data_nef_c16382_2kl3 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code TargetDB NsR437A stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 GLU middle . . 3 A 3 PRO middle . false 4 A 4 GLN middle . . 5 A 5 SER middle . . 6 A 6 ASP middle . . 7 A 7 ALA middle . . 8 A 8 HIS middle . . 9 A 9 VAL middle . . 10 A 10 LEU middle . . 11 A 11 LYS middle . . 12 A 12 SER middle . . 13 A 13 ARG middle . . 14 A 14 LEU middle . . 15 A 15 GLU middle . . 16 A 16 TRP middle . . 17 A 17 GLY middle . false 18 A 18 GLU middle . . 19 A 19 PRO middle . false 20 A 20 ALA middle . . 21 A 21 PHE middle . . 22 A 22 THR middle . . 23 A 23 ILE middle . . 24 A 24 LEU middle . . 25 A 25 ASP middle . . 26 A 26 VAL middle . . 27 A 27 ARG middle . . 28 A 28 ASP middle . . 29 A 29 ARG middle . . 30 A 30 SER middle . . 31 A 31 THR middle . . 32 A 32 TYR middle . . 33 A 33 ASN middle . . 34 A 34 ASP middle . . 35 A 35 GLY middle . false 36 A 36 HIS middle . . 37 A 37 ILE middle . . 38 A 38 MET middle . . 39 A 39 GLY middle . false 40 A 40 ALA middle . . 41 A 41 MET middle . . 42 A 42 ALA middle . . 43 A 43 MET middle . . 44 A 44 PRO middle . false 45 A 45 ILE middle . . 46 A 46 GLU middle . . 47 A 47 ASP middle . . 48 A 48 LEU middle . . 49 A 49 VAL middle . . 50 A 50 ASP middle . . 51 A 51 ARG middle . . 52 A 52 ALA middle . . 53 A 53 SER middle . . 54 A 54 SER middle . . 55 A 55 SER middle . . 56 A 56 LEU middle . . 57 A 57 GLU middle . . 58 A 58 LYS middle . . 59 A 59 SER middle . . 60 A 60 ARG middle . . 61 A 61 ASP middle . . 62 A 62 ILE middle . . 63 A 63 TYR middle . . 64 A 64 VAL middle . . 65 A 65 TYR middle . . 66 A 66 GLY middle . false 67 A 67 ALA middle . . 68 A 68 GLY middle . false 69 A 69 ASP middle . . 70 A 70 GLU middle . . 71 A 71 GLN middle . . 72 A 72 THR middle . . 73 A 73 SER middle . . 74 A 74 GLN middle . . 75 A 75 ALA middle . . 76 A 76 VAL middle . . 77 A 77 ASN middle . . 78 A 78 LEU middle . . 79 A 79 LEU middle . . 80 A 80 ARG middle . . 81 A 81 SER middle . . 82 A 82 ALA middle . . 83 A 83 GLY middle . false 84 A 84 PHE middle . . 85 A 85 GLU middle . . 86 A 86 HIS middle . . 87 A 87 VAL middle . . 88 A 88 SER middle . . 89 A 89 GLU middle . . 90 A 90 LEU middle . . 91 A 91 LYS middle . . 92 A 92 GLY middle . false 93 A 93 GLY middle . false 94 A 94 LEU middle . . 95 A 95 ALA middle . . 96 A 96 ALA middle . . 97 A 97 TRP middle . . 98 A 98 LYS middle . . 99 A 99 ALA middle . . 100 A 100 ILE middle . . 101 A 101 GLY middle . false 102 A 102 GLY middle . false 103 A 103 PRO middle . false 104 A 104 THR middle . . 105 A 105 GLU middle . . 106 A 106 GLY middle . false 107 A 107 ILE middle . . 108 A 108 ILE middle . . 109 A 109 GLU middle . . 110 A 110 SER middle . . 111 A 111 ARG middle . . 112 A 112 THR middle . . 113 A 113 PRO middle . false 114 A 114 ALA middle . . 115 A 115 GLY middle . false 116 A 116 ALA middle . . 117 A 117 ASP middle . . 118 A 118 ASP middle . . 119 A 119 TYR middle . . 120 A 120 ASN middle . . 121 A 121 VAL middle . . 122 A 122 VAL middle . . 123 A 123 SER middle . . 124 A 124 ARG middle . . 125 A 125 LEU middle . . 126 A 126 GLU middle . . 127 A 127 HIS middle . . 128 A 128 HIS middle . . 129 A 129 HIS middle . . 130 A 130 HIS middle . . 131 A 131 HIS middle . . 132 A 132 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET HA H 1 4.012 0.020 A 1 MET HBx H 1 1.982 0.020 A 1 MET HBy H 1 1.982 0.020 A 1 MET HE% H 1 1.462 0.020 A 1 MET HG2 H 1 2.286 0.020 A 1 MET HG3 H 1 2.357 0.020 A 1 MET C C 13 172.623 0.400 A 1 MET CA C 13 55.020 0.400 A 1 MET CB C 13 33.768 0.400 A 1 MET CE C 13 16.853 0.400 A 1 MET CG C 13 30.552 0.400 A 2 GLU H H 1 8.824 0.020 A 2 GLU HA H 1 4.687 0.020 A 2 GLU HBy H 1 2.269 0.020 A 2 GLU HBx H 1 1.955 0.020 A 2 GLU HG2 H 1 2.409 0.020 A 2 GLU HG3 H 1 2.351 0.020 A 2 GLU C C 13 175.506 0.400 A 2 GLU CA C 13 54.603 0.400 A 2 GLU CB C 13 29.310 0.400 A 2 GLU CG C 13 36.226 0.400 A 2 GLU N N 15 125.698 0.400 A 3 PRO HA H 1 4.398 0.020 A 3 PRO HB2 H 1 2.414 0.020 A 3 PRO HB3 H 1 2.043 0.020 A 3 PRO HD2 H 1 3.870 0.020 A 3 PRO HD3 H 1 3.870 0.020 A 3 PRO HG2 H 1 2.151 0.020 A 3 PRO HG3 H 1 2.061 0.020 A 3 PRO C C 13 176.267 0.400 A 3 PRO CA C 13 64.781 0.400 A 3 PRO CB C 13 31.918 0.400 A 3 PRO CD C 13 50.693 0.400 A 3 PRO CG C 13 27.519 0.400 A 4 GLN H H 1 7.738 0.020 A 4 GLN HA H 1 4.908 0.020 A 4 GLN HB2 H 1 1.917 0.020 A 4 GLN HB3 H 1 2.055 0.020 A 4 GLN HE21 H 1 7.664 0.020 A 4 GLN HE22 H 1 6.887 0.020 A 4 GLN HG2 H 1 2.322 0.020 A 4 GLN HG3 H 1 2.322 0.020 A 4 GLN C C 13 175.006 0.400 A 4 GLN CA C 13 54.697 0.400 A 4 GLN CB C 13 31.196 0.400 A 4 GLN CG C 13 33.737 0.400 A 4 GLN N N 15 114.971 0.400 A 4 GLN NE2 N 15 112.934 0.400 A 5 SER H H 1 9.180 0.020 A 5 SER HA H 1 4.825 0.020 A 5 SER HBx H 1 3.780 0.020 A 5 SER HBy H 1 3.780 0.020 A 5 SER C C 13 172.669 0.400 A 5 SER CA C 13 58.100 0.400 A 5 SER CB C 13 65.536 0.400 A 5 SER N N 15 117.801 0.400 A 6 ASP H H 1 8.386 0.020 A 6 ASP HA H 1 4.841 0.020 A 6 ASP HBy H 1 2.778 0.020 A 6 ASP HBx H 1 2.720 0.020 A 6 ASP C C 13 177.071 0.400 A 6 ASP CA C 13 53.810 0.400 A 6 ASP CB C 13 42.427 0.400 A 6 ASP N N 15 123.042 0.400 A 7 ALA H H 1 9.312 0.020 A 7 ALA HA H 1 4.036 0.020 A 7 ALA HB% H 1 1.459 0.020 A 7 ALA C C 13 178.859 0.400 A 7 ALA CA C 13 55.703 0.400 A 7 ALA CB C 13 17.952 0.400 A 7 ALA N N 15 123.976 0.400 A 8 HIS H H 1 8.537 0.020 A 8 HIS HA H 1 3.950 0.020 A 8 HIS HBx H 1 3.122 0.020 A 8 HIS HBy H 1 3.234 0.020 A 8 HIS HD2 H 1 7.211 0.020 A 8 HIS HE1 H 1 8.040 0.020 A 8 HIS C C 13 178.023 0.400 A 8 HIS CA C 13 59.778 0.400 A 8 HIS CB C 13 29.039 0.400 A 8 HIS CD2 C 13 119.504 0.400 A 8 HIS CE1 C 13 137.918 0.400 A 8 HIS N N 15 114.303 0.400 A 8 HIS ND1 N 15 215.792 0.400 A 8 HIS NE2 N 15 175.805 0.400 A 9 VAL H H 1 7.567 0.020 A 9 VAL HA H 1 3.709 0.020 A 9 VAL HB H 1 2.226 0.020 A 9 VAL HG1% H 1 0.995 0.020 A 9 VAL HG2% H 1 1.028 0.020 A 9 VAL C C 13 178.518 0.400 A 9 VAL CA C 13 65.508 0.400 A 9 VAL CB C 13 31.604 0.400 A 9 VAL CG1 C 13 20.836 0.400 A 9 VAL CG2 C 13 22.302 0.400 A 9 VAL N N 15 121.235 0.400 A 10 LEU H H 1 7.219 0.020 A 10 LEU HA H 1 3.716 0.020 A 10 LEU HB2 H 1 0.875 0.020 A 10 LEU HB3 H 1 1.750 0.020 A 10 LEU HD1% H 1 -0.294 0.020 A 10 LEU HD2% H 1 0.133 0.020 A 10 LEU HG H 1 1.292 0.020 A 10 LEU C C 13 177.133 0.400 A 10 LEU CA C 13 57.133 0.400 A 10 LEU CB C 13 40.756 0.400 A 10 LEU CD1 C 13 21.370 0.400 A 10 LEU CD2 C 13 25.178 0.400 A 10 LEU CG C 13 26.476 0.400 A 10 LEU N N 15 120.890 0.400 A 11 LYS H H 1 8.568 0.020 A 11 LYS HA H 1 3.943 0.020 A 11 LYS HB2 H 1 1.713 0.020 A 11 LYS HB3 H 1 1.302 0.020 A 11 LYS HD2 H 1 0.869 0.020 A 11 LYS HD3 H 1 1.237 0.020 A 11 LYS HEy H 1 2.738 0.020 A 11 LYS HEx H 1 2.616 0.020 A 11 LYS HG2 H 1 1.301 0.020 A 11 LYS HG3 H 1 0.865 0.020 A 11 LYS C C 13 178.143 0.400 A 11 LYS CA C 13 60.388 0.400 A 11 LYS CB C 13 32.354 0.400 A 11 LYS CD C 13 29.909 0.400 A 11 LYS CE C 13 41.544 0.400 A 11 LYS CG C 13 25.009 0.400 A 11 LYS N N 15 120.361 0.400 A 12 SER H H 1 7.865 0.020 A 12 SER HA H 1 4.225 0.020 A 12 SER HBx H 1 3.865 0.020 A 12 SER HBy H 1 3.865 0.020 A 12 SER C C 13 175.839 0.400 A 12 SER CA C 13 61.626 0.400 A 12 SER CB C 13 62.749 0.400 A 12 SER N N 15 113.173 0.400 A 13 ARG H H 1 7.701 0.020 A 13 ARG HA H 1 3.827 0.020 A 13 ARG HBx H 1 1.630 0.020 A 13 ARG HBy H 1 1.630 0.020 A 13 ARG HD2 H 1 2.345 0.020 A 13 ARG HD3 H 1 2.936 0.020 A 13 ARG HE H 1 7.536 0.020 A 13 ARG HG2 H 1 1.442 0.020 A 13 ARG HG3 H 1 1.614 0.020 A 13 ARG C C 13 178.606 0.400 A 13 ARG CA C 13 58.926 0.400 A 13 ARG CB C 13 29.616 0.400 A 13 ARG CD C 13 43.574 0.400 A 13 ARG CG C 13 27.180 0.400 A 13 ARG N N 15 122.104 0.400 A 13 ARG NE N 15 85.796 0.400 A 14 LEU H H 1 8.308 0.020 A 14 LEU HA H 1 4.219 0.020 A 14 LEU HBx H 1 1.834 0.020 A 14 LEU HBy H 1 1.983 0.020 A 14 LEU HDx% H 1 1.087 0.020 A 14 LEU HDy% H 1 1.087 0.020 A 14 LEU HG H 1 1.863 0.020 A 14 LEU C C 13 178.590 0.400 A 14 LEU CA C 13 57.904 0.400 A 14 LEU CB C 13 42.627 0.400 A 14 LEU CDx C 13 25.141 0.400 A 14 LEU CDy C 13 25.141 0.400 A 14 LEU CG C 13 27.354 0.400 A 14 LEU N N 15 119.549 0.400 A 15 GLU H H 1 7.824 0.020 A 15 GLU HA H 1 3.998 0.020 A 15 GLU HB2 H 1 1.668 0.020 A 15 GLU HB3 H 1 1.964 0.020 A 15 GLU HG2 H 1 1.999 0.020 A 15 GLU HG3 H 1 2.369 0.020 A 15 GLU C C 13 177.805 0.400 A 15 GLU CA C 13 58.219 0.400 A 15 GLU CB C 13 29.865 0.400 A 15 GLU CG C 13 36.528 0.400 A 15 GLU N N 15 116.921 0.400 A 16 TRP H H 1 7.905 0.020 A 16 TRP HA H 1 4.895 0.020 A 16 TRP HB2 H 1 3.443 0.020 A 16 TRP HB3 H 1 3.300 0.020 A 16 TRP HD1 H 1 7.302 0.020 A 16 TRP HE1 H 1 10.027 0.020 A 16 TRP HE3 H 1 7.706 0.020 A 16 TRP HH2 H 1 7.209 0.020 A 16 TRP HZ2 H 1 7.459 0.020 A 16 TRP HZ3 H 1 7.158 0.020 A 16 TRP C C 13 176.778 0.400 A 16 TRP CA C 13 57.033 0.400 A 16 TRP CB C 13 30.513 0.400 A 16 TRP CD1 C 13 127.359 0.400 A 16 TRP CE3 C 13 121.056 0.400 A 16 TRP CH2 C 13 124.227 0.400 A 16 TRP CZ2 C 13 114.266 0.400 A 16 TRP CZ3 C 13 121.723 0.400 A 16 TRP N N 15 116.589 0.400 A 16 TRP NE1 N 15 128.512 0.400 A 17 GLY H H 1 8.007 0.020 A 17 GLY HAx H 1 3.979 0.020 A 17 GLY HAy H 1 4.200 0.020 A 17 GLY C C 13 173.650 0.400 A 17 GLY CA C 13 44.786 0.400 A 17 GLY N N 15 108.398 0.400 A 18 GLU H H 1 8.483 0.020 A 18 GLU HA H 1 4.534 0.020 A 18 GLU HBy H 1 2.132 0.020 A 18 GLU HBx H 1 1.986 0.020 A 18 GLU HG2 H 1 2.399 0.020 A 18 GLU HG3 H 1 2.344 0.020 A 18 GLU C C 13 176.535 0.400 A 18 GLU CA C 13 54.615 0.400 A 18 GLU CB C 13 29.654 0.400 A 18 GLU CG C 13 36.162 0.400 A 18 GLU N N 15 121.984 0.400 A 19 PRO HA H 1 4.549 0.020 A 19 PRO HBx H 1 1.837 0.020 A 19 PRO HBy H 1 1.837 0.020 A 19 PRO HD2 H 1 3.713 0.020 A 19 PRO HD3 H 1 3.861 0.020 A 19 PRO HG2 H 1 1.942 0.020 A 19 PRO HG3 H 1 1.984 0.020 A 19 PRO C C 13 176.737 0.400 A 19 PRO CA C 13 63.685 0.400 A 19 PRO CB C 13 30.940 0.400 A 19 PRO CD C 13 50.775 0.400 A 19 PRO CG C 13 27.099 0.400 A 20 ALA H H 1 8.386 0.020 A 20 ALA HA H 1 4.536 0.020 A 20 ALA HB% H 1 1.440 0.020 A 20 ALA C C 13 174.844 0.400 A 20 ALA CA C 13 51.312 0.400 A 20 ALA CB C 13 17.883 0.400 A 20 ALA N N 15 126.537 0.400 A 21 PHE H H 1 7.244 0.020 A 21 PHE HA H 1 5.485 0.020 A 21 PHE HBx H 1 3.073 0.020 A 21 PHE HBy H 1 3.275 0.020 A 21 PHE HD1 H 1 7.035 0.020 A 21 PHE HD2 H 1 7.035 0.020 A 21 PHE HE1 H 1 7.200 0.020 A 21 PHE HE2 H 1 7.200 0.020 A 21 PHE HZ H 1 7.065 0.020 A 21 PHE C C 13 173.639 0.400 A 21 PHE CA C 13 55.312 0.400 A 21 PHE CB C 13 41.581 0.400 A 21 PHE CD1 C 13 131.800 0.400 A 21 PHE CD2 C 13 131.800 0.400 A 21 PHE CE1 C 13 130.783 0.400 A 21 PHE CE2 C 13 130.783 0.400 A 21 PHE CZ C 13 129.147 0.400 A 21 PHE N N 15 115.447 0.400 A 22 THR H H 1 9.203 0.020 A 22 THR HA H 1 4.583 0.020 A 22 THR HB H 1 3.723 0.020 A 22 THR HG2% H 1 1.289 0.020 A 22 THR C C 13 171.987 0.400 A 22 THR CA C 13 62.368 0.400 A 22 THR CB C 13 72.961 0.400 A 22 THR CG2 C 13 22.788 0.400 A 22 THR N N 15 119.035 0.400 A 23 ILE H H 1 9.318 0.020 A 23 ILE HA H 1 5.172 0.020 A 23 ILE HB H 1 1.544 0.020 A 23 ILE HD1% H 1 0.787 0.020 A 23 ILE HG1y H 1 1.912 0.020 A 23 ILE HG1x H 1 0.819 0.020 A 23 ILE HG2% H 1 0.837 0.020 A 23 ILE C C 13 173.969 0.400 A 23 ILE CA C 13 59.958 0.400 A 23 ILE CB C 13 40.273 0.400 A 23 ILE CD1 C 13 15.060 0.400 A 23 ILE CG1 C 13 27.341 0.400 A 23 ILE CG2 C 13 18.131 0.400 A 23 ILE N N 15 127.452 0.400 A 24 LEU H H 1 9.522 0.020 A 24 LEU HA H 1 4.871 0.020 A 24 LEU HB2 H 1 1.612 0.020 A 24 LEU HB3 H 1 1.016 0.020 A 24 LEU HD1% H 1 0.603 0.020 A 24 LEU HD2% H 1 0.732 0.020 A 24 LEU HG H 1 1.469 0.020 A 24 LEU C C 13 172.823 0.400 A 24 LEU CA C 13 53.100 0.400 A 24 LEU CB C 13 44.522 0.400 A 24 LEU CD1 C 13 25.840 0.400 A 24 LEU CD2 C 13 24.518 0.400 A 24 LEU CG C 13 26.530 0.400 A 24 LEU N N 15 127.148 0.400 A 25 ASP H H 1 8.325 0.020 A 25 ASP HA H 1 4.112 0.020 A 25 ASP HBx H 1 2.095 0.020 A 25 ASP HBy H 1 2.933 0.020 A 25 ASP C C 13 177.457 0.400 A 25 ASP CA C 13 51.097 0.400 A 25 ASP CB C 13 43.056 0.400 A 25 ASP N N 15 122.856 0.400 A 26 VAL H H 1 7.924 0.020 A 26 VAL HA H 1 4.964 0.020 A 26 VAL HB H 1 2.328 0.020 A 26 VAL HG1% H 1 0.766 0.020 A 26 VAL HG2% H 1 0.604 0.020 A 26 VAL C C 13 176.585 0.400 A 26 VAL CA C 13 59.554 0.400 A 26 VAL CB C 13 30.002 0.400 A 26 VAL CG1 C 13 21.231 0.400 A 26 VAL CG2 C 13 17.756 0.400 A 26 VAL N N 15 117.391 0.400 A 27 ARG H H 1 7.773 0.020 A 27 ARG HA H 1 4.418 0.020 A 27 ARG HBy H 1 2.017 0.020 A 27 ARG HBx H 1 2.016 0.020 A 27 ARG HD2 H 1 3.277 0.020 A 27 ARG HD3 H 1 3.174 0.020 A 27 ARG HE H 1 8.612 0.020 A 27 ARG HG2 H 1 1.805 0.020 A 27 ARG HG3 H 1 1.805 0.020 A 27 ARG HH1x H 1 7.024 0.020 A 27 ARG HH1y H 1 7.024 0.020 A 27 ARG HH2y H 1 10.290 0.020 A 27 ARG HH2x H 1 7.027 0.020 A 27 ARG C C 13 173.931 0.400 A 27 ARG CA C 13 55.487 0.400 A 27 ARG CB C 13 30.337 0.400 A 27 ARG CD C 13 43.700 0.400 A 27 ARG CG C 13 27.024 0.400 A 27 ARG N N 15 121.126 0.400 A 27 ARG NE N 15 82.154 0.400 A 27 ARG NH1 N 15 74.713 0.400 A 27 ARG NH2 N 15 74.216 0.400 A 28 ASP H H 1 7.792 0.020 A 28 ASP HA H 1 4.431 0.020 A 28 ASP HBx H 1 2.743 0.020 A 28 ASP HBy H 1 2.852 0.020 A 28 ASP C C 13 176.402 0.400 A 28 ASP CA C 13 54.427 0.400 A 28 ASP CB C 13 41.498 0.400 A 28 ASP N N 15 115.368 0.400 A 29 ARG H H 1 8.781 0.020 A 29 ARG HA H 1 3.853 0.020 A 29 ARG HB2 H 1 1.808 0.020 A 29 ARG HB3 H 1 1.760 0.020 A 29 ARG HD2 H 1 3.111 0.020 A 29 ARG HD3 H 1 3.111 0.020 A 29 ARG HE H 1 7.299 0.020 A 29 ARG HG2 H 1 1.594 0.020 A 29 ARG HG3 H 1 1.553 0.020 A 29 ARG C C 13 177.811 0.400 A 29 ARG CA C 13 58.920 0.400 A 29 ARG CB C 13 29.762 0.400 A 29 ARG CD C 13 42.511 0.400 A 29 ARG CG C 13 27.662 0.400 A 29 ARG N N 15 121.538 0.400 A 29 ARG NE N 15 83.990 0.400 A 30 SER H H 1 8.478 0.020 A 30 SER HA H 1 4.190 0.020 A 30 SER HBx H 1 3.961 0.020 A 30 SER HBy H 1 3.961 0.020 A 30 SER C C 13 176.814 0.400 A 30 SER CA C 13 61.929 0.400 A 30 SER CB C 13 62.051 0.400 A 30 SER N N 15 113.937 0.400 A 31 THR H H 1 7.724 0.020 A 31 THR HA H 1 4.096 0.020 A 31 THR HB H 1 4.194 0.020 A 31 THR HG2% H 1 1.328 0.020 A 31 THR C C 13 176.940 0.400 A 31 THR CA C 13 66.078 0.400 A 31 THR CB C 13 67.583 0.400 A 31 THR CG2 C 13 22.693 0.400 A 31 THR N N 15 120.025 0.400 A 32 TYR H H 1 8.186 0.020 A 32 TYR HA H 1 4.009 0.020 A 32 TYR HBx H 1 3.096 0.020 A 32 TYR HBy H 1 3.096 0.020 A 32 TYR HD1 H 1 7.148 0.020 A 32 TYR HD2 H 1 7.148 0.020 A 32 TYR C C 13 180.166 0.400 A 32 TYR CA C 13 61.797 0.400 A 32 TYR CB C 13 37.300 0.400 A 32 TYR CD1 C 13 133.231 0.400 A 32 TYR CD2 C 13 133.231 0.400 A 32 TYR N N 15 123.636 0.400 A 33 ASN H H 1 8.838 0.020 A 33 ASN HA H 1 4.435 0.020 A 33 ASN HB2 H 1 2.881 0.020 A 33 ASN HB3 H 1 3.157 0.020 A 33 ASN HD2x H 1 6.841 0.020 A 33 ASN HD2y H 1 7.782 0.020 A 33 ASN C C 13 176.730 0.400 A 33 ASN CA C 13 55.167 0.400 A 33 ASN CB C 13 37.308 0.400 A 33 ASN N N 15 122.000 0.400 A 33 ASN ND2 N 15 110.106 0.400 A 34 ASP H H 1 7.510 0.020 A 34 ASP HA H 1 4.587 0.020 A 34 ASP HBx H 1 2.752 0.020 A 34 ASP HBy H 1 2.976 0.020 A 34 ASP C C 13 177.045 0.400 A 34 ASP CA C 13 56.487 0.400 A 34 ASP CB C 13 40.822 0.400 A 34 ASP N N 15 119.832 0.400 A 35 GLY H H 1 7.412 0.020 A 35 GLY HAx H 1 3.997 0.020 A 35 GLY HAy H 1 3.997 0.020 A 35 GLY C C 13 171.246 0.400 A 35 GLY CA C 13 46.441 0.400 A 35 GLY N N 15 106.611 0.400 A 36 HIS H H 1 8.441 0.020 A 36 HIS HA H 1 4.782 0.020 A 36 HIS HB2 H 1 2.960 0.020 A 36 HIS HB3 H 1 3.070 0.020 A 36 HIS HD2 H 1 7.407 0.020 A 36 HIS HE1 H 1 8.210 0.020 A 36 HIS C C 13 172.800 0.400 A 36 HIS CA C 13 53.425 0.400 A 36 HIS CB C 13 31.978 0.400 A 36 HIS CD2 C 13 120.570 0.400 A 36 HIS CE1 C 13 134.993 0.400 A 36 HIS N N 15 117.929 0.400 A 36 HIS ND1 N 15 195.274 0.400 A 36 HIS NE2 N 15 176.636 0.400 A 37 ILE H H 1 8.087 0.020 A 37 ILE HA H 1 3.223 0.020 A 37 ILE HB H 1 1.201 0.020 A 37 ILE HD1% H 1 -0.883 0.020 A 37 ILE HG1y H 1 0.712 0.020 A 37 ILE HG1x H 1 -0.626 0.020 A 37 ILE HG2% H 1 0.111 0.020 A 37 ILE C C 13 175.423 0.400 A 37 ILE CA C 13 64.607 0.400 A 37 ILE CB C 13 37.269 0.400 A 37 ILE CD1 C 13 12.040 0.400 A 37 ILE CG1 C 13 28.515 0.400 A 37 ILE CG2 C 13 14.652 0.400 A 37 ILE N N 15 120.831 0.400 A 38 MET H H 1 7.625 0.020 A 38 MET HA H 1 3.953 0.020 A 38 MET HBx H 1 1.548 0.020 A 38 MET HBy H 1 1.976 0.020 A 38 MET HE% H 1 2.087 0.020 A 38 MET HG2 H 1 2.465 0.020 A 38 MET HG3 H 1 2.465 0.020 A 38 MET C C 13 174.632 0.400 A 38 MET CA C 13 57.865 0.400 A 38 MET CB C 13 32.882 0.400 A 38 MET CE C 13 17.370 0.400 A 38 MET CG C 13 31.065 0.400 A 38 MET N N 15 128.683 0.400 A 39 GLY H H 1 8.795 0.020 A 39 GLY HAx H 1 3.727 0.020 A 39 GLY HAy H 1 4.345 0.020 A 39 GLY C C 13 175.442 0.400 A 39 GLY CA C 13 44.964 0.400 A 39 GLY N N 15 113.814 0.400 A 40 ALA H H 1 8.566 0.020 A 40 ALA HA H 1 4.656 0.020 A 40 ALA HB% H 1 1.505 0.020 A 40 ALA C C 13 177.459 0.400 A 40 ALA CA C 13 52.139 0.400 A 40 ALA CB C 13 20.657 0.400 A 40 ALA N N 15 122.444 0.400 A 41 MET H H 1 9.268 0.020 A 41 MET HA H 1 4.478 0.020 A 41 MET HBx H 1 1.913 0.020 A 41 MET HBy H 1 1.913 0.020 A 41 MET HE% H 1 2.029 0.020 A 41 MET HG2 H 1 2.574 0.020 A 41 MET HG3 H 1 2.418 0.020 A 41 MET C C 13 174.328 0.400 A 41 MET CA C 13 54.330 0.400 A 41 MET CB C 13 34.473 0.400 A 41 MET CE C 13 16.828 0.400 A 41 MET CG C 13 31.753 0.400 A 41 MET N N 15 123.908 0.400 A 42 ALA H H 1 8.162 0.020 A 42 ALA HA H 1 3.870 0.020 A 42 ALA HB% H 1 -0.011 0.020 A 42 ALA C C 13 177.157 0.400 A 42 ALA CA C 13 51.888 0.400 A 42 ALA CB C 13 16.282 0.400 A 42 ALA N N 15 126.936 0.400 A 43 MET H H 1 8.109 0.020 A 43 MET HA H 1 4.386 0.020 A 43 MET HBx H 1 1.570 0.020 A 43 MET HBy H 1 1.570 0.020 A 43 MET HE% H 1 1.775 0.020 A 43 MET HG2 H 1 2.280 0.020 A 43 MET HG3 H 1 2.048 0.020 A 43 MET C C 13 168.952 0.400 A 43 MET CA C 13 53.535 0.400 A 43 MET CB C 13 34.346 0.400 A 43 MET CE C 13 18.067 0.400 A 43 MET CG C 13 34.064 0.400 A 43 MET N N 15 125.282 0.400 A 44 PRO HA H 1 3.949 0.020 A 44 PRO HB2 H 1 1.749 0.020 A 44 PRO HB3 H 1 2.286 0.020 A 44 PRO HD2 H 1 3.336 0.020 A 44 PRO HD3 H 1 3.196 0.020 A 44 PRO HG2 H 1 1.984 0.020 A 44 PRO HG3 H 1 2.034 0.020 A 44 PRO C C 13 179.070 0.400 A 44 PRO CA C 13 62.524 0.400 A 44 PRO CB C 13 32.611 0.400 A 44 PRO CD C 13 49.191 0.400 A 44 PRO CG C 13 27.471 0.400 A 45 ILE H H 1 7.764 0.020 A 45 ILE HA H 1 3.851 0.020 A 45 ILE HB H 1 1.832 0.020 A 45 ILE HD1% H 1 0.874 0.020 A 45 ILE HG1y H 1 1.425 0.020 A 45 ILE HG1x H 1 1.389 0.020 A 45 ILE HG2% H 1 0.978 0.020 A 45 ILE C C 13 175.827 0.400 A 45 ILE CA C 13 64.676 0.400 A 45 ILE CB C 13 38.991 0.400 A 45 ILE CD1 C 13 14.059 0.400 A 45 ILE CG1 C 13 29.278 0.400 A 45 ILE CG2 C 13 16.158 0.400 A 45 ILE N N 15 121.655 0.400 A 46 GLU H H 1 9.102 0.020 A 46 GLU HA H 1 4.056 0.020 A 46 GLU HBx H 1 1.969 0.020 A 46 GLU HBy H 1 1.969 0.020 A 46 GLU HG2 H 1 2.275 0.020 A 46 GLU HG3 H 1 2.275 0.020 A 46 GLU C C 13 176.499 0.400 A 46 GLU CA C 13 59.349 0.400 A 46 GLU CB C 13 28.456 0.400 A 46 GLU CG C 13 35.928 0.400 A 46 GLU N N 15 121.004 0.400 A 47 ASP H H 1 7.729 0.020 A 47 ASP HA H 1 5.059 0.020 A 47 ASP HB2 H 1 2.788 0.020 A 47 ASP HB3 H 1 2.433 0.020 A 47 ASP C C 13 175.683 0.400 A 47 ASP CA C 13 53.266 0.400 A 47 ASP CB C 13 42.048 0.400 A 47 ASP N N 15 117.171 0.400 A 48 LEU H H 1 7.193 0.020 A 48 LEU HA H 1 3.690 0.020 A 48 LEU HBx H 1 1.716 0.020 A 48 LEU HBy H 1 1.716 0.020 A 48 LEU HD1% H 1 0.798 0.020 A 48 LEU HD2% H 1 0.877 0.020 A 48 LEU HG H 1 1.216 0.020 A 48 LEU C C 13 176.829 0.400 A 48 LEU CA C 13 58.905 0.400 A 48 LEU CB C 13 43.334 0.400 A 48 LEU CD1 C 13 24.147 0.400 A 48 LEU CD2 C 13 27.550 0.400 A 48 LEU CG C 13 27.025 0.400 A 48 LEU N N 15 121.314 0.400 A 49 VAL H H 1 8.507 0.020 A 49 VAL HA H 1 3.290 0.020 A 49 VAL HB H 1 1.984 0.020 A 49 VAL HG1% H 1 0.937 0.020 A 49 VAL HG2% H 1 0.985 0.020 A 49 VAL C C 13 178.915 0.400 A 49 VAL CA C 13 67.886 0.400 A 49 VAL CB C 13 30.881 0.400 A 49 VAL CG1 C 13 21.309 0.400 A 49 VAL CG2 C 13 24.349 0.400 A 49 VAL N N 15 116.698 0.400 A 50 ASP H H 1 8.474 0.020 A 50 ASP HA H 1 4.396 0.020 A 50 ASP HBx H 1 2.638 0.020 A 50 ASP HBy H 1 2.638 0.020 A 50 ASP C C 13 178.890 0.400 A 50 ASP CA C 13 57.477 0.400 A 50 ASP CB C 13 40.945 0.400 A 50 ASP N N 15 121.526 0.400 A 51 ARG H H 1 8.334 0.020 A 51 ARG HA H 1 4.079 0.020 A 51 ARG HBx H 1 1.779 0.020 A 51 ARG HBy H 1 1.898 0.020 A 51 ARG HD2 H 1 3.157 0.020 A 51 ARG HD3 H 1 3.197 0.020 A 51 ARG HE H 1 7.391 0.020 A 51 ARG HG2 H 1 1.721 0.020 A 51 ARG HG3 H 1 1.721 0.020 A 51 ARG C C 13 179.634 0.400 A 51 ARG CA C 13 58.378 0.400 A 51 ARG CB C 13 29.692 0.400 A 51 ARG CD C 13 42.658 0.400 A 51 ARG CG C 13 27.284 0.400 A 51 ARG N N 15 118.666 0.400 A 51 ARG NE N 15 84.477 0.400 A 52 ALA H H 1 9.250 0.020 A 52 ALA HA H 1 3.752 0.020 A 52 ALA HB% H 1 1.094 0.020 A 52 ALA C C 13 179.710 0.400 A 52 ALA CA C 13 55.830 0.400 A 52 ALA CB C 13 18.164 0.400 A 52 ALA N N 15 124.004 0.400 A 53 SER H H 1 8.392 0.020 A 53 SER HA H 1 4.457 0.020 A 53 SER HBx H 1 3.992 0.020 A 53 SER HBy H 1 4.179 0.020 A 53 SER C C 13 175.807 0.400 A 53 SER CA C 13 62.214 0.400 A 53 SER CB C 13 62.805 0.400 A 53 SER N N 15 111.154 0.400 A 54 SER H H 1 7.570 0.020 A 54 SER HA H 1 4.512 0.020 A 54 SER HBy H 1 4.012 0.020 A 54 SER HBx H 1 3.969 0.020 A 54 SER C C 13 175.210 0.400 A 54 SER CA C 13 59.567 0.400 A 54 SER CB C 13 63.902 0.400 A 54 SER N N 15 112.745 0.400 A 55 SER H H 1 7.501 0.020 A 55 SER HA H 1 4.744 0.020 A 55 SER HBy H 1 3.778 0.020 A 55 SER HBx H 1 3.742 0.020 A 55 SER C C 13 173.106 0.400 A 55 SER CA C 13 59.905 0.400 A 55 SER CB C 13 65.881 0.400 A 55 SER N N 15 113.238 0.400 A 56 LEU H H 1 8.320 0.020 A 56 LEU HA H 1 4.823 0.020 A 56 LEU HBx H 1 1.375 0.020 A 56 LEU HBy H 1 2.049 0.020 A 56 LEU HD1% H 1 0.715 0.020 A 56 LEU HD2% H 1 0.866 0.020 A 56 LEU HG H 1 1.640 0.020 A 56 LEU C C 13 175.441 0.400 A 56 LEU CA C 13 53.476 0.400 A 56 LEU CB C 13 44.655 0.400 A 56 LEU CD1 C 13 26.193 0.400 A 56 LEU CD2 C 13 23.294 0.400 A 56 LEU CG C 13 26.711 0.400 A 56 LEU N N 15 122.043 0.400 A 57 GLU H H 1 8.510 0.020 A 57 GLU HA H 1 4.334 0.020 A 57 GLU HBx H 1 1.953 0.020 A 57 GLU HBy H 1 2.116 0.020 A 57 GLU HG2 H 1 2.353 0.020 A 57 GLU HG3 H 1 2.386 0.020 A 57 GLU C C 13 177.869 0.400 A 57 GLU CA C 13 55.911 0.400 A 57 GLU CB C 13 30.193 0.400 A 57 GLU CG C 13 36.406 0.400 A 57 GLU N N 15 121.479 0.400 A 58 LYS H H 1 8.513 0.020 A 58 LYS HA H 1 3.811 0.020 A 58 LYS HB2 H 1 1.653 0.020 A 58 LYS HB3 H 1 1.541 0.020 A 58 LYS HD2 H 1 0.793 0.020 A 58 LYS HD3 H 1 0.971 0.020 A 58 LYS HEx H 1 2.658 0.020 A 58 LYS HEy H 1 2.658 0.020 A 58 LYS HG2 H 1 1.093 0.020 A 58 LYS HG3 H 1 0.192 0.020 A 58 LYS C C 13 178.345 0.400 A 58 LYS CA C 13 58.526 0.400 A 58 LYS CB C 13 31.265 0.400 A 58 LYS CD C 13 27.950 0.400 A 58 LYS CE C 13 42.196 0.400 A 58 LYS CG C 13 25.138 0.400 A 58 LYS N N 15 120.689 0.400 A 59 SER H H 1 7.912 0.020 A 59 SER HA H 1 4.437 0.020 A 59 SER HBx H 1 3.853 0.020 A 59 SER HBy H 1 4.142 0.020 A 59 SER C C 13 174.216 0.400 A 59 SER CA C 13 57.862 0.400 A 59 SER CB C 13 63.682 0.400 A 59 SER N N 15 111.530 0.400 A 60 ARG H H 1 7.477 0.020 A 60 ARG HA H 1 4.199 0.020 A 60 ARG HBx H 1 1.881 0.020 A 60 ARG HBy H 1 2.058 0.020 A 60 ARG HD2 H 1 3.093 0.020 A 60 ARG HD3 H 1 3.330 0.020 A 60 ARG HE H 1 7.354 0.020 A 60 ARG HGx H 1 1.762 0.020 A 60 ARG HGy H 1 1.762 0.020 A 60 ARG C C 13 174.880 0.400 A 60 ARG CA C 13 55.828 0.400 A 60 ARG CB C 13 31.971 0.400 A 60 ARG CD C 13 43.685 0.400 A 60 ARG CG C 13 26.508 0.400 A 60 ARG N N 15 125.535 0.400 A 60 ARG NE N 15 84.656 0.400 A 61 ASP H H 1 8.540 0.020 A 61 ASP HA H 1 4.903 0.020 A 61 ASP HBy H 1 3.024 0.020 A 61 ASP HBx H 1 2.439 0.020 A 61 ASP C C 13 175.569 0.400 A 61 ASP CA C 13 55.438 0.400 A 61 ASP CB C 13 40.847 0.400 A 61 ASP N N 15 126.761 0.400 A 62 ILE H H 1 8.630 0.020 A 62 ILE HA H 1 5.038 0.020 A 62 ILE HB H 1 1.578 0.020 A 62 ILE HD1% H 1 0.695 0.020 A 62 ILE HG1y H 1 1.798 0.020 A 62 ILE HG1x H 1 0.697 0.020 A 62 ILE HG2% H 1 0.616 0.020 A 62 ILE C C 13 174.444 0.400 A 62 ILE CA C 13 59.799 0.400 A 62 ILE CB C 13 42.130 0.400 A 62 ILE CD1 C 13 15.328 0.400 A 62 ILE CG1 C 13 27.814 0.400 A 62 ILE CG2 C 13 18.421 0.400 A 62 ILE N N 15 125.212 0.400 A 63 TYR H H 1 9.026 0.020 A 63 TYR HA H 1 5.230 0.020 A 63 TYR HB2 H 1 2.575 0.020 A 63 TYR HB3 H 1 2.772 0.020 A 63 TYR HD1 H 1 6.764 0.020 A 63 TYR HD2 H 1 6.764 0.020 A 63 TYR HE1 H 1 6.417 0.020 A 63 TYR HE2 H 1 6.417 0.020 A 63 TYR C C 13 175.088 0.400 A 63 TYR CA C 13 56.143 0.400 A 63 TYR CB C 13 41.302 0.400 A 63 TYR CD1 C 13 132.601 0.400 A 63 TYR CD2 C 13 132.601 0.400 A 63 TYR CE1 C 13 117.476 0.400 A 63 TYR CE2 C 13 117.476 0.400 A 63 TYR N N 15 125.467 0.400 A 64 VAL H H 1 8.523 0.020 A 64 VAL HA H 1 5.106 0.020 A 64 VAL HB H 1 1.654 0.020 A 64 VAL HG1% H 1 0.804 0.020 A 64 VAL HG2% H 1 0.704 0.020 A 64 VAL C C 13 174.072 0.400 A 64 VAL CA C 13 60.302 0.400 A 64 VAL CB C 13 35.121 0.400 A 64 VAL CG1 C 13 22.490 0.400 A 64 VAL CG2 C 13 23.360 0.400 A 64 VAL N N 15 121.014 0.400 A 65 TYR H H 1 8.832 0.020 A 65 TYR HA H 1 5.289 0.020 A 65 TYR HBx H 1 3.134 0.020 A 65 TYR HBy H 1 3.134 0.020 A 65 TYR HD1 H 1 6.734 0.020 A 65 TYR HD2 H 1 7.066 0.020 A 65 TYR HE1 H 1 6.363 0.020 A 65 TYR HE2 H 1 6.363 0.020 A 65 TYR C C 13 172.116 0.400 A 65 TYR CA C 13 56.777 0.400 A 65 TYR CB C 13 42.528 0.400 A 65 TYR N N 15 120.331 0.400 A 66 GLY H H 1 8.278 0.020 A 66 GLY HA2 H 1 3.449 0.020 A 66 GLY HA3 H 1 4.408 0.020 A 66 GLY C C 13 173.636 0.400 A 66 GLY CA C 13 43.793 0.400 A 66 GLY N N 15 108.458 0.400 A 67 ALA H H 1 9.485 0.020 A 67 ALA HA H 1 4.331 0.020 A 67 ALA HB% H 1 1.444 0.020 A 67 ALA C C 13 176.363 0.400 A 67 ALA CA C 13 52.848 0.400 A 67 ALA CB C 13 18.178 0.400 A 67 ALA N N 15 126.325 0.400 A 68 GLY H H 1 7.553 0.020 A 68 GLY HAy H 1 4.270 0.020 A 68 GLY HAx H 1 4.209 0.020 A 68 GLY C C 13 173.695 0.400 A 68 GLY CA C 13 44.112 0.400 A 68 GLY N N 15 106.057 0.400 A 69 ASP H H 1 8.904 0.020 A 69 ASP HA H 1 4.408 0.020 A 69 ASP HBx H 1 2.655 0.020 A 69 ASP HBy H 1 2.848 0.020 A 69 ASP C C 13 178.531 0.400 A 69 ASP CA C 13 57.592 0.400 A 69 ASP CB C 13 40.198 0.400 A 69 ASP N N 15 121.078 0.400 A 70 GLU H H 1 8.905 0.020 A 70 GLU HA H 1 4.110 0.020 A 70 GLU HBy H 1 2.095 0.020 A 70 GLU HBx H 1 2.018 0.020 A 70 GLU HGx H 1 2.318 0.020 A 70 GLU HGy H 1 2.318 0.020 A 70 GLU C C 13 178.745 0.400 A 70 GLU CA C 13 59.956 0.400 A 70 GLU CB C 13 28.534 0.400 A 70 GLU CG C 13 36.340 0.400 A 70 GLU N N 15 120.998 0.400 A 71 GLN H H 1 8.453 0.020 A 71 GLN HA H 1 4.106 0.020 A 71 GLN HB2 H 1 1.993 0.020 A 71 GLN HB3 H 1 2.169 0.020 A 71 GLN HE21 H 1 7.590 0.020 A 71 GLN HE22 H 1 6.879 0.020 A 71 GLN HG2 H 1 2.494 0.020 A 71 GLN HG3 H 1 2.085 0.020 A 71 GLN C C 13 178.164 0.400 A 71 GLN CA C 13 59.350 0.400 A 71 GLN CB C 13 29.682 0.400 A 71 GLN CG C 13 35.805 0.400 A 71 GLN N N 15 121.273 0.400 A 71 GLN NE2 N 15 111.659 0.400 A 72 THR H H 1 8.267 0.020 A 72 THR HA H 1 3.524 0.020 A 72 THR HB H 1 4.433 0.020 A 72 THR HG2% H 1 1.311 0.020 A 72 THR C C 13 175.546 0.400 A 72 THR CA C 13 67.395 0.400 A 72 THR CB C 13 68.145 0.400 A 72 THR CG2 C 13 23.422 0.400 A 72 THR N N 15 115.641 0.400 A 73 SER H H 1 8.265 0.020 A 73 SER HA H 1 4.029 0.020 A 73 SER HBx H 1 4.001 0.020 A 73 SER HBy H 1 4.001 0.020 A 73 SER C C 13 176.825 0.400 A 73 SER CA C 13 61.746 0.400 A 73 SER CB C 13 62.746 0.400 A 73 SER N N 15 115.814 0.400 A 74 GLN H H 1 8.119 0.020 A 74 GLN HA H 1 4.090 0.020 A 74 GLN HBx H 1 2.149 0.020 A 74 GLN HBy H 1 2.237 0.020 A 74 GLN HE2y H 1 7.373 0.020 A 74 GLN HE2x H 1 6.803 0.020 A 74 GLN HG2 H 1 2.553 0.020 A 74 GLN HG3 H 1 2.299 0.020 A 74 GLN C C 13 178.630 0.400 A 74 GLN CA C 13 58.903 0.400 A 74 GLN CB C 13 27.943 0.400 A 74 GLN CG C 13 33.214 0.400 A 74 GLN N N 15 121.446 0.400 A 74 GLN NE2 N 15 110.244 0.400 A 75 ALA H H 1 8.210 0.020 A 75 ALA HA H 1 3.879 0.020 A 75 ALA HB% H 1 1.455 0.020 A 75 ALA C C 13 178.843 0.400 A 75 ALA CA C 13 54.959 0.400 A 75 ALA CB C 13 20.226 0.400 A 75 ALA N N 15 121.007 0.400 A 76 VAL H H 1 8.257 0.020 A 76 VAL HA H 1 3.472 0.020 A 76 VAL HB H 1 2.118 0.020 A 76 VAL HG1% H 1 0.857 0.020 A 76 VAL HG2% H 1 0.963 0.020 A 76 VAL C C 13 177.639 0.400 A 76 VAL CA C 13 67.080 0.400 A 76 VAL CB C 13 30.945 0.400 A 76 VAL CG1 C 13 20.736 0.400 A 76 VAL CG2 C 13 23.037 0.400 A 76 VAL N N 15 116.281 0.400 A 77 ASN H H 1 8.190 0.020 A 77 ASN HA H 1 4.430 0.020 A 77 ASN HBy H 1 2.913 0.020 A 77 ASN HBx H 1 2.842 0.020 A 77 ASN HD2x H 1 6.960 0.020 A 77 ASN HD2y H 1 7.526 0.020 A 77 ASN C C 13 178.638 0.400 A 77 ASN CA C 13 56.666 0.400 A 77 ASN CB C 13 37.950 0.400 A 77 ASN N N 15 118.786 0.400 A 77 ASN ND2 N 15 112.863 0.400 A 78 LEU H H 1 8.222 0.020 A 78 LEU HA H 1 4.045 0.020 A 78 LEU HB2 H 1 1.253 0.020 A 78 LEU HB3 H 1 2.096 0.020 A 78 LEU HD1% H 1 0.910 0.020 A 78 LEU HD2% H 1 0.908 0.020 