data_nef_c19453_2mct save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 SER middle . . 3 A 3 PRO middle . false 4 A 4 ILE middle . . 5 A 5 LEU middle . . 6 A 6 PRO middle . false 7 A 7 LYS middle . . 8 A 8 ALA middle . . 9 A 9 GLU middle . . 10 A 10 ASN middle . . 11 A 11 VAL middle . . 12 A 12 ASP middle . . 13 A 13 SER middle . . 14 A 14 ILE middle . . 15 A 15 CYS middle . . 16 A 16 ILE middle . . 17 A 17 ASP middle . . 18 A 18 PHE middle . . 19 A 19 THR middle . . 20 A 20 ASN middle . . 21 A 21 SER middle . . 22 A 22 ILE middle . . 23 A 23 GLN middle . . 24 A 24 LYS middle . . 25 A 25 ILE middle . . 26 A 26 TYR middle . . 27 A 27 ASP middle . . 28 A 28 ASP middle . . 29 A 29 SER middle . . 30 A 30 GLU middle . . 31 A 31 SER middle . . 32 A 32 ILE middle . . 33 A 33 GLN middle . . 34 A 34 LYS middle . . 35 A 35 ILE middle . . 36 A 36 LEU middle . . 37 A 37 SER middle . . 38 A 38 GLU middle . . 39 A 39 ILE middle . . 40 A 40 ALA middle . . 41 A 41 THR middle . . 42 A 42 GLY middle . false 43 A 43 LYS middle . . 44 A 44 ARG middle . . 45 A 45 THR middle . . 46 A 46 GLU middle . . 47 A 47 LYS middle . . 48 A 48 GLN middle . . 49 A 49 SER middle . . 50 A 50 ILE middle . . 51 A 51 GLN middle . . 52 A 52 ASP middle . . 53 A 53 TYR middle . . 54 A 54 PRO middle . false 55 A 55 SER middle . . 56 A 56 ALA middle . . 57 A 57 GLU middle . . 58 A 58 GLU middle . . 59 A 59 TYR middle . . 60 A 60 GLY middle . false 61 A 61 THR middle . . 62 A 62 ILE middle . . 63 A 63 ASN middle . . 64 A 64 ILE middle . . 65 A 65 GLU middle . . 66 A 66 ASN middle . . 67 A 67 ASN middle . . 68 A 68 GLY middle . false 69 A 69 GLY middle . false 70 A 70 MET middle . . 71 A 71 THR middle . . 72 A 72 THR middle . . 73 A 73 MET middle . . 74 A 74 PHE middle . . 75 A 75 TYR middle . . 76 A 76 TYR middle . . 77 A 77 GLU middle . . 78 A 78 GLU middle . . 79 A 79 ASN middle . . 80 A 80 GLY middle . false 81 A 81 LYS middle . . 82 A 82 TYR middle . . 83 A 83 TYR middle . . 84 A 84 ILE middle . . 85 A 85 GLU middle . . 86 A 86 CYS middle . . 87 A 87 PRO middle . false 88 A 88 TYR middle . . 89 A 89 LYS middle . . 90 A 90 GLY middle . false 91 A 91 ILE middle . . 92 A 92 TYR middle . . 93 A 93 GLU middle . . 94 A 94 ILE middle . . 95 A 95 GLU middle . . 96 A 96 ASN middle . . 97 A 97 ASN middle . . 98 A 98 PHE middle . . 99 A 99 GLU middle . . 100 A 100 ASP middle . . 101 A 101 MET middle . . 102 A 102 ILE 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 PRO HA H 1 3.776 0.0064 A 3 PRO HBy H 1 1.442 0.0064 A 3 PRO HBx H 1 1.069 0.0064 A 3 PRO HDx H 1 3.187 0.0064 A 3 PRO HDy H 1 3.256 0.0064 A 3 PRO HGx H 1 0.178 0.0064 A 3 PRO HGy H 1 0.178 0.0064 A 3 PRO CA C 13 62.923 0.1484 A 3 PRO CB C 13 31.156 0.1484 A 3 PRO CD C 13 50.321 0.1484 A 3 PRO CG C 13 25.803 0.1484 A 4 ILE H H 1 8.067 0.0064 A 4 ILE HA H 1 3.926 0.0064 A 4 ILE HB H 1 1.750 0.0064 A 4 ILE HD1% H 1 0.818 0.0064 A 4 ILE HG1y H 1 1.508 0.0064 A 4 ILE HG1x H 1 1.228 0.0064 A 4 ILE HG2% H 1 0.765 0.0064 A 4 ILE CA C 13 61.038 0.1484 A 4 ILE CB C 13 36.581 0.1484 A 4 ILE CD1 C 13 11.908 0.1484 A 4 ILE CG1 C 13 27.324 0.1484 A 4 ILE CG2 C 13 17.173 0.1484 A 4 ILE N N 15 122.637 0.0254 A 5 LEU H H 1 8.154 0.0064 A 5 LEU HA H 1 4.714 0.0064 A 5 LEU HBy H 1 1.423 0.0064 A 5 LEU HBx H 1 1.308 0.0064 A 5 LEU HDy% H 1 0.769 0.0064 A 5 LEU HG H 1 1.312 0.0064 A 5 LEU CA C 13 51.060 0.1484 A 5 LEU CB C 13 44.650 0.1484 A 5 LEU CDx C 13 21.565 0.1484 A 5 LEU CDy C 13 26.034 0.1484 A 5 LEU CG C 13 26.058 0.1484 A 5 LEU N N 15 127.924 0.0254 A 6 PRO HA H 1 4.421 0.0064 A 6 PRO HBy H 1 2.035 0.0064 A 6 PRO HBx H 1 1.577 0.0064 A 6 PRO HDx H 1 3.189 0.0064 A 6 PRO HDy H 1 3.657 0.0064 A 6 PRO HGy H 1 1.656 0.0064 A 6 PRO HGx H 1 1.526 0.0064 A 6 PRO CA C 13 61.034 0.1484 A 6 PRO CB C 13 31.516 0.1484 A 6 PRO CD C 13 49.051 0.1484 A 6 PRO CG C 13 26.966 0.1484 A 7 LYS H H 1 8.369 0.0064 A 7 LYS HA H 1 4.033 0.0064 A 7 LYS HBy H 1 1.905 0.0064 A 7 LYS HBx H 1 1.608 0.0064 A 7 LYS HDy H 1 1.631 0.0064 A 7 LYS HEy H 1 2.951 0.0064 A 7 LYS HGx H 1 1.433 0.0064 A 7 LYS HGy H 1 1.530 0.0064 A 7 LYS CA C 13 55.735 0.1484 A 7 LYS CB C 13 32.404 0.1484 A 7 LYS CD C 13 28.876 0.1484 A 7 LYS CE C 13 41.887 0.1484 A 7 LYS CG C 13 24.952 0.1484 A 7 LYS N N 15 118.478 0.0254 A 8 ALA H H 1 8.655 0.0064 A 8 ALA HA H 1 3.534 0.0064 A 8 ALA HB% H 1 1.322 0.0064 A 8 ALA CA C 13 55.504 0.1484 A 8 ALA CB C 13 18.219 0.1484 A 8 ALA N N 15 124.542 0.0254 A 9 GLU H H 1 9.191 0.0064 A 9 GLU HA H 1 4.116 0.0064 A 9 GLU HBx H 1 1.973 0.0064 A 9 GLU HBy H 1 1.973 0.0064 A 9 GLU HGy H 1 2.158 0.0064 A 9 GLU HGx H 1 2.100 0.0064 A 9 GLU CA C 13 57.919 0.1484 A 9 GLU CB C 13 28.233 0.1484 A 9 GLU CG C 13 35.505 0.1484 A 9 GLU N N 15 113.430 0.0254 A 10 ASN H H 1 7.923 0.0064 A 10 ASN HA H 1 4.986 0.0064 A 10 ASN HBy H 1 3.187 0.0064 A 10 ASN HBx H 1 2.523 0.0064 A 10 ASN HD2x H 1 7.015 0.0064 A 10 ASN HD2y H 1 7.721 0.0064 A 10 ASN CA C 13 52.438 0.1484 A 10 ASN CB C 13 40.067 0.1484 A 10 ASN N N 15 115.817 0.0254 A 10 ASN ND2 N 15 110.079 0.0254 A 11 VAL H H 1 7.531 0.0064 A 11 VAL HA H 1 4.218 0.0064 A 11 VAL HB H 1 2.148 0.0064 A 11 VAL HGx% H 1 0.838 0.0064 A 11 VAL HGy% H 1 0.699 0.0064 A 11 VAL CA C 13 61.805 0.1484 A 11 VAL CB C 13 32.203 0.1484 A 11 VAL CGy C 13 23.266 0.1484 A 11 VAL CGx C 13 22.844 0.1484 A 11 VAL N N 15 120.758 0.0254 A 12 ASP H H 1 8.461 0.0064 A 12 ASP HA H 1 4.555 0.0064 A 12 ASP HBy H 1 2.642 0.0064 A 12 ASP HBx H 1 2.223 0.0064 A 12 ASP CA C 13 55.918 0.1484 A 12 ASP CB C 13 42.978 0.1484 A 12 ASP N N 15 125.624 0.0254 A 13 SER H H 1 7.496 0.0064 A 13 SER HA H 1 4.787 0.0064 A 13 SER HBx H 1 3.588 0.0064 A 13 SER HBy H 1 4.081 0.0064 A 13 SER CA C 13 58.302 0.1484 A 13 SER CB C 13 64.575 0.1484 A 13 SER N N 15 108.535 0.0254 A 14 ILE H H 1 8.938 0.0064 A 14 ILE HA H 1 4.908 0.0064 A 14 ILE HB H 1 1.656 0.0064 A 14 ILE HD1% H 1 0.800 0.0064 A 14 ILE HG1x H 1 1.006 0.0064 A 14 ILE HG1y H 1 1.700 0.0064 A 14 ILE HG2% H 1 0.806 0.0064 A 14 ILE CA C 13 60.686 0.1484 A 14 ILE CB C 13 41.713 0.1484 A 14 ILE CD1 C 13 14.619 0.1484 A 14 ILE CG1 C 13 28.367 0.1484 A 14 ILE CG2 C 13 17.221 0.1484 A 14 ILE N N 15 118.240 0.0254 A 15 CYS H H 1 9.249 0.0064 A 15 CYS HA H 1 5.399 0.0064 A 15 CYS HBx H 1 2.814 0.0064 A 15 CYS HBy H 1 2.892 0.0064 A 15 CYS CA C 13 56.308 0.1484 A 15 CYS CB C 13 28.300 0.1484 A 15 CYS N N 15 128.109 0.0254 A 16 ILE H H 1 9.532 0.0064 A 16 ILE HA H 1 5.140 0.0064 A 16 ILE HB H 1 1.833 0.0064 A 16 ILE HD1% H 1 0.856 0.0064 A 16 ILE HG1y H 1 1.753 0.0064 A 16 ILE HG1x H 1 1.031 0.0064 A 16 ILE HG2% H 1 0.366 0.0064 A 16 ILE CA C 13 59.868 0.1484 A 16 ILE CB C 13 40.320 0.1484 A 16 ILE CD1 C 13 13.274 0.1484 A 16 ILE CG1 C 13 28.349 0.1484 A 16 ILE CG2 C 13 16.445 0.1484 A 16 ILE N N 15 130.224 0.0254 A 17 ASP H H 1 9.131 0.0064 A 17 ASP HA H 1 5.224 0.0064 A 17 ASP HBy H 1 2.761 0.0064 A 17 ASP HBx H 1 2.661 0.0064 A 17 ASP CA C 13 52.928 0.1484 A 17 ASP CB C 13 41.752 0.1484 A 17 ASP N N 15 127.172 0.0254 A 18 PHE H H 1 8.952 0.0064 A 18 PHE HA H 1 5.102 0.0064 A 18 PHE HBy H 1 3.421 0.0064 A 18 PHE HBx H 1 3.354 0.0064 A 18 PHE HDx H 1 7.522 0.0064 A 18 PHE HDy H 1 7.522 0.0064 A 18 PHE HEx H 1 7.310 0.0064 A 18 PHE CA C 13 57.679 0.1484 A 18 PHE CB C 13 40.100 0.1484 A 18 PHE CDx C 13 134.480 0.1484 A 18 PHE CEx C 13 132.681 0.1484 A 18 PHE N N 15 120.740 0.0254 A 19 THR H H 1 9.272 0.0064 A 19 THR HA H 1 3.886 0.0064 A 19 THR HB H 1 4.262 0.0064 A 19 THR HG2% H 1 1.230 0.0064 A 19 THR CA C 13 65.113 0.1484 A 19 THR CB C 13 68.774 0.1484 A 19 THR CG2 C 13 21.803 0.1484 A 19 THR N N 15 114.091 0.0254 A 20 ASN H H 1 8.040 0.0064 A 20 ASN HA H 1 4.702 0.0064 A 20 ASN HBx H 1 2.803 0.0064 A 20 ASN HBy H 1 3.158 0.0064 A 20 ASN HD2x H 1 6.322 0.0064 A 20 ASN HD2y H 1 7.355 0.0064 A 20 ASN CA C 13 52.387 0.1484 A 20 ASN CB C 13 37.104 0.1484 A 20 ASN N N 15 117.195 0.0254 A 20 ASN ND2 N 15 107.560 0.0254 A 21 SER H H 1 8.068 0.0064 A 21 SER HA H 1 4.167 0.0064 A 21 SER HBy H 1 4.752 0.0064 A 21 SER HBx H 1 4.010 0.0064 A 21 SER CA C 13 60.460 0.1484 A 21 SER CB C 13 61.844 0.1484 A 21 SER N N 15 109.771 0.0254 A 22 ILE H H 1 7.562 0.0064 A 22 ILE HA H 1 4.143 0.0064 A 22 ILE HB H 1 1.943 0.0064 A 22 ILE HD1% H 1 0.723 0.0064 A 22 ILE HG1y H 1 1.344 0.0064 A 22 ILE HG1x H 1 1.146 0.0064 A 22 ILE HG2% H 1 0.807 0.0064 A 22 ILE CA C 13 60.770 0.1484 A 22 ILE CB C 13 37.900 0.1484 A 22 ILE CD1 C 13 11.922 0.1484 A 22 ILE CG1 C 13 27.622 0.1484 A 22 ILE CG2 C 13 17.401 0.1484 A 22 ILE N N 15 121.777 0.0254 A 23 GLN H H 1 8.420 0.0064 A 23 GLN HA H 1 5.777 0.0064 A 23 GLN HBy H 1 2.024 0.0064 A 23 GLN HBx H 1 1.939 0.0064 A 23 GLN HE2x H 1 6.594 0.0064 A 23 GLN HE2y H 1 8.700 0.0064 A 23 GLN HGx H 1 1.813 0.0064 A 23 GLN HGy H 1 2.359 0.0064 A 23 GLN CA C 13 54.171 0.1484 A 23 GLN CB C 13 33.153 0.1484 A 23 GLN CG C 13 36.107 0.1484 A 23 GLN N N 15 125.114 0.0254 A 23 GLN NE2 N 15 114.185 0.0254 A 24 LYS H H 1 9.131 0.0064 A 24 LYS HA H 1 4.596 0.0064 A 24 LYS HBy H 1 1.755 0.0064 A 24 LYS HBx H 1 1.613 0.0064 A 24 LYS HEy H 1 2.719 0.0064 A 24 LYS HEx H 1 2.601 0.0064 A 24 LYS HGy H 1 1.206 0.0064 A 24 LYS HGx H 1 1.024 0.0064 A 24 LYS CA C 13 55.311 0.1484 A 24 LYS CB C 13 36.870 0.1484 A 24 LYS CE C 13 42.090 0.1484 A 24 LYS CG C 13 25.441 0.1484 A 24 LYS N N 15 125.530 0.0254 A 25 ILE H H 1 8.202 0.0064 A 25 ILE HA H 1 4.692 0.0064 A 25 ILE HB H 1 1.593 0.0064 A 25 ILE HD1% H 1 0.833 0.0064 A 25 ILE HG1x H 1 0.992 0.0064 A 25 ILE HG1y H 1 1.507 0.0064 A 25 ILE HG2% H 1 0.769 0.0064 A 25 ILE CA C 13 60.061 0.1484 A 25 ILE CB C 13 39.356 0.1484 A 25 ILE CD1 C 13 13.307 0.1484 A 25 ILE CG1 C 13 28.513 0.1484 A 25 ILE CG2 C 13 17.593 0.1484 A 25 ILE N N 15 121.962 0.0254 A 26 TYR H H 1 9.538 0.0064 A 26 TYR HA H 1 4.775 0.0064 A 26 TYR HBx H 1 2.826 0.0064 A 26 TYR HBy H 1 2.826 0.0064 A 26 TYR HDx H 1 7.095 0.0064 A 26 TYR HDy H 1 7.095 0.0064 A 26 TYR HEx H 1 6.689 0.0064 A 26 TYR HEy H 1 6.689 0.0064 A 26 TYR CA C 13 56.703 0.1484 A 26 TYR CB C 13 38.937 0.1484 A 26 TYR CDx C 13 135.509 0.1484 A 26 TYR CEx C 13 119.752 0.1484 A 26 TYR N N 15 127.274 0.0254 A 27 ASP H H 1 8.871 0.0064 A 27 ASP HA H 1 4.803 0.0064 A 27 ASP HBy H 1 3.091 0.0064 A 27 ASP HBx H 1 2.402 0.0064 A 27 ASP CA C 13 52.637 0.1484 A 27 ASP CB C 13 41.041 0.1484 A 27 ASP N N 15 120.136 0.0254 A 28 ASP H H 1 8.231 0.0064 A 28 ASP HA H 1 5.032 0.0064 A 28 ASP HBy H 1 2.909 0.0064 A 28 ASP HBx H 1 2.728 0.0064 A 28 ASP CA C 13 51.558 0.1484 A 28 ASP CB C 13 43.008 0.1484 A 28 ASP N N 15 117.393 0.0254 A 29 SER H H 1 8.915 0.0064 A 29 SER HA H 1 3.981 0.0064 A 29 SER HBx H 1 3.893 0.0064 A 29 SER HBy H 1 3.893 0.0064 A 29 SER CA C 13 61.735 0.1484 A 29 SER CB C 13 62.655 0.1484 A 29 SER N N 15 116.997 0.0254 A 30 GLU H H 1 8.486 0.0064 A 30 GLU HA H 1 4.000 0.0064 A 30 GLU HBy H 1 2.141 0.0064 A 30 GLU HBx H 1 2.035 0.0064 A 30 GLU HGx H 1 2.265 0.0064 A 30 GLU HGy H 1 2.316 0.0064 A 30 GLU CA C 13 59.963 0.1484 A 30 GLU CB C 13 29.015 0.1484 A 30 GLU CG C 13 36.525 0.1484 A 30 GLU N N 15 120.709 0.0254 A 31 SER H H 1 8.367 0.0064 A 31 SER HA H 1 4.060 0.0064 A 31 SER HBx H 1 3.793 0.0064 A 31 SER HBy H 1 4.137 0.0064 A 31 SER CA C 13 61.992 0.1484 A 31 SER CB C 13 62.070 0.1484 A 31 SER N N 15 117.632 0.0254 A 32 ILE H H 1 8.076 0.0064 A 32 ILE HA H 1 3.342 0.0064 A 32 ILE HB H 1 1.733 0.0064 A 32 ILE HD1% H 1 0.564 0.0064 A 32 ILE HG1x H 1 0.569 0.0064 A 32 ILE HG1y H 1 0.569 0.0064 A 32 ILE HG2% H 1 0.776 0.0064 A 32 ILE CA C 13 65.896 0.1484 A 32 ILE CB C 13 38.030 0.1484 A 32 ILE CD1 C 13 13.522 0.1484 A 32 ILE CG1 C 13 30.668 0.1484 A 32 ILE CG2 C 13 17.084 0.1484 A 32 ILE N N 15 121.164 0.0254 A 33 GLN H H 1 8.140 0.0064 A 33 GLN HA H 1 3.857 0.0064 A 33 GLN HBx H 1 2.084 0.0064 A 33 GLN HBy H 1 2.084 0.0064 A 33 GLN HE2y H 1 7.285 0.0064 A 33 GLN HE2x H 1 6.807 0.0064 A 33 GLN HGx H 1 2.258 0.0064 A 33 GLN HGy H 1 2.426 0.0064 A 33 GLN CA C 13 58.835 0.1484 A 33 GLN CB C 13 28.285 0.1484 A 33 GLN CG C 13 34.046 0.1484 A 33 GLN N N 15 116.303 0.0254 A 33 GLN NE2 N 15 111.140 0.0254 A 34 LYS H H 1 7.812 0.0064 A 34 LYS HA H 1 3.965 0.0064 A 34 LYS HBy H 1 1.962 0.0064 A 34 LYS HBx H 1 1.894 0.0064 A 34 LYS HDx H 1 1.613 0.0064 A 34 LYS HDy H 1 1.669 0.0064 A 34 LYS HEx H 1 2.862 0.0064 A 34 LYS HEy H 1 2.862 0.0064 A 34 LYS HGx H 1 1.304 0.0064 A 34 LYS HGy H 1 1.400 0.0064 A 34 LYS CA C 13 59.214 0.1484 A 34 LYS CB C 13 32.186 0.1484 A 34 LYS CD C 13 28.962 0.1484 A 34 LYS CE C 13 42.050 0.1484 A 34 LYS CG C 13 24.801 0.1484 A 34 LYS N N 15 120.324 0.0254 A 35 ILE H H 1 8.208 0.0064 A 35 ILE HA H 1 3.379 0.0064 A 35 ILE HB H 1 1.635 0.0064 A 35 ILE HD1% H 1 -0.008 0.0064 A 35 ILE HG1x H 1 0.579 0.0064 A 35 ILE HG1y H 1 1.513 0.0064 A 35 ILE HG2% H 1 0.842 0.0064 A 35 ILE CA C 13 65.674 0.1484 A 35 ILE CB C 13 37.802 0.1484 A 35 ILE CD1 C 13 12.754 0.1484 A 35 ILE CG1 C 13 29.680 0.1484 A 35 ILE CG2 C 13 17.683 0.1484 A 35 ILE N N 15 119.048 0.0254 A 36 LEU H H 1 8.289 0.0064 A 36 LEU HA H 1 3.837 0.0064 A 36 LEU HBx H 1 1.435 0.0064 A 36 LEU HBy H 1 1.830 0.0064 A 36 LEU HDy% H 1 0.741 0.0064 A 36 LEU HG H 1 1.910 0.0064 A 36 LEU CA C 13 58.091 0.1484 A 36 LEU CB C 13 40.694 0.1484 A 36 LEU CDy C 13 22.736 0.1484 A 36 LEU CG C 13 26.295 0.1484 A 36 LEU N N 15 116.792 0.0254 A 37 SER H H 1 8.297 0.0064 A 37 SER HA H 1 4.042 0.0064 A 37 SER HBx H 1 3.877 0.0064 A 37 SER HBy H 1 3.968 0.0064 A 37 SER CA C 13 61.648 0.1484 A 37 SER CB C 13 62.304 0.1484 A 37 SER N N 15 113.430 0.0254 A 38 GLU H H 1 7.699 0.0064 A 38 GLU HA H 1 4.379 0.0064 A 38 GLU HBx H 1 1.968 0.0064 A 38 GLU HBy H 1 1.968 0.0064 A 38 GLU HGx H 1 2.153 0.0064 A 38 GLU HGy H 1 2.391 0.0064 A 38 GLU CA C 13 57.408 0.1484 A 38 GLU CB C 13 27.315 0.1484 A 38 GLU CG C 13 32.914 0.1484 A 38 GLU N N 15 119.783 0.0254 A 39 ILE H H 1 8.231 0.0064 A 39 ILE HA H 1 3.386 0.0064 A 39 ILE HB H 1 1.770 0.0064 A 39 ILE HD1% H 1 0.590 0.0064 A 39 ILE HG1x H 1 0.590 0.0064 A 39 ILE HG1y H 1 2.095 0.0064 A 39 ILE HG2% H 1 0.739 0.0064 A 39 ILE CA C 13 65.687 0.1484 A 39 ILE CB C 13 37.627 0.1484 A 39 ILE CD1 C 13 13.616 0.1484 A 39 ILE CG1 C 13 29.067 0.1484 A 39 ILE CG2 C 13 14.606 0.1484 A 39 ILE N N 15 121.980 0.0254 A 40 ALA H H 1 7.846 0.0064 A 40 ALA HA H 1 3.962 0.0064 A 40 ALA HB% H 1 1.424 0.0064 A 40 ALA CA C 13 53.552 0.1484 A 40 ALA CB C 13 18.288 0.1484 A 40 ALA N N 15 117.263 0.0254 A 41 THR H H 1 7.210 0.0064 A 41 THR HA H 1 4.256 0.0064 A 41 THR HB H 1 4.355 0.0064 A 41 THR HG2% H 1 1.418 0.0064 A 41 THR CA C 13 62.756 0.1484 A 41 THR CB C 13 69.847 0.1484 A 41 THR CG2 C 13 20.912 0.1484 A 41 THR N N 15 106.764 0.0254 A 42 GLY H H 1 8.045 0.0064 A 42 GLY HAy H 1 4.250 0.0064 A 42 GLY HAx H 1 3.010 0.0064 A 42 GLY CA C 13 46.566 0.1484 A 42 GLY N N 15 107.934 0.0254 A 43 LYS H H 1 8.927 0.0064 A 43 LYS HA H 1 4.901 0.0064 A 43 LYS HBy H 1 1.876 0.0064 A 43 LYS HBx H 1 1.862 0.0064 A 43 LYS HDx H 1 1.719 0.0064 A 43 LYS HDy H 1 1.719 0.0064 A 43 LYS HEx H 1 3.023 0.0064 A 43 LYS HEy H 1 3.023 0.0064 A 43 LYS HGx H 1 1.475 0.0064 A 43 LYS HGy H 1 1.668 0.0064 A 43 LYS CA C 13 54.204 0.1484 A 43 LYS CB C 13 34.392 0.1484 A 43 LYS CD C 13 29.134 0.1484 A 43 LYS CE C 13 42.139 0.1484 A 43 LYS CG C 13 24.530 0.1484 A 43 LYS N N 15 123.814 0.0254 A 44 ARG H H 1 8.766 0.0064 A 44 ARG HA H 1 3.587 0.0064 A 44 ARG HBx H 1 1.820 0.0064 A 44 ARG HBy H 1 1.820 0.0064 A 44 ARG HDx H 1 3.083 0.0064 A 44 ARG HDy H 1 3.083 0.0064 A 44 ARG HGx H 1 0.914 0.0064 A 44 ARG HGy H 1 1.913 0.0064 A 44 ARG CA C 13 58.792 0.1484 A 44 ARG CB C 13 29.715 0.1484 A 44 ARG CD C 13 43.053 0.1484 A 44 ARG CG C 13 27.385 0.1484 A 44 ARG N N 15 126.933 0.0254 A 45 THR H H 1 8.491 0.0064 A 45 THR HA H 1 4.894 0.0064 A 45 THR HB H 1 4.565 0.0064 A 45 THR HG2% H 1 1.588 0.0064 A 45 THR CA C 13 60.605 0.1484 A 45 THR CB C 13 71.816 0.1484 A 45 THR CG2 C 13 22.159 0.1484 A 45 THR N N 15 118.103 0.0254 A 46 GLU H H 1 8.898 0.0064 A 46 GLU HA H 1 4.305 0.0064 A 46 GLU HBy H 1 2.226 0.0064 A 46 GLU HBx H 1 1.849 