.006 A 31 ASP HBy H 1 2.874 0.006 A 31 ASP HBx H 1 2.661 0.006 A 31 ASP CA C 13 54.532 0.156 A 31 ASP CB C 13 37.285 0.156 A 31 ASP N N 15 120.811 0.125 A 32 VAL H H 1 8.655 0.006 A 32 VAL HA H 1 3.411 0.006 A 32 VAL HB H 1 2.013 0.006 A 32 VAL HGx% H 1 0.826 0.006 A 32 VAL HGy% H 1 0.686 0.006 A 32 VAL CA C 13 64.215 0.156 A 32 VAL CB C 13 28.545 0.156 A 32 VAL CGy C 13 21.343 0.156 A 32 VAL CGx C 13 20.114 0.156 A 32 VAL N N 15 121.006 0.125 A 33 ARG H H 1 8.507 0.006 A 33 ARG HA H 1 3.493 0.006 A 33 ARG HBx H 1 1.762 0.006 A 33 ARG HBy H 1 1.919 0.006 A 33 ARG HDx H 1 3.131 0.006 A 33 ARG HDy H 1 3.131 0.006 A 33 ARG HGx H 1 1.406 0.006 A 33 ARG HGy H 1 1.406 0.006 A 33 ARG CA C 13 58.431 0.156 A 33 ARG CB C 13 27.232 0.156 A 33 ARG CD C 13 40.526 0.156 A 33 ARG CG C 13 24.796 0.156 A 33 ARG N N 15 122.143 0.125 A 34 ASP H H 1 8.633 0.006 A 34 ASP HA H 1 4.256 0.006 A 34 ASP HBx H 1 2.661 0.006 A 34 ASP HBy H 1 2.849 0.006 A 34 ASP CA C 13 55.100 0.156 A 34 ASP CB C 13 38.076 0.156 A 34 ASP N N 15 120.971 0.125 A 35 GLU H H 1 8.184 0.006 A 35 GLU HA H 1 4.064 0.006 A 35 GLU HBx H 1 2.017 0.006 A 35 GLU HBy H 1 2.178 0.006 A 35 GLU HGy H 1 2.408 0.006 A 35 GLU HGx H 1 2.244 0.006 A 35 GLU CA C 13 56.431 0.156 A 35 GLU CB C 13 26.860 0.156 A 35 GLU CG C 13 32.834 0.156 A 35 GLU N N 15 119.918 0.125 A 36 CYS H H 1 8.584 0.006 A 36 CYS HA H 1 4.374 0.006 A 36 CYS HBx H 1 2.752 0.006 A 36 CYS HBy H 1 2.922 0.006 A 36 CYS CA C 13 62.543 0.156 A 36 CYS CB C 13 24.910 0.156 A 36 CYS N N 15 114.288 0.125 A 37 SER H H 1 8.164 0.006 A 37 SER HA H 1 5.135 0.006 A 37 SER HBx H 1 3.965 0.006 A 37 SER HBy H 1 4.075 0.006 A 37 SER CA C 13 58.124 0.156 A 37 SER CB C 13 60.481 0.156 A 37 SER N N 15 114.987 0.125 A 38 LYS H H 1 7.111 0.006 A 38 LYS HA H 1 3.804 0.006 A 38 LYS HBy H 1 1.192 0.006 A 38 LYS HDx H 1 1.454 0.006 A 38 LYS HDy H 1 1.537 0.006 A 38 LYS HEx H 1 2.786 0.006 A 38 LYS HEy H 1 2.786 0.006 A 38 LYS HGy H 1 1.375 0.006 A 38 LYS HGx H 1 1.109 0.006 A 38 LYS CA C 13 55.490 0.156 A 38 LYS CB C 13 29.371 0.156 A 38 LYS CD C 13 26.714 0.156 A 38 LYS CE C 13 39.819 0.156 A 38 LYS CG C 13 22.733 0.156 A 38 LYS N N 15 119.574 0.125 A 39 TYR H H 1 7.576 0.006 A 39 TYR HA H 1 4.304 0.006 A 39 TYR HBy H 1 2.985 0.006 A 39 TYR HBx H 1 2.632 0.006 A 39 TYR HDx H 1 7.075 0.006 A 39 TYR HDy H 1 7.075 0.006 A 39 TYR HEx H 1 6.697 0.006 A 39 TYR HEy H 1 6.697 0.006 A 39 TYR CA C 13 55.924 0.156 A 39 TYR CB C 13 37.122 0.156 A 39 TYR CDx C 13 130.571 0.156 A 39 TYR CDy C 13 130.571 0.156 A 39 TYR CEx C 13 115.997 0.156 A 39 TYR CEy C 13 115.997 0.156 A 39 TYR N N 15 116.372 0.125 A 40 GLY H H 1 7.380 0.006 A 40 GLY HAx H 1 3.894 0.006 A 40 GLY HAy H 1 4.084 0.006 A 40 GLY CA C 13 42.186 0.156 A 40 GLY N N 15 103.718 0.125 A 41 LEU H H 1 8.260 0.006 A 41 LEU HA H 1 4.332 0.006 A 41 LEU HBx H 1 1.639 0.006 A 41 LEU HDx% H 1 0.917 0.006 A 41 LEU HDy% H 1 0.858 0.006 A 41 LEU HG H 1 1.479 0.006 A 41 LEU CA C 13 53.070 0.156 A 41 LEU CB C 13 39.959 0.156 A 41 LEU CDx C 13 21.939 0.156 A 41 LEU CDy C 13 22.165 0.156 A 41 LEU CG C 13 24.668 0.156 A 41 LEU N N 15 118.877 0.125 A 42 VAL H H 1 8.598 0.006 A 42 VAL HA H 1 3.507 0.006 A 42 VAL HB H 1 1.764 0.006 A 42 VAL HGx% H 1 0.474 0.006 A 42 VAL HGy% H 1 0.578 0.006 A 42 VAL CA C 13 59.948 0.156 A 42 VAL CB C 13 30.002 0.156 A 42 VAL CGx C 13 19.258 0.156 A 42 VAL CGy C 13 19.878 0.156 A 42 VAL N N 15 127.032 0.125 A 43 LYS H H 1 9.307 0.006 A 43 LYS HA H 1 4.126 0.006 A 43 LYS HBy H 1 1.496 0.006 A 43 LYS HBx H 1 1.269 0.006 A 43 LYS HDy H 1 1.561 0.006 A 43 LYS HDx H 1 1.470 0.006 A 43 LYS HEx H 1 2.928 0.006 A 43 LYS HEy H 1 2.928 0.006 A 43 LYS HGx H 1 1.274 0.006 A 43 LYS HGy H 1 1.274 0.006 A 43 LYS CA C 13 55.022 0.156 A 43 LYS CB C 13 32.093 0.156 A 43 LYS CD C 13 26.981 0.156 A 43 LYS CE C 13 39.498 0.156 A 43 LYS CG C 13 22.709 0.156 A 43 LYS N N 15 130.977 0.125 A 44 SER H H 1 7.938 0.006 A 44 SER HA H 1 4.492 0.006 A 44 SER HBx H 1 4.169 0.006 A 44 SER HBy H 1 4.169 0.006 A 44 SER CA C 13 55.890 0.156 A 44 SER CB C 13 62.940 0.156 A 44 SER N N 15 110.453 0.125 A 45 ILE H H 1 8.136 0.006 A 45 ILE HA H 1 5.050 0.006 A 45 ILE HB H 1 1.426 0.006 A 45 ILE HD1% H 1 0.655 0.006 A 45 ILE HG1y H 1 1.478 0.006 A 45 ILE HG1x H 1 0.792 0.006 A 45 ILE HG2% H 1 0.738 0.006 A 45 ILE CA C 13 57.531 0.156 A 45 ILE CB C 13 40.320 0.156 A 45 ILE CD1 C 13 12.218 0.156 A 45 ILE CG1 C 13 26.062 0.156 A 45 ILE CG2 C 13 13.976 0.156 A 45 ILE N N 15 118.542 0.125 A 46 GLU H H 1 9.364 0.006 A 46 GLU HA H 1 4.700 0.006 A 46 GLU HBx H 1 1.692 0.006 A 46 GLU HBy H 1 1.763 0.006 A 46 GLU HGy H 1 2.276 0.006 A 46 GLU HGx H 1 1.874 0.006 A 46 GLU CA C 13 52.467 0.156 A 46 GLU CB C 13 30.763 0.156 A 46 GLU CG C 13 31.764 0.156 A 46 GLU N N 15 125.456 0.125 A 47 ILE H H 1 8.672 0.006 A 47 ILE HA H 1 4.705 0.006 A 47 ILE HB H 1 1.951 0.006 A 47 ILE HD1% H 1 0.551 0.006 A 47 ILE HG1x H 1 1.506 0.006 A 47 ILE HG2% H 1 0.842 0.006 A 47 ILE CA C 13 56.335 0.156 A 47 ILE CB C 13 36.788 0.156 A 47 ILE CD1 C 13 11.913 0.156 A 47 ILE CG1 C 13 24.277 0.156 A 47 ILE CG2 C 13 15.569 0.156 A 47 ILE N N 15 122.471 0.125 A 48 PRO HDy H 1 3.848 0.006 A 48 PRO HDx H 1 3.279 0.006 A 48 PRO HGy H 1 1.635 0.006 A 48 PRO HGx H 1 1.550 0.006 A 48 PRO CB C 13 29.876 0.156 A 48 PRO CD C 13 47.686 0.156 A 48 PRO CG C 13 25.824 0.156 A 49 ARG H H 1 7.944 0.006 A 49 ARG HA H 1 4.707 0.006 A 49 ARG HBy H 1 1.817 0.006 A 49 ARG HBx H 1 1.372 0.006 A 49 ARG HDy H 1 2.462 0.006 A 49 ARG HDx H 1 1.579 0.006 A 49 ARG HGy H 1 1.731 0.006 A 49 ARG HGx H 1 1.119 0.006 A 49 ARG CB C 13 29.928 0.156 A 49 ARG CD C 13 40.548 0.156 A 49 ARG CG C 13 25.151 0.156 A 49 ARG N N 15 120.907 0.125 A 50 PRO HA H 1 4.392 0.006 A 50 PRO HBy H 1 2.012 0.006 A 50 PRO HBx H 1 1.666 0.006 A 50 PRO HDy H 1 3.500 0.006 A 50 PRO HDx H 1 3.307 0.006 A 50 PRO HGy H 1 1.889 0.006 A 50 PRO HGx H 1 1.860 0.006 A 50 PRO CA C 13 60.628 0.156 A 50 PRO CB C 13 29.626 0.156 A 50 PRO CD C 13 48.613 0.156 A 50 PRO CG C 13 25.033 0.156 A 51 VAL H H 1 7.992 0.006 A 51 VAL HA H 1 3.987 0.006 A 51 VAL HB H 1 1.677 0.006 A 51 VAL HGx% H 1 0.790 0.006 A 51 VAL HGy% H 1 0.833 0.006 A 51 VAL CA C 13 58.857 0.156 A 51 VAL CB C 13 32.238 0.156 A 51 VAL CGx C 13 18.580 0.156 A 51 VAL CGy C 13 18.668 0.156 A 51 VAL N N 15 121.425 0.125 A 52 ASP H H 1 8.746 0.006 A 52 ASP HA H 1 4.237 0.006 A 52 ASP HBy H 1 2.661 0.006 A 52 ASP HBx H 1 2.541 0.006 A 52 ASP CA C 13 53.288 0.156 A 52 ASP CB C 13 37.950 0.156 A 52 ASP N N 15 127.160 0.125 A 53 GLY H H 1 8.589 0.006 A 53 GLY HAx H 1 3.544 0.006 A 53 GLY HAy H 1 4.066 0.006 A 53 GLY CA C 13 42.974 0.156 A 53 GLY N N 15 108.483 0.125 A 54 VAL H H 1 7.804 0.006 A 54 VAL HA H 1 4.159 0.006 A 54 VAL HB H 1 1.920 0.006 A 54 VAL HGx% H 1 0.819 0.006 A 54 VAL HGy% H 1 0.784 0.006 A 54 VAL CA C 13 58.489 0.156 A 54 VAL CB C 13 32.033 0.156 A 54 VAL CGy C 13 18.620 0.156 A 54 VAL CGx C 13 18.618 0.156 A 54 VAL N N 15 120.874 0.125 A 55 GLU H H 1 8.578 0.006 A 55 GLU HA H 1 4.173 0.006 A 55 GLU HBx H 1 1.915 0.006 A 55 GLU HBy H 1 1.915 0.006 A 55 GLU HGy H 1 2.214 0.006 A 55 GLU HGx H 1 2.092 0.006 A 55 GLU CA C 13 53.696 0.156 A 55 GLU CB C 13 26.760 0.156 A 55 GLU CG C 13 33.746 0.156 A 55 GLU N N 15 126.140 0.125 A 56 VAL H H 1 7.661 0.006 A 56 VAL HA H 1 4.355 0.006 A 56 VAL HB H 1 2.052 0.006 A 56 VAL HGx% H 1 0.896 0.006 A 56 VAL HGy% H 1 0.890 0.006 A 56 VAL CA C 13 57.070 0.156 A 56 VAL CB C 13 29.806 0.156 A 56 VAL CGx C 13 17.747 0.156 A 56 VAL CGy C 13 18.566 0.156 A 56 VAL N N 15 124.648 0.125 A 57 PRO HA H 1 4.117 0.006 A 57 PRO HBy H 1 1.879 0.006 A 57 PRO HBx H 1 1.728 0.006 A 57 PRO HDy H 1 3.832 0.006 A 57 PRO HDx H 1 3.645 0.006 A 57 PRO HGx H 1 1.731 0.006 A 57 PRO HGy H 1 1.993 0.006 A 57 PRO CA C 13 61.241 0.156 A 57 PRO CB C 13 29.245 0.156 A 57 PRO CD C 13 48.395 0.156 A 57 PRO CG C 13 25.264 0.156 A 58 GLY H H 1 8.577 0.006 A 58 GLY HAy H 1 4.010 0.006 A 58 GLY HAx H 1 3.542 0.006 A 58 GLY CA C 13 42.847 0.156 A 58 GLY N N 15 109.755 0.125 A 59 CYS H H 1 7.631 0.006 A 59 CYS HA H 1 4.055 0.006 A 59 CYS HBy H 1 2.862 0.006 A 59 CYS HBx H 1 2.635 0.006 A 59 CYS CA C 13 59.324 0.156 A 59 CYS CB C 13 24.178 0.156 A 59 CYS N N 15 118.400 0.125 A 60 GLY H H 1 10.447 0.006 A 60 GLY HAy H 1 4.463 0.006 A 60 GLY HAx H 1 3.226 0.006 A 60 GLY CA C 13 42.139 0.156 A 60 GLY N N 15 119.002 0.125 A 61 LYS H H 1 8.233 0.006 A 61 LYS HA H 1 4.331 0.006 A 61 LYS HBy H 1 1.789 0.006 A 61 LYS HBx H 1 0.726 0.006 A 61 LYS HDx H 1 1.370 0.006 A 61 LYS HDy H 1 1.370 0.006 A 61 LYS HEx H 1 2.774 0.006 A 61 LYS HEy H 1 2.774 0.006 A 61 LYS HGy H 1 1.124 0.006 A 61 LYS HGx H 1 0.860 0.006 A 61 LYS CA C 13 52.944 0.156 A 61 LYS CB C 13 33.173 0.156 A 61 LYS CD C 13 27.741 0.156 A 61 LYS CE C 13 39.861 0.156 A 61 LYS CG C 13 24.181 0.156 A 61 LYS N N 15 122.250 0.125 A 62 ILE H H 1 7.272 0.006 A 62 ILE HA H 1 4.296 0.006 A 62 ILE HB H 1 1.521 0.006 A 62 ILE HD1% H 1 0.630 0.006 A 62 ILE HG1y H 1 1.402 0.006 A 62 ILE HG1x H 1 0.792 0.006 A 62 ILE HG2% H 1 0.629 0.006 A 62 ILE CA C 13 57.386 0.156 A 62 ILE CB C 13 39.003 0.156 A 62 ILE CD1 C 13 12.924 0.156 A 62 ILE CG1 C 13 24.188 0.156 A 62 ILE CG2 C 13 14.547 0.156 A 62 ILE N N 15 118.312 0.125 A 63 PHE H H 1 8.876 0.006 A 63 PHE HA H 1 5.300 0.006 A 63 PHE HBy H 1 3.075 0.006 A 63 PHE HBx H 1 2.644 0.006 A 63 PHE HDx H 1 6.822 0.006 A 63 PHE HDy H 1 6.822 0.006 A 63 PHE HEx H 1 6.923 0.006 A 63 PHE HEy H 1 6.923 0.006 A 63 PHE HZ H 1 6.989 0.006 A 63 PHE CA C 13 53.494 0.156 A 63 PHE CB C 13 39.791 0.156 A 63 PHE CDx C 13 129.050 0.156 A 63 PHE CDy C 13 129.050 0.156 A 63 PHE CEx C 13 128.965 0.156 A 63 PHE CEy C 13 128.965 0.156 A 63 PHE CZ C 13 127.023 0.156 A 63 PHE N N 15 125.445 0.125 A 64 VAL H H 1 9.161 0.006 A 64 VAL HA H 1 4.320 0.006 A 64 VAL HB H 1 1.754 0.006 A 64 VAL HGx% H 1 0.681 0.006 A 64 VAL HGy% H 1 0.317 0.006 A 64 VAL CA C 13 58.528 0.156 A 64 VAL CB C 13 32.571 0.156 A 64 VAL CGx C 13 18.465 0.156 A 64 VAL CGy C 13 19.672 0.156 A 64 VAL N N 15 122.504 0.125 A 65 GLU H H 1 8.601 0.006 A 65 GLU HA H 1 4.677 0.006 A 65 GLU HBy H 1 2.205 0.006 A 65 GLU HBx H 1 1.202 0.006 A 65 GLU HGy H 1 2.235 0.006 A 65 GLU HGx H 1 2.005 0.006 A 65 GLU CA C 13 51.445 0.156 A 65 GLU CB C 13 28.559 0.156 A 65 GLU CG C 13 33.238 0.156 A 65 GLU N N 15 127.687 0.125 A 66 PHE H H 1 9.352 0.006 A 66 PHE HA H 1 5.093 0.006 A 66 PHE HBx H 1 3.030 0.006 A 66 PHE HBy H 1 3.598 0.006 A 66 PHE HDx H 1 7.253 0.006 A 66 PHE HDy H 1 7.253 0.006 A 66 PHE CA C 13 55.185 0.156 A 66 PHE CB C 13 39.141 0.156 A 66 PHE CDx C 13 129.951 0.156 A 66 PHE CDy C 13 129.951 0.156 A 66 PHE CEy C 13 128.399 0.156 A 66 PHE N N 15 126.672 0.125 A 67 THR H H 1 9.072 0.006 A 67 THR HA H 1 4.248 0.006 A 67 THR HB H 1 4.410 0.006 A 67 THR HG2% H 1 1.245 0.006 A 67 THR CA C 13 60.963 0.156 A 67 THR CB C 13 66.974 0.156 A 67 THR CG2 C 13 20.143 0.156 A 67 THR N N 15 109.616 0.125 A 68 SER H H 1 7.511 0.006 A 68 SER HA H 1 4.922 0.006 A 68 SER HBx H 1 3.909 0.006 A 68 SER HBy H 1 4.124 0.006 A 68 SER CA C 13 53.411 0.156 A 68 SER CB C 13 63.507 0.156 A 68 SER N N 15 111.776 0.125 A 69 VAL H H 1 8.854 0.006 A 69 VAL HA H 1 3.405 0.006 A 69 VAL HB H 1 1.693 0.006 A 69 VAL HGx% H 1 0.695 0.006 A 69 VAL HGy% H 1 0.537 0.006 A 69 VAL CA C 13 62.588 0.156 A 69 VAL CB C 13 28.878 0.156 A 69 VAL CGy C 13 19.266 0.156 A 69 VAL CGx C 13 18.524 0.156 A 69 VAL N N 15 123.476 0.125 A 70 PHE H H 1 7.673 0.006 A 70 PHE HA H 1 4.229 0.006 A 70 PHE HBx H 1 3.027 0.006 A 70 PHE HBy H 1 3.027 0.006 A 70 PHE HDx H 1 7.278 0.006 A 70 PHE HDy H 1 7.324 0.006 A 70 PHE HEx H 1 7.268 0.006 A 70 PHE HEy H 1 7.268 0.006 A 70 PHE CA C 13 57.902 0.156 A 70 PHE CB C 13 36.263 0.156 A 70 PHE CDy C 13 129.295 0.156 A 70 PHE CDx C 13 129.230 0.156 A 70 PHE CEx C 13 127.537 0.156 A 70 PHE N N 15 119.530 0.125 A 71 ASP H H 1 7.585 0.006 A 71 ASP HA H 1 4.176 0.006 A 71 ASP HBx H 1 2.477 0.006 A 71 ASP HBy H 1 2.666 0.006 A 71 ASP CA C 13 54.306 0.156 A 71 ASP CB C 13 37.867 0.156 A 71 ASP N N 15 120.024 0.125 A 72 CYS H H 1 7.087 0.006 A 72 CYS HA H 1 2.796 0.006 A 72 CYS HBy H 1 3.541 0.006 A 72 CYS HBx H 1 2.781 0.006 A 72 CYS CA C 13 57.147 0.156 A 72 CYS CB C 13 25.349 0.156 A 72 CYS N N 15 119.689 0.125 A 73 GLN H H 1 8.478 0.006 A 73 GLN HA H 1 4.406 0.006 A 73 GLN HBy H 1 2.106 0.006 A 73 GLN HBx H 1 2.002 0.006 A 73 GLN HE2y H 1 7.016 0.006 A 73 GLN HE2x H 1 6.759 0.006 A 73 GLN HGx H 1 2.381 0.006 A 73 GLN CA C 13 56.361 0.156 A 73 GLN CB C 13 26.883 0.156 A 73 GLN CG C 13 32.134 0.156 A 73 GLN N N 15 117.350 0.125 A 73 GLN NE2 N 15 110.519 0.125 A 74 LYS H H 1 7.468 0.006 A 74 LYS HA H 1 3.774 0.006 A 74 LYS HBx H 1 1.751 0.006 A 74 LYS HBy H 1 2.006 0.006 A 74 LYS HDx H 1 1.656 0.006 A 74 LYS HDy H 1 1.712 0.006 A 74 LYS HEx H 1 2.984 0.006 A 74 LYS HEy H 1 2.984 0.006 A 74 LYS HGx H 1 1.306 0.006 A 74 LYS HGy H 1 1.445 0.006 A 74 LYS CA C 13 56.827 0.156 A 74 LYS CB C 13 29.502 0.156 A 74 LYS CD C 13 26.852 0.156 A 74 LYS CE C 13 39.604 0.156 A 74 LYS CG C 13 22.585 0.156 A 74 LYS N N 15 119.692 0.125 A 75 ALA H H 1 7.549 0.006 A 75 ALA HA H 1 2.595 0.006 A 75 ALA HB% H 1 0.977 0.006 A 75 ALA CA C 13 51.696 0.156 A 75 ALA CB C 13 17.091 0.156 A 75 ALA N N 15 124.287 0.125 A 76 MET H H 1 8.700 0.006 A 76 MET HA H 1 3.490 0.006 A 76 MET HBx H 1 2.142 0.006 A 76 MET HBy H 1 2.142 0.006 A 76 MET HE% H 1 1.131 0.006 A 76 MET HGx H 1 1.826 0.006 A 76 MET HGy H 1 1.826 0.006 A 76 MET CA C 13 56.956 0.156 A 76 MET CB C 13 28.966 0.156 A 76 MET CE C 13 14.008 0.156 A 76 MET CG C 13 29.227 0.156 A 76 MET N N 15 118.919 0.125 A 77 GLN H H 1 7.798 0.006 A 77 GLN HA H 1 3.856 0.006 A 77 GLN HBx H 1 1.975 0.006 A 77 GLN HBy H 1 1.975 0.006 A 77 GLN HE2y H 1 7.337 0.006 A 77 GLN HE2x H 1 6.751 0.006 A 77 GLN HGy H 1 2.412 0.006 A 77 GLN HGx H 1 2.311 0.006 A 77 GLN CA C 13 55.700 0.156 A 77 GLN CB C 13 25.781 0.156 A 77 GLN CG C 13 31.435 0.156 A 77 GLN N N 15 118.282 0.125 A 77 GLN NE2 N 15 111.353 0.125 A 78 GLY H H 1 7.797 0.006 A 78 GLY HAy H 1 3.860 0.006 A 78 GLY HAx H 1 3.332 0.006 A 78 GLY CA C 13 43.748 0.156 A 78 GLY N N 15 106.137 0.125 A 79 LEU H H 1 8.039 0.006 A 79 LEU HA H 1 4.190 0.006 A 79 LEU HBy H 1 1.517 0.006 A 79 LEU HBx H 1 1.124 0.006 A 79 LEU HDx% H 1 0.878 0.006 A 79 LEU HDy% H 1 0.738 0.006 A 79 LEU HG H 1 1.535 0.006 A 79 LEU CA C 13 53.263 0.156 A 79 LEU CB C 13 40.914 0.156 A 79 LEU CDx C 13 21.207 0.156 A 79 LEU CDy C 13 24.052 0.156 A 79 LEU CG C 13 25.074 0.156 A 79 LEU N N 15 118.753 0.125 A 80 THR H H 1 7.177 0.006 A 80 THR HA H 1 3.550 0.006 A 80 THR HB H 1 4.057 0.006 A 80 THR HG2% H 1 1.171 0.006 A 80 THR CA C 13 63.539 0.156 A 80 THR CB C 13 66.102 0.156 A 80 THR CG2 C 13 18.634 0.156 A 80 THR N N 15 114.360 0.125 A 81 GLY H H 1 8.680 0.006 A 81 GLY HAx H 1 3.540 0.006 A 81 GLY HAy H 1 4.126 0.006 A 81 GLY CA C 13 42.993 0.156 A 81 GLY N N 15 115.554 0.125 A 82 ARG H H 1 7.520 0.006 A 82 ARG HA H 1 