data_nef_c18437_2lsm save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 72 PRO start . false 2 A 73 ASP middle . . 3 A 74 THR middle . . 4 A 75 VAL middle . . 5 A 76 ILE middle . . 6 A 77 LEU middle . . 7 A 78 ASP middle . . 8 A 79 THR middle . . 9 A 80 SER middle . . 10 A 81 GLU middle . . 11 A 82 LEU middle . . 12 A 83 VAL middle . . 13 A 84 THR middle . . 14 A 85 VAL middle . . 15 A 86 VAL middle . . 16 A 87 ALA middle . . 17 A 88 LEU middle . . 18 A 89 VAL middle . . 19 A 90 LYS middle . . 20 A 91 LEU middle . . 21 A 92 HIS middle . . 22 A 93 THR middle . . 23 A 94 ASP middle . . 24 A 95 ALA middle . . 25 A 96 LEU middle . . 26 A 97 HIS middle . . 27 A 98 ALA middle . . 28 A 99 THR middle . . 29 A 100 ARG middle . . 30 A 101 ASP middle . . 31 A 102 GLU middle . . 32 A 103 PRO middle . false 33 A 104 VAL middle . . 34 A 105 ALA middle . . 35 A 106 PHE middle . . 36 A 107 VAL middle . . 37 A 108 LEU middle . . 38 A 109 PRO middle . false 39 A 110 GLY middle . false 40 A 111 THR middle . . 41 A 112 ALA middle . . 42 A 113 PHE middle . . 43 A 114 ARG middle . . 44 A 115 VAL middle . . 45 A 116 SER middle . . 46 A 117 ALA middle . . 47 A 118 GLY middle . false 48 A 119 VAL middle . . 49 A 120 ALA middle . . 50 A 121 ALA middle . . 51 A 122 GLU middle . . 52 A 123 MET middle . . 53 A 124 THR middle . . 54 A 125 GLU middle . . 55 A 126 ARG middle . . 56 A 127 GLY middle . false 57 A 128 LEU middle . . 58 A 129 ALA middle . . 59 A 130 ARG middle . . 60 A 131 MET middle . . 61 A 132 GLN 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 72 PRO HA H 1 4.417 0.003 A 72 PRO HBy H 1 2.297 0.012 A 72 PRO HBx H 1 1.88 0 A 72 PRO HDx H 1 3.649 0 A 72 PRO HDy H 1 3.856 0 A 72 PRO HGx H 1 2.036 0.014 A 72 PRO HGy H 1 2.036 0.014 A 72 PRO CA C 13 63.196 0 A 72 PRO CB C 13 32.047 0 A 72 PRO CD C 13 50.999 0 A 72 PRO CG C 13 27.6 0 A 73 ASP H H 1 8.508 0.002 A 73 ASP HA H 1 4.62 0.004 A 73 ASP HBx H 1 2.69 0.015 A 73 ASP HBy H 1 2.729 0.003 A 73 ASP CA C 13 54.246 0 A 73 ASP CB C 13 41.077 0 A 73 ASP N N 15 119.729 0 A 74 THR H H 1 8.047 0.002 A 74 THR HA H 1 4.328 0.003 A 74 THR HB H 1 4.177 0.003 A 74 THR HG2% H 1 1.198 0.003 A 74 THR CA C 13 62.046 0 A 74 THR CB C 13 69.779 0 A 74 THR CG2 C 13 21.627 0 A 74 THR N N 15 114.613 0.01 A 75 VAL H H 1 8.225 0.004 A 75 VAL HA H 1 4.123 0.003 A 75 VAL HB H 1 2.057 0.003 A 75 VAL HGx% H 1 0.944 0.006 A 75 VAL HGy% H 1 0.901 0.003 A 75 VAL CA C 13 62.272 0 A 75 VAL CB C 13 32.873 0 A 75 VAL CGx C 13 20.828 0 A 75 VAL CGy C 13 21.281 0 A 75 VAL N N 15 123.803 0 A 76 ILE H H 1 8.349 0.003 A 76 ILE HA H 1 4.172 0.002 A 76 ILE HB H 1 1.841 0.004 A 76 ILE HD1% H 1 0.841 0 A 76 ILE HG1y H 1 1.489 0.003 A 76 ILE HG1x H 1 1.18 0.004 A 76 ILE HG2% H 1 0.875 0 A 76 ILE CA C 13 60.469 0 A 76 ILE CB C 13 38.57 0 A 76 ILE CD1 C 13 12.701 0 A 76 ILE CG1 C 13 27.183 0 A 76 ILE CG2 C 13 17.377 0 A 76 ILE N N 15 126.05 0 A 77 LEU H H 1 8.408 0 A 77 LEU HA H 1 4.374 0.003 A 77 LEU HBx H 1 1.564 0 A 77 LEU HBy H 1 1.612 0 A 77 LEU HDx% H 1 0.852 0 A 77 LEU CA C 13 55.042 0 A 77 LEU CB C 13 42.7 0 A 77 LEU CDx C 13 23.473 0 A 77 LEU N N 15 127.505 0.003 A 78 ASP H H 1 8.468 0.001 A 78 ASP HA H 1 4.809 0.027 A 78 ASP HBy H 1 2.841 0.003 A 78 ASP HBx H 1 2.657 0.004 A 78 ASP CA C 13 53.746 0 A 78 ASP CB C 13 41.327 0 A 78 ASP N N 15 122.422 0 A 79 THR H H 1 8.447 0 A 79 THR HA H 1 4.237 0.017 A 79 THR HB H 1 4.396 0.004 A 79 THR HG2% H 1 1.185 0 A 79 THR CA C 13 62.272 0 A 79 THR CB C 13 68.766 0 A 79 THR N N 15 115.682 0 A 80 SER H H 1 8.521 0.002 A 80 SER HA H 1 4.349 0.004 A 80 SER HBx H 1 3.974 0.004 A 80 SER HBy H 1 3.974 0.004 A 80 SER CA C 13 60.346 0 A 80 SER CB C 13 63.372 0 A 80 SER N N 15 118.485 0 A 81 GLU H H 1 8.192 0.002 A 81 GLU HA H 1 4.399 0 A 81 GLU HBx H 1 1.94 0 A 81 GLU HBy H 1 2.203 0 A 81 GLU HGx H 1 2.233 0 A 81 GLU HGy H 1 2.304 0 A 81 GLU CA C 13 55.946 0 A 81 GLU CB C 13 30.073 0 A 81 GLU CG C 13 36.5 0 A 81 GLU N N 15 121.082 0 A 82 LEU H H 1 7.804 0.005 A 82 LEU HA H 1 4.486 0 A 82 LEU HBy H 1 1.768 0 A 82 LEU HBx H 1 1.187 0 A 82 LEU HDx% H 1 0.663 0 A 82 LEU HG H 1 0.803 0 A 82 LEU CA C 13 54.319 0 A 82 LEU CB C 13 43.302 0.003 A 82 LEU CDx C 13 22.227 0 A 82 LEU CG C 13 27.02 0 A 82 LEU N N 15 120.855 0 A 83 VAL H H 1 9.27 0.002 A 83 VAL HA H 1 4.429 0 A 83 VAL HB H 1 1.912 0 A 83 VAL HGx% H 1 0.856 0 A 83 VAL HGy% H 1 0.764 0 A 83 VAL CA C 13 60.069 0 A 83 VAL CB C 13 34.83 0 A 83 VAL CGy C 13 21.734 0 A 83 VAL CGx C 13 20.602 0 A 83 VAL N N 15 119.7 0 A 84 THR H H 1 8.38 0.002 A 84 THR HA H 1 4.838 0.002 A 84 THR HB H 1 3.9 0.001 A 84 THR HG2% H 1 1.021 0.001 A 84 THR CA C 13 62.246 0 A 84 THR CB C 13 68.463 0 A 84 THR CG2 C 13 22.653 0 A 84 THR N N 15 118.866 0 A 85 VAL H H 1 8.678 0.008 A 85 VAL HA H 1 4.786 0.002 A 85 VAL HB H 1 1.555 0 A 85 VAL HGx% H 1 0.555 0.005 A 85 VAL HGy% H 1 -0.367 0.005 A 85 VAL CA C 13 57.719 0 A 85 VAL CB C 13 35 0 A 85 VAL CGy C 13 22.853 0 A 85 VAL CGx C 13 18.339 0.009 A 85 VAL N N 15 120.684 0 A 86 VAL H H 1 8.926 0.005 A 86 VAL HA H 1 4.583 0.003 A 86 VAL HB H 1 1.611 0 A 86 VAL HGx% H 1 0.742 0 A 86 VAL HGy% H 1 0.757 0 A 86 VAL CA C 13 60.546 0 A 86 VAL CB C 13 34.7 0 A 86 VAL CGx C 13 20.602 0 A 86 VAL CGy C 13 21.055 0 A 86 VAL N N 15 116.897 0 A 87 ALA H H 1 8.508 0.005 A 87 ALA HA H 1 4.357 0.002 A 87 ALA HB% H 1 1.72 0.002 A 87 ALA CA C 13 53.527 0.038 A 87 ALA CB C 13 19.248 0 A 87 ALA N N 15 127.774 0.024 A 88 LEU H H 1 9.104 0.001 A 88 LEU HA H 1 4.565 0 A 88 LEU HBy H 1 1.612 0 A 88 LEU HBx H 1 1.564 0 A 88 LEU HDx% H 1 0.666 0.004 A 88 LEU HDy% H 1 0.829 0 A 88 LEU HG H 1 1.379 0 A 88 LEU CA C 13 55.019 0 A 88 LEU CB C 13 42.7 0 A 88 LEU CDy C 13 25.273 0 A 88 LEU CDx C 13 22.328 0 A 88 LEU CG C 13 27.312 0 A 88 LEU N N 15 122.162 0 A 89 VAL H H 1 7.444 0.002 A 89 VAL HA H 1 4.532 0 A 89 VAL HB H 1 2.324 0 A 89 VAL HGx% H 1 0.964 0 A 89 VAL HGy% H 1 0.882 0 A 89 VAL CA C 13 58.446 0 A 89 VAL CB C 13 36.3 0 A 89 VAL CGy C 13 21.7 0 A 89 VAL CGx C 13 18.928 0 A 89 VAL N N 15 112.263 0 A 90 LYS H H 1 8.198 0 A 90 LYS HA H 1 4.582 0.002 A 90 LYS HBx H 1 1.788 0 A 90 LYS HBy H 1 1.869 0 A 90 LYS HDx H 1 1.792 0 A 90 LYS HDy H 1 1.792 0 A 90 LYS HEx H 1 2.967 0 A 90 LYS HEy H 1 2.967 0 A 90 LYS HGx H 1 1.368 0 A 90 LYS HGy H 1 1.554 0 A 90 LYS CA C 13 56.946 0 A 90 LYS CB C 13 32.573 0 A 90 LYS CD C 13 29.647 0 A 90 LYS CE C 13 41.747 0 A 90 LYS CG C 13 25.5 0 A 90 LYS N N 15 118.799 0 A 91 LEU H H 1 8.351 0.002 A 91 LEU HA H 1 4.75 0 A 91 LEU HBx H 1 1.274 0 A 91 LEU HBy H 1 1.32 0 A 91 LEU HDx% H 1 0.747 0 A 91 LEU HDy% H 1 0.747 0 A 91 LEU HG H 1 0.835 0 A 91 LEU CA C 13 54.132 0 A 91 LEU CB C 13 46.4 0 A 91 LEU CDx C 13 25.856 0.022 A 91 LEU CG C 13 26.32 0 A 91 LEU N N 15 124.814 0 A 92 HIS H H 1 8.555 0.004 A 92 HIS HA H 1 5.112 0.003 A 92 HIS HBx H 1 3.041 0.016 A 92 HIS HBy H 1 3.194 0.009 A 92 HIS HD2 H 1 7.005 0 A 92 HIS CA C 13 55.553 0 A 92 HIS CB C 13 30.227 0 A 92 HIS N N 15 121.971 0 A 93 THR H H 1 8.182 0.006 A 93 THR HA H 1 4.492 0.003 A 93 THR HB H 1 3.735 0 A 93 THR HG2% H 1 0.41 0.006 A 93 THR CA C 13 59.546 0 A 93 THR CB C 13 69.472 0 A 93 THR CG2 C 13 18.478 0.045 A 93 THR N N 15 119.332 0 A 94 ASP H H 1 8.133 0.001 A 94 ASP HA H 1 4.979 0.001 A 94 ASP HBx H 1 2.611 0.003 A 94 ASP HBy H 1 2.766 0.003 A 94 ASP CA C 13 53.673 0.002 A 94 ASP CB C 13 41.027 0 A 94 ASP N N 15 121.861 0 A 95 ALA H H 1 7.992 0.002 A 95 ALA HA H 1 5.153 0.006 A 95 ALA HB% H 1 1.508 0 A 95 ALA CA C 13 50.916 0 A 95 ALA CB C 13 24.09 0 A 95 ALA N N 15 125.785 0 A 96 LEU H H 1 8.661 0.004 A 96 LEU HA H 1 5.311 0.003 A 96 LEU HBx H 1 1.632 0 A 96 LEU HBy H 1 1.835 0 A 96 LEU HDx% H 1 0.824 0 A 96 LEU HDy% H 1 0.796 0 A 96 LEU HG H 1 1.736 0 A 96 LEU CA C 13 53.416 0 A 96 LEU CB C 13 46 0 A 96 LEU CDy C 13 25.827 0 A 96 LEU CDx C 13 23.788 0 A 96 LEU CG C 13 27.573 0 A 96 LEU N N 15 120.726 0.018 A 97 HIS H H 1 8.725 0.001 A 97 HIS HA H 1 4.269 0.003 A 97 HIS HBx H 1 3.106 0.002 A 97 HIS HBy H 1 3.918 0.008 A 97 HIS HD2 H 1 7.221 0.011 A 97 HIS HE1 H 1 7.857 0.012 A 97 HIS CA C 13 58.316 0 A 97 HIS CB C 13 30.973 0 A 97 HIS N N 15 121.175 0.011 A 98 ALA H H 1 8.26 0.002 A 98 ALA HA H 1 3.759 0.001 A 98 ALA HB% H 1 1.323 0.001 A 98 ALA CA C 13 56.672 0 A 98 ALA CB C 13 19.377 0 A 98 ALA N N 15 126.618 0.004 A 99 THR H H 1 10.304 0.01 A 99 THR HA H 1 4.584 0.004 A 99 THR HB H 1 4.38 0 A 99 THR HG2% H 1 1.183 0.004 A 99 THR CA C 13 61.872 0 A 99 THR CB C 13 70.442 0 A 99 THR CG2 C 13 22.053 0 A 99 THR N N 15 107.369 0 A 100 ARG H H 1 9.037 0.004 A 100 ARG HA H 1 4.567 0.004 A 100 ARG HBy H 1 1.59 0.004 A 100 ARG HBx H 1 1.219 0.003 A 100 ARG HDx H 1 2.799 0 A 100 ARG HDy H 1 2.898 0 A 100 ARG HGx H 1 1.331 0.003 A 100 ARG HGy H 1 1.331 0.003 A 100 ARG CA C 13 55.246 0 A 100 ARG CB C 13 32.673 0 A 100 ARG CD C 13 43 0 A 100 ARG CG C 13 27.7 0 A 100 ARG N N 15 124.395 0.007 A 101 ASP H H 1 8.898 0.005 A 101 ASP HA H 1 4.733 0.003 A 101 ASP HBy H 1 2.732 0.001 A 101 ASP HBx H 1 2.617 0.002 A 101 ASP CA C 13 52.916 0 A 101 ASP CB C 13 38.097 0 A 101 ASP N N 15 124.596 0 A 102 GLU H H 1 7.876 0.002 A 102 GLU HA H 1 4.918 0.005 A 102 GLU HBx H 1 1.807 0 A 102 GLU HBy H 1 1.963 0 A 102 GLU HGx H 1 2.14 0 A 102 GLU HGy H 1 2.202 0 A 102 GLU CA C 13 52.546 0 A 102 GLU CB C 13 33.062 0 A 102 GLU CG C 13 35.781 0 A 102 GLU N N 15 121.916 0 A 103 PRO HA H 1 5.099 0.004 A 103 PRO HBx H 1 1.988 0 A 103 PRO HBy H 1 2.47 0 A 103 PRO HDx H 1 3.756 0 A 103 PRO HDy H 1 3.857 0 A 103 PRO HGy H 1 2.141 0 A 103 PRO HGx H 1 2.022 0 A 103 PRO CA C 13 62.689 0 A 103 PRO CB C 13 33.14 0 A 103 PRO CD C 13 50.96 0 A 103 PRO CG C 13 27.373 0 A 104 VAL H H 1 8.362 0.003 A 104 VAL HA H 1 4.403 0.001 A 104 VAL HB H 1 1.753 0.002 A 104 VAL HGx% H 1 0.804 0.001 A 104 VAL HGy% H 1 0.819 0.001 A 104 VAL CA C 13 61.216 0 A 104 VAL CB C 13 35.543 0 A 104 VAL CGx C 13 20.828 0 A 104 VAL CGy C 13 21.453 0 A 104 VAL N N 15 118.661 0 A 105 ALA H H 1 8.726 0.002 A 105 ALA HA H 1 5.17 0.006 A 105 ALA HB% H 1 1.47 0.002 A 105 ALA CA C 13 51.622 0 A 105 ALA CB C 13 21.017 0.025 A 105 ALA N N 15 126.902 0.017 A 106 PHE H H 1 7.597 0.001 A 106 PHE HA H 1 5.236 0.003 A 106 PHE HBy H 1 2.938 0 A 106 PHE HBx H 1 2.776 0 A 106 PHE HDx H 1 6.743 0 A 106 PHE HDy H 1 6.743 0 A 106 PHE CA C 13 56.646 0 A 106 PHE CB C 13 41.3 0 A 106 PHE N N 15 119.156 0.004 A 107 VAL H H 1 8.267 0 A 107 VAL HA H 1 4.219 0 A 107 VAL HB H 1 1.542 0 A 107 VAL HGx% H 1 0.439 0.003 A 107 VAL HGy% H 1 0.154 0.007 A 107 VAL CA C 13 59.546 0 A 107 VAL CB C 13 35.2 0 A 107 VAL CGy C 13 22.453 0 A 107 VAL CGx C 13 19.377 0 A 107 VAL N N 15 120.344 0 A 108 LEU H H 1 7.737 0 A 108 LEU HA H 1 4.429 0.002 A 108 LEU HBx H 1 1.491 0 A 108 LEU HBy H 1 1.491 0 A 108 LEU HDx% H 1 0.974 0 A 108 LEU HDy% H 1 0.979 0 A 108 LEU HG H 1 1.707 0 A 108 LEU CA C 13 51.866 0 A 108 LEU CB C 13 41.1 0 A 108 LEU CDx C 13 22.99 0 A 108 LEU CDy C 13 25.227 0 A 108 LEU CG C 13 27.163 0 A 108 LEU N N 15 121.82 0 A 109 PRO HA H 1 3.711 0 A 109 PRO HBx H 1 1.81 0 A 109 PRO HBy H 1 1.859 0 A 109 PRO HDy H 1 3.641 0 A 109 PRO HDx H 1 3.33 0 A 109 PRO HGx H 1 1.578 0 A 109 PRO HGy H 1 2.195 0 A 109 PRO CA C 13 63.672 0 A 109 PRO CB C 13 31.073 0 A 109 PRO CD C 13 50.146 0 A 109 PRO CG C 13 27.973 0 A 110 GLY H H 1 9.026 0 A 110 GLY HAx H 1 3.49 0 A 110 GLY HAy H 1 4.425 0 A 110 GLY CA C 13 44.843 0 A 110 GLY N N 15 112.032 0 A 111 THR H H 1 8.039 0.002 A 111 THR HA H 1 4.33 0.002 A 111 THR HB H 1 4.313 0.001 A 111 THR HG2% H 1 1.438 0.001 A 111 THR CA C 13 63.346 0 A 111 THR CB C 13 69.512 0.018 A 111 THR CG2 C 13 21.504 0.056 A 111 THR N N 15 119.141 0 A 112 ALA H H 1 8.9 0.001 A 112 ALA HA H 1 5.707 0.01 A 112 ALA HB% H 1 1.243 0.001 A 112 ALA CA C 13 50.312 0 A 112 ALA CB C 13 19.922 0 A 112 ALA N N 15 131.125 0.008 A 113 PHE H H 1 9.22 0.001 A 113 PHE HA H 1 4.658 0.001 A 113 PHE HBx H 1 2.944 0 A 113 PHE HBy H 1 3.165 0 A 113 PHE HDx H 1 6.982 0.007 A 113 PHE HDy H 1 6.982 0.007 A 113 PHE HEx H 1 6.855 0.008 A 113 PHE HEy H 1 6.855 0.008 A 113 PHE CA C 13 56.672 0 A 113 PHE CB C 13 38.393 0 A 113 PHE N N 15 116.476 0.02 A 114 ARG H H 1 9.145 0.001 A 114 ARG HA H 1 5.64 0.005 A 114 ARG HBy H 1 1.818 0.001 A 114 ARG HBx H 1 1.402 0.001 A 114 ARG HDx H 1 2.922 0.003 A 114 ARG HDy H 1 3.19 0.001 A 114 ARG HE H 1 7.188 0.001 A 114 ARG HGx H 1 1.38 0 A 114 ARG HGy H 1 1.824 0 A 114 ARG CA C 13 55.07 0 A 114 ARG CB C 13 34.9 0 A 114 ARG CD C 13 43.8 0 A 114 ARG CG C 13 28.073 0 A 114 ARG N N 15 117.116 0 A 114 ARG NE N 15 111.505 0 A 115 VAL H H 1 8.441 0.002 A 115 VAL HA H 1 4.853 0 A 115 VAL HB H 1 2.356 0 A 115 VAL HGx% H 1 1.144 0.001 A 115 VAL HGy% H 1 0.748 0.001 A 115 VAL CA C 13 58.772 0 A 115 VAL CB C 13 37.5 0 A 115 VAL CGy C 13 23.753 0 A 115 VAL CGx C 13 18.237 0.029 A 115 VAL N N 15 113.755 0 A 116 SER H H 1 8.723 0.004 A 116 SER HA H 1 4.53 0 A 116 SER HBy H 1 4.318 0 A 116 SER HBx H 1 4.046 0 A 116 SER CA C 13 58.168 0.148 A 116 SER CB C 13 64.399 0 A 116 SER N N 15 115.947 0 A 117 ALA H H 1 9.143 0.002 A 117 ALA HA H 1 3.98 0.001 A 117 ALA HB% H 1 1.482 0.011 A 117 ALA CA C 13 55.772 0 A 117 ALA CB C 13 18.11 0 A 117 ALA N N 15 123.625 0 A 118 GLY H H 1 8.937 0.003 A 118 GLY HAy H 1 3.929 0 A 118 GLY HAx H 1 3.874 0 A 118 GLY CA C 13 46.9 0 A 118 GLY N N 15 106.332 0.02 A 119 VAL H H 1 7.376 0.003 A 119 VAL HA H 1 3.843 0 A 119 VAL HB H 1 2.183 0 A 119 VAL HGx% H 1 1.063 0 A 119 VAL HGy% H 1 1.093 0 A 119 VAL CA C 13 65.816 0 A 119 VAL CB C 13 31.967 0 A 119 VAL CGy C 13 23.007 0.005 A 119 VAL CGx C 13 21.055 0 A 119 VAL N N 15 124.965 0 A 120 ALA H H 1 8.805 0.001 A 120 ALA HA H 1 3.672 0.003 A 120 ALA HB% H 1 1.236 0.005 A 120 ALA CA C 13 55.472 0 A 120 ALA CB C 13 18.454 0 A 120 ALA N N 15 122.605 0.017 A 121 ALA H H 1 7.976 0.002 A 121 ALA HA H 1 4.088 0 A 121 ALA HB% H 1 1.537 0 A 121 ALA CA C 13 54.946 0 A 121 ALA CB C 13 17.678 0 A 121 ALA N N 15 119.852 0 A 122 GLU H H 1 7.369 0.004 A 122 GLU HA H 1 4.146 0.001 A 122 GLU HBy H 1 2.245 0 A 122 GLU HBx H 1 2.153 0 A 122 GLU HGx H 1 2.396 0 A 122 GLU HGy H 1 2.396 0 A 122 GLU CA C 13 59.272 0 A 122 GLU CB C 13 29.7 0 A 122 GLU CG C 13 36.2 0 A 122 GLU N N 15 118.977 0 A 123 MET H H 1 8.794 0.003 A 123 MET HA H 1 3.941 0 A 123 MET HBy H 1 2.047 0 A 123 MET HBx H 1 1.892 0 A 123 MET HE% H 1 2.102 0.003 A 123 MET HGy H 1 3.043 0 A 123 MET HGx H 1 2.351 0 A 123 MET CA C 13 60.416 0 A 123 MET CB C 13 33.973 0 A 123 MET CE C 13 18.938 0.003 A 123 MET CG C 13 33.973 0 A 123 MET N N 15 116.735 0 A 124 THR H H 1 8.622 0.002 A 124 THR HA H 1 4.605 0.001 A 124 THR HB H 1 4.294 0 A 124 THR HG2% H 1 1.219 0 A 124 THR CA C 13 64.742 0 A 124 THR CB C 13 68.392 0 A 124 THR CG2 C 13 21.114 0.013 A 124 THR N N 15 112.866 0 A 125 GLU H H 1 8.054 0.002 A 125 GLU HA H 1 4.143 0.004 A 125 GLU HBx H 1 2.4 0 A 125 GLU HBy H 1 2.4 0 A 125 GLU CA C 13 59.639 0 A 125 GLU N N 15 125.722 0 A 126 ARG H H 1 7.703 0.001 A 126 ARG HA H 1 4.373 0.003 A 126 ARG HBx H 1 1.723 0.003 A 126 ARG HBy H 1 2.168 0.004 A 126 ARG HDx H 1 3.189 0 A 126 ARG HDy H 1 3.189 0 A 126 ARG HGy H 1 2.011 0.003 A 126 ARG HGx H 1 1.799 0.004 A 126 ARG CA C 13 56.472 0 A 126 ARG CB C 13 31.8 0 A 126 ARG CD C 13 43.9 0 A 126 ARG CG C 13 27.773 0 A 126 ARG N N 15 114.393 0.01 A 127 GLY H H 1 7.759 0.002 A 127 GLY HAx H 1 3.893 0.003 A 127 GLY HAy H 1 4.091 0.005 A 127 GLY CA C 13 46.2 0 A 127 GLY N N 15 107.07 0 A 128 LEU H H 1 8.293 0.002 A 128 LEU HA H 1 4.371 0.003 A 128 LEU HBy H 1 1.703 0 A 128 LEU HBx H 1 1.601 0.001 A 128 LEU HDx% H 1 0.954 0.001 A 128 LEU HDy% H 1 0.818 0.01 A 128 LEU HG H 1 1.584 0.001 A 128 LEU CA C 13 55.572 0 A 128 LEU CB C 13 42.427 0 A 128 LEU CDy C 13 25.548 0 A 128 LEU CDx C 13 22.227 0 A 128 LEU CG C 13 27.253 0 A 128 LEU N N 15 116.338 0 A 129 ALA H H 1 7.351 0.004 A 129 ALA HA H 1 5.13 0.004 A 129 ALA HB% H 1 1.077 0.002 A 129 ALA CA C 13 50.142 0 A 129 ALA CB C 13 23.308 0.022 A 129 ALA N N 15 116.379 0 A 130 ARG H H 1 8.771 0.004 A 130 ARG HA H 1 4.922 0.005 A 130 ARG HBy H 1 1.841 0 A 130 ARG HBx H 1 1.757 0 A 130 ARG HDx H 1 3.169 0 A 130 ARG HDy H 1 3.169 0 A 130 ARG HGx H 1 1.479 0 A 130 ARG HGy H 1 1.479 0 A 130 ARG CA C 13 53.189 0 A 130 ARG CB C 13 33.453 0 A 130 ARG CD C 13 43.347 0 A 130 ARG CG C 13 26.5 0 A 130 ARG N N 15 115.969 0 A 131 MET H H 1 8.91 0.003 A 131 MET HA H 1 4.415 0.009 A 131 MET HBx H 1 1.975 0 A 131 MET HBy H 1 2.154 0 A 131 MET HE% H 1 2.042 0.005 A 131 MET HGx H 1 2.596 0 A 131 MET HGy H 1 2.737 0 A 131 MET CA C 13 55.677 0.037 A 131 MET CB C 13 31.527 0 A 131 MET CE C 13 16.51 0 A 131 MET CG C 13 32.306 0 A 131 MET N N 15 120.973 0 A 132 GLN H H 1 7.93 0.002 A 132 GLN HA H 1 3.87 0 A 132 GLN HBx H 1 1.535 0 A 132 GLN HBy H 1 1.826 0 A 132 GLN HE2y H 1 7.51 0.001 A 132 GLN HE2x H 1 6.832 0.001 A 132 GLN HGx H 1 2.142 0 A 132 GLN HGy H 1 2.229 0 A 132 GLN CA C 13 58.946 0 A 132 GLN CB C 13 30.4 0 A 132 GLN CG C 13 35.158 0 A 132 GLN N N 15 128.114 0 A 132 GLN NE2 N 15 111.295 0 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 112 ALA HA A 86 VAL HGx% 1.0 . 