data_nef_c19851_2mmb 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 2MMB 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 THR middle . . 3 A 3 ASP middle . . 4 A 4 PHE middle . . 5 A 5 GLY middle . false 6 A 6 THR middle . . 7 A 7 THR middle . . 8 A 8 ASN middle . . 9 A 9 ASN middle . . 10 A 10 PHE middle . . 11 A 11 VAL middle . . 12 A 12 SER middle . . 13 A 13 PRO middle . false 14 A 14 ASN middle . . 15 A 15 LEU middle . . 16 A 16 GLN middle . . 17 A 17 LEU middle . . 18 A 18 LYS middle . . 19 A 19 GLN middle . . 20 A 20 ASN middle . . 21 A 21 VAL middle . . 22 A 22 LEU middle . . 23 A 23 PRO middle . false 24 A 24 PRO middle . false 25 A 25 THR middle . . 26 A 26 PRO middle . false 27 A 27 LYS middle . . 28 A 28 ASN middle . . 29 A 29 ILE middle . . 30 A 30 PRO middle . false 31 A 31 LEU middle . . 32 A 32 PRO middle . false 33 A 33 ALA middle . . 34 A 34 PHE middle . . 35 A 35 GLY middle . false 36 A 36 GLN middle . . 37 A 37 ARG middle . . 38 A 38 ILE middle . . 39 A 39 ILE middle . . 40 A 40 GLY middle . false 41 A 41 TRP middle . . 42 A 42 GLY middle . false 43 A 43 THR middle . . 44 A 44 GLY middle . false 45 A 45 ALA middle . . 46 A 46 GLU middle . . 47 A 47 GLY middle . false 48 A 48 ALA middle . . 49 A 49 ARG middle . . 50 A 50 GLN middle . . 51 A 51 ARG middle . . 52 A 52 LEU middle . . 53 A 53 GLU middle . . 54 A 54 ASN middle . . 55 A 55 ILE middle . . 56 A 56 GLN middle . . 57 A 57 PRO middle . false 58 A 58 ALA middle . . 59 A 59 ASP middle . . 60 A 60 VAL middle . . 61 A 61 SER middle . . 62 A 62 MET middle . . 63 A 63 ILE middle . . 64 A 64 LYS middle . . 65 A 65 LYS middle . . 66 A 66 GLN middle . . 67 A 67 GLY middle . false 68 A 68 THR middle . . 69 A 69 THR middle . . 70 A 70 LEU middle . . 71 A 71 GLU middle . . 72 A 72 MET middle . . 73 A 73 ILE middle . . 74 A 74 THR middle . . 75 A 75 ALA middle . . 76 A 76 TRP middle . . 77 A 77 GLN middle . . 78 A 78 ASP middle . . 79 A 79 PHE middle . . 80 A 80 TYR middle . . 81 A 81 GLU middle . . 82 A 82 GLN middle . . 83 A 83 GLU middle . . 84 A 84 GLN middle . . 85 A 85 GLN middle . . 86 A 86 ARG middle . . 87 A 87 ASN middle . . 88 A 88 GLU middle . . 89 A 89 ASN middle . . 90 A 90 ASN middle . . 91 A 91 PRO middle . false 92 A 92 THR middle . . 93 A 93 ALA middle . . 94 A 94 LYS middle . . 95 A 95 TYR middle . . 96 A 96 ARG middle . . 97 A 97 ALA middle . . 98 A 98 ARG middle . . 99 A 99 LEU middle . . 100 A 100 MET middle . . 101 A 101 LYS middle . . 102 A 102 LYS middle . . 103 A 103 ILE middle . . 104 A 104 ALA middle . . 105 A 105 ASP middle . . 106 A 106 LEU middle . . 107 A 107 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 3 ASP H H 1 8.326 0.023 A 3 ASP HA H 1 4.499 0.023 A 3 ASP HBx H 1 2.455 0.023 A 3 ASP HBy H 1 2.455 0.023 A 3 ASP CA C 13 51.355 0.148 A 3 ASP CB C 13 38.736 0.148 A 3 ASP N N 15 122.895 0.117 A 4 PHE H H 1 8.265 0.023 A 4 PHE HA H 1 4.503 0.023 A 4 PHE HBy H 1 3.118 0.023 A 4 PHE HBx H 1 2.935 0.023 A 4 PHE HDx H 1 7.249 0.023 A 4 PHE HDy H 1 7.249 0.023 A 4 PHE CA C 13 55.469 0.148 A 4 PHE CB C 13 36.655 0.148 A 4 PHE CD1 C 13 128.911 0.148 A 4 PHE CD2 C 13 128.911 0.148 A 4 PHE N N 15 121.355 0.117 A 5 GLY H H 1 8.349 0.023 A 5 GLY HAx H 1 3.847 0.023 A 5 GLY HAy H 1 3.885 0.023 A 5 GLY CA C 13 42.896 0.148 A 5 GLY N N 15 110.191 0.117 A 6 THR H H 1 7.968 0.023 A 6 THR HA H 1 4.265 0.023 A 6 THR HB H 1 4.182 0.023 A 6 THR HG2% H 1 1.113 0.023 A 6 THR CA C 13 59.242 0.148 A 6 THR CB C 13 67.162 0.148 A 6 THR CG2 C 13 19.205 0.148 A 6 THR N N 15 113.126 0.117 A 7 THR H H 1 8.106 0.023 A 7 THR HA H 1 4.345 0.023 A 7 THR HB H 1 4.188 0.023 A 7 THR HG2% H 1 1.113 0.023 A 7 THR CA C 13 59.138 0.148 A 7 THR CB C 13 67.101 0.148 A 7 THR CG2 C 13 18.947 0.148 A 7 THR N N 15 115.781 0.117 A 8 ASN H H 1 8.349 0.023 A 8 ASN HA H 1 4.565 0.023 A 8 ASN HBx H 1 2.653 0.023 A 8 ASN CA C 13 50.496 0.148 A 8 ASN CB C 13 36.561 0.148 A 8 ASN N N 15 120.804 0.117 A 9 ASN H H 1 8.233 0.023 A 9 ASN HA H 1 4.556 0.023 A 9 ASN HBx H 1 2.552 0.023 A 9 ASN HBy H 1 2.626 0.023 A 9 ASN CA C 13 50.507 0.148 A 9 ASN CB C 13 36.281 0.148 A 9 ASN N N 15 119.053 0.117 A 10 PHE H H 1 8.068 0.023 A 10 PHE HA H 1 4.507 0.023 A 10 PHE HBx H 1 2.945 0.023 A 10 PHE HBy H 1 3.004 0.023 A 10 PHE HDx H 1 7.129 0.023 A 10 PHE HDy H 1 7.129 0.023 A 10 PHE CA C 13 55.142 0.148 A 10 PHE CB C 13 36.800 0.148 A 10 PHE CDy C 13 129.037 0.148 A 10 PHE N N 15 120.473 0.117 A 11 VAL H H 1 7.869 0.023 A 11 VAL HA H 1 3.972 0.023 A 11 VAL HB H 1 1.856 0.023 A 11 VAL HG1% H 1 0.790 0.023 A 11 VAL HG2% H 1 0.778 0.023 A 11 VAL CA C 13 59.148 0.148 A 11 VAL CB C 13 30.496 0.148 A 11 VAL CGx C 13 18.029 0.148 A 11 VAL CGy C 13 18.525 0.148 A 11 VAL N N 15 122.806 0.117 A 12 SER H H 1 8.250 0.023 A 12 SER HA H 1 4.557 0.023 A 12 SER HBx H 1 3.775 0.023 A 12 SER HBy H 1 3.775 0.023 A 12 SER CA C 13 53.586 0.148 A 12 SER CB C 13 60.789 0.148 A 12 SER N N 15 120.860 0.117 A 13 PRO HA H 1 4.319 0.023 A 13 PRO HBy H 1 2.199 0.023 A 13 PRO HBx H 1 1.826 0.023 A 13 PRO HDx H 1 3.708 0.023 A 13 PRO HDy H 1 3.745 0.023 A 13 PRO HGx H 1 1.940 0.023 A 13 PRO HGy H 1 1.940 0.023 A 13 PRO CA C 13 60.905 0.148 A 13 PRO CB C 13 29.546 0.148 A 13 PRO CD C 13 48.164 0.148 A 13 PRO CG C 13 24.685 0.148 A 14 ASN H H 1 8.284 0.023 A 14 ASN HA H 1 4.554 0.023 A 14 ASN HBx H 1 2.640 0.023 A 14 ASN HBy H 1 2.753 0.023 A 14 ASN CA C 13 50.722 0.148 A 14 ASN CB C 13 35.961 0.148 A 14 ASN N N 15 117.629 0.117 A 15 LEU H H 1 8.041 0.023 A 15 LEU HA H 1 4.209 0.023 A 15 LEU HBx H 1 1.505 0.023 A 15 LEU HBy H 1 1.505 0.023 A 15 LEU HD1% H 1 0.769 0.023 A 15 LEU HD2% H 1 0.769 0.023 A 15 LEU HG H 1 1.504 0.023 A 15 LEU CA C 13 52.663 0.148 A 15 LEU CB C 13 39.600 0.148 A 15 LEU CDx C 13 20.849 0.148 A 15 LEU CDy C 13 20.886 0.148 A 15 LEU CG C 13 24.423 0.148 A 15 LEU N N 15 122.501 0.117 A 16 GLN H H 1 8.146 0.023 A 16 GLN HA H 1 4.183 0.023 A 16 GLN HBx H 1 1.890 0.023 A 16 GLN HBy H 1 1.995 0.023 A 16 GLN CA C 13 53.244 0.148 A 16 GLN CB C 13 26.527 0.148 A 16 GLN N N 15 120.254 0.117 A 17 LEU H H 1 7.976 0.023 A 17 LEU HA H 1 4.217 0.023 A 17 LEU HBy H 1 1.547 0.023 A 17 LEU HBx H 1 1.471 0.023 A 17 LEU HD2% H 1 0.832 0.023 A 17 LEU CA C 13 52.481 0.148 A 17 LEU CB C 13 39.694 0.148 A 17 LEU CDy C 13 22.462 0.148 A 17 LEU N N 15 122.662 0.117 A 18 LYS H H 1 8.169 0.023 A 18 LYS HA H 1 4.187 0.023 A 18 LYS HBy H 1 1.717 0.023 A 18 LYS HBx H 1 1.652 0.023 A 18 LYS HGy H 1 1.344 0.023 A 18 LYS HGx H 1 1.295 0.023 A 18 LYS CA C 13 53.535 0.148 A 18 LYS CB C 13 30.348 0.148 A 18 LYS CG C 13 22.198 0.148 A 18 LYS N N 15 121.948 0.117 A 19 GLN H H 1 8.272 0.023 A 19 GLN HA H 1 4.203 0.023 A 19 GLN HBx H 1 1.866 0.023 A 19 GLN HBy H 1 1.970 0.023 A 19 GLN HE2x H 1 6.760 0.023 A 19 GLN HE2y H 1 7.447 0.023 A 19 GLN HGx H 1 2.248 0.023 A 19 GLN HGy H 1 2.248 0.023 A 19 GLN CA C 13 53.093 0.148 A 19 GLN CB C 13 27.149 0.148 A 19 GLN CG C 13 31.241 0.148 A 19 GLN N N 15 121.169 0.117 A 19 GLN NE2 N 15 112.354 0.117 A 20 ASN H H 1 8.444 0.023 A 20 ASN HA H 1 4.608 0.023 A 20 ASN HBy H 1 2.719 0.023 A 20 ASN HBx H 1 2.625 0.023 A 20 ASN HD2y H 1 7.533 0.023 A 20 ASN HD2x H 1 6.752 0.023 A 20 ASN CA C 13 50.577 0.148 A 20 ASN CB C 13 36.198 0.148 A 20 ASN N N 15 120.273 0.117 A 20 ASN ND2 N 15 112.640 0.117 A 21 VAL H H 1 7.904 0.023 A 21 VAL HA H 1 3.973 0.023 A 21 VAL HB H 1 1.916 0.023 A 21 VAL HG1% H 1 0.759 0.023 A 21 VAL HG2% H 1 0.769 0.023 A 21 VAL CA C 13 59.283 0.148 A 21 VAL CB C 13 30.205 0.148 A 21 VAL CGy C 13 18.628 0.148 A 21 VAL CGx C 13 17.863 0.148 A 21 VAL N N 15 120.158 0.117 A 22 LEU H H 1 7.995 0.023 A 22 LEU HA H 1 4.015 0.023 A 22 LEU HBy H 1 1.404 0.023 A 22 LEU HBx H 1 1.196 0.023 A 22 LEU HD1% H 1 0.890 0.023 A 22 LEU HD2% H 1 0.689 0.023 A 22 LEU HG H 1 1.501 0.023 A 22 LEU CA C 13 50.011 0.148 A 22 LEU CB C 13 39.095 0.148 A 22 LEU CDy C 13 23.212 0.148 A 22 LEU CDx C 13 21.219 0.148 A 22 LEU CG C 13 24.640 0.148 A 22 LEU N N 15 126.721 0.117 A 23 PRO HA H 1 4.109 0.023 A 23 PRO HBx H 1 -0.185 0.023 A 23 PRO HBy H 1 1.378 0.023 A 23 PRO HDy H 1 2.555 0.023 A 23 PRO HDx H 1 1.268 0.023 A 23 PRO HGx H 1 -0.112 0.023 A 23 PRO HGy H 1 0.853 0.023 A 23 PRO CA C 13 58.095 0.148 A 23 PRO CB C 13 25.815 0.148 A 23 PRO CD C 13 46.676 0.148 A 23 PRO CG C 13 24.857 0.148 A 24 PRO HA H 1 4.408 0.023 A 24 PRO HBx H 1 2.222 0.023 A 24 PRO HBy H 1 2.222 0.023 A 24 PRO HDy H 1 3.477 0.023 A 24 PRO HDx H 1 3.086 0.023 A 24 PRO HGy H 1 1.836 0.023 A 24 PRO HGx H 1 1.728 0.023 A 24 PRO CA C 13 59.735 0.148 A 24 PRO CB C 13 30.229 0.148 A 24 PRO CD C 13 47.271 0.148 A 24 PRO CG C 13 24.800 0.148 A 25 THR H H 1 7.769 0.023 A 25 THR HA H 1 4.376 0.023 A 25 THR HB H 1 3.693 0.023 A 25 THR HG2% H 1 0.739 0.023 A 25 THR CA C 13 54.848 0.148 A 25 THR CB C 13 65.639 0.148 A 25 THR CG2 C 13 20.184 0.148 A 25 THR N N 15 107.451 0.117 A 26 PRO HA H 1 4.200 0.023 A 26 PRO HBy H 1 2.118 0.023 A 26 PRO HBx H 1 1.844 0.023 A 26 PRO HDy H 1 3.379 0.023 A 26 PRO HDx H 1 3.064 0.023 A 26 PRO HGy H 1 2.022 0.023 A 26 PRO HGx H 1 1.858 0.023 A 26 PRO CA C 13 60.850 0.148 A 26 PRO CB C 13 28.721 0.148 A 26 PRO CD C 13 48.757 0.148 A 26 PRO CG C 13 26.038 0.148 A 27 LYS H H 1 9.020 0.023 A 27 LYS HA H 1 3.793 0.023 A 27 LYS HBx H 1 1.816 0.023 A 27 LYS HBy H 1 1.864 0.023 A 27 LYS HDx H 1 1.612 0.023 A 27 LYS HDy H 1 1.612 0.023 A 27 LYS HEx H 1 2.918 0.023 A 27 LYS HEy H 1 2.918 0.023 A 27 LYS HGy H 1 1.355 0.023 A 27 LYS HGx H 1 1.308 0.023 A 27 LYS CA C 13 54.826 0.148 A 27 LYS CB C 13 27.915 0.148 A 27 LYS CD C 13 26.633 0.148 A 27 LYS CE C 13 39.698 0.148 A 27 LYS CG C 13 22.766 0.148 A 27 LYS N N 15 120.618 0.117 A 28 ASN H H 1 8.160 0.023 A 28 ASN HA H 1 4.217 0.023 A 28 ASN HBy H 1 2.935 0.023 A 28 ASN HBx H 1 2.735 0.023 A 28 ASN HD2y H 1 7.505 0.023 A 28 ASN HD2x H 1 6.821 0.023 A 28 ASN CA C 13 51.505 0.148 A 28 ASN CB C 13 34.951 0.148 A 28 ASN N N 15 112.892 0.117 A 28 ASN ND2 N 15 113.233 0.117 A 29 ILE H H 1 7.285 0.023 A 29 ILE HA H 1 4.379 0.023 A 29 ILE HB H 1 1.923 0.023 A 29 ILE HD1% H 1 0.775 0.023 A 29 ILE HG1x H 1 1.319 0.023 A 29 ILE HG1y H 1 1.376 0.023 A 29 ILE HG2% H 1 0.937 0.023 A 29 ILE CA C 13 57.403 0.148 A 29 ILE CB C 13 34.655 0.148 A 29 ILE CD1 C 13 11.096 0.148 A 29 ILE CG1 C 13 22.688 0.148 A 29 ILE CG2 C 13 14.531 0.148 A 29 ILE N N 15 117.111 0.117 A 30 PRO HA H 1 4.426 0.023 A 30 PRO HBx H 1 1.941 0.023 A 30 PRO HBy H 1 2.449 0.023 A 30 PRO HDx H 1 3.494 0.023 A 30 PRO HDy H 1 3.872 0.023 A 30 PRO HGx H 1 1.996 0.023 A 30 PRO HGy H 1 1.996 0.023 A 30 PRO CA C 13 60.016 0.148 A 30 PRO CB C 13 30.892 0.148 A 30 PRO CD C 13 48.314 0.148 A 30 PRO CG C 13 25.460 0.148 A 31 LEU H H 1 8.796 0.023 A 31 LEU HA H 1 4.178 0.023 A 31 LEU HBx H 1 1.780 0.023 A 31 LEU HBy H 1 1.998 0.023 A 31 LEU HD1% H 1 1.056 0.023 A 31 LEU HD2% H 1 1.030 0.023 A 31 LEU HG H 1 1.831 0.023 A 31 LEU CA C 13 57.424 0.148 A 31 LEU CB C 13 37.034 0.148 A 31 LEU CDy C 13 22.624 0.148 A 31 LEU CDx C 13 22.053 0.148 A 31 LEU CG C 13 25.446 0.148 A 31 LEU N N 15 122.508 0.117 A 32 PRO HA H 1 4.477 0.023 A 32 PRO HBy H 1 2.319 0.023 A 32 PRO HBx H 1 1.818 0.023 A 32 PRO HDy H 1 3.849 0.023 A 32 PRO HDx H 1 3.617 0.023 A 32 PRO HGy H 1 2.074 0.023 A 32 PRO HGx H 1 1.993 0.023 A 32 PRO CA C 13 63.487 0.148 A 32 PRO CB C 13 28.054 0.148 A 32 PRO CD C 13 47.324 0.148 A 32 PRO CG C 13 26.004 0.148 A 33 ALA H H 1 6.783 0.023 A 33 ALA HA H 1 4.105 0.023 A 33 ALA HB% H 1 1.401 0.023 A 33 ALA CA C 13 51.872 0.148 A 33 ALA CB C 13 16.025 0.148 A 33 ALA N N 15 118.864 0.117 A 34 PHE H H 1 8.187 0.023 A 34 PHE HA H 1 3.936 0.023 A 34 PHE HBx H 1 2.828 0.023 A 34 PHE HBy H 1 2.828 0.023 A 34 PHE HDy H 1 6.429 0.023 A 34 PHE HDx H 1 6.346 0.023 A 34 PHE HEx H 1 6.573 0.023 A 34 PHE HEy H 1 6.573 0.023 A 34 PHE CA C 13 57.377 0.148 A 34 PHE CB C 13 36.789 0.148 A 34 PHE CDx C 13 128.179 0.148 A 34 PHE CDy C 13 128.190 0.148 A 34 PHE CEx C 13 125.759 0.148 A 34 PHE CZ C 13 128.174 0.148 A 34 PHE N N 15 119.400 0.117 A 35 GLY H H 1 8.720 0.023 A 35 GLY HAx H 1 1.336 0.023 A 35 GLY HAy H 1 2.853 0.023 A 35 GLY CA C 13 43.276 0.148 A 35 GLY N N 15 104.919 0.117 A 36 GLN H H 1 7.955 0.023 A 36 GLN HA H 1 3.945 0.023 A 36 GLN HBy H 1 1.994 0.023 A 36 GLN HBx H 1 1.929 0.023 A 36 GLN HE2x H 1 6.924 0.023 A 36 GLN HE2y H 1 7.433 0.023 A 36 GLN HGx H 1 2.314 0.023 A 36 GLN HGy H 1 2.413 0.023 A 36 GLN CA C 13 55.346 0.148 A 36 GLN CB C 13 26.736 0.148 A 36 GLN CG C 13 31.734 0.148 A 36 GLN N N 15 117.042 0.117 A 36 GLN NE2 N 15 112.837 0.117 A 37 ARG H H 1 7.996 0.023 A 37 ARG HA H 1 4.207 0.023 A 37 ARG HBx H 1 1.811 0.023 A 37 ARG HBy H 1 1.811 0.023 A 37 ARG HDx H 1 3.053 0.023 A 37 ARG HDy H 1 3.053 0.023 A 37 ARG HGx H 1 1.442 0.023 A 37 ARG HGy H 1 1.549 0.023 A 37 ARG CA C 13 54.545 0.148 A 37 ARG CB C 13 28.249 0.148 A 37 ARG CD C 13 40.795 0.148 A 37 ARG CG C 13 24.879 0.148 A 37 ARG N N 15 115.249 0.117 A 38 ILE H H 1 6.767 0.023 A 38 ILE HA H 1 3.877 0.023 A 38 ILE HB H 1 2.031 0.023 A 38 ILE HD1% H 1 0.802 0.023 A 38 ILE HG1y H 1 1.380 0.023 A 38 ILE HG1x H 1 1.017 0.023 A 38 ILE HG2% H 1 0.681 0.023 A 38 ILE CA C 13 60.262 0.148 A 38 ILE CB C 13 33.914 0.148 A 38 ILE CD1 C 13 10.009 0.148 A 38 ILE CG1 C 13 25.390 0.148 A 38 ILE CG2 C 13 15.204 0.148 A 38 ILE N N 15 116.353 0.117 A 39 ILE H H 1 7.475 0.023 A 39 ILE HA H 1 3.266 0.023 A 39 ILE HB H 1 1.055 0.023 A 39 ILE HD1% H 1 0.113 0.023 A 39 ILE HG1x H 1 -0.223 0.023 A 39 ILE HG1y H 1 -0.223 0.023 A 39 ILE HG2% H 1 0.565 0.023 A 39 ILE CA C 13 57.919 0.148 A 39 ILE CB C 13 31.159 0.148 A 39 ILE CD1 C 13 5.541 0.148 A 39 ILE CG1 C 13 22.768 0.148 A 39 ILE CG2 C 13 16.362 0.148 A 39 ILE N N 15 115.762 0.117 A 40 GLY H H 1 6.846 0.023 A 40 GLY HAx H 1 3.649 0.023 A 40 GLY HAy H 1 3.760 0.023 A 40 GLY CA C 13 44.289 0.148 A 40 GLY N N 15 107.007 0.117 A 41 TRP H H 1 7.572 0.023 A 41 TRP HA H 1 4.232 0.023 A 41 TRP HBx H 1 2.641 0.023 A 41 TRP HBy H 1 3.182 0.023 A 41 TRP HD1 H 1 7.335 0.023 A 41 TRP HE1 H 1 10.321 0.023 A 41 TRP HE3 H 1 7.060 0.023 A 41 TRP HH2 H 1 6.766 0.023 A 41 TRP HZ2 H 1 7.165 0.023 A 41 TRP HZ3 H 1 6.852 0.023 A 41 TRP CA C 13 52.560 0.148 A 41 TRP CB C 13 25.451 0.148 A 41 TRP CD1 C 13 122.981 0.148 A 41 TRP CE3 C 13 116.292 0.148 A 41 TRP CH2 C 13 121.977 0.148 A 41 TRP CZ2 C 13 111.782 0.148 A 41 TRP CZ3 C 13 118.009 0.148 A 41 TRP N N 15 114.542 0.117 A 41 TRP NE1 N 15 132.409 0.117 A 42 GLY H H 1 8.375 0.023 A 42 GLY HAx H 1 3.676 0.023 A 42 GLY HAy H 1 3.801 0.023 A 42 GLY CA C 13 44.292 0.148 A 42 GLY N N 15 110.315 0.117 A 43 THR H H 1 8.545 0.023 A 43 THR HA H 1 4.391 0.023 A 43 THR HB H 1 3.918 0.023 A 43 THR HG2% H 1 1.096 0.023 A 43 THR CA C 13 58.707 0.148 A 43 THR CB C 13 67.765 0.148 A 43 THR CG2 C 13 18.906 0.148 A 43 THR N N 15 116.314 0.117 A 44 GLY H H 1 8.564 0.023 A 44 GLY HAx H 1 3.862 0.023 A 44 GLY HAy H 1 4.011 0.023 A 44 GLY CA C 13 42.359 0.148 A 44 GLY N N 15 111.838 0.117 A 45 ALA H H 1 8.796 0.023 A 45 ALA HA H 1 3.799 0.023 A 45 ALA HB% H 1 1.361 0.023 A 45 ALA CA C 13 53.441 0.148 A 45 ALA CB C 13 16.055 0.148 A 45 ALA N N 15 126.720 0.117 A 46 GLU H H 1 8.852 0.023 A 46 GLU HA H 1 3.853 0.023 A 46 GLU HBx H 1 1.860 0.023 A 46 GLU HBy H 1 1.963 0.023 A 46 GLU HGy H 1 2.253 0.023 A 46 GLU HGx H 1 2.184 0.023 A 46 GLU CA C 13 56.315 0.148 A 46 GLU CB C 13 26.280 0.148 A 46 GLU CG C 13 33.568 0.148 A 46 GLU N N 15 116.146 0.117 A 47 GLY H H 1 7.606 0.023 A 47 GLY HAx H 1 3.685 0.023 A 47 GLY HAy H 1 3.791 0.023 A 47 GLY CA C 13 45.137 0.148 A 47 GLY N N 15 106.444 0.117 A 48 ALA H H 1 7.088 0.023 A 48 ALA HA H 1 3.920 0.023 A 48 ALA HB% H 1 1.252 0.023 A 48 ALA CA C 13 52.505 0.148 A 48 ALA CB C 13 16.520 0.148 A 48 ALA N N 15 124.019 0.117 A 49 ARG H H 1 8.287 0.023 A 49 ARG HA H 1 3.392 0.023 A 49 ARG HBy H 1 1.352 0.023 A 49 ARG HBx H 1 0.524 0.023 A 49 ARG HDx H 1 2.548 0.023 A 49 ARG HDy H 1 2.849 0.023 A 49 ARG HGx H 1 1.022 0.023 A 49 ARG HGy H 1 1.121 0.023 A 49 ARG CA C 13 57.220 0.148 A 49 ARG CB C 13 27.075 0.148 A 49 ARG CD C 13 40.463 0.148 A 49 ARG CG C 13 24.531 0.148 A 49 ARG N N 15 119.400 0.117 A 50 GLN H H 1 8.126 0.023 A 50 GLN HA H 1 3.814 0.023 A 50 GLN HBy H 1 1.967 0.023 A 50 GLN HBx H 1 1.935 0.023 A 50 GLN HE2y H 1 7.487 0.023 A 50 GLN HE2x H 1 6.660 0.023 A 50 GLN HGy H 1 2.392 0.023 A 50 GLN HGx H 1 2.238 0.023 A 50 GLN CA C 13 56.308 0.148 A 50 GLN CB C 13 25.617 0.148 A 50 GLN CG C 13 31.614 0.148 A 50 GLN N N 15 116.877 0.117 A 50 GLN NE2 N 15 112.967 0.117 A 51 ARG H H 1 7.431 0.023 A 51 ARG HA H 1 4.025 0.023 A 51 ARG HBx H 1 1.960 0.023 A 51 ARG HBy H 1 1.960 0.023 A 51 ARG HDy H 1 3.582 0.023 A 51 ARG HDx H 1 2.982 0.023 A 51 ARG HGx H 1 1.111 0.023 A 51 ARG HGy H 1 1.585 0.023 A 51 ARG CA C 13 54.105 0.148 A 51 ARG CB C 13 27.622 0.148 A 51 ARG CD C 13 41.055 0.148 A 51 ARG CG C 13 25.067 0.148 A 51 ARG N N 15 119.277 0.117 A 52 LEU H H 1 8.252 0.023 A 52 LEU HA H 1 3.857 0.023 A 52 LEU HBy H 1 2.243 0.023 A 52 LEU HBx H 1 1.441 0.023 A 52 LEU HD1% H 1 1.021 0.023 A 52 LEU HD2% H 1 0.837 0.023 A 52 LEU HG H 1 1.591 0.023 A 52 LEU CA C 13 55.656 0.148 A 52 LEU CB C 13 39.710 0.148 A 52 LEU CDy C 13 24.554 0.148 A 52 LEU CDx C 13 21.430 0.148 A 52 LEU CG C 13 24.549 0.148 A 52 LEU N N 15 119.687 0.117 A 53 GLU H H 1 7.732 0.023 A 53 GLU HA H 1 3.997 0.023 A 53 GLU HBx H 1 1.918 0.023 A 53 GLU HBy H 1 1.969 0.023 A 53 GLU HGx H 1 2.192 0.023 A 53 GLU HGy H 1 2.379 0.023 A 53 GLU CA C 13 55.478 0.148 A 53 GLU CB C 13 27.372 0.148 A 53 GLU CG C 13 33.976 0.148 A 53 GLU N N 15 114.968 0.117 A 54 ASN H H 1 7.635 0.023 A 54 ASN HA H 1 4.801 0.023 A 54 ASN HBx H 1 2.666 0.023 A 54 ASN HBy H 1 2.837 0.023 A 54 ASN HD2x H 1 6.970 0.023 A 54 ASN HD2y H 1 7.479 0.023 A 54 ASN CA C 13 50.797 0.148 A 54 ASN CB C 13 38.143 0.148 A 54 ASN N N 15 114.649 0.117 A 54 ASN ND2 N 15 112.953 0.117 A 55 ILE H H 1 8.115 0.023 A 55 ILE HA H 1 4.016 0.023 A 55 ILE HB H 1 1.892 0.023 A 55 ILE HD1% H 1 0.762 0.023 A 55 ILE HG1y H 1 1.523 0.023 A 55 ILE HG1x H 1 1.152 0.023 A 55 ILE HG2% H 1 0.679 0.023 A 55 ILE CA C 13 61.076 0.148 A 55 ILE CB C 13 35.546 0.148 A 55 ILE CD1 C 13 13.278 0.148 A 55 ILE CG1 C 13 28.120 0.148 A 55 ILE CG2 C 13 11.797 0.148 A 55 ILE N N 15 124.024 0.117 A 56 GLN H H 1 9.039 0.023 A 56 GLN HA H 1 4.882 0.023 A 56 GLN HBy H 1 2.431 0.023 A 56 GLN HBx H 1 1.759 0.023 A 56 GLN HE2y H 1 7.229 0.023 A 56 GLN HE2x H 1 6.787 0.023 A 56 GLN HGx H 1 2.450 0.023 A 56 GLN HGy H 1 2.578 0.023 A 56 GLN CA C 13 50.392 0.148 A 56 GLN CB C 13 28.064 0.148 A 56 GLN CG C 13 30.502 0.148 A 56 GLN N N 15 125.430 0.117 A 56 GLN NE2 N 15 113.610 0.117 A 57 PRO HA H 1 4.062 0.023 A 57 PRO HBy H 1 2.462 0.023 A 57 PRO HBx H 1 1.926 0.023 A 57 PRO HDy H 1 3.916 0.023 A 57 PRO HDx H 1 