data_nef_c25886_2n98 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2N98 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 HIS middle . . 3 A 3 MET middle . . 4 A 4 SER middle . . 5 A 5 ASP middle . . 6 A 6 LEU middle . . 7 A 7 SER middle . . 8 A 8 THR middle . . 9 A 9 ALA middle . . 10 A 10 PRO middle . false 11 A 11 THR middle . . 12 A 12 LEU middle . . 13 A 13 ASP middle . . 14 A 14 SER middle . . 15 A 15 LEU middle . . 16 A 16 ARG middle . . 17 A 17 VAL middle . . 18 A 18 TRP middle . . 19 A 19 LEU middle . . 20 A 20 VAL middle . . 21 A 21 ASP middle . . 22 A 22 CYS middle . . 23 A 23 VAL middle . . 24 A 24 ALA middle . . 25 A 25 GLY middle . false 26 A 26 HIS middle . . 27 A 27 LEU middle . . 28 A 28 GLY middle . false 29 A 29 LEU middle . . 30 A 30 ASP middle . . 31 A 31 ALA middle . . 32 A 32 ALA middle . . 33 A 33 THR middle . . 34 A 34 ILE middle . . 35 A 35 ALA middle . . 36 A 36 THR middle . . 37 A 37 ASP middle . . 38 A 38 LEU middle . . 39 A 39 PRO middle . false 40 A 40 LEU middle . . 41 A 41 THR middle . . 42 A 42 SER middle . . 43 A 43 TYR middle . . 44 A 44 GLY middle . false 45 A 45 LEU middle . . 46 A 46 ASP middle . . 47 A 47 SER middle . . 48 A 48 VAL middle . . 49 A 49 TYR middle . . 50 A 50 ALA middle . . 51 A 51 LEU middle . . 52 A 52 SER middle . . 53 A 53 ILE middle . . 54 A 54 ALA middle . . 55 A 55 ALA middle . . 56 A 56 GLU middle . . 57 A 57 LEU middle . . 58 A 58 GLU middle . . 59 A 59 ASP middle . . 60 A 60 HIS middle . . 61 A 61 LEU middle . . 62 A 62 ASP middle . . 63 A 63 VAL middle . . 64 A 64 SER middle . . 65 A 65 LEU middle . . 66 A 66 ASP middle . . 67 A 67 PRO middle . false 68 A 68 THR middle . . 69 A 69 LEU middle . . 70 A 70 ILE middle . . 71 A 71 TRP middle . . 72 A 72 ASP middle . . 73 A 73 HIS middle . . 74 A 74 PRO middle . false 75 A 75 THR middle . . 76 A 76 ILE middle . . 77 A 77 ASP middle . . 78 A 78 ALA middle . . 79 A 79 LEU middle . . 80 A 80 SER middle . . 81 A 81 THR middle . . 82 A 82 ALA middle . . 83 A 83 LEU middle . . 84 A 84 VAL middle . . 85 A 85 ALA middle . . 86 A 86 GLU middle . . 87 A 87 LEU middle . . 88 A 88 ARG middle . . 89 A 89 SER middle . . 90 A 90 ALA end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 3 MET HA H 1 4.433 . A 3 MET HBy H 1 1.984 . A 3 MET HBx H 1 1.365 . A 3 MET C C 13 176.329 . A 3 MET CA C 13 55.845 . A 3 MET CB C 13 32.364 . A 4 SER H H 1 8.371 . A 4 SER HA H 1 4.405 . A 4 SER HBx H 1 3.891 . A 4 SER HBy H 1 3.891 . A 4 SER C C 13 174.319 . A 4 SER CA C 13 58.848 . A 4 SER CB C 13 63.741 . A 4 SER N N 15 116.189 . A 5 ASP H H 1 8.350 . A 5 ASP HA H 1 4.631 . A 5 ASP HBy H 1 2.714 . A 5 ASP HBx H 1 2.597 . A 5 ASP C C 13 176.127 . A 5 ASP CA C 13 54.410 . A 5 ASP CB C 13 41.073 . A 5 ASP N N 15 121.631 . A 6 LEU H H 1 8.136 . A 6 LEU HA H 1 4.325 . A 6 LEU HBx H 1 1.362 . A 6 LEU HBy H 1 1.503 . A 6 LEU HDx% H 1 0.807 . A 6 LEU HDy% H 1 0.630 . A 6 LEU HG H 1 1.625 . A 6 LEU C C 13 177.530 . A 6 LEU CA C 13 55.216 . A 6 LEU CB C 13 41.936 . A 6 LEU CDy C 13 24.774 . A 6 LEU CDx C 13 23.915 . A 6 LEU CG C 13 27.060 . A 6 LEU N N 15 122.230 . A 7 SER H H 1 8.407 . A 7 SER HA H 1 4.394 . A 7 SER HBx H 1 3.807 . A 7 SER HBy H 1 3.950 . A 7 SER C C 13 174.615 . A 7 SER CA C 13 58.950 . A 7 SER CB C 13 63.710 . A 7 SER N N 15 117.472 . A 8 THR H H 1 7.920 . A 8 THR HA H 1 4.566 . A 8 THR HB H 1 4.267 . A 8 THR HG1 H 1 1.123 . A 8 THR HG2% H 1 1.224 . A 8 THR C C 13 173.995 . A 8 THR CA C 13 61.772 . A 8 THR CB C 13 69.595 . A 8 THR CG2 C 13 22.500 . A 8 THR N N 15 113.875 . A 9 ALA H H 1 8.177 . A 9 ALA HA H 1 4.537 . A 9 ALA HB% H 1 1.310 . A 9 ALA C C 13 174.855 . A 9 ALA CA C 13 50.848 . A 9 ALA CB C 13 18.062 . A 9 ALA N N 15 126.484 . A 10 PRO HA H 1 4.538 . A 10 PRO HBy H 1 2.146 . A 10 PRO HBx H 1 1.854 . A 10 PRO HDx H 1 3.475 . A 10 PRO HDy H 1 3.696 . A 10 PRO HGx H 1 1.857 . A 10 PRO HGy H 1 2.082 . A 10 PRO C C 13 176.362 . A 10 PRO CA C 13 62.879 . A 10 PRO CB C 13 31.840 . A 10 PRO CD C 13 50.139 . A 11 THR H H 1 7.945 . A 11 THR HA H 1 4.399 . A 11 THR HB H 1 4.604 . A 11 THR HG2% H 1 1.293 . A 11 THR C C 13 175.097 . A 11 THR CA C 13 60.273 . A 11 THR CB C 13 71.369 . A 11 THR CG2 C 13 22.213 . A 11 THR N N 15 110.399 . A 12 LEU H H 1 8.802 . A 12 LEU HA H 1 3.922 . A 12 LEU HBy H 1 1.769 . A 12 LEU HBx H 1 1.652 . A 12 LEU HDx% H 1 0.929 . A 12 LEU HDy% H 1 1.014 . A 12 LEU HG H 1 1.546 . A 12 LEU C C 13 178.399 . A 12 LEU CA C 13 58.947 . A 12 LEU CB C 13 42.006 . A 12 LEU CDy C 13 25.270 . A 12 LEU CDx C 13 23.644 . A 12 LEU CG C 13 27.460 . A 12 LEU N N 15 122.488 . A 13 ASP H H 1 8.316 . A 13 ASP HA H 1 4.406 . A 13 ASP HBy H 1 2.672 . A 13 ASP HBx H 1 2.592 . A 13 ASP C C 13 178.443 . A 13 ASP CA C 13 57.507 . A 13 ASP CB C 13 40.704 . A 13 ASP N N 15 115.249 . A 14 SER H H 1 7.997 . A 14 SER HA H 1 4.327 . A 14 SER HBy H 1 4.037 . A 14 SER HBx H 1 3.932 . A 14 SER C C 13 177.578 . A 14 SER CA C 13 61.326 . A 14 SER CB C 13 62.795 . A 14 SER N N 15 115.362 . A 15 LEU H H 1 8.351 . A 15 LEU HA H 1 4.354 . A 15 LEU HBx H 1 1.692 . A 15 LEU HBy H 1 1.924 . A 15 LEU HDx% H 1 0.947 . A 15 LEU HDy% H 1 1.029 . A 15 LEU HG H 1 1.740 . A 15 LEU C C 13 178.061 . A 15 LEU CA C 13 57.951 . A 15 LEU CB C 13 42.171 . A 15 LEU CDy C 13 25.621 . A 15 LEU CDx C 13 23.883 . A 15 LEU CG C 13 27.406 . A 15 LEU N N 15 125.243 . A 16 ARG H H 1 8.492 . A 16 ARG HA H 1 3.894 . A 16 ARG HBx H 1 2.003 . A 16 ARG HBy H 1 2.003 . A 16 ARG HDx H 1 3.296 . A 16 ARG HDy H 1 3.296 . A 16 ARG HGx H 1 1.581 . A 16 ARG HGy H 1 1.839 . A 16 ARG C C 13 177.873 . A 16 ARG CA C 13 61.062 . A 16 ARG CB C 13 30.629 . A 16 ARG CD C 13 44.280 . A 16 ARG CG C 13 28.812 . A 16 ARG N N 15 119.501 . A 17 VAL H H 1 7.669 . A 17 VAL HA H 1 3.625 . A 17 VAL HB H 1 2.126 . A 17 VAL HGx% H 1 1.130 . A 17 VAL HGy% H 1 0.979 . A 17 VAL C C 13 177.909 . A 17 VAL CA C 13 66.311 . A 17 VAL CB C 13 32.004 . A 17 VAL CGy C 13 22.990 . A 17 VAL CGx C 13 21.331 . A 17 VAL N N 15 116.369 . A 18 TRP H H 1 7.897 . A 18 TRP HA H 1 4.105 . A 18 TRP HBx H 1 3.383 . A 18 TRP HBy H 1 3.472 . A 18 TRP HD1 H 1 7.155 . A 18 TRP HE1 H 1 10.112 . A 18 TRP HE3 H 1 7.146 . A 18 TRP HH2 H 1 6.806 . A 18 TRP HZ2 H 1 7.214 . A 18 TRP HZ3 H 1 6.929 . A 18 TRP C C 13 179.322 . A 18 TRP CA C 13 62.090 . A 18 TRP CB C 13 29.281 . A 18 TRP CD1 C 13 127.415 . A 18 TRP CH2 C 13 121.429 . A 18 TRP CZ2 C 13 114.040 . A 18 TRP CZ3 C 13 122.900 . A 18 TRP N N 15 120.931 . A 18 TRP NE1 N 15 128.264 . A 19 LEU H H 1 9.081 . A 19 LEU HA H 1 3.792 . A 19 LEU HBx H 1 1.396 . A 19 LEU HBy H 1 2.214 . A 19 LEU HDx% H 1 0.933 . A 19 LEU HDy% H 1 0.955 . A 19 LEU HG H 1 2.005 . A 19 LEU C C 13 178.608 . A 19 LEU CA C 13 58.306 . A 19 LEU CB C 13 43.542 . A 19 LEU CDy C 13 26.240 . A 19 LEU CDx C 13 24.389 . A 19 LEU CG C 13 28.343 . A 19 LEU N N 15 119.716 . A 20 VAL H H 1 8.352 . A 20 VAL HA H 1 3.255 . A 20 VAL HB H 1 2.180 . A 20 VAL HGx% H 1 0.907 . A 20 VAL HGy% H 1 1.031 . A 20 VAL C C 13 177.019 . A 20 VAL CA C 13 67.717 . A 20 VAL CB C 13 31.267 . A 20 VAL CGx C 13 22.481 . A 20 VAL CGy C 13 24.390 . A 20 VAL N N 15 120.030 . A 21 ASP H H 1 7.483 . A 21 ASP HA H 1 4.194 . A 21 ASP HBy H 1 2.541 . A 21 ASP HBx H 1 2.398 . A 21 ASP C C 13 179.001 . A 21 ASP CA C 13 57.423 . A 21 ASP CB C 13 40.153 . A 21 ASP N N 15 118.576 . A 22 CYS H H 1 8.203 . A 22 CYS HA H 1 3.764 . A 22 CYS HBx H 1 1.817 . A 22 CYS HBy H 1 2.394 . A 22 CYS C C 13 178.089 . A 22 CYS CA C 13 61.882 . A 22 CYS CB C 13 26.883 . A 22 CYS N N 15 121.824 . A 23 VAL H H 1 8.716 . A 23 VAL HA H 1 3.355 . A 23 VAL HB H 1 2.057 . A 23 VAL HGx% H 1 0.978 . A 23 VAL HGy% H 1 0.795 . A 23 VAL C C 13 177.280 . A 23 VAL CA C 13 67.315 . A 23 VAL CB C 13 31.574 . A 23 VAL CGy C 13 23.440 . A 23 VAL CGx C 13 21.880 . A 23 VAL N N 15 120.075 . A 24 ALA H H 1 8.720 . A 24 ALA HA H 1 3.617 . A 24 ALA HB% H 1 1.397 . A 24 ALA C C 13 180.241 . A 24 ALA CA C 13 56.165 . A 24 ALA CB C 13 17.269 . A 24 ALA N N 15 121.336 . A 25 GLY H H 1 7.999 . A 25 GLY HAx H 1 3.849 . A 25 GLY HAy H 1 3.849 . A 25 GLY C C 13 176.751 . A 25 GLY CA C 13 46.725 . A 25 GLY N N 15 103.304 . A 26 HIS H H 1 7.777 . A 26 HIS HA H 1 4.320 . A 26 HIS HBy H 1 3.030 . A 26 HIS HBx H 1 2.954 . A 26 HIS HD2 H 1 7.213 . A 26 HIS HE1 H 1 8.421 . A 26 HIS C C 13 176.194 . A 26 HIS CA C 13 59.195 . A 26 HIS CB C 13 29.148 . A 26 HIS CD2 C 13 119.996 . A 26 HIS CE1 C 13 137.559 . A 26 HIS N N 15 118.391 . A 27 LEU H H 1 7.955 . A 27 LEU HA H 1 4.050 . A 27 LEU HBx H 1 1.367 . A 27 LEU HBy H 1 1.493 . A 27 LEU HDx% H 1 0.614 . A 27 LEU HDy% H 1 0.466 . A 27 LEU HG H 1 1.526 . A 27 LEU C C 13 176.896 . A 27 LEU CA C 13 54.956 . A 27 LEU CB C 13 42.363 . A 27 LEU CDy C 13 26.316 . A 27 LEU CDx C 13 22.662 . A 27 LEU CG C 13 27.331 . A 27 LEU N N 15 115.175 . A 28 GLY H H 1 7.768 . A 28 GLY HAx H 1 3.915 . A 28 GLY HAy H 1 3.915 . A 28 GLY C C 13 174.510 . A 28 GLY CA C 13 46.760 . A 28 GLY N N 15 109.489 . A 29 LEU H H 1 7.883 . A 29 LEU HA H 1 4.595 . A 29 LEU HBx H 1 1.168 . A 29 LEU HBy H 1 1.353 . A 29 LEU HDx% H 1 0.834 . A 29 LEU HDy% H 1 0.746 . A 29 LEU HG H 1 1.397 . A 29 LEU C C 13 175.604 . A 29 LEU CA C 13 52.510 . A 29 LEU CB C 13 45.600 . A 29 LEU CDx C 13 22.715 . A 29 LEU CDy C 13 25.402 . A 29 LEU CG C 13 26.434 . A 29 LEU N N 15 118.747 . A 30 ASP H H 1 8.339 . A 30 ASP HA H 1 4.483 . A 30 ASP HBx H 1 2.691 . A 30 ASP HBy H 1 2.759 . A 30 ASP C C 13 178.020 . A 30 ASP CA C 13 53.754 . A 30 ASP CB C 13 41.508 . A 30 ASP N N 15 119.300 . A 31 ALA H H 1 9.073 . A 31 ALA HA H 1 3.628 . A 31 ALA HB% H 1 1.347 . A 31 ALA C C 13 178.446 . A 31 ALA CA C 13 55.454 . A 31 ALA CB C 13 18.717 . A 31 ALA N N 15 131.513 . A 32 ALA H H 1 8.371 . A 32 ALA HA H 1 4.124 . A 32 ALA HB% H 1 1.395 . A 32 ALA C C 13 178.812 . A 32 ALA CA C 13 53.841 . A 32 ALA CB C 13 18.597 . A 32 ALA N N 15 117.027 . A 33 THR H H 1 7.870 . A 33 THR HA H 1 4.314 . A 33 THR HB H 1 4.410 . A 33 THR HG2% H 1 1.246 . A 33 THR C C 13 174.256 . A 33 THR CA C 13 61.934 . A 33 THR CB C 13 69.812 . A 33 THR CG2 C 13 21.779 . A 33 THR N N 15 107.351 . A 34 ILE H H 1 7.006 . A 34 ILE HA H 1 3.641 . A 34 ILE HB H 1 1.822 . A 34 ILE HD1% H 1 0.287 . A 34 ILE HG1x H 1 0.718 . A 34 ILE HG1y H 1 1.159 . A 34 ILE HG2% H 1 0.449 . A 34 ILE C C 13 174.236 . A 34 ILE CA C 13 60.686 . A 34 ILE CB C 13 36.987 . A 34 ILE CD1 C 13 12.035 . A 34 ILE CG1 C 13 27.365 . A 34 ILE CG2 C 13 16.900 . A 34 ILE N N 15 122.110 . A 35 ALA H H 1 8.445 . A 35 ALA HA H 1 4.763 . A 35 ALA HB% H 1 1.634 . A 35 ALA C C 13 179.475 . A 35 ALA CA C 13 50.806 . A 35 ALA CB C 13 20.294 . A 35 ALA N N 15 131.062 . A 36 THR H H 1 9.005 . A 36 THR HA H 1 4.124 . A 36 THR HB H 1 4.420 . A 36 THR HG2% H 1 1.133 . A 36 THR C C 13 173.072 . A 36 THR CA C 13 64.129 . A 36 THR CB C 13 67.363 . A 36 THR CG2 C 13 22.007 . A 36 THR N N 15 112.131 . A 37 ASP H H 1 8.599 . A 37 ASP HA H 1 4.752 . A 37 ASP HBx H 1 2.600 . A 37 ASP HBy H 1 3.028 . A 37 ASP C C 13 175.440 . A 37 ASP CA C 13 52.265 . A 37 ASP CB C 13 40.676 . A 37 ASP N N 15 116.976 . A 38 LEU H H 1 6.888 . A 38 LEU HA H 1 4.966 . A 38 LEU HBy H 1 1.655 . A 38 LEU HBx H 1 1.484 . A 38 LEU HDx% H 1 0.798 . A 38 LEU HDy% H 1 0.844 . A 38 LEU HG H 1 1.650 . A 38 LEU C C 13 174.342 . A 38 LEU CA C 13 51.765 . A 38 LEU CB C 13 43.470 . A 38 LEU CDx C 13 23.571 . A 38 LEU CDy C 13 23.571 . A 38 LEU CG C 13 26.821 . A 38 LEU N N 15 120.576 . A 39 PRO HA H 1 4.326 . A 39 PRO HBy H 1 2.317 . A 39 PRO HBx H 1 2.116 . A 39 PRO C C 13 179.463 . A 39 PRO CA C 13 62.686 . A 39 PRO CB C 13 32.013 . A 40 LEU H H 1 9.138 . A 40 LEU HA H 1 4.293 . A 40 LEU HBx H 1 1.454 . A 40 LEU HBy H 1 1.839 . A 40 LEU HDx% H 1 0.791 . A 40 LEU HDy% H 1 1.059 . A 40 LEU HG H 1 2.087 . A 40 LEU C C 13 179.437 . A 40 LEU CA C 13 57.933 . A 40 LEU CB C 13 42.555 . A 40 LEU CDy C 13 25.316 . A 40 LEU CDx C 13 23.873 . A 40 LEU CG C 13 27.461 . A 40 LEU N N 15 124.956 . A 41 THR H H 1 8.111 . A 41 THR HA H 1 4.291 . A 41 THR HB H 1 4.406 . A 41 THR HG2% H 1 1.467 . A 41 THR C C 13 178.361 . A 41 THR CA C 13 64.361 . A 41 THR CB C 13 68.141 . A 41 THR CG2 C 13 22.701 . A 41 THR N N 15 110.392 . A 42 SER H H 1 8.185 . A 42 SER HA H 1 4.271 . A 42 SER HBy H 1 3.710 . A 42 SER HBx H 1 3.675 . A 42 SER C C 13 174.329 . A 42 SER CA C 13 61.374 . A 42 SER CB C 13 62.709 . A 42 SER N N 15 119.740 . A 43 TYR H H 1 7.306 . A 43 TYR HA H 1 4.684 . A 43 TYR HBx H 1 2.561 . A 43 TYR HBy H 1 3.399 . A 43 TYR HDx H 1 7.071 . A 43 TYR HEx H 1 6.843 . A 43 TYR C C 13 175.130 . A 43 TYR CA C 13 57.491 . A 43 TYR CB C 13 39.154 . A 43 TYR CDx C 13 132.413 . A 43 TYR CEx C 13 118.501 . A 43 TYR N N 15 118.040 . A 44 GLY H H 1 7.581 . A 44 GLY HAx H 1 3.789 . A 44 GLY HAy H 1 4.399 . A 44 GLY C C 13 174.473 . A 44 GLY CA C 13 44.749 . A 44 GLY N N 15 104.367 . A 45 LEU H H 1 7.186 . A 45 LEU HA H 1 4.062 . A 45 LEU HBy H 1 1.492 . A 45 LEU HBx H 1 1.237 . A 45 LEU HDx% H 1 0.498 . A 45 LEU HDy% H 1 0.769 . A 45 LEU HG H 1 1.680 . A 45 LEU C C 13 174.242 . A 45 LEU CA C 13 56.991 . A 45 LEU CB C 13 42.355 . A 45 LEU CDy C 13 25.586 . A 45 LEU CDx C 13 23.791 . A 45 LEU CG C 13 27.069 . A 45 LEU N N 15 119.632 . A 46 ASP H H 1 7.639 . A 46 ASP HA H 1 4.948 . A 46 ASP HBx H 1 2.827 . A 46 ASP HBy H 1 3.217 . A 46 ASP C C 13 176.681 . A 46 ASP CA C 13 52.602 . A 46 ASP CB C 13 42.627 . A 46 ASP N N 15 125.972 . A 47 SER H H 1 8.689 . A 47 SER HA H 1 4.258 . A 47 SER HBx H 1 3.921 . A 47 SER HBy H 1 3.921 . A 47 SER C C 13 175.752 . A 47 SER CA C 13 62.092 . A 47 SER CB C 13 62.795 . A 47 SER N N 15 114.070 . A 48 VAL H H 1 7.601 . A 48 VAL HA H 1 3.718 . A 48 VAL HB H 1 2.130 . A 48 VAL HGx% H 1 0.984 . A 48 VAL HGy% H 1 0.834 . A 48 VAL C C 13 179.567 . A 48 VAL CA C 13 66.184 . A 48 VAL CB C 13 31.441 . A 48 VAL CGy C 13 22.367 . A 48 VAL CGx C 13 21.493 . A 48 VAL N N 15 122.568 . A 49 TYR H H 1 8.656 . A 49 TYR HA H 1 4.449 . A 49 TYR HBx H 1 2.936 . A 49 TYR HBy H 1 2.936 . A 49 TYR HDx H 1 7.093 . A 49 TYR HEx H 1 6.754 . A 49 TYR C C 13 178.575 . A 49 TYR CA C 13 60.553 . A 49 TYR CB C 13 38.878 . A 49 TYR CDx C 13 132.413 . A 49 TYR CEx C 13 118.501 . A 49 TYR N N 15 120.689 . A 50 ALA H H 1 8.610 . A 50 ALA HA H 1 3.755 . A 50 ALA HB% H 1 1.420 . A 50 ALA C C 13 178.950 . A 50 ALA CA C 13 55.923 . A 50 ALA CB C 13 18.301 . A 50 ALA N N 15 120.368 . A 51 LEU H H 1 7.777 . A 51 LEU HA H 1 4.087 . A 51 LEU HBy H 1 1.925 . A 51 LEU HBx H 1 1.680 . A 51 LEU HDx% H 1 0.954 . A 51 LEU HDy% H 1 0.900 . A 51 LEU HG H 1 1.853 . A 51 LEU C C 13 179.836 . A 51 LEU CA C 13 57.982 . A 51 LEU CB C 13 41.649 . A 51 LEU CDy C 13 25.055 . A 51 LEU CDx C 13 23.823 . A 51 LEU CG C 13 27.421 . A 51 LEU N N 15 117.217 . A 52 SER H H 1 7.698 . A 52 SER HA H 1 4.322 . A 52 SER HBx H 1 3.896 . A 52 SER HBy H 1 3.896 . A 52 SER C C 13 177.047 . A 52 SER CA C 13 61.819 . A 52 SER CB C 13 62.775 . A 52 SER N N 15 116.010 . A 53 ILE H H 1 8.123 . A 53 ILE HA H 1 3.568 . A 53 ILE HB H 1 1.666 . A 53 ILE HD1% H 1 0.615 . A 53 ILE HG1x H 1 1.320 . A 53 ILE HG1y H 1 1.320 . A 53 ILE HG2% H 1 0.756 . A 53 ILE C C 13 177.401 . A 53 ILE CA C 13 64.772 . A 53 ILE CB C 13 37.757 . A 53 ILE CD1 C 13 13.915 . A 53 ILE CG1 C 13 29.316 . A 53 ILE CG2 C 13 16.799 . A 53 ILE N N 15 122.233 . A 54 ALA H H 1 8.237 . A 54 ALA HA H 1 3.903 . A 54 ALA HB% H 1 1.473 . A 54 ALA C C 13 178.862 . A 54 ALA CA C 13 55.935 . A 54 ALA CB C 13 17.757 . A 54 ALA N N 15 121.615 . A 55 ALA H H 1 7.852 . A 55 ALA HA H 1 4.294 . A 55 ALA HB% H 1 1.569 . A 55 ALA C C 13 180.737 . A 55 ALA CA C 13 54.997 . A 55 ALA CB C 13 18.034 . A 55 ALA N N 15 118.798 . A 56 GLU H H 1 7.884 . A 56 GLU HA H 1 4.307 . A 56 GLU HBx H 1 2.289 . A 56 GLU HBy H 1 2.368 . A 56 GLU HGx H 1 2.510 . A 56 GLU HGy H 1 2.635 . A 56 GLU C C 13 180.105 . A 56 GLU CA C 13 59.537 . A 56 GLU CB C 13 29.437 . A 56 GLU CG C 13 36.922 . A 56 GLU N N 15 119.441 . A 57 LEU H H 1 8.620 . A 57 LEU HA H 1 3.921 . A 57 LEU HBx H 1 1.392 . A 57 LEU HBy H 1 2.134 . A 57 LEU HDx% H 1 0.762 . A 57 LEU HDy% H 1 0.857 . A 57 LEU HG H 1 1.840 . A 57 LEU C C 13 178.628 . A 57 LEU CA C 13 58.266 . A 57 LEU CB C 13 42.326 . A 57 LEU CDy C 13 25.297 . A 57 LEU CDx C 13 23.421 . A 57 LEU CG C 13 27.328 . A 57 LEU N N 15 121.936 . A 58 GLU H H 1 8.481 . A 58 GLU HA H 1 4.021 . A 58 GLU HBx H 1 2.199 . A 58 GLU HBy H 1 2.345 . A 58 GLU HGx H 1 2.333 . A 58 GLU HGy H 1 2.740 . A 58 GLU C C 13 179.471 . A 58 GLU CA C 13 59.998 . A 58 GLU CB C 13 29.703 . A 58 GLU CG C 13 36.817 . A 58 GLU N N 15 119.453 . A 59 ASP H H 1 7.768 . A 59 ASP HA H 1 4.475 . A 59 ASP HBy H 1 2.869 . A 59 ASP HBx H 1 2.798 . A 59 ASP C C 13 177.832 . A 59 ASP CA C 13 56.730 . A 59 ASP CB C 13 41.579 . A 59 ASP N N 15 117.533 . A 60 HIS H H 1 8.276 . A 60 HIS HA H 1 4.407 . A 60 HIS HBx H 1 2.831 . A 60 HIS HBy H 1 3.155 . A 60 HIS HD2 H 1 7.282 . A 60 HIS HE1 H 1 8.374 . A 60 HIS C C 13 175.797 . A 60 HIS CA C 13 58.155 . A 60 HIS CB C 13 29.910 . A 60 HIS CD2 C 13 119.996 . A 60 HIS CE1 C 13 137.559 . A 60 HIS N N 15 116.220 . A 61 LEU H H 1 8.210 . A 61 LEU HA H 1 4.182 . A 61 LEU HBy H 1 1.707 . A 61 LEU HBx H 1 1.521 . A 61 LEU HDx% H 1 0.753 . A 61 LEU HDy% H 1 0.620 . A 61 LEU HG H 1 1.738 . A 61 LEU C C 13 175.794 . A 61 LEU CA C 13 54.363 . A 61 LEU CB C 13 43.226 . A 61 LEU CDy C 13 26.463 . A 61 LEU CDx C 13 23.276 . A 61 LEU CG C 13 27.375 . A 61 LEU N N 15 115.186 . A 62 ASP H H 1 8.019 . A 62 ASP HA H 1 4.429 . A 62 ASP HBx H 1 2.414 . A 62 ASP HBy H 1 3.104 . A 62 ASP C C 13 174.610 . A 62 ASP CA C 13 54.914 . A 62 ASP CB C 13 39.379 . A 62 ASP N N 15 119.028 . A 63 VAL H H 1 7.394 . A 63 VAL HA H 1 4.526 . A 63 VAL HB H 1 1.993 . A 63 VAL HGx% H 1 0.762 . A 63 VAL HGy% H 1 0.674 . A 63 VAL C C 13 174.227 . A 63 VAL CA C 13 59.196 . A 63 VAL CB C 13 35.518 . A 63 VAL CGy C 13 21.736 . A 63 VAL CGx C 13 19.580 . A 63 VAL N N 15 110.967 . A 64 SER H H 1 8.214 . A 64 SER HA H 1 4.648 . A 64 SER HBx H 1 3.687 . A 64 SER HBy H 1 3.779 . A 64 SER C C 13 174.091 . A 64 SER CA C 13 57.416 . A 64 SER CB C 13 63.835 . A 64 SER N N 15 116.252 . A 65 LEU H H 1 9.101 . A 65 LEU HA H 1 4.548 . A 65 LEU HBy H 1 1.545 . A 65 LEU HBx H 1 1.441 . A 65 LEU HDx% H 1 0.778 . A 65 LEU HDy% H 1 0.744 . A 65 LEU HG H 1 1.550 . A 65 LEU C C 13 175.819 . A 65 LEU CA C 13 53.530 . A 65 LEU CB C 13 44.310 . A 65 LEU CDy C 13 25.982 . A 65 LEU CDx C 13 24.496 . A 65 LEU CG C 13 26.880 . A 65 LEU N N 15 125.917 . A 66 ASP H H 1 8.514 . A 66 ASP HA H 1 4.812 . A 66 ASP HBy H 1 2.769 . A 66 ASP HBx H 1 2.684 . A 66 ASP C C 13 175.761 . A 66 ASP CA C 13 51.788 . A 66 ASP CB C 13 42.170 . A 66 ASP N N 15 124.439 . A 67 PRO HA H 1 4.215 . A 67 PRO HBx H 1 2.019 . A 67 PRO HBy H 1 2.244 . A 67 PRO HDx H 1 3.953 . A 67 PRO HDy H 1 4.000 . A 67 PRO HGx H 1 2.017 . A 67 PRO HGy H 1 2.085 . A 67 PRO C C 13 177.725 . A 67 PRO CA C 13 64.891 . A 67 PRO CB C 13 32.124 . A 67 PRO CD C 13 51.437 . A 67 PRO CG C 13 27.707 . A 68 THR H H 1 8.459 . A 68 THR HA H 1 4.340 . A 68 THR HB H 1 4.276 . A 68 THR HG2% H 1 1.299 . A 68 THR C C 13 175.675 . A 68 THR CA C 13 64.362 . A 68 THR CB C 13 69.016 . A 68 THR CG2 C 13 22.003 . A 68 THR N N 15 110.689 . A 69 LEU H H 1 7.808 . A 69 LEU HA H 1 4.211 . A 69 LEU HBx H 1 1.847 . A 69 LEU HBy H 1 1.997 . A 69 LEU HDx% H 1 0.958 . A 69 LEU HDy% H 1 0.854 . A 69 LEU HG H 1 1.630 . A 69 LEU C C 13 178.891 . A 69 LEU CA C 13 58.293 . A 69 LEU CB C 13 42.727 . A 69 LEU CDy C 13 25.092 . A 69 LEU CDx C 13 23.873 . A 69 LEU CG C 13 27.510 . A 69 LEU N N 15 122.728 . A 70 ILE H H 1 7.651 . A 70 ILE HA H 1 3.728 . A 70 ILE HB H 1 1.548 . A 70 ILE HD1% H 1 0.702 . A 70 ILE HG1x H 1 0.964 . A 70 ILE HG1y H 1 1.399 . A 70 ILE HG2% H 1 0.428 . A 70 ILE C C 13 175.998 . A 70 ILE CA C 13 63.215 . A 70 ILE CB C 13 37.580 . A 70 ILE CD1 C 13 13.660 . A 70 ILE CG1 C 13 29.020 . A 70 ILE CG2 C 13 17.121 . A 70 ILE N N 15 115.781 . A 71 TRP H H 1 7.207 . A 71 TRP HA H 1 4.501 . A 71 TRP HBx H 1 3.104 . A 71 TRP HBy H 1 3.388 . A 71 TRP HD1 H 1 7.168 . A 71 TRP HE1 H 1 9.895 . A 71 TRP HE3 H 1 7.618 . A 71 TRP HH2 H 1 6.949 . A 71 TRP HZ2 H 1 7.219 . A 71 TRP HZ3 H 1 6.940 . A 71 TRP C C 13 177.869 . A 71 TRP CA C 13 57.874 . A 71 TRP CB C 13 29.419 . A 71 TRP CD1 C 13 127.415 . A 71 TRP CE3 C 13 121.000 . A 71 TRP CH2 C 13 123.581 . A 71 TRP CZ2 C 13 114.040 . A 71 TRP CZ3 C 13 118.622 . A 71 TRP N N 15 118.548 . A 71 TRP NE1 N 15 129.389 . A 72 ASP H H 1 8.070 . A 72 ASP HA H 1 4.465 . A 72 ASP HBx H 1 2.247 . A 72 ASP HBy H 1 2.527 . A 72 ASP C C 13 176.148 . A 72 ASP CA C 13 55.103 . A 72 ASP CB C 13 40.701 . A 72 ASP N N 15 116.858 . A 73 HIS H H 1 7.550 . A 73 HIS HA H 1 4.967 . A 73 HIS HBy H 1 3.268 . A 73 HIS HBx H 1 2.710 . A 73 HIS HD2 H 1 7.366 . A 73 HIS HE1 H 1 8.607 . A 73 HIS C C 13 171.662 . A 73 HIS CA C 13 53.085 . A 73 HIS CB C 13 28.462 . A 73 HIS CD2 C 13 119.996 . A 73 HIS CE1 C 13 136.897 . A 73 HIS N N 15 116.676 . A 74 PRO HA H 1 4.744 . A 74 PRO HBx H 1 2.021 . A 74 PRO HBy H 1 2.238 . A 74 PRO HDx H 1 3.472 . A 74 PRO HDy H 1 3.602 . A 74 PRO HGy H 1 2.082 . A 74 PRO HGx H 1 1.875 . A 74 PRO C C 13 176.973 . A 74 PRO CA C 13 65.121 . A 74 PRO CB C 13 31.743 . A 74 PRO CD C 13 49.801 . A 74 PRO CG C 13 27.354 . A 75 THR H H 1 7.495 . A 75 THR HA H 1 4.799 . A 75 THR HB H 1 4.569 . A 75 THR HG2% H 1 0.925 . A 75 THR C C 13 174.104 . A 75 THR CA C 13 58.430 . A 75 THR CB C 13 71.148 . A 75 THR CG2 C 13 21.077 . A 75 THR N N 15 109.710 . A 76 ILE H H 1 9.386 . A 76 ILE HA H 1 3.722 . A 76 ILE HB H 1 1.893 . A 76 ILE HD1% H 1 0.818 . A 76 ILE HG1y H 1 1.936 . A 76 ILE HG1x H 1 1.221 . A 76 ILE HG2% H 1 1.067 . A 76 ILE C C 13 179.258 . A 76 ILE CA C 13 65.894 . A 76 ILE CB C 13 37.014 . A 76 ILE CD1 C 13 12.970 . A 76 ILE CG1 C 13 30.052 . A 76 ILE CG2 C 13 18.038 . A 76 ILE N N 15 123.173 . A 77 ASP H H 1 9.561 . A 77 ASP HA H 1 4.338 . A 77 ASP HBy H 1 2.649 . A 77 ASP HBx H 1 2.545 . A 77 ASP C C 13 178.211 . A 77 ASP CA C 13 58.388 . A 77 ASP CB C 13 40.090 . A 77 ASP N N 15 123.849 . A 78 ALA H H 1 8.441 . A 78 ALA HA H 1 4.183 . A 78 ALA HB% H 1 1.547 . A 78 ALA C C 13 180.705 . A 78 ALA CA C 13 54.837 . A 78 ALA CB C 13 18.918 . A 78 ALA N N 15 123.718 . A 79 LEU H H 1 8.961 . A 79 LEU HA H 1 3.955 . A 79 LEU HBx H 1 1.684 . A 79 LEU HBy H 1 2.172 . A 79 LEU HDx% H 1 0.904 . A 79 LEU HDy% H 1 0.845 . A 79 LEU HG H 1 1.741 . A 79 LEU C C 13 178.243 . A 79 LEU CA C 13 58.153 . A 79 LEU CB C 13 41.845 . A 79 LEU CDy C 13 25.290 . A 79 LEU CDx C 13 23.947 . A 79 LEU CG C 13 27.562 . A 79 LEU N N 15 121.699 . A 80 SER H H 1 8.573 . A 80 SER HA H 1 4.477 . A 80 SER HBx H 1 3.958 . A 80 SER HBy H 1 3.958 . A 80 SER C C 13 175.479 . A 80 SER CA C 13 58.342 . A 80 SER CB C 13 62.825 . A 80 SER N N 15 113.533 . A 81 THR H H 1 7.717 . A 81 THR HA H 1 4.202 . A 81 THR HB H 1 3.785 . A 81 THR HG1 H 1 1.230 . A 81 THR HG2% H 1 0.765 . A 81 THR C C 13 176.420 . A 81 THR CA C 13 68.943 . A 81 THR CB C 13 66.779 . A 81 THR CG2 C 13 22.015 . A 81 THR N N 15 117.244 . A 82 ALA H H 1 7.807 . A 82 ALA HA H 1 4.046 . A 82 ALA HB% H 1 1.058 . A 82 ALA C C 13 180.264 . A 82 ALA CA C 13 54.738 . A 82 ALA CB C 13 17.419 . A 82 ALA N N 15 123.805 . A 83 LEU H H 1 8.296 . A 83 LEU HA H 1 3.924 . A 83 LEU HBx H 1 1.174 . A 83 LEU HBy H 1 2.010 . A 83 LEU HDx% H 1 0.840 . A 83 LEU HDy% H 1 0.743 . A 83 LEU HG H 1 1.854 . A 83 LEU C C 13 178.602 . A 83 LEU CA C 13 57.688 . A 83 LEU CB C 13 42.501 . A 83 LEU CDx C 13 24.031 . A 83 LEU CDy C 13 25.296 . A 83 LEU CG C 13 27.359 . A 83 LEU N N 15 118.447 . A 84 VAL H H 1 7.891 . A 84 VAL HA H 1 3.605 . A 84 VAL HB H 1 2.136 . A 84 VAL HGx% H 1 0.993 . A 84 VAL HGy% H 1 0.947 . A 84 VAL C C 13 177.903 . A 84 VAL CA C 13 66.418 . A 84 VAL CB C 13 31.357 . A 84 VAL CGy C 13 23.144 . A 84 VAL CGx C 13 21.501 . A 84 VAL N N 15 117.009 . A 85 ALA H H 1 7.479 . A 85 ALA HA H 1 4.170 . A 85 ALA HB% H 1 1.492 . A 85 ALA C C 13 179.937 . A 85 ALA CA C 13 54.618 . A 85 ALA CB C 13 18.111 . A 85 ALA N N 15 120.913 . A 86 GLU H H 1 7.705 . A 86 GLU HA H 1 4.182 . A 86 GLU HBy H 1 2.170 . A 86 GLU HBx H 1 2.071 . A 86 GLU HGx H 1 2.312 . A 86 GLU HGy H 1 2.390 . A 86 GLU C C 13 178.085 . A 86 GLU CA C 13 57.388 . A 86 GLU CB C 13 29.520 . A 86 GLU CG C 13 35.106 . A 86 GLU N N 15 116.850 . A 87 LEU H H 1 7.832 . A 87 LEU HA H 1 4.188 . A 87 LEU HBy H 1 1.836 . A 87 LEU HBx H 1 1.583 . A 87 LEU HDx% H 1 0.860 . A 87 LEU HDy% H 1 0.839 . A 87 LEU HG H 1 1.851 . A 87 LEU C C 13 177.554 . A 87 LEU CA C 13 56.027 . A 87 LEU CB C 13 42.003 . A 87 LEU CDx C 13 23.473 . A 87 LEU CDy C 13 25.230 . A 87 LEU CG C 13 26.154 . A 87 LEU N N 15 119.107 . A 88 ARG H H 1 7.922 . A 88 ARG HA H 1 4.336 . A 88 ARG HBx H 1 1.853 . A 88 ARG HBy H 1 1.936 . A 88 ARG HDx H 1 3.221 . A 88 ARG HDy H 1 3.221 . A 88 ARG HGx H 1 1.666 . A 88 ARG HGy H 1 1.740 . A 88 ARG C C 13 176.360 . A 88 ARG CA C 13 56.529 . A 88 ARG CB C 13 30.599 . A 88 ARG CD C 13 43.650 . A 88 ARG CG C 13 27.466 . A 88 ARG N N 15 119.046 . A 89 SER H H 1 8.051 . A 89 SER HA H 1 4.441 . A 89 SER HBx H 1 3.913 . A 89 SER HBy H 1 3.913 . A 89 SER C C 13 173.377 . A 89 SER CA C 13 58.396 . A 89 SER CB C 13 64.055 . A 89 SER N N 15 116.398 . A 90 ALA H H 1 7.902 . A 90 ALA HA H 1 4.134 . A 90 ALA HB% H 1 1.357 . A 90 ALA C C 13 182.475 . A 90 ALA CA C 13 54.076 . A 90 ALA CB C 13 20.163 . A 90 ALA N N 15 131.316 . stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _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 3 MET HA A 3 MET HGx 1.0 0.0 3.65 2 1 A 3 MET HA A 3 MET HGy 1.0 0.0 3.65 3 2 A 4 SER HA A 5 ASP H 1.0 0.0 3.51 4 3 A 5 ASP H A 4 SER HBy 1.0 0.0 5.40 5 4 A 5 ASP H A 4 SER HBx 1.0 0.0 5.40 6 5 A 5 ASP H A 5 ASP HBx 1.0 0.0 3.71 7 6 A 5 ASP H A 5 ASP HBy 1.0 0.0 3.71 8 7 A 5 ASP H A 5 ASP HBx 1.0 0.0 3.21 9 7 A 5 ASP H A 5 ASP HBy 1.0 0.0 3.21 10 8 A 5 ASP H A 6 LEU H 1.0 0.0 3.07 11 9 A 6 LEU HA A 6 LEU HDy% 1.0 0.0 3.19 12 9 A 6 LEU HA A 6 LEU HDx% 1.0 0.0 3.19 13 10 A 6 LEU HA A 6 LEU HG 1.0 0.0 4.20 14 11 A 6 LEU HA A 7 SER HBy 1.0 0.0 5.02 15 11 A 6 LEU HA A 7 SER HBx 1.0 0.0 5.02 16 12 A 6 LEU HA A 7 SER H 1.0 0.0 3.47 17 13 A 6 LEU HDx% A 6 LEU HBy 1.0 0.0 3.52 18 14 A 6 LEU HBy A 6 LEU HDy% 1.0 0.0 3.52 19 15 A 6 LEU HDx% A 6 LEU HBx 1.0 0.0 3.52 20 16 A 6 LEU HBx A 6 LEU HDy% 1.0 0.0 3.52 21 17 A 6 LEU HBy A 10 PRO HBx 1.0 0.0 3.57 22 17 A 6 LEU HBx A 10 PRO HBx 1.0 0.0 3.57 23 17 A 10 PRO HBy A 6 LEU HBy 1.0 0.0 3.57 24 17 A 6 LEU HBx A 10 PRO HBy 1.0 0.0 3.57 25 18 A 6 LEU HBx A 6 LEU HDy% 1.0 0.0 1.57 26 18 A 6 LEU HBy A 6 LEU HDy% 1.0 0.0 1.57 27 18 A 6 LEU HDx% A 6 LEU HBy 1.0 0.0 1.57 28 18 A 6 LEU HDx% A 6 LEU HBx 1.0 0.0 1.57 29 19 A 7 SER H A 6 LEU HBy 1.0 0.0 4.33 30 19 A 7 SER H A 6 LEU HBx 1.0 0.0 4.33 31 20 A 6 LEU HDx% A 10 PRO HBx 1.0 0.0 2.70 32 20 A 6 LEU HDy% A 10 PRO HBx 1.0 0.0 2.70 33 20 A 10 PRO HBy A 6 LEU HDy% 1.0 0.0 2.70 34 20 A 6 LEU HDx% A 10 PRO HBy 1.0 0.0 2.70 35 21 A 6 LEU HDx% A 10 PRO HGx 1.0 0.0 2.74 36 21 A 6 LEU HDy% A 10 PRO HGx 1.0 0.0 2.74 37 21 A 10 PRO HGy A 6 LEU HDy% 1.0 0.0 2.74 38 21 A 6 LEU HDx% A 10 PRO HGy 1.0 0.0 2.74 39 22 A 11 THR H A 6 LEU HDy% 1.0 0.0 5.44 40 22 A 6 LEU HDx% A 11 THR H 1.0 0.0 5.44 41 23 A 6 LEU HDx% A 7 SER HBy 1.0 0.0 3.74 42 23 A 6 LEU HDy% A 7 SER HBy 1.0 0.0 3.74 43 23 A 7 SER HBx A 6 LEU HDy% 1.0 0.0 3.74 44 23 A 6 LEU HDx% A 7 SER HBx 1.0 0.0 3.74 45 24 A 7 SER H A 6 LEU HDy% 1.0 0.0 5.44 46 24 A 6 LEU HDx% A 7 SER H 1.0 0.0 5.44 47 25 A 9 ALA H A 6 LEU HDy% 1.0 0.0 5.18 48 25 A 6 LEU HDx% A 9 ALA H 1.0 0.0 5.18 49 26 A 6 LEU H A 6 LEU HBy 1.0 0.0 3.17 50 26 A 6 LEU H A 6 LEU HBx 1.0 0.0 3.17 51 27 A 6 LEU H A 6 LEU HDx% 1.0 0.0 4.71 52 28 A 6 LEU H A 6 LEU HDy% 1.0 0.0 4.71 53 29 A 6 LEU H A 6 LEU HDy% 1.0 0.0 3.99 54 29 A 6 LEU H A 6 LEU HDx% 1.0 0.0 3.99 55 30 A 6 LEU H A 6 LEU HG 1.0 0.0 4.97 56 31 A 6 LEU H A 7 SER H 1.0 0.0 4.64 57 32 A 7 SER HA A 9 ALA HB% 1.0 0.0 5.50 58 33 A 9 ALA H A 7 SER HBy 1.0 0.0 4.59 59 34 A 7 SER HBx A 9 ALA H 1.0 0.0 4.59 60 35 A 8 THR H A 7 SER HBy 1.0 0.0 4.45 61 35 A 7 SER HBx A 8 THR H 1.0 0.0 4.45 62 36 A 9 ALA H A 7 SER HBy 1.0 0.0 3.86 63 36 A 7 SER HBx A 9 ALA H 1.0 0.0 3.86 64 37 A 7 SER H A 8 THR H 1.0 0.0 4.59 65 38 A 7 SER H A 9 ALA HB% 1.0 0.0 6.50 66 39 A 7 SER H A 9 ALA H 1.0 0.0 4.60 67 40 A 8 THR HB A 10 PRO HDy 1.0 0.0 5.12 68 41 A 9 ALA HB% A 8 THR HB 1.0 0.0 4.31 69 42 A 9 ALA H A 8 THR HB 1.0 0.0 4.18 70 43 A 9 ALA H A 8 THR HG1 1.0 0.0 5.50 71 44 A 8 THR H A 8 THR HB 1.0 0.0 3.71 72 45 A 8 THR H A 8 THR HG1 1.0 0.0 4.14 73 46 A 8 THR H A 8 THR HG2% 1.0 0.0 4.01 74 47 A 9 ALA HB% A 8 THR H 1.0 0.0 4.40 75 48 A 9 ALA H A 8 THR H 1.0 0.0 3.33 76 49 A 10 PRO HDy A 9 ALA HA 1.0 0.0 3.38 77 50 A 9 ALA HA A 10 PRO HDx 1.0 0.0 3.51 78 51 A 9 ALA HA A 87 LEU HDy% 1.0 0.0 3.63 79 51 A 9 ALA HA A 87 LEU HDx% 1.0 0.0 3.63 80 52 A 9 ALA HB% A 10 PRO HDy 1.0 0.0 4.38 81 53 A 9 ALA HB% A 10 PRO HDx 1.0 0.0 3.98 82 54 A 9 ALA HB% A 87 LEU HDx% 1.0 0.0 4.56 83 55 A 9 ALA HB% A 87 LEU HDy% 1.0 0.0 4.56 84 56 A 9 ALA HB% A 87 LEU HDy% 1.0 0.0 3.53 85 56 A 9 ALA HB% A 87 LEU HDx% 1.0 0.0 3.53 86 57 A 9 ALA H A 10 PRO HDy 1.0 0.0 5.50 87 58 A 9 ALA H A 10 PRO HDx 1.0 0.0 4.63 88 59 A 9 ALA H A 9 ALA HB% 1.0 0.0 3.55 89 60 A 11 THR H A 10 PRO HA 1.0 0.0 3.08 90 61 A 15 LEU HDx% A 10 PRO HBx 1.0 0.0 3.54 91 62 A 10 PRO HBx A 15 LEU HDy% 1.0 0.0 3.54 92 63 A 10 PRO HBy A 15 LEU HDx% 1.0 0.0 3.54 93 64 A 10 PRO HBy A 15 LEU HDy% 1.0 0.0 3.54 94 65 A 11 THR H A 10 PRO HBx 1.0 0.0 3.85 95 65 A 10 PRO HBy A 11 THR H 1.0 0.0 3.85 96 66 A 10 PRO HBy A 15 LEU HDy% 1.0 0.0 1.57 97 66 A 10 PRO HBx A 15 LEU HDy% 1.0 0.0 1.57 98 66 A 15 LEU HDx% A 10 PRO HBx 1.0 0.0 1.57 99 66 A 10 PRO HBy A 15 LEU HDx% 1.0 0.0 1.57 100 67 A 10 PRO HDy A 87 LEU HDx% 1.0 0.0 5.47 101 68 A 10 PRO HDy A 87 LEU HDy% 1.0 0.0 5.47 102 69 A 10 PRO HDy A 87 LEU HDy% 1.0 0.0 4.50 103 69 A 10 PRO HDy A 87 LEU HDx% 1.0 0.0 4.50 104 70 A 10 PRO HDx A 87 LEU HBx 1.0 0.0 4.90 105 70 A 10 PRO HDx A 87 LEU HBy 1.0 0.0 4.90 106 71 A 10 PRO HDx A 87 LEU HDx% 1.0 0.0 4.51 107 72 A 10 PRO HDx A 87 LEU HDy% 1.0 0.0 4.51 108 73 A 10 PRO HDx A 87 LEU HDy% 1.0 0.0 3.51 109 73 A 10 PRO HDx A 87 LEU HDx% 1.0 0.0 3.51 110 74 A 11 THR HA A 11 THR HG2% 1.0 0.0 2.84 111 75 A 11 THR HA A 12 LEU HA 1.0 0.0 4.36 112 76 A 11 THR HA A 12 LEU HBy 1.0 0.0 5.03 113 77 A 11 THR HA A 12 LEU HDx% 1.0 0.0 4.53 114 78 A 11 THR HA A 12 LEU H 1.0 0.0 3.31 115 79 A 11 THR HA A 84 VAL HGy% 1.0 0.0 4.17 116 80 A 12 LEU H A 11 THR HB 1.0 0.0 3.65 117 81 A 11 THR HB A 13 ASP H 1.0 0.0 3.87 118 82 A 11 THR HB A 14 SER H 1.0 0.0 4.29 119 83 A 11 THR HG1 A 14 SER HBx 1.0 0.0 5.34 120 83 A 11 THR HG1 A 14 SER HBy 1.0 0.0 5.34 121 84 A 11 THR HG2% A 12 LEU HA 1.0 0.0 4.37 122 85 A 11 THR HG2% A 12 LEU HBx 1.0 0.0 5.34 123 86 A 11 THR HG2% A 12 LEU HBy 1.0 0.0 5.24 124 87 A 11 THR HG2% A 12 LEU H 1.0 0.0 4.48 125 88 A 11 THR HG2% A 13 ASP HA 1.0 0.0 5.49 126 89 A 11 THR HG2% A 13 ASP HBx 1.0 0.0 3.73 127 89 A 11 THR HG2% A 13 ASP HBy 1.0 0.0 3.73 128 90 A 11 THR HG2% A 13 ASP H 1.0 0.0 4.17 129 91 A 11 THR HG2% A 14 SER HBx 1.0 0.0 5.34 130 91 A 11 THR HG2% A 14 SER HBy 1.0 0.0 5.34 131 92 A 11 THR HG2% A 14 SER H 1.0 0.0 4.73 132 93 A 11 THR H A 11 THR HG1 1.0 0.0 3.86 133 94 A 11 THR H A 11 THR HG2% 1.0 0.0 4.38 134 95 A 11 THR H A 12 LEU H 1.0 0.0 5.21 135 96 A 11 THR H A 14 SER HBx 1.0 0.0 4.20 136 96 A 11 THR H A 14 SER HBy 1.0 0.0 4.20 137 97 A 11 THR H A 15 LEU HDy% 1.0 0.0 5.44 138 97 A 11 THR H A 15 LEU HDx% 1.0 0.0 5.44 139 98 A 12 LEU HA A 12 LEU HDx% 1.0 0.0 3.69 140 99 A 12 LEU HA A 12 LEU HDy% 1.0 0.0 4.02 141 100 A 12 LEU HA A 12 LEU HG 1.0 0.0 3.88 142 101 A 12 LEU HA A 14 SER H 1.0 0.0 5.12 143 102 A 12 LEU HA A 15 LEU HDy% 1.0 0.0 3.48 144 102 A 15 LEU HDx% A 12 LEU HA 1.0 0.0 3.48 145 103 A 12 LEU HA A 15 LEU H 1.0 0.0 4.13 146 104 A 12 LEU HA A 84 VAL HB 1.0 0.0 3.99 147 105 A 12 LEU HA A 84 VAL HGx% 1.0 0.0 4.55 148 106 A 12 LEU HA A 84 VAL HGy% 1.0 0.0 4.01 149 107 A 13 ASP H A 12 LEU HBx 1.0 0.0 3.86 150 108 A 84 VAL HGy% A 12 LEU HBx 1.0 0.0 5.00 151 109 A 12 LEU HBy A 12 LEU HDx% 1.0 0.0 2.86 152 110 A 12 LEU HBy A 12 LEU HDy% 1.0 0.0 3.54 153 111 A 12 LEU HBy A 13 ASP H 1.0 0.0 3.42 154 112 A 12 LEU HBy A 14 SER H 1.0 0.0 5.50 155 113 A 12 LEU HDx% A 13 ASP H 1.0 0.0 4.99 156 114 A 12 LEU HG A 84 VAL HA 1.0 0.0 4.83 157 115 A 84 VAL HGy% A 12 LEU HG 1.0 0.0 3.49 158 116 A 12 LEU HG A 84 VAL H 1.0 0.0 5.50 159 117 A 12 LEU H A 12 LEU HBx 1.0 0.0 3.61 160 118 A 12 LEU HBy A 12 LEU H 1.0 0.0 3.21 161 119 A 12 LEU HDx% A 12 LEU H 1.0 0.0 4.11 162 120 A 12 LEU H A 12 LEU HDy% 1.0 0.0 4.02 163 121 A 12 LEU H A 12 LEU HG 1.0 0.0 5.50 164 122 A 12 LEU H A 13 ASP H 1.0 0.0 3.72 165 123 A 12 LEU H A 14 SER H 1.0 0.0 5.50 166 124 A 12 LEU H A 84 VAL HGy% 1.0 0.0 4.67 167 125 A 13 ASP HA A 16 ARG HBy 1.0 0.0 4.68 168 126 A 13 ASP HA A 16 ARG HBx 1.0 0.0 4.68 169 127 A 13 ASP HA A 16 ARG HBx 1.0 0.0 4.09 170 127 A 13 ASP HA A 16 ARG HBy 1.0 0.0 4.09 171 128 A 13 ASP HA A 16 ARG HDy 1.0 0.0 3.96 172 128 A 13 ASP HA A 16 ARG HDx 1.0 0.0 3.96 173 129 A 13 ASP HA A 16 ARG HGy 1.0 0.0 5.34 174 129 A 13 ASP HA A 16 ARG HGx 1.0 0.0 5.34 175 130 A 13 ASP HA A 16 ARG H 1.0 0.0 4.05 176 131 A 14 SER H A 13 ASP HBx 1.0 0.0 4.02 177 132 A 17 VAL HGx% A 13 ASP HBx 1.0 0.0 3.52 178 133 A 13 ASP HBx A 17 VAL HGy% 1.0 0.0 4.52 179 134 A 14 SER H A 13 ASP HBy 1.0 0.0 