data_nef_c15419_2jtv save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 ALA middle . . 3 A 3 THR middle . . 4 A 4 ALA middle . . 5 A 5 ASP middle . . 6 A 6 ASP middle . . 7 A 7 PHE middle . . 8 A 8 LYS middle . . 9 A 9 LEU middle . . 10 A 10 ILE middle . . 11 A 11 ARG middle . . 12 A 12 ASP middle . . 13 A 13 ILE middle . . 14 A 14 HIS middle . . 15 A 15 SER middle . . 16 A 16 THR middle . . 17 A 17 GLY middle . false 18 A 18 GLY middle . false 19 A 19 ARG middle . . 20 A 20 ARG middle . . 21 A 21 GLN middle . . 22 A 22 VAL middle . . 23 A 23 PHE middle . . 24 A 24 GLY middle . false 25 A 25 SER middle . . 26 A 26 ARG middle . . 27 A 27 GLU middle . . 28 A 28 GLN middle . . 29 A 29 LYS middle . . 30 A 30 PRO middle . false 31 A 31 PHE middle . . 32 A 32 GLU middle . . 33 A 33 ASP middle . . 34 A 34 LEU middle . . 35 A 35 VAL middle . . 36 A 36 ASP middle . . 37 A 37 LEU middle . . 38 A 38 GLY middle . false 39 A 39 TRP middle . . 40 A 40 LEU middle . . 41 A 41 LYS middle . . 42 A 42 ARG middle . . 43 A 43 SER middle . . 44 A 44 SER middle . . 45 A 45 VAL middle . . 46 A 46 ASP middle . . 47 A 47 SER middle . . 48 A 48 ARG middle . . 49 A 49 ALA middle . . 50 A 50 THR middle . . 51 A 51 HIS middle . . 52 A 52 TYR middle . . 53 A 53 GLN middle . . 54 A 54 ILE middle . . 55 A 55 THR middle . . 56 A 56 GLU middle . . 57 A 57 ARG middle . . 58 A 58 GLY middle . false 59 A 59 THR middle . . 60 A 60 SER middle . . 61 A 61 ALA middle . . 62 A 62 ALA middle . . 63 A 63 LEU middle . . 64 A 64 ARG middle . . 65 A 65 SER 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 1 MET HA H 1 4.337 0.000 A 1 MET HBy H 1 1.904 0.000 A 1 MET HBx H 1 1.769 0.000 A 1 MET HGx H 1 2.330 0.000 A 1 MET HGy H 1 2.390 0.000 A 1 MET C C 13 175.265 0.000 A 1 MET CA C 13 54.910 0.000 A 1 MET CB C 13 32.840 0.000 A 1 MET CG C 13 31.772 0.000 A 2 ALA H H 1 7.839 0.000 A 2 ALA HA H 1 4.249 0.000 A 2 ALA HB% H 1 1.076 0.000 A 2 ALA C C 13 177.886 0.000 A 2 ALA CA C 13 51.662 0.000 A 2 ALA CB C 13 21.824 0.000 A 2 ALA N N 15 124.732 0.000 A 3 THR H H 1 9.861 0.000 A 3 THR HA H 1 4.716 0.000 A 3 THR HB H 1 4.576 0.000 A 3 THR HG2% H 1 1.157 0.000 A 3 THR CA C 13 59.963 0.000 A 3 THR CB C 13 72.420 0.000 A 3 THR CG2 C 13 21.258 0.000 A 3 THR N N 15 115.398 0.000 A 4 ALA HA H 1 4.314 0.000 A 4 ALA HB% H 1 1.429 0.000 A 4 ALA C C 13 181.099 0.000 A 4 ALA CA C 13 55.658 0.000 A 4 ALA CB C 13 17.975 0.000 A 5 ASP H H 1 8.033 0.000 A 5 ASP HA H 1 4.356 0.000 A 5 ASP HBx H 1 2.366 0.000 A 5 ASP HBy H 1 2.587 0.000 A 5 ASP C C 13 178.825 0.000 A 5 ASP CA C 13 57.218 0.000 A 5 ASP CB C 13 40.052 0.000 A 5 ASP N N 15 117.788 0.000 A 6 ASP H H 1 7.740 0.000 A 6 ASP HA H 1 4.255 0.000 A 6 ASP HBy H 1 2.739 0.000 A 6 ASP HBx H 1 2.028 0.000 A 6 ASP C C 13 178.412 0.000 A 6 ASP CA C 13 58.018 0.000 A 6 ASP CB C 13 39.982 0.000 A 6 ASP N N 15 124.628 0.000 A 7 PHE H H 1 7.782 0.000 A 7 PHE HA H 1 4.221 0.000 A 7 PHE HBy H 1 3.003 0.000 A 7 PHE HBx H 1 2.922 0.000 A 7 PHE HD1 H 1 7.150 0.000 A 7 PHE HD2 H 1 7.150 0.000 A 7 PHE C C 13 178.086 0.000 A 7 PHE CA C 13 62.281 0.000 A 7 PHE CB C 13 39.370 0.000 A 7 PHE CD1 C 13 131.500 0.000 A 7 PHE N N 15 117.093 0.000 A 8 LYS H H 1 7.986 0.000 A 8 LYS HA H 1 3.894 0.000 A 8 LYS HBx H 1 1.892 0.000 A 8 LYS HBy H 1 1.892 0.000 A 8 LYS HDx H 1 1.638 0.000 A 8 LYS HDy H 1 1.638 0.000 A 8 LYS HEx H 1 2.886 0.000 A 8 LYS HEy H 1 2.886 0.000 A 8 LYS HGy H 1 1.519 0.000 A 8 LYS HGx H 1 1.327 0.000 A 8 LYS C C 13 179.207 0.000 A 8 LYS CA C 13 59.926 0.000 A 8 LYS CB C 13 32.460 0.000 A 8 LYS CD C 13 29.149 0.000 A 8 LYS CE C 13 41.694 0.000 A 8 LYS CG C 13 25.013 0.000 A 8 LYS N N 15 119.065 0.000 A 9 LEU H H 1 7.811 0.000 A 9 LEU HA H 1 4.251 0.000 A 9 LEU HBx H 1 1.344 0.000 A 9 LEU HBy H 1 1.778 0.000 A 9 LEU HDx% H 1 -0.147 0.000 A 9 LEU HDy% H 1 0.732 0.000 A 9 LEU HG H 1 1.059 0.000 A 9 LEU C C 13 178.959 0.000 A 9 LEU CA C 13 57.122 0.000 A 9 LEU CB C 13 40.612 0.000 A 9 LEU CD1 C 13 24.462 0.000 A 9 LEU CD2 C 13 22.144 0.000 A 9 LEU CG C 13 26.679 0.000 A 9 LEU N N 15 120.318 0.000 A 10 ILE H H 1 8.531 0.000 A 10 ILE HA H 1 4.192 0.000 A 10 ILE HB H 1 1.932 0.000 A 10 ILE HD1% H 1 1.015 0.000 A 10 ILE HG1x H 1 1.244 0.000 A 10 ILE HG1y H 1 1.244 0.000 A 10 ILE HG2% H 1 0.821 0.000 A 10 ILE C C 13 177.285 0.000 A 10 ILE CA C 13 59.986 0.000 A 10 ILE CB C 13 37.717 0.000 A 10 ILE CD1 C 13 15.854 0.000 A 10 ILE CG1 C 13 29.611 0.000 A 10 ILE CG2 C 13 19.960 0.000 A 10 ILE N N 15 119.769 0.000 A 11 ARG H H 1 7.790 0.000 A 11 ARG HA H 1 3.960 0.000 A 11 ARG HBx H 1 1.899 0.000 A 11 ARG HBy H 1 1.899 0.000 A 11 ARG HDx H 1 3.176 0.000 A 11 ARG HDy H 1 3.176 0.000 A 11 ARG C C 13 178.855 0.000 A 11 ARG CA C 13 60.424 0.000 A 11 ARG CB C 13 29.810 0.000 A 11 ARG CD C 13 43.769 0.000 A 11 ARG N N 15 122.700 0.000 A 12 ASP H H 1 7.785 0.000 A 12 ASP HA H 1 4.347 0.000 A 12 ASP HBy H 1 2.981 0.000 A 12 ASP HBx H 1 2.837 0.000 A 12 ASP C C 13 179.164 0.000 A 12 ASP CA C 13 57.699 0.000 A 12 ASP CB C 13 41.639 0.000 A 12 ASP N N 15 122.254 0.000 A 13 ILE H H 1 8.517 0.000 A 13 ILE HA H 1 3.545 0.000 A 13 ILE HB H 1 1.755 0.000 A 13 ILE HD1% H 1 0.771 0.000 A 13 ILE HG1x H 1 1.910 0.000 A 13 ILE HG1y H 1 1.910 0.000 A 13 ILE HG2% H 1 0.604 0.000 A 13 ILE C C 13 178.701 0.000 A 13 ILE CA C 13 65.052 0.000 A 13 ILE CB C 13 38.512 0.000 A 13 ILE CD1 C 13 16.167 0.000 A 13 ILE CG1 C 13 29.029 0.000 A 13 ILE CG2 C 13 16.321 0.000 A 13 ILE N N 15 120.373 0.000 A 14 HIS H H 1 8.752 0.000 A 14 HIS HA H 1 3.834 0.000 A 14 HIS HBx H 1 2.794 0.000 A 14 HIS HBy H 1 3.111 0.000 A 14 HIS HD2 H 1 6.881 0.000 A 14 HIS HE1 H 1 7.529 0.000 A 14 HIS C C 13 178.103 0.000 A 14 HIS CA C 13 61.065 0.000 A 14 HIS CB C 13 31.493 0.000 A 14 HIS CD2 C 13 118.300 0.000 A 14 HIS CE1 C 13 138.670 0.000 A 14 HIS N N 15 121.039 0.000 A 15 SER H H 1 8.203 0.000 A 15 SER HA H 1 4.144 0.000 A 15 SER HBx H 1 4.078 0.000 A 15 SER HBy H 1 4.078 0.000 A 15 SER C C 13 175.187 0.000 A 15 SER CA C 13 60.870 0.000 A 15 SER CB C 13 63.316 0.000 A 15 SER N N 15 113.630 0.000 A 16 THR H H 1 7.521 0.000 A 16 THR HA H 1 4.641 0.000 A 16 THR HB H 1 4.647 0.000 A 16 THR HG2% H 1 1.142 0.000 A 16 THR C C 13 175.869 0.000 A 16 THR CA C 13 60.149 0.000 A 16 THR CB C 13 68.706 0.000 A 16 THR CG2 C 13 20.689 0.000 A 16 THR N N 15 111.008 0.000 A 17 GLY H H 1 7.465 0.000 A 17 GLY HAy H 1 4.299 0.000 A 17 GLY HAx H 1 3.660 0.000 A 17 GLY C C 13 175.544 0.000 A 17 GLY CA C 13 45.712 0.000 A 17 GLY N N 15 108.045 0.000 A 18 GLY H H 1 8.288 0.000 A 18 GLY HAy H 1 4.228 0.000 A 18 GLY HAx H 1 3.129 0.000 A 18 GLY C C 13 171.562 0.000 A 18 GLY CA C 13 46.216 0.000 A 18 GLY N N 15 106.635 0.000 A 19 ARG H H 1 7.460 0.000 A 19 ARG HA H 1 5.353 0.000 A 19 ARG HBy H 1 1.843 0.000 A 19 ARG HBx H 1 1.655 0.000 A 19 ARG HDx H 1 3.080 0.000 A 19 ARG HDy H 1 3.080 0.000 A 19 ARG HGx H 1 1.532 0.000 A 19 ARG HGy H 1 1.532 0.000 A 19 ARG C C 13 175.548 0.000 A 19 ARG CA C 13 54.081 0.000 A 19 ARG CB C 13 34.053 0.000 A 19 ARG CD C 13 43.834 0.000 A 19 ARG CG C 13 27.272 0.000 A 19 ARG N N 15 116.509 0.000 A 20 ARG H H 1 8.392 0.000 A 20 ARG HA H 1 4.444 0.000 A 20 ARG HBx H 1 1.352 0.000 A 20 ARG HBy H 1 1.635 0.000 A 20 ARG HDy H 1 3.426 0.000 A 20 ARG HDx H 1 3.180 0.000 A 20 ARG HGx H 1 1.352 0.000 A 20 ARG HGy H 1 1.352 0.000 A 20 ARG C C 13 173.006 0.000 A 20 ARG CA C 13 54.936 0.000 A 20 ARG CB C 13 33.730 0.000 A 20 ARG CD C 13 41.511 0.000 A 20 ARG CG C 13 26.159 0.000 A 20 ARG N N 15 120.670 0.000 A 21 GLN H H 1 8.601 0.000 A 21 GLN HA H 1 4.566 0.000 A 21 GLN HBx H 1 1.346 0.000 A 21 GLN HBy H 1 1.631 0.000 A 21 GLN HE2x H 1 6.703 0.000 A 21 GLN HE2y H 1 6.821 0.000 A 21 GLN HGx H 1 1.129 0.000 A 21 GLN HGy H 1 1.250 0.000 A 21 GLN C C 13 174.345 0.000 A 21 GLN CA C 13 54.339 0.000 A 21 GLN CB C 13 29.704 0.000 A 21 GLN CG C 13 33.353 0.000 A 21 GLN N N 15 128.055 0.000 A 21 GLN NE2 N 15 111.310 0.000 A 22 VAL H H 1 8.585 0.000 A 22 VAL HA H 1 4.053 0.000 A 22 VAL HB H 1 1.674 0.000 A 22 VAL HGx% H 1 0.594 0.000 A 22 VAL HGy% H 1 -0.294 0.000 A 22 VAL C C 13 175.246 0.000 A 22 VAL CA C 13 61.461 0.000 A 22 VAL CB C 13 34.346 0.000 A 22 VAL CG1 C 13 21.146 0.000 A 22 VAL CG2 C 13 19.410 0.000 A 22 VAL N N 15 125.840 0.000 A 23 PHE H H 1 8.864 0.000 A 23 PHE HA H 1 4.679 0.000 A 23 PHE HBx H 1 2.915 0.000 A 23 PHE HBy H 1 2.915 0.000 A 23 PHE HD1 H 1 7.120 0.000 A 23 PHE HD2 H 1 7.120 0.000 A 23 PHE C C 13 175.976 0.000 A 23 PHE CA C 13 57.467 0.000 A 23 PHE CB C 13 40.231 0.000 A 23 PHE CD1 C 13 129.800 0.000 A 23 PHE N N 15 129.446 0.000 A 24 GLY H H 1 7.950 0.000 A 24 GLY HAx H 1 3.675 0.000 A 24 GLY HAy H 1 4.494 0.000 A 24 GLY CA C 13 44.745 0.000 A 24 GLY N N 15 110.590 0.000 A 26 ARG HA H 1 4.062 0.000 A 26 ARG HBx H 1 1.791 0.000 A 26 ARG HBy H 1 1.791 0.000 A 26 ARG HDx H 1 3.140 0.000 A 26 ARG HDy H 1 3.140 0.000 A 26 ARG HGx H 1 1.590 0.000 A 26 ARG HGy H 1 1.590 0.000 A 26 ARG C C 13 178.778 0.000 A 26 ARG CA C 13 58.712 0.000 A 26 ARG CB C 13 29.631 0.000 A 26 ARG CD C 13 43.337 0.000 A 26 ARG CG C 13 26.867 0.000 A 27 GLU H H 1 8.965 0.000 A 27 GLU HA H 1 4.005 0.000 A 27 GLU HBx H 1 1.963 0.000 A 27 GLU HBy H 1 2.060 0.000 A 27 GLU HGy H 1 2.446 0.000 A 27 GLU HGx H 1 2.296 0.000 A 27 GLU C C 13 177.966 0.000 A 27 GLU CA C 13 58.507 0.000 A 27 GLU CB C 13 29.105 0.000 A 27 GLU CG C 13 37.569 0.000 A 27 GLU N N 15 119.937 0.000 A 28 GLN H H 1 7.660 0.000 A 28 GLN HA H 1 4.064 0.000 A 28 GLN HBx H 1 1.983 0.000 A 28 GLN HBy H 1 2.277 0.000 A 28 GLN HE2y H 1 7.070 0.000 A 28 GLN HE2x H 1 6.430 0.000 A 28 GLN HGx H 1 2.507 0.000 A 28 GLN HGy H 1 2.507 0.000 A 28 GLN C C 13 177.886 0.000 A 28 GLN CA C 13 57.357 0.000 A 28 GLN CB C 13 28.068 0.000 A 28 GLN CG C 13 33.400 0.000 A 28 GLN N N 15 114.224 0.000 A 28 GLN NE2 N 15 109.180 0.000 A 29 LYS H H 1 7.490 0.000 A 29 LYS HA H 1 4.054 0.000 A 29 LYS HBx H 1 1.918 0.000 A 29 LYS HBy H 1 1.918 0.000 A 29 LYS HDx H 1 1.643 0.000 A 29 LYS HDy H 1 1.643 0.000 A 29 LYS HEx H 1 2.861 0.000 A 29 LYS HEy H 1 2.861 0.000 A 29 LYS HGx H 1 1.389 0.000 A 29 LYS HGy H 1 1.389 0.000 A 29 LYS CA C 13 61.743 0.000 A 29 LYS CB C 13 29.810 0.000 A 29 LYS CD C 13 28.144 0.000 A 29 LYS CE C 13 42.037 0.000 A 29 LYS CG C 13 24.898 0.000 A 29 LYS N N 15 120.982 0.000 A 30 PRO HA H 1 4.149 0.000 A 30 PRO HBx H 1 1.091 0.000 A 30 PRO HBy H 1 1.958 0.000 A 30 PRO HDy H 1 3.754 0.000 A 30 PRO HDx H 1 3.467 0.000 A 30 PRO HGx H 1 1.767 0.000 A 30 PRO HGy H 1 1.767 0.000 A 30 PRO C C 13 178.770 0.000 A 30 PRO CA C 13 65.483 0.000 A 30 PRO CB C 13 30.772 0.000 A 30 PRO CD C 13 49.103 0.000 A 30 PRO CG C 13 27.956 0.000 A 31 PHE H H 1 6.910 0.000 A 31 PHE HA H 1 3.350 0.000 A 31 PHE HBx H 1 1.130 0.000 A 31 PHE HBy H 1 2.675 0.000 A 31 PHE HD1 H 1 6.761 0.000 A 31 PHE HD2 H 1 6.761 0.000 A 31 PHE HE1 H 1 7.060 0.000 A 31 PHE HE2 H 1 7.060 0.000 A 31 PHE C C 13 178.236 0.000 A 31 PHE CA C 13 60.679 0.000 A 31 PHE CB C 13 36.793 0.000 A 31 PHE CD1 C 13 131.700 0.000 A 31 PHE CE1 C 13 132.100 0.000 A 31 PHE N N 15 115.490 0.000 A 32 GLU H H 1 8.306 0.000 A 32 GLU HA H 1 3.762 0.000 A 32 GLU HBx H 1 2.107 0.000 A 32 GLU HBy H 1 2.107 0.000 A 32 GLU HGx H 1 2.365 0.000 A 32 GLU HGy H 1 2.365 0.000 A 32 GLU C C 13 179.561 0.000 A 32 GLU CA C 13 59.110 0.000 A 32 GLU CB C 13 28.903 0.000 A 32 GLU CG C 13 36.762 0.000 A 32 GLU N N 15 121.578 0.000 A 33 ASP H H 1 8.150 0.000 A 33 ASP HA H 1 4.125 0.000 A 33 ASP HBy H 1 2.527 0.000 A 33 ASP HBx H 1 2.338 0.000 A 33 ASP C C 13 178.981 0.000 A 33 ASP CA C 13 57.270 0.000 A 33 ASP CB C 13 38.851 0.000 A 33 ASP N N 15 119.784 0.000 A 34 LEU H H 1 6.899 0.000 A 34 LEU HA H 1 3.712 0.000 A 34 LEU HBx H 1 1.163 0.000 A 34 LEU HBy H 1 2.135 0.000 A 34 LEU HDx% H 1 0.708 0.000 A 34 LEU HDy% H 1 0.696 0.000 A 34 LEU C C 13 180.344 0.000 A 34 LEU CA C 13 57.026 0.000 A 34 LEU CB C 13 40.485 0.000 A 34 LEU CD1 C 13 26.456 0.000 A 34 LEU CD2 C 13 23.610 0.000 A 34 LEU N N 15 117.948 0.000 A 35 VAL H H 1 8.107 0.000 A 35 VAL HA H 1 4.145 0.000 A 35 VAL HB H 1 2.454 0.000 A 35 VAL HGx% H 1 0.979 0.000 A 35 VAL HGy% H 1 0.966 0.000 A 35 VAL C C 13 181.352 0.000 A 35 VAL CA C 13 65.326 0.000 A 35 VAL CB C 13 30.779 0.000 A 35 VAL CG1 C 13 21.066 0.000 A 35 VAL CG2 C 13 23.059 0.000 A 35 VAL N N 15 124.516 0.000 A 36 ASP H H 1 8.079 0.000 A 36 ASP HA H 1 4.273 0.000 A 36 ASP HBx H 1 2.457 0.000 A 36 ASP HBy H 1 2.622 0.000 A 36 ASP C C 13 178.246 0.000 A 36 ASP CA C 13 57.402 0.000 A 36 ASP CB C 13 39.537 0.000 A 36 ASP N N 15 123.125 0.000 A 37 LEU H H 1 6.679 0.000 A 37 LEU HA H 1 3.806 0.000 A 37 LEU HBx H 1 -0.045 0.000 A 37 LEU HBy H 1 0.686 0.000 A 37 LEU HDx% H 1 -0.610 0.000 A 37 LEU HDy% H 1 0.204 0.000 A 37 LEU HG H 1 1.139 0.000 A 37 LEU C C 13 177.064 0.000 A 37 LEU CA C 13 55.439 0.000 A 37 LEU CB C 13 42.020 0.000 A 37 LEU CD1 C 13 23.624 0.000 A 37 LEU CD2 C 13 22.159 0.000 A 37 LEU CG C 13 25.723 0.000 A 37 LEU N N 15 116.926 0.000 A 38 GLY H H 1 8.070 0.000 A 38 GLY HAy H 1 4.099 0.000 A 38 GLY HAx H 1 3.944 0.000 A 38 GLY C C 13 176.471 0.000 A 38 GLY CA C 13 44.656 0.000 A 38 GLY N N 15 105.805 0.000 A 39 TRP H H 1 8.143 0.000 A 39 TRP HA H 1 4.358 0.000 A 39 TRP HBx H 1 3.012 0.000 A 39 TRP HBy H 1 3.157 0.000 A 39 TRP HD1 H 1 6.140 0.000 A 39 TRP HE1 H 1 9.870 0.000 A 39 TRP HE3 H 1 6.930 0.000 A 39 TRP HH2 H 1 5.110 0.000 