3.71 2 2 A 112 ALA HA A 86 VAL HGy% 1.0 . 3.71 3 3 A 87 ALA HB% A 113 PHE HE% 1.0 . 3.11 4 4 A 87 ALA HB% A 113 PHE HD% 1.0 . 3.68 5 5 A 113 PHE HD% A 87 ALA HA 1.0 . 5.21 6 6 A 113 PHE HE% A 87 ALA HA 1.0 . 3.62 7 7 A 80 SER HA A 80 SER HBx 1.0 . 2.62 8 7 A 80 SER HA A 80 SER HBy 1.0 . 2.62 9 8 A 118 GLY HAx A 121 ALA HB% 1.0 . 4.62 10 9 A 87 ALA HA A 129 ALA HA 1.0 . 3.40 11 10 A 123 MET HBx A 129 ALA HB% 1.0 . 3.41 12 11 A 113 PHE HE% A 129 ALA HB% 1.0 . 3.67 13 12 A 113 PHE HD% A 129 ALA HB% 1.0 . 5.50 14 13 A 124 THR HA A 124 THR HG2% 1.0 . 2.90 15 14 A 74 THR HG2% A 75 VAL HA 1.0 . 4.51 16 15 A 124 THR HG2% A 131 MET HGx 1.0 . 4.11 17 16 A 124 THR HA A 125 GLU HA 1.0 . 4.77 18 17 A 121 ALA HB% A 118 GLY HAy 1.0 . 3.33 19 18 A 121 ALA HB% A 122 GLU HGx 1.0 . 5.04 20 18 A 121 ALA HB% A 122 GLU HGy 1.0 . 5.04 21 19 A 121 ALA HB% A 125 GLU HBx 1.0 . 5.44 22 19 A 121 ALA HB% A 125 GLU HBy 1.0 . 5.44 23 20 A 121 ALA HB% A 131 MET HE% 1.0 . 4.76 24 21 A 121 ALA HB% A 120 ALA HB% 1.0 . 3.95 25 22 A 120 ALA HB% A 121 ALA HA 1.0 . 4.20 26 23 A 124 THR HG2% A 121 ALA HA 1.0 . 4.62 27 24 A 120 ALA HB% A 85 VAL HGx% 1.0 . 4.19 28 25 A 120 ALA HB% A 83 VAL HB 1.0 . 3.41 29 26 A 120 ALA HB% A 119 VAL HB 1.0 . 4.27 30 27 A 120 ALA HB% A 117 ALA HA 1.0 . 3.25 31 28 A 120 ALA HA A 85 VAL HGx% 1.0 . 4.50 32 29 A 120 ALA HA A 123 MET HGy 1.0 . 4.51 33 30 A 123 MET HBx A 120 ALA HA 1.0 . 4.14 34 31 A 76 ILE HA A 76 ILE HG1y 1.0 . 3.77 35 32 A 76 ILE HG2% A 76 ILE HG1y 1.0 . 3.24 36 33 A 76 ILE HB A 76 ILE HD1% 1.0 . 3.35 37 34 A 76 ILE HA A 76 ILE HD1% 1.0 . 4.14 38 35 A 76 ILE HA A 76 ILE HG1x 1.0 . 3.77 39 36 A 76 ILE HG2% A 76 ILE HG1x 1.0 . 3.24 40 37 A 76 ILE HA A 76 ILE HG2% 1.0 . 2.78 41 38 A 123 MET HBx A 124 THR HG2% 1.0 . 4.08 42 39 A 129 ALA HA A 88 LEU HDy% 1.0 . 3.79 43 40 A 129 ALA HA A 88 LEU HG 1.0 . 3.30 44 41 A 129 ALA HA A 88 LEU HBy 1.0 . 4.40 45 42 A 96 LEU HA A 103 PRO HA 1.0 . 3.43 46 43 A 92 HIS HA A 106 PHE HA 1.0 . 3.21 47 44 A 95 ALA HB% A 104 VAL HGx% 1.0 . 3.52 48 45 A 120 ALA HB% A 83 VAL HGy% 1.0 . 2.91 49 46 A 87 ALA HA A 129 ALA HB% 1.0 . 3.32 50 47 A 87 ALA HB% A 129 ALA HB% 1.0 . 3.65 51 48 A 129 ALA HB% A 128 LEU HBy 1.0 . 4.13 52 49 A 87 ALA HB% A 129 ALA HA 1.0 . 4.10 53 50 A 112 ALA HA A 113 PHE HD% 1.0 . 4.06 54 51 A 104 VAL HA A 104 VAL HGy% 1.0 . 3.69 55 52 A 83 VAL HA A 83 VAL HGx% 1.0 . 3.21 56 53 A 119 VAL HA A 122 GLU HGx 1.0 . 5.12 57 53 A 122 GLU HGy A 119 VAL HA 1.0 . 5.12 58 54 A 88 LEU HDx% A 127 GLY HAy 1.0 . 5.19 59 55 A 87 ALA HB% A 91 LEU HDx% 1.0 . 4.33 60 55 A 87 ALA HB% A 91 LEU HDy% 1.0 . 4.33 61 56 A 87 ALA HA A 86 VAL HGx% 1.0 . 5.16 62 57 A 87 ALA HA A 86 VAL HGy% 1.0 . 5.16 63 58 A 87 ALA HA A 88 LEU HDy% 1.0 . 4.73 64 59 A 113 PHE HD% A 86 VAL HA 1.0 . 4.26 65 60 A 86 VAL HA A 112 ALA HB% 1.0 . 3.77 66 61 A 92 HIS HA A 93 THR HG2% 1.0 . 4.36 67 62 A 92 HIS HA A 106 PHE HBx 1.0 . 4.47 68 63 A 92 HIS HA A 106 PHE HD% 1.0 . 4.90 69 64 A 92 HIS HA A 92 HIS HD2 1.0 . 4.08 70 65 A 94 ASP HA A 105 ALA HA 1.0 . 3.75 71 66 A 97 HIS HA A 97 HIS HD2 1.0 . 4.54 72 67 A 102 GLU HA A 103 PRO HDx 1.0 . 3.24 73 68 A 102 GLU HA A 103 PRO HDy 1.0 . 3.24 74 69 A 124 THR HG2% A 120 ALA HA 1.0 . 4.49 75 70 A 124 THR HG2% A 130 ARG HA 1.0 . 3.18 76 71 A 88 LEU HDy% A 130 ARG HA 1.0 . 4.51 77 72 A 88 LEU HDx% A 130 ARG HA 1.0 . 4.33 78 73 A 129 ALA HB% A 130 ARG HA 1.0 . 4.25 79 74 A 87 ALA HB% A 109 PRO HA 1.0 . 3.15 80 75 A 107 VAL HA A 111 THR HG2% 1.0 . 4.03 81 76 A 107 VAL HB A 111 THR HB 1.0 . 3.41 82 77 A 87 ALA HB% A 107 VAL HGx% 1.0 . 3.35 83 78 A 113 PHE HBy A 107 VAL HGx% 1.0 . 4.91 84 79 A 113 PHE HBx A 107 VAL HGx% 1.0 . 5.50 85 80 A 107 VAL HA A 107 VAL HGx% 1.0 . 3.59 86 81 A 113 PHE HD% A 107 VAL HGx% 1.0 . 3.67 87 82 A 113 PHE HE% A 107 VAL HGx% 1.0 . 3.90 88 83 A 113 PHE HD% A 107 VAL HB 1.0 . 4.70 89 84 A 113 PHE HE% A 107 VAL HB 1.0 . 4.71 90 85 A 87 ALA HB% A 107 VAL HGy% 1.0 . 3.35 91 86 A 107 VAL HA A 107 VAL HGy% 1.0 . 3.59 92 87 A 87 ALA HA A 107 VAL HGy% 1.0 . 5.50 93 88 A 93 THR HB A 107 VAL HGy% 1.0 . 5.50 94 89 A 113 PHE HE% A 107 VAL HGy% 1.0 . 3.90 95 90 A 113 PHE HD% A 107 VAL HGy% 1.0 . 3.67 96 91 A 93 THR HG2% A 105 ALA HA 1.0 . 4.82 97 92 A 105 ALA HA A 104 VAL HGy% 1.0 . 5.47 98 93 A 106 PHE HD% A 105 ALA HB% 1.0 . 4.22 99 94 A 106 PHE HBx A 105 ALA HB% 1.0 . 4.44 100 95 A 105 ALA HB% A 106 PHE HBy 1.0 . 4.91 101 96 A 100 ARG HBy A 100 ARG HDx 1.0 . 4.17 102 97 A 100 ARG HBy A 100 ARG HDy 1.0 . 4.17 103 98 A 100 ARG HA A 100 ARG HDx 1.0 . 4.63 104 99 A 100 ARG HA A 100 ARG HDy 1.0 . 4.63 105 100 A 100 ARG HA A 100 ARG HGx 1.0 . 3.03 106 100 A 100 ARG HA A 100 ARG HGy 1.0 . 3.03 107 101 A 93 THR HG2% A 95 ALA HA 1.0 . 5.19 108 102 A 95 ALA HA A 104 VAL HB 1.0 . 5.50 109 103 A 113 PHE HD% A 95 ALA HB% 1.0 . 3.12 110 104 A 113 PHE HE% A 95 ALA HB% 1.0 . 3.60 111 105 A 95 ALA HB% A 93 THR HB 1.0 . 5.03 112 106 A 95 ALA HB% A 113 PHE HBx 1.0 . 4.13 113 107 A 95 ALA HB% A 115 VAL HB 1.0 . 4.82 114 108 A 95 ALA HB% A 93 THR HG2% 1.0 . 3.08 115 109 A 87 ALA HA A 88 LEU HG 1.0 . 4.49 116 110 A 87 ALA HB% A 86 VAL HA 1.0 . 5.06 117 111 A 87 ALA HB% A 88 LEU HA 1.0 . 5.50 118 112 A 129 ALA HB% A 85 VAL HGx% 1.0 . 3.86 119 113 A 129 ALA HB% A 93 THR HG2% 1.0 . 5.50 120 114 A 124 THR HA A 123 MET HBy 1.0 . 4.84 121 115 A 129 ALA HB% A 124 THR HA 1.0 . 4.03 122 116 A 124 THR HG2% A 131 MET HA 1.0 . 4.17 123 117 A 124 THR HG2% A 131 MET HBy 1.0 . 4.69 124 118 A 123 MET HA A 126 ARG HBx 1.0 . 3.55 125 119 A 129 ALA HB% A 123 MET HA 1.0 . 4.26 126 120 A 120 ALA HA A 123 MET HGx 1.0 . 4.68 127 121 A 120 ALA HA A 123 MET HBy 1.0 . 3.64 128 122 A 120 ALA HA A 85 VAL HB 1.0 . 4.60 129 123 A 120 ALA HB% A 131 MET HA 1.0 . 5.50 130 124 A 120 ALA HB% A 115 VAL HB 1.0 . 5.26 131 125 A 120 ALA HB% A 123 MET HGy 1.0 . 5.50 132 126 A 121 ALA HB% A 120 ALA HA 1.0 . 5.26 133 127 A 81 GLU HA A 117 ALA HB% 1.0 . 5.46 134 128 A 117 ALA HB% A 82 LEU HA 1.0 . 5.50 135 129 A 117 ALA HB% A 116 SER HA 1.0 . 5.50 136 130 A 117 ALA HB% A 81 GLU HBx 1.0 . 4.28 137 131 A 117 ALA HB% A 81 GLU HBy 1.0 . 4.28 138 132 A 120 ALA HB% A 117 ALA HB% 1.0 . 4.45 139 133 A 115 VAL HA A 116 SER HBx 1.0 . 5.50 140 134 A 119 VAL HB A 116 SER HBx 1.0 . 5.50 141 135 A 119 VAL HB A 116 SER HBy 1.0 . 5.50 142 136 A 115 VAL HA A 116 SER HBy 1.0 . 5.50 143 137 A 112 ALA HA A 113 PHE HE% 1.0 . 5.35 144 138 A 112 ALA HA A 111 THR HA 1.0 . 4.94 145 139 A 112 ALA HA A 111 THR HG2% 1.0 . 4.22 146 140 A 112 ALA HA A 132 GLN HBx 1.0 . 4.61 147 141 A 112 ALA HA A 86 VAL HB 1.0 . 4.65 148 142 A 112 ALA HA A 84 THR HG2% 1.0 . 4.44 149 143 A 113 PHE HD% A 112 ALA HB% 1.0 . 4.93 150 144 A 112 ALA HB% A 132 GLN HGx 1.0 . 4.68 151 145 A 112 ALA HB% A 86 VAL HGy% 1.0 . 3.83 152 146 A 112 ALA HB% A 84 THR HG2% 1.0 . 2.73 153 147 A 112 ALA HB% A 132 GLN HBy 1.0 . 4.36 154 148 A 112 ALA HB% A 111 THR HA 1.0 . 4.31 155 149 A 87 ALA HB% A 111 THR HB 1.0 . 4.09 156 150 A 111 THR HG2% A 111 THR HA 1.0 . 2.83 157 151 A 111 THR HG2% A 113 PHE HBy 1.0 . 4.54 158 152 A 109 PRO HBy A 89 VAL HGx% 1.0 . 5.45 159 153 A 89 VAL HA A 109 PRO HGx 1.0 . 4.73 160 154 A 109 PRO HGx A 108 LEU HA 1.0 . 5.14 161 155 A 109 PRO HGx A 110 GLY HAy 1.0 . 5.50 162 156 A 109 PRO HDy A 90 LYS HDx 1.0 . 4.30 163 156 A 90 LYS HDy A 109 PRO HDy 1.0 . 4.30 164 157 A 109 PRO HDx A 108 LEU HBx 1.0 . 3.70 165 157 A 108 LEU HBy A 109 PRO HDx 1.0 . 3.70 166 158 A 109 PRO HDy A 108 LEU HBx 1.0 . 3.45 167 158 A 109 PRO HDy A 108 LEU HBy 1.0 . 3.45 168 159 A 109 PRO HDx A 108 LEU HDy% 1.0 . 5.13 169 160 A 114 ARG HA A 114 ARG HDy 1.0 . 4.96 170 161 A 84 THR HG2% A 114 ARG HA 1.0 . 4.12 171 162 A 114 ARG HA A 114 ARG HDx 1.0 . 4.96 172 163 A 114 ARG HBx A 114 ARG HDx 1.0 . 4.02 173 164 A 114 ARG HBx A 114 ARG HDy 1.0 . 4.02 174 165 A 113 PHE HBx A 114 ARG HA 1.0 . 5.29 175 166 A 100 ARG HBx A 101 ASP HA 1.0 . 4.81 176 167 A 93 THR HG2% A 94 ASP HA 1.0 . 4.85 177 168 A 95 ALA HB% A 94 ASP HA 1.0 . 4.56 178 169 A 93 THR HA A 123 MET HE% 1.0 . 4.64 179 170 A 95 ALA HB% A 93 THR HA 1.0 . 5.32 180 171 A 93 THR HB A 93 THR HA 1.0 . 2.96 181 172 A 93 THR HB A 123 MET HGx 1.0 . 5.50 182 173 A 93 THR HB A 91 LEU HBy 1.0 . 4.78 183 174 A 93 THR HG2% A 104 VAL HGx% 1.0 . 3.81 184 175 A 93 THR HG2% A 104 VAL HGy% 1.0 . 3.81 185 176 A 93 THR HG2% A 91 LEU HDx% 1.0 . 3.68 186 176 A 91 LEU HDy% A 93 THR HG2% 1.0 . 3.68 187 177 A 113 PHE HE% A 93 THR HG2% 1.0 . 3.83 188 178 A 93 THR HG2% A 93 THR HA 1.0 . 3.23 189 179 A 89 VAL HA A 109 PRO HDx 1.0 . 4.93 190 180 A 89 VAL HA A 109 PRO HGy 1.0 . 3.77 191 181 A 128 LEU HA A 89 VAL HGx% 1.0 . 4.25 192 182 A 109 PRO HBy A 89 VAL HGy% 1.0 . 5.45 193 183 A 128 LEU HA A 89 VAL HGy% 1.0 . 4.25 194 184 A 89 VAL HA A 89 VAL HGx% 1.0 . 3.53 195 185 A 89 VAL HA A 89 VAL HGy% 1.0 . 3.53 196 186 A 113 PHE HE% A 86 VAL HA 1.0 . 4.96 197 187 A 86 VAL HA A 111 THR HG2% 1.0 . 5.24 198 188 A 86 VAL HB A 132 GLN HA 1.0 . 5.06 199 189 A 113 PHE HD% A 104 VAL HGx% 1.0 . 5.03 200 190 A 131 MET HA A 85 VAL HA 1.0 . 3.52 201 191 A 85 VAL HA A 131 MET HBx 1.0 . 5.50 202 192 A 131 MET HE% A 85 VAL HA 1.0 . 5.50 203 193 A 84 THR HG2% A 85 VAL HA 1.0 . 4.07 204 194 A 112 ALA HB% A 85 VAL HA 1.0 . 5.50 205 195 A 124 THR HG2% A 85 VAL HA 1.0 . 5.50 206 196 A 123 MET HBx A 85 VAL HGx% 1.0 . 5.22 207 197 A 124 THR HG2% A 85 VAL HGx% 1.0 . 4.37 208 198 A 85 VAL HA A 85 VAL HGx% 1.0 . 3.83 209 199 A 114 ARG HBx A 84 THR HA 1.0 . 3.81 210 200 A 85 VAL HB A 84 THR HA 1.0 . 5.50 211 201 A 132 GLN HBx A 84 THR HA 1.0 . 5.50 212 202 A 132 GLN HBy A 84 THR HB 1.0 . 3.57 213 203 A 132 GLN HBx A 84 THR HB 1.0 . 4.79 214 204 A 131 MET HBy A 84 THR HB 1.0 . 5.17 215 205 A 112 ALA HB% A 84 THR HB 1.0 . 5.25 216 206 A 132 GLN HBx A 84 THR HG2% 1.0 . 3.21 217 207 A 84 THR HG2% A 132 GLN HBy 1.0 . 3.34 218 208 A 84 THR HG2% A 84 THR HA 1.0 . 3.04 219 209 A 113 PHE HE% A 115 VAL HA 1.0 . 5.50 220 210 A 95 ALA HA A 115 VAL HA 1.0 . 5.11 221 211 A 119 VAL HB A 115 VAL HA 1.0 . 4.79 222 212 A 119 VAL HB A 115 VAL HB 1.0 . 3.89 223 213 A 113 PHE HD% A 115 VAL HB 1.0 . 5.08 224 214 A 95 ALA HB% A 115 VAL HGy% 1.0 . 4.05 225 215 A 123 MET HE% A 115 VAL HGy% 1.0 . 4.19 226 216 A 113 PHE HE% A 115 VAL HGy% 1.0 . 4.01 227 217 A 113 PHE HD% A 115 VAL HGy% 1.0 . 4.17 228 218 A 115 VAL HA A 115 VAL HGy% 1.0 . 3.36 229 219 A 113 PHE HD% A 115 VAL HGx% 1.0 . 4.17 230 220 A 113 PHE HE% A 115 VAL HGx% 1.0 . 4.01 231 221 A 123 MET HE% A 115 VAL HGx% 1.0 . 4.19 232 222 A 95 ALA HB% A 115 VAL HGx% 1.0 . 4.05 233 223 A 115 VAL HA A 115 VAL HGx% 1.0 . 3.36 234 224 A 115 VAL HB A 119 VAL HGx% 1.0 . 3.97 235 225 A 103 PRO HA A 102 GLU HA 1.0 . 4.63 236 226 A 103 PRO HA A 104 VAL HA 1.0 . 4.66 237 227 A 103 PRO HA A 96 LEU HBy 1.0 . 4.89 238 228 A 103 PRO HA A 96 LEU HG 1.0 . 5.12 239 229 A 103 PRO HA A 96 LEU HDx% 1.0 . 3.48 240 230 A 96 LEU HA A 103 PRO HBx 1.0 . 4.90 241 231 A 103 PRO HGy A 96 LEU HDx% 1.0 . 4.97 242 232 A 96 LEU HDx% A 103 PRO HGx 1.0 . 4.97 243 233 A 96 LEU HDy% A 103 PRO HGx 1.0 . 4.97 244 234 A 129 ALA HA A 88 LEU HA 1.0 . 5.02 245 235 A 120 ALA HB% A 83 VAL HA 1.0 . 5.17 246 236 A 83 VAL HA A 82 LEU HBy 1.0 . 5.50 247 237 A 83 VAL HB A 117 ALA HA 1.0 . 4.42 248 238 A 131 MET HE% A 83 VAL HGy% 1.0 . 3.31 249 239 A 117 ALA HA A 83 VAL HGy% 1.0 . 4.04 250 240 A 112 ALA HB% A 86 VAL HGx% 1.0 . 3.83 251 241 A 83 VAL HA A 83 VAL HGy% 1.0 . 3.21 252 242 A 120 ALA HB% A 83 VAL HGx% 1.0 . 2.91 253 243 A 95 ALA HB% A 104 VAL HGy% 1.0 . 3.52 254 244 A 117 ALA HA A 83 VAL HGx% 1.0 . 4.04 255 245 A 97 HIS HA A 98 ALA HB% 1.0 . 4.50 256 246 A 77 LEU HA A 78 ASP HA 1.0 . 4.57 257 247 A 78 ASP HA A 79 THR HA 1.0 . 4.83 258 248 A 78 ASP HA A 79 THR HG2% 1.0 . 4.19 259 249 A 76 ILE HA A 77 LEU HBx 1.0 . 4.45 260 250 A 76 ILE HB A 74 THR HA 1.0 . 5.50 261 251 A 76 ILE HB A 77 LEU HA 1.0 . 5.50 262 252 A 76 ILE HG2% A 78 ASP HBx 1.0 . 5.44 263 253 A 119 VAL HA A 123 MET HGx 1.0 . 5.50 264 254 A 121 ALA HB% A 119 VAL HA 1.0 . 5.01 265 255 A 119 VAL HA A 119 VAL HGx% 1.0 . 3.02 266 256 A 119 VAL HA A 119 VAL HGy% 1.0 . 3.02 267 257 A 115 VAL HB A 119 VAL HGy% 1.0 . 3.97 268 258 A 115 VAL HA A 119 VAL HGy% 1.0 . 5.26 269 259 A 84 THR HG2% A 132 GLN HA 1.0 . 4.64 270 260 A 112 ALA HB% A 132 GLN HA 1.0 . 5.30 271 261 A 132 GLN HA A 131 MET HBx 1.0 . 5.29 272 262 A 112 ALA HB% A 132 GLN HGy 1.0 . 4.68 273 263 A 84 THR HG2% A 132 GLN HGx 1.0 . 4.36 274 264 A 84 THR HG2% A 132 GLN HGy 1.0 . 4.36 275 265 A 132 GLN HBx A 132 GLN HA 1.0 . 3.01 276 266 A 132 GLN HA A 132 GLN HGx 1.0 . 3.46 277 267 A 132 GLN HA A 132 GLN HGy 1.0 . 3.46 278 268 A 109 PRO HDy A 90 LYS HA 1.0 . 4.07 279 269 A 109 PRO HDx A 90 LYS HA 1.0 . 3.67 280 270 A 90 LYS HA A 108 LEU HDx% 1.0 . 4.85 281 271 A 90 LYS HA A 108 LEU HDy% 1.0 . 4.85 282 272 A 90 LYS HA A 90 LYS HDx 1.0 . 3.89 283 272 A 90 LYS HDy A 90 LYS HA 1.0 . 3.89 284 273 A 109 PRO HDy A 90 LYS HGx 1.0 . 