data_nef_c17903_2lir 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 17904 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 23 HIS NE2 2 1 HEC FE 1 76 HIS NE2 2 1 HEC FE 1 19 CYS SG 2 1 HEC CAB 1 22 CYS SG 2 1 HEC CAC 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 -5 THR start . . 2 A -4 GLU middle . . 3 A -3 PHE middle . . 4 A -2 LYS middle . . 5 A -1 ALA middle . . 6 A 1 GLY middle . false 7 A 2 SER middle . . 8 A 3 ALA middle . . 9 A 4 LYS middle . . 10 A 5 LYS middle . . 11 A 6 GLY middle . false 12 A 7 ALA middle . . 13 A 8 THR middle . . 14 A 9 LEU middle . . 15 A 10 PHE middle . . 16 A 11 LYS middle . . 17 A 12 THR middle . . 18 A 13 ARG middle . . 19 A 14 CYS middle -HG . 20 A 15 LEU middle . . 21 A 16 GLN middle . . 22 A 17 CYS middle -HG . 23 A 18 HIS middle -HE2 . 24 A 19 THR middle . . 25 A 20 VAL middle . . 26 A 21 GLU middle . . 27 A 22 LYS middle . . 28 A 23 GLY middle . false 29 A 24 GLY middle . false 30 A 25 PRO middle . false 31 A 26 HIS middle . . 32 A 27 LYS middle . . 33 A 28 VAL middle . . 34 A 29 GLY middle . false 35 A 30 PRO middle . false 36 A 31 ASN middle . . 37 A 32 LEU middle . . 38 A 33 HIS middle . . 39 A 34 GLY middle . false 40 A 35 ILE middle . . 41 A 36 PHE middle . . 42 A 37 GLY middle . false 43 A 38 ARG middle . . 44 A 39 HIS middle . . 45 A 40 SER middle . . 46 A 41 GLY middle . false 47 A 42 GLN middle . . 48 A 43 ALA middle . . 49 A 44 GLU middle . . 50 A 45 GLY middle . false 51 A 46 TYR middle . . 52 A 47 SER middle . . 53 A 48 TYR middle . . 54 A 49 THR middle . . 55 A 50 ASP middle . . 56 A 51 ALA middle . . 57 A 52 ASN middle . . 58 A 53 ILE middle . . 59 A 54 LYS middle . . 60 A 55 LYS middle . . 61 A 56 ASN middle . . 62 A 57 VAL middle . . 63 A 58 LEU middle . . 64 A 59 TRP middle . . 65 A 60 ASP middle . . 66 A 61 GLU middle . . 67 A 62 ASN middle . . 68 A 63 ASN middle . . 69 A 64 MET middle . . 70 A 65 SER middle . . 71 A 66 GLU middle . . 72 A 67 TYR middle . . 73 A 68 LEU middle . . 74 A 69 THR middle . . 75 A 70 ASN middle . . 76 A 71 HIS middle -HE2 . 77 A 72 ALA middle . . 78 A 73 LYS middle . . 79 A 74 TYR middle . . 80 A 75 ILE middle . . 81 A 76 PRO middle . false 82 A 77 GLY middle . false 83 A 78 THR middle . . 84 A 79 LYS middle . . 85 A 80 MET middle . . 86 A 81 ALA middle . . 87 A 82 PHE middle . . 88 A 83 GLY middle . false 89 A 84 GLY middle . false 90 A 85 LEU middle . . 91 A 86 LYS middle . . 92 A 87 LYS middle . . 93 A 88 GLU middle . . 94 A 89 LYS middle . . 95 A 90 ASP middle . . 96 A 91 ARG middle . . 97 A 92 ASN middle . . 98 A 93 ASP middle . . 99 A 94 LEU middle . . 100 A 95 ILE middle . . 101 A 96 THR middle . . 102 A 97 TYR middle . . 103 A 98 LEU middle . . 104 A 99 LYS middle . . 105 A 100 LYS middle . . 106 A 101 ALA middle . . 107 A 102 THR middle . . 108 A 103 GLU end . . 109 B 1 HEC . . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A -3 PHE H H 1 7.737 0.001 A -3 PHE HA H 1 4.278 0.002 A -3 PHE HBx H 1 2.615 0.005 A -3 PHE HBy H 1 2.825 0.010 A -3 PHE HDx H 1 7.019 0.010 A -3 PHE HEx H 1 7.197 0.011 A -3 PHE HZ H 1 7.123 0.003 A -2 LYS H H 1 6.597 0.003 A -2 LYS HA H 1 3.792 0.001 A -2 LYS HBx H 1 1.277 0.002 A -2 LYS HDx H 1 1.388 0.002 A -2 LYS HEx H 1 2.811 0.001 A -2 LYS HGx H 1 1.128 0.014 A -1 ALA H H 1 7.737 0.001 A -1 ALA HA H 1 3.784 0.007 A -1 ALA HB% H 1 1.238 0.003 A 1 GLY H H 1 8.161 0.004 A 1 GLY HAy H 1 4.277 0.011 A 1 GLY HAx H 1 3.393 0.000 A 2 SER H H 1 9.365 0.003 A 2 SER HA H 1 3.982 0.004 A 2 SER HBx H 1 3.378 0.018 A 2 SER HBy H 1 3.567 0.002 A 3 ALA H H 1 8.961 0.012 A 3 ALA HA H 1 4.116 0.008 A 3 ALA HB% H 1 1.539 0.002 A 4 LYS H H 1 8.198 0.005 A 4 LYS HA H 1 4.325 0.004 A 4 LYS HBx H 1 1.657 0.000 A 4 LYS HEy H 1 2.869 0.015 A 4 LYS HEx H 1 2.798 0.000 A 4 LYS HGx H 1 1.281 0.000 A 5 LYS H H 1 7.710 0.003 A 5 LYS HA H 1 4.032 0.003 A 5 LYS HBx H 1 1.448 0.001 A 5 LYS HBy H 1 1.680 0.002 A 5 LYS HGx H 1 0.932 0.002 A 6 GLY H H 1 8.619 0.008 A 6 GLY HAx H 1 3.836 0.006 A 6 GLY HAy H 1 4.012 0.004 A 7 ALA H H 1 7.907 0.007 A 7 ALA HA H 1 2.184 0.002 A 7 ALA HB% H 1 1.111 0.003 A 8 THR H H 1 7.159 0.008 A 8 THR HA H 1 4.095 0.006 A 8 THR HB H 1 3.801 0.005 A 8 THR HG2% H 1 1.166 0.003 A 9 LEU H H 1 7.867 0.005 A 9 LEU HA H 1 3.744 0.006 A 9 LEU HBy H 1 1.739 0.004 A 9 LEU HDx% H 1 0.475 0.000 A 9 LEU HDy% H 1 0.762 0.012 A 9 LEU HG H 1 1.450 0.008 A 10 PHE H H 1 8.400 0.005 A 10 PHE HA H 1 3.778 0.011 A 10 PHE HBy H 1 3.160 0.005 A 10 PHE HBx H 1 2.658 0.004 A 10 PHE HDy H 1 7.162 0.009 A 10 PHE HEy H 1 7.812 0.009 A 10 PHE HZ H 1 8.493 0.06 A 11 LYS H H 1 8.101 0.012 A 11 LYS HA H 1 4.240 0.007 A 11 LYS HBx H 1 1.829 0.008 A 11 LYS HBy H 1 2.175 0.006 A 11 LYS HEx H 1 3.101 0.000 A 11 LYS HGx H 1 1.476 0.009 A 12 THR H H 1 7.740 0.003 A 12 THR HA H 1 4.240 0.002 A 12 THR HB H 1 4.038 0.004 A 12 THR HG2% H 1 1.268 0.003 A 13 ARG H H 1 8.200 0.003 A 13 ARG HA H 1 4.557 0.004 A 13 ARG HBx H 1 1.087 0.006 A 13 ARG HBy H 1 1.374 0.009 A 13 ARG HGy H 1 1.733 0.001 A 13 ARG HGx H 1 1.264 0.008 A 14 CYS H H 1 7.743 0.006 A 14 CYS HA H 1 1.474 0.003 A 14 CYS HBy H 1 2.933 0.007 A 14 CYS HBx H 1 2.814 0.002 A 15 LEU H H 1 8.143 0.003 A 15 LEU HA H 1 6.244 0.002 A 15 LEU HBx H 1 2.918 0.003 A 15 LEU HBy H 1 3.242 0.009 A 15 LEU HDx% H 1 2.019 0.010 A 15 LEU HDy% H 1 1.435 0.039 A 15 LEU HG H 1 2.364 0.004 A 16 GLN H H 1 9.961 0.001 A 16 GLN HA H 1 4.832 0.000 A 16 GLN HBx H 1 2.677 0.002 A 16 GLN HE2x H 1 6.930 0.000 A 16 GLN HE2y H 1 7.439 0.000 A 16 GLN HGx H 1 2.831 0.000 A 16 GLN HGy H 1 2.945 0.003 A 17 CYS H H 1 9.961 0.009 A 17 CYS HA H 1 5.661 0.004 A 17 CYS HBx H 1 2.220 0.007 A 17 CYS HBy H 1 2.491 0.009 A 18 HIS H H 1 10.592 0.017 A 18 HIS HA H 1 8.523 0.009 A 18 HIS HBx H 1 9.167 0.009 A 18 HIS HBy H 1 13.912 0.011 A 18 HIS HD1 H 1 12.190 0.009 A 18 HIS HD2 H 1 19.304 0.012 A 18 HIS HE1 H 1 -11.98 0.000 A 19 THR H H 1 10.271 0.010 A 19 THR HA H 1 6.076 0.011 A 19 THR HB H 1 5.401 0.009 A 19 THR HG2% H 1 2.158 0.008 A 20 VAL H H 1 9.167 0.013 A 20 VAL HA H 1 4.851 0.011 A 20 VAL HB H 1 2.168 0.007 A 20 VAL HGx% H 1 0.445 0.011 A 20 VAL HGy% H 1 0.753 0.010 A 21 GLU H H 1 9.353 0.011 A 21 GLU HA H 1 4.468 0.013 A 21 GLU HBx H 1 2.193 0.008 A 21 GLU HBy H 1 2.400 0.001 A 21 GLU HGx H 1 2.646 0.009 A 21 GLU HGy H 1 2.800 0.013 A 22 LYS H H 1 9.566 0.012 A 22 LYS HA H 1 3.797 0.005 A 22 LYS HBx H 1 1.792 0.000 A 22 LYS HDx H 1 1.545 0.000 A 22 LYS HGx H 1 1.125 0.000 A 22 LYS HGy H 1 1.297 0.000 A 23 GLY H H 1 9.546 0.008 A 23 GLY HAx H 1 3.803 0.010 A 23 GLY HAy H 1 4.093 0.009 A 24 GLY H H 1 8.353 0.012 A 24 GLY HAx H 1 3.776 0.022 A 24 GLY HAy H 1 4.374 0.014 A 25 PRO HA H 1 4.557 0.009 A 25 PRO HBx H 1 2.191 0.019 A 25 PRO HBy H 1 2.336 0.021 A 25 PRO HDx H 1 3.466 0.012 A 25 PRO HGx H 1 1.919 0.000 A 25 PRO HGy H 1 2.054 0.018 A 26 HIS HA H 1 4.856 0.024 A 26 HIS HBx H 1 2.815 0.021 A 26 HIS HBy H 1 3.020 0.055 A 26 HIS HD2 H 1 7.186 0.012 A 26 HIS HE2 H 1 7.721 0.013 A 27 LYS H H 1 8.395 0.012 A 27 LYS HBx H 1 1.805 0.011 A 27 LYS HBy H 1 2.367 0.000 A 27 LYS HGx H 1 1.231 0.005 A 28 VAL H H 1 7.759 0.007 A 28 VAL HA H 1 3.315 0.006 A 28 VAL HB H 1 1.371 0.018 A 28 VAL HGx% H 1 -0.623 0.012 A 28 VAL HGy% H 1 0.808 0.016 A 29 GLY H H 1 7.665 0.014 A 29 GLY HAx H 1 -2.778 0.019 A 29 GLY HAy H 1 -0.273 0.016 A 30 PRO HA H 1 3.934 0.021 A 30 PRO HBx H 1 -0.244 0.031 A 30 PRO HBy H 1 1.340 0.025 A 30 PRO HDy H 1 -0.758 0.023 A 30 PRO HDx H 1 -3.078 0.008 A 30 PRO HGx H 1 -0.634 0.035 A 31 ASN H H 1 9.976 0.010 A 31 ASN HA H 1 6.160 0.018 A 31 ASN HBx H 1 2.477 0.005 A 31 ASN HBy H 1 2.954 0.010 A 31 ASN HD2x H 1 8.029 0.011 A 31 ASN HD2y H 1 8.337 0.011 A 32 LEU H H 1 9.635 0.018 A 32 LEU HA H 1 4.760 0.009 A 32 LEU HBx H 1 1.992 0.011 A 32 LEU HBy H 1 2.379 0.008 A 32 LEU HDx% H 1 0.991 0.013 A 32 LEU HDy% H 1 0.595 0.011 A 33 HIS H H 1 7.334 0.015 A 33 HIS HA H 1 4.285 0.018 A 33 HIS HBx H 1 3.209 0.006 A 33 HIS HBy H 1 3.337 0.013 A 34 GLY H H 1 9.079 0.008 A 34 GLY HAx H 1 3.718 0.003 A 34 GLY HAy H 1 3.750 0.005 A 35 ILE H H 1 7.151 0.015 A 35 ILE HA H 1 3.604 0.008 A 35 ILE HB H 1 1.687 0.006 A 35 ILE HD1% H 1 0.107 0.017 A 35 ILE HG1y H 1 0.462 0.007 A 35 ILE HG2% H 1 0.168 0.018 A 36 PHE H H 1 7.787 0.015 A 36 PHE HA H 1 4.144 0.031 A 36 PHE HBx H 1 2.772 0.004 A 36 PHE HBy H 1 2.847 0.003 A 36 PHE HDx H 1 6.928 0.020 A 36 PHE HEx H 1 6.173 0.010 A 36 PHE HZ H 1 6.262 0.003 A 37 GLY H H 1 8.679 0.011 A 37 GLY HAx H 1 3.618 0.012 A 37 GLY HAy H 1 4.185 0.002 A 38 ARG H H 1 7.793 0.016 A 38 ARG HBx H 1 1.715 0.014 A 38 ARG HDx H 1 3.151 0.001 A 38 ARG HDy H 1 3.324 0.000 A 38 ARG HGx H 1 1.984 0.012 A 39 HIS H H 1 8.030 0.008 A 39 HIS HA H 1 5.100 0.000 A 39 HIS HBx H 1 2.737 0.015 A 39 HIS HBy H 1 2.957 0.007 A 39 HIS HD1 H 1 6.880 0.013 A 39 HIS HD2 H 1 6.687 0.008 A 39 HIS HE1 H 1 7.931 0.011 A 40 SER H H 1 8.708 0.007 A 40 SER HA H 1 4.374 0.017 A 40 SER HBx H 1 3.855 0.013 A 40 SER HBy H 1 4.040 0.017 A 41 GLY H H 1 8.616 0.021 A 41 GLY HAx H 1 1.661 0.016 A 41 GLY HAy H 1 3.172 0.013 A 42 GLN H H 1 7.900 0.015 A 42 GLN HA H 1 4.251 0.004 A 42 GLN HBx H 1 1.711 0.008 A 42 GLN HBy H 1 2.362 0.011 A 42 GLN HE2y H 1 7.199 0.006 A 42 GLN HE2x H 1 6.671 0.009 A 42 GLN HGx H 1 2.117 0.010 A 42 GLN HGy H 1 2.201 0.009 A 43 ALA H H 1 8.191 0.011 A 43 ALA HA H 1 4.136 0.004 A 43 ALA HB% H 1 1.287 0.011 A 44 GLU H H 1 8.663 0.011 A 44 GLU HA H 1 4.145 0.005 A 44 GLU HBx H 1 2.089 0.001 A 44 GLU HBy H 1 2.340 0.000 A 44 GLU HGy H 1 2.572 0.004 A 44 GLU HGx H 1 2.470 0.003 A 45 GLY H H 1 7.154 0.003 A 45 GLY HAx H 1 3.754 0.014 A 45 GLY HAy H 1 4.070 0.017 A 46 TYR H H 1 6.933 0.003 A 46 TYR HA H 1 3.699 0.024 A 46 TYR HBx H 1 0.767 0.005 A 46 TYR HBy H 1 1.766 0.018 A 46 TYR HDx H 1 4.546 0.002 A 46 TYR HDy H 1 5.843 0.023 A 46 TYR HEx H 1 3.491 0.032 A 46 TYR HEy H 1 5.223 0.009 A 47 SER HA H 1 4.100 0.005 A 47 SER HBy H 1 3.149 0.009 A 47 SER HBx H 1 2.960 0.008 A 48 TYR H H 1 7.563 0.016 A 48 TYR HA H 1 4.111 0.017 A 48 TYR HBx H 1 2.587 0.010 A 48 TYR HBy H 1 3.294 0.020 A 48 TYR HDx H 1 6.932 0.005 A 49 THR H H 1 7.989 0.024 A 49 THR HA H 1 4.265 0.005 A 49 THR HB H 1 4.528 0.015 A 49 THR HG2% H 1 1.397 0.013 A 50 ASP H H 1 8.714 0.015 A 50 ASP HA H 1 4.316 0.004 A 50 ASP HBx H 1 2.575 0.009 A 50 ASP HBy H 1 2.632 0.013 A 51 ALA H H 1 8.127 0.022 A 51 ALA HA H 1 4.120 0.005 A 51 ALA HB% H 1 1.737 0.013 A 52 ASN H H 1 8.407 0.019 A 52 ASN HA H 1 4.659 0.007 A 52 ASN HBy H 1 3.152 0.011 A 52 ASN HBx H 1 3.075 0.015 A 52 ASN HD2x H 1 6.846 0.022 A 52 ASN HD2y H 1 7.471 0.022 A 53 ILE H H 1 7.643 0.018 A 53 ILE HA H 1 3.697 0.011 A 53 ILE HB H 1 1.695 0.013 A 53 ILE HD1% H 1 1.056 0.009 A 53 ILE HG1x H 1 1.096 0.000 A 53 ILE HG1y H 1 1.239 0.015 A 53 ILE HG2% H 1 0.989 0.021 A 54 LYS H H 1 8.948 0.012 A 54 LYS HA H 1 4.106 0.015 A 54 LYS HBy H 1 1.761 0.008 A 54 LYS HBx H 1 1.538 0.005 A 54 LYS HGx H 1 1.373 0.002 A 55 LYS H H 1 7.419 0.001 A 55 LYS HA H 1 4.036 0.002 A 55 LYS HBx H 1 1.837 0.004 A 55 LYS HBy H 1 2.123 0.009 A 55 LYS HGx H 1 1.313 0.033 A 56 ASN H H 1 7.414 0.000 A 56 ASN HA H 1 4.301 0.014 A 56 ASN HBx H 1 2.270 0.002 A 56 ASN HBy H 1 3.326 0.005 A 56 ASN HD2x H 1 6.404 0.000 A 56 ASN HD2y H 1 7.190 0.000 A 57 VAL H H 1 7.776 0.004 A 57 VAL HA H 1 3.968 0.013 A 57 VAL HB H 1 1.453 0.004 A 57 VAL HGx% H 1 0.468 0.009 A 57 VAL HGy% H 1 0.585 0.010 A 58 LEU H H 1 8.402 0.011 A 58 LEU HA H 1 3.782 0.010 A 58 LEU HBx H 1 0.680 0.010 A 58 LEU HBy H 1 1.416 0.008 A 58 LEU HDx% H 1 0.466 0.008 A 58 LEU HDy% H 1 0.563 0.011 A 58 LEU HG H 1 1.225 0.007 A 59 TRP H H 1 7.766 0.013 A 59 TRP HBx H 1 2.339 0.016 A 59 TRP HBy H 1 3.567 0.025 A 59 TRP HD1 H 1 6.972 0.037 A 59 TRP HE1 H 1 7.469 0.033 A 59 TRP HE3 H 1 6.680 0.018 A 59 TRP HH2 H 1 7.156 0.009 A 59 TRP HZ2 H 1 7.086 0.017 A 59 TRP HZ3 H 1 6.874 0.011 A 60 ASP H H 1 9.950 0.053 A 60 ASP HA H 1 4.772 0.002 A 60 ASP HBy H 1 2.939 0.003 A 60 ASP HBx H 1 2.677 0.002 A 61 GLU H H 1 10.010 0.004 A 61 GLU HA H 1 3.300 0.011 A 61 GLU HBx H 1 1.081 0.013 A 61 GLU HBy H 1 1.264 0.012 A 61 GLU HGx H 1 0.849 0.018 A 62 ASN H H 1 8.207 0.011 A 62 ASN HA H 1 4.567 0.004 A 62 ASN HBx H 1 2.890 0.010 A 62 ASN HBy H 1 2.937 0.016 A 62 ASN HD2x H 1 7.136 0.010 A 62 ASN HD2y H 1 7.777 0.006 A 63 ASN H H 1 9.442 0.014 A 63 ASN HA H 1 4.463 0.021 A 63 ASN HBx H 1 2.869 0.021 A 63 ASN HBy H 1 3.062 0.014 A 63 ASN HD2y H 1 7.320 0.001 A 63 ASN HD2x H 1 7.023 0.014 A 64 MET H H 1 8.891 0.018 A 64 MET HA H 1 4.330 0.026 A 64 MET HBx H 1 2.074 0.011 A 64 MET HBy H 1 2.341 0.013 A 64 MET HE% H 1 -0.524 0.054 A 64 MET HGx H 1 1.642 0.007 A 64 MET HGy H 1 1.750 0.015 A 65 SER H H 1 7.660 0.009 A 65 SER HA H 1 3.572 0.026 A 65 SER HBy H 1 3.921 0.001 A 65 SER HBx H 1 3.774 0.000 A 66 GLU H H 1 7.657 0.001 A 66 GLU HA H 1 3.910 0.003 A 66 GLU HBx H 1 2.010 0.016 A 66 GLU HGx H 1 2.318 0.014 A 66 GLU HGy H 1 2.343 0.009 A 67 TYR H H 1 8.935 0.025 A 67 TYR HA H 1 4.396 0.008 A 67 TYR HBx H 1 2.725 0.020 A 67 TYR HBy H 1 2.932 0.012 A 67 TYR HDx H 1 7.503 0.024 A 67 TYR HEx H 1 7.800 0.021 A 68 LEU H H 1 8.189 0.014 A 68 LEU HA H 1 3.752 0.011 A 68 LEU HBx H 1 0.472 0.005 A 68 LEU HBy H 1 0.560 0.028 A 68 LEU HDx% H 1 -0.989 0.025 A 68 LEU HDy% H 1 -2.768 0.020 A 68 LEU HG H 1 0.795 0.026 A 69 THR H H 1 7.421 0.008 A 69 THR HA H 1 3.851 0.012 A 69 THR HB H 1 4.340 0.021 A 69 THR HG2% H 1 1.200 0.004 A 70 ASN H H 1 6.632 0.042 A 70 ASN HA H 1 5.002 0.009 A 70 ASN HBx H 1 3.349 0.018 A 70 ASN HBy H 1 3.469 0.013 A 70 ASN HD2x H 1 6.671 0.017 A 70 ASN HD2y H 1 7.437 0.025 A 71 HIS H H 1 11.262 0.026 A 71 HIS HA H 1 10.271 0.018 A 71 HIS HBy H 1 8.683 0.345 A 71 HIS HBx H 1 7.799 0.050 A 71 HIS HD1 H 1 17.004 0.018 A 71 HIS HD2 H 1 30.239 0.020 A 72 ALA H H 1 9.567 0.021 A 72 ALA HA H 1 6.225 0.016 A 72 ALA HB% H 1 1.791 0.014 A 73 LYS H H 1 8.017 0.010 A 73 LYS HA H 1 4.461 0.002 A 73 LYS HBx H 1 2.030 0.001 A 74 TYR H H 1 8.270 0.018 A 74 TYR HA H 1 4.213 0.002 A 74 TYR HBx H 1 3.963 0.000 A 74 TYR HBy H 1 4.138 0.013 A 74 TYR HDx H 1 7.782 0.002 A 74 TYR HEx H 1 7.169 0.008 A 75 ILE H H 1 9.605 0.001 A 75 ILE HA H 1 4.755 0.014 A 75 