data_nef_c19431_2mc8 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 4HYZ stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 GLU middle . . 3 A 3 ILE middle . . 4 A 4 LEU middle . . 5 A 5 LYS middle . . 6 A 6 GLU middle . . 7 A 7 LEU middle . . 8 A 8 PRO middle . false 9 A 9 GLU middle . . 10 A 10 GLY middle . false 11 A 11 PHE middle . . 12 A 12 ASP middle . . 13 A 13 LYS middle . . 14 A 14 GLU middle . . 15 A 15 THR middle . . 16 A 16 VAL middle . . 17 A 17 ARG middle . . 18 A 18 LYS middle . . 19 A 19 GLN middle . . 20 A 20 ALA middle . . 21 A 21 MET middle . . 22 A 22 GLU middle . . 23 A 23 ASP middle . . 24 A 24 ILE middle . . 25 A 25 GLU middle . . 26 A 26 ILE middle . . 27 A 27 ALA middle . . 28 A 28 GLN middle . . 29 A 29 SER middle . . 30 A 30 LYS middle . . 31 A 31 ASP middle . . 32 A 32 TYR middle . . 33 A 33 GLU middle . . 34 A 34 SER middle . . 35 A 35 TRP middle . . 36 A 36 LYS middle . . 37 A 37 SER middle . . 38 A 38 ARG middle . . 39 A 39 PHE middle . . 40 A 40 THR middle . . 41 A 41 LYS middle . . 42 A 42 ASP middle . . 43 A 43 LEU middle . . 44 A 44 GLN middle . . 45 A 45 SER middle . . 46 A 46 SER middle . . 47 A 47 LEU middle . . 48 A 48 THR middle . . 49 A 49 GLU middle . . 50 A 50 GLU middle . . 51 A 51 SER middle . . 52 A 52 TYR middle . . 53 A 53 ASP middle . . 54 A 54 SER middle . . 55 A 55 TYR middle . . 56 A 56 LEU middle . . 57 A 57 LYS middle . . 58 A 58 ILE middle . . 59 A 59 LEU middle . . 60 A 60 GLU middle . . 61 A 61 LYS middle . . 62 A 62 GLN middle . . 63 A 63 GLY middle . false 64 A 64 GLU middle . . 65 A 65 PHE middle . . 66 A 66 LYS middle . . 67 A 67 GLU middle . . 68 A 68 PHE middle . . 69 A 69 GLY middle . false 70 A 70 LYS middle . . 71 A 71 CYS middle . . 72 A 72 THR middle . . 73 A 73 TYR middle . . 74 A 74 LEU middle . . 75 A 75 GLY middle . false 76 A 76 GLN middle . . 77 A 77 ILE middle . . 78 A 78 LYS middle . . 79 A 79 ASP middle . . 80 A 80 ASN middle . . 81 A 81 LYS middle . . 82 A 82 LYS middle . . 83 A 83 TYR middle . . 84 A 84 GLY middle . false 85 A 85 GLY middle . false 86 A 86 VAL middle . . 87 A 87 ILE middle . . 88 A 88 ILE middle . . 89 A 89 VAL middle . . 90 A 90 VAL middle . . 91 A 91 LYS middle . . 92 A 92 TYR middle . . 93 A 93 GLU middle . . 94 A 94 GLU middle . . 95 A 95 GLY middle . false 96 A 96 ASN middle . . 97 A 97 VAL middle . . 98 A 98 ASN middle . . 99 A 99 TYR middle . . 100 A 100 SER middle . . 101 A 101 LEU middle . . 102 A 102 ALA middle . . 103 A 103 TYR middle . . 104 A 104 ASP middle . . 105 A 105 GLU middle . . 106 A 106 ASP middle . . 107 A 107 MET middle . . 108 A 108 ASN middle . . 109 A 109 LEU middle . . 110 A 110 VAL middle . . 111 A 111 SER middle . . 112 A 112 PHE middle . . 113 A 113 THR middle . . 114 A 114 MET end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 GLU HA H 1 4.446 0.007 A 2 GLU HBx H 1 1.849 0.007 A 2 GLU HBy H 1 1.995 0.007 A 2 GLU HGx H 1 2.143 0.007 A 2 GLU HGy H 1 2.187 0.007 A 2 GLU CA C 13 53.359 0.172 A 2 GLU CB C 13 29.108 0.172 A 2 GLU CG C 13 33.418 0.172 A 3 ILE H H 1 8.436 0.007 A 3 ILE HA H 1 4.358 0.007 A 3 ILE HB H 1 1.790 0.007 A 3 ILE HD1% H 1 0.723 0.007 A 3 ILE HG1x H 1 1.149 0.007 A 3 ILE HG1y H 1 1.441 0.007 A 3 ILE HG2% H 1 0.864 0.007 A 3 ILE CA C 13 57.727 0.172 A 3 ILE CB C 13 35.665 0.172 A 3 ILE CD1 C 13 9.384 0.172 A 3 ILE CG1 C 13 24.801 0.172 A 3 ILE CG2 C 13 15.306 0.172 A 3 ILE N N 15 123.144 0.125 A 4 LEU H H 1 8.743 0.007 A 4 LEU HA H 1 4.554 0.007 A 4 LEU HB2 H 1 1.574 0.007 A 4 LEU HB3 H 1 1.574 0.007 A 4 LEU HDx% H 1 0.764 0.007 A 4 LEU HD2% H 1 0.773 0.007 A 4 LEU HG H 1 1.520 0.007 A 4 LEU CA C 13 51.011 0.172 A 4 LEU CB C 13 41.209 0.172 A 4 LEU CDx C 13 20.243 0.172 A 4 LEU CDy C 13 22.587 0.172 A 4 LEU CG C 13 24.816 0.172 A 4 LEU N N 15 127.461 0.125 A 5 LYS H H 1 8.623 0.007 A 5 LYS HA H 1 4.436 0.007 A 5 LYS HBy H 1 1.997 0.007 A 5 LYS HBx H 1 1.671 0.007 A 5 LYS HD2 H 1 1.646 0.007 A 5 LYS HD3 H 1 1.646 0.007 A 5 LYS HE2 H 1 2.943 0.007 A 5 LYS HE3 H 1 2.943 0.007 A 5 LYS HGy H 1 1.446 0.007 A 5 LYS HGx H 1 1.359 0.007 A 5 LYS CA C 13 53.150 0.172 A 5 LYS CB C 13 29.359 0.172 A 5 LYS CD C 13 26.522 0.172 A 5 LYS CE C 13 39.688 0.172 A 5 LYS CG C 13 22.402 0.172 A 5 LYS N N 15 121.611 0.125 A 6 GLU H H 1 7.301 0.007 A 6 GLU HA H 1 4.269 0.007 A 6 GLU HBy H 1 2.017 0.007 A 6 GLU HBx H 1 1.990 0.007 A 6 GLU HGx H 1 2.037 0.007 A 6 GLU HGy H 1 2.080 0.007 A 6 GLU CA C 13 51.331 0.172 A 6 GLU CB C 13 29.583 0.172 A 6 GLU CG C 13 32.699 0.172 A 6 GLU N N 15 115.825 0.125 A 7 LEU H H 1 8.501 0.007 A 7 LEU HA H 1 4.311 0.007 A 7 LEU HBy H 1 1.490 0.007 A 7 LEU HBx H 1 1.342 0.007 A 7 LEU HDx% H 1 0.625 0.007 A 7 LEU HDy% H 1 0.992 0.007 A 7 LEU HG H 1 1.692 0.007 A 7 LEU CA C 13 50.182 0.172 A 7 LEU CB C 13 39.422 0.172 A 7 LEU CDy C 13 23.346 0.172 A 7 LEU CDx C 13 21.838 0.172 A 7 LEU CG C 13 24.203 0.172 A 7 LEU N N 15 118.967 0.125 A 8 PRO HA H 1 4.432 0.007 A 8 PRO HBx H 1 1.883 0.007 A 8 PRO HBy H 1 2.278 0.007 A 8 PRO HDx H 1 2.971 0.007 A 8 PRO HDy H 1 3.975 0.007 A 8 PRO HGx H 1 1.708 0.007 A 8 PRO HGy H 1 1.772 0.007 A 8 PRO CA C 13 59.119 0.172 A 8 PRO CB C 13 29.306 0.172 A 8 PRO CD C 13 48.008 0.172 A 8 PRO CG C 13 25.049 0.172 A 9 GLU H H 1 8.534 0.007 A 9 GLU HA H 1 4.033 0.007 A 9 GLU HB2 H 1 1.864 0.007 A 9 GLU HB3 H 1 1.864 0.007 A 9 GLU HG2 H 1 2.257 0.007 A 9 GLU HG3 H 1 2.257 0.007 A 9 GLU CA C 13 55.281 0.172 A 9 GLU CB C 13 26.864 0.172 A 9 GLU CG C 13 33.767 0.172 A 9 GLU N N 15 121.059 0.125 A 10 GLY H H 1 8.707 0.007 A 10 GLY HAy H 1 4.186 0.007 A 10 GLY HAx H 1 3.386 0.007 A 10 GLY CA C 13 42.029 0.172 A 10 GLY N N 15 112.279 0.125 A 11 PHE H H 1 7.543 0.007 A 11 PHE HA H 1 4.660 0.007 A 11 PHE HBy H 1 2.979 0.007 A 11 PHE HBx H 1 2.610 0.007 A 11 PHE HDy H 1 7.099 0.007 A 11 PHE HDx H 1 6.983 0.007 A 11 PHE CA C 13 54.280 0.172 A 11 PHE CB C 13 39.721 0.172 A 11 PHE CDx C 13 129.170 0.172 A 11 PHE CDy C 13 129.174 0.172 A 11 PHE N N 15 117.612 0.125 A 12 ASP H H 1 8.590 0.007 A 12 ASP HA H 1 4.875 0.007 A 12 ASP HBx H 1 2.524 0.007 A 12 ASP HBy H 1 2.562 0.007 A 12 ASP CA C 13 49.676 0.172 A 12 ASP CB C 13 42.307 0.172 A 12 ASP N N 15 121.568 0.125 A 13 LYS H H 1 8.692 0.007 A 13 LYS HA H 1 3.294 0.007 A 13 LYS HBx H 1 1.353 0.007 A 13 LYS HBy H 1 1.445 0.007 A 13 LYS HD2 H 1 1.349 0.007 A 13 LYS HD3 H 1 1.349 0.007 A 13 LYS HEx H 1 2.656 0.007 A 13 LYS HEy H 1 2.745 0.007 A 13 LYS HGx H 1 0.156 0.007 A 13 LYS HGy H 1 1.031 0.007 A 13 LYS CA C 13 58.046 0.172 A 13 LYS CB C 13 30.216 0.172 A 13 LYS CD C 13 27.058 0.172 A 13 LYS CE C 13 39.800 0.172 A 13 LYS CG C 13 22.877 0.172 A 13 LYS N N 15 125.770 0.125 A 14 GLU H H 1 8.343 0.007 A 14 GLU HA H 1 4.090 0.007 A 14 GLU HB2 H 1 2.017 0.007 A 14 GLU HB3 H 1 2.017 0.007 A 14 GLU HG2 H 1 2.218 0.007 A 14 GLU HG3 H 1 2.218 0.007 A 14 GLU CA C 13 56.364 0.172 A 14 GLU CB C 13 26.479 0.172 A 14 GLU CG C 13 33.660 0.172 A 14 GLU N N 15 118.590 0.125 A 15 THR H H 1 8.015 0.007 A 15 THR HA H 1 3.737 0.007 A 15 THR HB H 1 4.377 0.007 A 15 THR HG2% H 1 1.137 0.007 A 15 THR CA C 13 63.974 0.172 A 15 THR CB C 13 65.565 0.172 A 15 THR CG2 C 13 18.994 0.172 A 15 THR N N 15 118.372 0.125 A 16 VAL H H 1 8.342 0.007 A 16 VAL HA H 1 3.329 0.007 A 16 VAL HB H 1 2.125 0.007 A 16 VAL HGx% H 1 1.081 0.007 A 16 VAL HG2% H 1 0.948 0.007 A 16 VAL CA C 13 64.214 0.172 A 16 VAL CB C 13 29.011 0.172 A 16 VAL CG1 C 13 21.296 0.172 A 16 VAL CGx C 13 19.116 0.172 A 16 VAL CGy C 13 21.296 0.172 A 16 VAL N N 15 121.083 0.125 A 17 ARG H H 1 8.353 0.007 A 17 ARG HA H 1 3.737 0.007 A 17 ARG HBy H 1 2.256 0.007 A 17 ARG HBx H 1 1.838 0.007 A 17 ARG HDx H 1 3.134 0.007 A 17 ARG HDy H 1 3.291 0.007 A 17 ARG HGy H 1 1.518 0.007 A 17 ARG HGx H 1 1.369 0.007 A 17 ARG CA C 13 58.049 0.172 A 17 ARG CB C 13 27.401 0.172 A 17 ARG CD C 13 40.818 0.172 A 17 ARG CG C 13 25.608 0.172 A 17 ARG N N 15 119.409 0.125 A 18 LYS H H 1 8.028 0.007 A 18 LYS HA H 1 3.800 0.007 A 18 LYS HBx H 1 1.730 0.007 A 18 LYS HBy H 1 1.778 0.007 A 18 LYS HD2 H 1 1.564 0.007 A 18 LYS HD3 H 1 1.564 0.007 A 18 LYS HEy H 1 2.889 0.007 A 18 LYS HEx H 1 2.857 0.007 A 18 LYS HG2 H 1 1.468 0.007 A 18 LYS HG3 H 1 1.468 0.007 A 18 LYS CA C 13 57.031 0.172 A 18 LYS CB C 13 29.801 0.172 A 18 LYS CD C 13 26.823 0.172 A 18 LYS CE C 13 39.626 0.172 A 18 LYS CG C 13 22.673 0.172 A 18 LYS N N 15 116.168 0.125 A 19 GLN H H 1 8.140 0.007 A 19 GLN HA H 1 3.767 0.007 A 19 GLN HBy H 1 1.841 0.007 A 19 GLN HBx H 1 1.437 0.007 A 19 GLN HE2x H 1 7.163 0.007 A 19 GLN HE2y H 1 7.626 0.007 A 19 GLN HGy H 1 2.600 0.007 A 19 GLN HGx H 1 1.729 0.007 A 19 GLN CA C 13 54.492 0.172 A 19 GLN CB C 13 26.490 0.172 A 19 GLN CG C 13 31.816 0.172 A 19 GLN N N 15 120.008 0.125 A 19 GLN NE2 N 15 119.890 0.125 A 20 ALA H H 1 8.478 0.007 A 20 ALA HA H 1 4.404 0.007 A 20 ALA HB% H 1 1.380 0.007 A 20 ALA CA C 13 52.036 0.172 A 20 ALA CB C 13 16.407 0.172 A 20 ALA N N 15 122.405 0.125 A 21 MET H H 1 7.666 0.007 A 21 MET HA H 1 3.354 0.007 A 21 MET HBy H 1 1.773 0.007 A 21 MET HBx H 1 1.349 0.007 A 21 MET HE% H 1 1.778 0.007 A 21 MET HGy H 1 2.244 0.007 A 21 MET HGx H 1 0.417 0.007 A 21 MET CA C 13 56.861 0.172 A 21 MET CB C 13 30.538 0.172 A 21 MET CE C 13 13.794 0.172 A 21 MET CG C 13 28.351 0.172 A 21 MET N N 15 115.042 0.125 A 22 GLU H H 1 7.587 0.007 A 22 GLU HA H 1 3.923 0.007 A 22 GLU HB2 H 1 2.030 0.007 A 22 GLU HB3 H 1 2.030 0.007 A 22 GLU HGy H 1 2.348 0.007 A 22 GLU HGx H 1 2.174 0.007 A 22 GLU CA C 13 56.675 0.172 A 22 GLU CB C 13 26.613 0.172 A 22 GLU CG C 13 33.601 0.172 A 22 GLU N N 15 118.882 0.125 A 23 ASP H H 1 9.163 0.007 A 23 ASP HA H 1 4.658 0.007 A 23 ASP HBy H 1 2.826 0.007 A 23 ASP HBx H 1 2.469 0.007 A 23 ASP CA C 13 55.053 0.172 A 23 ASP CB C 13 37.479 0.172 A 23 ASP N N 15 122.549 0.125 A 24 ILE H H 1 8.658 0.007 A 24 ILE HA H 1 3.678 0.007 A 24 ILE HB H 1 1.847 0.007 A 24 ILE HD1% H 1 0.417 0.007 A 24 ILE HG1x H 1 0.198 0.007 A 24 ILE HG1y H 1 1.692 0.007 A 24 ILE HG2% H 1 0.583 0.007 A 24 ILE CA C 13 63.201 0.172 A 24 ILE CB C 13 35.138 0.172 A 24 ILE CD1 C 13 12.415 0.172 A 24 ILE CG1 C 13 27.972 0.172 A 24 ILE CG2 C 13 14.278 0.172 A 24 ILE N N 15 123.580 0.125 A 25 GLU H H 1 8.082 0.007 A 25 GLU HA H 1 3.885 0.007 A 25 GLU HBy H 1 2.281 0.007 A 25 GLU HBx H 1 1.985 0.007 A 25 GLU HGx H 1 2.027 0.007 A 25 GLU HGy H 1 2.551 0.007 A 25 GLU CA C 13 57.824 0.172 A 25 GLU CB C 13 25.883 0.172 A 25 GLU CG C 13 33.741 0.172 A 25 GLU N N 15 120.591 0.125 A 26 ILE H H 1 8.642 0.007 A 26 ILE HA H 1 3.718 0.007 A 26 ILE HB H 1 2.113 0.007 A 26 ILE HD1% H 1 0.897 0.007 A 26 ILE HG12 H 1 1.024 0.007 A 26 ILE HG13 H 1 1.024 0.007 A 26 ILE HG2% H 1 0.817 0.007 A 26 ILE CA C 13 62.881 0.172 A 26 ILE CB C 13 35.324 0.172 A 26 ILE CD1 C 13 10.928 0.172 A 26 ILE CG1 C 13 26.690 0.172 A 26 ILE CG2 C 13 14.577 0.172 A 26 ILE N N 15 121.350 0.125 A 27 ALA H H 1 8.640 0.007 A 27 ALA N N 15 120.204 0.125 A 28 GLN H H 1 8.727 0.007 A 28 GLN HB2 H 1 2.183 0.007 A 28 GLN HB3 H 1 2.183 0.007 A 28 GLN HE2y H 1 6.915 0.007 A 28 GLN HE2x H 1 5.134 0.007 A 28 GLN HGy H 1 2.822 0.007 A 28 GLN HGx H 1 2.592 0.007 A 28 GLN CB C 13 26.380 0.172 A 28 GLN CG C 13 32.247 0.172 A 28 GLN N N 15 114.627 0.125 A 28 GLN NE2 N 15 105.400 0.125 A 29 SER H H 1 7.849 0.007 A 29 SER HA H 1 4.260 0.007 A 29 SER HB2 H 1 4.116 0.007 A 29 SER HB3 H 1 4.116 0.007 A 29 SER CA C 13 57.768 0.172 A 29 SER CB C 13 61.367 0.172 A 29 SER N N 15 115.031 0.125 A 30 LYS H H 1 7.078 0.007 A 30 LYS HA H 1 4.228 0.007 A 30 LYS HBy H 1 2.328 0.007 A 30 LYS HBx H 1 1.946 0.007 A 30 LYS HDx H 1 1.586 0.007 A 30 LYS HDy H 1 1.635 0.007 A 30 LYS HE2 H 1 2.878 0.007 A 30 LYS HE3 H 1 2.878 0.007 A 30 LYS HG2 H 1 1.179 0.007 A 30 LYS HG3 H 1 1.179 0.007 A 30 LYS CA C 13 56.103 0.172 A 30 LYS CB C 13 26.478 0.172 A 30 LYS CD C 13 27.194 0.172 A 30 LYS CE C 13 39.574 0.172 A 30 LYS CG C 13 22.522 0.172 A 30 LYS N N 15 112.834 0.125 A 31 ASP H H 1 7.688 0.007 A 31 ASP HA H 1 4.877 0.007 A 31 ASP HBy H 1 2.894 0.007 A 31 ASP HBx H 1 2.418 0.007 A 31 ASP CA C 13 49.742 0.172 A 31 ASP CB C 13 38.652 0.172 A 31 ASP N N 15 121.067 0.125 A 32 TYR H H 1 8.582 0.007 A 32 TYR HA H 1 3.311 0.007 A 32 TYR HBx H 1 2.704 0.007 A 32 TYR HBy H 1 3.338 0.007 A 32 TYR HD1 H 1 6.781 0.007 A 32 TYR HD2 H 1 6.781 0.007 A 32 TYR HE1 H 1 6.016 0.007 A 32 TYR HE2 H 1 6.016 0.007 A 32 TYR CA C 13 57.951 0.172 A 32 TYR CB C 13 36.158 0.172 A 32 TYR CDx C 13 130.680 0.172 A 32 TYR CDy C 13 130.683 0.172 A 32 TYR CEx C 13 115.120 0.172 A 32 TYR CEy C 13 115.122 0.172 A 32 TYR N N 15 126.671 0.125 A 33 GLU H H 1 8.424 0.007 A 33 GLU HA H 1 3.442 0.007 A 33 GLU HB2 H 1 1.933 0.007 A 33 GLU HB3 H 1 1.933 0.007 A 33 GLU HG2 H 1 2.322 0.007 A 33 GLU HG3 H 1 2.322 0.007 A 33 GLU CA C 13 56.757 0.172 A 33 GLU CB C 13 26.095 0.172 A 33 GLU CG C 13 33.425 0.172 A 33 GLU N N 15 115.884 0.125 A 34 SER H H 1 7.657 0.007 A 34 SER HA H 1 4.026 0.007 A 34 SER HB2 H 1 3.656 0.007 A 34 SER HB3 H 1 3.656 0.007 A 34 SER CA C 13 58.953 0.172 A 34 SER CB C 13 59.683 0.172 A 34 SER N N 15 116.060 0.125 A 35 TRP H H 1 7.613 0.007 A 35 TRP HBy H 1 2.849 0.007 A 35 TRP HBx H 1 2.610 0.007 A 35 TRP HD1 H 1 6.405 0.007 A 35 TRP HE1 H 1 8.864 0.007 A 35 TRP HE3 H 1 6.944 0.007 A 35 TRP CA C 13 57.894 0.172 A 35 TRP CB C 13 25.531 0.172 A 35 TRP CD1 C 13 121.841 0.172 A 35 TRP CE3 C 13 118.363 0.172 A 35 TRP N N 15 123.977 0.125 A 35 TRP NE1 N 15 126.187 0.125 A 36 LYS H H 1 8.605 0.007 A 36 LYS HA H 1 3.128 0.007 A 36 LYS HBy H 1 1.247 0.007 A 36 LYS HBx H 1 0.906 0.007 A 36 LYS HDx H 1 1.336 0.007 A 36 LYS HDy H 1 1.458 0.007 A 36 LYS HE2 H 1 2.664 0.007 A 36 LYS HE3 H 1 2.664 0.007 A 36 LYS HGy H 1 0.975 0.007 A 36 LYS HGx H 1 0.890 0.007 A 36 LYS CA C 13 55.998 0.172 A 36 LYS CB C 13 29.304 0.172 A 36 LYS CD C 13 26.902 0.172 A 36 LYS CE C 13 39.400 0.172 A 36 LYS CG C 13 21.793 0.172 A 36 LYS N N 15 117.633 0.125 A 37 SER H H 1 7.281 0.007 A 37 SER HA H 1 3.989 0.007 A 37 SER HBy H 1 3.886 0.007 A 37 SER HBx H 1 3.849 0.007 A 37 SER CA C 13 57.765 0.172 A 37 SER CB C 13 60.606 0.172 A 37 SER N N 15 109.835 0.125 A 38 ARG H H 1 7.371 0.007 A 38 ARG HA H 1 4.144 0.007 A 38 ARG HBy H 1 1.692 0.007 A 38 ARG HBx H 1 1.620 0.007 A 38 ARG HDy H 1 3.236 0.007 A 38 ARG HDx H 1 3.043 0.007 A 38 ARG HGx H 1 1.432 0.007 A 38 ARG HGy H 1 1.622 0.007 A 38 ARG CA C 13 51.208 0.172 A 38 ARG CB C 13 25.717 0.172 A 38 ARG CD C 13 37.597 0.172 A 38 ARG CG C 13 25.573 0.172 A 38 ARG N N 15 119.946 0.125 A 39 PHE H H 1 7.458 0.007 A 39 PHE HA H 1 4.855 0.007 A 39 PHE HBy H 1 2.821 0.007 A 39 PHE HBx H 1 2.647 0.007 A 39 PHE HDx H 1 6.673 0.007 A 39 PHE HDy H 1 6.673 0.007 A 39 PHE HEx H 1 5.520 0.007 A 39 PHE HEy H 1 5.520 0.007 A 39 PHE HZ H 1 6.432 0.007 A 39 PHE CA C 13 54.234 0.172 A 39 PHE CB C 13 37.547 0.172 A 39 PHE CDx C 13 129.666 0.172 A 39 PHE CDy C 13 129.670 0.172 A 39 PHE CEx C 13 127.280 0.172 A 39 PHE CEy C 13 127.282 0.172 A 39 PHE CZ C 13 126.358 0.172 A 39 PHE N N 15 117.529 0.125 A 40 THR H H 1 8.234 0.007 A 40 THR HA H 1 3.991 0.007 A 40 THR HB H 1 4.282 0.007 A 40 THR HG2% H 1 1.324 0.007 A 40 THR CA C 13 59.704 0.172 A 40 THR CB C 13 66.175 0.172 A 40 THR CG2 C 13 20.655 0.172 A 40 THR N N 15 113.296 0.125 A 41 LYS H H 1 8.846 0.007 A 41 LYS HA H 1 3.713 0.007 A 41 LYS HBx H 1 1.783 0.007 A 41 LYS HBy H 1 1.831 0.007 A 41 LYS HD2 H 1 1.610 0.007 A 41 LYS HD3 H 1 1.610 0.007 A 41 LYS HEx H 1 2.878 0.007 A 41 LYS HEy H 1 2.942 0.007 A 41 LYS HGx H 1 1.411 0.007 A 41 LYS HGy H 1 1.451 0.007 A 41 LYS CA C 13 57.650 0.172 A 41 LYS CB C 13 29.363 0.172 A 41 LYS CD C 13 26.233 0.172 A 41 LYS CE C 13 39.513 0.172 A 41 LYS CG C 13 22.164 0.172 A 41 LYS N N 15 124.924 0.125 A 42 ASP H H 1 8.678 0.007 A 42 ASP HA H 1 4.343 0.007 A 42 ASP HBx H 1 2.526 0.007 A 42 ASP HBy H 1 2.605 0.007 A 42 ASP CA C 13 53.841 0.172 A 42 ASP CB C 13 37.703 0.172 A 42 ASP N N 15 116.255 0.125 A 43 LEU H H 1 7.514 0.007 A 43 LEU HA H 1 4.320 0.007 A 43 LEU HBy H 1 1.863 0.007 A 43 LEU HBx H 1 1.371 0.007 A 43 LEU HD1% H 1 0.797 0.007 A 43 LEU HDy% H 1 1.025 0.007 A 43 LEU HG H 1 1.610 0.007 A 43 LEU CA C 13 52.423 0.172 A 43 LEU CB C 13 40.023 0.172 A 43 LEU CDx C 13 20.224 0.172 A 43 LEU CDy C 13 23.379 0.172 A 43 LEU CG C 13 25.002 0.172 A 43 LEU N N 15 119.134 0.125 A 44 GLN H H 1 7.866 0.007 A 44 GLN HA H 1 3.466 0.007 A 44 GLN HBx H 1 1.865 0.007 A 44 GLN HBy H 1 1.919 0.007 A 44 GLN HE2x H 1 6.897 0.007 A 44 GLN HE2y H 1 7.471 0.007 A 44 GLN HGx H 1 2.350 0.007 A 44 GLN HGy H 1 2.550 0.007 A 44 GLN CA C 13 57.437 0.172 A 44 GLN CB C 13 25.394 0.172 A 44 GLN CG C 13 32.059 0.172 A 44 GLN N N 15 119.455 0.125 A 44 GLN NE2 N 15 112.566 0.125 A 45 SER H H 1 7.797 0.007 A 45 SER HA H 1 4.211 0.007 A 45 SER HBx H 1 3.875 0.007 A 45 SER HBy H 1 3.945 0.007 A 45 SER CA C 13 57.621 0.172 A 45 SER CB C 13 60.094 0.172 A 45 SER N N 15 110.605 0.125 A 46 SER H H 1 7.567 0.007 A 46 SER HA H 1 4.473 0.007 A 46 SER HBy H 1 3.916 0.007 A 46 SER HBx H 1 3.822 0.007 A 46 SER CA C 13 55.739 0.172 A 46 SER CB C 13 61.628 0.172 A 46 SER N N 15 115.075 0.125 A 47 LEU H H 1 7.074 0.007 A 47 LEU HA H 1 4.334 0.007 A 47 LEU HB2 H 1 1.405 0.007 A 47 LEU HB3 H 1 1.405 0.007 A 47 LEU HD1% H 1 0.104 0.007 A 47 LEU HDy% H 1 -0.231 0.007 A 47 LEU HG H 1 1.278 0.007 A 47 LEU CA C 13 52.040 0.172 A 47 LEU CB C 13 39.810 0.172 A 47 LEU CD1 C 13 20.166 0.172 A 47 LEU CDy C 13 22.249 0.172 A 47 LEU CDx C 13 20.166 0.172 A 47 LEU CG C 13 23.425 0.172 A 47 LEU N N 15 124.984 0.125 A 48 THR H H 1 7.807 0.007 A 48 THR HA H 1 4.665 0.007 A 48 THR HB H 1 4.601 0.007 A 48 THR HG2% H 1 1.213 0.007 A 48 THR CA C 13 56.718 0.172 A 48 THR CB C 13 69.103 0.172 A 48 THR CG2 C 13 19.235 0.172 A 48 THR N N 15 111.152 0.125 A 49 GLU H H 1 9.005 0.007 A 49 GLU HA H 1 3.194 0.007 A 49 GLU