3.810 0.023 A 57 PRO HGx H 1 2.262 0.023 A 57 PRO HGy H 1 2.262 0.023 A 57 PRO CA C 13 64.368 0.148 A 57 PRO CB C 13 29.165 0.148 A 57 PRO CD C 13 47.789 0.148 A 57 PRO CG C 13 25.768 0.148 A 58 ALA H H 1 8.669 0.023 A 58 ALA HA H 1 4.053 0.023 A 58 ALA HB% H 1 1.331 0.023 A 58 ALA CA C 13 52.619 0.148 A 58 ALA CB C 13 15.943 0.148 A 58 ALA N N 15 118.399 0.117 A 59 ASP H H 1 7.616 0.023 A 59 ASP HA H 1 4.386 0.023 A 59 ASP HBx H 1 2.536 0.023 A 59 ASP HBy H 1 3.101 0.023 A 59 ASP CA C 13 54.366 0.148 A 59 ASP CB C 13 39.365 0.148 A 59 ASP N N 15 116.481 0.117 A 60 VAL H H 1 7.398 0.023 A 60 VAL HA H 1 3.452 0.023 A 60 VAL HB H 1 2.201 0.023 A 60 VAL HG1% H 1 0.757 0.023 A 60 VAL HG2% H 1 1.014 0.023 A 60 VAL CA C 13 64.085 0.148 A 60 VAL CB C 13 28.588 0.148 A 60 VAL CGx C 13 19.688 0.148 A 60 VAL CGy C 13 21.722 0.148 A 60 VAL N N 15 121.094 0.117 A 61 SER H H 1 7.997 0.023 A 61 SER HA H 1 3.830 0.023 A 61 SER HBx H 1 3.856 0.023 A 61 SER HBy H 1 3.856 0.023 A 61 SER CA C 13 56.262 0.148 A 61 SER CB C 13 59.500 0.148 A 61 SER N N 15 115.365 0.117 A 62 MET H H 1 7.209 0.023 A 62 MET HA H 1 4.212 0.023 A 62 MET HBx H 1 2.193 0.023 A 62 MET HBy H 1 2.193 0.023 A 62 MET HE% H 1 2.002 0.023 A 62 MET HGx H 1 2.585 0.023 A 62 MET HGy H 1 2.620 0.023 A 62 MET CA C 13 55.436 0.148 A 62 MET CB C 13 28.841 0.148 A 62 MET CE C 13 14.368 0.148 A 62 MET CG C 13 29.599 0.148 A 62 MET N N 15 120.082 0.117 A 63 ILE H H 1 7.769 0.023 A 63 ILE HA H 1 3.483 0.023 A 63 ILE HB H 1 2.100 0.023 A 63 ILE HD1% H 1 0.772 0.023 A 63 ILE HG1x H 1 0.869 0.023 A 63 ILE HG1y H 1 1.781 0.023 A 63 ILE HG2% H 1 0.936 0.023 A 63 ILE CA C 13 63.695 0.148 A 63 ILE CB C 13 36.059 0.148 A 63 ILE CD1 C 13 11.377 0.148 A 63 ILE CG1 C 13 27.129 0.148 A 63 ILE CG2 C 13 13.721 0.148 A 63 ILE N N 15 122.971 0.117 A 64 LYS H H 1 8.005 0.023 A 64 LYS HA H 1 4.180 0.023 A 64 LYS HBy H 1 1.640 0.023 A 64 LYS HBx H 1 1.581 0.023 A 64 LYS HDy H 1 1.054 0.023 A 64 LYS HDx H 1 0.932 0.023 A 64 LYS HGx H 1 0.544 0.023 A 64 LYS HGy H 1 0.707 0.023 A 64 LYS CA C 13 57.002 0.148 A 64 LYS CB C 13 30.631 0.148 A 64 LYS CD C 13 27.480 0.148 A 64 LYS CG C 13 22.675 0.148 A 64 LYS N N 15 121.331 0.117 A 65 LYS H H 1 7.779 0.023 A 65 LYS HA H 1 4.045 0.023 A 65 LYS HBx H 1 1.936 0.023 A 65 LYS HBy H 1 1.963 0.023 A 65 LYS HDx H 1 1.596 0.023 A 65 LYS HDy H 1 1.596 0.023 A 65 LYS HEx H 1 2.871 0.023 A 65 LYS HEy H 1 2.871 0.023 A 65 LYS HGy H 1 1.549 0.023 A 65 LYS HGx H 1 1.428 0.023 A 65 LYS CA C 13 56.036 0.148 A 65 LYS CB C 13 29.811 0.148 A 65 LYS CD C 13 26.705 0.148 A 65 LYS CE C 13 39.549 0.148 A 65 LYS CG C 13 22.941 0.148 A 65 LYS N N 15 120.266 0.117 A 66 GLN H H 1 7.385 0.023 A 66 GLN HA H 1 4.312 0.023 A 66 GLN HBy H 1 2.401 0.023 A 66 GLN HBx H 1 1.843 0.023 A 66 GLN HE2y H 1 7.064 0.023 A 66 GLN HE2x H 1 6.823 0.023 A 66 GLN HGx H 1 2.395 0.023 A 66 GLN HGy H 1 2.395 0.023 A 66 GLN CA C 13 52.912 0.148 A 66 GLN CB C 13 26.428 0.148 A 66 GLN CG C 13 31.574 0.148 A 66 GLN N N 15 115.637 0.117 A 66 GLN NE2 N 15 111.828 0.117 A 67 GLY H H 1 7.913 0.023 A 67 GLY HAx H 1 3.726 0.023 A 67 GLY HAy H 1 4.235 0.023 A 67 GLY CA C 13 42.709 0.148 A 67 GLY N N 15 105.429 0.117 A 68 THR H H 1 7.210 0.023 A 68 THR HA H 1 4.477 0.023 A 68 THR HB H 1 3.978 0.023 A 68 THR HG2% H 1 1.415 0.023 A 68 THR CA C 13 60.488 0.148 A 68 THR CB C 13 65.980 0.148 A 68 THR CG2 C 13 20.106 0.148 A 68 THR N N 15 115.943 0.117 A 69 THR H H 1 7.841 0.023 A 69 THR HA H 1 5.027 0.023 A 69 THR HB H 1 4.712 0.023 A 69 THR HG2% H 1 1.279 0.023 A 69 THR CA C 13 56.692 0.148 A 69 THR CB C 13 68.864 0.148 A 69 THR CG2 C 13 19.288 0.148 A 69 THR N N 15 116.877 0.117 A 70 LEU H H 1 8.681 0.023 A 70 LEU HA H 1 2.697 0.023 A 70 LEU HBy H 1 1.309 0.023 A 70 LEU HBx H 1 0.201 0.023 A 70 LEU HD1% H 1 0.200 0.023 A 70 LEU HD2% H 1 0.602 0.023 A 70 LEU HG H 1 1.131 0.023 A 70 LEU CA C 13 54.402 0.148 A 70 LEU CB C 13 37.619 0.148 A 70 LEU CDx C 13 18.445 0.148 A 70 LEU CDy C 13 22.772 0.148 A 70 LEU CG C 13 23.522 0.148 A 70 LEU N N 15 124.543 0.117 A 71 GLU H H 1 8.427 0.023 A 71 GLU HA H 1 3.852 0.023 A 71 GLU HBx H 1 1.776 0.023 A 71 GLU HBy H 1 1.918 0.023 A 71 GLU HGy H 1 2.241 0.023 A 71 GLU HGx H 1 2.131 0.023 A 71 GLU CA C 13 57.071 0.148 A 71 GLU CB C 13 26.188 0.148 A 71 GLU CG C 13 34.453 0.148 A 71 GLU N N 15 116.996 0.117 A 72 MET H H 1 7.541 0.023 A 72 MET HA H 1 3.938 0.023 A 72 MET HBy H 1 2.687 0.023 A 72 MET HBx H 1 2.394 0.023 A 72 MET HE% H 1 2.029 0.023 A 72 MET HGx H 1 1.954 0.023 A 72 MET HGy H 1 1.954 0.023 A 72 MET CA C 13 57.253 0.148 A 72 MET CB C 13 30.786 0.148 A 72 MET CE C 13 15.432 0.148 A 72 MET CG C 13 29.974 0.148 A 72 MET N N 15 118.990 0.117 A 73 ILE H H 1 7.459 0.023 A 73 ILE HA H 1 3.878 0.023 A 73 ILE HB H 1 2.165 0.023 A 73 ILE HD1% H 1 0.761 0.023 A 73 ILE HG1x H 1 1.083 0.023 A 73 ILE HG1y H 1 1.642 0.023 A 73 ILE HG2% H 1 0.933 0.023 A 73 ILE CA C 13 59.377 0.148 A 73 ILE CB C 13 32.494 0.148 A 73 ILE CD1 C 13 7.157 0.148 A 73 ILE CG1 C 13 23.671 0.148 A 73 ILE CG2 C 13 16.838 0.148 A 73 ILE N N 15 118.857 0.117 A 74 THR H H 1 8.767 0.023 A 74 THR HA H 1 3.917 0.023 A 74 THR HB H 1 4.128 0.023 A 74 THR HG2% H 1 1.102 0.023 A 74 THR CA C 13 63.010 0.148 A 74 THR CB C 13 65.678 0.148 A 74 THR CG2 C 13 19.160 0.148 A 74 THR N N 15 112.473 0.117 A 75 ALA H H 1 7.851 0.023 A 75 ALA HA H 1 4.218 0.023 A 75 ALA HB% H 1 1.391 0.023 A 75 ALA CA C 13 52.488 0.148 A 75 ALA CB C 13 16.007 0.148 A 75 ALA N N 15 125.668 0.117 A 76 TRP H H 1 8.522 0.023 A 76 TRP HA H 1 4.281 0.023 A 76 TRP HBy H 1 3.660 0.023 A 76 TRP HBx H 1 3.530 0.023 A 76 TRP HD1 H 1 7.434 0.023 A 76 TRP HE1 H 1 9.215 0.023 A 76 TRP HE3 H 1 7.603 0.023 A 76 TRP HH2 H 1 6.882 0.023 A 76 TRP HZ2 H 1 6.900 0.023 A 76 TRP HZ3 H 1 6.583 0.023 A 76 TRP CA C 13 59.146 0.148 A 76 TRP CB C 13 27.353 0.148 A 76 TRP CD1 C 13 124.762 0.148 A 76 TRP CE3 C 13 116.875 0.148 A 76 TRP CH2 C 13 121.870 0.148 A 76 TRP CZ2 C 13 112.438 0.148 A 76 TRP CZ3 C 13 119.407 0.148 A 76 TRP N N 15 121.447 0.117 A 76 TRP NE1 N 15 129.062 0.117 A 77 GLN H H 1 8.879 0.023 A 77 GLN HA H 1 3.887 0.023 A 77 GLN HBx H 1 2.172 0.023 A 77 GLN HBy H 1 2.360 0.023 A 77 GLN HE2y H 1 7.583 0.023 A 77 GLN HE2x H 1 6.259 0.023 A 77 GLN HGx H 1 2.168 0.023 A 77 GLN HGy H 1 2.460 0.023 A 77 GLN CA C 13 58.324 0.148 A 77 GLN CB C 13 25.784 0.148 A 77 GLN CG C 13 29.977 0.148 A 77 GLN N N 15 122.113 0.117 A 77 GLN NE2 N 15 108.251 0.117 A 78 ASP H H 1 8.221 0.023 A 78 ASP HA H 1 4.273 0.023 A 78 ASP HBy H 1 2.739 0.023 A 78 ASP HBx H 1 2.589 0.023 A 78 ASP CA C 13 54.837 0.148 A 78 ASP CB C 13 38.655 0.148 A 78 ASP N N 15 118.194 0.117 A 79 PHE H H 1 8.071 0.023 A 79 PHE HA H 1 3.950 0.023 A 79 PHE HBy H 1 2.988 0.023 A 79 PHE HBx H 1 2.775 0.023 A 79 PHE HDx H 1 6.332 0.023 A 79 PHE HDy H 1 6.332 0.023 A 79 PHE HEx H 1 6.908 0.023 A 79 PHE HEy H 1 6.908 0.023 A 79 PHE HZ H 1 7.030 0.023 A 79 PHE CA C 13 58.983 0.148 A 79 PHE CB C 13 37.203 0.148 A 79 PHE CDy C 13 128.763 0.148 A 79 PHE CDx C 13 128.760 0.148 A 79 PHE CEx C 13 128.683 0.148 A 79 PHE CEy C 13 128.683 0.148 A 79 PHE CZ C 13 127.200 0.148 A 79 PHE N N 15 119.860 0.117 A 80 TYR H H 1 8.284 0.023 A 80 TYR HA H 1 4.266 0.023 A 80 TYR HBy H 1 3.645 0.023 A 80 TYR HBx H 1 2.650 0.023 A 80 TYR HDx H 1 7.159 0.023 A 80 TYR HDy H 1 7.159 0.023 A 80 TYR HEx H 1 7.066 0.023 A 80 TYR HEy H 1 7.066 0.023 A 80 TYR CA C 13 60.764 0.148 A 80 TYR CB C 13 35.105 0.148 A 80 TYR CDx C 13 129.496 0.148 A 80 TYR CDy C 13 129.496 0.148 A 80 TYR CEx C 13 116.869 0.148 A 80 TYR CEy C 13 116.869 0.148 A 80 TYR N N 15 117.578 0.117 A 81 GLU H H 1 8.886 0.023 A 81 GLU HA H 1 4.018 0.023 A 81 GLU HBy H 1 2.232 0.023 A 81 GLU HBx H 1 1.923 0.023 A 81 GLU HGy H 1 2.596 0.023 A 81 GLU HGx H 1 2.171 0.023 A 81 GLU CA C 13 57.254 0.148 A 81 GLU CB C 13 26.468 0.148 A 81 GLU CG C 13 35.015 0.148 A 81 GLU N N 15 122.971 0.117 A 82 GLN H H 1 8.268 0.023 A 82 GLN HA H 1 3.907 0.023 A 82 GLN HBx H 1 1.928 0.023 A 82 GLN HBy H 1 1.974 0.023 A 82 GLN HE2y H 1 7.376 0.023 A 82 GLN HE2x H 1 6.707 0.023 A 82 GLN HGx H 1 2.264 0.023 A 82 GLN HGy H 1 2.388 0.023 A 82 GLN CA C 13 56.117 0.148 A 82 GLN CB C 13 25.399 0.148 A 82 GLN CG C 13 31.641 0.148 A 82 GLN N N 15 119.419 0.117 A 82 GLN NE2 N 15 111.483 0.117 A 83 GLU H H 1 7.844 0.023 A 83 GLU HA H 1 3.827 0.023 A 83 GLU HBx H 1 1.892 0.023 A 83 GLU HBy H 1 1.892 0.023 A 83 GLU HGx H 1 1.743 0.023 A 83 GLU HGy H 1 1.822 0.023 A 83 GLU CA C 13 56.318 0.148 A 83 GLU CB C 13 27.135 0.148 A 83 GLU CG C 13 33.759 0.148 A 83 GLU N N 15 120.274 0.117 A 84 GLN H H 1 8.003 0.023 A 84 GLN HA H 1 4.061 0.023 A 84 GLN HBx H 1 2.026 0.023 A 84 GLN HBy H 1 2.026 0.023 A 84 GLN HE2x H 1 6.735 0.023 A 84 GLN HE2y H 1 7.115 0.023 A 84 GLN HGy H 1 2.392 0.023 A 84 GLN HGx H 1 2.253 0.023 A 84 GLN CA C 13 55.255 0.148 A 84 GLN CB C 13 26.041 0.148 A 84 GLN CG C 13 31.427 0.148 A 84 GLN N N 15 118.521 0.117 A 84 GLN NE2 N 15 109.824 0.117 A 85 GLN H H 1 7.384 0.023 A 85 GLN HA H 1 3.994 0.023 A 85 GLN HBy H 1 2.062 0.023 A 85 GLN HBx H 1 2.010 0.023 A 85 GLN HE2x H 1 6.704 0.023 A 85 GLN HE2y H 1 7.320 0.023 A 85 GLN HGy H 1 2.395 0.023 A 85 GLN HGx H 1 2.296 0.023 A 85 GLN CA C 13 54.696 0.148 A 85 GLN CB C 13 26.070 0.148 A 85 GLN CG C 13 31.473 0.148 A 85 GLN N N 15 116.641 0.117 A 85 GLN NE2 N 15 111.594 0.117 A 86 ARG H H 1 7.470 0.023 A 86 ARG HA H 1 4.110 0.023 A 86 ARG HBx H 1 1.745 0.023 A 86 ARG HBy H 1 1.745 0.023 A 86 ARG HDx H 1 3.053 0.023 A 86 ARG HDy H 1 3.053 0.023 A 86 ARG HGx H 1 1.522 0.023 A 86 ARG HGy H 1 1.604 0.023 A 86 ARG CA C 13 54.776 0.148 A 86 ARG CB C 13 28.497 0.148 A 86 ARG CD C 13 40.894 0.148 A 86 ARG CG C 13 25.240 0.148 A 86 ARG N N 15 117.050 0.117 A 87 ASN H H 1 7.681 0.023 A 87 ASN HA H 1 4.704 0.023 A 87 ASN HBy H 1 2.836 0.023 A 87 ASN HBx H 1 2.625 0.023 A 87 ASN HD2y H 1 7.683 0.023 A 87 ASN HD2x H 1 6.865 0.023 A 87 ASN CA C 13 49.890 0.148 A 87 ASN CB C 13 36.525 0.148 A 87 ASN N N 15 116.526 0.117 A 87 ASN ND2 N 15 112.382 0.117 A 88 GLU H H 1 8.643 0.023 A 88 GLU HA H 1 4.168 0.023 A 88 GLU HBx H 1 1.916 0.023 A 88 GLU HBy H 1 1.984 0.023 A 88 GLU HGx H 1 2.180 0.023 A 88 GLU HGy H 1 2.180 0.023 A 88 GLU CA C 13 54.926 0.148 A 88 GLU CB C 13 26.943 0.148 A 88 GLU CG C 13 33.316 0.148 A 88 GLU N N 15 122.265 0.117 A 89 ASN H H 1 8.245 0.023 A 89 ASN HA H 1 4.689 0.023 A 89 ASN HBx H 1 2.660 0.023 A 89 ASN HBy H 1 2.886 0.023 A 89 ASN HD2y H 1 7.600 0.023 A 89 ASN HD2x H 1 6.871 0.023 A 89 ASN CA C 13 50.572 0.148 A 89 ASN CB C 13 35.698 0.148 A 89 ASN N N 15 117.200 0.117 A 89 ASN ND2 N 15 113.093 0.117 A 90 ASN H H 1 7.639 0.023 A 90 ASN HA H 1 5.020 0.023 A 90 ASN HBy H 1 2.963 0.023 A 90 ASN HBx H 1 2.620 0.023 A 90 ASN HD2x H 1 7.105 0.023 A 90 ASN HD2y H 1 7.812 0.023 A 90 ASN CA C 13 47.733 0.148 A 90 ASN CB C 13 36.130 0.148 A 90 ASN N N 15 117.090 0.117 A 90 ASN ND2 N 15 112.647 0.117 A 91 PRO HA H 1 4.260 0.023 A 91 PRO HBy H 1 2.314 0.023 A 91 PRO HBx H 1 1.942 0.023 A 91 PRO HDy H 1 3.935 0.023 A 91 PRO HDx H 1 3.663 0.023 A 91 PRO HGx H 1 2.003 0.023 A 91 PRO HGy H 1 2.043 0.023 A 91 PRO CA C 13 61.962 0.148 A 91 PRO CB C 13 29.062 0.148 A 91 PRO CD C 13 48.151 0.148 A 91 PRO CG C 13 24.746 0.148 A 92 THR H H 1 7.950 0.023 A 92 THR HA H 1 3.395 0.023 A 92 THR HB H 1 3.988 0.023 A 92 THR HG2% H 1 0.557 0.023 A 92 THR CA C 13 65.540 0.148 A 92 THR CB C 13 64.457 0.148 A 92 THR CG2 C 13 18.156 0.148 A 92 THR N N 15 116.879 0.117 A 93 ALA H H 1 7.308 0.023 A 93 ALA HA H 1 3.566 0.023 A 93 ALA HB% H 1 1.527 0.023 A 93 ALA CA C 13 52.392 0.148 A 93 ALA CB C 13 15.870 0.148 A 93 ALA N N 15 122.220 0.117 A 94 LYS H H 1 7.314 0.023 A 94 LYS HA H 1 3.749 0.023 A 94 LYS HBx H 1 1.534 0.023 A 94 LYS HBy H 1 1.534 0.023 A 94 LYS HDy H 1 1.361 0.023 A 94 LYS HDx H 1 1.304 0.023 A 94 LYS HEy H 1 2.536 0.023 A 94 LYS HEx H 1 2.466 0.023 A 94 LYS HGy H 1 1.142 0.023 A 94 LYS HGx H 1 0.445 0.023 A 94 LYS CA C 13 56.612 0.148 A 94 LYS CB C 13 29.792 0.148 A 94 LYS CD C 13 26.872 0.148 A 94 LYS CE C 13 39.040 0.148 A 94 LYS CG C 13 21.441 0.148 A 94 LYS N N 15 116.634 0.117 A 95 TYR H H 1 7.886 0.023 A 95 TYR HA H 1 4.113 0.023 A 95 TYR HBy H 1 2.684 0.023 A 95 TYR HBx H 1 2.630 0.023 A 95 TYR HDx H 1 7.005 0.023 A 95 TYR HDy H 1 7.005 0.023 A 95 TYR HEx H 1 6.760 0.023 A 95 TYR HEy H 1 6.760 0.023 A 95 TYR CA C 13 59.954 0.148 A 95 TYR CB C 13 36.524 0.148 A 95 TYR CDx C 13 129.701 0.148 A 95 TYR CDy C 13 129.701 0.148 A 95 TYR CEx C 13 115.191 0.148 A 95 TYR CEy C 13 115.191 0.148 A 95 TYR N N 15 114.771 0.117 A 96 ARG H H 1 8.366 0.023 A 96 ARG HA H 1 3.710 0.023 A 96 ARG HBy H 1 1.232 0.023 A 96 ARG HBx H 1 0.236 0.023 A 96 ARG HDy H 1 1.227 0.023 A 96 ARG HDx H 1 0.424 0.023 A 96 ARG HGy H 1 0.641 0.023 A 96 ARG HGx H 1 0.469 0.023 A 96 ARG CA C 13 58.915 0.148 A 96 ARG CB C 13 27.369 0.148 A 96 ARG CD C 13 39.996 0.148 A 96 ARG CG C 13 26.329 0.148 A 96 ARG N N 15 118.985 0.117 A 97 ALA H H 1 8.423 0.023 A 97 ALA HA H 1 4.074 0.023 A 97 ALA HB% H 1 1.538 0.023 A 97 ALA CA C 13 53.945 0.148 A 97 ALA CB C 13 15.576 0.148 A 97 ALA N N 15 121.092 0.117 A 98 ARG H H 1 7.610 0.023 A 98 ARG HA H 1 3.912 0.023 A 98 ARG HBy H 1 1.926 0.023 A 98 ARG HBx H 1 1.822 0.023 A 98 ARG HDx H 1 2.805 0.023 A 98 ARG HDy H 1 3.039 0.023 A 98 ARG HGx H 1 1.691 0.023 A 98 ARG HGy H 1 1.691 0.023 A 98 ARG CA C 13 56.514 0.148 A 98 ARG CB C 13 28.346 0.148 A 98 ARG CD C 13 41.184 0.148 A 98 ARG CG C 13 25.070 0.148 A 98 ARG N N 15 116.714 0.117 A 99 LEU H H 1 8.525 0.023 A 99 LEU HA H 1 4.132 0.023 A 99 LEU HBy H 1 2.272 0.023 A 99 LEU HBx H 1 1.519 0.023 A 99 LEU HD1% H 1 1.012 0.023 A 99 LEU HD2% H 1 0.865 0.023 A 99 LEU HG H 1 1.617 0.023 A 99 LEU CA C 13 55.213 0.148 A 99 LEU CB C 13 38.954 0.148 A 99 LEU CDy C 13 24.818 0.148 A 99 LEU CDx C 13 20.097 0.148 A 99 LEU CG C 13 24.877 0.148 A 99 LEU N N 15 122.848 0.117 A 100 MET H H 1 8.274 0.023 A 100 MET HA H 1 4.429 0.023 A 100 MET HBx H 1 2.326 0.023 A 100 MET HBy H 1 2.326 0.023 A 100 MET HE% H 1 2.199 0.023 A 100 MET HGy H 1 3.441 0.023 A 100 MET HGx H 1 2.895 0.023 A 100 MET CA C 13 54.696 0.148 A 100 MET CB C 13 28.731 0.148 A 100 MET CE C 13 16.682 0.148 A 100 MET CG C 13 29.839 0.148 A 100 MET N N 15 116.911 0.117 A 101 LYS H H 1 7.663 0.023 A 101 LYS HA H 1 3.901 0.023 A 101 LYS HBx H 1 1.710 0.023 A 101 LYS HBy H 1 1.883 0.023 A 101 LYS HDx H 1 1.577 0.023 A 101 LYS HDy H 1 1.706 0.023 A 101 LYS HEx H 1 2.960 0.023 A 101 LYS HEy H 1 2.960 0.023 A 101 LYS HGx H 1 1.386 0.023 A 101 LYS HGy H 1 1.386 0.023 A 101 LYS CA C 13 56.621 0.148 A 101 LYS CB C 13 29.841 0.148 A 101 LYS CD C 13 26.122 0.148 A 101 LYS CE C 13 39.993 0.148 A 101 LYS CG C 13 22.618 0.148 A 101 LYS N N 15 119.105 0.117 A 102 LYS H H 1 7.847 0.023 A 102 LYS HA H 1 4.091 0.023 A 102 LYS HBy H 1 2.066 0.023 A 102 LYS HBx H 1 1.753 0.023 A 102 LYS HDx H 1 1.733 0.023 A 102 LYS HDy H 1 1.733 0.023 A 102 LYS HEx H 1 2.903 0.023 A 102 LYS HEy H 1 2.903 0.023 A 102 LYS HGx H 1 1.298 0.023 A 102 LYS HGy H 1 1.399 0.023 A 102 LYS CA C 13 56.392 0.148 A 102 LYS CB C 13 29.623 0.148 A 102 LYS CD C 13 27.293 0.148 A 102 LYS CE C 13 39.796 0.148 A 102 LYS CG C 13 22.684 0.148 A 102 LYS N N 15 119.568 0.117 A 103 ILE H H 1 8.142 0.023 A 103 ILE HA H 1 3.503 0.023 A 103 ILE HB H 1 2.077 0.023 A 103 ILE HD1% H 1 0.861 0.023 A 103 ILE HG1x H 1 0.715 0.023 A 103 ILE HG1y H 1 1.985 0.023 A 103 ILE HG2% H 1 1.198 0.023 A 103 ILE CA C 13 64.033 0.148 A 103 ILE CB C 13 35.032 0.148 A 103 ILE CD1 C 13 12.029 0.148 A 103 ILE CG1 C 13 28.130 0.148 A 103 ILE CG2 C 13 15.795 0.148 A 103 ILE N N 15 117.815 0.117 A 104 ALA H H 1 8.179 0.023 A 104 ALA HA H 1 3.920 0.023 A 104 ALA HB% H 1 1.384 0.023 A 104 ALA CA C 13 52.816 0.148 A 104 ALA CB C 13 15.191 0.148 A 104 ALA N N 15 120.877 0.117 A 105 ASP H H 1 8.556 0.023 A 105 ASP HA H 1 4.406 0.023 A 105 ASP HBy H 1 3.010 0.023 A 105 ASP HBx H 1 2.639 0.023 A 105 ASP CA C 13 54.142 0.148 A 105 ASP CB C 13 37.859 0.148 A 105 ASP N N 15 119.214 0.117 A 106 LEU H H 1 7.793 0.023 A 106 LEU HA H 1 4.340 0.023 A 106 LEU HBx H 1 1.602 0.023 A 106 LEU HBy H 1 1.933 0.023 A 106 LEU HD1% H 1 0.814 0.023 A 106 LEU HD2% H 1 0.613 0.023 A 106 LEU HG H 1 1.912 0.023 A 106 LEU CA C 13 52.050 0.148 A 106 LEU CB C 13 41.412 0.148 A 106 LEU CDx C 13 20.331 0.148 A 106 LEU CDy C 13 23.007 0.148 A 106 LEU CG C 13 24.367 0.148 A 106 LEU N N 15 120.972 0.117 A 107 TRP H H 1 7.605 0.023 A 107 TRP HA H 1 3.529 0.023 A 107 TRP HBx H 1 3.124 0.023 A 107 TRP HBy H 1 3.530 0.023 A 107 TRP HD1 H 1 7.157 0.023 A 107 TRP HE1 H 1 9.936 0.023 A 107 TRP HE3 H 1 7.357 0.023 A 107 TRP HH2 H 1 6.565 0.023 A 107 TRP HZ2 H 1 7.465 0.023 A 107 TRP HZ3 H 1 6.536 0.023 A 107 TRP CA C 13 59.075 0.148 A 107 TRP CB C 13 28.428 0.148 A 107 TRP CD1 C 13 123.760 0.148 A 107 TRP CE3 C 13 117.567 0.148 A 107 TRP CH2 C 13 121.120 0.148 A 107 TRP CZ2 C 13 112.580 0.148 A 107 TRP CZ3 C 13 118.479 0.148 A 107 TRP N N 15 129.294 0.117 A 107 TRP NE1 N 15 127.538 0.117 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 35 GLY H A 41 TRP HE1 1.0 . 5.22 2 2 A 41 TRP HE1 A 35 GLY HAy 1.0 . 4.00 3 3 A 41 TRP HE1 A 36 GLN HBy 1.0 . 5.50 4 4 A 41 TRP HE1 A 39 ILE HB 1.0 . 4.89 5 5 A 41 TRP HE1 A 36 GLN HGy 1.0 . 5.50 6 6 A 41 TRP HE1 A 35 GLY HAx 1.0 . 4.53 7 7 A 105 ASP H A 107 TRP H 1.0 . 4.62 8 8 A 107 TRP H A 104 ALA HA 1.0 . 3.89 9 9 A 107 TRP H A 107 TRP HBy 1.0 . 2.89 10 10 A 107 TRP H A 107 TRP HBx 1.0 . 3.25 11 11 A 107 TRP H A 106 LEU HBy 1.0 . 4.18 12 12 A 107 TRP H A 60 VAL HG1% 1.0 . 4.64 13 13 A 72 MET HA A 76 TRP HE1 1.0 . 5.50 14 14 A 76 TRP HE1 A 72 MET HBx 1.0 . 5.50 15 15 A 76 TRP HE1 A 26 PRO HDx 1.0 . 5.50 16 16 A 76 TRP HE1 A 75 ALA HB% 1.0 . 5.04 17 17 A 76 TRP HE1 A 23 PRO HBx 1.0 . 4.47 18 18 A 70 LEU H A 107 TRP HE1 1.0 . 4.06 19 19 A 107 TRP HE1 A 69 THR HB 1.0 . 5.48 20 20 A 107 TRP HE1 A 70 LEU HA 1.0 . 5.11 21 21 A 107 TRP HE1 A 70 LEU HBy 1.0 . 4.04 22 22 A 107 TRP HE1 A 70 LEU HBx 1.0 . 3.75 23 23 A 43 THR HG2% A 45 ALA H 1.0 . 5.50 24 24 A 45 ALA H A 47 GLY H 1.0 . 5.50 25 25 A 45 ALA H A 92 THR HA 1.0 . 5.50 26 26 A 45 ALA H A 46 GLU HBy 1.0 . 5.46 27 27 A 45 ALA H A 92 THR HG2% 1.0 . 5.50 28 28 A 22 LEU H A 22 LEU HBy 1.0 . 3.29 29 29 A 22 LEU H A 23 PRO HDy 1.0 . 5.50 30 30 A 22 LEU H A 21 VAL HB 1.0 . 4.19 31 31 A 22 LEU H A 79 PHE HE% 1.0 . 5.50 32 32 A 73 ILE HD1% A 75 ALA H 1.0 . 5.50 33 33 A 75 ALA H A 73 ILE HG2% 1.0 . 5.50 34 34 A 75 ALA H A 74 THR H 1.0 . 3.42 35 35 A 75 ALA H A 73 ILE H 1.0 . 4.95 36 36 A 75 ALA H A 74 THR HB 1.0 . 3.76 37 37 A 75 ALA H A 76 TRP HBy 1.0 . 5.50 38 38 A 75 ALA H A 72 MET HGx 1.0 . 5.50 39 38 A 75 ALA H A 72 MET HGy 1.0 . 5.50 40 39 A 56 GLN H A 59 ASP HBx 1.0 . 3.77 41 40 A 56 GLN H A 56 GLN HBy 1.0 . 