ILE HB H 1 3.270 0.013 A 75 ILE HD1% H 1 1.977 0.016 A 75 ILE HG1x H 1 1.568 0.015 A 75 ILE HG2% H 1 1.268 0.017 A 76 PRO HA H 1 5.515 0.010 A 76 PRO HBx H 1 1.805 0.000 A 76 PRO HBy H 1 2.226 0.000 A 76 PRO HDx H 1 3.49 0.003 A 76 PRO HGx H 1 1.805 0.000 A 76 PRO HGy H 1 1.908 0.000 A 77 GLY H H 1 9.364 0.002 A 77 GLY HAx H 1 3.947 0.000 A 78 THR H H 1 8.938 0.025 A 78 THR HA H 1 5.970 0.032 A 78 THR HB H 1 5.565 0.029 A 78 THR HG2% H 1 2.104 0.001 A 79 LYS H H 1 8.058 0.034 A 79 LYS HBx H 1 1.380 0.003 A 79 LYS HBy H 1 1.654 0.001 A 79 LYS HDx H 1 0.742 0.004 A 79 LYS HEx H 1 2.114 0.018 A 79 LYS HEy H 1 2.332 0.024 A 79 LYS HGx H 1 -0.006 0.127 A 79 LYS HGy H 1 1.040 0.162 A 80 MET H H 1 8.681 0.018 A 80 MET HA H 1 4.582 0.018 A 80 MET HBy H 1 2.083 0.000 A 80 MET HBx H 1 1.905 0.000 A 81 ALA H H 1 8.014 0.035 A 81 ALA HA H 1 5.162 0.000 A 81 ALA HB% H 1 1.246 0.000 A 82 PHE H H 1 8.708 0.008 A 82 PHE HA H 1 4.424 0.012 A 82 PHE HBx H 1 2.837 0.024 A 82 PHE HBy H 1 3.312 0.009 A 82 PHE HDy H 1 6.262 0.005 A 82 PHE HEx H 1 6.961 0.014 A 82 PHE HZ H 1 6.182 0.027 A 84 GLY HAy H 1 4.328 0.008 A 85 LEU H H 1 8.409 0.019 A 85 LEU HA H 1 3.992 0.011 A 85 LEU HBx H 1 0.754 0.010 A 85 LEU HBy H 1 1.104 0.010 A 85 LEU HDx% H 1 -0.049 0.009 A 85 LEU HDy% H 1 0.435 0.015 A 85 LEU HG H 1 1.061 0.016 A 86 LYS H H 1 8.165 0.003 A 86 LYS HA H 1 3.970 0.062 A 86 LYS HBx H 1 1.875 0.000 A 87 LYS H H 1 8.256 0.025 A 87 LYS HA H 1 4.325 0.056 A 87 LYS HBx H 1 1.690 0.010 A 87 LYS HBy H 1 1.896 0.004 A 87 LYS HGx H 1 1.218 0.000 A 88 GLU H H 1 8.436 0.006 A 88 GLU HA H 1 3.335 0.012 A 88 GLU HBx H 1 1.805 0.015 A 88 GLU HBy H 1 1.949 0.013 A 89 LYS H H 1 8.711 0.014 A 89 LYS HA H 1 3.840 0.004 A 89 LYS HBx H 1 1.604 0.004 A 89 LYS HBy H 1 1.751 0.009 A 89 LYS HEy H 1 2.831 0.001 A 89 LYS HGx H 1 1.393 0.019 A 90 ASP H H 1 6.317 0.016 A 90 ASP HA H 1 4.062 0.007 A 90 ASP HBx H 1 2.285 0.008 A 90 ASP HBy H 1 2.741 0.009 A 91 ARG H H 1 7.422 0.017 A 91 ARG HA H 1 3.416 0.055 A 91 ARG HBx H 1 1.950 0.002 A 91 ARG HGx H 1 1.377 0.001 A 92 ASN H H 1 8.486 0.011 A 92 ASN HA H 1 3.838 0.009 A 92 ASN HBx H 1 2.641 0.026 A 92 ASN HBy H 1 2.818 0.011 A 92 ASN HD2x H 1 6.941 0.017 A 92 ASN HD2y H 1 7.201 0.013 A 93 ASP H H 1 8.620 0.013 A 93 ASP HA H 1 4.019 0.008 A 93 ASP HBx H 1 2.424 0.017 A 94 LEU H H 1 8.189 0.013 A 94 LEU HA H 1 3.636 0.007 A 94 LEU HBx H 1 1.243 0.013 A 94 LEU HBy H 1 1.351 0.012 A 94 LEU HDx% H 1 -0.059 0.032 A 94 LEU HDy% H 1 0.436 0.072 A 94 LEU HG H 1 1.076 0.009 A 95 ILE H H 1 8.672 0.011 A 95 ILE HA H 1 2.826 0.004 A 95 ILE HB H 1 1.696 0.007 A 95 ILE HD1% H 1 0.479 0.008 A 95 ILE HG1x H 1 0.277 0.028 A 95 ILE HG1y H 1 1.251 0.013 A 95 ILE HG2% H 1 0.141 0.038 A 96 THR H H 1 7.928 0.021 A 96 THR HA H 1 3.825 0.025 A 96 THR HB H 1 4.216 0.011 A 96 THR HG2% H 1 1.375 0.010 A 97 TYR H H 1 7.499 0.022 A 97 TYR HA H 1 3.981 0.006 A 97 TYR HBx H 1 2.721 0.007 A 97 TYR HBy H 1 3.457 0.009 A 97 TYR HEy H 1 7.184 0.020 A 98 LEU H H 1 8.853 0.013 A 98 LEU HA H 1 2.939 0.006 A 98 LEU HBx H 1 1.729 0.009 A 98 LEU HDx% H 1 0.724 0.008 A 98 LEU HDy% H 1 1.073 0.030 A 98 LEU HG H 1 1.241 0.011 A 99 LYS H H 1 8.294 0.019 A 99 LYS HA H 1 3.286 0.015 A 99 LYS HBy H 1 1.366 0.004 A 99 LYS HBx H 1 1.193 0.007 A 99 LYS HDx H 1 0.734 0.008 A 99 LYS HGx H 1 0.662 0.011 A 100 LYS H H 1 6.365 0.013 A 100 LYS HA H 1 4.117 0.003 A 100 LYS HBy H 1 1.694 0.009 A 100 LYS HBx H 1 1.337 0.010 A 101 ALA H H 1 8.188 0.014 A 101 ALA HA H 1 3.883 0.002 A 101 ALA HB% H 1 0.465 0.000 A 102 THR H H 1 6.404 0.003 A 102 THR HB H 1 4.133 0.000 A 102 THR HG2% H 1 1.689 0.000 A 103 GLU H H 1 6.743 0.010 A 103 GLU HA H 1 3.987 0.002 A 103 GLU HBx H 1 1.944 0.019 A 103 GLU HBy H 1 2.265 0.007 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 -3 PHE HA A -3 PHE H 1.0 1.8 2.9 2 2 A -3 PHE H A -3 PHE HBy 1.0 1.8 5.0 3 3 A -3 PHE H A -3 PHE HBx 1.0 1.8 5.0 4 4 A -3 PHE HD% A -3 PHE HBy 1.0 1.8 2.9 5 5 A -3 PHE HD% A -3 PHE HBx 1.0 1.8 2.9 6 6 A -3 PHE HA A -3 PHE HD% 1.0 1.8 5.0 7 7 A -3 PHE HE% A -3 PHE HBy 1.0 1.8 5.0 8 8 A -3 PHE HE% A -3 PHE HBx 1.0 1.8 5.0 9 9 A -3 PHE HZ A -3 PHE HBy 1.0 1.8 6.0 10 10 A -3 PHE HZ A -3 PHE HBx 1.0 1.8 6.0 11 11 A -3 PHE HA A -3 PHE HBy 1.0 1.8 2.9 12 12 A -3 PHE HA A -3 PHE HBx 1.0 1.8 2.9 13 13 A -3 PHE HD% A -3 PHE HE% 1.0 1.8 5.0 14 14 A -3 PHE HE% A -3 PHE HZ 1.0 1.8 5.0 15 15 A -3 PHE HD% A -3 PHE HZ 1.0 1.8 5.0 16 16 A -3 PHE HA A -2 LYS H 1.0 1.8 5.0 17 17 A -2 LYS H A -3 PHE HBy 1.0 1.8 5.0 18 18 A -2 LYS H A -3 PHE HBx 1.0 1.8 5.0 19 19 A -3 PHE HBx A 65 SER HBy 1.0 1.8 5.0 20 19 A -3 PHE HBy A 65 SER HBy 1.0 1.8 5.0 21 19 A 65 SER HBx A -3 PHE HBx 1.0 1.8 5.0 22 19 A -3 PHE HBy A 65 SER HBx 1.0 1.8 5.0 23 20 A -3 PHE HD% A 61 GLU HBy 1.0 1.8 5.0 24 21 A -3 PHE HD% A 61 GLU HBx 1.0 1.8 5.0 25 22 A -3 PHE HD% A 61 GLU HGx 1.0 1.8 5.0 26 22 A -3 PHE HD% A 61 GLU HGy 1.0 1.8 5.0 27 23 A -3 PHE HD% A 95 ILE HB 1.0 1.8 5.0 28 24 A -3 PHE HD% A 95 ILE HG2% 1.0 1.8 5.0 29 25 A -3 PHE HD% A 95 ILE HD1% 1.0 1.8 5.0 30 26 A -3 PHE HE% A 95 ILE HB 1.0 1.8 5.0 31 27 A -3 PHE HE% A 95 ILE HG2% 1.0 1.8 5.0 32 28 A -3 PHE HE% A 95 ILE HD1% 1.0 1.8 5.0 33 29 A -3 PHE HZ A -1 ALA HB% 1.0 1.8 5.0 34 30 A -3 PHE HZ A 95 ILE HB 1.0 1.8 5.0 35 31 A -3 PHE HZ A 95 ILE HG2% 1.0 1.8 5.0 36 32 A -3 PHE HZ A 96 THR HG2% 1.0 1.8 5.0 37 33 A -3 PHE HZ A 96 THR HA 1.0 1.8 5.0 38 34 A -2 LYS H A -2 LYS HA 1.0 1.8 2.9 39 35 A -2 LYS H A -2 LYS HDx 1.0 1.8 5.0 40 35 A -2 LYS H A -2 LYS HDy 1.0 1.8 5.0 41 36 A -2 LYS H A -2 LYS HBx 1.0 1.8 3.5 42 36 A -2 LYS H A -2 LYS HBy 1.0 1.8 3.5 43 37 A -2 LYS H A -2 LYS HGx 1.0 1.8 5.0 44 37 A -2 LYS H A -2 LYS HGy 1.0 1.8 5.0 45 38 A -2 LYS HA A -2 LYS HBx 1.0 1.8 2.9 46 38 A -2 LYS HA A -2 LYS HBy 1.0 1.8 2.9 47 39 A -2 LYS HA A -2 LYS HGx 1.0 1.8 2.9 48 39 A -2 LYS HA A -2 LYS HGy 1.0 1.8 2.9 49 40 A -2 LYS HA A -2 LYS HDx 1.0 1.8 2.9 50 40 A -2 LYS HA A -2 LYS HDy 1.0 1.8 2.9 51 41 A -2 LYS HBx A -2 LYS HGx 1.0 1.8 2.9 52 41 A -2 LYS HBy A -2 LYS HGx 1.0 1.8 2.9 53 41 A -2 LYS HGy A -2 LYS HBx 1.0 1.8 2.9 54 41 A -2 LYS HBy A -2 LYS HGy 1.0 1.8 2.9 55 42 A -2 LYS HA A -1 ALA H 1.0 1.8 3.5 56 43 A 92 ASN HD2x A -2 LYS HBx 1.0 1.8 5.0 57 43 A -2 LYS HBy A 92 ASN HD2x 1.0 1.8 5.0 58 44 A 92 ASN HD2y A -2 LYS HBx 1.0 1.8 5.0 59 44 A -2 LYS HBy A 92 ASN HD2y 1.0 1.8 5.0 60 45 A 92 ASN HD2x A -2 LYS HGx 1.0 1.8 3.5 61 45 A -2 LYS HGy A 92 ASN HD2y 1.0 1.8 3.5 62 45 A -2 LYS HGy A 92 ASN HD2x 1.0 1.8 3.5 63 45 A 92 ASN HD2y A -2 LYS HGx 1.0 1.8 3.5 64 46 A -1 ALA HB% A -1 ALA H 1.0 1.8 2.9 65 47 A -1 ALA H A -1 ALA HA 1.0 1.8 2.9 66 48 A -1 ALA HB% A -1 ALA HA 1.0 1.8 2.9 67 49 A -3 PHE HZ A -1 ALA HB% 1.0 1.8 6.0 68 50 A -1 ALA HB% A 1 GLY H 1.0 1.8 3.5 69 51 A -1 ALA HB% A 92 ASN HD2x 1.0 1.8 5.0 70 51 A -1 ALA HB% A 92 ASN HD2y 1.0 1.8 5.0 71 52 A -1 ALA HA A 1 GLY H 1.0 1.8 3.5 72 53 A 1 GLY H A 1 GLY HAx 1.0 1.8 2.9 73 54 A 1 GLY H A 1 GLY HAy 1.0 1.8 2.9 74 55 A 96 THR HG2% A 1 GLY H 1.0 1.8 5.0 75 56 A 1 GLY H A 2 SER H 1.0 1.8 5.0 76 57 A 2 SER H A 1 GLY HAx 1.0 1.8 5.0 77 57 A 2 SER H A 1 GLY HAy 1.0 1.8 5.0 78 58 A 1 GLY HAy A 92 ASN HBy 1.0 1.8 5.0 79 58 A 1 GLY HAx A 92 ASN HBy 1.0 1.8 5.0 80 59 A 92 ASN HBx A 1 GLY HAx 1.0 1.8 5.0 81 59 A 1 GLY HAy A 92 ASN HBx 1.0 1.8 5.0 82 60 A 96 THR HG2% A 1 GLY HAx 1.0 1.8 5.0 83 60 A 96 THR HG2% A 1 GLY HAy 1.0 1.8 5.0 84 61 A 2 SER H A 2 SER HA 1.0 1.8 2.9 85 62 A 2 SER H A 2 SER HG 1.0 1.8 5.0 86 63 A 2 SER H A 2 SER HA 1.0 1.8 2.9 87 64 A 2 SER H A 2 SER HBy 1.0 1.8 5.0 88 65 A 2 SER H A 2 SER HBx 1.0 1.8 5.0 89 66 A 2 SER HA A 2 SER HBy 1.0 1.8 2.9 90 67 A 2 SER HA A 2 SER HBx 1.0 1.8 2.9 91 68 A 2 SER H A 3 ALA HB% 1.0 1.8 5.0 92 69 A 2 SER H A 3 ALA H 1.0 1.8 5.0 93 70 A 2 SER H A 93 ASP HBy 1.0 1.8 5.0 94 70 A 2 SER H A 93 ASP HBx 1.0 1.8 5.0 95 71 A 2 SER H A 93 ASP HA 1.0 1.8 5.0 96 72 A 3 ALA H A 2 SER HBy 1.0 1.8 5.0 97 72 A 3 ALA H A 2 SER HBx 1.0 1.8 5.0 98 73 A 2 SER H A 92 ASN HBy 1.0 1.8 5.0 99 73 A 2 SER H A 92 ASN HBx 1.0 1.8 5.0 100 74 A 2 SER H A 4 LYS HEy 1.0 1.8 5.0 101 74 A 2 SER H A 4 LYS HEx 1.0 1.8 5.0 102 75 A 3 ALA HB% A 3 ALA H 1.0 1.8 2.9 103 76 A 3 ALA H A 3 ALA HA 1.0 1.8 2.9 104 77 A 3 ALA HA A 4 LYS H 1.0 1.8 3.5 105 78 A 3 ALA HA A 5 LYS H 1.0 1.8 5.0 106 79 A 3 ALA HA A 6 GLY H 1.0 1.8 5.0 107 80 A 3 ALA HA A 7 ALA H 1.0 1.8 6.0 108 81 A 3 ALA H A 4 LYS H 1.0 1.8 5.0 109 82 A 3 ALA H A 5 LYS H 1.0 1.8 5.0 110 83 A 96 THR HG2% A 3 ALA HA 1.0 1.8 5.0 111 84 A 3 ALA HA A 97 TYR HBy 1.0 1.8 5.0 112 85 A 3 ALA HA A 97 TYR HBx 1.0 1.8 5.0 113 86 A 3 ALA HB% A 4 LYS H 1.0 1.8 3.5 114 87 A 4 LYS H A 4 LYS HGx 1.0 1.8 2.9 115 87 A 4 LYS H A 4 LYS HGy 1.0 1.8 2.9 116 88 A 4 LYS H A 4 LYS HBx 1.0 1.8 2.9 117 88 A 4 LYS H A 4 LYS HBy 1.0 1.8 2.9 118 89 A 4 LYS HEx A 4 LYS H 1.0 1.8 2.9 119 90 A 4 LYS HEy A 4 LYS H 1.0 1.8 2.9 120 91 A 4 LYS H A 5 LYS H 1.0 1.8 3.5 121 92 A 5 LYS H A 4 LYS HA 1.0 1.8 5.0 122 93 A 5 LYS H A 4 LYS HBx 1.0 1.8 5.0 123 93 A 5 LYS H A 4 LYS HBy 1.0 1.8 5.0 124 94 A 4 LYS H A 6 GLY H 1.0 1.8 5.0 125 95 A 5 LYS H A 5 LYS HA 1.0 1.8 2.9 126 96 A 5 LYS H A 5 LYS HBy 1.0 1.8 3.5 127 97 A 5 LYS H A 5 LYS HBx 1.0 1.8 3.5 128 98 A 5 LYS HA A 5 LYS HBy 1.0 1.8 2.9 129 99 A 5 LYS HA A 5 LYS HBx 1.0 1.8 2.9 130 100 A 5 LYS H A 5 LYS HGx 1.0 1.8 2.9 131 100 A 5 LYS H A 5 LYS HGy 1.0 1.8 2.9 132 101 A 6 GLY H A 5 LYS HA 1.0 1.8 3.5 133 102 A 7 ALA H A 5 LYS HA 1.0 1.8 5.0 134 103 A 5 LYS HA A 8 THR H 1.0 1.8 5.0 135 104 A 5 LYS HA A 9 LEU H 1.0 1.8 5.0 136 105 A 6 GLY H A 5 LYS HBy 1.0 1.8 5.0 137 106 A 6 GLY H A 5 LYS HBx 1.0 1.8 5.0 138 107 A 5 LYS H A 6 GLY H 1.0 1.8 5.0 139 108 A 5 LYS H A 7 ALA H 1.0 1.8 5.0 140 109 A 5 LYS HGx A 93 ASP HBy 1.0 1.8 5.0 141 109 A 5 LYS HGy A 93 ASP HBy 1.0 1.8 5.0 142 109 A 93 ASP HBx A 5 LYS HGx 1.0 1.8 5.0 143 109 A 5 LYS HGy A 93 ASP HBx 1.0 1.8 5.0 144 110 A 6 GLY H A 6 GLY HAy 1.0 1.8 2.9 145 111 A 6 GLY H A 6 GLY HAx 1.0 1.8 2.9 146 112 A 6 GLY H A 93 ASP HBy 1.0 1.8 5.0 147 112 A 6 GLY H A 93 ASP HBx 1.0 1.8 5.0 148 113 A 7 ALA H A 6 GLY HAy 1.0 1.8 3.5 149 114 A 7 ALA H A 6 GLY HAx 1.0 1.8 3.5 150 115 A 8 THR H A 6 GLY HAy 1.0 1.8 5.0 151 115 A 8 THR H A 6 GLY HAx 1.0 1.8 5.0 152 116 A 9 LEU H A 6 GLY HAy 1.0 1.8 5.0 153 116 A 9 LEU H A 6 GLY HAx 1.0 1.8 5.0 154 117 A 9 LEU HBy A 6 GLY HAy 1.0 1.8 5.0 155 117 A 6 GLY HAy A 9 LEU HBx 1.0 1.8 5.0 156 118 A 6 GLY HAx A 9 LEU HBy 1.0 1.8 5.0 157 118 A 6 GLY HAx A 9 LEU HBx 1.0 1.8 5.0 158 119 A 9 LEU HDy% A 6 GLY HAy 1.0 1.8 5.0 159 119 A 6 GLY HAy A 9 LEU HDx% 1.0 1.8 5.0 160 120 A 6 GLY HAx A 9 LEU HDy% 1.0 1.8 5.0 161 120 A 6 GLY HAx A 9 LEU HDx% 1.0 1.8 5.0 162 121 A 10 PHE H A 6 GLY HAy 1.0 1.8 5.0 163 121 A 6 GLY HAx A 10 PHE H 1.0 1.8 5.0 164 122 A 93 ASP HBx A 6 GLY HAy 1.0 1.8 5.0 165 122 A 6 GLY HAy A 93 ASP HBy 1.0 1.8 5.0 166 123 A 93 ASP HBx A 6 GLY HAx 1.0 1.8 5.0 167 123 A 6 GLY HAx A 93 ASP HBy 1.0 1.8 5.0 168 124 A 94 LEU HA A 6 GLY HAy 1.0 1.8 5.0 169 124 A 6 GLY HAx A 94 LEU HA 1.0 1.8 5.0 170 125 A 6 GLY HAx A 94 LEU HDx% 1.0 1.8 5.0 171 125 A 6 GLY HAx A 94 LEU HDy% 1.0 1.8 5.0 172 125 A 6 GLY HAy A 94 LEU HDx% 1.0 1.8 5.0 173 125 A 94 LEU HDy% A 6 GLY HAy 1.0 1.8 5.0 174 126 A 6 GLY H A 7 ALA H 1.0 1.8 3.5 175 127 A 6 GLY H A 8 THR H 1.0 1.8 5.0 176 128 A 7 ALA HA A 7 ALA HB% 1.0 1.8 2.9 177 129 A 7 ALA H A 7 ALA HA 1.0 1.8 2.9 178 130 A 7 ALA H A 7 ALA HB% 1.0 1.8 2.9 179 131 A 7 ALA H A 97 TYR HBy 1.0 1.8 5.0 180 132 A 7 ALA H A 97 TYR HBx 1.0 1.8 5.0 181 133 A 8 THR H A 7 ALA HA 1.0 1.8 3.5 182 134 A 9 LEU H A 7 ALA HA 1.0 1.8 5.0 183 135 A 7 ALA HA A 10 PHE HBy 1.0 1.8 5.0 184 135 A 7 ALA HA A 10 PHE HBx 1.0 1.8 5.0 185 136 A 10 PHE H A 7 ALA HA 1.0 1.8 5.0 186 137 A 7 ALA HA A 11 LYS H 1.0 1.8 5.0 187 138 A 7 ALA HB% A 8 THR HA 1.0 1.8 5.0 188 139 A 8 THR H A 7 ALA HB% 1.0 1.8 2.9 189 140 A 9 LEU H A 7 ALA HB% 1.0 1.8 5.0 190 141 A 8 THR H A 8 THR HA 1.0 1.8 2.9 191 142 A 8 THR H A 8 THR HB 1.0 1.8 3.5 192 143 A 8 THR HA A 8 THR HG2% 1.0 1.8 3.5 193 144 A 8 THR H A 8 THR HG2% 1.0 1.8 3.5 194 145 A 8 THR HA A 8 THR HB 1.0 1.8 2.9 195 146 A 8 THR HB A 8 THR HG2% 1.0 1.8 3.5 196 147 A 7 ALA H A 8 THR H 1.0 1.8 3.5 197 148 A 8 THR H A 9 LEU H 1.0 1.8 2.9 198 149 A 8 THR H A 10 PHE H 1.0 1.8 5.0 199 150 A 9 LEU H A 8 THR HA 1.0 1.8 3.5 200 151 A 10 PHE H A 8 THR HA 1.0 1.8 5.0 201 152 A 8 THR HA A 11 LYS HBy 1.0 1.8 5.0 202 153 A 8 THR HA A 11 LYS HBx 1.0 1.8 5.0 203 154 A 8 THR HA A 11 LYS HGx 1.0 1.8 5.0 204 154 A 8 THR HA A 11 LYS HGy 1.0 1.8 5.0 205 155 A 11 LYS H A 8 THR HA 1.0 1.8 5.0 206 156 A 8 THR HA A 12 THR H 1.0 1.8 5.0 207 157 A 9 LEU H A 8 THR HB 1.0 1.8 5.0 208 158 A 8 THR HB A 11 LYS HGx 1.0 1.8 5.0 209 158 A 8 THR HB A 11 LYS HGy 1.0 1.8 5.0 210 159 A 8 THR HB A 12 THR HG2% 1.0 1.8 5.0 211 160 A 9 LEU H A 8 THR HG2% 1.0 1.8 5.0 212 161 A 11 LYS H A 8 THR HG2% 1.0 1.8 6.0 213 162 A 9 LEU HA A 9 LEU HDx% 1.0 1.8 5.0 214 163 A 9 LEU HA A 9 LEU HDy% 1.0 1.8 5.0 215 164 A 9 LEU H A 9 LEU HA 1.0 1.8 2.9 216 165 A 9 LEU HBx A 9 LEU HDx% 1.0 1.8 2.9 217 165 A 9 LEU HBy A 9 LEU HDx% 1.0 1.8 2.9 218 166 A 9 LEU HDy% A 9 LEU HBx 1.0 1.8 2.9 219 166 A 9 LEU HBy A 9 LEU HDy% 1.0 1.8 2.9 220 167 A 9 LEU H A 9 LEU HBx 1.0 1.8 2.9 221 167 A 9 LEU H A 9 LEU HBy 1.0 1.8 2.9 222 168 A 9 LEU H A 9 LEU HG 1.0 1.8 5.0 223 169 A 9 LEU H A 9 LEU HDx% 1.0 1.8 3.5 224 169 A 9 LEU H A 9 LEU HDy% 1.0 1.8 3.5 225 170 A 9 LEU HG A 9 LEU HDx% 1.0 1.8 3.5 226 171 A 9 LEU HG A 9 LEU HDy% 1.0 1.8 3.5 227 172 A 9 LEU HA A 9 LEU HG 1.0 1.8 3.5 228 173 A 9 LEU H A 10 PHE H 1.0 1.8 3.5 229 174 A 9 LEU H A 11 LYS H 1.0 1.8 5.0 230 175 A 10 PHE H A 9 LEU HA 1.0 1.8 3.5 231 176 A 11 LYS H A 9 LEU HA 1.0 1.8 5.0 232 177 A 12 THR H A 9 LEU HA 1.0 1.8 5.0 233 178 A 9 LEU HA A 12 THR HB 1.0 1.8 5.0 234 179 A 9 LEU HA A 13 ARG H 1.0 1.8 5.0 235 180 A 9 LEU HA A 94 LEU HDx% 1.0 1.8 5.0 236 180 A 9 LEU HA A 94 LEU HDy% 1.0 1.8 5.0 237 181 A 10 PHE H A 9 LEU HBx 1.0 1.8 2.9 238 181 A 9 LEU HBy A 10 PHE H 1.0 1.8 2.9 239 182 A 94 LEU HDy% A 9 LEU HBx 1.0 1.8 3.5 240 182 A 9 LEU HBx A 94 LEU HDx% 1.0 1.8 3.5 241 182 A 9 LEU HBy A 94 LEU HDx% 1.0 1.8 3.5 242 182 A 9 LEU HBy A 94 LEU HDy% 1.0 1.8 3.5 243 183 A 13 ARG