0.0064 A 46 GLU HGx H 1 2.205 0.0064 A 46 GLU HGy H 1 2.323 0.0064 A 46 GLU CA C 13 55.930 0.1484 A 46 GLU CB C 13 28.997 0.1484 A 46 GLU CG C 13 36.010 0.1484 A 46 GLU N N 15 116.715 0.0254 A 47 LYS H H 1 7.647 0.0064 A 47 LYS HA H 1 4.026 0.0064 A 47 LYS HBy H 1 1.560 0.0064 A 47 LYS HBx H 1 1.345 0.0064 A 47 LYS HEx H 1 2.552 0.0064 A 47 LYS HEy H 1 2.684 0.0064 A 47 LYS HGx H 1 1.257 0.0064 A 47 LYS HGy H 1 1.325 0.0064 A 47 LYS CA C 13 56.327 0.1484 A 47 LYS CB C 13 33.214 0.1484 A 47 LYS CE C 13 41.010 0.1484 A 47 LYS CG C 13 24.291 0.1484 A 47 LYS N N 15 121.036 0.0254 A 48 GLN H H 1 8.519 0.0064 A 48 GLN HA H 1 4.182 0.0064 A 48 GLN HBy H 1 1.813 0.0064 A 48 GLN HBx H 1 1.747 0.0064 A 48 GLN HE2x H 1 7.343 0.0064 A 48 GLN HGy H 1 2.314 0.0064 A 48 GLN HGx H 1 2.238 0.0064 A 48 GLN CA C 13 54.589 0.1484 A 48 GLN CB C 13 29.703 0.1484 A 48 GLN CG C 13 33.519 0.1484 A 48 GLN N N 15 121.939 0.0254 A 48 GLN NE2 N 15 112.165 0.0254 A 49 SER H H 1 8.630 0.0064 A 49 SER HA H 1 4.396 0.0064 A 49 SER HBx H 1 3.299 0.0064 A 49 SER HBy H 1 3.414 0.0064 A 49 SER CA C 13 56.653 0.1484 A 49 SER CB C 13 61.547 0.1484 A 49 SER N N 15 117.730 0.0254 A 50 ILE H H 1 8.461 0.0064 A 50 ILE HA H 1 4.437 0.0064 A 50 ILE HB H 1 2.142 0.0064 A 50 ILE HD1% H 1 0.763 0.0064 A 50 ILE HG1x H 1 0.911 0.0064 A 50 ILE HG1y H 1 1.094 0.0064 A 50 ILE HG2% H 1 0.718 0.0064 A 50 ILE CA C 13 60.192 0.1484 A 50 ILE CB C 13 39.746 0.1484 A 50 ILE CD1 C 13 13.927 0.1484 A 50 ILE CG1 C 13 25.994 0.1484 A 50 ILE CG2 C 13 18.115 0.1484 A 50 ILE N N 15 120.525 0.0254 A 51 GLN H H 1 6.956 0.0064 A 51 GLN HA H 1 4.668 0.0064 A 51 GLN HBy H 1 2.035 0.0064 A 51 GLN HBx H 1 1.783 0.0064 A 51 GLN HE2y H 1 7.294 0.0064 A 51 GLN HE2x H 1 6.650 0.0064 A 51 GLN HGy H 1 2.186 0.0064 A 51 GLN HGx H 1 2.090 0.0064 A 51 GLN CA C 13 53.648 0.1484 A 51 GLN CB C 13 31.453 0.1484 A 51 GLN CG C 13 32.745 0.1484 A 51 GLN N N 15 117.389 0.0254 A 51 GLN NE2 N 15 110.953 0.0254 A 52 ASP H H 1 8.171 0.0064 A 52 ASP HA H 1 4.039 0.0064 A 52 ASP HBx H 1 2.502 0.0064 A 52 ASP HBy H 1 2.502 0.0064 A 52 ASP CA C 13 56.116 0.1484 A 52 ASP CB C 13 41.379 0.1484 A 52 ASP N N 15 115.553 0.0254 A 53 TYR H H 1 6.843 0.0064 A 53 TYR HA H 1 4.137 0.0064 A 53 TYR HBy H 1 2.469 0.0064 A 53 TYR HBx H 1 2.126 0.0064 A 53 TYR HDx H 1 6.843 0.0064 A 53 TYR HDy H 1 6.843 0.0064 A 53 TYR HEx H 1 6.805 0.0064 A 53 TYR HEy H 1 6.805 0.0064 A 53 TYR CA C 13 53.788 0.1484 A 53 TYR CB C 13 38.105 0.1484 A 53 TYR CDy C 13 136.119 0.1484 A 53 TYR CEx C 13 119.438 0.1484 A 53 TYR N N 15 111.429 0.0254 A 54 PRO HA H 1 3.964 0.0064 A 54 PRO HBx H 1 0.780 0.0064 A 54 PRO HBy H 1 1.612 0.0064 A 54 PRO HGx H 1 0.646 0.0064 A 54 PRO HGy H 1 0.907 0.0064 A 54 PRO CA C 13 61.571 0.1484 A 54 PRO CB C 13 32.535 0.1484 A 54 PRO CG C 13 28.382 0.1484 A 55 SER H H 1 8.311 0.0064 A 55 SER HA H 1 4.129 0.0064 A 55 SER HBx H 1 3.635 0.0064 A 55 SER HBy H 1 3.691 0.0064 A 55 SER CA C 13 57.823 0.1484 A 55 SER CB C 13 62.692 0.1484 A 55 SER N N 15 114.071 0.0254 A 56 ALA H H 1 6.365 0.0064 A 56 ALA HA H 1 3.998 0.0064 A 56 ALA HB% H 1 0.867 0.0064 A 56 ALA CA C 13 51.513 0.1484 A 56 ALA CB C 13 19.321 0.1484 A 56 ALA N N 15 123.584 0.0254 A 57 GLU H H 1 8.506 0.0064 A 57 GLU HA H 1 3.951 0.0064 A 57 GLU HBx H 1 1.998 0.0064 A 57 GLU HBy H 1 2.038 0.0064 A 57 GLU HGx H 1 2.287 0.0064 A 57 GLU HGy H 1 2.330 0.0064 A 57 GLU CA C 13 58.518 0.1484 A 57 GLU CB C 13 29.975 0.1484 A 57 GLU CG C 13 36.339 0.1484 A 57 GLU N N 15 119.864 0.0254 A 58 GLU H H 1 7.786 0.0064 A 58 GLU HA H 1 4.516 0.0064 A 58 GLU HBx H 1 1.935 0.0064 A 58 GLU HBy H 1 1.950 0.0064 A 58 GLU HGx H 1 2.181 0.0064 A 58 GLU HGy H 1 2.181 0.0064 A 58 GLU CA C 13 54.442 0.1484 A 58 GLU CB C 13 31.798 0.1484 A 58 GLU CG C 13 35.608 0.1484 A 58 GLU N N 15 114.761 0.0254 A 59 TYR H H 1 7.823 0.0064 A 59 TYR HA H 1 5.124 0.0064 A 59 TYR HBx H 1 2.870 0.0064 A 59 TYR HBy H 1 3.305 0.0064 A 59 TYR HDx H 1 6.767 0.0064 A 59 TYR HDy H 1 6.767 0.0064 A 59 TYR HEx H 1 6.617 0.0064 A 59 TYR HEy H 1 6.617 0.0064 A 59 TYR CA C 13 55.814 0.1484 A 59 TYR CB C 13 40.237 0.1484 A 59 TYR CDy C 13 136.107 0.1484 A 59 TYR CEy C 13 119.943 0.1484 A 59 TYR N N 15 117.366 0.0254 A 60 GLY H H 1 8.711 0.0064 A 60 GLY HAy H 1 4.538 0.0064 A 60 GLY HAx H 1 3.078 0.0064 A 60 GLY CA C 13 42.972 0.1484 A 60 GLY N N 15 109.114 0.0254 A 61 THR H H 1 8.791 0.0064 A 61 THR HA H 1 5.095 0.0064 A 61 THR HB H 1 4.229 0.0064 A 61 THR HG2% H 1 1.229 0.0064 A 61 THR CA C 13 62.587 0.1484 A 61 THR CB C 13 71.252 0.1484 A 61 THR CG2 C 13 22.161 0.1484 A 61 THR N N 15 114.830 0.0254 A 62 ILE H H 1 9.343 0.0064 A 62 ILE HA H 1 4.372 0.0064 A 62 ILE HB H 1 1.492 0.0064 A 62 ILE HD1% H 1 0.113 0.0064 A 62 ILE HG1x H 1 0.647 0.0064 A 62 ILE HG1y H 1 1.503 0.0064 A 62 ILE HG2% H 1 0.611 0.0064 A 62 ILE CA C 13 60.223 0.1484 A 62 ILE CB C 13 40.440 0.1484 A 62 ILE CD1 C 13 14.390 0.1484 A 62 ILE CG1 C 13 26.962 0.1484 A 62 ILE CG2 C 13 17.195 0.1484 A 62 ILE N N 15 126.252 0.0254 A 63 ASN H H 1 9.079 0.0064 A 63 ASN HA H 1 5.396 0.0064 A 63 ASN HBy H 1 2.888 0.0064 A 63 ASN HBx H 1 2.697 0.0064 A 63 ASN HD2x H 1 6.818 0.0064 A 63 ASN HD2y H 1 7.937 0.0064 A 63 ASN CA C 13 52.294 0.1484 A 63 ASN CB C 13 41.467 0.1484 A 63 ASN N N 15 125.280 0.0254 A 63 ASN ND2 N 15 115.511 0.0254 A 64 ILE H H 1 9.434 0.0064 A 64 ILE HA H 1 4.318 0.0064 A 64 ILE HB H 1 1.893 0.0064 A 64 ILE HD1% H 1 0.630 0.0064 A 64 ILE HG1x H 1 0.675 0.0064 A 64 ILE HG1y H 1 1.596 0.0064 A 64 ILE HG2% H 1 0.788 0.0064 A 64 ILE CA C 13 60.745 0.1484 A 64 ILE CB C 13 39.475 0.1484 A 64 ILE CD1 C 13 13.445 0.1484 A 64 ILE CG1 C 13 27.333 0.1484 A 64 ILE CG2 C 13 19.010 0.1484 A 64 ILE N N 15 124.610 0.0254 A 65 GLU H H 1 9.079 0.0064 A 65 GLU HA H 1 5.036 0.0064 A 65 GLU HBx H 1 1.805 0.0064 A 65 GLU HBy H 1 2.308 0.0064 A 65 GLU HGx H 1 2.270 0.0064 A 65 GLU HGy H 1 2.270 0.0064 A 65 GLU CA C 13 56.356 0.1484 A 65 GLU CB C 13 29.963 0.1484 A 65 GLU CG C 13 35.225 0.1484 A 65 GLU N N 15 134.083 0.0254 A 66 ASN H H 1 9.077 0.0064 A 66 ASN HA H 1 5.230 0.0064 A 66 ASN HBy H 1 2.621 0.0064 A 66 ASN HBx H 1 2.429 0.0064 A 66 ASN HD2y H 1 7.156 0.0064 A 66 ASN HD2x H 1 6.959 0.0064 A 66 ASN CA C 13 53.016 0.1484 A 66 ASN CB C 13 42.456 0.1484 A 66 ASN N N 15 122.728 0.0254 A 66 ASN ND2 N 15 111.079 0.0254 A 67 ASN H H 1 9.716 0.0064 A 67 ASN HA H 1 4.388 0.0064 A 67 ASN HBy H 1 3.000 0.0064 A 67 ASN HBx H 1 2.572 0.0064 A 67 ASN HD2y H 1 7.736 0.0064 A 67 ASN HD2x H 1 6.841 0.0064 A 67 ASN CA C 13 54.390 0.1484 A 67 ASN CB C 13 37.884 0.1484 A 67 ASN N N 15 121.354 0.0254 A 67 ASN ND2 N 15 112.561 0.0254 A 68 GLY H H 1 9.197 0.0064 A 68 GLY HAx H 1 3.698 0.0064 A 68 GLY HAy H 1 4.065 0.0064 A 68 GLY CA C 13 45.508 0.1484 A 68 GLY N N 15 105.595 0.0254 A 69 GLY H H 1 7.768 0.0064 A 69 GLY HAx H 1 3.778 0.0064 A 69 GLY HAy H 1 4.433 0.0064 A 69 GLY CA C 13 44.184 0.1484 A 69 GLY N N 15 108.798 0.0254 A 70 MET H H 1 8.373 0.0064 A 70 MET HA H 1 5.285 0.0064 A 70 MET HBy H 1 1.894 0.0064 A 70 MET HBx H 1 1.871 0.0064 A 70 MET HGy H 1 2.435 0.0064 A 70 MET HGx H 1 2.307 0.0064 A 70 MET CA C 13 53.338 0.1484 A 70 MET CB C 13 34.877 0.1484 A 70 MET CG C 13 31.963 0.1484 A 70 MET N N 15 118.771 0.0254 A 71 THR H H 1 8.845 0.0064 A 71 THR HA H 1 4.507 0.0064 A 71 THR HB H 1 3.830 0.0064 A 71 THR HG2% H 1 1.169 0.0064 A 71 THR CA C 13 62.231 0.1484 A 71 THR CB C 13 70.230 0.1484 A 71 THR CG2 C 13 21.571 0.1484 A 71 THR N N 15 123.288 0.0254 A 72 THR H H 1 8.570 0.0064 A 72 THR HA H 1 5.227 0.0064 A 72 THR HB H 1 3.568 0.0064 A 72 THR HG2% H 1 0.762 0.0064 A 72 THR CA C 13 61.916 0.1484 A 72 THR CB C 13 70.401 0.1484 A 72 THR CG2 C 13 22.405 0.1484 A 72 THR N N 15 125.625 0.0254 A 73 MET H H 1 9.062 0.0064 A 73 MET HA H 1 4.595 0.0064 A 73 MET HBy H 1 2.046 0.0064 A 73 MET HBx H 1 1.758 0.0064 A 73 MET HE% H 1 1.734 0.0064 A 73 MET HGx H 1 2.122 0.0064 A 73 MET HGy H 1 2.407 0.0064 A 73 MET CA C 13 53.951 0.1484 A 73 MET CB C 13 36.486 0.1484 A 73 MET CE C 13 17.900 0.1484 A 73 MET CG C 13 32.674 0.1484 A 73 MET N N 15 122.763 0.0254 A 74 PHE H H 1 8.880 0.0064 A 74 PHE HA H 1 5.948 0.0064 A 74 PHE HBy H 1 3.392 0.0064 A 74 PHE HBx H 1 2.551 0.0064 A 74 PHE HDx H 1 7.312 0.0064 A 74 PHE HDy H 1 7.312 0.0064 A 74 PHE HEx H 1 7.451 0.0064 A 74 PHE HEy H 1 7.451 0.0064 A 74 PHE HZ H 1 7.521 0.0064 A 74 PHE CA C 13 55.631 0.1484 A 74 PHE CB C 13 44.964 0.1484 A 74 PHE CDx C 13 134.563 0.1484 A 74 PHE CEx C 13 134.011 0.1484 A 74 PHE CZ C 13 131.748 0.1484 A 74 PHE N N 15 116.718 0.0254 A 75 TYR H H 1 8.535 0.0064 A 75 TYR HA H 1 5.969 0.0064 A 75 TYR HBx H 1 2.336 0.0064 A 75 TYR HBy H 1 3.281 0.0064 A 75 TYR CA C 13 55.747 0.1484 A 75 TYR CB C 13 41.726 0.1484 A 75 TYR N N 15 116.719 0.0254 A 76 TYR H H 1 8.450 0.0064 A 76 TYR HA H 1 5.088 0.0064 A 76 TYR HBx H 1 3.236 0.0064 A 76 TYR HBy H 1 3.724 0.0064 A 76 TYR HDx H 1 6.628 0.0064 A 76 TYR HDy H 1 6.628 0.0064 A 76 TYR HEx H 1 6.904 0.0064 A 76 TYR HEy H 1 6.904 0.0064 A 76 TYR CA C 13 56.639 0.1484 A 76 TYR CB C 13 39.052 0.1484 A 76 TYR CDy C 13 134.724 0.1484 A 76 TYR CEy C 13 119.330 0.1484 A 76 TYR N N 15 113.637 0.0254 A 77 GLU H H 1 9.101 0.0064 A 77 GLU HA H 1 5.392 0.0064 A 77 GLU HBx H 1 2.059 0.0064 A 77 GLU HBy H 1 2.127 0.0064 A 77 GLU HGx H 1 1.959 0.0064 A 77 GLU HGy H 1 2.032 0.0064 A 77 GLU CA C 13 53.716 0.1484 A 77 GLU CB C 13 32.085 0.1484 A 77 GLU CG C 13 35.118 0.1484 A 77 GLU N N 15 120.898 0.0254 A 78 GLU H H 1 9.337 0.0064 A 78 GLU HA H 1 4.523 0.0064 A 78 GLU HBx H 1 2.137 0.0064 A 78 GLU HBy H 1 2.169 0.0064 A 78 GLU HGy H 1 2.274 0.0064 A 78 GLU HGx H 1 2.050 0.0064 A 78 GLU CA C 13 56.493 0.1484 A 78 GLU CB C 13 33.101 0.1484 A 78 GLU CG C 13 36.369 0.1484 A 78 GLU N N 15 124.267 0.0254 A 79 ASN H H 1 9.660 0.0064 A 79 ASN HA H 1 4.397 0.0064 A 79 ASN HBy H 1 3.077 0.0064 A 79 ASN HBx H 1 2.749 0.0064 A 79 ASN HD2y H 1 7.625 0.0064 A 79 ASN HD2x H 1 6.910 0.0064 A 79 ASN CA C 13 54.013 0.1484 A 79 ASN CB C 13 37.796 0.1484 A 79 ASN N N 15 126.584 0.0254 A 79 ASN ND2 N 15 112.236 0.0254 A 80 GLY H H 1 9.125 0.0064 A 80 GLY HAx H 1 3.539 0.0064 A 80 GLY HAy H 1 4.005 0.0064 A 80 GLY CA C 13 45.307 0.1484 A 80 GLY N N 15 104.640 0.0254 A 81 LYS H H 1 7.512 0.0064 A 81 LYS HA H 1 4.161 0.0064 A 81 LYS HBy H 1 1.729 0.0064 A 81 LYS HBx H 1 1.318 0.0064 A 81 LYS HDx H 1 1.646 0.0064 A 81 LYS HDy H 1 1.646 0.0064 A 81 LYS HEx H 1 2.962 0.0064 A 81 LYS HEy H 1 2.962 0.0064 A 81 LYS HGx H 1 1.243 0.0064 A 81 LYS HGy H 1 1.331 0.0064 A 81 LYS CA C 13 53.746 0.1484 A 81 LYS CB C 13 35.982 0.1484 A 81 LYS CD C 13 28.922 0.1484 A 81 LYS CE C 13 42.073 0.1484 A 81 LYS CG C 13 25.675 0.1484 A 81 LYS N N 15 119.535 0.0254 A 82 TYR H H 1 7.976 0.0064 A 82 TYR HA H 1 4.942 0.0064 A 82 TYR HBx H 1 2.397 0.0064 A 82 TYR HBy H 1 2.885 0.0064 A 82 TYR HDx H 1 6.857 0.0064 A 82 TYR HDy H 1 6.857 0.0064 A 82 TYR HEx H 1 6.752 0.0064 A 82 TYR HEy H 1 6.752 0.0064 A 82 TYR CA C 13 57.028 0.1484 A 82 TYR CB C 13 41.066 0.1484 A 82 TYR CDy C 13 134.745 0.1484 A 82 TYR CEy C 13 119.776 0.1484 A 82 TYR N N 15 118.732 0.0254 A 83 TYR H H 1 8.692 0.0064 A 83 TYR HA H 1 5.585 0.0064 A 83 TYR HBy H 1 2.477 0.0064 A 83 TYR HBx H 1 1.544 0.0064 A 83 TYR HDx H 1 6.685 0.0064 A 83 TYR HDy H 1 6.685 0.0064 A 83 TYR HEx H 1 6.773 0.0064 A 83 TYR HEy H 1 6.773 0.0064 A 83 TYR CA C 13 56.497 0.1484 A 83 TYR CB C 13 42.970 0.1484 A 83 TYR CDx C 13 135.286 0.1484 A 83 TYR CEx C 13 119.108 0.1484 A 83 TYR N N 15 116.197 0.0254 A 84 ILE H H 1 9.206 0.0064 A 84 ILE HA H 1 5.097 0.0064 A 84 ILE HB H 1 1.600 0.0064 A 84 ILE HD1% H 1 0.589 0.0064 A 84 ILE HG1x H 1 1.033 0.0064 A 84 ILE HG1y H 1 1.512 0.0064 A 84 ILE HG2% H 1 0.768 0.0064 A 84 ILE CA C 13 58.655 0.1484 A 84 ILE CB C 13 41.151 0.1484 A 84 ILE CD1 C 13 13.654 0.1484 A 84 ILE CG1 C 13 27.443 0.1484 A 84 ILE CG2 C 13 17.212 0.1484 A 84 ILE N N 15 116.822 0.0254 A 85 GLU H H 1 9.777 0.0064 A 85 GLU HA H 1 5.248 0.0064 A 85 GLU HBy H 1 2.201 0.0064 A 85 GLU HBx H 1 2.003 0.0064 A 85 GLU HGx H 1 2.054 0.0064 A 85 GLU HGy H 1 2.054 0.0064 A 85 GLU CA C 13 54.193 0.1484 A 85 GLU CB C 13 34.109 0.1484 A 85 GLU CG C 13 34.702 0.1484 A 85 GLU N N 15 127.545 0.0254 A 86 CYS H H 1 9.194 0.0064 A 86 CYS HA H 1 5.172 0.0064 A 86 CYS HBx H 1 3.011 0.0064 A 86 CYS HBy H 1 3.140 0.0064 A 86 CYS CA C 13 55.021 0.1484 A 86 CYS CB C 13 28.673 0.1484 A 86 CYS N N 15 127.124 0.0254 A 87 PRO HA H 1 4.309 0.0064 A 87 PRO HBy H 1 2.286 0.0064 A 87 PRO HBx H 1 1.946 0.0064 A 87 PRO HDy H 1 4.096 0.0064 A 87 PRO HDx H 1 3.969 0.0064 A 87 PRO HGx H 1 2.187 0.0064 A 87 PRO HGy H 1 2.227 0.0064 A 87 PRO CA C 13 64.048 0.1484 A 87 PRO CB C 13 31.792 0.1484 A 87 PRO CD C 13 51.459 0.1484 A 87 PRO CG C 13 27.811 0.1484 A 88 TYR H H 1 8.117 0.0064 A 88 TYR HA H 1 4.126 0.0064 A 88 TYR HBx H 1 3.209 0.0064 A 88 TYR HBy H 1 3.277 0.0064 A 88 TYR HDx H 1 6.906 0.0064 A 88 TYR HDy H 1 6.906 0.0064 A 88 TYR HEx H 1 6.625 0.0064 A 88 TYR HEy H 1 6.625 0.0064 A 88 TYR CA C 13 60.962 0.1484 A 88 TYR CB C 13 35.459 0.1484 A 88 TYR CDx C 13 134.569 0.1484 A 88 TYR CEx C 13 119.372 0.1484 A 88 TYR N N 15 114.474 0.0254 A 89 LYS H H 1 8.871 0.0064 A 89 LYS HA H 1 4.754 0.0064 A 89 LYS HBx H 1 1.692 0.0064 A 89 LYS HBy H 1 1.984 0.0064 A 89 LYS HDx H 1 1.653 0.0064 A 89 LYS HDy H 1 1.753 0.0064 A 89 LYS HEx H 1 3.033 0.0064 A 89 LYS HEy H 1 3.033 0.0064 A 89 LYS HGy H 1 1.578 0.0064 A 89 LYS HGx H 1 1.431 0.0064 A 89 LYS CA C 13 56.623 0.1484 A 89 LYS CB C 13 34.813 0.1484 A 89 LYS CD C 13 28.911 0.1484 A 89 LYS CE C 13 42.240 0.1484 A 89 LYS CG C 13 25.047 0.1484 A 89 LYS N N 15 119.602 0.0254 A 90 GLY H H 1 8.325 0.0064 A 90 GLY HAy H 1 3.931 0.0064 A 90 GLY HAx H 1 3.852 0.0064 A 90 GLY CA C 13 46.241 0.1484 A 90 GLY N N 15 104.928 0.0254 A 91 ILE H H 1 8.658 0.0064 A 91 ILE HA H 1 4.601 0.0064 A 91 ILE HB H 1 1.312 0.0064 A 91 ILE HD1% H 1 0.408 0.0064 A 91 ILE HG1x H 1 0.619 0.0064 A 91 ILE HG1y H 1 1.317 0.0064 A 91 ILE HG2% H 1 0.589 0.0064 A 91 ILE CA C 13 61.617 0.1484 A 91 ILE CB C 13 38.976 0.1484 A 91 ILE CD1 C 13 13.457 0.1484 A 91 ILE CG1 C 13 29.537 0.1484 A 91 ILE CG2 C 13 18.022 0.1484 A 91 ILE N N 15 121.198 0.0254 A 92 TYR H H 1 10.120 0.0064 A 92 TYR HA H 1 5.063 0.0064 A 92 TYR HBy H 1 2.900 0.0064 A 92 TYR HBx H 1 2.411 0.0064 A 92 TYR HDx H 1 6.967 0.0064 A 92 TYR HDy H 1 6.967 0.0064 A 92 TYR HEx H 1 6.547 0.0064 A 92 TYR HEy H 1 6.547 0.0064 A 92 TYR CA C 13 55.597 0.1484 A 92 TYR CB C 13 39.723 0.1484 A 92 TYR CDy C 13 135.295 0.1484 A 92 TYR CEy C 13 119.687 0.1484 A 92 TYR N N 15 128.842 0.0254 A 93 GLU H H 1 9.349 0.0064 A 93 GLU HA H 1 4.884 0.0064 A 93 GLU HBx H 1 1.899 0.0064 A 93 GLU HBy H 1 1.949 0.0064 A 93 GLU HGy H 1 2.236 0.0064 A 93 GLU HGx H 1 2.163 0.0064 A 93 GLU CA C 13 55.607 0.1484 A 93 GLU CB C 13 31.057 0.1484 A 93 GLU CG C 13 35.921 0.1484 A 93 GLU N N 15 125.360 0.0254 A 94 ILE H H 1 8.610 0.0064 A 94 ILE HA H 1 4.815 0.0064 A 94 ILE HB H 1 1.914 0.0064 A 94 ILE HD1% H 1 0.976 0.0064 A 94 ILE HG1y H 1 1.560 0.0064 A 94 ILE HG1x H 1 0.657 0.0064 A 94 ILE HG2% H 1 0.800 0.0064 A 94 ILE CA C 13 59.704 0.1484 A 94 ILE CB C 13 41.348 0.1484 A 94 ILE CD1 C 13 14.254 0.1484 A 94 ILE CG1 C 13 25.831 0.1484 A 94 ILE CG2 C 13 18.529 0.1484 A 94 ILE N N 15 121.356 0.0254 A 95 GLU H H 1 8.481 0.0064 A 95 GLU HA H 1 4.079 0.0064 A 95 GLU HBx H 1 1.869 0.0064 A 95 GLU HBy H 1 2.013 0.0064 A 95 GLU HGy H 1 2.301 0.0064 A 95 GLU HGx H 1 2.231 0.0064 A 95 GLU CA C 13 58.286 0.1484 A 95 GLU CB C 13 31.013 0.1484 A 95 GLU CG C 13 36.498 0.1484 A 95 GLU N N 15 117.347 0.0254 A 96 ASN H H 1 7.316 0.0064 A 96 ASN HA H 1 4.375 0.0064 A 96 ASN HBy H 1 2.383 0.0064 A 96 ASN HBx H 1 2.136 0.0064 A 96 ASN HD2y H 1 7.412 0.0064 A 96 ASN HD2x H 1 6.841 0.0064 A 96 ASN CA C 13 50.341 0.1484 A 96 ASN CB C 13 42.474 0.1484 A 96 ASN N N 15 113.266 0.0254 A 96 ASN ND2 N 15 112.686 0.0254 A 97 ASN H H 1 7.066 0.0064 A 97 ASN HA H 1 3.596 0.0064 A 97 ASN HBy H 1 2.518 0.0064 A 97 ASN HBx H 1 2.133 0.0064 A 97 ASN HD2x H 1 7.134 0.0064 A 97 ASN HD2y H 1 7.505 0.0064 A 97 ASN CA C 13 52.754 0.1484 A 97 ASN CB C 13 37.884 0.1484 A 97 ASN N N 15 114.285 0.0254 A 97 ASN ND2 N 15 112.231 0.0254 A 98 PHE H H 1 8.139 0.0064 A 98 PHE HA H 1 3.668 0.0064 A 98 PHE HBy H 1 2.651 0.0064 A 98 PHE HBx H 1 1.874 0.0064 A 98 PHE HDx H 1 6.242 0.0064 A 98 PHE HDy H 1 6.242 0.0064 A 98 PHE HEx H 1 6.692 0.0064 A 98 PHE HEy H 1 6.692 0.0064 A 98 PHE HZ H 1 6.745 0.0064 A 98 PHE CA C 13 61.697 0.1484 A 98 PHE CB C 13 39.473 0.1484 A 98 PHE CDx C 13 133.214 0.1484 A 98 PHE CEy C 13 131.724 0.1484 A 98 PHE CZ C 13 130.381 0.1484 A 98 PHE N N 15 128.617 0.0254 A 99 GLU H H 1 7.513 0.0064 A 99 GLU HA H 1 3.496 0.0064 A 99 GLU HBy H 1 2.059 0.0064 A 99 GLU HBx H 1 1.820 0.0064 A 99 GLU HGx H 1 2.354 0.0064 A 99 GLU HGy H 1 2.692 0.0064 A 99 GLU CA C 13 58.129 0.1484 A 99 GLU CB C 13 28.467 0.1484 A 99 GLU CG C 13 36.812 0.1484 A 99 GLU N N 15 109.793 0.0254 A 100 ASP H H 1 7.486 0.0064 A 100 ASP HA H 1 4.522 0.0064 A 100 ASP HBy H 1 2.636 0.0064 A 100 ASP HBx H 1 2.417 0.0064 A 100 ASP CA C 13 54.600 0.1484 A 100 ASP CB C 13 40.847 0.1484 A 100 ASP N N 15 115.325 0.0254 A 101 MET H H 1 7.309 0.0064 A 101 MET HA H 1 4.168 0.0064 A 101 MET HBy H 1 1.956 0.0064 A 101 MET HBx H 1 1.523 0.0064 A 101 MET HGy H 1 2.194 0.0064 A 101 MET HGx H 1 2.155 0.0064 A 101 MET CA C 13 55.402 0.1484 A 101 MET CB C 13 33.073 0.1484 A 101 MET CG C 13 31.224 0.1484 A 101 MET N N 15 117.035 0.0254 A 102 ILE H H 1 6.295 0.0064 A 102 ILE HA H 1 3.763 0.0064 A 102 ILE HB H 1 1.572 0.0064 A 102 ILE HD1% H 1 0.561 0.0064 A 102 ILE HG1x H 1 0.566 0.0064 A 102 ILE HG1y H 1 0.999 0.0064 A 102 ILE HG2% H 1 0.208 0.0064 A 102 ILE CA C 13 62.067 0.1484 A 102 ILE CB C 13 39.076 0.1484 A 102 ILE CD1 C 13 14.281 0.1484 A 102 ILE CG1 C 13 25.523 0.1484 A 102 ILE CG2 C 13 18.749 0.1484 A 102 ILE N N 15 116.769 0.0254 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 12 ASP H A 65 GLU H 1.0 . 