5.44 285 274 A 109 PRO HDy A 90 LYS HGy 1.0 . 5.44 286 275 A 90 LYS HA A 90 LYS HGx 1.0 . 3.82 287 276 A 90 LYS HA A 90 LYS HGy 1.0 . 3.82 288 277 A 108 LEU HA A 90 LYS HDx 1.0 . 4.85 289 277 A 108 LEU HA A 90 LYS HDy 1.0 . 4.85 290 278 A 109 PRO HDx A 90 LYS HDx 1.0 . 5.22 291 278 A 90 LYS HDy A 109 PRO HDx 1.0 . 5.22 292 279 A 90 LYS HDx A 108 LEU HDx% 1.0 . 5.03 293 279 A 90 LYS HDy A 108 LEU HDx% 1.0 . 5.03 294 280 A 90 LYS HDy A 108 LEU HDy% 1.0 . 5.03 295 280 A 108 LEU HDy% A 90 LYS HDx 1.0 . 5.03 296 281 A 109 PRO HGy A 90 LYS HDx 1.0 . 5.11 297 281 A 90 LYS HDy A 109 PRO HGy 1.0 . 5.11 298 282 A 109 PRO HDx A 90 LYS HEx 1.0 . 4.93 299 282 A 109 PRO HDx A 90 LYS HEy 1.0 . 4.93 300 283 A 108 LEU HDy% A 90 LYS HEx 1.0 . 4.60 301 283 A 90 LYS HEy A 108 LEU HDy% 1.0 . 4.60 302 284 A 90 LYS HDx A 90 LYS HEx 1.0 . 2.99 303 284 A 90 LYS HDy A 90 LYS HEx 1.0 . 2.99 304 284 A 90 LYS HEy A 90 LYS HDx 1.0 . 2.99 305 284 A 90 LYS HDy A 90 LYS HEy 1.0 . 2.99 306 285 A 90 LYS HEy A 90 LYS HGx 1.0 . 3.53 307 285 A 90 LYS HGx A 90 LYS HEx 1.0 . 3.53 308 286 A 90 LYS HEy A 90 LYS HGy 1.0 . 3.53 309 286 A 90 LYS HEx A 90 LYS HGy 1.0 . 3.53 310 287 A 90 LYS HA A 90 LYS HEx 1.0 . 4.72 311 287 A 90 LYS HA A 90 LYS HEy 1.0 . 4.72 312 288 A 92 HIS HD2 A 91 LEU HA 1.0 . 4.72 313 289 A 87 ALA HB% A 91 LEU HA 1.0 . 5.50 314 290 A 123 MET HE% A 91 LEU HBy 1.0 . 4.61 315 291 A 93 THR HG2% A 91 LEU HBy 1.0 . 5.08 316 292 A 93 THR HB A 91 LEU HG 1.0 . 4.49 317 293 A 123 MET HE% A 91 LEU HG 1.0 . 3.92 318 294 A 93 THR HG2% A 91 LEU HG 1.0 . 4.40 319 295 A 128 LEU HBx A 91 LEU HDx% 1.0 . 2.69 320 295 A 91 LEU HDy% A 128 LEU HBx 1.0 . 2.69 321 296 A 128 LEU HBy A 91 LEU HDx% 1.0 . 3.21 322 296 A 128 LEU HBy A 91 LEU HDy% 1.0 . 3.21 323 297 A 129 ALA HB% A 91 LEU HDx% 1.0 . 3.76 324 297 A 129 ALA HB% A 91 LEU HDy% 1.0 . 3.76 325 298 A 93 THR HB A 91 LEU HDx% 1.0 . 3.96 326 298 A 91 LEU HDy% A 93 THR HB 1.0 . 3.96 327 299 A 91 LEU HBy A 91 LEU HG 1.0 . 2.98 328 300 A 91 LEU HBx A 91 LEU HDx% 1.0 . 3.09 329 300 A 91 LEU HDy% A 91 LEU HBx 1.0 . 3.09 330 301 A 91 LEU HBy A 91 LEU HDx% 1.0 . 2.91 331 301 A 91 LEU HDy% A 91 LEU HBy 1.0 . 2.91 332 302 A 91 LEU HA A 91 LEU HDx% 1.0 . 3.57 333 302 A 91 LEU HDy% A 91 LEU HA 1.0 . 3.57 334 303 A 91 LEU HA A 91 LEU HG 1.0 . 3.29 335 304 A 108 LEU HA A 109 PRO HDy 1.0 . 3.58 336 305 A 108 LEU HA A 109 PRO HDx 1.0 . 3.45 337 306 A 108 LEU HA A 109 PRO HGy 1.0 . 4.92 338 307 A 108 LEU HA A 108 LEU HDy% 1.0 . 3.18 339 308 A 108 LEU HA A 90 LYS HBy 1.0 . 5.50 340 309 A 109 PRO HBy A 108 LEU HA 1.0 . 5.50 341 310 A 109 PRO HDx A 108 LEU HDx% 1.0 . 5.13 342 311 A 90 LYS HEx A 108 LEU HDx% 1.0 . 4.60 343 311 A 90 LYS HEy A 108 LEU HDx% 1.0 . 4.60 344 312 A 109 PRO HDy A 108 LEU HDx% 1.0 . 4.38 345 313 A 108 LEU HA A 108 LEU HDx% 1.0 . 3.18 346 314 A 86 VAL HA A 84 THR HG2% 1.0 . 5.50 347 315 A 106 PHE HD% A 108 LEU HDx% 1.0 . 5.18 348 316 A 109 PRO HGy A 108 LEU HBx 1.0 . 5.20 349 316 A 108 LEU HBy A 109 PRO HGy 1.0 . 5.20 350 317 A 108 LEU HBx A 108 LEU HDx% 1.0 . 2.94 351 317 A 108 LEU HBy A 108 LEU HDx% 1.0 . 2.94 352 318 A 109 PRO HDy A 108 LEU HG 1.0 . 4.70 353 319 A 108 LEU HA A 108 LEU HG 1.0 . 4.22 354 320 A 87 ALA HB% A 108 LEU HA 1.0 . 4.35 355 321 A 108 LEU HA A 90 LYS HBx 1.0 . 5.50 356 322 A 109 PRO HDy A 108 LEU HDy% 1.0 . 4.38 357 323 A 108 LEU HDy% A 108 LEU HBx 1.0 . 2.94 358 323 A 108 LEU HBy A 108 LEU HDy% 1.0 . 2.94 359 324 A 128 LEU HBy A 128 LEU HDx% 1.0 . 3.66 360 325 A 88 LEU HDx% A 130 ARG HGx 1.0 . 3.89 361 325 A 88 LEU HDx% A 130 ARG HGy 1.0 . 3.89 362 326 A 88 LEU HDy% A 130 ARG HGx 1.0 . 4.06 363 326 A 88 LEU HDy% A 130 ARG HGy 1.0 . 4.06 364 327 A 130 ARG HA A 130 ARG HGx 1.0 . 3.51 365 327 A 130 ARG HA A 130 ARG HGy 1.0 . 3.51 366 328 A 130 ARG HDy A 130 ARG HGx 1.0 . 2.96 367 328 A 130 ARG HDx A 130 ARG HGx 1.0 . 2.96 368 328 A 130 ARG HGy A 130 ARG HDx 1.0 . 2.96 369 328 A 130 ARG HGy A 130 ARG HDy 1.0 . 2.96 370 329 A 130 ARG HDy A 130 ARG HBx 1.0 . 3.52 371 329 A 130 ARG HBx A 130 ARG HDx 1.0 . 3.52 372 330 A 130 ARG HDy A 130 ARG HBy 1.0 . 3.52 373 330 A 130 ARG HBy A 130 ARG HDx 1.0 . 3.52 374 331 A 88 LEU HDx% A 130 ARG HDx 1.0 . 4.02 375 331 A 88 LEU HDx% A 130 ARG HDy 1.0 . 4.02 376 332 A 130 ARG HA A 130 ARG HDx 1.0 . 4.15 377 332 A 130 ARG HA A 130 ARG HDy 1.0 . 4.15 378 333 A 126 ARG HBx A 126 ARG HDx 1.0 . 3.42 379 333 A 126 ARG HBx A 126 ARG HDy 1.0 . 3.42 380 334 A 126 ARG HBy A 126 ARG HDx 1.0 . 3.43 381 334 A 126 ARG HDy A 126 ARG HBy 1.0 . 3.43 382 335 A 126 ARG HA A 126 ARG HGy 1.0 . 3.76 383 336 A 126 ARG HA A 128 LEU HG 1.0 . 4.64 384 337 A 126 ARG HA A 126 ARG HDx 1.0 . 3.69 385 337 A 126 ARG HDy A 126 ARG HA 1.0 . 3.69 386 338 A 126 ARG HA A 126 ARG HGx 1.0 . 3.76 387 339 A 82 LEU HA A 115 VAL HA 1.0 . 5.07 388 340 A 82 LEU HA A 82 LEU HG 1.0 . 3.80 389 341 A 75 VAL HA A 75 VAL HGy% 1.0 . 3.24 390 342 A 75 VAL HA A 75 VAL HGx% 1.0 . 3.24 391 343 A 75 VAL HA A 76 ILE HB 1.0 . 5.50 392 344 A 79 THR HA A 79 THR HG2% 1.0 . 2.94 393 345 A 79 THR HA A 79 THR HB 1.0 . 2.94 394 346 A 114 ARG HBx A 82 LEU HBy 1.0 . 4.96 395 347 A 81 GLU HA A 82 LEU HBy 1.0 . 5.07 396 348 A 81 GLU HA A 80 SER HBx 1.0 . 4.52 397 348 A 80 SER HBy A 81 GLU HA 1.0 . 4.52 398 349 A 127 GLY HAy A 128 LEU HA 1.0 . 4.66 399 350 A 81 GLU HA A 81 GLU HGx 1.0 . 3.58 400 351 A 81 GLU HA A 81 GLU HGy 1.0 . 3.58 401 352 A 124 THR HG2% A 131 MET HGy 1.0 . 4.11 402 353 A 131 MET HA A 131 MET HGx 1.0 . 4.08 403 354 A 131 MET HA A 131 MET HGy 1.0 . 4.08 404 355 A 113 PHE HD% A 123 MET HGx 1.0 . 5.50 405 356 A 123 MET HGx A 85 VAL HB 1.0 . 5.24 406 357 A 129 ALA HB% A 123 MET HBy 1.0 . 4.79 407 358 A 123 MET HGy A 123 MET HA 1.0 . 3.56 408 359 A 123 MET HA A 123 MET HGx 1.0 . 3.88 409 360 A 104 VAL HA A 105 ALA HB% 1.0 . 4.19 410 361 A 96 LEU HA A 104 VAL HB 1.0 . 5.38 411 362 A 113 PHE HBy A 104 VAL HB 1.0 . 5.50 412 363 A 113 PHE HBx A 104 VAL HGy% 1.0 . 4.11 413 364 A 113 PHE HD% A 104 VAL HGy% 1.0 . 5.03 414 365 A 113 PHE HBx A 104 VAL HGx% 1.0 . 4.11 415 366 A 105 ALA HA A 104 VAL HGx% 1.0 . 5.47 416 367 A 106 PHE HA A 106 PHE HD% 1.0 . 3.85 417 368 A 106 PHE HA A 105 ALA HB% 1.0 . 4.71 418 369 A 106 PHE HA A 107 VAL HGy% 1.0 . 5.50 419 370 A 106 PHE HA A 93 THR HG2% 1.0 . 4.19 420 371 A 92 HIS HA A 106 PHE HBy 1.0 . 5.00 421 372 A 90 LYS HEx A 108 LEU HBx 1.0 . 5.50 422 372 A 90 LYS HEy A 108 LEU HBx 1.0 . 5.50 423 372 A 108 LEU HBy A 90 LYS HEx 1.0 . 5.50 424 372 A 108 LEU HBy A 90 LYS HEy 1.0 . 5.50 425 373 A 113 PHE HA A 104 VAL HGx% 1.0 . 5.50 426 374 A 113 PHE HA A 104 VAL HGy% 1.0 . 5.50 427 375 A 84 THR HA A 113 PHE HA 1.0 . 5.50 428 376 A 111 THR HB A 113 PHE HBy 1.0 . 5.11 429 377 A 74 THR HB A 75 VAL HB 1.0 . 5.50 430 378 A 74 THR HG2% A 73 ASP H 1.0 . 5.50 431 379 A 74 THR HG2% A 75 VAL HB 1.0 . 4.72 432 380 A 74 THR HG2% A 74 THR HA 1.0 . 2.95 433 381 A 124 THR HG2% A 125 GLU HA 1.0 . 5.50 434 382 A 122 GLU HA A 122 GLU HGx 1.0 . 3.15 435 382 A 122 GLU HGy A 122 GLU HA 1.0 . 3.15 436 383 A 122 GLU HGy A 122 GLU HBx 1.0 . 2.76 437 383 A 122 GLU HBx A 122 GLU HGx 1.0 . 2.76 438 384 A 122 GLU HGy A 122 GLU HBy 1.0 . 2.76 439 384 A 122 GLU HBy A 122 GLU HGx 1.0 . 2.76 440 385 A 100 ARG HBx A 102 GLU HBx 1.0 . 4.93 441 386 A 100 ARG HBx A 102 GLU HBy 1.0 . 4.93 442 387 A 102 GLU HA A 102 GLU HGy 1.0 . 3.77 443 388 A 102 GLU HA A 102 GLU HGx 1.0 . 3.77 444 389 A 128 LEU HA A 89 VAL HB 1.0 . 5.50 445 390 A 77 LEU HA A 79 THR HG2% 1.0 . 4.91 446 391 A 77 LEU HA A 77 LEU HBx 1.0 . 2.78 447 392 A 88 LEU HA A 88 LEU HBx 1.0 . 2.98 448 393 A 88 LEU HDy% A 130 ARG HDx 1.0 . 3.48 449 393 A 88 LEU HDy% A 130 ARG HDy 1.0 . 3.48 450 394 A 128 LEU HBx A 128 LEU HDy% 1.0 . 3.93 451 395 A 88 LEU HDx% A 128 LEU HA 1.0 . 4.43 452 396 A 88 LEU HDx% A 127 GLY HAx 1.0 . 4.31 453 397 A 88 LEU HDx% A 130 ARG HBy 1.0 . 4.13 454 398 A 88 LEU HDx% A 88 LEU HBx 1.0 . 2.91 455 399 A 88 LEU HBy A 88 LEU HDx% 1.0 . 3.04 456 400 A 88 LEU HDx% A 88 LEU HA 1.0 . 4.09 457 401 A 88 LEU HDy% A 88 LEU HA 1.0 . 2.85 458 402 A 88 LEU HDy% A 88 LEU HBx 1.0 . 3.30 459 403 A 88 LEU HG A 88 LEU HA 1.0 . 3.58 460 404 A 92 HIS HA A 91 LEU HA 1.0 . 4.95 461 405 A 96 LEU HBy A 98 ALA HB% 1.0 . 5.50 462 406 A 96 LEU HBx A 96 LEU HDy% 1.0 . 3.35 463 407 A 96 LEU HA A 103 PRO HBy 1.0 . 4.90 464 408 A 96 LEU HBy A 96 LEU HG 1.0 . 2.83 465 409 A 96 LEU HG A 96 LEU HBx 1.0 . 2.87 466 410 A 96 LEU HA A 96 LEU HDx% 1.0 . 3.40 467 411 A 96 LEU HA A 96 LEU HG 1.0 . 3.82 468 412 A 96 LEU HBy A 96 LEU HDx% 1.0 . 3.39 469 413 A 96 LEU HBx A 96 LEU HDx% 1.0 . 3.35 470 414 A 96 LEU HA A 96 LEU HDy% 1.0 . 3.40 471 415 A 103 PRO HA A 96 LEU HDy% 1.0 . 3.48 472 416 A 96 LEU HBy A 96 LEU HDy% 1.0 . 3.39 473 417 A 96 LEU HDy% A 103 PRO HGy 1.0 . 4.97 474 418 A 85 VAL HA A 84 THR HB 1.0 . 5.41 475 419 A 132 GLN HA A 85 VAL HA 1.0 . 5.50 476 420 A 131 MET HBy A 85 VAL HA 1.0 . 4.87 477 421 A 131 MET HA A 84 THR HG2% 1.0 . 5.12 478 422 A 129 ALA HB% A 128 LEU HA 1.0 . 5.47 479 423 A 131 MET HA A 85 VAL HB 1.0 . 4.05 480 424 A 86 VAL HA A 85 VAL HA 1.0 . 4.62 481 425 A 88 LEU HA A 109 PRO HBx 1.0 . 4.54 482 426 A 88 LEU HA A 109 PRO HBy 1.0 . 4.78 483 427 A 129 ALA HB% A 88 LEU HA 1.0 . 5.50 484 428 A 94 ASP HA A 104 VAL HGx% 1.0 . 5.50 485 429 A 94 ASP HA A 104 VAL HGy% 1.0 . 5.50 486 430 A 124 THR HB A 130 ARG HGx 1.0 . 5.09 487 430 A 130 ARG HGy A 124 THR HB 1.0 . 5.09 488 431 A 126 ARG HA A 128 LEU HDy% 1.0 . 5.50 489 432 A 87 ALA HA A 107 VAL HGx% 1.0 . 5.50 490 433 A 87 ALA HB% A 107 VAL HA 1.0 . 4.92 491 434 A 107 VAL HA A 108 LEU HG 1.0 . 5.30 492 435 A 73 ASP HA A 72 PRO HGx 1.0 . 5.28 493 435 A 72 PRO HGy A 73 ASP HA 1.0 . 5.28 494 436 A 93 THR HB A 107 VAL HGx% 1.0 . 5.50 495 437 A 106 PHE HA A 107 VAL HGx% 1.0 . 5.50 496 438 A 131 MET HA A 85 VAL HGx% 1.0 . 4.52 497 439 A 128 LEU HA A 91 LEU HDx% 1.0 . 4.34 498 439 A 91 LEU HDy% A 128 LEU HA 1.0 . 4.34 499 440 A 92 HIS HA A 91 LEU HDx% 1.0 . 5.50 500 440 A 92 HIS HA A 91 LEU HDy% 1.0 . 5.50 501 441 A 129 ALA HA A 91 LEU HDx% 1.0 . 5.50 502 441 A 129 ALA HA A 91 LEU HDy% 1.0 . 5.50 503 442 A 94 ASP HA A 105 ALA HB% 1.0 . 4.65 504 443 A 100 ARG HBx A 100 ARG HGx 1.0 . 2.93 505 443 A 100 ARG HGy A 100 ARG HBx 1.0 . 2.93 506 444 A 100 ARG HBx A 100 ARG HDy 1.0 . 3.71 507 445 A 100 ARG HBx A 100 ARG HDx 1.0 . 3.71 508 446 A 114 ARG HA A 84 THR HA 1.0 . 3.32 509 447 A 112 ALA HA A 86 VAL HA 1.0 . 2.93 510 448 A 129 ALA HA A 88 LEU HDx% 1.0 . 3.72 511 449 A 124 THR HA A 127 GLY HAx 1.0 . 5.16 512 450 A 95 ALA HB% A 115 VAL HA 1.0 . 4.25 513 451 A 114 ARG HA A 115 VAL HGy% 1.0 . 5.50 514 452 A 84 THR HG2% A 113 PHE HA 1.0 . 5.21 515 453 A 112 ALA HB% A 86 VAL HB 1.0 . 4.11 516 454 A 84 THR HG2% A 114 ARG HE 1.0 . 4.91 517 455 A 93 THR HG2% A 104 VAL HB 1.0 . 4.58 518 456 A 96 LEU HDx% A 103 PRO HDy 1.0 . 5.43 519 457 A 103 PRO HDx A 96 LEU HDx% 1.0 . 5.43 520 458 A 96 LEU HDy% A 103 PRO HDx 1.0 . 5.43 521 459 A 97 HIS HE1 A 100 ARG HGx 1.0 . 4.44 522 459 A 100 ARG HGy A 97 HIS HE1 1.0 . 4.44 523 460 A 98 ALA HB% A 82 LEU HG 1.0 . 4.21 524 461 A 96 LEU HDy% A 103 PRO HDy 1.0 . 5.43 525 462 A 92 HIS HD2 A 91 LEU HDx% 1.0 . 4.91 526 462 A 91 LEU HDy% A 92 HIS HD2 1.0 . 4.91 527 463 A 109 PRO HA A 89 VAL HA 1.0 . 4.68 528 464 A 109 PRO HBy A 89 VAL HA 1.0 . 3.76 529 465 A 116 SER HA A 82 LEU HBx 1.0 . 5.50 530 466 A 88 LEU HDx% A 130 ARG HBx 1.0 . 4.13 531 467 A 109 PRO HA A 88 LEU HA 1.0 . 4.73 532 468 A 78 ASP HA A 77 LEU HBy 1.0 . 4.72 533 469 A 74 THR HA A 73 ASP HBx 1.0 . 5.50 534 470 A 74 THR HA A 73 ASP HBy 1.0 . 5.50 535 471 A 126 ARG HA A 128 LEU HDx% 1.0 . 5.50 536 472 A 113 PHE HD% A 113 PHE HA 1.0 . 3.80 537 473 A 92 HIS HD2 A 106 PHE HBy 1.0 . 4.66 538 474 A 106 PHE HBx A 92 HIS HD2 1.0 . 4.67 539 475 A 106 PHE HA A 92 HIS HD2 1.0 . 4.56 540 476 A 131 MET HE% A 85 VAL HGx% 1.0 . 4.71 541 477 A 131 MET HE% A 83 VAL HGx% 1.0 . 3.31 542 478 A 131 MET HE% A 120 ALA HB% 1.0 . 2.89 543 479 A 124 THR HG2% A 131 MET HE% 1.0 . 3.33 544 480 A 131 MET HE% A 85 VAL HB 1.0 . 4.23 545 481 A 131 MET HE% A 131 MET HGy 1.0 . 3.30 546 482 A 131 MET HE% A 131 MET HGx 1.0 . 3.30 547 483 A 131 MET HE% A 120 ALA HA 1.0 . 4.62 548 484 A 131 MET HE% A 121 ALA HA 1.0 . 4.39 549 485 A 131 MET HE% A 131 MET HA 1.0 . 4.41 550 486 A 131 MET HE% A 124 THR HB 1.0 . 4.87 551 487 A 104 VAL HA A 104 VAL HGx% 1.0 . 3.69 552 488 A 113 PHE HBx A 107 VAL HGy% 1.0 . 5.50 553 489 A 113 PHE HBy A 107 VAL HGy% 1.0 . 4.91 554 490 A 113 PHE HD% A 93 THR HG2% 1.0 . 3.87 555 491 A 113 PHE HD% A 114 ARG HA 1.0 . 5.50 556 492 A 72 PRO HA A 73 ASP HBx 1.0 . 5.50 557 493 A 72 PRO HA A 73 ASP HBy 1.0 . 5.50 558 494 A 129 ALA HB% A 85 VAL HGy% 1.0 . 3.86 559 495 A 124 THR HG2% A 85 VAL HGy% 1.0 . 4.37 560 496 A 123 MET HBx A 85 VAL HGy% 1.0 . 5.22 561 497 A 76 ILE HG2% A 78 ASP HBy 1.0 . 5.44 562 498 A 83 VAL HA A 84 THR HA 1.0 . 4.62 563 499 A 84 THR HA A 85 VAL HGx% 1.0 . 5.50 564 500 A 84 THR HA A 85 VAL HGy% 1.0 . 5.50 565 501 A 85 VAL HA A 85 VAL HGy% 1.0 . 3.83 566 502 A 87 ALA HB% A 91 LEU HBy 1.0 . 3.98 567 503 A 109 PRO HDy A 90 LYS HEx 1.0 . 5.24 568 503 A 109 PRO HDy A 90 LYS HEy 1.0 . 5.24 569 504 A 123 MET HGy A 91 LEU HDx% 1.0 . 5.50 570 504 A 123 MET HGy A 91 LEU HDy% 1.0 . 5.50 571 505 A 113 PHE HD% A 93 THR HB 1.0 . 5.50 572 506 A 113 PHE HE% A 93 THR HB 1.0 . 5.41 573 507 A 113 PHE HD% A 111 THR HG2% 1.0 . 3.87 574 508 A 113 PHE HE% A 111 THR HG2% 1.0 . 5.50 575 509 A 112 ALA HA A 113 PHE HA 1.0 . 5.31 576 510 A 115 VAL HA A 119 VAL HGx% 1.0 . 5.26 577 511 A 120 ALA HA A 85 VAL HGy% 1.0 . 4.50 578 512 A 120 ALA HB% A 85 VAL HGy% 1.0 . 4.19 579 513 A 131 MET HE% A 85 VAL HGy% 1.0 . 4.71 580 514 A 93 THR HG2% A 123 MET HE% 1.0 . 3.08 581 515 A 87 ALA HA A 123 MET HE% 1.0 . 5.07 582 516 A 123 MET HE% A 85 VAL HGy% 1.0 . 5.06 583 517 A 131 MET HA A 85 VAL HGy% 1.0 . 4.52 584 518 A 113 PHE HE% A 129 ALA HA 1.0 . 5.18 585 519 A 129 ALA HA A 123 MET HE% 1.0 . 5.22 586 520 A 106 PHE HA A 93 THR HB 1.0 . 5.50 587 521 A 104 VAL HA A 105 ALA HA 1.0 . 5.05 588 522 A 104 VAL HA A 93 THR HG2% 1.0 . 5.50 589 523 A 123 MET HA A 123 MET HE% 1.0 . 3.94 590 524 A 93 THR HB A 123 MET HE% 1.0 . 3.60 591 525 A 123 MET HE% A 85 VAL HGx% 1.0 . 5.06 592 526 A 123 MET HE% A 91 LEU HDx% 1.0 . 2.83 593 526 A 91 LEU HDy% A 123 MET HE% 1.0 . 2.83 594 527 A 129 ALA HB% A 123 MET HE% 1.0 . 2.85 595 528 A 95 ALA HB% A 123 MET HE% 1.0 . 4.32 596 529 A 123 MET HBx A 123 MET HE% 1.0 . 2.98 597 530 A 113 PHE HE% A 123 MET HE% 1.0 . 2.96 598 531 A 123 MET HGx A 123 MET HE% 1.0 . 3.08 599 532 A 123 MET HGy A 123 MET HE% 1.0 . 3.39 600 533 A 112 ALA HB% A 84 THR HA 1.0 . 5.10 601 534 A 108 LEU HA A 90 LYS HA 1.0 . 3.54 602 535 A 109 PRO HGy A 90 LYS HA 1.0 . 5.05 603 536 A 106 PHE HD% A 108 LEU HDy% 1.0 . 5.18 604 537 A 93 THR HG2% A 106 PHE HBx 1.0 . 5.50 605 538 A 114 ARG HBx A 82 LEU HBx 1.0 . 4.03 606 539 A 114 ARG HA A 82 LEU HBx 1.0 . 5.50 607 540 A 115 VAL HA A 82 LEU HG 1.0 . 5.44 608 541 A 114 ARG HA A 82 LEU HG 1.0 . 