4.093 0.006 A 82 ARG HBy H 1 1.825 0.006 A 82 ARG HBx H 1 1.677 0.006 A 82 ARG HDx H 1 3.148 0.006 A 82 ARG HDy H 1 3.148 0.006 A 82 ARG HGy H 1 1.626 0.006 A 82 ARG HGx H 1 1.466 0.006 A 82 ARG CA C 13 53.446 0.156 A 82 ARG CB C 13 28.148 0.156 A 82 ARG CD C 13 40.512 0.156 A 82 ARG CG C 13 24.879 0.156 A 82 ARG N N 15 120.945 0.125 A 83 LYS H H 1 8.165 0.006 A 83 LYS HA H 1 5.008 0.006 A 83 LYS HBx H 1 1.529 0.006 A 83 LYS HBy H 1 1.529 0.006 A 83 LYS HDx H 1 1.533 0.006 A 83 LYS HDy H 1 1.533 0.006 A 83 LYS HEx H 1 2.829 0.006 A 83 LYS HEy H 1 2.829 0.006 A 83 LYS HGy H 1 1.347 0.006 A 83 LYS HGx H 1 1.118 0.006 A 83 LYS CA C 13 52.722 0.156 A 83 LYS CB C 13 31.590 0.156 A 83 LYS CD C 13 26.869 0.156 A 83 LYS CE C 13 39.528 0.156 A 83 LYS CG C 13 22.809 0.156 A 83 LYS N N 15 121.584 0.125 A 84 PHE H H 1 8.656 0.006 A 84 PHE HA H 1 4.437 0.006 A 84 PHE HBy H 1 2.914 0.006 A 84 PHE HBx H 1 2.642 0.006 A 84 PHE HDx H 1 7.124 0.006 A 84 PHE HDy H 1 7.124 0.006 A 84 PHE HEx H 1 7.132 0.006 A 84 PHE HEy H 1 7.132 0.006 A 84 PHE HZ H 1 6.774 0.006 A 84 PHE CA C 13 54.773 0.156 A 84 PHE CB C 13 39.087 0.156 A 84 PHE CDx C 13 129.756 0.156 A 84 PHE CDy C 13 129.756 0.156 A 84 PHE CEx C 13 128.472 0.156 A 84 PHE CEy C 13 128.472 0.156 A 84 PHE CZ C 13 126.543 0.156 A 84 PHE N N 15 125.104 0.125 A 85 ALA H H 1 8.831 0.006 A 85 ALA HA H 1 3.768 0.006 A 85 ALA HB% H 1 1.310 0.006 A 85 ALA CA C 13 51.048 0.156 A 85 ALA CB C 13 14.121 0.156 A 85 ALA N N 15 127.849 0.125 A 86 ASN H H 1 8.406 0.006 A 86 ASN HA H 1 4.359 0.006 A 86 ASN HBy H 1 2.904 0.006 A 86 ASN HBx H 1 2.875 0.006 A 86 ASN HD2y H 1 7.485 0.006 A 86 ASN HD2x H 1 6.843 0.006 A 86 ASN CA C 13 51.409 0.156 A 86 ASN CB C 13 35.722 0.156 A 86 ASN N N 15 113.065 0.125 A 86 ASN ND2 N 15 113.049 0.125 A 87 ARG H H 1 8.250 0.006 A 87 ARG HA H 1 4.521 0.006 A 87 ARG HBx H 1 1.828 0.006 A 87 ARG HBy H 1 2.055 0.006 A 87 ARG HDy H 1 3.183 0.006 A 87 ARG HDx H 1 2.984 0.006 A 87 ARG HGy H 1 1.659 0.006 A 87 ARG HGx H 1 1.461 0.006 A 87 ARG CA C 13 52.786 0.156 A 87 ARG CB C 13 29.880 0.156 A 87 ARG CD C 13 40.939 0.156 A 87 ARG CG C 13 25.017 0.156 A 87 ARG N N 15 121.167 0.125 A 88 VAL H H 1 8.279 0.006 A 88 VAL HA H 1 4.274 0.006 A 88 VAL HB H 1 1.809 0.006 A 88 VAL HGx% H 1 0.797 0.006 A 88 VAL HGy% H 1 0.760 0.006 A 88 VAL CA C 13 59.281 0.156 A 88 VAL CB C 13 30.290 0.156 A 88 VAL CGx C 13 18.780 0.156 A 88 VAL CGy C 13 18.782 0.156 A 88 VAL N N 15 121.437 0.125 A 89 VAL H H 1 8.601 0.006 A 89 VAL HA H 1 4.112 0.006 A 89 VAL HB H 1 2.221 0.006 A 89 VAL HGx% H 1 0.795 0.006 A 89 VAL HGy% H 1 0.969 0.006 A 89 VAL CA C 13 61.131 0.156 A 89 VAL CB C 13 30.108 0.156 A 89 VAL CGx C 13 19.926 0.156 A 89 VAL CGy C 13 20.679 0.156 A 89 VAL N N 15 127.754 0.125 A 90 VAL H H 1 7.866 0.006 A 90 VAL HA H 1 4.321 0.006 A 90 VAL HB H 1 1.747 0.006 A 90 VAL HGx% H 1 0.889 0.006 A 90 VAL HGy% H 1 0.889 0.006 A 90 VAL CA C 13 58.489 0.156 A 90 VAL CB C 13 32.346 0.156 A 90 VAL CGx C 13 18.596 0.156 A 90 VAL N N 15 127.874 0.125 A 91 THR H H 1 8.119 0.006 A 91 THR HA H 1 5.528 0.006 A 91 THR HB H 1 3.791 0.006 A 91 THR HG2% H 1 0.899 0.006 A 91 THR CA C 13 56.193 0.156 A 91 THR CB C 13 69.553 0.156 A 91 THR CG2 C 13 20.173 0.156 A 91 THR N N 15 114.187 0.125 A 92 LYS H H 1 8.199 0.006 A 92 LYS HA H 1 4.346 0.006 A 92 LYS HBx H 1 1.722 0.006 A 92 LYS HBy H 1 1.722 0.006 A 92 LYS HEx H 1 2.411 0.006 A 92 LYS HEy H 1 2.411 0.006 A 92 LYS HGx H 1 1.135 0.006 A 92 LYS HGy H 1 1.215 0.006 A 92 LYS CA C 13 52.654 0.156 A 92 LYS CB C 13 33.887 0.156 A 92 LYS CD C 13 27.001 0.156 A 92 LYS CE C 13 39.605 0.156 A 92 LYS CG C 13 21.789 0.156 A 92 LYS N N 15 116.111 0.125 A 93 TYR H H 1 8.450 0.006 A 93 TYR HA H 1 4.960 0.006 A 93 TYR HBy H 1 3.435 0.006 A 93 TYR HBx H 1 2.602 0.006 A 93 TYR HDx H 1 7.096 0.006 A 93 TYR HDy H 1 7.096 0.006 A 93 TYR HEx H 1 6.810 0.006 A 93 TYR HEy H 1 6.810 0.006 A 93 TYR CA C 13 56.410 0.156 A 93 TYR CB C 13 36.540 0.156 A 93 TYR CDx C 13 131.204 0.156 A 93 TYR CDy C 13 131.204 0.156 A 93 TYR CEx C 13 116.601 0.156 A 93 TYR CEy C 13 116.601 0.156 A 93 TYR N N 15 121.017 0.125 A 94 CYS H H 1 8.614 0.006 A 94 CYS HA H 1 4.812 0.006 A 94 CYS HBy H 1 2.797 0.006 A 94 CYS HBx H 1 2.324 0.006 A 94 CYS CA C 13 54.001 0.156 A 94 CYS CB C 13 27.586 0.156 A 94 CYS N N 15 119.566 0.125 A 95 ASP H H 1 8.969 0.006 A 95 ASP HA H 1 4.837 0.006 A 95 ASP HBx H 1 2.800 0.006 A 95 ASP HBy H 1 2.800 0.006 A 95 ASP CA C 13 50.010 0.156 A 95 ASP CB C 13 39.716 0.156 A 95 ASP N N 15 128.707 0.125 A 96 PRO HBx H 1 2.197 0.006 A 96 PRO HDy H 1 4.172 0.006 A 96 PRO HDx H 1 3.993 0.006 A 96 PRO HGx H 1 2.032 0.006 A 96 PRO HGy H 1 2.344 0.006 A 96 PRO CB C 13 29.735 0.156 A 96 PRO CD C 13 48.798 0.156 A 96 PRO CG C 13 26.133 0.156 A 97 ASP H H 1 8.189 0.006 A 97 ASP HA H 1 4.429 0.006 A 97 ASP HBy H 1 2.802 0.006 A 97 ASP HBx H 1 2.619 0.006 A 97 ASP CA C 13 55.041 0.156 A 97 ASP CB C 13 37.759 0.156 A 97 ASP N N 15 118.102 0.125 A 98 SER H H 1 7.792 0.006 A 98 SER HA H 1 3.961 0.006 A 98 SER CA C 13 59.519 0.156 A 98 SER N N 15 116.394 0.125 A 99 TYR H H 1 7.625 0.006 A 99 TYR HA H 1 3.742 0.006 A 99 TYR HBy H 1 2.894 0.006 A 99 TYR HBx H 1 2.788 0.006 A 99 TYR HDx H 1 6.366 0.006 A 99 TYR HDy H 1 6.366 0.006 A 99 TYR HEx H 1 6.488 0.006 A 99 TYR HEy H 1 6.488 0.006 A 99 TYR CA C 13 58.797 0.156 A 99 TYR CB C 13 36.175 0.156 A 99 TYR CDx C 13 129.736 0.156 A 99 TYR CDy C 13 129.736 0.156 A 99 TYR CEx C 13 116.033 0.156 A 99 TYR CEy C 13 116.033 0.156 A 99 TYR N N 15 121.890 0.125 A 100 HIS H H 1 8.425 0.006 A 100 HIS HA H 1 4.130 0.006 A 100 HIS HBy H 1 3.244 0.006 A 100 HIS HBx H 1 3.222 0.006 A 100 HIS HD2 H 1 7.336 0.006 A 100 HIS HE1 H 1 8.633 0.006 A 100 HIS CA C 13 55.608 0.156 A 100 HIS CB C 13 25.794 0.156 A 100 HIS CD2 C 13 117.572 0.156 A 100 HIS CE1 C 13 133.792 0.156 A 100 HIS N N 15 118.065 0.125 A 101 ARG H H 1 7.406 0.006 A 101 ARG HA H 1 4.101 0.006 A 101 ARG HBx H 1 1.629 0.006 A 101 ARG HBy H 1 1.718 0.006 A 101 ARG HDx H 1 3.057 0.006 A 101 ARG HDy H 1 3.057 0.006 A 101 ARG HGy H 1 1.626 0.006 A 101 ARG HGx H 1 1.548 0.006 A 101 ARG CA C 13 53.641 0.156 A 101 ARG CB C 13 28.109 0.156 A 101 ARG CD C 13 40.728 0.156 A 101 ARG CG C 13 25.920 0.156 A 101 ARG N N 15 116.756 0.125 A 102 ARG H H 1 7.297 0.006 A 102 ARG HA H 1 2.300 0.006 A 102 ARG HBy H 1 1.137 0.006 A 102 ARG HBx H 1 1.049 0.006 A 102 ARG HDy H 1 3.045 0.006 A 102 ARG HDx H 1 2.932 0.006 A 102 ARG HGx H 1 1.359 0.006 A 102 ARG HGy H 1 1.713 0.006 A 102 ARG CA C 13 53.586 0.156 A 102 ARG CB C 13 25.084 0.156 A 102 ARG CD C 13 40.952 0.156 A 102 ARG CG C 13 23.354 0.156 A 102 ARG N N 15 115.254 0.125 A 103 ASP H H 1 7.467 0.006 A 103 ASP HA H 1 4.346 0.006 A 103 ASP HBy H 1 2.393 0.006 A 103 ASP HBx H 1 2.113 0.006 A 103 ASP CA C 13 49.581 0.156 A 103 ASP CB C 13 37.749 0.156 A 103 ASP N N 15 119.588 0.125 A 104 PHE H H 1 7.138 0.006 A 104 PHE HA H 1 4.340 0.006 A 104 PHE HBx H 1 2.316 0.006 A 104 PHE HBy H 1 2.863 0.006 A 104 PHE HDx H 1 6.431 0.006 A 104 PHE HDy H 1 6.431 0.006 A 104 PHE HEx H 1 6.656 0.006 A 104 PHE HEy H 1 6.656 0.006 A 104 PHE HZ H 1 6.489 0.006 A 104 PHE CA C 13 52.701 0.156 A 104 PHE CB C 13 36.842 0.156 A 104 PHE CDy C 13 128.364 0.156 A 104 PHE CDx C 13 128.346 0.156 A 104 PHE CEx C 13 127.709 0.156 A 104 PHE CEy C 13 127.709 0.156 A 104 PHE CZ C 13 125.521 0.156 A 104 PHE N N 15 120.438 0.125 A 105 TRP H H 1 7.186 0.006 A 105 TRP HA H 1 4.298 0.006 A 105 TRP HBx H 1 3.177 0.006 A 105 TRP HBy H 1 3.261 0.006 A 105 TRP HD1 H 1 7.175 0.006 A 105 TRP HE1 H 1 9.973 0.006 A 105 TRP HE3 H 1 7.631 0.006 A 105 TRP HH2 H 1 7.138 0.006 A 105 TRP HZ2 H 1 7.419 0.006 A 105 TRP HZ3 H 1 7.089 0.006 A 105 TRP CA C 13 56.388 0.156 A 105 TRP CB C 13 27.492 0.156 A 105 TRP CD1 C 13 124.959 0.156 A 105 TRP CE3 C 13 118.848 0.156 A 105 TRP CH2 C 13 121.987 0.156 A 105 TRP CZ2 C 13 112.102 0.156 A 105 TRP CZ3 C 13 119.363 0.156 A 105 TRP N N 15 123.989 0.125 A 105 TRP NE1 N 15 128.920 0.125 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 43 LYS H A 64 VAL HGy% 1.0 . 5.50 2 2 A 43 LYS H A 43 LYS HBy 1.0 . 3.62 3 3 A 43 LYS H A 43 LYS HBx 1.0 . 3.47 4 4 A 43 LYS H A 42 VAL HB 1.0 . 5.32 5 5 A 43 LYS H A 42 VAL H 1.0 . 4.73 6 6 A 43 LYS H A 65 GLU HBy 1.0 . 4.75 7 7 A 8 LEU H A 9 CYS H 1.0 . 5.50 8 8 A 8 LEU H A 94 CYS H 1.0 . 5.50 9 9 A 8 LEU H A 7 VAL H 1.0 . 4.98 10 10 A 8 LEU H A 66 PHE HD% 1.0 . 5.12 11 11 A 8 LEU H A 8 LEU HBy 1.0 . 3.84 12 12 A 8 LEU H A 8 LEU HBx 1.0 . 3.59 13 13 A 8 LEU H A 8 LEU HG 1.0 . 5.25 14 14 A 8 LEU H A 7 VAL HGy% 1.0 . 4.94 15 15 A 57 PRO HBx A 105 TRP HE1 1.0 . 5.50 16 16 A 95 ASP H A 98 SER H 1.0 . 5.44 17 17 A 95 ASP H A 94 CYS HA 1.0 . 3.05 18 18 A 95 ASP H A 96 PRO HDy 1.0 . 5.49 19 19 A 95 ASP H A 94 CYS HBy 1.0 . 2.95 20 20 A 95 ASP H A 94 CYS HBx 1.0 . 4.49 21 21 A 95 ASP H A 5 THR HG2% 1.0 . 5.50 22 22 A 85 ALA H A 86 ASN H 1.0 . 3.96 23 23 A 85 ALA H A 87 ARG H 1.0 . 5.15 24 24 A 85 ALA H A 84 PHE HBx 1.0 . 4.79 25 25 A 89 VAL H A 90 VAL H 1.0 . 5.50 26 26 A 65 GLU H A 66 PHE H 1.0 . 4.65 27 27 A 89 VAL H A 82 ARG H 1.0 . 4.80 28 28 A 65 GLU H A 45 ILE HA 1.0 . 3.71 29 29 A 89 VAL H A 88 VAL HA 1.0 . 2.72 30 30 A 65 GLU HBy A 65 GLU H 1.0 . 3.07 31 31 A 65 GLU H A 65 GLU HBx 1.0 . 3.86 32 32 A 65 GLU H A 42 VAL HGx% 1.0 . 4.89 33 33 A 65 GLU H A 64 VAL H 1.0 . 5.18 34 34 A 9 CYS H A 10 LEU H 1.0 . 4.95 35 35 A 10 LEU H A 62 ILE H 1.0 . 3.88 36 36 A 10 LEU H A 63 PHE HA 1.0 . 4.59 37 37 A 10 LEU H A 9 CYS HA 1.0 . 3.08 38 38 A 10 LEU H A 62 ILE HA 1.0 . 5.12 39 39 A 10 LEU H A 9 CYS HBy 1.0 . 4.43 40 40 A 10 LEU H A 10 LEU HBy 1.0 . 3.65 41 41 A 51 VAL H A 52 ASP H 1.0 . 4.53 42 42 A 52 ASP H A 53 GLY HAx 1.0 . 5.50 43 43 A 52 ASP H A 52 ASP HBy 1.0 . 3.57 44 44 A 52 ASP H A 51 VAL HB 1.0 . 4.43 45 45 A 42 VAL H A 41 LEU HBx 1.0 . 4.27 46 46 A 66 PHE H A 65 GLU HA 1.0 . 3.26 47 47 A 66 PHE H A 6 GLU HA 1.0 . 5.35 48 48 A 66 PHE H A 66 PHE HBy 1.0 . 4.20 49 49 A 66 PHE H A 66 PHE HBx 1.0 . 3.74 50 50 A 66 PHE H A 72 CYS HBx 1.0 . 5.50 51 51 A 66 PHE H A 65 GLU HGy 1.0 . 4.04 52 52 A 66 PHE H A 65 GLU HGx 1.0 . 4.46 53 53 A 66 PHE H A 65 GLU HBx 1.0 . 4.66 54 54 A 66 PHE H A 7 VAL HGx% 1.0 . 5.47 55 55 A 22 ASP H A 25 TYR H 1.0 . 4.96 56 56 A 22 ASP H A 23 GLU H 1.0 . 3.71 57 57 A 22 ASP H A 22 ASP HBx 1.0 . 3.54 58 58 A 22 ASP H A 23 GLU HBy 1.0 . 5.26 59 59 A 55 GLU H A 56 VAL H 1.0 . 4.52 60 60 A 55 GLU H A 54 VAL HA 1.0 . 2.58 61 61 A 46 GLU H A 63 PHE H 1.0 . 4.34 62 62 A 46 GLU H A 63 PHE HBy 1.0 . 4.40 63 63 A 46 GLU H A 46 GLU HGy 1.0 . 4.87 64 64 A 63 PHE H A 48 PRO HDy 1.0 . 5.50 65 65 A 63 PHE H A 48 PRO HDx 1.0 . 5.47 66 66 A 46 GLU H A 63 PHE HBx 1.0 . 5.02 67 67 A 63 PHE H A 63 PHE HD% 1.0 . 3.84 68 68 A 45 ILE HA A 63 PHE H 1.0 . 5.14 69 69 A 63 PHE H A 47 ILE HA 1.0 . 4.58 70 70 A 62 ILE HA A 63 PHE H 1.0 . 3.18 71 71 A 63 PHE H A 63 PHE HBy 1.0 . 3.91 72 72 A 63 PHE H A 62 ILE HB 1.0 . 5.12 73 73 A 85 ALA H A 84 PHE H 1.0 . 4.80 74 74 A 87 ARG H A 84 PHE H 1.0 . 4.40 75 75 A 88 VAL HA A 84 PHE H 1.0 . 5.50 76 76 A 84 PHE H A 87 ARG HBy 1.0 . 5.26 77 77 A 84 PHE H A 83 LYS HBx 1.0 . 3.82 78 77 A 84 PHE H A 83 LYS HBy 1.0 . 3.82 79 78 A 84 PHE H A 83 LYS HGx 1.0 . 5.50 80 79 A 84 PHE H A 82 ARG HBy 1.0 . 5.44 81 80 A 84 PHE H A 89 VAL HGx% 1.0 . 5.40 82 81 A 84 PHE H A 89 VAL HGy% 1.0 . 5.12 83 82 A 56 VAL H A 59 CYS HBy 1.0 . 4.70 84 83 A 56 VAL H A 59 CYS HBx 1.0 . 5.27 85 84 A 73 GLN H A 75 ALA H 1.0 . 5.00 86 85 A 75 ALA H A 71 ASP HA 1.0 . 4.92 87 86 A 75 ALA H A 73 GLN HA 1.0 . 5.16 88 87 A 75 ALA H A 39 TYR HBy 1.0 . 4.44 89 88 A 75 ALA H A 77 GLN H 1.0 . 5.15 90 89 A 75 ALA H A 39 TYR HD% 1.0 . 5.02 91 90 A 75 ALA H A 74 LYS HBy 1.0 . 3.58 92 91 A 75 ALA H A 74 LYS HBx 1.0 . 3.98 93 92 A 11 MET H A 12 ASN H 1.0 . 5.50 94 93 A 90 VAL H A 11 MET H 1.0 . 4.26 95 94 A 11 MET H A 91 THR HA 1.0 . 4.34 96 95 A 11 MET H A 11 MET HBy 1.0 . 4.16 97 96 A 11 MET H A 11 MET HE% 1.0 . 3.86 98 97 A 10 LEU HBy A 11 MET H 1.0 . 5.07 99 98 A 11 MET H A 10 LEU HBx 1.0 . 4.75 100 99 A 11 MET H A 10 LEU HDy% 1.0 . 5.07 101 100 A 104 PHE HD% A 105 TRP H 1.0 . 4.76 102 101 A 105 TRP H A 104 PHE HA 1.0 . 3.06 103 102 A 105 TRP H A 58 GLY HAy 1.0 . 5.36 104 103 A 105 TRP H A 104 PHE HBx 1.0 . 4.29 105 104 A 9 CYS H A 91 THR HB 1.0 . 5.29 106 105 A 9 CYS H A 91 THR HA 1.0 . 5.24 107 106 A 9 CYS H A 9 CYS HBx 1.0 . 3.42 108 107 A 9 CYS H A 8 LEU HBy 1.0 . 4.74 109 108 A 9 CYS H A 8 LEU HBx 1.0 . 4.67 110 109 A 9 CYS H A 8 LEU HG 1.0 . 4.28 111 110 A 9 CYS H A 93 TYR HD% 1.0 . 5.50 112 111 A 68 SER HBy A 69 VAL H 1.0 . 3.47 113 112 A 69 VAL H A 68 SER HBx 1.0 . 4.08 114 113 A 69 VAL H A 6 GLU HBx 1.0 . 5.14 115 114 A 14 VAL H A 15 LEU H 1.0 . 5.21 116 115 A 15 LEU H A 15 LEU HG 1.0 . 4.09 117 116 A 15 LEU H A 15 LEU HBx 1.0 . 3.80 118 117 A 8 LEU H A 64 VAL H 1.0 . 3.87 119 118 A 64 VAL H A 63 PHE HD% 1.0 . 5.50 120 119 A 64 VAL H A 63 PHE HA 1.0 . 3.06 121 120 A 64 VAL H A 9 CYS HA 1.0 . 4.06 122 121 A 64 VAL H A 63 PHE HBx 1.0 . 4.54 123 122 A 64 VAL H A 7 VAL HGx% 1.0 . 4.24 124 123 A 64 VAL H A 99 TYR HE% 1.0 . 5.50 125 124 A 64 VAL H A 63 PHE HBy 1.0 . 5.09 126 125 A 46 GLU H A 47 ILE H 1.0 . 4.75 127 126 A 47 ILE H A 46 GLU HA 1.0 . 2.88 128 127 A 47 ILE H A 47 ILE HB 1.0 . 3.70 129 128 A 48 PRO HDx A 47 ILE H 1.0 . 4.90 130 129 A 47 ILE H A 47 ILE HG1x 1.0 . 4.16 131 130 A 48 PRO HDy A 47 ILE H 1.0 . 5.50 132 131 A 60 GLY H A 61 LYS H 1.0 . 3.35 133 132 A 48 PRO HDy A 61 LYS H 1.0 . 5.50 134 133 A 61 LYS H A 61 LYS HBy 1.0 . 3.79 135 134 A 61 LYS H A 61 LYS HDx 1.0 . 4.93 136 134 A 61 LYS H A 61 LYS HDy 1.0 . 4.93 137 135 A 61 LYS H A 61 LYS HBx 1.0 . 4.14 138 136 A 61 LYS H A 61 LYS HGy 1.0 . 4.26 139 137 A 61 LYS H A 61 LYS HGx 1.0 . 4.58 140 138 A 31 ASP HA A 33 ARG H 1.0 . 5.50 141 139 A 33 ARG H A 34 ASP HBy 1.0 . 4.92 142 140 A 33 ARG H A 33 ARG HBy 1.0 . 3.35 143 141 A 33 ARG H A 33 ARG HBx 1.0 . 3.31 144 142 A 33 ARG H A 32 VAL HGx% 1.0 . 3.84 145 143 A 22 ASP H A 24 GLU H 1.0 . 5.26 146 144 A 25 TYR H A 24 GLU H 1.0 . 3.38 147 145 A 24 GLU H A 27 GLU H 1.0 . 5.50 148 146 A 24 GLU H A 25 TYR HBx 1.0 . 4.90 149 146 A 24 GLU H A 25 TYR HBy 1.0 . 4.90 150 147 A 97 ASP HA A 99 TYR H 1.0 . 5.50 151 148 A 99 TYR H A 99 TYR HBy 1.0 . 3.32 152 149 A 99 TYR H A 99 TYR HBx 1.0 . 3.23 153 150 A 7 VAL HGx% A 99 TYR H 1.0 . 5.50 154 151 A 24 GLU H A 21 ASP HA 1.0 . 5.50 155 152 A 25 TYR H A 28 ILE H 1.0 . 5.50 156 153 A 28 ILE H A 30 GLU H 1.0 . 5.43 157 154 A 28 ILE H A 29 VAL HA 1.0 . 5.46 158 155 A 28 ILE H A 27 GLU HGy 1.0 . 5.05 159 156 A 28 ILE H A 27 GLU HBy 1.0 . 3.56 160 157 A 28 ILE H A 28 ILE HG2% 1.0 . 4.36 161 158 A 28 ILE H A 29 VAL HGy% 1.0 . 5.37 162 159 A 84 PHE H A 83 LYS H 1.0 . 4.60 163 160 A 83 LYS H A 83 LYS HBx 1.0 . 3.15 164 160 A 83 LYS HBy A 83 LYS H 1.0 . 3.15 165 161 A 83 LYS H A 83 LYS HGy 1.0 . 4.06 166 162 A 89 VAL HGx% A 83 LYS H 1.0 . 5.50 167 163 A 87 ARG HBy A 88 VAL H 1.0 . 