5.50 2 2 A 65 GLU H A 65 GLU HBy 1.0 . 3.36 3 3 A 65 GLU H A 14 ILE HG1x 1.0 . 4.84 4 4 A 16 ILE H A 24 LYS H 1.0 . 3.95 5 5 A 16 ILE H A 25 ILE H 1.0 . 5.50 6 6 A 16 ILE H A 26 TYR HD% 1.0 . 5.28 7 7 A 16 ILE H A 23 GLN HA 1.0 . 5.50 8 8 A 16 ILE H A 25 ILE HA 1.0 . 4.42 9 9 A 16 ILE H A 15 CYS HBx 1.0 . 4.45 10 10 A 16 ILE H A 23 GLN HGy 1.0 . 5.50 11 11 A 16 ILE H A 16 ILE HB 1.0 . 3.45 12 12 A 16 ILE H A 16 ILE HG1x 1.0 . 4.63 13 13 A 16 ILE H A 14 ILE HG2% 1.0 . 4.65 14 14 A 84 ILE H A 92 TYR H 1.0 . 3.95 15 15 A 92 TYR H A 91 ILE H 1.0 . 5.10 16 16 A 92 TYR H A 44 ARG HA 1.0 . 5.50 17 17 A 92 TYR H A 84 ILE HB 1.0 . 4.33 18 18 A 92 TYR H A 91 ILE HB 1.0 . 4.72 19 19 A 92 TYR H A 84 ILE HG2% 1.0 . 5.50 20 20 A 92 TYR H A 91 ILE HG2% 1.0 . 3.94 21 21 A 98 PHE H A 98 PHE HD% 1.0 . 4.85 22 22 A 98 PHE H A 75 TYR HBy 1.0 . 5.50 23 23 A 98 PHE H A 82 TYR HBy 1.0 . 5.01 24 24 A 98 PHE H A 98 PHE HBy 1.0 . 3.44 25 25 A 98 PHE H A 82 TYR HBx 1.0 . 5.05 26 26 A 98 PHE H A 97 ASN HBx 1.0 . 4.68 27 27 A 98 PHE H A 98 PHE HBx 1.0 . 3.58 28 28 A 98 PHE H A 94 ILE HG1y 1.0 . 5.50 29 29 A 98 PHE H A 84 ILE HD1% 1.0 . 5.50 30 30 A 15 CYS H A 35 ILE HD1% 1.0 . 5.50 31 31 A 16 ILE H A 15 CYS H 1.0 . 5.09 32 32 A 15 CYS H A 64 ILE H 1.0 . 5.04 33 33 A 15 CYS H A 63 ASN H 1.0 . 3.93 34 34 A 25 ILE HA A 15 CYS H 1.0 . 4.91 35 35 A 15 CYS H A 15 CYS HBy 1.0 . 3.40 36 36 A 15 CYS H A 14 ILE HB 1.0 . 4.67 37 37 A 14 ILE HG1x A 15 CYS H 1.0 . 4.74 38 38 A 15 CYS H A 62 ILE HG2% 1.0 . 5.31 39 39 A 15 CYS H A 13 SER HBx 1.0 . 5.50 40 40 A 5 LEU H A 6 PRO HDx 1.0 . 5.34 41 41 A 5 LEU H A 4 ILE HB 1.0 . 4.61 42 42 A 5 LEU H A 5 LEU HBy 1.0 . 3.32 43 43 A 5 LEU H A 5 LEU HDy% 1.0 . 3.77 44 44 A 74 PHE HBy A 85 GLU H 1.0 . 5.50 45 45 A 85 GLU H A 74 PHE HD% 1.0 . 5.50 46 46 A 84 ILE H A 85 GLU H 1.0 . 4.70 47 47 A 85 GLU H A 73 MET HA 1.0 . 5.28 48 48 A 85 GLU H A 74 PHE HBx 1.0 . 4.83 49 49 A 85 GLU H A 85 GLU HBy 1.0 . 3.94 50 50 A 85 GLU H A 85 GLU HBx 1.0 . 3.69 51 51 A 84 ILE HB A 85 GLU H 1.0 . 5.50 52 52 A 84 ILE HD1% A 85 GLU H 1.0 . 5.12 53 53 A 14 ILE H A 26 TYR H 1.0 . 3.98 54 54 A 26 TYR H A 26 TYR HE% 1.0 . 5.45 55 55 A 26 TYR H A 15 CYS HA 1.0 . 4.19 56 56 A 26 TYR H A 13 SER HBy 1.0 . 5.50 57 57 A 13 SER HBx A 26 TYR H 1.0 . 5.41 58 58 A 26 TYR H A 25 ILE HB 1.0 . 4.28 59 59 A 26 TYR H A 25 ILE HG1x 1.0 . 5.00 60 60 A 35 ILE HD1% A 26 TYR H 1.0 . 5.50 61 61 A 17 ASP H A 61 THR HB 1.0 . 4.05 62 62 A 17 ASP H A 17 ASP HBx 1.0 . 3.56 63 63 A 17 ASP H A 61 THR HG2% 1.0 . 5.50 64 64 A 16 ILE HG1x A 17 ASP H 1.0 . 5.32 65 65 A 17 ASP H A 16 ILE HD1% 1.0 . 5.50 66 66 A 85 GLU H A 86 CYS H 1.0 . 5.30 67 67 A 86 CYS H A 90 GLY H 1.0 . 4.71 68 68 A 86 CYS H A 90 GLY HAy 1.0 . 5.50 69 69 A 86 CYS H A 86 CYS HBx 1.0 . 3.66 70 70 A 85 GLU HBy A 86 CYS H 1.0 . 3.71 71 71 A 86 CYS H A 85 GLU HGx 1.0 . 4.16 72 71 A 86 CYS H A 85 GLU HGy 1.0 . 4.16 73 72 A 84 ILE HG2% A 86 CYS H 1.0 . 5.50 74 73 A 86 CYS H A 87 PRO HDy 1.0 . 5.50 75 74 A 86 CYS H A 87 PRO HA 1.0 . 5.50 76 75 A 16 ILE H A 17 ASP H 1.0 . 5.50 77 76 A 17 ASP H A 61 THR H 1.0 . 4.02 78 77 A 23 GLN HA A 17 ASP H 1.0 . 5.50 79 78 A 17 ASP H A 60 GLY HAy 1.0 . 5.50 80 79 A 44 ARG H A 45 THR H 1.0 . 4.77 81 80 A 44 ARG H A 92 TYR HBx 1.0 . 5.50 82 81 A 44 ARG H A 44 ARG HBx 1.0 . 2.92 83 81 A 44 ARG H A 44 ARG HBy 1.0 . 2.92 84 82 A 44 ARG H A 43 LYS HGx 1.0 . 5.11 85 83 A 44 ARG H A 44 ARG HGx 1.0 . 4.87 86 84 A 79 ASN H A 79 ASN HA 1.0 . 2.91 87 85 A 79 ASN H A 80 GLY HAx 1.0 . 5.50 88 86 A 62 ILE H A 62 ILE HB 1.0 . 3.29 89 87 A 61 THR HG2% A 62 ILE H 1.0 . 3.85 90 88 A 62 ILE HG2% A 62 ILE H 1.0 . 4.47 91 89 A 24 LYS H A 15 CYS HA 1.0 . 5.50 92 90 A 72 THR H A 73 MET H 1.0 . 5.18 93 91 A 72 THR H A 71 THR HB 1.0 . 4.94 94 92 A 72 THR H A 70 MET HBy 1.0 . 5.50 95 93 A 72 THR H A 72 THR HG2% 1.0 . 4.62 96 94 A 12 ASP H A 66 ASN H 1.0 . 5.50 97 95 A 12 ASP H A 12 ASP HBx 1.0 . 3.33 98 96 A 12 ASP H A 65 GLU HBx 1.0 . 5.50 99 97 A 24 LYS H A 25 ILE H 1.0 . 4.83 100 98 A 24 LYS H A 17 ASP HA 1.0 . 4.40 101 99 A 24 LYS H A 23 GLN HBx 1.0 . 4.22 102 100 A 24 LYS H A 24 LYS HGx 1.0 . 5.16 103 101 A 24 LYS H A 22 ILE HG2% 1.0 . 5.28 104 102 A 24 LYS H A 16 ILE HG2% 1.0 . 5.50 105 103 A 92 TYR H A 93 GLU H 1.0 . 5.37 106 104 A 93 GLU H A 43 LYS H 1.0 . 3.64 107 105 A 45 THR H A 93 GLU H 1.0 . 4.99 108 106 A 93 GLU H A 83 TYR HA 1.0 . 5.50 109 107 A 93 GLU H A 42 GLY HAy 1.0 . 5.44 110 108 A 44 ARG HA A 93 GLU H 1.0 . 4.36 111 109 A 93 GLU H A 92 TYR HBy 1.0 . 5.11 112 110 A 92 TYR HBx A 93 GLU H 1.0 . 4.15 113 111 A 93 GLU H A 93 GLU HBx 1.0 . 3.12 114 112 A 93 GLU H A 45 THR HG2% 1.0 . 3.76 115 113 A 93 GLU H A 94 ILE HG2% 1.0 . 5.50 116 114 A 84 ILE HD1% A 93 GLU H 1.0 . 5.50 117 115 A 63 ASN H A 16 ILE HG2% 1.0 . 5.50 118 116 A 63 ASN H A 63 ASN HD2y 1.0 . 4.70 119 117 A 63 ASN H A 16 ILE HA 1.0 . 4.36 120 118 A 63 ASN H A 14 ILE HA 1.0 . 5.50 121 119 A 63 ASN H A 62 ILE HB 1.0 . 5.04 122 120 A 63 ASN H A 61 THR HG2% 1.0 . 5.50 123 121 A 17 ASP HA A 23 GLN H 1.0 . 5.50 124 122 A 24 LYS H A 23 GLN H 1.0 . 4.94 125 123 A 23 GLN H A 22 ILE H 1.0 . 4.67 126 124 A 23 GLN H A 18 PHE HBy 1.0 . 5.50 127 125 A 23 GLN HGy A 23 GLN H 1.0 . 5.25 128 126 A 23 GLN H A 22 ILE HG1x 1.0 . 4.96 129 127 A 64 ILE H A 71 THR H 1.0 . 4.00 130 128 A 65 GLU H A 64 ILE H 1.0 . 4.57 131 129 A 64 ILE H A 66 ASN HD2y 1.0 . 5.50 132 130 A 64 ILE H A 71 THR HA 1.0 . 5.50 133 131 A 64 ILE H A 71 THR HB 1.0 . 4.24 134 132 A 64 ILE H A 63 ASN HBy 1.0 . 4.48 135 133 A 64 ILE H A 63 ASN HBx 1.0 . 5.26 136 134 A 64 ILE H A 64 ILE HD1% 1.0 . 4.17 137 135 A 7 LYS HEy A 8 ALA H 1.0 . 5.50 138 136 A 8 ALA H A 7 LYS H 1.0 . 4.74 139 137 A 8 ALA H A 10 ASN H 1.0 . 5.24 140 138 A 8 ALA H A 7 LYS HBy 1.0 . 3.70 141 139 A 8 ALA H A 7 LYS HBx 1.0 . 4.00 142 140 A 8 ALA H A 36 LEU HDy% 1.0 . 4.10 143 141 A 8 ALA H A 11 VAL H 1.0 . 5.50 144 142 A 79 ASN H A 78 GLU H 1.0 . 4.68 145 143 A 78 GLU H A 80 GLY H 1.0 . 3.79 146 144 A 78 GLU H A 83 TYR H 1.0 . 5.50 147 145 A 78 GLU H A 78 GLU HBx 1.0 . 3.40 148 146 A 78 GLU H A 77 GLU HGy 1.0 . 3.57 149 147 A 78 GLU H A 81 LYS HBx 1.0 . 5.18 150 148 A 43 LYS H A 92 TYR HA 1.0 . 4.73 151 149 A 43 LYS H A 92 TYR HD% 1.0 . 5.21 152 150 A 44 ARG HA A 43 LYS H 1.0 . 5.50 153 151 A 43 LYS H A 43 LYS HBy 1.0 . 3.23 154 152 A 43 LYS H A 43 LYS HGy 1.0 . 4.07 155 153 A 43 LYS H A 94 ILE HG2% 1.0 . 4.61 156 154 A 56 ALA H A 57 GLU H 1.0 . 4.60 157 155 A 56 ALA H A 55 SER H 1.0 . 3.24 158 156 A 56 ALA H A 59 TYR HD% 1.0 . 5.50 159 157 A 56 ALA H A 55 SER HBy 1.0 . 4.16 160 158 A 71 THR H A 66 ASN HD2y 1.0 . 4.41 161 159 A 71 THR H A 66 ASN HD2x 1.0 . 4.33 162 160 A 71 THR H A 65 GLU HA 1.0 . 4.46 163 161 A 71 THR HB A 71 THR H 1.0 . 3.34 164 162 A 71 THR H A 64 ILE HB 1.0 . 3.61 165 163 A 73 MET H A 74 PHE HA 1.0 . 5.50 166 164 A 66 ASN H A 67 ASN H 1.0 . 5.33 167 165 A 66 ASN H A 69 GLY H 1.0 . 4.00 168 166 A 66 ASN H A 66 ASN HD2y 1.0 . 4.42 169 167 A 66 ASN H A 66 ASN HD2x 1.0 . 3.78 170 168 A 66 ASN H A 69 GLY HAx 1.0 . 5.50 171 169 A 66 ASN H A 65 GLU HGx 1.0 . 3.81 172 169 A 66 ASN H A 65 GLU HGy 1.0 . 3.81 173 170 A 73 MET H A 74 PHE H 1.0 . 4.51 174 171 A 62 ILE H A 73 MET H 1.0 . 3.85 175 172 A 73 MET H A 73 MET HBx 1.0 . 3.91 176 173 A 61 THR HG2% A 73 MET H 1.0 . 4.77 177 174 A 4 ILE H A 92 TYR HE% 1.0 . 5.50 178 175 A 4 ILE H A 4 ILE HG1y 1.0 . 3.57 179 176 A 4 ILE H A 4 ILE HG2% 1.0 . 4.20 180 177 A 48 GLN H A 48 GLN HGx 1.0 . 3.64 181 178 A 48 GLN H A 48 GLN HBx 1.0 . 3.13 182 179 A 48 GLN H A 47 LYS HBy 1.0 . 3.73 183 180 A 48 GLN H A 50 ILE HG2% 1.0 . 5.50 184 181 A 38 GLU H A 39 ILE H 1.0 . 3.54 185 182 A 39 ILE H A 41 THR H 1.0 . 5.19 186 183 A 39 ILE H A 36 LEU HA 1.0 . 4.21 187 184 A 39 ILE H A 38 GLU HGy 1.0 . 5.25 188 185 A 39 ILE H A 39 ILE HG1y 1.0 . 3.32 189 186 A 39 ILE H A 39 ILE HG2% 1.0 . 3.85 190 187 A 98 PHE HD% A 39 ILE H 1.0 . 5.50 191 188 A 39 ILE H A 40 ALA HB% 1.0 . 4.79 192 189 A 25 ILE H A 15 CYS HA 1.0 . 5.48 193 190 A 25 ILE H A 25 ILE HG2% 1.0 . 4.28 194 191 A 25 ILE H A 26 TYR H 1.0 . 4.79 195 192 A 25 ILE H A 25 ILE HB 1.0 . 3.04 196 193 A 25 ILE H A 24 LYS HGx 1.0 . 4.26 197 194 A 22 ILE H A 20 ASN HA 1.0 . 5.50 198 195 A 22 ILE H A 20 ASN HD2y 1.0 . 4.92 199 196 A 22 ILE H A 18 PHE HBy 1.0 . 3.89 200 197 A 67 ASN H A 68 GLY HAx 1.0 . 5.50 201 198 A 67 ASN H A 11 VAL HGy% 1.0 . 5.50 202 199 A 12 ASP H A 67 ASN H 1.0 . 5.22 203 200 A 67 ASN H A 67 ASN HD2y 1.0 . 5.03 204 201 A 67 ASN H A 11 VAL HA 1.0 . 5.11 205 202 A 67 ASN H A 67 ASN HBx 1.0 . 3.79 206 203 A 94 ILE H A 96 ASN H 1.0 . 5.50 207 204 A 94 ILE H A 82 TYR H 1.0 . 5.14 208 205 A 94 ILE H A 83 TYR HD% 1.0 . 4.93 209 206 A 83 TYR HA A 94 ILE H 1.0 . 4.02 210 207 A 92 TYR HA A 94 ILE H 1.0 . 5.50 211 208 A 82 TYR HBy A 94 ILE H 1.0 . 5.12 212 209 A 82 TYR HBx A 94 ILE H 1.0 . 5.50 213 210 A 94 ILE H A 94 ILE HB 1.0 . 3.87 214 211 A 94 ILE H A 94 ILE HD1% 1.0 . 4.74 215 212 A 94 ILE H A 94 ILE HG1x 1.0 . 3.53 216 213 A 91 ILE H A 92 TYR HD% 1.0 . 5.50 217 214 A 91 ILE H A 92 TYR HE% 1.0 . 5.48 218 215 A 91 ILE H A 89 LYS HA 1.0 . 4.39 219 216 A 91 ILE H A 44 ARG HDx 1.0 . 5.50 220 216 A 91 ILE H A 44 ARG HDy 1.0 . 5.50 221 217 A 91 ILE H A 91 ILE HB 1.0 . 3.27 222 218 A 91 ILE H A 91 ILE HG1x 1.0 . 4.24 223 219 A 91 ILE H A 91 ILE HD1% 1.0 . 5.18 224 220 A 91 ILE H A 44 ARG HGy 1.0 . 5.50 225 221 A 31 SER HBx A 32 ILE H 1.0 . 4.18 226 222 A 32 ILE H A 26 TYR HBx 1.0 . 5.01 227 222 A 32 ILE H A 26 TYR HBy 1.0 . 5.01 228 223 A 32 ILE H A 32 ILE HG2% 1.0 . 4.21 229 224 A 35 ILE HD1% A 32 ILE H 1.0 . 5.50 230 225 A 32 ILE H A 29 SER H 1.0 . 5.43 231 226 A 26 TYR HD% A 32 ILE H 1.0 . 5.50 232 227 A 32 ILE H A 31 SER HA 1.0 . 3.55 233 228 A 32 ILE H A 33 GLN HBx 1.0 . 4.97 234 228 A 32 ILE H A 33 GLN HBy 1.0 . 4.97 235 229 A 32 ILE H A 32 ILE HG1x 1.0 . 3.66 236 229 A 32 ILE H A 32 ILE HG1y 1.0 . 3.66 237 230 A 32 ILE H A 28 ASP HA 1.0 . 5.50 238 231 A 46 GLU H A 47 LYS H 1.0 . 3.37 239 232 A 48 GLN H A 47 LYS H 1.0 . 4.64 240 233 A 47 LYS H A 45 THR HB 1.0 . 3.45 241 234 A 47 LYS H A 46 GLU HBy 1.0 . 4.33 242 235 A 47 LYS H A 46 GLU HBx 1.0 . 4.37 243 236 A 47 LYS HBy A 47 LYS H 1.0 . 3.38 244 237 A 47 LYS H A 47 LYS HGy 1.0 . 2.96 245 238 A 77 GLU H A 78 GLU HA 1.0 . 5.50 246 239 A 77 GLU H A 77 GLU HBy 1.0 . 3.28 247 240 A 11 VAL H A 66 ASN HA 1.0 . 5.50 248 241 A 18 PHE H A 19 THR H 1.0 . 5.13 249 242 A 24 LYS H A 18 PHE H 1.0 . 4.33 250 243 A 18 PHE H A 20 ASN H 1.0 . 5.04 251 244 A 23 GLN HA A 18 PHE H 1.0 . 4.03 252 245 A 18 PHE H A 22 ILE HA 1.0 . 5.50 253 246 A 18 PHE HBy A 18 PHE H 1.0 . 3.27 254 247 A 23 GLN HBx A 18 PHE H 1.0 . 5.31 255 248 A 22 ILE HG2% A 18 PHE H 1.0 . 5.50 256 249 A 29 SER H A 30 GLU H 1.0 . 3.62 257 250 A 30 GLU H A 33 GLN H 1.0 . 4.68 258 251 A 32 ILE H A 30 GLU H 1.0 . 4.62 259 252 A 30 GLU H A 29 SER HA 1.0 . 3.53 260 253 A 30 GLU H A 30 GLU HBy 1.0 . 3.02 261 254 A 11 VAL H A 9 GLU H 1.0 . 4.78 262 255 A 12 ASP H A 11 VAL H 1.0 . 5.01 263 256 A 10 ASN H A 11 VAL H 1.0 . 3.11 264 257 A 11 VAL H A 10 ASN HBx 1.0 . 4.55 265 258 A 7 LYS HBx A 11 VAL H 1.0 . 5.39 266 259 A 11 VAL H A 8 ALA HB% 1.0 . 5.50 267 260 A 49 SER HBx A 50 ILE H 1.0 . 4.63 268 261 A 50 ILE H A 51 GLN HBx 1.0 . 5.14 269 262 A 91 ILE HD1% A 50 ILE H 1.0 . 5.50 270 263 A 32 ILE HA A 34 LYS H 1.0 . 4.93 271 264 A 34 LYS H A 34 LYS HEx 1.0 . 5.50 272 264 A 34 LYS H A 34 LYS HEy 1.0 . 5.50 273 265 A 34 LYS H A 33 GLN HGy 1.0 . 4.99 274 266 A 34 LYS H A 34 LYS HBy 1.0 . 2.94 275 267 A 34 LYS H A 35 ILE HB 1.0 . 4.92 276 268 A 34 LYS H A 34 LYS HGy 1.0 . 4.33 277 269 A 32 ILE HG2% A 34 LYS H 1.0 . 5.37 278 270 A 35 ILE HD1% A 34 LYS H 1.0 . 5.50 279 271 A 34 LYS H A 35 ILE HG1x 1.0 . 5.50 280 272 A 26 TYR H A 27 ASP H 1.0 . 4.99 281 273 A 26 TYR HD% A 27 ASP H 1.0 . 5.05 282 274 A 27 ASP H A 26 TYR HA 1.0 . 2.90 283 275 A 27 ASP H A 26 TYR HBx 1.0 . 4.02 284 275 A 26 TYR HBy A 27 ASP H 1.0 . 4.02 285 276 A 27 ASP H A 32 ILE HG1x 1.0 . 5.16 286 276 A 32 ILE HG1y A 27 ASP H 1.0 . 5.16 287 277 A 57 GLU H A 58 GLU H 1.0 . 3.19 288 278 A 57 GLU H A 58 GLU HA 1.0 . 5.50 289 279 A 57 GLU H A 57 GLU HGy 1.0 . 3.72 290 280 A 57 GLU H A 57 GLU HBx 1.0 . 2.92 291 281 A 38 GLU H A 98 PHE HE% 1.0 . 5.50 292 282 A 38 GLU H A 37 SER HBy 1.0 . 3.64 293 283 A 38 GLU H A 35 ILE HA 1.0 . 4.17 294 284 A 38 GLU H A 38 GLU HGy 1.0 . 3.75 295 285 A 38 GLU H A 38 GLU HGx 1.0 . 3.96 296 286 A 38 GLU H A 38 GLU HBx 1.0 . 3.11 297 286 A 38 GLU H A 38 GLU HBy 1.0 . 3.11 298 287 A 38 GLU H A 41 THR HG2% 1.0 . 4.97 299 288 A 38 GLU H A 102 ILE HG2% 1.0 . 5.50 300 289 A 88 TYR H A 89 LYS H 1.0 . 3.72 301 290 A 90 GLY HAy A 89 LYS H 1.0 . 5.50 302 291 A 89 LYS H A 89 LYS HEx 1.0 . 5.47 303 291 A 89 LYS H A 89 LYS HEy 1.0 . 5.47 304 292 A 89 LYS H A 89 LYS HBy 1.0 . 3.86 305 293 A 89 LYS H A 89 LYS HBx 1.0 . 3.36 306 294 A 78 GLU H A 81 LYS H 1.0 . 3.67 307 295 A 80 GLY H A 81 LYS H 1.0 . 3.44 308 296 A 81 LYS H A 79 ASN HBy 1.0 . 5.09 309 297 A 81 LYS H A 81 LYS HBy 1.0 . 3.40 310 298 A 81 LYS HBx A 81 LYS H 1.0 . 3.44 311 299 A 79 ASN H A 81 LYS H 1.0 . 5.43 312 300 A 81 LYS H A 77 GLU HA 1.0 . 5.01 313 301 A 81 LYS H A 79 ASN HBx 1.0 . 5.15 314 302 A 34 LYS H A 35 ILE H 1.0 . 3.57 315 303 A 34 LYS HBy A 35 ILE H 1.0 . 3.38 316 304 A 35 ILE H A 35 ILE HG2% 1.0 . 4.23 317 305 A 35 ILE HG1x A 35 ILE H 1.0 . 3.88 318 306 A 35 ILE H A 34 LYS HEx 1.0 . 5.50 319 306 A 34 LYS HEy A 35 ILE H 1.0 . 5.50 320 307 A 71 THR H A 70 MET H 1.0 . 5.35 321 308 A 65 GLU HA A 70 MET H 1.0 . 5.50 322 309 A 7 LYS H A 10 ASN HD2y 1.0 . 4.83 323 310 A 70 MET H A 70 MET HGy 1.0 . 4.38 324 311 A 82 TYR H A 81 LYS H 1.0 . 5.04 325 312 A 82 TYR H A 77 GLU HA 1.0 . 5.50 326 313 A 82 TYR H A 96 ASN HA 1.0 . 5.50 327 314 A 82 TYR HBy A 82 TYR H 1.0 . 4.15 328 315 A 82 TYR HBx A 82 TYR H 1.0 . 3.59 329 316 A 82 TYR H A 94 ILE HG1x 1.0 . 5.50 330 317 A 78 GLU H A 82 TYR H 1.0 . 5.50 331 318 A 7 LYS H A 7 LYS HBx 1.0 . 2.89 332 319 A 7 LYS H A 11 VAL HGy% 1.0 . 5.03 333 320 A 14 ILE H A 15 CYS HA 1.0 . 5.50 334 321 A 14 ILE H A 13 SER H 1.0 . 