A 39 TRP HZ2 H 1 6.860 0.000 A 39 TRP HZ3 H 1 5.960 0.000 A 39 TRP C C 13 174.515 0.000 A 39 TRP CA C 13 56.279 0.000 A 39 TRP CB C 13 30.866 0.000 A 39 TRP CD1 C 13 122.100 0.000 A 39 TRP CE3 C 13 119.400 0.000 A 39 TRP CH2 C 13 125.700 0.000 A 39 TRP CZ2 C 13 113.900 0.000 A 39 TRP CZ3 C 13 120.500 0.000 A 39 TRP N N 15 122.115 0.000 A 39 TRP NE1 N 15 126.987 0.000 A 40 LEU H H 1 7.005 0.000 A 40 LEU HA H 1 5.133 0.000 A 40 LEU HBx H 1 1.354 0.000 A 40 LEU HBy H 1 1.354 0.000 A 40 LEU HDx% H 1 0.831 0.000 A 40 LEU HDy% H 1 0.858 0.000 A 40 LEU HG H 1 1.459 0.000 A 40 LEU C C 13 174.780 0.000 A 40 LEU CA C 13 52.286 0.000 A 40 LEU CB C 13 48.426 0.000 A 40 LEU CD1 C 13 26.922 0.000 A 40 LEU CD2 C 13 23.496 0.000 A 40 LEU CG C 13 26.922 0.000 A 40 LEU N N 15 115.111 0.000 A 41 LYS H H 1 9.290 0.000 A 41 LYS HA H 1 4.699 0.000 A 41 LYS HBx H 1 1.623 0.000 A 41 LYS HBy H 1 1.680 0.000 A 41 LYS HDx H 1 1.535 0.000 A 41 LYS HDy H 1 1.535 0.000 A 41 LYS HEx H 1 2.795 0.000 A 41 LYS HEy H 1 2.795 0.000 A 41 LYS HGy H 1 1.269 0.000 A 41 LYS HGx H 1 1.127 0.000 A 41 LYS C C 13 175.147 0.000 A 41 LYS CA C 13 54.252 0.000 A 41 LYS CB C 13 35.576 0.000 A 41 LYS CD C 13 29.480 0.000 A 41 LYS CE C 13 42.131 0.000 A 41 LYS CG C 13 24.311 0.000 A 41 LYS N N 15 119.776 0.000 A 42 ARG H H 1 9.039 0.000 A 42 ARG HA H 1 4.469 0.000 A 42 ARG HBy H 1 1.613 0.000 A 42 ARG HBx H 1 1.354 0.000 A 42 ARG HDx H 1 3.003 0.000 A 42 ARG HDy H 1 3.003 0.000 A 42 ARG HGy H 1 1.343 0.000 A 42 ARG HGx H 1 1.139 0.000 A 42 ARG C C 13 175.690 0.000 A 42 ARG CA C 13 55.166 0.000 A 42 ARG CB C 13 29.947 0.000 A 42 ARG CD C 13 42.756 0.000 A 42 ARG CG C 13 27.835 0.000 A 42 ARG N N 15 123.160 0.000 A 43 SER H H 1 8.924 0.000 A 43 SER HA H 1 4.253 0.000 A 43 SER HBx H 1 3.609 0.000 A 43 SER HBy H 1 3.609 0.000 A 43 SER CA C 13 59.259 0.000 A 43 SER CB C 13 63.841 0.000 A 43 SER N N 15 122.718 0.000 A 44 SER HA H 1 4.365 0.000 A 44 SER HBx H 1 3.548 0.000 A 44 SER HBy H 1 3.548 0.000 A 44 SER C C 13 172.346 0.000 A 44 SER CA C 13 58.364 0.000 A 44 SER CB C 13 63.854 0.000 A 45 VAL H H 1 8.295 0.000 A 45 VAL HA H 1 4.327 0.000 A 45 VAL HB H 1 1.789 0.000 A 45 VAL HGy% H 1 0.731 0.000 A 45 VAL C C 13 174.778 0.000 A 45 VAL CA C 13 62.123 0.000 A 45 VAL CB C 13 34.466 0.000 A 45 VAL CG2 C 13 20.780 0.000 A 45 VAL N N 15 122.881 0.000 A 46 ASP H H 1 8.488 0.000 A 46 ASP HA H 1 4.701 0.000 A 46 ASP HBy H 1 2.948 0.000 A 46 ASP HBx H 1 2.644 0.000 A 46 ASP CA C 13 52.840 0.000 A 46 ASP CB C 13 42.300 0.000 A 46 ASP N N 15 125.470 0.000 A 48 ARG HA H 1 4.357 0.000 A 48 ARG HBx H 1 1.823 0.000 A 48 ARG HBy H 1 1.823 0.000 A 48 ARG HDx H 1 3.137 0.000 A 48 ARG HDy H 1 3.137 0.000 A 48 ARG HGx H 1 1.560 0.000 A 48 ARG HGy H 1 1.560 0.000 A 48 ARG C C 13 175.740 0.000 A 48 ARG CA C 13 56.701 0.000 A 48 ARG CB C 13 31.563 0.000 A 48 ARG CD C 13 42.904 0.000 A 48 ARG CG C 13 27.296 0.000 A 49 ALA H H 1 8.183 0.000 A 49 ALA HA H 1 4.527 0.000 A 49 ALA HB% H 1 0.487 0.000 A 49 ALA C C 13 175.801 0.000 A 49 ALA CA C 13 51.380 0.000 A 49 ALA CB C 13 21.807 0.000 A 49 ALA N N 15 121.599 0.000 A 50 THR H H 1 7.845 0.000 A 50 THR HA H 1 4.425 0.000 A 50 THR HB H 1 3.529 0.000 A 50 THR HG2% H 1 0.376 0.000 A 50 THR C C 13 171.709 0.000 A 50 THR CA C 13 61.787 0.000 A 50 THR CB C 13 70.971 0.000 A 50 THR CG2 C 13 21.073 0.000 A 50 THR N N 15 116.118 0.000 A 51 HIS H H 1 8.543 0.000 A 51 HIS HA H 1 4.759 0.000 A 51 HIS HBx H 1 2.761 0.000 A 51 HIS HBy H 1 2.835 0.000 A 51 HIS HD2 H 1 6.497 0.000 A 51 HIS C C 13 174.147 0.000 A 51 HIS CA C 13 55.049 0.000 A 51 HIS CB C 13 32.181 0.000 A 51 HIS CD2 C 13 118.800 0.000 A 51 HIS N N 15 126.129 0.000 A 52 TYR H H 1 8.889 0.000 A 52 TYR HA H 1 5.247 0.000 A 52 TYR HBy H 1 2.850 0.000 A 52 TYR HBx H 1 2.559 0.000 A 52 TYR HD1 H 1 6.490 0.000 A 52 TYR HD2 H 1 6.490 0.000 A 52 TYR HE1 H 1 6.254 0.000 A 52 TYR HE2 H 1 6.254 0.000 A 52 TYR C C 13 175.581 0.000 A 52 TYR CA C 13 57.004 0.000 A 52 TYR CB C 13 42.441 0.000 A 52 TYR CD1 C 13 133.200 0.000 A 52 TYR CE1 C 13 117.700 0.000 A 52 TYR N N 15 121.031 0.000 A 53 GLN H H 1 9.011 0.000 A 53 GLN HA H 1 5.204 0.000 A 53 GLN HBy H 1 1.923 0.000 A 53 GLN HBx H 1 1.779 0.000 A 53 GLN HGx H 1 2.236 0.000 A 53 GLN HGy H 1 2.408 0.000 A 53 GLN C C 13 174.440 0.000 A 53 GLN CA C 13 53.587 0.000 A 53 GLN CB C 13 32.695 0.000 A 53 GLN CG C 13 33.139 0.000 A 53 GLN N N 15 121.155 0.000 A 54 ILE H H 1 8.990 0.000 A 54 ILE HA H 1 4.644 0.000 A 54 ILE HB H 1 1.467 0.000 A 54 ILE HD1% H 1 0.766 0.000 A 54 ILE HG2% H 1 0.942 0.000 A 54 ILE C C 13 174.026 0.000 A 54 ILE CA C 13 63.057 0.000 A 54 ILE CB C 13 40.533 0.000 A 54 ILE CD1 C 13 15.330 0.000 A 54 ILE CG2 C 13 16.926 0.000 A 54 ILE N N 15 128.036 0.000 A 55 THR H H 1 7.451 0.000 A 55 THR HA H 1 4.759 0.000 A 55 THR HB H 1 4.819 0.000 A 55 THR HG2% H 1 0.973 0.000 A 55 THR CA C 13 59.238 0.000 A 55 THR CB C 13 71.938 0.000 A 55 THR CG2 C 13 21.286 0.000 A 55 THR N N 15 115.743 0.000 A 57 ARG HA H 1 3.964 0.000 A 57 ARG HBx H 1 1.716 0.000 A 57 ARG HBy H 1 1.918 0.000 A 57 ARG HDx H 1 3.216 0.000 A 57 ARG HDy H 1 3.355 0.000 A 57 ARG HGx H 1 1.641 0.000 A 57 ARG HGy H 1 1.641 0.000 A 57 ARG C C 13 179.298 0.000 A 57 ARG CA C 13 58.910 0.000 A 57 ARG CB C 13 30.483 0.000 A 57 ARG CD C 13 43.589 0.000 A 57 ARG CG C 13 27.513 0.000 A 58 GLY H H 1 8.163 0.000 A 58 GLY HAx H 1 2.994 0.000 A 58 GLY HAy H 1 4.154 0.000 A 58 GLY C C 13 174.512 0.000 A 58 GLY CA C 13 46.239 0.000 A 58 GLY N N 15 109.761 0.000 A 59 THR H H 1 8.649 0.000 A 59 THR HA H 1 3.388 0.000 A 59 THR HB H 1 4.120 0.000 A 59 THR HG2% H 1 1.047 0.000 A 59 THR C C 13 175.246 0.000 A 59 THR CA C 13 67.397 0.000 A 59 THR CB C 13 68.146 0.000 A 59 THR CG2 C 13 21.759 0.000 A 59 THR N N 15 121.599 0.000 A 60 SER H H 1 7.591 0.000 A 60 SER HBx H 1 3.704 0.000 A 60 SER HBy H 1 3.763 0.000 A 60 SER C C 13 176.577 0.000 A 60 SER CB C 13 62.271 0.000 A 60 SER N N 15 114.659 0.000 A 61 ALA H H 1 7.216 0.000 A 61 ALA HA H 1 3.644 0.000 A 61 ALA HB% H 1 -0.051 0.000 A 61 ALA C C 13 178.844 0.000 A 61 ALA CA C 13 54.526 0.000 A 61 ALA CB C 13 16.264 0.000 A 61 ALA N N 15 123.377 0.000 A 62 ALA H H 1 7.758 0.000 A 62 ALA HA H 1 3.654 0.000 A 62 ALA HB% H 1 1.019 0.000 A 62 ALA C C 13 178.705 0.000 A 62 ALA CA C 13 53.921 0.000 A 62 ALA CB C 13 18.241 0.000 A 62 ALA N N 15 118.496 0.000 A 63 LEU H H 1 7.340 0.000 A 63 LEU HA H 1 4.003 0.000 A 63 LEU HBy H 1 1.472 0.000 A 63 LEU HBx H 1 1.388 0.000 A 63 LEU HDx% H 1 0.597 0.000 A 63 LEU HDy% H 1 0.575 0.000 A 63 LEU HG H 1 1.350 0.000 A 63 LEU C C 13 177.629 0.000 A 63 LEU CA C 13 54.817 0.000 A 63 LEU CB C 13 42.239 0.000 A 63 LEU CD1 C 13 25.033 0.000 A 63 LEU CD2 C 13 22.117 0.000 A 63 LEU CG C 13 25.767 0.000 A 63 LEU N N 15 115.855 0.000 A 64 ARG H H 1 7.257 0.000 A 64 ARG HA H 1 4.071 0.000 A 64 ARG HBx H 1 1.710 0.000 A 64 ARG HBy H 1 1.710 0.000 A 64 ARG HDx H 1 2.929 0.000 A 64 ARG HDy H 1 2.929 0.000 A 64 ARG HGx H 1 1.537 0.000 A 64 ARG HGy H 1 1.537 0.000 A 64 ARG C C 13 175.442 0.000 A 64 ARG CA C 13 56.599 0.000 A 64 ARG CB C 13 30.078 0.000 A 64 ARG CD C 13 43.178 0.000 A 64 ARG CG C 13 26.701 0.000 A 64 ARG N N 15 120.544 0.000 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-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 34 LEU HBx A 40 LEU HDx% 1.0 1.8 2.7 2 2 A 40 LEU HDx% A 34 LEU HBy 1.0 1.8 3.5 3 3 A 53 GLN H A 41 LYS H 1.0 1.8 3.5 4 4 A 34 LEU HBx A 40 LEU H 1.0 1.8 5.0 5 5 A 40 LEU HDx% A 35 VAL H 1.0 1.8 5.0 6 6 A 34 LEU HBy A 40 LEU H 1.0 1.8 3.5 7 7 A 53 GLN H A 40 LEU HDy% 1.0 1.8 5.0 8 8 A 34 LEU HBx A 40 LEU HBx 1.0 1.8 3.5 9 8 A 34 LEU HBx A 40 LEU HBy 1.0 1.8 3.5 10 9 A 35 VAL H A 40 LEU HBx 1.0 1.8 3.5 11 9 A 35 VAL H A 40 LEU HBy 1.0 1.8 3.5 12 10 A 35 VAL HA A 40 LEU HBx 1.0 1.8 3.5 13 10 A 40 LEU HBy A 35 VAL HA 1.0 1.8 3.5 14 11 A 34 LEU HBy A 39 TRP HBx 1.0 1.8 2.7 15 12 A 41 LYS H A 55 THR HG2% 1.0 1.8 5.0 16 13 A 34 LEU HBy A 40 LEU HBx 1.0 1.8 3.5 17 13 A 34 LEU HBy A 40 LEU HBy 1.0 1.8 3.5 18 14 A 53 GLN H A 40 LEU HBx 1.0 1.8 5.0 19 14 A 53 GLN H A 40 LEU HBy 1.0 1.8 5.0 20 15 A 23 PHE HA A 49 ALA HB% 1.0 1.8 3.5 21 16 A 35 VAL HGy% A 40 LEU HBx 1.0 1.8 2.7 22 16 A 40 LEU HBy A 35 VAL HGy% 1.0 1.8 2.7 23 17 A 34 LEU HBx A 39 TRP HBx 1.0 1.8 5.0 24 18 A 40 LEU HDx% A 34 LEU HA 1.0 1.8 5.0 25 19 A 40 LEU HDx% A 34 LEU HDx% 1.0 1.8 3.5 26 20 A 34 LEU HDx% A 10 ILE HD1% 1.0 1.8 5.0 27 21 A 39 TRP HBx A 34 LEU HDy% 1.0 1.8 3.5 28 22 A 22 VAL HGx% A 28 GLN HE2y 1.0 1.8 5.0 29 23 A 40 LEU HDx% A 35 VAL HGy% 1.0 1.8 3.5 30 24 A 40 LEU HDx% A 35 VAL HA 1.0 1.8 5.0 31 25 A 10 ILE HD1% A 39 TRP HE3 1.0 1.8 3.5 32 26 A 40 LEU HDx% A 34 LEU H 1.0 1.8 5.0 33 27 A 10 ILE HD1% A 39 TRP HBy 1.0 1.8 2.7 34 28 A 40 LEU H A 34 LEU HDy% 1.0 1.8 5.0 35 29 A 40 LEU H A 35 VAL HA 1.0 1.8 2.7 36 30 A 40 LEU HDx% A 53 GLN H 1.0 1.8 6.0 37 31 A 40 LEU H A 35 VAL H 1.0 1.8 5.0 38 32 A 41 LYS H A 52 TYR HD% 1.0 1.8 3.5 39 33 A 22 VAL HGx% A 28 GLN HE2x 1.0 1.8 5.0 40 34 A 40 LEU HDy% A 52 TYR HD% 1.0 1.8 3.5 41 35 A 22 VAL HGx% A 28 GLN HGx 1.0 1.8 3.5 42 35 A 22 VAL HGx% A 28 GLN HGy 1.0 1.8 3.5 43 36 A 40 LEU HDy% A 52 TYR HBx 1.0 1.8 2.7 44 37 A 34 LEU HDx% A 10 ILE HB 1.0 1.8 5.0 45 38 A 52 TYR HBx A 40 LEU HBx 1.0 1.8 2.7 46 38 A 40 LEU HBy A 52 TYR HBx 1.0 1.8 2.7 47 39 A 52 TYR HD% A 40 LEU HBx 1.0 1.8 2.7 48 39 A 40 LEU HBy A 52 TYR HD% 1.0 1.8 2.7 49 40 A 20 ARG H A 52 TYR H 1.0 1.8 3.5 50 41 A 39 TRP HBx A 10 ILE HD1% 1.0 1.8 3.5 51 42 A 49 ALA HB% A 22 VAL H 1.0 1.8 5.0 52 43 A 55 THR HG2% A 41 LYS HBx 1.0 1.8 3.5 53 44 A 34 LEU HA A 40 LEU HBx 1.0 1.8 5.0 54 44 A 40 LEU HBy A 34 LEU HA 1.0 1.8 5.0 55 45 A 34 LEU HBy A 39 TRP HBy 1.0 1.8 3.5 56 46 A 34 LEU HBy A 40 LEU HG 1.0 1.8 2.7 57 47 A 31 PHE H A 9 LEU HDx% 1.0 1.8 5.0 58 48 A 34 LEU HBx A 40 LEU HG 1.0 1.8 3.5 59 49 A 22 VAL HGx% A 28 GLN H 1.0 1.8 5.0 60 50 A 22 VAL H A 51 HIS HA 1.0 1.8 5.0 61 51 A 34 LEU H A 40 LEU HBx 1.0 1.8 5.0 62 51 A 40 LEU HBy A 34 LEU H 1.0 1.8 5.0 63 52 A 55 THR HG2% A 41 LYS HBy 1.0 1.8 5.0 64 53 A 55 THR HG2% A 41 LYS HDx 1.0 1.8 5.0 65 53 A 55 THR HG2% A 41 LYS HDy 1.0 1.8 5.0 66 54 A 55 THR HG2% A 41 LYS HGx 1.0 1.8 5.0 67 55 A 55 THR HG2% A 41 LYS HGy 1.0 1.8 5.0 68 56 A 55 THR HG2% A 41 LYS HEx 1.0 1.8 6.0 69 56 A 55 THR HG2% A 41 LYS HEy 1.0 1.8 6.0 70 57 A 41 LYS H A 52 TYR HA 1.0 1.8 5.0 71 58 A 49 ALA HB% A 23 PHE HD% 1.0 1.8 5.0 72 59 A 49 ALA HB% A 22 VAL HA 1.0 1.8 6.0 73 60 A 40 LEU HDy% A 52 TYR HBy 1.0 1.8 3.5 74 61 A 40 LEU HDy% A 52 TYR HA 1.0 1.8 5.0 75 62 A 52 TYR HBy A 40 LEU HBx 1.0 1.8 5.0 76 62 A 40 LEU HBy A 52 TYR HBy 1.0 1.8 5.0 77 63 A 34 LEU HBy A 39 TRP H 1.0 1.8 3.5 78 64 A 61 ALA HB% A 10 ILE HG2% 1.0 1.8 2.7 79 65 A 34 LEU HBx A 39 TRP HBy 1.0 1.8 5.0 80 66 A 41 LYS H A 52 TYR HBx 1.0 1.8 3.5 81 67 A 49 ALA HB% A 23 PHE HBx 1.0 1.8 5.0 82 67 A 49 ALA HB% A 23 PHE HBy 1.0 1.8 5.0 83 68 A 52 TYR HD% A 22 VAL H 1.0 1.8 3.5 84 69 A 22 VAL H A 52 TYR HE% 1.0 1.8 5.0 85 70 A 59 THR H A 54 ILE HD1% 1.0 1.8 5.0 86 71 A 52 TYR HA A 40 LEU HBx 1.0 1.8 5.0 87 71 A 40 LEU HBy A 52 TYR HA 1.0 1.8 5.0 88 72 A 40 LEU HDx% A 52 TYR HD% 1.0 1.8 3.5 89 73 A 40 LEU HDx% A 52 TYR HBx 1.0 1.8 3.5 90 74 A 10 ILE HD1% A 34 LEU HDy% 1.0 1.8 5.0 91 75 A 39 TRP HBx A 34 LEU HA 1.0 1.8 3.5 92 76 A 40 LEU HDy% A 54 ILE HA 1.0 1.8 3.5 93 77 A 31 PHE H A 9 LEU HDy% 1.0 1.8 5.0 94 78 A 35 VAL HGy% A 41 LYS HA 1.0 1.8 5.0 95 79 A 41 LYS HA A 35 VAL HGx% 1.0 1.8 3.5 96 80 A 39 TRP HE3 A 10 ILE HG2% 1.0 1.8 2.7 97 81 A 39 TRP HBy A 10 ILE HG2% 1.0 1.8 5.0 98 82 A 55 THR HG2% A 40 LEU HA 1.0 1.8 5.0 99 83 A 39 TRP HBy A 10 ILE HB 1.0 1.8 5.0 100 84 A 39 TRP HD1 A 57 ARG HBy 1.0 1.8 3.5 101 85 A 39 TRP HE3 A 10 ILE HB 1.0 1.8 2.7 102 86 A 34 LEU HDx% A 10 ILE HG1x 1.0 1.8 6.0 103 86 A 34 LEU HDx% A 10 ILE HG1y 1.0 1.8 6.0 104 87 A 10 ILE HG2% A 62 ALA HA 1.0 1.8 5.0 105 88 A 49 ALA HB% A 21 GLN HGx 1.0 1.8 6.0 106 89 A 34 LEU HDx% A 10 ILE H 1.0 1.8 5.0 107 90 A 52 TYR HD% A 20 ARG H 1.0 1.8 5.0 108 91 A 20 ARG HBx A 13 ILE HG2% 1.0 1.8 2.7 109 92 A 51 HIS HA A 21 GLN HBx 1.0 1.8 5.0 110 93 A 61 ALA HB% A 10 ILE HG1x 1.0 1.8 2.7 111 93 A 61 ALA HB% A 10 ILE HG1y 1.0 1.8 2.7 112 94 A 34 LEU HDx% A 10 ILE HG2% 1.0 1.8 6.0 113 95 A 35 VAL HA A 41 LYS HA 1.0 1.8 5.0 114 96 A 9 LEU HDx% A 31 PHE HA 1.0 1.8 5.0 115 97 A 49 ALA HB% A 21 GLN HBx 1.0 1.8 5.0 116 98 A 41 LYS H A 54 ILE HA 1.0 1.8 5.0 117 99 A 13 ILE HG2% A 19 ARG H 1.0 1.8 5.0 118 100 A 9 LEU HDx% A 31 PHE HD% 1.0 1.8 3.5 119 101 A 20 ARG HBx A 13 ILE HA 1.0 1.8 2.7 120 102 A 22 VAL HGx% A 28 GLN HBy 1.0 1.8 5.0 121 103 A 35 VAL H A 40 LEU HG 1.0 1.8 5.0 122 104 A 7 PHE H A 2 ALA HB% 1.0 1.8 5.0 123 105 A 10 ILE HG2% A 62 ALA H 1.0 1.8 5.0 124 106 A 13 ILE HG2% A 18 GLY H 1.0 1.8 5.0 125 107 A 58 GLY HAx A 39 TRP HA 1.0 1.8 3.5 126 108 A 49 ALA HB% A 21 GLN HGy 1.0 1.8 5.0 127 109 A 9 LEU HDx% A 30 PRO HGx 1.0 1.8 3.5 128 109 A 9 LEU HDx% A 30 PRO HGy 1.0 1.8 3.5 129 110 A 23 PHE HA A 49 ALA HA 1.0 1.8 2.7 130 111 A 39 TRP HD1 A 57 ARG HDy 1.0 1.8 5.0 131 112 A 39 TRP HD1 A 57 ARG HGx 1.0 1.8 5.0 132 112 A 39 TRP HD1 A 57 ARG HGy 1.0 1.8 5.0 133 113 A 13 ILE HG2% A 18 GLY HAy 1.0 1.8 5.0 134 114 A 51 HIS HA A 21 GLN HA 1.0 1.8 2.7 135 115 A 39 TRP HD1 A 57 ARG HBx 1.0 1.8 5.0 136 116 A 10 ILE HD1% A 40 LEU HG 1.0 1.8 2.7 137 117 A 61 ALA HB% A 39 TRP HH2 1.0 1.8 5.0 138 118 A 39 TRP