3.72 42 41 A 70 LEU H A 71 GLU HA 1.0 . 5.50 43 42 A 70 LEU H A 70 LEU HG 1.0 . 4.66 44 43 A 70 LEU H A 71 GLU H 1.0 . 3.67 45 44 A 70 LEU H A 69 THR HB 1.0 . 3.40 46 45 A 70 LEU H A 71 GLU HBy 1.0 . 5.50 47 46 A 70 LEU H A 70 LEU HBy 1.0 . 3.30 48 47 A 70 LEU H A 70 LEU HBx 1.0 . 3.37 49 48 A 56 GLN H A 55 ILE H 1.0 . 4.64 50 49 A 55 ILE H A 54 ASN H 1.0 . 3.27 51 50 A 55 ILE H A 52 LEU HA 1.0 . 4.76 52 51 A 55 ILE H A 55 ILE HB 1.0 . 3.18 53 52 A 55 ILE H A 55 ILE HG1y 1.0 . 4.58 54 53 A 48 ALA H A 50 GLN H 1.0 . 4.91 55 54 A 48 ALA H A 47 GLY HAy 1.0 . 3.56 56 55 A 48 ALA H A 49 ARG HA 1.0 . 5.39 57 56 A 48 ALA H A 49 ARG HBx 1.0 . 4.97 58 57 A 48 ALA H A 41 TRP HBx 1.0 . 5.33 59 58 A 48 ALA H A 43 THR H 1.0 . 5.26 60 59 A 81 GLU H A 97 ALA H 1.0 . 5.50 61 60 A 81 GLU H A 80 TYR H 1.0 . 3.43 62 61 A 81 GLU H A 81 GLU HBy 1.0 . 3.50 63 62 A 81 GLU H A 81 GLU HBx 1.0 . 3.81 64 63 A 61 SER HA A 63 ILE H 1.0 . 4.83 65 64 A 63 ILE H A 65 LYS HDx 1.0 . 5.39 66 64 A 63 ILE H A 65 LYS HDy 1.0 . 5.39 67 65 A 63 ILE H A 66 GLN H 1.0 . 5.14 68 66 A 63 ILE H A 63 ILE HB 1.0 . 3.31 69 67 A 99 LEU H A 99 LEU HBy 1.0 . 3.41 70 68 A 99 LEU H A 98 ARG HBy 1.0 . 3.84 71 69 A 99 LEU H A 99 LEU HBx 1.0 . 3.40 72 70 A 99 LEU H A 96 ARG HBy 1.0 . 5.50 73 71 A 99 LEU H A 52 LEU HD1% 1.0 . 4.41 74 72 A 99 LEU H A 52 LEU HD2% 1.0 . 4.19 75 73 A 3 ASP H A 4 PHE HD% 1.0 . 5.50 76 74 A 10 PHE HA A 11 VAL H 1.0 . 3.11 77 75 A 11 VAL H A 11 VAL HB 1.0 . 3.82 78 76 A 11 VAL H A 11 VAL HG2% 1.0 . 4.22 79 76 A 11 VAL H A 11 VAL HG1% 1.0 . 4.22 80 77 A 11 VAL H A 10 PHE HD% 1.0 . 5.50 81 78 A 17 LEU H A 15 LEU HD1% 1.0 . 5.21 82 78 A 15 LEU HD2% A 17 LEU H 1.0 . 5.21 83 79 A 17 LEU H A 16 GLN HA 1.0 . 2.99 84 80 A 17 LEU H A 16 GLN HBy 1.0 . 4.55 85 81 A 17 LEU H A 16 GLN HBx 1.0 . 4.61 86 82 A 17 LEU H A 15 LEU HG 1.0 . 3.25 87 83 A 31 LEU H A 33 ALA H 1.0 . 5.50 88 84 A 31 LEU H A 34 PHE HBx 1.0 . 5.50 89 84 A 31 LEU H A 34 PHE HBy 1.0 . 5.50 90 85 A 31 LEU H A 31 LEU HBy 1.0 . 3.45 91 86 A 31 LEU H A 31 LEU HBx 1.0 . 3.47 92 87 A 31 LEU H A 31 LEU HD2% 1.0 . 4.85 93 87 A 31 LEU H A 31 LEU HD1% 1.0 . 4.85 94 88 A 31 LEU H A 22 LEU HD1% 1.0 . 5.50 95 89 A 31 LEU H A 25 THR HG2% 1.0 . 5.50 96 90 A 14 ASN H A 15 LEU H 1.0 . 4.08 97 91 A 15 LEU H A 14 ASN HBy 1.0 . 5.18 98 92 A 15 LEU H A 14 ASN HBx 1.0 . 5.06 99 93 A 15 LEU H A 15 LEU HBx 1.0 . 3.25 100 93 A 15 LEU H A 15 LEU HBy 1.0 . 3.25 101 94 A 15 LEU H A 15 LEU HD1% 1.0 . 5.50 102 94 A 15 LEU HD2% A 15 LEU H 1.0 . 5.50 103 95 A 87 ASN HA A 88 GLU H 1.0 . 3.10 104 96 A 88 GLU H A 87 ASN HBy 1.0 . 4.75 105 97 A 88 GLU H A 87 ASN HBx 1.0 . 4.62 106 98 A 88 GLU H A 88 GLU HBx 1.0 . 3.51 107 99 A 93 ALA H A 96 ARG H 1.0 . 5.50 108 100 A 93 ALA H A 91 PRO HA 1.0 . 5.21 109 101 A 93 ALA H A 90 ASN HBy 1.0 . 5.31 110 102 A 93 ALA H A 90 ASN HBx 1.0 . 5.34 111 103 A 77 GLN H A 97 ALA HA 1.0 . 5.50 112 104 A 77 GLN H A 76 TRP H 1.0 . 3.58 113 105 A 77 GLN H A 78 ASP H 1.0 . 3.66 114 106 A 75 ALA H A 77 GLN H 1.0 . 4.92 115 107 A 77 GLN H A 76 TRP HD1 1.0 . 5.50 116 108 A 76 TRP HBy A 77 GLN H 1.0 . 4.69 117 109 A 77 GLN H A 77 GLN HBy 1.0 . 3.62 118 110 A 77 GLN H A 77 GLN HBx 1.0 . 3.42 119 111 A 75 ALA HB% A 77 GLN H 1.0 . 5.46 120 112 A 77 GLN H A 74 THR HG2% 1.0 . 5.50 121 113 A 73 ILE HG2% A 77 GLN H 1.0 . 5.39 122 114 A 93 ALA H A 90 ASN HA 1.0 . 5.50 123 115 A 93 ALA H A 92 THR HB 1.0 . 3.48 124 116 A 77 GLN H A 79 PHE H 1.0 . 4.71 125 117 A 17 LEU H A 18 LYS H 1.0 . 3.80 126 118 A 18 LYS H A 17 LEU HA 1.0 . 2.87 127 119 A 18 LYS H A 18 LYS HBx 1.0 . 3.47 128 120 A 18 LYS H A 17 LEU HBx 1.0 . 3.99 129 121 A 18 LYS H A 18 LYS HGx 1.0 . 4.23 130 122 A 18 LYS H A 15 LEU HD1% 1.0 . 5.14 131 122 A 15 LEU HD2% A 18 LYS H 1.0 . 5.14 132 123 A 76 TRP H A 77 GLN HBy 1.0 . 5.08 133 124 A 73 ILE HD1% A 76 TRP H 1.0 . 5.50 134 125 A 76 TRP HE1 A 76 TRP H 1.0 . 5.50 135 126 A 76 TRP H A 78 ASP H 1.0 . 4.45 136 127 A 76 TRP H A 79 PHE H 1.0 . 4.84 137 128 A 75 ALA H A 76 TRP H 1.0 . 3.51 138 129 A 76 TRP HBy A 76 TRP H 1.0 . 3.52 139 130 A 76 TRP H A 76 TRP HBx 1.0 . 3.81 140 131 A 4 PHE H A 4 PHE HBx 1.0 . 4.18 141 132 A 4 PHE H A 3 ASP HA 1.0 . 3.47 142 133 A 61 SER HA A 64 LYS H 1.0 . 4.14 143 134 A 64 LYS H A 68 THR HG2% 1.0 . 5.50 144 135 A 64 LYS H A 64 LYS HGx 1.0 . 4.09 145 136 A 63 ILE H A 64 LYS H 1.0 . 3.30 146 137 A 66 GLN H A 64 LYS H 1.0 . 5.04 147 138 A 64 LYS H A 62 MET H 1.0 . 4.75 148 139 A 64 LYS H A 107 TRP HH2 1.0 . 5.50 149 140 A 63 ILE HB A 64 LYS H 1.0 . 3.77 150 141 A 64 LYS H A 65 LYS HBx 1.0 . 4.94 151 142 A 64 LYS H A 64 LYS HDx 1.0 . 3.97 152 143 A 64 LYS H A 64 LYS HGy 1.0 . 3.54 153 144 A 97 ALA H A 98 ARG H 1.0 . 3.61 154 145 A 97 ALA H A 80 TYR HBy 1.0 . 3.89 155 146 A 97 ALA H A 80 TYR HBx 1.0 . 4.16 156 147 A 97 ALA H A 98 ARG HBy 1.0 . 5.49 157 148 A 97 ALA H A 96 ARG HBy 1.0 . 4.69 158 149 A 97 ALA H A 96 ARG HGy 1.0 . 4.66 159 150 A 97 ALA H A 95 TYR H 1.0 . 4.89 160 151 A 97 ALA H A 98 ARG HA 1.0 . 5.26 161 152 A 18 LYS HA A 19 GLN H 1.0 . 2.87 162 153 A 19 GLN H A 19 GLN HGx 1.0 . 4.28 163 153 A 19 GLN H A 19 GLN HGy 1.0 . 4.28 164 154 A 19 GLN H A 18 LYS HBy 1.0 . 4.24 165 155 A 56 GLN H A 60 VAL H 1.0 . 5.41 166 156 A 60 VAL H A 58 ALA H 1.0 . 5.14 167 157 A 60 VAL H A 58 ALA HA 1.0 . 3.94 168 158 A 60 VAL H A 59 ASP HBy 1.0 . 3.93 169 159 A 60 VAL HG1% A 60 VAL H 1.0 . 4.10 170 160 A 102 LYS H A 104 ALA H 1.0 . 4.77 171 161 A 104 ALA H A 100 MET HA 1.0 . 4.83 172 162 A 103 ILE HG2% A 106 LEU H 1.0 . 5.50 173 163 A 104 ALA H A 106 LEU H 1.0 . 5.13 174 164 A 107 TRP H A 106 LEU H 1.0 . 3.34 175 165 A 106 LEU H A 102 LYS HA 1.0 . 4.89 176 166 A 104 ALA HA A 106 LEU H 1.0 . 4.90 177 167 A 106 LEU H A 103 ILE HA 1.0 . 3.86 178 168 A 106 LEU H A 105 ASP HBy 1.0 . 3.95 179 169 A 106 LEU H A 106 LEU HG 1.0 . 3.19 180 170 A 106 LEU H A 106 LEU HBx 1.0 . 3.64 181 171 A 106 LEU H A 104 ALA HB% 1.0 . 4.91 182 172 A 106 LEU H A 106 LEU HD1% 1.0 . 4.27 183 173 A 60 VAL H A 61 SER HBx 1.0 . 4.49 184 173 A 60 VAL H A 61 SER HBy 1.0 . 4.49 185 174 A 7 THR HG2% A 8 ASN H 1.0 . 5.50 186 175 A 11 VAL H A 12 SER H 1.0 . 4.46 187 176 A 12 SER H A 11 VAL HA 1.0 . 2.99 188 177 A 12 SER H A 12 SER HBx 1.0 . 3.41 189 177 A 12 SER H A 12 SER HBy 1.0 . 3.41 190 178 A 12 SER H A 11 VAL HG2% 1.0 . 4.54 191 178 A 11 VAL HG1% A 12 SER H 1.0 . 4.54 192 179 A 104 ALA H A 102 LYS HA 1.0 . 5.50 193 180 A 104 ALA H A 103 ILE HB 1.0 . 3.78 194 181 A 104 ALA H A 103 ILE HG2% 1.0 . 4.64 195 182 A 27 LYS H A 29 ILE HD1% 1.0 . 5.50 196 183 A 8 ASN H A 6 THR HA 1.0 . 3.72 197 184 A 27 LYS H A 26 PRO HBx 1.0 . 3.72 198 185 A 27 LYS H A 27 LYS HGy 1.0 . 4.09 199 186 A 9 ASN H A 10 PHE H 1.0 . 3.98 200 187 A 10 PHE H A 9 ASN HA 1.0 . 3.34 201 188 A 10 PHE H A 10 PHE HBx 1.0 . 3.60 202 189 A 10 PHE H A 11 VAL HG2% 1.0 . 5.50 203 189 A 11 VAL HG1% A 10 PHE H 1.0 . 5.50 204 190 A 10 PHE HD% A 10 PHE H 1.0 . 5.50 205 191 A 19 GLN H A 20 ASN H 1.0 . 4.38 206 192 A 20 ASN H A 19 GLN HA 1.0 . 3.05 207 193 A 20 ASN H A 20 ASN HBx 1.0 . 3.74 208 194 A 20 ASN H A 19 GLN HGx 1.0 . 5.42 209 194 A 19 GLN HGy A 20 ASN H 1.0 . 5.42 210 195 A 20 ASN H A 19 GLN HBy 1.0 . 4.39 211 196 A 20 ASN H A 21 VAL HG2% 1.0 . 5.50 212 197 A 17 LEU H A 16 GLN H 1.0 . 3.45 213 198 A 16 GLN H A 14 ASN HA 1.0 . 5.21 214 199 A 16 GLN H A 15 LEU HA 1.0 . 3.06 215 200 A 16 GLN HBx A 16 GLN H 1.0 . 3.61 216 201 A 16 GLN H A 15 LEU HBx 1.0 . 4.13 217 201 A 15 LEU HBy A 16 GLN H 1.0 . 4.13 218 202 A 81 GLU H A 83 GLU H 1.0 . 5.34 219 203 A 83 GLU H A 82 GLN H 1.0 . 3.74 220 204 A 83 GLU H A 83 GLU HBx 1.0 . 3.12 221 204 A 83 GLU H A 83 GLU HBy 1.0 . 3.12 222 205 A 83 GLU H A 93 ALA HB% 1.0 . 4.97 223 206 A 83 GLU H A 80 TYR HD% 1.0 . 5.50 224 207 A 64 LYS H A 65 LYS H 1.0 . 3.55 225 208 A 62 MET H A 65 LYS H 1.0 . 5.38 226 209 A 65 LYS H A 66 GLN HGx 1.0 . 5.50 227 209 A 65 LYS H A 66 GLN HGy 1.0 . 5.50 228 210 A 65 LYS HBx A 65 LYS H 1.0 . 3.03 229 211 A 65 LYS H A 65 LYS HDx 1.0 . 3.37 230 211 A 65 LYS HDy A 65 LYS H 1.0 . 3.37 231 212 A 64 LYS HDx A 65 LYS H 1.0 . 5.50 232 213 A 65 LYS H A 63 ILE HA 1.0 . 5.27 233 214 A 65 LYS H A 62 MET HBx 1.0 . 5.50 234 214 A 65 LYS H A 62 MET HBy 1.0 . 5.50 235 215 A 14 ASN HBy A 16 GLN H 1.0 . 5.50 236 216 A 20 ASN H A 21 VAL H 1.0 . 3.97 237 217 A 21 VAL H A 20 ASN HBy 1.0 . 4.36 238 218 A 21 VAL HB A 21 VAL H 1.0 . 3.35 239 219 A 62 MET H A 58 ALA HB% 1.0 . 5.50 240 220 A 62 MET H A 61 SER H 1.0 . 3.48 241 221 A 63 ILE H A 62 MET H 1.0 . 3.49 242 222 A 62 MET H A 60 VAL H 1.0 . 4.65 243 223 A 61 SER HA A 62 MET H 1.0 . 3.27 244 224 A 62 MET H A 60 VAL HA 1.0 . 4.52 245 225 A 62 MET H A 62 MET HGx 1.0 . 3.86 246 226 A 62 MET H A 62 MET HBx 1.0 . 3.02 247 226 A 62 MET H A 62 MET HBy 1.0 . 3.02 248 227 A 62 MET H A 65 LYS HBx 1.0 . 5.49 249 228 A 62 MET H A 63 ILE HG1y 1.0 . 5.22 250 229 A 62 MET H A 65 LYS HDx 1.0 . 5.50 251 229 A 65 LYS HDy A 62 MET H 1.0 . 5.50 252 230 A 62 MET H A 64 LYS HDx 1.0 . 5.50 253 231 A 62 MET H A 63 ILE HD1% 1.0 . 5.11 254 232 A 79 PHE H A 79 PHE HD% 1.0 . 4.57 255 233 A 79 PHE H A 79 PHE HBy 1.0 . 3.66 256 234 A 79 PHE H A 23 PRO HGy 1.0 . 5.50 257 235 A 75 ALA HB% A 79 PHE H 1.0 . 5.50 258 236 A 78 ASP H A 79 PHE H 1.0 . 3.81 259 237 A 79 PHE H A 80 TYR HD% 1.0 . 5.50 260 238 A 79 PHE H A 79 PHE HBx 1.0 . 3.42 261 239 A 49 ARG HA A 52 LEU H 1.0 . 4.27 262 240 A 52 LEU H A 52 LEU HBy 1.0 . 3.30 263 241 A 52 LEU H A 52 LEU HBx 1.0 . 3.49 264 242 A 52 LEU HD1% A 52 LEU H 1.0 . 5.03 265 243 A 52 LEU HD2% A 52 LEU H 1.0 . 4.36 266 244 A 102 LYS H A 100 MET HA 1.0 . 5.50 267 245 A 102 LYS H A 103 ILE HA 1.0 . 5.50 268 246 A 105 ASP H A 102 LYS H 1.0 . 5.36 269 247 A 102 LYS H A 103 ILE H 1.0 . 3.66 270 248 A 102 LYS H A 101 LYS H 1.0 . 3.67 271 249 A 102 LYS H A 105 ASP HBy 1.0 . 5.50 272 250 A 102 LYS H A 102 LYS HBy 1.0 . 3.32 273 251 A 102 LYS H A 101 LYS HBy 1.0 . 3.65 274 252 A 102 LYS H A 101 LYS HGx 1.0 . 4.01 275 252 A 102 LYS H A 101 LYS HGy 1.0 . 4.01 276 253 A 52 LEU HD2% A 102 LYS H 1.0 . 4.35 277 254 A 49 ARG H A 49 ARG HGx 1.0 . 4.84 278 255 A 49 ARG HBx A 49 ARG H 1.0 . 3.39 279 256 A 82 GLN H A 80 TYR HA 1.0 . 4.69 280 257 A 82 GLN H A 82 GLN HGy 1.0 . 4.01 281 258 A 82 GLN H A 82 GLN HBx 1.0 . 3.19 282 259 A 30 PRO HBx A 34 PHE H 1.0 . 5.09 283 260 A 50 GLN H A 49 ARG H 1.0 . 3.28 284 261 A 48 ALA H A 49 ARG H 1.0 . 3.43 285 262 A 49 ARG H A 49 ARG HBy 1.0 . 3.32 286 263 A 81 GLU H A 82 GLN H 1.0 . 3.67 287 264 A 35 GLY H A 34 PHE H 1.0 . 3.78 288 265 A 33 ALA H A 34 PHE H 1.0 . 3.53 289 266 A 34 PHE H A 34 PHE HDy 1.0 . 4.74 290 267 A 34 PHE H A 31 LEU HA 1.0 . 4.11 291 268 A 34 PHE H A 34 PHE HBx 1.0 . 3.22 292 268 A 34 PHE HBy A 34 PHE H 1.0 . 3.22 293 269 A 34 PHE H A 29 ILE HG2% 1.0 . 5.27 294 270 A 50 GLN H A 51 ARG H 1.0 . 3.56 295 271 A 51 ARG H A 48 ALA HB% 1.0 . 5.50 296 272 A 51 ARG H A 99 LEU HD2% 1.0 . 5.30 297 273 A 52 LEU H A 51 ARG H 1.0 . 3.52 298 274 A 49 ARG HA A 51 ARG H 1.0 . 5.47 299 275 A 51 ARG H A 51 ARG HBx 1.0 . 2.99 300 275 A 51 ARG H A 51 ARG HBy 1.0 . 2.99 301 276 A 105 ASP H A 104 ALA H 1.0 . 3.51 302 277 A 105 ASP H A 106 LEU H 1.0 . 3.46 303 278 A 105 ASP H A 103 ILE HA 1.0 . 5.05 304 279 A 105 ASP H A 105 ASP HBy 1.0 . 3.27 305 280 A 105 ASP H A 106 LEU HG 1.0 . 4.81 306 281 A 105 ASP H A 102 LYS HBx 1.0 . 5.47 307 282 A 105 ASP H A 106 LEU HD2% 1.0 . 5.50 308 283 A 105 ASP H A 70 LEU HD1% 1.0 . 5.50 309 284 A 51 ARG H A 50 GLN HGy 1.0 . 5.50 310 285 A 51 ARG H A 51 ARG HGy 1.0 . 5.16 311 286 A 105 ASP H A 103 ILE HG2% 1.0 . 5.50 312 287 A 6 THR HA A 9 ASN H 1.0 . 5.50 313 288 A 101 LYS H A 77 GLN HE2x 1.0 . 5.50 314 289 A 101 LYS H A 77 GLN HGy 1.0 . 4.63 315 290 A 101 LYS H A 101 LYS HBy 1.0 . 3.34 316 291 A 101 LYS H A 101 LYS HBx 1.0 . 3.33 317 292 A 101 LYS H A 101 LYS HGx 1.0 . 4.13 318 292 A 101 LYS H A 101 LYS HGy 1.0 . 4.13 319 293 A 101 LYS H A 103 ILE HD1% 1.0 . 5.50 320 294 A 99 LEU H A 101 LYS H 1.0 . 5.14 321 295 A 92 THR HA A 96 ARG H 1.0 . 5.50 322 296 A 96 ARG H A 94 LYS H 1.0 . 5.07 323 297 A 96 ARG H A 41 TRP HE3 1.0 . 5.34 324 298 A 96 ARG H A 95 TYR HBx 1.0 . 3.94 325 299 A 96 ARG HBy A 96 ARG H 1.0 . 3.61 326 300 A 96 ARG H A 96 ARG HGy 1.0 . 4.12 327 301 A 96 ARG H A 96 ARG HGx 1.0 . 3.73 328 302 A 96 ARG H A 96 ARG HBx 1.0 . 4.07 329 303 A 69 THR HA A 72 MET H 1.0 . 5.42 330 304 A 69 THR HB A 72 MET H 1.0 . 4.42 331 305 A 68 THR HG2% A 72 MET H 1.0 . 4.99 332 306 A 72 MET H A 69 THR HG2% 1.0 . 5.18 333 307 A 72 MET H A 73 ILE HG1x 1.0 . 5.49 334 308 A 70 LEU HD1% A 72 MET H 1.0 . 5.50 335 309 A 74 THR H A 72 MET H 1.0 . 5.49 336 310 A 72 MET H A 69 THR H 1.0 . 4.38 337 311 A 72 MET H A 72 MET HBy 1.0 . 3.58 338 312 A 72 MET HBx A 72 MET H 1.0 . 3.44 339 313 A 71 GLU HBy A 72 MET H 1.0 . 3.74 340 314 A 73 ILE HD1% A 72 MET H 1.0 . 5.50 341 315 A 73 ILE H A 107 TRP HH2 1.0 . 5.50 342 316 A 72 MET HBx A 73 ILE H 1.0 . 3.96 343 317 A 73 ILE H A 71 GLU H 1.0 . 5.48 344 318 A 73 ILE H A 73 ILE HG1y 1.0 . 3.71 345 319 A 73 ILE H A 68 THR HG2% 1.0 . 4.92 346 320 A 73 ILE H A 73 ILE HG1x 1.0 . 3.91 347 321 A 33 ALA H A 34 PHE HBx 1.0 . 5.50 348 321 A 33 ALA H A 34 PHE HBy 1.0 . 5.50 349 322 A 33 ALA H A 32 PRO HBx 1.0 . 4.66 350 323 A 33 ALA H A 29 ILE HD1% 1.0 . 5.50 351 324 A 82 GLN H A 84 GLN H 1.0 . 5.48 352 325 A 83 GLU H A 84 GLN H 1.0 . 3.71 353 326 A 84 GLN H A 85 GLN H 1.0 . 3.57 354 327 A 84 GLN H A 84 GLN HGy 1.0 . 4.05 355 328 A 84 GLN H A 84 GLN HBx 1.0 . 3.13 356 328 A 84 GLN H A 84 GLN HBy 1.0 . 3.13 357 329 A 56 GLN H A 58 ALA H 1.0 . 5.50 358 330 A 58 ALA H A 59 ASP HBy 1.0 . 5.50 359 331 A 58 ALA H A 106 LEU HD2% 1.0 . 5.50 360 332 A 58 ALA H A 56 GLN HA 1.0 . 5.22 361 333 A 58 ALA H A 57 PRO HDy 1.0 . 4.35 362 334 A 56 GLN HBy A 58 ALA H 1.0 . 3.74 363 335 A 58 ALA H A 57 PRO HBx 1.0 . 3.82 364 336 A 58 ALA H A 56 GLN HBx 1.0 . 4.32 365 337 A 75 ALA HB% A 78 ASP H 1.0 . 5.50 366 338 A 78 ASP H A 74 THR HG2% 1.0 . 5.50 367 339 A 78 ASP H A 77 GLN HBy 1.0 . 3.61 368 340 A 78 ASP H A 77 GLN HGx 1.0 . 3.79 369 341 A 104 ALA HB% A 103 ILE H 1.0 . 4.98 370 342 A 103 ILE H A 101 LYS H 1.0 . 5.45 371 343 A 103 ILE H A 101 LYS HA 1.0 . 5.40 372 344 A 103 ILE HB A 103 ILE H 1.0 . 3.24 373 345 A 103 ILE H A 102 LYS HBx 1.0 . 4.26 374 346 A 103 ILE H A 103 ILE HG1x 1.0 . 3.90 375 347 A 80 TYR H A 79 PHE H 1.0 . 3.66 376 348 A 14 ASN H A 13 PRO HA 1.0 . 3.20 377 349 A 80 TYR H A 79 PHE HBy 1.0 . 4.03 378 350 A 80 TYR H A 80 TYR HBx 1.0 . 3.36 379 351 A 14 ASN H A 13 PRO HBy 1.0 . 4.61 380 352 A 14 ASN H A 13 PRO HBx 1.0 . 4.42 381 353 A 80 TYR H A 79 PHE HD% 1.0 . 4.53 382 354 A 88 GLU H A 89 ASN H 1.0 . 3.70 383 355 A 89 ASN H A 90 ASN H 1.0 . 3.60 384 356 A 89 ASN H A 89 ASN HBy 1.0 . 3.73 385 357 A 89 ASN H A 89 ASN HBx 1.0 . 3.50 386 358 A 89 ASN H A 88 GLU HBy 1.0 . 4.35 387 359 A 27 LYS H A 29 ILE H 1.0 . 5.50 388 360 A 41 TRP HE1 A 36 GLN H 1.0 . 5.10 389 361 A 35 GLY H A 36 GLN H 1.0 . 3.74 390 362 A 90 ASN H A 89 ASN HA 1.0 . 3.46 391 363 A 90 ASN H A 91 PRO HDx 1.0 . 5.34 392 364 A 90 ASN HBy A 90 ASN H 1.0 . 3.95 393 365 A 90 ASN HBx A 90 ASN H 1.0 . 3.93 394 366 A 83 GLU H A 86 ARG H 1.0 . 5.50 395 367 A 87 ASN HA A 86 ARG H 1.0 . 5.38 396 368 A 86 ARG H A 86 ARG HDx 1.0 . 5.32 397 368 A 86 ARG H A 86 ARG HDy 1.0 . 5.32 398 369 A 86 ARG H A 85 GLN HBx 1.0 . 4.64 399 370 A 86 ARG H A 86 ARG HGy 1.0 . 3.83 400 371 A 29 ILE H A 29 ILE HG1y 1.0 . 3.39 401 372 A 71 GLU H A 72 MET H 1.0 . 3.64 402 373 A 71 GLU H A 69 THR HA 1.0 . 4.50 403 374 A 69 THR HB A 71 GLU H 1.0 . 3.58 404 375 A 71 GLU H A 71 GLU HGx 1.0 . 4.19 405 376 A 71 GLU H A 71 GLU HBy 1.0 . 3.32 406 377 A 70 LEU HBy A 71 GLU H 1.0 . 3.61 407 378 A 70 LEU HG A 71 GLU H 1.0 . 4.54 408 379 A 70 LEU HBx A 71 GLU H 1.0 . 3.92 409 380 A 71 GLU H A 69 THR H 1.0 . 5.36 410 381 A 96 ARG HA A 100 MET H 1.0 . 4.83 411 382 A 34 PHE H A 36 GLN H 1.0 . 5.41 412 383 A 36 GLN HBy A 36 GLN H 1.0 . 3.18 413 384 A 90 ASN HD2y A 92 THR H 1.0 . 5.22 414 385 A 92 THR H A 45 ALA HB% 1.0 . 4.17 415 386 A 69 THR H A 63 ILE HG2% 1.0 . 5.50 416 387 A 84 GLN H A 86 ARG H 1.0 . 5.00 417 388 A 86 ARG H A 85 GLN HGy 1.0 . 5.50 418 389 A 86 ARG H A 86 ARG HBx 1.0 . 3.23 419 389 A 86 ARG H A 86 ARG HBy 1.0 . 3.23 420 390 A 107 TRP HE1 A 71 GLU H 1.0 . 5.50 421 391 A 99 LEU H A 100 MET H 1.0 . 3.72 422 392 A 103 ILE H A 100 MET H 1.0 . 5.20 423 393 A 101 LYS H A 100 MET H 1.0 . 3.73 424 394 A 99 LEU HBy A 100 MET H 1.0 . 3.45 425 395 A 100 MET H A 99 LEU HD1% 1.0 . 5.38 426 396 A 50 GLN H A 50 GLN HBy 1.0 . 3.05 427 397 A 50 GLN H A 49 ARG HBy 1.0 . 3.59 428 398 A 50 GLN H A 49 ARG HGy 1.0 . 4.80 429 399 A 50 GLN H A 49 ARG HBx 1.0 . 4.03 430 400 A 47 GLY H A 50 GLN H 1.0 . 5.50 431 401 A 93 ALA H A 92 THR H 1.0 . 3.34 432 402 A 92 THR HB A 92 THR H 1.0 . 3.05 433 403 A 93 ALA HB% A 92 THR H 1.0 . 4.88 434 404 A 69 THR H A 68 THR H 1.0 . 5.08 435 405 A 69 THR H A 68 THR HB 1.0 . 4.55 436 406 A 70 LEU H A 69 THR H 1.0 . 5.48 437 407 A 72 MET HBx A 69 THR H 1.0 . 3.83 438 408 A 99 LEU H A 98 ARG H 1.0 . 3.60 439 409 A 98 ARG HBy A 98 ARG H 1.0 . 3.22 440 410 A 89 ASN H A 87 ASN H 1.0 . 5.37 441 411 A 87 ASN H A 87 ASN HD2x 1.0 . 5.50 442 412 A 98 ARG H A 98 ARG HGx 1.0 . 3.86 443 412 A 98 ARG H A 98 ARG HGy 1.0 . 3.86 444 413 A 85 GLN H A 85 GLN HGy 1.0 . 3.91 445 414 A 85 GLN H A 84 GLN HBx 1.0 . 3.08 446 414 A 85 GLN H A 84 GLN HBy 1.0 . 3.08 447 415 A 85 GLN H A 86 ARG HBx 1.0 . 5.38 448 415 A 85 GLN H A 86 ARG HBy 1.0 . 5.38 449 416 A 85 GLN H A 86 ARG HGx 1.0 . 4.81 450 417 A 94 LYS H A 84 GLN HGy 1.0 . 5.50 451 418 A 94 LYS H A 84 GLN HE2x 1.0 . 5.50 452 419 A 94 LYS H A 94 LYS HBx 1.0 . 2.97 453 419 A 94 LYS H A 94 LYS HBy 1.0 . 2.97 454 420 A 88 GLU H A 87 ASN H 1.0 . 4.05 455 421 A 84 GLN H A 87 ASN H 1.0 . 5.12 456 422 A 86 ARG H A 87 ASN H 1.0 . 3.35 457 423 A 87 ASN HBy A 87 ASN H 1.0 . 3.89 458 424 A 87 ASN HBx A 87 ASN H 1.0 . 3.79 459 425 A 87 ASN H A 86 ARG HBx 1.0 . 3.69 460 425 A 86 ARG HBy A 87 ASN H 1.0 . 3.69 461 426 A 86 ARG HGy A 87 ASN H 1.0 . 4.73 462 427 A 56 GLN HA A 59 ASP H 1.0 . 5.50 463 428 A 60 VAL HA A 59 ASP H 1.0 . 5.35 464 429 A 92 THR HG2% A 94 LYS H 1.0 . 5.50 465 430 A 90 ASN HBy A 94 LYS H 1.0 . 5.50 466 431 A 61 SER H A 59 ASP H 1.0 . 4.86 467 432 A 56 GLN H A 59 ASP H 1.0 . 4.11 468 433 A 58 ALA H A 59 ASP H 1.0 . 3.67 469 434 A 60 VAL H A 59 ASP H 1.0 . 3.25 470 435 A 59 ASP HBy A 59 ASP H 1.0 . 3.45 471 436 A 38 ILE H A 39 ILE H 1.0 . 3.88 472 437 A 38 ILE H A 38 ILE HG1x 1.0 . 4.54 473 438 A 43 THR H A 42 GLY H 1.0 . 4.67 474 439 A 43 THR HG2% A 43 THR H 1.0 . 4.47 475 440 A 43 THR H A 41 TRP HA 1.0 . 5.50 476 441 A 38 ILE H A 39 ILE HG1x 1.0 . 5.50 477 441 A 38 ILE H A 39 ILE HG1y 1.0 . 5.50 478 442 A 38 ILE H A 37 ARG HBx 1.0 . 4.08 479 442 A 38 ILE H A 37 ARG HBy 1.0 . 4.08 480 443 A 38 ILE H A 39 ILE HD1% 1.0 . 