4.09 168 164 A 88 VAL H A 87 ARG HBx 1.0 . 3.02 169 165 A 88 VAL H A 87 ARG HGy 1.0 . 4.53 170 166 A 88 VAL H A 87 ARG HGx 1.0 . 4.71 171 167 A 88 VAL H A 83 LYS HA 1.0 . 5.34 172 168 A 51 VAL H A 53 GLY H 1.0 . 5.39 173 169 A 51 VAL H A 56 VAL H 1.0 . 4.88 174 170 A 51 VAL H A 50 PRO HA 1.0 . 2.85 175 171 A 51 VAL H A 50 PRO HBy 1.0 . 3.85 176 172 A 51 VAL H A 51 VAL HB 1.0 . 3.25 177 173 A 51 VAL H A 56 VAL HGy% 1.0 . 3.52 178 174 A 86 ASN H A 87 ARG H 1.0 . 3.43 179 175 A 87 ARG H A 83 LYS HA 1.0 . 4.77 180 176 A 87 ARG H A 85 ALA HA 1.0 . 5.19 181 177 A 87 ARG H A 86 ASN HBx 1.0 . 4.92 182 177 A 87 ARG H A 86 ASN HBy 1.0 . 4.92 183 178 A 87 ARG H A 87 ARG HBy 1.0 . 3.44 184 179 A 87 ARG H A 87 ARG HGy 1.0 . 3.75 185 180 A 28 ILE HA A 32 VAL H 1.0 . 4.72 186 181 A 29 VAL HA A 32 VAL H 1.0 . 4.51 187 182 A 33 ARG H A 32 VAL H 1.0 . 3.11 188 183 A 34 ASP H A 35 GLU HA 1.0 . 5.50 189 184 A 34 ASP HBy A 34 ASP H 1.0 . 3.13 190 185 A 34 ASP H A 34 ASP HBx 1.0 . 3.44 191 186 A 33 ARG HBy A 34 ASP H 1.0 . 3.42 192 187 A 93 TYR H A 93 TYR HE% 1.0 . 5.29 193 188 A 93 TYR H A 92 LYS HA 1.0 . 2.99 194 189 A 93 TYR H A 93 TYR HBy 1.0 . 3.94 195 190 A 93 TYR H A 93 TYR HBx 1.0 . 3.41 196 191 A 93 TYR H A 92 LYS HBx 1.0 . 3.39 197 191 A 93 TYR H A 92 LYS HBy 1.0 . 3.39 198 192 A 93 TYR H A 8 LEU HDx% 1.0 . 5.50 199 193 A 49 ARG H A 50 PRO HDy 1.0 . 5.50 200 194 A 82 ARG H A 81 GLY H 1.0 . 3.35 201 195 A 82 ARG H A 89 VAL HB 1.0 . 3.70 202 196 A 82 ARG H A 82 ARG HBy 1.0 . 3.23 203 197 A 82 ARG H A 82 ARG HBx 1.0 . 3.40 204 198 A 82 ARG H A 89 VAL HGx% 1.0 . 4.46 205 199 A 22 ASP H A 21 ASP H 1.0 . 5.50 206 200 A 49 ARG H A 50 PRO HDx 1.0 . 5.34 207 201 A 49 ARG H A 49 ARG HGy 1.0 . 3.89 208 202 A 49 ARG H A 49 ARG HDx 1.0 . 4.63 209 203 A 49 ARG H A 49 ARG HBx 1.0 . 3.45 210 204 A 49 ARG H A 49 ARG HGx 1.0 . 4.43 211 205 A 52 ASP HBy A 54 VAL H 1.0 . 5.35 212 206 A 52 ASP H A 54 VAL H 1.0 . 4.96 213 207 A 53 GLY H A 54 VAL H 1.0 . 3.21 214 208 A 51 VAL H A 54 VAL H 1.0 . 4.00 215 209 A 50 PRO HA A 54 VAL H 1.0 . 5.20 216 210 A 54 VAL H A 54 VAL HB 1.0 . 3.12 217 211 A 51 VAL HB A 54 VAL H 1.0 . 4.35 218 212 A 82 ARG H A 83 LYS H 1.0 . 4.75 219 213 A 82 ARG H A 82 ARG HDx 1.0 . 4.94 220 213 A 82 ARG H A 82 ARG HDy 1.0 . 4.94 221 214 A 32 VAL H A 31 ASP H 1.0 . 3.39 222 215 A 30 GLU H A 31 ASP H 1.0 . 3.36 223 216 A 28 ILE HA A 31 ASP H 1.0 . 3.97 224 217 A 31 ASP H A 31 ASP HBy 1.0 . 3.21 225 218 A 31 ASP H A 30 GLU HBx 1.0 . 3.51 226 219 A 31 ASP H A 32 VAL HGy% 1.0 . 5.32 227 220 A 31 ASP H A 29 VAL HGx% 1.0 . 5.37 228 221 A 21 ASP H A 20 LEU H 1.0 . 4.05 229 222 A 21 ASP H A 19 LEU HA 1.0 . 5.50 230 223 A 21 ASP H A 20 LEU HBx 1.0 . 4.80 231 224 A 103 ASP H A 104 PHE H 1.0 . 4.46 232 225 A 104 PHE H A 104 PHE HE% 1.0 . 5.50 233 226 A 104 PHE H A 103 ASP HA 1.0 . 2.88 234 227 A 104 PHE H A 104 PHE HBy 1.0 . 4.05 235 228 A 104 PHE HBx A 104 PHE H 1.0 . 3.53 236 229 A 104 PHE H A 103 ASP HBx 1.0 . 4.70 237 230 A 104 PHE H A 57 PRO HGx 1.0 . 4.96 238 231 A 104 PHE H A 102 ARG HGx 1.0 . 5.50 239 232 A 68 SER HA A 71 ASP H 1.0 . 5.50 240 233 A 69 VAL H A 71 ASP H 1.0 . 5.33 241 234 A 73 GLN H A 71 ASP H 1.0 . 5.12 242 235 A 71 ASP H A 72 CYS H 1.0 . 3.50 243 236 A 68 SER HBx A 71 ASP H 1.0 . 4.41 244 237 A 71 ASP H A 69 VAL HA 1.0 . 5.32 245 238 A 71 ASP H A 70 PHE HBx 1.0 . 3.38 246 238 A 71 ASP H A 70 PHE HBy 1.0 . 3.38 247 239 A 71 ASP H A 71 ASP HBy 1.0 . 3.40 248 240 A 71 ASP H A 71 ASP HBx 1.0 . 3.81 249 241 A 34 ASP H A 35 GLU H 1.0 . 3.22 250 242 A 35 GLU H A 32 VAL HA 1.0 . 4.10 251 243 A 32 VAL HGy% A 35 GLU H 1.0 . 5.50 252 244 A 35 GLU H A 35 GLU HBy 1.0 . 3.62 253 245 A 74 LYS H A 76 MET H 1.0 . 5.00 254 246 A 72 CYS H A 73 GLN HBy 1.0 . 5.50 255 247 A 72 CYS H A 69 VAL HGx% 1.0 . 5.50 256 248 A 72 CYS H A 69 VAL HGy% 1.0 . 5.50 257 249 A 77 GLN H A 74 LYS H 1.0 . 5.50 258 250 A 71 ASP HA A 74 LYS H 1.0 . 3.99 259 251 A 74 LYS H A 72 CYS HA 1.0 . 5.35 260 252 A 103 ASP H A 103 ASP HBx 1.0 . 3.22 261 253 A 74 LYS HBy A 74 LYS H 1.0 . 3.10 262 254 A 74 LYS HBx A 74 LYS H 1.0 . 3.54 263 255 A 74 LYS H A 74 LYS HGy 1.0 . 3.62 264 256 A 74 LYS H A 75 ALA HB% 1.0 . 5.27 265 257 A 38 LYS H A 38 LYS HGy 1.0 . 3.61 266 258 A 38 LYS H A 38 LYS HBy 1.0 . 3.18 267 259 A 72 CYS H A 72 CYS HBy 1.0 . 3.50 268 260 A 72 CYS H A 70 PHE HBx 1.0 . 4.92 269 260 A 72 CYS H A 70 PHE HBy 1.0 . 4.92 270 261 A 72 CYS HBx A 72 CYS H 1.0 . 3.18 271 262 A 25 TYR H A 25 TYR HD% 1.0 . 4.47 272 263 A 25 TYR H A 22 ASP HA 1.0 . 4.52 273 264 A 25 TYR H A 25 TYR HBx 1.0 . 3.11 274 264 A 25 TYR H A 25 TYR HBy 1.0 . 3.11 275 265 A 25 TYR H A 21 ASP HBy 1.0 . 5.27 276 266 A 94 CYS H A 5 THR H 1.0 . 5.50 277 267 A 94 CYS H A 93 TYR HA 1.0 . 3.14 278 268 A 94 CYS H A 8 LEU HA 1.0 . 4.62 279 269 A 94 CYS H A 93 TYR HBy 1.0 . 3.88 280 270 A 94 CYS H A 94 CYS HBx 1.0 . 3.86 281 271 A 94 CYS H A 7 VAL HB 1.0 . 4.73 282 272 A 94 CYS H A 8 LEU HDx% 1.0 . 5.50 283 273 A 94 CYS H A 7 VAL HGy% 1.0 . 5.50 284 274 A 23 GLU H A 21 ASP HBy 1.0 . 4.47 285 275 A 23 GLU H A 23 GLU HBy 1.0 . 3.06 286 276 A 15 LEU H A 17 GLU H 1.0 . 4.95 287 277 A 17 GLU H A 17 GLU HGy 1.0 . 3.57 288 278 A 17 GLU H A 17 GLU HGx 1.0 . 3.66 289 279 A 15 LEU HBx A 17 GLU H 1.0 . 4.52 290 280 A 69 VAL H A 70 PHE H 1.0 . 3.38 291 281 A 73 GLN H A 70 PHE H 1.0 . 5.50 292 282 A 68 SER HBx A 70 PHE H 1.0 . 4.41 293 283 A 70 PHE H A 70 PHE HBx 1.0 . 2.97 294 283 A 70 PHE HBy A 70 PHE H 1.0 . 2.97 295 284 A 70 PHE H A 69 VAL HB 1.0 . 3.55 296 285 A 103 ASP H A 98 SER HA 1.0 . 4.27 297 286 A 103 ASP H A 103 ASP HBy 1.0 . 3.34 298 287 A 38 LYS H A 36 CYS HA 1.0 . 4.86 299 288 A 7 VAL H A 6 GLU H 1.0 . 3.74 300 289 A 7 VAL H A 66 PHE H 1.0 . 5.33 301 290 A 7 VAL H A 93 TYR HD% 1.0 . 5.15 302 291 A 7 VAL H A 5 THR HB 1.0 . 3.81 303 292 A 7 VAL H A 69 VAL HA 1.0 . 5.50 304 293 A 7 VAL H A 7 VAL HB 1.0 . 3.65 305 294 A 31 ASP H A 29 VAL H 1.0 . 5.01 306 295 A 29 VAL H A 27 GLU HA 1.0 . 4.52 307 296 A 29 VAL H A 26 GLU HA 1.0 . 3.78 308 297 A 29 VAL H A 29 VAL HB 1.0 . 3.02 309 298 A 28 ILE HG2% A 29 VAL H 1.0 . 4.15 310 299 A 20 LEU H A 19 LEU H 1.0 . 4.44 311 300 A 94 CYS H A 7 VAL H 1.0 . 4.56 312 301 A 60 GLY H A 61 LYS HDx 1.0 . 5.50 313 301 A 60 GLY H A 61 LYS HDy 1.0 . 5.50 314 302 A 77 GLN H A 76 MET H 1.0 . 3.45 315 303 A 75 ALA H A 76 MET H 1.0 . 3.46 316 304 A 73 GLN HA A 76 MET H 1.0 . 3.92 317 305 A 76 MET H A 76 MET HBx 1.0 . 3.14 318 305 A 76 MET H A 76 MET HBy 1.0 . 3.14 319 306 A 93 TYR HE% A 76 MET H 1.0 . 5.50 320 307 A 76 MET H A 74 LYS HA 1.0 . 5.50 321 308 A 76 MET H A 8 LEU HDy% 1.0 . 4.51 322 309 A 8 LEU HDx% A 76 MET H 1.0 . 4.70 323 310 A 40 GLY HAy A 41 LEU H 1.0 . 3.24 324 311 A 41 LEU H A 40 GLY HAx 1.0 . 3.16 325 312 A 71 ASP HBx A 41 LEU H 1.0 . 4.61 326 313 A 41 LEU HBx A 41 LEU H 1.0 . 2.87 327 314 A 3 HIS H A 3 HIS HD2 1.0 . 5.20 328 315 A 3 HIS H A 2 GLY HAx 1.0 . 3.26 329 315 A 3 HIS H A 2 GLY HAy 1.0 . 3.26 330 316 A 3 HIS H A 4 PRO HDy 1.0 . 5.37 331 317 A 3 HIS H A 4 PRO HDx 1.0 . 5.50 332 318 A 3 HIS H A 3 HIS HBx 1.0 . 3.75 333 319 A 25 TYR H A 27 GLU H 1.0 . 5.09 334 320 A 27 GLU H A 25 TYR HBx 1.0 . 5.34 335 320 A 27 GLU H A 25 TYR HBy 1.0 . 5.34 336 321 A 27 GLU H A 28 ILE HG1y 1.0 . 5.50 337 322 A 27 GLU H A 28 ILE H 1.0 . 3.11 338 323 A 27 GLU H A 27 GLU HBy 1.0 . 2.94 339 324 A 76 MET H A 79 LEU H 1.0 . 5.50 340 325 A 79 LEU H A 78 GLY H 1.0 . 3.39 341 326 A 79 LEU H A 80 THR H 1.0 . 3.26 342 327 A 79 LEU H A 39 TYR HE% 1.0 . 5.34 343 328 A 79 LEU H A 76 MET HA 1.0 . 4.71 344 329 A 79 LEU H A 79 LEU HBy 1.0 . 3.02 345 330 A 79 LEU H A 79 LEU HBx 1.0 . 3.69 346 331 A 44 SER HA A 45 ILE H 1.0 . 2.94 347 332 A 45 ILE H A 44 SER HBx 1.0 . 3.61 348 332 A 45 ILE H A 44 SER HBy 1.0 . 3.61 349 333 A 45 ILE H A 45 ILE HB 1.0 . 3.49 350 334 A 46 GLU H A 45 ILE H 1.0 . 4.76 351 335 A 46 GLU HA A 45 ILE H 1.0 . 4.78 352 336 A 45 ILE H A 64 VAL HA 1.0 . 5.46 353 337 A 60 GLY H A 59 CYS H 1.0 . 4.66 354 338 A 59 CYS H A 58 GLY H 1.0 . 3.33 355 339 A 61 LYS H A 59 CYS H 1.0 . 5.32 356 340 A 59 CYS HBy A 59 CYS H 1.0 . 3.05 357 341 A 59 CYS H A 56 VAL HB 1.0 . 4.71 358 342 A 59 CYS H A 61 LYS HDx 1.0 . 4.56 359 342 A 61 LYS HDy A 59 CYS H 1.0 . 4.56 360 343 A 56 VAL HGy% A 59 CYS H 1.0 . 4.13 361 344 A 62 ILE H A 61 LYS H 1.0 . 5.11 362 345 A 62 ILE H A 9 CYS HA 1.0 . 5.19 363 346 A 12 ASN H A 13 MET H 1.0 . 3.83 364 347 A 14 VAL H A 13 MET H 1.0 . 3.21 365 348 A 13 MET H A 11 MET HA 1.0 . 4.37 366 349 A 89 VAL HGy% A 13 MET H 1.0 . 5.50 367 350 A 13 MET H A 14 VAL HGy% 1.0 . 4.76 368 351 A 13 MET H A 12 ASN HBx 1.0 . 4.85 369 351 A 13 MET H A 12 ASN HBy 1.0 . 4.85 370 352 A 77 GLN H A 79 LEU H 1.0 . 5.30 371 353 A 73 GLN HA A 77 GLN H 1.0 . 4.85 372 354 A 77 GLN H A 76 MET HBx 1.0 . 3.41 373 354 A 77 GLN H A 76 MET HBy 1.0 . 3.41 374 355 A 77 GLN H A 76 MET HGx 1.0 . 4.16 375 355 A 77 GLN H A 76 MET HGy 1.0 . 4.16 376 356 A 77 GLN H A 8 LEU HDx% 1.0 . 5.50 377 357 A 62 ILE H A 63 PHE H 1.0 . 5.14 378 358 A 62 ILE H A 61 LYS HA 1.0 . 3.15 379 359 A 62 ILE H A 61 LYS HBy 1.0 . 4.35 380 360 A 62 ILE H A 62 ILE HB 1.0 . 3.54 381 361 A 62 ILE H A 62 ILE HG1y 1.0 . 4.22 382 362 A 62 ILE H A 61 LYS HBx 1.0 . 3.97 383 363 A 97 ASP H A 100 HIS H 1.0 . 5.28 384 364 A 99 TYR H A 97 ASP H 1.0 . 4.50 385 365 A 97 ASP H A 95 ASP HA 1.0 . 5.14 386 366 A 96 PRO HDy A 97 ASP H 1.0 . 4.56 387 367 A 97 ASP H A 95 ASP HBx 1.0 . 3.07 388 367 A 97 ASP H A 95 ASP HBy 1.0 . 3.07 389 368 A 97 ASP H A 96 PRO HGy 1.0 . 3.97 390 369 A 97 ASP H A 96 PRO HBx 1.0 . 4.36 391 370 A 97 ASP H A 96 PRO HGx 1.0 . 3.80 392 371 A 98 SER H A 100 HIS H 1.0 . 4.99 393 372 A 99 TYR H A 100 HIS H 1.0 . 3.55 394 373 A 100 HIS H A 101 ARG H 1.0 . 3.47 395 374 A 97 ASP HA A 100 HIS H 1.0 . 4.06 396 375 A 98 SER HA A 100 HIS H 1.0 . 4.67 397 376 A 100 HIS H A 100 HIS HBy 1.0 . 3.20 398 377 A 99 TYR HBx A 100 HIS H 1.0 . 3.57 399 378 A 7 VAL HGy% A 97 ASP H 1.0 . 5.50 400 379 A 73 GLN H A 74 LYS H 1.0 . 3.51 401 380 A 73 GLN H A 72 CYS H 1.0 . 3.52 402 381 A 73 GLN H A 72 CYS HBy 1.0 . 3.72 403 382 A 73 GLN H A 73 GLN HGx 1.0 . 3.65 404 383 A 73 GLN H A 73 GLN HBy 1.0 . 3.32 405 384 A 73 GLN H A 73 GLN HBx 1.0 . 3.41 406 385 A 73 GLN H A 74 LYS HGx 1.0 . 5.50 407 386 A 73 GLN H A 75 ALA HB% 1.0 . 5.50 408 387 A 73 GLN H A 74 LYS HA 1.0 . 5.50 409 388 A 101 ARG H A 100 HIS HBy 1.0 . 3.89 410 389 A 101 ARG H A 101 ARG HBx 1.0 . 4.15 411 390 A 26 GLU H A 28 ILE HB 1.0 . 5.09 412 391 A 25 TYR H A 26 GLU H 1.0 . 3.62 413 392 A 24 GLU H A 26 GLU H 1.0 . 4.85 414 393 A 27 GLU H A 26 GLU H 1.0 . 3.52 415 394 A 26 GLU H A 25 TYR HE% 1.0 . 5.50 416 395 A 22 ASP HA A 26 GLU H 1.0 . 4.88 417 396 A 26 GLU H A 25 TYR HBx 1.0 . 3.43 418 396 A 25 TYR HBy A 26 GLU H 1.0 . 3.43 419 397 A 27 GLU HGy A 26 GLU H 1.0 . 3.78 420 398 A 29 VAL HGy% A 26 GLU H 1.0 . 5.50 421 399 A 98 SER H A 97 ASP H 1.0 . 3.14 422 400 A 98 SER H A 99 TYR H 1.0 . 3.31 423 401 A 98 SER H A 99 TYR HA 1.0 . 5.23 424 402 A 98 SER H A 97 ASP HBy 1.0 . 3.23 425 403 A 38 LYS H A 39 TYR H 1.0 . 3.14 426 404 A 40 GLY HAy A 39 TYR H 1.0 . 5.02 427 405 A 39 TYR H A 39 TYR HBx 1.0 . 3.58 428 406 A 38 LYS HBy A 39 TYR H 1.0 . 3.99 429 407 A 75 ALA HB% A 39 TYR H 1.0 . 5.50 430 408 A 30 GLU H A 32 VAL H 1.0 . 4.94 431 409 A 30 GLU H A 29 VAL H 1.0 . 3.61 432 410 A 30 GLU H A 30 GLU HBx 1.0 . 3.24 433 411 A 30 GLU H A 29 VAL HB 1.0 . 3.45 434 412 A 9 CYS H A 92 LYS H 1.0 . 3.78 435 413 A 93 TYR H A 92 LYS H 1.0 . 5.30 436 414 A 91 THR HA A 92 LYS H 1.0 . 3.00 437 415 A 92 LYS H A 10 LEU HA 1.0 . 4.83 438 416 A 91 THR HB A 92 LYS H 1.0 . 3.35 439 417 A 9 CYS HBx A 92 LYS H 1.0 . 3.99 440 418 A 92 LYS H A 92 LYS HBx 1.0 . 3.88 441 418 A 92 LYS HBy A 92 LYS H 1.0 . 3.88 442 419 A 92 LYS H A 91 THR HG2% 1.0 . 4.48 443 420 A 10 LEU H A 92 LYS H 1.0 . 5.21 444 421 A 81 GLY H A 90 VAL HA 1.0 . 4.82 445 422 A 81 GLY H A 80 THR HA 1.0 . 2.81 446 423 A 81 GLY H A 89 VAL HB 1.0 . 4.24 447 424 A 82 ARG HBy A 81 GLY H 1.0 . 5.43 448 425 A 89 VAL HGx% A 81 GLY H 1.0 . 4.33 449 426 A 103 ASP H A 102 ARG H 1.0 . 3.27 450 427 A 104 PHE HE% A 102 ARG H 1.0 . 5.47 451 428 A 102 ARG H A 101 ARG HDx 1.0 . 5.50 452 428 A 102 ARG H A 101 ARG HDy 1.0 . 5.50 453 429 A 102 ARG H A 102 ARG HDx 1.0 . 5.37 454 430 A 102 ARG H A 101 ARG HBy 1.0 . 4.21 455 431 A 102 ARG HGx A 102 ARG H 1.0 . 4.64 456 432 A 102 ARG H A 102 ARG HBy 1.0 . 4.10 457 433 A 102 ARG H A 102 ARG HBx 1.0 . 4.10 458 434 A 36 CYS H A 37 SER H 1.0 . 3.36 459 435 A 39 TYR H A 37 SER H 1.0 . 5.09 460 436 A 38 LYS H A 37 SER H 1.0 . 3.47 461 437 A 37 SER H A 34 ASP HA 1.0 . 4.19 462 438 A 37 SER H A 37 SER HBy 1.0 . 3.35 463 439 A 37 SER H A 37 SER HBx 1.0 . 3.56 464 440 A 37 SER H A 33 ARG HA 1.0 . 4.77 465 441 A 37 SER H A 36 CYS HBy 1.0 . 4.18 466 442 A 38 LYS HGy A 37 SER H 1.0 . 5.07 467 443 A 38 LYS HBy A 37 SER H 1.0 . 5.33 468 444 A 5 THR H A 6 GLU H 1.0 . 5.42 469 445 A 6 GLU H A 5 THR HB 1.0 . 2.96 470 446 A 69 VAL HA A 6 GLU H 1.0 . 5.21 471 447 A 6 GLU H A 6 GLU HGx 1.0 . 3.90 472 447 A 6 GLU H A 6 GLU HGy 1.0 . 3.90 473 448 A 6 GLU HBx A 6 GLU H 1.0 . 4.01 474 449 A 81 GLY H A 80 THR H 1.0 . 4.61 475 450 A 78 GLY H A 80 THR H 1.0 . 4.70 476 451 A 80 THR H A 80 THR HB 1.0 . 3.12 477 452 A 80 THR H A 77 GLN HA 1.0 . 4.54 478 453 A 80 THR H A 79 LEU HBy 1.0 . 4.44 479 454 A 80 THR H A 91 THR HG2% 1.0 . 4.58 480 455 A 35 GLU H A 36 CYS H 1.0 . 3.07 481 456 A 38 LYS H A 36 CYS H 1.0 . 4.64 482 457 A 36 CYS H A 37 SER HA 1.0 . 5.50 483 458 A 36 CYS H A 33 ARG HA 1.0 . 4.26 484 459 A 36 CYS H A 36 CYS HBy 1.0 . 3.40 485 460 A 36 CYS H A 36 CYS HBx 1.0 . 3.76 486 461 A 36 CYS H A 35 GLU HBx 1.0 . 4.02 487 462 A 32 VAL HGx% A 36 CYS H 1.0 . 4.83 488 463 A 36 CYS H A 42 VAL HGy% 1.0 . 4.92 489 464 A 81 GLY H A 91 THR H 1.0 . 5.50 490 465 A 90 VAL H A 91 THR H 1.0 . 4.95 491 466 A 80 THR HA A 91 THR H 1.0 . 5.03 492 467 A 91 THR H A 90 VAL HB 1.0 . 4.68 493 468 A 91 THR HG2% A 91 THR H 1.0 . 3.38 494 469 A 12 ASN H A 14 VAL H 1.0 . 4.99 495 470 A 12 ASN H A 11 MET HBy 1.0 . 4.08 496 471 A 12 ASN H A 11 MET HBx 1.0 . 4.38 497 472 A 7 VAL H A 5 THR H 1.0 . 5.50 498 473 A 93 TYR HBx A 5 THR H 1.0 . 5.12 499 474 A 69 VAL HGx% A 5 THR H 1.0 . 5.50 500 475 A 86 ASN H A 86 ASN HD2y 1.0 . 5.50 501 476 A 5 THR H A 93 TYR HA 1.0 . 5.50 502 477 A 86 ASN H A 86 ASN HBx 1.0 . 3.72 503 477 A 86 ASN H A 86 ASN HBy 1.0 . 3.72 504 478 A 86 ASN H A 83 LYS HBx 1.0 . 4.64 505 478 A 86 ASN H A 83 LYS HBy 1.0 . 4.64 506 479 A 86 ASN HD2y A 86 ASN HA 1.0 . 5.20 507 480 A 86 ASN HD2y A 86 ASN HBx 1.0 . 3.44 508 480 A 86 ASN HBy A 86 ASN HD2y 1.0 . 3.44 509 481 A 17 GLU H A 19 LEU H 1.0 . 4.52 510 482 A 86 ASN HA A 86 ASN HD2x 1.0 . 5.50 511 483 A 19 LEU H A 18 GLU H 1.0 . 5.45 512 484 A 18 GLU H A 15 LEU HA 1.0 . 5.35 513 485 A 17 GLU H A 18 GLU H 1.0 . 3.78 514 486 A 18 GLU H A 18 GLU HBx 1.0 . 3.33 515 486 A 18 GLU H A 18 GLU HBy 1.0 . 3.33 516 487 A 18 GLU H A 19 LEU HG 1.0 . 4.74 517 488 A 18 GLU H A 15 LEU HBy 1.0 . 