data_nef_c25956_5frh 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 BMRB 25955 PDB 5frf PDB 5frh stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 14 CYS SG 1 47 CYS SG stop_ 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 -2 GLY start . false 2 A -1 SER middle . . 3 A 0 HIS middle . . 4 A 1 MET middle . . 5 A 2 SER middle . . 6 A 3 ALA middle . . 7 A 4 GLY middle . false 8 A 5 GLU middle . . 9 A 6 PRO middle . false 10 A 7 HIS middle . . 11 A 8 GLU middle . . 12 A 9 THR middle . . 13 A 10 ASP middle . . 14 A 11 CYS middle -HG . 15 A 12 SER middle . . 16 A 13 GLU middle . . 17 A 14 ILE middle . . 18 A 15 LEU middle . . 19 A 16 ASP middle . . 20 A 17 HIS middle . . 21 A 18 LEU middle . . 22 A 19 TYR middle . . 23 A 20 GLU middle . . 24 A 21 PHE middle . . 25 A 22 LEU middle . . 26 A 23 ASP middle . . 27 A 24 LYS middle . . 28 A 25 GLU middle . . 29 A 26 MET middle . . 30 A 27 PRO middle . false 31 A 28 ASP middle . . 32 A 29 SER middle . . 33 A 30 ASP middle . . 34 A 31 ALA middle . . 35 A 32 VAL middle . . 36 A 33 LYS middle . . 37 A 34 PHE middle . . 38 A 35 GLU middle . . 39 A 36 HIS middle . . 40 A 37 HIS middle . . 41 A 38 PHE middle . . 42 A 39 GLU middle . . 43 A 40 GLU middle . . 44 A 41 SER middle . . 45 A 42 SER middle . . 46 A 43 PRO middle . false 47 A 44 CYS middle -HG . 48 A 45 LEU middle . . 49 A 46 GLU middle . . 50 A 47 LYS middle . . 51 A 48 TYR middle . . 52 A 49 GLY middle . false 53 A 50 LEU middle . . 54 A 51 GLU middle . . 55 A 52 GLN middle . . 56 A 53 ALA middle . . 57 A 54 VAL middle . . 58 A 55 LYS middle . . 59 A 56 LYS middle . . 60 A 57 LEU middle . . 61 A 58 VAL middle . . 62 A 59 LYS middle . . 63 A 60 ARG middle . . 64 A 61 ALA middle . . 65 A 62 ALA middle . . 66 A 63 GLY middle . false 67 A 64 GLN middle . . 68 A 65 ASP middle . . 69 A 66 ASP middle . . 70 A 67 VAL middle . . 71 A 68 PRO middle . false 72 A 69 GLY middle . false 73 A 70 ASP middle . . 74 A 71 LEU middle . . 75 A 72 ARG middle . . 76 A 73 ALA middle . . 77 A 74 LYS middle . . 78 A 75 VAL middle . . 79 A 76 MET middle . . 80 A 77 GLY middle . false 81 A 78 ARG middle . . 82 A 79 LEU middle . . 83 A 80 ASP middle . . 84 A 81 LEU middle . . 85 A 82 ILE middle . . 86 A 83 ARG middle . . 87 A 84 SER middle . . 88 A 85 GLY middle . false 89 A 86 GLN middle . . 90 A 87 SER middle . . 91 A 88 VAL middle . . 92 A 89 PRO middle . false 93 A 90 GLU middle . . 94 A 91 HIS middle . . 95 A 92 ASP middle . . 96 A 93 VAL middle . . 97 A 94 ALA middle . . 98 A 95 ALA middle . . 99 A 96 ALA middle . . 100 A 97 PRO middle . false 101 A 98 SER middle . . 102 A 99 SER middle . . 103 A 100 SER middle . . 104 A 101 ALA middle . . 105 A 102 PRO middle . false 106 A 103 GLN middle . . 107 A 104 GLU middle . . 108 A 105 SER end . . stop_ save_ save_assigned_chem_shift_list _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list 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 HBx H 1 1.951 . A 1 MET HBy H 1 2.410 . A 1 MET HE% H 1 1.951 . A 1 MET HG2 H 1 2.410 . A 1 MET HG3 H 1 2.410 . A 1 MET C C 13 176.046 . A 1 MET CA C 13 55.492 . A 1 MET CB C 13 32.793 . A 2 SER H H 1 8.357 0.012 A 2 SER HA H 1 4.424 0.013 A 2 SER HBx H 1 3.789 . A 2 SER HBy H 1 3.842 0.009 A 2 SER C C 13 174.164 . A 2 SER CA C 13 58.347 0.054 A 2 SER CB C 13 63.781 0.041 A 2 SER N N 15 117.373 0.052 A 3 ALA H H 1 8.407 0.008 A 3 ALA HA H 1 4.336 0.008 A 3 ALA HB% H 1 1.397 0.004 A 3 ALA C C 13 177.946 . A 3 ALA CA C 13 52.673 0.011 A 3 ALA CB C 13 19.179 0.008 A 3 ALA N N 15 126.118 0.051 A 4 GLY H H 1 8.303 0.006 A 4 GLY HAx H 1 3.930 0.002 A 4 GLY HAy H 1 3.931 0.002 A 4 GLY C C 13 173.750 . A 4 GLY CA C 13 45.011 0.003 A 4 GLY N N 15 108.066 0.057 A 5 GLU H H 1 8.177 0.008 A 5 GLU HA H 1 4.574 0.003 A 5 GLU HBx H 1 1.836 0.003 A 5 GLU HBy H 1 2.009 0.004 A 5 GLU HG2 H 1 2.253 0.004 A 5 GLU HG3 H 1 2.253 0.004 A 5 GLU C C 13 174.771 . A 5 GLU CA C 13 54.350 0.198 A 5 GLU CB C 13 29.740 0.181 A 5 GLU N N 15 121.600 0.039 A 6 PRO HA H 1 4.384 0.006 A 6 PRO HBx H 1 2.001 0.018 A 6 PRO HBy H 1 2.257 0.012 A 6 PRO HDx H 1 3.669 0.019 A 6 PRO HDy H 1 3.778 0.008 A 6 PRO HG2 H 1 1.873 0.003 A 6 PRO HG3 H 1 1.873 0.003 A 6 PRO C C 13 176.659 . A 6 PRO CA C 13 63.478 0.059 A 6 PRO CB C 13 32.232 0.281 A 6 PRO CD C 13 50.540 0.061 A 6 PRO CG C 13 27.175 0.056 A 7 HIS H H 1 8.403 0.007 A 7 HIS HA H 1 4.650 0.012 A 7 HIS HB2 H 1 3.134 0.003 A 7 HIS HB3 H 1 3.134 0.003 A 7 HIS C C 13 175.063 . A 7 HIS CA C 13 56.043 0.162 A 7 HIS CB C 13 30.491 . A 7 HIS N N 15 119.126 0.035 A 8 GLU H H 1 8.391 0.01 A 8 GLU HA H 1 4.315 0.004 A 8 GLU HBx H 1 1.920 . A 8 GLU HBy H 1 2.026 0.005 A 8 GLU HGx H 1 2.203 0.005 A 8 GLU HGy H 1 2.353 0.004 A 8 GLU C C 13 176.559 . A 8 GLU CA C 13 56.747 0.006 A 8 GLU CB C 13 30.372 0.012 A 8 GLU N N 15 122.757 0.059 A 9 THR H H 1 8.352 0.004 A 9 THR HA H 1 4.290 0.004 A 9 THR HB H 1 4.134 0.004 A 9 THR HG1 H 1 4.767 0.016 A 9 THR HG2% H 1 1.202 0.003 A 9 THR C C 13 174.130 . A 9 THR CA C 13 62.344 0.224 A 9 THR CB C 13 69.722 0.256 A 9 THR CG2 C 13 22.399 . A 9 THR N N 15 116.633 0.045 A 10 ASP H H 1 8.593 0.005 A 10 ASP HA H 1 4.696 0.006 A 10 ASP HBx H 1 2.767 0.008 A 10 ASP HBy H 1 2.862 0.006 A 10 ASP C C 13 177.399 . A 10 ASP CA C 13 54.346 0.013 A 10 ASP CB C 13 41.299 0.045 A 10 ASP N N 15 124.189 0.052 A 11 CYS HA H 1 4.892 0.007 A 11 CYS HBx H 1 3.179 0.006 A 11 CYS HBy H 1 3.204 0.013 A 11 CYS CA C 13 55.590 0.016 A 11 CYS CB C 13 37.462 0.068 A 12 SER H H 1 8.514 0.005 A 12 SER HA H 1 4.337 0.03 A 12 SER HB2 H 1 3.950 . A 12 SER HB3 H 1 3.950 . A 12 SER C C 13 175.923 . A 12 SER CA C 13 62.674 0.14 A 12 SER CB C 13 63.381 . A 12 SER N N 15 117.534 0.029 A 13 GLU H H 1 7.951 0.017 A 13 GLU HA H 1 4.075 0.005 A 13 GLU HB2 H 1 2.015 0.004 A 13 GLU HB3 H 1 2.027 . A 13 GLU HG2 H 1 2.268 0.006 A 13 GLU HG3 H 1 2.268 0.004 A 13 GLU C C 13 178.722 . A 13 GLU CA C 13 59.481 0.006 A 13 GLU CB C 13 29.455 0.018 A 13 GLU N N 15 121.618 0.056 A 14 ILE H H 1 7.759 0.013 A 14 ILE HA H 1 3.861 0.009 A 14 ILE HB H 1 2.030 0.006 A 14 ILE HD1% H 1 0.868 0.005 A 14 ILE HG1x H 1 1.267 0.002 A 14 ILE HG1y H 1 1.632 0.004 A 14 ILE HG2% H 1 0.986 0.011 A 14 ILE C C 13 178.332 . A 14 ILE CA C 13 63.936 0.003 A 14 ILE CB C 13 37.595 . A 14 ILE N N 15 119.671 0.035 A 15 LEU H H 1 8.176 0.015 A 15 LEU HA H 1 4.053 0.008 A 15 LEU HB2 H 1 1.879 0.005 A 15 LEU HB3 H 1 1.879 0.005 A 15 LEU HD1% H 1 0.622 0.005 A 15 LEU HD2% H 1 0.622 0.005 A 15 LEU HG H 1 1.291 0.005 A 15 LEU C C 13 179.294 . A 15 LEU CA C 13 58.024 . A 15 LEU CB C 13 40.286 . A 15 LEU N N 15 119.303 0.082 A 16 ASP H H 1 8.116 0.014 A 16 ASP HA H 1 4.463 0.005 A 16 ASP HBx H 1 2.680 0.006 A 16 ASP HBy H 1 2.837 0.005 A 16 ASP C C 13 178.974 . A 16 ASP CA C 13 57.690 . A 16 ASP CB C 13 40.290 . A 16 ASP N N 15 121.167 0.111 A 17 HIS H H 1 8.218 0.01 A 17 HIS HA H 1 4.643 0.004 A 17 HIS HBx H 1 3.256 0.004 A 17 HIS HBy H 1 3.446 0.004 A 17 HIS HD2 H 1 7.123 0.001 A 17 HIS HE1 H 1 8.226 0.002 A 17 HIS C C 13 178.292 . A 17 HIS CA C 13 58.109 0.001 A 17 HIS CB C 13 29.380 . A 17 HIS N N 15 119.098 0.054 A 18 LEU H H 1 8.495 0.016 A 18 LEU HA H 1 4.057 0.005 A 18 LEU HBx H 1 1.615 0.003 A 18 LEU HBy H 1 1.618 0.001 A 18 LEU HDx% H 1 0.726 0.008 A 18 LEU HDy% H 1 0.821 0.028 A 18 LEU HG H 1 1.540 0.012 A 18 LEU C C 13 177.281 . A 18 LEU CA C 13 57.986 0.027 A 18 LEU CB C 13 41.307 . A 18 LEU N N 15 121.136 0.043 A 19 TYR H H 1 8.501 0.006 A 19 TYR HA H 1 3.627 0.006 A 19 TYR HBx H 1 3.007 0.007 A 19 TYR HBy H 1 3.323 0.004 A 19 TYR HD1 H 1 6.957 0.004 A 19 TYR HD2 H 1 6.957 0.004 A 19 TYR HE1 H 1 6.788 0.009 A 19 TYR HE2 H 1 6.788 0.009 A 19 TYR C C 13 177.020 . A 19 TYR CA C 13 63.204 . A 19 TYR CB C 13 38.822 0.097 A 19 TYR N N 15 119.994 0.058 A 20 GLU H H 1 8.070 0.008 A 20 GLU HA H 1 4.076 0.005 A 20 GLU HBx H 1 2.176 0.005 A 20 GLU HBy H 1 2.252 0.006 A 20 GLU HGx H 1 2.403 0.005 A 20 GLU HGy H 1 2.502 0.004 A 20 GLU C C 13 178.233 . A 20 GLU CA C 13 59.387 0.014 A 20 GLU CB C 13 29.705 0.031 A 20 GLU N N 15 117.126 0.047 A 21 PHE H H 1 8.008 0.01 A 21 PHE HA H 1 4.226 0.006 A 21 PHE HBx H 1 3.040 0.005 A 21 PHE HBy H 1 3.120 0.027 A 21 PHE HD1 H 1 6.964 0.007 A 21 PHE HD2 H 1 6.964 0.007 A 21 PHE HE1 H 1 7.133 0.007 A 21 PHE HE2 H 1 7.133 0.007 A 21 PHE HZ H 1 7.043 0.024 A 21 PHE C C 13 177.317 . A 21 PHE CA C 13 60.585 0.104 A 21 PHE CB C 13 39.356 . A 21 PHE N N 15 119.263 0.058 A 22 LEU H H 1 8.107 0.01 A 22 LEU HA H 1 3.766 0.009 A 22 LEU HB2 H 1 1.977 0.001 A 22 LEU HB3 H 1 1.977 0.001 A 22 LEU HD1% H 1 0.717 0.008 A 22 LEU HD2% H 1 0.758 0.007 A 22 LEU HG H 1 1.728 0.01 A 22 LEU C C 13 179.297 . A 22 LEU CA C 13 56.712 0.081 A 22 LEU CB C 13 41.676 . A 22 LEU N N 15 117.129 0.081 A 23 ASP H H 1 8.659 0.007 A 23 ASP HA H 1 4.165 0.008 A 23 ASP HBx H 1 2.401 0.005 A 23 ASP HBy H 1 2.548 0.003 A 23 ASP C C 13 176.850 . A 23 ASP CA C 13 56.582 . A 23 ASP CB C 13 42.592 0.035 A 23 ASP N N 15 121.144 0.158 A 24 LYS H H 1 7.529 0.005 A 24 LYS HA H 1 4.232 0.006 A 24 LYS HBx H 1 1.708 0.003 A 24 LYS HBy H 1 1.890 0.002 A 24 LYS HD2 H 1 1.560 0.005 A 24 LYS HD3 H 1 1.560 0.005 A 24 LYS HE2 H 1 2.995 0.005 A 24 LYS HE3 H 1 2.995 0.005 A 24 LYS HGx H 1 1.438 . A 24 LYS HGy H 1 1.445 0.004 A 24 LYS C C 13 175.840 . A 24 LYS CA C 13 55.941 0.08 A 24 LYS CB C 13 32.946 0.034 A 24 LYS N N 15 114.785 0.053 A 25 GLU H H 1 7.873 0.008 A 25 GLU HA H 1 3.852 0.005 A 25 GLU HB2 H 1 1.958 0.003 A 25 GLU HB3 H 1 1.958 0.003 A 25 GLU HG2 H 1 2.100 0.001 A 25 GLU HG3 H 1 2.100 0.001 A 25 GLU C C 13 175.811 . A 25 GLU CA C 13 57.303 0.001 A 25 GLU CB C 13 28.262 . A 25 GLU N N 15 117.338 0.068 A 26 MET H H 1 8.083 0.009 A 26 MET HA H 1 4.226 0.001 A 26 MET N N 15 117.311 0.088 A 27 PRO HA H 1 4.392 0.013 A 27 PRO HBx H 1 2.014 0.008 A 27 PRO HBy H 1 2.283 0.006 A 27 PRO HDx H 1 3.622 0.017 A 27 PRO HDy H 1 3.793 0.002 A 27 PRO HGx H 1 1.896 0.002 A 27 PRO HGy H 1 2.014 0.008 A 27 PRO CA C 13 55.860 . A 27 PRO CB C 13 29.501 . A 28 ASP H H 1 8.448 0.024 A 28 ASP HA H 1 4.533 0.005 A 28 ASP HBx H 1 2.703 0.003 A 28 ASP HBy H 1 2.732 0.02 A 28 ASP C C 13 176.648 . A 28 ASP CA C 13 56.011 . A 28 ASP CB C 13 40.774 . A 28 ASP N N 15 120.684 0.063 A 29 SER H H 1 8.306 0.014 A 29 SER HA H 1 4.315 0.003 A 29 SER HBx H 1 3.908 0.037 A 29 SER HBy H 1 3.957 0.034 A 29 SER HG H 1 4.783 . A 29 SER C C 13 175.225 . A 29 SER CA C 13 59.849 0.024 A 29 SER CB C 13 63.333 0.011 A 29 SER N N 15 113.889 0.058 A 30 ASP H H 1 7.990 0.011 A 30 ASP HA H 1 4.711 . A 30 ASP HBx H 1 2.744 0.009 A 30 ASP HBy H 1 2.851 0.012 A 30 ASP C C 13 176.673 . A 30 ASP CA C 13 54.898 . A 30 ASP CB C 13 41.804 . A 30 ASP N N 15 121.365 0.052 A 31 ALA H H 1 8.174 0.013 A 31 ALA HA H 1 4.164 0.005 A 31 ALA HB% H 1 1.569 0.008 A 31 ALA C C 13 178.982 . A 31 ALA CA C 13 54.897 0.147 A 31 ALA CB C 13 18.836 0.005 A 31 ALA N N 15 124.060 0.035 A 32 VAL H H 1 7.904 0.003 A 32 VAL HA H 1 3.923 0.004 A 32 VAL HB H 1 2.104 0.004 A 32 VAL HGx% H 1 0.900 0.005 A 32 VAL HGy% H 1 1.006 0.003 A 32 VAL C C 13 177.324 . A 32 VAL CA C 13 64.138 0.24 A 32 VAL CB C 13 32.015 0.217 A 32 VAL N N 15 117.203 0.057 A 33 LYS H H 1 7.812 0.005 A 33 LYS HA H 1 4.131 0.003 A 33 LYS HBx H 1 1.744 0.007 A 33 LYS HBy H 1 1.745 0.007 A 33 LYS HDx H 1 1.625 0.003 A 33 LYS HDy H 1 1.628 0.006 A 33 LYS HEx H 1 2.913 0.008 A 33 LYS HEy H 1 2.914 0.007 A 33 LYS HGx H 1 1.284 0.004 A 33 LYS HGy H 1 1.388 0.01 A 33 LYS C C 13 177.849 . A 33 LYS CA C 13 57.798 0.232 A 33 LYS CB C 13 32.552 0.21 A 33 LYS CD C 13 29.635 . A 33 LYS CG C 13 25.489 0.121 A 33 LYS N N 15 121.352 0.071 A 34 PHE H H 1 8.007 0.01 A 34 PHE HA H 1 4.165 0.004 A 34 PHE HBx H 1 2.783 0.029 A 34 PHE HBy H 1 2.837 0.014 A 34 PHE HD1 H 1 6.902 0.015 A 34 PHE HD2 H 1 6.902 0.015 A 34 PHE HE1 H 1 7.006 0.003 A 34 PHE HE2 H 1 7.006 0.003 A 34 PHE HZ H 1 7.006 0.003 A 34 PHE C C 13 176.599 . A 34 PHE CA C 13 59.705 . A 34 PHE CB C 13 41.296 . A 34 PHE N N 15 119.267 0.038 A 35 GLU H H 1 8.255 0.018 A 35 GLU HA H 1 3.868 0.003 A 35 GLU HBx H 1 1.995 0.004 A 35 GLU HBy H 1 1.996 0.004 A 35 GLU HGx H 1 2.112 0.006 A 35 GLU HGy H 1 2.235 0.003 A 35 GLU C C 13 175.790 . A 35 GLU CA C 13 58.915 0.126 A 35 GLU CB C 13 29.532 . A 35 GLU N N 15 120.097 0.05 A 36 HIS HA H 1 4.428 0.004 A 36 HIS HB2 H 1 2.969 0.001 A 36 HIS HB3 H 1 2.969 0.001 A 36 HIS HD2 H 1 6.733 0.002 A 36 HIS HE1 H 1 7.837 . A 37 HIS HA H 1 4.430 0.002 A 37 HIS HBx H 1 2.762 0.002 A 37 HIS HBy H 1 2.870 0.003 A 37 HIS HD2 H 1 6.598 0.003 A 37 HIS HE1 H 1 7.793 0.009 A 38 PHE H H 1 8.515 0.005 A 38 PHE HA H 1 4.269 0.018 A 38 PHE HBx H 1 2.844 0.009 A 38 PHE HBy H 1 3.089 0.004 A 38 PHE HD1 H 1 7.071 0.004 A 38 PHE HD2 H 1 7.071 0.004 A 38 PHE HE1 H 1 7.128 0.011 A 38 PHE HE2 H 1 7.128 0.011 A 38 PHE HZ H 1 7.126 0.01 A 38 PHE C C 13 176.581 . A 38 PHE CA C 13 59.903 . A 38 PHE CB C 13 38.833 0.03 A 38 PHE N N 15 120.114 0.021 A 39 GLU H H 1 8.343 0.018 A 39 GLU HA H 1 4.012 0.005 A 39 GLU HBx H 1 2.060 0.003 A 39 GLU HBy H 1 2.061 0.003 A 39 GLU HG2 H 1 2.322 0.005 A 39 GLU HG3 H 1 2.322 0.005 A 39 GLU C C 13 178.258 . A 39 GLU CA C 13 58.900 0.032 A 39 GLU CB C 13 29.470 . A 39 GLU N N 15 120.055 0.075 A 40 GLU H H 1 8.013 0.006 A 40 GLU HA H 1 4.207 0.011 A 40 GLU HBx H 1 1.996 0.008 A 40 GLU HBy H 1 2.069 0.005 A 40 GLU HGx H 1 2.248 0.007 A 40 GLU HGy H 1 2.251 0.007 A 40 GLU C C 13 177.299 . A 40 GLU CA C 13 57.420 0.156 A 40 GLU CB C 13 29.989 0.02 A 40 GLU CG C 13 36.123 0.019 A 40 GLU N N 15 118.255 0.078 A 41 SER H H 1 7.909 0.013 A 41 SER HA H 1 4.490 0.009 A 41 SER HBx H 1 3.817 0.018 A 41 SER HBy H 1 3.850 0.034 A 41 SER C C 13 174.707 . A 41 SER CA C 13 58.924 0.012 A 41 SER CB C 13 63.741 . A 41 SER N N 15 113.187 0.144 A 42 SER H H 1 8.100 0.016 A 42 SER HA H 1 4.288 0.002 A 42 SER HBx H 1 3.805 0.007 A 42 SER HBy H 1 3.928 . A 42 SER C C 13 175.373 . A 42 SER CA C 13 61.753 0.343 A 42 SER CB C 13 63.864 . A 42 SER N N 15 118.617 0.049 A 43 PRO HA H 1 4.405 0.003 A 43 PRO HBx H 1 2.105 0.006 A 43 PRO HBy H 1 2.370 0.003 A 43 PRO HD2 H 1 4.137 . A 43 PRO HD3 H 1 4.137 . A 43 PRO HG2 H 1 1.908 0.005 A 43 PRO HG3 H 1 1.908 0.005 A 43 PRO C C 13 179.727 . A 43 PRO CA C 13 65.803 0.242 A 43 PRO CB C 13 31.400 . A 44 CYS H H 1 8.124 0.014 A 44 CYS HA H 1 4.479 0.005 A 44 CYS HBx H 1 2.757 0.006 A 44 CYS HBy H 1 3.167 0.005 A 44 CYS C C 13 175.467 . A 44 CYS CA C 13 58.450 0.087 A 44 CYS CB C 13 38.478 0.235 A 44 CYS N N 15 115.266 0.049 A 45 LEU H H 1 7.940 0.024 A 45 LEU HA H 1 4.184 0.006 A 45 LEU HBx H 1 1.806 0.003 A 45 LEU HBy H 1 2.033 0.004 A 45 LEU HDx% H 1 0.739 0.002 A 45 LEU HDy% H 1 0.869 0.005 A 45 LEU HG H 1 1.066 0.007 A 45 LEU C C 13 179.991 . A 45 LEU CA C 13 57.484 0.191 A 45 LEU CB C 13 41.334 0.212 A 45 LEU N N 15 116.387 0.088 A 46 GLU H H 1 8.830 0.005 A 46 GLU HA H 1 4.309 0.005 A 46 GLU HBx H 1 2.078 0.02 A 46 GLU HBy H 1 2.103 0.022 A 46 GLU HGx H 1 2.362 0.005 A 46 GLU HGy H 1 2.366 0.008 A 46 GLU C C 13 179.915 . A 46 GLU CA C 13 59.043 0.052 A 46 GLU CB C 13 29.474 . A 46 GLU CG C 13 36.482 . A 46 GLU N N 15 121.326 0.096 A 47 LYS H H 1 7.707 0.009 A 47 LYS HA H 1 3.954 0.005 A 47 LYS HB2 H 1 1.769 0.003 A 47 LYS HB3 H 1 1.769 0.003 A 47 LYS HDx H 1 1.629 0.006 A 47 LYS HDy H 1 1.630 0.004 A 47 LYS HEx H 1 2.942 0.005 A 47 LYS HEy H 1 2.947 . A 47 LYS C C 13 176.837 . A 47 LYS CA C 13 58.780 0.194 A 47 LYS CB C 13 32.143 0.305 A 47 LYS N N 15 119.687 0.066 A 48 TYR H H 1 6.914 0.015 A 48 TYR HA H 1 4.764 0.003 A 48 TYR HBx H 1 2.398 0.006 A 48 TYR HBy H 1 3.470 0.004 A 48 TYR HD1 H 1 7.275 0.01 A 48 TYR HD2 H 1 7.275 0.01 A 48 TYR HE1 H 1 6.768 0.002 A 48 TYR HE2 H 1 6.768 0.002 A 48 TYR C C 13 175.511 . A 48 TYR CA C 13 57.489 0.007 A 48 TYR CB C 13 40.155 0.144 A 48 TYR N N 15 113.315 0.065 A 49 GLY H H 1 7.939 0.005 A 49 GLY HAx H 1 3.972 0.013 A 49 GLY HAy H 1 4.251 0.006 A 49 GLY C C 13 176.366 . A 49 GLY CA C 13 47.268 0.137 A 49 GLY N N 15 109.045 0.039 A 50 LEU H H 1 8.131 0.011 A 50 LEU