data_nef_c17879_2li5 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2KWC stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 0 HIS start . . 2 A 1 MET middle . . 3 A 2 LYS middle . . 4 A 3 SER middle . . 5 A 4 THR middle . . 6 A 5 PHE middle . . 7 A 6 LYS middle . . 8 A 7 SER middle . . 9 A 8 GLU middle . . 10 A 9 TYR middle . . 11 A 10 PRO middle . false 12 A 11 PHE middle . . 13 A 12 GLU middle . . 14 A 13 LYS middle . . 15 A 14 ARG middle . . 16 A 15 LYS middle . . 17 A 16 ALA middle . . 18 A 17 GLU middle . . 19 A 18 SER middle . . 20 A 19 GLU middle . . 21 A 20 ARG middle . . 22 A 21 ILE middle . . 23 A 22 ALA middle . . 24 A 23 ASP middle . . 25 A 24 ARG middle . . 26 A 25 PHE middle . . 27 A 26 PRO middle . false 28 A 27 ASN middle . . 29 A 28 ARG middle . . 30 A 29 ILE middle . . 31 A 30 PRO middle . false 32 A 31 VAL middle . . 33 A 32 ILE middle . . 34 A 33 CYS middle . . 35 A 34 GLU middle . . 36 A 35 LYS middle . . 37 A 36 ALA middle . . 38 A 37 GLU middle . . 39 A 38 LYS middle . . 40 A 39 SER middle . . 41 A 40 ASP middle . . 42 A 41 ILE middle . . 43 A 42 PRO middle . false 44 A 43 GLU middle . . 45 A 44 ILE middle . . 46 A 45 ASP middle . . 47 A 46 LYS middle . . 48 A 47 ARG middle . . 49 A 48 LYS middle . . 50 A 49 TYR middle . . 51 A 50 LEU middle . . 52 A 51 VAL middle . . 53 A 52 PRO middle . false 54 A 53 ALA middle . . 55 A 54 ASP middle . . 56 A 55 LEU middle . . 57 A 56 THR middle . . 58 A 57 VAL middle . . 59 A 58 GLY middle . false 60 A 59 GLN middle . . 61 A 60 PHE middle . . 62 A 61 VAL middle . . 63 A 62 TYR middle . . 64 A 63 VAL middle . . 65 A 64 ILE middle . . 66 A 65 ARG middle . . 67 A 66 LYS middle . . 68 A 67 ARG middle . . 69 A 68 ILE middle . . 70 A 69 MET middle . . 71 A 70 LEU middle . . 72 A 71 PRO middle . false 73 A 72 PRO middle . false 74 A 73 GLU middle . . 75 A 74 LYS middle . . 76 A 75 ALA middle . . 77 A 76 ILE middle . . 78 A 77 PHE middle . . 79 A 78 ILE middle . . 80 A 79 PHE middle . . 81 A 80 VAL middle . . 82 A 81 ASN middle . . 83 A 82 ASP middle . . 84 A 83 THR middle . . 85 A 84 LEU middle . . 86 A 85 PRO middle . false 87 A 86 PRO middle . false 88 A 87 THR middle . . 89 A 88 ALA middle . . 90 A 89 ALA middle . . 91 A 90 LEU middle . . 92 A 91 MET middle . . 93 A 92 SER middle . . 94 A 93 ALA middle . . 95 A 94 ILE middle . . 96 A 95 TYR middle . . 97 A 96 GLN middle . . 98 A 97 GLU middle . . 99 A 98 HIS middle . . 100 A 99 LYS middle . . 101 A 100 ASP middle . . 102 A 101 LYS middle . . 103 A 102 ASP middle . . 104 A 103 GLY middle . false 105 A 104 PHE middle . . 106 A 105 LEU middle . . 107 A 106 TYR middle . . 108 A 107 VAL middle . . 109 A 108 THR middle . . 110 A 109 TYR middle . . 111 A 110 SER middle . . 112 A 111 GLY middle . false 113 A 112 GLU middle . . 114 A 113 ASN middle . . 115 A 114 THR middle . . 116 A 115 PHE middle . . 117 A 116 GLY end . false 118 B 597 GLY start . false 119 B 598 PRO middle . false 120 B 599 HIS middle . . 121 B 600 MET middle . . 122 B 601 ILE middle . . 123 B 602 SER middle . . 124 B 603 GLY middle . false 125 B 604 LEU middle . . 126 B 605 SER middle . . 127 B 606 VAL middle . . 128 B 607 ILE middle . . 129 B 608 LYS middle . . 130 B 609 GLN middle . . 131 B 610 GLU middle . . 132 B 611 VAL middle . . 133 B 612 GLU middle . . 134 B 613 ARG middle . . 135 B 614 LEU middle . . 136 B 615 GLY middle . false 137 B 616 ASN middle . . 138 B 617 ASP middle . . 139 B 618 VAL middle . . 140 B 619 PHE middle . . 141 B 620 GLU middle . . 142 B 621 TRP middle . . 143 B 622 GLU middle . . 144 B 623 ASP middle . . 145 B 624 ASP middle . . 146 B 625 GLU middle . . 147 B 626 SER middle . . 148 B 627 ASP middle . . 149 B 628 GLU middle . . 150 B 629 ILE middle . . 151 B 630 ALA 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 0 HIS H1 H 1 8.616 0.000 A 0 HIS HA H 1 4.671 0.000 A 0 HIS HBx H 1 3.127 0.000 A 0 HIS HBy H 1 3.188 0.000 A 0 HIS HD2 H 1 7.130 0.000 A 0 HIS HE1 H 1 8.182 0.000 A 0 HIS C C 13 174.844 0.000 A 0 HIS CA C 13 55.841 0.000 A 0 HIS CB C 13 30.002 0.018 A 0 HIS CD2 C 13 120.019 0.000 A 0 HIS CE1 C 13 137.568 0.000 A 0 HIS N N 15 119.515 0.000 A 1 MET H H 1 8.425 0.000 A 1 MET HA H 1 4.455 0.000 A 1 MET HBx H 1 1.992 0.000 A 1 MET HBy H 1 2.055 0.000 A 1 MET HE% H 1 2.069 0.000 A 1 MET HGx H 1 2.494 0.000 A 1 MET HGy H 1 2.540 0.000 A 1 MET C C 13 175.655 0.000 A 1 MET CA C 13 55.438 0.000 A 1 MET CB C 13 33.126 0.001 A 1 MET CE C 13 17.180 0.000 A 1 MET CG C 13 31.944 0.001 A 1 MET N N 15 122.410 0.000 A 2 LYS H H 1 8.512 0.000 A 2 LYS HA H 1 4.326 0.000 A 2 LYS HBy H 1 1.847 0.000 A 2 LYS HBx H 1 1.774 0.000 A 2 LYS HDx H 1 1.705 0.000 A 2 LYS HDy H 1 1.705 0.000 A 2 LYS HEx H 1 3.017 0.000 A 2 LYS HEy H 1 3.017 0.000 A 2 LYS HGx H 1 1.430 0.000 A 2 LYS HGy H 1 1.461 0.000 A 2 LYS C C 13 176.266 0.000 A 2 LYS CA C 13 56.348 0.000 A 2 LYS CB C 13 33.219 0.000 A 2 LYS CD C 13 29.216 0.000 A 2 LYS CE C 13 42.125 0.000 A 2 LYS CG C 13 24.711 0.002 A 2 LYS N N 15 123.656 0.000 A 3 SER H H 1 8.426 0.000 A 3 SER HA H 1 4.631 0.000 A 3 SER HBy H 1 3.883 0.000 A 3 SER HBx H 1 3.729 0.000 A 3 SER C C 13 175.421 0.000 A 3 SER CA C 13 57.629 0.000 A 3 SER CB C 13 64.079 0.004 A 3 SER N N 15 118.350 0.000 A 4 THR H H 1 9.971 0.000 A 4 THR HA H 1 4.482 0.000 A 4 THR HB H 1 4.823 0.000 A 4 THR HG2% H 1 1.307 0.000 A 4 THR C C 13 174.680 0.000 A 4 THR CA C 13 62.001 0.000 A 4 THR CB C 13 70.137 0.000 A 4 THR CG2 C 13 22.189 0.000 A 4 THR N N 15 127.775 0.000 A 5 PHE H H 1 8.863 0.000 A 5 PHE HA H 1 4.125 0.000 A 5 PHE HBx H 1 2.985 0.000 A 5 PHE HBy H 1 3.175 0.000 A 5 PHE HDx H 1 7.364 0.004 A 5 PHE HDy H 1 7.364 0.004 A 5 PHE HEx H 1 6.557 0.000 A 5 PHE HEy H 1 6.557 0.000 A 5 PHE HZ H 1 6.383 0.000 A 5 PHE C C 13 177.064 0.000 A 5 PHE CA C 13 63.041 0.000 A 5 PHE CB C 13 40.828 0.008 A 5 PHE CDx C 13 132.232 0.000 A 5 PHE CEx C 13 131.247 0.000 A 5 PHE CZ C 13 128.799 0.000 A 5 PHE N N 15 123.021 0.000 A 6 LYS H H 1 8.661 0.000 A 6 LYS HA H 1 3.916 0.000 A 6 LYS HBx H 1 1.692 0.000 A 6 LYS HBy H 1 1.786 0.000 A 6 LYS HDx H 1 1.377 0.000 A 6 LYS HDy H 1 1.524 0.000 A 6 LYS HEx H 1 2.086 0.000 A 6 LYS HEy H 1 2.593 0.000 A 6 LYS HGx H 1 1.365 0.000 A 6 LYS HGy H 1 1.703 0.000 A 6 LYS C C 13 177.535 0.000 A 6 LYS CA C 13 60.026 0.000 A 6 LYS CB C 13 33.611 0.003 A 6 LYS CD C 13 30.562 0.006 A 6 LYS CE C 13 41.700 0.001 A 6 LYS CG C 13 26.731 0.015 A 6 LYS N N 15 114.006 0.000 A 7 SER H H 1 7.552 0.000 A 7 SER HA H 1 4.275 0.000 A 7 SER HBx H 1 3.851 0.000 A 7 SER HBy H 1 3.971 0.000 A 7 SER C C 13 175.689 0.000 A 7 SER CA C 13 60.007 0.000 A 7 SER CB C 13 63.759 0.003 A 7 SER N N 15 111.149 0.000 A 8 GLU H H 1 7.924 0.000 A 8 GLU HA H 1 3.818 0.000 A 8 GLU HBx H 1 1.300 0.000 A 8 GLU HBy H 1 1.703 0.000 A 8 GLU HGx H 1 1.633 0.000 A 8 GLU HGy H 1 1.982 0.000 A 8 GLU C C 13 176.068 0.000 A 8 GLU CA C 13 58.137 0.000 A 8 GLU CB C 13 30.965 0.004 A 8 GLU CG C 13 36.287 0.002 A 8 GLU N N 15 122.296 0.000 A 9 TYR H H 1 7.052 0.000 A 9 TYR HA H 1 5.066 0.000 A 9 TYR HBx H 1 2.035 0.000 A 9 TYR HBy H 1 2.546 0.000 A 9 TYR HDx H 1 6.551 0.000 A 9 TYR HDy H 1 6.551 0.000 A 9 TYR HEx H 1 6.730 0.000 A 9 TYR HEy H 1 6.730 0.000 A 9 TYR CA C 13 53.958 0.000 A 9 TYR CB C 13 41.055 0.047 A 9 TYR CDy C 13 133.697 0.000 A 9 TYR CEy C 13 118.410 0.000 A 9 TYR N N 15 115.131 0.000 A 10 PRO HA H 1 4.708 0.000 A 10 PRO HBy H 1 2.620 0.000 A 10 PRO HBx H 1 2.160 0.000 A 10 PRO HDx H 1 3.699 0.000 A 10 PRO HDy H 1 4.069 0.000 A 10 PRO HGx H 1 2.101 0.000 A 10 PRO HGy H 1 2.237 0.000 A 10 PRO C C 13 177.384 0.000 A 10 PRO CA C 13 62.279 0.000 A 10 PRO CB C 13 33.087 0.004 A 10 PRO CD C 13 51.233 0.002 A 10 PRO CG C 13 27.764 0.003 A 11 PHE H H 1 9.385 0.000 A 11 PHE HA H 1 3.883 0.000 A 11 PHE HBx H 1 3.017 0.000 A 11 PHE HBy H 1 3.466 0.000 A 11 PHE HDx H 1 7.340 0.001 A 11 PHE HDy H 1 7.340 0.001 A 11 PHE HEx H 1 7.255 0.000 A 11 PHE HEy H 1 7.255 0.000 A 11 PHE HZ H 1 7.159 0.000 A 11 PHE C C 13 176.157 0.000 A 11 PHE CA C 13 63.156 0.000 A 11 PHE CB C 13 39.935 0.003 A 11 PHE CDx C 13 132.334 0.000 A 11 PHE CEx C 13 131.215 0.000 A 11 PHE CZ C 13 129.501 0.000 A 11 PHE N N 15 125.307 0.000 A 12 GLU H H 1 9.800 0.000 A 12 GLU HA H 1 3.857 0.000 A 12 GLU HBx H 1 2.119 0.000 A 12 GLU HBy H 1 2.119 0.000 A 12 GLU HGx H 1 2.494 0.000 A 12 GLU HGy H 1 2.537 0.000 A 12 GLU C C 13 179.598 0.000 A 12 GLU CA C 13 60.317 0.000 A 12 GLU CB C 13 28.642 0.000 A 12 GLU CG C 13 36.817 0.000 A 12 GLU N N 15 115.356 0.000 A 13 LYS H H 1 7.160 0.000 A 13 LYS HA H 1 4.246 0.000 A 13 LYS HBx H 1 1.886 0.000 A 13 LYS HBy H 1 1.986 0.000 A 13 LYS HDx H 1 1.772 0.000 A 13 LYS HDy H 1 1.772 0.000 A 13 LYS HEx H 1 3.014 0.000 A 13 LYS HEy H 1 3.014 0.000 A 13 LYS HGx H 1 1.509 0.000 A 13 LYS HGy H 1 1.632 0.000 A 13 LYS C C 13 178.804 0.000 A 13 LYS CA C 13 58.143 0.000 A 13 LYS CB C 13 32.770 0.001 A 13 LYS CD C 13 29.128 0.000 A 13 LYS CE C 13 42.030 0.000 A 13 LYS CG C 13 25.383 0.007 A 13 LYS N N 15 118.194 0.000 A 14 ARG H H 1 7.686 0.000 A 14 ARG HA H 1 3.892 0.000 A 14 ARG HBx H 1 2.078 0.000 A 14 ARG HBy H 1 2.078 0.000 A 14 ARG C C 13 176.858 0.000 A 14 ARG CA C 13 61.520 0.000 A 14 ARG CB C 13 32.840 0.000 A 14 ARG N N 15 120.949 0.000 A 15 LYS H H 1 8.667 0.000 A 15 LYS HA H 1 4.449 0.000 A 15 LYS HBx H 1 0.924 0.000 A 15 LYS HBy H 1 1.530 0.000 A 15 LYS HDx H 1 1.617 0.000 A 15 LYS HDy H 1 1.704 0.000 A 15 LYS HEx H 1 3.036 0.000 A 15 LYS HEy H 1 3.092 0.000 A 15 LYS HGx H 1 1.320 0.000 A 15 LYS HGy H 1 1.365 0.000 A 15 LYS C C 13 177.796 0.000 A 15 LYS CA C 13 57.366 0.000 A 15 LYS CB C 13 32.529 0.002 A 15 LYS CD C 13 29.409 0.004 A 15 LYS CE C 13 42.605 0.005 A 15 LYS CG C 13 24.407 0.000 A 15 LYS N N 15 119.224 0.000 A 16 ALA H H 1 7.305 0.000 A 16 ALA HA H 1 4.164 0.000 A 16 ALA HB% H 1 1.538 0.000 A 16 ALA C C 13 180.641 0.000 A 16 ALA CA C 13 54.627 0.000 A 16 ALA CB C 13 18.114 0.000 A 16 ALA N N 15 117.777 0.000 A 17 GLU H H 1 7.849 0.000 A 17 GLU HA H 1 4.695 0.000 A 17 GLU HBx H 1 2.244 0.000 A 17 GLU HBy H 1 2.361 0.000 A 17 GLU HGx H 1 2.454 0.000 A 17 GLU HGy H 1 2.454 0.000 A 17 GLU C C 13 178.339 0.000 A 17 GLU CA C 13 58.173 0.000 A 17 GLU CB C 13 28.765 0.013 A 17 GLU CG C 13 35.594 0.000 A 17 GLU N N 15 119.934 0.000 A 18 SER H H 1 8.785 0.000 A 18 SER HA H 1 3.542 0.000 A 18 SER HBx H 1 3.020 0.000 A 18 SER HBy H 1 3.297 0.000 A 18 SER HG H 1 6.435 0.000 A 18 SER C C 13 178.206 0.000 A 18 SER CA C 13 62.108 0.000 A 18 SER CB C 13 59.839 0.002 A 18 SER N N 15 117.685 0.000 A 19 GLU H H 1 8.052 0.000 A 19 GLU HA H 1 3.988 0.000 A 19 GLU HBx H 1 1.981 0.000 A 19 GLU HBy H 1 2.191 0.000 A 19 GLU HGx H 1 2.201 0.000 A 19 GLU HGy H 1 2.566 0.000 A 19 GLU C C 13 178.788 0.000 A 19 GLU CA C 13 59.701 0.000 A 19 GLU CB C 13 29.318 0.009 A 19 GLU CG C 13 36.996 0.004 A 19 GLU N N 15 124.346 0.000 A 20 ARG H H 1 7.958 0.000 A 20 ARG HA H 1 4.093 0.000 A 20 ARG HBx H 1 2.016 0.000 A 20 ARG HBy H 1 2.177 0.000 A 20 ARG HDx H 1 3.092 0.000 A 20 ARG HDy H 1 3.432 0.000 A 20 ARG HE H 1 8.217 0.000 A 20 ARG HGx H 1 1.415 0.000 A 20 ARG HGy H 1 1.756 0.000 A 20 ARG C C 13 179.458 0.000 A 20 ARG CA C 13 59.500 0.000 A 20 ARG CB C 13 30.412 0.005 A 20 ARG CD C 13 43.030 0.012 A 20 ARG CG C 13 27.530 0.000 A 20 ARG CZ C 13 160.022 0.000 A 20 ARG N N 15 122.089 0.000 A 20 ARG NE N 15 83.558 0.000 A 21 ILE H H 1 8.277 0.000 A 21 ILE HA H 1 3.623 0.000 A 21 ILE HB H 1 1.738 0.000 A 21 ILE HD1% H 1 0.740 0.000 A 21 ILE HG1x H 1 1.016 0.000 A 21 ILE HG1y H 1 1.752 0.000 A 21 ILE HG2% H 1 0.800 0.000 A 21 ILE C C 13 176.842 0.000 A 21 ILE CA C 13 65.145 0.000 A 21 ILE CB C 13 38.195 0.000 A 21 ILE CD1 C 13 14.221 0.000 A 21 ILE CG1 C 13 29.619 0.000 A 21 ILE CG2 C 13 17.801 0.000 A 21 ILE N N 15 119.893 0.000 A 22 ALA H H 1 7.962 0.000 A 22 ALA HA H 1 4.071 0.000 A 22 ALA HB% H 1 1.459 0.000 A 22 ALA C C 13 179.199 0.000 A 22 ALA CA C 13 54.519 0.000 A 22 ALA CB C 13 18.001 0.000 A 22 ALA N N 15 121.816 0.000 A 23 ASP H H 1 7.368 0.000 A 23 ASP HA H 1 4.401 0.000 A 23 ASP HBx H 1 2.669 0.000 A 23 ASP HBy H 1 2.717 0.000 A 23 ASP C C 13 177.324 0.000 A 23 ASP CA C 13 56.248 0.000 A 23 ASP CB C 13 42.193 0.000 A 23 ASP N N 15 114.866 0.000 A 24 ARG H H 1 7.815 0.000 A 24 ARG HA H 1 3.922 0.000 A 24 ARG HBx H 1 1.167 0.000 A 24 ARG HBy H 1 1.489 0.000 A 24 ARG HDx H 1 2.929 0.000 A 24 ARG HDy H 1 3.009 0.000 A 24 ARG HE H 1 7.130 0.000 A 24 ARG HGx H 1 1.122 0.000 A 24 ARG HGy H 1 1.184 0.000 A 24 ARG C C 13 176.266 0.000 A 24 ARG CA C 13 57.158 0.000 A 24 ARG CB C 13 31.477 0.001 A 24 ARG CD C 13 42.799 0.001 A 24 ARG CG C 13 26.849 0.005 A 24 ARG CZ C 13 159.504 0.000 A 24 ARG N N 15 116.868 0.000 A 24 ARG NE N 15 84.763 0.000 A 25 PHE H H 1 8.658 0.000 A 25 PHE HA H 1 5.084 0.000 A 25 PHE HBx H 1 2.727 0.000 A 25 PHE HBy H 1 2.935 0.000 A 25 PHE HDx H 1 7.185 0.002 A 25 PHE HDy H 1 7.185 0.002 A 25 PHE HEx H 1 7.248 0.000 A 25 PHE HEy H 1 7.248 0.000 A 25 PHE HZ H 1 7.206 0.000 A 25 PHE CA C 13 54.304 0.000 A 25 PHE CB C 13 39.026 0.019 A 25 PHE CDy C 13 132.591 0.000 A 25 PHE CEy C 13 131.393 0.000 A 25 PHE CZ C 13 129.767 0.000 A 25 PHE N N 15 116.737 0.000 A 26 PRO HA H 1 4.503 0.000 A 26 PRO HBy H 1 2.413 0.000 A 26 PRO HBx H 1 1.901 0.000 A 26 PRO HDx H 1 3.270 0.000 A 26 PRO HDy H 1 3.587 0.000 A 26 PRO HGx H 1 1.913 0.000 A 26 PRO HGy H 1 2.008 0.000 A 26 PRO C C 13 177.538 0.000 A 26 PRO CA C 13 64.394 0.000 A 26 PRO CB C 13 31.961 0.010 A 26 PRO CD C 13 50.166 0.006 A 26 PRO CG C 13 27.331 0.008 A 27 ASN H H 1 8.537 0.000 A 27 ASN HA H 1 4.725 0.000 A 27 ASN HBx H 1 2.933 0.000 A 27 ASN HBy H 1 2.966 0.000 A 27 ASN HD2y H 1 7.615 0.001 A 27 ASN HD2x H 1 6.998 0.001 A 27 ASN C C 13 174.678 0.000 A 27 ASN CA C 13 52.868 0.000 A 27 ASN CB C 13 38.331 0.002 A 27 ASN CG C 13 178.019 0.016 A 27 ASN N N 15 114.596 0.000 A 27 ASN ND2 N 15 113.142 0.000 A 28 ARG H H 1 7.580 0.000 A 28 ARG HA H 1 4.769 0.000 A 28 ARG HBx H 1 0.958 0.000 A 28 ARG HBy H 1 1.616 0.000 A 28 ARG HDx H 1 2.493 0.000 A 28 ARG HDy H 1 2.752 0.000 A 28 ARG HE H 1 7.244 0.000 A 28 ARG HGx H 1 1.383 0.000 A 28 ARG HGy H 1 1.383 0.000 A 28 ARG C C 13 174.469 0.000 A 28 ARG CA C 13 52.948 0.000 A 28 ARG CB C 13 32.941 0.003 A 28 ARG CD C 13 42.515 0.002 A 28 ARG CG C 13 27.467 0.000 A 28 ARG CZ C 13 159.507 0.000 A 28 ARG N N 15 116.946 0.000 A 28 ARG NE N 15 83.717 0.000 A 29 ILE H H 1 9.262 0.000 A 29 ILE HA H 1 4.098 0.000 A 29 ILE HB H 1 1.442 0.000 A 29 ILE HD1% H 1 0.329 0.000 A 29 ILE HG1x H 1 0.875 0.000 A 29 ILE HG1y H 1 0.934 0.000 A 29 ILE HG2% H 1 0.236 0.000 A 29 ILE CA C 13 55.558 0.000 A 29 ILE CB C 13 38.805 0.000 A 29 ILE CD1 C 13 11.752 0.000 A 29 ILE CG1 C 13 26.676 0.001 A 29 ILE CG2 C 13 17.009 0.000 A 29 ILE N N 15 121.854 0.000 A 30 PRO HA H 1 4.856 0.000 A 30 PRO HBy H 1 1.896 0.000 A 30 PRO HBx H 1 1.434 0.000 A 30 PRO HDx H 1 3.235 0.000 A 30 PRO HDy H 1 3.429 0.000 A 30 PRO HGx H 1 1.691 0.000 A 30 PRO HGy H 1 2.445 0.000 A 30 PRO C C 13 174.121 0.000 A 30 PRO CA C 13 61.705 0.000 A 30 PRO CB C 13 30.966 0.004 A 30 PRO CD C 13 50.226 0.004 A 30 PRO CG C 13 26.815 0.002 A 31 VAL H H 1 9.096 0.000 A 31 VAL HA H 1 4.997 0.000 A 31 VAL HB H 1 1.900 0.000 A 31 VAL HGx% H 1 0.599 0.000 A 31 VAL HGy% H 1 0.705 0.000 A 31 VAL C C 13 174.181 0.000 A 31 VAL CA C 13 60.620 0.000 A 31 VAL CB C 13 35.645 0.000 A 31 VAL CGy C 13 23.008 0.000 A 31 VAL CGx C 13 22.020 0.000 A 31 VAL N N 15 127.197 0.000 A 32 ILE H H 1 8.775 0.000 A 32 ILE HA H 1 4.917 0.000 A 32 ILE HB H 1 1.456 0.000 A 32 ILE HD1% H 1 -0.811 0.000 A 32 ILE HG1x H 1 -0.106 0.000 A 32 ILE HG1y H 1 0.493 0.000 A 32 ILE HG2% H 1 0.544 0.000 A 32 ILE C C 13 174.991 0.000 A 32 ILE CA C 13 56.589 0.000 A 32 ILE CB C 13 35.908 0.000 A 32 ILE CD1 C 13 7.541 0.000 A 32 ILE CG1 C 13 25.337 0.005 A 32 ILE CG2 C 13 16.810 0.000 A 32 ILE N N 15 127.157 0.000 A 33 CYS H H 1 9.738 0.000 A 33 CYS HA H 1 5.559 0.000 A 33 CYS HBx H 1 2.434 0.000 A 33 CYS HBy H 1 3.163 0.000 A 33 CYS HG H 1 1.379 0.000 A 33 CYS C C 13 173.218 0.000 A 33 CYS CA C 13 57.121 0.000 A 33 CYS CB C 13 28.880 0.001 A 33 CYS N N 15 129.280 0.000 A 34 GLU H H 1 8.531 0.000 A 34 GLU HA H 1 4.977 0.000 A 34 GLU HBx H 1 2.071 0.000 A 34 GLU HBy H 1 2.310 0.000 A 34 GLU HGx H 1 2.346 0.000 A 34 GLU HGy H 1 2.346 0.000 A 34 GLU C C 13 174.190 0.000 A 34 GLU CA C 13 54.308 0.000 A 34 GLU CB C 13 35.281 0.003 A 34 GLU CG C 13 38.721 0.000 A 34 GLU N N 15 124.130 0.000 A 35 LYS H H 1 8.949 0.000 A 35 LYS HA H 1 3.056 0.000 A 35 LYS HBx H 1 1.556 0.000 A 35 LYS HBy H 1 1.649 0.000 A 35 LYS HDx H 1 1.456 0.000 A 35 LYS HDy H 1 1.767 0.000 A 35 LYS HEx H 1 3.129 0.000 A 35 LYS HEy H 1 3.129 0.000 A 35 LYS HGx H 1 0.912 0.000 A 35 LYS HGy H 1 1.528 0.000 A 35 LYS C C 13 177.452 0.000 A 35 LYS CA C 13 56.374 0.000 A 35 LYS CB C 13 32.750 0.001 A 35 LYS CD C 13 29.184 0.008 A 35 LYS CE C 13 42.322 0.000 A 35 LYS CG C 13 22.780 0.001 A 35 LYS N N 15 123.562 0.000 A 36 ALA H H 1 8.561 0.000 A 36 ALA HA H 1 4.163 0.000 A 36 ALA HB% H 1 1.335 0.000 A 36 ALA C C 13 178.375 0.000 A 36 ALA CA C 13 52.702 0.000 A 36 ALA CB C 13 18.673 0.000 A 36 ALA N N 15 129.494 0.000 A 37 GLU H H 1 8.648 0.000 A 37 GLU HA H 1 3.959 0.000 A 37 GLU HBx H 1 1.976 0.000 A 37 GLU HBy H 1 2.090 0.000 A 37 GLU HGx H 1 2.224 0.000 A 37 GLU HGy H 1 2.332 0.000 A 37 GLU C C 13 177.516 0.000 A 37 GLU CA C 13 59.302 0.000 A 37 GLU CB C 13 30.154 0.001 A 37 GLU CG C 13 36.102 0.004 A 37 GLU N N 15 125.115 0.000 A 38 LYS H H 1 8.494 0.000 A 38 LYS HA H 1 4.188 0.000 A 38 LYS HBy H 1 1.933 0.000 A 38 LYS HBx H 1 1.726 0.000 A 38 LYS HDx H 1 1.583 0.000 A 38 LYS HDy H 1 1.626 0.000 A 38 LYS HEx H 1 2.931 0.000 A 38 LYS HEy H 1 2.931 0.000 A 38 LYS HGy H 1 1.376 0.000 A 38 LYS HGx H 1 1.345 0.000 A 38 LYS C C 13 176.244 0.000 A 38 LYS CA C 13 56.564 0.000 A 38 LYS CB C 13 31.484 0.003 A 38 LYS CD C 13 28.992 0.003 A 38 LYS CE C 13 42.108 0.000 A 38 LYS CG C 13 25.406 0.006 A 38 LYS N N 15 115.020 0.000 A 39 SER H H 1 7.346 0.000 A 39 SER HA H 1 4.535 0.000 A 39 SER HBx H 1 3.726 0.000 A 39 SER HBy H 1 4.076 0.000 A 39 SER C C 13 174.896 0.000 A 39 SER CA C 13 57.985 0.000 A 39 SER CB C 13 65.000 0.016 A 39 SER N N 15 113.091 0.000 A 40 ASP H H 1 8.744 0.000 A 40 ASP HA H 1 4.782 0.000 A 40 ASP HBx H 1 2.759 0.000 A 40 ASP HBy H 1 2.759 0.000 A 40 ASP C C 13 175.205 0.000 A 40 ASP CA C 13 53.549 0.000 A 40 ASP CB C 13 39.916 0.000 A 40 ASP N N 15 127.375 0.000 A 41 ILE H H 1 7.649 0.000 A 41 ILE HA H 1 4.661 0.000 A 41 ILE HB H 1 1.966 0.000 A 41 ILE HD1% H 1 1.004 0.000 A 41 ILE HG1x H 1 1.455 0.000 A 41 ILE HG1y H 1 1.730 0.000 A 41 ILE HG2% H 1 0.978 0.000 A 41 ILE CA C 13 59.133 0.000 A 41 ILE CB C 13 40.534 0.000 A 41 ILE CD1 C 13 14.968 0.000 A 41 ILE CG1 C 13 28.617 0.004 A 41 ILE CG2 C 13 18.006 0.000 A 41 ILE N N 15 122.943 0.000 A 42 PRO HA H 1 4.414 0.000 A 42 PRO HBy H 1 2.488 0.000 A 42 PRO HBx H 1 1.810 0.000 A 42 PRO HDx H 1 3.398 0.000 A 42 PRO HDy H 1 4.004 0.000 A 42 PRO HGx H 1 1.984 0.000 A 42 PRO HGy H 1 2.066 0.000 A 42 PRO C C 13 175.952 0.000 A 42 PRO CA C 13 63.829 0.000 A 42 PRO CB C 13 32.895 0.006 A 42 PRO CD C 13 51.880 0.001 A 42 PRO CG C 13 28.034 0.004 A 43 GLU H H 1 8.393 0.000 A 43 GLU HA H 1 4.298 0.000 A 43 GLU HBx H 1 1.941 0.000 A 43 GLU HBy H 1 2.112 0.000 A 43 GLU HGx H 1 2.408 0.000 A 43 GLU HGy H 1 2.408 0.000 A 43 GLU C C 13 175.316 0.000 A 43 GLU CA C 13 56.400 0.000 A 43 GLU CB C 13 31.282 0.005 A 43 GLU CG C 13 36.524 0.000 A 43 GLU N N 15 120.369 0.000 A 44 ILE H H 1 8.067 0.000 A 44 ILE HA H 1 4.419 0.000 A 44 ILE HB H 1 1.892 0.000 A 44 ILE HD1% H 1 0.839 0.000 A 44 ILE HG1y H 1 1.500 0.000 A 44 ILE HG1x H 1 1.444 0.000 A 44 ILE HG2% H 1 1.049 0.000 A 44 ILE C C 13 174.786 0.000 A 44 ILE CA C 13 61.027 0.000 A 44 ILE CB C 13 40.509 0.000 A 44 ILE CD1 C 13 15.590 0.000 A 44 ILE CG1 C 13 28.669 0.002 A 44 ILE CG2 C 13 16.568 0.000 A 44 ILE N N 15 123.670 0.000 A 45 ASP H H 1 8.468 0.000 A 45 ASP HA H 1 4.412 0.000 A 45 ASP HBx H 1 2.765 0.000 A 45 ASP HBy H 1 2.765 0.000 A 45 ASP C C 13 175.494 0.000 A 45 ASP CA C 13 55.467 0.000 A 45 ASP CB C 13 40.320 0.000 A 45 ASP N N 15 123.340 0.000 A 46 LYS H H 1 7.319 0.000 A 46 LYS HA H 1 4.428 0.000 A 46 LYS HBx H 1 1.612 0.000 A 46 LYS HBy H 1 1.612 0.000 A 46 LYS HDx H 1 1.378 0.000 A 46 LYS HDy H 1 1.457 0.000 A 46 LYS HEx H 1 2.579 0.000 A 46 LYS HEy H 1 2.755 0.000 A 46 LYS HGx H 1 0.655 0.000 A 46 LYS HGy H 1 1.215 0.000 A 46 LYS CA C 13 56.020 0.000 A 46 LYS CB C 13 34.644 0.000 A 46 LYS CD C 13 29.503 0.001 A 46 LYS CE C 13 42.277 0.000 A 46 LYS CG C 13 24.595 0.006 A 46 LYS N N 15 121.295 0.000 A 47 ARG H H 1 8.558 0.000 A 47 ARG HA H 1 5.271 0.000 A 47 ARG HBx H 1 1.911 0.000 A 47 ARG HBy H 1 2.071 0.000 A 47 ARG HDx H 1 3.241 0.000 A 47 ARG HDy H 1 3.400 0.000 A 47 ARG HGx H 1 1.543 0.000 A 47 ARG HGy H 1 1.857 0.000 A 47 ARG C C 13 173.546 0.000 A 47 ARG CA C 13 55.581 0.000 A 47 ARG CB C 13 32.992 0.004 A 47 ARG CD C 13 44.992 0.005 A 47 ARG CG C 13 25.725 0.018 A 47 ARG N N 15 124.949 0.000 A 48 LYS H H 1 7.440 0.000 A 48 LYS HA H 1 5.030 0.000 A 48 LYS HBx H 1 1.088 0.000 A 48 LYS HBy H 1 1.122 0.000 A 48 LYS HDx H 1 1.422 0.000 A 48 LYS HDy H 1 1.592 0.000 A 48 LYS HEx H 1 2.679 0.000 A 48 LYS HEy H 1 2.679 0.000 A 48 LYS HGx H 1 0.818 0.000 A 48 LYS HGy H 1 1.120 0.000 A 48 LYS C C 13 174.301 0.000 A 48 LYS CA C 13 55.042 0.000 A 48 LYS CB C 13 34.065 0.000 A 48 LYS CD C 13 30.498 0.000 A 48 LYS CE C 13 41.445 0.000 A 48 LYS CG C 13 24.251 0.019 A 48 LYS N N 15 122.812 0.000 A 49 TYR H H 1 9.590 0.000 A 49 TYR HA H 1 4.721 0.000 A 49 TYR HBx H 1 2.661 0.000 A 49 TYR HBy H 1 2.929 0.000 A 49 TYR HDx H 1 7.030 0.004 A 49 TYR HDy H 1 7.030 0.004 A 49 TYR HEx H 1 6.606 0.000 A 49 TYR HEy H 1 6.606 0.000 A 49 TYR C C 13 173.674 0.000 A 49 TYR CA C 13 57.192 0.000 A 49 TYR CB C 13 43.123 0.014 A 49 TYR CDy C 13 132.585 0.000 A 49 TYR CEy C 13 118.296 0.000 A 49 TYR N N 15 124.842 0.000 A 50 LEU H H 1 8.901 0.000 A 50 LEU HA H 1 4.753 0.000 A 50 LEU HBx H 1 0.825 0.000 A 50 LEU HBy H 1 1.562 0.000 A 50 LEU HDx% H 1 0.315 0.000 A 50 LEU HDy% H 1 0.396 0.000 A 50 LEU HG H 1 1.285 0.000 A 50 LEU C C 13 176.050 0.000 A 50 LEU CA C 13 53.158 0.000 A 50 LEU CB C 13 41.155 0.019 A 50 LEU CDx C 13 24.666 0.000 A 50 LEU CDy C 13 24.885 0.000 A 50 LEU CG C 13 27.282 0.000 A 50 LEU N N 15 124.138 0.000 A 51 VAL H H 1 8.513 0.000 A 51 VAL HA H 1 3.948 0.000 A 51 VAL HB H 1 1.743 0.000 A 51 VAL HGx% H 1 0.659 0.000 A 51 VAL HGy% H 1 0.704 0.000 A 51 VAL CA C 13 59.724 0.000 A 51 VAL CB C 13 33.605 0.000 A 51 VAL CGy C 13 22.742 0.000 A 51 VAL CGx C 13 21.764 0.000 A 51 VAL N N 15 123.181 0.000 A 52 PRO HA H 1 4.305 0.000 A 52 PRO HBy H 1 2.409 0.000 A 52 PRO HBx H 1 1.862 0.000 A 52 PRO C C 13 176.607 0.000 A 52 PRO CA C 13 63.950 0.000 A 52 PRO CB C 13 32.163 0.002 A 53 ALA H H 1 7.926 0.000 A 53 ALA HA H 1 3.720 0.000 A 53 ALA HB% H 1 1.281 0.000 A 53 ALA C C 13 176.409 0.000 A 53 ALA CA C 13 54.742 0.000 A 53 ALA CB C 13 18.948 0.000 A 53 ALA N N 15 123.771 0.000 A 54 ASP H H 1 8.106 0.000 A 54 ASP HA H 1 4.621 0.000 A 54 ASP HBy H 1 2.825 0.000 A 54 ASP HBx H 1 2.624 0.000 A 54 ASP C C 13 175.823 0.000 A 54 ASP CA C 13 52.744 0.000 A 54 ASP CB C 13 39.861 0.004 A 54 ASP N N 15 111.152 0.000 A 55 LEU H H 1 7.295 0.000 A 55 LEU HA H 1 4.351 0.000 A 55 LEU HBx H 1 1.429 0.000 A 55 LEU HBy H 1 1.593 0.000 A 55 LEU HDx% H 1 0.871 0.000 A 55 LEU HDy% H 1 0.917 0.000 A 55 LEU HG H 1 2.071 0.000 A 55 LEU C C 13 177.459 0.000 A 55 LEU CA C 13 55.472 0.000 A 55 LEU CB C 13 43.593 0.005 A 55 LEU CDy C 13 26.012 0.000 A 55 LEU CDx C 13 25.485 0.000 A 55 LEU CG C 13 27.318 0.000 A 55 LEU N N 15 121.263 0.000 A 56 THR H H 1 8.476 0.000 A 56 THR HA H 1 5.233 0.000 A 56 THR HB H 1 4.776 0.000 A 56 THR HG1 H 1 5.625 0.000 A 56 THR HG2% H 1 1.212 0.000 A 56 THR C C 13 176.538 0.000 A 56 THR CA C 13 60.318 0.000 A 56 THR CB C 13 71.303 0.000 A 56 THR CG2 C 13 22.210 0.000 A 56 THR N N 15 114.222 0.000 A 57 VAL H H 1 8.806 0.000 A 57 VAL HA H 1 3.738 0.000 A 57 VAL HB H 1 2.324 0.000 A 57 VAL HGx% H 1 0.836 0.000 A 57 VAL HGy% H 1 0.949 0.000 A 57 VAL C C 13 178.743 0.000 A 57 VAL CA C 13 66.797 0.000 A 57 VAL CB C 13 31.801 0.000 A 57 VAL CGx C 13 21.469 0.000 A 57 VAL CGy C 13 24.073 0.000 A 57 VAL N N 15 122.331 0.000 A 58 GLY H H 1 9.381 0.000 A 58 GLY HAy H 1 3.934 0.000 A 58 GLY HAx H 1 3.734 0.000 A 58 GLY C C 13 176.924 0.000 A 58 GLY CA C 13 47.317 0.004 A 58 GLY N N 15 105.470 0.000 A 59 GLN H H 1 8.027 0.000 A 59 GLN HA H 1 4.166 0.000 A 59 GLN HBx H 1 2.041 0.000 A 59 GLN HBy H 1 2.511 0.000 A 59 GLN HE2y H 1 7.569 0.001 A 59 GLN HE2x H 1 6.865 0.000 A 59 GLN HGx H 1 2.431 0.000 A 59 GLN HGy H 1 2.431 0.000 A 59 GLN C C 13 178.605 0.000 A 59 GLN CA C 13 58.764 0.000 A 59 GLN CB C 13 29.129 0.003 A 59 GLN CD C 13 180.130 0.006 A 59 GLN CG C 13 35.170 0.000 A 59 GLN N N 15 121.492 0.000 A 59 GLN NE2 N 15 111.544 0.013 A 60 PHE H H 1 8.522 0.000 A 60 PHE HA H 1 4.291 0.000 A 60 PHE HBy H 1 3.431 0.000 A 60 PHE HBx H 1 3.078 0.000 A 60 PHE HDx H 1 6.951 0.004 A 60 PHE HDy H 1 6.951 0.004 A 60 PHE HEx H 1 6.784 0.000 A 60 PHE HEy H 1 6.784 0.000 A 60 PHE HZ H 1 6.477 0.000 A 60 PHE C C 13 176.690 0.000 A 60 PHE CA C 13 61.502 0.000 A 60 PHE CB C 13 39.155 0.005 A 60 PHE CDx C 13 130.831 0.000 A 60 PHE CEx C 13 130.569 0.000 A 60 PHE CZ C 13 129.070 0.000 A 60 PHE N N 15 122.595 0.000 A 61 VAL H H 1 8.705 0.000 A 61 VAL HA H 1 3.070 0.000 A 61 VAL HB H 1 2.153 0.000 A 61 VAL HGx% H 1 0.752 0.000 A 61 VAL HGy% H 1 1.025 0.000 A 61 VAL C C 13 176.872 0.000 A 61 VAL CA C 13 67.040 0.000 A 61 VAL CB C 13 31.119 0.000 A 61 VAL CGx C 13 22.046 0.000 A 61 VAL CGy C 13 24.031 0.000 A 61 VAL N N 15 118.720 0.000 A 62 TYR H H 1 7.373 0.000 A 62 TYR HA H 1 3.987 0.000 A 62 TYR HBy H 1 3.237 0.000 A 62 TYR HBx H 1 3.117 0.000 A 62 TYR HDx H 1 7.119 0.002 A 62 TYR HDy H 1 7.119 0.002 A 62 TYR HEx H 1 6.786 0.000 A 62 TYR HEy H 1 6.786 0.000 A 62 TYR C C 13 177.325 0.000 A 62 TYR CA C 13 61.685 0.000 A 62 TYR CB C 13 37.906 0.005 A 62 TYR CDy C 13 133.190 0.000 A 62 TYR CEy C 13 118.117 0.000 A 62 TYR N N 15 118.462 0.000 A 63 VAL H H 1 7.376 0.000 A 63 VAL HA H 1 3.342 0.000 A 63 VAL HB H 1 2.132 0.000 A 63 VAL HGx% H 1 0.566 0.000 A 63 VAL HGy% H 1 1.088 0.000 A 63 VAL C C 13 178.326 0.000 A 63 VAL CA C 13 66.615 0.000 A 63 VAL CB C 13 31.157 0.000 A 63 VAL CGx C 13 20.765 0.000 A 63 VAL CGy C 13 23.011 0.000 A 63 VAL N N 15 119.137 0.000 A 64 ILE H H 1 7.366 0.000 A 64 ILE HA H 1 3.279 0.000 A 64 ILE HB H 1 1.467 0.000 A 64 ILE HD1% H 1 -0.018 0.000 A 64 ILE HG1x H 1 0.464 0.000 A 64 ILE HG1y H 1 0.567 0.000 A 64 ILE HG2% H 1 -0.001 0.000 A 64 ILE C C 13 177.653 0.000 A 64 ILE CA C 13 63.682 0.000 A 64 ILE CB C 13 36.150 0.000 A 64 ILE CD1 C 13 11.224 0.000 A 64 ILE CG1 C 13 26.342 0.000 A 64 ILE CG2 C 13 16.944 0.000 A 64 ILE N N 15 118.858 0.000 A 65 ARG H H 1 8.463 0.000 A 65 ARG HA H 1 3.397 0.000 A 65 ARG HBx H 1 1.687 0.000 A 65 ARG HBy H 1 1.763 0.000 A 65 ARG HDx H 1 3.056 0.000 A 65 ARG HDy H 1 3.056 0.000 A 65 ARG HE H 1 7.429 0.000 A 65 ARG HGx H 1 1.333 0.000 A 65 ARG HGy H 1 1.545 0.000 A 65 ARG HH1x H 1 6.561 0.000 A 65 ARG C C 13 178.284 0.000 A 65 ARG CA C 13 60.078 0.000 A 65 ARG CB C 13 30.022 0.006 A 65 ARG CD C 13 43.251 0.000 A 65 ARG CG C 13 28.517 0.002 A 65 ARG CZ C 13 159.277 0.000 A 65 ARG N N 15 118.729 0.000 A 65 ARG NE N 15 81.795 0.000 A 66 LYS H H 1 7.536 0.000 A 66 LYS HA H 1 3.951 0.000 A 66 LYS HBx H 1 1.673 0.000 A 66 LYS HBy H 1 1.713 0.000 A 66 LYS HDx H 1 1.535 0.000 A 66 LYS HDy H 1 1.535 0.000 A 66 LYS HEx H 1 2.806 0.000 A 66 LYS HEy H 1 2.873 0.000 A 66 LYS HGx H 1 1.228 0.000 A 66 LYS HGy H 1 1.315 0.000 A 66 LYS C C 13 178.989 0.000 A 66 LYS CA C 13 58.347 0.000 A 66 LYS CB C 13 31.938 0.001 A 66 LYS CD C 13 29.046 0.000 A 66 LYS CE C 13 41.841 0.001 A 66 LYS CG C 13 24.544 0.000 A 66 LYS N N 15 116.643 0.000 A 67 ARG H H 1 7.783 0.000 A 67 ARG HA H 1 4.104 0.000 A 67 ARG HBx H 1 1.859 0.000 A 67 ARG HBy H 1 2.006 0.000 A 67 ARG HDx H 1 3.180 0.000 A 67 ARG HDy H 1 3.215 0.000 A 67 ARG HE H 1 8.245 0.000 A 67 ARG HGx H 1 1.699 0.000 A 67 ARG HGy H 1 1.821 0.000 A 67 ARG HH1x H 1 6.958 0.000 A 67 ARG C C 13 178.122 0.000 A 67 ARG CA C 13 58.182 0.000 A 67 ARG CB C 13 30.273 0.020 A 67 ARG CD C 13 42.996 0.001 A 67 ARG CG C 13 27.517 0.005 A 67 ARG CZ C 13 159.684 0.000 A 67 ARG N N 15 119.051 0.000 A 67 ARG NE N 15 85.107 0.000 A 68 ILE H H 1 7.675 0.000 A 68 ILE HA H 1 4.223 0.000 A 68 ILE HB H 1 1.846 0.000 A 68 ILE HD1% H 1 0.532 0.000 A 68 ILE HG1x H 1 1.151 0.000 A 68 ILE HG1y H 1 1.272 0.000 A 68 ILE HG2% H 1 0.750 0.000 A 68 ILE C C 13 174.568 0.000 A 68 ILE CA C 13 61.502 0.000 A 68 ILE CB C 13 38.643 0.000 A 68 ILE CD1 C 13 14.695 0.000 A 68 ILE CG1 C 13 26.263 0.000 A 68 ILE CG2 C 13 17.682 0.000 A 68 ILE N N 15 112.456 0.000 A 69 MET H H 1 7.805 0.000 A 69 MET HA H 1 3.982 0.000 A 69 MET HBx H 1 2.109 0.000 A 69 MET HBy H 1 2.206 0.000 A 69 MET HE% H 1 2.080 0.000 A 69 MET HGx H 1 2.468 0.000 A 69 MET HGy H 1 2.468 0.000 A 69 MET C C 13 175.482 0.000 A 69 MET CA C 13 55.811 0.000 A 69 MET CB C 13 29.392 0.008 A 69 MET CE C 13 16.905 0.000 A 69 MET CG C 13 32.272 0.000 A 69 MET N N 15 118.509 0.000 A 70 LEU H H 1 7.493 0.000 A 70 LEU HA H 1 4.603 0.000 A 70 LEU HBy H 1 1.572 0.000 A 70 LEU HBx H 1 1.223 0.000 A 70 LEU HDx% H 1 0.899 0.000 A 70 LEU HDy% H 1 0.768 0.000 A 70 LEU HG H 1 1.596 0.000 A 70 LEU CA C 13 52.560 0.000 A 70 LEU CB C 13 44.045 0.001 A 70 LEU CDx C 13 25.398 0.000 A 70 LEU CDy C 13 25.892 0.000 A 70 LEU CG C 13 26.504 0.000 A 70 LEU N N 15 121.952 0.000 A 71 PRO HA H 1 4.678 0.000 A 71 PRO HBy H 1 2.482 0.000 A 71 PRO HBx H 1 2.030 0.000 A 71 PRO HDx H 1 3.511 0.000 A 71 PRO HDy H 1 4.112 0.000 A 71 PRO HGx H 1 2.027 0.000 A 71 PRO HGy H 1 2.116 0.000 A 71 PRO CA C 13 62.124 0.000 A 71 PRO CB C 13 31.307 0.001 A 71 PRO CD C 13 51.294 0.003 A 71 PRO CG C 13 27.744 0.002 A 72 PRO HA H 1 4.123 0.000 A 72 PRO HBy H 1 2.316 0.000 A 72 PRO HBx H 1 1.934 0.000 A 72 PRO HDx H 1 3.786 0.000 A 72 PRO HDy H 1 3.786 0.000 A 72 PRO HGx H 1 2.051 0.000 A 72 PRO HGy H 1 2.105 0.000 A 72 PRO C C 13 177.052 0.000 A 72 PRO CA C 13 64.924 0.000 A 72 PRO CB C 13 32.049 0.004 A 72 PRO CD C 13 50.676 0.000 A 72 PRO CG C 13 27.505 0.004 A 73 GLU H H 1 9.065 0.000 A 73 GLU HA H 1 4.181 0.000 A 73 GLU HBx H 1 2.032 0.000 A 73 GLU HBy H 1 2.073 0.000 A 73 GLU HGx H 1 2.207 0.000 A 73 GLU HGy H 1 2.313 0.000 A 73 GLU C C 13 176.459 0.000 A 73 GLU CA C 13 57.774 0.000 A 73 GLU CB C 13 28.321 0.000 A 73 GLU CG C 13 36.100 0.004 A 73 GLU N N 15 115.091 0.000 A 74 LYS H H 1 7.797 0.000 A 74 LYS HA H 1 4.520 0.000 A 74 LYS HBx H 1 1.774 0.000 A 74 LYS HBy H 1 1.945 0.000 A 74 LYS HDx H 1 1.731 0.000 A 74 LYS HDy H 1 1.731 0.000 A 74 LYS HEx H 1 3.052 0.000 A 74 LYS HEy H 1 3.052 0.000 A 74 LYS HGx H 1 1.409 0.000 A 74 LYS HGy H 1 1.466 0.000 A 74 LYS C C 13 174.789 0.000 A 74 LYS CA C 13 54.789 0.000 A 74 LYS CB C 13 32.882 0.001 A 74 LYS CD C 13 28.848 0.000 A 74 LYS CE C 13 42.252 0.000 A 74 LYS CG C 13 25.248 0.002 A 74 LYS N N 15 121.755 0.000 A 75 ALA H H 1 8.410 0.000 A 75 ALA HA H 1 4.072 0.000 A 75 ALA HB% H 1 1.229 0.000 A 75 ALA C C 13 175.710 0.000 A 75 ALA CA C 13 52.226 0.000 A 75 ALA CB C 13 20.956 0.000 A 75 ALA N N 15 127.848 0.000 A 76 ILE H H 1 7.193 0.000 A 76 ILE HA H 1 4.593 0.000 A 76 ILE HB H 1 1.408 0.000 A 76 ILE HD1% H 1 0.535 0.000 A 76 ILE HG1y H 1 1.404 0.000 A 76 ILE HG1x H 1 0.826 0.000 A 76 ILE HG2% H 1 0.625 0.000 A 76 ILE C C 13 172.379 0.000 A 76 ILE CA C 13 59.699 0.000 A 76 ILE CB C 13 41.218 0.000 A 76 ILE CD1 C 13 13.932 0.000 A 76 ILE CG1 C 13 27.946 0.000 A 76 ILE CG2 C 13 16.600 0.000 A 76 ILE N N 15 114.298 0.000 A 77 PHE H H 1 8.931 0.000 A 77 PHE HA H 1 4.556 0.000 A 77 PHE HBx H 1 2.479 0.000 A 77 PHE HBy H 1 2.602 0.000 A 77 PHE HDx H 1 6.965 0.000 A 77 PHE HDy H 1 6.965 0.000 A 77 PHE HEx H 1 7.209 0.000 A 77 PHE HEy H 1 7.209 0.000 A 77 PHE HZ H 1 7.236 0.000 A 77 PHE C C 13 174.359 0.000 A 77 PHE CA C 13 56.596 0.000 A 77 PHE CB C 13 42.370 0.056 A 77 PHE CDx C 13 132.236 0.000 A 77 PHE CEx C 13 130.987 0.000 A 77 PHE CZ C 13 129.623 0.000 A 77 PHE N N 15 124.094 0.000 A 78 ILE H H 1 8.025 0.000 A 78 ILE HA H 1 5.233 0.000 A 78 ILE HB H 1 1.823 0.000 A 78 ILE HD1% H 1 0.798 0.000 A 78 ILE HG1y H 1 1.373 0.000 A 78 ILE HG1x H 1 1.200 0.000 A 78 ILE HG2% H 1 0.808 0.000 A 78 ILE C C 13 173.334 0.000 A 78 ILE CA C 13 58.130 0.000 A 78 ILE CB C 13 39.360 0.000 A 78 ILE CD1 C 13 12.874 0.000 A 78 ILE CG1 C 13 26.877 0.001 A 78 ILE CG2 C 13 17.387 0.000 A 78 ILE N N 15 117.724 0.000 A 79 PHE H H 1 9.210 0.000 A 79 PHE HA H 1 5.365 0.000 A 79 PHE HBx H 1 2.929 0.000 A 79 PHE HBy H 1 2.929 0.000 A 79 PHE HDx H 1 6.944 0.003 A 79 PHE HDy H 1 6.944 0.003 A 79 PHE HEx H 1 7.194 0.000 A 79 PHE HEy H 1 7.194 0.000 A 79 PHE HZ H 1 7.058 0.000 A 79 PHE C C 13 176.270 0.000 A 79 PHE CA C 13 55.948 0.000 A 79 PHE CB C 13 42.763 0.106 A 79 PHE CDx C 13 131.603 0.000 A 79 PHE CEx C 13 131.484 0.000 A 79 PHE CZ C 13 129.329 0.000 A 79 PHE N N 15 121.084 0.000 A 80 VAL H H 1 8.832 0.000 A 80 VAL HA H 1 4.520 0.000 A 80 VAL HB H 1 1.568 0.000 A 80 VAL HGx% H 1 0.672 0.000 A 80 VAL HGy% H 1 0.733 0.000 A 80 VAL C C 13 175.699 0.000 A 80 VAL CA C 13 60.484 0.000 A 80 VAL CB C 13 34.263 0.000 A 80 VAL CGy C 13 21.487 0.000 A 80 VAL CGx C 13 20.680 0.000 A 80 VAL N N 15 117.974 0.000 A 81 ASN H H 