HGy A 9 LEU HDx% 1.0 1.8 5.0 244 183 A 9 LEU HDx% A 13 ARG HGx 1.0 1.8 5.0 245 184 A 13 ARG HGy A 9 LEU HDy% 1.0 1.8 5.0 246 184 A 9 LEU HDy% A 13 ARG HGx 1.0 1.8 5.0 247 185 A 9 LEU HDx% A 85 LEU HDx% 1.0 1.8 5.0 248 185 A 9 LEU HDy% A 85 LEU HDx% 1.0 1.8 5.0 249 186 A 85 LEU HDy% A 9 LEU HDx% 1.0 1.8 5.0 250 187 A 9 LEU HDy% A 85 LEU HDy% 1.0 1.8 5.0 251 188 A 90 ASP HA A 9 LEU HDx% 1.0 1.8 5.0 252 188 A 9 LEU HDy% A 90 ASP HA 1.0 1.8 5.0 253 189 A 94 LEU HDy% A 9 LEU HDx% 1.0 1.8 5.0 254 189 A 9 LEU HDx% A 94 LEU HDx% 1.0 1.8 5.0 255 190 A 9 LEU HDx% A 94 LEU HDx% 1.0 1.8 5.0 256 191 A 94 LEU HDy% A 9 LEU HDx% 1.0 1.8 5.0 257 192 A 9 LEU HDy% A 94 LEU HDx% 1.0 1.8 5.0 258 193 A 94 LEU HDy% A 9 LEU HDy% 1.0 1.8 5.0 259 194 A 9 LEU H A 94 LEU HDx% 1.0 1.8 5.0 260 194 A 9 LEU H A 94 LEU HDy% 1.0 1.8 5.0 261 195 A 90 ASP HBy A 9 LEU HDx% 1.0 1.8 5.0 262 196 A 9 LEU HDy% A 90 ASP HBy 1.0 1.8 5.0 263 197 A 90 ASP HBx A 9 LEU HDx% 1.0 1.8 5.0 264 198 A 9 LEU HDy% A 90 ASP HBx 1.0 1.8 5.0 265 199 A 9 LEU HDy% A 93 ASP HBy 1.0 1.8 5.0 266 199 A 9 LEU HDx% A 93 ASP HBy 1.0 1.8 5.0 267 199 A 93 ASP HBx A 9 LEU HDx% 1.0 1.8 5.0 268 199 A 93 ASP HBx A 9 LEU HDy% 1.0 1.8 5.0 269 200 A 9 LEU HDy% A 94 LEU HBx 1.0 1.8 5.0 270 200 A 9 LEU HDx% A 94 LEU HBx 1.0 1.8 5.0 271 200 A 94 LEU HBy A 9 LEU HDx% 1.0 1.8 5.0 272 200 A 9 LEU HDy% A 94 LEU HBy 1.0 1.8 5.0 273 201 A 10 PHE H A 9 LEU HG 1.0 1.8 5.0 274 202 A 9 LEU HG A 94 LEU HDx% 1.0 1.8 5.0 275 202 A 9 LEU HG A 94 LEU HDy% 1.0 1.8 5.0 276 203 A 10 PHE H A 9 LEU HDx% 1.0 1.8 5.0 277 204 A 10 PHE H A 9 LEU HDy% 1.0 1.8 5.0 278 205 A 10 PHE H A 10 PHE HA 1.0 1.8 2.9 279 206 A 10 PHE H A 10 PHE HBx 1.0 1.8 3.5 280 207 A 10 PHE H A 10 PHE HBy 1.0 1.8 3.5 281 208 A 10 PHE HBx A 10 PHE HD% 1.0 1.8 3.5 282 209 A 10 PHE HD% A 10 PHE HBy 1.0 1.8 3.5 283 210 A 10 PHE HD% A 10 PHE HE% 1.0 1.8 2.9 284 211 A 10 PHE HD% A 10 PHE HZ 1.0 1.8 5.0 285 212 A 10 PHE HE% A 10 PHE HZ 1.0 1.8 2.9 286 213 A 10 PHE HBx A 10 PHE HBy 1.0 1.8 3.5 287 214 A 11 LYS H A 10 PHE HA 1.0 1.8 5.0 288 215 A 12 THR H A 10 PHE HA 1.0 1.8 5.0 289 216 A 13 ARG H A 10 PHE HA 1.0 1.8 5.0 290 217 A 10 PHE HA A 13 ARG HBx 1.0 1.8 5.0 291 217 A 10 PHE HA A 13 ARG HBy 1.0 1.8 5.0 292 218 A 10 PHE HA A 14 CYS H 1.0 1.8 5.0 293 219 A 10 PHE HA A 15 LEU H 1.0 1.8 5.0 294 220 A 10 PHE HA A 94 LEU HDx% 1.0 1.8 5.0 295 220 A 94 LEU HDy% A 10 PHE HA 1.0 1.8 5.0 296 221 A 11 LYS H A 10 PHE HBy 1.0 1.8 2.9 297 221 A 10 PHE HBx A 11 LYS H 1.0 1.8 2.9 298 222 A 10 PHE HBx A 94 LEU HDx% 1.0 1.8 6.0 299 223 A 10 PHE HBx A 94 LEU HDy% 1.0 1.8 6.0 300 224 A 10 PHE HBy A 94 LEU HDx% 1.0 1.8 5.0 301 225 A 94 LEU HDy% A 10 PHE HBy 1.0 1.8 5.0 302 226 A 11 LYS H A 10 PHE HBy 1.0 1.8 2.9 303 226 A 10 PHE HBx A 11 LYS H 1.0 1.8 2.9 304 227 A 97 TYR HE% A 10 PHE HBy 1.0 1.8 5.0 305 227 A 10 PHE HBx A 97 TYR HE% 1.0 1.8 5.0 306 228 A 97 TYR H A 10 PHE HBy 1.0 1.8 6.0 307 228 A 10 PHE HBx A 97 TYR H 1.0 1.8 6.0 308 229 A 10 PHE HBy A 98 LEU HDx% 1.0 1.8 5.0 309 229 A 10 PHE HBx A 98 LEU HDx% 1.0 1.8 5.0 310 230 A 10 PHE HBx A 98 LEU HDy% 1.0 1.8 5.0 311 230 A 98 LEU HDy% A 10 PHE HBy 1.0 1.8 5.0 312 231 A 11 LYS H A 10 PHE HD% 1.0 1.8 5.0 313 232 A 10 PHE HD% A 11 LYS HA 1.0 1.8 5.0 314 233 A 10 PHE HD% A 14 CYS HBy 1.0 1.8 5.0 315 233 A 10 PHE HD% A 14 CYS HBx 1.0 1.8 5.0 316 234 A 10 PHE HD% A 15 LEU H 1.0 1.8 5.0 317 235 A 10 PHE HD% A 15 LEU HA 1.0 1.8 5.0 318 236 A 10 PHE HD% A 15 LEU HBy 1.0 1.8 5.0 319 237 A 10 PHE HD% A 15 LEU HBx 1.0 1.8 5.0 320 238 A 10 PHE HD% A 15 LEU HDx% 1.0 1.8 5.0 321 239 A 10 PHE HD% A 15 LEU HDy% 1.0 1.8 5.0 322 240 A 10 PHE HD% A 94 LEU HDx% 1.0 1.8 5.0 323 240 A 94 LEU HDy% A 10 PHE HD% 1.0 1.8 5.0 324 241 A 10 PHE HD% A 98 LEU HDx% 1.0 1.8 5.0 325 242 A 10 PHE HD% A 98 LEU HDy% 1.0 1.8 5.0 326 243 A 10 PHE HBx A 20 VAL HGy% 1.0 1.8 5.0 327 243 A 10 PHE HBx A 20 VAL HGx% 1.0 1.8 5.0 328 243 A 10 PHE HBy A 20 VAL HGy% 1.0 1.8 5.0 329 243 A 20 VAL HGx% A 10 PHE HBy 1.0 1.8 5.0 330 244 A 10 PHE HE% A 15 LEU HBx 1.0 1.8 5.0 331 244 A 10 PHE HE% A 15 LEU HBy 1.0 1.8 5.0 332 245 A 10 PHE HE% A 19 THR HA 1.0 1.8 5.0 333 246 A 10 PHE HE% A 19 THR HG2% 1.0 1.8 5.0 334 247 A 10 PHE HE% A 20 VAL HGy% 1.0 1.8 5.0 335 247 A 10 PHE HE% A 20 VAL HGx% 1.0 1.8 5.0 336 248 A 10 PHE HE% A 32 LEU HDx% 1.0 1.8 5.0 337 248 A 10 PHE HE% A 32 LEU HDy% 1.0 1.8 5.0 338 249 A 10 PHE HE% A 98 LEU HDx% 1.0 1.8 5.0 339 250 A 10 PHE HE% A 98 LEU HDy% 1.0 1.8 5.0 340 251 A 10 PHE HZ A 14 CYS HBy 1.0 1.8 5.0 341 251 A 10 PHE HZ A 14 CYS HBx 1.0 1.8 5.0 342 252 A 10 PHE HZ A 15 LEU HDx% 1.0 1.8 5.0 343 252 A 10 PHE HZ A 15 LEU HDy% 1.0 1.8 5.0 344 253 A 10 PHE HZ A 18 HIS HBy 1.0 1.8 5.0 345 253 A 10 PHE HZ A 18 HIS HBx 1.0 1.8 5.0 346 254 A 10 PHE HZ A 19 THR HA 1.0 1.8 5.0 347 255 A 10 PHE HZ A 19 THR HB 1.0 1.8 6.0 348 256 A 10 PHE HZ A 20 VAL HA 1.0 1.8 5.0 349 257 A 10 PHE HZ A 20 VAL HB 1.0 1.8 5.0 350 258 A 10 PHE HZ A 20 VAL HGy% 1.0 1.8 5.0 351 258 A 10 PHE HZ A 20 VAL HGx% 1.0 1.8 5.0 352 259 A 10 PHE H A 12 THR H 1.0 1.8 5.0 353 260 A 11 LYS HBy A 11 LYS HGx 1.0 1.8 3.5 354 260 A 11 LYS HBy A 11 LYS HGy 1.0 1.8 3.5 355 261 A 11 LYS HBx A 11 LYS HGx 1.0 1.8 3.5 356 261 A 11 LYS HBx A 11 LYS HGy 1.0 1.8 3.5 357 262 A 11 LYS H A 11 LYS HBy 1.0 1.8 3.5 358 263 A 11 LYS H A 11 LYS HBx 1.0 1.8 3.5 359 264 A 11 LYS H A 11 LYS HGx 1.0 1.8 2.9 360 264 A 11 LYS H A 11 LYS HGy 1.0 1.8 2.9 361 265 A 11 LYS HA A 11 LYS HGx 1.0 1.8 3.5 362 265 A 11 LYS HGy A 11 LYS HA 1.0 1.8 3.5 363 266 A 11 LYS HBx A 11 LYS HA 1.0 1.8 3.5 364 267 A 11 LYS H A 11 LYS HA 1.0 1.8 5.0 365 268 A 10 PHE H A 11 LYS H 1.0 1.8 2.9 366 269 A 11 LYS H A 13 ARG H 1.0 1.8 5.0 367 270 A 12 THR H A 11 LYS HA 1.0 1.8 3.5 368 271 A 13 ARG H A 11 LYS HA 1.0 1.8 5.0 369 272 A 14 CYS H A 11 LYS HA 1.0 1.8 5.0 370 273 A 11 LYS HA A 14 CYS HBy 1.0 1.8 5.0 371 273 A 11 LYS HA A 14 CYS HBx 1.0 1.8 5.0 372 274 A 11 LYS HA A 15 LEU HDx% 1.0 1.8 5.0 373 275 A 11 LYS HA A 15 LEU HDy% 1.0 1.8 5.0 374 276 A 15 LEU H A 11 LYS HA 1.0 1.8 5.0 375 277 A 11 LYS HGx A 15 LEU HBx 1.0 1.8 5.0 376 277 A 11 LYS HGy A 15 LEU HBx 1.0 1.8 5.0 377 277 A 15 LEU HBy A 11 LYS HGx 1.0 1.8 5.0 378 277 A 11 LYS HGy A 15 LEU HBy 1.0 1.8 5.0 379 278 A 15 LEU HDy% A 11 LYS HGx 1.0 1.8 6.0 380 278 A 11 LYS HGy A 15 LEU HDx% 1.0 1.8 6.0 381 278 A 11 LYS HGy A 15 LEU HDy% 1.0 1.8 6.0 382 278 A 11 LYS HGx A 15 LEU HDx% 1.0 1.8 6.0 383 279 A 12 THR H A 12 THR HA 1.0 1.8 5.0 384 280 A 12 THR H A 12 THR HB 1.0 1.8 3.5 385 281 A 12 THR HA A 12 THR HB 1.0 1.8 3.5 386 282 A 12 THR HG2% A 12 THR HA 1.0 1.8 3.5 387 283 A 12 THR H A 12 THR HG2% 1.0 1.8 5.0 388 284 A 12 THR HG2% A 12 THR HB 1.0 1.8 2.9 389 285 A 11 LYS H A 12 THR H 1.0 1.8 2.9 390 286 A 12 THR H A 13 ARG H 1.0 1.8 2.9 391 287 A 12 THR H A 14 CYS H 1.0 1.8 5.0 392 288 A 13 ARG H A 12 THR HA 1.0 1.8 3.5 393 289 A 14 CYS H A 12 THR HA 1.0 1.8 6.0 394 290 A 13 ARG H A 12 THR HB 1.0 1.8 5.0 395 291 A 13 ARG H A 13 ARG HA 1.0 1.8 5.0 396 292 A 13 ARG H A 13 ARG HBy 1.0 1.8 5.0 397 293 A 13 ARG H A 13 ARG HBx 1.0 1.8 3.5 398 294 A 13 ARG HA A 13 ARG HGx 1.0 1.8 3.5 399 294 A 13 ARG HGy A 13 ARG HA 1.0 1.8 3.5 400 295 A 13 ARG H A 13 ARG HGx 1.0 1.8 5.0 401 296 A 13 ARG H A 13 ARG HGy 1.0 1.8 5.0 402 297 A 14 CYS H A 13 ARG HBx 1.0 1.8 2.9 403 298 A 13 ARG HBy A 14 CYS H 1.0 1.8 3.5 404 299 A 82 PHE HE% A 13 ARG HBx 1.0 1.8 5.0 405 300 A 13 ARG HBy A 82 PHE HE% 1.0 1.8 5.0 406 301 A 82 PHE HZ A 13 ARG HBx 1.0 1.8 6.0 407 302 A 13 ARG HBy A 82 PHE HZ 1.0 1.8 6.0 408 303 A 13 ARG HA B 1 HEC HAB 1.0 1.8 5.0 409 304 B 1 HEC HAB A 13 ARG HBx 1.0 1.8 5.0 410 305 A 13 ARG HBy B 1 HEC HAB 1.0 1.8 5.0 411 306 B 1 HEC HBB1 A 13 ARG HBx 1.0 1.8 5.0 412 307 A 13 ARG HBy B 1 HEC HBB1 1.0 1.8 5.0 413 308 B 1 HEC HHC A 13 ARG HBx 1.0 1.8 5.0 414 309 A 13 ARG HBy B 1 HEC HHC 1.0 1.8 5.0 415 310 A 14 CYS HBx A 14 CYS HA 1.0 1.8 2.9 416 311 A 14 CYS HA A 14 CYS HBy 1.0 1.8 2.9 417 312 A 14 CYS H A 14 CYS HA 1.0 1.8 2.9 418 313 A 14 CYS H A 14 CYS HBy 1.0 1.8 5.0 419 313 A 14 CYS H A 14 CYS HBx 1.0 1.8 5.0 420 314 A 15 LEU H A 14 CYS HA 1.0 1.8 3.5 421 315 B 1 HEC HAB A 14 CYS HA 1.0 1.8 3.5 422 316 A 14 CYS HA B 1 HEC HMC1 1.0 1.8 3.5 423 317 A 15 LEU H A 14 CYS HBx 1.0 1.8 5.0 424 318 A 15 LEU H A 14 CYS HBy 1.0 1.8 5.0 425 319 A 13 ARG H A 14 CYS H 1.0 1.8 2.9 426 320 A 14 CYS HBx B 1 HEC HHC 1.0 1.8 5.0 427 321 B 1 HEC HHC A 14 CYS HBy 1.0 1.8 5.0 428 322 A 14 CYS HBx B 1 HEC HBB1 1.0 1.8 5.0 429 323 B 1 HEC HBB1 A 14 CYS HBy 1.0 1.8 5.0 430 324 A 15 LEU H A 15 LEU HA 1.0 1.8 3.5 431 325 A 15 LEU H A 15 LEU HBy 1.0 1.8 5.0 432 326 A 15 LEU H A 15 LEU HBx 1.0 1.8 5.0 433 327 A 15 LEU H A 15 LEU HDx% 1.0 1.8 5.0 434 328 A 15 LEU H A 15 LEU HDy% 1.0 1.8 5.0 435 329 A 15 LEU HA A 15 LEU HDx% 1.0 1.8 5.0 436 330 A 15 LEU HA A 15 LEU HDy% 1.0 1.8 5.0 437 331 A 15 LEU HDy% A 15 LEU HBx 1.0 1.8 3.5 438 331 A 15 LEU HBx A 15 LEU HDx% 1.0 1.8 3.5 439 332 A 15 LEU HBy A 15 LEU HDy% 1.0 1.8 5.0 440 332 A 15 LEU HBy A 15 LEU HDx% 1.0 1.8 5.0 441 333 A 15 LEU H A 15 LEU HG 1.0 1.8 5.0 442 334 A 15 LEU HA A 15 LEU HBy 1.0 1.8 3.5 443 335 A 15 LEU HA A 15 LEU HBx 1.0 1.8 3.5 444 336 A 15 LEU HBy A 15 LEU HBx 1.0 1.8 3.5 445 337 A 15 LEU HG A 15 LEU HDx% 1.0 1.8 3.5 446 338 A 14 CYS H A 15 LEU H 1.0 1.8 5.0 447 339 A 15 LEU H A 17 CYS H 1.0 1.8 5.0 448 340 A 15 LEU HA A 16 GLN H 1.0 1.8 5.0 449 341 A 15 LEU HA A 17 CYS H 1.0 1.8 5.0 450 342 A 16 GLN H A 15 LEU HBx 1.0 1.8 2.9 451 342 A 15 LEU HBy A 16 GLN H 1.0 1.8 2.9 452 343 A 19 THR HA A 15 LEU HG 1.0 1.8 5.0 453 344 A 14 CYS H A 15 LEU HDx% 1.0 1.8 6.0 454 344 A 14 CYS H A 15 LEU HDy% 1.0 1.8 6.0 455 345 A 19 THR HG2% A 15 LEU HDx% 1.0 1.8 3.5 456 345 A 19 THR HG2% A 15 LEU HDy% 1.0 1.8 3.5 457 346 A 19 THR HA A 15 LEU HDx% 1.0 1.8 5.0 458 346 A 19 THR HA A 15 LEU HDy% 1.0 1.8 5.0 459 347 A 19 THR HB A 15 LEU HDx% 1.0 1.8 5.0 460 347 A 15 LEU HDy% A 19 THR HB 1.0 1.8 5.0 461 348 A 15 LEU HDy% A 16 GLN HGx 1.0 1.8 6.0 462 348 A 15 LEU HDy% A 16 GLN HGy 1.0 1.8 6.0 463 349 A 16 GLN HGx A 15 LEU HDx% 1.0 1.8 6.0 464 349 A 15 LEU HDx% A 16 GLN HGy 1.0 1.8 6.0 465 350 A 16 GLN H A 16 GLN HBx 1.0 1.8 3.5 466 350 A 16 GLN H A 16 GLN HBy 1.0 1.8 3.5 467 351 A 16 GLN H A 16 GLN HGy 1.0 1.8 5.0 468 351 A 16 GLN H A 16 GLN HGx 1.0 1.8 5.0 469 352 A 15 LEU H A 16 GLN H 1.0 1.8 5.0 470 353 A 17 CYS H A 16 GLN HA 1.0 1.8 5.0 471 354 A 17 CYS H A 16 GLN HBx 1.0 1.8 5.0 472 354 A 17 CYS H A 16 GLN HBy 1.0 1.8 5.0 473 355 A 17 CYS H A 16 GLN HGy 1.0 1.8 5.0 474 355 A 17 CYS H A 16 GLN HGx 1.0 1.8 5.0 475 356 A 17 CYS H A 17 CYS HA 1.0 1.8 5.0 476 357 A 17 CYS HA A 29 GLY H 1.0 1.8 5.0 477 358 A 17 CYS HA A 18 HIS H 1.0 1.8 3.5 478 359 A 18 HIS H A 17 CYS HBy 1.0 1.8 3.5 479 360 A 18 HIS H A 17 CYS HBx 1.0 1.8 3.5 480 361 A 17 CYS HBx A 18 HIS HBy 1.0 1.8 5.0 481 361 A 17 CYS HBy A 18 HIS HBy 1.0 1.8 5.0 482 361 A 18 HIS HBx A 17 CYS HBx 1.0 1.8 5.0 483 361 A 18 HIS HBx A 17 CYS HBy 1.0 1.8 5.0 484 362 B 1 HEC HMC1 A 17 CYS HBx 1.0 1.8 5.0 485 362 B 1 HEC HMC1 A 17 CYS HBy 1.0 1.8 5.0 486 363 A 28 VAL H A 17 CYS HBx 1.0 1.8 5.0 487 363 A 17 CYS HBy A 28 VAL H 1.0 1.8 5.0 488 364 A 28 VAL HB A 17 CYS HBx 1.0 1.8 5.0 489 364 A 17 CYS HBy A 28 VAL HB 1.0 1.8 5.0 490 365 A 17 CYS HBy A 28 VAL HGy% 1.0 1.8 5.0 491 365 A 17 CYS HBx A 28 VAL HGy% 1.0 1.8 5.0 492 365 A 28 VAL HGx% A 17 CYS HBx 1.0 1.8 5.0 493 365 A 17 CYS HBy A 28 VAL HGx% 1.0 1.8 5.0 494 366 A 29 GLY H A 17 CYS HBy 1.0 1.8 6.0 495 367 A 29 GLY H A 17 CYS HBx 1.0 1.8 6.0 496 368 A 13 ARG HBy A 17 CYS H 1.0 1.8 6.0 497 368 A 17 CYS H A 13 ARG HBx 1.0 1.8 6.0 498 369 A 17 CYS HA A 19 THR H 1.0 1.8 6.3 499 370 A 18 HIS H A 18 HIS HBy 1.0 1.8 5.0 500 371 A 18 HIS HBx A 18 HIS H 1.0 1.8 3.5 501 372 A 18 HIS HD1 A 18 HIS HBy 1.0 1.8 5.0 502 372 A 18 HIS HBx A 18 HIS HD1 1.0 1.8 5.0 503 373 A 18 HIS HD2 A 18 HIS HBy 1.0 1.8 5.0 504 373 A 18 HIS HBx A 18 HIS HD2 1.0 1.8 5.0 505 374 A 19 THR H A 18 HIS HA 1.0 1.8 5.0 506 375 A 19 THR HA A 18 HIS HA 1.0 1.8 5.0 507 376 A 18 HIS HA A 31 ASN HA 1.0 1.8 5.0 508 377 A 18 HIS HD1 A 31 ASN HD2y 1.0 1.8 3.5 509 377 A 18 HIS HD1 A 31 ASN HD2x 1.0 1.8 3.5 510 378 A 18 HIS HD1 A 32 LEU H 1.0 1.8 5.0 511 379 A 19 THR H A 18 HIS HBy 1.0 1.8 6.0 512 380 A 18 HIS HBx A 19 THR H 1.0 1.8 6.0 513 381 A 32 LEU H A 18 HIS HBy 1.0 1.8 5.0 514 381 A 18 HIS HBx A 32 LEU H 1.0 1.8 5.0 515 382 A 18 HIS HBx A 32 LEU HBx 1.0 1.8 6.0 516 382 A 18 HIS HBy A 32 LEU HBx 1.0 1.8 6.0 517 382 A 32 LEU HBy A 18 HIS HBy 1.0 1.8 6.0 518 382 A 18 HIS HBx A 32 LEU HBy 1.0 1.8 6.0 519 383 B 1 HEC HHC A 18 HIS H 1.0 1.8 5.0 520 384 A 19 THR HA A 18 HIS HA 1.0 1.8 5.0 521 385 A 19 THR HA A 19 THR HB 1.0 1.8 2.9 522 386 A 19 THR HA A 19 THR HG2% 1.0 1.8 2.9 523 387 A 19 THR HG2% A 19 THR HB 1.0 1.8 2.9 524 388 A 19 THR HG2% A 19 THR H 1.0 1.8 5.0 525 389 A 19 THR HA A 19 THR H 1.0 1.8 5.0 526 390 A 19 THR HB A 19 THR H 1.0 1.8 5.0 527 391 A 19 THR HG2% A 25 PRO HDx 1.0 1.8 3.5 528 391 A 19 THR HG2% A 25 PRO HDy 1.0 1.8 3.5 529 392 A 19 THR HG2% A 20 VAL H 1.0 1.8 5.0 530 393 A 19 THR HG2% A 31 ASN HD2x 1.0 1.8 5.0 531 393 A 19 THR HG2% A 31 ASN HD2y 1.0 1.8 5.0 532 394 A 19 THR H A 31 ASN H 1.0 1.8 6.0 533 395 A 19 THR H A 31 ASN HA 1.0 1.8 5.0 534 396 A 19 THR HB A 24 GLY HAy 1.0 1.8 6.0 535 397 A 19 THR HB A 24 GLY HAx 1.0 1.8 6.0 536 398 A 20 VAL HGx% A 19 THR HA 1.0 1.8 6.0 537 399 A 19 THR HA A 20 VAL HGy% 1.0 1.8 5.0 538 400 A 20 VAL HGx% A 19 THR HB 1.0 1.8 6.0 539 401 A 19 THR HB A 20 VAL HGy% 1.0 1.8 5.0 540 402 A 19 THR HA A 20 VAL H 1.0 1.8 5.0 541 403 A 19 THR H A 20 VAL H 1.0 1.8 6.0 542 404 A 19 THR HB A 20 VAL H 1.0 1.8 5.0 543 405 A 19 THR HB A 24 GLY HAy 1.0 1.8 5.0 544 405 A 19 THR HB A 24 GLY HAx 1.0 1.8 5.0 545 406 A 19 THR HB A 24 GLY H 1.0 1.8 6.0 546 407 A 19 THR HB A 31 ASN HD2x 1.0 1.8 5.0 547 407 A 19 THR HB A 31 ASN HD2y 1.0 1.8 5.0 548 408 A 19 THR HG2% A 31 ASN HBy 1.0 1.8 5.0 549 408 A 19 THR HG2% A 31 ASN HBx 1.0 1.8 5.0 550 409 A 20 VAL HB A 20 VAL H 1.0 1.8 5.0 551 410 A 20 VAL HGx% A 20 VAL H 1.0 1.8 5.0 552 411 A 20 VAL H A 20 VAL HGy% 1.0 1.8 3.5 553 412 A 20 VAL HGx% A 20 VAL HA 1.0 1.8 3.5 554 413 A 20 VAL HA A 20 VAL HGy% 1.0 1.8 3.5 555 414 