4.00 518 489 A 15 LEU HBx A 18 GLU H 1.0 . 5.21 519 490 A 90 VAL H A 12 ASN HD2y 1.0 . 4.84 520 491 A 12 ASN HD2y A 12 ASN HA 1.0 . 5.12 521 492 A 12 ASN HD2y A 89 VAL HA 1.0 . 4.76 522 493 A 12 ASN HD2y A 90 VAL HGx% 1.0 . 4.14 523 493 A 12 ASN HD2y A 90 VAL HGy% 1.0 . 4.14 524 494 A 88 VAL H A 12 ASN HD2x 1.0 . 5.13 525 495 A 90 VAL H A 12 ASN HD2x 1.0 . 5.50 526 496 A 12 ASN HA A 12 ASN HD2x 1.0 . 5.50 527 497 A 89 VAL HA A 12 ASN HD2x 1.0 . 5.50 528 498 A 11 MET HBx A 12 ASN HD2x 1.0 . 4.75 529 499 A 66 PHE H A 68 SER H 1.0 . 4.99 530 500 A 68 SER H A 67 THR H 1.0 . 3.24 531 501 A 69 VAL H A 68 SER H 1.0 . 4.75 532 502 A 70 PHE H A 68 SER H 1.0 . 4.90 533 503 A 72 CYS H A 68 SER H 1.0 . 5.26 534 504 A 68 SER H A 66 PHE HA 1.0 . 4.37 535 505 A 68 SER H A 67 THR HB 1.0 . 4.57 536 506 A 68 SER HBx A 68 SER H 1.0 . 3.96 537 507 A 66 PHE HBy A 68 SER H 1.0 . 3.55 538 508 A 66 PHE HBx A 68 SER H 1.0 . 3.79 539 509 A 71 ASP HBy A 68 SER H 1.0 . 4.03 540 510 A 71 ASP HBx A 68 SER H 1.0 . 4.80 541 511 A 77 GLN HA A 77 GLN HE2y 1.0 . 5.50 542 512 A 77 GLN HE2y A 76 MET HBx 1.0 . 5.50 543 512 A 76 MET HBy A 77 GLN HE2y 1.0 . 5.50 544 513 A 77 GLN HE2y A 77 GLN HBx 1.0 . 5.11 545 513 A 77 GLN HE2y A 77 GLN HBy 1.0 . 5.11 546 514 A 73 GLN H A 73 GLN HE2y 1.0 . 5.50 547 515 A 73 GLN HA A 73 GLN HE2y 1.0 . 5.50 548 516 A 43 LYS H A 44 SER H 1.0 . 3.20 549 517 A 65 GLU H A 44 SER H 1.0 . 3.87 550 518 A 45 ILE H A 44 SER H 1.0 . 4.77 551 519 A 66 PHE HA A 44 SER H 1.0 . 4.69 552 520 A 64 VAL HA A 44 SER H 1.0 . 4.97 553 521 A 44 SER H A 42 VAL HA 1.0 . 4.22 554 522 A 65 GLU HBy A 44 SER H 1.0 . 3.54 555 523 A 65 GLU HGx A 44 SER H 1.0 . 5.10 556 524 A 43 LYS HBy A 44 SER H 1.0 . 3.64 557 525 A 43 LYS HBx A 44 SER H 1.0 . 3.62 558 526 A 64 VAL HGy% A 44 SER H 1.0 . 5.33 559 527 A 73 GLN HGx A 73 GLN HE2y 1.0 . 3.81 560 528 A 73 GLN HE2y A 4 PRO HGy 1.0 . 5.11 561 529 A 73 GLN HE2y A 4 PRO HBy 1.0 . 4.46 562 530 A 73 GLN HE2y A 4 PRO HBx 1.0 . 5.50 563 531 A 69 VAL HGx% A 73 GLN HE2y 1.0 . 5.50 564 532 A 69 VAL HGy% A 73 GLN HE2y 1.0 . 5.50 565 533 A 14 VAL H A 12 ASN HA 1.0 . 4.91 566 534 A 14 VAL H A 14 VAL HB 1.0 . 4.08 567 535 A 14 VAL H A 13 MET HBy 1.0 . 3.97 568 536 A 14 VAL H A 13 MET HBx 1.0 . 4.26 569 537 A 104 PHE HBx A 58 GLY H 1.0 . 5.50 570 538 A 58 GLY H A 57 PRO HA 1.0 . 2.90 571 539 A 59 CYS HBy A 58 GLY H 1.0 . 4.72 572 540 A 57 PRO HBx A 58 GLY H 1.0 . 4.30 573 541 A 58 GLY H A 61 LYS HDx 1.0 . 5.50 574 541 A 61 LYS HDy A 58 GLY H 1.0 . 5.50 575 542 A 56 VAL HGy% A 58 GLY H 1.0 . 5.42 576 543 A 66 PHE H A 67 THR H 1.0 . 4.93 577 544 A 41 LEU H A 67 THR H 1.0 . 5.50 578 545 A 67 THR H A 66 PHE HA 1.0 . 3.44 579 546 A 67 THR H A 67 THR HB 1.0 . 4.16 580 547 A 66 PHE HBy A 67 THR H 1.0 . 3.58 581 548 A 66 PHE HBx A 67 THR H 1.0 . 4.08 582 549 A 71 ASP HBy A 67 THR H 1.0 . 5.50 583 550 A 41 LEU HBx A 67 THR H 1.0 . 4.99 584 551 A 43 LYS HBy A 67 THR H 1.0 . 5.41 585 552 A 52 ASP H A 53 GLY H 1.0 . 3.73 586 553 A 52 ASP HBy A 53 GLY H 1.0 . 4.36 587 554 A 53 GLY H A 52 ASP HBx 1.0 . 4.55 588 555 A 53 GLY H A 54 VAL HGy% 1.0 . 4.84 589 556 A 78 GLY H A 39 TYR HE% 1.0 . 5.16 590 557 A 78 GLY H A 77 GLN HBx 1.0 . 3.59 591 557 A 78 GLY H A 77 GLN HBy 1.0 . 3.59 592 558 A 78 GLY H A 79 LEU HBy 1.0 . 4.71 593 559 A 76 MET H A 78 GLY H 1.0 . 5.07 594 560 A 41 LEU H A 40 GLY H 1.0 . 4.57 595 561 A 37 SER HA A 40 GLY H 1.0 . 4.08 596 562 A 39 TYR HBy A 40 GLY H 1.0 . 4.59 597 563 A 38 LYS HBy A 40 GLY H 1.0 . 5.50 598 564 A 75 ALA HB% A 40 GLY H 1.0 . 5.50 599 565 A 39 TYR H A 40 GLY H 1.0 . 3.12 600 566 A 39 TYR HBx A 40 GLY H 1.0 . 4.12 601 567 A 75 ALA HA A 78 GLY HAy 1.0 . 5.42 602 568 A 78 GLY HAx A 77 GLN HBx 1.0 . 5.00 603 568 A 77 GLN HBy A 78 GLY HAx 1.0 . 5.00 604 569 A 75 ALA HA A 78 GLY HAx 1.0 . 5.12 605 570 A 80 THR HG2% A 81 GLY HAy 1.0 . 4.96 606 571 A 81 GLY HAy A 88 VAL HGy% 1.0 . 3.95 607 572 A 54 VAL HGy% A 53 GLY HAy 1.0 . 4.57 608 573 A 58 GLY HAy A 63 PHE HE% 1.0 . 5.17 609 574 A 58 GLY HAy A 104 PHE HBy 1.0 . 4.24 610 575 A 58 GLY HAy A 61 LYS HDx 1.0 . 4.74 611 575 A 58 GLY HAy A 61 LYS HDy 1.0 . 4.74 612 576 A 80 THR HG2% A 81 GLY HAx 1.0 . 5.27 613 577 A 81 GLY HAx A 88 VAL HB 1.0 . 4.92 614 578 A 71 ASP HBx A 40 GLY HAy 1.0 . 4.22 615 579 A 41 LEU HBx A 40 GLY HAy 1.0 . 4.65 616 580 A 14 VAL HGy% A 60 GLY HAy 1.0 . 4.79 617 581 A 71 ASP HBy A 40 GLY HAy 1.0 . 4.82 618 582 A 66 PHE HD% A 40 GLY HAx 1.0 . 5.45 619 583 A 71 ASP HBx A 40 GLY HAx 1.0 . 4.29 620 584 A 40 GLY HAx A 39 TYR HA 1.0 . 5.09 621 585 A 41 LEU HBx A 40 GLY HAx 1.0 . 4.57 622 586 A 19 LEU HDy% A 60 GLY HAx 1.0 . 5.50 623 587 A 87 ARG HBy A 87 ARG HDy 1.0 . 4.17 624 588 A 87 ARG H A 87 ARG HDy 1.0 . 5.50 625 589 A 87 ARG HBy A 87 ARG HDx 1.0 . 4.04 626 590 A 87 ARG HBx A 87 ARG HDx 1.0 . 3.95 627 591 A 87 ARG H A 87 ARG HDx 1.0 . 4.99 628 592 A 79 LEU HBy A 79 LEU HDy% 1.0 . 3.85 629 593 A 79 LEU HBx A 79 LEU HDy% 1.0 . 3.92 630 594 A 104 PHE HE% A 102 ARG HDy 1.0 . 4.09 631 595 A 10 LEU HBy A 10 LEU HDx% 1.0 . 3.72 632 596 A 10 LEU H A 10 LEU HBx 1.0 . 3.94 633 597 A 83 LYS H A 82 ARG HDx 1.0 . 3.99 634 597 A 83 LYS H A 82 ARG HDy 1.0 . 3.99 635 598 A 82 ARG HBy A 82 ARG HDx 1.0 . 3.47 636 598 A 82 ARG HBy A 82 ARG HDy 1.0 . 3.47 637 599 A 33 ARG HDx A 33 ARG HGx 1.0 . 2.97 638 599 A 33 ARG HDy A 33 ARG HGx 1.0 . 2.97 639 599 A 33 ARG HGy A 33 ARG HDx 1.0 . 2.97 640 599 A 33 ARG HGy A 33 ARG HDy 1.0 . 2.97 641 600 A 29 VAL HGx% A 33 ARG HDx 1.0 . 4.43 642 600 A 29 VAL HGx% A 33 ARG HDy 1.0 . 4.43 643 601 A 33 ARG H A 33 ARG HDx 1.0 . 4.93 644 601 A 33 ARG H A 33 ARG HDy 1.0 . 4.93 645 602 A 102 ARG HDy A 102 ARG HA 1.0 . 4.70 646 603 A 102 ARG HBy A 102 ARG HDy 1.0 . 3.46 647 604 A 102 ARG HDx A 102 ARG HA 1.0 . 4.38 648 605 A 104 PHE HE% A 102 ARG HDx 1.0 . 4.15 649 606 A 102 ARG HDx A 102 ARG HBy 1.0 . 3.44 650 607 A 22 ASP H A 21 ASP HBy 1.0 . 5.08 651 608 A 24 GLU H A 21 ASP HBy 1.0 . 3.96 652 609 A 21 ASP H A 21 ASP HBy 1.0 . 3.53 653 610 A 21 ASP HBx A 24 GLU HBy 1.0 . 4.10 654 611 A 21 ASP H A 21 ASP HBx 1.0 . 3.59 655 612 A 22 ASP H A 21 ASP HBx 1.0 . 4.71 656 613 A 49 ARG H A 49 ARG HDy 1.0 . 5.49 657 614 A 62 ILE H A 10 LEU HBy 1.0 . 4.76 658 615 A 49 ARG HDx A 49 ARG HA 1.0 . 4.79 659 616 A 49 ARG HDy A 49 ARG HA 1.0 . 5.09 660 617 A 49 ARG HA A 19 LEU HBy 1.0 . 5.28 661 618 A 19 LEU H A 19 LEU HBy 1.0 . 4.17 662 619 A 50 PRO HDy A 19 LEU HBy 1.0 . 4.54 663 620 A 50 PRO HDx A 19 LEU HBy 1.0 . 4.52 664 621 A 19 LEU HDy% A 19 LEU HBy 1.0 . 4.11 665 622 A 21 ASP H A 20 LEU HBy 1.0 . 4.26 666 623 A 20 LEU H A 20 LEU HBy 1.0 . 3.62 667 624 A 19 LEU H A 19 LEU HBx 1.0 . 4.12 668 625 A 50 PRO HDx A 19 LEU HBx 1.0 . 5.14 669 626 A 20 LEU H A 20 LEU HBx 1.0 . 3.74 670 627 A 20 LEU HBx A 20 LEU HDy% 1.0 . 3.74 671 628 A 20 LEU H A 19 LEU HBy 1.0 . 5.39 672 629 A 19 LEU HBy A 16 PRO HA 1.0 . 5.22 673 630 A 46 GLU H A 45 ILE HB 1.0 . 4.33 674 631 A 46 GLU HA A 45 ILE HB 1.0 . 5.26 675 632 A 63 PHE HE% A 61 LYS HEx 1.0 . 5.50 676 632 A 63 PHE HE% A 61 LYS HEy 1.0 . 5.50 677 633 A 61 LYS HA A 61 LYS HEx 1.0 . 5.00 678 633 A 61 LYS HA A 61 LYS HEy 1.0 . 5.00 679 634 A 61 LYS HBy A 61 LYS HEx 1.0 . 3.86 680 634 A 61 LYS HBy A 61 LYS HEy 1.0 . 3.86 681 635 A 61 LYS HDx A 61 LYS HEx 1.0 . 2.98 682 635 A 61 LYS HDy A 61 LYS HEx 1.0 . 2.98 683 635 A 61 LYS HEy A 61 LYS HDx 1.0 . 2.98 684 635 A 61 LYS HDy A 61 LYS HEy 1.0 . 2.98 685 636 A 38 LYS HGx A 38 LYS HEx 1.0 . 3.29 686 636 A 38 LYS HGx A 38 LYS HEy 1.0 . 3.29 687 637 A 61 LYS HGx A 61 LYS HEx 1.0 . 3.61 688 637 A 61 LYS HGx A 61 LYS HEy 1.0 . 3.61 689 638 A 63 PHE HBy A 46 GLU HA 1.0 . 5.13 690 639 A 63 PHE HBy A 46 GLU HBx 1.0 . 4.21 691 640 A 45 ILE HA A 63 PHE HBy 1.0 . 5.32 692 641 A 83 LYS H A 83 LYS HEx 1.0 . 5.31 693 641 A 83 LYS H A 83 LYS HEy 1.0 . 5.31 694 642 A 95 ASP H A 95 ASP HBx 1.0 . 3.34 695 642 A 95 ASP H A 95 ASP HBy 1.0 . 3.34 696 643 A 98 SER H A 95 ASP HBx 1.0 . 4.18 697 643 A 98 SER H A 95 ASP HBy 1.0 . 4.18 698 644 A 96 PRO HDx A 95 ASP HBx 1.0 . 3.67 699 644 A 95 ASP HBy A 96 PRO HDx 1.0 . 3.67 700 645 A 38 LYS H A 38 LYS HEx 1.0 . 4.94 701 645 A 38 LYS H A 38 LYS HEy 1.0 . 4.94 702 646 A 63 PHE HBx A 99 TYR HD% 1.0 . 4.34 703 647 A 7 VAL HGx% A 63 PHE HBx 1.0 . 4.75 704 648 A 7 VAL HGx% A 63 PHE HBy 1.0 . 5.39 705 649 A 74 LYS HBy A 74 LYS HEx 1.0 . 4.12 706 649 A 74 LYS HBy A 74 LYS HEy 1.0 . 4.12 707 650 A 74 LYS HA A 74 LYS HEx 1.0 . 5.18 708 650 A 74 LYS HA A 74 LYS HEy 1.0 . 5.18 709 651 A 43 LYS HEy A 43 LYS HGx 1.0 . 2.94 710 651 A 43 LYS HEx A 43 LYS HGx 1.0 . 2.94 711 651 A 43 LYS HGy A 43 LYS HEx 1.0 . 2.94 712 651 A 43 LYS HGy A 43 LYS HEy 1.0 . 2.94 713 652 A 83 LYS HGy A 83 LYS HEx 1.0 . 3.49 714 652 A 83 LYS HGy A 83 LYS HEy 1.0 . 3.49 715 653 A 83 LYS HGx A 83 LYS HEx 1.0 . 3.48 716 653 A 83 LYS HGx A 83 LYS HEy 1.0 . 3.48 717 654 A 63 PHE HBx A 46 GLU HBy 1.0 . 5.04 718 655 A 70 PHE HDx A 74 LYS HEx 1.0 . 4.68 719 655 A 74 LYS HEy A 70 PHE HDx 1.0 . 4.68 720 656 A 83 LYS HDy A 83 LYS HEx 1.0 . 2.98 721 656 A 83 LYS HDx A 83 LYS HEx 1.0 . 2.98 722 656 A 83 LYS HEy A 83 LYS HDx 1.0 . 2.98 723 656 A 83 LYS HEy A 83 LYS HDy 1.0 . 2.98 724 657 A 15 LEU HBy A 16 PRO HDx 1.0 . 3.95 725 658 A 17 GLU H A 15 LEU HBy 1.0 . 4.71 726 659 A 15 LEU HBx A 16 PRO HDx 1.0 . 4.32 727 660 A 15 LEU HBx A 17 GLU HGx 1.0 . 4.03 728 661 A 15 LEU HBx A 15 LEU HDx% 1.0 . 3.59 729 662 A 66 PHE HBy A 67 THR HG2% 1.0 . 5.39 730 663 A 6 GLU HA A 66 PHE HBx 1.0 . 5.47 731 664 A 84 PHE H A 84 PHE HBy 1.0 . 3.83 732 665 A 85 ALA H A 84 PHE HBy 1.0 . 4.28 733 666 A 83 LYS HA A 84 PHE HBy 1.0 . 5.11 734 667 A 84 PHE HBx A 84 PHE H 1.0 . 3.67 735 668 A 84 PHE HBx A 13 MET HA 1.0 . 5.30 736 669 A 84 PHE HBx A 13 MET HGx 1.0 . 4.80 737 669 A 84 PHE HBx A 13 MET HGy 1.0 . 4.80 738 670 A 10 LEU H A 62 ILE HB 1.0 . 4.34 739 671 A 34 ASP HBy A 35 GLU HA 1.0 . 5.11 740 672 A 34 ASP HBy A 35 GLU H 1.0 . 3.55 741 673 A 31 ASP HA A 34 ASP HBy 1.0 . 3.53 742 674 A 22 ASP H A 22 ASP HBy 1.0 . 3.75 743 675 A 23 GLU H A 22 ASP HBx 1.0 . 3.39 744 676 A 97 ASP H A 97 ASP HBy 1.0 . 3.19 745 677 A 52 ASP HBy A 51 VAL HGx% 1.0 . 4.19 746 678 A 97 ASP H A 97 ASP HBx 1.0 . 3.18 747 679 A 98 SER H A 97 ASP HBx 1.0 . 3.75 748 680 A 54 VAL H A 52 ASP HBx 1.0 . 4.87 749 681 A 52 ASP H A 52 ASP HBx 1.0 . 3.25 750 682 A 52 ASP HBx A 51 VAL HA 1.0 . 4.34 751 683 A 66 PHE HD% A 71 ASP HBy 1.0 . 4.74 752 684 A 66 PHE HD% A 71 ASP HBx 1.0 . 4.51 753 685 A 72 CYS H A 71 ASP HBx 1.0 . 4.30 754 686 A 66 PHE HBy A 71 ASP HBx 1.0 . 4.99 755 687 A 104 PHE H A 103 ASP HBy 1.0 . 4.75 756 688 A 103 ASP HBy A 102 ARG H 1.0 . 5.16 757 689 A 98 SER HA A 103 ASP HBy 1.0 . 3.57 758 690 A 103 ASP HBy A 101 ARG HBx 1.0 . 4.60 759 691 A 103 ASP HBx A 102 ARG H 1.0 . 4.62 760 692 A 103 ASP HBx A 98 SER HA 1.0 . 3.63 761 693 A 103 ASP HBx A 101 ARG HBx 1.0 . 4.63 762 694 A 28 ILE HA A 31 ASP HBy 1.0 . 3.59 763 695 A 31 ASP H A 31 ASP HBx 1.0 . 3.36 764 696 A 28 ILE HA A 31 ASP HBx 1.0 . 3.63 765 697 A 28 ILE HG2% A 31 ASP HBx 1.0 . 5.50 766 698 A 39 TYR HBy A 39 TYR H 1.0 . 3.92 767 699 A 75 ALA HB% A 39 TYR HBx 1.0 . 4.41 768 700 A 105 TRP H A 104 PHE HBy 1.0 . 3.92 769 701 A 93 TYR HBx A 4 PRO HA 1.0 . 5.18 770 702 A 58 GLY HAy A 104 PHE HBx 1.0 . 4.50 771 703 A 104 PHE HBx A 57 PRO HGx 1.0 . 4.92 772 704 A 47 ILE HB A 25 TYR HD% 1.0 . 5.20 773 705 A 47 ILE HB A 29 VAL HGy% 1.0 . 4.79 774 706 A 93 TYR HBy A 4 PRO HA 1.0 . 5.00 775 707 A 94 CYS H A 93 TYR HBx 1.0 . 4.48 776 708 A 93 TYR HBy A 5 THR H 1.0 . 4.33 777 709 A 93 TYR HBx A 76 MET HE% 1.0 . 4.66 778 710 A 69 VAL HGx% A 70 PHE HBx 1.0 . 5.50 779 710 A 70 PHE HBy A 69 VAL HGx% 1.0 . 5.50 780 711 A 69 VAL H A 70 PHE HBx 1.0 . 4.54 781 711 A 69 VAL H A 70 PHE HBy 1.0 . 4.54 782 712 A 69 VAL HB A 70 PHE HBx 1.0 . 4.89 783 712 A 70 PHE HBy A 69 VAL HB 1.0 . 4.89 784 713 A 99 TYR HBy A 104 PHE HE% 1.0 . 5.50 785 714 A 26 GLU HBx A 25 TYR HBx 1.0 . 4.60 786 714 A 25 TYR HBy A 26 GLU HBx 1.0 . 4.60 787 715 A 7 VAL HGy% A 99 TYR HBy 1.0 . 4.71 788 716 A 7 VAL HGx% A 99 TYR HBy 1.0 . 4.60 789 717 A 7 VAL HGx% A 99 TYR HBx 1.0 . 4.91 790 718 A 86 ASN H A 86 ASN HBy 1.0 . 3.61 791 719 A 87 ARG H A 86 ASN HBy 1.0 . 4.68 792 720 A 86 ASN HBy A 86 ASN HD2y 1.0 . 3.75 793 721 A 86 ASN H A 86 ASN HBx 1.0 . 3.61 794 722 A 86 ASN HD2y A 86 ASN HBx 1.0 . 3.79 795 723 A 83 LYS HBy A 86 ASN HBx 1.0 . 5.38 796 723 A 83 LYS HBx A 86 ASN HBx 1.0 . 5.38 797 724 A 87 ARG H A 86 ASN HBx 1.0 . 4.68 798 725 A 85 ALA HB% A 86 ASN HBx 1.0 . 5.11 799 726 A 12 ASN H A 12 ASN HBx 1.0 . 3.97 800 726 A 12 ASN H A 12 ASN HBy 1.0 . 3.97 801 727 A 88 VAL H A 12 ASN HBx 1.0 . 4.65 802 727 A 88 VAL H A 12 ASN HBy 1.0 . 4.65 803 728 A 90 VAL H A 12 ASN HBx 1.0 . 3.87 804 728 A 90 VAL H A 12 ASN HBy 1.0 . 3.87 805 729 A 12 ASN HD2y A 12 ASN HBx 1.0 . 3.28 806 729 A 12 ASN HBy A 12 ASN HD2y 1.0 . 3.28 807 730 A 12 ASN HD2x A 12 ASN HBx 1.0 . 3.86 808 730 A 12 ASN HBy A 12 ASN HD2x 1.0 . 3.86 809 731 A 89 VAL HA A 12 ASN HBx 1.0 . 3.39 810 731 A 12 ASN HBy A 89 VAL HA 1.0 . 3.39 811 732 A 87 ARG HBy A 12 ASN HBx 1.0 . 4.62 812 732 A 87 ARG HBy A 12 ASN HBy 1.0 . 4.62 813 733 A 25 TYR HD% A 28 ILE HB 1.0 . 5.18 814 734 A 29 VAL HGy% A 28 ILE HB 1.0 . 5.16 815 735 A 27 GLU H A 28 ILE HB 1.0 . 5.16 816 736 A 28 ILE H A 28 ILE HB 1.0 . 3.07 817 737 A 28 ILE HB A 25 TYR HA 1.0 . 3.62 818 738 A 17 GLU HGy A 17 GLU HA 1.0 . 3.77 819 739 A 17 GLU HGy A 15 LEU HBy 1.0 . 5.42 820 740 A 15 LEU HBx A 17 GLU HGy 1.0 . 4.41 821 741 A 17 GLU HGy A 15 LEU HDx% 1.0 . 4.99 822 742 A 17 GLU HGx A 17 GLU HA 1.0 . 3.89 823 743 A 17 GLU HGx A 15 LEU HBy 1.0 . 4.82 824 744 A 29 VAL HA A 28 ILE HB 1.0 . 4.74 825 745 A 69 VAL HA A 6 GLU HGx 1.0 . 5.00 826 745 A 69 VAL HA A 6 GLU HGy 1.0 . 5.00 827 746 A 7 VAL HGy% A 6 GLU HGx 1.0 . 4.29 828 746 A 7 VAL HGy% A 6 GLU HGy 1.0 . 4.29 829 747 A 69 VAL H A 6 GLU HGx 1.0 . 4.66 830 747 A 69 VAL H A 6 GLU HGy 1.0 . 4.66 831 748 A 68 SER HA A 6 GLU HGx 1.0 . 4.97 832 748 A 68 SER HA A 6 GLU HGy 1.0 . 4.97 833 749 A 5 THR HB A 6 GLU HGx 1.0 . 5.21 834 749 A 5 THR HB A 6 GLU HGy 1.0 . 5.21 835 750 A 23 GLU HBy A 23 GLU HGy 1.0 . 2.87 836 751 A 23 GLU H A 23 GLU HGy 1.0 . 3.73 837 752 A 23 GLU HGy A 23 GLU HA 1.0 . 3.62 838 753 A 23 GLU H A 23 GLU HGx 1.0 . 3.69 839 754 A 23 GLU HA A 23 GLU HGx 1.0 . 3.60 840 755 A 15 LEU HA A 18 GLU HGx 1.0 . 5.50 841 755 A 15 LEU HA A 18 GLU HGy 1.0 . 5.50 842 756 A 91 THR HA A 92 LYS HBx 1.0 . 5.28 843 756 A 91 THR HA A 92 LYS HBy 1.0 . 5.28 844 757 A 94 CYS H A 92 LYS HBx 1.0 . 5.44 845 757 A 94 CYS H A 92 LYS HBy 1.0 . 5.44 846 758 A 55 GLU HA A 55 GLU HGy 1.0 . 3.61 847 759 A 55 GLU H A 55 GLU HGy 1.0 . 3.79 848 760 A 56 VAL H A 55 GLU HGy 1.0 . 4.54 849 761 A 55 GLU HGy A 55 GLU HBx 1.0 . 2.69 850 761 A 55 GLU HGy A 55 GLU HBy 1.0 . 2.69 851 762 A 18 GLU H A 18 GLU HGx 1.0 . 3.26 852 762 A 18 GLU H A 18 GLU HGy 1.0 . 3.26 853 763 A 15 LEU H A 18 GLU HGx 1.0 . 5.25 854 763 A 15 LEU H A 18 GLU HGy 1.0 . 5.25 855 764 A 17 GLU H A 18 GLU HGx 1.0 . 