5.50 481 444 A 44 GLY HAy A 46 GLU H 1.0 . 4.36 482 445 A 46 GLU HBy A 46 GLU H 1.0 . 3.23 483 446 A 45 ALA HB% A 46 GLU H 1.0 . 3.68 484 447 A 49 ARG H A 46 GLU H 1.0 . 5.50 485 448 A 48 ALA H A 46 GLU H 1.0 . 4.87 486 449 A 49 ARG HBx A 46 GLU H 1.0 . 5.21 487 450 A 68 THR H A 66 GLN HBy 1.0 . 5.45 488 451 A 68 THR H A 67 GLY H 1.0 . 3.24 489 452 A 68 THR H A 64 LYS HA 1.0 . 3.64 490 453 A 68 THR H A 68 THR HB 1.0 . 3.40 491 454 A 68 THR H A 34 PHE HE% 1.0 . 5.46 492 455 A 8 ASN H A 7 THR H 1.0 . 4.29 493 456 A 39 ILE H A 37 ARG H 1.0 . 5.05 494 457 A 35 GLY HAx A 39 ILE H 1.0 . 4.48 495 458 A 39 ILE H A 39 ILE HG2% 1.0 . 4.79 496 459 A 39 ILE H A 39 ILE HG1x 1.0 . 3.57 497 459 A 39 ILE H A 39 ILE HG1y 1.0 . 3.57 498 460 A 35 GLY HAy A 39 ILE H 1.0 . 5.50 499 461 A 7 THR HG2% A 7 THR H 1.0 . 4.97 500 462 A 39 ILE H A 40 GLY HAx 1.0 . 5.50 501 463 A 39 ILE HB A 39 ILE H 1.0 . 3.65 502 464 A 66 GLN H A 65 LYS H 1.0 . 3.41 503 465 A 66 GLN H A 63 ILE HA 1.0 . 4.61 504 466 A 66 GLN H A 66 GLN HBy 1.0 . 3.53 505 467 A 66 GLN H A 66 GLN HBx 1.0 . 3.36 506 468 A 66 GLN H A 64 LYS HBx 1.0 . 5.20 507 469 A 66 GLN H A 68 THR H 1.0 . 4.18 508 470 A 66 GLN H A 38 ILE HG2% 1.0 . 5.10 509 471 A 58 ALA H A 61 SER H 1.0 . 5.25 510 472 A 60 VAL H A 61 SER H 1.0 . 3.39 511 473 A 58 ALA HA A 61 SER H 1.0 . 3.54 512 474 A 61 SER H A 61 SER HBx 1.0 . 2.83 513 474 A 61 SER HBy A 61 SER H 1.0 . 2.83 514 475 A 37 ARG H A 38 ILE HG1y 1.0 . 4.13 515 476 A 38 ILE H A 37 ARG H 1.0 . 3.45 516 477 A 35 GLY HAy A 37 ARG H 1.0 . 5.50 517 478 A 36 GLN HBy A 37 ARG H 1.0 . 3.70 518 479 A 37 ARG H A 37 ARG HBx 1.0 . 3.37 519 479 A 37 ARG HBy A 37 ARG H 1.0 . 3.37 520 480 A 53 GLU H A 95 TYR HD% 1.0 . 5.50 521 481 A 52 LEU H A 53 GLU H 1.0 . 3.64 522 482 A 52 LEU HBy A 53 GLU H 1.0 . 3.47 523 483 A 53 GLU H A 53 GLU HBx 1.0 . 3.19 524 484 A 53 GLU H A 52 LEU HG 1.0 . 4.50 525 485 A 52 LEU HBx A 53 GLU H 1.0 . 4.09 526 486 A 52 LEU HD2% A 53 GLU H 1.0 . 5.39 527 487 A 53 GLU H A 54 ASN HD2y 1.0 . 5.36 528 488 A 95 TYR H A 96 ARG HBx 1.0 . 5.50 529 489 A 53 GLU H A 54 ASN HA 1.0 . 5.50 530 490 A 96 ARG H A 95 TYR H 1.0 . 3.67 531 491 A 95 TYR H A 94 LYS H 1.0 . 3.53 532 492 A 95 TYR H A 95 TYR HE% 1.0 . 5.20 533 493 A 91 PRO HA A 95 TYR H 1.0 . 4.47 534 494 A 95 TYR H A 93 ALA HA 1.0 . 5.32 535 495 A 92 THR HA A 95 TYR H 1.0 . 4.67 536 496 A 95 TYR H A 95 TYR HBx 1.0 . 3.33 537 497 A 95 TYR H A 91 PRO HBx 1.0 . 5.50 538 498 A 95 TYR H A 94 LYS HBx 1.0 . 3.28 539 498 A 95 TYR H A 94 LYS HBy 1.0 . 3.28 540 499 A 95 TYR H A 48 ALA HB% 1.0 . 4.61 541 500 A 95 TYR H A 94 LYS HGx 1.0 . 4.84 542 501 A 54 ASN H A 53 GLU HGy 1.0 . 5.50 543 502 A 54 ASN H A 55 ILE HD1% 1.0 . 4.90 544 503 A 54 ASN H A 52 LEU H 1.0 . 5.50 545 504 A 54 ASN H A 52 LEU HA 1.0 . 4.84 546 505 A 54 ASN H A 54 ASN HBx 1.0 . 3.85 547 506 A 54 ASN H A 53 GLU HGx 1.0 . 5.23 548 507 A 54 ASN H A 53 GLU HBx 1.0 . 3.57 549 508 A 36 GLN H A 41 TRP H 1.0 . 5.50 550 509 A 41 TRP H A 36 GLN HA 1.0 . 4.25 551 510 A 35 GLY HAy A 41 TRP H 1.0 . 5.50 552 511 A 39 ILE HG2% A 41 TRP H 1.0 . 4.72 553 512 A 39 ILE HB A 41 TRP H 1.0 . 4.27 554 513 A 41 TRP HE1 A 41 TRP H 1.0 . 5.50 555 514 A 55 ILE HA A 56 GLN HE2x 1.0 . 5.50 556 515 A 56 GLN H A 56 GLN HE2x 1.0 . 5.50 557 516 A 56 GLN H A 56 GLN HE2y 1.0 . 5.50 558 517 A 56 GLN HA A 56 GLN HE2y 1.0 . 4.81 559 518 A 55 ILE HA A 56 GLN HE2y 1.0 . 5.50 560 519 A 56 GLN HE2y A 56 GLN HGy 1.0 . 3.74 561 520 A 56 GLN HBx A 56 GLN HE2y 1.0 . 5.26 562 521 A 56 GLN HE2y A 54 ASN HBy 1.0 . 5.50 563 522 A 56 GLN HA A 56 GLN HE2x 1.0 . 5.24 564 523 A 27 LYS HA A 28 ASN HD2x 1.0 . 5.50 565 524 A 27 LYS HGy A 28 ASN HD2x 1.0 . 5.50 566 525 A 88 GLU H A 89 ASN HD2y 1.0 . 5.50 567 526 A 28 ASN H A 28 ASN HD2y 1.0 . 5.50 568 527 A 28 ASN HD2y A 28 ASN HA 1.0 . 5.49 569 528 A 28 ASN HD2y A 28 ASN HBx 1.0 . 3.70 570 529 A 28 ASN HD2x A 28 ASN H 1.0 . 5.50 571 530 A 5 GLY H A 6 THR H 1.0 . 4.39 572 531 A 7 THR H A 6 THR H 1.0 . 4.09 573 532 A 6 THR H A 6 THR HG2% 1.0 . 5.10 574 533 A 6 THR H A 7 THR HA 1.0 . 4.29 575 534 A 89 ASN H A 89 ASN HD2y 1.0 . 5.02 576 535 A 89 ASN HA A 89 ASN HD2y 1.0 . 4.61 577 536 A 89 ASN HBx A 89 ASN HD2y 1.0 . 3.83 578 537 A 27 LYS HGy A 28 ASN HD2y 1.0 . 5.50 579 538 A 88 GLU HBy A 89 ASN HD2x 1.0 . 5.50 580 539 A 52 LEU H A 54 ASN HD2y 1.0 . 5.50 581 540 A 50 GLN HGy A 50 GLN HE2y 1.0 . 3.96 582 541 A 55 ILE H A 54 ASN HD2y 1.0 . 5.50 583 542 A 54 ASN H A 54 ASN HD2y 1.0 . 4.29 584 543 A 54 ASN HD2y A 51 ARG HA 1.0 . 5.12 585 544 A 50 GLN HE2y A 50 GLN HA 1.0 . 5.15 586 545 A 55 ILE H A 54 ASN HD2x 1.0 . 5.50 587 546 A 54 ASN H A 54 ASN HD2x 1.0 . 4.58 588 547 A 54 ASN HA A 54 ASN HD2x 1.0 . 5.50 589 548 A 51 ARG HA A 54 ASN HD2x 1.0 . 5.17 590 549 A 53 GLU HGy A 54 ASN HD2x 1.0 . 5.50 591 550 A 52 LEU HBy A 54 ASN HD2x 1.0 . 5.16 592 551 A 53 GLU HBx A 54 ASN HD2x 1.0 . 5.50 593 552 A 89 ASN H A 89 ASN HD2x 1.0 . 5.50 594 553 A 49 ARG H A 50 GLN HE2x 1.0 . 5.50 595 554 A 50 GLN HBy A 50 GLN HE2x 1.0 . 5.19 596 555 A 27 LYS H A 28 ASN H 1.0 . 3.62 597 556 A 29 ILE H A 28 ASN H 1.0 . 3.57 598 557 A 28 ASN H A 29 ILE HA 1.0 . 4.76 599 558 A 26 PRO HBx A 28 ASN H 1.0 . 5.50 600 559 A 27 LYS HGy A 28 ASN H 1.0 . 4.46 601 560 A 29 ILE HD1% A 28 ASN H 1.0 . 5.50 602 561 A 41 TRP HE1 A 36 GLN HE2y 1.0 . 5.19 603 562 A 36 GLN H A 36 GLN HE2y 1.0 . 5.50 604 563 A 36 GLN HE2y A 41 TRP HZ2 1.0 . 5.39 605 564 A 36 GLN HE2y A 32 PRO HA 1.0 . 5.50 606 565 A 36 GLN HA A 36 GLN HE2y 1.0 . 5.50 607 566 A 36 GLN HBy A 36 GLN HE2y 1.0 . 5.47 608 567 A 43 THR HG2% A 36 GLN HE2y 1.0 . 5.50 609 568 A 36 GLN HBy A 36 GLN HE2x 1.0 . 5.50 610 569 A 36 GLN HE2x A 43 THR HA 1.0 . 5.50 611 570 A 32 PRO HBx A 36 GLN HE2x 1.0 . 5.50 612 571 A 43 THR HG2% A 36 GLN HE2x 1.0 . 5.50 613 572 A 92 THR HB A 90 ASN HD2y 1.0 . 5.50 614 573 A 90 ASN H A 90 ASN HD2y 1.0 . 5.43 615 574 A 90 ASN HA A 90 ASN HD2y 1.0 . 5.50 616 575 A 92 THR HG2% A 90 ASN HD2y 1.0 . 5.50 617 576 A 22 LEU H A 20 ASN HD2y 1.0 . 4.92 618 577 A 21 VAL H A 20 ASN HD2y 1.0 . 4.80 619 578 A 20 ASN HBx A 20 ASN HD2y 1.0 . 3.65 620 579 A 21 VAL HB A 20 ASN HD2y 1.0 . 5.17 621 580 A 20 ASN HD2y A 22 LEU HG 1.0 . 5.50 622 581 A 21 VAL HG2% A 20 ASN HD2y 1.0 . 5.50 623 582 A 92 THR H A 90 ASN HD2x 1.0 . 5.50 624 583 A 92 THR HB A 90 ASN HD2x 1.0 . 5.26 625 584 A 93 ALA HB% A 90 ASN HD2x 1.0 . 4.91 626 585 A 90 ASN HA A 90 ASN HD2x 1.0 . 5.50 627 586 A 73 ILE HD1% A 74 THR H 1.0 . 5.50 628 587 A 90 ASN HD2y A 87 ASN HD2x 1.0 . 5.50 629 588 A 74 THR H A 73 ILE HG1y 1.0 . 5.19 630 589 A 74 THR H A 73 ILE H 1.0 . 3.76 631 590 A 74 THR H A 74 THR HB 1.0 . 3.69 632 591 A 74 THR H A 73 ILE HA 1.0 . 3.54 633 592 A 74 THR H A 73 ILE HB 1.0 . 4.20 634 593 A 75 ALA HB% A 74 THR H 1.0 . 4.86 635 594 A 74 THR H A 74 THR HG2% 1.0 . 3.73 636 595 A 74 THR H A 70 LEU HD1% 1.0 . 4.86 637 596 A 72 MET HBx A 74 THR H 1.0 . 5.50 638 597 A 88 GLU H A 87 ASN HD2y 1.0 . 5.50 639 598 A 89 ASN H A 87 ASN HD2y 1.0 . 5.50 640 599 A 90 ASN HD2x A 87 ASN HD2y 1.0 . 5.50 641 600 A 87 ASN HD2y A 83 GLU HBx 1.0 . 5.50 642 600 A 83 GLU HBy A 87 ASN HD2y 1.0 . 5.50 643 601 A 87 ASN HD2y A 86 ARG HBx 1.0 . 5.46 644 601 A 86 ARG HBy A 87 ASN HD2y 1.0 . 5.46 645 602 A 87 ASN HD2x A 86 ARG HGx 1.0 . 5.50 646 603 A 87 ASN HBx A 87 ASN HD2x 1.0 . 3.89 647 604 A 87 ASN HD2x A 86 ARG HBx 1.0 . 5.50 648 604 A 86 ARG HBy A 87 ASN HD2x 1.0 . 5.50 649 605 A 79 PHE HE% A 20 ASN HD2x 1.0 . 4.17 650 606 A 90 ASN HA A 87 ASN HD2y 1.0 . 5.50 651 607 A 87 ASN HA A 87 ASN HD2y 1.0 . 5.10 652 608 A 19 GLN HA A 19 GLN HE2y 1.0 . 5.50 653 609 A 21 VAL HG2% A 19 GLN HE2y 1.0 . 5.50 654 610 A 87 ASN HD2x A 84 GLN HA 1.0 . 5.50 655 611 A 19 GLN H A 19 GLN HE2x 1.0 . 5.50 656 612 A 19 GLN H A 19 GLN HE2y 1.0 . 5.50 657 613 A 43 THR HG2% A 44 GLY H 1.0 . 4.19 658 614 A 45 ALA H A 44 GLY H 1.0 . 4.66 659 615 A 47 GLY H A 44 GLY H 1.0 . 5.50 660 616 A 64 LYS H A 66 GLN HE2y 1.0 . 5.50 661 617 A 65 LYS H A 66 GLN HE2y 1.0 . 5.18 662 618 A 66 GLN HE2y A 62 MET HA 1.0 . 5.21 663 619 A 66 GLN HE2y A 38 ILE HA 1.0 . 5.17 664 620 A 63 ILE HA A 66 GLN HE2y 1.0 . 4.86 665 621 A 62 MET HGx A 66 GLN HE2y 1.0 . 4.87 666 622 A 66 GLN HE2y A 62 MET HBx 1.0 . 4.82 667 622 A 62 MET HBy A 66 GLN HE2y 1.0 . 4.82 668 623 A 65 LYS HBx A 66 GLN HE2y 1.0 . 4.61 669 624 A 66 GLN HE2y A 38 ILE HD1% 1.0 . 5.33 670 625 A 66 GLN HA A 66 GLN HE2x 1.0 . 5.50 671 626 A 62 MET HA A 66 GLN HE2x 1.0 . 5.50 672 627 A 63 ILE HA A 66 GLN HE2x 1.0 . 5.50 673 628 A 62 MET HGx A 66 GLN HE2x 1.0 . 5.29 674 629 A 66 GLN HE2x A 62 MET HBx 1.0 . 5.50 675 629 A 62 MET HBy A 66 GLN HE2x 1.0 . 5.50 676 630 A 65 LYS HBx A 66 GLN HE2x 1.0 . 5.17 677 631 A 66 GLN HBx A 66 GLN HE2x 1.0 . 5.36 678 632 A 38 ILE HG1y A 66 GLN HE2x 1.0 . 5.50 679 633 A 38 ILE HG1x A 66 GLN HE2x 1.0 . 5.50 680 634 A 38 ILE HD1% A 66 GLN HE2x 1.0 . 5.39 681 635 A 38 ILE HA A 66 GLN HE2x 1.0 . 4.71 682 636 A 66 GLN H A 66 GLN HE2y 1.0 . 4.66 683 637 A 66 GLN HE2y A 66 GLN HA 1.0 . 5.38 684 638 A 66 GLN HBx A 66 GLN HE2y 1.0 . 4.71 685 639 A 65 LYS H A 66 GLN HE2x 1.0 . 5.50 686 640 A 82 GLN HA A 85 GLN HE2y 1.0 . 5.25 687 641 A 85 GLN HE2y A 82 GLN HBy 1.0 . 4.90 688 642 A 86 ARG HGx A 85 GLN HE2y 1.0 . 5.50 689 643 A 82 GLN H A 85 GLN HE2y 1.0 . 5.50 690 644 A 86 ARG H A 85 GLN HE2y 1.0 . 4.60 691 645 A 81 GLU HBy A 82 GLN HE2y 1.0 . 4.06 692 646 A 82 GLN HBx A 82 GLN HE2y 1.0 . 5.08 693 647 A 82 GLN HBx A 82 GLN HE2x 1.0 . 5.21 694 648 A 81 GLU HBy A 82 GLN HE2x 1.0 . 4.46 695 649 A 41 TRP HBx A 42 GLY H 1.0 . 5.50 696 650 A 42 GLY H A 51 ARG HBx 1.0 . 5.05 697 650 A 51 ARG HBy A 42 GLY H 1.0 . 5.05 698 651 A 41 TRP HE1 A 42 GLY H 1.0 . 5.50 699 652 A 42 GLY H A 41 TRP H 1.0 . 3.74 700 653 A 42 GLY H A 41 TRP HBy 1.0 . 5.50 701 654 A 5 GLY H A 6 THR HG2% 1.0 . 5.50 702 655 A 7 THR H A 5 GLY H 1.0 . 5.50 703 656 A 84 GLN HE2x A 94 LYS HGx 1.0 . 5.50 704 657 A 84 GLN H A 84 GLN HE2y 1.0 . 5.50 705 658 A 84 GLN HE2y A 81 GLU HA 1.0 . 4.24 706 659 A 84 GLN HGy A 84 GLN HE2y 1.0 . 3.94 707 660 A 84 GLN HE2y A 84 GLN HBx 1.0 . 5.31 708 660 A 84 GLN HBy A 84 GLN HE2y 1.0 . 5.31 709 661 A 93 ALA HB% A 84 GLN HE2y 1.0 . 4.52 710 662 A 84 GLN HE2y A 94 LYS HDy 1.0 . 5.50 711 663 A 84 GLN HE2y A 94 LYS HGy 1.0 . 5.50 712 664 A 84 GLN HE2x A 94 LYS HDy 1.0 . 5.50 713 665 A 84 GLN HE2x A 81 GLU HA 1.0 . 4.61 714 666 A 93 ALA HA A 84 GLN HE2y 1.0 . 5.50 715 667 A 82 GLN H A 84 GLN HE2x 1.0 . 5.50 716 668 A 102 LYS H A 77 GLN HE2x 1.0 . 5.50 717 669 A 101 LYS HBy A 77 GLN HE2y 1.0 . 5.16 718 670 A 78 ASP H A 77 GLN HE2y 1.0 . 5.50 719 671 A 101 LYS HA A 77 GLN HE2y 1.0 . 4.91 720 672 A 77 GLN HGx A 77 GLN HE2y 1.0 . 3.96 721 673 A 101 LYS HBx A 77 GLN HE2y 1.0 . 4.46 722 674 A 77 GLN HE2y A 101 LYS HDx 1.0 . 4.87 723 675 A 77 GLN HE2y A 101 LYS HGx 1.0 . 4.73 724 675 A 101 LYS HGy A 77 GLN HE2y 1.0 . 4.73 725 676 A 77 GLN HE2x A 101 LYS HBx 1.0 . 4.57 726 677 A 73 ILE HG2% A 77 GLN HE2x 1.0 . 5.50 727 678 A 26 PRO HDx A 25 THR H 1.0 . 5.50 728 679 A 25 THR H A 72 MET HE% 1.0 . 5.50 729 680 A 76 TRP HE1 A 25 THR H 1.0 . 5.50 730 681 A 25 THR H A 26 PRO HA 1.0 . 4.93 731 682 A 42 GLY H A 40 GLY H 1.0 . 5.10 732 683 A 37 ARG H A 40 GLY H 1.0 . 5.03 733 684 A 41 TRP H A 40 GLY H 1.0 . 3.53 734 685 A 35 GLY HAy A 40 GLY H 1.0 . 5.50 735 686 A 40 GLY H A 38 ILE HB 1.0 . 5.43 736 687 A 35 GLY HAx A 40 GLY H 1.0 . 5.03 737 688 A 39 ILE HB A 40 GLY H 1.0 . 3.87 738 689 A 40 GLY H A 39 ILE HG1x 1.0 . 4.89 739 689 A 39 ILE HG1y A 40 GLY H 1.0 . 4.89 740 690 A 47 GLY H A 45 ALA HB% 1.0 . 5.50 741 691 A 47 GLY H A 46 GLU H 1.0 . 3.43 742 692 A 47 GLY H A 43 THR H 1.0 . 4.15 743 693 A 47 GLY H A 49 ARG H 1.0 . 4.75 744 694 A 47 GLY H A 48 ALA H 1.0 . 3.48 745 695 A 47 GLY H A 46 GLU HBy 1.0 . 3.76 746 696 A 47 GLY H A 48 ALA HB% 1.0 . 5.41 747 697 A 67 GLY H A 68 THR HA 1.0 . 5.35 748 698 A 67 GLY H A 65 LYS HA 1.0 . 4.08 749 699 A 66 GLN HBy A 67 GLY H 1.0 . 4.48 750 700 A 67 GLY H A 66 GLN HBx 1.0 . 4.58 751 701 A 65 LYS H A 67 GLY H 1.0 . 4.63 752 702 A 66 GLN H A 67 GLY H 1.0 . 3.53 753 703 A 35 GLY H A 39 ILE H 1.0 . 5.50 754 704 A 35 GLY H A 38 ILE HG1x 1.0 . 4.71 755 705 A 35 GLY H A 33 ALA H 1.0 . 5.29 756 706 A 35 GLY H A 32 PRO HA 1.0 . 4.90 757 707 A 35 GLY H A 31 LEU HA 1.0 . 5.49 758 708 A 35 GLY H A 36 GLN HGy 1.0 . 5.50 759 709 A 35 GLY H A 36 GLN HBy 1.0 . 5.00 760 710 A 35 GLY H A 29 ILE HD1% 1.0 . 5.50 761 711 A 35 GLY H A 37 ARG HBx 1.0 . 5.50 762 711 A 35 GLY H A 37 ARG HBy 1.0 . 5.50 763 712 A 47 GLY HAy A 43 THR H 1.0 . 4.21 764 713 A 50 GLN H A 47 GLY HAy 1.0 . 5.50 765 714 A 43 THR H A 47 GLY HAx 1.0 . 4.09 766 715 A 48 ALA HB% A 47 GLY HAx 1.0 . 5.50 767 716 A 46 GLU H A 47 GLY HAx 1.0 . 5.35 768 717 A 51 ARG H A 47 GLY HAx 1.0 . 5.50 769 718 A 50 GLN H A 47 GLY HAx 1.0 . 5.15 770 719 A 73 ILE HD1% A 69 THR H 1.0 . 5.37 771 720 A 73 ILE HD1% A 73 ILE H 1.0 . 3.86 772 721 A 73 ILE HD1% A 34 PHE HDx 1.0 . 5.41 773 722 A 73 ILE HD1% A 100 MET HA 1.0 . 4.66 774 723 A 73 ILE HD1% A 73 ILE HA 1.0 . 3.22 775 724 A 73 ILE HD1% A 72 MET HBy 1.0 . 4.90 776 725 A 72 MET HBx A 73 ILE HD1% 1.0 . 5.14 777 726 A 73 ILE HD1% A 103 ILE HG2% 1.0 . 4.01 778 727 A 43 THR H A 42 GLY HAy 1.0 . 3.40 779 728 A 42 GLY HAy A 36 GLN HGx 1.0 . 5.50 780 729 A 43 THR H A 42 GLY HAx 1.0 . 3.42 781 730 A 36 GLN HGx A 42 GLY HAx 1.0 . 5.50 782 731 A 43 THR HG2% A 42 GLY HAx 1.0 . 5.31 783 732 A 40 GLY HAx A 51 ARG HBx 1.0 . 5.24 784 732 A 51 ARG HBy A 40 GLY HAx 1.0 . 5.24 785 733 A 39 ILE H A 39 ILE HD1% 1.0 . 4.10 786 734 A 39 ILE HD1% A 40 GLY H 1.0 . 5.50 787 735 A 39 ILE HD1% A 38 ILE HA 1.0 . 5.37 788 736 A 63 ILE HA A 39 ILE HD1% 1.0 . 4.92 789 737 A 39 ILE HD1% A 39 ILE HA 1.0 . 3.31 790 738 A 39 ILE HD1% A 38 ILE HB 1.0 . 5.18 791 739 A 39 ILE HD1% A 63 ILE HG1x 1.0 . 3.36 792 740 A 63 ILE HD1% A 39 ILE HD1% 1.0 . 3.38 793 741 A 39 ILE HD1% A 39 ILE HG2% 1.0 . 3.65 794 742 A 35 GLY HAy A 34 PHE H 1.0 . 5.50 795 743 A 35 GLY HAy A 39 ILE HG2% 1.0 . 5.50 796 744 A 35 GLY HAy A 39 ILE HB 1.0 . 4.17 797 745 A 35 GLY HAy A 39 ILE HG1x 1.0 . 4.98 798 745 A 35 GLY HAy A 39 ILE HG1y 1.0 . 4.98 799 746 A 35 GLY HAx A 39 ILE HG2% 1.0 . 5.50 800 747 A 35 GLY HAx A 39 ILE HG1x 1.0 . 5.02 801 747 A 35 GLY HAx A 39 ILE HG1y 1.0 . 5.02 802 748 A 35 GLY HAx A 41 TRP H 1.0 . 5.50 803 749 A 39 ILE HB A 35 GLY HAx 1.0 . 4.21 804 750 A 66 GLN H A 67 GLY HAy 1.0 . 5.10 805 751 A 67 GLY HAy A 26 PRO HBy 1.0 . 5.22 806 752 A 26 PRO HBx A 67 GLY HAy 1.0 . 4.53 807 753 A 26 PRO HBy A 67 GLY HAx 1.0 . 5.44 808 754 A 26 PRO HBx A 67 GLY HAx 1.0 . 5.33 809 755 A 66 GLN H A 67 GLY HAx 1.0 . 4.88 810 756 A 44 GLY HAy A 43 THR HA 1.0 . 5.30 811 757 A 92 THR HG2% A 44 GLY HAy 1.0 . 4.64 812 758 A 47 GLY H A 44 GLY HAy 1.0 . 5.35 813 759 A 45 ALA HB% A 44 GLY HAy 1.0 . 5.22 814 760 A 45 ALA HB% A 44 GLY HAx 1.0 . 5.31 815 761 A 43 THR HG2% A 44 GLY HAx 1.0 . 5.30 816 762 A 92 THR HG2% A 44 GLY HAx 1.0 . 4.75 817 763 A 43 THR HG2% A 44 GLY HAy 1.0 . 5.22 818 764 A 47 GLY H A 44 GLY HAx 1.0 . 5.48 819 765 A 106 LEU HBy A 57 PRO HA 1.0 . 5.21 820 766 A 106 LEU HBy A 106 LEU H 1.0 . 3.66 821 767 A 106 LEU HBy A 103 ILE HA 1.0 . 4.12 822 768 A 106 LEU HBy A 106 LEU HD1% 1.0 . 4.05 823 769 A 106 LEU HBy A 106 LEU HD2% 1.0 . 3.97 824 770 A 107 TRP H A 106 LEU HBx 1.0 . 4.95 825 771 A 105 ASP H A 106 LEU HBy 1.0 . 5.44 826 772 A 106 LEU HBx A 57 PRO HA 1.0 . 4.66 827 773 A 98 ARG H A 98 ARG HDy 1.0 . 4.80 828 774 A 95 TYR HD% A 98 ARG HDy 1.0 . 5.37 829 775 A 98 ARG HA A 98 ARG HDy 1.0 . 5.21 830 776 A 98 ARG HBy A 98 ARG HDy 1.0 . 3.28 831 777 A 52 LEU HD1% A 98 ARG HDy 1.0 . 4.62 832 778 A 52 LEU HD2% A 98 ARG HDy 1.0 . 5.46 833 779 A 98 ARG HA A 98 ARG HDx 1.0 . 4.68 834 780 A 98 ARG HBy A 98 ARG HDx 1.0 . 3.35 835 781 A 98 ARG H A 98 ARG HDx 1.0 . 4.72 836 782 A 95 TYR HD% A 98 ARG HDx 1.0 . 4.83 837 783 A 95 TYR HE% A 98 ARG HDx 1.0 . 5.48 838 784 A 98 ARG HDx A 95 TYR HA 1.0 . 4.28 839 785 A 52 LEU HD1% A 98 ARG HDx 1.0 . 4.56 840 786 A 52 LEU HD2% A 98 ARG HDx 1.0 . 5.50 841 787 A 94 LYS HGx A 98 ARG HDx 1.0 . 4.81 842 788 A 51 ARG H A 51 ARG HDy 1.0 . 5.50 843 789 A 51 ARG HDy A 51 ARG HBx 1.0 . 3.99 844 789 A 51 ARG HBy A 51 ARG HDy 1.0 . 3.99 845 790 A 98 ARG HDy A 95 TYR HA 1.0 . 4.06 846 791 A 51 ARG HDx A 51 ARG HBx 1.0 . 3.65 847 791 A 51 ARG HBy A 51 ARG HDx 1.0 . 3.65 848 792 A 51 ARG H A 51 ARG HDx 1.0 . 4.97 849 793 A 37 ARG HGy A 37 ARG HDx 1.0 . 2.99 850 793 A 37 ARG HGy A 37 ARG HDy 1.0 . 2.99 851 794 A 38 ILE HD1% A 37 ARG HDx 1.0 . 5.09 852 794 A 38 ILE HD1% A 37 ARG HDy 1.0 . 5.09 853 795 A 37 ARG H A 37 ARG HDx 1.0 . 4.66 854 795 A 37 ARG H A 37 ARG HDy 1.0 . 4.66 855 796 A 95 TYR HD% A 49 ARG HDy 1.0 . 5.50 856 797 A 49 ARG H A 49 ARG HDy 1.0 . 5.50 857 798 A 50 GLN H A 49 ARG HDy 1.0 . 5.50 858 799 A 49 ARG HA A 49 ARG HDy 1.0 . 4.82 859 800 A 49 ARG HBy A 49 ARG HDy 1.0 . 4.09 860 801 A 49 ARG HBx A 49 ARG HDy 1.0 . 4.10 861 802 A 50 GLN HE2y A 49 ARG HDy 1.0 . 4.81 862 803 A 49 ARG HDy A 46 GLU HA 1.0 . 5.33 863 804 A 49 ARG H A 49 ARG HDx 1.0 . 5.06 864 805 A 50 GLN H A 49 ARG HDx 1.0 . 5.18 865 806 A 50 GLN HE2y A 49 ARG HDx 1.0 . 4.62 866 807 A 50 GLN HE2x A 49 ARG HDx 1.0 . 5.26 867 808 A 95 TYR HE% A 49 ARG HDx 1.0 . 4.96 868 809 A 46 GLU HA A 49 ARG HDx 1.0 . 4.87 869 810 A 49 ARG HA A 49 ARG HDx 1.0 . 4.99 870 811 A 50 GLN HGy A 49 ARG HDx 1.0 . 5.50 871 812 A 49 ARG HBy A 49 ARG HDx 1.0 . 3.94 872 813 A 49 ARG HBx A 49 ARG HDx 1.0 . 3.96 873 814 A 101 LYS HA A 101 LYS HEx 1.0 . 4.97 874 814 A 101 LYS HA A 101 LYS HEy 1.0 . 4.97 875 815 A 77 GLN HE2y A 101 LYS HEx 1.0 . 5.06 876 815 A 77 GLN HE2y A 101 LYS HEy 1.0 . 5.06 877 816 A 77 GLN HE2x A 101 LYS HEx 1.0 . 4.68 878 816 A 77 GLN HE2x A 101 LYS HEy 1.0 . 4.68 879 817 A 101 LYS HEx A 101 LYS HGx 1.0 . 3.41 880 817 A 101 LYS HEy A 101 LYS HGx 1.0 . 3.41 881 817 A 101 LYS HGy A 101 LYS HEx 1.0 . 3.41 882 817 A 101 LYS HGy A 101 LYS HEy 1.0 . 3.41 883 818 A 102 LYS H A 101 LYS HEx 1.0 . 5.50 884 818 A 102 LYS H A 101 LYS HEy 1.0 . 5.50 885 819 A 96 ARG H A 96 ARG HDy 1.0 . 5.16 886 820 A 96 ARG HA A 96 ARG HDy 1.0 . 5.38 887 821 A 93 ALA HA A 96 ARG HDx 1.0 . 5.50 888 822 A 96 ARG HA A 96 ARG HDx 1.0 . 5.18 889 823 A 96 ARG H A 96 ARG HDx 1.0 . 5.50 890 824 A 102 LYS HA A 102 LYS HEx 1.0 . 4.53 891 824 A 102 LYS HA A 102 LYS HEy 1.0 . 4.53 892 825 A 102 LYS HDx A 102 LYS HEx 1.0 . 2.98 893 825 A 102 LYS HDy A 102 LYS HEx 1.0 . 2.98 894 825 A 102 LYS HEy A 102 LYS HDx 1.0 . 2.98 895 825 A 102 LYS HEy A 102 LYS HDy 1.0 . 2.98 896 826 A 27 LYS H A 27 LYS HEx 1.0 . 5.04 897 826 A 27 LYS H A 27 LYS HEy 1.0 . 5.04 898 827 A 27 LYS HGy A 27 LYS HEx 1.0 . 3.18 899 827 A 27 LYS HGy A 27 LYS HEy 1.0 . 3.18 900 828 A 52 LEU HBy A 51 ARG H 1.0 . 5.30 901 829 A 52 LEU HBy A 95 TYR HD% 1.0 . 5.50 902 830 A 52 LEU HBy A 99 LEU HA 1.0 . 