HA H 1 4.534 0.015 A 50 LEU HBx H 1 1.691 0.01 A 50 LEU HBy H 1 1.693 0.009 A 50 LEU HDx% H 1 0.763 0.008 A 50 LEU HDy% H 1 0.874 0.005 A 50 LEU HG H 1 1.696 0.007 A 50 LEU C C 13 176.502 . A 50 LEU CA C 13 54.520 0.038 A 50 LEU CB C 13 46.104 0.037 A 50 LEU N N 15 116.564 0.036 A 51 GLU H H 1 8.483 0.027 A 51 GLU HA H 1 3.769 0.007 A 51 GLU HBx H 1 1.849 0.005 A 51 GLU HBy H 1 1.852 0.004 A 51 GLU HGx H 1 2.109 0.007 A 51 GLU HGy H 1 2.113 0.007 A 51 GLU C C 13 177.288 . A 51 GLU CA C 13 61.159 0.162 A 51 GLU CB C 13 29.141 0.013 A 51 GLU CG C 13 35.802 . A 51 GLU N N 15 122.021 0.05 A 52 GLN H H 1 8.329 0.021 A 52 GLN HA H 1 3.992 0.005 A 52 GLN HB2 H 1 2.052 0.005 A 52 GLN HB3 H 1 2.052 0.005 A 52 GLN HGx H 1 2.441 0.023 A 52 GLN HGy H 1 2.442 0.025 A 52 GLN C C 13 178.762 . A 52 GLN CA C 13 58.907 0.007 A 52 GLN CB C 13 27.786 0.013 A 52 GLN CG C 13 33.921 . A 52 GLN N N 15 117.553 0.057 A 53 ALA H H 1 8.385 0.015 A 53 ALA HA H 1 3.996 0.014 A 53 ALA HB% H 1 1.328 0.007 A 53 ALA C C 13 179.162 . A 53 ALA CA C 13 54.870 0.133 A 53 ALA CB C 13 19.002 0.017 A 53 ALA N N 15 122.088 0.045 A 54 VAL H H 1 8.095 0.016 A 54 VAL HA H 1 3.512 0.009 A 54 VAL HB H 1 2.117 0.007 A 54 VAL HGx% H 1 0.847 0.015 A 54 VAL HGy% H 1 1.074 0.006 A 54 VAL C C 13 177.309 . A 54 VAL CA C 13 66.889 0.248 A 54 VAL CB C 13 31.183 0.032 A 54 VAL N N 15 115.013 0.081 A 55 LYS H H 1 7.899 0.006 A 55 LYS HA H 1 3.627 0.02 A 55 LYS HBx H 1 1.814 0.015 A 55 LYS HBy H 1 1.846 0.029 A 55 LYS HDx H 1 1.575 0.003 A 55 LYS HDy H 1 1.576 0.003 A 55 LYS HE2 H 1 2.818 0.004 A 55 LYS HE3 H 1 2.818 0.004 A 55 LYS HGx H 1 1.233 0.008 A 55 LYS HGy H 1 1.344 0.011 A 55 LYS C C 13 178.517 . A 55 LYS CA C 13 60.270 0.01 A 55 LYS CB C 13 32.026 0.048 A 55 LYS N N 15 119.212 0.081 A 56 LYS H H 1 7.409 0.006 A 56 LYS HA H 1 4.001 0.01 A 56 LYS HBx H 1 1.784 0.008 A 56 LYS HBy H 1 1.927 0.005 A 56 LYS HDx H 1 1.608 0.001 A 56 LYS HDy H 1 1.609 0.002 A 56 LYS HE2 H 1 2.924 0.01 A 56 LYS HGx H 1 1.400 0.001 A 56 LYS HGy H 1 1.406 0.006 A 56 LYS C C 13 178.236 . A 56 LYS CA C 13 58.755 0.26 A 56 LYS CB C 13 32.582 . A 56 LYS N N 15 116.129 0.023 A 57 LEU H H 1 7.727 0.01 A 57 LEU HA H 1 4.127 0.007 A 57 LEU HBx H 1 1.855 0.009 A 57 LEU HBy H 1 1.978 0.003 A 57 LEU HDx% H 1 0.809 0.008 A 57 LEU HDy% H 1 0.827 0.003 A 57 LEU HG H 1 1.510 0.006 A 57 LEU C C 13 178.597 . A 57 LEU CA C 13 57.356 0.152 A 57 LEU CB C 13 42.624 0.025 A 57 LEU N N 15 117.757 0.069 A 58 VAL H H 1 7.990 0.009 A 58 VAL HA H 1 3.981 0.019 A 58 VAL HB H 1 2.101 0.014 A 58 VAL HGx% H 1 0.796 0.01 A 58 VAL HGy% H 1 0.814 0.015 A 58 VAL C C 13 176.437 . A 58 VAL CA C 13 63.611 0.304 A 58 VAL CB C 13 31.953 0.015 A 58 VAL N N 15 114.724 0.065 A 59 LYS H H 1 7.705 0.007 A 59 LYS HA H 1 4.286 0.014 A 59 LYS HBx H 1 1.635 0.007 A 59 LYS HBy H 1 1.821 0.007 A 59 LYS HDx H 1 1.435 0.015 A 59 LYS HDy H 1 1.445 0.018 A 59 LYS HEx H 1 1.831 0.001 A 59 LYS HEy H 1 2.925 0.009 A 59 LYS HGx H 1 1.397 0.011 A 59 LYS HGy H 1 1.398 0.011 A 59 LYS HZ1 H 1 7.998 . A 59 LYS HZ2 H 1 7.998 . A 59 LYS HZ3 H 1 7.998 . A 59 LYS C C 13 176.664 . A 59 LYS CA C 13 56.385 0.105 A 59 LYS CB C 13 31.945 0.024 A 59 LYS CE C 13 42.174 0.15 A 59 LYS CG C 13 24.609 . A 59 LYS N N 15 120.236 0.082 A 60 ARG H H 1 8.019 0.011 A 60 ARG HA H 1 4.257 0.006 A 60 ARG HBx H 1 1.824 0.004 A 60 ARG HBy H 1 1.888 0.005 A 60 ARG HD2 H 1 3.201 0.004 A 60 ARG HD3 H 1 3.201 0.004 A 60 ARG HG2 H 1 1.649 0.005 A 60 ARG HG3 H 1 1.649 0.005 A 60 ARG C C 13 176.655 . A 60 ARG CA C 13 56.720 0.011 A 60 ARG CB C 13 29.995 0.012 A 60 ARG CD C 13 43.448 0.046 A 60 ARG CG C 13 27.774 0.115 A 60 ARG N N 15 121.112 0.072 A 61 ALA H H 1 8.274 0.013 A 61 ALA HA H 1 4.336 0.007 A 61 ALA HB% H 1 1.404 0.002 A 61 ALA C C 13 177.405 . A 61 ALA CA C 13 52.375 0.21 A 61 ALA CB C 13 19.350 0.021 A 61 ALA N N 15 124.581 0.052 A 62 ALA H H 1 8.220 0.02 A 62 ALA HA H 1 4.324 0.02 A 62 ALA HB% H 1 1.404 0.004 A 62 ALA C C 13 178.338 . A 62 ALA CA C 13 52.641 0.139 A 62 ALA CB C 13 18.918 0.037 A 62 ALA N N 15 122.568 0.09 A 63 GLY H H 1 8.401 0.01 A 63 GLY HAx H 1 3.923 0.006 A 63 GLY HAy H 1 4.037 0.003 A 63 GLY C C 13 174.403 . A 63 GLY CA C 13 45.505 0.162 A 63 GLY N N 15 108.634 0.081 A 64 GLN H H 1 8.124 0.009 A 64 GLN HA H 1 4.350 0.004 A 64 GLN HBx H 1 1.986 0.005 A 64 GLN HBy H 1 2.138 0.003 A 64 GLN HGx H 1 2.333 0.004 A 64 GLN HGy H 1 2.335 0.003 A 64 GLN C C 13 175.646 . A 64 GLN CA C 13 55.779 0.116 A 64 GLN CB C 13 29.608 0.214 A 64 GLN CG C 13 34.275 0.057 A 64 GLN N N 15 119.555 0.056 A 65 ASP H H 1 8.341 0.008 A 65 ASP HA H 1 4.592 0.007 A 65 ASP HBx H 1 2.597 0.01 A 65 ASP HBy H 1 2.690 0.002 A 65 ASP C C 13 175.644 . A 65 ASP CA C 13 54.438 0.003 A 65 ASP CB C 13 41.430 0.118 A 65 ASP N N 15 120.690 0.058 A 66 ASP H H 1 8.286 0.005 A 66 ASP HA H 1 4.597 0.004 A 66 ASP HBx H 1 2.609 0.004 A 66 ASP HBy H 1 2.686 0.004 A 66 ASP C C 13 175.860 . A 66 ASP CA C 13 54.032 . A 66 ASP CB C 13 41.243 . A 66 ASP N N 15 120.073 0.056 A 67 VAL H H 1 8.199 0.01 A 67 VAL HA H 1 4.353 0.003 A 67 VAL HB H 1 2.073 0.01 A 67 VAL HGx% H 1 0.942 0.009 A 67 VAL HGy% H 1 0.945 0.007 A 67 VAL C C 13 174.418 . A 67 VAL CA C 13 59.830 0.227 A 67 VAL CB C 13 32.647 0.007 A 67 VAL N N 15 121.544 0.057 A 68 PRO HA H 1 4.429 0.004 A 68 PRO HB2 H 1 2.386 0.003 A 68 PRO HB3 H 1 2.386 0.003 A 68 PRO HDx H 1 3.610 0.004 A 68 PRO HDy H 1 3.965 0.003 A 68 PRO HGx H 1 2.014 . A 68 PRO HGy H 1 2.109 0.003 A 68 PRO C C 13 178.331 . A 68 PRO CA C 13 63.346 0.16 A 68 PRO CB C 13 32.438 0.262 A 68 PRO CD C 13 50.916 0.178 A 69 GLY H H 1 8.774 0.007 A 69 GLY HAx H 1 3.894 0.041 A 69 GLY HAy H 1 3.964 0.004 A 69 GLY C C 13 174.793 . A 69 GLY CA C 13 46.661 . A 69 GLY N N 15 110.310 0.049 A 70 ASP H H 1 8.298 0.013 A 70 ASP HA H 1 4.659 0.005 A 70 ASP HBx H 1 2.657 0.015 A 70 ASP HBy H 1 2.831 0.012 A 70 ASP C C 13 177.021 . A 70 ASP CA C 13 53.851 0.31 A 70 ASP CB C 13 40.549 0.154 A 70 ASP N N 15 118.989 0.04 A 71 LEU H H 1 7.600 0.011 A 71 LEU HA H 1 4.023 0.005 A 71 LEU HBx H 1 1.609 0.009 A 71 LEU HBy H 1 1.743 0.007 A 71 LEU HD1% H 1 0.945 0.004 A 71 LEU HD2% H 1 0.945 0.004 A 71 LEU HG H 1 1.568 0.016 A 71 LEU C C 13 178.097 . A 71 LEU CA C 13 58.290 0.002 A 71 LEU CB C 13 41.989 0.045 A 71 LEU N N 15 121.757 0.067 A 72 ARG H H 1 8.666 0.028 A 72 ARG HA H 1 3.670 0.005 A 72 ARG HBx H 1 1.743 0.006 A 72 ARG HBy H 1 1.877 0.005 A 72 ARG HDx H 1 3.138 0.003 A 72 ARG HDy H 1 3.279 0.003 A 72 ARG HG2 H 1 1.403 0.004 A 72 ARG HG3 H 1 1.403 0.005 A 72 ARG C C 13 177.418 . A 72 ARG CA C 13 60.361 0.213 A 72 ARG CB C 13 29.510 0.034 A 72 ARG CG C 13 28.964 . A 72 ARG N N 15 119.091 0.093 A 73 ALA H H 1 8.012 0.012 A 73 ALA HA H 1 4.067 0.005 A 73 ALA HB% H 1 1.459 0.006 A 73 ALA C C 13 181.513 . A 73 ALA CA C 13 55.045 0.1 A 73 ALA CB C 13 18.005 0.002 A 73 ALA N N 15 120.095 0.103 A 74 LYS H H 1 8.114 0.011 A 74 LYS HA H 1 4.082 0.011 A 74 LYS HBx H 1 1.865 0.002 A 74 LYS HBy H 1 1.988 0.001 A 74 LYS HD2 H 1 1.677 0.016 A 74 LYS HD3 H 1 1.677 0.016 A 74 LYS HG2 H 1 1.446 . A 74 LYS HG3 H 1 1.446 . A 74 LYS C C 13 180.199 . A 74 LYS CA C 13 59.563 0.012 A 74 LYS CB C 13 32.546 0.02 A 74 LYS N N 15 120.071 0.056 A 75 VAL H H 1 8.517 0.016 A 75 VAL HA H 1 3.479 0.013 A 75 VAL HB H 1 2.086 0.026 A 75 VAL HGx% H 1 0.783 0.023 A 75 VAL HGy% H 1 0.946 0.004 A 75 VAL C C 13 177.865 . A 75 VAL CA C 13 66.888 0.306 A 75 VAL CB C 13 31.353 0.189 A 75 VAL CG1 C 13 20.840 . A 75 VAL CG2 C 13 20.840 . A 75 VAL N N 15 120.861 0.069 A 76 MET H H 1 8.634 0.013 A 76 MET HA H 1 3.939 0.004 A 76 MET HBx H 1 1.988 0.008 A 76 MET HBy H 1 2.176 0.004 A 76 MET HE% H 1 1.983 0.007 A 76 MET HG2 H 1 2.556 0.006 A 76 MET HG3 H 1 2.556 0.006 A 76 MET C C 13 178.102 . A 76 MET CA C 13 59.942 0.136 A 76 MET CB C 13 31.892 . A 76 MET N N 15 118.548 0.065 A 77 GLY H H 1 8.297 0.015 A 77 GLY HAx H 1 3.905 0.002 A 77 GLY HAy H 1 3.993 0.002 A 77 GLY C C 13 176.735 . A 77 GLY CA C 13 47.060 0.003 A 77 GLY N N 15 105.498 0.054 A 78 ARG H H 1 7.746 0.021 A 78 ARG HA H 1 4.234 0.008 A 78 ARG HBx H 1 2.026 0.009 A 78 ARG HBy H 1 2.027 0.007 A 78 ARG HDx H 1 3.232 0.013 A 78 ARG HDy H 1 3.382 0.007 A 78 ARG HGx H 1 1.765 0.012 A 78 ARG HGy H 1 1.783 0.009 A 78 ARG C C 13 178.645 . A 78 ARG CA C 13 58.752 0.025 A 78 ARG CB C 13 28.892 0.273 A 78 ARG N N 15 122.403 0.037 A 79 LEU H H 1 8.570 0.011 A 79 LEU HA H 1 3.981 0.015 A 79 LEU HBx H 1 1.913 0.004 A 79 LEU HBy H 1 2.304 0.004 A 79 LEU HDx% H 1 0.847 0.025 A 79 LEU HDy% H 1 0.892 0.009 A 79 LEU HG H 1 1.527 0.006 A 79 LEU C C 13 179.131 . A 79 LEU CA C 13 58.346 0.164 A 79 LEU CB C 13 41.963 . A 79 LEU N N 15 119.203 0.07 A 80 ASP H H 1 8.657 0.004 A 80 ASP HA H 1 4.371 0.008 A 80 ASP HBx H 1 2.668 0.013 A 80 ASP HBy H 1 2.909 0.015 A 80 ASP C C 13 179.091 . A 80 ASP CA C 13 57.481 0.149 A 80 ASP CB C 13 40.688 0.207 A 80 ASP N N 15 119.959 0.031 A 81 LEU H H 1 7.489 0.004 A 81 LEU HA H 1 4.011 0.01 A 81 LEU HB2 H 1 1.496 0.002 A 81 LEU HB3 H 1 1.496 0.002 A 81 LEU HDx% H 1 0.851 0.003 A 81 LEU HDy% H 1 0.971 0.011 A 81 LEU HG H 1 1.514 0.021 A 81 LEU C C 13 179.503 . A 81 LEU CA C 13 58.030 0.083 A 81 LEU CB C 13 41.871 0.161 A 81 LEU CDx C 13 24.086 . A 81 LEU CDy C 13 24.173 0.086 A 81 LEU CG C 13 26.363 0.099 A 81 LEU N N 15 120.685 0.094 A 82 ILE H H 1 8.040 0.016 A 82 ILE HA H 1 3.639 0.006 A 82 ILE HB H 1 1.616 0.008 A 82 ILE HD1% H 1 0.436 0.015 A 82 ILE HG1x H 1 0.757 0.01 A 82 ILE HG1y H 1 0.759 0.007 A 82 ILE HG2% H 1 0.470 0.021 A 82 ILE C C 13 180.074 . A 82 ILE CA C 13 64.724 0.163 A 82 ILE CB C 13 39.116 0.131 A 82 ILE CG1 C 13 18.390 . A 82 ILE CG2 C 13 18.390 . A 82 ILE N N 15 120.217 0.071 A 83 ARG H H 1 8.491 0.019 A 83 ARG HA H 1 4.032 0.007 A 83 ARG HBx H 1 1.662 0.024 A 83 ARG HBy H 1 1.824 0.004 A 83 ARG HDx H 1 2.752 0.003 A 83 ARG HDy H 1 2.981 0.003 A 83 ARG HE H 1 7.006 0.003 A 83 ARG HGx H 1 1.626 0.005 A 83 ARG HGy H 1 1.633 0.011 A 83 ARG C C 13 177.406 . A 83 ARG CA C 13 58.467 0.182 A 83 ARG CB C 13 30.123 0.158 A 83 ARG N N 15 119.428 0.073 A 84 SER H H 1 7.692 0.012 A 84 SER HA H 1 4.466 0.011 A 84 SER HBx H 1 3.977 0.011 A 84 SER HBy H 1 4.076 0.009 A 84 SER C C 13 175.207 . A 84 SER CA C 13 59.047 0.012 A 84 SER CB C 13 63.944 0.098 A 84 SER N N 15 112.616 0.055 A 85 GLY H H 1 7.857 0.004 A 85 GLY HAx H 1 3.908 0.006 A 85 GLY HAy H 1 4.082 0.006 A 85 GLY C C 13 174.518 . A 85 GLY CA C 13 46.073 0.158 A 85 GLY N N 15 110.028 0.065 A 86 GLN H H 1 7.897 0.008 A 86 GLN HA H 1 4.401 0.004 A 86 GLN HBx H 1 2.125 0.008 A 86 GLN HBy H 1 2.187 0.004 A 86 GLN HGx H 1 2.265 0.003 A 86 GLN HGy H 1 2.360 0.005 A 86 GLN C C 13 175.342 . A 86 GLN CA C 13 55.195 0.09 A 86 GLN CB C 13 30.312 0.009 A 86 GLN N N 15 118.928 0.055 A 87 SER H H 1 8.256 0.015 A 87 SER HA H 1 4.405 0.008 A 87 SER HBx H 1 3.791 0.006 A 87 SER HBy H 1 3.821 0.01 A 87 SER C C 13 173.942 . A 87 SER CA C 13 58.442 0.066 A 87 SER CB C 13 63.744 0.01 A 87 SER N N 15 115.929 0.047 A 88 VAL H H 1 8.308 0.023 A 88 VAL HA H 1 4.496 0.007 A 88 VAL HB H 1 2.101 0.004 A 88 VAL HGx% H 1 0.969 0.009 A 88 VAL HGy% H 1 1.009 0.015 A 88 VAL C C 13 174.377 . A 88 VAL CA C 13 59.531 . A 88 VAL CB C 13 32.768 0.054 A 88 VAL CG1 C 13 20.900 . A 88 VAL CG2 C 13 20.900 . A 88 VAL N N 15 122.228 0.082 A 89 PRO HA H 1 4.394 0.007 A 89 PRO HBx H 1 1.710 0.019 A 89 PRO HBy H 1 2.294 0.006 A 89 PRO HDx H 1 3.469 0.002 A 89 PRO HDy H 1 3.895 0.004 A 89 PRO HGx H 1 1.703 0.015 A 89 PRO HGy H 1 1.957 . A 89 PRO C C 13 176.462 . A 89 PRO CA C 13 63.068 0.004 A 89 PRO CB C 13 32.335 . A 89 PRO CD C 13 50.961 0.014 A 89 PRO CG C 13 27.960 0.039 A 90 GLU H H 1 8.517 0.006 A 90 GLU HA H 1 4.162 0.004 A 90 GLU HBx H 1 1.894 0.004 A 90 GLU HBy H 1 2.004 0.015 A 90 GLU HGx H 1 2.218 0.02 A 90 GLU HGy H 1 2.249 0.011 A 90 GLU C C 13 176.440 . A 90 GLU CA C 13 56.799 0.072 A 90 GLU CB C 13 30.025 0.003 A 90 GLU CG C 13 36.501 . A 90 GLU N N 15 120.148 0.045 A 91 HIS H H 1 7.875 0.007 A 91 HIS HA H 1 4.611 0.01 A 91 HIS HBx H 1 3.066 0.004 A 91 HIS HBy H 1 3.127 0.005 A 91 HIS HD1 H 1 7.009 0.004 A 91 HIS HD2 H 1 7.884 . A 91 HIS C C 13 174.750 . A 91 HIS CA C 13 55.684 0.03 A 91 HIS CB C 13 30.954 0.017 A 91 HIS N N 15 118.194 0.092 A 92 ASP H H 1 8.503 0.034 A 92 ASP HA H 1 4.598 0.009 A 92 ASP HBx H 1 2.604 0.032 A 92 ASP HBy H 1 2.659 0.001 A 92 ASP C C 13 176.831 . A 92 ASP CA C 13 54.458 0.008 A 92 ASP CB C 13 41.522 0.026 A 92 ASP N N 15 122.613 0.128 A 93 VAL H H 1 8.239 0.005 A 93 VAL HA H 1 3.982 0.01 A 93 VAL HB H 1 2.047 0.004 A 93 VAL HG1% H 1 0.925 0.005 A 93 VAL HG2% H 1 0.925 0.004 A 93 VAL C C 13 175.544 . A 93 VAL CA C 13 62.873 0.114 A 93 VAL CB C 13 32.503 0.212 A 93 VAL CG1 C 13 22.053 . A 93 VAL CG2 C 13 22.053 . A 93 VAL N N 15 122.124 0.095 A 94 ALA H H 1 8.423 0.02 A 94 ALA HA H 1 4.266 0.009 A 94 ALA HB% H 1 1.344 0.009 A 94 ALA C C 13 177.076 . A 94 ALA CA C 13 51.957 0.262 A 94 ALA CB C 13 19.174 . A 94 ALA N N 15 125.832 0.11 A 95 ALA H H 1 7.973 0.02 A 95 ALA HA H 1 4.275 0.006 A 95 ALA HB% H 1 1.363 0.007 A 95 ALA C C 13 176.909 . A 95 ALA CA C 13 52.002 0.035 A 95 ALA CB C 13 19.409 0.03 A 95 ALA N N 15 123.034 0.058 A 96 ALA H H 1 8.216 0.004 A 96 ALA HA H 1 4.529 0.008 A 96 ALA HB% H 1 1.340 0.003 A 96 ALA C C 13 175.530 . A 96 ALA CA C 13 50.143 0.202 A 96 ALA CB C 13 18.094 . A 96 ALA N N 15 124.737 0.039 A 97 PRO HA H 1 4.350 . A 97 PRO HBx H 1 2.002 0.002 A 97 PRO HBy H 1 2.269 . A 97 PRO HDx H 1 3.602 0.004 A 97 PRO HDy H 1 3.724 0.013 A 97 PRO HG2 H 1 1.943 0.018 A 97 PRO HG3 H 1 1.943 0.018 A 97 PRO C C 13 177.071 . A 97 PRO CA C 13 63.075 . A 97 PRO CB C 13 32.033 . A 98 SER H H 1 8.446 0.004 A 98 SER HA H 1 4.432 0.002 A 98 SER HBx H 1 3.850 0.007 A 98 SER HBy H 1 3.900 0.003 A 98 SER C C 13 177.087 . A 98 SER CA C 13 58.336 . A 98 SER CB C 13 63.761 . A 98 SER N N 15 116.281 0.134 A 99 SER H H 1 7.657 0.001 A 99 SER HA H 1 4.486 . A 99 SER HBx H 1 3.985 0.006 A 99 SER HBy H 1 4.103 0.005 A 100 SER HA H 1 4.469 0.001 A 100 SER C C 13 173.645 . A 100 SER CA C 13 58.141 . A 100 SER CB C 13 63.926 . A 101 ALA H H 1 8.225 0.008 A 101 ALA HA H 1 4.598 0.006 A 101 ALA HB% H 1 1.341 0.005 A 101 ALA C C 13 175.388 . A 101 ALA CA C 13 50.561 0.05 A 101 ALA CB C 13 18.133 0.024 A 101 ALA N N 15 127.109 0.051 A 102 PRO HA H 1 4.392 0.005 A 102 PRO HB2 H 1 2.281 0.008 A 102 PRO HB3 H 1 2.281 0.008 A 102 PRO HDx H 1 3.624 0.012 A 102 PRO HDy H 1 3.783 0.004 A 102 PRO HGx H 1 1.903 . A 102 PRO HGy H 1 2.007 0.007 A 102 PRO C C 13 176.890 . A 102 PRO CA C 13 62.902 0.186 A 102 PRO CB C 13 32.147 0.231 A 102 PRO CD C 13 50.603 0.191 A 102 PRO CG C 13 27.928 0.021 A 103 GLN H H 1 8.506 0.007 A 103 GLN HA H 1 4.322 . A 103 GLN HBx H 1 1.987 0.002 A 103 GLN HBy H 1 2.108 0.002 A 103 GLN HGx H 1 2.389 0.006 A 103 GLN HGy H 1 2.394 0.009 A 103 GLN C C 13 175.919 . A 103 GLN CA C 13 55.747 . A 103 GLN CB C 13 29.938 0.253 A 103 GLN N N 15 120.884 0.067 A 104 GLU H H 1 8.470 0.007 A 104 GLU HA H 1 4.334 0.011 A 104 GLU HBx H 1 1.927 . A 104 GLU HBy H 1 2.084 0.023 A 104 GLU HG2 H 1 2.266 0.008 A 104 GLU HG3 H 1 2.266 0.008 A 104 GLU C C 13 175.591 . A 104 GLU CA C 13 56.593 0.001 A 104 GLU CB C 13 30.543 0.005 A 104 GLU N N 15 123.070 0.043 A 105 SER H H 1 7.995 0.013 A 105 SER HA H 1 4.255 0.004 A 105 SER HBx H 1 3.818 0.011 A 105 SER HBy H 1 3.828 0.013 A 105 SER C C 13 175.588 . A 105 SER CA C 13 59.986 0.378 A 105 SER CB C 13 64.676 0.16 A 105 SER N N 15 122.446 0.036 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 71 LEU H A 71 LEU HBx 1.0 1.8 5.0 2 2 A 71 LEU H A 71 LEU HD2% 1.0 1.8 4.0 3 2 A 71 LEU H A 71 LEU HD1% 1.0 1.8 4.0 4 3 A 3 ALA HA A 3 ALA HB% 1.0 1.8 2.8 5 4 A 101 ALA HA A 101 ALA HB% 1.0 1.8 2.8 6 5 A 96 ALA HA A 96 ALA HB% 1.0 1.8 4.0 7 6 A 98 SER HA A 98 SER HBy 1.0 1.8 2.8 8 7 A 88 VAL HA A 88 VAL HGx% 1.0 1.8 4.0 9 8 A 88 VAL HA A 88 VAL HGy% 1.0 1.8 4.0 10 9 A 75 VAL HA A 75 VAL HGy% 1.0 1.8 4.0 11 10 A 54 VAL HA A 54 VAL HGy% 1.0 1.8 4.0 12 11 A 75 VAL HA A 75 VAL