A 78 LEU HG H 1 1.881 0.020 A 78 LEU C C 13 180.246 0.400 A 78 LEU CA C 13 57.926 0.400 A 78 LEU CB C 13 41.892 0.400 A 78 LEU CD1 C 13 25.547 0.400 A 78 LEU CD2 C 13 22.455 0.400 A 78 LEU CG C 13 26.603 0.400 A 78 LEU N N 15 121.759 0.400 A 79 LEU H H 1 7.887 0.020 A 79 LEU HA H 1 4.051 0.020 A 79 LEU HB2 H 1 1.103 0.020 A 79 LEU HB3 H 1 1.911 0.020 A 79 LEU HD1% H 1 0.451 0.020 A 79 LEU HD2% H 1 0.091 0.020 A 79 LEU HG H 1 1.624 0.020 A 79 LEU C C 13 179.804 0.400 A 79 LEU CA C 13 57.788 0.400 A 79 LEU CB C 13 41.616 0.400 A 79 LEU CD1 C 13 26.416 0.400 A 79 LEU CD2 C 13 21.940 0.400 A 79 LEU CG C 13 26.570 0.400 A 79 LEU N N 15 118.127 0.400 A 80 ARG H H 1 8.942 0.020 A 80 ARG HA H 1 4.516 0.020 A 80 ARG HBx H 1 1.914 0.020 A 80 ARG HBy H 1 1.914 0.020 A 80 ARG HD2 H 1 3.157 0.020 A 80 ARG HD3 H 1 3.189 0.020 A 80 ARG HE H 1 6.844 0.020 A 80 ARG HG2 H 1 1.872 0.020 A 80 ARG HG3 H 1 1.694 0.020 A 80 ARG C C 13 181.546 0.400 A 80 ARG CA C 13 60.006 0.400 A 80 ARG CB C 13 29.510 0.400 A 80 ARG CD C 13 43.463 0.400 A 80 ARG CG C 13 28.459 0.400 A 80 ARG N N 15 120.974 0.400 A 80 ARG NE N 15 84.886 0.400 A 81 SER H H 1 8.394 0.020 A 81 SER HA H 1 4.307 0.020 A 81 SER HBx H 1 4.013 0.020 A 81 SER HBy H 1 4.081 0.020 A 81 SER C C 13 174.601 0.400 A 81 SER CA C 13 61.570 0.400 A 81 SER CB C 13 62.832 0.400 A 81 SER N N 15 116.329 0.400 A 82 ALA H H 1 7.507 0.020 A 82 ALA HA H 1 4.546 0.020 A 82 ALA HB% H 1 1.717 0.020 A 82 ALA C C 13 176.449 0.400 A 82 ALA CA C 13 51.759 0.400 A 82 ALA CB C 13 18.850 0.400 A 82 ALA N N 15 122.576 0.400 A 83 GLY H H 1 7.678 0.020 A 83 GLY HA2 H 1 3.623 0.020 A 83 GLY HA3 H 1 4.217 0.020 A 83 GLY C C 13 174.557 0.400 A 83 GLY CA C 13 44.741 0.400 A 83 GLY N N 15 104.117 0.400 A 84 PHE H H 1 7.923 0.020 A 84 PHE HA H 1 4.254 0.020 A 84 PHE HB2 H 1 2.482 0.020 A 84 PHE HB3 H 1 3.086 0.020 A 84 PHE HD1 H 1 7.510 0.020 A 84 PHE HD2 H 1 7.510 0.020 A 84 PHE HE1 H 1 6.959 0.020 A 84 PHE HE2 H 1 6.959 0.020 A 84 PHE HZ H 1 7.005 0.020 A 84 PHE C C 13 176.479 0.400 A 84 PHE CA C 13 60.127 0.400 A 84 PHE CB C 13 36.999 0.400 A 84 PHE CD1 C 13 132.598 0.400 A 84 PHE CD2 C 13 132.598 0.400 A 84 PHE CE1 C 13 130.729 0.400 A 84 PHE CE2 C 13 130.729 0.400 A 84 PHE CZ C 13 129.665 0.400 A 84 PHE N N 15 119.861 0.400 A 85 GLU H H 1 7.730 0.020 A 85 GLU HA H 1 3.965 0.020 A 85 GLU HB2 H 1 1.426 0.020 A 85 GLU HB3 H 1 1.534 0.020 A 85 GLU HG2 H 1 2.061 0.020 A 85 GLU HG3 H 1 1.978 0.020 A 85 GLU C C 13 176.966 0.400 A 85 GLU CA C 13 57.841 0.400 A 85 GLU CB C 13 32.054 0.400 A 85 GLU CG C 13 36.212 0.400 A 85 GLU N N 15 122.200 0.400 A 86 HIS H H 1 9.957 0.020 A 86 HIS HA H 1 4.988 0.020 A 86 HIS HBx H 1 3.244 0.020 A 86 HIS HBy H 1 3.244 0.020 A 86 HIS HD2 H 1 7.294 0.020 A 86 HIS HE1 H 1 8.501 0.020 A 86 HIS C C 13 171.400 0.400 A 86 HIS CA C 13 53.063 0.400 A 86 HIS CB C 13 29.823 0.400 A 86 HIS CD2 C 13 120.094 0.400 A 86 HIS CE1 C 13 135.953 0.400 A 86 HIS N N 15 122.245 0.400 A 86 HIS ND1 N 15 181.682 0.400 A 86 HIS NE2 N 15 174.248 0.400 A 87 VAL H H 1 8.233 0.020 A 87 VAL HA H 1 4.934 0.020 A 87 VAL HB H 1 1.786 0.020 A 87 VAL HG1% H 1 0.842 0.020 A 87 VAL HG2% H 1 0.800 0.020 A 87 VAL C C 13 175.510 0.400 A 87 VAL CA C 13 59.972 0.400 A 87 VAL CB C 13 33.883 0.400 A 87 VAL CG1 C 13 24.472 0.400 A 87 VAL CG2 C 13 22.324 0.400 A 87 VAL N N 15 120.946 0.400 A 88 SER H H 1 8.968 0.020 A 88 SER HA H 1 4.869 0.020 A 88 SER HBy H 1 3.491 0.020 A 88 SER HBx H 1 3.371 0.020 A 88 SER C C 13 174.093 0.400 A 88 SER CA C 13 55.935 0.400 A 88 SER CB C 13 66.077 0.400 A 88 SER N N 15 121.913 0.400 A 89 GLU H H 1 8.628 0.020 A 89 GLU HA H 1 4.233 0.020 A 89 GLU HBx H 1 2.089 0.020 A 89 GLU HBy H 1 2.089 0.020 A 89 GLU HG2 H 1 2.425 0.020 A 89 GLU HG3 H 1 2.101 0.020 A 89 GLU C C 13 175.212 0.400 A 89 GLU CA C 13 55.728 0.400 A 89 GLU CB C 13 31.640 0.400 A 89 GLU CG C 13 36.595 0.400 A 89 GLU N N 15 125.288 0.400 A 90 LEU H H 1 8.727 0.020 A 90 LEU HA H 1 4.829 0.020 A 90 LEU HB2 H 1 2.091 0.020 A 90 LEU HB3 H 1 1.083 0.020 A 90 LEU HD1% H 1 0.655 0.020 A 90 LEU HD2% H 1 0.419 0.020 A 90 LEU HG H 1 1.452 0.020 A 90 LEU C C 13 175.893 0.400 A 90 LEU CA C 13 53.771 0.400 A 90 LEU CB C 13 41.511 0.400 A 90 LEU CD1 C 13 23.985 0.400 A 90 LEU CD2 C 13 25.866 0.400 A 90 LEU CG C 13 27.283 0.400 A 90 LEU N N 15 125.766 0.400 A 91 LYS H H 1 8.715 0.020 A 91 LYS HA H 1 4.164 0.020 A 91 LYS HB2 H 1 1.763 0.020 A 91 LYS HB3 H 1 1.876 0.020 A 91 LYS HD2 H 1 1.671 0.020 A 91 LYS HD3 H 1 1.671 0.020 A 91 LYS HEx H 1 2.940 0.020 A 91 LYS HEy H 1 2.940 0.020 A 91 LYS HG2 H 1 1.466 0.020 A 91 LYS HG3 H 1 1.466 0.020 A 91 LYS C C 13 177.680 0.400 A 91 LYS CA C 13 57.796 0.400 A 91 LYS CB C 13 31.705 0.400 A 91 LYS CD C 13 28.723 0.400 A 91 LYS CE C 13 41.422 0.400 A 91 LYS CG C 13 24.512 0.400 A 91 LYS N N 15 131.405 0.400 A 92 GLY H H 1 9.408 0.020 A 92 GLY HAx H 1 3.828 0.020 A 92 GLY HAy H 1 4.268 0.020 A 92 GLY C C 13 175.634 0.400 A 92 GLY CA C 13 46.001 0.400 A 92 GLY N N 15 115.262 0.400 A 93 GLY H H 1 7.616 0.020 A 93 GLY HA2 H 1 3.429 0.020 A 93 GLY HA3 H 1 4.276 0.020 A 93 GLY C C 13 172.357 0.400 A 93 GLY CA C 13 46.436 0.400 A 93 GLY N N 15 106.201 0.400 A 94 LEU H H 1 8.854 0.020 A 94 LEU HA H 1 3.643 0.020 A 94 LEU HB2 H 1 1.860 0.020 A 94 LEU HB3 H 1 1.317 0.020 A 94 LEU HD1% H 1 0.700 0.020 A 94 LEU HD2% H 1 0.855 0.020 A 94 LEU HG H 1 1.560 0.020 A 94 LEU C C 13 178.092 0.400 A 94 LEU CA C 13 56.966 0.400 A 94 LEU CB C 13 41.937 0.400 A 94 LEU CD1 C 13 24.131 0.400 A 94 LEU CD2 C 13 26.273 0.400 A 94 LEU CG C 13 26.459 0.400 A 94 LEU N N 15 124.279 0.400 A 95 ALA H H 1 8.683 0.020 A 95 ALA HA H 1 4.061 0.020 A 95 ALA HB% H 1 1.530 0.020 A 95 ALA C C 13 180.877 0.400 A 95 ALA CA C 13 55.406 0.400 A 95 ALA CB C 13 18.053 0.400 A 95 ALA N N 15 120.253 0.400 A 96 ALA H H 1 7.249 0.020 A 96 ALA HA H 1 4.132 0.020 A 96 ALA HB% H 1 1.561 0.020 A 96 ALA C C 13 179.350 0.400 A 96 ALA CA C 13 54.429 0.400 A 96 ALA CB C 13 18.580 0.400 A 96 ALA N N 15 121.080 0.400 A 97 TRP H H 1 7.636 0.020 A 97 TRP HA H 1 4.051 0.020 A 97 TRP HB2 H 1 3.353 0.020 A 97 TRP HB3 H 1 2.927 0.020 A 97 TRP HD1 H 1 6.322 0.020 A 97 TRP HE1 H 1 10.292 0.020 A 97 TRP HE3 H 1 7.249 0.020 A 97 TRP HH2 H 1 6.821 0.020 A 97 TRP HZ2 H 1 7.210 0.020 A 97 TRP HZ3 H 1 7.041 0.020 A 97 TRP C C 13 178.223 0.400 A 97 TRP CA C 13 59.343 0.400 A 97 TRP CB C 13 29.734 0.400 A 97 TRP CD1 C 13 125.060 0.400 A 97 TRP CE3 C 13 119.497 0.400 A 97 TRP CH2 C 13 122.807 0.400 A 97 TRP CZ2 C 13 113.972 0.400 A 97 TRP CZ3 C 13 122.230 0.400 A 97 TRP N N 15 119.015 0.400 A 97 TRP NE1 N 15 129.845 0.400 A 98 LYS H H 1 8.764 0.020 A 98 LYS HA H 1 3.886 0.020 A 98 LYS HB2 H 1 1.737 0.020 A 98 LYS HB3 H 1 1.888 0.020 A 98 LYS HD2 H 1 1.628 0.020 A 98 LYS HD3 H 1 1.669 0.020 A 98 LYS HEy H 1 2.945 0.020 A 98 LYS HEx H 1 2.860 0.020 A 98 LYS HG2 H 1 1.683 0.020 A 98 LYS HG3 H 1 1.420 0.020 A 98 LYS C C 13 180.503 0.400 A 98 LYS CA C 13 59.365 0.400 A 98 LYS CB C 13 31.899 0.400 A 98 LYS CD C 13 29.083 0.400 A 98 LYS CE C 13 41.243 0.400 A 98 LYS CG C 13 25.848 0.400 A 98 LYS N N 15 117.855 0.400 A 99 ALA H H 1 7.802 0.020 A 99 ALA HA H 1 4.139 0.020 A 99 ALA HB% H 1 1.519 0.020 A 99 ALA C C 13 179.188 0.400 A 99 ALA CA C 13 54.521 0.400 A 99 ALA CB C 13 18.016 0.400 A 99 ALA N N 15 121.263 0.400 A 100 ILE H H 1 6.803 0.020 A 100 ILE HA H 1 4.509 0.020 A 100 ILE HB H 1 1.950 0.020 A 100 ILE HD1% H 1 0.272 0.020 A 100 ILE HG1y H 1 1.126 0.020 A 100 ILE HG1x H 1 0.740 0.020 A 100 ILE HG2% H 1 0.713 0.020 A 100 ILE C C 13 175.810 0.400 A 100 ILE CA C 13 59.964 0.400 A 100 ILE CB C 13 37.866 0.400 A 100 ILE CD1 C 13 14.950 0.400 A 100 ILE CG1 C 13 25.575 0.400 A 100 ILE CG2 C 13 17.391 0.400 A 100 ILE N N 15 107.978 0.400 A 101 GLY H H 1 7.741 0.020 A 101 GLY HAx H 1 3.618 0.020 A 101 GLY HAy H 1 3.866 0.020 A 101 GLY C C 13 175.319 0.400 A 101 GLY CA C 13 45.444 0.400 A 101 GLY N N 15 109.732 0.400 A 102 GLY H H 1 7.823 0.020 A 102 GLY HAx H 1 2.942 0.020 A 102 GLY HAy H 1 2.942 0.020 A 102 GLY C C 13 171.578 0.400 A 102 GLY CA C 13 41.964 0.400 A 102 GLY N N 15 108.608 0.400 A 103 PRO HA H 1 4.643 0.020 A 103 PRO HB2 H 1 2.370 0.020 A 103 PRO HB3 H 1 2.152 0.020 A 103 PRO HDx H 1 3.645 0.020 A 103 PRO HDy H 1 3.645 0.020 A 103 PRO HG2 H 1 2.257 0.020 A 103 PRO HG3 H 1 2.257 0.020 A 103 PRO C C 13 178.778 0.400 A 103 PRO CA C 13 62.843 0.400 A 103 PRO CB C 13 32.263 0.400 A 103 PRO CD C 13 50.767 0.400 A 103 PRO CG C 13 28.012 0.400 A 104 THR H H 1 8.760 0.020 A 104 THR HA H 1 5.017 0.020 A 104 THR HB H 1 3.986 0.020 A 104 THR HG2% H 1 1.050 0.020 A 104 THR C C 13 172.498 0.400 A 104 THR CA C 13 59.729 0.400 A 104 THR CB C 13 72.479 0.400 A 104 THR CG2 C 13 22.186 0.400 A 104 THR N N 15 116.086 0.400 A 105 GLU H H 1 8.267 0.020 A 105 GLU HA H 1 4.499 0.020 A 105 GLU HB2 H 1 1.711 0.020 A 105 GLU HB3 H 1 1.596 0.020 A 105 GLU HG2 H 1 2.061 0.020 A 105 GLU HG3 H 1 1.975 0.020 A 105 GLU C C 13 173.848 0.400 A 105 GLU CA C 13 54.647 0.400 A 105 GLU CB C 13 34.227 0.400 A 105 GLU CG C 13 36.537 0.400 A 105 GLU N N 15 117.663 0.400 A 106 GLY H H 1 8.207 0.020 A 106 GLY HAx H 1 3.873 0.020 A 106 GLY HAy H 1 3.873 0.020 A 106 GLY C C 13 173.052 0.400 A 106 GLY CA C 13 44.313 0.400 A 106 GLY N N 15 108.896 0.400 A 107 ILE H H 1 8.333 0.020 A 107 ILE HA H 1 4.110 0.020 A 107 ILE HB H 1 1.882 0.020 A 107 ILE HD1% H 1 0.905 0.020 A 107 ILE HG1y H 1 1.545 0.020 A 107 ILE HG1x H 1 1.206 0.020 A 107 ILE HG2% H 1 0.917 0.020 A 107 ILE C C 13 176.773 0.400 A 107 ILE CA C 13 62.404 0.400 A 107 ILE CB C 13 38.826 0.400 A 107 ILE CD1 C 13 13.085 0.400 A 107 ILE CG1 C 13 27.728 0.400 A 107 ILE CG2 C 13 17.356 0.400 A 107 ILE N N 15 119.410 0.400 A 108 ILE H H 1 8.369 0.020 A 108 ILE HA H 1 4.167 0.020 A 108 ILE HB H 1 1.898 0.020 A 108 ILE HD1% H 1 0.825 0.020 A 108 ILE HG1y H 1 1.461 0.020 A 108 ILE HG1x H 1 1.192 0.020 A 108 ILE HG2% H 1 0.866 0.020 A 108 ILE C C 13 176.821 0.400 A 108 ILE CA C 13 61.060 0.400 A 108 ILE CB C 13 37.984 0.400 A 108 ILE CD1 C 13 12.276 0.400 A 108 ILE CG1 C 13 27.288 0.400 A 108 ILE CG2 C 13 17.305 0.400 A 108 ILE N N 15 122.390 0.400 A 109 GLU H H 1 8.127 0.020 A 109 GLU HA H 1 4.218 0.020 A 109 GLU HBx H 1 1.823 0.020 A 109 GLU HBy H 1 2.041 0.020 A 109 GLU HG2 H 1 2.244 0.020 A 109 GLU HG3 H 1 2.172 0.020 A 109 GLU C C 13 176.438 0.400 A 109 GLU CA C 13 56.548 0.400 A 109 GLU CB C 13 30.178 0.400 A 109 GLU CG C 13 36.272 0.400 A 109 GLU N N 15 123.739 0.400 A 110 SER H H 1 8.291 0.020 A 110 SER HA H 1 4.446 0.020 A 110 SER HBx H 1 3.878 0.020 A 110 SER HBy H 1 3.878 0.020 A 110 SER C C 13 174.330 0.400 A 110 SER CA C 13 58.252 0.400 A 110 SER CB C 13 63.598 0.400 A 110 SER N N 15 116.242 0.400 A 111 ARG H H 1 8.238 0.020 A 111 ARG HA H 1 4.426 0.020 A 111 ARG HBx H 1 1.783 0.020 A 111 ARG HBy H 1 1.879 0.020 A 111 ARG HD2 H 1 3.186 0.020 A 111 ARG HD3 H 1 3.186 0.020 A 111 ARG HE H 1 7.218 0.020 A 111 ARG HG2 H 1 1.632 0.020 A 111 ARG HG3 H 1 1.632 0.020 A 111 ARG C C 13 176.113 0.400 A 111 ARG CA C 13 55.848 0.400 A 111 ARG CB C 13 30.755 0.400 A 111 ARG CD C 13 43.309 0.400 A 111 ARG CG C 13 26.983 0.400 A 111 ARG N N 15 122.827 0.400 A 111 ARG NE N 15 84.691 0.400 A 112 THR H H 1 8.229 0.020 A 112 THR HA H 1 4.573 0.020 A 112 THR HB H 1 4.139 0.020 A 112 THR HG2% H 1 1.236 0.020 A 112 THR C C 13 172.790 0.400 A 112 THR CA C 13 59.716 0.400 A 112 THR CB C 13 69.503 0.400 A 112 THR CG2 C 13 21.362 0.400 A 112 THR N N 15 117.863 0.400 A 113 PRO HA H 1 4.388 0.020 A 113 PRO HBx H 1 1.908 0.020 A 113 PRO HBy H 1 2.289 0.020 A 113 PRO HD2 H 1 3.680 0.020 A 113 PRO HD3 H 1 3.851 0.020 A 113 PRO HG2 H 1 2.028 0.020 A 113 PRO HG3 H 1 1.969 0.020 A 113 PRO C C 13 176.605 0.400 A 113 PRO CA C 13 63.131 0.400 A 113 PRO CB C 13 31.931 0.400 A 113 PRO CD C 13 50.863 0.400 A 113 PRO CG C 13 27.361 0.400 A 114 ALA H H 1 8.422 0.020 A 114 ALA HA H 1 4.284 0.020 A 114 ALA HB% H 1 1.382 0.020 A 114 ALA C C 13 178.251 0.400 A 114 ALA CA C 13 52.518 0.400 A 114 ALA CB C 13 19.131 0.400 A 114 ALA N N 15 124.466 0.400 A 115 GLY H H 1 8.380 0.020 A 115 GLY HAy H 1 3.956 0.020 A 115 GLY HAx H 1 3.934 0.020 A 115 GLY C C 13 174.020 0.400 A 115 GLY CA C 13 45.095 0.400 A 115 GLY N N 15 108.587 0.400 A 116 ALA H H 1 8.127 0.020 A 116 ALA HA H 1 4.292 0.020 A 116 ALA HB% H 1 1.378 0.020 A 116 ALA C C 13 177.565 0.400 A 116 ALA CA C 13 52.504 0.400 A 116 ALA CB C 13 19.187 0.400 A 116 ALA N N 15 123.523 0.400 A 117 ASP H H 1 8.316 0.020 A 117 ASP HA H 1 4.555 0.020 A 117 ASP HBy H 1 2.628 0.020 A 117 ASP HBx H 1 2.564 0.020 A 117 ASP C C 13 175.899 0.400 A 117 ASP CA C 13 54.254 0.400 A 117 ASP CB C 13 40.962 0.400 A 117 ASP N N 15 118.783 0.400 A 118 ASP H H 1 8.083 0.020 A 118 ASP HA H 1 4.529 0.020 A 118 ASP HBy H 1 2.623 0.020 A 118 ASP HBx H 1 2.552 0.020 A 118 ASP C C 13 176.278 0.400 A 118 ASP CA C 13 54.202 0.400 A 118 ASP CB C 13 40.933 0.400 A 118 ASP N N 15 119.935 0.400 A 119 TYR H H 1 8.107 0.020 A 119 TYR HA H 1 4.450 0.020 A 119 TYR HBy H 1 3.040 0.020 A 119 TYR HBx H 1 2.984 0.020 A 119 TYR HD1 H 1 7.089 0.020 A 119 TYR HD2 H 1 7.089 0.020 A 119 TYR HE1 H 1 6.808 0.020 A 119 TYR HE2 H 1 6.808 0.020 A 119 TYR C C 13 175.825 0.400 A 119 TYR CA C 13 58.350 0.400 A 119 TYR CB C 13 38.260 0.400 A 119 TYR CD1 C 13 132.857 0.400 A 119 TYR CD2 C 13 132.857 0.400 A 119 TYR CE1 C 13 118.064 0.400 A 119 TYR CE2 C 13 118.064 0.400 A 119 TYR N N 15 120.415 0.400 A 120 ASN H H 1 8.276 0.020 A 120 ASN HA H 1 4.615 0.020 A 120 ASN HBy H 1 2.766 0.020 A 120 ASN HBx H 1 2.712 0.020 A 120 ASN HD2y H 1 7.676 0.020 A 120 ASN HD2x H 1 6.881 0.020 A 120 ASN C C 13 175.102 0.400 A 120 ASN CA C 13 53.396 0.400 A 120 ASN CB C 13 38.712 0.400 A 120 ASN N N 15 119.834 0.400 A 120 ASN ND2 N 15 113.115 0.400 A 121 VAL H H 1 7.897 0.020 A 121 VAL HA H 1 4.009 0.020 A 121 VAL HB H 1 2.073 0.020 A 121 VAL HGx% H 1 0.919 0.020 A 121 VAL HGy% H 1 0.919 0.020 A 121 VAL C C 13 176.484 0.400 A 121 VAL CA C 13 62.950 0.400 A 121 VAL CB C 13 32.326 0.400 A 121 VAL CGx C 13 20.806 0.400 A 121 VAL CGy C 13 20.806 0.400 A 121 VAL N N 15 120.109 0.400 A 122 VAL H H 1 8.091 0.020 A 122 VAL HA H 1 4.014 0.020 A 122 VAL HB H 1 2.062 0.020 A 122 VAL HGx% H 1 0.910 0.020 A 122 VAL HGy% H 1 0.910 0.020 A 122 VAL C C 13 176.568 0.400 A 122 VAL CA C 13 62.924 0.400 A 122 VAL CB C 13 32.279 0.400 A 122 VAL CGx C 13 20.933 0.400 A 122 VAL CGy C 13 20.933 0.400 A 122 VAL N N 15 122.407 0.400 A 123 SER H H 1 8.228 0.020 A 123 SER HA H 1 4.385 0.020 A 123 SER HBy H 1 3.833 0.020 A 123 SER HBx H 1 3.801 0.020 A 123 SER C C 13 174.863 0.400 A 123 SER CA C 13 58.525 0.400 A 123 SER CB C 13 63.450 0.400 A 123 SER N N 15 118.095 0.400 A 124 ARG H H 1 8.208 0.020 A 124 ARG HA H 1 4.297 0.020 A 124 ARG HBx H 1 1.752 0.020 A 124 ARG HBy H 1 1.863 0.020 A 124 ARG HDx H 1 3.154 0.020 A 124 ARG HDy H 1 3.154 0.020 A 124 ARG HG2 H 1 1.592 0.020 A 124 ARG HG3 H 1 1.592 0.020 A 124 ARG C C 13 176.328 0.400 A 124 ARG CA C 13 56.408 0.400 A 124 ARG CB C 13 30.480 0.400 A 124 ARG CD C 13 43.262 0.400 A 124 ARG CG C 13 26.949 0.400 A 124 ARG N N 15 122.632 0.400 A 125 LEU H H 1 8.081 0.020 A 125 LEU HA H 1 4.262 0.020 A 125 LEU HBx H 1 1.494 0.020 A 125 LEU HBy H 1 1.599 0.020 A 125 LEU HDx% H 1 0.867 0.020 A 125 LEU HDy% H 1 0.821 0.020 A 125 LEU HG H 1 1.590 0.020 A 125 LEU C C 13 177.375 0.400 A 125 LEU CA C 13 55.282 0.400 A 125 LEU CB C 13 42.042 0.400 A 125 LEU CD1 C 13 24.807 0.400 A 125 LEU CD2 C 13 23.153 0.400 A 125 LEU CG C 13 26.826 0.400 A 125 LEU N N 15 121.964 0.400 A 126 GLU H H 1 8.232 0.020 A 126 GLU HA H 1 4.179 0.020 A 126 GLU HBx H 1 1.883 0.020 A 126 GLU HBy H 1 1.883 0.020 A 126 GLU HG2 H 1 2.204 0.020 A 126 GLU HG3 H 1 2.137 0.020 A 126 GLU C C 13 176.238 0.400 A 126 GLU CA C 13 56.451 0.400 A 126 GLU CB C 13 30.131 0.400 A 126 GLU CG C 13 35.931 0.400 A 126 GLU N N 15 120.807 0.400 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 109 GLU H A 108 ILE HG1y 1.0 . 6.00 2 2 A 33 ASN HD2y A 107 ILE HD1% 1.0 . 6.00 3 3 A 57 GLU H A 57 GLU HG3 1.0 . 3.91 4 3 A 57 GLU H A 57 GLU HG2 1.0 . 3.91 5 4 A 33 ASN HD2y A 33 ASN HB2 1.0 . 4.00 6 5 A 94 LEU H A 94 LEU HD2% 1.0 . 5.51 7 6 A 99 ALA HA A 101 GLY H 1.0 . 4.66 8 7 A 83 GLY H A 84 PHE H 1.0 . 3.46 9 8 A 83 GLY H A 80 ARG HA 1.0 . 5.25 10 9 A 9 VAL H A 11 LYS H 1.0 . 6.00 11 10 A 98 LYS HA A 100 ILE H 1.0 . 5.19 12 11 A 15 GLU HB3 A 16 TRP HE1 1.0 . 5.28 13 12 A 38 MET HA A 39 GLY H 1.0 . 3.17 14 13 A 120 ASN H A 119 TYR HBy 1.0 . 5.25 15 14 A 90 LEU H A 90 LEU HG 1.0 . 5.61 16 15 A 47 ASP H A 47 ASP HB3 1.0 . 4.09 17 16 A 47 ASP H A 47 ASP HB2 1.0 . 3.62 18 17 A 64 VAL HA A 66 GLY H 1.0 . 6.00 19 18 A 39 GLY H A 38 MET HBx 1.0 . 4.78 20 19 A 4 GLN H A 4 GLN HG2 1.0 . 5.10 21 19 A 4 GLN H A 4 GLN HG3 1.0 . 5.10 22 20 A 58 LYS HA A 60 ARG H 1.0 . 5.50 23 21 A 64 VAL H A 87 VAL HA 1.0 . 5.65 24 22 A 36 HIS H A 36 HIS HD2 1.0 . 5.50 25 23 A 51 ARG H A 51 ARG HG2 1.0 . 3.35 26 23 A 51 ARG H A 51 ARG HG3 1.0 . 3.35 27 24 A 78 LEU HD2% A 81 SER H 1.0 . 6.00 28 25 A 100 ILE H A 97 TRP HA 1.0 . 5.09 29 26 A 79 LEU H A 79 LEU HD2% 1.0 . 5.01 30 27 A 49 VAL H A 49 VAL HG2% 1.0 . 3.59 31 28 A 74 GLN H A 74 GLN HBy 1.0 . 3.62 32 29 A 2 GLU H A 1 MET HBx 1.0 . 5.50 33 29 A 1 MET HBy A 2 GLU H 1.0 . 5.50 34 30 A 97 TRP HA A 102 GLY H 1.0 . 6.00 35 31 A 39 GLY H A 105 GLU HG3 1.0 . 5.50 36 32 A 39 GLY H A 38 MET HE% 1.0 . 5.50 37 33 A 30 SER HA A 34 ASP H 1.0 . 5.31 38 34 A 11 LYS H A 97 TRP HZ3 1.0 . 4.40 39 35 A 17 GLY H A 13 ARG HBx 1.0 . 5.50 40 35 A 13 ARG HBy A 17 GLY H 1.0 . 5.50 41 36 A 17 GLY H A 13 ARG HG3 1.0 . 5.50 42 37 A 84 PHE HB3 A 86 HIS H 1.0 . 5.55 43 38 A 30 SER H A 29 ARG HB3 1.0 . 3.75 44 38 A 29 ARG HB2 A 30 SER H 1.0 . 3.75 45 39 A 90 LEU H A 72 THR HG2% 1.0 . 4.58 46 40 A 102 GLY H A 11 LYS HD2 1.0 . 3.49 47 41 A 29 ARG H A 44 PRO HA 1.0 . 5.50 48 42 A 19 PRO HA A 21 PHE H 1.0 . 4.33 49 43 A 52 ALA HB% A 54 SER H 1.0 . 6.00 50 44 A 22 THR HB A 23 ILE H 1.0 . 5.64 51 45 A 33 ASN H A 34 ASP HA 1.0 . 6.00 52 46 A 52 ALA HB% A 56 LEU H 1.0 . 6.00 53 47 A 109 GLU H A 108 ILE HG2% 1.0 . 5.05 54 48 A 31 THR H A 31 THR HB 1.0 . 3.47 55 49 A 86 HIS H A 84 PHE HD% 1.0 . 6.00 56 50 A 68 GLY H A 71 GLN HG2 1.0 . 5.31 57 51 A 42 ALA H A 41 MET HBx 1.0 . 3.63 58 51 A 41 MET HBy A 42 ALA H 1.0 . 3.63 59 52 A 38 MET H A 97 TRP HE1 1.0 . 4.81 60 53 A 43 MET H A 43 MET HG2 1.0 . 5.16 61 54 A 17 GLY H A 16 TRP HB3 1.0 . 5.08 62 55 A 90 LEU HG A 93 GLY H 1.0 . 4.50 63 56 A 64 VAL H A 87 VAL HG1% 1.0 . 5.50 64 57 A 64 VAL H A 64 VAL HG1% 1.0 . 5.14 65 58 A 65 TYR H A 65 TYR HD1 1.0 . 4.95 66 59 A 65 TYR H A 75 ALA HB% 1.0 . 6.00 67 60 A 60 ARG H A 60 ARG HBx 1.0 . 3.63 68 61 A 65 TYR H A 25 ASP HA 1.0 . 4.55 69 62 A 43 MET H A 43 MET HBx 1.0 . 3.64 70 62 A 43 MET H A 43 MET HBy 1.0 . 3.64 71 63 A 16 TRP HE1 A 15 GLU HB2 1.0 . 4.81 72 64 A 38 MET H A 104 THR HA 1.0 . 3.76 73 65 A 21 PHE H A 20 ALA H 1.0 . 4.33 74 66 A 98 LYS H A 98 LYS HG2 1.0 . 4.10 75 67 A 27 ARG HD3 A 67 ALA H 1.0 . 5.65 76 68 A 49 VAL HG1% A 53 SER H 1.0 . 6.00 77 69 A 82 ALA H A 83 GLY HA2 1.0 . 5.50 78 70 A 94 LEU HD1% A 95 ALA H 1.0 . 6.00 79 71 A 12 SER H A 100 ILE HD1% 1.0 . 6.00 80 72 A 4 GLN H A 2 GLU HG2 1.0 . 5.50 81 73 A 60 ARG H A 60 ARG HBy 1.0 . 3.63 82 74 A 99 ALA H A 100 ILE HG1x 1.0 . 5.50 83 75 A 26 VAL H A 27 ARG H 1.0 . 3.68 84 76 A 4 GLN HB3 A 4 GLN HE22 1.0 . 5.09 85 77 A 27 ARG H A 27 ARG HD2 1.0 . 5.50 86 78 A 54 SER H A 53 SER H 1.0 . 3.58 87 79 A 62 ILE H A 63 TYR H 1.0 . 6.00 88 80 A 63 TYR H A 63 TYR HE% 1.0 . 6.00 89 81 A 101 GLY H A 99 ALA HB% 1.0 . 5.95 90 82 A 52 ALA HB% A 55 SER H 1.0 . 6.00 91 83 A 86 HIS H A 85 GLU HB3 1.0 . 6.00 92 84 A 98 LYS H A 95 ALA HA 1.0 . 5.24 93 85 A 33 ASN HD2y A 33 ASN H 1.0 . 5.74 94 86 A 28 ASP H A 28 ASP HBy 1.0 . 3.74 95 87 A 81 SER H A 80 ARG HG3 1.0 . 3.55 96 88 A 84 PHE H A 80 ARG HA 1.0 . 4.02 97 89 A 66 GLY H A 75 ALA HB% 1.0 . 6.00 98 90 A 6 ASP H A 6 ASP HBx 1.0 . 3.58 99 90 A 6 ASP H A 6 ASP HBy 1.0 . 3.58 100 91 A 112 THR H A 111 ARG HG2 1.0 . 5.72 101 91 A 111 ARG HG3 A 112 THR H 1.0 . 5.72 102 92 A 7 ALA HB% A 97 TRP H 1.0 . 5.90 103 93 A 107 ILE H A 107 ILE HG1y 1.0 . 3.73 104 94 A 36 HIS H A 35 GLY HAx 1.0 . 3.02 105 94 A 36 HIS H A 35 GLY HAy 1.0 . 3.02 106 95 A 98 LYS H A 99 ALA HB% 1.0 . 5.50 107 96 A 43 MET HG2 A 52 ALA H 1.0 . 5.50 108 97 A 6 ASP H A 5 SER HA 1.0 . 3.13 109 98 A 97 TRP H A 98 LYS HG3 1.0 . 5.15 110 99 A 31 THR HB A 32 TYR H 1.0 . 3.72 111 100 A 36 HIS H A 105 GLU H 1.0 . 3.92 112 101 A 30 SER H A 29 ARG H 1.0 . 3.52 113 102 A 42 ALA H A 41 MET H 1.0 . 4.91 114 103 A 97 TRP H A 93 GLY HA3 1.0 . 5.50 115 104 A 94 LEU H A 93 GLY HA3 1.0 . 3.36 116 105 A 75 ALA HB% A 77 ASN H 1.0 . 6.00 117 106 A 23 ILE H A 24 LEU H 1.0 . 5.07 118 107 A 35 GLY H A 34 ASP HBx 1.0 . 4.02 119 108 A 97 TRP H A 96 ALA H 1.0 . 3.31 120 109 A 107 ILE H A 107 ILE HG1x 1.0 . 3.73 121 110 A 107 ILE H A 35 GLY H 1.0 . 5.79 122 111 A 23 ILE H A 23 ILE HD1% 1.0 . 5.50 123 112 A 49 VAL HB A 50 ASP H 1.0 . 3.24 124 113 A 84 PHE H A 84 PHE HB2 1.0 . 3.46 125 114 A 87 VAL HA A 88 SER H 1.0 . 3.25 126 115 A 59 SER H A 57 GLU HG3 1.0 . 4.37 127 115 A 57 GLU HG2 A 59 SER H 1.0 . 4.37 128 116 A 97 TRP H A 96 ALA HB% 1.0 . 4.07 129 117 A 112 THR H A 112 THR HG2% 1.0 . 6.00 130 118 A 88 SER H A 62 ILE HB 1.0 . 6.00 131 119 A 28 ASP H A 27 ARG HG2 1.0 . 4.36 132 119 A 28 ASP H A 27 ARG HG3 1.0 . 4.36 133 120 A 24 LEU H A 25 ASP H 1.0 . 6.00 134 121 A 11 LYS HD2 A 97 TRP HE1 1.0 . 5.50 135 122 A 97 TRP HE1 A 11 LYS HG3 1.0 . 5.50 136 123 A 29 ARG H A 28 ASP HBx 1.0 . 3.99 137 124 A 12 SER H A 12 SER HBx 1.0 . 3.40 138 124 A 12 SER H A 12 SER HBy 1.0 . 3.40 139 125 A 71 GLN HA A 75 ALA H 1.0 . 5.50 140 126 A 9 VAL H A 10 LEU HB3 1.0 . 6.00 141 127 A 54 SER H A 52 ALA HA 1.0 . 4.90 142 128 A 64 VAL H A 64 VAL HG2% 1.0 . 4.31 143 129 A 43 MET H A 48 LEU HD1% 1.0 . 5.50 144 130 A 50 ASP H A 50 ASP HBx 1.0 . 3.00 145 130 A 50 ASP H A 50 ASP HBy 1.0 . 3.00 146 131 A 68 GLY H A 66 GLY HA3 1.0 . 5.45 147 132 A 98 LYS H A 98 LYS HB3 1.0 . 3.71 148 133 A 64 VAL H A 24 LEU H 1.0 . 5.84 149 134 A 23 ILE H A 22 THR HA 1.0 . 3.29 150 135 A 7 ALA HB% A 7 ALA H 1.0 . 4.19 151 136 A 89 GLU H A 89 GLU HG2 1.0 . 4.10 152 137 A 5 SER H A 91 LYS H 1.0 . 5.50 153 138 A 75 ALA H A 26 VAL HG2% 1.0 . 5.56 154 139 A 93 GLY H A 91 LYS HA 1.0 . 4.87 155 140 A 105 GLU H A 104 THR H 1.0 . 5.27 156 141 A 84 PHE H A 79 LEU HB2 1.0 . 6.00 157 142 A 17 GLY H A 18 GLU H 1.0 . 4.42 158 143 A 42 ALA H A 32 TYR HD% 1.0 . 5.50 159 144 A 10 LEU H A 10 LEU HD2% 1.0 . 6.00 160 145 A 58 LYS H A 58 LYS HB2 1.0 . 3.51 161 146 A 29 ARG H A 29 ARG HD2 1.0 . 4.46 162 146 A 29 ARG H A 29 ARG HD3 1.0 . 4.46 163 147 A 12 SER H A 9 VAL HA 1.0 . 4.49 164 148 A 22 THR HB A 63 TYR H 1.0 . 5.81 165 149 A 98 LYS H A 97 TRP H 1.0 . 3.61 166 150 A 94 LEU HD2% A 35 GLY H 1.0 . 5.50 167 151 A 88 SER H A 62 ILE HG2% 1.0 . 6.00 168 152 A 94 LEU H A 65 TYR HBx 1.0 . 5.13 169 152 A 94 LEU H A 65 TYR HBy 1.0 . 5.13 170 153 A 36 HIS H A 94 LEU HD1% 1.0 . 6.00 171 154 A 75 ALA HB% A 78 LEU H 1.0 . 6.00 172 155 A 97 TRP HE1 A 104 THR HA 1.0 . 5.98 173 156 A 17 GLY H A 13 ARG HA 1.0 . 4.12 174 157 A 88 SER H A 1 MET HE% 1.0 . 5.38 175 158 A 11 LYS H A 100 ILE HD1% 1.0 . 6.00 176 159 A 63 TYR H A 63 TYR HD% 1.0 . 3.97 177 160 A 30 SER HA A 33 ASN HD2x 1.0 . 4.98 178 161 A 77 ASN H A 77 ASN HBx 1.0 . 3.22 179 162 A 102 GLY H A 100 ILE HD1% 1.0 . 5.98 180 163 A 65 TYR H A 26 VAL HG2% 1.0 . 6.00 181 164 A 29 ARG H A 44 PRO HG2 1.0 . 4.31 182 164 A 29 ARG H A 44 PRO HG3 1.0 . 4.31 183 165 A 9 VAL HG1% A 13 ARG H 1.0 . 5.81 184 166 A 97 TRP H A 90 LEU HD2% 1.0 . 5.50 185 167 A 58 LYS H A 57 GLU HG3 1.0 . 5.86 186 167 A 57 GLU HG2 A 58 LYS H 1.0 . 5.86 187 168 A 27 ARG HE A 31 THR HG2% 1.0 . 5.87 188 169 A 93 GLY H A 92 GLY H 1.0 . 4.22 189 170 A 41 MET H A 24 LEU HA 1.0 . 3.86 190 171 A 86 HIS H A 87 VAL H 1.0 . 5.28 191 172 A 65 TYR H A 26 VAL H 1.0 . 4.77 192 173 A 77 ASN H A 76 VAL HG2% 1.0 . 4.95 193 174 A 79 LEU H A 80 ARG H 1.0 . 3.76 194 175 A 67 ALA H A 27 ARG H 1.0 . 5.83 195 176 A 11 LYS H A 12 SER H 1.0 . 3.99 196 177 A 91 LYS H A 91 LYS HB2 1.0 . 3.75 197 178 A 71 GLN HE22 A 27 ARG HG2 1.0 . 5.50 198 178 A 27 ARG HG3 A 71 GLN HE22 1.0 . 5.50 199 179 A 31 THR HB A 28 ASP H 1.0 . 4.84 200 180 A 47 ASP H A 48 LEU H 1.0 . 3.02 201 181 A 91 LYS H A 90 LEU HB3 1.0 . 6.00 202 182 A 112 THR H A 112 THR HB 1.0 . 3.99 203 183 A 10 LEU HB3 A 10 LEU H 1.0 . 4.03 204 184 A 13 ARG HA A 15 GLU H 1.0 . 6.00 205 185 A 45 ILE H A 48 LEU HD2% 1.0 . 5.50 206 186 A 45 ILE H A 45 ILE HD1% 1.0 . 5.32 207 187 A 65 TYR H A 65 TYR HD2 1.0 . 4.49 208 188 A 62 ILE H A 1 MET HE% 1.0 . 4.74 209 189 A 105 GLU H A 37 ILE HA 1.0 . 5.82 210 190 A 31 THR H A 28 ASP HBy 1.0 . 4.82 211 191 A 71 GLN HE22 A 67 ALA HB% 1.0 . 5.41 212 192 A 87 VAL H A 86 HIS HA 1.0 . 3.12 213 193 A 21 PHE HD% A 22 THR H 1.0 . 5.38 214 194 A 34 ASP HA A 107 ILE H 1.0 . 4.16 215 195 A 57 GLU H A 60 ARG HD3 1.0 . 6.00 216 196 A 90 LEU H A 90 LEU HD1% 1.0 . 5.50 217 197 A 68 GLY H A 71 GLN H 1.0 . 4.49 218 198 A 41 MET H A 40 ALA HB% 1.0 . 3.72 219 199 A 32 TYR H A 32 TYR HD% 1.0 . 5.25 220 200 A 24 LEU H A 23 ILE HA 1.0 . 3.10 221 201 A 55 SER H A 54 SER HBx 1.0 . 4.00 222 201 A 55 SER H A 54 SER HBy 1.0 . 4.00 223 202 A 30 SER H A 28 ASP HA 1.0 . 4.89 224 203 A 8 HIS H A 9 VAL HG2% 1.0 . 6.00 225 204 A 100 ILE H A 102 GLY H 1.0 . 5.06 226 205 A 28 ASP H A 27 ARG HE 1.0 . 5.22 227 206 A 109 GLU H A 108 ILE HB 1.0 . 4.34 228 207 A 77 ASN H A 74 GLN HA 1.0 . 4.22 229 208 A 22 THR H A 21 PHE HBy 1.0 . 4.44 230 209 A 121 VAL HA A 122 VAL H 1.0 . 3.45 231 210 A 82 ALA H A 81 SER HBy 1.0 . 3.62 232 210 A 82 ALA H A 81 SER HBx 1.0 . 3.62 233 211 A 82 ALA H A 79 LEU HA 1.0 . 4.19 234 212 A 35 GLY H A 33 ASN HA 1.0 . 5.88 235 213 A 38 MET H A 105 GLU H 1.0 . 6.00 236 214 A 91 LYS H A 90 LEU HD1% 1.0 . 4.92 237 215 A 68 GLY H A 67 ALA H 1.0 . 4.02 238 216 A 30 SER H A 29 ARG HG3 1.0 . 5.49 239 216 A 30 SER H A 29 ARG HG2 1.0 . 5.49 240 217 A 47 ASP H A 45 ILE HA 1.0 . 5.39 241 218 A 73 SER H A 73 SER HBx 1.0 . 2.98 242 218 A 73 SER H A 73 SER HBy 1.0 . 2.98 243 219 A 77 ASN H A 76 VAL HB 1.0 . 3.61 244 220 A 101 GLY H A 11 LYS HD2 1.0 . 6.00 245 221 A 34 ASP H A 33 ASN H 1.0 . 3.78 246 222 A 15 GLU HB2 A 15 GLU H 1.0 . 3.37 247 223 A 15 GLU H A 14 LEU HBx 1.0 . 4.48 248 224 A 108 ILE H A 106 GLY HAx 1.0 . 5.21 249 224 A 106 GLY HAy A 108 ILE H 1.0 . 5.21 250 225 A 56 LEU H A 84 PHE HE% 1.0 . 5.50 251 226 A 56 LEU H A 84 PHE HZ 1.0 . 5.50 252 227 A 109 GLU H A 109 GLU HBx 1.0 . 4.15 253 228 A 97 TRP HE1 A 103 PRO HG2 1.0 . 5.54 254 228 A 97 TRP HE1 A 103 PRO HG3 1.0 . 5.54 255 229 A 98 LYS H A 104 THR HG2% 1.0 . 6.00 256 230 A 58 LYS H A 84 PHE HE% 1.0 . 6.00 257 231 A 44 PRO HB2 A 46 GLU H 1.0 . 4.97 258 232 A 12 SER HA A 16 TRP H 1.0 . 5.00 259 233 A 36 HIS H A 104 THR HA 1.0 . 6.00 260 234 A 38 MET H A 38 MET HBy 1.0 . 3.90 261 235 A 42 ALA H A 42 ALA HB% 1.0 . 3.65 262 236 A 97 TRP HE1 A 37 ILE HG2% 1.0 . 4.86 263 237 A 16 TRP H A 12 SER HBx 1.0 . 5.50 264 237 A 12 SER HBy A 16 TRP H 1.0 . 5.50 265 238 A 13 ARG HA A 16 TRP H 1.0 . 5.50 266 239 A 31 THR H A 28 ASP HA 1.0 . 5.95 267 240 A 64 VAL H A 89 GLU HA 1.0 . 4.72 268 241 A 80 ARG H A 77 ASN HA 1.0 . 4.26 269 242 A 23 ILE H A 23 ILE HG1y 1.0 . 4.70 270 243 A 62 ILE H A 62 ILE HD1% 1.0 . 5.37 271 244 A 95 ALA H A 97 TRP H 1.0 . 5.14 272 245 A 54 SER H A 50 ASP HA 1.0 . 4.78 273 246 A 53 SER H A 82 ALA HB% 1.0 . 6.00 274 247 A 59 SER H A 84 PHE HE% 1.0 . 6.00 275 248 A 13 ARG H A 10 LEU HD1% 1.0 . 6.00 276 249 A 44 PRO HA A 45 ILE H 1.0 . 2.94 277 250 A 57 GLU H A 56 LEU HBx 1.0 . 4.68 278 251 A 97 TRP H A 37 ILE HD1% 1.0 . 5.50 279 252 A 91 LYS HA A 92 GLY H 1.0 . 2.99 280 253 A 7 ALA H A 8 HIS H 1.0 . 4.95 281 254 A 47 ASP HB3 A 48 LEU H 1.0 . 5.50 282 255 A 51 ARG H A 52 ALA HB% 1.0 . 6.00 283 256 A 98 LYS H A 96 ALA H 1.0 . 4.74 284 257 A 33 ASN H A 32 TYR HD% 1.0 . 4.79 285 258 A 20 ALA H A 18 GLU HG3 1.0 . 5.98 286 259 A 79 LEU H A 75 ALA HA 1.0 . 5.12 287 260 A 104 THR H A 103 PRO HA 1.0 . 3.24 288 261 A 43 MET H A 42 ALA HA 1.0 . 2.99 289 262 A 77 ASN HA A 80 ARG HE 1.0 . 5.88 290 263 A 54 SER H A 50 ASP HBx 1.0 . 5.72 291 263 A 54 SER H A 50 ASP HBy 1.0 . 5.72 292 264 A 79 LEU H A 78 LEU HB3 1.0 . 4.04 293 265 A 47 ASP H A 48 LEU HD1% 1.0 . 6.00 294 266 A 25 ASP H A 24 LEU HB3 1.0 . 4.62 295 267 A 59 SER H A 58 LYS H 1.0 . 3.83 296 268 A 34 ASP H A 32 TYR H 1.0 . 5.79 297 269 A 41 MET H A 40 ALA HA 1.0 . 3.23 298 270 A 13 ARG HG2 A 14 LEU H 1.0 . 5.76 299 271 A 14 LEU H A 14 LEU HBy 1.0 . 3.92 300 272 A 79 LEU H A 79 LEU HG 1.0 . 3.45 301 273 A 4 GLN H A 3 PRO HD2 1.0 . 4.40 302 273 A 4 GLN H A 3 PRO HD3 1.0 . 