HBx H 1 1.403 0.007 A 49 GLU HBy H 1 1.612 0.007 A 49 GLU HGy H 1 1.832 0.007 A 49 GLU HGx H 1 1.567 0.007 A 49 GLU CA C 13 56.770 0.172 A 49 GLU CB C 13 26.148 0.172 A 49 GLU CG C 13 33.628 0.172 A 49 GLU N N 15 124.552 0.125 A 50 GLU H H 1 8.574 0.007 A 50 GLU HA H 1 4.000 0.007 A 50 GLU HBy H 1 2.010 0.007 A 50 GLU HBx H 1 1.885 0.007 A 50 GLU HG2 H 1 2.259 0.007 A 50 GLU HG3 H 1 2.259 0.007 A 50 GLU CA C 13 57.357 0.172 A 50 GLU CB C 13 26.511 0.172 A 50 GLU CG C 13 33.728 0.172 A 50 GLU N N 15 118.615 0.125 A 51 SER H H 1 7.981 0.007 A 51 SER HA H 1 4.256 0.007 A 51 SER HB2 H 1 4.065 0.007 A 51 SER HB3 H 1 4.065 0.007 A 51 SER CA C 13 58.825 0.172 A 51 SER CB C 13 59.884 0.172 A 51 SER N N 15 116.380 0.125 A 52 TYR H H 1 7.521 0.007 A 52 TYR HBy H 1 2.962 0.007 A 52 TYR HBx H 1 2.922 0.007 A 52 TYR HDx H 1 6.782 0.007 A 52 TYR HDy H 1 6.782 0.007 A 52 TYR HEx H 1 6.584 0.007 A 52 TYR HEy H 1 6.584 0.007 A 52 TYR CB C 13 36.647 0.172 A 52 TYR CDx C 13 130.480 0.172 A 52 TYR CEx C 13 114.863 0.172 A 52 TYR N N 15 125.611 0.125 A 53 ASP H H 1 8.900 0.007 A 53 ASP HA H 1 4.115 0.007 A 53 ASP HBy H 1 2.662 0.007 A 53 ASP HBx H 1 2.528 0.007 A 53 ASP CA C 13 54.553 0.172 A 53 ASP CB C 13 37.477 0.172 A 53 ASP N N 15 119.653 0.125 A 54 SER H H 1 7.946 0.007 A 54 SER HA H 1 3.946 0.007 A 54 SER HBx H 1 3.911 0.007 A 54 SER HBy H 1 4.063 0.007 A 54 SER CA C 13 59.741 0.172 A 54 SER CB C 13 59.750 0.172 A 54 SER N N 15 114.883 0.125 A 55 TYR H H 1 7.207 0.007 A 55 TYR HA H 1 4.361 0.007 A 55 TYR HBy H 1 3.272 0.007 A 55 TYR HBx H 1 3.088 0.007 A 55 TYR HDx H 1 6.805 0.007 A 55 TYR HDy H 1 6.805 0.007 A 55 TYR HEx H 1 6.767 0.007 A 55 TYR HEy H 1 6.767 0.007 A 55 TYR CA C 13 57.213 0.172 A 55 TYR CB C 13 34.024 0.172 A 55 TYR CDx C 13 131.077 0.172 A 55 TYR CEx C 13 115.366 0.172 A 55 TYR N N 15 123.933 0.125 A 56 LEU H H 1 8.163 0.007 A 56 LEU HA H 1 3.252 0.007 A 56 LEU HBy H 1 1.721 0.007 A 56 LEU HBx H 1 1.050 0.007 A 56 LEU HD1% H 1 0.595 0.007 A 56 LEU HDy% H 1 0.422 0.007 A 56 LEU HG H 1 0.981 0.007 A 56 LEU CA C 13 54.681 0.172 A 56 LEU CB C 13 38.151 0.172 A 56 LEU CD1 C 13 23.384 0.172 A 56 LEU CDx C 13 19.840 0.172 A 56 LEU CDy C 13 23.384 0.172 A 56 LEU CG C 13 23.087 0.172 A 56 LEU N N 15 119.758 0.125 A 57 LYS H H 1 7.733 0.007 A 57 LYS HA H 1 3.852 0.007 A 57 LYS HBx H 1 1.713 0.007 A 57 LYS HBy H 1 1.794 0.007 A 57 LYS HDx H 1 1.488 0.007 A 57 LYS HDy H 1 1.552 0.007 A 57 LYS HEx H 1 2.838 0.007 A 57 LYS HGy H 1 1.437 0.007 A 57 LYS HGx H 1 1.355 0.007 A 57 LYS CA C 13 56.090 0.172 A 57 LYS CB C 13 29.683 0.172 A 57 LYS CD C 13 26.152 0.172 A 57 LYS CE C 13 39.574 0.172 A 57 LYS CG C 13 22.748 0.172 A 57 LYS N N 15 118.487 0.125 A 58 ILE H H 1 7.189 0.007 A 58 ILE HA H 1 3.591 0.007 A 58 ILE HB H 1 1.908 0.007 A 58 ILE HD1% H 1 0.779 0.007 A 58 ILE HG1y H 1 1.582 0.007 A 58 ILE HG1x H 1 1.063 0.007 A 58 ILE HG2% H 1 0.705 0.007 A 58 ILE CA C 13 61.366 0.172 A 58 ILE CB C 13 35.144 0.172 A 58 ILE CD1 C 13 10.213 0.172 A 58 ILE CG1 C 13 25.966 0.172 A 58 ILE CG2 C 13 14.808 0.172 A 58 ILE N N 15 120.887 0.125 A 59 LEU H H 1 8.314 0.007 A 59 LEU HA H 1 3.437 0.007 A 59 LEU HBy H 1 1.372 0.007 A 59 LEU HBx H 1 0.894 0.007 A 59 LEU HDx% H 1 0.715 0.007 A 59 LEU HDy% H 1 0.754 0.007 A 59 LEU HG H 1 1.148 0.007 A 59 LEU CA C 13 54.847 0.172 A 59 LEU CB C 13 39.071 0.172 A 59 LEU CDx C 13 20.890 0.172 A 59 LEU CDy C 13 22.284 0.172 A 59 LEU CG C 13 24.076 0.172 A 59 LEU N N 15 122.273 0.125 A 60 GLU H H 1 8.004 0.007 A 60 GLU HA H 1 3.810 0.007 A 60 GLU HBy H 1 2.025 0.007 A 60 GLU HBx H 1 1.896 0.007 A 60 GLU HGy H 1 2.233 0.007 A 60 GLU HGx H 1 2.160 0.007 A 60 GLU CA C 13 56.156 0.172 A 60 GLU CB C 13 26.820 0.172 A 60 GLU CG C 13 33.484 0.172 A 60 GLU N N 15 118.591 0.125 A 61 LYS H H 1 6.940 0.007 A 61 LYS HA H 1 4.029 0.007 A 61 LYS HBx H 1 1.745 0.007 A 61 LYS HBy H 1 1.788 0.007 A 61 LYS HD2 H 1 1.554 0.007 A 61 LYS HD3 H 1 1.554 0.007 A 61 LYS HE2 H 1 2.884 0.007 A 61 LYS HE3 H 1 2.884 0.007 A 61 LYS HGy H 1 1.484 0.007 A 61 LYS HGx H 1 1.392 0.007 A 61 LYS CA C 13 54.164 0.172 A 61 LYS CB C 13 29.581 0.172 A 61 LYS CD C 13 26.302 0.172 A 61 LYS CE C 13 39.800 0.172 A 61 LYS CG C 13 22.239 0.172 A 61 LYS N N 15 115.698 0.125 A 62 GLN H H 1 7.512 0.007 A 62 GLN HA H 1 3.851 0.007 A 62 GLN HBy H 1 1.792 0.007 A 62 GLN HBx H 1 1.125 0.007 A 62 GLN HE2y H 1 6.439 0.007 A 62 GLN HE2x H 1 6.314 0.007 A 62 GLN HGx H 1 1.387 0.007 A 62 GLN HGy H 1 2.235 0.007 A 62 GLN CA C 13 52.258 0.172 A 62 GLN CB C 13 25.186 0.172 A 62 GLN CG C 13 29.706 0.172 A 62 GLN N N 15 114.863 0.125 A 62 GLN NE2 N 15 109.324 0.125 A 63 GLY H H 1 6.883 0.007 A 63 GLY HAy H 1 4.175 0.007 A 63 GLY HAx H 1 3.723 0.007 A 63 GLY CA C 13 41.815 0.172 A 63 GLY N N 15 101.724 0.125 A 64 GLU H H 1 8.598 0.007 A 64 GLU HA H 1 4.137 0.007 A 64 GLU HBx H 1 1.890 0.007 A 64 GLU HBy H 1 1.969 0.007 A 64 GLU HGx H 1 2.344 0.007 A 64 GLU HGy H 1 2.392 0.007 A 64 GLU CA C 13 54.598 0.172 A 64 GLU CB C 13 28.312 0.172 A 64 GLU CG C 13 33.658 0.172 A 64 GLU N N 15 118.731 0.125 A 65 PHE H H 1 8.877 0.007 A 65 PHE HA H 1 3.825 0.007 A 65 PHE HBx H 1 2.728 0.007 A 65 PHE HBy H 1 3.044 0.007 A 65 PHE HDx H 1 6.609 0.007 A 65 PHE HDy H 1 6.609 0.007 A 65 PHE HEx H 1 6.314 0.007 A 65 PHE HEy H 1 6.314 0.007 A 65 PHE CA C 13 57.419 0.172 A 65 PHE CB C 13 36.666 0.172 A 65 PHE CDx C 13 129.090 0.172 A 65 PHE CDy C 13 129.092 0.172 A 65 PHE CEx C 13 128.420 0.172 A 65 PHE N N 15 123.366 0.125 A 66 LYS H H 1 8.112 0.007 A 66 LYS HA H 1 4.168 0.007 A 66 LYS HBx H 1 1.090 0.007 A 66 LYS HBy H 1 1.401 0.007 A 66 LYS HD2 H 1 1.371 0.007 A 66 LYS HD3 H 1 1.371 0.007 A 66 LYS HEx H 1 2.674 0.007 A 66 LYS HEy H 1 2.775 0.007 A 66 LYS HG2 H 1 1.100 0.007 A 66 LYS HG3 H 1 1.100 0.007 A 66 LYS CA C 13 53.226 0.172 A 66 LYS CB C 13 30.293 0.172 A 66 LYS CD C 13 25.379 0.172 A 66 LYS CE C 13 39.206 0.172 A 66 LYS CG C 13 20.469 0.172 A 66 LYS N N 15 125.336 0.125 A 67 GLU H H 1 6.744 0.007 A 67 GLU HA H 1 4.069 0.007 A 67 GLU HB2 H 1 2.010 0.007 A 67 GLU HB3 H 1 2.010 0.007 A 67 GLU HGx H 1 1.691 0.007 A 67 GLU HGy H 1 1.794 0.007 A 67 GLU CA C 13 52.907 0.172 A 67 GLU CB C 13 29.378 0.172 A 67 GLU CG C 13 32.467 0.172 A 67 GLU N N 15 112.076 0.125 A 68 PHE H H 1 8.730 0.007 A 68 PHE HBx H 1 3.007 0.007 A 68 PHE HBy H 1 3.074 0.007 A 68 PHE HDx H 1 7.380 0.007 A 68 PHE HDy H 1 7.380 0.007 A 68 PHE HEx H 1 7.213 0.007 A 68 PHE HEy H 1 7.213 0.007 A 68 PHE HZ H 1 7.141 0.007 A 68 PHE CB C 13 38.408 0.172 A 68 PHE CDy C 13 130.100 0.172 A 68 PHE CDx C 13 130.099 0.172 A 68 PHE CEx C 13 129.219 0.172 A 68 PHE CEy C 13 129.220 0.172 A 68 PHE CZ C 13 127.970 0.172 A 68 PHE N N 15 118.706 0.125 A 69 GLY H H 1 9.210 0.007 A 69 GLY HAy H 1 4.430 0.007 A 69 GLY HAx H 1 3.486 0.007 A 69 GLY CA C 13 41.353 0.172 A 69 GLY N N 15 112.889 0.125 A 70 LYS H H 1 8.197 0.007 A 70 LYS HA H 1 4.085 0.007 A 70 LYS HB2 H 1 1.725 0.007 A 70 LYS HB3 H 1 1.725 0.007 A 70 LYS HD2 H 1 1.589 0.007 A 70 LYS HD3 H 1 1.589 0.007 A 70 LYS HE2 H 1 2.876 0.007 A 70 LYS HE3 H 1 2.876 0.007 A 70 LYS HG2 H 1 1.367 0.007 A 70 LYS HG3 H 1 1.367 0.007 A 70 LYS CA C 13 54.418 0.172 A 70 LYS CB C 13 31.197 0.172 A 70 LYS CD C 13 26.752 0.172 A 70 LYS CE C 13 39.570 0.172 A 70 LYS CG C 13 22.250 0.172 A 70 LYS N N 15 122.409 0.125 A 71 CYS H H 1 8.197 0.007 A 71 CYS HA H 1 5.332 0.007 A 71 CYS HBy H 1 2.573 0.007 A 71 CYS HBx H 1 2.115 0.007 A 71 CYS CA C 13 54.655 0.172 A 71 CYS CB C 13 28.223 0.172 A 71 CYS N N 15 118.509 0.125 A 72 THR H H 1 8.719 0.007 A 72 THR HA H 1 4.272 0.007 A 72 THR HB H 1 3.920 0.007 A 72 THR HG2% H 1 1.124 0.007 A 72 THR CA C 13 58.652 0.172 A 72 THR CB C 13 68.199 0.172 A 72 THR CG2 C 13 18.529 0.172 A 72 THR N N 15 120.129 0.125 A 73 TYR H H 1 8.483 0.007 A 73 TYR HA H 1 5.034 0.007 A 73 TYR HBy H 1 2.971 0.007 A 73 TYR HBx H 1 2.750 0.007 A 73 TYR HDx H 1 7.125 0.007 A 73 TYR HDy H 1 7.125 0.007 A 73 TYR HEx H 1 6.645 0.007 A 73 TYR HEy H 1 6.645 0.007 A 73 TYR CA C 13 55.497 0.172 A 73 TYR CB C 13 38.271 0.172 A 73 TYR CDx C 13 130.730 0.172 A 73 TYR CDy C 13 130.730 0.172 A 73 TYR CEy C 13 115.960 0.172 A 73 TYR CEx C 13 115.959 0.172 A 73 TYR N N 15 122.772 0.125 A 74 LEU H H 1 8.277 0.007 A 74 LEU HA H 1 4.466 0.007 A 74 LEU HBy H 1 1.648 0.007 A 74 LEU HBx H 1 1.504 0.007 A 74 LEU HDx% H 1 0.602 0.007 A 74 LEU HD2% H 1 0.640 0.007 A 74 LEU HG H 1 1.168 0.007 A 74 LEU CA C 13 51.805 0.172 A 74 LEU CB C 13 42.030 0.172 A 74 LEU CDy C 13 22.934 0.172 A 74 LEU CDx C 13 22.910 0.172 A 74 LEU CG C 13 24.144 0.172 A 74 LEU N N 15 117.980 0.125 A 75 GLY H H 1 7.754 0.007 A 75 GLY HAy H 1 4.798 0.007 A 75 GLY HAx H 1 3.745 0.007 A 75 GLY CA C 13 42.799 0.172 A 75 GLY N N 15 105.257 0.125 A 76 GLN H H 1 8.764 0.007 A 76 GLN HA H 1 4.938 0.007 A 76 GLN HBx H 1 1.858 0.007 A 76 GLN HBy H 1 1.911 0.007 A 76 GLN HE2y H 1 7.093 0.007 A 76 GLN HE2x H 1 6.556 0.007 A 76 GLN HG2 H 1 2.101 0.007 A 76 GLN HG3 H 1 2.101 0.007 A 76 GLN CA C 13 52.495 0.172 A 76 GLN CB C 13 30.498 0.172 A 76 GLN CG C 13 31.479 0.172 A 76 GLN N N 15 119.071 0.125 A 76 GLN NE2 N 15 109.605 0.125 A 77 ILE H H 1 8.721 0.007 A 77 ILE HA H 1 4.992 0.007 A 77 ILE HB H 1 1.736 0.007 A 77 ILE HD1% H 1 0.824 0.007 A 77 ILE HG1x H 1 1.022 0.007 A 77 ILE HG1y H 1 1.475 0.007 A 77 ILE HG2% H 1 0.767 0.007 A 77 ILE CA C 13 57.239 0.172 A 77 ILE CB C 13 36.664 0.172 A 77 ILE CD1 C 13 10.245 0.172 A 77 ILE CG1 C 13 24.993 0.172 A 77 ILE CG2 C 13 14.549 0.172 A 77 ILE N N 15 123.550 0.125 A 78 LYS H H 1 8.911 0.007 A 78 LYS HA H 1 4.585 0.007 A 78 LYS HBy H 1 1.757 0.007 A 78 LYS HBx H 1 1.613 0.007 A 78 LYS HE2 H 1 2.890 0.007 A 78 LYS HE3 H 1 2.890 0.007 A 78 LYS HG2 H 1 1.288 0.007 A 78 LYS HG3 H 1 1.288 0.007 A 78 LYS CA C 13 52.768 0.172 A 78 LYS CB C 13 32.536 0.172 A 78 LYS CE C 13 39.626 0.172 A 78 LYS CG C 13 22.221 0.172 A 78 LYS N N 15 127.532 0.125 A 79 ASP H H 1 9.423 0.007 A 79 ASP HA H 1 4.168 0.007 A 79 ASP HBy H 1 2.827 0.007 A 79 ASP HBx H 1 2.670 0.007 A 79 ASP CA C 13 53.258 0.172 A 79 ASP CB C 13 36.826 0.172 A 79 ASP N N 15 128.019 0.125 A 80 ASN H H 1 8.604 0.007 A 80 ASN HA H 1 4.168 0.007 A 80 ASN HBx H 1 2.914 0.007 A 80 ASN HBy H 1 2.950 0.007 A 80 ASN HD2x H 1 6.855 0.007 A 80 ASN HD2y H 1 7.508 0.007 A 80 ASN CA C 13 51.912 0.172 A 80 ASN CB C 13 35.506 0.172 A 80 ASN N N 15 110.608 0.125 A 80 ASN ND2 N 15 113.268 0.125 A 81 LYS H H 1 7.985 0.007 A 81 LYS HA H 1 4.482 0.007 A 81 LYS HBy H 1 1.849 0.007 A 81 LYS HBx H 1 1.510 0.007 A 81 LYS HDy H 1 1.736 0.007 A 81 LYS HDx H 1 1.695 0.007 A 81 LYS HGx H 1 1.346 0.007 A 81 LYS HGy H 1 1.451 0.007 A 81 LYS CA C 13 52.353 0.172 A 81 LYS CB C 13 32.119 0.172 A 81 LYS CD C 13 26.261 0.172 A 81 LYS CE C 13 39.776 0.172 A 81 LYS CG C 13 22.224 0.172 A 81 LYS N N 15 121.116 0.125 A 82 LYS H H 1 8.011 0.007 A 82 LYS HA H 1 4.765 0.007 A 82 LYS HBy H 1 1.716 0.007 A 82 LYS HBx H 1 1.558 0.007 A 82 LYS HDx H 1 1.684 0.007 A 82 LYS HDy H 1 1.733 0.007 A 82 LYS HE2 H 1 2.886 0.007 A 82 LYS HE3 H 1 2.886 0.007 A 82 LYS HGx H 1 1.290 0.007 A 82 LYS HGy H 1 1.419 0.007 A 82 LYS CA C 13 52.722 0.172 A 82 LYS CB C 13 32.934 0.172 A 82 LYS CD C 13 26.808 0.172 A 82 LYS CE C 13 39.596 0.172 A 82 LYS CG C 13 22.498 0.172 A 82 LYS N N 15 119.259 0.125 A 83 TYR H H 1 8.735 0.007 A 83 TYR HA H 1 5.275 0.007 A 83 TYR HBx H 1 2.463 0.007 A 83 TYR HBy H 1 2.707 0.007 A 83 TYR HDx H 1 6.879 0.007 A 83 TYR HDy H 1 6.879 0.007 A 83 TYR HEx H 1 6.717 0.007 A 83 TYR HEy H 1 6.717 0.007 A 83 TYR CA C 13 53.383 0.172 A 83 TYR CB C 13 38.026 0.172 A 83 TYR CDx C 13 130.858 0.172 A 83 TYR CDy C 13 130.860 0.172 A 83 TYR CEy C 13 115.331 0.172 A 83 TYR CEx C 13 115.330 0.172 A 83 TYR N N 15 118.176 0.125 A 84 GLY H H 1 8.082 0.007 A 84 GLY HAy H 1 4.163 0.007 A 84 GLY HAx H 1 2.096 0.007 A 84 GLY CA C 13 41.219 0.172 A 84 GLY N N 15 111.686 0.125 A 85 GLY H H 1 8.518 0.007 A 85 GLY HAy H 1 4.921 0.007 A 85 GLY HAx H 1 3.726 0.007 A 85 GLY CA C 13 42.272 0.172 A 85 GLY N N 15 111.232 0.125 A 86 VAL H H 1 8.617 0.007 A 86 VAL HA H 1 5.127 0.007 A 86 VAL HB H 1 1.874 0.007 A 86 VAL HG1% H 1 0.723 0.007 A 86 VAL HGy% H 1 0.476 0.007 A 86 VAL CA C 13 55.741 0.172 A 86 VAL CB C 13 33.129 0.172 A 86 VAL CGy C 13 18.978 0.172 A 86 VAL CGx C 13 18.818 0.172 A 86 VAL N N 15 115.256 0.125 A 87 ILE H H 1 8.486 0.007 A 87 ILE HA H 1 5.206 0.007 A 87 ILE HB H 1 1.457 0.007 A 87 ILE HD1% H 1 0.622 0.007 A 87 ILE HG1y H 1 1.331 0.007 A 87 ILE HG1x H 1 0.861 0.007 A 87 ILE HG2% H 1 0.566 0.007 A 87 ILE CA C 13 57.168 0.172 A 87 ILE CB C 13 36.590 0.172 A 87 ILE CD1 C 13 11.055 0.172 A 87 ILE CG1 C 13 24.227 0.172 A 87 ILE CG2 C 13 14.496 0.172 A 87 ILE N N 15 125.124 0.125 A 88 ILE H H 1 9.414 0.007 A 88 ILE HA H 1 5.146 0.007 A 88 ILE HB H 1 1.462 0.007 A 88 ILE HD1% H 1 0.597 0.007 A 88 ILE HG2% H 1 0.872 0.007 A 88 ILE CA C 13 55.356 0.172 A 88 ILE CB C 13 39.847 0.172 A 88 ILE CD1 C 13 12.011 0.172 A 88 ILE CG2 C 13 13.302 0.172 A 88 ILE N N 15 128.056 0.125 A 89 VAL H H 1 7.949 0.007 A 89 VAL HA H 1 4.387 0.007 A 89 VAL HB H 1 1.979 0.007 A 89 VAL HGx% H 1 0.975 0.007 A 89 VAL HG2% H 1 0.780 0.007 A 89 VAL CA C 13 59.839 0.172 A 89 VAL CB C 13 30.295 0.172 A 89 VAL CGy C 13 18.677 0.172 A 89 VAL CGx C 13 18.397 0.172 A 89 VAL N N 15 128.326 0.125 A 90 VAL H H 1 9.325 0.007 A 90 VAL HA H 1 4.207 0.007 A 90 VAL HB H 1 2.211 0.007 A 90 VAL HGx% H 1 1.252 0.007 A 90 VAL HGy% H 1 0.413 0.007 A 90 VAL CA C 13 59.722 0.172 A 90 VAL CB C 13 31.537 0.172 A 90 VAL CGy C 13 22.174 0.172 A 90 VAL CGx C 13 19.246 0.172 A 90 VAL N N 15 128.738 0.125 A 91 LYS H H 1 8.401 0.007 A 91 LYS HA H 1 4.629 0.007 A 91 LYS HB2 H 1 1.484 0.007 A 91 LYS HB3 H 1 1.484 0.007 A 91 LYS HEx H 1 2.662 0.007 A 91 LYS HGy H 1 1.137 0.007 A 91 LYS HGx H 1 0.994 0.007 A 91 LYS CA C 13 52.972 0.172 A 91 LYS CB C 13 30.789 0.172 A 91 LYS CD C 13 25.159 0.172 A 91 LYS CE C 13 39.500 0.172 A 91 LYS CG C 13 22.267 0.172 A 91 LYS N N 15 126.004 0.125 A 92 TYR H H 1 8.349 0.007 A 92 TYR HA H 1 4.940 0.007 A 92 TYR HB2 H 1 2.967 0.007 A 92 TYR HB3 H 1 2.967 0.007 A 92 TYR HDx H 1 7.061 0.007 A 92 TYR HDy H 1 7.061 0.007 A 92 TYR HEx H 1 6.783 0.007 A 92 TYR HEy H 1 6.783 0.007 A 92 TYR CA C 13 53.905 0.172 A 92 TYR CB C 13 39.331 0.172 A 92 TYR CDx C 13 131.168 0.172 A 92 TYR CDy C 13 131.170 0.172 A 92 TYR CE1 C 13 115.846 0.172 A 92 TYR CEy C 13 115.850 0.172 A 92 TYR CEx C 13 115.846 0.172 A 92 TYR N N 15 123.932 0.125 A 93 GLU H H 1 8.825 0.007 A 93 GLU HA H 1 3.834 0.007 A 93 GLU HBy H 1 2.242 0.007 A 93 GLU HBx H 1 2.153 0.007 A 93 GLU HG2 H 1 2.337 0.007 A 93 GLU HG3 H 1 2.337 0.007 A 93 GLU CA C 13 57.465 0.172 A 93 GLU CB C 13 28.695 0.172 A 93 GLU CG C 13 33.601 0.172 A 93 GLU N N 15 122.195 0.125 A 94 GLU H H 1 8.447 0.007 A 94 GLU HA H 1 4.440 0.007 A 94 GLU HBx H 1 1.597 0.007 A 94 GLU HBy H 1 2.259 0.007 A 94 GLU HGy H 1 2.241 0.007 A 94 GLU HGx H 1 1.934 0.007 A 94 GLU CA C 13 52.555 0.172 A 94 GLU CB C 13 26.861 0.172 A 94 GLU CG C 13 32.604 0.172 A 94 GLU N N 15 110.219 0.125 A 95 GLY H H 1 7.274 0.007 A 95 GLY HAy H 1 4.365 0.007 A 95 GLY HAx H 1 3.784 0.007 A 95 GLY CA C 13 42.542 0.172 A 95 GLY N N 15 106.566 0.125 A 96 ASN H H 1 8.342 0.007 A 96 ASN HA H 1 5.720 0.007 A 96 ASN HBy H 1 2.590 0.007 A 96 ASN HBx H 1 2.425 0.007 A 96 ASN HD2x H 1 6.663 0.007 A 96 ASN HD2y H 1 7.296 0.007 A 96 ASN CA C 13 49.003 0.172 A 96 ASN CB C 13 37.602 0.172 A 96 ASN N N 15 116.707 0.125 A 96 ASN ND2 N 15 110.649 0.125 A 97 VAL H H 1 9.356 0.007 A 97 VAL HA H 1 4.117 0.007 A 97 VAL HB H 1 1.988 0.007 A 97 VAL HGx% H 1 0.383 0.007 A 97 VAL HG2% H 1 0.751 0.007 A 97 VAL CA C 13 58.404 0.172 A 97 VAL CB C 13 33.456 0.172 A 97 VAL CGx C 13 18.878 0.172 A 97 VAL CGy C 13 19.315 0.172 A 97 VAL N N 15 122.002 0.125 A 98 ASN H H 1 8.688 0.007 A 98 ASN HA H 1 5.135 0.007 A 98 ASN HBy H 1 2.642 0.007 A 98 ASN HBx H 1 2.043 0.007 A 98 ASN HD2x H 1 6.427 0.007 A 98 ASN HD2y H 1 7.234 0.007 A 98 ASN CA C 13 48.630 0.172 A 98 ASN CB C 13 36.031 0.172 A 98 ASN N N 15 124.376 0.125 A 98 ASN ND2 N 15 111.506 0.125 A 99 TYR H H 1 8.795 0.007 A 99 TYR HA H 1 4.640 0.007 A 99 TYR HBy H 1 2.915 0.007 A 99 TYR HBx H 1 2.366 0.007 A 99 TYR HD1 H 1 6.729 0.007 A 99 TYR HD2 H 1 6.729 0.007 A 99 TYR HEx H 1 6.963 0.007 A 99 TYR HEy H 1 6.963 0.007 A 99 TYR CA C 13 55.468 0.172 A 99 TYR CB C 13 38.122 0.172 A 99 TYR CD1 C 13 131.186 0.172 A 99 TYR CDy C 13 131.190 0.172 A 99 TYR CDx C 13 131.186 0.172 A 99 TYR CEx C 13 114.638 0.172 A 99 TYR CEy C 13 114.640 0.172 A 99 TYR N N 15 123.932 0.125 A 100 SER H H 1 8.757 0.007 A 100 SER HA H 1 5.242 0.007 A 100 SER HBy H 1 3.533 0.007 A 100 SER HBx H 1 3.461 0.007 A 100 SER CA C 13 53.767 0.172 A 100 SER CB C 13 60.649 0.172 A 100 SER N N 15 115.327 0.125 A 101 LEU H H 1 8.876 0.007 A 101 LEU HA H 1 4.978 0.007 A 101 LEU HBx H 1 1.284 0.007 A 101 LEU HBy H 1 1.401 0.007 A 101 LEU HDx% H 1 1.022 0.007 A 101 LEU HDy% H 1 0.655 0.007 A 101 LEU HG H 1 1.662 0.007 A 101 LEU CA C 13 51.756 0.172 A 101 LEU CB C 13 42.765 0.172 A 101 LEU CDy C 13 25.045 0.172 A 101 LEU CDx C 13 22.992 0.172 A 101 LEU CG C 13 27.589 0.172 A 101 LEU N N 15 130.521 0.125 A 102 ALA H H 1 7.673 0.007 A 102 ALA HA H 1 4.994 0.007 A 102 ALA HB% H 1 0.956 0.007 A 102 ALA CA C 13 48.505 0.172 A 102 ALA CB C 13 19.355 0.172 A 102 ALA N N 15 121.373 0.125 A 103 TYR H H 1 9.142 0.007 A 103 TYR HA H 1 5.311 0.007 A 103 TYR HBy H 1 3.645 0.007 A 103 TYR HBx H 1 2.724 0.007 A 103 TYR HDx H 1 7.061 0.007 A 103 TYR HDy H 1 7.061 0.007 A 103 TYR HE1 H 1 6.340 0.007 A 103 TYR HE2 H 1 6.340 0.007 A 103 TYR CA C 13 55.519 0.172 A 103 TYR CB C 13 42.037 0.172 A 103 TYR CDy C 13 127.951 0.172 A 103 TYR CDx C 13 127.946 0.172 A 103 TYR CEx C 13 114.840 0.172 A 103 TYR CEy C 13 114.843 0.172 A 103 TYR