A 20 VAL HB A 21 GLU H 1.0 1.8 5.0 556 415 A 20 VAL HGx% A 101 ALA HB% 1.0 1.8 5.0 557 415 A 101 ALA HB% A 20 VAL HGy% 1.0 1.8 5.0 558 416 A 20 VAL HA A 32 LEU HBx 1.0 1.8 5.0 559 416 A 20 VAL HA A 32 LEU HBy 1.0 1.8 5.0 560 417 A 20 VAL HA A 33 HIS H 1.0 1.8 5.0 561 418 A 20 VAL HGx% A 98 LEU HDy% 1.0 1.8 5.0 562 418 A 20 VAL HGx% A 98 LEU HDx% 1.0 1.8 5.0 563 419 A 98 LEU HDy% A 20 VAL HGy% 1.0 1.8 5.0 564 419 A 20 VAL HGy% A 98 LEU HDx% 1.0 1.8 5.0 565 420 A 21 GLU H A 21 GLU HBy 1.0 1.8 5.0 566 421 A 21 GLU H A 21 GLU HBx 1.0 1.8 5.0 567 422 A 21 GLU H A 21 GLU HA 1.0 1.8 3.5 568 423 A 21 GLU HA A 21 GLU HBy 1.0 1.8 5.0 569 424 A 21 GLU HA A 21 GLU HBx 1.0 1.8 5.0 570 425 A 21 GLU HA A 21 GLU HGy 1.0 1.8 5.0 571 426 A 21 GLU HA A 21 GLU HGx 1.0 1.8 5.0 572 427 A 21 GLU H A 22 LYS H 1.0 1.8 5.0 573 428 A 21 GLU HA A 22 LYS H 1.0 1.8 5.0 574 429 A 24 GLY H A 21 GLU HBx 1.0 1.8 5.0 575 429 A 24 GLY H A 21 GLU HBy 1.0 1.8 5.0 576 430 A 21 GLU HGy A 22 LYS H 1.0 1.8 5.0 577 431 A 21 GLU HGx A 22 LYS H 1.0 1.8 5.0 578 432 A 22 LYS H A 22 LYS HA 1.0 1.8 5.0 579 433 A 22 LYS H A 22 LYS HGy 1.0 1.8 5.0 580 434 A 22 LYS H A 22 LYS HGx 1.0 1.8 5.0 581 435 A 22 LYS H A 22 LYS HBx 1.0 1.8 5.0 582 435 A 22 LYS H A 22 LYS HBy 1.0 1.8 5.0 583 436 A 22 LYS H A 22 LYS HDx 1.0 1.8 5.0 584 436 A 22 LYS H A 22 LYS HDy 1.0 1.8 5.0 585 437 A 22 LYS HA A 23 GLY H 1.0 1.8 5.0 586 438 A 22 LYS HA A 33 HIS HBy 1.0 1.8 5.0 587 438 A 22 LYS HA A 33 HIS HBx 1.0 1.8 5.0 588 439 A 23 GLY H A 23 GLY HAy 1.0 1.8 5.0 589 440 A 23 GLY H A 23 GLY HAx 1.0 1.8 5.0 590 441 A 23 GLY H A 33 HIS HBy 1.0 1.8 5.0 591 441 A 23 GLY H A 33 HIS HBx 1.0 1.8 5.0 592 442 A 24 GLY H A 23 GLY H 1.0 1.8 5.0 593 443 A 24 GLY H A 23 GLY HAy 1.0 1.8 3.5 594 444 A 24 GLY H A 23 GLY HAx 1.0 1.8 3.5 595 445 A 24 GLY H A 24 GLY HAy 1.0 1.8 3.5 596 446 A 24 GLY HAx A 24 GLY H 1.0 1.8 3.5 597 447 A 24 GLY HAy A 25 PRO HDx 1.0 1.8 3.5 598 447 A 24 GLY HAx A 25 PRO HDx 1.0 1.8 3.5 599 447 A 25 PRO HDy A 24 GLY HAy 1.0 1.8 3.5 600 447 A 25 PRO HDy A 24 GLY HAx 1.0 1.8 3.5 601 448 A 24 GLY HAy A 31 ASN HBy 1.0 1.8 3.5 602 448 A 24 GLY HAx A 31 ASN HBy 1.0 1.8 3.5 603 448 A 31 ASN HBx A 24 GLY HAy 1.0 1.8 3.5 604 448 A 24 GLY HAx A 31 ASN HBx 1.0 1.8 3.5 605 449 A 31 ASN HD2x A 24 GLY HAy 1.0 1.8 5.0 606 449 A 31 ASN HD2x A 24 GLY HAx 1.0 1.8 5.0 607 450 A 31 ASN HD2y A 24 GLY HAy 1.0 1.8 5.0 608 450 A 31 ASN HD2y A 24 GLY HAx 1.0 1.8 5.0 609 451 A 25 PRO HA A 25 PRO HBy 1.0 1.8 3.5 610 451 A 25 PRO HBx A 25 PRO HA 1.0 1.8 3.5 611 452 A 25 PRO HDy A 25 PRO HBy 1.0 1.8 5.0 612 452 A 25 PRO HBy A 25 PRO HDx 1.0 1.8 5.0 613 453 A 25 PRO HDy A 25 PRO HBx 1.0 1.8 5.0 614 453 A 25 PRO HBx A 25 PRO HDx 1.0 1.8 5.0 615 454 A 25 PRO HA A 25 PRO HGx 1.0 1.8 3.5 616 454 A 25 PRO HA A 25 PRO HGy 1.0 1.8 3.5 617 455 A 25 PRO HGx A 27 LYS H 1.0 1.8 3.5 618 455 A 25 PRO HGy A 27 LYS H 1.0 1.8 3.5 619 456 A 27 LYS H A 25 PRO HBy 1.0 1.8 5.0 620 457 A 25 PRO HBx A 27 LYS H 1.0 1.8 5.0 621 458 A 26 HIS HA A 26 HIS HD2 1.0 1.8 5.0 622 459 A 26 HIS HD2 A 26 HIS HBy 1.0 1.8 3.5 623 460 A 26 HIS HD2 A 26 HIS HBx 1.0 1.8 3.5 624 461 A 27 LYS H A 26 HIS HA 1.0 1.8 5.0 625 462 A 26 HIS HA A 30 PRO HA 1.0 1.8 6.0 626 463 A 31 ASN HA A 26 HIS HA 1.0 1.8 5.0 627 464 A 26 HIS HA A 31 ASN HBy 1.0 1.8 5.0 628 465 A 31 ASN HBx A 26 HIS HA 1.0 1.8 5.0 629 466 A 31 ASN H A 26 HIS HA 1.0 1.8 5.0 630 467 A 27 LYS H A 26 HIS HBy 1.0 1.8 5.0 631 468 A 27 LYS H A 26 HIS HBx 1.0 1.8 5.0 632 469 A 30 PRO HA A 26 HIS HBy 1.0 1.8 6.0 633 469 A 30 PRO HA A 26 HIS HBx 1.0 1.8 6.0 634 470 A 31 ASN HD2y A 26 HIS HBx 1.0 1.8 6.0 635 470 A 31 ASN HD2y A 26 HIS HBy 1.0 1.8 6.0 636 470 A 31 ASN HD2x A 26 HIS HBx 1.0 1.8 6.0 637 470 A 31 ASN HD2x A 26 HIS HBy 1.0 1.8 6.0 638 471 A 26 HIS HBy A 46 TYR HBx 1.0 1.8 6.0 639 471 A 26 HIS HBx A 46 TYR HBx 1.0 1.8 6.0 640 471 A 46 TYR HBy A 26 HIS HBy 1.0 1.8 6.0 641 471 A 26 HIS HBx A 46 TYR HBy 1.0 1.8 6.0 642 472 A 46 TYR HDy A 26 HIS HBy 1.0 1.8 6.0 643 472 A 26 HIS HBx A 46 TYR HDx 1.0 1.8 6.0 644 472 A 46 TYR HDx A 26 HIS HBy 1.0 1.8 6.0 645 472 A 26 HIS HBx A 46 TYR HDy 1.0 1.8 6.0 646 473 A 26 HIS HD2 A 45 GLY HAy 1.0 1.8 5.0 647 473 A 26 HIS HD2 A 45 GLY HAx 1.0 1.8 5.0 648 474 A 26 HIS HD2 A 46 TYR HA 1.0 1.8 5.0 649 475 A 26 HIS HD2 A 46 TYR HDx 1.0 1.8 5.0 650 475 A 26 HIS HD2 A 46 TYR HDy 1.0 1.8 5.0 651 476 A 26 HIS HD2 A 46 TYR HBy 1.0 1.8 5.0 652 477 A 26 HIS HD2 A 46 TYR HBx 1.0 1.8 5.0 653 478 A 27 LYS H A 27 LYS HBy 1.0 1.8 3.5 654 479 A 27 LYS H A 27 LYS HBx 1.0 1.8 3.5 655 480 A 27 LYS H A 27 LYS HGx 1.0 1.8 5.0 656 480 A 27 LYS H A 27 LYS HGy 1.0 1.8 5.0 657 481 A 28 VAL H A 27 LYS HGx 1.0 1.8 3.5 658 481 A 28 VAL H A 27 LYS HGy 1.0 1.8 3.5 659 482 A 28 VAL H A 27 LYS HBx 1.0 1.8 2.9 660 482 A 28 VAL H A 27 LYS HBy 1.0 1.8 2.9 661 483 A 29 GLY H A 27 LYS HBx 1.0 1.8 5.0 662 483 A 29 GLY H A 27 LYS HBy 1.0 1.8 5.0 663 484 A 31 ASN HD2x A 27 LYS H 1.0 1.8 3.5 664 484 A 31 ASN HD2y A 27 LYS H 1.0 1.8 3.5 665 485 A 27 LYS HBy A 28 VAL HA 1.0 1.8 6.0 666 485 A 28 VAL HA A 27 LYS HBx 1.0 1.8 6.0 667 486 A 28 VAL HB A 28 VAL HA 1.0 1.8 2.9 668 487 A 28 VAL HGx% A 28 VAL HA 1.0 1.8 3.5 669 488 A 28 VAL HA A 28 VAL HGy% 1.0 1.8 3.5 670 489 A 28 VAL H A 28 VAL HA 1.0 1.8 3.5 671 490 A 28 VAL HB A 28 VAL HGx% 1.0 1.8 3.5 672 491 A 28 VAL HB A 28 VAL HGy% 1.0 1.8 3.5 673 492 A 28 VAL H A 28 VAL HB 1.0 1.8 5.0 674 493 A 28 VAL H A 28 VAL HGy% 1.0 1.8 5.0 675 494 A 28 VAL H A 28 VAL HGx% 1.0 1.8 5.0 676 495 A 27 LYS H A 28 VAL HA 1.0 1.8 6.0 677 496 A 29 GLY H A 28 VAL HB 1.0 1.8 3.5 678 497 A 29 GLY H A 28 VAL HGx% 1.0 1.8 3.5 679 498 A 29 GLY H A 28 VAL HGy% 1.0 1.8 3.5 680 499 A 28 VAL HGx% B 1 HEC HMD1 1.0 1.8 5.0 681 499 B 1 HEC HMD1 A 28 VAL HGy% 1.0 1.8 5.0 682 500 A 28 VAL HGx% B 1 HEC HHD 1.0 1.8 5.0 683 500 B 1 HEC HHD A 28 VAL HGy% 1.0 1.8 5.0 684 501 A 29 GLY H A 29 GLY HAy 1.0 1.8 3.5 685 502 A 29 GLY H A 29 GLY HAx 1.0 1.8 3.5 686 503 A 29 GLY HAx A 29 GLY HAy 1.0 1.8 2.9 687 504 A 29 GLY HAy A 30 PRO HDx 1.0 1.8 5.0 688 505 A 30 PRO HDy A 29 GLY HAy 1.0 1.8 5.0 689 506 A 29 GLY HAx A 30 PRO HDx 1.0 1.8 5.0 690 507 A 29 GLY HAx A 30 PRO HDy 1.0 1.8 5.0 691 508 B 1 HEC HHD A 29 GLY HAy 1.0 1.8 5.0 692 509 B 1 HEC HHD A 29 GLY HAx 1.0 1.8 5.0 693 510 B 1 HEC HMD1 A 29 GLY HAy 1.0 1.8 6.0 694 511 B 1 HEC HMD1 A 29 GLY HAx 1.0 1.8 5.0 695 512 A 46 TYR HEx A 29 GLY HAy 1.0 1.8 6.0 696 512 A 46 TYR HEy A 29 GLY HAy 1.0 1.8 6.0 697 513 A 46 TYR HEy A 29 GLY HAx 1.0 1.8 6.0 698 513 A 46 TYR HEx A 29 GLY HAx 1.0 1.8 6.0 699 514 A 29 GLY HAy A 46 TYR HBx 1.0 1.8 6.0 700 514 A 46 TYR HBy A 29 GLY HAy 1.0 1.8 6.0 701 514 A 29 GLY HAx A 46 TYR HBx 1.0 1.8 6.0 702 514 A 46 TYR HBy A 29 GLY HAx 1.0 1.8 6.0 703 515 A 26 HIS HD1 A 29 GLY HAy 1.0 1.8 5.0 704 515 A 29 GLY HAx A 26 HIS HD1 1.0 1.8 5.0 705 516 A 31 ASN HD2x A 29 GLY HAy 1.0 1.8 5.0 706 516 A 31 ASN HD2x A 29 GLY HAx 1.0 1.8 5.0 707 517 A 31 ASN HD2y A 29 GLY HAy 1.0 1.8 6.0 708 517 A 31 ASN HD2y A 29 GLY HAx 1.0 1.8 6.0 709 518 A 30 PRO HA A 30 PRO HGx 1.0 1.8 5.0 710 518 A 30 PRO HA A 30 PRO HGy 1.0 1.8 5.0 711 519 A 30 PRO HBy A 30 PRO HDx 1.0 1.8 5.0 712 519 A 30 PRO HBx A 30 PRO HDx 1.0 1.8 5.0 713 519 A 30 PRO HDy A 30 PRO HBy 1.0 1.8 5.0 714 519 A 30 PRO HBx A 30 PRO HDy 1.0 1.8 5.0 715 520 A 30 PRO HA A 26 HIS HE1 1.0 1.8 5.0 716 521 A 31 ASN H A 30 PRO HA 1.0 1.8 5.0 717 522 A 31 ASN HA A 30 PRO HA 1.0 1.8 5.0 718 523 A 32 LEU H A 30 PRO HBy 1.0 1.8 5.0 719 523 A 32 LEU H A 30 PRO HBx 1.0 1.8 5.0 720 524 A 26 HIS HE1 A 30 PRO HBy 1.0 1.8 5.0 721 525 A 30 PRO HBx A 26 HIS HE1 1.0 1.8 5.0 722 526 A 31 ASN H A 30 PRO HBy 1.0 1.8 5.0 723 527 A 31 ASN H A 30 PRO HBx 1.0 1.8 5.0 724 528 A 30 PRO HBx A 46 TYR HDx 1.0 1.8 5.0 725 528 A 46 TYR HDy A 30 PRO HBy 1.0 1.8 5.0 726 528 A 46 TYR HDx A 30 PRO HBy 1.0 1.8 5.0 727 528 A 30 PRO HBx A 46 TYR HDy 1.0 1.8 5.0 728 529 A 46 TYR HEx A 30 PRO HBy 1.0 1.8 5.0 729 529 A 46 TYR HEy A 30 PRO HBy 1.0 1.8 5.0 730 530 A 46 TYR HEx A 30 PRO HBx 1.0 1.8 5.0 731 530 A 46 TYR HEy A 30 PRO HBx 1.0 1.8 5.0 732 531 A 46 TYR HEy A 30 PRO HGy 1.0 1.8 5.0 733 531 A 46 TYR HEy A 30 PRO HGx 1.0 1.8 5.0 734 531 A 46 TYR HEx A 30 PRO HGx 1.0 1.8 5.0 735 531 A 46 TYR HEx A 30 PRO HGy 1.0 1.8 5.0 736 532 A 30 PRO HGy A 46 TYR HDy 1.0 1.8 5.0 737 532 A 30 PRO HGy A 46 TYR HDx 1.0 1.8 5.0 738 532 A 46 TYR HDx A 30 PRO HGx 1.0 1.8 5.0 739 532 A 46 TYR HDy A 30 PRO HGx 1.0 1.8 5.0 740 533 A 46 TYR HDy A 30 PRO HDx 1.0 1.8 5.0 741 533 A 46 TYR HDx A 30 PRO HDx 1.0 1.8 5.0 742 533 A 30 PRO HDy A 46 TYR HDy 1.0 1.8 5.0 743 533 A 30 PRO HDy A 46 TYR HDx 1.0 1.8 5.0 744 534 A 46 TYR HEx A 30 PRO HBx 1.0 1.8 5.0 745 534 A 46 TYR HEy A 30 PRO HBx 1.0 1.8 5.0 746 535 A 30 PRO HBx B 1 HEC HADy 1.0 1.8 5.0 747 535 B 1 HEC HADy A 30 PRO HBy 1.0 1.8 5.0 748 535 A 30 PRO HBx B 1 HEC HADx 1.0 1.8 5.0 749 535 A 30 PRO HBy B 1 HEC HADx 1.0 1.8 5.0 750 536 A 46 TYR HA A 30 PRO HBy 1.0 1.8 5.0 751 536 A 46 TYR HA A 30 PRO HBx 1.0 1.8 5.0 752 537 A 31 ASN HA A 31 ASN HBy 1.0 1.8 3.5 753 538 A 31 ASN HA A 31 ASN HBx 1.0 1.8 3.5 754 539 A 31 ASN HD2y A 31 ASN HBy 1.0 1.8 5.0 755 540 A 31 ASN HD2y A 31 ASN HBx 1.0 1.8 5.0 756 541 A 31 ASN HD2x A 31 ASN HBy 1.0 1.8 5.0 757 542 A 31 ASN HD2y A 31 ASN HBy 1.0 1.8 5.0 758 543 A 31 ASN HA A 31 ASN HD2x 1.0 1.8 5.0 759 544 A 31 ASN HA A 31 ASN HD2y 1.0 1.8 5.0 760 545 A 31 ASN HA A 26 HIS HE1 1.0 1.8 6.0 761 546 A 31 ASN HA A 32 LEU H 1.0 1.8 5.0 762 547 A 43 ALA HB% A 31 ASN HBy 1.0 1.8 5.0 763 547 A 31 ASN HBx A 43 ALA HB% 1.0 1.8 5.0 764 548 A 26 HIS HE1 A 31 ASN HBy 1.0 1.8 6.0 765 549 A 31 ASN HBx A 26 HIS HE1 1.0 1.8 6.0 766 550 A 32 LEU H A 32 LEU HBy 1.0 1.8 3.5 767 551 A 32 LEU H A 32 LEU HBx 1.0 1.8 3.5 768 552 A 32 LEU HA A 32 LEU HDx% 1.0 1.8 5.0 769 553 A 32 LEU HDy% A 32 LEU HA 1.0 1.8 5.0 770 554 A 32 LEU H A 32 LEU HDx% 1.0 1.8 5.0 771 555 A 32 LEU HDy% A 32 LEU H 1.0 1.8 5.0 772 556 A 32 LEU H A 33 HIS H 1.0 1.8 5.0 773 557 A 19 THR H A 32 LEU H 1.0 1.8 5.0 774 558 A 32 LEU HDx% B 1 HEC HBAx 1.0 1.8 5.0 775 558 B 1 HEC HBAy A 32 LEU HDx% 1.0 1.8 5.0 776 558 A 32 LEU HDy% B 1 HEC HBAx 1.0 1.8 5.0 777 558 A 32 LEU HDy% B 1 HEC HBAy 1.0 1.8 5.0 778 559 B 1 HEC HHA A 32 LEU HDx% 1.0 1.8 5.0 779 559 A 32 LEU HDy% B 1 HEC HHA 1.0 1.8 5.0 780 560 B 1 HEC HMA1 A 32 LEU HDx% 1.0 1.8 5.0 781 561 A 32 LEU HDy% B 1 HEC HMA1 1.0 1.8 5.0 782 562 B 1 HEC HMB1 A 32 LEU HDx% 1.0 1.8 5.0 783 562 A 32 LEU HDy% B 1 HEC HMB1 1.0 1.8 5.0 784 563 A 35 ILE H A 32 LEU HDx% 1.0 1.8 5.0 785 564 A 32 LEU HBy A 33 HIS HBy 1.0 1.8 5.0 786 564 A 32 LEU HBx A 33 HIS HBy 1.0 1.8 5.0 787 565 A 42 GLN H A 32 LEU HDx% 1.0 1.8 6.0 788 566 A 33 HIS H A 33 HIS HBy 1.0 1.8 5.0 789 567 A 33 HIS H A 33 HIS HBx 1.0 1.8 5.0 790 568 A 33 HIS HBx A 33 HIS HA 1.0 1.8 3.5 791 569 A 33 HIS HA A 33 HIS HBy 1.0 1.8 3.5 792 570 A 33 HIS HA A 34 GLY H 1.0 1.8 5.0 793 571 A 35 ILE H A 33 HIS HA 1.0 1.8 5.0 794 572 A 34 GLY H A 34 GLY HAy 1.0 1.8 5.0 795 573 A 34 GLY H A 34 GLY HAx 1.0 1.8 5.0 796 574 A 35 ILE H A 34 GLY HAy 1.0 1.8 5.0 797 574 A 35 ILE H A 34 GLY HAx 1.0 1.8 5.0 798 575 A 33 HIS H A 34 GLY HAy 1.0 1.8 5.0 799 575 A 33 HIS H A 34 GLY HAx 1.0 1.8 5.0 800 576 A 34 GLY H A 36 PHE HD% 1.0 1.8 5.0 801 577 A 34 GLY H A 35 ILE HG1x 1.0 1.8 5.0 802 578 A 35 ILE HA A 35 ILE HG1y 1.0 1.8 3.5 803 578 A 35 ILE HA A 35 ILE HG1x 1.0 1.8 3.5 804 579 A 35 ILE HA A 35 ILE HG2% 1.0 1.8 3.5 805 580 A 35 ILE HA A 35 ILE HD1% 1.0 1.8 5.0 806 581 A 35 ILE H A 35 ILE HA 1.0 1.8 2.9 807 582 A 35 ILE H A 35 ILE HB 1.0 1.8 5.0 808 583 A 35 ILE HD1% A 35 ILE HB 1.0 1.8 3.5 809 584 A 35 ILE HB A 35 ILE HG1y 1.0 1.8 2.9 810 584 A 35 ILE HG1x A 35 ILE HB 1.0 1.8 2.9 811 585 A 35 ILE H A 35 ILE HD1% 1.0 1.8 5.0 812 586 A 35 ILE H A 35 ILE HG1y 1.0 1.8 5.0 813 586 A 35 ILE H A 35 ILE HG1x 1.0 1.8 5.0 814 587 A 35 ILE HG2% A 35 ILE HG1y 1.0 1.8 2.9 815 587 A 35 ILE HG1x A 35 ILE HG2% 1.0 1.8 2.9 816 588 A 35 ILE H A 35 ILE HG2% 1.0 1.8 5.0 817 589 A 35 ILE HA A 35 ILE HB 1.0 1.8 2.9 818 590 A 35 ILE HA A 36 PHE H 1.0 1.8 5.0 819 591 A 35 ILE HA A 38 ARG HGx 1.0 1.8 5.0 820 591 A 35 ILE HA A 38 ARG HGy 1.0 1.8 5.0 821 592 A 35 ILE HA A 38 ARG HDx 1.0 1.8 6.0 822 592 A 35 ILE HA A 38 ARG HDy 1.0 1.8 6.0 823 593 A 35 ILE HA A 38 ARG H 1.0 1.8 6.0 824 594 A 35 ILE HB A 36 PHE H 1.0 1.8 5.0 825 595 A 35 ILE HB A 59 TRP HD1 1.0 1.8 6.0 826 596 A 32 LEU HBy A 35 ILE HD1% 1.0 1.8 5.0 827 597 A 35 ILE HD1% A 32 LEU HBx 1.0 1.8 5.0 828 598 A 35 ILE HD1% A 36 PHE H 1.0 1.8 5.0 829 599 A 35 ILE HD1% A 59 TRP HBy 1.0 1.8 5.0 830 599 A 35 ILE HD1% A 59 TRP HBx 1.0 1.8 5.0 831 600 A 35 ILE HD1% A 59 TRP HD1 1.0 1.8 5.0 832 601 B 1 HEC HMA1 A 35 ILE HD1% 1.0 1.8 5.0 833 602 A 35 ILE HG1x A 32 LEU HDx% 1.0 1.8 5.0 834 602 A 32 LEU HDx% A 35 ILE HG1y 1.0 1.8 5.0 835 603 A 32 LEU HDy% A 35 ILE HG1x 1.0 1.8 5.0 836 603 A 32 LEU HDy% A 35 ILE HG1y 1.0 1.8 5.0 837 604 A 32 LEU HBy A 35 ILE HG1x 1.0 1.8 6.0 838 604 A 32 LEU HBy A 35 ILE HG1y 1.0 1.8 6.0 839 605 A 35 ILE HG1x A 32 LEU HBx 1.0 1.8 6.0 840 605 A 32 LEU HBx A 35 ILE HG1y 1.0 1.8 6.0 841 606 A 35 ILE HG1y A 59 TRP HBx 1.0 1.8 6.0 842 606 A 35 ILE HG1x A 59 TRP HBx 1.0 1.8 6.0 843 606 A 59 TRP HBy A 35 ILE HG1y 1.0 1.8 6.0 844 606 A 35 ILE HG1x A 59 TRP HBy 1.0 1.8 6.0 845 607 A 59 TRP HE1 A 35 ILE HG1y 1.0 1.8 5.0 846 607 A 35 ILE HG1x A 59 TRP HE1 1.0 1.8 5.0 847 608 A 59 TRP HD1 A 35 ILE HG1y 1.0 1.8 5.0 848 608 A 35 ILE HG1x A 59 TRP HD1 1.0 1.8 5.0 849 609 B 1 HEC HMA1 A 35 ILE HG1y 1.0 1.8 5.0 850 609 B 1 HEC HMA1 A 35 ILE HG1x 1.0 1.8 5.0 851 610 A 32 LEU HBy A 35 ILE HG2% 1.0 1.8 5.0 852 611 A 35 ILE HG2% A 32 LEU HBx 1.0 1.8 5.0 853 612 A 35 ILE HG2% A 36 PHE H 1.0 1.8 5.0 854 613 A 35 ILE HG2% A 59 TRP HBx 1.0 1.8 5.0 855 613 A 35 ILE HG2% A 59 TRP HBy 1.0 1.8 5.0 856 614 A 35 ILE HG2% A 59 TRP HZ2 1.0 1.8 5.0 857 614 A 35 ILE HG2% A 59 TRP HD1 1.0 1.8 5.0 858 615 A 36 PHE H A 36 PHE HA 1.0 1.8 3.5 859 616 A 36 PHE HD% A 36 PHE HBx 1.0 1.8 2.9 860 616 A 36 PHE HD% A 36 PHE HBy 1.0 1.8 2.9 861 617 A 36 PHE HD% A 36 PHE HA 1.0 1.8 5.0 862 618 A 36 PHE HD% A 36 PHE HBx 1.0 1.8 5.0 863 618 A 36 PHE HD% A 36 PHE HBy 1.0 1.8 5.0 864 619 A 36 PHE H A 36 PHE HBy 