5.09 903 831 A 52 LEU HBy A 53 GLU HA 1.0 . 5.26 904 832 A 18 LYS H A 17 LEU HBy 1.0 . 4.70 905 833 A 17 LEU H A 17 LEU HBy 1.0 . 3.91 906 834 A 17 LEU HBy A 17 LEU HD2% 1.0 . 3.97 907 835 A 17 LEU H A 17 LEU HBx 1.0 . 4.01 908 836 A 52 LEU HD2% A 52 LEU HBx 1.0 . 3.79 909 837 A 49 ARG HA A 52 LEU HBx 1.0 . 4.31 910 838 A 65 LYS H A 65 LYS HEx 1.0 . 5.00 911 838 A 65 LYS H A 65 LYS HEy 1.0 . 5.00 912 839 A 62 MET HA A 65 LYS HEx 1.0 . 4.28 913 839 A 62 MET HA A 65 LYS HEy 1.0 . 4.28 914 840 A 65 LYS HBx A 65 LYS HEx 1.0 . 4.02 915 840 A 65 LYS HBx A 65 LYS HEy 1.0 . 4.02 916 841 A 65 LYS HDx A 65 LYS HEx 1.0 . 2.98 917 841 A 65 LYS HDy A 65 LYS HEx 1.0 . 2.98 918 841 A 65 LYS HEy A 65 LYS HDx 1.0 . 2.98 919 841 A 65 LYS HDy A 65 LYS HEy 1.0 . 2.98 920 842 A 65 LYS HGx A 65 LYS HEx 1.0 . 3.69 921 842 A 65 LYS HEy A 65 LYS HGx 1.0 . 3.69 922 843 A 17 LEU HD2% A 15 LEU HBx 1.0 . 3.92 923 843 A 15 LEU HBy A 17 LEU HD2% 1.0 . 3.92 924 844 A 56 GLN H A 59 ASP HBy 1.0 . 3.95 925 845 A 59 ASP HBy A 60 VAL HB 1.0 . 5.11 926 846 A 59 ASP HBy A 55 ILE HG2% 1.0 . 4.89 927 847 A 59 ASP HBx A 55 ILE HA 1.0 . 4.65 928 848 A 59 ASP HBx A 59 ASP H 1.0 . 3.75 929 849 A 59 ASP HBx A 60 VAL H 1.0 . 4.18 930 850 A 59 ASP HBy A 55 ILE HA 1.0 . 4.45 931 851 A 59 ASP HBx A 55 ILE HG1y 1.0 . 3.71 932 852 A 94 LYS HGy A 94 LYS HEy 1.0 . 4.19 933 853 A 95 TYR HE% A 94 LYS HEx 1.0 . 5.50 934 854 A 94 LYS HEx A 94 LYS HBx 1.0 . 4.08 935 854 A 94 LYS HBy A 94 LYS HEx 1.0 . 4.08 936 855 A 22 LEU HBy A 22 LEU HD2% 1.0 . 4.16 937 856 A 22 LEU H A 22 LEU HBx 1.0 . 3.68 938 857 A 22 LEU HBx A 76 TRP HH2 1.0 . 4.17 939 858 A 22 LEU HD1% A 22 LEU HBx 1.0 . 3.98 940 859 A 23 PRO HDy A 22 LEU HBx 1.0 . 4.53 941 860 A 91 PRO HA A 94 LYS HEy 1.0 . 4.66 942 861 A 91 PRO HA A 94 LYS HEx 1.0 . 4.90 943 862 A 99 LEU HBy A 100 MET HGy 1.0 . 5.50 944 863 A 52 LEU HA A 99 LEU HBy 1.0 . 5.20 945 864 A 99 LEU HBy A 98 ARG H 1.0 . 5.50 946 865 A 99 LEU HBx A 100 MET H 1.0 . 4.28 947 866 A 99 LEU HBx A 99 LEU HD1% 1.0 . 4.23 948 867 A 99 LEU HBx A 99 LEU HD2% 1.0 . 4.06 949 868 A 78 ASP H A 78 ASP HBy 1.0 . 3.26 950 869 A 79 PHE H A 78 ASP HBy 1.0 . 3.73 951 870 A 78 ASP HBy A 79 PHE HA 1.0 . 4.70 952 871 A 78 ASP H A 78 ASP HBx 1.0 . 3.26 953 872 A 77 GLN H A 78 ASP HBx 1.0 . 4.77 954 873 A 79 PHE H A 78 ASP HBx 1.0 . 3.70 955 874 A 78 ASP HBx A 74 THR HA 1.0 . 4.62 956 875 A 75 ALA HB% A 78 ASP HBx 1.0 . 5.00 957 876 A 55 ILE H A 54 ASN HBy 1.0 . 4.63 958 877 A 54 ASN H A 54 ASN HBy 1.0 . 3.63 959 878 A 55 ILE H A 54 ASN HBx 1.0 . 4.52 960 879 A 54 ASN HD2y A 54 ASN HBy 1.0 . 3.88 961 880 A 53 GLU HBx A 54 ASN HBy 1.0 . 4.85 962 881 A 54 ASN HD2y A 54 ASN HBx 1.0 . 3.85 963 882 A 106 LEU HG A 105 ASP HBx 1.0 . 4.65 964 883 A 104 ALA H A 105 ASP HBy 1.0 . 5.16 965 884 A 105 ASP HBy A 106 LEU HG 1.0 . 4.70 966 885 A 105 ASP HBy A 102 LYS HBx 1.0 . 4.84 967 886 A 105 ASP HBy A 106 LEU HD1% 1.0 . 5.44 968 887 A 105 ASP HBy A 106 LEU HD2% 1.0 . 5.50 969 888 A 105 ASP H A 105 ASP HBx 1.0 . 3.49 970 889 A 106 LEU H A 105 ASP HBx 1.0 . 4.13 971 890 A 102 LYS HA A 105 ASP HBx 1.0 . 3.79 972 891 A 106 LEU HD2% A 105 ASP HBx 1.0 . 5.50 973 892 A 107 TRP H A 105 ASP HBy 1.0 . 5.50 974 893 A 106 LEU HD1% A 105 ASP HBx 1.0 . 5.34 975 894 A 70 LEU HBy A 71 GLU HA 1.0 . 5.35 976 895 A 70 LEU HBy A 69 THR HA 1.0 . 4.93 977 896 A 70 LEU HBy A 107 TRP HZ2 1.0 . 5.50 978 897 A 70 LEU HBx A 107 TRP HD1 1.0 . 5.27 979 898 A 70 LEU HBx A 107 TRP HZ2 1.0 . 5.23 980 899 A 70 LEU HBx A 70 LEU HD2% 1.0 . 3.96 981 900 A 70 LEU HBx A 69 THR HA 1.0 . 5.14 982 901 A 69 THR HB A 70 LEU HBx 1.0 . 5.16 983 902 A 81 GLU H A 79 PHE HBy 1.0 . 5.35 984 903 A 79 PHE HBy A 23 PRO HGy 1.0 . 5.03 985 904 A 79 PHE HBy A 23 PRO HGx 1.0 . 5.06 986 905 A 80 TYR H A 79 PHE HBx 1.0 . 4.30 987 906 A 79 PHE HBx A 23 PRO HGx 1.0 . 4.63 988 907 A 23 PRO HGy A 79 PHE HBx 1.0 . 4.61 989 908 A 11 VAL H A 10 PHE HBy 1.0 . 5.01 990 909 A 31 LEU HBy A 30 PRO HA 1.0 . 4.97 991 910 A 31 LEU HBx A 32 PRO HDy 1.0 . 3.84 992 911 A 31 LEU HBx A 32 PRO HDx 1.0 . 4.43 993 912 A 31 LEU HBx A 31 LEU HD2% 1.0 . 3.77 994 913 A 11 VAL H A 10 PHE HBx 1.0 . 4.97 995 914 A 35 GLY H A 34 PHE HBx 1.0 . 3.73 996 914 A 35 GLY H A 34 PHE HBy 1.0 . 3.73 997 915 A 34 PHE HDy A 34 PHE HBx 1.0 . 3.59 998 915 A 34 PHE HBy A 34 PHE HDy 1.0 . 3.59 999 916 A 29 ILE HG1y A 34 PHE HBx 1.0 . 4.06 1000 916 A 34 PHE HBy A 29 ILE HG1y 1.0 . 4.06 1001 917 A 29 ILE HG2% A 34 PHE HBx 1.0 . 4.83 1002 917 A 34 PHE HBy A 29 ILE HG2% 1.0 . 4.83 1003 918 A 29 ILE HD1% A 34 PHE HBx 1.0 . 3.81 1004 918 A 34 PHE HBy A 29 ILE HD1% 1.0 . 3.81 1005 919 A 87 ASN HBy A 87 ASN HD2y 1.0 . 3.55 1006 920 A 95 TYR H A 95 TYR HBy 1.0 . 3.96 1007 921 A 7 THR H A 8 ASN HBx 1.0 . 4.99 1008 922 A 49 ARG HA A 95 TYR HBy 1.0 . 4.47 1009 923 A 48 ALA HB% A 95 TYR HBy 1.0 . 4.00 1010 924 A 48 ALA HB% A 95 TYR HBx 1.0 . 4.16 1011 925 A 87 ASN HBx A 87 ASN HD2y 1.0 . 3.49 1012 926 A 21 VAL HG2% A 20 ASN HBy 1.0 . 5.39 1013 927 A 90 ASN HBy A 90 ASN HD2y 1.0 . 4.05 1014 928 A 90 ASN HBy A 91 PRO HDy 1.0 . 5.36 1015 929 A 14 ASN HBx A 13 PRO HBy 1.0 . 4.67 1016 930 A 90 ASN HBx A 93 ALA HB% 1.0 . 4.49 1017 931 A 90 ASN HBx A 90 ASN HD2y 1.0 . 3.96 1018 932 A 63 ILE HB A 64 LYS HA 1.0 . 5.50 1019 933 A 63 ILE HB A 103 ILE HG2% 1.0 . 5.50 1020 934 A 63 ILE HB A 39 ILE HD1% 1.0 . 5.50 1021 935 A 63 ILE HB A 62 MET H 1.0 . 4.86 1022 936 A 63 ILE HB A 107 TRP HH2 1.0 . 5.38 1023 937 A 90 ASN HBx A 91 PRO HDy 1.0 . 5.48 1024 938 A 63 ILE HB A 63 ILE HD1% 1.0 . 3.66 1025 939 A 14 ASN HBy A 15 LEU HBx 1.0 . 5.50 1026 939 A 14 ASN HBy A 15 LEU HBy 1.0 . 5.50 1027 940 A 89 ASN HBy A 89 ASN HD2y 1.0 . 3.94 1028 941 A 56 GLN H A 55 ILE HB 1.0 . 4.18 1029 942 A 54 ASN H A 55 ILE HB 1.0 . 4.63 1030 943 A 52 LEU HA A 55 ILE HB 1.0 . 4.91 1031 944 A 81 GLU H A 80 TYR HBy 1.0 . 4.80 1032 945 A 80 TYR H A 80 TYR HBy 1.0 . 4.00 1033 946 A 97 ALA HA A 80 TYR HBy 1.0 . 4.47 1034 947 A 80 TYR HBy A 97 ALA HB% 1.0 . 3.80 1035 948 A 81 GLU H A 80 TYR HBx 1.0 . 4.76 1036 949 A 80 TYR HBx A 77 GLN HA 1.0 . 5.04 1037 950 A 80 TYR HBx A 97 ALA HB% 1.0 . 3.91 1038 951 A 77 GLN HE2y A 81 GLU HGy 1.0 . 5.27 1039 952 A 80 TYR HD% A 81 GLU HGy 1.0 . 5.50 1040 953 A 104 ALA HB% A 103 ILE HB 1.0 . 5.20 1041 954 A 103 ILE HB A 103 ILE HD1% 1.0 . 3.68 1042 955 A 28 ASN H A 28 ASN HBy 1.0 . 3.94 1043 956 A 28 ASN HD2y A 28 ASN HBy 1.0 . 3.92 1044 957 A 29 ILE H A 28 ASN HBy 1.0 . 4.76 1045 958 A 29 ILE HA A 28 ASN HBy 1.0 . 4.99 1046 959 A 27 LYS HGy A 28 ASN HBx 1.0 . 5.46 1047 960 A 28 ASN HBx A 29 ILE HA 1.0 . 5.31 1048 961 A 28 ASN H A 28 ASN HBx 1.0 . 3.96 1049 962 A 29 ILE H A 28 ASN HBx 1.0 . 4.75 1050 963 A 27 LYS HA A 28 ASN HBx 1.0 . 5.06 1051 964 A 26 PRO HBx A 28 ASN HBx 1.0 . 5.42 1052 965 A 81 GLU H A 81 GLU HGy 1.0 . 3.80 1053 966 A 81 GLU H A 81 GLU HGx 1.0 . 4.03 1054 967 A 82 GLN H A 81 GLU HGx 1.0 . 5.44 1055 968 A 77 GLN HE2y A 81 GLU HGx 1.0 . 5.50 1056 969 A 84 GLN HE2y A 81 GLU HGx 1.0 . 5.50 1057 970 A 81 GLU HGx A 78 ASP HA 1.0 . 5.50 1058 971 A 104 ALA HA A 103 ILE HB 1.0 . 5.24 1059 972 A 34 PHE H A 29 ILE HB 1.0 . 4.95 1060 973 A 29 ILE HB A 30 PRO HDy 1.0 . 3.87 1061 974 A 29 ILE HB A 30 PRO HDx 1.0 . 3.62 1062 975 A 71 GLU H A 71 GLU HGy 1.0 . 4.13 1063 976 A 72 MET H A 71 GLU HGy 1.0 . 5.08 1064 977 A 71 GLU HA A 71 GLU HGy 1.0 . 3.68 1065 978 A 69 THR HB A 71 GLU HGy 1.0 . 5.45 1066 979 A 72 MET H A 71 GLU HGx 1.0 . 4.91 1067 980 A 49 ARG HA A 53 GLU HGx 1.0 . 5.50 1068 981 A 52 LEU H A 53 GLU HGy 1.0 . 5.47 1069 982 A 53 GLU H A 53 GLU HGy 1.0 . 3.73 1070 983 A 53 GLU HGy A 50 GLN HA 1.0 . 4.87 1071 984 A 53 GLU H A 53 GLU HGx 1.0 . 3.77 1072 985 A 52 LEU HG A 53 GLU HGx 1.0 . 5.37 1073 986 A 39 ILE H A 38 ILE HB 1.0 . 3.66 1074 987 A 38 ILE H A 38 ILE HB 1.0 . 3.78 1075 988 A 38 ILE HB A 34 PHE HA 1.0 . 3.63 1076 989 A 38 ILE HB A 39 ILE HG1x 1.0 . 4.62 1077 989 A 39 ILE HG1y A 38 ILE HB 1.0 . 4.62 1078 990 A 37 ARG H A 38 ILE HB 1.0 . 5.19 1079 991 A 84 GLN H A 83 GLU HGy 1.0 . 5.14 1080 992 A 83 GLU H A 83 GLU HGy 1.0 . 3.91 1081 993 A 80 TYR HA A 83 GLU HGy 1.0 . 4.46 1082 994 A 93 ALA HB% A 83 GLU HGy 1.0 . 4.61 1083 995 A 79 PHE HE% A 83 GLU HGy 1.0 . 5.30 1084 996 A 79 PHE HE% A 83 GLU HGx 1.0 . 5.29 1085 997 A 84 GLN H A 83 GLU HGx 1.0 . 5.28 1086 998 A 83 GLU H A 83 GLU HGx 1.0 . 4.02 1087 999 A 84 GLN HE2y A 83 GLU HGx 1.0 . 4.75 1088 1000 A 79 PHE HD% A 83 GLU HGx 1.0 . 5.50 1089 1001 A 80 TYR HA A 83 GLU HGx 1.0 . 4.52 1090 1002 A 93 ALA HB% A 83 GLU HGx 1.0 . 4.80 1091 1003 A 46 GLU H A 46 GLU HGy 1.0 . 3.99 1092 1004 A 47 GLY H A 46 GLU HGy 1.0 . 4.91 1093 1005 A 46 GLU HA A 46 GLU HGy 1.0 . 4.03 1094 1006 A 46 GLU H A 46 GLU HGx 1.0 . 3.92 1095 1007 A 45 ALA HB% A 46 GLU HGy 1.0 . 5.30 1096 1008 A 45 ALA HB% A 46 GLU HGx 1.0 . 5.31 1097 1009 A 88 GLU H A 88 GLU HGx 1.0 . 3.76 1098 1009 A 88 GLU H A 88 GLU HGy 1.0 . 3.76 1099 1010 A 89 ASN H A 88 GLU HGx 1.0 . 4.72 1100 1010 A 89 ASN H A 88 GLU HGy 1.0 . 4.72 1101 1011 A 89 ASN HD2x A 88 GLU HGx 1.0 . 5.50 1102 1011 A 89 ASN HD2x A 88 GLU HGy 1.0 . 5.50 1103 1012 A 88 GLU HBy A 88 GLU HGx 1.0 . 2.61 1104 1012 A 88 GLU HBy A 88 GLU HGy 1.0 . 2.61 1105 1013 A 87 ASN HA A 88 GLU HGx 1.0 . 5.02 1106 1013 A 87 ASN HA A 88 GLU HGy 1.0 . 5.02 1107 1014 A 73 ILE H A 73 ILE HB 1.0 . 3.46 1108 1015 A 73 ILE HB A 107 TRP HZ3 1.0 . 5.29 1109 1016 A 42 GLY H A 36 GLN HGx 1.0 . 5.50 1110 1017 A 41 TRP HE1 A 36 GLN HGx 1.0 . 5.41 1111 1018 A 36 GLN H A 36 GLN HGx 1.0 . 3.79 1112 1019 A 32 PRO HA A 36 GLN HGx 1.0 . 5.07 1113 1020 A 36 GLN HGy A 36 GLN H 1.0 . 3.79 1114 1021 A 38 ILE HG1x A 66 GLN HGx 1.0 . 4.76 1115 1021 A 66 GLN HGy A 38 ILE HG1x 1.0 . 4.76 1116 1022 A 50 GLN H A 50 GLN HGy 1.0 . 3.94 1117 1023 A 86 ARG H A 85 GLN HGx 1.0 . 4.04 1118 1024 A 63 ILE HA A 66 GLN HGx 1.0 . 4.73 1119 1024 A 66 GLN HGy A 63 ILE HA 1.0 . 4.73 1120 1025 A 66 GLN HBx A 66 GLN HGx 1.0 . 2.67 1121 1025 A 66 GLN HGy A 66 GLN HBx 1.0 . 2.67 1122 1026 A 38 ILE HG2% A 66 GLN HGx 1.0 . 4.11 1123 1026 A 66 GLN HGy A 38 ILE HG2% 1.0 . 4.11 1124 1027 A 66 GLN HE2y A 66 GLN HGx 1.0 . 3.78 1125 1027 A 66 GLN HGy A 66 GLN HE2y 1.0 . 3.78 1126 1028 A 82 GLN HGy A 82 GLN HBy 1.0 . 2.83 1127 1029 A 82 GLN HE2y A 82 GLN HGx 1.0 . 4.04 1128 1030 A 50 GLN H A 50 GLN HGx 1.0 . 3.81 1129 1031 A 84 GLN H A 84 GLN HGx 1.0 . 4.05 1130 1032 A 19 GLN HBy A 19 GLN HGx 1.0 . 2.72 1131 1032 A 19 GLN HGy A 19 GLN HBy 1.0 . 2.72 1132 1033 A 19 GLN HA A 19 GLN HGx 1.0 . 3.62 1133 1033 A 19 GLN HGy A 19 GLN HA 1.0 . 3.62 1134 1034 A 21 VAL HG2% A 19 GLN HGx 1.0 . 4.98 1135 1034 A 19 GLN HGy A 21 VAL HG2% 1.0 . 4.98 1136 1035 A 35 GLY H A 39 ILE HB 1.0 . 5.32 1137 1036 A 31 LEU H A 30 PRO HBy 1.0 . 3.96 1138 1037 A 32 PRO HDx A 30 PRO HBy 1.0 . 3.87 1139 1038 A 30 PRO HBx A 33 ALA HB% 1.0 . 4.48 1140 1039 A 31 LEU H A 30 PRO HBx 1.0 . 4.18 1141 1040 A 33 ALA H A 30 PRO HBx 1.0 . 4.11 1142 1041 A 30 PRO HBx A 32 PRO HDy 1.0 . 3.91 1143 1042 A 30 PRO HBx A 32 PRO HDx 1.0 . 3.78 1144 1043 A 69 THR H A 72 MET HBy 1.0 . 4.38 1145 1044 A 30 PRO HBy A 33 ALA HB% 1.0 . 4.94 1146 1045 A 107 TRP HH2 A 64 LYS HBx 1.0 . 5.50 1147 1046 A 59 ASP H A 56 GLN HGy 1.0 . 5.32 1148 1047 A 58 ALA H A 56 GLN HGx 1.0 . 5.09 1149 1048 A 64 LYS H A 64 LYS HBy 1.0 . 3.71 1150 1049 A 61 SER HA A 64 LYS HBy 1.0 . 4.19 1151 1050 A 64 LYS HBx A 65 LYS HA 1.0 . 5.20 1152 1051 A 64 LYS H A 64 LYS HBx 1.0 . 3.73 1153 1052 A 65 LYS H A 64 LYS HBx 1.0 . 4.17 1154 1053 A 64 LYS HBx A 64 LYS HDy 1.0 . 4.07 1155 1054 A 64 LYS HDx A 64 LYS HBx 1.0 . 4.04 1156 1055 A 68 THR H A 64 LYS HBx 1.0 . 5.50 1157 1056 A 58 ALA H A 56 GLN HGy 1.0 . 5.21 1158 1057 A 58 ALA HB% A 56 GLN HGy 1.0 . 5.50 1159 1058 A 56 GLN H A 56 GLN HGx 1.0 . 4.02 1160 1059 A 56 GLN HE2y A 56 GLN HGx 1.0 . 3.94 1161 1060 A 56 GLN HA A 56 GLN HGx 1.0 . 3.85 1162 1061 A 11 VAL HB A 12 SER H 1.0 . 4.90 1163 1062 A 18 LYS H A 18 LYS HBy 1.0 . 4.08 1164 1063 A 18 LYS HBy A 21 VAL HG2% 1.0 . 5.35 1165 1064 A 65 LYS H A 64 LYS HBy 1.0 . 3.72 1166 1065 A 25 THR HG2% A 24 PRO HBx 1.0 . 5.50 1167 1065 A 25 THR HG2% A 24 PRO HBy 1.0 . 5.50 1168 1066 A 25 THR H A 24 PRO HBx 1.0 . 3.72 1169 1066 A 25 THR H A 24 PRO HBy 1.0 . 3.72 1170 1067 A 21 VAL HB A 20 ASN HA 1.0 . 5.35 1171 1068 A 77 GLN HGy A 77 GLN HA 1.0 . 3.84 1172 1069 A 77 GLN H A 100 MET HGy 1.0 . 5.50 1173 1070 A 100 MET H A 100 MET HGy 1.0 . 3.71 1174 1071 A 76 TRP HBy A 100 MET HGy 1.0 . 4.95 1175 1072 A 100 MET HGy A 100 MET HE% 1.0 . 4.01 1176 1073 A 99 LEU H A 100 MET HGy 1.0 . 5.50 1177 1074 A 101 LYS H A 100 MET HGy 1.0 . 5.18 1178 1075 A 97 ALA HA A 100 MET HGy 1.0 . 4.92 1179 1076 A 76 TRP H A 100 MET HGx 1.0 . 5.32 1180 1077 A 100 MET HGx A 41 TRP HZ3 1.0 . 5.50 1181 1078 A 77 GLN H A 100 MET HGx 1.0 . 5.17 1182 1079 A 100 MET H A 100 MET HGx 1.0 . 3.93 1183 1080 A 97 ALA HA A 100 MET HGx 1.0 . 5.16 1184 1081 A 77 GLN HA A 100 MET HGx 1.0 . 4.29 1185 1082 A 77 GLN H A 77 GLN HGy 1.0 . 4.66 1186 1083 A 78 ASP H A 77 GLN HGy 1.0 . 4.69 1187 1084 A 77 GLN HGx A 77 GLN HA 1.0 . 3.82 1188 1085 A 77 GLN H A 77 GLN HGx 1.0 . 4.42 1189 1086 A 97 ALA HA A 77 GLN HGx 1.0 . 5.50 1190 1087 A 65 LYS HBy A 65 LYS HEx 1.0 . 5.50 1191 1087 A 65 LYS HEy A 65 LYS HBy 1.0 . 5.50 1192 1088 A 76 TRP HE1 A 72 MET HGx 1.0 . 5.50 1193 1088 A 76 TRP HE1 A 72 MET HGy 1.0 . 5.50 1194 1089 A 101 LYS HBy A 77 GLN HE2x 1.0 . 5.50 1195 1090 A 99 LEU HBx A 100 MET HGy 1.0 . 5.50 1196 1091 A 101 LYS H A 100 MET HGx 1.0 . 5.16 1197 1092 A 73 ILE HG2% A 100 MET HGx 1.0 . 5.46 1198 1093 A 64 LYS H A 62 MET HGx 1.0 . 5.50 1199 1094 A 63 ILE HA A 62 MET HGx 1.0 . 5.50 1200 1095 A 84 GLN HE2x A 94 LYS HBx 1.0 . 5.37 1201 1095 A 84 GLN HE2x A 94 LYS HBy 1.0 . 5.37 1202 1096 A 94 LYS HEy A 94 LYS HBx 1.0 . 4.98 1203 1096 A 94 LYS HBy A 94 LYS HEy 1.0 . 4.98 1204 1097 A 94 LYS HDy A 94 LYS HBx 1.0 . 3.94 1205 1097 A 94 LYS HBy A 94 LYS HDy 1.0 . 3.94 1206 1098 A 63 ILE H A 62 MET HGy 1.0 . 4.99 1207 1099 A 62 MET H A 62 MET HGy 1.0 . 3.98 1208 1100 A 66 GLN HE2y A 62 MET HGy 1.0 . 5.01 1209 1101 A 62 MET HGy A 59 ASP HA 1.0 . 4.80 1210 1102 A 62 MET HA A 62 MET HGy 1.0 . 3.91 1211 1103 A 60 VAL HA A 62 MET HGy 1.0 . 5.30 1212 1104 A 62 MET HGy A 65 LYS HDx 1.0 . 5.50 1213 1104 A 65 LYS HDy A 62 MET HGy 1.0 . 5.50 1214 1105 A 61 SER H A 62 MET HGy 1.0 . 5.50 1215 1106 A 61 SER HA A 62 MET HGy 1.0 . 5.50 1216 1107 A 63 ILE H A 62 MET HGx 1.0 . 4.91 1217 1108 A 62 MET HGx A 59 ASP HA 1.0 . 4.73 1218 1109 A 14 ASN HA A 13 PRO HBy 1.0 . 5.50 1219 1110 A 103 ILE H A 102 LYS HBy 1.0 . 4.07 1220 1111 A 103 ILE HA A 102 LYS HBy 1.0 . 5.40 1221 1112 A 102 LYS HBy A 102 LYS HEx 1.0 . 5.44 1222 1112 A 102 LYS HBy A 102 LYS HEy 1.0 . 5.44 1223 1113 A 52 LEU HD2% A 102 LYS HBy 1.0 . 4.15 1224 1114 A 102 LYS H A 102 LYS HBx 1.0 . 3.46 1225 1115 A 102 LYS HBx A 102 LYS HEx 1.0 . 5.00 1226 1115 A 102 LYS HBx A 102 LYS HEy 1.0 . 5.00 1227 1116 A 52 LEU HD2% A 102 LYS HBx 1.0 . 4.51 1228 1117 A 56 GLN HA A 57 PRO HBy 1.0 . 5.50 1229 1118 A 58 ALA HB% A 57 PRO HBy 1.0 . 5.50 1230 1119 A 57 PRO HBy A 60 VAL HG2% 1.0 . 5.50 1231 1120 A 106 LEU HD1% A 57 PRO HBy 1.0 . 4.70 1232 1121 A 106 LEU HD2% A 57 PRO HBy 1.0 . 5.20 1233 1122 A 90 ASN HA A 91 PRO HBy 1.0 . 5.34 1234 1123 A 106 LEU HD1% A 57 PRO HBx 1.0 . 5.36 1235 1124 A 91 PRO HBy A 94 LYS HBx 1.0 . 4.50 1236 1124 A 94 LYS HBy A 91 PRO HBy 1.0 . 4.50 1237 1125 A 45 ALA HB% A 91 PRO HBy 1.0 . 4.08 1238 1126 A 95 TYR HD% A 91 PRO HBy 1.0 . 4.98 1239 1127 A 92 THR H A 91 PRO HBx 1.0 . 4.45 1240 1128 A 97 ALA HA A 100 MET HBx 1.0 . 5.16 1241 1128 A 97 ALA HA A 100 MET HBy 1.0 . 5.16 1242 1129 A 77 GLN HA A 100 MET HBx 1.0 . 3.95 1243 1129 A 77 GLN HA A 100 MET HBy 1.0 . 3.95 1244 1130 A 77 GLN H A 100 MET HBx 1.0 . 5.05 1245 1130 A 77 GLN H A 100 MET HBy 1.0 . 5.05 1246 1131 A 63 ILE H A 62 MET HBx 1.0 . 3.81 1247 1131 A 63 ILE H A 62 MET HBy 1.0 . 3.81 1248 1132 A 101 LYS H A 100 MET HBx 1.0 . 4.70 1249 1132 A 101 LYS H A 100 MET HBy 1.0 . 4.70 1250 1133 A 27 LYS H A 26 PRO HBy 1.0 . 4.07 1251 1134 A 68 THR HA A 26 PRO HBy 1.0 . 4.34 1252 1135 A 29 ILE HD1% A 26 PRO HBy 1.0 . 4.58 1253 1136 A 26 PRO HBx A 68 THR H 1.0 . 5.31 1254 1137 A 107 TRP HBy A 60 VAL HG1% 1.0 . 5.20 1255 1138 A 61 SER H A 60 VAL HB 1.0 . 4.07 1256 1139 A 60 VAL H A 60 VAL HB 1.0 . 3.34 1257 1140 A 62 MET HBy A 65 LYS HDx 1.0 . 4.55 1258 1140 A 62 MET HBx A 65 LYS HDx 1.0 . 4.55 1259 1140 A 65 LYS HDy A 62 MET HBx 1.0 . 4.55 1260 1140 A 65 LYS HDy A 62 MET HBy 1.0 . 4.55 1261 1141 A 86 ARG HBx A 86 ARG HDx 1.0 . 3.56 1262 1141 A 86 ARG HBy A 86 ARG HDx 1.0 . 3.56 1263 1141 A 86 ARG HDy A 86 ARG HBx 1.0 . 3.56 1264 1141 A 86 ARG HDy A 86 ARG HBy 1.0 . 3.56 1265 1142 A 86 ARG HGy A 86 ARG HBx 1.0 . 2.94 1266 1142 A 86 ARG HGy A 86 ARG HBy 1.0 . 2.94 1267 1143 A 107 TRP HBy A 106 LEU H 1.0 . 4.87 1268 1144 A 107 TRP HBy A 70 LEU HD2% 1.0 . 4.99 1269 1145 A 104 ALA HA A 107 TRP HBx 1.0 . 3.97 1270 1146 A 107 TRP HBx A 104 ALA HB% 1.0 . 5.09 1271 1147 A 38 ILE HD1% A 37 ARG HBx 1.0 . 4.83 1272 1147 A 37 ARG HBy A 38 ILE HD1% 1.0 . 4.83 1273 1148 A 87 ASN HA A 86 ARG HBx 1.0 . 4.70 1274 1148 A 87 ASN HA A 86 ARG HBy 1.0 . 4.70 1275 1149 A 98 ARG HBy A 95 TYR HD% 1.0 . 5.50 1276 1150 A 98 ARG HBy A 95 TYR HA 1.0 . 4.12 1277 1151 A 98 ARG HBy A 97 ALA HB% 1.0 . 5.47 1278 1152 A 99 LEU H A 98 ARG HBx 1.0 . 4.60 1279 1153 A 98 ARG H A 98 ARG HBx 1.0 . 3.91 1280 1154 A 37 ARG HBx A 37 ARG HDx 1.0 . 3.68 1281 1154 A 37 ARG HDy A 37 ARG HBx 1.0 . 3.68 1282 1154 A 37 ARG HBy A 37 ARG HDy 1.0 . 3.68 1283 1154 A 37 ARG HBy A 37 ARG HDx 1.0 . 3.68 1284 1155 A 73 ILE HD1% A 68 THR HB 1.0 . 5.50 1285 1156 A 33 ALA HB% A 32 PRO HBy 1.0 . 5.45 1286 1157 A 100 MET HA A 103 ILE HG1y 1.0 . 5.50 1287 1158 A 103 ILE H A 103 ILE HG1y 1.0 . 3.71 1288 1159 A 56 GLN H A 56 GLN HBx 1.0 . 3.66 1289 1160 A 57 PRO HDy A 56 GLN HBx 1.0 . 4.03 1290 1161 A 56 GLN H A 55 ILE HG1y 1.0 . 3.78 1291 1162 A 55 ILE HG1y A 59 ASP H 1.0 . 4.93 1292 1163 A 55 ILE HG1y A 59 ASP HA 1.0 . 5.50 1293 1164 A 55 ILE HG1y A 59 ASP HBy 1.0 . 3.90 1294 1165 A 55 ILE HG1y A 55 ILE HG2% 1.0 . 3.77 1295 1166 A 56 GLN H A 55 ILE HG1x 1.0 . 3.88 1296 1167 A 59 ASP H A 55 ILE HG1x 1.0 . 5.50 1297 1168 A 59 ASP HBy A 55 ILE HG1x 1.0 . 3.97 1298 1169 A 59 ASP HBx A 55 ILE HG1x 1.0 . 4.22 1299 1170 A 55 ILE H A 55 ILE HG1x 1.0 . 4.89 1300 1171 A 60 VAL H A 55 ILE HG1x 1.0 . 5.24 1301 1172 A 55 ILE HG2% A 55 ILE HG1x 1.0 . 3.66 1302 1173 A 103 ILE HA A 103 ILE HG1x 1.0 . 4.02 1303 1174 A 100 MET HA A 103 ILE HG1x 1.0 . 5.50 1304 1175 A 68 THR HB A 66 GLN HBx 1.0 . 5.41 1305 1176 A 56 GLN HBy A 59 ASP H 1.0 . 4.80 1306 1177 A 56 GLN HBy A 56 GLN HE2y 1.0 . 5.37 1307 1178 A 33 ALA H A 32 PRO HBy 1.0 . 4.26 1308 1179 A 31 LEU HD1% A 32 PRO HBy 1.0 . 