1 9.689 0.000 A 81 ASN HA H 1 4.339 0.000 A 81 ASN HBx H 1 2.811 0.000 A 81 ASN HBy H 1 3.039 0.000 A 81 ASN HD2y H 1 8.814 0.002 A 81 ASN HD2x H 1 7.136 0.000 A 81 ASN C C 13 174.036 0.000 A 81 ASN CA C 13 55.231 0.000 A 81 ASN CB C 13 37.408 0.001 A 81 ASN CG C 13 177.960 0.002 A 81 ASN N N 15 127.615 0.000 A 81 ASN ND2 N 15 116.147 0.000 A 82 ASP H H 1 8.772 0.000 A 82 ASP HA H 1 4.135 0.000 A 82 ASP HBx H 1 2.677 0.000 A 82 ASP HBy H 1 2.832 0.000 A 82 ASP C C 13 174.560 0.000 A 82 ASP CA C 13 55.638 0.000 A 82 ASP CB C 13 39.564 0.015 A 82 ASP N N 15 112.699 0.000 A 83 THR H H 1 8.080 0.000 A 83 THR HA H 1 4.715 0.000 A 83 THR HB H 1 4.124 0.000 A 83 THR HG2% H 1 1.217 0.000 A 83 THR C C 13 172.200 0.000 A 83 THR CA C 13 60.868 0.000 A 83 THR CB C 13 72.206 0.000 A 83 THR CG2 C 13 21.261 0.000 A 83 THR N N 15 112.567 0.000 A 84 LEU H H 1 8.520 0.000 A 84 LEU HA H 1 5.127 0.000 A 84 LEU HBy H 1 1.679 0.000 A 84 LEU HBx H 1 1.478 0.000 A 84 LEU HDx% H 1 0.780 0.000 A 84 LEU HDy% H 1 0.626 0.000 A 84 LEU HG H 1 1.372 0.000 A 84 LEU CA C 13 51.927 0.000 A 84 LEU CB C 13 42.779 0.001 A 84 LEU CDx C 13 25.420 0.000 A 84 LEU CDy C 13 25.514 0.000 A 84 LEU CG C 13 27.144 0.000 A 84 LEU N N 15 125.810 0.000 A 85 PRO HA H 1 4.835 0.000 A 85 PRO HBy H 1 2.203 0.000 A 85 PRO HBx H 1 1.847 0.000 A 85 PRO HDx H 1 3.949 0.000 A 85 PRO HDy H 1 4.248 0.000 A 85 PRO HGx H 1 1.682 0.000 A 85 PRO HGy H 1 1.924 0.000 A 85 PRO CA C 13 60.910 0.000 A 85 PRO CB C 13 30.852 0.000 A 85 PRO CD C 13 50.788 0.002 A 85 PRO CG C 13 26.849 0.009 A 86 PRO HA H 1 4.577 0.000 A 86 PRO HBy H 1 2.455 0.000 A 86 PRO HBx H 1 2.003 0.000 A 86 PRO HDx H 1 3.535 0.000 A 86 PRO HDy H 1 3.948 0.000 A 86 PRO HGx H 1 2.121 0.000 A 86 PRO HGy H 1 2.176 0.000 A 86 PRO C C 13 177.830 0.000 A 86 PRO CA C 13 62.424 0.000 A 86 PRO CB C 13 31.910 0.002 A 86 PRO CD C 13 50.564 0.006 A 86 PRO CG C 13 27.747 0.005 A 87 THR H H 1 8.291 0.000 A 87 THR HA H 1 3.802 0.000 A 87 THR HB H 1 4.165 0.000 A 87 THR HG2% H 1 1.326 0.000 A 87 THR C C 13 175.702 0.000 A 87 THR CA C 13 65.079 0.000 A 87 THR CB C 13 68.818 0.000 A 87 THR CG2 C 13 22.376 0.000 A 87 THR N N 15 114.642 0.000 A 88 ALA H H 1 8.031 0.000 A 88 ALA HA H 1 4.420 0.000 A 88 ALA HB% H 1 1.439 0.000 A 88 ALA C C 13 177.690 0.000 A 88 ALA CA C 13 52.118 0.000 A 88 ALA CB C 13 19.334 0.000 A 88 ALA N N 15 119.706 0.000 A 89 ALA H H 1 7.465 0.000 A 89 ALA HA H 1 4.179 0.000 A 89 ALA HB% H 1 1.445 0.000 A 89 ALA C C 13 176.520 0.000 A 89 ALA CA C 13 52.454 0.000 A 89 ALA CB C 13 19.301 0.000 A 89 ALA N N 15 120.388 0.000 A 90 LEU H H 1 8.458 0.000 A 90 LEU HA H 1 4.490 0.000 A 90 LEU HBy H 1 1.772 0.000 A 90 LEU HBx H 1 1.717 0.000 A 90 LEU HDx% H 1 0.830 0.000 A 90 LEU HDy% H 1 0.962 0.000 A 90 LEU HG H 1 1.820 0.000 A 90 LEU C C 13 179.555 0.000 A 90 LEU CA C 13 54.578 0.000 A 90 LEU CB C 13 42.689 0.000 A 90 LEU CDx C 13 23.264 0.000 A 90 LEU CDy C 13 25.336 0.000 A 90 LEU CG C 13 27.683 0.000 A 90 LEU N N 15 119.307 0.000 A 91 MET H H 1 9.203 0.000 A 91 MET HA H 1 4.231 0.000 A 91 MET HBx H 1 1.473 0.000 A 91 MET HBy H 1 2.045 0.000 A 91 MET HE% H 1 1.192 0.000 A 91 MET HGx H 1 2.220 0.000 A 91 MET HGy H 1 2.312 0.000 A 91 MET C C 13 178.860 0.000 A 91 MET CA C 13 56.938 0.000 A 91 MET CB C 13 29.372 0.001 A 91 MET CE C 13 15.409 0.000 A 91 MET CG C 13 32.789 0.000 A 91 MET N N 15 121.586 0.000 A 92 SER H H 1 8.717 0.000 A 92 SER HA H 1 3.978 0.000 A 92 SER HBx H 1 3.962 0.000 A 92 SER HBy H 1 3.962 0.000 A 92 SER C C 13 176.318 0.000 A 92 SER CA C 13 60.871 0.000 A 92 SER CB C 13 61.575 0.000 A 92 SER N N 15 112.826 0.000 A 93 ALA H H 1 7.058 0.000 A 93 ALA HA H 1 4.357 0.000 A 93 ALA HB% H 1 1.659 0.000 A 93 ALA C C 13 180.789 0.000 A 93 ALA CA C 13 54.841 0.000 A 93 ALA CB C 13 18.603 0.000 A 93 ALA N N 15 126.735 0.000 A 94 ILE H H 1 7.872 0.000 A 94 ILE HA H 1 4.063 0.000 A 94 ILE HB H 1 2.167 0.000 A 94 ILE HD1% H 1 0.778 0.000 A 94 ILE HG1x H 1 1.376 0.000 A 94 ILE HG1y H 1 1.642 0.000 A 94 ILE HG2% H 1 0.994 0.000 A 94 ILE C C 13 178.326 0.000 A 94 ILE CA C 13 62.755 0.000 A 94 ILE CB C 13 36.410 0.000 A 94 ILE CD1 C 13 10.983 0.000 A 94 ILE CG1 C 13 27.013 0.005 A 94 ILE CG2 C 13 19.120 0.000 A 94 ILE N N 15 118.720 0.000 A 95 TYR H H 1 8.841 0.000 A 95 TYR HA H 1 4.007 0.000 A 95 TYR HBx H 1 3.017 0.000 A 95 TYR HBy H 1 3.160 0.000 A 95 TYR HDx H 1 7.037 0.001 A 95 TYR HDy H 1 7.037 0.001 A 95 TYR HEx H 1 6.864 0.000 A 95 TYR HEy H 1 6.864 0.000 A 95 TYR C C 13 176.022 0.000 A 95 TYR CA C 13 62.187 0.000 A 95 TYR CB C 13 39.093 0.002 A 95 TYR CDx C 13 133.483 0.000 A 95 TYR CEx C 13 118.134 0.000 A 95 TYR N N 15 120.697 0.000 A 96 GLN H H 1 7.757 0.000 A 96 GLN HA H 1 3.778 0.000 A 96 GLN HBx H 1 2.178 0.000 A 96 GLN HBy H 1 2.219 0.000 A 96 GLN HE2y H 1 7.571 0.001 A 96 GLN HE2x H 1 6.934 0.001 A 96 GLN HGx H 1 2.577 0.000 A 96 GLN HGy H 1 2.577 0.000 A 96 GLN C C 13 177.250 0.000 A 96 GLN CA C 13 58.719 0.000 A 96 GLN CB C 13 28.286 0.003 A 96 GLN CD C 13 180.126 0.008 A 96 GLN CG C 13 33.504 0.000 A 96 GLN N N 15 114.982 0.000 A 96 GLN NE2 N 15 112.043 0.001 A 97 GLU H H 1 7.117 0.000 A 97 GLU HA H 1 4.099 0.000 A 97 GLU HBx H 1 1.582 0.000 A 97 GLU HBy H 1 1.813 0.000 A 97 GLU HGx H 1 1.532 0.000 A 97 GLU HGy H 1 1.997 0.000 A 97 GLU C C 13 178.140 0.000 A 97 GLU CA C 13 57.886 0.000 A 97 GLU CB C 13 31.589 0.003 A 97 GLU CG C 13 35.644 0.004 A 97 GLU N N 15 114.340 0.000 A 98 HIS H H 1 8.247 0.000 A 98 HIS HA H 1 4.829 0.000 A 98 HIS HBx H 1 2.800 0.000 A 98 HIS HBy H 1 3.232 0.000 A 98 HIS HD2 H 1 7.028 0.001 A 98 HIS HE1 H 1 7.868 0.000 A 98 HIS C C 13 175.856 0.000 A 98 HIS CA C 13 56.738 0.000 A 98 HIS CB C 13 32.930 0.009 A 98 HIS CD2 C 13 119.361 0.000 A 98 HIS CE1 C 13 138.983 0.000 A 98 HIS N N 15 113.377 0.000 A 99 LYS H H 1 8.065 0.000 A 99 LYS HA H 1 3.994 0.000 A 99 LYS HBx H 1 1.202 0.000 A 99 LYS HBy H 1 1.202 0.000 A 99 LYS HDx H 1 0.897 0.000 A 99 LYS HDy H 1 1.230 0.000 A 99 LYS HEx H 1 2.745 0.000 A 99 LYS HEy H 1 2.782 0.000 A 99 LYS HGx H 1 1.004 0.000 A 99 LYS HGy H 1 1.217 0.000 A 99 LYS C C 13 174.832 0.000 A 99 LYS CA C 13 57.693 0.000 A 99 LYS CB C 13 31.703 0.000 A 99 LYS CD C 13 29.340 0.000 A 99 LYS CE C 13 42.255 0.001 A 99 LYS CG C 13 22.528 0.017 A 99 LYS N N 15 120.905 0.000 A 100 ASP H H 1 9.027 0.000 A 100 ASP HA H 1 4.765 0.000 A 100 ASP HBx H 1 3.183 0.000 A 100 ASP HBy H 1 3.891 0.000 A 100 ASP C C 13 177.692 0.000 A 100 ASP CA C 13 54.030 0.000 A 100 ASP CB C 13 43.429 0.001 A 100 ASP N N 15 124.188 0.000 A 101 LYS H H 1 8.678 0.000 A 101 LYS HA H 1 4.239 0.000 A 101 LYS HBx H 1 2.053 0.000 A 101 LYS HBy H 1 2.053 0.000 A 101 LYS HDx H 1 1.711 0.000 A 101 LYS HDy H 1 1.711 0.000 A 101 LYS HEx H 1 2.973 0.000 A 101 LYS HEy H 1 2.973 0.000 A 101 LYS HGx H 1 1.652 0.000 A 101 LYS HGy H 1 1.709 0.000 A 101 LYS C C 13 178.053 0.000 A 101 LYS CA C 13 59.482 0.000 A 101 LYS CB C 13 32.821 0.000 A 101 LYS CD C 13 29.069 0.000 A 101 LYS CE C 13 42.123 0.000 A 101 LYS CG C 13 25.607 0.007 A 101 LYS N N 15 125.898 0.000 A 102 ASP H H 1 10.276 0.000 A 102 ASP HA H 1 4.127 0.000 A 102 ASP HBx H 1 2.619 0.000 A 102 ASP HBy H 1 2.817 0.000 A 102 ASP C C 13 176.833 0.000 A 102 ASP CA C 13 54.666 0.000 A 102 ASP CB C 13 39.848 0.008 A 102 ASP N N 15 119.326 0.000 A 103 GLY H H 1 8.173 0.000 A 103 GLY HAx H 1 3.509 0.000 A 103 GLY HAy H 1 4.415 0.000 A 103 GLY C C 13 174.655 0.000 A 103 GLY CA C 13 45.319 0.002 A 103 GLY N N 15 106.059 0.000 A 104 PHE H H 1 9.600 0.000 A 104 PHE HA H 1 4.682 0.000 A 104 PHE HBx H 1 2.090 0.000 A 104 PHE HBy H 1 3.541 0.000 A 104 PHE HDx H 1 7.056 0.003 A 104 PHE HDy H 1 7.056 0.003 A 104 PHE HEx H 1 7.200 0.000 A 104 PHE HEy H 1 7.200 0.000 A 104 PHE HZ H 1 6.934 0.000 A 104 PHE C C 13 174.830 0.000 A 104 PHE CA C 13 59.377 0.000 A 104 PHE CB C 13 39.938 0.007 A 104 PHE CDx C 13 132.618 0.000 A 104 PHE CEx C 13 130.543 0.000 A 104 PHE CZ C 13 127.239 0.000 A 104 PHE N N 15 121.781 0.000 A 105 LEU H H 1 8.376 0.000 A 105 LEU HA H 1 4.897 0.000 A 105 LEU HBx H 1 1.436 0.000 A 105 LEU HBy H 1 2.104 0.000 A 105 LEU HDx% H 1 0.703 0.000 A 105 LEU HDy% H 1 0.934 0.000 A 105 LEU HG H 1 1.440 0.000 A 105 LEU C C 13 173.947 0.000 A 105 LEU CA C 13 53.463 0.000 A 105 LEU CB C 13 45.066 0.001 A 105 LEU CDy C 13 26.136 0.000 A 105 LEU CDx C 13 24.301 0.000 A 105 LEU CG C 13 27.317 0.000 A 105 LEU N N 15 119.929 0.000 A 106 TYR H H 1 9.124 0.000 A 106 TYR HA H 1 4.992 0.000 A 106 TYR HBx H 1 2.927 0.000 A 106 TYR HBy H 1 3.111 0.000 A 106 TYR HDx H 1 7.315 0.001 A 106 TYR HDy H 1 7.315 0.001 A 106 TYR HEx H 1 7.286 0.000 A 106 TYR HEy H 1 7.286 0.000 A 106 TYR C C 13 176.099 0.000 A 106 TYR CA C 13 58.893 0.000 A 106 TYR CB C 13 38.140 0.011 A 106 TYR CDx C 13 132.786 0.000 A 106 TYR CEx C 13 118.838 0.000 A 106 TYR N N 15 127.637 0.000 A 107 VAL H H 1 9.560 0.000 A 107 VAL HA H 1 5.135 0.000 A 107 VAL HB H 1 2.252 0.000 A 107 VAL HGx% H 1 0.851 0.000 A 107 VAL HGy% H 1 0.934 0.000 A 107 VAL C C 13 175.722 0.000 A 107 VAL CA C 13 59.587 0.000 A 107 VAL CB C 13 34.787 0.000 A 107 VAL CGx C 13 20.911 0.000 A 107 VAL CGy C 13 22.171 0.000 A 107 VAL N N 15 121.630 0.000 A 108 THR H H 1 9.061 0.000 A 108 THR HA H 1 6.155 0.000 A 108 THR HB H 1 4.045 0.000 A 108 THR HG2% H 1 1.237 0.000 A 108 THR C C 13 174.158 0.000 A 108 THR CA C 13 59.869 0.000 A 108 THR CB C 13 72.268 0.000 A 108 THR CG2 C 13 22.350 0.000 A 108 THR N N 15 119.845 0.000 A 109 TYR H H 1 8.461 0.000 A 109 TYR HA H 1 6.332 0.000 A 109 TYR HBx H 1 2.596 0.000 A 109 TYR HBy H 1 2.917 0.000 A 109 TYR HDx H 1 6.833 0.003 A 109 TYR HDy H 1 6.833 0.003 A 109 TYR HEx H 1 6.632 0.000 A 109 TYR HEy H 1 6.632 0.000 A 109 TYR HH H 1 9.706 0.003 A 109 TYR C C 13 173.366 0.000 A 109 TYR CA C 13 54.655 0.000 A 109 TYR CB C 13 42.250 0.023 A 109 TYR CDx C 13 132.976 0.000 A 109 TYR CEx C 13 117.460 0.000 A 109 TYR N N 15 119.706 0.000 A 110 SER H H 1 9.089 0.000 A 110 SER HA H 1 4.745 0.000 A 110 SER HBx H 1 3.851 0.000 A 110 SER HBy H 1 3.978 0.000 A 110 SER C C 13 173.692 0.000 A 110 SER CA C 13 56.044 0.000 A 110 SER CB C 13 66.177 0.001 A 110 SER N N 15 112.907 0.000 A 111 GLY H H 1 8.443 0.000 A 111 GLY HAx H 1 3.859 0.000 A 111 GLY HAy H 1 4.846 0.000 A 111 GLY C C 13 173.331 0.000 A 111 GLY CA C 13 45.341 0.002 A 111 GLY N N 15 111.054 0.000 A 112 GLU H H 1 8.413 0.000 A 112 GLU HA H 1 4.660 0.000 A 112 GLU HBx H 1 1.978 0.000 A 112 GLU HBy H 1 2.054 0.000 A 112 GLU HGy H 1 2.297 0.000 A 112 GLU HGx H 1 2.191 0.000 A 112 GLU C C 13 174.538 0.000 A 112 GLU CA C 13 55.642 0.000 A 112 GLU CB C 13 32.930 0.016 A 112 GLU CG C 13 36.455 0.001 A 112 GLU N N 15 118.801 0.000 A 113 ASN H H 1 8.207 0.000 A 113 ASN HA H 1 4.187 0.000 A 113 ASN HBx H 1 1.647 0.000 A 113 ASN HBy H 1 1.921 0.000 A 113 ASN HD2y H 1 7.001 0.002 A 113 ASN HD2x H 1 6.540 0.001 A 113 ASN C C 13 175.011 0.000 A 113 ASN CA C 13 51.910 0.000 A 113 ASN CB C 13 36.865 0.004 A 113 ASN N N 15 118.152 0.000 A 113 ASN ND2 N 15 109.422 0.000 A 114 THR H H 1 7.411 0.000 A 114 THR HA H 1 4.190 0.000 A 114 THR HB H 1 3.959 0.000 A 114 THR HG2% H 1 0.960 0.000 A 114 THR C C 13 173.575 0.000 A 114 THR CA C 13 61.149 0.000 A 114 THR CB C 13 69.859 0.000 A 114 THR CG2 C 13 21.291 0.000 A 114 THR N N 15 112.887 0.000 A 115 PHE H H 1 8.021 0.000 A 115 PHE HA H 1 4.451 0.000 A 115 PHE HBy H 1 3.038 0.000 A 115 PHE HBx H 1 2.776 0.000 A 115 PHE HDx H 1 6.969 0.000 A 115 PHE HDy H 1 6.969 0.000 A 115 PHE HEx H 1 7.076 0.000 A 115 PHE HEy H 1 7.076 0.000 A 115 PHE HZ H 1 7.081 0.000 A 115 PHE C C 13 175.078 0.000 A 115 PHE CA C 13 57.681 0.000 A 115 PHE CB C 13 39.569 0.018 A 115 PHE CDx C 13 131.558 0.000 A 115 PHE CEx C 13 131.319 0.000 A 115 PHE CZ C 13 129.552 0.000 A 115 PHE N N 15 121.474 0.000 A 116 GLY H H 1 7.712 0.000 A 116 GLY HAx H 1 3.659 0.000 A 116 GLY HAy H 1 3.659 0.000 A 116 GLY CA C 13 46.190 0.000 A 116 GLY N N 15 116.271 0.000 B 597 GLY HAx H 1 3.977 0.000 B 597 GLY HAy H 1 3.977 0.000 B 597 GLY CA C 13 43.440 0.000 B 598 PRO HA H 1 4.457 0.000 B 598 PRO HBx H 1 1.852 0.000 B 598 PRO HBy H 1 2.262 0.000 B 598 PRO HDx H 1 3.549 0.000 B 598 PRO HDy H 1 3.568 0.000 B 598 PRO HGx H 1 1.933 0.000 B 598 PRO HGy H 1 2.003 0.000 B 598 PRO C C 13 176.564 0.000 B 598 PRO CA C 13 63.064 0.000 B 598 PRO CB C 13 32.327 0.000 B 598 PRO CD C 13 49.652 0.002 B 598 PRO CG C 13 26.973 0.000 B 599 HIS H H 1 8.536 0.000 B 599 HIS HA H 1 4.655 0.000 B 599 HIS HBx H 1 3.109 0.000 B 599 HIS HBy H 1 3.159 0.000 B 599 HIS HD2 H 1 7.105 0.000 B 599 HIS HE1 H 1 8.079 0.000 B 599 HIS CA C 13 56.012 0.000 B 599 HIS CB C 13 30.329 0.001 B 599 HIS CD2 C 13 119.930 0.000 B 599 HIS CE1 C 13 137.896 0.000 B 599 HIS N N 15 119.871 0.000 B 600 MET H H 1 8.344 0.000 B 600 MET HA H 1 4.507 0.000 B 600 MET HBx H 1 1.975 0.000 B 600 MET HBy H 1 2.035 0.000 B 600 MET HE% H 1 2.074 0.000 B 600 MET HGx H 1 2.471 0.000 B 600 MET HGy H 1 2.530 0.000 B 600 MET C C 13 175.825 0.000 B 600 MET CA C 13 55.390 0.000 B 600 MET CB C 13 33.136 0.002 B 600 MET CE C 13 17.021 0.000 B 600 MET CG C 13 31.901 0.001 B 600 MET N N 15 122.524 0.000 B 601 ILE H H 1 8.304 0.000 B 601 ILE HA H 1 4.216 0.000 B 601 ILE HB H 1 1.877 0.000 B 601 ILE HD1% H 1 0.859 0.000 B 601 ILE HG1x H 1 1.186 0.000 B 601 ILE HG1y H 1 1.473 0.000 B 601 ILE HG2% H 1 0.916 0.000 B 601 ILE C C 13 176.153 0.000 B 601 ILE CA C 13 61.155 0.000 B 601 ILE CB C 13 38.811 0.000 B 601 ILE CD1 C 13 12.995 0.000 B 601 ILE CG1 C 13 27.274 0.001 B 601 ILE CG2 C 13 17.600 0.000 B 601 ILE N N 15 122.607 0.000 B 602 SER H H 1 8.442 0.000 B 602 SER HA H 1 4.457 0.000 B 602 SER HBx H 1 3.887 0.000 B 602 SER HBy H 1 3.887 0.000 B 602 SER C C 13 174.979 0.000 B 602 SER CA C 13 58.465 0.000 B 602 SER CB C 13 63.954 0.000 B 602 SER N N 15 120.153 0.000 B 603 GLY H H 1 8.468 0.000 B 603 GLY HAx H 1 3.978 0.000 B 603 GLY HAy H 1 3.978 0.000 B 603 GLY C C 13 174.088 0.000 B 603 GLY CA C 13 45.491 0.000 B 603 GLY N N 15 110.866 0.000 B 604 LEU H H 1 8.057 0.000 B 604 LEU HA H 1 4.384 0.000 B 604 LEU HBx H 1 1.608 0.000 B 604 LEU HBy H 1 1.608 0.000 B 604 LEU HDx% H 1 0.863 0.000 B 604 LEU HDy% H 1 0.910 0.000 B 604 LEU HG H 1 1.606 0.000 B 604 LEU C C 13 177.404 0.000 B 604 LEU CA C 13 55.254 0.000 B 604 LEU CB C 13 42.665 0.000 B 604 LEU CDx C 13 23.621 0.000 B 604 LEU CDy C 13 24.960 0.000 B 604 LEU CG C 13 26.997 0.000 B 604 LEU N N 15 121.311 0.000 B 605 SER H H 1 8.301 0.000 B 605 SER HA H 1 4.474 0.000 B 605 SER HBx H 1 3.853 0.000 B 605 SER HBy H 1 3.853 0.000 B 605 SER C C 13 174.472 0.000 B 605 SER CA C 13 58.482 0.000 B 605 SER CB C 13 63.719 0.000 B 605 SER N N 15 116.752 0.000 B 606 VAL H H 1 8.082 0.000 B 606 VAL HA H 1 4.130 0.000 B 606 VAL HB H 1 2.080 0.000 B 606 VAL HGx% H 1 0.906 0.000 B 606 VAL HGy% H 1 0.920 0.000 B 606 VAL C C 13 176.077 0.000 B 606 VAL CA C 13 62.519 0.000 B 606 VAL CB C 13 32.778 0.000 B 606 VAL CGy C 13 21.195 0.000 B 606 VAL CGx C 13 20.602 0.000 B 606 VAL N N 15 121.969 0.000 B 607 ILE H H 1 8.130 0.000 B 607 ILE HA H 1 4.149 0.000 B 607 ILE HB H 1 1.843 0.000 B 607 ILE HD1% H 1 0.842 0.000 B 607 ILE HG1x H 1 1.202 0.000 B 607 ILE HG1y H 1 1.484 0.000 B 607 ILE HG2% H 1 0.889 0.000 B 607 ILE C C 13 176.140 0.000 B 607 ILE CA C 13 61.155 0.000 B 607 ILE CB C 13 38.482 0.000 B 607 ILE CD1 C 13 12.743 0.000 B 607 ILE CG1 C 13 27.465 0.002 B 607 ILE CG2 C 13 17.526 0.000 B 607 ILE N N 15 124.453 0.000 B 608 LYS H H 1 8.359 0.000 B 608 LYS HA H 1 4.283 0.000 B 608 LYS HBx H 1 1.753 0.000 B 608 LYS HBy H 1 1.821 0.000 B 608 LYS HDx H 1 1.671 0.000 B 608 LYS HDy H 1 1.671 0.000 B 608 LYS HEx H 1 2.981 0.000 B 608 LYS HEy H 1 2.981 0.000 B 608 LYS HGx H 1 1.374 0.000 B 608 LYS HGy H 1 1.443 0.000 B 608 LYS C C 13 176.411 0.000 B 608 LYS CA C 13 56.557 0.000 B 608 LYS CB C 13 33.135 0.001 B 608 LYS CD C 13 29.185 0.000 B 608 LYS CE C 13 42.137 0.000 B 608 LYS CG C 13 24.837 0.000 B 608 LYS N N 15 125.812 0.000 B 609 GLN H H 1 8.411 0.000 B 609 GLN HA H 1 4.302 0.000 B 609 GLN HBx H 1 1.985 0.000 B 609 GLN HBy H 1 2.088 0.000 B 609 GLN HE2x H 1 6.873 0.001 B 609 GLN HE2y H 1 7.556 0.000 B 609 GLN HGx H 1 2.361 0.000 B 609 GLN HGy H 1 2.361 0.000 B 609 GLN C C 13 176.080 0.000 B 609 GLN CA C 13 56.187 0.000 B 609 GLN CB C 13 29.652 0.003 B 609 GLN CD C 13 180.299 0.012 B 609 GLN CG C 13 33.931 0.000 B 609 GLN N N 15 121.878 0.000 B 609 GLN NE2 N 15 112.352 0.000 B 610 GLU H H 1 8.466 0.000 B 610 GLU HA H 1 4.305 0.000 B 610 GLU HBx H 1 1.953 0.000 B 610 GLU HBy H 1 2.013 0.000 B 610 GLU HGx H 1 2.240 0.000 B 610 GLU HGy H 1 2.285 0.000 B 610 GLU C C 13 176.712 0.000 B 610 GLU CA C 13 56.879 0.000 B 610 GLU CB C 13 30.247 0.000 B 610 GLU CG C 13 36.222 0.003 B 610 GLU N N 15 122.374 0.000 B 611 VAL H H 1 8.119 0.000 B 611 VAL HA H 1 4.049 0.000 B 611 VAL HB H 1 2.081 0.000 B 611 VAL HGx% H 1 0.938 0.000 B 611 VAL HGy% H 1 0.921 0.000 B 611 VAL C C 13 176.324 0.000 B 611 VAL CA C 13 62.800 0.000 B 611 VAL CB C 13 32.741 0.000 B 611 VAL CGx C 13 20.832 0.000 B 611 VAL CGy C 13 21.278 0.000 B 611 VAL N N 15 120.329 0.000 B 612 GLU H H 1 8.391 0.000 B 612 GLU HA H 1 4.230 0.000 B 612 GLU HBx H 1 1.952 0.000 B 612 GLU HBy H 1 2.037 0.000 B 612 GLU HGx H 1 2.222 0.000 B 612 GLU HGy H 1 2.276 0.000 B 612 GLU C C 13 176.450 0.000 B 612 GLU CA C 13 56.996 0.000 B 612 GLU CB C 13 30.273 0.002 B 612 GLU CG C 13 36.417 0.005 B 612 GLU N N 15 123.835 0.000 B 613 ARG H H 1 8.255 0.000 B 613 ARG HA H 1 4.320 0.000 B 613 ARG HBx H 1 1.765 0.000 B 613 ARG HBy H 1 1.848 0.000 B 613 ARG HDx H 1 3.168 0.000 B 613 ARG HDy H 1 3.168 0.000 B 613 ARG HE H 1 7.287 0.000 B 613 ARG HGx H 1 1.576 0.000 B 613 ARG HGy H 1 1.632 0.000 B 613 ARG C C 13 176.228 0.000 B 613 ARG CA C 13 56.218 0.000 B 613 ARG CB C 13 30.827 0.002 B 613 ARG CD C 13 43.398 0.000 B 613 ARG CG C 13 27.237 0.005 B 613 ARG CZ C 13 159.641 0.000 B 613 ARG N N 15 121.915 0.000 B 613 ARG NE N 15 84.706 0.000 B 614 LEU H H 1 8.267 0.000 B 614 LEU HA H 1 4.330 0.000 B 614 LEU HBx H 1 1.528 0.000 B 614 LEU HBy H 1 1.679 0.000 B 614 LEU HDx% H 1 0.833 0.000 B 614 LEU HDy% H 1 0.893 0.000 B 614 LEU HG H 1 1.619 0.000 B 614 LEU C C 13 177.738 0.000 B 614 LEU CA C 13 55.245 0.000 B 614 LEU CB C 13 42.358 0.000 B 614 LEU CDx C 13 23.497 0.000 B 614 LEU CDy C 13 25.249 0.000 B 614 LEU CG C 13 27.004 0.000 B 614 LEU N N 15 123.052 0.000 B 615 GLY H H 1 8.346 0.000 B 615 GLY HAx H 1 3.948 0.000 B 615 GLY HAy H 1 3.948 0.000 B 615 GLY C C 13 173.926 0.000 B 615 GLY CA C 13 45.395 0.000 B 615 GLY N N 15 109.092 0.000 B 616 ASN H H 1 8.314 0.000 B 616 ASN HA H 1 4.698 0.000 B 616 ASN HBx H 1 2.726 0.000 B 616 ASN HBy H 1 2.820 0.000 B 616 ASN HD2x H 1 6.892 0.000 B 616 ASN HD2y H 1 7.582 0.002 B 616 ASN C C 13 174.953 0.000 B 616 ASN CA C 13 53.490 0.000 B 616 ASN CB C 13 39.112 0.001 B 616 ASN CG C 13 176.928 0.011 B 616 ASN N N 15 118.277 0.000 B 616 ASN ND2 N 15 112.742 0.002 B 617 ASP H H 1 8.421 0.000 B 617 ASP HA H 1 4.586 0.000 B 617 ASP HBx H 1 2.602 0.000 B 617 ASP HBy H 1 2.636 0.000 B 617 ASP C C 13 175.972 0.000 B 617 ASP CA C 13 54.363 0.000 B 617 ASP CB C 13 41.166 0.005 B 617 ASP N N 15 119.904 0.000 B 618 VAL H H 1 7.882 0.000 B 618 VAL HA H 1 4.035 0.000 B 618 VAL HB H 1 2.009 0.000 B 618 VAL HGx% H 1 0.792 0.000 B 618 VAL HGy% H 1 0.802 0.000 B 618 VAL C C 13 175.551 0.000 B 618 VAL CA C 13 62.255 0.000 B 618 VAL CB C 13 32.818 0.000 B 618 VAL CGy C 13 21.414 0.000 B 618 VAL CGx C 13 20.564 0.000 B 618 VAL N N 15 118.639 0.000 B 619 PHE H H 1 8.223 0.000 B 619 PHE HA H 1 4.618 0.000 B 619 PHE HBx H 1 2.901 0.000 B 619 PHE HBy H 1 2.967 0.000 B 619 PHE HDx H 1 7.194 0.000 B 619 PHE HDy H 1 7.194 0.000 B 619 PHE HEx H 1 7.229 0.000 B 619 PHE HEy H 1 7.229 0.000 B 619 PHE HZ H 1 7.115 0.000 B 619 PHE C C 13 175.634 0.000 B 619 PHE CA C 13 57.318 0.000 B 619 PHE CB C 13 39.558 0.000 B 619 PHE CDx C 13 131.770 0.000 B 619 PHE CEx C 13 131.434 0.000 B 619 PHE CZ C 13 129.649 0.000 B 619 PHE N N 15 122.033 0.000 B 620 GLU H H 1 8.273 0.000 B 620 GLU HA H 1 4.267 0.000 B 620 GLU HBx H 1 1.962 0.000 B 620 GLU HBy H 1 1.962 0.000 B 620 GLU HGx H 1 2.163 0.000 B 620 GLU HGy H 1 2.163 0.000 B 620 GLU C C 13 175.851 0.000 B 620 GLU CA C 13 56.767 0.000 B 620 GLU CB C 13 30.511 0.000 B 620 GLU CG C 13 36.215 0.000 B 620 GLU N N 15 121.922 0.000 B 621 TRP H H 1 7.850 0.000 B 621 TRP HA H 1 4.680 0.000 B 621 TRP HBx H 1 2.952 0.000 B 621 TRP HBy H 1 3.184 0.000 B 621 TRP HD1 H 1 7.267 0.000 B 621 TRP HE1 H 1 10.396 0.000 B 621 TRP HE3 H 1 7.556 0.000 B 621 TRP HH2 H 1 7.011 0.000 B 621 TRP HZ2 H 1 7.338 0.000 B 621 TRP HZ3 H 1 7.043 0.000 B 621 TRP C C 13 176.040 0.000 B 621 TRP CA C 13 56.697 0.000 B 621 TRP CB C 13 32.374 0.009 B 621 TRP CD1 C 13 127.632 0.000 B 621 TRP CE3 C 13 121.316 0.000 B 621 TRP CH2 C 13 124.074 0.000 B 621 TRP CZ2 C 13 114.764 0.000 B 621 TRP CZ3 C 13 121.411 0.000 B 621 TRP N N 15 120.736 0.000 B 621 TRP NE1 N 15 130.565 0.000 B 622 GLU H H 1 8.027 0.000 B 622 GLU HA H 1 4.151 0.000 B 622 GLU HBx H 1 1.752 0.000 B 622 GLU HBy H 1 1.823 0.000 B 622 GLU HGx H 1 1.964 0.000 B 622 GLU HGy H 1 1.999 0.000 B 622 GLU C C 13 175.641 0.000 B 622 GLU CA C 13 57.093 0.000 B 622 GLU CB C 13 30.434 0.002 B 622 GLU CG C 13 36.209 0.003 B 622 GLU N N 15 122.552 0.000 B 623 ASP H H 1 8.141 0.000 B 623 ASP HA H 1 4.628 0.000 B 623 ASP HBx H 1 2.550 0.000 B 623 ASP HBy H 1 2.731 0.000 B 623 ASP C C 13 175.769 0.000 B 623 ASP CA C 13 54.152 0.000 B 623 ASP CB C 13 41.861 0.005 B 623 ASP N N 15 120.965 0.000 B 624 ASP H H 1 8.241 0.000 B 624 ASP HA H 1 4.602 0.000 B 624 ASP HBx H 1 2.655 0.000 B 624 ASP HBy H 1 2.655 0.000 B 624 ASP C C 13 176.588 0.000 B 624 ASP CA C 13 54.630 0.000 B 624 ASP CB C 13 41.514 0.000 B 624 ASP N N 15 120.962 0.000 B 625 GLU H H 1 8.519 0.000 B 625 GLU HA H 1 4.305 0.000 B 625 GLU HBx H 1 1.965 0.000 B 625 GLU HBy H 1 2.115 0.000 B 625 GLU HGx H 1 2.230 0.000 B 625 GLU HGy H 1 2.285 0.000 B 625 GLU C C 13 176.461 0.000 B 625 GLU CA C 13 56.767 0.000 B 625 GLU CB C 13 30.248 0.006 B 625 GLU CG C 13 36.440 0.004 B 625 GLU N N 15 121.292 0.000 B 626 SER H H 1 8.323 0.000 B 626 SER HA H 1 4.423 0.000 B 626 SER HBx H 1 3.846 0.000 B 626 SER HBy H 1 3.917 0.000 B 626 SER C C 13 174.341 0.000 B 626 SER CA C 13 58.514 0.000 B 626 SER CB C 13 63.953 0.004 B 626 SER N N 15 116.111 0.000 B 627 ASP H H 1 8.278 0.000 B 627 ASP HA H 1 4.617 0.000 B 627 ASP HBx H 1 2.628 0.000 B 627 ASP HBy H 1 2.727 0.000 B 627 ASP C C 13 176.004 0.000 B 627 ASP CA C 13 54.410 0.000 B 627 ASP CB C 13 41.348 0.003 B 627 ASP N N 15 122.546 0.000 B 628 GLU H H 1 8.217 0.000 B 628 GLU HA H 1 4.250 0.000 B 628 GLU HBx H 1 1.953 0.000 B 628 GLU HBy H 1 2.055 0.000 B 628 GLU HGx H 1 2.230 0.000 B 628 GLU HGy H 1 2.319 0.000 B 628 GLU C C 13 176.322 0.000 B 628 GLU CA C 13 57.273 0.000 B 628 GLU CB C 13 30.493 0.003 B 628 GLU CG C 13 36.276 0.004 B 628 GLU N N 15 120.743 0.000 B 629 ILE H H 1 8.073 0.000 B 629 ILE HA H 1 3.975 0.000 B 629 ILE HB H 1 1.550 0.000 B 629 ILE HD1% H 1 0.552 0.000 B 629 ILE HG1x H 1 0.970 0.000 B 629 ILE HG1y H 1 1.100 0.000 B 629 ILE HG2% H 1 0.523 0.000 B 629 ILE C C 13 173.873 0.000 B 629 ILE CA C 13 60.199 0.000 B 629 ILE CB C 13 37.477 0.000 B 629 ILE CD1 C 13 13.088 0.000 B 629 ILE CG1 C 13 26.808 0.001 B 629 ILE CG2 C 13 17.014 0.000 B 629 ILE N N 15 120.905 0.000 B 630 ALA H H 1 7.726 0.000 B 630 ALA HA H 1 4.242 0.000 B 630 ALA HB% H 1 1.350 0.000 B 630 ALA CA C 13 53.488 0.000 B 630 ALA CB C 13 21.059 0.000 B 630 ALA N N 15 132.760 0.000 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _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 57 VAL HGy% A 58 GLY H 1.0 . 4.27 2 2 A 58 GLY H A 56 THR HG2% 1.0 . 4.83 3 3 A 58 GLY H A 57 VAL HB 1.0 . 3.47 4 4 A 58 GLY H A 59 GLN HGx 1.0 . 4.68 5 4 A 58 GLY H A 59 GLN HGy 1.0 . 4.68 6 5 A 58 GLY H A 88 ALA HA 1.0 . 5.32 7 6 A 58 GLY H A 56 THR HG1 1.0 . 4.69 8 7 A 58 GLY H A 57 VAL H 1.0 . 3.69 9 8 A 15 LYS HBx A 103 GLY H 1.0 . 5.50 10 9 A 103 GLY H A 102 ASP H 1.0 . 3.51 11 10 A 103 GLY H A 101 LYS HBx 1.0 . 4.60 12 10 A 103 GLY H A 101 LYS HBy 1.0 . 4.60 13 11 A 103 GLY H A 102 ASP HBx 1.0 . 4.93 14 12 A 103 GLY H A 102 ASP HBy 1.0 . 4.93 15 13 A 103 GLY H A 100 ASP HBx 1.0 . 4.36 16 14 A 103 GLY H A 100 ASP HBy 1.0 . 4.36 17 15 A 103 GLY H A 101 LYS HA 1.0 . 4.15 18 16 A 103 GLY H A 100 ASP HA 1.0 . 4.48 19 17 A 103 GLY H A 18 SER HG 1.0 . 5.33 20 18 A 103 GLY H A 11 PHE HZ 1.0 . 5.50 21 19 A 103 GLY H A 106 TYR HE% 1.0 . 4.83 22 20 A 103 GLY H A 100 ASP H 1.0 . 4.66 23 21 A 103 GLY H A 104 PHE H 1.0 . 3.65 24 22 A 113 ASN HD2x A 84 LEU HDy% 1.0 . 4.66 25 23 A 113 ASN HD2y A 84 LEU HDy% 1.0 . 4.85 26 24 A 113 ASN HD2y A 84 LEU HDx% 1.0 . 4.85 27 25 A 113 ASN HD2x A 113 ASN HA 1.0 . 4.88 28 26 A 113 ASN HD2y A 113 ASN HA 1.0 . 4.97 29 27 A 41 ILE HG2% A 111 GLY H 1.0 . 3.75 30 28 A 111 GLY H A 41 ILE HD1% 1.0 . 3.75 31 29 A 111 GLY H A 36 ALA HB% 1.0 . 4.94 32 30 A 111 GLY H A 41 ILE HG1x 1.0 . 4.70 33 31 A 111 GLY H A 41 ILE HB 1.0 . 4.98 34 32 A 111 GLY H A 39 SER HBx 1.0 . 4.31 35 33 A 111 GLY H A 39 SER HBy 1.0 . 4.31 36 34 A 111 GLY H A 39 SER HA 1.0 . 4.75 37 35 A 111 GLY H A 110 SER HA 1.0 . 3.21 38 36 A 111 GLY H A 109 TYR HD% 1.0 . 5.28 39 37 A 7 SER H A 7 SER HBx 1.0 . 3.52 40 38 A 7 SER H A 7 SER HBy 1.0 . 3.52 41 39 A 7 SER H A 8 GLU H 1.0 . 3.37 42 40 A 7 SER H A 6 LYS H 1.0 . 3.84 43 41 A 29 ILE HG1x A 54 ASP H 1.0 . 5.13 44 42 A 54 ASP H A 29 ILE HG1y 1.0 . 4.87 45 43 A 54 ASP H A 53 ALA HB% 1.0 . 3.61 46 44 A 54 ASP H A 55 LEU HBx 1.0 . 4.13 47 45 A 54 ASP H A 55 LEU HBy 1.0 . 4.62 48 46 A 54 ASP H A 52 PRO HBy 1.0 . 3.85 49 47 A 54 ASP H A 52 PRO HBx 1.0 . 4.04 50 48 A 54 ASP H A 54 ASP HBx 1.0 . 3.90 51 49 A 54 ASP H A 54 ASP HBy 1.0 . 3.90 52 50 A 54 ASP H A 92 SER HBx 1.0 . 4.96 53 50 A 54 ASP H A 92 SER HBy 1.0 . 4.96 54 51 A 54 ASP H A 52 PRO HA 1.0 . 3.99 55 52 A 54 ASP H A 55 LEU H 1.0 . 3.07 56 53 A 59 GLN HE2x A 55 LEU HDy% 1.0 . 6.29 57 54 A 59 GLN HE2y A 59 GLN HGx 1.0 . 3.81 58 54 A 59 GLN HGy A 59 GLN HE2y 1.0 . 3.81 59 55 A 59 GLN HE2x A 59 GLN HGx 1.0 . 3.81 60 55 A 59 GLN HGy A 59 GLN HE2x 1.0 . 3.81 61 56 A 59 GLN HE2y A 56 THR H 1.0 . 5.21 62 57 A 68 ILE H A 68 ILE HD1% 1.0 . 4.14 63 58 A 68 ILE H A 68 ILE HG2% 1.0 . 3.59 64 59 A 68 ILE H A 68 ILE HG1x 1.0 . 3.56 65 60 A 68 ILE H A 68 ILE HG1y 1.0 . 3.56 66 61 A 68 ILE H A 68 ILE HB 1.0 . 3.62 67 62 A 68 ILE H A 67 ARG HBy 1.0 . 3.98 68 63 A 68 ILE H A 69 MET HGx 1.0 . 5.44 69 63 A 68 ILE H A 69 MET HGy 1.0 . 5.44 70 64 A 68 ILE H A 64 ILE HA 1.0 . 5.06 71 65 A 68 ILE H A 65 ARG HA 1.0 . 4.31 72 66 A 68 ILE H A 69 MET HA 1.0 . 4.76 73 67 A 68 ILE H A 69 MET H 1.0 . 3.04 74 68 A 80 VAL HB A 83 THR H 1.0 . 5.50 75 69 A 83 THR H A 82 ASP HBx 1.0 . 4.61 76 70 A 83 THR H A 82 ASP HBy 1.0 . 4.61 77 71 A 83 THR H A 79 PHE HBx 1.0 . 4.48 78 71 A 83 THR H A 79 PHE HBy 1.0 . 4.48 79 72 A 83 THR H A 81 ASN HBy 1.0 . 5.05 80 73 A 83 THR H A 83 THR HB 1.0 . 3.22 81 74 A 83 THR H A 82 ASP HA 1.0 . 3.17 82 75 A 83 THR H A 81 ASN HA 1.0 . 4.73 83 76 A 83 THR H A 79 PHE HA 1.0 . 4.31 84 77 A 83 THR H A 79 PHE HD% 1.0 . 4.87 85 78 A 83 THR H A 82 ASP H 1.0 . 2.99 86 79 A 83 THR H A 80 VAL H 1.0 . 3.14 87 80 A 83 THR H A 81 ASN H 1.0 . 4.43 88 81 A 81 ASN HBy A 82 ASP H 1.0 . 4.74 89 82 A 29 ILE HG2% A 92 SER H 1.0 . 4.68 90 83 A 92 SER H A 90 LEU HDx% 1.0 . 4.66 91 84 A 92 SER H A 91 MET HBy 1.0 . 4.23 92 85 A 92 SER H A 90 LEU HBx 1.0 . 3.38 93 86 A 92 SER H A 91 MET HBx 1.0 . 3.76 94 87 A 92 SER H A 53 ALA HA 1.0 . 4.21 95 88 A 92 SER H A 92 SER HA 1.0 . 2.89 96 89 A 92 SER H A 90 LEU HA 1.0 . 4.31 97 90 A 92 SER H A 54 ASP HA 1.0 . 5.50 98 91 A 92 SER H A 56 THR HA 1.0 . 5.16 99 92 A 92 SER H A 94 ILE H 1.0 . 4.75 100 93 A 92 SER H A 91 MET H 1.0 . 3.60 101 94 A 114 THR H A 114 THR HG2% 1.0 . 4.04 102 95 A 114 THR H A 113 ASN HBx 1.0 . 4.71 103 96 A 114 THR H A 113 ASN HBy 1.0 . 4.71 104 97 A 114 THR H A 114 THR HB 1.0 . 3.66 105 98 A 114 THR H A 79 PHE HZ 1.0 . 4.28 106 99 A 114 THR H A 113 ASN H 1.0 . 3.61 107 100 A 114 THR H A 112 GLU H 1.0 . 4.94 108 101 A 78 ILE HD1% A 110 SER H 1.0 . 4.70 109 102 A 41 ILE HG2% A 110 SER H 1.0 . 5.50 110 103 A 36 ALA HB% A 110 SER H 1.0 . 4.84 111 104 A 110 SER H A 76 ILE HG1y 1.0 . 4.42 112 105 A 110 SER H A 77 PHE HBx 1.0 . 4.11 113 106 A 110 SER H A 77 PHE HBy 1.0 . 5.16 114 107 A 110 SER H A 109 TYR HBx 1.0 . 3.60 115 108 A 110 SER H A 110 SER HBx 1.0 . 3.99 116 109 A 110 SER H A 110 SER HBy 1.0 . 3.99 117 110 A 110 SER H A 76 ILE HA 1.0 . 4.24 118 111 A 110 SER H A 78 ILE HA 1.0 . 4.12 119 112 A 110 SER H A 109 TYR HA 1.0 . 3.07 120 113 A 109 TYR HD% A 110 SER H 1.0 . 4.26 121 114 A 79 PHE HD% A 110 SER H 1.0 . 4.37 122 115 A 110 SER H A 79 PHE HE% 1.0 . 5.07 123 116 A 111 GLY H A 110 SER H 1.0 . 4.50 124 117 A 36 ALA HB% A 39 SER H 1.0 . 3.44 125 118 A 39 SER H A 38 LYS HDx 1.0 . 5.50 126 119 A 39 SER H A 38 LYS HBx 1.0 . 4.17 127 120 A 39 SER H A 38 LYS HBy 1.0 . 4.17 128 121 A 39 SER H A 39 SER HBx 1.0 . 3.14 129 122 A 39 SER H A 37 GLU HA 1.0 . 4.41 130 123 A 39 SER H A 39 SER HBy 1.0 . 3.14 131 124 A 39 SER H A 38 LYS HA 1.0 . 3.63 132 125 A 39 SER H A 38 LYS H 1.0 . 3.13 133 126 A 39 SER H A 37 GLU H 1.0 . 4.44 134 127 A 39 SER H A 40 ASP H 1.0 . 4.81 135 128 A 27 ASN HD2x A 27 ASN HBx 1.0 . 3.91 136 129 A 27 ASN HD2y A 27 ASN HBx 1.0 . 3.35 137 130 A 27 ASN HD2x A 27 ASN HBy 1.0 . 3.91 138 131 A 27 ASN HD2y A 27 ASN HBy 1.0 . 3.35 139 132 A 98 HIS H A 105 LEU HDx% 1.0 . 4.39 140 133 A 98 HIS H A 105 LEU HDy% 1.0 . 4.39 141 134 A 98 HIS H A 94 ILE HG2% 1.0 . 4.17 142 135 A 98 HIS H A 99 LYS HBx 1.0 . 4.30 143 135 A 98 HIS H A 99 LYS HBy 1.0 . 4.30 144 136 A 98 HIS H A 97 GLU HBy 1.0 . 4.16 145 137 A 98 HIS H A 97 GLU HBx 1.0 . 4.59 146 138 A 98 HIS H A 98 HIS HBx 1.0 . 3.36 147 139 A 98 HIS H A 98 HIS HBy 1.0 . 3.81 148 140 A 98 HIS H A 95 TYR HA 1.0 . 3.76 149 141 A 98 HIS H A 94 ILE HA 1.0 . 4.28 150 142 A 98 HIS H A 98 HIS HD2 1.0 . 4.79 151 143 A 6 LYS H A 5 PHE HBx 1.0 . 4.94 152 144 A 6 LYS H A 5 PHE HBy 1.0 . 4.94 153 145 A 6 LYS H A 4 THR H 1.0 . 4.84 154 146 A 56 THR H A 55 LEU HDx% 1.0 . 4.14 155 147 A 56 THR H A 55 LEU HDy% 1.0 . 4.14 156 148 A 55 LEU HBx A 56 THR H 1.0 . 4.69 157 149 A 55 LEU HBy A 56 THR H 1.0 . 4.22 158 150 A 56 THR H A 59 GLN HGx 1.0 . 3.81 159 150 A 59 GLN HGy A 56 THR H 1.0 . 3.81 160 151 A 56 THR H A 55 LEU HA 1.0 . 3.10 161 152 A 56 THR H A 56 THR HB 1.0 . 4.11 162 153 A 56 THR HG1 A 56 THR H 1.0 . 4.40 163 154 A 55 LEU H A 56 THR H 1.0 . 4.76 164 155 A 59 GLN HE2x A 56 THR H 1.0 . 5.21 165 156 A 76 ILE H A 76 ILE HG2% 1.0 . 3.42 166 157 A 76 ILE H A 76 ILE HB 1.0 . 3.38 167 158 A 76 ILE H A 65 ARG HDx 1.0 . 4.92 168 158 A 76 ILE H A 65 ARG HDy 1.0 . 4.92 169 159 A 76 ILE H A 75 ALA HA 1.0 . 2.64 170 160 A 76 ILE H A 65 ARG HH2% 1.0 . 4.46 171 161 A 76 ILE H A 77 PHE H 1.0 . 4.38 172 162 A 97 GLU H A 99 LYS HBx 1.0 . 4.96 173 162 A 99 LYS HBy A 97 GLU H 1.0 . 4.96 174 163 A 97 GLU H A 97 GLU HGx 1.0 . 3.25 175 164 A 97 GLU HBy A 97 GLU H 1.0 . 3.01 176 165 A 97 GLU HBx A 97 GLU H 1.0 . 3.80 177 166 A 97 GLU H A 97 GLU HGy 1.0 . 3.98 178 167 A 97 GLU H A 96 GLN HBy 1.0 . 3.63 179 168 A 98 HIS HBx A 97 GLU H 1.0 . 4.46 180 169 A 98 HIS HBy A 97 GLU H 1.0 . 5.50 181 170 A 97 GLU H A 93 ALA HA 1.0 . 4.94 182 171 A 98 HIS H A 97 GLU H 1.0 . 3.00 183 172 A 27 ASN H A 28 ARG HGx 1.0 . 4.77 184 172 A 27 ASN H A 28 ARG HGy 1.0 . 4.77 185 173 A 27 ASN H A 26 PRO HBx 1.0 . 4.54 186 174 A 27 ASN H A 26 PRO HBy 1.0 . 4.42 187 175 A 27 ASN H A 27 ASN HBx 1.0 . 3.83 188 176 A 27 ASN H A 27 ASN HBy 1.0 . 3.83 189 177 A 27 ASN H A 26 PRO HDx 1.0 . 4.73 190 178 A 27 ASN H A 26 PRO HDy 1.0 . 4.73 191 179 A 27 ASN H A 25 PHE HA 1.0 . 4.84 192 180 A 57 VAL HGx% A 87 THR H 1.0 . 4.62 193 181 A 57 VAL HGy% A 87 THR H 1.0 . 5.50 194 182 A 87 THR H A 87 THR HG2% 1.0 . 3.18 195 183 A 87 THR H A 88 ALA HB% 1.0 . 4.36 196 184 A 87 THR H A 89 ALA HB% 1.0 . 4.76 197 185 A 87 THR H A 86 PRO HBy 1.0 . 3.79 198 186 A 57 VAL HB A 87 THR H 1.0 . 4.73 199 187 A 87 THR H A 86 PRO HBx 1.0 . 3.68 200 188 A 87 THR H A 87 THR HB 1.0 . 3.60 201 189 A 87 THR H A 86 PRO HA 1.0 . 2.78 202 190 A 87 THR H A 89 ALA H 1.0 . 4.89 203 191 A 87 THR H A 88 ALA H 1.0 . 3.26 204 192 A 21 ILE HG2% A 23 ASP H 1.0 . 4.74 205 193 A 23 ASP H A 23 ASP HBy 1.0 . 2.72 206 194 A 23 ASP H A 23 ASP HBx 1.0 . 2.89 207 195 A 23 ASP H A 21 ILE HA 1.0 . 4.56 208 196 A 23 ASP H A 24 ARG HA 1.0 . 4.96 209 197 A 23 ASP H A 20 ARG HA 1.0 . 3.50 210 198 A 23 ASP H A 24 ARG H 1.0 . 3.14 211 199 A 23 ASP H A 22 ALA H 1.0 . 3.14 212 200 A 23 ASP H A 21 ILE H 1.0 . 4.52 213 201 A 23 ASP H A 25 PHE H 1.0 . 4.23 214 202 A 29 ILE HG2% A 96 GLN H 1.0 . 4.96 215 203 A 96 GLN H A 99 LYS HBx 1.0 . 5.27 216 203 A 99 LYS HBy A 96 GLN H 1.0 . 5.27 217 204 A 97 GLU HGx A 96 GLN H 1.0 . 4.70 218 205 A 97 GLU HBy A 96 GLN H 1.0 . 4.52 219 206 A 96 GLN H A 93 ALA HB% 1.0 . 4.80 220 207 A 97 GLU HBx A 96 GLN H 1.0 . 5.50 221 208 A 96 GLN HBy A 96 GLN H 1.0 . 2.90 222 209 A 96 GLN H A 96 GLN HBx 1.0 . 3.51 223 210 A 96 GLN H A 96 GLN HGx 1.0 . 3.87 224 210 A 96 GLN H A 96 GLN HGy 1.0 . 3.87 225 211 A 96 GLN H A 95 TYR HBx 1.0 . 4.48 226 212 A 96 GLN H A 95 TYR HBy 1.0 . 3.44 227 213 A 93 ALA HA A 96 GLN H 1.0 . 3.79 228 214 A 96 GLN H A 95 TYR HD% 1.0 . 4.06 229 215 A 97 GLU H A 96 GLN H 1.0 . 3.21 230 216 A 96 GLN H A 95 TYR H 1.0 . 3.46 231 217 A 38 LYS H A 38 LYS HGx 1.0 . 3.33 232 218 A 38 LYS H A 38 LYS HGy 1.0 . 3.33 233 219 A 38 LYS H A 38 LYS HBx 1.0 . 