N N 15 120.633 0.125 A 104 ASP H H 1 8.803 0.007 A 104 ASP HA H 1 5.163 0.007 A 104 ASP HBx H 1 2.736 0.007 A 104 ASP HBy H 1 3.496 0.007 A 104 ASP CA C 13 49.372 0.172 A 104 ASP CB C 13 39.054 0.172 A 104 ASP N N 15 118.129 0.125 A 105 GLU H H 1 8.568 0.007 A 105 GLU HA H 1 3.624 0.007 A 105 GLU HBx H 1 1.792 0.007 A 105 GLU HBy H 1 1.937 0.007 A 105 GLU HGx H 1 2.021 0.007 A 105 GLU HGy H 1 2.297 0.007 A 105 GLU CA C 13 55.976 0.172 A 105 GLU CB C 13 27.111 0.172 A 105 GLU CG C 13 34.669 0.172 A 105 GLU N N 15 115.031 0.125 A 106 ASP H H 1 7.718 0.007 A 106 ASP N N 15 119.038 0.125 A 107 MET H H 1 8.686 0.007 A 107 MET HA H 1 4.343 0.007 A 107 MET HBx H 1 2.004 0.007 A 107 MET HBy H 1 2.228 0.007 A 107 MET HE% H 1 1.057 0.007 A 107 MET HGy H 1 2.536 0.007 A 107 MET HGx H 1 2.147 0.007 A 107 MET CA C 13 51.671 0.172 A 107 MET CB C 13 21.629 0.172 A 107 MET CE C 13 11.740 0.172 A 107 MET CG C 13 28.404 0.172 A 107 MET N N 15 111.995 0.125 A 108 ASN H H 1 8.420 0.007 A 108 ASN HA H 1 5.111 0.007 A 108 ASN HBy H 1 2.793 0.007 A 108 ASN HBx H 1 2.291 0.007 A 108 ASN HD2x H 1 6.951 0.007 A 108 ASN HD2y H 1 8.550 0.007 A 108 ASN CA C 13 49.519 0.172 A 108 ASN CB C 13 37.221 0.172 A 108 ASN N N 15 117.079 0.125 A 108 ASN ND2 N 15 117.015 0.125 A 109 LEU H H 1 8.760 0.007 A 109 LEU HA H 1 4.020 0.007 A 109 LEU HBy H 1 0.244 0.007 A 109 LEU HBx H 1 -0.003 0.007 A 109 LEU HD1% H 1 0.342 0.007 A 109 LEU HDy% H 1 0.018 0.007 A 109 LEU HG H 1 1.135 0.007 A 109 LEU CA C 13 52.898 0.172 A 109 LEU CB C 13 40.774 0.172 A 109 LEU CD1 C 13 21.307 0.172 A 109 LEU CD2 C 13 23.639 0.172 A 109 LEU CG C 13 23.850 0.172 A 109 LEU N N 15 122.211 0.125 A 110 VAL H H 1 8.609 0.007 A 110 VAL HA H 1 4.551 0.007 A 110 VAL HB H 1 1.918 0.007 A 110 VAL HGx% H 1 0.343 0.007 A 110 VAL HGy% H 1 0.900 0.007 A 110 VAL CA C 13 57.276 0.172 A 110 VAL CB C 13 30.242 0.172 A 110 VAL CGx C 13 16.584 0.172 A 110 VAL CGy C 13 19.388 0.172 A 110 VAL N N 15 109.806 0.125 A 111 SER H H 1 7.191 0.007 A 111 SER HA H 1 4.476 0.007 A 111 SER HBx H 1 3.521 0.007 A 111 SER HBy H 1 3.588 0.007 A 111 SER CA C 13 55.637 0.172 A 111 SER CB C 13 61.288 0.172 A 111 SER N N 15 113.487 0.125 A 112 PHE H H 1 8.770 0.007 A 112 PHE HA H 1 4.991 0.007 A 112 PHE HBy H 1 3.609 0.007 A 112 PHE HBx H 1 2.865 0.007 A 112 PHE HDx H 1 7.316 0.007 A 112 PHE HDy H 1 7.316 0.007 A 112 PHE HEx H 1 6.817 0.007 A 112 PHE HEy H 1 6.817 0.007 A 112 PHE CA C 13 55.305 0.172 A 112 PHE CB C 13 40.128 0.172 A 112 PHE CDy C 13 130.191 0.172 A 112 PHE CDx C 13 130.190 0.172 A 112 PHE CEy C 13 128.034 0.172 A 112 PHE CEx C 13 128.030 0.172 A 112 PHE N N 15 126.988 0.125 A 113 THR H H 1 8.675 0.007 A 113 THR HA H 1 4.775 0.007 A 113 THR HB H 1 4.294 0.007 A 113 THR HG2% H 1 1.169 0.007 A 113 THR CA C 13 57.888 0.172 A 113 THR CB C 13 69.193 0.172 A 113 THR CG2 C 13 18.478 0.172 A 113 THR N N 15 120.333 0.125 A 114 MET H H 1 7.847 0.007 A 114 MET HA H 1 4.380 0.007 A 114 MET HBx H 1 1.560 0.007 A 114 MET HBy H 1 1.648 0.007 A 114 MET HE% H 1 1.819 0.007 A 114 MET HGx H 1 2.040 0.007 A 114 MET HGy H 1 2.077 0.007 A 114 MET CA C 13 53.861 0.172 A 114 MET CB C 13 30.728 0.172 A 114 MET CE C 13 14.755 0.172 A 114 MET CG C 13 29.195 0.172 A 114 MET N N 15 124.535 0.125 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 88 ILE H A 101 LEU H 1.0 . 5.36 2 2 A 101 LEU H A 102 ALA H 1.0 . 5.16 3 3 A 101 LEU H A 100 SER HBy 1.0 . 4.43 4 4 A 101 LEU H A 101 LEU HG 1.0 . 5.16 5 5 A 101 LEU H A 101 LEU HBx 1.0 . 3.73 6 6 A 90 VAL H A 99 TYR HE% 1.0 . 5.32 7 7 A 90 VAL H A 99 TYR HD% 1.0 . 4.61 8 8 A 90 VAL H A 96 ASN HA 1.0 . 5.19 9 9 A 90 VAL H A 89 VAL HB 1.0 . 4.41 10 10 A 90 VAL H A 89 VAL H 1.0 . 4.82 11 11 A 89 VAL H A 69 GLY HAx 1.0 . 5.30 12 12 A 89 VAL H A 69 GLY H 1.0 . 5.13 13 13 A 89 VAL H A 72 THR H 1.0 . 5.15 14 14 A 89 VAL H A 71 CYS HA 1.0 . 4.17 15 15 A 89 VAL H A 70 LYS HB2 1.0 . 5.50 16 15 A 89 VAL H A 70 LYS HB3 1.0 . 5.50 17 16 A 89 VAL H A 88 ILE HD1% 1.0 . 5.40 18 17 A 88 ILE H A 89 VAL HA 1.0 . 5.50 19 18 A 88 ILE H A 99 TYR HD% 1.0 . 5.50 20 19 A 79 ASP H A 78 LYS HG2 1.0 . 5.12 21 19 A 78 LYS HG3 A 79 ASP H 1.0 . 5.12 22 20 A 88 ILE H A 89 VAL H 1.0 . 4.99 23 21 A 79 ASP H A 78 LYS HE2 1.0 . 4.76 24 21 A 79 ASP H A 78 LYS HE3 1.0 . 4.76 25 22 A 88 ILE H A 99 TYR HBx 1.0 . 5.50 26 23 A 88 ILE H A 88 ILE HB 1.0 . 3.97 27 24 A 78 LYS H A 80 ASN HA 1.0 . 5.37 28 25 A 78 LYS H A 77 ILE HG1x 1.0 . 5.28 29 26 A 79 ASP H A 78 LYS H 1.0 . 5.50 30 27 A 78 LYS H A 77 ILE H 1.0 . 4.46 31 28 A 78 LYS H A 80 ASN H 1.0 . 4.78 32 29 A 78 LYS H A 82 LYS HA 1.0 . 4.51 33 30 A 78 LYS H A 78 LYS HBy 1.0 . 3.64 34 31 A 78 LYS H A 78 LYS HBx 1.0 . 3.91 35 32 A 78 LYS H A 78 LYS HG2 1.0 . 4.59 36 32 A 78 LYS HG3 A 78 LYS H 1.0 . 4.59 37 33 A 4 LEU H A 76 GLN HA 1.0 . 4.08 38 34 A 4 LEU H A 75 GLY HAx 1.0 . 5.18 39 35 A 4 LEU H A 3 ILE HB 1.0 . 4.42 40 36 A 4 LEU H A 4 LEU HG 1.0 . 3.15 41 37 A 4 LEU H A 6 GLU H 1.0 . 5.42 42 38 A 4 LEU H A 3 ILE HG1x 1.0 . 5.50 43 39 A 112 PHE H A 112 PHE HD% 1.0 . 5.50 44 40 A 112 PHE H A 39 PHE HE% 1.0 . 5.10 45 41 A 112 PHE H A 112 PHE HBy 1.0 . 3.71 46 42 A 112 PHE H A 113 THR HG2% 1.0 . 4.92 47 43 A 112 PHE H A 39 PHE HZ 1.0 . 5.50 48 44 A 32 TYR H A 34 SER H 1.0 . 4.52 49 45 A 32 TYR H A 32 TYR HE% 1.0 . 4.50 50 46 A 32 TYR H A 31 ASP HA 1.0 . 3.09 51 47 A 32 TYR H A 30 LYS HA 1.0 . 5.50 52 48 A 32 TYR H A 31 ASP HBy 1.0 . 5.30 53 49 A 32 TYR H A 32 TYR HBx 1.0 . 3.44 54 50 A 32 TYR H A 33 GLU HB2 1.0 . 5.50 55 50 A 32 TYR H A 33 GLU HB3 1.0 . 5.50 56 51 A 26 ILE HB A 35 TRP HE1 1.0 . 3.90 57 52 A 35 TRP HE1 A 26 ILE HG2% 1.0 . 4.82 58 53 A 90 VAL H A 91 LYS H 1.0 . 4.88 59 54 A 69 GLY H A 91 LYS H 1.0 . 4.76 60 55 A 91 LYS H A 68 PHE HD% 1.0 . 5.50 61 56 A 91 LYS H A 67 GLU H 1.0 . 3.96 62 57 A 91 LYS H A 65 PHE HE% 1.0 . 5.50 63 58 A 96 ASN HA A 91 LYS H 1.0 . 5.50 64 59 A 69 GLY HAx A 91 LYS H 1.0 . 5.50 65 60 A 13 LYS H A 73 TYR HE% 1.0 . 5.50 66 61 A 13 LYS H A 12 ASP HBy 1.0 . 4.10 67 61 A 13 LYS H A 12 ASP HBx 1.0 . 4.10 68 62 A 13 LYS H A 13 LYS HBy 1.0 . 3.25 69 63 A 13 LYS H A 13 LYS HGy 1.0 . 3.47 70 64 A 13 LYS H A 7 LEU HDx% 1.0 . 4.49 71 65 A 13 LYS H A 14 GLU HA 1.0 . 5.50 72 66 A 52 TYR H A 51 SER HB2 1.0 . 4.22 73 66 A 51 SER HB3 A 52 TYR H 1.0 . 4.22 74 67 A 52 TYR H A 52 TYR HBy 1.0 . 4.06 75 68 A 52 TYR H A 55 TYR HD% 1.0 . 5.50 76 69 A 65 PHE HBx A 66 LYS H 1.0 . 5.11 77 70 A 91 LYS H A 66 LYS H 1.0 . 5.50 78 71 A 66 LYS H A 65 PHE HBy 1.0 . 4.52 79 72 A 66 LYS H A 66 LYS HBy 1.0 . 3.95 80 73 A 66 LYS H A 66 LYS HG2 1.0 . 3.46 81 73 A 66 LYS H A 66 LYS HG3 1.0 . 3.46 82 74 A 66 LYS H A 93 GLU H 1.0 . 4.69 83 75 A 66 LYS H A 92 TYR HD% 1.0 . 4.80 84 76 A 66 LYS H A 90 VAL HGy% 1.0 . 5.44 85 77 A 88 ILE H A 87 ILE H 1.0 . 4.96 86 78 A 87 ILE H A 73 TYR HD% 1.0 . 5.50 87 79 A 87 ILE H A 72 THR HA 1.0 . 5.50 88 80 A 87 ILE H A 72 THR HB 1.0 . 4.28 89 81 A 87 ILE H A 86 VAL HB 1.0 . 4.14 90 82 A 87 ILE H A 72 THR HG2% 1.0 . 5.36 91 83 A 87 ILE H A 74 LEU HDx% 1.0 . 4.19 92 84 A 87 ILE H A 71 CYS HBy 1.0 . 5.50 93 85 A 45 SER H A 47 LEU H 1.0 . 4.39 94 86 A 47 LEU H A 44 GLN HA 1.0 . 5.02 95 87 A 47 LEU H A 47 LEU HB2 1.0 . 3.10 96 87 A 47 LEU H A 47 LEU HB3 1.0 . 3.10 97 88 A 47 LEU H A 47 LEU HD1% 1.0 . 4.91 98 89 A 47 LEU H A 47 LEU HDy% 1.0 . 5.13 99 90 A 40 THR H A 41 LYS H 1.0 . 4.94 100 91 A 41 LYS H A 44 GLN HE2y 1.0 . 4.88 101 92 A 41 LYS H A 108 ASN HBx 1.0 . 5.50 102 93 A 41 LYS H A 41 LYS HBx 1.0 . 3.03 103 94 A 41 LYS H A 41 LYS HGx 1.0 . 4.02 104 95 A 41 LYS H A 41 LYS HD2 1.0 . 5.14 105 95 A 41 LYS H A 41 LYS HD3 1.0 . 5.14 106 96 A 49 GLU H A 52 TYR HE% 1.0 . 5.40 107 97 A 49 GLU H A 51 SER H 1.0 . 5.37 108 98 A 49 GLU H A 49 GLU HBy 1.0 . 3.45 109 99 A 113 THR H A 114 MET H 1.0 . 4.84 110 100 A 114 MET H A 113 THR HA 1.0 . 3.04 111 101 A 114 MET H A 113 THR HB 1.0 . 3.06 112 102 A 114 MET H A 114 MET HGx 1.0 . 3.85 113 103 A 113 THR HG2% A 114 MET H 1.0 . 4.20 114 104 A 114 MET H A 97 VAL HGx% 1.0 . 5.50 115 105 A 89 VAL HA A 98 ASN H 1.0 . 5.04 116 106 A 98 ASN H A 97 VAL H 1.0 . 4.75 117 107 A 98 ASN H A 98 ASN HBx 1.0 . 3.65 118 108 A 98 ASN H A 87 ILE HG2% 1.0 . 5.50 119 109 A 98 ASN HBy A 99 TYR H 1.0 . 5.29 120 110 A 35 TRP H A 36 LYS H 1.0 . 3.55 121 111 A 35 TRP H A 33 GLU H 1.0 . 4.95 122 112 A 35 TRP H A 35 TRP HD1 1.0 . 5.50 123 113 A 35 TRP H A 34 SER HB2 1.0 . 3.57 124 113 A 35 TRP H A 34 SER HB3 1.0 . 3.57 125 114 A 35 TRP H A 32 TYR HA 1.0 . 4.66 126 115 A 35 TRP H A 35 TRP HBy 1.0 . 3.34 127 116 A 35 TRP H A 35 TRP HBx 1.0 . 3.42 128 117 A 35 TRP H A 33 GLU HB2 1.0 . 5.50 129 117 A 33 GLU HB3 A 35 TRP H 1.0 . 5.50 130 118 A 26 ILE HG2% A 35 TRP H 1.0 . 4.37 131 119 A 35 TRP H A 36 LYS HBy 1.0 . 5.35 132 120 A 88 ILE H A 99 TYR H 1.0 . 3.89 133 121 A 99 TYR HE% A 99 TYR H 1.0 . 5.32 134 122 A 89 VAL HA A 99 TYR H 1.0 . 4.21 135 123 A 99 TYR H A 99 TYR HBy 1.0 . 3.46 136 124 A 98 ASN HBx A 99 TYR H 1.0 . 4.43 137 125 A 87 ILE HG2% A 99 TYR H 1.0 . 5.01 138 126 A 99 TYR H A 24 ILE HD1% 1.0 . 4.91 139 127 A 97 VAL H A 92 TYR H 1.0 . 4.81 140 128 A 96 ASN HA A 92 TYR H 1.0 . 3.87 141 129 A 92 TYR H A 92 TYR HB2 1.0 . 3.51 142 129 A 92 TYR H A 92 TYR HB3 1.0 . 3.51 143 130 A 92 TYR H A 91 LYS HB2 1.0 . 4.21 144 130 A 92 TYR H A 91 LYS HB3 1.0 . 4.21 145 131 A 90 VAL HGy% A 92 TYR H 1.0 . 5.50 146 132 A 92 TYR H A 95 GLY H 1.0 . 4.34 147 133 A 92 TYR H A 65 PHE HA 1.0 . 4.96 148 134 A 55 TYR HD% A 55 TYR H 1.0 . 4.64 149 135 A 55 TYR H A 55 TYR HBx 1.0 . 3.54 150 136 A 55 TYR H A 56 LEU HBy 1.0 . 5.50 151 137 A 24 ILE H A 25 GLU H 1.0 . 3.59 152 138 A 24 ILE H A 20 ALA HA 1.0 . 5.10 153 139 A 24 ILE H A 23 ASP HBy 1.0 . 4.24 154 140 A 24 ILE H A 23 ASP HBx 1.0 . 5.12 155 141 A 24 ILE H A 24 ILE HG1y 1.0 . 3.68 156 142 A 24 ILE H A 24 ILE HG1x 1.0 . 4.34 157 143 A 77 ILE H A 3 ILE HA 1.0 . 4.89 158 144 A 77 ILE H A 76 GLN HBx 1.0 . 3.67 159 145 A 77 ILE H A 77 ILE HG1y 1.0 . 4.05 160 146 A 24 ILE H A 101 LEU HDx% 1.0 . 5.36 161 147 A 64 GLU H A 65 PHE H 1.0 . 5.01 162 148 A 66 LYS H A 65 PHE H 1.0 . 5.10 163 149 A 65 PHE H A 65 PHE HD% 1.0 . 4.63 164 150 A 65 PHE H A 92 TYR HA 1.0 . 5.41 165 151 A 65 PHE HBx A 65 PHE H 1.0 . 3.19 166 152 A 65 PHE H A 64 GLU HGy 1.0 . 4.25 167 153 A 65 PHE H A 66 LYS HG2 1.0 . 5.50 168 153 A 66 LYS HG3 A 65 PHE H 1.0 . 5.50 169 154 A 4 LEU H A 3 ILE H 1.0 . 4.54 170 155 A 3 ILE H A 2 GLU HGx 1.0 . 4.33 171 156 A 3 ILE H A 2 GLU HBy 1.0 . 3.94 172 157 A 3 ILE HG1x A 3 ILE H 1.0 . 3.80 173 158 A 73 TYR HD% A 73 TYR H 1.0 . 3.48 174 159 A 73 TYR H A 73 TYR HBy 1.0 . 4.07 175 160 A 73 TYR H A 73 TYR HBx 1.0 . 3.47 176 161 A 74 LEU HDx% A 73 TYR H 1.0 . 5.50 177 162 A 24 ILE H A 23 ASP H 1.0 . 3.60 178 163 A 25 GLU H A 23 ASP H 1.0 . 4.88 179 164 A 23 ASP H A 22 GLU H 1.0 . 3.32 180 165 A 23 ASP H A 19 GLN HA 1.0 . 4.65 181 166 A 23 ASP HBy A 23 ASP H 1.0 . 3.38 182 167 A 23 ASP HBx A 23 ASP H 1.0 . 3.88 183 168 A 101 LEU HDx% A 23 ASP H 1.0 . 5.26 184 169 A 23 ASP H A 26 ILE HD1% 1.0 . 5.50 185 170 A 20 ALA H A 21 MET HA 1.0 . 4.53 186 171 A 23 ASP H A 20 ALA H 1.0 . 5.50 187 172 A 20 ALA H A 21 MET H 1.0 . 3.48 188 173 A 20 ALA H A 103 TYR HE% 1.0 . 5.30 189 174 A 20 ALA H A 21 MET HGy 1.0 . 5.50 190 175 A 20 ALA H A 19 GLN HBy 1.0 . 4.53 191 176 A 69 GLY H A 70 LYS H 1.0 . 4.31 192 177 A 70 LYS H A 88 ILE HA 1.0 . 5.50 193 178 A 69 GLY HAx A 70 LYS H 1.0 . 3.01 194 179 A 70 LYS H A 70 LYS HG2 1.0 . 4.01 195 179 A 70 LYS H A 70 LYS HG3 1.0 . 4.01 196 180 A 40 THR H A 109 LEU H 1.0 . 4.81 197 181 A 109 LEU H A 108 ASN HBy 1.0 . 4.52 198 182 A 109 LEU H A 109 LEU HG 1.0 . 3.92 199 183 A 109 LEU H A 109 LEU HBy 1.0 . 3.50 200 184 A 109 LEU H A 109 LEU HBx 1.0 . 3.68 201 185 A 109 LEU H A 38 ARG HBx 1.0 . 5.50 202 186 A 55 TYR HA A 59 LEU H 1.0 . 5.50 203 187 A 59 LEU H A 58 ILE HG1y 1.0 . 4.94 204 188 A 59 LEU H A 60 GLU H 1.0 . 3.57 205 189 A 59 LEU H A 58 ILE H 1.0 . 3.31 206 190 A 59 LEU H A 57 LYS HA 1.0 . 5.08 207 191 A 59 LEU H A 62 GLN HGy 1.0 . 5.50 208 192 A 59 LEU H A 59 LEU HBy 1.0 . 3.40 209 193 A 59 LEU H A 59 LEU HBx 1.0 . 3.35 210 194 A 59 LEU H A 56 LEU HDy% 1.0 . 5.50 211 195 A 93 GLU H A 64 GLU H 1.0 . 4.81 212 196 A 93 GLU H A 92 TYR HD% 1.0 . 4.63 213 197 A 93 GLU H A 92 TYR HB2 1.0 . 3.28 214 197 A 93 GLU H A 92 TYR HB3 1.0 . 3.28 215 198 A 93 GLU H A 93 GLU HBy 1.0 . 3.18 216 199 A 93 GLU H A 66 LYS HD2 1.0 . 5.00 217 199 A 93 GLU H A 66 LYS HD3 1.0 . 5.00 218 200 A 93 GLU H A 66 LYS HG2 1.0 . 4.01 219 200 A 66 LYS HG3 A 93 GLU H 1.0 . 4.01 220 201 A 93 GLU H A 63 GLY HAy 1.0 . 4.58 221 202 A 109 LEU H A 39 PHE H 1.0 . 5.49 222 203 A 97 VAL H A 96 ASN H 1.0 . 4.40 223 204 A 92 TYR HD% A 97 VAL H 1.0 . 4.52 224 205 A 97 VAL H A 91 LYS HA 1.0 . 4.88 225 206 A 89 VAL HA A 97 VAL H 1.0 . 5.07 226 207 A 97 VAL H A 90 VAL HB 1.0 . 4.50 227 208 A 97 VAL H A 98 ASN HA 1.0 . 5.50 228 209 A 11 PHE HBy A 12 ASP H 1.0 . 4.35 229 210 A 12 ASP H A 12 ASP HBy 1.0 . 3.17 230 210 A 12 ASP HBx A 12 ASP H 1.0 . 3.17 231 211 A 7 LEU HDx% A 12 ASP H 1.0 . 5.14 232 212 A 5 LYS H A 5 LYS HD2 1.0 . 3.19 233 212 A 5 LYS H A 5 LYS HD3 1.0 . 3.19 234 213 A 5 LYS H A 4 LEU HDx% 1.0 . 4.33 235 214 A 12 ASP H A 11 PHE H 1.0 . 5.19 236 215 A 12 ASP H A 11 PHE HDy 1.0 . 5.30 237 216 A 12 ASP H A 15 THR HB 1.0 . 3.98 238 217 A 102 ALA H A 110 VAL H 1.0 . 4.27 239 218 A 102 ALA H A 111 SER H 1.0 . 3.84 240 219 A 102 ALA H A 101 LEU HA 1.0 . 2.86 241 220 A 102 ALA H A 111 SER HBx 1.0 . 4.22 242 221 A 102 ALA H A 109 LEU HDy% 1.0 . 5.50 243 222 A 9 GLU H A 10 GLY H 1.0 . 4.59 244 223 A 73 TYR HE% A 16 VAL H 1.0 . 5.26 245 224 A 15 THR HB A 16 VAL H 1.0 . 3.45 246 225 A 16 VAL H A 12 ASP HBy 1.0 . 4.81 247 225 A 12 ASP HBx A 16 VAL H 1.0 . 4.81 248 226 A 16 VAL H A 16 VAL HB 1.0 . 3.23 249 227 A 79 ASP H A 81 LYS H 1.0 . 5.50 250 228 A 78 LYS H A 81 LYS H 1.0 . 3.61 251 229 A 80 ASN H A 81 LYS H 1.0 . 3.40 252 230 A 81 LYS H A 83 TYR HE% 1.0 . 4.99 253 231 A 81 LYS H A 80 ASN HBy 1.0 . 4.30 254 231 A 81 LYS H A 80 ASN HBx 1.0 . 4.30 255 232 A 81 LYS H A 79 ASP HBx 1.0 . 4.59 256 233 A 81 LYS H A 81 LYS HBy 1.0 . 3.21 257 234 A 81 LYS H A 81 LYS HBx 1.0 . 3.44 258 235 A 81 LYS H A 83 TYR HD% 1.0 . 5.50 259 236 A 30 LYS H A 31 ASP H 1.0 . 3.71 260 237 A 32 TYR HE% A 31 ASP H 1.0 . 4.80 261 238 A 31 ASP HBy A 31 ASP H 1.0 . 3.49 262 239 A 31 ASP H A 31 ASP HBx 1.0 . 3.66 263 240 A 31 ASP H A 30 LYS HBx 1.0 . 5.02 264 241 A 31 ASP H A 29 SER H 1.0 . 4.79 265 242 A 11 PHE H A 9 GLU H 1.0 . 5.50 266 243 A 9 GLU H A 9 GLU HG2 1.0 . 3.50 267 243 A 9 GLU H A 9 GLU HG3 1.0 . 3.50 268 244 A 9 GLU H A 8 PRO HBx 1.0 . 2.83 269 245 A 9 GLU H A 4 LEU HD2% 1.0 . 5.21 270 246 A 7 LEU HDx% A 16 VAL H 1.0 . 5.50 271 247 A 55 TYR HA A 58 ILE H 1.0 . 4.28 272 248 A 58 ILE H A 59 LEU HBy 1.0 . 4.71 273 249 A 102 ALA H A 103 TYR H 1.0 . 4.92 274 250 A 103 TYR H A 76 GLN HE2y 1.0 . 5.31 275 251 A 103 TYR H A 76 GLN HE2x 1.0 . 4.45 276 252 A 103 TYR H A 103 TYR HBy 1.0 . 4.05 277 253 A 103 TYR H A 103 TYR HBx 1.0 . 3.55 278 254 A 25 GLU H A 26 ILE H 1.0 . 3.70 279 255 A 103 TYR H A 83 TYR HBx 1.0 . 5.50 280 256 A 112 PHE HD% A 113 THR H 1.0 . 5.07 281 257 A 113 THR H A 112 PHE HBx 1.0 . 4.78 282 258 A 101 LEU HG A 113 THR H 1.0 . 5.30 283 259 A 113 THR H A 101 LEU HDy% 1.0 . 4.96 284 260 A 113 THR H A 112 PHE HA 1.0 . 2.97 285 261 A 113 THR HG2% A 113 THR H 1.0 . 4.11 286 262 A 72 THR H A 87 ILE H 1.0 . 3.51 287 263 A 72 THR H A 88 ILE HA 1.0 . 4.02 288 264 A 72 THR H A 72 THR HB 1.0 . 3.60 289 265 A 72 THR H A 87 ILE HB 1.0 . 4.00 290 266 A 72 THR H A 86 VAL HGy% 1.0 . 4.35 291 267 A 25 GLU HA A 27 ALA H 1.0 . 3.85 292 268 A 20 ALA H A 19 GLN H 1.0 . 3.40 293 269 A 16 VAL H A 19 GLN H 1.0 . 4.72 294 270 A 19 GLN H A 19 GLN HGy 1.0 . 5.33 295 271 A 19 GLN H A 18 LYS HBy 1.0 . 3.22 296 272 A 19 GLN H A 19 GLN HBx 1.0 . 3.42 297 273 A 36 LYS H A 38 ARG H 1.0 . 5.44 298 274 A 38 ARG H A 39 PHE HD% 1.0 . 4.45 299 275 A 38 ARG H A 37 SER HBy 1.0 . 4.12 300 276 A 38 ARG H A 38 ARG HGx 1.0 . 4.52 301 277 A 23 ASP H A 19 GLN HE2y 1.0 . 5.36 302 278 A 19 GLN HE2y A 22 GLU HB2 1.0 . 4.49 303 278 A 19 GLN HE2y A 22 GLU HB3 1.0 . 4.49 304 279 A 23 ASP H A 19 GLN HE2x 1.0 . 5.50 305 280 A 103 TYR HE% A 19 GLN HE2x 1.0 . 5.50 306 281 A 53 ASP HA A 56 LEU H 1.0 . 3.90 307 282 A 55 TYR HBx A 56 LEU H 1.0 . 3.87 308 283 A 56 LEU H A 56 LEU HG 1.0 . 3.32 309 284 A 56 LEU HDy% A 56 LEU H 1.0 . 4.48 310 285 A 59 LEU H A 56 LEU H 1.0 . 5.08 311 286 A 55 TYR H A 56 LEU H 1.0 . 3.55 312 287 A 56 LEU HBy A 56 LEU H 1.0 . 3.37 313 288 A 53 ASP H A 54 SER H 1.0 . 3.45 314 289 A 52 TYR H A 53 ASP H 1.0 . 3.43 315 290 A 55 TYR H A 53 ASP H 1.0 . 5.50 316 291 A 53 ASP H A 52 TYR HD% 1.0 . 5.50 317 292 A 53 ASP H A 53 ASP HBy 1.0 . 3.15 318 293 A 53 ASP H A 56 LEU HD1% 1.0 . 5.50 319 294 A 19 GLN H A 17 ARG H 1.0 . 4.49 320 295 A 44 GLN H A 44 GLN HGy 1.0 . 3.49 321 296 A 44 GLN H A 44 GLN HBx 1.0 . 3.15 322 297 A 17 ARG H A 17 ARG HBy 1.0 . 3.30 323 298 A 17 ARG H A 17 ARG HBx 1.0 . 3.28 324 299 A 17 ARG H A 17 ARG HGy 1.0 . 4.80 325 300 A 17 ARG H A 17 ARG HGx 1.0 . 4.62 326 301 A 17 ARG H A 16 VAL HG2% 1.0 . 4.85 327 302 A 44 GLN H A 39 PHE HBy 1.0 . 5.50 328 303 A 44 GLN H A 43 LEU HG 1.0 . 5.50 329 304 A 44 GLN H A 43 LEU HBx 1.0 . 4.34 330 305 A 82 LYS H A 82 LYS HE2 1.0 . 5.43 331 305 A 82 LYS H A 82 LYS HE3 1.0 . 5.43 332 306 A 82 LYS H A 82 LYS HBy 1.0 . 3.24 333 307 A 81 LYS HBx A 82 LYS H 1.0 . 3.24 334 308 A 75 GLY H A 76 GLN H 1.0 . 4.94 335 309 A 83 TYR HD% A 76 GLN H 1.0 . 5.50 336 310 A 76 GLN H A 83 TYR HBy 1.0 . 5.15 337 311 A 76 GLN H A 7 LEU HDy% 1.0 . 5.50 338 312 A 104 ASP HA A 106 ASP H 1.0 . 5.22 339 313 A 106 ASP H A 104 ASP HBy 1.0 . 4.63 340 314 A 106 ASP H A 105 GLU HGy 1.0 . 5.34 341 315 A 41 LYS H A 43 LEU H 1.0 . 5.04 342 316 A 44 GLN H A 43 LEU H 1.0 . 