5.50 1309 1180 A 28 ASN H A 27 LYS HBx 1.0 . 4.76 1310 1180 A 28 ASN H A 27 LYS HBy 1.0 . 4.76 1311 1181 A 27 LYS HBy A 27 LYS HEx 1.0 . 5.10 1312 1181 A 27 LYS HBx A 27 LYS HEx 1.0 . 5.10 1313 1181 A 27 LYS HEy A 27 LYS HBx 1.0 . 5.10 1314 1181 A 27 LYS HEy A 27 LYS HBy 1.0 . 5.10 1315 1182 A 38 ILE HG1y A 37 ARG HBx 1.0 . 3.08 1316 1182 A 37 ARG HBy A 38 ILE HG1y 1.0 . 3.08 1317 1183 A 29 ILE HG2% A 37 ARG HBx 1.0 . 4.75 1318 1183 A 29 ILE HG2% A 37 ARG HBy 1.0 . 4.75 1319 1184 A 25 THR HB A 26 PRO HDy 1.0 . 4.28 1320 1185 A 25 THR HB A 26 PRO HGx 1.0 . 5.50 1321 1186 A 27 LYS H A 27 LYS HBx 1.0 . 4.16 1322 1186 A 27 LYS H A 27 LYS HBy 1.0 . 4.16 1323 1187 A 25 THR HB A 26 PRO HGy 1.0 . 5.50 1324 1188 A 26 PRO HDx A 25 THR HB 1.0 . 4.70 1325 1189 A 92 THR HA A 95 TYR HD% 1.0 . 5.50 1326 1190 A 92 THR HA A 45 ALA HA 1.0 . 3.97 1327 1191 A 92 THR HA A 95 TYR HBx 1.0 . 5.35 1328 1192 A 92 THR HA A 45 ALA HB% 1.0 . 4.70 1329 1193 A 63 ILE H A 64 LYS HDy 1.0 . 5.50 1330 1194 A 64 LYS H A 64 LYS HDy 1.0 . 4.90 1331 1195 A 64 LYS HA A 64 LYS HDy 1.0 . 5.16 1332 1196 A 61 SER HA A 64 LYS HDy 1.0 . 4.26 1333 1197 A 64 LYS HBy A 64 LYS HDy 1.0 . 3.74 1334 1198 A 64 LYS HDx A 64 LYS HA 1.0 . 5.32 1335 1199 A 61 SER HA A 64 LYS HDx 1.0 . 4.09 1336 1200 A 64 LYS HDx A 65 LYS HDx 1.0 . 4.29 1337 1200 A 65 LYS HDy A 64 LYS HDx 1.0 . 4.29 1338 1201 A 76 TRP HBy A 100 MET HGx 1.0 . 4.70 1339 1202 A 77 GLN H A 76 TRP HBx 1.0 . 4.60 1340 1203 A 76 TRP HBx A 100 MET HGx 1.0 . 4.62 1341 1204 A 75 ALA HB% A 76 TRP HBx 1.0 . 5.50 1342 1205 A 54 ASN HA A 53 GLU HBy 1.0 . 5.37 1343 1206 A 63 ILE H A 64 LYS HDx 1.0 . 5.45 1344 1207 A 96 ARG HBx A 80 TYR HE% 1.0 . 5.20 1345 1208 A 95 TYR HBx A 96 ARG HBx 1.0 . 5.26 1346 1209 A 19 GLN H A 19 GLN HBy 1.0 . 4.00 1347 1210 A 52 LEU HA A 102 LYS HDx 1.0 . 4.53 1348 1210 A 52 LEU HA A 102 LYS HDy 1.0 . 4.53 1349 1211 A 52 LEU HD2% A 102 LYS HDx 1.0 . 3.55 1350 1211 A 52 LEU HD2% A 102 LYS HDy 1.0 . 3.55 1351 1212 A 102 LYS HA A 102 LYS HDx 1.0 . 3.88 1352 1212 A 102 LYS HA A 102 LYS HDy 1.0 . 3.88 1353 1213 A 96 ARG HBy A 93 ALA HA 1.0 . 5.50 1354 1214 A 64 LYS H A 63 ILE HG1x 1.0 . 5.50 1355 1215 A 19 GLN HBy A 19 GLN HE2x 1.0 . 5.50 1356 1216 A 19 GLN HBy A 21 VAL HG2% 1.0 . 5.50 1357 1217 A 93 ALA HB% A 83 GLU HBx 1.0 . 3.99 1358 1217 A 83 GLU HBy A 93 ALA HB% 1.0 . 3.99 1359 1218 A 20 ASN H A 19 GLN HBx 1.0 . 5.11 1360 1219 A 19 GLN H A 19 GLN HBx 1.0 . 4.05 1361 1220 A 64 LYS H A 63 ILE HG1y 1.0 . 5.01 1362 1221 A 63 ILE HG1y A 39 ILE HD1% 1.0 . 5.37 1363 1222 A 63 ILE H A 63 ILE HG1y 1.0 . 3.76 1364 1223 A 63 ILE HA A 63 ILE HG1y 1.0 . 3.73 1365 1224 A 63 ILE H A 63 ILE HG1x 1.0 . 4.26 1366 1225 A 63 ILE HA A 63 ILE HG1x 1.0 . 3.84 1367 1226 A 39 ILE HA A 63 ILE HG1x 1.0 . 5.16 1368 1227 A 49 ARG HBx A 95 TYR HE% 1.0 . 5.43 1369 1228 A 49 ARG HBx A 95 TYR HD% 1.0 . 5.50 1370 1229 A 88 GLU HBy A 89 ASN HA 1.0 . 5.23 1371 1230 A 88 GLU H A 88 GLU HBy 1.0 . 3.77 1372 1231 A 87 ASN HA A 88 GLU HBx 1.0 . 4.81 1373 1232 A 49 ARG HBy A 95 TYR HE% 1.0 . 4.88 1374 1233 A 91 PRO HA A 94 LYS HDx 1.0 . 5.14 1375 1234 A 94 LYS HDx A 94 LYS HA 1.0 . 4.95 1376 1235 A 36 GLN HBy A 38 ILE H 1.0 . 5.40 1377 1236 A 36 GLN HBy A 37 ARG HDx 1.0 . 5.41 1378 1236 A 36 GLN HBy A 37 ARG HDy 1.0 . 5.41 1379 1237 A 36 GLN HBx A 37 ARG HDx 1.0 . 5.50 1380 1237 A 37 ARG HDy A 36 GLN HBx 1.0 . 5.50 1381 1238 A 88 GLU HBx A 88 GLU HGx 1.0 . 2.79 1382 1238 A 88 GLU HBx A 88 GLU HGy 1.0 . 2.79 1383 1239 A 66 GLN H A 65 LYS HDx 1.0 . 5.35 1384 1239 A 65 LYS HDy A 66 GLN H 1.0 . 5.35 1385 1240 A 65 LYS HA A 65 LYS HDx 1.0 . 3.97 1386 1240 A 65 LYS HDy A 65 LYS HA 1.0 . 3.97 1387 1241 A 65 LYS HBx A 65 LYS HDx 1.0 . 3.18 1388 1241 A 65 LYS HDy A 65 LYS HBx 1.0 . 3.18 1389 1242 A 65 LYS HGx A 65 LYS HDx 1.0 . 2.66 1390 1242 A 65 LYS HDy A 65 LYS HGx 1.0 . 2.66 1391 1243 A 36 GLN HBy A 43 THR HG2% 1.0 . 5.44 1392 1244 A 43 THR HG2% A 36 GLN HBx 1.0 . 5.50 1393 1245 A 27 LYS H A 27 LYS HDx 1.0 . 5.12 1394 1245 A 27 LYS H A 27 LYS HDy 1.0 . 5.12 1395 1246 A 27 LYS HA A 27 LYS HDx 1.0 . 4.30 1396 1246 A 27 LYS HA A 27 LYS HDy 1.0 . 4.30 1397 1247 A 62 MET HA A 65 LYS HDx 1.0 . 3.89 1398 1247 A 65 LYS HDy A 62 MET HA 1.0 . 3.89 1399 1248 A 27 LYS HBy A 27 LYS HDx 1.0 . 3.15 1400 1248 A 27 LYS HBx A 27 LYS HDx 1.0 . 3.15 1401 1248 A 27 LYS HDy A 27 LYS HBx 1.0 . 3.15 1402 1248 A 27 LYS HBy A 27 LYS HDy 1.0 . 3.15 1403 1249 A 60 VAL H A 57 PRO HA 1.0 . 5.36 1404 1250 A 92 THR HB A 45 ALA HA 1.0 . 5.36 1405 1251 A 66 GLN HBy A 66 GLN HE2y 1.0 . 5.11 1406 1252 A 38 ILE HG1x A 66 GLN HBy 1.0 . 4.66 1407 1253 A 66 GLN HBy A 38 ILE HD1% 1.0 . 4.06 1408 1254 A 81 GLU HBy A 97 ALA HB% 1.0 . 5.34 1409 1255 A 81 GLU HBy A 82 GLN H 1.0 . 4.05 1410 1256 A 81 GLU HBx A 82 GLN H 1.0 . 4.11 1411 1257 A 27 LYS HGy A 27 LYS HDx 1.0 . 2.97 1412 1257 A 27 LYS HGy A 27 LYS HDy 1.0 . 2.97 1413 1258 A 63 ILE HA A 66 GLN HBy 1.0 . 4.66 1414 1259 A 66 GLN HBy A 38 ILE HG1y 1.0 . 5.50 1415 1260 A 46 GLU H A 46 GLU HBx 1.0 . 3.37 1416 1261 A 47 GLY H A 46 GLU HBx 1.0 . 4.03 1417 1262 A 68 THR H A 66 GLN HBx 1.0 . 4.98 1418 1263 A 96 ARG HGy A 80 TYR HE% 1.0 . 5.35 1419 1264 A 96 ARG HGy A 93 ALA HA 1.0 . 5.01 1420 1265 A 96 ARG HGx A 93 ALA HA 1.0 . 4.88 1421 1266 A 96 ARG HGx A 80 TYR HE% 1.0 . 5.50 1422 1267 A 103 ILE HA A 103 ILE HG1y 1.0 . 3.99 1423 1268 A 103 ILE HA A 107 TRP HE3 1.0 . 4.49 1424 1269 A 103 ILE HA A 60 VAL HG2% 1.0 . 3.80 1425 1270 A 103 ILE HG2% A 60 VAL HA 1.0 . 4.12 1426 1271 A 60 VAL HA A 60 VAL HG2% 1.0 . 3.71 1427 1272 A 60 VAL HG1% A 60 VAL HA 1.0 . 3.47 1428 1273 A 69 THR HB A 71 GLU HBy 1.0 . 3.99 1429 1274 A 63 ILE HG2% A 66 GLN HBx 1.0 . 5.50 1430 1275 A 29 ILE HD1% A 26 PRO HGx 1.0 . 4.22 1431 1276 A 71 GLU H A 71 GLU HBx 1.0 . 3.41 1432 1277 A 72 MET H A 71 GLU HBx 1.0 . 4.07 1433 1278 A 77 GLN HE2x A 101 LYS HDy 1.0 . 4.87 1434 1279 A 77 GLN HE2y A 101 LYS HDy 1.0 . 5.09 1435 1280 A 101 LYS HA A 101 LYS HDy 1.0 . 4.09 1436 1281 A 77 GLN HE2x A 101 LYS HDx 1.0 . 4.74 1437 1282 A 101 LYS HA A 101 LYS HDx 1.0 . 4.20 1438 1283 A 103 ILE HA A 106 LEU HBx 1.0 . 5.50 1439 1284 A 63 ILE HA A 65 LYS HDx 1.0 . 5.25 1440 1284 A 65 LYS HDy A 63 ILE HA 1.0 . 5.25 1441 1285 A 31 LEU H A 32 PRO HGy 1.0 . 5.50 1442 1286 A 31 LEU HD1% A 32 PRO HGy 1.0 . 5.50 1443 1287 A 33 ALA H A 32 PRO HGy 1.0 . 4.50 1444 1288 A 85 GLN H A 85 GLN HBy 1.0 . 3.35 1445 1289 A 83 GLU H A 84 GLN HBx 1.0 . 4.54 1446 1289 A 83 GLU H A 84 GLN HBy 1.0 . 4.54 1447 1290 A 81 GLU HA A 84 GLN HBx 1.0 . 3.12 1448 1290 A 84 GLN HBy A 81 GLU HA 1.0 . 3.12 1449 1291 A 68 THR HA A 26 PRO HGx 1.0 . 4.00 1450 1292 A 77 GLN HBy A 79 PHE H 1.0 . 5.50 1451 1293 A 29 ILE HD1% A 26 PRO HGy 1.0 . 3.92 1452 1294 A 84 GLN HGx A 84 GLN HBx 1.0 . 2.86 1453 1294 A 84 GLN HBy A 84 GLN HGx 1.0 . 2.86 1454 1295 A 33 ALA H A 32 PRO HGx 1.0 . 5.26 1455 1296 A 27 LYS H A 26 PRO HGx 1.0 . 5.49 1456 1297 A 77 GLN HBy A 77 GLN HE2y 1.0 . 5.30 1457 1298 A 77 GLN HBy A 77 GLN HE2x 1.0 . 5.50 1458 1299 A 56 GLN HA A 57 PRO HGx 1.0 . 4.47 1459 1299 A 56 GLN HA A 57 PRO HGy 1.0 . 4.47 1460 1300 A 106 LEU HD2% A 57 PRO HGx 1.0 . 5.33 1461 1300 A 106 LEU HD2% A 57 PRO HGy 1.0 . 5.33 1462 1301 A 58 ALA H A 57 PRO HGx 1.0 . 5.22 1463 1301 A 58 ALA H A 57 PRO HGy 1.0 . 5.22 1464 1302 A 78 ASP H A 77 GLN HBx 1.0 . 4.19 1465 1303 A 77 GLN HBx A 77 GLN HE2y 1.0 . 4.84 1466 1304 A 77 GLN HBx A 77 GLN HE2x 1.0 . 5.42 1467 1305 A 51 ARG H A 50 GLN HBy 1.0 . 3.64 1468 1306 A 23 PRO HBy A 24 PRO HDx 1.0 . 4.08 1469 1307 A 34 PHE H A 32 PRO HA 1.0 . 5.05 1470 1308 A 36 GLN H A 32 PRO HA 1.0 . 4.68 1471 1309 A 32 PRO HDx A 31 LEU HG 1.0 . 5.26 1472 1310 A 41 TRP HBy A 48 ALA HA 1.0 . 4.10 1473 1311 A 41 TRP HBy A 51 ARG HBx 1.0 . 4.99 1474 1311 A 51 ARG HBy A 41 TRP HBy 1.0 . 4.99 1475 1312 A 99 LEU HD1% A 41 TRP HBy 1.0 . 4.20 1476 1313 A 39 ILE HG2% A 41 TRP HBy 1.0 . 4.58 1477 1314 A 41 TRP HBx A 99 LEU HD2% 1.0 . 5.50 1478 1315 A 41 TRP HBx A 48 ALA HB% 1.0 . 4.91 1479 1316 A 41 TRP HBx A 99 LEU HD1% 1.0 . 4.14 1480 1317 A 81 GLU H A 82 GLN HBx 1.0 . 5.50 1481 1318 A 32 PRO HDy A 31 LEU HG 1.0 . 4.30 1482 1319 A 76 TRP HH2 A 31 LEU HG 1.0 . 5.09 1483 1320 A 31 LEU HA A 31 LEU HG 1.0 . 4.06 1484 1321 A 39 ILE H A 38 ILE HG1y 1.0 . 5.08 1485 1322 A 34 PHE HDy A 38 ILE HG1y 1.0 . 5.50 1486 1323 A 38 ILE HG1y A 38 ILE HA 1.0 . 3.74 1487 1324 A 38 ILE HG1x A 37 ARG H 1.0 . 5.38 1488 1325 A 41 TRP HBx A 51 ARG HBx 1.0 . 4.96 1489 1325 A 41 TRP HBx A 51 ARG HBy 1.0 . 4.96 1490 1326 A 82 GLN H A 82 GLN HBy 1.0 . 3.63 1491 1327 A 83 GLU H A 82 GLN HBy 1.0 . 4.01 1492 1328 A 83 GLU H A 82 GLN HBx 1.0 . 4.06 1493 1329 A 87 ASN HA A 86 ARG HGy 1.0 . 5.30 1494 1330 A 86 ARG H A 86 ARG HGx 1.0 . 4.06 1495 1331 A 87 ASN HA A 86 ARG HGx 1.0 . 5.50 1496 1332 A 38 ILE H A 38 ILE HG1y 1.0 . 4.01 1497 1333 A 38 ILE HG1y A 34 PHE HBx 1.0 . 5.50 1498 1333 A 34 PHE HBy A 38 ILE HG1y 1.0 . 5.50 1499 1334 A 38 ILE HG1y A 66 GLN HGx 1.0 . 4.99 1500 1334 A 66 GLN HGy A 38 ILE HG1y 1.0 . 4.99 1501 1335 A 78 ASP H A 74 THR HA 1.0 . 4.55 1502 1336 A 77 GLN HBy A 74 THR HA 1.0 . 3.63 1503 1337 A 74 THR HG2% A 74 THR HA 1.0 . 3.51 1504 1338 A 73 ILE HG2% A 74 THR HA 1.0 . 4.90 1505 1339 A 104 ALA HB% A 74 THR HA 1.0 . 4.94 1506 1340 A 86 ARG HGy A 86 ARG HA 1.0 . 3.96 1507 1341 A 86 ARG HGx A 86 ARG HBx 1.0 . 2.98 1508 1341 A 86 ARG HBy A 86 ARG HGx 1.0 . 2.98 1509 1342 A 87 ASN H A 86 ARG HGx 1.0 . 5.31 1510 1343 A 41 TRP HA A 51 ARG HGx 1.0 . 4.86 1511 1344 A 95 TYR HA A 98 ARG HGx 1.0 . 4.93 1512 1344 A 98 ARG HGy A 95 TYR HA 1.0 . 4.93 1513 1345 A 98 ARG HBy A 98 ARG HGx 1.0 . 2.87 1514 1345 A 98 ARG HBy A 98 ARG HGy 1.0 . 2.87 1515 1346 A 52 LEU HD2% A 98 ARG HGx 1.0 . 5.17 1516 1346 A 52 LEU HD2% A 98 ARG HGy 1.0 . 5.17 1517 1347 A 99 LEU H A 98 ARG HGx 1.0 . 5.04 1518 1347 A 99 LEU H A 98 ARG HGy 1.0 . 5.04 1519 1348 A 51 ARG H A 51 ARG HGx 1.0 . 5.09 1520 1349 A 95 TYR HD% A 91 PRO HGy 1.0 . 5.50 1521 1350 A 95 TYR HD% A 91 PRO HGx 1.0 . 5.50 1522 1351 A 23 PRO HA A 24 PRO HGy 1.0 . 4.70 1523 1352 A 23 PRO HA A 24 PRO HGx 1.0 . 4.66 1524 1353 A 25 THR H A 24 PRO HGx 1.0 . 5.07 1525 1354 A 99 LEU H A 99 LEU HG 1.0 . 4.73 1526 1355 A 103 ILE H A 99 LEU HG 1.0 . 5.50 1527 1356 A 38 ILE H A 37 ARG HGy 1.0 . 5.11 1528 1357 A 37 ARG H A 37 ARG HGy 1.0 . 3.99 1529 1358 A 37 ARG HGy A 37 ARG HA 1.0 . 3.89 1530 1359 A 38 ILE H A 37 ARG HGx 1.0 . 4.98 1531 1360 A 37 ARG H A 37 ARG HGx 1.0 . 4.00 1532 1361 A 99 LEU H A 99 LEU HD1% 1.0 . 4.45 1533 1362 A 79 PHE HD% A 23 PRO HGy 1.0 . 5.50 1534 1363 A 92 THR H A 91 PRO HGy 1.0 . 4.38 1535 1364 A 95 TYR HE% A 91 PRO HGy 1.0 . 5.50 1536 1365 A 90 ASN HA A 91 PRO HGy 1.0 . 4.54 1537 1366 A 45 ALA HB% A 91 PRO HGy 1.0 . 4.44 1538 1367 A 45 ALA HB% A 91 PRO HGx 1.0 . 4.59 1539 1368 A 92 THR H A 91 PRO HGx 1.0 . 4.43 1540 1369 A 25 THR H A 24 PRO HGy 1.0 . 5.17 1541 1370 A 22 LEU HG A 22 LEU HA 1.0 . 4.09 1542 1371 A 79 PHE HE% A 22 LEU HG 1.0 . 5.22 1543 1372 A 49 ARG HGy A 95 TYR HE% 1.0 . 5.50 1544 1373 A 52 LEU H A 52 LEU HG 1.0 . 4.67 1545 1374 A 22 LEU H A 22 LEU HG 1.0 . 3.43 1546 1375 A 49 ARG H A 49 ARG HGy 1.0 . 4.74 1547 1376 A 49 ARG HA A 49 ARG HGy 1.0 . 4.11 1548 1377 A 49 ARG HGy A 50 GLN HA 1.0 . 5.21 1549 1378 A 52 LEU HD1% A 53 GLU H 1.0 . 4.59 1550 1379 A 52 LEU HD1% A 52 LEU HBx 1.0 . 3.85 1551 1380 A 52 LEU HD1% A 98 ARG H 1.0 . 4.96 1552 1381 A 52 LEU HD1% A 95 TYR HA 1.0 . 4.14 1553 1382 A 52 LEU HA A 52 LEU HD1% 1.0 . 4.00 1554 1383 A 52 LEU HD1% A 52 LEU HBy 1.0 . 3.35 1555 1384 A 98 ARG HBy A 52 LEU HD1% 1.0 . 3.66 1556 1385 A 102 LYS HA A 106 LEU HG 1.0 . 5.50 1557 1386 A 103 ILE HA A 106 LEU HG 1.0 . 5.02 1558 1387 A 106 LEU HG A 60 VAL HG2% 1.0 . 5.50 1559 1388 A 15 LEU HG A 15 LEU HA 1.0 . 4.14 1560 1389 A 15 LEU HG A 16 GLN H 1.0 . 5.50 1561 1390 A 91 PRO HA A 94 LYS H 1.0 . 3.75 1562 1391 A 91 PRO HA A 94 LYS HBx 1.0 . 3.18 1563 1391 A 91 PRO HA A 94 LYS HBy 1.0 . 3.18 1564 1392 A 91 PRO HA A 94 LYS HDy 1.0 . 4.34 1565 1393 A 72 MET HBx A 73 ILE HG1y 1.0 . 5.48 1566 1394 A 70 LEU HD1% A 73 ILE HG1y 1.0 . 5.32 1567 1395 A 107 TRP HH2 A 73 ILE HG1y 1.0 . 4.55 1568 1396 A 70 LEU HA A 73 ILE HG1x 1.0 . 4.74 1569 1397 A 73 ILE HG2% A 73 ILE HG1x 1.0 . 4.21 1570 1398 A 71 GLU HA A 70 LEU HG 1.0 . 5.17 1571 1399 A 56 GLN H A 55 ILE HA 1.0 . 2.87 1572 1400 A 54 ASN H A 55 ILE HA 1.0 . 4.45 1573 1401 A 56 GLN HA A 55 ILE HA 1.0 . 4.61 1574 1402 A 55 ILE HG1y A 55 ILE HA 1.0 . 3.33 1575 1403 A 55 ILE HA A 55 ILE HG1x 1.0 . 3.66 1576 1404 A 22 LEU H A 22 LEU HD1% 1.0 . 4.32 1577 1405 A 22 LEU HD1% A 76 TRP HH2 1.0 . 3.69 1578 1406 A 22 LEU HD1% A 22 LEU HA 1.0 . 4.10 1579 1407 A 31 LEU HBy A 22 LEU HD1% 1.0 . 4.46 1580 1408 A 31 LEU HBx A 22 LEU HD1% 1.0 . 4.07 1581 1409 A 22 LEU HBy A 22 LEU HD1% 1.0 . 3.18 1582 1410 A 14 ASN HBx A 13 PRO HA 1.0 . 5.27 1583 1411 A 102 LYS HBx A 106 LEU HD2% 1.0 . 4.60 1584 1412 A 56 GLN H A 106 LEU HD2% 1.0 . 5.44 1585 1413 A 103 ILE H A 106 LEU HD2% 1.0 . 5.26 1586 1414 A 86 ARG HGx A 83 GLU HA 1.0 . 4.00 1587 1415 A 27 LYS H A 26 PRO HA 1.0 . 2.88 1588 1416 A 26 PRO HA A 27 LYS HGx 1.0 . 4.45 1589 1417 A 66 GLN H A 65 LYS HGy 1.0 . 5.46 1590 1418 A 62 MET HA A 65 LYS HGy 1.0 . 4.84 1591 1419 A 65 LYS H A 65 LYS HGy 1.0 . 4.07 1592 1420 A 65 LYS H A 65 LYS HGx 1.0 . 4.14 1593 1421 A 62 MET HA A 65 LYS HGx 1.0 . 4.81 1594 1422 A 106 LEU H A 106 LEU HD2% 1.0 . 4.14 1595 1423 A 107 TRP H A 106 LEU HD2% 1.0 . 5.28 1596 1424 A 60 VAL H A 106 LEU HD2% 1.0 . 5.50 1597 1425 A 106 LEU HD2% A 56 GLN HA 1.0 . 4.34 1598 1426 A 106 LEU HD2% A 106 LEU HA 1.0 . 4.29 1599 1427 A 106 LEU HD2% A 57 PRO HA 1.0 . 3.98 1600 1428 A 103 ILE HA A 106 LEU HD2% 1.0 . 3.92 1601 1429 A 106 LEU HD2% A 102 LYS HEx 1.0 . 3.82 1602 1429 A 106 LEU HD2% A 102 LYS HEy 1.0 . 3.82 1603 1430 A 106 LEU HBx A 106 LEU HD2% 1.0 . 3.76 1604 1431 A 27 LYS HGy A 27 LYS HA 1.0 . 3.76 1605 1432 A 27 LYS H A 27 LYS HGx 1.0 . 4.11 1606 1433 A 27 LYS HA A 27 LYS HGx 1.0 . 3.78 1607 1434 A 61 SER HA A 64 LYS HGy 1.0 . 4.74 1608 1435 A 107 TRP HE1 A 70 LEU HD2% 1.0 . 4.62 1609 1436 A 70 LEU H A 70 LEU HD2% 1.0 . 4.25 1610 1437 A 71 GLU H A 70 LEU HD2% 1.0 . 4.82 1611 1438 A 70 LEU HA A 70 LEU HD2% 1.0 . 4.23 1612 1439 A 70 LEU HBy A 70 LEU HD2% 1.0 . 3.42 1613 1440 A 107 TRP HBx A 70 LEU HD2% 1.0 . 4.70 1614 1441 A 69 THR H A 68 THR HA 1.0 . 3.00 1615 1442 A 34 PHE HE% A 68 THR HA 1.0 . 4.80 1616 1443 A 26 PRO HBx A 68 THR HA 1.0 . 4.54 1617 1444 A 106 LEU HD2% A 102 LYS HGy 1.0 . 4.69 1618 1445 A 105 ASP H A 101 LYS HGx 1.0 . 5.34 1619 1445 A 105 ASP H A 101 LYS HGy 1.0 . 5.34 1620 1446 A 102 LYS HGy A 102 LYS HEx 1.0 . 3.51 1621 1446 A 102 LYS HEy A 102 LYS HGy 1.0 . 3.51 1622 1447 A 77 GLN HE2x A 101 LYS HGx 1.0 . 4.46 1623 1447 A 101 LYS HGy A 77 GLN HE2x 1.0 . 4.46 1624 1448 A 29 ILE HG1y A 30 PRO HDx 1.0 . 5.50 1625 1449 A 30 PRO HDx A 29 ILE HG1x 1.0 . 5.50 1626 1450 A 29 ILE HG2% A 29 ILE HG1x 1.0 . 4.10 1627 1451 A 102 LYS HGx A 102 LYS HEx 1.0 . 3.56 1628 1451 A 102 LYS HEy A 102 LYS HGx 1.0 . 3.56 1629 1452 A 102 LYS H A 102 LYS HGx 1.0 . 4.64 1630 1453 A 102 LYS HA A 102 LYS HGx 1.0 . 3.86 1631 1454 A 41 TRP HE1 A 31 LEU HD1% 1.0 . 5.50 1632 1455 A 31 LEU H A 31 LEU HD1% 1.0 . 4.48 1633 1456 A 31 LEU HD1% A 41 TRP HZ2 1.0 . 4.55 1634 1457 A 31 LEU HD1% A 76 TRP HH2 1.0 . 4.14 1635 1458 A 31 LEU HD1% A 32 PRO HA 1.0 . 4.73 1636 1459 A 31 LEU HD1% A 31 LEU HA 1.0 . 4.07 1637 1460 A 31 LEU HD1% A 32 PRO HDy 1.0 . 4.51 1638 1461 A 34 PHE HBy A 31 LEU HD1% 1.0 . 4.80 1639 1461 A 31 LEU HD1% A 34 PHE HBx 1.0 . 4.80 1640 1462 A 31 LEU HBy A 31 LEU HD1% 1.0 . 3.41 1641 1463 A 31 LEU HD1% A 22 LEU HD1% 1.0 . 4.12 1642 1464 A 31 LEU HD1% A 22 LEU HD2% 1.0 . 4.29 1643 1465 A 64 LYS HGy A 65 LYS H 1.0 . 4.82 1644 1466 A 64 LYS HGy A 63 ILE HA 1.0 . 5.50 1645 1467 A 107 TRP HE1 A 64 LYS HGx 1.0 . 5.50 1646 1468 A 64 LYS HGx A 65 LYS H 1.0 . 5.50 1647 1469 A 61 SER HA A 64 LYS HGx 1.0 . 4.96 1648 1470 A 15 LEU HA A 17 LEU HD2% 1.0 . 4.42 1649 1471 A 17 LEU H A 17 LEU HD2% 1.0 . 5.50 1650 1472 A 38 ILE HA A 37 ARG HBx 1.0 . 4.45 1651 1472 A 37 ARG HBy A 38 ILE HA 1.0 . 4.45 1652 1473 A 15 LEU HG A 17 LEU HD2% 1.0 . 3.25 1653 1474 A 14 ASN HBy A 17 LEU HD2% 1.0 . 5.50 1654 1475 A 31 LEU H A 30 PRO HA 1.0 . 2.89 1655 1476 A 30 PRO HA A 32 PRO HDx 1.0 . 4.63 1656 1477 A 49 ARG HA A 95 TYR HA 1.0 . 5.39 1657 1478 A 94 LYS HGx A 95 TYR HA 1.0 . 5.16 1658 1479 A 25 THR HG2% A 24 PRO HA 1.0 . 4.71 1659 1480 A 99 LEU H A 95 TYR HA 1.0 . 5.03 1660 1481 A 98 ARG H A 95 TYR HA 1.0 . 4.12 1661 1482 A 95 TYR HE% A 95 TYR HA 1.0 . 4.80 1662 1483 A 95 TYR HA A 98 ARG HBx 1.0 . 3.88 1663 1484 A 95 TYR HA A 94 LYS HBx 1.0 . 5.24 1664 1484 A 94 LYS HBy A 95 TYR HA 1.0 . 5.24 1665 1485 A 34 PHE H A 31 LEU HD2% 1.0 . 4.94 1666 1486 A 32 PRO HA A 31 LEU HD2% 1.0 . 5.44 1667 1487 A 31 LEU HA A 31 LEU HD2% 1.0 . 3.37 1668 1488 A 32 PRO HDy A 31 LEU HD2% 1.0 . 5.50 1669 1489 A 32 PRO HDx A 31 LEU HD2% 1.0 . 5.50 1670 1490 A 34 PHE HBy A 31 LEU HD2% 1.0 . 3.93 1671 1490 A 31 LEU HD2% A 34 PHE HBx 1.0 . 3.93 1672 1491 A 25 THR H A 24 PRO HA 1.0 . 2.76 1673 1492 A 106 LEU HBy A 60 VAL HG2% 1.0 . 3.37 1674 1493 A 61 SER H A 60 VAL HG2% 1.0 . 4.39 1675 1494 A 106 LEU H A 60 VAL HG2% 1.0 . 4.59 1676 1495 A 59 ASP H A 60 VAL HG2% 1.0 . 4.60 1677 1496 A 60 VAL H A 60 VAL HG2% 1.0 . 3.19 1678 1497 A 60 VAL HG2% A 106 LEU HA 1.0 . 5.28 1679 1498 A 57 PRO HA A 60 VAL HG2% 1.0 . 3.82 1680 1499 A 60 VAL HG2% A 61 SER HBx 1.0 . 5.48 1681 1499 A 61 SER HBy A 60 VAL HG2% 1.0 . 5.48 1682 1500 A 59 ASP HBy A 60 VAL HG2% 1.0 . 4.39 1683 1501 A 106 LEU HBx A 60 VAL HG2% 1.0 . 3.42 1684 1502 A 72 MET HBy A 73 ILE HA 1.0 . 5.50 1685 1503 A 77 GLN HBy A 73 ILE HA 1.0 . 5.50 1686 1504 A 76 TRP H A 73 ILE HA 1.0 . 4.42 1687 1505 A 61 SER HBx A 65 LYS HDx 1.0 . 3.75 1688 1505 A 61 SER HBy A 65 LYS HDx 1.0 . 3.75 1689 1505 A 65 LYS HDy A 61 SER HBx 1.0 . 3.75 1690 1505 A 65 LYS HDy A 61 SER HBy 1.0 . 3.75 1691 1506 A 58 ALA HB% A 61 SER HBx 1.0 . 4.56 1692 1506 A 61 SER HBy A 58 ALA HB% 1.0 . 4.56 1693 1507 A 61 SER HBx A 65 LYS HEx 1.0 . 5.50 1694 1507 A 61 SER HBy A 65 LYS HEx 1.0 . 5.50 1695 1507 A 65 LYS HEy A 61 SER HBx 1.0 . 5.50 1696 1507 A 61 SER HBy A 65 LYS HEy 1.0 . 5.50 1697 1508 A 56 GLN H A 60 VAL HG2% 1.0 . 5.20 1698 1509 A 100 MET HE% A 76 TRP HA 1.0 . 5.50 1699 1510 A 22 LEU H A 21 VAL HA 1.0 . 2.68 1700 1511 A 84 GLN HE2x A 94 LYS HGy 1.0 . 5.09 1701 1512 A 91 PRO HA A 94 LYS HGy 1.0 . 4.81 1702 1513 A 95 TYR H A 94 LYS HGy 1.0 . 5.10 1703 1514 A 94 LYS H A 94 LYS HGy 1.0 . 4.96 1704 1515 A 52 LEU HD2% A 95 TYR HD% 1.0 . 5.20 1705 1516 A 52 LEU HD2% A 102 LYS HEx 1.0 . 4.35 1706 1516 A 52 LEU HD2% A 102 LYS HEy 1.0 . 4.35 1707 1517 A 52 LEU HD2% A 52 LEU HBy 1.0 . 4.10 1708 1518 A 52 LEU HD2% A 99 LEU HA 1.0 . 