HBy A 61 ALA HB% 1.0 1.8 5.0 139 119 A 61 ALA HB% A 39 TRP HZ3 1.0 1.8 5.0 140 120 A 39 TRP HE3 A 61 ALA HB% 1.0 1.8 5.0 141 121 A 61 ALA HB% A 39 TRP HZ2 1.0 1.8 5.0 142 122 A 39 TRP HD1 A 57 ARG HDx 1.0 1.8 5.0 143 123 A 52 TYR H A 21 GLN HA 1.0 1.8 3.5 144 124 A 40 LEU HDx% A 52 TYR HBy 1.0 1.8 3.5 145 125 A 22 VAL HGx% A 27 GLU HBy 1.0 1.8 5.0 146 126 A 39 TRP HBx A 10 ILE HB 1.0 1.8 5.0 147 127 A 34 LEU HDy% A 10 ILE HB 1.0 1.8 5.0 148 128 A 19 ARG H A 53 GLN HA 1.0 1.8 6.0 149 129 A 34 LEU HDy% A 39 TRP HZ3 1.0 1.8 3.5 150 130 A 10 ILE HD1% A 39 TRP HA 1.0 1.8 5.0 151 131 A 39 TRP HA A 58 GLY H 1.0 1.8 2.7 152 132 A 41 LYS H A 55 THR H 1.0 1.8 5.0 153 133 A 19 ARG H A 54 ILE HG2% 1.0 1.8 5.0 154 134 A 2 ALA HB% A 37 LEU HDx% 1.0 1.8 2.7 155 135 A 61 ALA HB% A 39 TRP HE1 1.0 1.8 5.0 156 136 A 54 ILE HD1% A 18 GLY HAy 1.0 1.8 2.7 157 137 A 54 ILE HG2% A 18 GLY HAx 1.0 1.8 5.0 158 138 A 18 GLY HAy A 54 ILE HG2% 1.0 1.8 3.5 159 139 A 54 ILE HD1% A 18 GLY HAx 1.0 1.8 3.5 160 140 A 10 ILE HB A 39 TRP HZ3 1.0 1.8 5.0 161 141 A 40 LEU HDx% A 31 PHE HD% 1.0 1.8 2.7 162 142 A 10 ILE HG2% A 39 TRP HZ3 1.0 1.8 2.7 163 143 A 50 THR HG2% A 42 ARG HDx 1.0 1.8 5.0 164 143 A 42 ARG HDy A 50 THR HG2% 1.0 1.8 5.0 165 144 A 9 LEU HDx% A 31 PHE HE% 1.0 1.8 3.5 166 145 A 9 LEU HDx% A 30 PRO HBx 1.0 1.8 2.7 167 146 A 9 LEU HDx% A 30 PRO HBy 1.0 1.8 5.0 168 147 A 53 GLN H A 40 LEU HA 1.0 1.8 5.0 169 148 A 20 ARG H A 52 TYR HBy 1.0 1.8 3.5 170 149 A 52 TYR HBx A 20 ARG H 1.0 1.8 5.0 171 150 A 10 ILE HD1% A 39 TRP H 1.0 1.8 5.0 172 151 A 34 LEU HDy% A 6 ASP HA 1.0 1.8 5.0 173 152 A 31 PHE HE% A 20 ARG HDx 1.0 1.8 5.0 174 153 A 34 LEU HBy A 10 ILE HD1% 1.0 1.8 3.5 175 154 A 9 LEU HDy% A 31 PHE HE% 1.0 1.8 3.5 176 155 A 9 LEU HDy% A 31 PHE HD% 1.0 1.8 3.5 177 156 A 10 ILE HG2% A 62 ALA HB% 1.0 1.8 5.0 178 157 A 53 GLN HA A 19 ARG HA 1.0 1.8 3.5 179 158 A 35 VAL HGx% A 42 ARG HGx 1.0 1.8 5.0 180 159 A 52 TYR H A 22 VAL H 1.0 1.8 5.0 181 160 A 62 ALA HA A 10 ILE HG1x 1.0 1.8 5.0 182 160 A 10 ILE HG1y A 62 ALA HA 1.0 1.8 5.0 183 161 A 20 ARG HBx A 13 ILE HD1% 1.0 1.8 3.5 184 162 A 49 ALA HB% A 23 PHE H 1.0 1.8 5.0 185 163 A 2 ALA HB% A 7 PHE HD% 1.0 1.8 5.0 186 164 A 49 ALA HB% A 21 GLN HBy 1.0 1.8 5.0 187 165 A 49 ALA HB% A 21 GLN HE2x 1.0 1.8 5.0 188 166 A 13 ILE HG2% A 20 ARG HBy 1.0 1.8 2.7 189 167 A 9 LEU HDy% A 31 PHE HA 1.0 1.8 3.5 190 168 A 52 TYR HD% A 21 GLN HA 1.0 1.8 5.0 191 169 A 39 TRP HZ3 A 6 ASP HBx 1.0 1.8 3.5 192 170 A 53 GLN H A 41 LYS HA 1.0 1.8 5.0 193 171 A 50 THR HG2% A 42 ARG HGy 1.0 1.8 5.0 194 172 A 62 ALA HA A 11 ARG H 1.0 1.8 5.0 195 173 A 62 ALA HA A 11 ARG HA 1.0 1.8 5.0 196 174 A 31 PHE HE% A 20 ARG HGx 1.0 1.8 3.5 197 174 A 31 PHE HE% A 20 ARG HGy 1.0 1.8 3.5 198 175 A 50 THR HG2% A 42 ARG HGx 1.0 1.8 5.0 199 176 A 50 THR HG2% A 42 ARG HBy 1.0 1.8 5.0 200 177 A 39 TRP HA A 58 GLY HAy 1.0 1.8 3.5 201 178 A 20 ARG HBx A 31 PHE HE% 1.0 1.8 5.0 202 179 A 54 ILE HA A 40 LEU HA 1.0 1.8 3.5 203 180 A 50 THR HG2% A 42 ARG HBx 1.0 1.8 3.5 204 181 A 40 LEU HA A 55 THR H 1.0 1.8 5.0 205 182 A 54 ILE HD1% A 19 ARG H 1.0 1.8 6.0 206 183 A 54 ILE HA A 13 ILE HG2% 1.0 1.8 5.0 207 184 A 40 LEU HDy% A 55 THR H 1.0 1.8 5.0 208 185 A 2 ALA HB% A 37 LEU HDy% 1.0 1.8 5.0 209 186 A 13 ILE HG2% A 18 GLY HAx 1.0 1.8 5.0 210 187 A 52 TYR HA A 42 ARG HA 1.0 1.8 3.5 211 188 A 13 ILE HG2% A 54 ILE HG2% 1.0 1.8 2.7 212 189 A 28 GLN HE2y A 22 VAL HB 1.0 1.8 5.0 213 190 A 57 ARG HBy A 39 TRP HA 1.0 1.8 5.0 214 191 A 40 LEU HDx% A 13 ILE HB 1.0 1.8 6.0 215 192 A 40 LEU HDx% A 13 ILE HG2% 1.0 1.8 5.0 216 193 A 40 LEU HDx% A 13 ILE HG1x 1.0 1.8 3.5 217 193 A 40 LEU HDx% A 13 ILE HG1y 1.0 1.8 3.5 218 194 A 20 ARG HBx A 13 ILE HG1x 1.0 1.8 5.0 219 194 A 20 ARG HBx A 13 ILE HG1y 1.0 1.8 5.0 220 195 A 40 LEU HDy% A 53 GLN HA 1.0 1.8 5.0 221 196 A 7 PHE H A 39 TRP HZ3 1.0 1.8 5.0 222 197 A 39 TRP HE3 A 10 ILE H 1.0 1.8 5.0 223 198 A 22 VAL HGx% A 27 GLU HA 1.0 1.8 6.0 224 199 A 20 ARG H A 51 HIS HA 1.0 1.8 5.0 225 200 A 34 LEU HA A 39 TRP H 1.0 1.8 5.0 226 201 A 10 ILE HG2% A 61 ALA H 1.0 1.8 5.0 227 202 A 34 LEU HDx% A 39 TRP HZ3 1.0 1.8 5.0 228 203 A 40 LEU HDy% A 10 ILE HD1% 1.0 1.8 2.7 229 204 A 52 TYR HA A 42 ARG H 1.0 1.8 5.0 230 205 A 37 LEU HDx% A 2 ALA H 1.0 1.8 5.0 231 206 A 20 ARG H A 13 ILE HG2% 1.0 1.8 3.5 232 207 A 59 THR H A 54 ILE HG2% 1.0 1.8 5.0 233 208 A 62 ALA H A 10 ILE HG1x 1.0 1.8 5.0 234 208 A 10 ILE HG1y A 62 ALA H 1.0 1.8 5.0 235 209 A 40 LEU HDx% A 31 PHE H 1.0 1.8 5.0 236 210 A 54 ILE HD1% A 18 GLY H 1.0 1.8 5.0 237 211 A 41 LYS H A 35 VAL HA 1.0 1.8 6.0 238 212 A 40 LEU HDx% A 31 PHE HBy 1.0 1.8 2.7 239 213 A 40 LEU HDx% A 31 PHE HA 1.0 1.8 2.7 240 214 A 40 LEU HDx% A 31 PHE HBx 1.0 1.8 5.0 241 215 A 22 VAL HB A 28 GLN HGx 1.0 1.8 5.0 242 215 A 28 GLN HGy A 22 VAL HB 1.0 1.8 5.0 243 216 A 34 LEU HDy% A 6 ASP HBy 1.0 1.8 5.0 244 217 A 34 LEU HDy% A 6 ASP HBx 1.0 1.8 3.5 245 218 A 9 LEU HDy% A 30 PRO HBx 1.0 1.8 5.0 246 219 A 62 ALA HB% A 14 HIS H 1.0 1.8 5.0 247 220 A 62 ALA HB% A 14 HIS HBx 1.0 1.8 5.0 248 221 A 62 ALA HB% A 14 HIS HA 1.0 1.8 6.0 249 222 A 62 ALA HB% A 14 HIS HBy 1.0 1.8 5.0 250 223 A 37 LEU HDx% A 2 ALA HA 1.0 1.8 5.0 251 224 A 37 LEU HDy% A 2 ALA H 1.0 1.8 5.0 252 225 A 54 ILE HD1% A 59 THR HA 1.0 1.8 5.0 253 226 A 54 ILE HD1% A 14 HIS HA 1.0 1.8 3.5 254 227 A 18 GLY H A 54 ILE HG2% 1.0 1.8 5.0 255 228 A 39 TRP HBy A 10 ILE HG1x 1.0 1.8 2.7 256 228 A 39 TRP HBy A 10 ILE HG1y 1.0 1.8 2.7 257 229 A 31 PHE HE% A 20 ARG HBy 1.0 1.8 3.5 258 230 A 9 LEU HDy% A 30 PRO HBy 1.0 1.8 6.0 259 231 A 31 PHE HE% A 20 ARG HDy 1.0 1.8 6.0 260 232 A 52 TYR HD% A 22 VAL HGy% 1.0 1.8 3.5 261 233 A 54 ILE HD1% A 14 HIS HD2 1.0 1.8 5.0 262 234 A 62 ALA HB% A 14 HIS HD2 1.0 1.8 2.7 263 235 A 52 TYR HE% A 22 VAL HB 1.0 1.8 3.5 264 236 A 52 TYR HE% A 22 VAL HGy% 1.0 1.8 5.0 265 237 A 35 VAL HGx% A 42 ARG H 1.0 1.8 3.5 266 238 A 28 GLN HE2x A 50 THR HB 1.0 1.8 2.7 267 239 A 13 ILE HD1% A 20 ARG HBy 1.0 1.8 2.7 268 240 A 40 LEU H A 55 THR HG2% 1.0 1.8 5.0 269 241 A 39 TRP HZ3 A 7 PHE HA 1.0 1.8 3.5 270 242 A 34 LEU HBy A 10 ILE HB 1.0 1.8 5.0 271 243 A 62 ALA HA A 11 ARG HBx 1.0 1.8 5.0 272 243 A 62 ALA HA A 11 ARG HBy 1.0 1.8 5.0 273 244 A 53 GLN HA A 19 ARG HGx 1.0 1.8 5.0 274 244 A 53 GLN HA A 19 ARG HGy 1.0 1.8 5.0 275 245 A 34 LEU HDy% A 10 ILE HG1x 1.0 1.8 5.0 276 245 A 34 LEU HDy% A 10 ILE HG1y 1.0 1.8 5.0 277 246 A 52 TYR HE% A 31 PHE HBy 1.0 1.8 3.5 278 247 A 61 ALA H A 10 ILE HG1x 1.0 1.8 5.0 279 247 A 10 ILE HG1y A 61 ALA H 1.0 1.8 5.0 280 248 A 41 LYS H A 54 ILE H 1.0 1.8 6.0 281 249 A 22 VAL H A 50 THR H 1.0 1.8 3.5 282 250 A 23 PHE HA A 50 THR H 1.0 1.8 3.5 283 251 A 23 PHE HA A 28 GLN HE2y 1.0 1.8 5.0 284 252 A 39 TRP HA A 57 ARG HBx 1.0 1.8 5.0 285 253 A 39 TRP HZ3 A 7 PHE HD% 1.0 1.8 5.0 286 254 A 40 LEU HDy% A 13 ILE HB 1.0 1.8 3.5 287 255 A 40 LEU HDy% A 13 ILE HG1x 1.0 1.8 2.7 288 255 A 40 LEU HDy% A 13 ILE HG1y 1.0 1.8 2.7 289 256 A 40 LEU HDy% A 13 ILE HG2% 1.0 1.8 2.7 290 257 A 40 LEU HDx% A 13 ILE HD1% 1.0 1.8 2.7 291 258 A 53 GLN H A 42 ARG HA 1.0 1.8 5.0 292 259 A 28 GLN HE2x A 50 THR H 1.0 1.8 3.5 293 260 A 13 ILE HG2% A 19 ARG HA 1.0 1.8 3.5 294 261 A 35 VAL HGx% A 42 ARG HDx 1.0 1.8 5.0 295 261 A 35 VAL HGx% A 42 ARG HDy 1.0 1.8 5.0 296 262 A 34 LEU HDy% A 6 ASP H 1.0 1.8 6.0 297 263 A 35 VAL HGy% A 52 TYR HE% 1.0 1.8 2.7 298 264 A 28 GLN HE2y A 50 THR HB 1.0 1.8 3.5 299 265 A 23 PHE HA A 28 GLN HE2x 1.0 1.8 5.0 300 266 A 28 GLN HE2x A 22 VAL HB 1.0 1.8 5.0 301 267 A 23 PHE HA A 48 ARG HBx 1.0 1.8 5.0 302 267 A 23 PHE HA A 48 ARG HBy 1.0 1.8 5.0 303 268 A 23 PHE HD% A 49 ALA HA 1.0 1.8 5.0 304 269 A 37 LEU HDy% A 2 ALA HA 1.0 1.8 5.0 305 270 A 18 GLY HAx A 54 ILE H 1.0 1.8 5.0 306 271 A 18 GLY HAy A 54 ILE H 1.0 1.8 5.0 307 272 A 51 HIS HA A 21 GLN HGy 1.0 1.8 6.0 308 273 A 40 LEU HDy% A 54 ILE HG2% 1.0 1.8 3.5 309 274 A 52 TYR HD% A 42 ARG HA 1.0 1.8 5.0 310 275 A 52 TYR HD% A 22 VAL HB 1.0 1.8 5.0 311 276 A 41 LYS H A 53 GLN HBx 1.0 1.8 5.0 312 277 A 54 ILE HD1% A 59 THR HB 1.0 1.8 5.0 313 278 A 39 TRP HD1 A 58 GLY HAx 1.0 1.8 5.0 314 279 A 53 GLN HA A 19 ARG HBx 1.0 1.8 5.0 315 280 A 10 ILE HB A 61 ALA HB% 1.0 1.8 5.0 316 281 A 21 GLN HBx A 51 HIS HD2 1.0 1.8 5.0 317 282 A 39 TRP HBx A 10 ILE HG1x 1.0 1.8 5.0 318 282 A 39 TRP HBx A 10 ILE HG1y 1.0 1.8 5.0 319 283 A 10 ILE HD1% A 61 ALA HB% 1.0 1.8 5.0 320 284 A 35 VAL HGy% A 40 LEU HA 1.0 1.8 5.0 321 285 A 7 PHE HD% A 64 ARG H 1.0 1.8 5.0 322 286 A 37 LEU HDx% A 3 THR H 1.0 1.8 6.0 323 287 A 51 HIS H A 45 VAL HGy% 1.0 1.8 6.0 324 288 A 59 THR H A 54 ILE HA 1.0 1.8 6.0 325 289 A 28 GLN HE2y A 50 THR H 1.0 1.8 5.0 326 290 A 2 ALA HB% A 39 TRP HE1 1.0 1.8 6.0 327 291 A 51 HIS H A 45 VAL HA 1.0 1.8 5.0 328 292 A 52 TYR HD% A 42 ARG H 1.0 1.8 5.0 329 293 A 10 ILE H A 39 TRP HZ3 1.0 1.8 5.0 330 294 A 10 ILE HG2% A 39 TRP HH2 1.0 1.8 5.0 331 295 A 31 PHE HD% A 22 VAL HGy% 1.0 1.8 3.5 332 296 A 22 VAL HGx% A 31 PHE HD% 1.0 1.8 5.0 333 297 A 50 THR HG2% A 45 VAL HGy% 1.0 1.8 5.0 334 298 A 45 VAL HGy% A 50 THR HA 1.0 1.8 5.0 335 299 A 31 PHE HE% A 13 ILE HD1% 1.0 1.8 2.7 336 300 A 13 ILE HG2% A 54 ILE H 1.0 1.8 3.5 337 301 A 54 ILE HD1% A 14 HIS HBy 1.0 1.8 5.0 338 302 A 13 ILE HG2% A 54 ILE HB 1.0 1.8 5.0 339 303 A 54 ILE HG2% A 14 HIS HA 1.0 1.8 3.5 340 304 A 54 ILE HD1% A 14 HIS HBx 1.0 1.8 5.0 341 305 A 7 PHE HD% A 64 ARG HDx 1.0 1.8 6.0 342 305 A 7 PHE HD% A 64 ARG HDy 1.0 1.8 6.0 343 306 A 62 ALA HB% A 11 ARG HA 1.0 1.8 3.5 344 307 A 45 VAL HA A 50 THR HA 1.0 1.8 3.5 345 308 A 54 ILE HD1% A 59 THR HG2% 1.0 1.8 5.0 346 309 A 7 PHE HD% A 64 ARG HBx 1.0 1.8 5.0 347 309 A 7 PHE HD% A 64 ARG HBy 1.0 1.8 5.0 348 310 A 7 PHE HD% A 64 ARG HGx 1.0 1.8 6.0 349 310 A 7 PHE HD% A 64 ARG HGy 1.0 1.8 6.0 350 311 A 34 LEU HBx A 10 ILE HD1% 1.0 1.8 5.0 351 312 A 20 ARG HBy A 13 ILE HG1x 1.0 1.8 5.0 352 312 A 20 ARG HBy A 13 ILE HG1y 1.0 1.8 5.0 353 313 A 50 THR HG2% A 45 VAL HA 1.0 1.8 5.0 354 314 A 49 ALA HA A 23 PHE HBx 1.0 1.8 5.0 355 314 A 23 PHE HBy A 49 ALA HA 1.0 1.8 5.0 356 315 A 2 ALA HB% A 39 TRP HH2 1.0 1.8 2.7 357 316 A 2 ALA HB% A 39 TRP HZ3 1.0 1.8 3.5 358 317 A 22 VAL HGx% A 52 TYR HE% 1.0 1.8 5.0 359 318 A 2 ALA HB% A 39 TRP HZ2 1.0 1.8 5.0 360 319 A 52 TYR HE% A 31 PHE HD% 1.0 1.8 5.0 361 320 A 34 LEU HDy% A 7 PHE H 1.0 1.8 6.0 362 321 A 39 TRP HE1 A 57 ARG HGx 1.0 1.8 5.0 363 321 A 57 ARG HGy A 39 TRP HE1 1.0 1.8 5.0 364 322 A 57 ARG HDy A 39 TRP HE1 1.0 1.8 5.0 365 323 A 34 LEU HDx% A 9 LEU HDx% 1.0 1.8 3.5 366 324 A 40 LEU HDy% A 10 ILE HA 1.0 1.8 5.0 367 325 A 21 GLN HBx A 51 HIS H 1.0 1.8 5.0 368 326 A 59 THR H A 39 TRP HA 1.0 1.8 5.0 369 327 A 22 VAL H A 50 THR HB 1.0 1.8 5.0 370 328 A 49 ALA HB% A 24 GLY H 1.0 1.8 6.0 371 329 A 39 TRP HH2 A 6 ASP HBx 1.0 1.8 5.0 372 330 A 39 TRP HZ3 A 6 ASP HBy 1.0 1.8 5.0 373 331 A 52 TYR HE% A 35 VAL HB 1.0 1.8 5.0 374 332 A 52 TYR HE% A 32 GLU HA 1.0 1.8 3.5 375 333 A 28 GLN HE2x A 49 ALA HA 1.0 1.8 5.0 376 334 A 52 TYR H A 20 ARG HBy 1.0 1.8 5.0 377 335 A 40 LEU HG A 10 ILE HA 1.0 1.8 5.0 378 336 A 13 ILE HA A 20 ARG HDx 1.0 1.8 5.0 379 337 A 28 GLN HE2y A 22 VAL H 1.0 1.8 5.0 380 338 A 22 VAL HB A 50 THR H 1.0 1.8 5.0 381 339 A 28 GLN HE2y A 49 ALA HA 1.0 1.8 6.0 382 340 A 23 PHE HD% A 48 ARG HBx 1.0 1.8 6.0 383 340 A 23 PHE HD% A 48 ARG HBy 1.0 1.8 6.0 384 341 A 62 ALA HB% A 11 ARG HBx 1.0 1.8 5.0 385 341 A 62 ALA HB% A 11 ARG HBy 1.0 1.8 5.0 386 342 A 54 ILE HG2% A 14 HIS HD2 1.0 1.8 5.0 387 343 A 22 VAL HGy% A 28 GLN HGx 1.0 1.8 5.0 388 343 A 28 GLN HGy A 22 VAL HGy% 1.0 1.8 5.0 389 344 A 39 TRP HH2 A 7 PHE HA 1.0 1.8 5.0 390 345 A 39 TRP HH2 A 7 PHE HD% 1.0 1.8 5.0 391 346 A 19 ARG HA A 54 ILE H 1.0 1.8 3.5 392 347 A 35 VAL H A 52 TYR HE% 1.0 1.8 5.0 393 348 A 58 GLY HAx A 10 ILE HG1x 1.0 1.8 2.7 394 348 A 10 ILE HG1y A 58 GLY HAx 1.0 1.8 2.7 395 349 A 52 TYR HA A 43 SER H 1.0 1.8 5.0 396 350 A 31 PHE HE% A 22 VAL HGy% 1.0 1.8 3.5 397 351 A 22 VAL HB A 50 THR HB 1.0 1.8 5.0 398 352 A 50 THR HB A 28 GLN HGx 1.0 1.8 5.0 399 352 A 28 GLN HGy A 50 THR HB 1.0 1.8 5.0 400 353 A 52 TYR HD% A 32 GLU HA 1.0 1.8 6.0 401 354 A 2 ALA HB% A 37 LEU HBx 1.0 1.8 6.0 402 355 A 54 ILE HG2% A 59 THR HA 1.0 1.8 5.0 403 356 A 52 TYR HD% A 31 PHE HBy 1.0 1.8 5.0 404 357 A 31 PHE HE% A 13 ILE HG1x 1.0 1.8 5.0 405 357 A 31 PHE HE% A 13 ILE HG1y 1.0 1.8 5.0 406 358 A 13 ILE HG2% A 31 PHE HE% 1.0 1.8 5.0 407 359 A 31 PHE HD% A 22 VAL HB 1.0 1.8 5.0 408 360 A 22 VAL HGx% A 31 PHE HE% 1.0 1.8 5.0 409 361 A 39 TRP HE3 A 6 ASP HBx 1.0 1.8 5.0 410 362 A 10 ILE HD1% A 58 GLY HAx 1.0 1.8 3.5 411 363 A 37 LEU HDy% A 1 MET HBy 1.0 1.8 5.0 412 364 A 13 ILE HA A 18 GLY H 1.0 1.8 5.0 413 365 A 27 GLU HBy A 22 VAL HGy% 1.0 1.8 6.0 414 366 A 54 ILE HA A 13 ILE HG1x 1.0 1.8 5.0 415 366 A 54 ILE HA A 13 ILE HG1y 1.0 1.8 5.0 416 367 A 21 GLN HBy A 51 HIS HD2 1.0 1.8 5.0 417 368 A 39 TRP HBy A 58 GLY HAy 1.0 1.8 3.5 418 369 A 31 PHE HD% A 13 ILE HD1% 1.0 1.8 3.5 419 370 A 40 LEU HDy% A 31 PHE HD% 1.0 1.8 5.0 420 371 A 34 LEU HDx% A 6 ASP HA 1.0 1.8 5.0 421 372 A 51 HIS HBx A 44 SER HBx 1.0 1.8 5.0 422 372 A 44 SER HBy A 51 HIS HBx 1.0 1.8 5.0 423 373 A 52 TYR HE% A 28 GLN HGx 1.0 1.8 5.0 424 373 A 28 GLN HGy A 52 TYR HE% 1.0 1.8 5.0 425 374 A 37 LEU HDx% A 6 ASP HBx 1.0 1.8 5.0 426 375 A 37 LEU HDx% A 6 ASP HBy 1.0 1.8 5.0 427 376 A 51 HIS HBy A 44 SER HBx 1.0 1.8 6.0 428 376 A 44 SER HBy A 51 HIS HBy 1.0 1.8 6.0 429 377 A 52 TYR HBy A 13 ILE HG2% 