3.08 343 317 A 39 PHE HD% A 43 LEU H 1.0 . 5.50 344 318 A 43 LEU H A 41 LYS HA 1.0 . 5.15 345 319 A 43 LEU H A 42 ASP HBx 1.0 . 3.81 346 320 A 43 LEU H A 44 GLN HGx 1.0 . 5.50 347 321 A 43 LEU H A 43 LEU HBy 1.0 . 3.18 348 322 A 76 GLN H A 75 GLY HAy 1.0 . 3.38 349 323 A 83 TYR HBx A 76 GLN H 1.0 . 4.32 350 324 A 76 GLN HBx A 76 GLN H 1.0 . 3.69 351 325 A 4 LEU HG A 76 GLN H 1.0 . 5.50 352 326 A 4 LEU HD2% A 76 GLN H 1.0 . 4.82 353 327 A 6 GLU H A 7 LEU H 1.0 . 4.72 354 328 A 73 TYR HD% A 7 LEU H 1.0 . 5.37 355 329 A 73 TYR HBx A 7 LEU H 1.0 . 4.46 356 330 A 7 LEU H A 6 GLU HBy 1.0 . 3.46 357 331 A 7 LEU H A 7 LEU HG 1.0 . 3.37 358 332 A 7 LEU H A 7 LEU HBy 1.0 . 3.28 359 333 A 7 LEU H A 7 LEU HBx 1.0 . 3.69 360 334 A 7 LEU HDy% A 7 LEU H 1.0 . 4.64 361 335 A 7 LEU HDx% A 7 LEU H 1.0 . 4.53 362 336 A 106 ASP H A 107 MET H 1.0 . 3.20 363 337 A 106 ASP H A 107 MET HA 1.0 . 5.18 364 338 A 106 ASP H A 104 ASP HBx 1.0 . 3.18 365 339 A 68 PHE H A 67 GLU HB2 1.0 . 4.03 366 339 A 67 GLU HB3 A 68 PHE H 1.0 . 4.03 367 340 A 65 PHE HE% A 68 PHE H 1.0 . 4.08 368 341 A 92 TYR HD% A 64 GLU H 1.0 . 5.50 369 342 A 24 ILE H A 22 GLU H 1.0 . 5.00 370 343 A 22 GLU H A 20 ALA H 1.0 . 5.04 371 344 A 25 GLU H A 22 GLU H 1.0 . 5.50 372 345 A 22 GLU H A 19 GLN HA 1.0 . 4.39 373 346 A 23 ASP HBy A 22 GLU H 1.0 . 5.50 374 347 A 22 GLU H A 21 MET HBy 1.0 . 3.56 375 348 A 22 GLU H A 21 MET HBx 1.0 . 3.94 376 349 A 22 GLU H A 21 MET HGx 1.0 . 5.41 377 350 A 20 ALA HA A 22 GLU H 1.0 . 5.50 378 351 A 68 PHE HD% A 68 PHE H 1.0 . 3.92 379 352 A 68 PHE H A 68 PHE HBx 1.0 . 3.27 380 353 A 64 GLU H A 92 TYR HB2 1.0 . 5.50 381 353 A 92 TYR HB3 A 64 GLU H 1.0 . 5.50 382 354 A 64 GLU H A 93 GLU HBy 1.0 . 3.45 383 355 A 64 GLU H A 64 GLU HBx 1.0 . 3.07 384 356 A 60 GLU H A 59 LEU HBy 1.0 . 3.43 385 357 A 49 GLU H A 50 GLU H 1.0 . 3.44 386 358 A 51 SER H A 50 GLU H 1.0 . 3.32 387 359 A 50 GLU H A 48 THR HB 1.0 . 3.30 388 360 A 49 GLU HBy A 50 GLU H 1.0 . 3.77 389 361 A 50 GLU H A 49 GLU HBx 1.0 . 4.01 390 362 A 13 LYS H A 14 GLU H 1.0 . 3.67 391 363 A 14 GLU H A 15 THR H 1.0 . 3.18 392 364 A 14 GLU H A 12 ASP HA 1.0 . 4.98 393 365 A 15 THR HB A 14 GLU H 1.0 . 5.12 394 366 A 14 GLU H A 12 ASP HBy 1.0 . 4.89 395 366 A 12 ASP HBx A 14 GLU H 1.0 . 4.89 396 367 A 14 GLU H A 14 GLU HG2 1.0 . 3.56 397 367 A 14 GLU H A 14 GLU HG3 1.0 . 3.56 398 368 A 14 GLU H A 14 GLU HB2 1.0 . 3.05 399 368 A 14 GLU H A 14 GLU HB3 1.0 . 3.05 400 369 A 13 LYS HBy A 14 GLU H 1.0 . 3.49 401 370 A 13 LYS HGy A 14 GLU H 1.0 . 5.50 402 371 A 14 GLU H A 13 LYS HGx 1.0 . 5.36 403 372 A 60 GLU H A 60 GLU HGy 1.0 . 3.81 404 373 A 60 GLU H A 59 LEU HBx 1.0 . 3.94 405 374 A 60 GLU H A 59 LEU HDy% 1.0 . 4.65 406 375 A 7 LEU HDx% A 14 GLU H 1.0 . 5.50 407 376 A 72 THR H A 71 CYS H 1.0 . 5.13 408 377 A 88 ILE HA A 71 CYS H 1.0 . 5.32 409 378 A 72 THR HA A 71 CYS H 1.0 . 5.13 410 379 A 71 CYS H A 70 LYS HB2 1.0 . 3.49 411 379 A 70 LYS HB3 A 71 CYS H 1.0 . 3.49 412 380 A 60 GLU H A 56 LEU HA 1.0 . 4.44 413 381 A 60 GLU H A 57 LYS H 1.0 . 5.09 414 382 A 59 LEU H A 57 LYS H 1.0 . 4.77 415 383 A 56 LEU H A 57 LYS H 1.0 . 3.46 416 384 A 58 ILE H A 57 LYS H 1.0 . 3.40 417 385 A 57 LYS H A 57 LYS HGy 1.0 . 3.68 418 386 A 57 LYS H A 56 LEU HBx 1.0 . 4.07 419 387 A 16 VAL H A 15 THR H 1.0 . 2.88 420 388 A 15 THR HB A 15 THR H 1.0 . 3.20 421 389 A 15 THR H A 12 ASP HBy 1.0 . 3.83 422 389 A 12 ASP HBx A 15 THR H 1.0 . 3.83 423 390 A 15 THR H A 15 THR HG2% 1.0 . 4.30 424 391 A 56 LEU HD1% A 57 LYS H 1.0 . 5.50 425 392 A 56 LEU HDy% A 57 LYS H 1.0 . 5.50 426 393 A 106 ASP H A 104 ASP H 1.0 . 5.50 427 394 A 107 MET HA A 104 ASP H 1.0 . 5.00 428 395 A 108 ASN HBx A 104 ASP H 1.0 . 5.50 429 396 A 110 VAL H A 104 ASP H 1.0 . 4.67 430 397 A 104 ASP H A 108 ASN H 1.0 . 4.00 431 398 A 83 TYR HD% A 104 ASP H 1.0 . 5.50 432 399 A 104 ASP H A 109 LEU HA 1.0 . 4.83 433 400 A 103 TYR HBy A 104 ASP H 1.0 . 3.96 434 401 A 104 ASP HBx A 104 ASP H 1.0 . 3.58 435 402 A 104 ASP H A 40 THR HG2% 1.0 . 5.50 436 403 A 83 TYR HE% A 83 TYR H 1.0 . 5.50 437 404 A 77 ILE HG1x A 83 TYR H 1.0 . 5.50 438 405 A 78 LYS H A 83 TYR H 1.0 . 5.02 439 406 A 82 LYS H A 83 TYR H 1.0 . 4.59 440 407 A 83 TYR H A 77 ILE HA 1.0 . 4.37 441 408 A 82 LYS HA A 83 TYR H 1.0 . 3.06 442 409 A 83 TYR H A 77 ILE HG2% 1.0 . 5.43 443 410 A 73 TYR H A 74 LEU H 1.0 . 4.59 444 411 A 74 LEU H A 73 TYR HA 1.0 . 2.94 445 412 A 74 LEU H A 6 GLU HA 1.0 . 5.14 446 413 A 74 LEU H A 85 GLY HAx 1.0 . 4.95 447 414 A 73 TYR HBy A 74 LEU H 1.0 . 3.63 448 415 A 73 TYR HBx A 74 LEU H 1.0 . 4.10 449 416 A 74 LEU HDx% A 74 LEU H 1.0 . 4.16 450 417 A 36 LYS H A 35 TRP HBy 1.0 . 4.18 451 418 A 11 PHE H A 10 GLY H 1.0 . 3.20 452 419 A 11 PHE H A 11 PHE HDy 1.0 . 3.63 453 420 A 11 PHE H A 11 PHE HBx 1.0 . 3.83 454 421 A 11 PHE H A 9 GLU HB2 1.0 . 4.91 455 421 A 11 PHE H A 9 GLU HB3 1.0 . 4.91 456 422 A 11 PHE H A 7 LEU HBx 1.0 . 5.22 457 423 A 7 LEU HDx% A 11 PHE H 1.0 . 5.50 458 424 A 36 LYS H A 33 GLU HB2 1.0 . 5.50 459 424 A 33 GLU HB3 A 36 LYS H 1.0 . 5.50 460 425 A 39 PHE H A 44 GLN HE2x 1.0 . 5.50 461 426 A 39 PHE H A 39 PHE HD% 1.0 . 3.54 462 427 A 39 PHE H A 36 LYS HA 1.0 . 4.94 463 428 A 39 PHE H A 39 PHE HBy 1.0 . 3.47 464 429 A 39 PHE H A 44 GLN HGx 1.0 . 5.19 465 430 A 38 ARG HBx A 39 PHE H 1.0 . 5.50 466 431 A 107 MET H A 108 ASN H 1.0 . 3.46 467 432 A 108 ASN H A 108 ASN HD2x 1.0 . 5.46 468 433 A 108 ASN H A 103 TYR HA 1.0 . 4.81 469 434 A 103 TYR HBy A 108 ASN H 1.0 . 4.79 470 435 A 108 ASN HBy A 108 ASN H 1.0 . 3.36 471 436 A 108 ASN H A 107 MET HBx 1.0 . 5.50 472 437 A 108 ASN H A 40 THR HG2% 1.0 . 5.50 473 438 A 40 THR HG2% A 108 ASN HD2y 1.0 . 5.50 474 439 A 104 ASP H A 108 ASN HD2y 1.0 . 5.50 475 440 A 106 ASP H A 108 ASN HD2y 1.0 . 5.50 476 441 A 108 ASN HD2y A 108 ASN HA 1.0 . 5.50 477 442 A 108 ASN HD2y A 40 THR HA 1.0 . 5.00 478 443 A 108 ASN HBy A 108 ASN HD2y 1.0 . 3.45 479 444 A 106 ASP H A 108 ASN H 1.0 . 4.22 480 445 A 108 ASN HBx A 108 ASN H 1.0 . 3.98 481 446 A 108 ASN HD2x A 108 ASN HA 1.0 . 5.50 482 447 A 108 ASN HD2x A 40 THR HA 1.0 . 5.42 483 448 A 108 ASN HBy A 108 ASN HD2x 1.0 . 3.65 484 449 A 40 THR HG2% A 108 ASN HD2x 1.0 . 5.50 485 450 A 96 ASN H A 96 ASN HBy 1.0 . 3.35 486 451 A 96 ASN H A 96 ASN HBx 1.0 . 3.89 487 452 A 96 ASN H A 97 VAL HG2% 1.0 . 5.36 488 453 A 95 GLY H A 96 ASN H 1.0 . 4.46 489 454 A 52 TYR H A 51 SER H 1.0 . 3.64 490 455 A 51 SER H A 48 THR HB 1.0 . 4.18 491 456 A 51 SER H A 51 SER HB2 1.0 . 3.03 492 456 A 51 SER HB3 A 51 SER H 1.0 . 3.03 493 457 A 51 SER H A 50 GLU HG2 1.0 . 4.66 494 457 A 51 SER H A 50 GLU HG3 1.0 . 4.66 495 458 A 51 SER H A 50 GLU HBy 1.0 . 3.85 496 459 A 51 SER H A 50 GLU HBx 1.0 . 3.75 497 460 A 41 LYS H A 42 ASP H 1.0 . 3.49 498 461 A 44 GLN H A 42 ASP H 1.0 . 4.66 499 462 A 43 LEU H A 42 ASP H 1.0 . 3.27 500 463 A 40 THR HA A 42 ASP H 1.0 . 4.68 501 464 A 42 ASP HBx A 42 ASP H 1.0 . 3.13 502 465 A 41 LYS HBx A 42 ASP H 1.0 . 3.30 503 466 A 42 ASP H A 41 LYS HD2 1.0 . 5.00 504 466 A 41 LYS HD3 A 42 ASP H 1.0 . 5.00 505 467 A 40 THR HG2% A 42 ASP H 1.0 . 4.23 506 468 A 51 SER H A 49 GLU HBx 1.0 . 5.50 507 469 A 17 ARG H A 18 LYS H 1.0 . 3.43 508 470 A 18 LYS H A 17 ARG HDx 1.0 . 5.50 509 471 A 17 ARG HBy A 18 LYS H 1.0 . 3.97 510 472 A 18 LYS HBy A 18 LYS H 1.0 . 2.93 511 473 A 18 LYS H A 18 LYS HG2 1.0 . 3.76 512 473 A 18 LYS H A 18 LYS HG3 1.0 . 3.76 513 474 A 18 LYS H A 16 VAL HA 1.0 . 4.94 514 475 A 34 SER H A 31 ASP HA 1.0 . 5.50 515 476 A 34 SER H A 34 SER HB2 1.0 . 3.24 516 476 A 34 SER H A 34 SER HB3 1.0 . 3.24 517 477 A 34 SER H A 31 ASP HBy 1.0 . 4.66 518 478 A 34 SER H A 33 GLU HG2 1.0 . 5.50 519 478 A 34 SER H A 33 GLU HG3 1.0 . 5.50 520 479 A 34 SER H A 26 ILE HG2% 1.0 . 5.50 521 480 A 34 SER H A 36 LYS HBy 1.0 . 5.50 522 481 A 32 TYR H A 33 GLU H 1.0 . 3.76 523 482 A 34 SER H A 33 GLU H 1.0 . 3.34 524 483 A 31 ASP HA A 33 GLU H 1.0 . 4.69 525 484 A 33 GLU H A 34 SER HB2 1.0 . 4.96 526 484 A 33 GLU H A 34 SER HB3 1.0 . 4.96 527 485 A 32 TYR HBx A 33 GLU H 1.0 . 3.63 528 486 A 33 GLU H A 33 GLU HB2 1.0 . 2.99 529 486 A 33 GLU HB3 A 33 GLU H 1.0 . 2.99 530 487 A 33 GLU H A 36 LYS HBy 1.0 . 5.50 531 488 A 33 GLU H A 36 LYS HGx 1.0 . 5.50 532 489 A 33 GLU H A 34 SER HA 1.0 . 5.50 533 490 A 6 GLU H A 75 GLY H 1.0 . 4.59 534 491 A 6 GLU H A 74 LEU HDx% 1.0 . 5.50 535 492 A 6 GLU H A 5 LYS H 1.0 . 3.35 536 493 A 6 GLU H A 5 LYS HA 1.0 . 3.22 537 494 A 75 GLY HAx A 6 GLU H 1.0 . 5.50 538 495 A 6 GLU H A 8 PRO HDx 1.0 . 5.50 539 496 A 6 GLU H A 6 GLU HGx 1.0 . 3.55 540 497 A 6 GLU H A 4 LEU HB2 1.0 . 3.18 541 497 A 6 GLU H A 4 LEU HB3 1.0 . 3.18 542 498 A 6 GLU H A 4 LEU HD2% 1.0 . 4.80 543 499 A 58 ILE HA A 61 LYS H 1.0 . 4.35 544 500 A 61 LYS H A 61 LYS HE2 1.0 . 5.50 545 500 A 61 LYS H A 61 LYS HE3 1.0 . 5.50 546 501 A 61 LYS H A 62 GLN HBx 1.0 . 5.27 547 502 A 59 LEU H A 61 LYS H 1.0 . 5.09 548 503 A 60 GLU H A 61 LYS H 1.0 . 3.44 549 504 A 61 LYS H A 62 GLN H 1.0 . 3.31 550 505 A 61 LYS H A 62 GLN HE2x 1.0 . 5.49 551 506 A 61 LYS H A 61 LYS HGy 1.0 . 3.60 552 507 A 61 LYS H A 58 ILE HG2% 1.0 . 5.32 553 508 A 99 TYR HBy A 100 SER H 1.0 . 4.65 554 509 A 113 THR HG2% A 100 SER H 1.0 . 5.50 555 510 A 99 TYR HD% A 100 SER H 1.0 . 4.74 556 511 A 113 THR HA A 100 SER H 1.0 . 5.23 557 512 A 100 SER HBy A 100 SER H 1.0 . 3.60 558 513 A 99 TYR HBx A 100 SER H 1.0 . 4.14 559 514 A 100 SER H A 87 ILE HG1x 1.0 . 5.50 560 515 A 101 LEU HDy% A 100 SER H 1.0 . 4.85 561 516 A 101 LEU H A 86 VAL H 1.0 . 3.72 562 517 A 102 ALA H A 86 VAL H 1.0 . 5.50 563 518 A 86 VAL H A 85 GLY HAy 1.0 . 3.10 564 519 A 85 GLY HAx A 86 VAL H 1.0 . 3.29 565 520 A 86 VAL HGy% A 86 VAL H 1.0 . 4.47 566 521 A 73 TYR HD% A 86 VAL H 1.0 . 5.50 567 522 A 45 SER H A 46 SER H 1.0 . 3.39 568 523 A 47 LEU H A 46 SER H 1.0 . 2.96 569 524 A 46 SER H A 43 LEU HA 1.0 . 3.98 570 525 A 46 SER H A 45 SER HBx 1.0 . 3.42 571 526 A 44 GLN HA A 46 SER H 1.0 . 4.72 572 527 A 44 GLN HBx A 46 SER H 1.0 . 5.20 573 528 A 47 LEU HD1% A 46 SER H 1.0 . 5.50 574 529 A 106 ASP H A 105 GLU H 1.0 . 3.86 575 530 A 83 TYR HE% A 105 GLU H 1.0 . 5.41 576 531 A 105 GLU H A 105 GLU HBy 1.0 . 3.59 577 532 A 105 GLU H A 105 GLU HBx 1.0 . 3.44 578 533 A 83 TYR HD% A 105 GLU H 1.0 . 5.01 579 534 A 29 SER H A 28 GLN H 1.0 . 3.71 580 535 A 30 LYS H A 29 SER H 1.0 . 3.55 581 536 A 29 SER H A 29 SER HB2 1.0 . 3.11 582 536 A 29 SER H A 29 SER HB3 1.0 . 3.11 583 537 A 29 SER H A 25 GLU HA 1.0 . 5.23 584 538 A 29 SER H A 26 ILE HA 1.0 . 4.27 585 539 A 29 SER H A 28 GLN HGy 1.0 . 5.50 586 540 A 29 SER H A 28 GLN HGx 1.0 . 5.50 587 541 A 29 SER H A 28 GLN HB2 1.0 . 4.15 588 541 A 29 SER H A 28 GLN HB3 1.0 . 4.15 589 542 A 23 ASP H A 21 MET H 1.0 . 5.17 590 543 A 21 MET H A 18 LYS HA 1.0 . 4.08 591 544 A 21 MET H A 21 MET HGy 1.0 . 3.46 592 545 A 21 MET H A 22 GLU HB2 1.0 . 5.11 593 545 A 21 MET H A 22 GLU HB3 1.0 . 5.11 594 546 A 21 MET H A 21 MET HBy 1.0 . 3.32 595 547 A 88 ILE HD1% A 21 MET H 1.0 . 4.98 596 548 A 21 MET H A 21 MET HGx 1.0 . 3.89 597 549 A 46 SER H A 43 LEU HD1% 1.0 . 5.50 598 550 A 52 TYR H A 54 SER H 1.0 . 4.45 599 551 A 55 TYR H A 54 SER H 1.0 . 3.40 600 552 A 54 SER H A 50 GLU HA 1.0 . 2.96 601 553 A 55 TYR HBx A 54 SER H 1.0 . 5.19 602 554 A 56 LEU HBy A 54 SER H 1.0 . 5.50 603 555 A 62 GLN H A 63 GLY H 1.0 . 3.04 604 556 A 62 GLN H A 62 GLN HE2x 1.0 . 4.76 605 557 A 62 GLN H A 62 GLN HBy 1.0 . 4.05 606 558 A 62 GLN H A 62 GLN HGx 1.0 . 3.86 607 559 A 62 GLN HBx A 62 GLN H 1.0 . 3.51 608 560 A 60 GLU H A 62 GLN H 1.0 . 5.50 609 561 A 28 GLN H A 28 GLN HGy 1.0 . 5.50 610 562 A 25 GLU HA A 28 GLN H 1.0 . 5.50 611 563 A 28 GLN H A 28 GLN HGx 1.0 . 5.50 612 564 A 112 PHE H A 111 SER H 1.0 . 4.45 613 565 A 110 VAL H A 111 SER H 1.0 . 2.87 614 566 A 111 SER H A 112 PHE HA 1.0 . 4.69 615 567 A 111 SER H A 109 LEU HA 1.0 . 3.80 616 568 A 111 SER H A 111 SER HBx 1.0 . 3.98 617 569 A 111 SER H A 112 PHE HBx 1.0 . 5.50 618 570 A 111 SER H A 110 VAL HB 1.0 . 4.53 619 571 A 111 SER H A 102 ALA HB% 1.0 . 4.15 620 572 A 109 LEU HBx A 111 SER H 1.0 . 3.92 621 573 A 39 PHE HE% A 111 SER H 1.0 . 5.50 622 574 A 80 ASN H A 80 ASN HD2x 1.0 . 5.50 623 575 A 40 THR H A 39 PHE HA 1.0 . 3.15 624 576 A 40 THR H A 110 VAL HA 1.0 . 4.60 625 577 A 40 THR H A 40 THR HB 1.0 . 3.60 626 578 A 40 THR H A 39 PHE HBy 1.0 . 3.92 627 579 A 40 THR H A 39 PHE HBx 1.0 . 3.60 628 580 A 40 THR H A 108 ASN HBx 1.0 . 4.29 629 581 A 40 THR H A 43 LEU HBy 1.0 . 4.43 630 582 A 40 THR H A 39 PHE H 1.0 . 4.56 631 583 A 80 ASN HA A 80 ASN HD2y 1.0 . 5.00 632 584 A 80 ASN HD2y A 80 ASN HBy 1.0 . 3.48 633 584 A 80 ASN HBx A 80 ASN HD2y 1.0 . 3.48 634 585 A 80 ASN HA A 80 ASN HD2x 1.0 . 5.44 635 586 A 69 GLY H A 90 VAL HGy% 1.0 . 5.50 636 587 A 69 GLY H A 90 VAL HA 1.0 . 3.86 637 588 A 69 GLY H A 68 PHE HBy 1.0 . 3.98 638 589 A 69 GLY H A 90 VAL HGx% 1.0 . 5.50 639 590 A 69 GLY H A 89 VAL HG2% 1.0 . 5.41 640 591 A 32 TYR HE% A 30 LYS H 1.0 . 5.50 641 592 A 30 LYS H A 56 LEU HD1% 1.0 . 5.50 642 593 A 30 LYS H A 30 LYS HE2 1.0 . 5.50 643 593 A 30 LYS H A 30 LYS HE3 1.0 . 5.50 644 594 A 56 LEU HDy% A 30 LYS H 1.0 . 5.30 645 595 A 44 GLN HE2y A 39 PHE HBy 1.0 . 5.50 646 596 A 44 GLN HA A 44 GLN HE2y 1.0 . 5.50 647 597 A 44 GLN HE2y A 44 GLN HBx 1.0 . 4.86 648 598 A 44 GLN HE2y A 44 GLN H 1.0 . 5.50 649 599 A 41 LYS H A 44 GLN HE2x 1.0 . 5.50 650 600 A 44 GLN HE2x A 41 LYS HD2 1.0 . 5.50 651 600 A 41 LYS HD3 A 44 GLN HE2x 1.0 . 5.50 652 601 A 44 GLN HBx A 44 GLN HE2x 1.0 . 5.50 653 602 A 41 LYS HGx A 44 GLN HE2x 1.0 . 5.50 654 603 A 44 GLN HE2x A 36 LYS HBx 1.0 . 5.50 655 604 A 11 PHE HDy A 10 GLY H 1.0 . 5.50 656 605 A 10 GLY H A 9 GLU HG2 1.0 . 4.10 657 605 A 10 GLY H A 9 GLU HG3 1.0 . 4.10 658 606 A 67 GLU H A 65 PHE HE% 1.0 . 4.99 659 607 A 67 GLU H A 92 TYR HA 1.0 . 4.85 660 608 A 67 GLU H A 65 PHE HA 1.0 . 4.40 661 609 A 67 GLU H A 90 VAL HGy% 1.0 . 4.90 662 610 A 107 MET H A 108 ASN HA 1.0 . 5.49 663 611 A 103 TYR HBy A 107 MET H 1.0 . 4.45 664 612 A 107 MET H A 104 ASP HBx 1.0 . 4.09 665 613 A 107 MET H A 107 MET HGy 1.0 . 5.42 666 614 A 107 MET H A 107 MET HGx 1.0 . 4.59 667 615 A 107 MET H A 107 MET HE% 1.0 . 5.49 668 616 A 67 GLU H A 68 PHE H 1.0 . 5.24 669 617 A 67 GLU H A 66 LYS H 1.0 . 3.16 670 618 A 67 GLU H A 65 PHE HBy 1.0 . 5.50 671 619 A 83 TYR H A 84 GLY H 1.0 . 5.40 672 620 A 76 GLN HE2y A 84 GLY H 1.0 . 3.87 673 621 A 83 TYR HD% A 84 GLY H 1.0 . 4.74 674 622 A 84 GLY H A 102 ALA HA 1.0 . 5.27 675 623 A 102 ALA HB% A 84 GLY H 1.0 . 5.03 676 624 A 103 TYR H A 84 GLY H 1.0 . 3.99 677 625 A 83 TYR HBy A 84 GLY H 1.0 . 3.86 678 626 A 97 VAL HA A 98 ASN HD2y 1.0 . 5.50 679 627 A 98 ASN H A 98 ASN HD2y 1.0 . 4.73 680 628 A 98 ASN HA A 98 ASN HD2y 1.0 . 5.50 681 629 A 98 ASN HBy A 98 ASN HD2y 1.0 . 3.77 682 630 A 98 ASN HD2y A 89 VAL HGx% 1.0 . 5.50 683 631 A 87 ILE HG2% A 98 ASN HD2y 1.0 . 5.41 684 632 A 98 ASN H A 98 ASN HD2x 1.0 . 5.26 685 633 A 97 VAL HA A 98 ASN HD2x 1.0 . 5.50 686 634 A 98 ASN HA A 98 ASN HD2x 1.0 . 5.50 687 635 A 73 TYR HD% A 85 GLY H 1.0 . 5.50 688 636 A 85 GLY H A 74 LEU HG 1.0 . 4.85 689 637 A 103 TYR H A 85 GLY H 1.0 . 5.50 690 638 A 74 LEU H A 85 GLY H 1.0 . 3.69 691 639 A 84 GLY H A 85 GLY H 1.0 . 4.51 692 640 A 7 LEU HG A 85 GLY H 1.0 . 5.50 693 641 A 85 GLY H A 74 LEU HBx 1.0 . 5.28 694 642 A 49 GLU H A 48 THR H 1.0 . 4.96 695 643 A 50 GLU H A 48 THR H 1.0 . 5.50 696 644 A 48 THR H A 51 SER HB2 1.0 . 4.48 697 644 A 51 SER HB3 A 48 THR H 1.0 . 4.48 698 645 A 48 THR H A 47 LEU HB2 1.0 . 3.71 699 645 A 47 LEU HB3 A 48 THR H 1.0 . 3.71 700 646 A 47 LEU HDy% A 48 THR H 1.0 . 5.50 701 647 A 79 ASP H A 80 ASN H 1.0 . 4.04 702 648 A 80 ASN H A 80 ASN HD2y 1.0 . 5.50 703 649 A 80 ASN H A 78 LYS HE2 1.0 . 3.62 704 649 A 78 LYS HE3 A 80 ASN H 1.0 . 3.62 705 650 A 80 ASN H A 78 LYS HBy 1.0 . 5.50 706 651 A 80 ASN H A 81 LYS HGy 1.0 . 5.50 707 652 A 80 ASN H A 77 ILE HG2% 1.0 . 4.23 708 653 A 45 SER H A 45 SER HBx 1.0 . 3.29 709 654 A 45 SER H A 44 GLN HGy 1.0 . 5.21 710 655 A 45 SER H A 44 GLN HBx 1.0 . 3.69 711 656 A 96 ASN H A 96 ASN HD2y 1.0 . 5.06 712 657 A 96 ASN HBy A 96 ASN HD2y 1.0 . 3.74 713 658 A 96 ASN HD2y A 91 LYS HGx 1.0 . 5.50 714 659 A 96 ASN H A 96 ASN HD2x 1.0 . 5.50 715 660 A 96 ASN HA A 96 ASN HD2x 1.0 . 5.50 716 661 A 91 LYS HGx A 96 ASN HD2x 1.0 . 5.50 717 662 A 89 VAL HG2% A 96 ASN HD2x 1.0 . 5.50 718 663 A 45 SER H A 44 GLN HGx 1.0 . 5.50 719 664 A 93 GLU H A 94 GLU H 1.0 . 3.96 720 665 A 64 GLU H A 94 GLU H 1.0 . 5.05 721 666 A 63 GLY HAy A 94 GLU H 1.0 . 4.54 722 667 A 94 GLU H A 92 TYR HB2 1.0 . 3.77 723 667 A 92 TYR HB3 A 94 GLU H 1.0 . 3.77 724 668 A 94 GLU H A 94 GLU HBx 1.0 . 3.56 725 669 A 92 TYR HD% A 94 GLU H 1.0 . 5.50 726 670 A 92 TYR HA A 94 GLU H 1.0 . 5.46 727 671 A 109 LEU H A 110 VAL H 1.0 . 4.88 728 672 A 36 LYS H A 37 SER H 1.0 . 3.84 729 673 A 37 SER HBy A 37 SER H 1.0 . 3.28 730 674 A 36 LYS HBy A 37 SER H 1.0 . 3.93 731 675 A 36 LYS HBx A 37 SER H 1.0 . 4.14 732 676 A 109 LEU HBx A 110 VAL H 1.0 . 4.24 733 677 A 83 TYR HD% A 76 GLN HE2y 1.0 . 4.44 734 678 A 76 GLN HE2y A 83 TYR HBy 1.0 . 5.50 735 679 A 76 GLN HE2y A 76 GLN HG2 1.0 . 3.60 736 679 A 76 GLN HE2y A 76 GLN HG3 1.0 . 3.60 737 680 A 76 GLN HBx A 76 GLN HE2y 1.0 . 4.86 738 681 A 76 GLN HE2x A 83 TYR HBy 1.0 . 5.50 739 682 A 83 TYR HD% A 76 GLN HE2x 1.0 . 5.50 740 683 A 76 GLN HE2x A 102 ALA HB% 1.0 . 5.50 741 684 A 62 GLN HA A 62 GLN HE2y 1.0 . 5.50 742 685 A 62 GLN HBy A 62 GLN HE2y 1.0 . 4.48 743 686 A 58 ILE HG2% A 62 GLN HE2y 1.0 . 4.53 744 687 A 62 GLN HE2x A 95 GLY HAy 1.0 . 5.50 745 688 A 58 ILE HA A 62 GLN HE2x 1.0 . 5.50 746 689 A 62 GLN HE2x A 59 LEU HA 1.0 . 5.50 747 690 A 62 GLN HE2x A 62 GLN HBy 1.0 . 4.22 748 691 A 58 ILE HA A 62 GLN HE2y 1.0 . 5.50 749 692 A 62 GLN HE2y A 95 GLY HAy 1.0 . 5.50 750 693 A 93 GLU H A 95 GLY H 1.0 . 5.06 751 694 A 95 GLY H A 94 GLU H 1.0 . 3.19 752 695 A 92 TYR HD% A 95 GLY H 1.0 . 