HGx% 1.0 1.8 4.0 13 12 A 54 VAL HA A 54 VAL HGx% 1.0 1.8 4.0 14 13 A 89 PRO HDy A 88 VAL HGx% 1.0 1.8 4.0 15 14 A 54 VAL HGx% A 54 VAL HB 1.0 1.8 4.0 16 15 A 54 VAL HGy% A 54 VAL HB 1.0 1.8 2.8 17 16 A 21 PHE HD% A 21 PHE HBy 1.0 1.8 4.0 18 17 A 48 TYR HA A 48 TYR HBy 1.0 1.8 4.0 19 18 A 48 TYR HA A 48 TYR HBx 1.0 1.8 4.0 20 19 A 48 TYR HBy A 48 TYR HBx 1.0 1.8 4.0 21 20 A 53 ALA HB% A 71 LEU HD2% 1.0 1.8 4.0 22 20 A 71 LEU HD1% A 53 ALA HB% 1.0 1.8 4.0 23 21 A 59 LYS H A 58 VAL HGy% 1.0 1.8 5.0 24 22 A 59 LYS H A 58 VAL HGx% 1.0 1.8 4.0 25 23 A 101 ALA HB% A 101 ALA H 1.0 1.8 5.0 26 24 A 101 ALA H A 100 SER HA 1.0 1.8 4.0 27 25 A 19 TYR H A 16 ASP HA 1.0 1.8 5.0 28 26 A 53 ALA HB% A 53 ALA H 1.0 1.8 4.0 29 27 A 85 GLY H A 85 GLY HAx 1.0 1.8 2.8 30 28 A 85 GLY H A 85 GLY HAy 1.0 1.8 2.8 31 29 A 82 ILE H A 82 ILE HA 1.0 1.8 4.0 32 30 A 82 ILE H A 82 ILE HB 1.0 1.8 2.8 33 31 A 82 ILE H A 82 ILE HG2% 1.0 1.8 5.0 34 32 A 82 ILE H A 82 ILE HD1% 1.0 1.8 5.0 35 33 A 82 ILE H A 81 LEU HDx% 1.0 1.8 5.0 36 34 A 75 VAL HGy% A 73 ALA H 1.0 1.8 5.0 37 35 A 77 GLY H A 77 GLY HAx 1.0 1.8 2.8 38 36 A 77 GLY H A 77 GLY HAy 1.0 1.8 2.8 39 37 A 75 VAL HGx% A 75 VAL H 1.0 1.8 4.0 40 38 A 75 VAL HGy% A 75 VAL H 1.0 1.8 4.0 41 39 A 71 LEU H A 71 LEU HBy 1.0 1.8 4.0 42 40 A 61 ALA H A 61 ALA HB% 1.0 1.8 4.0 43 41 A 59 LYS H A 59 LYS HDy 1.0 1.8 4.0 44 42 A 59 LYS H A 59 LYS HGy 1.0 1.8 4.0 45 42 A 59 LYS H A 59 LYS HGx 1.0 1.8 4.0 46 43 A 57 LEU H A 57 LEU HDx% 1.0 1.8 5.0 47 44 A 57 LEU H A 57 LEU HDx% 1.0 1.8 4.0 48 45 A 44 CYS H A 44 CYS HA 1.0 1.8 4.0 49 46 A 44 CYS H A 44 CYS HBx 1.0 1.8 4.0 50 47 A 44 CYS H A 44 CYS HBy 1.0 1.8 4.0 51 48 A 33 LYS H A 33 LYS HBy 1.0 1.8 2.8 52 48 A 33 LYS H A 33 LYS HBx 1.0 1.8 2.8 53 49 A 33 LYS H A 33 LYS HGx 1.0 1.8 4.0 54 50 A 32 VAL H A 32 VAL HGx% 1.0 1.8 4.0 55 51 A 32 VAL H A 32 VAL HGy% 1.0 1.8 4.0 56 52 A 31 ALA H A 31 ALA HB% 1.0 1.8 4.0 57 53 A 31 ALA H A 31 ALA HA 1.0 1.8 4.0 58 54 A 30 ASP H A 30 ASP HBy 1.0 1.8 4.0 59 55 A 30 ASP H A 30 ASP HBx 1.0 1.8 4.0 60 56 A 24 LYS H A 23 ASP HBy 1.0 1.8 4.0 61 57 A 24 LYS H A 24 LYS HA 1.0 1.8 2.8 62 58 A 24 LYS H A 23 ASP HBx 1.0 1.8 4.0 63 59 A 24 LYS H A 24 LYS HBy 1.0 1.8 4.0 64 60 A 24 LYS H A 24 LYS HD2 1.0 1.8 4.0 65 60 A 24 LYS H A 24 LYS HD3 1.0 1.8 4.0 66 61 A 24 LYS H A 24 LYS HGx 1.0 1.8 5.0 67 62 A 24 LYS H A 24 LYS HE2 1.0 1.8 5.0 68 62 A 24 LYS H A 24 LYS HE3 1.0 1.8 5.0 69 63 A 23 ASP HBx A 23 ASP H 1.0 1.8 4.0 70 64 A 22 LEU H A 22 LEU HA 1.0 1.8 4.0 71 65 A 21 PHE H A 21 PHE HA 1.0 1.8 2.8 72 66 A 21 PHE H A 21 PHE HBy 1.0 1.8 2.8 73 67 A 21 PHE H A 21 PHE HBx 1.0 1.8 2.8 74 68 A 20 GLU H A 20 GLU HA 1.0 1.8 2.8 75 69 A 20 GLU H A 20 GLU HGx 1.0 1.8 4.0 76 70 A 20 GLU H A 20 GLU HGy 1.0 1.8 4.0 77 71 A 20 GLU H A 20 GLU HBx 1.0 1.8 4.0 78 72 A 19 TYR H A 19 TYR HA 1.0 1.8 4.0 79 73 A 19 TYR H A 19 TYR HBy 1.0 1.8 2.8 80 74 A 19 TYR H A 19 TYR HBx 1.0 1.8 2.8 81 75 A 17 HIS H A 17 HIS HBx 1.0 1.8 4.0 82 76 A 17 HIS H A 17 HIS HBy 1.0 1.8 4.0 83 77 A 17 HIS H A 17 HIS HA 1.0 1.8 4.0 84 78 A 17 HIS H A 16 ASP HBx 1.0 1.8 4.0 85 79 A 17 HIS H A 16 ASP HBy 1.0 1.8 4.0 86 80 A 15 LEU H A 15 LEU HA 1.0 1.8 4.0 87 81 A 15 LEU H A 15 LEU HG 1.0 1.8 4.0 88 82 A 15 LEU H A 14 ILE HG2% 1.0 1.8 4.0 89 83 A 15 LEU H A 15 LEU HD2% 1.0 1.8 4.0 90 83 A 15 LEU H A 15 LEU HD1% 1.0 1.8 4.0 91 84 A 14 ILE H A 14 ILE HG1x 1.0 1.8 2.8 92 85 A 14 ILE H A 14 ILE HG1y 1.0 1.8 4.0 93 86 A 14 ILE HG2% A 14 ILE H 1.0 1.8 4.0 94 87 A 14 ILE H A 14 ILE HD1% 1.0 1.8 5.0 95 88 A 14 ILE H A 15 LEU HD2% 1.0 1.8 6.0 96 88 A 15 LEU HD1% A 14 ILE H 1.0 1.8 6.0 97 89 A 14 ILE H A 14 ILE HA 1.0 1.8 4.0 98 90 A 12 SER H A 12 SER HB3 1.0 1.8 2.8 99 90 A 12 SER H A 12 SER HB2 1.0 1.8 2.8 100 91 A 10 ASP H A 10 ASP HBx 1.0 1.8 4.0 101 92 A 10 ASP H A 10 ASP HBy 1.0 1.8 4.0 102 93 A 29 SER H A 29 SER HA 1.0 1.8 4.0 103 94 A 9 THR H A 9 THR HB 1.0 1.8 4.0 104 95 A 9 THR H A 9 THR HG2% 1.0 1.8 5.0 105 96 A 7 HIS H A 7 HIS HB2 1.0 1.8 4.0 106 96 A 7 HIS H A 7 HIS HB3 1.0 1.8 4.0 107 97 A 4 GLY H A 4 GLY HAx 1.0 1.8 4.0 108 97 A 4 GLY H A 4 GLY HAy 1.0 1.8 4.0 109 98 A 3 ALA HB% A 3 ALA H 1.0 1.8 5.0 110 99 A 96 ALA HA A 97 PRO HDy 1.0 1.8 2.8 111 100 A 96 ALA HA A 97 PRO HDx 1.0 1.8 2.8 112 101 A 67 VAL HA A 68 PRO HDx 1.0 1.8 2.8 113 102 A 67 VAL HA A 67 VAL H 1.0 1.8 2.8 114 103 A 101 ALA HA A 101 ALA H 1.0 1.8 4.0 115 104 A 67 VAL HA A 67 VAL HGy% 1.0 1.8 4.0 116 104 A 67 VAL HA A 67 VAL HGx% 1.0 1.8 4.0 117 105 A 82 ILE HG2% A 83 ARG H 1.0 1.8 5.0 118 106 A 82 ILE HD1% A 83 ARG H 1.0 1.8 6.0 119 107 A 82 ILE HG2% A 48 TYR HD% 1.0 1.8 6.0 120 108 A 82 ILE HD1% A 48 TYR HD% 1.0 1.8 5.0 121 109 A 83 ARG H A 15 LEU HD2% 1.0 1.8 6.0 122 109 A 15 LEU HD1% A 83 ARG H 1.0 1.8 6.0 123 110 A 16 ASP HA A 19 TYR HBx 1.0 1.8 4.0 124 111 A 36 HIS HA A 36 HIS HB2 1.0 1.8 2.8 125 111 A 36 HIS HA A 36 HIS HB3 1.0 1.8 2.8 126 112 A 88 VAL HA A 89 PRO HDy 1.0 1.8 2.8 127 113 A 89 PRO HDy A 89 PRO HDx 1.0 1.8 2.5 128 114 A 99 SER HA A 99 SER HBy 1.0 1.8 2.8 129 115 A 68 PRO HDx A 67 VAL H 1.0 1.8 4.0 130 116 A 67 VAL H A 67 VAL HGy% 1.0 1.8 2.8 131 116 A 67 VAL H A 67 VAL HGx% 1.0 1.8 2.8 132 117 A 67 VAL HA A 68 PRO HDy 1.0 1.8 2.5 133 118 A 68 PRO HDx A 68 PRO HDy 1.0 1.8 2.5 134 119 A 69 GLY H A 68 PRO HA 1.0 1.8 4.0 135 120 A 78 ARG HA A 78 ARG HDy 1.0 1.8 4.0 136 121 A 78 ARG HA A 78 ARG H 1.0 1.8 2.8 137 122 A 78 ARG HDy A 78 ARG H 1.0 1.8 5.0 138 123 A 78 ARG H A 78 ARG HDx 1.0 1.8 5.0 139 124 A 78 ARG HA A 78 ARG HDx 1.0 1.8 4.0 140 125 A 78 ARG HDy A 78 ARG HDx 1.0 1.8 2.8 141 126 A 82 ILE HB A 82 ILE HG2% 1.0 1.8 4.0 142 127 A 82 ILE HB A 82 ILE HD1% 1.0 1.8 4.0 143 128 A 82 ILE HG2% A 83 ARG HBy 1.0 1.8 4.0 144 129 A 48 TYR HBx A 50 LEU HDx% 1.0 1.8 5.0 145 130 A 48 TYR HBx A 82 ILE HD1% 1.0 1.8 5.0 146 131 A 82 ILE HD1% A 78 ARG HGx 1.0 1.8 5.0 147 132 A 82 ILE HD1% A 14 ILE HG2% 1.0 1.8 6.0 148 133 A 82 ILE HD1% A 81 LEU HDx% 1.0 1.8 6.0 149 134 A 82 ILE HD1% A 81 LEU HDy% 1.0 1.8 5.0 150 135 A 82 ILE HD1% A 82 ILE HG1x 1.0 1.8 4.0 151 136 A 82 ILE HD1% A 15 LEU HD2% 1.0 1.8 5.0 152 136 A 82 ILE HD1% A 15 LEU HD1% 1.0 1.8 5.0 153 137 A 82 ILE HG2% A 15 LEU HD2% 1.0 1.8 5.0 154 137 A 82 ILE HG2% A 15 LEU HD1% 1.0 1.8 5.0 155 138 A 82 ILE HG2% A 14 ILE HG2% 1.0 1.8 6.0 156 139 A 82 ILE HG2% A 81 LEU HDx% 1.0 1.8 6.0 157 140 A 82 ILE HG2% A 81 LEU HDy% 1.0 1.8 6.0 158 141 A 82 ILE HD1% A 78 ARG HDx 1.0 1.8 6.0 159 142 A 82 ILE HD1% A 78 ARG HDy 1.0 1.8 6.0 160 143 A 82 ILE HA A 82 ILE HG2% 1.0 1.8 4.0 161 144 A 82 ILE HA A 82 ILE HD1% 1.0 1.8 5.0 162 145 A 82 ILE HG2% A 83 ARG HA 1.0 1.8 5.0 163 146 A 83 ARG HA A 83 ARG HDx 1.0 1.8 4.0 164 147 A 52 GLN HA A 52 GLN HGy 1.0 1.8 4.0 165 148 A 52 GLN HA A 52 GLN HGx 1.0 1.8 4.0 166 149 A 89 PRO HA A 89 PRO HBx 1.0 1.8 2.8 167 150 A 48 TYR HA A 82 ILE HD1% 1.0 1.8 6.0 168 151 A 89 PRO HA A 89 PRO HGx 1.0 1.8 4.0 169 152 A 14 ILE HG2% A 15 LEU HD2% 1.0 1.8 5.0 170 152 A 14 ILE HG2% A 15 LEU HD1% 1.0 1.8 5.0 171 153 A 82 ILE HG2% A 48 TYR HE% 1.0 1.8 6.0 172 154 A 82 ILE HD1% A 48 TYR HE% 1.0 1.8 6.0 173 155 A 83 ARG H A 83 ARG HBy 1.0 1.8 2.8 174 156 A 15 LEU HG A 15 LEU HD2% 1.0 1.8 4.0 175 156 A 15 LEU HG A 15 LEU HD1% 1.0 1.8 4.0 176 157 A 53 ALA HB% A 53 ALA HA 1.0 1.8 4.0 177 158 A 15 LEU HA A 15 LEU HG 1.0 1.8 4.0 178 159 A 15 LEU HA A 15 LEU HD2% 1.0 1.8 4.0 179 159 A 15 LEU HA A 15 LEU HD1% 1.0 1.8 4.0 180 160 A 11 CYS HA A 15 LEU HD2% 1.0 1.8 6.0 181 160 A 15 LEU HD1% A 11 CYS HA 1.0 1.8 6.0 182 161 A 44 CYS HBx A 15 LEU HD2% 1.0 1.8 5.0 183 161 A 44 CYS HBx A 15 LEU HD1% 1.0 1.8 5.0 184 162 A 34 PHE HA A 34 PHE HBx 1.0 1.8 4.0 185 163 A 9 THR HB A 9 THR HA 1.0 1.8 2.8 186 164 A 38 PHE HA A 38 PHE HBx 1.0 1.8 4.0 187 165 A 38 PHE HA A 38 PHE HBy 1.0 1.8 4.0 188 166 A 9 THR HG2% A 9 THR HA 1.0 1.8 4.0 189 167 A 42 SER HA A 45 LEU HDx% 1.0 1.8 5.0 190 168 A 98 SER HA A 98 SER HBx 1.0 1.8 4.0 191 169 A 53 ALA H A 50 LEU HDy% 1.0 1.8 6.0 192 170 A 94 ALA H A 94 ALA HA 1.0 1.8 4.0 193 171 A 90 GLU H A 90 GLU HA 1.0 1.8 2.8 194 172 A 88 VAL H A 88 VAL HGx% 1.0 1.8 5.0 195 173 A 88 VAL H A 88 VAL HGy% 1.0 1.8 4.0 196 174 A 88 VAL HA A 88 VAL H 1.0 1.8 2.8 197 175 A 88 VAL HB A 88 VAL HGx% 1.0 1.8 4.0 198 176 A 88 VAL HB A 88 VAL HGy% 1.0 1.8 4.0 199 177 A 67 VAL HGx% A 67 VAL HB 1.0 1.8 2.8 200 178 A 87 SER H A 87 SER HA 1.0 1.8 2.8 201 179 A 87 SER H A 87 SER HBx 1.0 1.8 4.0 202 180 A 87 SER H A 87 SER HBy 1.0 1.8 4.0 203 181 A 87 SER HA A 87 SER HBx 1.0 1.8 2.8 204 182 A 86 GLN H A 86 GLN HA 1.0 1.8 2.8 205 183 A 86 GLN H A 86 GLN HGx 1.0 1.8 4.0 206 184 A 86 GLN H A 86 GLN HGy 1.0 1.8 4.0 207 185 A 86 GLN H A 86 GLN HBx 1.0 1.8 5.0 208 186 A 86 GLN H A 86 GLN HBy 1.0 1.8 2.8 209 187 A 85 GLY HAx A 85 GLY HAy 1.0 1.8 2.5 210 188 A 83 ARG H A 83 ARG HA 1.0 1.8 2.8 211 189 A 82 ILE HA A 82 ILE HB 1.0 1.8 4.0 212 190 A 82 ILE HA A 82 ILE HG1x 1.0 1.8 4.0 213 191 A 81 LEU H A 81 LEU HA 1.0 1.8 2.8 214 192 A 81 LEU H A 80 ASP HBx 1.0 1.8 4.0 215 193 A 81 LEU H A 80 ASP HBy 1.0 1.8 4.0 216 194 A 82 ILE HG2% A 81 LEU H 1.0 1.8 6.0 217 195 A 82 ILE HD1% A 81 LEU H 1.0 1.8 6.0 218 196 A 81 LEU HDx% A 81 LEU H 1.0 1.8 4.0 219 197 A 81 LEU HDy% A 81 LEU H 1.0 1.8 4.0 220 198 A 81 LEU H A 81 LEU HG 1.0 1.8 4.0 221 199 A 81 LEU HA A 81 LEU HG 1.0 1.8 4.0 222 200 A 81 LEU HDx% A 81 LEU HA 1.0 1.8 4.0 223 201 A 81 LEU HDy% A 81 LEU HA 1.0 1.8 2.8 224 202 A 80 ASP H A 80 ASP HA 1.0 1.8 2.8 225 203 A 80 ASP HBx A 80 ASP H 1.0 1.8 2.8 226 204 A 80 ASP HBy A 80 ASP H 1.0 1.8 2.8 227 205 A 80 ASP HBx A 80 ASP HA 1.0 1.8 4.0 228 206 A 80 ASP HBy A 80 ASP HA 1.0 1.8 4.0 229 207 A 80 ASP H A 79 LEU HA 1.0 1.8 4.0 230 208 A 79 LEU HA A 79 LEU H 1.0 1.8 2.8 231 209 A 78 ARG HA A 79 LEU H 1.0 1.8 4.0 232 210 A 79 LEU H A 79 LEU HDx% 1.0 1.8 5.0 233 211 A 79 LEU H A 79 LEU HDx% 1.0 1.8 5.0 234 212 A 79 LEU H A 79 LEU HBy 1.0 1.8 2.8 235 213 A 79 LEU H A 79 LEU HG 1.0 2.8 5.0 236 214 A 76 MET H A 76 MET HA 1.0 1.8 2.8 237 215 A 76 MET H A 76 MET HG3 1.0 1.8 2.8 238 215 A 76 MET H A 76 MET HG2 1.0 1.8 2.8 239 216 A 76 MET HA A 76 MET HG3 1.0 1.8 4.0 240 216 A 76 MET HA A 76 MET HG2 1.0 1.8 4.0 241 217 A 75 VAL HA A 76 MET H 1.0 1.8 4.0 242 218 A 75 VAL HGy% A 75 VAL HGx% 1.0 1.8 4.0 243 219 A 75 VAL HA A 75 VAL HB 1.0 1.8 4.0 244 220 A 74 LYS H A 73 ALA HB% 1.0 1.8 4.0 245 221 A 73 ALA H A 73 ALA HB% 1.0 1.8 2.8 246 222 A 73 ALA H A 73 ALA HA 1.0 1.8 2.8 247 223 A 73 ALA HB% A 73 ALA HA 1.0 1.8 4.0 248 224 A 71 LEU H A 71 LEU HA 1.0 1.8 2.8 249 225 A 71 LEU H A 70 ASP HBx 1.0 1.8 4.0 250 226 A 71 LEU H A 70 ASP HBy 1.0 1.8 4.0 251 227 A 71 LEU H A 71 LEU HG 1.0 1.8 5.0 252 228 A 71 LEU H A 57 LEU HDx% 1.0 1.8 6.0 253 229 A 71 LEU HA A 71 LEU HD2% 1.0 1.8 2.8 254 229 A 71 LEU HD1% A 71 LEU HA 1.0 1.8 2.8 255 230 A 71 LEU HBy A 71 LEU HA 1.0 1.8 2.8 256 231 A 71 LEU HBx A 71 LEU HBy 1.0 1.8 2.5 257 232 A 71 LEU HBx A 71 LEU HD2% 1.0 1.8 4.0 258 232 A 71 LEU HBx A 71 LEU HD1% 1.0 1.8 4.0 259 233 A 71 LEU HBx A 57 LEU HDx% 1.0 1.8 4.0 260 234 A 66 ASP HA A 66 ASP HBy 1.0 1.8 2.8 261 235 A 69 GLY H A 69 GLY HAy 1.0 1.8 5.0 262 236 A 69 GLY H A 69 GLY HAx 1.0 1.8 5.0 263 237 A 67 VAL H A 66 ASP HBx 1.0 1.8 2.8 264 238 A 66 ASP HBy A 66 ASP H 1.0 1.8 4.0 265 239 A 66 ASP HBx A 66 ASP H 1.0 1.8 4.0 266 240 A 66 ASP HA A 66 ASP H 1.0 1.8 2.5 267 241 A 66 ASP HA A 66 ASP HBx 1.0 1.8 2.8 268 242 A 65 ASP H A 65 ASP HA 1.0 1.8 4.0 269 243 A 65 ASP H A 65 ASP HBy 1.0 1.8 4.0 270 244 A 65 ASP H A 65 ASP HBx 1.0 1.8 4.0 271 245 A 62 ALA H A 62 ALA HB% 1.0 1.8 5.0 272 246 A 62 ALA H A 62 ALA HA 1.0 1.8 2.8 273 247 A 62 ALA HB% A 62 ALA HA 1.0 1.8 4.0 274 248 A 60 ARG H A 59 LYS HA 1.0 1.8 4.0 275 249 A 59 LYS H A 59 LYS HA 1.0 1.8 2.8 276 250 A 47 LYS H A 47 LYS HA 1.0 1.8 2.8 277 251 A 59 LYS H A 58 VAL HB 1.0 1.8 2.8 278 252 A 58 VAL H A 58 VAL HGy% 1.0 1.8 4.0 279 253 A 58 VAL H A 58 VAL HGx% 1.0 1.8 4.0 280 254 A 58 VAL HA A 58 VAL HGy% 1.0 1.8 4.0 281 255 A 58 VAL HA A 58 VAL HGx% 1.0 1.8 4.0 282 256 A 57 LEU H A 57 LEU HA 1.0 1.8 4.0 283 257 A 14 ILE H A 13 GLU HA 1.0 1.8 4.0 284 258 A 57 LEU H A 56 LYS HA 1.0 1.8 4.0 285 259 A 54 VAL HA A 57 LEU H 1.0 1.8 4.0 286 260 A 2 SER H A 2 SER HBy 1.0 1.8 4.0 287 261 A 88 VAL H A 87 SER HBy 1.0 1.8 4.0 288 262 A 5 GLU H A 4 GLY HAx 1.0 1.8 2.8 289 262 A 4 GLY HAy A 5 GLU H 1.0 1.8 2.8 290 263 A 9 THR H A 9 THR HA 1.0 1.8 2.8 291 264 A 9 THR HB A 9 THR HG2% 1.0 1.8 4.0 292 265 A 10 ASP H A 9 THR HA 1.0 1.8 4.0 293 266 A 10 ASP H A 9 THR HB 1.0 1.8 4.0 294 267 A 10 ASP HBx A 10 ASP HA 1.0 1.8 4.0 295 268 A 10 ASP HBy A 10 ASP HA 1.0 1.8 4.0 296 269 A 58 VAL H A 58 VAL HA 1.0 1.8 4.0 297 270 A 13 GLU H A 12 SER HB3 1.0 1.8 2.8 298 270 A 12 SER HB2 A 13 GLU H 1.0 1.8 2.8 299 271 A 14 ILE HD1% A 14 ILE HA 1.0 1.8 4.0 300 272 A 14 ILE HG1y A 14 ILE HA 1.0 1.8 4.0 301 273 A 14 ILE HG1x A 14 ILE HA 1.0 1.8 4.0 302 274 A 14 ILE HD1% A 14 ILE HB 1.0 1.8 4.0 303 275 A 14 ILE HG1x A 14 ILE HD1% 1.0 1.8 4.0 304 276 A 14 ILE HG1y A 14 ILE HD1% 1.0 1.8 4.0 305 277 A 15 LEU HB3 A 15 LEU HD2% 1.0 1.8 4.0 306 277 A 15 LEU HD1% A 15 LEU HB2 1.0 1.8 4.0 307 277 A 15 LEU HD1% A 15 LEU HB3 1.0 1.8 4.0 308 277 A 15 LEU HB2 A 15 LEU HD2% 1.0 1.8 4.0 309 278 A 16 ASP HBy A 16 ASP H 1.0 1.8 2.8 310 279 A 16 ASP HBx A 16 ASP H 1.0 1.8 2.8 311 280 A 16 ASP HA A 16 ASP HBx 1.0 1.8 4.0 312 281 A 16 ASP HA A 16 ASP HBy 1.0 1.8 4.0 313 282 A 16 ASP HBx A 16 ASP HBy 1.0 1.8 2.5 314 283 A 17 HIS HBx A 17 HIS HA 1.0 1.8 4.0 315 284 A 17 HIS HBy A 17 HIS HA 1.0 1.8 4.0 316 285 A 17 HIS HBx A 17 HIS HBy 1.0 1.8 2.8 317 286 A 17 HIS HBy A 18 LEU H 1.0 1.8 4.0 318 287 A 17 HIS HBx A 18 LEU H 1.0 1.8 4.0 319 288 A 18 LEU HA A 21 PHE HBx 1.0 1.8 4.0 320 289 A 18 LEU H A 18 LEU HBy 1.0 1.8 2.8 321 289 A 18 LEU H A 18 LEU HBx 1.0 1.8 2.8 322 290 A 18 LEU H A 18 LEU HG 1.0 1.8 4.0 323 291 A 18 LEU HA A 18 LEU HBy 1.0 1.8 4.0 324 291 A 18 LEU HA A 18 LEU HBx 1.0 1.8 4.0 325 292 A 18 LEU HA A 18 LEU HG 1.0 1.8 4.0 326 293 A 18 LEU HA A 18 LEU HDx% 1.0 1.8 4.0 327 294 A 18 LEU HA A 18 LEU HDx% 1.0 1.8 4.0 328 295 A 18 LEU H A 18 LEU HDx% 1.0 1.8 5.0 329 296 A 18 LEU H A 79 LEU HDx% 1.0 1.8 5.0 330 297 A 18 LEU HDx% A 18 LEU HBy 1.0 1.8 4.0 331 298 A 18 LEU HG A 18 LEU HDx% 1.0 1.8 2.8 332 299 A 20 GLU HA A 20 GLU HBx 1.0 1.8 2.8 333 300 A 13 GLU HA A 13 GLU HG2 1.0 1.8 4.0 334 301 A 20 GLU HA A 20 GLU HGy 1.0 1.8 4.0 335 302 A 20 GLU HA A 20 GLU HGx 1.0 1.8 4.0 336 303 A 22 LEU H A 21 PHE HBx 1.0 1.8 4.0 337 304 A 22 LEU H A 21 PHE HBy 1.0 1.8 4.0 338 305 A 22 LEU HA A 22 LEU HD1% 1.0 1.8 5.0 339 306 A 22 LEU HA A 22 LEU HD2% 1.0 1.8 4.0 340 307 A 22 LEU HA A 22 LEU HD1% 1.0 1.8 5.0 341 308 A 23 ASP H A 23 ASP HA 1.0 1.8 4.0 342 309 A 23 ASP HBy A 23 ASP HA 1.0 1.8 4.0 343 310 A 23 ASP HBx A 23 ASP HA 1.0 1.8 4.0 344 311 A 24 LYS HA A 24 LYS HE2 1.0 1.8 4.0 345 311 A 24 LYS HA A 24 LYS HE3 1.0 1.8 4.0 346 312 A 24 LYS HA A 24 LYS HBy 1.0 1.8 4.0 347 313 A 24 LYS HA A 24 LYS HD2 1.0 1.8 4.0 348 313 A 24 LYS HA A 24 LYS HD3 1.0 1.8 4.0 349 314 A 24 LYS HA A 24 LYS HGx 1.0 1.8 4.0 350 315 A 24 LYS HA A 25 GLU H 1.0 1.8 4.0 351 316 A 28 ASP H A 28 ASP HBy 1.0 1.8 4.0 352 317 A 28 ASP H A 28 ASP HBx 1.0 1.8 4.0 353 318 A 29 SER HA A 29 SER HBx 1.0 1.8 2.8 354 319 A 31 ALA HB% A 31 ALA HA 1.0 1.8 4.0 355 320 A 32 VAL H A 32 VAL HA 1.0 1.8 2.8 356 321 A 32 VAL H A 31 ALA HA 1.0 1.8 4.0 357 322 A 32 VAL H A 32 VAL HB 1.0 1.8 2.8 358 323 A 32 VAL HGx% A 32 VAL HA 1.0 1.8 4.0 359 324 A 32 VAL HGy% A 32 VAL HA 1.0 1.8 4.0 360 325 A 32 VAL HGy% A 32 VAL HB 1.0 1.8 4.0 361 326 A 33 LYS H A 32 VAL HA 1.0 1.8 4.0 362 327 A 33 LYS H A 33 LYS HA 1.0 1.8 4.0 363 328 A 33 LYS H A 32 VAL HGy% 1.0 1.8 5.0 364 329 A 33 LYS H A 32 VAL HGx% 1.0 1.8 5.0 365 330 A 33 LYS HA A 33 LYS HBy 1.0 1.8 4.0 366 331 A 33 LYS HA A 33 LYS HDx 1.0 1.8 4.0 367 332 A 33 LYS HGx A 33 LYS HA 1.0 1.8 4.0 368 333 A 34 PHE HA A 35 GLU H 1.0 1.8 4.0 369 334 A 35 GLU H A 35 GLU HA 1.0 1.8 4.0 370 335 A 41 SER H A 41 SER HA 1.0 1.8 4.0 371 336 A 44 CYS HA A 45 LEU H 1.0 1.8 5.0 372 337 A 41 SER H A 