1.0 1.8 5.0 430 378 A 52 TYR HE% A 28 GLN HA 1.0 1.8 5.0 431 379 A 52 TYR HBx A 13 ILE HG2% 1.0 1.8 5.0 432 380 A 35 VAL HGy% A 52 TYR HD% 1.0 1.8 2.7 433 381 A 52 TYR HBy A 31 PHE HD% 1.0 1.8 5.0 434 382 A 52 TYR HE% A 42 ARG HGy 1.0 1.8 5.0 435 383 A 39 TRP HA A 55 THR H 1.0 1.8 5.0 436 384 A 54 ILE HA A 14 HIS HE1 1.0 1.8 5.0 437 385 A 39 TRP H A 39 TRP HD1 1.0 1.8 3.5 438 386 A 41 LYS H A 41 LYS HA 1.0 1.8 3.5 439 387 A 39 TRP HBx A 39 TRP H 1.0 1.8 2.7 440 388 A 39 TRP HBy A 39 TRP H 1.0 1.8 5.0 441 389 A 39 TRP H A 39 TRP HA 1.0 1.8 3.5 442 390 A 39 TRP H A 38 GLY H 1.0 1.8 2.7 443 391 A 39 TRP HBx A 39 TRP HBy 1.0 1.8 2.7 444 392 A 10 ILE H A 9 LEU HBy 1.0 1.8 2.7 445 393 A 39 TRP HBx A 39 TRP HD1 1.0 1.8 5.0 446 394 A 39 TRP HBx A 39 TRP HA 1.0 1.8 3.5 447 395 A 39 TRP HBy A 39 TRP HD1 1.0 1.8 5.0 448 396 A 9 LEU HBy A 9 LEU H 1.0 1.8 2.7 449 397 A 39 TRP H A 37 LEU HDx% 1.0 1.8 5.0 450 398 A 39 TRP HD1 A 39 TRP HA 1.0 1.8 2.7 451 399 A 30 PRO HDy A 30 PRO HDx 1.0 1.8 2.7 452 400 A 40 LEU H A 39 TRP H 1.0 1.8 2.7 453 401 A 39 TRP HBy A 39 TRP HA 1.0 1.8 2.7 454 402 A 39 TRP HBy A 39 TRP HA 1.0 1.8 2.7 455 403 A 38 GLY H A 37 LEU H 1.0 1.8 2.7 456 404 A 63 LEU HBy A 63 LEU H 1.0 1.8 2.7 457 405 A 8 LYS H A 8 LYS HBx 1.0 1.8 2.7 458 405 A 8 LYS HBy A 8 LYS H 1.0 1.8 2.7 459 406 A 14 HIS H A 15 SER H 1.0 1.8 2.7 460 407 A 10 ILE HG2% A 10 ILE H 1.0 1.8 2.7 461 408 A 14 HIS H A 13 ILE H 1.0 1.8 2.7 462 409 A 40 LEU H A 40 LEU HG 1.0 1.8 3.5 463 410 A 40 LEU H A 40 LEU HBx 1.0 1.8 2.7 464 410 A 40 LEU H A 40 LEU HBy 1.0 1.8 2.7 465 411 A 41 LYS HBx A 41 LYS HA 1.0 1.8 2.7 466 412 A 8 LYS H A 8 LYS HA 1.0 1.8 3.5 467 413 A 10 ILE HG2% A 8 LYS H 1.0 1.8 5.0 468 414 A 40 LEU H A 39 TRP HBx 1.0 1.8 2.7 469 415 A 39 TRP HD1 A 39 TRP HE1 1.0 1.8 2.7 470 416 A 39 TRP HA A 39 TRP HE1 1.0 1.8 5.0 471 417 A 31 PHE H A 30 PRO HGx 1.0 1.8 2.7 472 417 A 31 PHE H A 30 PRO HGy 1.0 1.8 2.7 473 418 A 63 LEU HBy A 63 LEU HBx 1.0 1.8 2.7 474 419 A 31 PHE H A 30 PRO HDy 1.0 1.8 3.5 475 420 A 64 ARG H A 63 LEU H 1.0 1.8 2.7 476 421 A 21 GLN HGx A 21 GLN HA 1.0 1.8 5.0 477 422 A 63 LEU H A 63 LEU HDx% 1.0 1.8 5.0 478 423 A 39 TRP H A 37 LEU HBy 1.0 1.8 5.0 479 424 A 10 ILE H A 10 ILE HA 1.0 1.8 3.5 480 425 A 20 ARG H A 20 ARG HA 1.0 1.8 3.5 481 426 A 31 PHE H A 31 PHE HD% 1.0 1.8 2.7 482 427 A 31 PHE H A 31 PHE HA 1.0 1.8 3.5 483 428 A 39 TRP H A 38 GLY HAx 1.0 1.8 3.5 484 429 A 21 GLN HBx A 21 GLN HA 1.0 1.8 2.7 485 430 A 62 ALA H A 63 LEU H 1.0 1.8 2.7 486 431 A 13 ILE HG2% A 14 HIS H 1.0 1.8 5.0 487 432 A 37 LEU H A 36 ASP HBy 1.0 1.8 2.7 488 433 A 14 HIS H A 14 HIS HA 1.0 1.8 3.5 489 434 A 39 TRP HE3 A 39 TRP HH2 1.0 1.8 5.0 490 435 A 39 TRP HH2 A 39 TRP HZ3 1.0 1.8 2.7 491 436 A 39 TRP HE3 A 39 TRP HZ3 1.0 1.8 2.7 492 437 A 39 TRP HH2 A 39 TRP HZ2 1.0 1.8 2.7 493 438 A 39 TRP HZ2 A 39 TRP HE1 1.0 1.8 2.7 494 439 A 39 TRP HZ3 A 39 TRP HZ2 1.0 1.8 5.0 495 440 A 41 LYS H A 41 LYS HBy 1.0 1.8 3.5 496 441 A 30 PRO HDy A 30 PRO HGx 1.0 1.8 2.7 497 441 A 30 PRO HGy A 30 PRO HDy 1.0 1.8 2.7 498 442 A 9 LEU HDx% A 9 LEU H 1.0 1.8 5.0 499 443 A 9 LEU HDy% A 10 ILE H 1.0 1.8 3.5 500 444 A 41 LYS H A 41 LYS HGx 1.0 1.8 5.0 501 445 A 63 LEU H A 63 LEU HBx 1.0 1.8 2.7 502 446 A 9 LEU HDy% A 9 LEU H 1.0 1.8 5.0 503 447 A 37 LEU H A 37 LEU HG 1.0 1.8 2.7 504 448 A 37 LEU H A 36 ASP H 1.0 1.8 2.7 505 449 A 40 LEU HG A 40 LEU HBx 1.0 1.8 2.7 506 449 A 40 LEU HBy A 40 LEU HG 1.0 1.8 2.7 507 450 A 21 GLN HGx A 21 GLN HGy 1.0 1.8 2.7 508 451 A 40 LEU H A 40 LEU HDy% 1.0 1.8 5.0 509 452 A 40 LEU H A 39 TRP HD1 1.0 1.8 5.0 510 453 A 64 ARG H A 63 LEU HBy 1.0 1.8 5.0 511 454 A 63 LEU HBy A 63 LEU HA 1.0 1.8 2.7 512 455 A 63 LEU HBy A 63 LEU HDx% 1.0 1.8 2.7 513 456 A 9 LEU H A 9 LEU HBx 1.0 1.8 2.7 514 457 A 10 ILE H A 9 LEU H 1.0 1.8 2.7 515 458 A 63 LEU HBy A 63 LEU HG 1.0 1.8 3.5 516 459 A 37 LEU H A 37 LEU HA 1.0 1.8 3.5 517 460 A 31 PHE H A 30 PRO HDx 1.0 1.8 5.0 518 461 A 41 LYS HBy A 41 LYS HA 1.0 1.8 3.5 519 462 A 21 GLN HBx A 21 GLN HGy 1.0 1.8 2.7 520 463 A 21 GLN HGy A 21 GLN HA 1.0 1.8 5.0 521 464 A 21 GLN HA A 21 GLN H 1.0 1.8 3.5 522 465 A 41 LYS HA A 41 LYS HDx 1.0 1.8 5.0 523 465 A 41 LYS HDy A 41 LYS HA 1.0 1.8 5.0 524 466 A 41 LYS HGy A 41 LYS HA 1.0 1.8 5.0 525 467 A 41 LYS HGx A 41 LYS HA 1.0 1.8 5.0 526 468 A 41 LYS HA A 41 LYS HEx 1.0 1.8 5.0 527 468 A 41 LYS HEy A 41 LYS HA 1.0 1.8 5.0 528 469 A 30 PRO HDy A 29 LYS H 1.0 1.8 2.7 529 470 A 10 ILE H A 11 ARG H 1.0 1.8 2.7 530 471 A 40 LEU HDx% A 40 LEU HDy% 1.0 1.8 2.7 531 472 A 30 PRO HDx A 30 PRO HGx 1.0 1.8 2.7 532 472 A 30 PRO HGy A 30 PRO HDx 1.0 1.8 2.7 533 473 A 42 ARG HA A 42 ARG H 1.0 1.8 3.5 534 474 A 21 GLN HGx A 21 GLN HBx 1.0 1.8 3.5 535 475 A 40 LEU H A 40 LEU HA 1.0 1.8 3.5 536 476 A 14 HIS HA A 15 SER H 1.0 1.8 3.5 537 477 A 63 LEU H A 63 LEU HA 1.0 1.8 3.5 538 478 A 40 LEU HDx% A 40 LEU HG 1.0 1.8 2.7 539 479 A 13 ILE HB A 14 HIS H 1.0 1.8 2.7 540 480 A 13 ILE HA A 14 HIS H 1.0 1.8 3.5 541 481 A 9 LEU H A 9 LEU HA 1.0 1.8 3.5 542 482 A 37 LEU H A 36 ASP HA 1.0 1.8 3.5 543 483 A 64 ARG H A 63 LEU HBx 1.0 1.8 3.5 544 484 A 9 LEU H A 9 LEU HG 1.0 1.8 5.0 545 485 A 40 LEU H A 39 TRP HA 1.0 1.8 3.5 546 486 A 9 LEU H A 8 LYS H 1.0 1.8 2.7 547 487 A 30 PRO HDx A 29 LYS H 1.0 1.8 3.5 548 488 A 38 GLY H A 37 LEU HBy 1.0 1.8 5.0 549 489 A 63 LEU HBx A 63 LEU HA 1.0 1.8 3.5 550 490 A 20 ARG H A 20 ARG HBx 1.0 1.8 3.5 551 491 A 9 LEU HDx% A 9 LEU HBy 1.0 1.8 2.7 552 492 A 41 LYS H A 40 LEU HG 1.0 1.8 5.0 553 493 A 41 LYS H A 40 LEU HBx 1.0 1.8 3.5 554 493 A 41 LYS H A 40 LEU HBy 1.0 1.8 3.5 555 494 A 54 ILE HG2% A 54 ILE H 1.0 1.8 2.7 556 495 A 10 ILE HG2% A 11 ARG H 1.0 1.8 2.7 557 496 A 64 ARG H A 63 LEU HDx% 1.0 1.8 5.0 558 497 A 63 LEU HDx% A 63 LEU HA 1.0 1.8 2.7 559 498 A 20 ARG HA A 20 ARG HGx 1.0 1.8 3.5 560 498 A 20 ARG HGy A 20 ARG HA 1.0 1.8 3.5 561 499 A 9 LEU HDy% A 9 LEU HBy 1.0 1.8 2.7 562 500 A 40 LEU H A 39 TRP HBy 1.0 1.8 5.0 563 501 A 29 LYS H A 29 LYS HGx 1.0 1.8 5.0 564 501 A 29 LYS H A 29 LYS HGy 1.0 1.8 5.0 565 502 A 29 LYS H A 29 LYS HA 1.0 1.8 3.5 566 503 A 40 LEU HG A 40 LEU HA 1.0 1.8 3.5 567 504 A 39 TRP H A 37 LEU H 1.0 1.8 5.0 568 505 A 41 LYS H A 40 LEU H 1.0 1.8 5.0 569 506 A 21 GLN HGx A 21 GLN HBy 1.0 1.8 2.7 570 507 A 41 LYS H A 40 LEU HA 1.0 1.8 2.7 571 508 A 38 GLY H A 37 LEU HA 1.0 1.8 3.5 572 509 A 40 LEU HDx% A 40 LEU HBx 1.0 1.8 2.7 573 509 A 40 LEU HDx% A 40 LEU HBy 1.0 1.8 2.7 574 510 A 10 ILE H A 10 ILE HG1x 1.0 1.8 5.0 575 510 A 10 ILE HG1y A 10 ILE H 1.0 1.8 5.0 576 511 A 10 ILE HG2% A 9 LEU HBy 1.0 1.8 5.0 577 512 A 9 LEU HDx% A 10 ILE H 1.0 1.8 5.0 578 513 A 8 LYS H A 8 LYS HDx 1.0 1.8 5.0 579 513 A 8 LYS H A 8 LYS HDy 1.0 1.8 5.0 580 514 A 8 LYS H A 8 LYS HGy 1.0 1.8 5.0 581 515 A 8 LYS H A 8 LYS HGx 1.0 1.8 5.0 582 516 A 21 GLN HBx A 21 GLN HBy 1.0 1.8 2.7 583 517 A 21 GLN HA A 21 GLN HBy 1.0 1.8 3.5 584 518 A 9 LEU HDx% A 9 LEU HDy% 1.0 1.8 2.7 585 519 A 9 LEU HBy A 9 LEU HBx 1.0 1.8 2.7 586 520 A 41 LYS H A 40 LEU HDy% 1.0 1.8 3.5 587 521 A 31 PHE H A 31 PHE HBy 1.0 1.8 3.5 588 522 A 21 GLN HBy A 21 GLN H 1.0 1.8 3.5 589 523 A 40 LEU HDx% A 41 LYS H 1.0 1.8 5.0 590 524 A 63 LEU HBx A 63 LEU HG 1.0 1.8 2.7 591 525 A 63 LEU H A 63 LEU HG 1.0 1.8 5.0 592 526 A 8 LYS HA A 8 LYS HBx 1.0 1.8 2.7 593 526 A 8 LYS HBy A 8 LYS HA 1.0 1.8 2.7 594 527 A 37 LEU H A 37 LEU HBy 1.0 1.8 3.5 595 528 A 39 TRP H A 37 LEU HBx 1.0 1.8 3.5 596 529 A 41 LYS HBx A 41 LYS HBy 1.0 1.8 2.7 597 530 A 40 LEU HDx% A 40 LEU HA 1.0 1.8 5.0 598 531 A 37 LEU HG A 37 LEU HA 1.0 1.8 3.5 599 532 A 28 GLN H A 28 GLN HBy 1.0 1.8 3.5 600 533 A 28 GLN H A 28 GLN HGx 1.0 1.8 5.0 601 533 A 28 GLN HGy A 28 GLN H 1.0 1.8 5.0 602 534 A 62 ALA HB% A 63 LEU H 1.0 1.8 3.5 603 535 A 41 LYS HBx A 41 LYS HGy 1.0 1.8 3.5 604 536 A 41 LYS HBx A 41 LYS HGx 1.0 1.8 3.5 605 537 A 41 LYS HBx A 41 LYS HDx 1.0 1.8 3.5 606 537 A 41 LYS HBx A 41 LYS HDy 1.0 1.8 3.5 607 538 A 41 LYS HBx A 41 LYS HEx 1.0 1.8 5.0 608 538 A 41 LYS HBx A 41 LYS HEy 1.0 1.8 5.0 609 539 A 10 ILE HB A 10 ILE H 1.0 1.8 2.7 610 540 A 37 LEU HBx A 38 GLY H 1.0 1.8 3.5 611 541 A 34 LEU HBy A 34 LEU H 1.0 1.8 3.5 612 542 A 63 LEU HBy A 63 LEU HDy% 1.0 1.8 2.7 613 543 A 40 LEU HA A 40 LEU HBx 1.0 1.8 2.7 614 543 A 40 LEU HBy A 40 LEU HA 1.0 1.8 2.7 615 544 A 20 ARG H A 20 ARG HBy 1.0 1.8 2.7 616 545 A 13 ILE HD1% A 13 ILE H 1.0 1.8 2.7 617 546 A 37 LEU HDy% A 37 LEU H 1.0 1.8 5.0 618 547 A 37 LEU HBx A 37 LEU H 1.0 1.8 2.7 619 548 A 29 LYS H A 29 LYS HBx 1.0 1.8 2.7 620 548 A 29 LYS H A 29 LYS HBy 1.0 1.8 2.7 621 549 A 40 LEU HDy% A 40 LEU HBx 1.0 1.8 2.7 622 549 A 40 LEU HDy% A 40 LEU HBy 1.0 1.8 2.7 623 550 A 42 ARG HGx A 42 ARG H 1.0 1.8 3.5 624 551 A 20 ARG HDx A 20 ARG HA 1.0 1.8 5.0 625 552 A 42 ARG HBy A 42 ARG H 1.0 1.8 3.5 626 553 A 13 ILE H A 13 ILE HG1x 1.0 1.8 2.7 627 553 A 13 ILE HG1y A 13 ILE H 1.0 1.8 2.7 628 554 A 31 PHE H A 32 GLU H 1.0 1.8 2.7 629 555 A 9 LEU HBy A 9 LEU HA 1.0 1.8 3.5 630 556 A 31 PHE H A 31 PHE HBx 1.0 1.8 2.7 631 557 A 10 ILE HD1% A 10 ILE H 1.0 1.8 5.0 632 558 A 37 LEU HDx% A 39 TRP HE1 1.0 1.8 5.0 633 559 A 41 LYS HA A 42 ARG H 1.0 1.8 2.7 634 560 A 59 THR H A 60 SER H 1.0 1.8 2.7 635 561 A 35 VAL H A 35 VAL HGy% 1.0 1.8 2.7 636 562 A 40 LEU HDy% A 40 LEU HG 1.0 1.8 2.7 637 563 A 40 LEU HDy% A 40 LEU HA 1.0 1.8 2.7 638 564 A 14 HIS H A 14 HIS HBy 1.0 1.8 3.5 639 565 A 9 LEU HBy A 9 LEU HG 1.0 1.8 3.5 640 566 A 42 ARG HGy A 42 ARG HA 1.0 1.8 5.0 641 567 A 38 GLY H A 37 LEU HG 1.0 1.8 5.0 642 568 A 31 PHE H A 30 PRO HBy 1.0 1.8 5.0 643 569 A 63 LEU HA A 63 LEU HDy% 1.0 1.8 5.0 644 570 A 13 ILE HA A 13 ILE H 1.0 1.8 2.7 645 571 A 13 ILE HD1% A 14 HIS H 1.0 1.8 5.0 646 572 A 42 ARG H A 42 ARG HDx 1.0 1.8 5.0 647 572 A 42 ARG HDy A 42 ARG H 1.0 1.8 5.0 648 573 A 21 GLN HGy A 21 GLN HBy 1.0 1.8 3.5 649 574 A 9 LEU HDx% A 9 LEU HBx 1.0 1.8 2.7 650 575 A 35 VAL H A 35 VAL HA 1.0 1.8 3.5 651 576 A 64 ARG H A 63 LEU HA 1.0 1.8 3.5 652 577 A 10 ILE HG2% A 9 LEU H 1.0 1.8 5.0 653 578 A 34 LEU HBx A 34 LEU H 1.0 1.8 2.7 654 579 A 42 ARG HBx A 42 ARG HA 1.0 1.8 2.7 655 580 A 63 LEU HBx A 63 LEU HDy% 1.0 1.8 2.7 656 581 A 53 GLN HA A 53 GLN HGy 1.0 1.8 5.0 657 582 A 9 LEU HDy% A 9 LEU HBx 1.0 1.8 3.5 658 583 A 10 ILE HG2% A 10 ILE HA 1.0 1.8 3.5 659 584 A 13 ILE HB A 13 ILE H 1.0 1.8 3.5 660 585 A 35 VAL HA A 35 VAL HB 1.0 1.8 3.5 661 586 A 41 LYS HBy A 41 LYS HGy 1.0 1.8 3.5 662 587 A 41 LYS HBy A 41 LYS HGx 1.0 1.8 3.5 663 588 A 41 LYS HBy A 41 LYS HDx 1.0 1.8 3.5 664 588 A 41 LYS HBy A 41 LYS HDy 1.0 1.8 3.5 665 589 A 41 LYS HBy A 41 LYS HEx 1.0 1.8 5.0 666 589 A 41 LYS HBy A 41 LYS HEy 1.0 1.8 5.0 667 590 A 14 HIS H A 14 HIS HBx 1.0 1.8 2.7 668 591 A 41 LYS HGx A 41 LYS HGy 1.0 1.8 2.7 669 592 A 41 LYS HGy A 41 LYS HDx 1.0 1.8 2.7 670 592 A 41 LYS HDy A 41 LYS HGy 1.0 1.8 2.7 671 593 A 41 LYS HGx A 41 LYS HDx 1.0 1.8 2.7 672 593 A 41 LYS HDy A 41 LYS HGx 1.0 1.8 2.7 673 594 A 41 LYS HGy A 41 LYS HEx 1.0 1.8 3.5 674 594 A 41 LYS HGy A 41 LYS HEy 1.0 1.8 3.5 675 595 A 41 LYS HDx A 41 LYS HEx 1.0 1.8 2.7 676 595 A 41 LYS HDy A 41 LYS HEx 1.0 1.8 2.7 677 595 A 41 LYS HEy A 41 LYS HDx 1.0 1.8 2.7 678 595 A 41 LYS HDy A 41 LYS HEy 1.0 1.8 2.7 679 596 A 41 LYS HGx A 41 LYS HEx 1.0 1.8 3.5 680 596 A 41 LYS HGx A 41 LYS HEy 1.0 1.8 3.5 681 597 A 51 HIS HA A 51 HIS H 1.0 1.8 3.5 682 598 A 30 PRO HBy A 30 PRO HDy 1.0 1.8 5.0 683 599 A 29 LYS H A 29 LYS HDx 1.0 1.8 5.0 684 599 A 29 LYS H A 29 LYS HDy 1.0 1.8 5.0 685 600 A 30 PRO HDx A 30 PRO HA 1.0 1.8 3.5 686 601 A 30 PRO HBx A 30 PRO HDx 1.0 1.8 5.0 687 602 A 42 ARG HGx A 42 ARG HGy 1.0 1.8 2.7 688 603 A 31 PHE H A 29 LYS H 1.0 1.8 5.0 689 604 A 30 PRO HBx A 30 PRO HDy 1.0 1.8 5.0 690 605 A 30 PRO HDy A 30 PRO HA 1.0 1.8 5.0 691 606 A 30 PRO HBy A 30 PRO HDx 1.0 1.8 3.5 692 607 A 20 ARG HDx A 20 ARG HBy 1.0 1.8 5.0 693 608 A 20 ARG HDx A 20 ARG HDy 1.0 1.8 2.7 694 609 A 31 PHE HA A 31 PHE HD% 1.0 1.8 3.5 695 610 A 42 ARG HGx A 42 ARG HA 1.0 1.8 5.0 696 611 A 42 ARG HBy A 42 ARG HA 1.0 1.8 3.5 697 612 A 14 HIS H A 13 ILE HG1x 1.0 1.8 5.0 698 612 A 13 ILE HG1y A 14 HIS H 1.0 1.8 5.0 699 613 A 31 PHE H A 30 PRO HA 1.0 1.8 3.5 700 614 A 31 PHE H A 30 PRO HBx 1.0 1.8 3.5 701 615 A 10 ILE H A 8 LYS H 1.0 1.8 5.0 702 616 A 21 GLN HE2x A 21 GLN HE2y 1.0 1.8 2.7 703 617 A 9 LEU HDx% A 9 LEU HA 1.0 1.8 5.0 704 618 A 63 LEU HDx% A 63 LEU HG 1.0 1.8 2.7 705 619 A 20 ARG HBx A 20 ARG HA 1.0 1.8 2.7 706 620 A 10 ILE H A 9 LEU HBx 1.0 1.8 5.0 707 621 A 63 LEU HA A 63 LEU HG 1.0 1.8 3.5 708 622 A 42 ARG HBy A 42 ARG HBx 1.0 1.8 2.7 709 623 A 52 TYR H A 51 HIS HA 1.0 1.8 2.7 710 624 A 53 GLN HGy A 53 GLN HGx 1.0 1.8 2.7 711 625 A 14 HIS HA A 14 HIS HBy 1.0 1.8 2.7 712 626 A 9 LEU HDy% A 9 LEU HA 1.0 1.8 3.5 713 627 A 53 GLN HA A 53 GLN HGx 1.0 1.8 5.0 714 628 A 37 LEU HDx% A 37 LEU H 1.0 1.8 5.0 715 629 A 37 LEU H A 36 ASP HBx 1.0 1.8 5.0 716 630 A 29 LYS HA A 29 LYS HGx 1.0 1.8 3.5 717 630 A 29 LYS HGy A 29 LYS HA 1.0 1.8 3.5 718 631 A 28 GLN HBy A 28 GLN HGx 1.0 1.8 2.7 719 631 A 28 GLN HGy A 28 GLN HBy 1.0 1.8 2.7 720 632 A 20 ARG HBy A 20 ARG HGx 1.0 1.8 2.7 721 632 A 20 ARG HBy A 20 ARG HGy 1.0 1.8 2.7 722 633 A 20 ARG HDy A 20 ARG HGx 1.0 1.8 2.7 723 633 A 20 ARG HGy A 20 ARG HDy 1.0 1.8 2.7 724 634 A 22 VAL H A 21 GLN HA 1.0 1.8 2.7 725 635 A 9 LEU HDx% A 9 LEU HG 1.0 1.8 2.7 726 636 A 28 GLN H A 28 GLN HA 1.0 1.8 3.5 727 637 A 28 GLN H A 28 GLN HBx 1.0 1.8 