4.29 753 696 A 96 ASN HA A 95 GLY H 1.0 . 5.50 754 697 A 95 GLY H A 92 TYR HA 1.0 . 5.50 755 698 A 95 GLY H A 91 LYS HA 1.0 . 5.50 756 699 A 95 GLY H A 92 TYR HB2 1.0 . 3.66 757 699 A 92 TYR HB3 A 95 GLY H 1.0 . 3.66 758 700 A 95 GLY H A 94 GLU HBy 1.0 . 4.63 759 701 A 95 GLY H A 94 GLU HBx 1.0 . 4.65 760 702 A 28 GLN H A 28 GLN HE2y 1.0 . 5.50 761 703 A 65 PHE HD% A 28 GLN HE2y 1.0 . 5.09 762 704 A 25 GLU HA A 28 GLN HE2y 1.0 . 4.06 763 705 A 65 PHE HBy A 28 GLN HE2y 1.0 . 5.50 764 706 A 28 GLN HE2y A 28 GLN HB2 1.0 . 3.38 765 706 A 28 GLN HB3 A 28 GLN HE2y 1.0 . 3.38 766 707 A 28 GLN HE2y A 24 ILE HG2% 1.0 . 5.50 767 708 A 4 LEU H A 75 GLY H 1.0 . 3.72 768 709 A 75 GLY H A 74 LEU H 1.0 . 5.27 769 710 A 75 GLY H A 8 PRO HDy 1.0 . 5.50 770 711 A 75 GLY H A 8 PRO HDx 1.0 . 5.50 771 712 A 75 GLY H A 74 LEU HBx 1.0 . 3.08 772 713 A 75 GLY H A 74 LEU HG 1.0 . 4.97 773 714 A 74 LEU HDx% A 75 GLY H 1.0 . 5.15 774 715 A 28 GLN HE2y A 59 LEU HDx% 1.0 . 5.50 775 716 A 65 PHE HD% A 28 GLN HE2x 1.0 . 5.50 776 717 A 63 GLY H A 62 GLN HGx 1.0 . 5.50 777 718 A 64 GLU H A 63 GLY H 1.0 . 4.60 778 719 A 63 GLY H A 92 TYR HB2 1.0 . 5.50 779 719 A 92 TYR HB3 A 63 GLY H 1.0 . 5.50 780 720 A 63 GLY H A 62 GLN HBy 1.0 . 5.38 781 721 A 62 GLN HBx A 63 GLY H 1.0 . 4.24 782 722 A 86 VAL H A 101 LEU HBy 1.0 . 5.22 783 723 A 75 GLY HAy A 7 LEU HA 1.0 . 3.79 784 724 A 75 GLY HAy A 8 PRO HDy 1.0 . 4.11 785 725 A 75 GLY HAx A 76 GLN HG2 1.0 . 5.09 786 725 A 75 GLY HAx A 76 GLN HG3 1.0 . 5.09 787 726 A 75 GLY HAx A 4 LEU HD2% 1.0 . 4.34 788 727 A 75 GLY HAx A 76 GLN H 1.0 . 3.38 789 728 A 75 GLY HAx A 8 PRO HDx 1.0 . 4.37 790 729 A 75 GLY HAx A 4 LEU HG 1.0 . 3.88 791 730 A 102 ALA H A 101 LEU HBy 1.0 . 4.19 792 731 A 101 LEU H A 101 LEU HBy 1.0 . 4.17 793 732 A 103 TYR HE% A 101 LEU HBy 1.0 . 4.73 794 733 A 101 LEU HBy A 20 ALA HB% 1.0 . 2.86 795 734 A 101 LEU HBy A 109 LEU HD1% 1.0 . 4.21 796 735 A 101 LEU HBx A 86 VAL H 1.0 . 4.92 797 736 A 102 ALA H A 101 LEU HBx 1.0 . 4.37 798 737 A 101 LEU HBx A 103 TYR HE% 1.0 . 4.90 799 738 A 101 LEU HBx A 109 LEU HD1% 1.0 . 4.36 800 739 A 96 ASN H A 95 GLY HAy 1.0 . 3.12 801 740 A 96 ASN H A 95 GLY HAx 1.0 . 3.10 802 741 A 96 ASN HA A 95 GLY HAx 1.0 . 5.07 803 742 A 102 ALA H A 85 GLY HAy 1.0 . 5.30 804 743 A 85 GLY HAy A 102 ALA HB% 1.0 . 4.14 805 744 A 103 TYR H A 85 GLY HAy 1.0 . 4.25 806 745 A 74 LEU HDx% A 85 GLY HAx 1.0 . 4.37 807 746 A 12 ASP H A 12 ASP HBy 1.0 . 3.52 808 747 A 14 GLU H A 12 ASP HBy 1.0 . 4.64 809 748 A 15 THR HG2% A 12 ASP HBy 1.0 . 4.71 810 749 A 12 ASP HBx A 12 ASP H 1.0 . 3.59 811 750 A 12 ASP HBx A 14 GLU H 1.0 . 4.65 812 751 A 12 ASP HBx A 15 THR H 1.0 . 4.32 813 752 A 12 ASP HBx A 15 THR HG2% 1.0 . 4.85 814 753 A 85 GLY HAy A 74 LEU HG 1.0 . 4.91 815 754 A 103 TYR H A 85 GLY HAx 1.0 . 5.01 816 755 A 85 GLY HAx A 74 LEU HG 1.0 . 4.33 817 756 A 15 THR H A 12 ASP HBy 1.0 . 4.27 818 757 A 15 THR HB A 12 ASP HBy 1.0 . 3.44 819 758 A 64 GLU H A 63 GLY HAx 1.0 . 2.99 820 759 A 103 TYR HBy A 84 GLY H 1.0 . 5.42 821 760 A 103 TYR HBy A 107 MET HE% 1.0 . 5.00 822 761 A 10 GLY HAx A 9 GLU HG2 1.0 . 5.50 823 761 A 9 GLU HG3 A 10 GLY HAx 1.0 . 5.50 824 762 A 10 GLY HAx A 9 GLU HB2 1.0 . 5.11 825 762 A 9 GLU HB3 A 10 GLY HAx 1.0 . 5.11 826 763 A 103 TYR HBx A 104 ASP H 1.0 . 4.70 827 764 A 75 GLY H A 74 LEU HBy 1.0 . 3.46 828 765 A 74 LEU HDx% A 74 LEU HBy 1.0 . 3.65 829 766 A 85 GLY HAx A 74 LEU HBy 1.0 . 4.77 830 767 A 85 GLY HAx A 74 LEU HBx 1.0 . 4.77 831 768 A 74 LEU HDx% A 74 LEU HBx 1.0 . 3.79 832 769 A 63 GLY HAy A 64 GLU HBx 1.0 . 4.70 833 770 A 92 TYR HD% A 63 GLY HAx 1.0 . 5.50 834 771 A 64 GLU H A 63 GLY HAy 1.0 . 3.16 835 772 A 62 GLN H A 63 GLY HAx 1.0 . 5.23 836 773 A 63 GLY HAx A 93 GLU HBx 1.0 . 4.60 837 774 A 64 GLU HBx A 63 GLY HAx 1.0 . 4.96 838 775 A 69 GLY HAx A 91 LYS HEx 1.0 . 5.12 839 776 A 91 LYS HEx A 69 GLY HAy 1.0 . 5.38 840 777 A 69 GLY HAy A 70 LYS HB2 1.0 . 4.80 841 777 A 70 LYS HB3 A 69 GLY HAy 1.0 . 4.80 842 778 A 70 LYS H A 69 GLY HAy 1.0 . 3.21 843 779 A 89 VAL HG2% A 69 GLY HAy 1.0 . 4.68 844 780 A 85 GLY H A 84 GLY HAy 1.0 . 3.23 845 781 A 69 GLY HAx A 89 VAL HGx% 1.0 . 5.24 846 782 A 69 GLY HAx A 70 LYS HA 1.0 . 5.50 847 783 A 75 GLY HAy A 84 GLY HAy 1.0 . 4.28 848 784 A 7 LEU HDx% A 84 GLY HAy 1.0 . 5.19 849 785 A 8 PRO HDx A 84 GLY HAy 1.0 . 4.28 850 786 A 103 TYR H A 84 GLY HAx 1.0 . 5.12 851 787 A 84 GLY HAx A 11 PHE HDx 1.0 . 4.42 852 788 A 7 LEU HDy% A 84 GLY HAx 1.0 . 3.84 853 789 A 7 LEU HDx% A 84 GLY HAx 1.0 . 4.72 854 790 A 85 GLY H A 84 GLY HAx 1.0 . 3.53 855 791 A 84 GLY HAx A 83 TYR HA 1.0 . 4.82 856 792 A 75 GLY HAy A 84 GLY HAx 1.0 . 5.20 857 793 A 75 GLY HAy A 4 LEU HB2 1.0 . 4.92 858 793 A 75 GLY HAy A 4 LEU HB3 1.0 . 4.92 859 794 A 4 LEU H A 4 LEU HB2 1.0 . 3.36 860 794 A 4 LEU H A 4 LEU HB3 1.0 . 3.36 861 795 A 75 GLY H A 4 LEU HB2 1.0 . 3.74 862 795 A 75 GLY H A 4 LEU HB3 1.0 . 3.74 863 796 A 75 GLY HAx A 4 LEU HB2 1.0 . 3.90 864 796 A 75 GLY HAx A 4 LEU HB3 1.0 . 3.90 865 797 A 4 LEU HD2% A 4 LEU HB2 1.0 . 3.21 866 797 A 4 LEU HD2% A 4 LEU HB3 1.0 . 3.21 867 798 A 6 GLU HGx A 4 LEU HB2 1.0 . 4.71 868 798 A 6 GLU HGx A 4 LEU HB3 1.0 . 4.71 869 799 A 88 ILE HD1% A 17 ARG HDy 1.0 . 5.50 870 800 A 18 LYS H A 17 ARG HDy 1.0 . 5.36 871 801 A 17 ARG HBy A 17 ARG HDy 1.0 . 3.85 872 802 A 88 ILE HD1% A 17 ARG HDx 1.0 . 5.50 873 803 A 17 ARG H A 17 ARG HDx 1.0 . 5.04 874 804 A 17 ARG HDx A 17 ARG HA 1.0 . 4.35 875 805 A 17 ARG HBy A 17 ARG HDx 1.0 . 3.84 876 806 A 40 THR H A 109 LEU HBy 1.0 . 4.97 877 807 A 109 LEU HBy A 39 PHE HD% 1.0 . 4.97 878 808 A 109 LEU HBy A 110 VAL H 1.0 . 5.12 879 809 A 109 LEU HBy A 111 SER H 1.0 . 5.10 880 810 A 109 LEU HBy A 39 PHE HA 1.0 . 3.64 881 811 A 40 THR H A 109 LEU HBx 1.0 . 5.39 882 812 A 39 PHE HE% A 109 LEU HBx 1.0 . 5.24 883 813 A 109 LEU HBx A 39 PHE HD% 1.0 . 4.98 884 814 A 109 LEU HBx A 39 PHE HA 1.0 . 3.96 885 815 A 109 LEU HBy A 39 PHE HBy 1.0 . 5.43 886 816 A 112 PHE HBy A 109 LEU HDy% 1.0 . 5.41 887 817 A 112 PHE H A 112 PHE HBx 1.0 . 4.12 888 818 A 112 PHE HBx A 109 LEU HD1% 1.0 . 4.56 889 819 A 109 LEU HBx A 112 PHE HBx 1.0 . 4.07 890 820 A 44 GLN H A 43 LEU HBy 1.0 . 4.29 891 821 A 89 VAL H A 88 ILE HB 1.0 . 4.33 892 822 A 48 THR HA A 47 LEU HB2 1.0 . 4.60 893 822 A 47 LEU HB3 A 48 THR HA 1.0 . 4.60 894 823 A 43 LEU HBx A 43 LEU H 1.0 . 3.70 895 824 A 7 LEU HDx% A 11 PHE HBy 1.0 . 4.47 896 825 A 11 PHE HBy A 7 LEU HBx 1.0 . 3.95 897 826 A 12 ASP H A 11 PHE HBx 1.0 . 4.07 898 827 A 12 ASP HA A 11 PHE HBx 1.0 . 5.50 899 828 A 7 LEU HG A 11 PHE HBx 1.0 . 5.50 900 829 A 44 GLN HA A 47 LEU HB2 1.0 . 4.90 901 829 A 44 GLN HA A 47 LEU HB3 1.0 . 4.90 902 830 A 47 LEU HD1% A 47 LEU HB2 1.0 . 4.08 903 830 A 47 LEU HB3 A 47 LEU HD1% 1.0 . 4.08 904 831 A 41 LYS HEy A 41 LYS HD2 1.0 . 2.96 905 831 A 41 LYS HD3 A 41 LYS HEy 1.0 . 2.96 906 832 A 41 LYS HGx A 41 LYS HEy 1.0 . 3.49 907 833 A 81 LYS H A 78 LYS HE2 1.0 . 4.53 908 833 A 78 LYS HE3 A 81 LYS H 1.0 . 4.53 909 834 A 70 LYS HE3 A 70 LYS HG2 1.0 . 3.04 910 834 A 70 LYS HE2 A 70 LYS HG2 1.0 . 3.04 911 834 A 70 LYS HG3 A 70 LYS HE2 1.0 . 3.04 912 834 A 70 LYS HG3 A 70 LYS HE3 1.0 . 3.04 913 835 A 77 ILE HG2% A 82 LYS HE2 1.0 . 4.09 914 835 A 82 LYS HE3 A 77 ILE HG2% 1.0 . 4.09 915 836 A 62 GLN HBy A 92 TYR HB2 1.0 . 3.68 916 836 A 92 TYR HB3 A 62 GLN HBy 1.0 . 3.68 917 837 A 57 LYS HDy A 57 LYS HEx 1.0 . 2.90 918 838 A 57 LYS H A 57 LYS HEx 1.0 . 5.46 919 839 A 13 LYS HBy A 13 LYS HEy 1.0 . 3.08 920 840 A 66 LYS HEx A 66 LYS HD2 1.0 . 3.01 921 840 A 66 LYS HD3 A 66 LYS HEx 1.0 . 3.01 922 841 A 36 LYS HGy A 36 LYS HE2 1.0 . 3.48 923 841 A 36 LYS HGy A 36 LYS HE3 1.0 . 3.48 924 842 A 73 TYR HD% A 13 LYS HEx 1.0 . 4.59 925 843 A 66 LYS HEy A 66 LYS HG2 1.0 . 3.86 926 843 A 66 LYS HG3 A 66 LYS HEy 1.0 . 3.86 927 844 A 13 LYS HGx A 13 LYS HEy 1.0 . 4.06 928 845 A 83 TYR HE% A 104 ASP HBx 1.0 . 4.03 929 846 A 66 LYS HEx A 66 LYS HG2 1.0 . 3.61 930 846 A 66 LYS HG3 A 66 LYS HEx 1.0 . 3.61 931 847 A 44 GLN HBx A 36 LYS HE2 1.0 . 3.88 932 847 A 44 GLN HBx A 36 LYS HE3 1.0 . 3.88 933 848 A 13 LYS HGx A 13 LYS HEx 1.0 . 4.01 934 849 A 73 TYR HBy A 7 LEU HBy 1.0 . 4.17 935 850 A 7 LEU HBx A 8 PRO HDy 1.0 . 5.21 936 851 A 7 LEU HBx A 8 PRO HDx 1.0 . 4.15 937 852 A 104 ASP HBy A 105 GLU H 1.0 . 3.78 938 853 A 45 SER HA A 36 LYS HE2 1.0 . 5.12 939 853 A 36 LYS HE3 A 45 SER HA 1.0 . 5.12 940 854 A 59 LEU HBy A 59 LEU HDx% 1.0 . 3.55 941 855 A 62 GLN HGy A 59 LEU HBx 1.0 . 5.27 942 856 A 59 LEU HBx A 59 LEU HDx% 1.0 . 3.65 943 857 A 58 ILE H A 59 LEU HBx 1.0 . 5.20 944 858 A 59 LEU HBx A 56 LEU HA 1.0 . 3.78 945 859 A 59 LEU HBx A 55 TYR HE% 1.0 . 5.12 946 860 A 104 ASP HBy A 110 VAL HGx% 1.0 . 5.43 947 861 A 104 ASP HBx A 105 GLU H 1.0 . 3.41 948 862 A 59 LEU HBy A 60 GLU HA 1.0 . 5.03 949 863 A 59 LEU HBx A 56 LEU HDy% 1.0 . 5.29 950 864 A 31 ASP HBy A 34 SER HB2 1.0 . 3.83 951 864 A 31 ASP HBy A 34 SER HB3 1.0 . 3.83 952 865 A 31 ASP HBy A 35 TRP HD1 1.0 . 5.43 953 866 A 31 ASP HBx A 34 SER HB2 1.0 . 4.35 954 866 A 34 SER HB3 A 31 ASP HBx 1.0 . 4.35 955 867 A 32 TYR H A 31 ASP HBx 1.0 . 5.29 956 868 A 88 ILE HD1% A 68 PHE HBy 1.0 . 4.74 957 869 A 68 PHE H A 68 PHE HBy 1.0 . 3.62 958 870 A 90 VAL HA A 68 PHE HBy 1.0 . 5.37 959 871 A 73 TYR HBy A 7 LEU H 1.0 . 3.70 960 872 A 31 ASP HBy A 35 TRP HBy 1.0 . 2.40 961 873 A 7 LEU HDx% A 73 TYR HBx 1.0 . 5.14 962 874 A 73 TYR HBy A 7 LEU HBx 1.0 . 5.50 963 875 A 73 TYR HBx A 7 LEU HG 1.0 . 4.35 964 876 A 55 TYR HD% A 56 LEU HBx 1.0 . 5.50 965 877 A 99 TYR HBy A 90 VAL HGx% 1.0 . 5.50 966 878 A 88 ILE H A 99 TYR HBy 1.0 . 4.79 967 879 A 83 TYR HBy A 83 TYR H 1.0 . 3.96 968 880 A 83 TYR HBy A 102 ALA HB% 1.0 . 4.69 969 881 A 76 GLN HBx A 83 TYR HBy 1.0 . 4.12 970 882 A 83 TYR HBx A 83 TYR H 1.0 . 3.60 971 883 A 83 TYR HBx A 84 GLY H 1.0 . 4.49 972 884 A 76 GLN HBx A 83 TYR HBx 1.0 . 3.88 973 885 A 99 TYR HBx A 99 TYR H 1.0 . 3.77 974 886 A 56 LEU HBy A 57 LYS H 1.0 . 4.11 975 887 A 56 LEU HBy A 56 LEU HD1% 1.0 . 3.77 976 888 A 56 LEU HBy A 53 ASP HA 1.0 . 3.64 977 889 A 56 LEU HBy A 56 LEU HDy% 1.0 . 4.18 978 890 A 56 LEU H A 56 LEU HBx 1.0 . 3.94 979 891 A 56 LEU HD1% A 56 LEU HBx 1.0 . 4.02 980 892 A 56 LEU HDy% A 56 LEU HBx 1.0 . 4.10 981 893 A 44 GLN H A 42 ASP HBy 1.0 . 5.50 982 894 A 43 LEU H A 42 ASP HBy 1.0 . 3.86 983 895 A 42 ASP H A 42 ASP HBy 1.0 . 3.34 984 896 A 96 ASN HBy A 89 VAL HG2% 1.0 . 3.94 985 897 A 97 VAL H A 96 ASN HBy 1.0 . 4.02 986 898 A 42 ASP HBx A 41 LYS HBy 1.0 . 5.17 987 899 A 43 LEU HG A 42 ASP HBx 1.0 . 5.50 988 900 A 42 ASP HBx A 40 THR HG2% 1.0 . 5.50 989 901 A 97 VAL H A 96 ASN HBx 1.0 . 3.87 990 902 A 96 ASN HBx A 89 VAL HG2% 1.0 . 3.92 991 903 A 38 ARG HBy A 38 ARG HDx 1.0 . 3.80 992 904 A 54 SER H A 53 ASP HBy 1.0 . 3.70 993 905 A 39 PHE H A 39 PHE HBx 1.0 . 3.80 994 906 A 43 LEU HBy A 39 PHE HBx 1.0 . 4.24 995 907 A 56 LEU HG A 53 ASP HBy 1.0 . 5.31 996 908 A 40 THR HG2% A 42 ASP HBy 1.0 . 5.14 997 909 A 53 ASP H A 53 ASP HBx 1.0 . 3.22 998 910 A 54 SER H A 53 ASP HBx 1.0 . 3.67 999 911 A 96 ASN HBx A 96 ASN HD2y 1.0 . 3.95 1000 912 A 38 ARG HDx A 38 ARG HA 1.0 . 3.86 1001 913 A 23 ASP HBx A 109 LEU HDy% 1.0 . 4.39 1002 914 A 108 ASN HBy A 40 THR HG2% 1.0 . 4.16 1003 915 A 108 ASN HBx A 109 LEU H 1.0 . 3.83 1004 916 A 108 ASN HBx A 108 ASN HD2y 1.0 . 3.92 1005 917 A 108 ASN HBx A 40 THR HA 1.0 . 3.93 1006 918 A 108 ASN HBx A 40 THR HB 1.0 . 4.64 1007 919 A 80 ASN H A 79 ASP HBy 1.0 . 3.54 1008 920 A 65 PHE HBx A 64 GLU HA 1.0 . 4.89 1009 921 A 65 PHE HBx A 28 GLN HE2x 1.0 . 4.98 1010 922 A 80 ASN H A 79 ASP HBx 1.0 . 3.58 1011 923 A 65 PHE HBy A 65 PHE H 1.0 . 3.25 1012 924 A 65 PHE HBy A 92 TYR HD% 1.0 . 4.57 1013 925 A 65 PHE HBy A 92 TYR HE% 1.0 . 3.65 1014 926 A 65 PHE HBy A 28 GLN HE2x 1.0 . 4.75 1015 927 A 65 PHE HBy A 90 VAL HGy% 1.0 . 5.50 1016 928 A 52 TYR H A 52 TYR HBx 1.0 . 3.96 1017 929 A 81 LYS H A 79 ASP HBy 1.0 . 5.50 1018 930 A 65 PHE HBx A 90 VAL HGy% 1.0 . 5.50 1019 931 A 77 ILE H A 77 ILE HB 1.0 . 3.22 1020 932 A 78 LYS H A 77 ILE HB 1.0 . 4.34 1021 933 A 72 THR HA A 87 ILE HB 1.0 . 5.31 1022 934 A 72 THR HB A 87 ILE HB 1.0 . 3.32 1023 935 A 88 ILE H A 87 ILE HB 1.0 . 4.93 1024 936 A 87 ILE H A 87 ILE HB 1.0 . 3.48 1025 937 A 32 TYR H A 32 TYR HBy 1.0 . 3.75 1026 938 A 33 GLU H A 32 TYR HBy 1.0 . 4.35 1027 939 A 52 TYR HE% A 32 TYR HBy 1.0 . 5.50 1028 940 A 32 TYR HA A 32 TYR HBy 1.0 . 2.70 1029 941 A 98 ASN H A 98 ASN HBy 1.0 . 3.29 1030 942 A 98 ASN HBy A 89 VAL HGx% 1.0 . 5.50 1031 943 A 98 ASN HBy A 97 VAL HA 1.0 . 4.68 1032 944 A 89 VAL HA A 98 ASN HBx 1.0 . 4.91 1033 945 A 97 VAL HGx% A 98 ASN HBy 1.0 . 5.50 1034 946 A 80 ASN HBx A 77 ILE HG2% 1.0 . 5.47 1035 947 A 3 ILE HB A 3 ILE H 1.0 . 3.01 1036 948 A 80 ASN H A 80 ASN HBy 1.0 . 3.73 1037 949 A 81 LYS H A 80 ASN HBy 1.0 . 4.25 1038 950 A 80 ASN HD2y A 80 ASN HBy 1.0 . 3.71 1039 951 A 80 ASN H A 80 ASN HBx 1.0 . 3.83 1040 952 A 80 ASN HBx A 80 ASN HD2y 1.0 . 3.93 1041 953 A 81 LYS H A 80 ASN HBx 1.0 . 4.51 1042 954 A 26 ILE HB A 26 ILE H 1.0 . 3.23 1043 955 A 59 LEU H A 58 ILE HB 1.0 . 3.37 1044 956 A 57 LYS H A 58 ILE HB 1.0 . 5.16 1045 957 A 58 ILE H A 58 ILE HB 1.0 . 3.02 1046 958 A 55 TYR HA A 58 ILE HB 1.0 . 3.80 1047 959 A 24 ILE H A 24 ILE HB 1.0 . 3.21 1048 960 A 25 GLU H A 24 ILE HB 1.0 . 3.83 1049 961 A 23 ASP H A 24 ILE HB 1.0 . 5.08 1050 962 A 21 MET HA A 24 ILE HB 1.0 . 3.91 1051 963 A 105 GLU HGy A 83 TYR H 1.0 . 5.50 1052 964 A 105 GLU HGy A 105 GLU H 1.0 . 3.72 1053 965 A 105 GLU HGy A 11 PHE HDx 1.0 . 4.31 1054 966 A 105 GLU H A 105 GLU HGx 1.0 . 3.93 1055 967 A 11 PHE HDx A 105 GLU HGx 1.0 . 4.35 1056 968 A 105 GLU HGx A 105 GLU HA 1.0 . 3.77 1057 969 A 56 LEU H A 55 TYR HBy 1.0 . 4.29 1058 970 A 55 TYR H A 55 TYR HBy 1.0 . 3.55 1059 971 A 24 ILE HG2% A 25 GLU HGy 1.0 . 5.45 1060 972 A 24 ILE H A 25 GLU HGy 1.0 . 4.89 1061 973 A 25 GLU H A 25 GLU HGy 1.0 . 3.57 1062 974 A 25 GLU HA A 25 GLU HGy 1.0 . 3.79 1063 975 A 66 LYS HG2 A 93 GLU HG2 1.0 . 4.65 1064 975 A 93 GLU HG3 A 66 LYS HG2 1.0 . 4.65 1065 975 A 66 LYS HG3 A 93 GLU HG3 1.0 . 4.65 1066 975 A 66 LYS HG3 A 93 GLU HG2 1.0 . 4.65 1067 976 A 50 GLU H A 50 GLU HG2 1.0 . 3.66 1068 976 A 50 GLU H A 50 GLU HG3 1.0 . 3.66 1069 977 A 50 GLU HA A 50 GLU HG2 1.0 . 3.16 1070 977 A 50 GLU HG3 A 50 GLU HA 1.0 . 3.16 1071 978 A 25 GLU HGx A 68 PHE HZ 1.0 . 4.44 1072 979 A 25 GLU HA A 25 GLU HGx 1.0 . 3.53 1073 980 A 26 ILE H A 25 GLU HGx 1.0 . 5.50 1074 981 A 25 GLU H A 25 GLU HGx 1.0 . 4.06 1075 982 A 25 GLU HGx A 25 GLU HBx 1.0 . 2.40 1076 983 A 64 GLU HGy A 64 GLU HA 1.0 . 3.88 1077 984 A 64 GLU HA A 64 GLU HGx 1.0 . 3.69 1078 985 A 66 LYS HD2 A 93 GLU HG2 1.0 . 4.76 1079 985 A 66 LYS HD3 A 93 GLU HG2 1.0 . 4.76 1080 985 A 93 GLU HG3 A 66 LYS HD2 1.0 . 4.76 1081 985 A 66 LYS HD3 A 93 GLU HG3 1.0 . 4.76 1082 986 A 93 GLU H A 93 GLU HG2 1.0 . 3.65 1083 986 A 93 GLU H A 93 GLU HG3 1.0 . 3.65 1084 987 A 22 GLU H A 22 GLU HGy 1.0 . 3.89 1085 988 A 93 GLU HA A 93 GLU HG2 1.0 . 3.52 1086 988 A 93 GLU HG3 A 93 GLU HA 1.0 . 3.52 1087 989 A 33 GLU H A 33 GLU HG2 1.0 . 3.39 1088 989 A 33 GLU H A 33 GLU HG3 1.0 . 3.39 1089 990 A 33 GLU HB2 A 33 GLU HG2 1.0 . 2.64 1090 990 A 33 GLU HB3 A 33 GLU HG2 1.0 . 2.64 1091 990 A 33 GLU HG3 A 33 GLU HB2 1.0 . 2.64 1092 990 A 33 GLU HB3 A 33 GLU HG3 1.0 . 2.64 1093 991 A 33 GLU HA A 33 GLU HG2 1.0 . 3.79 1094 991 A 33 GLU HG3 A 33 GLU HA 1.0 . 3.79 1095 992 A 19 GLN HE2x A 22 GLU HGx 1.0 . 5.46 1096 993 A 2 GLU HBy A 2 GLU HGy 1.0 . 2.48 1097 994 A 23 ASP H A 22 GLU HGx 1.0 . 4.97 1098 995 A 22 GLU H A 22 GLU HGx 1.0 . 3.98 1099 996 A 49 GLU H A 49 GLU HGy 1.0 . 4.54 1100 997 A 52 TYR HD% A 49 GLU HGy 1.0 . 5.02 1101 998 A 52 TYR HE% A 49 GLU HGy 1.0 . 5.06 1102 999 A 52 TYR HE% A 49 GLU HGx 1.0 . 5.18 1103 1000 A 60 GLU HGy A 61 LYS H 1.0 . 5.25 1104 1001 A 60 GLU HGy A 60 GLU HA 1.0 . 3.68 1105 1002 A 11 PHE H A 9 GLU HG2 1.0 . 5.50 1106 1002 A 11 PHE H A 9 GLU HG3 1.0 . 5.50 1107 1003 A 4 LEU HDx% A 2 GLU HGy 1.0 . 4.81 1108 1004 A 61 LYS H A 60 GLU HGx 1.0 . 4.75 1109 1005 A 60 GLU H A 60 GLU HGx 1.0 . 3.93 1110 1006 A 2 GLU HGx A 2 GLU HA 1.0 . 4.25 1111 1007 A 97 VAL H A 97 VAL HB 1.0 . 3.42 1112 1008 A 99 TYR HE% A 97 VAL HB 1.0 . 4.46 1113 1009 A 98 ASN H A 97 VAL HB 1.0 . 4.19 1114 1010 A 82 LYS HBy A 82 LYS HE2 1.0 . 4.29 1115 1010 A 82 LYS HE3 A 82 LYS HBy 1.0 . 4.29 1116 1011 A 83 TYR H A 82 LYS HBx 1.0 . 4.47 1117 1012 A 82 LYS H A 82 LYS HBx 1.0 . 3.90 1118 1013 A 82 LYS HBx A 82 LYS HE2 1.0 . 4.70 1119 1013 A 82 LYS HE3 A 82 LYS HBx 1.0 . 4.70 1120 1014 A 7 LEU H A 6 GLU HGy 1.0 . 4.40 1121 1015 A 6 GLU H A 6 GLU HGy 1.0 . 4.05 1122 1016 A 6 GLU HA A 6 GLU HGy 1.0 . 4.00 1123 1017 A 7 LEU H A 6 GLU HGx 1.0 . 4.40 1124 1018 A 6 GLU HA A 6 GLU HGx 1.0 . 4.06 1125 1019 A 67 GLU HGy A 67 GLU HB2 1.0 . 2.90 1126 1019 A 67 GLU HB3 A 67 GLU HGy 1.0 . 2.90 1127 1020 A 78 LYS HBy A 78 LYS HE2 1.0 . 4.94 1128 1020 A 78 LYS HE3 A 78 LYS HBy 1.0 . 4.94 1129 1021 A 82 LYS HBy A 83 TYR H 1.0 . 4.43 1130 1022 A 63 GLY HAy A 94 GLU HGy 1.0 . 5.28 1131 1023 A 5 LYS H A 6 GLU HGx 1.0 . 4.96 1132 1024 A 63 GLY H A 94 GLU HGx 1.0 . 5.50 1133 1025 A 94 GLU HGx A 94 GLU HA 1.0 . 4.01 1134 1026 A 93 GLU HA A 94 GLU HGx 1.0 . 5.02 1135 1027 A 94 GLU H A 94 GLU HGx 1.0 . 3.61 1136 1028 A 63 GLY HAy A 94 GLU HGx 1.0 . 4.80 1137 1029 A 68 PHE H A 67 GLU HGy 1.0 . 4.82 1138 1030 A 91 LYS H A 67 GLU HGy 1.0 . 5.50 1139 1031 A 78 LYS HBy A 83 TYR HE% 1.0 . 3.82 1140 1032 A 78 LYS HBy A 83 TYR HD% 1.0 . 4.79 1141 1033 A 83 TYR HD% A 82 LYS HBy 1.0 . 5.50 1142 1034 A 91 LYS H A 67 GLU HGx 1.0 . 4.92 1143 1035 A 67 GLU H A 67 GLU HGx 1.0 . 4.35 1144 1036 A 78 LYS HBx A 83 TYR HE% 1.0 . 4.09 1145 1037 A 78 LYS HBx A 81 LYS H 1.0 . 5.26 1146 1038 A 78 LYS HBx A 83 TYR HD% 1.0 . 5.02 1147 1039 A 28 GLN HGy A 59 LEU HDx% 1.0 . 