3.74 234 220 A 38 LYS H A 38 LYS HBy 1.0 . 3.74 235 221 A 38 LYS H A 37 GLU HBx 1.0 . 3.74 236 222 A 38 LYS H A 37 GLU HBy 1.0 . 4.05 237 223 A 38 LYS H A 37 GLU HGx 1.0 . 4.48 238 224 A 38 LYS H A 37 GLU HGy 1.0 . 4.48 239 225 A 73 GLU H A 74 LYS HBx 1.0 . 4.88 240 226 A 73 GLU H A 73 GLU HGx 1.0 . 3.57 241 227 A 73 GLU H A 73 GLU HGy 1.0 . 3.57 242 228 A 73 GLU H A 71 PRO HBy 1.0 . 3.95 243 229 A 73 GLU H A 72 PRO HDx 1.0 . 3.47 244 229 A 73 GLU H A 72 PRO HDy 1.0 . 3.47 245 230 A 73 GLU H A 72 PRO HA 1.0 . 3.37 246 231 A 73 GLU H A 74 LYS HA 1.0 . 5.33 247 232 A 73 GLU H A 74 LYS H 1.0 . 3.04 248 233 A 8 GLU H A 9 TYR H 1.0 . 4.46 249 234 A 12 GLU H A 15 LYS HBy 1.0 . 5.33 250 235 A 12 GLU H A 15 LYS HDy 1.0 . 5.50 251 236 A 12 GLU H A 12 GLU HBx 1.0 . 2.99 252 236 A 12 GLU H A 12 GLU HBy 1.0 . 2.99 253 237 A 12 GLU H A 12 GLU HGx 1.0 . 3.99 254 238 A 12 GLU H A 12 GLU HGy 1.0 . 3.99 255 239 A 12 GLU H A 11 PHE HBy 1.0 . 3.43 256 240 A 12 GLU H A 10 PRO HA 1.0 . 5.08 257 241 A 12 GLU H A 13 LYS H 1.0 . 3.49 258 242 A 12 GLU H A 14 ARG H 1.0 . 4.97 259 243 A 12 GLU H A 11 PHE H 1.0 . 3.94 260 244 A 81 ASN HBx A 81 ASN HD2y 1.0 . 3.68 261 245 A 83 THR H A 81 ASN HD2y 1.0 . 5.50 262 246 A 83 THR H A 81 ASN HD2x 1.0 . 5.50 263 247 A 114 THR HG2% A 116 GLY H 1.0 . 4.87 264 248 A 116 GLY H A 115 PHE HBx 1.0 . 4.62 265 249 A 116 GLY H A 115 PHE HBy 1.0 . 4.62 266 250 A 116 GLY H A 116 GLY HAx 1.0 . 2.69 267 250 A 116 GLY H A 116 GLY HAy 1.0 . 2.69 268 251 A 114 THR HB A 116 GLY H 1.0 . 4.80 269 252 A 116 GLY H A 115 PHE HA 1.0 . 2.89 270 253 A 68 ILE HD1% A 66 LYS H 1.0 . 5.50 271 254 A 66 LYS H A 76 ILE HD1% 1.0 . 5.50 272 255 A 66 LYS H A 66 LYS HGx 1.0 . 4.10 273 256 A 66 LYS H A 66 LYS HGy 1.0 . 4.10 274 257 A 66 LYS H A 66 LYS HBx 1.0 . 2.88 275 258 A 66 LYS H A 66 LYS HBy 1.0 . 3.50 276 259 A 66 LYS H A 63 VAL HB 1.0 . 5.50 277 260 A 66 LYS H A 65 ARG HDx 1.0 . 5.50 278 260 A 65 ARG HDy A 66 LYS H 1.0 . 5.50 279 261 A 66 LYS H A 63 VAL HA 1.0 . 3.79 280 262 A 66 LYS H A 67 ARG H 1.0 . 3.40 281 263 A 66 LYS H A 65 ARG H 1.0 . 3.46 282 264 A 21 ILE HG2% A 25 PHE H 1.0 . 4.32 283 265 A 25 PHE H A 24 ARG HBx 1.0 . 3.81 284 266 A 25 PHE H A 24 ARG HBy 1.0 . 3.81 285 267 A 26 PRO HBx A 25 PHE H 1.0 . 5.50 286 268 A 25 PHE H A 25 PHE HBy 1.0 . 4.04 287 269 A 25 PHE H A 25 PHE HBx 1.0 . 3.62 288 270 A 25 PHE H A 26 PRO HDx 1.0 . 4.58 289 271 A 25 PHE H A 26 PRO HDy 1.0 . 4.58 290 272 A 21 ILE HA A 25 PHE H 1.0 . 3.96 291 273 A 25 PHE H A 22 ALA HA 1.0 . 4.39 292 274 A 25 PHE H A 23 ASP HA 1.0 . 5.40 293 275 A 25 PHE H A 25 PHE HD% 1.0 . 3.99 294 276 A 24 ARG H A 25 PHE H 1.0 . 3.28 295 277 A 21 ILE HG2% A 24 ARG H 1.0 . 4.93 296 278 A 24 ARG H A 24 ARG HBx 1.0 . 3.66 297 279 A 24 ARG H A 24 ARG HBy 1.0 . 3.66 298 280 A 23 ASP HBy A 24 ARG H 1.0 . 3.47 299 281 A 23 ASP HBx A 24 ARG H 1.0 . 4.16 300 282 A 24 ARG H A 24 ARG HDx 1.0 . 5.50 301 283 A 24 ARG H A 25 PHE HBx 1.0 . 5.50 302 284 A 24 ARG H A 24 ARG HDy 1.0 . 5.50 303 285 A 21 ILE HA A 24 ARG H 1.0 . 4.24 304 286 A 24 ARG H A 22 ALA HA 1.0 . 4.87 305 287 A 28 ARG H A 29 ILE HD1% 1.0 . 4.79 306 288 A 21 ILE HG2% A 28 ARG H 1.0 . 5.34 307 289 A 28 ARG H A 28 ARG HBx 1.0 . 3.72 308 290 A 28 ARG H A 28 ARG HGx 1.0 . 3.63 309 290 A 28 ARG HGy A 28 ARG H 1.0 . 3.63 310 291 A 28 ARG H A 28 ARG HBy 1.0 . 3.76 311 292 A 25 PHE HBy A 28 ARG H 1.0 . 4.51 312 293 A 25 PHE HBx A 28 ARG H 1.0 . 4.79 313 294 A 52 PRO HA A 28 ARG H 1.0 . 5.46 314 295 A 28 ARG H A 26 PRO HA 1.0 . 4.18 315 296 A 28 ARG H A 27 ASN HA 1.0 . 3.26 316 297 A 27 ASN H A 28 ARG H 1.0 . 3.12 317 298 A 28 ARG H A 29 ILE H 1.0 . 4.57 318 299 A 21 ILE HG2% A 18 SER H 1.0 . 5.50 319 300 A 18 SER H A 16 ALA HB% 1.0 . 5.37 320 301 A 18 SER H A 21 ILE HB 1.0 . 4.85 321 302 A 18 SER H A 17 GLU HBx 1.0 . 4.07 322 303 A 18 SER H A 17 GLU HBy 1.0 . 4.07 323 304 A 18 SER H A 17 GLU HGx 1.0 . 3.98 324 304 A 18 SER H A 17 GLU HGy 1.0 . 3.98 325 305 A 18 SER H A 18 SER HBx 1.0 . 3.96 326 306 A 18 SER H A 18 SER HBy 1.0 . 3.96 327 307 A 18 SER H A 19 GLU HA 1.0 . 5.41 328 308 A 18 SER H A 16 ALA HA 1.0 . 5.32 329 309 A 18 SER H A 15 LYS HA 1.0 . 4.10 330 310 A 18 SER HG A 18 SER H 1.0 . 4.18 331 311 A 18 SER H A 104 PHE HZ 1.0 . 4.76 332 312 A 18 SER H A 104 PHE HE% 1.0 . 4.24 333 313 A 18 SER H A 19 GLU H 1.0 . 3.52 334 314 A 76 ILE HG2% A 78 ILE H 1.0 . 5.06 335 315 A 78 ILE HD1% A 78 ILE H 1.0 . 3.68 336 316 A 78 ILE H A 78 ILE HG1x 1.0 . 3.84 337 317 A 78 ILE H A 78 ILE HG1y 1.0 . 3.89 338 318 A 78 ILE H A 78 ILE HB 1.0 . 3.56 339 319 A 77 PHE HBx A 78 ILE H 1.0 . 4.51 340 320 A 77 PHE HBy A 78 ILE H 1.0 . 3.80 341 321 A 78 ILE H A 77 PHE HA 1.0 . 2.98 342 322 A 109 TYR HA A 78 ILE H 1.0 . 4.99 343 323 A 78 ILE H A 77 PHE HD% 1.0 . 4.48 344 324 A 77 PHE H A 78 ILE H 1.0 . 4.48 345 325 A 78 ILE H A 79 PHE H 1.0 . 4.70 346 326 A 15 LYS HBx A 16 ALA H 1.0 . 4.12 347 327 A 16 ALA H A 15 LYS HGx 1.0 . 3.96 348 328 A 16 ALA H A 19 GLU HGx 1.0 . 5.50 349 329 A 16 ALA H A 19 GLU HGy 1.0 . 5.50 350 330 A 16 ALA H A 12 GLU HA 1.0 . 4.32 351 331 A 16 ALA H A 13 LYS HA 1.0 . 3.73 352 332 A 16 ALA H A 17 GLU HA 1.0 . 5.50 353 333 A 14 ARG H A 16 ALA H 1.0 . 4.69 354 334 A 16 ALA H A 17 GLU H 1.0 . 3.41 355 335 A 16 ALA H A 15 LYS H 1.0 . 3.47 356 336 A 61 VAL HGx% A 65 ARG HE 1.0 . 5.06 357 337 A 75 ALA HA A 65 ARG HE 1.0 . 5.50 358 338 A 80 VAL H A 80 VAL HGx% 1.0 . 3.96 359 339 A 80 VAL H A 83 THR HG2% 1.0 . 4.70 360 340 A 80 VAL H A 84 LEU HG 1.0 . 5.48 361 341 A 80 VAL HB A 80 VAL H 1.0 . 3.64 362 342 A 80 VAL H A 85 PRO HGx 1.0 . 5.48 363 343 A 80 VAL H A 79 PHE HBx 1.0 . 3.80 364 343 A 79 PHE HBy A 80 VAL H 1.0 . 3.80 365 344 A 80 VAL H A 85 PRO HDy 1.0 . 3.74 366 345 A 80 VAL H A 85 PRO HDx 1.0 . 4.31 367 346 A 80 VAL H A 84 LEU HA 1.0 . 4.15 368 347 A 79 PHE HA A 80 VAL H 1.0 . 2.97 369 348 A 79 PHE HD% A 80 VAL H 1.0 . 4.69 370 349 A 80 VAL H A 79 PHE HE% 1.0 . 5.50 371 350 A 80 VAL H A 79 PHE H 1.0 . 4.41 372 351 A 114 THR HG2% A 113 ASN H 1.0 . 5.50 373 352 A 113 ASN H A 113 ASN HBx 1.0 . 3.59 374 353 A 113 ASN H A 113 ASN HBy 1.0 . 3.59 375 354 A 113 ASN H A 112 GLU HGy 1.0 . 4.77 376 355 A 113 ASN H A 112 GLU HA 1.0 . 3.03 377 356 A 113 ASN HD2y A 113 ASN H 1.0 . 5.12 378 357 A 113 ASN H A 77 PHE HE% 1.0 . 4.35 379 358 A 15 LYS HBy A 13 LYS H 1.0 . 5.50 380 359 A 13 LYS H A 16 ALA HB% 1.0 . 5.50 381 360 A 13 LYS H A 13 LYS HBx 1.0 . 3.63 382 361 A 13 LYS H A 13 LYS HBy 1.0 . 3.63 383 362 A 13 LYS H A 12 GLU HBx 1.0 . 3.49 384 362 A 12 GLU HBy A 13 LYS H 1.0 . 3.49 385 363 A 13 LYS H A 12 GLU HGy 1.0 . 5.34 386 364 A 13 LYS H A 14 ARG H 1.0 . 3.49 387 365 A 3 SER H A 2 LYS HGx 1.0 . 4.86 388 366 A 3 SER H A 2 LYS HGy 1.0 . 4.86 389 367 A 3 SER H A 2 LYS HBx 1.0 . 4.25 390 368 A 3 SER H A 2 LYS HBy 1.0 . 4.25 391 369 A 3 SER H A 3 SER HBx 1.0 . 3.72 392 370 A 3 SER H A 3 SER HBy 1.0 . 3.72 393 371 A 3 SER H A 2 LYS HA 1.0 . 3.63 394 372 A 61 VAL HGx% A 62 TYR H 1.0 . 3.75 395 373 A 62 TYR H A 61 VAL HB 1.0 . 3.29 396 374 A 62 TYR H A 62 TYR HBy 1.0 . 3.02 397 375 A 62 TYR H A 62 TYR HBx 1.0 . 3.07 398 376 A 62 TYR H A 58 GLY HAy 1.0 . 5.24 399 377 A 62 TYR H A 59 GLN HA 1.0 . 3.84 400 378 A 62 TYR H A 61 VAL H 1.0 . 3.38 401 379 A 68 ILE HG2% A 69 MET H 1.0 . 4.44 402 380 A 69 MET H A 68 ILE HG1x 1.0 . 4.29 403 381 A 69 MET H A 68 ILE HG1y 1.0 . 4.29 404 382 A 68 ILE HB A 69 MET H 1.0 . 4.37 405 383 A 69 MET H A 69 MET HBx 1.0 . 4.13 406 384 A 69 MET H A 69 MET HBy 1.0 . 4.13 407 385 A 69 MET H A 69 MET HGx 1.0 . 3.82 408 385 A 69 MET HGy A 69 MET H 1.0 . 3.82 409 386 A 69 MET HA A 69 MET H 1.0 . 2.84 410 387 A 69 MET H A 68 ILE HA 1.0 . 3.55 411 388 A 69 MET H A 70 LEU HA 1.0 . 5.40 412 389 A 61 VAL H A 64 ILE HG1y 1.0 . 5.50 413 390 A 57 VAL HGx% A 61 VAL H 1.0 . 4.07 414 391 A 94 ILE H A 94 ILE HG2% 1.0 . 3.75 415 392 A 78 ILE HG1y A 61 VAL H 1.0 . 5.23 416 393 A 94 ILE H A 94 ILE HG1x 1.0 . 3.47 417 394 A 61 VAL HB A 61 VAL H 1.0 . 3.17 418 395 A 94 ILE H A 94 ILE HB 1.0 . 3.26 419 396 A 94 ILE H A 95 TYR HBx 1.0 . 5.07 420 397 A 94 ILE H A 95 TYR HBy 1.0 . 4.57 421 398 A 61 VAL H A 57 VAL HA 1.0 . 4.46 422 399 A 58 GLY HAy A 61 VAL H 1.0 . 4.73 423 400 A 61 VAL H A 58 GLY HAx 1.0 . 5.50 424 401 A 94 ILE H A 91 MET HA 1.0 . 3.81 425 402 A 61 VAL H A 60 PHE HD% 1.0 . 4.83 426 403 A 94 ILE H A 95 TYR H 1.0 . 3.37 427 404 A 58 GLY H A 61 VAL H 1.0 . 5.32 428 405 A 65 ARG H A 64 ILE HG2% 1.0 . 3.88 429 406 A 65 ARG H A 64 ILE HD1% 1.0 . 4.61 430 407 A 65 ARG H A 64 ILE HG1x 1.0 . 4.13 431 408 A 65 ARG H A 61 VAL HGx% 1.0 . 4.05 432 409 A 65 ARG H A 65 ARG HGx 1.0 . 4.65 433 410 A 65 ARG H A 64 ILE HB 1.0 . 3.36 434 411 A 65 ARG H A 65 ARG HGy 1.0 . 4.65 435 412 A 65 ARG H A 65 ARG HBx 1.0 . 3.12 436 413 A 65 ARG H A 65 ARG HBy 1.0 . 3.12 437 414 A 65 ARG H A 61 VAL HA 1.0 . 4.32 438 415 A 65 ARG H A 62 TYR HA 1.0 . 3.87 439 416 A 65 ARG H A 64 ILE H 1.0 . 3.32 440 417 A 41 ILE HG2% A 112 GLU H 1.0 . 4.30 441 418 A 112 GLU H A 75 ALA HB% 1.0 . 5.50 442 419 A 36 ALA HB% A 112 GLU H 1.0 . 5.42 443 420 A 112 GLU H A 112 GLU HGx 1.0 . 4.02 444 421 A 112 GLU H A 112 GLU HGy 1.0 . 4.02 445 422 A 112 GLU H A 111 GLY HAy 1.0 . 3.38 446 423 A 112 GLU H A 77 PHE HD% 1.0 . 4.30 447 424 A 112 GLU H A 77 PHE HE% 1.0 . 5.36 448 425 A 112 GLU H A 40 ASP H 1.0 . 5.36 449 426 A 64 ILE HD1% A 64 ILE H 1.0 . 3.51 450 427 A 64 ILE HG1x A 64 ILE H 1.0 . 3.31 451 428 A 64 ILE H A 63 VAL HGx% 1.0 . 3.93 452 429 A 64 ILE H A 63 VAL HGy% 1.0 . 3.93 453 430 A 64 ILE HB A 64 ILE H 1.0 . 3.33 454 431 A 64 ILE H A 65 ARG HBx 1.0 . 5.10 455 432 A 64 ILE H A 65 ARG HBy 1.0 . 5.10 456 433 A 61 VAL HA A 64 ILE H 1.0 . 3.50 457 434 A 67 ARG H A 64 ILE HD1% 1.0 . 5.09 458 435 A 68 ILE HG2% A 67 ARG H 1.0 . 5.30 459 436 A 67 ARG H A 44 ILE HD1% 1.0 . 5.50 460 437 A 67 ARG H A 68 ILE HG1x 1.0 . 4.80 461 438 A 67 ARG H A 68 ILE HG1y 1.0 . 4.80 462 439 A 66 LYS HBx A 67 ARG H 1.0 . 3.31 463 440 A 66 LYS HBy A 67 ARG H 1.0 . 3.40 464 441 A 67 ARG H A 67 ARG HGx 1.0 . 3.20 465 442 A 67 ARG H A 67 ARG HBx 1.0 . 3.17 466 443 A 67 ARG HBy A 67 ARG H 1.0 . 3.54 467 444 A 64 ILE HA A 67 ARG H 1.0 . 3.91 468 445 A 67 ARG H A 65 ARG H 1.0 . 4.54 469 446 A 63 VAL HB A 63 VAL H 1.0 . 3.54 470 447 A 62 TYR HBy A 63 VAL H 1.0 . 4.27 471 448 A 62 TYR HBx A 63 VAL H 1.0 . 3.31 472 449 A 63 VAL H A 60 PHE HA 1.0 . 3.84 473 450 A 15 LYS HBx A 15 LYS H 1.0 . 3.56 474 451 A 15 LYS H A 15 LYS HGy 1.0 . 4.06 475 452 A 15 LYS HGx A 15 LYS H 1.0 . 4.12 476 453 A 15 LYS HBy A 15 LYS H 1.0 . 3.43 477 454 A 15 LYS H A 14 ARG HBx 1.0 . 4.02 478 454 A 15 LYS H A 14 ARG HBy 1.0 . 4.02 479 455 A 15 LYS H A 102 ASP HBx 1.0 . 4.85 480 456 A 15 LYS H A 102 ASP HBy 1.0 . 4.85 481 457 A 12 GLU HA A 15 LYS H 1.0 . 3.85 482 458 A 15 LYS H A 102 ASP HA 1.0 . 5.38 483 459 A 13 LYS H A 15 LYS H 1.0 . 4.72 484 460 A 14 ARG H A 15 LYS H 1.0 . 3.81 485 461 A 88 ALA HB% A 90 LEU H 1.0 . 4.26 486 462 A 90 LEU HBx A 90 LEU H 1.0 . 3.67 487 463 A 90 LEU H A 90 LEU HBy 1.0 . 2.89 488 464 A 90 LEU H A 89 ALA HA 1.0 . 2.75 489 465 A 56 THR HA A 90 LEU H 1.0 . 4.61 490 466 A 91 MET H A 90 LEU H 1.0 . 4.64 491 467 A 57 VAL HGx% A 88 ALA H 1.0 . 5.50 492 468 A 87 THR HG2% A 88 ALA H 1.0 . 3.67 493 469 A 88 ALA HB% A 88 ALA H 1.0 . 2.75 494 470 A 86 PRO HBy A 88 ALA H 1.0 . 3.67 495 471 A 109 TYR HBx A 109 TYR H 1.0 . 4.11 496 472 A 109 TYR H A 35 LYS HA 1.0 . 3.52 497 473 A 109 TYR H A 108 THR HB 1.0 . 4.31 498 474 A 87 THR HB A 88 ALA H 1.0 . 4.17 499 475 A 109 TYR H A 108 THR HA 1.0 . 2.97 500 476 A 109 TYR H A 109 TYR HE% 1.0 . 4.71 501 477 A 109 TYR H A 108 THR H 1.0 . 4.39 502 478 A 110 SER H A 109 TYR H 1.0 . 4.65 503 479 A 58 GLY H A 88 ALA H 1.0 . 5.48 504 480 A 108 THR H A 78 ILE HG2% 1.0 . 3.75 505 481 A 108 THR H A 107 VAL HGx% 1.0 . 4.23 506 482 A 78 ILE HB A 108 THR H 1.0 . 5.50 507 483 A 108 THR H A 107 VAL HB 1.0 . 4.10 508 484 A 108 THR H A 79 PHE HBx 1.0 . 4.33 509 484 A 79 PHE HBy A 108 THR H 1.0 . 4.33 510 485 A 108 THR HB A 108 THR H 1.0 . 3.56 511 486 A 108 THR H A 80 VAL HA 1.0 . 4.53 512 487 A 108 THR H A 107 VAL HA 1.0 . 2.95 513 488 A 108 THR H A 33 CYS HA 1.0 . 4.85 514 489 A 21 ILE H A 21 ILE HD1% 1.0 . 3.89 515 490 A 21 ILE HG2% A 21 ILE H 1.0 . 3.72 516 491 A 21 ILE H A 21 ILE HB 1.0 . 3.05 517 492 A 21 ILE H A 20 ARG HBx 1.0 . 4.22 518 493 A 21 ILE H A 20 ARG HBy 1.0 . 4.22 519 494 A 21 ILE H A 18 SER HA 1.0 . 3.92 520 495 A 21 ILE H A 20 ARG H 1.0 . 3.34 521 496 A 105 LEU H A 105 LEU HDx% 1.0 . 4.55 522 497 A 105 LEU H A 105 LEU HDy% 1.0 . 4.55 523 498 A 105 LEU H A 105 LEU HBy 1.0 . 3.72 524 499 A 105 LEU H A 105 LEU HBx 1.0 . 3.40 525 500 A 105 LEU H A 104 PHE HA 1.0 . 3.51 526 501 A 105 LEU H A 31 VAL HA 1.0 . 3.93 527 502 A 105 LEU H A 95 TYR HE% 1.0 . 4.52 528 503 A 95 TYR HD% A 105 LEU H 1.0 . 4.19 529 504 A 105 LEU H A 106 TYR H 1.0 . 4.69 530 505 A 104 PHE H A 105 LEU H 1.0 . 5.15 531 506 A 17 GLU H A 17 GLU HBx 1.0 . 3.33 532 507 A 17 GLU H A 17 GLU HBy 1.0 . 3.33 533 508 A 17 GLU H A 17 GLU HGx 1.0 . 4.06 534 508 A 17 GLU HGy A 17 GLU H 1.0 . 4.06 535 509 A 17 GLU H A 14 ARG HA 1.0 . 4.30 536 510 A 104 PHE HZ A 17 GLU H 1.0 . 5.50 537 511 A 18 SER H A 17 GLU H 1.0 . 3.45 538 512 A 41 ILE HG1x A 43 GLU H 1.0 . 5.06 539 513 A 43 GLU H A 42 PRO HBy 1.0 . 4.26 540 514 A 43 GLU H A 43 GLU HBx 1.0 . 3.29 541 515 A 43 GLU H A 43 GLU HBy 1.0 . 3.29 542 516 A 43 GLU H A 43 GLU HGx 1.0 . 4.05 543 516 A 43 GLU H A 43 GLU HGy 1.0 . 4.05 544 517 A 43 GLU H A 35 LYS HEx 1.0 . 5.06 545 517 A 43 GLU H A 35 LYS HEy 1.0 . 5.06 546 518 A 43 GLU H A 42 PRO HA 1.0 . 2.77 547 519 A 43 GLU H A 44 ILE H 1.0 . 4.90 548 520 A 57 VAL HGy% A 89 ALA H 1.0 . 4.02 549 521 A 89 ALA HB% A 89 ALA H 1.0 . 2.73 550 522 A 86 PRO HBy A 89 ALA H 1.0 . 3.58 551 523 A 89 ALA H A 86 PRO HGy 1.0 . 4.93 552 524 A 57 VAL HB A 89 ALA H 1.0 . 3.97 553 525 A 86 PRO HBx A 89 ALA H 1.0 . 4.99 554 526 A 89 ALA H A 87 THR HA 1.0 . 4.07 555 527 A 88 ALA HA A 89 ALA H 1.0 . 3.62 556 528 A 86 PRO HA A 89 ALA H 1.0 . 5.05 557 529 A 56 THR HB A 89 ALA H 1.0 . 4.42 558 530 A 56 THR HA A 89 ALA H 1.0 . 5.29 559 531 A 89 ALA H A 88 ALA H 1.0 . 3.09 560 532 A 89 ALA H A 90 LEU H 1.0 . 3.94 561 533 A 57 VAL H A 89 ALA H 1.0 . 4.13 562 534 A 58 GLY H A 89 ALA H 1.0 . 4.85 563 535 A 95 TYR H A 29 ILE HD1% 1.0 . 4.22 564 536 A 95 TYR H A 105 LEU HDx% 1.0 . 4.43 565 537 A 95 TYR H A 105 LEU HDy% 1.0 . 4.43 566 538 A 95 TYR H A 94 ILE HG1x 1.0 . 4.40 567 539 A 95 TYR H A 94 ILE HB 1.0 . 3.51 568 540 A 95 TYR HBx A 95 TYR H 1.0 . 3.32 569 541 A 95 TYR HBy A 95 TYR H 1.0 . 3.29 570 542 A 95 TYR HD% A 95 TYR H 1.0 . 4.16 571 543 A 97 GLU H A 95 TYR H 1.0 . 4.36 572 544 A 99 LYS H A 99 LYS HGx 1.0 . 3.77 573 545 A 99 LYS H A 99 LYS HBx 1.0 . 2.85 574 545 A 99 LYS HBy A 99 LYS H 1.0 . 2.85 575 546 A 97 GLU HBy A 99 LYS H 1.0 . 5.50 576 547 A 98 HIS HBx A 99 LYS H 1.0 . 3.99 577 548 A 98 HIS HBy A 99 LYS H 1.0 . 4.56 578 549 A 95 TYR HA A 99 LYS H 1.0 . 4.10 579 550 A 95 TYR HD% A 99 LYS H 1.0 . 5.50 580 551 A 97 GLU H A 99 LYS H 1.0 . 4.00 581 552 A 98 HIS H A 99 LYS H 1.0 . 3.20 582 553 A 100 ASP H A 99 LYS H 1.0 . 4.85 583 554 A 14 ARG H A 15 LYS HGx 1.0 . 5.50 584 555 A 14 ARG H A 13 LYS HBx 1.0 . 4.34 585 556 A 14 ARG H A 13 LYS HBy 1.0 . 4.34 586 557 A 79 PHE H A 78 ILE HG2% 1.0 . 3.52 587 558 A 79 PHE H A 108 THR HG2% 1.0 . 5.07 588 559 A 78 ILE HG1y A 79 PHE H 1.0 . 5.50 589 560 A 79 PHE H A 84 LEU HG 1.0 . 5.50 590 561 A 78 ILE HB A 79 PHE H 1.0 . 4.32 591 562 A 79 PHE H A 109 TYR HBy 1.0 . 5.09 592 563 A 79 PHE H A 79 PHE HBx 1.0 . 3.50 593 563 A 79 PHE HBy A 79 PHE H 1.0 . 3.50 594 564 A 79 PHE H A 108 THR HB 1.0 . 4.40 595 565 A 78 ILE HA A 79 PHE H 1.0 . 2.99 596 566 A 109 TYR HA A 79 PHE H 1.0 . 4.13 597 567 A 79 PHE HD% A 79 PHE H 1.0 . 4.14 598 568 A 79 PHE H A 108 THR H 1.0 . 3.74 599 569 A 68 ILE HG2% A 67 ARG HE 1.0 . 5.50 600 570 A 44 ILE HD1% A 67 ARG HE 1.0 . 5.14 601 571 A 67 ARG HE A 67 ARG HA 1.0 . 5.26 602 572 A 55 LEU H A 55 LEU HDx% 1.0 . 4.47 603 573 A 55 LEU H A 55 LEU HDy% 1.0 . 4.47 604 574 A 55 LEU HBx A 55 LEU H 1.0 . 3.05 605 575 A 55 LEU HBy A 55 LEU H 1.0 . 3.19 606 576 A 52 PRO HBy A 55 LEU H 1.0 . 3.76 607 577 A 55 LEU H A 55 LEU HG 1.0 . 4.65 608 578 A 52 PRO HBx A 55 LEU H 1.0 . 4.61 609 579 A 55 LEU H A 54 ASP HBx 1.0 . 4.64 610 580 A 55 LEU H A 54 ASP HBy 1.0 . 4.64 611 581 A 55 LEU H A 53 ALA HA 1.0 . 4.57 612 582 A 55 LEU H A 91 MET H 1.0 . 5.38 613 583 A 44 ILE HD1% A 46 LYS H 1.0 . 3.89 614 584 A 46 LYS H A 44 ILE HG1x 1.0 . 3.58 615 585 A 46 LYS H A 46 LYS HBx 1.0 . 3.27 616 585 A 46 LYS H A 46 LYS HBy 1.0 . 3.27 617 586 A 46 LYS H A 45 ASP HBx 1.0 . 4.05 618 586 A 46 LYS H A 45 ASP HBy 1.0 . 4.05 619 587 A 46 LYS H A 67 ARG HDx 1.0 . 5.38 620 588 A 46 LYS H A 67 ARG HDy 1.0 . 4.82 621 589 A 114 THR HG2% A 115 PHE H 1.0 . 3.85 622 590 A 115 PHE H A 115 PHE HBx 1.0 . 3.77 623 591 A 115 PHE H A 115 PHE HBy 1.0 . 3.77 624 592 A 114 THR HB A 115 PHE H 1.0 . 3.29 625 593 A 115 PHE H A 114 THR HA 1.0 . 2.76 626 594 A 115 PHE H A 115 PHE HD% 1.0 . 3.90 627 595 A 116 GLY H A 115 PHE H 1.0 . 4.06 628 596 A 59 GLN H A 59 GLN HBx 1.0 . 3.69 629 597 A 59 GLN H A 59 GLN HGx 1.0 . 3.12 630 597 A 59 GLN HGy A 59 GLN H 1.0 . 3.12 631 598 A 59 GLN H A 59 GLN HBy 1.0 . 3.69 632 599 A 57 VAL HA A 59 GLN H 1.0 . 4.33 633 600 A 58 GLY HAx A 59 GLN H 1.0 . 3.44 634 601 A 59 GLN HA A 59 GLN H 1.0 . 2.91 635 602 A 56 THR HG1 A 59 GLN H 1.0 . 4.06 636 603 A 56 THR H A 59 GLN H 1.0 . 3.93 637 604 A 59 GLN H A 60 PHE H 1.0 . 3.31 638 605 A 61 VAL H A 59 GLN H 1.0 . 4.18 639 606 A 58 GLY H A 59 GLN H 1.0 . 3.59 640 607 A 57 VAL HGy% A 91 MET H 1.0 . 4.24 641 608 A 56 THR HG2% A 91 MET H 1.0 . 4.48 642 609 A 91 MET HBy A 91 MET H 1.0 . 3.88 643 610 A 90 LEU HBx A 91 MET H 1.0 . 4.04 644 611 A 91 MET H A 90 LEU HBy 1.0 . 4.63 645 612 A 91 MET HBx A 91 MET H 1.0 . 3.64 646 613 A 91 MET H A 91 MET HGx 1.0 . 3.62 647 614 A 91 MET H A 91 MET HGy 1.0 . 3.62 648 615 A 90 LEU HA A 91 MET H 1.0 . 3.17 649 616 A 91 MET H A 56 THR HB 1.0 . 4.65 650 617 A 56 THR HA A 91 MET H 1.0 . 3.70 651 618 A 32 ILE HG2% A 107 VAL H 1.0 . 4.98 652 619 A 108 THR HG2% A 107 VAL H 1.0 . 5.50 653 620 A 107 VAL H A 32 ILE HB 1.0 . 4.31 654 621 A 107 VAL HB A 107 VAL H 1.0 . 3.74 655 622 A 107 VAL H A 106 TYR HBx 1.0 . 4.73 656 623 A 107 VAL H A 106 TYR HBy 1.0 . 4.73 657 624 A 107 VAL H A 106 TYR HA 1.0 . 3.04 658 625 A 33 CYS HA A 107 VAL H 1.0 . 4.16 659 626 A 107 VAL H A 106 TYR HD% 1.0 . 4.64 660 627 A 108 THR H A 107 VAL H 1.0 . 4.67 661 628 A 106 TYR H A 107 VAL H 1.0 . 4.39 662 629 A 74 LYS H A 70 LEU HDy% 1.0 . 5.50 663 630 A 74 LYS H A 70 LEU HDx% 1.0 . 5.50 664 631 A 74 LYS H A 74 LYS HGx 1.0 . 3.96 665 632 A 74 LYS H A 74 LYS HGy 1.0 . 3.96 666 633 A 74 LYS HBx A 74 LYS H 1.0 . 3.07 667 634 A 74 LYS H A 74 LYS HBy 1.0 . 3.78 668 635 A 74 LYS H A 71 PRO HGx 1.0 . 4.16 669 636 A 74 LYS H A 73 GLU HGy 1.0 . 4.86 670 637 A 71 PRO HBy A 74 LYS H 1.0 . 4.61 671 638 A 74 LYS H A 65 ARG HDx 1.0 . 5.50 672 638 A 65 ARG HDy A 74 LYS H 1.0 . 5.50 673 639 A 74 LYS H A 74 LYS HEx 1.0 . 5.50 674 639 A 74 LYS H A 74 LYS HEy 1.0 . 5.50 675 640 A 74 LYS H A 71 PRO HDx 1.0 . 4.82 676 641 A 74 LYS H A 72 PRO HDx 1.0 . 5.04 677 641 A 72 PRO HDy A 74 LYS H 1.0 . 5.04 678 642 A 72 PRO HA A 74 LYS H 1.0 . 3.75 679 643 A 65 ARG HH2% A 74 LYS H 1.0 . 4.57 680 644 A 21 ILE HG2% A 22 ALA H 1.0 . 3.69 681 645 A 22 ALA H A 21 ILE HB 1.0 . 3.41 682 646 A 23 ASP HBy A 22 ALA H 1.0 . 4.94 683 647 A 23 ASP HBx A 22 ALA H 1.0 . 5.01 684 648 A 22 ALA H A 18 SER HA 1.0 . 4.59 685 649 A 22 ALA H A 23 ASP HA 1.0 . 5.16 686 650 A 22 ALA H A 21 ILE H 1.0 . 3.14 687 651 A 22 ALA H A 25 PHE H 1.0 . 4.75 688 652 A 29 ILE HG2% A 29 ILE H 1.0 . 4.09 689 653 A 29 ILE HD1% A 29 ILE H 1.0 . 4.09 690 654 A 29 ILE HG1x A 29 ILE H 1.0 . 3.45 691 655 A 28 ARG HBx A 29 ILE H 1.0 . 3.79 692 656 A 53 ALA HB% A 29 ILE H 1.0 . 4.92 693 657 A 29 ILE H A 28 ARG HGx 1.0 . 4.10 694 657 A 28 ARG HGy A 29 ILE H 1.0 . 4.10 695 658 A 29 ILE H A 29 ILE HB 1.0 . 3.40 696 659 A 28 ARG HBy A 29 ILE H 1.0 . 4.01 697 660 A 29 ILE H A 28 ARG HDx 1.0 . 4.93 698 661 A 29 ILE H A 28 ARG HDy 1.0 . 4.93 699 662 A 29 ILE H A 30 PRO HDx 1.0 . 5.03 700 663 A 29 ILE H A 30 PRO HDy 1.0 . 5.03 701 664 A 53 ALA HA A 29 ILE H 1.0 . 5.41 702 665 A 52 PRO HA A 29 ILE H 1.0 . 4.56 703 666 A 29 ILE H A 28 ARG HA 1.0 . 3.16 704 667 A 29 ILE H A 51 VAL H 1.0 . 4.34 705 668 A 68 ILE HD1% A 70 LEU H 1.0 . 4.17 706 669 A 70 LEU H A 70 LEU HDy% 1.0 . 4.50 707 670 A 70 LEU H A 70 LEU HDx% 1.0 . 4.50 708 671 A 70 LEU H A 70 LEU HBx 1.0 . 3.48 709 672 A 70 LEU H A 70 LEU HBy 1.0 . 3.48 710 673 A 68 ILE HB A 70 LEU H 1.0 . 4.28 711 674 A 70 LEU H A 69 MET HBx 1.0 . 4.85 712 675 A 70 LEU H A 69 MET HBy 1.0 . 4.85 713 676 A 70 LEU H A 69 MET HGx 1.0 . 4.26 714 676 A 69 MET HGy A 70 LEU H 1.0 . 4.26 715 677 A 70 LEU H A 65 ARG HDx 1.0 . 4.93 716 677 A 65 ARG HDy A 70 LEU H 1.0 . 4.93 717 678 A 65 ARG HA A 70 LEU H 1.0 . 4.05 718 679 A 71 PRO HDx A 70 LEU H 1.0 . 5.20 719 680 A 69 MET HA A 70 LEU H 1.0 . 3.04 720 681 A 68 ILE HA A 70 LEU H 1.0 . 4.72 721 682 A 69 MET H A 70 LEU H 1.0 . 3.31 722 683 A 20 ARG H A 20 ARG HGx 1.0 . 3.50 723 684 A 20 ARG H A 20 ARG HGy 1.0 . 3.50 724 685 A 20 ARG H A 20 ARG HBx 1.0 . 3.79 725 686 A 20 ARG H A 20 ARG HBy 1.0 . 3.79 726 687 A 20 ARG H A 20 ARG HDx 1.0 . 5.50 727 688 A 17 GLU HA A 20 ARG H 1.0 . 4.30 728 689 A 57 VAL H A 57 VAL HGx% 1.0 . 3.77 729 690 A 57 VAL HB A 57 VAL H 1.0 . 3.29 730 691 A 57 VAL H A 87 THR HA 1.0 . 3.86 731 692 A 57 VAL H A 89 ALA HA 1.0 . 5.50 732 693 A 57 VAL H A 56 THR HB 1.0 . 3.24 733 694 A 57 VAL H A 56 THR HA 1.0 . 3.21 734 695 A 56 THR HG1 A 57 VAL H 1.0 . 4.83 735 696 A 57 VAL H A 59 GLN H 1.0 . 4.83 736 697 A 57 VAL H A 56 THR H 1.0 . 4.45 737 698 A 57 VAL H A 91 MET H 1.0 . 4.69 738 699 A 1 MET H A 1 MET HBx 1.0 . 4.16 739 700 A 1 MET H A 1 MET HBy 1.0 . 4.16 740 701 A 1 MET H A 1 MET HGx 1.0 . 4.89 741 702 A 1 MET H A 1 MET HGy 1.0 . 4.89 742 703 A 78 ILE HG1x A 60 PHE H 1.0 . 5.50 743 704 A 60 PHE H A 91 MET HE% 1.0 . 5.50 744 705 A 55 LEU HBy A 60 PHE H 1.0 . 5.50 745 706 A 60 PHE H A 59 GLN HBx 1.0 . 4.11 746 707 A 61 VAL HB A 60 PHE H 1.0 . 4.90 747 708 A 60 PHE H A 59 GLN HGx 1.0 . 4.48 748 708 A 59 GLN HGy A 60 PHE H 1.0 . 4.48 749 709 A 60 PHE H A 59 GLN HBy 1.0 . 4.11 750 710 A 60 PHE H A 60 PHE HBx 1.0 . 3.33 751 711 A 60 PHE H A 60 PHE HBy 1.0 . 3.33 752 712 A 57 VAL HA A 60 PHE H 1.0 . 3.80 753 713 A 60 PHE HD% A 60 PHE H 1.0 . 4.61 754 714 A 62 TYR H A 60 PHE H 1.0 . 4.57 755 715 A 61 VAL H A 60 PHE H 1.0 . 3.57 756 716 A 58 GLY H A 60 PHE H 1.0 . 4.88 757 717 A 48 LYS H A 47 ARG HBx 1.0 . 4.94 758 718 A 48 LYS H A 47 ARG HBy 1.0 . 4.94 759 719 A 48 LYS H A 46 LYS HA 1.0 . 5.50 760 720 A 48 LYS H A 49 TYR H 1.0 . 5.09 761 721 A 41 ILE HG2% A 41 ILE H 1.0 . 2.94 762 722 A 41 ILE HD1% A 41 ILE H 1.0 . 3.50 763 723 A 41 ILE HG1x A 41 ILE H 1.0 . 3.43 764 724 A 41 ILE H A 41 ILE HG1y 1.0 . 4.04 765 725 A 41 ILE H A 35 LYS HDy 1.0 . 3.70 766 726 A 41 ILE HB A 41 ILE H 1.0 . 3.68 767 727 A 41 ILE H A 40 ASP HBx 1.0 . 3.76 768 727 A 41 ILE H A 40 ASP HBy 1.0 . 3.76 769 728 A 41 ILE H A 35 LYS HEx 1.0 . 3.80 770 728 A 35 LYS HEy A 41 ILE H 1.0 . 3.80 771 729 A 41 ILE H A 42 PRO HDx 1.0 . 5.14 772 730 A 41 ILE H A 39 SER HBx 1.0 . 4.27 773 731 A 41 ILE H A 42 PRO HDy 1.0 . 4.99 774 732 A 41 ILE H A 39 SER HBy 1.0 . 4.27 775 733 A 39 SER HA A 41 ILE H 1.0 . 4.14 776 734 A 41 ILE H A 40 ASP HA 1.0 . 3.41 777 735 A 40 ASP H A 41 ILE H 1.0 . 3.32 778 736 A 5 PHE H A 47 ARG HA 1.0 . 5.45 779 737 A 29 ILE HG2% A 51 VAL H 1.0 . 5.12 780 738 A 29 ILE HB A 51 VAL H 1.0 . 4.02 781 739 A 51 VAL H A 51 VAL HB 1.0 . 3.76 782 740 A 51 VAL H A 50 LEU HA 1.0 . 2.99 783 741 A 68 ILE HG2% A 45 ASP H 1.0 . 4.52 784 742 A 45 ASP H A 44 ILE HG2% 1.0 . 4.04 785 743 A 44 ILE HG1x A 45 ASP H 1.0 . 3.65 786 744 A 45 ASP H A 44 ILE HG1y 1.0 . 3.37 787 745 A 45 ASP H A 67 ARG HGy 1.0 . 5.50 788 746 A 45 ASP H A 44 ILE HB 1.0 . 4.02 789 747 A 67 ARG HBy A 45 ASP H 1.0 . 4.63 790 748 A 45 ASP H A 45 ASP HBx 1.0 . 3.27 791 748 A 45 ASP HBy A 45 ASP H 1.0 . 3.27 792 749 A 45 ASP H A 44 ILE HA 1.0 . 2.95 793 750 A 46 LYS H A 45 ASP H 1.0 . 3.43 794 751 A 35 LYS H A 35 LYS HGx 1.0 . 5.01 795 752 A 44 ILE HG2% A 35 LYS H 1.0 . 4.39 796 753 A 35 LYS H A 35 LYS HBx 1.0 . 3.19 797 754 A 35 LYS H A 35 LYS HBy 1.0 . 3.19 798 755 A 35 LYS H A 34 GLU HBx 1.0 . 4.07 799 756 A 35 LYS H A 34 GLU HBy 1.0 . 4.07 800 757 A 35 LYS H A 34 GLU HGx 1.0 . 3.28 801 757 A 35 LYS H A 34 GLU HGy 1.0 . 3.28 802 758 A 35 LYS H A 34 GLU HA 1.0 . 2.95 803 759 A 35 LYS H A 34 GLU H 1.0 . 4.46 804 760 A 35 LYS H A 36 ALA H 1.0 . 4.70 805 761 A 2 LYS H A 2 LYS HGx 1.0 . 3.83 806 762 A 2 LYS H A 2 LYS HGy 1.0 . 3.83 807 763 A 2 LYS H A 2 LYS HBx 1.0 . 3.83 808 764 A 2 LYS H A 2 LYS HBy 1.0 . 3.83 809 765 A 1 MET HBx A 2 LYS H 1.0 . 3.86 810 766 A 1 MET HBy A 2 LYS H 1.0 . 3.86 811 767 A 2 LYS H A 1 MET HGx 1.0 . 4.72 812 768 A 2 LYS H A 1 MET HGy 1.0 . 4.72 813 769 A 2 LYS H A 1 MET HA 1.0 . 2.89 814 770 A 68 ILE HD1% A 44 ILE H 1.0 . 5.50 815 771 A 44 ILE H A 44 ILE HG1x 1.0 . 4.65 816 772 A 44 ILE H A 44 ILE HG1y 1.0 . 4.53 817 773 A 44 ILE H A 44 ILE HB 1.0 . 3.31 818 774 A 44 ILE H A 43 GLU HBx 1.0 . 4.19 819 775 A 44 ILE H A 43 GLU HBy 1.0 . 4.19 820 776 A 44 ILE H A 43 GLU HGx 1.0 . 3.99 821 776 A 43 GLU HGy A 44 ILE H 1.0 . 3.99 822 777 A 35 LYS HA A 44 ILE H 1.0 . 5.50 823 778 A 44 ILE H A 43 GLU HA 1.0 . 2.96 824 779 A 109 TYR HE% A 44 ILE H 1.0 . 4.31 825 780 A 44 ILE H A 46 LYS H 1.0 . 5.50 826 781 A 44 ILE H A 45 ASP H 1.0 . 4.73 827 782 A 44 ILE H A 35 LYS H 1.0 . 5.17 828 783 A 44 ILE H A 109 TYR HH 1.0 . 3.82 829 784 A 29 ILE HG1x A 53 ALA H 1.0 . 4.38 830 785 A 29 ILE HG1y A 53 ALA H 1.0 . 4.46 831 786 A 52 PRO HBx A 53 ALA H 1.0 . 4.22 832 787 A 53 ALA H A 92 SER HBx 1.0 . 5.30 833 787 A 92 SER HBy A 53 ALA H 1.0 . 5.30 834 788 A 52 PRO HA A 53 ALA H 1.0 . 3.20 835 789 A 27 ASN HA A 53 ALA H 1.0 . 5.19 836 790 A 28 ARG HA A 53 ALA H 1.0 . 3.87 837 791 A 54 ASP H A 53 ALA H 1.0 . 3.88 838 792 A 29 ILE H A 53 ALA H 1.0 . 4.92 839 793 A 76 ILE HG2% A 77 PHE H 1.0 . 3.73 840 794 A 77 PHE H A 76 ILE HG1x 1.0 . 4.21 841 795 A 41 ILE HD1% A 77 PHE H 1.0 . 5.02 842 796 A 76 ILE HG1y A 77 PHE H 1.0 . 3.45 843 797 A 77 PHE HBx A 77 PHE H 1.0 . 3.55 844 798 A 77 PHE HBy A 77 PHE H 1.0 . 3.75 845 799 A 109 TYR HBx A 77 PHE H 1.0 . 4.82 846 800 A 77 PHE H A 111 GLY HAx 1.0 . 4.49 847 801 A 109 TYR HA A 77 PHE H 1.0 . 4.77 848 802 A 77 PHE H A 77 PHE HD% 1.0 . 3.64 849 803 A 110 SER H A 77 PHE H 1.0 . 3.59 850 804 A 34 GLU H A 107 VAL HGx% 1.0 . 5.32 851 805 A 108 THR HG2% A 34 GLU H 1.0 . 4.42 852 806 A 34 GLU H A 33 CYS HG 1.0 . 4.49 853 807 A 34 GLU H A 34 GLU HBx 1.0 . 3.81 854 808 A 34 GLU H A 34 GLU HBy 1.0 . 3.81 855 809 A 34 GLU H A 34 GLU HGx 1.0 . 4.49 856 809 A 34 GLU HGy A 34 GLU H 1.0 . 4.49 857 810 A 34 GLU H A 33 CYS HBy 1.0 . 4.53 858 811 A 33 CYS HA A 34 GLU H 1.0 . 3.04 859 812 A 108 THR HA A 34 GLU H 1.0 . 3.59 860 813 A 109 TYR HD% A 34 GLU H 1.0 . 4.99 861 814 A 107 VAL H A 34 GLU H 1.0 . 4.77 862 815 A 34 GLU H A 33 CYS H 1.0 . 5.38 863 816 A 100 ASP H A 99 LYS HBx 1.0 . 3.55 864 816 A 100 ASP H A 99 LYS HBy 1.0 . 3.55 865 817 A 102 ASP H A 100 ASP H 1.0 . 5.50 866 818 A 100 ASP H A 100 ASP HBx 1.0 . 3.44 867 819 A 100 ASP H A 100 ASP HBy 1.0 . 3.44 868 820 A 100 ASP H A 99 LYS HA 1.0 . 3.11 869 821 A 100 ASP H A 101 LYS H 1.0 . 5.32 870 822 A 19 GLU H A 19 GLU HBy 1.0 . 3.84 871 823 A 19 GLU H A 19 GLU HBx 1.0 . 3.28 872 824 A 19 GLU H A 18 SER HBx 1.0 . 4.90 873 825 A 19 GLU H A 18 SER HBy 1.0 . 4.90 874 826 A 18 SER HG A 19 GLU H 1.0 . 4.82 875 827 A 49 TYR H A 32 ILE HD1% 1.0 . 4.85 876 828 A 49 TYR H A 31 VAL HGx% 1.0 . 5.50 877 829 A 49 TYR H A 31 VAL HGy% 1.0 . 5.50 878 830 A 49 TYR H A 48 LYS HBx 1.0 . 4.76 879 831 A 49 TYR H A 48 LYS HBy 1.0 . 4.76 880 832 A 49 TYR H A 32 ILE HA 1.0 . 4.14 881 833 A 49 TYR H A 48 LYS HA 1.0 . 3.48 882 834 A 37 GLU H A 108 THR HG2% 1.0 . 4.97 883 835 A 37 GLU H A 37 GLU HBy 1.0 . 3.23 884 836 A 37 GLU H A 37 GLU HGx 1.0 . 4.05 885 837 A 37 GLU H A 36 ALA HA 1.0 . 2.84 886 838 A 84 LEU H A 84 LEU HDx% 1.0 . 4.44 887 839 A 83 THR HG2% A 84 LEU H 1.0 . 3.76 888 840 A 84 LEU H A 84 LEU HBx 1.0 . 3.44 889 841 A 84 LEU H A 84 LEU HBy 1.0 . 3.44 890 842 A 85 PRO HDy A 84 LEU H 1.0 . 4.75 891 843 A 85 PRO HDx A 84 LEU H 1.0 . 5.02 892 844 A 84 LEU H A 83 THR HA 1.0 . 2.71 893 845 A 79 PHE HD% A 84 LEU H 1.0 . 4.79 894 846 A 79 PHE HE% A 84 LEU H 1.0 . 4.90 895 847 A 83 THR H A 84 LEU H 1.0 . 4.49 896 848 A 101 LYS H A 101 LYS HGx 1.0 . 4.10 897 849 A 102 ASP H A 101 LYS H 1.0 . 4.52 898 850 A 100 ASP HA A 101 LYS H 1.0 . 3.46 899 851 A 93 ALA H A 94 ILE HD1% 1.0 . 5.39 900 852 A 53 ALA HB% A 93 ALA H 1.0 . 5.50 901 853 A 94 ILE HG1x A 93 ALA H 1.0 . 4.42 902 854 A 93 ALA HB% A 93 ALA H 1.0 . 2.69 903 855 A 90 LEU HBy A 93 ALA H 1.0 . 3.69 904 856 A 94 ILE HB A 93 ALA H 1.0 . 5.06 905 857 A 94 ILE H A 93 ALA H 1.0 . 3.03 906 858 A 90 LEU H A 93 ALA H 1.0 . 4.78 907 859 A 92 SER H A 93 ALA H 1.0 . 3.41 908 860 A 95 TYR H A 93 ALA H 1.0 . 4.54 909 861 A 91 MET H A 93 ALA H 1.0 . 5.18 910 862 A 32 ILE HD1% A 32 ILE H 1.0 . 4.56 911 863 A 32 ILE HG2% A 32 ILE H 1.0 . 4.17 912 864 A 32 ILE H A 107 VAL HGx% 1.0 . 5.50 913 865 A 32 ILE HB A 32 ILE H 1.0 . 3.58 914 866 A 32 ILE H A 31 VAL HB 1.0 . 4.68 915 867 A 105 LEU HBx A 32 ILE H 1.0 . 4.34 916 868 A 31 VAL HA A 32 ILE H 1.0 . 3.14 917 869 A 106 TYR HA A 32 ILE H 1.0 . 3.52 918 870 A 32 ILE H A 49 TYR HD% 1.0 . 5.50 919 871 A 106 TYR HD% A 32 ILE H 1.0 . 5.43 920 872 A 105 LEU H A 32 ILE H 1.0 . 4.50 921 873 A 32 ILE H A 31 VAL H 1.0 . 4.62 922 874 A 107 VAL H A 32 ILE H 1.0 . 4.21 923 875 A 33 CYS H A 32 ILE H 1.0 . 4.75 924 876 A 31 VAL H A 50 LEU HDx% 1.0 . 5.50 925 877 A 31 VAL H A 31 VAL HGx% 1.0 . 3.98 926 878 A 31 VAL H A 30 PRO HBy 1.0 . 4.60 927 879 A 31 VAL H A 30 PRO HBx 1.0 . 4.60 928 880 A 31 VAL H A 49 TYR HBx 1.0 . 4.75 929 881 A 31 VAL H A 49 TYR HBy 1.0 . 4.75 930 882 A 31 VAL H A 30 PRO HA 1.0 . 3.14 931 883 A 104 PHE HE% A 31 VAL H 1.0 . 4.68 932 884 A 105 LEU H A 31 VAL H 1.0 . 4.94 933 885 A 49 TYR H A 31 VAL H 1.0 . 4.35 934 886 A 41 ILE HG2% A 40 ASP H 1.0 . 4.46 935 887 A 41 ILE HB A 40 ASP H 1.0 . 5.21 936 888 A 40 ASP H A 40 ASP HBx 1.0 . 3.27 937 888 A 40 ASP H A 40 ASP HBy 1.0 . 3.27 938 889 A 40 ASP H A 39 SER HBx 1.0 . 4.28 939 890 A 40 ASP H A 39 SER HBy 1.0 . 4.28 940 891 A 39 SER HA A 40 ASP H 1.0 . 2.97 941 892 A 80 VAL HB A 81 ASN H 1.0 . 4.73 942 893 A 81 ASN H A 81 ASN HBx 1.0 . 4.12 943 894 A 81 ASN HBy A 81 ASN H 1.0 . 4.13 944 895 A 81 ASN H A 80 VAL HA 1.0 . 3.08 945 896 A 81 ASN H A 107 VAL HA 1.0 . 5.16 946 897 A 82 ASP H A 81 ASN H 1.0 . 3.82 947 898 A 80 VAL H A 81 ASN H 1.0 . 4.19 948 899 A 106 TYR H A 105 LEU HDy% 1.0 . 5.12 949 900 A 105 LEU HBy A 106 TYR H 1.0 . 4.01 950 901 A 105 LEU HBx A 106 TYR H 1.0 . 4.57 951 902 A 106 TYR H A 106 TYR HBx 1.0 . 3.95 952 903 A 106 TYR H A 106 TYR HBy 1.0 . 3.95 953 904 A 106 TYR H A 99 LYS HA 1.0 . 5.50 954 905 A 106 TYR H A 105 LEU HA 1.0 . 3.22 955 906 A 106 TYR H A 106 TYR HD% 1.0 . 3.65 956 907 A 4 THR H A 5 PHE HD% 1.0 . 5.50 957 908 A 76 ILE HG1x A 75 ALA H 1.0 . 5.50 958 909 A 75 ALA HB% A 75 ALA H 1.0 . 2.78 959 910 A 76 ILE HB A 75 ALA H 1.0 . 5.50 960 911 A 75 ALA H A 74 LYS HGy 1.0 . 4.93 961 912 A 75 ALA H A 74 LYS HDx 1.0 . 3.86 962 912 A 75 ALA H A 74 LYS HDy 1.0 . 3.86 963 913 A 74 LYS HBx A 75 ALA H 1.0 . 3.88 964 914 A 74 LYS HBy A 75 ALA H 1.0 . 3.59 965 915 A 75 ALA H A 65 ARG HDx 1.0 . 5.50 966 915 A 65 ARG HDy A 75 ALA H 1.0 . 5.50 967 916 A 75 ALA H A 74 LYS HEx 1.0 . 5.50 968 916 A 74 LYS HEy A 75 ALA H 1.0 . 5.50 969 917 A 74 LYS HA A 75 ALA H 1.0 . 2.75 970 918 A 76 ILE H A 75 ALA H 1.0 . 4.55 971 919 A 74 LYS H A 75 ALA H 1.0 . 4.64 972 920 A 33 CYS HG A 33 CYS H 1.0 . 5.10 973 921 A 33 CYS H A 47 ARG HBx 1.0 . 5.50 974 922 A 33 CYS H A 47 ARG HBy 1.0 . 5.50 975 923 A 33 CYS H A 33 CYS HBx 1.0 . 4.13 976 924 A 33 CYS HBy A 33 CYS H 1.0 . 4.06 977 925 A 33 CYS H A 32 ILE HA 1.0 . 3.42 978 926 A 33 CYS H A 48 LYS HA 1.0 . 4.39 979 927 A 47 ARG HA A 33 CYS H 1.0 . 4.59 980 928 A 33 CYS H A 49 TYR HD% 1.0 . 4.94 981 929 A 48 LYS H A 33 CYS H 1.0 . 5.50 982 930 A 36 ALA H A 35 LYS HBx 1.0 . 4.69 983 931 A 36 ALA H A 35 LYS HBy 1.0 . 4.69 984 932 A 35 LYS HA A 36 ALA H 1.0 . 2.88 985 933 A 110 SER HA A 36 ALA H 1.0 . 4.20 986 934 A 108 THR HA A 36 ALA H 1.0 . 5.31 987 935 A 109 TYR HA A 36 ALA H 1.0 . 5.41 988 936 A 109 TYR HE% A 36 ALA H 1.0 . 5.50 989 937 A 109 TYR HD% A 36 ALA H 1.0 . 5.21 990 938 A 94 ILE HG2% A 94 ILE HD1% 1.0 . 2.97 991 939 A 89 ALA HB% A 94 ILE HD1% 1.0 . 2.87 992 940 A 94 ILE HD1% A 85 PRO HBy 1.0 . 3.40 993 941 A 94 ILE HB A 94 ILE HD1% 1.0 . 3.34 994 942 A 94 ILE HD1% A 85 PRO HBx 1.0 . 3.15 995 943 A 94 ILE HD1% A 86 PRO HDx 1.0 . 4.12 996 944 A 94 ILE HD1% A 86 PRO HDy 1.0 . 4.12 997 945 A 94 ILE HA A 94 ILE HD1% 1.0 . 3.07 998 946 A 91 MET HA A 94 ILE HD1% 1.0 . 4.38 999 947 A 94 ILE HD1% A 85 PRO HA 1.0 . 4.33 1000 948 A 98 HIS HD2 A 94 ILE HD1% 1.0 . 3.91 1001 949 A 89 ALA H A 94 ILE HD1% 1.0 . 4.67 1002 950 A 94 ILE H A 94 ILE HD1% 1.0 . 3.86 1003 951 A 95 TYR H A 94 ILE HD1% 1.0 . 4.96 1004 952 A 91 MET H A 94 ILE HD1% 1.0 . 5.50 1005 953 A 64 ILE HD1% A 63 VAL HGx% 1.0 . 4.63 1006 954 A 78 ILE HD1% A 64 ILE HD1% 1.0 . 3.84 1007 955 A 64 ILE HD1% A 64 ILE HB 1.0 . 3.62 1008 956 A 64 ILE HD1% A 67 ARG HGy 1.0 . 