2.7 728 638 A 37 LEU HBy A 37 LEU HG 1.0 1.8 3.5 729 639 A 30 PRO HBy A 30 PRO HGx 1.0 1.8 2.7 730 639 A 30 PRO HGy A 30 PRO HBy 1.0 1.8 2.7 731 640 A 6 ASP H A 3 THR HA 1.0 1.8 5.0 732 641 A 9 LEU HDy% A 9 LEU HG 1.0 1.8 2.7 733 642 A 37 LEU HBy A 37 LEU HA 1.0 1.8 2.7 734 643 A 13 ILE HG2% A 13 ILE H 1.0 1.8 5.0 735 644 A 9 LEU HBx A 9 LEU HA 1.0 1.8 2.7 736 645 A 8 LYS H A 7 PHE HBx 1.0 1.8 3.5 737 646 A 42 ARG HA A 42 ARG HDx 1.0 1.8 5.0 738 646 A 42 ARG HDy A 42 ARG HA 1.0 1.8 5.0 739 647 A 20 ARG HDx A 20 ARG HGx 1.0 1.8 2.7 740 647 A 20 ARG HDx A 20 ARG HGy 1.0 1.8 2.7 741 648 A 61 ALA H A 60 SER H 1.0 1.8 2.7 742 649 A 31 PHE H A 31 PHE HE% 1.0 1.8 5.0 743 650 A 53 GLN HA A 54 ILE H 1.0 1.8 2.7 744 651 A 31 PHE HA A 32 GLU H 1.0 1.8 3.5 745 652 A 34 LEU HBx A 34 LEU HBy 1.0 1.8 2.7 746 653 A 8 LYS HBx A 8 LYS HEx 1.0 1.8 5.0 747 653 A 8 LYS HBy A 8 LYS HEx 1.0 1.8 5.0 748 653 A 8 LYS HEy A 8 LYS HBx 1.0 1.8 5.0 749 653 A 8 LYS HBy A 8 LYS HEy 1.0 1.8 5.0 750 654 A 37 LEU HBx A 37 LEU HG 1.0 1.8 2.7 751 655 A 52 TYR H A 52 TYR HA 1.0 1.8 3.5 752 656 A 10 ILE HD1% A 10 ILE HA 1.0 1.8 2.7 753 657 A 52 TYR HD% A 52 TYR H 1.0 1.8 2.7 754 658 A 34 LEU HBx A 35 VAL H 1.0 1.8 3.5 755 659 A 7 PHE H A 7 PHE HD% 1.0 1.8 3.5 756 660 A 13 ILE HG2% A 13 ILE HB 1.0 1.8 2.7 757 661 A 63 LEU HG A 63 LEU HDy% 1.0 1.8 2.7 758 662 A 10 ILE HD1% A 10 ILE HG2% 1.0 1.8 3.5 759 663 A 10 ILE HB A 10 ILE HG2% 1.0 1.8 2.7 760 664 A 20 ARG H A 19 ARG HA 1.0 1.8 2.7 761 665 A 52 TYR HD% A 52 TYR HA 1.0 1.8 3.5 762 666 A 10 ILE HG2% A 10 ILE HG1x 1.0 1.8 2.7 763 666 A 10 ILE HG2% A 10 ILE HG1y 1.0 1.8 2.7 764 667 A 34 LEU HA A 34 LEU H 1.0 1.8 3.5 765 668 A 37 LEU HBx A 37 LEU HA 1.0 1.8 3.5 766 669 A 20 ARG HBx A 20 ARG HDx 1.0 1.8 5.0 767 670 A 9 LEU HA A 9 LEU HG 1.0 1.8 2.7 768 671 A 13 ILE HA A 13 ILE HD1% 1.0 1.8 2.7 769 672 A 28 GLN H A 29 LYS H 1.0 1.8 2.7 770 673 A 9 LEU HBx A 9 LEU HG 1.0 1.8 2.7 771 674 A 8 LYS HGy A 8 LYS HBx 1.0 1.8 2.7 772 674 A 8 LYS HBy A 8 LYS HGy 1.0 1.8 2.7 773 675 A 8 LYS HGx A 8 LYS HBx 1.0 1.8 2.7 774 675 A 8 LYS HBy A 8 LYS HGx 1.0 1.8 2.7 775 676 A 8 LYS HBx A 8 LYS HDx 1.0 1.8 2.7 776 676 A 8 LYS HBy A 8 LYS HDx 1.0 1.8 2.7 777 676 A 8 LYS HDy A 8 LYS HBx 1.0 1.8 2.7 778 676 A 8 LYS HBy A 8 LYS HDy 1.0 1.8 2.7 779 677 A 7 PHE H A 8 LYS H 1.0 1.8 2.7 780 678 A 10 ILE HD1% A 11 ARG H 1.0 1.8 5.0 781 679 A 20 ARG HBy A 20 ARG HA 1.0 1.8 3.5 782 680 A 20 ARG HDy A 20 ARG HA 1.0 1.8 5.0 783 681 A 11 ARG H A 10 ILE HA 1.0 1.8 3.5 784 682 A 42 ARG HGy A 42 ARG HBy 1.0 1.8 3.5 785 683 A 29 LYS HBy A 29 LYS HGx 1.0 1.8 2.7 786 683 A 29 LYS HGy A 29 LYS HBx 1.0 1.8 2.7 787 683 A 29 LYS HGy A 29 LYS HBy 1.0 1.8 2.7 788 683 A 29 LYS HBx A 29 LYS HGx 1.0 1.8 2.7 789 684 A 29 LYS HA A 29 LYS HBx 1.0 1.8 2.7 790 684 A 29 LYS HA A 29 LYS HBy 1.0 1.8 2.7 791 685 A 35 VAL HGx% A 36 ASP H 1.0 1.8 3.5 792 686 A 13 ILE HA A 15 SER H 1.0 1.8 5.0 793 687 A 20 ARG HBx A 20 ARG HBy 1.0 1.8 2.7 794 688 A 19 ARG H A 19 ARG HA 1.0 1.8 3.5 795 689 A 42 ARG HGx A 42 ARG HDx 1.0 1.8 2.7 796 689 A 42 ARG HDy A 42 ARG HGx 1.0 1.8 2.7 797 690 A 42 ARG HBy A 42 ARG HDx 1.0 1.8 3.5 798 690 A 42 ARG HDy A 42 ARG HBy 1.0 1.8 3.5 799 691 A 30 PRO HBx A 30 PRO HGx 1.0 1.8 2.7 800 691 A 30 PRO HGy A 30 PRO HBx 1.0 1.8 2.7 801 692 A 30 PRO HA A 30 PRO HGx 1.0 1.8 3.5 802 692 A 30 PRO HGy A 30 PRO HA 1.0 1.8 3.5 803 693 A 37 LEU HDy% A 37 LEU HG 1.0 1.8 2.7 804 694 A 39 TRP HZ2 A 37 LEU HDx% 1.0 1.8 5.0 805 695 A 52 TYR H A 52 TYR HE% 1.0 1.8 5.0 806 696 A 37 LEU HBx A 37 LEU HBy 1.0 1.8 2.7 807 697 A 9 LEU HBy A 8 LYS H 1.0 1.8 5.0 808 698 A 10 ILE HA A 10 ILE HG1x 1.0 1.8 3.5 809 698 A 10 ILE HG1y A 10 ILE HA 1.0 1.8 3.5 810 699 A 7 PHE H A 7 PHE HBx 1.0 1.8 3.5 811 700 A 8 LYS HA A 8 LYS HGy 1.0 1.8 3.5 812 701 A 8 LYS HA A 8 LYS HGx 1.0 1.8 3.5 813 702 A 8 LYS HA A 8 LYS HDx 1.0 1.8 5.0 814 702 A 8 LYS HA A 8 LYS HDy 1.0 1.8 5.0 815 703 A 13 ILE HG2% A 15 SER H 1.0 1.8 6.0 816 704 A 22 VAL H A 22 VAL HA 1.0 1.8 3.5 817 705 A 54 ILE HA A 54 ILE H 1.0 1.8 3.5 818 706 A 53 GLN HA A 53 GLN HBx 1.0 1.8 3.5 819 707 A 22 VAL HA A 22 VAL HGy% 1.0 1.8 2.7 820 708 A 22 VAL HGx% A 22 VAL HA 1.0 1.8 2.7 821 709 A 2 ALA HB% A 6 ASP H 1.0 1.8 5.0 822 710 A 6 ASP H A 3 THR H 1.0 1.8 3.5 823 711 A 34 LEU HBy A 34 LEU HA 1.0 1.8 2.7 824 712 A 6 ASP H A 3 THR HG2% 1.0 1.8 2.7 825 713 A 39 TRP H A 38 GLY HAy 1.0 1.8 3.5 826 714 A 35 VAL H A 35 VAL HB 1.0 1.8 2.7 827 715 A 8 LYS HA A 8 LYS HEx 1.0 1.8 5.0 828 715 A 8 LYS HA A 8 LYS HEy 1.0 1.8 5.0 829 716 A 13 ILE HD1% A 13 ILE HB 1.0 1.8 3.5 830 717 A 42 ARG HBx A 42 ARG HDx 1.0 1.8 3.5 831 717 A 42 ARG HDy A 42 ARG HBx 1.0 1.8 3.5 832 718 A 7 PHE HD% A 8 LYS H 1.0 1.8 5.0 833 719 A 14 HIS HBy A 15 SER H 1.0 1.8 5.0 834 720 A 27 GLU HBy A 27 GLU H 1.0 1.8 3.5 835 721 A 31 PHE HA A 31 PHE HBy 1.0 1.8 2.7 836 722 A 19 ARG H A 19 ARG HBy 1.0 1.8 5.0 837 723 A 19 ARG H A 19 ARG HGx 1.0 1.8 5.0 838 723 A 19 ARG H A 19 ARG HGy 1.0 1.8 5.0 839 724 A 37 LEU HDy% A 37 LEU HA 1.0 1.8 2.7 840 725 A 31 PHE HD% A 31 PHE HBy 1.0 1.8 2.7 841 726 A 62 ALA H A 63 LEU HBy 1.0 1.8 5.0 842 727 A 42 ARG HGx A 42 ARG HBy 1.0 1.8 2.7 843 728 A 13 ILE HB A 13 ILE HG1x 1.0 1.8 2.7 844 728 A 13 ILE HB A 13 ILE HG1y 1.0 1.8 2.7 845 729 A 54 ILE H A 53 GLN HGy 1.0 1.8 3.5 846 730 A 10 ILE HD1% A 10 ILE HG1x 1.0 1.8 2.7 847 730 A 10 ILE HD1% A 10 ILE HG1y 1.0 1.8 2.7 848 731 A 42 ARG HGy A 42 ARG HDx 1.0 1.8 2.7 849 731 A 42 ARG HDy A 42 ARG HGy 1.0 1.8 2.7 850 732 A 9 LEU H A 8 LYS HA 1.0 1.8 3.5 851 733 A 7 PHE HA A 8 LYS H 1.0 1.8 3.5 852 734 A 36 ASP HBy A 36 ASP H 1.0 1.8 2.7 853 735 A 13 ILE HD1% A 13 ILE HG1x 1.0 1.8 2.7 854 735 A 13 ILE HD1% A 13 ILE HG1y 1.0 1.8 2.7 855 736 A 53 GLN HGy A 53 GLN HBy 1.0 1.8 3.5 856 737 A 53 GLN HBx A 53 GLN HGx 1.0 1.8 2.7 857 738 A 7 PHE HD% A 4 ALA HA 1.0 1.8 2.7 858 739 A 30 PRO HDx A 29 LYS HGx 1.0 1.8 5.0 859 739 A 30 PRO HDx A 29 LYS HGy 1.0 1.8 5.0 860 740 A 14 HIS HBx A 14 HIS HA 1.0 1.8 3.5 861 741 A 14 HIS HA A 14 HIS HD2 1.0 1.8 5.0 862 742 A 30 PRO HDx A 29 LYS HA 1.0 1.8 5.0 863 743 A 13 ILE HA A 13 ILE HB 1.0 1.8 3.5 864 744 A 7 PHE H A 7 PHE HBy 1.0 1.8 2.7 865 745 A 53 GLN HA A 53 GLN HBy 1.0 1.8 2.7 866 746 A 29 LYS HDx A 29 LYS HGx 1.0 1.8 2.7 867 746 A 29 LYS HGy A 29 LYS HDx 1.0 1.8 2.7 868 746 A 29 LYS HGy A 29 LYS HDy 1.0 1.8 2.7 869 746 A 29 LYS HDy A 29 LYS HGx 1.0 1.8 2.7 870 747 A 29 LYS HA A 29 LYS HDx 1.0 1.8 5.0 871 747 A 29 LYS HA A 29 LYS HDy 1.0 1.8 5.0 872 748 A 28 GLN HBy A 28 GLN HBx 1.0 1.8 2.7 873 749 A 28 GLN HBx A 28 GLN HGx 1.0 1.8 2.7 874 749 A 28 GLN HGy A 28 GLN HBx 1.0 1.8 2.7 875 750 A 28 GLN HBy A 28 GLN HA 1.0 1.8 3.5 876 751 A 28 GLN HA A 28 GLN HGx 1.0 1.8 2.7 877 751 A 28 GLN HGy A 28 GLN HA 1.0 1.8 2.7 878 752 A 28 GLN HE2y A 28 GLN HGx 1.0 1.8 2.7 879 752 A 28 GLN HE2y A 28 GLN HGy 1.0 1.8 2.7 880 753 A 28 GLN HE2x A 28 GLN HGx 1.0 1.8 3.5 881 753 A 28 GLN HE2x A 28 GLN HGy 1.0 1.8 3.5 882 754 A 62 ALA H A 64 ARG H 1.0 1.8 5.0 883 755 A 35 VAL H A 34 LEU H 1.0 1.8 2.7 884 756 A 53 GLN H A 53 GLN HBx 1.0 1.8 2.7 885 757 A 20 ARG HBy A 20 ARG HDy 1.0 1.8 5.0 886 758 A 13 ILE HG2% A 13 ILE HD1% 1.0 1.8 2.7 887 759 A 13 ILE HG2% A 13 ILE HG1x 1.0 1.8 2.7 888 759 A 13 ILE HG2% A 13 ILE HG1y 1.0 1.8 2.7 889 760 A 13 ILE HA A 13 ILE HG1x 1.0 1.8 3.5 890 760 A 13 ILE HA A 13 ILE HG1y 1.0 1.8 3.5 891 761 A 34 LEU HBx A 34 LEU HDy% 1.0 1.8 3.5 892 762 A 30 PRO HBx A 30 PRO HBy 1.0 1.8 2.7 893 763 A 30 PRO HBy A 30 PRO HA 1.0 1.8 2.7 894 764 A 37 LEU HDx% A 37 LEU HG 1.0 1.8 2.7 895 765 A 32 GLU H A 32 GLU HBx 1.0 1.8 2.7 896 765 A 32 GLU H A 32 GLU HBy 1.0 1.8 2.7 897 766 A 35 VAL HGx% A 37 LEU H 1.0 1.8 5.0 898 767 A 39 TRP HBx A 40 LEU HG 1.0 1.8 3.5 899 768 A 13 ILE HG2% A 13 ILE HA 1.0 1.8 2.7 900 769 A 31 PHE HA A 31 PHE HBx 1.0 1.8 3.5 901 770 A 31 PHE HD% A 31 PHE HBx 1.0 1.8 2.7 902 771 A 22 VAL HA A 23 PHE H 1.0 1.8 2.7 903 772 A 8 LYS H A 7 PHE HBy 1.0 1.8 3.5 904 773 A 34 LEU HBy A 35 VAL H 1.0 1.8 5.0 905 774 A 9 LEU H A 8 LYS HBx 1.0 1.8 2.7 906 774 A 9 LEU H A 8 LYS HBy 1.0 1.8 2.7 907 775 A 36 ASP H A 36 ASP HA 1.0 1.8 3.5 908 776 A 37 LEU HDx% A 37 LEU HA 1.0 1.8 5.0 909 777 A 11 ARG H A 10 ILE HG1x 1.0 1.8 5.0 910 777 A 10 ILE HG1y A 11 ARG H 1.0 1.8 5.0 911 778 A 34 LEU HBx A 34 LEU HDx% 1.0 1.8 2.7 912 779 A 8 LYS HGy A 8 LYS HEx 1.0 1.8 3.5 913 779 A 8 LYS HGy A 8 LYS HEy 1.0 1.8 3.5 914 780 A 8 LYS HGx A 8 LYS HEx 1.0 1.8 3.5 915 780 A 8 LYS HGx A 8 LYS HEy 1.0 1.8 3.5 916 781 A 8 LYS HDy A 8 LYS HEx 1.0 1.8 2.7 917 781 A 8 LYS HDx A 8 LYS HEx 1.0 1.8 2.7 918 781 A 8 LYS HEy A 8 LYS HDx 1.0 1.8 2.7 919 781 A 8 LYS HDy A 8 LYS HEy 1.0 1.8 2.7 920 782 A 35 VAL HA A 36 ASP H 1.0 1.8 3.5 921 783 A 40 LEU HDx% A 39 TRP HBx 1.0 1.8 5.0 922 784 A 34 LEU H A 33 ASP H 1.0 1.8 2.7 923 785 A 54 ILE H A 53 GLN HGx 1.0 1.8 5.0 924 786 A 41 LYS HA A 42 ARG HGy 1.0 1.8 5.0 925 787 A 52 TYR H A 52 TYR HBy 1.0 1.8 2.7 926 788 A 34 LEU HA A 37 LEU HDx% 1.0 1.8 2.7 927 789 A 37 LEU HDy% A 37 LEU HBy 1.0 1.8 2.7 928 790 A 52 TYR HBx A 52 TYR H 1.0 1.8 5.0 929 791 A 53 GLN HBx A 53 GLN HBy 1.0 1.8 2.7 930 792 A 54 ILE HA A 54 ILE HG2% 1.0 1.8 2.7 931 793 A 39 TRP H A 37 LEU HA 1.0 1.8 5.0 932 794 A 53 GLN HBx A 53 GLN HGy 1.0 1.8 3.5 933 795 A 53 GLN HGx A 53 GLN HBy 1.0 1.8 3.5 934 796 A 52 TYR HA A 52 TYR HBy 1.0 1.8 3.5 935 797 A 52 TYR HBx A 52 TYR HA 1.0 1.8 2.7 936 798 A 52 TYR HD% A 52 TYR HBy 1.0 1.8 2.7 937 799 A 52 TYR HD% A 52 TYR HBx 1.0 1.8 2.7 938 800 A 52 TYR HD% A 52 TYR HE% 1.0 1.8 2.7 939 801 A 22 VAL H A 21 GLN HBx 1.0 1.8 5.0 940 802 A 20 ARG H A 19 ARG HDx 1.0 1.8 6.0 941 802 A 20 ARG H A 19 ARG HDy 1.0 1.8 6.0 942 803 A 20 ARG H A 19 ARG HGx 1.0 1.8 5.0 943 803 A 20 ARG H A 19 ARG HGy 1.0 1.8 5.0 944 804 A 20 ARG H A 19 ARG H 1.0 1.8 5.0 945 805 A 20 ARG H A 19 ARG HBy 1.0 1.8 5.0 946 806 A 28 GLN HE2y A 28 GLN HE2x 1.0 1.8 2.7 947 807 A 29 LYS HBy A 29 LYS HDx 1.0 1.8 3.5 948 807 A 29 LYS HDy A 29 LYS HBx 1.0 1.8 3.5 949 807 A 29 LYS HBy A 29 LYS HDy 1.0 1.8 3.5 950 807 A 29 LYS HBx A 29 LYS HDx 1.0 1.8 3.5 951 808 A 28 GLN HA A 28 GLN HBx 1.0 1.8 3.5 952 809 A 8 LYS HGy A 8 LYS HGx 1.0 1.8 2.7 953 810 A 8 LYS HGy A 8 LYS HDx 1.0 1.8 2.7 954 810 A 8 LYS HDy A 8 LYS HGy 1.0 1.8 2.7 955 811 A 8 LYS HGx A 8 LYS HDx 1.0 1.8 2.7 956 811 A 8 LYS HDy A 8 LYS HGx 1.0 1.8 2.7 957 812 A 62 ALA HA A 63 LEU H 1.0 1.8 3.5 958 813 A 53 GLN H A 53 GLN HBy 1.0 1.8 5.0 959 814 A 35 VAL HA A 35 VAL HGx% 1.0 1.8 2.7 960 815 A 41 LYS HA A 42 ARG HGx 1.0 1.8 5.0 961 816 A 38 GLY H A 36 ASP HBy 1.0 1.8 5.0 962 817 A 13 ILE H A 12 ASP H 1.0 1.8 2.7 963 818 A 35 VAL HGx% A 35 VAL HB 1.0 1.8 2.7 964 819 A 62 ALA HB% A 63 LEU HBy 1.0 1.8 5.0 965 820 A 37 LEU HDy% A 37 LEU HBx 1.0 1.8 3.5 966 821 A 31 PHE HBy A 31 PHE HBx 1.0 1.8 2.7 967 822 A 19 ARG HA A 19 ARG HGx 1.0 1.8 3.5 968 822 A 19 ARG HA A 19 ARG HGy 1.0 1.8 3.5 969 823 A 19 ARG HA A 19 ARG HBy 1.0 1.8 3.5 970 824 A 19 ARG HA A 19 ARG HDx 1.0 1.8 5.0 971 824 A 19 ARG HA A 19 ARG HDy 1.0 1.8 5.0 972 825 A 30 PRO HDy A 29 LYS HA 1.0 1.8 5.0 973 826 A 30 PRO HDy A 29 LYS HGx 1.0 1.8 5.0 974 826 A 30 PRO HDy A 29 LYS HGy 1.0 1.8 5.0 975 827 A 34 LEU HBx A 34 LEU HA 1.0 1.8 3.5 976 828 A 21 GLN HA A 22 VAL HGy% 1.0 1.8 3.5 977 829 A 34 LEU HBy A 34 LEU HDy% 1.0 1.8 2.7 978 830 A 30 PRO HBx A 30 PRO HA 1.0 1.8 2.7 979 831 A 34 LEU HA A 34 LEU HDy% 1.0 1.8 5.0 980 832 A 10 ILE HD1% A 10 ILE HB 1.0 1.8 2.7 981 833 A 37 LEU HDx% A 37 LEU HDy% 1.0 1.8 2.7 982 834 A 37 LEU HDx% A 37 LEU HBx 1.0 1.8 2.7 983 835 A 22 VAL H A 22 VAL HGy% 1.0 1.8 2.7 984 836 A 14 HIS HBx A 14 HIS HBy 1.0 1.8 2.7 985 837 A 14 HIS HBy A 14 HIS HD2 1.0 1.8 5.0 986 838 A 58 GLY H A 55 THR H 1.0 1.8 3.5 987 839 A 35 VAL HGy% A 32 GLU HA 1.0 1.8 2.7 988 840 A 27 GLU HBy A 27 GLU HA 1.0 1.8 3.5 989 841 A 52 TYR HBx A 52 TYR HBy 1.0 1.8 2.7 990 842 A 34 LEU HA A 34 LEU HDx% 1.0 1.8 5.0 991 843 A 7 PHE H A 7 PHE HA 1.0 1.8 2.7 992 844 A 54 ILE HD1% A 54 ILE H 1.0 1.8 5.0 993 845 A 54 ILE H A 54 ILE HB 1.0 1.8 5.0 994 846 A 22 VAL H A 21 GLN HGx 1.0 1.8 6.0 995 847 A 51 HIS H A 51 HIS HBx 1.0 1.8 2.7 996 848 A 22 VAL HA A 22 VAL HB 1.0 1.8 3.5 997 849 A 34 LEU HBy A 34 LEU HDx% 1.0 1.8 3.5 998 850 A 51 HIS H A 51 HIS HBy 1.0 1.8 5.0 999 851 A 13 ILE H A 12 ASP HBx 1.0 1.8 2.7 1000 852 A 31 PHE HBy A 32 GLU H 1.0 1.8 5.0 1001 853 A 39 TRP HE1 A 37 LEU HBy 1.0 1.8 5.0 1002 854 A 21 GLN H A 20 ARG HGx 1.0 1.8 3.5 1003 854 A 20 ARG HGy A 21 GLN H 1.0 1.8 3.5 1004 855 A 7 PHE HD% A 7 PHE HA 1.0 1.8 3.5 1005 856 A 14 HIS H A 12 ASP H 1.0 1.8 5.0 1006 857 A 37 LEU HDx% A 37 LEU HBy 1.0 1.8 2.7 1007 858 A 10 ILE HB A 10 ILE HA 1.0 1.8 2.7 1008 859 A 14 HIS HD2 A 15 SER H 1.0 1.8 5.0 1009 860 A 14 HIS HBx A 15 SER H 1.0 1.8 2.7 1010 861 A 6 ASP H A 4 ALA HB% 1.0 1.8 5.0 1011 862 A 14 HIS H A 12 ASP HA 1.0 1.8 5.0 1012 863 A 19 ARG HBy A 19 ARG HGx 1.0 1.8 2.7 1013 863 A 19 ARG HGy A 19 ARG HBy 1.0 1.8 2.7 1014 864 A 19 ARG HDx A 19 ARG HGx 1.0 1.8 2.7 1015 864 A 19 ARG HDy A 19 ARG HGx 1.0 1.8 2.7 1016 864 A 19 ARG HGy A 19 ARG HDx 1.0 1.8 2.7 1017 864 A 19 ARG HGy A 19 ARG HDy 1.0 1.8 2.7 1018 865 A 19 ARG HBy A 19 ARG HDx 1.0 1.8 3.5 1019 865 A 19 ARG HBy A 19 ARG HDy 1.0 1.8 3.5 1020 866 A 27 GLU H A 27 GLU HBx 1.0 1.8 3.5 1021 867 A 27 GLU H A 27 GLU HGx 1.0 1.8 5.0 1022 868 A 27 GLU H A 27 GLU HGy 1.0 1.8 5.0 1023 869 A 19 ARG H A 19 ARG HBx 