4.39 1148 1040 A 28 GLN HGx A 59 LEU HDx% 1.0 . 4.15 1149 1041 A 78 LYS H A 81 LYS HBy 1.0 . 4.90 1150 1042 A 78 LYS H A 81 LYS HBx 1.0 . 5.29 1151 1043 A 44 GLN HE2y A 44 GLN HGy 1.0 . 3.86 1152 1044 A 44 GLN H A 44 GLN HGx 1.0 . 4.00 1153 1045 A 44 GLN HE2y A 44 GLN HGx 1.0 . 3.96 1154 1046 A 41 LYS HA A 44 GLN HGx 1.0 . 4.51 1155 1047 A 44 GLN HA A 44 GLN HGx 1.0 . 3.90 1156 1048 A 39 PHE HBy A 44 GLN HGx 1.0 . 4.44 1157 1049 A 43 LEU HBx A 44 GLN HGx 1.0 . 5.50 1158 1050 A 44 GLN HGx A 36 LYS HBx 1.0 . 4.25 1159 1051 A 81 LYS HBy A 83 TYR HD% 1.0 . 4.89 1160 1052 A 83 TYR HE% A 81 LYS HBy 1.0 . 3.90 1161 1053 A 81 LYS HBy A 81 LYS HGy 1.0 . 2.58 1162 1054 A 81 LYS HBx A 81 LYS HGy 1.0 . 2.43 1163 1055 A 19 GLN HGy A 19 GLN HE2y 1.0 . 4.02 1164 1056 A 107 MET HE% A 19 GLN HGx 1.0 . 4.49 1165 1057 A 103 TYR HE% A 19 GLN HGx 1.0 . 4.87 1166 1058 A 103 TYR HE% A 19 GLN HGy 1.0 . 4.59 1167 1059 A 19 GLN HGy A 107 MET HE% 1.0 . 5.42 1168 1060 A 90 VAL H A 90 VAL HB 1.0 . 3.43 1169 1061 A 99 TYR HE% A 90 VAL HB 1.0 . 3.50 1170 1062 A 90 VAL HB A 92 TYR HE% 1.0 . 3.47 1171 1063 A 90 VAL HB A 97 VAL HG2% 1.0 . 4.67 1172 1064 A 89 VAL HA A 90 VAL HB 1.0 . 4.65 1173 1065 A 91 LYS H A 90 VAL HB 1.0 . 4.97 1174 1066 A 75 GLY HAy A 76 GLN HG2 1.0 . 5.50 1175 1066 A 75 GLY HAy A 76 GLN HG3 1.0 . 5.50 1176 1067 A 76 GLN H A 76 GLN HG2 1.0 . 3.52 1177 1067 A 76 GLN H A 76 GLN HG3 1.0 . 3.52 1178 1068 A 76 GLN HA A 76 GLN HG2 1.0 . 3.63 1179 1068 A 76 GLN HA A 76 GLN HG3 1.0 . 3.63 1180 1069 A 83 TYR HBy A 76 GLN HG2 1.0 . 5.31 1181 1069 A 83 TYR HBy A 76 GLN HG3 1.0 . 5.31 1182 1070 A 83 TYR HD% A 76 GLN HG2 1.0 . 5.10 1183 1070 A 83 TYR HD% A 76 GLN HG3 1.0 . 5.10 1184 1071 A 76 GLN HBx A 76 GLN HG2 1.0 . 2.62 1185 1071 A 76 GLN HBx A 76 GLN HG3 1.0 . 2.62 1186 1072 A 70 LYS H A 70 LYS HB2 1.0 . 2.76 1187 1072 A 70 LYS HB3 A 70 LYS H 1.0 . 2.76 1188 1073 A 69 GLY HAx A 70 LYS HB2 1.0 . 4.47 1189 1073 A 69 GLY HAx A 70 LYS HB3 1.0 . 4.47 1190 1074 A 70 LYS HB3 A 70 LYS HE2 1.0 . 4.74 1191 1074 A 70 LYS HE3 A 70 LYS HB2 1.0 . 4.74 1192 1074 A 70 LYS HB3 A 70 LYS HE3 1.0 . 4.74 1193 1074 A 70 LYS HB2 A 70 LYS HE2 1.0 . 4.74 1194 1075 A 97 VAL HG2% A 114 MET HBy 1.0 . 5.33 1195 1076 A 91 LYS H A 91 LYS HB2 1.0 . 3.21 1196 1076 A 91 LYS H A 91 LYS HB3 1.0 . 3.21 1197 1077 A 67 GLU H A 91 LYS HB2 1.0 . 3.90 1198 1077 A 67 GLU H A 91 LYS HB3 1.0 . 3.90 1199 1078 A 96 ASN HA A 91 LYS HB2 1.0 . 5.04 1200 1078 A 96 ASN HA A 91 LYS HB3 1.0 . 5.04 1201 1079 A 76 GLN HBy A 76 GLN HG2 1.0 . 2.83 1202 1079 A 76 GLN HG3 A 76 GLN HBy 1.0 . 2.83 1203 1080 A 100 SER H A 114 MET HBy 1.0 . 4.79 1204 1081 A 114 MET HBy A 99 TYR HA 1.0 . 4.26 1205 1082 A 97 VAL HGx% A 114 MET HBy 1.0 . 3.96 1206 1083 A 99 TYR HE% A 114 MET HBy 1.0 . 5.38 1207 1084 A 114 MET H A 114 MET HBx 1.0 . 4.12 1208 1085 A 99 TYR HE% A 114 MET HBx 1.0 . 5.24 1209 1086 A 99 TYR HA A 114 MET HBx 1.0 . 4.18 1210 1087 A 3 ILE HA A 76 GLN HBy 1.0 . 4.86 1211 1088 A 3 ILE HA A 76 GLN HBx 1.0 . 5.13 1212 1089 A 76 GLN HBx A 83 TYR HD% 1.0 . 4.46 1213 1090 A 76 GLN HBx A 3 ILE HD1% 1.0 . 5.50 1214 1091 A 97 VAL HG2% A 114 MET HBx 1.0 . 5.13 1215 1092 A 21 MET H A 21 MET HBx 1.0 . 3.73 1216 1093 A 21 MET HBx A 68 PHE HE% 1.0 . 5.25 1217 1094 A 89 VAL HB A 69 GLY H 1.0 . 4.24 1218 1095 A 89 VAL HB A 70 LYS H 1.0 . 3.45 1219 1096 A 89 VAL HB A 89 VAL H 1.0 . 3.18 1220 1097 A 89 VAL HB A 69 GLY HAx 1.0 . 3.63 1221 1098 A 66 LYS H A 66 LYS HBx 1.0 . 3.82 1222 1099 A 92 TYR HA A 66 LYS HBx 1.0 . 5.10 1223 1100 A 65 PHE HA A 66 LYS HBx 1.0 . 5.40 1224 1101 A 89 VAL HB A 98 ASN HA 1.0 . 4.86 1225 1102 A 83 TYR HE% A 110 VAL HB 1.0 . 5.23 1226 1103 A 13 LYS HBy A 7 LEU HDx% 1.0 . 5.50 1227 1104 A 13 LYS HEy A 13 LYS HBx 1.0 . 5.02 1228 1105 A 13 LYS H A 13 LYS HBx 1.0 . 3.71 1229 1106 A 14 GLU H A 13 LYS HBx 1.0 . 4.00 1230 1107 A 73 TYR HE% A 13 LYS HBx 1.0 . 5.25 1231 1108 A 13 LYS HEx A 13 LYS HBx 1.0 . 5.50 1232 1109 A 88 ILE HD1% A 21 MET HBx 1.0 . 5.41 1233 1110 A 18 LYS H A 18 LYS HBx 1.0 . 3.57 1234 1111 A 62 GLN HGy A 62 GLN HE2x 1.0 . 3.99 1235 1112 A 62 GLN HGy A 58 ILE HG2% 1.0 . 4.08 1236 1113 A 57 LYS H A 57 LYS HBy 1.0 . 3.40 1237 1114 A 58 ILE H A 57 LYS HBy 1.0 . 3.94 1238 1115 A 61 LYS H A 61 LYS HBy 1.0 . 3.31 1239 1116 A 57 LYS HEx A 57 LYS HBy 1.0 . 4.50 1240 1117 A 61 LYS H A 61 LYS HBx 1.0 . 3.81 1241 1118 A 57 LYS H A 57 LYS HBx 1.0 . 3.45 1242 1119 A 58 ILE H A 57 LYS HBx 1.0 . 3.99 1243 1120 A 57 LYS HEx A 57 LYS HBx 1.0 . 4.42 1244 1121 A 62 GLN HGx A 59 LEU HA 1.0 . 3.99 1245 1122 A 58 ILE HG2% A 62 GLN HGx 1.0 . 3.70 1246 1123 A 7 LEU H A 6 GLU HBx 1.0 . 3.65 1247 1123 A 7 LEU H A 6 GLU HBy 1.0 . 3.65 1248 1124 A 6 GLU H A 6 GLU HBx 1.0 . 3.88 1249 1124 A 6 GLU H A 6 GLU HBy 1.0 . 3.88 1250 1125 A 67 GLU HGx A 67 GLU HB2 1.0 . 2.40 1251 1125 A 67 GLU HB3 A 67 GLU HGx 1.0 . 2.40 1252 1126 A 62 GLN HE2x A 61 LYS HBx 1.0 . 5.07 1253 1127 A 9 GLU H A 8 PRO HBy 1.0 . 3.69 1254 1128 A 4 LEU HD2% A 8 PRO HBy 1.0 . 4.06 1255 1129 A 5 LYS H A 5 LYS HBy 1.0 . 3.90 1256 1130 A 8 PRO HBx A 4 LEU HD2% 1.0 . 4.75 1257 1131 A 42 ASP H A 41 LYS HBy 1.0 . 3.79 1258 1132 A 5 LYS HBx A 5 LYS HE2 1.0 . 5.21 1259 1132 A 5 LYS HBx A 5 LYS HE3 1.0 . 5.21 1260 1133 A 5 LYS H A 5 LYS HBx 1.0 . 3.31 1261 1134 A 6 GLU H A 5 LYS HBx 1.0 . 4.55 1262 1135 A 36 LYS HBy A 33 GLU HG2 1.0 . 5.50 1263 1135 A 36 LYS HBy A 33 GLU HG3 1.0 . 5.50 1264 1136 A 36 LYS H A 36 LYS HBy 1.0 . 3.55 1265 1137 A 36 LYS HBy A 36 LYS HE2 1.0 . 4.63 1266 1137 A 36 LYS HBy A 36 LYS HE3 1.0 . 4.63 1267 1138 A 36 LYS H A 36 LYS HBx 1.0 . 3.63 1268 1139 A 36 LYS HBx A 33 GLU HA 1.0 . 4.13 1269 1140 A 36 LYS HBx A 36 LYS HE2 1.0 . 4.52 1270 1140 A 36 LYS HBx A 36 LYS HE3 1.0 . 4.52 1271 1141 A 114 MET H A 114 MET HGy 1.0 . 4.04 1272 1142 A 114 MET HGy A 114 MET HA 1.0 . 4.12 1273 1143 A 97 VAL HGx% A 114 MET HGy 1.0 . 4.24 1274 1144 A 99 TYR HE% A 114 MET HGy 1.0 . 4.85 1275 1145 A 99 TYR HE% A 114 MET HGx 1.0 . 5.13 1276 1146 A 114 MET HGx A 97 VAL HGx% 1.0 . 4.20 1277 1147 A 66 LYS HBx A 67 GLU HB2 1.0 . 4.71 1278 1147 A 67 GLU HB3 A 66 LYS HBx 1.0 . 4.71 1279 1148 A 4 LEU HDx% A 2 GLU HBx 1.0 . 4.55 1280 1149 A 16 VAL HB A 17 ARG H 1.0 . 3.04 1281 1150 A 16 VAL HB A 13 LYS HA 1.0 . 3.43 1282 1151 A 7 LEU HDx% A 16 VAL HB 1.0 . 4.44 1283 1152 A 3 ILE H A 2 GLU HBx 1.0 . 4.63 1284 1153 A 2 GLU HGx A 2 GLU HBx 1.0 . 2.80 1285 1154 A 93 GLU HBy A 63 GLY HAy 1.0 . 3.95 1286 1155 A 93 GLU HBy A 94 GLU H 1.0 . 3.96 1287 1156 A 93 GLU H A 93 GLU HBx 1.0 . 3.33 1288 1157 A 64 GLU H A 93 GLU HBx 1.0 . 3.71 1289 1158 A 63 GLY HAy A 93 GLU HBx 1.0 . 3.82 1290 1159 A 72 THR H A 71 CYS HBy 1.0 . 4.11 1291 1160 A 71 CYS HBy A 71 CYS H 1.0 . 3.42 1292 1161 A 71 CYS HBy A 88 ILE HA 1.0 . 4.55 1293 1162 A 88 ILE HB A 71 CYS HBy 1.0 . 4.52 1294 1163 A 72 THR H A 71 CYS HBx 1.0 . 3.87 1295 1164 A 65 PHE H A 64 GLU HBy 1.0 . 3.79 1296 1165 A 64 GLU H A 64 GLU HBy 1.0 . 3.65 1297 1166 A 65 PHE H A 64 GLU HBx 1.0 . 3.77 1298 1167 A 68 PHE HD% A 21 MET HGx 1.0 . 5.33 1299 1168 A 21 MET HGx A 68 PHE HE% 1.0 . 5.50 1300 1169 A 21 MET HA A 21 MET HGx 1.0 . 3.72 1301 1170 A 71 CYS HBy A 70 LYS HA 1.0 . 4.71 1302 1171 A 71 CYS HBy A 86 VAL HGy% 1.0 . 3.97 1303 1172 A 71 CYS H A 71 CYS HBx 1.0 . 3.79 1304 1173 A 88 ILE HA A 71 CYS HBx 1.0 . 4.47 1305 1174 A 88 ILE HB A 71 CYS HBx 1.0 . 4.40 1306 1175 A 24 ILE HG1y A 112 PHE HE% 1.0 . 5.34 1307 1176 A 24 ILE HG1y A 24 ILE HA 1.0 . 3.94 1308 1177 A 99 TYR HE% A 24 ILE HG1x 1.0 . 5.38 1309 1178 A 24 ILE HG1x A 101 LEU HDx% 1.0 . 5.50 1310 1179 A 102 ALA H A 101 LEU HG 1.0 . 4.71 1311 1180 A 101 LEU HG A 101 LEU HA 1.0 . 3.48 1312 1181 A 73 TYR HE% A 17 ARG HBy 1.0 . 4.73 1313 1182 A 17 ARG HBx A 18 LYS H 1.0 . 3.75 1314 1183 A 73 TYR HE% A 17 ARG HBx 1.0 . 5.02 1315 1184 A 106 ASP H A 105 GLU HBx 1.0 . 5.01 1316 1185 A 33 GLU HA A 36 LYS HDy 1.0 . 5.11 1317 1186 A 73 TYR HE% A 13 LYS HD2 1.0 . 4.26 1318 1186 A 73 TYR HE% A 13 LYS HD3 1.0 . 4.26 1319 1187 A 61 LYS H A 60 GLU HBy 1.0 . 3.86 1320 1188 A 61 LYS H A 60 GLU HBx 1.0 . 3.84 1321 1189 A 50 GLU H A 50 GLU HBx 1.0 . 3.06 1322 1190 A 10 GLY H A 9 GLU HB2 1.0 . 3.81 1323 1190 A 10 GLY H A 9 GLU HB3 1.0 . 3.81 1324 1191 A 9 GLU H A 9 GLU HB2 1.0 . 3.07 1325 1191 A 9 GLU H A 9 GLU HB3 1.0 . 3.07 1326 1192 A 77 ILE HG2% A 82 LYS HDy 1.0 . 4.85 1327 1193 A 33 GLU HA A 36 LYS HDx 1.0 . 4.45 1328 1194 A 36 LYS HA A 36 LYS HDx 1.0 . 5.21 1329 1195 A 25 GLU HA A 26 ILE HG12 1.0 . 5.32 1330 1195 A 25 GLU HA A 26 ILE HG13 1.0 . 5.32 1331 1196 A 26 ILE HD1% A 22 GLU HB2 1.0 . 5.10 1332 1196 A 26 ILE HD1% A 22 GLU HB3 1.0 . 5.10 1333 1197 A 60 GLU H A 60 GLU HBy 1.0 . 3.68 1334 1198 A 60 GLU H A 60 GLU HBx 1.0 . 3.13 1335 1199 A 60 GLU HGx A 60 GLU HBx 1.0 . 2.79 1336 1200 A 48 THR HB A 50 GLU HBx 1.0 . 5.09 1337 1201 A 57 LYS HEx A 60 GLU HBx 1.0 . 4.98 1338 1202 A 19 GLN HBy A 16 VAL HA 1.0 . 4.39 1339 1203 A 71 CYS H A 70 LYS HD2 1.0 . 4.37 1340 1203 A 71 CYS H A 70 LYS HD3 1.0 . 4.37 1341 1204 A 70 LYS HA A 70 LYS HD2 1.0 . 4.66 1342 1204 A 70 LYS HA A 70 LYS HD3 1.0 . 4.66 1343 1205 A 18 LYS HA A 18 LYS HD2 1.0 . 4.02 1344 1205 A 18 LYS HA A 18 LYS HD3 1.0 . 4.02 1345 1206 A 20 ALA HA A 19 GLN HBx 1.0 . 4.93 1346 1207 A 36 LYS HDx A 44 GLN HBy 1.0 . 4.14 1347 1208 A 26 ILE H A 26 ILE HG12 1.0 . 4.02 1348 1208 A 26 ILE H A 26 ILE HG13 1.0 . 4.02 1349 1209 A 23 ASP HA A 26 ILE HG12 1.0 . 4.92 1350 1209 A 26 ILE HG13 A 23 ASP HA 1.0 . 4.92 1351 1210 A 26 ILE HA A 26 ILE HG12 1.0 . 3.72 1352 1210 A 26 ILE HA A 26 ILE HG13 1.0 . 3.72 1353 1211 A 23 ASP H A 22 GLU HB2 1.0 . 3.39 1354 1211 A 23 ASP H A 22 GLU HB3 1.0 . 3.39 1355 1212 A 22 GLU H A 22 GLU HB2 1.0 . 2.91 1356 1212 A 22 GLU H A 22 GLU HB3 1.0 . 2.91 1357 1213 A 19 GLN HE2x A 22 GLU HB2 1.0 . 4.07 1358 1213 A 22 GLU HB3 A 19 GLN HE2x 1.0 . 4.07 1359 1214 A 48 THR HB A 50 GLU HBy 1.0 . 5.05 1360 1215 A 23 ASP HBy A 22 GLU HB2 1.0 . 4.80 1361 1215 A 23 ASP HBy A 22 GLU HB3 1.0 . 4.80 1362 1216 A 50 GLU H A 50 GLU HBy 1.0 . 3.29 1363 1217 A 56 LEU HDy% A 30 LYS HBx 1.0 . 4.98 1364 1218 A 19 GLN HBy A 19 GLN H 1.0 . 3.53 1365 1219 A 19 GLN HBy A 19 GLN HE2y 1.0 . 4.97 1366 1220 A 20 ALA H A 19 GLN HBx 1.0 . 4.42 1367 1221 A 31 ASP H A 30 LYS HBy 1.0 . 5.34 1368 1222 A 30 LYS HBy A 30 LYS HE2 1.0 . 4.98 1369 1222 A 30 LYS HE3 A 30 LYS HBy 1.0 . 4.98 1370 1223 A 56 LEU HD1% A 30 LYS HBy 1.0 . 5.29 1371 1224 A 30 LYS H A 28 GLN HB2 1.0 . 5.10 1372 1224 A 30 LYS H A 28 GLN HB3 1.0 . 5.10 1373 1225 A 28 GLN HE2x A 28 GLN HB2 1.0 . 3.99 1374 1225 A 28 GLN HB3 A 28 GLN HE2x 1.0 . 3.99 1375 1226 A 59 LEU HDx% A 28 GLN HB2 1.0 . 4.48 1376 1226 A 28 GLN HB3 A 59 LEU HDx% 1.0 . 4.48 1377 1227 A 24 ILE HG2% A 28 GLN HB2 1.0 . 5.50 1378 1227 A 28 GLN HB3 A 24 ILE HG2% 1.0 . 5.50 1379 1228 A 30 LYS HBx A 30 LYS HE2 1.0 . 4.73 1380 1228 A 30 LYS HBx A 30 LYS HE3 1.0 . 4.73 1381 1229 A 30 LYS HBx A 56 LEU HD1% 1.0 . 4.50 1382 1230 A 82 LYS H A 81 LYS HDx 1.0 . 4.92 1383 1231 A 19 GLN HBx A 19 GLN HE2y 1.0 . 5.29 1384 1232 A 32 TYR HD% A 33 GLU HB2 1.0 . 5.50 1385 1232 A 33 GLU HB3 A 32 TYR HD% 1.0 . 5.50 1386 1233 A 82 LYS H A 81 LYS HDy 1.0 . 4.79 1387 1234 A 83 TYR HE% A 81 LYS HDy 1.0 . 5.50 1388 1235 A 81 LYS HDy A 81 LYS HA 1.0 . 4.07 1389 1236 A 81 LYS HDx A 81 LYS HA 1.0 . 4.16 1390 1237 A 41 LYS HA A 41 LYS HD2 1.0 . 3.93 1391 1237 A 41 LYS HD3 A 41 LYS HA 1.0 . 3.93 1392 1238 A 49 GLU H A 49 GLU HBx 1.0 . 3.31 1393 1239 A 52 TYR HD% A 49 GLU HBx 1.0 . 4.88 1394 1240 A 49 GLU HBx A 50 GLU HA 1.0 . 5.50 1395 1241 A 34 SER H A 33 GLU HB2 1.0 . 3.58 1396 1241 A 34 SER H A 33 GLU HB3 1.0 . 3.58 1397 1242 A 58 ILE HA A 61 LYS HD2 1.0 . 3.73 1398 1242 A 58 ILE HA A 61 LYS HD3 1.0 . 3.73 1399 1243 A 52 TYR HE% A 49 GLU HBx 1.0 . 4.77 1400 1244 A 58 ILE H A 58 ILE HG1x 1.0 . 3.82 1401 1245 A 58 ILE HA A 58 ILE HG1x 1.0 . 3.51 1402 1246 A 26 ILE H A 25 GLU HBy 1.0 . 3.88 1403 1247 A 25 GLU H A 25 GLU HBy 1.0 . 3.44 1404 1248 A 25 GLU H A 25 GLU HBx 1.0 . 3.67 1405 1249 A 55 TYR HA A 58 ILE HG1x 1.0 . 4.98 1406 1250 A 17 ARG HGy A 17 ARG HA 1.0 . 3.91 1407 1251 A 32 TYR HA A 35 TRP HBy 1.0 . 4.62 1408 1252 A 32 TYR HA A 35 TRP HBx 1.0 . 4.71 1409 1253 A 36 LYS H A 35 TRP HBx 1.0 . 4.32 1410 1254 A 26 ILE HG2% A 35 TRP HBx 1.0 . 4.36 1411 1255 A 41 LYS HA A 44 GLN HBy 1.0 . 5.23 1412 1256 A 38 ARG HBx A 109 LEU HDy% 1.0 . 4.78 1413 1257 A 67 GLU H A 66 LYS HD2 1.0 . 4.79 1414 1257 A 67 GLU H A 66 LYS HD3 1.0 . 4.79 1415 1258 A 49 GLU H A 48 THR HB 1.0 . 3.73 1416 1259 A 44 GLN H A 44 GLN HBy 1.0 . 3.76 1417 1260 A 44 GLN HE2y A 44 GLN HBy 1.0 . 5.30 1418 1261 A 44 GLN HBx A 45 SER HA 1.0 . 5.50 1419 1262 A 44 GLN HBx A 41 LYS HA 1.0 . 4.85 1420 1263 A 44 GLN HBx A 43 LEU H 1.0 . 5.22 1421 1264 A 92 TYR HA A 66 LYS HD2 1.0 . 5.18 1422 1264 A 92 TYR HA A 66 LYS HD3 1.0 . 5.18 1423 1265 A 66 LYS HA A 66 LYS HD2 1.0 . 3.59 1424 1265 A 66 LYS HD3 A 66 LYS HA 1.0 . 3.59 1425 1266 A 62 GLN HBx A 62 GLN HGx 1.0 . 2.85 1426 1267 A 4 LEU HD2% A 8 PRO HGy 1.0 . 3.96 1427 1268 A 75 GLY HAy A 8 PRO HGy 1.0 . 4.64 1428 1269 A 75 GLY HAx A 8 PRO HGx 1.0 . 5.08 1429 1270 A 75 GLY HAy A 8 PRO HGx 1.0 . 4.81 1430 1271 A 4 LEU HD2% A 8 PRO HGx 1.0 . 4.01 1431 1272 A 39 PHE HD% A 43 LEU HG 1.0 . 5.06 1432 1273 A 92 TYR HD% A 62 GLN HBx 1.0 . 4.60 1433 1274 A 62 GLN HBx A 59 LEU HA 1.0 . 4.78 1434 1275 A 9 GLU H A 8 PRO HGy 1.0 . 5.19 1435 1276 A 43 LEU HG A 43 LEU H 1.0 . 3.80 1436 1277 A 101 LEU H A 101 LEU HDx% 1.0 . 5.19 1437 1278 A 102 ALA H A 101 LEU HDx% 1.0 . 4.71 1438 1279 A 101 LEU HDx% A 101 LEU HA 1.0 . 3.54 1439 1280 A 20 ALA HA A 101 LEU HDx% 1.0 . 3.35 1440 1281 A 101 LEU HDx% A 24 ILE HA 1.0 . 5.44 1441 1282 A 23 ASP HBy A 101 LEU HDx% 1.0 . 3.70 1442 1283 A 23 ASP HBx A 101 LEU HDx% 1.0 . 4.19 1443 1284 A 101 LEU HDx% A 109 LEU HDy% 1.0 . 4.72 1444 1285 A 43 LEU HG A 43 LEU HA 1.0 . 3.86 1445 1286 A 43 LEU HG A 40 THR HG2% 1.0 . 4.43 1446 1287 A 76 GLN HA A 4 LEU HG 1.0 . 4.23 1447 1288 A 4 LEU HG A 4 LEU HA 1.0 . 4.01 1448 1289 A 4 LEU HG A 3 ILE HA 1.0 . 4.42 1449 1290 A 4 LEU HG A 75 GLY H 1.0 . 5.36 1450 1291 A 3 ILE H A 3 ILE HG1y 1.0 . 3.80 1451 1292 A 3 ILE HA A 3 ILE HG1y 1.0 . 4.11 1452 1293 A 101 LEU HDx% A 103 TYR HE% 1.0 . 4.54 1453 1294 A 4 LEU HG A 6 GLU H 1.0 . 5.19 1454 1295 A 71 CYS HA A 72 THR HB 1.0 . 5.33 1455 1296 A 72 THR HB A 73 TYR H 1.0 . 3.87 1456 1297 A 72 THR HB A 74 LEU HDx% 1.0 . 4.54 1457 1298 A 87 ILE H A 87 ILE HG1x 1.0 . 4.71 1458 1299 A 7 LEU HG A 6 GLU HA 1.0 . 4.26 1459 1300 A 73 TYR HBy A 7 LEU HG 1.0 . 3.57 1460 1301 A 7 LEU HG A 13 LYS HEy 1.0 . 4.69 1461 1302 A 88 ILE H A 87 ILE HG1y 1.0 . 5.07 1462 1303 A 87 ILE H A 87 ILE HG1y 1.0 . 3.98 1463 1304 A 87 ILE HG1y A 87 ILE HA 1.0 . 3.69 1464 1305 A 72 THR HB A 87 ILE HG1y 1.0 . 4.94 1465 1306 A 74 LEU HDx% A 87 ILE HG1y 1.0 . 3.55 1466 1307 A 74 LEU H A 74 LEU HG 1.0 . 3.69 1467 1308 A 73 TYR HE% A 7 LEU HG 1.0 . 5.50 1468 1309 A 109 LEU HG A 39 PHE HA 1.0 . 5.50 1469 1310 A 60 GLU H A 59 LEU HG 1.0 . 5.50 1470 1311 A 47 LEU H A 47 LEU HG 1.0 . 3.57 1471 1312 A 47 LEU HG A 47 LEU HA 1.0 . 4.19 1472 1313 A 48 THR H A 47 LEU HG 1.0 . 5.07 1473 1314 A 46 SER H A 47 LEU HG 1.0 . 5.21 1474 1315 A 56 LEU H A 56 LEU HD1% 1.0 . 3.97 1475 1316 A 55 TYR HD% A 56 LEU HD1% 1.0 . 4.89 1476 1317 A 53 ASP HA A 56 LEU HD1% 1.0 . 3.53 1477 1318 A 40 THR H A 43 LEU HDy% 1.0 . 4.30 1478 1319 A 43 LEU H A 43 LEU HDy% 1.0 . 4.36 1479 1320 A 43 LEU HA A 43 LEU HDy% 1.0 . 3.78 1480 1321 A 39 PHE HBx A 43 LEU HDy% 1.0 . 4.90 1481 1322 A 43 LEU HBy A 43 LEU HDy% 1.0 . 3.14 1482 1323 A 47 LEU HDy% A 43 LEU HDy% 1.0 . 5.50 1483 1324 A 7 LEU HDx% A 13 LYS HA 1.0 . 3.28 1484 1325 A 7 LEU HDx% A 73 TYR HBy 1.0 . 3.52 1485 1326 A 7 LEU HDx% A 7 LEU HBy 1.0 . 3.49 1486 1327 A 7 LEU HDx% A 7 LEU HBx 1.0 . 3.53 1487 1328 A 73 TYR HE% A 7 LEU HDx% 1.0 . 4.69 1488 1329 A 7 LEU HDx% A 7 LEU HA 1.0 . 4.19 1489 1330 A 7 LEU HDx% A 11 PHE HBx 1.0 . 3.97 1490 1331 A 40 THR HG2% A 43 LEU HDy% 1.0 . 3.35 1491 1332 A 55 TYR HD% A 56 LEU HG 1.0 . 4.67 1492 1333 A 13 LYS HGy A 13 LYS HEx 1.0 . 4.04 1493 1334 A 101 LEU H A 101 LEU HDy% 1.0 . 4.20 1494 1335 A 102 ALA H A 101 LEU HDy% 1.0 . 4.94 1495 1336 A 112 PHE HD% A 101 LEU HDy% 1.0 . 4.56 1496 1337 A 101 LEU HA A 101 LEU HDy% 1.0 . 3.73 1497 1338 A 99 TYR HBy A 101 LEU HDy% 1.0 . 3.65 1498 1339 A 99 TYR HBx A 101 LEU HDy% 1.0 . 3.45 1499 1340 A 87 ILE HG1y A 74 LEU HD2% 1.0 . 3.74 1500 1341 A 24 ILE HG1x A 101 LEU HDy% 1.0 . 3.75 1501 1342 A 74 LEU H A 74 LEU HD2% 1.0 . 4.01 1502 1343 A 75 GLY H A 74 LEU HD2% 1.0 . 4.85 1503 1344 A 13 LYS H A 13 LYS HGx 1.0 . 4.16 1504 1345 A 18 LYS HA A 18 LYS HG2 1.0 . 3.74 1505 1345 A 18 LYS HG3 A 18 LYS HA 1.0 . 3.74 1506 1346 A 57 LYS H A 57 LYS HGx 1.0 . 3.93 1507 1347 A 85 GLY HAx A 74 LEU HD2% 1.0 . 4.37 1508 1348 A 18 LYS HEx A 18 LYS HG2 1.0 . 4.21 1509 1348 A 18 LYS HEy A 18 LYS HG2 1.0 . 4.21 1510 1348 A 18 LYS HG3 A 18 LYS HEy 1.0 . 4.21 1511 1348 A 18 LYS HG3 A 18 LYS HEx 1.0 . 4.21 1512 1349 A 82 LYS HA A 82 LYS HGy 1.0 . 4.08 1513 1350 A 78 LYS HE2 A 78 LYS HG2 1.0 . 3.69 1514 1350 A 78 LYS HG3 A 78 LYS HE2 1.0 . 3.69 1515 1350 A 78 LYS HG3 A 78 LYS HE3 1.0 . 3.69 1516 1350 A 78 LYS HE3 A 78 LYS HG2 1.0 . 3.69 1517 1351 A 82 LYS H A 82 LYS HGx 1.0 . 4.29 1518 1352 A 30 LYS H A 30 LYS HG2 1.0 . 4.42 1519 1352 A 30 LYS H A 30 LYS HG3 1.0 . 4.42 1520 1353 A 30 LYS HA A 30 LYS HG2 1.0 . 3.84 1521 1353 A 30 LYS HA A 30 LYS HG3 1.0 . 3.84 1522 1354 A 30 LYS HE2 A 30 LYS HG2 1.0 . 4.07 1523 1354 A 30 LYS HE3 A 30 LYS HG2 1.0 . 4.07 1524 1354 A 30 LYS HG3 A 30 LYS HE2 1.0 . 4.07 1525 1354 A 30 LYS HE3 A 30 LYS HG3 1.0 . 4.07 1526 1355 A 4 LEU H A 4 LEU HD2% 1.0 . 3.66 1527 1356 A 41 LYS H A 40 THR HB 1.0 . 3.47 1528 1357 A 42 ASP H A 40 THR HB 1.0 . 4.13 1529 1358 A 43 LEU H A 40 THR HB 1.0 . 4.64 1530 1359 A 108 ASN HBy A 40 THR HB 1.0 . 