3.78 856 764 A 17 GLU H A 18 GLU HGy 1.0 . 3.78 857 765 A 19 LEU H A 18 GLU HGx 1.0 . 5.30 858 765 A 19 LEU H A 18 GLU HGy 1.0 . 5.30 859 766 A 18 GLU HA A 18 GLU HGx 1.0 . 3.30 860 766 A 18 GLU HGy A 18 GLU HA 1.0 . 3.30 861 767 A 18 GLU HBy A 18 GLU HGx 1.0 . 2.40 862 767 A 18 GLU HGy A 18 GLU HBx 1.0 . 2.40 863 767 A 18 GLU HBy A 18 GLU HGy 1.0 . 2.40 864 767 A 18 GLU HBx A 18 GLU HGx 1.0 . 2.40 865 768 A 15 LEU HBy A 18 GLU HGx 1.0 . 3.87 866 768 A 15 LEU HBy A 18 GLU HGy 1.0 . 3.87 867 769 A 15 LEU HBx A 18 GLU HGx 1.0 . 3.98 868 769 A 15 LEU HBx A 18 GLU HGy 1.0 . 3.98 869 770 A 54 VAL HGx% A 55 GLU HGx 1.0 . 5.32 870 771 A 55 GLU H A 55 GLU HGx 1.0 . 3.83 871 772 A 56 VAL H A 55 GLU HGx 1.0 . 4.51 872 773 A 55 GLU HA A 55 GLU HGx 1.0 . 3.69 873 774 A 65 GLU H A 65 GLU HGx 1.0 . 5.43 874 775 A 43 LYS HBy A 65 GLU HGy 1.0 . 4.16 875 776 A 7 VAL HGy% A 65 GLU HGy 1.0 . 4.77 876 777 A 25 TYR HD% A 26 GLU HGy 1.0 . 4.43 877 778 A 26 GLU H A 26 GLU HGy 1.0 . 3.72 878 779 A 26 GLU HA A 26 GLU HGy 1.0 . 3.84 879 780 A 11 MET HBy A 90 VAL HGx% 1.0 . 4.53 880 780 A 11 MET HBy A 90 VAL HGy% 1.0 . 4.53 881 781 A 61 LYS HBy A 63 PHE HE% 1.0 . 4.17 882 782 A 61 LYS HBx A 63 PHE HE% 1.0 . 5.23 883 783 A 61 LYS HBx A 11 MET HGy 1.0 . 5.49 884 784 A 27 GLU H A 26 GLU HGy 1.0 . 4.94 885 785 A 25 TYR HD% A 26 GLU HGx 1.0 . 4.41 886 786 A 26 GLU HA A 30 GLU HGy 1.0 . 5.50 887 787 A 29 VAL HGy% A 30 GLU HGx 1.0 . 5.50 888 788 A 11 MET HBx A 12 ASN HBx 1.0 . 5.23 889 788 A 12 ASN HBy A 11 MET HBx 1.0 . 5.23 890 789 A 25 TYR H A 24 GLU HGy 1.0 . 5.15 891 790 A 27 GLU HGy A 28 ILE HG1y 1.0 . 5.14 892 791 A 27 GLU H A 27 GLU HGy 1.0 . 3.65 893 792 A 27 GLU HGy A 27 GLU HBy 1.0 . 2.72 894 793 A 25 TYR H A 27 GLU HGy 1.0 . 5.37 895 794 A 30 GLU HGy A 30 GLU HA 1.0 . 3.68 896 795 A 29 VAL HGx% A 30 GLU HGy 1.0 . 5.03 897 796 A 30 GLU H A 30 GLU HGy 1.0 . 3.66 898 797 A 31 ASP H A 30 GLU HGx 1.0 . 4.70 899 798 A 30 GLU H A 30 GLU HGx 1.0 . 3.68 900 799 A 29 VAL HGx% A 30 GLU HGx 1.0 . 5.23 901 800 A 26 GLU HA A 30 GLU HGx 1.0 . 5.20 902 801 A 27 GLU HA A 27 GLU HGx 1.0 . 3.73 903 802 A 28 ILE H A 27 GLU HGx 1.0 . 5.21 904 803 A 27 GLU H A 27 GLU HGx 1.0 . 3.83 905 804 A 24 GLU H A 24 GLU HGy 1.0 . 3.99 906 805 A 24 GLU HGy A 24 GLU HA 1.0 . 3.73 907 806 A 24 GLU HGx A 28 ILE HG1x 1.0 . 5.50 908 807 A 25 TYR H A 24 GLU HGx 1.0 . 5.00 909 808 A 24 GLU HGx A 28 ILE HD1% 1.0 . 4.32 910 809 A 35 GLU H A 35 GLU HGy 1.0 . 3.91 911 810 A 35 GLU HA A 35 GLU HGx 1.0 . 4.01 912 811 A 35 GLU H A 35 GLU HGx 1.0 . 4.26 913 812 A 15 LEU H A 14 VAL HB 1.0 . 3.44 914 813 A 14 VAL HB A 47 ILE HG2% 1.0 . 4.11 915 814 A 45 ILE HA A 64 VAL HB 1.0 . 5.04 916 815 A 64 VAL H A 64 VAL HB 1.0 . 3.52 917 816 A 90 VAL H A 90 VAL HB 1.0 . 3.56 918 817 A 51 VAL HB A 54 VAL HB 1.0 . 3.31 919 818 A 73 GLN HGx A 4 PRO HBy 1.0 . 4.31 920 819 A 55 GLU H A 54 VAL HB 1.0 . 3.93 921 820 A 51 VAL H A 54 VAL HB 1.0 . 4.30 922 821 A 50 PRO HA A 54 VAL HB 1.0 . 5.46 923 822 A 43 LYS HBy A 42 VAL HA 1.0 . 4.71 924 823 A 43 LYS HBy A 65 GLU HA 1.0 . 5.50 925 824 A 43 LYS HBx A 66 PHE HA 1.0 . 5.14 926 825 A 43 LYS HBx A 65 GLU HA 1.0 . 4.81 927 826 A 43 LYS HBx A 42 VAL HA 1.0 . 4.77 928 827 A 43 LYS HBx A 43 LYS HEx 1.0 . 4.41 929 827 A 43 LYS HBx A 43 LYS HEy 1.0 . 4.41 930 828 A 43 LYS HBx A 65 GLU HGy 1.0 . 4.45 931 829 A 13 MET H A 13 MET HBy 1.0 . 3.89 932 830 A 43 LYS HBy A 43 LYS HEx 1.0 . 4.78 933 830 A 43 LYS HBy A 43 LYS HEy 1.0 . 4.78 934 831 A 13 MET H A 13 MET HBx 1.0 . 3.84 935 832 A 89 VAL HGy% A 13 MET HBx 1.0 . 4.56 936 833 A 13 MET HBx A 62 ILE HD1% 1.0 . 4.13 937 834 A 13 MET HBx A 62 ILE HG1x 1.0 . 4.47 938 835 A 46 GLU HGy A 46 GLU HA 1.0 . 4.12 939 836 A 46 GLU HGy A 47 ILE H 1.0 . 5.26 940 837 A 46 GLU HGy A 99 TYR HE% 1.0 . 4.36 941 838 A 104 PHE HE% A 46 GLU HGx 1.0 . 4.96 942 839 A 63 PHE HBy A 46 GLU HGx 1.0 . 5.32 943 840 A 46 GLU H A 46 GLU HGx 1.0 . 4.99 944 841 A 47 ILE H A 46 GLU HGx 1.0 . 5.50 945 842 A 46 GLU HGx A 104 PHE HZ 1.0 . 4.23 946 843 A 84 PHE HBx A 13 MET HBx 1.0 . 4.96 947 844 A 63 PHE HBy A 46 GLU HGy 1.0 . 5.01 948 845 A 83 LYS HBy A 83 LYS HEx 1.0 . 4.80 949 845 A 83 LYS HBx A 83 LYS HEx 1.0 . 4.80 950 845 A 83 LYS HEy A 83 LYS HBx 1.0 . 4.80 951 845 A 83 LYS HBy A 83 LYS HEy 1.0 . 4.80 952 846 A 77 GLN H A 77 GLN HGy 1.0 . 3.71 953 847 A 77 GLN HA A 77 GLN HGy 1.0 . 3.75 954 848 A 77 GLN H A 77 GLN HGx 1.0 . 3.68 955 849 A 63 PHE HBy A 46 GLU HBy 1.0 . 4.51 956 850 A 99 TYR HE% A 46 GLU HBy 1.0 . 4.29 957 851 A 63 PHE HD% A 46 GLU HBx 1.0 . 5.50 958 852 A 104 PHE HE% A 46 GLU HBx 1.0 . 5.33 959 853 A 99 TYR HE% A 46 GLU HBx 1.0 . 4.25 960 854 A 63 PHE HBx A 46 GLU HBx 1.0 . 5.21 961 855 A 11 MET H A 11 MET HGy 1.0 . 4.46 962 856 A 12 ASN H A 11 MET HGy 1.0 . 4.83 963 857 A 11 MET HA A 11 MET HGy 1.0 . 3.94 964 858 A 11 MET HGy A 61 LYS HEx 1.0 . 4.50 965 858 A 61 LYS HEy A 11 MET HGy 1.0 . 4.50 966 859 A 11 MET HGy A 61 LYS HDx 1.0 . 5.04 967 859 A 61 LYS HDy A 11 MET HGy 1.0 . 5.04 968 860 A 61 LYS HGy A 11 MET HGy 1.0 . 4.99 969 861 A 61 LYS HGx A 11 MET HGy 1.0 . 4.10 970 862 A 12 ASN H A 11 MET HGx 1.0 . 4.90 971 863 A 11 MET H A 11 MET HGx 1.0 . 4.28 972 864 A 11 MET HA A 11 MET HGx 1.0 . 3.97 973 865 A 94 CYS HBy A 7 VAL HB 1.0 . 3.84 974 866 A 47 ILE H A 46 GLU HBx 1.0 . 4.58 975 867 A 61 LYS HA A 11 MET HGy 1.0 . 5.50 976 868 A 14 VAL H A 13 MET HGx 1.0 . 4.71 977 868 A 14 VAL H A 13 MET HGy 1.0 . 4.71 978 869 A 12 ASN HD2y A 88 VAL HB 1.0 . 4.68 979 870 A 88 VAL H A 88 VAL HB 1.0 . 2.99 980 871 A 89 VAL HB A 84 PHE HD% 1.0 . 5.00 981 872 A 89 VAL H A 89 VAL HB 1.0 . 3.19 982 873 A 90 VAL H A 89 VAL HB 1.0 . 4.78 983 874 A 89 VAL HB A 80 THR HA 1.0 . 4.93 984 875 A 69 VAL HGx% A 4 PRO HBx 1.0 . 4.79 985 876 A 4 PRO HBx A 73 GLN HE2x 1.0 . 4.68 986 877 A 5 THR H A 4 PRO HBx 1.0 . 4.10 987 878 A 73 GLN HGx A 4 PRO HBx 1.0 . 4.64 988 879 A 5 THR HB A 96 PRO HGx 1.0 . 4.53 989 880 A 56 VAL H A 56 VAL HB 1.0 . 3.42 990 881 A 56 VAL HB A 57 PRO HDx 1.0 . 3.67 991 882 A 42 VAL HB A 42 VAL H 1.0 . 3.12 992 883 A 5 THR H A 4 PRO HBy 1.0 . 3.94 993 884 A 69 VAL HGy% A 4 PRO HBy 1.0 . 4.02 994 885 A 50 PRO HDx A 49 ARG HBx 1.0 . 4.15 995 886 A 50 PRO HDy A 49 ARG HBx 1.0 . 4.74 996 887 A 7 VAL HGx% A 96 PRO HBx 1.0 . 5.50 997 888 A 56 VAL HB A 57 PRO HDy 1.0 . 3.97 998 889 A 58 GLY H A 56 VAL HB 1.0 . 5.50 999 890 A 50 PRO HDx A 49 ARG HBy 1.0 . 4.45 1000 891 A 42 VAL HB A 41 LEU HA 1.0 . 4.82 1001 892 A 53 GLY H A 50 PRO HBx 1.0 . 4.99 1002 893 A 71 ASP HA A 74 LYS HBy 1.0 . 3.74 1003 894 A 39 TYR HBy A 74 LYS HBy 1.0 . 3.99 1004 895 A 74 LYS HBy A 39 TYR HBx 1.0 . 5.30 1005 896 A 15 LEU HA A 16 PRO HBx 1.0 . 5.50 1006 897 A 39 TYR HBy A 74 LYS HBx 1.0 . 4.17 1007 898 A 51 VAL H A 50 PRO HBx 1.0 . 3.85 1008 899 A 50 PRO HBx A 20 LEU HDx% 1.0 . 3.90 1009 900 A 104 PHE H A 57 PRO HBy 1.0 . 5.50 1010 901 A 74 LYS HBx A 39 TYR HA 1.0 . 4.73 1011 902 A 38 LYS HBy A 38 LYS HEx 1.0 . 4.77 1012 902 A 38 LYS HBy A 38 LYS HEy 1.0 . 4.77 1013 903 A 38 LYS HBy A 39 TYR HE% 1.0 . 5.16 1014 904 A 58 GLY H A 57 PRO HBy 1.0 . 4.30 1015 905 A 73 GLN HA A 76 MET HGx 1.0 . 4.94 1016 905 A 73 GLN HA A 76 MET HGy 1.0 . 4.94 1017 906 A 35 GLU HA A 38 LYS HBy 1.0 . 5.15 1018 907 A 76 MET HBy A 76 MET HGx 1.0 . 2.86 1019 907 A 76 MET HBx A 76 MET HGx 1.0 . 2.86 1020 907 A 76 MET HGy A 76 MET HBx 1.0 . 2.86 1021 907 A 76 MET HBy A 76 MET HGy 1.0 . 2.86 1022 908 A 31 ASP H A 29 VAL HB 1.0 . 5.08 1023 909 A 76 MET H A 76 MET HGx 1.0 . 3.83 1024 909 A 76 MET H A 76 MET HGy 1.0 . 3.83 1025 910 A 93 TYR HE% A 76 MET HBx 1.0 . 4.46 1026 910 A 93 TYR HE% A 76 MET HBy 1.0 . 4.46 1027 911 A 73 GLN HA A 76 MET HBx 1.0 . 3.47 1028 911 A 73 GLN HA A 76 MET HBy 1.0 . 3.47 1029 912 A 29 VAL HA A 32 VAL HB 1.0 . 3.87 1030 913 A 68 SER HA A 69 VAL HB 1.0 . 5.22 1031 914 A 69 VAL H A 69 VAL HB 1.0 . 3.29 1032 915 A 65 GLU HBy A 99 TYR HE% 1.0 . 5.41 1033 916 A 32 VAL H A 32 VAL HB 1.0 . 3.14 1034 917 A 33 ARG H A 32 VAL HB 1.0 . 3.47 1035 918 A 65 GLU HBx A 7 VAL HGx% 1.0 . 5.46 1036 919 A 43 LYS HBy A 65 GLU HBy 1.0 . 5.28 1037 920 A 65 GLU HBy A 7 VAL HGy% 1.0 . 5.43 1038 921 A 65 GLU HBy A 66 PHE H 1.0 . 4.96 1039 922 A 65 GLU HBx A 44 SER H 1.0 . 4.60 1040 923 A 82 ARG HBy A 83 LYS H 1.0 . 4.01 1041 924 A 101 ARG HBy A 101 ARG HDx 1.0 . 4.04 1042 924 A 101 ARG HDy A 101 ARG HBy 1.0 . 4.04 1043 925 A 82 ARG HBx A 82 ARG HDx 1.0 . 3.95 1044 925 A 82 ARG HBx A 82 ARG HDy 1.0 . 3.95 1045 926 A 83 LYS H A 82 ARG HBx 1.0 . 3.87 1046 927 A 82 ARG HBx A 84 PHE HE% 1.0 . 4.37 1047 928 A 101 ARG HBx A 101 ARG HDx 1.0 . 4.09 1048 928 A 101 ARG HBx A 101 ARG HDy 1.0 . 4.09 1049 929 A 101 ARG HBx A 101 ARG HGy 1.0 . 2.62 1050 930 A 61 LYS HBx A 61 LYS HDx 1.0 . 3.99 1051 930 A 61 LYS HDy A 61 LYS HBx 1.0 . 3.99 1052 931 A 63 PHE HE% A 61 LYS HDx 1.0 . 4.47 1053 931 A 61 LYS HDy A 63 PHE HE% 1.0 . 4.47 1054 932 A 61 LYS HA A 61 LYS HDx 1.0 . 4.83 1055 932 A 61 LYS HDy A 61 LYS HA 1.0 . 4.83 1056 933 A 105 TRP HBy A 105 TRP HE3 1.0 . 4.11 1057 934 A 105 TRP H A 105 TRP HBy 1.0 . 3.47 1058 935 A 105 TRP HE3 A 105 TRP HBx 1.0 . 4.19 1059 936 A 7 VAL HGy% A 94 CYS HBy 1.0 . 4.76 1060 937 A 94 CYS HBy A 7 VAL HGx% 1.0 . 3.64 1061 938 A 94 CYS H A 94 CYS HBy 1.0 . 3.77 1062 939 A 94 CYS HBy A 5 THR HG2% 1.0 . 5.26 1063 940 A 94 CYS HBx A 7 VAL HB 1.0 . 4.23 1064 941 A 7 VAL HGy% A 94 CYS HBx 1.0 . 5.08 1065 942 A 94 CYS HBx A 7 VAL HGx% 1.0 . 3.78 1066 943 A 105 TRP H A 105 TRP HBx 1.0 . 3.50 1067 944 A 33 ARG HBy A 33 ARG HDx 1.0 . 3.97 1068 944 A 33 ARG HBy A 33 ARG HDy 1.0 . 3.97 1069 945 A 33 ARG HBy A 30 GLU HA 1.0 . 3.82 1070 946 A 33 ARG HBy A 45 ILE HD1% 1.0 . 4.30 1071 947 A 33 ARG HBx A 34 ASP H 1.0 . 4.33 1072 948 A 33 ARG HBx A 33 ARG HDx 1.0 . 4.01 1073 948 A 33 ARG HBx A 33 ARG HDy 1.0 . 4.01 1074 949 A 67 THR HB A 67 THR HA 1.0 . 2.98 1075 950 A 28 ILE H A 28 ILE HG1y 1.0 . 3.57 1076 951 A 28 ILE HA A 28 ILE HG1y 1.0 . 3.78 1077 952 A 43 LYS H A 43 LYS HDy 1.0 . 5.20 1078 953 A 28 ILE H A 28 ILE HG1x 1.0 . 3.99 1079 954 A 28 ILE HA A 28 ILE HG1x 1.0 . 3.65 1080 955 A 17 GLU H A 17 GLU HBx 1.0 . 3.91 1081 955 A 17 GLU H A 17 GLU HBy 1.0 . 3.91 1082 956 A 35 GLU HBy A 36 CYS H 1.0 . 4.09 1083 957 A 35 GLU HBy A 84 PHE HE% 1.0 . 5.19 1084 958 A 35 GLU HBy A 79 LEU HDx% 1.0 . 5.25 1085 959 A 73 GLN HBy A 73 GLN HE2x 1.0 . 5.20 1086 960 A 32 VAL HA A 35 GLU HBx 1.0 . 4.03 1087 961 A 69 VAL HGy% A 73 GLN HBx 1.0 . 5.50 1088 962 A 43 LYS HDy A 43 LYS HGx 1.0 . 2.92 1089 962 A 43 LYS HGy A 43 LYS HDy 1.0 . 2.92 1090 963 A 83 LYS H A 83 LYS HDx 1.0 . 4.81 1091 963 A 83 LYS H A 83 LYS HDy 1.0 . 4.81 1092 964 A 83 LYS HA A 83 LYS HDx 1.0 . 4.22 1093 964 A 83 LYS HA A 83 LYS HDy 1.0 . 4.22 1094 965 A 86 ASN HA A 83 LYS HDx 1.0 . 4.37 1095 965 A 86 ASN HA A 83 LYS HDy 1.0 . 4.37 1096 966 A 67 THR HA A 43 LYS HDx 1.0 . 4.49 1097 967 A 43 LYS HDx A 43 LYS HGx 1.0 . 2.98 1098 967 A 43 LYS HGy A 43 LYS HDx 1.0 . 2.98 1099 968 A 19 LEU H A 17 GLU HBx 1.0 . 5.18 1100 968 A 19 LEU H A 17 GLU HBy 1.0 . 5.18 1101 969 A 35 GLU HBy A 38 LYS HDy 1.0 . 4.03 1102 970 A 73 GLN HBx A 70 PHE HA 1.0 . 4.04 1103 971 A 55 GLU H A 55 GLU HBx 1.0 . 2.88 1104 971 A 55 GLU H A 55 GLU HBy 1.0 . 2.88 1105 972 A 56 VAL H A 55 GLU HBx 1.0 . 3.73 1106 972 A 56 VAL H A 55 GLU HBy 1.0 . 3.73 1107 973 A 56 VAL HA A 55 GLU HBx 1.0 . 5.07 1108 973 A 55 GLU HBy A 56 VAL HA 1.0 . 5.07 1109 974 A 59 CYS HBy A 55 GLU HBx 1.0 . 5.00 1110 974 A 59 CYS HBy A 55 GLU HBy 1.0 . 5.00 1111 975 A 54 VAL HGx% A 55 GLU HBx 1.0 . 4.50 1112 975 A 55 GLU HBy A 54 VAL HGx% 1.0 . 4.50 1113 976 A 74 LYS HBy A 74 LYS HDx 1.0 . 3.71 1114 977 A 71 ASP HA A 74 LYS HDx 1.0 . 4.89 1115 978 A 38 LYS H A 38 LYS HDy 1.0 . 4.49 1116 979 A 83 LYS HGx A 83 LYS HDx 1.0 . 2.94 1117 979 A 83 LYS HGx A 83 LYS HDy 1.0 . 2.94 1118 980 A 65 GLU HGy A 43 LYS HDx 1.0 . 5.01 1119 981 A 35 GLU HA A 38 LYS HDx 1.0 . 4.43 1120 982 A 35 GLU HBy A 79 LEU HDy% 1.0 . 4.62 1121 983 A 25 TYR H A 24 GLU HBy 1.0 . 3.90 1122 984 A 21 ASP HBy A 24 GLU HBy 1.0 . 3.62 1123 985 A 55 GLU HGx A 55 GLU HBx 1.0 . 2.53 1124 985 A 55 GLU HBy A 55 GLU HGx 1.0 . 2.53 1125 986 A 39 TYR HE% A 38 LYS HDy 1.0 . 5.50 1126 987 A 38 LYS H A 38 LYS HDx 1.0 . 4.66 1127 988 A 38 LYS HDx A 38 LYS HA 1.0 . 5.32 1128 989 A 4 PRO HDy A 3 HIS HBy 1.0 . 4.12 1129 990 A 5 THR HG2% A 3 HIS HBy 1.0 . 5.50 1130 991 A 24 GLU H A 24 GLU HBy 1.0 . 2.91 1131 992 A 27 GLU HBy A 28 ILE HG1y 1.0 . 4.54 1132 993 A 79 LEU H A 80 THR HB 1.0 . 4.70 1133 994 A 91 THR HG2% A 80 THR HB 1.0 . 5.47 1134 995 A 4 PRO HDy A 3 HIS HBx 1.0 . 4.79 1135 996 A 5 THR HG2% A 3 HIS HBx 1.0 . 5.50 1136 997 A 9 CYS HBy A 7 VAL HGx% 1.0 . 5.50 1137 998 A 9 CYS HBx A 92 LYS HBx 1.0 . 4.48 1138 998 A 9 CYS HBx A 92 LYS HBy 1.0 . 4.48 1139 999 A 10 LEU H A 9 CYS HBx 1.0 . 4.63 1140 1000 A 27 GLU H A 26 GLU HBy 1.0 . 3.10 1141 1001 A 26 GLU H A 26 GLU HBy 1.0 . 3.18 1142 1002 A 25 TYR HD% A 26 GLU HBx 1.0 . 5.50 1143 1003 A 26 GLU H A 26 GLU HBx 1.0 . 3.22 1144 1004 A 30 GLU H A 30 GLU HBy 1.0 . 3.41 1145 1004 A 30 GLU H A 30 GLU HBx 1.0 . 3.41 1146 1005 A 64 VAL HA A 45 ILE HG1y 1.0 . 4.97 1147 1006 A 81 GLY H A 80 THR HB 1.0 . 4.47 1148 1007 A 6 GLU H A 96 PRO HGy 1.0 . 4.77 1149 1008 A 95 ASP HA A 96 PRO HGy 1.0 . 4.49 1150 1009 A 5 THR HB A 96 PRO HGy 1.0 . 4.06 1151 1010 A 5 THR HG2% A 96 PRO HGy 1.0 . 4.76 1152 1011 A 7 VAL HGy% A 96 PRO HGy 1.0 . 4.94 1153 1012 A 25 TYR HD% A 26 GLU HBy 1.0 . 5.21 1154 1013 A 5 THR HG2% A 96 PRO HGx 1.0 . 5.05 1155 1014 A 7 VAL HGy% A 96 PRO HGx 1.0 . 4.46 1156 1015 A 30 GLU HGx A 30 GLU HBy 1.0 . 3.01 1157 1015 A 30 GLU HGx A 30 GLU HBx 1.0 . 3.01 1158 1016 A 6 GLU HBx A 69 VAL HGx% 1.0 . 5.50 1159 1017 A 46 GLU H A 45 ILE HG1y 1.0 . 4.70 1160 1018 A 45 ILE H A 45 ILE HG1x 1.0 . 5.29 1161 1019 A 96 PRO HGy A 95 ASP HBx 1.0 . 5.35 1162 1019 A 95 ASP HBy A 96 PRO HGy 1.0 . 5.35 1163 1020 A 95 ASP HA A 96 PRO HGx 1.0 . 4.66 1164 1021 A 66 PHE H A 6 GLU HBx 1.0 . 5.19 1165 1022 A 45 ILE HA A 45 ILE HG1y 1.0 . 4.12 1166 1023 A 45 ILE H A 45 ILE HG1y 1.0 . 4.63 1167 1024 A 42 VAL HGx% A 45 ILE HG1y 1.0 . 3.97 1168 1025 A 64 VAL HA A 45 ILE HG1x 1.0 . 4.65 1169 1026 A 46 GLU H A 45 ILE HG1x 1.0 . 4.74 1170 1027 A 42 VAL HGx% A 45 ILE HG1x 1.0 . 5.09 1171 1028 A 64 VAL HGy% A 45 ILE HG1x 1.0 . 4.56 1172 1029 A 100 HIS H A 100 HIS HBy 1.0 . 3.61 1173 1029 A 100 HIS H A 100 HIS HBx 1.0 . 3.61 1174 1030 A 101 ARG H A 100 HIS HBy 1.0 . 4.25 1175 1030 A 101 ARG H A 100 HIS HBx 1.0 . 4.25 1176 1031 A 101 ARG HGy A 100 HIS HBy 1.0 . 5.25 1177 1031 A 101 ARG HGy A 100 HIS HBx 1.0 . 5.25 1178 1032 A 76 MET H A 77 GLN HBx 1.0 . 5.50 1179 1032 A 76 MET H A 77 GLN HBy 1.0 . 5.50 1180 1033 A 79 LEU H A 77 GLN HBx 1.0 . 5.06 1181 1033 A 79 LEU H A 77 GLN HBy 1.0 . 5.06 1182 1034 A 77 GLN H A 77 GLN HBx 1.0 . 2.96 1183 1034 A 77 GLN H A 77 GLN HBy 1.0 . 2.96 1184 1035 A 47 ILE HA A 48 PRO HGy 1.0 . 4.58 1185 1036 A 104 PHE HD% A 48 PRO HGy 1.0 . 