1.0 1.8 5.0 1024 870 A 28 GLN H A 27 GLU H 1.0 1.8 2.7 1025 871 A 58 GLY HAx A 61 ALA H 1.0 1.8 3.5 1026 872 A 51 HIS HD2 A 51 HIS H 1.0 1.8 3.5 1027 873 A 54 ILE H A 53 GLN HBx 1.0 1.8 5.0 1028 874 A 14 HIS HBx A 14 HIS HD2 1.0 1.8 2.7 1029 875 A 39 TRP HD1 A 38 GLY HAx 1.0 1.8 5.0 1030 876 A 11 ARG H A 9 LEU HBy 1.0 1.8 5.0 1031 877 A 30 PRO HDx A 29 LYS HDx 1.0 1.8 5.0 1032 877 A 30 PRO HDx A 29 LYS HDy 1.0 1.8 5.0 1033 878 A 51 HIS HA A 51 HIS HBy 1.0 1.8 2.7 1034 879 A 35 VAL HA A 35 VAL HGy% 1.0 1.8 2.7 1035 880 A 62 ALA HB% A 64 ARG H 1.0 1.8 5.0 1036 881 A 11 ARG H A 8 LYS H 1.0 1.8 5.0 1037 882 A 29 LYS HEy A 29 LYS HGx 1.0 1.8 2.7 1038 882 A 29 LYS HGy A 29 LYS HEx 1.0 1.8 2.7 1039 882 A 29 LYS HGy A 29 LYS HEy 1.0 1.8 2.7 1040 882 A 29 LYS HEx A 29 LYS HGx 1.0 1.8 2.7 1041 883 A 29 LYS HA A 29 LYS HEx 1.0 1.8 5.0 1042 883 A 29 LYS HA A 29 LYS HEy 1.0 1.8 5.0 1043 884 A 62 ALA H A 62 ALA HB% 1.0 1.8 2.7 1044 885 A 11 ARG HA A 14 HIS H 1.0 1.8 3.5 1045 886 A 35 VAL H A 34 LEU HA 1.0 1.8 3.5 1046 887 A 10 ILE HB A 10 ILE HG1x 1.0 1.8 2.7 1047 887 A 10 ILE HB A 10 ILE HG1y 1.0 1.8 2.7 1048 888 A 7 PHE HA A 7 PHE HBx 1.0 1.8 2.7 1049 889 A 22 VAL H A 21 GLN HGy 1.0 1.8 5.0 1050 890 A 52 TYR HD% A 51 HIS HA 1.0 1.8 5.0 1051 891 A 7 PHE HBx A 7 PHE HBy 1.0 1.8 2.7 1052 892 A 61 ALA H A 59 THR HA 1.0 1.8 5.0 1053 893 A 62 ALA H A 63 LEU HBx 1.0 1.8 5.0 1054 894 A 9 LEU HDy% A 12 ASP HBy 1.0 1.8 5.0 1055 895 A 32 GLU HA A 32 GLU H 1.0 1.8 3.5 1056 896 A 15 SER H A 15 SER HA 1.0 1.8 3.5 1057 897 A 10 ILE HG2% A 7 PHE HD% 1.0 1.8 3.5 1058 898 A 36 ASP HBy A 36 ASP HA 1.0 1.8 3.5 1059 899 A 31 PHE HD% A 31 PHE HE% 1.0 1.8 2.7 1060 900 A 59 THR H A 55 THR H 1.0 1.8 5.0 1061 901 A 29 LYS HBy A 29 LYS HEx 1.0 1.8 5.0 1062 901 A 29 LYS HBx A 29 LYS HEx 1.0 1.8 5.0 1063 901 A 29 LYS HEy A 29 LYS HBx 1.0 1.8 5.0 1064 901 A 29 LYS HBy A 29 LYS HEy 1.0 1.8 5.0 1065 902 A 13 ILE HA A 16 THR H 1.0 1.8 5.0 1066 903 A 35 VAL H A 37 LEU H 1.0 1.8 5.0 1067 904 A 7 PHE HD% A 3 THR HG2% 1.0 1.8 5.0 1068 905 A 31 PHE HBx A 28 GLN HA 1.0 1.8 2.7 1069 906 A 59 THR H A 61 ALA H 1.0 1.8 5.0 1070 907 A 7 PHE HD% A 7 PHE HBx 1.0 1.8 2.7 1071 908 A 36 ASP HBy A 37 LEU HG 1.0 1.8 3.5 1072 909 A 54 ILE H A 53 GLN HBy 1.0 1.8 5.0 1073 910 A 13 ILE H A 12 ASP HA 1.0 1.8 3.5 1074 911 A 62 ALA H A 63 LEU HA 1.0 1.8 6.0 1075 912 A 31 PHE H A 32 GLU HBx 1.0 1.8 5.0 1076 912 A 31 PHE H A 32 GLU HBy 1.0 1.8 5.0 1077 913 A 38 GLY H A 38 GLY HAx 1.0 1.8 3.5 1078 914 A 53 GLN HA A 54 ILE HG2% 1.0 1.8 5.0 1079 915 A 22 VAL HGx% A 22 VAL H 1.0 1.8 5.0 1080 916 A 54 ILE HD1% A 54 ILE HG2% 1.0 1.8 2.7 1081 917 A 54 ILE HG2% A 54 ILE HB 1.0 1.8 2.7 1082 918 A 41 LYS H A 42 ARG H 1.0 1.8 5.0 1083 919 A 29 LYS H A 30 PRO HGx 1.0 1.8 5.0 1084 919 A 30 PRO HGy A 29 LYS H 1.0 1.8 5.0 1085 920 A 22 VAL HGx% A 22 VAL HGy% 1.0 1.8 2.7 1086 921 A 35 VAL HGy% A 35 VAL HB 1.0 1.8 2.7 1087 922 A 13 ILE HG2% A 14 HIS HA 1.0 1.8 5.0 1088 923 A 41 LYS HBx A 42 ARG H 1.0 1.8 5.0 1089 924 A 52 TYR HBx A 52 TYR HE% 1.0 1.8 5.0 1090 925 A 29 LYS HDy A 29 LYS HEx 1.0 1.8 2.7 1091 925 A 29 LYS HDx A 29 LYS HEx 1.0 1.8 2.7 1092 925 A 29 LYS HEy A 29 LYS HDx 1.0 1.8 2.7 1093 925 A 29 LYS HDy A 29 LYS HEy 1.0 1.8 2.7 1094 926 A 50 THR HG2% A 51 HIS H 1.0 1.8 3.5 1095 927 A 40 LEU H A 38 GLY HAx 1.0 1.8 5.0 1096 928 A 20 ARG HA A 21 GLN H 1.0 1.8 2.7 1097 929 A 20 ARG H A 21 GLN H 1.0 1.8 5.0 1098 930 A 7 PHE HD% A 7 PHE HBy 1.0 1.8 2.7 1099 931 A 13 ILE HB A 10 ILE HA 1.0 1.8 5.0 1100 932 A 9 LEU HDy% A 12 ASP HBx 1.0 1.8 5.0 1101 933 A 10 ILE HG2% A 7 PHE HA 1.0 1.8 2.7 1102 934 A 64 ARG H A 64 ARG HA 1.0 1.8 3.5 1103 935 A 64 ARG H A 64 ARG HBx 1.0 1.8 3.5 1104 935 A 64 ARG H A 64 ARG HBy 1.0 1.8 3.5 1105 936 A 38 GLY H A 36 ASP HA 1.0 1.8 5.0 1106 937 A 62 ALA HB% A 63 LEU HDx% 1.0 1.8 5.0 1107 938 A 15 SER H A 16 THR H 1.0 1.8 2.7 1108 939 A 13 ILE H A 12 ASP HBy 1.0 1.8 5.0 1109 940 A 7 PHE HA A 7 PHE HBy 1.0 1.8 3.5 1110 941 A 11 ARG H A 11 ARG HA 1.0 1.8 3.5 1111 942 A 19 ARG HA A 19 ARG HBx 1.0 1.8 3.5 1112 943 A 31 PHE HE% A 31 PHE HBy 1.0 1.8 5.0 1113 944 A 57 ARG HBy A 57 ARG HGx 1.0 1.8 2.7 1114 944 A 57 ARG HBy A 57 ARG HGy 1.0 1.8 2.7 1115 945 A 57 ARG HBy A 57 ARG HBx 1.0 1.8 2.7 1116 946 A 57 ARG HBy A 57 ARG HA 1.0 1.8 3.5 1117 947 A 36 ASP HBy A 37 LEU HA 1.0 1.8 5.0 1118 948 A 15 SER H A 13 ILE H 1.0 1.8 5.0 1119 949 A 15 SER H A 15 SER HBx 1.0 1.8 2.7 1120 949 A 15 SER H A 15 SER HBy 1.0 1.8 2.7 1121 950 A 22 VAL H A 22 VAL HB 1.0 1.8 2.7 1122 951 A 34 LEU H A 37 LEU HDx% 1.0 1.8 5.0 1123 952 A 6 ASP H A 3 THR HB 1.0 1.8 5.0 1124 953 A 13 ILE HG2% A 16 THR H 1.0 1.8 5.0 1125 954 A 7 PHE H A 3 THR HG2% 1.0 1.8 5.0 1126 955 A 27 GLU HBy A 27 GLU HGx 1.0 1.8 3.5 1127 956 A 27 GLU HBy A 27 GLU HGy 1.0 1.8 3.5 1128 957 A 27 GLU HA A 27 GLU HGx 1.0 1.8 5.0 1129 958 A 27 GLU HA A 27 GLU HGy 1.0 1.8 5.0 1130 959 A 22 VAL HB A 22 VAL HGy% 1.0 1.8 2.7 1131 960 A 22 VAL HGx% A 22 VAL HB 1.0 1.8 2.7 1132 961 A 10 ILE HD1% A 13 ILE HB 1.0 1.8 3.5 1133 962 A 2 ALA HB% A 6 ASP HBy 1.0 1.8 2.7 1134 963 A 2 ALA HB% A 6 ASP HBx 1.0 1.8 3.5 1135 964 A 27 GLU HBy A 27 GLU HBx 1.0 1.8 2.7 1136 965 A 27 GLU HA A 27 GLU HBx 1.0 1.8 3.5 1137 966 A 9 LEU HDy% A 11 ARG H 1.0 1.8 5.0 1138 967 A 51 HIS HA A 51 HIS HD2 1.0 1.8 5.0 1139 968 A 31 PHE HBx A 32 GLU H 1.0 1.8 2.7 1140 969 A 32 GLU H A 33 ASP H 1.0 1.8 2.7 1141 970 A 33 ASP H A 32 GLU HBx 1.0 1.8 3.5 1142 970 A 32 GLU HBy A 33 ASP H 1.0 1.8 3.5 1143 971 A 59 THR HA A 60 SER H 1.0 1.8 3.5 1144 972 A 31 PHE HD% A 32 GLU H 1.0 1.8 5.0 1145 973 A 58 GLY HAx A 60 SER H 1.0 1.8 5.0 1146 974 A 23 PHE HA A 23 PHE H 1.0 1.8 3.5 1147 975 A 39 TRP H A 40 LEU HBx 1.0 1.8 5.0 1148 975 A 40 LEU HBy A 39 TRP H 1.0 1.8 5.0 1149 976 A 50 THR H A 50 THR HA 1.0 1.8 3.5 1150 977 A 2 ALA HB% A 2 ALA H 1.0 1.8 2.7 1151 978 A 31 PHE H A 28 GLN HA 1.0 1.8 5.0 1152 979 A 19 ARG HBx A 19 ARG HGx 1.0 1.8 2.7 1153 979 A 19 ARG HGy A 19 ARG HBx 1.0 1.8 2.7 1154 980 A 19 ARG HBx A 19 ARG HBy 1.0 1.8 2.7 1155 981 A 19 ARG HBx A 19 ARG HDx 1.0 1.8 3.5 1156 981 A 19 ARG HBx A 19 ARG HDy 1.0 1.8 3.5 1157 982 A 53 GLN H A 52 TYR HBy 1.0 1.8 5.0 1158 983 A 53 GLN H A 52 TYR HBx 1.0 1.8 3.5 1159 984 A 53 GLN H A 52 TYR HD% 1.0 1.8 5.0 1160 985 A 53 GLN H A 52 TYR HA 1.0 1.8 2.7 1161 986 A 10 ILE HB A 9 LEU HBy 1.0 1.8 5.0 1162 987 A 31 PHE HD% A 30 PRO HGx 1.0 1.8 2.7 1163 987 A 31 PHE HD% A 30 PRO HGy 1.0 1.8 2.7 1164 988 A 57 ARG HBx A 57 ARG HGx 1.0 1.8 2.7 1165 988 A 57 ARG HGy A 57 ARG HBx 1.0 1.8 2.7 1166 989 A 57 ARG HA A 57 ARG HGx 1.0 1.8 3.5 1167 989 A 57 ARG HGy A 57 ARG HA 1.0 1.8 3.5 1168 990 A 57 ARG HBx A 57 ARG HA 1.0 1.8 3.5 1169 991 A 29 LYS H A 28 GLN HGx 1.0 1.8 5.0 1170 991 A 28 GLN HGy A 29 LYS H 1.0 1.8 5.0 1171 992 A 28 GLN HBy A 29 LYS H 1.0 1.8 5.0 1172 993 A 14 HIS H A 10 ILE HA 1.0 1.8 5.0 1173 994 A 36 ASP H A 36 ASP HBx 1.0 1.8 2.7 1174 995 A 54 ILE HD1% A 54 ILE HA 1.0 1.8 5.0 1175 996 A 54 ILE HA A 54 ILE HB 1.0 1.8 2.7 1176 997 A 10 ILE HG2% A 7 PHE HBx 1.0 1.8 5.0 1177 998 A 27 GLU HBx A 27 GLU HGx 1.0 1.8 3.5 1178 999 A 27 GLU HBx A 27 GLU HGy 1.0 1.8 3.5 1179 1000 A 27 GLU HGx A 27 GLU HGy 1.0 1.8 2.7 1180 1001 A 52 TYR H A 51 HIS HBy 1.0 1.8 5.0 1181 1002 A 52 TYR H A 51 HIS HBx 1.0 1.8 5.0 1182 1003 A 35 VAL HGy% A 34 LEU H 1.0 1.8 5.0 1183 1004 A 15 SER H A 16 THR HA 1.0 1.8 6.0 1184 1005 A 60 SER H A 60 SER HBy 1.0 1.8 2.7 1185 1006 A 61 ALA HB% A 63 LEU H 1.0 1.8 5.0 1186 1007 A 6 ASP H A 5 ASP H 1.0 1.8 2.7 1187 1008 A 6 ASP HBy A 3 THR H 1.0 1.8 3.5 1188 1009 A 6 ASP HBx A 3 THR H 1.0 1.8 5.0 1189 1010 A 36 ASP HBy A 36 ASP HBx 1.0 1.8 2.7 1190 1011 A 35 VAL HGy% A 32 GLU H 1.0 1.8 5.0 1191 1012 A 7 PHE HD% A 3 THR HA 1.0 1.8 5.0 1192 1013 A 14 HIS H A 16 THR H 1.0 1.8 5.0 1193 1014 A 12 ASP H A 12 ASP HBy 1.0 1.8 2.7 1194 1015 A 32 GLU H A 32 GLU HGx 1.0 1.8 2.7 1195 1015 A 32 GLU H A 32 GLU HGy 1.0 1.8 2.7 1196 1016 A 54 ILE HG2% A 53 GLN HGy 1.0 1.8 6.0 1197 1017 A 61 ALA HB% A 61 ALA H 1.0 1.8 2.7 1198 1018 A 15 SER H A 12 ASP HA 1.0 1.8 3.5 1199 1019 A 57 ARG HBy A 58 GLY H 1.0 1.8 5.0 1200 1020 A 55 THR H A 54 ILE H 1.0 1.8 5.0 1201 1021 A 54 ILE HA A 55 THR H 1.0 1.8 2.7 1202 1022 A 55 THR H A 54 ILE HB 1.0 1.8 3.5 1203 1023 A 54 ILE HD1% A 55 THR H 1.0 1.8 5.0 1204 1024 A 3 THR H A 3 THR HA 1.0 1.8 3.5 1205 1025 A 22 VAL HGx% A 23 PHE H 1.0 1.8 3.5 1206 1026 A 51 HIS H A 50 THR HA 1.0 1.8 2.7 1207 1027 A 12 ASP H A 12 ASP HBx 1.0 1.8 2.7 1208 1028 A 55 THR H A 54 ILE HG2% 1.0 1.8 5.0 1209 1029 A 3 THR HA A 3 THR HG2% 1.0 1.8 3.5 1210 1030 A 4 ALA HB% A 5 ASP H 1.0 1.8 2.7 1211 1031 A 23 PHE HA A 22 VAL HA 1.0 1.8 5.0 1212 1032 A 31 PHE HD% A 28 GLN HA 1.0 1.8 3.5 1213 1033 A 34 LEU HBx A 35 VAL HA 1.0 1.8 5.0 1214 1034 A 59 THR HG2% A 60 SER H 1.0 1.8 5.0 1215 1035 A 39 TRP HH2 A 37 LEU HDx% 1.0 1.8 5.0 1216 1036 A 39 TRP HZ3 A 37 LEU HDx% 1.0 1.8 5.0 1217 1037 A 52 TYR H A 51 HIS H 1.0 1.8 5.0 1218 1038 A 31 PHE HA A 32 GLU HBx 1.0 1.8 6.0 1219 1038 A 31 PHE HA A 32 GLU HBy 1.0 1.8 6.0 1220 1039 A 54 ILE HD1% A 54 ILE HB 1.0 1.8 2.7 1221 1040 A 51 HIS HA A 52 TYR HA 1.0 1.8 5.0 1222 1041 A 51 HIS HBx A 51 HIS HBy 1.0 1.8 2.7 1223 1042 A 54 ILE HG2% A 53 GLN HGx 1.0 1.8 6.0 1224 1043 A 11 ARG H A 11 ARG HBx 1.0 1.8 2.7 1225 1043 A 11 ARG H A 11 ARG HBy 1.0 1.8 2.7 1226 1044 A 10 ILE HG2% A 8 LYS HA 1.0 1.8 5.0 1227 1045 A 40 LEU H A 41 LYS HA 1.0 1.8 5.0 1228 1046 A 63 LEU H A 64 ARG HBx 1.0 1.8 5.0 1229 1046 A 64 ARG HBy A 63 LEU H 1.0 1.8 5.0 1230 1047 A 28 GLN H A 27 GLU HBy 1.0 1.8 5.0 1231 1048 A 28 GLN H A 27 GLU HA 1.0 1.8 3.5 1232 1049 A 22 VAL HA A 21 GLN HA 1.0 1.8 5.0 1233 1050 A 20 ARG HDx A 22 VAL HGy% 1.0 1.8 5.0 1234 1051 A 35 VAL HGx% A 36 ASP HA 1.0 1.8 5.0 1235 1052 A 45 VAL HGy% A 45 VAL H 1.0 1.8 2.7 1236 1053 A 61 ALA H A 60 SER HBy 1.0 1.8 5.0 1237 1054 A 40 LEU H A 38 GLY H 1.0 1.8 5.0 1238 1055 A 31 PHE HA A 33 ASP H 1.0 1.8 5.0 1239 1056 A 23 PHE HA A 23 PHE HBx 1.0 1.8 2.7 1240 1056 A 23 PHE HA A 23 PHE HBy 1.0 1.8 2.7 1241 1057 A 35 VAL HGy% A 33 ASP H 1.0 1.8 5.0 1242 1058 A 11 ARG H A 11 ARG HDx 1.0 1.8 5.0 1243 1058 A 11 ARG H A 11 ARG HDy 1.0 1.8 5.0 1244 1059 A 36 ASP HA A 36 ASP HBx 1.0 1.8 2.7 1245 1060 A 64 ARG H A 64 ARG HDx 1.0 1.8 6.0 1246 1060 A 64 ARG H A 64 ARG HDy 1.0 1.8 6.0 1247 1061 A 64 ARG H A 64 ARG HGx 1.0 1.8 5.0 1248 1061 A 64 ARG H A 64 ARG HGy 1.0 1.8 5.0 1249 1062 A 33 ASP H A 33 ASP HBy 1.0 1.8 2.7 1250 1063 A 33 ASP H A 33 ASP HA 1.0 1.8 3.5 1251 1064 A 33 ASP H A 33 ASP HBx 1.0 1.8 3.5 1252 1065 A 12 ASP HBx A 12 ASP HBy 1.0 1.8 2.7 1253 1066 A 16 THR HA A 15 SER HBx 1.0 1.8 5.0 1254 1066 A 15 SER HBy A 16 THR HA 1.0 1.8 5.0 1255 1067 A 3 THR H A 3 THR HG2% 1.0 1.8 2.7 1256 1068 A 57 ARG HBy A 57 ARG HDy 1.0 1.8 5.0 1257 1069 A 57 ARG HBy A 57 ARG HDx 1.0 1.8 3.5 1258 1070 A 9 LEU HA A 8 LYS HBx 1.0 1.8 5.0 1259 1070 A 8 LYS HBy A 9 LEU HA 1.0 1.8 5.0 1260 1071 A 22 VAL HGy% A 20 ARG HGx 1.0 1.8 2.7 1261 1071 A 20 ARG HGy A 22 VAL HGy% 1.0 1.8 2.7 1262 1072 A 51 HIS HA A 50 THR HG2% 1.0 1.8 5.0 1263 1073 A 38 GLY H A 38 GLY HAy 1.0 1.8 2.7 1264 1074 A 35 VAL HA A 37 LEU H 1.0 1.8 5.0 1265 1075 A 42 ARG HBx A 43 SER H 1.0 1.8 5.0 1266 1076 A 1 MET HA A 1 MET HBx 1.0 1.8 3.5 1267 1077 A 46 ASP H A 46 ASP HA 1.0 1.8 3.5 1268 1078 A 35 VAL H A 36 ASP HA 1.0 1.8 6.0 1269 1079 A 7 PHE H A 3 THR H 1.0 1.8 5.0 1270 1080 A 46 ASP H A 45 VAL HB 1.0 1.8 5.0 1271 1081 A 45 VAL H A 46 ASP H 1.0 1.8 5.0 1272 1082 A 10 ILE HD1% A 13 ILE HD1% 1.0 1.8 3.5 1273 1083 A 45 VAL HA A 46 ASP H 1.0 1.8 2.7 1274 1084 A 9 LEU HDx% A 10 ILE HA 1.0 1.8 6.0 1275 1085 A 31 PHE HBy A 28 GLN HA 1.0 1.8 5.0 1276 1086 A 31 PHE H A 29 LYS HBx 1.0 1.8 5.0 1277 1086 A 31 PHE H A 29 LYS HBy 1.0 1.8 5.0 1278 1087 A 34 LEU H A 33 ASP HA 1.0 1.8 3.5 1279 1088 A 34 LEU H A 33 ASP HBx 1.0 1.8 3.5 1280 1089 A 42 ARG HA A 43 SER H 1.0 1.8 2.7 1281 1090 A 42 ARG H A 43 SER H 1.0 1.8 5.0 1282 1091 A 50 THR H A 51 HIS H 1.0 1.8 5.0 1283 1092 A 50 THR HB A 51 HIS H 1.0 1.8 5.0 1284 1093 A 12 ASP H A 12 ASP HA 1.0 1.8 3.5 1285 1094 A 19 ARG H A 18 GLY H 1.0 1.8 3.5 1286 1095 A 42 ARG HBy A 43 SER H 1.0 1.8 5.0 1287 1096 A 34 LEU H A 33 ASP HBy 1.0 1.8 5.0 1288 1097 A 50 THR HG2% A 50 THR H 1.0 1.8 5.0 1289 1098 A 31 PHE HD% A 30 PRO HDy 1.0 1.8 3.5 1290 1099 A 23 PHE H A 23 PHE HBx 1.0 1.8 3.5 1291 1099 A 23 PHE HBy A 23 PHE H 1.0 1.8 3.5 1292 1100 A 12 ASP HBx A 12 ASP HA 1.0 1.8 3.5 1293 1101 A 32 GLU HA A 32 GLU HBx 1.0 1.8 2.7 1294 1101 A 32 GLU HA A 32 GLU HBy 1.0 1.8 2.7 1295 1102 A 12 ASP HA A 12 ASP HBy 1.0 1.8 2.7 1296 1103 A 59 THR HB A 60 SER H 1.0 1.8 5.0 1297 1104 A 13 ILE HB A 14 HIS HA 1.0 1.8 5.0 1298 1105 A 31 PHE HA A 30 PRO HGx 1.0 1.8 5.0 1299 1105 A 31 PHE HA A 30 PRO HGy 1.0 1.8 5.0 1300 1106 A 57 ARG HDy A 57 ARG HGx 1.0 1.8 2.7 1301 1106 A 57 ARG HDy A 57 ARG HGy 1.0 1.8 2.7 1302 1107 A 57 ARG HDx A 57 ARG HGx 1.0 1.8 2.7 1303 1107 A 57 ARG HGy A 57 ARG HDx 1.0 1.8 2.7 1304 1108 A 57 ARG HBx A 57 ARG HDx 1.0 1.8 5.0 1305 1109 A 57 ARG HDy A 57 ARG HA 1.0 1.8 5.0 1306 1110 A 57 ARG HDx A 57 ARG HA 1.0 1.8 5.0 1307 1111 A 57 ARG HDy A 57 ARG HBx 1.0 1.8 5.0 1308 1112 A 59 THR H A 59 THR HG2% 1.0 1.8 5.0 1309 1113 A 7 PHE HD% A 4 ALA HB% 1.0 1.8 5.0 1310 1114 A 59 THR H A 59 THR HA 1.0 1.8 3.5 1311 1115 A 41 LYS HBx A 40 LEU HA 1.0 1.8 5.0 1312 1116 A 39 TRP HD1 A 37 LEU HBy 1.0 1.8 5.0 1313 