4.65 1531 1360 A 41 LYS HBx A 40 THR HB 1.0 . 4.69 1532 1361 A 5 LYS H A 5 LYS HGy 1.0 . 3.92 1533 1362 A 5 LYS H A 5 LYS HGx 1.0 . 4.05 1534 1363 A 41 LYS HA A 41 LYS HGy 1.0 . 4.10 1535 1364 A 41 LYS H A 41 LYS HGy 1.0 . 4.20 1536 1365 A 61 LYS H A 61 LYS HGx 1.0 . 3.82 1537 1366 A 61 LYS HGx A 61 LYS HA 1.0 . 3.66 1538 1367 A 61 LYS HGx A 61 LYS HE2 1.0 . 3.71 1539 1367 A 61 LYS HE3 A 61 LYS HGx 1.0 . 3.71 1540 1368 A 81 LYS HA A 81 LYS HGx 1.0 . 3.55 1541 1369 A 82 LYS H A 81 LYS HGx 1.0 . 5.11 1542 1370 A 83 TYR HE% A 81 LYS HGx 1.0 . 5.50 1543 1371 A 91 LYS H A 91 LYS HGy 1.0 . 3.98 1544 1372 A 91 LYS HA A 91 LYS HGy 1.0 . 4.15 1545 1373 A 59 LEU H A 59 LEU HDy% 1.0 . 4.29 1546 1374 A 59 LEU HDy% A 55 TYR HE% 1.0 . 3.75 1547 1375 A 59 LEU HDy% A 59 LEU HA 1.0 . 3.76 1548 1376 A 59 LEU HDy% A 56 LEU HA 1.0 . 3.97 1549 1377 A 59 LEU HDy% A 28 GLN HGy 1.0 . 4.21 1550 1378 A 59 LEU HDy% A 28 GLN HB2 1.0 . 3.97 1551 1378 A 59 LEU HDy% A 28 GLN HB3 1.0 . 3.97 1552 1379 A 59 LEU HBy A 59 LEU HDy% 1.0 . 3.51 1553 1380 A 56 LEU HDy% A 59 LEU HDy% 1.0 . 3.82 1554 1381 A 59 LEU HDy% A 28 GLN HGx 1.0 . 4.13 1555 1382 A 47 LEU HDy% A 39 PHE HBy 1.0 . 5.50 1556 1383 A 47 LEU HDy% A 43 LEU HBy 1.0 . 5.45 1557 1384 A 47 LEU HDy% A 36 LYS HGy 1.0 . 4.45 1558 1385 A 47 LEU HDy% A 39 PHE HD% 1.0 . 5.02 1559 1386 A 47 LEU HDy% A 47 LEU HB2 1.0 . 3.73 1560 1386 A 47 LEU HB3 A 47 LEU HDy% 1.0 . 3.73 1561 1387 A 58 ILE HA A 61 LYS HGy 1.0 . 5.16 1562 1388 A 71 CYS H A 70 LYS HG2 1.0 . 3.73 1563 1388 A 70 LYS HG3 A 71 CYS H 1.0 . 3.73 1564 1389 A 90 VAL H A 90 VAL HGx% 1.0 . 3.69 1565 1390 A 99 TYR H A 90 VAL HGx% 1.0 . 5.18 1566 1391 A 91 LYS H A 90 VAL HGx% 1.0 . 4.36 1567 1392 A 68 PHE HD% A 90 VAL HGx% 1.0 . 3.48 1568 1393 A 99 TYR HE% A 90 VAL HGx% 1.0 . 3.69 1569 1394 A 65 PHE HE% A 90 VAL HGx% 1.0 . 5.25 1570 1395 A 89 VAL HA A 90 VAL HGx% 1.0 . 5.19 1571 1396 A 90 VAL HA A 90 VAL HGx% 1.0 . 3.40 1572 1397 A 65 PHE HBx A 90 VAL HGx% 1.0 . 4.44 1573 1398 A 98 ASN HA A 90 VAL HGx% 1.0 . 5.29 1574 1399 A 73 TYR HE% A 7 LEU HDy% 1.0 . 5.28 1575 1400 A 12 ASP HBx A 15 THR HB 1.0 . 3.27 1576 1401 A 107 MET HE% A 107 MET HBy 1.0 . 4.39 1577 1402 A 7 LEU HDy% A 85 GLY H 1.0 . 3.32 1578 1403 A 7 LEU HDy% A 74 LEU H 1.0 . 4.12 1579 1404 A 73 TYR HD% A 7 LEU HDy% 1.0 . 3.74 1580 1405 A 7 LEU HDy% A 7 LEU HA 1.0 . 3.19 1581 1406 A 7 LEU HDy% A 84 GLY HAy 1.0 . 3.84 1582 1407 A 7 LEU HDy% A 8 PRO HDy 1.0 . 4.17 1583 1408 A 7 LEU HDy% A 13 LYS HA 1.0 . 4.55 1584 1409 A 73 TYR HBy A 7 LEU HDy% 1.0 . 3.36 1585 1410 A 7 LEU HDy% A 85 GLY HAx 1.0 . 5.28 1586 1411 A 7 LEU HDy% A 11 PHE HBx 1.0 . 4.27 1587 1412 A 39 PHE HD% A 36 LYS HGy 1.0 . 5.50 1588 1413 A 36 LYS H A 36 LYS HGx 1.0 . 4.59 1589 1414 A 36 LYS HA A 36 LYS HGx 1.0 . 4.12 1590 1415 A 36 LYS HGx A 37 SER H 1.0 . 5.25 1591 1416 A 107 MET HBx A 107 MET HE% 1.0 . 4.25 1592 1417 A 16 VAL HG2% A 11 PHE HA 1.0 . 4.78 1593 1418 A 15 THR HB A 16 VAL HG2% 1.0 . 4.49 1594 1419 A 16 VAL HG2% A 16 VAL HA 1.0 . 3.13 1595 1420 A 11 PHE HBy A 16 VAL HG2% 1.0 . 4.19 1596 1421 A 16 VAL HG2% A 11 PHE HBx 1.0 . 3.61 1597 1422 A 7 LEU HDx% A 16 VAL HG2% 1.0 . 3.45 1598 1423 A 109 LEU H A 109 LEU HD1% 1.0 . 4.28 1599 1424 A 110 VAL H A 109 LEU HD1% 1.0 . 3.87 1600 1425 A 102 ALA H A 109 LEU HD1% 1.0 . 3.89 1601 1426 A 112 PHE HD% A 109 LEU HD1% 1.0 . 4.10 1602 1427 A 111 SER H A 109 LEU HD1% 1.0 . 4.21 1603 1428 A 103 TYR HE% A 109 LEU HD1% 1.0 . 4.02 1604 1429 A 103 TYR HA A 109 LEU HD1% 1.0 . 5.02 1605 1430 A 101 LEU HA A 109 LEU HD1% 1.0 . 4.14 1606 1431 A 109 LEU HA A 109 LEU HD1% 1.0 . 3.27 1607 1432 A 23 ASP HBx A 109 LEU HD1% 1.0 . 4.99 1608 1433 A 101 LEU HDx% A 109 LEU HD1% 1.0 . 3.56 1609 1434 A 12 ASP H A 16 VAL HG2% 1.0 . 3.84 1610 1435 A 16 VAL H A 16 VAL HG2% 1.0 . 3.13 1611 1436 A 73 TYR HE% A 16 VAL HG2% 1.0 . 5.39 1612 1437 A 23 ASP HBy A 109 LEU HD1% 1.0 . 4.17 1613 1438 A 101 LEU HG A 109 LEU HD1% 1.0 . 4.79 1614 1439 A 59 LEU H A 59 LEU HDx% 1.0 . 4.06 1615 1440 A 59 LEU HDx% A 55 TYR HE% 1.0 . 3.52 1616 1441 A 59 LEU HA A 59 LEU HDx% 1.0 . 3.15 1617 1442 A 56 LEU HA A 59 LEU HDx% 1.0 . 4.69 1618 1443 A 56 LEU HDy% A 59 LEU HDx% 1.0 . 4.45 1619 1444 A 41 LYS H A 40 THR HG2% 1.0 . 3.95 1620 1445 A 40 THR H A 40 THR HG2% 1.0 . 3.14 1621 1446 A 43 LEU H A 40 THR HG2% 1.0 . 3.68 1622 1447 A 39 PHE HD% A 40 THR HG2% 1.0 . 4.77 1623 1448 A 40 THR HG2% A 39 PHE HA 1.0 . 4.95 1624 1449 A 40 THR HG2% A 110 VAL HA 1.0 . 3.94 1625 1450 A 40 THR HG2% A 40 THR HA 1.0 . 3.47 1626 1451 A 108 ASN HBx A 40 THR HG2% 1.0 . 4.03 1627 1452 A 40 THR HG2% A 110 VAL HGy% 1.0 . 3.19 1628 1453 A 40 THR HG2% A 110 VAL HGx% 1.0 . 4.53 1629 1454 A 103 TYR HE% A 16 VAL HA 1.0 . 5.50 1630 1455 A 15 THR HB A 16 VAL HA 1.0 . 5.13 1631 1456 A 19 GLN HBx A 16 VAL HA 1.0 . 4.01 1632 1457 A 19 GLN H A 16 VAL HA 1.0 . 4.61 1633 1458 A 15 THR HG2% A 15 THR HA 1.0 . 3.45 1634 1459 A 43 LEU H A 43 LEU HD1% 1.0 . 4.00 1635 1460 A 39 PHE HD% A 43 LEU HD1% 1.0 . 4.77 1636 1461 A 39 PHE HE% A 43 LEU HD1% 1.0 . 5.42 1637 1462 A 43 LEU HA A 43 LEU HD1% 1.0 . 2.86 1638 1463 A 4 LEU H A 4 LEU HDx% 1.0 . 3.84 1639 1464 A 3 ILE H A 4 LEU HDx% 1.0 . 4.90 1640 1465 A 4 LEU HDx% A 4 LEU HA 1.0 . 2.95 1641 1466 A 2 GLU HGx A 4 LEU HDx% 1.0 . 4.68 1642 1467 A 39 PHE HZ A 47 LEU HD1% 1.0 . 5.49 1643 1468 A 47 LEU HD1% A 48 THR H 1.0 . 4.15 1644 1469 A 39 PHE HE% A 47 LEU HD1% 1.0 . 4.40 1645 1470 A 47 LEU HD1% A 47 LEU HA 1.0 . 3.16 1646 1471 A 47 LEU HD1% A 43 LEU HBy 1.0 . 5.48 1647 1472 A 44 GLN HA A 47 LEU HD1% 1.0 . 4.94 1648 1473 A 47 LEU HD1% A 39 PHE HBx 1.0 . 5.50 1649 1474 A 103 TYR H A 110 VAL HGy% 1.0 . 5.50 1650 1475 A 103 TYR HA A 110 VAL HGy% 1.0 . 4.47 1651 1476 A 40 THR HB A 110 VAL HGy% 1.0 . 5.01 1652 1477 A 104 ASP HBy A 110 VAL HGy% 1.0 . 3.86 1653 1478 A 90 VAL HGy% A 90 VAL HA 1.0 . 3.29 1654 1479 A 24 ILE HG1x A 24 ILE HA 1.0 . 4.09 1655 1480 A 51 SER H A 48 THR HG2% 1.0 . 4.48 1656 1481 A 103 TYR H A 102 ALA HB% 1.0 . 3.47 1657 1482 A 102 ALA H A 102 ALA HB% 1.0 . 3.41 1658 1483 A 111 SER HBx A 102 ALA HB% 1.0 . 3.42 1659 1484 A 83 TYR HBx A 102 ALA HB% 1.0 . 5.17 1660 1485 A 102 ALA HB% A 110 VAL HGx% 1.0 . 3.19 1661 1486 A 86 VAL H A 102 ALA HB% 1.0 . 4.12 1662 1487 A 85 GLY HAx A 102 ALA HB% 1.0 . 3.74 1663 1488 A 104 ASP H A 110 VAL HGy% 1.0 . 3.83 1664 1489 A 110 VAL H A 110 VAL HGy% 1.0 . 3.71 1665 1490 A 40 THR H A 110 VAL HGy% 1.0 . 4.71 1666 1491 A 111 SER H A 110 VAL HGy% 1.0 . 4.98 1667 1492 A 83 TYR HD% A 110 VAL HGy% 1.0 . 3.84 1668 1493 A 110 VAL HA A 110 VAL HGy% 1.0 . 3.18 1669 1494 A 49 GLU H A 48 THR HG2% 1.0 . 3.98 1670 1495 A 50 GLU H A 48 THR HG2% 1.0 . 4.39 1671 1496 A 48 THR H A 48 THR HG2% 1.0 . 3.43 1672 1497 A 47 LEU HA A 48 THR HG2% 1.0 . 4.83 1673 1498 A 73 TYR HD% A 16 VAL HGx% 1.0 . 3.68 1674 1499 A 17 ARG H A 16 VAL HGx% 1.0 . 3.92 1675 1500 A 103 TYR HE% A 16 VAL HGx% 1.0 . 4.15 1676 1501 A 16 VAL HA A 16 VAL HGx% 1.0 . 3.43 1677 1502 A 97 VAL H A 97 VAL HG2% 1.0 . 3.57 1678 1503 A 98 ASN H A 97 VAL HG2% 1.0 . 4.25 1679 1504 A 92 TYR HD% A 97 VAL HG2% 1.0 . 3.65 1680 1505 A 97 VAL HG2% A 97 VAL HA 1.0 . 3.21 1681 1506 A 90 VAL H A 90 VAL HGy% 1.0 . 4.37 1682 1507 A 91 LYS H A 90 VAL HGy% 1.0 . 3.44 1683 1508 A 65 PHE HE% A 90 VAL HGy% 1.0 . 3.47 1684 1509 A 26 ILE HA A 29 SER HB2 1.0 . 4.11 1685 1509 A 29 SER HB3 A 26 ILE HA 1.0 . 4.11 1686 1510 A 26 ILE HG2% A 26 ILE HA 1.0 . 3.84 1687 1511 A 101 LEU H A 86 VAL HG1% 1.0 . 4.27 1688 1512 A 86 VAL H A 86 VAL HG1% 1.0 . 3.41 1689 1513 A 73 TYR HD% A 86 VAL HG1% 1.0 . 4.13 1690 1514 A 73 TYR HE% A 86 VAL HG1% 1.0 . 4.49 1691 1515 A 103 TYR HE% A 86 VAL HG1% 1.0 . 4.13 1692 1516 A 86 VAL HG1% A 86 VAL HA 1.0 . 3.79 1693 1517 A 87 ILE HG2% A 89 VAL HGx% 1.0 . 4.09 1694 1518 A 88 ILE H A 86 VAL HGy% 1.0 . 4.69 1695 1519 A 101 LEU H A 86 VAL HGy% 1.0 . 4.51 1696 1520 A 87 ILE H A 86 VAL HGy% 1.0 . 3.41 1697 1521 A 73 TYR HD% A 86 VAL HGy% 1.0 . 4.27 1698 1522 A 103 TYR HE% A 86 VAL HGy% 1.0 . 5.50 1699 1523 A 86 VAL HGy% A 86 VAL HA 1.0 . 3.31 1700 1524 A 86 VAL HGy% A 71 CYS HBx 1.0 . 3.69 1701 1525 A 97 VAL HGx% A 97 VAL H 1.0 . 4.28 1702 1526 A 97 VAL HGx% A 98 ASN H 1.0 . 3.49 1703 1527 A 97 VAL HGx% A 98 ASN HA 1.0 . 4.96 1704 1528 A 97 VAL HGx% A 114 MET HA 1.0 . 4.38 1705 1529 A 97 VAL HGx% A 97 VAL HA 1.0 . 3.38 1706 1530 A 97 VAL HGx% A 114 MET HBx 1.0 . 3.69 1707 1531 A 96 ASN HBy A 89 VAL HGx% 1.0 . 5.50 1708 1532 A 90 VAL H A 89 VAL HGx% 1.0 . 3.98 1709 1533 A 70 LYS H A 89 VAL HGx% 1.0 . 3.91 1710 1534 A 89 VAL H A 89 VAL HGx% 1.0 . 3.12 1711 1535 A 89 VAL HGx% A 98 ASN HD2x 1.0 . 5.20 1712 1536 A 98 ASN HA A 89 VAL HGx% 1.0 . 3.65 1713 1537 A 89 VAL HA A 89 VAL HGx% 1.0 . 3.15 1714 1538 A 89 VAL HGx% A 70 LYS HB2 1.0 . 3.41 1715 1538 A 70 LYS HB3 A 89 VAL HGx% 1.0 . 3.41 1716 1539 A 72 THR H A 72 THR HG2% 1.0 . 3.99 1717 1540 A 72 THR HG2% A 73 TYR H 1.0 . 3.38 1718 1541 A 73 TYR HD% A 72 THR HG2% 1.0 . 5.35 1719 1542 A 72 THR HA A 72 THR HG2% 1.0 . 3.15 1720 1543 A 72 THR HG2% A 74 LEU HDx% 1.0 . 3.33 1721 1544 A 71 CYS HA A 72 THR HG2% 1.0 . 5.50 1722 1545 A 90 VAL HA A 89 VAL HG2% 1.0 . 5.21 1723 1546 A 89 VAL HG2% A 96 ASN HD2y 1.0 . 4.46 1724 1547 A 96 ASN HA A 89 VAL HG2% 1.0 . 4.76 1725 1548 A 69 GLY HAx A 89 VAL HG2% 1.0 . 3.96 1726 1549 A 90 VAL H A 89 VAL HG2% 1.0 . 3.33 1727 1550 A 70 LYS H A 89 VAL HG2% 1.0 . 4.25 1728 1551 A 89 VAL H A 89 VAL HG2% 1.0 . 4.07 1729 1552 A 98 ASN HA A 89 VAL HG2% 1.0 . 4.51 1730 1553 A 89 VAL HA A 89 VAL HG2% 1.0 . 3.24 1731 1554 A 47 LEU H A 46 SER HBy 1.0 . 5.25 1732 1555 A 47 LEU H A 46 SER HBx 1.0 . 5.50 1733 1556 A 58 ILE HA A 57 LYS HBx 1.0 . 4.31 1734 1557 A 58 ILE HG1y A 58 ILE HA 1.0 . 3.93 1735 1558 A 102 ALA H A 111 SER HBy 1.0 . 5.50 1736 1559 A 110 VAL HGx% A 111 SER HBy 1.0 . 5.10 1737 1560 A 100 SER HBy A 113 THR HG2% 1.0 . 4.78 1738 1561 A 37 SER H A 37 SER HBx 1.0 . 3.72 1739 1562 A 100 SER HBy A 87 ILE HG2% 1.0 . 5.31 1740 1563 A 100 SER H A 100 SER HBx 1.0 . 3.87 1741 1564 A 87 ILE HG1x A 100 SER HBx 1.0 . 4.90 1742 1565 A 87 ILE HG2% A 100 SER HBx 1.0 . 4.95 1743 1566 A 103 TYR H A 110 VAL HGx% 1.0 . 5.06 1744 1567 A 104 ASP H A 110 VAL HGx% 1.0 . 4.12 1745 1568 A 110 VAL H A 110 VAL HGx% 1.0 . 3.19 1746 1569 A 102 ALA H A 110 VAL HGx% 1.0 . 4.70 1747 1570 A 111 SER H A 110 VAL HGx% 1.0 . 3.61 1748 1571 A 110 VAL HA A 110 VAL HGx% 1.0 . 3.81 1749 1572 A 109 LEU HA A 110 VAL HGx% 1.0 . 4.23 1750 1573 A 111 SER HBx A 110 VAL HGx% 1.0 . 3.95 1751 1574 A 83 TYR HBy A 110 VAL HGx% 1.0 . 3.76 1752 1575 A 83 TYR HBx A 110 VAL HGx% 1.0 . 4.85 1753 1576 A 23 ASP H A 20 ALA HB% 1.0 . 5.50 1754 1577 A 24 ILE H A 20 ALA HB% 1.0 . 5.48 1755 1578 A 20 ALA H A 20 ALA HB% 1.0 . 3.11 1756 1579 A 21 MET H A 20 ALA HB% 1.0 . 3.50 1757 1580 A 24 ILE HD1% A 20 ALA HB% 1.0 . 3.76 1758 1581 A 20 ALA HB% A 17 ARG HA 1.0 . 3.60 1759 1582 A 16 VAL HA A 20 ALA HB% 1.0 . 4.65 1760 1583 A 23 ASP HBy A 20 ALA HB% 1.0 . 5.50 1761 1584 A 101 LEU HG A 20 ALA HB% 1.0 . 4.35 1762 1585 A 50 GLU H A 51 SER HB2 1.0 . 4.98 1763 1585 A 51 SER HB3 A 50 GLU H 1.0 . 4.98 1764 1586 A 46 SER H A 45 SER HBy 1.0 . 4.99 1765 1587 A 45 SER H A 45 SER HBy 1.0 . 3.98 1766 1588 A 90 VAL H A 89 VAL HA 1.0 . 2.89 1767 1589 A 89 VAL HA A 98 ASN HA 1.0 . 3.44 1768 1590 A 65 PHE HE% A 90 VAL HA 1.0 . 5.10 1769 1591 A 91 LYS H A 90 VAL HA 1.0 . 2.91 1770 1592 A 90 VAL HA A 91 LYS HB2 1.0 . 4.88 1771 1592 A 91 LYS HB3 A 90 VAL HA 1.0 . 4.88 1772 1593 A 54 SER H A 54 SER HBx 1.0 . 3.52 1773 1594 A 43 LEU H A 40 THR HA 1.0 . 5.30 1774 1595 A 41 LYS H A 40 THR HA 1.0 . 2.82 1775 1596 A 41 LYS HBx A 40 THR HA 1.0 . 4.44 1776 1597 A 108 ASN HBy A 40 THR HA 1.0 . 4.17 1777 1598 A 4 LEU H A 3 ILE HG2% 1.0 . 3.40 1778 1599 A 3 ILE H A 3 ILE HG2% 1.0 . 4.14 1779 1600 A 75 GLY H A 3 ILE HG2% 1.0 . 4.18 1780 1601 A 76 GLN HA A 3 ILE HG2% 1.0 . 5.23 1781 1602 A 3 ILE HA A 3 ILE HG2% 1.0 . 3.15 1782 1603 A 3 ILE HG1y A 3 ILE HG2% 1.0 . 3.62 1783 1604 A 3 ILE HG1x A 3 ILE HG2% 1.0 . 3.51 1784 1605 A 9 GLU H A 8 PRO HA 1.0 . 2.90 1785 1606 A 4 LEU HD2% A 8 PRO HA 1.0 . 4.52 1786 1607 A 51 SER HA A 51 SER HB2 1.0 . 2.69 1787 1607 A 51 SER HB3 A 51 SER HA 1.0 . 2.69 1788 1608 A 26 ILE HG2% A 34 SER HA 1.0 . 5.28 1789 1609 A 72 THR HA A 73 TYR H 1.0 . 2.82 1790 1610 A 71 CYS HA A 72 THR HA 1.0 . 4.57 1791 1611 A 72 THR HA A 86 VAL HGy% 1.0 . 5.50 1792 1612 A 55 TYR HA A 58 ILE HG2% 1.0 . 4.81 1793 1613 A 59 LEU H A 58 ILE HG2% 1.0 . 3.95 1794 1614 A 60 GLU H A 58 ILE HG2% 1.0 . 5.50 1795 1615 A 58 ILE H A 58 ILE HG2% 1.0 . 4.02 1796 1616 A 62 GLN HE2x A 58 ILE HG2% 1.0 . 3.78 1797 1617 A 58 ILE HA A 58 ILE HG2% 1.0 . 3.14 1798 1618 A 58 ILE HG1y A 58 ILE HG2% 1.0 . 3.53 1799 1619 A 58 ILE HG2% A 58 ILE HG1x 1.0 . 3.45 1800 1620 A 73 TYR HE% A 72 THR HA 1.0 . 5.11 1801 1621 A 96 ASN HBy A 97 VAL HA 1.0 . 4.27 1802 1622 A 114 MET H A 114 MET HE% 1.0 . 4.57 1803 1623 A 99 TYR HE% A 114 MET HE% 1.0 . 4.08 1804 1624 A 55 TYR HD% A 114 MET HE% 1.0 . 3.43 1805 1625 A 55 TYR HA A 114 MET HE% 1.0 . 4.01 1806 1626 A 114 MET HGy A 114 MET HE% 1.0 . 3.23 1807 1627 A 97 VAL HGx% A 114 MET HE% 1.0 . 3.57 1808 1628 A 98 ASN H A 97 VAL HA 1.0 . 2.75 1809 1629 A 26 ILE HG2% A 26 ILE H 1.0 . 4.05 1810 1630 A 26 ILE HG2% A 29 SER H 1.0 . 5.36 1811 1631 A 26 ILE HG2% A 34 SER HB2 1.0 . 3.12 1812 1631 A 26 ILE HG2% A 34 SER HB3 1.0 . 3.12 1813 1632 A 26 ILE HG2% A 35 TRP HBy 1.0 . 4.19 1814 1633 A 78 LYS H A 77 ILE HG2% 1.0 . 3.40 1815 1634 A 77 ILE H A 77 ILE HG2% 1.0 . 3.93 1816 1635 A 81 LYS H A 77 ILE HG2% 1.0 . 3.93 1817 1636 A 77 ILE HA A 77 ILE HG2% 1.0 . 3.18 1818 1637 A 82 LYS HA A 77 ILE HG2% 1.0 . 4.68 1819 1638 A 80 ASN HA A 77 ILE HG2% 1.0 . 3.52 1820 1639 A 77 ILE HG1y A 77 ILE HG2% 1.0 . 4.04 1821 1640 A 77 ILE HG1x A 77 ILE HG2% 1.0 . 3.41 1822 1641 A 88 ILE H A 87 ILE HG2% 1.0 . 3.49 1823 1642 A 87 ILE H A 87 ILE HG2% 1.0 . 4.25 1824 1643 A 87 ILE HG2% A 98 ASN HD2x 1.0 . 5.50 1825 1644 A 87 ILE HG2% A 87 ILE HA 1.0 . 3.10 1826 1645 A 98 ASN HBx A 87 ILE HG2% 1.0 . 3.33 1827 1646 A 87 ILE HG2% A 87 ILE HG1x 1.0 . 3.20 1828 1647 A 13 LYS HGy A 13 LYS HA 1.0 . 3.52 1829 1648 A 13 LYS HGx A 13 LYS HA 1.0 . 3.57 1830 1649 A 25 GLU HA A 24 ILE HG2% 1.0 . 4.30 1831 1650 A 87 ILE HG2% A 98 ASN HBy 1.0 . 3.94 1832 1651 A 113 THR HG2% A 113 THR HA 1.0 . 3.94 1833 1652 A 21 MET H A 17 ARG HA 1.0 . 5.46 1834 1653 A 32 TYR HA A 32 TYR HD% 1.0 . 3.88 1835 1654 A 32 TYR HE% A 32 TYR HA 1.0 . 4.87 1836 1655 A 73 TYR HD% A 13 LYS HA 1.0 . 5.01 1837 1656 A 73 TYR HE% A 13 LYS HA 1.0 . 3.98 1838 1657 A 31 ASP HA A 32 TYR HA 1.0 . 4.57 1839 1658 A 24 ILE H A 24 ILE HG2% 1.0 . 4.13 1840 1659 A 25 GLU H A 24 ILE HG2% 1.0 . 4.35 1841 1660 A 24 ILE HG2% A 68 PHE HE% 1.0 . 3.62 1842 1661 A 24 ILE HG2% A 24 ILE HA 1.0 . 3.45 1843 1662 A 28 GLN HGy A 24 ILE HG2% 1.0 . 4.23 1844 1663 A 90 VAL HGx% A 24 ILE HG2% 1.0 . 3.68 1845 1664 A 90 VAL HGy% A 24 ILE HG2% 1.0 . 3.43 1846 1665 A 24 ILE HG1x A 24 ILE HG2% 1.0 . 3.86 1847 1666 A 4 LEU H A 3 ILE HA 1.0 . 2.67 1848 1667 A 3 ILE HG1x A 3 ILE HA 1.0 . 4.03 1849 1668 A 44 GLN HE2x A 37 SER HA 1.0 . 3.54 1850 1669 A 25 GLU HA A 28 GLN HE2x 1.0 . 4.32 1851 1670 A 17 ARG HGx A 17 ARG HA 1.0 . 3.23 1852 1671 A 3 ILE HA A 77 ILE HD1% 1.0 . 3.47 1853 1672 A 47 LEU H A 45 SER HA 1.0 . 4.57 1854 1673 A 45 SER HBx A 45 SER HA 1.0 . 2.82 1855 1674 A 18 LYS H A 21 MET HE% 1.0 . 5.05 1856 1675 A 21 MET H A 21 MET HE% 1.0 . 4.15 1857 1676 A 68 PHE HE% A 21 MET HE% 1.0 . 4.78 1858 1677 A 18 LYS HA A 21 MET HE% 1.0 . 3.04 1859 1678 A 17 ARG HDy A 21 MET HE% 1.0 . 4.35 1860 1679 A 21 MET HGy A 21 MET HE% 1.0 . 3.94 1861 1680 A 21 MET HE% A 18 LYS HG2 1.0 . 3.33 1862 1680 A 18 LYS HG3 A 21 MET HE% 1.0 . 3.33 1863 1681 A 21 MET HBx A 21 MET HE% 1.0 . 2.88 1864 1682 A 88 ILE HD1% A 21 MET HE% 1.0 . 4.25 1865 1683 A 21 MET HGx A 21 MET HE% 1.0 . 3.75 1866 1684 A 93 GLU HBy A 93 GLU HA 1.0 . 2.98 1867 1685 A 93 GLU HA A 66 LYS HG2 1.0 . 3.47 1868 1685 A 66 LYS HG3 A 93 GLU HA 1.0 . 3.47 1869 1686 A 66 LYS H A 65 PHE HA 1.0 . 2.97 1870 1687 A 90 VAL HGy% A 65 PHE HA 1.0 . 4.84 1871 1688 A 44 GLN HE2y A 41 LYS HA 1.0 . 3.91 1872 1689 A 41 LYS HA A 44 GLN HE2x 1.0 . 4.37 1873 1690 A 44 GLN HGy A 41 LYS HA 1.0 . 3.82 1874 1691 A 41 LYS HBx A 41 LYS HA 1.0 . 2.85 1875 1692 A 44 GLN H A 41 LYS HA 1.0 . 4.64 1876 1693 A 44 GLN HA A 39 PHE HBy 1.0 . 5.16 1877 1694 A 44 GLN HA A 43 LEU H 1.0 . 5.12 1878 1695 A 44 GLN HA A 44 GLN HGy 1.0 . 3.82 1879 1696 A 44 GLN HA A 43 LEU HBx 1.0 . 4.78 1880 1697 A 44 GLN HA A 47 LEU HDy% 1.0 . 3.90 1881 1698 A 78 LYS H A 77 ILE HA 1.0 . 2.79 1882 1699 A 81 LYS H A 77 ILE HA 1.0 . 4.58 1883 1700 A 83 TYR HD% A 77 ILE HA 1.0 . 4.39 1884 1701 A 77 ILE HG1x A 77 ILE HA 1.0 . 3.78 1885 1702 A 110 VAL HB A 110 VAL HA 1.0 . 3.01 1886 1703 A 55 TYR HA A 57 LYS H 1.0 . 4.76 1887 1704 A 53 ASP H A 50 GLU HA 1.0 . 3.77 1888 1705 A 44 GLN HA A 47 LEU HG 1.0 . 4.06 1889 1706 A 87 ILE H A 88 ILE HG2% 1.0 . 5.46 1890 1707 A 89 VAL HA A 88 ILE HG2% 1.0 . 4.94 1891 1708 A 88 ILE H A 87 ILE HA 1.0 . 2.89 1892 1709 A 101 LEU H A 87 ILE HA 1.0 . 4.62 1893 1710 A 87 ILE HG1x A 87 ILE HA 1.0 . 3.65 1894 1711 A 77 ILE HA A 82 LYS HGx 1.0 . 5.15 1895 1712 A 83 TYR HE% A 77 ILE HA 1.0 . 5.15 1896 1713 A 77 ILE HG1y A 77 ILE HA 1.0 . 4.08 1897 1714 A 53 ASP HBy A 50 GLU HA 1.0 . 3.26 1898 1715 A 50 GLU HA A 53 ASP HBx 1.0 . 3.58 1899 1716 A 88 ILE H A 88 ILE HG2% 1.0 . 3.19 1900 1717 A 99 TYR H A 88 ILE HG2% 1.0 . 4.05 1901 1718 A 89 VAL H A 88 ILE HG2% 1.0 . 4.39 1902 1719 A 68 PHE HD% A 88 ILE HG2% 1.0 . 4.34 1903 1720 A 68 PHE HE% A 88 ILE HG2% 1.0 . 4.86 1904 1721 A 99 TYR HD% A 88 ILE HG2% 1.0 . 4.27 1905 1722 A 88 ILE HA A 88 ILE HG2% 1.0 . 3.68 1906 1723 A 99 TYR HBy A 88 ILE HG2% 1.0 . 3.43 1907 1724 A 24 ILE HD1% A 88 ILE HG2% 1.0 . 