5.00 335 322 A 26 TYR HD% A 14 ILE H 1.0 . 5.33 336 323 A 14 ILE H A 13 SER HA 1.0 . 3.07 337 324 A 14 ILE H A 13 SER HBy 1.0 . 4.02 338 325 A 13 SER HBx A 14 ILE H 1.0 . 3.47 339 326 A 14 ILE HB A 14 ILE H 1.0 . 3.43 340 327 A 14 ILE HG1x A 14 ILE H 1.0 . 4.74 341 328 A 14 ILE H A 32 ILE HG1x 1.0 . 4.22 342 328 A 14 ILE H A 32 ILE HG1y 1.0 . 4.22 343 329 A 35 ILE HD1% A 14 ILE H 1.0 . 5.50 344 330 A 45 THR H A 92 TYR HE% 1.0 . 5.50 345 331 A 45 THR H A 47 LYS H 1.0 . 5.15 346 332 A 45 THR H A 92 TYR HA 1.0 . 4.18 347 333 A 44 ARG HA A 45 THR H 1.0 . 3.28 348 334 A 45 THR H A 44 ARG HDx 1.0 . 4.95 349 334 A 45 THR H A 44 ARG HDy 1.0 . 4.95 350 335 A 45 THR H A 43 LYS HBy 1.0 . 3.77 351 336 A 45 THR H A 44 ARG HGx 1.0 . 4.10 352 337 A 90 GLY H A 49 SER H 1.0 . 5.29 353 338 A 88 TYR H A 49 SER H 1.0 . 5.50 354 339 A 89 LYS HA A 49 SER H 1.0 . 4.68 355 340 A 49 SER H A 49 SER HBy 1.0 . 3.27 356 341 A 48 GLN HGx A 49 SER H 1.0 . 4.70 357 342 A 49 SER H A 48 GLN HBy 1.0 . 3.65 358 343 A 32 ILE HA A 31 SER H 1.0 . 5.50 359 344 A 29 SER H A 31 SER H 1.0 . 5.50 360 345 A 32 ILE H A 31 SER H 1.0 . 3.38 361 346 A 26 TYR HD% A 31 SER H 1.0 . 5.50 362 347 A 31 SER HBx A 31 SER H 1.0 . 3.75 363 348 A 31 SER H A 28 ASP HBy 1.0 . 5.50 364 349 A 31 SER H A 32 ILE HG1x 1.0 . 5.50 365 349 A 32 ILE HG1y A 31 SER H 1.0 . 5.50 366 350 A 27 ASP HBy A 28 ASP H 1.0 . 5.16 367 351 A 94 ILE HA A 95 GLU H 1.0 . 3.16 368 352 A 95 GLU H A 95 GLU HGy 1.0 . 3.73 369 353 A 94 ILE HB A 95 GLU H 1.0 . 2.88 370 354 A 94 ILE HG1y A 95 GLU H 1.0 . 5.21 371 355 A 94 ILE HD1% A 95 GLU H 1.0 . 5.25 372 356 A 27 ASP H A 28 ASP H 1.0 . 3.01 373 357 A 31 SER HBx A 28 ASP H 1.0 . 5.18 374 358 A 28 ASP H A 28 ASP HBx 1.0 . 3.64 375 359 A 25 ILE HG2% A 28 ASP H 1.0 . 5.50 376 360 A 28 ASP H A 32 ILE HG1x 1.0 . 4.38 377 360 A 32 ILE HG1y A 28 ASP H 1.0 . 4.38 378 361 A 26 TYR HD% A 28 ASP H 1.0 . 5.50 379 362 A 28 ASP HBy A 28 ASP H 1.0 . 3.88 380 363 A 59 TYR H A 58 GLU HGx 1.0 . 4.34 381 363 A 58 GLU HGy A 59 TYR H 1.0 . 4.34 382 364 A 59 TYR H A 58 GLU HBx 1.0 . 3.69 383 365 A 59 TYR H A 60 GLY H 1.0 . 5.04 384 366 A 49 SER H A 51 GLN H 1.0 . 5.50 385 367 A 50 ILE H A 51 GLN H 1.0 . 2.97 386 368 A 51 GLN H A 51 GLN HE2x 1.0 . 4.77 387 369 A 51 GLN H A 51 GLN HGx 1.0 . 3.68 388 370 A 51 GLN HBx A 51 GLN H 1.0 . 3.97 389 371 A 51 GLN H A 50 ILE HG1y 1.0 . 4.57 390 372 A 51 GLN H A 50 ILE HG1x 1.0 . 4.74 391 373 A 50 ILE HG2% A 51 GLN H 1.0 . 4.84 392 374 A 20 ASN H A 19 THR HG2% 1.0 . 5.50 393 375 A 20 ASN H A 18 PHE HA 1.0 . 5.50 394 376 A 39 ILE H A 40 ALA H 1.0 . 3.47 395 377 A 41 THR H A 40 ALA H 1.0 . 3.61 396 378 A 39 ILE HG1y A 40 ALA H 1.0 . 4.76 397 379 A 40 ALA H A 39 ILE HB 1.0 . 3.50 398 380 A 39 ILE HG2% A 40 ALA H 1.0 . 3.84 399 381 A 29 SER H A 29 SER HBx 1.0 . 2.95 400 381 A 29 SER H A 29 SER HBy 1.0 . 2.95 401 382 A 29 SER H A 28 ASP HBy 1.0 . 3.64 402 383 A 29 SER H A 32 ILE HD1% 1.0 . 5.37 403 384 A 100 ASP H A 101 MET H 1.0 . 3.22 404 385 A 101 MET H A 102 ILE H 1.0 . 3.22 405 386 A 101 MET H A 100 ASP HBy 1.0 . 4.79 406 387 A 101 MET H A 100 ASP HBx 1.0 . 4.28 407 388 A 101 MET H A 101 MET HBy 1.0 . 3.87 408 389 A 101 MET H A 101 MET HBx 1.0 . 3.47 409 390 A 101 MET H A 102 ILE HG1y 1.0 . 5.37 410 391 A 84 ILE H A 83 TYR HD% 1.0 . 4.47 411 392 A 84 ILE H A 93 GLU HA 1.0 . 4.72 412 393 A 84 ILE H A 91 ILE HA 1.0 . 5.50 413 394 A 84 ILE H A 92 TYR HBy 1.0 . 4.47 414 395 A 84 ILE H A 84 ILE HB 1.0 . 3.36 415 396 A 84 ILE H A 84 ILE HG1x 1.0 . 4.57 416 397 A 84 ILE H A 84 ILE HG2% 1.0 . 4.52 417 398 A 84 ILE H A 84 ILE HD1% 1.0 . 4.49 418 399 A 35 ILE HB A 36 LEU H 1.0 . 3.54 419 400 A 35 ILE HD1% A 36 LEU H 1.0 . 5.50 420 401 A 32 ILE HG2% A 36 LEU H 1.0 . 3.68 421 402 A 46 GLU H A 46 GLU HBy 1.0 . 3.56 422 403 A 46 GLU H A 47 LYS HGy 1.0 . 5.36 423 404 A 46 GLU H A 45 THR HB 1.0 . 2.93 424 405 A 85 GLU H A 74 PHE H 1.0 . 3.81 425 406 A 74 PHE HBx A 74 PHE H 1.0 . 3.83 426 407 A 74 PHE H A 73 MET HBy 1.0 . 3.63 427 408 A 72 THR HG2% A 74 PHE H 1.0 . 5.50 428 409 A 62 ILE H A 75 TYR H 1.0 . 5.48 429 410 A 75 TYR H A 76 TYR HD% 1.0 . 4.88 430 411 A 74 PHE HBy A 75 TYR H 1.0 . 3.68 431 412 A 75 TYR H A 60 GLY HAx 1.0 . 5.41 432 413 A 74 PHE HBx A 75 TYR H 1.0 . 4.37 433 414 A 75 TYR H A 62 ILE HD1% 1.0 . 5.50 434 415 A 102 ILE H A 99 GLU HA 1.0 . 5.00 435 416 A 102 ILE H A 101 MET HGx 1.0 . 5.50 436 417 A 102 ILE H A 101 MET HBy 1.0 . 4.80 437 418 A 75 TYR H A 54 PRO HGx 1.0 . 5.50 438 419 A 33 GLN H A 34 LYS H 1.0 . 3.38 439 420 A 33 GLN H A 33 GLN HGy 1.0 . 3.87 440 421 A 33 GLN H A 33 GLN HBx 1.0 . 2.96 441 421 A 33 GLN HBy A 33 GLN H 1.0 . 2.96 442 422 A 33 GLN H A 32 ILE HB 1.0 . 3.44 443 423 A 32 ILE HG2% A 33 GLN H 1.0 . 4.11 444 424 A 33 GLN H A 32 ILE HG1x 1.0 . 4.72 445 424 A 32 ILE HG1y A 33 GLN H 1.0 . 4.72 446 425 A 83 TYR H A 82 TYR H 1.0 . 5.18 447 426 A 82 TYR HBy A 83 TYR H 1.0 . 4.20 448 427 A 83 TYR H A 83 TYR HBy 1.0 . 4.15 449 428 A 83 TYR H A 83 TYR HBx 1.0 . 3.66 450 429 A 83 TYR H A 94 ILE HD1% 1.0 . 5.50 451 430 A 84 ILE HD1% A 83 TYR H 1.0 . 5.50 452 431 A 7 LYS H A 10 ASN H 1.0 . 5.50 453 432 A 10 ASN H A 9 GLU HGx 1.0 . 3.95 454 433 A 10 ASN H A 9 GLU HBx 1.0 . 4.10 455 433 A 10 ASN H A 9 GLU HBy 1.0 . 4.10 456 434 A 10 ASN H A 7 LYS HBx 1.0 . 4.21 457 435 A 51 GLN HBx A 52 ASP H 1.0 . 3.44 458 436 A 52 ASP H A 52 ASP HBx 1.0 . 3.11 459 436 A 52 ASP H A 52 ASP HBy 1.0 . 3.11 460 437 A 52 ASP H A 51 GLN HBy 1.0 . 3.49 461 438 A 63 ASN H A 63 ASN HD2x 1.0 . 5.30 462 439 A 61 THR HB A 63 ASN HD2x 1.0 . 5.50 463 440 A 72 THR HG2% A 63 ASN HD2x 1.0 . 4.96 464 441 A 100 ASP H A 102 ILE HG1y 1.0 . 5.50 465 442 A 102 ILE HG2% A 100 ASP H 1.0 . 5.50 466 443 A 98 PHE H A 100 ASP H 1.0 . 5.44 467 444 A 100 ASP H A 102 ILE H 1.0 . 4.64 468 445 A 100 ASP H A 101 MET HA 1.0 . 5.50 469 446 A 100 ASP H A 98 PHE HA 1.0 . 4.74 470 447 A 100 ASP H A 100 ASP HBx 1.0 . 3.32 471 448 A 97 ASN HBx A 100 ASP H 1.0 . 4.08 472 449 A 100 ASP H A 99 GLU HBx 1.0 . 4.28 473 450 A 100 ASP H A 102 ILE HG1x 1.0 . 5.50 474 451 A 61 THR H A 62 ILE H 1.0 . 5.50 475 452 A 61 THR H A 74 PHE HA 1.0 . 5.50 476 453 A 61 THR HB A 61 THR H 1.0 . 3.51 477 454 A 17 ASP HBx A 61 THR H 1.0 . 3.72 478 455 A 61 THR HG2% A 61 THR H 1.0 . 4.81 479 456 A 61 THR H A 16 ILE HG2% 1.0 . 5.09 480 457 A 59 TYR HD% A 58 GLU H 1.0 . 5.07 481 458 A 56 ALA H A 58 GLU H 1.0 . 5.50 482 459 A 58 GLU H A 59 TYR HA 1.0 . 5.50 483 460 A 58 GLU H A 58 GLU HBy 1.0 . 3.06 484 461 A 58 GLU H A 59 TYR HBx 1.0 . 5.50 485 462 A 90 GLY H A 88 TYR H 1.0 . 5.04 486 463 A 88 TYR H A 88 TYR HE% 1.0 . 5.50 487 464 A 88 TYR H A 87 PRO HDx 1.0 . 5.50 488 465 A 88 TYR H A 49 SER HBy 1.0 . 4.14 489 466 A 88 TYR H A 87 PRO HBy 1.0 . 4.15 490 467 A 98 PHE H A 97 ASN H 1.0 . 5.03 491 468 A 97 ASN H A 97 ASN HD2y 1.0 . 4.61 492 469 A 94 ILE HD1% A 97 ASN H 1.0 . 5.50 493 470 A 23 GLN HA A 23 GLN HE2y 1.0 . 5.50 494 471 A 23 GLN HE2y A 23 GLN HBy 1.0 . 4.25 495 472 A 23 GLN HE2y A 25 ILE HD1% 1.0 . 5.50 496 473 A 17 ASP HA A 23 GLN HE2y 1.0 . 5.50 497 474 A 97 ASN H A 82 TYR HD% 1.0 . 4.23 498 475 A 97 ASN H A 82 TYR HE% 1.0 . 4.30 499 476 A 97 ASN H A 97 ASN HBy 1.0 . 3.25 500 477 A 97 ASN H A 96 ASN HBy 1.0 . 3.27 501 478 A 97 ASN HBx A 97 ASN H 1.0 . 3.10 502 479 A 17 ASP HA A 23 GLN HE2x 1.0 . 5.50 503 480 A 23 GLN HBy A 23 GLN HE2x 1.0 . 4.63 504 481 A 25 ILE HD1% A 23 GLN HE2x 1.0 . 5.50 505 482 A 19 THR H A 20 ASN H 1.0 . 4.36 506 483 A 19 THR H A 18 PHE HBx 1.0 . 3.79 507 484 A 19 THR H A 19 THR HG2% 1.0 . 4.27 508 485 A 16 ILE HG2% A 19 THR H 1.0 . 5.50 509 486 A 55 SER H A 54 PRO HBy 1.0 . 3.82 510 487 A 55 SER H A 76 TYR HD% 1.0 . 5.07 511 488 A 55 SER H A 55 SER HBx 1.0 . 3.32 512 489 A 85 GLU H A 76 TYR H 1.0 . 5.47 513 490 A 84 ILE HD1% A 76 TYR H 1.0 . 5.50 514 491 A 77 GLU H A 76 TYR H 1.0 . 5.47 515 492 A 83 TYR H A 76 TYR H 1.0 . 3.90 516 493 A 76 TYR HD% A 76 TYR H 1.0 . 4.17 517 494 A 75 TYR HBy A 76 TYR H 1.0 . 3.59 518 495 A 76 TYR H A 75 TYR HBx 1.0 . 4.13 519 496 A 83 TYR HBx A 76 TYR H 1.0 . 4.36 520 497 A 8 ALA H A 9 GLU H 1.0 . 3.58 521 498 A 10 ASN H A 9 GLU H 1.0 . 3.51 522 499 A 9 GLU H A 10 ASN HA 1.0 . 5.50 523 500 A 9 GLU H A 9 GLU HBx 1.0 . 3.01 524 500 A 9 GLU H A 9 GLU HBy 1.0 . 3.01 525 501 A 7 LYS HBx A 9 GLU H 1.0 . 4.02 526 502 A 11 VAL HGy% A 9 GLU H 1.0 . 5.27 527 503 A 9 GLU H A 10 ASN HBx 1.0 . 5.50 528 504 A 38 GLU H A 37 SER H 1.0 . 3.41 529 505 A 37 SER HBy A 37 SER H 1.0 . 3.06 530 506 A 35 ILE HA A 37 SER H 1.0 . 5.30 531 507 A 38 GLU HGy A 37 SER H 1.0 . 5.50 532 508 A 37 SER H A 36 LEU HBy 1.0 . 3.57 533 509 A 37 SER H A 36 LEU HBx 1.0 . 3.87 534 510 A 36 LEU HDy% A 37 SER H 1.0 . 5.20 535 511 A 96 ASN H A 95 GLU H 1.0 . 3.37 536 512 A 96 ASN H A 94 ILE HA 1.0 . 4.87 537 513 A 82 TYR HBy A 96 ASN H 1.0 . 5.24 538 514 A 96 ASN H A 96 ASN HBy 1.0 . 3.83 539 515 A 96 ASN H A 96 ASN HBx 1.0 . 3.51 540 516 A 96 ASN H A 94 ILE HB 1.0 . 3.42 541 517 A 94 ILE HG1y A 96 ASN H 1.0 . 4.23 542 518 A 94 ILE HG2% A 96 ASN H 1.0 . 5.18 543 519 A 96 ASN H A 94 ILE HG1x 1.0 . 5.01 544 520 A 96 ASN HA A 96 ASN HD2y 1.0 . 4.85 545 521 A 96 ASN HBy A 96 ASN HD2y 1.0 . 4.05 546 522 A 96 ASN HBx A 96 ASN HD2y 1.0 . 3.78 547 523 A 67 ASN HD2y A 66 ASN HA 1.0 . 5.50 548 524 A 67 ASN HD2y A 67 ASN HA 1.0 . 5.50 549 525 A 67 ASN HD2y A 10 ASN HBy 1.0 . 5.50 550 526 A 67 ASN H A 67 ASN HD2x 1.0 . 5.50 551 527 A 10 ASN H A 67 ASN HD2x 1.0 . 5.08 552 528 A 79 ASN H A 79 ASN HD2y 1.0 . 5.50 553 529 A 79 ASN HA A 79 ASN HD2y 1.0 . 5.39 554 530 A 79 ASN HBx A 79 ASN HD2y 1.0 . 3.56 555 531 A 79 ASN HD2y A 78 GLU HGy 1.0 . 5.50 556 532 A 79 ASN HD2y A 78 GLU HGx 1.0 . 4.61 557 533 A 97 ASN HBx A 97 ASN HD2y 1.0 . 3.75 558 534 A 99 GLU HBx A 97 ASN HD2y 1.0 . 5.25 559 535 A 48 GLN H A 48 GLN HE2x 1.0 . 5.50 560 536 A 50 ILE HG2% A 48 GLN HE2x 1.0 . 5.50 561 537 A 97 ASN HA A 97 ASN HD2x 1.0 . 5.50 562 538 A 97 ASN HD2x A 99 GLU HGy 1.0 . 5.50 563 539 A 99 GLU HBx A 97 ASN HD2x 1.0 . 4.60 564 540 A 79 ASN H A 79 ASN HD2x 1.0 . 5.50 565 541 A 79 ASN HA A 79 ASN HD2x 1.0 . 5.50 566 542 A 78 GLU HGy A 79 ASN HD2x 1.0 . 5.50 567 543 A 78 GLU HGx A 79 ASN HD2x 1.0 . 5.12 568 544 A 48 GLN HE2x A 47 LYS HA 1.0 . 5.50 569 545 A 52 ASP H A 53 TYR H 1.0 . 3.40 570 546 A 53 TYR H A 51 GLN HA 1.0 . 4.95 571 547 A 53 TYR H A 53 TYR HBx 1.0 . 3.34 572 548 A 53 TYR H A 52 ASP HBx 1.0 . 3.51 573 548 A 52 ASP HBy A 53 TYR H 1.0 . 3.51 574 549 A 8 ALA HB% A 33 GLN HE2x 1.0 . 5.50 575 550 A 55 SER H A 51 GLN HE2y 1.0 . 5.11 576 551 A 51 GLN HE2y A 54 PRO HA 1.0 . 4.23 577 552 A 33 GLN HGy A 33 GLN HE2y 1.0 . 3.92 578 553 A 51 GLN HE2y A 54 PRO HBx 1.0 . 5.40 579 554 A 66 ASN HD2y A 65 GLU HA 1.0 . 5.50 580 555 A 66 ASN HD2y A 64 ILE HB 1.0 . 5.41 581 556 A 55 SER HBx A 51 GLN HE2y 1.0 . 5.36 582 557 A 51 GLN HBx A 51 GLN HE2y 1.0 . 4.82 583 558 A 6 PRO HDx A 66 ASN HD2y 1.0 . 5.50 584 559 A 66 ASN HD2x A 67 ASN HD2y 1.0 . 5.50 585 560 A 6 PRO HDx A 66 ASN HD2x 1.0 . 5.50 586 561 A 66 ASN HD2x A 64 ILE HG1y 1.0 . 5.50 587 562 A 55 SER H A 51 GLN HE2x 1.0 . 5.48 588 563 A 51 GLN HE2x A 53 TYR HA 1.0 . 4.80 589 564 A 51 GLN HE2x A 54 PRO HA 1.0 . 5.50 590 565 A 51 GLN HBx A 51 GLN HE2x 1.0 . 5.50 591 566 A 51 GLN HE2x A 54 PRO HBx 1.0 . 5.50 592 567 A 10 ASN H A 10 ASN HD2y 1.0 . 5.18 593 568 A 10 ASN HD2y A 67 ASN HD2x 1.0 . 5.06 594 569 A 10 ASN HD2y A 10 ASN HA 1.0 . 3.65 595 570 A 10 ASN HD2y A 11 VAL HB 1.0 . 5.41 596 571 A 7 LYS HBx A 10 ASN HD2y 1.0 . 4.43 597 572 A 7 LYS H A 10 ASN HD2x 1.0 . 5.50 598 573 A 10 ASN H A 10 ASN HD2x 1.0 . 5.20 599 574 A 11 VAL H A 10 ASN HD2x 1.0 . 5.50 600 575 A 67 ASN HD2x A 10 ASN HD2x 1.0 . 4.79 601 576 A 11 VAL HB A 10 ASN HD2x 1.0 . 5.00 602 577 A 7 LYS HBx A 10 ASN HD2x 1.0 . 4.67 603 578 A 9 GLU H A 10 ASN HD2y 1.0 . 5.50 604 579 A 11 VAL H A 10 ASN HD2y 1.0 . 4.65 605 580 A 7 LYS HEy A 10 ASN HD2y 1.0 . 5.50 606 581 A 10 ASN HD2y A 9 GLU HBx 1.0 . 5.50 607 581 A 10 ASN HD2y A 9 GLU HBy 1.0 . 5.50 608 582 A 7 LYS HEy A 10 ASN HD2x 1.0 . 5.50 609 583 A 98 PHE HE% A 99 GLU H 1.0 . 5.50 610 584 A 98 PHE HD% A 99 GLU H 1.0 . 4.97 611 585 A 99 GLU H A 102 ILE HD1% 1.0 . 5.50 612 586 A 22 ILE H A 21 SER H 1.0 . 3.53 613 587 A 21 SER H A 20 ASN HBy 1.0 . 5.50 614 588 A 21 SER H A 20 ASN HBx 1.0 . 5.50 615 589 A 21 SER H A 22 ILE HB 1.0 . 5.16 616 590 A 22 ILE HG2% A 21 SER H 1.0 . 5.50 617 591 A 98 PHE H A 99 GLU H 1.0 . 4.00 618 592 A 101 MET H A 99 GLU H 1.0 . 4.58 619 593 A 99 GLU H A 100 ASP HA 1.0 . 5.50 620 594 A 99 GLU HGy A 99 GLU H 1.0 . 3.47 621 595 A 99 GLU H A 99 GLU HGx 1.0 . 4.00 622 596 A 99 GLU HBx A 99 GLU H 1.0 . 3.28 623 597 A 94 ILE HD1% A 99 GLU H 1.0 . 5.50 624 598 A 60 GLY H A 75 TYR H 1.0 . 3.86 625 599 A 74 PHE HA A 60 GLY H 1.0 . 5.49 626 600 A 60 GLY H A 59 TYR HBy 1.0 . 3.60 627 601 A 60 GLY H A 59 TYR HBx 1.0 . 4.13 628 602 A 60 GLY H A 19 THR HG2% 1.0 . 4.69 629 603 A 69 GLY H A 67 ASN HBx 1.0 . 4.84 630 604 A 65 GLU HA A 69 GLY H 1.0 . 5.17 631 605 A 69 GLY H A 65 GLU HGx 1.0 . 5.08 632 605 A 69 GLY H A 65 GLU HGy 1.0 . 5.08 633 606 A 67 ASN H A 69 GLY H 1.0 . 5.19 634 607 A 69 GLY H A 68 GLY H 1.0 . 3.35 635 608 A 69 GLY H A 70 MET H 1.0 . 4.82 636 609 A 69 GLY H A 67 ASN HBy 1.0 . 5.18 637 610 A 65 GLU H A 13 SER H 1.0 . 3.97 638 611 A 12 ASP H A 13 SER H 1.0 . 3.19 639 612 A 11 VAL HA A 13 SER H 1.0 . 4.26 640 613 A 13 SER H A 65 GLU HGx 1.0 . 3.31 641 613 A 65 GLU HGy A 13 SER H 1.0 . 3.31 642 614 A 13 SER H A 32 ILE HD1% 1.0 . 5.17 643 615 A 43 LYS H A 42 GLY H 1.0 . 4.54 644 616 A 40 ALA H A 42 GLY H 1.0 . 4.76 645 617 A 41 THR H A 42 GLY H 1.0 . 3.24 646 618 A 94 ILE HA A 42 GLY H 1.0 . 5.50 647 619 A 42 GLY H A 40 ALA HA 1.0 . 4.07 648 620 A 92 TYR HBx A 42 GLY H 1.0 . 4.94 649 621 A 41 THR HG2% A 42 GLY H 1.0 . 4.44 650 622 A 42 GLY H A 3 PRO HGx 1.0 . 5.50 651 622 A 42 GLY H A 3 PRO HGy 1.0 . 5.50 652 623 A 22 ILE H A 20 ASN HD2x 1.0 . 5.36 653 624 A 20 ASN H A 20 ASN HD2x 1.0 . 5.50 654 625 A 22 ILE HB A 20 ASN HD2x 1.0 . 5.50 655 626 A 20 ASN HD2y A 22 ILE HB 1.0 . 5.50 656 627 A 20 ASN HD2y A 20 ASN H 1.0 . 5.50 657 628 A 20 ASN HA A 20 ASN HD2y 1.0 . 5.50 658 629 A 20 ASN HD2y A 22 ILE HG1y 1.0 . 5.50 659 630 A 22 ILE HG1x A 20 ASN HD2y 1.0 . 5.50 660 631 A 41 THR H A 39 ILE HA 1.0 . 4.79 661 632 A 41 THR H A 42 GLY HAx 1.0 . 5.04 662 633 A 5 LEU HDy% A 41 THR H 1.0 . 5.28 663 634 A 67 ASN H A 68 GLY H 1.0 . 3.69 664 635 A 66 ASN HA A 68 GLY H 1.0 . 4.72 665 636 A 67 ASN HA A 68 GLY H 1.0 . 3.54 666 637 A 68 GLY H A 67 ASN HBy 1.0 . 5.01 667 638 A 67 ASN HBx A 68 GLY H 1.0 . 4.98 668 639 A 68 GLY H A 65 GLU HGx 1.0 . 5.12 669 639 A 65 GLU HGy A 68 GLY H 1.0 . 5.12 670 640 A 90 GLY H A 89 LYS H 1.0 . 3.07 671 641 A 90 GLY H A 87 PRO HA 1.0 . 5.50 672 642 A 90 GLY H A 88 TYR HA 1.0 . 5.31 673 643 A 90 GLY H A 49 SER HBy 1.0 . 3.95 674 644 A 90 GLY H A 86 CYS HBx 1.0 . 4.20 675 645 A 90 GLY H A 87 PRO HGx 1.0 . 5.50 676 646 A 90 GLY H A 89 LYS HBy 1.0 . 4.47 677 647 A 80 GLY H A 77 GLU HA 1.0 . 5.50 678 648 A 79 ASN H A 80 GLY H 1.0 . 3.74 679 649 A 80 GLY H A 77 GLU HGx 1.0 . 4.02 680 650 A 80 GLY H A 81 LYS HBx 1.0 . 5.50 681 651 A 42 GLY HAy A 92 TYR HA 1.0 . 5.50 682 652 A 92 TYR HBx A 42 GLY HAy 1.0 . 4.19 683 653 A 43 LYS H A 42 GLY HAy 1.0 . 3.01 684 654 A 42 GLY HAy A 94 ILE HA 1.0 . 4.29 685 655 A 42 GLY HAy A 43 LYS HBx 1.0 . 4.66 686 655 A 42 GLY HAy A 43 LYS HBy 1.0 . 4.66 687 656 A 42 GLY HAx A 43 LYS HBx 1.0 . 5.13 688 656 A 42 GLY HAx A 43 LYS HBy 1.0 . 5.13 689 657 A 43 LYS H A 42 GLY HAx 1.0 . 3.38 690 658 A 92 TYR HBx A 42 GLY HAx 1.0 . 3.64 691 659 A 92 TYR HD% A 42 GLY HAx 1.0 . 5.24 692 660 A 90 GLY HAy A 91 ILE HG1y 1.0 . 4.95 693 661 A 90 GLY HAy A 92 TYR HE% 1.0 . 4.29 694 662 A 89 LYS HA A 90 GLY HAx 1.0 . 4.42 695 663 A 91 ILE H A 90 GLY HAx 1.0 . 3.29 696 664 A 91 ILE HA A 90 GLY HAx 1.0 . 5.48 697 665 A 91 ILE HG1y A 90 GLY HAx 1.0 . 4.96 698 666 A 68 GLY HAx A 67 ASN HA 1.0 . 4.86 699 667 A 77 GLU HGx A 80 GLY HAy 1.0 . 5.15 700 668 A 74 PHE HBy A 61 THR HA 1.0 . 4.62 701 669 A 74 PHE HBy A 59 TYR HE% 1.0 . 4.33 702 670 A 74 PHE HBy A 54 PRO HGx 1.0 . 