41 SER HBx 1.0 1.8 4.0 373 338 A 41 SER H A 41 SER HBy 1.0 1.8 4.0 374 339 A 41 SER HA A 41 SER HBx 1.0 1.8 2.8 375 340 A 41 SER HA A 41 SER HBy 1.0 1.8 2.8 376 341 A 55 LYS H A 55 LYS HBy 1.0 1.8 2.5 377 341 A 55 LYS H A 55 LYS HBx 1.0 1.8 2.5 378 342 A 46 GLU H A 46 GLU HA 1.0 1.8 4.0 379 343 A 46 GLU H A 46 GLU HGx 1.0 1.8 4.0 380 343 A 46 GLU H A 46 GLU HGy 1.0 1.8 4.0 381 344 A 46 GLU HA A 46 GLU HGx 1.0 1.8 4.0 382 344 A 46 GLU HA A 46 GLU HGy 1.0 1.8 4.0 383 345 A 8 GLU HA A 8 GLU HGx 1.0 1.8 4.0 384 346 A 46 GLU HA A 46 GLU HBy 1.0 1.8 4.0 385 346 A 46 GLU HA A 46 GLU HBx 1.0 1.8 4.0 386 347 A 47 LYS H A 47 LYS HB2 1.0 2.5 3.5 387 347 A 47 LYS H A 47 LYS HB3 1.0 2.5 3.5 388 348 A 47 LYS H A 47 LYS HDy 1.0 1.8 2.8 389 348 A 47 LYS H A 47 LYS HDx 1.0 1.8 2.8 390 349 A 47 LYS HA A 47 LYS HB2 1.0 1.8 4.0 391 349 A 47 LYS HA A 47 LYS HB3 1.0 1.8 4.0 392 350 A 47 LYS HA A 47 LYS HDy 1.0 1.8 4.0 393 350 A 47 LYS HA A 47 LYS HDx 1.0 1.8 4.0 394 351 A 50 LEU HDy% A 50 LEU H 1.0 1.8 4.0 395 352 A 50 LEU HDx% A 50 LEU H 1.0 1.8 4.0 396 353 A 50 LEU HDy% A 50 LEU HA 1.0 1.8 4.0 397 354 A 50 LEU HDx% A 50 LEU HA 1.0 1.8 5.0 398 355 A 50 LEU HDx% A 50 LEU HDy% 1.0 1.8 4.0 399 356 A 54 VAL HA A 54 VAL H 1.0 1.8 4.0 400 357 A 53 ALA HB% A 54 VAL H 1.0 1.8 4.0 401 358 A 54 VAL HGx% A 54 VAL H 1.0 1.8 4.0 402 359 A 54 VAL HGy% A 54 VAL H 1.0 1.8 4.0 403 360 A 45 LEU H A 45 LEU HG 1.0 1.8 4.0 404 361 A 54 VAL HGy% A 55 LYS H 1.0 1.8 4.0 405 362 A 55 LYS H A 55 LYS HGx 1.0 1.8 4.0 406 363 A 56 LYS HA A 56 LYS H 1.0 1.8 2.8 407 364 A 56 LYS H A 55 LYS HA 1.0 1.8 5.0 408 365 A 56 LYS H A 56 LYS HBy 1.0 1.8 4.0 409 366 A 56 LYS H A 56 LYS HDy 1.0 1.8 2.8 410 366 A 56 LYS H A 56 LYS HDx 1.0 1.8 2.8 411 367 A 56 LYS H A 56 LYS HGx 1.0 1.8 5.0 412 368 A 56 LYS HA A 56 LYS HBy 1.0 1.8 4.0 413 369 A 56 LYS HA A 56 LYS HDy 1.0 1.8 2.8 414 370 A 56 LYS HA A 56 LYS HGx 1.0 1.8 2.8 415 371 A 56 LYS HGx A 56 LYS HDy 1.0 1.8 2.5 416 371 A 56 LYS HDx A 56 LYS HGx 1.0 1.8 2.5 417 372 A 55 LYS H A 55 LYS HA 1.0 1.8 2.8 418 373 A 54 VAL HA A 55 LYS H 1.0 1.8 4.0 419 374 A 44 CYS HA A 44 CYS HBy 1.0 1.8 4.0 420 375 A 44 CYS HA A 44 CYS HBx 1.0 1.8 4.0 421 376 A 44 CYS HBx A 44 CYS HBy 1.0 1.8 2.8 422 377 A 44 CYS HBx A 11 CYS HA 1.0 1.8 5.0 423 378 A 11 CYS HA A 11 CYS HBx 1.0 1.8 4.0 424 378 A 11 CYS HA A 11 CYS HBy 1.0 1.8 4.0 425 379 A 48 TYR HE% A 11 CYS HBx 1.0 1.8 5.0 426 379 A 48 TYR HE% A 11 CYS HBy 1.0 1.8 5.0 427 380 A 88 VAL H A 87 SER HA 1.0 1.8 2.5 428 381 A 34 PHE HA A 34 PHE HBy 1.0 1.8 4.0 429 382 A 57 LEU HA A 57 LEU HG 1.0 1.8 4.0 430 383 A 57 LEU HDx% A 57 LEU HA 1.0 1.8 4.0 431 384 A 57 LEU HDx% A 57 LEU HA 1.0 1.8 4.0 432 385 A 57 LEU HG A 57 LEU HBy 1.0 1.8 2.8 433 386 A 57 LEU HDx% A 57 LEU HBy 1.0 1.8 4.0 434 387 A 57 LEU HDx% A 57 LEU HBy 1.0 1.8 4.0 435 388 A 57 LEU HDx% A 57 LEU HG 1.0 1.8 4.0 436 389 A 59 LYS HA A 59 LYS HBx 1.0 1.8 2.8 437 390 A 59 LYS HA A 59 LYS HBy 1.0 1.8 4.0 438 391 A 59 LYS HA A 59 LYS HDy 1.0 1.8 4.0 439 392 A 60 ARG H A 60 ARG HD3 1.0 1.8 4.0 440 392 A 60 ARG H A 60 ARG HD2 1.0 1.8 4.0 441 393 A 96 ALA H A 95 ALA HA 1.0 1.8 4.0 442 394 A 19 TYR HA A 19 TYR HBy 1.0 1.8 4.0 443 395 A 19 TYR HA A 19 TYR HBx 1.0 1.8 4.0 444 396 A 19 TYR HBy A 19 TYR HBx 1.0 1.8 2.8 445 397 A 21 PHE HA A 21 PHE HBy 1.0 1.8 4.0 446 398 A 21 PHE HA A 21 PHE HBx 1.0 1.8 4.0 447 399 A 18 LEU HA A 21 PHE HBy 1.0 1.8 4.0 448 400 A 38 PHE HBx A 38 PHE HBy 1.0 1.8 2.8 449 401 A 34 PHE HA A 34 PHE HD% 1.0 1.8 4.0 450 402 A 38 PHE HA A 38 PHE HD% 1.0 1.8 4.0 451 403 A 34 PHE HA A 38 PHE HD% 1.0 1.8 4.0 452 404 A 21 PHE HD% A 21 PHE HA 1.0 1.8 4.0 453 405 A 19 TYR HA A 19 TYR HD% 1.0 1.8 4.0 454 406 A 19 TYR HBy A 19 TYR HD% 1.0 1.8 4.0 455 407 A 19 TYR HBx A 19 TYR HD% 1.0 1.8 4.0 456 408 A 48 TYR HBx A 48 TYR HD% 1.0 1.8 4.0 457 409 A 48 TYR HBy A 48 TYR HD% 1.0 1.8 4.0 458 410 A 48 TYR HD% A 47 LYS HA 1.0 1.8 5.0 459 411 A 48 TYR HD% A 45 LEU HA 1.0 1.8 5.0 460 412 A 46 GLU H A 45 LEU HA 1.0 1.8 5.0 461 413 A 44 CYS HA A 48 TYR HD% 1.0 1.8 6.0 462 414 A 82 ILE HB A 48 TYR HD% 1.0 1.8 5.0 463 415 A 38 PHE HBx A 38 PHE HD% 1.0 1.8 4.0 464 416 A 38 PHE HBy A 38 PHE HD% 1.0 1.8 4.0 465 417 A 47 LYS HA A 48 TYR H 1.0 1.8 4.0 466 418 A 34 PHE HD% A 34 PHE HBy 1.0 1.8 4.0 467 419 A 34 PHE HD% A 34 PHE HBx 1.0 1.8 4.0 468 420 A 48 TYR HBx A 48 TYR H 1.0 1.8 4.0 469 421 A 34 PHE HD% A 58 VAL HGy% 1.0 1.8 6.0 470 421 A 34 PHE HD% A 58 VAL HGx% 1.0 1.8 6.0 471 422 A 21 PHE HD% A 18 LEU HDx% 1.0 1.8 5.0 472 423 A 21 PHE HD% A 22 LEU HD2% 1.0 1.8 5.0 473 424 A 21 PHE HD% A 18 LEU HDx% 1.0 1.8 5.0 474 425 A 76 MET HA A 19 TYR HD% 1.0 1.8 4.0 475 426 A 20 GLU HA A 19 TYR HD% 1.0 1.8 4.0 476 427 A 13 GLU HA A 13 GLU H 1.0 1.8 2.8 477 428 A 20 GLU HA A 19 TYR HE% 1.0 1.8 5.0 478 429 A 19 TYR HD% A 19 TYR HE% 1.0 1.8 2.8 479 430 A 76 MET HA A 19 TYR HE% 1.0 1.8 5.0 480 431 A 79 LEU HBy A 19 TYR HD% 1.0 1.8 5.0 481 432 A 80 ASP H A 79 LEU HBy 1.0 1.8 4.0 482 433 A 79 LEU HBy A 19 TYR HE% 1.0 1.8 5.0 483 434 A 19 TYR HD% A 24 LYS HD2 1.0 1.8 4.0 484 434 A 24 LYS HD3 A 19 TYR HD% 1.0 1.8 4.0 485 435 A 23 ASP H A 24 LYS HD2 1.0 1.8 4.0 486 435 A 24 LYS HD3 A 23 ASP H 1.0 1.8 4.0 487 436 A 19 TYR HE% A 24 LYS HD2 1.0 1.8 4.0 488 436 A 24 LYS HD3 A 19 TYR HE% 1.0 1.8 4.0 489 437 A 19 TYR HD% A 79 LEU HDx% 1.0 1.8 5.0 490 438 A 80 ASP H A 79 LEU HDx% 1.0 1.8 5.0 491 439 A 94 ALA H A 94 ALA HB% 1.0 1.8 4.0 492 440 A 19 TYR H A 79 LEU HDx% 1.0 1.8 5.0 493 441 A 19 TYR HE% A 79 LEU HDx% 1.0 1.8 6.0 494 442 A 23 ASP HBx A 19 TYR HD% 1.0 1.8 5.0 495 443 A 23 ASP HBx A 19 TYR HE% 1.0 1.8 5.0 496 444 A 23 ASP HBy A 19 TYR HD% 1.0 1.8 5.0 497 445 A 23 ASP HBy A 19 TYR HE% 1.0 1.8 5.0 498 446 A 19 TYR HD% A 79 LEU HDx% 1.0 1.8 5.0 499 447 A 19 TYR HA A 19 TYR HE% 1.0 1.8 5.0 500 448 A 48 TYR HD% A 48 TYR HE% 1.0 1.8 2.8 501 449 A 48 TYR HBy A 48 TYR HE% 1.0 1.8 5.0 502 450 A 48 TYR HD% A 15 LEU HD2% 1.0 1.8 5.0 503 450 A 15 LEU HD1% A 48 TYR HD% 1.0 1.8 5.0 504 451 A 48 TYR HE% A 15 LEU HD2% 1.0 1.8 5.0 505 451 A 15 LEU HD1% A 48 TYR HE% 1.0 1.8 5.0 506 452 A 48 TYR HD% A 50 LEU HDx% 1.0 1.8 5.0 507 453 A 48 TYR HD% A 88 VAL HGx% 1.0 1.8 6.0 508 454 A 48 TYR HE% A 88 VAL HGx% 1.0 1.8 6.0 509 455 A 82 ILE H A 88 VAL HGx% 1.0 1.8 6.0 510 456 A 58 VAL HA A 38 PHE HE% 1.0 1.8 5.0 511 457 A 83 ARG HDx A 83 ARG HE 1.0 1.8 4.0 512 458 A 14 ILE HD1% A 38 PHE HD% 1.0 1.8 5.0 513 459 A 22 LEU H A 22 LEU HD2% 1.0 1.8 5.0 514 460 A 96 ALA HA A 96 ALA H 1.0 1.8 4.0 515 461 A 31 ALA HB% A 28 ASP HA 1.0 1.8 5.0 516 462 A 23 ASP HBy A 24 LYS HD2 1.0 1.8 4.0 517 462 A 23 ASP HBy A 24 LYS HD3 1.0 1.8 4.0 518 463 A 23 ASP HBx A 24 LYS HD2 1.0 1.8 4.0 519 463 A 23 ASP HBx A 24 LYS HD3 1.0 1.8 4.0 520 464 A 76 MET HA A 76 MET HBx 1.0 1.8 4.0 521 465 A 22 LEU HD1% A 22 LEU HG 1.0 1.8 4.0 522 466 A 15 LEU HD1% A 11 CYS HBy 1.0 1.8 5.0 523 466 A 11 CYS HBy A 15 LEU HD2% 1.0 1.8 5.0 524 467 A 15 LEU HD1% A 12 SER HB2 1.0 1.8 4.0 525 468 A 96 ALA HB% A 97 PRO HDy 1.0 1.8 4.0 526 469 A 59 LYS HEx A 71 LEU HD2% 1.0 1.8 4.0 527 469 A 71 LEU HD1% A 59 LYS HEx 1.0 1.8 4.0 528 470 A 18 LEU H A 18 LEU HDx% 1.0 1.8 5.0 529 471 A 19 TYR HA A 79 LEU HDx% 1.0 1.8 4.0 530 472 A 22 LEU H A 22 LEU HD1% 1.0 1.8 5.0 531 473 A 48 TYR HBy A 82 ILE HD1% 1.0 1.8 5.0 532 474 A 82 ILE HD1% A 79 LEU HA 1.0 1.8 4.0 533 475 A 71 LEU HBy A 71 LEU HD2% 1.0 1.8 2.8 534 475 A 71 LEU HD1% A 71 LEU HBy 1.0 1.8 2.8 535 476 A 71 LEU HG A 71 LEU HD2% 1.0 1.8 2.8 536 476 A 71 LEU HD1% A 71 LEU HG 1.0 1.8 2.8 537 477 A 79 LEU HBx A 79 LEU HDx% 1.0 1.8 4.0 538 478 A 45 LEU HDx% A 45 LEU HBy 1.0 1.8 4.0 539 479 A 79 LEU HBx A 79 LEU HDx% 1.0 1.8 4.0 540 480 A 81 LEU HDy% A 81 LEU HB3 1.0 1.8 4.0 541 481 A 57 LEU HDx% A 57 LEU HBx 1.0 1.8 4.0 542 482 A 57 LEU HDx% A 57 LEU HBx 1.0 1.8 4.0 543 483 A 50 LEU HDx% A 79 LEU HBx 1.0 1.8 4.0 544 484 A 45 LEU HG A 45 LEU HBx 1.0 1.8 2.8 545 485 A 14 ILE HG2% A 14 ILE HB 1.0 1.8 4.0 546 486 A 45 LEU HBy A 45 LEU HDy% 1.0 1.8 4.0 547 487 A 22 LEU HD1% A 22 LEU HB2 1.0 1.8 4.0 548 487 A 22 LEU HD1% A 22 LEU HB3 1.0 1.8 4.0 549 488 A 79 LEU HG A 79 LEU HDx% 1.0 1.8 4.0 550 489 A 81 LEU HDx% A 81 LEU HB3 1.0 1.8 4.0 551 490 A 54 VAL HGx% A 50 LEU HDx% 1.0 1.8 4.0 552 491 A 45 LEU HG A 45 LEU HDy% 1.0 1.8 4.0 553 492 A 45 LEU HDx% A 45 LEU HG 1.0 1.8 2.8 554 493 A 48 TYR HBy A 50 LEU HDy% 1.0 1.8 4.0 555 494 A 60 ARG HD3 A 60 ARG HG2 1.0 1.8 2.8 556 494 A 60 ARG HD2 A 60 ARG HG2 1.0 1.8 2.8 557 494 A 60 ARG HG3 A 60 ARG HD3 1.0 1.8 2.8 558 494 A 60 ARG HD2 A 60 ARG HG3 1.0 1.8 2.8 559 495 A 72 ARG HDx A 72 ARG HG3 1.0 1.8 2.8 560 495 A 72 ARG HDx A 72 ARG HG2 1.0 1.8 2.8 561 496 A 72 ARG HDy A 72 ARG HG3 1.0 1.8 2.8 562 496 A 72 ARG HG2 A 72 ARG HDy 1.0 1.8 2.8 563 497 A 51 GLU HBy A 51 GLU HGx 1.0 1.8 4.0 564 497 A 51 GLU HBx A 51 GLU HGx 1.0 1.8 4.0 565 498 A 81 LEU HG A 81 LEU HB2 1.0 1.8 2.8 566 499 A 79 LEU HBy A 79 LEU HG 1.0 1.8 2.8 567 500 A 45 LEU HA A 45 LEU HDy% 1.0 1.8 4.0 568 501 A 57 LEU HA A 71 LEU HD2% 1.0 1.8 4.0 569 501 A 71 LEU HD1% A 57 LEU HA 1.0 1.8 4.0 570 502 A 70 ASP HBy A 70 ASP HA 1.0 1.8 4.0 571 503 A 37 HIS HA A 37 HIS HBy 1.0 1.8 4.0 572 504 A 5 GLU HA A 6 PRO HDy 1.0 1.8 2.8 573 505 A 5 GLU HA A 6 PRO HDx 1.0 1.8 2.8 574 506 A 16 ASP HBy A 13 GLU HA 1.0 1.8 4.0 575 507 A 37 HIS HA A 37 HIS HBx 1.0 1.8 4.0 576 508 A 61 ALA H A 60 ARG HA 1.0 1.8 4.0 577 509 A 89 PRO HA A 90 GLU H 1.0 1.8 2.5 578 510 A 103 GLN H A 102 PRO HA 1.0 1.8 4.0 579 511 A 8 GLU HA A 8 GLU H 1.0 1.8 4.0 580 512 A 46 GLU HA A 50 LEU H 1.0 1.8 4.0 581 513 A 51 GLU H A 51 GLU HA 1.0 1.8 4.0 582 514 A 72 ARG H A 72 ARG HA 1.0 1.8 4.0 583 515 A 57 LEU HDx% A 38 PHE HD% 1.0 1.8 5.0 584 516 A 57 LEU HDx% A 38 PHE HD% 1.0 1.8 5.0 585 517 A 52 GLN HA A 55 LYS H 1.0 1.8 4.0 586 518 A 25 GLU H A 25 GLU HA 1.0 1.8 2.8 587 519 A 74 LYS H A 74 LYS HA 1.0 1.8 2.8 588 520 A 50 LEU H A 49 GLY HAx 1.0 1.8 2.8 589 521 A 99 SER HA A 99 SER HBx 1.0 1.8 2.8 590 522 A 88 VAL HA A 89 PRO HDx 1.0 1.8 2.8 591 523 A 20 GLU H A 19 TYR HBy 1.0 1.8 2.8 592 524 A 57 LEU HDx% A 72 ARG H 1.0 1.8 5.0 593 525 A 75 VAL HGx% A 76 MET H 1.0 1.8 4.0 594 526 A 72 ARG H A 71 LEU HD2% 1.0 1.8 5.0 595 526 A 71 LEU HD1% A 72 ARG H 1.0 1.8 5.0 596 527 A 75 VAL HGy% A 76 MET H 1.0 1.8 4.0 597 528 A 80 ASP H A 79 LEU HDx% 1.0 1.8 5.0 598 529 A 53 ALA H A 52 GLN HGx 1.0 1.8 4.0 599 530 A 53 ALA H A 52 GLN HGy 1.0 1.8 4.0 600 531 A 38 PHE HBx A 39 GLU H 1.0 1.8 4.0 601 532 A 53 ALA H A 52 GLN HA 1.0 1.8 4.0 602 533 A 14 ILE HA A 18 LEU H 1.0 1.8 4.0 603 534 A 77 GLY H A 74 LYS HA 1.0 1.8 4.0 604 535 A 67 VAL H A 68 PRO HDy 1.0 1.8 4.0 605 536 A 32 VAL HA A 35 GLU H 1.0 1.8 4.0 606 537 A 76 MET H A 73 ALA HA 1.0 1.8 4.0 607 538 A 71 LEU HA A 72 ARG H 1.0 1.8 4.0 608 539 A 99 SER HA A 99 SER H 1.0 1.8 4.0 609 540 A 81 LEU H A 80 ASP HA 1.0 1.8 4.0 610 541 A 64 GLN H A 64 GLN HA 1.0 1.8 4.0 611 542 A 58 VAL H A 57 LEU HA 1.0 1.8 4.0 612 543 A 44 CYS HBy A 45 LEU H 1.0 1.8 4.0 613 544 A 33 LYS HGx A 32 VAL H 1.0 1.8 4.0 614 545 A 55 LYS H A 55 LYS HGx 1.0 1.8 5.0 615 546 A 45 LEU HDx% A 45 LEU H 1.0 1.8 5.0 616 547 A 56 LYS H A 71 LEU HD2% 1.0 1.8 6.0 617 547 A 71 LEU HD1% A 56 LYS H 1.0 1.8 6.0 618 548 A 37 HIS HBy A 37 HIS HD2 1.0 1.8 5.0 619 549 A 37 HIS HBx A 37 HIS HD2 1.0 1.8 5.0 620 550 A 48 TYR HBy A 48 TYR H 1.0 1.8 4.0 621 551 A 17 HIS HBy A 17 HIS HD2 1.0 1.8 5.0 622 552 A 17 HIS HBx A 17 HIS HD2 1.0 1.8 5.0 623 553 A 34 PHE HA A 37 HIS HD2 1.0 1.8 5.0 624 554 A 16 ASP HA A 19 TYR HBy 1.0 1.8 4.0 625 555 A 70 ASP HBx A 70 ASP HA 1.0 1.8 2.8 626 556 A 83 ARG HDx A 80 ASP HA 1.0 1.8 4.0 627 557 A 73 ALA HB% A 70 ASP HA 1.0 1.8 5.0 628 558 A 66 ASP HA A 67 VAL HGy% 1.0 1.8 5.0 629 559 A 78 ARG HA A 81 LEU HDy% 1.0 1.8 5.0 630 560 A 45 LEU HG A 45 LEU HA 1.0 1.8 4.0 631 561 A 82 ILE HG2% A 79 LEU HA 1.0 1.8 5.0 632 562 A 45 LEU HG A 51 GLU HA 1.0 1.8 4.0 633 563 A 55 LYS HGx A 55 LYS HA 1.0 1.8 4.0 634 564 A 16 ASP HBx A 13 GLU HA 1.0 1.8 4.0 635 565 A 33 LYS HA A 36 HIS HB2 1.0 1.8 4.0 636 565 A 36 HIS HB3 A 33 LYS HA 1.0 1.8 4.0 637 566 A 83 ARG HDx A 83 ARG HDy 1.0 1.8 2.5 638 567 A 80 ASP HBx A 80 ASP HBy 1.0 1.8 2.5 639 568 A 44 CYS HBy A 14 ILE HG2% 1.0 1.8 5.0 640 569 A 71 LEU HD1% A 60 ARG HD3 1.0 1.8 5.0 641 569 A 60 ARG HD3 A 71 LEU HD2% 1.0 1.8 5.0 642 570 A 78 ARG HDx A 50 LEU HDy% 1.0 1.8 5.0 643 571 A 44 CYS HBx A 14 ILE HG2% 1.0 1.8 5.0 644 572 A 57 LEU HDx% A 34 PHE HBy 1.0 1.8 5.0 645 573 A 57 LEU HDx% A 34 PHE HBy 1.0 1.8 5.0 646 574 A 22 LEU HD1% A 76 MET HG3 1.0 1.8 5.0 647 574 A 76 MET HG2 A 22 LEU HD1% 1.0 1.8 5.0 648 575 A 18 LEU HDx% A 21 PHE HBx 1.0 1.8 5.0 649 576 A 22 LEU HD2% A 22 LEU HB2 1.0 1.8 4.0 650 576 A 22 LEU HD2% A 22 LEU HB3 1.0 1.8 4.0 651 577 A 81 LEU HDx% A 81 LEU HDy% 1.0 1.8 4.0 652 578 A 22 LEU HD1% A 22 LEU HD2% 1.0 1.8 5.0 653 579 A 96 ALA HB% A 96 ALA H 1.0 1.8 4.0 654 580 A 101 ALA HA A 102 PRO HDx 1.0 1.8 4.0 655 581 A 90 GLU HA A 90 GLU HGy 1.0 1.8 4.0 656 582 A 40 GLU HA A 40 GLU HGx 1.0 1.8 4.0 657 582 A 40 GLU HA A 40 GLU HGy 1.0 1.8 4.0 658 583 A 91 HIS HA A 91 HIS HBx 1.0 1.8 4.0 659 584 A 91 HIS HA A 91 HIS HBy 1.0 1.8 2.8 660 585 A 14 ILE HG2% A 11 CYS HA 1.0 1.8 5.0 661 586 A 14 ILE HD1% A 11 CYS HA 1.0 1.8 5.0 662 587 A 44 CYS HBy A 14 ILE HD1% 1.0 1.8 5.0 663 588 A 44 CYS HBx A 14 ILE HD1% 1.0 1.8 5.0 664 589 A 89 PRO HDy A 89 PRO HGx 1.0 1.8 4.0 665 590 A 54 VAL HGx% A 51 GLU HA 1.0 1.8 4.0 666 591 A 76 MET HG2 A 76 MET HBy 1.0 1.8 2.8 667 592 A 23 ASP HBy A 20 GLU HA 1.0 1.8 4.0 668 593 A 71 LEU HBy A 72 ARG H 1.0 1.8 5.0 669 594 A 73 ALA HB% A 72 ARG H 1.0 1.8 6.0 670 595 A 21 PHE HA A 21 PHE HE% 1.0 1.8 6.0 671 596 A 89 PRO HDy A 89 PRO HA 1.0 1.8 4.0 672 597 A 10 ASP H A 9 THR HG2% 1.0 1.8 5.0 673 598 A 54 VAL HGx% A 53 ALA H 1.0 1.8 5.0 674 599 A 54 VAL HGx% A 51 GLU H 1.0 1.8 5.0 675 600 A 76 MET H A 22 LEU HD1% 1.0 1.8 5.0 676 601 A 89 PRO HDx A 89 PRO HA 1.0 1.8 4.0 677 602 A 89 PRO HDx A 88 VAL HGx% 1.0 1.8 5.0 678 603 A 54 VAL HA A 54 VAL HB 1.0 1.8 4.0 679 604 A 102 PRO HDx A 102 PRO HDy 1.0 1.8 2.5 680 605 A 101 ALA HA A 102 PRO HDy 1.0 1.8 4.0 681 606 A 80 ASP H A 19 TYR HD% 1.0 1.8 5.0 682 607 A 80 ASP H A 19 TYR HE% 1.0 1.8 5.0 683 608 A 21 PHE HD% A 22 LEU H 1.0 1.8 4.0 684 609 A 20 GLU H A 19 TYR HD% 1.0 1.8 4.0 685 610 A 21 PHE HD% A 21 PHE H 1.0 1.8 4.0 686 611 A 96 ALA HB% A 97 PRO HDx 1.0 1.8 5.0 687 612 A 97 PRO HDy A 97 PRO HBy 1.0 1.8 4.0 688 613 A 97 PRO HDy A 97 PRO HG2 1.0 1.8 4.0 689 613 A 97 PRO HDy A 97 PRO HG3 1.0 1.8 4.0 690 614 A 97 PRO HDy A 97 PRO HBx 1.0 1.8 4.0 691 615 A 102 PRO HA A 102 PRO HDx 1.0 1.8 4.0 692 616 A 100 SER HA A 102 PRO HDx 1.0 1.8 4.0 693 617 A 43 PRO HBy A 43 PRO HA 1.0 1.8 2.8 694 618 A 43 PRO HA A 43 PRO HBx 1.0 1.8 4.0 695 619 A 43 PRO HA A 43 PRO HG2 1.0 1.8 2.8 696 619 A 43 PRO HA A 43 PRO HG3 1.0 1.8 2.8 697 620 A 43 PRO HBy A 43 PRO HG2 1.0 1.8 2.8 698 620 A 43 PRO HBy A 43 PRO HG3 1.0 1.8 2.8 699 621 A 43 PRO HBy A 43 PRO HBx 1.0 1.8 2.8 700 622 A 89 PRO HDy A 88 VAL HGy% 1.0 1.8 4.0 701 623 A 14 ILE HG2% A 14 ILE HA 1.0 1.8 4.0 702 624 A 59 LYS H A 55 LYS HA 1.0 1.8 5.0 703 625 A 26 MET H A 26 MET HA 1.0 1.8 4.0 704 626 A 49 GLY H A 49 GLY HAy 1.0 1.8 2.8 705 627 A 38 PHE HBy A 35 GLU HA 1.0 1.8 4.0 706 628 A 58 VAL H A 38 PHE HD% 1.0 1.8 5.0 707 629 A 38 PHE HD% A 17 HIS HE1 1.0 1.8 5.0 708 630 A 35 GLU H A 34 PHE HD% 1.0 1.8 5.0 709 631 A 47 LYS H A 48 TYR H 1.0 1.8 4.0 710 632 A 48 TYR HD% A 48 TYR H 1.0 1.8 4.0 711 633 A 48 TYR H A 49 GLY H 1.0 1.8 2.8 712 634 A 30 ASP H A 34 PHE HD% 1.0 1.8 5.0 713 635 A 104 GLU H A 104 GLU HA 1.0 1.8 4.0 714 636 A 94 ALA HA A 94 ALA HB% 1.0 1.8 2.8 715 637 A 45 LEU HA A 15 LEU HD2% 1.0 1.8 5.0 716 637 A 15 LEU HD1% A 45 LEU HA 1.0 1.8 5.0 717 638 A 44 CYS HBx A 45 LEU H 1.0 1.8 4.0 718 639 A 45 LEU H A 45 LEU HA 1.0 1.8 4.0 719 640 A 45 LEU H A 45 LEU HDy% 1.0 1.8 5.0 720 641 A 45 LEU H A 45 LEU HBy 1.0 1.8 4.0 721 642 A 82 ILE H A 82 ILE HG1x 1.0 1.8 4.0 722 643 A 82 ILE H A 82 ILE HG1x 1.0 1.8 4.0 723 644 A 45 LEU HG A 45 LEU HBy 1.0 1.8 