5.50 609 542 A 114 ARG HBx A 82 LEU HG 1.0 . 3.78 610 543 A 82 LEU HG A 82 LEU HBx 1.0 . 2.98 611 544 A 82 LEU HG A 114 ARG HBy 1.0 . 3.40 612 545 A 79 THR HB A 80 SER HBx 1.0 . 5.24 613 545 A 80 SER HBy A 79 THR HB 1.0 . 5.24 614 546 A 82 LEU HA A 98 ALA HB% 1.0 . 4.85 615 547 A 127 GLY HAy A 126 ARG HA 1.0 . 5.43 616 548 A 128 LEU HA A 127 GLY HAx 1.0 . 4.84 617 549 A 115 VAL HA A 98 ALA HB% 1.0 . 5.46 618 550 A 128 LEU HA A 128 LEU HG 1.0 . 3.41 619 551 A 126 ARG HBy A 128 LEU HG 1.0 . 4.03 620 552 A 128 LEU HBy A 123 MET HA 1.0 . 5.41 621 553 A 128 LEU HBy A 128 LEU HDy% 1.0 . 3.66 622 554 A 128 LEU HBx A 128 LEU HDx% 1.0 . 3.93 623 555 A 123 MET HA A 126 ARG HDx 1.0 . 5.50 624 555 A 123 MET HA A 126 ARG HDy 1.0 . 5.50 625 556 A 122 GLU HA A 126 ARG HDx 1.0 . 5.50 626 556 A 126 ARG HDy A 122 GLU HA 1.0 . 5.50 627 557 A 114 ARG HA A 84 THR HB 1.0 . 5.50 628 558 A 113 PHE HE% A 111 THR HB 1.0 . 5.50 629 559 A 113 PHE HD% A 111 THR HB 1.0 . 5.21 630 560 A 129 ALA HA A 124 THR HA 1.0 . 5.45 631 561 A 129 ALA HB% A 86 VAL HA 1.0 . 5.50 632 562 A 97 HIS HA A 98 ALA HA 1.0 . 4.50 633 563 A 97 HIS HD2 A 98 ALA HA 1.0 . 5.50 634 564 A 111 THR HA A 110 GLY HAx 1.0 . 5.50 635 565 A 100 ARG HBy A 101 ASP HA 1.0 . 5.39 636 566 A 100 ARG HBx A 101 ASP HBy 1.0 . 5.50 637 567 A 100 ARG HBx A 101 ASP HBx 1.0 . 5.50 638 568 A 105 ALA HA A 104 VAL HB 1.0 . 5.50 639 569 A 97 HIS HA A 115 VAL HA 1.0 . 5.50 640 570 A 97 HIS HA A 100 ARG HBy 1.0 . 5.03 641 571 A 97 HIS HA A 100 ARG HBx 1.0 . 5.50 642 572 A 100 ARG HBx A 97 HIS HBy 1.0 . 4.73 643 573 A 100 ARG HBx A 97 HIS HBx 1.0 . 4.73 644 574 A 93 THR HG2% A 113 PHE HBx 1.0 . 5.50 645 575 A 105 ALA HA A 93 THR HA 1.0 . 5.50 646 576 A 114 ARG HA A 115 VAL HGx% 1.0 . 5.50 647 577 A 121 ALA HA A 120 ALA HA 1.0 . 4.98 648 578 A 120 ALA HB% A 115 VAL HA 1.0 . 5.50 649 579 A 119 VAL HB A 117 ALA HA 1.0 . 5.50 650 580 A 84 THR HG2% A 114 ARG HBx 1.0 . 5.18 651 581 A 96 LEU HA A 104 VAL HA 1.0 . 5.46 652 582 A 96 LEU HA A 97 HIS HA 1.0 . 5.50 653 583 A 94 ASP HA A 93 THR HA 1.0 . 5.05 654 584 A 73 ASP H A 72 PRO HA 1.0 . 2.82 655 585 A 73 ASP H A 72 PRO HGx 1.0 . 4.79 656 585 A 73 ASP H A 72 PRO HGy 1.0 . 4.79 657 586 A 73 ASP H A 74 THR H 1.0 . 3.30 658 587 A 73 ASP H A 75 VAL H 1.0 . 4.38 659 588 A 73 ASP HA A 74 THR H 1.0 . 3.54 660 589 A 74 THR H A 73 ASP HBx 1.0 . 4.99 661 590 A 74 THR H A 73 ASP HBy 1.0 . 4.99 662 591 A 74 THR HB A 74 THR H 1.0 . 3.17 663 592 A 74 THR HG2% A 74 THR H 1.0 . 3.86 664 593 A 74 THR H A 72 PRO HGx 1.0 . 5.50 665 593 A 72 PRO HGy A 74 THR H 1.0 . 5.50 666 594 A 75 VAL HB A 74 THR H 1.0 . 5.50 667 595 A 74 THR HG2% A 75 VAL H 1.0 . 3.98 668 596 A 74 THR HB A 75 VAL H 1.0 . 3.38 669 597 A 75 VAL HB A 75 VAL H 1.0 . 3.87 670 598 A 75 VAL H A 75 VAL HGy% 1.0 . 3.95 671 599 A 75 VAL H A 75 VAL HGx% 1.0 . 3.95 672 600 A 75 VAL HB A 76 ILE H 1.0 . 4.66 673 601 A 76 ILE HG2% A 76 ILE H 1.0 . 4.33 674 602 A 76 ILE HD1% A 76 ILE H 1.0 . 4.60 675 603 A 75 VAL HA A 76 ILE H 1.0 . 3.12 676 604 A 76 ILE HB A 76 ILE H 1.0 . 3.00 677 605 A 76 ILE H A 76 ILE HG1y 1.0 . 4.15 678 606 A 74 THR HG2% A 76 ILE H 1.0 . 4.01 679 607 A 76 ILE H A 76 ILE HG1x 1.0 . 4.15 680 608 A 76 ILE HB A 77 LEU H 1.0 . 4.41 681 609 A 76 ILE HG2% A 77 LEU H 1.0 . 3.22 682 610 A 77 LEU HBy A 77 LEU H 1.0 . 3.14 683 611 A 77 LEU HBx A 77 LEU H 1.0 . 2.78 684 612 A 79 THR HG2% A 78 ASP H 1.0 . 4.61 685 613 A 77 LEU HA A 78 ASP H 1.0 . 2.53 686 614 A 77 LEU HBy A 78 ASP H 1.0 . 4.25 687 615 A 79 THR HB A 79 THR H 1.0 . 4.06 688 616 A 79 THR HG2% A 79 THR H 1.0 . 3.25 689 617 A 79 THR HA A 80 SER H 1.0 . 3.20 690 618 A 79 THR HG2% A 80 SER H 1.0 . 4.16 691 619 A 80 SER H A 80 SER HBx 1.0 . 3.29 692 619 A 80 SER HBy A 80 SER H 1.0 . 3.29 693 620 A 80 SER H A 81 GLU H 1.0 . 3.31 694 621 A 81 GLU H A 80 SER HBx 1.0 . 4.10 695 621 A 80 SER HBy A 81 GLU H 1.0 . 4.10 696 622 A 80 SER HA A 81 GLU H 1.0 . 3.15 697 623 A 81 GLU H A 82 LEU H 1.0 . 3.53 698 624 A 82 LEU HBx A 82 LEU H 1.0 . 3.45 699 625 A 82 LEU H A 80 SER HBx 1.0 . 5.34 700 625 A 80 SER HBy A 82 LEU H 1.0 . 5.34 701 626 A 81 GLU HA A 82 LEU H 1.0 . 2.81 702 627 A 82 LEU H A 81 GLU HBx 1.0 . 4.77 703 628 A 82 LEU H A 81 GLU HBy 1.0 . 4.77 704 629 A 82 LEU HBy A 82 LEU H 1.0 . 3.07 705 630 A 82 LEU H A 83 VAL H 1.0 . 4.67 706 631 A 82 LEU HA A 83 VAL H 1.0 . 2.61 707 632 A 82 LEU HBy A 83 VAL H 1.0 . 4.45 708 633 A 83 VAL HB A 83 VAL H 1.0 . 3.83 709 634 A 83 VAL H A 83 VAL HGx% 1.0 . 3.92 710 635 A 83 VAL H A 83 VAL HGy% 1.0 . 3.92 711 636 A 115 VAL HA A 83 VAL H 1.0 . 4.62 712 637 A 114 ARG HA A 83 VAL H 1.0 . 4.61 713 638 A 114 ARG HBx A 83 VAL H 1.0 . 4.22 714 639 A 83 VAL H A 115 VAL H 1.0 . 3.30 715 640 A 83 VAL H A 116 SER H 1.0 . 4.85 716 641 A 117 ALA HA A 83 VAL H 1.0 . 5.14 717 642 A 117 ALA HB% A 83 VAL H 1.0 . 5.39 718 643 A 82 LEU HBx A 83 VAL H 1.0 . 3.64 719 644 A 83 VAL H A 84 THR H 1.0 . 4.65 720 645 A 83 VAL HA A 84 THR H 1.0 . 2.48 721 646 A 83 VAL HB A 84 THR H 1.0 . 3.12 722 647 A 84 THR HB A 84 THR H 1.0 . 2.82 723 648 A 84 THR HG2% A 84 THR H 1.0 . 3.94 724 649 A 114 ARG HBx A 84 THR H 1.0 . 4.94 725 650 A 85 VAL HA A 85 VAL H 1.0 . 2.94 726 651 A 84 THR HA A 85 VAL H 1.0 . 2.59 727 652 A 84 THR HG2% A 85 VAL H 1.0 . 3.22 728 653 A 98 ALA HB% A 97 HIS H 1.0 . 5.50 729 654 A 112 ALA HB% A 85 VAL H 1.0 . 4.72 730 655 A 85 VAL H A 113 PHE H 1.0 . 3.82 731 656 A 114 ARG HA A 85 VAL H 1.0 . 3.55 732 657 A 131 MET HA A 85 VAL H 1.0 . 4.83 733 658 A 85 VAL H A 86 VAL H 1.0 . 4.38 734 659 A 85 VAL HA A 86 VAL H 1.0 . 2.85 735 660 A 85 VAL HB A 86 VAL H 1.0 . 4.37 736 661 A 132 GLN HBx A 86 VAL H 1.0 . 4.52 737 662 A 86 VAL H A 85 VAL HGx% 1.0 . 4.38 738 663 A 86 VAL H A 85 VAL HGy% 1.0 . 4.38 739 664 A 86 VAL H A 87 ALA H 1.0 . 4.63 740 665 A 112 ALA HA A 86 VAL H 1.0 . 4.77 741 666 A 112 ALA HB% A 86 VAL H 1.0 . 4.65 742 667 A 129 ALA HA A 86 VAL H 1.0 . 5.50 743 668 A 129 ALA HB% A 86 VAL H 1.0 . 4.28 744 669 A 86 VAL H A 130 ARG H 1.0 . 3.58 745 670 A 132 GLN HBy A 86 VAL H 1.0 . 5.50 746 671 A 131 MET HA A 86 VAL H 1.0 . 3.83 747 672 A 132 GLN HA A 86 VAL H 1.0 . 4.85 748 673 A 86 VAL HA A 87 ALA H 1.0 . 2.75 749 674 A 86 VAL HB A 87 ALA H 1.0 . 4.10 750 675 A 87 ALA HB% A 87 ALA H 1.0 . 2.95 751 676 A 87 ALA H A 110 GLY H 1.0 . 4.05 752 677 A 87 ALA H A 107 VAL HGx% 1.0 . 4.84 753 678 A 87 ALA H A 107 VAL HGy% 1.0 . 4.84 754 679 A 109 PRO HA A 87 ALA H 1.0 . 5.07 755 680 A 111 THR HG2% A 87 ALA H 1.0 . 5.25 756 681 A 112 ALA HA A 87 ALA H 1.0 . 3.90 757 682 A 112 ALA HB% A 87 ALA H 1.0 . 5.30 758 683 A 113 PHE HD% A 87 ALA H 1.0 . 3.51 759 684 A 113 PHE HE% A 87 ALA H 1.0 . 3.51 760 685 A 129 ALA HB% A 87 ALA H 1.0 . 4.42 761 686 A 87 ALA H A 130 ARG H 1.0 . 5.10 762 687 A 87 ALA HA A 88 LEU H 1.0 . 2.81 763 688 A 87 ALA HB% A 88 LEU H 1.0 . 3.38 764 689 A 88 LEU HBy A 88 LEU H 1.0 . 3.16 765 690 A 88 LEU HG A 88 LEU H 1.0 . 3.45 766 691 A 88 LEU HDx% A 88 LEU H 1.0 . 3.95 767 692 A 88 LEU HDy% A 88 LEU H 1.0 . 3.70 768 693 A 113 PHE HE% A 88 LEU H 1.0 . 5.45 769 694 A 129 ALA HB% A 88 LEU H 1.0 . 3.76 770 695 A 130 ARG H A 88 LEU H 1.0 . 4.74 771 696 A 87 ALA HA A 89 VAL H 1.0 . 3.95 772 697 A 87 ALA HB% A 89 VAL H 1.0 . 3.38 773 698 A 88 LEU H A 89 VAL H 1.0 . 2.91 774 699 A 88 LEU HBy A 89 VAL H 1.0 . 3.46 775 700 A 88 LEU HG A 89 VAL H 1.0 . 4.23 776 701 A 89 VAL H A 89 VAL HGx% 1.0 . 3.46 777 702 A 89 VAL H A 89 VAL HGy% 1.0 . 3.46 778 703 A 89 VAL H A 91 LEU HDx% 1.0 . 4.92 779 703 A 91 LEU HDy% A 89 VAL H 1.0 . 4.92 780 704 A 109 PRO HA A 89 VAL H 1.0 . 4.48 781 705 A 109 PRO HBy A 89 VAL H 1.0 . 4.17 782 706 A 129 ALA HA A 89 VAL H 1.0 . 4.66 783 707 A 89 VAL H A 90 LYS H 1.0 . 4.49 784 708 A 89 VAL HA A 90 LYS H 1.0 . 2.86 785 709 A 89 VAL HB A 90 LYS H 1.0 . 2.93 786 710 A 90 LYS H A 89 VAL HGx% 1.0 . 3.92 787 711 A 90 LYS H A 89 VAL HGy% 1.0 . 3.92 788 712 A 90 LYS H A 90 LYS HBx 1.0 . 3.64 789 713 A 90 LYS H A 90 LYS HBy 1.0 . 3.64 790 714 A 90 LYS H A 90 LYS HGx 1.0 . 3.89 791 715 A 90 LYS H A 90 LYS HGy 1.0 . 3.89 792 716 A 90 LYS H A 90 LYS HEx 1.0 . 5.03 793 716 A 90 LYS HEy A 90 LYS H 1.0 . 5.03 794 717 A 106 PHE HBy A 93 THR H 1.0 . 4.70 795 718 A 109 PRO HDy A 90 LYS H 1.0 . 4.74 796 719 A 109 PRO HDx A 90 LYS H 1.0 . 3.99 797 720 A 109 PRO HGy A 90 LYS H 1.0 . 3.73 798 721 A 87 ALA HB% A 91 LEU H 1.0 . 4.03 799 722 A 91 LEU HG A 91 LEU H 1.0 . 4.95 800 723 A 90 LYS HA A 91 LEU H 1.0 . 2.68 801 724 A 91 LEU H A 90 LYS HDx 1.0 . 5.48 802 724 A 90 LYS HDy A 91 LEU H 1.0 . 5.48 803 725 A 91 LEU HBx A 91 LEU H 1.0 . 3.57 804 726 A 91 LEU HBy A 91 LEU H 1.0 . 3.22 805 727 A 91 LEU H A 91 LEU HDx% 1.0 . 4.44 806 727 A 91 LEU HDy% A 91 LEU H 1.0 . 4.44 807 728 A 106 PHE HA A 91 LEU H 1.0 . 5.50 808 729 A 108 LEU HA A 91 LEU H 1.0 . 3.80 809 730 A 109 PRO HDx A 91 LEU H 1.0 . 4.50 810 731 A 91 LEU H A 92 HIS H 1.0 . 4.57 811 732 A 91 LEU HA A 92 HIS H 1.0 . 2.83 812 733 A 91 LEU HBy A 92 HIS H 1.0 . 4.33 813 734 A 91 LEU HG A 92 HIS H 1.0 . 4.00 814 735 A 92 HIS H A 91 LEU HDx% 1.0 . 4.24 815 735 A 91 LEU HDy% A 92 HIS H 1.0 . 4.24 816 736 A 106 PHE HBy A 92 HIS H 1.0 . 5.41 817 737 A 93 THR H A 92 HIS H 1.0 . 4.30 818 738 A 92 HIS HA A 93 THR H 1.0 . 2.55 819 739 A 93 THR HB A 93 THR H 1.0 . 3.93 820 740 A 93 THR HG2% A 93 THR H 1.0 . 3.24 821 741 A 106 PHE HBx A 93 THR H 1.0 . 4.76 822 742 A 93 THR H A 106 PHE H 1.0 . 4.73 823 743 A 93 THR HA A 94 ASP H 1.0 . 2.78 824 744 A 93 THR HB A 94 ASP H 1.0 . 4.32 825 745 A 93 THR HG2% A 94 ASP H 1.0 . 4.12 826 746 A 94 ASP H A 94 ASP HBx 1.0 . 3.78 827 747 A 94 ASP H A 94 ASP HBy 1.0 . 3.78 828 748 A 95 ALA HA A 94 ASP H 1.0 . 5.13 829 749 A 93 THR HG2% A 95 ALA H 1.0 . 3.97 830 750 A 94 ASP HA A 95 ALA H 1.0 . 2.76 831 751 A 95 ALA HB% A 95 ALA H 1.0 . 3.10 832 752 A 96 LEU HBx A 95 ALA H 1.0 . 5.50 833 753 A 104 VAL HB A 95 ALA H 1.0 . 4.35 834 754 A 95 ALA H A 104 VAL HGx% 1.0 . 4.58 835 755 A 95 ALA H A 104 VAL HGy% 1.0 . 4.58 836 756 A 95 ALA H A 96 LEU H 1.0 . 4.38 837 757 A 95 ALA HA A 96 LEU H 1.0 . 3.17 838 758 A 95 ALA HB% A 96 LEU H 1.0 . 3.53 839 759 A 96 LEU HBx A 96 LEU H 1.0 . 3.15 840 760 A 113 PHE HD% A 85 VAL H 1.0 . 4.79 841 761 A 95 ALA HB% A 97 HIS H 1.0 . 5.36 842 762 A 96 LEU HA A 97 HIS H 1.0 . 2.88 843 763 A 96 LEU HBx A 97 HIS H 1.0 . 4.70 844 764 A 96 LEU HBy A 97 HIS H 1.0 . 3.81 845 765 A 97 HIS H A 97 HIS HBx 1.0 . 3.74 846 766 A 97 HIS HD2 A 97 HIS H 1.0 . 4.81 847 767 A 97 HIS H A 102 GLU H 1.0 . 4.02 848 768 A 102 GLU HA A 97 HIS H 1.0 . 5.45 849 769 A 97 HIS HA A 98 ALA H 1.0 . 2.63 850 770 A 98 ALA H A 97 HIS HBx 1.0 . 4.67 851 771 A 98 ALA H A 97 HIS HBy 1.0 . 4.67 852 772 A 97 HIS HD2 A 98 ALA H 1.0 . 4.71 853 773 A 98 ALA HB% A 98 ALA H 1.0 . 2.70 854 774 A 97 HIS HA A 100 ARG H 1.0 . 4.62 855 775 A 98 ALA H A 100 ARG H 1.0 . 4.09 856 776 A 98 ALA HA A 100 ARG H 1.0 . 5.42 857 777 A 100 ARG HBx A 100 ARG H 1.0 . 3.69 858 778 A 100 ARG HBy A 100 ARG H 1.0 . 3.71 859 779 A 100 ARG H A 100 ARG HDx 1.0 . 5.50 860 780 A 100 ARG H A 100 ARG HDy 1.0 . 5.50 861 781 A 100 ARG H A 100 ARG HGx 1.0 . 3.51 862 781 A 100 ARG HGy A 100 ARG H 1.0 . 3.51 863 782 A 100 ARG HA A 101 ASP H 1.0 . 2.88 864 783 A 100 ARG HBy A 101 ASP H 1.0 . 3.66 865 784 A 100 ARG HBx A 101 ASP H 1.0 . 3.86 866 785 A 101 ASP H A 100 ARG HGx 1.0 . 3.83 867 785 A 100 ARG HGy A 101 ASP H 1.0 . 3.83 868 786 A 101 ASP H A 101 ASP HBy 1.0 . 3.67 869 787 A 101 ASP H A 101 ASP HBx 1.0 . 3.67 870 788 A 100 ARG HBx A 102 GLU H 1.0 . 4.11 871 789 A 102 GLU H A 102 GLU HBx 1.0 . 3.60 872 790 A 97 HIS HA A 102 GLU H 1.0 . 4.80 873 791 A 102 GLU H A 97 HIS HBx 1.0 . 3.81 874 792 A 102 GLU H A 97 HIS HBy 1.0 . 3.81 875 793 A 97 HIS HD2 A 102 GLU H 1.0 . 5.50 876 794 A 100 ARG HBy A 102 GLU H 1.0 . 4.79 877 795 A 102 GLU H A 101 ASP H 1.0 . 4.09 878 796 A 101 ASP HA A 102 GLU H 1.0 . 2.76 879 797 A 102 GLU H A 101 ASP HBy 1.0 . 4.82 880 798 A 102 GLU H A 101 ASP HBx 1.0 . 4.82 881 799 A 102 GLU H A 102 GLU HBy 1.0 . 3.60 882 800 A 103 PRO HA A 102 GLU H 1.0 . 4.63 883 801 A 95 ALA H A 104 VAL H 1.0 . 3.88 884 802 A 95 ALA HB% A 104 VAL H 1.0 . 4.74 885 803 A 105 ALA HB% A 104 VAL H 1.0 . 5.23 886 804 A 96 LEU HA A 104 VAL H 1.0 . 3.41 887 805 A 103 PRO HA A 104 VAL H 1.0 . 2.72 888 806 A 104 VAL H A 103 PRO HBx 1.0 . 3.63 889 807 A 104 VAL H A 103 PRO HBy 1.0 . 3.63 890 808 A 104 VAL HB A 104 VAL H 1.0 . 3.36 891 809 A 104 VAL H A 105 ALA H 1.0 . 4.44 892 810 A 104 VAL HA A 105 ALA H 1.0 . 2.74 893 811 A 104 VAL HB A 105 ALA H 1.0 . 4.35 894 812 A 105 ALA HB% A 105 ALA H 1.0 . 3.10 895 813 A 93 THR HG2% A 106 PHE H 1.0 . 4.59 896 814 A 106 PHE H A 107 VAL HGx% 1.0 . 5.28 897 815 A 104 VAL HA A 106 PHE H 1.0 . 3.77 898 816 A 106 PHE H A 105 ALA H 1.0 . 2.75 899 817 A 105 ALA HB% A 106 PHE H 1.0 . 3.22 900 818 A 106 PHE HBy A 106 PHE H 1.0 . 4.09 901 819 A 106 PHE HBx A 106 PHE H 1.0 . 3.55 902 820 A 106 PHE HD% A 106 PHE H 1.0 . 4.26 903 821 A 106 PHE H A 107 VAL H 1.0 . 4.34 904 822 A 106 PHE H A 107 VAL HGy% 1.0 . 5.28 905 823 A 87 ALA HB% A 107 VAL H 1.0 . 4.78 906 824 A 90 LYS HA A 107 VAL H 1.0 . 5.50 907 825 A 91 LEU HG A 107 VAL H 1.0 . 5.24 908 826 A 92 HIS HA A 107 VAL H 1.0 . 3.68 909 827 A 93 THR HG2% A 107 VAL H 1.0 . 3.92 910 828 A 107 VAL H A 107 VAL HGx% 1.0 . 4.45 911 829 A 106 PHE HA A 107 VAL H 1.0 . 2.73 912 830 A 106 PHE HBy A 107 VAL H 1.0 . 3.93 913 831 A 106 PHE HBx A 107 VAL H 1.0 . 4.53 914 832 A 106 PHE HD% A 107 VAL H 1.0 . 4.79 915 833 A 107 VAL HB A 107 VAL H 1.0 . 3.69 916 834 A 107 VAL H A 107 VAL HGy% 1.0 . 4.45 917 835 A 107 VAL H A 108 LEU H 1.0 . 4.57 918 836 A 107 VAL HA A 108 LEU H 1.0 . 2.68 919 837 A 108 LEU H A 107 VAL HGx% 1.0 . 4.42 920 838 A 108 LEU H A 107 VAL HGy% 1.0 . 4.42 921 839 A 108 LEU H A 108 LEU HBx 1.0 . 3.10 922 839 A 108 LEU HBy A 108 LEU H 1.0 . 3.10 923 840 A 109 PRO HDy A 108 LEU H 1.0 . 4.80 924 841 A 109 PRO HDx A 108 LEU H 1.0 . 5.14 925 842 A 87 ALA HB% A 110 GLY H 1.0 . 3.35 926 843 A 88 LEU HA A 110 GLY H 1.0 . 4.62 927 844 A 110 GLY H A 108 LEU HBx 1.0 . 4.66 928 844 A 108 LEU HBy A 110 GLY H 1.0 . 4.66 929 845 A 109 PRO HA A 110 GLY H 1.0 . 2.67 930 846 A 109 PRO HBx A 110 GLY H 1.0 . 4.27 931 847 A 109 PRO HDx A 110 GLY H 1.0 . 5.50 932 848 A 86 VAL HB A 110 GLY H 1.0 . 5.50 933 849 A 111 THR HB A 110 GLY H 1.0 . 4.35 934 850 A 86 VAL HA A 111 THR H 1.0 . 4.97 935 851 A 87 ALA H A 111 THR H 1.0 . 3.83 936 852 A 87 ALA HB% A 111 THR H 1.0 . 3.78 937 853 A 108 LEU H A 111 THR H 1.0 . 4.39 938 854 A 111 THR HG2% A 111 THR H 1.0 . 3.95 939 855 A 109 PRO HA A 111 THR H 1.0 . 4.12 940 856 A 110 GLY H A 111 THR H 1.0 . 3.03 941 857 A 111 THR HB A 111 THR H 1.0 . 2.76 942 858 A 86 VAL HA A 112 ALA H 1.0 . 4.76 943 859 A 111 THR H A 112 ALA H 1.0 . 4.43 944 860 A 111 THR HA A 112 ALA H 1.0 . 2.42 945 861 A 111 THR HG2% A 112 ALA H 1.0 . 3.18 946 862 A 112 ALA HB% A 112 ALA H 1.0 . 2.83 947 863 A 113 PHE H A 112 ALA H 1.0 . 4.52 948 864 A 113 PHE H A 86 VAL H 1.0 . 5.02 949 865 A 86 VAL HA A 113 PHE H 1.0 . 