3.97 703 671 A 74 PHE HBy A 59 TYR HD% 1.0 . 4.47 704 672 A 74 PHE HBy A 85 GLU HBx 1.0 . 4.78 705 673 A 74 PHE HBx A 76 TYR HD% 1.0 . 4.37 706 674 A 74 PHE HBx A 59 TYR HD% 1.0 . 5.12 707 675 A 74 PHE HBx A 85 GLU HBx 1.0 . 4.12 708 676 A 74 PHE HBx A 54 PRO HGy 1.0 . 4.28 709 677 A 74 PHE HBx A 54 PRO HGx 1.0 . 4.28 710 678 A 5 LEU HBy A 6 PRO HDy 1.0 . 5.09 711 679 A 6 PRO HDx A 5 LEU HBy 1.0 . 4.03 712 680 A 5 LEU HBy A 5 LEU HDy% 1.0 . 3.51 713 681 A 5 LEU H A 5 LEU HBx 1.0 . 3.69 714 682 A 5 LEU HDy% A 5 LEU HBx 1.0 . 3.46 715 683 A 70 MET H A 69 GLY HAy 1.0 . 3.22 716 684 A 69 GLY HAx A 70 MET H 1.0 . 3.11 717 685 A 69 GLY HAx A 70 MET HBx 1.0 . 4.80 718 685 A 69 GLY HAx A 70 MET HBy 1.0 . 4.80 719 686 A 28 ASP HBy A 29 SER HBx 1.0 . 4.95 720 686 A 28 ASP HBy A 29 SER HBy 1.0 . 4.95 721 687 A 65 GLU H A 12 ASP HBx 1.0 . 5.25 722 688 A 61 THR H A 60 GLY HAy 1.0 . 3.25 723 689 A 44 ARG H A 44 ARG HDx 1.0 . 3.36 724 689 A 44 ARG H A 44 ARG HDy 1.0 . 3.36 725 690 A 92 TYR HE% A 44 ARG HDx 1.0 . 4.11 726 690 A 92 TYR HE% A 44 ARG HDy 1.0 . 4.11 727 691 A 89 LYS HA A 44 ARG HDx 1.0 . 3.15 728 691 A 89 LYS HA A 44 ARG HDy 1.0 . 3.15 729 692 A 60 GLY HAx A 19 THR HA 1.0 . 4.39 730 693 A 44 ARG HA A 44 ARG HDx 1.0 . 4.03 731 693 A 44 ARG HA A 44 ARG HDy 1.0 . 4.03 732 694 A 44 ARG HBx A 44 ARG HDx 1.0 . 3.01 733 694 A 44 ARG HBy A 44 ARG HDx 1.0 . 3.01 734 694 A 44 ARG HDy A 44 ARG HBx 1.0 . 3.01 735 694 A 44 ARG HBy A 44 ARG HDy 1.0 . 3.01 736 695 A 30 GLU H A 28 ASP HBy 1.0 . 4.16 737 696 A 29 SER H A 28 ASP HBx 1.0 . 3.87 738 697 A 30 GLU H A 28 ASP HBx 1.0 . 4.48 739 698 A 13 SER H A 12 ASP HBy 1.0 . 3.98 740 699 A 84 ILE H A 83 TYR HBy 1.0 . 3.71 741 700 A 12 ASP HBx A 13 SER H 1.0 . 3.76 742 701 A 84 ILE H A 83 TYR HBx 1.0 . 4.28 743 702 A 12 ASP H A 12 ASP HBy 1.0 . 3.67 744 703 A 10 ASN HBy A 66 ASN HBy 1.0 . 5.50 745 704 A 67 ASN HD2y A 66 ASN HBy 1.0 . 5.20 746 705 A 97 ASN H A 96 ASN HBx 1.0 . 3.73 747 706 A 66 ASN HD2x A 66 ASN HBy 1.0 . 3.89 748 707 A 67 ASN HD2y A 66 ASN HBx 1.0 . 4.91 749 708 A 67 ASN H A 66 ASN HBx 1.0 . 3.88 750 709 A 12 ASP H A 66 ASN HBx 1.0 . 5.48 751 710 A 11 VAL HA A 66 ASN HBx 1.0 . 3.74 752 711 A 10 ASN HBy A 66 ASN HBx 1.0 . 4.82 753 712 A 11 VAL HGy% A 66 ASN HBx 1.0 . 3.97 754 713 A 89 LYS HA A 89 LYS HEx 1.0 . 3.54 755 713 A 89 LYS HA A 89 LYS HEy 1.0 . 3.54 756 714 A 88 TYR HBx A 89 LYS HEx 1.0 . 2.49 757 714 A 89 LYS HEy A 88 TYR HBx 1.0 . 2.49 758 715 A 89 LYS HGx A 89 LYS HEx 1.0 . 3.54 759 715 A 89 LYS HEy A 89 LYS HGx 1.0 . 3.54 760 716 A 43 LYS HBx A 43 LYS HEx 1.0 . 4.10 761 716 A 43 LYS HEy A 43 LYS HBx 1.0 . 4.10 762 716 A 43 LYS HBy A 43 LYS HEy 1.0 . 4.10 763 716 A 43 LYS HBy A 43 LYS HEx 1.0 . 4.10 764 717 A 34 LYS HGy A 34 LYS HEx 1.0 . 3.55 765 717 A 34 LYS HEy A 34 LYS HGy 1.0 . 3.55 766 718 A 26 TYR HA A 24 LYS HEy 1.0 . 4.24 767 719 A 24 LYS HEy A 24 LYS HBx 1.0 . 3.21 768 720 A 26 TYR HA A 24 LYS HEx 1.0 . 4.34 769 721 A 26 TYR HE% A 24 LYS HEx 1.0 . 5.36 770 722 A 24 LYS HBx A 24 LYS HEx 1.0 . 3.17 771 723 A 24 LYS HEx A 24 LYS HGy 1.0 . 4.18 772 724 A 7 LYS HEy A 10 ASN H 1.0 . 5.50 773 725 A 7 LYS HEy A 7 LYS HGx 1.0 . 3.74 774 726 A 34 LYS HBx A 34 LYS HEx 1.0 . 4.06 775 726 A 34 LYS HEy A 34 LYS HBx 1.0 . 4.06 776 727 A 18 PHE H A 17 ASP HBy 1.0 . 4.67 777 728 A 14 ILE HB A 13 SER HA 1.0 . 4.88 778 729 A 75 TYR HBy A 84 ILE HA 1.0 . 4.52 779 730 A 75 TYR HBy A 98 PHE HBx 1.0 . 4.72 780 731 A 75 TYR HBy A 84 ILE HG1y 1.0 . 5.12 781 732 A 75 TYR HBy A 84 ILE HG1x 1.0 . 4.44 782 733 A 75 TYR HBy A 62 ILE HD1% 1.0 . 5.22 783 734 A 75 TYR HBy A 84 ILE HD1% 1.0 . 4.75 784 735 A 17 ASP H A 17 ASP HBy 1.0 . 3.60 785 736 A 61 THR H A 17 ASP HBy 1.0 . 3.99 786 737 A 61 THR HB A 17 ASP HBy 1.0 . 3.27 787 738 A 61 THR HG2% A 17 ASP HBy 1.0 . 5.06 788 739 A 17 ASP HBx A 18 PHE H 1.0 . 5.19 789 740 A 17 ASP HBx A 61 THR HG2% 1.0 . 5.14 790 741 A 84 ILE HG1x A 75 TYR HBx 1.0 . 4.17 791 742 A 98 PHE HBx A 75 TYR HBx 1.0 . 5.35 792 743 A 14 ILE HB A 26 TYR H 1.0 . 4.82 793 744 A 35 ILE HD1% A 14 ILE HB 1.0 . 4.34 794 745 A 84 ILE HG2% A 75 TYR HBx 1.0 . 5.50 795 746 A 15 CYS H A 63 ASN HBy 1.0 . 4.78 796 747 A 63 ASN H A 63 ASN HBy 1.0 . 3.73 797 748 A 63 ASN HBy A 70 MET HBx 1.0 . 4.43 798 748 A 63 ASN HBy A 70 MET HBy 1.0 . 4.43 799 749 A 63 ASN HD2y A 63 ASN HBx 1.0 . 3.60 800 750 A 63 ASN H A 63 ASN HBx 1.0 . 3.53 801 751 A 15 CYS H A 63 ASN HBx 1.0 . 4.39 802 752 A 63 ASN HBx A 70 MET HBx 1.0 . 4.64 803 752 A 63 ASN HBx A 70 MET HBy 1.0 . 4.64 804 753 A 53 TYR HD% A 52 ASP HBx 1.0 . 3.49 805 753 A 52 ASP HBy A 53 TYR HD% 1.0 . 3.49 806 754 A 28 ASP H A 27 ASP HBx 1.0 . 5.03 807 755 A 25 ILE HG2% A 27 ASP HBy 1.0 . 4.69 808 756 A 13 SER HBy A 27 ASP HBy 1.0 . 4.78 809 757 A 82 TYR HBy A 94 ILE HG1y 1.0 . 3.77 810 758 A 82 TYR HBy A 94 ILE HG1x 1.0 . 4.51 811 759 A 47 LYS HGy A 47 LYS HEy 1.0 . 4.12 812 760 A 27 ASP H A 27 ASP HBx 1.0 . 4.13 813 761 A 13 SER HBy A 27 ASP HBx 1.0 . 4.59 814 762 A 13 SER HBx A 27 ASP HBx 1.0 . 4.20 815 763 A 82 TYR HBx A 94 ILE HD1% 1.0 . 4.96 816 764 A 82 TYR HBx A 94 ILE HG1y 1.0 . 3.64 817 765 A 84 ILE HB A 92 TYR HBy 1.0 . 3.48 818 766 A 84 ILE HB A 83 TYR HA 1.0 . 4.79 819 767 A 27 ASP HBy A 32 ILE HD1% 1.0 . 5.42 820 768 A 47 LYS HGy A 47 LYS HEx 1.0 . 3.48 821 769 A 91 ILE HG2% A 47 LYS HEx 1.0 . 4.89 822 770 A 91 ILE HD1% A 47 LYS HEx 1.0 . 5.02 823 771 A 100 ASP H A 100 ASP HBy 1.0 . 3.62 824 772 A 36 LEU H A 36 LEU HBy 1.0 . 3.18 825 773 A 36 LEU HDy% A 36 LEU HBy 1.0 . 3.38 826 774 A 36 LEU H A 36 LEU HBx 1.0 . 3.57 827 775 A 36 LEU HDy% A 36 LEU HBx 1.0 . 3.24 828 776 A 62 ILE HB A 73 MET H 1.0 . 3.90 829 777 A 62 ILE HB A 73 MET HGx 1.0 . 4.11 830 778 A 62 ILE HB A 62 ILE HD1% 1.0 . 3.70 831 779 A 54 PRO HGx A 59 TYR HBx 1.0 . 4.93 832 780 A 16 ILE HB A 17 ASP H 1.0 . 4.52 833 781 A 16 ILE HB A 18 PHE HEx 1.0 . 4.19 834 782 A 16 ILE HB A 18 PHE HD% 1.0 . 4.54 835 783 A 16 ILE HB A 26 TYR HE% 1.0 . 3.73 836 784 A 16 ILE HG2% A 18 PHE HBy 1.0 . 5.50 837 785 A 22 ILE HG2% A 18 PHE HBy 1.0 . 5.50 838 786 A 20 ASN H A 18 PHE HBx 1.0 . 3.94 839 787 A 18 PHE HBx A 22 ILE HB 1.0 . 4.16 840 788 A 76 TYR HD% A 59 TYR HBy 1.0 . 4.03 841 789 A 59 TYR HBy A 76 TYR HBy 1.0 . 4.60 842 790 A 59 TYR HBy A 56 ALA HB% 1.0 . 4.63 843 791 A 54 PRO HGx A 59 TYR HBy 1.0 . 4.61 844 792 A 7 LYS H A 10 ASN HBy 1.0 . 5.31 845 793 A 10 ASN H A 10 ASN HBy 1.0 . 3.67 846 794 A 11 VAL H A 10 ASN HBy 1.0 . 4.80 847 795 A 67 ASN H A 10 ASN HBy 1.0 . 4.74 848 796 A 11 VAL HGy% A 10 ASN HBy 1.0 . 5.45 849 797 A 10 ASN H A 10 ASN HBx 1.0 . 3.31 850 798 A 10 ASN HBx A 67 ASN HD2x 1.0 . 5.24 851 799 A 18 PHE HBy A 20 ASN H 1.0 . 4.01 852 800 A 18 PHE HBy A 19 THR H 1.0 . 3.90 853 801 A 18 PHE HBy A 18 PHE HEx 1.0 . 5.40 854 802 A 18 PHE H A 18 PHE HBx 1.0 . 3.59 855 803 A 22 ILE HG2% A 18 PHE HBx 1.0 . 5.50 856 804 A 74 PHE HBx A 59 TYR HBy 1.0 . 5.50 857 805 A 66 ASN HA A 10 ASN HBy 1.0 . 5.15 858 806 A 7 LYS HBx A 10 ASN HBy 1.0 . 4.28 859 807 A 10 ASN HBy A 67 ASN HD2x 1.0 . 5.18 860 808 A 7 LYS H A 10 ASN HBx 1.0 . 4.31 861 809 A 7 LYS HBx A 10 ASN HBx 1.0 . 3.89 862 810 A 11 VAL HGy% A 10 ASN HBx 1.0 . 5.09 863 811 A 92 TYR H A 92 TYR HBy 1.0 . 3.77 864 812 A 43 LYS H A 92 TYR HBy 1.0 . 4.77 865 813 A 84 ILE HD1% A 92 TYR HBy 1.0 . 5.43 866 814 A 84 ILE HG2% A 92 TYR HBy 1.0 . 4.59 867 815 A 84 ILE HB A 92 TYR HBx 1.0 . 4.06 868 816 A 92 TYR H A 92 TYR HBx 1.0 . 4.08 869 817 A 92 TYR HBx A 43 LYS H 1.0 . 4.11 870 818 A 92 TYR HBx A 94 ILE HG2% 1.0 . 5.01 871 819 A 51 GLN H A 50 ILE HB 1.0 . 4.70 872 820 A 88 TYR HE% A 50 ILE HB 1.0 . 5.31 873 821 A 98 PHE HBy A 99 GLU H 1.0 . 4.45 874 822 A 98 PHE HBy A 84 ILE HD1% 1.0 . 5.01 875 823 A 75 TYR HBy A 98 PHE HBy 1.0 . 4.60 876 824 A 64 ILE H A 64 ILE HB 1.0 . 3.41 877 825 A 65 GLU H A 64 ILE HB 1.0 . 4.84 878 826 A 66 ASN HD2x A 64 ILE HB 1.0 . 4.59 879 827 A 64 ILE HD1% A 64 ILE HB 1.0 . 3.51 880 828 A 98 PHE HBx A 99 GLU H 1.0 . 4.07 881 829 A 98 PHE HBx A 94 ILE HD1% 1.0 . 4.42 882 830 A 102 ILE H A 102 ILE HB 1.0 . 3.88 883 831 A 102 ILE HD1% A 102 ILE HB 1.0 . 3.28 884 832 A 35 ILE HD1% A 102 ILE HB 1.0 . 5.01 885 833 A 58 GLU H A 76 TYR HBy 1.0 . 5.05 886 834 A 77 GLU H A 76 TYR HBy 1.0 . 3.76 887 835 A 60 GLY H A 76 TYR HBy 1.0 . 4.93 888 836 A 59 TYR HBx A 76 TYR HBy 1.0 . 3.89 889 837 A 76 TYR HBy A 56 ALA HB% 1.0 . 4.28 890 838 A 77 GLU H A 76 TYR HBx 1.0 . 3.25 891 839 A 59 TYR HBx A 76 TYR HBx 1.0 . 4.63 892 840 A 31 SER HBx A 26 TYR HBx 1.0 . 4.10 893 840 A 31 SER HBx A 26 TYR HBy 1.0 . 4.10 894 841 A 14 ILE HG2% A 26 TYR HBx 1.0 . 4.17 895 841 A 14 ILE HG2% A 26 TYR HBy 1.0 . 4.17 896 842 A 26 TYR HBx A 32 ILE HG1x 1.0 . 4.35 897 842 A 26 TYR HBy A 32 ILE HG1x 1.0 . 4.35 898 842 A 32 ILE HG1y A 26 TYR HBx 1.0 . 4.35 899 842 A 26 TYR HBy A 32 ILE HG1y 1.0 . 4.35 900 843 A 26 TYR H A 26 TYR HBx 1.0 . 3.46 901 843 A 26 TYR H A 26 TYR HBy 1.0 . 3.46 902 844 A 14 ILE H A 26 TYR HBx 1.0 . 3.95 903 844 A 14 ILE H A 26 TYR HBy 1.0 . 3.95 904 845 A 28 ASP H A 26 TYR HBx 1.0 . 4.78 905 845 A 26 TYR HBy A 28 ASP H 1.0 . 4.78 906 846 A 31 SER HA A 26 TYR HBx 1.0 . 4.03 907 846 A 26 TYR HBy A 31 SER HA 1.0 . 4.03 908 847 A 14 ILE HB A 26 TYR HBx 1.0 . 3.33 909 847 A 14 ILE HB A 26 TYR HBy 1.0 . 3.33 910 848 A 91 ILE HB A 47 LYS H 1.0 . 4.96 911 849 A 91 ILE HB A 47 LYS HBy 1.0 . 4.03 912 850 A 91 ILE HB A 91 ILE HD1% 1.0 . 3.76 913 851 A 54 PRO HGx A 76 TYR HBy 1.0 . 5.34 914 852 A 74 PHE HD% A 53 TYR HBy 1.0 . 5.23 915 853 A 32 ILE H A 32 ILE HB 1.0 . 3.00 916 854 A 96 ASN HA A 97 ASN HBy 1.0 . 5.50 917 855 A 18 PHE H A 22 ILE HB 1.0 . 4.98 918 856 A 23 GLN H A 22 ILE HB 1.0 . 3.76 919 857 A 22 ILE H A 22 ILE HB 1.0 . 3.07 920 858 A 79 ASN HBy A 79 ASN HD2y 1.0 . 4.08 921 859 A 79 ASN HBy A 78 GLU HGx 1.0 . 4.63 922 860 A 80 GLY H A 79 ASN HBy 1.0 . 4.89 923 861 A 67 ASN H A 67 ASN HBy 1.0 . 4.18 924 862 A 67 ASN HD2y A 67 ASN HBy 1.0 . 3.95 925 863 A 80 GLY H A 79 ASN HBx 1.0 . 5.07 926 864 A 67 ASN HD2y A 67 ASN HBx 1.0 . 3.57 927 865 A 97 ASN HD2y A 97 ASN HBy 1.0 . 3.63 928 866 A 82 TYR HE% A 97 ASN HBy 1.0 . 5.45 929 867 A 18 PHE HBy A 22 ILE HB 1.0 . 3.82 930 868 A 35 ILE HB A 35 ILE H 1.0 . 3.07 931 869 A 36 LEU HA A 35 ILE HB 1.0 . 5.28 932 870 A 35 ILE HB A 36 LEU HG 1.0 . 5.19 933 871 A 39 ILE H A 39 ILE HB 1.0 . 3.30 934 872 A 36 LEU HA A 39 ILE HB 1.0 . 3.60 935 873 A 40 ALA HB% A 39 ILE HB 1.0 . 4.75 936 874 A 20 ASN HD2y A 20 ASN HBx 1.0 . 3.77 937 875 A 20 ASN HD2y A 20 ASN HBy 1.0 . 3.75 938 876 A 20 ASN H A 20 ASN HBy 1.0 . 4.14 939 877 A 20 ASN H A 20 ASN HBx 1.0 . 3.90 940 878 A 24 LYS H A 24 LYS HBy 1.0 . 3.76 941 879 A 18 PHE HD% A 24 LYS HBy 1.0 . 4.49 942 880 A 26 TYR HE% A 24 LYS HBy 1.0 . 4.07 943 881 A 24 LYS H A 24 LYS HBx 1.0 . 3.86 944 882 A 24 LYS HBx A 18 PHE HD% 1.0 . 4.71 945 883 A 98 PHE HE% A 99 GLU HGy 1.0 . 4.32 946 884 A 98 PHE HD% A 99 GLU HGy 1.0 . 5.45 947 885 A 102 ILE HD1% A 99 GLU HGx 1.0 . 5.48 948 886 A 98 PHE HE% A 99 GLU HGx 1.0 . 4.61 949 887 A 98 PHE HD% A 99 GLU HGx 1.0 . 5.18 950 888 A 96 ASN H A 95 GLU HGy 1.0 . 4.99 951 889 A 96 ASN H A 95 GLU HGx 1.0 . 5.50 952 890 A 58 GLU H A 57 GLU HGx 1.0 . 4.79 953 890 A 58 GLU H A 57 GLU HGy 1.0 . 4.79 954 891 A 95 GLU H A 95 GLU HGx 1.0 . 3.79 955 892 A 95 GLU HGx A 95 GLU HA 1.0 . 3.83 956 893 A 73 MET HBy A 62 ILE HD1% 1.0 . 5.03 957 894 A 73 MET HBy A 86 CYS HA 1.0 . 4.53 958 895 A 74 PHE H A 73 MET HBx 1.0 . 3.88 959 896 A 73 MET HBx A 62 ILE HD1% 1.0 . 4.53 960 897 A 4 ILE HB A 4 ILE H 1.0 . 3.03 961 898 A 79 ASN H A 78 GLU HGy 1.0 . 4.70 962 899 A 78 GLU HGy A 83 TYR HE% 1.0 . 4.81 963 900 A 78 GLU HA A 78 GLU HGy 1.0 . 3.65 964 901 A 79 ASN H A 78 GLU HGx 1.0 . 4.64 965 902 A 76 TYR HD% A 78 GLU HGx 1.0 . 4.84 966 903 A 78 GLU HGx A 83 TYR HE% 1.0 . 4.84 967 904 A 23 GLN HGy A 23 GLN HE2y 1.0 . 3.66 968 905 A 23 GLN HGy A 17 ASP HA 1.0 . 4.39 969 906 A 25 ILE H A 23 GLN HGx 1.0 . 5.50 970 907 A 25 ILE HD1% A 23 GLN HGx 1.0 . 5.26 971 908 A 24 LYS H A 23 GLN HGx 1.0 . 4.14 972 909 A 24 LYS H A 23 GLN HGy 1.0 . 4.01 973 910 A 46 GLU HA A 46 GLU HGy 1.0 . 3.83 974 911 A 46 GLU H A 46 GLU HGy 1.0 . 4.16 975 912 A 46 GLU HGy A 45 THR HA 1.0 . 5.10 976 913 A 93 GLU H A 93 GLU HGy 1.0 . 5.12 977 914 A 94 ILE H A 93 GLU HGy 1.0 . 3.98 978 915 A 83 TYR HE% A 93 GLU HGy 1.0 . 5.44 979 916 A 93 GLU HA A 93 GLU HGy 1.0 . 3.88 980 917 A 81 LYS HBx A 93 GLU HGy 1.0 . 4.84 981 918 A 82 TYR H A 93 GLU HGy 1.0 . 4.98 982 919 A 46 GLU H A 46 GLU HGx 1.0 . 4.15 983 920 A 46 GLU HA A 46 GLU HGx 1.0 . 3.91 984 921 A 93 GLU HA A 93 GLU HGx 1.0 . 3.91 985 922 A 81 LYS HBy A 83 TYR HE% 1.0 . 3.84 986 923 A 81 LYS HBx A 82 TYR H 1.0 . 3.62 987 924 A 89 LYS H A 88 TYR HBy 1.0 . 5.12 988 925 A 58 GLU H A 58 GLU HGx 1.0 . 3.57 989 925 A 58 GLU H A 58 GLU HGy 1.0 . 3.57 990 926 A 58 GLU HBy A 58 GLU HGx 1.0 . 2.40 991 926 A 58 GLU HBx A 58 GLU HGx 1.0 . 2.40 992 926 A 58 GLU HGy A 58 GLU HBy 1.0 . 2.40 993 926 A 58 GLU HGy A 58 GLU HBx 1.0 . 2.40 994 927 A 10 ASN H A 9 GLU HGy 1.0 . 4.03 995 928 A 7 LYS HBx A 9 GLU HGy 1.0 . 3.44 996 929 A 9 GLU H A 9 GLU HGy 1.0 . 3.56 997 930 A 89 LYS H A 88 TYR HBx 1.0 . 5.06 998 931 A 88 TYR HBx A 89 LYS HGy 1.0 . 5.19 999 932 A 9 GLU HGy A 9 GLU HA 1.0 . 3.98 1000 933 A 9 GLU H A 9 GLU HGx 1.0 . 3.66 1001 934 A 7 LYS HBx A 9 GLU HGx 1.0 . 4.09 1002 935 A 9 GLU HGx A 10 ASN HA 1.0 . 5.50 1003 936 A 9 GLU HGx A 9 GLU HA 1.0 . 3.71 1004 937 A 64 ILE HG2% A 65 GLU HGx 1.0 . 5.50 1005 937 A 65 GLU HGy A 64 ILE HG2% 1.0 . 5.50 1006 938 A 12 ASP H A 65 GLU HGx 1.0 . 5.21 1007 938 A 12 ASP H A 65 GLU HGy 1.0 . 5.21 1008 939 A 80 GLY H A 77 GLU HGy 1.0 . 3.93 1009 940 A 77 GLU HGy A 81 LYS H 1.0 . 4.47 1010 941 A 77 GLU HGy A 82 TYR HE% 1.0 . 4.29 1011 942 A 77 GLU HGy A 77 GLU HA 1.0 . 3.77 1012 943 A 80 GLY HAx A 77 GLU HGy 1.0 . 4.78 1013 944 A 81 LYS H A 77 GLU HGx 1.0 . 4.52 1014 945 A 78 GLU H A 77 GLU HGx 1.0 . 3.88 1015 946 A 77 GLU HA A 77 GLU HGx 1.0 . 3.79 1016 947 A 80 GLY HAx A 77 GLU HGx 1.0 . 4.74 1017 948 A 77 GLU HGy A 81 LYS HA 1.0 . 5.50 1018 949 A 89 LYS HBy A 89 LYS HEx 1.0 . 4.04 1019 949 A 89 LYS HEy A 89 LYS HBy 1.0 . 4.04 1020 950 A 69 GLY HAy A 70 MET HBx 1.0 . 4.93 1021 950 A 69 GLY HAy A 70 MET HBy 1.0 . 4.93 1022 951 A 70 MET H A 70 MET HBx 1.0 . 3.44 1023 951 A 70 MET H A 70 MET HBy 1.0 . 3.44 1024 952 A 89 LYS HBx A 89 LYS HEx 1.0 . 4.77 1025 952 A 89 LYS HEy A 89 LYS HBx 1.0 . 4.77 1026 953 A 90 GLY H A 89 LYS HBx 1.0 . 4.45 1027 954 A 89 LYS HBx A 86 CYS HBy 1.0 . 4.12 1028 955 A 85 GLU HBy A 85 GLU HGx 1.0 . 2.90 1029 955 A 85 GLU HBy A 85 GLU HGy 1.0 . 2.90 1030 956 A 93 GLU H A 43 LYS HBx 1.0 . 4.21 1031 956 A 93 GLU H A 43 LYS HBy 1.0 . 4.21 1032 957 A 43 LYS H A 43 LYS HBx 1.0 . 3.21 1033 957 A 43 LYS H A 43 LYS HBy 1.0 . 3.21 1034 958 A 44 ARG H A 43 LYS HBx 1.0 . 4.21 1035 958 A 44 ARG H A 43 LYS HBy 1.0 . 4.21 1036 959 A 43 LYS HGy A 43 LYS HBx 1.0 . 2.65 1037 959 A 43 LYS HGy A 43 LYS HBy 1.0 . 2.65 1038 960 A 33 GLN HGy A 33 GLN HA 1.0 . 3.86 1039 961 A 33 GLN HGy A 33 GLN HBx 1.0 . 2.76 1040 961 A 33 GLN HBy A 33 GLN HGy 1.0 . 2.76 1041 962 A 8 ALA HB% A 33 GLN HGy 1.0 . 4.21 1042 963 A 32 ILE HG2% A 33 GLN HGy 1.0 . 5.39 1043 964 A 33 GLN H A 33 GLN HGx 1.0 . 3.87 1044 965 A 8 ALA HB% A 33 GLN HGx 1.0 . 4.07 1045 966 A 33 GLN HGx A 30 GLU HA 1.0 . 4.43 1046 967 A 48 GLN HGx A 50 ILE HG2% 1.0 . 5.03 1047 968 A 48 GLN HA A 48 GLN HGy 1.0 . 3.90 1048 969 A 47 LYS HA A 48 GLN HGy 1.0 . 4.66 1049 970 A 50 ILE HG2% A 48 GLN HGy 1.0 . 4.95 1050 971 A 48 GLN H A 48 GLN HGy 1.0 . 3.70 1051 972 A 61 THR HB A 17 ASP HBx 1.0 . 3.14 1052 973 A 48 GLN H A 47 LYS HBx 1.0 . 4.43 1053 974 A 78 GLU H A 78 GLU HBy 1.0 . 4.00 1054 975 A 83 TYR HE% A 78 GLU HBy 1.0 . 3.52 1055 976 A 24 LYS H A 23 GLN HBy 1.0 . 4.57 1056 977 A 17 ASP HA A 23 GLN HBy 1.0 . 5.05 1057 978 A 22 ILE HA A 23 GLN HBy 1.0 . 4.57 1058 979 A 23 GLN H A 23 GLN HBy 1.0 . 3.57 1059 980 A 23 GLN HBy A 25 ILE HD1% 1.0 . 5.50 1060 981 A 23 GLN HBx A 23 GLN HE2y 1.0 . 4.36 1061 982 A 23 GLN HBx A 23 GLN H 1.0 . 