4.93 1009 957 A 64 ILE HD1% A 67 ARG HGx 1.0 . 5.14 1010 958 A 64 ILE HD1% A 109 TYR HBy 1.0 . 4.66 1011 959 A 64 ILE HA A 64 ILE HD1% 1.0 . 3.44 1012 960 A 64 ILE HD1% A 60 PHE HE% 1.0 . 4.06 1013 961 A 109 TYR HD% A 64 ILE HD1% 1.0 . 4.16 1014 962 A 60 PHE HD% A 64 ILE HD1% 1.0 . 4.30 1015 963 A 53 ALA HB% A 29 ILE HD1% 1.0 . 3.39 1016 964 A 29 ILE HD1% A 29 ILE HB 1.0 . 3.37 1017 965 A 91 MET HBx A 29 ILE HD1% 1.0 . 4.97 1018 966 A 95 TYR HBx A 29 ILE HD1% 1.0 . 3.67 1019 967 A 95 TYR HBy A 29 ILE HD1% 1.0 . 3.72 1020 968 A 53 ALA HA A 29 ILE HD1% 1.0 . 3.44 1021 969 A 92 SER HA A 29 ILE HD1% 1.0 . 3.02 1022 970 A 29 ILE HD1% A 29 ILE HA 1.0 . 3.35 1023 971 A 29 ILE HD1% A 28 ARG HA 1.0 . 4.52 1024 972 A 29 ILE HD1% A 95 TYR HE% 1.0 . 4.67 1025 973 A 95 TYR HD% A 29 ILE HD1% 1.0 . 3.87 1026 974 A 96 GLN H A 29 ILE HD1% 1.0 . 4.97 1027 975 A 92 SER H A 29 ILE HD1% 1.0 . 4.35 1028 976 A 78 ILE HD1% A 76 ILE HD1% 1.0 . 4.55 1029 977 A 78 ILE HD1% A 78 ILE HB 1.0 . 3.34 1030 978 A 78 ILE HD1% A 61 VAL HB 1.0 . 4.84 1031 979 A 78 ILE HD1% A 107 VAL HB 1.0 . 4.91 1032 980 A 78 ILE HD1% A 109 TYR HBy 1.0 . 3.97 1033 981 A 78 ILE HD1% A 109 TYR HBx 1.0 . 3.89 1034 982 A 78 ILE HD1% A 61 VAL HA 1.0 . 3.93 1035 983 A 78 ILE HD1% A 57 VAL HA 1.0 . 5.50 1036 984 A 78 ILE HD1% A 78 ILE HA 1.0 . 3.58 1037 985 A 78 ILE HD1% A 109 TYR HA 1.0 . 4.01 1038 986 A 78 ILE HD1% A 60 PHE HE% 1.0 . 3.89 1039 987 A 78 ILE HD1% A 60 PHE HD% 1.0 . 3.67 1040 988 A 78 ILE HD1% A 79 PHE H 1.0 . 4.16 1041 989 A 41 ILE HG2% A 76 ILE HD1% 1.0 . 4.47 1042 990 A 41 ILE HD1% A 76 ILE HD1% 1.0 . 3.58 1043 991 A 76 ILE HB A 76 ILE HD1% 1.0 . 3.20 1044 992 A 76 ILE HD1% A 41 ILE HG1y 1.0 . 4.25 1045 993 A 76 ILE HD1% A 109 TYR HBy 1.0 . 4.54 1046 994 A 109 TYR HBx A 76 ILE HD1% 1.0 . 4.17 1047 995 A 76 ILE HD1% A 61 VAL HA 1.0 . 4.83 1048 996 A 65 ARG HA A 76 ILE HD1% 1.0 . 3.70 1049 997 A 76 ILE HA A 76 ILE HD1% 1.0 . 4.09 1050 998 A 76 ILE HD1% A 109 TYR HE% 1.0 . 4.52 1051 999 A 76 ILE H A 76 ILE HD1% 1.0 . 5.04 1052 1000 A 76 ILE HD1% A 65 ARG H 1.0 . 4.00 1053 1001 A 77 PHE H A 76 ILE HD1% 1.0 . 5.02 1054 1002 A 21 ILE HD1% A 50 LEU HDx% 1.0 . 4.17 1055 1003 A 21 ILE HD1% A 30 PRO HBy 1.0 . 4.09 1056 1004 A 21 ILE HD1% A 17 GLU HGx 1.0 . 3.83 1057 1004 A 17 GLU HGy A 21 ILE HD1% 1.0 . 3.83 1058 1005 A 21 ILE HD1% A 48 LYS HEx 1.0 . 4.40 1059 1005 A 21 ILE HD1% A 48 LYS HEy 1.0 . 4.40 1060 1006 A 21 ILE HD1% A 104 PHE HD% 1.0 . 5.01 1061 1007 A 21 ILE HD1% A 20 ARG H 1.0 . 5.39 1062 1008 A 22 ALA H A 21 ILE HD1% 1.0 . 5.50 1063 1009 A 68 ILE HD1% A 64 ILE HG2% 1.0 . 3.41 1064 1010 A 68 ILE HD1% A 68 ILE HG2% 1.0 . 3.03 1065 1011 A 41 ILE HD1% A 68 ILE HD1% 1.0 . 3.39 1066 1012 A 68 ILE HD1% A 70 LEU HBy 1.0 . 4.50 1067 1013 A 68 ILE HD1% A 68 ILE HB 1.0 . 3.14 1068 1014 A 68 ILE HD1% A 42 PRO HDx 1.0 . 3.64 1069 1015 A 68 ILE HD1% A 42 PRO HDy 1.0 . 4.58 1070 1016 A 68 ILE HD1% A 42 PRO HA 1.0 . 5.50 1071 1017 A 68 ILE HD1% A 70 LEU HA 1.0 . 4.51 1072 1018 A 109 TYR HD% A 68 ILE HD1% 1.0 . 4.23 1073 1019 A 68 ILE HD1% A 69 MET H 1.0 . 5.07 1074 1020 A 68 ILE HD1% A 109 TYR HH 1.0 . 4.47 1075 1021 A 41 ILE HD1% A 64 ILE HG2% 1.0 . 4.67 1076 1022 A 41 ILE HD1% A 41 ILE HB 1.0 . 3.26 1077 1023 A 41 ILE HD1% A 109 TYR HBy 1.0 . 5.45 1078 1024 A 41 ILE HD1% A 35 LYS HA 1.0 . 4.02 1079 1025 A 41 ILE HD1% A 42 PRO HDx 1.0 . 3.93 1080 1026 A 41 ILE HD1% A 111 GLY HAy 1.0 . 3.65 1081 1027 A 41 ILE HD1% A 42 PRO HDy 1.0 . 4.88 1082 1028 A 41 ILE HD1% A 76 ILE HA 1.0 . 4.23 1083 1029 A 41 ILE HD1% A 41 ILE HA 1.0 . 4.20 1084 1030 A 41 ILE HD1% A 110 SER HA 1.0 . 3.43 1085 1031 A 41 ILE HD1% A 111 GLY HAx 1.0 . 3.74 1086 1032 A 41 ILE HD1% A 109 TYR HD% 1.0 . 3.31 1087 1033 A 41 ILE HD1% A 110 SER H 1.0 . 4.87 1088 1034 A 29 ILE HG2% A 91 MET HE% 1.0 . 3.53 1089 1035 A 91 MET HE% A 31 VAL HGx% 1.0 . 3.47 1090 1036 A 91 MET HE% A 51 VAL HGy% 1.0 . 3.75 1091 1037 A 91 MET HBy A 91 MET HE% 1.0 . 3.00 1092 1038 A 91 MET HBx A 91 MET HE% 1.0 . 3.61 1093 1039 A 91 MET HE% A 91 MET HGx 1.0 . 3.55 1094 1040 A 91 MET HE% A 91 MET HGy 1.0 . 3.55 1095 1041 A 91 MET HE% A 60 PHE HBx 1.0 . 4.28 1096 1042 A 91 MET HE% A 60 PHE HBy 1.0 . 4.28 1097 1043 A 57 VAL HA A 91 MET HE% 1.0 . 3.88 1098 1044 A 91 MET HA A 91 MET HE% 1.0 . 3.39 1099 1045 A 31 VAL HA A 91 MET HE% 1.0 . 5.50 1100 1046 A 91 MET HE% A 60 PHE HE% 1.0 . 4.05 1101 1047 A 60 PHE HD% A 91 MET HE% 1.0 . 3.63 1102 1048 A 57 VAL H A 91 MET HE% 1.0 . 5.39 1103 1049 A 91 MET H A 91 MET HE% 1.0 . 4.05 1104 1050 A 64 ILE HG2% A 44 ILE HD1% 1.0 . 3.40 1105 1051 A 44 ILE HD1% B 629 ILE HG2% 1.0 . 4.70 1106 1052 A 44 ILE HD1% A 44 ILE HB 1.0 . 3.23 1107 1053 A 67 ARG HBy A 44 ILE HD1% 1.0 . 4.03 1108 1054 A 44 ILE HD1% A 67 ARG HDx 1.0 . 3.88 1109 1055 A 44 ILE HD1% A 67 ARG HDy 1.0 . 3.88 1110 1056 A 44 ILE HD1% A 47 ARG HA 1.0 . 4.49 1111 1057 A 44 ILE HD1% A 49 TYR HE% 1.0 . 3.76 1112 1058 A 44 ILE HD1% A 44 ILE H 1.0 . 4.46 1113 1059 A 44 ILE HD1% A 45 ASP H 1.0 . 4.07 1114 1060 A 68 ILE HG2% A 44 ILE HG2% 1.0 . 4.56 1115 1061 A 44 ILE HD1% A 44 ILE HG2% 1.0 . 3.36 1116 1062 A 44 ILE HG1x A 44 ILE HG2% 1.0 . 3.60 1117 1063 A 44 ILE HG2% A 44 ILE HG1y 1.0 . 3.37 1118 1064 A 44 ILE HG2% A 43 GLU HGx 1.0 . 4.58 1119 1064 A 43 GLU HGy A 44 ILE HG2% 1.0 . 4.58 1120 1065 A 44 ILE HG2% A 43 GLU HA 1.0 . 4.00 1121 1066 A 44 ILE HG2% A 44 ILE HA 1.0 . 3.56 1122 1067 A 44 ILE HG2% A 34 GLU HA 1.0 . 4.30 1123 1068 A 47 ARG HA A 44 ILE HG2% 1.0 . 4.36 1124 1069 A 109 TYR HE% A 44 ILE HG2% 1.0 . 3.57 1125 1070 A 46 LYS H A 44 ILE HG2% 1.0 . 3.84 1126 1071 A 44 ILE H A 44 ILE HG2% 1.0 . 3.22 1127 1072 A 44 ILE HG2% A 33 CYS H 1.0 . 5.50 1128 1073 A 76 ILE HG2% A 64 ILE HG2% 1.0 . 3.99 1129 1074 A 76 ILE HG2% A 61 VAL HGy% 1.0 . 3.53 1130 1075 A 76 ILE HG1y A 76 ILE HG2% 1.0 . 3.43 1131 1076 A 76 ILE HG2% A 65 ARG HBx 1.0 . 4.81 1132 1077 A 76 ILE HG2% A 65 ARG HBy 1.0 . 4.81 1133 1078 A 76 ILE HG2% A 61 VAL HB 1.0 . 4.51 1134 1079 A 109 TYR HBx A 76 ILE HG2% 1.0 . 3.88 1135 1080 A 76 ILE HG2% A 61 VAL HA 1.0 . 3.83 1136 1081 A 65 ARG HA A 76 ILE HG2% 1.0 . 4.50 1137 1082 A 76 ILE HA A 76 ILE HG2% 1.0 . 3.44 1138 1083 A 76 ILE HG2% A 109 TYR HE% 1.0 . 5.50 1139 1084 A 109 TYR HD% A 76 ILE HG2% 1.0 . 4.05 1140 1085 A 76 ILE HG2% A 62 TYR H 1.0 . 5.50 1141 1086 A 76 ILE HG2% A 64 ILE H 1.0 . 5.50 1142 1087 A 76 ILE HG2% A 65 ARG HE 1.0 . 4.65 1143 1088 A 76 ILE HG2% A 65 ARG H 1.0 . 4.38 1144 1089 A 110 SER H A 76 ILE HG2% 1.0 . 5.01 1145 1090 A 32 ILE HG2% A 32 ILE HD1% 1.0 . 3.44 1146 1091 A 32 ILE HG2% A 47 ARG HBx 1.0 . 4.40 1147 1092 A 32 ILE HG2% A 47 ARG HBy 1.0 . 4.40 1148 1093 A 32 ILE HG2% A 32 ILE HA 1.0 . 3.47 1149 1094 A 32 ILE HG2% A 106 TYR HA 1.0 . 4.42 1150 1095 A 32 ILE HG2% A 106 TYR HD% 1.0 . 3.93 1151 1096 A 32 ILE HG2% A 5 PHE HD% 1.0 . 3.82 1152 1097 A 32 ILE HG2% A 33 CYS H 1.0 . 3.93 1153 1098 A 4 THR H A 32 ILE HG2% 1.0 . 5.50 1154 1099 A 69 MET H A 69 MET HE% 1.0 . 4.95 1155 1100 A 76 ILE HD1% A 64 ILE HG2% 1.0 . 2.96 1156 1101 A 64 ILE HG2% A 44 ILE HG2% 1.0 . 4.47 1157 1102 A 64 ILE HG2% A 68 ILE HG1x 1.0 . 4.42 1158 1103 A 64 ILE HG2% A 68 ILE HG1y 1.0 . 4.42 1159 1104 A 64 ILE HG2% A 67 ARG HGy 1.0 . 4.96 1160 1105 A 64 ILE HG2% A 44 ILE HB 1.0 . 4.42 1161 1106 A 64 ILE HG2% A 109 TYR HBy 1.0 . 4.69 1162 1107 A 64 ILE HG2% A 61 VAL HA 1.0 . 4.24 1163 1108 A 64 ILE HG2% A 49 TYR HE% 1.0 . 4.49 1164 1109 A 109 TYR HD% A 64 ILE HG2% 1.0 . 4.27 1165 1110 A 64 ILE HG2% A 64 ILE H 1.0 . 3.79 1166 1111 A 29 ILE HG2% A 51 VAL HGy% 1.0 . 4.49 1167 1112 A 29 ILE HG1x A 29 ILE HG2% 1.0 . 3.30 1168 1113 A 29 ILE HG1y A 29 ILE HG2% 1.0 . 3.42 1169 1114 A 53 ALA HB% A 29 ILE HG2% 1.0 . 4.66 1170 1115 A 29 ILE HG2% A 51 VAL HB 1.0 . 4.95 1171 1116 A 29 ILE HG2% A 105 LEU HBx 1.0 . 3.94 1172 1117 A 29 ILE HG2% A 95 TYR HBx 1.0 . 3.69 1173 1118 A 29 ILE HG2% A 95 TYR HBy 1.0 . 3.73 1174 1119 A 29 ILE HG2% A 30 PRO HDx 1.0 . 4.11 1175 1120 A 29 ILE HG2% A 30 PRO HDy 1.0 . 4.11 1176 1121 A 29 ILE HG2% A 92 SER HA 1.0 . 4.22 1177 1122 A 29 ILE HG2% A 29 ILE HA 1.0 . 3.44 1178 1123 A 29 ILE HG2% A 95 TYR H 1.0 . 4.41 1179 1124 A 1 MET HA A 1 MET HE% 1.0 . 3.98 1180 1125 A 78 ILE HG2% A 61 VAL HGy% 1.0 . 3.90 1181 1126 A 78 ILE HG1x A 78 ILE HG2% 1.0 . 3.49 1182 1127 A 78 ILE HG1y A 78 ILE HG2% 1.0 . 3.43 1183 1128 A 78 ILE HG2% A 107 VAL HB 1.0 . 3.85 1184 1129 A 78 ILE HG2% A 109 TYR HBy 1.0 . 4.03 1185 1130 A 78 ILE HG2% A 80 VAL HA 1.0 . 4.99 1186 1131 A 78 ILE HA A 78 ILE HG2% 1.0 . 3.36 1187 1132 A 78 ILE H A 78 ILE HG2% 1.0 . 3.85 1188 1133 A 109 TYR H A 78 ILE HG2% 1.0 . 5.20 1189 1134 A 68 ILE HG2% A 64 ILE HG2% 1.0 . 4.32 1190 1135 A 68 ILE HG2% A 68 ILE HG1x 1.0 . 3.67 1191 1136 A 68 ILE HG2% A 68 ILE HG1y 1.0 . 3.67 1192 1137 A 68 ILE HG2% A 44 ILE HG1x 1.0 . 4.04 1193 1138 A 68 ILE HG2% A 67 ARG HBy 1.0 . 3.84 1194 1139 A 68 ILE HG2% A 42 PRO HBx 1.0 . 4.48 1195 1140 A 68 ILE HG2% A 42 PRO HDx 1.0 . 3.90 1196 1141 A 68 ILE HG2% A 68 ILE HA 1.0 . 3.27 1197 1142 A 68 ILE HG2% A 44 ILE HA 1.0 . 3.54 1198 1143 A 68 ILE HG2% A 109 TYR HE% 1.0 . 4.39 1199 1144 A 68 ILE HG2% A 70 LEU H 1.0 . 5.10 1200 1145 A 68 ILE HG2% A 44 ILE H 1.0 . 4.39 1201 1146 A 68 ILE HG2% A 109 TYR HH 1.0 . 5.04 1202 1147 A 21 ILE HG2% A 50 LEU HDy% 1.0 . 3.38 1203 1148 A 21 ILE HG2% A 22 ALA HB% 1.0 . 4.18 1204 1149 A 21 ILE HG2% A 30 PRO HGx 1.0 . 4.54 1205 1150 A 21 ILE HG2% A 25 PHE HBy 1.0 . 4.31 1206 1151 A 21 ILE HG2% A 25 PHE HBx 1.0 . 3.76 1207 1152 A 21 ILE HG2% A 30 PRO HDx 1.0 . 4.81 1208 1153 A 21 ILE HG2% A 30 PRO HDy 1.0 . 4.81 1209 1154 A 21 ILE HG2% A 21 ILE HA 1.0 . 3.43 1210 1155 A 21 ILE HG2% A 22 ALA HA 1.0 . 4.06 1211 1156 A 23 ASP HBy A 22 ALA HB% 1.0 . 4.86 1212 1157 A 23 ASP HBx A 22 ALA HB% 1.0 . 4.40 1213 1158 A 19 GLU HA A 22 ALA HB% 1.0 . 3.48 1214 1159 A 23 ASP H A 22 ALA HB% 1.0 . 3.22 1215 1160 A 22 ALA H A 22 ALA HB% 1.0 . 2.83 1216 1161 A 21 ILE H A 22 ALA HB% 1.0 . 4.51 1217 1162 A 41 ILE HG2% A 68 ILE HD1% 1.0 . 4.47 1218 1163 A 41 ILE HG2% A 41 ILE HG1x 1.0 . 3.50 1219 1164 A 41 ILE HG2% A 74 LYS HDx 1.0 . 3.96 1220 1164 A 41 ILE HG2% A 74 LYS HDy 1.0 . 3.96 1221 1165 A 41 ILE HG2% A 40 ASP HBx 1.0 . 4.74 1222 1165 A 41 ILE HG2% A 40 ASP HBy 1.0 . 4.74 1223 1166 A 41 ILE HG2% A 74 LYS HEx 1.0 . 4.62 1224 1166 A 41 ILE HG2% A 74 LYS HEy 1.0 . 4.62 1225 1167 A 41 ILE HG2% A 35 LYS HEx 1.0 . 4.17 1226 1167 A 41 ILE HG2% A 35 LYS HEy 1.0 . 4.17 1227 1168 A 41 ILE HG2% A 42 PRO HDx 1.0 . 4.11 1228 1169 A 41 ILE HG2% A 39 SER HBx 1.0 . 4.05 1229 1170 A 41 ILE HG2% A 42 PRO HDy 1.0 . 4.04 1230 1171 A 41 ILE HG2% A 39 SER HBy 1.0 . 4.05 1231 1172 A 41 ILE HG2% A 41 ILE HA 1.0 . 3.48 1232 1173 A 41 ILE HG2% A 109 TYR HD% 1.0 . 4.51 1233 1174 A 16 ALA HB% A 19 GLU HBx 1.0 . 4.02 1234 1175 A 16 ALA HB% A 13 LYS HA 1.0 . 3.03 1235 1176 A 16 ALA HB% A 17 GLU HA 1.0 . 4.75 1236 1177 A 16 ALA HB% A 16 ALA H 1.0 . 2.75 1237 1178 A 16 ALA HB% A 17 GLU H 1.0 . 3.30 1238 1179 A 16 ALA HB% A 15 LYS H 1.0 . 4.57 1239 1180 A 93 ALA HB% A 94 ILE HD1% 1.0 . 4.00 1240 1181 A 93 ALA HB% A 94 ILE HB 1.0 . 5.10 1241 1182 A 93 ALA HB% A 96 GLN HBx 1.0 . 5.46 1242 1183 A 93 ALA HB% A 92 SER HBx 1.0 . 4.13 1243 1183 A 92 SER HBy A 93 ALA HB% 1.0 . 4.13 1244 1184 A 93 ALA HB% A 89 ALA HA 1.0 . 4.07 1245 1185 A 94 ILE H A 93 ALA HB% 1.0 . 3.27 1246 1186 A 93 ALA HB% A 90 LEU H 1.0 . 4.00 1247 1187 A 92 SER H A 93 ALA HB% 1.0 . 5.05 1248 1188 A 93 ALA HB% A 95 TYR H 1.0 . 5.26 1249 1189 A 36 ALA HB% A 35 LYS HA 1.0 . 4.12 1250 1190 A 36 ALA HB% A 39 SER HBx 1.0 . 4.15 1251 1191 A 36 ALA HB% A 110 SER HBx 1.0 . 3.67 1252 1192 A 36 ALA HB% A 110 SER HBy 1.0 . 3.67 1253 1193 A 36 ALA HB% A 108 THR HB 1.0 . 4.11 1254 1194 A 36 ALA HB% A 79 PHE HD% 1.0 . 4.65 1255 1195 A 36 ALA HB% A 79 PHE HE% 1.0 . 5.50 1256 1196 A 36 ALA HB% A 36 ALA H 1.0 . 2.95 1257 1197 A 36 ALA HB% A 37 GLU H 1.0 . 3.42 1258 1198 A 29 ILE HG1x A 53 ALA HB% 1.0 . 3.68 1259 1199 A 29 ILE HG1y A 53 ALA HB% 1.0 . 3.70 1260 1200 A 53 ALA HB% A 92 SER HBx 1.0 . 3.08 1261 1200 A 53 ALA HB% A 92 SER HBy 1.0 . 3.08 1262 1201 A 53 ALA HB% A 52 PRO HA 1.0 . 4.01 1263 1202 A 53 ALA HB% A 27 ASN HA 1.0 . 3.71 1264 1203 A 53 ALA HB% A 53 ALA H 1.0 . 3.00 1265 1204 A 53 ALA HB% A 92 SER H 1.0 . 4.49 1266 1205 A 94 ILE HG2% A 80 VAL HGy% 1.0 . 3.39 1267 1206 A 94 ILE HG2% A 94 ILE HG1x 1.0 . 3.39 1268 1207 A 94 ILE HG2% A 94 ILE HG1y 1.0 . 3.34 1269 1208 A 94 ILE HG2% A 85 PRO HBy 1.0 . 4.24 1270 1209 A 94 ILE HG2% A 98 HIS HBx 1.0 . 3.83 1271 1210 A 94 ILE HG2% A 98 HIS HBy 1.0 . 4.10 1272 1211 A 94 ILE HG2% A 94 ILE HA 1.0 . 3.08 1273 1212 A 94 ILE HG2% A 91 MET HA 1.0 . 4.05 1274 1213 A 94 ILE HG2% A 98 HIS HA 1.0 . 5.17 1275 1214 A 94 ILE HG2% A 98 HIS HD2 1.0 . 3.30 1276 1215 A 94 ILE HG2% A 95 TYR H 1.0 . 3.77 1277 1216 A 89 ALA HB% A 86 PRO HGx 1.0 . 3.53 1278 1217 A 89 ALA HB% A 86 PRO HGy 1.0 . 3.53 1279 1218 A 89 ALA HB% A 86 PRO HDx 1.0 . 3.75 1280 1219 A 89 ALA HB% A 87 THR HA 1.0 . 4.55 1281 1220 A 89 ALA HB% A 86 PRO HDy 1.0 . 3.75 1282 1221 A 89 ALA HB% A 90 LEU H 1.0 . 3.79 1283 1222 A 57 VAL H A 89 ALA HB% 1.0 . 4.31 1284 1223 A 88 ALA HB% A 86 PRO HBy 1.0 . 3.92 1285 1224 A 89 ALA HB% A 86 PRO HBy 1.0 . 4.09 1286 1225 A 56 THR HB A 88 ALA HB% 1.0 . 4.72 1287 1226 A 98 HIS HBx A 80 VAL HGy% 1.0 . 4.88 1288 1227 A 98 HIS HBy A 80 VAL HGy% 1.0 . 4.84 1289 1228 A 85 PRO HDy A 80 VAL HGy% 1.0 . 4.97 1290 1229 A 80 VAL HA A 80 VAL HGy% 1.0 . 3.39 1291 1230 A 107 VAL HA A 80 VAL HGy% 1.0 . 4.60 1292 1231 A 79 PHE HA A 80 VAL HGy% 1.0 . 5.50 1293 1232 A 83 THR H A 80 VAL HGy% 1.0 . 4.98 1294 1233 A 80 VAL H A 80 VAL HGy% 1.0 . 3.96 1295 1234 A 81 ASN H A 80 VAL HGy% 1.0 . 4.67 1296 1235 A 63 VAL HA A 63 VAL HGx% 1.0 . 3.24 1297 1236 A 60 PHE HA A 63 VAL HGx% 1.0 . 4.55 1298 1237 A 63 VAL H A 63 VAL HGx% 1.0 . 3.76 1299 1238 A 107 VAL HA A 107 VAL HGx% 1.0 . 3.49 1300 1239 A 33 CYS HA A 107 VAL HGx% 1.0 . 4.57 1301 1240 A 60 PHE HD% A 107 VAL HGx% 1.0 . 4.57 1302 1241 A 107 VAL H A 107 VAL HGx% 1.0 . 3.81 1303 1242 A 74 LYS HA A 75 ALA HB% 1.0 . 3.87 1304 1243 A 76 ILE H A 75 ALA HB% 1.0 . 3.01 1305 1244 A 83 THR HG2% A 80 VAL HGx% 1.0 . 4.34 1306 1245 A 83 THR HG2% A 80 VAL HGy% 1.0 . 4.34 1307 1246 A 81 ASN HBx A 83 THR HG2% 1.0 . 4.03 1308 1247 A 81 ASN HBy A 83 THR HG2% 1.0 . 5.18 1309 1248 A 83 THR HG2% A 85 PRO HDy 1.0 . 4.07 1310 1249 A 83 THR HG2% A 83 THR HA 1.0 . 3.28 1311 1250 A 83 THR HG2% A 84 LEU HA 1.0 . 4.74 1312 1251 A 83 THR H A 83 THR HG2% 1.0 . 3.36 1313 1252 A 114 THR HG2% A 114 THR HA 1.0 . 3.16 1314 1253 A 114 THR HG2% A 115 PHE HD% 1.0 . 5.01 1315 1254 A 57 VAL HGx% A 78 ILE HG1y 1.0 . 4.21 1316 1255 A 57 VAL HGx% A 85 PRO HGy 1.0 . 4.49 1317 1256 A 57 VAL HGx% A 85 PRO HBy 1.0 . 3.61 1318 1257 A 57 VAL HGx% A 85 PRO HGx 1.0 . 3.37 1319 1258 A 57 VAL HGx% A 57 VAL HA 1.0 . 3.17 1320 1259 A 57 VAL HGx% A 87 THR HA 1.0 . 3.08 1321 1260 A 57 VAL HGx% A 85 PRO HDy 1.0 . 4.95 1322 1261 A 57 VAL HGx% A 85 PRO HDx 1.0 . 4.46 1323 1262 A 57 VAL HGx% A 89 ALA H 1.0 . 4.64 1324 1263 A 57 VAL HGx% A 59 GLN H 1.0 . 4.76 1325 1264 A 57 VAL HGx% A 78 ILE H 1.0 . 5.10 1326 1265 A 57 VAL HGx% A 60 PHE H 1.0 . 4.49 1327 1266 A 58 GLY H A 57 VAL HGx% 1.0 . 3.69 1328 1267 A 94 ILE HG2% A 80 VAL HGx% 1.0 . 3.39 1329 1268 A 98 HIS HBx A 80 VAL HGx% 1.0 . 4.88 1330 1269 A 98 HIS HBy A 80 VAL HGx% 1.0 . 4.84 1331 1270 A 85 PRO HDy A 80 VAL HGx% 1.0 . 4.97 1332 1271 A 80 VAL HA A 80 VAL HGx% 1.0 . 3.39 1333 1272 A 107 VAL HA A 80 VAL HGx% 1.0 . 4.60 1334 1273 A 98 HIS HD2 A 80 VAL HGx% 1.0 . 4.06 1335 1274 A 83 THR H A 80 VAL HGx% 1.0 . 4.98 1336 1275 A 81 ASN H A 80 VAL HGx% 1.0 . 4.67 1337 1276 A 51 VAL HA A 51 VAL HGy% 1.0 . 4.01 1338 1277 A 51 VAL H A 51 VAL HGy% 1.0 . 3.84 1339 1278 A 91 MET HE% A 31 VAL HGy% 1.0 . 3.47 1340 1279 A 105 LEU HBy A 31 VAL HGy% 1.0 . 3.82 1341 1280 A 105 LEU HBx A 31 VAL HGy% 1.0 . 4.46 1342 1281 A 49 TYR HBx A 31 VAL HGy% 1.0 . 4.75 1343 1282 A 31 VAL HGy% A 49 TYR HBy 1.0 . 4.75 1344 1283 A 31 VAL HA A 31 VAL HGy% 1.0 . 3.46 1345 1284 A 60 PHE HE% A 31 VAL HGy% 1.0 . 4.57 1346 1285 A 32 ILE H A 31 VAL HGy% 1.0 . 4.19 1347 1286 A 31 VAL H A 31 VAL HGy% 1.0 . 3.98 1348 1287 A 61 VAL HGx% A 64 ILE HG2% 1.0 . 4.33 1349 1288 A 78 ILE HG1x A 61 VAL HGx% 1.0 . 4.36 1350 1289 A 76 ILE HG1y A 61 VAL HGx% 1.0 . 4.60 1351 1290 A 61 VAL HGx% A 61 VAL HA 1.0 . 3.09 1352 1291 A 61 VAL HGx% A 62 TYR HA 1.0 . 4.00 1353 1292 A 77 PHE HA A 61 VAL HGx% 1.0 . 4.32 1354 1293 A 76 ILE H A 61 VAL HGx% 1.0 . 4.44 1355 1294 A 78 ILE H A 61 VAL HGx% 1.0 . 4.75 1356 1295 A 61 VAL HGx% A 61 VAL H 1.0 . 3.71 1357 1296 A 107 VAL HA A 107 VAL HGy% 1.0 . 3.49 1358 1297 A 33 CYS HA A 107 VAL HGy% 1.0 . 4.57 1359 1298 A 108 THR HA A 107 VAL HGy% 1.0 . 5.08 1360 1299 A 60 PHE HE% A 107 VAL HGy% 1.0 . 3.99 1361 1300 A 60 PHE HD% A 107 VAL HGy% 1.0 . 4.57 1362 1301 A 34 GLU H A 107 VAL HGy% 1.0 . 5.32 1363 1302 A 32 ILE H A 107 VAL HGy% 1.0 . 5.50 1364 1303 A 108 THR H A 107 VAL HGy% 1.0 . 4.23 1365 1304 A 107 VAL H A 107 VAL HGy% 1.0 . 3.81 1366 1305 A 4 THR HA A 4 THR HG2% 1.0 . 3.04 1367 1306 A 4 THR HG2% A 3 SER HA 1.0 . 3.99 1368 1307 A 7 SER H A 4 THR HG2% 1.0 . 5.12 1369 1308 A 6 LYS H A 4 THR HG2% 1.0 . 5.18 1370 1309 A 4 THR H A 4 THR HG2% 1.0 . 4.03 1371 1310 A 56 THR HG2% A 90 LEU HG 1.0 . 4.20 1372 1311 A 56 THR HG2% A 59 GLN HBx 1.0 . 4.34 1373 1312 A 56 THR HG2% A 59 GLN HGx 1.0 . 4.12 1374 1312 A 56 THR HG2% A 59 GLN HGy 1.0 . 4.12 1375 1313 A 56 THR HG2% A 59 GLN HBy 1.0 . 4.34 1376 1314 A 56 THR HG2% A 88 ALA HA 1.0 . 3.58 1377 1315 A 56 THR HG2% A 90 LEU HA 1.0 . 3.56 1378 1316 A 56 THR HG2% A 56 THR HA 1.0 . 3.05 1379 1317 A 56 THR HG2% A 56 THR HG1 1.0 . 3.56 1380 1318 A 56 THR HG2% A 59 GLN H 1.0 . 4.14 1381 1319 A 56 THR HG2% A 56 THR H 1.0 . 3.02 1382 1320 A 56 THR HG2% A 57 VAL H 1.0 . 3.98 1383 1321 A 108 THR HG2% A 34 GLU HBx 1.0 . 4.27 1384 1322 A 108 THR HG2% A 34 GLU HBy 1.0 . 4.27 1385 1323 A 108 THR HG2% A 79 PHE HBx 1.0 . 4.17 1386 1323 A 79 PHE HBy A 108 THR HG2% 1.0 . 4.17 1387 1324 A 35 LYS HA A 108 THR HG2% 1.0 . 4.12 1388 1325 A 108 THR HG2% A 36 ALA HA 1.0 . 3.16 1389 1326 A 108 THR HA A 108 THR HG2% 1.0 . 3.15 1390 1327 A 109 TYR H A 108 THR HG2% 1.0 . 3.42 1391 1328 A 108 THR HG2% A 36 ALA H 1.0 . 3.27 1392 1329 A 108 THR H A 108 THR HG2% 1.0 . 4.07 1393 1330 A 57 VAL HGx% A 87 THR HG2% 1.0 . 3.85 1394 1331 A 87 THR HG2% A 87 THR HA 1.0 . 3.01 1395 1332 A 87 THR HG2% A 58 GLY HAx 1.0 . 3.97 1396 1333 A 87 THR HG2% A 86 PRO HA 1.0 . 3.94 1397 1334 A 87 THR HG2% A 89 ALA H 1.0 . 4.88 1398 1335 A 57 VAL H A 87 THR HG2% 1.0 . 5.50 1399 1336 A 58 GLY H A 87 THR HG2% 1.0 . 4.23 1400 1337 A 99 LYS HBy A 99 LYS HGx 1.0 . 2.97 1401 1337 A 99 LYS HGx A 99 LYS HBx 1.0 . 2.97 1402 1338 A 99 LYS HBy A 99 LYS HGy 1.0 . 2.97 1403 1338 A 99 LYS HBx A 99 LYS HGy 1.0 . 2.97 1404 1339 A 99 LYS H A 99 LYS HGy 1.0 . 3.77 1405 1340 A 29 ILE HG2% A 51 VAL HGx% 1.0 . 4.49 1406 1341 A 91 MET HE% A 51 VAL HGx% 1.0 . 3.75 1407 1342 A 51 VAL HGx% A 91 MET HGx 1.0 . 5.15 1408 1343 A 51 VAL HGx% A 91 MET HGy 1.0 . 5.15 1409 1344 A 51 VAL HA A 51 VAL HGx% 1.0 . 4.01 1410 1345 A 51 VAL H A 51 VAL HGx% 1.0 . 3.84 1411 1346 A 35 LYS H A 35 LYS HGy 1.0 . 5.01 1412 1347 A 105 LEU HBy A 31 VAL HGx% 1.0 . 3.82 1413 1348 A 105 LEU HBx A 31 VAL HGx% 1.0 . 4.46 1414 1349 A 31 VAL HGx% A 49 TYR HBx 1.0 . 4.75 1415 1350 A 31 VAL HGx% A 49 TYR HBy 1.0 . 4.75 1416 1351 A 31 VAL HA A 31 VAL HGx% 1.0 . 3.46 1417 1352 A 60 PHE HE% A 31 VAL HGx% 1.0 . 4.57 1418 1353 A 32 ILE H A 31 VAL HGx% 1.0 . 4.19 1419 1354 A 64 ILE HD1% A 63 VAL HGy% 1.0 . 4.63 1420 1355 A 63 VAL HA A 63 VAL HGy% 1.0 . 3.24 1421 1356 A 60 PHE HA A 63 VAL HGy% 1.0 . 4.55 1422 1357 A 63 VAL H A 63 VAL HGy% 1.0 . 3.76 1423 1358 A 90 LEU HBx A 90 LEU HDx% 1.0 . 3.31 1424 1359 A 90 LEU HA A 90 LEU HDx% 1.0 . 4.09 1425 1360 A 93 ALA H A 90 LEU HDx% 1.0 . 5.21 1426 1361 A 90 LEU H A 90 LEU HDx% 1.0 . 3.70 1427 1362 A 64 ILE HD1% A 61 VAL HGy% 1.0 . 5.30 1428 1363 A 78 ILE HD1% A 61 VAL HGy% 1.0 . 2.61 1429 1364 A 78 ILE HG1y A 61 VAL HGy% 1.0 . 3.41 1430 1365 A 78 ILE HB A 61 VAL HGy% 1.0 . 3.92 1431 1366 A 61 VAL HA A 61 VAL HGy% 1.0 . 3.04 1432 1367 A 58 GLY HAy A 61 VAL HGy% 1.0 . 3.55 1433 1368 A 58 GLY HAx A 61 VAL HGy% 1.0 . 4.60 1434 1369 A 77 PHE HA A 61 VAL HGy% 1.0 . 4.42 1435 1370 A 78 ILE HA A 61 VAL HGy% 1.0 . 4.76 1436 1371 A 60 PHE HD% A 61 VAL HGy% 1.0 . 4.33 1437 1372 A 62 TYR H A 61 VAL HGy% 1.0 . 4.06 1438 1373 A 78 ILE H A 61 VAL HGy% 1.0 . 4.11 1439 1374 A 65 ARG H A 61 VAL HGy% 1.0 . 5.50 1440 1375 A 60 PHE H A 61 VAL HGy% 1.0 . 4.24 1441 1376 A 61 VAL H A 61 VAL HGy% 1.0 . 2.96 1442 1377 A 57 VAL HGy% A 89 ALA HB% 1.0 . 2.87 1443 1378 A 57 VAL HGy% A 94 ILE HG1y 1.0 . 3.54 1444 1379 A 57 VAL HGy% A 85 PRO HBy 1.0 . 3.35 1445 1380 A 57 VAL HGy% A 57 VAL HA 1.0 . 3.03 1446 1381 A 57 VAL HGy% A 91 MET HA 1.0 . 3.79 1447 1382 A 57 VAL HGy% A 90 LEU HA 1.0 . 4.77 1448 1383 A 57 VAL HGy% A 60 PHE H 1.0 . 5.09 1449 1384 A 57 VAL HGy% A 57 VAL H 1.0 . 2.93 1450 1385 A 105 LEU HBx A 105 LEU HDy% 1.0 . 3.50 1451 1386 A 105 LEU HA A 105 LEU HDy% 1.0 . 4.47 1452 1387 A 16 ALA HA A 15 LYS HGy 1.0 . 4.53 1453 1388 A 16 ALA HA A 15 LYS HGx 1.0 . 4.60 1454 1389 A 16 ALA H A 15 LYS HGy 1.0 . 4.47 1455 1390 A 63 VAL HA A 66 LYS HGx 1.0 . 5.14 1456 1391 A 63 VAL HA A 66 LYS HGy 1.0 . 5.14 1457 1392 A 21 ILE HG2% A 50 LEU HDx% 1.0 . 3.38 1458 1393 A 50 LEU HDx% A 50 LEU HBx 1.0 . 3.85 1459 1394 A 50 LEU HDx% A 50 LEU HBy 1.0 . 3.85 1460 1395 A 50 LEU HDx% A 48 LYS HEx 1.0 . 4.77 1461 1395 A 48 LYS HEy A 50 LEU HDx% 1.0 . 4.77 1462 1396 A 25 PHE HBx A 50 LEU HDx% 1.0 . 4.55 1463 1397 A 50 LEU HA A 50 LEU HDx% 1.0 . 3.98 1464 1398 A 51 VAL H A 50 LEU HDx% 1.0 . 5.50 1465 1399 A 50 LEU H A 50 LEU HDx% 1.0 . 5.22 1466 1400 A 21 ILE HD1% A 50 LEU HDy% 1.0 . 4.17 1467 1401 A 50 LEU HBx A 50 LEU HDy% 1.0 . 3.85 1468 1402 A 50 LEU HBy A 50 LEU HDy% 1.0 . 3.85 1469 1403 A 48 LYS HEx A 50 LEU HDy% 1.0 . 4.77 1470 1403 A 48 LYS HEy A 50 LEU HDy% 1.0 . 4.77 1471 1404 A 25 PHE HBx A 50 LEU HDy% 1.0 . 4.55 1472 1405 A 50 LEU HA A 50 LEU HDy% 1.0 . 3.98 1473 1406 A 25 PHE HD% A 50 LEU HDy% 1.0 . 4.32 1474 1407 A 51 VAL H A 50 LEU HDy% 1.0 . 5.50 1475 1408 A 50 LEU H A 50 LEU HDy% 1.0 . 5.22 1476 1409 A 31 VAL H A 50 LEU HDy% 1.0 . 5.50 1477 1410 A 75 ALA H A 74 LYS HGx 1.0 . 4.93 1478 1411 A 90 LEU HBx A 90 LEU HDy% 1.0 . 3.31 1479 1412 A 90 LEU HA A 90 LEU HDy% 1.0 . 4.09 1480 1413 A 93 ALA H A 90 LEU HDy% 1.0 . 5.21 1481 1414 A 90 LEU H A 90 LEU HDy% 1.0 . 3.70 1482 1415 A 92 SER H A 90 LEU HDy% 1.0 . 4.66 1483 1416 A 106 TYR HD% A 32 ILE HG1x 1.0 . 5.01 1484 1417 A 106 TYR HD% A 32 ILE HG1y 1.0 . 5.01 1485 1418 A 13 LYS HEy A 13 LYS HGx 1.0 . 3.76 1486 1418 A 13 LYS HGx A 13 LYS HEx 1.0 . 3.76 1487 1419 A 13 LYS HEy A 13 LYS HGy 1.0 . 3.76 1488 1419 A 13 LYS HEx A 13 LYS HGy 1.0 . 3.76 1489 1420 A 10 PRO HDx A 13 LYS HGx 1.0 . 4.70 1490 1421 A 10 PRO HDx A 13 LYS HGy 1.0 . 4.70 1491 1422 A 13 LYS HA A 13 LYS HGy 1.0 . 3.87 1492 1423 A 13 LYS H A 13 LYS HGx 1.0 . 4.71 1493 1424 A 13 LYS H A 13 LYS HGy 1.0 . 4.71 1494 1425 A 68 ILE HD1% A 70 LEU HDx% 1.0 . 3.71 1495 1426 A 70 LEU HDx% A 70 LEU HBx 1.0 . 3.94 1496 1427 A 74 LYS HDy A 70 LEU HDx% 1.0 . 3.94 1497 1427 A 70 LEU HDx% A 74 LYS HDx 1.0 . 3.94 1498 1428 A 41 ILE HB A 70 LEU HDx% 1.0 . 4.04 1499 1429 A 70 LEU HDx% A 65 ARG HDx 1.0 . 4.75 1500 1429 A 65 ARG HDy A 70 LEU HDx% 1.0 . 4.75 1501 1430 A 42 PRO HDx A 70 LEU HDx% 1.0 . 4.67 1502 1431 A 71 PRO HDx A 70 LEU HDx% 1.0 . 4.36 1503 1432 A 71 PRO HDy A 70 LEU HDx% 1.0 . 4.89 1504 1433 A 70 LEU HA A 70 LEU HDx% 1.0 . 4.16 1505 1434 A 84 LEU HDx% A 84 LEU HBx 1.0 . 3.49 1506 1435 A 84 LEU HDx% A 84 LEU HBy 1.0 . 3.49 1507 1436 A 77 PHE HBx A 84 LEU HDx% 1.0 . 4.21 1508 1437 A 77 PHE HBy A 84 LEU HDx% 1.0 . 3.89 1509 1438 A 113 ASN HA A 84 LEU HDx% 1.0 . 4.44 1510 1439 A 85 PRO HDx A 84 LEU HDx% 1.0 . 5.12 1511 1440 A 84 LEU HA A 84 LEU HDx% 1.0 . 3.81 1512 1441 A 113 ASN HD2x A 84 LEU HDx% 1.0 . 4.66 1513 1442 A 79 PHE HZ A 84 LEU HDx% 1.0 . 4.75 1514 1443 A 78 ILE H A 84 LEU HDx% 1.0 . 5.10 1515 1444 A 55 LEU HBx A 55 LEU HDy% 1.0 . 3.59 1516 1445 A 55 LEU HBy A 55 LEU HDy% 1.0 . 3.49 1517 1446 A 59 GLN HBy A 55 LEU HDy% 1.0 . 4.42 1518 1447 A 55 LEU HA A 55 LEU HDy% 1.0 . 3.73 1519 1448 A 62 TYR HD% A 55 LEU HDy% 1.0 . 4.38 1520 1449 A 84 LEU HBx A 84 LEU HDy% 1.0 . 3.49 1521 1450 A 84 LEU HBy A 84 LEU HDy% 1.0 . 3.49 1522 1451 A 77 PHE HBx A 84 LEU HDy% 1.0 . 4.21 1523 1452 A 77 PHE HBy A 84 LEU HDy% 1.0 . 3.89 1524 1453 A 113 ASN HA A 84 LEU HDy% 1.0 . 4.44 1525 1454 A 85 PRO HDx A 84 LEU HDy% 1.0 . 5.12 1526 1455 A 77 PHE HA A 84 LEU HDy% 1.0 . 4.61 1527 1456 A 84 LEU HA A 84 LEU HDy% 1.0 . 3.81 1528 1457 A 77 PHE HD% A 84 LEU HDy% 1.0 . 3.56 1529 1458 A 78 ILE H A 84 LEU HDy% 1.0 . 5.10 1530 1459 A 84 LEU H A 84 LEU HDy% 1.0 . 4.44 1531 1460 A 101 LYS HGx A 101 LYS HEx 1.0 . 3.93 1532 1460 A 101 LYS HEy A 101 LYS HGx 1.0 . 3.93 1533 1461 A 101 LYS HEy A 101 LYS HGy 1.0 . 3.93 1534 1461 A 101 LYS HEx A 101 LYS HGy 1.0 . 3.93 1535 1462 A 101 LYS HA A 101 LYS HGy 1.0 . 3.85 1536 1463 A 101 LYS H A 101 LYS HGy 1.0 . 4.10 1537 1464 A 5 PHE H A 47 ARG HGx 1.0 . 4.70 1538 1465 A 5 PHE H A 47 ARG HGy 1.0 . 4.70 1539 1466 A 68 ILE HD1% A 70 LEU HDy% 1.0 . 3.71 1540 1467 A 70 LEU HBx A 70 LEU HDy% 1.0 . 3.94 1541 1468 A 41 ILE HB A 70 LEU HDy% 1.0 . 4.04 1542 1469 A 65 ARG HDy A 70 LEU HDy% 1.0 . 4.75 1543 1469 A 65 ARG HDx A 70 LEU HDy% 1.0 . 4.75 1544 1470 A 42 PRO HDx A 70 LEU HDy% 1.0 . 4.67 1545 1471 A 71 PRO HDx A 70 LEU HDy% 1.0 . 4.36 1546 1472 A 55 LEU HBx A 55 LEU HDx% 1.0 . 3.59 1547 1473 A 55 LEU HBy A 55 LEU HDx% 1.0 . 3.49 1548 1474 A 55 LEU HDx% A 59 GLN HBy 1.0 . 4.42 1549 1475 A 60 PHE HA A 55 LEU HDx% 1.0 . 4.70 1550 1476 A 59 GLN HE2y A 55 LEU HDx% 1.0 . 6.29 1551 1477 A 105 LEU HBx A 105 LEU HDx% 1.0 . 3.50 1552 1478 A 95 TYR HBx A 105 LEU HDx% 1.0 . 4.81 1553 1479 A 95 TYR HA A 105 LEU HDx% 1.0 . 3.67 1554 1480 A 106 TYR H A 105 LEU HDx% 1.0 . 5.12 1555 1481 A 70 LEU H A 68 ILE HG1x 1.0 . 4.74 1556 1482 A 70 LEU H A 68 ILE HG1y 1.0 . 4.74 1557 1483 A 64 ILE HG1y A 64 ILE H 1.0 . 3.98 1558 1484 A 29 ILE HG1x A 92 SER HA 1.0 . 4.64 1559 1485 A 29 ILE HG1y A 92 SER HA 1.0 . 4.50 1560 1486 A 29 ILE HG1y A 29 ILE H 1.0 . 4.63 1561 1487 A 6 LYS H A 6 LYS HGx 1.0 . 5.05 1562 1488 A 6 LYS H A 6 LYS HGy 1.0 . 5.05 1563 1489 A 21 ILE HD1% A 30 PRO HGx 1.0 . 5.00 1564 1490 A 29 ILE HA A 30 PRO HGy 1.0 . 4.48 1565 1491 A 105 LEU H A 30 PRO HGy 1.0 . 5.50 1566 1492 A 105 LEU H A 30 PRO HGx 1.0 . 4.67 1567 1493 A 94 ILE HD1% A 85 PRO HGy 1.0 . 3.60 1568 1494 A 85 PRO HGx A 94 ILE HD1% 1.0 . 3.76 1569 1495 A 57 VAL HGy% A 85 PRO HGx 1.0 . 3.99 1570 1496 A 24 ARG HA A 24 ARG HGx 1.0 . 4.15 1571 1497 A 24 ARG HA A 24 ARG HGy 1.0 . 4.15 1572 1498 A 84 LEU HA A 85 PRO HGy 1.0 . 4.75 1573 1499 A 78 ILE HG1x A 61 VAL HGy% 1.0 . 3.22 1574 1500 A 98 HIS HD2 A 94 ILE HG1y 1.0 . 5.03 1575 1501 A 94 ILE H A 94 ILE HG1y 1.0 . 3.88 1576 1502 A 95 TYR H A 94 ILE HG1y 1.0 . 5.04 1577 1503 A 84 LEU HG A 85 PRO HDy 1.0 . 4.77 1578 1504 A 84 LEU HG A 85 PRO HDx 1.0 . 4.61 1579 1505 A 77 PHE HD% A 84 LEU HG 1.0 . 5.07 1580 1506 A 79 PHE HE% A 84 LEU HG 1.0 . 5.14 1581 1507 A 84 LEU HG A 84 LEU H 1.0 . 4.40 1582 1508 A 50 LEU HA A 50 LEU HG 1.0 . 4.17 1583 1509 A 50 LEU H A 50 LEU HG 1.0 . 4.61 1584 1510 A 106 TYR H A 105 LEU HG 1.0 . 5.10 1585 1511 A 56 THR HG2% A 55 LEU HG 1.0 . 5.50 1586 1512 A 56 THR H A 55 LEU HG 1.0 . 4.33 1587 1513 A 25 PHE HA A 26 PRO HGx 1.0 . 4.80 1588 1514 A 25 PHE HA A 26 PRO HGy 1.0 . 4.80 1589 1515 A 25 PHE HBy A 28 ARG HGx 1.0 . 4.09 1590 1515 A 28 ARG HGy A 25 PHE HBy 1.0 . 4.09 1591 1516 A 25 PHE HBx A 28 ARG HGx 1.0 . 4.67 1592 1516 A 28 ARG HGy A 25 PHE HBx 1.0 . 4.67 1593 1517 A 28 ARG HA A 28 ARG HGx 1.0 . 3.85 1594 1517 A 28 ARG HGy A 28 ARG HA 1.0 . 3.85 1595 1518 A 67 ARG HA A 67 ARG HGy 1.0 . 4.20 1596 1519 A 67 ARG H A 67 ARG HGy 1.0 . 4.50 1597 1520 A 90 LEU HA A 90 LEU HG 1.0 . 4.04 1598 1521 A 93 ALA H A 90 LEU HG 1.0 . 5.38 1599 1522 A 90 LEU H A 90 LEU HG 1.0 . 4.34 1600 1523 A 91 MET H A 90 LEU HG 1.0 . 5.36 1601 1524 A 71 PRO HGx A 74 LYS HGx 1.0 . 4.58 1602 1525 A 71 PRO HGx A 74 LYS HGy 1.0 . 4.58 1603 1526 A 85 PRO HA A 86 PRO HGx 1.0 . 4.91 1604 1527 A 85 PRO HA A 86 PRO HGy 1.0 . 4.91 1605 1528 A 89 ALA H A 86 PRO HGx 1.0 . 4.93 1606 1529 A 13 LYS HEy A 10 PRO HGx 1.0 . 5.50 1607 1529 A 10 PRO HGx A 13 LYS HEx 1.0 . 5.50 1608 1530 A 13 LYS HEy A 10 PRO HGy 1.0 . 5.50 1609 1530 A 10 PRO HGy A 13 LYS HEx 1.0 . 5.50 1610 1531 A 76 ILE HG2% A 76 ILE HG1x 1.0 . 3.91 1611 1532 A 76 ILE HG1y A 76 ILE HA 1.0 . 3.90 1612 1533 A 76 ILE H A 76 ILE HG1x 1.0 . 4.72 1613 1534 A 93 ALA HA A 96 GLN HBx 1.0 . 4.06 1614 1535 A 97 GLU H A 96 GLN HBx 1.0 . 4.62 1615 1536 A 74 LYS H A 73 GLU HBx 1.0 . 4.79 1616 1537 A 74 LYS H A 73 GLU HBy 1.0 . 4.79 1617 1538 A 41 ILE HG1x A 68 ILE HD1% 1.0 . 4.20 1618 1539 A 41 ILE HG2% A 41 ILE HG1y 1.0 . 3.61 1619 1540 A 41 ILE HG1x A 42 PRO HDx 1.0 . 4.07 1620 1541 A 41 ILE HG1y A 42 PRO HDx 1.0 . 4.18 1621 1542 A 41 ILE HG1x A 42 PRO HDy 1.0 . 4.71 1622 1543 A 41 ILE HG1y A 42 PRO HDy 1.0 . 4.20 1623 1544 A 41 ILE HG1x A 42 PRO HA 1.0 . 4.56 1624 1545 A 46 LYS H A 44 ILE HG1y 1.0 . 4.29 1625 1546 A 74 LYS HDy A 70 LEU HDy% 1.0 . 3.94 1626 1546 A 70 LEU HDy% A 74 LYS HDx 1.0 . 3.94 1627 1547 A 71 PRO HDx A 74 LYS HDx 1.0 . 4.19 1628 1547 A 71 PRO HDx A 74 LYS HDy 1.0 . 4.19 1629 1548 A 71 PRO HDy A 74 LYS HDx 1.0 . 5.04 1630 1548 A 74 LYS HDy A 71 PRO HDy 1.0 . 5.04 1631 1549 A 74 LYS H A 74 LYS HDx 1.0 . 4.99 1632 1549 A 74 LYS H A 74 LYS HDy 1.0 . 4.99 1633 1550 A 33 CYS HBy A 49 TYR HE% 1.0 . 4.55 1634 1551 A 34 GLU H A 33 CYS HBx 1.0 . 4.62 1635 1552 A 38 LYS HA A 38 LYS HDy 1.0 . 4.38 1636 1553 A 38 LYS HDx A 38 LYS HA 1.0 . 4.56 1637 1554 A 38 LYS HDx A 38 LYS H 1.0 . 4.51 1638 1555 A 63 VAL HA A 66 LYS HDx 1.0 . 4.75 1639 1555 A 63 VAL HA A 66 LYS HDy 1.0 . 4.75 1640 1556 A 66 LYS H A 66 LYS HDx 1.0 . 5.01 1641 1556 A 66 LYS H A 66 LYS HDy 1.0 . 5.01 1642 1557 A 101 LYS HA A 101 LYS HDx 1.0 . 4.23 1643 1557 A 101 LYS HA A 101 LYS HDy 1.0 . 4.23 1644 1558 A 101 LYS H A 101 LYS HDx 1.0 . 4.25 1645 1558 A 101 LYS H A 101 LYS HDy 1.0 . 4.25 1646 1559 A 10 PRO HDx A 13 LYS HDx 1.0 . 4.57 1647 1559 A 10 PRO HDx A 13 LYS HDy 1.0 . 4.57 1648 1560 A 9 TYR HD% A 13 LYS HDx 1.0 . 4.49 1649 1560 A 13 LYS HDy A 9 TYR HD% 1.0 . 4.49 1650 1561 A 13 LYS H A 13 LYS HDx 1.0 . 4.82 1651 1561 A 13 LYS H A 13 LYS HDy 1.0 . 4.82 1652 1562 A 55 LEU HDx% A 59 GLN HBx 1.0 . 4.42 1653 1563 A 55 LEU HDy% A 59 GLN HBx 1.0 . 4.42 1654 1564 A 41 ILE HG2% A 35 LYS HDy 1.0 . 3.65 1655 1565 A 36 ALA HA A 35 LYS HDx 1.0 . 4.89 1656 1566 A 109 TYR HE% A 35 LYS HDy 1.0 . 4.47 1657 1567 A 109 TYR HD% A 35 LYS HDy 1.0 . 5.03 1658 1568 A 2 LYS HDx A 2 LYS HEx 1.0 . 2.94 1659 1568 A 2 LYS HDy A 2 LYS HEx 1.0 . 2.94 1660 1568 A 2 LYS HEy A 2 LYS HDx 1.0 . 2.94 1661 1568 A 2 LYS HDy A 2 LYS HEy 1.0 . 2.94 1662 1569 A 20 ARG H A 19 GLU HBy 1.0 . 4.21 1663 1570 A 20 ARG H A 19 GLU HBx 1.0 . 4.07 1664 1571 A 99 LYS HA A 99 LYS HDx 1.0 . 4.51 1665 1572 A 100 ASP HA A 99 LYS HDy 1.0 . 5.50 1666 1573 A 100 ASP HA A 99 LYS HDx 1.0 . 4.31 1667 1574 A 99 LYS H A 99 LYS HDy 1.0 . 4.84 1668 1575 A 99 LYS H A 99 LYS HDx 1.0 . 4.47 1669 1576 A 15 LYS HDy A 15 LYS HA 1.0 . 4.92 1670 1577 A 11 PHE HZ A 15 LYS HDx 1.0 . 4.66 1671 1578 A 15 LYS HDx A 11 PHE HE% 1.0 . 4.29 1672 1579 A 15 LYS HDy A 15 LYS H 1.0 . 4.71 1673 1580 A 15 LYS H A 15 LYS HDx 1.0 . 5.18 1674 1581 A 66 LYS H A 65 ARG HBx 1.0 . 4.74 1675 1582 A 66 LYS H A 65 ARG HBy 1.0 . 4.74 1676 1583 A 36 ALA HB% A 37 GLU HBy 1.0 . 5.17 1677 1584 A 37 GLU H A 37 GLU HBx 1.0 . 3.72 1678 1585 A 57 VAL HGy% A 85 PRO HBx 1.0 . 4.14 1679 1586 A 85 PRO HBx A 86 PRO HDx 1.0 . 4.56 1680 1587 A 85 PRO HBx A 86 PRO HDy 1.0 . 4.56 1681 1588 A 9 TYR H A 8 GLU HBx 1.0 . 5.01 1682 1589 A 9 TYR H A 8 GLU HBy 1.0 . 5.01 1683 1590 A 21 ILE HD1% A 30 PRO HBx 1.0 . 4.09 1684 1591 A 61 VAL HB A 58 GLY HAy 1.0 . 4.15 1685 1592 A 61 VAL HB A 58 GLY HAx 1.0 . 5.31 1686 1593 A 63 VAL HB A 64 ILE H 1.0 . 3.22 1687 1594 A 42 PRO HA A 43 GLU HBx 1.0 . 5.07 1688 1595 A 42 PRO HA A 43 GLU HBy 1.0 . 5.07 1689 1596 A 71 PRO HBx A 72 PRO HDx 1.0 . 3.75 1690 1596 A 72 PRO HDy A 71 PRO HBx 1.0 . 3.75 1691 1597 A 71 PRO HBy A 72 PRO HDx 1.0 . 3.65 1692 1597 A 71 PRO HBy A 72 PRO HDy 1.0 . 3.65 1693 1598 A 73 GLU H A 71 PRO HBx 1.0 . 4.51 1694 1599 A 57 VAL HB A 87 THR HG2% 1.0 . 4.71 1695 1600 A 89 ALA HB% A 86 PRO HBx 1.0 . 4.34 1696 1601 A 86 PRO HBx A 88 ALA H 1.0 . 4.34 1697 1602 A 69 MET HGy A 69 MET HBx 1.0 . 2.87 1698 1602 A 69 MET HBx A 69 MET HGx 1.0 . 2.87 1699 1603 A 69 MET HGy A 69 MET HBy 1.0 . 2.87 1700 1603 A 69 MET HBy A 69 MET HGx 1.0 . 2.87 1701 1604 A 68 ILE HA A 69 MET HGx 1.0 . 4.39 1702 1604 A 69 MET HGy A 68 ILE HA 1.0 . 4.39 1703 1605 A 15 LYS HBy A 102 ASP HA 1.0 . 5.03 1704 1606 A 15 LYS HBy A 16 ALA H 1.0 . 4.11 1705 1607 A 10 PRO HDx A 13 LYS HBx 1.0 . 4.75 1706 1608 A 10 PRO HDx A 13 LYS HBy 1.0 . 4.75 1707 1609 A 10 PRO HDy A 13 LYS HBx 1.0 . 4.88 1708 1610 A 10 PRO HDy A 13 LYS HBy 1.0 . 4.88 1709 1611 A 51 VAL HGy% A 91 MET HGx 1.0 . 5.15 1710 1612 A 91 MET HGy A 51 VAL HGy% 1.0 . 5.15 1711 1613 A 101 LYS HBx A 101 LYS HDx 1.0 . 3.48 1712 1613 A 101 LYS HBy A 101 LYS HDx 1.0 . 3.48 1713 1613 A 101 LYS HDy A 101 LYS HBx 1.0 . 3.48 1714 1613 A 101 LYS HBy A 101 LYS HDy 1.0 . 3.48 1715 1614 A 11 PHE HZ A 101 LYS HBx 1.0 . 