1.0 1.8 5.0 865 620 A 36 PHE H A 36 PHE HBx 1.0 1.8 3.5 866 621 A 36 PHE HBy A 36 PHE HE% 1.0 1.8 5.0 867 622 A 36 PHE HE% A 36 PHE HBx 1.0 1.8 5.0 868 623 A 36 PHE HD% A 36 PHE HE% 1.0 1.8 2.9 869 624 A 36 PHE HE% A 36 PHE HZ 1.0 1.8 2.9 870 625 A 36 PHE HD% A 36 PHE HZ 1.0 1.8 5.0 871 626 A 36 PHE HA A 37 GLY H 1.0 1.8 5.0 872 627 A 37 GLY H A 36 PHE HBx 1.0 1.8 5.0 873 628 A 36 PHE HBy A 37 GLY H 1.0 1.8 5.0 874 629 A 35 ILE H A 36 PHE H 1.0 1.8 5.0 875 630 A 33 HIS HA A 36 PHE HD% 1.0 1.8 5.0 876 631 A 36 PHE HD% A 61 GLU H 1.0 1.8 5.0 877 632 A 36 PHE HD% A 61 GLU HA 1.0 1.8 5.0 878 633 A 36 PHE HD% A 64 MET HBy 1.0 1.8 5.0 879 634 A 36 PHE HD% A 64 MET HBx 1.0 1.8 5.0 880 635 A 36 PHE HD% A 64 MET HE% 1.0 1.8 5.0 881 636 A 36 PHE HD% A 99 LYS HA 1.0 1.8 5.0 882 637 A 36 PHE HD% A 99 LYS HGx 1.0 1.8 5.0 883 637 A 36 PHE HD% A 99 LYS HGy 1.0 1.8 5.0 884 638 A 36 PHE HE% A 64 MET HBy 1.0 1.8 5.0 885 639 A 36 PHE HE% A 64 MET HBx 1.0 1.8 5.0 886 640 A 36 PHE HE% A 64 MET HGy 1.0 1.8 5.0 887 640 A 36 PHE HE% A 64 MET HGx 1.0 1.8 5.0 888 641 A 36 PHE HE% A 64 MET HE% 1.0 1.8 5.0 889 642 A 36 PHE HE% A 61 GLU H 1.0 1.8 5.0 890 643 A 36 PHE HE% A 61 GLU HA 1.0 1.8 2.9 891 644 A 36 PHE HE% A 61 GLU HGx 1.0 1.8 3.5 892 644 A 61 GLU HGy A 36 PHE HE% 1.0 1.8 3.5 893 645 A 36 PHE HE% A 98 LEU H 1.0 1.8 6.0 894 646 A 95 ILE HG2% A 36 PHE HE% 1.0 1.8 5.0 895 647 A 36 PHE HE% A 98 LEU HDx% 1.0 1.8 5.0 896 648 A 98 LEU HDy% A 36 PHE HE% 1.0 1.8 5.0 897 649 A 36 PHE HE% A 99 LYS H 1.0 1.8 6.0 898 650 A 36 PHE HE% A 99 LYS HA 1.0 1.8 6.0 899 651 A 36 PHE HE% A 61 GLU HBx 1.0 1.8 5.0 900 651 A 36 PHE HE% A 99 LYS HBy 1.0 1.8 5.0 901 651 A 36 PHE HE% A 99 LYS HBx 1.0 1.8 5.0 902 651 A 36 PHE HE% A 61 GLU HBy 1.0 1.8 5.0 903 652 A 36 PHE HE% A 99 LYS HDx 1.0 1.8 6.0 904 652 A 36 PHE HE% A 99 LYS HDy 1.0 1.8 6.0 905 653 A 36 PHE HZ A 99 LYS HA 1.0 1.8 6.0 906 654 A 36 PHE HZ A 99 LYS H 1.0 1.8 6.0 907 655 A 36 PHE HZ A 64 MET HBy 1.0 1.8 5.0 908 656 A 36 PHE HZ A 64 MET HBx 1.0 1.8 5.0 909 657 A 36 PHE HZ A 61 GLU HA 1.0 1.8 5.0 910 658 A 36 PHE HZ A 64 MET HE% 1.0 1.8 5.0 911 659 A 36 PHE HZ A 95 ILE HG1y 1.0 1.8 6.0 912 659 A 36 PHE HZ A 95 ILE HG1x 1.0 1.8 6.0 913 660 A 95 ILE HG2% A 36 PHE HZ 1.0 1.8 5.0 914 661 A 36 PHE HZ A 98 LEU HBx 1.0 1.8 5.0 915 661 A 36 PHE HZ A 98 LEU HBy 1.0 1.8 5.0 916 662 A 36 PHE HZ A 98 LEU HDx% 1.0 1.8 5.0 917 663 A 98 LEU HDy% A 36 PHE HZ 1.0 1.8 5.0 918 664 A 37 GLY H A 37 GLY HAy 1.0 1.8 3.5 919 665 A 37 GLY H A 37 GLY HAx 1.0 1.8 5.0 920 666 A 37 GLY HAx A 37 GLY HAy 1.0 1.8 2.9 921 667 A 38 ARG H A 37 GLY H 1.0 1.8 3.5 922 668 A 39 HIS H A 37 GLY HAy 1.0 1.8 6.0 923 668 A 37 GLY HAx A 39 HIS H 1.0 1.8 6.0 924 669 A 58 LEU HDx% A 37 GLY HAy 1.0 1.8 5.0 925 669 A 37 GLY HAx A 58 LEU HDx% 1.0 1.8 5.0 926 670 A 58 LEU HDy% A 37 GLY HAy 1.0 1.8 5.0 927 670 A 37 GLY HAx A 58 LEU HDy% 1.0 1.8 5.0 928 671 A 38 ARG H A 37 GLY HAy 1.0 1.8 3.5 929 672 A 38 ARG H A 37 GLY HAx 1.0 1.8 3.5 930 673 A 38 ARG H A 38 ARG HBx 1.0 1.8 3.5 931 673 A 38 ARG H A 38 ARG HBy 1.0 1.8 3.5 932 674 A 38 ARG H A 38 ARG HGx 1.0 1.8 5.0 933 674 A 38 ARG HGy A 38 ARG H 1.0 1.8 5.0 934 675 A 38 ARG H A 38 ARG HDx 1.0 1.8 5.0 935 675 A 38 ARG HDy A 38 ARG H 1.0 1.8 5.0 936 676 A 38 ARG HBx A 38 ARG HDx 1.0 1.8 5.0 937 676 A 38 ARG HBy A 38 ARG HDx 1.0 1.8 5.0 938 676 A 38 ARG HDy A 38 ARG HBx 1.0 1.8 5.0 939 676 A 38 ARG HDy A 38 ARG HBy 1.0 1.8 5.0 940 677 A 38 ARG HBx A 38 ARG HGx 1.0 1.8 3.5 941 677 A 38 ARG HBy A 38 ARG HGx 1.0 1.8 3.5 942 677 A 38 ARG HGy A 38 ARG HBx 1.0 1.8 3.5 943 677 A 38 ARG HGy A 38 ARG HBy 1.0 1.8 3.5 944 678 A 38 ARG H A 59 TRP HD1 1.0 1.8 5.0 945 679 A 39 HIS H A 38 ARG HBx 1.0 1.8 3.5 946 679 A 39 HIS H A 38 ARG HBy 1.0 1.8 3.5 947 680 A 42 GLN H A 38 ARG HBx 1.0 1.8 6.0 948 680 A 42 GLN H A 38 ARG HBy 1.0 1.8 6.0 949 681 A 59 TRP HD1 A 38 ARG HBx 1.0 1.8 6.0 950 681 A 59 TRP HD1 A 38 ARG HBy 1.0 1.8 6.0 951 682 A 39 HIS HE1 A 38 ARG HDx 1.0 1.8 6.0 952 682 A 38 ARG HDy A 39 HIS HE1 1.0 1.8 6.0 953 683 A 38 ARG HDx A 42 GLN HGy 1.0 1.8 5.0 954 683 A 38 ARG HDy A 42 GLN HGy 1.0 1.8 5.0 955 683 A 42 GLN HGx A 38 ARG HDx 1.0 1.8 5.0 956 683 A 38 ARG HDy A 42 GLN HGx 1.0 1.8 5.0 957 684 A 42 GLN H A 38 ARG HGx 1.0 1.8 6.0 958 684 A 42 GLN H A 38 ARG HGy 1.0 1.8 6.0 959 685 A 59 TRP HD1 A 38 ARG HGx 1.0 1.8 5.0 960 685 A 38 ARG HGy A 59 TRP HD1 1.0 1.8 5.0 961 686 A 38 ARG HDy A 42 GLN HBy 1.0 1.8 3.5 962 686 A 38 ARG HDx A 42 GLN HBy 1.0 1.8 3.5 963 687 A 38 ARG HDy A 42 GLN HBx 1.0 1.8 3.5 964 687 A 42 GLN HBx A 38 ARG HDx 1.0 1.8 3.5 965 688 A 39 HIS HD2 A 39 HIS HBy 1.0 1.8 5.0 966 689 A 39 HIS HD2 A 39 HIS HBx 1.0 1.8 5.0 967 690 A 39 HIS HE1 A 39 HIS HBy 1.0 1.8 6.0 968 691 A 39 HIS HE1 A 39 HIS HBx 1.0 1.8 5.0 969 692 A 39 HIS H A 39 HIS HBy 1.0 1.8 5.0 970 693 A 39 HIS H A 39 HIS HBx 1.0 1.8 5.0 971 694 A 39 HIS HE1 A 39 HIS HD1 1.0 1.8 5.0 972 695 A 58 LEU HDx% A 39 HIS HA 1.0 1.8 5.0 973 696 A 58 LEU HDy% A 39 HIS HA 1.0 1.8 6.0 974 697 A 56 ASN HA A 39 HIS HBy 1.0 1.8 5.0 975 697 A 39 HIS HBx A 56 ASN HA 1.0 1.8 5.0 976 698 A 40 SER H A 39 HIS HBy 1.0 1.8 5.0 977 698 A 39 HIS HBx A 40 SER H 1.0 1.8 5.0 978 699 A 42 GLN H A 39 HIS HBy 1.0 1.8 5.0 979 700 A 42 GLN H A 39 HIS HBx 1.0 1.8 5.0 980 701 A 42 GLN HE2y A 39 HIS HBy 1.0 1.8 5.0 981 701 A 39 HIS HBx A 42 GLN HE2x 1.0 1.8 5.0 982 701 A 42 GLN HE2x A 39 HIS HBy 1.0 1.8 5.0 983 701 A 39 HIS HBx A 42 GLN HE2y 1.0 1.8 5.0 984 702 A 58 LEU HDx% A 39 HIS HBy 1.0 1.8 5.0 985 702 A 58 LEU HDy% A 39 HIS HBx 1.0 1.8 5.0 986 702 A 58 LEU HDy% A 39 HIS HBy 1.0 1.8 5.0 987 702 A 58 LEU HDx% A 39 HIS HBx 1.0 1.8 5.0 988 703 A 39 HIS HD2 A 56 ASN HA 1.0 1.8 5.0 989 704 A 58 LEU HDx% A 39 HIS HD2 1.0 1.8 5.0 990 705 A 58 LEU HDy% A 39 HIS HD2 1.0 1.8 6.0 991 706 A 39 HIS HD2 A 58 LEU HA 1.0 1.8 5.0 992 707 A 39 HIS HD2 A 57 VAL HA 1.0 1.8 5.0 993 708 A 39 HIS HD2 A 58 LEU HBy 1.0 1.8 5.0 994 708 A 39 HIS HD2 A 58 LEU HBx 1.0 1.8 5.0 995 709 A 39 HIS HD2 A 58 LEU H 1.0 1.8 3.5 996 710 A 40 SER H A 40 SER HBy 1.0 1.8 3.5 997 711 A 40 SER H A 40 SER HBx 1.0 1.8 5.0 998 712 A 40 SER H A 40 SER HA 1.0 1.8 5.0 999 713 A 40 SER HBy A 40 SER HA 1.0 1.8 5.0 1000 714 A 40 SER HBx A 40 SER HA 1.0 1.8 5.0 1001 715 A 39 HIS H A 40 SER H 1.0 1.8 5.0 1002 716 A 40 SER HA A 41 GLY H 1.0 1.8 5.0 1003 717 A 59 TRP HD1 A 40 SER HA 1.0 1.8 5.0 1004 718 A 59 TRP HE1 A 40 SER HA 1.0 1.8 5.0 1005 719 A 40 SER HBy A 41 GLY H 1.0 1.8 5.0 1006 720 A 40 SER HBx A 41 GLY H 1.0 1.8 5.0 1007 721 A 40 SER HBy A 52 ASN HD2x 1.0 1.8 5.0 1008 721 A 40 SER HBy A 52 ASN HD2y 1.0 1.8 5.0 1009 722 A 40 SER HBx A 52 ASN HD2x 1.0 1.8 5.0 1010 722 A 40 SER HBx A 52 ASN HD2y 1.0 1.8 5.0 1011 723 A 40 SER HBy A 57 VAL H 1.0 1.8 5.0 1012 724 A 40 SER HBx A 57 VAL H 1.0 1.8 5.0 1013 725 A 40 SER HBy A 57 VAL HGy% 1.0 1.8 5.0 1014 725 A 40 SER HBy A 57 VAL HGx% 1.0 1.8 5.0 1015 726 A 40 SER HBx A 57 VAL HGy% 1.0 1.8 5.0 1016 726 A 40 SER HBx A 57 VAL HGx% 1.0 1.8 5.0 1017 727 A 59 TRP HE1 A 40 SER HBy 1.0 1.8 5.0 1018 728 A 59 TRP HE1 A 40 SER HBx 1.0 1.8 5.0 1019 729 A 59 TRP HZ2 A 40 SER HBy 1.0 1.8 5.0 1020 730 A 59 TRP HZ2 A 40 SER HBx 1.0 1.8 5.0 1021 731 A 40 SER HA A 56 ASN HBy 1.0 1.8 5.0 1022 731 A 40 SER HA A 56 ASN HBx 1.0 1.8 5.0 1023 732 A 40 SER HBy A 56 ASN HBy 1.0 1.8 5.0 1024 733 A 40 SER HBx A 56 ASN HBy 1.0 1.8 5.0 1025 734 A 40 SER HBy A 56 ASN HBx 1.0 1.8 5.0 1026 735 A 40 SER HBx A 56 ASN HBx 1.0 1.8 5.0 1027 736 A 41 GLY H A 41 GLY HAy 1.0 1.8 2.9 1028 737 A 41 GLY H A 41 GLY HAx 1.0 1.8 2.9 1029 738 A 41 GLY HAx A 41 GLY HAy 1.0 1.8 3.5 1030 739 A 59 TRP HD1 A 41 GLY H 1.0 1.8 5.0 1031 740 A 42 GLN H A 41 GLY HAy 1.0 1.8 3.5 1032 740 A 42 GLN H A 41 GLY HAx 1.0 1.8 3.5 1033 741 A 43 ALA H A 41 GLY HAy 1.0 1.8 5.0 1034 741 A 41 GLY HAx A 43 ALA H 1.0 1.8 5.0 1035 742 A 41 GLY HAy A 48 TYR HBx 1.0 1.8 5.0 1036 742 A 48 TYR HBy A 41 GLY HAy 1.0 1.8 5.0 1037 742 A 41 GLY HAx A 48 TYR HBy 1.0 1.8 5.0 1038 742 A 41 GLY HAx A 48 TYR HBx 1.0 1.8 5.0 1039 743 A 53 ILE HA A 41 GLY HAy 1.0 1.8 5.0 1040 743 A 41 GLY HAx A 53 ILE HA 1.0 1.8 5.0 1041 744 A 41 GLY HAx A 53 ILE HG1x 1.0 1.8 5.0 1042 744 A 53 ILE HG1x A 41 GLY HAy 1.0 1.8 5.0 1043 745 A 41 GLY HAx A 53 ILE HG1y 1.0 1.8 5.0 1044 745 A 41 GLY HAy A 53 ILE HG1y 1.0 1.8 5.0 1045 746 A 53 ILE HG2% A 41 GLY HAy 1.0 1.8 5.0 1046 746 A 41 GLY HAx A 53 ILE HG2% 1.0 1.8 5.0 1047 747 A 42 GLN H A 42 GLN HA 1.0 1.8 3.5 1048 748 A 42 GLN H A 42 GLN HBy 1.0 1.8 5.0 1049 749 A 42 GLN H A 42 GLN HBx 1.0 1.8 5.0 1050 750 A 42 GLN H A 42 GLN HGx 1.0 1.8 5.0 1051 751 A 42 GLN H A 42 GLN HGy 1.0 1.8 5.0 1052 752 A 42 GLN HGx A 42 GLN HA 1.0 1.8 3.5 1053 753 A 42 GLN HA A 42 GLN HGy 1.0 1.8 3.5 1054 754 A 42 GLN HGx A 42 GLN HE2y 1.0 1.8 5.0 1055 755 A 42 GLN HE2x A 42 GLN HGy 1.0 1.8 5.0 1056 756 A 42 GLN HGx A 42 GLN HE2y 1.0 1.8 5.0 1057 757 A 42 GLN HE2x A 42 GLN HGy 1.0 1.8 5.0 1058 758 A 42 GLN HA A 42 GLN HBy 1.0 1.8 5.0 1059 759 A 42 GLN HA A 42 GLN HBx 1.0 1.8 5.0 1060 760 A 42 GLN H A 41 GLY H 1.0 1.8 5.0 1061 761 A 39 HIS H A 42 GLN HBy 1.0 1.8 3.5 1062 761 A 39 HIS H A 42 GLN HBx 1.0 1.8 3.5 1063 762 A 39 HIS H A 42 GLN HE2y 1.0 1.8 5.0 1064 762 A 39 HIS H A 42 GLN HE2x 1.0 1.8 5.0 1065 763 A 48 TYR H A 42 GLN HGy 1.0 1.8 6.0 1066 763 A 42 GLN HGx A 48 TYR H 1.0 1.8 6.0 1067 764 A 43 ALA H A 43 ALA HA 1.0 1.8 2.9 1068 765 A 43 ALA HB% A 43 ALA H 1.0 1.8 2.9 1069 766 A 43 ALA HB% A 43 ALA HA 1.0 1.8 2.9 1070 767 A 42 GLN H A 43 ALA H 1.0 1.8 5.0 1071 768 A 43 ALA HA A 44 GLU H 1.0 1.8 5.0 1072 769 A 26 HIS HD1 A 43 ALA HB% 1.0 1.8 6.0 1073 770 A 26 HIS HE1 A 43 ALA HB% 1.0 1.8 6.0 1074 771 A 43 ALA HB% A 44 GLU H 1.0 1.8 3.5 1075 772 A 43 ALA HB% A 48 TYR H 1.0 1.8 3.5 1076 773 A 44 GLU H A 44 GLU HA 1.0 1.8 5.0 1077 774 A 44 GLU H A 44 GLU HBx 1.0 1.8 5.0 1078 774 A 44 GLU H A 44 GLU HBy 1.0 1.8 5.0 1079 775 A 44 GLU HA A 44 GLU HGy 1.0 1.8 3.5 1080 776 A 44 GLU HA A 44 GLU HGx 1.0 1.8 3.5 1081 777 A 44 GLU HBy A 45 GLY H 1.0 1.8 5.0 1082 777 A 45 GLY H A 44 GLU HBx 1.0 1.8 5.0 1083 778 A 45 GLY H A 45 GLY HAy 1.0 1.8 2.9 1084 779 A 45 GLY HAx A 45 GLY H 1.0 1.8 2.9 1085 780 A 45 GLY HAx A 45 GLY HAy 1.0 1.8 2.9 1086 781 A 26 HIS HD1 A 45 GLY HAy 1.0 1.8 5.0 1087 781 A 45 GLY HAx A 26 HIS HD1 1.0 1.8 5.0 1088 782 A 26 HIS HE1 A 45 GLY HAy 1.0 1.8 5.0 1089 782 A 45 GLY HAx A 26 HIS HE1 1.0 1.8 5.0 1090 783 A 46 TYR H A 45 GLY HAy 1.0 1.8 5.0 1091 783 A 45 GLY HAx A 46 TYR H 1.0 1.8 5.0 1092 784 A 46 TYR HA A 46 TYR HDx 1.0 1.8 5.0 1093 785 A 46 TYR HA A 46 TYR HDy 1.0 1.8 5.0 1094 786 A 46 TYR HA A 46 TYR H 1.0 1.8 5.0 1095 787 A 46 TYR HBy A 46 TYR H 1.0 1.8 5.0 1096 788 A 46 TYR H A 46 TYR HBx 1.0 1.8 5.0 1097 789 A 46 TYR HBy A 46 TYR HA 1.0 1.8 3.5 1098 790 A 46 TYR HA A 46 TYR HBx 1.0 1.8 3.5 1099 791 A 46 TYR HDx A 46 TYR HBx 1.0 1.8 5.0 1100 791 A 46 TYR HBy A 46 TYR HDy 1.0 1.8 5.0 1101 791 A 46 TYR HDy A 46 TYR HBx 1.0 1.8 5.0 1102 791 A 46 TYR HBy A 46 TYR HDx 1.0 1.8 5.0 1103 792 A 46 TYR HDx A 46 TYR HDy 1.0 1.8 5.0 1104 793 A 46 TYR HEy A 46 TYR HDy 1.0 1.8 5.0 1105 793 A 46 TYR HEx A 46 TYR HDy 1.0 1.8 5.0 1106 794 A 46 TYR HEy A 46 TYR HDx 1.0 1.8 5.0 1107 794 A 46 TYR HEx A 46 TYR HDx 1.0 1.8 5.0 1108 795 A 46 TYR HA A 46 TYR HEy 1.0 1.8 5.0 1109 795 A 46 TYR HA A 46 TYR HEx 1.0 1.8 5.0 1110 796 A 46 TYR HA A 48 TYR H 1.0 1.8 6.0 1111 797 A 46 TYR HA A 44 GLU H 1.0 1.8 6.3 1112 798 A 26 HIS HE1 A 46 TYR HBx 1.0 1.8 5.0 1113 798 A 46 TYR HBy A 26 HIS HE1 1.0 1.8 5.0 1114 799 A 26 HIS HD1 A 46 TYR HBx 1.0 1.8 5.0 1115 799 A 46 TYR HBy A 26 HIS HD1 1.0 1.8 5.0 1116 800 A 48 TYR H A 46 TYR HDy 1.0 1.8 6.0 1117 801 A 46 TYR HEx A 48 TYR H 1.0 1.8 6.0 1118 802 A 46 TYR HEy A 48 TYR H 1.0 1.8 6.0 1119 803 A 46 TYR HEy A 79 LYS HEy 1.0 1.8 5.0 1120 803 A 46 TYR HEx A 79 LYS HEy 1.0 1.8 5.0 1121 804 A 46 TYR HEy A 79 LYS HEy 1.0 1.8 5.0 1122 804 A 46 TYR HEx A 79 LYS HEy 1.0 1.8 5.0 1123 805 A 47 SER HBx A 47 SER HA 1.0 1.8 3.5 1124 806 A 47 SER HA A 47 SER HBy 1.0 1.8 3.5 1125 807 A 48 TYR H A 47 SER HA 1.0 1.8 5.0 1126 808 A 48 TYR H A 47 SER HBy 1.0 1.8 5.0 1127 808 A 48 TYR H A 47 SER HBx 1.0 1.8 5.0 1128 809 A 48 TYR H A 48 TYR HA 1.0 1.8 3.5 1129 810 A 48 TYR HA A 48 TYR HD% 1.0 1.8 5.0 1130 811 A 48 TYR HBy A 48 TYR HD% 1.0 1.8 3.5 1131 812 A 48 TYR HD% A 48 TYR HBx 1.0 1.8 3.5 1132 813 A 48 TYR HBy A 48 TYR H 1.0 1.8 3.5 1133 814 A 48 TYR H A 48 TYR HBx 1.0 1.8 3.5 1134 815 A 48 TYR H A 49 THR H 1.0 1.8 5.0 1135 816 A 53 ILE HB A 48 TYR HBx 1.0 1.8 5.0 1136 816 A 48 TYR HBy A 53 ILE HB 1.0 1.8 5.0 1137 817 A 48 TYR HBx A 53 ILE HG1y 1.0 1.8 3.5 1138 817 A 48 TYR HBy A 53 ILE HG1y 1.0 1.8 3.5 1139 818 A 53 ILE HG1x A 48 TYR HBx 1.0 1.8 3.5 1140 818 A 48 TYR HBy A 53 ILE HG1x 1.0 1.8 3.5 1141 819 A 53 ILE HG2% A 48 TYR HBx 1.0 1.8 5.0 1142 819 A 48 TYR HBy A 53 ILE HG2% 1.0 1.8 5.0 1143 820 A 48 TYR HD% A 49 THR H 1.0 1.8 5.0 1144 821 A 48 TYR HD% A 52 ASN HBy 1.0 1.8 5.0 1145 821 A 48 TYR HD% A 52 ASN HBx 1.0 1.8 5.0 1146 822 A 48 TYR HD% A 52 ASN HD2x 1.0 1.8 5.0 1147 822 A 48 TYR HD% A 52 ASN HD2y 1.0 1.8 5.0 1148 823 A 48 TYR HD% A 53 ILE HG1y 1.0 1.8 5.0 1149 823 A 48 TYR HD% A 53 ILE HG1x 1.0 1.8 5.0 1150 824 A 48 TYR HD% A 53 ILE HD1% 1.0 1.8 5.0 1151 825 A 49 THR H A 49 THR HG2% 1.0 1.8 5.0 1152 826 A 49 THR HG2% A 49 THR HA 1.0 1.8 3.5 1153 827 A 49 THR H A 49 THR HA 1.0 1.8 3.5 1154 828 A 49 THR H A 49 THR HB 1.0 1.8 5.0 1155 829 A 49 THR HA A 49 THR HB 1.0 1.8 3.5 1156 830 A 49 THR HG2% A 49 THR HB 1.0 1.8 3.5 1157 831 A 49 THR HA A 50 ASP H 1.0 1.8 3.5 1158 832 A 49 THR HB A 51 ALA H 1.0 1.8 5.0 1159 833 A 49 THR HB A 52 ASN HD2x 1.0 1.8 5.0 1160 833 A 49 THR HB A 52 ASN HD2y 1.0 1.8 5.0 1161 834 A 49 THR HG2% A 51 ALA H 1.0 1.8 5.0 1162 835 A 49 THR HG2% A 78 THR HA 1.0 1.8 5.0 1163 836 A 49 THR HG2% A 79 LYS H 1.0 1.8 5.0 1164 837 A 49 THR HG2% A 79 LYS HEy 1.0 1.8 5.0 1165 837 A 49 THR HG2% A 79 LYS HEx 1.0 1.8 5.0 1166 838 A 50 ASP H A 50 ASP HA 1.0 1.8 2.9 1167 839 A 50 ASP H A 50 ASP HBy 1.0 1.8 3.5 1168 840 A 50 ASP H A 50 ASP HBx 1.0 1.8 3.5 1169 841 A 50 ASP HA A 50 ASP HBy 1.0 1.8 3.5 1170 842 A 50 ASP HA A 50 ASP HBx 1.0 1.8 3.5 1171 843 A 50 ASP H A 52 ASN H 1.0 1.8 5.0 