4.40 303 274 A 36 HIS HB2 A 37 ILE H 1.0 . 4.32 304 275 A 41 MET H A 22 THR HG2% 1.0 . 6.00 305 276 A 119 TYR H A 119 TYR HBx 1.0 . 3.52 306 276 A 119 TYR H A 119 TYR HBy 1.0 . 3.52 307 277 A 72 THR HG2% A 73 SER H 1.0 . 5.50 308 278 A 72 THR HG2% A 72 THR H 1.0 . 5.50 309 279 A 83 GLY H A 84 PHE HB2 1.0 . 6.00 310 280 A 76 VAL HB A 76 VAL H 1.0 . 3.14 311 281 A 77 ASN H A 76 VAL HG1% 1.0 . 5.46 312 282 A 58 LYS H A 58 LYS HD2 1.0 . 5.50 313 283 A 45 ILE HD1% A 74 GLN HE2x 1.0 . 5.50 314 284 A 86 HIS H A 87 VAL HG2% 1.0 . 5.30 315 285 A 4 GLN HE22 A 4 GLN HG2 1.0 . 4.05 316 285 A 4 GLN HG3 A 4 GLN HE22 1.0 . 4.05 317 286 A 60 ARG H A 59 SER H 1.0 . 3.60 318 287 A 13 ARG H A 12 SER HBx 1.0 . 4.20 319 287 A 12 SER HBy A 13 ARG H 1.0 . 4.20 320 288 A 109 GLU H A 108 ILE H 1.0 . 3.78 321 289 A 71 GLN HG2 A 71 GLN HE22 1.0 . 3.96 322 290 A 18 GLU H A 19 PRO HD3 1.0 . 6.00 323 291 A 61 ASP H A 60 ARG HGx 1.0 . 4.16 324 291 A 60 ARG HGy A 61 ASP H 1.0 . 4.16 325 292 A 84 PHE H A 58 LYS HG2 1.0 . 5.50 326 293 A 84 PHE H A 79 LEU HB3 1.0 . 5.50 327 294 A 48 LEU HD1% A 48 LEU H 1.0 . 5.44 328 295 A 104 THR H A 103 PRO HB3 1.0 . 4.54 329 296 A 25 ASP HA A 26 VAL H 1.0 . 3.12 330 297 A 9 VAL H A 10 LEU H 1.0 . 3.88 331 298 A 72 THR HG2% A 89 GLU H 1.0 . 6.00 332 299 A 30 SER H A 28 ASP HBy 1.0 . 4.69 333 300 A 65 TYR H A 64 VAL HG2% 1.0 . 5.04 334 301 A 80 ARG HE A 80 ARG HBx 1.0 . 4.52 335 301 A 80 ARG HE A 80 ARG HBy 1.0 . 4.52 336 302 A 116 ALA HA A 117 ASP H 1.0 . 3.44 337 303 A 38 MET H A 104 THR H 1.0 . 5.50 338 304 A 39 GLY H A 38 MET H 1.0 . 5.50 339 305 A 38 MET H A 37 ILE HA 1.0 . 3.42 340 306 A 30 SER H A 29 ARG HD2 1.0 . 5.34 341 306 A 30 SER H A 29 ARG HD3 1.0 . 5.34 342 307 A 95 ALA H A 97 TRP HB3 1.0 . 5.88 343 308 A 94 LEU H A 95 ALA HB% 1.0 . 5.09 344 309 A 21 PHE H A 20 ALA HB% 1.0 . 5.00 345 310 A 114 ALA HA A 115 GLY H 1.0 . 3.42 346 311 A 67 ALA H A 26 VAL H 1.0 . 5.89 347 312 A 78 LEU H A 75 ALA HA 1.0 . 4.48 348 313 A 79 LEU HB2 A 80 ARG H 1.0 . 4.07 349 314 A 24 LEU H A 62 ILE HG2% 1.0 . 5.50 350 315 A 13 ARG HE A 13 ARG HBx 1.0 . 5.50 351 315 A 13 ARG HBy A 13 ARG HE 1.0 . 5.50 352 316 A 25 ASP H A 40 ALA HB% 1.0 . 5.14 353 317 A 84 PHE H A 58 LYS HEx 1.0 . 6.00 354 317 A 84 PHE H A 58 LYS HEy 1.0 . 6.00 355 318 A 107 ILE H A 107 ILE HG2% 1.0 . 5.19 356 319 A 11 LYS H A 10 LEU H 1.0 . 4.01 357 320 A 98 LYS HA A 102 GLY H 1.0 . 3.74 358 321 A 57 GLU H A 56 LEU HA 1.0 . 3.15 359 322 A 48 LEU H A 46 GLU H 1.0 . 5.43 360 323 A 63 TYR H A 24 LEU HG 1.0 . 5.50 361 324 A 33 ASN H A 32 TYR HBx 1.0 . 3.67 362 324 A 33 ASN H A 32 TYR HBy 1.0 . 3.67 363 325 A 33 ASN HB2 A 33 ASN H 1.0 . 3.68 364 326 A 97 TRP HE1 A 103 PRO HDx 1.0 . 4.51 365 326 A 97 TRP HE1 A 103 PRO HDy 1.0 . 4.51 366 327 A 28 ASP H A 28 ASP HBx 1.0 . 3.74 367 328 A 49 VAL H A 47 ASP HA 1.0 . 5.27 368 329 A 53 SER H A 52 ALA H 1.0 . 3.61 369 330 A 98 LYS H A 97 TRP HB2 1.0 . 4.10 370 331 A 28 ASP H A 31 THR HG2% 1.0 . 5.49 371 332 A 24 LEU H A 24 LEU HG 1.0 . 4.07 372 333 A 78 LEU H A 78 LEU HG 1.0 . 3.41 373 334 A 66 GLY H A 67 ALA H 1.0 . 5.50 374 335 A 33 ASN HB2 A 33 ASN HD2x 1.0 . 4.00 375 336 A 33 ASN H A 33 ASN HB3 1.0 . 3.75 376 337 A 93 GLY H A 91 LYS H 1.0 . 6.00 377 338 A 37 ILE HG2% A 37 ILE H 1.0 . 6.00 378 339 A 46 GLU H A 45 ILE HG1x 1.0 . 5.35 379 339 A 46 GLU H A 45 ILE HG1y 1.0 . 5.35 380 340 A 123 SER H A 123 SER HBy 1.0 . 3.98 381 340 A 123 SER H A 123 SER HBx 1.0 . 3.98 382 341 A 6 ASP H A 5 SER H 1.0 . 5.80 383 342 A 31 THR HB A 35 GLY H 1.0 . 6.00 384 343 A 15 GLU H A 14 LEU H 1.0 . 3.91 385 344 A 52 ALA H A 51 ARG HBx 1.0 . 4.22 386 345 A 53 SER H A 53 SER HBy 1.0 . 3.83 387 346 A 45 ILE HD1% A 74 GLN HE2y 1.0 . 5.50 388 347 A 45 ILE H A 26 VAL HB 1.0 . 3.75 389 348 A 22 THR H A 62 ILE HA 1.0 . 4.28 390 349 A 105 GLU HG3 A 105 GLU H 1.0 . 6.00 391 350 A 89 GLU H A 88 SER HBy 1.0 . 5.63 392 351 A 11 LYS H A 13 ARG H 1.0 . 5.24 393 352 A 6 ASP H A 9 VAL HB 1.0 . 4.77 394 353 A 9 VAL H A 8 HIS H 1.0 . 3.82 395 354 A 79 LEU H A 79 LEU HD1% 1.0 . 4.86 396 355 A 64 VAL H A 88 SER H 1.0 . 4.97 397 356 A 4 GLN HB2 A 4 GLN HE21 1.0 . 5.61 398 357 A 84 PHE H A 82 ALA HB% 1.0 . 5.36 399 358 A 94 LEU H A 97 TRP H 1.0 . 5.50 400 359 A 94 LEU H A 93 GLY H 1.0 . 5.19 401 360 A 34 ASP H A 108 ILE H 1.0 . 4.78 402 361 A 66 GLY H A 65 TYR HA 1.0 . 3.26 403 362 A 47 ASP H A 46 GLU H 1.0 . 3.63 404 363 A 126 GLU H A 126 GLU HBx 1.0 . 3.31 405 363 A 126 GLU H A 126 GLU HBy 1.0 . 3.31 406 364 A 89 GLU H A 76 VAL HG1% 1.0 . 5.50 407 365 A 62 ILE H A 87 VAL HG2% 1.0 . 5.50 408 366 A 87 VAL HG1% A 88 SER H 1.0 . 4.53 409 367 A 75 ALA H A 74 GLN HBx 1.0 . 4.14 410 368 A 105 GLU HG3 A 38 MET H 1.0 . 5.50 411 369 A 38 MET HE% A 38 MET H 1.0 . 5.50 412 370 A 100 ILE H A 99 ALA H 1.0 . 3.53 413 371 A 11 LYS H A 11 LYS HG3 1.0 . 4.68 414 372 A 101 GLY H A 100 ILE HD1% 1.0 . 6.00 415 373 A 33 ASN H A 32 TYR H 1.0 . 4.05 416 374 A 30 SER H A 31 THR HG2% 1.0 . 6.00 417 375 A 18 GLU H A 18 GLU HG3 1.0 . 4.62 418 375 A 18 GLU H A 18 GLU HG2 1.0 . 4.62 419 376 A 43 MET H A 42 ALA HB% 1.0 . 4.75 420 377 A 29 ARG H A 28 ASP HBy 1.0 . 3.99 421 378 A 24 LEU H A 22 THR HG2% 1.0 . 6.00 422 379 A 84 PHE HB3 A 85 GLU H 1.0 . 4.75 423 380 A 85 GLU H A 85 GLU HG3 1.0 . 3.93 424 381 A 71 GLN H A 70 GLU H 1.0 . 3.74 425 382 A 90 LEU H A 64 VAL HG1% 1.0 . 6.00 426 383 A 14 LEU H A 13 ARG HD2 1.0 . 6.00 427 384 A 67 ALA H A 26 VAL HG2% 1.0 . 5.62 428 385 A 90 LEU H A 90 LEU HB2 1.0 . 3.92 429 386 A 112 THR HG2% A 114 ALA H 1.0 . 6.00 430 387 A 25 ASP H A 48 LEU HD1% 1.0 . 5.50 431 388 A 25 ASP H A 23 ILE HG2% 1.0 . 5.50 432 389 A 63 TYR H A 22 THR H 1.0 . 5.40 433 390 A 12 SER H A 13 ARG H 1.0 . 3.95 434 391 A 78 LEU H A 77 ASN HBx 1.0 . 4.41 435 392 A 35 GLY H A 108 ILE H 1.0 . 5.35 436 393 A 100 ILE H A 98 LYS H 1.0 . 5.27 437 394 A 11 LYS H A 97 TRP HH2 1.0 . 5.01 438 395 A 96 ALA H A 97 TRP HB2 1.0 . 6.00 439 396 A 67 ALA H A 27 ARG HD2 1.0 . 6.00 440 397 A 80 ARG H A 80 ARG HG2 1.0 . 3.89 441 398 A 32 TYR H A 29 ARG HA 1.0 . 4.35 442 399 A 18 GLU H A 18 GLU HBx 1.0 . 3.86 443 400 A 45 ILE H A 45 ILE HG1x 1.0 . 4.23 444 400 A 45 ILE H A 45 ILE HG1y 1.0 . 4.23 445 401 A 74 GLN H A 75 ALA HB% 1.0 . 5.35 446 402 A 41 MET H A 25 ASP H 1.0 . 4.77 447 403 A 66 GLY H A 26 VAL H 1.0 . 5.50 448 404 A 26 VAL H A 25 ASP H 1.0 . 5.50 449 405 A 81 SER H A 82 ALA H 1.0 . 3.48 450 406 A 101 GLY H A 100 ILE H 1.0 . 3.42 451 407 A 47 ASP H A 45 ILE HG2% 1.0 . 5.92 452 408 A 78 LEU H A 78 LEU HB2 1.0 . 3.54 453 409 A 115 GLY H A 114 ALA HB% 1.0 . 5.40 454 410 A 42 ALA H A 40 ALA HB% 1.0 . 6.00 455 411 A 27 ARG HE A 27 ARG HBy 1.0 . 3.73 456 411 A 27 ARG HE A 27 ARG HBx 1.0 . 3.73 457 412 A 91 LYS H A 90 LEU HA 1.0 . 3.31 458 413 A 90 LEU H A 90 LEU HD2% 1.0 . 5.50 459 414 A 83 GLY H A 79 LEU HA 1.0 . 6.00 460 415 A 24 LEU H A 24 LEU HB2 1.0 . 3.81 461 416 A 35 GLY H A 106 GLY HAx 1.0 . 4.48 462 416 A 35 GLY H A 106 GLY HAy 1.0 . 4.48 463 417 A 37 ILE H A 36 HIS HB3 1.0 . 4.92 464 418 A 30 SER H A 32 TYR H 1.0 . 4.97 465 419 A 64 VAL H A 65 TYR H 1.0 . 4.61 466 420 A 21 PHE H A 22 THR H 1.0 . 5.35 467 421 A 8 HIS H A 8 HIS HBx 1.0 . 4.06 468 422 A 37 ILE HD1% A 37 ILE H 1.0 . 5.62 469 423 A 29 ARG H A 29 ARG HG3 1.0 . 4.21 470 423 A 29 ARG H A 29 ARG HG2 1.0 . 4.21 471 424 A 87 VAL H A 86 HIS HBx 1.0 . 4.76 472 424 A 87 VAL H A 86 HIS HBy 1.0 . 4.76 473 425 A 75 ALA H A 72 THR HA 1.0 . 5.36 474 426 A 81 SER H A 80 ARG H 1.0 . 3.62 475 427 A 47 ASP H A 49 VAL H 1.0 . 5.76 476 428 A 42 ALA H A 41 MET HG3 1.0 . 5.05 477 429 A 101 GLY H A 98 LYS HA 1.0 . 4.05 478 430 A 101 GLY H A 100 ILE HB 1.0 . 5.15 479 431 A 49 VAL H A 45 ILE HA 1.0 . 6.00 480 432 A 84 PHE H A 82 ALA H 1.0 . 4.26 481 433 A 88 SER H A 89 GLU H 1.0 . 5.50 482 434 A 62 ILE H A 88 SER H 1.0 . 5.50 483 435 A 97 TRP HE1 A 37 ILE HA 1.0 . 4.83 484 436 A 11 LYS H A 14 LEU HDx% 1.0 . 6.00 485 436 A 11 LYS H A 14 LEU HDy% 1.0 . 6.00 486 437 A 4 GLN H A 4 GLN HB2 1.0 . 3.98 487 438 A 109 GLU H A 109 GLU HBy 1.0 . 4.15 488 439 A 13 ARG H A 14 LEU H 1.0 . 4.05 489 440 A 94 LEU H A 96 ALA H 1.0 . 5.77 490 441 A 87 VAL HG2% A 85 GLU H 1.0 . 6.00 491 442 A 27 ARG H A 31 THR HG2% 1.0 . 6.00 492 443 A 33 ASN H A 33 ASN HD2x 1.0 . 5.74 493 444 A 22 THR HG2% A 60 ARG HE 1.0 . 6.00 494 445 A 16 TRP H A 15 GLU HG3 1.0 . 5.87 495 446 A 52 ALA H A 48 LEU HD1% 1.0 . 5.50 496 447 A 29 ARG H A 31 THR HB 1.0 . 5.50 497 448 A 30 SER HA A 29 ARG H 1.0 . 5.50 498 449 A 83 GLY H A 82 ALA H 1.0 . 3.25 499 450 A 20 ALA H A 19 PRO HG2 1.0 . 5.22 500 450 A 20 ALA H A 19 PRO HG3 1.0 . 5.22 501 451 A 68 GLY H A 70 GLU H 1.0 . 5.50 502 452 A 68 GLY H A 69 ASP H 1.0 . 5.50 503 453 A 126 GLU H A 125 LEU HG 1.0 . 5.50 504 454 A 65 TYR H A 24 LEU HB2 1.0 . 5.16 505 455 A 65 TYR H A 64 VAL HB 1.0 . 5.19 506 456 A 105 GLU H A 105 GLU HG2 1.0 . 6.00 507 457 A 37 ILE H A 23 ILE HG2% 1.0 . 6.00 508 458 A 125 LEU H A 126 GLU HBx 1.0 . 5.46 509 458 A 126 GLU HBy A 125 LEU H 1.0 . 5.46 510 459 A 26 VAL H A 27 ARG HG2 1.0 . 5.16 511 459 A 26 VAL H A 27 ARG HG3 1.0 . 5.16 512 460 A 59 SER H A 57 GLU HA 1.0 . 4.75 513 461 A 6 ASP H A 5 SER HBx 1.0 . 4.28 514 461 A 6 ASP H A 5 SER HBy 1.0 . 4.28 515 462 A 31 THR H A 30 SER HBx 1.0 . 3.59 516 462 A 31 THR H A 30 SER HBy 1.0 . 3.59 517 463 A 48 LEU H A 45 ILE HA 1.0 . 3.89 518 464 A 56 LEU H A 55 SER H 1.0 . 3.12 519 465 A 2 GLU H A 2 GLU HG3 1.0 . 5.50 520 466 A 2 GLU H A 1 MET HG2 1.0 . 5.50 521 467 A 90 LEU H A 89 GLU HBx 1.0 . 4.12 522 467 A 90 LEU H A 89 GLU HBy 1.0 . 4.12 523 468 A 58 LYS H A 57 GLU HA 1.0 . 2.98 524 469 A 49 VAL HG1% A 50 ASP H 1.0 . 4.76 525 470 A 47 ASP H A 46 GLU HG2 1.0 . 3.86 526 470 A 47 ASP H A 46 GLU HG3 1.0 . 3.86 527 471 A 90 LEU H A 5 SER H 1.0 . 5.71 528 472 A 78 LEU H A 80 ARG H 1.0 . 5.53 529 473 A 94 LEU H A 95 ALA H 1.0 . 3.46 530 474 A 105 GLU HB3 A 106 GLY H 1.0 . 3.89 531 475 A 96 ALA H A 96 ALA HB% 1.0 . 3.50 532 476 A 33 ASN H A 29 ARG HA 1.0 . 4.79 533 477 A 92 GLY H A 91 LYS HD2 1.0 . 5.48 534 477 A 92 GLY H A 91 LYS HD3 1.0 . 5.48 535 478 A 122 VAL H A 121 VAL HB 1.0 . 4.26 536 479 A 71 GLN HA A 71 GLN HE22 1.0 . 6.00 537 480 A 26 VAL HG2% A 72 THR H 1.0 . 6.00 538 481 A 70 GLU H A 70 GLU HBy 1.0 . 3.89 539 482 A 48 LEU H A 46 GLU HA 1.0 . 5.40 540 483 A 79 LEU H A 77 ASN H 1.0 . 4.90 541 484 A 94 LEU H A 94 LEU HB2 1.0 . 3.61 542 485 A 88 SER H A 87 VAL H 1.0 . 6.00 543 486 A 27 ARG HE A 27 ARG HA 1.0 . 4.94 544 487 A 84 PHE H A 58 LYS HD3 1.0 . 4.49 545 488 A 49 VAL HG2% A 48 LEU H 1.0 . 5.82 546 489 A 84 PHE HD% A 85 GLU H 1.0 . 5.16 547 490 A 45 ILE H A 45 ILE HB 1.0 . 3.24 548 491 A 75 ALA HB% A 75 ALA H 1.0 . 3.55 549 492 A 81 SER H A 80 ARG HG2 1.0 . 4.46 550 493 A 36 HIS H A 35 GLY H 1.0 . 4.36 551 494 A 27 ARG HD3 A 28 ASP H 1.0 . 5.86 552 495 A 63 TYR H A 62 ILE HG2% 1.0 . 4.46 553 496 A 79 LEU H A 82 ALA H 1.0 . 5.25 554 497 A 105 GLU H A 104 THR HG2% 1.0 . 5.16 555 498 A 7 ALA HB% A 8 HIS H 1.0 . 4.87 556 499 A 36 HIS H A 106 GLY HAx 1.0 . 4.37 557 499 A 36 HIS H A 106 GLY HAy 1.0 . 4.37 558 500 A 27 ARG HA A 71 GLN HE21 1.0 . 6.00 559 501 A 71 GLN H A 70 GLU HGx 1.0 . 5.19 560 501 A 71 GLN H A 70 GLU HGy 1.0 . 5.19 561 502 A 56 LEU H A 55 SER HBx 1.0 . 4.04 562 502 A 56 LEU H A 55 SER HBy 1.0 . 4.04 563 503 A 24 LEU H A 63 TYR HB3 1.0 . 6.00 564 504 A 31 THR H A 28 ASP HBx 1.0 . 4.82 565 505 A 28 ASP H A 27 ARG HBy 1.0 . 3.21 566 505 A 28 ASP H A 27 ARG HBx 1.0 . 3.21 567 506 A 91 LYS H A 91 LYS HD2 1.0 . 5.10 568 506 A 91 LYS H A 91 LYS HD3 1.0 . 5.10 569 507 A 93 GLY H A 96 ALA HB% 1.0 . 6.00 570 508 A 98 LYS H A 99 ALA H 1.0 . 3.40 571 509 A 97 TRP HE1 A 94 LEU HD1% 1.0 . 5.50 572 510 A 34 ASP HA A 108 ILE H 1.0 . 4.25 573 511 A 33 ASN H A 31 THR H 1.0 . 5.11 574 512 A 60 ARG H A 62 ILE HD1% 1.0 . 6.00 575 513 A 99 ALA H A 98 LYS HB2 1.0 . 3.49 576 514 A 45 ILE HB A 71 GLN HE21 1.0 . 6.00 577 515 A 54 SER H A 52 ALA H 1.0 . 5.56 578 516 A 41 MET H A 41 MET HG3 1.0 . 3.87 579 517 A 47 ASP H A 44 PRO HG2 1.0 . 4.73 580 518 A 61 ASP H A 21 PHE HA 1.0 . 5.44 581 519 A 68 GLY H A 71 GLN HB2 1.0 . 4.71 582 520 A 45 ILE HG2% A 71 GLN HE21 1.0 . 4.99 583 521 A 111 ARG H A 110 SER HBx 1.0 . 5.13 584 521 A 110 SER HBy A 111 ARG H 1.0 . 5.13 585 522 A 87 VAL HG1% A 80 ARG H 1.0 . 5.50 586 523 A 59 SER H A 57 GLU HBy 1.0 . 4.30 587 524 A 73 SER H A 70 GLU HA 1.0 . 4.45 588 525 A 98 LYS H A 94 LEU HA 1.0 . 4.82 589 526 A 27 ARG HE A 27 ARG HG2 1.0 . 3.83 590 526 A 27 ARG HG3 A 27 ARG HE 1.0 . 3.83 591 527 A 63 TYR H A 24 LEU H 1.0 . 5.30 592 528 A 97 TRP HE1 A 104 THR H 1.0 . 5.89 593 529 A 57 GLU H A 57 GLU HBy 1.0 . 3.76 594 530 A 51 ARG H A 51 ARG HBx 1.0 . 3.78 595 531 A 100 ILE H A 100 ILE HG1y 1.0 . 4.00 596 532 A 43 MET H A 44 PRO HD3 1.0 . 6.00 597 533 A 18 GLU H A 19 PRO HD2 1.0 . 5.50 598 534 A 18 GLU H A 13 ARG HA 1.0 . 5.50 599 535 A 116 ALA H A 115 GLY HAx 1.0 . 3.55 600 535 A 115 GLY HAy A 116 ALA H 1.0 . 3.55 601 536 A 38 MET H A 40 ALA H 1.0 . 5.57 602 537 A 30 SER H A 31 THR H 1.0 . 3.62 603 538 A 39 GLY H A 36 HIS HD2 1.0 . 4.71 604 539 A 79 LEU H A 78 LEU H 1.0 . 3.66 605 540 A 75 ALA HB% A 76 VAL H 1.0 . 4.32 606 541 A 32 TYR H A 27 ARG HBy 1.0 . 6.00 607 541 A 32 TYR H A 27 ARG HBx 1.0 . 6.00 608 542 A 120 ASN H A 120 ASN HBx 1.0 . 3.67 609 542 A 120 ASN H A 120 ASN HBy 1.0 . 3.67 610 543 A 76 VAL H A 76 VAL HG1% 1.0 . 4.41 611 544 A 10 LEU H A 10 LEU HD1% 1.0 . 6.00 612 545 A 111 ARG H A 111 ARG HG2 1.0 . 3.72 613 545 A 111 ARG HG3 A 111 ARG H 1.0 . 3.72 614 546 A 63 TYR HE% A 22 THR H 1.0 . 6.00 615 547 A 78 LEU H A 77 ASN HBy 1.0 . 4.41 616 548 A 39 GLY H A 40 ALA H 1.0 . 3.71 617 549 A 12 SER H A 13 ARG HG2 1.0 . 6.00 618 550 A 41 MET H A 40 ALA H 1.0 . 5.34 619 551 A 49 VAL H A 50 ASP HBx 1.0 . 5.53 620 551 A 49 VAL H A 50 ASP HBy 1.0 . 5.53 621 552 A 11 LYS HD2 A 12 SER H 1.0 . 5.50 622 553 A 12 SER H A 11 LYS HG3 1.0 . 5.50 623 554 A 10 LEU HD1% A 14 LEU H 1.0 . 6.00 624 555 A 12 SER H A 11 LYS HB2 1.0 . 4.20 625 556 A 6 ASP H A 7 ALA H 1.0 . 5.24 626 557 A 119 TYR H A 118 ASP HBy 1.0 . 4.58 627 558 A 115 GLY H A 116 ALA H 1.0 . 4.15 628 559 A 66 GLY H A 64 VAL HG1% 1.0 . 6.00 629 560 A 53 SER H A 84 PHE HE% 1.0 . 5.27 630 561 A 41 MET H A 41 MET HG2 1.0 . 4.24 631 562 A 83 GLY H A 82 ALA HB% 1.0 . 4.61 632 563 A 80 ARG H A 80 ARG HD3 1.0 . 5.28 633 563 A 80 ARG H A 80 ARG HD2 1.0 . 5.28 634 564 A 26 VAL H A 66 GLY HA2 1.0 . 4.50 635 565 A 67 ALA HB% A 71 GLN HE21 1.0 . 5.50 636 566 A 56 LEU H A 53 SER HA 1.0 . 5.70 637 567 A 64 VAL H A 64 VAL HB 1.0 . 3.67 638 568 A 81 SER H A 79 LEU H 1.0 . 4.80 639 569 A 31 THR H A 32 TYR HBx 1.0 . 5.00 640 569 A 31 THR H A 32 TYR HBy 1.0 . 5.00 641 570 A 31 THR H A 32 TYR H 1.0 . 3.63 642 571 A 105 GLU HG3 A 106 GLY H 1.0 . 4.55 643 572 A 124 ARG H A 123 SER HBy 1.0 . 6.00 644 572 A 123 SER HBx A 124 ARG H 1.0 . 6.00 645 573 A 4 GLN HB3 A 4 GLN HE21 1.0 . 5.84 646 574 A 72 THR HG2% A 69 ASP H 1.0 . 6.00 647 575 A 86 HIS H A 85 GLU H 1.0 . 4.01 648 576 A 11 LYS H A 11 LYS HB2 1.0 . 3.34 649 577 A 51 ARG H A 52 ALA H 1.0 . 3.47 650 578 A 71 GLN HE22 A 45 ILE HD1% 1.0 . 6.00 651 579 A 99 ALA H A 99 ALA HB% 1.0 . 3.42 652 580 A 107 ILE H A 33 ASN HA 1.0 . 5.79 653 581 A 110 SER H A 109 GLU HBy 1.0 . 4.73 654 582 A 94 LEU H A 94 LEU HB3 1.0 . 3.61 655 583 A 68 GLY H A 72 THR H 1.0 . 4.90 656 584 A 15 GLU H A 12 SER HA 1.0 . 5.39 657 585 A 89 GLU H A 88 SER HBx 1.0 . 5.63 658 586 A 20 ALA H A 20 ALA HB% 1.0 . 4.02 659 587 A 10 LEU H A 8 HIS H 1.0 . 5.50 660 588 A 85 GLU H A 85 GLU HB2 1.0 . 3.52 661 589 A 43 MET H A 44 PRO HD2 1.0 . 5.09 662 590 A 82 ALA H A 87 VAL HG2% 1.0 . 6.00 663 591 A 8 HIS H A 8 HIS HBy 1.0 . 4.06 664 592 A 57 GLU H A 84 PHE HE% 1.0 . 5.91 665 593 A 82 ALA H A 80 ARG H 1.0 . 5.16 666 594 A 60 ARG H A 61 ASP H 1.0 . 5.50 667 595 A 57 GLU H A 60 ARG H 1.0 . 5.50 668 596 A 60 ARG H A 58 LYS H 1.0 . 5.50 669 597 A 34 ASP H A 30 SER H 1.0 . 5.89 670 598 A 29 ARG H A 29 ARG HB3 1.0 . 3.30 671 598 A 29 ARG HB2 A 29 ARG H 1.0 . 3.30 672 599 A 16 TRP HB3 A 16 TRP H 1.0 . 4.09 673 600 A 34 ASP H A 32 TYR HA 1.0 . 4.58 674 601 A 80 ARG H A 76 VAL HA 1.0 . 5.74 675 602 A 45 ILE H A 46 GLU H 1.0 . 4.43 676 603 A 106 GLY H A 105 GLU HB2 1.0 . 4.09 677 604 A 17 GLY H A 16 TRP HB2 1.0 . 4.83 678 605 A 38 MET H A 38 MET HBx 1.0 . 3.90 679 606 A 74 GLN H A 74 GLN HBx 1.0 . 3.62 680 607 A 29 ARG H A 28 ASP H 1.0 . 4.47 681 608 A 47 ASP H A 44 PRO HB2 1.0 . 3.96 682 609 A 47 ASP H A 48 LEU HBx 1.0 . 4.87 683 609 A 47 ASP H A 48 LEU HBy 1.0 . 4.87 684 610 A 95 ALA H A 96 ALA H 1.0 . 3.62 685 611 A 71 GLN HE22 A 27 ARG HA 1.0 . 5.08 686 612 A 17 GLY H A 15 GLU HB2 1.0 . 5.94 687 613 A 60 ARG H A 60 ARG HGx 1.0 . 4.46 688 613 A 60 ARG H A 60 ARG HGy 1.0 . 4.46 689 614 A 110 SER H A 110 SER HBx 1.0 . 3.63 690 614 A 110 SER HBy A 110 SER H 1.0 . 3.63 691 615 A 51 ARG H A 50 ASP HBx 1.0 . 3.41 692 615 A 51 ARG H A 50 ASP HBy 1.0 . 3.41 693 616 A 35 GLY H A 31 THR HG2% 1.0 . 6.00 694 617 A 121 VAL H A 121 VAL HGx% 1.0 . 4.21 695 617 A 121 VAL H A 121 VAL HGy% 1.0 . 4.21 696 618 A 52 ALA HB% A 52 ALA H 1.0 . 3.83 697 619 A 59 SER H A 58 LYS HG2 1.0 . 6.00 698 620 A 66 GLY H A 65 TYR H 1.0 . 4.92 699 621 A 20 ALA H A 19 PRO HBx 1.0 . 4.46 700 621 A 20 ALA H A 19 PRO HBy 1.0 . 4.46 701 622 A 96 ALA H A 92 GLY HAy 1.0 . 5.76 702 623 A 24 LEU H A 63 TYR HB2 1.0 . 5.91 703 624 A 66 GLY H A 65 TYR HBx 1.0 . 3.74 704 624 A 66 GLY H A 65 TYR HBy 1.0 . 3.74 705 625 A 72 THR H A 71 GLN HB3 1.0 . 4.04 706 626 A 49 VAL H A 48 LEU H 1.0 . 3.84 707 627 A 27 ARG HD2 A 67 ALA HB% 1.0 . 4.76 708 628 A 57 GLU H A 56 LEU HD1% 1.0 . 6.00 709 629 A 7 ALA HB% A 97 TRP HB2 1.0 . 6.00 710 630 A 64 VAL HG1% A 72 THR HA 1.0 . 5.01 711 631 A 82 ALA HA A 83 GLY HA3 1.0 . 5.15 712 632 A 11 LYS HA A 14 LEU HBy 1.0 . 4.56 713 633 A 48 LEU HD1% A 48 LEU HBx 1.0 . 4.11 714 633 A 48 LEU HD1% A 48 LEU HBy 1.0 . 4.11 715 634 A 84 PHE HB3 A 87 VAL HG2% 1.0 . 4.07 716 635 A 49 VAL HG1% A 50 ASP HA 1.0 . 5.21 717 636 A 40 ALA H A 23 ILE HB 1.0 . 6.00 718 637 A 32 TYR H A 31 THR HG2% 1.0 . 5.48 719 638 A 56 LEU H A 43 MET HE% 1.0 . 5.67 720 639 A 98 LYS H A 98 LYS HG3 1.0 . 4.09 721 640 A 6 ASP HA A 91 LYS HB3 1.0 . 4.10 722 641 A 14 LEU H A 13 ARG HBx 1.0 . 4.72 723 641 A 13 ARG HBy A 14 LEU H 1.0 . 4.72 724 642 A 4 GLN HG3 A 91 LYS HG2 1.0 . 4.88 725 642 A 4 GLN HG2 A 91 LYS HG2 1.0 . 4.88 726 642 A 91 LYS HG3 A 4 GLN HG2 1.0 . 4.88 727 642 A 4 GLN HG3 A 91 LYS HG3 1.0 . 4.88 728 643 A 108 ILE HG2% A 109 GLU HG3 1.0 . 5.50 729 644 A 94 LEU HD2% A 109 GLU HG3 1.0 . 5.50 730 645 A 13 ARG H A 10 LEU HG 1.0 . 6.00 731 646 A 109 GLU H A 108 ILE HG1x 1.0 . 6.00 732 647 A 64 VAL HG2% A 76 VAL HB 1.0 . 5.50 733 648 A 87 VAL HA A 64 VAL HG2% 1.0 . 6.00 734 649 A 34 ASP H A 31 THR HA 1.0 . 4.01 735 650 A 107 ILE HD1% A 33 ASN HB3 1.0 . 4.80 736 651 A 19 PRO HD2 A 18 GLU HG3 1.0 . 4.64 737 652 A 2 GLU HG3 A 3 PRO HD2 1.0 . 4.67 738 652 A 3 PRO HD3 A 2 GLU HG3 1.0 . 4.67 739 653 A 64 VAL HG1% A 75 ALA HA 1.0 . 6.00 740 654 A 38 MET HA A 105 GLU HA 1.0 . 5.21 741 655 A 23 ILE HD1% A 23 ILE HB 1.0 . 4.03 742 656 A 1 MET HE% A 86 HIS HBx 1.0 . 4.83 743 656 A 1 MET HE% A 86 HIS HBy 1.0 . 4.83 744 657 A 97 TRP H A 94 LEU HA 1.0 . 4.09 745 658 A 48 LEU HD2% A 48 LEU HA 1.0 . 5.74 746 659 A 42 ALA HB% A 41 MET HA 1.0 . 4.88 747 660 A 81 SER HBx A 82 ALA HB% 1.0 . 6.00 748 661 A 98 LYS HA A 98 LYS HG2 1.0 . 3.56 749 662 A 23 ILE HG2% A 63 TYR HB3 1.0 . 5.50 750 663 A 56 LEU HD2% A 60 ARG HD2 1.0 . 6.00 751 664 A 58 LYS H A 58 LYS HG3 1.0 . 4.12 752 665 A 46 GLU H A 44 PRO HB3 1.0 . 4.72 753 666 A 84 PHE HE% A 79 LEU HG 1.0 . 5.50 754 667 A 84 PHE HE% A 56 LEU HG 1.0 . 5.50 755 668 A 7 ALA HB% A 100 ILE HG1x 1.0 . 6.00 756 669 A 94 LEU HD1% A 94 LEU HB2 1.0 . 4.19 757 670 A 22 THR H A 62 ILE HD1% 1.0 . 6.00 758 671 A 78 LEU HB3 A 48 LEU HBx 1.0 . 5.50 759 671 A 78 LEU HB3 A 48 LEU HBy 1.0 . 5.50 760 672 A 82 ALA HB% A 78 LEU HB3 1.0 . 5.50 761 673 A 76 VAL HG2% A 76 VAL HA 1.0 . 3.93 762 674 A 90 LEU HD2% A 65 TYR HD2 1.0 . 5.50 763 675 A 38 MET HA A 37 ILE HG2% 1.0 . 6.00 764 676 A 58 LYS HB2 A 84 PHE HA 1.0 . 4.54 765 677 A 60 ARG HD3 A 20 ALA HB% 1.0 . 6.00 766 678 A 91 LYS H A 90 LEU HD2% 1.0 . 5.50 767 679 A 114 ALA HB% A 113 PRO HD3 1.0 . 6.00 768 680 A 81 SER H A 78 LEU HA 1.0 . 4.53 769 681 A 109 GLU H A 109 GLU HG2 1.0 . 4.12 770 682 A 25 ASP HA A 40 ALA HB% 1.0 . 6.00 771 683 A 84 PHE HB3 A 87 VAL HG1% 1.0 . 6.00 772 684 A 98 LYS H A 96 ALA HA 1.0 . 5.23 773 685 A 67 ALA HA A 27 ARG HBy 1.0 . 5.35 774 685 A 27 ARG HBx A 67 ALA HA 1.0 . 5.35 775 686 A 71 GLN HB3 A 67 ALA HA 1.0 . 5.50 776 687 A 76 VAL H A 26 VAL HB 1.0 . 6.00 777 688 A 94 LEU HD2% A 95 ALA H 1.0 . 5.97 778 689 A 62 ILE HG2% A 63 TYR HA 1.0 . 5.50 779 690 A 62 ILE HG2% A 23 ILE HA 1.0 . 5.50 780 691 A 74 GLN H A 70 GLU HGx 1.0 . 6.00 781 691 A 74 GLN H A 70 GLU HGy 1.0 . 6.00 782 692 A 108 ILE HA A 108 ILE HG1y 1.0 . 4.11 783 693 A 58 LYS HD3 A 84 PHE HA 1.0 . 5.07 784 694 A 84 PHE HB2 A 79 LEU HD1% 1.0 . 6.00 785 695 A 37 ILE HA A 104 THR HG2% 1.0 . 4.37 786 696 A 23 ILE HD1% A 63 TYR HB2 1.0 . 6.00 787 697 A 93 GLY HA3 A 65 TYR HBx 1.0 . 4.61 788 697 A 93 GLY HA3 A 65 TYR HBy 1.0 . 4.61 789 698 A 94 LEU HD1% A 27 ARG HH2x 1.0 . 5.50 790 699 A 4 GLN HE21 A 91 LYS HG2 1.0 . 4.94 791 699 A 4 GLN HE21 A 91 LYS HG3 1.0 . 4.94 792 700 A 39 GLY H A 40 ALA HB% 1.0 . 6.00 793 701 A 79 LEU H A 78 LEU HB2 1.0 . 3.71 794 702 A 79 LEU H A 78 LEU HG 1.0 . 6.00 795 703 A 41 MET HA A 41 MET HE% 1.0 . 5.50 796 704 A 41 MET HG3 A 43 MET HE% 1.0 . 5.71 797 705 A 10 LEU H A 9 VAL HG1% 1.0 . 5.36 798 706 A 96 ALA HB% A 92 GLY HAy 1.0 . 4.11 799 707 A 2 GLU HA A 3 PRO HD2 1.0 . 2.93 800 707 A 3 PRO HD3 A 2 GLU HA 1.0 . 2.93 801 708 A 37 ILE HD1% A 36 HIS HA 1.0 . 6.00 802 709 A 15 GLU HB2 A 16 TRP H 1.0 . 4.04 803 710 A 11 LYS H A 10 LEU HB2 1.0 . 5.27 804 711 A 59 SER H A 58 LYS HB2 1.0 . 4.28 805 712 A 96 ALA HB% A 7 ALA H 1.0 . 6.00 806 713 A 63 TYR HA A 88 SER HBx 1.0 . 6.00 807 714 A 43 MET HG3 A 51 ARG HD2 1.0 . 5.55 808 715 A 48 LEU HA A 49 VAL HA 1.0 . 5.38 809 716 A 45 ILE HD1% A 45 ILE HB 1.0 . 4.03 810 717 A 107 ILE HD1% A 106 GLY HAx 1.0 . 6.00 811 717 A 107 ILE HD1% A 106 GLY HAy 1.0 . 6.00 812 718 A 29 ARG H A 42 ALA HB% 1.0 . 6.00 813 719 A 88 SER H A 76 VAL HG2% 1.0 . 6.00 814 720 A 77 ASN HA A 80 ARG HBx 1.0 . 4.82 815 720 A 77 ASN HA A 80 ARG HBy 1.0 . 4.82 816 721 A 10 LEU HD2% A 10 LEU HA 1.0 . 5.76 817 722 A 97 TRP HH2 A 11 LYS HA 1.0 . 3.77 818 723 A 34 ASP HA A 108 ILE HG2% 1.0 . 6.00 819 724 A 9 VAL HA A 13 ARG H 1.0 . 4.64 820 725 A 49 VAL H A 49 VAL HG1% 1.0 . 5.36 821 726 A 4 GLN HE22 A 91 LYS HD2 1.0 . 5.52 822 726 A 4 GLN HE22 A 91 LYS HD3 1.0 . 5.52 823 727 A 33 ASN HB3 A 107 ILE HG1x 1.0 . 6.00 824 728 A 38 MET HA A 105 GLU HB2 1.0 . 4.91 825 729 A 48 LEU HD2% A 79 LEU HA 1.0 . 6.00 826 730 A 71 GLN HA A 71 GLN HE21 1.0 . 5.34 827 731 A 24 LEU HA A 24 LEU HD2% 1.0 . 3.98 828 732 A 79 LEU HD2% A 48 LEU HG 1.0 . 4.06 829 733 A 86 HIS H A 84 PHE HA 1.0 . 5.20 830 734 A 15 GLU HG3 A 14 LEU HDx% 1.0 . 5.39 831 734 A 14 LEU HDy% A 15 GLU HG3 1.0 . 5.39 832 735 A 79 LEU HB3 A 76 VAL HA 1.0 . 5.20 833 736 A 27 ARG HD2 A 35 GLY H 1.0 . 6.00 834 737 A 10 LEU HD2% A 7 ALA HA 1.0 . 6.00 835 738 A 43 MET H A 24 LEU HD2% 1.0 . 5.50 836 739 A 94 LEU HD1% A 27 ARG HH2y 1.0 . 5.50 837 740 A 80 ARG HG3 A 81 SER HA 1.0 . 5.64 838 741 A 48 LEU HD1% A 43 MET HBx 1.0 . 3.59 839 741 A 43 MET HBy A 48 LEU HD1% 1.0 . 3.59 840 742 A 38 MET HE% A 104 THR H 1.0 . 5.50 841 743 A 94 LEU HD2% A 35 GLY HAx 1.0 . 5.50 842 743 A 94 LEU HD2% A 35 GLY HAy 1.0 . 5.50 843 744 A 25 ASP H A 42 ALA HB% 1.0 . 5.74 844 745 A 96 ALA H A 92 GLY HAx 1.0 . 5.76 845 746 A 87 VAL HG2% A 79 LEU HB3 1.0 . 4.12 846 747 A 76 VAL HG1% A 80 ARG HG2 1.0 . 5.50 847 748 A 4 GLN HE21 A 4 GLN HG2 1.0 . 3.53 848 748 A 4 GLN HG3 A 4 GLN HE21 1.0 . 3.53 849 749 A 29 ARG HA A 44 PRO HG2 1.0 . 6.00 850 750 A 26 VAL HG2% A 27 ARG HG2 1.0 . 4.89 851 750 A 27 ARG HG3 A 26 VAL HG2% 1.0 . 4.89 852 751 A 4 GLN HB2 A 91 LYS HD2 1.0 . 4.54 853 751 A 4 GLN HB2 A 91 LYS HD3 1.0 . 4.54 854 752 A 41 MET HG2 A 56 LEU HD2% 1.0 . 6.00 855 753 A 10 LEU H A 9 VAL HB 1.0 . 3.91 856 754 A 79 LEU HG A 78 LEU HB2 1.0 . 6.00 857 755 A 31 THR HA A 34 ASP HBx 1.0 . 4.21 858 756 A 10 LEU HB2 A 5 SER HBx 1.0 . 5.50 859 756 A 5 SER HBy A 10 LEU HB2 1.0 . 5.50 860 757 A 100 ILE HD1% A 7 ALA HB% 1.0 . 4.72 861 758 A 88 SER H A 64 VAL HB 1.0 . 6.00 862 759 A 79 LEU HD2% A 78 LEU HB2 1.0 . 5.50 863 760 A 65 TYR HA A 90 LEU HB2 1.0 . 5.87 864 761 A 62 ILE HD1% A 56 LEU HBy 1.0 . 5.50 865 762 A 92 GLY H A 91 LYS HB2 1.0 . 4.88 866 763 A 40 ALA HB% A 36 HIS HB2 1.0 . 4.99 867 764 A 37 ILE HG2% A 37 ILE HD1% 1.0 . 4.67 868 765 A 22 THR HB A 24 LEU HD2% 1.0 . 6.00 869 766 A 90 LEU HD2% A 90 LEU HA 1.0 . 5.80 870 767 A 30 SER HBy A 28 ASP HBy 1.0 . 5.50 871 767 A 28 ASP HBy A 30 SER HBx 1.0 . 5.50 872 768 A 11 LYS HA A 11 LYS HEy 1.0 . 5.50 873 769 A 49 VAL HG2% A 48 LEU HA 1.0 . 6.00 874 770 A 123 SER H A 122 VAL HA 1.0 . 3.44 875 771 A 38 MET HA A 104 THR HA 1.0 . 5.50 876 772 A 86 HIS HA A 85 GLU HA 1.0 . 5.50 877 773 A 64 VAL HG1% A 65 TYR HA 1.0 . 5.08 878 774 A 31 THR HG2% A 32 TYR HA 1.0 . 5.50 879 775 A 11 LYS HA A 14 LEU HG 1.0 . 5.19 880 776 A 97 TRP HZ3 A 10 LEU HB2 1.0 . 4.48 881 777 A 4 GLN H A 3 PRO HG3 1.0 . 5.07 882 778 A 23 ILE HD1% A 63 TYR HB3 1.0 . 6.00 883 779 A 10 LEU HD2% A 90 LEU HD1% 1.0 . 5.09 884 780 A 4 GLN HA A 4 GLN HG2 1.0 . 3.73 885 780 A 4 GLN HG3 A 4 GLN HA 1.0 . 3.73 886 781 A 75 ALA HA A 74 GLN HG3 1.0 . 6.00 887 782 A 103 PRO HDy A 11 LYS HEy 1.0 . 4.93 888 782 A 11 LYS HEy A 103 PRO HDx 1.0 . 4.93 889 783 A 60 ARG H A 57 GLU HBy 1.0 . 5.32 890 784 A 26 VAL HG2% A 45 ILE HD1% 1.0 . 4.94 891 785 A 79 LEU HD1% A 48 LEU HG 1.0 . 6.00 892 786 A 60 ARG H A 57 GLU HG3 1.0 . 5.82 893 787 A 61 ASP HA A 62 ILE HG1x 1.0 . 6.00 894 788 A 31 THR HB A 28 ASP HBx 1.0 . 5.50 895 789 A 87 VAL HG1% A 87 VAL H 1.0 . 5.50 896 790 A 47 ASP H A 48 LEU HA 1.0 . 4.91 897 791 A 40 ALA HB% A 36 HIS HB3 1.0 . 5.50 898 792 A 94 LEU H A 94 LEU HG 1.0 . 5.50 899 793 A 10 LEU H A 9 VAL HG2% 1.0 . 5.23 900 794 A 76 VAL HG2% A 79 LEU HD1% 1.0 . 6.00 901 795 A 90 LEU HD2% A 37 ILE HD1% 1.0 . 4.85 902 796 A 84 PHE HD% A 56 LEU HD2% 1.0 . 5.50 903 797 A 55 SER H A 56 LEU HD2% 1.0 . 5.50 904 798 A 90 LEU HD1% A 63 TYR HB2 1.0 . 5.50 905 799 A 24 LEU HD1% A 41 MET HBx 1.0 . 5.93 906 799 A 41 MET HBy A 24 LEU HD1% 1.0 . 5.93 907 800 A 81 SER H A 82 ALA HB% 1.0 . 5.64 908 801 A 43 MET HE% A 24 LEU HD1% 1.0 . 5.50 909 802 A 8 HIS HA A 11 LYS HB3 1.0 . 5.02 910 803 A 9 VAL HA A 9 VAL HG1% 1.0 . 3.95 911 804 A 58 LYS HG3 A 58 LYS HEx 1.0 . 3.54 912 804 A 58 LYS HEy A 58 LYS HG3 1.0 . 3.54 913 805 A 78 LEU HD2% A 74 GLN HG3 1.0 . 5.50 914 806 A 61 ASP H A 60 ARG HA 1.0 . 3.08 915 807 A 2 GLU HG2 A 3 PRO HD2 1.0 . 4.18 916 807 A 2 GLU HG2 A 3 PRO HD3 1.0 . 4.18 917 808 A 49 VAL HG2% A 50 ASP HA 1.0 . 6.00 918 809 A 49 VAL H A 49 VAL HB 1.0 . 3.10 919 810 A 52 ALA H A 51 ARG HG2 1.0 . 4.68 920 810 A 51 ARG HG3 A 52 ALA H 1.0 . 4.68 921 811 A 1 MET HE% A 1 MET HBx 1.0 . 5.14 922 811 A 1 MET HBy A 1 MET HE% 1.0 . 5.14 923 812 A 68 GLY H A 71 GLN HB3 1.0 . 3.99 924 813 A 56 LEU HD1% A 55 SER HBx 1.0 . 6.00 925 814 A 27 ARG H A 26 VAL HB 1.0 . 4.92 926 815 A 80 ARG H A 79 LEU HD1% 1.0 . 6.00 927 816 A 80 ARG HG3 A 87 VAL HG2% 1.0 . 6.00 928 817 A 62 ILE HD1% A 60 ARG HBx 1.0 . 5.50 929 818 A 84 PHE HD% A 56 LEU HBy 1.0 . 5.50 930 819 A 66 GLY H A 72 THR HG2% 1.0 . 4.21 931 820 A 72 THR HG2% A 89 GLU HBx 1.0 . 3.58 932 820 A 72 THR HG2% A 89 GLU HBy 1.0 . 3.58 933 821 A 124 ARG HBx A 122 VAL HGx% 1.0 . 6.00 934 821 A 122 VAL HGy% A 124 ARG HBx 1.0 . 6.00 935 822 A 11 LYS H A 90 LEU HD1% 1.0 . 5.50 936 823 A 64 VAL H A 90 LEU HD1% 1.0 . 5.50 937 824 A 90 LEU HD1% A 8 HIS H 1.0 . 5.50 938 825 A 22 THR HG2% A 60 ARG HGx 1.0 . 5.50 939 825 A 22 THR HG2% A 60 ARG HGy 1.0 . 5.50 940 826 A 22 THR HG2% A 43 MET HE% 1.0 . 5.50 941 827 A 87 VAL HG1% A 84 PHE HB2 1.0 . 6.00 942 828 A 79 LEU HD1% A 76 VAL HA 1.0 . 4.79 943 829 A 63 TYR HB2 A 23 ILE HG1x 1.0 . 5.87 944 830 A 98 LYS HA A 98 LYS HD3 1.0 . 6.00 945 831 A 9 VAL H A 9 VAL HG1% 1.0 . 5.29 946 832 A 14 LEU HG A 21 PHE HZ 1.0 . 4.14 947 833 A 103 PRO HB3 A 97 TRP HZ2 1.0 . 6.00 948 834 A 26 VAL HG1% A 71 GLN HG3 1.0 . 6.00 949 835 A 112 THR HG2% A 113 PRO HD2 1.0 . 5.75 950 836 A 42 ALA HB% A 44 PRO HG2 1.0 . 6.00 951 837 A 79 LEU HD2% A 87 VAL HG1% 1.0 . 6.00 952 838 A 56 LEU H A 56 LEU HD2% 1.0 . 5.65 953 839 A 67 ALA H A 71 GLN HB3 1.0 . 4.14 954 840 A 37 ILE HD1% A 97 TRP HE3 1.0 . 5.84 955 841 A 120 ASN HBy A 121 VAL H 1.0 . 5.14 956 842 A 52 ALA HB% A 49 VAL HA 1.0 . 4.59 957 843 A 94 LEU HD1% A 97 TRP HB3 1.0 . 5.00 958 844 A 100 ILE HD1% A 97 TRP H 1.0 . 