4.0 724 645 A 50 LEU HA A 51 GLU H 1.0 1.8 4.0 725 646 A 28 ASP HA A 28 ASP HBy 1.0 1.8 2.8 726 647 A 28 ASP HA A 28 ASP HBx 1.0 1.8 4.0 727 648 A 77 GLY HAy A 78 ARG H 1.0 1.8 4.0 728 649 A 50 LEU H A 50 LEU HA 1.0 1.8 4.0 729 650 A 90 GLU HA A 99 SER H 1.0 1.8 4.0 730 651 A 99 SER HBy A 99 SER H 1.0 1.8 4.0 731 652 A 29 SER HA A 29 SER HBy 1.0 1.8 2.8 732 653 A 99 SER HBy A 99 SER HBx 1.0 1.8 2.5 733 654 A 49 GLY HAx A 49 GLY HAy 1.0 1.8 2.8 734 655 A 22 LEU HD2% A 72 ARG HG2 1.0 1.8 4.0 735 656 A 75 VAL HGy% A 74 LYS H 1.0 1.8 4.0 736 657 A 13 GLU HA A 13 GLU HG2 1.0 1.8 2.8 737 657 A 13 GLU HA A 13 GLU HG3 1.0 1.8 2.8 738 658 A 13 GLU HA A 13 GLU HB3 1.0 1.8 2.8 739 659 A 13 GLU HA A 13 GLU HB2 1.0 1.8 2.8 740 660 A 75 VAL HGy% A 78 ARG H 1.0 1.8 5.0 741 661 A 19 TYR HBx A 19 TYR HE% 1.0 1.8 5.0 742 662 A 80 ASP HBx A 19 TYR HE% 1.0 1.8 5.0 743 663 A 56 LYS H A 56 LYS HE2 1.0 1.8 5.0 744 664 A 68 PRO HA A 68 PRO HB2 1.0 1.8 2.8 745 664 A 68 PRO HA A 68 PRO HB3 1.0 1.8 2.8 746 665 A 37 HIS HBy A 37 HIS HE1 1.0 1.8 5.0 747 666 A 37 HIS HBx A 37 HIS HE1 1.0 1.8 5.0 748 667 A 37 HIS HD2 A 37 HIS HE1 1.0 1.8 5.0 749 668 A 37 HIS HE1 A 36 HIS HD2 1.0 1.8 5.0 750 669 A 36 HIS HD2 A 36 HIS HE1 1.0 1.8 5.0 751 670 A 36 HIS HD2 A 36 HIS HB2 1.0 1.8 4.0 752 670 A 36 HIS HB3 A 36 HIS HD2 1.0 1.8 4.0 753 671 A 7 HIS HA A 7 HIS HB2 1.0 1.8 4.0 754 671 A 7 HIS HB3 A 7 HIS HA 1.0 1.8 4.0 755 672 A 60 ARG HA A 60 ARG HD3 1.0 1.8 4.0 756 672 A 60 ARG HD2 A 60 ARG HA 1.0 1.8 4.0 757 673 A 36 HIS HA A 36 HIS HD2 1.0 1.8 5.0 758 674 A 36 HIS HE1 A 36 HIS HB2 1.0 1.8 5.0 759 674 A 36 HIS HB3 A 36 HIS HE1 1.0 1.8 5.0 760 675 A 14 ILE H A 10 ASP HBy 1.0 1.8 5.0 761 676 A 14 ILE H A 10 ASP HBx 1.0 1.8 5.0 762 677 A 37 HIS HA A 37 HIS HD2 1.0 1.8 5.0 763 678 A 70 ASP HBy A 70 ASP H 1.0 1.8 5.0 764 679 A 70 ASP HBx A 70 ASP HBy 1.0 1.8 2.5 765 680 A 37 HIS HBy A 37 HIS HBx 1.0 1.8 2.5 766 681 A 56 LYS HA A 56 LYS HE2 1.0 1.8 4.0 767 682 A 64 GLN HA A 64 GLN HGy 1.0 1.8 4.0 768 682 A 64 GLN HA A 64 GLN HGx 1.0 1.8 4.0 769 683 A 40 GLU H A 40 GLU HGx 1.0 1.8 2.8 770 683 A 40 GLU HGy A 40 GLU H 1.0 1.8 2.8 771 684 A 40 GLU HA A 40 GLU H 1.0 1.8 2.8 772 685 A 90 GLU HA A 90 GLU HGx 1.0 1.8 4.0 773 686 A 90 GLU HA A 90 GLU HBx 1.0 1.8 2.8 774 687 A 90 GLU HA A 90 GLU HBy 1.0 1.8 2.8 775 688 A 8 GLU HA A 8 GLU HGx 1.0 1.8 4.0 776 689 A 8 GLU HGx A 8 GLU H 1.0 1.8 5.0 777 690 A 8 GLU HGx A 8 GLU H 1.0 1.8 5.0 778 691 A 86 GLN HA A 86 GLN HBx 1.0 1.8 4.0 779 692 A 60 ARG HA A 60 ARG HBy 1.0 1.8 2.8 780 693 A 79 LEU HBy A 79 LEU HDx% 1.0 1.8 4.0 781 694 A 79 LEU HBy A 79 LEU HDx% 1.0 1.8 5.0 782 695 A 79 LEU H A 79 LEU HBx 1.0 1.8 2.8 783 696 A 86 GLN HA A 88 VAL HGx% 1.0 1.8 5.0 784 697 A 78 ARG HA A 81 LEU H 1.0 1.8 4.0 785 698 A 78 ARG HA A 88 VAL HGx% 1.0 1.8 5.0 786 699 A 82 ILE HA A 81 LEU HDx% 1.0 1.8 5.0 787 700 A 82 ILE HA A 88 VAL HGx% 1.0 1.8 5.0 788 701 A 78 ARG HDy A 88 VAL HGx% 1.0 1.8 5.0 789 702 A 78 ARG HDy A 88 VAL HGy% 1.0 1.8 5.0 790 703 A 19 TYR HBy A 79 LEU HDx% 1.0 1.8 5.0 791 704 A 78 ARG HDy A 50 LEU HDy% 1.0 1.8 5.0 792 705 A 78 ARG HDx A 88 VAL HGx% 1.0 1.8 5.0 793 706 A 19 TYR HBx A 79 LEU HDx% 1.0 1.8 5.0 794 707 A 19 TYR HBx A 79 LEU HDx% 1.0 1.8 5.0 795 708 A 34 PHE HBx A 58 VAL HGy% 1.0 1.8 5.0 796 709 A 14 ILE HG2% A 14 ILE HG1x 1.0 1.8 4.0 797 710 A 23 ASP HBy A 22 LEU HD2% 1.0 1.8 6.0 798 711 A 72 ARG H A 72 ARG HG3 1.0 1.8 4.0 799 711 A 72 ARG HG2 A 72 ARG H 1.0 1.8 4.0 800 712 A 56 LYS HE2 A 56 LYS HGx 1.0 1.8 4.0 801 713 A 33 LYS HGx A 33 LYS HA 1.0 1.8 4.0 802 714 A 33 LYS HGx A 33 LYS HEx 1.0 1.8 4.0 803 714 A 33 LYS HGx A 33 LYS HEy 1.0 1.8 4.0 804 715 A 33 LYS H A 33 LYS HGx 1.0 1.8 4.0 805 716 A 33 LYS HGx A 33 LYS HEx 1.0 1.8 4.0 806 716 A 33 LYS HGx A 33 LYS HEy 1.0 1.8 4.0 807 717 A 81 LEU H A 81 LEU HB3 1.0 1.8 5.0 808 718 A 81 LEU H A 81 LEU HB2 1.0 1.8 2.8 809 719 A 81 LEU HDy% A 86 GLN HGx 1.0 1.8 5.0 810 720 A 32 VAL HGy% A 33 LYS HA 1.0 1.8 5.0 811 721 A 66 ASP HBx A 67 VAL HGy% 1.0 1.8 5.0 812 721 A 67 VAL HGx% A 66 ASP HBx 1.0 1.8 5.0 813 722 A 32 VAL HA A 32 VAL HB 1.0 1.8 2.8 814 723 A 35 GLU HA A 35 GLU HGx 1.0 1.8 4.0 815 724 A 35 GLU HA A 35 GLU HGx 1.0 1.8 2.8 816 725 A 35 GLU HA A 35 GLU HBx 1.0 1.8 2.8 817 725 A 35 GLU HA A 35 GLU HBy 1.0 1.8 2.8 818 726 A 35 GLU HGx A 35 GLU HBx 1.0 1.8 4.0 819 726 A 35 GLU HGx A 35 GLU HBy 1.0 1.8 4.0 820 727 A 54 VAL HGy% A 38 PHE HBx 1.0 1.8 5.0 821 728 A 14 ILE HD1% A 38 PHE HBx 1.0 1.8 5.0 822 729 A 54 VAL HA A 57 LEU HG 1.0 1.8 4.0 823 730 A 45 LEU HDx% A 46 GLU H 1.0 1.8 6.0 824 731 A 59 LYS HGx A 60 ARG H 1.0 1.8 4.0 825 732 A 57 LEU HDx% A 56 LYS H 1.0 1.8 6.0 826 733 A 57 LEU HDx% A 56 LYS H 1.0 1.8 6.0 827 734 A 57 LEU HDx% A 60 ARG HD3 1.0 1.8 5.0 828 734 A 57 LEU HDx% A 60 ARG HD2 1.0 1.8 5.0 829 735 A 18 LEU HDx% A 21 PHE HBy 1.0 1.8 5.0 830 736 A 76 MET HG2 A 79 LEU HDx% 1.0 1.8 6.0 831 736 A 79 LEU HDx% A 76 MET HG3 1.0 1.8 6.0 832 737 A 81 LEU HDy% A 80 ASP HBy 1.0 1.8 6.0 833 738 A 66 ASP HBy A 67 VAL HGy% 1.0 1.8 5.0 834 739 A 22 LEU HD2% A 21 PHE HBy 1.0 1.8 5.0 835 740 A 46 GLU H A 46 GLU HGy 1.0 1.8 4.0 836 741 A 46 GLU H A 46 GLU HBx 1.0 1.8 4.0 837 742 A 46 GLU H A 46 GLU HBy 1.0 1.8 4.0 838 743 A 46 GLU H A 45 LEU HG 1.0 1.8 5.0 839 744 A 72 ARG H A 72 ARG HBy 1.0 1.8 2.8 840 745 A 75 VAL H A 75 VAL HB 1.0 1.8 2.8 841 746 A 57 LEU HDx% A 72 ARG H 1.0 1.8 6.0 842 747 A 72 ARG HG3 A 76 MET HG3 1.0 1.8 4.0 843 747 A 72 ARG HG2 A 76 MET HG3 1.0 1.8 4.0 844 747 A 76 MET HG2 A 72 ARG HG3 1.0 1.8 4.0 845 747 A 76 MET HG2 A 72 ARG HG2 1.0 1.8 4.0 846 748 A 61 ALA HB% A 64 GLN HGy 1.0 1.8 5.0 847 748 A 61 ALA HB% A 64 GLN HGx 1.0 1.8 5.0 848 749 A 54 VAL HB A 54 VAL H 1.0 1.8 5.0 849 750 A 72 ARG HDx A 72 ARG HDy 1.0 1.8 2.8 850 751 A 55 LYS HGx A 55 LYS HE2 1.0 1.8 4.0 851 751 A 55 LYS HGx A 55 LYS HE3 1.0 1.8 4.0 852 752 A 77 GLY HAx A 80 ASP HBy 1.0 1.8 4.0 853 753 A 80 ASP HBy A 19 TYR HE% 1.0 1.8 5.0 854 754 A 15 LEU HG A 15 LEU HB2 1.0 1.8 2.8 855 754 A 15 LEU HG A 15 LEU HB3 1.0 1.8 2.8 856 755 A 92 ASP HA A 92 ASP HBy 1.0 1.8 4.0 857 756 A 92 ASP HA A 92 ASP HBx 1.0 1.8 4.0 858 757 A 82 ILE HG2% A 83 ARG HBy 1.0 1.8 6.0 859 758 A 95 ALA HA A 95 ALA H 1.0 1.8 2.8 860 759 A 37 HIS HE1 A 36 HIS HB2 1.0 1.8 5.0 861 759 A 36 HIS HB3 A 37 HIS HE1 1.0 1.8 5.0 862 760 A 38 PHE HD% A 37 HIS HD2 1.0 1.8 4.0 863 761 A 37 HIS HD2 A 36 HIS HD2 1.0 1.8 4.0 864 762 A 37 HIS HD2 A 36 HIS HB2 1.0 1.8 5.0 865 762 A 36 HIS HB3 A 37 HIS HD2 1.0 1.8 5.0 866 763 A 21 PHE HD% A 37 HIS HBy 1.0 1.8 5.0 867 764 A 34 PHE HA A 37 HIS HBy 1.0 1.8 4.0 868 765 A 88 VAL HA A 89 PRO HGy 1.0 1.8 4.0 869 766 A 57 LEU HA A 60 ARG HD3 1.0 1.8 4.0 870 766 A 57 LEU HA A 60 ARG HD2 1.0 1.8 4.0 871 767 A 55 LYS HGx A 55 LYS HDy 1.0 1.8 4.0 872 767 A 55 LYS HGx A 55 LYS HDx 1.0 1.8 4.0 873 768 A 99 SER HBx A 99 SER H 1.0 1.8 4.0 874 769 A 24 LYS H A 23 ASP HA 1.0 1.8 4.0 875 770 A 24 LYS H A 20 GLU HA 1.0 1.8 4.0 876 771 A 75 VAL HA A 75 VAL H 1.0 1.8 4.0 877 772 A 44 CYS H A 43 PRO HBy 1.0 1.8 5.0 878 773 A 61 ALA H A 60 ARG HG2 1.0 1.8 4.0 879 773 A 61 ALA H A 60 ARG HG3 1.0 1.8 4.0 880 774 A 16 ASP HBx A 17 HIS HD2 1.0 1.8 5.0 881 775 A 80 ASP HA A 19 TYR HE% 1.0 1.8 5.0 882 776 A 16 ASP HA A 19 TYR HD% 1.0 1.8 5.0 883 777 A 54 VAL HA A 58 VAL H 1.0 1.8 4.0 884 778 A 55 LYS HDy A 55 LYS HE2 1.0 1.8 2.8 885 778 A 55 LYS HDx A 55 LYS HE2 1.0 1.8 2.8 886 778 A 55 LYS HE3 A 55 LYS HDy 1.0 1.8 2.8 887 778 A 55 LYS HE3 A 55 LYS HDx 1.0 1.8 2.8 888 779 A 55 LYS HGx A 55 LYS HE2 1.0 1.8 4.0 889 779 A 55 LYS HGx A 55 LYS HE3 1.0 1.8 4.0 890 780 A 24 LYS HD2 A 24 LYS HE2 1.0 1.8 4.0 891 780 A 24 LYS HD3 A 24 LYS HE2 1.0 1.8 4.0 892 780 A 24 LYS HE3 A 24 LYS HD2 1.0 1.8 4.0 893 780 A 24 LYS HD3 A 24 LYS HE3 1.0 1.8 4.0 894 781 A 24 LYS HGx A 24 LYS HE2 1.0 1.8 4.0 895 781 A 24 LYS HE3 A 24 LYS HGx 1.0 1.8 4.0 896 782 A 83 ARG HDy A 83 ARG HGx 1.0 1.8 2.8 897 783 A 83 ARG HDx A 83 ARG HGx 1.0 1.8 4.0 898 784 A 55 LYS HGx A 56 LYS HE2 1.0 1.8 4.0 899 785 A 20 GLU HA A 24 LYS HD2 1.0 1.8 4.0 900 785 A 24 LYS HD3 A 20 GLU HA 1.0 1.8 4.0 901 786 A 73 ALA HB% A 70 ASP HBx 1.0 1.8 5.0 902 787 A 46 GLU H A 45 LEU HDy% 1.0 1.8 6.0 903 788 A 53 ALA H A 45 LEU HDy% 1.0 1.8 6.0 904 789 A 53 ALA H A 52 GLN HB2 1.0 1.8 2.8 905 789 A 53 ALA H A 52 GLN HB3 1.0 1.8 2.8 906 790 A 77 GLY H A 22 LEU HD1% 1.0 1.8 6.0 907 791 A 75 VAL HGx% A 77 GLY H 1.0 1.8 6.0 908 792 A 45 LEU HDx% A 45 LEU HA 1.0 1.8 5.0 909 793 A 32 VAL HGx% A 29 SER HA 1.0 1.8 5.0 910 794 A 32 VAL HGx% A 31 ALA HA 1.0 1.8 5.0 911 795 A 79 LEU HG A 83 ARG HE 1.0 1.8 5.0 912 796 A 60 ARG HA A 60 ARG HBx 1.0 1.8 4.0 913 797 A 58 VAL HB A 55 LYS HA 1.0 1.8 5.0 914 798 A 53 ALA HB% A 50 LEU HA 1.0 1.8 4.0 915 799 A 46 GLU HBx A 43 PRO HA 1.0 1.8 4.0 916 800 A 37 HIS HA A 40 GLU H 1.0 1.8 4.0 917 801 A 17 HIS HA A 20 GLU HBy 1.0 1.8 5.0 918 802 A 94 ALA HB% A 91 HIS HA 1.0 1.8 4.0 919 803 A 79 LEU H A 76 MET HA 1.0 1.8 4.0 920 804 A 55 LYS H A 51 GLU HA 1.0 1.8 4.0 921 805 A 46 GLU H A 43 PRO HA 1.0 1.8 4.0 922 806 A 44 CYS H A 43 PRO HA 1.0 1.8 4.0 923 807 A 77 GLY HAy A 81 LEU H 1.0 1.8 5.0 924 808 A 77 GLY HAy A 80 ASP H 1.0 1.8 4.0 925 809 A 78 ARG H A 74 LYS HA 1.0 1.8 5.0 926 810 A 76 MET H A 72 ARG HA 1.0 1.8 4.0 927 811 A 71 LEU H A 68 PRO HA 1.0 1.8 5.0 928 812 A 46 GLU H A 8 GLU HGx 1.0 1.8 5.0 929 813 A 80 ASP HA A 83 ARG HE 1.0 1.8 5.0 930 814 A 80 ASP HA A 19 TYR HD% 1.0 1.8 5.0 931 815 A 82 ILE HD1% A 49 GLY HAy 1.0 1.8 6.0 932 816 A 45 LEU HBx A 15 LEU HD2% 1.0 1.8 5.0 933 816 A 15 LEU HD1% A 45 LEU HBx 1.0 1.8 5.0 934 817 A 48 TYR HBy A 82 ILE HG2% 1.0 1.8 6.0 935 818 A 82 ILE HD1% A 79 LEU HBx 1.0 1.8 6.0 936 819 A 82 ILE HG2% A 79 LEU HBx 1.0 1.8 6.0 937 820 A 96 ALA HA A 93 VAL HG2% 1.0 1.8 5.0 938 820 A 96 ALA HA A 93 VAL HG1% 1.0 1.8 5.0 939 821 A 54 VAL HGx% A 50 LEU HG 1.0 1.8 5.0 940 822 A 54 VAL HGx% A 18 LEU HG 1.0 1.8 5.0 941 823 A 54 VAL HGx% A 53 ALA HB% 1.0 1.8 6.0 942 824 A 14 ILE HG1y A 11 CYS HA 1.0 1.8 5.0 943 825 A 37 HIS HA A 37 HIS HE1 1.0 1.8 5.0 944 826 A 23 ASP HBy A 22 LEU HD1% 1.0 1.8 6.0 945 827 A 83 ARG HDx A 79 LEU HDx% 1.0 1.8 6.0 946 828 A 14 ILE HG2% A 40 GLU HGx 1.0 1.8 5.0 947 829 A 86 GLN HBx A 88 VAL HGy% 1.0 1.8 5.0 948 830 A 75 VAL H A 74 LYS HA 1.0 1.8 4.0 949 831 A 37 HIS HA A 17 HIS HE1 1.0 1.8 5.0 950 832 A 3 ALA HB% A 4 GLY HAx 1.0 1.8 5.0 951 832 A 3 ALA HB% A 4 GLY HAy 1.0 1.8 5.0 952 833 A 68 PRO HDx A 68 PRO HB2 1.0 1.8 4.0 953 833 A 68 PRO HDx A 68 PRO HB3 1.0 1.8 4.0 954 834 A 9 THR HG2% A 8 GLU HBy 1.0 1.8 5.0 955 835 A 81 LEU HDx% A 78 ARG H 1.0 1.8 5.0 956 836 A 89 PRO HDx A 89 PRO HGx 1.0 1.8 4.0 957 837 A 68 PRO HDx A 68 PRO HA 1.0 1.8 4.0 958 838 A 68 PRO HDy A 68 PRO HA 1.0 1.8 4.0 959 839 A 59 LYS H A 58 VAL HA 1.0 1.8 4.0 960 840 A 47 LYS H A 43 PRO HA 1.0 1.8 5.0 961 841 A 44 CYS HA A 47 LYS H 1.0 1.8 4.0 962 842 A 27 PRO HDy A 27 PRO HBy 1.0 1.8 5.0 963 843 A 67 VAL H A 67 VAL HB 1.0 1.8 5.0 964 844 A 54 VAL HB A 57 LEU HDx% 1.0 1.8 4.0 965 845 A 15 LEU H A 14 ILE HA 1.0 1.8 4.0 966 846 A 92 ASP HA A 93 VAL H 1.0 1.8 4.0 967 847 A 9 THR HG2% A 8 GLU HGx 1.0 1.8 6.0 968 848 A 58 VAL H A 58 VAL HGy% 1.0 1.8 4.0 969 848 A 58 VAL H A 58 VAL HGx% 1.0 1.8 4.0 970 849 A 84 SER H A 84 SER HA 1.0 1.8 2.8 971 850 A 84 SER H A 84 SER HBx 1.0 1.8 2.8 972 851 A 84 SER H A 84 SER HBy 1.0 1.8 2.8 973 852 A 71 LEU H A 70 ASP HA 1.0 1.8 4.0 974 853 A 31 ALA H A 30 ASP HBy 1.0 1.8 4.0 975 854 A 31 ALA H A 30 ASP HBx 1.0 1.8 4.0 976 855 A 16 ASP HA A 17 HIS H 1.0 1.8 4.0 977 856 A 79 LEU H A 79 LEU HDy% 1.0 1.8 4.0 978 856 A 79 LEU H A 79 LEU HDx% 1.0 1.8 4.0 979 857 A 18 LEU H A 18 LEU HA 1.0 1.8 2.8 980 858 A 14 ILE H A 14 ILE HB 1.0 1.8 2.5 981 859 A 82 ILE H A 82 ILE HG1y 1.0 1.8 4.0 982 859 A 82 ILE H A 82 ILE HG1x 1.0 1.8 4.0 983 860 A 91 HIS HA A 91 HIS H 1.0 1.8 4.0 984 861 A 91 HIS HBx A 91 HIS H 1.0 1.8 5.0 985 862 A 91 HIS HBy A 91 HIS H 1.0 1.8 5.0 986 863 A 7 HIS H A 7 HIS HA 1.0 1.8 4.0 987 864 A 60 ARG H A 60 ARG HBy 1.0 1.8 4.0 988 865 A 60 ARG H A 60 ARG HG2 1.0 1.8 2.8 989 865 A 60 ARG H A 60 ARG HG3 1.0 1.8 2.8 990 866 A 15 LEU HG A 16 ASP H 1.0 1.8 4.0 991 867 A 60 ARG H A 59 LYS HGy 1.0 1.8 4.0 992 867 A 59 LYS HGx A 60 ARG H 1.0 1.8 4.0 993 868 A 76 MET H A 76 MET HBx 1.0 1.8 4.0 994 869 A 74 LYS H A 74 LYS HBx 1.0 1.8 2.8 995 870 A 74 LYS H A 74 LYS HD2 1.0 1.8 4.0 996 870 A 74 LYS H A 74 LYS HD3 1.0 1.8 4.0 997 871 A 47 LYS H A 46 GLU HBy 1.0 2.5 3.5 998 871 A 47 LYS H A 46 GLU HBx 1.0 2.5 3.5 999 872 A 59 LYS H A 59 LYS HBx 1.0 1.8 2.5 1000 873 A 59 LYS H A 59 LYS HDy 1.0 1.8 4.0 1001 873 A 59 LYS H A 59 LYS HDx 1.0 1.8 4.0 1002 874 A 59 LYS H A 59 LYS HBy 1.0 1.8 2.8 1003 875 A 64 GLN H A 64 GLN HGx 1.0 1.8 4.0 1004 876 A 64 GLN H A 64 GLN HBx 1.0 1.8 4.0 1005 877 A 46 GLU H A 46 GLU HBy 1.0 1.8 2.8 1006 877 A 46 GLU H A 46 GLU HBx 1.0 1.8 2.8 1007 878 A 52 GLN HA A 52 GLN H 1.0 1.8 4.0 1008 879 A 39 GLU H A 39 GLU HA 1.0 1.8 4.0 1009 880 A 77 GLY HAx A 78 ARG H 1.0 1.8 4.0 1010 881 A 17 HIS H A 18 LEU H 1.0 1.8 2.8 1011 882 A 12 SER H A 13 GLU H 1.0 1.8 4.0 1012 883 A 14 ILE H A 13 GLU H 1.0 1.8 2.8 1013 884 A 15 LEU H A 14 ILE H 1.0 1.8 2.8 1014 885 A 19 TYR H A 20 GLU H 1.0 1.8 2.8 1015 886 A 23 ASP HBy A 23 ASP H 1.0 1.8 4.0 1016 887 A 23 ASP H A 22 LEU H 1.0 1.8 4.0 1017 888 A 24 LYS H A 23 ASP H 1.0 1.8 4.0 1018 889 A 24 LYS H A 25 GLU H 1.0 1.8 4.0 1019 890 A 25 GLU H A 26 MET H 1.0 1.8 4.0 1020 891 A 31 ALA H A 30 ASP H 1.0 1.8 4.0 1021 892 A 32 VAL H A 31 ALA H 1.0 1.8 4.0 1022 893 A 33 LYS H A 34 PHE H 1.0 1.8 4.0 1023 894 A 35 GLU H A 34 PHE H 1.0 1.8 4.0 1024 895 A 39 GLU H A 40 GLU H 1.0 1.8 4.0 1025 896 A 41 SER H A 40 GLU H 1.0 1.8 4.0 1026 897 A 41 SER H A 42 SER H 1.0 1.8 4.0 1027 898 A 44 CYS H A 45 LEU H 1.0 1.8 4.0 1028 899 A 45 LEU H A 46 GLU H 1.0 1.8 4.0 1029 900 A 47 LYS H A 46 GLU H 1.0 1.8 4.0 1030 901 A 47 LYS H A 49 GLY H 1.0 1.8 4.0 1031 902 A 50 LEU H A 49 GLY H 1.0 1.8 2.8 1032 903 A 50 LEU H A 51 GLU H 1.0 1.8 2.8 1033 904 A 51 GLU H A 52 GLN H 1.0 1.8 4.0 1034 905 A 54 VAL H A 52 GLN H 1.0 1.8 5.0 1035 906 A 53 ALA H A 54 VAL H 1.0 1.8 2.8 1036 907 A 55 LYS H A 54 VAL H 1.0 1.8 2.8 1037 908 A 55 LYS H A 56 LYS H 1.0 1.8 2.8 1038 909 A 57 LEU H A 56 LYS H 1.0 1.8 2.8 1039 910 A 57 LEU H A 58 VAL H 1.0 1.8 2.8 1040 911 A 59 LYS H A 60 ARG H 1.0 1.8 2.8 1041 912 A 61 ALA H A 60 ARG H 1.0 1.8 4.0 1042 913 A 67 VAL H A 66 ASP H 1.0 1.8 4.0 1043 914 A 71 LEU H A 72 ARG H 1.0 1.8 4.0 1044 915 A 73 ALA H A 72 ARG H 1.0 1.8 2.8 1045 916 A 73 ALA H A 74 LYS H 1.0 1.8 2.5 1046 917 A 75 VAL H A 74 LYS H 1.0 1.8 2.8 1047 918 A 77 GLY H A 76 MET H 1.0 1.8 2.8 1048 919 A 75 VAL H A 76 MET H 1.0 1.8 2.8 1049 920 A 77 GLY H A 78 ARG H 1.0 1.8 2.8 1050 921 A 78 ARG H A 79 LEU H 1.0 1.8 2.8 1051 922 A 79 LEU H A 19 TYR HE% 1.0 1.8 6.0 1052 923 A 77 GLY H A 79 LEU H 1.0 1.8 4.0 1053 924 A 81 LEU H A 80 ASP H 1.0 1.8 2.8 1054 925 A 82 ILE H A 81 LEU H 1.0 1.8 2.8 1055 926 A 82 ILE H A 83 ARG H 1.0 1.8 2.8 1056 927 A 83 ARG H A 84 SER H 1.0 1.8 2.8 1057 928 A 85 GLY H A 84 SER H 1.0 1.8 2.8 1058 929 A 57 LEU H A 55 LYS H 1.0 1.8 4.0 1059 930 A 87 SER H A 86 GLN H 1.0 1.8 4.0 1060 931 A 90 GLU H A 91 HIS H 1.0 1.8 5.0 1061 932 A 94 ALA H A 93 VAL H 1.0 1.8 4.0 1062 933 A 94 ALA H A 95 ALA H 1.0 1.8 4.0 1063 934 A 96 ALA H A 95 ALA H 1.0 1.8 4.0 1064 935 A 3 ALA HA A 3 ALA H 1.0 1.8 5.0 1065 936 A 94 ALA H A 93 VAL HG1% 1.0 1.8 4.0 1066 937 A 94 ALA H A 93 VAL HB 1.0 1.8 4.0 1067 938 A 94 ALA H A 93 VAL HA 1.0 1.8 4.0 1068 939 A 53 ALA H A 53 ALA HA 1.0 1.8 2.8 1069 940 A 61 ALA H A 61 ALA HA 1.0 1.8 2.8 1070 941 A 95 ALA H A 95 ALA HB% 1.0 1.8 4.0 1071 942 A 49 GLY HAx A 49 GLY H 1.0 1.8 2.8 1072 943 A 62 ALA HA A 63 GLY H 1.0 1.8 4.0 1073 944 A 63 GLY H A 63 GLY HAx 1.0 1.8 4.0 1074 945 A 63 GLY H A 63 GLY HAy 1.0 1.8 4.0 1075 946 A 62 ALA HB% A 63 GLY H 1.0 1.8 6.0 1076 947 A 85 GLY H A 84 SER HA 1.0 1.8 4.0 1077 948 A 29 SER H A 29 SER HBx 1.0 1.8 5.0 1078 949 A 29 SER H A 29 SER HBy 1.0 1.8 4.0 1079 950 A 41 SER H A 