3.10 1709 1519 A 91 PRO HA A 94 LYS HGx 1.0 . 5.32 1710 1520 A 95 TYR HE% A 94 LYS HGx 1.0 . 5.50 1711 1521 A 75 ALA HB% A 76 TRP HA 1.0 . 4.73 1712 1522 A 79 PHE HD% A 76 TRP HA 1.0 . 4.56 1713 1523 A 79 PHE HBy A 76 TRP HA 1.0 . 3.71 1714 1524 A 79 PHE HBx A 76 TRP HA 1.0 . 3.95 1715 1525 A 23 PRO HGy A 76 TRP HA 1.0 . 4.61 1716 1526 A 23 PRO HGx A 76 TRP HA 1.0 . 4.18 1717 1527 A 80 TYR HA A 79 PHE HA 1.0 . 4.82 1718 1528 A 106 LEU H A 107 TRP HA 1.0 . 4.93 1719 1529 A 107 TRP HE3 A 107 TRP HA 1.0 . 3.80 1720 1530 A 104 ALA HA A 107 TRP HA 1.0 . 4.73 1721 1531 A 60 VAL HG1% A 107 TRP HA 1.0 . 3.55 1722 1532 A 107 TRP HD1 A 107 TRP HA 1.0 . 5.14 1723 1533 A 22 LEU H A 22 LEU HD2% 1.0 . 4.16 1724 1534 A 79 PHE HE% A 22 LEU HD2% 1.0 . 3.51 1725 1535 A 22 LEU HD2% A 22 LEU HA 1.0 . 3.20 1726 1536 A 22 LEU HD2% A 22 LEU HBx 1.0 . 3.61 1727 1537 A 22 LEU HD2% A 31 LEU HD2% 1.0 . 4.36 1728 1538 A 94 LYS H A 94 LYS HGx 1.0 . 4.91 1729 1539 A 79 PHE HD% A 79 PHE HA 1.0 . 3.79 1730 1540 A 60 VAL HB A 107 TRP HA 1.0 . 5.32 1731 1541 A 70 LEU HD1% A 107 TRP HA 1.0 . 5.33 1732 1542 A 23 PRO HDy A 22 LEU HD2% 1.0 . 4.13 1733 1543 A 81 GLU H A 79 PHE HA 1.0 . 5.22 1734 1544 A 98 ARG H A 96 ARG HA 1.0 . 5.43 1735 1545 A 99 LEU H A 96 ARG HA 1.0 . 4.05 1736 1546 A 96 ARG HA A 95 TYR HA 1.0 . 5.50 1737 1547 A 95 TYR HBx A 96 ARG HA 1.0 . 5.09 1738 1548 A 99 LEU HBy A 96 ARG HA 1.0 . 3.64 1739 1549 A 99 LEU HBx A 96 ARG HA 1.0 . 3.84 1740 1550 A 96 ARG HA A 99 LEU HD1% 1.0 . 4.36 1741 1551 A 99 LEU HD2% A 96 ARG HA 1.0 . 5.26 1742 1552 A 96 ARG HGy A 96 ARG HA 1.0 . 3.90 1743 1553 A 96 ARG HGx A 96 ARG HA 1.0 . 4.05 1744 1554 A 41 TRP HE3 A 96 ARG HA 1.0 . 5.23 1745 1555 A 43 THR HA A 44 GLY H 1.0 . 2.89 1746 1556 A 16 GLN H A 15 LEU HD1% 1.0 . 5.11 1747 1556 A 15 LEU HD2% A 16 GLN H 1.0 . 5.11 1748 1557 A 15 LEU HA A 15 LEU HD1% 1.0 . 3.25 1749 1557 A 15 LEU HD2% A 15 LEU HA 1.0 . 3.25 1750 1558 A 15 LEU HBy A 15 LEU HD1% 1.0 . 2.84 1751 1558 A 15 LEU HBx A 15 LEU HD1% 1.0 . 2.84 1752 1558 A 15 LEU HD2% A 15 LEU HBx 1.0 . 2.84 1753 1558 A 15 LEU HD2% A 15 LEU HBy 1.0 . 2.84 1754 1559 A 18 LYS HGx A 15 LEU HD1% 1.0 . 3.97 1755 1559 A 15 LEU HD2% A 18 LYS HGx 1.0 . 3.97 1756 1560 A 80 TYR HD% A 77 GLN HA 1.0 . 5.20 1757 1561 A 100 MET HGy A 77 GLN HA 1.0 . 4.65 1758 1562 A 97 ALA HB% A 77 GLN HA 1.0 . 4.86 1759 1563 A 105 ASP H A 106 LEU HD1% 1.0 . 5.50 1760 1564 A 106 LEU HD1% A 106 LEU HA 1.0 . 2.86 1761 1565 A 106 LEU HD1% A 57 PRO HGx 1.0 . 4.52 1762 1565 A 106 LEU HD1% A 57 PRO HGy 1.0 . 4.52 1763 1566 A 106 LEU HBx A 106 LEU HD1% 1.0 . 3.35 1764 1567 A 23 PRO HA A 24 PRO HDy 1.0 . 3.07 1765 1568 A 69 THR HB A 68 THR HG2% 1.0 . 5.50 1766 1569 A 68 THR HG2% A 64 LYS HA 1.0 . 5.50 1767 1570 A 106 LEU HD1% A 57 PRO HA 1.0 . 4.13 1768 1571 A 106 LEU HD1% A 57 PRO HDx 1.0 . 4.93 1769 1572 A 76 TRP HE1 A 25 THR HG2% 1.0 . 3.70 1770 1573 A 25 THR HG2% A 34 PHE H 1.0 . 4.79 1771 1574 A 25 THR HG2% A 25 THR H 1.0 . 4.02 1772 1575 A 25 THR HG2% A 25 THR HA 1.0 . 3.32 1773 1576 A 25 THR HG2% A 31 LEU HA 1.0 . 3.93 1774 1577 A 25 THR HG2% A 34 PHE HA 1.0 . 5.50 1775 1578 A 25 THR HG2% A 34 PHE HBx 1.0 . 3.69 1776 1578 A 34 PHE HBy A 25 THR HG2% 1.0 . 3.69 1777 1579 A 25 THR HG2% A 26 PRO HGy 1.0 . 5.47 1778 1580 A 23 PRO HA A 24 PRO HBx 1.0 . 5.28 1779 1580 A 24 PRO HBy A 23 PRO HA 1.0 . 5.28 1780 1581 A 63 ILE HD1% A 39 ILE HA 1.0 . 3.70 1781 1582 A 39 ILE HA A 39 ILE HG1x 1.0 . 4.05 1782 1582 A 39 ILE HG1y A 39 ILE HA 1.0 . 4.05 1783 1583 A 63 ILE HG1y A 39 ILE HA 1.0 . 4.97 1784 1584 A 68 THR HG2% A 26 PRO HDy 1.0 . 5.50 1785 1585 A 68 THR HG2% A 72 MET HBy 1.0 . 5.38 1786 1586 A 72 MET HBx A 68 THR HG2% 1.0 . 3.79 1787 1587 A 68 THR HG2% A 73 ILE HG1y 1.0 . 3.78 1788 1588 A 73 ILE HD1% A 68 THR HG2% 1.0 . 3.41 1789 1589 A 68 THR HG2% A 69 THR H 1.0 . 3.50 1790 1590 A 68 THR HG2% A 107 TRP HZ2 1.0 . 4.13 1791 1591 A 68 THR HG2% A 68 THR H 1.0 . 4.23 1792 1592 A 68 THR HG2% A 34 PHE HE% 1.0 . 3.46 1793 1593 A 68 THR HG2% A 69 THR HA 1.0 . 4.84 1794 1594 A 68 THR HG2% A 68 THR HA 1.0 . 3.30 1795 1595 A 68 THR HG2% A 63 ILE HG2% 1.0 . 3.48 1796 1596 A 99 LEU H A 99 LEU HD2% 1.0 . 4.52 1797 1597 A 99 LEU HD2% A 100 MET H 1.0 . 4.02 1798 1598 A 103 ILE H A 99 LEU HD2% 1.0 . 4.21 1799 1599 A 99 LEU HD2% A 99 LEU HA 1.0 . 3.24 1800 1600 A 52 LEU HA A 99 LEU HD2% 1.0 . 3.20 1801 1601 A 99 LEU HBy A 99 LEU HD2% 1.0 . 3.95 1802 1602 A 60 VAL HG1% A 61 SER H 1.0 . 3.94 1803 1603 A 60 VAL HG1% A 106 LEU H 1.0 . 4.61 1804 1604 A 60 VAL HG1% A 57 PRO HA 1.0 . 5.41 1805 1605 A 60 VAL HG1% A 61 SER HA 1.0 . 4.46 1806 1606 A 60 VAL HG1% A 103 ILE HA 1.0 . 3.07 1807 1607 A 107 TRP HBx A 60 VAL HG1% 1.0 . 4.83 1808 1608 A 106 LEU HBy A 60 VAL HG1% 1.0 . 3.99 1809 1609 A 60 VAL HG1% A 106 LEU HBx 1.0 . 4.01 1810 1610 A 29 ILE HA A 30 PRO HDy 1.0 . 2.94 1811 1611 A 29 ILE HA A 30 PRO HDx 1.0 . 3.22 1812 1612 A 29 ILE HG1y A 29 ILE HA 1.0 . 3.80 1813 1613 A 31 LEU HA A 34 PHE HBx 1.0 . 3.46 1814 1613 A 34 PHE HBy A 31 LEU HA 1.0 . 3.46 1815 1614 A 33 ALA H A 34 PHE HA 1.0 . 4.52 1816 1615 A 34 PHE HDy A 34 PHE HA 1.0 . 3.64 1817 1616 A 31 LEU HA A 34 PHE HA 1.0 . 5.38 1818 1617 A 29 ILE HG1y A 34 PHE HA 1.0 . 3.34 1819 1618 A 38 ILE HG1x A 34 PHE HA 1.0 . 4.66 1820 1619 A 29 ILE HD1% A 34 PHE HA 1.0 . 3.58 1821 1620 A 80 TYR HA A 81 GLU HA 1.0 . 5.24 1822 1621 A 84 GLN H A 81 GLU HA 1.0 . 4.34 1823 1622 A 85 GLN H A 81 GLU HA 1.0 . 5.38 1824 1623 A 81 GLU HA A 81 GLU HGy 1.0 . 3.83 1825 1624 A 81 GLU HA A 81 GLU HGx 1.0 . 3.24 1826 1625 A 81 GLU HA A 97 ALA HB% 1.0 . 4.12 1827 1626 A 72 MET HA A 75 ALA H 1.0 . 4.24 1828 1627 A 49 ARG HA A 53 GLU H 1.0 . 4.82 1829 1628 A 49 ARG HA A 52 LEU HBy 1.0 . 3.61 1830 1629 A 49 ARG HA A 52 LEU HG 1.0 . 4.55 1831 1630 A 49 ARG HA A 52 LEU HD1% 1.0 . 3.63 1832 1631 A 49 ARG HA A 52 LEU HD2% 1.0 . 5.44 1833 1632 A 107 TRP HE1 A 69 THR HG2% 1.0 . 5.50 1834 1633 A 71 GLU H A 69 THR HG2% 1.0 . 4.34 1835 1634 A 64 LYS HGy A 64 LYS HA 1.0 . 3.62 1836 1635 A 71 GLU HA A 71 GLU HGx 1.0 . 3.52 1837 1636 A 71 GLU HA A 74 THR HG2% 1.0 . 4.30 1838 1637 A 74 THR HB A 71 GLU HA 1.0 . 4.44 1839 1638 A 71 GLU HA A 70 LEU HD1% 1.0 . 5.17 1840 1639 A 70 LEU H A 69 THR HG2% 1.0 . 3.83 1841 1640 A 69 THR HG2% A 69 THR H 1.0 . 3.37 1842 1641 A 69 THR HG2% A 107 TRP HZ2 1.0 . 4.35 1843 1642 A 107 TRP HH2 A 69 THR HG2% 1.0 . 5.50 1844 1643 A 69 THR HA A 69 THR HG2% 1.0 . 3.16 1845 1644 A 69 THR HG2% A 68 THR HA 1.0 . 4.12 1846 1645 A 69 THR HG2% A 72 MET HBy 1.0 . 5.05 1847 1646 A 70 LEU HBx A 69 THR HG2% 1.0 . 5.50 1848 1647 A 75 ALA H A 74 THR HG2% 1.0 . 4.26 1849 1648 A 70 LEU HA A 74 THR HG2% 1.0 . 4.85 1850 1649 A 77 GLN HBy A 74 THR HG2% 1.0 . 5.29 1851 1650 A 74 THR HG2% A 73 ILE HB 1.0 . 4.44 1852 1651 A 74 THR HG2% A 70 LEU HD1% 1.0 . 3.61 1853 1652 A 64 LYS HGx A 64 LYS HA 1.0 . 3.67 1854 1653 A 73 ILE H A 74 THR HG2% 1.0 . 4.76 1855 1654 A 70 LEU HA A 69 THR HA 1.0 . 4.70 1856 1655 A 7 THR HG2% A 6 THR H 1.0 . 5.31 1857 1656 A 43 THR HG2% A 43 THR HA 1.0 . 3.30 1858 1657 A 107 TRP HE1 A 69 THR HA 1.0 . 4.71 1859 1658 A 70 LEU H A 69 THR HA 1.0 . 3.10 1860 1659 A 107 TRP HH2 A 69 THR HA 1.0 . 4.36 1861 1660 A 77 GLN HE2x A 101 LYS HA 1.0 . 4.91 1862 1661 A 98 ARG HA A 98 ARG HGx 1.0 . 2.96 1863 1661 A 98 ARG HA A 98 ARG HGy 1.0 . 2.96 1864 1662 A 104 ALA H A 101 LYS HA 1.0 . 4.54 1865 1663 A 101 LYS HA A 101 LYS HGx 1.0 . 3.01 1866 1663 A 101 LYS HGy A 101 LYS HA 1.0 . 3.01 1867 1664 A 84 GLN HE2y A 94 LYS HA 1.0 . 4.76 1868 1665 A 84 GLN HE2x A 94 LYS HA 1.0 . 4.37 1869 1666 A 91 PRO HA A 94 LYS HA 1.0 . 5.08 1870 1667 A 94 LYS HA A 94 LYS HBx 1.0 . 2.95 1871 1667 A 94 LYS HBy A 94 LYS HA 1.0 . 2.95 1872 1668 A 94 LYS HDy A 94 LYS HA 1.0 . 4.63 1873 1669 A 94 LYS HGy A 94 LYS HA 1.0 . 3.72 1874 1670 A 94 LYS HGx A 94 LYS HA 1.0 . 3.94 1875 1671 A 43 THR HG2% A 36 GLN HGx 1.0 . 5.34 1876 1672 A 84 GLN HGy A 94 LYS HA 1.0 . 5.21 1877 1673 A 22 LEU H A 21 VAL HG1% 1.0 . 3.75 1878 1674 A 21 VAL HA A 21 VAL HG1% 1.0 . 3.27 1879 1675 A 105 ASP H A 102 LYS HA 1.0 . 3.84 1880 1676 A 102 LYS HA A 105 ASP HBy 1.0 . 3.54 1881 1677 A 102 LYS HA A 101 LYS HBy 1.0 . 4.63 1882 1678 A 102 LYS HA A 102 LYS HGy 1.0 . 3.42 1883 1679 A 102 LYS HA A 106 LEU HD2% 1.0 . 5.50 1884 1680 A 46 GLU HA A 46 GLU HGx 1.0 . 3.72 1885 1681 A 49 ARG HBy A 46 GLU HA 1.0 . 3.34 1886 1682 A 49 ARG HBx A 46 GLU HA 1.0 . 3.91 1887 1683 A 48 ALA H A 46 GLU HA 1.0 . 5.34 1888 1684 A 50 GLN HGy A 50 GLN HA 1.0 . 3.76 1889 1685 A 50 GLN HA A 50 GLN HGx 1.0 . 3.52 1890 1686 A 50 GLN HA A 50 GLN HBx 1.0 . 2.70 1891 1687 A 50 GLN HA A 54 ASN HD2x 1.0 . 4.99 1892 1688 A 12 SER H A 11 VAL HG2% 1.0 . 5.23 1893 1689 A 73 ILE H A 70 LEU HD1% 1.0 . 4.68 1894 1690 A 104 ALA HA A 70 LEU HD1% 1.0 . 3.25 1895 1691 A 107 TRP HBy A 70 LEU HD1% 1.0 . 3.73 1896 1692 A 107 TRP HBx A 70 LEU HD1% 1.0 . 3.96 1897 1693 A 70 LEU HA A 70 LEU HD1% 1.0 . 3.07 1898 1694 A 70 LEU HD1% A 73 ILE HB 1.0 . 3.56 1899 1695 A 104 ALA HB% A 70 LEU HD1% 1.0 . 3.36 1900 1696 A 73 ILE HG2% A 70 LEU HD1% 1.0 . 4.21 1901 1697 A 73 ILE HD1% A 70 LEU HD1% 1.0 . 5.06 1902 1698 A 107 TRP HE1 A 70 LEU HD1% 1.0 . 5.01 1903 1699 A 70 LEU H A 70 LEU HD1% 1.0 . 4.33 1904 1700 A 71 GLU H A 70 LEU HD1% 1.0 . 5.50 1905 1701 A 104 ALA H A 70 LEU HD1% 1.0 . 4.81 1906 1702 A 82 GLN HA A 82 GLN HE2y 1.0 . 4.11 1907 1703 A 82 GLN HGy A 82 GLN HA 1.0 . 3.70 1908 1704 A 82 GLN HA A 82 GLN HGx 1.0 . 3.46 1909 1705 A 107 TRP H A 70 LEU HD1% 1.0 . 4.89 1910 1706 A 68 THR H A 65 LYS HA 1.0 . 5.20 1911 1707 A 64 LYS HA A 65 LYS HA 1.0 . 4.69 1912 1708 A 65 LYS HA A 65 LYS HGx 1.0 . 3.53 1913 1709 A 65 LYS HA A 65 LYS HEx 1.0 . 5.24 1914 1709 A 65 LYS HA A 65 LYS HEy 1.0 . 5.24 1915 1710 A 65 LYS HA A 65 LYS HBy 1.0 . 2.87 1916 1711 A 65 LYS HA A 65 LYS HGy 1.0 . 3.43 1917 1712 A 84 GLN H A 82 GLN HA 1.0 . 4.94 1918 1713 A 92 THR HG2% A 44 GLY H 1.0 . 4.90 1919 1714 A 92 THR HG2% A 96 ARG H 1.0 . 4.75 1920 1715 A 92 THR HG2% A 92 THR H 1.0 . 4.22 1921 1716 A 92 THR HG2% A 93 ALA H 1.0 . 4.07 1922 1717 A 92 THR HG2% A 45 ALA HA 1.0 . 3.81 1923 1718 A 92 THR HG2% A 95 TYR HBx 1.0 . 5.04 1924 1719 A 92 THR HG2% A 93 ALA HB% 1.0 . 5.13 1925 1720 A 92 THR HG2% A 96 ARG HDy 1.0 . 3.48 1926 1721 A 92 THR HG2% A 96 ARG HBx 1.0 . 5.18 1927 1722 A 10 PHE HA A 11 VAL HG1% 1.0 . 5.41 1928 1723 A 52 LEU HA A 52 LEU HG 1.0 . 3.78 1929 1724 A 19 GLN HA A 21 VAL HG2% 1.0 . 4.97 1930 1725 A 21 VAL HG2% A 21 VAL H 1.0 . 3.38 1931 1726 A 21 VAL HG2% A 21 VAL HA 1.0 . 3.43 1932 1727 A 52 LEU HA A 99 LEU HD1% 1.0 . 4.12 1933 1728 A 52 LEU HA A 52 LEU HD2% 1.0 . 3.10 1934 1729 A 64 LYS H A 62 MET HA 1.0 . 4.71 1935 1730 A 65 LYS H A 62 MET HA 1.0 . 3.74 1936 1731 A 66 GLN H A 62 MET HA 1.0 . 5.43 1937 1732 A 61 SER HA A 62 MET HA 1.0 . 4.88 1938 1733 A 62 MET HGx A 62 MET HA 1.0 . 3.81 1939 1734 A 62 MET HA A 62 MET HBx 1.0 . 3.01 1940 1734 A 62 MET HBy A 62 MET HA 1.0 . 3.01 1941 1735 A 65 LYS HBx A 62 MET HA 1.0 . 3.35 1942 1736 A 55 ILE H A 53 GLU HA 1.0 . 5.45 1943 1737 A 53 GLU HGy A 53 GLU HA 1.0 . 3.76 1944 1738 A 53 GLU HGx A 53 GLU HA 1.0 . 3.31 1945 1739 A 53 GLU HA A 53 GLU HBy 1.0 . 2.91 1946 1740 A 52 LEU HG A 53 GLU HA 1.0 . 4.36 1947 1741 A 52 LEU HD2% A 53 GLU HA 1.0 . 5.15 1948 1742 A 36 GLN HA A 37 ARG HGy 1.0 . 5.50 1949 1743 A 36 GLN HA A 40 GLY H 1.0 . 5.00 1950 1744 A 103 ILE H A 99 LEU HA 1.0 . 5.46 1951 1745 A 83 GLU H A 84 GLN HA 1.0 . 4.99 1952 1746 A 87 ASN H A 84 GLN HA 1.0 . 4.11 1953 1747 A 90 ASN HBy A 84 GLN HA 1.0 . 4.86 1954 1748 A 84 GLN HGy A 84 GLN HA 1.0 . 4.00 1955 1749 A 84 GLN HA A 84 GLN HGx 1.0 . 3.80 1956 1750 A 84 GLN HA A 84 GLN HBx 1.0 . 2.98 1957 1750 A 84 GLN HBy A 84 GLN HA 1.0 . 2.98 1958 1751 A 36 GLN HA A 36 GLN HGx 1.0 . 3.90 1959 1752 A 42 GLY H A 36 GLN HA 1.0 . 4.20 1960 1753 A 35 GLY H A 36 GLN HA 1.0 . 5.50 1961 1754 A 10 PHE HA A 10 PHE HD% 1.0 . 4.44 1962 1755 A 102 LYS H A 99 LEU HA 1.0 . 4.46 1963 1756 A 102 LYS HBy A 99 LEU HA 1.0 . 4.32 1964 1757 A 52 LEU HD1% A 99 LEU HA 1.0 . 4.11 1965 1758 A 35 GLY HAy A 36 GLN HA 1.0 . 5.25 1966 1759 A 89 ASN H A 88 GLU HA 1.0 . 3.57 1967 1760 A 90 ASN H A 88 GLU HA 1.0 . 4.58 1968 1761 A 87 ASN HA A 88 GLU HA 1.0 . 4.71 1969 1762 A 88 GLU HA A 88 GLU HGx 1.0 . 3.48 1970 1762 A 88 GLU HGy A 88 GLU HA 1.0 . 3.48 1971 1763 A 26 PRO HDy A 25 THR HA 1.0 . 3.20 1972 1764 A 72 MET HE% A 25 THR HA 1.0 . 4.57 1973 1765 A 26 PRO HGx A 25 THR HA 1.0 . 4.59 1974 1766 A 76 TRP HE1 A 25 THR HA 1.0 . 4.48 1975 1767 A 81 GLU H A 78 ASP HA 1.0 . 3.89 1976 1768 A 81 GLU HBy A 78 ASP HA 1.0 . 3.28 1977 1769 A 81 GLU HBx A 78 ASP HA 1.0 . 3.72 1978 1770 A 86 ARG HGx A 86 ARG HA 1.0 . 3.75 1979 1771 A 52 LEU HA A 99 LEU HA 1.0 . 3.64 1980 1772 A 86 ARG HA A 86 ARG HBx 1.0 . 3.02 1981 1772 A 86 ARG HBy A 86 ARG HA 1.0 . 3.02 1982 1773 A 27 LYS HA A 27 LYS HBx 1.0 . 3.01 1983 1773 A 27 LYS HA A 27 LYS HBy 1.0 . 3.01 1984 1774 A 27 LYS HA A 28 ASN H 1.0 . 3.40 1985 1775 A 29 ILE H A 27 LYS HA 1.0 . 4.95 1986 1776 A 27 LYS HA A 26 PRO HA 1.0 . 4.36 1987 1777 A 100 MET HA A 103 ILE H 1.0 . 3.87 1988 1778 A 100 MET HA A 100 MET HE% 1.0 . 3.69 1989 1779 A 100 MET HA A 103 ILE HB 1.0 . 3.58 1990 1780 A 26 PRO HDx A 25 THR HA 1.0 . 3.44 1991 1781 A 86 ARG HA A 86 ARG HDx 1.0 . 4.50 1992 1781 A 86 ARG HDy A 86 ARG HA 1.0 . 4.50 1993 1782 A 85 GLN HBy A 85 GLN HA 1.0 . 2.97 1994 1783 A 86 ARG HGx A 85 GLN HA 1.0 . 5.50 1995 1784 A 73 ILE HG2% A 74 THR H 1.0 . 4.33 1996 1785 A 73 ILE HG2% A 104 ALA H 1.0 . 3.66 1997 1786 A 73 ILE HG2% A 73 ILE H 1.0 . 4.11 1998 1787 A 73 ILE HG2% A 100 MET HA 1.0 . 3.99 1999 1788 A 73 ILE HG2% A 73 ILE HA 1.0 . 3.24 2000 1789 A 73 ILE HG2% A 103 ILE HA 1.0 . 4.73 2001 1790 A 73 ILE HG2% A 100 MET HBx 1.0 . 3.89 2002 1790 A 73 ILE HG2% A 100 MET HBy 1.0 . 3.89 2003 1791 A 73 ILE HG2% A 73 ILE HG1y 1.0 . 4.19 2004 1792 A 73 ILE HG2% A 103 ILE HG2% 1.0 . 3.77 2005 1793 A 73 ILE HD1% A 73 ILE HG2% 1.0 . 3.48 2006 1794 A 105 ASP H A 73 ILE HG2% 1.0 . 5.09 2007 1795 A 37 ARG HA A 37 ARG HDx 1.0 . 4.10 2008 1795 A 37 ARG HDy A 37 ARG HA 1.0 . 4.10 2009 1796 A 37 ARG HA A 37 ARG HBx 1.0 . 3.00 2010 1796 A 37 ARG HBy A 37 ARG HA 1.0 . 3.00 2011 1797 A 37 ARG HA A 37 ARG HGx 1.0 . 3.79 2012 1798 A 76 TRP H A 100 MET HE% 1.0 . 4.71 2013 1799 A 76 TRP HD1 A 100 MET HE% 1.0 . 4.23 2014 1800 A 41 TRP HE3 A 100 MET HE% 1.0 . 4.36 2015 1801 A 34 PHE HE% A 100 MET HE% 1.0 . 4.50 2016 1802 A 73 ILE HA A 100 MET HE% 1.0 . 3.39 2017 1803 A 76 TRP HBy A 100 MET HE% 1.0 . 3.76 2018 1804 A 76 TRP HBx A 100 MET HE% 1.0 . 3.90 2019 1805 A 100 MET HE% A 100 MET HGx 1.0 . 3.79 2020 1806 A 103 ILE HD1% A 100 MET HE% 1.0 . 3.73 2021 1807 A 73 ILE HD1% A 100 MET HE% 1.0 . 3.39 2022 1808 A 39 ILE HG2% A 100 MET HE% 1.0 . 3.57 2023 1809 A 39 ILE HD1% A 100 MET HE% 1.0 . 3.32 2024 1810 A 100 MET HE% A 39 ILE HG1x 1.0 . 4.02 2025 1810 A 39 ILE HG1y A 100 MET HE% 1.0 . 4.02 2026 1811 A 62 MET H A 59 ASP HA 1.0 . 4.53 2027 1812 A 59 ASP HA A 62 MET HBx 1.0 . 3.69 2028 1812 A 62 MET HBy A 59 ASP HA 1.0 . 3.69 2029 1813 A 56 GLN H A 59 ASP HA 1.0 . 5.28 2030 1814 A 61 SER H A 59 ASP HA 1.0 . 5.45 2031 1815 A 70 LEU HA A 73 ILE H 1.0 . 3.77 2032 1816 A 70 LEU HA A 107 TRP HH2 1.0 . 4.97 2033 1817 A 69 THR HB A 70 LEU HA 1.0 . 4.76 2034 1818 A 70 LEU HA A 73 ILE HB 1.0 . 3.47 2035 1819 A 70 LEU HA A 73 ILE HG1y 1.0 . 4.21 2036 1820 A 70 LEU HA A 70 LEU HG 1.0 . 3.69 2037 1821 A 70 LEU HA A 73 ILE HG2% 1.0 . 4.60 2038 1822 A 70 LEU HA A 73 ILE HD1% 1.0 . 4.93 2039 1823 A 49 ARG H A 48 ALA HB% 1.0 . 3.73 2040 1824 A 48 ALA H A 48 ALA HB% 1.0 . 3.38 2041 1825 A 49 ARG HA A 48 ALA HB% 1.0 . 4.39 2042 1826 A 48 ALA HB% A 41 TRP HBy 1.0 . 4.40 2043 1827 A 49 ARG HBx A 48 ALA HB% 1.0 . 4.36 2044 1828 A 48 ALA HB% A 96 ARG HBx 1.0 . 4.30 2045 1829 A 48 ALA HB% A 51 ARG HBx 1.0 . 5.48 2046 1829 A 48 ALA HB% A 51 ARG HBy 1.0 . 5.48 2047 1830 A 48 ALA HB% A 41 TRP HA 1.0 . 5.50 2048 1831 A 41 TRP HA A 39 ILE HG2% 1.0 . 4.77 2049 1832 A 41 TRP HBx A 39 ILE HG2% 1.0 . 3.85 2050 1833 A 39 ILE HG2% A 40 GLY H 1.0 . 4.18 2051 1834 A 39 ILE HG2% A 39 ILE HA 1.0 . 3.41 2052 1835 A 39 ILE HG2% A 103 ILE HG1y 1.0 . 5.45 2053 1836 A 39 ILE HG2% A 99 LEU HG 1.0 . 4.36 2054 1837 A 99 LEU HD1% A 39 ILE HG2% 1.0 . 3.30 2055 1838 A 103 ILE HD1% A 39 ILE HG2% 1.0 . 3.77 2056 1839 A 39 ILE HG2% A 39 ILE HG1x 1.0 . 3.67 2057 1839 A 39 ILE HG1y A 39 ILE HG2% 1.0 . 3.67 2058 1840 A 104 ALA HB% A 105 ASP HA 1.0 . 4.13 2059 1841 A 50 GLN H A 51 ARG HA 1.0 . 5.20 2060 1842 A 51 ARG HA A 51 ARG HDy 1.0 . 3.71 2061 1843 A 51 ARG HA A 51 ARG HDx 1.0 . 3.64 2062 1844 A 54 ASN H A 51 ARG HA 1.0 . 4.41 2063 1845 A 81 GLU H A 97 ALA HA 1.0 . 4.93 2064 1846 A 97 ALA HA A 77 GLN HA 1.0 . 3.18 2065 1847 A 97 ALA HA A 80 TYR HBx 1.0 . 3.85 2066 1848 A 97 ALA HA A 77 GLN HBx 1.0 . 4.01 2067 1849 A 37 ARG H A 33 ALA HB% 1.0 . 4.63 2068 1850 A 34 PHE H A 33 ALA HB% 1.0 . 3.59 2069 1851 A 33 ALA H A 33 ALA HB% 1.0 . 3.13 2070 1852 A 30 PRO HDx A 33 ALA HB% 1.0 . 3.67 2071 1853 A 29 ILE HB A 33 ALA HB% 1.0 . 3.47 2072 1854 A 29 ILE HG2% A 33 ALA HB% 1.0 . 4.52 2073 1855 A 29 ILE HD1% A 33 ALA HB% 1.0 . 3.81 2074 1856 A 45 ALA HB% A 95 TYR HE% 1.0 . 4.04 2075 1857 A 45 ALA H A 45 ALA HB% 1.0 . 3.32 2076 1858 A 45 ALA HB% A 91 PRO HBx 1.0 . 3.47 2077 1859 A 92 THR HG2% A 45 ALA HB% 1.0 . 4.91 2078 1860 A 90 ASN HBy A 93 ALA HB% 1.0 . 4.29 2079 1861 A 75 ALA HB% A 76 TRP H 1.0 . 3.71 2080 1862 A 75 ALA HB% A 75 ALA H 1.0 . 3.08 2081 1863 A 75 ALA HB% A 23 PRO HBx 1.0 . 4.46 2082 1864 A 93 ALA H A 45 ALA HB% 1.0 . 5.50 2083 1865 A 58 ALA H A 58 ALA HB% 1.0 . 3.20 2084 1866 A 58 ALA HB% A 61 SER H 1.0 . 4.79 2085 1867 A 58 ALA HB% A 59 ASP H 1.0 . 3.55 2086 1868 A 60 VAL H A 58 ALA HB% 1.0 . 4.94 2087 1869 A 58 ALA HB% A 59 ASP HA 1.0 . 4.70 2088 1870 A 59 ASP HBy A 58 ALA HB% 1.0 . 5.25 2089 1871 A 56 GLN HBy A 58 ALA HB% 1.0 . 4.09 2090 1872 A 12 SER HA A 13 PRO HDy 1.0 . 2.91 2091 1873 A 12 SER HA A 13 PRO HGx 1.0 . 5.02 2092 1873 A 12 SER HA A 13 PRO HGy 1.0 . 5.02 2093 1874 A 93 ALA HB% A 90 ASN HD2y 1.0 . 4.39 2094 1875 A 93 ALA HB% A 80 TYR HA 1.0 . 4.23 2095 1876 A 93 ALA H A 93 ALA HB% 1.0 . 3.13 2096 1877 A 104 ALA HA A 103 ILE HG2% 1.0 . 4.19 2097 1878 A 103 ILE HG2% A 103 ILE H 1.0 . 3.67 2098 1879 A 103 ILE HG2% A 107 TRP HZ3 1.0 . 3.47 2099 1880 A 100 MET HA A 103 ILE HG2% 1.0 . 4.53 2100 1881 A 103 ILE HG2% A 103 ILE HA 1.0 . 3.27 2101 1882 A 103 ILE HG2% A 103 ILE HD1% 1.0 . 3.15 2102 1883 A 60 VAL HG1% A 103 ILE HG2% 1.0 . 2.98 2103 1884 A 103 ILE HG2% A 39 ILE HD1% 1.0 . 4.78 2104 1885 A 49 ARG H A 45 ALA HA 1.0 . 4.54 2105 1886 A 84 GLN HE2x A 97 ALA HB% 1.0 . 4.44 2106 1887 A 92 THR H A 45 ALA HA 1.0 . 4.64 2107 1888 A 95 TYR HBx A 45 ALA HA 1.0 . 4.28 2108 1889 A 95 TYR HD% A 45 ALA HA 1.0 . 4.23 2109 1890 A 69 THR H A 72 MET HE% 1.0 . 