3.32 950 866 A 113 PHE H A 87 ALA H 1.0 . 4.25 951 867 A 111 THR HB A 113 PHE H 1.0 . 5.33 952 868 A 112 ALA HA A 113 PHE H 1.0 . 2.75 953 869 A 112 ALA HB% A 113 PHE H 1.0 . 3.53 954 870 A 113 PHE HBx A 113 PHE H 1.0 . 4.18 955 871 A 113 PHE HBy A 113 PHE H 1.0 . 4.02 956 872 A 113 PHE HD% A 113 PHE H 1.0 . 3.22 957 873 A 113 PHE HE% A 113 PHE H 1.0 . 3.97 958 874 A 114 ARG HBy A 114 ARG H 1.0 . 3.43 959 875 A 114 ARG H A 114 ARG HGy 1.0 . 3.71 960 876 A 114 ARG H A 114 ARG HGx 1.0 . 3.71 961 877 A 113 PHE HA A 114 ARG H 1.0 . 3.06 962 878 A 113 PHE HBx A 114 ARG H 1.0 . 3.18 963 879 A 113 PHE HBy A 114 ARG H 1.0 . 4.30 964 880 A 113 PHE HD% A 114 ARG H 1.0 . 4.20 965 881 A 82 LEU HA A 115 VAL H 1.0 . 4.87 966 882 A 114 ARG HBy A 115 VAL H 1.0 . 4.05 967 883 A 115 VAL H A 85 VAL H 1.0 . 4.30 968 884 A 95 ALA HB% A 115 VAL H 1.0 . 5.08 969 885 A 115 VAL H A 114 ARG H 1.0 . 4.72 970 886 A 114 ARG HA A 115 VAL H 1.0 . 2.69 971 887 A 114 ARG HBx A 115 VAL H 1.0 . 3.62 972 888 A 115 VAL H A 115 VAL HGx% 1.0 . 4.14 973 889 A 115 VAL H A 115 VAL HGy% 1.0 . 4.14 974 890 A 88 LEU HDx% A 130 ARG H 1.0 . 4.42 975 891 A 115 VAL H A 116 SER H 1.0 . 4.62 976 892 A 115 VAL HA A 116 SER H 1.0 . 2.87 977 893 A 115 VAL HB A 116 SER H 1.0 . 2.79 978 894 A 116 SER H A 116 SER HBy 1.0 . 3.49 979 895 A 116 SER H A 116 SER HBx 1.0 . 3.49 980 896 A 119 VAL HB A 116 SER H 1.0 . 3.60 981 897 A 129 ALA HB% A 130 ARG H 1.0 . 3.45 982 898 A 81 GLU H A 117 ALA H 1.0 . 5.32 983 899 A 119 VAL HB A 117 ALA H 1.0 . 5.50 984 900 A 117 ALA H A 83 VAL HGx% 1.0 . 4.33 985 901 A 117 ALA H A 83 VAL HGy% 1.0 . 4.33 986 902 A 116 SER H A 117 ALA H 1.0 . 4.67 987 903 A 116 SER HA A 117 ALA H 1.0 . 2.64 988 904 A 117 ALA H A 116 SER HBy 1.0 . 3.73 989 905 A 117 ALA H A 116 SER HBx 1.0 . 3.73 990 906 A 117 ALA HB% A 117 ALA H 1.0 . 2.66 991 907 A 117 ALA H A 118 GLY H 1.0 . 3.47 992 908 A 117 ALA H A 119 VAL H 1.0 . 4.50 993 909 A 120 ALA HB% A 117 ALA H 1.0 . 5.15 994 910 A 117 ALA HB% A 118 GLY H 1.0 . 3.41 995 911 A 118 GLY H A 119 VAL H 1.0 . 3.37 996 912 A 119 VAL HB A 118 GLY H 1.0 . 5.21 997 913 A 116 SER H A 119 VAL H 1.0 . 4.21 998 914 A 119 VAL H A 116 SER HBy 1.0 . 4.56 999 915 A 119 VAL H A 116 SER HBx 1.0 . 4.56 1000 916 A 117 ALA HB% A 119 VAL H 1.0 . 5.09 1001 917 A 121 ALA HB% A 119 VAL H 1.0 . 5.50 1002 918 A 118 GLY HAx A 119 VAL H 1.0 . 3.39 1003 919 A 119 VAL HB A 119 VAL H 1.0 . 2.97 1004 920 A 120 ALA HB% A 119 VAL H 1.0 . 4.32 1005 921 A 119 VAL H A 121 ALA H 1.0 . 4.25 1006 922 A 115 VAL HB A 120 ALA H 1.0 . 4.83 1007 923 A 123 MET HGy A 120 ALA H 1.0 . 5.25 1008 924 A 117 ALA HA A 120 ALA H 1.0 . 3.97 1009 925 A 119 VAL H A 120 ALA H 1.0 . 2.77 1010 926 A 119 VAL HB A 120 ALA H 1.0 . 3.20 1011 927 A 120 ALA H A 119 VAL HGx% 1.0 . 4.31 1012 928 A 120 ALA H A 119 VAL HGy% 1.0 . 4.31 1013 929 A 120 ALA HB% A 120 ALA H 1.0 . 2.71 1014 930 A 121 ALA H A 120 ALA H 1.0 . 3.11 1015 931 A 121 ALA HB% A 120 ALA H 1.0 . 4.64 1016 932 A 123 MET HBy A 120 ALA H 1.0 . 5.40 1017 933 A 131 MET HE% A 120 ALA H 1.0 . 5.50 1018 934 A 118 GLY HAy A 121 ALA H 1.0 . 4.16 1019 935 A 119 VAL HA A 121 ALA H 1.0 . 4.53 1020 936 A 120 ALA HB% A 121 ALA H 1.0 . 3.00 1021 937 A 121 ALA HB% A 121 ALA H 1.0 . 2.67 1022 938 A 121 ALA H A 122 GLU H 1.0 . 2.93 1023 939 A 119 VAL HB A 121 ALA H 1.0 . 5.18 1024 940 A 131 MET HE% A 121 ALA H 1.0 . 4.54 1025 941 A 119 VAL HA A 122 GLU H 1.0 . 3.74 1026 942 A 122 GLU H A 119 VAL HGy% 1.0 . 5.50 1027 943 A 122 GLU H A 119 VAL HGx% 1.0 . 5.50 1028 944 A 120 ALA HA A 122 GLU H 1.0 . 4.45 1029 945 A 120 ALA HB% A 122 GLU H 1.0 . 4.80 1030 946 A 121 ALA HB% A 122 GLU H 1.0 . 3.11 1031 947 A 122 GLU H A 122 GLU HBy 1.0 . 3.63 1032 948 A 122 GLU H A 122 GLU HBx 1.0 . 3.63 1033 949 A 122 GLU H A 122 GLU HGx 1.0 . 4.02 1034 949 A 122 GLU HGy A 122 GLU H 1.0 . 4.02 1035 950 A 122 GLU H A 124 THR H 1.0 . 4.42 1036 951 A 119 VAL HA A 123 MET H 1.0 . 4.53 1037 952 A 120 ALA HA A 123 MET H 1.0 . 3.62 1038 953 A 120 ALA HB% A 123 MET H 1.0 . 5.09 1039 954 A 124 THR HG2% A 123 MET H 1.0 . 5.45 1040 955 A 121 ALA H A 123 MET H 1.0 . 4.54 1041 956 A 122 GLU H A 123 MET H 1.0 . 2.86 1042 957 A 123 MET HBy A 123 MET H 1.0 . 3.10 1043 958 A 123 MET HBx A 123 MET H 1.0 . 3.60 1044 959 A 123 MET HGx A 123 MET H 1.0 . 3.71 1045 960 A 123 MET HGy A 123 MET H 1.0 . 3.48 1046 961 A 123 MET H A 122 GLU HGx 1.0 . 4.20 1047 961 A 122 GLU HGy A 123 MET H 1.0 . 4.20 1048 962 A 124 THR H A 123 MET H 1.0 . 3.01 1049 963 A 121 ALA HB% A 124 THR H 1.0 . 5.30 1050 964 A 120 ALA HA A 124 THR H 1.0 . 4.04 1051 965 A 121 ALA HA A 124 THR H 1.0 . 4.36 1052 966 A 123 MET HBy A 124 THR H 1.0 . 3.50 1053 967 A 123 MET HBx A 124 THR H 1.0 . 3.77 1054 968 A 123 MET HGx A 124 THR H 1.0 . 4.83 1055 969 A 123 MET HGy A 124 THR H 1.0 . 4.53 1056 970 A 124 THR H A 125 GLU HBx 1.0 . 4.99 1057 970 A 125 GLU HBy A 124 THR H 1.0 . 4.99 1058 971 A 124 THR HB A 124 THR H 1.0 . 3.66 1059 972 A 124 THR HG2% A 124 THR H 1.0 . 3.01 1060 973 A 124 THR H A 126 ARG H 1.0 . 4.23 1061 974 A 129 ALA HB% A 124 THR H 1.0 . 4.70 1062 975 A 121 ALA HB% A 125 GLU H 1.0 . 5.22 1063 976 A 122 GLU H A 125 GLU H 1.0 . 4.70 1064 977 A 123 MET H A 125 GLU H 1.0 . 4.06 1065 978 A 124 THR H A 125 GLU H 1.0 . 3.00 1066 979 A 124 THR HB A 125 GLU H 1.0 . 4.18 1067 980 A 124 THR HG2% A 125 GLU H 1.0 . 4.32 1068 981 A 126 ARG H A 125 GLU H 1.0 . 2.97 1069 982 A 123 MET HA A 126 ARG H 1.0 . 3.80 1070 983 A 124 THR HA A 126 ARG H 1.0 . 4.73 1071 984 A 126 ARG HBx A 126 ARG H 1.0 . 3.02 1072 985 A 126 ARG HBy A 126 ARG H 1.0 . 3.64 1073 986 A 126 ARG H A 126 ARG HGx 1.0 . 3.63 1074 987 A 126 ARG H A 126 ARG HDx 1.0 . 4.77 1075 987 A 126 ARG HDy A 126 ARG H 1.0 . 4.77 1076 988 A 126 ARG H A 128 LEU H 1.0 . 4.15 1077 989 A 126 ARG H A 129 ALA H 1.0 . 4.94 1078 990 A 88 LEU HDx% A 127 GLY H 1.0 . 5.50 1079 991 A 124 THR HA A 127 GLY H 1.0 . 3.76 1080 992 A 124 THR HG2% A 127 GLY H 1.0 . 5.30 1081 993 A 125 GLU H A 127 GLY H 1.0 . 4.28 1082 994 A 126 ARG HA A 127 GLY H 1.0 . 3.53 1083 995 A 126 ARG HBx A 127 GLY H 1.0 . 3.98 1084 996 A 126 ARG HBy A 127 GLY H 1.0 . 4.12 1085 997 A 127 GLY HAx A 127 GLY H 1.0 . 2.84 1086 998 A 88 LEU HDx% A 128 LEU H 1.0 . 4.87 1087 999 A 124 THR HA A 128 LEU H 1.0 . 5.11 1088 1000 A 126 ARG HBx A 128 LEU H 1.0 . 3.42 1089 1001 A 128 LEU HBy A 128 LEU H 1.0 . 3.64 1090 1002 A 126 ARG HBy A 128 LEU H 1.0 . 4.10 1091 1003 A 128 LEU H A 127 GLY H 1.0 . 3.02 1092 1004 A 128 LEU H A 128 LEU HDx% 1.0 . 4.08 1093 1005 A 129 ALA HB% A 128 LEU H 1.0 . 4.32 1094 1006 A 88 LEU H A 129 ALA H 1.0 . 4.62 1095 1007 A 88 LEU HG A 129 ALA H 1.0 . 4.31 1096 1008 A 88 LEU HDx% A 129 ALA H 1.0 . 3.94 1097 1009 A 124 THR HA A 129 ALA H 1.0 . 3.78 1098 1010 A 126 ARG HBy A 129 ALA H 1.0 . 5.43 1099 1011 A 129 ALA H A 127 GLY H 1.0 . 3.96 1100 1012 A 127 GLY HAx A 129 ALA H 1.0 . 4.10 1101 1013 A 127 GLY HAy A 129 ALA H 1.0 . 5.15 1102 1014 A 128 LEU H A 129 ALA H 1.0 . 2.84 1103 1015 A 129 ALA HB% A 129 ALA H 1.0 . 3.23 1104 1016 A 130 ARG H A 129 ALA H 1.0 . 4.53 1105 1017 A 85 VAL HA A 130 ARG H 1.0 . 5.18 1106 1018 A 130 ARG H A 85 VAL HGx% 1.0 . 5.39 1107 1019 A 130 ARG H A 85 VAL HGy% 1.0 . 5.39 1108 1020 A 88 LEU HDy% A 130 ARG H 1.0 . 3.74 1109 1021 A 87 ALA HA A 130 ARG H 1.0 . 3.98 1110 1022 A 88 LEU HG A 130 ARG H 1.0 . 3.70 1111 1023 A 129 ALA HA A 130 ARG H 1.0 . 2.94 1112 1024 A 130 ARG H A 130 ARG HBy 1.0 . 3.70 1113 1025 A 130 ARG H A 130 ARG HBx 1.0 . 3.70 1114 1026 A 130 ARG H A 130 ARG HDx 1.0 . 5.15 1115 1026 A 130 ARG HDy A 130 ARG H 1.0 . 5.15 1116 1027 A 124 THR HG2% A 131 MET H 1.0 . 3.36 1117 1028 A 129 ALA HB% A 131 MET H 1.0 . 5.50 1118 1029 A 130 ARG HA A 131 MET H 1.0 . 2.77 1119 1030 A 131 MET H A 130 ARG HDx 1.0 . 5.05 1120 1030 A 130 ARG HDy A 131 MET H 1.0 . 5.05 1121 1031 A 131 MET H A 130 ARG HGx 1.0 . 3.70 1122 1031 A 130 ARG HGy A 131 MET H 1.0 . 3.70 1123 1032 A 131 MET HBx A 131 MET H 1.0 . 3.00 1124 1033 A 131 MET HBy A 131 MET H 1.0 . 3.79 1125 1034 A 131 MET H A 131 MET HGx 1.0 . 3.44 1126 1035 A 131 MET H A 131 MET HGy 1.0 . 3.44 1127 1036 A 131 MET H A 132 GLN H 1.0 . 4.63 1128 1037 A 84 THR HG2% A 132 GLN H 1.0 . 4.17 1129 1038 A 85 VAL HA A 132 GLN H 1.0 . 3.10 1130 1039 A 86 VAL H A 132 GLN H 1.0 . 3.68 1131 1040 A 112 ALA HB% A 132 GLN H 1.0 . 4.96 1132 1041 A 131 MET HA A 132 GLN H 1.0 . 2.61 1133 1042 A 131 MET HBx A 132 GLN H 1.0 . 4.35 1134 1043 A 131 MET HBy A 132 GLN H 1.0 . 3.71 1135 1044 A 132 GLN H A 131 MET HGx 1.0 . 5.50 1136 1045 A 132 GLN HBx A 132 GLN H 1.0 . 3.04 1137 1046 A 132 GLN HBy A 132 GLN H 1.0 . 3.10 1138 1047 A 84 THR HG2% A 132 GLN HE2y 1.0 . 4.39 1139 1048 A 84 THR HG2% A 132 GLN HE2x 1.0 . 4.39 1140 1049 A 132 GLN HE2x A 86 VAL HGx% 1.0 . 5.50 1141 1050 A 132 GLN HE2x A 86 VAL HGy% 1.0 . 5.50 1142 1051 A 132 GLN HE2y A 86 VAL HGx% 1.0 . 5.50 1143 1052 A 132 GLN HE2y A 86 VAL HGy% 1.0 . 5.50 1144 1053 A 112 ALA HB% A 132 GLN HE2y 1.0 . 4.26 1145 1054 A 112 ALA HB% A 132 GLN HE2x 1.0 . 4.26 1146 1055 A 97 HIS H A 104 VAL H 1.0 . 4.59 1147 1056 A 106 PHE HBx A 105 ALA H 1.0 . 5.10 1148 1057 A 97 HIS HD2 A 100 ARG H 1.0 . 4.97 1149 1058 A 82 LEU HG A 100 ARG H 1.0 . 5.50 1150 1059 A 82 LEU HG A 98 ALA H 1.0 . 4.35 1151 1060 A 91 LEU HA A 93 THR H 1.0 . 5.50 1152 1061 A 106 PHE HA A 93 THR H 1.0 . 3.25 1153 1062 A 76 ILE HA A 77 LEU H 1.0 . 2.43 1154 1063 A 74 THR H A 76 ILE H 1.0 . 4.75 1155 1064 A 96 LEU HBy A 96 LEU H 1.0 . 3.34 1156 1065 A 113 PHE H A 86 VAL HGx% 1.0 . 5.06 1157 1066 A 113 PHE H A 86 VAL HGy% 1.0 . 5.06 1158 1067 A 126 ARG HBx A 124 THR H 1.0 . 5.43 1159 1068 A 125 GLU H A 125 GLU HBx 1.0 . 3.29 1160 1068 A 125 GLU HBy A 125 GLU H 1.0 . 3.29 1161 1069 A 126 ARG H A 126 ARG HGy 1.0 . 3.63 1162 1070 A 126 ARG H A 125 GLU HBx 1.0 . 3.79 1163 1070 A 125 GLU HBy A 126 ARG H 1.0 . 3.79 1164 1071 A 128 LEU HG A 127 GLY H 1.0 . 4.41 1165 1072 A 128 LEU HG A 128 LEU H 1.0 . 2.81 1166 1073 A 128 LEU HBy A 129 ALA H 1.0 . 3.71 1167 1074 A 123 MET HBx A 129 ALA H 1.0 . 4.72 1168 1075 A 86 VAL HB A 112 ALA H 1.0 . 4.20 1169 1076 A 109 PRO HDy A 91 LEU H 1.0 . 5.50 1170 1077 A 79 THR HA A 78 ASP H 1.0 . 5.07 1171 1078 A 132 GLN H A 131 MET HGy 1.0 . 5.50 1172 1079 A 85 VAL H A 132 GLN H 1.0 . 4.48 1173 1080 A 129 ALA HA A 88 LEU H 1.0 . 3.13 1174 1081 A 82 LEU HBx A 84 THR H 1.0 . 5.50 1175 1082 A 120 ALA HB% A 84 THR H 1.0 . 5.50 1176 1083 A 114 ARG HA A 114 ARG HE 1.0 . 5.48 1177 1084 A 114 ARG HE A 114 ARG HGy 1.0 . 3.41 1178 1085 A 114 ARG HE A 114 ARG HGx 1.0 . 3.41 1179 1086 A 114 ARG HE A 114 ARG H 1.0 . 4.64 1180 1087 A 92 HIS H A 92 HIS HBy 1.0 . 3.64 1181 1088 A 92 HIS H A 92 HIS HBx 1.0 . 3.64 1182 1089 A 103 PRO HA A 97 HIS H 1.0 . 3.82 1183 1090 A 125 GLU HA A 126 ARG H 1.0 . 3.50 1184 1091 A 129 ALA HB% A 126 ARG H 1.0 . 5.50 1185 1092 A 88 LEU HG A 128 LEU H 1.0 . 5.50 1186 1093 A 84 THR HG2% A 112 ALA H 1.0 . 5.50 1187 1094 A 100 ARG HBy A 98 ALA H 1.0 . 5.50 1188 1095 A 113 PHE HE% A 111 THR H 1.0 . 5.50 1189 1096 A 113 PHE HD% A 111 THR H 1.0 . 5.26 1190 1097 A 100 ARG H A 101 ASP H 1.0 . 4.65 1191 1098 A 84 THR H A 85 VAL H 1.0 . 4.89 1192 1099 A 97 HIS H A 98 ALA H 1.0 . 4.61 1193 1100 A 113 PHE HE% A 85 VAL H 1.0 . 5.37 1194 1101 A 86 VAL HA A 85 VAL H 1.0 . 4.95 1195 1102 A 113 PHE HA A 85 VAL H 1.0 . 4.95 1196 1103 A 111 THR HG2% A 113 PHE H 1.0 . 4.21 1197 1104 A 94 ASP HA A 106 PHE H 1.0 . 5.50 1198 1105 A 107 VAL HA A 106 PHE H 1.0 . 5.19 1199 1106 A 102 GLU H A 100 ARG H 1.0 . 5.37 1200 1107 A 113 PHE HD% A 95 ALA H 1.0 . 5.50 1201 1108 A 96 LEU HA A 95 ALA H 1.0 . 5.14 1202 1109 A 93 THR HA A 95 ALA H 1.0 . 5.30 1203 1110 A 129 ALA HA A 128 LEU H 1.0 . 5.18 1204 1111 A 128 LEU H A 128 LEU HDy% 1.0 . 4.08 1205 1112 A 120 ALA HB% A 118 GLY H 1.0 . 5.17 1206 1113 A 116 SER HA A 118 GLY H 1.0 . 4.83 1207 1114 A 77 LEU HA A 76 ILE H 1.0 . 5.50 1208 1115 A 78 ASP HA A 79 THR H 1.0 . 3.06 1209 1116 A 74 THR H A 75 VAL H 1.0 . 3.26 1210 1117 A 75 VAL H A 76 ILE H 1.0 . 3.18 1211 1118 A 87 ALA H A 88 LEU H 1.0 . 4.64 1212 1119 A 97 HIS H A 97 HIS HBy 1.0 . 3.74 1213 1120 A 72 PRO HA A 73 ASP HBy 1.0 . 4.81 1214 1120 A 72 PRO HA A 73 ASP HBx 1.0 . 4.81 1215 1121 A 72 PRO HGx A 73 ASP HBy 1.0 . 5.34 1216 1121 A 73 ASP HBx A 72 PRO HGx 1.0 . 5.34 1217 1121 A 72 PRO HGy A 73 ASP HBx 1.0 . 5.34 1218 1121 A 72 PRO HGy A 73 ASP HBy 1.0 . 5.34 1219 1122 A 72 PRO HGy A 75 VAL HGy% 1.0 . 4.82 1220 1122 A 75 VAL HGx% A 72 PRO HGx 1.0 . 4.82 1221 1122 A 72 PRO HGy A 75 VAL HGx% 1.0 . 4.82 1222 1122 A 72 PRO HGx A 75 VAL HGy% 1.0 . 4.82 1223 1123 A 73 ASP H A 73 ASP HBy 1.0 . 3.10 1224 1123 A 73 ASP H A 73 ASP HBx 1.0 . 3.10 1225 1124 A 73 ASP HA A 75 VAL HGy% 1.0 . 5.28 1226 1124 A 73 ASP HA A 75 VAL HGx% 1.0 . 5.28 1227 1125 A 74 THR H A 73 ASP HBy 1.0 . 4.27 1228 1125 A 74 THR H A 73 ASP HBx 1.0 . 4.27 1229 1126 A 74 THR H A 75 VAL HGy% 1.0 . 4.62 1230 1126 A 74 THR H A 75 VAL HGx% 1.0 . 4.62 1231 1127 A 74 THR HA A 75 VAL HGy% 1.0 . 3.90 1232 1127 A 74 THR HA A 75 VAL HGx% 1.0 . 3.90 1233 1128 A 74 THR HB A 75 VAL HGy% 1.0 . 4.79 1234 1128 A 74 THR HB A 75 VAL HGx% 1.0 . 4.79 1235 1129 A 75 VAL H A 75 VAL HGy% 1.0 . 3.20 1236 1129 A 75 VAL H A 75 VAL HGx% 1.0 . 3.20 1237 1130 A 75 VAL H A 76 ILE HG1x 1.0 . 4.14 1238 1130 A 75 VAL H A 76 ILE HG1y 1.0 . 4.14 1239 1131 A 75 VAL HA A 75 VAL HGy% 1.0 . 2.59 1240 1131 A 75 VAL HA A 75 VAL HGx% 1.0 . 2.59 1241 1132 A 76 ILE H A 75 VAL HGy% 1.0 . 4.30 1242 1132 A 76 ILE H A 75 VAL HGx% 1.0 . 4.30 1243 1133 A 76 ILE HA A 76 ILE HG1x 1.0 . 3.10 1244 1133 A 76 ILE HA A 76 ILE HG1y 1.0 . 3.10 1245 1134 A 76 ILE HG2% A 78 ASP HBx 1.0 . 4.73 1246 1134 A 76 ILE HG2% A 78 ASP HBy 1.0 . 4.73 1247 1135 A 77 LEU H A 76 ILE HG1x 1.0 . 5.07 1248 1135 A 77 LEU H A 76 ILE HG1y 1.0 . 5.07 1249 1136 A 77 LEU HA A 77 LEU HDx% 1.0 . 2.52 1250 1136 A 77 LEU HA A 77 LEU HD21 1.0 . 2.52 1251 1137 A 77 LEU HBy A 77 LEU HDx% 1.0 . 2.52 1252 1137 A 77 LEU HBy A 77 LEU HD21 1.0 . 2.52 1253 1138 A 78 ASP H A 77 LEU HDx% 1.0 . 3.59 1254 1138 A 78 ASP H A 77 LEU HD21 1.0 . 3.59 1255 1139 A 78 ASP HA A 77 LEU HDx% 1.0 . 4.36 1256 1139 A 78 ASP HA A 77 LEU HD21 1.0 . 4.36 1257 1140 A 77 LEU HD21 A 78 ASP HBx 1.0 . 4.85 1258 1140 A 77 LEU HDx% A 78 ASP HBx 1.0 . 4.85 1259 1140 A 78 ASP HBy A 77 LEU HDx% 1.0 . 4.85 1260 1140 A 78 ASP HBy A 77 LEU HD21 1.0 . 4.85 1261 1141 A 79 THR HA A 77 LEU HDx% 1.0 . 4.58 1262 1141 A 79 THR HA A 77 LEU HD21 1.0 . 4.58 1263 1142 A 80 SER H A 77 LEU HDx% 1.0 . 5.44 1264 1142 A 80 SER H A 77 LEU HD21 1.0 . 5.44 1265 1143 A 78 ASP H A 78 ASP HBx 1.0 . 2.90 1266 1143 A 78 ASP H A 78 ASP HBy 1.0 . 2.90 1267 1144 A 81 GLU H A 81 GLU HBx 1.0 . 3.04 1268 1144 A 81 GLU H A 81 GLU HBy 1.0 . 3.04 1269 1145 A 81 GLU H A 81 GLU HGx 1.0 . 3.87 1270 1145 A 81 GLU H A 81 GLU HGy 1.0 . 3.87 1271 1146 A 81 GLU H A 82 LEU HDx% 1.0 . 4.43 1272 1146 A 81 GLU H A 82 LEU HD21 1.0 . 4.43 1273 1147 A 81 GLU HA A 81 GLU HBx 1.0 . 2.61 1274 1147 A 81 GLU HA A 81 GLU HBy 1.0 . 