6.00 959 845 A 15 GLU H A 14 LEU HBy 1.0 . 4.48 960 846 A 78 LEU HA A 78 LEU HD1% 1.0 . 5.13 961 847 A 52 ALA HB% A 48 LEU HA 1.0 . 6.00 962 848 A 98 LYS HA A 98 LYS HEy 1.0 . 5.43 963 849 A 116 ALA HB% A 117 ASP HA 1.0 . 6.00 964 850 A 78 LEU HB2 A 78 LEU HD1% 1.0 . 3.80 965 851 A 72 THR HG2% A 69 ASP HA 1.0 . 5.55 966 852 A 105 GLU HA A 106 GLY HAx 1.0 . 4.12 967 852 A 106 GLY HAy A 105 GLU HA 1.0 . 4.12 968 853 A 91 LYS HB3 A 91 LYS HEx 1.0 . 3.70 969 853 A 91 LYS HB3 A 91 LYS HEy 1.0 . 3.70 970 854 A 108 ILE HA A 111 ARG HG2 1.0 . 6.00 971 854 A 111 ARG HG3 A 108 ILE HA 1.0 . 6.00 972 855 A 76 VAL HB A 77 ASN HBx 1.0 . 5.50 973 856 A 36 HIS HB3 A 32 TYR HA 1.0 . 4.19 974 857 A 76 VAL HG1% A 88 SER HA 1.0 . 6.00 975 858 A 97 TRP HZ2 A 38 MET HG2 1.0 . 6.00 976 858 A 97 TRP HZ2 A 38 MET HG3 1.0 . 6.00 977 859 A 24 LEU H A 23 ILE HB 1.0 . 6.00 978 860 A 26 VAL HG1% A 43 MET HBx 1.0 . 5.08 979 860 A 43 MET HBy A 26 VAL HG1% 1.0 . 5.08 980 861 A 24 LEU HB2 A 26 VAL HG1% 1.0 . 5.49 981 862 A 41 MET HG2 A 43 MET HE% 1.0 . 5.51 982 863 A 5 SER H A 91 LYS HG2 1.0 . 5.53 983 863 A 5 SER H A 91 LYS HG3 1.0 . 5.53 984 864 A 79 LEU H A 79 LEU HB2 1.0 . 3.39 985 865 A 47 ASP HB3 A 48 LEU HA 1.0 . 6.00 986 866 A 125 LEU H A 124 ARG HA 1.0 . 3.48 987 867 A 87 VAL HG1% A 76 VAL HB 1.0 . 5.73 988 868 A 100 ILE HD1% A 100 ILE HG2% 1.0 . 4.47 989 869 A 94 LEU HA A 94 LEU HG 1.0 . 4.20 990 870 A 94 LEU HD1% A 65 TYR HD2 1.0 . 6.00 991 871 A 43 MET HE% A 43 MET HA 1.0 . 5.45 992 872 A 32 TYR HD% A 33 ASN HA 1.0 . 4.90 993 873 A 79 LEU H A 49 VAL HG2% 1.0 . 6.00 994 874 A 51 ARG H A 51 ARG HBy 1.0 . 3.78 995 875 A 40 ALA HB% A 41 MET HG3 1.0 . 5.50 996 876 A 24 LEU HG A 41 MET HG3 1.0 . 5.50 997 877 A 56 LEU HA A 56 LEU HD2% 1.0 . 3.97 998 878 A 44 PRO HD3 A 43 MET HBx 1.0 . 5.48 999 878 A 43 MET HBy A 44 PRO HD3 1.0 . 5.48 1000 879 A 56 LEU H A 55 SER HBx 1.0 . 4.84 1001 880 A 10 LEU HD2% A 37 ILE HD1% 1.0 . 6.00 1002 881 A 124 ARG H A 124 ARG HG2 1.0 . 4.65 1003 881 A 124 ARG H A 124 ARG HG3 1.0 . 4.65 1004 882 A 45 ILE HB A 26 VAL HG1% 1.0 . 5.93 1005 883 A 14 LEU HA A 14 LEU HDx% 1.0 . 3.84 1006 883 A 14 LEU HDy% A 14 LEU HA 1.0 . 3.84 1007 884 A 75 ALA HA A 79 LEU HD1% 1.0 . 6.00 1008 885 A 41 MET H A 23 ILE HG2% 1.0 . 5.50 1009 886 A 23 ILE H A 23 ILE HG2% 1.0 . 5.50 1010 887 A 24 LEU H A 64 VAL HG2% 1.0 . 6.00 1011 888 A 23 ILE H A 23 ILE HG1x 1.0 . 4.70 1012 889 A 51 ARG HA A 51 ARG HD3 1.0 . 3.88 1013 890 A 124 ARG HA A 124 ARG HG2 1.0 . 3.58 1014 890 A 124 ARG HA A 124 ARG HG3 1.0 . 3.58 1015 891 A 72 THR H A 71 GLN HG3 1.0 . 6.00 1016 892 A 43 MET HE% A 51 ARG HD3 1.0 . 5.70 1017 892 A 43 MET HE% A 51 ARG HD2 1.0 . 5.70 1018 893 A 79 LEU HD2% A 48 LEU HA 1.0 . 6.00 1019 894 A 67 ALA H A 71 GLN HG3 1.0 . 5.85 1020 895 A 43 MET HE% A 51 ARG HA 1.0 . 5.51 1021 896 A 98 LYS H A 96 ALA HB% 1.0 . 6.00 1022 897 A 49 VAL HA A 48 LEU HBx 1.0 . 5.34 1023 897 A 48 LEU HBy A 49 VAL HA 1.0 . 5.34 1024 898 A 82 ALA HB% A 49 VAL HA 1.0 . 5.50 1025 899 A 57 GLU HG2 A 58 LYS H 1.0 . 3.79 1026 900 A 48 LEU H A 48 LEU HG 1.0 . 5.21 1027 901 A 95 ALA H A 94 LEU HB3 1.0 . 3.77 1028 902 A 97 TRP HZ3 A 11 LYS HA 1.0 . 4.73 1029 903 A 94 LEU HD1% A 104 THR HG2% 1.0 . 4.16 1030 904 A 48 LEU HD2% A 26 VAL HA 1.0 . 6.00 1031 905 A 30 SER HA A 30 SER HBx 1.0 . 2.63 1032 905 A 30 SER HA A 30 SER HBy 1.0 . 2.63 1033 906 A 126 GLU H A 126 GLU HG3 1.0 . 6.00 1034 907 A 122 VAL HGx% A 124 ARG HBy 1.0 . 6.00 1035 907 A 122 VAL HGy% A 124 ARG HBy 1.0 . 6.00 1036 908 A 80 ARG HA A 79 LEU HB3 1.0 . 5.50 1037 909 A 4 GLN HG2 A 91 LYS HD2 1.0 . 5.14 1038 909 A 4 GLN HG3 A 91 LYS HD2 1.0 . 5.14 1039 909 A 91 LYS HD3 A 4 GLN HG2 1.0 . 5.14 1040 909 A 4 GLN HG3 A 91 LYS HD3 1.0 . 5.14 1041 910 A 83 GLY H A 58 LYS HEx 1.0 . 6.00 1042 910 A 83 GLY H A 58 LYS HEy 1.0 . 6.00 1043 911 A 38 MET HE% A 104 THR HA 1.0 . 6.00 1044 912 A 32 TYR HD% A 40 ALA HB% 1.0 . 6.00 1045 913 A 22 THR HB A 21 PHE HA 1.0 . 5.64 1046 914 A 79 LEU HD1% A 64 VAL HB 1.0 . 6.00 1047 915 A 45 ILE HD1% A 46 GLU H 1.0 . 6.00 1048 916 A 10 LEU HD1% A 14 LEU HDx% 1.0 . 6.00 1049 916 A 10 LEU HD1% A 14 LEU HDy% 1.0 . 6.00 1050 917 A 52 ALA HA A 56 LEU HD1% 1.0 . 4.26 1051 918 A 97 TRP HA A 37 ILE HD1% 1.0 . 6.00 1052 919 A 10 LEU HB3 A 7 ALA HA 1.0 . 4.80 1053 920 A 38 MET H A 37 ILE HG2% 1.0 . 4.79 1054 921 A 90 LEU HB3 A 65 TYR HA 1.0 . 5.05 1055 922 A 34 ASP HA A 108 ILE HD1% 1.0 . 6.00 1056 923 A 64 VAL HA A 24 LEU HB3 1.0 . 5.16 1057 924 A 45 ILE HA A 45 ILE HG1x 1.0 . 3.64 1058 925 A 79 LEU HD2% A 48 LEU HD1% 1.0 . 4.48 1059 926 A 75 ALA HB% A 79 LEU HD1% 1.0 . 6.00 1060 927 A 24 LEU H A 24 LEU HD2% 1.0 . 5.30 1061 928 A 15 GLU H A 15 GLU HG2 1.0 . 4.25 1062 929 A 75 ALA HB% A 48 LEU HD2% 1.0 . 4.54 1063 930 A 47 ASP HB3 A 51 ARG HG2 1.0 . 3.91 1064 930 A 47 ASP HB3 A 51 ARG HG3 1.0 . 3.91 1065 931 A 79 LEU HA A 82 ALA HB% 1.0 . 3.95 1066 932 A 41 MET HG3 A 41 MET HA 1.0 . 4.22 1067 933 A 76 VAL HG2% A 88 SER HA 1.0 . 6.00 1068 934 A 72 THR HA A 71 GLN HG3 1.0 . 5.28 1069 935 A 84 PHE HD% A 87 VAL HG1% 1.0 . 6.00 1070 936 A 119 TYR H A 118 ASP HBx 1.0 . 4.58 1071 937 A 41 MET HG3 A 24 LEU HD1% 1.0 . 6.00 1072 938 A 58 LYS HD2 A 58 LYS HB3 1.0 . 4.02 1073 939 A 102 GLY H A 103 PRO HDx 1.0 . 4.67 1074 939 A 102 GLY H A 103 PRO HDy 1.0 . 4.67 1075 940 A 31 THR HG2% A 31 THR HA 1.0 . 3.84 1076 941 A 15 GLU HG3 A 15 GLU HA 1.0 . 3.74 1077 942 A 98 LYS H A 98 LYS HD3 1.0 . 5.63 1078 943 A 74 GLN HA A 77 ASN HBx 1.0 . 3.77 1079 944 A 75 ALA HB% A 45 ILE HB 1.0 . 5.15 1080 945 A 31 THR H A 31 THR HG2% 1.0 . 4.65 1081 946 A 38 MET HA A 36 HIS HD2 1.0 . 4.07 1082 947 A 74 GLN H A 73 SER HBx 1.0 . 3.67 1083 947 A 74 GLN H A 73 SER HBy 1.0 . 3.67 1084 948 A 92 GLY H A 91 LYS HB3 1.0 . 4.45 1085 949 A 76 VAL HG2% A 76 VAL H 1.0 . 3.87 1086 950 A 43 MET HA A 51 ARG HD3 1.0 . 5.15 1087 951 A 37 ILE HA A 37 ILE HD1% 1.0 . 5.37 1088 952 A 45 ILE HB A 26 VAL HA 1.0 . 5.02 1089 953 A 97 TRP HA A 90 LEU HD2% 1.0 . 5.50 1090 954 A 90 LEU HD2% A 7 ALA HA 1.0 . 5.50 1091 955 A 54 SER HA A 54 SER HBx 1.0 . 2.82 1092 955 A 54 SER HBy A 54 SER HA 1.0 . 2.82 1093 956 A 12 SER HA A 16 TRP HD1 1.0 . 3.98 1094 957 A 32 TYR HD% A 42 ALA HA 1.0 . 4.86 1095 958 A 43 MET HG2 A 24 LEU HD1% 1.0 . 5.65 1096 959 A 36 HIS HD2 A 40 ALA HB% 1.0 . 4.29 1097 960 A 55 SER H A 52 ALA HA 1.0 . 5.64 1098 961 A 71 GLN HG2 A 45 ILE HG2% 1.0 . 5.44 1099 962 A 66 GLY HA3 A 27 ARG HG2 1.0 . 4.47 1100 962 A 27 ARG HG3 A 66 GLY HA3 1.0 . 4.47 1101 963 A 15 GLU H A 14 LEU HG 1.0 . 5.55 1102 964 A 100 ILE HG2% A 100 ILE HA 1.0 . 3.25 1103 965 A 33 ASN HB2 A 30 SER HA 1.0 . 4.07 1104 966 A 56 LEU HD1% A 43 MET HE% 1.0 . 4.62 1105 967 A 43 MET HE% A 24 LEU HD2% 1.0 . 5.24 1106 968 A 24 LEU HB2 A 24 LEU HD1% 1.0 . 4.16 1107 969 A 108 ILE HD1% A 35 GLY HAx 1.0 . 6.00 1108 969 A 35 GLY HAy A 108 ILE HD1% 1.0 . 6.00 1109 970 A 87 VAL HG1% A 79 LEU HD1% 1.0 . 4.29 1110 971 A 85 GLU HG3 A 84 PHE HA 1.0 . 5.18 1111 972 A 64 VAL HA A 64 VAL HG2% 1.0 . 4.23 1112 973 A 71 GLN HG2 A 75 ALA HB% 1.0 . 5.50 1113 974 A 71 GLN HG2 A 67 ALA HB% 1.0 . 5.50 1114 975 A 37 ILE HA A 37 ILE HG1y 1.0 . 3.90 1115 976 A 38 MET H A 38 MET HG2 1.0 . 4.81 1116 976 A 38 MET H A 38 MET HG3 1.0 . 4.81 1117 977 A 26 VAL HG2% A 71 GLN HG3 1.0 . 4.50 1118 978 A 90 LEU HD2% A 10 LEU HG 1.0 . 6.00 1119 979 A 9 VAL H A 9 VAL HB 1.0 . 3.45 1120 980 A 76 VAL HG2% A 64 VAL HB 1.0 . 4.03 1121 981 A 52 ALA HB% A 56 LEU HD1% 1.0 . 4.37 1122 982 A 41 MET HE% A 55 SER HBx 1.0 . 4.88 1123 982 A 55 SER HBy A 41 MET HE% 1.0 . 4.88 1124 983 A 49 VAL HB A 50 ASP HBx 1.0 . 5.51 1125 983 A 49 VAL HB A 50 ASP HBy 1.0 . 5.51 1126 984 A 109 GLU H A 109 GLU HG3 1.0 . 4.30 1127 985 A 37 ILE HG2% A 23 ILE HG2% 1.0 . 5.50 1128 986 A 10 LEU HD2% A 23 ILE HG2% 1.0 . 5.09 1129 987 A 78 LEU HD2% A 78 LEU HA 1.0 . 3.44 1130 988 A 11 LYS HB3 A 11 LYS HD3 1.0 . 4.16 1131 989 A 84 PHE HB2 A 62 ILE HD1% 1.0 . 6.00 1132 990 A 7 ALA HB% A 6 ASP HA 1.0 . 5.60 1133 991 A 85 GLU H A 84 PHE HA 1.0 . 3.13 1134 992 A 5 SER H A 4 GLN HG2 1.0 . 5.70 1135 992 A 4 GLN HG3 A 5 SER H 1.0 . 5.70 1136 993 A 22 THR HG2% A 24 LEU HD2% 1.0 . 4.19 1137 994 A 32 TYR HD% A 29 ARG HG3 1.0 . 6.00 1138 995 A 77 ASN HA A 80 ARG HD2 1.0 . 3.98 1139 996 A 29 ARG H A 29 ARG HB3 1.0 . 3.56 1140 997 A 64 VAL H A 63 TYR HB3 1.0 . 4.82 1141 998 A 99 ALA HB% A 100 ILE HA 1.0 . 5.33 1142 999 A 87 VAL HG1% A 76 VAL HA 1.0 . 4.21 1143 1000 A 97 TRP HZ2 A 14 LEU HDx% 1.0 . 3.90 1144 1000 A 14 LEU HDy% A 97 TRP HZ2 1.0 . 3.90 1145 1001 A 71 GLN HG2 A 66 GLY HA3 1.0 . 5.67 1146 1002 A 13 ARG H A 13 ARG HG2 1.0 . 5.79 1147 1003 A 91 LYS HB2 A 6 ASP HA 1.0 . 4.32 1148 1004 A 29 ARG H A 44 PRO HB3 1.0 . 5.36 1149 1005 A 43 MET HG2 A 56 LEU HD1% 1.0 . 4.89 1150 1006 A 43 MET HG2 A 24 LEU HD2% 1.0 . 5.50 1151 1007 A 90 LEU HD2% A 97 TRP HB2 1.0 . 6.00 1152 1008 A 23 ILE HD1% A 21 PHE HD% 1.0 . 5.50 1153 1009 A 104 THR HG2% A 102 GLY HAx 1.0 . 5.50 1154 1009 A 104 THR HG2% A 102 GLY HAy 1.0 . 5.50 1155 1010 A 24 LEU HD1% A 43 MET HBx 1.0 . 5.82 1156 1010 A 43 MET HBy A 24 LEU HD1% 1.0 . 5.82 1157 1011 A 98 LYS HG3 A 104 THR HG2% 1.0 . 4.41 1158 1012 A 17 GLY HAx A 13 ARG HBx 1.0 . 5.50 1159 1012 A 13 ARG HBy A 17 GLY HAx 1.0 . 5.50 1160 1013 A 13 ARG HG3 A 17 GLY HAx 1.0 . 5.50 1161 1014 A 95 ALA HB% A 92 GLY HAx 1.0 . 6.00 1162 1015 A 72 THR HG2% A 89 GLU HG2 1.0 . 5.01 1163 1016 A 108 ILE HG2% A 108 ILE HA 1.0 . 3.92 1164 1017 A 121 VAL HGy% A 119 TYR HBx 1.0 . 6.00 1165 1017 A 119 TYR HBx A 121 VAL HGx% 1.0 . 6.00 1166 1018 A 91 LYS H A 91 LYS HEx 1.0 . 5.50 1167 1018 A 91 LYS H A 91 LYS HEy 1.0 . 5.50 1168 1019 A 36 HIS H A 109 GLU HG3 1.0 . 5.72 1169 1020 A 56 LEU HG A 55 SER HBx 1.0 . 4.15 1170 1020 A 55 SER HBy A 56 LEU HG 1.0 . 4.15 1171 1021 A 52 ALA HA A 56 LEU HG 1.0 . 4.01 1172 1022 A 122 VAL H A 121 VAL HGx% 1.0 . 4.35 1173 1022 A 122 VAL H A 121 VAL HGy% 1.0 . 4.35 1174 1023 A 78 LEU HD2% A 77 ASN HBx 1.0 . 5.50 1175 1024 A 78 LEU HD1% A 77 ASN HBx 1.0 . 5.50 1176 1025 A 109 GLU H A 107 ILE HG2% 1.0 . 6.00 1177 1026 A 40 ALA HB% A 40 ALA H 1.0 . 3.85 1178 1027 A 42 ALA HB% A 41 MET HBx 1.0 . 6.00 1179 1027 A 41 MET HBy A 42 ALA HB% 1.0 . 6.00 1180 1028 A 125 LEU H A 124 ARG HG2 1.0 . 3.85 1181 1028 A 125 LEU H A 124 ARG HG3 1.0 . 3.85 1182 1029 A 125 LEU HG A 125 LEU H 1.0 . 5.44 1183 1030 A 41 MET HE% A 55 SER HBx 1.0 . 6.00 1184 1031 A 74 GLN H A 45 ILE HD1% 1.0 . 5.74 1185 1032 A 29 ARG HB2 A 29 ARG HD3 1.0 . 3.55 1186 1032 A 29 ARG HB2 A 29 ARG HD2 1.0 . 3.55 1187 1033 A 88 SER H A 63 TYR HA 1.0 . 4.16 1188 1034 A 108 ILE H A 108 ILE HG1y 1.0 . 4.16 1189 1035 A 93 GLY HA3 A 94 LEU HA 1.0 . 6.00 1190 1036 A 35 GLY H A 32 TYR HA 1.0 . 5.03 1191 1037 A 90 LEU HB3 A 65 TYR HBx 1.0 . 3.98 1192 1037 A 65 TYR HBy A 90 LEU HB3 1.0 . 3.98 1193 1038 A 109 GLU HG3 A 104 THR HB 1.0 . 4.87 1194 1039 A 64 VAL HG2% A 76 VAL HA 1.0 . 5.10 1195 1040 A 52 ALA HB% A 62 ILE HD1% 1.0 . 6.00 1196 1041 A 66 GLY HA3 A 71 GLN HB3 1.0 . 4.51 1197 1042 A 88 SER H A 64 VAL HG2% 1.0 . 6.00 1198 1043 A 97 TRP HZ3 A 11 LYS HB2 1.0 . 6.00 1199 1044 A 119 TYR H A 119 TYR HBy 1.0 . 3.92 1200 1045 A 6 ASP H A 9 VAL HG1% 1.0 . 6.00 1201 1046 A 58 LYS HA A 58 LYS HG3 1.0 . 3.93 1202 1047 A 97 TRP HB2 A 94 LEU HA 1.0 . 4.05 1203 1048 A 38 MET HE% A 103 PRO HA 1.0 . 6.00 1204 1049 A 109 GLU HG2 A 109 GLU HA 1.0 . 3.96 1205 1050 A 84 PHE HE% A 56 LEU HD2% 1.0 . 6.00 1206 1051 A 49 VAL HG2% A 84 PHE HD% 1.0 . 5.50 1207 1052 A 49 VAL HG2% A 82 ALA H 1.0 . 5.50 1208 1053 A 64 VAL HG1% A 26 VAL H 1.0 . 4.98 1209 1054 A 23 ILE HD1% A 40 ALA HA 1.0 . 6.00 1210 1055 A 30 SER HBy A 28 ASP HBx 1.0 . 5.50 1211 1055 A 28 ASP HBx A 30 SER HBx 1.0 . 5.50 1212 1056 A 94 LEU HD2% A 36 HIS HA 1.0 . 5.21 1213 1057 A 43 MET HG3 A 41 MET HBx 1.0 . 4.34 1214 1057 A 41 MET HBy A 43 MET HG3 1.0 . 4.34 1215 1058 A 38 MET H A 103 PRO HG2 1.0 . 5.71 1216 1058 A 38 MET H A 103 PRO HG3 1.0 . 5.71 1217 1059 A 45 ILE HA A 48 LEU HG 1.0 . 4.84 1218 1060 A 124 ARG H A 124 ARG HDx 1.0 . 5.50 1219 1060 A 124 ARG H A 124 ARG HDy 1.0 . 5.50 1220 1061 A 29 ARG HG2 A 42 ALA HB% 1.0 . 5.93 1221 1062 A 78 LEU H A 48 LEU HD2% 1.0 . 5.50 1222 1063 A 75 ALA H A 48 LEU HD2% 1.0 . 5.50 1223 1064 A 79 LEU H A 78 LEU HD1% 1.0 . 6.00 1224 1065 A 29 ARG HA A 29 ARG HD2 1.0 . 3.46 1225 1065 A 29 ARG HD3 A 29 ARG HA 1.0 . 3.46 1226 1066 A 48 LEU HD2% A 78 LEU HB2 1.0 . 5.15 1227 1067 A 126 GLU H A 126 GLU HG2 1.0 . 6.00 1228 1068 A 22 THR HG2% A 23 ILE HB 1.0 . 6.00 1229 1069 A 33 ASN HB2 A 34 ASP H 1.0 . 3.80 1230 1070 A 22 THR HB A 60 ARG HD3 1.0 . 5.50 1231 1071 A 52 ALA HB% A 53 SER HA 1.0 . 5.78 1232 1072 A 94 LEU HD1% A 94 LEU HA 1.0 . 3.79 1233 1073 A 63 TYR HE% A 13 ARG HD2 1.0 . 6.00 1234 1074 A 105 GLU H A 35 GLY HAx 1.0 . 6.00 1235 1074 A 35 GLY HAy A 105 GLU H 1.0 . 6.00 1236 1075 A 49 VAL HG2% A 75 ALA HA 1.0 . 6.00 1237 1076 A 48 LEU HA A 43 MET HBx 1.0 . 4.22 1238 1076 A 43 MET HBy A 48 LEU HA 1.0 . 4.22 1239 1077 A 57 GLU HG2 A 57 GLU HA 1.0 . 3.68 1240 1078 A 32 TYR HD% A 29 ARG HD2 1.0 . 4.74 1241 1078 A 32 TYR HD% A 29 ARG HD3 1.0 . 4.74 1242 1079 A 84 PHE HE% A 58 LYS HG3 1.0 . 6.00 1243 1080 A 125 LEU H A 124 ARG HBx 1.0 . 5.50 1244 1081 A 44 PRO HA A 48 LEU HD1% 1.0 . 5.50 1245 1082 A 44 PRO HA A 26 VAL HG1% 1.0 . 5.50 1246 1083 A 97 TRP HB3 A 94 LEU HA 1.0 . 3.98 1247 1084 A 64 VAL HG2% A 76 VAL H 1.0 . 6.00 1248 1085 A 82 ALA HB% A 81 SER HBy 1.0 . 6.00 1249 1086 A 72 THR HG2% A 76 VAL HG1% 1.0 . 6.00 1250 1087 A 91 LYS HA A 91 LYS HG2 1.0 . 3.47 1251 1087 A 91 LYS HA A 91 LYS HG3 1.0 . 3.47 1252 1088 A 40 ALA HB% A 37 ILE H 1.0 . 5.30 1253 1089 A 30 SER HBy A 29 ARG HG3 1.0 . 4.86 1254 1089 A 29 ARG HG3 A 30 SER HBx 1.0 . 4.86 1255 1090 A 48 LEU HD2% A 49 VAL HA 1.0 . 6.00 1256 1091 A 48 LEU HD2% A 79 LEU HG 1.0 . 5.33 1257 1092 A 23 ILE HG2% A 65 TYR HE% 1.0 . 4.90 1258 1093 A 26 VAL HB A 45 ILE HG2% 1.0 . 6.00 1259 1094 A 42 ALA HB% A 43 MET HE% 1.0 . 6.00 1260 1095 A 48 LEU H A 45 ILE HG2% 1.0 . 6.00 1261 1096 A 106 GLY HAx A 109 GLU HBy 1.0 . 5.18 1262 1096 A 106 GLY HAy A 109 GLU HBy 1.0 . 5.18 1263 1097 A 47 ASP HB2 A 48 LEU H 1.0 . 4.99 1264 1098 A 80 ARG H A 80 ARG HD2 1.0 . 6.00 1265 1099 A 97 TRP HA A 100 ILE HG1y 1.0 . 4.24 1266 1100 A 52 ALA H A 56 LEU HD1% 1.0 . 6.00 1267 1101 A 71 GLN HG2 A 45 ILE HD1% 1.0 . 4.18 1268 1102 A 89 GLU HA A 76 VAL HG1% 1.0 . 6.00 1269 1103 A 75 ALA HB% A 26 VAL HB 1.0 . 4.78 1270 1104 A 95 ALA HA A 97 TRP H 1.0 . 6.00 1271 1105 A 9 VAL HB A 5 SER HBx 1.0 . 5.35 1272 1105 A 9 VAL HB A 5 SER HBy 1.0 . 5.35 1273 1106 A 64 VAL HG2% A 63 TYR HA 1.0 . 5.87 1274 1107 A 104 THR HG2% A 98 LYS HD2 1.0 . 5.87 1275 1108 A 92 GLY H A 91 LYS HG2 1.0 . 4.37 1276 1108 A 92 GLY H A 91 LYS HG3 1.0 . 4.37 1277 1109 A 15 GLU H A 15 GLU HG3 1.0 . 3.70 1278 1110 A 38 MET HA A 105 GLU HB3 1.0 . 4.66 1279 1111 A 27 ARG HD3 A 27 ARG H 1.0 . 5.84 1280 1112 A 36 HIS HE1 A 107 ILE HG1x 1.0 . 6.00 1281 1113 A 98 LYS HG2 A 95 ALA HA 1.0 . 5.86 1282 1114 A 48 LEU HD2% A 45 ILE HA 1.0 . 4.05 1283 1115 A 94 LEU HD1% A 97 TRP HB2 1.0 . 5.50 1284 1116 A 84 PHE HD% A 58 LYS HD3 1.0 . 5.42 1285 1117 A 47 ASP HB2 A 48 LEU HA 1.0 . 6.00 1286 1118 A 38 MET HA A 38 MET HG2 1.0 . 3.50 1287 1118 A 38 MET HA A 38 MET HG3 1.0 . 3.50 1288 1119 A 4 GLN HB2 A 91 LYS HG2 1.0 . 3.75 1289 1119 A 4 GLN HB2 A 91 LYS HG3 1.0 . 3.75 1290 1120 A 40 ALA H A 38 MET HG2 1.0 . 6.00 1291 1120 A 40 ALA H A 38 MET HG3 1.0 . 6.00 1292 1121 A 77 ASN HA A 76 VAL HG1% 1.0 . 5.00 1293 1122 A 60 ARG H A 60 ARG HD3 1.0 . 6.00 1294 1123 A 23 ILE HD1% A 40 ALA H 1.0 . 5.50 1295 1124 A 25 ASP HA A 26 VAL HG2% 1.0 . 5.26 1296 1125 A 20 ALA HB% A 18 GLU HG2 1.0 . 6.00 1297 1126 A 86 HIS H A 85 GLU HB2 1.0 . 4.87 1298 1127 A 97 TRP HH2 A 10 LEU HG 1.0 . 4.25 1299 1128 A 40 ALA HA A 23 ILE HB 1.0 . 3.55 1300 1129 A 57 GLU H A 57 GLU HBx 1.0 . 3.76 1301 1130 A 43 MET HE% A 43 MET HG3 1.0 . 4.05 1302 1131 A 14 LEU H A 14 LEU HG 1.0 . 4.14 1303 1132 A 36 HIS HA A 37 ILE HB 1.0 . 5.34 1304 1133 A 42 ALA H A 41 MET HE% 1.0 . 6.00 1305 1134 A 70 GLU H A 70 GLU HBx 1.0 . 3.89 1306 1135 A 59 SER H A 59 SER HBx 1.0 . 4.12 1307 1136 A 99 ALA HB% A 97 TRP H 1.0 . 5.50 1308 1137 A 97 TRP H A 95 ALA HB% 1.0 . 5.50 1309 1138 A 24 LEU HA A 41 MET HBx 1.0 . 4.68 1310 1138 A 41 MET HBy A 24 LEU HA 1.0 . 4.68 1311 1139 A 95 ALA HA A 98 LYS HB2 1.0 . 3.66 1312 1140 A 55 SER HBy A 56 LEU HD1% 1.0 . 6.00 1313 1141 A 11 LYS HA A 14 LEU HDx% 1.0 . 4.32 1314 1141 A 14 LEU HDy% A 11 LYS HA 1.0 . 4.32 1315 1142 A 47 ASP HA A 50 ASP HBx 1.0 . 4.71 1316 1142 A 50 ASP HBy A 47 ASP HA 1.0 . 4.71 1317 1143 A 63 TYR HD% A 10 LEU HD1% 1.0 . 6.00 1318 1144 A 86 HIS HA A 1 MET HBx 1.0 . 5.64 1319 1144 A 1 MET HBy A 86 HIS HA 1.0 . 5.64 1320 1145 A 96 ALA H A 94 LEU HA 1.0 . 5.85 1321 1146 A 102 GLY H A 11 LYS HD3 1.0 . 6.00 1322 1147 A 62 ILE HD1% A 60 ARG HBy 1.0 . 5.50 1323 1148 A 29 ARG H A 44 PRO HB2 1.0 . 6.00 1324 1149 A 76 VAL H A 26 VAL HG1% 1.0 . 5.50 1325 1150 A 75 ALA H A 26 VAL HG1% 1.0 . 5.50 1326 1151 A 71 GLN HG2 A 72 THR H 1.0 . 5.77 1327 1152 A 80 ARG H A 76 VAL HG1% 1.0 . 5.50 1328 1153 A 95 ALA HA A 98 LYS HG3 1.0 . 5.99 1329 1154 A 85 GLU H A 58 LYS HB3 1.0 . 5.81 1330 1155 A 121 VAL HA A 121 VAL HGx% 1.0 . 3.83 1331 1155 A 121 VAL HA A 121 VAL HGy% 1.0 . 3.83 1332 1156 A 25 ASP HA A 23 ILE HG2% 1.0 . 6.00 1333 1157 A 64 VAL H A 76 VAL HG2% 1.0 . 5.47 1334 1158 A 42 ALA HB% A 29 ARG HG3 1.0 . 6.00 1335 1159 A 45 ILE HD1% A 71 GLN HG3 1.0 . 4.72 1336 1160 A 75 ALA HB% A 66 GLY HA3 1.0 . 5.50 1337 1161 A 66 GLY HA3 A 67 ALA HB% 1.0 . 5.50 1338 1162 A 38 MET H A 37 ILE HB 1.0 . 6.00 1339 1163 A 66 GLY HA3 A 26 VAL HG2% 1.0 . 4.20 1340 1164 A 96 ALA H A 95 ALA HB% 1.0 . 3.79 1341 1165 A 26 VAL H A 66 GLY HA3 1.0 . 5.64 1342 1166 A 97 TRP HA A 11 LYS HG3 1.0 . 5.77 1343 1167 A 71 GLN H A 70 GLU HBy 1.0 . 4.40 1344 1168 A 72 THR HG2% A 72 THR HA 1.0 . 3.96 1345 1169 A 79 LEU HB2 A 87 VAL HG2% 1.0 . 4.33 1346 1170 A 50 ASP H A 51 ARG HG2 1.0 . 5.09 1347 1170 A 51 ARG HG3 A 50 ASP H 1.0 . 5.09 1348 1171 A 29 ARG H A 29 ARG HG2 1.0 . 4.60 1349 1172 A 58 LYS H A 58 LYS HD3 1.0 . 5.54 1350 1173 A 31 THR HG2% A 27 ARG HA 1.0 . 5.31 1351 1174 A 11 LYS HD2 A 102 GLY HAx 1.0 . 3.17 1352 1174 A 11 LYS HD2 A 102 GLY HAy 1.0 . 3.17 1353 1175 A 56 LEU HG A 55 SER HBx 1.0 . 4.74 1354 1176 A 84 PHE HD% A 58 LYS HG3 1.0 . 6.00 1355 1177 A 119 TYR H A 118 ASP HA 1.0 . 3.37 1356 1178 A 26 VAL HG2% A 75 ALA HA 1.0 . 5.50 1357 1179 A 95 ALA HA A 98 LYS HD2 1.0 . 6.00 1358 1180 A 76 VAL HB A 77 ASN HBy 1.0 . 5.50 1359 1181 A 38 MET HA A 37 ILE HA 1.0 . 5.50 1360 1182 A 4 GLN HE21 A 91 LYS HD2 1.0 . 6.00 1361 1182 A 4 GLN HE21 A 91 LYS HD3 1.0 . 6.00 1362 1183 A 15 GLU HB3 A 12 SER HA 1.0 . 5.79 1363 1184 A 15 GLU H A 14 LEU HDx% 1.0 . 6.00 1364 1184 A 15 GLU H A 14 LEU HDy% 1.0 . 6.00 1365 1185 A 45 ILE HG2% A 46 GLU HBx 1.0 . 4.66 1366 1185 A 45 ILE HG2% A 46 GLU HBy 1.0 . 4.66 1367 1186 A 96 ALA HB% A 97 TRP HB2 1.0 . 6.00 1368 1187 A 72 THR HG2% A 64 VAL HG1% 1.0 . 5.10 1369 1188 A 43 MET HG3 A 24 LEU HD2% 1.0 . 6.00 1370 1189 A 98 LYS HG2 A 104 THR HG2% 1.0 . 4.31 1371 1190 A 10 LEU HD2% A 97 TRP HE3 1.0 . 5.50 1372 1191 A 100 ILE HD1% A 100 ILE HB 1.0 . 4.25 1373 1192 A 82 ALA HB% A 58 LYS HEx 1.0 . 5.01 1374 1192 A 82 ALA HB% A 58 LYS HEy 1.0 . 5.01 1375 1193 A 75 ALA HB% A 26 VAL H 1.0 . 5.99 1376 1194 A 3 PRO HD3 A 2 GLU HBy 1.0 . 3.66 1377 1194 A 2 GLU HBy A 3 PRO HD2 1.0 . 3.66 1378 1195 A 34 ASP H A 34 ASP HBy 1.0 . 3.60 1379 1196 A 58 LYS HD3 A 83 GLY HA3 1.0 . 6.00 1380 1197 A 49 VAL HG2% A 79 LEU HA 1.0 . 4.94 1381 1198 A 49 VAL HG2% A 78 LEU HA 1.0 . 5.50 1382 1199 A 104 THR HG2% A 98 LYS HEx 1.0 . 5.78 1383 1200 A 14 LEU HDy% A 19 PRO HBx 1.0 . 6.00 1384 1200 A 14 LEU HDx% A 19 PRO HBx 1.0 . 6.00 1385 1200 A 19 PRO HBy A 14 LEU HDx% 1.0 . 6.00 1386 1200 A 14 LEU HDy% A 19 PRO HBy 1.0 . 6.00 1387 1201 A 90 LEU HB3 A 93 GLY HA2 1.0 . 5.50 1388 1202 A 57 GLU H A 60 ARG HBx 1.0 . 5.50 1389 1203 A 62 ILE HD1% A 56 LEU HBx 1.0 . 5.50 1390 1204 A 45 ILE HD1% A 26 VAL HA 1.0 . 6.00 1391 1205 A 72 THR HG2% A 89 GLU HG3 1.0 . 4.59 1392 1206 A 56 LEU HA A 56 LEU HD1% 1.0 . 6.00 1393 1207 A 84 PHE HB2 A 87 VAL HG2% 1.0 . 4.15 1394 1208 A 37 ILE HA A 37 ILE HG1x 1.0 . 3.90 1395 1209 A 64 VAL HA A 24 LEU H 1.0 . 4.57 1396 1210 A 1 MET HG2 A 88 SER HBy 1.0 . 6.00 1397 1211 A 41 MET HE% A 24 LEU HD1% 1.0 . 6.00 1398 1212 A 96 ALA HB% A 97 TRP HB3 1.0 . 5.50 1399 1213 A 97 TRP HB3 A 94 LEU HG 1.0 . 5.50 1400 1214 A 87 VAL H A 87 VAL HB 1.0 . 4.01 1401 1215 A 48 LEU HD2% A 26 VAL HB 1.0 . 5.88 1402 1216 A 85 GLU HA A 85 GLU HG2 1.0 . 3.24 1403 1217 A 15 GLU HB3 A 16 TRP H 1.0 . 4.49 1404 1218 A 15 GLU HG3 A 14 LEU HBy 1.0 . 6.00 1405 1219 A 119 TYR H A 119 TYR HBx 1.0 . 3.92 1406 1220 A 1 MET HE% A 88 SER HBy 1.0 . 5.18 1407 1221 A 79 LEU HB3 A 79 LEU HD1% 1.0 . 4.05 1408 1222 A 37 ILE HA A 40 ALA HB% 1.0 . 5.50 1409 1223 A 18 GLU H A 18 GLU HBy 1.0 . 3.86 1410 1224 A 80 ARG H A 80 ARG HBx 1.0 . 3.58 1411 1224 A 80 ARG H A 80 ARG HBy 1.0 . 3.58 1412 1225 A 90 LEU HG A 93 GLY HA2 1.0 . 5.71 1413 1226 A 87 VAL HG1% A 79 LEU HB2 1.0 . 5.13 1414 1227 A 55 SER H A 56 LEU HG 1.0 . 4.83 1415 1228 A 105 GLU HB2 A 38 MET HG2 1.0 . 5.60 1416 1228 A 105 GLU HB2 A 38 MET HG3 1.0 . 5.60 1417 1229 A 29 ARG H A 29 ARG HG3 1.0 . 5.02 1418 1230 A 121 VAL HGy% A 120 ASN HBx 1.0 . 6.00 1419 1230 A 120 ASN HBx A 121 VAL HGx% 1.0 . 6.00 1420 1231 A 42 ALA HA A 43 MET HBx 1.0 . 5.64 1421 1231 A 43 MET HBy A 42 ALA HA 1.0 . 5.64 1422 1232 A 100 ILE HD1% A 99 ALA HB% 1.0 . 6.00 1423 1233 A 84 PHE HD% A 58 LYS HEx 1.0 . 5.22 1424 1233 A 84 PHE HD% A 58 LYS HEy 1.0 . 5.22 1425 1234 A 21 PHE HD% A 21 PHE HA 1.0 . 5.64 1426 1235 A 102 GLY H A 11 LYS HG3 1.0 . 5.50 1427 1236 A 121 VAL H A 120 ASN HBx 1.0 . 5.14 1428 1237 A 45 ILE HD1% A 26 VAL HB 1.0 . 4.19 1429 1238 A 41 MET HE% A 24 LEU HD2% 1.0 . 4.59 1430 1239 A 94 LEU HD2% A 94 LEU HB2 1.0 . 4.03 1431 1240 A 22 THR HB A 62 ILE HA 1.0 . 4.29 1432 1241 A 79 LEU HA A 87 VAL HG2% 1.0 . 5.74 1433 1242 A 64 VAL HG1% A 89 GLU HBx 1.0 . 5.50 1434 1242 A 64 VAL HG1% A 89 GLU HBy 1.0 . 5.50 1435 1243 A 24 LEU HD2% A 41 MET HBx 1.0 . 3.75 1436 1243 A 41 MET HBy A 24 LEU HD2% 1.0 . 3.75 1437 1244 A 24 LEU HA A 41 MET HE% 1.0 . 5.50 1438 1245 A 56 LEU HA A 41 MET HE% 1.0 . 5.50 1439 1246 A 63 TYR HB2 A 23 ILE HG1y 1.0 . 5.87 1440 1247 A 79 LEU HD2% A 62 ILE HD1% 1.0 . 6.00 1441 1248 A 108 ILE HG2% A 106 GLY HAx 1.0 . 5.50 1442 1248 A 108 ILE HG2% A 106 GLY HAy 1.0 . 5.50 1443 1249 A 108 ILE HG2% A 110 SER HBx 1.0 . 5.50 1444 1249 A 108 ILE HG2% A 110 SER HBy 1.0 . 5.50 1445 1250 A 100 ILE HD1% A 11 LYS HEy 1.0 . 6.00 1446 1251 A 25 ASP H A 25 ASP HBy 1.0 . 4.07 1447 1252 A 1 MET HE% A 88 SER HBx 1.0 . 5.18 1448 1253 A 37 ILE HD1% A 97 TRP HB3 1.0 . 5.79 1449 1254 A 58 LYS HA A 58 LYS HEx 1.0 . 5.59 1450 1254 A 58 LYS HA A 58 LYS HEy 1.0 . 5.59 1451 1255 A 44 PRO HA A 46 GLU H 1.0 . 5.83 1452 1256 A 21 PHE HZ A 19 PRO HBx 1.0 . 5.90 1453 1256 A 19 PRO HBy A 21 PHE HZ 1.0 . 5.90 1454 1257 A 13 ARG HD3 A 21 PHE HE% 1.0 . 6.00 1455 1258 A 87 VAL HG2% A 85 GLU HA 1.0 . 6.00 1456 1259 A 11 LYS H A 11 LYS HD3 1.0 . 6.00 1457 1260 A 40 ALA HB% A 23 ILE HG2% 1.0 . 4.62 1458 1261 A 25 ASP H A 24 LEU HD1% 1.0 . 6.00 1459 1262 A 26 VAL HG2% A 71 GLN HE21 1.0 . 5.50 1460 1263 A 41 MET HE% A 51 ARG HD2 1.0 . 6.00 1461 1264 A 60 ARG HD3 A 62 ILE HD1% 1.0 . 5.50 1462 1265 A 49 VAL HG1% A 52 ALA H 1.0 . 6.00 1463 1266 A 26 VAL HB A 45 ILE HB 1.0 . 3.42 1464 1267 A 105 GLU HB3 A 38 MET HG2 1.0 . 6.00 1465 1267 A 105 GLU HB3 A 38 MET HG3 1.0 . 6.00 1466 1268 A 43 MET HG2 A 43 MET HE% 1.0 . 4.28 1467 1269 A 11 LYS HD2 A 100 ILE HD1% 1.0 . 5.29 1468 1270 A 45 ILE HG2% A 46 GLU HA 1.0 . 4.65 1469 1271 A 94 LEU HD2% A 36 HIS H 1.0 . 6.00 1470 1272 A 59 SER H A 57 GLU HBx 1.0 . 4.30 1471 1273 A 115 GLY HAy A 116 ALA HB% 1.0 . 5.50 1472 1274 A 114 ALA HB% A 115 GLY HAy 1.0 . 5.50 1473 1275 A 29 ARG HA A 29 ARG HG3 1.0 . 4.18 1474 1276 A 100 ILE HD1% A 7 ALA HA 1.0 . 5.50 1475 1277 A 94 LEU H A 90 LEU HD2% 1.0 . 5.50 1476 1278 A 84 PHE HB3 A 79 LEU HB3 1.0 . 5.20 1477 1279 A 99 ALA HA A 100 ILE HA 1.0 . 5.33 1478 1280 A 27 ARG HA A 27 ARG HG2 1.0 . 3.51 1479 1280 A 27 ARG HG3 A 27 ARG HA 1.0 . 3.51 1480 1281 A 45 ILE H A 45 ILE HG2% 1.0 . 4.11 1481 1282 A 22 THR H A 21 PHE HBx 1.0 . 4.44 1482 1283 A 84 PHE HE% A 58 LYS HD3 1.0 . 5.50 1483 1284 A 58 LYS H A 57 GLU HG3 1.0 . 3.90 1484 1285 A 23 ILE HG2% A 21 PHE HE% 1.0 . 6.00 1485 1286 A 15 GLU HB2 A 16 TRP HD1 1.0 . 3.82 1486 1287 A 40 ALA HB% A 37 ILE HD1% 1.0 . 6.00 1487 1288 A 10 LEU HD2% A 90 LEU HD2% 1.0 . 5.56 1488 1289 A 119 TYR HA A 119 TYR HD% 1.0 . 3.88 1489 1290 A 27 ARG H A 27 ARG HG2 1.0 . 3.62 1490 1290 A 27 ARG H A 27 ARG HG3 1.0 . 3.62 1491 1291 A 116 ALA HB% A 115 GLY HAx 1.0 . 5.50 1492 1291 A 115 GLY HAy A 116 ALA HB% 1.0 . 5.50 1493 1292 A 114 ALA HB% A 115 GLY HAx 1.0 . 5.50 1494 1292 A 114 ALA HB% A 115 GLY HAy 1.0 . 5.50 1495 1293 A 45 ILE HG2% A 71 GLN HG3 1.0 . 6.00 1496 1294 A 83 GLY HA2 A 58 LYS HEx 1.0 . 6.00 1497 1294 A 83 GLY HA2 A 58 LYS HEy 1.0 . 6.00 1498 1295 A 44 PRO HA A 26 VAL HA 1.0 . 3.59 1499 1296 A 100 ILE HG2% A 8 HIS HBy 1.0 . 6.00 1500 1297 A 94 LEU HD2% A 95 ALA HB% 1.0 . 6.00 1501 1298 A 12 SER H A 11 LYS HB3 1.0 . 3.88 1502 1299 A 37 ILE HG2% A 23 ILE HB 1.0 . 6.00 1503 1300 A 11 LYS H A 9 VAL HG1% 1.0 . 6.00 1504 1301 A 84 PHE HD% A 87 VAL HG2% 1.0 . 5.50 1505 1302 A 13 ARG HG2 A 21 PHE HE% 1.0 . 5.61 1506 1303 A 63 TYR H A 62 ILE HB 1.0 . 5.55 1507 1304 A 47 ASP HB2 A 44 PRO HG2 1.0 . 5.28 1508 1305 A 11 LYS H A 11 LYS HB3 1.0 . 4.12 1509 1306 A 44 PRO HD2 A 43 MET HBx 1.0 . 5.22 1510 1306 A 43 MET HBy A 44 PRO HD2 1.0 . 5.22 1511 1307 A 4 GLN HG3 A 91 LYS HEx 1.0 . 6.00 1512 1307 A 91 LYS HEy A 4 GLN HG2 1.0 . 6.00 1513 1307 A 4 GLN HG3 A 91 LYS HEy 1.0 . 6.00 1514 1307 A 4 GLN HG2 A 91 LYS HEx 1.0 . 6.00 1515 1308 A 104 THR HG2% A 37 ILE HG2% 1.0 . 5.50 1516 1309 A 4 GLN HA A 89 GLU HG3 1.0 . 5.50 1517 1310 A 11 LYS HD2 A 11 LYS HA 1.0 . 5.50 1518 1311 A 11 LYS HD2 A 8 HIS HA 1.0 . 5.50 1519 1312 A 62 ILE HD1% A 84 PHE HA 1.0 . 5.50 1520 1313 A 62 ILE HD1% A 60 ARG HA 1.0 . 5.50 1521 1314 A 75 ALA HB% A 71 GLN HG3 1.0 . 4.73 1522 1315 A 27 ARG HD3 A 31 THR HG2% 1.0 . 4.42 1523 1316 A 79 LEU HA A 49 VAL HA 1.0 . 6.00 1524 1317 A 79 LEU HD2% A 87 VAL HG2% 1.0 . 6.00 1525 1318 A 36 HIS HD2 A 105 GLU HB2 1.0 . 6.00 1526 1319 A 28 ASP HA A 45 ILE HG2% 1.0 . 5.50 1527 1320 A 45 ILE HG2% A 27 ARG HA 1.0 . 5.50 1528 1321 A 89 GLU H A 89 GLU HBx 1.0 . 3.84 1529 1321 A 89 GLU H A 89 GLU HBy 1.0 . 3.84 1530 1322 A 48 LEU H A 46 GLU HG2 1.0 . 6.00 1531 1322 A 48 LEU H A 46 GLU HG3 1.0 . 6.00 1532 1323 A 37 ILE HD1% A 65 TYR HE% 1.0 . 5.50 1533 1324 A 11 LYS H A 8 HIS HA 1.0 . 5.50 1534 1325 A 49 VAL HG2% A 84 PHE HE% 1.0 . 6.00 1535 1326 A 64 VAL HA A 62 ILE HG2% 1.0 . 5.48 1536 1327 A 46 GLU HA A 46 GLU HG2 1.0 . 3.51 1537 1327 A 46 GLU HG3 A 46 GLU HA 1.0 . 3.51 1538 1328 A 49 VAL HG1% A 84 PHE HE% 1.0 . 6.00 1539 1329 A 3 PRO HD3 A 2 GLU HBx 1.0 . 3.66 1540 1329 A 2 GLU HBx A 3 PRO HD2 1.0 . 3.66 1541 1330 A 95 ALA H A 94 LEU HG 1.0 . 6.00 1542 1331 A 107 ILE HD1% A 107 ILE HB 1.0 . 4.13 1543 1332 A 64 VAL H A 63 TYR HA 1.0 . 3.23 1544 1333 A 72 THR HA A 64 VAL HB 1.0 . 6.00 1545 1334 A 33 ASN HB3 A 107 ILE HB 1.0 . 5.65 1546 1335 A 26 VAL HG2% A 71 GLN HB2 1.0 . 6.00 1547 1336 A 90 LEU HG A 91 LYS H 1.0 . 4.69 1548 1337 A 76 VAL HA A 87 VAL HB 1.0 . 6.00 1549 1338 A 29 ARG HD3 A 29 ARG HG3 1.0 . 2.94 1550 1338 A 29 ARG HD2 A 29 ARG HG3 1.0 . 2.94 1551 1338 A 29 ARG HG2 A 29 ARG HD2 1.0 . 2.94 1552 1338 A 29 ARG HD3 A 29 ARG HG2 1.0 . 2.94 1553 1339 A 84 PHE H A 58 LYS HB3 1.0 . 5.50 1554 1340 A 59 SER H A 58 LYS HB3 1.0 . 5.18 1555 1341 A 71 GLN HG2 A 67 ALA H 1.0 . 6.00 1556 1342 A 111 ARG H A 111 ARG HD2 1.0 . 5.50 1557 1342 A 111 ARG H A 111 ARG HD3 1.0 . 5.50 1558 1343 A 112 THR H A 111 ARG HD2 1.0 . 5.50 1559 1343 A 112 THR H A 111 ARG HD3 1.0 . 5.50 1560 1344 A 74 GLN HA A 77 ASN HBy 1.0 . 3.77 1561 1345 A 36 HIS H A 109 GLU HG2 1.0 . 6.00 1562 1346 A 26 VAL H A 45 ILE HD1% 1.0 . 6.00 1563 1347 A 9 VAL HG1% A 13 ARG HBx 1.0 . 5.50 1564 1347 A 13 ARG HBy A 9 VAL HG1% 1.0 . 5.50 1565 1348 A 13 ARG HG3 A 9 VAL HG1% 1.0 . 5.50 1566 1349 A 90 LEU HB2 A 63 TYR HB3 1.0 . 6.00 1567 1350 A 71 GLN HA A 45 ILE HD1% 1.0 . 4.75 1568 1351 A 28 ASP HA A 27 ARG HBy 1.0 . 5.05 1569 1351 A 28 ASP HA A 27 ARG HBx 1.0 . 5.05 1570 1352 A 95 ALA HA A 98 LYS HEy 1.0 . 5.93 1571 1353 A 47 ASP HB2 A 44 PRO HD3 1.0 . 5.40 1572 1354 A 87 VAL HG1% A 80 ARG HE 1.0 . 6.00 1573 1355 A 94 LEU HD2% A 98 LYS HD3 1.0 . 6.00 1574 1356 A 25 ASP H A 43 MET HBx 1.0 . 5.50 1575 1356 A 43 MET HBy A 25 ASP H 1.0 . 5.50 1576 1357 A 87 VAL HG1% A 89 GLU H 1.0 . 