4.02 180 135 A 13 ASP HBy A 17 VAL HGx% 1.0 0.0 4.52 181 136 A 13 ASP HBy A 17 VAL HGy% 1.0 0.0 4.52 182 137 A 14 SER HA A 13 ASP HBx 1.0 0.0 4.60 183 137 A 13 ASP HBy A 14 SER HA 1.0 0.0 4.60 184 138 A 14 SER H A 13 ASP HBx 1.0 0.0 3.49 185 138 A 14 SER H A 13 ASP HBy 1.0 0.0 3.49 186 139 A 13 ASP HBy A 17 VAL HGy% 1.0 0.0 2.57 187 139 A 13 ASP HBx A 17 VAL HGy% 1.0 0.0 2.57 188 139 A 17 VAL HGx% A 13 ASP HBx 1.0 0.0 2.57 189 139 A 13 ASP HBy A 17 VAL HGx% 1.0 0.0 2.57 190 140 A 13 ASP H A 13 ASP HBx 1.0 0.0 3.87 191 141 A 13 ASP H A 13 ASP HBy 1.0 0.0 3.87 192 142 A 13 ASP H A 13 ASP HBx 1.0 0.0 3.21 193 142 A 13 ASP H A 13 ASP HBy 1.0 0.0 3.21 194 143 A 13 ASP H A 14 SER H 1.0 0.0 3.31 195 144 A 13 ASP H A 16 ARG H 1.0 0.0 5.10 196 145 A 14 SER HA A 17 VAL HB 1.0 0.0 4.75 197 146 A 14 SER HA A 17 VAL HGy% 1.0 0.0 3.35 198 146 A 14 SER HA A 17 VAL HGx% 1.0 0.0 3.35 199 147 A 14 SER HA A 18 TRP H 1.0 0.0 4.85 200 148 A 17 VAL HGx% A 14 SER HBx 1.0 0.0 5.53 201 149 A 14 SER HBx A 17 VAL HGy% 1.0 0.0 4.53 202 150 A 14 SER HBy A 17 VAL HGx% 1.0 0.0 5.53 203 151 A 14 SER HBy A 17 VAL HGy% 1.0 0.0 3.53 204 152 A 15 LEU H A 14 SER HBx 1.0 0.0 4.26 205 152 A 14 SER HBy A 15 LEU H 1.0 0.0 4.26 206 153 A 14 SER HBy A 17 VAL HGy% 1.0 0.0 3.07 207 153 A 14 SER HBx A 17 VAL HGy% 1.0 0.0 3.07 208 153 A 17 VAL HGx% A 14 SER HBx 1.0 0.0 3.07 209 153 A 14 SER HBy A 17 VAL HGx% 1.0 0.0 3.07 210 154 A 14 SER H A 14 SER HBx 1.0 0.0 3.16 211 154 A 14 SER H A 14 SER HBy 1.0 0.0 3.16 212 155 A 14 SER H A 15 LEU HDy% 1.0 0.0 5.44 213 155 A 15 LEU HDx% A 14 SER H 1.0 0.0 5.44 214 156 A 14 SER H A 15 LEU HG 1.0 0.0 6.50 215 157 A 14 SER H A 15 LEU H 1.0 0.0 3.45 216 158 A 14 SER H A 16 ARG H 1.0 0.0 4.81 217 159 A 15 LEU HDx% A 15 LEU HA 1.0 0.0 4.30 218 160 A 15 LEU HA A 15 LEU HDy% 1.0 0.0 4.30 219 161 A 15 LEU HA A 15 LEU HDy% 1.0 0.0 3.25 220 161 A 15 LEU HDx% A 15 LEU HA 1.0 0.0 3.25 221 162 A 15 LEU HG A 15 LEU HA 1.0 0.0 3.35 222 163 A 15 LEU HA A 18 TRP HBy 1.0 0.0 3.65 223 164 A 18 TRP H A 15 LEU HA 1.0 0.0 4.07 224 165 A 15 LEU HA A 19 LEU HDx% 1.0 0.0 4.48 225 166 A 15 LEU HDx% A 15 LEU HBy 1.0 0.0 3.52 226 167 A 15 LEU HBy A 15 LEU HDy% 1.0 0.0 3.52 227 168 A 17 VAL H A 15 LEU HBy 1.0 0.0 5.50 228 169 A 83 LEU HDx% A 15 LEU HBy 1.0 0.0 3.52 229 170 A 15 LEU HBy A 83 LEU HDy% 1.0 0.0 3.52 230 171 A 15 LEU HDx% A 15 LEU HBx 1.0 0.0 3.52 231 172 A 15 LEU HBx A 15 LEU HDy% 1.0 0.0 3.52 232 173 A 17 VAL H A 15 LEU HBx 1.0 0.0 5.50 233 174 A 15 LEU HBx A 83 LEU HDx% 1.0 0.0 3.52 234 175 A 15 LEU HBx A 83 LEU HDy% 1.0 0.0 4.52 235 176 A 15 LEU HBx A 15 LEU HDy% 1.0 0.0 1.56 236 176 A 15 LEU HBy A 15 LEU HDy% 1.0 0.0 1.56 237 176 A 15 LEU HDx% A 15 LEU HBy 1.0 0.0 1.56 238 176 A 15 LEU HDx% A 15 LEU HBx 1.0 0.0 1.56 239 177 A 17 VAL H A 15 LEU HBy 1.0 0.0 4.63 240 177 A 17 VAL H A 15 LEU HBx 1.0 0.0 4.63 241 178 A 18 TRP HD1 A 15 LEU HBy 1.0 0.0 5.22 242 178 A 15 LEU HBx A 18 TRP HD1 1.0 0.0 5.22 243 179 A 15 LEU HBy A 83 LEU HBy 1.0 0.0 2.57 244 179 A 15 LEU HBx A 83 LEU HBy 1.0 0.0 2.57 245 179 A 83 LEU HBx A 15 LEU HBy 1.0 0.0 2.57 246 179 A 15 LEU HBx A 83 LEU HBx 1.0 0.0 2.57 247 180 A 15 LEU HBy A 83 LEU HDy% 1.0 0.0 2.57 248 180 A 15 LEU HBx A 83 LEU HDy% 1.0 0.0 2.57 249 180 A 83 LEU HDx% A 15 LEU HBy 1.0 0.0 2.57 250 180 A 15 LEU HBx A 83 LEU HDx% 1.0 0.0 2.57 251 181 A 15 LEU HDx% A 18 TRP HD1 1.0 0.0 4.85 252 182 A 18 TRP HD1 A 15 LEU HDy% 1.0 0.0 4.85 253 183 A 16 ARG H A 15 LEU HDy% 1.0 0.0 4.90 254 183 A 15 LEU HDx% A 16 ARG H 1.0 0.0 4.90 255 184 A 18 TRP HBy A 15 LEU HDy% 1.0 0.0 5.44 256 184 A 15 LEU HDx% A 18 TRP HBy 1.0 0.0 5.44 257 185 A 18 TRP HBx A 15 LEU HDy% 1.0 0.0 5.44 258 185 A 15 LEU HDx% A 18 TRP HBx 1.0 0.0 5.44 259 186 A 18 TRP HD1 A 15 LEU HDy% 1.0 0.0 3.79 260 186 A 15 LEU HDx% A 18 TRP HD1 1.0 0.0 3.79 261 187 A 84 VAL HA A 15 LEU HDy% 1.0 0.0 3.43 262 187 A 15 LEU HDx% A 84 VAL HA 1.0 0.0 3.43 263 188 A 84 VAL HB A 15 LEU HDy% 1.0 0.0 2.82 264 188 A 15 LEU HDx% A 84 VAL HB 1.0 0.0 2.82 265 189 A 84 VAL H A 15 LEU HDy% 1.0 0.0 3.49 266 189 A 15 LEU HDx% A 84 VAL H 1.0 0.0 3.49 267 190 A 85 ALA H A 15 LEU HDy% 1.0 0.0 5.43 268 190 A 15 LEU HDx% A 85 ALA H 1.0 0.0 5.43 269 191 A 15 LEU H A 15 LEU HBy 1.0 0.0 3.67 270 191 A 15 LEU H A 15 LEU HBx 1.0 0.0 3.67 271 192 A 15 LEU HDx% A 15 LEU H 1.0 0.0 3.90 272 193 A 15 LEU H A 15 LEU HDy% 1.0 0.0 3.90 273 194 A 15 LEU H A 15 LEU HDy% 1.0 0.0 3.37 274 194 A 15 LEU HDx% A 15 LEU H 1.0 0.0 3.37 275 195 A 15 LEU H A 15 LEU HG 1.0 0.0 4.18 276 196 A 15 LEU H A 16 ARG H 1.0 0.0 2.98 277 197 A 15 LEU H A 17 VAL H 1.0 0.0 5.50 278 198 A 15 LEU H A 18 TRP H 1.0 0.0 5.37 279 199 A 16 ARG HA A 16 ARG HDy 1.0 0.0 5.37 280 200 A 16 ARG HDx A 16 ARG HA 1.0 0.0 5.37 281 201 A 16 ARG HA A 16 ARG HDy 1.0 0.0 4.62 282 201 A 16 ARG HDx A 16 ARG HA 1.0 0.0 4.62 283 202 A 16 ARG HA A 16 ARG HGy 1.0 0.0 3.88 284 203 A 16 ARG HGx A 16 ARG HA 1.0 0.0 3.88 285 204 A 16 ARG HA A 16 ARG HGy 1.0 0.0 3.38 286 204 A 16 ARG HGx A 16 ARG HA 1.0 0.0 3.38 287 205 A 16 ARG HA A 17 VAL HA 1.0 0.0 5.50 288 206 A 18 TRP HD1 A 16 ARG HA 1.0 0.0 5.50 289 207 A 18 TRP H A 16 ARG HA 1.0 0.0 5.50 290 208 A 16 ARG HA A 19 LEU HBx 1.0 0.0 5.08 291 209 A 19 LEU HDx% A 16 ARG HA 1.0 0.0 3.76 292 210 A 16 ARG HA A 19 LEU H 1.0 0.0 5.43 293 211 A 16 ARG HA A 20 VAL H 1.0 0.0 5.50 294 212 A 16 ARG HA A 76 ILE HG2% 1.0 0.0 3.63 295 213 A 16 ARG HBy A 76 ILE HG2% 1.0 0.0 4.83 296 214 A 76 ILE HG2% A 16 ARG HBx 1.0 0.0 4.83 297 215 A 16 ARG HBx A 16 ARG HDy 1.0 0.0 2.56 298 215 A 16 ARG HBy A 16 ARG HDy 1.0 0.0 2.56 299 215 A 16 ARG HDx A 16 ARG HBx 1.0 0.0 2.56 300 215 A 16 ARG HBy A 16 ARG HDx 1.0 0.0 2.56 301 216 A 17 VAL H A 16 ARG HBx 1.0 0.0 4.20 302 216 A 16 ARG HBy A 17 VAL H 1.0 0.0 4.20 303 217 A 76 ILE HG2% A 16 ARG HBx 1.0 0.0 4.01 304 217 A 16 ARG HBy A 76 ILE HG2% 1.0 0.0 4.01 305 218 A 17 VAL HGx% A 16 ARG HDy 1.0 0.0 3.53 306 219 A 16 ARG HDy A 17 VAL HGy% 1.0 0.0 4.53 307 220 A 17 VAL H A 16 ARG HDy 1.0 0.0 5.50 308 221 A 76 ILE HG2% A 16 ARG HDy 1.0 0.0 5.05 309 222 A 16 ARG HDx A 17 VAL HGx% 1.0 0.0 3.53 310 223 A 16 ARG HDx A 17 VAL HGy% 1.0 0.0 4.53 311 224 A 16 ARG HDx A 17 VAL H 1.0 0.0 5.50 312 225 A 16 ARG HDx A 76 ILE HG2% 1.0 0.0 5.05 313 226 A 16 ARG HDx A 17 VAL HGy% 1.0 0.0 2.57 314 226 A 16 ARG HDy A 17 VAL HGy% 1.0 0.0 2.57 315 226 A 17 VAL HGx% A 16 ARG HDy 1.0 0.0 2.57 316 226 A 16 ARG HDx A 17 VAL HGx% 1.0 0.0 2.57 317 227 A 36 THR HG2% A 16 ARG HDy 1.0 0.0 5.34 318 227 A 16 ARG HDx A 36 THR HG2% 1.0 0.0 5.34 319 228 A 76 ILE HG2% A 16 ARG HDy 1.0 0.0 4.21 320 228 A 16 ARG HDx A 76 ILE HG2% 1.0 0.0 4.21 321 229 A 36 THR HB A 16 ARG HGy 1.0 0.0 5.50 322 230 A 16 ARG HGx A 36 THR HB 1.0 0.0 5.50 323 231 A 17 VAL HA A 16 ARG HGy 1.0 0.0 5.34 324 231 A 16 ARG HGx A 17 VAL HA 1.0 0.0 5.34 325 232 A 36 THR HG2% A 16 ARG HGy 1.0 0.0 5.06 326 232 A 16 ARG HGx A 36 THR HG2% 1.0 0.0 5.06 327 233 A 16 ARG HGx A 76 ILE HG2% 1.0 0.0 4.03 328 233 A 76 ILE HG2% A 16 ARG HGy 1.0 0.0 4.03 329 234 A 76 ILE HG2% A 16 ARG HGy 1.0 0.0 3.63 330 234 A 16 ARG HGx A 76 ILE HG2% 1.0 0.0 3.63 331 235 A 16 ARG HBy A 16 ARG H 1.0 0.0 3.51 332 236 A 16 ARG H A 16 ARG HBx 1.0 0.0 3.51 333 237 A 16 ARG H A 16 ARG HBx 1.0 0.0 2.96 334 237 A 16 ARG HBy A 16 ARG H 1.0 0.0 2.96 335 238 A 16 ARG H A 16 ARG HDy 1.0 0.0 5.50 336 239 A 16 ARG HDx A 16 ARG H 1.0 0.0 5.50 337 240 A 16 ARG H A 16 ARG HGy 1.0 0.0 4.34 338 240 A 16 ARG HGx A 16 ARG H 1.0 0.0 4.34 339 241 A 16 ARG H A 17 VAL HGy% 1.0 0.0 4.56 340 241 A 16 ARG H A 17 VAL HGx% 1.0 0.0 4.56 341 242 A 16 ARG H A 17 VAL H 1.0 0.0 3.58 342 243 A 16 ARG H A 18 TRP H 1.0 0.0 5.13 343 244 A 16 ARG H A 19 LEU HBx 1.0 0.0 5.31 344 245 A 16 ARG H A 19 LEU HDx% 1.0 0.0 5.26 345 246 A 16 ARG H A 19 LEU H 1.0 0.0 5.50 346 247 A 16 ARG H A 76 ILE HG2% 1.0 0.0 5.10 347 248 A 17 VAL HGx% A 17 VAL HA 1.0 0.0 3.57 348 249 A 17 VAL HA A 17 VAL HGy% 1.0 0.0 3.57 349 250 A 17 VAL HA A 17 VAL HGy% 1.0 0.0 2.86 350 250 A 17 VAL HGx% A 17 VAL HA 1.0 0.0 2.86 351 251 A 17 VAL HA A 18 TRP HA 1.0 0.0 4.99 352 252 A 17 VAL HA A 20 VAL HGy% 1.0 0.0 3.18 353 252 A 17 VAL HA A 20 VAL HGx% 1.0 0.0 3.18 354 253 A 17 VAL HA A 20 VAL H 1.0 0.0 4.35 355 254 A 17 VAL HA A 21 ASP H 1.0 0.0 4.75 356 255 A 17 VAL HB A 18 TRP H 1.0 0.0 3.99 357 256 A 17 VAL HGx% A 18 TRP H 1.0 0.0 4.11 358 257 A 18 TRP H A 17 VAL HGy% 1.0 0.0 4.11 359 258 A 18 TRP HA A 17 VAL HGy% 1.0 0.0 4.62 360 258 A 17 VAL HGx% A 18 TRP HA 1.0 0.0 4.62 361 259 A 18 TRP HBy A 17 VAL HGy% 1.0 0.0 5.44 362 259 A 17 VAL HGx% A 18 TRP HBy 1.0 0.0 5.44 363 260 A 18 TRP HBx A 17 VAL HGy% 1.0 0.0 5.44 364 260 A 17 VAL HGx% A 18 TRP HBx 1.0 0.0 5.44 365 261 A 18 TRP H A 17 VAL HGy% 1.0 0.0 3.57 366 261 A 17 VAL HGx% A 18 TRP H 1.0 0.0 3.57 367 262 A 21 ASP HA A 17 VAL HGy% 1.0 0.0 5.95 368 262 A 17 VAL HGx% A 21 ASP HA 1.0 0.0 5.95 369 263 A 17 VAL HGx% A 21 ASP HBx 1.0 0.0 3.73 370 263 A 17 VAL HGy% A 21 ASP HBx 1.0 0.0 3.73 371 263 A 21 ASP HBy A 17 VAL HGy% 1.0 0.0 3.73 372 263 A 17 VAL HGx% A 21 ASP HBy 1.0 0.0 3.73 373 264 A 21 ASP H A 17 VAL HGy% 1.0 0.0 4.22 374 264 A 17 VAL HGx% A 21 ASP H 1.0 0.0 4.22 375 265 A 17 VAL HB A 17 VAL H 1.0 0.0 3.55 376 266 A 17 VAL HGx% A 17 VAL H 1.0 0.0 3.94 377 267 A 17 VAL H A 17 VAL HGy% 1.0 0.0 3.94 378 268 A 17 VAL H A 17 VAL HGy% 1.0 0.0 3.26 379 268 A 17 VAL HGx% A 17 VAL H 1.0 0.0 3.26 380 269 A 17 VAL H A 18 TRP HD1 1.0 0.0 5.50 381 270 A 18 TRP H A 17 VAL H 1.0 0.0 2.84 382 271 A 18 TRP HA A 18 TRP HE3 1.0 0.0 3.79 383 272 A 18 TRP HA A 21 ASP HBx 1.0 0.0 3.92 384 272 A 18 TRP HA A 21 ASP HBy 1.0 0.0 3.92 385 273 A 18 TRP HA A 21 ASP H 1.0 0.0 4.66 386 274 A 18 TRP HBy A 19 LEU H 1.0 0.0 3.70 387 275 A 18 TRP HBx A 18 TRP HE3 1.0 0.0 3.74 388 276 A 18 TRP HBx A 19 LEU H 1.0 0.0 4.78 389 277 A 18 TRP HD1 A 19 LEU HBx 1.0 0.0 4.69 390 278 A 19 LEU HDx% A 18 TRP HD1 1.0 0.0 4.58 391 279 A 18 TRP HD1 A 19 LEU HG 1.0 0.0 4.08 392 280 A 18 TRP HD1 A 19 LEU H 1.0 0.0 4.68 393 281 A 19 LEU HBx A 18 TRP HE1 1.0 0.0 4.63 394 282 A 19 LEU HDx% A 18 TRP HE1 1.0 0.0 5.50 395 283 A 19 LEU HG A 18 TRP HE1 1.0 0.0 5.50 396 284 A 18 TRP HE1 A 61 LEU HDy% 1.0 0.0 5.44 397 284 A 18 TRP HE1 A 61 LEU HDx% 1.0 0.0 5.44 398 285 A 18 TRP HE3 A 57 LEU HA 1.0 0.0 5.50 399 286 A 18 TRP HE3 A 60 HIS HBy 1.0 0.0 5.50 400 287 A 18 TRP HE3 A 60 HIS HBx 1.0 0.0 5.50 401 288 A 18 TRP HE3 A 60 HIS HBy 1.0 0.0 4.62 402 288 A 18 TRP HE3 A 60 HIS HBx 1.0 0.0 4.62 403 289 A 18 TRP HE3 A 61 LEU HDy% 1.0 0.0 5.42 404 289 A 18 TRP HE3 A 61 LEU HDx% 1.0 0.0 5.42 405 290 A 18 TRP HH2 A 19 LEU HA 1.0 0.0 5.02 406 291 A 19 LEU HDx% A 18 TRP HH2 1.0 0.0 5.50 407 292 A 19 LEU HG A 18 TRP HH2 1.0 0.0 5.50 408 293 A 18 TRP HH2 A 22 CYS HBy 1.0 0.0 5.00 409 293 A 18 TRP HH2 A 22 CYS HBx 1.0 0.0 5.00 410 294 A 57 LEU HA A 18 TRP HH2 1.0 0.0 4.27 411 295 A 18 TRP HH2 A 57 LEU HDx% 1.0 0.0 3.80 412 296 A 18 TRP HH2 A 57 LEU HDy% 1.0 0.0 3.80 413 297 A 18 TRP HH2 A 57 LEU HDy% 1.0 0.0 3.07 414 297 A 18 TRP HH2 A 57 LEU HDx% 1.0 0.0 3.07 415 298 A 18 TRP HH2 A 57 LEU HG 1.0 0.0 4.23 416 299 A 18 TRP HH2 A 61 LEU HDy% 1.0 0.0 4.60 417 299 A 61 LEU HDx% A 18 TRP HH2 1.0 0.0 4.60 418 300 A 18 TRP HH2 A 79 LEU HDx% 1.0 0.0 5.50 419 301 A 18 TRP H A 18 TRP HBy 1.0 0.0 3.05 420 302 A 18 TRP H A 18 TRP HBx 1.0 0.0 3.87 421 303 A 18 TRP H A 18 TRP HD1 1.0 0.0 5.50 422 304 A 18 TRP H A 19 LEU HDx% 1.0 0.0 5.16 423 305 A 18 TRP H A 19 LEU H 1.0 0.0 4.05 424 306 A 18 TRP H A 20 VAL H 1.0 0.0 5.50 425 307 A 18 TRP H A 21 ASP H 1.0 0.0 4.87 426 308 A 19 LEU HA A 18 TRP HZ2 1.0 0.0 4.59 427 309 A 19 LEU HDx% A 18 TRP HZ2 1.0 0.0 5.26 428 310 A 18 TRP HZ2 A 19 LEU HDy% 1.0 0.0 4.14 429 311 A 19 LEU HG A 18 TRP HZ2 1.0 0.0 3.62 430 312 A 57 LEU HA A 18 TRP HZ2 1.0 0.0 5.50 431 313 A 18 TRP HZ2 A 57 LEU HBy 1.0 0.0 4.00 432 314 A 18 TRP HZ2 A 57 LEU HDy% 1.0 0.0 5.44 433 314 A 57 LEU HDx% A 18 TRP HZ2 1.0 0.0 5.44 434 315 A 61 LEU HDx% A 18 TRP HZ2 1.0 0.0 4.48 435 316 A 18 TRP HZ2 A 61 LEU HDy% 1.0 0.0 4.48 436 317 A 18 TRP HZ2 A 61 LEU HDy% 1.0 0.0 3.64 437 317 A 61 LEU HDx% A 18 TRP HZ2 1.0 0.0 3.64 438 318 A 79 LEU HDx% A 18 TRP HZ2 1.0 0.0 4.18 439 319 A 18 TRP HZ3 A 22 CYS HBy 1.0 0.0 4.19 440 320 A 22 CYS HBx A 18 TRP HZ3 1.0 0.0 4.19 441 321 A 18 TRP HZ3 A 22 CYS HBy 1.0 0.0 3.65 442 321 A 22 CYS HBx A 18 TRP HZ3 1.0 0.0 3.65 443 322 A 57 LEU HA A 18 TRP HZ3 1.0 0.0 4.03 444 323 A 57 LEU HBy A 18 TRP HZ3 1.0 0.0 5.45 445 324 A 18 TRP HZ3 A 57 LEU HDy% 1.0 0.0 3.91 446 324 A 57 LEU HDx% A 18 TRP HZ3 1.0 0.0 3.91 447 325 A 18 TRP HZ3 A 60 HIS HBy 1.0 0.0 5.34 448 325 A 60 HIS HBx A 18 TRP HZ3 1.0 0.0 5.34 449 326 A 18 TRP HZ3 A 61 LEU HDy% 1.0 0.0 4.32 450 326 A 61 LEU HDx% A 18 TRP HZ3 1.0 0.0 4.32 451 327 A 19 LEU HDx% A 19 LEU HA 1.0 0.0 4.64 452 328 A 19 LEU HA A 19 LEU HDy% 1.0 0.0 3.37 453 329 A 19 LEU HA A 22 CYS HBy 1.0 0.0 4.08 454 330 A 19 LEU HA A 22 CYS HBx 1.0 0.0 4.08 455 331 A 19 LEU HA A 22 CYS HBy 1.0 0.0 3.49 456 331 A 19 LEU HA A 22 CYS HBx 1.0 0.0 3.49 457 332 A 19 LEU HA A 23 VAL H 1.0 0.0 5.02 458 333 A 19 LEU HA A 79 LEU HG 1.0 0.0 5.50 459 334 A 19 LEU HDy% A 19 LEU HBy 1.0 0.0 3.43 460 335 A 20 VAL H A 19 LEU HBy 1.0 0.0 3.60 461 336 A 19 LEU HBy A 22 CYS H 1.0 0.0 5.50 462 337 A 19 LEU HBy A 76 ILE HD1% 1.0 0.0 3.74 463 338 A 76 ILE HG2% A 19 LEU HBy 1.0 0.0 3.65 464 339 A 19 LEU HBx A 19 LEU HDy% 1.0 0.0 3.30 465 340 A 19 LEU HBx A 20 VAL H 1.0 0.0 4.28 466 341 A 19 LEU HDx% A 20 VAL H 1.0 0.0 4.44 467 342 A 19 LEU HDx% A 76 ILE HA 1.0 0.0 4.79 468 343 A 19 LEU HDx% A 79 LEU HBy 1.0 0.0 2.94 469 344 A 19 LEU HDx% A 79 LEU HG 1.0 0.0 2.90 470 345 A 19 LEU HDx% A 80 SER H 1.0 0.0 4.03 471 346 A 19 LEU HDy% A 76 ILE HA 1.0 0.0 3.58 472 347 A 19 LEU HDy% A 79 LEU HG 1.0 0.0 3.53 473 348 A 19 LEU H A 19 LEU HBy 1.0 0.0 3.56 474 349 A 19 LEU HDx% A 19 LEU H 1.0 0.0 5.17 475 350 A 19 LEU H A 19 LEU HDy% 1.0 0.0 5.50 476 351 A 19 LEU H A 19 LEU HG 1.0 0.0 3.92 477 352 A 19 LEU H A 20 VAL HGy% 1.0 0.0 4.18 478 352 A 19 LEU H A 20 VAL HGx% 1.0 0.0 4.18 479 353 A 19 LEU H A 20 VAL H 1.0 0.0 3.95 480 354 A 19 LEU H A 76 ILE HD1% 1.0 0.0 5.50 481 355 A 19 LEU H A 76 ILE HG2% 1.0 0.0 5.08 482 356 A 20 VAL HGx% A 20 VAL HA 1.0 0.0 3.63 483 357 A 20 VAL HA A 20 VAL HGy% 1.0 0.0 3.63 484 358 A 20 VAL HA A 20 VAL HGy% 1.0 0.0 3.09 485 358 A 20 VAL HGx% A 20 VAL HA 1.0 0.0 3.09 486 359 A 20 VAL HA A 24 ALA HB% 1.0 0.0 5.50 487 360 A 20 VAL HA A 24 ALA H 1.0 0.0 4.72 488 361 A 20 VAL HA A 31 ALA HB% 1.0 0.0 5.37 489 362 A 20 VAL HA A 34 ILE HG2% 1.0 0.0 4.34 490 363 A 20 VAL HA A 36 THR HA 1.0 0.0 5.50 491 364 A 36 THR HG2% A 20 VAL HA 1.0 0.0 5.50 492 365 A 20 VAL HA A 76 ILE HG1x 1.0 0.0 4.65 493 365 A 20 VAL HA A 76 ILE HG1y 1.0 0.0 4.65 494 366 A 21 ASP H A 20 VAL HB 1.0 0.0 3.96 495 367 A 34 ILE HG2% A 20 VAL HB 1.0 0.0 5.42 496 368 A 36 THR HA A 20 VAL HB 1.0 0.0 5.20 497 369 A 76 ILE HD1% A 20 VAL HB 1.0 0.0 4.11 498 370 A 76 ILE HG2% A 20 VAL HB 1.0 0.0 4.10 499 371 A 20 VAL HGx% A 21 ASP H 1.0 0.0 4.46 500 372 A 21 ASP H A 20 VAL HGy% 1.0 0.0 4.46 501 373 A 21 ASP HA A 20 VAL HGy% 1.0 0.0 3.99 502 373 A 20 VAL HGx% A 21 ASP HA 1.0 0.0 3.99 503 374 A 20 VAL HGx% A 21 ASP HBx 1.0 0.0 2.75 504 374 A 20 VAL HGy% A 21 ASP HBx 1.0 0.0 2.75 505 374 A 21 ASP HBy A 20 VAL HGy% 1.0 0.0 2.75 506 374 A 20 VAL HGx% A 21 ASP HBy 1.0 0.0 2.75 507 375 A 21 ASP H A 20 VAL HGy% 1.0 0.0 3.83 508 375 A 20 VAL HGx% A 21 ASP H 1.0 0.0 3.83 509 376 A 22 CYS H A 20 VAL HGy% 1.0 0.0 4.96 510 376 A 20 VAL HGx% A 22 CYS H 1.0 0.0 4.96 511 377 A 24 ALA HB% A 20 VAL HGy% 1.0 0.0 3.77 512 377 A 20 VAL HGx% A 24 ALA HB% 1.0 0.0 3.77 513 378 A 24 ALA H A 20 VAL HGy% 1.0 0.0 4.21 514 378 A 20 VAL HGx% A 24 ALA H 1.0 0.0 4.21 515 379 A 31 ALA HA A 20 VAL HGy% 1.0 0.0 3.40 516 379 A 20 VAL HGx% A 31 ALA HA 1.0 0.0 3.40 517 380 A 31 ALA HB% A 20 VAL HGy% 1.0 0.0 2.47 518 380 A 20 VAL HGx% A 31 ALA HB% 1.0 0.0 2.47 519 381 A 31 ALA H A 20 VAL HGy% 1.0 0.0 4.85 520 381 A 20 VAL HGx% A 31 ALA H 1.0 0.0 4.85 521 382 A 32 ALA HA A 20 VAL HGy% 1.0 0.0 4.75 522 382 A 20 VAL HGx% A 32 ALA HA 1.0 0.0 4.75 523 383 A 32 ALA H A 20 VAL HGy% 1.0 0.0 4.92 524 383 A 20 VAL HGx% A 32 ALA H 1.0 0.0 4.92 525 384 A 34 ILE HB A 20 VAL HGy% 1.0 0.0 3.05 526 384 A 20 VAL HGx% A 34 ILE HB 1.0 0.0 3.05 527 385 A 34 ILE HG2% A 20 VAL HGy% 1.0 0.0 3.32 528 385 A 20 VAL HGx% A 34 ILE HG2% 1.0 0.0 3.32 529 386 A 34 ILE H A 20 VAL HGy% 1.0 0.0 4.51 530 386 A 20 VAL HGx% A 34 ILE H 1.0 0.0 4.51 531 387 A 35 ALA H A 20 VAL HGy% 1.0 0.0 5.44 532 387 A 20 VAL HGx% A 35 ALA H 1.0 0.0 5.44 533 388 A 36 THR H A 20 VAL HGy% 1.0 0.0 5.44 534 388 A 20 VAL HGx% A 36 THR H 1.0 0.0 5.44 535 389 A 20 VAL H A 20 VAL HB 1.0 0.0 3.66 536 390 A 20 VAL H A 20 VAL HGx% 1.0 0.0 4.36 537 391 A 20 VAL H A 20 