1117 A 58 GLY HAx A 58 GLY H 1.0 1.8 3.5 1314 1118 A 51 HIS HD2 A 51 HIS HBy 1.0 1.8 5.0 1315 1119 A 51 HIS HD2 A 51 HIS HBx 1.0 1.8 5.0 1316 1120 A 1 MET HBy A 1 MET HBx 1.0 1.8 2.7 1317 1121 A 1 MET HBy A 1 MET HA 1.0 1.8 3.5 1318 1122 A 52 TYR HE% A 50 THR HG2% 1.0 1.8 3.5 1319 1123 A 9 LEU HDy% A 13 ILE HD1% 1.0 1.8 2.7 1320 1124 A 62 ALA H A 61 ALA H 1.0 1.8 2.7 1321 1125 A 6 ASP HBy A 6 ASP H 1.0 1.8 2.7 1322 1126 A 6 ASP HBx A 6 ASP H 1.0 1.8 5.0 1323 1127 A 20 ARG HBx A 22 VAL HGy% 1.0 1.8 5.0 1324 1128 A 23 PHE HD% A 23 PHE H 1.0 1.8 3.5 1325 1129 A 50 THR HG2% A 50 THR HA 1.0 1.8 2.7 1326 1130 A 50 THR HB A 50 THR H 1.0 1.8 3.5 1327 1131 A 61 ALA HB% A 62 ALA H 1.0 1.8 2.7 1328 1132 A 6 ASP H A 5 ASP HBy 1.0 1.8 5.0 1329 1133 A 6 ASP H A 5 ASP HBx 1.0 1.8 5.0 1330 1134 A 32 GLU HBy A 32 GLU HGx 1.0 1.8 2.7 1331 1134 A 32 GLU HBx A 32 GLU HGx 1.0 1.8 2.7 1332 1134 A 32 GLU HGy A 32 GLU HBx 1.0 1.8 2.7 1333 1134 A 32 GLU HBy A 32 GLU HGy 1.0 1.8 2.7 1334 1135 A 6 ASP H A 5 ASP HA 1.0 1.8 3.5 1335 1136 A 62 ALA H A 59 THR HA 1.0 1.8 5.0 1336 1137 A 31 PHE H A 28 GLN HBy 1.0 1.8 6.0 1337 1138 A 60 SER H A 57 ARG HA 1.0 1.8 3.5 1338 1139 A 7 PHE H A 4 ALA HA 1.0 1.8 3.5 1339 1140 A 2 ALA HB% A 3 THR H 1.0 1.8 3.5 1340 1141 A 18 GLY H A 14 HIS HA 1.0 1.8 3.5 1341 1142 A 6 ASP HBx A 3 THR HG2% 1.0 1.8 5.0 1342 1143 A 13 ILE HB A 10 ILE HG1x 1.0 1.8 5.0 1343 1143 A 10 ILE HG1y A 13 ILE HB 1.0 1.8 5.0 1344 1144 A 57 ARG HDy A 57 ARG HDx 1.0 1.8 2.7 1345 1145 A 58 GLY H A 57 ARG HA 1.0 1.8 3.5 1346 1146 A 57 ARG HBx A 58 GLY H 1.0 1.8 5.0 1347 1147 A 23 PHE HD% A 22 VAL HA 1.0 1.8 5.0 1348 1148 A 11 ARG HA A 11 ARG HBx 1.0 1.8 2.7 1349 1148 A 11 ARG HA A 11 ARG HBy 1.0 1.8 2.7 1350 1149 A 22 VAL HA A 23 PHE HBx 1.0 1.8 5.0 1351 1149 A 22 VAL HA A 23 PHE HBy 1.0 1.8 5.0 1352 1150 A 23 PHE H A 22 VAL HB 1.0 1.8 5.0 1353 1151 A 23 PHE H A 22 VAL HGy% 1.0 1.8 5.0 1354 1152 A 58 GLY H A 57 ARG HGx 1.0 1.8 5.0 1355 1152 A 57 ARG HGy A 58 GLY H 1.0 1.8 5.0 1356 1153 A 49 ALA HB% A 49 ALA H 1.0 1.8 3.5 1357 1154 A 59 THR H A 59 THR HB 1.0 1.8 2.7 1358 1155 A 34 LEU HDx% A 37 LEU HDx% 1.0 1.8 5.0 1359 1156 A 34 LEU HDy% A 37 LEU HDx% 1.0 1.8 5.0 1360 1157 A 58 GLY H A 55 THR HB 1.0 1.8 5.0 1361 1158 A 37 LEU H A 38 GLY HAx 1.0 1.8 6.0 1362 1159 A 31 PHE H A 32 GLU HGx 1.0 1.8 5.0 1363 1159 A 31 PHE H A 32 GLU HGy 1.0 1.8 5.0 1364 1160 A 54 ILE HA A 53 GLN HA 1.0 1.8 5.0 1365 1161 A 14 HIS HA A 16 THR H 1.0 1.8 5.0 1366 1162 A 37 LEU HDy% A 36 ASP H 1.0 1.8 6.0 1367 1163 A 4 ALA HA A 7 PHE HBy 1.0 1.8 2.7 1368 1164 A 16 THR HA A 16 THR HG2% 1.0 1.8 3.5 1369 1165 A 7 PHE H A 8 LYS HBx 1.0 1.8 5.0 1370 1165 A 7 PHE H A 8 LYS HBy 1.0 1.8 5.0 1371 1166 A 10 ILE HA A 13 ILE H 1.0 1.8 3.5 1372 1167 A 19 ARG HA A 20 ARG HA 1.0 1.8 5.0 1373 1168 A 15 SER HA A 15 SER HBx 1.0 1.8 2.7 1374 1168 A 15 SER HA A 15 SER HBy 1.0 1.8 2.7 1375 1169 A 50 THR HB A 50 THR HA 1.0 1.8 3.5 1376 1170 A 2 ALA HB% A 2 ALA HA 1.0 1.8 2.7 1377 1171 A 64 ARG HA A 64 ARG HBx 1.0 1.8 2.7 1378 1171 A 64 ARG HBy A 64 ARG HA 1.0 1.8 2.7 1379 1172 A 13 ILE HD1% A 12 ASP HBx 1.0 1.8 3.5 1380 1173 A 62 ALA H A 60 SER H 1.0 1.8 5.0 1381 1174 A 6 ASP HA A 6 ASP H 1.0 1.8 3.5 1382 1175 A 61 ALA H A 63 LEU H 1.0 1.8 5.0 1383 1176 A 38 GLY HAx A 38 GLY HAy 1.0 1.8 2.7 1384 1177 A 20 ARG HDy A 22 VAL HGy% 1.0 1.8 5.0 1385 1178 A 10 ILE HD1% A 13 ILE H 1.0 1.8 5.0 1386 1179 A 3 THR HA A 5 ASP H 1.0 1.8 5.0 1387 1180 A 63 LEU H A 60 SER H 1.0 1.8 5.0 1388 1181 A 61 ALA HB% A 58 GLY HAx 1.0 1.8 2.7 1389 1182 A 18 GLY HAy A 14 HIS HA 1.0 1.8 2.7 1390 1183 A 28 GLN HBy A 31 PHE HBx 1.0 1.8 5.0 1391 1184 A 31 PHE HBx A 28 GLN HGx 1.0 1.8 5.0 1392 1184 A 28 GLN HGy A 31 PHE HBx 1.0 1.8 5.0 1393 1185 A 35 VAL HGy% A 32 GLU HBx 1.0 1.8 5.0 1394 1185 A 35 VAL HGy% A 32 GLU HBy 1.0 1.8 5.0 1395 1186 A 62 ALA HA A 62 ALA H 1.0 1.8 3.5 1396 1187 A 37 LEU HDx% A 33 ASP HA 1.0 1.8 6.0 1397 1188 A 45 VAL HGy% A 46 ASP H 1.0 1.8 5.0 1398 1189 A 35 VAL H A 36 ASP HBy 1.0 1.8 5.0 1399 1190 A 58 GLY H A 60 SER H 1.0 1.8 5.0 1400 1191 A 1 MET HA A 1 MET HGy 1.0 1.8 5.0 1401 1192 A 2 ALA H A 1 MET HA 1.0 1.8 3.5 1402 1193 A 49 ALA HB% A 50 THR H 1.0 1.8 3.5 1403 1194 A 46 ASP H A 46 ASP HBy 1.0 1.8 5.0 1404 1195 A 63 LEU HBx A 64 ARG HA 1.0 1.8 5.0 1405 1196 A 5 ASP H A 5 ASP HBx 1.0 1.8 2.7 1406 1197 A 5 ASP H A 5 ASP HA 1.0 1.8 3.5 1407 1198 A 45 VAL HGy% A 45 VAL HB 1.0 1.8 2.7 1408 1199 A 45 VAL HGy% A 45 VAL HA 1.0 1.8 3.5 1409 1200 A 45 VAL HA A 45 VAL HB 1.0 1.8 3.5 1410 1201 A 50 THR HG2% A 50 THR HB 1.0 1.8 2.7 1411 1202 A 64 ARG HBx A 64 ARG HGx 1.0 1.8 2.7 1412 1202 A 64 ARG HGy A 64 ARG HBx 1.0 1.8 2.7 1413 1202 A 64 ARG HBy A 64 ARG HGy 1.0 1.8 2.7 1414 1202 A 64 ARG HBy A 64 ARG HGx 1.0 1.8 2.7 1415 1203 A 64 ARG HBx A 64 ARG HDx 1.0 1.8 3.5 1416 1203 A 64 ARG HBy A 64 ARG HDx 1.0 1.8 3.5 1417 1203 A 64 ARG HDy A 64 ARG HBx 1.0 1.8 3.5 1418 1203 A 64 ARG HDy A 64 ARG HBy 1.0 1.8 3.5 1419 1204 A 64 ARG HA A 64 ARG HGx 1.0 1.8 3.5 1420 1204 A 64 ARG HGy A 64 ARG HA 1.0 1.8 3.5 1421 1205 A 23 PHE HD% A 23 PHE HBx 1.0 1.8 2.7 1422 1205 A 23 PHE HD% A 23 PHE HBy 1.0 1.8 2.7 1423 1206 A 64 ARG HA A 64 ARG HDx 1.0 1.8 5.0 1424 1206 A 64 ARG HDy A 64 ARG HA 1.0 1.8 5.0 1425 1207 A 32 GLU HA A 33 ASP H 1.0 1.8 3.5 1426 1208 A 19 ARG H A 18 GLY HAy 1.0 1.8 3.5 1427 1209 A 19 ARG H A 18 GLY HAx 1.0 1.8 3.5 1428 1210 A 33 ASP HBy A 33 ASP HBx 1.0 1.8 2.7 1429 1211 A 33 ASP HBy A 33 ASP HA 1.0 1.8 3.5 1430 1212 A 33 ASP HA A 33 ASP HBx 1.0 1.8 3.5 1431 1213 A 13 ILE HA A 12 ASP HBx 1.0 1.8 5.0 1432 1214 A 51 HIS HD2 A 50 THR HA 1.0 1.8 5.0 1433 1215 A 2 ALA H A 2 ALA HA 1.0 1.8 3.5 1434 1216 A 43 SER H A 43 SER HBx 1.0 1.8 3.5 1435 1216 A 43 SER H A 43 SER HBy 1.0 1.8 3.5 1436 1217 A 28 GLN HBy A 32 GLU H 1.0 1.8 6.0 1437 1218 A 39 TRP HE1 A 37 LEU HDy% 1.0 1.8 6.0 1438 1219 A 20 ARG HDx A 16 THR HG2% 1.0 1.8 5.0 1439 1220 A 55 THR H A 55 THR HB 1.0 1.8 5.0 1440 1221 A 55 THR HG2% A 55 THR H 1.0 1.8 5.0 1441 1222 A 6 ASP HBx A 6 ASP HBy 1.0 1.8 2.7 1442 1223 A 12 ASP HA A 15 SER HBx 1.0 1.8 2.7 1443 1223 A 12 ASP HA A 15 SER HBy 1.0 1.8 2.7 1444 1224 A 59 THR HB A 59 THR HG2% 1.0 1.8 2.7 1445 1225 A 59 THR HA A 59 THR HB 1.0 1.8 3.5 1446 1226 A 1 MET HBx A 1 MET HGx 1.0 1.8 3.5 1447 1227 A 1 MET HBy A 1 MET HGy 1.0 1.8 3.5 1448 1228 A 1 MET HA A 1 MET HGx 1.0 1.8 5.0 1449 1229 A 35 VAL HGy% A 31 PHE HA 1.0 1.8 5.0 1450 1230 A 16 THR HA A 17 GLY H 1.0 1.8 3.5 1451 1231 A 64 ARG HDx A 64 ARG HGx 1.0 1.8 2.7 1452 1231 A 64 ARG HDy A 64 ARG HGx 1.0 1.8 2.7 1453 1231 A 64 ARG HGy A 64 ARG HDx 1.0 1.8 2.7 1454 1231 A 64 ARG HDy A 64 ARG HGy 1.0 1.8 2.7 1455 1232 A 48 ARG HA A 48 ARG HBx 1.0 1.8 2.7 1456 1232 A 48 ARG HBy A 48 ARG HA 1.0 1.8 2.7 1457 1233 A 14 HIS H A 15 SER HBx 1.0 1.8 5.0 1458 1233 A 14 HIS H A 15 SER HBy 1.0 1.8 5.0 1459 1234 A 60 SER H A 60 SER HBx 1.0 1.8 3.5 1460 1235 A 59 THR H A 58 GLY HAx 1.0 1.8 3.5 1461 1236 A 59 THR H A 58 GLY H 1.0 1.8 2.7 1462 1237 A 34 LEU HDy% A 33 ASP H 1.0 1.8 6.0 1463 1238 A 32 GLU HA A 32 GLU HGx 1.0 1.8 3.5 1464 1238 A 32 GLU HA A 32 GLU HGy 1.0 1.8 3.5 1465 1239 A 55 THR H A 58 GLY HAy 1.0 1.8 3.5 1466 1240 A 6 ASP HA A 6 ASP HBx 1.0 1.8 2.7 1467 1241 A 6 ASP HA A 6 ASP HBy 1.0 1.8 3.5 1468 1242 A 2 ALA HA A 3 THR H 1.0 1.8 2.7 1469 1243 A 2 ALA H A 3 THR H 1.0 1.8 5.0 1470 1244 A 49 ALA H A 48 ARG HBx 1.0 1.8 5.0 1471 1244 A 48 ARG HBy A 49 ALA H 1.0 1.8 5.0 1472 1245 A 61 ALA H A 57 ARG HA 1.0 1.8 5.0 1473 1246 A 31 PHE H A 33 ASP H 1.0 1.8 5.0 1474 1247 A 61 ALA HB% A 60 SER H 1.0 1.8 5.0 1475 1248 A 34 LEU HA A 37 LEU H 1.0 1.8 3.5 1476 1249 A 2 ALA HB% A 3 THR HA 1.0 1.8 5.0 1477 1250 A 3 THR HA A 4 ALA HA 1.0 1.8 5.0 1478 1251 A 3 THR HA A 4 ALA HB% 1.0 1.8 5.0 1479 1252 A 13 ILE HD1% A 10 ILE HG1x 1.0 1.8 5.0 1480 1252 A 10 ILE HG1y A 13 ILE HD1% 1.0 1.8 5.0 1481 1253 A 27 GLU H A 26 ARG HGx 1.0 1.8 5.0 1482 1253 A 27 GLU H A 26 ARG HGy 1.0 1.8 5.0 1483 1254 A 62 ALA HA A 62 ALA HB% 1.0 1.8 2.7 1484 1255 A 27 GLU H A 26 ARG HBx 1.0 1.8 3.5 1485 1255 A 27 GLU H A 26 ARG HBy 1.0 1.8 3.5 1486 1256 A 9 LEU HA A 12 ASP H 1.0 1.8 3.5 1487 1257 A 16 THR H A 16 THR HG2% 1.0 1.8 5.0 1488 1258 A 55 THR H A 55 THR HA 1.0 1.8 3.5 1489 1259 A 18 GLY H A 17 GLY HAx 1.0 1.8 3.5 1490 1260 A 14 HIS HBy A 15 SER HA 1.0 1.8 5.0 1491 1261 A 23 PHE HA A 22 VAL HGx% 1.0 1.8 5.0 1492 1262 A 11 ARG HA A 11 ARG HDx 1.0 1.8 5.0 1493 1262 A 11 ARG HA A 11 ARG HDy 1.0 1.8 5.0 1494 1263 A 1 MET HGy A 1 MET HGx 1.0 1.8 2.7 1495 1264 A 1 MET HBx A 1 MET HGy 1.0 1.8 3.5 1496 1265 A 1 MET HBy A 1 MET HGx 1.0 1.8 3.5 1497 1266 A 5 ASP HBy A 5 ASP HBx 1.0 1.8 2.7 1498 1267 A 5 ASP HBy A 5 ASP HA 1.0 1.8 3.5 1499 1268 A 5 ASP HBx A 5 ASP HA 1.0 1.8 3.5 1500 1269 A 59 THR HA A 59 THR HG2% 1.0 1.8 3.5 1501 1270 A 26 ARG HBy A 26 ARG HGx 1.0 1.8 2.7 1502 1270 A 26 ARG HBx A 26 ARG HGx 1.0 1.8 2.7 1503 1270 A 26 ARG HGy A 26 ARG HBx 1.0 1.8 2.7 1504 1270 A 26 ARG HGy A 26 ARG HBy 1.0 1.8 2.7 1505 1271 A 9 LEU HA A 12 ASP HBx 1.0 1.8 3.5 1506 1272 A 9 LEU HA A 12 ASP HBy 1.0 1.8 3.5 1507 1273 A 48 ARG HA A 48 ARG HGx 1.0 1.8 3.5 1508 1273 A 48 ARG HA A 48 ARG HGy 1.0 1.8 3.5 1509 1274 A 58 GLY HAy A 61 ALA H 1.0 1.8 5.0 1510 1275 A 35 VAL HB A 32 GLU HA 1.0 1.8 3.5 1511 1276 A 61 ALA H A 60 SER HBx 1.0 1.8 5.0 1512 1277 A 11 ARG HBx A 11 ARG HDx 1.0 1.8 2.7 1513 1277 A 11 ARG HBy A 11 ARG HDx 1.0 1.8 2.7 1514 1277 A 11 ARG HDy A 11 ARG HBx 1.0 1.8 2.7 1515 1277 A 11 ARG HBy A 11 ARG HDy 1.0 1.8 2.7 1516 1278 A 10 ILE HG2% A 11 ARG HA 1.0 1.8 3.5 1517 1279 A 35 VAL H A 32 GLU HA 1.0 1.8 3.5 1518 1280 A 48 ARG HBy A 48 ARG HGx 1.0 1.8 2.7 1519 1280 A 48 ARG HBx A 48 ARG HGx 1.0 1.8 2.7 1520 1280 A 48 ARG HGy A 48 ARG HBx 1.0 1.8 2.7 1521 1280 A 48 ARG HBy A 48 ARG HGy 1.0 1.8 2.7 1522 1281 A 58 GLY H A 58 GLY HAy 1.0 1.8 2.7 1523 1282 A 9 LEU HDy% A 13 ILE HG1x 1.0 1.8 3.5 1524 1282 A 9 LEU HDy% A 13 ILE HG1y 1.0 1.8 3.5 1525 1283 A 11 ARG HA A 13 ILE HB 1.0 1.8 5.0 1526 1284 A 3 THR H A 3 THR HB 1.0 1.8 3.5 1527 1285 A 3 THR HG2% A 3 THR HB 1.0 1.8 2.7 1528 1286 A 49 ALA HA A 49 ALA H 1.0 1.8 3.5 1529 1287 A 59 THR H A 60 SER HBy 1.0 1.8 6.0 1530 1288 A 2 ALA H A 1 MET HBx 1.0 1.8 5.0 1531 1289 A 37 LEU HDx% A 33 ASP HBx 1.0 1.8 5.0 1532 1290 A 3 THR HB A 5 ASP H 1.0 1.8 5.0 1533 1291 A 11 ARG HA A 15 SER H 1.0 1.8 5.0 1534 1292 A 14 HIS H A 10 ILE HG1x 1.0 1.8 5.0 1535 1292 A 10 ILE HG1y A 14 HIS H 1.0 1.8 5.0 1536 1293 A 11 ARG HA A 14 HIS HBx 1.0 1.8 3.5 1537 1294 A 11 ARG HA A 14 HIS HBy 1.0 1.8 5.0 1538 1295 A 13 ILE HA A 16 THR HG2% 1.0 1.8 5.0 1539 1296 A 31 PHE HD% A 28 GLN HGx 1.0 1.8 6.0 1540 1296 A 28 GLN HGy A 31 PHE HD% 1.0 1.8 6.0 1541 1297 A 7 PHE H A 6 ASP HBx 1.0 1.8 5.0 1542 1298 A 7 PHE H A 6 ASP HBy 1.0 1.8 2.7 1543 1299 A 39 TRP HD1 A 37 LEU HBx 1.0 1.8 5.0 1544 1300 A 34 LEU H A 31 PHE HA 1.0 1.8 3.5 1545 1301 A 2 ALA H A 1 MET HBy 1.0 1.8 5.0 1546 1302 A 45 VAL H A 46 ASP HA 1.0 1.8 6.0 1547 1303 A 46 ASP HA A 45 VAL HB 1.0 1.8 5.0 1548 1304 A 7 PHE HBx A 4 ALA HA 1.0 1.8 5.0 1549 1305 A 4 ALA HA A 5 ASP H 1.0 1.8 3.5 1550 1306 A 49 ALA HB% A 50 THR HA 1.0 1.8 5.0 1551 1307 A 18 GLY H A 18 GLY HAy 1.0 1.8 2.7 1552 1308 A 18 GLY H A 18 GLY HAx 1.0 1.8 3.5 1553 1309 A 55 THR HG2% A 58 GLY H 1.0 1.8 5.0 1554 1310 A 12 ASP HBy A 13 ILE HG1x 1.0 1.8 5.0 1555 1310 A 13 ILE HG1y A 12 ASP HBy 1.0 1.8 5.0 1556 1311 A 31 PHE HBy A 32 GLU HA 1.0 1.8 5.0 1557 1312 A 7 PHE HD% A 11 ARG H 1.0 1.8 6.0 1558 1313 A 26 ARG HA A 26 ARG HGx 1.0 1.8 3.5 1559 1313 A 26 ARG HGy A 26 ARG HA 1.0 1.8 3.5 1560 1314 A 26 ARG HA A 26 ARG HBx 1.0 1.8 2.7 1561 1314 A 26 ARG HBy A 26 ARG HA 1.0 1.8 2.7 1562 1315 A 49 ALA HB% A 49 ALA HA 1.0 1.8 2.7 1563 1316 A 61 ALA HA A 64 ARG HBx 1.0 1.8 5.0 1564 1316 A 64 ARG HBy A 61 ALA HA 1.0 1.8 5.0 1565 1317 A 46 ASP HA A 46 ASP HBy 1.0 1.8 3.5 1566 1318 A 16 THR HG2% A 16 THR HB 1.0 1.8 2.7 1567 1319 A 49 ALA H A 48 ARG HA 1.0 1.8 3.5 1568 1320 A 16 THR HG2% A 15 SER HBx 1.0 1.8 6.0 1569 1320 A 15 SER HBy A 16 THR HG2% 1.0 1.8 6.0 1570 1321 A 39 TRP HZ2 A 37 LEU HDy% 1.0 1.8 6.0 1571 1322 A 4 ALA HA A 4 ALA HB% 1.0 1.8 2.7 1572 1323 A 60 SER HBy A 60 SER HBx 1.0 1.8 2.7 1573 1324 A 48 ARG HBx A 48 ARG HDx 1.0 1.8 2.7 1574 1324 A 48 ARG HBy A 48 ARG HDx 1.0 1.8 2.7 1575 1324 A 48 ARG HDy A 48 ARG HBx 1.0 1.8 2.7 1576 1324 A 48 ARG HBy A 48 ARG HDy 1.0 1.8 2.7 1577 1325 A 10 ILE H A 12 ASP HBx 1.0 1.8 5.0 1578 1326 A 8 LYS H A 5 ASP HA 1.0 1.8 3.5 1579 1327 A 40 LEU H A 37 LEU H 1.0 1.8 5.0 1580 1328 A 28 GLN HE2x A 24 GLY H 1.0 1.8 5.0 1581 1329 A 58 GLY H A 55 THR HA 1.0 1.8 5.0 1582 1330 A 58 GLY HAx A 55 THR H 1.0 1.8 5.0 1583 1331 A 11 ARG H A 7 PHE HA 1.0 1.8 5.0 1584 1332 A 28 GLN HE2y A 24 GLY H 1.0 1.8 5.0 1585 1333 A 59 THR HA A 63 LEU H 1.0 1.8 5.0 1586 1334 A 5 ASP HA A 8 LYS HDx 1.0 1.8 5.0 1587 1334 A 8 LYS HDy A 5 ASP HA 1.0 1.8 5.0 1588 1335 A 18 GLY HAx A 14 HIS HA 1.0 1.8 5.0 1589 1336 A 10 ILE HD1% A 13 ILE HG2% 1.0 1.8 3.5 1590 1337 A 5 ASP HA A 8 LYS HBx 1.0 1.8 3.5 1591 1337 A 8 LYS HBy A 5 ASP HA 1.0 1.8 3.5 1592 1338 A 31 PHE HBy A 28 GLN HGx 1.0 1.8 6.0 1593 1338 A 28 GLN HGy A 31 PHE HBy 1.0 1.8 6.0 1594 1339 A 57 ARG HA A 60 SER HBy 1.0 1.8 5.0 1595 1340 A 57 ARG HA A 60 SER HBx 1.0 1.8 5.0 1596 1341 A 8 LYS HGy A 5 ASP HA 1.0 1.8 6.0 1597 1342 A 43 SER H A 43 SER HA 1.0 1.8 3.5 1598 1343 A 29 LYS H A 32 GLU H 1.0 1.8 