41 SER HBy 1.0 1.8 4.0 1080 950 A 41 SER H A 41 SER HBx 1.0 1.8 4.0 1081 951 A 41 SER H A 40 GLU HA 1.0 1.8 4.0 1082 952 A 42 SER H A 42 SER HBx 1.0 1.8 4.0 1083 953 A 42 SER HA A 42 SER H 1.0 1.8 4.0 1084 954 A 87 SER H A 87 SER HBy 1.0 1.8 2.8 1085 954 A 87 SER H A 87 SER HBx 1.0 1.8 2.8 1086 955 A 104 GLU HA A 105 SER H 1.0 1.8 4.0 1087 956 A 105 SER H A 105 SER HA 1.0 1.8 4.0 1088 957 A 10 ASP H A 10 ASP HA 1.0 1.8 4.0 1089 958 A 58 VAL HB A 58 VAL H 1.0 1.8 2.8 1090 959 A 65 ASP H A 64 GLN HA 1.0 2.5 3.5 1091 960 A 93 VAL H A 93 VAL HA 1.0 1.8 2.8 1092 961 A 93 VAL H A 93 VAL HB 1.0 1.8 2.8 1093 962 A 88 VAL H A 88 VAL HGy% 1.0 1.8 4.0 1094 962 A 88 VAL H A 88 VAL HGx% 1.0 1.8 4.0 1095 963 A 93 VAL H A 93 VAL HG2% 1.0 1.8 4.0 1096 963 A 93 VAL HG1% A 93 VAL H 1.0 1.8 4.0 1097 964 A 5 GLU H A 5 GLU HBy 1.0 1.8 2.8 1098 965 A 5 GLU H A 5 GLU HG2 1.0 1.8 4.0 1099 965 A 5 GLU H A 5 GLU HG3 1.0 1.8 4.0 1100 966 A 5 GLU H A 5 GLU HA 1.0 1.8 2.8 1101 967 A 5 GLU H A 5 GLU HBx 1.0 1.8 4.0 1102 968 A 14 ILE H A 13 GLU HG2 1.0 1.8 4.0 1103 968 A 14 ILE H A 13 GLU HG3 1.0 1.8 4.0 1104 969 A 13 GLU H A 13 GLU HG2 1.0 1.8 4.0 1105 969 A 13 GLU H A 13 GLU HG3 1.0 1.8 4.0 1106 970 A 13 GLU H A 13 GLU HB2 1.0 1.8 4.0 1107 971 A 15 LEU H A 15 LEU HB2 1.0 1.8 2.8 1108 971 A 15 LEU H A 15 LEU HB3 1.0 1.8 2.8 1109 972 A 15 LEU H A 14 ILE HB 1.0 1.8 2.8 1110 973 A 15 LEU H A 79 LEU HDx% 1.0 1.8 5.0 1111 974 A 16 ASP HA A 16 ASP H 1.0 1.8 2.8 1112 975 A 16 ASP H A 15 LEU HD2% 1.0 1.8 5.0 1113 975 A 15 LEU HD1% A 16 ASP H 1.0 1.8 5.0 1114 976 A 19 TYR H A 18 LEU HA 1.0 1.8 4.0 1115 977 A 20 GLU H A 19 TYR HBx 1.0 1.8 4.0 1116 978 A 19 TYR H A 18 LEU HBy 1.0 1.8 4.0 1117 979 A 34 PHE H A 34 PHE HBy 1.0 1.8 2.8 1118 979 A 34 PHE H A 34 PHE HBx 1.0 1.8 2.8 1119 980 A 26 MET H A 25 GLU HB2 1.0 1.8 2.8 1120 980 A 26 MET H A 25 GLU HB3 1.0 1.8 2.8 1121 981 A 21 PHE H A 20 GLU HBx 1.0 1.8 4.0 1122 982 A 21 PHE H A 20 GLU HBy 1.0 1.8 2.8 1123 983 A 24 LYS H A 24 LYS HBx 1.0 1.8 4.0 1124 984 A 24 LYS H A 24 LYS HGy 1.0 1.8 4.0 1125 984 A 24 LYS H A 24 LYS HGx 1.0 1.8 4.0 1126 985 A 24 LYS HBy A 25 GLU H 1.0 1.8 4.0 1127 986 A 25 GLU H A 24 LYS HBx 1.0 1.8 4.0 1128 987 A 28 ASP H A 27 PRO HA 1.0 1.8 4.0 1129 988 A 28 ASP H A 28 ASP HBy 1.0 1.8 4.0 1130 988 A 28 ASP H A 28 ASP HBx 1.0 1.8 4.0 1131 989 A 29 SER H A 28 ASP HBy 1.0 1.8 5.0 1132 989 A 29 SER H A 28 ASP HBx 1.0 1.8 5.0 1133 990 A 30 ASP H A 29 SER HA 1.0 1.8 4.0 1134 991 A 32 VAL H A 31 ALA HB% 1.0 1.8 4.0 1135 992 A 33 LYS H A 32 VAL HB 1.0 1.8 4.0 1136 993 A 38 PHE HBy A 39 GLU H 1.0 1.8 5.0 1137 994 A 40 GLU H A 39 GLU HA 1.0 1.8 4.0 1138 995 A 40 GLU H A 40 GLU HBx 1.0 1.8 2.8 1139 996 A 41 SER H A 40 GLU HGx 1.0 1.8 4.0 1140 996 A 41 SER H A 40 GLU HGy 1.0 1.8 4.0 1141 997 A 41 SER H A 40 GLU HBy 1.0 1.8 4.0 1142 998 A 41 SER H A 40 GLU HBx 1.0 1.8 4.0 1143 999 A 45 LEU H A 45 LEU HBx 1.0 1.8 4.0 1144 1000 A 47 LYS H A 46 GLU HGx 1.0 1.8 4.0 1145 1000 A 47 LYS H A 46 GLU HGy 1.0 1.8 4.0 1146 1001 A 50 LEU H A 49 GLY HAy 1.0 1.8 4.0 1147 1002 A 51 GLU H A 50 LEU HBy 1.0 1.8 4.0 1148 1003 A 53 ALA HA A 54 VAL H 1.0 1.8 4.0 1149 1004 A 54 VAL H A 51 GLU HA 1.0 1.8 4.0 1150 1005 A 56 LYS H A 56 LYS HGy 1.0 1.8 4.0 1151 1005 A 56 LYS H A 56 LYS HGx 1.0 1.8 4.0 1152 1006 A 57 LEU H A 57 LEU HBy 1.0 1.8 2.8 1153 1007 A 57 LEU H A 57 LEU HBx 1.0 1.8 4.0 1154 1008 A 58 VAL H A 57 LEU HBy 1.0 1.8 4.0 1155 1009 A 58 VAL H A 57 LEU HBx 1.0 1.8 4.0 1156 1010 A 58 VAL H A 57 LEU HG 1.0 1.8 4.0 1157 1011 A 60 ARG H A 57 LEU HA 1.0 1.8 4.0 1158 1012 A 61 ALA H A 60 ARG HBy 1.0 1.8 4.0 1159 1013 A 71 LEU HG A 72 ARG H 1.0 1.8 4.0 1160 1014 A 71 LEU HD1% A 72 ARG H 1.0 1.8 4.0 1161 1015 A 73 ALA H A 70 ASP HA 1.0 1.8 4.0 1162 1016 A 73 ALA H A 72 ARG HA 1.0 1.8 4.0 1163 1017 A 72 ARG H A 72 ARG HBx 1.0 1.8 2.8 1164 1018 A 82 ILE H A 81 LEU HB3 1.0 1.8 4.0 1165 1019 A 75 VAL H A 72 ARG HA 1.0 1.8 4.0 1166 1020 A 77 GLY H A 76 MET HBx 1.0 1.8 4.0 1167 1021 A 75 VAL HA A 78 ARG H 1.0 1.8 4.0 1168 1022 A 78 ARG H A 78 ARG HBy 1.0 1.8 2.8 1169 1022 A 78 ARG H A 78 ARG HBx 1.0 1.8 2.8 1170 1023 A 78 ARG H A 78 ARG HGy 1.0 1.8 4.0 1171 1023 A 78 ARG H A 78 ARG HGx 1.0 1.8 4.0 1172 1024 A 80 ASP H A 79 LEU HG 1.0 1.8 4.0 1173 1025 A 88 VAL H A 87 SER HBy 1.0 1.8 4.0 1174 1025 A 88 VAL H A 87 SER HBx 1.0 1.8 4.0 1175 1026 A 82 ILE H A 81 LEU HA 1.0 1.8 4.0 1176 1027 A 82 ILE H A 81 LEU HB2 1.0 1.8 2.8 1177 1028 A 83 ARG H A 80 ASP HA 1.0 1.8 4.0 1178 1029 A 83 ARG HBy A 84 SER H 1.0 1.8 4.0 1179 1030 A 84 SER H A 83 ARG HGx 1.0 1.8 4.0 1180 1031 A 85 GLY H A 82 ILE HA 1.0 1.8 4.0 1181 1032 A 87 SER H A 86 GLN HGx 1.0 1.8 5.0 1182 1033 A 87 SER H A 86 GLN HGy 1.0 1.8 5.0 1183 1034 A 55 LYS H A 55 LYS HDy 1.0 1.8 4.0 1184 1034 A 55 LYS H A 55 LYS HDx 1.0 1.8 4.0 1185 1035 A 90 GLU H A 90 GLU HGx 1.0 1.8 2.8 1186 1035 A 90 GLU H A 90 GLU HGy 1.0 1.8 2.8 1187 1036 A 90 GLU H A 90 GLU HBx 1.0 1.8 4.0 1188 1037 A 90 GLU HA A 91 HIS H 1.0 1.8 4.0 1189 1038 A 67 VAL H A 66 ASP HA 1.0 1.8 4.0 1190 1039 A 48 TYR H A 47 LYS HDy 1.0 1.8 4.0 1191 1039 A 47 LYS HDx A 48 TYR H 1.0 1.8 4.0 1192 1040 A 8 GLU H A 7 HIS HA 1.0 1.8 4.0 1193 1041 A 12 SER H A 12 SER HA 1.0 1.8 5.0 1194 1042 A 17 HIS H A 14 ILE HA 1.0 1.8 5.0 1195 1043 A 20 GLU H A 17 HIS HA 1.0 1.8 4.0 1196 1044 A 16 ASP HA A 20 GLU H 1.0 1.8 4.0 1197 1045 A 22 LEU H A 21 PHE HA 1.0 1.8 4.0 1198 1046 A 23 ASP H A 20 GLU HA 1.0 1.8 4.0 1199 1047 A 23 ASP H A 22 LEU HA 1.0 1.8 5.0 1200 1048 A 25 GLU HA A 26 MET H 1.0 1.8 4.0 1201 1049 A 48 TYR HBy A 49 GLY H 1.0 1.8 5.0 1202 1050 A 51 GLU HA A 52 GLN H 1.0 1.8 5.0 1203 1051 A 53 ALA H A 50 LEU HA 1.0 1.8 4.0 1204 1052 A 54 VAL HA A 56 LYS H 1.0 1.8 4.0 1205 1053 A 74 LYS H A 70 ASP HA 1.0 1.8 4.0 1206 1054 A 80 ASP HA A 84 SER H 1.0 1.8 4.0 1207 1055 A 85 GLY HAx A 86 GLN H 1.0 1.8 4.0 1208 1056 A 82 ILE HA A 84 SER H 1.0 1.8 5.0 1209 1057 A 94 ALA H A 91 HIS HA 1.0 1.8 4.0 1210 1058 A 66 ASP H A 67 VAL HGy% 1.0 1.8 5.0 1211 1058 A 67 VAL HGx% A 66 ASP H 1.0 1.8 5.0 1212 1059 A 60 ARG H A 58 VAL HA 1.0 1.8 4.0 1213 1060 A 55 LYS HGx A 52 GLN H 1.0 1.8 4.0 1214 1061 A 46 GLU HA A 51 GLU H 1.0 1.8 4.0 1215 1062 A 48 TYR HBx A 49 GLY H 1.0 1.8 4.0 1216 1063 A 35 GLU H A 34 PHE HBy 1.0 1.8 4.0 1217 1063 A 35 GLU H A 34 PHE HBx 1.0 1.8 4.0 1218 1064 A 22 LEU H A 21 PHE HBy 1.0 1.8 4.0 1219 1064 A 22 LEU H A 21 PHE HBx 1.0 1.8 4.0 1220 1065 A 19 TYR H A 79 LEU HDx% 1.0 1.8 4.0 1221 1066 A 7 HIS H A 6 PRO HA 1.0 1.8 4.0 1222 1067 A 52 GLN H A 52 GLN HGy 1.0 1.8 4.0 1223 1067 A 52 GLN H A 52 GLN HGx 1.0 1.8 4.0 1224 1068 A 52 GLN H A 52 GLN HB2 1.0 1.8 2.8 1225 1068 A 52 GLN HB3 A 52 GLN H 1.0 1.8 2.8 1226 1069 A 51 GLU HBx A 52 GLN H 1.0 1.8 4.0 1227 1070 A 19 TYR H A 18 LEU HDx% 1.0 1.8 5.0 1228 1071 A 25 GLU H A 25 GLU HB2 1.0 1.8 2.8 1229 1071 A 25 GLU H A 25 GLU HB3 1.0 1.8 2.8 1230 1072 A 28 ASP H A 28 ASP HA 1.0 1.8 4.0 1231 1073 A 35 GLU H A 35 GLU HGx 1.0 1.8 4.0 1232 1074 A 39 GLU H A 39 GLU HBy 1.0 1.8 2.8 1233 1074 A 39 GLU H A 39 GLU HBx 1.0 1.8 2.8 1234 1075 A 35 GLU H A 35 GLU HBx 1.0 1.8 2.8 1235 1075 A 35 GLU H A 35 GLU HBy 1.0 1.8 2.8 1236 1076 A 39 GLU H A 39 GLU HG2 1.0 1.8 4.0 1237 1076 A 39 GLU H A 39 GLU HG3 1.0 1.8 4.0 1238 1077 A 47 LYS H A 46 GLU HA 1.0 1.8 4.0 1239 1078 A 48 TYR H A 47 LYS HB2 1.0 1.8 4.0 1240 1078 A 47 LYS HB3 A 48 TYR H 1.0 1.8 4.0 1241 1079 A 50 LEU HDx% A 48 TYR H 1.0 1.8 5.0 1242 1080 A 50 LEU HDx% A 49 GLY H 1.0 1.8 6.0 1243 1081 A 51 GLU H A 46 GLU HGx 1.0 1.8 4.0 1244 1081 A 46 GLU HGy A 51 GLU H 1.0 1.8 4.0 1245 1082 A 51 GLU H A 51 GLU HGx 1.0 1.8 2.8 1246 1082 A 51 GLU H A 51 GLU HGy 1.0 1.8 2.8 1247 1083 A 51 GLU H A 51 GLU HBy 1.0 1.8 4.0 1248 1083 A 51 GLU HBx A 51 GLU H 1.0 1.8 4.0 1249 1084 A 54 VAL HGx% A 55 LYS H 1.0 1.8 5.0 1250 1085 A 90 GLU H A 90 GLU HBy 1.0 1.8 4.0 1251 1086 A 60 ARG H A 60 ARG HBx 1.0 1.8 4.0 1252 1087 A 82 ILE H A 15 LEU HD2% 1.0 1.8 6.0 1253 1087 A 82 ILE H A 15 LEU HD1% 1.0 1.8 6.0 1254 1088 A 18 LEU H A 15 LEU HD2% 1.0 1.8 6.0 1255 1088 A 15 LEU HD1% A 18 LEU H 1.0 1.8 6.0 1256 1089 A 19 TYR H A 15 LEU HD2% 1.0 1.8 6.0 1257 1089 A 19 TYR H A 15 LEU HD1% 1.0 1.8 6.0 1258 1090 A 12 SER H A 15 LEU HD2% 1.0 1.8 6.0 1259 1090 A 15 LEU HD1% A 12 SER H 1.0 1.8 6.0 1260 1091 A 23 ASP H A 22 LEU HD1% 1.0 1.8 6.0 1261 1092 A 46 GLU H A 6 PRO HDy 1.0 1.8 5.0 1262 1093 A 38 PHE HA A 39 GLU H 1.0 1.8 4.0 1263 1094 A 35 GLU H A 35 GLU HGx 1.0 1.8 4.0 1264 1095 A 33 LYS H A 33 LYS HDy 1.0 1.8 4.0 1265 1095 A 33 LYS H A 33 LYS HDx 1.0 1.8 4.0 1266 1096 A 31 ALA H A 30 ASP HA 1.0 1.8 4.0 1267 1097 A 12 SER H A 11 CYS HA 1.0 1.8 4.0 1268 1098 A 12 SER H A 11 CYS HBy 1.0 1.8 4.0 1269 1099 A 12 SER H A 11 CYS HBx 1.0 1.8 4.0 1270 1100 A 48 TYR HA A 48 TYR H 1.0 1.8 4.0 1271 1101 A 9 THR H A 8 GLU HGx 1.0 1.8 5.0 1272 1102 A 9 THR H A 8 GLU HBy 1.0 1.8 4.0 1273 1103 A 25 GLU H A 25 GLU HG2 1.0 1.8 4.0 1274 1103 A 25 GLU H A 25 GLU HG3 1.0 1.8 4.0 1275 1104 A 78 ARG H A 50 LEU HDy% 1.0 1.8 5.0 1276 1105 A 55 LYS H A 55 LYS HE2 1.0 1.8 5.0 1277 1105 A 55 LYS H A 55 LYS HE3 1.0 1.8 5.0 1278 1106 A 53 ALA H A 52 GLN HGy 1.0 1.8 5.0 1279 1106 A 53 ALA H A 52 GLN HGx 1.0 1.8 5.0 1280 1107 A 29 SER H A 28 ASP HA 1.0 1.8 5.0 1281 1108 A 33 LYS H A 32 VAL H 1.0 1.8 2.8 1282 1109 A 34 PHE HA A 34 PHE H 1.0 1.8 2.8 1283 1110 A 21 PHE H A 20 GLU HGx 1.0 1.8 5.0 1284 1111 A 21 PHE H A 20 GLU HGy 1.0 1.8 4.0 1285 1112 A 14 ILE H A 11 CYS HA 1.0 1.8 4.0 1286 1113 A 36 HIS HA A 39 GLU H 1.0 1.8 4.0 1287 1114 A 82 ILE HA A 83 ARG H 1.0 1.8 4.0 1288 1115 A 70 ASP HA A 70 ASP H 1.0 1.8 4.0 1289 1116 A 61 ALA H A 58 VAL HA 1.0 1.8 5.0 1290 1117 A 58 VAL H A 55 LYS HA 1.0 1.8 4.0 1291 1118 A 41 SER HA A 42 SER H 1.0 1.8 4.0 1292 1119 A 39 GLU HA A 42 SER H 1.0 1.8 4.0 1293 1120 A 31 ALA H A 28 ASP HA 1.0 1.8 4.0 1294 1121 A 24 LYS H A 22 LEU HA 1.0 1.8 5.0 1295 1122 A 24 LYS H A 25 GLU HA 1.0 1.8 5.0 1296 1123 A 22 LEU H A 19 TYR HA 1.0 1.8 4.0 1297 1124 A 16 ASP H A 12 SER HB3 1.0 1.8 4.0 1298 1124 A 12 SER HB2 A 16 ASP H 1.0 1.8 4.0 1299 1125 A 15 LEU H A 12 SER HB3 1.0 2.8 5.0 1300 1125 A 15 LEU H A 12 SER HB2 1.0 2.8 5.0 1301 1126 A 15 LEU H A 11 CYS HA 1.0 1.8 5.0 1302 1127 A 11 CYS HA A 13 GLU H 1.0 1.8 5.0 1303 1128 A 101 ALA HA A 104 GLU H 1.0 1.8 4.0 1304 1129 A 82 ILE H A 78 ARG HA 1.0 1.8 4.0 1305 1130 A 75 VAL HA A 79 LEU H 1.0 1.8 4.0 1306 1131 A 71 LEU H A 67 VAL HA 1.0 1.8 5.0 1307 1132 A 82 ILE H A 80 ASP H 1.0 1.8 4.0 1308 1133 A 55 LYS H A 38 PHE HD% 1.0 1.8 5.0 1309 1134 A 85 GLY H A 83 ARG H 1.0 1.8 5.0 1310 1135 A 83 ARG H A 81 LEU H 1.0 1.8 5.0 1311 1136 A 82 ILE H A 84 SER H 1.0 1.8 4.0 1312 1137 A 81 LEU H A 79 LEU H 1.0 1.8 5.0 1313 1138 A 76 MET H A 74 LYS H 1.0 1.8 4.0 1314 1139 A 78 ARG H A 76 MET H 1.0 1.8 5.0 1315 1140 A 77 GLY H A 75 VAL H 1.0 1.8 5.0 1316 1141 A 71 LEU H A 73 ALA H 1.0 1.8 4.0 1317 1142 A 71 LEU H A 70 ASP H 1.0 1.8 5.0 1318 1143 A 73 ALA H A 75 VAL H 1.0 1.8 4.0 1319 1144 A 78 ARG H A 80 ASP H 1.0 1.8 4.0 1320 1145 A 80 ASP H A 79 LEU H 1.0 1.8 2.8 1321 1146 A 74 LYS H A 72 ARG H 1.0 1.8 5.0 1322 1147 A 59 LYS H A 61 ALA H 1.0 1.8 5.0 1323 1148 A 58 VAL H A 56 LYS H 1.0 1.8 4.0 1324 1149 A 53 ALA H A 55 LYS H 1.0 1.8 4.0 1325 1150 A 53 ALA H A 51 GLU H 1.0 1.8 4.0 1326 1151 A 51 GLU H A 49 GLY H 1.0 1.8 4.0 1327 1152 A 50 LEU H A 48 TYR H 1.0 1.8 4.0 1328 1153 A 44 CYS H A 46 GLU H 1.0 1.8 5.0 1329 1154 A 46 GLU H A 48 TYR H 1.0 1.8 5.0 1330 1155 A 38 PHE HD% A 39 GLU H 1.0 1.8 6.0 1331 1156 A 39 GLU H A 38 PHE H 1.0 1.8 4.0 1332 1157 A 22 LEU H A 21 PHE H 1.0 1.8 2.5 1333 1158 A 32 VAL H A 34 PHE H 1.0 1.8 4.0 1334 1159 A 29 SER H A 28 ASP H 1.0 1.8 5.0 1335 1160 A 24 LYS H A 22 LEU H 1.0 1.8 5.0 1336 1161 A 23 ASP H A 21 PHE H 1.0 1.8 4.0 1337 1162 A 19 TYR H A 21 PHE H 1.0 1.8 4.0 1338 1163 A 19 TYR H A 17 HIS H 1.0 1.8 4.0 1339 1164 A 16 ASP H A 18 LEU H 1.0 1.8 5.0 1340 1165 A 17 HIS H A 16 ASP H 1.0 2.5 3.5 1341 1166 A 14 ILE H A 16 ASP H 1.0 1.8 4.0 1342 1167 A 15 LEU H A 13 GLU H 1.0 1.8 4.0 1343 1168 A 14 ILE H A 12 SER H 1.0 1.8 5.0 1344 1169 A 38 PHE HA A 38 PHE H 1.0 1.8 4.0 1345 1170 A 54 VAL HGx% A 57 LEU H 1.0 1.8 6.0 1346 1171 A 4 GLY H A 2 SER HA 1.0 1.8 4.0 1347 1172 A 3 ALA HA A 4 GLY H 1.0 1.8 5.0 1348 1173 A 9 THR H A 8 GLU HBx 1.0 1.8 5.0 1349 1174 A 95 ALA H A 93 VAL HA 1.0 1.8 4.0 1350 1175 A 95 ALA H A 92 ASP HBy 1.0 1.8 5.0 1351 1175 A 95 ALA H A 92 ASP HBx 1.0 1.8 5.0 1352 1176 A 94 ALA H A 92 ASP HBy 1.0 1.8 5.0 1353 1177 A 93 VAL H A 92 ASP HBy 1.0 1.8 4.0 1354 1178 A 93 VAL H A 92 ASP HBx 1.0 1.8 4.0 1355 1179 A 24 LYS H A 27 PRO HDy 1.0 1.8 5.0 1356 1180 A 23 ASP H A 22 LEU HG 1.0 1.8 4.0 1357 1181 A 71 LEU H A 68 PRO HDx 1.0 1.8 5.0 1358 1182 A 55 LYS HGx A 56 LYS H 1.0 1.8 5.0 1359 1183 A 68 PRO HA A 70 ASP H 1.0 1.8 4.0 1360 1184 A 67 VAL H A 60 ARG HG2 1.0 1.8 4.0 1361 1184 A 67 VAL H A 60 ARG HG3 1.0 1.8 4.0 1362 1185 A 66 ASP H A 64 GLN HA 1.0 1.8 4.0 1363 1186 A 66 ASP H A 64 GLN HGy 1.0 1.8 5.0 1364 1186 A 66 ASP H A 64 GLN HGx 1.0 1.8 5.0 1365 1187 A 65 ASP H A 60 ARG HA 1.0 1.8 4.0 1366 1188 A 64 GLN H A 63 GLY HAy 1.0 1.8 4.0 1367 1189 A 61 ALA H A 60 ARG HD3 1.0 1.8 5.0 1368 1189 A 61 ALA H A 60 ARG HD2 1.0 1.8 5.0 1369 1190 A 47 LYS H A 45 LEU H 1.0 1.8 5.0 1370 1191 A 61 ALA H A 31 ALA H 1.0 1.8 4.0 1371 1192 A 95 ALA H A 93 VAL HG2% 1.0 1.8 6.0 1372 1192 A 95 ALA H A 93 VAL HG1% 1.0 1.8 6.0 1373 1193 A 92 ASP HA A 92 ASP H 1.0 1.8 4.0 1374 1194 A 92 ASP H A 92 ASP HBy 1.0 1.8 5.0 1375 1195 A 92 ASP HBx A 92 ASP H 1.0 1.8 4.0 1376 1196 A 95 ALA HA A 95 ALA HB% 1.0 1.8 2.8 1377 1197 A 93 VAL HB A 93 VAL HA 1.0 1.8 4.0 1378 1198 A 93 VAL HG1% A 93 VAL HA 1.0 1.8 4.0 1379 1199 A 105 SER HA A 105 SER HBx 1.0 1.8 2.8 1380 1200 A 67 VAL HA A 67 VAL HB 1.0 1.8 5.0 1381 1201 A 104 GLU HA A 104 GLU HG2 1.0 1.8 6.0 1382 1201 A 104 GLU HA A 104 GLU HG3 1.0 1.8 6.0 1383 1202 A 104 GLU HA A 104 GLU HBy 1.0 1.8 5.0 1384 1203 A 103 GLN HA A 103 GLN HBx 1.0 1.8 4.0 1385 1204 A 103 GLN HA A 103 GLN HBy 1.0 1.8 4.0 1386 1205 A 90 GLU HA A 90 GLU HGx 1.0 1.8 4.0 1387 1205 A 90 GLU HA A 90 GLU HGy 1.0 1.8 4.0 1388 1206 A 90 GLU HBx A 90 GLU HGx 1.0 1.8 2.5 1389 1207 A 103 GLN HBx A 103 GLN HGx 1.0 1.8 2.5 1390 1208 A 103 GLN HBy A 103 GLN HGx 1.0 1.8 2.8 1391 1209 A 102 PRO HA A 102 PRO HB2 1.0 1.8 2.8 1392 1209 A 102 PRO HA A 102 PRO HB3 1.0 1.8 2.8 1393 1210 A 102 PRO HA A 97 PRO HG2 1.0 1.8 4.0 1394 1210 A 102 PRO HA A 97 PRO HG3 1.0 1.8 4.0 1395 1211 A 102 PRO HA A 102 PRO HGx 1.0 1.8 2.8 1396 1212 A 102 PRO HA A 102 PRO HGy 1.0 1.8 5.0 1397 1213 A 102 PRO HGy A 102 PRO HB2 1.0 1.8 2.5 1398 1213 A 102 PRO HB3 A 102 PRO HGy 1.0 1.8 2.5 1399 1214 A 93 VAL HB A 93 VAL HG2% 1.0 1.8 4.0 1400 1214 A 93 VAL HG1% A 93 VAL HB 1.0 1.8 4.0 1401 1215 A 87 SER HA A 87 SER HBy 1.0 1.8 4.0 1402 1216 A 86 GLN HA A 86 GLN HGx 1.0 1.8 5.0 1403 1217 A 86 GLN HA A 86 GLN HGy 1.0 1.8 4.0 1404 1218 A 84 SER HBx A 84 SER HBy 1.0 1.8 4.0 1405 1219 A 83 ARG HBy A 83 ARG HGx 1.0 1.8 4.0 1406 1220 A 83 ARG HBy A 83 ARG HA 1.0 1.8 2.8 1407 1221 A 82 ILE HB A 82 ILE HG1x 1.0 1.8 5.0 1408 1222 A 81 LEU HDx% A 81 LEU HB2 1.0 1.8 5.0 1409 1223 A 81 LEU HDy% A 81 LEU HB2 1.0 1.8 5.0 1410 1224 A 81 LEU HG A 81 LEU HB3 1.0 1.8 4.0 1411 1225 A 75 VAL HGy% A 75 VAL HB 1.0 1.8 5.0 1412 1226 A 75 VAL HGx% A 75 VAL HB 1.0 1.8 5.0 1413 1227 A 72 ARG HA A 72 ARG HG3 1.0 1.8 4.0 1414 1228 A 72 ARG HBx A 72 ARG HG3 1.0 1.8 5.0 1415 1229 A 64 GLN HA A 64 GLN HBx 1.0 1.8 4.0 1416 1230 A 64 GLN HA A 64 GLN HBy 1.0 1.8 4.0 1417 1231 A 64 GLN HBx A 64 GLN HGy 1.0 1.8 2.5 1418 1231 A 64 GLN HGx A 64 GLN HBx 1.0 1.8 2.5 1419 1232 A 64 GLN HBy A 64 GLN HGy 1.0 1.8 4.0 1420 1232 A 64 GLN HGx A 64 GLN HBy 1.0 1.8 4.0 1421 1233 A 64 GLN HBy A 64 GLN HGy 1.0 1.8 2.8 1422 1234 A 63 GLY HAx A 63 GLY HAy 1.0 1.8 5.0 1423 1235 A 60 ARG HD2 A 60 ARG HG3 1.0 1.8 2.8 1424 1235 A 60 ARG HD2 A 60 ARG HG2 1.0 1.8 2.8 1425 1236 A 60 ARG HBx A 60 ARG HG2 1.0 1.8 4.0 1426 1236 A 60 ARG HG3 A 60 ARG HBx 1.0 1.8 4.0 1427 1237 A 60 ARG HBy A 60 