3.90 1716 1614 A 101 LYS HBy A 11 PHE HZ 1.0 . 3.90 1717 1615 A 101 LYS H A 101 LYS HBx 1.0 . 3.57 1718 1615 A 101 LYS HBy A 101 LYS H 1.0 . 3.57 1719 1616 A 16 ALA H A 14 ARG HBx 1.0 . 5.50 1720 1616 A 16 ALA H A 14 ARG HBy 1.0 . 5.50 1721 1617 A 74 LYS HBx A 70 LEU HDy% 1.0 . 4.27 1722 1618 A 74 LYS HBx A 70 LEU HDx% 1.0 . 4.27 1723 1619 A 68 ILE HG2% A 42 PRO HBy 1.0 . 4.48 1724 1620 A 43 GLU H A 42 PRO HBx 1.0 . 4.26 1725 1621 A 2 LYS HEy A 2 LYS HBx 1.0 . 5.17 1726 1621 A 2 LYS HBx A 2 LYS HEx 1.0 . 5.17 1727 1622 A 2 LYS HEy A 2 LYS HBy 1.0 . 5.17 1728 1622 A 2 LYS HBy A 2 LYS HEx 1.0 . 5.17 1729 1623 A 96 GLN HBy A 96 GLN HGx 1.0 . 2.78 1730 1623 A 96 GLN HBy A 96 GLN HGy 1.0 . 2.78 1731 1624 A 96 GLN HA A 96 GLN HGx 1.0 . 3.30 1732 1624 A 96 GLN HGy A 96 GLN HA 1.0 . 3.30 1733 1625 A 93 ALA HA A 96 GLN HGx 1.0 . 3.78 1734 1625 A 93 ALA HA A 96 GLN HGy 1.0 . 3.78 1735 1626 A 97 GLU H A 96 GLN HGx 1.0 . 3.80 1736 1626 A 97 GLU H A 96 GLN HGy 1.0 . 3.80 1737 1627 A 80 VAL HB A 98 HIS HBy 1.0 . 5.37 1738 1628 A 80 VAL HB A 85 PRO HDy 1.0 . 4.71 1739 1629 A 80 VAL HB A 107 VAL HA 1.0 . 5.38 1740 1630 A 80 VAL HB A 79 PHE HA 1.0 . 5.07 1741 1631 A 107 VAL HB A 33 CYS HA 1.0 . 4.63 1742 1632 A 98 HIS H A 97 GLU HGx 1.0 . 4.98 1743 1633 A 98 HIS H A 97 GLU HGy 1.0 . 4.90 1744 1634 A 31 VAL HB A 31 VAL H 1.0 . 3.94 1745 1635 A 49 TYR H A 31 VAL HB 1.0 . 5.50 1746 1636 A 73 GLU HA A 73 GLU HGy 1.0 . 3.94 1747 1637 A 74 LYS H A 73 GLU HGx 1.0 . 4.86 1748 1638 A 37 GLU HGx A 38 LYS HGx 1.0 . 4.14 1749 1639 A 37 GLU HGy A 38 LYS HGx 1.0 . 4.14 1750 1640 A 38 LYS HGy A 37 GLU HGx 1.0 . 4.14 1751 1641 A 38 LYS HGy A 37 GLU HGy 1.0 . 4.14 1752 1642 A 37 GLU HA A 37 GLU HGx 1.0 . 3.87 1753 1643 A 37 GLU H A 37 GLU HGy 1.0 . 4.05 1754 1644 A 8 GLU H A 8 GLU HGx 1.0 . 4.95 1755 1645 A 8 GLU H A 8 GLU HGy 1.0 . 4.95 1756 1646 A 113 ASN H A 112 GLU HGx 1.0 . 4.77 1757 1647 A 35 LYS HDy A 43 GLU HGx 1.0 . 5.50 1758 1647 A 43 GLU HGy A 35 LYS HDy 1.0 . 5.50 1759 1648 A 35 LYS HEx A 43 GLU HGx 1.0 . 4.16 1760 1648 A 35 LYS HEy A 43 GLU HGx 1.0 . 4.16 1761 1648 A 43 GLU HGy A 35 LYS HEx 1.0 . 4.16 1762 1648 A 43 GLU HGy A 35 LYS HEy 1.0 . 4.16 1763 1649 A 43 GLU HA A 43 GLU HGx 1.0 . 3.75 1764 1649 A 43 GLU HGy A 43 GLU HA 1.0 . 3.75 1765 1650 A 44 ILE HA A 43 GLU HGx 1.0 . 4.28 1766 1650 A 43 GLU HGy A 44 ILE HA 1.0 . 4.28 1767 1651 A 15 LYS HBy A 12 GLU HGx 1.0 . 5.50 1768 1652 A 15 LYS HBy A 12 GLU HGy 1.0 . 5.50 1769 1653 A 13 LYS H A 12 GLU HGx 1.0 . 5.34 1770 1654 A 77 PHE HZ A 113 ASN HBx 1.0 . 4.84 1771 1655 A 77 PHE HZ A 113 ASN HBy 1.0 . 4.84 1772 1656 A 19 GLU HA A 19 GLU HGx 1.0 . 3.66 1773 1657 A 19 GLU H A 19 GLU HGx 1.0 . 3.79 1774 1658 A 19 GLU H A 19 GLU HGy 1.0 . 3.79 1775 1659 A 82 ASP H A 81 ASN HBx 1.0 . 4.14 1776 1660 A 81 ASN HBx A 81 ASN HD2x 1.0 . 3.68 1777 1661 A 21 ILE HB A 21 ILE HD1% 1.0 . 3.64 1778 1662 A 21 ILE HB A 22 ALA HB% 1.0 . 4.84 1779 1663 A 68 ILE HB A 69 MET HGx 1.0 . 5.00 1780 1663 A 68 ILE HB A 69 MET HGy 1.0 . 5.00 1781 1664 A 32 ILE HG2% A 34 GLU HGx 1.0 . 4.60 1782 1664 A 32 ILE HG2% A 34 GLU HGy 1.0 . 4.60 1783 1665 A 29 ILE HB A 51 VAL HB 1.0 . 4.40 1784 1666 A 29 ILE HB A 50 LEU HA 1.0 . 5.50 1785 1667 A 29 ILE HG1x A 95 TYR HBy 1.0 . 5.18 1786 1668 A 95 TYR HBx A 105 LEU HDy% 1.0 . 4.81 1787 1669 A 57 VAL HGy% A 78 ILE HB 1.0 . 4.47 1788 1670 A 78 ILE HB A 77 PHE HA 1.0 . 4.93 1789 1671 A 12 GLU H A 11 PHE HBx 1.0 . 4.21 1790 1672 A 68 ILE HG2% A 44 ILE HB 1.0 . 3.97 1791 1673 A 41 ILE HB A 42 PRO HDx 1.0 . 4.28 1792 1674 A 41 ILE HB A 111 GLY HAy 1.0 . 4.68 1793 1675 A 41 ILE HB A 42 PRO HDy 1.0 . 4.23 1794 1676 A 76 ILE HB A 61 VAL HGx% 1.0 . 3.91 1795 1677 A 76 ILE HB A 75 ALA HA 1.0 . 4.77 1796 1678 A 76 ILE HB A 77 PHE H 1.0 . 4.80 1797 1679 A 106 TYR HE% A 6 LYS HEy 1.0 . 4.54 1798 1680 A 66 LYS HGx A 66 LYS HEx 1.0 . 4.06 1799 1681 A 66 LYS HGx A 66 LYS HEy 1.0 . 4.06 1800 1682 A 66 LYS HEx A 66 LYS HGy 1.0 . 4.06 1801 1683 A 66 LYS HEy A 66 LYS HGy 1.0 . 4.06 1802 1684 A 13 LYS HDy A 13 LYS HEx 1.0 . 2.71 1803 1684 A 13 LYS HEy A 13 LYS HDx 1.0 . 2.71 1804 1684 A 13 LYS HEy A 13 LYS HDy 1.0 . 2.71 1805 1684 A 13 LYS HDx A 13 LYS HEx 1.0 . 2.71 1806 1685 A 38 LYS HEx A 38 LYS HGx 1.0 . 3.39 1807 1685 A 38 LYS HEy A 38 LYS HGx 1.0 . 3.39 1808 1686 A 38 LYS HEy A 38 LYS HGy 1.0 . 3.39 1809 1686 A 38 LYS HGy A 38 LYS HEx 1.0 . 3.39 1810 1687 A 38 LYS HDy A 38 LYS HEx 1.0 . 3.05 1811 1687 A 38 LYS HDy A 38 LYS HEy 1.0 . 3.05 1812 1688 A 38 LYS HDx A 38 LYS HEx 1.0 . 2.95 1813 1688 A 38 LYS HDx A 38 LYS HEy 1.0 . 2.95 1814 1689 A 101 LYS HDx A 101 LYS HEx 1.0 . 2.78 1815 1689 A 101 LYS HDy A 101 LYS HEx 1.0 . 2.78 1816 1689 A 101 LYS HEy A 101 LYS HDx 1.0 . 2.78 1817 1689 A 101 LYS HEy A 101 LYS HDy 1.0 . 2.78 1818 1690 A 101 LYS HBy A 101 LYS HEx 1.0 . 4.19 1819 1690 A 101 LYS HBx A 101 LYS HEx 1.0 . 4.19 1820 1690 A 101 LYS HEy A 101 LYS HBx 1.0 . 4.19 1821 1690 A 101 LYS HBy A 101 LYS HEy 1.0 . 4.19 1822 1691 A 2 LYS HEy A 2 LYS HGx 1.0 . 3.30 1823 1691 A 2 LYS HGx A 2 LYS HEx 1.0 . 3.30 1824 1692 A 2 LYS HEy A 2 LYS HGy 1.0 . 3.30 1825 1692 A 2 LYS HEx A 2 LYS HGy 1.0 . 3.30 1826 1693 A 76 ILE HG2% A 109 TYR HBy 1.0 . 4.75 1827 1694 A 110 SER H A 109 TYR HBy 1.0 . 4.72 1828 1695 A 74 LYS HGx A 74 LYS HEx 1.0 . 3.50 1829 1695 A 74 LYS HEy A 74 LYS HGx 1.0 . 3.50 1830 1696 A 74 LYS HEy A 74 LYS HGy 1.0 . 3.50 1831 1696 A 74 LYS HEx A 74 LYS HGy 1.0 . 3.50 1832 1697 A 74 LYS HDx A 74 LYS HEx 1.0 . 2.97 1833 1697 A 74 LYS HDy A 74 LYS HEx 1.0 . 2.97 1834 1697 A 74 LYS HEy A 74 LYS HDx 1.0 . 2.97 1835 1697 A 74 LYS HEy A 74 LYS HDy 1.0 . 2.97 1836 1698 A 46 LYS HBy A 46 LYS HEx 1.0 . 4.58 1837 1698 A 46 LYS HEx A 46 LYS HBx 1.0 . 4.58 1838 1699 A 46 LYS HBx A 46 LYS HEy 1.0 . 4.58 1839 1699 A 46 LYS HBy A 46 LYS HEy 1.0 . 4.58 1840 1700 A 35 LYS HGx A 35 LYS HEx 1.0 . 3.64 1841 1700 A 35 LYS HEy A 35 LYS HGx 1.0 . 3.64 1842 1701 A 41 ILE HG1x A 35 LYS HEx 1.0 . 3.64 1843 1701 A 41 ILE HG1x A 35 LYS HEy 1.0 . 3.64 1844 1702 A 35 LYS HEx A 35 LYS HGy 1.0 . 3.64 1845 1702 A 35 LYS HEy A 35 LYS HGy 1.0 . 3.64 1846 1703 A 41 ILE HB A 35 LYS HEx 1.0 . 5.12 1847 1703 A 41 ILE HB A 35 LYS HEy 1.0 . 5.12 1848 1704 A 39 SER H A 35 LYS HEx 1.0 . 5.45 1849 1704 A 39 SER H A 35 LYS HEy 1.0 . 5.45 1850 1705 A 35 LYS H A 35 LYS HEx 1.0 . 5.50 1851 1705 A 35 LYS HEy A 35 LYS H 1.0 . 5.50 1852 1706 A 28 ARG HBy A 28 ARG HDx 1.0 . 4.29 1853 1707 A 28 ARG HBy A 28 ARG HDy 1.0 . 4.29 1854 1708 A 52 PRO HA A 28 ARG HDx 1.0 . 4.40 1855 1709 A 52 PRO HA A 28 ARG HDy 1.0 . 4.40 1856 1710 A 15 LYS HGy A 15 LYS HEx 1.0 . 3.51 1857 1711 A 15 LYS HGy A 15 LYS HEy 1.0 . 3.51 1858 1712 A 15 LYS HGx A 15 LYS HEx 1.0 . 3.48 1859 1713 A 15 LYS HGx A 15 LYS HEy 1.0 . 3.48 1860 1714 A 90 LEU HBx A 93 ALA H 1.0 . 4.54 1861 1715 A 92 SER H A 90 LEU HBy 1.0 . 4.99 1862 1716 A 24 ARG HA A 24 ARG HDx 1.0 . 4.51 1863 1717 A 24 ARG HA A 24 ARG HDy 1.0 . 4.51 1864 1718 A 67 ARG HDx A 49 TYR HE% 1.0 . 4.70 1865 1719 A 67 ARG HDy A 49 TYR HE% 1.0 . 5.45 1866 1720 A 67 ARG HDx A 67 ARG HH2% 1.0 . 4.78 1867 1721 A 67 ARG HDy A 67 ARG HH2% 1.0 . 4.82 1868 1722 A 67 ARG H A 67 ARG HDx 1.0 . 5.42 1869 1723 A 67 ARG H A 67 ARG HDy 1.0 . 4.97 1870 1724 A 20 ARG H A 20 ARG HDy 1.0 . 5.50 1871 1725 A 61 VAL HGx% A 65 ARG HDx 1.0 . 4.56 1872 1725 A 65 ARG HDy A 61 VAL HGx% 1.0 . 4.56 1873 1726 A 65 ARG HH2% A 65 ARG HDx 1.0 . 4.81 1874 1726 A 65 ARG HDy A 65 ARG HH2% 1.0 . 4.81 1875 1727 A 102 ASP H A 100 ASP HBx 1.0 . 4.98 1876 1728 A 102 ASP H A 100 ASP HBy 1.0 . 4.98 1877 1729 A 55 LEU HBx A 51 VAL HB 1.0 . 5.44 1878 1730 A 32 ILE HB A 32 ILE HD1% 1.0 . 4.03 1879 1731 A 32 ILE HD1% A 32 ILE HA 1.0 . 3.68 1880 1732 A 32 ILE HD1% A 48 LYS HA 1.0 . 3.90 1881 1733 A 104 PHE HE% A 32 ILE HD1% 1.0 . 4.35 1882 1734 A 32 ILE HD1% A 5 PHE HD% 1.0 . 4.63 1883 1735 A 33 CYS H A 32 ILE HD1% 1.0 . 4.45 1884 1736 A 68 ILE HD1% A 70 LEU HBx 1.0 . 4.50 1885 1737 A 70 LEU HBy A 70 LEU HDy% 1.0 . 3.94 1886 1738 A 70 LEU HDx% A 70 LEU HBy 1.0 . 3.94 1887 1739 A 71 PRO HDx A 70 LEU HBx 1.0 . 5.04 1888 1740 A 71 PRO HDx A 70 LEU HBy 1.0 . 5.04 1889 1741 A 95 TYR HD% A 105 LEU HBy 1.0 . 4.47 1890 1742 A 103 GLY HAx A 99 LYS HBx 1.0 . 5.14 1891 1742 A 99 LYS HBy A 103 GLY HAx 1.0 . 5.14 1892 1743 A 99 LYS HBy A 103 GLY HAy 1.0 . 5.14 1893 1743 A 99 LYS HBx A 103 GLY HAy 1.0 . 5.14 1894 1744 A 41 ILE HG2% A 111 GLY HAy 1.0 . 4.07 1895 1745 A 41 ILE HG2% A 111 GLY HAx 1.0 . 4.52 1896 1746 A 115 PHE HD% A 116 GLY HAx 1.0 . 4.67 1897 1746 A 116 GLY HAy A 115 PHE HD% 1.0 . 4.67 1898 1747 A 57 VAL HGx% A 58 GLY HAy 1.0 . 4.48 1899 1748 A 87 THR HG2% A 58 GLY HAy 1.0 . 4.47 1900 1749 A 85 PRO HBy A 86 PRO HDx 1.0 . 4.24 1901 1750 A 85 PRO HBy A 86 PRO HDy 1.0 . 4.24 1902 1751 A 71 PRO HDy A 70 LEU HDy% 1.0 . 4.89 1903 1752 A 71 PRO HDx A 70 LEU HG 1.0 . 4.32 1904 1753 A 71 PRO HDy A 70 LEU HG 1.0 . 4.33 1905 1754 A 68 ILE HG2% A 42 PRO HDy 1.0 . 4.85 1906 1755 A 42 PRO HDy A 74 LYS HDx 1.0 . 5.05 1907 1755 A 42 PRO HDy A 74 LYS HDy 1.0 . 5.05 1908 1756 A 113 ASN HA A 77 PHE HBy 1.0 . 4.49 1909 1757 A 113 ASN HA A 79 PHE HZ 1.0 . 3.49 1910 1758 A 113 ASN HA A 79 PHE HE% 1.0 . 3.95 1911 1759 A 113 ASN HA A 114 THR H 1.0 . 3.50 1912 1760 A 84 LEU HG A 84 LEU HA 1.0 . 4.00 1913 1761 A 85 PRO HGx A 84 LEU HA 1.0 . 4.73 1914 1762 A 85 PRO HDy A 84 LEU HA 1.0 . 3.34 1915 1763 A 85 PRO HDx A 84 LEU HA 1.0 . 3.20 1916 1764 A 79 PHE HD% A 84 LEU HA 1.0 . 4.76 1917 1765 A 88 ALA HA A 56 THR HB 1.0 . 3.67 1918 1766 A 88 ALA HA A 56 THR HA 1.0 . 5.32 1919 1767 A 88 ALA HA A 57 VAL H 1.0 . 4.72 1920 1768 A 76 ILE HG2% A 75 ALA HA 1.0 . 4.53 1921 1769 A 75 ALA HA A 74 LYS HA 1.0 . 4.72 1922 1770 A 75 ALA HA A 65 ARG HH2% 1.0 . 4.47 1923 1771 A 57 VAL HGy% A 89 ALA HA 1.0 . 4.65 1924 1772 A 70 LEU HA A 70 LEU HDy% 1.0 . 4.16 1925 1773 A 70 LEU HA A 71 PRO HGx 1.0 . 4.63 1926 1774 A 70 LEU HA A 71 PRO HGy 1.0 . 4.25 1927 1775 A 70 LEU HA A 71 PRO HDx 1.0 . 3.30 1928 1776 A 70 LEU HA A 71 PRO HDy 1.0 . 3.06 1929 1777 A 35 LYS HA A 36 ALA HA 1.0 . 4.57 1930 1778 A 54 ASP HA A 90 LEU HDx% 1.0 . 3.66 1931 1779 A 54 ASP HA A 90 LEU HDy% 1.0 . 3.66 1932 1780 A 29 ILE HD1% A 27 ASN HA 1.0 . 5.02 1933 1781 A 105 LEU HA A 105 LEU HDx% 1.0 . 4.47 1934 1782 A 95 TYR HD% A 105 LEU HA 1.0 . 4.50 1935 1783 A 106 TYR HD% A 105 LEU HA 1.0 . 4.76 1936 1784 A 100 ASP H A 105 LEU HA 1.0 . 4.38 1937 1785 A 10 PRO HDx A 9 TYR HA 1.0 . 3.61 1938 1786 A 10 PRO HDy A 9 TYR HA 1.0 . 3.37 1939 1787 A 9 TYR HD% A 9 TYR HA 1.0 . 4.11 1940 1788 A 25 PHE HA A 26 PRO HDx 1.0 . 3.67 1941 1789 A 25 PHE HA A 26 PRO HDy 1.0 . 3.67 1942 1790 A 25 PHE HA A 25 PHE HD% 1.0 . 3.89 1943 1791 A 34 GLU HA A 34 GLU HGx 1.0 . 3.43 1944 1791 A 34 GLU HGy A 34 GLU HA 1.0 . 3.43 1945 1792 A 109 TYR HE% A 34 GLU HA 1.0 . 4.49 1946 1793 A 90 LEU HA A 91 MET HGx 1.0 . 4.91 1947 1794 A 90 LEU HA A 91 MET HGy 1.0 . 4.91 1948 1795 A 57 VAL H A 90 LEU HA 1.0 . 4.32 1949 1796 A 16 ALA HA A 19 GLU HBy 1.0 . 3.84 1950 1797 A 16 ALA HA A 19 GLU HBx 1.0 . 3.38 1951 1798 A 16 ALA HA A 19 GLU H 1.0 . 4.15 1952 1799 A 109 TYR HA A 78 ILE HG2% 1.0 . 4.01 1953 1800 A 109 TYR HA A 108 THR HG2% 1.0 . 4.94 1954 1801 A 109 TYR HA A 78 ILE HG1y 1.0 . 4.70 1955 1802 A 109 TYR HA A 78 ILE HB 1.0 . 5.45 1956 1803 A 110 SER HA A 109 TYR HA 1.0 . 4.62 1957 1804 A 78 ILE HA A 109 TYR HA 1.0 . 3.79 1958 1805 A 79 PHE HD% A 109 TYR HA 1.0 . 5.05 1959 1806 A 15 LYS HBx A 102 ASP HA 1.0 . 4.39 1960 1807 A 15 LYS HGx A 102 ASP HA 1.0 . 5.21 1961 1808 A 102 ASP HA A 15 LYS HDx 1.0 . 4.38 1962 1809 A 102 ASP HA A 11 PHE HE% 1.0 . 3.92 1963 1810 A 29 ILE HG2% A 53 ALA HA 1.0 . 4.36 1964 1811 A 29 ILE HG1x A 53 ALA HA 1.0 . 3.44 1965 1812 A 29 ILE HG1y A 53 ALA HA 1.0 . 3.50 1966 1813 A 53 ALA HA A 29 ILE HB 1.0 . 4.11 1967 1814 A 91 MET HBx A 53 ALA HA 1.0 . 4.36 1968 1815 A 53 ALA HA A 92 SER HBx 1.0 . 3.79 1969 1815 A 92 SER HBy A 53 ALA HA 1.0 . 3.79 1970 1816 A 53 ALA HA A 28 ARG HA 1.0 . 4.90 1971 1817 A 74 LYS HA A 74 LYS HGx 1.0 . 3.70 1972 1818 A 74 LYS HA A 74 LYS HGy 1.0 . 3.70 1973 1819 A 74 LYS HA A 74 LYS HDx 1.0 . 3.67 1974 1819 A 74 LYS HA A 74 LYS HDy 1.0 . 3.67 1975 1820 A 96 GLN HBy A 93 ALA HA 1.0 . 3.45 1976 1821 A 81 ASN HA A 82 ASP H 1.0 . 3.55 1977 1822 A 1 MET HA A 1 MET HGx 1.0 . 3.82 1978 1823 A 1 MET HA A 1 MET HGy 1.0 . 3.82 1979 1824 A 45 ASP HA A 45 ASP HBx 1.0 . 2.83 1980 1824 A 45 ASP HBy A 45 ASP HA 1.0 . 2.83 1981 1825 A 55 LEU HA A 55 LEU HDx% 1.0 . 3.73 1982 1826 A 56 THR HG2% A 55 LEU HA 1.0 . 4.21 1983 1827 A 55 LEU HA A 55 LEU HG 1.0 . 3.88 1984 1828 A 29 ILE HG1x A 29 ILE HA 1.0 . 4.20 1985 1829 A 29 ILE HA A 30 PRO HDx 1.0 . 3.51 1986 1830 A 29 ILE HA A 30 PRO HDy 1.0 . 3.51 1987 1831 A 47 ARG HA A 33 CYS HBy 1.0 . 4.61 1988 1832 A 47 ARG HA A 49 TYR HE% 1.0 . 4.06 1989 1833 A 47 ARG HA A 49 TYR HD% 1.0 . 4.93 1990 1834 A 82 ASP HA A 79 PHE HBx 1.0 . 4.12 1991 1834 A 79 PHE HBy A 82 ASP HA 1.0 . 4.12 1992 1835 A 82 ASP HA A 79 PHE HD% 1.0 . 5.25 1993 1836 A 77 PHE HD% A 112 GLU HA 1.0 . 4.42 1994 1837 A 112 GLU HA A 77 PHE HE% 1.0 . 4.15 1995 1838 A 68 ILE HB A 69 MET HA 1.0 . 5.50 1996 1839 A 69 MET HA A 69 MET HGx 1.0 . 3.46 1997 1839 A 69 MET HGy A 69 MET HA 1.0 . 3.46 1998 1840 A 79 PHE HA A 80 VAL HGx% 1.0 . 5.50 1999 1841 A 79 PHE HA A 85 PRO HDy 1.0 . 4.08 2000 1842 A 79 PHE HA A 85 PRO HDx 1.0 . 4.04 2001 1843 A 79 PHE HA A 84 LEU HA 1.0 . 3.89 2002 1844 A 79 PHE HA A 79 PHE HD% 1.0 . 4.19 2003 1845 A 46 LYS HA A 5 PHE H 1.0 . 3.79 2004 1846 A 23 ASP HA A 22 ALA HB% 1.0 . 4.21 2005 1847 A 23 ASP HBx A 23 ASP HA 1.0 . 2.89 2006 1848 A 2 LYS HA A 2 LYS HGx 1.0 . 3.54 2007 1849 A 2 LYS HA A 2 LYS HGy 1.0 . 3.54 2008 1850 A 35 LYS HA A 43 GLU HA 1.0 . 5.21 2009 1851 A 43 GLU HA A 109 TYR HH 1.0 . 3.99 2010 1852 A 38 LYS HA A 38 LYS HGx 1.0 . 3.46 2011 1853 A 38 LYS HA A 38 LYS HGy 1.0 . 3.46 2012 1854 A 76 ILE HG2% A 77 PHE HA 1.0 . 4.43 2013 1855 A 77 PHE HA A 84 LEU HDx% 1.0 . 4.61 2014 1856 A 78 ILE HG1x A 77 PHE HA 1.0 . 5.37 2015 1857 A 78 ILE HG1y A 77 PHE HA 1.0 . 4.35 2016 1858 A 78 ILE HA A 77 PHE HA 1.0 . 4.76 2017 1859 A 77 PHE HA A 77 PHE HD% 1.0 . 3.96 2018 1860 A 77 PHE HA A 77 PHE HE% 1.0 . 4.82 2019 1861 A 94 ILE HG1x A 91 MET HA 1.0 . 3.71 2020 1862 A 91 MET HA A 94 ILE HG1y 1.0 . 3.89 2021 1863 A 94 ILE HB A 91 MET HA 1.0 . 3.53 2022 1864 A 91 MET HA A 91 MET HGx 1.0 . 4.16 2023 1865 A 91 MET HA A 91 MET HGy 1.0 . 4.16 2024 1866 A 91 MET HA A 93 ALA H 1.0 . 4.93 2025 1867 A 95 TYR H A 91 MET HA 1.0 . 4.50 2026 1868 A 33 CYS HA A 106 TYR HA 1.0 . 5.50 2027 1869 A 33 CYS HA A 60 PHE HZ 1.0 . 4.97 2028 1870 A 23 ASP HBy A 24 ARG HA 1.0 . 4.55 2029 1871 A 24 ARG HA A 25 PHE HE% 1.0 . 5.16 2030 1872 A 15 LYS HA A 15 LYS HGy 1.0 . 3.63 2031 1873 A 15 LYS HA A 15 LYS HGx 1.0 . 3.83 2032 1874 A 15 LYS HA A 15 LYS HDx 1.0 . 4.70 2033 1875 A 18 SER HG A 15 LYS HA 1.0 . 4.20 2034 1876 A 115 PHE HA A 115 PHE HD% 1.0 . 3.67 2035 1877 A 99 LYS HA A 105 LEU HG 1.0 . 4.84 2036 1878 A 100 ASP HA A 99 LYS HA 1.0 . 4.52 2037 1879 A 99 LYS HA A 105 LEU HA 1.0 . 3.88 2038 1880 A 73 GLU HA A 73 GLU HBx 1.0 . 2.86 2039 1881 A 73 GLU HA A 73 GLU HBy 1.0 . 2.86 2040 1882 A 73 GLU HA A 73 GLU HGx 1.0 . 3.94 2041 1883 A 97 GLU HGx A 97 GLU HA 1.0 . 3.91 2042 1884 A 97 GLU HBx A 97 GLU HA 1.0 . 2.98 2043 1885 A 97 GLU HGy A 97 GLU HA 1.0 . 3.60 2044 1886 A 97 GLU HA A 96 GLN HGx 1.0 . 4.42 2045 1886 A 96 GLN HGy A 97 GLU HA 1.0 . 4.42 2046 1887 A 36 ALA HB% A 39 SER HA 1.0 . 4.47 2047 1888 A 39 SER HA A 40 ASP HBx 1.0 . 4.43 2048 1888 A 39 SER HA A 40 ASP HBy 1.0 . 4.43 2049 1889 A 78 ILE HA A 109 TYR HBy 1.0 . 5.24 2050 1890 A 109 TYR HBx A 78 ILE HA 1.0 . 4.47 2051 1891 A 79 PHE HD% A 78 ILE HA 1.0 . 4.94 2052 1892 A 8 GLU HA A 8 GLU HGx 1.0 . 3.83 2053 1893 A 8 GLU HA A 8 GLU HGy 1.0 . 3.83 2054 1894 A 7 SER H A 8 GLU HA 1.0 . 5.12 2055 1895 A 13 LYS HA A 13 LYS HGx 1.0 . 3.87 2056 1896 A 13 LYS HA A 13 LYS HDx 1.0 . 3.62 2057 1896 A 13 LYS HA A 13 LYS HDy 1.0 . 3.62 2058 1897 A 67 ARG HGx A 67 ARG HA 1.0 . 3.06 2059 1898 A 67 ARG HA A 67 ARG HDx 1.0 . 4.23 2060 1899 A 67 ARG HA A 67 ARG HDy 1.0 . 3.76 2061 1900 A 66 LYS HA A 66 LYS HGx 1.0 . 3.71 2062 1901 A 66 LYS HA A 66 LYS HGy 1.0 . 3.71 2063 1902 A 66 LYS HA A 66 LYS HDx 1.0 . 3.84 2064 1902 A 66 LYS HDy A 66 LYS HA 1.0 . 3.84 2065 1903 A 99 LYS H A 96 GLN HA 1.0 . 4.60 2066 1904 A 98 HIS H A 96 GLN HA 1.0 . 4.62 2067 1905 A 59 GLN HA A 59 GLN HGx 1.0 . 3.24 2068 1905 A 59 GLN HGy A 59 GLN HA 1.0 . 3.24 2069 1906 A 62 TYR HBy A 59 GLN HA 1.0 . 4.30 2070 1907 A 62 TYR HBx A 59 GLN HA 1.0 . 3.91 2071 1908 A 106 TYR HA A 105 LEU HDx% 1.0 . 5.50 2072 1909 A 106 TYR HA A 107 VAL HGx% 1.0 . 5.50 2073 1910 A 106 TYR HA A 105 LEU HDy% 1.0 . 5.50 2074 1911 A 106 TYR HA A 107 VAL HGy% 1.0 . 5.50 2075 1912 A 32 ILE HB A 106 TYR HA 1.0 . 4.14 2076 1913 A 107 VAL HB A 106 TYR HA 1.0 . 5.50 2077 1914 A 106 TYR HA A 106 TYR HD% 1.0 . 4.15 2078 1915 A 41 ILE HG1x A 41 ILE HA 1.0 . 3.99 2079 1916 A 41 ILE HG1y A 41 ILE HA 1.0 . 3.97 2080 1917 A 41 ILE HA A 74 LYS HDx 1.0 . 4.39 2081 1917 A 74 LYS HDy A 41 ILE HA 1.0 . 4.39 2082 1918 A 41 ILE HA A 35 LYS HEx 1.0 . 4.89 2083 1918 A 35 LYS HEy A 41 ILE HA 1.0 . 4.89 2084 1919 A 42 PRO HDx A 41 ILE HA 1.0 . 3.54 2085 1920 A 42 PRO HDy A 41 ILE HA 1.0 . 3.19 2086 1921 A 36 ALA HB% A 37 GLU HA 1.0 . 4.48 2087 1922 A 37 GLU HA A 37 GLU HGy 1.0 . 3.87 2088 1923 A 37 GLU HA A 35 LYS HEx 1.0 . 4.69 2089 1923 A 37 GLU HA A 35 LYS HEy 1.0 . 4.69 2090 1924 A 104 PHE HA A 30 PRO HGy 1.0 . 5.03 2091 1925 A 104 PHE HA A 30 PRO HGx 1.0 . 4.36 2092 1926 A 104 PHE HA A 104 PHE HD% 1.0 . 4.48 2093 1927 A 101 LYS HA A 101 LYS HGx 1.0 . 3.85 2094 1928 A 101 LYS HA A 101 LYS HBx 1.0 . 2.92 2095 1928 A 101 LYS HBy A 101 LYS HA 1.0 . 2.92 2096 1929 A 101 LYS HA A 101 LYS HEx 1.0 . 4.97 2097 1929 A 101 LYS HA A 101 LYS HEy 1.0 . 4.97 2098 1930 A 101 LYS HA A 100 ASP HA 1.0 . 4.56 2099 1931 A 20 ARG HA A 20 ARG HGx 1.0 . 3.92 2100 1932 A 20 ARG HA A 22 ALA HB% 1.0 . 4.56 2101 1933 A 20 ARG HA A 20 ARG HGy 1.0 . 3.92 2102 1934 A 23 ASP HBy A 20 ARG HA 1.0 . 3.59 2103 1935 A 23 ASP HBx A 20 ARG HA 1.0 . 3.82 2104 1936 A 80 VAL HA A 107 VAL HA 1.0 . 4.01 2105 1937 A 108 THR HA A 107 VAL HA 1.0 . 4.88 2106 1938 A 76 ILE HA A 76 ILE HG1x 1.0 . 4.02 2107 1939 A 41 ILE HG2% A 76 ILE HA 1.0 . 4.25 2108 1940 A 76 ILE HA A 75 ALA HB% 1.0 . 4.77 2109 1941 A 76 ILE HA A 111 GLY HAx 1.0 . 4.41 2110 1942 A 76 ILE HA A 77 PHE HD% 1.0 . 4.79 2111 1943 A 76 ILE HA A 77 PHE H 1.0 . 3.17 2112 1944 A 19 GLU HA A 19 GLU HGy 1.0 . 3.66 2113 1945 A 108 THR HA A 107 VAL HGx% 1.0 . 5.08 2114 1946 A 108 THR HA A 34 GLU HBx 1.0 . 4.95 2115 1947 A 108 THR HA A 34 GLU HBy 1.0 . 4.95 2116 1948 A 35 LYS HA A 108 THR HA 1.0 . 4.84 2117 1949 A 108 THR HA A 33 CYS HA 1.0 . 4.54 2118 1950 A 65 ARG HA A 64 ILE HG2% 1.0 . 4.68 2119 1951 A 68 ILE HD1% A 65 ARG HA 1.0 . 3.95 2120 1952 A 65 ARG HA A 68 ILE HG1x 1.0 . 4.04 2121 1953 A 65 ARG HA A 68 ILE HG1y 1.0 . 4.04 2122 1954 A 65 ARG HA A 65 ARG HGx 1.0 . 3.82 2123 1955 A 65 ARG HA A 65 ARG HGy 1.0 . 3.82 2124 1956 A 65 ARG HA A 65 ARG HDx 1.0 . 4.24 2125 1956 A 65 ARG HA A 65 ARG HDy 1.0 . 4.24 2126 1957 A 65 ARG HA A 69 MET HA 1.0 . 5.06 2127 1958 A 65 ARG HA A 69 MET H 1.0 . 4.66 2128 1959 A 15 LYS HBx A 12 GLU HA 1.0 . 4.74 2129 1960 A 12 GLU HA A 15 LYS HGy 1.0 . 4.85 2130 1961 A 15 LYS HGx A 12 GLU HA 1.0 . 4.39 2131 1962 A 15 LYS HBy A 12 GLU HA 1.0 . 3.57 2132 1963 A 12 GLU HA A 12 GLU HBx 1.0 . 2.98 2133 1963 A 12 GLU HBy A 12 GLU HA 1.0 . 2.98 2134 1964 A 12 GLU HA A 12 GLU HGx 1.0 . 3.49 2135 1965 A 12 GLU HA A 12 GLU HGy 1.0 . 3.49 2136 1966 A 11 PHE HBy A 12 GLU HA 1.0 . 4.94 2137 1967 A 14 ARG H A 12 GLU HA 1.0 . 4.91 2138 1968 A 57 VAL HGy% A 56 THR HA 1.0 . 4.06 2139 1969 A 56 THR HA A 89 ALA HB% 1.0 . 5.12 2140 1970 A 55 LEU HBy A 56 THR HA 1.0 . 5.00 2141 1971 A 90 LEU HBx A 56 THR HA 1.0 . 5.04 2142 1972 A 56 THR HA A 90 LEU HBy 1.0 . 5.18 2143 1973 A 56 THR HA A 55 LEU HG 1.0 . 5.50 2144 1974 A 56 THR HA A 57 VAL HA 1.0 . 4.71 2145 1975 A 56 THR HA A 91 MET HA 1.0 . 4.37 2146 1976 A 90 LEU HA A 56 THR HA 1.0 . 3.31 2147 1977 A 58 GLY H A 56 THR HA 1.0 . 5.14 2148 1978 A 81 ASN HA A 80 VAL HA 1.0 . 4.34 2149 1979 A 105 LEU HBy A 31 VAL HA 1.0 . 4.14 2150 1980 A 105 LEU HBx A 31 VAL HA 1.0 . 4.24 2151 1981 A 79 PHE HD% A 83 THR HA 1.0 . 5.05 2152 1982 A 92 SER HA A 95 TYR HBx 1.0 . 4.32 2153 1983 A 92 SER HA A 95 TYR HBy 1.0 . 3.86 2154 1984 A 92 SER HA A 95 TYR H 1.0 . 4.55 2155 1985 A 85 PRO HA A 86 PRO HDx 1.0 . 3.41 2156 1986 A 85 PRO HA A 86 PRO HDy 1.0 . 3.41 2157 1987 A 68 ILE HD1% A 44 ILE HA 1.0 . 5.36 2158 1988 A 44 ILE HD1% A 44 ILE HA 1.0 . 3.92 2159 1989 A 44 ILE HG1y A 44 ILE HA 1.0 . 3.49 2160 1990 A 44 ILE HA A 45 ASP HBx 1.0 . 4.66 2161 1990 A 45 ASP HBy A 44 ILE HA 1.0 . 4.66 2162 1991 A 46 LYS H A 44 ILE HA 1.0 . 4.83 2163 1992 A 114 THR HA A 115 PHE HD% 1.0 . 4.61 2164 1993 A 114 THR HA A 115 PHE HE% 1.0 . 4.33 2165 1994 A 68 ILE HD1% A 68 ILE HA 1.0 . 4.22 2166 1995 A 60 PHE HA A 55 LEU HDy% 1.0 . 4.70 2167 1996 A 68 ILE HA A 68 ILE HG1x 1.0 . 4.20 2168 1997 A 68 ILE HA A 68 ILE HG1y 1.0 . 4.20 2169 1998 A 68 ILE HA A 69 MET HE% 1.0 . 4.49 2170 1999 A 63 VAL HB A 60 PHE HA 1.0 . 3.85 2171 2000 A 60 PHE HA A 62 TYR HD% 1.0 . 4.52 2172 2001 A 92 SER H A 92 SER HBx 1.0 . 3.92 2173 2001 A 92 SER HBy A 92 SER H 1.0 . 3.92 2174 2002 A 62 TYR HA A 65 ARG HBx 1.0 . 3.84 2175 2003 A 62 TYR HA A 65 ARG HBy 1.0 . 3.84 2176 2004 A 61 VAL HB A 62 TYR HA 1.0 . 4.69 2177 2005 A 21 ILE HD1% A 18 SER HA 1.0 . 3.86 2178 2006 A 21 ILE HB A 18 SER HA 1.0 . 3.62 2179 2007 A 18 SER HA A 17 GLU HGx 1.0 . 4.91 2180 2007 A 17 GLU HGy A 18 SER HA 1.0 . 4.91 2181 2008 A 104 PHE HZ A 18 SER HA 1.0 . 5.17 2182 2009 A 18 SER HA A 20 ARG H 1.0 . 4.77 2183 2010 A 71 PRO HA A 72 PRO HDx 1.0 . 2.81 2184 2010 A 72 PRO HDy A 71 PRO HA 1.0 . 2.81 2185 2011 A 73 GLU H A 71 PRO HA 1.0 . 4.36 2186 2012 A 29 ILE HG2% A 95 TYR HA 1.0 . 4.54 2187 2013 A 95 TYR HA A 105 LEU HDy% 1.0 . 3.67 2188 2014 A 95 TYR HA A 99 LYS HBx 1.0 . 4.29 2189 2014 A 99 LYS HBy A 95 TYR HA 1.0 . 4.29 2190 2015 A 95 TYR HA A 105 LEU HG 1.0 . 4.11 2191 2016 A 95 TYR HA A 105 LEU HBx 1.0 . 4.61 2192 2017 A 95 TYR HA A 94 ILE HB 1.0 . 4.56 2193 2018 A 11 PHE HBy A 10 PRO HA 1.0 . 4.98 2194 2019 A 89 ALA HB% A 86 PRO HA 1.0 . 4.37 2195 2020 A 87 THR HB A 86 PRO HA 1.0 . 5.50 2196 2021 A 86 PRO HA A 88 ALA H 1.0 . 4.75 2197 2022 A 94 ILE HA A 94 ILE HG1y 1.0 . 3.79 2198 2023 A 97 GLU HBx A 94 ILE HA 1.0 . 5.25 2199 2024 A 94 ILE HA A 98 HIS HD2 1.0 . 3.70 2200 2025 A 94 ILE HA A 97 GLU H 1.0 . 3.88 2201 2026 A 5 PHE HA A 8 GLU HBx 1.0 . 4.46 2202 2027 A 5 PHE HA A 8 GLU HBy 1.0 . 4.46 2203 2028 A 9 TYR HD% A 5 PHE HA 1.0 . 5.50 2204 2029 A 8 GLU H A 5 PHE HA 1.0 . 4.36 2205 2030 A 4 THR H A 5 PHE HA 1.0 . 4.89 2206 2031 A 14 ARG H A 11 PHE HA 1.0 . 4.53 2207 2032 A 15 LYS H A 11 PHE HA 1.0 . 5.08 2208 2033 A 64 ILE HA A 64 ILE HG2% 1.0 . 3.28 2209 2034 A 64 ILE HA A 64 ILE HG1x 1.0 . 4.10 2210 2035 A 64 ILE HA A 44 ILE HD1% 1.0 . 4.35 2211 2036 A 64 ILE HA A 67 ARG HGy 1.0 . 4.55 2212 2037 A 64 ILE HA A 67 ARG HGx 1.0 . 4.75 2213 2038 A 67 ARG HBy A 64 ILE HA 1.0 . 4.89 2214 2039 A 8 GLU H A 7 SER HBx 1.0 . 4.86 2215 2040 A 8 GLU H A 7 SER HBy 1.0 . 4.86 2216 2041 A 29 ILE HG1y A 52 PRO HA 1.0 . 4.73 2217 2042 A 52 PRO HA A 28 ARG HGx 1.0 . 4.26 2218 2042 A 52 PRO HA A 28 ARG HGy 1.0 . 4.26 2219 2043 A 52 PRO HA A 28 ARG HBy 1.0 . 4.44 2220 2044 A 52 PRO HA A 53 ALA HA 1.0 . 4.41 2221 2045 A 28 ARG HBx A 26 PRO HA 1.0 . 4.80 2222 2046 A 26 PRO HA A 28 ARG HGx 1.0 . 5.50 2223 2046 A 28 ARG HGy A 26 PRO HA 1.0 . 5.50 2224 2047 A 26 PRO HA A 22 ALA HB% 1.0 . 4.51 2225 2048 A 25 PHE HBx A 26 PRO HA 1.0 . 5.09 2226 2049 A 22 ALA HA A 26 PRO HA 1.0 . 3.97 2227 2050 A 72 PRO HA A 65 ARG HDx 1.0 . 5.33 2228 2050 A 65 ARG HDy A 72 PRO HA 1.0 . 5.33 2229 2051 A 65 ARG HH2% A 72 PRO HA 1.0 . 4.32 2230 2052 A 36 ALA HB% A 39 SER HBy 1.0 . 4.15 2231 2053 A 57 VAL HGy% A 87 THR HA 1.0 . 4.37 2232 2054 A 57 VAL HB A 87 THR HA 1.0 . 3.16 2233 2055 A 86 PRO HA A 87 THR HA 1.0 . 4.40 2234 2056 A 58 GLY H A 87 THR HA 1.0 . 3.76 2235 2057 A 21 ILE HA A 21 ILE HD1% 1.0 . 3.83 2236 2058 A 21 ILE HA A 21 ILE HG1x 1.0 . 4.20 2237 2059 A 21 ILE HA A 24 ARG HBx 1.0 . 4.48 2238 2060 A 21 ILE HA A 24 ARG HBy 1.0 . 4.48 2239 2061 A 21 ILE HA A 21 ILE HG1y 1.0 . 4.20 2240 2062 A 66 LYS HBx A 63 VAL HA 1.0 . 3.98 2241 2063 A 66 LYS HBy A 63 VAL HA 1.0 . 4.11 2242 2064 A 63 VAL HA A 62 TYR HD% 1.0 . 4.57 2243 2065 A 57 VAL HA A 60 PHE HBx 1.0 . 4.06 2244 2066 A 57 VAL HA A 60 PHE HBy 1.0 . 4.06 2245 2067 A 57 VAL HA A 60 PHE HD% 1.0 . 4.91 2246 2068 A 64 ILE HD1% A 61 VAL HA 1.0 . 4.32 2247 2069 A 64 ILE HG1x A 61 VAL HA 1.0 . 4.01 2248 2070 A 64 ILE HG1y A 61 VAL HA 1.0 . 4.10 2249 2071 A 64 ILE HB A 61 VAL HA 1.0 . 4.01 2250 2072 A 57 VAL HGx% A 87 THR HB 1.0 . 4.38 2251 2073 A 57 VAL HB A 87 THR HB 1.0 . 4.78 2252 2074 A 87 THR HB A 58 GLY HAy 1.0 . 4.19 2253 2075 A 87 THR HB A 58 GLY HAx 1.0 . 3.77 2254 2076 A 58 GLY H A 87 THR HB 1.0 . 3.81 2255 2077 A 108 THR HB A 79 PHE HBx 1.0 . 3.83 2256 2077 A 79 PHE HBy A 108 THR HB 1.0 . 3.83 2257 2078 A 79 PHE HD% A 108 THR HB 1.0 . 4.68 2258 2079 A 64 ILE HD1% A 109 TYR HE% 1.0 . 4.72 2259 2080 A 68 ILE HD1% A 109 TYR HE% 1.0 . 3.57 2260 2081 A 44 ILE HD1% A 109 TYR HE% 1.0 . 3.72 2261 2082 A 41 ILE HD1% A 109 TYR HE% 1.0 . 3.09 2262 2083 A 41 ILE HG1x A 109 TYR HE% 1.0 . 3.55 2263 2084 A 109 TYR HE% A 41 ILE HG1y 1.0 . 4.00 2264 2085 A 109 TYR HE% A 44 ILE HB 1.0 . 4.04 2265 2086 A 35 LYS HA A 109 TYR HE% 1.0 . 4.10 2266 2087 A 109 TYR HE% A 43 GLU HA 1.0 . 4.43 2267 2088 A 109 TYR HE% A 34 GLU H 1.0 . 4.36 2268 2089 A 109 TYR HE% A 35 LYS H 1.0 . 4.44 2269 2090 A 62 TYR HE% A 66 LYS HDx 1.0 . 3.54 2270 2090 A 66 LYS HDy A 62 TYR HE% 1.0 . 3.54 2271 2091 A 66 LYS HBx A 62 TYR HE% 1.0 . 4.62 2272 2092 A 62 TYR HE% A 66 LYS HEx 1.0 . 4.09 2273 2093 A 62 TYR HE% A 66 LYS HEy 1.0 . 4.09 2274 2094 A 63 VAL HA A 62 TYR HE% 1.0 . 4.30 2275 2095 A 29 ILE HG2% A 95 TYR HE% 1.0 . 4.00 2276 2096 A 95 TYR HE% A 99 LYS HBx 1.0 . 4.02 2277 2096 A 99 LYS HBy A 95 TYR HE% 1.0 . 4.02 2278 2097 A 95 TYR HE% A 105 LEU HG 1.0 . 5.50 2279 2098 A 95 TYR HE% A 30 PRO HGy 1.0 . 4.53 2280 2099 A 105 LEU HBx A 95 TYR HE% 1.0 . 4.65 2281 2100 A 95 TYR HE% A 30 PRO HGx 1.0 . 4.54 2282 2101 A 95 TYR HE% A 30 PRO HDx 1.0 . 4.57 2283 2102 A 95 TYR HE% A 30 PRO HDy 1.0 . 4.57 2284 2103 A 64 ILE HD1% A 49 TYR HE% 1.0 . 3.97 2285 2104 A 67 ARG HGx A 49 TYR HE% 1.0 . 4.30 2286 2105 A 44 ILE HB A 49 TYR HE% 1.0 . 5.11 2287 2106 A 33 CYS HBx A 49 TYR HE% 1.0 . 4.19 2288 2107 A 33 CYS H A 49 TYR HE% 1.0 . 4.61 2289 2108 A 5 PHE HA A 9 TYR HE% 1.0 . 4.00 2290 2109 A 5 PHE HD% A 9 TYR HE% 1.0 . 3.89 2291 2110 A 8 GLU H A 9 TYR HE% 1.0 . 4.54 2292 2111 A 106 TYR HE% A 32 ILE HD1% 1.0 . 5.22 2293 2112 A 106 TYR HE% A 32 ILE HG2% 1.0 . 4.42 2294 2113 A 106 TYR HE% A 32 ILE HB 1.0 . 4.58 2295 2114 A 106 TYR HE% A 6 LYS HEx 1.0 . 4.54 2296 2115 A 106 TYR HE% A 104 PHE HBx 1.0 . 4.82 2297 2116 A 106 TYR HE% A 100 ASP HBx 1.0 . 4.03 2298 2117 A 106 TYR HE% A 104 PHE HBy 1.0 . 4.82 2299 2118 A 106 TYR HE% A 100 ASP HBy 1.0 . 4.03 2300 2119 A 98 HIS HD2 A 80 VAL HGy% 1.0 . 4.06 2301 2120 A 80 VAL HB A 98 HIS HD2 1.0 . 4.46 2302 2121 A 98 HIS HD2 A 97 GLU HGy 1.0 . 4.56 2303 2122 A 98 HIS HD2 A 94 ILE HB 1.0 . 4.62 2304 2123 A 104 PHE HZ A 21 ILE HD1% 1.0 . 4.16 2305 2124 A 104 PHE HZ A 17 GLU HGx 1.0 . 3.45 2306 2124 A 17 GLU HGy A 104 PHE HZ 1.0 . 3.45 2307 2125 A 64 ILE HD1% A 60 PHE HZ 1.0 . 4.21 2308 2126 A 33 CYS HBx A 60 PHE HZ 1.0 . 4.55 2309 2127 A 33 CYS HBy A 60 PHE HZ 1.0 . 4.83 2310 2128 A 79 PHE HZ A 84 LEU HDy% 1.0 . 4.75 2311 2129 A 79 PHE HZ A 77 PHE HBy 1.0 . 5.09 2312 2130 A 79 PHE HZ A 114 THR HA 1.0 . 4.13 2313 2131 A 11 PHE HZ A 15 LYS HDy 1.0 . 4.23 2314 2132 A 11 PHE HZ A 101 LYS HDx 1.0 . 5.50 2315 2132 A 11 PHE HZ A 101 LYS HDy 1.0 . 5.50 2316 2133 A 11 PHE HZ A 101 LYS HEx 1.0 . 4.71 2317 2133 A 11 PHE HZ A 101 LYS HEy 1.0 . 4.71 2318 2134 A 75 ALA HB% A 77 PHE HZ 1.0 . 4.04 2319 2135 A 104 PHE HE% A 21 ILE HD1% 1.0 . 3.69 2320 2136 A 104 PHE HE% A 48 LYS HDx 1.0 . 4.71 2321 2137 A 104 PHE HE% A 48 LYS HDy 1.0 . 4.71 2322 2138 A 104 PHE HE% A 17 GLU HBx 1.0 . 3.98 2323 2139 A 104 PHE HE% A 17 GLU HBy 1.0 . 3.98 2324 2140 A 104 PHE HE% A 17 GLU HGx 1.0 . 3.69 2325 2140 A 17 GLU HGy A 104 PHE HE% 1.0 . 3.69 2326 2141 A 104 PHE HE% A 48 LYS HEx 1.0 . 4.16 2327 2141 A 104 PHE HE% A 48 LYS HEy 1.0 . 4.16 2328 2142 A 104 PHE HE% A 18 SER HA 1.0 . 4.78 2329 2143 A 104 PHE HE% A 14 ARG HA 1.0 . 4.47 2330 2144 A 104 PHE HE% A 15 LYS H 1.0 . 5.50 2331 2145 A 60 PHE HE% A 107 VAL HGx% 1.0 . 3.99 2332 2146 A 63 VAL HB A 60 PHE HE% 1.0 . 4.87 2333 2147 A 107 VAL HB A 60 PHE HE% 1.0 . 4.53 2334 2148 A 60 PHE HA A 60 PHE HE% 1.0 . 4.73 2335 2149 A 60 PHE HD% A 78 ILE HG2% 1.0 . 3.49 2336 2150 A 60 PHE HD% A 60 PHE HA 1.0 . 3.99 2337 2151 A 77 PHE HE% A 113 ASN HBx 1.0 . 4.57 2338 2152 A 77 PHE HE% A 113 ASN HBy 1.0 . 4.57 2339 2153 A 76 ILE HA A 77 PHE HE% 1.0 . 4.93 2340 2154 A 15 LYS HDy A 11 PHE HE% 1.0 . 3.96 2341 2155 A 11 PHE HE% A 101 LYS HBx 1.0 . 3.69 2342 2155 A 101 LYS HBy A 11 PHE HE% 1.0 . 3.69 2343 2156 A 32 ILE HD1% A 5 PHE HE% 1.0 . 4.75 2344 2157 A 5 PHE HA A 5 PHE HE% 1.0 . 5.09 2345 2158 A 79 PHE HE% A 84 LEU HDy% 1.0 . 4.42 2346 2159 A 79 PHE HE% A 84 LEU HDx% 1.0 . 4.42 2347 2160 A 77 PHE HBx A 79 PHE HE% 1.0 . 4.05 2348 2161 A 77 PHE HBy A 79 PHE HE% 1.0 . 4.14 2349 2162 A 82 ASP HA A 79 PHE HE% 1.0 . 4.40 2350 2163 A 5 PHE HD% A 5 PHE HA 1.0 . 4.10 2351 2164 A 77 PHE HD% A 84 LEU HDx% 1.0 . 3.56 2352 2165 A 77 PHE HD% A 75 ALA HB% 1.0 . 4.22 2353 2166 A 15 LYS HDy A 11 PHE HD% 1.0 . 4.31 2354 2167 A 102 ASP H A 11 PHE HD% 1.0 . 4.46 2355 2168 A 11 PHE HD% A 101 LYS HBx 1.0 . 4.89 2356 2168 A 101 LYS HBy A 11 PHE HD% 1.0 . 4.89 2357 2169 A 11 PHE HD% A 12 GLU HBx 1.0 . 4.10 2358 2169 A 12 GLU HBy A 11 PHE HD% 1.0 . 4.10 2359 2170 A 11 PHE HA A 11 PHE HD% 1.0 . 3.48 2360 2171 A 12 GLU H A 11 PHE HD% 1.0 . 3.95 2361 2172 A 44 ILE HD1% A 49 TYR HD% 1.0 . 4.08 2362 2173 A 49 TYR HD% A 33 CYS HBx 1.0 . 4.20 2363 2174 A 33 CYS HBy A 49 TYR HD% 1.0 . 3.97 2364 2175 A 49 TYR H A 49 TYR HD% 1.0 . 3.97 2365 2176 A 25 PHE HD% A 50 LEU HDx% 1.0 . 4.32 2366 2177 A 21 ILE HG2% A 25 PHE HD% 1.0 . 3.50 2367 2178 A 25 PHE HD% A 21 ILE HG1x 1.0 . 4.47 2368 2179 A 25 PHE HD% A 24 ARG HBx 1.0 . 4.04 2369 2180 A 25 PHE HD% A 28 ARG HGx 1.0 . 4.02 2370 2180 A 28 ARG HGy A 25 PHE HD% 1.0 . 4.02 2371 2181 A 25 PHE HD% A 24 ARG HBy 1.0 . 4.04 2372 2182 A 25 PHE HD% A 21 ILE HG1y 1.0 . 4.47 2373 2183 A 21 ILE HA A 25 PHE HD% 1.0 . 3.54 2374 2184 A 24 ARG HA A 25 PHE HD% 1.0 . 4.81 2375 2185 A 32 ILE HD1% A 104 PHE HD% 1.0 . 4.23 2376 2186 A 104 PHE HD% A 30 PRO HBy 1.0 . 4.14 2377 2187 A 104 PHE HD% A 30 PRO HBx 1.0 . 4.14 2378 2188 A 32 ILE HB A 106 TYR HD% 1.0 . 4.15 2379 2189 A 109 TYR HD% A 76 ILE HD1% 1.0 . 3.55 2380 2190 A 109 TYR HD% A 76 ILE HG1x 1.0 . 3.66 2381 2191 A 109 TYR HD% A 76 ILE HG1y 1.0 . 3.54 2382 2192 A 109 TYR HD% A 35 LYS HA 1.0 . 4.06 2383 2193 A 109 TYR HD% A 108 THR HA 1.0 . 4.33 2384 2194 A 109 TYR HD% A 109 TYR HA 1.0 . 4.25 2385 2195 A 109 TYR HD% A 109 TYR H 1.0 . 3.55 2386 2196 A 62 TYR HD% A 55 LEU HDx% 1.0 . 4.38 2387 2197 A 62 TYR HD% A 66 LYS HDx 1.0 . 4.32 2388 2197 A 62 TYR HD% A 66 LYS HDy 1.0 . 4.32 2389 2198 A 66 LYS HBx A 62 TYR HD% 1.0 . 4.52 2390 2199 A 62 TYR HA A 62 TYR HD% 1.0 . 3.33 2391 2200 A 59 GLN HA A 62 TYR HD% 1.0 . 4.10 2392 2201 A 29 ILE HG2% A 95 TYR HD% 1.0 . 3.54 2393 2202 A 95 TYR HD% A 105 LEU HDx% 1.0 . 3.78 2394 2203 A 95 TYR HD% A 105 LEU HDy% 1.0 . 3.78 2395 2204 A 95 TYR HD% A 99 LYS HBx 1.0 . 4.12 2396 2204 A 99 LYS HBy A 95 TYR HD% 1.0 . 4.12 2397 2205 A 95 TYR HD% A 105 LEU HG 1.0 . 4.24 2398 2206 A 95 TYR HD% A 105 LEU HBx 1.0 . 3.94 2399 2207 A 95 TYR HD% A 96 GLN HA 1.0 . 4.24 2400 2208 A 95 TYR HA A 95 TYR HD% 1.0 . 3.49 2401 2209 A 9 TYR HD% A 8 GLU HBx 1.0 . 4.10 2402 2210 A 9 TYR HD% A 8 GLU HBy 1.0 . 4.10 2403 2211 A 9 TYR HD% A 13 LYS HEx 1.0 . 5.18 2404 2211 A 13 LYS HEy A 9 TYR HD% 1.0 . 5.18 2405 2212 A 10 PRO HDx A 9 TYR HD% 1.0 . 4.29 2406 2213 A 9 TYR HD% A 10 PRO HDy 1.0 . 4.79 2407 2214 A 9 TYR H A 9 TYR HD% 1.0 . 4.34 2408 2215 A 5 PHE HD% A 9 TYR HD% 1.0 . 5.50 2409 2216 A 83 THR HG2% A 98 HIS HE1 1.0 . 3.62 2410 2217 A 97 GLU HGx A 98 HIS HE1 1.0 . 4.74 2411 2218 A 97 GLU HGy A 98 HIS HE1 1.0 . 4.67 2412 2219 A 81 ASN HBx A 98 HIS HE1 1.0 . 4.37 2413 2220 A 81 ASN HBy A 98 HIS HE1 1.0 . 5.40 2414 2221 B 615 GLY H B 614 LEU HDx% 1.0 . 5.19 2415 2222 B 615 GLY H B 614 LEU HDy% 1.0 . 5.19 2416 2223 B 615 GLY H B 614 LEU HBx 1.0 . 4.49 2417 2224 B 615 GLY H B 614 LEU HG 1.0 . 5.17 2418 2225 B 615 GLY H B 614 LEU HBy 1.0 . 4.49 2419 2226 B 615 GLY H B 614 LEU HA 1.0 . 3.23 2420 2227 B 603 GLY H B 602 SER HBx 1.0 . 4.51 2421 2227 B 602 SER HBy B 603 GLY H 1.0 . 4.51 2422 2228 B 603 GLY H B 604 LEU H 1.0 . 5.13 2423 2229 B 607 ILE HD1% B 609 GLN HE2x 1.0 . 5.38 2424 2230 B 607 ILE HD1% B 609 GLN HE2y 1.0 . 5.38 2425 2231 B 609 GLN HE2x B 607 ILE HG2% 1.0 . 4.86 2426 2232 B 609 GLN HE2y B 607 ILE HG2% 1.0 . 4.86 2427 2233 B 609 GLN HE2x B 609 GLN HGx 1.0 . 4.15 2428 2233 B 609 GLN HE2x B 609 GLN HGy 1.0 . 4.15 2429 2234 B 609 GLN HE2y B 609 GLN HGx 1.0 . 4.15 2430 2234 B 609 GLN HE2y B 609 GLN HGy 1.0 . 