5.0 1599 1344 A 2 ALA H A 3 THR HA 1.0 1.8 6.0 1600 1345 A 49 ALA H A 48 ARG HGx 1.0 1.8 5.0 1601 1345 A 49 ALA H A 48 ARG HGy 1.0 1.8 5.0 1602 1346 A 50 THR H A 49 ALA H 1.0 1.8 5.0 1603 1347 A 49 ALA HA A 50 THR H 1.0 1.8 2.7 1604 1348 A 4 ALA HB% A 3 THR HB 1.0 1.8 6.0 1605 1349 A 2 ALA HA A 3 THR HG2% 1.0 1.8 5.0 1606 1350 A 44 SER HA A 44 SER HBx 1.0 1.8 2.7 1607 1350 A 44 SER HBy A 44 SER HA 1.0 1.8 2.7 1608 1351 A 52 TYR HE% A 50 THR HB 1.0 1.8 3.5 1609 1352 A 52 TYR HE% A 50 THR H 1.0 1.8 5.0 1610 1353 A 15 SER HA A 16 THR HA 1.0 1.8 5.0 1611 1354 A 57 ARG HBy A 58 GLY HAx 1.0 1.8 5.0 1612 1355 A 62 ALA HA A 64 ARG HBx 1.0 1.8 5.0 1613 1355 A 62 ALA HA A 64 ARG HBy 1.0 1.8 5.0 1614 1356 A 64 ARG H A 61 ALA HA 1.0 1.8 5.0 1615 1357 A 17 GLY HAx A 17 GLY HAy 1.0 1.8 2.7 1616 1358 A 46 ASP HA A 46 ASP HBx 1.0 1.8 3.5 1617 1359 A 26 ARG HDx A 26 ARG HGx 1.0 1.8 2.7 1618 1359 A 26 ARG HDy A 26 ARG HGx 1.0 1.8 2.7 1619 1359 A 26 ARG HGy A 26 ARG HDx 1.0 1.8 2.7 1620 1359 A 26 ARG HGy A 26 ARG HDy 1.0 1.8 2.7 1621 1360 A 26 ARG HBx A 26 ARG HDx 1.0 1.8 3.5 1622 1360 A 26 ARG HBy A 26 ARG HDx 1.0 1.8 3.5 1623 1360 A 26 ARG HDy A 26 ARG HBx 1.0 1.8 3.5 1624 1360 A 26 ARG HBy A 26 ARG HDy 1.0 1.8 3.5 1625 1361 A 18 GLY HAy A 18 GLY HAx 1.0 1.8 2.7 1626 1362 A 48 ARG HDy A 48 ARG HGx 1.0 1.8 2.7 1627 1362 A 48 ARG HDx A 48 ARG HGx 1.0 1.8 2.7 1628 1362 A 48 ARG HGy A 48 ARG HDx 1.0 1.8 2.7 1629 1362 A 48 ARG HGy A 48 ARG HDy 1.0 1.8 2.7 1630 1363 A 13 ILE HA A 16 THR HB 1.0 1.8 5.0 1631 1364 A 62 ALA HB% A 59 THR HA 1.0 1.8 3.5 1632 1365 A 58 GLY HAx A 58 GLY HAy 1.0 1.8 2.7 1633 1366 A 18 GLY H A 16 THR H 1.0 1.8 5.0 1634 1367 A 26 ARG HA A 26 ARG HDx 1.0 1.8 5.0 1635 1367 A 26 ARG HA A 26 ARG HDy 1.0 1.8 5.0 1636 1368 A 17 GLY H A 17 GLY HAx 1.0 1.8 3.5 1637 1369 A 17 GLY H A 15 SER HBx 1.0 1.8 5.0 1638 1369 A 15 SER HBy A 17 GLY H 1.0 1.8 5.0 1639 1370 A 45 VAL H A 44 SER HA 1.0 1.8 3.5 1640 1371 A 18 GLY H A 15 SER H 1.0 1.8 5.0 1641 1372 A 35 VAL HGx% A 38 GLY H 1.0 1.8 5.0 1642 1373 A 61 ALA HB% A 60 SER HBy 1.0 1.8 6.0 1643 1374 A 15 SER H A 17 GLY H 1.0 1.8 5.0 1644 1375 A 46 ASP HBy A 46 ASP HBx 1.0 1.8 2.7 1645 1376 A 61 ALA H A 61 ALA HA 1.0 1.8 3.5 1646 1377 A 18 GLY H A 17 GLY HAy 1.0 1.8 3.5 1647 1378 A 45 VAL HA A 46 ASP HBy 1.0 1.8 6.0 1648 1379 A 2 ALA HB% A 1 MET HA 1.0 1.8 5.0 1649 1380 A 16 THR HA A 17 GLY HAx 1.0 1.8 5.0 1650 1381 A 48 ARG HA A 48 ARG HDx 1.0 1.8 5.0 1651 1381 A 48 ARG HA A 48 ARG HDy 1.0 1.8 5.0 1652 1382 A 7 PHE HBy A 4 ALA HB% 1.0 1.8 5.0 1653 1383 A 55 THR HG2% A 55 THR HB 1.0 1.8 2.7 1654 1384 A 16 THR HG2% A 20 ARG HGx 1.0 1.8 5.0 1655 1384 A 20 ARG HGy A 16 THR HG2% 1.0 1.8 5.0 1656 1385 A 7 PHE HD% A 6 ASP H 1.0 1.8 5.0 1657 1386 A 12 ASP HA A 16 THR H 1.0 1.8 5.0 1658 1387 A 61 ALA HB% A 61 ALA HA 1.0 1.8 2.7 1659 1388 A 20 ARG HBx A 16 THR HG2% 1.0 1.8 5.0 1660 1389 A 43 SER HA A 43 SER HBx 1.0 1.8 2.7 1661 1389 A 43 SER HBy A 43 SER HA 1.0 1.8 2.7 1662 1390 A 20 ARG HDx A 16 THR HB 1.0 1.8 5.0 1663 1391 A 13 ILE HG2% A 16 THR HG2% 1.0 1.8 5.0 1664 1392 A 62 ALA H A 58 GLY HAx 1.0 1.8 5.0 1665 1393 A 61 ALA HB% A 64 ARG HBx 1.0 1.8 5.0 1666 1393 A 61 ALA HB% A 64 ARG HBy 1.0 1.8 5.0 1667 1394 A 36 ASP H A 40 LEU HBx 1.0 1.8 6.0 1668 1394 A 40 LEU HBy A 36 ASP H 1.0 1.8 6.0 1669 1395 A 23 PHE HA A 24 GLY H 1.0 1.8 3.5 1670 1396 A 24 GLY H A 23 PHE HBx 1.0 1.8 5.0 1671 1396 A 23 PHE HBy A 24 GLY H 1.0 1.8 5.0 1672 1397 A 49 ALA HB% A 48 ARG HBx 1.0 1.8 5.0 1673 1397 A 49 ALA HB% A 48 ARG HBy 1.0 1.8 5.0 1674 1398 A 19 ARG H A 17 GLY HAx 1.0 1.8 5.0 1675 1399 A 28 GLN H A 30 PRO HDy 1.0 1.8 5.0 1676 1400 A 18 GLY H A 16 THR HG2% 1.0 1.8 6.0 1677 1401 A 29 LYS H A 27 GLU H 1.0 1.8 5.0 1678 1402 A 11 ARG H A 12 ASP HA 1.0 1.8 6.0 1679 1403 A 18 GLY HAy A 14 HIS H 1.0 1.8 5.0 1680 1404 A 35 VAL H A 32 GLU H 1.0 1.8 5.0 1681 1405 A 12 ASP H A 15 SER HBx 1.0 1.8 6.0 1682 1405 A 12 ASP H A 15 SER HBy 1.0 1.8 6.0 1683 1406 A 24 GLY H A 28 GLN HGx 1.0 1.8 6.0 1684 1406 A 28 GLN HGy A 24 GLY H 1.0 1.8 6.0 1685 1407 A 34 LEU HA A 37 LEU HBx 1.0 1.8 2.7 1686 1408 A 6 ASP HBy A 2 ALA HA 1.0 1.8 5.0 1687 1409 A 61 ALA HB% A 58 GLY HAy 1.0 1.8 5.0 1688 1410 A 45 VAL H A 44 SER HBx 1.0 1.8 5.0 1689 1410 A 44 SER HBy A 45 VAL H 1.0 1.8 5.0 1690 1411 A 45 VAL HGy% A 44 SER HA 1.0 1.8 5.0 1691 1412 A 3 THR HG2% A 4 ALA HA 1.0 1.8 5.0 1692 1413 A 14 HIS HD2 A 10 ILE HA 1.0 1.8 5.0 1693 1414 A 24 GLY H A 24 GLY HAy 1.0 1.8 3.5 1694 1415 A 24 GLY H A 24 GLY HAx 1.0 1.8 3.5 1695 1416 A 61 ALA HA A 64 ARG HGx 1.0 1.8 5.0 1696 1416 A 64 ARG HGy A 61 ALA HA 1.0 1.8 5.0 1697 1417 A 41 LYS HEx A 43 SER HBx 1.0 1.8 5.0 1698 1417 A 41 LYS HEy A 43 SER HBx 1.0 1.8 5.0 1699 1417 A 43 SER HBy A 41 LYS HEx 1.0 1.8 5.0 1700 1417 A 41 LYS HEy A 43 SER HBy 1.0 1.8 5.0 1701 1418 A 43 SER HA A 41 LYS HEx 1.0 1.8 5.0 1702 1418 A 41 LYS HEy A 43 SER HA 1.0 1.8 5.0 1703 1419 A 9 LEU HDx% A 13 ILE HD1% 1.0 1.8 5.0 1704 1420 A 43 SER H A 44 SER HBx 1.0 1.8 5.0 1705 1420 A 43 SER H A 44 SER HBy 1.0 1.8 5.0 1706 1421 A 34 LEU HDx% A 31 PHE HA 1.0 1.8 3.5 1707 1422 A 44 SER HA A 43 SER HBx 1.0 1.8 5.0 1708 1422 A 43 SER HBy A 44 SER HA 1.0 1.8 5.0 1709 1423 A 49 ALA HB% A 51 HIS HD2 1.0 1.8 5.0 1710 1424 A 24 GLY HAy A 24 GLY HAx 1.0 1.8 2.7 1711 1425 A 20 ARG HDy A 16 THR HB 1.0 1.8 5.0 1712 1426 A 36 ASP HBy A 33 ASP HA 1.0 1.8 3.5 1713 1427 A 36 ASP HBx A 33 ASP HA 1.0 1.8 5.0 1714 1428 A 10 ILE H A 7 PHE H 1.0 1.8 5.0 1715 1429 A 10 ILE HG2% A 6 ASP HBx 1.0 1.8 5.0 1716 1430 A 58 GLY HAy A 54 ILE HB 1.0 1.8 5.0 1717 1431 A 27 GLU HA A 30 PRO HGx 1.0 1.8 5.0 1718 1431 A 30 PRO HGy A 27 GLU HA 1.0 1.8 5.0 1719 1432 A 27 GLU HA A 30 PRO HDx 1.0 1.8 5.0 1720 1433 A 55 THR HB A 57 ARG HGx 1.0 1.8 6.0 1721 1433 A 57 ARG HGy A 55 THR HB 1.0 1.8 6.0 1722 1434 A 29 LYS HA A 32 GLU HGx 1.0 1.8 5.0 1723 1434 A 29 LYS HA A 32 GLU HGy 1.0 1.8 5.0 1724 1435 A 31 PHE HD% A 27 GLU HBy 1.0 1.8 6.0 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 1 MET C A 2 ALA N A 2 ALA CA A 2 ALA C 1.0 -125.0 -61.0 PHI 2 2 A 2 ALA N A 2 ALA CA A 2 ALA C A 3 THR N 1.0 111.0 167.0 PSI 3 3 A 2 ALA C A 3 THR N A 3 THR CA A 3 THR C 1.0 -144.0 -36.0 PHI 4 4 A 3 THR N A 3 THR CA A 3 THR C A 4 ALA N 1.0 156.0 180.0 PSI 5 5 A 3 THR C A 4 ALA N A 4 ALA CA A 4 ALA C 1.0 -69.0 -49.0 PHI 6 6 A 4 ALA N A 4 ALA CA A 4 ALA C A 5 ASP N 1.0 -53.0 -25.0 PSI 7 7 A 4 ALA C A 5 ASP N A 5 ASP CA A 5 ASP C 1.0 -76.0 -56.0 PHI 8 8 A 5 ASP N A 5 ASP CA A 5 ASP C A 6 ASP N 1.0 -56.0 -24.0 PSI 9 9 A 5 ASP C A 6 ASP N A 6 ASP CA A 6 ASP C 1.0 -77.0 -57.0 PHI 10 10 A 6 ASP N A 6 ASP CA A 6 ASP C A 7 PHE N 1.0 -55.0 -31.0 PSI 11 11 A 6 ASP C A 7 PHE N A 7 PHE CA A 7 PHE C 1.0 -74.0 -54.0 PHI 12 12 A 7 PHE N A 7 PHE CA A 7 PHE C A 8 LYS N 1.0 -50.0 -30.0 PSI 13 13 A 7 PHE C A 8 LYS N A 8 LYS CA A 8 LYS C 1.0 -77.0 -53.0 PHI 14 14 A 8 LYS N A 8 LYS CA A 8 LYS C A 9 LEU N 1.0 -55.0 -31.0 PSI 15 15 A 8 LYS C A 9 LEU N A 9 LEU CA A 9 LEU C 1.0 -83.0 -55.0 PHI 16 16 A 9 LEU N A 9 LEU CA A 9 LEU C A 10 ILE N 1.0 -51.0 -11.0 PSI 17 17 A 9 LEU C A 10 ILE N A 10 ILE CA A 10 ILE C 1.0 -128.0 -48.0 PHI 18 18 A 10 ILE N A 10 ILE CA A 10 ILE C A 11 ARG N 1.0 -87.0 41.0 PSI 19 19 A 10 ILE C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 -71.0 -47.0 PHI 20 20 A 11 ARG N A 11 ARG CA A 11 ARG C A 12 ASP N 1.0 -50.0 -26.0 PSI 21 21 A 11 ARG C A 12 ASP N A 12 ASP CA A 12 ASP C 1.0 -82.0 -54.0 PHI 22 22 A 12 ASP N A 12 ASP CA A 12 ASP C A 13 ILE N 1.0 -57.0 -25.0 PSI 23 23 A 12 ASP C A 13 ILE N A 13 ILE CA A 13 ILE C 1.0 -73.0 -53.0 PHI 24 24 A 13 ILE N A 13 ILE CA A 13 ILE C A 14 HIS N 1.0 -51.0 -31.0 PSI 25 25 A 13 ILE C A 14 HIS N A 14 HIS CA A 14 HIS C 1.0 -74.0 -50.0 PHI 26 26 A 14 HIS N A 14 HIS CA A 14 HIS C A 15 SER N 1.0 -54.0 -34.0 PSI 27 27 A 14 HIS C A 15 SER N A 15 SER CA A 15 SER C 1.0 -81.0 -49.0 PHI 28 28 A 15 SER N A 15 SER CA A 15 SER C A 16 THR N 1.0 -48.0 -8.0 PSI 29 29 A 15 SER C A 16 THR N A 16 THR CA A 16 THR C 1.0 -133.0 -65.0 PHI 30 30 A 16 THR N A 16 THR CA A 16 THR C A 17 GLY N 1.0 -18.0 30.0 PSI 31 31 A 18 GLY C A 19 ARG N A 19 ARG CA A 19 ARG C 1.0 -146.0 -94.0 PHI 32 32 A 19 ARG N A 19 ARG CA A 19 ARG C A 20 ARG N 1.0 124.0 176.0 PSI 33 33 A 19 ARG C A 20 ARG N A 20 ARG CA A 20 ARG C 1.0 -179.0 -95.0 PHI 34 34 A 20 ARG N A 20 ARG CA A 20 ARG C A 21 GLN N 1.0 112.0 156.0 PSI 35 35 A 20 ARG C A 21 GLN N A 21 GLN CA A 21 GLN C 1.0 -136.0 -72.0 PHI 36 36 A 21 GLN N A 21 GLN CA A 21 GLN C A 22 VAL N 1.0 112.0 136.0 PSI 37 37 A 21 GLN C A 22 VAL N A 22 VAL CA A 22 VAL C 1.0 -152.0 -80.0 PHI 38 38 A 22 VAL N A 22 VAL CA A 22 VAL C A 23 PHE N 1.0 116.0 140.0 PSI 39 39 A 25 SER C A 26 ARG N A 26 ARG CA A 26 ARG C 1.0 -78.0 -50.0 PHI 40 40 A 26 ARG N A 26 ARG CA A 26 ARG C A 27 GLU N 1.0 -52.0 -16.0 PSI 41 41 A 26 ARG C A 27 GLU N A 27 GLU CA A 27 GLU C 1.0 -75.0 -55.0 PHI 42 42 A 27 GLU N A 27 GLU CA A 27 GLU C A 28 GLN N 1.0 -55.0 -27.0 PSI 43 43 A 27 GLU C A 28 GLN N A 28 GLN CA A 28 GLN C 1.0 -80.0 -52.0 PHI 44 44 A 28 GLN N A 28 GLN CA A 28 GLN C A 29 LYS N 1.0 -55.0 -23.0 PSI 45 45 A 28 GLN C A 29 LYS N A 29 LYS CA A 29 LYS C 1.0 -80.0 -36.0 PHI 46 46 A 29 LYS N A 29 LYS CA A 29 LYS C A 30 PRO N 1.0 -65.0 -17.0 PSI 47 47 A 30 PRO C A 31 PHE N A 31 PHE CA A 31 PHE C 1.0 -80.0 -48.0 PHI 48 48 A 31 PHE N A 31 PHE CA A 31 PHE C A 32 GLU N 1.0 -57.0 -25.0 PSI 49 49 A 31 PHE C A 32 GLU N A 32 GLU CA A 32 GLU C 1.0 -72.0 -52.0 PHI 50 50 A 32 GLU N A 32 GLU CA A 32 GLU C A 33 ASP N 1.0 -52.0 -24.0 PSI 51 51 A 32 GLU C A 33 ASP N A 33 ASP CA A 33 ASP C 1.0 -76.0 -52.0 PHI 52 52 A 33 ASP N A 33 ASP CA A 33 ASP C A 34 LEU N 1.0 -51.0 -31.0 PSI 53 53 A 33 ASP C A 34 LEU N A 34 LEU CA A 34 LEU C 1.0 -82.0 -50.0 PHI 54 54 A 34 LEU N A 34 LEU CA A 34 LEU C A 35 VAL N 1.0 -52.0 -24.0 PSI 55 55 A 34 LEU C A 35 VAL N A 35 VAL CA A 35 VAL C 1.0 -77.0 -57.0 PHI 56 56 A 35 VAL N A 35 VAL CA A 35 VAL C A 36 ASP N 1.0 -53.0 -29.0 PSI 57 57 A 35 VAL C A 36 ASP N A 36 ASP CA A 36 ASP C 1.0 -78.0 -58.0 PHI 58 58 A 36 ASP N A 36 ASP CA A 36 ASP C A 37 LEU N 1.0 -51.0 -3.0 PSI 59 59 A 36 ASP C A 37 LEU N A 37 LEU CA A 37 LEU C 1.0 -96.0 -64.0 PHI 60 60 A 37 LEU N A 37 LEU CA A 37 LEU C A 38 GLY N 1.0 -25.0 3.0 PSI 61 61 A 39 TRP C A 40 LEU N A 40 LEU CA A 40 LEU C 1.0 -167.0 -111.0 PHI 62 62 A 40 LEU N A 40 LEU CA A 40 LEU C A 41 LYS N 1.0 142.0 166.0 PSI 63 63 A 40 LEU C A 41 LYS N A 41 LYS CA A 41 LYS C 1.0 -169.0 -89.0 PHI 64 64 A 41 LYS N A 41 LYS CA A 41 LYS C A 42 ARG N 1.0 98.0 178.0 PSI 65 65 A 41 LYS C A 42 ARG N A 42 ARG CA A 42 ARG C 1.0 -113.0 -69.0 PHI 66 66 A 42 ARG N A 42 ARG CA A 42 ARG C A 43 SER N 1.0 103.0 151.0 PSI 67 67 A 45 VAL C A 46 ASP N A 46 ASP CA A 46 ASP C 1.0 -130.0 -62.0 PHI 68 68 A 46 ASP N A 46 ASP CA A 46 ASP C A 47 SER N 1.0 100.0 164.0 PSI 69 69 A 48 ARG C A 49 ALA N A 49 ALA CA A 49 ALA C 1.0 -180.0 -60.0 PHI 70 70 A 49 ALA N A 49 ALA CA A 49 ALA C A 50 THR N 1.0 116.0 164.0 PSI 71 71 A 49 ALA C A 50 THR N A 50 THR CA A 50 THR C 1.0 -163.0 -75.0 PHI 72 72 A 50 THR N A 50 THR CA A 50 THR C A 51 HIS N 1.0 102.0 146.0 PSI 73 73 A 50 THR C A 51 HIS N A 51 HIS CA A 51 HIS C 1.0 -133.0 -69.0 PHI 74 74 A 51 HIS N A 51 HIS CA A 51 HIS C A 52 TYR N 1.0 116.0 156.0 PSI 75 75 A 51 HIS C A 52 TYR N A 52 TYR CA A 52 TYR C 1.0 -134.0 -90.0 PHI 76 76 A 52 TYR N A 52 TYR CA A 52 TYR C A 53 GLN N 1.0 117.0 161.0 PSI 77 77 A 52 TYR C A 53 GLN N A 53 GLN CA A 53 GLN C 1.0 -159.0 -95.0 PHI 78 78 A 53 GLN N A 53 GLN CA A 53 GLN C A 54 ILE N 1.0 111.0 159.0 PSI 79 79 A 53 GLN C A 54 ILE N A 54 ILE CA A 54 ILE C 1.0 -144.0 -56.0 PHI 80 80 A 54 ILE N A 54 ILE CA A 54 ILE C A 55 THR N 1.0 102.0 158.0 PSI 81 81 A 54 ILE C A 55 THR N A 55 THR CA A 55 THR C 1.0 -170.0 -86.0 PHI 82 82 A 55 THR N A 55 THR CA A 55 THR C A 56 GLU N 1.0 122.0 194.0 PSI 83 83 A 56 GLU C A 57 ARG N A 57 ARG CA A 57 ARG C 1.0 -77.0 -53.0 PHI 84 84 A 57 ARG N A 57 ARG CA A 57 ARG C A 58 GLY N 1.0 -52.0 -20.0 PSI 85 85 A 57 ARG C A 58 GLY N A 58 GLY CA A 58 GLY C 1.0 -74.0 -54.0 PHI 86 86 A 58 GLY N A 58 GLY CA A 58 GLY C A 59 THR N 1.0 -57.0 -29.0 PSI 87 87 A 58 GLY C A 59 THR N A 59 THR CA A 59 THR C 1.0 -73.0 -49.0 PHI 88 88 A 59 THR N A 59 THR CA A 59 THR C A 60 SER N 1.0 -67.0 -27.0 PSI 89 89 A 59 THR C A 60 SER N A 60 SER CA A 60 SER C 1.0 -74.0 -54.0 PHI 90 90 A 60 SER N A 60 SER CA A 60 SER C A 61 ALA N 1.0 -52.0 -24.0 PSI 91 91 A 60 SER C A 61 ALA N A 61 ALA CA A 61 ALA C 1.0 -84.0 -48.0 PHI 92 92 A 61 ALA N A 61 ALA CA A 61 ALA C A 62 ALA N 1.0 -48.0 -28.0 PSI 93 93 A 61 ALA C A 62 ALA N A 62 ALA CA A 62 ALA C 1.0 -75.0 -47.0 PHI 94 94 A 62 ALA N A 62 ALA CA A 62 ALA C A 63 LEU N 1.0 -48.0 -24.0 PSI 95 95 A 62 ALA C A 63 LEU N A 63 LEU CA A 63 LEU C 1.0 -104.0 -48.0 PHI 96 96 A 63 LEU N A 63 LEU CA A 63 LEU C A 64 ARG N 1.0 -49.0 -1.0 PSI stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 6265.664 2 13C 4424.779 3 1H 1505.228 stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 6265.664 2 13C 9433.962 3 1H 3102.238 stop_ save_ save_spectral_peak_list_3 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_3 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 7199.424 2 13C 9208.103 3 1H 4202.306 stop_ save_ save_spectral_peak_list_4 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_4 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 7199.424 2 15N 1702.997 3 1H 7183.908 stop_ save_