1172 844 A 51 ALA H A 50 ASP HA 1.0 1.8 5.0 1173 845 A 50 ASP HA A 52 ASN H 1.0 1.8 5.0 1174 846 A 50 ASP HA A 53 ILE H 1.0 1.8 5.0 1175 847 A 53 ILE HB A 50 ASP HA 1.0 1.8 5.0 1176 848 A 50 ASP HA A 54 LYS H 1.0 1.8 5.0 1177 849 A 53 ILE HG2% A 50 ASP HA 1.0 1.8 5.0 1178 850 A 51 ALA H A 50 ASP HBy 1.0 1.8 5.0 1179 851 A 51 ALA H A 50 ASP HBx 1.0 1.8 5.0 1180 852 A 51 ALA HA A 51 ALA HB% 1.0 1.8 3.5 1181 853 A 51 ALA H A 51 ALA HB% 1.0 1.8 2.9 1182 854 A 51 ALA H A 51 ALA HA 1.0 1.8 3.5 1183 855 A 50 ASP H A 51 ALA H 1.0 1.8 2.9 1184 856 A 51 ALA H A 53 ILE H 1.0 1.8 5.0 1185 857 A 52 ASN H A 51 ALA HA 1.0 1.8 3.5 1186 858 A 53 ILE H A 51 ALA HA 1.0 1.8 5.0 1187 859 A 54 LYS H A 51 ALA HA 1.0 1.8 5.0 1188 860 A 51 ALA HA A 55 LYS H 1.0 1.8 5.0 1189 861 A 52 ASN H A 51 ALA HB% 1.0 1.8 2.9 1190 862 A 51 ALA HB% A 75 ILE HG2% 1.0 1.8 5.0 1191 863 A 51 ALA HB% A 77 GLY HAx 1.0 1.8 5.0 1192 863 A 51 ALA HB% A 77 GLY HAy 1.0 1.8 5.0 1193 864 A 51 ALA HB% A 78 THR H 1.0 1.8 6.0 1194 865 A 78 THR HA A 51 ALA HB% 1.0 1.8 5.0 1195 866 A 51 ALA HB% A 78 THR HB 1.0 1.8 6.0 1196 867 A 51 ALA HA A 54 LYS HBx 1.0 1.8 3.5 1197 868 A 51 ALA HA A 54 LYS HBy 1.0 1.8 3.5 1198 869 A 52 ASN H A 52 ASN HBy 1.0 1.8 2.9 1199 869 A 52 ASN HBx A 52 ASN H 1.0 1.8 2.9 1200 870 A 52 ASN HA A 52 ASN HBy 1.0 1.8 2.9 1201 870 A 52 ASN HBx A 52 ASN HA 1.0 1.8 2.9 1202 871 A 52 ASN H A 54 LYS H 1.0 1.8 5.0 1203 872 A 52 ASN H A 75 ILE HG2% 1.0 1.8 5.0 1204 873 A 53 ILE H A 52 ASN HA 1.0 1.8 3.5 1205 874 A 54 LYS H A 52 ASN HA 1.0 1.8 5.0 1206 875 A 52 ASN HA A 55 LYS HBy 1.0 1.8 5.0 1207 876 A 52 ASN HA A 55 LYS HBx 1.0 1.8 5.0 1208 877 A 52 ASN HA A 75 ILE HD1% 1.0 1.8 5.0 1209 878 A 75 ILE HG2% A 52 ASN HA 1.0 1.8 5.0 1210 879 A 78 THR HB A 52 ASN HA 1.0 1.8 5.0 1211 880 A 52 ASN HBx A 53 ILE HG1y 1.0 1.8 5.0 1212 880 A 52 ASN HBy A 53 ILE HG1y 1.0 1.8 5.0 1213 880 A 53 ILE HG1x A 52 ASN HBy 1.0 1.8 5.0 1214 880 A 52 ASN HBx A 53 ILE HG1x 1.0 1.8 5.0 1215 881 A 75 ILE HG2% A 52 ASN HBy 1.0 1.8 5.0 1216 881 A 52 ASN HBx A 75 ILE HG2% 1.0 1.8 5.0 1217 882 A 78 THR HA A 52 ASN HBy 1.0 1.8 5.0 1218 882 A 52 ASN HBx A 78 THR HA 1.0 1.8 5.0 1219 883 A 78 THR HA A 52 ASN HBy 1.0 1.8 5.0 1220 883 A 52 ASN HBx A 78 THR HA 1.0 1.8 5.0 1221 884 A 78 THR HB A 52 ASN HBy 1.0 1.8 5.0 1222 884 A 52 ASN HBx A 78 THR HB 1.0 1.8 5.0 1223 885 A 41 GLY H A 52 ASN HD2x 1.0 1.8 5.0 1224 886 A 41 GLY H A 52 ASN HD2y 1.0 1.8 5.0 1225 887 A 75 ILE HD1% A 52 ASN HD2x 1.0 1.8 5.0 1226 887 A 75 ILE HD1% A 52 ASN HD2y 1.0 1.8 5.0 1227 888 A 59 TRP HE1 A 52 ASN HD2x 1.0 1.8 5.0 1228 888 A 59 TRP HE1 A 52 ASN HD2y 1.0 1.8 5.0 1229 889 A 52 ASN HD2y B 1 HEC HADx 1.0 1.8 3.5 1230 889 A 52 ASN HD2x B 1 HEC HADx 1.0 1.8 3.5 1231 890 A 52 ASN HD2y B 1 HEC HADy 1.0 1.8 3.5 1232 890 A 52 ASN HD2x B 1 HEC HADy 1.0 1.8 3.5 1233 891 A 53 ILE HA A 53 ILE H 1.0 1.8 5.0 1234 892 A 53 ILE HA A 53 ILE HD1% 1.0 1.8 5.0 1235 893 A 53 ILE HA A 53 ILE HG1y 1.0 1.8 3.5 1236 894 A 53 ILE HA A 53 ILE HG1x 1.0 1.8 3.5 1237 895 A 53 ILE HA A 53 ILE HG2% 1.0 1.8 5.0 1238 896 A 53 ILE HA A 53 ILE HB 1.0 1.8 2.9 1239 897 A 53 ILE HB A 53 ILE HG1y 1.0 1.8 3.5 1240 898 A 53 ILE HB A 53 ILE HG1x 1.0 1.8 3.5 1241 899 A 53 ILE HB A 53 ILE HD1% 1.0 1.8 5.0 1242 900 A 53 ILE HD1% A 53 ILE HG1y 1.0 1.8 3.5 1243 901 A 53 ILE HG1x A 53 ILE HD1% 1.0 1.8 3.5 1244 902 A 53 ILE HB A 53 ILE H 1.0 1.8 2.9 1245 903 A 53 ILE H A 53 ILE HD1% 1.0 1.8 5.0 1246 904 A 53 ILE HG2% A 53 ILE HG1y 1.0 1.8 2.9 1247 904 A 53 ILE HG2% A 53 ILE HG1x 1.0 1.8 2.9 1248 905 A 53 ILE HG2% A 53 ILE H 1.0 1.8 5.0 1249 906 A 53 ILE H A 53 ILE HG1y 1.0 1.8 5.0 1250 907 A 53 ILE HG1x A 53 ILE H 1.0 1.8 5.0 1251 908 A 53 ILE HA A 55 LYS H 1.0 1.8 5.0 1252 909 A 53 ILE HB A 54 LYS H 1.0 1.8 2.9 1253 910 A 52 ASN HD2y A 53 ILE HG1y 1.0 1.8 5.0 1254 910 A 53 ILE HG1x A 52 ASN HD2y 1.0 1.8 5.0 1255 911 A 54 LYS H A 53 ILE HG1y 1.0 1.8 5.0 1256 911 A 53 ILE HG1x A 54 LYS H 1.0 1.8 5.0 1257 912 A 53 ILE HG2% A 54 LYS HA 1.0 1.8 3.5 1258 913 A 53 ILE HG2% A 54 LYS H 1.0 1.8 5.0 1259 914 A 52 ASN H A 53 ILE H 1.0 1.8 5.0 1260 915 A 54 LYS HBx A 54 LYS HA 1.0 1.8 2.9 1261 916 A 54 LYS HBy A 54 LYS HA 1.0 1.8 2.9 1262 917 A 54 LYS H A 54 LYS HBx 1.0 1.8 3.5 1263 918 A 54 LYS H A 54 LYS HBy 1.0 1.8 3.5 1264 919 A 54 LYS HBx A 54 LYS HGx 1.0 1.8 3.5 1265 919 A 54 LYS HBx A 54 LYS HGy 1.0 1.8 3.5 1266 920 A 54 LYS HBy A 54 LYS HGx 1.0 1.8 3.5 1267 920 A 54 LYS HBy A 54 LYS HGy 1.0 1.8 3.5 1268 921 A 54 LYS H A 54 LYS HGx 1.0 1.8 5.0 1269 921 A 54 LYS H A 54 LYS HGy 1.0 1.8 5.0 1270 922 A 54 LYS HA A 54 LYS HGx 1.0 1.8 5.0 1271 922 A 54 LYS HA A 54 LYS HGy 1.0 1.8 5.0 1272 923 A 54 LYS H A 54 LYS HA 1.0 1.8 5.0 1273 924 A 53 ILE H A 54 LYS H 1.0 1.8 2.9 1274 925 A 55 LYS H A 54 LYS HA 1.0 1.8 5.0 1275 926 A 55 LYS H A 54 LYS HBx 1.0 1.8 3.5 1276 927 A 55 LYS H A 54 LYS HBy 1.0 1.8 5.0 1277 928 A 55 LYS H A 54 LYS HGx 1.0 1.8 3.5 1278 928 A 55 LYS H A 54 LYS HGy 1.0 1.8 3.5 1279 929 A 55 LYS H A 55 LYS HA 1.0 1.8 3.5 1280 930 A 55 LYS H A 55 LYS HBy 1.0 1.8 3.5 1281 931 A 55 LYS H A 55 LYS HBx 1.0 1.8 5.0 1282 932 A 55 LYS HBy A 55 LYS HA 1.0 1.8 3.5 1283 933 A 55 LYS HBx A 55 LYS HA 1.0 1.8 5.0 1284 934 A 55 LYS HBy A 55 LYS HGx 1.0 1.8 3.5 1285 934 A 55 LYS HBy A 55 LYS HGy 1.0 1.8 3.5 1286 935 A 55 LYS HBx A 55 LYS HGx 1.0 1.8 5.0 1287 935 A 55 LYS HBx A 55 LYS HGy 1.0 1.8 5.0 1288 936 A 55 LYS H A 55 LYS HGx 1.0 1.8 5.0 1289 936 A 55 LYS H A 55 LYS HGy 1.0 1.8 5.0 1290 937 A 55 LYS HA A 55 LYS HGx 1.0 1.8 5.0 1291 937 A 55 LYS HA A 55 LYS HGy 1.0 1.8 5.0 1292 938 A 53 ILE H A 55 LYS H 1.0 1.8 5.0 1293 939 A 55 LYS HBy A 75 ILE HA 1.0 1.8 5.0 1294 940 A 55 LYS HBx A 75 ILE HA 1.0 1.8 5.0 1295 941 A 56 ASN H A 56 ASN HBy 1.0 1.8 3.5 1296 941 A 56 ASN HBx A 56 ASN H 1.0 1.8 3.5 1297 942 A 56 ASN HA A 56 ASN HBx 1.0 1.8 3.5 1298 943 A 56 ASN HA A 56 ASN H 1.0 1.8 3.5 1299 944 A 56 ASN HA A 40 SER H 1.0 1.8 5.0 1300 945 A 57 VAL HA A 57 VAL HB 1.0 1.8 2.9 1301 946 A 57 VAL HA A 57 VAL HGy% 1.0 1.8 2.9 1302 946 A 57 VAL HA A 57 VAL HGx% 1.0 1.8 2.9 1303 947 A 57 VAL HA A 57 VAL H 1.0 1.8 2.9 1304 948 A 57 VAL HGx% A 57 VAL HB 1.0 1.8 3.5 1305 949 A 57 VAL HGy% A 57 VAL HB 1.0 1.8 3.5 1306 950 A 57 VAL H A 57 VAL HB 1.0 1.8 3.5 1307 951 A 57 VAL H A 57 VAL HGx% 1.0 1.8 5.0 1308 952 A 57 VAL H A 57 VAL HGy% 1.0 1.8 5.0 1309 953 A 39 HIS HD1 A 57 VAL HA 1.0 1.8 6.0 1310 954 A 57 VAL HA A 58 LEU H 1.0 1.8 3.5 1311 955 A 58 LEU H A 57 VAL HB 1.0 1.8 5.0 1312 956 A 59 TRP HZ2 A 57 VAL HB 1.0 1.8 5.0 1313 957 A 58 LEU H A 57 VAL HGx% 1.0 1.8 5.0 1314 958 A 58 LEU H A 57 VAL HGy% 1.0 1.8 5.0 1315 959 A 57 VAL HGy% A 59 TRP HE3 1.0 1.8 5.0 1316 959 A 57 VAL HGx% A 59 TRP HE3 1.0 1.8 5.0 1317 960 A 57 VAL HGy% A 59 TRP HZ3 1.0 1.8 5.0 1318 960 A 57 VAL HGx% A 59 TRP HZ3 1.0 1.8 5.0 1319 961 A 57 VAL HGy% A 74 TYR HE% 1.0 1.8 5.0 1320 961 A 57 VAL HGx% A 74 TYR HE% 1.0 1.8 5.0 1321 962 A 57 VAL HGy% A 75 ILE HD1% 1.0 1.8 5.0 1322 962 A 57 VAL HGx% A 75 ILE HD1% 1.0 1.8 5.0 1323 963 A 40 SER H A 57 VAL HGx% 1.0 1.8 5.0 1324 964 A 40 SER H A 57 VAL HGy% 1.0 1.8 5.0 1325 965 A 57 VAL HGx% A 63 ASN HD2y 1.0 1.8 3.5 1326 965 A 57 VAL HGy% A 63 ASN HD2y 1.0 1.8 3.5 1327 965 A 57 VAL HGy% A 63 ASN HD2x 1.0 1.8 3.5 1328 965 A 57 VAL HGx% A 63 ASN HD2x 1.0 1.8 3.5 1329 966 A 40 SER H A 57 VAL H 1.0 1.8 5.0 1330 967 A 58 LEU HA A 58 LEU H 1.0 1.8 2.9 1331 968 A 58 LEU HDx% A 58 LEU HA 1.0 1.8 5.0 1332 969 A 58 LEU HDy% A 58 LEU HA 1.0 1.8 5.0 1333 970 A 58 LEU HDx% A 58 LEU HBx 1.0 1.8 3.5 1334 970 A 58 LEU HDx% A 58 LEU HBy 1.0 1.8 3.5 1335 971 A 58 LEU HDy% A 58 LEU HBx 1.0 1.8 3.5 1336 971 A 58 LEU HDy% A 58 LEU HBy 1.0 1.8 3.5 1337 972 A 58 LEU H A 58 LEU HBy 1.0 1.8 3.5 1338 973 A 58 LEU H A 58 LEU HBx 1.0 1.8 3.5 1339 974 A 58 LEU HDy% A 58 LEU H 1.0 1.8 5.0 1340 974 A 58 LEU HDx% A 58 LEU H 1.0 1.8 5.0 1341 975 A 58 LEU H A 58 LEU HG 1.0 1.8 5.0 1342 976 A 58 LEU HA A 58 LEU HBy 1.0 1.8 3.5 1343 977 A 58 LEU HA A 58 LEU HBx 1.0 1.8 3.5 1344 978 A 58 LEU HA A 58 LEU HG 1.0 1.8 5.0 1345 979 A 58 LEU HDx% A 58 LEU HG 1.0 1.8 3.5 1346 980 A 58 LEU HDy% A 58 LEU HG 1.0 1.8 3.5 1347 981 A 39 HIS HD1 A 58 LEU H 1.0 1.8 5.0 1348 982 A 58 LEU H A 57 VAL H 1.0 1.8 5.0 1349 983 A 58 LEU HA A 59 TRP H 1.0 1.8 5.0 1350 984 A 39 HIS HD1 A 58 LEU HBx 1.0 1.8 5.0 1351 984 A 39 HIS HD1 A 58 LEU HBy 1.0 1.8 5.0 1352 985 A 39 HIS HE1 A 58 LEU HBx 1.0 1.8 5.0 1353 985 A 39 HIS HE1 A 58 LEU HBy 1.0 1.8 5.0 1354 986 A 59 TRP H A 58 LEU HBx 1.0 1.8 5.0 1355 986 A 58 LEU HBy A 59 TRP H 1.0 1.8 5.0 1356 987 A 59 TRP HE3 A 58 LEU HG 1.0 1.8 6.0 1357 988 A 59 TRP HD1 A 58 LEU HBx 1.0 1.8 6.3 1358 988 A 59 TRP HD1 A 58 LEU HBy 1.0 1.8 6.3 1359 989 A 58 LEU HG A 59 TRP H 1.0 1.8 5.0 1360 990 A 58 LEU HG A 60 ASP H 1.0 1.8 5.0 1361 991 A 37 GLY H A 58 LEU HDy% 1.0 1.8 5.0 1362 991 A 37 GLY H A 58 LEU HDx% 1.0 1.8 5.0 1363 992 A 38 ARG H A 58 LEU HDy% 1.0 1.8 3.5 1364 992 A 38 ARG H A 58 LEU HDx% 1.0 1.8 3.5 1365 993 A 39 HIS H A 58 LEU HDy% 1.0 1.8 5.0 1366 993 A 39 HIS H A 58 LEU HDx% 1.0 1.8 5.0 1367 994 A 58 LEU HDx% A 59 TRP H 1.0 1.8 5.0 1368 995 A 58 LEU HDy% A 59 TRP H 1.0 1.8 5.0 1369 996 A 58 LEU HDx% A 39 HIS HD1 1.0 1.8 5.0 1370 997 A 58 LEU HDy% A 39 HIS HD1 1.0 1.8 5.0 1371 998 A 58 LEU HDx% A 39 HIS HE1 1.0 1.8 5.0 1372 999 A 58 LEU HDy% A 39 HIS HE1 1.0 1.8 5.0 1373 1000 A 59 TRP HZ2 A 58 LEU HG 1.0 1.8 6.0 1374 1000 A 59 TRP HD1 A 58 LEU HG 1.0 1.8 6.0 1375 1001 A 59 TRP HZ2 A 58 LEU HDy% 1.0 1.8 5.0 1376 1001 A 59 TRP HD1 A 58 LEU HDy% 1.0 1.8 5.0 1377 1001 A 59 TRP HZ2 A 58 LEU HDx% 1.0 1.8 5.0 1378 1001 A 59 TRP HD1 A 58 LEU HDx% 1.0 1.8 5.0 1379 1002 A 58 LEU HDy% A 59 TRP HE3 1.0 1.8 6.0 1380 1002 A 58 LEU HDx% A 59 TRP HE3 1.0 1.8 6.0 1381 1003 A 58 LEU HDx% A 63 ASN HD2x 1.0 1.8 5.0 1382 1003 A 58 LEU HDx% A 63 ASN HD2y 1.0 1.8 5.0 1383 1003 A 58 LEU HDy% A 63 ASN HD2y 1.0 1.8 5.0 1384 1003 A 58 LEU HDy% A 63 ASN HD2x 1.0 1.8 5.0 1385 1004 A 59 TRP HD1 A 59 TRP HBy 1.0 1.8 5.0 1386 1005 A 59 TRP HD1 A 59 TRP HBx 1.0 1.8 3.5 1387 1006 A 59 TRP HD1 A 59 TRP HA 1.0 1.8 5.0 1388 1007 A 59 TRP HA A 59 TRP HH2 1.0 1.8 6.0 1389 1008 A 59 TRP HBy A 59 TRP HA 1.0 1.8 3.5 1390 1009 A 59 TRP HA A 59 TRP HBx 1.0 1.8 3.5 1391 1010 A 59 TRP HBy A 59 TRP H 1.0 1.8 3.5 1392 1011 A 59 TRP H A 59 TRP HBx 1.0 1.8 3.5 1393 1012 A 59 TRP HD1 A 59 TRP H 1.0 1.8 5.0 1394 1013 A 59 TRP HE1 A 59 TRP HBx 1.0 1.8 5.0 1395 1013 A 59 TRP HBy A 59 TRP HE1 1.0 1.8 5.0 1396 1014 A 58 LEU H A 59 TRP H 1.0 1.8 5.0 1397 1015 A 59 TRP HBy A 37 GLY H 1.0 1.8 5.0 1398 1016 A 37 GLY H A 59 TRP HBx 1.0 1.8 5.0 1399 1017 A 38 ARG H A 59 TRP HBx 1.0 1.8 5.0 1400 1017 A 38 ARG H A 59 TRP HBy 1.0 1.8 5.0 1401 1018 A 60 ASP H A 59 TRP HBx 1.0 1.8 5.0 1402 1018 A 59 TRP HBy A 60 ASP H 1.0 1.8 5.0 1403 1019 A 59 TRP HBy A 63 ASN HD2x 1.0 1.8 5.0 1404 1019 A 59 TRP HBy A 63 ASN HD2y 1.0 1.8 5.0 1405 1019 A 63 ASN HD2y A 59 TRP HBx 1.0 1.8 5.0 1406 1019 A 63 ASN HD2x A 59 TRP HBx 1.0 1.8 5.0 1407 1020 A 38 ARG H A 59 TRP HD1 1.0 1.8 3.5 1408 1021 A 59 TRP HE1 A 52 ASN HD2x 1.0 1.8 5.0 1409 1021 A 59 TRP HE1 A 52 ASN HD2y 1.0 1.8 5.0 1410 1022 A 59 TRP HE3 A 64 MET H 1.0 1.8 5.0 1411 1023 A 59 TRP HE3 A 64 MET HA 1.0 1.8 5.0 1412 1024 A 59 TRP HE3 A 64 MET HBy 1.0 1.8 5.0 1413 1024 A 59 TRP HE3 A 64 MET HBx 1.0 1.8 5.0 1414 1025 A 64 MET HE% A 59 TRP HE3 1.0 1.8 5.0 1415 1026 A 59 TRP HH2 A 64 MET HA 1.0 1.8 5.0 1416 1027 A 59 TRP HZ2 A 64 MET HA 1.0 1.8 6.0 1417 1028 A 59 TRP HZ2 A 64 MET HGy 1.0 1.8 6.0 1418 1028 A 59 TRP HZ2 A 64 MET HGx 1.0 1.8 6.0 1419 1029 A 59 TRP HZ2 A 64 MET HE% 1.0 1.8 5.0 1420 1030 A 59 TRP HZ2 A 67 TYR HBx 1.0 1.8 5.0 1421 1030 A 59 TRP HZ2 A 67 TYR HBy 1.0 1.8 5.0 1422 1031 A 75 ILE HD1% A 59 TRP HH2 1.0 1.8 5.0 1423 1032 A 59 TRP HZ3 A 64 MET HA 1.0 1.8 5.0 1424 1033 A 59 TRP HZ3 A 64 MET HBy 1.0 1.8 5.0 1425 1034 A 59 TRP HZ3 A 64 MET HBx 1.0 1.8 5.0 1426 1035 A 59 TRP HZ3 A 64 MET HGy 1.0 1.8 5.0 1427 1036 A 64 MET HGx A 59 TRP HZ3 1.0 1.8 5.0 1428 1037 A 59 TRP HZ3 A 67 TYR HBy 1.0 1.8 5.0 1429 1038 A 59 TRP HZ3 A 67 TYR HBx 1.0 1.8 5.0 1430 1039 A 59 TRP HH2 A 64 MET HA 1.0 1.8 5.0 1431 1040 A 59 TRP HH2 A 67 TYR HBx 1.0 1.8 5.0 1432 1040 A 59 TRP HH2 A 67 TYR HBy 1.0 1.8 5.0 1433 1041 A 60 ASP H A 60 ASP HBx 1.0 1.8 3.5 1434 1042 A 60 ASP H A 60 ASP HBy 1.0 1.8 3.5 1435 1043 A 60 ASP HBx A 60 ASP HA 1.0 1.8 3.5 1436 1044 A 60 ASP HBy A 60 ASP HA 1.0 1.8 3.5 1437 1045 A 60 ASP H A 62 ASN H 1.0 1.8 5.0 1438 1046 A 59 TRP HE3 A 60 ASP H 1.0 1.8 5.0 1439 1047 A 60 ASP H A 63 ASN HD2y 1.0 1.8 5.0 1440 1047 A 60 ASP H A 63 ASN HD2x 1.0 1.8 5.0 1441 1048 A 61 GLU H A 60 ASP HBx 1.0 1.8 5.0 1442 1049 A 61 GLU H A 60 ASP HBy 1.0 1.8 5.0 1443 1050 A 60 ASP H A 63 ASN H 1.0 1.8 3.5 1444 1051 A 61 GLU HA A 61 GLU HGx 1.0 1.8 3.5 1445 1051 A 61 GLU HGy A 61 GLU HA 1.0 1.8 3.5 1446 1052 A 61 GLU H A 61 GLU HA 1.0 1.8 3.5 1447 1053 A 61 GLU H A 61 GLU HBy 1.0 1.8 5.0 1448 1054 A 61 GLU H A 61 GLU HBx 1.0 1.8 5.0 1449 1055 A 61 GLU H A 61 GLU HGx 1.0 1.8 5.0 1450 1055 A 61 GLU HGy A 61 GLU H 1.0 1.8 5.0 1451 1056 A 61 GLU HA A 61 GLU HBy 1.0 1.8 3.5 1452 1057 A 61 GLU HA A 61 GLU HBx 1.0 1.8 3.5 1453 1058 A 61 GLU HGy A 61 GLU HBy 1.0 1.8 5.0 1454 1058 A 61 GLU HBy A 61 GLU HGx 1.0 1.8 5.0 1455 1059 A 61 GLU HGy A 61 GLU HBx 1.0 1.8 5.0 1456 1059 A 61 GLU HBx A 61 GLU HGx 1.0 1.8 5.0 1457 1060 A 95 ILE HG2% A 61 GLU H 1.0 1.8 6.0 1458 1061 A 61 GLU HA A 62 ASN HBy 1.0 1.8 6.0 1459 1061 A 61 GLU HA A 62 ASN HBx 1.0 1.8 6.0 1460 1062 A 61 GLU HA A 62 ASN H 1.0 1.8 3.5 1461 1063 A 61 GLU HA A 64 MET HBx 1.0 1.8 5.0 1462 1063 A 61 GLU HA A 64 MET HBy 1.0 1.8 5.0 1463 1064 A 61 GLU HA A 64 MET H 1.0 1.8 5.0 1464 1065 A 61 GLU HA A 65 SER H 1.0 1.8 5.0 1465 1066 A 61 GLU HA A 64 MET HBy 1.0 1.8 5.0 1466 1067 A 61 GLU HA A 64 MET HBx 1.0 1.8 5.0 1467 1068 A 61 GLU HA A 64 MET HGy 1.0 1.8 6.0 1468 1068 A 61 GLU HA A 64 MET HGx 1.0 1.8 6.0 1469 1069 A 95 ILE HG2% A 61 GLU HA 1.0 1.8 5.0 1470 1070 A 61 GLU HBy A 62 ASN H 1.0 1.8 5.0 1471 1071 A 62 ASN H A 61 GLU HBx 1.0 1.8 5.0 1472 1072 A 61 GLU HBx A 64 MET HGy 1.0 1.8 6.0 1473 1072 A 64 MET HGx A 61 GLU HBx 1.0 1.8 6.0 1474 1072 A 64 MET HGx A 