5.50 1577 1358 A 87 VAL HG1% A 62 ILE H 1.0 . 5.50 1578 1359 A 94 LEU HD2% A 98 LYS HEy 1.0 . 5.67 1579 1360 A 29 ARG HA A 32 TYR HBx 1.0 . 3.95 1580 1360 A 32 TYR HBy A 29 ARG HA 1.0 . 3.95 1581 1361 A 23 ILE HG2% A 41 MET HG3 1.0 . 6.00 1582 1362 A 75 ALA HB% A 76 VAL HG2% 1.0 . 5.95 1583 1363 A 99 ALA HB% A 96 ALA HA 1.0 . 3.80 1584 1364 A 51 ARG HA A 51 ARG HD2 1.0 . 3.87 1585 1365 A 85 GLU HB2 A 86 HIS HD2 1.0 . 4.31 1586 1366 A 100 ILE H A 100 ILE HD1% 1.0 . 5.80 1587 1367 A 15 GLU HB2 A 12 SER HA 1.0 . 4.48 1588 1368 A 61 ASP H A 60 ARG HD2 1.0 . 4.72 1589 1369 A 79 LEU HD2% A 78 LEU HB3 1.0 . 6.00 1590 1370 A 58 LYS H A 58 LYS HEx 1.0 . 5.29 1591 1370 A 58 LYS H A 58 LYS HEy 1.0 . 5.29 1592 1371 A 79 LEU HD2% A 43 MET HE% 1.0 . 6.00 1593 1372 A 84 PHE HD% A 79 LEU HD1% 1.0 . 6.00 1594 1373 A 46 GLU H A 46 GLU HG2 1.0 . 3.61 1595 1373 A 46 GLU H A 46 GLU HG3 1.0 . 3.61 1596 1374 A 10 LEU HD1% A 21 PHE HE% 1.0 . 5.32 1597 1375 A 14 LEU HDy% A 38 MET HG2 1.0 . 5.12 1598 1375 A 14 LEU HDx% A 38 MET HG2 1.0 . 5.12 1599 1375 A 38 MET HG3 A 14 LEU HDx% 1.0 . 5.12 1600 1375 A 14 LEU HDy% A 38 MET HG3 1.0 . 5.12 1601 1376 A 32 TYR HD% A 29 ARG HA 1.0 . 5.79 1602 1377 A 107 ILE HD1% A 107 ILE H 1.0 . 5.00 1603 1378 A 89 GLU HA A 64 VAL HB 1.0 . 4.68 1604 1379 A 73 SER H A 69 ASP HA 1.0 . 5.50 1605 1380 A 72 THR H A 69 ASP HA 1.0 . 5.50 1606 1381 A 64 VAL HG1% A 75 ALA HB% 1.0 . 4.55 1607 1382 A 75 ALA HB% A 26 VAL HG1% 1.0 . 4.53 1608 1383 A 78 LEU HG A 77 ASN HBx 1.0 . 5.50 1609 1384 A 98 LYS HB3 A 104 THR HG2% 1.0 . 6.00 1610 1385 A 14 LEU HA A 13 ARG HBx 1.0 . 5.91 1611 1385 A 13 ARG HBy A 14 LEU HA 1.0 . 5.91 1612 1386 A 24 LEU H A 23 ILE HG2% 1.0 . 4.35 1613 1387 A 43 MET HG3 A 51 ARG HD3 1.0 . 4.65 1614 1388 A 84 PHE HD% A 83 GLY HA2 1.0 . 5.50 1615 1389 A 97 TRP HA A 100 ILE HG2% 1.0 . 5.52 1616 1390 A 62 ILE HB A 62 ILE HD1% 1.0 . 3.94 1617 1391 A 107 ILE HA A 107 ILE HG1y 1.0 . 4.07 1618 1392 A 10 LEU HD2% A 63 TYR HB2 1.0 . 6.00 1619 1393 A 84 PHE HD% A 82 ALA HB% 1.0 . 4.12 1620 1394 A 82 ALA H A 82 ALA HB% 1.0 . 3.62 1621 1395 A 53 SER HA A 58 LYS HEx 1.0 . 4.58 1622 1395 A 58 LYS HEy A 53 SER HA 1.0 . 4.58 1623 1396 A 21 PHE HE% A 13 ARG HBx 1.0 . 5.50 1624 1396 A 13 ARG HBy A 21 PHE HE% 1.0 . 5.50 1625 1397 A 78 LEU HG A 78 LEU HA 1.0 . 3.71 1626 1398 A 64 VAL HG2% A 79 LEU HD1% 1.0 . 4.55 1627 1399 A 100 ILE HD1% A 11 LYS HG3 1.0 . 6.00 1628 1400 A 79 LEU HD2% A 82 ALA HB% 1.0 . 5.50 1629 1401 A 51 ARG H A 51 ARG HD2 1.0 . 5.20 1630 1402 A 84 PHE HD% A 49 VAL HG1% 1.0 . 5.50 1631 1403 A 49 VAL HG1% A 82 ALA H 1.0 . 5.50 1632 1404 A 23 ILE HD1% A 37 ILE HG2% 1.0 . 4.67 1633 1405 A 23 ILE HD1% A 10 LEU HD2% 1.0 . 5.50 1634 1406 A 49 VAL HA A 48 LEU HG 1.0 . 4.33 1635 1407 A 31 THR HB A 27 ARG HBy 1.0 . 4.81 1636 1407 A 31 THR HB A 27 ARG HBx 1.0 . 4.81 1637 1408 A 50 ASP H A 82 ALA HB% 1.0 . 5.50 1638 1409 A 49 VAL H A 82 ALA HB% 1.0 . 5.50 1639 1410 A 94 LEU HD1% A 37 ILE H 1.0 . 5.29 1640 1411 A 117 ASP HA A 118 ASP H 1.0 . 3.37 1641 1412 A 102 GLY H A 100 ILE HG1x 1.0 . 4.56 1642 1413 A 98 LYS HA A 98 LYS HD2 1.0 . 5.65 1643 1414 A 36 HIS H A 104 THR HB 1.0 . 4.30 1644 1415 A 51 ARG H A 48 LEU HA 1.0 . 5.27 1645 1416 A 102 GLY H A 104 THR HG2% 1.0 . 5.71 1646 1417 A 23 ILE HB A 14 LEU HDx% 1.0 . 6.00 1647 1417 A 14 LEU HDy% A 23 ILE HB 1.0 . 6.00 1648 1418 A 99 ALA HB% A 100 ILE HG2% 1.0 . 4.95 1649 1419 A 91 LYS H A 91 LYS HG2 1.0 . 3.58 1650 1419 A 91 LYS H A 91 LYS HG3 1.0 . 3.58 1651 1420 A 45 ILE HD1% A 75 ALA HA 1.0 . 3.92 1652 1421 A 79 LEU HD2% A 64 VAL HG2% 1.0 . 6.00 1653 1422 A 67 ALA HA A 27 ARG HG2 1.0 . 5.42 1654 1422 A 27 ARG HG3 A 67 ALA HA 1.0 . 5.42 1655 1423 A 104 THR HA A 38 MET HBy 1.0 . 6.00 1656 1424 A 1 MET HA A 1 MET HG3 1.0 . 3.77 1657 1425 A 79 LEU H A 79 LEU HB3 1.0 . 3.97 1658 1426 A 52 ALA H A 51 ARG HBy 1.0 . 4.22 1659 1427 A 44 PRO HD2 A 43 MET HA 1.0 . 3.33 1660 1428 A 78 LEU HD2% A 77 ASN HBx 1.0 . 6.00 1661 1428 A 78 LEU HD2% A 77 ASN HBy 1.0 . 6.00 1662 1429 A 78 LEU HD1% A 74 GLN HG2 1.0 . 5.50 1663 1430 A 94 LEU HD2% A 98 LYS HEx 1.0 . 5.67 1664 1431 A 50 ASP H A 47 ASP HA 1.0 . 5.26 1665 1432 A 89 GLU H A 76 VAL HG2% 1.0 . 6.00 1666 1433 A 110 SER HA A 110 SER HBx 1.0 . 2.87 1667 1433 A 110 SER HBy A 110 SER HA 1.0 . 2.87 1668 1434 A 24 LEU HA A 23 ILE HG2% 1.0 . 6.00 1669 1435 A 95 ALA HA A 98 LYS HB3 1.0 . 4.22 1670 1436 A 90 LEU HD1% A 5 SER HBx 1.0 . 5.90 1671 1436 A 90 LEU HD1% A 5 SER HBy 1.0 . 5.90 1672 1437 A 37 ILE HA A 97 TRP HD1 1.0 . 4.80 1673 1438 A 37 ILE HD1% A 97 TRP HH2 1.0 . 6.00 1674 1439 A 52 ALA HB% A 56 LEU HG 1.0 . 4.94 1675 1440 A 58 LYS HA A 58 LYS HD3 1.0 . 4.66 1676 1441 A 47 ASP H A 46 GLU HBx 1.0 . 4.11 1677 1441 A 47 ASP H A 46 GLU HBy 1.0 . 4.11 1678 1442 A 104 THR HG2% A 103 PRO HB2 1.0 . 5.50 1679 1443 A 103 PRO HB2 A 14 LEU HDx% 1.0 . 5.50 1680 1443 A 14 LEU HDy% A 103 PRO HB2 1.0 . 5.50 1681 1444 A 107 ILE HG2% A 110 SER HBx 1.0 . 5.32 1682 1444 A 107 ILE HG2% A 110 SER HBy 1.0 . 5.32 1683 1445 A 107 ILE HA A 107 ILE HG1x 1.0 . 4.07 1684 1446 A 96 ALA HA A 100 ILE HG2% 1.0 . 5.61 1685 1447 A 97 TRP HZ3 A 90 LEU HD2% 1.0 . 6.00 1686 1448 A 56 LEU H A 55 SER HBy 1.0 . 4.84 1687 1449 A 105 GLU HA A 104 THR HB 1.0 . 6.00 1688 1450 A 11 LYS HA A 10 LEU HG 1.0 . 5.67 1689 1451 A 90 LEU HD2% A 65 TYR HBx 1.0 . 4.77 1690 1451 A 65 TYR HBy A 90 LEU HD2% 1.0 . 4.77 1691 1452 A 47 ASP HA A 48 LEU HBx 1.0 . 5.50 1692 1452 A 47 ASP HA A 48 LEU HBy 1.0 . 5.50 1693 1453 A 38 MET HA A 38 MET HE% 1.0 . 6.00 1694 1454 A 5 SER H A 90 LEU HD1% 1.0 . 6.00 1695 1455 A 95 ALA H A 95 ALA HB% 1.0 . 3.46 1696 1456 A 2 GLU HA A 3 PRO HG2 1.0 . 4.93 1697 1457 A 30 SER HA A 33 ASN H 1.0 . 4.42 1698 1458 A 49 VAL H A 48 LEU HD2% 1.0 . 6.00 1699 1459 A 19 PRO HD3 A 18 GLU HA 1.0 . 3.40 1700 1460 A 45 ILE H A 26 VAL HA 1.0 . 4.35 1701 1461 A 66 GLY HA2 A 27 ARG HG2 1.0 . 4.51 1702 1461 A 27 ARG HG3 A 66 GLY HA2 1.0 . 4.51 1703 1462 A 116 ALA HB% A 115 GLY HAx 1.0 . 5.50 1704 1463 A 114 ALA HB% A 115 GLY HAx 1.0 . 5.50 1705 1464 A 43 MET HG2 A 43 MET HA 1.0 . 4.25 1706 1465 A 45 ILE HD1% A 71 GLN H 1.0 . 6.00 1707 1466 A 65 TYR HD1 A 23 ILE HG2% 1.0 . 5.09 1708 1467 A 93 GLY HA2 A 65 TYR HBx 1.0 . 4.01 1709 1467 A 65 TYR HBy A 93 GLY HA2 1.0 . 4.01 1710 1468 A 22 THR HB A 56 LEU HD2% 1.0 . 5.50 1711 1469 A 62 ILE HG2% A 64 VAL HB 1.0 . 5.50 1712 1470 A 26 VAL HG2% A 64 VAL HB 1.0 . 5.50 1713 1471 A 27 ARG HD2 A 28 ASP H 1.0 . 5.50 1714 1472 A 71 GLN H A 71 GLN HB2 1.0 . 3.49 1715 1473 A 78 LEU H A 78 LEU HD1% 1.0 . 4.71 1716 1474 A 77 ASN H A 77 ASN HBy 1.0 . 3.22 1717 1475 A 49 VAL H A 48 LEU HBx 1.0 . 3.37 1718 1475 A 49 VAL H A 48 LEU HBy 1.0 . 3.37 1719 1476 A 13 ARG H A 13 ARG HBx 1.0 . 3.24 1720 1476 A 13 ARG HBy A 13 ARG H 1.0 . 3.24 1721 1477 A 26 VAL HG1% A 26 VAL HA 1.0 . 3.79 1722 1478 A 113 PRO HD2 A 112 THR HA 1.0 . 3.17 1723 1479 A 125 LEU H A 125 LEU HDy% 1.0 . 5.50 1724 1480 A 49 VAL HG2% A 78 LEU HB3 1.0 . 3.66 1725 1481 A 7 ALA HA A 97 TRP HE3 1.0 . 4.44 1726 1482 A 19 PRO HA A 14 LEU HDx% 1.0 . 6.00 1727 1482 A 19 PRO HA A 14 LEU HDy% 1.0 . 6.00 1728 1483 A 84 PHE HB2 A 79 LEU HA 1.0 . 6.00 1729 1484 A 93 GLY H A 90 LEU HD2% 1.0 . 5.50 1730 1485 A 44 PRO HA A 45 ILE HG2% 1.0 . 6.00 1731 1486 A 23 ILE H A 23 ILE HB 1.0 . 3.78 1732 1487 A 104 THR HG2% A 103 PRO HA 1.0 . 6.00 1733 1488 A 7 ALA H A 90 LEU HD1% 1.0 . 6.00 1734 1489 A 1 MET HE% A 63 TYR HA 1.0 . 6.00 1735 1490 A 97 TRP HE1 A 102 GLY HAx 1.0 . 5.62 1736 1490 A 97 TRP HE1 A 102 GLY HAy 1.0 . 5.62 1737 1491 A 90 LEU HD1% A 97 TRP HE3 1.0 . 5.24 1738 1492 A 84 PHE HD% A 56 LEU HBx 1.0 . 5.50 1739 1493 A 48 LEU HD1% A 44 PRO HD2 1.0 . 6.00 1740 1494 A 72 THR H A 71 GLN HB2 1.0 . 4.56 1741 1495 A 42 ALA HB% A 43 MET HA 1.0 . 6.00 1742 1496 A 108 ILE H A 108 ILE HD1% 1.0 . 5.55 1743 1497 A 74 GLN H A 74 GLN HG3 1.0 . 4.63 1744 1498 A 45 ILE HD1% A 74 GLN HG2 1.0 . 5.50 1745 1499 A 26 VAL H A 26 VAL HG1% 1.0 . 4.08 1746 1500 A 79 LEU HG A 76 VAL HA 1.0 . 5.50 1747 1501 A 108 ILE HA A 111 ARG HD2 1.0 . 5.97 1748 1501 A 108 ILE HA A 111 ARG HD3 1.0 . 5.97 1749 1502 A 47 ASP HB2 A 43 MET HA 1.0 . 5.50 1750 1503 A 84 PHE HD% A 56 LEU HD1% 1.0 . 6.00 1751 1504 A 43 MET HE% A 41 MET HE% 1.0 . 4.26 1752 1505 A 22 THR H A 60 ARG HGx 1.0 . 5.05 1753 1505 A 22 THR H A 60 ARG HGy 1.0 . 5.05 1754 1506 A 110 SER H A 109 GLU HA 1.0 . 3.52 1755 1507 A 42 ALA HB% A 32 TYR HBx 1.0 . 6.00 1756 1507 A 42 ALA HB% A 32 TYR HBy 1.0 . 6.00 1757 1508 A 90 LEU HG A 10 LEU HD2% 1.0 . 5.50 1758 1509 A 7 ALA HB% A 10 LEU HD2% 1.0 . 5.50 1759 1510 A 108 ILE HA A 108 ILE HG1x 1.0 . 4.11 1760 1511 A 79 LEU HB2 A 76 VAL HA 1.0 . 4.26 1761 1512 A 60 ARG H A 57 GLU HBx 1.0 . 5.32 1762 1513 A 74 GLN HG3 A 78 LEU HD1% 1.0 . 4.97 1763 1514 A 45 ILE HD1% A 74 GLN HG3 1.0 . 5.26 1764 1515 A 50 ASP HBy A 51 ARG HG2 1.0 . 4.25 1765 1515 A 50 ASP HBx A 51 ARG HG2 1.0 . 4.25 1766 1515 A 51 ARG HG3 A 50 ASP HBx 1.0 . 4.25 1767 1515 A 51 ARG HG3 A 50 ASP HBy 1.0 . 4.25 1768 1516 A 37 ILE HA A 23 ILE HG2% 1.0 . 6.00 1769 1517 A 1 MET HE% A 87 VAL H 1.0 . 6.00 1770 1518 A 29 ARG HB2 A 42 ALA HB% 1.0 . 5.50 1771 1519 A 41 MET H A 24 LEU HD2% 1.0 . 5.04 1772 1520 A 74 GLN HA A 74 GLN HG2 1.0 . 3.53 1773 1521 A 75 ALA HB% A 45 ILE HD1% 1.0 . 3.84 1774 1522 A 120 ASN HBy A 121 VAL HGy% 1.0 . 6.00 1775 1522 A 120 ASN HBy A 121 VAL HGx% 1.0 . 6.00 1776 1523 A 53 SER H A 53 SER HBx 1.0 . 3.83 1777 1524 A 91 LYS HB2 A 4 GLN HE21 1.0 . 6.00 1778 1525 A 29 ARG HB2 A 30 SER H 1.0 . 4.69 1779 1526 A 27 ARG HD3 A 67 ALA HA 1.0 . 3.76 1780 1527 A 66 GLY H A 26 VAL HG2% 1.0 . 5.13 1781 1528 A 21 PHE HE% A 19 PRO HBx 1.0 . 5.50 1782 1528 A 19 PRO HBy A 21 PHE HE% 1.0 . 5.50 1783 1529 A 21 PHE H A 19 PRO HBx 1.0 . 4.56 1784 1529 A 21 PHE H A 19 PRO HBy 1.0 . 4.56 1785 1530 A 111 ARG HD3 A 111 ARG HBy 1.0 . 3.73 1786 1530 A 111 ARG HBy A 111 ARG HD2 1.0 . 3.73 1787 1531 A 75 ALA HA A 78 LEU HB3 1.0 . 4.20 1788 1532 A 18 GLU H A 13 ARG HG2 1.0 . 6.00 1789 1533 A 107 ILE HD1% A 107 ILE HA 1.0 . 4.68 1790 1534 A 38 MET HA A 14 LEU HDx% 1.0 . 6.00 1791 1534 A 38 MET HA A 14 LEU HDy% 1.0 . 6.00 1792 1535 A 62 ILE HD1% A 86 HIS HBx 1.0 . 6.00 1793 1535 A 62 ILE HD1% A 86 HIS HBy 1.0 . 6.00 1794 1536 A 25 ASP H A 41 MET HBx 1.0 . 5.57 1795 1536 A 41 MET HBy A 25 ASP H 1.0 . 5.57 1796 1537 A 14 LEU H A 14 LEU HBx 1.0 . 3.92 1797 1538 A 104 THR HA A 37 ILE HG2% 1.0 . 6.00 1798 1539 A 123 SER H A 122 VAL HB 1.0 . 4.71 1799 1540 A 52 ALA HB% A 24 LEU HD1% 1.0 . 5.76 1800 1541 A 94 LEU HD1% A 98 LYS HD2 1.0 . 5.46 1801 1542 A 90 LEU HD2% A 23 ILE HG2% 1.0 . 6.00 1802 1543 A 58 LYS HA A 58 LYS HG2 1.0 . 3.80 1803 1544 A 22 THR HG2% A 60 ARG HD2 1.0 . 6.00 1804 1545 A 112 THR HG2% A 113 PRO HD3 1.0 . 5.09 1805 1546 A 107 ILE HD1% A 36 HIS HE1 1.0 . 6.00 1806 1547 A 94 LEU HD1% A 98 LYS HEx 1.0 . 5.67 1807 1548 A 32 TYR HD% A 36 HIS HB2 1.0 . 6.00 1808 1549 A 40 ALA HA A 41 MET HG2 1.0 . 4.77 1809 1550 A 76 VAL HG2% A 73 SER HA 1.0 . 4.48 1810 1551 A 98 LYS HA A 98 LYS HEx 1.0 . 5.43 1811 1552 A 26 VAL HB A 45 ILE HG1x 1.0 . 5.50 1812 1553 A 10 LEU HB2 A 7 ALA HA 1.0 . 5.10 1813 1554 A 62 ILE H A 86 HIS HBx 1.0 . 4.67 1814 1554 A 62 ILE H A 86 HIS HBy 1.0 . 4.67 1815 1555 A 9 VAL HG2% A 6 ASP HA 1.0 . 5.50 1816 1556 A 5 SER HA A 9 VAL HG2% 1.0 . 5.50 1817 1557 A 18 GLU HG2 A 18 GLU HA 1.0 . 4.07 1818 1558 A 79 LEU HD2% A 48 LEU HD2% 1.0 . 5.86 1819 1559 A 2 GLU HG2 A 2 GLU HA 1.0 . 3.87 1820 1560 A 43 MET HE% A 56 LEU HD2% 1.0 . 5.50 1821 1561 A 45 ILE HG1y A 26 VAL HB 1.0 . 5.50 1822 1562 A 30 SER H A 28 ASP HBx 1.0 . 4.69 1823 1563 A 11 LYS H A 10 LEU HB3 1.0 . 4.52 1824 1564 A 48 LEU HA A 51 ARG HD3 1.0 . 6.00 1825 1565 A 46 GLU H A 46 GLU HBx 1.0 . 3.17 1826 1565 A 46 GLU H A 46 GLU HBy 1.0 . 3.17 1827 1566 A 27 ARG HD2 A 31 THR HG2% 1.0 . 4.24 1828 1567 A 94 LEU HB3 A 93 GLY HA2 1.0 . 6.00 1829 1568 A 79 LEU H A 48 LEU HD2% 1.0 . 4.27 1830 1569 A 48 LEU HD1% A 79 LEU HD1% 1.0 . 4.74 1831 1570 A 108 ILE HG2% A 109 GLU HG2 1.0 . 5.81 1832 1571 A 84 PHE HE% A 62 ILE HD1% 1.0 . 4.84 1833 1572 A 28 ASP HA A 44 PRO HB2 1.0 . 4.13 1834 1573 A 100 ILE H A 99 ALA HB% 1.0 . 4.48 1835 1574 A 18 GLU HA A 18 GLU HG3 1.0 . 4.21 1836 1575 A 41 MET HG2 A 24 LEU HD2% 1.0 . 5.28 1837 1576 A 48 LEU HA A 43 MET HG3 1.0 . 4.79 1838 1577 A 66 GLY HA2 A 26 VAL HG1% 1.0 . 6.00 1839 1578 A 10 LEU HA A 13 ARG HBx 1.0 . 4.15 1840 1578 A 13 ARG HBy A 10 LEU HA 1.0 . 4.15 1841 1579 A 58 LYS HB3 A 58 LYS HEx 1.0 . 5.83 1842 1579 A 58 LYS HEy A 58 LYS HB3 1.0 . 5.83 1843 1580 A 10 LEU HD1% A 13 ARG HD3 1.0 . 6.00 1844 1581 A 45 ILE H A 44 PRO HB3 1.0 . 4.32 1845 1582 A 5 SER HA A 9 VAL HB 1.0 . 5.12 1846 1583 A 9 VAL HB A 6 ASP HA 1.0 . 5.50 1847 1584 A 41 MET HG2 A 24 LEU HD1% 1.0 . 6.00 1848 1585 A 78 LEU HG A 77 ASN HBy 1.0 . 5.50 1849 1586 A 26 VAL HG2% A 45 ILE HG1x 1.0 . 6.00 1850 1587 A 109 GLU H A 108 ILE HA 1.0 . 3.21 1851 1588 A 84 PHE HD% A 79 LEU HB3 1.0 . 4.31 1852 1589 A 23 ILE H A 22 THR HG2% 1.0 . 4.35 1853 1590 A 107 ILE HD1% A 33 ASN H 1.0 . 6.00 1854 1591 A 85 GLU HB3 A 86 HIS HD2 1.0 . 5.46 1855 1592 A 20 ALA HB% A 18 GLU HG3 1.0 . 6.00 1856 1593 A 63 TYR HE% A 10 LEU HD1% 1.0 . 5.96 1857 1594 A 58 LYS H A 58 LYS HB3 1.0 . 4.06 1858 1595 A 30 SER H A 30 SER HBx 1.0 . 3.07 1859 1595 A 30 SER H A 30 SER HBy 1.0 . 3.07 1860 1596 A 75 ALA HB% A 64 VAL HG2% 1.0 . 6.00 1861 1597 A 52 ALA HB% A 53 SER H 1.0 . 4.25 1862 1598 A 42 ALA H A 41 MET HA 1.0 . 2.98 1863 1599 A 74 GLN HA A 74 GLN HG3 1.0 . 3.69 1864 1600 A 58 LYS HG3 A 84 PHE HA 1.0 . 5.53 1865 1601 A 23 ILE HD1% A 37 ILE HB 1.0 . 5.50 1866 1602 A 98 LYS H A 94 LEU HD1% 1.0 . 5.77 1867 1603 A 13 ARG HG3 A 13 ARG H 1.0 . 5.07 1868 1604 A 48 LEU H A 46 GLU HBx 1.0 . 4.76 1869 1604 A 48 LEU H A 46 GLU HBy 1.0 . 4.76 1870 1605 A 11 LYS HG3 A 97 TRP HH2 1.0 . 6.00 1871 1606 A 10 LEU HD2% A 63 TYR HB3 1.0 . 6.00 1872 1607 A 64 VAL HA A 76 VAL HG2% 1.0 . 6.00 1873 1608 A 81 SER H A 78 LEU HG 1.0 . 6.00 1874 1609 A 93 GLY HA3 A 90 LEU HD2% 1.0 . 6.00 1875 1610 A 72 THR HG2% A 89 GLU HA 1.0 . 4.93 1876 1611 A 12 SER HA A 16 TRP HB2 1.0 . 5.50 1877 1612 A 112 THR HB A 113 PRO HD2 1.0 . 4.20 1878 1613 A 26 VAL HG2% A 66 GLY HA2 1.0 . 4.09 1879 1614 A 49 VAL HG1% A 50 ASP HBx 1.0 . 5.50 1880 1614 A 49 VAL HG1% A 50 ASP HBy 1.0 . 5.50 1881 1615 A 107 ILE HD1% A 33 ASN HB2 1.0 . 5.41 1882 1616 A 100 ILE HD1% A 11 LYS HG2 1.0 . 6.00 1883 1617 A 67 ALA H A 71 GLN HB2 1.0 . 5.00 1884 1618 A 79 LEU HD2% A 84 PHE HB3 1.0 . 6.00 1885 1619 A 48 LEU H A 48 LEU HD2% 1.0 . 4.52 1886 1620 A 98 LYS HA A 102 GLY HAx 1.0 . 5.42 1887 1620 A 98 LYS HA A 102 GLY HAy 1.0 . 5.42 1888 1621 A 90 LEU H A 64 VAL HG2% 1.0 . 6.00 1889 1622 A 44 PRO HD3 A 43 MET HA 1.0 . 3.33 1890 1623 A 79 LEU HD2% A 49 VAL HG1% 1.0 . 6.00 1891 1624 A 4 GLN HE22 A 3 PRO HB2 1.0 . 6.00 1892 1625 A 46 GLU HG3 A 44 PRO HG2 1.0 . 4.58 1893 1625 A 44 PRO HG2 A 46 GLU HG2 1.0 . 4.58 1894 1626 A 108 ILE HG2% A 111 ARG HD2 1.0 . 5.50 1895 1626 A 108 ILE HG2% A 111 ARG HD3 1.0 . 5.50 1896 1627 A 40 ALA HA A 41 MET HBx 1.0 . 4.83 1897 1627 A 41 MET HBy A 40 ALA HA 1.0 . 4.83 1898 1628 A 75 ALA HB% A 76 VAL HA 1.0 . 6.00 1899 1629 A 37 ILE HA A 104 THR HB 1.0 . 5.50 1900 1630 A 97 TRP HZ2 A 102 GLY HAx 1.0 . 6.00 1901 1630 A 97 TRP HZ2 A 102 GLY HAy 1.0 . 6.00 1902 1631 A 84 PHE HZ A 53 SER HA 1.0 . 3.57 1903 1632 A 110 SER H A 109 GLU HBx 1.0 . 4.73 1904 1633 A 91 LYS HEy A 91 LYS HG2 1.0 . 3.59 1905 1633 A 91 LYS HEx A 91 LYS HG2 1.0 . 3.59 1906 1633 A 91 LYS HG3 A 91 LYS HEx 1.0 . 3.59 1907 1633 A 91 LYS HG3 A 91 LYS HEy 1.0 . 3.59 1908 1634 A 24 LEU HB3 A 43 MET HBx 1.0 . 5.96 1909 1634 A 43 MET HBy A 24 LEU HB3 1.0 . 5.96 1910 1635 A 64 VAL HG1% A 76 VAL HA 1.0 . 5.50 1911 1636 A 33 ASN HA A 107 ILE HB 1.0 . 6.00 1912 1637 A 48 LEU HD1% A 43 MET HG3 1.0 . 4.57 1913 1638 A 82 ALA H A 81 SER HBy 1.0 . 5.50 1914 1639 A 108 ILE HB A 106 GLY HAx 1.0 . 6.00 1915 1639 A 108 ILE HB A 106 GLY HAy 1.0 . 6.00 1916 1640 A 14 LEU HDy% A 103 PRO HG2 1.0 . 4.38 1917 1640 A 14 LEU HDx% A 103 PRO HG2 1.0 . 4.38 1918 1640 A 103 PRO HG3 A 14 LEU HDx% 1.0 . 4.38 1919 1640 A 103 PRO HG3 A 14 LEU HDy% 1.0 . 4.38 1920 1641 A 57 GLU H A 56 LEU HD2% 1.0 . 4.72 1921 1642 A 24 LEU HA A 41 MET HG3 1.0 . 6.00 1922 1643 A 76 VAL HG1% A 87 VAL HB 1.0 . 5.07 1923 1644 A 47 ASP HB3 A 51 ARG HD3 1.0 . 6.00 1924 1645 A 43 MET HG2 A 51 ARG HD3 1.0 . 5.75 1925 1646 A 103 PRO HB3 A 14 LEU HDx% 1.0 . 6.00 1926 1646 A 103 PRO HB3 A 14 LEU HDy% 1.0 . 6.00 1927 1647 A 44 PRO HB3 A 29 ARG HG3 1.0 . 6.00 1928 1648 A 49 VAL HG2% A 48 LEU HBx 1.0 . 4.52 1929 1648 A 49 VAL HG2% A 48 LEU HBy 1.0 . 4.52 1930 1649 A 49 VAL HG2% A 82 ALA HB% 1.0 . 5.26 1931 1650 A 65 TYR H A 23 ILE HG2% 1.0 . 6.00 1932 1651 A 11 LYS HD3 A 102 GLY HAx 1.0 . 5.74 1933 1651 A 11 LYS HD3 A 102 GLY HAy 1.0 . 5.74 1934 1652 A 43 MET HG2 A 48 LEU HD1% 1.0 . 5.46 1935 1653 A 44 PRO HB2 A 46 GLU HG2 1.0 . 4.99 1936 1653 A 44 PRO HB2 A 46 GLU HG3 1.0 . 4.99 1937 1654 A 93 GLY H A 91 LYS HB3 1.0 . 5.84 1938 1655 A 11 LYS H A 9 VAL HB 1.0 . 5.50 1939 1656 A 8 HIS H A 9 VAL HB 1.0 . 5.50 1940 1657 A 113 PRO HD3 A 112 THR HA 1.0 . 3.42 1941 1658 A 35 GLY HAy A 109 GLU HBx 1.0 . 5.50 1942 1658 A 109 GLU HBx A 35 GLY HAx 1.0 . 5.50 1943 1659 A 104 THR HB A 109 GLU HBx 1.0 . 5.50 1944 1660 A 58 LYS HA A 82 ALA HB% 1.0 . 6.00 1945 1661 A 56 LEU HD2% A 55 SER HBx 1.0 . 5.09 1946 1661 A 55 SER HBy A 56 LEU HD2% 1.0 . 5.09 1947 1662 A 91 LYS HA A 91 LYS HD2 1.0 . 4.15 1948 1662 A 91 LYS HA A 91 LYS HD3 1.0 . 4.15 1949 1663 A 84 PHE HD% A 84 PHE HA 1.0 . 4.05 1950 1664 A 104 THR HA A 37 ILE HA 1.0 . 4.00 1951 1665 A 8 HIS HA A 100 ILE HG2% 1.0 . 6.00 1952 1666 A 79 LEU HA A 79 LEU HG 1.0 . 4.07 1953 1667 A 79 LEU HD2% A 79 LEU HB3 1.0 . 4.14 1954 1668 A 79 LEU HD2% A 52 ALA HB% 1.0 . 4.45 1955 1669 A 76 VAL HG2% A 63 TYR HA 1.0 . 6.00 1956 1670 A 42 ALA HB% A 41 MET HE% 1.0 . 6.00 1957 1671 A 84 PHE HD% A 58 LYS HG2 1.0 . 6.00 1958 1672 A 80 ARG HG3 A 76 VAL HG1% 1.0 . 5.28 1959 1673 A 81 SER H A 77 ASN HBy 1.0 . 6.00 1960 1674 A 73 SER H A 72 THR HB 1.0 . 3.40 1961 1675 A 48 LEU HD1% A 43 MET HA 1.0 . 6.00 1962 1676 A 108 ILE HD1% A 106 GLY HAx 1.0 . 5.50 1963 1676 A 106 GLY HAy A 108 ILE HD1% 1.0 . 5.50 1964 1677 A 108 ILE HD1% A 110 SER HBx 1.0 . 5.50 1965 1677 A 110 SER HBy A 108 ILE HD1% 1.0 . 5.50 1966 1678 A 93 GLY H A 90 LEU HD1% 1.0 . 6.00 1967 1679 A 47 ASP HB2 A 51 ARG H 1.0 . 6.00 1968 1680 A 67 ALA H A 27 ARG HG2 1.0 . 4.14 1969 1680 A 67 ALA H A 27 ARG HG3 1.0 . 4.14 1970 1681 A 13 ARG HD3 A 13 ARG HBx 1.0 . 4.16 1971 1681 A 13 ARG HBy A 13 ARG HD3 1.0 . 4.16 1972 1682 A 63 TYR H A 62 ILE HD1% 1.0 . 6.00 1973 1683 A 49 VAL HG2% A 49 VAL HA 1.0 . 3.74 1974 1684 A 62 ILE H A 61 ASP HA 1.0 . 3.31 1975 1685 A 94 LEU HD1% A 98 LYS HG3 1.0 . 6.00 1976 1686 A 64 VAL HG1% A 24 LEU H 1.0 . 6.00 1977 1687 A 51 ARG HA A 51 ARG HG2 1.0 . 3.11 1978 1687 A 51 ARG HG3 A 51 ARG HA 1.0 . 3.11 1979 1688 A 31 THR HG2% A 27 ARG HBy 1.0 . 4.26 1980 1688 A 31 THR HG2% A 27 ARG HBx 1.0 . 4.26 1981 1689 A 39 GLY H A 38 MET HBy 1.0 . 4.78 1982 1690 A 104 THR H A 104 THR HG2% 1.0 . 5.01 1983 1691 A 30 SER HA A 33 ASN HB3 1.0 . 4.74 1984 1692 A 79 LEU HB2 A 76 VAL HG2% 1.0 . 6.00 1985 1693 A 55 SER HBy A 56 LEU HG 1.0 . 4.74 1986 1694 A 41 MET HA A 24 LEU HD2% 1.0 . 6.00 1987 1695 A 68 GLY H A 67 ALA HB% 1.0 . 4.54 1988 1696 A 79 LEU HD2% A 56 LEU HD1% 1.0 . 6.00 1989 1697 A 63 TYR H A 23 ILE HG2% 1.0 . 5.50 1990 1698 A 72 THR HG2% A 65 TYR H 1.0 . 6.00 1991 1699 A 108 ILE H A 107 ILE HB 1.0 . 3.56 1992 1700 A 107 ILE H A 107 ILE HB 1.0 . 3.87 1993 1701 A 49 VAL H A 78 LEU HD1% 1.0 . 6.00 1994 1702 A 94 LEU HD1% A 37 ILE HA 1.0 . 5.20 1995 1703 A 66 GLY HA3 A 71 GLN HB2 1.0 . 6.00 1996 1704 A 9 VAL HG1% A 10 LEU HA 1.0 . 6.00 1997 1705 A 7 ALA HB% A 97 TRP HB3 1.0 . 5.50 1998 1706 A 52 ALA HB% A 84 PHE HE% 1.0 . 4.52 1999 1707 A 67 ALA HB% A 71 GLN HB3 1.0 . 4.71 2000 1708 A 36 HIS HE1 A 107 ILE HG1y 1.0 . 6.00 2001 1709 A 74 GLN H A 74 GLN HG2 1.0 . 3.86 2002 1710 A 79 LEU HD2% A 79 LEU HA 1.0 . 3.66 2003 1711 A 23 ILE HD1% A 14 LEU HDx% 1.0 . 5.25 2004 1711 A 23 ILE HD1% A 14 LEU HDy% 1.0 . 5.25 2005 1712 A 25 ASP H A 25 ASP HBx 1.0 . 4.07 2006 1713 A 122 VAL H A 122 VAL HGx% 1.0 . 5.03 2007 1713 A 122 VAL H A 122 VAL HGy% 1.0 . 5.03 2008 1714 A 104 THR HG2% A 103 PRO HDx 1.0 . 5.50 2009 1714 A 104 THR HG2% A 103 PRO HDy 1.0 . 5.50 2010 1715 A 14 LEU HDy% A 103 PRO HDx 1.0 . 4.55 2011 1715 A 14 LEU HDx% A 103 PRO HDx 1.0 . 4.55 2012 1715 A 103 PRO HDy A 14 LEU HDx% 1.0 . 4.55 2013 1715 A 103 PRO HDy A 14 LEU HDy% 1.0 . 4.55 2014 1716 A 60 ARG HD3 A 61 ASP H 1.0 . 5.02 2015 1717 A 104 THR HG2% A 98 LYS HEy 1.0 . 5.78 2016 1718 A 79 LEU HD2% A 48 LEU HBx 1.0 . 5.37 2017 1718 A 79 LEU HD2% A 48 LEU HBy 1.0 . 5.37 2018 1719 A 58 LYS H A 58 LYS HG2 1.0 . 3.62 2019 1720 A 22 THR H A 22 THR HG2% 1.0 . 5.91 2020 1721 A 13 ARG HG3 A 21 PHE HD% 1.0 . 6.00 2021 1722 A 97 TRP HA A 7 ALA HB% 1.0 . 3.74 2022 1723 A 32 TYR HD% A 33 ASN HB3 1.0 . 6.00 2023 1724 A 58 LYS HG2 A 58 LYS HEx 1.0 . 3.87 2024 1724 A 58 LYS HG2 A 58 LYS HEy 1.0 . 3.87 2025 1725 A 7 ALA HB% A 97 TRP HE3 1.0 . 3.79 2026 1726 A 97 TRP H A 97 TRP HB2 1.0 . 3.40 2027 1727 A 80 ARG HG3 A 80 ARG H 1.0 . 4.16 2028 1728 A 100 ILE HD1% A 102 GLY HAx 1.0 . 5.50 2029 1728 A 100 ILE HD1% A 102 GLY HAy 1.0 . 5.50 2030 1729 A 45 ILE H A 45 ILE HG1x 1.0 . 5.20 2031 1730 A 49 VAL HG1% A 82 ALA HA 1.0 . 6.00 2032 1731 A 13 ARG HA A 16 TRP HB2 1.0 . 5.69 2033 1732 A 84 PHE HA A 58 LYS HB3 1.0 . 4.31 2034 1733 A 38 MET H A 14 LEU HDx% 1.0 . 6.00 2035 1733 A 38 MET H A 14 LEU HDy% 1.0 . 6.00 2036 1734 A 22 THR HG2% A 41 MET HG3 1.0 . 4.99 2037 1735 A 100 ILE HD1% A 11 LYS HEx 1.0 . 6.00 2038 1736 A 2 GLU HA A 3 PRO HG3 1.0 . 5.06 2039 1737 A 78 LEU HD2% A 75 ALA HA 1.0 . 5.65 2040 1738 A 72 THR HG2% A 66 GLY HA3 1.0 . 6.00 2041 1739 A 90 LEU HD1% A 10 LEU HD1% 1.0 . 6.00 2042 1740 A 80 ARG HBy A 80 ARG HD2 1.0 . 4.13 2043 1740 A 80 ARG HD2 A 80 ARG HBx 1.0 . 4.13 2044 1741 A 88 SER H A 87 VAL HB 1.0 . 5.50 2045 1742 A 80 ARG H A 87 VAL HB 1.0 . 5.50 2046 1743 A 94 LEU HD2% A 94 LEU HB3 1.0 . 4.13 2047 1744 A 99 ALA H A 97 TRP HB2 1.0 . 5.90 2048 1745 A 94 LEU H A 94 LEU HD1% 1.0 . 5.91 2049 1746 A 79 LEU HA A 79 LEU HD1% 1.0 . 4.99 2050 1747 A 19 PRO HD3 A 18 GLU HG3 1.0 . 5.30 2051 1748 A 52 ALA HB% A 51 ARG HBx 1.0 . 5.50 2052 1749 A 7 ALA HB% A 100 ILE HG2% 1.0 . 5.50 2053 1750 A 94 LEU HD1% A 36 HIS HA 1.0 . 4.79 2054 1751 A 106 GLY HAy A 109 GLU HBx 1.0 . 5.18 2055 1751 A 109 GLU HBx A 106 GLY HAx 1.0 . 5.18 2056 1752 A 90 LEU HD1% A 7 ALA HA 1.0 . 4.24 2057 1753 A 79 LEU HD2% A 84 PHE HB2 1.0 . 6.00 2058 1754 A 41 MET H A 41 MET HBx 1.0 . 3.72 2059 1754 A 41 MET HBy A 41 MET H 1.0 . 3.72 2060 1755 A 42 ALA HB% A 44 PRO HD2 1.0 . 4.95 2061 1756 A 15 GLU HB3 A 15 GLU H 1.0 . 3.89 2062 1757 A 94 LEU HD1% A 35 GLY HAx 1.0 . 5.50 2063 1757 A 94 LEU HD1% A 35 GLY HAy 1.0 . 5.50 2064 1758 A 13 ARG HD2 A 13 ARG HBx 1.0 . 4.22 2065 1758 A 13 ARG HBy A 13 ARG HD2 1.0 . 4.22 2066 1759 A 108 ILE HA A 108 ILE HD1% 1.0 . 4.42 2067 1760 A 84 PHE HB2 A 80 ARG HBx 1.0 . 5.50 2068 1760 A 84 PHE HB2 A 80 ARG HBy 1.0 . 5.50 2069 1761 A 84 PHE HB2 A 79 LEU HB2 1.0 . 5.13 2070 1762 A 4 GLN HA A 89 GLU HBx 1.0 . 4.64 2071 1762 A 89 GLU HBy A 4 GLN HA 1.0 . 4.64 2072 1763 A 80 ARG HE A 87 VAL HG2% 1.0 . 6.00 2073 1764 A 114 ALA H A 113 PRO HA 1.0 . 3.27 2074 1765 A 125 LEU H A 124 ARG HBy 1.0 . 5.50 2075 1766 A 52 ALA H A 48 LEU HA 1.0 . 5.17 2076 1767 A 98 LYS HA A 11 LYS HD2 1.0 . 6.00 2077 1768 A 79 LEU HD2% A 53 SER H 1.0 . 6.00 2078 1769 A 96 ALA HB% A 92 GLY H 1.0 . 6.00 2079 1770 A 64 VAL HA A 65 TYR H 1.0 . 3.02 2080 1771 A 108 ILE H A 108 ILE HG1x 1.0 . 4.16 2081 1772 A 43 MET HG3 A 43 MET HA 1.0 . 3.94 2082 1773 A 100 ILE H A 100 ILE HG2% 1.0 . 3.71 2083 1774 A 98 LYS H A 98 LYS HD2 1.0 . 4.98 2084 1775 A 45 ILE H A 45 ILE HG1y 1.0 . 5.20 2085 1776 A 109 GLU HG2 A 35 GLY HAx 1.0 . 4.26 2086 1776 A 35 GLY HAy A 109 GLU HG2 1.0 . 4.26 2087 1777 A 100 ILE H A 100 ILE HG1x 1.0 . 4.00 2088 1778 A 70 GLU H A 70 GLU HGx 1.0 . 4.01 2089 1778 A 70 GLU H A 70 GLU HGy 1.0 . 4.01 2090 1779 A 76 VAL HG2% A 72 THR HA 1.0 . 6.00 2091 1780 A 7 ALA HB% A 90 LEU HD2% 1.0 . 6.00 2092 1781 A 94 LEU HD1% A 98 LYS HD3 1.0 . 5.49 2093 1782 A 6 ASP HA A 91 LYS HD2 1.0 . 5.31 2094 1782 A 91 LYS HD3 A 6 ASP HA 1.0 . 5.31 2095 1783 A 29 ARG H A 28 ASP HA 1.0 . 3.09 2096 1784 A 97 TRP HE1 A 14 LEU HDx% 1.0 . 6.00 2097 1784 A 97 TRP HE1 A 14 LEU HDy% 1.0 . 6.00 2098 1785 A 64 VAL HG1% A 65 TYR H 1.0 . 3.97 2099 1786 A 75 ALA HA A 26 VAL HG1% 1.0 . 5.50 2100 1787 A 45 ILE HA A 26 VAL HG1% 1.0 . 5.50 2101 1788 A 34 ASP H A 31 THR HG2% 1.0 . 6.00 2102 1789 A 19 PRO HD2 A 18 GLU HA 1.0 . 3.09 2103 1790 A 99 ALA H A 100 ILE HG2% 1.0 . 5.50 2104 1791 A 72 THR HG2% A 65 TYR HA 1.0 . 4.26 2105 1792 A 24 LEU HA A 24 LEU HD1% 1.0 . 5.99 2106 1793 A 40 ALA HB% A 41 MET HG2 1.0 . 6.00 2107 1794 A 24 LEU HA A 41 MET HG2 1.0 . 5.38 2108 1795 A 84 PHE HE% A 58 LYS HD2 1.0 . 5.84 2109 1796 A 107 ILE HD1% A 33 ASN HD2x 1.0 . 6.00 2110 1797 A 15 GLU HG3 A 14 LEU HBx 1.0 . 6.00 2111 1798 A 1 MET HE% A 62 ILE HA 1.0 . 6.00 2112 1799 A 38 MET HA A 40 ALA H 1.0 . 4.32 2113 1800 A 121 VAL HB A 121 VAL H 1.0 . 3.55 2114 1801 A 6 ASP H A 9 VAL HG2% 1.0 . 4.93 2115 1802 A 79 LEU HD2% A 52 ALA H 1.0 . 6.00 2116 1803 A 71 GLN HE22 A 45 ILE HG2% 1.0 . 5.13 2117 1804 A 47 ASP HB3 A 44 PRO HG2 1.0 . 5.50 2118 1805 A 97 TRP HH2 A 14 LEU HDx% 1.0 . 4.11 2119 1805 A 97 TRP HH2 A 14 LEU HDy% 1.0 . 4.11 2120 1806 A 27 ARG H A 26 VAL HG2% 1.0 . 4.79 2121 1807 A 55 SER H A 43 MET HE% 1.0 . 6.00 2122 1808 A 16 TRP HB3 A 12 SER HA 1.0 . 5.50 2123 1809 A 32 TYR HD% A 32 TYR HA 1.0 . 4.40 2124 1810 A 52 ALA HB% A 79 LEU HA 1.0 . 5.55 2125 1811 A 99 ALA H A 95 ALA HA 1.0 . 5.61 2126 1812 A 94 LEU HD1% A 98 LYS HEy 1.0 . 5.67 2127 1813 A 33 ASN H A 30 SER HBx 1.0 . 5.50 2128 1813 A 33 ASN H A 30 SER HBy 1.0 . 5.50 2129 1814 A 29 ARG H A 30 SER HBx 1.0 . 5.50 2130 1814 A 29 ARG H A 30 SER HBy 1.0 . 5.50 2131 1815 A 90 LEU H A 65 TYR HA 1.0 . 5.86 2132 1816 A 104 THR HA A 105 GLU H 1.0 . 3.36 2133 1817 A 75 ALA H A 74 GLN HBy 1.0 . 4.14 2134 1818 A 93 GLY HA3 A 96 ALA H 1.0 . 4.90 2135 1819 A 107 ILE H A 106 GLY HAx 1.0 . 2.93 2136 1819 A 107 ILE H A 106 GLY HAy 1.0 . 2.93 2137 1820 A 52 ALA H A 24 LEU HD1% 1.0 . 6.00 2138 1821 A 21 PHE HD% A 13 ARG HG2 1.0 . 6.00 2139 1822 A 41 MET HG2 A 41 MET HA 1.0 . 3.98 2140 1823 A 23 ILE HG2% A 37 ILE HB 1.0 . 5.11 2141 1824 A 37 ILE HG2% A 38 MET HBy 1.0 . 6.00 2142 1825 A 94 LEU HD1% A 97 TRP HD1 1.0 . 4.62 2143 1826 A 20 ALA HB% A 60 ARG HD2 1.0 . 6.00 2144 1827 A 100 ILE HD1% A 11 LYS HB3 1.0 . 5.16 2145 1828 A 94 LEU HD1% A 97 TRP H 1.0 . 6.00 2146 1829 A 97 TRP HZ2 A 103 PRO HB2 1.0 . 6.00 2147 1830 A 97 TRP HA A 94 LEU HA 1.0 . 5.50 2148 1831 A 95 ALA HA A 94 LEU HA 1.0 . 5.50 2149 1832 A 45 ILE H A 26 VAL HG1% 1.0 . 5.50 2150 1833 A 27 ARG H A 26 VAL HG1% 1.0 . 5.50 2151 1834 A 37 ILE HG2% A 103 PRO HDx 1.0 . 6.00 2152 1834 A 37 ILE HG2% A 103 PRO HDy 1.0 . 6.00 2153 1835 A 74 GLN HE2y A 70 GLU HGx 1.0 . 6.00 2154 1835 A 74 GLN HE2y A 70 GLU HGy 1.0 . 6.00 2155 1836 A 106 GLY H A 105 GLU HA 1.0 . 3.02 2156 1837 A 79 LEU H A 87 VAL HG1% 1.0 . 6.00 2157 1838 A 56 LEU HA A 57 GLU HBy 1.0 . 5.74 2158 1839 A 40 ALA HB% A 37 ILE HB 1.0 . 4.06 2159 1840 A 89 GLU HG2 A 76 VAL HG2% 1.0 . 4.70 2160 1841 A 84 PHE HE% A 58 LYS HEx 1.0 . 4.15 2161 1841 A 84 PHE HE% A 58 LYS HEy 1.0 . 4.15 2162 1842 A 64 VAL HA A 64 VAL HG1% 1.0 . 3.89 2163 1843 A 34 ASP HA A 107 ILE HG2% 1.0 . 5.46 2164 1844 A 29 ARG HD3 A 29 ARG HB3 1.0 . 3.93 2165 1844 A 29 ARG HB3 A 29 ARG HD2 1.0 . 3.93 2166 1845 A 98 LYS H A 97 TRP HB3 1.0 . 3.99 2167 1846 A 84 PHE HD% A 58 LYS HD2 1.0 . 6.00 2168 1847 A 10 LEU HD2% A 97 TRP HH2 1.0 . 5.50 2169 1848 A 75 ALA HA A 78 LEU HB2 1.0 . 3.95 2170 1849 A 51 ARG H A 51 ARG HD3 1.0 . 5.25 2171 1850 A 56 LEU H A 52 ALA HA 1.0 . 4.21 2172 1851 A 41 MET HG2 A 41 MET HE% 1.0 . 4.26 2173 1852 A 45 ILE HA A 45 ILE HG1y 1.0 . 3.64 2174 1853 A 94 LEU HD1% A 37 ILE HG2% 1.0 . 6.00 2175 1854 A 22 THR HG2% A 41 MET HG2 1.0 . 5.61 2176 1855 A 97 TRP HZ3 A 100 ILE HD1% 1.0 . 6.00 2177 1856 A 105 GLU HG3 A 104 THR H 1.0 . 5.50 2178 1857 A 95 ALA H A 94 LEU HB2 1.0 . 4.49 2179 1858 A 80 ARG HE A 76 VAL HG1% 1.0 . 5.50 2180 1859 A 37 ILE HD1% A 23 ILE HG2% 1.0 . 5.34 2181 1860 A 75 ALA HB% A 74 GLN HA 1.0 . 5.50 2182 1861 A 75 ALA HB% A 73 SER HA 1.0 . 5.50 2183 1862 A 37 ILE HD1% A 94 LEU HA 1.0 . 5.54 2184 1863 A 84 PHE HD% A 83 GLY HA3 1.0 . 5.50 2185 1864 A 82 ALA H A 83 GLY HA3 1.0 . 5.50 2186 1865 A 14 LEU HDy% A 38 MET HBy 1.0 . 6.00 2187 1865 A 14 LEU HDx% A 38 MET HBy 1.0 . 