5.26 1186 1037 A 101 ARG H A 101 ARG HGy 1.0 . 4.06 1187 1038 A 101 ARG HGy A 101 ARG HA 1.0 . 3.91 1188 1039 A 49 ARG H A 48 PRO HGx 1.0 . 5.50 1189 1040 A 47 ILE HA A 48 PRO HGx 1.0 . 4.51 1190 1041 A 101 ARG H A 101 ARG HGx 1.0 . 4.08 1191 1042 A 104 PHE HD% A 48 PRO HGx 1.0 . 5.29 1192 1043 A 101 ARG HA A 101 ARG HGx 1.0 . 3.77 1193 1044 A 15 LEU HA A 16 PRO HGy 1.0 . 4.68 1194 1045 A 66 PHE HD% A 72 CYS HBy 1.0 . 4.66 1195 1046 A 6 GLU HA A 72 CYS HBy 1.0 . 4.08 1196 1047 A 66 PHE HBx A 72 CYS HBy 1.0 . 5.19 1197 1048 A 69 VAL HGy% A 72 CYS HBy 1.0 . 5.50 1198 1049 A 72 CYS HBx A 73 GLN H 1.0 . 4.35 1199 1050 A 15 LEU HA A 16 PRO HGx 1.0 . 4.62 1200 1051 A 49 ARG HGx A 25 TYR HD% 1.0 . 5.47 1201 1052 A 49 ARG HGx A 25 TYR HE% 1.0 . 4.95 1202 1053 A 49 ARG HA A 50 PRO HGy 1.0 . 4.58 1203 1053 A 49 ARG HA A 50 PRO HGx 1.0 . 4.58 1204 1054 A 51 VAL H A 50 PRO HGy 1.0 . 4.86 1205 1054 A 51 VAL H A 50 PRO HGx 1.0 . 4.86 1206 1055 A 20 LEU HDy% A 50 PRO HGy 1.0 . 4.69 1207 1055 A 20 LEU HDy% A 50 PRO HGx 1.0 . 4.69 1208 1056 A 69 VAL HGy% A 4 PRO HGy 1.0 . 4.88 1209 1057 A 4 PRO HGy A 73 GLN HE2x 1.0 . 4.55 1210 1058 A 73 GLN HE2x A 4 PRO HGx 1.0 . 4.80 1211 1059 A 79 LEU H A 79 LEU HG 1.0 . 3.72 1212 1060 A 78 GLY H A 79 LEU HG 1.0 . 4.95 1213 1061 A 79 LEU HG A 79 LEU HA 1.0 . 3.95 1214 1062 A 10 LEU H A 10 LEU HG 1.0 . 3.84 1215 1063 A 9 CYS HA A 10 LEU HG 1.0 . 4.89 1216 1064 A 10 LEU HA A 10 LEU HG 1.0 . 3.91 1217 1065 A 102 ARG HBx A 102 ARG HDy 1.0 . 3.84 1218 1066 A 102 ARG HDx A 102 ARG HBx 1.0 . 3.92 1219 1067 A 104 PHE HE% A 102 ARG HBx 1.0 . 4.64 1220 1068 A 38 LYS H A 36 CYS HBy 1.0 . 5.08 1221 1069 A 33 ARG HA A 36 CYS HBy 1.0 . 4.35 1222 1070 A 64 VAL HGy% A 36 CYS HBy 1.0 . 4.70 1223 1071 A 36 CYS HBx A 35 GLU HGy 1.0 . 4.40 1224 1072 A 37 SER H A 36 CYS HBx 1.0 . 4.70 1225 1073 A 86 ASN H A 87 ARG HGy 1.0 . 5.50 1226 1074 A 83 LYS H A 82 ARG HGy 1.0 . 4.92 1227 1075 A 82 ARG H A 82 ARG HGy 1.0 . 4.14 1228 1076 A 69 VAL HGy% A 4 PRO HGx 1.0 . 5.16 1229 1077 A 4 PRO HGx A 3 HIS HA 1.0 . 4.52 1230 1078 A 82 ARG H A 82 ARG HGx 1.0 . 4.06 1231 1079 A 91 THR HA A 10 LEU HG 1.0 . 5.11 1232 1080 A 33 ARG H A 29 VAL HA 1.0 . 5.12 1233 1081 A 42 VAL H A 41 LEU HG 1.0 . 4.93 1234 1082 A 87 ARG H A 87 ARG HGx 1.0 . 3.59 1235 1083 A 34 ASP H A 33 ARG HGx 1.0 . 4.45 1236 1083 A 34 ASP H A 33 ARG HGy 1.0 . 4.45 1237 1084 A 33 ARG H A 33 ARG HGx 1.0 . 4.29 1238 1084 A 33 ARG H A 33 ARG HGy 1.0 . 4.29 1239 1085 A 42 VAL HGx% A 33 ARG HGx 1.0 . 4.27 1240 1085 A 42 VAL HGx% A 33 ARG HGy 1.0 . 4.27 1241 1086 A 20 LEU H A 20 LEU HG 1.0 . 4.73 1242 1087 A 41 LEU HA A 41 LEU HG 1.0 . 4.13 1243 1088 A 8 LEU HG A 91 THR HB 1.0 . 5.06 1244 1089 A 32 VAL HA A 35 GLU HBy 1.0 . 4.47 1245 1090 A 32 VAL HA A 35 GLU HGy 1.0 . 4.89 1246 1091 A 15 LEU HG A 16 PRO HDx 1.0 . 5.03 1247 1092 A 47 ILE HA A 62 ILE HG1y 1.0 . 4.02 1248 1093 A 19 LEU HDy% A 49 ARG HA 1.0 . 3.33 1249 1094 A 50 PRO HDy A 19 LEU HDy% 1.0 . 4.21 1250 1095 A 19 LEU HDy% A 19 LEU HBx 1.0 . 3.46 1251 1096 A 60 GLY H A 19 LEU HDy% 1.0 . 4.53 1252 1097 A 19 LEU HDy% A 59 CYS HA 1.0 . 5.42 1253 1098 A 8 LEU H A 8 LEU HDy% 1.0 . 5.08 1254 1099 A 9 CYS H A 8 LEU HDy% 1.0 . 4.69 1255 1100 A 8 LEU HA A 8 LEU HDy% 1.0 . 5.22 1256 1101 A 91 THR HB A 8 LEU HDy% 1.0 . 4.67 1257 1102 A 8 LEU HDy% A 76 MET HBx 1.0 . 5.05 1258 1102 A 76 MET HBy A 8 LEU HDy% 1.0 . 5.05 1259 1103 A 8 LEU HBy A 8 LEU HDy% 1.0 . 3.74 1260 1104 A 8 LEU HBx A 8 LEU HDy% 1.0 . 3.48 1261 1105 A 59 CYS HBy A 56 VAL HA 1.0 . 4.77 1262 1106 A 59 CYS HBx A 60 GLY H 1.0 . 4.85 1263 1107 A 47 ILE HG1x A 29 VAL HGy% 1.0 . 5.50 1264 1108 A 47 ILE HA A 47 ILE HG1x 1.0 . 4.10 1265 1109 A 61 LYS HGy A 61 LYS HEx 1.0 . 4.15 1266 1109 A 61 LYS HGy A 61 LYS HEy 1.0 . 4.15 1267 1110 A 19 LEU H A 19 LEU HDy% 1.0 . 4.42 1268 1111 A 25 TYR HD% A 19 LEU HDy% 1.0 . 5.13 1269 1112 A 25 TYR HE% A 19 LEU HDy% 1.0 . 5.15 1270 1113 A 19 LEU HA A 19 LEU HDy% 1.0 . 4.31 1271 1114 A 19 LEU HDy% A 16 PRO HA 1.0 . 3.56 1272 1115 A 59 CYS HBx A 19 LEU HDy% 1.0 . 5.27 1273 1116 A 14 VAL HGy% A 19 LEU HDy% 1.0 . 3.97 1274 1117 A 59 CYS HBy A 60 GLY H 1.0 . 4.92 1275 1118 A 59 CYS HBy A 61 LYS HDx 1.0 . 5.31 1276 1118 A 59 CYS HBy A 61 LYS HDy 1.0 . 5.31 1277 1119 A 59 CYS HBy A 56 VAL HB 1.0 . 3.54 1278 1120 A 59 CYS HBy A 56 VAL HGy% 1.0 . 3.77 1279 1121 A 59 CYS HBx A 59 CYS H 1.0 . 3.21 1280 1122 A 59 CYS HBx A 56 VAL HGy% 1.0 . 4.02 1281 1123 A 59 CYS HBx A 58 GLY H 1.0 . 4.89 1282 1124 A 59 CYS HBx A 16 PRO HBx 1.0 . 4.51 1283 1125 A 62 ILE HA A 62 ILE HG1y 1.0 . 4.09 1284 1126 A 61 LYS HGx A 60 GLY HAy 1.0 . 5.50 1285 1127 A 61 LYS HGx A 11 MET HGx 1.0 . 5.11 1286 1128 A 62 ILE H A 62 ILE HG1x 1.0 . 5.26 1287 1129 A 79 LEU H A 79 LEU HDy% 1.0 . 4.23 1288 1130 A 79 LEU HDy% A 79 LEU HA 1.0 . 4.31 1289 1131 A 76 MET HA A 79 LEU HDy% 1.0 . 5.01 1290 1132 A 68 SER HBy A 70 PHE HBx 1.0 . 5.16 1291 1132 A 68 SER HBy A 70 PHE HBy 1.0 . 5.16 1292 1133 A 68 SER HBy A 70 PHE H 1.0 . 4.72 1293 1134 A 39 TYR HE% A 79 LEU HDy% 1.0 . 4.30 1294 1135 A 36 CYS HA A 79 LEU HDy% 1.0 . 4.37 1295 1136 A 79 LEU HDy% A 35 GLU HGy 1.0 . 4.70 1296 1137 A 79 LEU HDy% A 35 GLU HGx 1.0 . 5.50 1297 1138 A 82 ARG H A 80 THR HA 1.0 . 4.83 1298 1139 A 80 THR HA A 77 GLN HA 1.0 . 5.06 1299 1140 A 20 LEU H A 19 LEU HG 1.0 . 5.33 1300 1141 A 19 LEU HG A 16 PRO HA 1.0 . 4.31 1301 1142 A 50 PRO HDy A 19 LEU HG 1.0 . 5.47 1302 1143 A 17 GLU H A 19 LEU HG 1.0 . 5.00 1303 1144 A 50 PRO HDx A 19 LEU HG 1.0 . 5.50 1304 1145 A 14 VAL HGy% A 19 LEU HG 1.0 . 4.95 1305 1146 A 19 LEU H A 19 LEU HG 1.0 . 3.85 1306 1147 A 10 LEU H A 10 LEU HDy% 1.0 . 4.00 1307 1148 A 10 LEU HDy% A 92 LYS H 1.0 . 5.14 1308 1149 A 10 LEU HDy% A 84 PHE HE% 1.0 . 5.31 1309 1150 A 91 THR HA A 10 LEU HDy% 1.0 . 4.45 1310 1151 A 10 LEU HDy% A 10 LEU HA 1.0 . 3.50 1311 1152 A 10 LEU HDy% A 91 THR HB 1.0 . 4.41 1312 1153 A 10 LEU HDy% A 89 VAL HB 1.0 . 4.99 1313 1154 A 11 MET HE% A 10 LEU HDy% 1.0 . 5.33 1314 1155 A 10 LEU HBx A 10 LEU HDy% 1.0 . 3.54 1315 1156 A 104 PHE HE% A 102 ARG HGy 1.0 . 5.46 1316 1157 A 102 ARG H A 102 ARG HGy 1.0 . 4.65 1317 1158 A 104 PHE HZ A 102 ARG HGy 1.0 . 5.50 1318 1159 A 14 VAL HA A 15 LEU HDy% 1.0 . 5.30 1319 1160 A 15 LEU H A 15 LEU HDy% 1.0 . 4.20 1320 1161 A 17 GLU H A 15 LEU HDy% 1.0 . 5.24 1321 1162 A 15 LEU HA A 15 LEU HDy% 1.0 . 4.12 1322 1163 A 16 PRO HDx A 15 LEU HDy% 1.0 . 4.52 1323 1164 A 87 ARG HDy A 15 LEU HDy% 1.0 . 5.49 1324 1165 A 87 ARG HDx A 15 LEU HDy% 1.0 . 5.49 1325 1166 A 17 GLU HGy A 15 LEU HDy% 1.0 . 4.70 1326 1167 A 15 LEU HDy% A 18 GLU HGx 1.0 . 3.86 1327 1167 A 18 GLU HGy A 15 LEU HDy% 1.0 . 3.86 1328 1168 A 15 LEU HBy A 15 LEU HDy% 1.0 . 3.22 1329 1169 A 10 LEU H A 10 LEU HDx% 1.0 . 3.83 1330 1170 A 62 ILE H A 10 LEU HDx% 1.0 . 4.95 1331 1171 A 10 LEU HDx% A 84 PHE HE% 1.0 . 5.12 1332 1172 A 9 CYS HA A 10 LEU HDx% 1.0 . 4.77 1333 1173 A 62 ILE HB A 10 LEU HDx% 1.0 . 3.32 1334 1174 A 84 PHE H A 83 LYS HGy 1.0 . 4.86 1335 1175 A 83 LYS HGx A 83 LYS HA 1.0 . 3.90 1336 1176 A 83 LYS HGx A 83 LYS H 1.0 . 4.41 1337 1177 A 72 CYS H A 69 VAL HA 1.0 . 4.80 1338 1178 A 72 CYS HBx A 69 VAL HA 1.0 . 4.36 1339 1179 A 6 GLU HBx A 69 VAL HA 1.0 . 5.17 1340 1180 A 72 CYS H A 74 LYS HGy 1.0 . 4.89 1341 1181 A 38 LYS HGy A 39 TYR H 1.0 . 5.50 1342 1182 A 88 VAL HA A 83 LYS HGy 1.0 . 5.50 1343 1183 A 38 LYS HGy A 38 LYS HEx 1.0 . 4.06 1344 1183 A 38 LYS HGy A 38 LYS HEy 1.0 . 4.06 1345 1184 A 66 PHE HA A 43 LYS HGx 1.0 . 5.46 1346 1184 A 66 PHE HA A 43 LYS HGy 1.0 . 5.46 1347 1185 A 43 LYS H A 43 LYS HGx 1.0 . 4.12 1348 1185 A 43 LYS H A 43 LYS HGy 1.0 . 4.12 1349 1186 A 44 SER H A 43 LYS HGx 1.0 . 4.61 1350 1186 A 44 SER H A 43 LYS HGy 1.0 . 4.61 1351 1187 A 39 TYR H A 38 LYS HGx 1.0 . 5.17 1352 1188 A 38 LYS H A 38 LYS HGx 1.0 . 4.00 1353 1189 A 38 LYS HGx A 38 LYS HA 1.0 . 3.76 1354 1190 A 18 GLU H A 20 LEU HDy% 1.0 . 5.03 1355 1191 A 21 ASP H A 20 LEU HDy% 1.0 . 4.98 1356 1192 A 19 LEU H A 20 LEU HDy% 1.0 . 5.25 1357 1193 A 20 LEU H A 20 LEU HDy% 1.0 . 4.15 1358 1194 A 20 LEU HDy% A 18 GLU HA 1.0 . 3.27 1359 1195 A 20 LEU HDy% A 18 GLU HGx 1.0 . 4.47 1360 1195 A 20 LEU HDy% A 18 GLU HGy 1.0 . 4.47 1361 1196 A 20 LEU HDy% A 18 GLU HBx 1.0 . 4.18 1362 1196 A 18 GLU HBy A 20 LEU HDy% 1.0 . 4.18 1363 1197 A 19 LEU HBy A 20 LEU HDy% 1.0 . 4.68 1364 1198 A 36 CYS HA A 39 TYR H 1.0 . 4.75 1365 1199 A 71 ASP HA A 74 LYS HGy 1.0 . 5.18 1366 1200 A 74 LYS HGy A 74 LYS HA 1.0 . 3.77 1367 1201 A 74 LYS H A 74 LYS HGx 1.0 . 3.82 1368 1202 A 41 LEU HDy% A 43 LYS HA 1.0 . 5.06 1369 1203 A 41 LEU HBx A 41 LEU HDy% 1.0 . 3.00 1370 1204 A 42 VAL HA A 41 LEU HDx% 1.0 . 5.48 1371 1205 A 42 VAL H A 41 LEU HDy% 1.0 . 4.25 1372 1206 A 41 LEU H A 41 LEU HDy% 1.0 . 4.31 1373 1207 A 41 LEU HA A 41 LEU HDy% 1.0 . 3.54 1374 1208 A 42 VAL H A 41 LEU HDx% 1.0 . 3.56 1375 1209 A 41 LEU H A 41 LEU HDx% 1.0 . 4.43 1376 1210 A 41 LEU HA A 41 LEU HDx% 1.0 . 3.29 1377 1211 A 43 LYS HA A 41 LEU HDx% 1.0 . 4.93 1378 1212 A 41 LEU HBx A 41 LEU HDx% 1.0 . 3.15 1379 1213 A 93 TYR H A 92 LYS HGy 1.0 . 4.92 1380 1214 A 92 LYS H A 92 LYS HGy 1.0 . 4.52 1381 1215 A 92 LYS HGy A 92 LYS HEx 1.0 . 4.09 1382 1215 A 92 LYS HGy A 92 LYS HEy 1.0 . 4.09 1383 1216 A 93 TYR H A 92 LYS HGx 1.0 . 4.78 1384 1217 A 92 LYS HGx A 92 LYS HEx 1.0 . 4.01 1385 1217 A 92 LYS HEy A 92 LYS HGx 1.0 . 4.01 1386 1218 A 92 LYS H A 92 LYS HGx 1.0 . 4.69 1387 1219 A 66 PHE HD% A 41 LEU HDx% 1.0 . 5.50 1388 1220 A 32 VAL HGy% A 29 VAL H 1.0 . 5.33 1389 1221 A 90 VAL H A 89 VAL HA 1.0 . 3.02 1390 1222 A 33 ARG H A 32 VAL HGy% 1.0 . 3.98 1391 1223 A 32 VAL HGy% A 35 GLU HGy 1.0 . 4.90 1392 1224 A 32 VAL H A 32 VAL HGy% 1.0 . 3.09 1393 1225 A 28 ILE HA A 32 VAL HGy% 1.0 . 4.43 1394 1226 A 32 VAL HGy% A 32 VAL HA 1.0 . 3.12 1395 1227 A 29 VAL HA A 32 VAL HGy% 1.0 . 4.16 1396 1228 A 31 ASP HBy A 32 VAL HGy% 1.0 . 4.45 1397 1229 A 32 VAL HGy% A 31 ASP HBx 1.0 . 4.53 1398 1230 A 79 LEU H A 79 LEU HDx% 1.0 . 4.09 1399 1231 A 82 ARG H A 79 LEU HDx% 1.0 . 5.39 1400 1232 A 39 TYR HE% A 79 LEU HDx% 1.0 . 3.87 1401 1233 A 79 LEU HDx% A 79 LEU HA 1.0 . 3.02 1402 1234 A 79 LEU HDx% A 82 ARG HDx 1.0 . 4.08 1403 1234 A 82 ARG HDy A 79 LEU HDx% 1.0 . 4.08 1404 1235 A 35 GLU HGx A 79 LEU HDx% 1.0 . 4.17 1405 1236 A 79 LEU HBx A 79 LEU HDx% 1.0 . 3.48 1406 1237 A 8 LEU H A 8 LEU HDx% 1.0 . 4.97 1407 1238 A 9 CYS H A 8 LEU HDx% 1.0 . 3.71 1408 1239 A 8 LEU HDx% A 92 LYS H 1.0 . 4.17 1409 1240 A 91 THR HA A 8 LEU HDx% 1.0 . 4.63 1410 1241 A 8 LEU HDx% A 8 LEU HA 1.0 . 3.38 1411 1242 A 91 THR HB A 8 LEU HDx% 1.0 . 3.48 1412 1243 A 8 LEU HDx% A 76 MET HA 1.0 . 3.79 1413 1244 A 8 LEU HDx% A 76 MET HBx 1.0 . 3.58 1414 1244 A 8 LEU HDx% A 76 MET HBy 1.0 . 3.58 1415 1245 A 8 LEU HBy A 8 LEU HDx% 1.0 . 3.61 1416 1246 A 8 LEU HBx A 8 LEU HDx% 1.0 . 3.33 1417 1247 A 67 THR HA A 43 LYS HDy 1.0 . 4.05 1418 1248 A 56 VAL H A 50 PRO HA 1.0 . 4.26 1419 1249 A 50 PRO HA A 56 VAL HGy% 1.0 . 3.65 1420 1250 A 37 SER HBy A 42 VAL HGy% 1.0 . 5.10 1421 1251 A 36 CYS H A 37 SER HBx 1.0 . 4.95 1422 1252 A 38 LYS H A 37 SER HBx 1.0 . 4.75 1423 1253 A 89 VAL HGy% A 11 MET H 1.0 . 5.16 1424 1254 A 89 VAL H A 89 VAL HGy% 1.0 . 3.10 1425 1255 A 90 VAL H A 89 VAL HGy% 1.0 . 4.07 1426 1256 A 82 ARG H A 89 VAL HGy% 1.0 . 4.40 1427 1257 A 89 VAL HGy% A 83 LYS HA 1.0 . 4.68 1428 1258 A 88 VAL HA A 89 VAL HGy% 1.0 . 3.92 1429 1259 A 89 VAL HGy% A 89 VAL HA 1.0 . 3.24 1430 1260 A 89 VAL HGy% A 13 MET HA 1.0 . 3.91 1431 1261 A 89 VAL HGy% A 12 ASN HBx 1.0 . 4.29 1432 1261 A 89 VAL HGy% A 12 ASN HBy 1.0 . 4.29 1433 1262 A 89 VAL HGy% A 84 PHE HBy 1.0 . 4.33 1434 1263 A 84 PHE HBx A 89 VAL HGy% 1.0 . 4.21 1435 1264 A 89 VAL HGy% A 13 MET HGx 1.0 . 3.54 1436 1264 A 89 VAL HGy% A 13 MET HGy 1.0 . 3.54 1437 1265 A 89 VAL HGy% A 10 LEU HDy% 1.0 . 4.62 1438 1266 A 19 LEU H A 20 LEU HDx% 1.0 . 4.97 1439 1267 A 20 LEU H A 20 LEU HDx% 1.0 . 4.04 1440 1268 A 20 LEU HDx% A 20 LEU HA 1.0 . 2.93 1441 1269 A 50 PRO HDy A 20 LEU HDx% 1.0 . 4.37 1442 1270 A 50 PRO HDx A 20 LEU HDx% 1.0 . 4.22 1443 1271 A 20 LEU HDx% A 50 PRO HGy 1.0 . 3.43 1444 1271 A 20 LEU HDx% A 50 PRO HGx 1.0 . 3.43 1445 1272 A 34 ASP HA A 37 SER HBx 1.0 . 3.90 1446 1273 A 4 PRO HA A 5 THR HA 1.0 . 4.66 1447 1274 A 43 LYS H A 67 THR HG2% 1.0 . 4.51 1448 1275 A 67 THR H A 67 THR HG2% 1.0 . 3.56 1449 1276 A 42 VAL H A 67 THR HG2% 1.0 . 5.50 1450 1277 A 68 SER H A 67 THR HG2% 1.0 . 4.53 1451 1278 A 67 THR HG2% A 67 THR HA 1.0 . 3.18 1452 1279 A 68 SER HBx A 67 THR HG2% 1.0 . 5.50 1453 1280 A 42 VAL HA A 67 THR HG2% 1.0 . 5.45 1454 1281 A 41 LEU HBx A 67 THR HG2% 1.0 . 3.14 1455 1282 A 67 THR HG2% A 41 LEU HG 1.0 . 3.20 1456 1283 A 67 THR HG2% A 41 LEU HDy% 1.0 . 3.72 1457 1284 A 81 GLY H A 91 THR HG2% 1.0 . 4.47 1458 1285 A 91 THR HA A 91 THR HG2% 1.0 . 3.35 1459 1286 A 10 LEU HA A 91 THR HG2% 1.0 . 3.83 1460 1287 A 91 THR HG2% A 80 THR HA 1.0 . 4.24 1461 1288 A 91 THR HG2% A 76 MET HBx 1.0 . 4.28 1462 1288 A 76 MET HBy A 91 THR HG2% 1.0 . 4.28 1463 1289 A 79 LEU HBy A 91 THR HG2% 1.0 . 3.76 1464 1290 A 10 LEU HDy% A 91 THR HG2% 1.0 . 3.23 1465 1291 A 19 LEU HDx% A 25 TYR HBx 1.0 . 4.40 1466 1291 A 25 TYR HBy A 19 LEU HDx% 1.0 . 4.40 1467 1292 A 25 TYR H A 19 LEU HDx% 1.0 . 5.50 1468 1293 A 19 LEU H A 19 LEU HDx% 1.0 . 4.29 1469 1294 A 25 TYR HE% A 19 LEU HDx% 1.0 . 4.00 1470 1295 A 49 ARG HA A 19 LEU HDx% 1.0 . 3.99 1471 1296 A 19 LEU HA A 19 LEU HDx% 1.0 . 3.05 1472 1297 A 25 TYR HA A 19 LEU HDx% 1.0 . 4.22 1473 1298 A 19 LEU HBx A 19 LEU HDx% 1.0 . 3.41 1474 1299 A 19 LEU HDx% A 14 VAL HGx% 1.0 . 3.26 1475 1300 A 32 VAL HGx% A 29 VAL HA 1.0 . 4.63 1476 1301 A 32 VAL HGx% A 36 CYS HBy 1.0 . 4.80 1477 1302 A 67 THR H A 42 VAL HA 1.0 . 4.95 1478 1303 A 66 PHE HD% A 42 VAL HA 1.0 . 5.08 1479 1304 A 42 VAL HA A 41 LEU HA 1.0 . 5.13 1480 1305 A 43 LYS H A 42 VAL HA 1.0 . 3.04 1481 1306 A 42 VAL HA A 43 LYS HA 1.0 . 4.89 1482 1307 A 93 TYR HE% A 4 PRO HA 1.0 . 4.31 1483 1308 A 5 THR H A 4 PRO HA 1.0 . 3.01 1484 1309 A 69 VAL HGy% A 4 PRO HA 1.0 . 5.21 1485 1310 A 41 LEU H A 67 THR HG2% 1.0 . 5.05 1486 1311 A 67 THR HG2% A 43 LYS HEx 1.0 . 4.59 1487 1311 A 43 LYS HEy A 67 THR HG2% 1.0 . 4.59 1488 1312 A 32 VAL HGx% A 32 VAL H 1.0 . 3.82 1489 1313 A 32 VAL HGx% A 35 GLU H 1.0 . 5.09 1490 1314 A 32 VAL HGx% A 32 VAL HA 1.0 . 3.27 1491 1315 A 32 VAL HGx% A 35 GLU HGy 1.0 . 3.50 1492 1316 A 89 VAL HGx% A 11 MET H 1.0 . 4.24 1493 1317 A 89 VAL H A 89 VAL HGx% 1.0 . 3.87 1494 1318 A 90 VAL H A 89 VAL HGx% 1.0 . 3.56 1495 1319 A 89 VAL HGx% A 84 PHE HD% 1.0 . 4.72 1496 1320 A 89 VAL HGx% A 10 LEU HA 1.0 . 4.96 1497 1321 A 89 VAL HGx% A 89 VAL HA 1.0 . 3.44 1498 1322 A 89 VAL HGx% A 80 THR HA 1.0 . 4.04 1499 1323 A 89 VAL HGx% A 10 LEU HBx 1.0 . 3.49 1500 1324 A 89 VAL HGx% A 10 LEU HDy% 1.0 . 3.53 1501 1325 A 14 VAL H A 15 LEU HDx% 1.0 . 5.50 1502 1326 A 43 LYS H A 42 VAL HGy% 1.0 . 4.21 1503 1327 A 42 VAL H A 42 VAL HGy% 1.0 . 3.23 1504 1328 A 37 SER H A 42 VAL HGy% 1.0 . 4.27 1505 1329 A 37 SER HA A 42 VAL HGy% 1.0 . 