4.15 2431 2235 B 626 SER H B 625 GLU HBx 1.0 . 4.59 2432 2236 B 626 SER H B 625 GLU HBy 1.0 . 4.59 2433 2237 B 626 SER H B 625 GLU HGx 1.0 . 4.61 2434 2238 B 626 SER H B 626 SER HBx 1.0 . 3.90 2435 2239 B 626 SER H B 626 SER HBy 1.0 . 3.90 2436 2240 B 626 SER H B 625 GLU HA 1.0 . 3.63 2437 2241 B 626 SER H B 624 ASP HA 1.0 . 4.79 2438 2242 B 626 SER H B 625 GLU H 1.0 . 3.90 2439 2243 B 605 SER H B 604 LEU HDx% 1.0 . 4.99 2440 2244 B 605 SER H B 604 LEU HDy% 1.0 . 4.99 2441 2245 B 605 SER H B 604 LEU HBx 1.0 . 4.64 2442 2245 B 605 SER H B 604 LEU HBy 1.0 . 4.64 2443 2246 B 605 SER H B 605 SER HBx 1.0 . 3.78 2444 2246 B 605 SER H B 605 SER HBy 1.0 . 3.78 2445 2247 B 605 SER H B 604 LEU HA 1.0 . 3.57 2446 2248 B 604 LEU H B 605 SER H 1.0 . 4.51 2447 2249 B 605 SER H B 606 VAL H 1.0 . 4.91 2448 2250 B 616 ASN H B 615 GLY HAx 1.0 . 3.45 2449 2250 B 615 GLY HAy B 616 ASN H 1.0 . 3.45 2450 2251 B 618 VAL H B 618 VAL HGx% 1.0 . 3.78 2451 2252 B 618 VAL H B 618 VAL HB 1.0 . 4.03 2452 2253 B 618 VAL H B 617 ASP HBx 1.0 . 4.41 2453 2254 B 618 VAL H B 617 ASP HBy 1.0 . 4.41 2454 2255 B 618 VAL H B 617 ASP HA 1.0 . 3.41 2455 2256 B 618 VAL H B 617 ASP H 1.0 . 4.57 2456 2257 B 617 ASP H B 617 ASP HBx 1.0 . 4.05 2457 2258 B 617 ASP H B 617 ASP HBy 1.0 . 4.05 2458 2259 B 617 ASP H B 616 ASN HBx 1.0 . 4.74 2459 2260 B 617 ASP H B 616 ASN HBy 1.0 . 4.74 2460 2261 B 601 ILE HD1% B 602 SER H 1.0 . 4.79 2461 2262 B 602 SER H B 601 ILE HG2% 1.0 . 4.54 2462 2263 B 602 SER H B 601 ILE HB 1.0 . 4.75 2463 2264 B 602 SER H B 602 SER HBx 1.0 . 3.93 2464 2264 B 602 SER HBy B 602 SER H 1.0 . 3.93 2465 2265 B 602 SER H B 601 ILE HA 1.0 . 3.48 2466 2266 B 611 VAL H B 611 VAL HGy% 1.0 . 3.71 2467 2267 B 611 VAL H B 610 GLU HBx 1.0 . 3.66 2468 2268 B 611 VAL H B 610 GLU HBy 1.0 . 3.66 2469 2269 B 611 VAL H B 611 VAL HB 1.0 . 3.86 2470 2270 B 611 VAL H B 610 GLU HGx 1.0 . 4.67 2471 2271 B 611 VAL H B 610 GLU HA 1.0 . 3.04 2472 2272 B 611 VAL H B 612 GLU H 1.0 . 4.32 2473 2273 B 621 TRP H B 620 GLU HBx 1.0 . 5.50 2474 2273 B 620 GLU HBy B 621 TRP H 1.0 . 5.50 2475 2274 B 629 ILE HG2% B 628 GLU H 1.0 . 4.74 2476 2275 B 628 GLU H B 629 ILE HD1% 1.0 . 5.01 2477 2276 B 628 GLU H B 628 GLU HBx 1.0 . 3.70 2478 2277 B 628 GLU H B 628 GLU HBy 1.0 . 3.70 2479 2278 B 628 GLU H B 628 GLU HGx 1.0 . 4.03 2480 2279 B 628 GLU H B 628 GLU HGy 1.0 . 4.03 2481 2280 B 628 GLU H B 627 ASP HBy 1.0 . 4.60 2482 2281 B 628 GLU H B 626 SER HBx 1.0 . 4.72 2483 2282 B 628 GLU H B 626 SER HBy 1.0 . 4.72 2484 2283 B 628 GLU H B 629 ILE H 1.0 . 3.44 2485 2284 B 629 ILE HG2% B 629 ILE H 1.0 . 3.89 2486 2285 B 629 ILE H B 629 ILE HG1x 1.0 . 4.26 2487 2286 B 629 ILE H B 629 ILE HG1y 1.0 . 4.26 2488 2287 B 629 ILE H B 629 ILE HB 1.0 . 3.66 2489 2288 B 629 ILE H B 628 GLU HBy 1.0 . 4.37 2490 2289 B 629 ILE H B 628 GLU HGx 1.0 . 4.76 2491 2290 B 629 ILE H B 627 ASP HBx 1.0 . 5.50 2492 2291 B 629 ILE H B 627 ASP HBy 1.0 . 5.50 2493 2292 B 629 ILE H B 628 GLU HA 1.0 . 3.54 2494 2293 B 624 ASP H B 624 ASP HBx 1.0 . 3.42 2495 2293 B 624 ASP H B 624 ASP HBy 1.0 . 3.42 2496 2294 B 624 ASP H B 623 ASP HBy 1.0 . 4.59 2497 2295 B 624 ASP H B 623 ASP H 1.0 . 3.59 2498 2296 B 623 ASP H B 622 GLU HBx 1.0 . 4.88 2499 2297 B 623 ASP H B 622 GLU HBy 1.0 . 4.88 2500 2298 B 625 GLU H B 625 GLU HBx 1.0 . 3.75 2501 2299 B 625 GLU H B 625 GLU HBy 1.0 . 3.75 2502 2300 B 625 GLU H B 625 GLU HGx 1.0 . 3.95 2503 2301 B 625 GLU H B 625 GLU HGy 1.0 . 3.95 2504 2302 B 625 GLU H B 624 ASP HBx 1.0 . 3.77 2505 2302 B 625 GLU H B 624 ASP HBy 1.0 . 3.77 2506 2303 B 625 GLU H B 624 ASP H 1.0 . 3.76 2507 2304 B 604 LEU H B 604 LEU HDx% 1.0 . 4.36 2508 2305 B 604 LEU H B 604 LEU HDy% 1.0 . 4.36 2509 2306 B 604 LEU H B 604 LEU HBx 1.0 . 2.98 2510 2306 B 604 LEU H B 604 LEU HBy 1.0 . 2.98 2511 2307 B 604 LEU H B 603 GLY HAx 1.0 . 3.15 2512 2307 B 604 LEU H B 603 GLY HAy 1.0 . 3.15 2513 2308 B 607 ILE HG2% B 609 GLN H 1.0 . 4.48 2514 2309 B 609 GLN H B 609 GLN HBx 1.0 . 3.81 2515 2310 B 609 GLN H B 609 GLN HBy 1.0 . 3.81 2516 2311 B 609 GLN H B 609 GLN HGx 1.0 . 3.88 2517 2311 B 609 GLN HGy B 609 GLN H 1.0 . 3.88 2518 2312 B 613 ARG H B 613 ARG HGy 1.0 . 3.63 2519 2313 B 613 ARG H B 613 ARG HGx 1.0 . 3.87 2520 2314 B 613 ARG H B 613 ARG HBx 1.0 . 3.88 2521 2315 B 613 ARG H B 613 ARG HBy 1.0 . 3.88 2522 2316 B 613 ARG H B 612 GLU HBx 1.0 . 4.13 2523 2317 B 613 ARG H B 612 GLU HBy 1.0 . 4.13 2524 2318 B 613 ARG H B 613 ARG HDx 1.0 . 5.05 2525 2318 B 613 ARG H B 613 ARG HDy 1.0 . 5.05 2526 2319 B 612 GLU H B 613 ARG H 1.0 . 3.67 2527 2320 B 620 GLU H B 620 GLU HBx 1.0 . 3.89 2528 2320 B 620 GLU HBy B 620 GLU H 1.0 . 3.89 2529 2321 B 620 GLU H B 619 PHE HBx 1.0 . 4.72 2530 2322 B 621 TRP H B 620 GLU H 1.0 . 5.40 2531 2323 B 606 VAL H B 606 VAL HGx% 1.0 . 3.81 2532 2324 B 606 VAL H B 605 SER HBx 1.0 . 4.79 2533 2324 B 605 SER HBy B 606 VAL H 1.0 . 4.79 2534 2325 B 606 VAL H B 605 SER HA 1.0 . 3.51 2535 2326 B 618 VAL HB B 619 PHE H 1.0 . 4.70 2536 2327 B 618 VAL H B 619 PHE H 1.0 . 4.22 2537 2328 B 610 GLU H B 610 GLU HBx 1.0 . 3.73 2538 2329 B 610 GLU H B 609 GLN HBx 1.0 . 4.12 2539 2330 B 610 GLU H B 610 GLU HBy 1.0 . 3.73 2540 2331 B 610 GLU H B 610 GLU HGx 1.0 . 4.06 2541 2332 B 610 GLU H B 610 GLU HGy 1.0 . 4.06 2542 2333 B 610 GLU H B 609 GLN HA 1.0 . 3.14 2543 2334 B 611 VAL H B 610 GLU H 1.0 . 4.70 2544 2335 B 627 ASP H B 627 ASP HBx 1.0 . 3.69 2545 2336 B 627 ASP H B 627 ASP HBy 1.0 . 3.69 2546 2337 B 627 ASP H B 626 SER HBx 1.0 . 4.36 2547 2338 B 627 ASP H B 626 SER HBy 1.0 . 4.36 2548 2339 B 627 ASP H B 626 SER HA 1.0 . 3.11 2549 2340 B 622 GLU H B 622 GLU HGx 1.0 . 4.70 2550 2341 B 622 GLU H B 622 GLU HGy 1.0 . 4.70 2551 2342 B 621 TRP H B 622 GLU H 1.0 . 4.77 2552 2343 B 601 ILE HD1% B 601 ILE H 1.0 . 4.56 2553 2344 B 601 ILE HG2% B 601 ILE H 1.0 . 4.39 2554 2345 B 601 ILE H B 601 ILE HG1x 1.0 . 4.44 2555 2346 B 601 ILE H B 601 ILE HG1y 1.0 . 4.44 2556 2347 B 601 ILE HB B 601 ILE H 1.0 . 3.77 2557 2348 B 601 ILE H B 600 MET HBx 1.0 . 4.43 2558 2349 B 601 ILE H B 600 MET HBy 1.0 . 4.43 2559 2350 B 601 ILE H B 600 MET HA 1.0 . 3.26 2560 2351 B 614 LEU H B 614 LEU HDx% 1.0 . 4.39 2561 2352 B 614 LEU H B 614 LEU HDy% 1.0 . 4.39 2562 2353 B 614 LEU H B 614 LEU HBx 1.0 . 3.69 2563 2354 B 613 ARG HGy B 614 LEU H 1.0 . 3.47 2564 2355 B 613 ARG HGx B 614 LEU H 1.0 . 3.58 2565 2356 B 614 LEU H B 614 LEU HBy 1.0 . 3.69 2566 2357 B 614 LEU H B 615 GLY HAx 1.0 . 4.89 2567 2357 B 615 GLY HAy B 614 LEU H 1.0 . 4.89 2568 2358 B 612 GLU H B 611 VAL HGy% 1.0 . 4.45 2569 2359 B 611 VAL HB B 612 GLU H 1.0 . 4.27 2570 2360 B 612 GLU H B 612 GLU HGx 1.0 . 3.94 2571 2361 B 612 GLU H B 612 GLU HGy 1.0 . 3.94 2572 2362 B 612 GLU H B 611 VAL HA 1.0 . 2.90 2573 2363 B 607 ILE HD1% B 607 ILE H 1.0 . 3.94 2574 2364 B 607 ILE HG2% B 607 ILE H 1.0 . 3.90 2575 2365 B 607 ILE H B 606 VAL HGx% 1.0 . 3.90 2576 2366 B 607 ILE H B 607 ILE HG1x 1.0 . 3.94 2577 2367 B 607 ILE H B 607 ILE HG1y 1.0 . 3.94 2578 2368 B 607 ILE H B 607 ILE HB 1.0 . 3.22 2579 2369 B 607 ILE H B 606 VAL HA 1.0 . 2.80 2580 2370 B 607 ILE H B 608 LYS H 1.0 . 4.69 2581 2371 B 607 ILE HD1% B 608 LYS H 1.0 . 4.52 2582 2372 B 607 ILE HG2% B 608 LYS H 1.0 . 3.84 2583 2373 B 608 LYS H B 607 ILE HG1x 1.0 . 5.50 2584 2374 B 608 LYS H B 608 LYS HGx 1.0 . 4.43 2585 2375 B 608 LYS H B 608 LYS HGy 1.0 . 4.43 2586 2376 B 608 LYS H B 608 LYS HBx 1.0 . 4.07 2587 2377 B 608 LYS H B 607 ILE HA 1.0 . 2.92 2588 2378 B 621 TRP HE1 B 623 ASP HBx 1.0 . 5.40 2589 2379 B 621 TRP HE1 B 623 ASP HBy 1.0 . 5.40 2590 2380 B 629 ILE HG2% B 630 ALA H 1.0 . 4.61 2591 2381 B 630 ALA H B 629 ILE HG1x 1.0 . 5.50 2592 2382 B 630 ALA H B 629 ILE HG1y 1.0 . 5.50 2593 2383 B 629 ILE HB B 630 ALA H 1.0 . 4.70 2594 2384 B 630 ALA H B 629 ILE HA 1.0 . 3.13 2595 2385 B 628 GLU HA B 630 ALA H 1.0 . 4.29 2596 2386 B 629 ILE H B 630 ALA H 1.0 . 4.33 2597 2387 B 629 ILE HD1% B 629 ILE HB 1.0 . 3.91 2598 2388 B 629 ILE HD1% B 629 ILE HA 1.0 . 3.90 2599 2389 B 629 ILE HD1% B 630 ALA H 1.0 . 4.76 2600 2390 B 629 ILE HD1% B 629 ILE H 1.0 . 5.09 2601 2391 B 629 ILE HG2% B 629 ILE HA 1.0 . 4.09 2602 2392 B 629 ILE HG2% B 628 GLU HA 1.0 . 5.06 2603 2393 B 629 ILE HG2% A 49 TYR HE% 1.0 . 4.72 2604 2394 B 607 ILE HG2% B 607 ILE HA 1.0 . 3.41 2605 2395 B 618 VAL HA B 618 VAL HGy% 1.0 . 3.78 2606 2396 B 618 VAL H B 618 VAL HGy% 1.0 . 3.78 2607 2397 B 606 VAL HA B 606 VAL HGy% 1.0 . 3.51 2608 2398 B 606 VAL H B 606 VAL HGy% 1.0 . 3.81 2609 2399 B 607 ILE H B 606 VAL HGy% 1.0 . 3.90 2610 2400 B 611 VAL HA B 611 VAL HGx% 1.0 . 3.37 2611 2401 B 611 VAL H B 611 VAL HGx% 1.0 . 3.71 2612 2402 B 612 GLU H B 611 VAL HGx% 1.0 . 4.45 2613 2403 B 630 ALA HB% B 627 ASP HBy 1.0 . 4.61 2614 2404 B 629 ILE HA B 630 ALA HB% 1.0 . 4.87 2615 2405 B 630 ALA HB% B 627 ASP HA 1.0 . 4.45 2616 2406 B 630 ALA H B 630 ALA HB% 1.0 . 3.45 2617 2407 B 606 VAL HA B 606 VAL HGx% 1.0 . 3.51 2618 2408 B 611 VAL HA B 611 VAL HGy% 1.0 . 3.37 2619 2409 B 618 VAL HA B 618 VAL HGx% 1.0 . 3.78 2620 2410 B 614 LEU HDx% B 614 LEU HBx 1.0 . 3.58 2621 2411 B 614 LEU HDx% B 614 LEU HBy 1.0 . 3.58 2622 2412 B 619 PHE HD% B 614 LEU HDx% 1.0 . 5.50 2623 2413 B 604 LEU HBx B 604 LEU HDy% 1.0 . 3.75 2624 2413 B 604 LEU HBy B 604 LEU HDy% 1.0 . 3.75 2625 2414 B 614 LEU HBx B 614 LEU HDy% 1.0 . 3.58 2626 2415 B 614 LEU HBy B 614 LEU HDy% 1.0 . 3.58 2627 2416 B 614 LEU HA B 614 LEU HDy% 1.0 . 4.12 2628 2417 B 629 ILE HG2% B 629 ILE HG1x 1.0 . 4.18 2629 2418 B 629 ILE HG2% B 629 ILE HG1y 1.0 . 4.18 2630 2419 B 604 LEU HA B 604 LEU HG 1.0 . 4.22 2631 2420 B 604 LEU H B 604 LEU HG 1.0 . 4.58 2632 2421 B 605 SER H B 604 LEU HG 1.0 . 4.10 2633 2422 B 614 LEU HG B 614 LEU HA 1.0 . 3.83 2634 2423 B 614 LEU HG B 614 LEU H 1.0 . 3.84 2635 2424 B 614 LEU HA B 613 ARG HGy 1.0 . 4.73 2636 2425 B 601 ILE HG2% B 601 ILE HG1x 1.0 . 3.50 2637 2426 B 601 ILE HG2% B 601 ILE HG1y 1.0 . 3.50 2638 2427 B 607 ILE HG2% B 607 ILE HG1x 1.0 . 3.52 2639 2428 B 607 ILE HG2% B 607 ILE HG1y 1.0 . 3.52 2640 2429 B 608 LYS H B 607 ILE HG1y 1.0 . 5.50 2641 2430 B 608 LYS HA B 608 LYS HDx 1.0 . 4.77 2642 2430 B 608 LYS HA B 608 LYS HDy 1.0 . 4.77 2643 2431 B 610 GLU H B 609 GLN HBy 1.0 . 4.12 2644 2432 B 629 ILE H B 628 GLU HBx 1.0 . 4.37 2645 2433 B 614 LEU H B 613 ARG HBx 1.0 . 4.68 2646 2434 B 614 LEU H B 613 ARG HBy 1.0 . 4.68 2647 2435 B 606 VAL H B 606 VAL HB 1.0 . 3.64 2648 2436 B 607 ILE H B 606 VAL HB 1.0 . 3.95 2649 2437 B 608 LYS H B 608 LYS HBy 1.0 . 4.07 2650 2438 B 609 GLN H B 608 LYS HBx 1.0 . 4.56 2651 2439 B 609 GLN H B 608 LYS HBy 1.0 . 4.56 2652 2440 B 607 ILE HG2% B 609 GLN HGx 1.0 . 4.13 2653 2440 B 607 ILE HG2% B 609 GLN HGy 1.0 . 4.13 2654 2441 B 609 GLN HA B 609 GLN HGx 1.0 . 3.58 2655 2441 B 609 GLN HGy B 609 GLN HA 1.0 . 3.58 2656 2442 B 610 GLU H B 609 GLN HGx 1.0 . 4.79 2657 2442 B 609 GLN HGy B 610 GLU H 1.0 . 4.79 2658 2443 B 620 GLU HA B 620 GLU HGx 1.0 . 4.15 2659 2443 B 620 GLU HA B 620 GLU HGy 1.0 . 4.15 2660 2444 B 621 TRP H B 620 GLU HGx 1.0 . 4.62 2661 2444 B 621 TRP H B 620 GLU HGy 1.0 . 4.62 2662 2445 B 620 GLU H B 620 GLU HGx 1.0 . 4.39 2663 2445 B 620 GLU H B 620 GLU HGy 1.0 . 4.39 2664 2446 B 611 VAL H B 610 GLU HGy 1.0 . 4.67 2665 2447 B 628 GLU HA B 628 GLU HGx 1.0 . 3.91 2666 2448 B 628 GLU HA B 628 GLU HGy 1.0 . 3.91 2667 2449 B 629 ILE H B 628 GLU HGy 1.0 . 4.76 2668 2450 B 612 GLU HA B 612 GLU HGx 1.0 . 4.02 2669 2451 B 612 GLU HA B 612 GLU HGy 1.0 . 4.02 2670 2452 B 613 ARG H B 612 GLU HGx 1.0 . 4.62 2671 2453 B 613 ARG H B 612 GLU HGy 1.0 . 4.62 2672 2454 B 626 SER H B 625 GLU HGy 1.0 . 4.61 2673 2455 B 607 ILE HD1% B 607 ILE HB 1.0 . 3.53 2674 2456 B 601 ILE HD1% B 601 ILE HB 1.0 . 3.69 2675 2457 B 620 GLU H B 619 PHE HBy 1.0 . 4.72 2676 2458 B 619 PHE HD% B 617 ASP HBx 1.0 . 5.50 2677 2459 B 619 PHE HD% B 617 ASP HBy 1.0 . 5.50 2678 2460 B 630 ALA HB% B 627 ASP HBx 1.0 . 4.61 2679 2461 B 628 GLU H B 627 ASP HBx 1.0 . 4.60 2680 2462 B 624 ASP H B 623 ASP HBx 1.0 . 4.59 2681 2463 B 607 ILE HG2% B 608 LYS HEx 1.0 . 5.34 2682 2463 B 607 ILE HG2% B 608 LYS HEy 1.0 . 5.34 2683 2464 B 608 LYS HGx B 608 LYS HEx 1.0 . 3.87 2684 2464 B 608 LYS HEy B 608 LYS HGx 1.0 . 3.87 2685 2465 B 608 LYS HEy B 608 LYS HGy 1.0 . 3.87 2686 2465 B 608 LYS HEx B 608 LYS HGy 1.0 . 3.87 2687 2466 B 604 LEU HBy B 604 LEU HDx% 1.0 . 3.75 2688 2466 B 604 LEU HDx% B 604 LEU HBx 1.0 . 3.75 2689 2467 B 613 ARG HDy B 613 ARG HBx 1.0 . 3.63 2690 2467 B 613 ARG HBx B 613 ARG HDx 1.0 . 3.63 2691 2468 B 613 ARG HDy B 613 ARG HBy 1.0 . 3.63 2692 2468 B 613 ARG HBy B 613 ARG HDx 1.0 . 3.63 2693 2469 B 613 ARG HA B 613 ARG HDx 1.0 . 4.61 2694 2469 B 613 ARG HDy B 613 ARG HA 1.0 . 4.61 2695 2470 B 614 LEU H B 613 ARG HDx 1.0 . 5.02 2696 2470 B 613 ARG HDy B 614 LEU H 1.0 . 5.02 2697 2471 B 598 PRO HDx B 597 GLY HAx 1.0 . 3.06 2698 2471 B 597 GLY HAy B 598 PRO HDx 1.0 . 3.06 2699 2472 B 598 PRO HDy B 597 GLY HAx 1.0 . 3.06 2700 2472 B 597 GLY HAy B 598 PRO HDy 1.0 . 3.06 2701 2473 B 601 ILE HG2% B 603 GLY HAx 1.0 . 5.50 2702 2473 B 601 ILE HG2% B 603 GLY HAy 1.0 . 5.50 2703 2474 B 603 GLY HAx B 604 LEU HBx 1.0 . 5.26 2704 2474 B 603 GLY HAy B 604 LEU HBx 1.0 . 5.26 2705 2474 B 604 LEU HBy B 603 GLY HAx 1.0 . 5.26 2706 2474 B 604 LEU HBy B 603 GLY HAy 1.0 . 5.26 2707 2475 B 629 ILE HB B 630 ALA HA 1.0 . 5.16 2708 2476 B 624 ASP H B 623 ASP HA 1.0 . 3.33 2709 2477 B 628 GLU HA B 627 ASP HA 1.0 . 5.21 2710 2478 B 627 ASP HA B 630 ALA HA 1.0 . 5.50 2711 2479 B 628 GLU H B 627 ASP HA 1.0 . 3.42 2712 2480 B 614 LEU HA B 614 LEU HDx% 1.0 . 4.12 2713 2481 B 604 LEU HA B 604 LEU HDx% 1.0 . 3.99 2714 2482 B 604 LEU HA B 604 LEU HDy% 1.0 . 3.99 2715 2483 B 613 ARG HGy B 613 ARG HA 1.0 . 4.08 2716 2484 B 613 ARG HGx B 613 ARG HA 1.0 . 3.70 2717 2485 B 607 ILE HG2% B 608 LYS HA 1.0 . 4.20 2718 2486 B 609 GLN H B 608 LYS HA 1.0 . 3.47 2719 2487 B 621 TRP HA B 621 TRP HD1 1.0 . 5.08 2720 2488 B 610 GLU HA B 610 GLU HGx 1.0 . 3.93 2721 2489 B 610 GLU HA B 610 GLU HGy 1.0 . 3.93 2722 2490 B 613 ARG HGx B 612 GLU HA 1.0 . 5.50 2723 2491 B 601 ILE HG2% B 602 SER HA 1.0 . 4.64 2724 2492 B 605 SER HA B 604 LEU HBx 1.0 . 5.50 2725 2492 B 604 LEU HBy B 605 SER HA 1.0 . 5.50 2726 2493 B 605 SER HA B 604 LEU HG 1.0 . 5.50 2727 2494 B 607 ILE HD1% B 607 ILE HA 1.0 . 3.88 2728 2495 B 601 ILE HD1% B 601 ILE HA 1.0 . 4.09 2729 2496 B 601 ILE HG2% B 601 ILE HA 1.0 . 3.65 2730 2497 B 611 VAL HA A 8 GLU HGx 1.0 . 4.71 2731 2498 B 611 VAL HA A 8 GLU HGy 1.0 . 4.71 2732 2499 B 621 TRP H B 621 TRP HD1 1.0 . 5.20 2733 2500 B 619 PHE HD% B 614 LEU HDy% 1.0 . 5.50 2734 2501 B 618 VAL HB B 619 PHE HD% 1.0 . 5.01 2735 2502 B 619 PHE H B 619 PHE HD% 1.0 . 4.51 2736 2503 A 1 MET H A 1 MET HGx 1.0 . 4.27 2737 2503 A 1 MET H A 1 MET HGy 1.0 . 4.27 2738 2504 A 2 LYS H A 1 MET HGx 1.0 . 4.11 2739 2504 A 2 LYS H A 1 MET HGy 1.0 . 4.11 2740 2505 A 2 LYS H A 2 LYS HBx 1.0 . 3.07 2741 2505 A 2 LYS H A 2 LYS HBy 1.0 . 3.07 2742 2506 A 2 LYS H A 3 SER HBx 1.0 . 4.26 2743 2506 A 2 LYS H A 3 SER HBy 1.0 . 4.26 2744 2507 A 2 LYS HA A 2 LYS HGy 1.0 . 3.04 2745 2507 A 2 LYS HA A 2 LYS HGx 1.0 . 3.04 2746 2508 A 2 LYS HBy A 2 LYS HEx 1.0 . 4.41 2747 2508 A 2 LYS HBx A 2 LYS HEx 1.0 . 4.41 2748 2508 A 2 LYS HEy A 2 LYS HBx 1.0 . 4.41 2749 2508 A 2 LYS HEy A 2 LYS HBy 1.0 . 4.41 2750 2509 A 3 SER H A 2 LYS HBx 1.0 . 3.58 2751 2509 A 3 SER H A 2 LYS HBy 1.0 . 3.58 2752 2510 A 2 LYS HEy A 2 LYS HGy 1.0 . 2.80 2753 2510 A 2 LYS HEx A 2 LYS HGy 1.0 . 2.80 2754 2510 A 2 LYS HGx A 2 LYS HEx 1.0 . 2.80 2755 2510 A 2 LYS HEy A 2 LYS HGx 1.0 . 2.80 2756 2511 A 3 SER H A 2 LYS HGy 1.0 . 4.02 2757 2511 A 3 SER H A 2 LYS HGx 1.0 . 4.02 2758 2512 A 3 SER HA A 6 LYS HBx 1.0 . 5.04 2759 2512 A 3 SER HA A 6 LYS HBy 1.0 . 5.04 2760 2513 A 4 THR HA A 3 SER HBx 1.0 . 5.32 2761 2513 A 4 THR HA A 3 SER HBy 1.0 . 5.32 2762 2514 A 3 SER HBx A 6 LYS HBx 1.0 . 4.05 2763 2514 A 3 SER HBy A 6 LYS HBx 1.0 . 4.05 2764 2514 A 6 LYS HBy A 3 SER HBx 1.0 . 4.05 2765 2514 A 3 SER HBy A 6 LYS HBy 1.0 . 4.05 2766 2515 A 3 SER HBx A 6 LYS HGy 1.0 . 5.10 2767 2515 A 3 SER HBy A 6 LYS HGy 1.0 . 5.10 2768 2515 A 6 LYS HGx A 3 SER HBx 1.0 . 5.10 2769 2515 A 3 SER HBy A 6 LYS HGx 1.0 . 5.10 2770 2516 A 4 THR H A 5 PHE HBx 1.0 . 4.10 2771 2516 A 4 THR H A 5 PHE HBy 1.0 . 4.10 2772 2517 A 4 THR HG2% A 7 SER HBy 1.0 . 4.57 2773 2517 A 4 THR HG2% A 7 SER HBx 1.0 . 4.57 2774 2518 A 7 SER H A 5 PHE HBx 1.0 . 5.00 2775 2518 A 7 SER H A 5 PHE HBy 1.0 . 5.00 2776 2519 A 32 ILE HG2% A 5 PHE HBx 1.0 . 3.59 2777 2519 A 32 ILE HG2% A 5 PHE HBy 1.0 . 3.59 2778 2520 A 32 ILE HD1% A 5 PHE HBx 1.0 . 4.86 2779 2520 A 32 ILE HD1% A 5 PHE HBy 1.0 . 4.86 2780 2521 A 5 PHE HD% A 47 ARG HGy 1.0 . 5.34 2781 2521 A 5 PHE HD% A 47 ARG HGx 1.0 . 5.34 2782 2522 A 5 PHE HD% A 48 LYS HGx 1.0 . 4.59 2783 2522 A 5 PHE HD% A 48 LYS HGy 1.0 . 4.59 2784 2523 A 5 PHE HE% A 48 LYS HGx 1.0 . 4.08 2785 2523 A 5 PHE HE% A 48 LYS HGy 1.0 . 4.08 2786 2524 A 6 LYS H A 6 LYS HBx 1.0 . 3.67 2787 2524 A 6 LYS H A 6 LYS HBy 1.0 . 3.67 2788 2525 A 6 LYS H A 6 LYS HGy 1.0 . 4.45 2789 2525 A 6 LYS H A 6 LYS HGx 1.0 . 4.45 2790 2526 A 6 LYS HBx A 6 LYS HDx 1.0 . 3.19 2791 2526 A 6 LYS HBy A 6 LYS HDx 1.0 . 3.19 2792 2526 A 6 LYS HDy A 6 LYS HBx 1.0 . 3.19 2793 2526 A 6 LYS HBy A 6 LYS HDy 1.0 . 3.19 2794 2527 A 6 LYS HBx A 6 LYS HEy 1.0 . 3.95 2795 2527 A 6 LYS HBy A 6 LYS HEy 1.0 . 3.95 2796 2527 A 6 LYS HEx A 6 LYS HBx 1.0 . 3.95 2797 2527 A 6 LYS HBy A 6 LYS HEx 1.0 . 3.95 2798 2528 A 7 SER H A 6 LYS HBx 1.0 . 3.57 2799 2528 A 7 SER H A 6 LYS HBy 1.0 . 3.57 2800 2529 A 6 LYS HBx A 7 SER HBy 1.0 . 4.46 2801 2529 A 6 LYS HBy A 7 SER HBy 1.0 . 4.46 2802 2529 A 7 SER HBx A 6 LYS HBx 1.0 . 4.46 2803 2529 A 6 LYS HBy A 7 SER HBx 1.0 . 4.46 2804 2530 A 106 TYR HD% A 6 LYS HGy 1.0 . 5.34 2805 2530 A 106 TYR HD% A 6 LYS HGx 1.0 . 5.34 2806 2531 A 106 TYR HE% A 6 LYS HGy 1.0 . 4.41 2807 2531 A 106 TYR HE% A 6 LYS HGx 1.0 . 4.41 2808 2532 A 106 TYR HD% A 6 LYS HDx 1.0 . 4.94 2809 2532 A 106 TYR HD% A 6 LYS HDy 1.0 . 4.94 2810 2533 A 106 TYR HD% A 6 LYS HEy 1.0 . 4.52 2811 2533 A 106 TYR HD% A 6 LYS HEx 1.0 . 4.52 2812 2534 A 106 TYR HE% A 6 LYS HEy 1.0 . 3.94 2813 2534 A 106 TYR HE% A 6 LYS HEx 1.0 . 3.94 2814 2535 A 7 SER H A 8 GLU HBy 1.0 . 4.39 2815 2535 A 7 SER H A 8 GLU HBx 1.0 . 4.39 2816 2536 A 8 GLU H A 7 SER HBy 1.0 . 4.28 2817 2536 A 8 GLU H A 7 SER HBx 1.0 . 4.28 2818 2537 A 8 GLU H A 8 GLU HGy 1.0 . 4.31 2819 2537 A 8 GLU H A 8 GLU HGx 1.0 . 4.31 2820 2538 A 8 GLU HA A 8 GLU HGy 1.0 . 3.36 2821 2538 A 8 GLU HA A 8 GLU HGx 1.0 . 3.36 2822 2539 A 9 TYR H A 8 GLU HBy 1.0 . 4.36 2823 2539 A 9 TYR H A 8 GLU HBx 1.0 . 4.36 2824 2540 A 9 TYR HD% A 8 GLU HBy 1.0 . 3.55 2825 2540 A 9 TYR HD% A 8 GLU HBx 1.0 . 3.55 2826 2541 A 9 TYR HE% A 8 GLU HBy 1.0 . 3.81 2827 2541 A 9 TYR HE% A 8 GLU HBx 1.0 . 3.81 2828 2542 A 9 TYR H A 8 GLU HGy 1.0 . 5.34 2829 2542 A 9 TYR H A 8 GLU HGx 1.0 . 5.34 2830 2543 A 9 TYR HE% A 8 GLU HGy 1.0 . 4.22 2831 2543 A 9 TYR HE% A 8 GLU HGx 1.0 . 4.22 2832 2544 A 9 TYR H A 13 LYS HGy 1.0 . 5.34 2833 2544 A 9 TYR H A 13 LYS HGx 1.0 . 5.34 2834 2545 A 9 TYR HA A 10 PRO HGx 1.0 . 4.16 2835 2545 A 9 TYR HA A 10 PRO HGy 1.0 . 4.16 2836 2546 A 9 TYR HE% A 13 LYS HBy 1.0 . 5.34 2837 2546 A 9 TYR HE% A 13 LYS HBx 1.0 . 5.34 2838 2547 A 9 TYR HE% B 618 VAL HGy% 1.0 . 3.76 2839 2547 A 9 TYR HE% B 618 VAL HGx% 1.0 . 3.76 2840 2548 A 11 PHE H A 10 PRO HBy 1.0 . 4.14 2841 2548 A 11 PHE H A 10 PRO HBx 1.0 . 4.14 2842 2549 A 12 GLU H A 10 PRO HBy 1.0 . 4.71 2843 2549 A 12 GLU H A 10 PRO HBx 1.0 . 4.71 2844 2550 A 13 LYS H A 10 PRO HBy 1.0 . 4.23 2845 2550 A 13 LYS H A 10 PRO HBx 1.0 . 4.23 2846 2551 A 10 PRO HGy A 13 LYS HEx 1.0 . 4.71 2847 2551 A 10 PRO HGx A 13 LYS HEx 1.0 . 4.71 2848 2551 A 13 LYS HEy A 10 PRO HGx 1.0 . 4.71 2849 2551 A 13 LYS HEy A 10 PRO HGy 1.0 . 4.71 2850 2552 A 10 PRO HDx A 13 LYS HGy 1.0 . 4.09 2851 2552 A 10 PRO HDx A 13 LYS HGx 1.0 . 4.09 2852 2553 A 10 PRO HDy A 13 LYS HBy 1.0 . 4.29 2853 2553 A 10 PRO HDy A 13 LYS HBx 1.0 . 4.29 2854 2554 A 11 PHE HA A 102 ASP HBy 1.0 . 5.16 2855 2554 A 11 PHE HA A 102 ASP HBx 1.0 . 5.16 2856 2555 A 11 PHE HD% A 12 GLU HGy 1.0 . 3.77 2857 2555 A 11 PHE HD% A 12 GLU HGx 1.0 . 3.77 2858 2556 A 11 PHE HE% A 12 GLU HGy 1.0 . 4.31 2859 2556 A 11 PHE HE% A 12 GLU HGx 1.0 . 4.31 2860 2557 A 12 GLU H A 12 GLU HGy 1.0 . 3.36 2861 2557 A 12 GLU H A 12 GLU HGx 1.0 . 3.36 2862 2558 A 13 LYS H A 12 GLU HGy 1.0 . 4.67 2863 2558 A 13 LYS H A 12 GLU HGx 1.0 . 4.67 2864 2559 A 15 LYS HBy A 12 GLU HGy 1.0 . 4.81 2865 2559 A 15 LYS HBy A 12 GLU HGx 1.0 . 4.81 2866 2560 A 13 LYS H A 13 LYS HBy 1.0 . 3.16 2867 2560 A 13 LYS H A 13 LYS HBx 1.0 . 3.16 2868 2561 A 13 LYS H A 13 LYS HGy 1.0 . 4.03 2869 2561 A 13 LYS H A 13 LYS HGx 1.0 . 4.03 2870 2562 A 13 LYS HA A 13 LYS HGy 1.0 . 3.26 2871 2562 A 13 LYS HA A 13 LYS HGx 1.0 . 3.26 2872 2563 A 14 ARG H A 13 LYS HBy 1.0 . 3.72 2873 2563 A 14 ARG H A 13 LYS HBx 1.0 . 3.72 2874 2564 A 14 ARG HA B 618 VAL HGy% 1.0 . 4.35 2875 2564 A 14 ARG HA B 618 VAL HGx% 1.0 . 4.35 2876 2565 A 15 LYS H A 102 ASP HBy 1.0 . 4.19 2877 2565 A 15 LYS H A 102 ASP HBx 1.0 . 4.19 2878 2566 A 15 LYS HBx A 15 LYS HEy 1.0 . 4.46 2879 2566 A 15 LYS HBx A 15 LYS HEx 1.0 . 4.46 2880 2567 A 16 ALA H A 15 LYS HEy 1.0 . 4.96 2881 2567 A 16 ALA H A 15 LYS HEx 1.0 . 4.96 2882 2568 A 16 ALA H A 19 GLU HGy 1.0 . 4.65 2883 2568 A 16 ALA H A 19 GLU HGx 1.0 . 4.65 2884 2569 A 16 ALA HA A 19 GLU HGy 1.0 . 3.99 2885 2569 A 16 ALA HA A 19 GLU HGx 1.0 . 3.99 2886 2570 A 16 ALA HB% A 19 GLU HGy 1.0 . 5.34 2887 2570 A 16 ALA HB% A 19 GLU HGx 1.0 . 5.34 2888 2571 A 17 GLU H B 618 VAL HGy% 1.0 . 4.90 2889 2571 A 17 GLU H B 618 VAL HGx% 1.0 . 4.90 2890 2572 A 18 SER H A 17 GLU HBy 1.0 . 3.50 2891 2572 A 18 SER H A 17 GLU HBx 1.0 . 3.50 2892 2573 A 104 PHE HE% A 17 GLU HBy 1.0 . 3.49 2893 2573 A 104 PHE HE% A 17 GLU HBx 1.0 . 3.49 2894 2574 A 18 SER H A 18 SER HBy 1.0 . 3.38 2895 2574 A 18 SER H A 18 SER HBx 1.0 . 3.38 2896 2575 A 18 SER H B 618 VAL HGy% 1.0 . 5.44 2897 2575 A 18 SER H B 618 VAL HGx% 1.0 . 5.44 2898 2576 A 18 SER HA A 19 GLU HGy 1.0 . 5.34 2899 2576 A 18 SER HA A 19 GLU HGx 1.0 . 5.34 2900 2577 A 19 GLU H A 18 SER HBy 1.0 . 4.25 2901 2577 A 19 GLU H A 18 SER HBx 1.0 . 4.25 2902 2578 A 18 SER HBx A 19 GLU HGy 1.0 . 4.61 2903 2578 A 18 SER HBy A 19 GLU HGy 1.0 . 4.61 2904 2578 A 19 GLU HGx A 18 SER HBy 1.0 . 4.61 2905 2578 A 19 GLU HGx A 18 SER HBx 1.0 . 4.61 2906 2579 A 18 SER HG A 103 GLY HAy 1.0 . 4.32 2907 2579 A 18 SER HG A 103 GLY HAx 1.0 . 4.32 2908 2580 A 19 GLU H A 19 GLU HGy 1.0 . 3.32 2909 2580 A 19 GLU H A 19 GLU HGx 1.0 . 3.32 2910 2581 A 19 GLU HA A 19 GLU HGy 1.0 . 3.18 2911 2581 A 19 GLU HA A 19 GLU HGx 1.0 . 3.18 2912 2582 A 20 ARG H A 19 GLU HGy 1.0 . 4.41 2913 2582 A 20 ARG H A 19 GLU HGx 1.0 . 4.41 2914 2583 A 20 ARG H A 20 ARG HBy 1.0 . 3.05 2915 2583 A 20 ARG H A 20 ARG HBx 1.0 . 3.05 2916 2584 A 20 ARG H A 20 ARG HGy 1.0 . 3.07 2917 2584 A 20 ARG H A 20 ARG HGx 1.0 . 3.07 2918 2585 A 20 ARG H A 20 ARG HDx 1.0 . 4.68 2919 2585 A 20 ARG H A 20 ARG HDy 1.0 . 4.68 2920 2586 A 20 ARG HE A 20 ARG HBy 1.0 . 4.72 2921 2586 A 20 ARG HBx A 20 ARG HE 1.0 . 4.72 2922 2587 A 23 ASP H A 20 ARG HBy 1.0 . 4.49 2923 2587 A 23 ASP H A 20 ARG HBx 1.0 . 4.49 2924 2588 A 21 ILE H A 20 ARG HGy 1.0 . 4.58 2925 2588 A 21 ILE H A 20 ARG HGx 1.0 . 4.58 2926 2589 A 23 ASP H A 20 ARG HGy 1.0 . 5.34 2927 2589 A 23 ASP H A 20 ARG HGx 1.0 . 5.34 2928 2590 A 21 ILE H A 21 ILE HG1x 1.0 . 3.68 2929 2590 A 21 ILE H A 21 ILE HG1y 1.0 . 3.68 2930 2591 A 21 ILE HA A 21 ILE HG1x 1.0 . 3.56 2931 2591 A 21 ILE HA A 21 ILE HG1y 1.0 . 3.56 2932 2592 A 21 ILE HA A 50 LEU HDy% 1.0 . 4.95 2933 2592 A 21 ILE HA A 50 LEU HDx% 1.0 . 4.95 2934 2593 A 21 ILE HG2% A 21 ILE HG1x 1.0 . 2.91 2935 2593 A 21 ILE HG2% A 21 ILE HG1y 1.0 . 2.91 2936 2594 A 21 ILE HG2% A 30 PRO HBy 1.0 . 3.61 2937 2594 A 21 ILE HG2% A 30 PRO HBx 1.0 . 3.61 2938 2595 A 21 ILE HG2% A 30 PRO HDy 1.0 . 4.21 2939 2595 A 21 ILE HG2% A 30 PRO HDx 1.0 . 4.21 2940 2596 A 22 ALA H A 21 ILE HG1x 1.0 . 4.97 2941 2596 A 22 ALA H A 21 ILE HG1y 1.0 . 4.97 2942 2597 A 25 PHE HD% A 21 ILE HG1x 1.0 . 3.91 2943 2597 A 25 PHE HD% A 21 ILE HG1y 1.0 . 3.91 2944 2598 A 21 ILE HG1y A 50 LEU HDy% 1.0 . 3.66 2945 2598 A 21 ILE HG1x A 50 LEU HDy% 1.0 . 3.66 2946 2598 A 50 LEU HDx% A 21 ILE HG1x 1.0 . 3.66 2947 2598 A 21 ILE HG1y A 50 LEU HDx% 1.0 . 3.66 2948 2599 A 21 ILE HD1% A 50 LEU HDy% 1.0 . 3.20 2949 2599 A 21 ILE HD1% A 50 LEU HDx% 1.0 . 3.20 2950 2600 A 23 ASP H A 24 ARG HBy 1.0 . 4.40 2951 2600 A 23 ASP H A 24 ARG HBx 1.0 . 4.40 2952 2601 A 24 ARG H A 24 ARG HBy 1.0 . 3.13 2953 2601 A 24 ARG H A 24 ARG HBx 1.0 . 3.13 2954 2602 A 24 ARG H A 24 ARG HGy 1.0 . 3.82 2955 2602 A 24 ARG H A 24 ARG HGx 1.0 . 3.82 2956 2603 A 24 ARG H A 24 ARG HDx 1.0 . 4.83 2957 2603 A 24 ARG H A 24 ARG HDy 1.0 . 4.83 2958 2604 A 24 ARG HA A 24 ARG HGy 1.0 . 3.55 2959 2604 A 24 ARG HA A 24 ARG HGx 1.0 . 3.55 2960 2605 A 24 ARG HA A 24 ARG HDx 1.0 . 3.90 2961 2605 A 24 ARG HA A 24 ARG HDy 1.0 . 3.90 2962 2606 A 24 ARG HA A 26 PRO HDy 1.0 . 4.58 2963 2606 A 24 ARG HA A 26 PRO HDx 1.0 . 4.58 2964 2607 A 25 PHE HBx A 24 ARG HBy 1.0 . 5.34 2965 2607 A 25 PHE HBx A 24 ARG HBx 1.0 . 5.34 2966 2608 A 25 PHE HE% A 24 ARG HBy 1.0 . 5.22 2967 2608 A 25 PHE HE% A 24 ARG HBx 1.0 . 5.22 2968 2609 A 25 PHE HD% A 24 ARG HGy 1.0 . 4.81 2969 2609 A 25 PHE HD% A 24 ARG HGx 1.0 . 4.81 2970 2610 A 25 PHE H A 26 PRO HDy 1.0 . 3.84 2971 2610 A 25 PHE H A 26 PRO HDx 1.0 . 3.84 2972 2611 A 25 PHE HA A 26 PRO HGx 1.0 . 4.20 2973 2611 A 25 PHE HA A 26 PRO HGy 1.0 . 4.20 2974 2612 A 25 PHE HA A 26 PRO HDy 1.0 . 3.12 2975 2612 A 25 PHE HA A 26 PRO HDx 1.0 . 3.12 2976 2613 A 25 PHE HBy A 50 LEU HDy% 1.0 . 4.74 2977 2613 A 25 PHE HBy A 50 LEU HDx% 1.0 . 4.74 2978 2614 A 25 PHE HD% A 50 LEU HDy% 1.0 . 3.68 2979 2614 A 25 PHE HD% A 50 LEU HDx% 1.0 . 3.68 2980 2615 A 27 ASN H A 26 PRO HGx 1.0 . 4.10 2981 2615 A 27 ASN H A 26 PRO HGy 1.0 . 4.10 2982 2616 A 27 ASN HD2y A 26 PRO HGx 1.0 . 4.73 2983 2616 A 27 ASN HD2y A 26 PRO HGy 1.0 . 4.73 2984 2617 A 27 ASN HD2x A 26 PRO HGx 1.0 . 4.54 2985 2617 A 27 ASN HD2x A 26 PRO HGy 1.0 . 4.54 2986 2618 A 27 ASN H A 26 PRO HDy 1.0 . 3.98 2987 2618 A 27 ASN H A 26 PRO HDx 1.0 . 3.98 2988 2619 A 27 ASN H A 27 ASN HBy 1.0 . 3.19 2989 2619 A 27 ASN H A 27 ASN HBx 1.0 . 3.19 2990 2620 A 27 ASN HD2x A 27 ASN HBy 1.0 . 3.37 2991 2620 A 27 ASN HD2x A 27 ASN HBx 1.0 . 3.37 2992 2621 A 53 ALA H A 27 ASN HBy 1.0 . 4.87 2993 2621 A 53 ALA H A 27 ASN HBx 1.0 . 4.87 2994 2622 A 53 ALA HB% A 27 ASN HBy 1.0 . 3.83 2995 2622 A 53 ALA HB% A 27 ASN HBx 1.0 . 3.83 2996 2623 A 28 ARG H A 28 ARG HDx 1.0 . 4.97 2997 2623 A 28 ARG H A 28 ARG HDy 1.0 . 4.97 2998 2624 A 28 ARG HBx A 28 ARG HDx 1.0 . 3.57 2999 2624 A 28 ARG HBx A 28 ARG HDy 1.0 . 3.57 3000 2625 A 28 ARG HBx A 50 LEU HDy% 1.0 . 4.23 3001 2625 A 28 ARG HBx A 50 LEU HDx% 1.0 . 4.23 3002 2626 A 28 ARG HBy A 28 ARG HDx 1.0 . 3.71 3003 2626 A 28 ARG HBy A 28 ARG HDy 1.0 . 3.71 3004 2627 A 28 ARG HGx A 50 LEU HDy% 1.0 . 4.56 3005 2627 A 28 ARG HGy A 50 LEU HDy% 1.0 . 4.56 3006 2627 A 50 LEU HDx% A 28 ARG HGx 1.0 . 4.56 3007 2627 A 28 ARG HGy A 50 LEU HDx% 1.0 . 4.56 3008 2628 A 29 ILE H A 28 ARG HDx 1.0 . 4.15 3009 2628 A 29 ILE H A 28 ARG HDy 1.0 . 4.15 3010 2629 A 52 PRO HA A 28 ARG HDx 1.0 . 3.71 3011 2629 A 52 PRO HA A 28 ARG HDy 1.0 . 3.71 3012 2630 A 53 ALA H A 28 ARG HDx 1.0 . 4.53 3013 2630 A 53 ALA H A 28 ARG HDy 1.0 . 4.53 3014 2631 A 29 ILE H A 51 VAL HGy% 1.0 . 4.63 3015 2631 A 29 ILE H A 51 VAL HGx% 1.0 . 4.63 3016 2632 A 29 ILE HA A 30 PRO HDy 1.0 . 3.08 3017 2632 A 29 ILE HA A 30 PRO HDx 1.0 . 3.08 3018 2633 A 29 ILE HB A 51 VAL HGy% 1.0 . 4.52 3019 2633 A 29 ILE HB A 51 VAL HGx% 1.0 . 4.52 3020 2634 A 29 ILE HG2% A 30 PRO HDy 1.0 . 3.53 3021 2634 A 29 ILE HG2% A 30 PRO HDx 1.0 . 3.53 3022 2635 A 29 ILE HG2% A 31 VAL HGy% 1.0 . 3.12 3023 2635 A 29 ILE HG2% A 31 VAL HGx% 1.0 . 3.12 3024 2636 A 29 ILE HG2% A 51 VAL HGy% 1.0 . 3.46 3025 2636 A 29 ILE HG2% A 51 VAL HGx% 1.0 . 3.46 3026 2637 A 29 ILE HG2% A 105 LEU HDy% 1.0 . 4.23 3027 2637 A 29 ILE HG2% A 105 LEU HDx% 1.0 . 4.23 3028 2638 A 29 ILE HD1% A 30 PRO HDy 1.0 . 4.07 3029 2638 A 29 ILE HD1% A 30 PRO HDx 1.0 . 4.07 3030 2639 A 29 ILE HD1% A 51 VAL HGy% 1.0 . 4.97 3031 2639 A 29 ILE HD1% A 51 VAL HGx% 1.0 . 4.97 3032 2640 A 29 ILE HD1% A 105 LEU HDy% 1.0 . 5.44 3033 2640 A 29 ILE HD1% A 105 LEU HDx% 1.0 . 5.44 3034 2641 A 30 PRO HA A 31 VAL HGy% 1.0 . 4.12 3035 2641 A 30 PRO HA A 31 VAL HGx% 1.0 . 4.12 3036 2642 A 30 PRO HA A 50 LEU HDy% 1.0 . 4.32 3037 2642 A 30 PRO HA A 50 LEU HDx% 1.0 . 4.32 3038 2643 A 31 VAL H A 30 PRO HBy 1.0 . 3.98 3039 2643 A 31 VAL H A 30 PRO HBx 1.0 . 3.98 3040 2644 A 95 TYR HE% A 30 PRO HBy 1.0 . 5.03 3041 2644 A 95 TYR HE% A 30 PRO HBx 1.0 . 5.03 3042 2645 A 104 PHE HD% A 30 PRO HBy 1.0 . 3.51 3043 2645 A 104 PHE HD% A 30 PRO HBx 1.0 . 3.51 3044 2646 A 104 PHE HE% A 30 PRO HBy 1.0 . 3.73 3045 2646 A 104 PHE HE% A 30 PRO HBx 1.0 . 3.73 3046 2647 A 30 PRO HDy A 50 LEU HDy% 1.0 . 4.22 3047 2647 A 30 PRO HDx A 50 LEU HDy% 1.0 . 4.22 3048 2647 A 50 LEU HDx% A 30 PRO HDy 1.0 . 4.22 3049 2647 A 50 LEU HDx% A 30 PRO HDx 1.0 . 4.22 3050 2648 A 95 TYR HE% A 30 PRO HDy 1.0 . 3.79 3051 2648 A 95 TYR HE% A 30 PRO HDx 1.0 . 3.79 3052 2649 A 31 VAL H A 31 VAL HGy% 1.0 . 3.31 3053 2649 A 31 VAL H A 31 VAL HGx% 1.0 . 3.31 3054 2650 A 31 VAL H A 49 TYR HBy 1.0 . 4.10 3055 2650 A 31 VAL H A 49 TYR HBx 1.0 . 4.10 3056 2651 A 31 VAL H A 50 LEU HDy% 1.0 . 4.37 3057 2651 A 31 VAL H A 50 LEU HDx% 1.0 . 4.37 3058 2652 A 31 VAL H A 51 VAL HGy% 1.0 . 4.20 3059 2652 A 31 VAL H A 51 VAL HGx% 1.0 . 4.20 3060 2653 A 31 VAL HA A 105 LEU HDy% 1.0 . 4.96 3061 2653 A 31 VAL HA A 105 LEU HDx% 1.0 . 4.96 3062 2654 A 31 VAL HA A 107 VAL HGy% 1.0 . 4.63 3063 2654 A 31 VAL HA A 107 VAL HGx% 1.0 . 4.63 3064 2655 A 31 VAL HB A 49 TYR HBy 1.0 . 4.41 3065 2655 A 31 VAL HB A 49 TYR HBx 1.0 . 4.41 3066 2656 A 31 VAL HB A 51 VAL HGy% 1.0 . 3.67 3067 2656 A 31 VAL HB A 51 VAL HGx% 1.0 . 3.67 3068 2657 A 32 ILE H A 31 VAL HGy% 1.0 . 3.29 3069 2657 A 32 ILE H A 31 VAL HGx% 1.0 . 3.29 3070 2658 A 33 CYS H A 31 VAL HGy% 1.0 . 4.87 3071 2658 A 33 CYS H A 31 VAL HGx% 1.0 . 4.87 3072 2659 A 33 CYS HA A 31 VAL HGy% 1.0 . 4.51 3073 2659 A 33 CYS HA A 31 VAL HGx% 1.0 . 4.51 3074 2660 A 33 CYS HBx A 31 VAL HGy% 1.0 . 3.77 3075 2660 A 33 CYS HBx A 31 VAL HGx% 1.0 . 3.77 3076 2661 A 33 CYS HBy A 31 VAL HGy% 1.0 . 4.94 3077 2661 A 33 CYS HBy A 31 VAL HGx% 1.0 . 4.94 3078 2662 A 49 TYR H A 31 VAL HGy% 1.0 . 4.38 3079 2662 A 49 TYR H A 31 VAL HGx% 1.0 . 4.38 3080 2663 A 31 VAL HGy% A 49 TYR HBy 1.0 . 3.36 3081 2663 A 31 VAL HGx% A 49 TYR HBy 1.0 . 3.36 3082 2663 A 49 TYR HBx A 31 VAL HGy% 1.0 . 3.36 3083 2663 A 31 VAL HGx% A 49 TYR HBx 1.0 . 3.36 3084 2664 A 49 TYR HD% A 31 VAL HGy% 1.0 . 4.11 3085 2664 A 49 TYR HD% A 31 VAL HGx% 1.0 . 4.11 3086 2665 A 50 LEU HA A 31 VAL HGy% 1.0 . 4.58 3087 2665 A 50 LEU HA A 31 VAL HGx% 1.0 . 4.58 3088 2666 A 51 VAL H A 31 VAL HGy% 1.0 . 4.13 3089 2666 A 51 VAL H A 31 VAL HGx% 1.0 . 4.13 3090 2667 A 51 VAL HB A 31 VAL HGy% 1.0 . 4.46 3091 2667 A 51 VAL HB A 31 VAL HGx% 1.0 . 4.46 3092 2668 A 31 VAL HGx% A 51 VAL HGy% 1.0 . 2.76 3093 2668 A 31 VAL HGy% A 51 VAL HGy% 1.0 . 2.76 3094 2668 A 51 VAL HGx% A 31 VAL HGy% 1.0 . 2.76 3095 2668 A 51 VAL HGx% A 31 VAL HGx% 1.0 . 2.76 3096 2669 A 60 PHE HD% A 31 VAL HGy% 1.0 . 4.36 3097 2669 A 60 PHE HD% A 31 VAL HGx% 1.0 . 4.36 3098 2670 A 60 PHE HE% A 31 VAL HGy% 1.0 . 3.72 3099 2670 A 60 PHE HE% A 31 VAL HGx% 1.0 . 3.72 3100 2671 A 60 PHE HZ A 31 VAL HGy% 1.0 . 3.84 3101 2671 A 60 PHE HZ A 31 VAL HGx% 1.0 . 3.84 3102 2672 A 91 MET HE% A 31 VAL HGy% 1.0 . 2.53 3103 2672 A 91 MET HE% A 31 VAL HGx% 1.0 . 2.53 3104 2673 A 95 TYR HA A 31 VAL HGy% 1.0 . 4.72 3105 2673 A 95 TYR HA A 31 VAL HGx% 1.0 . 4.72 3106 2674 A 105 LEU H A 31 VAL HGy% 1.0 . 4.29 3107 2674 A 105 LEU H A 31 VAL HGx% 1.0 . 4.29 3108 2675 A 105 LEU HBx A 31 VAL HGy% 1.0 . 3.41 3109 2675 A 105 LEU HBx A 31 VAL HGx% 1.0 . 3.41 3110 2676 A 105 LEU HBy A 31 VAL HGy% 1.0 . 3.26 3111 2676 A 105 LEU HBy A 31 VAL HGx% 1.0 . 3.26 3112 2677 A 105 LEU HG A 31 VAL HGy% 1.0 . 3.83 3113 2677 A 105 LEU HG A 31 VAL HGx% 1.0 . 3.83 3114 2678 A 31 VAL HGy% A 105 LEU HDy% 1.0 . 3.95 3115 2678 A 105 LEU HDx% A 31 VAL HGy% 1.0 . 3.95 3116 2678 A 31 VAL HGx% A 105 LEU HDx% 1.0 . 3.95 3117 2678 A 31 VAL HGx% A 105 LEU HDy% 1.0 . 3.95 3118 2679 A 106 TYR HA A 31 VAL HGy% 1.0 . 5.44 3119 2679 A 106 TYR HA A 31 VAL HGx% 1.0 . 5.44 3120 2680 A 107 VAL H A 31 VAL HGy% 1.0 . 4.02 3121 2680 A 107 VAL H A 31 VAL HGx% 1.0 . 4.02 3122 2681 A 107 VAL HB A 31 VAL HGy% 1.0 . 4.49 3123 2681 A 107 VAL HB A 31 VAL HGx% 1.0 . 4.49 3124 2682 A 31 VAL HGy% A 107 VAL HGy% 1.0 . 3.94 3125 2682 A 31 VAL HGx% A 107 VAL HGy% 1.0 . 3.94 3126 2682 A 107 VAL HGx% A 31 VAL HGy% 1.0 . 3.94 3127 2682 A 31 VAL HGx% A 107 VAL HGx% 1.0 . 3.94 3128 2683 A 32 ILE H A 32 ILE HG1x 1.0 . 3.61 3129 2683 A 32 ILE H A 32 ILE HG1y 1.0 . 3.61 3130 2684 A 32 ILE H A 105 LEU HDy% 1.0 . 5.44 3131 2684 A 32 ILE H A 105 LEU HDx% 1.0 . 5.44 3132 2685 A 32 ILE H A 107 VAL HGy% 1.0 . 4.29 3133 2685 A 32 ILE H A 107 VAL HGx% 1.0 . 4.29 3134 2686 A 32 ILE HG2% A 47 ARG HBy 1.0 . 3.54 3135 2686 A 32 ILE HG2% A 47 ARG HBx 1.0 . 3.54 3136 2687 A 32 ILE HG2% A 47 ARG HGy 1.0 . 4.21 3137 2687 A 32 ILE HG2% A 47 ARG HGx 1.0 . 4.21 3138 2688 A 32 ILE HG2% A 47 ARG HDx 1.0 . 3.79 3139 2688 A 32 ILE HG2% A 47 ARG HDy 1.0 . 3.79 3140 2689 A 104 PHE HD% A 32 ILE HG1x 1.0 . 4.86 3141 2689 A 104 PHE HD% A 32 ILE HG1y 1.0 . 