3.48 1062 983 A 47 LYS HBy A 47 LYS HEy 1.0 . 4.53 1063 984 A 47 LYS HEy A 47 LYS HBx 1.0 . 4.64 1064 985 A 91 ILE HG2% A 47 LYS HBx 1.0 . 4.55 1065 986 A 47 LYS H A 47 LYS HBx 1.0 . 3.51 1066 987 A 91 ILE HD1% A 47 LYS HBx 1.0 . 4.19 1067 988 A 38 GLU HGy A 35 ILE HA 1.0 . 5.26 1068 989 A 38 GLU HGx A 101 MET HBx 1.0 . 4.45 1069 990 A 102 ILE HG2% A 101 MET HBx 1.0 . 4.78 1070 991 A 100 ASP H A 101 MET HBx 1.0 . 4.76 1071 992 A 102 ILE H A 101 MET HBx 1.0 . 4.36 1072 993 A 38 GLU HGy A 102 ILE HG2% 1.0 . 4.93 1073 994 A 35 ILE HA A 38 GLU HGx 1.0 . 5.00 1074 995 A 98 PHE HD% A 38 GLU HGx 1.0 . 5.50 1075 996 A 23 GLN HBx A 17 ASP HBy 1.0 . 4.23 1076 997 A 52 ASP H A 51 GLN HGy 1.0 . 4.90 1077 998 A 50 ILE HG1y A 51 GLN HGy 1.0 . 4.71 1078 999 A 51 GLN H A 51 GLN HGy 1.0 . 4.36 1079 1000 A 50 ILE H A 51 GLN HGx 1.0 . 5.13 1080 1001 A 51 GLN HGx A 52 ASP H 1.0 . 5.08 1081 1002 A 73 MET H A 72 THR HB 1.0 . 4.73 1082 1003 A 72 THR H A 72 THR HB 1.0 . 3.11 1083 1004 A 73 MET H A 73 MET HGy 1.0 . 4.26 1084 1005 A 62 ILE HB A 73 MET HGy 1.0 . 4.11 1085 1006 A 72 THR HG2% A 73 MET HGy 1.0 . 5.50 1086 1007 A 62 ILE HG2% A 73 MET HGy 1.0 . 4.56 1087 1008 A 50 ILE H A 51 GLN HGy 1.0 . 5.07 1088 1009 A 51 GLN HGx A 53 TYR H 1.0 . 4.25 1089 1010 A 59 TYR HD% A 54 PRO HBy 1.0 . 5.32 1090 1011 A 59 TYR HD% A 54 PRO HBx 1.0 . 4.64 1091 1012 A 56 ALA H A 54 PRO HBx 1.0 . 4.15 1092 1013 A 76 TYR HD% A 54 PRO HBx 1.0 . 4.45 1093 1014 A 7 LYS HBy A 9 GLU H 1.0 . 3.83 1094 1015 A 7 LYS H A 7 LYS HBy 1.0 . 3.63 1095 1016 A 56 ALA H A 54 PRO HBy 1.0 . 3.58 1096 1017 A 7 LYS HBx A 7 LYS HGx 1.0 . 2.96 1097 1018 A 55 SER H A 54 PRO HBx 1.0 . 4.20 1098 1019 A 71 THR HB A 66 ASN HD2y 1.0 . 4.06 1099 1020 A 71 THR HB A 6 PRO HDy 1.0 . 4.53 1100 1021 A 71 THR HB A 64 ILE HG1y 1.0 . 5.41 1101 1022 A 71 THR HB A 64 ILE HG2% 1.0 . 4.31 1102 1023 A 71 THR HB A 66 ASN HD2x 1.0 . 4.42 1103 1024 A 71 THR HB A 64 ILE HB 1.0 . 3.02 1104 1025 A 12 ASP H A 11 VAL HB 1.0 . 4.84 1105 1026 A 11 VAL H A 11 VAL HB 1.0 . 3.06 1106 1027 A 78 GLU H A 77 GLU HBy 1.0 . 4.69 1107 1028 A 77 GLU HBy A 82 TYR HE% 1.0 . 4.19 1108 1029 A 77 GLU H A 77 GLU HBx 1.0 . 3.67 1109 1030 A 35 ILE H A 34 LYS HBx 1.0 . 3.71 1110 1031 A 34 LYS H A 34 LYS HBx 1.0 . 3.14 1111 1032 A 78 GLU H A 77 GLU HBx 1.0 . 4.61 1112 1033 A 94 ILE HG2% A 41 THR HB 1.0 . 4.99 1113 1034 A 71 THR H A 70 MET HGy 1.0 . 4.73 1114 1035 A 64 ILE H A 70 MET HGy 1.0 . 5.30 1115 1036 A 71 THR H A 70 MET HGx 1.0 . 4.49 1116 1037 A 70 MET H A 70 MET HGx 1.0 . 4.78 1117 1038 A 87 PRO HBy A 88 TYR HD% 1.0 . 4.46 1118 1039 A 88 TYR HE% A 87 PRO HBx 1.0 . 4.92 1119 1040 A 7 LYS H A 6 PRO HBy 1.0 . 3.82 1120 1041 A 51 GLN HBy A 53 TYR H 1.0 . 3.81 1121 1042 A 11 VAL HGy% A 6 PRO HBy 1.0 . 4.04 1122 1043 A 7 LYS H A 6 PRO HBx 1.0 . 3.52 1123 1044 A 11 VAL HGy% A 6 PRO HBx 1.0 . 3.48 1124 1045 A 51 GLN HE2x A 51 GLN HBy 1.0 . 5.50 1125 1046 A 51 GLN HBx A 53 TYR H 1.0 . 3.97 1126 1047 A 101 MET H A 101 MET HGy 1.0 . 3.79 1127 1048 A 101 MET HA A 101 MET HGy 1.0 . 3.79 1128 1049 A 101 MET H A 101 MET HGx 1.0 . 3.94 1129 1050 A 100 ASP H A 101 MET HGx 1.0 . 4.81 1130 1051 A 101 MET HGx A 101 MET HA 1.0 . 3.79 1131 1052 A 101 MET HGx A 98 PHE HA 1.0 . 4.48 1132 1053 A 98 PHE HA A 101 MET HGy 1.0 . 4.74 1133 1054 A 96 ASN H A 95 GLU HBy 1.0 . 4.35 1134 1055 A 83 TYR HE% A 93 GLU HBy 1.0 . 4.01 1135 1056 A 93 GLU H A 93 GLU HBy 1.0 . 3.54 1136 1057 A 43 LYS H A 93 GLU HBy 1.0 . 4.92 1137 1058 A 93 GLU HBx A 94 ILE H 1.0 . 5.37 1138 1059 A 4 ILE H A 3 PRO HBy 1.0 . 3.94 1139 1060 A 40 ALA HA A 3 PRO HBy 1.0 . 4.72 1140 1061 A 4 ILE H A 3 PRO HBx 1.0 . 4.32 1141 1062 A 40 ALA HA A 3 PRO HBx 1.0 . 4.62 1142 1063 A 4 ILE HB A 3 PRO HBx 1.0 . 5.50 1143 1064 A 95 GLU H A 95 GLU HBx 1.0 . 3.29 1144 1065 A 96 ASN H A 95 GLU HBx 1.0 . 4.31 1145 1066 A 20 ASN H A 19 THR HB 1.0 . 4.36 1146 1067 A 19 THR HB A 58 GLU HGx 1.0 . 4.54 1147 1067 A 58 GLU HGy A 19 THR HB 1.0 . 4.54 1148 1068 A 19 THR HB A 58 GLU HBy 1.0 . 4.08 1149 1068 A 58 GLU HBx A 19 THR HB 1.0 . 4.08 1150 1069 A 13 SER HA A 32 ILE HG1x 1.0 . 4.52 1151 1069 A 32 ILE HG1y A 13 SER HA 1.0 . 4.52 1152 1070 A 29 SER HA A 32 ILE HG1x 1.0 . 5.37 1153 1070 A 32 ILE HG1y A 29 SER HA 1.0 . 5.37 1154 1071 A 32 ILE HA A 32 ILE HG1x 1.0 . 3.69 1155 1071 A 32 ILE HG1y A 32 ILE HA 1.0 . 3.69 1156 1072 A 32 ILE HG2% A 32 ILE HG1x 1.0 . 3.71 1157 1072 A 32 ILE HG2% A 32 ILE HG1y 1.0 . 3.71 1158 1073 A 65 GLU HBy A 13 SER H 1.0 . 3.55 1159 1074 A 57 GLU H A 57 GLU HBy 1.0 . 3.13 1160 1074 A 57 GLU H A 57 GLU HBx 1.0 . 3.13 1161 1075 A 58 GLU H A 57 GLU HBy 1.0 . 3.60 1162 1075 A 58 GLU H A 57 GLU HBx 1.0 . 3.60 1163 1076 A 65 GLU H A 65 GLU HBx 1.0 . 3.40 1164 1077 A 65 GLU HBx A 13 SER H 1.0 . 3.96 1165 1078 A 89 LYS HA A 44 ARG HBx 1.0 . 3.70 1166 1078 A 44 ARG HBy A 89 LYS HA 1.0 . 3.70 1167 1079 A 65 GLU HBx A 64 ILE HA 1.0 . 4.86 1168 1080 A 50 ILE HG2% A 48 GLN HBy 1.0 . 3.93 1169 1081 A 48 GLN H A 48 GLN HBy 1.0 . 3.80 1170 1082 A 35 ILE H A 35 ILE HG1y 1.0 . 3.35 1171 1083 A 35 ILE HA A 35 ILE HG1y 1.0 . 3.66 1172 1084 A 35 ILE HG2% A 35 ILE HG1y 1.0 . 4.23 1173 1085 A 102 ILE HG2% A 35 ILE HG1y 1.0 . 4.92 1174 1086 A 35 ILE HG1x A 35 ILE HA 1.0 . 3.60 1175 1087 A 35 ILE HG1x A 102 ILE HG2% 1.0 . 4.43 1176 1088 A 91 ILE H A 91 ILE HG1y 1.0 . 4.38 1177 1089 A 49 SER HBx A 91 ILE HG1y 1.0 . 3.92 1178 1090 A 91 ILE HG1x A 91 ILE HA 1.0 . 4.04 1179 1091 A 92 TYR H A 91 ILE HG1x 1.0 . 5.13 1180 1092 A 89 LYS HA A 91 ILE HG1x 1.0 . 4.49 1181 1093 A 30 GLU HBx A 31 SER HBy 1.0 . 5.08 1182 1094 A 98 PHE HE% A 39 ILE HG1x 1.0 . 4.49 1183 1095 A 38 GLU H A 39 ILE HG1y 1.0 . 5.34 1184 1096 A 30 GLU H A 30 GLU HBx 1.0 . 3.30 1185 1097 A 46 GLU H A 46 GLU HBx 1.0 . 3.51 1186 1098 A 43 LYS HA A 43 LYS HDx 1.0 . 4.46 1187 1098 A 43 LYS HA A 43 LYS HDy 1.0 . 4.46 1188 1099 A 34 LYS HA A 34 LYS HDy 1.0 . 5.50 1189 1100 A 34 LYS HDx A 102 ILE HA 1.0 . 4.74 1190 1101 A 80 GLY HAy A 81 LYS HDx 1.0 . 4.25 1191 1101 A 80 GLY HAy A 81 LYS HDy 1.0 . 4.25 1192 1102 A 7 LYS HBy A 7 LYS HDy 1.0 . 3.96 1193 1103 A 9 GLU H A 7 LYS HDy 1.0 . 4.85 1194 1104 A 7 LYS H A 7 LYS HDy 1.0 . 4.29 1195 1105 A 7 LYS HDy A 7 LYS HA 1.0 . 4.04 1196 1106 A 89 LYS HA A 86 CYS HBy 1.0 . 5.07 1197 1107 A 86 CYS H A 86 CYS HBy 1.0 . 3.85 1198 1108 A 89 LYS H A 86 CYS HBy 1.0 . 4.86 1199 1109 A 90 GLY H A 86 CYS HBy 1.0 . 4.11 1200 1110 A 92 TYR HE% A 86 CYS HBy 1.0 . 4.26 1201 1111 A 86 CYS HBx A 92 TYR HE% 1.0 . 4.15 1202 1112 A 35 ILE H A 34 LYS HDx 1.0 . 4.89 1203 1113 A 87 PRO HDy A 86 CYS HBy 1.0 . 5.22 1204 1114 A 86 CYS HBx A 89 LYS H 1.0 . 5.37 1205 1115 A 35 ILE HD1% A 14 ILE HG1y 1.0 . 5.50 1206 1116 A 16 ILE H A 25 ILE HG1y 1.0 . 4.86 1207 1117 A 25 ILE HA A 25 ILE HG1y 1.0 . 3.90 1208 1118 A 25 ILE H A 25 ILE HG1y 1.0 . 3.73 1209 1119 A 25 ILE H A 25 ILE HG1x 1.0 . 4.62 1210 1120 A 25 ILE HA A 25 ILE HG1x 1.0 . 3.95 1211 1121 A 99 GLU H A 99 GLU HBy 1.0 . 3.67 1212 1122 A 16 ILE H A 16 ILE HG1y 1.0 . 4.12 1213 1123 A 26 TYR HE% A 16 ILE HG1y 1.0 . 5.50 1214 1124 A 16 ILE HA A 16 ILE HG1y 1.0 . 4.13 1215 1125 A 16 ILE HG1y A 62 ILE HA 1.0 . 4.80 1216 1126 A 14 ILE H A 14 ILE HG1y 1.0 . 4.35 1217 1127 A 26 TYR HD% A 14 ILE HG1y 1.0 . 5.50 1218 1128 A 64 ILE HA A 14 ILE HG1y 1.0 . 4.58 1219 1129 A 14 ILE HA A 14 ILE HG1y 1.0 . 4.11 1220 1130 A 14 ILE HG1y A 32 ILE HG1x 1.0 . 3.83 1221 1130 A 32 ILE HG1y A 14 ILE HG1y 1.0 . 3.83 1222 1131 A 13 SER H A 14 ILE HG1y 1.0 . 5.42 1223 1132 A 15 CYS HA A 25 ILE HG1y 1.0 . 4.76 1224 1133 A 16 ILE HG1x A 63 ASN H 1.0 . 4.76 1225 1134 A 14 ILE HG1x A 64 ILE HD1% 1.0 . 4.48 1226 1135 A 74 PHE HD% A 54 PRO HGy 1.0 . 4.93 1227 1136 A 59 TYR HD% A 54 PRO HGy 1.0 . 5.20 1228 1137 A 59 TYR HD% A 54 PRO HGx 1.0 . 4.81 1229 1138 A 15 CYS HBy A 63 ASN HD2x 1.0 . 5.47 1230 1139 A 63 ASN H A 15 CYS HBy 1.0 . 5.50 1231 1140 A 15 CYS HBy A 14 ILE HA 1.0 . 5.01 1232 1141 A 15 CYS HBy A 25 ILE HG1y 1.0 . 5.44 1233 1142 A 15 CYS HBy A 25 ILE HG1x 1.0 . 4.41 1234 1143 A 15 CYS HBx A 63 ASN H 1.0 . 4.77 1235 1144 A 15 CYS HBx A 14 ILE HA 1.0 . 4.95 1236 1145 A 15 CYS HBx A 15 CYS H 1.0 . 3.54 1237 1146 A 15 CYS HBx A 63 ASN HD2y 1.0 . 5.16 1238 1147 A 15 CYS HBx A 14 ILE HG2% 1.0 . 4.79 1239 1148 A 15 CYS HBx A 25 ILE HG1y 1.0 . 5.39 1240 1149 A 34 LYS H A 33 GLN HBx 1.0 . 3.55 1241 1149 A 33 GLN HBy A 34 LYS H 1.0 . 3.55 1242 1150 A 33 GLN HGx A 33 GLN HBx 1.0 . 2.51 1243 1150 A 33 GLN HBy A 33 GLN HGx 1.0 . 2.51 1244 1151 A 8 ALA HB% A 33 GLN HBx 1.0 . 4.40 1245 1151 A 33 GLN HBy A 8 ALA HB% 1.0 . 4.40 1246 1152 A 26 TYR HD% A 16 ILE HG1y 1.0 . 4.70 1247 1153 A 16 ILE HG1x A 35 ILE HD1% 1.0 . 5.50 1248 1154 A 74 PHE HBy A 54 PRO HGy 1.0 . 4.48 1249 1155 A 59 TYR HE% A 54 PRO HGy 1.0 . 4.25 1250 1156 A 74 PHE HD% A 54 PRO HGx 1.0 . 5.14 1251 1157 A 54 PRO HGx A 53 TYR HA 1.0 . 5.02 1252 1158 A 35 ILE HA A 34 LYS HDx 1.0 . 3.51 1253 1159 A 35 ILE HD1% A 35 ILE HA 1.0 . 4.39 1254 1160 A 32 ILE HG2% A 32 ILE HA 1.0 . 3.38 1255 1161 A 39 ILE HA A 39 ILE HD1% 1.0 . 3.18 1256 1162 A 86 CYS HA A 87 PRO HGy 1.0 . 4.91 1257 1163 A 39 ILE HG1y A 39 ILE HA 1.0 . 3.87 1258 1164 A 22 ILE H A 22 ILE HG1y 1.0 . 3.69 1259 1165 A 20 ASN HD2x A 22 ILE HG1y 1.0 . 4.89 1260 1166 A 22 ILE HA A 22 ILE HG1y 1.0 . 3.91 1261 1167 A 23 GLN H A 22 ILE HG1y 1.0 . 5.10 1262 1168 A 18 PHE HBy A 22 ILE HG1y 1.0 . 5.04 1263 1169 A 22 ILE H A 22 ILE HG1x 1.0 . 3.69 1264 1170 A 22 ILE HG1x A 20 ASN HD2x 1.0 . 5.34 1265 1171 A 35 ILE HA A 38 GLU HBx 1.0 . 3.91 1266 1171 A 35 ILE HA A 38 GLU HBy 1.0 . 3.91 1267 1172 A 45 THR H A 44 ARG HGy 1.0 . 4.37 1268 1173 A 92 TYR HE% A 44 ARG HGy 1.0 . 5.17 1269 1174 A 89 LYS HA A 44 ARG HGy 1.0 . 4.21 1270 1175 A 44 ARG HA A 44 ARG HGy 1.0 . 4.14 1271 1176 A 63 ASN H A 64 ILE HG1y 1.0 . 4.84 1272 1177 A 64 ILE H A 64 ILE HG1y 1.0 . 3.71 1273 1178 A 64 ILE HG1y A 64 ILE HA 1.0 . 3.91 1274 1179 A 14 ILE HG1x A 64 ILE HG1y 1.0 . 4.18 1275 1180 A 84 ILE HA A 84 ILE HG1y 1.0 . 4.09 1276 1181 A 84 ILE H A 84 ILE HG1y 1.0 . 4.51 1277 1182 A 4 ILE H A 4 ILE HG1x 1.0 . 3.76 1278 1183 A 14 ILE HG1x A 64 ILE HG1x 1.0 . 3.54 1279 1184 A 64 ILE H A 64 ILE HG1x 1.0 . 4.49 1280 1185 A 64 ILE HA A 64 ILE HG1x 1.0 . 3.93 1281 1186 A 60 GLY HAy A 19 THR HA 1.0 . 4.59 1282 1187 A 39 ILE H A 38 GLU HBx 1.0 . 3.73 1283 1187 A 39 ILE H A 38 GLU HBy 1.0 . 3.73 1284 1188 A 98 PHE HD% A 38 GLU HBx 1.0 . 5.24 1285 1188 A 98 PHE HD% A 38 GLU HBy 1.0 . 5.24 1286 1189 A 84 ILE HG2% A 84 ILE HG1y 1.0 . 3.18 1287 1190 A 74 PHE HA A 62 ILE HG1y 1.0 . 5.37 1288 1191 A 44 ARG HGx A 92 TYR HD% 1.0 . 5.36 1289 1192 A 65 GLU H A 64 ILE HG1x 1.0 . 5.39 1290 1193 A 62 ILE HA A 62 ILE HG1x 1.0 . 3.97 1291 1194 A 7 LYS H A 6 PRO HGy 1.0 . 5.40 1292 1195 A 6 PRO HGy A 5 LEU HA 1.0 . 5.16 1293 1196 A 66 ASN HBy A 6 PRO HGy 1.0 . 4.63 1294 1197 A 11 VAL HGy% A 6 PRO HGy 1.0 . 3.54 1295 1198 A 66 ASN HD2y A 6 PRO HGy 1.0 . 5.26 1296 1199 A 62 ILE H A 62 ILE HG1y 1.0 . 4.06 1297 1200 A 98 PHE HE% A 62 ILE HG1y 1.0 . 4.76 1298 1201 A 16 ILE HA A 62 ILE HG1x 1.0 . 5.19 1299 1202 A 63 ASN H A 62 ILE HG1x 1.0 . 5.32 1300 1203 A 62 ILE H A 62 ILE HG1x 1.0 . 4.71 1301 1204 A 98 PHE HE% A 62 ILE HG1x 1.0 . 4.77 1302 1205 A 16 ILE HG2% A 62 ILE HG1x 1.0 . 4.96 1303 1206 A 13 SER HBx A 32 ILE HD1% 1.0 . 5.50 1304 1207 A 5 LEU HA A 6 PRO HGx 1.0 . 4.87 1305 1208 A 13 SER HBy A 25 ILE HG2% 1.0 . 4.55 1306 1209 A 13 SER HBx A 27 ASP HBy 1.0 . 4.97 1307 1210 A 32 ILE HA A 36 LEU HG 1.0 . 5.50 1308 1211 A 36 LEU H A 36 LEU HG 1.0 . 3.42 1309 1212 A 36 LEU HA A 36 LEU HG 1.0 . 4.07 1310 1213 A 87 PRO HA A 89 LYS H 1.0 . 4.21 1311 1214 A 87 PRO HA A 88 TYR H 1.0 . 2.83 1312 1215 A 87 PRO HA A 49 SER HBy 1.0 . 4.83 1313 1216 A 5 LEU H A 5 LEU HG 1.0 . 4.24 1314 1217 A 5 LEU HA A 5 LEU HG 1.0 . 4.06 1315 1218 A 6 PRO HDx A 5 LEU HG 1.0 . 4.77 1316 1219 A 5 LEU HDy% A 40 ALA H 1.0 . 4.08 1317 1220 A 5 LEU HDy% A 5 LEU HA 1.0 . 4.16 1318 1221 A 5 LEU HDy% A 40 ALA HA 1.0 . 3.68 1319 1222 A 6 PRO HDx A 5 LEU HDy% 1.0 . 4.83 1320 1223 A 5 LEU HDy% A 39 ILE HB 1.0 . 3.63 1321 1224 A 94 ILE HG1x A 95 GLU HA 1.0 . 5.28 1322 1225 A 50 ILE H A 50 ILE HG1y 1.0 . 3.62 1323 1226 A 50 ILE H A 50 ILE HG1x 1.0 . 3.52 1324 1227 A 5 LEU HDy% A 3 PRO HBx 1.0 . 2.89 1325 1228 A 4 ILE H A 3 PRO HGx 1.0 . 5.05 1326 1228 A 4 ILE H A 3 PRO HGy 1.0 . 5.05 1327 1229 A 92 TYR HBx A 3 PRO HGx 1.0 . 5.30 1328 1229 A 92 TYR HBx A 3 PRO HGy 1.0 . 5.30 1329 1230 A 94 ILE HG1y A 94 ILE H 1.0 . 3.73 1330 1231 A 82 TYR H A 81 LYS HGy 1.0 . 4.68 1331 1232 A 81 LYS H A 81 LYS HGy 1.0 . 4.41 1332 1233 A 93 GLU HGy A 81 LYS HGy 1.0 . 4.82 1333 1234 A 83 TYR HE% A 81 LYS HGx 1.0 . 5.47 1334 1235 A 83 TYR HA A 94 ILE HG1x 1.0 . 4.57 1335 1236 A 84 ILE H A 94 ILE HG1x 1.0 . 5.27 1336 1237 A 82 TYR HBx A 94 ILE HG1x 1.0 . 4.31 1337 1238 A 92 TYR HD% A 3 PRO HGx 1.0 . 4.66 1338 1238 A 92 TYR HD% A 3 PRO HGy 1.0 . 4.66 1339 1239 A 40 ALA HA A 3 PRO HGx 1.0 . 4.99 1340 1239 A 40 ALA HA A 3 PRO HGy 1.0 . 4.99 1341 1240 A 83 TYR HE% A 81 LYS HGy 1.0 . 5.50 1342 1241 A 81 LYS HA A 81 LYS HGy 1.0 . 3.75 1343 1242 A 82 TYR H A 81 LYS HGx 1.0 . 4.95 1344 1243 A 81 LYS H A 81 LYS HGx 1.0 . 4.57 1345 1244 A 81 LYS HA A 81 LYS HGx 1.0 . 3.65 1346 1245 A 81 LYS HGx A 81 LYS HEx 1.0 . 4.23 1347 1245 A 81 LYS HGx A 81 LYS HEy 1.0 . 4.23 1348 1246 A 98 PHE HE% A 102 ILE HG1x 1.0 . 5.28 1349 1247 A 24 LYS H A 24 LYS HGy 1.0 . 4.86 1350 1248 A 25 ILE H A 24 LYS HGy 1.0 . 4.69 1351 1249 A 24 LYS HGy A 18 PHE HEx 1.0 . 4.70 1352 1250 A 24 LYS HGy A 24 LYS HA 1.0 . 4.09 1353 1251 A 24 LYS HGx A 24 LYS HA 1.0 . 3.88 1354 1252 A 26 TYR HE% A 24 LYS HGx 1.0 . 5.42 1355 1253 A 98 PHE HE% A 102 ILE HG1y 1.0 . 5.49 1356 1254 A 102 ILE H A 102 ILE HG1y 1.0 . 3.68 1357 1255 A 101 MET H A 102 ILE HG1x 1.0 . 4.67 1358 1256 A 102 ILE H A 102 ILE HG1x 1.0 . 3.41 1359 1257 A 99 GLU HA A 102 ILE HG1x 1.0 . 3.92 1360 1258 A 102 ILE HG2% A 102 ILE HG1x 1.0 . 3.93 1361 1259 A 102 ILE HG1x A 99 GLU H 1.0 . 4.96 1362 1260 A 4 ILE H A 3 PRO HA 1.0 . 2.69 1363 1261 A 92 TYR HD% A 3 PRO HA 1.0 . 5.39 1364 1262 A 92 TYR HE% A 3 PRO HA 1.0 . 4.14 1365 1263 A 4 ILE HB A 3 PRO HA 1.0 . 4.92 1366 1264 A 89 LYS H A 89 LYS HGy 1.0 . 4.27 1367 1265 A 89 LYS HA A 89 LYS HGy 1.0 . 3.74 1368 1266 A 89 LYS HGy A 89 LYS HEx 1.0 . 4.00 1369 1266 A 89 LYS HEy A 89 LYS HGy 1.0 . 4.00 1370 1267 A 89 LYS HGy A 89 LYS HDy 1.0 . 2.82 1371 1268 A 7 LYS H A 7 LYS HGy 1.0 . 3.66 1372 1269 A 7 LYS HA A 7 LYS HGy 1.0 . 3.85 1373 1270 A 7 LYS H A 7 LYS HGx 1.0 . 3.75 1374 1271 A 89 LYS HA A 89 LYS HGx 1.0 . 3.64 1375 1272 A 89 LYS H A 89 LYS HGx 1.0 . 4.44 1376 1273 A 88 TYR HBx A 89 LYS HGx 1.0 . 5.22 1377 1274 A 41 THR HG2% A 41 THR HA 1.0 . 3.11 1378 1275 A 55 SER H A 55 SER HBy 1.0 . 3.52 1379 1276 A 51 GLN HE2x A 55 SER HBx 1.0 . 5.50 1380 1277 A 56 ALA H A 55 SER HBx 1.0 . 4.48 1381 1278 A 34 LYS HGy A 34 LYS HA 1.0 . 3.83 1382 1279 A 34 LYS HGy A 102 ILE HA 1.0 . 4.74 1383 1280 A 34 LYS H A 34 LYS HGx 1.0 . 4.93 1384 1281 A 102 ILE HG2% A 34 LYS HGx 1.0 . 5.50 1385 1282 A 61 THR HA A 62 ILE HG1y 1.0 . 4.47 1386 1283 A 62 ILE H A 61 THR HA 1.0 . 2.89 1387 1284 A 74 PHE HA A 61 THR HA 1.0 . 3.36 1388 1285 A 30 GLU H A 29 SER HBx 1.0 . 3.37 1389 1285 A 30 GLU H A 29 SER HBy 1.0 . 3.37 1390 1286 A 28 ASP HA A 29 SER HBx 1.0 . 5.31 1391 1286 A 28 ASP HA A 29 SER HBy 1.0 . 5.31 1392 1287 A 32 ILE HD1% A 29 SER HBx 1.0 . 5.12 1393 1287 A 29 SER HBy A 32 ILE HD1% 1.0 . 5.12 1394 1288 A 34 LYS HGy A 35 ILE H 1.0 . 5.05 1395 1289 A 34 LYS HGy A 102 ILE HG2% 1.0 . 5.50 1396 1290 A 34 LYS HA A 34 LYS HGx 1.0 . 4.03 1397 1291 A 102 ILE HA A 34 LYS HGx 1.0 . 4.85 1398 1292 A 34 LYS HGx A 34 LYS HEx 1.0 . 4.08 1399 1292 A 34 LYS HEy A 34 LYS HGx 1.0 . 4.08 1400 1293 A 35 ILE H A 34 LYS HGx 1.0 . 5.19 1401 1294 A 71 THR HA A 70 MET HBx 1.0 . 4.67 1402 1294 A 71 THR HA A 70 MET HBy 1.0 . 4.67 1403 1295 A 72 THR H A 71 THR HA 1.0 . 2.67 1404 1296 A 37 SER HBy A 35 ILE HA 1.0 . 5.37 1405 1297 A 37 SER H A 37 SER HBx 1.0 . 3.41 1406 1298 A 38 GLU H A 37 SER HBx 1.0 . 