3.19 1908 1725 A 48 THR HA A 48 THR HG2% 1.0 . 3.64 1909 1726 A 18 LYS HA A 18 LYS HBx 1.0 . 2.77 1910 1727 A 21 MET HGx A 18 LYS HA 1.0 . 5.34 1911 1728 A 33 GLU HA A 36 LYS HE2 1.0 . 4.25 1912 1728 A 36 LYS HE3 A 33 GLU HA 1.0 . 4.25 1913 1729 A 36 LYS H A 33 GLU HA 1.0 . 4.03 1914 1730 A 37 SER H A 33 GLU HA 1.0 . 4.88 1915 1731 A 33 GLU HA A 33 GLU HB2 1.0 . 2.93 1916 1731 A 33 GLU HB3 A 33 GLU HA 1.0 . 2.93 1917 1732 A 36 LYS HBy A 33 GLU HA 1.0 . 3.33 1918 1733 A 36 LYS HGx A 33 GLU HA 1.0 . 3.82 1919 1734 A 23 ASP H A 21 MET HA 1.0 . 5.46 1920 1735 A 24 ILE H A 21 MET HA 1.0 . 4.31 1921 1736 A 25 GLU H A 21 MET HA 1.0 . 5.47 1922 1737 A 20 ALA HA A 21 MET HA 1.0 . 5.39 1923 1738 A 21 MET HA A 21 MET HGy 1.0 . 3.85 1924 1739 A 21 MET HA A 24 ILE HG2% 1.0 . 4.36 1925 1740 A 51 SER H A 49 GLU HA 1.0 . 5.05 1926 1741 A 52 TYR H A 49 GLU HA 1.0 . 4.14 1927 1742 A 52 TYR HD% A 49 GLU HA 1.0 . 4.25 1928 1743 A 49 GLU HGy A 49 GLU HA 1.0 . 3.82 1929 1744 A 49 GLU HGx A 49 GLU HA 1.0 . 3.12 1930 1745 A 49 GLU H A 48 THR HA 1.0 . 2.97 1931 1746 A 24 ILE H A 22 GLU HA 1.0 . 4.38 1932 1747 A 25 GLU H A 22 GLU HA 1.0 . 3.98 1933 1748 A 25 GLU HGy A 22 GLU HA 1.0 . 4.44 1934 1749 A 25 GLU HBy A 22 GLU HA 1.0 . 3.24 1935 1750 A 22 GLU HA A 22 GLU HB2 1.0 . 2.87 1936 1750 A 22 GLU HB3 A 22 GLU HA 1.0 . 2.87 1937 1751 A 48 THR HA A 49 GLU HA 1.0 . 4.43 1938 1752 A 14 GLU HA A 13 LYS HA 1.0 . 4.92 1939 1753 A 14 GLU HA A 14 GLU HG2 1.0 . 3.48 1940 1753 A 14 GLU HA A 14 GLU HG3 1.0 . 3.48 1941 1754 A 60 GLU HA A 59 LEU HG 1.0 . 4.85 1942 1755 A 24 ILE HD1% A 20 ALA HA 1.0 . 5.50 1943 1756 A 24 ILE HD1% A 24 ILE H 1.0 . 4.12 1944 1757 A 24 ILE HD1% A 68 PHE HE% 1.0 . 3.72 1945 1758 A 99 TYR HE% A 24 ILE HD1% 1.0 . 4.79 1946 1759 A 24 ILE HD1% A 24 ILE HA 1.0 . 4.26 1947 1760 A 24 ILE HD1% A 21 MET HA 1.0 . 4.15 1948 1761 A 99 TYR HBy A 24 ILE HD1% 1.0 . 3.84 1949 1762 A 99 TYR HBx A 24 ILE HD1% 1.0 . 4.11 1950 1763 A 30 LYS HA A 56 LEU HD1% 1.0 . 4.04 1951 1764 A 57 LYS HA A 57 LYS HBx 1.0 . 3.01 1952 1765 A 57 LYS HA A 57 LYS HGy 1.0 . 3.64 1953 1766 A 57 LYS HA A 57 LYS HGx 1.0 . 3.56 1954 1767 A 60 GLU H A 57 LYS HA 1.0 . 3.83 1955 1768 A 62 GLN H A 60 GLU HA 1.0 . 4.22 1956 1769 A 60 GLU HA A 60 GLU HGx 1.0 . 3.46 1957 1770 A 24 ILE HD1% A 25 GLU H 1.0 . 5.50 1958 1771 A 24 ILE HD1% A 99 TYR HA 1.0 . 5.19 1959 1772 A 11 PHE HDx A 105 GLU HA 1.0 . 3.36 1960 1773 A 104 ASP HA A 105 GLU HA 1.0 . 5.13 1961 1774 A 105 GLU HGy A 105 GLU HA 1.0 . 3.88 1962 1775 A 36 LYS HA A 35 TRP HE3 1.0 . 4.86 1963 1776 A 39 PHE HE% A 36 LYS HA 1.0 . 4.46 1964 1777 A 36 LYS HA A 36 LYS HBx 1.0 . 2.99 1965 1778 A 47 LEU HD1% A 36 LYS HA 1.0 . 4.47 1966 1779 A 47 LEU HDy% A 36 LYS HA 1.0 . 3.89 1967 1780 A 112 PHE H A 111 SER HA 1.0 . 2.81 1968 1781 A 46 SER HBx A 46 SER HA 1.0 . 3.00 1969 1782 A 71 CYS HA A 88 ILE HD1% 1.0 . 5.50 1970 1783 A 88 ILE HD1% A 88 ILE HA 1.0 . 4.25 1971 1784 A 88 ILE HD1% A 17 ARG HA 1.0 . 4.72 1972 1785 A 88 ILE HD1% A 68 PHE HBx 1.0 . 4.46 1973 1786 A 88 ILE HD1% A 88 ILE HB 1.0 . 3.39 1974 1787 A 88 ILE HD1% A 88 ILE HG2% 1.0 . 2.75 1975 1788 A 88 ILE HD1% A 21 MET HGx 1.0 . 3.37 1976 1789 A 69 GLY H A 88 ILE HD1% 1.0 . 5.13 1977 1790 A 88 ILE HD1% A 21 MET HGy 1.0 . 4.08 1978 1791 A 104 ASP H A 103 TYR HA 1.0 . 2.99 1979 1792 A 110 VAL H A 103 TYR HA 1.0 . 3.83 1980 1793 A 109 LEU HA A 103 TYR HA 1.0 . 3.57 1981 1794 A 103 TYR HA A 110 VAL HGx% 1.0 . 4.16 1982 1795 A 111 SER H A 103 TYR HA 1.0 . 5.03 1983 1796 A 73 TYR HD% A 86 VAL HA 1.0 . 4.40 1984 1797 A 87 ILE H A 86 VAL HA 1.0 . 2.85 1985 1798 A 74 LEU HD2% A 86 VAL HA 1.0 . 4.03 1986 1799 A 86 VAL HB A 73 TYR HA 1.0 . 4.68 1987 1800 A 73 TYR HA A 74 LEU HD2% 1.0 . 4.92 1988 1801 A 19 GLN HE2y A 107 MET HE% 1.0 . 5.50 1989 1802 A 103 TYR HE% A 107 MET HE% 1.0 . 4.44 1990 1803 A 107 MET HA A 107 MET HE% 1.0 . 3.69 1991 1804 A 71 CYS HA A 88 ILE HA 1.0 . 3.24 1992 1805 A 72 THR HG2% A 73 TYR HA 1.0 . 5.50 1993 1806 A 100 SER H A 99 TYR HA 1.0 . 2.91 1994 1807 A 10 GLY HAx A 9 GLU HA 1.0 . 4.42 1995 1808 A 89 VAL H A 88 ILE HA 1.0 . 2.82 1996 1809 A 112 PHE HA A 102 ALA HB% 1.0 . 5.43 1997 1810 A 113 THR HG2% A 112 PHE HA 1.0 . 5.50 1998 1811 A 11 PHE HDy A 9 GLU HA 1.0 . 5.50 1999 1812 A 10 GLY H A 9 GLU HA 1.0 . 2.67 2000 1813 A 11 PHE H A 9 GLU HA 1.0 . 3.84 2001 1814 A 9 GLU HA A 9 GLU HG2 1.0 . 3.56 2002 1814 A 9 GLU HG3 A 9 GLU HA 1.0 . 3.56 2003 1815 A 9 GLU HA A 9 GLU HB2 1.0 . 2.86 2004 1815 A 9 GLU HB3 A 9 GLU HA 1.0 . 2.86 2005 1816 A 101 LEU HG A 112 PHE HA 1.0 . 4.51 2006 1817 A 26 ILE HB A 23 ASP HA 1.0 . 3.85 2007 1818 A 62 GLN HBy A 59 LEU HA 1.0 . 4.70 2008 1819 A 61 LYS H A 59 LEU HA 1.0 . 4.70 2009 1820 A 62 GLN HGy A 59 LEU HA 1.0 . 3.49 2010 1821 A 59 LEU HA A 59 LEU HG 1.0 . 3.76 2011 1822 A 72 THR H A 87 ILE HD1% 1.0 . 5.08 2012 1823 A 98 ASN HBx A 87 ILE HD1% 1.0 . 5.26 2013 1824 A 87 ILE H A 87 ILE HD1% 1.0 . 4.36 2014 1825 A 87 ILE HA A 87 ILE HD1% 1.0 . 3.88 2015 1826 A 72 THR HB A 87 ILE HD1% 1.0 . 4.18 2016 1827 A 74 LEU HDx% A 87 ILE HD1% 1.0 . 2.40 2017 1828 A 62 GLN H A 59 LEU HA 1.0 . 4.15 2018 1829 A 56 LEU HD1% A 56 LEU HA 1.0 . 4.45 2019 1830 A 59 LEU H A 56 LEU HA 1.0 . 3.95 2020 1831 A 55 TYR HD% A 56 LEU HA 1.0 . 4.53 2021 1832 A 59 LEU HBy A 56 LEU HA 1.0 . 3.30 2022 1833 A 56 LEU HDy% A 56 LEU HA 1.0 . 3.26 2023 1834 A 26 ILE HD1% A 26 ILE H 1.0 . 3.99 2024 1835 A 26 ILE HB A 26 ILE HD1% 1.0 . 3.42 2025 1836 A 26 ILE HD1% A 23 ASP HA 1.0 . 3.52 2026 1837 A 26 ILE HD1% A 25 GLU HA 1.0 . 5.50 2027 1838 A 72 THR H A 71 CYS HA 1.0 . 2.84 2028 1839 A 71 CYS HA A 88 ILE HB 1.0 . 3.90 2029 1840 A 71 CYS HA A 86 VAL HGy% 1.0 . 5.10 2030 1841 A 65 PHE H A 64 GLU HA 1.0 . 2.64 2031 1842 A 53 ASP HA A 56 LEU HG 1.0 . 3.53 2032 1843 A 56 LEU HDy% A 53 ASP HA 1.0 . 5.07 2033 1844 A 71 CYS HA A 70 LYS HA 1.0 . 4.75 2034 1845 A 19 GLN HA A 107 MET HE% 1.0 . 5.50 2035 1846 A 58 ILE H A 56 LEU HA 1.0 . 5.01 2036 1847 A 108 ASN HBy A 39 PHE HA 1.0 . 4.85 2037 1848 A 71 CYS H A 70 LYS HA 1.0 . 2.50 2038 1849 A 70 LYS HA A 70 LYS HB2 1.0 . 2.90 2039 1849 A 70 LYS HB3 A 70 LYS HA 1.0 . 2.90 2040 1850 A 70 LYS HA A 70 LYS HG2 1.0 . 3.75 2041 1850 A 70 LYS HG3 A 70 LYS HA 1.0 . 3.75 2042 1851 A 19 GLN HA A 19 GLN HE2y 1.0 . 3.66 2043 1852 A 19 GLN HA A 19 GLN HE2x 1.0 . 4.29 2044 1853 A 19 GLN HA A 19 GLN HGy 1.0 . 4.21 2045 1854 A 53 ASP HA A 56 LEU HA 1.0 . 5.50 2046 1855 A 109 LEU H A 39 PHE HA 1.0 . 3.73 2047 1856 A 12 ASP H A 11 PHE HA 1.0 . 2.99 2048 1857 A 61 LYS HBx A 61 LYS HA 1.0 . 2.86 2049 1858 A 61 LYS HGy A 61 LYS HA 1.0 . 3.59 2050 1859 A 77 ILE H A 77 ILE HD1% 1.0 . 3.92 2051 1860 A 82 LYS HA A 77 ILE HD1% 1.0 . 4.13 2052 1861 A 77 ILE HB A 77 ILE HD1% 1.0 . 3.44 2053 1862 A 77 ILE HD1% A 82 LYS HE2 1.0 . 4.21 2054 1862 A 82 LYS HE3 A 77 ILE HD1% 1.0 . 4.21 2055 1863 A 59 LEU H A 58 ILE HD1% 1.0 . 4.99 2056 1864 A 58 ILE H A 58 ILE HD1% 1.0 . 4.07 2057 1865 A 55 TYR HD% A 58 ILE HD1% 1.0 . 4.90 2058 1866 A 55 TYR HA A 58 ILE HD1% 1.0 . 3.80 2059 1867 A 58 ILE HA A 58 ILE HD1% 1.0 . 3.84 2060 1868 A 56 LEU HA A 58 ILE HD1% 1.0 . 4.90 2061 1869 A 93 GLU H A 92 TYR HA 1.0 . 3.20 2062 1870 A 65 PHE HA A 92 TYR HA 1.0 . 3.36 2063 1871 A 66 LYS H A 92 TYR HA 1.0 . 3.31 2064 1872 A 92 TYR HA A 66 LYS HG2 1.0 . 3.56 2065 1872 A 66 LYS HG3 A 92 TYR HA 1.0 . 3.56 2066 1873 A 100 SER H A 114 MET HA 1.0 . 3.69 2067 1874 A 114 MET HGx A 114 MET HA 1.0 . 3.60 2068 1875 A 114 MET HBx A 114 MET HA 1.0 . 3.00 2069 1876 A 113 THR HG2% A 114 MET HA 1.0 . 5.13 2070 1877 A 101 LEU H A 100 SER HA 1.0 . 2.86 2071 1878 A 87 ILE HG1y A 100 SER HA 1.0 . 5.09 2072 1879 A 87 ILE HG1x A 100 SER HA 1.0 . 4.26 2073 1880 A 87 ILE HG2% A 100 SER HA 1.0 . 4.22 2074 1881 A 88 ILE H A 100 SER HA 1.0 . 4.30 2075 1882 A 41 LYS HBx A 42 ASP HA 1.0 . 5.12 2076 1883 A 84 GLY H A 83 TYR HA 1.0 . 2.98 2077 1884 A 83 TYR HD% A 83 TYR HA 1.0 . 3.68 2078 1885 A 83 TYR HA A 76 GLN HG2 1.0 . 5.05 2079 1885 A 76 GLN HG3 A 83 TYR HA 1.0 . 5.05 2080 1886 A 80 ASN H A 79 ASP HA 1.0 . 3.56 2081 1887 A 3 ILE H A 2 GLU HA 1.0 . 2.55 2082 1888 A 5 LYS HA A 5 LYS HBy 1.0 . 2.91 2083 1889 A 5 LYS HA A 5 LYS HGx 1.0 . 3.47 2084 1890 A 66 LYS HA A 66 LYS HG2 1.0 . 3.18 2085 1890 A 66 LYS HG3 A 66 LYS HA 1.0 . 3.18 2086 1891 A 77 ILE H A 3 ILE HD1% 1.0 . 4.36 2087 1892 A 3 ILE H A 3 ILE HD1% 1.0 . 4.34 2088 1893 A 76 GLN HA A 3 ILE HD1% 1.0 . 5.50 2089 1894 A 3 ILE HA A 3 ILE HD1% 1.0 . 3.53 2090 1895 A 3 ILE HD1% A 76 GLN HG2 1.0 . 4.36 2091 1895 A 76 GLN HG3 A 3 ILE HD1% 1.0 . 4.36 2092 1896 A 3 ILE HB A 3 ILE HD1% 1.0 . 3.78 2093 1897 A 3 ILE HD1% A 3 ILE HG2% 1.0 . 3.06 2094 1898 A 92 TYR H A 91 LYS HA 1.0 . 2.79 2095 1899 A 79 ASP H A 78 LYS HA 1.0 . 3.46 2096 1900 A 77 ILE HG2% A 78 LYS HA 1.0 . 4.46 2097 1901 A 68 PHE H A 67 GLU HA 1.0 . 2.75 2098 1902 A 68 PHE HD% A 67 GLU HA 1.0 . 4.71 2099 1903 A 68 PHE HBx A 67 GLU HA 1.0 . 4.70 2100 1904 A 66 LYS HBx A 67 GLU HA 1.0 . 5.18 2101 1905 A 109 LEU HA A 40 THR HG2% 1.0 . 5.50 2102 1906 A 110 VAL H A 109 LEU HA 1.0 . 2.89 2103 1907 A 109 LEU HG A 109 LEU HA 1.0 . 4.07 2104 1908 A 109 LEU HA A 110 VAL HGy% 1.0 . 4.84 2105 1909 A 77 ILE H A 76 GLN HA 1.0 . 2.63 2106 1910 A 94 GLU HBy A 94 GLU HA 1.0 . 3.00 2107 1911 A 76 GLN HA A 3 ILE HA 1.0 . 3.82 2108 1912 A 94 GLU H A 62 GLN HA 1.0 . 4.41 2109 1913 A 62 GLN HE2x A 62 GLN HA 1.0 . 5.35 2110 1914 A 94 GLU HBx A 62 GLN HA 1.0 . 3.19 2111 1915 A 58 ILE HG2% A 62 GLN HA 1.0 . 5.41 2112 1916 A 82 LYS H A 81 LYS HA 1.0 . 2.66 2113 1917 A 48 THR H A 47 LEU HA 1.0 . 2.74 2114 1918 A 43 LEU HBx A 43 LEU HA 1.0 . 2.96 2115 1919 A 47 LEU HDy% A 47 LEU HA 1.0 . 4.52 2116 1920 A 6 GLU H A 74 LEU HA 1.0 . 3.67 2117 1921 A 20 ALA HA A 23 ASP H 1.0 . 3.91 2118 1922 A 20 ALA HA A 23 ASP HBy 1.0 . 3.59 2119 1923 A 20 ALA HA A 23 ASP HBx 1.0 . 4.57 2120 1924 A 20 ALA HA A 101 LEU HDy% 1.0 . 4.63 2121 1925 A 80 ASN HA A 80 ASN H 1.0 . 2.82 2122 1926 A 80 ASN HA A 80 ASN HBx 1.0 . 2.85 2123 1927 A 75 GLY H A 74 LEU HA 1.0 . 2.97 2124 1928 A 74 LEU HDx% A 74 LEU HA 1.0 . 4.05 2125 1929 A 101 LEU HA A 102 ALA HB% 1.0 . 4.95 2126 1930 A 103 TYR HBx A 107 MET HA 1.0 . 4.71 2127 1931 A 103 TYR HBy A 107 MET HA 1.0 . 3.49 2128 1932 A 7 LEU H A 6 GLU HA 1.0 . 2.88 2129 1933 A 73 TYR HBy A 6 GLU HA 1.0 . 4.10 2130 1934 A 6 GLU HA A 6 GLU HBx 1.0 . 2.94 2131 1934 A 6 GLU HA A 6 GLU HBy 1.0 . 2.94 2132 1935 A 73 TYR HBx A 6 GLU HA 1.0 . 4.08 2133 1936 A 38 ARG HA A 38 ARG HDy 1.0 . 3.38 2134 1937 A 5 LYS H A 4 LEU HA 1.0 . 2.76 2135 1938 A 6 GLU H A 4 LEU HA 1.0 . 4.76 2136 1939 A 8 PRO HDy A 7 LEU HA 1.0 . 3.11 2137 1940 A 75 GLY HAx A 7 LEU HA 1.0 . 4.37 2138 1941 A 8 PRO HDx A 7 LEU HA 1.0 . 3.40 2139 1942 A 7 LEU HA A 6 GLU HGy 1.0 . 5.50 2140 1943 A 7 LEU HG A 7 LEU HA 1.0 . 3.85 2141 1944 A 109 LEU H A 108 ASN HA 1.0 . 3.17 2142 1945 A 13 LYS H A 12 ASP HA 1.0 . 2.76 2143 1946 A 13 LYS HGy A 12 ASP HA 1.0 . 4.60 2144 1947 A 7 LEU HDx% A 12 ASP HA 1.0 . 4.40 2145 1948 A 32 TYR HE% A 31 ASP HA 1.0 . 4.60 2146 1949 A 104 ASP HA A 84 GLY H 1.0 . 4.94 2147 1950 A 104 ASP HA A 105 GLU H 1.0 . 3.29 2148 1951 A 104 ASP HA A 110 VAL HGy% 1.0 . 4.59 2149 1952 A 104 ASP HA A 110 VAL HGx% 1.0 . 5.07 2150 1953 A 96 ASN HA A 96 ASN HD2y 1.0 . 5.08 2151 1954 A 96 ASN HA A 97 VAL H 1.0 . 2.85 2152 1955 A 96 ASN HA A 91 LYS HA 1.0 . 3.27 2153 1956 A 96 ASN HA A 97 VAL HG2% 1.0 . 4.31 2154 1957 A 96 ASN HA A 97 VAL HB 1.0 . 4.77 2155 1958 A 99 TYR HBy A 98 ASN HA 1.0 . 4.49 2156 1959 A 99 TYR H A 98 ASN HA 1.0 . 2.87 2157 1960 A 90 VAL H A 98 ASN HA 1.0 . 3.96 2158 1961 A 103 TYR HBx A 102 ALA HA 1.0 . 4.89 2159 1962 A 103 TYR H A 102 ALA HA 1.0 . 2.90 2160 1963 A 86 VAL H A 102 ALA HA 1.0 . 3.93 2161 1964 A 85 GLY HAx A 102 ALA HA 1.0 . 3.56 2162 1965 A 102 ALA HA A 110 VAL HGx% 1.0 . 4.95 2163 1966 A 76 GLN HE2x A 102 ALA HA 1.0 . 4.87 2164 1967 A 7 LEU H A 8 PRO HDy 1.0 . 4.52 2165 1968 A 75 GLY HAx A 8 PRO HDy 1.0 . 4.15 2166 1969 A 4 LEU HD2% A 8 PRO HDy 1.0 . 5.50 2167 1970 A 75 GLY HAy A 8 PRO HDx 1.0 . 4.64 2168 1971 A 8 PRO HDx A 6 GLU HGy 1.0 . 4.65 2169 1972 A 76 GLN H A 8 PRO HDx 1.0 . 4.98 2170 1973 A 7 LEU H A 8 PRO HDx 1.0 . 4.67 2171 1974 A 7 LEU HDy% A 8 PRO HDx 1.0 . 4.45 2172 1975 A 7 LEU HDx% A 8 PRO HDx 1.0 . 5.13 2173 1976 A 8 PRO HDy A 6 GLU HGy 1.0 . 5.18 2174 1977 A 99 TYR HD% A 114 MET HBy 1.0 . 4.16 2175 1978 A 99 TYR HD% A 101 LEU HDy% 1.0 . 3.45 2176 1979 A 92 TYR HD% A 65 PHE H 1.0 . 3.41 2177 1980 A 92 TYR HD% A 92 TYR H 1.0 . 3.06 2178 1981 A 96 ASN HA A 92 TYR HD% 1.0 . 3.65 2179 1982 A 92 TYR HD% A 92 TYR HA 1.0 . 3.31 2180 1983 A 92 TYR HD% A 64 GLU HA 1.0 . 3.79 2181 1984 A 92 TYR HD% A 65 PHE HA 1.0 . 2.80 2182 1985 A 92 TYR HD% A 62 GLN HBy 1.0 . 3.59 2183 1986 A 92 TYR HD% A 90 VAL HGy% 1.0 . 3.46 2184 1987 A 55 TYR HD% A 114 MET HGy 1.0 . 3.85 2185 1988 A 99 TYR HD% A 114 MET HA 1.0 . 4.00 2186 1989 A 99 TYR HD% A 99 TYR H 1.0 . 2.97 2187 1990 A 99 TYR HD% A 99 TYR HA 1.0 . 3.25 2188 1991 A 99 TYR HD% A 90 VAL HGx% 1.0 . 2.69 2189 1992 A 99 TYR HD% A 24 ILE HD1% 1.0 . 3.77 2190 1993 A 55 TYR HD% A 56 LEU H 1.0 . 3.53 2191 1994 A 78 LYS H A 83 TYR HD% 1.0 . 3.59 2192 1995 A 83 TYR HD% A 83 TYR H 1.0 . 3.02 2193 1996 A 83 TYR HD% A 104 ASP HA 1.0 . 2.74 2194 1997 A 82 LYS HA A 83 TYR HD% 1.0 . 3.45 2195 1998 A 83 TYR HD% A 104 ASP HBy 1.0 . 3.69 2196 1999 A 83 TYR HD% A 110 VAL HGx% 1.0 . 2.88 2197 2000 A 73 TYR HD% A 16 VAL HB 1.0 . 4.49 2198 2001 A 73 TYR HD% A 13 LYS HGx 1.0 . 4.44 2199 2002 A 73 TYR HD% A 74 LEU H 1.0 . 3.63 2200 2003 A 73 TYR HD% A 73 TYR HA 1.0 . 3.02 2201 2004 A 73 TYR HD% A 86 VAL HB 1.0 . 3.54 2202 2005 A 73 TYR HD% A 7 LEU HG 1.0 . 3.69 2203 2006 A 7 LEU HDx% A 73 TYR HD% 1.0 . 3.42 2204 2007 A 32 TYR H A 32 TYR HD% 1.0 . 3.58 2205 2008 A 33 GLU H A 32 TYR HD% 1.0 . 3.67 2206 2009 A 32 TYR HD% A 33 GLU HG2 1.0 . 4.11 2207 2009 A 33 GLU HG3 A 32 TYR HD% 1.0 . 4.11 2208 2010 A 52 TYR HD% A 49 GLU HGx 1.0 . 4.56 2209 2011 A 52 TYR H A 52 TYR HD% 1.0 . 4.55 2210 2012 A 68 PHE HD% A 90 VAL HA 1.0 . 4.58 2211 2013 A 69 GLY H A 68 PHE HD% 1.0 . 3.90 2212 2014 A 112 PHE HD% A 112 PHE HA 1.0 . 3.21 2213 2015 A 112 PHE HD% A 113 THR HA 1.0 . 3.74 2214 2016 A 101 LEU HG A 112 PHE HD% 1.0 . 2.92 2215 2017 A 112 PHE HD% A 101 LEU HDx% 1.0 . 2.98 2216 2018 A 68 PHE HD% A 21 MET HE% 1.0 . 3.59 2217 2019 A 88 ILE HD1% A 68 PHE HD% 1.0 . 3.09 2218 2020 A 40 THR H A 39 PHE HD% 1.0 . 3.67 2219 2021 A 39 PHE HD% A 39 PHE HA 1.0 . 3.41 2220 2022 A 39 PHE HD% A 36 LYS HA 1.0 . 2.78 2221 2023 A 39 PHE HD% A 43 LEU HBy 1.0 . 3.78 2222 2024 A 39 PHE HD% A 43 LEU HBx 1.0 . 3.53 2223 2025 A 39 PHE HD% A 43 LEU HDy% 1.0 . 3.34 2224 2026 A 109 LEU H A 39 PHE HD% 1.0 . 4.46 2225 2027 A 11 PHE HDx A 11 PHE HA 1.0 . 4.03 2226 2028 A 25 GLU HGy A 68 PHE HE% 1.0 . 4.39 2227 2029 A 24 ILE HB A 68 PHE HE% 1.0 . 3.68 2228 2030 A 90 VAL HGx% A 68 PHE HE% 1.0 . 3.23 2229 2031 A 11 PHE HDx A 83 TYR HA 1.0 . 4.79 2230 2032 A 11 PHE HBy A 11 PHE HDx 1.0 . 3.50 2231 2033 A 21 MET HA A 68 PHE HE% 1.0 . 3.70 2232 2034 A 11 PHE HDy A 11 PHE HBx 1.0 . 3.23 2233 2035 A 65 PHE HA A 65 PHE HD% 1.0 . 3.31 2234 2036 A 90 VAL HGy% A 65 PHE HD% 1.0 . 2.80 2235 2037 A 66 LYS H A 65 PHE HD% 1.0 . 3.80 2236 2038 A 65 PHE HE% A 66 LYS H 1.0 . 4.44 2237 2039 A 68 PHE HD% A 65 PHE HE% 1.0 . 4.45 2238 2040 A 65 PHE HE% A 67 GLU HA 1.0 . 3.75 2239 2041 A 112 PHE HE% A 24 ILE HA 1.0 . 3.69 2240 2042 A 24 ILE HB A 68 PHE HZ 1.0 . 3.62 2241 2043 A 21 MET HA A 68 PHE HZ 1.0 . 3.62 2242 2044 A 25 GLU HGy A 68 PHE HZ 1.0 . 3.47 2243 2045 A 24 ILE HD1% A 68 PHE HZ 1.0 . 3.88 2244 2046 A 19 GLN HGx A 103 TYR HD% 1.0 . 4.45 2245 2047 A 84 GLY H A 103 TYR HD% 1.0 . 3.56 2246 2048 A 101 LEU HDx% A 112 PHE HE% 1.0 . 3.56 2247 2049 A 24 ILE HG1x A 112 PHE HE% 1.0 . 4.47 2248 2050 A 39 PHE HE% A 43 LEU HDy% 1.0 . 4.61 2249 2051 A 39 PHE HE% A 112 PHE HBx 1.0 . 4.19 2250 2052 A 39 PHE HE% A 109 LEU HDy% 1.0 . 3.48 2251 2053 A 39 PHE HE% A 47 LEU HDy% 1.0 . 4.06 2252 2054 A 39 PHE HE% A 112 PHE HBy 1.0 . 4.08 2253 2055 A 39 PHE HZ A 39 PHE HD% 1.0 . 4.20 2254 2056 A 112 PHE HBy A 39 PHE HZ 1.0 . 3.35 2255 2057 A 39 PHE HZ A 112 PHE HBx 1.0 . 3.43 2256 2058 A 26 ILE HG2% A 35 TRP HD1 1.0 . 3.81 2257 2059 A 47 LEU HDy% A 35 TRP HE3 1.0 . 4.70 2258 2060 A 92 TYR H A 92 TYR HE% 1.0 . 4.84 2259 2061 A 64 GLU HA A 92 TYR HE% 1.0 . 4.51 2260 2062 A 92 TYR HA A 92 TYR HE% 1.0 . 4.63 2261 2063 A 97 VAL H A 92 TYR HE% 1.0 . 4.31 2262 2064 A 73 TYR HE% A 17 ARG H 1.0 . 3.31 2263 2065 A 73 TYR HE% A 17 ARG HA 1.0 . 3.87 2264 2066 A 73 TYR HE% A 16 VAL HB 1.0 . 3.11 2265 2067 A 73 TYR HE% A 86 VAL HB 1.0 . 3.65 2266 2068 A 73 TYR HE% A 16 VAL HGx% 1.0 . 2.81 2267 2069 A 73 TYR HE% A 86 VAL HGy% 1.0 . 3.39 2268 2070 A 73 TYR HE% A 13 LYS HGx 1.0 . 4.15 2269 2071 A 65 PHE HA A 92 TYR HE% 1.0 . 3.55 2270 2072 A 92 TYR HE% A 97 VAL HB 1.0 . 2.78 2271 2073 A 97 VAL HG2% A 92 TYR HE% 1.0 . 2.61 2272 2074 A 90 VAL HGy% A 92 TYR HE% 1.0 . 2.81 2273 2075 A 65 PHE H A 92 TYR HE% 1.0 . 4.44 2274 2076 A 56 LEU HDy% A 55 TYR HE% 1.0 . 2.94 2275 2077 A 78 LYS H A 83 TYR HE% 1.0 . 3.37 2276 2078 A 83 TYR HE% A 82 LYS H 1.0 . 4.38 2277 2079 A 83 TYR HE% A 104 ASP HA 1.0 . 3.82 2278 2080 A 83 TYR HE% A 104 ASP HBy 1.0 . 3.25 2279 2081 A 83 TYR HE% A 81 LYS HBx 1.0 . 2.97 2280 2082 A 83 TYR HE% A 78 LYS HG2 1.0 . 3.46 2281 2082 A 78 LYS HG3 A 83 TYR HE% 1.0 . 3.46 2282 2083 A 83 TYR HE% A 110 VAL HGy% 1.0 . 2.68 2283 2084 A 83 TYR HE% A 110 VAL HGx% 1.0 . 3.11 2284 2085 A 32 TYR HE% A 30 LYS HA 1.0 . 3.67 2285 2086 A 52 TYR HE% A 49 GLU HA 1.0 . 3.53 2286 2087 A 20 ALA HA A 103 TYR HE% 1.0 . 4.17 2287 2088 A 103 TYR HE% A 20 ALA HB% 1.0 . 3.58 2288 2089 A 99 TYR HE% A 114 MET HA 1.0 . 5.47 2289 2090 A 99 TYR HE% A 24 ILE HA 1.0 . 4.39 2290 2091 A 99 TYR HE% A 24 ILE HG2% 1.0 . 3.36 stop_ save_