VAL HGy% 1.0 0.0 4.36 538 392 A 20 VAL H A 20 VAL HGy% 1.0 0.0 3.15 539 392 A 20 VAL H A 20 VAL HGx% 1.0 0.0 3.15 540 393 A 20 VAL H A 21 ASP HA 1.0 0.0 5.50 541 394 A 20 VAL H A 21 ASP HBx 1.0 0.0 5.34 542 394 A 20 VAL H A 21 ASP HBy 1.0 0.0 5.34 543 395 A 20 VAL H A 21 ASP H 1.0 0.0 3.83 544 396 A 20 VAL H A 22 CYS HBy 1.0 0.0 5.34 545 396 A 20 VAL H A 22 CYS HBx 1.0 0.0 5.34 546 397 A 20 VAL H A 22 CYS H 1.0 0.0 4.55 547 398 A 20 VAL H A 23 VAL H 1.0 0.0 5.50 548 399 A 20 VAL H A 76 ILE HD1% 1.0 0.0 4.64 549 400 A 20 VAL H A 76 ILE HG2% 1.0 0.0 3.88 550 401 A 21 ASP HA A 24 ALA HA 1.0 0.0 5.36 551 402 A 21 ASP HA A 24 ALA HB% 1.0 0.0 3.32 552 403 A 21 ASP HA A 24 ALA H 1.0 0.0 4.62 553 404 A 21 ASP HA A 31 ALA HA 1.0 0.0 5.50 554 405 A 21 ASP HA A 31 ALA HB% 1.0 0.0 3.98 555 406 A 21 ASP HA A 34 ILE HG2% 1.0 0.0 5.50 556 407 A 22 CYS H A 21 ASP HBx 1.0 0.0 4.17 557 408 A 24 ALA HB% A 21 ASP HBx 1.0 0.0 5.50 558 409 A 31 ALA HB% A 21 ASP HBx 1.0 0.0 5.50 559 410 A 21 ASP HBy A 22 CYS H 1.0 0.0 4.17 560 411 A 21 ASP HBy A 24 ALA HB% 1.0 0.0 5.50 561 412 A 21 ASP HBy A 31 ALA HB% 1.0 0.0 5.50 562 413 A 22 CYS H A 21 ASP HBx 1.0 0.0 3.35 563 413 A 21 ASP HBy A 22 CYS H 1.0 0.0 3.35 564 414 A 21 ASP H A 21 ASP HBx 1.0 0.0 3.93 565 415 A 21 ASP H A 21 ASP HBy 1.0 0.0 3.93 566 416 A 21 ASP H A 21 ASP HBx 1.0 0.0 3.33 567 416 A 21 ASP H A 21 ASP HBy 1.0 0.0 3.33 568 417 A 21 ASP H A 22 CYS H 1.0 0.0 3.74 569 418 A 21 ASP H A 24 ALA HB% 1.0 0.0 5.50 570 419 A 23 VAL H A 22 CYS HBy 1.0 0.0 4.25 571 420 A 22 CYS HBx A 23 VAL H 1.0 0.0 4.25 572 421 A 23 VAL H A 22 CYS HBy 1.0 0.0 3.58 573 421 A 22 CYS HBx A 23 VAL H 1.0 0.0 3.58 574 422 A 22 CYS H A 22 CYS HBy 1.0 0.0 3.23 575 423 A 22 CYS HBx A 22 CYS H 1.0 0.0 3.23 576 424 A 22 CYS H A 23 VAL HB 1.0 0.0 5.50 577 425 A 22 CYS H A 23 VAL HGy% 1.0 0.0 5.31 578 426 A 23 VAL H A 22 CYS H 1.0 0.0 3.65 579 427 A 22 CYS H A 24 ALA HB% 1.0 0.0 5.01 580 428 A 23 VAL HA A 23 VAL HGx% 1.0 0.0 3.30 581 429 A 23 VAL HGy% A 23 VAL HA 1.0 0.0 3.51 582 430 A 24 ALA HB% A 23 VAL HA 1.0 0.0 5.39 583 431 A 23 VAL HA A 26 HIS HBx 1.0 0.0 4.31 584 431 A 23 VAL HA A 26 HIS HBy 1.0 0.0 4.31 585 432 A 23 VAL HA A 26 HIS HD2 1.0 0.0 3.46 586 433 A 23 VAL HA A 26 HIS H 1.0 0.0 4.77 587 434 A 23 VAL HA A 27 LEU HBx 1.0 0.0 5.50 588 435 A 23 VAL HA A 27 LEU HG 1.0 0.0 5.50 589 436 A 23 VAL HA A 27 LEU H 1.0 0.0 5.50 590 437 A 23 VAL HA A 34 ILE HD1% 1.0 0.0 4.95 591 438 A 24 ALA HA A 23 VAL HB 1.0 0.0 4.45 592 439 A 24 ALA H A 23 VAL HB 1.0 0.0 3.88 593 440 A 23 VAL HB A 27 LEU HDx% 1.0 0.0 5.50 594 441 A 23 VAL HB A 34 ILE HD1% 1.0 0.0 4.55 595 442 A 34 ILE HG2% A 23 VAL HB 1.0 0.0 4.77 596 443 A 24 ALA HA A 23 VAL HGx% 1.0 0.0 3.91 597 444 A 24 ALA H A 23 VAL HGx% 1.0 0.0 4.30 598 445 A 23 VAL HGx% A 26 HIS HD2 1.0 0.0 4.54 599 446 A 23 VAL HGx% A 27 LEU HBx 1.0 0.0 3.89 600 447 A 23 VAL HGx% A 27 LEU H 1.0 0.0 4.52 601 448 A 34 ILE HB A 23 VAL HGx% 1.0 0.0 4.80 602 449 A 23 VAL HGx% A 34 ILE HD1% 1.0 0.0 3.31 603 450 A 34 ILE HG2% A 23 VAL HGx% 1.0 0.0 2.73 604 451 A 23 VAL HGx% A 43 TYR HBx 1.0 0.0 5.50 605 452 A 23 VAL HGx% A 43 TYR HD% 1.0 0.0 5.14 606 453 A 23 VAL HGx% A 43 TYR HEx 1.0 0.0 3.21 607 453 A 23 VAL HGx% A 43 TYR HEy 1.0 0.0 3.21 608 454 A 23 VAL HGy% A 35 ALA HB% 1.0 0.0 4.75 609 455 A 24 ALA H A 23 VAL HGy% 1.0 0.0 4.41 610 456 A 23 VAL HGy% A 26 HIS HD2 1.0 0.0 4.40 611 457 A 34 ILE HG2% A 23 VAL HGy% 1.0 0.0 3.57 612 458 A 23 VAL HGy% A 43 TYR HD% 1.0 0.0 4.96 613 459 A 23 VAL HGy% A 43 TYR HEx 1.0 0.0 3.30 614 459 A 23 VAL HGy% A 43 TYR HEy 1.0 0.0 3.30 615 460 A 23 VAL H A 23 VAL HB 1.0 0.0 3.43 616 461 A 23 VAL H A 23 VAL HGx% 1.0 0.0 3.98 617 462 A 23 VAL H A 23 VAL HGy% 1.0 0.0 3.57 618 463 A 23 VAL H A 24 ALA HB% 1.0 0.0 5.45 619 464 A 23 VAL H A 76 ILE HD1% 1.0 0.0 5.50 620 465 A 24 ALA HA A 27 LEU HBx 1.0 0.0 4.24 621 466 A 24 ALA HA A 27 LEU H 1.0 0.0 5.50 622 467 A 24 ALA HA A 29 LEU HBy 1.0 0.0 5.50 623 468 A 24 ALA HA A 29 LEU HBx 1.0 0.0 4.55 624 469 A 24 ALA HA A 29 LEU H 1.0 0.0 3.73 625 470 A 24 ALA HA A 30 ASP HA 1.0 0.0 5.50 626 471 A 24 ALA HA A 30 ASP H 1.0 0.0 5.50 627 472 A 31 ALA H A 24 ALA HA 1.0 0.0 4.89 628 473 A 24 ALA HA A 34 ILE HD1% 1.0 0.0 3.69 629 474 A 24 ALA HA A 34 ILE HG1y 1.0 0.0 4.54 630 475 A 24 ALA HB% A 25 GLY HAy 1.0 0.0 4.92 631 476 A 24 ALA HB% A 25 GLY HAx 1.0 0.0 4.92 632 477 A 24 ALA HB% A 25 GLY HAy 1.0 0.0 4.16 633 477 A 24 ALA HB% A 25 GLY HAx 1.0 0.0 4.16 634 478 A 24 ALA HB% A 25 GLY H 1.0 0.0 3.71 635 479 A 24 ALA HB% A 30 ASP HA 1.0 0.0 4.51 636 480 A 24 ALA HB% A 30 ASP H 1.0 0.0 5.50 637 481 A 24 ALA HB% A 31 ALA HA 1.0 0.0 3.18 638 482 A 24 ALA HB% A 31 ALA H 1.0 0.0 4.41 639 483 A 24 ALA HB% A 34 ILE HD1% 1.0 0.0 3.63 640 484 A 24 ALA HB% A 34 ILE H 1.0 0.0 5.50 641 485 A 24 ALA HB% A 24 ALA H 1.0 0.0 3.34 642 486 A 24 ALA H A 25 GLY HAy 1.0 0.0 5.50 643 487 A 24 ALA H A 25 GLY HAx 1.0 0.0 5.50 644 488 A 24 ALA H A 25 GLY H 1.0 0.0 4.00 645 489 A 24 ALA H A 31 ALA HA 1.0 0.0 4.79 646 490 A 24 ALA H A 31 ALA HB% 1.0 0.0 5.24 647 491 A 24 ALA H A 34 ILE HD1% 1.0 0.0 4.97 648 492 A 24 ALA H A 34 ILE HG1y 1.0 0.0 5.50 649 493 A 26 HIS HA A 25 GLY HAy 1.0 0.0 4.44 650 493 A 25 GLY HAx A 26 HIS HA 1.0 0.0 4.44 651 494 A 26 HIS H A 25 GLY H 1.0 0.0 2.80 652 495 A 26 HIS HA A 26 HIS HE1 1.0 0.0 5.50 653 496 A 27 LEU HBx A 26 HIS HBx 1.0 0.0 5.50 654 497 A 27 LEU H A 26 HIS HBx 1.0 0.0 4.55 655 498 A 26 HIS HBy A 27 LEU HBx 1.0 0.0 5.50 656 499 A 26 HIS HBy A 27 LEU H 1.0 0.0 4.55 657 500 A 27 LEU HDx% A 26 HIS HBx 1.0 0.0 5.34 658 500 A 26 HIS HBy A 27 LEU HDx% 1.0 0.0 5.34 659 501 A 27 LEU HDy% A 26 HIS HBx 1.0 0.0 5.13 660 501 A 26 HIS HBy A 27 LEU HDy% 1.0 0.0 5.13 661 502 A 27 LEU HG A 26 HIS HBx 1.0 0.0 5.33 662 502 A 26 HIS HBy A 27 LEU HG 1.0 0.0 5.33 663 503 A 27 LEU H A 26 HIS HBx 1.0 0.0 3.97 664 503 A 26 HIS HBy A 27 LEU H 1.0 0.0 3.97 665 504 A 53 ILE HD1% A 26 HIS HBx 1.0 0.0 5.34 666 504 A 26 HIS HBy A 53 ILE HD1% 1.0 0.0 5.34 667 505 A 26 HIS HD2 A 53 ILE HD1% 1.0 0.0 4.88 668 506 A 26 HIS HD2 A 53 ILE HG2% 1.0 0.0 5.22 669 507 A 26 HIS HE1 A 53 ILE HD1% 1.0 0.0 5.50 670 508 A 26 HIS H A 26 HIS HBx 1.0 0.0 3.82 671 509 A 26 HIS HBy A 26 HIS H 1.0 0.0 3.82 672 510 A 26 HIS H A 26 HIS HBx 1.0 0.0 3.27 673 510 A 26 HIS HBy A 26 HIS H 1.0 0.0 3.27 674 511 A 26 HIS H A 27 LEU HA 1.0 0.0 5.50 675 512 A 26 HIS H A 27 LEU HBx 1.0 0.0 5.50 676 513 A 26 HIS H A 27 LEU HG 1.0 0.0 5.50 677 514 A 26 HIS H A 27 LEU H 1.0 0.0 3.14 678 515 A 27 LEU HDx% A 27 LEU HA 1.0 0.0 4.97 679 516 A 27 LEU HDy% A 27 LEU HA 1.0 0.0 3.50 680 517 A 27 LEU HG A 27 LEU HA 1.0 0.0 3.04 681 518 A 27 LEU HBx A 27 LEU HDx% 1.0 0.0 3.65 682 519 A 27 LEU HBx A 27 LEU HDy% 1.0 0.0 3.45 683 520 A 27 LEU HBx A 28 GLY H 1.0 0.0 4.28 684 521 A 27 LEU HDx% A 40 LEU HA 1.0 0.0 5.50 685 522 A 27 LEU HDx% A 43 TYR HA 1.0 0.0 4.77 686 523 A 27 LEU HDx% A 43 TYR HBy 1.0 0.0 4.47 687 524 A 27 LEU HDx% A 43 TYR HBx 1.0 0.0 4.82 688 525 A 27 LEU HDx% A 43 TYR HD% 1.0 0.0 4.57 689 526 A 27 LEU HDx% A 43 TYR HEx 1.0 0.0 4.83 690 526 A 27 LEU HDx% A 43 TYR HEy 1.0 0.0 4.83 691 527 A 27 LEU HDx% A 45 LEU H 1.0 0.0 5.50 692 528 A 34 ILE HD1% A 27 LEU HDy% 1.0 0.0 4.62 693 529 A 27 LEU HDy% A 43 TYR HBy 1.0 0.0 5.48 694 530 A 43 TYR HBx A 27 LEU HDy% 1.0 0.0 5.50 695 531 A 27 LEU HDy% A 43 TYR HEx 1.0 0.0 5.50 696 531 A 27 LEU HDy% A 43 TYR HEy 1.0 0.0 5.50 697 532 A 27 LEU HDy% A 45 LEU H 1.0 0.0 5.50 698 533 A 27 LEU HBx A 27 LEU H 1.0 0.0 3.09 699 534 A 27 LEU H A 27 LEU HDx% 1.0 0.0 5.32 700 535 A 27 LEU H A 27 LEU HDy% 1.0 0.0 4.93 701 536 A 27 LEU HG A 27 LEU H 1.0 0.0 4.52 702 537 A 27 LEU H A 28 GLY H 1.0 0.0 2.95 703 538 A 29 LEU HDy% A 28 GLY HAy 1.0 0.0 5.50 704 539 A 29 LEU HG A 28 GLY HAy 1.0 0.0 5.23 705 540 A 29 LEU HDy% A 28 GLY HAx 1.0 0.0 5.50 706 541 A 29 LEU HG A 28 GLY HAx 1.0 0.0 5.23 707 542 A 29 LEU HG A 28 GLY HAy 1.0 0.0 4.51 708 542 A 29 LEU HG A 28 GLY HAx 1.0 0.0 4.51 709 543 A 29 LEU H A 28 GLY H 1.0 0.0 3.40 710 544 A 29 LEU HA A 29 LEU HDx% 1.0 0.0 5.50 711 545 A 29 LEU HDy% A 29 LEU HA 1.0 0.0 3.34 712 546 A 30 ASP H A 29 LEU HA 1.0 0.0 3.12 713 547 A 29 LEU HBy A 29 LEU HDy% 1.0 0.0 3.67 714 548 A 29 LEU HBy A 30 ASP H 1.0 0.0 3.30 715 549 A 29 LEU HBy A 34 ILE HA 1.0 0.0 5.50 716 550 A 34 ILE HD1% A 29 LEU HBy 1.0 0.0 5.20 717 551 A 29 LEU HBx A 29 LEU HDy% 1.0 0.0 3.71 718 552 A 29 LEU HBx A 30 ASP H 1.0 0.0 3.69 719 553 A 29 LEU HBx A 34 ILE HA 1.0 0.0 4.95 720 554 A 34 ILE HD1% A 29 LEU HBx 1.0 0.0 3.38 721 555 A 34 ILE HD1% A 29 LEU HDx% 1.0 0.0 3.69 722 556 A 30 ASP H A 29 LEU HDy% 1.0 0.0 4.26 723 557 A 34 ILE HD1% A 29 LEU HG 1.0 0.0 3.76 724 558 A 29 LEU HBx A 29 LEU H 1.0 0.0 3.53 725 559 A 29 LEU H A 29 LEU HDx% 1.0 0.0 4.86 726 560 A 29 LEU H A 29 LEU HDy% 1.0 0.0 3.86 727 561 A 29 LEU H A 29 LEU HG 1.0 0.0 2.91 728 562 A 29 LEU H A 30 ASP H 1.0 0.0 4.91 729 563 A 34 ILE HD1% A 29 LEU H 1.0 0.0 5.41 730 564 A 31 ALA HB% A 30 ASP HA 1.0 0.0 4.83 731 565 A 31 ALA H A 30 ASP HA 1.0 0.0 3.05 732 566 A 32 ALA H A 30 ASP HA 1.0 0.0 4.24 733 567 A 32 ALA HB% A 30 ASP HBy 1.0 0.0 5.50 734 568 A 32 ALA H A 30 ASP HBy 1.0 0.0 4.46 735 569 A 33 THR H A 30 ASP HBy 1.0 0.0 5.50 736 570 A 32 ALA HB% A 30 ASP HBx 1.0 0.0 5.50 737 571 A 32 ALA H A 30 ASP HBx 1.0 0.0 4.46 738 572 A 33 THR H A 30 ASP HBx 1.0 0.0 5.50 739 573 A 31 ALA H A 30 ASP HBy 1.0 0.0 4.30 740 573 A 31 ALA H A 30 ASP HBx 1.0 0.0 4.30 741 574 A 33 THR HG1 A 30 ASP HBy 1.0 0.0 4.69 742 574 A 30 ASP HBx A 33 THR HG1 1.0 0.0 4.69 743 575 A 33 THR HG2% A 30 ASP HBy 1.0 0.0 4.55 744 575 A 30 ASP HBx A 33 THR HG2% 1.0 0.0 4.55 745 576 A 30 ASP H A 30 ASP HBy 1.0 0.0 2.96 746 576 A 30 ASP H A 30 ASP HBx 1.0 0.0 2.96 747 577 A 31 ALA H A 30 ASP H 1.0 0.0 5.50 748 578 A 30 ASP H A 33 THR H 1.0 0.0 5.39 749 579 A 31 ALA HA A 32 ALA HA 1.0 0.0 5.01 750 580 A 31 ALA HA A 33 THR H 1.0 0.0 4.02 751 581 A 31 ALA HA A 34 ILE HB 1.0 0.0 4.47 752 582 A 31 ALA HA A 34 ILE HD1% 1.0 0.0 3.89 753 583 A 31 ALA HA A 34 ILE HG1y 1.0 0.0 4.99 754 584 A 31 ALA HA A 34 ILE HG1x 1.0 0.0 4.45 755 585 A 31 ALA HA A 34 ILE H 1.0 0.0 4.39 756 586 A 36 THR HG2% A 31 ALA HA 1.0 0.0 4.89 757 587 A 31 ALA HB% A 34 ILE HB 1.0 0.0 4.27 758 588 A 31 ALA HB% A 34 ILE HG2% 1.0 0.0 4.29 759 589 A 31 ALA HB% A 31 ALA H 1.0 0.0 3.17 760 590 A 31 ALA H A 32 ALA HB% 1.0 0.0 5.00 761 591 A 31 ALA H A 32 ALA H 1.0 0.0 3.82 762 592 A 32 ALA HA A 34 ILE H 1.0 0.0 5.50 763 593 A 32 ALA HB% A 33 THR H 1.0 0.0 3.48 764 594 A 34 ILE H A 32 ALA HB% 1.0 0.0 5.50 765 595 A 32 ALA H A 32 ALA HB% 1.0 0.0 2.96 766 596 A 32 ALA H A 33 THR HG2% 1.0 0.0 5.14 767 597 A 32 ALA H A 33 THR H 1.0 0.0 3.48 768 598 A 32 ALA H A 34 ILE H 1.0 0.0 5.50 769 599 A 33 THR HG2% A 33 THR HA 1.0 0.0 3.57 770 600 A 34 ILE HA A 33 THR HA 1.0 0.0 4.81 771 601 A 34 ILE HG1x A 33 THR HA 1.0 0.0 5.50 772 602 A 34 ILE HD1% A 33 THR HB 1.0 0.0 5.50 773 603 A 34 ILE H A 33 THR HB 1.0 0.0 5.23 774 604 A 33 THR H A 33 THR HB 1.0 0.0 4.00 775 605 A 33 THR H A 33 THR HG1 1.0 0.0 4.12 776 606 A 33 THR H A 33 THR HG2% 1.0 0.0 3.69 777 607 A 34 ILE HA A 33 THR H 1.0 0.0 5.50 778 608 A 34 ILE H A 33 THR H 1.0 0.0 3.43 779 609 A 34 ILE HD1% A 34 ILE HA 1.0 0.0 4.17 780 610 A 34 ILE HG2% A 34 ILE HA 1.0 0.0 3.61 781 611 A 34 ILE HA A 43 TYR HEx 1.0 0.0 4.14 782 611 A 34 ILE HA A 43 TYR HEy 1.0 0.0 4.14 783 612 A 34 ILE HB A 34 ILE HD1% 1.0 0.0 4.00 784 613 A 34 ILE HB A 35 ALA H 1.0 0.0 5.50 785 614 A 36 THR HG2% A 34 ILE HB 1.0 0.0 3.91 786 615 A 76 ILE HD1% A 34 ILE HB 1.0 0.0 5.28 787 616 A 35 ALA H A 34 ILE HD1% 1.0 0.0 5.46 788 617 A 34 ILE HD1% A 43 TYR HD% 1.0 0.0 5.07 789 618 A 34 ILE HD1% A 43 TYR HEx 1.0 0.0 4.74 790 618 A 34 ILE HD1% A 43 TYR HEy 1.0 0.0 4.74 791 619 A 35 ALA H A 34 ILE HG1x 1.0 0.0 5.50 792 620 A 34 ILE HG2% A 34 ILE HG1y 1.0 0.0 3.95 793 621 A 34 ILE HG2% A 34 ILE HG1x 1.0 0.0 3.98 794 622 A 34 ILE HG2% A 35 ALA HA 1.0 0.0 4.81 795 623 A 34 ILE HG2% A 35 ALA HB% 1.0 0.0 5.39 796 624 A 34 ILE HG2% A 35 ALA H 1.0 0.0 4.00 797 625 A 34 ILE HG2% A 36 THR HA 1.0 0.0 5.50 798 626 A 36 THR HG2% A 34 ILE HG2% 1.0 0.0 4.53 799 627 A 34 ILE HG2% A 42 SER HBx 1.0 0.0 5.34 800 627 A 34 ILE HG2% A 42 SER HBy 1.0 0.0 5.34 801 628 A 34 ILE HG2% A 43 TYR HEx 1.0 0.0 3.34 802 628 A 34 ILE HG2% A 43 TYR HEy 1.0 0.0 3.34 803 629 A 76 ILE HD1% A 34 ILE HG2% 1.0 0.0 3.79 804 630 A 34 ILE HB A 34 ILE H 1.0 0.0 3.43 805 631 A 34 ILE H A 34 ILE HD1% 1.0 0.0 4.71 806 632 A 34 ILE H A 34 ILE HG1y 1.0 0.0 4.33 807 633 A 34 ILE H A 34 ILE HG1x 1.0 0.0 4.07 808 634 A 34 ILE HG2% A 34 ILE H 1.0 0.0 4.14 809 635 A 34 ILE H A 35 ALA H 1.0 0.0 5.50 810 636 A 36 THR HG2% A 35 ALA HA 1.0 0.0 4.81 811 637 A 36 THR H A 35 ALA HA 1.0 0.0 3.09 812 638 A 35 ALA HA A 38 LEU HDy% 1.0 0.0 4.76 813 638 A 35 ALA HA A 38 LEU HDx% 1.0 0.0 4.76 814 639 A 35 ALA HA A 38 LEU H 1.0 0.0 4.01 815 640 A 35 ALA HB% A 43 TYR HEx 1.0 0.0 4.29 816 641 A 36 THR HG2% A 35 ALA HB% 1.0 0.0 5.42 817 642 A 36 THR H A 35 ALA HB% 1.0 0.0 3.80 818 643 A 35 ALA HB% A 43 TYR HEx 1.0 0.0 3.33 819 643 A 35 ALA HB% A 43 TYR HEy 1.0 0.0 3.33 820 644 A 35 ALA H A 35 ALA HB% 1.0 0.0 3.40 821 645 A 35 ALA H A 36 THR H 1.0 0.0 5.50 822 646 A 35 ALA H A 38 LEU H 1.0 0.0 5.50 823 647 A 35 ALA H A 43 TYR HEx 1.0 0.0 5.50 824 647 A 35 ALA H A 43 TYR HEy 1.0 0.0 5.50 825 648 A 36 THR HB A 36 THR HA 1.0 0.0 2.91 826 649 A 36 THR HG2% A 36 THR HA 1.0 0.0 3.28 827 650 A 36 THR HA A 76 ILE HB 1.0 0.0 3.64 828 651 A 76 ILE HD1% A 36 THR HA 1.0 0.0 4.05 829 652 A 36 THR HA A 76 ILE HG1x 1.0 0.0 3.87 830 652 A 36 THR HA A 76 ILE HG1y 1.0 0.0 3.87 831 653 A 76 ILE HG2% A 36 THR HA 1.0 0.0 3.41 832 654 A 36 THR HA A 76 ILE H 1.0 0.0 4.65 833 655 A 36 THR HA A 77 ASP H 1.0 0.0 5.23 834 656 A 36 THR HB A 76 ILE HB 1.0 0.0 4.53 835 657 A 76 ILE HG2% A 36 THR HB 1.0 0.0 4.59 836 658 A 36 THR HG1 A 37 ASP H 1.0 0.0 5.50 837 659 A 36 THR HG2% A 37 ASP H 1.0 0.0 4.75 838 660 A 36 THR HG2% A 76 ILE HD1% 1.0 0.0 4.80 839 661 A 36 THR HG2% A 36 THR H 1.0 0.0 3.46 840 662 A 36 THR H A 37 ASP H 1.0 0.0 3.52 841 663 A 36 THR H A 38 LEU H 1.0 0.0 5.50 842 664 A 37 ASP HA A 75 THR HG2% 1.0 0.0 3.97 843 665 A 37 ASP HA A 77 ASP HBx 1.0 0.0 5.50 844 666 A 77 ASP H A 37 ASP HA 1.0 0.0 5.04 845 667 A 75 THR HG2% A 37 ASP HBx 1.0 0.0 5.34 846 667 A 75 THR HG2% A 37 ASP HBy 1.0 0.0 5.34 847 668 A 37 ASP H A 37 ASP HBx 1.0 0.0 3.59 848 668 A 37 ASP H A 37 ASP HBy 1.0 0.0 3.59 849 669 A 37 ASP H A 38 LEU HBx 1.0 0.0 4.00 850 669 A 37 ASP H A 38 LEU HBy 1.0 0.0 4.00 851 670 A 37 ASP H A 38 LEU HDy% 1.0 0.0 5.44 852 670 A 38 LEU HDx% A 37 ASP H 1.0 0.0 5.44 853 671 A 37 ASP H A 38 LEU HG 1.0 0.0 5.50 854 672 A 38 LEU H A 37 ASP H 1.0 0.0 3.42 855 673 A 38 LEU HDx% A 38 LEU HA 1.0 0.0 4.17 856 674 A 38 LEU HA A 38 LEU HDy% 1.0 0.0 4.17 857 675 A 38 LEU HA A 38 LEU HDy% 1.0 0.0 3.23 858 675 A 38 LEU HDx% A 38 LEU HA 1.0 0.0 3.23 859 676 A 38 LEU HA A 39 PRO HDy 1.0 0.0 3.58 860 677 A 38 LEU HA A 39 PRO HDx 1.0 0.0 3.58 861 678 A 38 LEU HA A 39 PRO HDy 1.0 0.0 2.92 862 678 A 38 LEU HA A 39 PRO HDx 1.0 0.0 2.92 863 679 A 38 LEU HDx% A 38 LEU HBx 1.0 0.0 2.90 864 680 A 38 LEU HBx A 38 LEU HDy% 1.0 0.0 2.90 865 681 A 38 LEU HDx% A 38 LEU HBy 1.0 0.0 2.90 866 682 A 38 LEU HBy A 38 LEU HDy% 1.0 0.0 2.90 867 683 A 38 LEU HBy A 38 LEU HDy% 1.0 0.0 1.56 868 683 A 38 LEU HBx A 38 LEU HDy% 1.0 0.0 1.56 869 683 A 38 LEU HDx% A 38 LEU HBx 1.0 0.0 1.56 870 683 A 38 LEU HDx% A 38 LEU HBy 1.0 0.0 1.56 871 684 A 38 LEU HBy A 39 PRO HBy 1.0 0.0 4.57 872 684 A 38 LEU HBx A 39 PRO HBy 1.0 0.0 4.57 873 684 A 39 PRO HBx A 38 LEU HBx 1.0 0.0 4.57 874 684 A 38 LEU HBy A 39 PRO HBx 1.0 0.0 4.57 875 685 A 38 LEU HBy A 39 PRO HDy 1.0 0.0 2.57 876 685 A 38 LEU HBx A 39 PRO HDy 1.0 0.0 2.57 877 685 A 39 PRO HDx A 38 LEU HBx 1.0 0.0 2.57 878 685 A 38 LEU HBy A 39 PRO HDx 1.0 0.0 2.57 879 686 A 38 LEU HBx A 42 SER HBx 1.0 0.0 2.57 880 686 A 38 LEU HBy A 42 SER HBx 1.0 0.0 2.57 881 686 A 42 SER HBy A 38 LEU HBx 1.0 0.0 2.57 882 686 A 42 SER HBy A 38 LEU HBy 1.0 0.0 2.57 883 687 A 38 LEU HDx% A 42 SER HBx 1.0 0.0 5.10 884 688 A 42 SER HBy A 38 LEU HDx% 1.0 0.0 5.10 885 689 A 38 LEU HDy% A 42 SER HBx 1.0 0.0 5.10 886 690 A 42 SER HBy A 38 LEU HDy% 1.0 0.0 5.10 887 691 A 38 LEU HDx% A 39 PRO HDy 1.0 0.0 2.75 888 691 A 38 LEU HDy% A 39 PRO HDy 1.0 0.0 2.75 889 691 A 39 PRO HDx A 38 LEU HDy% 1.0 0.0 2.75 890 691 A 38 LEU HDx% A 39 PRO HDx 1.0 0.0 2.75 891 692 A 39 PRO HGx A 38 LEU HDy% 1.0 0.0 3.98 892 692 A 38 LEU HDx% A 39 PRO HGx 1.0 0.0 3.98 893 693 A 38 LEU HDy% A 42 SER HBx 1.0 0.0 2.72 894 693 A 42 SER HBy A 38 LEU HDy% 1.0 0.0 2.72 895 693 A 42 SER HBy A 38 LEU HDx% 1.0 0.0 2.72 896 693 A 38 LEU HDx% A 42 SER HBx 1.0 0.0 2.72 897 694 A 38 LEU HG A 39 PRO HDy 1.0 0.0 4.12 898 