4.86 3142 2690 A 106 TYR HD% A 32 ILE HG1x 1.0 . 4.19 3143 2690 A 106 TYR HD% A 32 ILE HG1y 1.0 . 4.19 3144 2691 A 32 ILE HD1% A 48 LYS HBy 1.0 . 3.83 3145 2691 A 32 ILE HD1% A 48 LYS HBx 1.0 . 3.83 3146 2692 A 32 ILE HD1% A 48 LYS HGx 1.0 . 4.23 3147 2692 A 32 ILE HD1% A 48 LYS HGy 1.0 . 4.23 3148 2693 A 32 ILE HD1% A 104 PHE HBx 1.0 . 5.09 3149 2693 A 32 ILE HD1% A 104 PHE HBy 1.0 . 5.09 3150 2694 A 33 CYS H A 34 GLU HBy 1.0 . 5.34 3151 2694 A 33 CYS H A 34 GLU HBx 1.0 . 5.34 3152 2695 A 33 CYS H A 107 VAL HGy% 1.0 . 5.09 3153 2695 A 33 CYS H A 107 VAL HGx% 1.0 . 5.09 3154 2696 A 33 CYS HA A 107 VAL HGy% 1.0 . 3.42 3155 2696 A 33 CYS HA A 107 VAL HGx% 1.0 . 3.42 3156 2697 A 33 CYS HBx A 107 VAL HGy% 1.0 . 3.93 3157 2697 A 33 CYS HBx A 107 VAL HGx% 1.0 . 3.93 3158 2698 A 33 CYS HBy A 107 VAL HGy% 1.0 . 4.60 3159 2698 A 33 CYS HBy A 107 VAL HGx% 1.0 . 4.60 3160 2699 A 33 CYS HG A 107 VAL HGy% 1.0 . 3.70 3161 2699 A 33 CYS HG A 107 VAL HGx% 1.0 . 3.70 3162 2700 A 34 GLU H A 107 VAL HGy% 1.0 . 3.99 3163 2700 A 34 GLU H A 107 VAL HGx% 1.0 . 3.99 3164 2701 A 35 LYS H A 34 GLU HBy 1.0 . 3.43 3165 2701 A 35 LYS H A 34 GLU HBx 1.0 . 3.43 3166 2702 A 36 ALA H A 34 GLU HBy 1.0 . 5.34 3167 2702 A 36 ALA H A 34 GLU HBx 1.0 . 5.34 3168 2703 A 34 GLU HBx A 47 ARG HDx 1.0 . 5.18 3169 2703 A 34 GLU HBy A 47 ARG HDx 1.0 . 5.18 3170 2703 A 47 ARG HDy A 34 GLU HBy 1.0 . 5.18 3171 2703 A 47 ARG HDy A 34 GLU HBx 1.0 . 5.18 3172 2704 A 108 THR HG2% A 34 GLU HBy 1.0 . 3.62 3173 2704 A 108 THR HG2% A 34 GLU HBx 1.0 . 3.62 3174 2705 A 35 LYS H A 35 LYS HGy 1.0 . 4.30 3175 2705 A 35 LYS H A 35 LYS HGx 1.0 . 4.30 3176 2706 A 35 LYS HA A 35 LYS HGy 1.0 . 3.71 3177 2706 A 35 LYS HA A 35 LYS HGx 1.0 . 3.71 3178 2707 A 36 ALA H A 35 LYS HBy 1.0 . 3.96 3179 2707 A 36 ALA H A 35 LYS HBx 1.0 . 3.96 3180 2708 A 109 TYR HE% A 35 LYS HBy 1.0 . 4.58 3181 2708 A 109 TYR HE% A 35 LYS HBx 1.0 . 4.58 3182 2709 A 35 LYS HEx A 35 LYS HGy 1.0 . 2.97 3183 2709 A 35 LYS HEy A 35 LYS HGy 1.0 . 2.97 3184 2709 A 35 LYS HGx A 35 LYS HEx 1.0 . 2.97 3185 2709 A 35 LYS HEy A 35 LYS HGx 1.0 . 2.97 3186 2710 A 36 ALA H A 35 LYS HGy 1.0 . 3.78 3187 2710 A 36 ALA H A 35 LYS HGx 1.0 . 3.78 3188 2711 A 41 ILE HG1x A 35 LYS HGy 1.0 . 3.92 3189 2711 A 41 ILE HG1x A 35 LYS HGx 1.0 . 3.92 3190 2712 A 35 LYS HGx A 43 GLU HGx 1.0 . 4.78 3191 2712 A 35 LYS HGy A 43 GLU HGx 1.0 . 4.78 3192 2712 A 43 GLU HGy A 35 LYS HGy 1.0 . 4.78 3193 2712 A 43 GLU HGy A 35 LYS HGx 1.0 . 4.78 3194 2713 A 109 TYR HE% A 35 LYS HGy 1.0 . 4.67 3195 2713 A 109 TYR HE% A 35 LYS HGx 1.0 . 4.67 3196 2714 A 35 LYS HDy A 39 SER HBy 1.0 . 4.27 3197 2714 A 35 LYS HDy A 39 SER HBx 1.0 . 4.27 3198 2715 A 36 ALA H A 39 SER HBy 1.0 . 3.73 3199 2715 A 36 ALA H A 39 SER HBx 1.0 . 3.73 3200 2716 A 36 ALA HB% A 39 SER HBy 1.0 . 3.37 3201 2716 A 36 ALA HB% A 39 SER HBx 1.0 . 3.37 3202 2717 A 36 ALA HB% A 110 SER HBy 1.0 . 3.11 3203 2717 A 36 ALA HB% A 110 SER HBx 1.0 . 3.11 3204 2718 A 37 GLU HBx A 38 LYS HGx 1.0 . 4.97 3205 2718 A 37 GLU HBx A 38 LYS HGy 1.0 . 4.97 3206 2719 A 37 GLU HBy A 37 GLU HGy 1.0 . 2.65 3207 2719 A 37 GLU HBy A 37 GLU HGx 1.0 . 2.65 3208 2720 A 37 GLU HGx A 38 LYS HBx 1.0 . 4.59 3209 2720 A 37 GLU HGy A 38 LYS HBx 1.0 . 4.59 3210 2720 A 38 LYS HBy A 37 GLU HGy 1.0 . 4.59 3211 2720 A 37 GLU HGx A 38 LYS HBy 1.0 . 4.59 3212 2721 A 37 GLU HGy A 38 LYS HGx 1.0 . 3.13 3213 2721 A 37 GLU HGx A 38 LYS HGx 1.0 . 3.13 3214 2721 A 38 LYS HGy A 37 GLU HGy 1.0 . 3.13 3215 2721 A 38 LYS HGy A 37 GLU HGx 1.0 . 3.13 3216 2722 A 38 LYS H A 38 LYS HBx 1.0 . 3.04 3217 2722 A 38 LYS H A 38 LYS HBy 1.0 . 3.04 3218 2723 A 38 LYS HA A 38 LYS HGx 1.0 . 3.03 3219 2723 A 38 LYS HA A 38 LYS HGy 1.0 . 3.03 3220 2724 A 38 LYS HBy A 38 LYS HEx 1.0 . 4.10 3221 2724 A 38 LYS HBx A 38 LYS HEx 1.0 . 4.10 3222 2724 A 38 LYS HEy A 38 LYS HBx 1.0 . 4.10 3223 2724 A 38 LYS HEy A 38 LYS HBy 1.0 . 4.10 3224 2725 A 39 SER H A 38 LYS HBx 1.0 . 3.62 3225 2725 A 39 SER H A 38 LYS HBy 1.0 . 3.62 3226 2726 A 38 LYS HEx A 38 LYS HGx 1.0 . 2.96 3227 2726 A 38 LYS HEy A 38 LYS HGx 1.0 . 2.96 3228 2726 A 38 LYS HGy A 38 LYS HEx 1.0 . 2.96 3229 2726 A 38 LYS HEy A 38 LYS HGy 1.0 . 2.96 3230 2727 A 39 SER H A 38 LYS HGx 1.0 . 4.30 3231 2727 A 39 SER H A 38 LYS HGy 1.0 . 4.30 3232 2728 A 39 SER H A 39 SER HBy 1.0 . 2.74 3233 2728 A 39 SER H A 39 SER HBx 1.0 . 2.74 3234 2729 A 39 SER H A 112 GLU HGx 1.0 . 5.34 3235 2729 A 39 SER H A 112 GLU HGy 1.0 . 5.34 3236 2730 A 39 SER HA A 112 GLU HBx 1.0 . 4.76 3237 2730 A 39 SER HA A 112 GLU HBy 1.0 . 4.76 3238 2731 A 41 ILE H A 39 SER HBy 1.0 . 3.71 3239 2731 A 41 ILE H A 39 SER HBx 1.0 . 3.71 3240 2732 A 41 ILE HG2% A 39 SER HBy 1.0 . 3.48 3241 2732 A 41 ILE HG2% A 39 SER HBx 1.0 . 3.48 3242 2733 A 111 GLY H A 39 SER HBy 1.0 . 3.73 3243 2733 A 111 GLY H A 39 SER HBx 1.0 . 3.73 3244 2734 A 41 ILE HB A 70 LEU HDy% 1.0 . 3.15 3245 2734 A 41 ILE HB A 70 LEU HDx% 1.0 . 3.15 3246 2735 A 41 ILE HG1y A 70 LEU HDy% 1.0 . 4.09 3247 2735 A 41 ILE HG1y A 70 LEU HDx% 1.0 . 4.09 3248 2736 A 42 PRO HA A 43 GLU HBy 1.0 . 4.25 3249 2736 A 42 PRO HA A 43 GLU HBx 1.0 . 4.25 3250 2737 A 43 GLU H A 42 PRO HBy 1.0 . 3.72 3251 2737 A 43 GLU H A 42 PRO HBx 1.0 . 3.72 3252 2738 A 68 ILE HG2% A 42 PRO HBy 1.0 . 3.86 3253 2738 A 68 ILE HG2% A 42 PRO HBx 1.0 . 3.86 3254 2739 A 68 ILE HD1% A 42 PRO HGx 1.0 . 3.85 3255 2739 A 68 ILE HD1% A 42 PRO HGy 1.0 . 3.85 3256 2740 A 42 PRO HDx A 70 LEU HBy 1.0 . 5.34 3257 2740 A 42 PRO HDx A 70 LEU HBx 1.0 . 5.34 3258 2741 A 42 PRO HDx A 70 LEU HDy% 1.0 . 3.43 3259 2741 A 42 PRO HDx A 70 LEU HDx% 1.0 . 3.43 3260 2742 A 42 PRO HDy A 70 LEU HDy% 1.0 . 3.74 3261 2742 A 42 PRO HDy A 70 LEU HDx% 1.0 . 3.74 3262 2743 A 43 GLU H A 43 GLU HBy 1.0 . 2.83 3263 2743 A 43 GLU H A 43 GLU HBx 1.0 . 2.83 3264 2744 A 44 ILE HA A 43 GLU HBy 1.0 . 5.34 3265 2744 A 44 ILE HA A 43 GLU HBx 1.0 . 5.34 3266 2745 A 46 LYS H A 46 LYS HGx 1.0 . 4.38 3267 2745 A 46 LYS H A 46 LYS HGy 1.0 . 4.38 3268 2746 A 46 LYS H A 46 LYS HDx 1.0 . 3.49 3269 2746 A 46 LYS H A 46 LYS HDy 1.0 . 3.49 3270 2747 A 46 LYS HA A 46 LYS HGx 1.0 . 3.68 3271 2747 A 46 LYS HA A 46 LYS HGy 1.0 . 3.68 3272 2748 A 46 LYS HA A 46 LYS HDx 1.0 . 4.71 3273 2748 A 46 LYS HA A 46 LYS HDy 1.0 . 4.71 3274 2749 A 46 LYS HBx A 46 LYS HEy 1.0 . 3.85 3275 2749 A 46 LYS HBy A 46 LYS HEy 1.0 . 3.85 3276 2749 A 46 LYS HEx A 46 LYS HBx 1.0 . 3.85 3277 2749 A 46 LYS HBy A 46 LYS HEx 1.0 . 3.85 3278 2750 A 46 LYS HEx A 46 LYS HGx 1.0 . 3.36 3279 2750 A 46 LYS HEy A 46 LYS HGx 1.0 . 3.36 3280 2750 A 46 LYS HGy A 46 LYS HEy 1.0 . 3.36 3281 2750 A 46 LYS HGy A 46 LYS HEx 1.0 . 3.36 3282 2751 A 48 LYS H A 46 LYS HGx 1.0 . 5.34 3283 2751 A 48 LYS H A 46 LYS HGy 1.0 . 5.34 3284 2752 B 621 TRP HE3 A 46 LYS HGx 1.0 . 5.34 3285 2752 A 46 LYS HGy B 621 TRP HE3 1.0 . 5.34 3286 2753 B 621 TRP HZ3 A 46 LYS HGx 1.0 . 4.41 3287 2753 A 46 LYS HGy B 621 TRP HZ3 1.0 . 4.41 3288 2754 B 621 TRP HZ2 A 46 LYS HGx 1.0 . 4.36 3289 2754 A 46 LYS HGy B 621 TRP HZ2 1.0 . 4.36 3290 2755 B 621 TRP HH2 A 46 LYS HGx 1.0 . 3.93 3291 2755 A 46 LYS HGy B 621 TRP HH2 1.0 . 3.93 3292 2756 A 49 TYR HE% A 46 LYS HDx 1.0 . 4.51 3293 2756 A 49 TYR HE% A 46 LYS HDy 1.0 . 4.51 3294 2757 A 49 TYR HE% A 46 LYS HEy 1.0 . 5.26 3295 2757 A 49 TYR HE% A 46 LYS HEx 1.0 . 5.26 3296 2758 A 47 ARG HA A 47 ARG HGy 1.0 . 3.65 3297 2758 A 47 ARG HA A 47 ARG HGx 1.0 . 3.65 3298 2759 A 49 TYR HE% A 47 ARG HBy 1.0 . 5.25 3299 2759 A 49 TYR HE% A 47 ARG HBx 1.0 . 5.25 3300 2760 A 48 LYS H A 47 ARG HGy 1.0 . 5.09 3301 2760 A 48 LYS H A 47 ARG HGx 1.0 . 5.09 3302 2761 A 106 TYR HD% A 47 ARG HDx 1.0 . 5.34 3303 2761 A 106 TYR HD% A 47 ARG HDy 1.0 . 5.34 3304 2762 A 48 LYS H A 48 LYS HGx 1.0 . 4.75 3305 2762 A 48 LYS H A 48 LYS HGy 1.0 . 4.75 3306 2763 A 48 LYS H A 48 LYS HDy 1.0 . 4.71 3307 2763 A 48 LYS H A 48 LYS HDx 1.0 . 4.71 3308 2764 A 48 LYS HBx A 48 LYS HEx 1.0 . 4.42 3309 2764 A 48 LYS HBy A 48 LYS HEx 1.0 . 4.42 3310 2764 A 48 LYS HEy A 48 LYS HBy 1.0 . 4.42 3311 2764 A 48 LYS HEy A 48 LYS HBx 1.0 . 4.42 3312 2765 A 49 TYR H A 48 LYS HBy 1.0 . 4.14 3313 2765 A 49 TYR H A 48 LYS HBx 1.0 . 4.14 3314 2766 B 621 TRP HZ2 A 48 LYS HBy 1.0 . 4.20 3315 2766 A 48 LYS HBx B 621 TRP HZ2 1.0 . 4.20 3316 2767 B 621 TRP HH2 A 48 LYS HBy 1.0 . 4.15 3317 2767 A 48 LYS HBx B 621 TRP HH2 1.0 . 4.15 3318 2768 A 49 TYR H A 48 LYS HGx 1.0 . 4.67 3319 2768 A 49 TYR H A 48 LYS HGy 1.0 . 4.67 3320 2769 B 619 PHE HD% A 48 LYS HGx 1.0 . 4.24 3321 2769 B 619 PHE HD% A 48 LYS HGy 1.0 . 4.24 3322 2770 B 621 TRP HH2 A 48 LYS HGx 1.0 . 4.68 3323 2770 A 48 LYS HGy B 621 TRP HH2 1.0 . 4.68 3324 2771 A 104 PHE HE% A 48 LYS HDy 1.0 . 4.05 3325 2771 A 104 PHE HE% A 48 LYS HDx 1.0 . 4.05 3326 2772 B 619 PHE HE% A 48 LYS HDy 1.0 . 4.27 3327 2772 A 48 LYS HDx B 619 PHE HE% 1.0 . 4.27 3328 2773 A 48 LYS HEx A 50 LEU HDy% 1.0 . 3.86 3329 2773 A 48 LYS HEy A 50 LEU HDy% 1.0 . 3.86 3330 2773 A 50 LEU HDx% A 48 LYS HEx 1.0 . 3.86 3331 2773 A 48 LYS HEy A 50 LEU HDx% 1.0 . 3.86 3332 2774 A 49 TYR HBx A 51 VAL HGy% 1.0 . 3.51 3333 2774 A 49 TYR HBy A 51 VAL HGy% 1.0 . 3.51 3334 2774 A 51 VAL HGx% A 49 TYR HBy 1.0 . 3.51 3335 2774 A 51 VAL HGx% A 49 TYR HBx 1.0 . 3.51 3336 2775 A 49 TYR HD% A 63 VAL HGy% 1.0 . 3.79 3337 2775 A 49 TYR HD% A 63 VAL HGx% 1.0 . 3.79 3338 2776 A 49 TYR HE% A 63 VAL HGy% 1.0 . 4.34 3339 2776 A 49 TYR HE% A 63 VAL HGx% 1.0 . 4.34 3340 2777 A 50 LEU H A 50 LEU HDy% 1.0 . 4.40 3341 2777 A 50 LEU H A 50 LEU HDx% 1.0 . 4.40 3342 2778 A 50 LEU HA A 50 LEU HDy% 1.0 . 3.36 3343 2778 A 50 LEU HA A 50 LEU HDx% 1.0 . 3.36 3344 2779 A 50 LEU HA A 51 VAL HGy% 1.0 . 4.23 3345 2779 A 50 LEU HA A 51 VAL HGx% 1.0 . 4.23 3346 2780 A 50 LEU HBx A 50 LEU HDy% 1.0 . 2.81 3347 2780 A 50 LEU HBy A 50 LEU HDy% 1.0 . 2.81 3348 2780 A 50 LEU HDx% A 50 LEU HBx 1.0 . 2.81 3349 2780 A 50 LEU HDx% A 50 LEU HBy 1.0 . 2.81 3350 2781 A 51 VAL H A 50 LEU HBx 1.0 . 4.68 3351 2781 A 51 VAL H A 50 LEU HBy 1.0 . 4.68 3352 2782 A 51 VAL H A 50 LEU HDy% 1.0 . 4.41 3353 2782 A 51 VAL H A 50 LEU HDx% 1.0 . 4.41 3354 2783 A 104 PHE HE% A 50 LEU HDy% 1.0 . 4.40 3355 2783 A 104 PHE HE% A 50 LEU HDx% 1.0 . 4.40 3356 2784 A 51 VAL H A 51 VAL HGy% 1.0 . 3.22 3357 2784 A 51 VAL H A 51 VAL HGx% 1.0 . 3.22 3358 2785 A 51 VAL HA A 55 LEU HDy% 1.0 . 4.69 3359 2785 A 51 VAL HA A 55 LEU HDx% 1.0 . 4.69 3360 2786 A 52 PRO HA A 51 VAL HGy% 1.0 . 4.31 3361 2786 A 52 PRO HA A 51 VAL HGx% 1.0 . 4.31 3362 2787 A 55 LEU HG A 51 VAL HGy% 1.0 . 4.36 3363 2787 A 55 LEU HG A 51 VAL HGx% 1.0 . 4.36 3364 2788 A 51 VAL HGx% A 60 PHE HBy 1.0 . 4.63 3365 2788 A 51 VAL HGy% A 60 PHE HBy 1.0 . 4.63 3366 2788 A 60 PHE HBx A 51 VAL HGy% 1.0 . 4.63 3367 2788 A 51 VAL HGx% A 60 PHE HBx 1.0 . 4.63 3368 2789 A 60 PHE HD% A 51 VAL HGy% 1.0 . 3.44 3369 2789 A 60 PHE HD% A 51 VAL HGx% 1.0 . 3.44 3370 2790 A 60 PHE HE% A 51 VAL HGy% 1.0 . 3.59 3371 2790 A 60 PHE HE% A 51 VAL HGx% 1.0 . 3.59 3372 2791 A 60 PHE HZ A 51 VAL HGy% 1.0 . 4.00 3373 2791 A 60 PHE HZ A 51 VAL HGx% 1.0 . 4.00 3374 2792 A 51 VAL HGx% A 91 MET HGx 1.0 . 3.48 3375 2792 A 51 VAL HGy% A 91 MET HGx 1.0 . 3.48 3376 2792 A 91 MET HGy A 51 VAL HGy% 1.0 . 3.48 3377 2792 A 51 VAL HGx% A 91 MET HGy 1.0 . 3.48 3378 2793 A 91 MET HE% A 51 VAL HGy% 1.0 . 2.52 3379 2793 A 91 MET HE% A 51 VAL HGx% 1.0 . 2.52 3380 2794 A 54 ASP H A 54 ASP HBx 1.0 . 3.22 3381 2794 A 54 ASP H A 54 ASP HBy 1.0 . 3.22 3382 2795 A 54 ASP H A 55 LEU HDy% 1.0 . 5.13 3383 2795 A 54 ASP H A 55 LEU HDx% 1.0 . 5.13 3384 2796 A 54 ASP H A 90 LEU HDy% 1.0 . 5.39 3385 2796 A 54 ASP H A 90 LEU HDx% 1.0 . 5.39 3386 2797 A 55 LEU H A 54 ASP HBx 1.0 . 3.93 3387 2797 A 55 LEU H A 54 ASP HBy 1.0 . 3.93 3388 2798 A 54 ASP HBx A 55 LEU HDy% 1.0 . 4.47 3389 2798 A 54 ASP HBy A 55 LEU HDy% 1.0 . 4.47 3390 2798 A 55 LEU HDx% A 54 ASP HBx 1.0 . 4.47 3391 2798 A 55 LEU HDx% A 54 ASP HBy 1.0 . 4.47 3392 2799 A 54 ASP HBy A 90 LEU HDy% 1.0 . 4.64 3393 2799 A 54 ASP HBx A 90 LEU HDy% 1.0 . 4.64 3394 2799 A 90 LEU HDx% A 54 ASP HBx 1.0 . 4.64 3395 2799 A 54 ASP HBy A 90 LEU HDx% 1.0 . 4.64 3396 2800 A 55 LEU H A 55 LEU HDy% 1.0 . 3.64 3397 2800 A 55 LEU H A 55 LEU HDx% 1.0 . 3.64 3398 2801 A 55 LEU H A 90 LEU HDy% 1.0 . 4.82 3399 2801 A 55 LEU H A 90 LEU HDx% 1.0 . 4.82 3400 2802 A 55 LEU HA A 55 LEU HDy% 1.0 . 3.02 3401 2802 A 55 LEU HA A 55 LEU HDx% 1.0 . 3.02 3402 2803 A 59 GLN HE2y A 55 LEU HA 1.0 . 4.75 3403 2803 A 59 GLN HE2x A 55 LEU HA 1.0 . 4.75 3404 2804 A 55 LEU HBx A 55 LEU HDy% 1.0 . 3.01 3405 2804 A 55 LEU HBx A 55 LEU HDx% 1.0 . 3.01 3406 2805 A 55 LEU HBx A 91 MET HGx 1.0 . 5.34 3407 2805 A 55 LEU HBx A 91 MET HGy 1.0 . 5.34 3408 2806 A 55 LEU HBy A 55 LEU HDy% 1.0 . 2.98 3409 2806 A 55 LEU HBy A 55 LEU HDx% 1.0 . 2.98 3410 2807 A 55 LEU HBy A 91 MET HGx 1.0 . 4.55 3411 2807 A 55 LEU HBy A 91 MET HGy 1.0 . 4.55 3412 2808 A 56 THR H A 55 LEU HDy% 1.0 . 3.53 3413 2808 A 56 THR H A 55 LEU HDx% 1.0 . 3.53 3414 2809 A 59 GLN H A 55 LEU HDy% 1.0 . 3.99 3415 2809 A 59 GLN H A 55 LEU HDx% 1.0 . 3.99 3416 2810 A 59 GLN HA A 55 LEU HDy% 1.0 . 4.58 3417 2810 A 59 GLN HA A 55 LEU HDx% 1.0 . 4.58 3418 2811 A 55 LEU HDx% A 59 GLN HBx 1.0 . 3.26 3419 2811 A 55 LEU HDy% A 59 GLN HBx 1.0 . 3.26 3420 2811 A 59 GLN HBy A 55 LEU HDy% 1.0 . 3.26 3421 2811 A 55 LEU HDx% A 59 GLN HBy 1.0 . 3.26 3422 2812 A 55 LEU HDy% A 59 GLN HGx 1.0 . 4.99 3423 2812 A 59 GLN HGy A 55 LEU HDy% 1.0 . 4.99 3424 2812 A 59 GLN HGy A 55 LEU HDx% 1.0 . 4.99 3425 2812 A 55 LEU HDx% A 59 GLN HGx 1.0 . 4.99 3426 2813 A 59 GLN HE2x A 55 LEU HDx% 1.0 . 3.89 3427 2813 A 59 GLN HE2y A 55 LEU HDx% 1.0 . 3.89 3428 2813 A 59 GLN HE2x A 55 LEU HDy% 1.0 . 3.89 3429 2813 A 59 GLN HE2y A 55 LEU HDy% 1.0 . 3.89 3430 2814 A 59 GLN HE2x A 55 LEU HDx% 1.0 . 6.29 3431 2815 A 59 GLN HE2y A 55 LEU HDy% 1.0 . 6.29 3432 2816 A 60 PHE H A 55 LEU HDy% 1.0 . 3.73 3433 2816 A 60 PHE H A 55 LEU HDx% 1.0 . 3.73 3434 2817 A 60 PHE HA A 55 LEU HDy% 1.0 . 3.39 3435 2817 A 60 PHE HA A 55 LEU HDx% 1.0 . 3.39 3436 2818 A 55 LEU HDy% A 60 PHE HBy 1.0 . 3.52 3437 2818 A 55 LEU HDx% A 60 PHE HBy 1.0 . 3.52 3438 2818 A 60 PHE HBx A 55 LEU HDy% 1.0 . 3.52 3439 2818 A 55 LEU HDx% A 60 PHE HBx 1.0 . 3.52 3440 2819 A 60 PHE HD% A 55 LEU HDy% 1.0 . 4.22 3441 2819 A 60 PHE HD% A 55 LEU HDx% 1.0 . 4.22 3442 2820 A 62 TYR H A 55 LEU HDy% 1.0 . 5.44 3443 2820 A 62 TYR H A 55 LEU HDx% 1.0 . 5.44 3444 2821 A 62 TYR HD% A 55 LEU HDy% 1.0 . 3.72 3445 2821 A 62 TYR HD% A 55 LEU HDx% 1.0 . 3.72 3446 2822 A 63 VAL H A 55 LEU HDy% 1.0 . 5.44 3447 2822 A 63 VAL H A 55 LEU HDx% 1.0 . 5.44 3448 2823 A 55 LEU HDy% A 91 MET HGx 1.0 . 3.80 3449 2823 A 55 LEU HDx% A 91 MET HGx 1.0 . 3.80 3450 2823 A 91 MET HGy A 55 LEU HDy% 1.0 . 3.80 3451 2823 A 55 LEU HDx% A 91 MET HGy 1.0 . 3.80 3452 2824 A 56 THR H A 59 GLN HBx 1.0 . 3.66 3453 2824 A 56 THR H A 59 GLN HBy 1.0 . 3.66 3454 2825 A 59 GLN HE2y A 56 THR H 1.0 . 4.49 3455 2825 A 59 GLN HE2x A 56 THR H 1.0 . 4.49 3456 2826 A 56 THR HA A 90 LEU HDy% 1.0 . 3.52 3457 2826 A 56 THR HA A 90 LEU HDx% 1.0 . 3.52 3458 2827 A 56 THR HA A 91 MET HGx 1.0 . 4.20 3459 2827 A 56 THR HA A 91 MET HGy 1.0 . 4.20 3460 2828 A 56 THR HB A 90 LEU HDy% 1.0 . 3.89 3461 2828 A 56 THR HB A 90 LEU HDx% 1.0 . 3.89 3462 2829 A 56 THR HG2% A 59 GLN HBx 1.0 . 3.77 3463 2829 A 56 THR HG2% A 59 GLN HBy 1.0 . 3.77 3464 2830 A 56 THR HG2% A 59 GLN HE2y 1.0 . 4.67 3465 2830 A 56 THR HG2% A 59 GLN HE2x 1.0 . 4.67 3466 2831 A 56 THR HG2% A 90 LEU HDy% 1.0 . 2.92 3467 2831 A 56 THR HG2% A 90 LEU HDx% 1.0 . 2.92 3468 2832 A 57 VAL H A 90 LEU HDy% 1.0 . 4.71 3469 2832 A 57 VAL H A 90 LEU HDx% 1.0 . 4.71 3470 2833 A 57 VAL HA A 60 PHE HBy 1.0 . 3.52 3471 2833 A 57 VAL HA A 60 PHE HBx 1.0 . 3.52 3472 2834 A 59 GLN H A 59 GLN HBx 1.0 . 3.17 3473 2834 A 59 GLN H A 59 GLN HBy 1.0 . 3.17 3474 2835 A 59 GLN HE2x A 59 GLN HBy 1.0 . 4.07 3475 2835 A 59 GLN HE2x A 59 GLN HBx 1.0 . 4.07 3476 2835 A 59 GLN HE2y A 59 GLN HBy 1.0 . 4.07 3477 2835 A 59 GLN HE2y A 59 GLN HBx 1.0 . 4.07 3478 2836 A 60 PHE H A 59 GLN HBx 1.0 . 3.53 3479 2836 A 60 PHE H A 59 GLN HBy 1.0 . 3.53 3480 2837 A 59 GLN HE2y A 59 GLN HGx 1.0 . 3.33 3481 2837 A 59 GLN HGy A 59 GLN HE2y 1.0 . 3.33 3482 2837 A 59 GLN HGy A 59 GLN HE2x 1.0 . 3.33 3483 2837 A 59 GLN HE2x A 59 GLN HGx 1.0 . 3.33 3484 2838 A 60 PHE HA A 63 VAL HGy% 1.0 . 3.45 3485 2838 A 60 PHE HA A 63 VAL HGx% 1.0 . 3.45 3486 2839 A 61 VAL H A 60 PHE HBy 1.0 . 3.52 3487 2839 A 61 VAL H A 60 PHE HBx 1.0 . 3.52 3488 2840 A 61 VAL HGy% A 60 PHE HBy 1.0 . 4.30 3489 2840 A 61 VAL HGy% A 60 PHE HBx 1.0 . 4.30 3490 2841 A 78 ILE HD1% A 60 PHE HBy 1.0 . 4.87 3491 2841 A 78 ILE HD1% A 60 PHE HBx 1.0 . 4.87 3492 2842 A 91 MET HE% A 60 PHE HBy 1.0 . 3.62 3493 2842 A 91 MET HE% A 60 PHE HBx 1.0 . 3.62 3494 2843 A 60 PHE HD% A 63 VAL HGy% 1.0 . 4.58 3495 2843 A 60 PHE HD% A 63 VAL HGx% 1.0 . 4.58 3496 2844 A 60 PHE HD% A 107 VAL HGy% 1.0 . 4.00 3497 2844 A 60 PHE HD% A 107 VAL HGx% 1.0 . 4.00 3498 2845 A 60 PHE HE% A 107 VAL HGy% 1.0 . 3.26 3499 2845 A 60 PHE HE% A 107 VAL HGx% 1.0 . 3.26 3500 2846 A 60 PHE HZ A 63 VAL HGy% 1.0 . 5.13 3501 2846 A 60 PHE HZ A 63 VAL HGx% 1.0 . 5.13 3502 2847 A 60 PHE HZ A 107 VAL HGy% 1.0 . 4.34 3503 2847 A 60 PHE HZ A 107 VAL HGx% 1.0 . 4.34 3504 2848 A 61 VAL H A 63 VAL HGy% 1.0 . 5.44 3505 2848 A 61 VAL H A 63 VAL HGx% 1.0 . 5.44 3506 2849 A 61 VAL HGx% A 65 ARG HBy 1.0 . 3.99 3507 2849 A 61 VAL HGx% A 65 ARG HBx 1.0 . 3.99 3508 2850 A 62 TYR H A 63 VAL HGy% 1.0 . 4.36 3509 2850 A 62 TYR H A 63 VAL HGx% 1.0 . 4.36 3510 2851 A 62 TYR HA A 65 ARG HBy 1.0 . 3.34 3511 2851 A 62 TYR HA A 65 ARG HBx 1.0 . 3.34 3512 2852 A 62 TYR HA A 65 ARG HGy 1.0 . 5.34 3513 2852 A 62 TYR HA A 65 ARG HGx 1.0 . 5.34 3514 2853 A 62 TYR HBy A 63 VAL HGy% 1.0 . 4.73 3515 2853 A 62 TYR HBy A 63 VAL HGx% 1.0 . 4.73 3516 2854 A 62 TYR HD% A 63 VAL HGy% 1.0 . 3.33 3517 2854 A 62 TYR HD% A 63 VAL HGx% 1.0 . 3.33 3518 2855 A 62 TYR HD% A 66 LYS HGy 1.0 . 4.26 3519 2855 A 62 TYR HD% A 66 LYS HGx 1.0 . 4.26 3520 2856 A 62 TYR HD% A 66 LYS HEy 1.0 . 4.21 3521 2856 A 62 TYR HD% A 66 LYS HEx 1.0 . 4.21 3522 2857 A 62 TYR HE% A 63 VAL HGy% 1.0 . 3.80 3523 2857 A 62 TYR HE% A 63 VAL HGx% 1.0 . 3.80 3524 2858 A 62 TYR HE% A 66 LYS HGy 1.0 . 3.87 3525 2858 A 62 TYR HE% A 66 LYS HGx 1.0 . 3.87 3526 2859 A 63 VAL H A 63 VAL HGy% 1.0 . 2.84 3527 2859 A 63 VAL H A 63 VAL HGx% 1.0 . 2.84 3528 2860 A 63 VAL HA A 63 VAL HGy% 1.0 . 2.80 3529 2860 A 63 VAL HA A 63 VAL HGx% 1.0 . 2.80 3530 2861 A 63 VAL HA A 66 LYS HGy 1.0 . 4.39 3531 2861 A 63 VAL HA A 66 LYS HGx 1.0 . 4.39 3532 2862 A 63 VAL HA A 66 LYS HEy 1.0 . 5.34 3533 2862 A 63 VAL HA A 66 LYS HEx 1.0 . 5.34 3534 2863 A 64 ILE H A 63 VAL HGy% 1.0 . 3.35 3535 2863 A 64 ILE H A 63 VAL HGx% 1.0 . 3.35 3536 2864 A 64 ILE HA A 63 VAL HGy% 1.0 . 3.65 3537 2864 A 64 ILE HA A 63 VAL HGx% 1.0 . 3.65 3538 2865 A 64 ILE HD1% A 63 VAL HGy% 1.0 . 3.09 3539 2865 A 64 ILE HD1% A 63 VAL HGx% 1.0 . 3.09 3540 2866 A 66 LYS H A 63 VAL HGy% 1.0 . 4.71 3541 2866 A 66 LYS H A 63 VAL HGx% 1.0 . 4.71 3542 2867 A 67 ARG H A 63 VAL HGy% 1.0 . 4.81 3543 2867 A 67 ARG H A 63 VAL HGx% 1.0 . 4.81 3544 2868 A 67 ARG HGx A 63 VAL HGy% 1.0 . 5.02 3545 2868 A 67 ARG HGx A 63 VAL HGx% 1.0 . 5.02 3546 2869 A 67 ARG HGy A 63 VAL HGy% 1.0 . 4.39 3547 2869 A 67 ARG HGy A 63 VAL HGx% 1.0 . 4.39 3548 2870 A 67 ARG HDx A 63 VAL HGy% 1.0 . 5.44 3549 2870 A 67 ARG HDx A 63 VAL HGx% 1.0 . 5.44 3550 2871 A 64 ILE HG2% A 68 ILE HG1x 1.0 . 3.86 3551 2871 A 64 ILE HG2% A 68 ILE HG1y 1.0 . 3.86 3552 2872 A 65 ARG H A 65 ARG HGy 1.0 . 4.03 3553 2872 A 65 ARG H A 65 ARG HGx 1.0 . 4.03 3554 2873 A 65 ARG HA A 65 ARG HGy 1.0 . 3.33 3555 2873 A 65 ARG HA A 65 ARG HGx 1.0 . 3.33 3556 2874 A 65 ARG HA A 68 ILE HG1x 1.0 . 3.47 3557 2874 A 65 ARG HA A 68 ILE HG1y 1.0 . 3.47 3558 2875 A 65 ARG HA A 70 LEU HBy 1.0 . 5.34 3559 2875 A 65 ARG HA A 70 LEU HBx 1.0 . 5.34 3560 2876 A 65 ARG HA A 70 LEU HDy% 1.0 . 4.12 3561 2876 A 65 ARG HA A 70 LEU HDx% 1.0 . 4.12 3562 2877 A 65 ARG HE A 65 ARG HBy 1.0 . 4.44 3563 2877 A 65 ARG HE A 65 ARG HBx 1.0 . 4.44 3564 2878 A 66 LYS H A 65 ARG HBy 1.0 . 4.11 3565 2878 A 66 LYS H A 65 ARG HBx 1.0 . 4.11 3566 2879 A 76 ILE HG2% A 65 ARG HBy 1.0 . 4.00 3567 2879 A 76 ILE HG2% A 65 ARG HBx 1.0 . 4.00 3568 2880 A 76 ILE HD1% A 65 ARG HBy 1.0 . 3.72 3569 2880 A 76 ILE HD1% A 65 ARG HBx 1.0 . 3.72 3570 2881 A 69 MET HA A 65 ARG HGy 1.0 . 5.34 3571 2881 A 69 MET HA A 65 ARG HGx 1.0 . 5.34 3572 2882 A 76 ILE HD1% A 65 ARG HGy 1.0 . 4.43 3573 2882 A 76 ILE HD1% A 65 ARG HGx 1.0 . 4.43 3574 2883 A 65 ARG HDy A 70 LEU HDy% 1.0 . 4.18 3575 2883 A 70 LEU HDx% A 65 ARG HDx 1.0 . 4.18 3576 2883 A 65 ARG HDy A 70 LEU HDx% 1.0 . 4.18 3577 2883 A 65 ARG HDx A 70 LEU HDy% 1.0 . 4.18 3578 2884 A 66 LYS H A 66 LYS HGy 1.0 . 3.49 3579 2884 A 66 LYS H A 66 LYS HGx 1.0 . 3.49 3580 2885 A 66 LYS HA A 66 LYS HGy 1.0 . 3.24 3581 2885 A 66 LYS HA A 66 LYS HGx 1.0 . 3.24 3582 2886 A 66 LYS HEx A 66 LYS HGy 1.0 . 3.13 3583 2886 A 66 LYS HEy A 66 LYS HGy 1.0 . 3.13 3584 2886 A 66 LYS HGx A 66 LYS HEy 1.0 . 3.13 3585 2886 A 66 LYS HGx A 66 LYS HEx 1.0 . 3.13 3586 2887 A 67 ARG H A 66 LYS HGy 1.0 . 5.15 3587 2887 A 67 ARG H A 66 LYS HGx 1.0 . 5.15 3588 2888 A 67 ARG H A 68 ILE HG1x 1.0 . 4.20 3589 2888 A 67 ARG H A 68 ILE HG1y 1.0 . 4.20 3590 2889 A 68 ILE H A 68 ILE HG1x 1.0 . 3.12 3591 2889 A 68 ILE H A 68 ILE HG1y 1.0 . 3.12 3592 2890 A 68 ILE HA A 68 ILE HG1x 1.0 . 3.69 3593 2890 A 68 ILE HA A 68 ILE HG1y 1.0 . 3.69 3594 2891 A 69 MET H A 68 ILE HG1x 1.0 . 3.67 3595 2891 A 69 MET H A 68 ILE HG1y 1.0 . 3.67 3596 2892 A 70 LEU H A 68 ILE HG1x 1.0 . 4.03 3597 2892 A 70 LEU H A 68 ILE HG1y 1.0 . 4.03 3598 2893 A 68 ILE HD1% A 70 LEU HDy% 1.0 . 3.17 3599 2893 A 68 ILE HD1% A 70 LEU HDx% 1.0 . 3.17 3600 2894 A 69 MET H A 69 MET HBy 1.0 . 3.45 3601 2894 A 69 MET H A 69 MET HBx 1.0 . 3.45 3602 2895 A 69 MET HA A 70 LEU HBy 1.0 . 4.66 3603 2895 A 69 MET HA A 70 LEU HBx 1.0 . 4.66 3604 2896 A 69 MET HGy A 70 LEU HDy% 1.0 . 5.44 3605 2896 A 69 MET HGx A 70 LEU HDy% 1.0 . 5.44 3606 2896 A 70 LEU HDx% A 69 MET HGx 1.0 . 5.44 3607 2896 A 69 MET HGy A 70 LEU HDx% 1.0 . 5.44 3608 2897 A 70 LEU H A 70 LEU HBy 1.0 . 2.83 3609 2897 A 70 LEU H A 70 LEU HBx 1.0 . 2.83 3610 2898 A 70 LEU H A 70 LEU HDy% 1.0 . 3.65 3611 2898 A 70 LEU H A 70 LEU HDx% 1.0 . 3.65 3612 2899 A 70 LEU HA A 70 LEU HDy% 1.0 . 3.07 3613 2899 A 70 LEU HA A 70 LEU HDx% 1.0 . 3.07 3614 2900 A 70 LEU HBx A 70 LEU HDy% 1.0 . 2.89 3615 2900 A 70 LEU HBy A 70 LEU HDy% 1.0 . 2.89 3616 2900 A 70 LEU HDx% A 70 LEU HBy 1.0 . 2.89 3617 2900 A 70 LEU HDx% A 70 LEU HBx 1.0 . 2.89 3618 2901 A 71 PRO HGx A 70 LEU HBy 1.0 . 5.32 3619 2901 A 71 PRO HGx A 70 LEU HBx 1.0 . 5.32 3620 2902 A 71 PRO HDx A 70 LEU HBy 1.0 . 4.35 3621 2902 A 71 PRO HDx A 70 LEU HBx 1.0 . 4.35 3622 2903 A 76 ILE HB A 70 LEU HBy 1.0 . 5.34 3623 2903 A 76 ILE HB A 70 LEU HBx 1.0 . 5.34 3624 2904 A 71 PRO HDx A 70 LEU HDy% 1.0 . 3.34 3625 2904 A 71 PRO HDx A 70 LEU HDx% 1.0 . 3.34 3626 2905 A 71 PRO HDy A 70 LEU HDy% 1.0 . 3.43 3627 2905 A 71 PRO HDy A 70 LEU HDx% 1.0 . 3.43 3628 2906 A 73 GLU H A 70 LEU HDy% 1.0 . 5.44 3629 2906 A 73 GLU H A 70 LEU HDx% 1.0 . 5.44 3630 2907 A 74 LYS H A 70 LEU HDy% 1.0 . 4.55 3631 2907 A 74 LYS H A 70 LEU HDx% 1.0 . 4.55 3632 2908 A 74 LYS HBx A 70 LEU HDy% 1.0 . 3.75 3633 2908 A 74 LYS HBx A 70 LEU HDx% 1.0 . 3.75 3634 2909 A 74 LYS HBy A 70 LEU HDy% 1.0 . 4.23 3635 2909 A 74 LYS HBy A 70 LEU HDx% 1.0 . 4.23 3636 2910 A 70 LEU HDx% A 74 LYS HGy 1.0 . 3.19 3637 2910 A 70 LEU HDy% A 74 LYS HGy 1.0 . 3.19 3638 2910 A 74 LYS HGx A 70 LEU HDy% 1.0 . 3.19 3639 2910 A 70 LEU HDx% A 74 LYS HGx 1.0 . 3.19 3640 2911 A 70 LEU HDy% A 74 LYS HDx 1.0 . 3.01 3641 2911 A 70 LEU HDx% A 74 LYS HDx 1.0 . 3.01 3642 2911 A 74 LYS HDy A 70 LEU HDy% 1.0 . 3.01 3643 2911 A 74 LYS HDy A 70 LEU HDx% 1.0 . 3.01 3644 2912 A 70 LEU HDy% A 74 LYS HEx 1.0 . 4.85 3645 2912 A 70 LEU HDx% A 74 LYS HEx 1.0 . 4.85 3646 2912 A 74 LYS HEy A 70 LEU HDy% 1.0 . 4.85 3647 2912 A 74 LYS HEy A 70 LEU HDx% 1.0 . 4.85 3648 2913 A 75 ALA HA A 70 LEU HDy% 1.0 . 4.60 3649 2913 A 75 ALA HA A 70 LEU HDx% 1.0 . 4.60 3650 2914 A 76 ILE HA A 70 LEU HDy% 1.0 . 4.79 3651 2914 A 76 ILE HA A 70 LEU HDx% 1.0 . 4.79 3652 2915 A 76 ILE HB A 70 LEU HDy% 1.0 . 3.21 3653 2915 A 76 ILE HB A 70 LEU HDx% 1.0 . 3.21 3654 2916 A 76 ILE HD1% A 70 LEU HDy% 1.0 . 3.12 3655 2916 A 76 ILE HD1% A 70 LEU HDx% 1.0 . 3.12 3656 2917 A 71 PRO HA A 72 PRO HGx 1.0 . 4.35 3657 2917 A 71 PRO HA A 72 PRO HGy 1.0 . 4.35 3658 2918 A 71 PRO HGx A 74 LYS HGy 1.0 . 3.76 3659 2918 A 71 PRO HGx A 74 LYS HGx 1.0 . 3.76 3660 2919 A 71 PRO HDx A 74 LYS HGy 1.0 . 4.20 3661 2919 A 71 PRO HDx A 74 LYS HGx 1.0 . 4.20 3662 2920 A 73 GLU H A 72 PRO HBy 1.0 . 3.92 3663 2920 A 73 GLU H A 72 PRO HBx 1.0 . 3.92 3664 2921 A 73 GLU H A 72 PRO HGx 1.0 . 3.96 3665 2921 A 73 GLU H A 72 PRO HGy 1.0 . 3.96 3666 2922 A 72 PRO HDy A 73 GLU HGy 1.0 . 4.80 3667 2922 A 72 PRO HDx A 73 GLU HGy 1.0 . 4.80 3668 2922 A 73 GLU HGx A 72 PRO HDx 1.0 . 4.80 3669 2922 A 72 PRO HDy A 73 GLU HGx 1.0 . 4.80 3670 2923 A 73 GLU H A 73 GLU HBy 1.0 . 2.74 3671 2923 A 73 GLU H A 73 GLU HBx 1.0 . 2.74 3672 2924 A 73 GLU H A 74 LYS HGy 1.0 . 4.86 3673 2924 A 73 GLU H A 74 LYS HGx 1.0 . 4.86 3674 2925 A 73 GLU HA A 73 GLU HGy 1.0 . 3.40 3675 2925 A 73 GLU HA A 73 GLU HGx 1.0 . 3.40 3676 2926 A 73 GLU HBx A 73 GLU HGy 1.0 . 2.29 3677 2926 A 73 GLU HGx A 73 GLU HBy 1.0 . 2.29 3678 2926 A 73 GLU HGx A 73 GLU HBx 1.0 . 2.29 3679 2926 A 73 GLU HBy A 73 GLU HGy 1.0 . 2.29 3680 2927 A 74 LYS H A 73 GLU HGy 1.0 . 4.07 3681 2927 A 74 LYS H A 73 GLU HGx 1.0 . 4.07 3682 2928 A 74 LYS H A 74 LYS HGy 1.0 . 3.44 3683 2928 A 74 LYS H A 74 LYS HGx 1.0 . 3.44 3684 2929 A 74 LYS HEy A 74 LYS HGy 1.0 . 3.05 3685 2929 A 74 LYS HEx A 74 LYS HGy 1.0 . 3.05 3686 2929 A 74 LYS HGx A 74 LYS HEx 1.0 . 3.05 3687 2929 A 74 LYS HEy A 74 LYS HGx 1.0 . 3.05 3688 2930 A 75 ALA H A 74 LYS HGy 1.0 . 4.21 3689 2930 A 75 ALA H A 74 LYS HGx 1.0 . 4.21 3690 2931 A 77 PHE H A 110 SER HBy 1.0 . 4.64 3691 2931 A 77 PHE H A 110 SER HBx 1.0 . 4.64 3692 2932 A 77 PHE HA A 84 LEU HDy% 1.0 . 3.85 3693 2932 A 77 PHE HA A 84 LEU HDx% 1.0 . 3.85 3694 2933 A 77 PHE HBy A 84 LEU HDy% 1.0 . 3.41 3695 2933 A 77 PHE HBy A 84 LEU HDx% 1.0 . 3.41 3696 2934 A 77 PHE HD% A 113 ASN HBy 1.0 . 4.05 3697 2934 A 77 PHE HD% A 113 ASN HBx 1.0 . 4.05 3698 2935 A 77 PHE HE% A 84 LEU HDy% 1.0 . 4.00 3699 2935 A 77 PHE HE% A 84 LEU HDx% 1.0 . 4.00 3700 2936 A 77 PHE HE% A 113 ASN HBy 1.0 . 3.76 3701 2936 A 77 PHE HE% A 113 ASN HBx 1.0 . 3.76 3702 2937 A 77 PHE HZ A 113 ASN HBy 1.0 . 4.10 3703 2937 A 77 PHE HZ A 113 ASN HBx 1.0 . 4.10 3704 2938 A 78 ILE H A 84 LEU HDy% 1.0 . 3.70 3705 2938 A 78 ILE H A 84 LEU HDx% 1.0 . 3.70 3706 2939 A 78 ILE HA A 107 VAL HGy% 1.0 . 4.40 3707 2939 A 78 ILE HA A 107 VAL HGx% 1.0 . 4.40 3708 2940 A 78 ILE HB A 107 VAL HGy% 1.0 . 3.87 3709 2940 A 78 ILE HB A 107 VAL HGx% 1.0 . 3.87 3710 2941 A 79 PHE H A 107 VAL HGy% 1.0 . 4.12 3711 2941 A 79 PHE H A 107 VAL HGx% 1.0 . 4.12 3712 2942 A 79 PHE HA A 80 VAL HGy% 1.0 . 4.11 3713 2942 A 79 PHE HA A 80 VAL HGx% 1.0 . 4.11 3714 2943 A 79 PHE HA A 84 LEU HDy% 1.0 . 4.09 3715 2943 A 79 PHE HA A 84 LEU HDx% 1.0 . 4.09 3716 2944 A 79 PHE HE% A 84 LEU HDy% 1.0 . 3.53 3717 2944 A 79 PHE HE% A 84 LEU HDx% 1.0 . 3.53 3718 2945 A 79 PHE HE% A 110 SER HBy 1.0 . 4.46 3719 2945 A 79 PHE HE% A 110 SER HBx 1.0 . 4.46 3720 2946 A 79 PHE HZ A 84 LEU HDy% 1.0 . 4.08 3721 2946 A 79 PHE HZ A 84 LEU HDx% 1.0 . 4.08 3722 2947 A 80 VAL H A 80 VAL HGy% 1.0 . 3.35 3723 2947 A 80 VAL H A 80 VAL HGx% 1.0 . 3.35 3724 2948 A 80 VAL H A 107 VAL HGy% 1.0 . 5.20 3725 2948 A 80 VAL H A 107 VAL HGx% 1.0 . 5.20 3726 2949 A 80 VAL HA A 107 VAL HGy% 1.0 . 4.20 3727 2949 A 80 VAL HA A 107 VAL HGx% 1.0 . 4.20 3728 2950 A 80 VAL HB A 107 VAL HGy% 1.0 . 4.92 3729 2950 A 80 VAL HB A 107 VAL HGx% 1.0 . 4.92 3730 2951 A 81 ASN H A 80 VAL HGy% 1.0 . 3.73 3731 2951 A 81 ASN H A 80 VAL HGx% 1.0 . 3.73 3732 2952 A 81 ASN HA A 80 VAL HGy% 1.0 . 4.80 3733 2952 A 81 ASN HA A 80 VAL HGx% 1.0 . 4.80 3734 2953 A 81 ASN HBx A 80 VAL HGy% 1.0 . 4.75 3735 2953 A 81 ASN HBx A 80 VAL HGx% 1.0 . 4.75 3736 2954 A 81 ASN HBy A 80 VAL HGy% 1.0 . 5.21 3737 2954 A 81 ASN HBy A 80 VAL HGx% 1.0 . 5.21 3738 2955 A 81 ASN HD2x A 80 VAL HGx% 1.0 . 3.32 3739 2955 A 81 ASN HD2y A 80 VAL HGx% 1.0 . 3.32 3740 2955 A 81 ASN HD2x A 80 VAL HGy% 1.0 . 3.32 3741 2955 A 81 ASN HD2y A 80 VAL HGy% 1.0 . 3.32 3742 2956 A 83 THR H A 80 VAL HGy% 1.0 . 4.32 3743 2956 A 83 THR H A 80 VAL HGx% 1.0 . 4.32 3744 2957 A 83 THR HB A 80 VAL HGy% 1.0 . 5.44 3745 2957 A 83 THR HB A 80 VAL HGx% 1.0 . 5.44 3746 2958 A 83 THR HG2% A 80 VAL HGy% 1.0 . 3.49 3747 2958 A 83 THR HG2% A 80 VAL HGx% 1.0 . 3.49 3748 2959 A 84 LEU HA A 80 VAL HGy% 1.0 . 4.15 3749 2959 A 84 LEU HA A 80 VAL HGx% 1.0 . 4.15 3750 2960 A 85 PRO HBy A 80 VAL HGy% 1.0 . 4.33 3751 2960 A 85 PRO HBy A 80 VAL HGx% 1.0 . 4.33 3752 2961 A 85 PRO HBx A 80 VAL HGy% 1.0 . 3.83 3753 2961 A 85 PRO HBx A 80 VAL HGx% 1.0 . 3.83 3754 2962 A 85 PRO HGx A 80 VAL HGy% 1.0 . 3.68 3755 2962 A 85 PRO HGx A 80 VAL HGx% 1.0 . 3.68 3756 2963 A 85 PRO HGy A 80 VAL HGy% 1.0 . 3.35 3757 2963 A 85 PRO HGy A 80 VAL HGx% 1.0 . 3.35 3758 2964 A 85 PRO HDx A 80 VAL HGy% 1.0 . 3.84 3759 2964 A 85 PRO HDx A 80 VAL HGx% 1.0 . 3.84 3760 2965 A 85 PRO HDy A 80 VAL HGy% 1.0 . 3.60 3761 2965 A 85 PRO HDy A 80 VAL HGx% 1.0 . 3.60 3762 2966 A 94 ILE HG2% A 80 VAL HGy% 1.0 . 2.83 3763 2966 A 94 ILE HG2% A 80 VAL HGx% 1.0 . 2.83 3764 2967 A 98 HIS H A 80 VAL HGy% 1.0 . 5.22 3765 2967 A 98 HIS H A 80 VAL HGx% 1.0 . 5.22 3766 2968 A 98 HIS HBx A 80 VAL HGy% 1.0 . 3.35 3767 2968 A 98 HIS HBx A 80 VAL HGx% 1.0 . 3.35 3768 2969 A 98 HIS HBy A 80 VAL HGy% 1.0 . 3.39 3769 2969 A 98 HIS HBy A 80 VAL HGx% 1.0 . 3.39 3770 2970 A 98 HIS HD2 A 80 VAL HGy% 1.0 . 3.42 3771 2970 A 98 HIS HD2 A 80 VAL HGx% 1.0 . 3.42 3772 2971 A 98 HIS HE1 A 80 VAL HGy% 1.0 . 4.25 3773 2971 A 98 HIS HE1 A 80 VAL HGx% 1.0 . 4.25 3774 2972 A 107 VAL HA A 80 VAL HGy% 1.0 . 3.94 3775 2972 A 107 VAL HA A 80 VAL HGx% 1.0 . 3.94 3776 2973 A 80 VAL HGx% A 107 VAL HGy% 1.0 . 2.97 3777 2973 A 80 VAL HGy% A 107 VAL HGy% 1.0 . 2.97 3778 2973 A 107 VAL HGx% A 80 VAL HGy% 1.0 . 2.97 3779 2973 A 107 VAL HGx% A 80 VAL HGx% 1.0 . 2.97 3780 2974 A 108 THR H A 80 VAL HGy% 1.0 . 5.31 3781 2974 A 108 THR H A 80 VAL HGx% 1.0 . 5.31 3782 2975 A 81 ASN HBy A 81 ASN HD2y 1.0 . 3.35 3783 2975 A 81 ASN HBy A 81 ASN HD2x 1.0 . 3.35 3784 2976 A 83 THR H A 81 ASN HD2y 1.0 . 4.83 3785 2976 A 83 THR H A 81 ASN HD2x 1.0 . 4.83 3786 2977 A 81 ASN HD2y A 83 THR HG2% 1.0 . 4.06 3787 2977 A 81 ASN HD2x A 83 THR HG2% 1.0 . 4.06 3788 2978 A 81 ASN HD2y A 98 HIS HA 1.0 . 4.08 3789 2978 A 81 ASN HD2x A 98 HIS HA 1.0 . 4.08 3790 2979 A 98 HIS HBy A 81 ASN HD2y 1.0 . 4.00 3791 2979 A 98 HIS HBy A 81 ASN HD2x 1.0 . 4.00 3792 2980 A 98 HIS HD2 A 81 ASN HD2y 1.0 . 4.75 3793 2980 A 98 HIS HD2 A 81 ASN HD2x 1.0 . 4.75 3794 2981 A 81 ASN HD2y A 98 HIS HE1 1.0 . 4.04 3795 2981 A 81 ASN HD2x A 98 HIS HE1 1.0 . 4.04 3796 2982 A 82 ASP H A 82 ASP HBy 1.0 . 3.66 3797 2982 A 82 ASP H A 82 ASP HBx 1.0 . 3.66 3798 2983 A 83 THR H A 82 ASP HBy 1.0 . 3.88 3799 2983 A 83 THR H A 82 ASP HBx 1.0 . 3.88 3800 2984 A 83 THR H A 84 LEU HDy% 1.0 . 5.44 3801 2984 A 83 THR H A 84 LEU HDx% 1.0 . 5.44 3802 2985 A 83 THR HA A 84 LEU HBy 1.0 . 4.39 3803 2985 A 83 THR HA A 84 LEU HBx 1.0 . 4.39 3804 2986 A 84 LEU H A 84 LEU HBy 1.0 . 2.90 3805 2986 A 84 LEU H A 84 LEU HBx 1.0 . 2.90 3806 2987 A 84 LEU H A 84 LEU HDy% 1.0 . 3.88 3807 2987 A 84 LEU H A 84 LEU HDx% 1.0 . 3.88 3808 2988 A 84 LEU HA A 84 LEU HDy% 1.0 . 3.26 3809 2988 A 84 LEU HA A 84 LEU HDx% 1.0 . 3.26 3810 2989 A 84 LEU HBx A 84 LEU HDy% 1.0 . 2.62 3811 2989 A 84 LEU HDx% A 84 LEU HBy 1.0 . 2.62 3812 2989 A 84 LEU HDx% A 84 LEU HBx 1.0 . 2.62 3813 2989 A 84 LEU HBy A 84 LEU HDy% 1.0 . 2.62 3814 2990 A 85 PRO HDx A 84 LEU HBy 1.0 . 4.75 3815 2990 A 85 PRO HDx A 84 LEU HBx 1.0 . 4.75 3816 2991 A 85 PRO HDx A 84 LEU HDy% 1.0 . 3.93 3817 2991 A 85 PRO HDx A 84 LEU HDx% 1.0 . 3.93 3818 2992 A 85 PRO HDy A 84 LEU HDy% 1.0 . 4.43 3819 2992 A 85 PRO HDy A 84 LEU HDx% 1.0 . 4.43 3820 2993 A 113 ASN HA A 84 LEU HDy% 1.0 . 3.87 3821 2993 A 113 ASN HA A 84 LEU HDx% 1.0 . 3.87 3822 2994 A 84 LEU HDx% A 113 ASN HBy 1.0 . 4.13 3823 2994 A 84 LEU HDy% A 113 ASN HBy 1.0 . 4.13 3824 2994 A 113 ASN HBx A 84 LEU HDy% 1.0 . 4.13 3825 2994 A 84 LEU HDx% A 113 ASN HBx 1.0 . 4.13 3826 2995 A 113 ASN HD2x A 84 LEU HDy% 1.0 . 4.02 3827 2995 A 113 ASN HD2x A 84 LEU HDx% 1.0 . 4.02 3828 2996 A 85 PRO HA A 86 PRO HGx 1.0 . 4.08 3829 2996 A 85 PRO HA A 86 PRO HGy 1.0 . 4.08 3830 2997 A 85 PRO HA A 86 PRO HDy 1.0 . 2.91 3831 2997 A 85 PRO HA A 86 PRO HDx 1.0 . 2.91 3832 2998 A 85 PRO HBy A 86 PRO HDy 1.0 . 3.63 3833 2998 A 85 PRO HBy A 86 PRO HDx 1.0 . 3.63 3834 2999 A 85 PRO HBx A 86 PRO HDy 1.0 . 3.92 3835 2999 A 85 PRO HBx A 86 PRO HDx 1.0 . 3.92 3836 3000 A 87 THR H A 86 PRO HGx 1.0 . 4.25 3837 3000 A 87 THR H A 86 PRO HGy 1.0 . 4.25 3838 3001 A 88 ALA H A 86 PRO HGx 1.0 . 4.36 3839 3001 A 88 ALA H A 86 PRO HGy 1.0 . 4.36 3840 3002 A 89 ALA HB% A 86 PRO HGx 1.0 . 3.08 3841 3002 A 89 ALA HB% A 86 PRO HGy 1.0 . 3.08 3842 3003 A 89 ALA H A 86 PRO HDy 1.0 . 5.06 3843 3003 A 89 ALA H A 86 PRO HDx 1.0 . 5.06 3844 3004 A 89 ALA HB% A 86 PRO HDy 1.0 . 3.19 3845 3004 A 89 ALA HB% A 86 PRO HDx 1.0 . 3.19 3846 3005 A 94 ILE HD1% A 86 PRO HDy 1.0 . 3.58 3847 3005 A 94 ILE HD1% A 86 PRO HDx 1.0 . 3.58 3848 3006 A 88 ALA HA A 90 LEU HDy% 1.0 . 