6.00 2188 1866 A 54 SER H A 54 SER HBx 1.0 . 3.77 2189 1867 A 24 LEU HB3 A 24 LEU HD2% 1.0 . 4.12 2190 1868 A 64 VAL HB A 76 VAL HA 1.0 . 5.50 2191 1869 A 52 ALA H A 43 MET HE% 1.0 . 5.35 2192 1870 A 48 LEU H A 48 LEU HBx 1.0 . 2.94 2193 1870 A 48 LEU H A 48 LEU HBy 1.0 . 2.94 2194 1871 A 48 LEU HD1% A 79 LEU HA 1.0 . 6.00 2195 1872 A 11 LYS H A 9 VAL HA 1.0 . 5.53 2196 1873 A 21 PHE HD% A 10 LEU HD1% 1.0 . 5.50 2197 1874 A 48 LEU HA A 24 LEU HD1% 1.0 . 6.00 2198 1875 A 74 GLN HE2x A 70 GLU HGx 1.0 . 6.00 2199 1875 A 74 GLN HE2x A 70 GLU HGy 1.0 . 6.00 2200 1876 A 80 ARG HA A 80 ARG HG2 1.0 . 3.97 2201 1877 A 84 PHE HB3 A 79 LEU HB2 1.0 . 6.00 2202 1878 A 27 ARG HD2 A 67 ALA HA 1.0 . 4.51 2203 1879 A 49 VAL HG2% A 50 ASP HBx 1.0 . 6.00 2204 1879 A 49 VAL HG2% A 50 ASP HBy 1.0 . 6.00 2205 1880 A 79 LEU HD1% A 87 VAL HB 1.0 . 6.00 2206 1881 A 64 VAL HB A 63 TYR HA 1.0 . 4.75 2207 1882 A 108 ILE HG2% A 109 GLU HA 1.0 . 6.00 2208 1883 A 12 SER H A 11 LYS HG2 1.0 . 6.00 2209 1884 A 7 ALA H A 6 ASP HBx 1.0 . 4.75 2210 1885 A 107 ILE HD1% A 34 ASP HA 1.0 . 5.36 2211 1886 A 112 THR HB A 113 PRO HD3 1.0 . 3.92 2212 1887 A 42 ALA HB% A 29 ARG HD2 1.0 . 4.07 2213 1887 A 29 ARG HD3 A 42 ALA HB% 1.0 . 4.07 2214 1888 A 26 VAL HG2% A 65 TYR HA 1.0 . 6.00 2215 1889 A 79 LEU HD2% A 49 VAL HG2% 1.0 . 5.55 2216 1890 A 58 LYS HA A 84 PHE HA 1.0 . 4.89 2217 1891 A 55 SER HBy A 43 MET HE% 1.0 . 5.17 2218 1892 A 23 ILE HA A 63 TYR HB2 1.0 . 4.36 2219 1893 A 27 ARG H A 66 GLY HA2 1.0 . 5.90 2220 1894 A 97 TRP H A 97 TRP HB3 1.0 . 3.43 2221 1895 A 30 SER H A 29 ARG HB3 1.0 . 4.11 2222 1896 A 98 LYS HG2 A 97 TRP HD1 1.0 . 5.26 2223 1897 A 44 PRO HG3 A 42 ALA HB% 1.0 . 5.14 2224 1898 A 22 THR HB A 56 LEU HD1% 1.0 . 4.79 2225 1899 A 9 VAL H A 9 VAL HG2% 1.0 . 4.03 2226 1900 A 7 ALA HB% A 100 ILE HG1y 1.0 . 6.00 2227 1901 A 45 ILE HD1% A 66 GLY HA2 1.0 . 5.50 2228 1902 A 45 ILE HD1% A 27 ARG HA 1.0 . 5.50 2229 1903 A 78 LEU HD2% A 79 LEU H 1.0 . 6.00 2230 1904 A 10 LEU HG A 21 PHE HE% 1.0 . 5.50 2231 1905 A 10 LEU H A 10 LEU HG 1.0 . 5.50 2232 1906 A 84 PHE HE% A 58 LYS HB3 1.0 . 6.00 2233 1907 A 26 VAL HG2% A 71 GLN HE22 1.0 . 6.00 2234 1908 A 85 GLU HB3 A 85 GLU H 1.0 . 4.19 2235 1909 A 97 TRP HB2 A 97 TRP HE3 1.0 . 4.07 2236 1910 A 87 VAL HA A 87 VAL HG2% 1.0 . 4.15 2237 1911 A 43 MET HA A 51 ARG HD2 1.0 . 6.00 2238 1912 A 57 GLU H A 56 LEU HBy 1.0 . 4.68 2239 1913 A 105 GLU H A 109 GLU HG3 1.0 . 5.30 2240 1914 A 100 ILE HD1% A 100 ILE HA 1.0 . 5.35 2241 1915 A 14 LEU H A 14 LEU HDx% 1.0 . 5.61 2242 1915 A 14 LEU H A 14 LEU HDy% 1.0 . 5.61 2243 1916 A 98 LYS HG3 A 97 TRP HD1 1.0 . 4.45 2244 1917 A 45 ILE HA A 48 LEU HBx 1.0 . 3.07 2245 1917 A 45 ILE HA A 48 LEU HBy 1.0 . 3.07 2246 1918 A 94 LEU HD1% A 37 ILE HD1% 1.0 . 5.62 2247 1919 A 102 GLY HAx A 103 PRO HG2 1.0 . 5.74 2248 1919 A 102 GLY HAy A 103 PRO HG2 1.0 . 5.74 2249 1919 A 103 PRO HG3 A 102 GLY HAx 1.0 . 5.74 2250 1919 A 103 PRO HG3 A 102 GLY HAy 1.0 . 5.74 2251 1920 A 89 GLU HA A 90 LEU HB2 1.0 . 5.66 2252 1921 A 112 THR HG2% A 111 ARG HA 1.0 . 6.00 2253 1922 A 58 LYS HB2 A 59 SER HA 1.0 . 5.05 2254 1923 A 85 GLU HB3 A 59 SER HA 1.0 . 5.46 2255 1924 A 100 ILE HD1% A 11 LYS HB2 1.0 . 6.00 2256 1925 A 49 VAL HG1% A 82 ALA HB% 1.0 . 4.19 2257 1926 A 94 LEU HD2% A 37 ILE HA 1.0 . 5.50 2258 1927 A 94 LEU HD2% A 27 ARG HD2 1.0 . 5.50 2259 1928 A 9 VAL HA A 9 VAL HG2% 1.0 . 3.86 2260 1929 A 23 ILE HD1% A 10 LEU HG 1.0 . 6.00 2261 1930 A 112 THR HA A 113 PRO HG3 1.0 . 6.00 2262 1931 A 67 ALA HB% A 71 GLN HB2 1.0 . 5.61 2263 1932 A 10 LEU HD1% A 23 ILE HG2% 1.0 . 6.00 2264 1933 A 1 MET HBy A 86 HIS HBx 1.0 . 5.37 2265 1933 A 1 MET HBx A 86 HIS HBx 1.0 . 5.37 2266 1933 A 86 HIS HBy A 1 MET HBx 1.0 . 5.37 2267 1933 A 1 MET HBy A 86 HIS HBy 1.0 . 5.37 2268 1934 A 49 VAL HG1% A 49 VAL HA 1.0 . 3.95 2269 1935 A 90 LEU HD1% A 65 TYR HBx 1.0 . 6.00 2270 1935 A 65 TYR HBy A 90 LEU HD1% 1.0 . 6.00 2271 1936 A 43 MET HA A 44 PRO HG2 1.0 . 5.50 2272 1937 A 84 PHE HE% A 56 LEU HD1% 1.0 . 5.94 2273 1938 A 97 TRP HE1 A 104 THR HG2% 1.0 . 4.65 2274 1939 A 64 VAL H A 72 THR HG2% 1.0 . 6.00 2275 1940 A 48 LEU HD1% A 48 LEU HA 1.0 . 3.74 2276 1941 A 11 LYS HB2 A 8 HIS HA 1.0 . 4.65 2277 1942 A 79 LEU HD2% A 24 LEU HD2% 1.0 . 6.00 2278 1943 A 88 SER H A 87 VAL HG2% 1.0 . 5.50 2279 1944 A 80 ARG H A 87 VAL HG2% 1.0 . 5.50 2280 1945 A 43 MET HA A 29 ARG HD2 1.0 . 6.00 2281 1945 A 29 ARG HD3 A 43 MET HA 1.0 . 6.00 2282 1946 A 22 THR HG2% A 56 LEU HD2% 1.0 . 4.64 2283 1947 A 15 GLU HG2 A 15 GLU HA 1.0 . 3.65 2284 1948 A 56 LEU H A 56 LEU HG 1.0 . 3.93 2285 1949 A 66 GLY HA2 A 27 ARG HBy 1.0 . 5.50 2286 1949 A 27 ARG HBx A 66 GLY HA2 1.0 . 5.50 2287 1950 A 66 GLY HA2 A 71 GLN HB3 1.0 . 5.50 2288 1951 A 22 THR HB A 22 THR H 1.0 . 3.76 2289 1952 A 90 LEU HD1% A 63 TYR HB3 1.0 . 6.00 2290 1953 A 90 LEU HD1% A 90 LEU HA 1.0 . 4.00 2291 1954 A 48 LEU HA A 51 ARG HG2 1.0 . 4.96 2292 1954 A 51 ARG HG3 A 48 LEU HA 1.0 . 4.96 2293 1955 A 104 THR HG2% A 98 LYS HD3 1.0 . 5.44 2294 1956 A 94 LEU HD2% A 94 LEU HA 1.0 . 5.09 2295 1957 A 7 ALA HB% A 8 HIS HA 1.0 . 6.00 2296 1958 A 102 GLY H A 100 ILE HG1y 1.0 . 4.56 2297 1959 A 99 ALA H A 100 ILE HG1y 1.0 . 5.50 2298 1960 A 19 PRO HA A 20 ALA H 1.0 . 3.48 2299 1961 A 66 GLY H A 26 VAL HG1% 1.0 . 5.50 2300 1962 A 25 ASP H A 26 VAL HG1% 1.0 . 5.50 2301 1963 A 78 LEU HG A 74 GLN HG2 1.0 . 6.00 2302 1964 A 100 ILE HD1% A 8 HIS H 1.0 . 5.44 2303 1965 A 98 LYS HA A 94 LEU HD1% 1.0 . 6.00 2304 1966 A 84 PHE HD% A 58 LYS HB3 1.0 . 6.00 2305 1967 A 59 SER H A 62 ILE HD1% 1.0 . 6.00 2306 1968 A 37 ILE HG2% A 97 TRP HZ2 1.0 . 4.48 2307 1969 A 84 PHE HD% A 79 LEU HB2 1.0 . 4.74 2308 1970 A 66 GLY HA2 A 71 GLN HG3 1.0 . 5.50 2309 1971 A 27 ARG HA A 71 GLN HG3 1.0 . 5.50 2310 1972 A 52 ALA HA A 62 ILE HD1% 1.0 . 5.21 2311 1973 A 22 THR HB A 62 ILE HD1% 1.0 . 5.50 2312 1974 A 65 TYR HA A 72 THR HA 1.0 . 5.95 2313 1975 A 25 ASP H A 24 LEU HA 1.0 . 3.05 2314 1976 A 19 PRO HD3 A 18 GLU HG2 1.0 . 5.15 2315 1977 A 75 ALA HB% A 64 VAL HB 1.0 . 5.87 2316 1978 A 64 VAL HG2% A 89 GLU HA 1.0 . 6.00 2317 1979 A 87 VAL HA A 87 VAL HG1% 1.0 . 4.13 2318 1980 A 97 TRP HZ3 A 10 LEU HG 1.0 . 4.32 2319 1981 A 124 ARG HA A 124 ARG HDx 1.0 . 4.37 2320 1981 A 124 ARG HA A 124 ARG HDy 1.0 . 4.37 2321 1982 A 45 ILE HD1% A 71 GLN HE21 1.0 . 5.29 2322 1983 A 43 MET HE% A 55 SER HBx 1.0 . 5.17 2323 1984 A 60 ARG HD3 A 60 ARG HA 1.0 . 4.07 2324 1985 A 32 TYR H A 29 ARG HD2 1.0 . 6.00 2325 1985 A 32 TYR H A 29 ARG HD3 1.0 . 6.00 2326 1986 A 111 ARG HA A 111 ARG HG2 1.0 . 3.58 2327 1986 A 111 ARG HG3 A 111 ARG HA 1.0 . 3.58 2328 1987 A 59 SER H A 59 SER HBy 1.0 . 4.12 2329 1988 A 100 ILE HD1% A 8 HIS HA 1.0 . 3.96 2330 1989 A 109 GLU HG3 A 35 GLY HAx 1.0 . 3.87 2331 1989 A 35 GLY HAy A 109 GLU HG3 1.0 . 3.87 2332 1990 A 98 LYS HA A 98 LYS HG3 1.0 . 3.58 2333 1991 A 88 SER HA A 3 PRO HA 1.0 . 4.34 2334 1992 A 80 ARG HE A 87 VAL HB 1.0 . 4.35 2335 1993 A 104 THR HG2% A 37 ILE HD1% 1.0 . 5.50 2336 1994 A 37 ILE HD1% A 90 LEU HB2 1.0 . 5.50 2337 1995 A 33 ASN HB3 A 107 ILE HG1y 1.0 . 6.00 2338 1996 A 43 MET HG3 A 24 LEU HD1% 1.0 . 6.00 2339 1997 A 41 MET H A 41 MET HE% 1.0 . 5.86 2340 1998 A 71 GLN H A 71 GLN HG3 1.0 . 5.18 2341 1999 A 35 GLY HAx A 109 GLU HBy 1.0 . 5.50 2342 1999 A 35 GLY HAy A 109 GLU HBy 1.0 . 5.50 2343 2000 A 104 THR HB A 109 GLU HBy 1.0 . 5.50 2344 2001 A 65 TYR HE% A 37 ILE HB 1.0 . 5.18 2345 2002 A 58 LYS HA A 58 LYS HD2 1.0 . 4.90 2346 2003 A 34 ASP H A 34 ASP HBx 1.0 . 3.60 2347 2004 A 76 VAL HB A 73 SER HA 1.0 . 3.70 2348 2005 A 24 LEU H A 23 ILE HD1% 1.0 . 6.00 2349 2006 A 42 ALA HA A 29 ARG HD2 1.0 . 5.81 2350 2006 A 29 ARG HD3 A 42 ALA HA 1.0 . 5.81 2351 2007 A 27 ARG H A 27 ARG HBy 1.0 . 3.40 2352 2007 A 27 ARG H A 27 ARG HBx 1.0 . 3.40 2353 2008 A 10 LEU HG A 13 ARG HBx 1.0 . 5.19 2354 2008 A 13 ARG HBy A 10 LEU HG 1.0 . 5.19 2355 2009 A 57 GLU HG2 A 60 ARG H 1.0 . 5.32 2356 2010 A 42 ALA HB% A 44 PRO HD3 1.0 . 5.49 2357 2011 A 87 VAL H A 87 VAL HG2% 1.0 . 4.45 2358 2012 A 64 VAL HG1% A 76 VAL H 1.0 . 5.33 2359 2013 A 111 ARG HD3 A 111 ARG HG2 1.0 . 2.90 2360 2013 A 111 ARG HD2 A 111 ARG HG2 1.0 . 2.90 2361 2013 A 111 ARG HG3 A 111 ARG HD2 1.0 . 2.90 2362 2013 A 111 ARG HG3 A 111 ARG HD3 1.0 . 2.90 2363 2014 A 48 LEU HD2% A 75 ALA HA 1.0 . 4.88 2364 2015 A 55 SER H A 51 ARG HA 1.0 . 5.58 2365 2016 A 23 ILE HD1% A 10 LEU HD1% 1.0 . 5.05 2366 2017 A 80 ARG H A 80 ARG HD3 1.0 . 6.00 2367 2018 A 41 MET HG3 A 24 LEU HD2% 1.0 . 5.12 2368 2019 A 10 LEU HD1% A 10 LEU HA 1.0 . 4.29 2369 2020 A 38 MET H A 37 ILE HD1% 1.0 . 5.50 2370 2021 A 81 SER H A 77 ASN HBx 1.0 . 6.00 2371 2022 A 72 THR HG2% A 65 TYR HBx 1.0 . 6.00 2372 2022 A 72 THR HG2% A 65 TYR HBy 1.0 . 6.00 2373 2023 A 30 SER H A 29 ARG HG2 1.0 . 6.00 2374 2024 A 36 HIS H A 105 GLU HB2 1.0 . 6.00 2375 2025 A 25 ASP HA A 27 ARG H 1.0 . 6.00 2376 2026 A 40 ALA HA A 41 MET HG3 1.0 . 5.66 2377 2027 A 98 LYS HG2 A 94 LEU HD1% 1.0 . 6.00 2378 2028 A 9 VAL HG1% A 5 SER HBx 1.0 . 5.50 2379 2028 A 9 VAL HG1% A 5 SER HBy 1.0 . 5.50 2380 2029 A 2 GLU H A 2 GLU HG2 1.0 . 6.00 2381 2030 A 119 TYR HBy A 121 VAL HGy% 1.0 . 6.00 2382 2030 A 119 TYR HBy A 121 VAL HGx% 1.0 . 6.00 2383 2031 A 107 ILE HD1% A 33 ASN HA 1.0 . 5.73 2384 2032 A 42 ALA HB% A 29 ARG HG3 1.0 . 5.19 2385 2032 A 29 ARG HG2 A 42 ALA HB% 1.0 . 5.19 2386 2033 A 42 ALA HB% A 43 MET HBx 1.0 . 5.50 2387 2033 A 43 MET HBy A 42 ALA HB% 1.0 . 5.50 2388 2034 A 89 GLU HG2 A 76 VAL HG1% 1.0 . 4.99 2389 2035 A 64 VAL HG1% A 89 GLU HA 1.0 . 5.50 2390 2036 A 87 VAL HG2% A 84 PHE HA 1.0 . 5.50 2391 2037 A 95 ALA H A 93 GLY HA2 1.0 . 5.93 2392 2038 A 84 PHE HE% A 56 LEU HBy 1.0 . 4.70 2393 2039 A 32 TYR H A 32 TYR HBx 1.0 . 3.29 2394 2039 A 32 TYR H A 32 TYR HBy 1.0 . 3.29 2395 2040 A 85 GLU HB2 A 84 PHE HA 1.0 . 6.00 2396 2041 A 89 GLU H A 4 GLN HG2 1.0 . 5.16 2397 2041 A 4 GLN HG3 A 89 GLU H 1.0 . 5.16 2398 2042 A 126 GLU H A 125 LEU HA 1.0 . 3.55 2399 2043 A 78 LEU HD1% A 48 LEU HBx 1.0 . 6.00 2400 2043 A 48 LEU HBy A 78 LEU HD1% 1.0 . 6.00 2401 2044 A 33 ASN HD2y A 30 SER HA 1.0 . 4.98 2402 2045 A 84 PHE HB2 A 82 ALA HB% 1.0 . 6.00 2403 2046 A 31 THR HB A 28 ASP HBy 1.0 . 5.50 2404 2047 A 78 LEU H A 78 LEU HB3 1.0 . 4.01 2405 2048 A 52 ALA HA A 43 MET HE% 1.0 . 4.14 2406 2049 A 84 PHE HA A 85 GLU HG2 1.0 . 5.30 2407 2050 A 30 SER H A 29 ARG HG3 1.0 . 5.23 2408 2051 A 72 THR HG2% A 76 VAL HG2% 1.0 . 5.28 2409 2052 A 23 ILE HD1% A 23 ILE HA 1.0 . 5.48 2410 2053 A 75 ALA HB% A 26 VAL HG2% 1.0 . 4.28 2411 2054 A 85 GLU HG3 A 85 GLU HA 1.0 . 3.59 2412 2055 A 32 TYR HD% A 36 HIS HB3 1.0 . 5.05 2413 2056 A 8 HIS H A 100 ILE HG2% 1.0 . 6.00 2414 2057 A 11 LYS HG3 A 11 LYS HA 1.0 . 4.04 2415 2058 A 90 LEU HD2% A 93 GLY HA2 1.0 . 6.00 2416 2059 A 93 GLY HA3 A 90 LEU HB3 1.0 . 5.50 2417 2060 A 90 LEU HB3 A 89 GLU HA 1.0 . 5.50 2418 2061 A 63 TYR H A 23 ILE HA 1.0 . 4.05 2419 2062 A 67 ALA HA A 93 GLY HA2 1.0 . 5.50 2420 2063 A 66 GLY HA3 A 67 ALA HA 1.0 . 5.50 2421 2064 A 87 VAL HA A 62 ILE HD1% 1.0 . 5.50 2422 2065 A 62 ILE HD1% A 61 ASP HA 1.0 . 5.50 2423 2066 A 98 LYS HA A 104 THR HG2% 1.0 . 5.85 2424 2067 A 1 MET HG2 A 88 SER HBx 1.0 . 6.00 2425 2068 A 11 LYS HB3 A 11 LYS HEx 1.0 . 6.00 2426 2069 A 76 VAL HG1% A 64 VAL HB 1.0 . 5.50 2427 2070 A 71 GLN HG2 A 26 VAL HG2% 1.0 . 5.33 2428 2071 A 35 GLY H A 34 ASP HBy 1.0 . 4.02 2429 2072 A 107 ILE HG2% A 111 ARG HD2 1.0 . 6.00 2430 2072 A 107 ILE HG2% A 111 ARG HD3 1.0 . 6.00 2431 2073 A 79 LEU HD2% A 52 ALA HA 1.0 . 6.00 2432 2074 A 33 ASN HA A 107 ILE HG2% 1.0 . 6.00 2433 2075 A 79 LEU HG A 48 LEU HG 1.0 . 4.19 2434 2076 A 16 TRP HB3 A 13 ARG HA 1.0 . 5.50 2435 2077 A 16 TRP HB3 A 12 SER HBx 1.0 . 5.50 2436 2077 A 16 TRP HB3 A 12 SER HBy 1.0 . 5.50 2437 2078 A 97 TRP HZ3 A 10 LEU HD2% 1.0 . 5.09 2438 2079 A 120 ASN H A 119 TYR HBx 1.0 . 5.25 2439 2080 A 46 GLU HA A 46 GLU HBx 1.0 . 2.77 2440 2080 A 46 GLU HA A 46 GLU HBy 1.0 . 2.77 2441 2081 A 56 LEU H A 56 LEU HD1% 1.0 . 5.74 2442 2082 A 62 ILE H A 62 ILE HB 1.0 . 3.83 2443 2083 A 55 SER HBy A 41 MET HE% 1.0 . 6.00 2444 2084 A 34 ASP H A 33 ASN HB3 1.0 . 5.69 2445 2085 A 100 ILE HG2% A 8 HIS HBx 1.0 . 6.00 2446 2086 A 58 LYS HB2 A 58 LYS HEx 1.0 . 5.42 2447 2086 A 58 LYS HB2 A 58 LYS HEy 1.0 . 5.42 2448 2087 A 61 ASP HA A 86 HIS HBx 1.0 . 3.69 2449 2087 A 86 HIS HBy A 61 ASP HA 1.0 . 3.69 2450 2088 A 37 ILE HG2% A 38 MET HBx 1.0 . 6.00 2451 2089 A 95 ALA HA A 98 LYS HD3 1.0 . 4.59 2452 2090 A 117 ASP H A 116 ALA HB% 1.0 . 5.57 2453 2091 A 54 SER H A 54 SER HBy 1.0 . 3.77 2454 2092 A 75 ALA H A 45 ILE HG2% 1.0 . 6.00 2455 2093 A 97 TRP HE1 A 37 ILE HD1% 1.0 . 6.00 2456 2094 A 38 MET HE% A 14 LEU HDx% 1.0 . 5.33 2457 2094 A 38 MET HE% A 14 LEU HDy% 1.0 . 5.33 2458 2095 A 5 SER H A 4 GLN HA 1.0 . 3.51 2459 2096 A 46 GLU HBx A 46 GLU HG2 1.0 . 2.93 2460 2096 A 46 GLU HBy A 46 GLU HG2 1.0 . 2.93 2461 2096 A 46 GLU HG3 A 46 GLU HBx 1.0 . 2.93 2462 2096 A 46 GLU HG3 A 46 GLU HBy 1.0 . 2.93 2463 2097 A 64 VAL HG1% A 66 GLY HA3 1.0 . 5.50 2464 2098 A 66 GLY HA3 A 26 VAL HG1% 1.0 . 5.50 2465 2099 A 24 LEU HB2 A 24 LEU HD2% 1.0 . 4.24 2466 2100 A 49 VAL H A 79 LEU HA 1.0 . 6.00 2467 2101 A 80 ARG HA A 80 ARG HD2 1.0 . 5.51 2468 2102 A 79 LEU HB2 A 79 LEU HD1% 1.0 . 4.15 2469 2103 A 94 LEU HD2% A 37 ILE H 1.0 . 6.00 2470 2104 A 120 ASN H A 119 TYR HA 1.0 . 3.43 2471 2105 A 67 ALA HB% A 27 ARG HG2 1.0 . 4.01 2472 2105 A 27 ARG HG3 A 67 ALA HB% 1.0 . 4.01 2473 2106 A 99 ALA H A 98 LYS HB3 1.0 . 4.07 2474 2107 A 14 LEU HDy% A 38 MET HBx 1.0 . 6.00 2475 2107 A 38 MET HBx A 14 LEU HDx% 1.0 . 6.00 2476 2108 A 43 MET HA A 51 ARG HG2 1.0 . 5.01 2477 2108 A 51 ARG HG3 A 43 MET HA 1.0 . 5.01 2478 2109 A 49 VAL H A 48 LEU HD1% 1.0 . 5.74 2479 2110 A 79 LEU HD2% A 80 ARG H 1.0 . 6.00 2480 2111 A 90 LEU HB2 A 65 TYR HBx 1.0 . 4.24 2481 2111 A 65 TYR HBy A 90 LEU HB2 1.0 . 4.24 2482 2112 A 57 GLU H A 62 ILE HD1% 1.0 . 6.00 2483 2113 A 23 ILE HA A 23 ILE HG2% 1.0 . 4.12 2484 2114 A 90 LEU HG A 65 TYR HBx 1.0 . 5.19 2485 2114 A 90 LEU HG A 65 TYR HBy 1.0 . 5.19 2486 2115 A 71 GLN HG2 A 66 GLY HA2 1.0 . 5.50 2487 2116 A 71 GLN HG2 A 27 ARG HA 1.0 . 5.50 2488 2117 A 22 THR HB A 62 ILE HG2% 1.0 . 5.66 2489 2118 A 76 VAL HG1% A 73 SER HA 1.0 . 5.90 2490 2119 A 49 VAL HG2% A 78 LEU HB2 1.0 . 4.70 2491 2120 A 11 LYS HA A 11 LYS HEx 1.0 . 5.50 2492 2121 A 80 ARG H A 79 LEU HB3 1.0 . 4.75 2493 2122 A 24 LEU HA A 43 MET HE% 1.0 . 6.00 2494 2123 A 32 TYR HD% A 25 ASP HBx 1.0 . 4.43 2495 2124 A 45 ILE HD1% A 72 THR HA 1.0 . 6.00 2496 2125 A 76 VAL HG2% A 72 THR HB 1.0 . 6.00 2497 2126 A 25 ASP H A 24 LEU HB2 1.0 . 5.49 2498 2127 A 97 TRP HH2 A 103 PRO HDx 1.0 . 5.11 2499 2127 A 103 PRO HDy A 97 TRP HH2 1.0 . 5.11 2500 2128 A 27 ARG H A 66 GLY HA3 1.0 . 6.00 2501 2129 A 63 TYR HA A 88 SER HBy 1.0 . 6.00 2502 2130 A 42 ALA HA A 32 TYR HBx 1.0 . 4.85 2503 2130 A 42 ALA HA A 32 TYR HBy 1.0 . 4.85 2504 2131 A 33 ASN HB2 A 30 SER HBx 1.0 . 4.72 2505 2131 A 33 ASN HB2 A 30 SER HBy 1.0 . 4.72 2506 2132 A 43 MET HG3 A 51 ARG HG2 1.0 . 4.45 2507 2132 A 51 ARG HG3 A 43 MET HG3 1.0 . 4.45 2508 2133 A 104 THR HA A 38 MET HBx 1.0 . 6.00 2509 2134 A 91 LYS HD3 A 91 LYS HG2 1.0 . 2.52 2510 2134 A 91 LYS HD2 A 91 LYS HG2 1.0 . 2.52 2511 2134 A 91 LYS HG3 A 91 LYS HD2 1.0 . 2.52 2512 2134 A 91 LYS HD3 A 91 LYS HG3 1.0 . 2.52 2513 2135 A 111 ARG HA A 111 ARG HD2 1.0 . 4.92 2514 2135 A 111 ARG HD3 A 111 ARG HA 1.0 . 4.92 2515 2136 A 95 ALA HB% A 94 LEU HA 1.0 . 6.00 2516 2137 A 48 LEU HD1% A 49 VAL HA 1.0 . 5.93 2517 2138 A 97 TRP HZ3 A 10 LEU HB3 1.0 . 4.48 2518 2139 A 33 ASN H A 31 THR HA 1.0 . 5.89 2519 2140 A 29 ARG HB2 A 29 ARG H 1.0 . 3.65 2520 2141 A 26 VAL HG2% A 78 LEU HD1% 1.0 . 6.00 2521 2142 A 66 GLY HA3 A 71 GLN HG3 1.0 . 4.82 2522 2143 A 23 ILE HG2% A 40 ALA H 1.0 . 5.50 2523 2144 A 78 LEU HD1% A 77 ASN HBy 1.0 . 5.50 2524 2145 A 78 LEU HD2% A 77 ASN HBy 1.0 . 5.50 2525 2146 A 90 LEU HD1% A 10 LEU HB2 1.0 . 6.00 2526 2147 A 4 GLN HB3 A 5 SER H 1.0 . 4.90 2527 2148 A 79 LEU HD2% A 62 ILE HG2% 1.0 . 5.50 2528 2149 A 79 LEU HD2% A 24 LEU HD1% 1.0 . 5.50 2529 2150 A 76 VAL HG1% A 89 GLU HG3 1.0 . 5.49 2530 2151 A 64 VAL HA A 24 LEU HB2 1.0 . 4.77 2531 2152 A 89 GLU HG2 A 88 SER HA 1.0 . 5.70 2532 2153 A 47 ASP HB2 A 51 ARG HG2 1.0 . 4.29 2533 2153 A 47 ASP HB2 A 51 ARG HG3 1.0 . 4.29 2534 2154 A 26 VAL HG2% A 45 ILE HG1y 1.0 . 6.00 2535 2155 A 63 TYR HE% A 88 SER HBx 1.0 . 6.00 2536 2156 A 45 ILE HG2% A 46 GLU HG2 1.0 . 4.65 2537 2156 A 45 ILE HG2% A 46 GLU HG3 1.0 . 4.65 2538 2157 A 108 ILE HB A 108 ILE H 1.0 . 3.41 2539 2158 A 40 ALA HB% A 37 ILE HG2% 1.0 . 5.83 2540 2159 A 87 VAL HA A 62 ILE HB 1.0 . 3.97 2541 2160 A 71 GLN HB2 A 66 GLY HA2 1.0 . 5.50 2542 2161 A 27 ARG HA A 71 GLN HB2 1.0 . 5.50 2543 2162 A 75 ALA HB% A 72 THR HA 1.0 . 4.48 2544 2163 A 48 LEU HD1% A 45 ILE HA 1.0 . 4.74 2545 2164 A 52 ALA HA A 24 LEU HD1% 1.0 . 5.50 2546 2165 A 22 THR HB A 24 LEU HD1% 1.0 . 5.50 2547 2166 A 60 ARG HD2 A 60 ARG HA 1.0 . 4.12 2548 2167 A 62 ILE H A 62 ILE HG2% 1.0 . 6.00 2549 2168 A 48 LEU HD2% A 79 LEU HD1% 1.0 . 6.00 2550 2169 A 38 MET HG3 A 39 GLY HAx 1.0 . 5.23 2551 2169 A 39 GLY HAx A 38 MET HG2 1.0 . 5.23 2552 2170 A 45 ILE HG2% A 26 VAL HA 1.0 . 6.00 2553 2171 A 100 ILE HD1% A 11 LYS HD3 1.0 . 4.51 2554 2172 A 72 THR HA A 26 VAL HG1% 1.0 . 5.50 2555 2173 A 13 ARG H A 10 LEU HA 1.0 . 4.65 2556 2174 A 29 ARG H A 44 PRO HG3 1.0 . 4.73 2557 2175 A 8 HIS HA A 11 LYS HD3 1.0 . 5.04 2558 2176 A 84 PHE HB2 A 79 LEU HB3 1.0 . 4.77 2559 2177 A 45 ILE HA A 26 VAL HB 1.0 . 4.07 2560 2178 A 22 THR HG2% A 41 MET HE% 1.0 . 5.39 2561 2179 A 52 ALA HB% A 48 LEU HD1% 1.0 . 4.83 2562 2180 A 72 THR HG2% A 73 SER HA 1.0 . 5.25 2563 2181 A 10 LEU HD1% A 11 LYS HA 1.0 . 6.00 2564 2182 A 80 ARG HA A 84 PHE HB2 1.0 . 6.00 2565 2183 A 75 ALA H A 74 GLN HG2 1.0 . 4.96 2566 2184 A 79 LEU HA A 76 VAL HA 1.0 . 5.75 2567 2185 A 40 ALA HB% A 41 MET HA 1.0 . 6.00 2568 2186 A 64 VAL HG1% A 26 VAL HB 1.0 . 6.00 2569 2187 A 79 LEU HA A 62 ILE HD1% 1.0 . 6.00 2570 2188 A 23 ILE HA A 24 LEU HG 1.0 . 6.00 2571 2189 A 89 GLU H A 89 GLU HG3 1.0 . 4.41 2572 2190 A 76 VAL H A 64 VAL HB 1.0 . 5.50 2573 2191 A 64 VAL HB A 89 GLU HBx 1.0 . 5.50 2574 2191 A 64 VAL HB A 89 GLU HBy 1.0 . 5.50 2575 2192 A 22 THR HG2% A 62 ILE HA 1.0 . 6.00 2576 2193 A 40 ALA HA A 23 ILE HG2% 1.0 . 4.93 2577 2194 A 90 LEU H A 89 GLU HA 1.0 . 3.27 2578 2195 A 76 VAL HG1% A 80 ARG HD3 1.0 . 5.39 2579 2196 A 10 LEU HB3 A 90 LEU HD1% 1.0 . 6.00 2580 2197 A 56 LEU HD2% A 60 ARG HGx 1.0 . 5.50 2581 2197 A 60 ARG HGy A 56 LEU HD2% 1.0 . 5.50 2582 2198 A 26 VAL HG2% A 45 ILE HA 1.0 . 5.50 2583 2199 A 43 MET H A 43 MET HG3 1.0 . 5.79 2584 2200 A 98 LYS H A 98 LYS HB2 1.0 . 3.18 2585 2201 A 110 SER HA A 111 ARG HG2 1.0 . 5.78 2586 2201 A 111 ARG HG3 A 110 SER HA 1.0 . 5.78 2587 2202 A 62 ILE HD1% A 60 ARG HD2 1.0 . 5.50 2588 2203 A 52 ALA HB% A 79 LEU HD1% 1.0 . 6.00 2589 2204 A 64 VAL HA A 24 LEU HD1% 1.0 . 6.00 2590 2205 A 91 LYS HB2 A 91 LYS HG2 1.0 . 2.85 2591 2205 A 91 LYS HB2 A 91 LYS HG3 1.0 . 2.85 2592 2206 A 79 LEU H A 76 VAL HA 1.0 . 4.38 2593 2207 A 38 MET HE% A 105 GLU HA 1.0 . 6.00 2594 2208 A 89 GLU HA A 89 GLU HG3 1.0 . 4.21 2595 2209 A 91 LYS HB3 A 91 LYS HG2 1.0 . 2.99 2596 2209 A 91 LYS HB3 A 91 LYS HG3 1.0 . 2.99 2597 2210 A 48 LEU HA A 51 ARG HD2 1.0 . 6.00 2598 2211 A 107 ILE HD1% A 34 ASP H 1.0 . 6.00 2599 2212 A 48 LEU HD2% A 48 LEU HBx 1.0 . 4.04 2600 2212 A 48 LEU HD2% A 48 LEU HBy 1.0 . 4.04 2601 2213 A 85 GLU H A 85 GLU HG2 1.0 . 4.11 2602 2214 A 31 THR HA A 34 ASP HBy 1.0 . 4.21 2603 2215 A 83 GLY HA2 A 58 LYS HD3 1.0 . 5.36 2604 2216 A 112 THR H A 111 ARG HA 1.0 . 3.48 2605 2217 A 80 ARG HA A 87 VAL HG2% 1.0 . 5.30 2606 2218 A 25 ASP H A 42 ALA HA 1.0 . 4.35 2607 2219 A 13 ARG HG3 A 21 PHE HE% 1.0 . 5.50 2608 2220 A 95 ALA H A 93 GLY HA3 1.0 . 4.66 2609 2221 A 13 ARG HA A 13 ARG HD3 1.0 . 6.00 2610 2222 A 107 ILE HG2% A 107 ILE HA 1.0 . 4.02 2611 2223 A 64 VAL HG1% A 79 LEU HD1% 1.0 . 5.50 2612 2224 A 87 VAL HG2% A 79 LEU HD1% 1.0 . 5.50 2613 2225 A 47 ASP HB3 A 44 PRO HD3 1.0 . 5.56 2614 2226 A 108 ILE HD1% A 111 ARG HD2 1.0 . 6.00 2615 2226 A 108 ILE HD1% A 111 ARG HD3 1.0 . 6.00 2616 2227 A 97 TRP HZ3 A 90 LEU HD1% 1.0 . 6.00 2617 2228 A 21 PHE HZ A 14 LEU HA 1.0 . 3.51 2618 2229 A 38 MET HA A 105 GLU H 1.0 . 5.40 2619 2230 A 78 LEU HD2% A 78 LEU H 1.0 . 5.11 2620 2231 A 89 GLU HA A 4 GLN HG2 1.0 . 5.81 2621 2231 A 4 GLN HG3 A 89 GLU HA 1.0 . 5.81 2622 2232 A 70 GLU HA A 70 GLU HGx 1.0 . 3.35 2623 2232 A 70 GLU HGy A 70 GLU HA 1.0 . 3.35 2624 2233 A 71 GLN H A 71 GLN HB3 1.0 . 3.96 2625 2234 A 22 THR HB A 60 ARG HGx 1.0 . 4.86 2626 2234 A 22 THR HB A 60 ARG HGy 1.0 . 4.86 2627 2235 A 29 ARG H A 44 PRO HG2 1.0 . 5.18 2628 2236 A 10 LEU HD1% A 13 ARG HBx 1.0 . 5.46 2629 2236 A 13 ARG HBy A 10 LEU HD1% 1.0 . 5.46 2630 2237 A 6 ASP HA A 91 LYS HG2 1.0 . 4.45 2631 2237 A 6 ASP HA A 91 LYS HG3 1.0 . 4.45 2632 2238 A 75 ALA H A 74 GLN HG3 1.0 . 5.22 2633 2239 A 102 GLY H A 98 LYS HG2 1.0 . 5.50 2634 2240 A 98 LYS HG2 A 99 ALA H 1.0 . 5.50 2635 2241 A 1 MET HE% A 61 ASP HA 1.0 . 4.68 2636 2242 A 40 ALA HB% A 65 TYR HE% 1.0 . 5.12 2637 2243 A 105 GLU HA A 109 GLU HG2 1.0 . 6.00 2638 2244 A 97 TRP HA A 100 ILE HG1x 1.0 . 4.24 2639 2245 A 84 PHE HE% A 56 LEU HBx 1.0 . 4.70 2640 2246 A 36 HIS HB2 A 32 TYR HA 1.0 . 5.50 2641 2247 A 100 ILE HD1% A 8 HIS HBy 1.0 . 5.56 2642 2248 A 44 PRO HA A 26 VAL HG2% 1.0 . 6.00 2643 2249 A 6 ASP HBy A 7 ALA H 1.0 . 4.75 2644 2250 A 98 LYS HA A 97 TRP HD1 1.0 . 5.14 2645 2251 A 42 ALA H A 41 MET HG2 1.0 . 5.17 2646 2252 A 107 ILE HG2% A 33 ASN HB3 1.0 . 6.00 2647 2253 A 47 ASP HB3 A 51 ARG HD2 1.0 . 5.01 2648 2254 A 65 TYR HD1 A 37 ILE HD1% 1.0 . 5.50 2649 2255 A 97 TRP HZ3 A 37 ILE HD1% 1.0 . 5.50 2650 2256 A 52 ALA HB% A 84 PHE HD% 1.0 . 5.50 2651 2257 A 31 THR HG2% A 27 ARG HG2 1.0 . 4.85 2652 2257 A 27 ARG HG3 A 31 THR HG2% 1.0 . 4.85 2653 2258 A 37 ILE H A 37 ILE HB 1.0 . 3.70 2654 2259 A 56 LEU HD2% A 41 MET HE% 1.0 . 5.50 2655 2260 A 96 ALA HB% A 92 GLY HAx 1.0 . 4.11 2656 2261 A 97 TRP HZ3 A 11 LYS HB3 1.0 . 5.82 2657 2262 A 11 LYS HA A 11 LYS HG2 1.0 . 3.86 2658 2263 A 2 GLU HG3 A 2 GLU HA 1.0 . 4.03 2659 2264 A 108 ILE H A 107 ILE HG2% 1.0 . 4.83 2660 2265 A 43 MET HG2 A 48 LEU HA 1.0 . 5.30 2661 2266 A 44 PRO HA A 28 ASP HA 1.0 . 4.27 2662 2267 A 21 PHE HZ A 14 LEU HDx% 1.0 . 4.05 2663 2267 A 14 LEU HDy% A 21 PHE HZ 1.0 . 4.05 2664 2268 A 32 TYR HD% A 42 ALA HB% 1.0 . 5.41 2665 2269 A 108 ILE HG2% A 108 ILE H 1.0 . 4.81 2666 2270 A 66 GLY HA3 A 65 TYR HA 1.0 . 6.00 2667 2271 A 125 LEU H A 125 LEU HDx% 1.0 . 5.50 2668 2272 A 86 HIS H A 86 HIS HBx 1.0 . 4.02 2669 2272 A 86 HIS H A 86 HIS HBy 1.0 . 4.02 2670 2273 A 84 PHE H A 58 LYS HD2 1.0 . 5.50 2671 2274 A 90 LEU H A 76 VAL HG2% 1.0 . 6.00 2672 2275 A 27 ARG HD2 A 27 ARG HA 1.0 . 5.50 2673 2276 A 27 ARG HD2 A 66 GLY HA2 1.0 . 5.50 2674 2277 A 71 GLN HA A 71 GLN HG3 1.0 . 4.02 2675 2278 A 42 ALA H A 43 MET HE% 1.0 . 6.00 2676 2279 A 78 LEU HD2% A 49 VAL H 1.0 . 6.00 2677 2280 A 52 ALA HA A 56 LEU HD2% 1.0 . 6.00 2678 2281 A 23 ILE HD1% A 37 ILE HD1% 1.0 . 6.00 2679 2282 A 51 ARG HA A 50 ASP HBx 1.0 . 5.30 2680 2282 A 50 ASP HBy A 51 ARG HA 1.0 . 5.30 2681 2283 A 49 VAL HG2% A 82 ALA HA 1.0 . 6.00 2682 2284 A 71 GLN HG2 A 71 GLN HA 1.0 . 3.42 2683 2285 A 25 ASP H A 24 LEU HD2% 1.0 . 5.05 2684 2286 A 47 ASP HB2 A 51 ARG HD2 1.0 . 6.00 2685 2287 A 21 PHE HZ A 14 LEU HBx 1.0 . 5.47 2686 2288 A 37 ILE HG2% A 40 ALA H 1.0 . 5.49 2687 2289 A 44 PRO HD3 A 43 MET HE% 1.0 . 6.00 2688 2290 A 63 TYR HE% A 88 SER HBy 1.0 . 6.00 2689 2291 A 25 ASP HA A 26 VAL HG1% 1.0 . 4.92 2690 2292 A 58 LYS HA A 57 GLU HA 1.0 . 5.22 2691 2293 A 65 TYR HD2 A 37 ILE HD1% 1.0 . 6.00 2692 2294 A 102 GLY HAy A 103 PRO HDx 1.0 . 3.35 2693 2294 A 103 PRO HDy A 102 GLY HAx 1.0 . 3.35 2694 2294 A 103 PRO HDy A 102 GLY HAy 1.0 . 3.35 2695 2294 A 102 GLY HAx A 103 PRO HDx 1.0 . 3.35 2696 2295 A 26 VAL H A 26 VAL HG2% 1.0 . 3.89 2697 2296 A 5 SER H A 4 GLN HB2 1.0 . 4.83 2698 2297 A 105 GLU HG2 A 106 GLY H 1.0 . 4.86 2699 2298 A 65 TYR HD2 A 40 ALA HB% 1.0 . 5.63 2700 2299 A 11 LYS HB3 A 11 LYS HEy 1.0 . 6.00 2701 2300 A 44 PRO HD2 A 51 ARG HG2 1.0 . 5.27 2702 2300 A 51 ARG HG3 A 44 PRO HD2 1.0 . 5.27 2703 2301 A 111 ARG HD3 A 111 ARG HBx 1.0 . 3.73 2704 2301 A 111 ARG HBx A 111 ARG HD2 1.0 . 3.73 2705 2302 A 21 PHE HA A 60 ARG HGx 1.0 . 5.19 2706 2302 A 60 ARG HGy A 21 PHE HA 1.0 . 5.19 2707 2303 A 76 VAL HG2% A 89 GLU HG3 1.0 . 4.71 2708 2304 A 100 ILE HD1% A 8 HIS HBx 1.0 . 5.56 2709 2305 A 110 SER H A 109 GLU HG2 1.0 . 5.10 2710 2306 A 14 LEU HG A 14 LEU HA 1.0 . 3.62 2711 2307 A 42 ALA HB% A 29 ARG HA 1.0 . 6.00 2712 2308 A 26 VAL HG2% A 45 ILE HB 1.0 . 4.90 2713 2309 A 23 ILE HA A 22 THR HG2% 1.0 . 6.00 2714 2310 A 75 ALA HA A 78 LEU HG 1.0 . 4.43 2715 2311 A 49 VAL HG2% A 78 LEU H 1.0 . 5.78 2716 2312 A 64 VAL HG1% A 72 THR HB 1.0 . 5.50 2717 2313 A 64 VAL HG1% A 66 GLY HA2 1.0 . 5.50 2718 2314 A 64 VAL H A 62 ILE HG2% 1.0 . 6.00 2719 2315 A 38 MET H A 104 THR HG2% 1.0 . 5.27 2720 2316 A 65 TYR H A 26 VAL HG1% 1.0 . 6.00 2721 2317 A 79 LEU HD2% A 49 VAL HA 1.0 . 4.74 2722 2318 A 87 VAL HG2% A 80 ARG HBx 1.0 . 6.00 2723 2318 A 87 VAL HG2% A 80 ARG HBy 1.0 . 6.00 2724 2319 A 58 LYS HD2 A 84 PHE HA 1.0 . 5.50 2725 2320 A 58 LYS HD2 A 83 GLY HA3 1.0 . 5.50 2726 2321 A 37 ILE HD1% A 97 TRP HB2 1.0 . 5.37 2727 2322 A 84 PHE HB3 A 62 ILE HD1% 1.0 . 5.27 2728 2323 A 97 TRP HA A 100 ILE HD1% 1.0 . 5.50 2729 2324 A 10 LEU HD1% A 14 LEU HG 1.0 . 6.00 2730 2325 A 40 ALA HB% A 41 MET HBx 1.0 . 5.50 2731 2325 A 41 MET HBy A 40 ALA HB% 1.0 . 5.50 2732 2326 A 109 GLU H A 108 ILE HD1% 1.0 . 6.00 2733 2327 A 88 SER HBy A 1 MET HBx 1.0 . 6.00 2734 2327 A 1 MET HBy A 88 SER HBy 1.0 . 6.00 2735 2328 A 105 GLU HG3 A 104 THR HA 1.0 . 6.00 2736 2329 A 56 LEU HA A 57 GLU HBx 1.0 . 5.74 2737 2330 A 67 ALA H A 67 ALA HB% 1.0 . 3.84 2738 2331 A 22 THR HG2% A 56 LEU HD1% 1.0 . 6.00 2739 2332 A 11 LYS H A 11 LYS HG2 1.0 . 6.00 2740 2333 A 52 ALA HB% A 41 MET HE% 1.0 . 6.00 2741 2334 A 85 GLU HB2 A 59 SER HA 1.0 . 4.39 2742 2335 A 83 GLY HA3 A 58 LYS HEx 1.0 . 4.79 2743 2335 A 58 LYS HEy A 83 GLY HA3 1.0 . 4.79 2744 2336 A 63 TYR H A 62 ILE HA 1.0 . 3.53 2745 2337 A 52 ALA HB% A 51 ARG HBy 1.0 . 5.50 2746 2338 A 52 ALA HB% A 43 MET HE% 1.0 . 5.19 2747 2339 A 80 ARG HA A 80 ARG HD3 1.0 . 5.52 2748 2340 A 75 ALA HA A 78 LEU HD1% 1.0 . 3.99 2749 2341 A 103 PRO HDy A 11 LYS HEx 1.0 . 4.93 2750 2341 A 11 LYS HEx A 103 PRO HDx 1.0 . 4.93 2751 2342 A 79 LEU HD2% A 84 PHE HE% 1.0 . 5.42 2752 2343 A 16 TRP H A 16 TRP HB2 1.0 . 3.80 2753 2344 A 38 MET HG2 A 39 GLY HAy 1.0 . 5.23 2754 2344 A 38 MET HG3 A 39 GLY HAy 1.0 . 5.23 2755 2345 A 97 TRP HZ2 A 14 LEU HBy 1.0 . 5.50 2756 2346 A 21 PHE HE% A 14 LEU HBy 1.0 . 5.50 2757 2347 A 39 GLY H A 38 MET HG2 1.0 . 3.88 2758 2347 A 39 GLY H A 38 MET HG3 1.0 . 3.88 2759 2348 A 1 MET HBx A 88 SER HBx 1.0 . 6.00 2760 2348 A 1 MET HBy A 88 SER HBx 1.0 . 6.00 2761 2349 A 48 LEU HA A 26 VAL HG1% 1.0 . 6.00 2762 2350 A 110 SER HBy A 111 ARG HG2 1.0 . 4.98 2763 2350 A 110 SER HBx A 111 ARG HG2 1.0 . 4.98 2764 2350 A 111 ARG HG3 A 110 SER HBx 1.0 . 4.98 2765 2350 A 111 ARG HG3 A 110 SER HBy 1.0 . 4.98 2766 2351 A 97 TRP HZ2 A 14 LEU HBx 1.0 . 5.50 2767 2352 A 21 PHE HE% A 14 LEU HBx 1.0 . 5.50 2768 2353 A 71 GLN HG2 A 71 GLN H 1.0 . 4.74 2769 2354 A 47 ASP HA A 51 ARG HG2 1.0 . 5.50 2770 2354 A 51 ARG HG3 A 47 ASP HA 1.0 . 5.50 2771 2355 A 37 ILE HG2% A 14 LEU HDx% 1.0 . 5.50 2772 2355 A 37 ILE HG2% A 14 LEU HDy% 1.0 . 5.50 2773 2356 A 121 VAL H A 120 ASN HA 1.0 . 3.37 2774 2357 A 87 VAL HG1% A 79 LEU HA 1.0 . 6.00 2775 2358 A 61 ASP HA A 62 ILE HG1y 1.0 . 6.00 2776 2359 A 46 GLU H A 45 ILE HG2% 1.0 . 3.94 2777 2360 A 76 VAL HG2% A 89 GLU HA 1.0 . 4.59 2778 2361 A 76 VAL HG1% A 80 ARG HD3 1.0 . 5.43 2779 2361 A 76 VAL HG1% A 80 ARG HD2 1.0 . 5.43 2780 2362 A 76 VAL HG1% A 80 ARG HD2 1.0 . 5.50 2781 2363 A 71 GLN HE21 A 71 GLN HB2 1.0 . 5.50 2782 2364 A 57 GLU H A 60 ARG HBy 1.0 . 5.50 2783 2365 A 78 LEU HD2% A 78 LEU HB3 1.0 . 3.78 2784 2366 A 60 ARG HA A 60 ARG HGx 1.0 . 3.74 2785 2366 A 60 ARG HGy A 60 ARG HA 1.0 . 3.74 2786 2367 A 49 VAL H A 48 LEU HG 1.0 . 4.35 2787 2368 A 11 LYS HA A 14 LEU HBx 1.0 . 4.56 2788 2369 A 38 MET HE% A 105 GLU H 1.0 . 6.00 2789 2370 A 84 PHE HZ A 43 MET HE% 1.0 . 5.50 2790 2371 A 84 PHE HE% A 43 MET HE% 1.0 . 5.50 2791 2372 A 94 LEU HD2% A 98 LYS HD2 1.0 . 6.00 2792 2373 A 13 ARG HBy A 17 GLY HAy 1.0 . 5.50 2793 2373 A 13 ARG HBx A 17 GLY HAy 1.0 . 5.50 2794 2374 A 13 ARG HG3 A 17 GLY HAy 1.0 . 5.50 2795 2375 A 95 ALA HA A 98 LYS HEx 1.0 . 5.93 2796 2376 A 46 GLU H A 45 ILE HB 1.0 . 4.60 2797 2377 A 87 VAL HG1% A 63 TYR HA 1.0 . 5.41 2798 2378 A 72 THR HG2% A 64 VAL HB 1.0 . 4.87 2799 2379 A 60 ARG HD3 A 56 LEU HD2% 1.0 . 