694 A 38 LEU HG A 39 PRO HDx 1.0 0.0 4.12 899 695 A 38 LEU H A 38 LEU HBx 1.0 0.0 3.92 900 696 A 38 LEU H A 38 LEU HBy 1.0 0.0 3.92 901 697 A 38 LEU H A 38 LEU HBx 1.0 0.0 3.17 902 697 A 38 LEU H A 38 LEU HBy 1.0 0.0 3.17 903 698 A 38 LEU HDx% A 38 LEU H 1.0 0.0 5.50 904 699 A 38 LEU H A 38 LEU HDy% 1.0 0.0 5.50 905 700 A 38 LEU H A 38 LEU HDy% 1.0 0.0 4.37 906 700 A 38 LEU HDx% A 38 LEU H 1.0 0.0 4.37 907 701 A 38 LEU H A 38 LEU HG 1.0 0.0 4.53 908 702 A 38 LEU H A 75 THR HB 1.0 0.0 5.50 909 703 A 38 LEU H A 75 THR HG2% 1.0 0.0 4.22 910 704 A 39 PRO HA A 40 LEU HDy% 1.0 0.0 4.62 911 704 A 39 PRO HA A 40 LEU HDx% 1.0 0.0 4.62 912 705 A 39 PRO HA A 40 LEU H 1.0 0.0 3.41 913 706 A 39 PRO HA A 74 PRO HBx 1.0 0.0 3.19 914 707 A 39 PRO HA A 75 THR HA 1.0 0.0 3.92 915 708 A 75 THR HG2% A 39 PRO HA 1.0 0.0 3.42 916 709 A 40 LEU H A 39 PRO HBy 1.0 0.0 3.60 917 709 A 39 PRO HBx A 40 LEU H 1.0 0.0 3.60 918 710 A 41 THR HG1 A 39 PRO HBy 1.0 0.0 4.99 919 710 A 39 PRO HBx A 41 THR HG1 1.0 0.0 4.99 920 711 A 41 THR HG2% A 39 PRO HBy 1.0 0.0 4.64 921 711 A 39 PRO HBx A 41 THR HG2% 1.0 0.0 4.64 922 712 A 41 THR H A 39 PRO HBy 1.0 0.0 4.37 923 712 A 39 PRO HBx A 41 THR H 1.0 0.0 4.37 924 713 A 42 SER H A 39 PRO HBy 1.0 0.0 5.34 925 713 A 39 PRO HBx A 42 SER H 1.0 0.0 5.34 926 714 A 75 THR HG2% A 39 PRO HDy 1.0 0.0 4.20 927 715 A 75 THR HG2% A 39 PRO HDx 1.0 0.0 4.20 928 716 A 75 THR HG2% A 39 PRO HDy 1.0 0.0 3.58 929 716 A 75 THR HG2% A 39 PRO HDx 1.0 0.0 3.58 930 717 A 41 THR HG1 A 39 PRO HGy 1.0 0.0 4.70 931 718 A 40 LEU HA A 39 PRO HGx 1.0 0.0 5.50 932 719 A 39 PRO HGx A 40 LEU HDy% 1.0 0.0 4.90 933 719 A 39 PRO HGx A 40 LEU HDx% 1.0 0.0 4.90 934 720 A 39 PRO HGx A 40 LEU H 1.0 0.0 4.44 935 721 A 39 PRO HGx A 41 THR HA 1.0 0.0 5.50 936 722 A 39 PRO HGx A 41 THR HG1 1.0 0.0 5.14 937 723 A 39 PRO HGx A 41 THR H 1.0 0.0 5.18 938 724 A 39 PRO HGx A 42 SER HA 1.0 0.0 5.37 939 725 A 39 PRO HGx A 42 SER H 1.0 0.0 4.04 940 726 A 40 LEU HA A 40 LEU HDx% 1.0 0.0 4.15 941 727 A 40 LEU HA A 40 LEU HDy% 1.0 0.0 4.15 942 728 A 40 LEU HA A 40 LEU HDy% 1.0 0.0 3.44 943 728 A 40 LEU HA A 40 LEU HDx% 1.0 0.0 3.44 944 729 A 40 LEU HA A 43 TYR HBy 1.0 0.0 5.50 945 730 A 43 TYR HBx A 40 LEU HA 1.0 0.0 4.95 946 731 A 43 TYR HD% A 40 LEU HA 1.0 0.0 3.48 947 732 A 40 LEU HA A 43 TYR HEx 1.0 0.0 3.34 948 732 A 40 LEU HA A 43 TYR HEy 1.0 0.0 3.34 949 733 A 40 LEU HA A 43 TYR H 1.0 0.0 4.26 950 734 A 40 LEU HA A 45 LEU HDy% 1.0 0.0 4.57 951 735 A 40 LEU HDx% A 40 LEU HBy 1.0 0.0 3.52 952 736 A 40 LEU HBy A 40 LEU HDy% 1.0 0.0 3.52 953 737 A 40 LEU HDx% A 40 LEU HBx 1.0 0.0 3.52 954 738 A 40 LEU HBx A 40 LEU HDy% 1.0 0.0 3.52 955 739 A 40 LEU HBx A 40 LEU HDy% 1.0 0.0 1.56 956 739 A 40 LEU HDx% A 40 LEU HBy 1.0 0.0 1.56 957 739 A 40 LEU HDx% A 40 LEU HBx 1.0 0.0 1.56 958 739 A 40 LEU HBy A 40 LEU HDy% 1.0 0.0 1.56 959 740 A 43 TYR HD% A 40 LEU HBy 1.0 0.0 4.88 960 740 A 43 TYR HD% A 40 LEU HBx 1.0 0.0 4.88 961 741 A 40 LEU HBy A 43 TYR HEy 1.0 0.0 3.83 962 741 A 40 LEU HBx A 43 TYR HEy 1.0 0.0 3.83 963 741 A 43 TYR HEx A 40 LEU HBy 1.0 0.0 3.83 964 741 A 43 TYR HEx A 40 LEU HBx 1.0 0.0 3.83 965 742 A 45 LEU HDx% A 40 LEU HBy 1.0 0.0 3.56 966 742 A 40 LEU HBx A 45 LEU HDx% 1.0 0.0 3.56 967 743 A 45 LEU HDy% A 40 LEU HBy 1.0 0.0 4.00 968 743 A 45 LEU HDy% A 40 LEU HBx 1.0 0.0 4.00 969 744 A 40 LEU HDx% A 45 LEU HDy% 1.0 0.0 3.38 970 745 A 40 LEU HDx% A 71 TRP HH2 1.0 0.0 4.73 971 746 A 45 LEU HDy% A 40 LEU HDy% 1.0 0.0 3.38 972 747 A 71 TRP HH2 A 40 LEU HDy% 1.0 0.0 4.73 973 748 A 41 THR HA A 40 LEU HDy% 1.0 0.0 4.17 974 748 A 40 LEU HDx% A 41 THR HA 1.0 0.0 4.17 975 749 A 41 THR HG2% A 40 LEU HDy% 1.0 0.0 4.00 976 749 A 40 LEU HDx% A 41 THR HG2% 1.0 0.0 4.00 977 750 A 41 THR H A 40 LEU HDy% 1.0 0.0 5.03 978 750 A 40 LEU HDx% A 41 THR H 1.0 0.0 5.03 979 751 A 43 TYR HD% A 40 LEU HDy% 1.0 0.0 3.99 980 751 A 43 TYR HD% A 40 LEU HDx% 1.0 0.0 3.99 981 752 A 40 LEU HDx% A 43 TYR HEy 1.0 0.0 4.97 982 752 A 43 TYR HEx A 40 LEU HDy% 1.0 0.0 4.97 983 752 A 43 TYR HEx A 40 LEU HDx% 1.0 0.0 4.97 984 752 A 40 LEU HDy% A 43 TYR HEy 1.0 0.0 4.97 985 753 A 45 LEU HDy% A 40 LEU HDy% 1.0 0.0 2.91 986 753 A 40 LEU HDx% A 45 LEU HDy% 1.0 0.0 2.91 987 754 A 49 TYR HBy A 40 LEU HDy% 1.0 0.0 4.96 988 754 A 40 LEU HDx% A 49 TYR HBy 1.0 0.0 4.96 989 755 A 71 TRP HE3 A 40 LEU HDy% 1.0 0.0 5.31 990 755 A 40 LEU HDx% A 71 TRP HE3 1.0 0.0 5.31 991 756 A 71 TRP HH2 A 40 LEU HDy% 1.0 0.0 3.87 992 756 A 40 LEU HDx% A 71 TRP HH2 1.0 0.0 3.87 993 757 A 41 THR HA A 40 LEU HG 1.0 0.0 4.90 994 758 A 41 THR HG2% A 40 LEU HG 1.0 0.0 5.50 995 759 A 41 THR H A 40 LEU HG 1.0 0.0 5.13 996 760 A 43 TYR HD% A 40 LEU HG 1.0 0.0 5.50 997 761 A 40 LEU H A 40 LEU HBy 1.0 0.0 3.53 998 761 A 40 LEU H A 40 LEU HBx 1.0 0.0 3.53 999 762 A 40 LEU HDx% A 40 LEU H 1.0 0.0 4.29 1000 763 A 40 LEU H A 40 LEU HDy% 1.0 0.0 4.29 1001 764 A 40 LEU H A 40 LEU HDy% 1.0 0.0 3.71 1002 764 A 40 LEU HDx% A 40 LEU H 1.0 0.0 3.71 1003 765 A 40 LEU H A 40 LEU HG 1.0 0.0 4.03 1004 766 A 40 LEU H A 41 THR H 1.0 0.0 4.40 1005 767 A 40 LEU H A 45 LEU HDx% 1.0 0.0 5.50 1006 768 A 40 LEU H A 74 PRO HA 1.0 0.0 5.50 1007 769 A 40 LEU H A 74 PRO HBx 1.0 0.0 5.50 1008 770 A 75 THR HG2% A 40 LEU H 1.0 0.0 4.79 1009 771 A 41 THR HG2% A 41 THR HA 1.0 0.0 3.40 1010 772 A 41 THR HA A 43 TYR H 1.0 0.0 4.92 1011 773 A 41 THR HA A 45 LEU HBx 1.0 0.0 5.50 1012 774 A 41 THR HA A 45 LEU HDy% 1.0 0.0 5.45 1013 775 A 45 LEU H A 41 THR HA 1.0 0.0 3.98 1014 776 A 42 SER H A 41 THR HB 1.0 0.0 5.37 1015 777 A 41 THR HG1 A 42 SER H 1.0 0.0 4.91 1016 778 A 41 THR HG2% A 42 SER H 1.0 0.0 5.38 1017 779 A 41 THR HG2% A 44 GLY H 1.0 0.0 5.50 1018 780 A 41 THR HG2% A 45 LEU HDy% 1.0 0.0 3.49 1019 781 A 41 THR HG2% A 71 TRP HE3 1.0 0.0 5.50 1020 782 A 41 THR HG2% A 71 TRP HH2 1.0 0.0 3.74 1021 783 A 41 THR HG2% A 71 TRP HZ3 1.0 0.0 3.83 1022 784 A 41 THR HG1 A 41 THR H 1.0 0.0 4.23 1023 785 A 41 THR HG2% A 41 THR H 1.0 0.0 3.69 1024 786 A 42 SER HA A 44 GLY H 1.0 0.0 4.51 1025 787 A 43 TYR HD% A 42 SER HBx 1.0 0.0 3.84 1026 787 A 43 TYR HD% A 42 SER HBy 1.0 0.0 3.84 1027 788 A 42 SER HBy A 43 TYR HEy 1.0 0.0 4.34 1028 788 A 43 TYR HEx A 42 SER HBx 1.0 0.0 4.34 1029 788 A 42 SER HBy A 43 TYR HEx 1.0 0.0 4.34 1030 788 A 42 SER HBx A 43 TYR HEy 1.0 0.0 4.34 1031 789 A 43 TYR H A 42 SER HBx 1.0 0.0 4.43 1032 789 A 42 SER HBy A 43 TYR H 1.0 0.0 4.43 1033 790 A 42 SER H A 42 SER HBx 1.0 0.0 3.27 1034 790 A 42 SER HBy A 42 SER H 1.0 0.0 3.27 1035 791 A 43 TYR HD% A 42 SER H 1.0 0.0 5.50 1036 792 A 42 SER H A 43 TYR H 1.0 0.0 3.66 1037 793 A 42 SER H A 44 GLY H 1.0 0.0 5.50 1038 794 A 43 TYR HD% A 43 TYR HA 1.0 0.0 2.94 1039 795 A 43 TYR HA A 43 TYR HEx 1.0 0.0 4.67 1040 795 A 43 TYR HA A 43 TYR HEy 1.0 0.0 4.67 1041 796 A 43 TYR HBy A 45 LEU HDx% 1.0 0.0 5.01 1042 797 A 43 TYR HBx A 44 GLY H 1.0 0.0 5.50 1043 798 A 43 TYR HBx A 45 LEU HDx% 1.0 0.0 4.95 1044 799 A 43 TYR HD% A 45 LEU HDy% 1.0 0.0 3.29 1045 800 A 43 TYR HEx A 45 LEU HDx% 1.0 0.0 5.50 1046 800 A 45 LEU HDx% A 43 TYR HEy 1.0 0.0 5.50 1047 801 A 43 TYR HBy A 43 TYR H 1.0 0.0 4.19 1048 802 A 43 TYR HBx A 43 TYR H 1.0 0.0 3.67 1049 803 A 43 TYR HD% A 43 TYR H 1.0 0.0 3.58 1050 804 A 43 TYR HEx A 43 TYR H 1.0 0.0 5.50 1051 804 A 43 TYR H A 43 TYR HEy 1.0 0.0 5.50 1052 805 A 43 TYR H A 44 GLY H 1.0 0.0 3.20 1053 806 A 45 LEU HDy% A 44 GLY HAx 1.0 0.0 5.34 1054 806 A 45 LEU HDy% A 44 GLY HAy 1.0 0.0 5.34 1055 807 A 45 LEU HDy% A 44 GLY H 1.0 0.0 5.50 1056 808 A 45 LEU H A 44 GLY H 1.0 0.0 3.64 1057 809 A 45 LEU HA A 45 LEU HBy 1.0 0.0 3.01 1058 810 A 45 LEU HDx% A 45 LEU HA 1.0 0.0 4.22 1059 811 A 45 LEU HDy% A 45 LEU HA 1.0 0.0 4.36 1060 812 A 49 TYR HBy A 45 LEU HA 1.0 0.0 5.38 1061 813 A 45 LEU HA A 49 TYR HBx 1.0 0.0 4.75 1062 814 A 45 LEU HA A 49 TYR HD% 1.0 0.0 4.43 1063 815 A 45 LEU HDx% A 45 LEU HBx 1.0 0.0 3.34 1064 816 A 45 LEU HDy% A 45 LEU HBx 1.0 0.0 3.99 1065 817 A 45 LEU HDx% A 45 LEU HBy 1.0 0.0 2.76 1066 818 A 45 LEU HDy% A 45 LEU HBy 1.0 0.0 3.79 1067 819 A 45 LEU HBy A 49 TYR HD% 1.0 0.0 4.09 1068 820 A 45 LEU HDx% A 46 ASP H 1.0 0.0 5.50 1069 821 A 45 LEU HDx% A 49 TYR HA 1.0 0.0 4.89 1070 822 A 45 LEU HDx% A 49 TYR HBy 1.0 0.0 3.96 1071 823 A 45 LEU HDx% A 49 TYR HD% 1.0 0.0 2.94 1072 824 A 45 LEU HDx% A 49 TYR HE% 1.0 0.0 4.24 1073 825 A 45 LEU HDx% A 50 ALA HA 1.0 0.0 4.35 1074 826 A 45 LEU HDx% A 50 ALA H 1.0 0.0 5.50 1075 827 A 45 LEU HDx% A 71 TRP HH2 1.0 0.0 5.26 1076 828 A 45 LEU HDy% A 49 TYR HBy 1.0 0.0 5.50 1077 829 A 45 LEU HDy% A 49 TYR HBx 1.0 0.0 5.27 1078 830 A 45 LEU HDy% A 49 TYR HE% 1.0 0.0 5.50 1079 831 A 45 LEU HDy% A 71 TRP HH2 1.0 0.0 4.11 1080 832 A 45 LEU HDy% A 71 TRP HZ2 1.0 0.0 5.46 1081 833 A 45 LEU HG A 46 ASP HBy 1.0 0.0 5.34 1082 833 A 45 LEU HG A 46 ASP HBx 1.0 0.0 5.34 1083 834 A 46 ASP H A 45 LEU HG 1.0 0.0 4.87 1084 835 A 49 TYR HBy A 45 LEU HG 1.0 0.0 5.50 1085 836 A 49 TYR HBx A 45 LEU HG 1.0 0.0 5.50 1086 837 A 45 LEU HG A 49 TYR H 1.0 0.0 5.50 1087 838 A 50 ALA H A 45 LEU HG 1.0 0.0 5.50 1088 839 A 45 LEU H A 45 LEU HBx 1.0 0.0 3.63 1089 840 A 45 LEU H A 45 LEU HBy 1.0 0.0 3.60 1090 841 A 45 LEU H A 45 LEU HDx% 1.0 0.0 4.57 1091 842 A 45 LEU H A 45 LEU HDy% 1.0 0.0 4.94 1092 843 A 45 LEU H A 45 LEU HG 1.0 0.0 4.40 1093 844 A 47 SER H A 46 ASP HBy 1.0 0.0 4.30 1094 845 A 46 ASP HBx A 47 SER H 1.0 0.0 4.30 1095 846 A 47 SER H A 46 ASP HBy 1.0 0.0 3.55 1096 846 A 46 ASP HBx A 47 SER H 1.0 0.0 3.55 1097 847 A 48 VAL H A 46 ASP HBy 1.0 0.0 5.34 1098 847 A 46 ASP HBx A 48 VAL H 1.0 0.0 5.34 1099 848 A 49 TYR H A 46 ASP HBy 1.0 0.0 5.10 1100 848 A 46 ASP HBx A 49 TYR H 1.0 0.0 5.10 1101 849 A 49 TYR HBx A 46 ASP H 1.0 0.0 3.94 1102 850 A 49 TYR HD% A 46 ASP H 1.0 0.0 5.50 1103 851 A 46 ASP H A 49 TYR H 1.0 0.0 5.50 1104 852 A 49 TYR H A 47 SER HA 1.0 0.0 5.50 1105 853 A 47 SER HA A 50 ALA HB% 1.0 0.0 4.00 1106 854 A 50 ALA H A 47 SER HA 1.0 0.0 5.50 1107 855 A 71 TRP HH2 A 47 SER HA 1.0 0.0 5.50 1108 856 A 71 TRP HZ2 A 47 SER HA 1.0 0.0 3.37 1109 857 A 48 VAL H A 47 SER HBy 1.0 0.0 5.22 1110 858 A 71 TRP HZ2 A 47 SER HBy 1.0 0.0 5.50 1111 859 A 48 VAL H A 47 SER HBx 1.0 0.0 5.22 1112 860 A 71 TRP HZ2 A 47 SER HBx 1.0 0.0 5.50 1113 861 A 47 SER H A 48 VAL HGy% 1.0 0.0 3.82 1114 861 A 47 SER H A 48 VAL HGx% 1.0 0.0 3.82 1115 862 A 47 SER H A 48 VAL H 1.0 0.0 3.80 1116 863 A 48 VAL HGx% A 48 VAL HA 1.0 0.0 3.83 1117 864 A 48 VAL HA A 48 VAL HGy% 1.0 0.0 3.83 1118 865 A 49 TYR HA A 48 VAL HA 1.0 0.0 4.91 1119 866 A 50 ALA H A 48 VAL HA 1.0 0.0 5.09 1120 867 A 49 TYR H A 48 VAL HB 1.0 0.0 4.09 1121 868 A 49 TYR H A 48 VAL HGx% 1.0 0.0 5.50 1122 869 A 49 TYR H A 48 VAL HGy% 1.0 0.0 5.50 1123 870 A 48 VAL H A 48 VAL HB 1.0 0.0 3.78 1124 871 A 48 VAL H A 48 VAL HGx% 1.0 0.0 3.97 1125 872 A 48 VAL H A 48 VAL HGy% 1.0 0.0 3.97 1126 873 A 48 VAL H A 48 VAL HGy% 1.0 0.0 3.26 1127 873 A 48 VAL H A 48 VAL HGx% 1.0 0.0 3.26 1128 874 A 49 TYR HBx A 48 VAL H 1.0 0.0 5.50 1129 875 A 49 TYR H A 48 VAL H 1.0 0.0 3.88 1130 876 A 49 TYR HD% A 49 TYR HA 1.0 0.0 2.84 1131 877 A 49 TYR HA A 49 TYR HE% 1.0 0.0 5.07 1132 878 A 49 TYR HA A 52 SER HBy 1.0 0.0 5.09 1133 879 A 49 TYR HA A 52 SER HBx 1.0 0.0 5.09 1134 880 A 49 TYR HA A 52 SER HBy 1.0 0.0 4.38 1135 880 A 49 TYR HA A 52 SER HBx 1.0 0.0 4.38 1136 881 A 49 TYR HA A 52 SER H 1.0 0.0 4.19 1137 882 A 49 TYR HBy A 50 ALA HB% 1.0 0.0 5.50 1138 883 A 53 ILE HD1% A 49 TYR HBy 1.0 0.0 4.44 1139 884 A 49 TYR HBx A 50 ALA HB% 1.0 0.0 5.50 1140 885 A 53 ILE HD1% A 49 TYR HD% 1.0 0.0 4.92 1141 886 A 49 TYR HBx A 49 TYR H 1.0 0.0 3.65 1142 887 A 49 TYR HD% A 49 TYR H 1.0 0.0 5.50 1143 888 A 50 ALA HA A 53 ILE HB 1.0 0.0 3.69 1144 889 A 53 ILE HD1% A 50 ALA HA 1.0 0.0 5.18 1145 890 A 53 ILE HG2% A 50 ALA HA 1.0 0.0 4.61 1146 891 A 50 ALA HA A 54 ALA H 1.0 0.0 4.56 1147 892 A 50 ALA HA A 70 ILE HG2% 1.0 0.0 4.57 1148 893 A 50 ALA HB% A 51 LEU HBx 1.0 0.0 4.26 1149 893 A 50 ALA HB% A 51 LEU HBy 1.0 0.0 4.26 1150 894 A 50 ALA HB% A 51 LEU H 1.0 0.0 3.26 1151 895 A 50 ALA HB% A 53 ILE HB 1.0 0.0 4.36 1152 896 A 50 ALA HB% A 54 ALA H 1.0 0.0 5.28 1153 897 A 71 TRP HH2 A 50 ALA HB% 1.0 0.0 5.50 1154 898 A 71 TRP HZ2 A 50 ALA HB% 1.0 0.0 3.58 1155 899 A 50 ALA H A 50 ALA HB% 1.0 0.0 3.24 1156 900 A 50 ALA H A 51 LEU H 1.0 0.0 3.70 1157 901 A 51 LEU HA A 51 LEU HDx% 1.0 0.0 4.12 1158 902 A 51 LEU HA A 51 LEU HDy% 1.0 0.0 4.12 1159 903 A 51 LEU HA A 51 LEU HDy% 1.0 0.0 3.02 1160 903 A 51 LEU HA A 51 LEU HDx% 1.0 0.0 3.02 1161 904 A 51 LEU HA A 54 ALA HB% 1.0 0.0 3.75 1162 905 A 54 ALA H A 51 LEU HA 1.0 0.0 5.50 1163 906 A 51 LEU HDx% A 51 LEU HBx 1.0 0.0 3.52 1164 907 A 51 LEU HBx A 51 LEU HDy% 1.0 0.0 3.52 1165 908 A 52 SER H A 51 LEU HBx 1.0 0.0 4.11 1166 909 A 51 LEU HBy A 51 LEU HDx% 1.0 0.0 3.52 1167 910 A 51 LEU HBy A 51 LEU HDy% 1.0 0.0 3.52 1168 911 A 52 SER H A 51 LEU HBy 1.0 0.0 4.11 1169 912 A 51 LEU HBy A 51 LEU HDy% 1.0 0.0 1.57 1170 912 A 51 LEU HBx A 51 LEU HDy% 1.0 0.0 1.57 1171 912 A 51 LEU HDx% A 51 LEU HBx 1.0 0.0 1.57 1172 912 A 51 LEU HBy A 51 LEU HDx% 1.0 0.0 1.57 1173 913 A 51 LEU HG A 51 LEU HBx 1.0 0.0 2.61 1174 913 A 51 LEU HBy A 51 LEU HG 1.0 0.0 2.61 1175 914 A 52 SER H A 51 LEU HBx 1.0 0.0 3.47 1176 914 A 52 SER H A 51 LEU HBy 1.0 0.0 3.47 1177 915 A 52 SER HA A 51 LEU HDy% 1.0 0.0 4.38 1178 915 A 51 LEU HDx% A 52 SER HA 1.0 0.0 4.38 1179 916 A 51 LEU HDx% A 52 SER HBy 1.0 0.0 2.75 1180 916 A 51 LEU HDy% A 52 SER HBy 1.0 0.0 2.75 1181 916 A 52 SER HBx A 51 LEU HDy% 1.0 0.0 2.75 1182 916 A 52 SER HBx A 51 LEU HDx% 1.0 0.0 2.75 1183 917 A 51 LEU HG A 52 SER HBy 1.0 0.0 5.12 1184 917 A 52 SER HBx A 51 LEU HG 1.0 0.0 5.12 1185 918 A 51 LEU H A 51 LEU HBx 1.0 0.0 3.97 1186 919 A 51 LEU HBy A 51 LEU H 1.0 0.0 3.97 1187 920 A 51 LEU H A 51 LEU HBx 1.0 0.0 3.18 1188 920 A 51 LEU HBy A 51 LEU H 1.0 0.0 3.18 1189 921 A 51 LEU H A 51 LEU HDx% 1.0 0.0 4.72 1190 922 A 51 LEU H A 51 LEU HDy% 1.0 0.0 4.72 1191 923 A 51 LEU H A 51 LEU HDy% 1.0 0.0 4.08 1192 923 A 51 LEU H A 51 LEU HDx% 1.0 0.0 4.08 1193 924 A 51 LEU H A 51 LEU HG 1.0 0.0 4.71 1194 925 A 52 SER HA A 53 ILE HA 1.0 0.0 5.05 1195 926 A 52 SER HA A 55 ALA HB% 1.0 0.0 4.07 1196 927 A 52 SER HA A 56 GLU HBy 1.0 0.0 5.34 1197 927 A 52 SER HA A 56 GLU HBx 1.0 0.0 5.34 1198 928 A 52 SER HBy A 53 ILE HG1x 1.0 0.0 2.57 1199 928 A 52 SER HBx A 53 ILE HG1x 1.0 0.0 2.57 1200 928 A 53 ILE HG1y A 52 SER HBy 1.0 0.0 2.57 1201 928 A 52 SER HBx A 53 ILE HG1y 1.0 0.0 2.57 1202 929 A 53 ILE H A 52 SER HBy 1.0 0.0 3.92 1203 929 A 52 SER HBx A 53 ILE H 1.0 0.0 3.92 1204 930 A 52 SER H A 52 SER HBy 1.0 0.0 3.37 1205 930 A 52 SER HBx A 52 SER H 1.0 0.0 3.37 1206 931 A 53 ILE HD1% A 52 SER H 1.0 0.0 5.50 1207 932 A 52 SER H A 53 ILE H 1.0 0.0 3.51 1208 933 A 53 ILE HD1% A 53 ILE HA 1.0 0.0 4.22 1209 934 A 53 ILE HG2% A 53 ILE HA 1.0 0.0 3.68 1210 935 A 53 ILE HA A 56 GLU HBy 1.0 0.0 4.52 1211 935 A 53 ILE HA A 56 GLU HBx 1.0 0.0 4.52 1212 936 A 53 ILE HA A 56 GLU HGy 1.0 0.0 5.50 1213 937 A 53 ILE HA A 56 GLU HGx 1.0 0.0 5.50 1214 938 A 53 ILE HA A 56 GLU H 1.0 0.0 4.37 1215 939 A 53 ILE HD1% A 53 ILE HB 1.0 0.0 3.64 1216 940 A 53 ILE HB A 54 ALA H 1.0 0.0 3.52 1217 941 A 53 ILE HD1% A 57 LEU H 1.0 0.0 5.50 1218 942 A 53 ILE HD1% A 53 ILE HG2% 1.0 0.0 2.54 1219 943 A 53 ILE HG2% A 53 ILE HG1x 1.0 0.0 3.28 1220 943 A 53 ILE HG2% A 53 ILE HG1y 1.0 0.0 3.28 1221 944 A 53 ILE HG2% A 54 ALA HA 1.0 0.0 3.44 1222 945 A 53 ILE HG2% A 54 ALA H 1.0 0.0 3.79 1223 946 A 53 ILE HG2% A 55 ALA H 1.0 0.0 5.50 1224 947 A 53 ILE HG2% A 56 GLU H 1.0 0.0 5.50 1225 948 A 53 ILE HG2% A 57 LEU H 1.0 0.0 5.50 1226 949 A 53 ILE HB A 53 ILE H 1.0 0.0 3.28 1227 950 A 53 ILE HD1% A 53 ILE H 1.0 0.0 4.22 1228 951 A 53 ILE H A 53 ILE HG1x 1.0 0.0 4.54 1229 951 A 53 ILE HG1y A 53 ILE H 1.0 0.0 4.54 1230 952 A 53 ILE HG2% A 53 ILE H 1.0 0.0 4.15 1231 953 A 54 ALA HA A 55 ALA HA 1.0 0.0 5.50 1232 954 A 56 GLU H A 54 ALA HA 1.0 0.0 5.50 1233 955 A 54 ALA HA A 57 LEU HBx 1.0 0.0 3.75 1234 956 A 57 LEU HG A 54 ALA HA 1.0 0.0 5.30 1235 957 A 57 LEU H A 54 ALA HA 1.0 0.0 4.63 1236 958 A 54 ALA HA A 70 ILE HD1% 1.0 0.0 4.55 1237 959 A 54 ALA HB% A 55 ALA H 1.0 0.0 3.37 1238 960 A 54 ALA HB% A 58 GLU HGy 1.0 0.0 5.34 1239 960 A 54 ALA HB% A 58 GLU HGx 1.0 0.0 5.34 1240 961 A 54 ALA HB% A 70 ILE HD1% 1.0 0.0 3.08 1241 962 A 70 ILE HG2% A 54 ALA HB% 1.0 0.0 5.37 1242 963 A 54 ALA H A 54 ALA HB% 1.0 0.0 3.15 1243 964 A 54 ALA H A 55 ALA H 1.0 0.0 3.23 1244 965 A 54 ALA H A 57 LEU HBx 1.0 0.0 5.50 1245 966 A 54 ALA H A 70 ILE HD1% 1.0 0.0 4.69 1246 967 A 55 ALA HA A 58 GLU HGy 1.0 0.0 3.32 1247 967 A 55 ALA HA A 58 GLU HGx 1.0 0.0 3.32 1248 968 A 55 ALA HA A 59 ASP H 1.0 0.0 4.86 1249 969 A 55 ALA HA A 65 LEU HDy% 1.0 0.0 5.44 1250 969 A 55 ALA HA A 65 LEU HDx% 1.0 0.0 5.44 1251 970 A 55 ALA HB% A 56 GLU HBy 1.0 0.0 4.63 1252 970 A 55 