ARG HG2 1.0 1.8 2.8 1428 1237 A 60 ARG HG3 A 60 ARG HBy 1.0 1.8 2.8 1429 1238 A 59 LYS HA A 59 LYS HGy 1.0 1.8 4.0 1430 1238 A 59 LYS HGx A 59 LYS HA 1.0 1.8 4.0 1431 1239 A 59 LYS HA A 59 LYS HDy 1.0 1.8 4.0 1432 1239 A 59 LYS HA A 59 LYS HDx 1.0 1.8 4.0 1433 1240 A 59 LYS HBy A 59 LYS HEx 1.0 1.8 2.5 1434 1241 A 59 LYS HEx A 59 LYS HGy 1.0 1.8 2.8 1435 1241 A 59 LYS HGx A 59 LYS HEx 1.0 1.8 2.8 1436 1242 A 59 LYS HBx A 59 LYS HGy 1.0 1.8 4.0 1437 1242 A 59 LYS HGx A 59 LYS HBx 1.0 1.8 4.0 1438 1243 A 59 LYS HBx A 59 LYS HDy 1.0 1.8 4.0 1439 1243 A 59 LYS HBx A 59 LYS HDx 1.0 1.8 4.0 1440 1244 A 58 VAL HA A 58 VAL HGy% 1.0 1.8 4.0 1441 1244 A 58 VAL HA A 58 VAL HGx% 1.0 1.8 4.0 1442 1245 A 58 VAL HB A 58 VAL HA 1.0 1.8 4.0 1443 1246 A 58 VAL HB A 58 VAL HGy% 1.0 1.8 4.0 1444 1246 A 58 VAL HB A 58 VAL HGx% 1.0 1.8 4.0 1445 1247 A 52 GLN HA A 52 GLN HB2 1.0 1.8 2.8 1446 1247 A 52 GLN HA A 52 GLN HB3 1.0 1.8 2.8 1447 1248 A 52 GLN HA A 52 GLN HGy 1.0 1.8 4.0 1448 1248 A 52 GLN HA A 52 GLN HGx 1.0 1.8 4.0 1449 1249 A 51 GLU HA A 51 GLU HGx 1.0 1.8 2.8 1450 1249 A 51 GLU HA A 51 GLU HGy 1.0 1.8 2.8 1451 1250 A 51 GLU HA A 51 GLU HBy 1.0 1.8 2.8 1452 1250 A 51 GLU HBx A 51 GLU HA 1.0 1.8 2.8 1453 1251 A 54 VAL HGx% A 50 LEU HBy 1.0 1.8 6.0 1454 1251 A 54 VAL HGx% A 50 LEU HBx 1.0 1.8 6.0 1455 1252 A 50 LEU HDy% A 50 LEU HBy 1.0 1.8 6.0 1456 1252 A 50 LEU HDy% A 50 LEU HBx 1.0 1.8 6.0 1457 1253 A 50 LEU HDx% A 50 LEU HBy 1.0 1.8 5.0 1458 1254 A 47 LYS HDy A 47 LYS HEx 1.0 1.8 6.0 1459 1254 A 47 LYS HDx A 47 LYS HEx 1.0 1.8 6.0 1460 1254 A 47 LYS HEy A 47 LYS HDy 1.0 1.8 6.0 1461 1254 A 47 LYS HDx A 47 LYS HEy 1.0 1.8 6.0 1462 1255 A 47 LYS HB2 A 47 LYS HDy 1.0 1.8 2.8 1463 1255 A 47 LYS HB3 A 47 LYS HDy 1.0 1.8 2.8 1464 1255 A 47 LYS HDx A 47 LYS HB2 1.0 1.8 2.8 1465 1255 A 47 LYS HB3 A 47 LYS HDx 1.0 1.8 2.8 1466 1256 A 46 GLU HGy A 46 GLU HBy 1.0 1.8 2.8 1467 1256 A 46 GLU HGy A 46 GLU HBx 1.0 1.8 2.8 1468 1257 A 44 CYS HBy A 15 LEU HD2% 1.0 1.8 6.0 1469 1257 A 44 CYS HBy A 15 LEU HD1% 1.0 1.8 6.0 1470 1258 A 41 SER HA A 41 SER HBy 1.0 1.8 4.0 1471 1258 A 41 SER HA A 41 SER HBx 1.0 1.8 4.0 1472 1259 A 40 GLU HA A 40 GLU HGx 1.0 1.8 4.0 1473 1260 A 40 GLU HA A 40 GLU HBy 1.0 1.8 2.8 1474 1261 A 40 GLU HA A 40 GLU HBx 1.0 1.8 2.8 1475 1262 A 40 GLU HBx A 40 GLU HGx 1.0 1.8 2.5 1476 1262 A 40 GLU HGy A 40 GLU HBx 1.0 1.8 2.5 1477 1263 A 40 GLU HBy A 40 GLU HGx 1.0 1.8 2.8 1478 1264 A 40 GLU HBy A 40 GLU HGx 1.0 1.8 2.5 1479 1264 A 40 GLU HGy A 40 GLU HBy 1.0 1.8 2.5 1480 1265 A 39 GLU HA A 39 GLU HG2 1.0 1.8 4.0 1481 1265 A 39 GLU HA A 39 GLU HG3 1.0 1.8 4.0 1482 1266 A 105 SER HA A 103 GLN HGx 1.0 1.8 6.0 1483 1267 A 33 LYS HGx A 33 LYS HDy 1.0 1.8 2.5 1484 1267 A 33 LYS HGx A 33 LYS HDx 1.0 1.8 2.5 1485 1268 A 32 VAL HGy% A 33 LYS HDy 1.0 1.8 5.0 1486 1269 A 33 LYS HA A 33 LYS HBy 1.0 1.8 5.0 1487 1269 A 33 LYS HBx A 33 LYS HA 1.0 1.8 5.0 1488 1270 A 32 VAL HA A 35 GLU HBx 1.0 1.8 4.0 1489 1270 A 32 VAL HA A 35 GLU HBy 1.0 1.8 4.0 1490 1271 A 31 ALA HA A 34 PHE HBy 1.0 1.8 5.0 1491 1271 A 31 ALA HA A 34 PHE HBx 1.0 1.8 5.0 1492 1272 A 29 SER HBx A 29 SER HBy 1.0 1.8 2.5 1493 1273 A 15 LEU HD1% A 11 CYS HBx 1.0 1.8 6.0 1494 1273 A 11 CYS HBx A 15 LEU HD2% 1.0 1.8 6.0 1495 1274 A 62 ALA HB% A 63 GLY HAy 1.0 1.8 6.0 1496 1275 A 3 ALA HA A 5 GLU HA 1.0 1.8 6.0 1497 1276 A 5 GLU HA A 5 GLU HBy 1.0 1.8 4.0 1498 1277 A 5 GLU HA A 5 GLU HBx 1.0 1.8 5.0 1499 1278 A 20 GLU HGx A 20 GLU HBy 1.0 1.8 4.0 1500 1279 A 5 GLU HBx A 5 GLU HG2 1.0 1.8 2.8 1501 1279 A 5 GLU HG3 A 5 GLU HBx 1.0 1.8 2.8 1502 1280 A 5 GLU HBy A 5 GLU HG2 1.0 1.8 4.0 1503 1281 A 5 GLU HBy A 5 GLU HBx 1.0 1.8 2.5 1504 1282 A 6 PRO HA A 6 PRO HBy 1.0 1.8 4.0 1505 1283 A 6 PRO HA A 6 PRO HBx 1.0 1.8 4.0 1506 1284 A 10 ASP HBx A 10 ASP HBy 1.0 1.8 2.5 1507 1285 A 25 GLU HA A 25 GLU HB2 1.0 1.8 4.0 1508 1285 A 25 GLU HA A 25 GLU HB3 1.0 1.8 4.0 1509 1286 A 71 LEU HBx A 22 LEU HD1% 1.0 1.8 5.0 1510 1287 A 43 PRO HA A 43 PRO HD2 1.0 1.8 6.0 1511 1287 A 43 PRO HA A 43 PRO HD3 1.0 1.8 6.0 1512 1288 A 6 PRO HDy A 6 PRO HDx 1.0 1.8 2.5 1513 1289 A 76 MET HA A 76 MET HBy 1.0 1.8 2.8 1514 1290 A 96 ALA HB% A 93 VAL HA 1.0 1.8 6.0 1515 1291 A 73 ALA HA A 76 MET HBx 1.0 1.8 5.0 1516 1292 A 73 ALA HA A 76 MET HBy 1.0 1.8 4.0 1517 1293 A 89 PRO HDx A 88 VAL HB 1.0 1.8 5.0 1518 1294 A 6 PRO HDx A 6 PRO HBy 1.0 1.8 5.0 1519 1295 A 6 PRO HDx A 6 PRO HBx 1.0 1.8 2.8 1520 1296 A 6 PRO HDx A 6 PRO HG2 1.0 1.8 5.0 1521 1296 A 6 PRO HDx A 6 PRO HG3 1.0 1.8 5.0 1522 1297 A 6 PRO HDy A 6 PRO HBy 1.0 1.8 5.0 1523 1298 A 6 PRO HBy A 6 PRO HBx 1.0 1.8 2.8 1524 1299 A 6 PRO HBy A 6 PRO HG2 1.0 1.8 2.8 1525 1299 A 6 PRO HBy A 6 PRO HG3 1.0 1.8 2.8 1526 1300 A 9 THR HB A 9 THR HG1 1.0 1.8 4.0 1527 1301 A 9 THR HB A 8 GLU HBy 1.0 1.8 6.0 1528 1302 A 9 THR HA A 9 THR HG1 1.0 1.8 4.0 1529 1303 A 96 ALA HA A 97 PRO HBy 1.0 1.8 6.0 1530 1304 A 94 ALA HA A 97 PRO HBx 1.0 1.8 6.0 1531 1305 A 29 SER HA A 29 SER HG 1.0 1.8 4.0 1532 1306 A 67 VAL HB A 60 ARG HD3 1.0 1.8 5.0 1533 1306 A 67 VAL HB A 60 ARG HD2 1.0 1.8 5.0 1534 1307 A 65 ASP HBx A 59 LYS HGy 1.0 1.8 5.0 1535 1307 A 59 LYS HGx A 65 ASP HBx 1.0 1.8 5.0 1536 1308 A 76 MET H A 75 VAL HB 1.0 1.8 4.0 1537 1309 A 76 MET HBy A 76 MET HG3 1.0 1.8 2.8 1538 1309 A 76 MET HG2 A 76 MET HBy 1.0 1.8 2.8 1539 1310 A 76 MET HBx A 76 MET HG3 1.0 1.8 4.0 1540 1310 A 76 MET HG2 A 76 MET HBx 1.0 1.8 4.0 1541 1311 A 55 LYS H A 55 LYS HBx 1.0 1.8 4.0 1542 1312 A 55 LYS H A 55 LYS HBy 1.0 1.8 4.0 1543 1313 A 19 TYR HE% A 76 MET HBy 1.0 1.8 5.0 1544 1314 A 36 HIS HD2 A 35 GLU HBx 1.0 1.8 5.0 1545 1314 A 36 HIS HD2 A 35 GLU HBy 1.0 1.8 5.0 1546 1315 A 19 TYR HE% A 76 MET HBx 1.0 1.8 5.0 1547 1316 A 19 TYR HBy A 19 TYR HE% 1.0 1.8 5.0 1548 1317 A 21 PHE HD% A 22 LEU HB2 1.0 1.8 4.0 1549 1317 A 21 PHE HD% A 22 LEU HB3 1.0 1.8 4.0 1550 1318 A 45 LEU HA A 45 LEU HBy 1.0 1.8 4.0 1551 1319 A 38 PHE HBx A 35 GLU HA 1.0 1.8 4.0 1552 1320 A 35 GLU HA A 34 PHE HBx 1.0 1.8 5.0 1553 1321 A 57 LEU HBy A 38 PHE HD% 1.0 1.8 4.0 1554 1322 A 54 VAL HB A 38 PHE HD% 1.0 1.8 4.0 1555 1323 A 13 GLU H A 13 GLU HB3 1.0 1.8 4.0 1556 1324 A 13 GLU H A 13 GLU HG2 1.0 1.8 4.0 1557 1325 A 14 ILE H A 13 GLU HB2 1.0 1.8 4.0 1558 1326 A 14 ILE H A 13 GLU HB3 1.0 1.8 4.0 1559 1327 A 78 ARG H A 78 ARG HBx 1.0 1.8 4.0 1560 1328 A 87 SER H A 86 GLN HBx 1.0 1.8 4.0 1561 1329 A 8 GLU H A 8 GLU HBy 1.0 2.5 3.5 1562 1330 A 83 ARG HBy A 83 ARG HDx 1.0 1.8 4.0 1563 1331 A 83 ARG HBy A 83 ARG HDy 1.0 1.8 4.0 1564 1332 A 78 ARG HDy A 78 ARG HGx 1.0 1.8 4.0 1565 1333 A 78 ARG HDy A 78 ARG HGy 1.0 1.8 4.0 1566 1334 A 78 ARG HDy A 78 ARG HBy 1.0 1.8 4.0 1567 1335 A 78 ARG HDx A 78 ARG HBx 1.0 1.8 4.0 1568 1336 A 78 ARG HDx A 78 ARG HGy 1.0 1.8 4.0 1569 1337 A 78 ARG HDx A 78 ARG HGx 1.0 1.8 4.0 1570 1338 A 72 ARG HDx A 72 ARG HBy 1.0 1.8 4.0 1571 1339 A 72 ARG HDx A 72 ARG HBx 1.0 1.8 4.0 1572 1340 A 72 ARG HDy A 72 ARG HBy 1.0 1.8 4.0 1573 1341 A 72 ARG HDy A 72 ARG HBx 1.0 1.8 4.0 1574 1342 A 60 ARG HBx A 60 ARG HD3 1.0 1.8 4.0 1575 1342 A 60 ARG HD2 A 60 ARG HBx 1.0 1.8 4.0 1576 1343 A 60 ARG HBy A 60 ARG HD3 1.0 1.8 4.0 1577 1343 A 60 ARG HD2 A 60 ARG HBy 1.0 1.8 4.0 1578 1344 A 60 ARG HA A 60 ARG HG2 1.0 2.5 3.5 1579 1344 A 60 ARG HG3 A 60 ARG HA 1.0 2.5 3.5 1580 1345 A 83 ARG HBy A 83 ARG HA 1.0 1.8 2.8 1581 1346 A 83 ARG HBy A 83 ARG HDx 1.0 1.8 4.0 1582 1347 A 83 ARG H A 83 ARG HGy 1.0 1.8 2.8 1583 1347 A 83 ARG H A 83 ARG HGx 1.0 1.8 2.8 1584 1348 A 20 GLU HGx A 20 GLU HBx 1.0 1.8 4.0 1585 1349 A 68 PRO HDx A 68 PRO HGx 1.0 1.8 2.8 1586 1350 A 23 ASP HBx A 24 LYS HBy 1.0 1.8 4.0 1587 1351 A 74 LYS HA A 74 LYS HBy 1.0 1.8 2.8 1588 1352 A 74 LYS H A 74 LYS HBy 1.0 1.8 2.8 1589 1353 A 54 VAL HA A 57 LEU HBy 1.0 1.8 2.8 1590 1354 A 89 PRO HDy A 89 PRO HGy 1.0 1.8 2.8 1591 1355 A 89 PRO HDx A 89 PRO HGy 1.0 1.8 2.8 1592 1356 A 40 GLU H A 40 GLU HBy 1.0 1.8 4.0 1593 1357 A 61 ALA H A 60 ARG HBx 1.0 1.8 4.0 1594 1358 A 22 LEU HA A 22 LEU HG 1.0 1.8 4.0 1595 1359 A 22 LEU H A 22 LEU HG 1.0 2.8 5.0 1596 1360 A 56 LYS H A 56 LYS HBx 1.0 1.8 4.0 1597 1361 A 77 GLY H A 76 MET HBy 1.0 1.8 4.0 1598 1362 A 90 GLU H A 90 GLU HGy 1.0 1.8 4.0 1599 1363 A 81 LEU H A 78 ARG HBx 1.0 1.8 5.0 1600 1364 A 81 LEU H A 78 ARG HBy 1.0 1.8 5.0 1601 1365 A 104 GLU H A 104 GLU HBy 1.0 1.8 2.8 1602 1366 A 79 LEU HBy A 76 MET HA 1.0 1.8 4.0 1603 1367 A 79 LEU HA A 79 LEU HBy 1.0 1.8 4.0 1604 1368 A 8 GLU HGx A 6 PRO HDy 1.0 1.8 4.0 1605 1369 A 8 GLU HGx A 6 PRO HDy 1.0 1.8 4.0 1606 1370 A 24 LYS HA A 24 LYS HBx 1.0 1.8 2.8 1607 1371 A 57 LEU HA A 57 LEU HBy 1.0 1.8 2.8 1608 1372 A 57 LEU HA A 57 LEU HBx 1.0 1.8 4.0 1609 1373 A 72 ARG HA A 72 ARG HBx 1.0 1.8 2.8 1610 1374 A 54 VAL HA A 57 LEU HBx 1.0 1.8 4.0 1611 1375 A 88 VAL H A 88 VAL HB 1.0 1.8 4.0 1612 1376 A 12 SER H A 11 CYS HBx 1.0 1.8 5.0 1613 1376 A 12 SER H A 11 CYS HBy 1.0 1.8 5.0 1614 1377 A 17 HIS HA A 18 LEU H 1.0 1.8 4.0 1615 1378 A 44 CYS H A 11 CYS HA 1.0 1.8 5.0 1616 1379 A 48 TYR HE% A 11 CYS HA 1.0 1.8 6.0 1617 1380 A 17 HIS HA A 17 HIS HD2 1.0 1.8 4.0 1618 1381 A 16 ASP HBy A 17 HIS HD2 1.0 1.8 5.0 1619 1382 A 44 CYS HA A 48 TYR HE% 1.0 1.8 5.0 1620 1383 A 72 ARG HDy A 76 MET HBy 1.0 1.8 4.0 1621 1384 A 83 ARG HE A 83 ARG HDy 1.0 1.8 4.0 1622 1385 A 83 ARG HE A 83 ARG HGx 1.0 1.8 4.0 1623 1386 A 83 ARG HBy A 80 ASP HA 1.0 1.8 4.0 1624 1387 A 77 GLY HAy A 80 ASP HBx 1.0 1.8 4.0 1625 1388 A 72 ARG HA A 72 ARG HBy 1.0 1.8 2.8 1626 1389 A 71 LEU HA A 74 LYS HBx 1.0 1.8 2.8 1627 1390 A 38 PHE HD% A 37 HIS HA 1.0 1.8 5.0 1628 1391 A 72 ARG HBx A 76 MET HG3 1.0 1.8 4.0 1629 1391 A 76 MET HG2 A 72 ARG HBx 1.0 1.8 4.0 1630 1392 A 23 ASP HBy A 23 ASP HBx 1.0 1.8 2.8 1631 1393 A 56 LYS HA A 56 LYS HBx 1.0 1.8 2.8 1632 1394 A 5 GLU HA A 5 GLU HG2 1.0 1.8 5.0 1633 1394 A 5 GLU HA A 5 GLU HG3 1.0 1.8 5.0 1634 1395 A 5 GLU HBy A 5 GLU HG2 1.0 1.8 4.0 1635 1395 A 5 GLU HBy A 5 GLU HG3 1.0 1.8 4.0 1636 1396 A 6 PRO HA A 6 PRO HG2 1.0 1.8 4.0 1637 1396 A 6 PRO HA A 6 PRO HG3 1.0 1.8 4.0 1638 1397 A 103 GLN H A 103 GLN HGy 1.0 1.8 5.0 1639 1397 A 103 GLN H A 103 GLN HGx 1.0 1.8 5.0 1640 1398 A 68 PRO HDy A 65 ASP HA 1.0 1.8 6.0 1641 1399 A 89 PRO HDx A 89 PRO HBx 1.0 1.8 4.0 1642 1400 A 89 PRO HDy A 89 PRO HBx 1.0 1.8 4.0 1643 1401 A 68 PRO HGy A 68 PRO HB2 1.0 1.8 2.5 1644 1401 A 68 PRO HB3 A 68 PRO HGy 1.0 1.8 2.5 1645 1402 A 68 PRO HDy A 68 PRO HGx 1.0 1.8 2.8 1646 1403 A 57 LEU HDx% A 72 ARG HG3 1.0 1.8 4.0 1647 1403 A 57 LEU HDx% A 72 ARG HG2 1.0 1.8 4.0 1648 1404 A 60 ARG H A 60 ARG HA 1.0 1.8 4.0 1649 1405 A 57 LEU H A 57 LEU HG 1.0 1.8 5.0 1650 1406 A 20 GLU H A 20 GLU HBy 1.0 1.8 4.0 1651 1407 A 34 PHE H A 34 PHE HBy 1.0 1.8 4.0 1652 1408 A 34 PHE H A 34 PHE HBx 1.0 1.8 4.0 1653 1409 A 55 LYS HBx A 56 LYS H 1.0 1.8 5.0 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 54 VAL HGy% A 45 LEU HG 1.0 1.8 4.0 2 1 A 54 VAL HGy% A 54 VAL HGx% 1.0 1.8 4.0 3 2 A 2 SER HBy A 2 SER HA 1.0 1.8 2.8 4 2 A 2 SER HA A 87 SER HBy 1.0 1.8 2.8 5 2 A 87 SER HA A 2 SER HBy 1.0 1.8 2.8 6 2 A 87 SER HA A 87 SER HBy 1.0 1.8 2.8 7 3 A 38 PHE HD% A 38 PHE HZ 1.0 1.8 2.8 8 3 A 38 PHE HD% A 38 PHE HE% 1.0 1.8 2.8 9 4 A 75 VAL HA A 78 ARG H 1.0 1.8 4.0 10 4 A 48 TYR HBy A 78 ARG H 1.0 1.8 4.0 11 5 A 50 LEU HA A 50 LEU HBy 1.0 1.8 4.0 12 5 A 50 LEU HA A 50 LEU HG 1.0 1.8 4.0 13 5 A 50 LEU HA A 50 LEU HBx 1.0 1.8 4.0 14 6 A 82 ILE HD1% A 83 ARG HBy 1.0 1.8 4.0 15 6 A 82 ILE HG2% A 83 ARG HBy 1.0 1.8 4.0 16 7 A 81 LEU HDy% A 87 SER HA 1.0 1.8 5.0 17 7 A 81 LEU HDy% A 86 GLN HA 1.0 1.8 5.0 18 8 A 31 ALA HA A 34 PHE H 1.0 1.8 4.0 19 8 A 34 PHE HA A 34 PHE H 1.0 1.8 4.0 20 9 A 32 VAL H A 31 ALA HB% 1.0 1.8 4.0 21 9 A 32 VAL H A 55 LYS HDy 1.0 1.8 4.0 22 9 A 55 LYS H A 55 LYS HDy 1.0 1.8 4.0 23 9 A 31 ALA HB% A 55 LYS H 1.0 1.8 4.0 24 10 A 50 LEU H A 50 LEU HBy 1.0 1.8 2.8 25 10 A 50 LEU H A 50 LEU HG 1.0 1.8 2.8 26 10 A 50 LEU H A 50 LEU HBx 1.0 1.8 2.8 27 11 A 50 LEU HDy% A 50 LEU HBy 1.0 1.8 4.0 28 11 A 50 LEU HDy% A 50 LEU HG 1.0 1.8 4.0 29 11 A 50 LEU HDy% A 50 LEU HBx 1.0 1.8 4.0 30 12 A 50 LEU HDx% A 50 LEU HBy 1.0 1.8 4.0 31 12 A 50 LEU HDx% A 50 LEU HG 1.0 1.8 4.0 32 12 A 50 LEU HDx% A 50 LEU HBx 1.0 1.8 4.0 33 13 A 59 LYS H A 56 LYS HA 1.0 1.8 4.0 34 13 A 56 LYS HA A 84 SER H 1.0 1.8 4.0 35 13 A 81 LEU HA A 84 SER H 1.0 1.8 4.0 36 13 A 59 LYS H A 81 LEU HA 1.0 1.8 4.0 37 14 A 14 ILE HA A 38 PHE HD% 1.0 1.8 4.0 38 14 A 35 GLU HA A 38 PHE HD% 1.0 1.8 4.0 39 15 A 34 PHE HD% A 34 PHE HE% 1.0 1.8 2.8 40 15 A 34 PHE HD% A 34 PHE HZ 1.0 1.8 2.8 41 16 A 48 TYR HD% A 11 CYS HBy 1.0 1.8 6.0 42 16 A 44 CYS HBy A 48 TYR HD% 1.0 1.8 6.0 43 17 A 48 TYR H A 47 LYS HDy 1.0 1.8 5.0 44 17 A 82 ILE HB A 48 TYR H 1.0 1.8 5.0 45 18 A 18 LEU HDx% A 34 PHE HD% 1.0 1.8 6.0 46 18 A 57 LEU HDx% A 34 PHE HD% 1.0 1.8 6.0 47 19 A 79 LEU HG A 19 TYR HD% 1.0 1.8 4.0 48 19 A 18 LEU HG A 19 TYR HD% 1.0 1.8 4.0 49 20 A 48 TYR HE% A 79 LEU HDx% 1.0 1.8 6.0 50 20 A 81 LEU HDy% A 48 TYR HE% 1.0 1.8 6.0 51 21 A 48 TYR HD% A 88 VAL HGy% 1.0 1.8 5.0 52 21 A 81 LEU HDx% A 48 TYR HD% 1.0 1.8 5.0 53 22 A 48 TYR HE% A 88 VAL HGy% 1.0 1.8 6.0 54 22 A 81 LEU HDx% A 48 TYR HE% 1.0 1.8 6.0 55 23 A 87 SER HA A 88 VAL HGy% 1.0 1.8 5.0 56 23 A 81 LEU HDx% A 87 SER HA 1.0 1.8 5.0 57 24 A 38 PHE HD% A 55 LYS HDy 1.0 1.8 5.0 58 24 A 31 ALA HB% A 38 PHE HD% 1.0 1.8 5.0 59 24 A 38 PHE HD% A 55 LYS HDx 1.0 1.8 5.0 60 25 A 34 PHE HA A 38 PHE HZ 1.0 1.8 4.0 61 25 A 34 PHE HA A 38 PHE HE% 1.0 1.8 4.0 62 26 A 38 PHE HZ A 55 LYS HDy 1.0 1.8 5.0 63 26 A 31 ALA HB% A 21 PHE HE% 1.0 1.8 5.0 64 26 A 38 PHE HE% A 55 LYS HDy 1.0 1.8 5.0 65 26 A 55 LYS HDx A 38 PHE HZ 1.0 1.8 5.0 66 26 A 21 PHE HE% A 55 LYS HDy 1.0 1.8 5.0 67 26 A 38 PHE HE% A 55 LYS HDx 1.0 1.8 5.0 68 26 A 21 PHE HE% A 55 LYS HDx 1.0 1.8 5.0 69 26 A 31 ALA HB% A 38 PHE HE% 1.0 1.8 5.0 70 26 A 31 ALA HB% A 38 PHE HZ 1.0 1.8 5.0 71 27 A 34 PHE HA A 34 PHE HE% 1.0 1.8 4.0 72 27 A 34 PHE HA A 34 PHE HZ 1.0 1.8 4.0 73 28 A 17 HIS HBx A 34 PHE HE% 1.0 1.8 5.0 74 28 A 17 HIS HBx A 34 PHE HZ 1.0 1.8 5.0 75 29 A 14 ILE HG2% A 34 PHE HE% 1.0 1.8 6.0 76 29 A 14 ILE HG2% A 34 PHE HZ 1.0 1.8 6.0 77 30 A 45 LEU HDx% A 51 GLU HA 1.0 1.8 4.0 78 30 A 50 LEU HDy% A 51 GLU HA 1.0 1.8 4.0 79 31 A 68 PRO HDx A 67 VAL HGy% 1.0 1.8 4.0 80 31 A 71 LEU HD1% A 68 PRO HDx 1.0 1.8 4.0 81 31 A 68 PRO HDx A 71 LEU HD2% 1.0 1.8 4.0 82 32 A 19 TYR HA A 22 LEU HD1% 1.0 1.8 4.0 83 32 A 19 TYR HA A 18 LEU HDx% 1.0 1.8 4.0 84 33 A 57 LEU HBx A 71 LEU HD2% 1.0 1.8 4.0 85 33 A 71 LEU HD1% A 57 LEU HBx 1.0 1.8 4.0 86 33 A 75 VAL HGy% A 57 LEU HBx 1.0 1.8 4.0 87 34 A 89 PRO HBx A 89 PRO HBy 1.0 1.8 2.8 88 34 A 89 PRO HBx A 89 PRO HGx 1.0 1.8 2.8 89 35 A 81 LEU HDx% A 78 ARG HA 1.0 1.8 4.0 90 35 A 78 ARG HA A 88 VAL HGy% 1.0 1.8 4.0 91 36 A 61 ALA H A 62 ALA HA 1.0 1.8 4.0 92 36 A 61 ALA H A 61 ALA HA 1.0 1.8 4.0 93 37 A 42 SER H A 41 SER HBx 1.0 1.8 4.0 94 37 A 25 GLU HA A 42 SER H 1.0 1.8 4.0 95 37 A 25 GLU HA A 26 MET H 1.0 1.8 4.0 96 37 A 26 MET H A 41 SER HBx 1.0 1.8 4.0 97 38 A 71 LEU HBx A 72 ARG H 1.0 1.8 4.0 98 38 A 72 ARG H A 72 ARG HBx 1.0 1.8 4.0 99 39 A 59 LYS HA A 58 VAL HGy% 1.0 1.8 5.0 100 39 A 57 LEU HDx% A 59 LYS HA 1.0 1.8 5.0 101 40 A 82 ILE HD1% A 18 LEU HDx% 1.0 1.8 5.0 102 40 A 82 ILE HG2% A 18 LEU HDx% 1.0 1.8 5.0 103 41 A 21 PHE HD% A 19 TYR H 1.0 1.8 5.0 104 41 A 19 TYR H A 19 TYR HD% 1.0 1.8 5.0 105 42 A 68 PRO HDy A 67 VAL HGy% 1.0 1.8 4.0 106 42 A 71 LEU HD1% A 68 PRO HDy 1.0 1.8 4.0 107 42 A 68 PRO HDy A 71 LEU HD2% 1.0 1.8 4.0 108 43 A 89 PRO HGy A 89 PRO HBy 1.0 1.8 2.8 109 43 A 89 PRO HGx A 89 PRO HGy 1.0 1.8 2.8 110 44 A 17 HIS H A 38 PHE HZ 1.0 1.8 5.0 111 44 A 17 HIS H A 38 PHE HE% 1.0 1.8 5.0 112 44 A 17 HIS H A 21 PHE HE% 1.0 1.8 5.0 113 45 A 17 HIS HBy A 14 ILE HA 1.0 1.8 5.0 114 45 A 17 HIS HBy A 35 GLU HA 1.0 1.8 5.0 115 46 A 17 HIS HBy A 34 PHE HE% 1.0 1.8 5.0 116 46 A 17 HIS HBy A 34 PHE HZ 1.0 1.8 5.0 117 47 A 17 HIS HBx A 14 ILE HA 1.0 1.8 4.0 118 47 A 17 HIS HBx A 35 GLU HA 1.0 1.8 4.0 119 48 A 18 LEU H A 34 PHE HE% 1.0 1.8 5.0 120 48 A 18 LEU H A 34 PHE HZ 1.0 1.8 