4.54 3849 3006 A 88 ALA HA A 90 LEU HDx% 1.0 . 4.54 3850 3007 A 89 ALA H A 90 LEU HDy% 1.0 . 5.44 3851 3007 A 89 ALA H A 90 LEU HDx% 1.0 . 5.44 3852 3008 A 89 ALA HA A 90 LEU HDy% 1.0 . 5.32 3853 3008 A 89 ALA HA A 90 LEU HDx% 1.0 . 5.32 3854 3009 A 90 LEU H A 90 LEU HDy% 1.0 . 3.18 3855 3009 A 90 LEU H A 90 LEU HDx% 1.0 . 3.18 3856 3010 A 90 LEU HA A 90 LEU HDy% 1.0 . 2.84 3857 3010 A 90 LEU HA A 90 LEU HDx% 1.0 . 2.84 3858 3011 A 90 LEU HA A 91 MET HGx 1.0 . 4.24 3859 3011 A 90 LEU HA A 91 MET HGy 1.0 . 4.24 3860 3012 A 90 LEU HBx A 90 LEU HDy% 1.0 . 2.62 3861 3012 A 90 LEU HBx A 90 LEU HDx% 1.0 . 2.62 3862 3013 A 91 MET H A 90 LEU HDy% 1.0 . 3.63 3863 3013 A 91 MET H A 90 LEU HDx% 1.0 . 3.63 3864 3014 A 92 SER H A 90 LEU HDy% 1.0 . 4.07 3865 3014 A 92 SER H A 90 LEU HDx% 1.0 . 4.07 3866 3015 A 93 ALA H A 90 LEU HDy% 1.0 . 4.18 3867 3015 A 93 ALA H A 90 LEU HDx% 1.0 . 4.18 3868 3016 A 93 ALA HB% A 90 LEU HDy% 1.0 . 4.31 3869 3016 A 93 ALA HB% A 90 LEU HDx% 1.0 . 4.31 3870 3017 A 91 MET HA A 91 MET HGx 1.0 . 3.51 3871 3017 A 91 MET HA A 91 MET HGy 1.0 . 3.51 3872 3018 A 91 MET HE% A 91 MET HGx 1.0 . 2.86 3873 3018 A 91 MET HE% A 91 MET HGy 1.0 . 2.86 3874 3019 A 92 SER H A 91 MET HGx 1.0 . 4.55 3875 3019 A 92 SER H A 91 MET HGy 1.0 . 4.55 3876 3020 A 94 ILE HB A 105 LEU HDy% 1.0 . 3.91 3877 3020 A 94 ILE HB A 105 LEU HDx% 1.0 . 3.91 3878 3021 A 94 ILE HG2% A 105 LEU HDy% 1.0 . 2.65 3879 3021 A 94 ILE HG2% A 105 LEU HDx% 1.0 . 2.65 3880 3022 A 95 TYR H A 105 LEU HDy% 1.0 . 3.76 3881 3022 A 95 TYR H A 105 LEU HDx% 1.0 . 3.76 3882 3023 A 95 TYR HA A 105 LEU HDy% 1.0 . 3.17 3883 3023 A 95 TYR HA A 105 LEU HDx% 1.0 . 3.17 3884 3024 A 95 TYR HBx A 105 LEU HDy% 1.0 . 3.99 3885 3024 A 95 TYR HBx A 105 LEU HDx% 1.0 . 3.99 3886 3025 A 95 TYR HBy A 105 LEU HDy% 1.0 . 4.56 3887 3025 A 95 TYR HBy A 105 LEU HDx% 1.0 . 4.56 3888 3026 A 95 TYR HD% A 105 LEU HDy% 1.0 . 3.28 3889 3026 A 95 TYR HD% A 105 LEU HDx% 1.0 . 3.28 3890 3027 A 95 TYR HE% A 105 LEU HDy% 1.0 . 3.78 3891 3027 A 95 TYR HE% A 105 LEU HDx% 1.0 . 3.78 3892 3028 A 96 GLN H A 105 LEU HDy% 1.0 . 4.69 3893 3028 A 96 GLN H A 105 LEU HDx% 1.0 . 4.69 3894 3029 A 97 GLU H A 105 LEU HDy% 1.0 . 4.65 3895 3029 A 97 GLU H A 105 LEU HDx% 1.0 . 4.65 3896 3030 A 97 GLU HA A 99 LYS HGy 1.0 . 4.27 3897 3030 A 97 GLU HA A 99 LYS HGx 1.0 . 4.27 3898 3031 A 98 HIS H A 105 LEU HDy% 1.0 . 3.61 3899 3031 A 98 HIS H A 105 LEU HDx% 1.0 . 3.61 3900 3032 A 98 HIS HBx A 105 LEU HDy% 1.0 . 3.42 3901 3032 A 98 HIS HBx A 105 LEU HDx% 1.0 . 3.42 3902 3033 A 98 HIS HBy A 105 LEU HDy% 1.0 . 3.67 3903 3033 A 98 HIS HBy A 105 LEU HDx% 1.0 . 3.67 3904 3034 A 98 HIS HD2 A 105 LEU HDy% 1.0 . 4.68 3905 3034 A 98 HIS HD2 A 105 LEU HDx% 1.0 . 4.68 3906 3035 A 99 LYS H A 99 LYS HGy 1.0 . 3.21 3907 3035 A 99 LYS H A 99 LYS HGx 1.0 . 3.21 3908 3036 A 99 LYS H A 99 LYS HEx 1.0 . 4.21 3909 3036 A 99 LYS H A 99 LYS HEy 1.0 . 4.21 3910 3037 A 99 LYS H A 105 LEU HDy% 1.0 . 3.44 3911 3037 A 99 LYS H A 105 LEU HDx% 1.0 . 3.44 3912 3038 A 99 LYS HA A 99 LYS HGy 1.0 . 3.43 3913 3038 A 99 LYS HA A 99 LYS HGx 1.0 . 3.43 3914 3039 A 99 LYS HA A 105 LEU HDy% 1.0 . 2.98 3915 3039 A 99 LYS HA A 105 LEU HDx% 1.0 . 2.98 3916 3040 A 99 LYS HBy A 103 GLY HAy 1.0 . 4.51 3917 3040 A 99 LYS HBx A 103 GLY HAy 1.0 . 4.51 3918 3040 A 103 GLY HAx A 99 LYS HBx 1.0 . 4.51 3919 3040 A 99 LYS HBy A 103 GLY HAx 1.0 . 4.51 3920 3041 A 99 LYS HBy A 105 LEU HDy% 1.0 . 4.06 3921 3041 A 99 LYS HBx A 105 LEU HDy% 1.0 . 4.06 3922 3041 A 105 LEU HDx% A 99 LYS HBx 1.0 . 4.06 3923 3041 A 99 LYS HBy A 105 LEU HDx% 1.0 . 4.06 3924 3042 A 99 LYS HEy A 99 LYS HGy 1.0 . 3.20 3925 3042 A 99 LYS HEx A 99 LYS HGy 1.0 . 3.20 3926 3042 A 99 LYS HGx A 99 LYS HEx 1.0 . 3.20 3927 3042 A 99 LYS HGx A 99 LYS HEy 1.0 . 3.20 3928 3043 A 100 ASP H A 100 ASP HBy 1.0 . 2.99 3929 3043 A 100 ASP H A 100 ASP HBx 1.0 . 2.99 3930 3044 A 100 ASP H A 105 LEU HDy% 1.0 . 4.31 3931 3044 A 100 ASP H A 105 LEU HDx% 1.0 . 4.31 3932 3045 A 100 ASP HA A 101 LYS HGy 1.0 . 4.52 3933 3045 A 100 ASP HA A 101 LYS HGx 1.0 . 4.52 3934 3046 A 102 ASP H A 100 ASP HBy 1.0 . 4.32 3935 3046 A 102 ASP H A 100 ASP HBx 1.0 . 4.32 3936 3047 A 103 GLY H A 100 ASP HBy 1.0 . 3.69 3937 3047 A 103 GLY H A 100 ASP HBx 1.0 . 3.69 3938 3048 A 106 TYR HE% A 100 ASP HBy 1.0 . 3.48 3939 3048 A 106 TYR HE% A 100 ASP HBx 1.0 . 3.48 3940 3049 A 101 LYS HA A 101 LYS HGy 1.0 . 3.07 3941 3049 A 101 LYS HA A 101 LYS HGx 1.0 . 3.07 3942 3050 A 103 GLY H A 101 LYS HGy 1.0 . 5.34 3943 3050 A 103 GLY H A 101 LYS HGx 1.0 . 5.34 3944 3051 A 102 ASP HA A 103 GLY HAy 1.0 . 4.69 3945 3051 A 102 ASP HA A 103 GLY HAx 1.0 . 4.69 3946 3052 A 105 LEU H A 104 PHE HBx 1.0 . 4.55 3947 3052 A 105 LEU H A 104 PHE HBy 1.0 . 4.55 3948 3053 A 106 TYR HE% A 104 PHE HBx 1.0 . 3.99 3949 3053 A 106 TYR HE% A 104 PHE HBy 1.0 . 3.99 3950 3054 A 104 PHE HZ B 618 VAL HGy% 1.0 . 4.07 3951 3054 A 104 PHE HZ B 618 VAL HGx% 1.0 . 4.07 3952 3055 A 105 LEU H A 105 LEU HDy% 1.0 . 3.98 3953 3055 A 105 LEU H A 105 LEU HDx% 1.0 . 3.98 3954 3056 A 105 LEU HA A 105 LEU HDy% 1.0 . 3.10 3955 3056 A 105 LEU HA A 105 LEU HDx% 1.0 . 3.10 3956 3057 A 105 LEU HBy A 107 VAL HGy% 1.0 . 4.22 3957 3057 A 105 LEU HBy A 107 VAL HGx% 1.0 . 4.22 3958 3058 A 106 TYR H A 105 LEU HDy% 1.0 . 3.58 3959 3058 A 106 TYR H A 105 LEU HDx% 1.0 . 3.58 3960 3059 A 106 TYR HD% A 105 LEU HDy% 1.0 . 4.67 3961 3059 A 106 TYR HD% A 105 LEU HDx% 1.0 . 4.67 3962 3060 A 106 TYR H A 106 TYR HBy 1.0 . 3.39 3963 3060 A 106 TYR H A 106 TYR HBx 1.0 . 3.39 3964 3061 A 106 TYR HA A 107 VAL HGy% 1.0 . 4.16 3965 3061 A 106 TYR HA A 107 VAL HGx% 1.0 . 4.16 3966 3062 A 107 VAL H A 106 TYR HBy 1.0 . 3.97 3967 3062 A 107 VAL H A 106 TYR HBx 1.0 . 3.97 3968 3063 A 107 VAL H A 107 VAL HGy% 1.0 . 3.19 3969 3063 A 107 VAL H A 107 VAL HGx% 1.0 . 3.19 3970 3064 A 107 VAL HA A 107 VAL HGy% 1.0 . 2.99 3971 3064 A 107 VAL HA A 107 VAL HGx% 1.0 . 2.99 3972 3065 A 108 THR H A 107 VAL HGy% 1.0 . 3.30 3973 3065 A 108 THR H A 107 VAL HGx% 1.0 . 3.30 3974 3066 A 108 THR HA A 107 VAL HGy% 1.0 . 4.47 3975 3066 A 108 THR HA A 107 VAL HGx% 1.0 . 4.47 3976 3067 A 109 TYR H A 107 VAL HGy% 1.0 . 5.44 3977 3067 A 109 TYR H A 107 VAL HGx% 1.0 . 5.44 3978 3068 A 110 SER H A 110 SER HBy 1.0 . 3.35 3979 3068 A 110 SER H A 110 SER HBx 1.0 . 3.35 3980 3069 A 111 GLY H A 110 SER HBy 1.0 . 3.88 3981 3069 A 111 GLY H A 110 SER HBx 1.0 . 3.88 3982 3070 A 112 GLU H A 110 SER HBy 1.0 . 3.55 3983 3070 A 112 GLU H A 110 SER HBx 1.0 . 3.55 3984 3071 A 112 GLU H A 112 GLU HBx 1.0 . 3.10 3985 3071 A 112 GLU H A 112 GLU HBy 1.0 . 3.10 3986 3072 A 112 GLU HA A 112 GLU HGx 1.0 . 3.59 3987 3072 A 112 GLU HA A 112 GLU HGy 1.0 . 3.59 3988 3073 A 113 ASN H A 112 GLU HBx 1.0 . 3.42 3989 3073 A 113 ASN H A 112 GLU HBy 1.0 . 3.42 3990 3074 A 114 THR H A 112 GLU HBx 1.0 . 3.37 3991 3074 A 114 THR H A 112 GLU HBy 1.0 . 3.37 3992 3075 A 113 ASN H A 112 GLU HGx 1.0 . 4.13 3993 3075 A 113 ASN H A 112 GLU HGy 1.0 . 4.13 3994 3076 A 114 THR H A 112 GLU HGx 1.0 . 4.42 3995 3076 A 114 THR H A 112 GLU HGy 1.0 . 4.42 3996 3077 A 114 THR HG2% A 112 GLU HGx 1.0 . 5.34 3997 3077 A 114 THR HG2% A 112 GLU HGy 1.0 . 5.34 3998 3078 A 113 ASN HD2x A 113 ASN HBy 1.0 . 3.60 3999 3078 A 113 ASN HD2x A 113 ASN HBx 1.0 . 3.60 4000 3079 A 114 THR H A 113 ASN HBy 1.0 . 4.12 4001 3079 A 114 THR H A 113 ASN HBx 1.0 . 4.12 4002 3080 A 115 PHE H A 115 PHE HBy 1.0 . 3.30 4003 3080 A 115 PHE H A 115 PHE HBx 1.0 . 3.30 4004 3081 A 116 GLY H A 115 PHE HBy 1.0 . 3.75 4005 3081 A 116 GLY H A 115 PHE HBx 1.0 . 3.75 4006 3082 B 599 HIS HD2 B 599 HIS HBx 1.0 . 3.41 4007 3082 B 599 HIS HBy B 599 HIS HD2 1.0 . 3.41 4008 3083 B 601 ILE H B 600 MET HBy 1.0 . 3.80 4009 3083 B 601 ILE H B 600 MET HBx 1.0 . 3.80 4010 3084 B 601 ILE H B 601 ILE HG1x 1.0 . 3.83 4011 3084 B 601 ILE H B 601 ILE HG1y 1.0 . 3.83 4012 3085 B 601 ILE HA B 601 ILE HG1x 1.0 . 3.75 4013 3085 B 601 ILE HA B 601 ILE HG1y 1.0 . 3.75 4014 3086 B 603 GLY HAx B 604 LEU HDy% 1.0 . 5.44 4015 3086 B 603 GLY HAy B 604 LEU HDy% 1.0 . 5.44 4016 3086 B 604 LEU HDx% B 603 GLY HAx 1.0 . 5.44 4017 3086 B 603 GLY HAy B 604 LEU HDx% 1.0 . 5.44 4018 3087 B 606 VAL H B 606 VAL HGy% 1.0 . 3.33 4019 3087 B 606 VAL H B 606 VAL HGx% 1.0 . 3.33 4020 3088 B 607 ILE H B 606 VAL HGy% 1.0 . 3.24 4021 3088 B 607 ILE H B 606 VAL HGx% 1.0 . 3.24 4022 3089 B 607 ILE H B 607 ILE HG1x 1.0 . 3.43 4023 3089 B 607 ILE H B 607 ILE HG1y 1.0 . 3.43 4024 3090 B 607 ILE HG2% B 608 LYS HBy 1.0 . 4.51 4025 3090 B 607 ILE HG2% B 608 LYS HBx 1.0 . 4.51 4026 3091 B 607 ILE HG2% B 609 GLN HBx 1.0 . 5.24 4027 3091 B 607 ILE HG2% B 609 GLN HBy 1.0 . 5.24 4028 3092 B 609 GLN HE2x B 607 ILE HG2% 1.0 . 4.26 4029 3092 B 609 GLN HE2y B 607 ILE HG2% 1.0 . 4.26 4030 3093 B 608 LYS H B 607 ILE HG1x 1.0 . 4.67 4031 3093 B 608 LYS H B 607 ILE HG1y 1.0 . 4.67 4032 3094 B 607 ILE HD1% B 609 GLN HE2x 1.0 . 4.73 4033 3094 B 607 ILE HD1% B 609 GLN HE2y 1.0 . 4.73 4034 3095 B 608 LYS H B 608 LYS HBy 1.0 . 3.33 4035 3095 B 608 LYS H B 608 LYS HBx 1.0 . 3.33 4036 3096 B 608 LYS H B 608 LYS HGy 1.0 . 3.79 4037 3096 B 608 LYS H B 608 LYS HGx 1.0 . 3.79 4038 3097 B 609 GLN HE2x B 608 LYS HA 1.0 . 5.23 4039 3097 B 609 GLN HE2y B 608 LYS HA 1.0 . 5.23 4040 3098 B 609 GLN H B 608 LYS HBy 1.0 . 3.81 4041 3098 B 609 GLN H B 608 LYS HBx 1.0 . 3.81 4042 3099 B 608 LYS HEy B 608 LYS HGy 1.0 . 3.40 4043 3099 B 608 LYS HGx B 608 LYS HEx 1.0 . 3.40 4044 3099 B 608 LYS HEy B 608 LYS HGx 1.0 . 3.40 4045 3099 B 608 LYS HEx B 608 LYS HGy 1.0 . 3.40 4046 3100 B 609 GLN H B 608 LYS HGy 1.0 . 4.94 4047 3100 B 609 GLN H B 608 LYS HGx 1.0 . 4.94 4048 3101 B 609 GLN HE2x B 609 GLN HA 1.0 . 5.34 4049 3101 B 609 GLN HE2y B 609 GLN HA 1.0 . 5.34 4050 3102 B 609 GLN HE2y B 609 GLN HBx 1.0 . 4.02 4051 3102 B 609 GLN HE2x B 609 GLN HBx 1.0 . 4.02 4052 3102 B 609 GLN HE2y B 609 GLN HBy 1.0 . 4.02 4053 3102 B 609 GLN HE2x B 609 GLN HBy 1.0 . 4.02 4054 3103 B 610 GLU H B 609 GLN HBx 1.0 . 3.34 4055 3103 B 610 GLU H B 609 GLN HBy 1.0 . 3.34 4056 3104 B 609 GLN HE2y B 609 GLN HGx 1.0 . 3.35 4057 3104 B 609 GLN HE2x B 609 GLN HGy 1.0 . 3.35 4058 3104 B 609 GLN HE2y B 609 GLN HGy 1.0 . 3.35 4059 3104 B 609 GLN HE2x B 609 GLN HGx 1.0 . 3.35 4060 3105 B 610 GLU H B 610 GLU HBy 1.0 . 3.06 4061 3105 B 610 GLU H B 610 GLU HBx 1.0 . 3.06 4062 3106 B 610 GLU H B 610 GLU HGy 1.0 . 3.41 4063 3106 B 610 GLU H B 610 GLU HGx 1.0 . 3.41 4064 3107 B 610 GLU H B 611 VAL HGy% 1.0 . 5.18 4065 3107 B 610 GLU H B 611 VAL HGx% 1.0 . 5.18 4066 3108 B 610 GLU HA B 610 GLU HGy 1.0 . 3.37 4067 3108 B 610 GLU HA B 610 GLU HGx 1.0 . 3.37 4068 3109 B 610 GLU HA B 611 VAL HGy% 1.0 . 3.97 4069 3109 B 610 GLU HA B 611 VAL HGx% 1.0 . 3.97 4070 3110 B 611 VAL H B 610 GLU HBy 1.0 . 3.14 4071 3110 B 611 VAL H B 610 GLU HBx 1.0 . 3.14 4072 3111 B 610 GLU HBx B 611 VAL HGy% 1.0 . 4.88 4073 3111 B 611 VAL HGx% B 610 GLU HBy 1.0 . 4.88 4074 3111 B 610 GLU HBx B 611 VAL HGx% 1.0 . 4.88 4075 3111 B 610 GLU HBy B 611 VAL HGy% 1.0 . 4.88 4076 3112 B 611 VAL H B 610 GLU HGy 1.0 . 4.04 4077 3112 B 611 VAL H B 610 GLU HGx 1.0 . 4.04 4078 3113 B 611 VAL H B 611 VAL HGy% 1.0 . 2.96 4079 3113 B 611 VAL H B 611 VAL HGx% 1.0 . 2.96 4080 3114 B 612 GLU H B 611 VAL HGy% 1.0 . 3.85 4081 3114 B 612 GLU H B 611 VAL HGx% 1.0 . 3.85 4082 3115 B 612 GLU HA B 611 VAL HGy% 1.0 . 4.81 4083 3115 B 612 GLU HA B 611 VAL HGx% 1.0 . 4.81 4084 3116 B 612 GLU H B 612 GLU HBy 1.0 . 2.99 4085 3116 B 612 GLU H B 612 GLU HBx 1.0 . 2.99 4086 3117 B 612 GLU H B 612 GLU HGy 1.0 . 3.29 4087 3117 B 612 GLU H B 612 GLU HGx 1.0 . 3.29 4088 3118 B 612 GLU HA B 612 GLU HGy 1.0 . 3.48 4089 3118 B 612 GLU HA B 612 GLU HGx 1.0 . 3.48 4090 3119 B 613 ARG H B 612 GLU HBy 1.0 . 3.60 4091 3119 B 613 ARG H B 612 GLU HBx 1.0 . 3.60 4092 3120 B 612 GLU HBx B 614 LEU HDy% 1.0 . 5.28 4093 3120 B 612 GLU HBy B 614 LEU HDy% 1.0 . 5.28 4094 3120 B 614 LEU HDx% B 612 GLU HBy 1.0 . 5.28 4095 3120 B 612 GLU HBx B 614 LEU HDx% 1.0 . 5.28 4096 3121 B 613 ARG H B 612 GLU HGy 1.0 . 3.77 4097 3121 B 613 ARG H B 612 GLU HGx 1.0 . 3.77 4098 3122 B 613 ARG HE B 612 GLU HGy 1.0 . 3.97 4099 3122 B 612 GLU HGx B 613 ARG HE 1.0 . 3.97 4100 3123 B 612 GLU HGy B 614 LEU HDy% 1.0 . 5.02 4101 3123 B 612 GLU HGx B 614 LEU HDy% 1.0 . 5.02 4102 3123 B 614 LEU HDx% B 612 GLU HGy 1.0 . 5.02 4103 3123 B 612 GLU HGx B 614 LEU HDx% 1.0 . 5.02 4104 3124 B 613 ARG H B 613 ARG HBy 1.0 . 3.40 4105 3124 B 613 ARG H B 613 ARG HBx 1.0 . 3.40 4106 3125 B 613 ARG H B 614 LEU HDy% 1.0 . 4.99 4107 3125 B 613 ARG H B 614 LEU HDx% 1.0 . 4.99 4108 3126 B 613 ARG HBx B 613 ARG HDx 1.0 . 3.18 4109 3126 B 613 ARG HBy B 613 ARG HDx 1.0 . 3.18 4110 3126 B 613 ARG HDy B 613 ARG HBy 1.0 . 3.18 4111 3126 B 613 ARG HDy B 613 ARG HBx 1.0 . 3.18 4112 3127 B 614 LEU H B 613 ARG HBy 1.0 . 4.00 4113 3127 B 614 LEU H B 613 ARG HBx 1.0 . 4.00 4114 3128 B 613 ARG HDy B 614 LEU HDy% 1.0 . 4.74 4115 3128 B 613 ARG HDx B 614 LEU HDy% 1.0 . 4.74 4116 3128 B 614 LEU HDx% B 613 ARG HDx 1.0 . 4.74 4117 3128 B 613 ARG HDy B 614 LEU HDx% 1.0 . 4.74 4118 3129 B 614 LEU H B 614 LEU HBx 1.0 . 3.24 4119 3129 B 614 LEU H B 614 LEU HBy 1.0 . 3.24 4120 3130 B 614 LEU H B 614 LEU HDy% 1.0 . 3.77 4121 3130 B 614 LEU H B 614 LEU HDx% 1.0 . 3.77 4122 3131 B 614 LEU HA B 614 LEU HDy% 1.0 . 3.55 4123 3131 B 614 LEU HA B 614 LEU HDx% 1.0 . 3.55 4124 3132 B 614 LEU HBx B 614 LEU HDy% 1.0 . 2.68 4125 3132 B 614 LEU HDx% B 614 LEU HBx 1.0 . 2.68 4126 3132 B 614 LEU HDx% B 614 LEU HBy 1.0 . 2.68 4127 3132 B 614 LEU HBy B 614 LEU HDy% 1.0 . 2.68 4128 3133 B 615 GLY H B 614 LEU HBx 1.0 . 3.87 4129 3133 B 615 GLY H B 614 LEU HBy 1.0 . 3.87 4130 3134 B 615 GLY H B 614 LEU HDy% 1.0 . 4.13 4131 3134 B 615 GLY H B 614 LEU HDx% 1.0 . 4.13 4132 3135 B 619 PHE HD% B 614 LEU HDy% 1.0 . 4.30 4133 3135 B 619 PHE HD% B 614 LEU HDx% 1.0 . 4.30 4134 3136 B 621 TRP HZ3 B 614 LEU HDy% 1.0 . 4.83 4135 3136 B 621 TRP HZ3 B 614 LEU HDx% 1.0 . 4.83 4136 3137 B 621 TRP HH2 B 614 LEU HDy% 1.0 . 4.20 4137 3137 B 621 TRP HH2 B 614 LEU HDx% 1.0 . 4.20 4138 3138 B 616 ASN H B 616 ASN HBy 1.0 . 3.59 4139 3138 B 616 ASN H B 616 ASN HBx 1.0 . 3.59 4140 3139 B 616 ASN HBy B 616 ASN HD2x 1.0 . 3.22 4141 3139 B 616 ASN HBx B 616 ASN HD2x 1.0 . 3.22 4142 3139 B 616 ASN HD2y B 616 ASN HBy 1.0 . 3.22 4143 3139 B 616 ASN HBx B 616 ASN HD2y 1.0 . 3.22 4144 3140 B 617 ASP H B 616 ASN HBy 1.0 . 4.10 4145 3140 B 617 ASP H B 616 ASN HBx 1.0 . 4.10 4146 3141 B 616 ASN HD2x B 617 ASP HBy 1.0 . 4.17 4147 3141 B 616 ASN HD2y B 617 ASP HBy 1.0 . 4.17 4148 3141 B 617 ASP HBx B 616 ASN HD2x 1.0 . 4.17 4149 3141 B 616 ASN HD2y B 617 ASP HBx 1.0 . 4.17 4150 3142 B 617 ASP H B 617 ASP HBy 1.0 . 3.35 4151 3142 B 617 ASP H B 617 ASP HBx 1.0 . 3.35 4152 3143 B 617 ASP HA B 618 VAL HGy% 1.0 . 4.35 4153 3143 B 617 ASP HA B 618 VAL HGx% 1.0 . 4.35 4154 3144 B 618 VAL H B 617 ASP HBy 1.0 . 3.85 4155 3144 B 618 VAL H B 617 ASP HBx 1.0 . 3.85 4156 3145 B 617 ASP HBy B 618 VAL HGy% 1.0 . 5.11 4157 3145 B 617 ASP HBx B 618 VAL HGy% 1.0 . 5.11 4158 3145 B 618 VAL HGx% B 617 ASP HBy 1.0 . 5.11 4159 3145 B 618 VAL HGx% B 617 ASP HBx 1.0 . 5.11 4160 3146 B 618 VAL H B 618 VAL HGy% 1.0 . 3.31 4161 3146 B 618 VAL H B 618 VAL HGx% 1.0 . 3.31 4162 3147 B 619 PHE H B 618 VAL HGy% 1.0 . 3.98 4163 3147 B 619 PHE H B 618 VAL HGx% 1.0 . 3.98 4164 3148 B 618 VAL HGy% B 619 PHE HBx 1.0 . 4.20 4165 3148 B 618 VAL HGx% B 619 PHE HBx 1.0 . 4.20 4166 3148 B 619 PHE HBy B 618 VAL HGy% 1.0 . 4.20 4167 3148 B 618 VAL HGx% B 619 PHE HBy 1.0 . 4.20 4168 3149 B 619 PHE HD% B 618 VAL HGy% 1.0 . 3.75 4169 3149 B 619 PHE HD% B 618 VAL HGx% 1.0 . 3.75 4170 3150 B 619 PHE HE% B 618 VAL HGy% 1.0 . 4.34 4171 3150 B 618 VAL HGx% B 619 PHE HE% 1.0 . 4.34 4172 3151 B 619 PHE H B 619 PHE HBx 1.0 . 3.64 4173 3151 B 619 PHE H B 619 PHE HBy 1.0 . 3.64 4174 3152 B 621 TRP HE1 B 621 TRP HBx 1.0 . 4.78 4175 3152 B 621 TRP HE1 B 621 TRP HBy 1.0 . 4.78 4176 3153 B 621 TRP HD1 B 622 GLU HGy 1.0 . 4.56 4177 3153 B 621 TRP HD1 B 622 GLU HGx 1.0 . 4.56 4178 3154 B 621 TRP HE1 B 622 GLU HBy 1.0 . 5.34 4179 3154 B 621 TRP HE1 B 622 GLU HBx 1.0 . 5.34 4180 3155 B 621 TRP HE1 B 622 GLU HGy 1.0 . 5.34 4181 3155 B 621 TRP HE1 B 622 GLU HGx 1.0 . 5.34 4182 3156 B 622 GLU H B 622 GLU HGy 1.0 . 4.05 4183 3156 B 622 GLU H B 622 GLU HGx 1.0 . 4.05 4184 3157 B 623 ASP H B 622 GLU HBy 1.0 . 4.10 4185 3157 B 623 ASP H B 622 GLU HBx 1.0 . 4.10 4186 3158 B 623 ASP H B 623 ASP HBy 1.0 . 3.61 4187 3158 B 623 ASP H B 623 ASP HBx 1.0 . 3.61 4188 3159 B 625 GLU H B 625 GLU HBy 1.0 . 3.24 4189 3159 B 625 GLU H B 625 GLU HBx 1.0 . 3.24 4190 3160 B 625 GLU H B 625 GLU HGy 1.0 . 3.37 4191 3160 B 625 GLU H B 625 GLU HGx 1.0 . 3.37 4192 3161 B 625 GLU HA B 625 GLU HGy 1.0 . 3.50 4193 3161 B 625 GLU HA B 625 GLU HGx 1.0 . 3.50 4194 3162 B 626 SER HA B 625 GLU HGy 1.0 . 5.34 4195 3162 B 626 SER HA B 625 GLU HGx 1.0 . 5.34 4196 3163 B 626 SER H B 626 SER HBy 1.0 . 3.29 4197 3163 B 626 SER H B 626 SER HBx 1.0 . 3.29 4198 3164 B 626 SER HA B 627 ASP HBy 1.0 . 4.99 4199 3164 B 626 SER HA B 627 ASP HBx 1.0 . 4.99 4200 3165 B 628 GLU H B 626 SER HBy 1.0 . 4.13 4201 3165 B 628 GLU H B 626 SER HBx 1.0 . 4.13 4202 3166 B 628 GLU H B 627 ASP HBy 1.0 . 4.03 4203 3166 B 628 GLU H B 627 ASP HBx 1.0 . 4.03 4204 3167 B 630 ALA H B 627 ASP HBy 1.0 . 5.31 4205 3167 B 630 ALA H B 627 ASP HBx 1.0 . 5.31 4206 3168 B 630 ALA HB% B 627 ASP HBy 1.0 . 4.05 4207 3168 B 630 ALA HB% B 627 ASP HBx 1.0 . 4.05 4208 3169 B 628 GLU H B 628 GLU HBy 1.0 . 3.05 4209 3169 B 628 GLU H B 628 GLU HBx 1.0 . 3.05 4210 3170 B 628 GLU H B 628 GLU HGy 1.0 . 3.42 4211 3170 B 628 GLU H B 628 GLU HGx 1.0 . 3.42 4212 3171 B 628 GLU H B 629 ILE HG1x 1.0 . 4.53 4213 3171 B 628 GLU H B 629 ILE HG1y 1.0 . 4.53 4214 3172 B 628 GLU HBx B 628 GLU HGy 1.0 . 2.39 4215 3172 B 628 GLU HBy B 628 GLU HGy 1.0 . 2.39 4216 3172 B 628 GLU HGx B 628 GLU HBy 1.0 . 2.39 4217 3172 B 628 GLU HBx B 628 GLU HGx 1.0 . 2.39 4218 3173 B 629 ILE H B 628 GLU HBy 1.0 . 3.84 4219 3173 B 629 ILE H B 628 GLU HBx 1.0 . 3.84 4220 3174 B 630 ALA H B 628 GLU HBy 1.0 . 5.33 4221 3174 B 630 ALA H B 628 GLU HBx 1.0 . 5.33 4222 3175 B 629 ILE H B 628 GLU HGy 1.0 . 4.17 4223 3175 B 629 ILE H B 628 GLU HGx 1.0 . 4.17 4224 3176 B 629 ILE HD1% B 628 GLU HGy 1.0 . 4.50 4225 3176 B 629 ILE HD1% B 628 GLU HGx 1.0 . 4.50 4226 3177 B 630 ALA H B 628 GLU HGy 1.0 . 5.34 4227 3177 B 630 ALA H B 628 GLU HGx 1.0 . 5.34 4228 3178 B 629 ILE H B 629 ILE HG1x 1.0 . 3.67 4229 3178 B 629 ILE H B 629 ILE HG1y 1.0 . 3.67 4230 3179 B 630 ALA H B 629 ILE HG1x 1.0 . 4.79 4231 3179 B 630 ALA H B 629 ILE HG1y 1.0 . 4.79 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 2 LYS C A 3 SER N A 3 SER CA A 3 SER C 1.0 -146.3 -33.4 PHI 2 2 A 3 SER N A 3 SER CA A 3 SER C A 4 THR N 1.0 78.9 174.3 PSI 3 3 A 4 THR C A 5 PHE N A 5 PHE CA A 5 PHE C 1.0 -95.1 -19.8 PHI 4 4 A 5 PHE N A 5 PHE CA A 5 PHE C A 6 LYS N 1.0 -76.8 4.8 PSI 5 5 A 5 PHE C A 6 LYS N A 6 LYS CA A 6 LYS C 1.0 -100.4 -22.2 PHI 6 6 A 6 LYS N A 6 LYS CA A 6 LYS C A 7 SER N 1.0 -84.1 5.4 PSI 7 7 A 6 LYS C A 7 SER N A 7 SER CA A 7 SER C 1.0 -122.6 -25.8 PHI 8 8 A 7 SER N A 7 SER CA A 7 SER C A 8 GLU N 1.0 -80.0 4.9 PSI 9 9 A 7 SER C A 8 GLU N A 8 GLU CA A 8 GLU C 1.0 -131.8 -39.3 PHI 10 10 A 8 GLU N A 8 GLU CA A 8 GLU C A 9 TYR N 1.0 -80.9 15.3 PSI 11 11 A 8 GLU C A 9 TYR N A 9 TYR CA A 9 TYR C 1.0 -182.5 -83.5 PHI 12 12 A 9 TYR N A 9 TYR CA A 9 TYR C A 10 PRO N 1.0 81.2 193.8 PSI 13 13 A 10 PRO N A 10 PRO CA A 10 PRO C A 11 PHE N 1.0 108.3 182.8 PSI 14 14 A 10 PRO C A 11 PHE N A 11 PHE CA A 11 PHE C 1.0 -89.9 -10.3 PHI 15 15 A 11 PHE N A 11 PHE CA A 11 PHE C A 12 GLU N 1.0 -86.4 -5.4 PSI 16 16 A 11 PHE C A 12 GLU N A 12 GLU CA A 12 GLU C 1.0 -94.2 -23.8 PHI 17 17 A 12 GLU N A 12 GLU CA A 12 GLU C A 13 LYS N 1.0 -79.9 -4.8 PSI 18 18 A 12 GLU C A 13 LYS N A 13 LYS CA A 13 LYS C 1.0 -100.1 -28.8 PHI 19 19 A 13 LYS N A 13 LYS CA A 13 LYS C A 14 ARG N 1.0 -78.1 -2.9 PSI 20 20 A 13 LYS C A 14 ARG N A 14 ARG CA A 14 ARG C 1.0 -98.0 -28.0 PHI 21 21 A 14 ARG N A 14 ARG CA A 14 ARG C A 15 LYS N 1.0 -82.5 -5.2 PSI 22 22 A 14 ARG C A 15 LYS N A 15 LYS CA A 15 LYS C 1.0 -99.5 -29.1 PHI 23 23 A 15 LYS N A 15 LYS CA A 15 LYS C A 16 ALA N 1.0 -78.9 -0.1 PSI 24 24 A 15 LYS C A 16 ALA N A 16 ALA CA A 16 ALA C 1.0 -96.0 -24.9 PHI 25 25 A 16 ALA N A 16 ALA CA A 16 ALA C A 17 GLU N 1.0 -77.4 -5.8 PSI 26 26 A 16 ALA C A 17 GLU N A 17 GLU CA A 17 GLU C 1.0 -105.8 -29.9 PHI 27 27 A 17 GLU N A 17 GLU CA A 17 GLU C A 18 SER N 1.0 -74.5 -4.5 PSI 28 28 A 17 GLU C A 18 SER N A 18 SER CA A 18 SER C 1.0 -100.0 -29.0 PHI 29 29 A 18 SER N A 18 SER CA A 18 SER C A 19 GLU N 1.0 -78.3 -8.6 PSI 30 30 A 18 SER C A 19 GLU N A 19 GLU CA A 19 GLU C 1.0 -98.0 -32.3 PHI 31 31 A 19 GLU N A 19 GLU CA A 19 GLU C A 20 ARG N 1.0 -73.0 -6.0 PSI 32 32 A 19 GLU C A 20 ARG N A 20 ARG CA A 20 ARG C 1.0 -101.8 -29.3 PHI 33 33 A 20 ARG N A 20 ARG CA A 20 ARG C A 21 ILE N 1.0 -80.8 3.1 PSI 34 34 A 20 ARG C A 21 ILE N A 21 ILE CA A 21 ILE C 1.0 -99.0 -31.4 PHI 35 35 A 21 ILE N A 21 ILE CA A 21 ILE C A 22 ALA N 1.0 -75.1 -8.0 PSI 36 36 A 21 ILE C A 22 ALA N A 22 ALA CA A 22 ALA C 1.0 -98.6 -27.0 PHI 37 37 A 22 ALA N A 22 ALA CA A 22 ALA C A 23 ASP N 1.0 -75.1 -1.3 PSI 38 38 A 22 ALA C A 23 ASP N A 23 ASP CA A 23 ASP C 1.0 -106.2 -28.5 PHI 39 39 A 23 ASP N A 23 ASP CA A 23 ASP C A 24 ARG N 1.0 -70.4 -2.2 PSI 40 40 A 23 ASP C A 24 ARG N A 24 ARG CA A 24 ARG C 1.0 -125.7 -39.0 PHI 41 41 A 24 ARG N A 24 ARG CA A 24 ARG C A 25 PHE N 1.0 -76.3 24.4 PSI 42 42 A 24 ARG C A 25 PHE N A 25 PHE CA A 25 PHE C 1.0 -172.7 -78.8 PHI 43 43 A 25 PHE N A 25 PHE CA A 25 PHE C A 26 PRO N 1.0 29.3 124.8 PSI 44 44 A 26 PRO N A 26 PRO CA A 26 PRO C A 27 ASN N 1.0 -61.4 14.0 PSI 45 45 A 26 PRO C A 27 ASN N A 27 ASN CA A 27 ASN C 1.0 -135.0 -50.6 PHI 46 46 A 27 ASN N A 27 ASN CA A 27 ASN C A 28 ARG N 1.0 -53.5 51.9 PSI 47 47 A 27 ASN C A 28 ARG N A 28 ARG CA A 28 ARG C 1.0 -175.9 -74.3 PHI 48 48 A 28 ARG N A 28 ARG CA A 28 ARG C A 29 ILE N 1.0 114.1 198.0 PSI 49 49 A 28 ARG C A 29 ILE N A 29 ILE CA A 29 ILE C 1.0 -164.4 -53.0 PHI 50 50 A 29 ILE N A 29 ILE CA A 29 ILE C A 30 PRO N 1.0 91.1 184.4 PSI 51 51 A 30 PRO N A 30 PRO CA A 30 PRO C A 31 VAL N 1.0 97.5 187.3 PSI 52 52 A 30 PRO C A 31 VAL N A 31 VAL CA A 31 VAL C 1.0 -161.8 -78.8 PHI 53 53 A 31 VAL N A 31 VAL CA A 31 VAL C A 32 ILE N 1.0 95.1 173.0 PSI 54 54 A 31 VAL C A 32 ILE N A 32 ILE CA A 32 ILE C 1.0 -161.0 -64.5 PHI 55 55 A 32 ILE N A 32 ILE CA A 32 ILE C A 33 CYS N 1.0 80.9 167.9 PSI 56 56 A 32 ILE C A 33 CYS N A 33 CYS CA A 33 CYS C 1.0 -145.1 -64.7 PHI 57 57 A 33 CYS N A 33 CYS CA A 33 CYS C A 34 GLU N 1.0 93.2 168.6 PSI 58 58 A 33 CYS C A 34 GLU N A 34 GLU CA A 34 GLU C 1.0 -175.5 -88.4 PHI 59 59 A 34 GLU N A 34 GLU CA A 34 GLU C A 35 LYS N 1.0 112.1 191.0 PSI 60 60 A 34 GLU C A 35 LYS N A 35 LYS CA A 35 LYS C 1.0 -134.9 -52.8 PHI 61 61 A 35 LYS N A 35 LYS CA A 35 LYS C A 36 ALA N 1.0 92.1 172.6 PSI 62 62 A 35 LYS C A 36 ALA N A 36 ALA CA A 36 ALA C 1.0 -119.9 -36.4 PHI 63 63 A 36 ALA N A 36 ALA CA A 36 ALA C A 37 GLU N 1.0 90.3 186.4 PSI 64 64 A 36 ALA C A 37 GLU N A 37 GLU CA A 37 GLU C 1.0 -96.4 -23.2 PHI 65 65 A 37 GLU N A 37 GLU CA A 37 GLU C A 38 LYS N 1.0 -73.6 7.4 PSI 66 66 A 37 GLU C A 38 LYS N A 38 LYS CA A 38 LYS C 1.0 -140.6 -38.0 PHI 67 67 A 38 LYS N A 38 LYS CA A 38 LYS C A 39 SER N 1.0 -53.1 53.1 PSI 68 68 A 38 LYS C A 39 SER N A 39 SER CA A 39 SER C 1.0 -141.5 -37.8 PHI 69 69 A 39 SER N A 39 SER CA A 39 SER C A 40 ASP N 1.0 95.4 175.3 PSI 70 70 A 40 ASP C A 41 ILE N A 41 ILE CA A 41 ILE C 1.0 -163.8 -56.8 PHI 71 71 A 41 ILE N A 41 ILE CA A 41 ILE C A 42 PRO N 1.0 83.8 187.3 PSI 72 72 A 42 PRO N A 42 PRO CA A 42 PRO C A 43 GLU N 1.0 103.2 190.8 PSI 73 73 A 42 PRO C A 43 GLU N A 43 GLU CA A 43 GLU C 1.0 -153.3 -46.3 PHI 74 74 A 43 GLU N A 43 GLU CA A 43 GLU C A 44 ILE N 1.0 82.5 179.1 PSI 75 75 A 43 GLU C A 44 ILE N A 44 ILE CA A 44 ILE C 1.0 -177.3 -52.3 PHI 76 76 A 44 ILE N A 44 ILE CA A 44 ILE C A 45 ASP N 1.0 80.8 200.2 PSI 77 77 A 45 ASP C A 46 LYS N A 46 LYS CA A 46 LYS C 1.0 -168.6 -58.8 PHI 78 78 A 46 LYS N A 46 LYS CA A 46 LYS C A 47 ARG N 1.0 91.5 183.7 PSI 79 79 A 46 LYS C A 47 ARG N A 47 ARG CA A 47 ARG C 1.0 -168.9 -63.8 PHI 80 80 A 47 ARG N A 47 ARG CA A 47 ARG C A 48 LYS N 1.0 98.0 176.3 PSI 81 81 A 47 ARG C A 48 LYS N A 48 LYS CA A 48 LYS C 1.0 -164.5 -62.7 PHI 82 82 A 48 LYS N A 48 LYS CA A 48 LYS C A 49 TYR N 1.0 86.8 178.8 PSI 83 83 A 48 LYS C A 49 TYR N A 49 TYR CA A 49 TYR C 1.0 -162.9 -82.9 PHI 84 84 A 49 TYR N A 49 TYR CA A 49 TYR C A 50 LEU N 1.0 91.0 180.4 PSI 85 85 A 49 TYR C A 50 LEU N A 50 LEU CA A 50 LEU C 1.0 -140.1 -57.2 PHI 86 86 A 50 LEU N A 50 LEU CA A 50 LEU C A 51 VAL N 1.0 78.3 168.5 PSI 87 87 A 50 LEU C A 51 VAL N A 51 VAL CA A 51 VAL C 1.0 -149.0 -42.0 PHI 88 88 A 51 VAL N A 51 VAL CA A 51 VAL C A 52 PRO N 1.0 81.8 178.5 PSI 89 89 A 52 PRO N A 52 PRO CA A 52 PRO C A 53 ALA N 1.0 102.8 181.4 PSI 90 90 A 52 PRO C A 53 ALA N A 53 ALA CA A 53 ALA C 1.0 -97.3 -24.2 PHI 91 91 A 53 ALA N A 53 ALA CA A 53 ALA C A 54 ASP N 1.0 -64.3 17.8 PSI 92 92 A 53 ALA C A 54 ASP N A 54 ASP CA A 54 ASP C 1.0 -133.5 -56.8 PHI 93 93 A 54 ASP N A 54 ASP CA A 54 ASP C A 55 LEU N 1.0 -37.5 42.0 PSI 94 94 A 54 ASP C A 55 LEU N A 55 LEU CA A 55 LEU C 1.0 -114.1 -26.6 PHI 95 95 A 55 LEU N A 55 LEU CA A 55 LEU C A 56 THR N 1.0 110.8 187.4 PSI 96 96 A 55 LEU C A 56 THR N A 56 THR CA A 56 THR C 1.0 -134.8 -46.2 PHI 97 97 A 56 THR N A 56 THR CA A 56 THR C A 57 VAL N 1.0 129.2 201.6 PSI 98 98 A 56 THR C A 57 VAL N A 57 VAL CA A 57 VAL C 1.0 -100.4 -25.3 PHI 99 99 A 57 VAL N A 57 VAL CA A 57 VAL C A 58 GLY N 1.0 -74.8 -2.7 PSI 100 100 A 57 VAL C A 58 GLY N A 58 GLY CA A 58 GLY C 1.0 -98.2 -30.1 PHI 101 101 A 58 GLY N A 58 GLY CA A 58 GLY C A 59 GLN N 1.0 -78.0 -5.1 PSI 102 102 A 58 GLY C A 59 GLN N A 59 GLN CA A 59 GLN C 1.0 -99.1 -32.2 PHI 103 103 A 59 GLN N A 59 GLN CA A 59 GLN C A 60 PHE N 1.0 -75.9 -9.0 PSI 104 104 A 59 GLN C A 60 PHE N A 60 PHE CA A 60 PHE C 1.0 -119.3 -27.2 PHI 105 105 A 60 PHE N A 60 PHE CA A 60 PHE C A 61 VAL N 1.0 -80.5 3.8 PSI 106 106 A 60 PHE C A 61 VAL N A 61 VAL CA A 61 VAL C 1.0 -95.5 -26.4 PHI 107 107 A 61 VAL N A 61 VAL CA A 61 VAL C A 62 TYR N 1.0 -79.0 -8.3 PSI 108 108 A 61 VAL C A 62 TYR N A 62 TYR CA A 62 TYR C 1.0 -93.0 -25.6 PHI 109 109 A 62 TYR N A 62 TYR CA A 62 TYR C A 63 VAL N 1.0 -73.6 -3.4 PSI 110 110 A 62 TYR C A 63 VAL N A 63 VAL CA A 63 VAL C 1.0 -101.7 -27.2 PHI 111 111 A 63 VAL N A 63 VAL CA A 63 VAL C A 64 ILE N 1.0 -80.8 -5.1 PSI 112 112 A 63 VAL C A 64 ILE N A 64 ILE CA A 64 ILE C 1.0 -101.7 -26.0 PHI 113 113 A 64 ILE N A 64 ILE CA A 64 ILE C A 65 ARG N 1.0 -83.5 -2.8 PSI 114 114 A 64 ILE C A 65 ARG N A 65 ARG CA A 65 ARG C 1.0 -101.3 -26.0 PHI 115 115 A 65 ARG N A 65 ARG CA A 65 ARG C A 66 LYS N 1.0 -77.3 -3.5 PSI 116 116 A 65 ARG C A 66 LYS N A 66 LYS CA A 66 LYS C 1.0 -97.8 -28.3 PHI 117 117 A 66 LYS N A 66 LYS CA A 66 LYS C A 67 ARG N 1.0 -77.5 -2.4 PSI 118 118 A 66 LYS C A 67 ARG N A 67 ARG CA A 67 ARG C 1.0 -103.2 -26.2 PHI 119 119 A 67 ARG N A 67 ARG CA A 67 ARG C A 68 ILE N 1.0 -73.5 0.9 PSI 120 120 A 67 ARG C A 68 ILE N A 68 ILE CA A 68 ILE C 1.0 -139.1 -50.6 PHI 121 121 A 68 ILE N A 68 ILE CA A 68 ILE C A 69 MET N 1.0 -45.8 42.0 PSI 122 122 A 68 ILE C A 69 MET N A 69 MET CA A 69 MET C 1.0 11.6 116.0 PHI 123 123 A 69 MET N A 69 MET CA A 69 MET C A 70 LEU N 1.0 -13.7 80.6 PSI 124 124 A 69 MET C A 70 LEU N A 70 LEU CA A 70 LEU C 1.0 -153.4 -49.0 PHI 125 125 A 70 LEU N A 70 LEU CA A 70 LEU C A 71 PRO N 1.0 93.4 172.1 PSI 126 126 A 71 PRO N A 71 PRO CA A 71 PRO C A 72 PRO N 1.0 100.5 186.1 PSI 127 127 A 72 PRO N A 72 PRO CA A 72 PRO C A 73 GLU N 1.0 -72.4 7.3 PSI 128 128 A 72 PRO C A 73 GLU N A 73 GLU CA A 73 GLU C 1.0 -133.2 -39.0 PHI 129 129 A 73 GLU N A 73 GLU CA A 73 GLU C A 74 LYS N 1.0 -46.3 43.5 PSI 130 130 A 73 GLU C A 74 LYS N A 74 LYS CA A 74 LYS C 1.0 -135.1 -40.2 PHI 131 131 A 74 LYS N A 74 LYS CA A 74 LYS C A 75 ALA N 1.0 89.5 180.9 PSI 132 132 A 74 LYS C A 75 ALA N A 75 ALA CA A 75 ALA C 1.0 -158.2 -43.5 PHI 133 133 A 75 ALA N A 75 ALA CA A 75 ALA C A 76 ILE N 1.0 88.4 202.2 PSI 134 134 A 75 ALA C A 76 ILE N A 76 ILE CA A 76 ILE C 1.0 -188.7 -89.3 PHI 135 135 A 76 ILE N A 76 ILE CA A 76 ILE C A 77 PHE N 1.0 96.4 194.9 PSI 136 136 A 76 ILE C A 77 PHE N A 77 PHE CA A 77 PHE C 1.0 -163.3 -74.9 PHI 137 137 A 77 PHE N A 77 PHE CA A 77 PHE C A 78 ILE N 1.0 104.0 187.0 PSI 138 138 A 77 PHE C A 78 ILE N A 78 ILE CA A 78 ILE C 1.0 -164.0 -84.8 PHI 139 139 A 78 ILE N A 78 ILE CA A 78 ILE C A 79 PHE N 1.0 101.7 189.2 PSI 140 140 A 78 ILE C A 79 PHE N A 79 PHE CA A 79 PHE C 1.0 -170.7 -79.0 PHI 141 141 A 79 PHE N A 79 PHE CA A 79 PHE C A 80 VAL N 1.0 108.6 196.1 PSI 142 142 A 79 PHE C A 80 VAL N A 80 VAL CA A 80 VAL C 1.0 -172.6 -76.9 PHI 143 143 A 80 VAL N A 80 VAL CA A 80 VAL C A 81 ASN N 1.0 80.7 172.5 PSI 144 144 A 82 ASP C A 83 THR N A 83 THR CA A 83 THR C 1.0 -169.9 -75.0 PHI 145 145 A 83 THR N A 83 THR CA A 83 THR C A 84 LEU N 1.0 97.1 181.3 PSI 146 146 A 83 THR C A 84 LEU N A 84 LEU CA A 84 LEU C 1.0 -157.2 -54.5 PHI 147 147 A 84 LEU N A 84 LEU CA A 84 LEU C A 85 PRO N 1.0 69.7 177.5 PSI 148 148 A 85 PRO N A 85 PRO CA A 85 PRO C A 86 PRO N 1.0 106.1 189.8 PSI 149 149 A 86 PRO C A 87 THR N A 87 THR CA A 87 THR C 1.0 -97.2 -18.7 PHI 150 150 A 87 THR N A 87 THR CA A 87 THR C A 88 ALA N 1.0 -73.6 15.7 PSI 151 151 A 87 THR C A 88 ALA N A 88 ALA CA A 88 ALA C 1.0 -128.6 -37.2 PHI 152 152 A 88 ALA N A 88 ALA CA A 88 ALA C A 89 ALA N 1.0 -58.7 25.9 PSI 153 153 A 88 ALA C A 89 ALA N A 89 ALA CA A 89 ALA C 1.0 -156.1 -51.8 PHI 154 154 A 89 ALA N A 89 ALA CA A 89 ALA C A 90 LEU N 1.0 -66.2 57.4 PSI 155 155 A 90 LEU C A 91 MET N A 91 MET CA A 91 MET C 1.0 -101.2 -26.0 PHI 156 156 A 91 MET N A 91 MET CA A 91 MET C A 92 SER N 1.0 -78.3 10.1 PSI 157 157 A 91 MET C A 92 SER N A 92 SER CA A 92 SER C 1.0 -98.7 -31.5 PHI 158 158 A 92 SER N A 92 SER CA A 92 SER C A 93 ALA N 1.0 -73.2 -4.9 PSI 159 159 A 92 SER C A 93 ALA N A 93 ALA CA A 93 ALA C 1.0 -99.1 -30.2 PHI 160 160 A 93 ALA N A 93 ALA CA A 93 ALA C A 94 ILE N 1.0 -80.1 -8.6 PSI 161 161 A 93 ALA C A 94 ILE N A 94 ILE CA A 94 ILE C 1.0 -107.5 -29.7 PHI 162 162 A 94 ILE N A 94 ILE CA A 94 ILE C A 95 TYR N 1.0 -75.9 2.0 PSI 163 163 A 94 ILE C A 95 TYR N A 95 TYR CA A 95 TYR C 1.0 -100.3 -27.1 PHI 164 164 A 95 TYR N A 95 TYR CA A 95 TYR C A 96 GLN N 1.0 -76.3 -6.6 PSI 165 165 A 95 TYR C A 96 GLN N A 96 GLN CA A 96 GLN C 1.0 -104.0 -26.9 PHI 166 166 A 96 GLN N A 96 GLN CA A 96 GLN C A 97 GLU N 1.0 -80.0 8.6 PSI 167 167 A 96 GLN C A 97 GLU N A 97 GLU CA A 97 GLU C 1.0 -120.4 -35.0 PHI 168 168 A 97 GLU N A 97 GLU CA A 97 GLU C A 98 HIS N 1.0 -73.3 8.4 PSI 169 169 A 97 GLU C A 98 HIS N A 98 HIS CA A 98 HIS C 1.0 -144.1 -45.2 PHI 170 170 A 98 HIS N A 98 HIS CA A 98 HIS C A 99 LYS N 1.0 -61.3 25.2 PSI 171 171 A 99 LYS C A 100 ASP N A 100 ASP CA A 100 ASP C 1.0 -149.7 -31.5 PHI 172 172 A 100 ASP N A 100 ASP CA A 100 ASP C A 101 LYS N 1.0 79.1 178.2 PSI 173 173 A 100 ASP C A 101 LYS N A 101 LYS CA A 101 LYS C 1.0 -96.8 -27.4 PHI 174 174 A 101 LYS N A 101 LYS CA A 101 LYS C A 102 ASP N 1.0 -71.3 12.3 PSI 175 175 A 101 LYS C A 102 ASP N A 102 ASP CA A 102 ASP C 1.0 -128.5 -44.9 PHI 176 176 A 102 ASP N A 102 ASP CA A 102 ASP C A 103 GLY N 1.0 -44.6 53.0 PSI 177 177 A 102 ASP C A 103 GLY N A 103 GLY CA A 103 GLY C 1.0 55.7 146.8 PHI 178 178 A 103 GLY N A 103 GLY CA A 103 GLY C A 104 PHE N 1.0 -39.3 39.8 PSI 179 179 A 104 PHE C A 105 LEU N A 105 LEU CA A 105 LEU C 1.0 -173.0 -61.2 PHI 180 180 A 105 LEU N A 105 LEU CA A 105 LEU C A 106 TYR N 1.0 92.9 184.7 PSI 181 181 A 105 LEU C A 106 TYR N A 106 TYR CA A 106 TYR C 1.0 -144.9 -42.3 PHI 182 182 A 106 TYR N A 106 TYR CA A 106 TYR C A 107 VAL N 1.0 88.8 175.6 PSI 183 183 A 106 TYR C A 107 VAL N A 107 VAL CA A 107 VAL C 1.0 -160.5 -76.0 PHI 184 184 A 107 VAL N A 107 VAL CA A 107 VAL C A 108 THR N 1.0 97.7 189.3 PSI 185 185 A 107 VAL C A 108 THR N A 108 THR CA A 108 THR C 1.0 -161.6 -83.1 PHI 186 186 A 108 THR N A 108 THR CA A 108 THR C A 109 TYR N 1.0 102.3 189.5 PSI 187 187 A 108 THR C A 109 TYR N A 109 TYR CA A 109 TYR C 1.0 -173.6 -95.1 PHI 188 188 A 109 TYR N A 109 TYR CA A 109 TYR C A 110 SER N 1.0 115.9 199.6 PSI 189 189 A 109 TYR C A 110 SER N A 110 SER CA A 110 SER C 1.0 -189.3 -95.7 PHI 190 190 A 110 SER N A 110 SER CA A 110 SER C A 111 GLY N 1.0 111.5 192.6 PSI 191 191 A 111 GLY C A 112 GLU N A 112 GLU CA A 112 GLU C 1.0 -172.9 -64.2 PHI 192 192 A 112 GLU N A 112 GLU CA A 112 GLU C A 113 ASN N 1.0 112.6 198.6 PSI 193 193 A 114 THR C A 115 PHE N A 115 PHE CA A 115 PHE C 1.0 -146.2 -23.0 PHI 194 194 A 115 PHE N A 115 PHE CA A 115 PHE C A 116 GLY N 1.0 60.9 189.2 PSI 195 195 B 598 PRO N B 598 PRO CA B 598 PRO C B 599 HIS N 1.0 107.2 187.7 PSI 196 196 B 598 PRO C B 599 HIS N B 599 HIS CA B 599 HIS C 1.0 -153.3 -43.4 PHI 197 197 B 599 HIS N B 599 HIS CA B 599 HIS C B 600 MET N 1.0 81.7 175.7 PSI 198 198 B 620 GLU C B 621 TRP N B 621 TRP CA B 621 TRP C 1.0 -166.9 -42.7 PHI 199 199 B 621 TRP N B 621 TRP CA B 621 TRP C B 622 GLU N 1.0 85.0 190.9 PSI 200 200 B 623 ASP C B 624 ASP N B 624 ASP CA B 624 ASP C 1.0 -112.4 -31.0 PHI 201 201 B 624 ASP N B 624 ASP CA B 624 ASP C B 625 GLU N 1.0 -82.5 21.0 PSI 202 202 B 624 ASP C B 625 GLU N B 625 GLU CA B 625 GLU C 1.0 -140.9 -27.3 PHI 203 203 B 625 GLU N B 625 GLU CA B 625 GLU C B 626 SER N 1.0 -76.2 20.5 PSI 204 204 B 626 SER C B 627 ASP N B 627 ASP CA B 627 ASP C 1.0 -111.9 -30.9 PHI 205 205 B 627 ASP N B 627 ASP CA B 627 ASP C B 628 GLU N 1.0 -79.4 23.7 PSI stop_ save_