ALA HB% A 56 GLU HBx 1.0 0.0 4.63 1253 971 A 55 ALA HB% A 56 GLU H 1.0 0.0 3.28 1254 972 A 55 ALA HB% A 58 GLU HGy 1.0 0.0 4.93 1255 973 A 55 ALA HB% A 58 GLU HGx 1.0 0.0 4.93 1256 974 A 55 ALA HB% A 58 GLU HGy 1.0 0.0 4.23 1257 974 A 55 ALA HB% A 58 GLU HGx 1.0 0.0 4.23 1258 975 A 55 ALA HB% A 58 GLU H 1.0 0.0 5.50 1259 976 A 55 ALA HB% A 55 ALA H 1.0 0.0 2.97 1260 977 A 55 ALA H A 56 GLU HBy 1.0 0.0 5.34 1261 977 A 56 GLU HBx A 55 ALA H 1.0 0.0 5.34 1262 978 A 57 LEU H A 55 ALA H 1.0 0.0 5.50 1263 979 A 56 GLU HA A 56 GLU HGy 1.0 0.0 3.53 1264 979 A 56 GLU HA A 56 GLU HGx 1.0 0.0 3.53 1265 980 A 56 GLU HA A 57 LEU HDy% 1.0 0.0 5.44 1266 980 A 57 LEU HDx% A 56 GLU HA 1.0 0.0 5.44 1267 981 A 59 ASP H A 56 GLU HA 1.0 0.0 5.06 1268 982 A 57 LEU H A 56 GLU HBy 1.0 0.0 4.59 1269 983 A 56 GLU HBx A 57 LEU H 1.0 0.0 4.59 1270 984 A 56 GLU HBx A 56 GLU HGy 1.0 0.0 2.55 1271 984 A 56 GLU HBy A 56 GLU HGy 1.0 0.0 2.55 1272 984 A 56 GLU HGx A 56 GLU HBy 1.0 0.0 2.55 1273 984 A 56 GLU HBx A 56 GLU HGx 1.0 0.0 2.55 1274 985 A 57 LEU H A 56 GLU HBy 1.0 0.0 3.82 1275 985 A 56 GLU HBx A 57 LEU H 1.0 0.0 3.82 1276 986 A 56 GLU H A 56 GLU HBy 1.0 0.0 3.86 1277 987 A 56 GLU HBx A 56 GLU H 1.0 0.0 3.86 1278 988 A 56 GLU H A 56 GLU HBy 1.0 0.0 3.05 1279 988 A 56 GLU HBx A 56 GLU H 1.0 0.0 3.05 1280 989 A 56 GLU H A 56 GLU HGy 1.0 0.0 4.82 1281 990 A 56 GLU H A 56 GLU HGx 1.0 0.0 4.82 1282 991 A 56 GLU H A 56 GLU HGy 1.0 0.0 4.08 1283 991 A 56 GLU H A 56 GLU HGx 1.0 0.0 4.08 1284 992 A 57 LEU HA A 56 GLU H 1.0 0.0 5.50 1285 993 A 56 GLU H A 57 LEU H 1.0 0.0 3.49 1286 994 A 56 GLU H A 58 GLU H 1.0 0.0 5.50 1287 995 A 57 LEU HA A 57 LEU HDx% 1.0 0.0 3.91 1288 996 A 57 LEU HA A 57 LEU HDy% 1.0 0.0 3.91 1289 997 A 57 LEU HA A 57 LEU HDy% 1.0 0.0 2.88 1290 997 A 57 LEU HA A 57 LEU HDx% 1.0 0.0 2.88 1291 998 A 57 LEU HA A 57 LEU HG 1.0 0.0 3.46 1292 999 A 57 LEU HA A 59 ASP HBx 1.0 0.0 5.28 1293 999 A 57 LEU HA A 59 ASP HBy 1.0 0.0 5.28 1294 1000 A 57 LEU HA A 59 ASP H 1.0 0.0 5.50 1295 1001 A 57 LEU HA A 60 HIS HBy 1.0 0.0 4.74 1296 1002 A 57 LEU HA A 60 HIS HBx 1.0 0.0 4.74 1297 1003 A 57 LEU HA A 60 HIS HBy 1.0 0.0 3.92 1298 1003 A 57 LEU HA A 60 HIS HBx 1.0 0.0 3.92 1299 1004 A 57 LEU HA A 60 HIS H 1.0 0.0 4.59 1300 1005 A 61 LEU HDx% A 57 LEU HA 1.0 0.0 5.50 1301 1006 A 57 LEU HA A 61 LEU HDy% 1.0 0.0 4.50 1302 1007 A 57 LEU HA A 61 LEU H 1.0 0.0 5.50 1303 1008 A 57 LEU HBy A 58 GLU HA 1.0 0.0 4.38 1304 1009 A 57 LEU HBy A 58 GLU H 1.0 0.0 4.43 1305 1010 A 57 LEU HDx% A 57 LEU HBx 1.0 0.0 3.54 1306 1011 A 57 LEU HBx A 57 LEU HDy% 1.0 0.0 3.54 1307 1012 A 57 LEU HBx A 65 LEU HDy% 1.0 0.0 3.75 1308 1012 A 57 LEU HBx A 65 LEU HDx% 1.0 0.0 3.75 1309 1013 A 59 ASP H A 57 LEU HDy% 1.0 0.0 5.44 1310 1013 A 57 LEU HDx% A 59 ASP H 1.0 0.0 5.44 1311 1014 A 60 HIS H A 57 LEU HDy% 1.0 0.0 5.44 1312 1014 A 57 LEU HDx% A 60 HIS H 1.0 0.0 5.44 1313 1015 A 57 LEU HG A 58 GLU H 1.0 0.0 5.23 1314 1016 A 57 LEU H A 57 LEU HBx 1.0 0.0 3.81 1315 1017 A 57 LEU HDx% A 57 LEU H 1.0 0.0 5.50 1316 1018 A 57 LEU H A 57 LEU HDy% 1.0 0.0 5.50 1317 1019 A 57 LEU H A 57 LEU HDy% 1.0 0.0 4.01 1318 1019 A 57 LEU HDx% A 57 LEU H 1.0 0.0 4.01 1319 1020 A 57 LEU HG A 57 LEU H 1.0 0.0 4.14 1320 1021 A 58 GLU HA A 58 GLU HGy 1.0 0.0 4.23 1321 1022 A 58 GLU HGx A 58 GLU HA 1.0 0.0 4.23 1322 1023 A 58 GLU HA A 60 HIS HBy 1.0 0.0 5.34 1323 1023 A 60 HIS HBx A 58 GLU HA 1.0 0.0 5.34 1324 1024 A 61 LEU H A 58 GLU HA 1.0 0.0 4.83 1325 1025 A 58 GLU HA A 63 VAL HGy% 1.0 0.0 3.92 1326 1025 A 58 GLU HA A 63 VAL HGx% 1.0 0.0 3.92 1327 1026 A 58 GLU HA A 63 VAL H 1.0 0.0 4.41 1328 1027 A 58 GLU HA A 65 LEU HDy% 1.0 0.0 3.32 1329 1027 A 65 LEU HDx% A 58 GLU HA 1.0 0.0 3.32 1330 1028 A 63 VAL HGx% A 58 GLU HBy 1.0 0.0 5.52 1331 1029 A 58 GLU HBy A 63 VAL HGy% 1.0 0.0 3.52 1332 1030 A 65 LEU HDx% A 58 GLU HBy 1.0 0.0 3.52 1333 1031 A 58 GLU HBy A 65 LEU HDy% 1.0 0.0 3.52 1334 1032 A 63 VAL HGx% A 58 GLU HBx 1.0 0.0 4.52 1335 1033 A 58 GLU HBx A 63 VAL HGy% 1.0 0.0 3.52 1336 1034 A 65 LEU HDx% A 58 GLU HBx 1.0 0.0 3.52 1337 1035 A 58 GLU HBx A 65 LEU HDy% 1.0 0.0 4.52 1338 1036 A 59 ASP H A 58 GLU HBy 1.0 0.0 4.46 1339 1036 A 59 ASP H A 58 GLU HBx 1.0 0.0 4.46 1340 1037 A 58 GLU HBy A 63 VAL HGy% 1.0 0.0 2.06 1341 1037 A 58 GLU HBx A 63 VAL HGy% 1.0 0.0 2.06 1342 1037 A 63 VAL HGx% A 58 GLU HBy 1.0 0.0 2.06 1343 1037 A 63 VAL HGx% A 58 GLU HBx 1.0 0.0 2.06 1344 1038 A 58 GLU HBy A 65 LEU HDy% 1.0 0.0 2.56 1345 1038 A 58 GLU HBx A 65 LEU HDy% 1.0 0.0 2.56 1346 1038 A 65 LEU HDx% A 58 GLU HBy 1.0 0.0 2.56 1347 1038 A 65 LEU HDx% A 58 GLU HBx 1.0 0.0 2.56 1348 1039 A 65 LEU HG A 58 GLU HBy 1.0 0.0 3.93 1349 1039 A 58 GLU HBx A 65 LEU HG 1.0 0.0 3.93 1350 1040 A 65 LEU H A 58 GLU HBy 1.0 0.0 5.34 1351 1040 A 58 GLU HBx A 65 LEU H 1.0 0.0 5.34 1352 1041 A 65 LEU HDx% A 58 GLU HGy 1.0 0.0 3.53 1353 1042 A 58 GLU HGy A 65 LEU HDy% 1.0 0.0 4.53 1354 1043 A 58 GLU HGx A 65 LEU HDx% 1.0 0.0 3.53 1355 1044 A 58 GLU HGx A 65 LEU HDy% 1.0 0.0 3.53 1356 1045 A 59 ASP H A 58 GLU HGy 1.0 0.0 3.41 1357 1045 A 58 GLU HGx A 59 ASP H 1.0 0.0 3.41 1358 1046 A 58 GLU HGx A 65 LEU HDy% 1.0 0.0 2.57 1359 1046 A 58 GLU HGy A 65 LEU HDy% 1.0 0.0 2.57 1360 1046 A 65 LEU HDx% A 58 GLU HGy 1.0 0.0 2.57 1361 1046 A 58 GLU HGx A 65 LEU HDx% 1.0 0.0 2.57 1362 1047 A 65 LEU HG A 58 GLU HGy 1.0 0.0 5.34 1363 1047 A 58 GLU HGx A 65 LEU HG 1.0 0.0 5.34 1364 1048 A 58 GLU H A 58 GLU HBy 1.0 0.0 3.66 1365 1048 A 58 GLU H A 58 GLU HBx 1.0 0.0 3.66 1366 1049 A 58 GLU H A 58 GLU HGy 1.0 0.0 4.22 1367 1050 A 58 GLU HGx A 58 GLU H 1.0 0.0 4.22 1368 1051 A 58 GLU H A 58 GLU HGy 1.0 0.0 3.59 1369 1051 A 58 GLU HGx A 58 GLU H 1.0 0.0 3.59 1370 1052 A 58 GLU H A 59 ASP HBx 1.0 0.0 4.88 1371 1052 A 58 GLU H A 59 ASP HBy 1.0 0.0 4.88 1372 1053 A 59 ASP H A 58 GLU H 1.0 0.0 3.53 1373 1054 A 58 GLU H A 63 VAL HGy% 1.0 0.0 5.44 1374 1054 A 58 GLU H A 63 VAL HGx% 1.0 0.0 5.44 1375 1055 A 58 GLU H A 65 LEU HDy% 1.0 0.0 4.23 1376 1055 A 65 LEU HDx% A 58 GLU H 1.0 0.0 4.23 1377 1056 A 60 HIS H A 59 ASP HBx 1.0 0.0 3.63 1378 1056 A 59 ASP HBy A 60 HIS H 1.0 0.0 3.63 1379 1057 A 59 ASP H A 59 ASP HBx 1.0 0.0 3.89 1380 1058 A 59 ASP H A 59 ASP HBy 1.0 0.0 3.89 1381 1059 A 59 ASP H A 59 ASP HBx 1.0 0.0 3.08 1382 1059 A 59 ASP H A 59 ASP HBy 1.0 0.0 3.08 1383 1060 A 59 ASP H A 60 HIS H 1.0 0.0 3.54 1384 1061 A 59 ASP H A 65 LEU HDy% 1.0 0.0 5.44 1385 1061 A 59 ASP H A 65 LEU HDx% 1.0 0.0 5.44 1386 1062 A 60 HIS HA A 60 HIS HE1 1.0 0.0 4.82 1387 1063 A 61 LEU HDx% A 60 HIS HBy 1.0 0.0 4.52 1388 1064 A 60 HIS HBy A 61 LEU HDy% 1.0 0.0 3.52 1389 1065 A 61 LEU H A 60 HIS HBy 1.0 0.0 4.52 1390 1066 A 61 LEU HDx% A 60 HIS HBx 1.0 0.0 3.52 1391 1067 A 60 HIS HBx A 61 LEU HDy% 1.0 0.0 3.52 1392 1068 A 60 HIS HBx A 61 LEU H 1.0 0.0 4.52 1393 1069 A 60 HIS HD2 A 60 HIS HBy 1.0 0.0 3.38 1394 1069 A 60 HIS HBx A 60 HIS HD2 1.0 0.0 3.38 1395 1070 A 60 HIS HBy A 61 LEU HDy% 1.0 0.0 1.56 1396 1070 A 60 HIS HBx A 61 LEU HDy% 1.0 0.0 1.56 1397 1070 A 61 LEU HDx% A 60 HIS HBy 1.0 0.0 1.56 1398 1070 A 61 LEU HDx% A 60 HIS HBx 1.0 0.0 1.56 1399 1071 A 61 LEU H A 60 HIS HBy 1.0 0.0 3.71 1400 1071 A 60 HIS HBx A 61 LEU H 1.0 0.0 3.71 1401 1072 A 60 HIS H A 60 HIS HBy 1.0 0.0 3.94 1402 1073 A 60 HIS HBx A 60 HIS H 1.0 0.0 3.94 1403 1074 A 60 HIS H A 60 HIS HBy 1.0 0.0 3.38 1404 1074 A 60 HIS HBx A 60 HIS H 1.0 0.0 3.38 1405 1075 A 60 HIS H A 61 LEU HBx 1.0 0.0 5.34 1406 1075 A 60 HIS H A 61 LEU HBy 1.0 0.0 5.34 1407 1076 A 60 HIS H A 61 LEU HDy% 1.0 0.0 5.44 1408 1076 A 61 LEU HDx% A 60 HIS H 1.0 0.0 5.44 1409 1077 A 61 LEU HDx% A 61 LEU HA 1.0 0.0 4.05 1410 1078 A 61 LEU HA A 61 LEU HDy% 1.0 0.0 4.05 1411 1079 A 61 LEU HA A 61 LEU HDy% 1.0 0.0 3.15 1412 1079 A 61 LEU HDx% A 61 LEU HA 1.0 0.0 3.15 1413 1080 A 61 LEU HA A 63 VAL HGy% 1.0 0.0 4.50 1414 1080 A 63 VAL HGx% A 61 LEU HA 1.0 0.0 4.50 1415 1081 A 61 LEU HDx% A 61 LEU HBx 1.0 0.0 3.14 1416 1082 A 61 LEU HBx A 61 LEU HDy% 1.0 0.0 3.14 1417 1083 A 63 VAL HGx% A 61 LEU HBx 1.0 0.0 3.52 1418 1084 A 61 LEU HBx A 63 VAL HGy% 1.0 0.0 3.52 1419 1085 A 61 LEU HDx% A 61 LEU HBy 1.0 0.0 3.14 1420 1086 A 61 LEU HBy A 61 LEU HDy% 1.0 0.0 3.14 1421 1087 A 63 VAL HGx% A 61 LEU HBy 1.0 0.0 3.52 1422 1088 A 61 LEU HBy A 63 VAL HGy% 1.0 0.0 3.52 1423 1089 A 61 LEU HBy A 61 LEU HDy% 1.0 0.0 1.55 1424 1089 A 61 LEU HBx A 61 LEU HDy% 1.0 0.0 1.55 1425 1089 A 61 LEU HDx% A 61 LEU HBx 1.0 0.0 1.55 1426 1089 A 61 LEU HDx% A 61 LEU HBy 1.0 0.0 1.55 1427 1090 A 62 ASP H A 61 LEU HBx 1.0 0.0 4.16 1428 1090 A 61 LEU HBy A 62 ASP H 1.0 0.0 4.16 1429 1091 A 63 VAL HB A 61 LEU HBx 1.0 0.0 4.43 1430 1091 A 61 LEU HBy A 63 VAL HB 1.0 0.0 4.43 1431 1092 A 61 LEU HBx A 63 VAL HGy% 1.0 0.0 1.56 1432 1092 A 61 LEU HBy A 63 VAL HGy% 1.0 0.0 1.56 1433 1092 A 63 VAL HGx% A 61 LEU HBx 1.0 0.0 1.56 1434 1092 A 63 VAL HGx% A 61 LEU HBy 1.0 0.0 1.56 1435 1093 A 61 LEU HDx% A 62 ASP H 1.0 0.0 5.50 1436 1094 A 62 ASP H A 61 LEU HDy% 1.0 0.0 5.50 1437 1095 A 61 LEU H A 61 LEU HBx 1.0 0.0 3.66 1438 1096 A 61 LEU H A 61 LEU HBy 1.0 0.0 3.66 1439 1097 A 61 LEU HDx% A 61 LEU H 1.0 0.0 4.41 1440 1098 A 61 LEU H A 61 LEU HDy% 1.0 0.0 4.41 1441 1099 A 61 LEU H A 61 LEU HDy% 1.0 0.0 3.59 1442 1099 A 61 LEU HDx% A 61 LEU H 1.0 0.0 3.59 1443 1100 A 61 LEU H A 61 LEU HG 1.0 0.0 3.95 1444 1101 A 61 LEU H A 62 ASP H 1.0 0.0 2.91 1445 1102 A 61 LEU H A 63 VAL HGy% 1.0 0.0 4.61 1446 1102 A 61 LEU H A 63 VAL HGx% 1.0 0.0 4.61 1447 1103 A 61 LEU H A 63 VAL H 1.0 0.0 5.50 1448 1104 A 63 VAL HGx% A 62 ASP HBy 1.0 0.0 4.52 1449 1105 A 62 ASP HBy A 63 VAL HGy% 1.0 0.0 4.52 1450 1106 A 63 VAL HGx% A 62 ASP HBx 1.0 0.0 3.52 1451 1107 A 62 ASP HBx A 63 VAL HGy% 1.0 0.0 4.52 1452 1108 A 62 ASP HBy A 63 VAL HGy% 1.0 0.0 3.07 1453 1108 A 62 ASP HBx A 63 VAL HGy% 1.0 0.0 3.07 1454 1108 A 63 VAL HGx% A 62 ASP HBy 1.0 0.0 3.07 1455 1108 A 63 VAL HGx% A 62 ASP HBx 1.0 0.0 3.07 1456 1109 A 63 VAL H A 62 ASP H 1.0 0.0 3.74 1457 1110 A 63 VAL HA A 64 SER H 1.0 0.0 3.11 1458 1111 A 63 VAL HB A 64 SER HBx 1.0 0.0 5.34 1459 1111 A 63 VAL HB A 64 SER HBy 1.0 0.0 5.34 1460 1112 A 63 VAL HB A 64 SER H 1.0 0.0 4.02 1461 1113 A 63 VAL HGx% A 64 SER H 1.0 0.0 4.87 1462 1114 A 64 SER H A 63 VAL HGy% 1.0 0.0 4.87 1463 1115 A 63 VAL HGy% A 64 SER HBx 1.0 0.0 4.75 1464 1115 A 63 VAL HGx% A 64 SER HBx 1.0 0.0 4.75 1465 1115 A 64 SER HBy A 63 VAL HGy% 1.0 0.0 4.75 1466 1115 A 63 VAL HGx% A 64 SER HBy 1.0 0.0 4.75 1467 1116 A 64 SER H A 63 VAL HGy% 1.0 0.0 3.75 1468 1116 A 63 VAL HGx% A 64 SER H 1.0 0.0 3.75 1469 1117 A 63 VAL HGx% A 63 VAL H 1.0 0.0 4.42 1470 1118 A 63 VAL H A 63 VAL HGy% 1.0 0.0 4.42 1471 1119 A 63 VAL H A 63 VAL HGy% 1.0 0.0 3.68 1472 1119 A 63 VAL HGx% A 63 VAL H 1.0 0.0 3.68 1473 1120 A 63 VAL H A 64 SER H 1.0 0.0 5.50 1474 1121 A 65 LEU HG A 64 SER HA 1.0 0.0 5.50 1475 1122 A 65 LEU H A 64 SER HA 1.0 0.0 3.40 1476 1123 A 65 LEU HG A 64 SER HBx 1.0 0.0 5.34 1477 1123 A 65 LEU HG A 64 SER HBy 1.0 0.0 5.34 1478 1124 A 64 SER H A 64 SER HBx 1.0 0.0 3.42 1479 1124 A 64 SER H A 64 SER HBy 1.0 0.0 3.42 1480 1125 A 65 LEU HG A 64 SER H 1.0 0.0 5.19 1481 1126 A 65 LEU HA A 65 LEU HDy% 1.0 0.0 3.73 1482 1126 A 65 LEU HDx% A 65 LEU HA 1.0 0.0 3.73 1483 1127 A 65 LEU HA A 66 ASP H 1.0 0.0 3.16 1484 1128 A 65 LEU HDx% A 65 LEU HBx 1.0 0.0 3.52 1485 1129 A 65 LEU HBx A 65 LEU HDy% 1.0 0.0 3.52 1486 1130 A 65 LEU HDx% A 65 LEU HBy 1.0 0.0 3.52 1487 1131 A 65 LEU HBy A 65 LEU HDy% 1.0 0.0 3.52 1488 1132 A 65 LEU HBx A 65 LEU HDy% 1.0 0.0 1.57 1489 1132 A 65 LEU HDx% A 65 LEU HBx 1.0 0.0 1.57 1490 1132 A 65 LEU HDx% A 65 LEU HBy 1.0 0.0 1.57 1491 1132 A 65 LEU HBy A 65 LEU HDy% 1.0 0.0 1.57 1492 1133 A 65 LEU HG A 65 LEU HBx 1.0 0.0 2.48 1493 1133 A 65 LEU HG A 65 LEU HBy 1.0 0.0 2.48 1494 1134 A 66 ASP H A 65 LEU HBx 1.0 0.0 3.52 1495 1134 A 66 ASP H A 65 LEU HBy 1.0 0.0 3.52 1496 1135 A 65 LEU HDx% A 66 ASP H 1.0 0.0 4.94 1497 1136 A 66 ASP H A 65 LEU HDy% 1.0 0.0 4.94 1498 1137 A 65 LEU HDx% A 66 ASP HBx 1.0 0.0 5.24 1499 1137 A 65 LEU HDy% A 66 ASP HBx 1.0 0.0 5.24 1500 1137 A 66 ASP HBy A 65 LEU HDy% 1.0 0.0 5.24 1501 1137 A 65 LEU HDx% A 66 ASP HBy 1.0 0.0 5.24 1502 1138 A 66 ASP H A 65 LEU HDy% 1.0 0.0 3.97 1503 1138 A 65 LEU HDx% A 66 ASP H 1.0 0.0 3.97 1504 1139 A 70 ILE HA A 65 LEU HDy% 1.0 0.0 5.00 1505 1139 A 65 LEU HDx% A 70 ILE HA 1.0 0.0 5.00 1506 1140 A 70 ILE H A 65 LEU HDy% 1.0 0.0 5.44 1507 1140 A 65 LEU HDx% A 70 ILE H 1.0 0.0 5.44 1508 1141 A 65 LEU HDx% A 65 LEU H 1.0 0.0 5.13 1509 1142 A 65 LEU H A 65 LEU HDy% 1.0 0.0 5.13 1510 1143 A 65 LEU HG A 65 LEU H 1.0 0.0 4.37 1511 1144 A 66 ASP HA A 67 PRO HGy 1.0 0.0 5.35 1512 1145 A 66 ASP HA A 67 PRO HGx 1.0 0.0 5.35 1513 1146 A 66 ASP HA A 67 PRO HGy 1.0 0.0 4.53 1514 1146 A 66 ASP HA A 67 PRO HGx 1.0 0.0 4.53 1515 1147 A 66 ASP HA A 68 THR H 1.0 0.0 5.90 1516 1148 A 70 ILE HD1% A 66 ASP HA 1.0 0.0 4.51 1517 1149 A 69 LEU HDx% A 66 ASP HBx 1.0 0.0 3.52 1518 1150 A 66 ASP HBx A 69 LEU HDy% 1.0 0.0 4.52 1519 1151 A 66 ASP HBy A 69 LEU HDx% 1.0 0.0 3.52 1520 1152 A 66 ASP HBy A 69 LEU HDy% 1.0 0.0 3.52 1521 1153 A 66 ASP HBy A 67 PRO HBx 1.0 0.0 4.57 1522 1153 A 66 ASP HBx A 67 PRO HBx 1.0 0.0 4.57 1523 1153 A 67 PRO HBy A 66 ASP HBx 1.0 0.0 4.57 1524 1153 A 66 ASP HBy A 67 PRO HBy 1.0 0.0 4.57 1525 1154 A 66 ASP HBx A 67 PRO HDy 1.0 0.0 2.57 1526 1154 A 66 ASP HBy A 67 PRO HDy 1.0 0.0 2.57 1527 1154 A 67 PRO HDx A 66 ASP HBx 1.0 0.0 2.57 1528 1154 A 66 ASP HBy A 67 PRO HDx 1.0 0.0 2.57 1529 1155 A 68 THR H A 66 ASP HBx 1.0 0.0 4.75 1530 1155 A 66 ASP HBy A 68 THR H 1.0 0.0 4.75 1531 1156 A 66 ASP HBx A 69 LEU HBy 1.0 0.0 1.57 1532 1156 A 66 ASP HBy A 69 LEU HBy 1.0 0.0 1.57 1533 1156 A 69 LEU HBx A 66 ASP HBx 1.0 0.0 1.57 1534 1156 A 66 ASP HBy A 69 LEU HBx 1.0 0.0 1.57 1535 1157 A 66 ASP HBy A 69 LEU HDy% 1.0 0.0 2.57 1536 1157 A 66 ASP HBx A 69 LEU HDy% 1.0 0.0 2.57 1537 1157 A 69 LEU HDx% A 66 ASP HBx 1.0 0.0 2.57 1538 1157 A 66 ASP HBy A 69 LEU HDx% 1.0 0.0 2.57 1539 1158 A 69 LEU HG A 66 ASP HBx 1.0 0.0 5.34 1540 1158 A 66 ASP HBy A 69 LEU HG 1.0 0.0 5.34 1541 1159 A 66 ASP H A 66 ASP HBx 1.0 0.0 3.62 1542 1160 A 66 ASP H A 66 ASP HBy 1.0 0.0 3.62 1543 1161 A 66 ASP H A 67 PRO HDy 1.0 0.0 5.50 1544 1162 A 66 ASP H A 67 PRO HDx 1.0 0.0 5.50 1545 1163 A 66 ASP H A 69 LEU HDy% 1.0 0.0 5.44 1546 1163 A 66 ASP H A 69 LEU HDx% 1.0 0.0 5.44 1547 1164 A 67 PRO HA A 69 LEU H 1.0 0.0 5.32 1548 1165 A 67 PRO HA A 70 ILE HB 1.0 0.0 3.86 1549 1166 A 70 ILE HD1% A 67 PRO HA 1.0 0.0 4.53 1550 1167 A 67 PRO HA A 70 ILE HG1x 1.0 0.0 5.50 1551 1168 A 70 ILE HG2% A 67 PRO HA 1.0 0.0 5.50 1552 1169 A 70 ILE H A 67 PRO HA 1.0 0.0 4.12 1553 1170 A 70 ILE HD1% A 67 PRO HBx 1.0 0.0 4.90 1554 1170 A 70 ILE HD1% A 67 PRO HBy 1.0 0.0 4.90 1555 1171 A 68 THR H A 67 PRO HDy 1.0 0.0 4.13 1556 1171 A 68 THR H A 67 PRO HDx 1.0 0.0 4.13 1557 1172 A 68 THR HG2% A 67 PRO HGy 1.0 0.0 4.67 1558 1172 A 67 PRO HGx A 68 THR HG2% 1.0 0.0 4.67 1559 1173 A 68 THR H A 67 PRO HGy 1.0 0.0 4.14 1560 1173 A 67 PRO HGx A 68 THR H 1.0 0.0 4.14 1561 1174 A 68 THR HG2% A 68 THR HA 1.0 0.0 3.53 1562 1175 A 68 THR HG2% A 71 TRP HD1 1.0 0.0 5.50 1563 1176 A 68 THR HG2% A 71 TRP H 1.0 0.0 5.50 1564 1177 A 68 THR H A 68 THR HG1 1.0 0.0 4.47 1565 1178 A 68 THR H A 68 THR HG2% 1.0 0.0 3.96 1566 1179 A 68 THR H A 69 LEU H 1.0 0.0 3.68 1567 1180 A 69 LEU HDx% A 69 LEU HA 1.0 0.0 4.25 1568 1181 A 69 LEU HA A 69 LEU HDy% 1.0 0.0 4.25 1569 1182 A 69 LEU HA A 69 LEU HDy% 1.0 0.0 3.32 1570 1182 A 69 LEU HDx% A 69 LEU HA 1.0 0.0 3.32 1571 1183 A 69 LEU HG A 69 LEU HA 1.0 0.0 3.83 1572 1184 A 70 ILE HA A 69 LEU HA 1.0 0.0 5.20 1573 1185 A 69 LEU HA A 70 ILE HG1y 1.0 0.0 5.50 1574 1186 A 69 LEU HA A 72 ASP HBy 1.0 0.0 3.53 1575 1186 A 69 LEU HA A 72 ASP HBx 1.0 0.0 3.53 1576 1187 A 69 LEU HA A 72 ASP H 1.0 0.0 4.46 1577 1188 A 69 LEU HA A 73 HIS HD2 1.0 0.0 5.34 1578 1189 A 69 LEU HA A 73 HIS HE1 1.0 0.0 5.50 1579 1190 A 69 LEU HDx% A 69 LEU HBy 1.0 0.0 3.52 1580 1191 A 69 LEU HBy A 69 LEU HDy% 1.0 0.0 3.52 1581 1192 A 69 LEU HBx A 69 LEU HDx% 1.0 0.0 3.52 1582 1193 A 69 LEU HBx A 69 LEU HDy% 1.0 0.0 3.52 1583 1194 A 69 LEU HBy A 69 LEU HDy% 1.0 0.0 1.56 1584 1194 A 69 LEU HBx A 69 LEU HDy% 1.0 0.0 1.56 1585 1194 A 69 LEU HDx% A 69 LEU HBy 1.0 0.0 1.56 1586 1194 A 69 LEU HBx A 69 LEU HDx% 1.0 0.0 1.56 1587 1195 A 69 LEU HG A 69 LEU HBy 1.0 0.0 2.62 1588 1195 A 69 LEU HBx A 69 LEU HG 1.0 0.0 2.62 1589 1196 A 70 ILE H A 69 LEU HBy 1.0 0.0 4.07 1590 1196 A 70 ILE H A 69 LEU HBx 1.0 0.0 4.07 1591 1197 A 69 LEU HDx% A 73 HIS HD2 1.0 0.0 4.49 1592 1198 A 69 LEU HDx% A 73 HIS H 1.0 0.0 5.50 1593 1199 A 73 HIS HD2 A 69 LEU HDy% 1.0 0.0 4.49 1594 1200 A 73 HIS H A 69 LEU HDy% 1.0 0.0 5.50 1595 1201 A 70 ILE HA A 69 LEU HDy% 1.0 0.0 3.33 1596 1201 A 70 ILE HA A 69 LEU HDx% 1.0 0.0 3.33 1597 1202 A 