5.0 121 49 A 14 ILE HA A 17 HIS HD2 1.0 1.8 4.0 122 49 A 35 GLU HA A 17 HIS HD2 1.0 1.8 4.0 123 50 A 38 PHE HBy A 45 LEU HDx% 1.0 1.8 5.0 124 50 A 14 ILE HD1% A 38 PHE HBy 1.0 1.8 5.0 125 51 A 54 VAL HB A 45 LEU HDx% 1.0 1.8 4.0 126 51 A 54 VAL HB A 14 ILE HD1% 1.0 1.8 4.0 127 51 A 54 VAL HB A 50 LEU HDy% 1.0 1.8 4.0 128 52 A 14 ILE HA A 18 LEU HDx% 1.0 1.8 5.0 129 52 A 57 LEU HDx% A 14 ILE HA 1.0 1.8 5.0 130 53 A 61 ALA HB% A 64 GLN HBy 1.0 1.8 4.0 131 53 A 62 ALA HB% A 64 GLN HBy 1.0 1.8 4.0 132 54 A 17 HIS H A 37 HIS HBx 1.0 1.8 4.0 133 54 A 17 HIS H A 34 PHE HBx 1.0 1.8 4.0 134 54 A 35 GLU H A 34 PHE HBx 1.0 1.8 4.0 135 54 A 35 GLU H A 37 HIS HBx 1.0 1.8 4.0 136 55 A 37 HIS HE1 A 36 HIS HB2 1.0 1.8 5.0 137 55 A 36 HIS HB3 A 37 HIS HE1 1.0 1.8 5.0 138 55 A 14 ILE H A 36 HIS HB3 1.0 1.8 5.0 139 55 A 14 ILE H A 36 HIS HB2 1.0 1.8 5.0 140 56 A 94 ALA HB% A 93 VAL HB 1.0 1.8 4.0 141 56 A 94 ALA HB% A 52 GLN HB3 1.0 1.8 4.0 142 56 A 53 ALA HB% A 93 VAL HB 1.0 1.8 4.0 143 56 A 53 ALA HB% A 52 GLN HB2 1.0 1.8 4.0 144 56 A 94 ALA HB% A 52 GLN HB2 1.0 1.8 4.0 145 56 A 53 ALA HB% A 52 GLN HB3 1.0 1.8 4.0 146 57 A 75 VAL HGx% A 53 ALA H 1.0 1.8 6.0 147 57 A 53 ALA H A 50 LEU HDx% 1.0 1.8 6.0 148 58 A 71 LEU HD1% A 68 PRO HA 1.0 1.8 5.0 149 58 A 68 PRO HA A 67 VAL HGy% 1.0 1.8 5.0 150 58 A 67 VAL HGx% A 68 PRO HA 1.0 1.8 5.0 151 59 A 44 CYS HA A 47 LYS HDy 1.0 1.8 4.0 152 59 A 44 CYS HA A 14 ILE HG1x 1.0 1.8 4.0 153 59 A 44 CYS HA A 47 LYS HDx 1.0 1.8 4.0 154 60 A 66 ASP HA A 60 ARG HD3 1.0 1.8 4.0 155 60 A 65 ASP HA A 60 ARG HD3 1.0 1.8 4.0 156 60 A 66 ASP HA A 60 ARG HD2 1.0 1.8 4.0 157 60 A 65 ASP HA A 60 ARG HD2 1.0 1.8 4.0 158 61 A 54 VAL HGx% A 51 GLU HBx 1.0 1.8 5.0 159 61 A 54 VAL HGx% A 57 LEU HBx 1.0 1.8 5.0 160 62 A 38 PHE HE% A 58 VAL HGy% 1.0 1.8 6.0 161 62 A 18 LEU HDx% A 38 PHE HE% 1.0 1.8 6.0 162 63 A 57 LEU HDx% A 34 PHE HE% 1.0 1.8 5.0 163 63 A 57 LEU HDx% A 34 PHE HZ 1.0 1.8 5.0 164 64 A 94 ALA HA A 71 LEU HD2% 1.0 1.8 4.0 165 64 A 71 LEU HD1% A 94 ALA HA 1.0 1.8 4.0 166 64 A 94 ALA HA A 67 VAL HGy% 1.0 1.8 4.0 167 64 A 75 VAL HGy% A 94 ALA HA 1.0 1.8 4.0 168 64 A 67 VAL HGx% A 94 ALA HA 1.0 1.8 4.0 169 65 A 27 PRO HBy A 27 PRO HGx 1.0 1.8 4.0 170 65 A 27 PRO HBy A 27 PRO HBx 1.0 1.8 4.0 171 66 A 82 ILE H A 82 ILE HD1% 1.0 1.8 4.0 172 66 A 82 ILE H A 82 ILE HG2% 1.0 1.8 4.0 173 67 A 76 MET H A 76 MET HBy 1.0 1.8 4.0 174 67 A 76 MET H A 76 MET HE% 1.0 1.8 4.0 175 68 A 74 LYS H A 74 LYS HBy 1.0 1.8 2.8 176 68 A 74 LYS H A 72 ARG HBy 1.0 1.8 2.8 177 69 A 74 LYS H A 74 LYS HG2 1.0 1.8 2.8 178 69 A 74 LYS H A 74 LYS HG3 1.0 1.8 2.8 179 69 A 74 LYS H A 73 ALA HB% 1.0 1.8 2.8 180 70 A 59 LYS H A 59 LYS HZ% 1.0 1.8 2.8 181 70 A 59 LYS H A 58 VAL H 1.0 1.8 2.8 182 71 A 21 PHE HD% A 79 LEU H 1.0 1.8 5.0 183 71 A 79 LEU H A 19 TYR HD% 1.0 1.8 5.0 184 72 A 61 ALA HB% A 62 ALA H 1.0 1.8 4.0 185 72 A 62 ALA H A 62 ALA HB% 1.0 1.8 4.0 186 73 A 42 SER H A 41 SER HBy 1.0 1.8 2.8 187 73 A 42 SER H A 41 SER HBx 1.0 1.8 2.8 188 73 A 42 SER H A 42 SER HBy 1.0 1.8 2.8 189 74 A 15 LEU HA A 16 ASP H 1.0 1.8 2.8 190 74 A 13 GLU HA A 16 ASP H 1.0 1.8 2.8 191 75 A 19 TYR HA A 26 MET H 1.0 1.8 2.8 192 75 A 26 MET H A 27 PRO HDy 1.0 1.8 2.8 193 75 A 20 GLU H A 27 PRO HDy 1.0 1.8 2.8 194 75 A 20 GLU H A 19 TYR HA 1.0 1.8 2.8 195 76 A 90 GLU H A 89 PRO HBy 1.0 1.8 4.0 196 76 A 89 PRO HGx A 90 GLU H 1.0 1.8 4.0 197 76 A 71 LEU HBx A 90 GLU H 1.0 1.8 4.0 198 76 A 90 GLU H A 72 ARG HBx 1.0 1.8 4.0 199 77 A 24 LYS HA A 25 GLU H 1.0 1.8 2.8 200 77 A 21 PHE HA A 25 GLU H 1.0 1.8 2.8 201 78 A 40 GLU H A 39 GLU HBx 1.0 1.8 2.8 202 78 A 40 GLU H A 40 GLU HBy 1.0 1.8 2.8 203 79 A 71 LEU H A 71 LEU HBy 1.0 1.8 2.8 204 79 A 71 LEU H A 71 LEU HG 1.0 1.8 2.8 205 80 A 71 LEU HBx A 73 ALA H 1.0 1.8 2.8 206 80 A 73 ALA H A 72 ARG HBx 1.0 1.8 2.8 207 81 A 83 ARG H A 83 ARG HGy 1.0 1.8 2.8 208 81 A 83 ARG H A 83 ARG HBy 1.0 1.8 2.8 209 81 A 83 ARG H A 83 ARG HGx 1.0 1.8 2.8 210 82 A 22 LEU H A 22 LEU HD1% 1.0 1.8 4.0 211 82 A 22 LEU H A 22 LEU HD2% 1.0 1.8 4.0 212 83 A 57 LEU H A 56 LYS HDy 1.0 1.8 4.0 213 83 A 71 LEU HBy A 57 LEU H 1.0 1.8 4.0 214 83 A 57 LEU H A 56 LYS HDx 1.0 1.8 4.0 215 84 A 45 LEU HDx% A 51 GLU H 1.0 1.8 5.0 216 84 A 50 LEU HDy% A 51 GLU H 1.0 1.8 5.0 217 85 A 54 VAL HGy% A 46 GLU H 1.0 1.8 6.0 218 85 A 45 LEU HDx% A 46 GLU H 1.0 1.8 6.0 219 86 A 45 LEU HDx% A 41 SER H 1.0 1.8 6.0 220 86 A 14 ILE HD1% A 41 SER H 1.0 1.8 6.0 221 87 A 82 ILE HD1% A 81 LEU H 1.0 1.8 6.0 222 87 A 82 ILE HG2% A 81 LEU H 1.0 1.8 6.0 223 88 A 45 LEU H A 41 SER HBy 1.0 1.8 4.0 224 88 A 45 LEU H A 42 SER HBy 1.0 1.8 4.0 225 89 A 22 LEU H A 18 LEU HA 1.0 1.8 4.0 226 89 A 22 LEU H A 73 ALA HA 1.0 1.8 4.0 227 90 A 24 LYS H A 26 MET H 1.0 1.8 5.0 228 90 A 24 LYS H A 22 LEU H 1.0 1.8 5.0 229 91 A 45 LEU HDx% A 42 SER H 1.0 1.8 5.0 230 91 A 14 ILE HD1% A 42 SER H 1.0 1.8 5.0 231 92 A 61 ALA HB% A 32 VAL H 1.0 1.8 5.0 232 92 A 32 VAL H A 62 ALA HB% 1.0 1.8 5.0 233 93 A 82 ILE HA A 82 ILE HD1% 1.0 1.8 5.0 234 93 A 82 ILE HA A 82 ILE HG2% 1.0 1.8 5.0 235 94 A 82 ILE HB A 82 ILE HD1% 1.0 1.8 5.0 236 94 A 82 ILE HB A 82 ILE HG2% 1.0 1.8 5.0 237 95 A 48 TYR HBy A 50 LEU HBy 1.0 1.8 5.0 238 95 A 48 TYR HBy A 50 LEU HG 1.0 1.8 5.0 239 95 A 48 TYR HBy A 50 LEU HBx 1.0 1.8 5.0 240 96 A 59 LYS HEx A 59 LYS HEy 1.0 1.8 4.0 241 96 A 59 LYS HBx A 59 LYS HEx 1.0 1.8 4.0 242 97 A 45 LEU HDx% A 51 GLU HA 1.0 1.8 5.0 243 97 A 14 ILE HD1% A 51 GLU HA 1.0 1.8 5.0 244 97 A 50 LEU HDy% A 51 GLU HA 1.0 1.8 5.0 245 98 A 48 TYR HBx A 49 GLY HAy 1.0 1.8 6.0 246 98 A 49 GLY HAy A 46 GLU HGx 1.0 1.8 6.0 247 99 A 48 TYR HBy A 82 ILE HG1x 1.0 1.8 6.0 248 99 A 48 TYR HBy A 50 LEU HDx% 1.0 1.8 6.0 249 100 A 48 TYR HBy A 82 ILE HD1% 1.0 1.8 6.0 250 100 A 48 TYR HBy A 82 ILE HG2% 1.0 1.8 6.0 251 101 A 44 CYS HBy A 45 LEU HDx% 1.0 1.8 6.0 252 101 A 44 CYS HBy A 14 ILE HD1% 1.0 1.8 6.0 253 101 A 44 CYS HBy A 50 LEU HDy% 1.0 1.8 6.0 254 102 A 95 ALA HA A 67 VAL HGy% 1.0 1.8 5.0 255 102 A 71 LEU HD1% A 95 ALA HA 1.0 1.8 5.0 256 102 A 75 VAL HGy% A 95 ALA HA 1.0 1.8 5.0 257 102 A 95 ALA HA A 71 LEU HD2% 1.0 1.8 5.0 258 103 A 61 ALA HA A 67 VAL HGy% 1.0 1.8 6.0 259 103 A 71 LEU HD1% A 61 ALA HA 1.0 1.8 6.0 260 103 A 61 ALA HA A 71 LEU HD2% 1.0 1.8 6.0 261 104 A 72 ARG H A 60 ARG HBx 1.0 1.8 4.0 262 104 A 72 ARG H A 72 ARG HBy 1.0 1.8 4.0 263 105 A 35 GLU HA A 34 PHE HBy 1.0 1.8 4.0 264 105 A 38 PHE HBy A 35 GLU HA 1.0 1.8 4.0 265 106 A 57 LEU HBy A 34 PHE HE% 1.0 1.8 4.0 266 106 A 57 LEU HBy A 34 PHE HZ 1.0 1.8 4.0 267 107 A 78 ARG HA A 78 ARG HBx 1.0 1.8 2.8 268 107 A 78 ARG HA A 81 LEU HB2 1.0 1.8 2.8 269 108 A 59 LYS HEx A 59 LYS HGy 1.0 1.8 4.0 270 108 A 59 LYS HEx A 59 LYS HDy 1.0 1.8 4.0 271 108 A 59 LYS HGx A 59 LYS HEx 1.0 1.8 4.0 272 108 A 59 LYS HEx A 59 LYS HDx 1.0 1.8 4.0 273 109 A 74 LYS H A 74 LYS HBx 1.0 1.8 2.8 274 109 A 64 GLN H A 64 GLN HBy 1.0 1.8 2.8 275 109 A 74 LYS H A 64 GLN HBy 1.0 1.8 2.8 276 109 A 64 GLN H A 74 LYS HBx 1.0 1.8 2.8 277 110 A 88 VAL HA A 43 PRO HBx 1.0 1.8 4.0 278 110 A 41 SER HA A 43 PRO HBx 1.0 1.8 4.0 279 110 A 88 VAL HA A 88 VAL HB 1.0 1.8 4.0 280 110 A 88 VAL HB A 41 SER HA 1.0 1.8 4.0 281 111 A 20 GLU HA A 17 HIS HD2 1.0 1.8 5.0 282 111 A 13 GLU HA A 17 HIS HD2 1.0 1.8 5.0 283 112 A 37 HIS HA A 40 GLU H 1.0 1.8 4.0 284 112 A 36 HIS HA A 40 GLU H 1.0 1.8 4.0 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_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 10 ASP C A 11 CYS N A 11 CYS CA A 11 CYS C 1.0 -163.62 -71.86 PHI 2 2 A 12 SER N A 12 SER CA A 12 SER C A 13 GLU N 1.0 -59.89 -9.89 PSI 3 3 A 12 SER C A 13 GLU N A 13 GLU CA A 13 GLU C 1.0 -91.10 -41.10 PHI 4 4 A 13 GLU N A 13 GLU CA A 13 GLU C A 14 ILE N 1.0 -66.79 -16.79 PSI 5 5 A 13 GLU C A 14 ILE N A 14 ILE CA A 14 ILE C 1.0 -88.92 -38.92 PHI 6 6 A 14 ILE N A 14 ILE CA A 14 ILE C A 15 LEU N 1.0 -66.07 -16.07 PSI 7 7 A 14 ILE C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -88.34 -38.34 PHI 8 8 A 15 LEU N A 15 LEU CA A 15 LEU C A 16 ASP N 1.0 -66.56 -16.56 PSI 9 9 A 15 LEU C A 16 ASP N A 16 ASP CA A 16 ASP C 1.0 -97.33 -37.33 PHI 10 10 A 16 ASP N A 16 ASP CA A 16 ASP C A 17 HIS N 1.0 -63.13 -13.13 PSI 11 11 A 16 ASP C A 17 HIS N A 17 HIS CA A 17 HIS C 1.0 -92.25 -42.25 PHI 12 12 A 17 HIS N A 17 HIS CA A 17 HIS C A 18 LEU N 1.0 -63.00 -13.00 PSI 13 13 A 17 HIS C A 18 LEU N A 18 LEU CA A 18 LEU C 1.0 -89.21 -39.21 PHI 14 14 A 18 LEU N A 18 LEU CA A 18 LEU C A 19 TYR N 1.0 -67.24 -17.24 PSI 15 15 A 18 LEU C A 19 TYR N A 19 TYR CA A 19 TYR C 1.0 -85.95 -35.95 PHI 16 16 A 19 TYR N A 19 TYR CA A 19 TYR C A 20 GLU N 1.0 -72.98 -12.98 PSI 17 17 A 19 TYR C A 20 GLU N A 20 GLU CA A 20 GLU C 1.0 -86.23 -36.23 PHI 18 18 A 20 GLU N A 20 GLU CA A 20 GLU C A 21 PHE N 1.0 -58.76 -8.76 PSI 19 19 A 20 GLU C A 21 PHE N A 21 PHE CA A 21 PHE C 1.0 -88.85 -38.85 PHI 20 20 A 21 PHE N A 21 PHE CA A 21 PHE C A 22 LEU N 1.0 -69.18 -19.18 PSI 21 21 A 21 PHE C A 22 LEU N A 22 LEU CA A 22 LEU C 1.0 -91.86 -41.86 PHI 22 22 A 22 LEU N A 22 LEU CA A 22 LEU C A 23 ASP N 1.0 -65.71 -15.71 PSI 23 23 A 22 LEU C A 23 ASP N A 23 ASP CA A 23 ASP C 1.0 -89.96 -39.96 PHI 24 24 A 23 ASP N A 23 ASP CA A 23 ASP C A 24 LYS N 1.0 -59.22 -9.22 PSI 25 25 A 23 ASP C A 24 LYS N A 24 LYS CA A 24 LYS C 1.0 -132.68 -52.12 PHI 26 26 A 24 LYS N A 24 LYS CA A 24 LYS C A 25 GLU N 1.0 -33.22 24.34 PSI 27 27 A 27 PRO C A 28 ASP N A 28 ASP CA A 28 ASP C 1.0 -88.41 -37.41 PHI 28 28 A 28 ASP N A 28 ASP CA A 28 ASP C A 29 SER N 1.0 -60.85 -2.73 PSI 29 29 A 30 ASP C A 31 ALA N A 31 ALA CA A 31 ALA C 1.0 -86.49 -36.49 PHI 30 30 A 31 ALA N A 31 ALA CA A 31 ALA C A 32 VAL N 1.0 -67.28 -17.28 PSI 31 31 A 31 ALA C A 32 VAL N A 32 VAL CA A 32 VAL C 1.0 -97.70 -40.22 PHI 32 32 A 32 VAL N A 32 VAL CA A 32 VAL C A 33 LYS N 1.0 -65.99 -15.99 PSI 33 33 A 32 VAL C A 33 LYS N A 33 LYS CA A 33 LYS C 1.0 -91.34 -41.34 PHI 34 34 A 33 LYS N A 33 LYS CA A 33 LYS C A 34 PHE N 1.0 -62.12 -12.12 PSI 35 35 A 33 LYS C A 34 PHE N A 34 PHE CA A 34 PHE C 1.0 -100.86 -41.30 PHI 36 36 A 37 HIS C A 38 PHE N A 38 PHE CA A 38 PHE C 1.0 -90.19 -40.19 PHI 37 37 A 38 PHE N A 38 PHE CA A 38 PHE C A 39 GLU N 1.0 -68.65 -18.65 PSI 38 38 A 38 PHE C A 39 GLU N A 39 GLU CA A 39 GLU C 1.0 -88.48 -38.48 PHI 39 39 A 39 GLU N A 39 GLU CA A 39 GLU C A 40 GLU N 1.0 -64.68 -14.68 PSI 40 40 A 39 GLU C A 40 GLU N A 40 GLU CA A 40 GLU C 1.0 -98.78 -44.42 PHI 41 41 A 40 GLU N A 40 GLU CA A 40 GLU C A 41 SER N 1.0 -54.01 -4.01 PSI 42 42 A 41 SER C A 42 SER N A 42 SER CA A 42 SER C 1.0 -90.99 -30.99 PHI 43 43 A 42 SER N A 42 SER CA A 42 SER C A 43 PRO N 1.0 -59.83 -9.83 PSI 44 44 A 42 SER C A 43 PRO N A 43 PRO CA A 43 PRO C 1.0 -105.72 -50.76 PHI 45 45 A 43 PRO N A 43 PRO CA A 43 PRO C A 44 CYS N 1.0 -52.51 5.57 PSI 46 46 A 44 CYS C A 45 LEU N A 45 LEU CA A 45 LEU C 1.0 -85.66 -35.66 PHI 47 47 A 45 LEU N A 45 LEU CA A 45 LEU C A 46 GLU N 1.0 -66.23 -6.23 PSI 48 48 A 46 GLU C A 47 LYS N A 47 LYS CA A 47 LYS C 1.0 -95.54 -35.54 PHI 49 49 A 47 LYS N A 47 LYS CA A 47 LYS C A 48 TYR N 1.0 -62.10 -1.10 PSI 50 50 A 50 LEU C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -85.98 -35.98 PHI 51 51 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 GLN N 1.0 -59.58 -9.58 PSI 52 52 A 51 GLU C A 52 GLN N A 52 GLN CA A 52 GLN C 1.0 -87.79 -37.79 PHI 53 53 A 52 GLN N A 52 GLN CA A 52 GLN C A 53 ALA N 1.0 -66.58 -16.58 PSI 54 54 A 52 GLN C A 53 ALA N A 53 ALA CA A 53 ALA C 1.0 -92.65 -42.65 PHI 55 55 A 53 ALA N A 53 ALA CA A 53 ALA C A 54 VAL N 1.0 -68.34 -18.34 PSI 56 56 A 53 ALA C A 54 VAL N A 54 VAL CA A 54 VAL C 1.0 -89.80 -39.80 PHI 57 57 A 54 VAL N A 54 VAL CA A 54 VAL C A 55 LYS N 1.0 -68.50 -18.50 PSI 58 58 A 54 VAL C A 55 LYS N A 55 LYS CA A 55 LYS C 1.0 -84.63 -34.63 PHI 59 59 A 55 LYS N A 55 LYS CA A 55 LYS C A 56 LYS N 1.0 -69.34 -19.34 PSI 60 60 A 55 LYS C A 56 LYS N A 56 LYS CA A 56 LYS C 1.0 -87.99 -37.99 PHI 61 61 A 56 LYS N A 56 LYS CA A 56 LYS C A 57 LEU N 1.0 -67.50 -17.50 PSI 62 62 A 69 GLY C A 70 ASP N A 70 ASP CA A 70 ASP C 1.0 -117.01 -38.85 PHI 63 63 A 70 ASP N A 70 ASP CA A 70 ASP C A 71 LEU N 1.0 -70.97 28.43 PSI 64 64 A 70 ASP C A 71 LEU N A 71 LEU CA A 71 LEU C 1.0 -85.54 -35.54 PHI 65 65 A 71 LEU N A 71 LEU CA A 71 LEU C A 72 ARG N 1.0 -63.91 -13.91 PSI 66 66 A 71 LEU C A 72 ARG N A 72 ARG CA A 72 ARG C 1.0 -87.07 -37.07 PHI 67 67 A 72 ARG N A 72 ARG CA A 72 ARG C A 73 ALA N 1.0 -68.05 -18.05 PSI 68 68 A 72 ARG C A 73 ALA N A 73 ALA CA A 73 ALA C 1.0 -89.29 -39.29 PHI 69 69 A 73 ALA N A 73 ALA CA A 73 ALA C A 74 LYS N 1.0 -63.56 -13.56 PSI 70 70 A 73 ALA C A 74 LYS N A 74 LYS CA A 74 LYS C 1.0 -92.52 -42.52 PHI 71 71 A 74 LYS N A 74 LYS CA A 74 LYS C A 75 VAL N 1.0 -62.90 -12.90 PSI 72 72 A 74 LYS C A 75 VAL N A 75 VAL CA A 75 VAL C 1.0 -90.74 -40.74 PHI 73 73 A 75 VAL N A 75 VAL CA A 75 VAL C A 76 MET N 1.0 -70.93 -20.93 PSI 74 74 A 75 VAL C A 76 MET N A 76 MET CA A 76 MET C 1.0 -85.01 -35.01 PHI 75 75 A 76 MET N A 76 MET CA A 76 MET C A 77 GLY N 1.0 -67.45 -17.45 PSI 76 76 A 76 MET C A 77 GLY N A 77 GLY CA A 77 GLY C 1.0 -89.74 -39.74 PHI 77 77 A 77 GLY N A 77 GLY CA A 77 GLY C A 78 ARG N 1.0 -64.20 -14.20 PSI 78 78 A 77 GLY C A 78 ARG N A 78 ARG CA A 78 ARG C 1.0 -88.14 -38.14 PHI 79 79 A 78 ARG N A 78 ARG CA A 78 ARG C A 79 LEU N 1.0 -66.54 -15.90 PSI 80 80 A 78 ARG C A 79 LEU N A 79 LEU CA A 79 LEU C 1.0 -88.01 -38.01 PHI 81 81 A 79 LEU N A 79 LEU CA A 79 LEU C A 80 ASP N 1.0 -66.63 -16.63 PSI 82 82 A 79 LEU C A 80 ASP N A 80 ASP CA A 80 ASP C 1.0 -91.80 -41.80 PHI 83 83 A 80 ASP N A 80 ASP CA A 80 ASP C A 81 LEU N 1.0 -64.05 -14.05 PSI 84 84 A 80 ASP C A 81 LEU N A 81 LEU CA A 81 LEU C 1.0 -92.32 -42.32 PHI 85 85 A 81 LEU N A 81 LEU CA A 81 LEU C A 82 ILE N 1.0 -65.30 -15.30 PSI 86 86 A 81 LEU C A 82 ILE N A 82 ILE CA A 82 ILE C 1.0 -88.33 -38.33 PHI 87 87 A 82 ILE N A 82 ILE CA A 82 ILE C A 83 ARG N 1.0 -66.26 -16.26 PSI 88 88 A 82 ILE C A 83 ARG N A 83 ARG CA A 83 ARG C 1.0 -92.99 -42.99 PHI 89 89 A 83 ARG N A 83 ARG CA A 83 ARG C A 84 SER N 1.0 -52.88 -2.88 PSI 90 90 A 83 ARG C A 84 SER N A 84 SER CA A 84 SER C 1.0 -126.93 -60.09 PHI 91 91 A 84 SER N A 84 SER CA A 84 SER C A 85 GLY N 1.0 -34.81 27.87 PSI 92 92 A 98 SER C A 99 SER N A 99 SER CA A 99 SER C 1.0 -101.41 -50.05 PHI 93 93 A 99 SER N A 99 SER CA A 99 SER C A 100 SER N 1.0 -50.90 8.82 PSI 94 94 A 100 SER C A 101 ALA N A 101 ALA CA A 101 ALA C 1.0 -139.61 -38.21 PHI stop_ save_ save_CNS/XPLOR_dipolar_coupling_5 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_5 _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 14 ILE N A 14 ILE H 1.0 . . . 2 2 A 15 LEU N A 15 LEU H 1.0 . . . 3 3 A 16 ASP N A 16 ASP H 1.0 . . . 4 4 A 17 HIS N A 17 HIS H 1.0 . . . 5 5 A 18 LEU N A 18 LEU H 1.0 . . . 6 6 A 20 GLU N A 20 GLU H 1.0 . . . 7 7 A 22 LEU N A 22 LEU H 1.0 . . . 8 8 A 23 ASP N A 23 ASP H 1.0 . . . 9 9 A 30 ASP N A 30 ASP H 1.0 . . . 10 10 A 31 ALA N A 31 ALA H 1.0 . . . 11 11 A 32 VAL N A 32 VAL H 1.0 . . . 12 12 A 33 LYS N A 33 LYS H 1.0 . . . 13 13 A 35 GLU N A 35 GLU H 1.0 . . . 14 14 A 44 CYS N A 44 CYS H 1.0 . . . 15 15 A 45 LEU N A 45 LEU H 1.0 . . . 16 16 A 46 GLU N A 46 GLU H 1.0 . . . 17 17 A 47 LYS N A 47 LYS H 1.0 . . . 18 18 A 48 TYR N A 48 TYR H 1.0 . . . 19 19 A 51 GLU N A 51 GLU H 1.0 . . . 20 20 A 52 GLN N A 52 GLN H 1.0 . . . 21 21 A 54 VAL N A 54 VAL H 1.0 . . . 22 22 A 55 LYS N A 55 LYS H 1.0 . . . 23 23 A 56 LYS N A 56 LYS H 1.0 . . . 24 24 A 57 LEU N A 57 LEU H 1.0 . . . 25 25 A 58 VAL N A 58 VAL H 1.0 . . . 26 26 A 59 LYS N A 59 LYS H 1.0 . . . 27 27 A 70 ASP N A 70 ASP H 1.0 . . . 28 28 A 71 LEU N A 71 LEU H 1.0 . . . 29 29 A 72 ARG N A 72 ARG H 1.0 . . . 30 30 A 73 ALA N A 73 ALA H 1.0 . . . 31 31 A 74 LYS N A 74 LYS H 1.0 . . . 32 32 A 75 VAL N A 75 VAL H 1.0 . . . 33 33 A 76 MET N A 76 MET H 1.0 . . . 34 34 A 77 GLY N A 77 GLY H 1.0 . . . 35 35 A 78 ARG N A 78 ARG H 1.0 . . . 36 36 A 79 LEU N A 79 LEU H 1.0 . . . 37 37 A 80 ASP N A 80 ASP H 1.0 . . . 38 38 A 81 LEU N A 81 LEU H 1.0 . . . 39 39 A 82 ILE N A 82 ILE H 1.0 . . . 40 40 A 83 ARG N A 83 ARG H 1.0 . . . stop_ save_