3.58 1506 1330 A 42 VAL HGy% A 41 LEU HA 1.0 . 4.02 1507 1331 A 42 VAL HGy% A 42 VAL HA 1.0 . 3.19 1508 1332 A 36 CYS HBy A 42 VAL HGy% 1.0 . 3.62 1509 1333 A 36 CYS HBx A 42 VAL HGy% 1.0 . 3.61 1510 1334 A 42 VAL HGy% A 35 GLU HGy 1.0 . 5.50 1511 1335 A 42 VAL HGy% A 33 ARG HGx 1.0 . 4.54 1512 1335 A 42 VAL HGy% A 33 ARG HGy 1.0 . 4.54 1513 1336 A 64 VAL HGy% A 42 VAL HGy% 1.0 . 3.85 1514 1337 A 47 ILE H A 29 VAL HGy% 1.0 . 5.17 1515 1338 A 29 VAL HGy% A 29 VAL H 1.0 . 3.02 1516 1339 A 27 GLU H A 29 VAL HGy% 1.0 . 5.50 1517 1340 A 30 GLU H A 29 VAL HGy% 1.0 . 4.16 1518 1341 A 29 VAL HGy% A 25 TYR HA 1.0 . 4.82 1519 1342 A 29 VAL HGy% A 26 GLU HA 1.0 . 3.63 1520 1343 A 29 VAL HA A 29 VAL HGy% 1.0 . 3.18 1521 1344 A 29 VAL HGy% A 47 ILE HD1% 1.0 . 3.09 1522 1345 A 87 ARG HDx A 15 LEU HDx% 1.0 . 4.51 1523 1346 A 15 LEU H A 15 LEU HDx% 1.0 . 4.22 1524 1347 A 15 LEU HA A 15 LEU HDx% 1.0 . 3.01 1525 1348 A 16 PRO HDx A 15 LEU HDx% 1.0 . 3.54 1526 1349 A 87 ARG HDy A 15 LEU HDx% 1.0 . 4.11 1527 1350 A 15 LEU HBy A 15 LEU HDx% 1.0 . 3.50 1528 1351 A 98 SER HA A 97 ASP HBy 1.0 . 3.70 1529 1352 A 64 VAL HGy% A 64 VAL H 1.0 . 4.31 1530 1353 A 64 VAL HGy% A 65 GLU H 1.0 . 3.61 1531 1354 A 64 VAL HGy% A 84 PHE HE% 1.0 . 4.08 1532 1355 A 64 VAL HGy% A 45 ILE HA 1.0 . 4.17 1533 1356 A 64 VAL HGy% A 65 GLU HA 1.0 . 4.85 1534 1357 A 64 VAL HGy% A 64 VAL HA 1.0 . 3.42 1535 1358 A 64 VAL HGy% A 42 VAL HA 1.0 . 4.45 1536 1359 A 64 VAL HGy% A 36 CYS HBx 1.0 . 4.21 1537 1360 A 64 VAL HGy% A 45 ILE HG1y 1.0 . 4.36 1538 1361 A 64 VAL HGy% A 42 VAL HGx% 1.0 . 3.13 1539 1362 A 88 VAL HA A 83 LYS HGx 1.0 . 4.46 1540 1363 A 88 VAL HA A 89 VAL HB 1.0 . 4.39 1541 1364 A 60 GLY H A 59 CYS HA 1.0 . 3.29 1542 1365 A 61 LYS H A 59 CYS HA 1.0 . 4.06 1543 1366 A 59 CYS HA A 61 LYS HDx 1.0 . 3.84 1544 1366 A 61 LYS HDy A 59 CYS HA 1.0 . 3.84 1545 1367 A 69 VAL HGx% A 70 PHE H 1.0 . 4.19 1546 1368 A 6 GLU HA A 69 VAL HGx% 1.0 . 4.66 1547 1369 A 69 VAL HA A 69 VAL HGx% 1.0 . 3.36 1548 1370 A 56 VAL HGy% A 59 CYS HA 1.0 . 4.55 1549 1371 A 69 VAL HGx% A 6 GLU H 1.0 . 3.79 1550 1372 A 69 VAL H A 69 VAL HGx% 1.0 . 3.19 1551 1373 A 69 VAL HGx% A 6 GLU HGx 1.0 . 4.59 1552 1373 A 69 VAL HGx% A 6 GLU HGy 1.0 . 4.59 1553 1374 A 14 VAL HA A 14 VAL HGx% 1.0 . 3.15 1554 1375 A 43 LYS H A 42 VAL HGx% 1.0 . 3.61 1555 1376 A 42 VAL H A 42 VAL HGx% 1.0 . 3.73 1556 1377 A 42 VAL HGx% A 45 ILE H 1.0 . 4.94 1557 1378 A 42 VAL HGx% A 44 SER H 1.0 . 3.61 1558 1379 A 42 VAL HGx% A 66 PHE HA 1.0 . 4.51 1559 1380 A 42 VAL HGx% A 64 VAL HA 1.0 . 4.77 1560 1381 A 42 VAL HGx% A 43 LYS HA 1.0 . 4.87 1561 1382 A 42 VAL HGx% A 42 VAL HA 1.0 . 3.28 1562 1383 A 42 VAL HGx% A 33 ARG HDx 1.0 . 4.80 1563 1383 A 42 VAL HGx% A 33 ARG HDy 1.0 . 4.80 1564 1384 A 42 VAL HGx% A 36 CYS HBy 1.0 . 5.22 1565 1385 A 5 THR HG2% A 6 GLU H 1.0 . 3.97 1566 1386 A 7 VAL H A 5 THR HG2% 1.0 . 4.31 1567 1387 A 5 THR HG2% A 5 THR H 1.0 . 3.82 1568 1388 A 5 THR HG2% A 95 ASP HA 1.0 . 3.64 1569 1389 A 96 PRO HDy A 5 THR HG2% 1.0 . 3.54 1570 1390 A 5 THR HG2% A 96 PRO HDx 1.0 . 3.82 1571 1391 A 5 THR HG2% A 93 TYR HBy 1.0 . 3.84 1572 1392 A 5 THR HG2% A 4 PRO HA 1.0 . 3.98 1573 1393 A 15 LEU H A 14 VAL HGx% 1.0 . 4.50 1574 1394 A 14 VAL H A 14 VAL HGx% 1.0 . 4.00 1575 1395 A 52 ASP H A 51 VAL HA 1.0 . 2.72 1576 1396 A 53 GLY H A 51 VAL HA 1.0 . 4.95 1577 1397 A 51 VAL HGx% A 51 VAL HA 1.0 . 3.02 1578 1398 A 7 VAL HGx% A 99 TYR HA 1.0 . 5.36 1579 1399 A 46 GLU HGy A 99 TYR HA 1.0 . 5.38 1580 1400 A 94 CYS H A 5 THR HG2% 1.0 . 4.72 1581 1401 A 88 VAL H A 88 VAL HGx% 1.0 . 3.18 1582 1402 A 88 VAL HA A 88 VAL HGx% 1.0 . 3.15 1583 1403 A 46 GLU H A 64 VAL HA 1.0 . 4.23 1584 1404 A 65 GLU H A 64 VAL HA 1.0 . 3.06 1585 1405 A 89 VAL H A 88 VAL HGy% 1.0 . 3.40 1586 1406 A 88 VAL H A 88 VAL HGy% 1.0 . 3.97 1587 1407 A 88 VAL HA A 88 VAL HGy% 1.0 . 3.17 1588 1408 A 88 VAL HGy% A 81 GLY HAx 1.0 . 3.24 1589 1409 A 88 VAL HGy% A 83 LYS HEx 1.0 . 4.96 1590 1409 A 88 VAL HGy% A 83 LYS HEy 1.0 . 4.96 1591 1410 A 29 VAL HGx% A 29 VAL H 1.0 . 3.80 1592 1411 A 30 GLU H A 29 VAL HGx% 1.0 . 3.91 1593 1412 A 29 VAL HGx% A 30 GLU HA 1.0 . 4.03 1594 1413 A 29 VAL HA A 29 VAL HGx% 1.0 . 3.23 1595 1414 A 65 GLU HBy A 64 VAL HA 1.0 . 5.19 1596 1415 A 54 VAL HA A 54 VAL HGy% 1.0 . 3.06 1597 1416 A 81 GLY H A 80 THR HG2% 1.0 . 3.41 1598 1417 A 91 THR H A 80 THR HG2% 1.0 . 4.03 1599 1418 A 82 ARG H A 80 THR HG2% 1.0 . 4.83 1600 1419 A 80 THR H A 80 THR HG2% 1.0 . 3.88 1601 1420 A 77 GLN HA A 80 THR HG2% 1.0 . 4.35 1602 1421 A 80 THR HA A 80 THR HG2% 1.0 . 3.14 1603 1422 A 80 THR HG2% A 77 GLN HBx 1.0 . 5.24 1604 1422 A 77 GLN HBy A 80 THR HG2% 1.0 . 5.24 1605 1423 A 91 THR H A 90 VAL HGx% 1.0 . 3.27 1606 1423 A 91 THR H A 90 VAL HGy% 1.0 . 3.27 1607 1424 A 11 MET H A 90 VAL HGx% 1.0 . 4.50 1608 1424 A 11 MET H A 90 VAL HGy% 1.0 . 4.50 1609 1425 A 91 THR HA A 90 VAL HGx% 1.0 . 5.17 1610 1425 A 91 THR HA A 90 VAL HGy% 1.0 . 5.17 1611 1426 A 90 VAL H A 90 VAL HGx% 1.0 . 3.46 1612 1426 A 90 VAL H A 90 VAL HGy% 1.0 . 3.46 1613 1427 A 12 ASN HD2x A 90 VAL HGx% 1.0 . 3.73 1614 1427 A 90 VAL HGy% A 12 ASN HD2x 1.0 . 3.73 1615 1428 A 89 VAL HA A 90 VAL HGx% 1.0 . 3.95 1616 1428 A 89 VAL HA A 90 VAL HGy% 1.0 . 3.95 1617 1429 A 12 ASN HBx A 90 VAL HGx% 1.0 . 3.79 1618 1429 A 12 ASN HBy A 90 VAL HGx% 1.0 . 3.79 1619 1429 A 90 VAL HGy% A 12 ASN HBx 1.0 . 3.79 1620 1429 A 12 ASN HBy A 90 VAL HGy% 1.0 . 3.79 1621 1430 A 51 VAL H A 51 VAL HGy% 1.0 . 3.49 1622 1431 A 51 VAL HA A 51 VAL HGy% 1.0 . 3.06 1623 1432 A 55 GLU H A 54 VAL HGx% 1.0 . 3.20 1624 1433 A 51 VAL H A 51 VAL HGx% 1.0 . 3.98 1625 1434 A 54 VAL H A 54 VAL HGy% 1.0 . 3.20 1626 1435 A 89 VAL HB A 88 VAL HGy% 1.0 . 5.05 1627 1436 A 84 PHE HE% A 64 VAL HGx% 1.0 . 5.20 1628 1437 A 90 VAL HA A 91 THR H 1.0 . 2.87 1629 1438 A 90 VAL HA A 80 THR HA 1.0 . 4.52 1630 1439 A 90 VAL HA A 80 THR HG2% 1.0 . 4.31 1631 1440 A 35 GLU H A 33 ARG HA 1.0 . 4.57 1632 1441 A 33 ARG HA A 35 GLU HGy 1.0 . 5.06 1633 1442 A 33 ARG HA A 33 ARG HGx 1.0 . 3.33 1634 1442 A 33 ARG HA A 33 ARG HGy 1.0 . 3.33 1635 1443 A 90 VAL HA A 90 VAL HGx% 1.0 . 2.81 1636 1443 A 90 VAL HA A 90 VAL HGy% 1.0 . 2.81 1637 1444 A 52 ASP HBx A 51 VAL HGy% 1.0 . 5.50 1638 1445 A 54 VAL H A 54 VAL HGx% 1.0 . 3.87 1639 1446 A 54 VAL HA A 54 VAL HGx% 1.0 . 3.06 1640 1447 A 52 ASP H A 51 VAL HGx% 1.0 . 3.39 1641 1448 A 52 ASP HBx A 51 VAL HGx% 1.0 . 4.01 1642 1449 A 65 GLU H A 64 VAL HGx% 1.0 . 4.68 1643 1450 A 8 LEU H A 64 VAL HGx% 1.0 . 5.02 1644 1451 A 64 VAL H A 64 VAL HGx% 1.0 . 3.67 1645 1452 A 63 PHE HA A 64 VAL HGx% 1.0 . 4.62 1646 1453 A 64 VAL HA A 64 VAL HGx% 1.0 . 3.49 1647 1454 A 69 VAL HGy% A 6 GLU H 1.0 . 4.42 1648 1455 A 69 VAL H A 69 VAL HGy% 1.0 . 3.74 1649 1456 A 73 GLN H A 69 VAL HGy% 1.0 . 4.98 1650 1457 A 69 VAL HGy% A 70 PHE H 1.0 . 4.14 1651 1458 A 69 VAL HGy% A 70 PHE HE% 1.0 . 5.50 1652 1459 A 69 VAL HGy% A 3 HIS HD2 1.0 . 5.25 1653 1460 A 69 VAL HGy% A 73 GLN HE2x 1.0 . 5.11 1654 1461 A 69 VAL HGy% A 5 THR H 1.0 . 4.42 1655 1462 A 68 SER HA A 69 VAL HGy% 1.0 . 5.50 1656 1463 A 69 VAL HGy% A 5 THR HA 1.0 . 3.63 1657 1464 A 6 GLU HA A 69 VAL HGy% 1.0 . 3.98 1658 1465 A 69 VAL HA A 69 VAL HGy% 1.0 . 3.38 1659 1466 A 69 VAL HGy% A 70 PHE HBx 1.0 . 5.26 1660 1466 A 70 PHE HBy A 69 VAL HGy% 1.0 . 5.26 1661 1467 A 69 VAL HGy% A 73 GLN HGx 1.0 . 4.03 1662 1468 A 69 VAL HGy% A 4 PRO HBx 1.0 . 3.30 1663 1469 A 72 CYS HBx A 69 VAL HGy% 1.0 . 5.50 1664 1470 A 7 VAL HGy% A 66 PHE H 1.0 . 3.94 1665 1471 A 7 VAL HGy% A 100 HIS H 1.0 . 5.50 1666 1472 A 7 VAL H A 7 VAL HGy% 1.0 . 3.86 1667 1473 A 7 VAL HGy% A 7 VAL HA 1.0 . 3.60 1668 1474 A 7 VAL HGy% A 65 GLU HA 1.0 . 3.60 1669 1475 A 7 VAL HGy% A 5 THR HB 1.0 . 5.50 1670 1476 A 7 VAL HGy% A 6 GLU HA 1.0 . 5.22 1671 1477 A 7 VAL HGy% A 96 PRO HDx 1.0 . 3.49 1672 1478 A 7 VAL HGy% A 99 TYR HBx 1.0 . 3.83 1673 1479 A 7 VAL HGy% A 96 PRO HBx 1.0 . 3.10 1674 1480 A 7 VAL HGy% A 65 GLU HGx 1.0 . 3.38 1675 1481 A 7 VAL HGy% A 65 GLU HBx 1.0 . 4.43 1676 1482 A 8 LEU H A 7 VAL HGx% 1.0 . 3.60 1677 1483 A 94 CYS H A 7 VAL HGx% 1.0 . 4.55 1678 1484 A 7 VAL H A 7 VAL HGx% 1.0 . 4.76 1679 1485 A 7 VAL HGx% A 7 VAL HA 1.0 . 3.50 1680 1486 A 7 VAL HGx% A 96 PRO HDx 1.0 . 5.08 1681 1487 A 39 TYR H A 37 SER HA 1.0 . 4.23 1682 1488 A 65 GLU HA A 7 VAL HA 1.0 . 3.85 1683 1489 A 7 VAL HGy% A 99 TYR H 1.0 . 5.27 1684 1490 A 7 VAL HGy% A 6 GLU H 1.0 . 4.67 1685 1491 A 42 VAL H A 37 SER HA 1.0 . 4.42 1686 1492 A 37 SER HA A 33 ARG HGx 1.0 . 5.50 1687 1492 A 37 SER HA A 33 ARG HGy 1.0 . 5.50 1688 1493 A 8 LEU H A 7 VAL HA 1.0 . 3.06 1689 1494 A 57 PRO HDx A 56 VAL HGx% 1.0 . 3.93 1690 1495 A 73 GLN H A 70 PHE HA 1.0 . 4.08 1691 1496 A 73 GLN HGx A 70 PHE HA 1.0 . 4.48 1692 1497 A 73 GLN HBy A 70 PHE HA 1.0 . 3.71 1693 1498 A 69 VAL HGy% A 70 PHE HA 1.0 . 4.57 1694 1499 A 56 VAL H A 56 VAL HGy% 1.0 . 3.17 1695 1500 A 56 VAL HGy% A 55 GLU HA 1.0 . 4.34 1696 1501 A 45 ILE HA A 46 GLU H 1.0 . 3.02 1697 1502 A 45 ILE HA A 64 VAL HA 1.0 . 3.40 1698 1503 A 62 ILE HA A 47 ILE HA 1.0 . 3.93 1699 1504 A 62 ILE HA A 62 ILE HG1x 1.0 . 3.62 1700 1505 A 57 PRO HDy A 56 VAL HA 1.0 . 3.00 1701 1506 A 57 PRO HDx A 56 VAL HA 1.0 . 3.19 1702 1507 A 57 PRO HGx A 56 VAL HA 1.0 . 4.64 1703 1508 A 56 VAL HA A 56 VAL HGx% 1.0 . 3.10 1704 1509 A 76 MET H A 72 CYS HA 1.0 . 5.08 1705 1510 A 66 PHE HD% A 72 CYS HA 1.0 . 4.08 1706 1511 A 71 ASP HA A 72 CYS HA 1.0 . 4.72 1707 1512 A 75 ALA H A 72 CYS HA 1.0 . 4.09 1708 1513 A 27 GLU H A 23 GLU HA 1.0 . 5.04 1709 1514 A 26 GLU H A 23 GLU HA 1.0 . 4.01 1710 1515 A 23 GLU HA A 23 GLU HBx 1.0 . 2.77 1711 1516 A 76 MET HA A 76 MET HGx 1.0 . 3.61 1712 1516 A 76 MET HA A 76 MET HGy 1.0 . 3.61 1713 1517 A 76 MET HA A 91 THR HG2% 1.0 . 4.20 1714 1518 A 8 LEU HDy% A 76 MET HA 1.0 . 3.87 1715 1519 A 76 MET HA A 79 LEU HBy 1.0 . 4.74 1716 1520 A 76 MET H A 75 ALA HB% 1.0 . 3.58 1717 1521 A 75 ALA H A 75 ALA HB% 1.0 . 3.10 1718 1522 A 75 ALA HB% A 76 MET HA 1.0 . 5.02 1719 1523 A 39 TYR HBy A 75 ALA HB% 1.0 . 3.91 1720 1524 A 72 CYS HA A 75 ALA HB% 1.0 . 3.54 1721 1525 A 74 LYS HBy A 75 ALA HB% 1.0 . 5.05 1722 1526 A 75 ALA HB% A 79 LEU HG 1.0 . 5.50 1723 1527 A 75 ALA HB% A 8 LEU HDy% 1.0 . 3.43 1724 1528 A 60 GLY H A 14 VAL HGy% 1.0 . 4.98 1725 1529 A 15 LEU H A 14 VAL HGy% 1.0 . 4.01 1726 1530 A 14 VAL H A 14 VAL HGy% 1.0 . 3.43 1727 1531 A 14 VAL HGy% A 14 VAL HA 1.0 . 3.67 1728 1532 A 14 VAL HGy% A 13 MET HA 1.0 . 4.89 1729 1533 A 14 VAL HGy% A 60 GLY HAx 1.0 . 4.11 1730 1534 A 14 VAL HGy% A 47 ILE HG2% 1.0 . 3.40 1731 1535 A 3 HIS HD2 A 5 THR HA 1.0 . 4.75 1732 1536 A 6 GLU H A 5 THR HA 1.0 . 3.32 1733 1537 A 4 PRO HBx A 5 THR HA 1.0 . 4.84 1734 1538 A 5 THR HG2% A 5 THR HA 1.0 . 3.56 1735 1539 A 69 VAL HGx% A 5 THR HA 1.0 . 3.87 1736 1540 A 39 TYR HD% A 74 LYS HA 1.0 . 5.20 1737 1541 A 74 LYS HA A 74 LYS HGx 1.0 . 3.46 1738 1542 A 93 TYR HA A 8 LEU HA 1.0 . 3.66 1739 1543 A 8 LEU HDx% A 93 TYR HA 1.0 . 4.85 1740 1544 A 35 GLU HA A 38 LYS HEx 1.0 . 3.92 1741 1544 A 35 GLU HA A 38 LYS HEy 1.0 . 3.92 1742 1545 A 35 GLU HA A 38 LYS HDy 1.0 . 4.00 1743 1546 A 35 GLU HA A 38 LYS HGy 1.0 . 4.13 1744 1547 A 35 GLU HA A 38 LYS H 1.0 . 4.44 1745 1548 A 28 ILE H A 24 GLU HA 1.0 . 4.66 1746 1549 A 27 GLU H A 24 GLU HA 1.0 . 3.97 1747 1550 A 27 GLU HGy A 24 GLU HA 1.0 . 3.35 1748 1551 A 30 GLU H A 27 GLU HA 1.0 . 3.94 1749 1552 A 31 ASP HBy A 27 GLU HA 1.0 . 5.43 1750 1553 A 27 GLU HGy A 27 GLU HA 1.0 . 3.73 1751 1554 A 93 TYR HE% A 93 TYR HA 1.0 . 5.06 1752 1555 A 73 GLN HA A 73 GLN HGx 1.0 . 3.66 1753 1556 A 58 GLY H A 105 TRP HA 1.0 . 4.10 1754 1557 A 30 GLU H A 26 GLU HA 1.0 . 4.52 1755 1558 A 25 TYR HD% A 26 GLU HA 1.0 . 4.45 1756 1559 A 26 GLU HA A 25 TYR HBx 1.0 . 4.63 1757 1559 A 25 TYR HBy A 26 GLU HA 1.0 . 4.63 1758 1560 A 26 GLU HA A 26 GLU HGx 1.0 . 3.66 1759 1561 A 26 GLU HA A 26 GLU HBx 1.0 . 2.95 1760 1562 A 26 GLU HA A 29 VAL HB 1.0 . 3.38 1761 1563 A 29 VAL HGx% A 26 GLU HA 1.0 . 4.42 1762 1564 A 91 THR HA A 10 LEU HA 1.0 . 3.92 1763 1565 A 91 THR HA A 90 VAL HA 1.0 . 5.13 1764 1566 A 91 THR HA A 11 MET HE% 1.0 . 4.41 1765 1567 A 74 LYS HBy A 39 TYR HA 1.0 . 4.96 1766 1568 A 57 PRO HBx A 105 TRP HA 1.0 . 4.07 1767 1569 A 17 GLU H A 18 GLU HA 1.0 . 4.75 1768 1570 A 18 GLU HA A 18 GLU HBx 1.0 . 2.82 1769 1570 A 18 GLU HBy A 18 GLU HA 1.0 . 2.82 1770 1571 A 20 LEU H A 18 GLU HA 1.0 . 4.80 1771 1572 A 32 VAL H A 30 GLU HA 1.0 . 4.14 1772 1573 A 30 GLU HA A 33 ARG HDx 1.0 . 4.64 1773 1573 A 33 ARG HDy A 30 GLU HA 1.0 . 4.64 1774 1574 A 42 VAL HGx% A 44 SER HA 1.0 . 4.39 1775 1575 A 39 TYR HD% A 39 TYR HA 1.0 . 3.44 1776 1576 A 33 ARG H A 30 GLU HA 1.0 . 3.55 1777 1577 A 33 ARG HBx A 30 GLU HA 1.0 . 3.67 1778 1578 A 30 GLU HA A 33 ARG HGx 1.0 . 4.65 1779 1578 A 33 ARG HGy A 30 GLU HA 1.0 . 4.65 1780 1579 A 30 GLU HGx A 30 GLU HA 1.0 . 3.59 1781 1580 A 30 GLU HA A 30 GLU HBy 1.0 . 2.83 1782 1580 A 30 GLU HA A 30 GLU HBx 1.0 . 2.83 1783 1581 A 44 SER HA A 45 ILE HB 1.0 . 4.51 1784 1582 A 15 LEU H A 14 VAL HA 1.0 . 3.04 1785 1583 A 25 TYR HD% A 22 ASP HA 1.0 . 4.46 1786 1584 A 22 ASP HA A 25 TYR HBx 1.0 . 3.41 1787 1584 A 25 TYR HBy A 22 ASP HA 1.0 . 3.41 1788 1585 A 77 GLN HA A 77 GLN HGx 1.0 . 3.59 1789 1586 A 77 GLN HA A 77 GLN HBx 1.0 . 2.81 1790 1586 A 77 GLN HA A 77 GLN HBy 1.0 . 2.81 1791 1587 A 6 GLU HA A 72 CYS HBx 1.0 . 3.53 1792 1588 A 6 GLU HA A 69 VAL H 1.0 . 4.89 1793 1589 A 38 LYS HGy A 38 LYS HA 1.0 . 3.73 1794 1590 A 47 ILE H A 47 ILE HG2% 1.0 . 4.62 1795 1591 A 6 GLU HA A 72 CYS H 1.0 . 4.81 1796 1592 A 6 GLU HA A 69 VAL HA 1.0 . 3.43 1797 1593 A 63 PHE H A 47 ILE HG2% 1.0 . 5.50 1798 1594 A 25 TYR HD% A 47 ILE HG2% 1.0 . 4.45 1799 1595 A 47 ILE HA A 47 ILE HG2% 1.0 . 2.98 1800 1596 A 62 ILE HA A 47 ILE HG2% 1.0 . 4.39 1801 1597 A 48 PRO HDy A 47 ILE HG2% 1.0 . 4.99 1802 1598 A 48 PRO HDx A 47 ILE HG2% 1.0 . 4.78 1803 1599 A 47 ILE HG2% A 47 ILE HD1% 1.0 . 3.31 1804 1600 A 66 PHE HA A 42 VAL HA 1.0 . 3.43 1805 1601 A 66 PHE HA A 67 THR HG2% 1.0 . 4.40 1806 1602 A 43 LYS H A 66 PHE HA 1.0 . 3.35 1807 1603 A 42 VAL H A 66 PHE HA 1.0 . 4.91 1808 1604 A 43 LYS HBy A 66 PHE HA 1.0 . 4.36 1809 1605 A 97 ASP HA A 98 SER HA 1.0 . 4.93 1810 1606 A 97 ASP HA A 100 HIS HBy 1.0 . 3.79 1811 1606 A 97 ASP HA A 100 HIS HBx 1.0 . 3.79 1812 1607 A 43 LYS HA A 43 LYS HGx 1.0 . 2.87 1813 1607 A 43 LYS HGy A 43 LYS HA 1.0 . 2.87 1814 1608 A 13 MET HA A 13 MET HGx 1.0 . 3.53 1815 1608 A 13 MET HA A 13 MET HGy 1.0 . 3.53 1816 1609 A 13 MET HA A 62 ILE HD1% 1.0 . 5.05 1817 1610 A 84 PHE HBy A 13 MET HA 1.0 . 4.97 1818 1611 A 34 ASP HA A 33 ARG HGx 1.0 . 4.70 1819 1611 A 34 ASP HA A 33 ARG HGy 1.0 . 4.70 1820 1612 A 85 ALA H A 84 PHE HA 1.0 . 2.93 1821 1613 A 85 ALA HB% A 84 PHE HA 1.0 . 5.02 1822 1614 A 31 ASP HA A 35 GLU H 1.0 . 4.96 1823 1615 A 31 ASP HA A 30 GLU HBy 1.0 . 4.47 1824 1615 A 31 ASP HA A 30 GLU HBx 1.0 . 4.47 1825 1616 A 19 LEU H A 17 GLU HA 1.0 . 4.17 1826 1617 A 20 LEU HDy% A 17 GLU HA 1.0 . 4.78 1827 1618 A 31 ASP HA A 31 ASP HBx 1.0 . 