70 ILE HG2% A 69 LEU HDy% 1.0 0.0 3.94 1598 1202 A 70 ILE HG2% A 69 LEU HDx% 1.0 0.0 3.94 1599 1203 A 70 ILE H A 69 LEU HDy% 1.0 0.0 5.44 1600 1203 A 70 ILE H A 69 LEU HDx% 1.0 0.0 5.44 1601 1204 A 69 LEU HDy% A 72 ASP HBy 1.0 0.0 2.75 1602 1204 A 69 LEU HDx% A 72 ASP HBy 1.0 0.0 2.75 1603 1204 A 72 ASP HBx A 69 LEU HDy% 1.0 0.0 2.75 1604 1204 A 69 LEU HDx% A 72 ASP HBx 1.0 0.0 2.75 1605 1205 A 69 LEU HDx% A 73 HIS HBx 1.0 0.0 2.72 1606 1205 A 69 LEU HDy% A 73 HIS HBx 1.0 0.0 2.72 1607 1205 A 73 HIS HBy A 69 LEU HDy% 1.0 0.0 2.72 1608 1205 A 69 LEU HDx% A 73 HIS HBy 1.0 0.0 2.72 1609 1206 A 73 HIS HD2 A 69 LEU HDy% 1.0 0.0 2.97 1610 1206 A 69 LEU HDx% A 73 HIS HD2 1.0 0.0 2.97 1611 1207 A 73 HIS HE1 A 69 LEU HDy% 1.0 0.0 4.52 1612 1207 A 69 LEU HDx% A 73 HIS HE1 1.0 0.0 4.52 1613 1208 A 73 HIS H A 69 LEU HDy% 1.0 0.0 4.62 1614 1208 A 69 LEU HDx% A 73 HIS H 1.0 0.0 4.62 1615 1209 A 69 LEU HG A 73 HIS HD2 1.0 0.0 4.36 1616 1210 A 69 LEU HG A 73 HIS HE1 1.0 0.0 5.50 1617 1211 A 69 LEU H A 69 LEU HBy 1.0 0.0 3.36 1618 1211 A 69 LEU HBx A 69 LEU H 1.0 0.0 3.36 1619 1212 A 69 LEU HDx% A 69 LEU H 1.0 0.0 5.15 1620 1213 A 69 LEU H A 69 LEU HDy% 1.0 0.0 5.15 1621 1214 A 69 LEU H A 69 LEU HDy% 1.0 0.0 4.22 1622 1214 A 69 LEU HDx% A 69 LEU H 1.0 0.0 4.22 1623 1215 A 69 LEU HG A 69 LEU H 1.0 0.0 4.74 1624 1216 A 70 ILE HD1% A 70 ILE HA 1.0 0.0 4.12 1625 1217 A 70 ILE HG2% A 70 ILE HA 1.0 0.0 3.86 1626 1218 A 70 ILE HD1% A 70 ILE HB 1.0 0.0 3.78 1627 1219 A 70 ILE HB A 71 TRP HD1 1.0 0.0 4.20 1628 1220 A 70 ILE HB A 71 TRP H 1.0 0.0 4.74 1629 1221 A 70 ILE HD1% A 71 TRP HD1 1.0 0.0 5.31 1630 1222 A 70 ILE HD1% A 71 TRP HE1 1.0 0.0 5.50 1631 1223 A 70 ILE HD1% A 71 TRP H 1.0 0.0 5.50 1632 1224 A 70 ILE HG2% A 70 ILE HD1% 1.0 0.0 2.70 1633 1225 A 70 ILE HG2% A 70 ILE HG1x 1.0 0.0 3.43 1634 1226 A 70 ILE HG2% A 71 TRP HA 1.0 0.0 4.40 1635 1227 A 70 ILE HG2% A 71 TRP HD1 1.0 0.0 4.99 1636 1228 A 70 ILE HG2% A 71 TRP H 1.0 0.0 4.40 1637 1229 A 70 ILE H A 70 ILE HB 1.0 0.0 3.30 1638 1230 A 70 ILE HD1% A 70 ILE H 1.0 0.0 4.26 1639 1231 A 70 ILE H A 70 ILE HG1y 1.0 0.0 4.30 1640 1232 A 70 ILE H A 70 ILE HG1x 1.0 0.0 4.05 1641 1233 A 70 ILE HG2% A 70 ILE H 1.0 0.0 4.30 1642 1234 A 70 ILE H A 71 TRP HBx 1.0 0.0 5.38 1643 1235 A 70 ILE H A 71 TRP HD1 1.0 0.0 5.50 1644 1236 A 70 ILE H A 71 TRP H 1.0 0.0 3.86 1645 1237 A 70 ILE H A 72 ASP H 1.0 0.0 4.28 1646 1238 A 71 TRP HD1 A 71 TRP HA 1.0 0.0 4.51 1647 1239 A 71 TRP HE3 A 71 TRP HA 1.0 0.0 3.66 1648 1240 A 71 TRP HZ3 A 71 TRP HA 1.0 0.0 5.50 1649 1241 A 73 HIS H A 71 TRP HA 1.0 0.0 5.50 1650 1242 A 72 ASP H A 71 TRP HBy 1.0 0.0 4.59 1651 1243 A 71 TRP HD1 A 71 TRP HBx 1.0 0.0 3.29 1652 1244 A 72 ASP H A 71 TRP HBx 1.0 0.0 4.39 1653 1245 A 71 TRP H A 71 TRP HBx 1.0 0.0 4.07 1654 1246 A 71 TRP H A 72 ASP H 1.0 0.0 3.75 1655 1247 A 73 HIS HE1 A 72 ASP HBy 1.0 0.0 5.27 1656 1248 A 73 HIS H A 72 ASP HBy 1.0 0.0 5.50 1657 1249 A 72 ASP HBx A 73 HIS HE1 1.0 0.0 5.27 1658 1250 A 72 ASP HBx A 73 HIS H 1.0 0.0 5.50 1659 1251 A 73 HIS HD2 A 72 ASP HBy 1.0 0.0 4.47 1660 1251 A 72 ASP HBx A 73 HIS HD2 1.0 0.0 4.47 1661 1252 A 73 HIS HE1 A 72 ASP HBy 1.0 0.0 4.58 1662 1252 A 72 ASP HBx A 73 HIS HE1 1.0 0.0 4.58 1663 1253 A 72 ASP H A 72 ASP HBy 1.0 0.0 4.09 1664 1254 A 72 ASP HBx A 72 ASP H 1.0 0.0 4.09 1665 1255 A 72 ASP H A 72 ASP HBy 1.0 0.0 3.42 1666 1255 A 72 ASP HBx A 72 ASP H 1.0 0.0 3.42 1667 1256 A 72 ASP H A 73 HIS H 1.0 0.0 3.70 1668 1257 A 73 HIS HD2 A 73 HIS HA 1.0 0.0 5.31 1669 1258 A 73 HIS HA A 74 PRO HDy 1.0 0.0 3.76 1670 1259 A 73 HIS HA A 74 PRO HDx 1.0 0.0 3.53 1671 1260 A 73 HIS HA A 75 THR H 1.0 0.0 5.50 1672 1261 A 73 HIS HA A 78 ALA HB% 1.0 0.0 4.41 1673 1262 A 73 HIS HA A 79 LEU HDy% 1.0 0.0 4.29 1674 1263 A 73 HIS HD2 A 73 HIS HBx 1.0 0.0 3.83 1675 1264 A 73 HIS HD2 A 73 HIS HBy 1.0 0.0 3.83 1676 1265 A 73 HIS HD2 A 73 HIS HBx 1.0 0.0 3.18 1677 1265 A 73 HIS HD2 A 73 HIS HBy 1.0 0.0 3.18 1678 1266 A 78 ALA HB% A 73 HIS HBx 1.0 0.0 3.62 1679 1266 A 73 HIS HBy A 78 ALA HB% 1.0 0.0 3.62 1680 1267 A 79 LEU HA A 73 HIS HBx 1.0 0.0 3.28 1681 1267 A 73 HIS HBy A 79 LEU HA 1.0 0.0 3.28 1682 1268 A 79 LEU HDx% A 73 HIS HBx 1.0 0.0 5.29 1683 1268 A 79 LEU HDx% A 73 HIS HBy 1.0 0.0 5.29 1684 1269 A 79 LEU HDy% A 73 HIS HBx 1.0 0.0 4.30 1685 1269 A 73 HIS HBy A 79 LEU HDy% 1.0 0.0 4.30 1686 1270 A 73 HIS HD2 A 78 ALA HB% 1.0 0.0 5.38 1687 1271 A 73 HIS HD2 A 79 LEU HDy% 1.0 0.0 5.02 1688 1272 A 73 HIS H A 74 PRO HDy 1.0 0.0 4.76 1689 1273 A 73 HIS H A 79 LEU HDy% 1.0 0.0 5.34 1690 1274 A 74 PRO HA A 78 ALA HB% 1.0 0.0 5.50 1691 1275 A 75 THR H A 74 PRO HBy 1.0 0.0 4.30 1692 1276 A 74 PRO HBx A 75 THR HA 1.0 0.0 4.58 1693 1277 A 74 PRO HDx A 75 THR HG1 1.0 0.0 5.50 1694 1278 A 75 THR HG2% A 74 PRO HDx 1.0 0.0 5.17 1695 1279 A 74 PRO HDx A 75 THR H 1.0 0.0 4.76 1696 1280 A 74 PRO HDx A 78 ALA HB% 1.0 0.0 3.67 1697 1281 A 74 PRO HDx A 79 LEU HDy% 1.0 0.0 5.50 1698 1282 A 75 THR HA A 74 PRO HGy 1.0 0.0 4.66 1699 1283 A 75 THR HG2% A 74 PRO HGy 1.0 0.0 4.24 1700 1284 A 76 ILE HD1% A 75 THR HA 1.0 0.0 5.28 1701 1285 A 76 ILE HG2% A 75 THR HA 1.0 0.0 5.50 1702 1286 A 77 ASP H A 75 THR HA 1.0 0.0 5.50 1703 1287 A 75 THR HA A 78 ALA HB% 1.0 0.0 5.50 1704 1288 A 75 THR HA A 78 ALA H 1.0 0.0 5.25 1705 1289 A 76 ILE H A 75 THR HB 1.0 0.0 3.56 1706 1290 A 77 ASP H A 75 THR HB 1.0 0.0 4.04 1707 1291 A 75 THR HB A 78 ALA H 1.0 0.0 5.39 1708 1292 A 75 THR HG1 A 77 ASP HBy 1.0 0.0 5.50 1709 1293 A 78 ALA HB% A 75 THR HG1 1.0 0.0 3.98 1710 1294 A 75 THR HG1 A 78 ALA H 1.0 0.0 5.50 1711 1295 A 76 ILE H A 75 THR HG2% 1.0 0.0 4.62 1712 1296 A 75 THR HG2% A 77 ASP HBy 1.0 0.0 5.50 1713 1297 A 75 THR H A 75 THR HG1 1.0 0.0 4.44 1714 1298 A 75 THR HG2% A 75 THR H 1.0 0.0 4.06 1715 1299 A 75 THR H A 78 ALA HB% 1.0 0.0 3.55 1716 1300 A 75 THR H A 78 ALA H 1.0 0.0 5.50 1717 1301 A 76 ILE HD1% A 76 ILE HA 1.0 0.0 4.33 1718 1302 A 76 ILE HA A 76 ILE HG1x 1.0 0.0 3.83 1719 1303 A 76 ILE HA A 76 ILE HG1y 1.0 0.0 3.83 1720 1304 A 76 ILE HA A 76 ILE HG1x 1.0 0.0 3.22 1721 1304 A 76 ILE HA A 76 ILE HG1y 1.0 0.0 3.22 1722 1305 A 76 ILE HG2% A 76 ILE HA 1.0 0.0 3.45 1723 1306 A 76 ILE HA A 79 LEU HBy 1.0 0.0 3.56 1724 1307 A 76 ILE HA A 79 LEU HBx 1.0 0.0 4.25 1725 1308 A 76 ILE HA A 79 LEU H 1.0 0.0 5.50 1726 1309 A 76 ILE HB A 77 ASP HBy 1.0 0.0 4.76 1727 1310 A 76 ILE HB A 77 ASP H 1.0 0.0 3.93 1728 1311 A 76 ILE HD1% A 77 ASP H 1.0 0.0 5.50 1729 1312 A 76 ILE HG2% A 76 ILE HD1% 1.0 0.0 2.47 1730 1313 A 76 ILE HG2% A 76 ILE HG1x 1.0 0.0 3.41 1731 1313 A 76 ILE HG2% A 76 ILE HG1y 1.0 0.0 3.41 1732 1314 A 76 ILE HG2% A 77 ASP HBy 1.0 0.0 5.12 1733 1315 A 76 ILE HG2% A 77 ASP H 1.0 0.0 4.11 1734 1316 A 76 ILE HB A 76 ILE H 1.0 0.0 3.36 1735 1317 A 76 ILE HD1% A 76 ILE H 1.0 0.0 4.33 1736 1318 A 76 ILE H A 76 ILE HG1x 1.0 0.0 4.43 1737 1319 A 76 ILE HG1y A 76 ILE H 1.0 0.0 4.43 1738 1320 A 76 ILE HG2% A 76 ILE H 1.0 0.0 4.15 1739 1321 A 77 ASP HBx A 78 ALA HA 1.0 0.0 4.47 1740 1322 A 78 ALA H A 77 ASP HBy 1.0 0.0 4.07 1741 1323 A 77 ASP H A 77 ASP HBy 1.0 0.0 3.39 1742 1324 A 77 ASP H A 78 ALA H 1.0 0.0 4.09 1743 1325 A 79 LEU HA A 78 ALA HA 1.0 0.0 4.85 1744 1326 A 78 ALA HA A 81 THR HB 1.0 0.0 3.84 1745 1327 A 78 ALA HA A 81 THR HG1 1.0 0.0 4.06 1746 1328 A 78 ALA HA A 81 THR H 1.0 0.0 4.82 1747 1329 A 78 ALA HB% A 79 LEU HBx 1.0 0.0 4.00 1748 1330 A 78 ALA HB% A 79 LEU H 1.0 0.0 4.25 1749 1331 A 78 ALA HB% A 81 THR HB 1.0 0.0 5.50 1750 1332 A 78 ALA HB% A 82 ALA H 1.0 0.0 5.50 1751 1333 A 78 ALA HB% A 78 ALA H 1.0 0.0 3.38 1752 1334 A 78 ALA H A 79 LEU H 1.0 0.0 3.84 1753 1335 A 79 LEU HDx% A 79 LEU HA 1.0 0.0 2.73 1754 1336 A 79 LEU HDy% A 79 LEU HA 1.0 0.0 2.90 1755 1337 A 79 LEU HG A 79 LEU HA 1.0 0.0 3.78 1756 1338 A 79 LEU HA A 82 ALA H 1.0 0.0 5.50 1757 1339 A 79 LEU HBy A 80 SER H 1.0 0.0 3.73 1758 1340 A 79 LEU HBy A 81 THR H 1.0 0.0 5.50 1759 1341 A 79 LEU HDx% A 79 LEU HBx 1.0 0.0 3.84 1760 1342 A 79 LEU HDy% A 79 LEU HBx 1.0 0.0 3.94 1761 1343 A 80 SER H A 79 LEU HBx 1.0 0.0 4.47 1762 1344 A 79 LEU HDx% A 80 SER H 1.0 0.0 4.17 1763 1345 A 79 LEU HDx% A 81 THR H 1.0 0.0 5.43 1764 1346 A 79 LEU HDx% A 82 ALA H 1.0 0.0 5.50 1765 1347 A 79 LEU HDy% A 82 ALA H 1.0 0.0 5.50 1766 1348 A 79 LEU HBy A 79 LEU H 1.0 0.0 3.54 1767 1349 A 79 LEU HBx A 79 LEU H 1.0 0.0 3.95 1768 1350 A 79 LEU HDx% A 79 LEU H 1.0 0.0 5.21 1769 1351 A 79 LEU HDy% A 79 LEU H 1.0 0.0 5.10 1770 1352 A 80 SER H A 79 LEU H 1.0 0.0 3.70 1771 1353 A 80 SER HA A 82 ALA HB% 1.0 0.0 5.12 1772 1354 A 81 THR H A 80 SER HBy 1.0 0.0 4.01 1773 1355 A 81 THR H A 80 SER HBx 1.0 0.0 4.01 1774 1356 A 80 SER H A 80 SER HBy 1.0 0.0 3.93 1775 1357 A 80 SER H A 80 SER HBx 1.0 0.0 3.93 1776 1358 A 80 SER H A 81 THR HA 1.0 0.0 5.50 1777 1359 A 80 SER H A 81 THR H 1.0 0.0 3.93 1778 1360 A 80 SER H A 82 ALA HB% 1.0 0.0 4.86 1779 1361 A 81 THR HA A 81 THR HG2% 1.0 0.0 4.01 1780 1362 A 81 THR HA A 83 LEU H 1.0 0.0 4.99 1781 1363 A 84 VAL HB A 81 THR HA 1.0 0.0 4.38 1782 1364 A 84 VAL HGx% A 81 THR HA 1.0 0.0 3.94 1783 1365 A 81 THR HA A 85 ALA HB% 1.0 0.0 4.63 1784 1366 A 81 THR HB A 82 ALA HB% 1.0 0.0 4.13 1785 1367 A 81 THR HB A 82 ALA H 1.0 0.0 4.22 1786 1368 A 84 VAL HGx% A 81 THR HB 1.0 0.0 4.44 1787 1369 A 81 THR HG1 A 82 ALA H 1.0 0.0 4.35 1788 1370 A 81 THR HG2% A 82 ALA HA 1.0 0.0 3.54 1789 1371 A 84 VAL HGx% A 81 THR HG2% 1.0 0.0 4.04 1790 1372 A 81 THR HG2% A 85 ALA HB% 1.0 0.0 3.27 1791 1373 A 81 THR HB A 81 THR H 1.0 0.0 3.69 1792 1374 A 81 THR HG1 A 81 THR H 1.0 0.0 4.72 1793 1375 A 81 THR H A 83 LEU H 1.0 0.0 4.46 1794 1376 A 84 VAL HGx% A 81 THR H 1.0 0.0 4.73 1795 1377 A 85 ALA HB% A 82 ALA HA 1.0 0.0 3.13 1796 1378 A 85 ALA H A 82 ALA HA 1.0 0.0 4.55 1797 1379 A 82 ALA HB% A 83 LEU H 1.0 0.0 3.52 1798 1380 A 82 ALA H A 82 ALA HB% 1.0 0.0 3.12 1799 1381 A 82 ALA H A 83 LEU HA 1.0 0.0 5.44 1800 1382 A 82 ALA H A 83 LEU H 1.0 0.0 3.58 1801 1383 A 82 ALA H A 85 ALA HB% 1.0 0.0 5.50 1802 1384 A 83 LEU HA A 83 LEU HDy% 1.0 0.0 2.84 1803 1384 A 83 LEU HDx% A 83 LEU HA 1.0 0.0 2.84 1804 1385 A 83 LEU HA A 83 LEU HG 1.0 0.0 2.98 1805 1386 A 83 LEU HA A 86 GLU HA 1.0 0.0 5.50 1806 1387 A 83 LEU HA A 86 GLU HBx 1.0 0.0 3.68 1807 1387 A 83 LEU HA A 86 GLU HBy 1.0 0.0 3.68 1808 1388 A 83 LEU HA A 86 GLU HGy 1.0 0.0 5.25 1809 1389 A 83 LEU HA A 86 GLU HGx 1.0 0.0 5.25 1810 1390 A 83 LEU HA A 86 GLU HGy 1.0 0.0 4.49 1811 1390 A 83 LEU HA A 86 GLU HGx 1.0 0.0 4.49 1812 1391 A 83 LEU HDx% A 83 LEU HBy 1.0 0.0 3.52 1813 1392 A 83 LEU HBy A 83 LEU HDy% 1.0 0.0 3.52 1814 1393 A 84 VAL H A 83 LEU HBy 1.0 0.0 4.99 1815 1394 A 83 LEU HBx A 83 LEU HDx% 1.0 0.0 3.52 1816 1395 A 83 LEU HBx A 83 LEU HDy% 1.0 0.0 3.52 1817 1396 A 84 VAL H A 83 LEU HBx 1.0 0.0 4.99 1818 1397 A 83 LEU HBy A 83 LEU HDy% 1.0 0.0 1.57 1819 1397 A 83 LEU HBx A 83 LEU HDy% 1.0 0.0 1.57 1820 1397 A 83 LEU HDx% A 83 LEU HBy 1.0 0.0 1.57 1821 1397 A 83 LEU HBx A 83 LEU HDx% 1.0 0.0 1.57 1822 1398 A 84 VAL H A 83 LEU HBy 1.0 0.0 4.22 1823 1398 A 84 VAL H A 83 LEU HBx 1.0 0.0 4.22 1824 1399 A 84 VAL H A 83 LEU HDx% 1.0 0.0 5.50 1825 1400 A 83 LEU HDx% A 86 GLU HGy 1.0 0.0 5.74 1826 1401 A 83 LEU HDx% A 86 GLU HGx 1.0 0.0 5.74 1827 1402 A 84 VAL H A 83 LEU HDy% 1.0 0.0 5.50 1828 1403 A 83 LEU HDy% A 86 GLU HGy 1.0 0.0 4.74 1829 1404 A 86 GLU HGx A 83 LEU HDy% 1.0 0.0 4.74 1830 1405 A 84 VAL HA A 83 LEU HDy% 1.0 0.0 5.44 1831 1405 A 84 VAL HA A 83 LEU HDx% 1.0 0.0 5.44 1832 1406 A 84 VAL H A 83 LEU HDy% 1.0 0.0 4.54 1833 1406 A 84 VAL H A 83 LEU HDx% 1.0 0.0 4.54 1834 1407 A 83 LEU HDx% A 86 GLU HBx 1.0 0.0 2.73 1835 1407 A 86 GLU HBy A 83 LEU HDy% 1.0 0.0 2.73 1836 1407 A 83 LEU HDx% A 86 GLU HBy 1.0 0.0 2.73 1837 1407 A 83 LEU HDy% A 86 GLU HBx 1.0 0.0 2.73 1838 1408 A 83 LEU HDx% A 86 GLU HGy 1.0 0.0 2.70 1839 1408 A 83 LEU HDy% A 86 GLU HGy 1.0 0.0 2.70 1840 1408 A 86 GLU HGx A 83 LEU HDy% 1.0 0.0 2.70 1841 1408 A 83 LEU HDx% A 86 GLU HGx 1.0 0.0 2.70 1842 1409 A 86 GLU H A 83 LEU HDy% 1.0 0.0 5.44 1843 1409 A 83 LEU HDx% A 86 GLU H 1.0 0.0 5.44 1844 1410 A 83 LEU H A 83 LEU HBy 1.0 0.0 3.44 1845 1410 A 83 LEU HBx A 83 LEU H 1.0 0.0 3.44 1846 1411 A 83 LEU HDx% A 83 LEU H 1.0 0.0 5.19 1847 1412 A 83 LEU H A 83 LEU HDy% 1.0 0.0 5.19 1848 1413 A 83 LEU H A 83 LEU HDy% 1.0 0.0 3.83 1849 1413 A 83 LEU HDx% A 83 LEU H 1.0 0.0 3.83 1850 1414 A 83 LEU H A 83 LEU HG 1.0 0.0 4.46 1851 1415 A 84 VAL HGx% A 83 LEU H 1.0 0.0 4.13 1852 1416 A 84 VAL H A 83 LEU H 1.0 0.0 3.45 1853 1417 A 84 VAL HGx% A 84 VAL HA 1.0 0.0 3.67 1854 1418 A 84 VAL HGy% A 84 VAL HA 1.0 0.0 4.03 1855 1419 A 84 VAL HA A 85 ALA HA 1.0 0.0 5.04 1856 1420 A 84 VAL HB A 85 ALA H 1.0 0.0 4.15 1857 1421 A 84 VAL HGx% A 85 ALA HA 1.0 0.0 3.49 1858 1422 A 84 VAL HGx% A 85 ALA HB% 1.0 0.0 3.67 1859 1423 A 84 VAL HGx% A 85 ALA H 1.0 0.0 4.27 1860 1424 A 84 VAL HGy% A 85 ALA HA 1.0 0.0 4.12 1861 1425 A 84 VAL HGy% A 88 ARG HA 1.0 0.0 5.50 1862 1426 A 84 VAL HGy% A 88 ARG HDy 1.0 0.0 5.50 1863 1427 A 84 VAL HGy% A 88 ARG HDx 1.0 0.0 5.50 1864 1428 A 84 VAL HGy% A 88 ARG HGy 1.0 0.0 5.17 1865 1428 A 84 VAL HGy% A 88 ARG HGx 1.0 0.0 5.17 1866 1429 A 84 VAL HB A 84 VAL H 1.0 0.0 3.40 1867 1430 A 84 VAL HGx% A 84 VAL H 1.0 0.0 3.32 1868 1431 A 84 VAL HGy% A 84 VAL H 1.0 0.0 4.94 1869 1432 A 84 VAL H A 85 ALA HB% 1.0 0.0 5.50 1870 1433 A 84 VAL H A 85 ALA H 1.0 0.0 3.77 1871 1434 A 85 ALA HA A 87 LEU H 1.0 0.0 4.11 1872 1435 A 85 ALA HA A 88 ARG HDy 1.0 0.0 5.50 1873 1436 A 85 ALA HA A 88 ARG HDx 1.0 0.0 5.50 1874 1437 A 85 ALA HA A 88 ARG HGy 1.0 0.0 4.41 1875 1437 A 85 ALA HA A 88 ARG HGx 1.0 0.0 4.41 1876 1438 A 85 ALA HA A 88 ARG H 1.0 0.0 4.30 1877 1439 A 85 ALA HA A 89 SER H 1.0 0.0 5.50 1878 1440 A 85 ALA HB% A 86 GLU HGy 1.0 0.0 4.34 1879 1440 A 85 ALA HB% A 86 GLU HGx 1.0 0.0 4.34 1880 1441 A 85 ALA HB% A 86 GLU H 1.0 0.0 3.78 1881 1442 A 85 ALA H A 85 ALA HB% 1.0 0.0 3.45 1882 1443 A 85 ALA H A 86 GLU H 1.0 0.0 3.14 1883 1444 A 85 ALA H A 87 LEU H 1.0 0.0 4.23 1884 1445 A 85 ALA H A 88 ARG HBx 1.0 0.0 5.34 1885 1445 A 85 ALA H A 88 ARG HBy 1.0 0.0 5.34 1886 1446 A 85 ALA H A 88 ARG HGy 1.0 0.0 5.34 1887 1446 A 85 ALA H A 88 ARG HGx 1.0 0.0 5.34 1888 1447 A 86 GLU HA A 86 GLU HGy 1.0 0.0 3.29 1889 1447 A 86 GLU HA A 86 GLU HGx 1.0 0.0 3.29 1890 1448 A 87 LEU H A 86 GLU HBx 1.0 0.0 4.13 1891 1448 A 86 GLU HBy A 87 LEU H 1.0 0.0 4.13 1892 1449 A 87 LEU H A 86 GLU HGy 1.0 0.0 5.34 1893 1449 A 86 GLU HGx A 87 LEU H 1.0 0.0 5.34 1894 1450 A 86 GLU H A 86 GLU HBx 1.0 0.0 3.96 1895 1451 A 86 GLU HBy A 86 GLU H 1.0 0.0 3.96 1896 1452 A 86 GLU H A 86 GLU HBx 1.0 0.0 3.37 1897 1452 A 86 GLU HBy A 86 GLU H 1.0 0.0 3.37 1898 1453 A 86 GLU H A 86 GLU HGy 1.0 0.0 4.18 1899 1454 A 86 GLU HGx A 86 GLU H 1.0 0.0 4.18 1900 1455 A 86 GLU H A 86 GLU HGy 1.0 0.0 3.39 1901 1455 A 86 GLU HGx A 86 GLU H 1.0 0.0 3.39 1902 1456 A 87 LEU HDx% A 87 LEU HA 1.0 0.0 4.65 1903 1457 A 87 LEU HA A 87 LEU HDy% 1.0 0.0 4.65 1904 1458 A 87 LEU HA A 87 LEU HDy% 1.0 0.0 4.02 1905 1458 A 87 LEU HDx% A 87 LEU HA 1.0 0.0 4.02 1906 1459 A 87 LEU HA A 87 LEU HG 1.0 0.0 3.93 1907 1460 A 87 LEU HDx% A 87 LEU HBx 1.0 0.0 3.20 1908 1461 A 87 LEU HBx A 87 LEU HDy% 1.0 0.0 3.20 1909 1462 A 87 LEU HDx% A 87 LEU HBy 1.0 0.0 3.20 1910 1463 A 87 LEU HBy A 87 LEU HDy% 1.0 0.0 3.20 1911 1464 A 87 LEU HBy A 87 LEU HDy% 1.0 0.0 1.56 1912 1464 A 87 LEU HBx A 87 LEU HDy% 1.0 0.0 1.56 1913 1464 A 87 LEU HDx% A 87 LEU HBx 1.0 0.0 1.56 1914 1464 A 87 LEU HDx% A 87 LEU HBy 1.0 0.0 1.56 1915 1465 A 88 ARG HA A 87 LEU HBx 1.0 0.0 5.34 1916 1465 A 87 LEU HBy A 88 ARG HA 1.0 0.0 5.34 1917 1466 A 88 ARG H A 87 LEU HBx 1.0 0.0 3.43 1918 1466 A 87 LEU HBy A 88 ARG H 1.0 0.0 3.43 1919 1467 A 87 LEU HDx% A 88 ARG H 1.0 0.0 5.50 1920 1468 A 88 ARG H A 87 LEU HDy% 1.0 0.0 5.50 1921 1469 A 88 ARG H A 87 LEU HDy% 1.0 0.0 4.78 1922 1469 A 87 LEU HDx% A 88 ARG H 1.0 0.0 4.78 1923 1470 A 87 LEU H A 87 LEU HBx 1.0 0.0 3.64 1924 1471 A 87 LEU HBy A 87 LEU H 1.0 0.0 3.64 1925 1472 A 87 LEU H A 87 LEU HBx 1.0 0.0 2.83 1926 1472 A 87 LEU HBy A 87 LEU H 1.0 0.0 2.83 1927 1473 A 87 LEU HDx% A 87 LEU H 1.0 0.0 5.50 1928 1474 A 87 LEU H A 87 LEU HDy% 1.0 0.0 5.50 1929 1475 A 87 LEU H A 87 LEU HDy% 1.0 0.0 4.60 1930 1475 A 87 LEU HDx% A 87 LEU H 1.0 0.0 4.60 1931 1476 A 87 LEU H A 87 LEU HG 1.0 0.0 5.50 1932 1477 A 88 ARG HA A 88 ARG HDy 1.0 0.0 5.48 1933 1478 A 88 ARG HA A 88 ARG HDx 1.0 0.0 5.48 1934 1479 A 88 ARG HA A 88 ARG HDy 1.0 0.0 4.67 1935 1479 A 88 ARG HA A 88 ARG HDx 1.0 0.0 4.67 1936 1480 A 88 ARG HA A 88 ARG HGy 1.0 0.0 3.58 1937 1480 A 88 ARG HA A 88 ARG HGx 1.0 0.0 3.58 1938 1481 A 89 SER H A 88 ARG HBy 1.0 0.0 5.09 1939 1482 A 89 SER H A 88 ARG HBx 1.0 0.0 5.09 1940 1483 A 89 SER H A 88 ARG HBx 1.0 0.0 4.41 1941 1483 A 89 SER H A 88 ARG HBy 1.0 0.0 4.41 1942 1484 A 88 ARG H A 88 ARG HBx 1.0 0.0 3.40 1943 1484 A 88 