2.61 1275 1148 A 81 GLU HA A 81 GLU HGx 1.0 . 2.99 1276 1148 A 81 GLU HA A 81 GLU HGy 1.0 . 2.99 1277 1149 A 81 GLU HBx A 81 GLU HGx 1.0 . 2.32 1278 1149 A 81 GLU HBy A 81 GLU HGx 1.0 . 2.32 1279 1149 A 81 GLU HGy A 81 GLU HBx 1.0 . 2.32 1280 1149 A 81 GLU HBy A 81 GLU HGy 1.0 . 2.32 1281 1150 A 82 LEU H A 81 GLU HBx 1.0 . 4.13 1282 1150 A 82 LEU H A 81 GLU HBy 1.0 . 4.13 1283 1151 A 81 GLU HBy A 83 VAL HGy% 1.0 . 4.41 1284 1151 A 81 GLU HBx A 83 VAL HGy% 1.0 . 4.41 1285 1151 A 83 VAL HGx% A 81 GLU HBx 1.0 . 4.41 1286 1151 A 81 GLU HBy A 83 VAL HGx% 1.0 . 4.41 1287 1152 A 117 ALA H A 81 GLU HBx 1.0 . 4.60 1288 1152 A 117 ALA H A 81 GLU HBy 1.0 . 4.60 1289 1153 A 117 ALA HA A 81 GLU HBx 1.0 . 5.34 1290 1153 A 117 ALA HA A 81 GLU HBy 1.0 . 5.34 1291 1154 A 117 ALA HB% A 81 GLU HBx 1.0 . 3.57 1292 1154 A 117 ALA HB% A 81 GLU HBy 1.0 . 3.57 1293 1155 A 82 LEU H A 81 GLU HGx 1.0 . 5.05 1294 1155 A 82 LEU H A 81 GLU HGy 1.0 . 5.05 1295 1156 A 82 LEU H A 82 LEU HDx% 1.0 . 3.60 1296 1156 A 82 LEU H A 82 LEU HD21 1.0 . 3.60 1297 1157 A 82 LEU HA A 82 LEU HDx% 1.0 . 2.84 1298 1157 A 82 LEU HA A 82 LEU HD21 1.0 . 2.84 1299 1158 A 82 LEU HA A 83 VAL HGy% 1.0 . 4.14 1300 1158 A 82 LEU HA A 83 VAL HGx% 1.0 . 4.14 1301 1159 A 82 LEU HA A 116 SER HBx 1.0 . 5.06 1302 1159 A 82 LEU HA A 116 SER HBy 1.0 . 5.06 1303 1160 A 82 LEU HBy A 82 LEU HDx% 1.0 . 3.06 1304 1160 A 82 LEU HBy A 82 LEU HD21 1.0 . 3.06 1305 1161 A 82 LEU HBy A 114 ARG HDx 1.0 . 5.17 1306 1161 A 82 LEU HBy A 114 ARG HDy 1.0 . 5.17 1307 1162 A 82 LEU HBx A 114 ARG HDx 1.0 . 4.12 1308 1162 A 82 LEU HBx A 114 ARG HDy 1.0 . 4.12 1309 1163 A 82 LEU HG A 114 ARG HDx 1.0 . 3.89 1310 1163 A 82 LEU HG A 114 ARG HDy 1.0 . 3.89 1311 1164 A 83 VAL H A 82 LEU HDx% 1.0 . 3.60 1312 1164 A 83 VAL H A 82 LEU HD21 1.0 . 3.60 1313 1165 A 97 HIS HA A 82 LEU HDx% 1.0 . 4.75 1314 1165 A 97 HIS HA A 82 LEU HD21 1.0 . 4.75 1315 1166 A 114 ARG HA A 82 LEU HDx% 1.0 . 5.44 1316 1166 A 114 ARG HA A 82 LEU HD21 1.0 . 5.44 1317 1167 A 114 ARG HBx A 82 LEU HDx% 1.0 . 4.54 1318 1167 A 114 ARG HBx A 82 LEU HD21 1.0 . 4.54 1319 1168 A 82 LEU HDx% A 114 ARG HDx 1.0 . 5.12 1320 1168 A 82 LEU HD21 A 114 ARG HDx 1.0 . 5.12 1321 1168 A 114 ARG HDy A 82 LEU HDx% 1.0 . 5.12 1322 1168 A 82 LEU HD21 A 114 ARG HDy 1.0 . 5.12 1323 1169 A 115 VAL HA A 82 LEU HDx% 1.0 . 3.83 1324 1169 A 115 VAL HA A 82 LEU HD21 1.0 . 3.83 1325 1170 A 115 VAL HB A 82 LEU HDx% 1.0 . 5.44 1326 1170 A 115 VAL HB A 82 LEU HD21 1.0 . 5.44 1327 1171 A 116 SER H A 82 LEU HDx% 1.0 . 4.00 1328 1171 A 116 SER H A 82 LEU HD21 1.0 . 4.00 1329 1172 A 116 SER HA A 82 LEU HDx% 1.0 . 3.44 1330 1172 A 116 SER HA A 82 LEU HD21 1.0 . 3.44 1331 1173 A 82 LEU HDx% A 116 SER HBx 1.0 . 4.01 1332 1173 A 82 LEU HD21 A 116 SER HBx 1.0 . 4.01 1333 1173 A 116 SER HBy A 82 LEU HDx% 1.0 . 4.01 1334 1173 A 82 LEU HD21 A 116 SER HBy 1.0 . 4.01 1335 1174 A 117 ALA H A 82 LEU HDx% 1.0 . 4.73 1336 1174 A 117 ALA H A 82 LEU HD21 1.0 . 4.73 1337 1175 A 83 VAL H A 83 VAL HGy% 1.0 . 2.94 1338 1175 A 83 VAL H A 83 VAL HGx% 1.0 . 2.94 1339 1176 A 83 VAL HB A 85 VAL HGy% 1.0 . 4.64 1340 1176 A 83 VAL HB A 85 VAL HGx% 1.0 . 4.64 1341 1177 A 83 VAL HB A 115 VAL HGy% 1.0 . 4.72 1342 1177 A 83 VAL HB A 115 VAL HGx% 1.0 . 4.72 1343 1178 A 84 THR H A 83 VAL HGy% 1.0 . 3.44 1344 1178 A 84 THR H A 83 VAL HGx% 1.0 . 3.44 1345 1179 A 84 THR HA A 83 VAL HGy% 1.0 . 4.58 1346 1179 A 84 THR HA A 83 VAL HGx% 1.0 . 4.58 1347 1180 A 84 THR HB A 83 VAL HGy% 1.0 . 5.13 1348 1180 A 84 THR HB A 83 VAL HGx% 1.0 . 5.13 1349 1181 A 85 VAL H A 83 VAL HGy% 1.0 . 4.36 1350 1181 A 85 VAL H A 83 VAL HGx% 1.0 . 4.36 1351 1182 A 83 VAL HGy% A 85 VAL HGy% 1.0 . 3.15 1352 1182 A 83 VAL HGx% A 85 VAL HGy% 1.0 . 3.15 1353 1182 A 85 VAL HGx% A 83 VAL HGy% 1.0 . 3.15 1354 1182 A 83 VAL HGx% A 85 VAL HGx% 1.0 . 3.15 1355 1183 A 115 VAL H A 83 VAL HGy% 1.0 . 4.23 1356 1183 A 115 VAL H A 83 VAL HGx% 1.0 . 4.23 1357 1184 A 115 VAL HA A 83 VAL HGy% 1.0 . 5.44 1358 1184 A 115 VAL HA A 83 VAL HGx% 1.0 . 5.44 1359 1185 A 115 VAL HB A 83 VAL HGy% 1.0 . 4.18 1360 1185 A 115 VAL HB A 83 VAL HGx% 1.0 . 4.18 1361 1186 A 83 VAL HGy% A 115 VAL HGy% 1.0 . 3.25 1362 1186 A 83 VAL HGx% A 115 VAL HGy% 1.0 . 3.25 1363 1186 A 115 VAL HGx% A 83 VAL HGy% 1.0 . 3.25 1364 1186 A 83 VAL HGx% A 115 VAL HGx% 1.0 . 3.25 1365 1187 A 117 ALA H A 83 VAL HGy% 1.0 . 3.55 1366 1187 A 117 ALA H A 83 VAL HGx% 1.0 . 3.55 1367 1188 A 117 ALA HA A 83 VAL HGy% 1.0 . 2.87 1368 1188 A 117 ALA HA A 83 VAL HGx% 1.0 . 2.87 1369 1189 A 117 ALA HB% A 83 VAL HGy% 1.0 . 3.04 1370 1189 A 117 ALA HB% A 83 VAL HGx% 1.0 . 3.04 1371 1190 A 118 GLY H A 83 VAL HGy% 1.0 . 5.27 1372 1190 A 118 GLY H A 83 VAL HGx% 1.0 . 5.27 1373 1191 A 83 VAL HGy% A 131 MET HGy 1.0 . 4.57 1374 1191 A 83 VAL HGx% A 131 MET HGy 1.0 . 4.57 1375 1191 A 131 MET HGx A 83 VAL HGy% 1.0 . 4.57 1376 1191 A 83 VAL HGx% A 131 MET HGx 1.0 . 4.57 1377 1192 A 131 MET HE% A 83 VAL HGy% 1.0 . 2.73 1378 1192 A 131 MET HE% A 83 VAL HGx% 1.0 . 2.73 1379 1193 A 84 THR HA A 85 VAL HGy% 1.0 . 4.82 1380 1193 A 84 THR HA A 85 VAL HGx% 1.0 . 4.82 1381 1194 A 84 THR HA A 114 ARG HGy 1.0 . 3.49 1382 1194 A 84 THR HA A 114 ARG HGx 1.0 . 3.49 1383 1195 A 84 THR HB A 114 ARG HDx 1.0 . 5.34 1384 1195 A 84 THR HB A 114 ARG HDy 1.0 . 5.34 1385 1196 A 84 THR HB A 132 GLN HGy 1.0 . 5.34 1386 1196 A 84 THR HB A 132 GLN HGx 1.0 . 5.34 1387 1197 A 84 THR HB A 132 GLN HE2y 1.0 . 5.34 1388 1197 A 84 THR HB A 132 GLN HE2x 1.0 . 5.34 1389 1198 A 84 THR HG2% A 85 VAL HGy% 1.0 . 5.13 1390 1198 A 84 THR HG2% A 85 VAL HGx% 1.0 . 5.13 1391 1199 A 84 THR HG2% A 114 ARG HDx 1.0 . 4.68 1392 1199 A 84 THR HG2% A 114 ARG HDy 1.0 . 4.68 1393 1200 A 84 THR HG2% A 132 GLN HGy 1.0 . 3.80 1394 1200 A 84 THR HG2% A 132 GLN HGx 1.0 . 3.80 1395 1201 A 84 THR HG2% A 132 GLN HE2y 1.0 . 3.83 1396 1201 A 84 THR HG2% A 132 GLN HE2x 1.0 . 3.83 1397 1202 A 85 VAL H A 85 VAL HGy% 1.0 . 3.73 1398 1202 A 85 VAL H A 85 VAL HGx% 1.0 . 3.73 1399 1203 A 85 VAL HA A 85 VAL HGy% 1.0 . 2.95 1400 1203 A 85 VAL HA A 85 VAL HGx% 1.0 . 2.95 1401 1204 A 85 VAL HA A 86 VAL HGy% 1.0 . 3.97 1402 1204 A 85 VAL HA A 86 VAL HGx% 1.0 . 3.97 1403 1205 A 86 VAL H A 85 VAL HGy% 1.0 . 3.55 1404 1205 A 86 VAL H A 85 VAL HGx% 1.0 . 3.55 1405 1206 A 86 VAL HA A 85 VAL HGy% 1.0 . 4.96 1406 1206 A 86 VAL HA A 85 VAL HGx% 1.0 . 4.96 1407 1207 A 85 VAL HGy% A 86 VAL HGy% 1.0 . 4.03 1408 1207 A 86 VAL HGx% A 85 VAL HGy% 1.0 . 4.03 1409 1207 A 85 VAL HGx% A 86 VAL HGx% 1.0 . 4.03 1410 1207 A 85 VAL HGx% A 86 VAL HGy% 1.0 . 4.03 1411 1208 A 87 ALA H A 85 VAL HGy% 1.0 . 4.70 1412 1208 A 87 ALA H A 85 VAL HGx% 1.0 . 4.70 1413 1209 A 87 ALA HA A 85 VAL HGy% 1.0 . 5.39 1414 1209 A 87 ALA HA A 85 VAL HGx% 1.0 . 5.39 1415 1210 A 87 ALA HB% A 85 VAL HGy% 1.0 . 4.38 1416 1210 A 87 ALA HB% A 85 VAL HGx% 1.0 . 4.38 1417 1211 A 88 LEU HG A 85 VAL HGy% 1.0 . 5.44 1418 1211 A 88 LEU HG A 85 VAL HGx% 1.0 . 5.44 1419 1212 A 85 VAL HGx% A 91 LEU HDx% 1.0 . 5.38 1420 1212 A 85 VAL HGy% A 91 LEU HDx% 1.0 . 5.38 1421 1212 A 91 LEU HDy% A 85 VAL HGy% 1.0 . 5.38 1422 1212 A 91 LEU HDy% A 85 VAL HGx% 1.0 . 5.38 1423 1213 A 93 THR HG2% A 85 VAL HGy% 1.0 . 5.12 1424 1213 A 93 THR HG2% A 85 VAL HGx% 1.0 . 5.12 1425 1214 A 95 ALA HB% A 85 VAL HGy% 1.0 . 5.44 1426 1214 A 95 ALA HB% A 85 VAL HGx% 1.0 . 5.44 1427 1215 A 85 VAL HGy% A 107 VAL HGy% 1.0 . 4.53 1428 1215 A 85 VAL HGx% A 107 VAL HGy% 1.0 . 4.53 1429 1215 A 107 VAL HGx% A 85 VAL HGy% 1.0 . 4.53 1430 1215 A 85 VAL HGx% A 107 VAL HGx% 1.0 . 4.53 1431 1216 A 112 ALA HA A 85 VAL HGy% 1.0 . 5.24 1432 1216 A 112 ALA HA A 85 VAL HGx% 1.0 . 5.24 1433 1217 A 112 ALA HB% A 85 VAL HGy% 1.0 . 5.44 1434 1217 A 112 ALA HB% A 85 VAL HGx% 1.0 . 5.44 1435 1218 A 113 PHE H A 85 VAL HGy% 1.0 . 4.20 1436 1218 A 113 PHE H A 85 VAL HGx% 1.0 . 4.20 1437 1219 A 113 PHE HD% A 85 VAL HGy% 1.0 . 3.87 1438 1219 A 113 PHE HD% A 85 VAL HGx% 1.0 . 3.87 1439 1220 A 113 PHE HE% A 85 VAL HGy% 1.0 . 3.27 1440 1220 A 113 PHE HE% A 85 VAL HGx% 1.0 . 3.27 1441 1221 A 114 ARG HA A 85 VAL HGy% 1.0 . 5.44 1442 1221 A 114 ARG HA A 85 VAL HGx% 1.0 . 5.44 1443 1222 A 115 VAL HB A 85 VAL HGy% 1.0 . 5.44 1444 1222 A 115 VAL HB A 85 VAL HGx% 1.0 . 5.44 1445 1223 A 85 VAL HGx% A 115 VAL HGy% 1.0 . 3.17 1446 1223 A 85 VAL HGy% A 115 VAL HGy% 1.0 . 3.17 1447 1223 A 115 VAL HGx% A 85 VAL HGy% 1.0 . 3.17 1448 1223 A 85 VAL HGx% A 115 VAL HGx% 1.0 . 3.17 1449 1224 A 120 ALA H A 85 VAL HGy% 1.0 . 5.31 1450 1224 A 120 ALA H A 85 VAL HGx% 1.0 . 5.31 1451 1225 A 120 ALA HA A 85 VAL HGy% 1.0 . 3.47 1452 1225 A 120 ALA HA A 85 VAL HGx% 1.0 . 3.47 1453 1226 A 120 ALA HB% A 85 VAL HGy% 1.0 . 2.82 1454 1226 A 120 ALA HB% A 85 VAL HGx% 1.0 . 2.82 1455 1227 A 123 MET HBy A 85 VAL HGy% 1.0 . 4.40 1456 1227 A 123 MET HBy A 85 VAL HGx% 1.0 . 4.40 1457 1228 A 123 MET HBx A 85 VAL HGy% 1.0 . 4.56 1458 1228 A 123 MET HBx A 85 VAL HGx% 1.0 . 4.56 1459 1229 A 123 MET HGy A 85 VAL HGy% 1.0 . 5.44 1460 1229 A 123 MET HGy A 85 VAL HGx% 1.0 . 5.44 1461 1230 A 123 MET HE% A 85 VAL HGy% 1.0 . 3.77 1462 1230 A 123 MET HE% A 85 VAL HGx% 1.0 . 3.77 1463 1231 A 124 THR HG2% A 85 VAL HGy% 1.0 . 3.28 1464 1231 A 124 THR HG2% A 85 VAL HGx% 1.0 . 3.28 1465 1232 A 129 ALA HA A 85 VAL HGy% 1.0 . 5.12 1466 1232 A 129 ALA HA A 85 VAL HGx% 1.0 . 5.12 1467 1233 A 129 ALA HB% A 85 VAL HGy% 1.0 . 2.92 1468 1233 A 129 ALA HB% A 85 VAL HGx% 1.0 . 2.92 1469 1234 A 130 ARG H A 85 VAL HGy% 1.0 . 4.33 1470 1234 A 130 ARG H A 85 VAL HGx% 1.0 . 4.33 1471 1235 A 131 MET H A 85 VAL HGy% 1.0 . 5.17 1472 1235 A 131 MET H A 85 VAL HGx% 1.0 . 5.17 1473 1236 A 131 MET HA A 85 VAL HGy% 1.0 . 3.51 1474 1236 A 131 MET HA A 85 VAL HGx% 1.0 . 3.51 1475 1237 A 131 MET HBy A 85 VAL HGy% 1.0 . 5.04 1476 1237 A 131 MET HBy A 85 VAL HGx% 1.0 . 5.04 1477 1238 A 85 VAL HGy% A 131 MET HGy 1.0 . 4.56 1478 1238 A 85 VAL HGx% A 131 MET HGy 1.0 . 4.56 1479 1238 A 131 MET HGx A 85 VAL HGy% 1.0 . 4.56 1480 1238 A 85 VAL HGx% A 131 MET HGx 1.0 . 4.56 1481 1239 A 131 MET HE% A 85 VAL HGy% 1.0 . 3.61 1482 1239 A 131 MET HE% A 85 VAL HGx% 1.0 . 3.61 1483 1240 A 132 GLN H A 85 VAL HGy% 1.0 . 4.47 1484 1240 A 132 GLN H A 85 VAL HGx% 1.0 . 4.47 1485 1241 A 86 VAL H A 86 VAL HGy% 1.0 . 3.15 1486 1241 A 86 VAL H A 86 VAL HGx% 1.0 . 3.15 1487 1242 A 86 VAL H A 130 ARG HBx 1.0 . 5.34 1488 1242 A 86 VAL H A 130 ARG HBy 1.0 . 5.34 1489 1243 A 86 VAL HA A 86 VAL HGy% 1.0 . 2.84 1490 1243 A 86 VAL HA A 86 VAL HGx% 1.0 . 2.84 1491 1244 A 87 ALA H A 86 VAL HGy% 1.0 . 3.08 1492 1244 A 87 ALA H A 86 VAL HGx% 1.0 . 3.08 1493 1245 A 87 ALA HA A 86 VAL HGy% 1.0 . 4.27 1494 1245 A 87 ALA HA A 86 VAL HGx% 1.0 . 4.27 1495 1246 A 87 ALA HB% A 86 VAL HGy% 1.0 . 4.02 1496 1246 A 87 ALA HB% A 86 VAL HGx% 1.0 . 4.02 1497 1247 A 110 GLY H A 86 VAL HGy% 1.0 . 3.46 1498 1247 A 110 GLY H A 86 VAL HGx% 1.0 . 3.46 1499 1248 A 110 GLY HAx A 86 VAL HGy% 1.0 . 3.22 1500 1248 A 110 GLY HAx A 86 VAL HGx% 1.0 . 3.22 1501 1249 A 110 GLY HAy A 86 VAL HGy% 1.0 . 4.12 1502 1249 A 110 GLY HAy A 86 VAL HGx% 1.0 . 4.12 1503 1250 A 111 THR H A 86 VAL HGy% 1.0 . 3.84 1504 1250 A 111 THR H A 86 VAL HGx% 1.0 . 3.84 1505 1251 A 111 THR HA A 86 VAL HGy% 1.0 . 4.30 1506 1251 A 111 THR HA A 86 VAL HGx% 1.0 . 4.30 1507 1252 A 111 THR HB A 86 VAL HGy% 1.0 . 5.06 1508 1252 A 111 THR HB A 86 VAL HGx% 1.0 . 5.06 1509 1253 A 112 ALA H A 86 VAL HGy% 1.0 . 3.79 1510 1253 A 112 ALA H A 86 VAL HGx% 1.0 . 3.79 1511 1254 A 112 ALA HA A 86 VAL HGy% 1.0 . 3.23 1512 1254 A 112 ALA HA A 86 VAL HGx% 1.0 . 3.23 1513 1255 A 112 ALA HB% A 86 VAL HGy% 1.0 . 3.11 1514 1255 A 112 ALA HB% A 86 VAL HGx% 1.0 . 3.11 1515 1256 A 113 PHE H A 86 VAL HGy% 1.0 . 4.39 1516 1256 A 113 PHE H A 86 VAL HGx% 1.0 . 4.39 1517 1257 A 113 PHE HD% A 86 VAL HGy% 1.0 . 4.71 1518 1257 A 113 PHE HD% A 86 VAL HGx% 1.0 . 4.71 1519 1258 A 113 PHE HE% A 86 VAL HGy% 1.0 . 5.35 1520 1258 A 113 PHE HE% A 86 VAL HGx% 1.0 . 5.35 1521 1259 A 131 MET H A 86 VAL HGy% 1.0 . 5.44 1522 1259 A 131 MET H A 86 VAL HGx% 1.0 . 5.44 1523 1260 A 132 GLN H A 86 VAL HGy% 1.0 . 3.91 1524 1260 A 132 GLN H A 86 VAL HGx% 1.0 . 3.91 1525 1261 A 132 GLN HA A 86 VAL HGy% 1.0 . 3.09 1526 1261 A 132 GLN HA A 86 VAL HGx% 1.0 . 3.09 1527 1262 A 132 GLN HBx A 86 VAL HGy% 1.0 . 3.28 1528 1262 A 132 GLN HBx A 86 VAL HGx% 1.0 . 3.28 1529 1263 A 132 GLN HBy A 86 VAL HGy% 1.0 . 4.13 1530 1263 A 132 GLN HBy A 86 VAL HGx% 1.0 . 4.13 1531 1264 A 86 VAL HGx% A 132 GLN HGy 1.0 . 3.27 1532 1264 A 86 VAL HGy% A 132 GLN HGy 1.0 . 3.27 1533 1264 A 132 GLN HGx A 86 VAL HGy% 1.0 . 3.27 1534 1264 A 132 GLN HGx A 86 VAL HGx% 1.0 . 3.27 1535 1265 A 132 GLN HE2y A 86 VAL HGx% 1.0 . 4.27 1536 1265 A 132 GLN HE2y A 86 VAL HGy% 1.0 . 4.27 1537 1265 A 132 GLN HE2x A 86 VAL HGy% 1.0 . 4.27 1538 1265 A 132 GLN HE2x A 86 VAL HGx% 1.0 . 4.27 1539 1266 A 87 ALA H A 107 VAL HGy% 1.0 . 4.15 1540 1266 A 87 ALA H A 107 VAL HGx% 1.0 . 4.15 1541 1267 A 87 ALA HA A 107 VAL HGy% 1.0 . 4.62 1542 1267 A 87 ALA HA A 107 VAL HGx% 1.0 . 4.62 1543 1268 A 87 ALA HB% A 89 VAL HGy% 1.0 . 4.57 1544 1268 A 87 ALA HB% A 89 VAL HGx% 1.0 . 4.57 1545 1269 A 87 ALA HB% A 107 VAL HGy% 1.0 . 2.77 1546 1269 A 87 ALA HB% A 107 VAL HGx% 1.0 . 2.77 1547 1270 A 88 LEU H A 89 VAL HGy% 1.0 . 3.88 1548 1270 A 88 LEU H A 89 VAL HGx% 1.0 . 3.88 1549 1271 A 88 LEU HA A 89 VAL HGy% 1.0 . 4.25 1550 1271 A 88 LEU HA A 89 VAL HGx% 1.0 . 4.25 1551 1272 A 88 LEU HBy A 89 VAL HGy% 1.0 . 3.46 1552 1272 A 88 LEU HBy A 89 VAL HGx% 1.0 . 3.46 1553 1273 A 88 LEU HDx% A 130 ARG HBx 1.0 . 3.51 1554 1273 A 88 LEU HDx% A 130 ARG HBy 1.0 . 3.51 1555 1274 A 88 LEU HDy% A 130 ARG HBx 1.0 . 3.37 1556 1274 A 88 LEU HDy% A 130 ARG HBy 1.0 . 3.37 1557 1275 A 89 VAL H A 89 VAL HGy% 1.0 . 2.95 1558 1275 A 89 VAL H A 89 VAL HGx% 1.0 . 2.95 1559 1276 A 89 VAL HA A 89 VAL HGy% 1.0 . 2.94 1560 1276 A 89 VAL HA A 89 VAL HGx% 1.0 . 2.94 1561 1277 A 89 VAL HB A 128 LEU HDx% 1.0 . 4.76 1562 1277 A 89 VAL HB A 128 LEU HDy% 1.0 . 4.76 1563 1278 A 90 LYS H A 89 VAL HGy% 1.0 . 3.40 1564 1278 A 90 LYS H A 89 VAL HGx% 1.0 . 3.40 1565 1279 A 89 VAL HGy% A 90 LYS HBy 1.0 . 4.91 1566 1279 A 89 VAL HGx% A 90 LYS HBy 1.0 . 4.91 1567 1279 A 90 LYS HBx A 89 VAL HGy% 1.0 . 4.91 1568 1279 A 89 VAL HGx% A 90 LYS HBx 1.0 . 4.91 1569 1280 A 91 LEU H A 89 VAL HGy% 1.0 . 4.41 1570 1280 A 91 LEU H A 89 VAL HGx% 1.0 . 4.41 1571 1281 A 91 LEU HBx A 89 VAL HGy% 1.0 . 3.56 1572 1281 A 91 LEU HBx A 89 VAL HGx% 1.0 . 3.56 1573 1282 A 109 PRO HBy A 89 VAL HGy% 1.0 . 4.42 1574 1282 A 109 PRO HBy A 89 VAL HGx% 1.0 . 4.42 1575 1283 A 109 PRO HGy A 89 VAL HGy% 1.0 . 5.10 1576 1283 A 109 PRO HGy A 89 VAL HGx% 1.0 . 5.10 1577 1284 A 128 LEU HA A 89 VAL HGy% 1.0 . 3.26 1578 1284 A 128 LEU HA A 89 VAL HGx% 1.0 . 3.26 1579 1285 A 128 LEU HBy A 89 VAL HGy% 1.0 . 4.85 1580 1285 A 128 LEU HBy A 89 VAL HGx% 1.0 . 4.85 1581 1286 A 128 LEU HBx A 89 VAL HGy% 1.0 . 3.33 1582 1286 A 128 LEU HBx A 89 VAL HGx% 1.0 . 3.33 1583 1287 A 90 LYS H A 90 LYS HBy 1.0 . 2.92 1584 1287 A 90 LYS H A 90 LYS HBx 1.0 . 