4.19 1407 1299 A 42 GLY HAy A 43 LYS HGy 1.0 . 5.36 1408 1300 A 43 LYS HGy A 43 LYS HA 1.0 . 4.11 1409 1301 A 43 LYS HGx A 43 LYS H 1.0 . 4.52 1410 1302 A 43 LYS HGx A 43 LYS HA 1.0 . 3.95 1411 1303 A 45 THR HB A 47 LYS HGy 1.0 . 4.92 1412 1304 A 71 THR HA A 72 THR HA 1.0 . 5.05 1413 1305 A 71 THR HA A 72 THR HB 1.0 . 4.62 1414 1306 A 32 ILE H A 31 SER HBy 1.0 . 4.13 1415 1307 A 102 ILE HA A 34 LYS HEx 1.0 . 3.82 1416 1307 A 34 LYS HEy A 102 ILE HA 1.0 . 3.82 1417 1308 A 38 GLU HGx A 102 ILE HA 1.0 . 4.57 1418 1309 A 102 ILE HB A 102 ILE HA 1.0 . 2.96 1419 1310 A 102 ILE HG1x A 102 ILE HA 1.0 . 3.90 1420 1311 A 48 GLN H A 47 LYS HGy 1.0 . 4.65 1421 1312 A 91 ILE HD1% A 47 LYS HGy 1.0 . 5.08 1422 1313 A 48 GLN H A 47 LYS HGx 1.0 . 5.02 1423 1314 A 47 LYS H A 47 LYS HGx 1.0 . 4.09 1424 1315 A 91 ILE HD1% A 47 LYS HGx 1.0 . 5.04 1425 1316 A 45 THR HB A 47 LYS HGx 1.0 . 5.02 1426 1317 A 47 LYS HA A 47 LYS HGx 1.0 . 3.91 1427 1318 A 64 ILE H A 72 THR HA 1.0 . 4.55 1428 1319 A 73 MET H A 72 THR HA 1.0 . 2.79 1429 1320 A 72 THR HA A 63 ASN HA 1.0 . 3.17 1430 1321 A 31 SER H A 31 SER HBy 1.0 . 3.65 1431 1322 A 26 TYR HD% A 31 SER HBy 1.0 . 4.33 1432 1323 A 26 TYR HA A 31 SER HBy 1.0 . 3.60 1433 1324 A 31 SER HBy A 26 TYR HBx 1.0 . 4.18 1434 1324 A 26 TYR HBy A 31 SER HBy 1.0 . 4.18 1435 1325 A 31 SER HA A 32 ILE HG1x 1.0 . 5.08 1436 1325 A 31 SER HA A 32 ILE HG1y 1.0 . 5.08 1437 1326 A 35 ILE HD1% A 31 SER HA 1.0 . 5.47 1438 1327 A 31 SER HBx A 31 SER HA 1.0 . 2.64 1439 1328 A 31 SER HBx A 26 TYR HA 1.0 . 3.73 1440 1329 A 101 MET HBy A 102 ILE HA 1.0 . 5.20 1441 1330 A 12 ASP H A 11 VAL HA 1.0 . 2.75 1442 1331 A 11 VAL HA A 66 ASN HBy 1.0 . 3.57 1443 1332 A 66 ASN H A 11 VAL HA 1.0 . 5.02 1444 1333 A 21 SER HA A 21 SER HBx 1.0 . 2.40 1445 1334 A 21 SER H A 21 SER HBx 1.0 . 3.89 1446 1335 A 22 ILE H A 21 SER HBx 1.0 . 4.60 1447 1336 A 102 ILE HG2% A 98 PHE HA 1.0 . 5.50 1448 1337 A 92 TYR H A 91 ILE HA 1.0 . 3.03 1449 1338 A 11 VAL HA A 10 ASN HA 1.0 . 4.70 1450 1339 A 40 ALA H A 37 SER HA 1.0 . 4.05 1451 1340 A 32 ILE H A 29 SER HA 1.0 . 3.85 1452 1341 A 29 SER HA A 32 ILE HB 1.0 . 3.10 1453 1342 A 84 ILE HD1% A 98 PHE HA 1.0 . 5.50 1454 1343 A 101 MET H A 98 PHE HA 1.0 . 4.36 1455 1344 A 98 PHE HD% A 98 PHE HA 1.0 . 3.49 1456 1345 A 99 GLU HA A 98 PHE HA 1.0 . 4.91 1457 1346 A 101 MET HBx A 98 PHE HA 1.0 . 3.73 1458 1347 A 50 ILE H A 49 SER HBy 1.0 . 5.22 1459 1348 A 49 SER HBy A 51 GLN H 1.0 . 5.12 1460 1349 A 91 ILE HG2% A 91 ILE HA 1.0 . 3.45 1461 1350 A 91 ILE HA A 91 ILE HG1y 1.0 . 3.69 1462 1351 A 55 SER H A 54 PRO HA 1.0 . 2.69 1463 1352 A 56 ALA H A 54 PRO HA 1.0 . 4.05 1464 1353 A 89 LYS H A 49 SER HBy 1.0 . 4.26 1465 1354 A 89 LYS HA A 49 SER HBy 1.0 . 3.78 1466 1355 A 49 SER HBy A 88 TYR HA 1.0 . 4.49 1467 1356 A 91 ILE HD1% A 49 SER HBy 1.0 . 5.04 1468 1357 A 49 SER HBx A 89 LYS H 1.0 . 5.22 1469 1358 A 49 SER HBx A 49 SER H 1.0 . 3.71 1470 1359 A 90 GLY H A 49 SER HBx 1.0 . 5.06 1471 1360 A 49 SER HBx A 51 GLN HGy 1.0 . 4.41 1472 1361 A 91 ILE HG1x A 49 SER HBx 1.0 . 4.72 1473 1362 A 91 ILE HG1x A 49 SER HBy 1.0 . 5.20 1474 1363 A 7 LYS H A 6 PRO HA 1.0 . 2.62 1475 1364 A 5 LEU H A 4 ILE HA 1.0 . 2.58 1476 1365 A 4 ILE HG1y A 4 ILE HA 1.0 . 3.91 1477 1366 A 4 ILE HG1x A 4 ILE HA 1.0 . 3.63 1478 1367 A 13 SER HBx A 11 VAL HGx% 1.0 . 5.02 1479 1368 A 65 GLU H A 11 VAL HGx% 1.0 . 4.16 1480 1369 A 12 ASP H A 11 VAL HGx% 1.0 . 3.70 1481 1370 A 13 SER H A 11 VAL HGx% 1.0 . 3.24 1482 1371 A 11 VAL HA A 11 VAL HGx% 1.0 . 3.44 1483 1372 A 11 VAL HGx% A 8 ALA HA 1.0 . 4.92 1484 1373 A 14 ILE HG1y A 11 VAL HGx% 1.0 . 3.60 1485 1374 A 32 ILE HD1% A 11 VAL HGx% 1.0 . 3.69 1486 1375 A 14 ILE H A 11 VAL HGx% 1.0 . 5.25 1487 1376 A 5 LEU HA A 4 ILE HA 1.0 . 4.67 1488 1377 A 14 ILE HG1x A 14 ILE HA 1.0 . 3.62 1489 1378 A 15 CYS H A 14 ILE HA 1.0 . 2.86 1490 1379 A 65 GLU H A 14 ILE HA 1.0 . 3.76 1491 1380 A 14 ILE HG2% A 14 ILE HA 1.0 . 3.37 1492 1381 A 65 GLU HBy A 64 ILE HA 1.0 . 4.74 1493 1382 A 14 ILE HG1x A 64 ILE HA 1.0 . 3.68 1494 1383 A 15 CYS H A 64 ILE HA 1.0 . 4.26 1495 1384 A 65 GLU H A 64 ILE HA 1.0 . 2.87 1496 1385 A 14 ILE HA A 64 ILE HA 1.0 . 3.33 1497 1386 A 64 ILE HG2% A 64 ILE HA 1.0 . 3.30 1498 1387 A 23 GLN H A 22 ILE HA 1.0 . 2.61 1499 1388 A 22 ILE HG1x A 22 ILE HA 1.0 . 3.60 1500 1389 A 46 GLU H A 45 THR HA 1.0 . 3.09 1501 1390 A 47 LYS H A 45 THR HA 1.0 . 4.32 1502 1391 A 45 THR HB A 45 THR HA 1.0 . 2.98 1503 1392 A 12 ASP H A 11 VAL HGy% 1.0 . 4.73 1504 1393 A 10 ASN H A 11 VAL HGy% 1.0 . 4.14 1505 1394 A 11 VAL H A 11 VAL HGy% 1.0 . 3.29 1506 1395 A 11 VAL HGy% A 11 VAL HA 1.0 . 3.18 1507 1396 A 11 VAL HGy% A 8 ALA HA 1.0 . 3.36 1508 1397 A 11 VAL HGy% A 66 ASN HBy 1.0 . 3.69 1509 1398 A 11 VAL HGy% A 6 PRO HGx 1.0 . 3.39 1510 1399 A 36 LEU HDy% A 36 LEU H 1.0 . 5.09 1511 1400 A 21 SER H A 21 SER HA 1.0 . 2.92 1512 1401 A 26 TYR HD% A 25 ILE HA 1.0 . 4.02 1513 1402 A 51 GLN H A 50 ILE HA 1.0 . 3.26 1514 1403 A 88 TYR HE% A 50 ILE HA 1.0 . 4.17 1515 1404 A 50 ILE HB A 50 ILE HA 1.0 . 2.86 1516 1405 A 63 ASN H A 62 ILE HA 1.0 . 2.82 1517 1406 A 62 ILE HA A 62 ILE HG1y 1.0 . 3.60 1518 1407 A 16 ILE HG1x A 62 ILE HA 1.0 . 4.64 1519 1408 A 73 MET H A 72 THR HG2% 1.0 . 3.37 1520 1409 A 74 PHE HD% A 72 THR HG2% 1.0 . 3.93 1521 1410 A 72 THR HG2% A 72 THR HA 1.0 . 3.32 1522 1411 A 25 ILE HA A 26 TYR H 1.0 . 3.01 1523 1412 A 92 TYR H A 45 THR HG2% 1.0 . 5.40 1524 1413 A 45 THR HG2% A 46 GLU H 1.0 . 4.19 1525 1414 A 45 THR H A 45 THR HG2% 1.0 . 3.29 1526 1415 A 45 THR HG2% A 47 LYS H 1.0 . 4.54 1527 1416 A 45 THR HG2% A 92 TYR HA 1.0 . 3.54 1528 1417 A 45 THR HG2% A 45 THR HA 1.0 . 3.19 1529 1418 A 44 ARG HA A 45 THR HG2% 1.0 . 4.21 1530 1419 A 45 THR HG2% A 43 LYS HBx 1.0 . 3.20 1531 1419 A 45 THR HG2% A 43 LYS HBy 1.0 . 3.20 1532 1420 A 91 ILE HG2% A 45 THR HG2% 1.0 . 4.04 1533 1421 A 17 ASP H A 16 ILE HA 1.0 . 2.79 1534 1422 A 16 ILE HA A 62 ILE HA 1.0 . 3.41 1535 1423 A 16 ILE HG1x A 16 ILE HA 1.0 . 3.62 1536 1424 A 34 LYS H A 30 GLU HA 1.0 . 5.19 1537 1425 A 33 GLN H A 30 GLU HA 1.0 . 3.96 1538 1426 A 30 GLU HA A 30 GLU HGx 1.0 . 3.38 1539 1426 A 30 GLU HA A 30 GLU HGy 1.0 . 3.38 1540 1427 A 30 GLU HA A 33 GLN HBx 1.0 . 2.82 1541 1427 A 33 GLN HBy A 30 GLU HA 1.0 . 2.82 1542 1428 A 61 THR HG2% A 74 PHE HA 1.0 . 4.67 1543 1429 A 61 THR HG2% A 63 ASN HD2y 1.0 . 4.07 1544 1430 A 61 THR HG2% A 63 ASN HD2x 1.0 . 3.56 1545 1431 A 61 THR HG2% A 61 THR HA 1.0 . 3.16 1546 1432 A 61 THR HG2% A 72 THR HG2% 1.0 . 3.30 1547 1433 A 94 ILE HD1% A 94 ILE HA 1.0 . 4.15 1548 1434 A 59 TYR H A 19 THR HG2% 1.0 . 4.35 1549 1435 A 60 GLY HAy A 19 THR HG2% 1.0 . 4.15 1550 1436 A 19 THR HG2% A 19 THR HA 1.0 . 3.19 1551 1437 A 19 THR HG2% A 58 GLU HBy 1.0 . 3.29 1552 1437 A 19 THR HG2% A 58 GLU HBx 1.0 . 3.29 1553 1438 A 19 THR HG2% A 60 GLY HAx 1.0 . 4.49 1554 1439 A 19 THR HG2% A 58 GLU HGx 1.0 . 3.80 1555 1439 A 58 GLU HGy A 19 THR HG2% 1.0 . 3.80 1556 1440 A 64 ILE H A 71 THR HG2% 1.0 . 4.78 1557 1441 A 71 THR H A 71 THR HG2% 1.0 . 4.42 1558 1442 A 72 THR H A 71 THR HG2% 1.0 . 3.56 1559 1443 A 66 ASN HD2y A 71 THR HG2% 1.0 . 4.93 1560 1444 A 72 THR HA A 71 THR HG2% 1.0 . 4.73 1561 1445 A 71 THR HA A 71 THR HG2% 1.0 . 3.21 1562 1446 A 64 ILE HB A 71 THR HG2% 1.0 . 4.24 1563 1447 A 64 ILE HD1% A 71 THR HG2% 1.0 . 3.55 1564 1448 A 6 PRO HDy A 71 THR HG2% 1.0 . 4.50 1565 1449 A 66 ASN HD2x A 71 THR HG2% 1.0 . 5.50 1566 1450 A 34 LYS HBx A 34 LYS HA 1.0 . 3.00 1567 1451 A 33 GLN HE2y A 33 GLN HA 1.0 . 5.01 1568 1452 A 33 GLN HA A 33 GLN HGx 1.0 . 3.58 1569 1453 A 33 GLN HA A 33 GLN HBx 1.0 . 2.86 1570 1453 A 33 GLN HBy A 33 GLN HA 1.0 . 2.86 1571 1454 A 36 LEU HBy A 33 GLN HA 1.0 . 3.43 1572 1455 A 8 ALA HB% A 33 GLN HA 1.0 . 3.80 1573 1456 A 44 ARG HA A 92 TYR HD% 1.0 . 3.72 1574 1457 A 44 ARG HA A 92 TYR HE% 1.0 . 4.72 1575 1458 A 44 ARG HA A 92 TYR HBx 1.0 . 4.84 1576 1459 A 44 ARG HA A 44 ARG HGx 1.0 . 3.61 1577 1460 A 41 THR HG2% A 40 ALA H 1.0 . 5.19 1578 1461 A 41 THR H A 41 THR HG2% 1.0 . 3.17 1579 1462 A 85 GLU H A 84 ILE HA 1.0 . 2.95 1580 1463 A 75 TYR HBx A 84 ILE HA 1.0 . 4.78 1581 1464 A 84 ILE HG1x A 84 ILE HA 1.0 . 3.68 1582 1465 A 57 GLU HA A 57 GLU HGx 1.0 . 3.49 1583 1465 A 57 GLU HGy A 57 GLU HA 1.0 . 3.49 1584 1466 A 57 GLU HA A 57 GLU HBy 1.0 . 2.75 1585 1466 A 57 GLU HBx A 57 GLU HA 1.0 . 2.75 1586 1467 A 56 ALA HB% A 57 GLU HA 1.0 . 4.99 1587 1468 A 95 GLU HA A 95 GLU HBy 1.0 . 3.00 1588 1469 A 36 LEU HDy% A 36 LEU HA 1.0 . 2.93 1589 1470 A 36 LEU HA A 40 ALA H 1.0 . 4.70 1590 1471 A 38 GLU H A 36 LEU HA 1.0 . 5.21 1591 1472 A 101 MET H A 99 GLU HA 1.0 . 4.03 1592 1473 A 98 PHE HD% A 99 GLU HA 1.0 . 4.36 1593 1474 A 99 GLU HA A 99 GLU HGy 1.0 . 3.99 1594 1475 A 99 GLU HA A 99 GLU HGx 1.0 . 3.55 1595 1476 A 102 ILE HG1y A 99 GLU HA 1.0 . 4.36 1596 1477 A 99 GLU HA A 102 ILE HD1% 1.0 . 3.56 1597 1478 A 102 ILE HG2% A 99 GLU HA 1.0 . 5.04 1598 1479 A 9 GLU HA A 9 GLU HBx 1.0 . 2.57 1599 1479 A 9 GLU HBy A 9 GLU HA 1.0 . 2.57 1600 1480 A 8 ALA HB% A 9 GLU HA 1.0 . 4.57 1601 1481 A 55 SER HBx A 55 SER HA 1.0 . 2.66 1602 1482 A 11 VAL H A 9 GLU HA 1.0 . 4.21 1603 1483 A 19 THR H A 18 PHE HA 1.0 . 3.19 1604 1484 A 18 PHE HA A 18 PHE HD% 1.0 . 4.04 1605 1485 A 18 PHE HA A 60 GLY HAx 1.0 . 5.02 1606 1486 A 16 ILE HG2% A 18 PHE HA 1.0 . 4.15 1607 1487 A 18 PHE HA A 18 PHE HEx 1.0 . 5.50 1608 1488 A 41 THR H A 38 GLU HA 1.0 . 4.10 1609 1489 A 38 GLU HGx A 38 GLU HA 1.0 . 4.25 1610 1490 A 38 GLU HA A 38 GLU HBx 1.0 . 2.95 1611 1490 A 38 GLU HBy A 38 GLU HA 1.0 . 2.95 1612 1491 A 41 THR HG2% A 38 GLU HA 1.0 . 3.31 1613 1492 A 83 TYR HBx A 82 TYR HA 1.0 . 4.62 1614 1493 A 56 ALA HB% A 76 TYR HBx 1.0 . 3.86 1615 1494 A 77 GLU H A 56 ALA HB% 1.0 . 5.13 1616 1495 A 57 GLU H A 56 ALA HB% 1.0 . 3.41 1617 1496 A 55 SER H A 56 ALA HB% 1.0 . 4.73 1618 1497 A 58 GLU H A 56 ALA HB% 1.0 . 3.43 1619 1498 A 56 ALA H A 56 ALA HB% 1.0 . 3.01 1620 1499 A 59 TYR HA A 56 ALA HB% 1.0 . 4.46 1621 1500 A 59 TYR HBx A 56 ALA HB% 1.0 . 4.05 1622 1501 A 54 PRO HBy A 56 ALA HB% 1.0 . 3.78 1623 1502 A 78 GLU H A 82 TYR HA 1.0 . 4.10 1624 1503 A 83 TYR H A 82 TYR HA 1.0 . 2.99 1625 1504 A 77 GLU HA A 82 TYR HA 1.0 . 3.22 1626 1505 A 66 ASN HD2x A 64 ILE HG2% 1.0 . 4.12 1627 1506 A 64 ILE H A 64 ILE HG2% 1.0 . 4.42 1628 1507 A 65 GLU H A 64 ILE HG2% 1.0 . 3.77 1629 1508 A 13 SER H A 64 ILE HG2% 1.0 . 4.70 1630 1509 A 66 ASN HD2y A 64 ILE HG2% 1.0 . 4.70 1631 1510 A 66 ASN HBy A 64 ILE HG2% 1.0 . 3.90 1632 1511 A 64 ILE HG1y A 64 ILE HG2% 1.0 . 3.43 1633 1512 A 77 GLU H A 76 TYR HA 1.0 . 2.91 1634 1513 A 60 GLY H A 76 TYR HA 1.0 . 4.86 1635 1514 A 51 GLN H A 49 SER HA 1.0 . 4.25 1636 1515 A 50 ILE H A 49 SER HA 1.0 . 2.75 1637 1516 A 102 ILE HG2% A 99 GLU H 1.0 . 5.24 1638 1517 A 98 PHE HE% A 102 ILE HG2% 1.0 . 3.84 1639 1518 A 102 ILE HG2% A 102 ILE H 1.0 . 3.72 1640 1519 A 102 ILE HG2% A 101 MET HA 1.0 . 5.50 1641 1520 A 102 ILE HG2% A 102 ILE HA 1.0 . 3.26 1642 1521 A 35 ILE HA A 102 ILE HG2% 1.0 . 3.62 1643 1522 A 38 GLU HGx A 102 ILE HG2% 1.0 . 4.10 1644 1523 A 16 ILE HD1% A 102 ILE HG2% 1.0 . 3.90 1645 1524 A 102 ILE HG2% A 102 ILE HD1% 1.0 . 3.16 1646 1525 A 84 ILE H A 83 TYR HA 1.0 . 2.93 1647 1526 A 83 TYR HA A 93 GLU HA 1.0 . 3.32 1648 1527 A 92 TYR H A 83 TYR HA 1.0 . 5.03 1649 1528 A 83 TYR HA A 94 ILE HG2% 1.0 . 5.50 1650 1529 A 56 ALA HB% A 76 TYR HA 1.0 . 5.50 1651 1530 A 79 ASN H A 78 GLU HA 1.0 . 2.82 1652 1531 A 78 GLU HBx A 78 GLU HA 1.0 . 2.96 1653 1532 A 94 ILE HG1y A 94 ILE HG2% 1.0 . 3.96 1654 1533 A 102 ILE HG2% A 35 ILE H 1.0 . 4.94 1655 1534 A 102 ILE HG2% A 38 GLU HBx 1.0 . 3.80 1656 1534 A 38 GLU HBy A 102 ILE HG2% 1.0 . 3.80 1657 1535 A 102 ILE HG2% A 102 ILE HG1y 1.0 . 3.82 1658 1536 A 102 ILE HG2% A 101 MET H 1.0 . 4.65 1659 1537 A 15 CYS HA A 25 ILE HG1x 1.0 . 4.15 1660 1538 A 16 ILE H A 15 CYS HA 1.0 . 2.81 1661 1539 A 25 ILE HA A 15 CYS HA 1.0 . 3.05 1662 1540 A 14 ILE HG2% A 15 CYS HA 1.0 . 4.06 1663 1541 A 66 ASN H A 65 GLU HA 1.0 . 2.69 1664 1542 A 66 ASN HD2x A 65 GLU HA 1.0 . 4.75 1665 1543 A 65 GLU HA A 70 MET HA 1.0 . 3.30 1666 1544 A 65 GLU HA A 65 GLU HGx 1.0 . 3.14 1667 1544 A 65 GLU HA A 65 GLU HGy 1.0 . 3.14 1668 1545 A 91 ILE HD1% A 47 LYS HA 1.0 . 5.44 1669 1546 A 48 GLN H A 47 LYS HA 1.0 . 2.64 1670 1547 A 47 LYS HGy A 47 LYS HA 1.0 . 3.16 1671 1548 A 94 ILE HG2% A 42 GLY H 1.0 . 3.91 1672 1549 A 94 ILE HG2% A 94 ILE HA 1.0 . 3.00 1673 1550 A 42 GLY HAy A 94 ILE HG2% 1.0 . 3.16 1674 1551 A 94 ILE HG2% A 42 GLY HAx 1.0 . 3.59 1675 1552 A 94 ILE HG2% A 94 ILE HD1% 1.0 . 3.06 1676 1553 A 94 ILE HG2% A 94 ILE H 1.0 . 4.06 1677 1554 A 94 ILE HG2% A 95 GLU H 1.0 . 4.03 1678 1555 A 40 ALA HB% A 42 GLY H 1.0 . 5.14 1679 1556 A 40 ALA HB% A 40 ALA H 1.0 . 2.89 1680 1557 A 41 THR H A 40 ALA HB% 1.0 . 3.98 1681 1558 A 5 LEU HDy% A 40 ALA HB% 1.0 . 3.45 1682 1559 A 52 ASP HA A 52 ASP HBx 1.0 . 2.97 1683 1559 A 52 ASP HBy A 52 ASP HA 1.0 . 2.97 1684 1560 A 9 GLU H A 8 ALA HB% 1.0 . 3.31 1685 1561 A 8 ALA H A 8 ALA HB% 1.0 . 2.85 1686 1562 A 33 GLN H A 8 ALA HB% 1.0 . 4.91 1687 1563 A 8 ALA HB% A 33 GLN HE2y 1.0 . 5.44 1688 1564 A 8 ALA HB% A 7 LYS HA 1.0 . 4.64 1689 1565 A 36 LEU HDy% A 8 ALA HB% 1.0 . 3.15 1690 1566 A 32 ILE HD1% A 12 ASP HA 1.0 . 5.29 1691 1567 A 46 GLU HBy A 46 GLU HA 1.0 . 2.80 1692 1568 A 8 ALA HB% A 32 ILE HD1% 1.0 . 4.14 1693 1569 A 50 ILE HG2% A 50 ILE H 1.0 . 3.65 1694 1570 A 50 ILE HG2% A 50 ILE HA 1.0 . 3.00 1695 1571 A 50 ILE HG2% A 49 SER H 1.0 . 4.67 1696 1572 A 91 ILE HG2% A 83 TYR HD% 1.0 . 3.38 1697 1573 A 91 ILE H A 91 ILE HG2% 1.0 . 4.51 1698 1574 A 91 ILE HG2% A 47 LYS H 1.0 . 5.32 1699 1575 A 91 ILE HG2% A 47 LYS HEy 1.0 . 4.51 1700 1576 A 91 ILE HG2% A 47 LYS HBy 1.0 . 3.32 1701 1577 A 85 GLU H A 75 TYR HA 1.0 . 4.17 1702 1578 A 76 TYR H A 75 TYR HA 1.0 . 2.99 1703 1579 A 84 ILE HG1x A 75 TYR HA 1.0 . 5.22 1704 1580 A 84 ILE HA A 75 TYR HA 1.0 . 2.97 1705 1581 A 84 ILE HG2% A 75 TYR HA 1.0 . 4.92 1706 1582 A 60 GLY H A 59 TYR HA 1.0 . 2.97 1707 1583 A 59 TYR HA A 76 TYR HBy 1.0 . 3.41 1708 1584 A 19 THR HG2% A 59 TYR HA 1.0 . 4.20 1709 1585 A 76 TYR HD% A 59 TYR HA 1.0 . 5.04 1710 1586 A 9 GLU H A 7 LYS HA 1.0 . 4.45 1711 1587 A 8 ALA H A 7 LYS HA 1.0 . 2.60 1712 1588 A 7 LYS HBy A 7 LYS HA 1.0 . 2.99 1713 1589 A 7 LYS HA A 6 PRO HA 1.0 . 5.39 1714 1590 A 7 LYS HGx A 7 LYS HA 1.0 . 3.34 1715 1591 A 36 LEU HDy% A 7 LYS HA 1.0 . 4.33 1716 1592 A 73 MET H A 73 MET HE% 1.0 . 4.97 1717 1593 A 86 CYS HA A 73 MET HE% 1.0 . 4.51 1718 1594 A 71 THR HB A 73 MET HE% 1.0 . 4.50 1719 1595 A 73 MET HGy A 73 MET HE% 1.0 . 3.25 1720 1596 A 73 MET HGx A 73 MET HE% 1.0 . 3.40 1721 1597 A 71 THR HG2% A 73 MET HE% 1.0 . 3.24 1722 1598 A 62 ILE HD1% A 73 MET HE% 1.0 . 4.78 1723 1599 A 74 PHE HA A 75 TYR H 1.0 . 3.09 1724 1600 A 62 ILE H A 74 PHE HA 1.0 . 3.91 1725 1601 A 62 ILE HB A 74 PHE HA 1.0 . 4.84 1726 1602 A 93 GLU H A 92 TYR HA 1.0 . 2.99 1727 1603 A 44 ARG HA A 92 TYR HA 1.0 . 3.21 1728 1604 A 93 GLU HBx A 92 TYR HA 1.0 . 4.64 1729 1605 A 92 TYR HA A 92 TYR HD% 1.0 . 4.21 1730 1606 A 92 TYR HA A 91 ILE HA 1.0 . 4.64 1731 1607 A 94 ILE HG1x A 93 GLU HA 1.0 . 4.53 1732 1608 A 94 ILE H A 93 GLU HA 1.0 . 2.88 1733 1609 A 7 LYS HBy A 8 ALA HA 1.0 . 4.96 1734 1610 A 25 ILE HG2% A 26 TYR HBx 1.0 . 4.37 1735 1610 A 25 ILE HG2% A 26 TYR HBy 1.0 . 4.37 1736 1611 A 91 ILE HG2% A 93 GLU H 1.0 . 5.50 1737 1612 A 93 GLU HA A 83 TYR HBy 1.0 . 4.65 1738 1613 A 11 VAL H A 8 ALA HA 1.0 . 4.01 1739 1614 A 11 VAL HB A 8 ALA HA 1.0 . 3.46 1740 1615 A 10 ASN H A 8 ALA HA 1.0 . 4.35 1741 1616 A 35 ILE HG2% A 36 LEU H 1.0 . 3.85 1742 1617 A 36 LEU HA A 35 ILE HG2% 1.0 . 4.42 1743 1618 A 35 ILE HA A 35 ILE HG2% 1.0 . 3.28 1744 1619 A 35 ILE HG1x A 35 ILE HG2% 1.0 . 3.21 1745 1620 A 26 TYR H A 25 ILE HG2% 1.0 . 3.36 1746 1621 A 25 ILE HA A 25 ILE HG2% 1.0 . 3.30 1747 1622 A 13 SER HBx A 25 ILE HG2% 1.0 . 3.79 1748 1623 A 25 ILE HG2% A 27 ASP HBx 1.0 . 3.57 1749 1624 A 25 ILE H A 24 LYS HA 1.0 . 2.63 1750 1625 A 22 ILE HG2% A 23 GLN H 1.0 . 3.35 1751 1626 A 22 ILE HG2% A 22 ILE H 1.0 . 3.84 1752 1627 A 22 ILE HG2% A 22 ILE HA 1.0 . 