ARG H A 88 ARG HBy 1.0 0.0 3.40 1944 1485 A 88 ARG H A 88 ARG HDy 1.0 0.0 5.50 1945 1486 A 88 ARG H A 88 ARG HDx 1.0 0.0 5.50 1946 1487 A 88 ARG H A 88 ARG HDy 1.0 0.0 4.84 1947 1487 A 88 ARG H A 88 ARG HDx 1.0 0.0 4.84 1948 1488 A 88 ARG H A 88 ARG HGy 1.0 0.0 4.44 1949 1489 A 88 ARG HGx A 88 ARG H 1.0 0.0 4.44 1950 1490 A 90 ALA H A 89 SER HBy 1.0 0.0 5.50 1951 1491 A 90 ALA H A 89 SER HBx 1.0 0.0 5.50 1952 1492 A 89 SER H A 89 SER HBy 1.0 0.0 3.70 1953 1492 A 89 SER H A 89 SER HBx 1.0 0.0 3.70 1954 1493 A 89 SER H A 90 ALA HA 1.0 0.0 5.50 1955 1494 A 90 ALA H A 90 ALA HB% 1.0 0.0 3.56 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.restraint_origin hbond _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 16 ARG H A 12 LEU O 1.0 0.0 2.0 2 2 A 12 LEU O A 16 ARG N 1.0 0.0 3.0 3 3 A 17 VAL H A 13 ASP O 1.0 0.0 2.0 4 4 A 13 ASP O A 17 VAL N 1.0 0.0 3.0 5 5 A 18 TRP H A 14 SER O 1.0 0.0 2.0 6 6 A 14 SER O A 18 TRP N 1.0 0.0 3.0 7 7 A 19 LEU H A 15 LEU O 1.0 0.0 2.0 8 8 A 15 LEU O A 19 LEU N 1.0 0.0 3.0 9 9 A 20 VAL H A 16 ARG O 1.0 0.0 2.0 10 10 A 16 ARG O A 20 VAL N 1.0 0.0 3.0 11 11 A 21 ASP H A 17 VAL O 1.0 0.0 2.0 12 12 A 17 VAL O A 21 ASP N 1.0 0.0 3.0 13 13 A 22 CYS H A 18 TRP O 1.0 0.0 2.0 14 14 A 18 TRP O A 22 CYS N 1.0 0.0 3.0 15 15 A 23 VAL H A 19 LEU O 1.0 0.0 2.0 16 16 A 19 LEU O A 23 VAL N 1.0 0.0 3.0 17 17 A 24 ALA H A 20 VAL O 1.0 0.0 2.0 18 18 A 20 VAL O A 24 ALA N 1.0 0.0 3.0 19 19 A 25 GLY H A 21 ASP O 1.0 0.0 2.0 20 20 A 21 ASP O A 25 GLY N 1.0 0.0 3.0 21 21 A 26 HIS H A 22 CYS O 1.0 0.0 2.0 22 22 A 22 CYS O A 26 HIS N 1.0 0.0 3.0 23 23 A 33 THR H A 30 ASP O 1.0 0.0 2.0 24 24 A 30 ASP O A 33 THR N 1.0 0.0 3.0 25 25 A 34 ILE H A 31 ALA O 1.0 0.0 2.0 26 26 A 31 ALA O A 34 ILE N 1.0 0.0 3.0 27 27 A 42 SER H A 40 LEU O 1.0 0.0 3.0 28 28 A 40 LEU O A 42 SER N 1.0 0.0 3.0 29 29 A 53 ILE H A 49 TYR O 1.0 0.0 2.0 30 30 A 49 TYR O A 53 ILE N 1.0 0.0 3.0 31 31 A 54 ALA H A 50 ALA O 1.0 0.0 2.0 32 32 A 50 ALA O A 54 ALA N 1.0 0.0 3.0 33 33 A 55 ALA H A 51 LEU O 1.0 0.0 2.0 34 34 A 51 LEU O A 55 ALA N 1.0 0.0 3.0 35 35 A 56 GLU H A 52 SER O 1.0 0.0 2.0 36 36 A 52 SER O A 56 GLU N 1.0 0.0 3.0 37 37 A 57 LEU H A 53 ILE O 1.0 0.0 2.0 38 38 A 53 ILE O A 57 LEU N 1.0 0.0 3.0 39 39 A 58 GLU H A 54 ALA O 1.0 0.0 2.0 40 40 A 54 ALA O A 58 GLU N 1.0 0.0 3.0 41 41 A 59 ASP H A 55 ALA O 1.0 0.0 2.0 42 42 A 55 ALA O A 59 ASP N 1.0 0.0 3.0 43 43 A 60 HIS H A 56 GLU O 1.0 0.0 2.0 44 44 A 56 GLU O A 60 HIS N 1.0 0.0 3.0 45 45 A 69 LEU H A 67 PRO O 1.0 0.0 3.0 46 46 A 67 PRO O A 69 LEU N 1.0 0.0 3.0 47 47 A 80 SER H A 76 ILE O 1.0 0.0 2.0 48 48 A 76 ILE O A 80 SER N 1.0 0.0 3.0 49 49 A 81 THR H A 77 ASP O 1.0 0.0 2.0 50 50 A 77 ASP O A 81 THR N 1.0 0.0 3.0 51 51 A 82 ALA H A 78 ALA O 1.0 0.0 2.0 52 52 A 78 ALA O A 82 ALA N 1.0 0.0 3.0 53 53 A 83 LEU H A 79 LEU O 1.0 0.0 2.0 54 54 A 79 LEU O A 83 LEU N 1.0 0.0 3.0 55 55 A 84 VAL H A 80 SER O 1.0 0.0 2.0 56 56 A 80 SER O A 84 VAL N 1.0 0.0 3.0 57 57 A 85 ALA H A 81 THR O 1.0 0.0 2.0 58 58 A 81 THR O A 85 ALA N 1.0 0.0 3.0 59 59 A 86 GLU H A 82 ALA O 1.0 0.0 2.0 60 60 A 82 ALA O A 86 GLU N 1.0 0.0 3.0 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 10 PRO C A 11 THR N A 11 THR CA A 11 THR C 1.0 -118.0 -63.2 PHI 2 2 A 11 THR N A 11 THR CA A 11 THR C A 12 LEU N 1.0 146.8 186.8 PSI 3 3 A 11 THR C A 12 LEU N A 12 LEU CA A 12 LEU C 1.0 -81.2 -41.2 PHI 4 4 A 12 LEU N A 12 LEU CA A 12 LEU C A 13 ASP N 1.0 -61.3 -21.3 PSI 5 5 A 12 LEU C A 13 ASP N A 13 ASP CA A 13 ASP C 1.0 -80.5 -40.5 PHI 6 6 A 13 ASP N A 13 ASP CA A 13 ASP C A 14 SER N 1.0 -61.7 -21.7 PSI 7 7 A 13 ASP C A 14 SER N A 14 SER CA A 14 SER C 1.0 -86.2 -46.2 PHI 8 8 A 14 SER N A 14 SER CA A 14 SER C A 15 LEU N 1.0 -58.4 -18.4 PSI 9 9 A 14 SER C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -84.8 -44.8 PHI 10 10 A 15 LEU N A 15 LEU CA A 15 LEU C A 16 ARG N 1.0 -65.4 -25.4 PSI 11 11 A 15 LEU C A 16 ARG N A 16 ARG CA A 16 ARG C 1.0 -79.9 -39.9 PHI 12 12 A 16 ARG N A 16 ARG CA A 16 ARG C A 17 VAL N 1.0 -65.2 -25.2 PSI 13 13 A 16 ARG C A 17 VAL N A 17 VAL CA A 17 VAL C 1.0 -84.7 -44.7 PHI 14 14 A 17 VAL N A 17 VAL CA A 17 VAL C A 18 TRP N 1.0 -60.8 -20.8 PSI 15 15 A 17 VAL C A 18 TRP N A 18 TRP CA A 18 TRP C 1.0 -80.9 -40.9 PHI 16 16 A 18 TRP N A 18 TRP CA A 18 TRP C A 19 LEU N 1.0 -63.4 -23.4 PSI 17 17 A 18 TRP C A 19 LEU N A 19 LEU CA A 19 LEU C 1.0 -83.3 -43.3 PHI 18 18 A 19 LEU N A 19 LEU CA A 19 LEU C A 20 VAL N 1.0 -65.9 -25.9 PSI 19 19 A 19 LEU C A 20 VAL N A 20 VAL CA A 20 VAL C 1.0 -83.0 -43.0 PHI 20 20 A 20 VAL N A 20 VAL CA A 20 VAL C A 21 ASP N 1.0 -64.4 -24.4 PSI 21 21 A 20 VAL C A 21 ASP N A 21 ASP CA A 21 ASP C 1.0 -82.4 -42.4 PHI 22 22 A 21 ASP N A 21 ASP CA A 21 ASP C A 22 CYS N 1.0 -59.6 -19.6 PSI 23 23 A 21 ASP C A 22 CYS N A 22 CYS CA A 22 CYS C 1.0 -87.8 -47.8 PHI 24 24 A 22 CYS N A 22 CYS CA A 22 CYS C A 23 VAL N 1.0 -61.2 -21.2 PSI 25 25 A 22 CYS C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -83.9 -43.9 PHI 26 26 A 23 VAL N A 23 VAL CA A 23 VAL C A 24 ALA N 1.0 -62.9 -22.9 PSI 27 27 A 23 VAL C A 24 ALA N A 24 ALA CA A 24 ALA C 1.0 -84.7 -44.7 PHI 28 28 A 24 ALA N A 24 ALA CA A 24 ALA C A 25 GLY N 1.0 -54.0 -14.0 PSI 29 29 A 24 ALA C A 25 GLY N A 25 GLY CA A 25 GLY C 1.0 -86.1 -46.1 PHI 30 30 A 25 GLY N A 25 GLY CA A 25 GLY C A 26 HIS N 1.0 -66.1 -26.1 PSI 31 31 A 25 GLY C A 26 HIS N A 26 HIS CA A 26 HIS C 1.0 -91.1 -51.1 PHI 32 32 A 26 HIS N A 26 HIS CA A 26 HIS C A 27 LEU N 1.0 -53.1 3.9 PSI 33 33 A 26 HIS C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -118.6 -58.2 PHI 34 34 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 GLY N 1.0 -27.7 23.5 PSI 35 35 A 27 LEU C A 28 GLY N A 28 GLY CA A 28 GLY C 1.0 53.0 99.0 PHI 36 36 A 28 GLY N A 28 GLY CA A 28 GLY C A 29 LEU N 1.0 -0.7 56.7 PSI 37 37 A 28 GLY C A 29 LEU N A 29 LEU CA A 29 LEU C 1.0 -144.5 -73.5 PHI 38 38 A 29 LEU N A 29 LEU CA A 29 LEU C A 30 ASP N 1.0 138.4 178.4 PSI 39 39 A 30 ASP C A 31 ALA N A 31 ALA CA A 31 ALA C 1.0 -88.3 -48.3 PHI 40 40 A 31 ALA N A 31 ALA CA A 31 ALA C A 32 ALA N 1.0 -49.8 11.4 PSI 41 41 A 31 ALA C A 32 ALA N A 32 ALA CA A 32 ALA C 1.0 -81.3 -41.3 PHI 42 42 A 32 ALA N A 32 ALA CA A 32 ALA C A 33 THR N 1.0 -51.9 -11.9 PSI 43 43 A 32 ALA C A 33 THR N A 33 THR CA A 33 THR C 1.0 -143.5 -55.5 PHI 44 44 A 33 THR N A 33 THR CA A 33 THR C A 34 ILE N 1.0 -62.8 41.4 PSI 45 45 A 33 THR C A 34 ILE N A 34 ILE CA A 34 ILE C 1.0 -133.3 -29.1 PHI 46 46 A 34 ILE N A 34 ILE CA A 34 ILE C A 35 ALA N 1.0 -74.0 44.6 PSI 47 47 A 35 ALA C A 36 THR N A 36 THR CA A 36 THR C 1.0 -81.6 -41.6 PHI 48 48 A 36 THR N A 36 THR CA A 36 THR C A 37 ASP N 1.0 -47.7 2.3 PSI 49 49 A 36 THR C A 37 ASP N A 37 ASP CA A 37 ASP C 1.0 -121.9 -80.9 PHI 50 50 A 37 ASP N A 37 ASP CA A 37 ASP C A 38 LEU N 1.0 -44.1 46.7 PSI 51 51 A 37 ASP C A 38 LEU N A 38 LEU CA A 38 LEU C 1.0 -147.9 -89.9 PHI 52 52 A 38 LEU N A 38 LEU CA A 38 LEU C A 39 PRO N 1.0 39.8 178.2 PSI 53 53 A 39 PRO C A 40 LEU N A 40 LEU CA A 40 LEU C 1.0 -72.1 -31.3 PHI 54 54 A 40 LEU N A 40 LEU CA A 40 LEU C A 41 THR N 1.0 -64.1 -22.3 PSI 55 55 A 40 LEU C A 41 THR N A 41 THR CA A 41 THR C 1.0 -83.9 -43.9 PHI 56 56 A 41 THR N A 41 THR CA A 41 THR C A 42 SER N 1.0 -58.1 -18.1 PSI 57 57 A 41 THR C A 42 SER N A 42 SER CA A 42 SER C 1.0 -85.0 -45.0 PHI 58 58 A 42 SER N A 42 SER CA A 42 SER C A 43 TYR N 1.0 -63.6 -0.2 PSI 59 59 A 43 TYR C A 44 GLY N A 44 GLY CA A 44 GLY C 1.0 65.6 121.0 PHI 60 60 A 44 GLY N A 44 GLY CA A 44 GLY C A 45 LEU N 1.0 -49.4 29.0 PSI 61 61 A 44 GLY C A 45 LEU N A 45 LEU CA A 45 LEU C 1.0 -94.4 -54.4 PHI 62 62 A 45 LEU N A 45 LEU CA A 45 LEU C A 46 ASP N 1.0 122.0 162.0 PSI 63 63 A 45 LEU C A 46 ASP N A 46 ASP CA A 46 ASP C 1.0 -149.8 -51.6 PHI 64 64 A 46 ASP N A 46 ASP CA A 46 ASP C A 47 SER N 1.0 99.5 212.7 PSI 65 65 A 46 ASP C A 47 SER N A 47 SER CA A 47 SER C 1.0 -88.0 -39.4 PHI 66 66 A 47 SER N A 47 SER CA A 47 SER C A 48 VAL N 1.0 -57.4 -17.4 PSI 67 67 A 47 SER C A 48 VAL N A 48 VAL CA A 48 VAL C 1.0 -85.8 -45.8 PHI 68 68 A 48 VAL N A 48 VAL CA A 48 VAL C A 49 TYR N 1.0 -65.7 -25.7 PSI 69 69 A 48 VAL C A 49 TYR N A 49 TYR CA A 49 TYR C 1.0 -80.7 -40.7 PHI 70 70 A 49 TYR N A 49 TYR CA A 49 TYR C A 50 ALA N 1.0 -61.3 -21.3 PSI 71 71 A 49 TYR C A 50 ALA N A 50 ALA CA A 50 ALA C 1.0 -85.4 -45.4 PHI 72 72 A 50 ALA N A 50 ALA CA A 50 ALA C A 51 LEU N 1.0 -61.3 -21.3 PSI 73 73 A 50 ALA C A 51 LEU N A 51 LEU CA A 51 LEU C 1.0 -81.8 -41.8 PHI 74 74 A 51 LEU N A 51 LEU CA A 51 LEU C A 52 SER N 1.0 -64.3 -24.3 PSI 75 75 A 51 LEU C A 52 SER N A 52 SER CA A 52 SER C 1.0 -86.4 -46.4 PHI 76 76 A 52 SER N A 52 SER CA A 52 SER C A 53 ILE N 1.0 -57.1 -17.1 PSI 77 77 A 52 SER C A 53 ILE N A 53 ILE CA A 53 ILE C 1.0 -83.7 -43.7 PHI 78 78 A 53 ILE N A 53 ILE CA A 53 ILE C A 54 ALA N 1.0 -62.4 -22.4 PSI 79 79 A 53 ILE C A 54 ALA N A 54 ALA CA A 54 ALA C 1.0 -83.1 -43.1 PHI 80 80 A 54 ALA N A 54 ALA CA A 54 ALA C A 55 ALA N 1.0 -59.6 -19.6 PSI 81 81 A 54 ALA C A 55 ALA N A 55 ALA CA A 55 ALA C 1.0 -81.1 -41.1 PHI 82 82 A 55 ALA N A 55 ALA CA A 55 ALA C A 56 GLU N 1.0 -64.7 -24.7 PSI 83 83 A 55 ALA C A 56 GLU N A 56 GLU CA A 56 GLU C 1.0 -84.3 -44.3 PHI 84 84 A 56 GLU N A 56 GLU CA A 56 GLU C A 57 LEU N 1.0 -63.4 -23.4 PSI 85 85 A 56 GLU C A 57 LEU N A 57 LEU CA A 57 LEU C 1.0 -84.1 -44.1 PHI 86 86 A 57 LEU N A 57 LEU CA A 57 LEU C A 58 GLU N 1.0 -62.1 -22.1 PSI 87 87 A 57 LEU C A 58 GLU N A 58 GLU CA A 58 GLU C 1.0 -85.1 -45.1 PHI 88 88 A 58 GLU N A 58 GLU CA A 58 GLU C A 59 ASP N 1.0 -58.5 -18.5 PSI 89 89 A 58 GLU C A 59 ASP N A 59 ASP CA A 59 ASP C 1.0 -83.0 -43.0 PHI 90 90 A 59 ASP N A 59 ASP CA A 59 ASP C A 60 HIS N 1.0 -62.1 6.7 PSI 91 91 A 59 ASP C A 60 HIS N A 60 HIS CA A 60 HIS C 1.0 -95.5 -45.5 PHI 92 92 A 60 HIS N A 60 HIS CA A 60 HIS C A 61 LEU N 1.0 -53.2 -10.6 PSI 93 93 A 60 HIS C A 61 LEU N A 61 LEU CA A 61 LEU C 1.0 -123.2 -78.8 PHI 94 94 A 61 LEU N A 61 LEU CA A 61 LEU C A 62 ASP N 1.0 -49.7 31.3 PSI 95 95 A 61 LEU C A 62 ASP N A 62 ASP CA A 62 ASP C 1.0 42.4 94.4 PHI 96 96 A 62 ASP N A 62 ASP CA A 62 ASP C A 63 VAL N 1.0 5.7 68.9 PSI 97 97 A 62 ASP C A 63 VAL N A 63 VAL CA A 63 VAL C 1.0 -159.0 -109.4 PHI 98 98 A 63 VAL N A 63 VAL CA A 63 VAL C A 64 SER N 1.0 144.1 185.1 PSI 99 99 A 63 VAL C A 64 SER N A 64 SER CA A 64 SER C 1.0 -158.2 -77.6 PHI 100 100 A 64 SER N A 64 SER CA A 64 SER C A 65 LEU N 1.0 106.1 160.5 PSI 101 101 A 64 SER C A 65 LEU N A 65 LEU CA A 65 LEU C 1.0 -165.4 -72.6 PHI 102 102 A 65 LEU N A 65 LEU CA A 65 LEU C A 66 ASP N 1.0 103.7 181.5 PSI 103 103 A 65 LEU C A 66 ASP N A 66 ASP CA A 66 ASP C 1.0 -97.0 -53.2 PHI 104 104 A 66 ASP N A 66 ASP CA A 66 ASP C A 67 PRO N 1.0 98.3 175.9 PSI 105 105 A 67 PRO C A 68 THR N A 68 THR CA A 68 THR C 1.0 -88.2 -48.2 PHI 106 106 A 68 THR N A 68 THR CA A 68 THR C A 69 LEU N 1.0 -56.1 -10.5 PSI 107 107 A 68 THR C A 69 LEU N A 69 LEU CA A 69 LEU C 1.0 -84.9 -44.9 PHI 108 108 A 69 LEU N A 69 LEU CA A 69 LEU C A 70 ILE N 1.0 -65.8 -9.0 PSI 109 109 A 69 LEU C A 70 ILE N A 70 ILE CA A 70 ILE C 1.0 -93.3 -48.1 PHI 110 110 A 70 ILE N A 70 ILE CA A 70 ILE C A 71 TRP N 1.0 -60.1 -2.5 PSI 111 111 A 70 ILE C A 71 TRP N A 71 TRP CA A 71 TRP C 1.0 -113.9 -34.1 PHI 112 112 A 71 TRP N A 71 TRP CA A 71 TRP C A 72 ASP N 1.0 -63.9 -5.3 PSI 113 113 A 71 TRP C A 72 ASP N A 72 ASP CA A 72 ASP C 1.0 -101.3 -54.7 PHI 114 114 A 72 ASP N A 72 ASP CA A 72 ASP C A 73 HIS N 1.0 -74.3 23.9 PSI 115 115 A 72 ASP C A 73 HIS N A 73 HIS CA A 73 HIS C 1.0 -150.9 -86.5 PHI 116 116 A 73 HIS N A 73 HIS CA A 73 HIS C A 74 PRO N 1.0 32.3 125.1 PSI 117 117 A 74 PRO C A 75 THR N A 75 THR CA A 75 THR C 1.0 -151.0 -59.6 PHI 118 118 A 75 THR N A 75 THR CA A 75 THR C A 76 ILE N 1.0 138.2 178.2 PSI 119 119 A 75 THR C A 76 ILE N A 76 ILE CA A 76 ILE C 1.0 -87.1 -47.1 PHI 120 120 A 76 ILE N A 76 ILE CA A 76 ILE C A 77 ASP N 1.0 -53.1 -13.1 PSI 121 121 A 76 ILE C A 77 ASP N A 77 ASP CA A 77 ASP C 1.0 -87.2 -47.2 PHI 122 122 A 77 ASP N A 77 ASP CA A 77 ASP C A 78 ALA N 1.0 -60.3 -20.3 PSI 123 123 A 77 ASP C A 78 ALA N A 78 ALA CA A 78 ALA C 1.0 -85.7 -45.7 PHI 124 124 A 78 ALA N A 78 ALA CA A 78 ALA C A 79 LEU N 1.0 -58.9 -18.9 PSI 125 125 A 78 ALA C A 79 LEU N A 79 LEU CA A 79 LEU C 1.0 -86.7 -46.7 PHI 126 126 A 79 LEU N A 79 LEU CA A 79 LEU C A 80 SER N 1.0 -54.7 4.5 PSI 127 127 A 79 LEU C A 80 SER N A 80 SER CA A 80 SER C 1.0 -122.6 -35.8 PHI 128 128 A 80 SER N A 80 SER CA A 80 SER C A 81 THR N 1.0 -88.7 45.1 PSI 129 129 A 80 SER C A 81 THR N A 81 THR CA A 81 THR C 1.0 -83.3 -43.3 PHI 130 130 A 81 THR N A 81 THR CA A 81 THR C A 82 ALA N 1.0 -60.4 -20.4 PSI 131 131 A 81 THR C A 82 ALA N A 82 ALA CA A 82 ALA C 1.0 -84.2 -44.2 PHI 132 132 A 82 ALA N A 82 ALA CA A 82 ALA C A 83 LEU N 1.0 -60.4 -20.4 PSI 133 133 A 82 ALA C A 83 LEU N A 83 LEU CA A 83 LEU C 1.0 -83.5 -43.5 PHI 134 134 A 83 LEU N A 83 LEU CA A 83 LEU C A 84 VAL N 1.0 -64.9 -24.9 PSI 135 135 A 83 LEU C A 84 VAL N A 84 VAL CA A 84 VAL C 1.0 -84.9 -44.9 PHI 136 136 A 84 VAL N A 84 VAL CA A 84 VAL C A 85 ALA N 1.0 -59.5 -19.5 PSI 137 137 A 84 VAL C A 85 ALA N A 85 ALA CA A 85 ALA C 1.0 -79.6 -39.6 PHI 138 138 A 85 ALA N A 85 ALA CA A 85 ALA C A 86 GLU N 1.0 -65.9 -25.9 PSI 139 139 A 85 ALA C A 86 GLU N A 86 GLU CA A 86 GLU C 1.0 -100.6 -41.8 PHI 140 140 A 86 GLU N A 86 GLU CA A 86 GLU C A 87 LEU N 1.0 -60.3 -20.3 PSI 141 141 A 86 GLU C A 87 LEU N A 87 LEU CA A 87 LEU C 1.0 -109.1 -30.9 PHI 142 142 A 87 LEU N A 87 LEU CA A 87 LEU C A 88 ARG N 1.0 -60.4 -19.8 PSI stop_ save_ save_CNS/XPLOR_dipolar_coupling_3 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_3 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 4 SER N A 4 SER H 1.0 . . . 2 2 A 5 ASP N A 5 ASP H 1.0 . . . 3 3 A 6 LEU N A 6 LEU H 1.0 . . . 4 4 A 7 SER N A 7 SER H 1.0 . . . 5 5 A 8 THR N A 8 THR H 1.0 . . . 6 6 A 9 ALA N A 9 ALA H 1.0 . . . 7 7 A 11 THR N A 11 THR H 1.0 . . . 8 8 A 12 LEU N A 12 LEU H 1.0 . . . 9 9 A 13 ASP N A 13 ASP H 1.0 . . . 10 10 A 14 SER N A 14 SER H 1.0 . . . 11 11 A 15 LEU N A 15 LEU H 1.0 . . . 12 12 A 16 ARG N A 16 ARG H 1.0 . . . 13 13 A 17 VAL N A 17 VAL H 1.0 . . . 14 14 A 18 TRP N A 18 TRP H 1.0 . . . 15 15 A 19 LEU N A 19 LEU H 1.0 . . . 16 16 A 20 VAL N A 20 VAL H 1.0 . . . 17 17 A 21 ASP N A 21 ASP H 1.0 . . . 18 18 A 22 CYS N A 22 CYS H 1.0 . . . 19 19 A 23 VAL N A 23 VAL H 1.0 . . . 20 20 A 24 ALA N A 24 ALA H 1.0 . . . 21 21 A 25 GLY N A 25 GLY H 1.0 . . . 22 22 A 26 HIS N A 26 HIS H 1.0 . . . 23 23 A 27 LEU N A 27 LEU H 1.0 . . . 24 24 A 28 GLY N A 28 GLY H 1.0 . . . 25 25 A 29 LEU N A 29 LEU H 1.0 . . . 26 26 A 30 ASP N A 30 ASP H 1.0 . . . 27 27 A 31 ALA N A 31 ALA H 1.0 . . . 28 28 A 32 ALA N A 32 ALA H 1.0 . . . 29 29 A 33 THR N A 33 THR H 1.0 . . . 30 30 A 34 ILE N A 34 ILE H 1.0 . . . 31 31 A 35 ALA N A 35 ALA H 1.0 . . . 32 32 A 36 THR N A 36 THR H 1.0 . . . 33 33 A 37 ASP N A 37 ASP H 1.0 . . . 34 34 A 38 LEU N A 38 LEU H 1.0 . . . 35 35 A 40 LEU N A 40 LEU H 1.0 . . . 36 36 A 41 THR N A 41 THR H 1.0 . . . 37 37 A 42 SER N A 42 SER H 1.0 . . . 38 38 A 43 TYR N A 43 TYR H 1.0 . . . 39 39 A 44 GLY N A 44 GLY H 1.0 . . . 40 40 A 45 LEU N A 45 LEU H 1.0 . . . 41 41 A 46 ASP N A 46 ASP H 1.0 . . . 42 42 A 47 SER N A 47 SER H 1.0 . . . 43 43 A 48 VAL N A 48 VAL H 1.0 . . . 44 44 A 49 TYR N A 49 TYR H 1.0 . . . 45 45 A 50 ALA N A 50 ALA H 1.0 . . . 46 46 A 51 LEU N A 51 LEU H 1.0 . . . 47 47 A 52 SER N A 52 SER H 1.0 . . . 48 48 A 53 ILE N A 53 ILE H 1.0 . . . 49 49 A 54 ALA N A 54 ALA H 1.0 . . . 50 50 A 55 ALA N A 55 ALA H 1.0 . . . 51 51 A 56 GLU N A 56 GLU H 1.0 . . . 52 52 A 57 LEU N A 57 LEU H 1.0 . . . 53 53 A 58 GLU N A 58 GLU H 1.0 . . . 54 54 A 59 ASP N A 59 ASP H 1.0 . . . 55 55 A 60 HIS N A 60 HIS H 1.0 . . . 56 56 A 61 LEU N A 61 LEU H 1.0 . . . 57 57 A 62 ASP N A 62 ASP H 1.0 . . . 58 58 A 63 VAL N A 63 VAL H 1.0 . . . 59 59 A 64 SER N A 64 SER H 1.0 . . . 60 60 A 65 LEU N A 65 LEU H 1.0 . . . 61 61 A 66 ASP N A 66 ASP H 1.0 . . . 62 62 A 68 THR N A 68 THR H 1.0 . . . 63 63 A 69 LEU N A 69 LEU H 1.0 . . . 64 64 A 70 ILE N A 70 ILE H 1.0 . . . 65 65 A 71 TRP N A 71 TRP H 1.0 . . . 66 66 A 72 ASP N A 72 ASP H 1.0 . . . 67 67 A 73 HIS N A 73 HIS H 1.0 . . . 68 68 A 75 THR N A 75 THR H 1.0 . . . 69 69 A 76 ILE N A 76 ILE H 1.0 . . . 70 70 A 77 ASP N A 77 ASP H 1.0 . . . 71 71 A 78 ALA N A 78 ALA H 1.0 . . . 72 72 A 79 LEU N A 79 LEU H 1.0 . . . 73 73 A 80 SER N A 80 SER H 1.0 . . . 74 74 A 81 THR N A 81 THR H 1.0 . . . 75 75 A 82 ALA N A 82 ALA H 1.0 . . . 76 76 A 83 LEU N A 83 LEU H 1.0 . . . 77 77 A 84 VAL N A 84 VAL H 1.0 . . . 78 78 A 85 ALA N A 85 ALA H 1.0 . . . 79 79 A 86 GLU N A 86 GLU H 1.0 . . . 80 80 A 87 LEU N A 87 LEU H 1.0 . . . 81 81 A 88 ARG N A 88 ARG H 1.0 . . . 82 82 A 89 SER N A 89 SER H 1.0 . . . 83 83 A 90 ALA N A 90 ALA H 1.0 . . . stop_ save_