3.50 2110 1891 A 72 MET H A 72 MET HE% 1.0 . 4.75 2111 1892 A 72 MET HE% A 68 THR HA 1.0 . 3.64 2112 1893 A 72 MET HE% A 26 PRO HA 1.0 . 3.01 2113 1894 A 26 PRO HDx A 72 MET HE% 1.0 . 4.70 2114 1895 A 72 MET HBy A 72 MET HE% 1.0 . 3.23 2115 1896 A 72 MET HBx A 72 MET HE% 1.0 . 3.39 2116 1897 A 69 THR HG2% A 72 MET HE% 1.0 . 3.37 2117 1898 A 81 GLU H A 97 ALA HB% 1.0 . 4.01 2118 1899 A 97 ALA H A 97 ALA HB% 1.0 . 3.20 2119 1900 A 80 TYR H A 97 ALA HB% 1.0 . 4.12 2120 1901 A 98 ARG H A 97 ALA HB% 1.0 . 3.45 2121 1902 A 97 ALA HB% A 81 GLU HGx 1.0 . 3.70 2122 1903 A 97 ALA HB% A 81 GLU HGy 1.0 . 3.39 2123 1904 A 72 MET HA A 72 MET HE% 1.0 . 5.06 2124 1905 A 72 MET HE% A 26 PRO HDy 1.0 . 4.88 2125 1906 A 68 THR HG2% A 72 MET HE% 1.0 . 4.71 2126 1907 A 105 ASP H A 104 ALA HB% 1.0 . 3.40 2127 1908 A 104 ALA H A 104 ALA HB% 1.0 . 3.02 2128 1909 A 107 TRP H A 104 ALA HB% 1.0 . 4.94 2129 1910 A 107 TRP HBy A 104 ALA HB% 1.0 . 4.45 2130 1911 A 105 ASP HBy A 104 ALA HB% 1.0 . 4.89 2131 1912 A 74 THR HG2% A 104 ALA HB% 1.0 . 3.83 2132 1913 A 73 ILE HG2% A 104 ALA HB% 1.0 . 3.55 2133 1914 A 73 ILE HD1% A 104 ALA HB% 1.0 . 5.50 2134 1915 A 104 ALA HB% A 70 LEU HD2% 1.0 . 4.99 2135 1916 A 63 ILE H A 38 ILE HG2% 1.0 . 5.50 2136 1917 A 39 ILE H A 38 ILE HG2% 1.0 . 3.96 2137 1918 A 38 ILE HG2% A 66 GLN HE2y 1.0 . 5.50 2138 1919 A 38 ILE H A 38 ILE HG2% 1.0 . 4.17 2139 1920 A 38 ILE HG2% A 38 ILE HA 1.0 . 3.22 2140 1921 A 63 ILE HA A 38 ILE HG2% 1.0 . 3.49 2141 1922 A 38 ILE HG2% A 39 ILE HA 1.0 . 5.01 2142 1923 A 66 GLN HBy A 38 ILE HG2% 1.0 . 4.13 2143 1924 A 66 GLN HBx A 38 ILE HG2% 1.0 . 3.46 2144 1925 A 38 ILE HG2% A 38 ILE HG1y 1.0 . 3.55 2145 1926 A 63 ILE HG2% A 38 ILE HG2% 1.0 . 3.49 2146 1927 A 39 ILE HD1% A 38 ILE HG2% 1.0 . 3.84 2147 1928 A 38 ILE HG2% A 39 ILE HG1x 1.0 . 4.39 2148 1928 A 39 ILE HG1y A 38 ILE HG2% 1.0 . 4.39 2149 1929 A 66 GLN HA A 66 GLN HGx 1.0 . 2.90 2150 1929 A 66 GLN HGy A 66 GLN HA 1.0 . 2.90 2151 1930 A 38 ILE HD1% A 66 GLN HA 1.0 . 5.41 2152 1931 A 102 LYS HA A 104 ALA HB% 1.0 . 5.05 2153 1932 A 104 ALA HA A 107 TRP HBy 1.0 . 3.63 2154 1933 A 41 TRP HA A 51 ARG HBx 1.0 . 3.51 2155 1933 A 51 ARG HBy A 41 TRP HA 1.0 . 3.51 2156 1934 A 62 MET H A 58 ALA HA 1.0 . 5.33 2157 1935 A 58 ALA HA A 61 SER HBx 1.0 . 3.35 2158 1935 A 58 ALA HA A 61 SER HBy 1.0 . 3.35 2159 1936 A 58 ALA HA A 57 PRO HBx 1.0 . 4.92 2160 1937 A 41 TRP HA A 48 ALA HA 1.0 . 4.11 2161 1938 A 41 TRP HBx A 48 ALA HA 1.0 . 3.94 2162 1939 A 48 ALA HA A 51 ARG HBx 1.0 . 3.65 2163 1939 A 51 ARG HBy A 48 ALA HA 1.0 . 3.65 2164 1940 A 80 TYR HBx A 93 ALA HA 1.0 . 4.80 2165 1941 A 93 ALA HA A 96 ARG HDy 1.0 . 4.78 2166 1942 A 96 ARG H A 93 ALA HA 1.0 . 4.16 2167 1943 A 80 TYR HA A 93 ALA HA 1.0 . 5.33 2168 1944 A 29 ILE HG2% A 28 ASN H 1.0 . 4.07 2169 1945 A 29 ILE HG2% A 29 ILE H 1.0 . 3.32 2170 1946 A 34 PHE HDy A 29 ILE HG2% 1.0 . 4.86 2171 1947 A 29 ILE HG2% A 29 ILE HA 1.0 . 3.18 2172 1948 A 29 ILE HG2% A 28 ASN HA 1.0 . 5.36 2173 1949 A 29 ILE HG2% A 30 PRO HDy 1.0 . 3.92 2174 1950 A 29 ILE HG2% A 30 PRO HDx 1.0 . 4.06 2175 1951 A 29 ILE HG2% A 29 ILE HG1y 1.0 . 3.18 2176 1952 A 29 ILE HD1% A 29 ILE HG2% 1.0 . 3.15 2177 1953 A 63 ILE H A 62 MET HE% 1.0 . 4.85 2178 1954 A 66 GLN HE2y A 62 MET HE% 1.0 . 4.61 2179 1955 A 66 GLN HE2x A 62 MET HE% 1.0 . 4.76 2180 1956 A 59 ASP HA A 62 MET HE% 1.0 . 4.56 2181 1957 A 62 MET HA A 62 MET HE% 1.0 . 4.00 2182 1958 A 62 MET HGx A 62 MET HE% 1.0 . 4.44 2183 1959 A 63 ILE HD1% A 62 MET HE% 1.0 . 5.50 2184 1960 A 106 LEU HG A 106 LEU HA 1.0 . 3.31 2185 1961 A 106 LEU HA A 107 TRP HA 1.0 . 4.62 2186 1962 A 37 ARG H A 33 ALA HA 1.0 . 3.62 2187 1963 A 36 GLN HBy A 33 ALA HA 1.0 . 3.70 2188 1964 A 33 ALA HA A 37 ARG HBx 1.0 . 3.80 2189 1964 A 37 ARG HBy A 33 ALA HA 1.0 . 3.80 2190 1965 A 29 ILE HD1% A 33 ALA HA 1.0 . 5.46 2191 1966 A 33 ALA HA A 37 ARG HDx 1.0 . 4.73 2192 1966 A 37 ARG HDy A 33 ALA HA 1.0 . 4.73 2193 1967 A 37 ARG HGy A 33 ALA HA 1.0 . 4.05 2194 1968 A 64 LYS H A 63 ILE HG2% 1.0 . 4.12 2195 1969 A 63 ILE H A 63 ILE HG2% 1.0 . 3.91 2196 1970 A 66 GLN H A 63 ILE HG2% 1.0 . 5.24 2197 1971 A 63 ILE HG2% A 68 THR H 1.0 . 4.38 2198 1972 A 107 TRP HH2 A 63 ILE HG2% 1.0 . 3.57 2199 1973 A 63 ILE HG2% A 68 THR HA 1.0 . 5.50 2200 1974 A 63 ILE HG2% A 64 LYS HA 1.0 . 4.40 2201 1975 A 63 ILE HG2% A 68 THR HB 1.0 . 3.23 2202 1976 A 63 ILE HA A 63 ILE HG2% 1.0 . 3.35 2203 1977 A 63 ILE HG2% A 39 ILE HA 1.0 . 5.50 2204 1978 A 63 ILE HG1y A 63 ILE HG2% 1.0 . 4.20 2205 1979 A 103 ILE HG2% A 63 ILE HG2% 1.0 . 4.34 2206 1980 A 63 ILE HD1% A 63 ILE HG2% 1.0 . 3.25 2207 1981 A 63 ILE HG2% A 39 ILE HD1% 1.0 . 3.95 2208 1982 A 63 ILE HG2% A 39 ILE HG1x 1.0 . 5.50 2209 1982 A 63 ILE HG2% A 39 ILE HG1y 1.0 . 5.50 2210 1983 A 27 LYS H A 28 ASN HA 1.0 . 5.32 2211 1984 A 28 ASN H A 28 ASN HA 1.0 . 2.85 2212 1985 A 27 LYS HA A 28 ASN HA 1.0 . 4.67 2213 1986 A 27 LYS HGy A 28 ASN HA 1.0 . 4.50 2214 1987 A 29 ILE HD1% A 28 ASN HA 1.0 . 5.50 2215 1988 A 56 GLN H A 55 ILE HD1% 1.0 . 4.27 2216 1989 A 55 ILE HD1% A 55 ILE HA 1.0 . 3.67 2217 1990 A 52 LEU HA A 55 ILE HD1% 1.0 . 3.66 2218 1991 A 59 ASP HBy A 55 ILE HD1% 1.0 . 4.94 2219 1992 A 55 ILE HB A 55 ILE HD1% 1.0 . 3.43 2220 1993 A 54 ASN HD2y A 54 ASN HA 1.0 . 4.43 2221 1994 A 54 ASN HA A 53 GLU HA 1.0 . 4.53 2222 1995 A 15 LEU H A 14 ASN HA 1.0 . 3.31 2223 1996 A 21 VAL H A 20 ASN HA 1.0 . 2.95 2224 1997 A 21 VAL HG2% A 20 ASN HA 1.0 . 4.66 2225 1998 A 20 ASN HA A 21 VAL HA 1.0 . 4.49 2226 1999 A 7 THR HG2% A 8 ASN HA 1.0 . 4.45 2227 2000 A 56 GLN HA A 57 PRO HDx 1.0 . 3.10 2228 2001 A 56 GLN HA A 56 GLN HGy 1.0 . 3.73 2229 2002 A 79 PHE HE% A 22 LEU HA 1.0 . 4.69 2230 2003 A 23 PRO HDy A 22 LEU HA 1.0 . 3.25 2231 2004 A 103 ILE HD1% A 39 ILE HG1x 1.0 . 5.50 2232 2004 A 103 ILE HD1% A 39 ILE HG1y 1.0 . 5.50 2233 2005 A 23 PRO HGx A 22 LEU HA 1.0 . 4.90 2234 2006 A 79 PHE HD% A 22 LEU HA 1.0 . 5.50 2235 2007 A 103 ILE H A 103 ILE HD1% 1.0 . 3.83 2236 2008 A 103 ILE HD1% A 107 TRP HZ3 1.0 . 5.50 2237 2009 A 100 MET HA A 103 ILE HD1% 1.0 . 3.74 2238 2010 A 103 ILE HA A 103 ILE HD1% 1.0 . 3.83 2239 2011 A 103 ILE HD1% A 39 ILE HA 1.0 . 4.96 2240 2012 A 103 ILE HD1% A 99 LEU HG 1.0 . 3.86 2241 2013 A 103 ILE HD1% A 39 ILE HD1% 1.0 . 3.81 2242 2014 A 56 GLN H A 55 ILE HG2% 1.0 . 4.23 2243 2015 A 55 ILE H A 55 ILE HG2% 1.0 . 4.11 2244 2016 A 59 ASP H A 55 ILE HG2% 1.0 . 5.50 2245 2017 A 60 VAL H A 55 ILE HG2% 1.0 . 5.50 2246 2018 A 55 ILE HA A 55 ILE HG2% 1.0 . 3.88 2247 2019 A 52 LEU HA A 55 ILE HG2% 1.0 . 5.38 2248 2020 A 63 ILE H A 63 ILE HD1% 1.0 . 3.89 2249 2021 A 60 VAL HA A 63 ILE HD1% 1.0 . 3.18 2250 2022 A 63 ILE HD1% A 39 ILE HG1x 1.0 . 5.50 2251 2022 A 63 ILE HD1% A 39 ILE HG1y 1.0 . 5.50 2252 2023 A 29 ILE HD1% A 29 ILE HB 1.0 . 3.37 2253 2024 A 29 ILE HD1% A 34 PHE H 1.0 . 4.18 2254 2025 A 29 ILE HD1% A 29 ILE H 1.0 . 4.16 2255 2026 A 29 ILE HD1% A 34 PHE HDy 1.0 . 4.36 2256 2027 A 29 ILE HD1% A 29 ILE HA 1.0 . 4.03 2257 2028 A 25 THR H A 26 PRO HDy 1.0 . 5.20 2258 2029 A 34 PHE HDy A 26 PRO HDy 1.0 . 4.31 2259 2030 A 25 THR HG2% A 26 PRO HDy 1.0 . 4.26 2260 2031 A 26 PRO HDx A 34 PHE HDy 1.0 . 4.25 2261 2032 A 26 PRO HDx A 25 THR HG2% 1.0 . 4.16 2262 2033 A 29 ILE H A 30 PRO HDy 1.0 . 5.08 2263 2034 A 30 PRO HDy A 33 ALA HB% 1.0 . 4.41 2264 2035 A 29 ILE HD1% A 30 PRO HDy 1.0 . 5.47 2265 2036 A 90 ASN HBy A 91 PRO HDx 1.0 . 5.50 2266 2037 A 29 ILE HD1% A 30 PRO HDx 1.0 . 5.20 2267 2038 A 29 ILE H A 30 PRO HDx 1.0 . 5.39 2268 2039 A 33 ALA H A 30 PRO HDx 1.0 . 5.44 2269 2040 A 92 THR H A 91 PRO HDy 1.0 . 4.24 2270 2041 A 45 ALA HB% A 91 PRO HDy 1.0 . 5.50 2271 2042 A 90 ASN H A 91 PRO HDy 1.0 . 5.42 2272 2043 A 12 SER H A 13 PRO HDy 1.0 . 5.50 2273 2044 A 12 SER HA A 13 PRO HDx 1.0 . 3.33 2274 2045 A 13 PRO HDx A 11 VAL HG2% 1.0 . 5.50 2275 2046 A 91 PRO HDx A 92 THR H 1.0 . 4.71 2276 2047 A 90 ASN HA A 91 PRO HDx 1.0 . 3.31 2277 2048 A 89 ASN HA A 91 PRO HDx 1.0 . 4.83 2278 2049 A 90 ASN HBx A 91 PRO HDx 1.0 . 5.19 2279 2050 A 91 PRO HDx A 45 ALA HB% 1.0 . 5.50 2280 2051 A 89 ASN HA A 91 PRO HDy 1.0 . 5.37 2281 2052 A 57 PRO HDy A 56 GLN HGy 1.0 . 4.60 2282 2053 A 58 ALA HB% A 57 PRO HDy 1.0 . 5.50 2283 2054 A 56 GLN HBy A 57 PRO HDy 1.0 . 3.52 2284 2055 A 106 LEU HD1% A 57 PRO HDy 1.0 . 5.29 2285 2056 A 56 GLN H A 57 PRO HDy 1.0 . 5.50 2286 2057 A 56 GLN H A 57 PRO HDx 1.0 . 5.48 2287 2058 A 58 ALA H A 57 PRO HDx 1.0 . 5.00 2288 2059 A 106 LEU HD2% A 57 PRO HDx 1.0 . 5.11 2289 2060 A 38 ILE HD1% A 37 ARG HA 1.0 . 5.50 2290 2061 A 39 ILE H A 38 ILE HD1% 1.0 . 5.26 2291 2062 A 38 ILE H A 38 ILE HD1% 1.0 . 4.19 2292 2063 A 34 PHE HDy A 38 ILE HD1% 1.0 . 3.72 2293 2064 A 38 ILE HA A 38 ILE HD1% 1.0 . 3.43 2294 2065 A 38 ILE HD1% A 66 GLN HGx 1.0 . 3.51 2295 2065 A 66 GLN HGy A 38 ILE HD1% 1.0 . 3.51 2296 2066 A 38 ILE HD1% A 38 ILE HB 1.0 . 3.31 2297 2067 A 66 GLN HBx A 38 ILE HD1% 1.0 . 3.34 2298 2068 A 90 ASN HA A 89 ASN HA 1.0 . 4.90 2299 2069 A 90 ASN HA A 91 PRO HGx 1.0 . 4.34 2300 2070 A 90 ASN HA A 93 ALA HB% 1.0 . 5.50 2301 2071 A 90 ASN HA A 92 THR H 1.0 . 4.38 2302 2072 A 90 ASN HA A 91 PRO HDy 1.0 . 3.19 2303 2073 A 56 GLN HA A 57 PRO HDy 1.0 . 3.55 2304 2074 A 106 LEU HD2% A 57 PRO HDy 1.0 . 5.40 2305 2075 A 58 ALA HB% A 57 PRO HDx 1.0 . 5.50 2306 2076 A 56 GLN HBx A 57 PRO HDx 1.0 . 4.26 2307 2077 A 31 LEU H A 32 PRO HDy 1.0 . 3.89 2308 2078 A 33 ALA H A 32 PRO HDy 1.0 . 4.45 2309 2079 A 31 LEU HBy A 32 PRO HDy 1.0 . 3.01 2310 2080 A 31 LEU H A 32 PRO HDx 1.0 . 3.97 2311 2081 A 33 ALA H A 32 PRO HDx 1.0 . 4.13 2312 2082 A 31 LEU HBy A 32 PRO HDx 1.0 . 3.09 2313 2083 A 32 PRO HDx A 33 ALA HB% 1.0 . 5.50 2314 2084 A 34 PHE H A 32 PRO HDx 1.0 . 5.50 2315 2085 A 31 LEU HD1% A 32 PRO HDx 1.0 . 5.04 2316 2086 A 23 PRO HBy A 24 PRO HDy 1.0 . 3.74 2317 2087 A 23 PRO HBx A 24 PRO HDy 1.0 . 4.44 2318 2088 A 76 TRP HE1 A 24 PRO HDx 1.0 . 5.50 2319 2089 A 24 PRO HDx A 23 PRO HA 1.0 . 3.27 2320 2090 A 75 ALA HB% A 24 PRO HDx 1.0 . 3.61 2321 2091 A 23 PRO HBx A 24 PRO HDx 1.0 . 4.16 2322 2092 A 23 PRO HDy A 76 TRP HH2 1.0 . 5.18 2323 2093 A 23 PRO HDy A 79 PHE HD% 1.0 . 5.50 2324 2094 A 79 PHE HE% A 23 PRO HDx 1.0 . 5.43 2325 2095 A 49 ARG H A 95 TYR HD% 1.0 . 5.12 2326 2096 A 49 ARG HA A 95 TYR HD% 1.0 . 3.74 2327 2097 A 95 TYR HD% A 91 PRO HBx 1.0 . 4.17 2328 2098 A 95 TYR H A 95 TYR HD% 1.0 . 3.71 2329 2099 A 95 TYR HD% A 95 TYR HA 1.0 . 3.21 2330 2100 A 45 ALA HB% A 95 TYR HD% 1.0 . 3.50 2331 2101 A 52 LEU HD1% A 95 TYR HD% 1.0 . 3.26 2332 2102 A 97 ALA HA A 80 TYR HD% 1.0 . 4.72 2333 2103 A 80 TYR H A 80 TYR HD% 1.0 . 4.14 2334 2104 A 80 TYR HD% A 79 PHE HD% 1.0 . 4.56 2335 2105 A 97 ALA H A 80 TYR HD% 1.0 . 5.37 2336 2106 A 80 TYR HD% A 76 TRP HE3 1.0 . 4.77 2337 2107 A 80 TYR HD% A 80 TYR HA 1.0 . 3.26 2338 2108 A 80 TYR HD% A 93 ALA HA 1.0 . 3.41 2339 2109 A 80 TYR HD% A 83 GLU HBx 1.0 . 4.42 2340 2109 A 83 GLU HBy A 80 TYR HD% 1.0 . 4.42 2341 2110 A 93 ALA HB% A 80 TYR HD% 1.0 . 3.27 2342 2111 A 96 ARG HGy A 80 TYR HD% 1.0 . 4.69 2343 2112 A 80 TYR HD% A 96 ARG HDx 1.0 . 4.88 2344 2113 A 81 GLU H A 80 TYR HD% 1.0 . 5.14 2345 2114 A 4 PHE HD% A 4 PHE HA 1.0 . 5.46 2346 2115 A 79 PHE HD% A 80 TYR HA 1.0 . 4.39 2347 2116 A 79 PHE HD% A 22 LEU HD2% 1.0 . 4.68 2348 2117 A 79 PHE HE% A 80 TYR H 1.0 . 5.50 2349 2118 A 79 PHE HE% A 76 TRP HE3 1.0 . 5.16 2350 2119 A 79 PHE HE% A 76 TRP HZ3 1.0 . 5.14 2351 2120 A 79 PHE HE% A 80 TYR HA 1.0 . 4.99 2352 2121 A 79 PHE HE% A 79 PHE HA 1.0 . 4.88 2353 2122 A 23 PRO HDy A 79 PHE HE% 1.0 . 5.50 2354 2123 A 79 PHE HE% A 23 PRO HGy 1.0 . 5.50 2355 2124 A 35 GLY H A 34 PHE HDy 1.0 . 5.46 2356 2125 A 34 PHE HDy A 26 PRO HGy 1.0 . 4.15 2357 2126 A 34 PHE HDy A 29 ILE HG1y 1.0 . 4.08 2358 2127 A 34 PHE HDy A 38 ILE HG1x 1.0 . 4.74 2359 2128 A 34 PHE HDy A 39 ILE HG1x 1.0 . 5.22 2360 2128 A 34 PHE HDy A 39 ILE HG1y 1.0 . 5.22 2361 2129 A 34 PHE HDx A 26 PRO HGy 1.0 . 5.50 2362 2130 A 39 ILE HD1% A 34 PHE HDx 1.0 . 5.50 2363 2131 A 34 PHE H A 34 PHE HDx 1.0 . 5.50 2364 2132 A 34 PHE HDx A 26 PRO HDy 1.0 . 4.97 2365 2133 A 34 PHE HDx A 39 ILE HG1x 1.0 . 5.35 2366 2133 A 39 ILE HG1y A 34 PHE HDx 1.0 . 5.35 2367 2134 A 26 PRO HDx A 34 PHE HDx 1.0 . 5.23 2368 2135 A 34 PHE HDx A 100 MET HE% 1.0 . 5.50 2369 2136 A 25 THR HG2% A 34 PHE HDx 1.0 . 4.41 2370 2137 A 34 PHE HDx A 31 LEU HD2% 1.0 . 5.18 2371 2138 A 34 PHE HDx A 76 TRP HZ2 1.0 . 4.59 2372 2139 A 22 LEU HD2% A 79 PHE HZ 1.0 . 4.13 2373 2140 A 22 LEU HG A 79 PHE HZ 1.0 . 5.50 2374 2141 A 34 PHE HE% A 25 THR HA 1.0 . 5.50 2375 2142 A 76 TRP HD1 A 34 PHE HE% 1.0 . 4.51 2376 2143 A 34 PHE HE% A 39 ILE HG1x 1.0 . 5.14 2377 2143 A 39 ILE HG1y A 34 PHE HE% 1.0 . 5.14 2378 2144 A 76 TRP HE1 A 34 PHE HE% 1.0 . 5.50 2379 2145 A 34 PHE HE% A 34 PHE HDx 1.0 . 2.95 2380 2146 A 25 THR HG2% A 34 PHE HE% 1.0 . 3.80 2381 2147 A 39 ILE HD1% A 34 PHE HE% 1.0 . 3.83 2382 2148 A 34 PHE HE% A 73 ILE HA 1.0 . 4.95 2383 2149 A 76 TRP HD1 A 73 ILE HA 1.0 . 4.20 2384 2150 A 76 TRP HD1 A 25 THR HA 1.0 . 5.33 2385 2151 A 76 TRP HD1 A 34 PHE HDx 1.0 . 5.17 2386 2152 A 75 ALA HB% A 76 TRP HD1 1.0 . 3.90 2387 2153 A 76 TRP H A 76 TRP HD1 1.0 . 3.94 2388 2154 A 76 TRP HD1 A 76 TRP HA 1.0 . 5.50 2389 2155 A 72 MET HBx A 76 TRP HD1 1.0 . 4.28 2390 2156 A 76 TRP HD1 A 72 MET HGx 1.0 . 4.12 2391 2156 A 72 MET HGy A 76 TRP HD1 1.0 . 4.12 2392 2157 A 25 THR HG2% A 76 TRP HD1 1.0 . 4.37 2393 2158 A 107 TRP HBx A 107 TRP HD1 1.0 . 3.48 2394 2159 A 70 LEU HBy A 107 TRP HD1 1.0 . 4.33 2395 2160 A 107 TRP HD1 A 70 LEU HD2% 1.0 . 3.51 2396 2161 A 70 LEU H A 107 TRP HD1 1.0 . 5.00 2397 2162 A 107 TRP H A 107 TRP HD1 1.0 . 5.37 2398 2163 A 107 TRP HBy A 107 TRP HD1 1.0 . 3.77 2399 2164 A 70 LEU HD1% A 107 TRP HD1 1.0 . 4.04 2400 2165 A 39 ILE HG2% A 41 TRP HD1 1.0 . 5.16 2401 2166 A 43 THR H A 41 TRP HD1 1.0 . 5.07 2402 2167 A 36 GLN HGx A 41 TRP HD1 1.0 . 5.31 2403 2168 A 42 GLY H A 41 TRP HD1 1.0 . 3.84 2404 2169 A 35 GLY HAy A 41 TRP HD1 1.0 . 4.77 2405 2170 A 36 GLN HA A 41 TRP HD1 1.0 . 4.67 2406 2171 A 99 LEU HD1% A 41 TRP HD1 1.0 . 5.24 2407 2172 A 41 TRP H A 41 TRP HD1 1.0 . 3.93 2408 2173 A 41 TRP HA A 41 TRP HD1 1.0 . 5.38 2409 2174 A 43 THR HA A 41 TRP HD1 1.0 . 5.50 2410 2175 A 31 LEU HBy A 76 TRP HH2 1.0 . 5.21 2411 2176 A 100 MET HE% A 41 TRP HH2 1.0 . 5.12 2412 2177 A 41 TRP HH2 A 31 LEU HD2% 1.0 . 3.79 2413 2178 A 96 ARG HDx A 41 TRP HH2 1.0 . 5.50 2414 2179 A 76 TRP HH2 A 31 LEU HD2% 1.0 . 3.84 2415 2180 A 22 LEU HD2% A 76 TRP HH2 1.0 . 3.66 2416 2181 A 31 LEU HA A 76 TRP HH2 1.0 . 5.20 2417 2182 A 35 GLY HAy A 41 TRP HH2 1.0 . 5.26 2418 2183 A 31 LEU HBx A 76 TRP HH2 1.0 . 4.38 2419 2184 A 76 TRP HH2 A 22 LEU HA 1.0 . 5.24 2420 2185 A 23 PRO HBx A 76 TRP HH2 1.0 . 5.50 2421 2186 A 70 LEU H A 107 TRP HH2 1.0 . 5.33 2422 2187 A 107 TRP HH2 A 64 LYS HA 1.0 . 4.17 2423 2188 A 107 TRP HH2 A 68 THR HB 1.0 . 3.69 2424 2189 A 107 TRP HH2 A 64 LYS HGy 1.0 . 3.87 2425 2190 A 64 LYS HGx A 107 TRP HH2 1.0 . 4.48 2426 2191 A 68 THR HG2% A 107 TRP HH2 1.0 . 3.78 2427 2192 A 107 TRP HH2 A 69 THR H 1.0 . 5.50 2428 2193 A 107 TRP HH2 A 70 LEU HD1% 1.0 . 5.50 2429 2194 A 31 LEU HG A 76 TRP HZ3 1.0 . 4.98 2430 2195 A 76 TRP HZ3 A 31 LEU HD2% 1.0 . 4.19 2431 2196 A 22 LEU HD1% A 76 TRP HZ3 1.0 . 4.99 2432 2197 A 22 LEU HD2% A 76 TRP HZ3 1.0 . 4.45 2433 2198 A 68 THR HG2% A 107 TRP HZ3 1.0 . 5.08 2434 2199 A 60 VAL HG1% A 107 TRP HZ3 1.0 . 3.70 2435 2200 A 73 ILE HG1y A 107 TRP HZ3 1.0 . 4.97 2436 2201 A 73 ILE HG1x A 107 TRP HZ3 1.0 . 4.36 2437 2202 A 73 ILE HG2% A 107 TRP HZ3 1.0 . 3.84 2438 2203 A 63 ILE HB A 107 TRP HZ3 1.0 . 5.03 2439 2204 A 99 LEU HD1% A 41 TRP HZ3 1.0 . 4.90 2440 2205 A 39 ILE HG2% A 41 TRP HZ3 1.0 . 4.67 2441 2206 A 100 MET HE% A 41 TRP HZ3 1.0 . 3.95 2442 2207 A 41 TRP HZ3 A 39 ILE HG1x 1.0 . 5.04 2443 2207 A 39 ILE HG1y A 41 TRP HZ3 1.0 . 5.04 2444 2208 A 35 GLY HAy A 41 TRP HZ3 1.0 . 5.50 2445 2209 A 105 ASP H A 107 TRP HE3 1.0 . 5.33 2446 2210 A 107 TRP H A 107 TRP HE3 1.0 . 4.46 2447 2211 A 70 LEU HD1% A 107 TRP HE3 1.0 . 4.43 2448 2212 A 107 TRP HBy A 107 TRP HE3 1.0 . 3.39 2449 2213 A 107 TRP HBx A 107 TRP HE3 1.0 . 4.19 2450 2214 A 104 ALA HA A 107 TRP HE3 1.0 . 4.38 2451 2215 A 103 ILE HG2% A 107 TRP HE3 1.0 . 3.50 2452 2216 A 60 VAL HG1% A 107 TRP HE3 1.0 . 3.46 2453 2217 A 80 TYR H A 76 TRP HE3 1.0 . 5.33 2454 2218 A 80 TYR HE% A 76 TRP HE3 1.0 . 3.56 2455 2219 A 79 PHE HD% A 76 TRP HE3 1.0 . 4.01 2456 2220 A 76 TRP HA A 76 TRP HE3 1.0 . 3.81 2457 2221 A 79 PHE HBx A 76 TRP HE3 1.0 . 5.10 2458 2222 A 80 TYR HE% A 76 TRP HZ3 1.0 . 3.96 2459 2223 A 93 ALA HA A 80 TYR HE% 1.0 . 4.03 2460 2224 A 93 ALA HB% A 80 TYR HE% 1.0 . 4.04 2461 2225 A 80 TYR HA A 80 TYR HE% 1.0 . 4.56 2462 2226 A 79 PHE HD% A 80 TYR HE% 1.0 . 5.02 2463 2227 A 97 ALA HA A 80 TYR HE% 1.0 . 5.50 2464 2228 A 83 GLU HGy A 80 TYR HE% 1.0 . 5.42 2465 2229 A 96 ARG HDy A 80 TYR HE% 1.0 . 4.60 2466 2230 A 76 TRP HBx A 76 TRP HE3 1.0 . 3.80 2467 2231 A 79 PHE HBy A 76 TRP HE3 1.0 . 4.66 2468 2232 A 76 TRP HE3 A 31 LEU HD2% 1.0 . 5.49 2469 2233 A 76 TRP H A 76 TRP HE3 1.0 . 5.50 2470 2234 A 96 ARG HDx A 80 TYR HE% 1.0 . 4.16 2471 2235 A 80 TYR H A 80 TYR HE% 1.0 . 5.22 2472 2236 A 41 TRP HBx A 41 TRP HE3 1.0 . 3.69 2473 2237 A 41 TRP HE3 A 41 TRP HBy 1.0 . 4.01 2474 2238 A 41 TRP HE3 A 99 LEU HD1% 1.0 . 3.51 2475 2239 A 41 TRP HE3 A 39 ILE HG1x 1.0 . 4.82 2476 2239 A 41 TRP HE3 A 39 ILE HG1y 1.0 . 4.82 2477 2240 A 41 TRP HE3 A 39 ILE HG2% 1.0 . 3.37 2478 2241 A 49 ARG H A 95 TYR HE% 1.0 . 5.50 2479 2242 A 95 TYR HE% A 91 PRO HBx 1.0 . 3.87 2480 2243 A 49 ARG HGx A 95 TYR HE% 1.0 . 3.41 2481 2244 A 95 TYR HE% A 94 LYS HBx 1.0 . 5.50 2482 2244 A 94 LYS HBy A 95 TYR HE% 1.0 . 5.50 2483 2245 A 91 PRO HA A 95 TYR HE% 1.0 . 5.07 2484 2246 A 95 TYR HE% A 45 ALA HA 1.0 . 5.34 2485 2247 A 49 ARG HA A 95 TYR HE% 1.0 . 4.51 2486 2248 A 95 TYR HE% A 91 PRO HBy 1.0 . 4.49 2487 2249 A 70 LEU H A 107 TRP HZ2 1.0 . 3.61 2488 2250 A 69 THR HA A 107 TRP HZ2 1.0 . 3.16 2489 2251 A 64 LYS HA A 107 TRP HZ2 1.0 . 4.64 2490 2252 A 64 LYS HGx A 107 TRP HZ2 1.0 . 3.85 2491 2253 A 70 LEU HD1% A 107 TRP HZ2 1.0 . 4.71 2492 2254 A 69 THR HB A 107 TRP HZ2 1.0 . 4.30 2493 2255 A 68 THR HB A 107 TRP HZ2 1.0 . 4.74 2494 2256 A 70 LEU HA A 107 TRP HZ2 1.0 . 4.60 2495 2257 A 64 LYS HDx A 107 TRP HZ2 1.0 . 5.28 2496 2258 A 64 LYS HGy A 107 TRP HZ2 1.0 . 4.30 2497 2259 A 76 TRP HZ2 A 31 LEU HD2% 1.0 . 4.24 2498 2260 A 25 THR HG2% A 76 TRP HZ2 1.0 . 3.14 2499 2261 A 31 LEU HBy A 76 TRP HZ2 1.0 . 5.50 2500 2262 A 23 PRO HBx A 76 TRP HZ2 1.0 . 4.88 2501 2263 A 31 LEU HBx A 76 TRP HZ2 1.0 . 5.42 2502 2264 A 25 THR HA A 76 TRP HZ2 1.0 . 5.01 2503 2265 A 35 GLY H A 41 TRP HZ2 1.0 . 4.65 2504 2266 A 41 TRP HZ2 A 31 LEU HD2% 1.0 . 3.30 2505 2267 A 35 GLY HAy A 41 TRP HZ2 1.0 . 3.99 2506 2268 A 35 GLY HAx A 41 TRP HZ2 1.0 . 4.82 stop_ save_