5.92 2800 2380 A 105 GLU H A 104 THR HB 1.0 . 3.49 2801 2381 A 26 VAL HG2% A 71 GLN HB3 1.0 . 6.00 2802 2382 A 28 ASP HA A 44 PRO HB3 1.0 . 4.14 2803 2383 A 53 SER H A 49 VAL HA 1.0 . 4.83 2804 2384 A 79 LEU HD2% A 53 SER HA 1.0 . 6.00 2805 2385 A 94 LEU HD1% A 104 THR HB 1.0 . 5.50 2806 2386 A 91 LYS HB2 A 91 LYS HEx 1.0 . 5.30 2807 2386 A 91 LYS HB2 A 91 LYS HEy 1.0 . 5.30 2808 2387 A 34 ASP HA A 107 ILE HB 1.0 . 3.61 2809 2388 A 26 VAL HG2% A 45 ILE HG2% 1.0 . 6.00 2810 2389 A 44 PRO HA A 45 ILE HB 1.0 . 4.38 2811 2390 A 62 ILE HD1% A 62 ILE HA 1.0 . 4.88 2812 2391 A 47 ASP HA A 46 GLU HG2 1.0 . 5.81 2813 2391 A 47 ASP HA A 46 GLU HG3 1.0 . 5.81 2814 2392 A 26 VAL HG2% A 72 THR HA 1.0 . 5.12 2815 2393 A 95 ALA HB% A 92 GLY HAy 1.0 . 6.00 2816 2394 A 27 ARG HD3 A 67 ALA HB% 1.0 . 4.70 2817 2395 A 75 ALA HB% A 48 LEU HBx 1.0 . 5.50 2818 2395 A 75 ALA HB% A 48 LEU HBy 1.0 . 5.50 2819 2396 A 24 LEU HB3 A 41 MET HBx 1.0 . 6.00 2820 2396 A 41 MET HBy A 24 LEU HB3 1.0 . 6.00 2821 2397 A 90 LEU HD2% A 65 TYR HA 1.0 . 6.00 2822 2398 A 23 ILE HG2% A 63 TYR HB2 1.0 . 5.28 2823 2399 A 90 LEU HD1% A 37 ILE HD1% 1.0 . 6.00 2824 2400 A 11 LYS HG3 A 103 PRO HDx 1.0 . 3.54 2825 2400 A 11 LYS HG3 A 103 PRO HDy 1.0 . 3.54 2826 2401 A 64 VAL H A 63 TYR HB2 1.0 . 5.64 2827 2402 A 62 ILE HD1% A 22 THR HG2% 1.0 . 6.00 2828 2403 A 78 LEU HB3 A 78 LEU HD1% 1.0 . 4.18 2829 2404 A 52 ALA H A 49 VAL HA 1.0 . 4.76 2830 2405 A 84 PHE HD% A 62 ILE HD1% 1.0 . 4.19 2831 2406 A 23 ILE HD1% A 63 TYR HD% 1.0 . 6.00 2832 2407 A 65 TYR HD2 A 37 ILE HB 1.0 . 6.00 2833 2408 A 82 ALA H A 81 SER HBx 1.0 . 5.50 2834 2409 A 62 ILE HG2% A 22 THR HG2% 1.0 . 5.50 2835 2410 A 22 THR HG2% A 24 LEU HD1% 1.0 . 5.50 2836 2411 A 24 LEU H A 24 LEU HD1% 1.0 . 5.50 2837 2412 A 78 LEU H A 79 LEU HD1% 1.0 . 6.00 2838 2413 A 75 ALA H A 45 ILE HD1% 1.0 . 4.35 2839 2414 A 10 LEU HD1% A 13 ARG HD2 1.0 . 6.00 2840 2415 A 71 GLN H A 70 GLU HBx 1.0 . 4.40 2841 2416 A 65 TYR HD2 A 23 ILE HG2% 1.0 . 4.54 2842 2417 A 22 THR HG2% A 41 MET HBx 1.0 . 4.83 2843 2417 A 41 MET HBy A 22 THR HG2% 1.0 . 4.83 2844 2418 A 79 LEU HD2% A 49 VAL H 1.0 . 6.00 2845 2419 A 64 VAL H A 63 TYR HD% 1.0 . 5.91 2846 2420 A 90 LEU HD2% A 97 TRP HE3 1.0 . 5.46 2847 2421 A 119 TYR H A 119 TYR HD% 1.0 . 4.40 2848 2422 A 36 HIS HD2 A 105 GLU HB3 1.0 . 4.96 2849 2423 A 80 ARG HA A 84 PHE HD% 1.0 . 5.23 2850 2424 A 104 THR HG2% A 97 TRP HD1 1.0 . 3.59 2851 2425 A 79 LEU HA A 84 PHE HE% 1.0 . 5.50 2852 2426 A 94 LEU HA A 97 TRP HD1 1.0 . 5.36 2853 2427 A 97 TRP HD1 A 103 PRO HDx 1.0 . 5.50 2854 2427 A 103 PRO HDy A 97 TRP HD1 1.0 . 5.50 2855 2428 A 15 GLU HB3 A 16 TRP HD1 1.0 . 3.94 2856 2429 A 14 LEU HG A 21 PHE HE% 1.0 . 5.50 2857 2430 A 97 TRP HZ2 A 103 PRO HDx 1.0 . 3.10 2858 2430 A 103 PRO HDy A 97 TRP HZ2 1.0 . 3.10 2859 2431 A 119 TYR HD% A 120 ASN HA 1.0 . 6.00 2860 2432 A 58 LYS HA A 84 PHE HD% 1.0 . 3.72 2861 2433 A 16 TRP H A 16 TRP HD1 1.0 . 3.81 2862 2434 A 15 GLU HG3 A 16 TRP HD1 1.0 . 5.51 2863 2435 A 84 PHE HD% A 85 GLU HB2 1.0 . 6.00 2864 2436 A 58 LYS HA A 84 PHE HE% 1.0 . 4.49 2865 2437 A 14 LEU HA A 21 PHE HE% 1.0 . 4.72 2866 2438 A 97 TRP HZ3 A 11 LYS HG3 1.0 . 5.50 2867 2439 A 23 ILE HD1% A 21 PHE HE% 1.0 . 4.96 2868 2440 A 22 THR HA A 21 PHE HD% 1.0 . 5.50 2869 2441 A 19 PRO HA A 21 PHE HD% 1.0 . 5.50 2870 2442 A 63 TYR HE% A 1 MET HE% 1.0 . 5.76 2871 2443 A 36 HIS HE1 A 106 GLY HAx 1.0 . 3.50 2872 2443 A 106 GLY HAy A 36 HIS HE1 1.0 . 3.50 2873 2444 A 8 HIS HA A 8 HIS HD2 1.0 . 5.64 2874 2445 A 21 PHE HZ A 14 LEU HBy 1.0 . 5.47 2875 2446 A 1 MET HE% A 63 TYR HD% 1.0 . 6.00 2876 2447 A 37 ILE HG2% A 97 TRP HD1 1.0 . 5.89 2877 2448 A 97 TRP HD1 A 102 GLY HAx 1.0 . 4.38 2878 2448 A 102 GLY HAy A 97 TRP HD1 1.0 . 4.38 2879 2449 A 9 VAL HG2% A 8 HIS HD2 1.0 . 5.45 2880 2450 A 63 TYR HE% A 10 LEU HD2% 1.0 . 6.00 2881 2451 A 32 TYR HD% A 25 ASP HBy 1.0 . 4.43 2882 2452 A 63 TYR HE% A 21 PHE HE% 1.0 . 5.84 2883 2453 A 97 TRP HH2 A 10 LEU HA 1.0 . 6.00 2884 2454 A 97 TRP HD1 A 37 ILE HG1x 1.0 . 4.66 2885 2455 A 63 TYR HD% A 5 SER HBx 1.0 . 4.77 2886 2455 A 63 TYR HD% A 5 SER HBy 1.0 . 4.77 2887 2456 A 52 ALA HB% A 84 PHE HZ 1.0 . 4.90 2888 2457 A 119 TYR HA A 119 TYR HE% 1.0 . 6.00 2889 2458 A 85 GLU HB3 A 86 HIS HE1 1.0 . 5.62 2890 2459 A 16 TRP HD1 A 16 TRP HA 1.0 . 4.07 2891 2460 A 33 ASN HA A 36 HIS HE1 1.0 . 6.00 2892 2461 A 84 PHE HE% A 53 SER HA 1.0 . 5.01 2893 2462 A 119 TYR HE% A 121 VAL HGx% 1.0 . 6.00 2894 2462 A 121 VAL HGy% A 119 TYR HE% 1.0 . 6.00 2895 2463 A 20 ALA H A 21 PHE HD% 1.0 . 5.83 2896 2464 A 63 TYR HD% A 21 PHE HD% 1.0 . 5.61 2897 2465 A 86 HIS HD2 A 86 HIS HBx 1.0 . 3.85 2898 2465 A 86 HIS HBy A 86 HIS HD2 1.0 . 3.85 2899 2466 A 16 TRP HB2 A 16 TRP HD1 1.0 . 3.76 2900 2467 A 97 TRP HZ3 A 7 ALA HA 1.0 . 5.11 2901 2468 A 10 LEU HD1% A 21 PHE HZ 1.0 . 5.50 2902 2469 A 21 PHE HD% A 13 ARG HE 1.0 . 6.00 2903 2470 A 100 ILE HD1% A 8 HIS HD2 1.0 . 5.39 2904 2471 A 11 LYS HB2 A 97 TRP HE3 1.0 . 5.50 2905 2472 A 10 LEU HG A 97 TRP HE3 1.0 . 5.50 2906 2473 A 16 TRP HB3 A 16 TRP HD1 1.0 . 3.84 2907 2474 A 37 ILE HD1% A 97 TRP HZ2 1.0 . 6.00 2908 2475 A 86 HIS H A 86 HIS HD2 1.0 . 6.00 2909 2476 A 10 LEU HB2 A 97 TRP HE3 1.0 . 5.50 2910 2477 A 11 LYS HG3 A 97 TRP HE3 1.0 . 5.50 2911 2478 A 21 PHE HE% A 14 LEU HDx% 1.0 . 4.25 2912 2478 A 14 LEU HDy% A 21 PHE HE% 1.0 . 4.25 2913 2479 A 16 TRP HD1 A 12 SER HBx 1.0 . 4.42 2914 2479 A 12 SER HBy A 16 TRP HD1 1.0 . 4.42 2915 2480 A 100 ILE HG2% A 8 HIS HE1 1.0 . 5.41 2916 2481 A 97 TRP HZ2 A 11 LYS HG2 1.0 . 5.50 2917 2482 A 57 GLU H A 84 PHE HD% 1.0 . 5.50 2918 2483 A 84 PHE HD% A 58 LYS H 1.0 . 5.50 2919 2484 A 98 LYS H A 97 TRP HD1 1.0 . 4.99 2920 2485 A 97 TRP HZ2 A 103 PRO HG2 1.0 . 3.66 2921 2485 A 103 PRO HG3 A 97 TRP HZ2 1.0 . 3.66 2922 2486 A 63 TYR HD% A 90 LEU HA 1.0 . 5.59 2923 2487 A 11 LYS HA A 97 TRP HZ2 1.0 . 4.98 2924 2488 A 97 TRP HD1 A 37 ILE HG1y 1.0 . 4.66 2925 2489 A 36 HIS HD2 A 40 ALA H 1.0 . 3.72 2926 2490 A 63 TYR HE% A 5 SER HBx 1.0 . 4.91 2927 2490 A 63 TYR HE% A 5 SER HBy 1.0 . 4.91 2928 2491 A 63 TYR HE% A 21 PHE HD% 1.0 . 5.22 2929 2492 A 63 TYR HE% A 9 VAL HG1% 1.0 . 6.00 2930 2493 A 25 ASP H A 32 TYR HD% 1.0 . 6.00 2931 2494 A 119 TYR HD% A 121 VAL HGx% 1.0 . 6.00 2932 2494 A 121 VAL HGy% A 119 TYR HD% 1.0 . 6.00 2933 2495 A 37 ILE HD1% A 97 TRP HD1 1.0 . 6.00 2934 2496 A 23 ILE HD1% A 21 PHE HZ 1.0 . 6.00 2935 2497 A 79 LEU HD2% A 84 PHE HD% 1.0 . 5.02 2936 2498 A 86 HIS HD2 A 59 SER HA 1.0 . 3.86 2937 2499 A 100 ILE HG2% A 8 HIS HD2 1.0 . 5.32 2938 2500 A 37 ILE HG2% A 97 TRP HH2 1.0 . 5.50 2939 2501 A 84 PHE HE% A 82 ALA HB% 1.0 . 5.08 2940 2502 A 84 PHE HD% A 79 LEU HA 1.0 . 4.08 2941 2503 A 63 TYR HE% A 13 ARG HD3 1.0 . 5.50 2942 2504 A 63 TYR HE% A 1 MET HG2 1.0 . 5.50 2943 2505 A 21 PHE HD% A 13 ARG HD3 1.0 . 6.00 2944 2506 A 36 HIS HD2 A 37 ILE HA 1.0 . 6.00 2945 2507 A 63 TYR HE% A 10 LEU HB2 1.0 . 6.00 2946 2508 A 86 HIS HA A 86 HIS HD2 1.0 . 4.41 2947 2509 A 21 PHE HD% A 20 ALA HB% 1.0 . 5.50 2948 2510 A 97 TRP HA A 97 TRP HE3 1.0 . 3.07 2949 2511 A 63 TYR HD% A 63 TYR HA 1.0 . 4.22 2950 2512 A 9 VAL HG2% A 8 HIS HE1 1.0 . 5.72 2951 2513 A 14 LEU H A 21 PHE HZ 1.0 . 6.00 2952 2514 A 63 TYR HD% A 90 LEU HD2% 1.0 . 6.00 2953 2515 A 38 MET H A 97 TRP HZ2 1.0 . 5.28 2954 2516 A 11 LYS HG3 A 97 TRP HZ2 1.0 . 5.21 2955 2517 A 23 ILE HD1% A 97 TRP HZ2 1.0 . 6.00 2956 2518 A 97 TRP H A 97 TRP HD1 1.0 . 5.39 2957 2519 A 38 MET H A 97 TRP HD1 1.0 . 5.50 2958 2520 A 84 PHE HE% A 87 VAL HG2% 1.0 . 5.50 2959 2521 A 84 PHE H A 84 PHE HD% 1.0 . 3.43 2960 2522 A 85 GLU HG2 A 86 HIS HD2 1.0 . 5.05 2961 2523 A 16 TRP HE3 A 12 SER HBx 1.0 . 5.92 2962 2523 A 12 SER HBy A 16 TRP HE3 1.0 . 5.92 2963 2524 A 84 PHE HD% A 62 ILE HB 1.0 . 5.50 2964 2525 A 19 PRO HA A 21 PHE HE% 1.0 . 4.79 2965 2526 A 84 PHE H A 84 PHE HE% 1.0 . 5.50 2966 2527 A 63 TYR HD% A 62 ILE HA 1.0 . 5.17 2967 2528 A 97 TRP HA A 97 TRP HD1 1.0 . 5.50 2968 2529 A 104 THR HB A 97 TRP HD1 1.0 . 5.50 2969 2530 A 100 ILE HB A 8 HIS HE1 1.0 . 5.52 2970 2531 A 15 GLU HA A 16 TRP HD1 1.0 . 5.74 2971 2532 A 63 TYR HD% A 90 LEU HD1% 1.0 . 6.00 2972 2533 A 16 TRP HA A 16 TRP HE3 1.0 . 4.02 2973 2534 A 8 HIS H A 8 HIS HD2 1.0 . 4.54 2974 2535 A 10 LEU HD2% A 63 TYR HD% 1.0 . 5.50 2975 2536 A 100 ILE HD1% A 97 TRP HE3 1.0 . 5.50 2976 2537 A 10 LEU HB3 A 97 TRP HE3 1.0 . 5.56 2977 2538 A 1 MET HG2 A 88 SER HBx 1.0 . 5.12 2978 2538 A 1 MET HG2 A 88 SER HBy 1.0 . 5.12 2979 2539 A 1 MET HG3 A 88 SER HBx 1.0 . 5.01 2980 2539 A 1 MET HG3 A 88 SER HBy 1.0 . 5.01 2981 2540 A 1 MET HE% A 61 ASP HBy 1.0 . 4.47 2982 2540 A 1 MET HE% A 61 ASP HBx 1.0 . 4.47 2983 2541 A 1 MET HE% A 88 SER HBx 1.0 . 4.49 2984 2541 A 1 MET HE% A 88 SER HBy 1.0 . 4.49 2985 2542 A 2 GLU HBx A 3 PRO HD2 1.0 . 3.11 2986 2542 A 2 GLU HBy A 3 PRO HD2 1.0 . 3.11 2987 2542 A 3 PRO HD3 A 2 GLU HBx 1.0 . 3.11 2988 2542 A 3 PRO HD3 A 2 GLU HBy 1.0 . 3.11 2989 2543 A 4 GLN H A 2 GLU HBx 1.0 . 5.06 2990 2543 A 4 GLN H A 2 GLU HBy 1.0 . 5.06 2991 2544 A 6 ASP H A 6 ASP HBx 1.0 . 3.58 2992 2544 A 6 ASP H A 6 ASP HBy 1.0 . 3.58 2993 2545 A 7 ALA HB% A 6 ASP HBx 1.0 . 5.81 2994 2545 A 6 ASP HBy A 7 ALA HB% 1.0 . 5.81 2995 2546 A 8 HIS H A 6 ASP HBx 1.0 . 5.01 2996 2546 A 6 ASP HBy A 8 HIS H 1.0 . 5.01 2997 2547 A 8 HIS HD2 A 6 ASP HBx 1.0 . 4.15 2998 2547 A 6 ASP HBy A 8 HIS HD2 1.0 . 4.15 2999 2548 A 9 VAL H A 6 ASP HBx 1.0 . 5.01 3000 2548 A 9 VAL H A 6 ASP HBy 1.0 . 5.01 3001 2549 A 9 VAL HB A 6 ASP HBx 1.0 . 5.81 3002 2549 A 6 ASP HBy A 9 VAL HB 1.0 . 5.81 3003 2550 A 9 VAL HG2% A 6 ASP HBx 1.0 . 4.60 3004 2550 A 6 ASP HBy A 9 VAL HG2% 1.0 . 4.60 3005 2551 A 90 LEU HD1% A 6 ASP HBx 1.0 . 5.34 3006 2551 A 6 ASP HBy A 90 LEU HD1% 1.0 . 5.34 3007 2552 A 9 VAL H A 8 HIS HBx 1.0 . 4.24 3008 2552 A 9 VAL H A 8 HIS HBy 1.0 . 4.24 3009 2553 A 9 VAL HG2% A 8 HIS HBx 1.0 . 5.81 3010 2553 A 9 VAL HG2% A 8 HIS HBy 1.0 . 5.81 3011 2554 A 100 ILE HD1% A 8 HIS HBx 1.0 . 4.87 3012 2554 A 100 ILE HD1% A 8 HIS HBy 1.0 . 4.87 3013 2555 A 10 LEU HD1% A 23 ILE HG1x 1.0 . 5.34 3014 2555 A 10 LEU HD1% A 23 ILE HG1y 1.0 . 5.34 3015 2556 A 10 LEU HD2% A 23 ILE HG1x 1.0 . 4.48 3016 2556 A 10 LEU HD2% A 23 ILE HG1y 1.0 . 4.48 3017 2557 A 11 LYS HA A 14 LEU HBx 1.0 . 3.91 3018 2557 A 11 LYS HA A 14 LEU HBy 1.0 . 3.91 3019 2558 A 100 ILE HB A 11 LYS HEx 1.0 . 5.73 3020 2558 A 100 ILE HB A 11 LYS HEy 1.0 . 5.73 3021 2559 A 11 LYS HEx A 103 PRO HDx 1.0 . 4.31 3022 2559 A 11 LYS HEy A 103 PRO HDx 1.0 . 4.31 3023 2559 A 103 PRO HDy A 11 LYS HEx 1.0 . 4.31 3024 2559 A 103 PRO HDy A 11 LYS HEy 1.0 . 4.31 3025 2560 A 13 ARG H A 14 LEU HBx 1.0 . 4.86 3026 2560 A 13 ARG H A 14 LEU HBy 1.0 . 4.86 3027 2561 A 13 ARG HG2 A 17 GLY HAy 1.0 . 5.81 3028 2561 A 13 ARG HG2 A 17 GLY HAx 1.0 . 5.81 3029 2562 A 14 LEU H A 14 LEU HBx 1.0 . 3.41 3030 2562 A 14 LEU H A 14 LEU HBy 1.0 . 3.41 3031 2563 A 15 GLU H A 14 LEU HBx 1.0 . 3.83 3032 2563 A 15 GLU H A 14 LEU HBy 1.0 . 3.83 3033 2564 A 21 PHE HZ A 14 LEU HBx 1.0 . 4.62 3034 2564 A 21 PHE HZ A 14 LEU HBy 1.0 . 4.62 3035 2565 A 97 TRP HH2 A 14 LEU HBx 1.0 . 5.34 3036 2565 A 97 TRP HH2 A 14 LEU HBy 1.0 . 5.34 3037 2566 A 16 TRP HB2 A 17 GLY HAy 1.0 . 5.09 3038 2566 A 16 TRP HB2 A 17 GLY HAx 1.0 . 5.09 3039 2567 A 16 TRP HB3 A 17 GLY HAy 1.0 . 5.09 3040 2567 A 16 TRP HB3 A 17 GLY HAx 1.0 . 5.09 3041 2568 A 18 GLU HA A 17 GLY HAy 1.0 . 4.93 3042 2568 A 18 GLU HA A 17 GLY HAx 1.0 . 4.93 3043 2569 A 18 GLU H A 18 GLU HBx 1.0 . 3.26 3044 2569 A 18 GLU H A 18 GLU HBy 1.0 . 3.26 3045 2570 A 19 PRO HD2 A 18 GLU HBx 1.0 . 4.71 3046 2570 A 19 PRO HD2 A 18 GLU HBy 1.0 . 4.71 3047 2571 A 19 PRO HD3 A 18 GLU HBx 1.0 . 4.20 3048 2571 A 19 PRO HD3 A 18 GLU HBy 1.0 . 4.20 3049 2572 A 20 ALA HB% A 61 ASP HBy 1.0 . 5.34 3050 2572 A 20 ALA HB% A 61 ASP HBx 1.0 . 5.34 3051 2573 A 21 PHE HA A 61 ASP HBy 1.0 . 4.66 3052 2573 A 21 PHE HA A 61 ASP HBx 1.0 . 4.66 3053 2574 A 22 THR H A 21 PHE HBy 1.0 . 3.75 3054 2574 A 22 THR H A 21 PHE HBx 1.0 . 3.75 3055 2575 A 22 THR HB A 21 PHE HBy 1.0 . 5.34 3056 2575 A 22 THR HB A 21 PHE HBx 1.0 . 5.34 3057 2576 A 21 PHE HBy A 61 ASP HBy 1.0 . 5.18 3058 2576 A 21 PHE HBx A 61 ASP HBy 1.0 . 5.18 3059 2576 A 61 ASP HBx A 21 PHE HBy 1.0 . 5.18 3060 2576 A 61 ASP HBx A 21 PHE HBx 1.0 . 5.18 3061 2577 A 63 TYR HD% A 21 PHE HBy 1.0 . 4.87 3062 2577 A 63 TYR HD% A 21 PHE HBx 1.0 . 4.87 3063 2578 A 63 TYR HE% A 21 PHE HBy 1.0 . 4.04 3064 2578 A 63 TYR HE% A 21 PHE HBx 1.0 . 4.04 3065 2579 A 21 PHE HD% A 23 ILE HG1x 1.0 . 4.56 3066 2579 A 21 PHE HD% A 23 ILE HG1y 1.0 . 4.56 3067 2580 A 21 PHE HE% A 23 ILE HG1x 1.0 . 4.43 3068 2580 A 21 PHE HE% A 23 ILE HG1y 1.0 . 4.43 3069 2581 A 22 THR H A 62 ILE HG1x 1.0 . 5.08 3070 2581 A 22 THR H A 62 ILE HG1y 1.0 . 5.08 3071 2582 A 22 THR HB A 62 ILE HG1x 1.0 . 4.08 3072 2582 A 22 THR HB A 62 ILE HG1y 1.0 . 4.08 3073 2583 A 22 THR HG2% A 62 ILE HG1x 1.0 . 5.09 3074 2583 A 22 THR HG2% A 62 ILE HG1y 1.0 . 5.09 3075 2584 A 23 ILE H A 23 ILE HG1x 1.0 . 3.99 3076 2584 A 23 ILE H A 23 ILE HG1y 1.0 . 3.99 3077 2585 A 24 LEU H A 23 ILE HG1x 1.0 . 5.23 3078 2585 A 24 LEU H A 23 ILE HG1y 1.0 . 5.23 3079 2586 A 40 ALA HB% A 23 ILE HG1x 1.0 . 5.34 3080 2586 A 40 ALA HB% A 23 ILE HG1y 1.0 . 5.34 3081 2587 A 63 TYR H A 23 ILE HG1x 1.0 . 5.34 3082 2587 A 63 TYR H A 23 ILE HG1y 1.0 . 5.34 3083 2588 A 63 TYR HB2 A 23 ILE HG1x 1.0 . 5.05 3084 2588 A 63 TYR HB2 A 23 ILE HG1y 1.0 . 5.05 3085 2589 A 63 TYR HB3 A 23 ILE HG1x 1.0 . 5.34 3086 2589 A 63 TYR HB3 A 23 ILE HG1y 1.0 . 5.34 3087 2590 A 63 TYR HD% A 23 ILE HG1x 1.0 . 4.11 3088 2590 A 63 TYR HD% A 23 ILE HG1y 1.0 . 4.11 3089 2591 A 23 ILE HD1% A 39 GLY HAy 1.0 . 5.81 3090 2591 A 23 ILE HD1% A 39 GLY HAx 1.0 . 5.81 3091 2592 A 24 LEU HD1% A 62 ILE HG1x 1.0 . 5.34 3092 2592 A 24 LEU HD1% A 62 ILE HG1y 1.0 . 5.34 3093 2593 A 25 ASP H A 25 ASP HBy 1.0 . 3.53 3094 2593 A 25 ASP H A 25 ASP HBx 1.0 . 3.53 3095 2594 A 32 TYR HD% A 25 ASP HBy 1.0 . 3.89 3096 2594 A 32 TYR HD% A 25 ASP HBx 1.0 . 3.89 3097 2595 A 37 ILE H A 25 ASP HBy 1.0 . 5.81 3098 2595 A 37 ILE H A 25 ASP HBx 1.0 . 5.81 3099 2596 A 40 ALA HB% A 25 ASP HBy 1.0 . 4.43 3100 2596 A 40 ALA HB% A 25 ASP HBx 1.0 . 4.43 3101 2597 A 42 ALA HA A 25 ASP HBy 1.0 . 4.30 3102 2597 A 42 ALA HA A 25 ASP HBx 1.0 . 4.30 3103 2598 A 42 ALA HB% A 25 ASP HBy 1.0 . 5.81 3104 2598 A 42 ALA HB% A 25 ASP HBx 1.0 . 5.81 3105 2599 A 43 MET H A 25 ASP HBy 1.0 . 5.81 3106 2599 A 43 MET H A 25 ASP HBx 1.0 . 5.81 3107 2600 A 31 THR HG2% A 27 ARG HH1% 1.0 . 4.25 3108 2601 A 67 ALA HB% A 27 ARG HH1% 1.0 . 5.34 3109 2602 A 94 LEU HD2% A 27 ARG HH1% 1.0 . 5.34 3110 2603 A 94 LEU HD2% A 27 ARG HH2y 1.0 . 5.09 3111 2603 A 94 LEU HD2% A 27 ARG HH2x 1.0 . 5.09 3112 2604 A 28 ASP H A 28 ASP HBy 1.0 . 3.27 3113 2604 A 28 ASP H A 28 ASP HBx 1.0 . 3.27 3114 2605 A 29 ARG H A 28 ASP HBy 1.0 . 3.45 3115 2605 A 29 ARG H A 28 ASP HBx 1.0 . 3.45 3116 2606 A 30 SER HA A 28 ASP HBy 1.0 . 5.34 3117 2606 A 30 SER HA A 28 ASP HBx 1.0 . 5.34 3118 2607 A 28 ASP HBy A 30 SER HBx 1.0 . 4.65 3119 2607 A 30 SER HBy A 28 ASP HBy 1.0 . 4.65 3120 2607 A 30 SER HBy A 28 ASP HBx 1.0 . 4.65 3121 2607 A 28 ASP HBx A 30 SER HBx 1.0 . 4.65 3122 2608 A 31 THR H A 28 ASP HBy 1.0 . 4.23 3123 2608 A 31 THR H A 28 ASP HBx 1.0 . 4.23 3124 2609 A 31 THR HB A 28 ASP HBy 1.0 . 4.76 3125 2609 A 31 THR HB A 28 ASP HBx 1.0 . 4.76 3126 2610 A 31 THR HG2% A 28 ASP HBy 1.0 . 5.34 3127 2610 A 31 THR HG2% A 28 ASP HBx 1.0 . 5.34 3128 2611 A 32 TYR H A 28 ASP HBy 1.0 . 5.68 3129 2611 A 32 TYR H A 28 ASP HBx 1.0 . 5.68 3130 2612 A 33 ASN HD2x A 29 ARG HG2 1.0 . 4.67 3131 2612 A 33 ASN HD2y A 29 ARG HG2 1.0 . 4.67 3132 2613 A 33 ASN HD2x A 29 ARG HG3 1.0 . 4.34 3133 2613 A 33 ASN HD2y A 29 ARG HG3 1.0 . 4.34 3134 2614 A 33 ASN HD2x A 29 ARG HG3 1.0 . 4.58 3135 2614 A 33 ASN HD2x A 29 ARG HG2 1.0 . 4.58 3136 2614 A 33 ASN HD2y A 29 ARG HG2 1.0 . 4.58 3137 2614 A 33 ASN HD2y A 29 ARG HG3 1.0 . 4.58 3138 2615 A 33 ASN HD2y A 29 ARG HD3 1.0 . 4.82 3139 2615 A 33 ASN HD2y A 29 ARG HD2 1.0 . 4.82 3140 2615 A 29 ARG HD3 A 33 ASN HD2x 1.0 . 4.82 3141 2615 A 33 ASN HD2x A 29 ARG HD2 1.0 . 4.82 3142 2616 A 30 SER HA A 33 ASN HD2x 1.0 . 4.14 3143 2616 A 33 ASN HD2y A 30 SER HA 1.0 . 4.14 3144 2617 A 31 THR HA A 34 ASP HBy 1.0 . 3.51 3145 2617 A 31 THR HA A 34 ASP HBx 1.0 . 3.51 3146 2618 A 31 THR HG2% A 34 ASP HBy 1.0 . 5.62 3147 2618 A 31 THR HG2% A 34 ASP HBx 1.0 . 5.62 3148 2619 A 33 ASN H A 33 ASN HD2x 1.0 . 4.98 3149 2619 A 33 ASN HD2y A 33 ASN H 1.0 . 4.98 3150 2620 A 33 ASN HA A 107 ILE HG1x 1.0 . 4.94 3151 2620 A 33 ASN HA A 107 ILE HG1y 1.0 . 4.94 3152 2621 A 34 ASP H A 34 ASP HBy 1.0 . 3.01 3153 2621 A 34 ASP H A 34 ASP HBx 1.0 . 3.01 3154 2622 A 34 ASP HA A 107 ILE HG1x 1.0 . 4.58 3155 2622 A 34 ASP HA A 107 ILE HG1y 1.0 . 4.58 3156 2623 A 34 ASP HA A 108 ILE HG1x 1.0 . 4.35 3157 2623 A 34 ASP HA A 108 ILE HG1y 1.0 . 4.35 3158 2624 A 35 GLY H A 34 ASP HBy 1.0 . 3.49 3159 2624 A 35 GLY H A 34 ASP HBx 1.0 . 3.49 3160 2625 A 34 ASP HBx A 35 GLY HAx 1.0 . 5.26 3161 2625 A 34 ASP HBy A 35 GLY HAx 1.0 . 5.26 3162 2625 A 35 GLY HAy A 34 ASP HBy 1.0 . 5.26 3163 2625 A 35 GLY HAy A 34 ASP HBx 1.0 . 5.26 3164 2626 A 107 ILE HB A 34 ASP HBy 1.0 . 5.81 3165 2626 A 107 ILE HB A 34 ASP HBx 1.0 . 5.81 3166 2627 A 107 ILE HG2% A 34 ASP HBy 1.0 . 5.81 3167 2627 A 107 ILE HG2% A 34 ASP HBx 1.0 . 5.81 3168 2628 A 108 ILE HB A 34 ASP HBy 1.0 . 4.69 3169 2628 A 108 ILE HB A 34 ASP HBx 1.0 . 4.69 3170 2629 A 108 ILE HG2% A 34 ASP HBy 1.0 . 5.81 3171 2629 A 108 ILE HG2% A 34 ASP HBx 1.0 . 5.81 3172 2630 A 34 ASP HBy A 108 ILE HG1x 1.0 . 4.43 3173 2630 A 34 ASP HBx A 108 ILE HG1x 1.0 . 4.43 3174 2630 A 108 ILE HG1y A 34 ASP HBy 1.0 . 4.43 3175 2630 A 34 ASP HBx A 108 ILE HG1y 1.0 . 4.43 3176 2631 A 108 ILE HD1% A 34 ASP HBy 1.0 . 4.99 3177 2631 A 108 ILE HD1% A 34 ASP HBx 1.0 . 4.99 3178 2632 A 36 HIS HA A 37 ILE HG1x 1.0 . 5.81 3179 2632 A 36 HIS HA A 37 ILE HG1y 1.0 . 5.81 3180 2633 A 36 HIS HE1 A 107 ILE HG1x 1.0 . 5.18 3181 2633 A 36 HIS HE1 A 107 ILE HG1y 1.0 . 5.18 3182 2634 A 37 ILE H A 37 ILE HG1x 1.0 . 3.95 3183 2634 A 37 ILE H A 37 ILE HG1y 1.0 . 3.95 3184 2635 A 37 ILE HA A 38 MET HBy 1.0 . 5.09 3185 2635 A 37 ILE HA A 38 MET HBx 1.0 . 5.09 3186 2636 A 94 LEU HD1% A 37 ILE HG1x 1.0 . 4.65 3187 2636 A 94 LEU HD1% A 37 ILE HG1y 1.0 . 4.65 3188 2637 A 97 TRP HD1 A 37 ILE HG1x 1.0 . 3.99 3189 2637 A 97 TRP HD1 A 37 ILE HG1y 1.0 . 3.99 3190 2638 A 97 TRP HE1 A 37 ILE HG1x 1.0 . 5.09 3191 2638 A 97 TRP HE1 A 37 ILE HG1y 1.0 . 5.09 3192 2639 A 104 THR HG2% A 37 ILE HG1x 1.0 . 5.81 3193 2639 A 104 THR HG2% A 37 ILE HG1y 1.0 . 5.81 3194 2640 A 38 MET HE% A 38 MET HBy 1.0 . 4.43 3195 2640 A 38 MET HE% A 38 MET HBx 1.0 . 4.43 3196 2641 A 39 GLY H A 38 MET HBy 1.0 . 4.06 3197 2641 A 39 GLY H A 38 MET HBx 1.0 . 4.06 3198 2642 A 97 TRP HZ2 A 38 MET HBy 1.0 . 5.34 3199 2642 A 97 TRP HZ2 A 38 MET HBx 1.0 . 5.34 3200 2643 A 103 PRO HB2 A 38 MET HBy 1.0 . 4.18 3201 2643 A 103 PRO HB2 A 38 MET HBx 1.0 . 4.18 3202 2644 A 103 PRO HB3 A 38 MET HBy 1.0 . 5.03 3203 2644 A 103 PRO HB3 A 38 MET HBx 1.0 . 5.03 3204 2645 A 38 MET HBx A 103 PRO HG2 1.0 . 4.05 3205 2645 A 38 MET HBy A 103 PRO HG2 1.0 . 4.05 3206 2645 A 103 PRO HG3 A 38 MET HBy 1.0 . 4.05 3207 2645 A 103 PRO HG3 A 38 MET HBx 1.0 . 4.05 3208 2646 A 104 THR HA A 38 MET HBy 1.0 . 5.12 3209 2646 A 104 THR HA A 38 MET HBx 1.0 . 5.12 3210 2647 A 38 MET HG2 A 39 GLY HAy 1.0 . 4.48 3211 2647 A 39 GLY HAx A 38 MET HG2 1.0 . 4.48 3212 2647 A 38 MET HG3 A 39 GLY HAx 1.0 . 4.48 3213 2647 A 38 MET HG3 A 39 GLY HAy 1.0 . 4.48 3214 2648 A 38 MET HE% A 39 GLY HAy 1.0 . 5.81 3215 2648 A 38 MET HE% A 39 GLY HAx 1.0 . 5.81 3216 2649 A 43 MET HG3 A 51 ARG HBy 1.0 . 4.21 3217 2649 A 43 MET HG3 A 51 ARG HBx 1.0 . 4.21 3218 2650 A 43 MET HE% A 54 SER HBx 1.0 . 5.34 3219 2650 A 54 SER HBy A 43 MET HE% 1.0 . 5.34 3220 2651 A 43 MET HE% A 55 SER HBx 1.0 . 4.41 3221 2651 A 55 SER HBy A 43 MET HE% 1.0 . 4.41 3222 2652 A 45 ILE HA A 45 ILE HG1x 1.0 . 3.04 3223 2652 A 45 ILE HA A 45 ILE HG1y 1.0 . 3.04 3224 2653 A 74 GLN HE2y A 45 ILE HG2% 1.0 . 5.81 3225 2653 A 74 GLN HE2x A 45 ILE HG2% 1.0 . 5.81 3226 2654 A 45 ILE HG1x A 48 LEU HBx 1.0 . 5.34 3227 2654 A 45 ILE HG1y A 48 LEU HBx 1.0 . 5.34 3228 2654 A 48 LEU HBy A 45 ILE HG1x 1.0 . 5.34 3229 2654 A 45 ILE HG1y A 48 LEU HBy 1.0 . 5.34 3230 2655 A 71 GLN HG3 A 45 ILE HG1x 1.0 . 5.34 3231 2655 A 45 ILE HG1y A 71 GLN HG3 1.0 . 5.34 3232 2656 A 71 GLN HE21 A 45 ILE HG1x 1.0 . 5.34 3233 2656 A 45 ILE HG1y A 71 GLN HE21 1.0 . 5.34 3234 2657 A 74 GLN HG3 A 45 ILE HG1x 1.0 . 5.34 3235 2657 A 45 ILE HG1y A 74 GLN HG3 1.0 . 5.34 3236 2658 A 78 LEU HB2 A 45 ILE HG1x 1.0 . 5.34 3237 2658 A 45 ILE HG1y A 78 LEU HB2 1.0 . 5.34 3238 2659 A 78 LEU HD1% A 45 ILE HG1x 1.0 . 4.20 3239 2659 A 45 ILE HG1y A 78 LEU HD1% 1.0 . 4.20 3240 2660 A 78 LEU HD2% A 45 ILE HG1x 1.0 . 5.81 3241 2660 A 78 LEU HD2% A 45 ILE HG1y 1.0 . 5.81 3242 2661 A 45 ILE HD1% A 74 GLN HBx 1.0 . 3.81 3243 2661 A 45 ILE HD1% A 74 GLN HBy 1.0 . 3.81 3244 2662 A 47 ASP HB3 A 51 ARG HBy 1.0 . 5.80 3245 2662 A 47 ASP HB3 A 51 ARG HBx 1.0 . 5.80 3246 2663 A 48 LEU HA A 51 ARG HBy 1.0 . 4.18 3247 2663 A 48 LEU HA A 51 ARG HBx 1.0 . 4.18 3248 2664 A 48 LEU HD1% A 51 ARG HBy 1.0 . 5.45 3249 2664 A 48 LEU HD1% A 51 ARG HBx 1.0 . 5.45 3250 2665 A 49 VAL HG1% A 53 SER HBy 1.0 . 5.81 3251 2665 A 49 VAL HG1% A 53 SER HBx 1.0 . 5.81 3252 2666 A 50 ASP HA A 53 SER HBy 1.0 . 4.15 3253 2666 A 50 ASP HA A 53 SER HBx 1.0 . 4.15 3254 2667 A 50 ASP HBx A 51 ARG HBy 1.0 . 5.56 3255 2667 A 50 ASP HBy A 51 ARG HBy 1.0 . 5.56 3256 2667 A 51 ARG HBx A 50 ASP HBx 1.0 . 5.56 3257 2667 A 50 ASP HBy A 51 ARG HBx 1.0 . 5.56 3258 2668 A 51 ARG H A 51 ARG HBy 1.0 . 3.17 3259 2668 A 51 ARG H A 51 ARG HBx 1.0 . 3.17 3260 2669 A 51 ARG HE A 51 ARG HBy 1.0 . 5.38 3261 2669 A 51 ARG HBx A 51 ARG HE 1.0 . 5.38 3262 2670 A 52 ALA H A 51 ARG HBy 1.0 . 3.64 3263 2670 A 52 ALA H A 51 ARG HBx 1.0 . 3.64 3264 2671 A 52 ALA HB% A 51 ARG HBy 1.0 . 4.85 3265 2671 A 52 ALA HB% A 51 ARG HBx 1.0 . 4.85 3266 2672 A 51 ARG HBy A 54 SER HBx 1.0 . 5.18 3267 2672 A 51 ARG HBx A 54 SER HBx 1.0 . 5.18 3268 2672 A 54 SER HBy A 51 ARG HBy 1.0 . 5.18 3269 2672 A 54 SER HBy A 51 ARG HBx 1.0 . 5.18 3270 2673 A 52 ALA HA A 56 LEU HBx 1.0 . 4.60 3271 2673 A 52 ALA HA A 56 LEU HBy 1.0 . 4.60 3272 2674 A 52 ALA HB% A 53 SER HBy 1.0 . 5.81 3273 2674 A 52 ALA HB% A 53 SER HBx 1.0 . 5.81 3274 2675 A 52 ALA HB% A 56 LEU HBx 1.0 . 5.00 3275 2675 A 52 ALA HB% A 56 LEU HBy 1.0 . 5.00 3276 2676 A 53 SER H A 53 SER HBy 1.0 . 3.33 3277 2676 A 53 SER H A 53 SER HBx 1.0 . 3.33 3278 2677 A 54 SER H A 53 SER HBy 1.0 . 3.76 3279 2677 A 54 SER H A 53 SER HBx 1.0 . 3.76 3280 2678 A 53 SER HBx A 58 LYS HEx 1.0 . 5.33 3281 2678 A 53 SER HBy A 58 LYS HEx 1.0 . 5.33 3282 2678 A 58 LYS HEy A 53 SER HBy 1.0 . 5.33 3283 2678 A 58 LYS HEy A 53 SER HBx 1.0 . 5.33 3284 2679 A 84 PHE HE% A 53 SER HBy 1.0 . 5.09 3285 2679 A 84 PHE HE% A 53 SER HBx 1.0 . 5.09 3286 2680 A 54 SER H A 54 SER HBx 1.0 . 3.21 3287 2680 A 54 SER H A 54 SER HBy 1.0 . 3.21 3288 2681 A 55 SER H A 55 SER HBx 1.0 . 3.55 3289 2681 A 55 SER H A 55 SER HBy 1.0 . 3.55 3290 2682 A 55 SER H A 56 LEU HBx 1.0 . 5.10 3291 2682 A 55 SER H A 56 LEU HBy 1.0 . 5.10 3292 2683 A 56 LEU H A 55 SER HBx 1.0 . 4.04 3293 2683 A 56 LEU H A 55 SER HBy 1.0 . 4.04 3294 2684 A 56 LEU HG A 55 SER HBx 1.0 . 4.15 3295 2684 A 55 SER HBy A 56 LEU HG 1.0 . 4.15 3296 2685 A 56 LEU HD2% A 55 SER HBx 1.0 . 5.09 3297 2685 A 55 SER HBy A 56 LEU HD2% 1.0 . 5.09 3298 2686 A 56 LEU H A 56 LEU HBx 1.0 . 3.44 3299 2686 A 56 LEU H A 56 LEU HBy 1.0 . 3.44 3300 2687 A 56 LEU HA A 60 ARG HBy 1.0 . 4.76 3301 2687 A 56 LEU HA A 60 ARG HBx 1.0 . 4.76 3302 2688 A 57 GLU H A 56 LEU HBx 1.0 . 3.81 3303 2688 A 57 GLU H A 56 LEU HBy 1.0 . 3.81 3304 2689 A 62 ILE HD1% A 56 LEU HBx 1.0 . 4.80 3305 2689 A 62 ILE HD1% A 56 LEU HBy 1.0 . 4.80 3306 2690 A 79 LEU HD2% A 56 LEU HBx 1.0 . 5.34 3307 2690 A 79 LEU HD2% A 56 LEU HBy 1.0 . 5.34 3308 2691 A 84 PHE HE% A 56 LEU HBx 1.0 . 3.92 3309 2691 A 84 PHE HE% A 56 LEU HBy 1.0 . 3.92 3310 2692 A 84 PHE HZ A 56 LEU HBx 1.0 . 4.45 3311 2692 A 84 PHE HZ A 56 LEU HBy 1.0 . 4.45 3312 2693 A 56 LEU HD1% A 62 ILE HG1x 1.0 . 4.92 3313 2693 A 56 LEU HD1% A 62 ILE HG1y 1.0 . 4.92 3314 2694 A 57 GLU HG2 A 57 GLU HBy 1.0 . 2.61 3315 2694 A 57 GLU HG2 A 57 GLU HBx 1.0 . 2.61 3316 2695 A 58 LYS H A 57 GLU HBy 1.0 . 3.98 3317 2695 A 58 LYS H A 57 GLU HBx 1.0 . 3.98 3318 2696 A 59 SER H A 57 GLU HBy 1.0 . 3.55 3319 2696 A 59 SER H A 57 GLU HBx 1.0 . 3.55 3320 2697 A 60 ARG H A 57 GLU HBy 1.0 . 4.66 3321 2697 A 60 ARG H A 57 GLU HBx 1.0 . 4.66 3322 2698 A 84 PHE HE% A 57 GLU HBy 1.0 . 5.81 3323 2698 A 84 PHE HE% A 57 GLU HBx 1.0 . 5.81 3324 2699 A 58 LYS H A 59 SER HBy 1.0 . 5.81 3325 2699 A 58 LYS H A 59 SER HBx 1.0 . 5.81 3326 2700 A 59 SER H A 59 SER HBy 1.0 . 3.55 3327 2700 A 59 SER H A 59 SER HBx 1.0 . 3.55 3328 2701 A 86 HIS HD2 A 59 SER HBy 1.0 . 4.83 3329 2701 A 86 HIS HD2 A 59 SER HBx 1.0 . 4.83 3330 2702 A 60 ARG H A 60 ARG HBy 1.0 . 3.16 3331 2702 A 60 ARG H A 60 ARG HBx 1.0 . 3.16 3332 2703 A 60 ARG H A 62 ILE HG1x 1.0 . 5.34 3333 2703 A 60 ARG H A 62 ILE HG1y 1.0 . 5.34 3334 2704 A 60 ARG HD3 A 60 ARG HBy 1.0 . 3.70 3335 2704 A 60 ARG HD3 A 60 ARG HBx 1.0 . 3.70 3336 2705 A 60 ARG HBx A 62 ILE HG1x 1.0 . 4.76 3337 2705 A 62 ILE HG1y A 60 ARG HBy 1.0 . 4.76 3338 2705 A 62 ILE HG1y A 60 ARG HBx 1.0 . 4.76 3339 2705 A 60 ARG HBy A 62 ILE HG1x 1.0 . 4.76 3340 2706 A 62 ILE HD1% A 60 ARG HBy 1.0 . 4.69 3341 2706 A 62 ILE HD1% A 60 ARG HBx 1.0 . 4.69 3342 2707 A 84 PHE HD% A 60 ARG HBy 1.0 . 5.81 3343 2707 A 84 PHE HD% A 60 ARG HBx 1.0 . 5.81 3344 2708 A 60 ARG HGy A 62 ILE HG1x 1.0 . 5.07 3345 2708 A 60 ARG HGx A 62 ILE HG1x 1.0 . 5.07 3346 2708 A 62 ILE HG1y A 60 ARG HGx 1.0 . 5.07 3347 2708 A 60 ARG HGy A 62 ILE HG1y 1.0 . 5.07 3348 2709 A 60 ARG HD2 A 61 ASP HBy 1.0 . 5.59 3349 2709 A 60 ARG HD2 A 61 ASP HBx 1.0 . 5.59 3350 2710 A 60 ARG HD2 A 62 ILE HG1x 1.0 . 5.34 3351 2710 A 60 ARG HD2 A 62 ILE HG1y 1.0 . 5.34 3352 2711 A 60 ARG HD3 A 62 ILE HG1x 1.0 . 5.34 3353 2711 A 60 ARG HD3 A 62 ILE HG1y 1.0 . 5.34 3354 2712 A 61 ASP H A 61 ASP HBy 1.0 . 3.56 3355 2712 A 61 ASP H A 61 ASP HBx 1.0 . 3.56 3356 2713 A 61 ASP HA A 62 ILE HG1x 1.0 . 5.20 3357 2713 A 61 ASP HA A 62 ILE HG1y 1.0 . 5.20 3358 2714 A 63 TYR HE% A 61 ASP HBy 1.0 . 5.81 3359 2714 A 63 TYR HE% A 61 ASP HBx 1.0 . 5.81 3360 2715 A 61 ASP HBy A 86 HIS HBx 1.0 . 5.34 3361 2715 A 61 ASP HBx A 86 HIS HBx 1.0 . 5.34 3362 2715 A 86 HIS HBy A 61 ASP HBy 1.0 . 5.34 3363 2715 A 86 HIS HBy A 61 ASP HBx 1.0 . 5.34 3364 2716 A 62 ILE H A 62 ILE HG1x 1.0 . 4.40 3365 2716 A 62 ILE H A 62 ILE HG1y 1.0 . 4.40 3366 2717 A 84 PHE HD% A 62 ILE HG1x 1.0 . 5.34 3367 2717 A 84 PHE HD% A 62 ILE HG1y 1.0 . 5.34 3368 2718 A 63 TYR HD% A 88 SER HBx 1.0 . 4.25 3369 2718 A 63 TYR HD% A 88 SER HBy 1.0 . 4.25 3370 2719 A 69 ASP H A 69 ASP HBx 1.0 . 3.56 3371 2719 A 69 ASP H A 69 ASP HBy 1.0 . 3.56 3372 2720 A 70 GLU H A 70 GLU HBx 1.0 . 3.16 3373 2720 A 70 GLU H A 70 GLU HBy 1.0 . 3.16 3374 2721 A 71 GLN H A 70 GLU HBx 1.0 . 3.80 3375 2721 A 71 GLN H A 70 GLU HBy 1.0 . 3.80 3376 2722 A 72 THR H A 70 GLU HBx 1.0 . 5.81 3377 2722 A 72 THR H A 70 GLU HBy 1.0 . 5.81 3378 2723 A 71 GLN HA A 74 GLN HBx 1.0 . 3.97 3379 2723 A 71 GLN HA A 74 GLN HBy 1.0 . 3.97 3380 2724 A 71 GLN HA A 74 GLN HE2y 1.0 . 5.34 3381 2724 A 71 GLN HA A 74 GLN HE2x 1.0 . 5.34 3382 2725 A 74 GLN HA A 74 GLN HE2y 1.0 . 5.34 3383 2725 A 74 GLN HA A 74 GLN HE2x 1.0 . 5.34 3384 2726 A 74 GLN HA A 77 ASN HBx 1.0 . 3.23 3385 2726 A 74 GLN HA A 77 ASN HBy 1.0 . 3.23 3386 2727 A 74 GLN HA A 77 ASN HD2x 1.0 . 4.15 3387 2727 A 74 GLN HA A 77 ASN HD2y 1.0 . 4.15 3388 2728 A 75 ALA H A 74 GLN HBx 1.0 . 3.36 3389 2728 A 75 ALA H A 74 GLN HBy 1.0 . 3.36 3390 2729 A 75 ALA HA A 74 GLN HBx 1.0 . 5.76 3391 2729 A 75 ALA HA A 74 GLN HBy 1.0 . 5.76 3392 2730 A 75 ALA HB% A 74 GLN HBx 1.0 . 5.09 3393 2730 A 75 ALA HB% A 74 GLN HBy 1.0 . 5.09 3394 2731 A 74 GLN HBx A 77 ASN HBx 1.0 . 5.61 3395 2731 A 74 GLN HBy A 77 ASN HBx 1.0 . 5.61 3396 2731 A 77 ASN HBy A 74 GLN HBx 1.0 . 5.61 3397 2731 A 77 ASN HBy A 74 GLN HBy 1.0 . 5.61 3398 2732 A 78 LEU HD1% A 74 GLN HBx 1.0 . 5.00 3399 2732 A 78 LEU HD1% A 74 GLN HBy 1.0 . 5.00 3400 2733 A 78 LEU HD2% A 74 GLN HBx 1.0 . 5.34 3401 2733 A 78 LEU HD2% A 74 GLN HBy 1.0 . 5.34 3402 2734 A 75 ALA H A 74 GLN HE2y 1.0 . 5.72 3403 2734 A 75 ALA H A 74 GLN HE2x 1.0 . 5.72 3404 2735 A 74 GLN HE2y A 78 LEU HD1% 1.0 . 5.09 3405 2735 A 74 GLN HE2x A 78 LEU HD1% 1.0 . 5.09 3406 2736 A 78 LEU HD2% A 74 GLN HE2y 1.0 . 5.81 3407 2736 A 78 LEU HD2% A 74 GLN HE2x 1.0 . 5.81 3408 2737 A 76 VAL HB A 77 ASN HBx 1.0 . 4.83 3409 2737 A 76 VAL HB A 77 ASN HBy 1.0 . 