2.92 1585 1288 A 90 LYS H A 90 LYS HGy 1.0 . 3.12 1586 1288 A 90 LYS H A 90 LYS HGx 1.0 . 3.12 1587 1289 A 90 LYS HA A 90 LYS HGy 1.0 . 3.32 1588 1289 A 90 LYS HA A 90 LYS HGx 1.0 . 3.32 1589 1290 A 90 LYS HA A 107 VAL HGy% 1.0 . 5.44 1590 1290 A 90 LYS HA A 107 VAL HGx% 1.0 . 5.44 1591 1291 A 90 LYS HA A 108 LEU HDx% 1.0 . 4.25 1592 1291 A 90 LYS HA A 108 LEU HDy% 1.0 . 4.25 1593 1292 A 90 LYS HBx A 90 LYS HDx 1.0 . 2.88 1594 1292 A 90 LYS HBy A 90 LYS HDx 1.0 . 2.88 1595 1292 A 90 LYS HDy A 90 LYS HBy 1.0 . 2.88 1596 1292 A 90 LYS HDy A 90 LYS HBx 1.0 . 2.88 1597 1293 A 90 LYS HBy A 90 LYS HEx 1.0 . 3.60 1598 1293 A 90 LYS HBx A 90 LYS HEx 1.0 . 3.60 1599 1293 A 90 LYS HEy A 90 LYS HBy 1.0 . 3.60 1600 1293 A 90 LYS HEy A 90 LYS HBx 1.0 . 3.60 1601 1294 A 108 LEU HA A 90 LYS HBy 1.0 . 4.70 1602 1294 A 108 LEU HA A 90 LYS HBx 1.0 . 4.70 1603 1295 A 90 LYS HBy A 108 LEU HDx% 1.0 . 4.44 1604 1295 A 90 LYS HBx A 108 LEU HDx% 1.0 . 4.44 1605 1295 A 108 LEU HDy% A 90 LYS HBy 1.0 . 4.44 1606 1295 A 90 LYS HBx A 108 LEU HDy% 1.0 . 4.44 1607 1296 A 109 PRO HDx A 90 LYS HBy 1.0 . 4.17 1608 1296 A 109 PRO HDx A 90 LYS HBx 1.0 . 4.17 1609 1297 A 108 LEU HA A 90 LYS HGy 1.0 . 4.10 1610 1297 A 108 LEU HA A 90 LYS HGx 1.0 . 4.10 1611 1298 A 109 PRO HDy A 90 LYS HGy 1.0 . 4.66 1612 1298 A 109 PRO HDy A 90 LYS HGx 1.0 . 4.66 1613 1299 A 109 PRO HDx A 90 LYS HGy 1.0 . 3.88 1614 1299 A 109 PRO HDx A 90 LYS HGx 1.0 . 3.88 1615 1300 A 90 LYS HDx A 108 LEU HDx% 1.0 . 4.36 1616 1300 A 90 LYS HDy A 108 LEU HDx% 1.0 . 4.36 1617 1300 A 108 LEU HDy% A 90 LYS HDx 1.0 . 4.36 1618 1300 A 90 LYS HDy A 108 LEU HDy% 1.0 . 4.36 1619 1301 A 90 LYS HEx A 108 LEU HDx% 1.0 . 3.59 1620 1301 A 90 LYS HEy A 108 LEU HDx% 1.0 . 3.59 1621 1301 A 108 LEU HDy% A 90 LYS HEx 1.0 . 3.59 1622 1301 A 90 LYS HEy A 108 LEU HDy% 1.0 . 3.59 1623 1302 A 91 LEU H A 107 VAL HGy% 1.0 . 3.93 1624 1302 A 91 LEU H A 107 VAL HGx% 1.0 . 3.93 1625 1303 A 91 LEU H A 108 LEU HDx% 1.0 . 4.57 1626 1303 A 91 LEU H A 108 LEU HDy% 1.0 . 4.57 1627 1304 A 91 LEU HA A 92 HIS HBx 1.0 . 4.33 1628 1304 A 91 LEU HA A 92 HIS HBy 1.0 . 4.33 1629 1305 A 91 LEU HA A 107 VAL HGy% 1.0 . 5.19 1630 1305 A 91 LEU HA A 107 VAL HGx% 1.0 . 5.19 1631 1306 A 91 LEU HBy A 107 VAL HGy% 1.0 . 3.48 1632 1306 A 91 LEU HBy A 107 VAL HGx% 1.0 . 3.48 1633 1307 A 91 LEU HG A 92 HIS HBx 1.0 . 4.39 1634 1307 A 91 LEU HG A 92 HIS HBy 1.0 . 4.39 1635 1308 A 91 LEU HG A 107 VAL HGy% 1.0 . 4.07 1636 1308 A 91 LEU HG A 107 VAL HGx% 1.0 . 4.07 1637 1309 A 91 LEU HDx% A 92 HIS HBx 1.0 . 3.86 1638 1309 A 91 LEU HDy% A 92 HIS HBx 1.0 . 3.86 1639 1309 A 92 HIS HBy A 91 LEU HDx% 1.0 . 3.86 1640 1309 A 91 LEU HDy% A 92 HIS HBy 1.0 . 3.86 1641 1310 A 91 LEU HDx% A 107 VAL HGy% 1.0 . 3.53 1642 1310 A 107 VAL HGx% A 91 LEU HDx% 1.0 . 3.53 1643 1310 A 91 LEU HDy% A 107 VAL HGx% 1.0 . 3.53 1644 1310 A 91 LEU HDy% A 107 VAL HGy% 1.0 . 3.53 1645 1311 A 92 HIS H A 92 HIS HBx 1.0 . 3.05 1646 1311 A 92 HIS H A 92 HIS HBy 1.0 . 3.05 1647 1312 A 92 HIS H A 107 VAL HGy% 1.0 . 5.14 1648 1312 A 92 HIS H A 107 VAL HGx% 1.0 . 5.14 1649 1313 A 93 THR H A 92 HIS HBx 1.0 . 3.76 1650 1313 A 93 THR H A 92 HIS HBy 1.0 . 3.76 1651 1314 A 106 PHE HA A 92 HIS HBx 1.0 . 4.73 1652 1314 A 106 PHE HA A 92 HIS HBy 1.0 . 4.73 1653 1315 A 93 THR HB A 107 VAL HGy% 1.0 . 4.45 1654 1315 A 93 THR HB A 107 VAL HGx% 1.0 . 4.45 1655 1316 A 93 THR HG2% A 104 VAL HGy% 1.0 . 3.14 1656 1316 A 93 THR HG2% A 104 VAL HGx% 1.0 . 3.14 1657 1317 A 93 THR HG2% A 107 VAL HGy% 1.0 . 2.88 1658 1317 A 93 THR HG2% A 107 VAL HGx% 1.0 . 2.88 1659 1318 A 93 THR HG2% A 115 VAL HGy% 1.0 . 4.08 1660 1318 A 93 THR HG2% A 115 VAL HGx% 1.0 . 4.08 1661 1319 A 93 THR HG2% A 119 VAL HGy% 1.0 . 5.17 1662 1319 A 93 THR HG2% A 119 VAL HGx% 1.0 . 5.17 1663 1320 A 94 ASP H A 94 ASP HBy 1.0 . 3.18 1664 1320 A 94 ASP H A 94 ASP HBx 1.0 . 3.18 1665 1321 A 95 ALA H A 115 VAL HGy% 1.0 . 4.87 1666 1321 A 95 ALA H A 115 VAL HGx% 1.0 . 4.87 1667 1322 A 95 ALA HA A 96 LEU HDx% 1.0 . 5.44 1668 1322 A 95 ALA HA A 96 LEU HDy% 1.0 . 5.44 1669 1323 A 95 ALA HA A 104 VAL HGy% 1.0 . 5.39 1670 1323 A 95 ALA HA A 104 VAL HGx% 1.0 . 5.39 1671 1324 A 95 ALA HA A 115 VAL HGy% 1.0 . 3.84 1672 1324 A 95 ALA HA A 115 VAL HGx% 1.0 . 3.84 1673 1325 A 95 ALA HB% A 104 VAL HGy% 1.0 . 2.91 1674 1325 A 95 ALA HB% A 104 VAL HGx% 1.0 . 2.91 1675 1326 A 95 ALA HB% A 107 VAL HGy% 1.0 . 4.98 1676 1326 A 95 ALA HB% A 107 VAL HGx% 1.0 . 4.98 1677 1327 A 95 ALA HB% A 115 VAL HGy% 1.0 . 2.92 1678 1327 A 95 ALA HB% A 115 VAL HGx% 1.0 . 2.92 1679 1328 A 96 LEU H A 96 LEU HDx% 1.0 . 3.90 1680 1328 A 96 LEU H A 96 LEU HDy% 1.0 . 3.90 1681 1329 A 96 LEU HA A 96 LEU HDx% 1.0 . 2.91 1682 1329 A 96 LEU HA A 96 LEU HDy% 1.0 . 2.91 1683 1330 A 96 LEU HA A 104 VAL HGy% 1.0 . 4.73 1684 1330 A 96 LEU HA A 104 VAL HGx% 1.0 . 4.73 1685 1331 A 96 LEU HBy A 96 LEU HDx% 1.0 . 2.94 1686 1331 A 96 LEU HBy A 96 LEU HDy% 1.0 . 2.94 1687 1332 A 96 LEU HG A 103 PRO HBy 1.0 . 5.34 1688 1332 A 96 LEU HG A 103 PRO HBx 1.0 . 5.34 1689 1333 A 97 HIS H A 96 LEU HDx% 1.0 . 3.14 1690 1333 A 97 HIS H A 96 LEU HDy% 1.0 . 3.14 1691 1334 A 96 LEU HDy% A 97 HIS HBx 1.0 . 3.78 1692 1334 A 96 LEU HDx% A 97 HIS HBx 1.0 . 3.78 1693 1334 A 97 HIS HBy A 96 LEU HDx% 1.0 . 3.78 1694 1334 A 96 LEU HDy% A 97 HIS HBy 1.0 . 3.78 1695 1335 A 98 ALA HA A 96 LEU HDx% 1.0 . 4.92 1696 1335 A 98 ALA HA A 96 LEU HDy% 1.0 . 4.92 1697 1336 A 103 PRO HA A 96 LEU HDx% 1.0 . 3.04 1698 1336 A 103 PRO HA A 96 LEU HDy% 1.0 . 3.04 1699 1337 A 96 LEU HDx% A 103 PRO HBy 1.0 . 3.42 1700 1337 A 96 LEU HDy% A 103 PRO HBy 1.0 . 3.42 1701 1337 A 103 PRO HBx A 96 LEU HDx% 1.0 . 3.42 1702 1337 A 96 LEU HDy% A 103 PRO HBx 1.0 . 3.42 1703 1338 A 96 LEU HDy% A 103 PRO HGx 1.0 . 3.72 1704 1338 A 96 LEU HDx% A 103 PRO HGx 1.0 . 3.72 1705 1338 A 103 PRO HGy A 96 LEU HDx% 1.0 . 3.72 1706 1338 A 96 LEU HDy% A 103 PRO HGy 1.0 . 3.72 1707 1339 A 96 LEU HDy% A 103 PRO HDy 1.0 . 4.11 1708 1339 A 96 LEU HDx% A 103 PRO HDy 1.0 . 4.11 1709 1339 A 103 PRO HDx A 96 LEU HDx% 1.0 . 4.11 1710 1339 A 96 LEU HDy% A 103 PRO HDx 1.0 . 4.11 1711 1340 A 104 VAL H A 96 LEU HDx% 1.0 . 3.04 1712 1340 A 104 VAL H A 96 LEU HDy% 1.0 . 3.04 1713 1341 A 97 HIS H A 97 HIS HBx 1.0 . 2.97 1714 1341 A 97 HIS H A 97 HIS HBy 1.0 . 2.97 1715 1342 A 97 HIS H A 103 PRO HBy 1.0 . 4.32 1716 1342 A 97 HIS H A 103 PRO HBx 1.0 . 4.32 1717 1343 A 97 HIS H A 103 PRO HDy 1.0 . 4.98 1718 1343 A 97 HIS H A 103 PRO HDx 1.0 . 4.98 1719 1344 A 97 HIS HD2 A 97 HIS HBx 1.0 . 3.49 1720 1344 A 97 HIS HD2 A 97 HIS HBy 1.0 . 3.49 1721 1345 A 98 ALA H A 97 HIS HBx 1.0 . 3.80 1722 1345 A 98 ALA H A 97 HIS HBy 1.0 . 3.80 1723 1346 A 100 ARG H A 97 HIS HBx 1.0 . 3.91 1724 1346 A 100 ARG H A 97 HIS HBy 1.0 . 3.91 1725 1347 A 100 ARG HBy A 97 HIS HBx 1.0 . 5.24 1726 1347 A 100 ARG HBy A 97 HIS HBy 1.0 . 5.24 1727 1348 A 100 ARG HBx A 97 HIS HBx 1.0 . 4.07 1728 1348 A 100 ARG HBx A 97 HIS HBy 1.0 . 4.07 1729 1349 A 102 GLU H A 97 HIS HBx 1.0 . 3.21 1730 1349 A 102 GLU H A 97 HIS HBy 1.0 . 3.21 1731 1350 A 97 HIS HBy A 102 GLU HBx 1.0 . 4.02 1732 1350 A 97 HIS HBx A 102 GLU HBx 1.0 . 4.02 1733 1350 A 102 GLU HBy A 97 HIS HBx 1.0 . 4.02 1734 1350 A 97 HIS HBy A 102 GLU HBy 1.0 . 4.02 1735 1351 A 103 PRO HA A 97 HIS HBx 1.0 . 4.87 1736 1351 A 103 PRO HA A 97 HIS HBy 1.0 . 4.87 1737 1352 A 97 HIS HE1 A 100 ARG HDx 1.0 . 4.86 1738 1352 A 97 HIS HE1 A 100 ARG HDy 1.0 . 4.86 1739 1353 A 100 ARG H A 100 ARG HDx 1.0 . 4.84 1740 1353 A 100 ARG H A 100 ARG HDy 1.0 . 4.84 1741 1354 A 100 ARG H A 114 ARG HDx 1.0 . 5.34 1742 1354 A 100 ARG H A 114 ARG HDy 1.0 . 5.34 1743 1355 A 100 ARG HA A 100 ARG HDx 1.0 . 3.99 1744 1355 A 100 ARG HA A 100 ARG HDy 1.0 . 3.99 1745 1356 A 100 ARG HBy A 100 ARG HDx 1.0 . 3.50 1746 1356 A 100 ARG HBy A 100 ARG HDy 1.0 . 3.50 1747 1357 A 100 ARG HBx A 102 GLU HBx 1.0 . 4.18 1748 1357 A 100 ARG HBx A 102 GLU HBy 1.0 . 4.18 1749 1358 A 101 ASP H A 101 ASP HBx 1.0 . 3.17 1750 1358 A 101 ASP H A 101 ASP HBy 1.0 . 3.17 1751 1359 A 101 ASP HA A 102 GLU HBx 1.0 . 4.63 1752 1359 A 101 ASP HA A 102 GLU HBy 1.0 . 4.63 1753 1360 A 102 GLU H A 101 ASP HBx 1.0 . 4.13 1754 1360 A 102 GLU H A 101 ASP HBy 1.0 . 4.13 1755 1361 A 102 GLU H A 102 GLU HBx 1.0 . 3.09 1756 1361 A 102 GLU H A 102 GLU HBy 1.0 . 3.09 1757 1362 A 102 GLU H A 102 GLU HGx 1.0 . 4.89 1758 1362 A 102 GLU H A 102 GLU HGy 1.0 . 4.89 1759 1363 A 102 GLU H A 103 PRO HDy 1.0 . 4.11 1760 1363 A 102 GLU H A 103 PRO HDx 1.0 . 4.11 1761 1364 A 102 GLU HA A 102 GLU HGx 1.0 . 3.28 1762 1364 A 102 GLU HA A 102 GLU HGy 1.0 . 3.28 1763 1365 A 102 GLU HBy A 102 GLU HGx 1.0 . 2.32 1764 1365 A 102 GLU HGy A 102 GLU HBx 1.0 . 2.32 1765 1365 A 102 GLU HBy A 102 GLU HGy 1.0 . 2.32 1766 1365 A 102 GLU HBx A 102 GLU HGx 1.0 . 2.32 1767 1366 A 102 GLU HBy A 103 PRO HDy 1.0 . 4.84 1768 1366 A 103 PRO HDx A 102 GLU HBx 1.0 . 4.84 1769 1366 A 103 PRO HDx A 102 GLU HBy 1.0 . 4.84 1770 1366 A 102 GLU HBx A 103 PRO HDy 1.0 . 4.84 1771 1367 A 102 GLU HGx A 103 PRO HDy 1.0 . 4.20 1772 1367 A 102 GLU HGy A 103 PRO HDy 1.0 . 4.20 1773 1367 A 103 PRO HDx A 102 GLU HGx 1.0 . 4.20 1774 1367 A 103 PRO HDx A 102 GLU HGy 1.0 . 4.20 1775 1368 A 104 VAL H A 103 PRO HBy 1.0 . 3.13 1776 1368 A 104 VAL H A 103 PRO HBx 1.0 . 3.13 1777 1369 A 104 VAL HB A 103 PRO HBy 1.0 . 5.34 1778 1369 A 104 VAL HB A 103 PRO HBx 1.0 . 5.34 1779 1370 A 104 VAL H A 103 PRO HGx 1.0 . 4.41 1780 1370 A 104 VAL H A 103 PRO HGy 1.0 . 4.41 1781 1371 A 104 VAL H A 103 PRO HDy 1.0 . 4.96 1782 1371 A 104 VAL H A 103 PRO HDx 1.0 . 4.96 1783 1372 A 104 VAL H A 104 VAL HGy% 1.0 . 3.37 1784 1372 A 104 VAL H A 104 VAL HGx% 1.0 . 3.37 1785 1373 A 104 VAL HA A 104 VAL HGy% 1.0 . 2.89 1786 1373 A 104 VAL HA A 104 VAL HGx% 1.0 . 2.89 1787 1374 A 104 VAL HA A 107 VAL HGy% 1.0 . 5.44 1788 1374 A 104 VAL HA A 107 VAL HGx% 1.0 . 5.44 1789 1375 A 104 VAL HB A 107 VAL HGy% 1.0 . 5.44 1790 1375 A 104 VAL HB A 107 VAL HGx% 1.0 . 5.44 1791 1376 A 105 ALA H A 104 VAL HGy% 1.0 . 3.58 1792 1376 A 105 ALA H A 104 VAL HGx% 1.0 . 3.58 1793 1377 A 105 ALA HA A 104 VAL HGy% 1.0 . 4.46 1794 1377 A 105 ALA HA A 104 VAL HGx% 1.0 . 4.46 1795 1378 A 106 PHE H A 104 VAL HGy% 1.0 . 3.39 1796 1378 A 106 PHE H A 104 VAL HGx% 1.0 . 3.39 1797 1379 A 106 PHE HA A 104 VAL HGy% 1.0 . 5.26 1798 1379 A 106 PHE HA A 104 VAL HGx% 1.0 . 5.26 1799 1380 A 107 VAL H A 104 VAL HGy% 1.0 . 5.37 1800 1380 A 107 VAL H A 104 VAL HGx% 1.0 . 5.37 1801 1381 A 107 VAL HA A 104 VAL HGy% 1.0 . 4.37 1802 1381 A 107 VAL HA A 104 VAL HGx% 1.0 . 4.37 1803 1382 A 107 VAL HB A 104 VAL HGy% 1.0 . 4.76 1804 1382 A 107 VAL HB A 104 VAL HGx% 1.0 . 4.76 1805 1383 A 104 VAL HGy% A 107 VAL HGy% 1.0 . 3.10 1806 1383 A 104 VAL HGx% A 107 VAL HGy% 1.0 . 3.10 1807 1383 A 107 VAL HGx% A 104 VAL HGy% 1.0 . 3.10 1808 1383 A 107 VAL HGx% A 104 VAL HGx% 1.0 . 3.10 1809 1384 A 113 PHE HBy A 104 VAL HGy% 1.0 . 3.76 1810 1384 A 113 PHE HBy A 104 VAL HGx% 1.0 . 3.76 1811 1385 A 113 PHE HD% A 104 VAL HGy% 1.0 . 4.10 1812 1385 A 113 PHE HD% A 104 VAL HGx% 1.0 . 4.10 1813 1386 A 106 PHE H A 107 VAL HGy% 1.0 . 4.65 1814 1386 A 106 PHE H A 107 VAL HGx% 1.0 . 4.65 1815 1387 A 106 PHE H A 108 LEU HDx% 1.0 . 5.44 1816 1387 A 106 PHE H A 108 LEU HDy% 1.0 . 5.44 1817 1388 A 106 PHE HA A 107 VAL HGy% 1.0 . 4.50 1818 1388 A 106 PHE HA A 107 VAL HGx% 1.0 . 4.50 1819 1389 A 106 PHE HBy A 107 VAL HGy% 1.0 . 5.44 1820 1389 A 106 PHE HBy A 107 VAL HGx% 1.0 . 5.44 1821 1390 A 106 PHE HBy A 108 LEU HDx% 1.0 . 5.44 1822 1390 A 106 PHE HBy A 108 LEU HDy% 1.0 . 5.44 1823 1391 A 106 PHE HD% A 108 LEU HDx% 1.0 . 4.42 1824 1391 A 106 PHE HD% A 108 LEU HDy% 1.0 . 4.42 1825 1392 A 107 VAL H A 107 VAL HGy% 1.0 . 3.16 1826 1392 A 107 VAL H A 107 VAL HGx% 1.0 . 3.16 1827 1393 A 107 VAL HA A 107 VAL HGy% 1.0 . 2.93 1828 1393 A 107 VAL HA A 107 VAL HGx% 1.0 . 2.93 1829 1394 A 107 VAL HA A 108 LEU HDx% 1.0 . 4.38 1830 1394 A 107 VAL HA A 108 LEU HDy% 1.0 . 4.38 1831 1395 A 108 LEU H A 107 VAL HGy% 1.0 . 3.63 1832 1395 A 108 LEU H A 107 VAL HGx% 1.0 . 3.63 1833 1396 A 107 VAL HGx% A 108 LEU HDx% 1.0 . 4.86 1834 1396 A 107 VAL HGy% A 108 LEU HDx% 1.0 . 4.86 1835 1396 A 108 LEU HDy% A 107 VAL HGy% 1.0 . 4.86 1836 1396 A 107 VAL HGx% A 108 LEU HDy% 1.0 . 4.86 1837 1397 A 109 PRO HA A 107 VAL HGy% 1.0 . 5.44 1838 1397 A 109 PRO HA A 107 VAL HGx% 1.0 . 5.44 1839 1398 A 111 THR H A 107 VAL HGy% 1.0 . 5.44 1840 1398 A 111 THR H A 107 VAL HGx% 1.0 . 5.44 1841 1399 A 111 THR HB A 107 VAL HGy% 1.0 . 3.21 1842 1399 A 111 THR HB A 107 VAL HGx% 1.0 . 3.21 1843 1400 A 111 THR HG2% A 107 VAL HGy% 1.0 . 2.93 1844 1400 A 111 THR HG2% A 107 VAL HGx% 1.0 . 2.93 1845 1401 A 112 ALA H A 107 VAL HGy% 1.0 . 5.24 1846 1401 A 112 ALA H A 107 VAL HGx% 1.0 . 5.24 1847 1402 A 113 PHE H A 107 VAL HGy% 1.0 . 4.93 1848 1402 A 113 PHE H A 107 VAL HGx% 1.0 . 4.93 1849 1403 A 113 PHE HA A 107 VAL HGy% 1.0 . 4.83 1850 1403 A 113 PHE HA A 107 VAL HGx% 1.0 . 4.83 1851 1404 A 113 PHE HBx A 107 VAL HGy% 1.0 . 4.08 1852 1404 A 113 PHE HBx A 107 VAL HGx% 1.0 . 4.08 1853 1405 A 113 PHE HBy A 107 VAL HGy% 1.0 . 3.88 1854 1405 A 113 PHE HBy A 107 VAL HGx% 1.0 . 3.88 1855 1406 A 113 PHE HD% A 107 VAL HGy% 1.0 . 3.14 1856 1406 A 113 PHE HD% A 107 VAL HGx% 1.0 . 3.14 1857 1407 A 113 PHE HE% A 107 VAL HGy% 1.0 . 3.37 1858 1407 A 113 PHE HE% A 107 VAL HGx% 1.0 . 3.37 1859 1408 A 123 MET HE% A 107 VAL HGy% 1.0 . 4.67 1860 1408 A 123 MET HE% A 107 VAL HGx% 1.0 . 4.67 1861 1409 A 108 LEU H A 108 LEU HDx% 1.0 . 3.62 1862 1409 A 108 LEU H A 108 LEU HDy% 1.0 . 3.62 1863 1410 A 109 PRO HGy A 108 LEU HDx% 1.0 . 5.44 1864 1410 A 109 PRO HGy A 108 LEU HDy% 1.0 . 5.44 1865 1411 A 109 PRO HDy A 108 LEU HDx% 1.0 . 3.56 1866 1411 A 109 PRO HDy A 108 LEU HDy% 1.0 . 3.56 1867 1412 A 109 PRO HDx A 108 LEU HDx% 1.0 . 3.59 1868 1412 A 109 PRO HDx A 108 LEU HDy% 1.0 . 3.59 1869 1413 A 112 ALA HA A 132 GLN HE2y 1.0 . 5.34 1870 1413 A 112 ALA HA A 132 GLN HE2x 1.0 . 5.34 1871 1414 A 112 ALA HB% A 132 GLN HGy 1.0 . 4.11 1872 1414 A 112 ALA HB% A 132 GLN HGx 1.0 . 4.11 1873 1415 A 112 ALA HB% A 132 GLN HE2y 1.0 . 3.70 1874 1415 A 112 ALA HB% A 132 GLN HE2x 1.0 . 3.70 1875 1416 A 113 PHE H A 114 ARG HGy 1.0 . 5.34 1876 1416 A 113 PHE H A 114 ARG HGx 1.0 . 5.34 1877 1417 A 113 PHE HA A 114 ARG HGy 1.0 . 4.40 1878 1417 A 113 PHE HA A 114 ARG HGx 1.0 . 4.40 1879 1418 A 113 PHE HD% A 115 VAL HGy% 1.0 . 3.49 1880 1418 A 113 PHE HD% A 115 VAL HGx% 1.0 . 3.49 1881 1419 A 113 PHE HD% A 119 VAL HGy% 1.0 . 5.37 1882 1419 A 113 PHE HD% A 119 VAL HGx% 1.0 . 5.37 1883 1420 A 113 PHE HE% A 115 VAL HGy% 1.0 . 3.31 1884 1420 A 113 PHE HE% A 115 VAL HGx% 1.0 . 3.31 1885 1421 A 113 PHE HE% A 119 VAL HGy% 1.0 . 5.44 1886 1421 A 113 PHE HE% A 119 VAL HGx% 1.0 . 5.44 1887 1422 A 114 ARG H A 114 ARG HGy 1.0 . 3.16 1888 1422 A 114 ARG H A 114 ARG HGx 1.0 . 3.16 1889 1423 A 114 ARG H A 115 VAL HGy% 1.0 . 4.22 1890 1423 A 114 ARG H A 115 VAL HGx% 1.0 . 4.22 1891 1424 A 114 ARG HA A 114 ARG HGy 1.0 . 3.49 1892 1424 A 114 ARG HA A 114 ARG HGx 1.0 . 