3.26 1753 1628 A 25 ILE HG2% A 27 ASP H 1.0 . 3.84 1754 1629 A 84 ILE HG2% A 84 ILE HG1x 1.0 . 3.02 1755 1630 A 14 ILE HG2% A 26 TYR H 1.0 . 5.17 1756 1631 A 14 ILE HG2% A 15 CYS H 1.0 . 3.46 1757 1632 A 14 ILE HG2% A 64 ILE HA 1.0 . 3.80 1758 1633 A 14 ILE HG2% A 35 ILE HD1% 1.0 . 3.95 1759 1634 A 14 ILE HG2% A 63 ASN H 1.0 . 4.36 1760 1635 A 73 MET HA A 86 CYS HA 1.0 . 4.09 1761 1636 A 87 PRO HDy A 86 CYS HA 1.0 . 3.14 1762 1637 A 73 MET HBx A 86 CYS HA 1.0 . 4.52 1763 1638 A 87 PRO HDx A 86 CYS HA 1.0 . 3.09 1764 1639 A 84 ILE HG2% A 85 GLU H 1.0 . 3.62 1765 1640 A 84 ILE HG2% A 84 ILE HA 1.0 . 3.44 1766 1641 A 4 ILE HG2% A 4 ILE HA 1.0 . 3.09 1767 1642 A 16 ILE HG1x A 62 ILE HG2% 1.0 . 4.11 1768 1643 A 63 ASN H A 62 ILE HG2% 1.0 . 3.65 1769 1644 A 62 ILE HG2% A 98 PHE HE% 1.0 . 4.82 1770 1645 A 62 ILE HG2% A 63 ASN HA 1.0 . 4.88 1771 1646 A 62 ILE HG2% A 62 ILE HA 1.0 . 3.34 1772 1647 A 62 ILE HG2% A 73 MET HGx 1.0 . 4.64 1773 1648 A 62 ILE HG2% A 16 ILE HG1y 1.0 . 3.80 1774 1649 A 50 ILE HG2% A 48 GLN HA 1.0 . 5.40 1775 1650 A 102 ILE H A 100 ASP HA 1.0 . 4.02 1776 1651 A 49 SER H A 48 GLN HA 1.0 . 2.68 1777 1652 A 48 GLN HGx A 48 GLN HA 1.0 . 3.72 1778 1653 A 48 GLN HBx A 48 GLN HA 1.0 . 3.02 1779 1654 A 91 ILE HD1% A 48 GLN HA 1.0 . 5.01 1780 1655 A 58 GLU HA A 58 GLU HGx 1.0 . 3.40 1781 1655 A 58 GLU HA A 58 GLU HGy 1.0 . 3.40 1782 1656 A 58 GLU HA A 59 TYR H 1.0 . 2.59 1783 1657 A 58 GLU HA A 58 GLU HBy 1.0 . 2.90 1784 1657 A 58 GLU HA A 58 GLU HBx 1.0 . 2.90 1785 1658 A 48 GLN HE2x A 48 GLN HA 1.0 . 5.47 1786 1659 A 44 ARG H A 43 LYS HA 1.0 . 2.83 1787 1660 A 44 ARG HA A 43 LYS HA 1.0 . 4.51 1788 1661 A 67 ASN H A 67 ASN HA 1.0 . 2.66 1789 1662 A 16 ILE H A 16 ILE HG2% 1.0 . 4.65 1790 1663 A 17 ASP H A 16 ILE HG2% 1.0 . 3.53 1791 1664 A 16 ILE HG2% A 18 PHE H 1.0 . 5.00 1792 1665 A 16 ILE HG2% A 98 PHE HE% 1.0 . 3.57 1793 1666 A 16 ILE HG2% A 16 ILE HA 1.0 . 3.19 1794 1667 A 16 ILE HG2% A 62 ILE HA 1.0 . 4.55 1795 1668 A 16 ILE HG1x A 16 ILE HG2% 1.0 . 3.84 1796 1669 A 16 ILE HG2% A 102 ILE HG2% 1.0 . 4.15 1797 1670 A 16 ILE HG2% A 62 ILE HG1y 1.0 . 5.36 1798 1671 A 24 LYS H A 23 GLN HA 1.0 . 2.81 1799 1672 A 23 GLN HA A 17 ASP HA 1.0 . 3.18 1800 1673 A 23 GLN HA A 24 LYS HA 1.0 . 5.25 1801 1674 A 23 GLN HA A 22 ILE HA 1.0 . 5.01 1802 1675 A 23 GLN HA A 23 GLN HGx 1.0 . 3.96 1803 1676 A 23 GLN HA A 23 GLN HGy 1.0 . 3.67 1804 1677 A 23 GLN HA A 22 ILE HG2% 1.0 . 4.94 1805 1678 A 84 ILE HG2% A 85 GLU HA 1.0 . 5.17 1806 1679 A 86 CYS H A 85 GLU HA 1.0 . 2.97 1807 1680 A 92 TYR HD% A 85 GLU HA 1.0 . 4.71 1808 1681 A 79 ASN HA A 80 GLY H 1.0 . 3.19 1809 1682 A 73 MET HA A 74 PHE H 1.0 . 3.05 1810 1683 A 79 ASN HA A 80 GLY HAx 1.0 . 5.11 1811 1684 A 73 MET HA A 72 THR HG2% 1.0 . 4.49 1812 1685 A 73 MET HA A 73 MET HGy 1.0 . 3.97 1813 1686 A 74 PHE HD% A 53 TYR HA 1.0 . 4.10 1814 1687 A 78 GLU H A 77 GLU HA 1.0 . 2.85 1815 1688 A 83 TYR H A 77 GLU HA 1.0 . 4.16 1816 1689 A 52 ASP H A 51 GLN HA 1.0 . 2.86 1817 1690 A 82 TYR H A 81 LYS HA 1.0 . 2.93 1818 1691 A 81 LYS HA A 81 LYS HDx 1.0 . 2.96 1819 1691 A 81 LYS HA A 81 LYS HDy 1.0 . 2.96 1820 1692 A 53 TYR HA A 54 PRO HGy 1.0 . 4.90 1821 1693 A 66 ASN HD2y A 70 MET HA 1.0 . 4.80 1822 1694 A 66 ASN H A 70 MET HA 1.0 . 3.74 1823 1695 A 71 THR H A 70 MET HA 1.0 . 2.76 1824 1696 A 66 ASN HD2x A 70 MET HA 1.0 . 4.65 1825 1697 A 71 THR HB A 70 MET HA 1.0 . 4.51 1826 1698 A 70 MET HGx A 70 MET HA 1.0 . 4.08 1827 1699 A 17 ASP HA A 18 PHE HBy 1.0 . 4.64 1828 1700 A 70 MET HGy A 70 MET HA 1.0 . 4.22 1829 1701 A 17 ASP HA A 18 PHE H 1.0 . 2.83 1830 1702 A 17 ASP HA A 18 PHE HD% 1.0 . 4.49 1831 1703 A 17 ASP HA A 23 GLN HGx 1.0 . 4.87 1832 1704 A 66 ASN HD2x A 66 ASN HA 1.0 . 5.15 1833 1705 A 66 ASN HA A 67 ASN HA 1.0 . 4.65 1834 1706 A 67 ASN H A 66 ASN HA 1.0 . 2.81 1835 1707 A 12 ASP H A 66 ASN HA 1.0 . 3.54 1836 1708 A 11 VAL HA A 66 ASN HA 1.0 . 3.41 1837 1709 A 11 VAL HGy% A 66 ASN HA 1.0 . 4.76 1838 1710 A 98 PHE H A 97 ASN HA 1.0 . 2.92 1839 1711 A 97 ASN HD2y A 97 ASN HA 1.0 . 4.39 1840 1712 A 82 TYR HD% A 97 ASN HA 1.0 . 3.66 1841 1713 A 94 ILE HD1% A 97 ASN HA 1.0 . 4.97 1842 1714 A 82 TYR HBy A 97 ASN HA 1.0 . 4.13 1843 1715 A 32 ILE HD1% A 27 ASP HA 1.0 . 3.90 1844 1716 A 64 ILE HA A 14 ILE HD1% 1.0 . 4.45 1845 1717 A 32 ILE HA A 14 ILE HD1% 1.0 . 3.27 1846 1718 A 14 ILE HB A 14 ILE HD1% 1.0 . 2.81 1847 1719 A 36 LEU H A 14 ILE HD1% 1.0 . 4.36 1848 1720 A 35 ILE HD1% A 14 ILE HD1% 1.0 . 4.03 1849 1721 A 36 LEU HA A 39 ILE HG2% 1.0 . 3.36 1850 1722 A 39 ILE HG2% A 39 ILE HA 1.0 . 4.20 1851 1723 A 39 ILE HG1y A 39 ILE HG2% 1.0 . 3.13 1852 1724 A 39 ILE HG2% A 98 PHE HE% 1.0 . 4.31 1853 1725 A 63 ASN HD2x A 63 ASN HA 1.0 . 5.32 1854 1726 A 64 ILE H A 63 ASN HA 1.0 . 2.79 1855 1727 A 64 ILE HA A 63 ASN HA 1.0 . 4.79 1856 1728 A 64 ILE HB A 63 ASN HA 1.0 . 4.83 1857 1729 A 64 ILE HG1y A 63 ASN HA 1.0 . 4.75 1858 1730 A 72 THR HG2% A 63 ASN HA 1.0 . 4.52 1859 1731 A 64 ILE HD1% A 63 ASN HA 1.0 . 5.50 1860 1732 A 63 ASN HD2y A 63 ASN HA 1.0 . 4.90 1861 1733 A 98 PHE HE% A 102 ILE HD1% 1.0 . 3.79 1862 1734 A 102 ILE H A 102 ILE HD1% 1.0 . 3.81 1863 1735 A 102 ILE HD1% A 102 ILE HA 1.0 . 4.72 1864 1736 A 62 ILE H A 62 ILE HD1% 1.0 . 4.58 1865 1737 A 98 PHE HD% A 62 ILE HD1% 1.0 . 4.81 1866 1738 A 74 PHE HA A 62 ILE HD1% 1.0 . 4.91 1867 1739 A 62 ILE HD1% A 61 THR HA 1.0 . 5.01 1868 1740 A 62 ILE HD1% A 62 ILE HA 1.0 . 4.81 1869 1741 A 62 ILE HD1% A 75 TYR HBx 1.0 . 4.06 1870 1742 A 62 ILE HD1% A 73 MET HGx 1.0 . 3.94 1871 1743 A 62 ILE HG2% A 62 ILE HD1% 1.0 . 3.06 1872 1744 A 73 MET H A 62 ILE HD1% 1.0 . 5.31 1873 1745 A 94 ILE HD1% A 98 PHE HE% 1.0 . 5.50 1874 1746 A 98 PHE H A 94 ILE HD1% 1.0 . 3.81 1875 1747 A 96 ASN H A 94 ILE HD1% 1.0 . 4.43 1876 1748 A 98 PHE HD% A 94 ILE HD1% 1.0 . 3.76 1877 1749 A 94 ILE HD1% A 98 PHE HA 1.0 . 3.77 1878 1750 A 82 TYR HBy A 94 ILE HD1% 1.0 . 4.33 1879 1751 A 98 PHE HBy A 94 ILE HD1% 1.0 . 3.70 1880 1752 A 94 ILE HB A 94 ILE HD1% 1.0 . 3.71 1881 1753 A 35 ILE HD1% A 102 ILE HD1% 1.0 . 4.19 1882 1754 A 50 ILE HA A 50 ILE HD1% 1.0 . 4.37 1883 1755 A 50 ILE HB A 50 ILE HD1% 1.0 . 3.27 1884 1756 A 50 ILE H A 50 ILE HD1% 1.0 . 4.00 1885 1757 A 28 ASP HA A 29 SER HA 1.0 . 4.84 1886 1758 A 29 SER H A 28 ASP HA 1.0 . 2.78 1887 1759 A 28 ASP HA A 30 GLU H 1.0 . 4.47 1888 1760 A 87 PRO HDx A 86 CYS HBy 1.0 . 5.26 1889 1761 A 87 PRO HDy A 89 LYS H 1.0 . 5.12 1890 1762 A 57 GLU H A 56 ALA HA 1.0 . 2.57 1891 1763 A 58 GLU H A 56 ALA HA 1.0 . 4.09 1892 1764 A 56 ALA HA A 57 GLU HBy 1.0 . 4.01 1893 1764 A 57 GLU HBx A 56 ALA HA 1.0 . 4.01 1894 1765 A 89 LYS H A 87 PRO HDx 1.0 . 4.90 1895 1766 A 98 PHE HD% A 39 ILE HD1% 1.0 . 4.16 1896 1767 A 84 ILE HD1% A 84 ILE HA 1.0 . 3.95 1897 1768 A 84 ILE HD1% A 75 TYR HBx 1.0 . 4.62 1898 1769 A 84 ILE HD1% A 75 TYR HA 1.0 . 4.84 1899 1770 A 39 ILE HG2% A 39 ILE HD1% 1.0 . 2.78 1900 1771 A 84 ILE HD1% A 42 GLY HAy 1.0 . 5.50 1901 1772 A 28 ASP H A 32 ILE HD1% 1.0 . 4.48 1902 1773 A 32 ILE H A 32 ILE HD1% 1.0 . 4.02 1903 1774 A 13 SER HA A 32 ILE HD1% 1.0 . 3.13 1904 1775 A 29 SER HA A 32 ILE HD1% 1.0 . 3.77 1905 1776 A 84 ILE HB A 84 ILE HD1% 1.0 . 2.86 1906 1777 A 64 ILE HD1% A 64 ILE HA 1.0 . 4.48 1907 1778 A 71 THR HB A 64 ILE HD1% 1.0 . 3.98 1908 1779 A 6 PRO HDx A 64 ILE HD1% 1.0 . 4.42 1909 1780 A 14 ILE H A 32 ILE HD1% 1.0 . 4.30 1910 1781 A 32 ILE HD1% A 11 VAL HB 1.0 . 4.19 1911 1782 A 32 ILE HD1% A 32 ILE HB 1.0 . 3.18 1912 1783 A 91 ILE HD1% A 49 SER H 1.0 . 4.44 1913 1784 A 48 GLN H A 91 ILE HD1% 1.0 . 4.60 1914 1785 A 91 ILE HD1% A 47 LYS H 1.0 . 5.21 1915 1786 A 91 ILE HD1% A 91 ILE HA 1.0 . 4.58 1916 1787 A 91 ILE HD1% A 49 SER HA 1.0 . 3.88 1917 1788 A 91 ILE HD1% A 49 SER HBx 1.0 . 4.30 1918 1789 A 91 ILE HD1% A 47 LYS HEy 1.0 . 4.71 1919 1790 A 47 LYS HBy A 91 ILE HD1% 1.0 . 3.34 1920 1791 A 91 ILE HG2% A 91 ILE HD1% 1.0 . 2.94 1921 1792 A 16 ILE HD1% A 16 ILE HA 1.0 . 4.01 1922 1793 A 16 ILE HD1% A 62 ILE HA 1.0 . 4.33 1923 1794 A 16 ILE HD1% A 102 ILE HD1% 1.0 . 3.33 1924 1795 A 16 ILE HD1% A 16 ILE HG2% 1.0 . 3.33 1925 1796 A 35 ILE HD1% A 16 ILE HD1% 1.0 . 3.86 1926 1797 A 16 ILE H A 16 ILE HD1% 1.0 . 4.65 1927 1798 A 25 ILE H A 25 ILE HD1% 1.0 . 4.29 1928 1799 A 15 CYS HA A 25 ILE HD1% 1.0 . 4.69 1929 1800 A 25 ILE HA A 25 ILE HD1% 1.0 . 4.18 1930 1801 A 26 TYR H A 25 ILE HD1% 1.0 . 5.50 1931 1802 A 64 ILE HD1% A 6 PRO HDy 1.0 . 4.91 1932 1803 A 35 ILE HD1% A 35 ILE H 1.0 . 4.07 1933 1804 A 35 ILE HD1% A 26 TYR HA 1.0 . 4.60 1934 1805 A 35 ILE HD1% A 31 SER HBx 1.0 . 4.30 1935 1806 A 35 ILE HD1% A 32 ILE HA 1.0 . 3.65 1936 1807 A 35 ILE HD1% A 26 TYR HBx 1.0 . 3.78 1937 1807 A 35 ILE HD1% A 26 TYR HBy 1.0 . 3.78 1938 1808 A 35 ILE HD1% A 35 ILE HB 1.0 . 3.11 1939 1809 A 35 ILE HD1% A 35 ILE HG2% 1.0 . 2.99 1940 1810 A 96 ASN HA A 96 ASN HD2x 1.0 . 4.27 1941 1811 A 96 ASN HA A 97 ASN H 1.0 . 3.01 1942 1812 A 92 TYR HD% A 3 PRO HDy 1.0 . 5.08 1943 1813 A 40 ALA HA A 3 PRO HDy 1.0 . 3.24 1944 1814 A 42 GLY H A 3 PRO HDy 1.0 . 4.71 1945 1815 A 41 THR HA A 3 PRO HDy 1.0 . 5.44 1946 1816 A 40 ALA HA A 3 PRO HDx 1.0 . 3.37 1947 1817 A 42 GLY H A 3 PRO HDx 1.0 . 4.57 1948 1818 A 20 ASN HD2y A 22 ILE HD1% 1.0 . 4.36 1949 1819 A 20 ASN HD2x A 22 ILE HD1% 1.0 . 4.15 1950 1820 A 22 ILE HB A 22 ILE HD1% 1.0 . 3.53 1951 1821 A 22 ILE H A 22 ILE HD1% 1.0 . 4.28 1952 1822 A 4 ILE H A 4 ILE HD1% 1.0 . 4.09 1953 1823 A 4 ILE HB A 4 ILE HD1% 1.0 . 3.43 1954 1824 A 6 PRO HDy A 5 LEU HA 1.0 . 2.91 1955 1825 A 6 PRO HDy A 5 LEU HBx 1.0 . 3.82 1956 1826 A 6 PRO HDx A 5 LEU HA 1.0 . 3.06 1957 1827 A 6 PRO HDx A 5 LEU HBx 1.0 . 3.25 1958 1828 A 59 TYR HD% A 60 GLY H 1.0 . 3.73 1959 1829 A 59 TYR HD% A 59 TYR H 1.0 . 3.38 1960 1830 A 59 TYR HD% A 59 TYR HA 1.0 . 3.74 1961 1831 A 59 TYR HD% A 56 ALA HB% 1.0 . 3.07 1962 1832 A 59 TYR HD% A 57 GLU HA 1.0 . 4.46 1963 1833 A 59 TYR HD% A 75 TYR H 1.0 . 4.89 1964 1834 A 59 TYR HD% A 74 PHE HA 1.0 . 4.31 1965 1835 A 26 TYR HD% A 15 CYS HA 1.0 . 4.09 1966 1836 A 26 TYR HD% A 14 ILE HB 1.0 . 3.19 1967 1837 A 26 TYR HD% A 35 ILE HG1x 1.0 . 4.11 1968 1838 A 26 TYR HD% A 26 TYR H 1.0 . 2.84 1969 1839 A 26 TYR HD% A 31 SER HA 1.0 . 3.37 1970 1840 A 26 TYR HD% A 31 SER HBx 1.0 . 3.14 1971 1841 A 26 TYR HD% A 16 ILE HG1x 1.0 . 3.78 1972 1842 A 26 TYR HD% A 14 ILE HG2% 1.0 . 3.66 1973 1843 A 26 TYR HD% A 35 ILE HD1% 1.0 . 3.20 1974 1844 A 84 ILE HD1% A 92 TYR HD% 1.0 . 4.22 1975 1845 A 92 TYR H A 92 TYR HD% 1.0 . 2.92 1976 1846 A 84 ILE H A 92 TYR HD% 1.0 . 4.15 1977 1847 A 44 ARG H A 92 TYR HD% 1.0 . 3.31 1978 1848 A 92 TYR HD% A 3 PRO HDx 1.0 . 3.34 1979 1849 A 92 TYR HD% A 44 ARG HBx 1.0 . 3.37 1980 1849 A 44 ARG HBy A 92 TYR HD% 1.0 . 3.37 1981 1850 A 84 ILE HB A 92 TYR HD% 1.0 . 3.85 1982 1851 A 92 TYR HD% A 3 PRO HBy 1.0 . 4.52 1983 1852 A 84 ILE HG2% A 92 TYR HD% 1.0 . 3.43 1984 1853 A 93 GLU H A 92 TYR HD% 1.0 . 5.08 1985 1854 A 92 TYR H A 83 TYR HD% 1.0 . 4.50 1986 1855 A 78 GLU H A 83 TYR HD% 1.0 . 3.50 1987 1856 A 81 LYS HBx A 83 TYR HD% 1.0 . 3.98 1988 1857 A 83 TYR HA A 83 TYR HD% 1.0 . 3.18 1989 1858 A 83 TYR HD% A 77 GLU HA 1.0 . 3.93 1990 1859 A 83 TYR HD% A 93 GLU HA 1.0 . 3.04 1991 1860 A 83 TYR HD% A 78 GLU HBy 1.0 . 3.12 1992 1861 A 93 GLU HBx A 83 TYR HD% 1.0 . 3.53 1993 1862 A 83 TYR H A 83 TYR HD% 1.0 . 3.41 1994 1863 A 45 THR H A 92 TYR HD% 1.0 . 4.91 1995 1864 A 83 TYR H A 82 TYR HD% 1.0 . 5.05 1996 1865 A 82 TYR HD% A 81 LYS HA 1.0 . 4.68 1997 1866 A 94 ILE HG1y A 82 TYR HD% 1.0 . 4.97 1998 1867 A 82 TYR H A 82 TYR HD% 1.0 . 3.76 1999 1868 A 82 TYR HD% A 82 TYR HA 1.0 . 3.71 2000 1869 A 82 TYR HD% A 77 GLU HBx 1.0 . 3.42 2001 1870 A 77 GLU HA A 82 TYR HD% 1.0 . 4.01 2002 1871 A 96 ASN HA A 82 TYR HD% 1.0 . 3.90 2003 1872 A 98 PHE H A 82 TYR HD% 1.0 . 4.97 2004 1873 A 76 TYR HD% A 59 TYR HBx 1.0 . 3.71 2005 1874 A 76 TYR HD% A 54 PRO HBy 1.0 . 3.72 2006 1875 A 76 TYR HD% A 56 ALA HB% 1.0 . 3.11 2007 1876 A 76 TYR HD% A 54 PRO HGx 1.0 . 3.63 2008 1877 A 77 GLU H A 76 TYR HD% 1.0 . 3.70 2009 1878 A 76 TYR HD% A 76 TYR HA 1.0 . 3.65 2010 1879 A 74 PHE HD% A 74 PHE HA 1.0 . 3.69 2011 1880 A 74 PHE HD% A 73 MET HA 1.0 . 4.97 2012 1881 A 74 PHE HD% A 61 THR HA 1.0 . 3.66 2013 1882 A 74 PHE HD% A 62 ILE H 1.0 . 4.73 2014 1883 A 74 PHE HD% A 75 TYR H 1.0 . 4.77 2015 1884 A 74 PHE HD% A 59 TYR HD% 1.0 . 3.48 2016 1885 A 89 LYS H A 88 TYR HD% 1.0 . 4.68 2017 1886 A 88 TYR H A 88 TYR HD% 1.0 . 3.90 2018 1887 A 88 TYR HA A 88 TYR HD% 1.0 . 3.05 2019 1888 A 88 TYR HD% A 87 PRO HBx 1.0 . 3.22 2020 1889 A 76 TYR HD% A 75 TYR HA 1.0 . 4.13 2021 1890 A 19 THR H A 18 PHE HD% 1.0 . 3.99 2022 1891 A 24 LYS H A 18 PHE HD% 1.0 . 3.63 2023 1892 A 18 PHE H A 18 PHE HD% 1.0 . 2.92 2024 1893 A 23 GLN HA A 18 PHE HD% 1.0 . 3.61 2025 1894 A 102 ILE HD1% A 18 PHE HD% 1.0 . 4.54 2026 1895 A 16 ILE HG2% A 18 PHE HD% 1.0 . 3.36 2027 1896 A 74 PHE HD% A 74 PHE H 1.0 . 4.06 2028 1897 A 74 PHE HD% A 85 GLU HGx 1.0 . 4.48 2029 1897 A 74 PHE HD% A 85 GLU HGy 1.0 . 4.48 2030 1898 A 74 PHE HD% A 61 THR HG2% 1.0 . 3.71 2031 1899 A 97 ASN HD2y A 82 TYR HD% 1.0 . 4.09 2032 1900 A 74 PHE HD% A 85 GLU HBy 1.0 . 4.19 2033 1901 A 74 PHE H A 74 PHE HE% 1.0 . 4.97 2034 1902 A 61 THR HA A 74 PHE HE% 1.0 . 4.28 2035 1903 A 72 THR HG2% A 74 PHE HE% 1.0 . 3.68 2036 1904 A 74 PHE HE% A 53 TYR HE% 1.0 . 4.23 2037 1905 A 53 TYR HA A 74 PHE HE% 1.0 . 3.66 2038 1906 A 61 THR HG2% A 74 PHE HE% 1.0 . 3.25 2039 1907 A 24 LYS H A 18 PHE HEx 1.0 . 3.80 2040 1908 A 23 GLN HA A 18 PHE HEx 1.0 . 4.84 2041 1909 A 16 ILE HG2% A 18 PHE HEx 1.0 . 3.65 2042 1910 A 18 PHE H A 18 PHE HEx 1.0 . 4.63 2043 1911 A 18 PHE HEx A 18 PHE HD% 1.0 . 2.40 2044 1912 A 18 PHE HEx A 24 LYS HBy 1.0 . 2.93 2045 1913 A 24 LYS HBx A 18 PHE HEx 1.0 . 3.20 2046 1914 A 102 ILE HD1% A 18 PHE HEx 1.0 . 3.45 2047 1915 A 98 PHE HE% A 39 ILE HA 1.0 . 3.63 2048 1916 A 39 ILE H A 98 PHE HE% 1.0 . 3.95 2049 1917 A 39 ILE HG1y A 98 PHE HE% 1.0 . 3.36 2050 1918 A 98 PHE HE% A 38 GLU HBx 1.0 . 3.41 2051 1918 A 98 PHE HE% A 38 GLU HBy 1.0 . 3.41 2052 1919 A 16 ILE HD1% A 98 PHE HE% 1.0 . 2.81 2053 1920 A 98 PHE HE% A 39 ILE HD1% 1.0 . 2.85 2054 1921 A 39 ILE HG1y A 98 PHE HZ 1.0 . 3.68 2055 1922 A 35 ILE HG2% A 98 PHE HZ 1.0 . 2.92 2056 1923 A 39 ILE HD1% A 98 PHE HZ 1.0 . 3.39 2057 1924 A 59 TYR HE% A 74 PHE HE% 1.0 . 3.05 2058 1925 A 74 PHE HD% A 59 TYR HE% 1.0 . 2.98 2059 1926 A 59 TYR H A 59 TYR HE% 1.0 . 4.53 2060 1927 A 82 TYR H A 82 TYR HE% 1.0 . 4.75 2061 1928 A 97 ASN HD2y A 82 TYR HE% 1.0 . 3.88 2062 1929 A 96 ASN HA A 82 TYR HE% 1.0 . 3.39 2063 1930 A 82 TYR HE% A 97 ASN HA 1.0 . 3.73 2064 1931 A 82 TYR HE% A 77 GLU HBx 1.0 . 2.64 2065 1932 A 24 LYS H A 26 TYR HE% 1.0 . 4.42 2066 1933 A 26 TYR HE% A 31 SER HBx 1.0 . 4.27 2067 1934 A 16 ILE HG1x A 26 TYR HE% 1.0 . 3.37 2068 1935 A 26 TYR HE% A 16 ILE HD1% 1.0 . 2.82 2069 1936 A 26 TYR HE% A 102 ILE HD1% 1.0 . 3.77 2070 1937 A 35 ILE HD1% A 26 TYR HE% 1.0 . 3.51 2071 1938 A 16 ILE H A 26 TYR HE% 1.0 . 3.52 2072 1939 A 26 TYR HE% A 24 LYS HBx 1.0 . 2.94 2073 1940 A 82 TYR HE% A 82 TYR HA 1.0 . 4.76 2074 1941 A 26 TYR HE% A 24 LYS HGy 1.0 . 4.78 2075 1942 A 26 TYR HE% A 16 ILE HG2% 1.0 . 4.04 2076 1943 A 92 TYR H A 92 TYR HE% 1.0 . 4.20 2077 1944 A 92 TYR HE% A 3 PRO HBy 1.0 . 3.97 2078 1945 A 44 ARG HGx A 92 TYR HE% 1.0 . 3.65 2079 1946 A 92 TYR HE% A 3 PRO HGx 1.0 . 3.85 2080 1946 A 92 TYR HE% A 3 PRO HGy 1.0 . 3.85 2081 1947 A 44 ARG H A 92 TYR HE% 1.0 . 3.80 2082 1948 A 92 TYR HE% A 90 GLY HAx 1.0 . 3.60 2083 1949 A 92 TYR HE% A 44 ARG HBx 1.0 . 2.80 2084 1949 A 44 ARG HBy A 92 TYR HE% 1.0 . 2.80 2085 1950 A 53 TYR HE% A 52 ASP HBx 1.0 . 3.28 2086 1950 A 52 ASP HBy A 53 TYR HE% 1.0 . 3.28 2087 1951 A 78 GLU HA A 83 TYR HE% 1.0 . 4.44 2088 1952 A 78 GLU H A 83 TYR HE% 1.0 . 3.31 2089 1953 A 81 LYS H A 83 TYR HE% 1.0 . 3.80 2090 1954 A 83 TYR HE% A 93 GLU HGx 1.0 . 2.61 2091 1955 A 93 GLU HBx A 83 TYR HE% 1.0 . 2.94 2092 1956 A 81 LYS HBx A 83 TYR HE% 1.0 . 3.06 2093 1957 A 82 TYR H A 83 TYR HE% 1.0 . 4.70 2094 1958 A 77 GLU HA A 83 TYR HE% 1.0 . 4.55 2095 1959 A 83 TYR HE% A 81 LYS HA 1.0 . 4.59 stop_ save_