4.83 3410 2738 A 77 ASN H A 77 ASN HBx 1.0 . 2.79 3411 2738 A 77 ASN H A 77 ASN HBy 1.0 . 2.79 3412 2739 A 77 ASN HBy A 77 ASN HD2x 1.0 . 3.16 3413 2739 A 77 ASN HBx A 77 ASN HD2x 1.0 . 3.16 3414 2739 A 77 ASN HD2y A 77 ASN HBx 1.0 . 3.16 3415 2739 A 77 ASN HBy A 77 ASN HD2y 1.0 . 3.16 3416 2740 A 78 LEU H A 77 ASN HBx 1.0 . 3.72 3417 2740 A 78 LEU H A 77 ASN HBy 1.0 . 3.72 3418 2741 A 78 LEU HB2 A 77 ASN HBx 1.0 . 5.34 3419 2741 A 78 LEU HB2 A 77 ASN HBy 1.0 . 5.34 3420 2742 A 78 LEU HG A 77 ASN HBx 1.0 . 4.78 3421 2742 A 78 LEU HG A 77 ASN HBy 1.0 . 4.78 3422 2743 A 80 ARG HG3 A 77 ASN HBx 1.0 . 5.34 3423 2743 A 80 ARG HG3 A 77 ASN HBy 1.0 . 5.34 3424 2744 A 78 LEU H A 77 ASN HD2x 1.0 . 5.07 3425 2744 A 78 LEU H A 77 ASN HD2y 1.0 . 5.07 3426 2745 A 78 LEU HD2% A 77 ASN HD2x 1.0 . 5.81 3427 2745 A 78 LEU HD2% A 77 ASN HD2y 1.0 . 5.81 3428 2746 A 81 SER H A 77 ASN HD2x 1.0 . 5.70 3429 2746 A 81 SER H A 77 ASN HD2y 1.0 . 5.70 3430 2747 A 77 ASN HD2x A 81 SER HBy 1.0 . 4.29 3431 2747 A 77 ASN HD2y A 81 SER HBy 1.0 . 4.29 3432 2747 A 81 SER HBx A 77 ASN HD2x 1.0 . 4.29 3433 2747 A 81 SER HBx A 77 ASN HD2y 1.0 . 4.29 3434 2748 A 80 ARG HG3 A 81 SER HBy 1.0 . 5.53 3435 2748 A 80 ARG HG3 A 81 SER HBx 1.0 . 5.53 3436 2749 A 81 SER H A 81 SER HBy 1.0 . 3.09 3437 2749 A 81 SER H A 81 SER HBx 1.0 . 3.09 3438 2750 A 82 ALA HB% A 81 SER HBy 1.0 . 5.25 3439 2750 A 81 SER HBx A 82 ALA HB% 1.0 . 5.25 3440 2751 A 91 LYS HA A 92 GLY HAy 1.0 . 4.50 3441 2751 A 91 LYS HA A 92 GLY HAx 1.0 . 4.50 3442 2752 A 95 ALA HB% A 92 GLY HAy 1.0 . 5.19 3443 2752 A 95 ALA HB% A 92 GLY HAx 1.0 . 5.19 3444 2753 A 96 ALA H A 92 GLY HAy 1.0 . 4.92 3445 2753 A 96 ALA H A 92 GLY HAx 1.0 . 4.92 3446 2754 A 96 ALA HB% A 92 GLY HAy 1.0 . 3.51 3447 2754 A 96 ALA HB% A 92 GLY HAx 1.0 . 3.51 3448 2755 A 97 TRP H A 92 GLY HAy 1.0 . 5.34 3449 2755 A 97 TRP H A 92 GLY HAx 1.0 . 5.34 3450 2756 A 94 LEU HG A 98 LYS HEx 1.0 . 5.09 3451 2756 A 94 LEU HG A 98 LYS HEy 1.0 . 5.09 3452 2757 A 94 LEU HD1% A 98 LYS HEx 1.0 . 4.95 3453 2757 A 94 LEU HD1% A 98 LYS HEy 1.0 . 4.95 3454 2758 A 94 LEU HD2% A 98 LYS HEx 1.0 . 4.81 3455 2758 A 94 LEU HD2% A 98 LYS HEy 1.0 . 4.81 3456 2759 A 95 ALA H A 98 LYS HEx 1.0 . 5.34 3457 2759 A 95 ALA H A 98 LYS HEy 1.0 . 5.34 3458 2760 A 95 ALA HA A 98 LYS HEx 1.0 . 5.23 3459 2760 A 95 ALA HA A 98 LYS HEy 1.0 . 5.23 3460 2761 A 95 ALA HB% A 98 LYS HEx 1.0 . 5.81 3461 2761 A 95 ALA HB% A 98 LYS HEy 1.0 . 5.81 3462 2762 A 97 TRP HA A 100 ILE HG1x 1.0 . 3.73 3463 2762 A 97 TRP HA A 100 ILE HG1y 1.0 . 3.73 3464 2763 A 97 TRP HE3 A 100 ILE HG1x 1.0 . 5.34 3465 2763 A 97 TRP HE3 A 100 ILE HG1y 1.0 . 5.34 3466 2764 A 98 LYS HA A 100 ILE HG1x 1.0 . 5.81 3467 2764 A 98 LYS HA A 100 ILE HG1y 1.0 . 5.81 3468 2765 A 98 LYS HA A 101 GLY HAx 1.0 . 5.17 3469 2765 A 98 LYS HA A 101 GLY HAy 1.0 . 5.17 3470 2766 A 98 LYS HB2 A 98 LYS HEx 1.0 . 4.57 3471 2766 A 98 LYS HB2 A 98 LYS HEy 1.0 . 4.57 3472 2767 A 98 LYS HB3 A 98 LYS HEx 1.0 . 3.80 3473 2767 A 98 LYS HB3 A 98 LYS HEy 1.0 . 3.80 3474 2768 A 104 THR HG2% A 98 LYS HEx 1.0 . 5.01 3475 2768 A 104 THR HG2% A 98 LYS HEy 1.0 . 5.01 3476 2769 A 100 ILE H A 100 ILE HG1x 1.0 . 3.31 3477 2769 A 100 ILE H A 100 ILE HG1y 1.0 . 3.31 3478 2770 A 100 ILE H A 101 GLY HAx 1.0 . 5.32 3479 2770 A 100 ILE H A 101 GLY HAy 1.0 . 5.32 3480 2771 A 100 ILE HA A 101 GLY HAx 1.0 . 5.81 3481 2771 A 100 ILE HA A 101 GLY HAy 1.0 . 5.81 3482 2772 A 101 GLY H A 100 ILE HG1x 1.0 . 4.26 3483 2772 A 101 GLY H A 100 ILE HG1y 1.0 . 4.26 3484 2773 A 102 GLY H A 100 ILE HG1x 1.0 . 3.68 3485 2773 A 102 GLY H A 100 ILE HG1y 1.0 . 3.68 3486 2774 A 105 GLU HA A 109 GLU HBy 1.0 . 4.54 3487 2774 A 105 GLU HA A 109 GLU HBx 1.0 . 4.54 3488 2775 A 106 GLY H A 109 GLU HBy 1.0 . 4.79 3489 2775 A 106 GLY H A 109 GLU HBx 1.0 . 4.79 3490 2776 A 106 GLY HAy A 107 ILE HG1x 1.0 . 4.90 3491 2776 A 106 GLY HAx A 107 ILE HG1x 1.0 . 4.90 3492 2776 A 107 ILE HG1y A 106 GLY HAx 1.0 . 4.90 3493 2776 A 106 GLY HAy A 107 ILE HG1y 1.0 . 4.90 3494 2777 A 106 GLY HAx A 109 GLU HBy 1.0 . 4.44 3495 2777 A 106 GLY HAy A 109 GLU HBy 1.0 . 4.44 3496 2777 A 109 GLU HBx A 106 GLY HAx 1.0 . 4.44 3497 2777 A 106 GLY HAy A 109 GLU HBx 1.0 . 4.44 3498 2778 A 107 ILE H A 107 ILE HG1x 1.0 . 3.23 3499 2778 A 107 ILE H A 107 ILE HG1y 1.0 . 3.23 3500 2779 A 107 ILE HA A 107 ILE HG1x 1.0 . 3.49 3501 2779 A 107 ILE HA A 107 ILE HG1y 1.0 . 3.49 3502 2780 A 108 ILE H A 107 ILE HG1x 1.0 . 5.03 3503 2780 A 108 ILE H A 107 ILE HG1y 1.0 . 5.03 3504 2781 A 108 ILE H A 108 ILE HG1x 1.0 . 3.55 3505 2781 A 108 ILE H A 108 ILE HG1y 1.0 . 3.55 3506 2782 A 108 ILE HA A 108 ILE HG1x 1.0 . 3.59 3507 2782 A 108 ILE HA A 108 ILE HG1y 1.0 . 3.59 3508 2783 A 108 ILE HG2% A 109 GLU HBy 1.0 . 5.81 3509 2783 A 108 ILE HG2% A 109 GLU HBx 1.0 . 5.81 3510 2784 A 109 GLU H A 108 ILE HG1x 1.0 . 5.25 3511 2784 A 109 GLU H A 108 ILE HG1y 1.0 . 5.25 3512 2785 A 109 GLU H A 109 GLU HBy 1.0 . 3.38 3513 2785 A 109 GLU H A 109 GLU HBx 1.0 . 3.38 3514 2786 A 109 GLU HBy A 110 SER HBx 1.0 . 5.81 3515 2786 A 109 GLU HBx A 110 SER HBx 1.0 . 5.81 3516 2786 A 110 SER HBy A 109 GLU HBy 1.0 . 5.81 3517 2786 A 110 SER HBy A 109 GLU HBx 1.0 . 5.81 3518 2787 A 111 ARG H A 109 GLU HBy 1.0 . 5.81 3519 2787 A 111 ARG H A 109 GLU HBx 1.0 . 5.81 3520 2788 A 110 SER HBx A 111 ARG HBy 1.0 . 5.34 3521 2788 A 110 SER HBy A 111 ARG HBy 1.0 . 5.34 3522 2788 A 111 ARG HBx A 110 SER HBx 1.0 . 5.34 3523 2788 A 110 SER HBy A 111 ARG HBx 1.0 . 5.34 3524 2789 A 111 ARG H A 111 ARG HBy 1.0 . 3.68 3525 2789 A 111 ARG H A 111 ARG HBx 1.0 . 3.68 3526 2790 A 111 ARG HBy A 111 ARG HD2 1.0 . 3.25 3527 2790 A 111 ARG HBx A 111 ARG HD2 1.0 . 3.25 3528 2790 A 111 ARG HD3 A 111 ARG HBy 1.0 . 3.25 3529 2790 A 111 ARG HD3 A 111 ARG HBx 1.0 . 3.25 3530 2791 A 112 THR H A 111 ARG HBy 1.0 . 4.43 3531 2791 A 112 THR H A 111 ARG HBx 1.0 . 4.43 3532 2792 A 117 ASP H A 117 ASP HBy 1.0 . 3.55 3533 2792 A 117 ASP H A 117 ASP HBx 1.0 . 3.55 3534 2793 A 118 ASP H A 117 ASP HBy 1.0 . 3.77 3535 2793 A 118 ASP H A 117 ASP HBx 1.0 . 3.77 3536 2794 A 119 TYR H A 118 ASP HBx 1.0 . 3.79 3537 2794 A 119 TYR H A 118 ASP HBy 1.0 . 3.79 3538 2795 A 118 ASP HBy A 121 VAL HGx% 1.0 . 5.34 3539 2795 A 118 ASP HBx A 121 VAL HGx% 1.0 . 5.34 3540 2795 A 121 VAL HGy% A 118 ASP HBx 1.0 . 5.34 3541 2795 A 121 VAL HGy% A 118 ASP HBy 1.0 . 5.34 3542 2796 A 119 TYR HE% A 123 SER HBy 1.0 . 5.81 3543 2796 A 123 SER HBx A 119 TYR HE% 1.0 . 5.81 3544 2797 A 120 ASN HBx A 120 ASN HD2y 1.0 . 3.18 3545 2797 A 120 ASN HBy A 120 ASN HD2y 1.0 . 3.18 3546 2797 A 120 ASN HD2x A 120 ASN HBx 1.0 . 3.18 3547 2797 A 120 ASN HBy A 120 ASN HD2x 1.0 . 3.18 3548 2798 A 121 VAL HGx% A 123 SER HBy 1.0 . 5.34 3549 2798 A 121 VAL HGy% A 123 SER HBy 1.0 . 5.34 3550 2798 A 123 SER HBx A 121 VAL HGx% 1.0 . 5.34 3551 2798 A 123 SER HBx A 121 VAL HGy% 1.0 . 5.34 3552 2799 A 122 VAL HGy% A 123 SER HBy 1.0 . 5.34 3553 2799 A 122 VAL HGx% A 123 SER HBy 1.0 . 5.34 3554 2799 A 123 SER HBx A 122 VAL HGx% 1.0 . 5.34 3555 2799 A 123 SER HBx A 122 VAL HGy% 1.0 . 5.34 3556 2800 A 124 ARG HBy A 124 ARG HDx 1.0 . 3.36 3557 2800 A 124 ARG HBx A 124 ARG HDx 1.0 . 3.36 3558 2800 A 124 ARG HDy A 124 ARG HBy 1.0 . 3.36 3559 2800 A 124 ARG HDy A 124 ARG HBx 1.0 . 3.36 3560 2801 A 125 LEU H A 125 LEU HBx 1.0 . 3.67 3561 2801 A 125 LEU H A 125 LEU HBy 1.0 . 3.67 3562 2802 A 125 LEU HA A 125 LEU HDy% 1.0 . 4.03 3563 2802 A 125 LEU HA A 125 LEU HDx% 1.0 . 4.03 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 hbond _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 5 SER H A 89 GLU O 1.0 . 2.3 2 2 A 89 GLU O A 5 SER N 1.0 . 3.3 3 3 A 10 LEU H A 6 ASP O 1.0 . 2.3 4 4 A 6 ASP O A 10 LEU N 1.0 . 3.3 5 5 A 11 LYS H A 7 ALA O 1.0 . 2.3 6 6 A 7 ALA O A 11 LYS N 1.0 . 3.3 7 7 A 12 SER H A 8 HIS O 1.0 . 2.3 8 8 A 8 HIS O A 12 SER N 1.0 . 3.3 9 9 A 13 ARG H A 9 VAL O 1.0 . 2.3 10 10 A 9 VAL O A 13 ARG N 1.0 . 3.3 11 11 A 14 LEU H A 10 LEU O 1.0 . 2.3 12 12 A 10 LEU O A 14 LEU N 1.0 . 3.3 13 13 A 15 GLU H A 11 LYS O 1.0 . 2.3 14 14 A 11 LYS O A 15 GLU N 1.0 . 3.3 15 15 A 16 TRP H A 12 SER O 1.0 . 2.3 16 16 A 12 SER O A 16 TRP N 1.0 . 3.3 17 17 A 22 THR H A 61 ASP O 1.0 . 2.3 18 18 A 61 ASP O A 22 THR N 1.0 . 3.3 19 19 A 24 LEU H A 63 TYR O 1.0 . 2.3 20 20 A 63 TYR O A 24 LEU N 1.0 . 3.3 21 21 A 25 ASP H A 41 MET O 1.0 . 2.3 22 22 A 41 MET O A 25 ASP N 1.0 . 3.3 23 23 A 26 VAL H A 65 TYR O 1.0 . 2.3 24 24 A 65 TYR O A 26 VAL N 1.0 . 3.3 25 25 A 32 TYR H A 28 ASP O 1.0 . 2.3 26 26 A 28 ASP O A 32 TYR N 1.0 . 3.3 27 27 A 33 ASN H A 29 ARG O 1.0 . 2.3 28 28 A 29 ARG O A 33 ASN N 1.0 . 3.3 29 29 A 34 ASP H A 30 SER O 1.0 . 2.3 30 30 A 30 SER O A 34 ASP N 1.0 . 3.3 31 31 A 35 GLY H A 31 THR O 1.0 . 2.3 32 32 A 31 THR O A 35 GLY N 1.0 . 3.3 33 33 A 36 HIS H A 105 GLU O 1.0 . 2.3 34 34 A 105 GLU O A 36 HIS N 1.0 . 3.3 35 35 A 32 TYR O A 36 HIS HD1 1.0 . 2.3 36 36 A 32 TYR O A 36 HIS ND1 1.0 . 3.3 37 37 A 38 MET H A 103 PRO O 1.0 . 2.3 38 38 A 103 PRO O A 38 MET N 1.0 . 3.3 39 39 A 41 MET H A 23 ILE O 1.0 . 2.3 40 40 A 23 ILE O A 41 MET N 1.0 . 3.3 41 41 A 45 ILE H A 26 VAL O 1.0 . 2.3 42 42 A 26 VAL O A 45 ILE N 1.0 . 3.3 43 43 A 47 ASP H A 44 PRO O 1.0 . 2.3 44 44 A 44 PRO O A 47 ASP N 1.0 . 3.3 45 45 A 51 ARG H A 47 ASP O 1.0 . 2.3 46 46 A 47 ASP O A 51 ARG N 1.0 . 3.3 47 47 A 52 ALA H A 48 LEU O 1.0 . 2.3 48 48 A 48 LEU O A 52 ALA N 1.0 . 3.3 49 49 A 53 SER H A 49 VAL O 1.0 . 2.3 50 50 A 49 VAL O A 53 SER N 1.0 . 3.3 51 51 A 62 ILE H A 86 HIS O 1.0 . 2.3 52 52 A 86 HIS O A 62 ILE N 1.0 . 3.3 53 53 A 63 TYR H A 22 THR O 1.0 . 2.3 54 54 A 22 THR O A 63 TYR N 1.0 . 3.3 55 55 A 64 VAL H A 88 SER O 1.0 . 2.3 56 56 A 88 SER O A 64 VAL N 1.0 . 3.3 57 57 A 65 TYR H A 24 LEU O 1.0 . 2.3 58 58 A 24 LEU O A 65 TYR N 1.0 . 3.3 59 59 A 72 THR H A 68 GLY O 1.0 . 2.3 60 60 A 68 GLY O A 72 THR N 1.0 . 3.3 61 61 A 73 SER H A 69 ASP O 1.0 . 2.3 62 62 A 69 ASP O A 73 SER N 1.0 . 3.3 63 63 A 74 GLN H A 70 GLU O 1.0 . 2.3 64 64 A 70 GLU O A 74 GLN N 1.0 . 3.3 65 65 A 75 ALA H A 71 GLN O 1.0 . 2.3 66 66 A 71 GLN O A 75 ALA N 1.0 . 3.3 67 67 A 76 VAL H A 72 THR O 1.0 . 2.3 68 68 A 72 THR O A 76 VAL N 1.0 . 3.3 69 69 A 77 ASN H A 73 SER O 1.0 . 2.3 70 70 A 73 SER O A 77 ASN N 1.0 . 3.3 71 71 A 78 LEU H A 74 GLN O 1.0 . 2.3 72 72 A 74 GLN O A 78 LEU N 1.0 . 3.3 73 73 A 79 LEU H A 75 ALA O 1.0 . 2.3 74 74 A 75 ALA O A 79 LEU N 1.0 . 3.3 75 75 A 80 ARG H A 76 VAL O 1.0 . 2.3 76 76 A 76 VAL O A 80 ARG N 1.0 . 3.3 77 77 A 81 SER H A 77 ASN O 1.0 . 2.3 78 78 A 77 ASN O A 81 SER N 1.0 . 3.3 79 79 A 82 ALA H A 79 LEU O 1.0 . 2.3 80 80 A 79 LEU O A 82 ALA N 1.0 . 3.3 81 81 A 83 GLY H A 80 ARG O 1.0 . 2.3 82 82 A 80 ARG O A 83 GLY N 1.0 . 3.3 83 83 A 85 GLU H A 58 LYS O 1.0 . 2.3 84 84 A 58 LYS O A 85 GLU N 1.0 . 3.3 85 85 A 86 HIS H A 58 LYS O 1.0 . 2.3 86 86 A 58 LYS O A 86 HIS N 1.0 . 3.3 87 87 A 88 SER H A 62 ILE O 1.0 . 2.3 88 88 A 62 ILE O A 88 SER N 1.0 . 3.3 89 89 A 89 GLU H A 3 PRO O 1.0 . 2.3 90 90 A 3 PRO O A 89 GLU N 1.0 . 3.3 91 91 A 90 LEU H A 64 VAL O 1.0 . 2.3 92 92 A 64 VAL O A 90 LEU N 1.0 . 3.3 93 93 A 91 LYS H A 5 SER O 1.0 . 2.3 94 94 A 5 SER O A 91 LYS N 1.0 . 3.3 95 95 A 97 TRP H A 93 GLY O 1.0 . 2.3 96 96 A 93 GLY O A 97 TRP N 1.0 . 3.3 97 97 A 98 LYS H A 94 LEU O 1.0 . 2.3 98 98 A 94 LEU O A 98 LYS N 1.0 . 3.3 99 99 A 99 ALA H A 95 ALA O 1.0 . 2.3 100 100 A 95 ALA O A 99 ALA N 1.0 . 3.3 101 101 A 100 ILE H A 96 ALA O 1.0 . 2.3 102 102 A 96 ALA O A 100 ILE N 1.0 . 3.3 103 103 A 101 GLY H A 98 LYS O 1.0 . 2.3 104 104 A 98 LYS O A 101 GLY N 1.0 . 3.3 105 105 A 102 GLY H A 97 TRP O 1.0 . 2.3 106 106 A 97 TRP O A 102 GLY N 1.0 . 3.3 107 107 A 105 GLU H A 36 HIS O 1.0 . 2.3 108 108 A 36 HIS O A 105 GLU N 1.0 . 3.3 109 109 A 107 ILE H A 33 ASN O 1.0 . 2.3 110 110 A 33 ASN O A 107 ILE N 1.0 . 3.3 111 111 A 5 SER H A 89 GLU O 1.0 . 1.5 112 112 A 89 GLU O A 5 SER N 1.0 . 2.4 113 113 A 10 LEU H A 6 ASP O 1.0 . 1.5 114 114 A 6 ASP O A 10 LEU N 1.0 . 2.4 115 115 A 11 LYS H A 7 ALA O 1.0 . 1.5 116 116 A 7 ALA O A 11 LYS N 1.0 . 2.4 117 117 A 12 SER H A 8 HIS O 1.0 . 1.5 118 118 A 8 HIS O A 12 SER N 1.0 . 2.4 119 119 A 13 ARG H A 9 VAL O 1.0 . 1.5 120 120 A 9 VAL O A 13 ARG N 1.0 . 2.4 121 121 A 14 LEU H A 10 LEU O 1.0 . 1.5 122 122 A 10 LEU O A 14 LEU N 1.0 . 2.4 123 123 A 15 GLU H A 11 LYS O 1.0 . 1.5 124 124 A 11 LYS O A 15 GLU N 1.0 . 2.4 125 125 A 16 TRP H A 12 SER O 1.0 . 1.5 126 126 A 12 SER O A 16 TRP N 1.0 . 2.4 127 127 A 22 THR H A 61 ASP O 1.0 . 1.5 128 128 A 61 ASP O A 22 THR N 1.0 . 2.4 129 129 A 24 LEU H A 63 TYR O 1.0 . 1.5 130 130 A 63 TYR O A 24 LEU N 1.0 . 2.4 131 131 A 25 ASP H A 41 MET O 1.0 . 1.5 132 132 A 41 MET O A 25 ASP N 1.0 . 2.4 133 133 A 26 VAL H A 65 TYR O 1.0 . 1.5 134 134 A 65 TYR O A 26 VAL N 1.0 . 2.4 135 135 A 32 TYR H A 28 ASP O 1.0 . 1.5 136 136 A 28 ASP O A 32 TYR N 1.0 . 2.4 137 137 A 33 ASN H A 29 ARG O 1.0 . 1.5 138 138 A 29 ARG O A 33 ASN N 1.0 . 2.4 139 139 A 34 ASP H A 30 SER O 1.0 . 1.5 140 140 A 30 SER O A 34 ASP N 1.0 . 2.4 141 141 A 35 GLY H A 31 THR O 1.0 . 1.5 142 142 A 31 THR O A 35 GLY N 1.0 . 2.4 143 143 A 36 HIS H A 105 GLU O 1.0 . 1.5 144 144 A 105 GLU O A 36 HIS N 1.0 . 2.4 145 145 A 32 TYR O A 36 HIS HD1 1.0 . 1.5 146 146 A 32 TYR O A 36 HIS ND1 1.0 . 2.4 147 147 A 38 MET H A 103 PRO O 1.0 . 1.5 148 148 A 103 PRO O A 38 MET N 1.0 . 2.4 149 149 A 41 MET H A 23 ILE O 1.0 . 1.5 150 150 A 23 ILE O A 41 MET N 1.0 . 2.4 151 151 A 45 ILE H A 26 VAL O 1.0 . 1.5 152 152 A 26 VAL O A 45 ILE N 1.0 . 2.4 153 153 A 47 ASP H A 44 PRO O 1.0 . 1.5 154 154 A 44 PRO O A 47 ASP N 1.0 . 2.4 155 155 A 51 ARG H A 47 ASP O 1.0 . 1.5 156 156 A 47 ASP O A 51 ARG N 1.0 . 2.4 157 157 A 52 ALA H A 48 LEU O 1.0 . 1.5 158 158 A 48 LEU O A 52 ALA N 1.0 . 2.4 159 159 A 53 SER H A 49 VAL O 1.0 . 1.5 160 160 A 49 VAL O A 53 SER N 1.0 . 2.4 161 161 A 62 ILE H A 86 HIS O 1.0 . 1.5 162 162 A 86 HIS O A 62 ILE N 1.0 . 2.4 163 163 A 63 TYR H A 22 THR O 1.0 . 1.5 164 164 A 22 THR O A 63 TYR N 1.0 . 2.4 165 165 A 64 VAL H A 88 SER O 1.0 . 1.5 166 166 A 88 SER O A 64 VAL N 1.0 . 2.4 167 167 A 65 TYR H A 24 LEU O 1.0 . 1.5 168 168 A 24 LEU O A 65 TYR N 1.0 . 2.4 169 169 A 72 THR H A 68 GLY O 1.0 . 1.5 170 170 A 68 GLY O A 72 THR N 1.0 . 2.4 171 171 A 73 SER H A 69 ASP O 1.0 . 1.5 172 172 A 69 ASP O A 73 SER N 1.0 . 2.4 173 173 A 74 GLN H A 70 GLU O 1.0 . 1.5 174 174 A 70 GLU O A 74 GLN N 1.0 . 2.4 175 175 A 75 ALA H A 71 GLN O 1.0 . 1.5 176 176 A 71 GLN O A 75 ALA N 1.0 . 2.4 177 177 A 76 VAL H A 72 THR O 1.0 . 1.5 178 178 A 72 THR O A 76 VAL N 1.0 . 2.4 179 179 A 77 ASN H A 73 SER O 1.0 . 1.5 180 180 A 73 SER O A 77 ASN N 1.0 . 2.4 181 181 A 78 LEU H A 74 GLN O 1.0 . 1.5 182 182 A 74 GLN O A 78 LEU N 1.0 . 2.4 183 183 A 79 LEU H A 75 ALA O 1.0 . 1.5 184 184 A 75 ALA O A 79 LEU N 1.0 . 2.4 185 185 A 80 ARG H A 76 VAL O 1.0 . 1.5 186 186 A 76 VAL O A 80 ARG N 1.0 . 2.4 187 187 A 81 SER H A 77 ASN O 1.0 . 1.5 188 188 A 77 ASN O A 81 SER N 1.0 . 2.4 189 189 A 82 ALA H A 79 LEU O 1.0 . 1.5 190 190 A 79 LEU O A 82 ALA N 1.0 . 2.4 191 191 A 83 GLY H A 80 ARG O 1.0 . 1.5 192 192 A 80 ARG O A 83 GLY N 1.0 . 2.4 193 193 A 85 GLU H A 58 LYS O 1.0 . 1.5 194 194 A 58 LYS O A 85 GLU N 1.0 . 2.4 195 195 A 86 HIS H A 58 LYS O 1.0 . 1.5 196 196 A 58 LYS O A 86 HIS N 1.0 . 2.4 197 197 A 88 SER H A 62 ILE O 1.0 . 1.5 198 198 A 62 ILE O A 88 SER N 1.0 . 2.4 199 199 A 89 GLU H A 3 PRO O 1.0 . 1.5 200 200 A 3 PRO O A 89 GLU N 1.0 . 2.4 201 201 A 90 LEU H A 64 VAL O 1.0 . 1.5 202 202 A 64 VAL O A 90 LEU N 1.0 . 2.4 203 203 A 91 LYS H A 5 SER O 1.0 . 1.5 204 204 A 5 SER O A 91 LYS N 1.0 . 2.4 205 205 A 97 TRP H A 93 GLY O 1.0 . 1.5 206 206 A 93 GLY O A 97 TRP N 1.0 . 2.4 207 207 A 98 LYS H A 94 LEU O 1.0 . 1.5 208 208 A 94 LEU O A 98 LYS N 1.0 . 2.4 209 209 A 99 ALA H A 95 ALA O 1.0 . 1.5 210 210 A 95 ALA O A 99 ALA N 1.0 . 2.4 211 211 A 100 ILE H A 96 ALA O 1.0 . 1.5 212 212 A 96 ALA O A 100 ILE N 1.0 . 2.4 213 213 A 101 GLY H A 98 LYS O 1.0 . 1.5 214 214 A 98 LYS O A 101 GLY N 1.0 . 2.4 215 215 A 102 GLY H A 97 TRP O 1.0 . 1.5 216 216 A 97 TRP O A 102 GLY N 1.0 . 2.4 217 217 A 105 GLU H A 36 HIS O 1.0 . 1.5 218 218 A 36 HIS O A 105 GLU N 1.0 . 2.4 219 219 A 107 ILE H A 33 ASN O 1.0 . 1.5 220 220 A 33 ASN O A 107 ILE N 1.0 . 2.4 stop_ save_ save_DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_4 _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 6 ASP C A 7 ALA N A 7 ALA CA A 7 ALA C 1.0 -70.3 -48.3 PHI 2 2 A 7 ALA N A 7 ALA CA A 7 ALA C A 8 HIS N 1.0 -50.1 -25.3 PSI 3 3 A 7 ALA C A 8 HIS N A 8 HIS CA A 8 HIS C 1.0 -73.2 -53.2 PHI 4 4 A 8 HIS N A 8 HIS CA A 8 HIS C A 9 VAL N 1.0 -50.1 -27.7 PSI 5 5 A 8 HIS C A 9 VAL N A 9 VAL CA A 9 VAL C 1.0 -75.3 -54.9 PHI 6 6 A 9 VAL N A 9 VAL CA A 9 VAL C A 10 LEU N 1.0 -53.2 -28.5 PSI 7 7 A 9 VAL C A 10 LEU N A 10 LEU CA A 10 LEU C 1.0 -76.4 -54.0 PHI 8 8 A 10 LEU N A 10 LEU CA A 10 LEU C A 11 LYS N 1.0 -50.9 -30.9 PSI 9 9 A 10 LEU C A 11 LYS N A 11 LYS CA A 11 LYS C 1.0 -68.7 -48.7 PHI 10 10 A 11 LYS N A 11 LYS CA A 11 LYS C A 12 SER N 1.0 -60.0 -31.2 PSI 11 11 A 11 LYS C A 12 SER N A 12 SER CA A 12 SER C 1.0 -74.2 -51.8 PHI 12 12 A 12 SER N A 12 SER CA A 12 SER C A 13 ARG N 1.0 -53.5 -30.9 PSI 13 13 A 12 SER C A 13 ARG N A 13 ARG CA A 13 ARG C 1.0 -80.5 -42.8 PHI 14 14 A 13 ARG N A 13 ARG CA A 13 ARG C A 14 LEU N 1.0 -56.7 -27.8 PSI 15 15 A 13 ARG C A 14 LEU N A 14 LEU CA A 14 LEU C 1.0 -77.0 -49.5 PHI 16 16 A 14 LEU N A 14 LEU CA A 14 LEU C A 15 GLU N 1.0 -55.9 -17.0 PSI 17 17 A 14 LEU C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -86.8 -54.3 PHI 18 18 A 15 GLU N A 15 GLU CA A 15 GLU C A 16 TRP N 1.0 -52.1 -15.8 PSI 19 19 A 20 ALA C A 21 PHE N A 21 PHE CA A 21 PHE C 1.0 -154.4 -94.7 PHI 20 20 A 21 PHE N A 21 PHE CA A 21 PHE C A 22 THR N 1.0 128.3 158.1 PSI 21 21 A 21 PHE C A 22 THR N A 22 THR CA A 22 THR C 1.0 -158.4 -86.1 PHI 22 22 A 22 THR N A 22 THR CA A 22 THR C A 23 ILE N 1.0 114.4 147.4 PSI 23 23 A 22 THR C A 23 ILE N A 23 ILE CA A 23 ILE C 1.0 -128.7 -86.5 PHI 24 24 A 23 ILE N A 23 ILE CA A 23 ILE C A 24 LEU N 1.0 120.0 142.2 PSI 25 25 A 23 ILE C A 24 LEU N A 24 LEU CA A 24 LEU C 1.0 -153.7 -97.0 PHI 26 26 A 24 LEU N A 24 LEU CA A 24 LEU C A 25 ASP N 1.0 118.5 170.3 PSI 27 27 A 24 LEU C A 25 ASP N A 25 ASP CA A 25 ASP C 1.0 -148.2 -84.0 PHI 28 28 A 25 ASP N A 25 ASP CA A 25 ASP C A 26 VAL N 1.0 63.4 193.8 PSI 29 29 A 28 ASP C A 29 ARG N A 29 ARG CA A 29 ARG C 1.0 -69.5 -49.5 PHI 30 30 A 29 ARG N A 29 ARG CA A 29 ARG C A 30 SER N 1.0 -56.9 -29.2 PSI 31 31 A 29 ARG C A 30 SER N A 30 SER CA A 30 SER C 1.0 -81.0 -52.4 PHI 32 32 A 30 SER N A 30 SER CA A 30 SER C A 31 THR N 1.0 -56.6 -4.5 PSI 33 33 A 30 SER C A 31 THR N A 31 THR CA A 31 THR C 1.0 -86.6 -51.8 PHI 34 34 A 31 THR N A 31 THR CA A 31 THR C A 32 TYR N 1.0 -55.5 -23.6 PSI 35 35 A 31 THR C A 32 TYR N A 32 TYR CA A 32 TYR C 1.0 -77.1 -55.5 PHI 36 36 A 32 TYR N A 32 TYR CA A 32 TYR C A 33 ASN N 1.0 -54.1 -29.2 PSI 37 37 A 32 TYR C A 33 ASN N A 33 ASN CA A 33 ASN C 1.0 -79.5 -59.5 PHI 38 38 A 33 ASN N A 33 ASN CA A 33 ASN C A 34 ASP N 1.0 -57.3 -16.8 PSI 39 39 A 33 ASN C A 34 ASP N A 34 ASP CA A 34 ASP C 1.0 -77.4 -52.8 PHI 40 40 A 34 ASP N A 34 ASP CA A 34 ASP C A 35 GLY N 1.0 -44.5 -13.5 PSI 41 41 A 35 GLY C A 36 HIS N A 36 HIS CA A 36 HIS C 1.0 -158.7 -64.5 PHI 42 42 A 36 HIS N A 36 HIS CA A 36 HIS C A 37 ILE N 1.0 121.5 178.5 PSI 43 43 A 36 HIS C A 37 ILE N A 37 ILE CA A 37 ILE C 1.0 -88.4 -45.6 PHI 44 44 A 37 ILE N A 37 ILE CA A 37 ILE C A 38 MET N 1.0 119.2 142.4 PSI 45 45 A 44 PRO C A 45 ILE N A 45 ILE CA A 45 ILE C 1.0 -72.1 -41.6 PHI 46 46 A 45 ILE N A 45 ILE CA A 45 ILE C A 46 GLU N 1.0 -60.8 -26.2 PSI 47 47 A 45 ILE C A 46 GLU N A 46 GLU CA A 46 GLU C 1.0 -86.6 -50.0 PHI 48 48 A 46 GLU N A 46 GLU CA A 46 GLU C A 47 ASP N 1.0 -50.1 2.2 PSI 49 49 A 46 GLU C A 47 ASP N A 47 ASP CA A 47 ASP C 1.0 -131.8 -66.2 PHI 50 50 A 47 ASP N A 47 ASP CA A 47 ASP C A 48 LEU N 1.0 -28.7 22.5 PSI 51 51 A 47 ASP C A 48 LEU N A 48 LEU CA A 48 LEU C 1.0 -71.8 -40.2 PHI 52 52 A 48 LEU N A 48 LEU CA A 48 LEU C A 49 VAL N 1.0 -72.0 -22.9 PSI 53 53 A 48 LEU C A 49 VAL N A 49 VAL CA A 49 VAL C 1.0 -74.7 -44.7 PHI 54 54 A 49 VAL N A 49 VAL CA A 49 VAL C A 50 ASP N 1.0 -52.4 -30.2 PSI 55 55 A 49 VAL C A 50 ASP N A 50 ASP CA A 50 ASP C 1.0 -74.0 -51.2 PHI 56 56 A 50 ASP N A 50 ASP CA A 50 ASP C A 51 ARG N 1.0 -53.3 -33.3 PSI 57 57 A 50 ASP C A 51 ARG N A 51 ARG CA A 51 ARG C 1.0 -76.8 -50.9 PHI 58 58 A 51 ARG N A 51 ARG CA A 51 ARG C A 52 ALA N 1.0 -54.8 -30.2 PSI 59 59 A 51 ARG C A 52 ALA N A 52 ALA CA A 52 ALA C 1.0 -73.2 -53.2 PHI 60 60 A 52 ALA N A 52 ALA CA A 52 ALA C A 53 SER N 1.0 -53.6 -31.2 PSI 61 61 A 52 ALA C A 53 SER N A 53 SER CA A 53 SER C 1.0 -77.0 -56.0 PHI 62 62 A 53 SER N A 53 SER CA A 53 SER C A 54 SER N 1.0 -62.3 -12.1 PSI 63 63 A 53 SER C A 54 SER N A 54 SER CA A 54 SER C 1.0 -94.6 -55.9 PHI 64 64 A 54 SER N A 54 SER CA A 54 SER C A 55 SER N 1.0 -62.6 1.0 PSI 65 65 A 59 SER C A 60 ARG N A 60 ARG CA A 60 ARG C 1.0 -153.4 -55.6 PHI 66 66 A 60 ARG N A 60 ARG CA A 60 ARG C A 61 ASP N 1.0 117.5 153.1 PSI 67 67 A 60 ARG C A 61 ASP N A 61 ASP CA A 61 ASP C 1.0 -157.9 -37.8 PHI 68 68 A 61 ASP N A 61 ASP CA A 61 ASP C A 62 ILE N 1.0 96.1 146.1 PSI 69 69 A 61 ASP C A 62 ILE N A 62 ILE CA A 62 ILE C 1.0 -149.7 -101.5 PHI 70 70 A 62 ILE N A 62 ILE CA A 62 ILE C A 63 TYR N 1.0 115.5 146.8 PSI 71 71 A 62 ILE C A 63 TYR N A 63 TYR CA A 63 TYR C 1.0 -145.3 -95.8 PHI 72 72 A 63 TYR N A 63 TYR CA A 63 TYR C A 64 VAL N 1.0 107.5 166.2 PSI 73 73 A 63 TYR C A 64 VAL N A 64 VAL CA A 64 VAL C 1.0 -151.9 -105.6 PHI 74 74 A 64 VAL N A 64 VAL CA A 64 VAL C A 65 TYR N 1.0 126.2 172.6 PSI 75 75 A 68 GLY C A 69 ASP N A 69 ASP CA A 69 ASP C 1.0 -67.3 -47.3 PHI 76 76 A 69 ASP N A 69 ASP CA A 69 ASP C A 70 GLU N 1.0 -50.4 -21.4 PSI 77 77 A 69 ASP C A 70 GLU N A 70 GLU CA A 70 GLU C 1.0 -81.1 -57.2 PHI 78 78 A 70 GLU N A 70 GLU CA A 70 GLU C A 71 GLN N 1.0 -51.8 -25.7 PSI 79 79 A 70 GLU C A 71 GLN N A 71 GLN CA A 71 GLN C 1.0 -76.5 -56.5 PHI 80 80 A 71 GLN N A 71 GLN CA A 71 GLN C A 72 THR N 1.0 -53.1 -27.1 PSI 81 81 A 71 GLN C A 72 THR N A 72 THR CA A 72 THR C 1.0 -77.9 -53.7 PHI 82 82 A 72 THR N A 72 THR CA A 72 THR C A 73 SER N 1.0 -54.0 -28.2 PSI 83 83 A 72 THR C A 73 SER N A 73 SER CA A 73 SER C 1.0 -72.0 -51.1 PHI 84 84 A 73 SER N A 73 SER CA A 73 SER C A 74 GLN N 1.0 -54.8 -29.8 PSI 85 85 A 73 SER C A 74 GLN N A 74 GLN CA A 74 GLN C 1.0 -75.5 -54.7 PHI 86 86 A 74 GLN N A 74 GLN CA A 74 GLN C A 75 ALA N 1.0 -53.6 -33.6 PSI 87 87 A 74 GLN C A 75 ALA N A 75 ALA CA A 75 ALA C 1.0 -73.5 -53.2 PHI 88 88 A 75 ALA N A 75 ALA CA A 75 ALA C A 76 VAL N 1.0 -62.6 -24.9 PSI 89 89 A 75 ALA C A 76 VAL N A 76 VAL CA A 76 VAL C 1.0 -73.2 -53.2 PHI 90 90 A 76 VAL N A 76 VAL CA A 76 VAL C A 77 ASN N 1.0 -52.7 -32.7 PSI 91 91 A 76 VAL C A 77 ASN N A 77 ASN CA A 77 ASN C 1.0 -71.5 -51.5 PHI 92 92 A 77 ASN N A 77 ASN CA A 77 ASN C A 78 LEU N 1.0 -59.0 -20.4 PSI 93 93 A 77 ASN C A 78 LEU N A 78 LEU CA A 78 LEU C 1.0 -75.4 -53.0 PHI 94 94 A 78 LEU N A 78 LEU CA A 78 LEU C A 79 LEU N 1.0 -53.9 -28.0 PSI 95 95 A 78 LEU C A 79 LEU N A 79 LEU CA A 79 LEU C 1.0 -75.3 -54.0 PHI 96 96 A 79 LEU N A 79 LEU CA A 79 LEU C A 80 ARG N 1.0 -52.5 -26.5 PSI 97 97 A 79 LEU C A 80 ARG N A 80 ARG CA A 80 ARG C 1.0 -82.4 -47.3 PHI 98 98 A 80 ARG N A 80 ARG CA A 80 ARG C A 81 SER N 1.0 -60.6 -10.5 PSI 99 99 A 80 ARG C A 81 SER N A 81 SER CA A 81 SER C 1.0 -76.0 -54.1 PHI 100 100 A 81 SER N A 81 SER CA A 81 SER C A 82 ALA N 1.0 -41.2 -7.6 PSI 101 101 A 81 SER C A 82 ALA N A 82 ALA CA A 82 ALA C 1.0 -106.8 -70.9 PHI 102 102 A 82 ALA N A 82 ALA CA A 82 ALA C A 83 GLY N 1.0 -21.5 23.4 PSI 103 103 A 85 GLU C A 86 HIS N A 86 HIS CA A 86 HIS C 1.0 -152.9 -78.5 PHI 104 104 A 86 HIS N A 86 HIS CA A 86 HIS C A 87 VAL N 1.0 70.4 184.7 PSI 105 105 A 86 HIS C A 87 VAL N A 87 VAL CA A 87 VAL C 1.0 -141.9 -95.7 PHI 106 106 A 87 VAL N A 87 VAL CA A 87 VAL C A 88 SER N 1.0 119.4 146.1 PSI 107 107 A 87 VAL C A 88 SER N A 88 SER CA A 88 SER C 1.0 -137.9 -99.6 PHI 108 108 A 88 SER N A 88 SER CA A 88 SER C A 89 GLU N 1.0 104.9 172.2 PSI 109 109 A 88 SER C A 89 GLU N A 89 GLU CA A 89 GLU C 1.0 -145.6 -63.8 PHI 110 110 A 89 GLU N A 89 GLU CA A 89 GLU C A 90 LEU N 1.0 92.0 167.1 PSI 111 111 A 93 GLY C A 94 LEU N A 94 LEU CA A 94 LEU C 1.0 -69.6 -49.6 PHI 112 112 A 94 LEU N A 94 LEU CA A 94 LEU C A 95 ALA N 1.0 -53.2 -29.8 PSI 113 113 A 94 LEU C A 95 ALA N A 95 ALA CA A 95 ALA C 1.0 -73.0 -53.0 PHI 114 114 A 95 ALA N A 95 ALA CA A 95 ALA C A 96 ALA N 1.0 -50.1 -30.1 PSI 115 115 A 95 ALA C A 96 ALA N A 96 ALA CA A 96 ALA C 1.0 -73.5 -46.5 PHI 116 116 A 96 ALA N A 96 ALA CA A 96 ALA C A 97 TRP N 1.0 -53.8 -30.5 PSI 117 117 A 96 ALA C A 97 TRP N A 97 TRP CA A 97 TRP C 1.0 -91.1 -39.6 PHI 118 118 A 97 TRP N A 97 TRP CA A 97 TRP C A 98 LYS N 1.0 -53.1 -31.9 PSI 119 119 A 97 TRP C A 98 LYS N A 98 LYS CA A 98 LYS C 1.0 -77.3 -49.5 PHI 120 120 A 98 LYS N A 98 LYS CA A 98 LYS C A 99 ALA N 1.0 -51.8 -29.3 PSI 121 121 A 98 LYS C A 99 ALA N A 99 ALA CA A 99 ALA C 1.0 -77.3 -48.6 PHI 122 122 A 99 ALA N A 99 ALA CA A 99 ALA C A 100 ILE N 1.0 -48.1 -12.9 PSI 123 123 A 99 ALA C A 100 ILE N A 100 ILE CA A 100 ILE C 1.0 -133.1 -74.6 PHI 124 124 A 100 ILE N A 100 ILE CA A 100 ILE C A 101 GLY N 1.0 -21.5 28.9 PSI 125 125 A 103 PRO C A 104 THR N A 104 THR CA A 104 THR C 1.0 -143.6 -110.5 PHI 126 126 A 104 THR N A 104 THR CA A 104 THR C A 105 GLU N 1.0 147.9 167.9 PSI 127 127 A 104 THR C A 105 GLU N A 105 GLU CA A 105 GLU C 1.0 -168.4 -114.2 PHI 128 128 A 105 GLU N A 105 GLU CA A 105 GLU C A 106 GLY N 1.0 133.7 173.4 PSI stop_ save_ save_DYANA/DIANA_dipolar_coupling_6 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode DYANA/DIANA_dipolar_coupling_6 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 4 GLN H A 4 GLN N 1.0 . . . 2 2 A 5 SER H A 5 SER N 1.0 . . . 3 3 A 6 ASP H A 6 ASP N 1.0 . . . 4 4 A 8 HIS H A 8 HIS N 1.0 . . . 5 5 A 9 VAL H A 9 VAL N 1.0 . . . 6 6 A 11 LYS H A 11 LYS N 1.0 . . . 7 7 A 12 SER H A 12 SER N 1.0 . . . 8 8 A 13 ARG H A 13 ARG N 1.0 . . . 9 9 A 15 GLU H A 15 GLU N 1.0 . . . 10 10 A 22 THR H A 22 THR N 1.0 . . . 11 11 A 23 ILE H A 23 ILE N 1.0 . . . 12 12 A 24 LEU H A 24 LEU N 1.0 . . . 13 13 A 25 ASP H A 25 ASP N 1.0 . . . 14 14 A 30 SER H A 30 SER N 1.0 . . . 15 15 A 31 THR H A 31 THR N 1.0 . . . 16 16 A 33 ASN H A 33 ASN N 1.0 . . . 17 17 A 34 ASP H A 34 ASP N 1.0 . . . 18 18 A 49 VAL H A 49 VAL N 1.0 . . . 19 19 A 53 SER H A 53 SER N 1.0 . . . 20 20 A 54 SER H A 54 SER N 1.0 . . . 21 21 A 63 TYR H A 63 TYR N 1.0 . . . 22 22 A 71 GLN H A 71 GLN N 1.0 . . . 23 23 A 72 THR H A 72 THR N 1.0 . . . 24 24 A 73 SER H A 73 SER N 1.0 . . . 25 25 A 74 GLN H A 74 GLN N 1.0 . . . 26 26 A 77 ASN H A 77 ASN N 1.0 . . . 27 27 A 78 LEU H A 78 LEU N 1.0 . . . 28 28 A 79 LEU H A 79 LEU N 1.0 . . . 29 29 A 81 SER H A 81 SER N 1.0 . . . 30 30 A 88 SER H A 88 SER N 1.0 . . . 31 31 A 95 ALA H A 95 ALA N 1.0 . . . 32 32 A 97 TRP H A 97 TRP N 1.0 . . . 33 33 A 98 LYS H A 98 LYS N 1.0 . . . 34 34 A 99 ALA H A 99 ALA N 1.0 . . . 35 35 A 104 THR H A 104 THR N 1.0 . . . 36 36 A 105 GLU H A 105 GLU N 1.0 . . . stop_ save_ save_DYANA/DIANA_dipolar_coupling_7 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode DYANA/DIANA_dipolar_coupling_7 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 5 SER H A 5 SER N 1.0 . . . 2 2 A 6 ASP H A 6 ASP N 1.0 . . . 3 3 A 8 HIS H A 8 HIS N 1.0 . . . 4 4 A 9 VAL H A 9 VAL N 1.0 . . . 5 5 A 12 SER H A 12 SER N 1.0 . . . 6 6 A 22 THR H A 22 THR N 1.0 . . . 7 7 A 23 ILE H A 23 ILE N 1.0 . . . 8 8 A 24 LEU H A 24 LEU N 1.0 . . . 9 9 A 30 SER H A 30 SER N 1.0 . . . 10 10 A 31 THR H A 31 THR N 1.0 . . . 11 11 A 33 ASN H A 33 ASN N 1.0 . . . 12 12 A 34 ASP H A 34 ASP N 1.0 . . . 13 13 A 49 VAL H A 49 VAL N 1.0 . . . 14 14 A 53 SER H A 53 SER N 1.0 . . . 15 15 A 54 SER H A 54 SER N 1.0 . . . 16 16 A 65 TYR H A 65 TYR N 1.0 . . . 17 17 A 74 GLN H A 74 GLN N 1.0 . . . 18 18 A 77 ASN H A 77 ASN N 1.0 . . . 19 19 A 78 LEU H A 78 LEU N 1.0 . . . 20 20 A 81 SER H A 81 SER N 1.0 . . . 21 21 A 88 SER H A 88 SER N 1.0 . . . 22 22 A 91 LYS H A 91 LYS N 1.0 . . . 23 23 A 95 ALA H A 95 ALA N 1.0 . . . 24 24 A 97 TRP H A 97 TRP N 1.0 . . . 25 25 A 98 LYS H A 98 LYS N 1.0 . . . 26 26 A 99 ALA H A 99 ALA N 1.0 . . . 27 27 A 104 THR H A 104 THR N 1.0 . . . stop_ save_ save_n _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode n _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 4878.0 2 15N 2200.0 3 1H 9758.5 stop_ save_ save_ali _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode ali _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 9756.1 2 13C 8575.4 3 1H 9758.5 stop_ save_ save_aro _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode aro _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 4878.0 2 13C 8575.4 3 1H 9758.5 stop_ save_