3.49 1893 1425 A 114 ARG HA A 114 ARG HDx 1.0 . 4.18 1894 1425 A 114 ARG HA A 114 ARG HDy 1.0 . 4.18 1895 1426 A 114 ARG HA A 115 VAL HGy% 1.0 . 4.05 1896 1426 A 114 ARG HA A 115 VAL HGx% 1.0 . 4.05 1897 1427 A 114 ARG HBy A 114 ARG HDx 1.0 . 3.41 1898 1427 A 114 ARG HBy A 114 ARG HDy 1.0 . 3.41 1899 1428 A 114 ARG HBy A 115 VAL HGy% 1.0 . 4.61 1900 1428 A 114 ARG HBy A 115 VAL HGx% 1.0 . 4.61 1901 1429 A 114 ARG HBx A 114 ARG HDx 1.0 . 3.33 1902 1429 A 114 ARG HBx A 114 ARG HDy 1.0 . 3.33 1903 1430 A 115 VAL H A 115 VAL HGy% 1.0 . 2.93 1904 1430 A 115 VAL H A 115 VAL HGx% 1.0 . 2.93 1905 1431 A 115 VAL HA A 115 VAL HGy% 1.0 . 2.79 1906 1431 A 115 VAL HA A 115 VAL HGx% 1.0 . 2.79 1907 1432 A 115 VAL HA A 119 VAL HGy% 1.0 . 4.51 1908 1432 A 115 VAL HA A 119 VAL HGx% 1.0 . 4.51 1909 1433 A 115 VAL HB A 119 VAL HGy% 1.0 . 3.15 1910 1433 A 115 VAL HB A 119 VAL HGx% 1.0 . 3.15 1911 1434 A 116 SER H A 115 VAL HGy% 1.0 . 3.53 1912 1434 A 116 SER H A 115 VAL HGx% 1.0 . 3.53 1913 1435 A 116 SER HA A 115 VAL HGy% 1.0 . 5.44 1914 1435 A 116 SER HA A 115 VAL HGx% 1.0 . 5.44 1915 1436 A 117 ALA HA A 115 VAL HGy% 1.0 . 4.56 1916 1436 A 117 ALA HA A 115 VAL HGx% 1.0 . 4.56 1917 1437 A 118 GLY H A 115 VAL HGy% 1.0 . 5.44 1918 1437 A 118 GLY H A 115 VAL HGx% 1.0 . 5.44 1919 1438 A 119 VAL H A 115 VAL HGy% 1.0 . 4.18 1920 1438 A 119 VAL H A 115 VAL HGx% 1.0 . 4.18 1921 1439 A 119 VAL HA A 115 VAL HGy% 1.0 . 4.54 1922 1439 A 119 VAL HA A 115 VAL HGx% 1.0 . 4.54 1923 1440 A 119 VAL HB A 115 VAL HGy% 1.0 . 3.41 1924 1440 A 119 VAL HB A 115 VAL HGx% 1.0 . 3.41 1925 1441 A 115 VAL HGx% A 119 VAL HGy% 1.0 . 2.78 1926 1441 A 115 VAL HGy% A 119 VAL HGy% 1.0 . 2.78 1927 1441 A 119 VAL HGx% A 115 VAL HGy% 1.0 . 2.78 1928 1441 A 115 VAL HGx% A 119 VAL HGx% 1.0 . 2.78 1929 1442 A 120 ALA H A 115 VAL HGy% 1.0 . 3.11 1930 1442 A 120 ALA H A 115 VAL HGx% 1.0 . 3.11 1931 1443 A 120 ALA HA A 115 VAL HGy% 1.0 . 3.27 1932 1443 A 120 ALA HA A 115 VAL HGx% 1.0 . 3.27 1933 1444 A 120 ALA HB% A 115 VAL HGy% 1.0 . 2.79 1934 1444 A 120 ALA HB% A 115 VAL HGx% 1.0 . 2.79 1935 1445 A 121 ALA H A 115 VAL HGy% 1.0 . 4.52 1936 1445 A 121 ALA H A 115 VAL HGx% 1.0 . 4.52 1937 1446 A 123 MET HBx A 115 VAL HGy% 1.0 . 5.40 1938 1446 A 123 MET HBx A 115 VAL HGx% 1.0 . 5.40 1939 1447 A 123 MET HGx A 115 VAL HGy% 1.0 . 5.35 1940 1447 A 123 MET HGx A 115 VAL HGx% 1.0 . 5.35 1941 1448 A 123 MET HE% A 115 VAL HGy% 1.0 . 3.64 1942 1448 A 123 MET HE% A 115 VAL HGx% 1.0 . 3.64 1943 1449 A 124 THR H A 115 VAL HGy% 1.0 . 5.44 1944 1449 A 124 THR H A 115 VAL HGx% 1.0 . 5.44 1945 1450 A 116 SER H A 116 SER HBx 1.0 . 3.04 1946 1450 A 116 SER H A 116 SER HBy 1.0 . 3.04 1947 1451 A 116 SER H A 119 VAL HGy% 1.0 . 3.21 1948 1451 A 116 SER H A 119 VAL HGx% 1.0 . 3.21 1949 1452 A 118 GLY H A 116 SER HBx 1.0 . 3.94 1950 1452 A 118 GLY H A 116 SER HBy 1.0 . 3.94 1951 1453 A 118 GLY HAx A 116 SER HBx 1.0 . 4.37 1952 1453 A 118 GLY HAx A 116 SER HBy 1.0 . 4.37 1953 1454 A 119 VAL H A 116 SER HBx 1.0 . 4.01 1954 1454 A 119 VAL H A 116 SER HBy 1.0 . 4.01 1955 1455 A 119 VAL HB A 116 SER HBx 1.0 . 4.81 1956 1455 A 119 VAL HB A 116 SER HBy 1.0 . 4.81 1957 1456 A 116 SER HBx A 119 VAL HGy% 1.0 . 3.95 1958 1456 A 116 SER HBy A 119 VAL HGy% 1.0 . 3.95 1959 1456 A 119 VAL HGx% A 116 SER HBx 1.0 . 3.95 1960 1456 A 116 SER HBy A 119 VAL HGx% 1.0 . 3.95 1961 1457 A 117 ALA HA A 119 VAL HGy% 1.0 . 5.44 1962 1457 A 117 ALA HA A 119 VAL HGx% 1.0 . 5.44 1963 1458 A 118 GLY H A 119 VAL HGy% 1.0 . 4.53 1964 1458 A 118 GLY H A 119 VAL HGx% 1.0 . 4.53 1965 1459 A 119 VAL H A 119 VAL HGy% 1.0 . 2.92 1966 1459 A 119 VAL H A 119 VAL HGx% 1.0 . 2.92 1967 1460 A 119 VAL HA A 119 VAL HGy% 1.0 . 2.55 1968 1460 A 119 VAL HA A 119 VAL HGx% 1.0 . 2.55 1969 1461 A 119 VAL HA A 122 GLU HBy 1.0 . 3.40 1970 1461 A 119 VAL HA A 122 GLU HBx 1.0 . 3.40 1971 1462 A 120 ALA H A 119 VAL HGy% 1.0 . 3.66 1972 1462 A 120 ALA H A 119 VAL HGx% 1.0 . 3.66 1973 1463 A 120 ALA HA A 119 VAL HGy% 1.0 . 3.91 1974 1463 A 120 ALA HA A 119 VAL HGx% 1.0 . 3.91 1975 1464 A 122 GLU H A 119 VAL HGy% 1.0 . 4.34 1976 1464 A 122 GLU H A 119 VAL HGx% 1.0 . 4.34 1977 1465 A 119 VAL HGx% A 122 GLU HBy 1.0 . 4.39 1978 1465 A 122 GLU HBx A 119 VAL HGy% 1.0 . 4.39 1979 1465 A 119 VAL HGx% A 122 GLU HBx 1.0 . 4.39 1980 1465 A 119 VAL HGy% A 122 GLU HBy 1.0 . 4.39 1981 1466 A 123 MET H A 119 VAL HGy% 1.0 . 3.94 1982 1466 A 123 MET H A 119 VAL HGx% 1.0 . 3.94 1983 1467 A 123 MET HBy A 119 VAL HGy% 1.0 . 4.61 1984 1467 A 123 MET HBy A 119 VAL HGx% 1.0 . 4.61 1985 1468 A 123 MET HGy A 119 VAL HGy% 1.0 . 4.05 1986 1468 A 123 MET HGy A 119 VAL HGx% 1.0 . 4.05 1987 1469 A 123 MET HGx A 119 VAL HGy% 1.0 . 3.93 1988 1469 A 123 MET HGx A 119 VAL HGx% 1.0 . 3.93 1989 1470 A 121 ALA HB% A 122 GLU HBy 1.0 . 4.60 1990 1470 A 121 ALA HB% A 122 GLU HBx 1.0 . 4.60 1991 1471 A 122 GLU H A 122 GLU HBy 1.0 . 2.86 1992 1471 A 122 GLU H A 122 GLU HBx 1.0 . 2.86 1993 1472 A 122 GLU HA A 122 GLU HBy 1.0 . 2.60 1994 1472 A 122 GLU HA A 122 GLU HBx 1.0 . 2.60 1995 1473 A 122 GLU HBy A 122 GLU HGx 1.0 . 2.28 1996 1473 A 122 GLU HBx A 122 GLU HGx 1.0 . 2.28 1997 1473 A 122 GLU HGy A 122 GLU HBy 1.0 . 2.28 1998 1473 A 122 GLU HGy A 122 GLU HBx 1.0 . 2.28 1999 1474 A 123 MET H A 122 GLU HBy 1.0 . 3.14 2000 1474 A 123 MET H A 122 GLU HBx 1.0 . 3.14 2001 1475 A 122 GLU HBx A 126 ARG HDx 1.0 . 4.70 2002 1475 A 126 ARG HDy A 122 GLU HBy 1.0 . 4.70 2003 1475 A 126 ARG HDy A 122 GLU HBx 1.0 . 4.70 2004 1475 A 122 GLU HBy A 126 ARG HDx 1.0 . 4.70 2005 1476 A 122 GLU HGy A 126 ARG HGx 1.0 . 5.28 2006 1476 A 122 GLU HGx A 126 ARG HGx 1.0 . 5.28 2007 1476 A 126 ARG HGy A 122 GLU HGx 1.0 . 5.28 2008 1476 A 122 GLU HGy A 126 ARG HGy 1.0 . 5.28 2009 1477 A 123 MET HBx A 128 LEU HDx% 1.0 . 5.44 2010 1477 A 123 MET HBx A 128 LEU HDy% 1.0 . 5.44 2011 1478 A 123 MET HE% A 128 LEU HDx% 1.0 . 4.26 2012 1478 A 123 MET HE% A 128 LEU HDy% 1.0 . 4.26 2013 1479 A 124 THR HG2% A 130 ARG HBx 1.0 . 5.34 2014 1479 A 124 THR HG2% A 130 ARG HBy 1.0 . 5.34 2015 1480 A 124 THR HG2% A 131 MET HGy 1.0 . 3.45 2016 1480 A 124 THR HG2% A 131 MET HGx 1.0 . 3.45 2017 1481 A 125 GLU H A 126 ARG HGx 1.0 . 4.39 2018 1481 A 125 GLU H A 126 ARG HGy 1.0 . 4.39 2019 1482 A 125 GLU HBx A 126 ARG HGx 1.0 . 5.34 2020 1482 A 125 GLU HBy A 126 ARG HGx 1.0 . 5.34 2021 1482 A 126 ARG HGy A 125 GLU HBx 1.0 . 5.34 2022 1482 A 125 GLU HBy A 126 ARG HGy 1.0 . 5.34 2023 1483 A 126 ARG H A 126 ARG HGx 1.0 . 3.03 2024 1483 A 126 ARG H A 126 ARG HGy 1.0 . 3.03 2025 1484 A 126 ARG H A 128 LEU HDx% 1.0 . 4.96 2026 1484 A 126 ARG H A 128 LEU HDy% 1.0 . 4.96 2027 1485 A 126 ARG HA A 126 ARG HGx 1.0 . 3.12 2028 1485 A 126 ARG HA A 126 ARG HGy 1.0 . 3.12 2029 1486 A 126 ARG HA A 128 LEU HDx% 1.0 . 4.37 2030 1486 A 126 ARG HA A 128 LEU HDy% 1.0 . 4.37 2031 1487 A 126 ARG HBx A 126 ARG HGx 1.0 . 2.59 2032 1487 A 126 ARG HBx A 126 ARG HGy 1.0 . 2.59 2033 1488 A 126 ARG HBx A 128 LEU HDx% 1.0 . 4.37 2034 1488 A 126 ARG HBx A 128 LEU HDy% 1.0 . 4.37 2035 1489 A 126 ARG HBy A 128 LEU HDx% 1.0 . 4.14 2036 1489 A 126 ARG HBy A 128 LEU HDy% 1.0 . 4.14 2037 1490 A 127 GLY H A 126 ARG HGx 1.0 . 4.73 2038 1490 A 127 GLY H A 126 ARG HGy 1.0 . 4.73 2039 1491 A 126 ARG HGx A 128 LEU HDx% 1.0 . 4.41 2040 1491 A 126 ARG HGy A 128 LEU HDx% 1.0 . 4.41 2041 1491 A 128 LEU HDy% A 126 ARG HGx 1.0 . 4.41 2042 1491 A 128 LEU HDy% A 126 ARG HGy 1.0 . 4.41 2043 1492 A 126 ARG HDx A 128 LEU HDx% 1.0 . 3.52 2044 1492 A 126 ARG HDy A 128 LEU HDx% 1.0 . 3.52 2045 1492 A 128 LEU HDy% A 126 ARG HDx 1.0 . 3.52 2046 1492 A 126 ARG HDy A 128 LEU HDy% 1.0 . 3.52 2047 1493 A 127 GLY H A 128 LEU HDx% 1.0 . 5.05 2048 1493 A 127 GLY H A 128 LEU HDy% 1.0 . 5.05 2049 1494 A 127 GLY HAx A 128 LEU HDx% 1.0 . 5.44 2050 1494 A 127 GLY HAx A 128 LEU HDy% 1.0 . 5.44 2051 1495 A 127 GLY HAy A 128 LEU HDx% 1.0 . 5.15 2052 1495 A 127 GLY HAy A 128 LEU HDy% 1.0 . 5.15 2053 1496 A 128 LEU H A 128 LEU HDx% 1.0 . 3.43 2054 1496 A 128 LEU H A 128 LEU HDy% 1.0 . 3.43 2055 1497 A 128 LEU HA A 128 LEU HDx% 1.0 . 2.87 2056 1497 A 128 LEU HA A 128 LEU HDy% 1.0 . 2.87 2057 1498 A 128 LEU HBx A 128 LEU HDx% 1.0 . 2.98 2058 1498 A 128 LEU HBx A 128 LEU HDy% 1.0 . 2.98 2059 1499 A 129 ALA H A 128 LEU HDx% 1.0 . 4.71 2060 1499 A 129 ALA H A 128 LEU HDy% 1.0 . 4.71 2061 1500 A 129 ALA HA A 130 ARG HBx 1.0 . 5.08 2062 1500 A 129 ALA HA A 130 ARG HBy 1.0 . 5.08 2063 1501 A 130 ARG HBx A 130 ARG HDx 1.0 . 2.89 2064 1501 A 130 ARG HDy A 130 ARG HBx 1.0 . 2.89 2065 1501 A 130 ARG HDy A 130 ARG HBy 1.0 . 2.89 2066 1501 A 130 ARG HBy A 130 ARG HDx 1.0 . 2.89 2067 1502 A 131 MET H A 130 ARG HBx 1.0 . 3.80 2068 1502 A 131 MET H A 130 ARG HBy 1.0 . 3.80 2069 1503 A 131 MET H A 131 MET HGy 1.0 . 2.89 2070 1503 A 131 MET H A 131 MET HGx 1.0 . 2.89 2071 1504 A 131 MET HE% A 131 MET HGy 1.0 . 2.87 2072 1504 A 131 MET HE% A 131 MET HGx 1.0 . 2.87 2073 1505 A 132 GLN HA A 132 GLN HGy 1.0 . 2.90 2074 1505 A 132 GLN HA A 132 GLN HGx 1.0 . 2.90 2075 1506 A 132 GLN HA A 132 GLN HE2y 1.0 . 5.34 2076 1506 A 132 GLN HA A 132 GLN HE2x 1.0 . 5.34 2077 1507 A 132 GLN HBx A 132 GLN HE2y 1.0 . 4.51 2078 1507 A 132 GLN HBx A 132 GLN HE2x 1.0 . 4.51 2079 1508 A 132 GLN HBy A 132 GLN HE2y 1.0 . 4.23 2080 1508 A 132 GLN HBy A 132 GLN HE2x 1.0 . 4.23 2081 1509 A 132 GLN HE2x A 132 GLN HGy 1.0 . 3.20 2082 1509 A 132 GLN HE2y A 132 GLN HGx 1.0 . 3.20 2083 1509 A 132 GLN HE2x A 132 GLN HGx 1.0 . 3.20 2084 1509 A 132 GLN HE2y A 132 GLN HGy 1.0 . 3.20 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 82 LEU C A 83 VAL N A 83 VAL CA A 83 VAL C 1.0 -152.0 -80.0 PHI 2 2 A 83 VAL N A 83 VAL CA A 83 VAL C A 84 THR N 1.0 105.0 185.0 PSI 3 3 A 83 VAL C A 84 THR N A 84 THR CA A 84 THR C 1.0 -120.0 -68.0 PHI 4 4 A 84 THR N A 84 THR CA A 84 THR C A 85 VAL N 1.0 115.0 155.0 PSI 5 5 A 84 THR C A 85 VAL N A 85 VAL CA A 85 VAL C 1.0 -156.0 -104.0 PHI 6 6 A 85 VAL N A 85 VAL CA A 85 VAL C A 86 VAL N 1.0 131.0 191.0 PSI 7 7 A 85 VAL C A 86 VAL N A 86 VAL CA A 86 VAL C 1.0 -154.0 -78.0 PHI 8 8 A 86 VAL N A 86 VAL CA A 86 VAL C A 87 ALA N 1.0 107.0 187.0 PSI 9 9 A 86 VAL C A 87 ALA N A 87 ALA CA A 87 ALA C 1.0 -103.0 -47.0 PHI 10 10 A 87 ALA N A 87 ALA CA A 87 ALA C A 88 LEU N 1.0 117.0 169.0 PSI 11 11 A 88 LEU C A 89 VAL N A 89 VAL CA A 89 VAL C 1.0 -154.0 -102.0 PHI 12 12 A 89 VAL N A 89 VAL CA A 89 VAL C A 90 LYS N 1.0 137.0 177.0 PSI 13 13 A 89 VAL C A 90 LYS N A 90 LYS CA A 90 LYS C 1.0 -126.0 -54.0 PHI 14 14 A 90 LYS N A 90 LYS CA A 90 LYS C A 91 LEU N 1.0 95.0 171.0 PSI 15 15 A 90 LYS C A 91 LEU N A 91 LEU CA A 91 LEU C 1.0 -161.0 -53.0 PHI 16 16 A 91 LEU N A 91 LEU CA A 91 LEU C A 92 HIS N 1.0 108.0 180.0 PSI 17 17 A 91 LEU C A 92 HIS N A 92 HIS CA A 92 HIS C 1.0 -126.0 -66.0 PHI 18 18 A 92 HIS N A 92 HIS CA A 92 HIS C A 93 THR N 1.0 107.0 139.0 PSI 19 19 A 92 HIS C A 93 THR N A 93 THR CA A 93 THR C 1.0 -150.0 -30.0 PHI 20 20 A 93 THR N A 93 THR CA A 93 THR C A 94 ASP N 1.0 90.0 180.0 PSI 21 21 A 93 THR C A 94 ASP N A 94 ASP CA A 94 ASP C 1.0 -150.0 -30.0 PHI 22 22 A 94 ASP N A 94 ASP CA A 94 ASP C A 95 ALA N 1.0 90.0 180.0 PSI 23 23 A 94 ASP C A 95 ALA N A 95 ALA CA A 95 ALA C 1.0 -150.0 -30.0 PHI 24 24 A 95 ALA N A 95 ALA CA A 95 ALA C A 96 LEU N 1.0 90.0 180.0 PSI 25 25 A 95 ALA C A 96 LEU N A 96 LEU CA A 96 LEU C 1.0 -154.0 -90.0 PHI 26 26 A 96 LEU N A 96 LEU CA A 96 LEU C A 97 HIS N 1.0 123.0 167.0 PSI 27 27 A 96 LEU C A 97 HIS N A 97 HIS CA A 97 HIS C 1.0 -94.0 -46.0 PHI 28 28 A 97 HIS N A 97 HIS CA A 97 HIS C A 98 ALA N 1.0 109.0 173.0 PSI 29 29 A 97 HIS C A 98 ALA N A 98 ALA CA A 98 ALA C 1.0 -93.0 -33.0 PHI 30 30 A 98 ALA N A 98 ALA CA A 98 ALA C A 99 THR N 1.0 -46.0 -22.0 PSI 31 31 A 100 ARG C A 101 ASP N A 101 ASP CA A 101 ASP C 1.0 -115.0 -67.0 PHI 32 32 A 101 ASP N A 101 ASP CA A 101 ASP C A 102 GLU N 1.0 83.0 151.0 PSI 33 33 A 101 ASP C A 102 GLU N A 102 GLU CA A 102 GLU C 1.0 -164.0 -92.0 PHI 34 34 A 102 GLU N A 102 GLU CA A 102 GLU C A 103 PRO N 1.0 106.0 178.0 PSI 35 35 A 103 PRO C A 104 VAL N A 104 VAL CA A 104 VAL C 1.0 -160.0 -92.0 PHI 36 36 A 104 VAL N A 104 VAL CA A 104 VAL C A 105 ALA N 1.0 112.0 172.0 PSI 37 37 A 105 ALA C A 106 PHE N A 106 PHE CA A 106 PHE C 1.0 -159.0 -79.0 PHI 38 38 A 106 PHE N A 106 PHE CA A 106 PHE C A 107 VAL N 1.0 106.0 178.0 PSI 39 39 A 106 PHE C A 107 VAL N A 107 VAL CA A 107 VAL C 1.0 -161.0 -97.0 PHI 40 40 A 107 VAL N A 107 VAL CA A 107 VAL C A 108 LEU N 1.0 125.0 169.0 PSI 41 41 A 107 VAL C A 108 LEU N A 108 LEU CA A 108 LEU C 1.0 -113.0 -69.0 PHI 42 42 A 108 LEU N A 108 LEU CA A 108 LEU C A 109 PRO N 1.0 70.0 178.0 PSI 43 43 A 110 GLY C A 111 THR N A 111 THR CA A 111 THR C 1.0 -126.0 -50.0 PHI 44 44 A 111 THR N A 111 THR CA A 111 THR C A 112 ALA N 1.0 107.0 155.0 PSI 45 45 A 111 THR C A 112 ALA N A 112 ALA CA A 112 ALA C 1.0 -139.0 -67.0 PHI 46 46 A 112 ALA N A 112 ALA CA A 112 ALA C A 113 PHE N 1.0 107.0 159.0 PSI 47 47 A 112 ALA C A 113 PHE N A 113 PHE CA A 113 PHE C 1.0 -193.0 -97.0 PHI 48 48 A 113 PHE N A 113 PHE CA A 113 PHE C A 114 ARG N 1.0 113.0 205.0 PSI 49 49 A 113 PHE C A 114 ARG N A 114 ARG CA A 114 ARG C 1.0 -153.0 -85.0 PHI 50 50 A 114 ARG N A 114 ARG CA A 114 ARG C A 115 VAL N 1.0 122.0 178.0 PSI 51 51 A 114 ARG C A 115 VAL N A 115 VAL CA A 115 VAL C 1.0 -161.0 -105.0 PHI 52 52 A 115 VAL N A 115 VAL CA A 115 VAL C A 116 SER N 1.0 134.0 178.0 PSI 53 53 A 116 SER C A 117 ALA N A 117 ALA CA A 117 ALA C 1.0 -68.0 -48.0 PHI 54 54 A 117 ALA N A 117 ALA CA A 117 ALA C A 118 GLY N 1.0 -53.0 -25.0 PSI 55 55 A 117 ALA C A 118 GLY N A 118 GLY CA A 118 GLY C 1.0 -80.0 -52.0 PHI 56 56 A 118 GLY N A 118 GLY CA A 118 GLY C A 119 VAL N 1.0 -55.0 -27.0 PSI 57 57 A 118 GLY C A 119 VAL N A 119 VAL CA A 119 VAL C 1.0 -77.0 -57.0 PHI 58 58 A 119 VAL N A 119 VAL CA A 119 VAL C A 120 ALA N 1.0 -56.0 -28.0 PSI 59 59 A 119 VAL C A 120 ALA N A 120 ALA CA A 120 ALA C 1.0 -72.0 -52.0 PHI 60 60 A 120 ALA N A 120 ALA CA A 120 ALA C A 121 ALA N 1.0 -49.0 -29.0 PSI 61 61 A 120 ALA C A 121 ALA N A 121 ALA CA A 121 ALA C 1.0 -75.0 -51.0 PHI 62 62 A 121 ALA N A 121 ALA CA A 121 ALA C A 122 GLU N 1.0 -57.0 -25.0 PSI 63 63 A 121 ALA C A 122 GLU N A 122 GLU CA A 122 GLU C 1.0 -76.0 -56.0 PHI 64 64 A 122 GLU N A 122 GLU CA A 122 GLU C A 123 MET N 1.0 -51.3 -31.3 PSI 65 65 A 122 GLU C A 123 MET N A 123 MET CA A 123 MET C 1.0 -70.4 -50.4 PHI 66 66 A 123 MET N A 123 MET CA A 123 MET C A 124 THR N 1.0 -54.3 -34.3 PSI 67 67 A 123 MET C A 124 THR N A 124 THR CA A 124 THR C 1.0 -75.6 -55.6 PHI 68 68 A 124 THR N A 124 THR CA A 124 THR C A 125 GLU N 1.0 -49.4 -29.4 PSI 69 69 A 124 THR C A 125 GLU N A 125 GLU CA A 125 GLU C 1.0 -79.5 -52.2 PHI 70 70 A 125 GLU N A 125 GLU CA A 125 GLU C A 126 ARG N 1.0 -52.1 -7.5 PSI 71 71 A 129 ALA C A 130 ARG N A 130 ARG CA A 130 ARG C 1.0 -147.3 -96.0 PHI 72 72 A 130 ARG N A 130 ARG CA A 130 ARG C A 131 MET N 1.0 122.7 169.2 PSI 73 73 A 130 ARG C A 131 MET N A 131 MET CA A 131 MET C 1.0 -128.0 -48.0 PHI 74 74 A 131 MET N A 131 MET CA A 131 MET C A 132 GLN N 1.0 106.0 162.0 PSI stop_ save_