61 GLU HBy 1.0 1.8 6.0 1475 1072 A 61 GLU HBy A 64 MET HGy 1.0 1.8 6.0 1476 1073 A 95 ILE HG2% A 61 GLU HBy 1.0 1.8 5.0 1477 1074 A 95 ILE HG2% A 61 GLU HBx 1.0 1.8 5.0 1478 1075 A 36 PHE HD% A 61 GLU HGx 1.0 1.8 3.5 1479 1075 A 61 GLU HGy A 36 PHE HD% 1.0 1.8 3.5 1480 1076 A 60 ASP H A 61 GLU HGx 1.0 1.8 6.0 1481 1076 A 61 GLU HGy A 60 ASP H 1.0 1.8 6.0 1482 1077 A 95 ILE HG2% A 61 GLU HGx 1.0 1.8 6.0 1483 1077 A 61 GLU HGy A 95 ILE HG2% 1.0 1.8 6.0 1484 1078 A 62 ASN HA A 62 ASN HD2x 1.0 1.8 5.0 1485 1078 A 62 ASN HA A 62 ASN HD2y 1.0 1.8 5.0 1486 1079 A 62 ASN HD2x A 62 ASN HBy 1.0 1.8 5.0 1487 1080 A 62 ASN HD2y A 62 ASN HBy 1.0 1.8 5.0 1488 1081 A 62 ASN HBx A 62 ASN HD2x 1.0 1.8 5.0 1489 1082 A 62 ASN HBx A 62 ASN HD2y 1.0 1.8 5.0 1490 1083 A 62 ASN H A 62 ASN HBy 1.0 1.8 5.0 1491 1084 A 62 ASN H A 62 ASN HBx 1.0 1.8 5.0 1492 1085 A 62 ASN HD2x A 62 ASN HD2y 1.0 1.8 2.9 1493 1086 A 62 ASN HBx A 62 ASN HA 1.0 1.8 5.0 1494 1087 A 62 ASN HA A 62 ASN HBy 1.0 1.8 5.0 1495 1088 A 62 ASN H A 62 ASN HA 1.0 1.8 5.0 1496 1089 A 63 ASN H A 62 ASN HA 1.0 1.8 5.0 1497 1090 A 64 MET H A 62 ASN HA 1.0 1.8 5.0 1498 1091 A 65 SER H A 62 ASN HA 1.0 1.8 5.0 1499 1092 A 62 ASN HA A 65 SER HBy 1.0 1.8 5.0 1500 1092 A 65 SER HBx A 62 ASN HA 1.0 1.8 5.0 1501 1093 A 62 ASN HA A 66 GLU H 1.0 1.8 5.0 1502 1094 A 63 ASN H A 62 ASN HBy 1.0 1.8 5.0 1503 1095 A 63 ASN H A 62 ASN HBx 1.0 1.8 5.0 1504 1096 A 61 GLU H A 62 ASN H 1.0 1.8 5.0 1505 1097 A 63 ASN HD2y A 63 ASN HBy 1.0 1.8 5.0 1506 1098 A 63 ASN HD2x A 63 ASN HBy 1.0 1.8 5.0 1507 1099 A 63 ASN HD2y A 63 ASN HBx 1.0 1.8 5.0 1508 1100 A 63 ASN HD2x A 63 ASN HBx 1.0 1.8 5.0 1509 1101 A 63 ASN H A 63 ASN HBy 1.0 1.8 3.5 1510 1102 A 63 ASN H A 63 ASN HBx 1.0 1.8 3.5 1511 1103 A 63 ASN HD2y A 63 ASN HD2x 1.0 1.8 2.9 1512 1104 A 63 ASN HA A 63 ASN HBy 1.0 1.8 5.0 1513 1105 A 63 ASN HA A 63 ASN HBx 1.0 1.8 5.0 1514 1106 A 63 ASN H A 63 ASN HA 1.0 1.8 5.0 1515 1107 A 61 GLU H A 63 ASN H 1.0 1.8 5.0 1516 1108 A 63 ASN H A 65 SER H 1.0 1.8 5.0 1517 1109 A 62 ASN H A 63 ASN H 1.0 1.8 2.9 1518 1110 A 64 MET H A 63 ASN HA 1.0 1.8 3.5 1519 1111 A 65 SER H A 63 ASN HA 1.0 1.8 5.0 1520 1112 A 63 ASN HA A 66 GLU HBx 1.0 1.8 5.0 1521 1112 A 63 ASN HA A 66 GLU HBy 1.0 1.8 5.0 1522 1113 A 66 GLU H A 63 ASN HA 1.0 1.8 5.0 1523 1114 A 63 ASN HA A 67 TYR H 1.0 1.8 5.0 1524 1115 A 59 TRP HE3 A 63 ASN HBy 1.0 1.8 5.0 1525 1115 A 59 TRP HE3 A 63 ASN HBx 1.0 1.8 5.0 1526 1116 A 60 ASP H A 63 ASN HBy 1.0 1.8 5.0 1527 1117 A 60 ASP H A 63 ASN HBx 1.0 1.8 5.0 1528 1118 A 62 ASN H A 63 ASN HBy 1.0 1.8 5.0 1529 1118 A 62 ASN H A 63 ASN HBx 1.0 1.8 5.0 1530 1119 A 64 MET HA A 63 ASN HBy 1.0 1.8 5.0 1531 1119 A 64 MET HA A 63 ASN HBx 1.0 1.8 5.0 1532 1120 A 64 MET H A 63 ASN HBy 1.0 1.8 5.0 1533 1120 A 64 MET H A 63 ASN HBx 1.0 1.8 5.0 1534 1121 A 64 MET H A 64 MET HA 1.0 1.8 3.5 1535 1122 A 64 MET H A 64 MET HBy 1.0 1.8 3.5 1536 1123 A 64 MET H A 64 MET HBx 1.0 1.8 3.5 1537 1124 A 64 MET HA A 64 MET HBy 1.0 1.8 3.5 1538 1125 A 64 MET HA A 64 MET HBx 1.0 1.8 3.5 1539 1126 A 64 MET HE% A 64 MET H 1.0 1.8 5.0 1540 1127 A 64 MET H A 64 MET HGy 1.0 1.8 3.5 1541 1127 A 64 MET HGx A 64 MET H 1.0 1.8 3.5 1542 1128 A 64 MET HE% A 64 MET HBy 1.0 1.8 5.0 1543 1128 A 64 MET HE% A 64 MET HBx 1.0 1.8 5.0 1544 1129 A 64 MET HBy A 64 MET HGy 1.0 1.8 3.5 1545 1129 A 64 MET HGx A 64 MET HBy 1.0 1.8 3.5 1546 1129 A 64 MET HBx A 64 MET HGy 1.0 1.8 3.5 1547 1129 A 64 MET HGx A 64 MET HBx 1.0 1.8 3.5 1548 1130 A 59 TRP HE3 A 64 MET H 1.0 1.8 5.0 1549 1131 A 64 MET H A 62 ASN H 1.0 1.8 5.0 1550 1132 A 64 MET H A 63 ASN H 1.0 1.8 2.9 1551 1133 A 64 MET H A 65 SER H 1.0 1.8 3.5 1552 1134 A 64 MET H A 66 GLU H 1.0 1.8 5.0 1553 1135 A 59 TRP HE3 A 64 MET HA 1.0 1.8 5.0 1554 1136 A 59 TRP HZ2 A 64 MET HA 1.0 1.8 6.0 1555 1137 A 64 MET HA A 65 SER H 1.0 1.8 5.0 1556 1138 A 64 MET HA A 66 GLU H 1.0 1.8 5.0 1557 1139 A 64 MET HA A 67 TYR HBy 1.0 1.8 5.0 1558 1140 A 64 MET HA A 67 TYR HBx 1.0 1.8 5.0 1559 1141 A 64 MET HA A 67 TYR H 1.0 1.8 5.0 1560 1142 A 64 MET HA A 68 LEU H 1.0 1.8 5.0 1561 1143 A 59 TRP HE3 A 64 MET HBy 1.0 1.8 5.0 1562 1144 A 59 TRP HE3 A 64 MET HBx 1.0 1.8 5.0 1563 1145 A 95 ILE HD1% A 64 MET HBx 1.0 1.8 5.0 1564 1145 A 95 ILE HD1% A 64 MET HBy 1.0 1.8 5.0 1565 1146 A 64 MET HBy A 95 ILE HG1y 1.0 1.8 5.0 1566 1146 A 64 MET HBx A 95 ILE HG1y 1.0 1.8 5.0 1567 1146 A 95 ILE HG1x A 64 MET HBx 1.0 1.8 5.0 1568 1146 A 95 ILE HG1x A 64 MET HBy 1.0 1.8 5.0 1569 1147 A 95 ILE HG2% A 64 MET HBx 1.0 1.8 5.0 1570 1147 A 95 ILE HG2% A 64 MET HBy 1.0 1.8 5.0 1571 1148 A 59 TRP HE3 A 64 MET HGy 1.0 1.8 5.0 1572 1149 A 64 MET HGx A 59 TRP HE3 1.0 1.8 5.0 1573 1150 A 59 TRP HE1 A 64 MET HGy 1.0 1.8 6.0 1574 1150 A 59 TRP HE1 A 64 MET HGx 1.0 1.8 6.0 1575 1151 A 65 SER H A 64 MET HGy 1.0 1.8 5.0 1576 1151 A 64 MET HGx A 65 SER H 1.0 1.8 5.0 1577 1152 A 64 MET HE% A 67 TYR HBy 1.0 1.8 5.0 1578 1153 A 64 MET HE% A 67 TYR HBx 1.0 1.8 5.0 1579 1154 A 64 MET HE% A 68 LEU H 1.0 1.8 5.0 1580 1155 A 64 MET HE% A 68 LEU HG 1.0 1.8 5.0 1581 1156 A 36 PHE HE% A 64 MET HE% 1.0 1.8 3.5 1582 1157 A 36 PHE HZ A 64 MET HE% 1.0 1.8 3.5 1583 1158 A 36 PHE HD% A 64 MET HE% 1.0 1.8 3.5 1584 1159 A 64 MET HE% A 94 LEU HDx% 1.0 1.8 6.0 1585 1160 A 94 LEU HDy% A 64 MET HE% 1.0 1.8 6.0 1586 1161 B 1 HEC HMA1 A 64 MET HE% 1.0 1.8 3.5 1587 1162 A 64 MET HE% A 68 LEU HG 1.0 1.8 5.0 1588 1163 A 65 SER H A 65 SER HA 1.0 1.8 2.9 1589 1164 A 65 SER H A 65 SER HBy 1.0 1.8 3.5 1590 1164 A 65 SER HBx A 65 SER H 1.0 1.8 3.5 1591 1165 A 65 SER HA A 65 SER HBy 1.0 1.8 3.5 1592 1165 A 65 SER HBx A 65 SER HA 1.0 1.8 3.5 1593 1166 A 65 SER H A 66 GLU H 1.0 1.8 2.9 1594 1167 A 65 SER H A 67 TYR H 1.0 1.8 5.0 1595 1168 A 66 GLU H A 65 SER HA 1.0 1.8 5.0 1596 1169 A 67 TYR H A 65 SER HA 1.0 1.8 5.0 1597 1170 A 65 SER HA A 68 LEU HBx 1.0 1.8 5.0 1598 1170 A 65 SER HA A 68 LEU HBy 1.0 1.8 5.0 1599 1171 A 68 LEU H A 65 SER HA 1.0 1.8 5.0 1600 1172 A 65 SER HA A 69 THR H 1.0 1.8 5.0 1601 1173 A 65 SER HA A 95 ILE HG1y 1.0 1.8 5.0 1602 1173 A 95 ILE HG1x A 65 SER HA 1.0 1.8 5.0 1603 1174 A 95 ILE HD1% A 65 SER HBy 1.0 1.8 5.0 1604 1174 A 65 SER HBx A 95 ILE HD1% 1.0 1.8 5.0 1605 1175 A 66 GLU H A 65 SER HBy 1.0 1.8 3.5 1606 1175 A 65 SER HBx A 66 GLU H 1.0 1.8 3.5 1607 1176 A 66 GLU H A 66 GLU HGy 1.0 1.8 3.5 1608 1177 A 66 GLU H A 66 GLU HGx 1.0 1.8 3.5 1609 1178 A 66 GLU H A 66 GLU HA 1.0 1.8 3.5 1610 1179 A 66 GLU H A 66 GLU HBx 1.0 1.8 3.5 1611 1179 A 66 GLU H A 66 GLU HBy 1.0 1.8 3.5 1612 1180 A 67 TYR H A 66 GLU HA 1.0 1.8 5.0 1613 1181 A 68 LEU H A 66 GLU HA 1.0 1.8 5.0 1614 1182 A 69 THR H A 66 GLU HA 1.0 1.8 5.0 1615 1183 A 66 GLU HA A 70 ASN H 1.0 1.8 6.0 1616 1184 A 66 GLU HA A 69 THR HB 1.0 1.8 5.0 1617 1185 A 66 GLU HA A 69 THR HG2% 1.0 1.8 5.0 1618 1186 A 67 TYR H A 66 GLU HBx 1.0 1.8 3.5 1619 1186 A 66 GLU HBy A 67 TYR H 1.0 1.8 3.5 1620 1187 A 74 TYR HD% A 66 GLU HGy 1.0 1.8 5.0 1621 1187 A 66 GLU HGx A 74 TYR HD% 1.0 1.8 5.0 1622 1188 A 74 TYR HE% A 66 GLU HGy 1.0 1.8 5.0 1623 1188 A 74 TYR HE% A 66 GLU HGx 1.0 1.8 5.0 1624 1189 A 67 TYR H A 67 TYR HA 1.0 1.8 3.5 1625 1190 A 67 TYR HBy A 67 TYR HA 1.0 1.8 5.0 1626 1191 A 67 TYR HA A 67 TYR HBx 1.0 1.8 5.0 1627 1192 A 67 TYR HBy A 67 TYR H 1.0 1.8 5.0 1628 1193 A 67 TYR H A 67 TYR HBx 1.0 1.8 5.0 1629 1194 A 67 TYR HBy A 67 TYR HD% 1.0 1.8 2.9 1630 1195 A 67 TYR HD% A 67 TYR HBx 1.0 1.8 2.9 1631 1196 A 67 TYR H A 67 TYR HD% 1.0 1.8 5.0 1632 1197 A 67 TYR HD% A 67 TYR HE% 1.0 1.8 3.5 1633 1198 A 68 LEU H A 67 TYR HA 1.0 1.8 5.0 1634 1199 A 69 THR H A 67 TYR HA 1.0 1.8 5.0 1635 1200 A 68 LEU H A 67 TYR HBx 1.0 1.8 3.5 1636 1200 A 67 TYR HBy A 68 LEU H 1.0 1.8 3.5 1637 1201 A 59 TRP HZ2 A 67 TYR HBy 1.0 1.8 6.0 1638 1202 A 59 TRP HZ2 A 67 TYR HBx 1.0 1.8 5.0 1639 1203 A 66 GLU H A 67 TYR H 1.0 1.8 5.0 1640 1204 A 67 TYR H A 69 THR H 1.0 1.8 5.0 1641 1205 A 74 TYR HD% A 67 TYR HA 1.0 1.8 5.0 1642 1206 A 67 TYR HD% A 68 LEU HDx% 1.0 1.8 5.0 1643 1207 A 67 TYR HD% A 68 LEU HDy% 1.0 1.8 5.0 1644 1208 A 75 ILE HG2% A 67 TYR HD% 1.0 1.8 5.0 1645 1209 A 67 TYR HE% A 68 LEU HDy% 1.0 1.8 5.0 1646 1209 A 67 TYR HE% A 68 LEU HDx% 1.0 1.8 5.0 1647 1210 A 68 LEU HG A 68 LEU HA 1.0 1.8 3.5 1648 1211 A 68 LEU H A 68 LEU HA 1.0 1.8 2.9 1649 1212 A 68 LEU H A 68 LEU HBy 1.0 1.8 3.5 1650 1213 A 68 LEU H A 68 LEU HBx 1.0 1.8 3.5 1651 1214 A 68 LEU H A 68 LEU HG 1.0 1.8 5.0 1652 1215 A 68 LEU H A 68 LEU HDx% 1.0 1.8 5.0 1653 1216 A 68 LEU H A 68 LEU HDy% 1.0 1.8 5.0 1654 1217 A 68 LEU HBy A 68 LEU HA 1.0 1.8 3.5 1655 1218 A 68 LEU HA A 68 LEU HBx 1.0 1.8 3.5 1656 1219 A 68 LEU HG A 68 LEU HBy 1.0 1.8 3.5 1657 1220 A 68 LEU HG A 68 LEU HBx 1.0 1.8 3.5 1658 1221 A 68 LEU HBy A 68 LEU HDx% 1.0 1.8 3.5 1659 1222 A 68 LEU HDx% A 68 LEU HBx 1.0 1.8 3.5 1660 1223 A 68 LEU HBy A 68 LEU HDy% 1.0 1.8 3.5 1661 1224 A 68 LEU HDy% A 68 LEU HBx 1.0 1.8 3.5 1662 1225 A 68 LEU HG A 68 LEU HDy% 1.0 1.8 3.5 1663 1226 A 68 LEU HG A 68 LEU HDy% 1.0 1.8 3.5 1664 1227 A 67 TYR H A 68 LEU H 1.0 1.8 3.5 1665 1228 A 69 THR H A 68 LEU HA 1.0 1.8 3.5 1666 1229 A 68 LEU HBy A 69 THR H 1.0 1.8 5.0 1667 1230 A 69 THR H A 68 LEU HBx 1.0 1.8 5.0 1668 1231 A 68 LEU HBy A 85 LEU HBx 1.0 1.8 5.0 1669 1231 A 85 LEU HBy A 68 LEU HBx 1.0 1.8 5.0 1670 1231 A 68 LEU HBy A 85 LEU HBy 1.0 1.8 5.0 1671 1231 A 68 LEU HBx A 85 LEU HBx 1.0 1.8 5.0 1672 1232 A 85 LEU H A 68 LEU HBx 1.0 1.8 6.0 1673 1232 A 68 LEU HBy A 85 LEU H 1.0 1.8 6.0 1674 1233 A 68 LEU HG A 69 THR H 1.0 1.8 5.0 1675 1234 A 69 THR H A 68 LEU HDy% 1.0 1.8 5.0 1676 1234 A 69 THR H A 68 LEU HDx% 1.0 1.8 5.0 1677 1235 A 68 LEU HDx% A 94 LEU HDx% 1.0 1.8 5.0 1678 1236 A 94 LEU HDy% A 68 LEU HDx% 1.0 1.8 5.0 1679 1237 A 68 LEU HDy% A 94 LEU HDx% 1.0 1.8 5.0 1680 1238 A 94 LEU HDy% A 68 LEU HDy% 1.0 1.8 5.0 1681 1239 A 68 LEU HDy% A 95 ILE HG1y 1.0 1.8 5.0 1682 1239 A 68 LEU HDx% A 95 ILE HG1y 1.0 1.8 5.0 1683 1239 A 95 ILE HG1x A 68 LEU HDy% 1.0 1.8 5.0 1684 1239 A 95 ILE HG1x A 68 LEU HDx% 1.0 1.8 5.0 1685 1240 A 95 ILE HD1% A 68 LEU HDy% 1.0 1.8 3.5 1686 1240 A 95 ILE HD1% A 68 LEU HDx% 1.0 1.8 3.5 1687 1241 A 68 LEU HDy% A 85 LEU HG 1.0 1.8 5.0 1688 1241 A 68 LEU HDx% A 85 LEU HG 1.0 1.8 5.0 1689 1242 A 68 LEU HDy% A 85 LEU HDx% 1.0 1.8 5.0 1690 1242 A 68 LEU HDx% A 85 LEU HDx% 1.0 1.8 5.0 1691 1242 A 68 LEU HDy% A 85 LEU HDy% 1.0 1.8 5.0 1692 1242 A 68 LEU HDx% A 85 LEU HDy% 1.0 1.8 5.0 1693 1243 A 69 THR H A 69 THR HA 1.0 1.8 5.0 1694 1244 A 69 THR HB A 69 THR HA 1.0 1.8 5.0 1695 1245 A 69 THR H A 69 THR HB 1.0 1.8 3.5 1696 1246 A 69 THR H A 69 THR HG2% 1.0 1.8 3.5 1697 1247 A 69 THR HG2% A 69 THR HA 1.0 1.8 5.0 1698 1248 A 69 THR HB A 69 THR HG2% 1.0 1.8 3.5 1699 1249 A 68 LEU H A 69 THR H 1.0 1.8 2.9 1700 1250 A 69 THR HA A 70 ASN HBy 1.0 1.8 6.0 1701 1250 A 69 THR HA A 70 ASN HBx 1.0 1.8 6.0 1702 1251 A 70 ASN H A 69 THR HA 1.0 1.8 3.5 1703 1252 A 85 LEU H A 69 THR HA 1.0 1.8 5.0 1704 1253 A 70 ASN H A 69 THR HB 1.0 1.8 5.0 1705 1254 A 69 THR HG2% A 70 ASN HBy 1.0 1.8 5.0 1706 1254 A 69 THR HG2% A 70 ASN HBx 1.0 1.8 5.0 1707 1255 A 70 ASN H A 69 THR HG2% 1.0 1.8 5.0 1708 1256 A 69 THR HG2% A 86 LYS HA 1.0 1.8 5.0 1709 1257 A 70 ASN HD2x A 70 ASN HBy 1.0 1.8 5.0 1710 1258 A 70 ASN HD2y A 70 ASN HBy 1.0 1.8 5.0 1711 1259 A 70 ASN HBx A 70 ASN HD2x 1.0 1.8 5.0 1712 1260 A 70 ASN HBx A 70 ASN HD2y 1.0 1.8 5.0 1713 1261 A 70 ASN HD2x A 70 ASN HD2y 1.0 1.8 2.9 1714 1262 A 70 ASN H A 70 ASN HBx 1.0 1.8 5.0 1715 1263 A 70 ASN H A 70 ASN HBy 1.0 1.8 5.0 1716 1264 A 70 ASN HBx A 70 ASN HA 1.0 1.8 3.5 1717 1265 A 70 ASN HA A 70 ASN HBy 1.0 1.8 3.5 1718 1266 A 69 THR H A 70 ASN H 1.0 1.8 3.5 1719 1267 A 72 ALA H A 70 ASN HBy 1.0 1.8 6.0 1720 1267 A 70 ASN HBx A 72 ALA H 1.0 1.8 6.0 1721 1268 A 70 ASN HBx A 71 HIS HA 1.0 1.8 6.0 1722 1269 A 71 HIS HA A 70 ASN HBy 1.0 1.8 6.0 1723 1270 A 71 HIS HA A 71 HIS HD1 1.0 1.8 5.0 1724 1271 A 71 HIS HD1 A 71 HIS HBx 1.0 1.8 5.0 1725 1272 A 71 HIS HD1 A 71 HIS HBy 1.0 1.8 5.0 1726 1273 A 71 HIS HBx A 71 HIS HD2 1.0 1.8 5.0 1727 1274 A 71 HIS HBy A 71 HIS HD2 1.0 1.8 5.0 1728 1275 A 71 HIS HA A 71 HIS HBx 1.0 1.8 3.5 1729 1276 A 71 HIS HA A 71 HIS HBy 1.0 1.8 3.5 1730 1277 A 71 HIS HBy B 1 HEC HAAy 1.0 1.8 6.0 1731 1277 A 71 HIS HBx B 1 HEC HAAy 1.0 1.8 6.0 1732 1277 A 71 HIS HBy B 1 HEC HAAx 1.0 1.8 6.0 1733 1277 A 71 HIS HBx B 1 HEC HAAx 1.0 1.8 6.0 1734 1278 B 1 HEC HHA A 71 HIS HD2 1.0 1.8 6.0 1735 1279 A 71 HIS HD1 A 80 MET HA 1.0 1.8 6.0 1736 1280 A 67 TYR HD% A 71 HIS HA 1.0 1.8 5.0 1737 1281 A 72 ALA H A 71 HIS H 1.0 1.8 5.0 1738 1282 A 72 ALA H A 71 HIS HBx 1.0 1.8 5.0 1739 1283 A 72 ALA H A 71 HIS HBy 1.0 1.8 5.0 1740 1284 A 72 ALA H A 72 ALA HA 1.0 1.8 5.0 1741 1285 A 72 ALA H A 72 ALA HB% 1.0 1.8 5.0 1742 1286 A 72 ALA HA A 72 ALA HB% 1.0 1.8 5.0 1743 1287 A 70 ASN HD2x A 72 ALA HB% 1.0 1.8 5.0 1744 1287 A 70 ASN HD2y A 72 ALA HB% 1.0 1.8 5.0 1745 1288 A 72 ALA HB% A 73 LYS H 1.0 1.8 3.5 1746 1289 A 78 THR HB A 72 ALA H 1.0 1.8 6.0 1747 1290 A 72 ALA HA A 75 ILE HB 1.0 1.8 5.0 1748 1291 A 72 ALA HB% B 1 HEC HAAy 1.0 1.8 6.3 1749 1292 A 72 ALA HA A 75 ILE H 1.0 1.8 5.0 1750 1293 A 72 ALA HA A 73 LYS H 1.0 1.8 5.0 1751 1294 A 73 LYS H A 74 TYR H 1.0 1.8 5.0 1752 1295 A 74 TYR H A 73 LYS HBx 1.0 1.8 5.0 1753 1295 A 74 TYR H A 73 LYS HBy 1.0 1.8 5.0 1754 1296 A 74 TYR HD% A 74 TYR HBy 1.0 1.8 2.9 1755 1297 A 74 TYR HD% A 74 TYR HBx 1.0 1.8 2.9 1756 1298 A 74 TYR HE% A 74 TYR HD% 1.0 1.8 2.9 1757 1299 A 75 ILE H A 74 TYR HBy 1.0 1.8 5.0 1758 1300 A 75 ILE H A 74 TYR HBx 1.0 1.8 5.0 1759 1301 A 75 ILE H A 74 TYR H 1.0 1.8 5.0 1760 1302 A 75 ILE HB A 75 ILE H 1.0 1.8 5.0 1761 1303 A 75 ILE HG2% A 75 ILE HB 1.0 1.8 2.9 1762 1304 A 75 ILE H A 75 ILE HG1x 1.0 1.8 5.0 1763 1304 A 75 ILE H A 75 ILE HG1y 1.0 1.8 5.0 1764 1305 A 75 ILE HG2% A 75 ILE H 1.0 1.8 5.0 1765 1306 A 75 ILE HG2% A 75 ILE HD1% 1.0 1.8 2.9 1766 1307 A 75 ILE HD1% A 75 ILE H 1.0 1.8 5.0 1767 1308 A 75 ILE HD1% A 75 ILE HB 1.0 1.8 3.5 1768 1309 A 75 ILE HB A 75 ILE HG1x 1.0 1.8 2.9 1769 1309 A 75 ILE HB A 75 ILE HG1y 1.0 1.8 2.9 1770 1310 A 73 LYS H A 75 ILE HG1x 1.0 1.8 5.0 1771 1310 A 73 LYS H A 75 ILE HG1y 1.0 1.8 5.0 1772 1311 A 52 ASN H A 75 ILE HG2% 1.0 1.8 5.0 1773 1312 A 75 ILE HD1% A 52 ASN