3.02 1828 1619 A 17 GLU HA A 20 LEU HDx% 1.0 . 5.32 1829 1620 A 89 VAL HA A 13 MET HE% 1.0 . 5.46 1830 1621 A 10 LEU H A 62 ILE HG2% 1.0 . 4.69 1831 1622 A 63 PHE H A 62 ILE HG2% 1.0 . 3.76 1832 1623 A 62 ILE H A 62 ILE HG2% 1.0 . 4.58 1833 1624 A 47 ILE HA A 62 ILE HG2% 1.0 . 4.21 1834 1625 A 62 ILE HA A 62 ILE HG2% 1.0 . 3.53 1835 1626 A 46 GLU H A 62 ILE HG2% 1.0 . 5.50 1836 1627 A 28 ILE HG2% A 32 VAL H 1.0 . 4.63 1837 1628 A 28 ILE HG2% A 25 TYR HD% 1.0 . 5.50 1838 1629 A 28 ILE HG2% A 25 TYR HA 1.0 . 4.41 1839 1630 A 28 ILE HG2% A 28 ILE HA 1.0 . 3.32 1840 1631 A 29 VAL HA A 28 ILE HG2% 1.0 . 4.05 1841 1632 A 28 ILE HG2% A 31 ASP HBy 1.0 . 4.93 1842 1633 A 28 ILE HG2% A 28 ILE HG1y 1.0 . 3.96 1843 1634 A 28 ILE HG2% A 28 ILE HG1x 1.0 . 3.18 1844 1635 A 71 ASP HA A 74 LYS HEx 1.0 . 4.01 1845 1635 A 71 ASP HA A 74 LYS HEy 1.0 . 4.01 1846 1636 A 11 MET HE% A 92 LYS H 1.0 . 4.35 1847 1637 A 90 VAL H A 11 MET HE% 1.0 . 5.50 1848 1638 A 11 MET HE% A 12 ASN HD2x 1.0 . 5.48 1849 1639 A 11 MET HE% A 90 VAL HA 1.0 . 4.31 1850 1640 A 11 MET HE% A 9 CYS HBx 1.0 . 4.58 1851 1641 A 11 MET HE% A 11 MET HGx 1.0 . 4.03 1852 1642 A 11 MET HBy A 11 MET HE% 1.0 . 2.93 1853 1643 A 11 MET HE% A 92 LYS HGy 1.0 . 3.36 1854 1644 A 11 MET HE% A 90 VAL HGx% 1.0 . 3.05 1855 1644 A 11 MET HE% A 90 VAL HGy% 1.0 . 3.05 1856 1645 A 84 PHE H A 13 MET HE% 1.0 . 5.00 1857 1646 A 84 PHE HD% A 13 MET HE% 1.0 . 3.65 1858 1647 A 84 PHE HA A 13 MET HE% 1.0 . 5.50 1859 1648 A 13 MET HA A 13 MET HE% 1.0 . 4.56 1860 1649 A 84 PHE HBy A 13 MET HE% 1.0 . 4.25 1861 1650 A 84 PHE HBx A 13 MET HE% 1.0 . 4.03 1862 1651 A 89 VAL HB A 13 MET HE% 1.0 . 3.96 1863 1652 A 13 MET HE% A 13 MET HGx 1.0 . 3.25 1864 1652 A 13 MET HGy A 13 MET HE% 1.0 . 3.25 1865 1653 A 89 VAL HGy% A 13 MET HE% 1.0 . 3.86 1866 1654 A 89 VAL HGx% A 13 MET HE% 1.0 . 3.33 1867 1655 A 45 ILE HA A 62 ILE HG2% 1.0 . 5.11 1868 1656 A 20 LEU HDy% A 20 LEU HA 1.0 . 4.60 1869 1657 A 85 ALA H A 85 ALA HB% 1.0 . 3.53 1870 1658 A 84 PHE H A 85 ALA HB% 1.0 . 5.50 1871 1659 A 86 ASN H A 85 ALA HB% 1.0 . 3.10 1872 1660 A 87 ARG H A 85 ALA HB% 1.0 . 4.17 1873 1661 A 86 ASN HBy A 85 ALA HB% 1.0 . 4.29 1874 1662 A 76 MET HE% A 76 MET HGx 1.0 . 3.87 1875 1662 A 76 MET HGy A 76 MET HE% 1.0 . 3.87 1876 1663 A 9 CYS H A 76 MET HE% 1.0 . 5.23 1877 1664 A 76 MET H A 76 MET HE% 1.0 . 5.18 1878 1665 A 93 TYR H A 76 MET HE% 1.0 . 3.55 1879 1666 A 92 LYS H A 76 MET HE% 1.0 . 4.01 1880 1667 A 77 GLN H A 76 MET HE% 1.0 . 4.94 1881 1668 A 93 TYR HD% A 76 MET HE% 1.0 . 3.82 1882 1669 A 93 TYR HE% A 76 MET HE% 1.0 . 3.82 1883 1670 A 91 THR HA A 76 MET HE% 1.0 . 4.44 1884 1671 A 93 TYR HA A 76 MET HE% 1.0 . 4.66 1885 1672 A 92 LYS HA A 76 MET HE% 1.0 . 3.12 1886 1673 A 91 THR HB A 76 MET HE% 1.0 . 3.41 1887 1674 A 76 MET HA A 76 MET HE% 1.0 . 4.17 1888 1675 A 76 MET HE% A 76 MET HBx 1.0 . 3.15 1889 1675 A 76 MET HBy A 76 MET HE% 1.0 . 3.15 1890 1676 A 8 LEU HDx% A 76 MET HE% 1.0 . 3.22 1891 1677 A 46 GLU H A 45 ILE HG2% 1.0 . 3.58 1892 1678 A 63 PHE H A 45 ILE HG2% 1.0 . 4.87 1893 1679 A 47 ILE H A 45 ILE HG2% 1.0 . 4.35 1894 1680 A 45 ILE H A 45 ILE HG2% 1.0 . 3.82 1895 1681 A 45 ILE HA A 45 ILE HG2% 1.0 . 3.58 1896 1682 A 46 GLU HA A 45 ILE HG2% 1.0 . 4.19 1897 1683 A 64 VAL HA A 45 ILE HG2% 1.0 . 4.34 1898 1684 A 64 VAL HB A 45 ILE HG2% 1.0 . 4.30 1899 1685 A 56 VAL H A 55 GLU HA 1.0 . 2.74 1900 1686 A 55 GLU HA A 55 GLU HBx 1.0 . 2.88 1901 1686 A 55 GLU HA A 55 GLU HBy 1.0 . 2.88 1902 1687 A 102 ARG HGx A 102 ARG HA 1.0 . 3.68 1903 1688 A 63 PHE HA A 64 VAL HB 1.0 . 4.68 1904 1689 A 8 LEU H A 63 PHE HA 1.0 . 5.22 1905 1690 A 63 PHE HA A 63 PHE HD% 1.0 . 4.52 1906 1691 A 63 PHE HA A 9 CYS HA 1.0 . 3.71 1907 1692 A 63 PHE HA A 62 ILE HG2% 1.0 . 4.55 1908 1693 A 63 PHE HA A 7 VAL HGx% 1.0 . 4.96 1909 1694 A 6 GLU HBx A 68 SER HA 1.0 . 4.61 1910 1695 A 68 SER HA A 70 PHE HBx 1.0 . 5.32 1911 1695 A 68 SER HA A 70 PHE HBy 1.0 . 5.32 1912 1696 A 88 VAL HGy% A 82 ARG HA 1.0 . 5.36 1913 1697 A 84 PHE HD% A 82 ARG HA 1.0 . 5.49 1914 1698 A 102 ARG HA A 102 ARG HGy 1.0 . 3.89 1915 1699 A 63 PHE HA A 62 ILE HA 1.0 . 4.78 1916 1700 A 69 VAL H A 68 SER HA 1.0 . 2.92 1917 1701 A 68 SER HBy A 68 SER HA 1.0 . 3.02 1918 1702 A 68 SER HA A 69 VAL HGx% 1.0 . 4.53 1919 1703 A 68 SER HA A 70 PHE H 1.0 . 4.20 1920 1704 A 51 VAL HA A 52 ASP HA 1.0 . 4.34 1921 1705 A 53 GLY HAx A 52 ASP HA 1.0 . 4.64 1922 1706 A 52 ASP H A 52 ASP HA 1.0 . 2.91 1923 1707 A 53 GLY H A 52 ASP HA 1.0 . 2.74 1924 1708 A 79 LEU HA A 82 ARG HDx 1.0 . 4.19 1925 1708 A 82 ARG HDy A 79 LEU HA 1.0 . 4.19 1926 1709 A 81 GLY H A 82 ARG HA 1.0 . 5.21 1927 1710 A 83 LYS H A 82 ARG HA 1.0 . 2.73 1928 1711 A 82 ARG HA A 82 ARG HDx 1.0 . 3.64 1929 1711 A 82 ARG HDy A 82 ARG HA 1.0 . 3.64 1930 1712 A 51 VAL HGx% A 52 ASP HA 1.0 . 4.54 1931 1713 A 88 VAL H A 87 ARG HA 1.0 . 2.77 1932 1714 A 87 ARG HGy A 87 ARG HA 1.0 . 3.83 1933 1715 A 88 VAL HGx% A 87 ARG HA 1.0 . 4.37 1934 1716 A 42 VAL H A 41 LEU HA 1.0 . 2.74 1935 1717 A 62 ILE HD1% A 14 VAL HA 1.0 . 5.46 1936 1718 A 84 PHE H A 83 LYS HA 1.0 . 2.84 1937 1719 A 88 VAL HA A 83 LYS HA 1.0 . 3.42 1938 1720 A 83 LYS HGy A 83 LYS HA 1.0 . 4.13 1939 1721 A 87 ARG HGx A 87 ARG HA 1.0 . 3.59 1940 1722 A 92 LYS HA A 92 LYS HBx 1.0 . 2.88 1941 1722 A 92 LYS HA A 92 LYS HBy 1.0 . 2.88 1942 1723 A 63 PHE H A 62 ILE HD1% 1.0 . 5.50 1943 1724 A 62 ILE H A 62 ILE HD1% 1.0 . 4.65 1944 1725 A 14 VAL H A 62 ILE HD1% 1.0 . 4.70 1945 1726 A 47 ILE HA A 62 ILE HD1% 1.0 . 3.95 1946 1727 A 62 ILE HA A 62 ILE HD1% 1.0 . 4.24 1947 1728 A 62 ILE HD1% A 13 MET HGx 1.0 . 3.79 1948 1728 A 13 MET HGy A 62 ILE HD1% 1.0 . 3.79 1949 1729 A 13 MET HBy A 62 ILE HD1% 1.0 . 3.66 1950 1730 A 12 ASN H A 11 MET HA 1.0 . 3.35 1951 1731 A 11 MET HA A 90 VAL HGx% 1.0 . 5.50 1952 1731 A 11 MET HA A 90 VAL HGy% 1.0 . 5.50 1953 1732 A 92 LYS HA A 93 TYR HA 1.0 . 5.50 1954 1733 A 45 ILE H A 45 ILE HD1% 1.0 . 4.98 1955 1734 A 33 ARG H A 45 ILE HD1% 1.0 . 3.90 1956 1735 A 45 ILE HA A 45 ILE HD1% 1.0 . 4.52 1957 1736 A 64 VAL HA A 45 ILE HD1% 1.0 . 5.50 1958 1737 A 33 ARG HA A 45 ILE HD1% 1.0 . 3.54 1959 1738 A 33 ARG HBx A 45 ILE HD1% 1.0 . 3.46 1960 1739 A 42 VAL HGx% A 45 ILE HD1% 1.0 . 3.72 1961 1740 A 64 VAL HGy% A 45 ILE HD1% 1.0 . 4.71 1962 1741 A 75 ALA HA A 79 LEU HG 1.0 . 4.65 1963 1742 A 47 ILE H A 47 ILE HD1% 1.0 . 4.58 1964 1743 A 29 VAL H A 47 ILE HD1% 1.0 . 4.48 1965 1744 A 25 TYR HD% A 47 ILE HD1% 1.0 . 5.23 1966 1745 A 25 TYR HE% A 47 ILE HD1% 1.0 . 4.59 1967 1746 A 47 ILE HA A 47 ILE HD1% 1.0 . 3.99 1968 1747 A 62 ILE HA A 47 ILE HD1% 1.0 . 4.75 1969 1748 A 29 VAL HA A 47 ILE HD1% 1.0 . 3.45 1970 1749 A 47 ILE HB A 47 ILE HD1% 1.0 . 3.73 1971 1750 A 85 ALA H A 86 ASN HA 1.0 . 5.20 1972 1751 A 79 LEU H A 75 ALA HA 1.0 . 4.66 1973 1752 A 78 GLY H A 75 ALA HA 1.0 . 3.92 1974 1753 A 39 TYR HD% A 75 ALA HA 1.0 . 4.10 1975 1754 A 39 TYR HBy A 75 ALA HA 1.0 . 4.60 1976 1755 A 75 ALA HA A 79 LEU HDy% 1.0 . 4.79 1977 1756 A 65 GLU HA A 65 GLU HGx 1.0 . 3.66 1978 1757 A 86 ASN HA A 86 ASN HBx 1.0 . 2.99 1979 1758 A 86 ASN HA A 83 LYS HBx 1.0 . 3.84 1980 1758 A 83 LYS HBy A 86 ASN HA 1.0 . 3.84 1981 1759 A 86 ASN HA A 85 ALA HB% 1.0 . 5.29 1982 1760 A 28 ILE H A 28 ILE HD1% 1.0 . 4.01 1983 1761 A 25 TYR HD% A 28 ILE HD1% 1.0 . 5.20 1984 1762 A 25 TYR HA A 28 ILE HD1% 1.0 . 3.78 1985 1763 A 28 ILE HA A 28 ILE HD1% 1.0 . 4.00 1986 1764 A 28 ILE HD1% A 25 TYR HBx 1.0 . 4.99 1987 1764 A 25 TYR HBy A 28 ILE HD1% 1.0 . 4.99 1988 1765 A 24 GLU HGy A 28 ILE HD1% 1.0 . 4.16 1989 1766 A 28 ILE HB A 28 ILE HD1% 1.0 . 3.36 1990 1767 A 28 ILE HG2% A 28 ILE HD1% 1.0 . 3.24 1991 1768 A 25 TYR H A 28 ILE HD1% 1.0 . 5.31 1992 1769 A 11 MET H A 10 LEU HA 1.0 . 3.11 1993 1770 A 19 LEU HA A 18 GLU HA 1.0 . 4.71 1994 1771 A 85 ALA HA A 86 ASN HBy 1.0 . 4.64 1995 1772 A 85 ALA H A 85 ALA HA 1.0 . 2.90 1996 1773 A 85 ALA HA A 84 PHE HA 1.0 . 4.35 1997 1774 A 22 ASP H A 21 ASP HA 1.0 . 2.89 1998 1775 A 19 LEU HA A 25 TYR HBx 1.0 . 4.23 1999 1775 A 25 TYR HBy A 19 LEU HA 1.0 . 4.23 2000 1776 A 21 ASP HA A 22 ASP HA 1.0 . 4.74 2001 1777 A 23 GLU H A 21 ASP HA 1.0 . 3.90 2002 1778 A 4 PRO HDy A 3 HIS HA 1.0 . 2.85 2003 1779 A 4 PRO HDx A 3 HIS HA 1.0 . 3.14 2004 1780 A 96 PRO HDy A 95 ASP HA 1.0 . 3.22 2005 1781 A 93 TYR HD% A 8 LEU HA 1.0 . 4.18 2006 1782 A 9 CYS H A 8 LEU HA 1.0 . 3.22 2007 1783 A 96 PRO HDy A 95 ASP HBx 1.0 . 4.34 2008 1783 A 96 PRO HDy A 95 ASP HBy 1.0 . 4.34 2009 1784 A 96 PRO HDy A 5 THR HB 1.0 . 4.62 2010 1785 A 97 ASP H A 96 PRO HDx 1.0 . 4.25 2011 1786 A 95 ASP HA A 96 PRO HDx 1.0 . 3.27 2012 1787 A 5 THR HB A 96 PRO HDx 1.0 . 4.67 2013 1788 A 50 PRO HDy A 19 LEU HBx 1.0 . 4.32 2014 1789 A 50 PRO HDy A 49 ARG HA 1.0 . 3.50 2015 1790 A 50 PRO HDx A 19 LEU HDy% 1.0 . 4.77 2016 1791 A 7 VAL HGy% A 96 PRO HDy 1.0 . 5.50 2017 1792 A 56 VAL H A 57 PRO HDy 1.0 . 5.08 2018 1793 A 50 PRO HDx A 49 ARG HA 1.0 . 3.61 2019 1794 A 57 PRO HDy A 56 VAL HGx% 1.0 . 4.08 2020 1795 A 56 VAL H A 57 PRO HDx 1.0 . 4.95 2021 1796 A 58 GLY H A 57 PRO HDx 1.0 . 5.47 2022 1797 A 48 PRO HDy A 47 ILE HA 1.0 . 3.35 2023 1798 A 48 PRO HDx A 47 ILE HA 1.0 . 3.39 2024 1799 A 48 PRO HDx A 63 PHE HD% 1.0 . 4.45 2025 1800 A 15 LEU H A 16 PRO HDx 1.0 . 5.12 2026 1801 A 15 LEU HA A 16 PRO HDx 1.0 . 3.11 2027 1802 A 5 THR HG2% A 3 HIS HE1 1.0 . 4.38 2028 1803 A 100 HIS HE1 A 100 HIS HBy 1.0 . 5.33 2029 1804 A 96 PRO HBx A 100 HIS HE1 1.0 . 4.29 2030 1805 A 96 PRO HGx A 100 HIS HE1 1.0 . 4.16 2031 1806 A 93 TYR HD% A 4 PRO HBx 1.0 . 5.46 2032 1807 A 93 TYR HD% A 93 TYR H 1.0 . 3.82 2033 1808 A 93 TYR HD% A 8 LEU HDx% 1.0 . 4.23 2034 1809 A 94 CYS H A 93 TYR HD% 1.0 . 4.44 2035 1810 A 93 TYR HD% A 5 THR H 1.0 . 3.53 2036 1811 A 93 TYR HD% A 93 TYR HA 1.0 . 3.55 2037 1812 A 93 TYR HD% A 4 PRO HA 1.0 . 3.87 2038 1813 A 39 TYR HD% A 74 LYS HBy 1.0 . 3.99 2039 1814 A 39 TYR HD% A 39 TYR H 1.0 . 3.42 2040 1815 A 39 TYR HD% A 36 CYS HA 1.0 . 2.94 2041 1816 A 39 TYR HD% A 38 LYS HA 1.0 . 4.76 2042 1817 A 39 TYR HD% A 74 LYS HBx 1.0 . 3.62 2043 1818 A 39 TYR HD% A 75 ALA HB% 1.0 . 3.66 2044 1819 A 19 LEU HA A 25 TYR HD% 1.0 . 3.58 2045 1820 A 25 TYR HD% A 19 LEU HBx 1.0 . 3.78 2046 1821 A 25 TYR HD% A 19 LEU HDx% 1.0 . 2.97 2047 1822 A 29 VAL HGy% A 25 TYR HD% 1.0 . 4.19 2048 1823 A 25 TYR HD% A 26 GLU H 1.0 . 3.67 2049 1824 A 25 TYR HD% A 25 TYR HA 1.0 . 3.33 2050 1825 A 66 PHE HD% A 66 PHE H 1.0 . 3.32 2051 1826 A 66 PHE HD% A 67 THR H 1.0 . 4.18 2052 1827 A 66 PHE HD% A 66 PHE HA 1.0 . 3.51 2053 1828 A 66 PHE HD% A 72 CYS HBx 1.0 . 3.74 2054 1829 A 66 PHE HD% A 41 LEU H 1.0 . 4.80 2055 1830 A 42 VAL HB A 66 PHE HD% 1.0 . 5.16 2056 1831 A 64 VAL HGy% A 66 PHE HD% 1.0 . 4.42 2057 1832 A 66 PHE HD% A 8 LEU HBy 1.0 . 4.62 2058 1833 A 66 PHE HD% A 65 GLU HA 1.0 . 3.71 2059 1834 A 85 ALA H A 84 PHE HD% 1.0 . 4.52 2060 1835 A 84 PHE H A 84 PHE HD% 1.0 . 3.74 2061 1836 A 84 PHE HD% A 84 PHE HA 1.0 . 3.55 2062 1837 A 89 VAL HGy% A 84 PHE HD% 1.0 . 3.35 2063 1838 A 99 TYR H A 99 TYR HD% 1.0 . 4.26 2064 1839 A 65 GLU HGy A 99 TYR HD% 1.0 . 4.92 2065 1840 A 7 VAL HGy% A 99 TYR HD% 1.0 . 3.64 2066 1841 A 99 TYR HA A 99 TYR HD% 1.0 . 3.51 2067 1842 A 83 LYS HA A 84 PHE HD% 1.0 . 4.64 2068 1843 A 82 ARG HBy A 84 PHE HD% 1.0 . 3.98 2069 1844 A 100 HIS H A 99 TYR HD% 1.0 . 4.16 2070 1845 A 7 VAL HGx% A 99 TYR HD% 1.0 . 3.47 2071 1846 A 70 PHE HDx A 70 PHE HA 1.0 . 3.50 2072 1847 A 70 PHE HDx A 70 PHE HBx 1.0 . 3.21 2073 1847 A 70 PHE HBy A 70 PHE HDx 1.0 . 3.21 2074 1848 A 70 PHE HDy A 70 PHE HBx 1.0 . 3.54 2075 1848 A 70 PHE HBy A 70 PHE HDy 1.0 . 3.54 2076 1849 A 70 PHE HE% A 70 PHE HDy 1.0 . 2.40 2077 1850 A 69 VAL HB A 70 PHE HDy 1.0 . 4.44 2078 1851 A 48 PRO HDy A 63 PHE HE% 1.0 . 5.31 2079 1852 A 62 ILE HA A 63 PHE HE% 1.0 . 4.59 2080 1853 A 62 ILE HA A 63 PHE HD% 1.0 . 4.93 2081 1854 A 48 PRO HDy A 63 PHE HD% 1.0 . 5.02 2082 1855 A 63 PHE HA A 63 PHE HE% 1.0 . 5.41 2083 1856 A 63 PHE HD% A 47 ILE HA 1.0 . 5.22 2084 1857 A 63 PHE HD% A 46 GLU HBy 1.0 . 4.61 2085 1858 A 63 PHE H A 63 PHE HE% 1.0 . 4.32 2086 1859 A 48 PRO HDx A 63 PHE HE% 1.0 . 4.92 2087 1860 A 7 VAL HGx% A 63 PHE HD% 1.0 . 4.38 2088 1861 A 36 CYS HA A 84 PHE HE% 1.0 . 5.13 2089 1862 A 82 ARG HBy A 84 PHE HE% 1.0 . 3.70 2090 1863 A 104 PHE HD% A 104 PHE H 1.0 . 3.98 2091 1864 A 104 PHE HD% A 104 PHE HA 1.0 . 3.18 2092 1865 A 36 CYS HBx A 84 PHE HE% 1.0 . 3.83 2093 1866 A 104 PHE HD% A 99 TYR HA 1.0 . 4.52 2094 1867 A 104 PHE HD% A 58 GLY HAy 1.0 . 5.44 2095 1868 A 104 PHE HE% A 102 ARG HA 1.0 . 3.66 2096 1869 A 104 PHE HE% A 99 TYR HA 1.0 . 3.91 2097 1870 A 104 PHE HE% A 102 ARG HGx 1.0 . 4.59 2098 1871 A 69 VAL HB A 70 PHE HE% 1.0 . 4.78 2099 1872 A 58 GLY HAy A 63 PHE HZ 1.0 . 5.29 2100 1873 A 61 LYS HBx A 63 PHE HZ 1.0 . 5.41 2101 1874 A 104 PHE HA A 63 PHE HZ 1.0 . 4.59 2102 1875 A 104 PHE HBy A 63 PHE HZ 1.0 . 4.11 2103 1876 A 61 LYS HBy A 63 PHE HZ 1.0 . 4.84 2104 1877 A 63 PHE HZ A 61 LYS HDx 1.0 . 3.84 2105 1877 A 61 LYS HDy A 63 PHE HZ 1.0 . 3.84 2106 1878 A 36 CYS HA A 84 PHE HZ 1.0 . 4.43 2107 1879 A 36 CYS HBx A 84 PHE HZ 1.0 . 3.50 2108 1880 A 102 ARG H A 104 PHE HZ 1.0 . 5.27 2109 1881 A 102 ARG HA A 104 PHE HZ 1.0 . 3.76 2110 1882 A 102 ARG HGx A 104 PHE HZ 1.0 . 5.33 2111 1883 A 102 ARG HBx A 104 PHE HZ 1.0 . 4.58 2112 1884 A 99 TYR HA A 104 PHE HZ 1.0 . 5.00 2113 1885 A 105 TRP HA A 105 TRP HD1 1.0 . 3.82 2114 1886 A 5 THR HG2% A 3 HIS HD2 1.0 . 3.69 2115 1887 A 100 HIS H A 100 HIS HD2 1.0 . 4.24 2116 1888 A 99 TYR HD% A 100 HIS HD2 1.0 . 4.04 2117 1889 A 100 HIS HD2 A 100 HIS HA 1.0 . 3.50 2118 1890 A 100 HIS HBx A 100 HIS HD2 1.0 . 3.81 2119 1891 A 73 GLN H A 93 TYR HE% 1.0 . 4.60 2120 1892 A 93 TYR HE% A 5 THR H 1.0 . 4.00 2121 1893 A 73 GLN HA A 93 TYR HE% 1.0 . 3.92 2122 1894 A 93 TYR HE% A 4 PRO HBy 1.0 . 3.82 2123 1895 A 93 TYR HE% A 8 LEU HDx% 1.0 . 4.45 2124 1896 A 93 TYR HE% A 4 PRO HBx 1.0 . 5.23 2125 1897 A 39 TYR HE% A 39 TYR H 1.0 . 4.78 2126 1898 A 63 PHE H A 99 TYR HE% 1.0 . 4.44 2127 1899 A 45 ILE HA A 99 TYR HE% 1.0 . 5.23 2128 1900 A 65 GLU H A 99 TYR HE% 1.0 . 4.61 2129 1901 A 99 TYR HE% A 100 HIS HD2 1.0 . 4.66 2130 1902 A 63 PHE HBy A 99 TYR HE% 1.0 . 3.43 2131 1903 A 63 PHE HBx A 99 TYR HE% 1.0 . 3.62 2132 1904 A 36 CYS HA A 39 TYR HE% 1.0 . 4.06 2133 1905 A 39 TYR HE% A 78 GLY HAy 1.0 . 3.86 2134 1906 A 39 TYR HE% A 78 GLY HAx 1.0 . 3.86 2135 1907 A 39 TYR HE% A 75 ALA HA 1.0 . 4.17 2136 1908 A 39 TYR HE% A 79 LEU HG 1.0 . 3.58 2137 1909 A 65 GLU HBx A 99 TYR HE% 1.0 . 3.88 2138 1910 A 7 VAL HGy% A 99 TYR HE% 1.0 . 4.41 2139 1911 A 46 GLU H A 99 TYR HE% 1.0 . 4.04 2140 1912 A 65 GLU HGy A 99 TYR HE% 1.0 . 4.30 2141 1913 A 7 VAL HGx% A 99 TYR HE% 1.0 . 4.02 2142 1914 A 47 ILE H A 25 TYR HE% 1.0 . 4.43 2143 1915 A 49 ARG HDx A 25 TYR HE% 1.0 . 4.21 2144 1916 A 25 TYR HE% A 49 ARG HDy 1.0 . 3.97 2145 1917 A 47 ILE HB A 25 TYR HE% 1.0 . 3.27 2146 1918 A 25 TYR HE% A 47 ILE HG2% 1.0 . 2.90 2147 1919 A 29 VAL HGy% A 25 TYR HE% 1.0 . 3.55 2148 1920 A 26 GLU HA A 25 TYR HE% 1.0 . 5.14 stop_ save_