HD2x 1.0 1.8 6.0 1774 1312 A 75 ILE HD1% A 52 ASN HD2y 1.0 1.8 6.0 1775 1313 A 78 THR H A 75 ILE HB 1.0 1.8 6.0 1776 1314 A 78 THR H A 75 ILE HD1% 1.0 1.8 5.0 1777 1315 A 76 PRO HA A 76 PRO HBx 1.0 1.8 3.5 1778 1315 A 76 PRO HA A 76 PRO HBy 1.0 1.8 3.5 1779 1316 A 76 PRO HA A 76 PRO HGy 1.0 1.8 5.0 1780 1317 A 76 PRO HA A 76 PRO HGx 1.0 1.8 5.0 1781 1318 A 76 PRO HGy A 76 PRO HBx 1.0 1.8 5.0 1782 1318 A 76 PRO HBy A 76 PRO HGy 1.0 1.8 5.0 1783 1319 A 76 PRO HGx A 76 PRO HBx 1.0 1.8 5.0 1784 1319 A 76 PRO HBy A 76 PRO HGx 1.0 1.8 5.0 1785 1320 A 78 THR H A 76 PRO HA 1.0 1.8 6.0 1786 1321 A 78 THR H A 78 THR HB 1.0 1.8 5.0 1787 1322 A 78 THR HA A 78 THR HG2% 1.0 1.8 5.0 1788 1323 A 78 THR HA A 78 THR H 1.0 1.8 5.0 1789 1324 A 78 THR H A 78 THR HG2% 1.0 1.8 5.0 1790 1325 A 78 THR H A 77 GLY H 1.0 1.8 5.0 1791 1326 A 79 LYS H A 78 THR H 1.0 1.8 5.0 1792 1327 A 78 THR HA A 72 ALA HA 1.0 1.8 6.0 1793 1328 A 78 THR HA A 79 LYS HGy 1.0 1.8 5.0 1794 1329 A 78 THR HA A 79 LYS HGx 1.0 1.8 5.0 1795 1330 A 78 THR HA B 1 HEC HADx 1.0 1.8 6.0 1796 1330 A 78 THR HA B 1 HEC HADy 1.0 1.8 6.0 1797 1331 A 78 THR HA A 76 PRO HA 1.0 1.8 6.0 1798 1332 A 79 LYS H A 79 LYS HGx 1.0 1.8 5.0 1799 1333 A 79 LYS H A 79 LYS HGy 1.0 1.8 5.0 1800 1334 A 79 LYS H A 79 LYS HBy 1.0 1.8 5.0 1801 1335 A 79 LYS H A 79 LYS HBx 1.0 1.8 5.0 1802 1336 A 79 LYS HBx A 79 LYS HGy 1.0 1.8 3.5 1803 1337 A 79 LYS HDx A 79 LYS HGy 1.0 1.8 2.9 1804 1337 A 79 LYS HDy A 79 LYS HGy 1.0 1.8 2.9 1805 1338 A 79 LYS HBy A 79 LYS HGy 1.0 1.8 3.5 1806 1339 A 79 LYS H A 79 LYS HEy 1.0 1.8 5.0 1807 1339 A 79 LYS H A 79 LYS HEx 1.0 1.8 5.0 1808 1340 A 79 LYS HBy A 80 MET H 1.0 1.8 5.0 1809 1341 A 79 LYS HBx A 80 MET H 1.0 1.8 5.0 1810 1342 A 80 MET H A 79 LYS HGy 1.0 1.8 5.0 1811 1342 A 80 MET H A 79 LYS HGx 1.0 1.8 5.0 1812 1343 B 1 HEC HMD1 A 79 LYS HDx 1.0 1.8 5.0 1813 1343 B 1 HEC HMD1 A 79 LYS HDy 1.0 1.8 5.0 1814 1344 B 1 HEC HMD1 A 79 LYS HEy 1.0 1.8 5.0 1815 1344 B 1 HEC HMD1 A 79 LYS HEx 1.0 1.8 5.0 1816 1345 B 1 HEC HMD1 A 79 LYS HGy 1.0 1.8 6.0 1817 1346 B 1 HEC HMD1 A 79 LYS HGx 1.0 1.8 6.0 1818 1347 A 80 MET H A 80 MET HBx 1.0 1.8 5.0 1819 1348 A 80 MET H A 80 MET HBy 1.0 1.8 3.5 1820 1349 A 80 MET HA A 80 MET H 1.0 1.8 3.5 1821 1350 A 80 MET HA A 80 MET HBx 1.0 1.8 5.0 1822 1351 A 80 MET HA A 80 MET HBy 1.0 1.8 3.5 1823 1352 A 80 MET HA A 81 ALA H 1.0 1.8 3.5 1824 1353 A 81 ALA H A 81 ALA HA 1.0 1.8 3.5 1825 1354 A 81 ALA H A 81 ALA HB% 1.0 1.8 3.5 1826 1355 A 81 ALA HA A 81 ALA HB% 1.0 1.8 3.5 1827 1356 A 81 ALA HB% A 82 PHE H 1.0 1.8 5.0 1828 1357 B 1 HEC HHD A 81 ALA H 1.0 1.8 6.0 1829 1358 A 82 PHE H A 82 PHE HA 1.0 1.8 3.5 1830 1359 A 82 PHE H A 82 PHE HBy 1.0 1.8 3.5 1831 1360 A 82 PHE H A 82 PHE HBx 1.0 1.8 3.5 1832 1361 A 82 PHE HBy A 82 PHE HD% 1.0 1.8 3.5 1833 1362 A 82 PHE HBx A 82 PHE HD% 1.0 1.8 3.5 1834 1363 A 82 PHE HA A 82 PHE HBy 1.0 1.8 3.5 1835 1364 A 82 PHE HA A 82 PHE HBx 1.0 1.8 3.5 1836 1365 A 82 PHE HZ A 82 PHE HD% 1.0 1.8 5.0 1837 1366 A 82 PHE HE% A 82 PHE HD% 1.0 1.8 3.5 1838 1367 A 82 PHE HE% A 82 PHE HZ 1.0 1.8 5.0 1839 1368 B 1 HEC HMC1 A 82 PHE HA 1.0 1.8 3.5 1840 1369 A 81 ALA H A 82 PHE H 1.0 1.8 3.5 1841 1370 A 82 PHE HD% A 84 GLY HAx 1.0 1.8 5.0 1842 1370 A 82 PHE HD% A 84 GLY HAy 1.0 1.8 5.0 1843 1371 A 82 PHE HD% A 85 LEU HDx% 1.0 1.8 5.0 1844 1372 A 85 LEU HDy% A 82 PHE HD% 1.0 1.8 5.0 1845 1373 A 82 PHE HE% A 85 LEU HDx% 1.0 1.8 5.0 1846 1374 A 82 PHE HE% A 85 LEU HDy% 1.0 1.8 5.0 1847 1375 A 82 PHE HZ A 84 GLY HAx 1.0 1.8 6.0 1848 1375 A 82 PHE HZ A 84 GLY HAy 1.0 1.8 6.0 1849 1376 A 82 PHE HZ B 1 HEC HHC 1.0 1.8 6.0 1850 1377 A 82 PHE HZ A 85 LEU HA 1.0 1.8 5.0 1851 1378 A 82 PHE HZ A 85 LEU HDy% 1.0 1.8 5.0 1852 1379 A 82 PHE HZ A 85 LEU HDx% 1.0 1.8 5.0 1853 1380 A 82 PHE HZ A 85 LEU HG 1.0 1.8 5.0 1854 1381 A 82 PHE HBy A 85 LEU HDx% 1.0 1.8 6.0 1855 1382 A 82 PHE HBx A 85 LEU HDx% 1.0 1.8 6.0 1856 1383 A 85 LEU HDy% A 82 PHE HBy 1.0 1.8 6.0 1857 1384 A 85 LEU HDy% A 82 PHE HBx 1.0 1.8 6.0 1858 1385 A 85 LEU H A 84 GLY HAx 1.0 1.8 5.0 1859 1385 A 85 LEU H A 84 GLY HAy 1.0 1.8 5.0 1860 1386 A 85 LEU H A 85 LEU HA 1.0 1.8 3.5 1861 1387 A 85 LEU HBy A 85 LEU H 1.0 1.8 3.5 1862 1388 A 85 LEU H A 85 LEU HBx 1.0 1.8 3.5 1863 1389 A 85 LEU HBy A 85 LEU HDx% 1.0 1.8 3.5 1864 1390 A 85 LEU HBx A 85 LEU HDx% 1.0 1.8 3.5 1865 1391 A 85 LEU HBy A 85 LEU HDy% 1.0 1.8 3.5 1866 1392 A 85 LEU HDy% A 85 LEU HBx 1.0 1.8 3.5 1867 1393 A 85 LEU H A 85 LEU HDx% 1.0 1.8 3.5 1868 1394 A 85 LEU H A 85 LEU HDy% 1.0 1.8 5.0 1869 1395 A 85 LEU HA A 85 LEU HDx% 1.0 1.8 5.0 1870 1396 A 85 LEU HDy% A 85 LEU HA 1.0 1.8 5.0 1871 1397 A 85 LEU H A 85 LEU HG 1.0 1.8 5.0 1872 1398 A 85 LEU HBy A 85 LEU HA 1.0 1.8 3.5 1873 1399 A 85 LEU HA A 85 LEU HBx 1.0 1.8 3.5 1874 1400 A 85 LEU HG A 85 LEU HA 1.0 1.8 5.0 1875 1401 A 85 LEU HG A 85 LEU HDx% 1.0 1.8 3.5 1876 1402 A 85 LEU HG A 85 LEU HDy% 1.0 1.8 5.0 1877 1403 A 85 LEU HBy A 85 LEU HG 1.0 1.8 3.5 1878 1404 A 85 LEU HG A 85 LEU HBx 1.0 1.8 3.5 1879 1405 A 90 ASP HA A 85 LEU HDx% 1.0 1.8 5.0 1880 1406 A 90 ASP HA A 85 LEU HDy% 1.0 1.8 5.0 1881 1407 A 90 ASP HBy A 85 LEU HDx% 1.0 1.8 3.5 1882 1408 A 90 ASP HBy A 85 LEU HDy% 1.0 1.8 3.5 1883 1409 A 90 ASP HBx A 85 LEU HDx% 1.0 1.8 3.5 1884 1410 A 90 ASP HBx A 85 LEU HDy% 1.0 1.8 3.5 1885 1411 A 90 ASP H A 85 LEU HDx% 1.0 1.8 6.0 1886 1412 A 85 LEU HDy% A 90 ASP H 1.0 1.8 6.0 1887 1413 A 85 LEU HA A 91 ARG H 1.0 1.8 5.0 1888 1414 A 86 LYS HA A 86 LYS H 1.0 1.8 2.9 1889 1415 A 86 LYS H A 86 LYS HBy 1.0 1.8 3.5 1890 1416 A 86 LYS H A 86 LYS HBx 1.0 1.8 3.5 1891 1417 A 87 LYS H A 86 LYS HBx 1.0 1.8 5.0 1892 1417 A 86 LYS HBy A 87 LYS H 1.0 1.8 5.0 1893 1418 A 86 LYS HA A 87 LYS H 1.0 1.8 3.5 1894 1419 A 87 LYS H A 87 LYS HBy 1.0 1.8 5.0 1895 1420 A 87 LYS H A 87 LYS HBx 1.0 1.8 3.5 1896 1421 A 87 LYS H A 87 LYS HGx 1.0 1.8 5.0 1897 1421 A 87 LYS H A 87 LYS HGy 1.0 1.8 5.0 1898 1422 A 87 LYS H A 87 LYS HA 1.0 1.8 5.0 1899 1423 A 90 ASP H A 87 LYS HBx 1.0 1.8 5.0 1900 1423 A 90 ASP H A 87 LYS HBy 1.0 1.8 5.0 1901 1424 A 88 GLU HA A 88 GLU HBy 1.0 1.8 2.9 1902 1425 A 88 GLU HA A 88 GLU HBx 1.0 1.8 2.9 1903 1426 A 88 GLU HA A 88 GLU H 1.0 1.8 2.9 1904 1427 A 88 GLU H A 88 GLU HBx 1.0 1.8 3.5 1905 1427 A 88 GLU H A 88 GLU HBy 1.0 1.8 3.5 1906 1428 A 88 GLU H A 89 LYS H 1.0 1.8 3.5 1907 1429 A 90 ASP H A 88 GLU H 1.0 1.8 5.0 1908 1430 A 88 GLU HA A 89 LYS H 1.0 1.8 3.5 1909 1431 A 90 ASP H A 88 GLU HA 1.0 1.8 5.0 1910 1432 A 91 ARG H A 88 GLU HA 1.0 1.8 5.0 1911 1433 A 88 GLU HA A 91 ARG HBx 1.0 1.8 5.0 1912 1433 A 88 GLU HA A 91 ARG HBy 1.0 1.8 5.0 1913 1434 A 88 GLU HA A 92 ASN H 1.0 1.8 5.0 1914 1435 A 88 GLU HBy A 89 LYS H 1.0 1.8 5.0 1915 1436 A 89 LYS H A 88 GLU HBx 1.0 1.8 5.0 1916 1437 A 89 LYS HA A 89 LYS HBy 1.0 1.8 3.5 1917 1438 A 89 LYS HA A 89 LYS HBx 1.0 1.8 3.5 1918 1439 A 89 LYS H A 89 LYS HA 1.0 1.8 2.9 1919 1440 A 89 LYS H A 89 LYS HBy 1.0 1.8 3.5 1920 1441 A 89 LYS H A 89 LYS HBx 1.0 1.8 3.5 1921 1442 A 89 LYS H A 89 LYS HGx 1.0 1.8 5.0 1922 1442 A 89 LYS H A 89 LYS HGy 1.0 1.8 5.0 1923 1443 A 89 LYS HA A 89 LYS HGx 1.0 1.8 3.5 1924 1443 A 89 LYS HA A 89 LYS HGy 1.0 1.8 3.5 1925 1444 A 90 ASP H A 89 LYS HA 1.0 1.8 3.5 1926 1445 A 91 ARG H A 89 LYS HA 1.0 1.8 5.0 1927 1446 A 92 ASN H A 89 LYS HA 1.0 1.8 5.0 1928 1447 A 89 LYS HA A 92 ASN HBy 1.0 1.8 5.0 1929 1448 A 89 LYS HA A 92 ASN HBx 1.0 1.8 5.0 1930 1449 A 89 LYS HA A 93 ASP H 1.0 1.8 5.0 1931 1450 A 90 ASP H A 89 LYS HBy 1.0 1.8 3.5 1932 1451 A 90 ASP H A 89 LYS HBx 1.0 1.8 3.5 1933 1452 A 90 ASP H A 89 LYS HGx 1.0 1.8 5.0 1934 1452 A 90 ASP H A 89 LYS HGy 1.0 1.8 5.0 1935 1453 A 90 ASP H A 89 LYS H 1.0 1.8 2.9 1936 1454 A 92 ASN HD2x A 89 LYS H 1.0 1.8 5.0 1937 1454 A 92 ASN HD2y A 89 LYS H 1.0 1.8 5.0 1938 1455 A 90 ASP HA A 90 ASP HBy 1.0 1.8 2.9 1939 1456 A 90 ASP HA A 90 ASP H 1.0 1.8 2.9 1940 1457 A 90 ASP HBy A 90 ASP HBx 1.0 1.8 2.9 1941 1458 A 90 ASP HBy A 90 ASP H 1.0 1.8 3.5 1942 1459 A 90 ASP HBx A 90 ASP H 1.0 1.8 3.5 1943 1460 A 90 ASP HA A 91 ARG H 1.0 1.8 5.0 1944 1461 A 90 ASP HA A 92 ASN H 1.0 1.8 5.0 1945 1462 A 90 ASP HA A 93 ASP H 1.0 1.8 5.0 1946 1463 A 90 ASP HA A 93 ASP HBy 1.0 1.8 5.0 1947 1463 A 93 ASP HBx A 90 ASP HA 1.0 1.8 5.0 1948 1464 A 90 ASP HA A 94 LEU H 1.0 1.8 5.0 1949 1465 A 90 ASP HBy A 91 ARG H 1.0 1.8 3.5 1950 1466 A 90 ASP HBx A 91 ARG H 1.0 1.8 3.5 1951 1467 A 90 ASP H A 89 LYS H 1.0 1.8 2.9 1952 1468 A 91 ARG HA A 91 ARG HBx 1.0 1.8 2.9 1953 1468 A 91 ARG HBy A 91 ARG HA 1.0 1.8 2.9 1954 1469 A 91 ARG H A 91 ARG HBx 1.0 1.8 2.9 1955 1469 A 91 ARG H A 91 ARG HBy 1.0 1.8 2.9 1956 1470 A 91 ARG H A 91 ARG HGx 1.0 1.8 5.0 1957 1470 A 91 ARG H A 91 ARG HGy 1.0 1.8 5.0 1958 1471 A 90 ASP H A 91 ARG H 1.0 1.8 3.5 1959 1472 A 91 ARG H A 92 ASN H 1.0 1.8 3.5 1960 1473 A 91 ARG H A 93 ASP H 1.0 1.8 5.0 1961 1474 A 92 ASN H A 91 ARG HA 1.0 1.8 3.5 1962 1475 A 93 ASP H A 91 ARG HA 1.0 1.8 5.0 1963 1476 A 94 LEU H A 91 ARG HA 1.0 1.8 5.0 1964 1477 A 94 LEU HBy A 91 ARG HA 1.0 1.8 5.0 1965 1478 A 91 ARG HA A 94 LEU HBx 1.0 1.8 5.0 1966 1479 A 91 ARG HA A 94 LEU HDx% 1.0 1.8 2.9 1967 1479 A 94 LEU HDy% A 91 ARG HA 1.0 1.8 2.9 1968 1480 A 91 ARG HA A 95 ILE H 1.0 1.8 5.0 1969 1481 A 92 ASN H A 91 ARG HBx 1.0 1.8 5.0 1970 1481 A 91 ARG HBy A 92 ASN H 1.0 1.8 5.0 1971 1482 A 92 ASN H A 91 ARG HGx 1.0 1.8 5.0 1972 1482 A 92 ASN H A 91 ARG HGy 1.0 1.8 5.0 1973 1483 A 92 ASN H A 92 ASN HA 1.0 1.8 2.9 1974 1484 A 92 ASN H A 92 ASN HBy 1.0 1.8 3.5 1975 1485 A 92 ASN H A 92 ASN HBx 1.0 1.8 3.5 1976 1486 A 92 ASN HA A 92 ASN HBy 1.0 1.8 3.5 1977 1487 A 92 ASN HA A 92 ASN HBx 1.0 1.8 3.5 1978 1488 A 92 ASN HD2x A 92 ASN H 1.0 1.8 5.0 1979 1489 A 92 ASN HD2y A 92 ASN H 1.0 1.8 5.0 1980 1490 A 90 ASP H A 92 ASN H 1.0 1.8 5.0 1981 1491 A 92 ASN H A 93 ASP H 1.0 1.8 5.0 1982 1492 A 92 ASN H A 94 LEU H 1.0 1.8 5.0 1983 1493 A 93 ASP H A 92 ASN HA 1.0 1.8 3.5 1984 1494 A 94 LEU H A 92 ASN HA 1.0 1.8 5.0 1985 1495 A 95 ILE H A 92 ASN HA 1.0 1.8 5.0 1986 1496 A 95 ILE HB A 92 ASN HA 1.0 1.8 5.0 1987 1497 A 92 ASN HA A 96 THR H 1.0 1.8 5.0 1988 1498 A 1 GLY H A 92 ASN HBy 1.0 1.8 5.0 1989 1498 A 1 GLY H A 92 ASN HBx 1.0 1.8 5.0 1990 1499 A 93 ASP H A 92 ASN HBy 1.0 1.8 3.5 1991 1500 A 93 ASP H A 92 ASN HBx 1.0 1.8 3.5 1992 1501 A 92 ASN HD2x A 89 LYS H 1.0 1.8 5.0 1993 1501 A 92 ASN HD2y A 89 LYS H 1.0 1.8 5.0 1994 1502 A 93 ASP H A 93 ASP HBy 1.0 1.8 2.9 1995 1502 A 93 ASP HBx A 93 ASP H 1.0 1.8 2.9 1996 1503 A 93 ASP HA A 93 ASP H 1.0 1.8 3.5 1997 1504 A 93 ASP H A 94 LEU H 1.0 1.8 5.0 1998 1505 A 93 ASP H A 95 ILE H 1.0 1.8 5.0 1999 1506 A 2 SER H A 93 ASP HA 1.0 1.8 6.0 2000 1507 A 93 ASP HA A 94 LEU H 1.0 1.8 3.5 2001 1508 A 93 ASP HA A 95 ILE H 1.0 1.8 5.0 2002 1509 A 93 ASP HA A 96 THR H 1.0 1.8 5.0 2003 1510 A 93 ASP HA A 97 TYR H 1.0 1.8 5.0 2004 1511 A 2 SER H A 93 ASP HBy 1.0 1.8 6.0 2005 1511 A 2 SER H A 93 ASP HBx 1.0 1.8 6.0 2006 1512 A 94 LEU H A 93 ASP HBy 1.0 1.8 3.5 2007 1512 A 93 ASP HBx A 94 LEU H 1.0 1.8 3.5 2008 1513 A 94 LEU HA A 94 LEU H 1.0 1.8 2.9 2009 1514 A 94 LEU H A 94 LEU HBx 1.0 1.8 3.5 2010 1514 A 94 LEU HBy A 94 LEU H 1.0 1.8 3.5 2011 1515 A 94 LEU HBy A 94 LEU HDx% 1.0 1.8 3.5 2012 1515 A 94 LEU HBx A 94 LEU HDx% 1.0 1.8 3.5 2013 1516 A 94 LEU HDy% A 94 LEU HBy 1.0 1.8 3.5 2014 1516 A 94 LEU HDy% A 94 LEU HBx 1.0 1.8 3.5 2015 1517 A 94 LEU H A 94 LEU HDx% 1.0 1.8 5.0 2016 1518 A 94 LEU HDy% A 94 LEU H 1.0 1.8 5.0 2017 1519 A 94 LEU HA A 94 LEU HDx% 1.0 1.8 5.0 2018 1520 A 94 LEU HA A 94 LEU HDy% 1.0 1.8 5.0 2019 1521 A 94 LEU HG A 94 LEU HDx% 1.0 1.8 2.9 2020 1522 A 94 LEU HDy% A 94 LEU HG 1.0 1.8 2.9 2021 1523 A 94 LEU H A 94 LEU HG 1.0 1.8 5.0 2022 1524 A 94 LEU H A 95 ILE H 1.0 1.8 5.0 2023 1525 A 94 LEU H A 96 THR H 1.0 1.8 5.0 2024 1526 A 94 LEU HDx% A 95 ILE HG1y 1.0 1.8 5.0 2025 1527 A 94 LEU HDy% A 95 ILE HG1y 1.0 1.8 5.0 2026 1528 A 95 ILE HG1x A 94 LEU HDx% 1.0 1.8 5.0 2027 1529 A 94 LEU HDy% A 95 ILE HG1x 1.0 1.8 5.0 2028 1530 A 94 LEU HA A 95 ILE H 1.0 1.8 3.5 2029 1531 A 94 LEU HA A 96 THR H 1.0 1.8 5.0 2030 1532 A 94 LEU HA A 97 TYR H 1.0 1.8 5.0 2031 1533 A 94 LEU HA A 97 TYR HBx 1.0 1.8 5.0 2032 1533 A 94 LEU HA A 97 TYR HBy 1.0 1.8 5.0 2033 1534 A 94 LEU HA A 98 LEU H 1.0 1.8 5.0 2034 1535 A 94 LEU HA A 98 LEU HG 1.0 1.8 5.0 2035 1536 A 94 LEU HBy A 95 ILE H 1.0 1.8 3.5 2036 1537 A 95 ILE H A 94 LEU HBx 1.0 1.8 3.5 2037 1538 A 94 LEU HG A 98 LEU HDx% 1.0 1.8 5.0 2038 1538 A 98 LEU HDy% A 94 LEU HG 1.0 1.8 5.0 2039 1539 A 94 LEU HG A 98 LEU HG 1.0 1.8 5.0 2040 1540 A 95 ILE H A 94 LEU HDx% 1.0 1.8 5.0 2041 1540 A 94 LEU HDy% A 95 ILE H 1.0 1.8 5.0 2042 1541 B 1 HEC HMB1 A 94 LEU HDx% 1.0 1.8 5.0 2043 1541 A 94 LEU HDy% B 1 HEC HMB1 1.0 1.8 5.0 2044 1542 A 98 LEU H A 94 LEU HDx% 1.0 1.8 5.0 2045 1542 A 94 LEU HDy% A 98 LEU H 1.0 1.8 5.0 2046 1543 A 94 LEU HDy% B 1 HEC HAB 1.0 1.8 5.0 2047 1544 B 1 HEC HAB A 94 LEU HDx% 1.0 1.8 5.0 2048 1545 A 98 LEU HBy A 94 LEU HDx% 1.0 1.8 5.0 2049 1545 A 94 LEU HDx% A 98 LEU HBx 1.0 1.8 5.0 2050 1545 A 94 LEU HDy% A 98 LEU HBx 1.0 1.8 5.0 2051 1545 A 94 LEU HDy% A 98 LEU HBy 1.0 1.8 5.0 2052 1546 A 94 LEU HA A 9 LEU HDx% 1.0 1.8 5.0 2053 1546 A 94 LEU HA A 9 LEU HDy% 1.0 1.8 5.0 2054 1547 A 95 ILE HD1% A 95 ILE HA 1.0 1.8 5.0 2055 1548 A 95 ILE HG2% A 95 ILE HA 1.0 1.8 2.9 2056 1549 A 95 ILE H A 95 ILE HA 1.0 1.8 2.9 2057 1550 A 95 ILE HB A 95 ILE HG1y 1.0 1.8 2.9 2058 1550 A 95 ILE HB A 95 ILE HG1x 1.0 1.8 2.9 2059 1551 A 95 ILE HB A 95 ILE HG2% 1.0 1.8 2.9 2060 1552 A 95 ILE HB A 95 ILE H 1.0 1.8 2.9 2061 1553 A 95 ILE HG2% A 95 ILE HD1% 1.0 1.8 2.9 2062 1554 A 95 ILE HG2% A 95 ILE H 1.0 1.8 3.5 2063 1555 A 95 ILE H A 95 ILE HG1y 1.0 1.8 5.0 2064 1556 A 95 ILE HG1x A 95 ILE H 1.0 1.8 5.0 2065 1557 A 95 ILE HD1% A 95 ILE HG1y 1.0 1.8 2.9 2066 1558 A 95 ILE HD1% A 95 ILE HG1x 1.0 1.8 2.9 2067 1559 A 95 ILE HG2% A 95 ILE HG1y 1.0 1.8 2.9 2068 1559 A 95 ILE HG2% A 95 ILE HG1x 1.0 1.8 2.9 2069 1560 A 95 ILE HD1% A 95 ILE H 1.0 1.8 3.5 2070 1561 A 95 ILE H A 96 THR H 1.0 1.8 3.5 2071 1562 A 97 TYR H A 95 ILE H 1.0 1.8 5.0 2072 1563 A 96 THR H A 95 ILE HA 1.0 1.8 3.5 2073 1564 A 97 TYR H A 95 ILE HA 1.0 1.8 5.0 2074 1565 A 98 LEU H A 95 ILE HA 1.0 1.8 5.0 2075 1566 A 95 ILE HA A 98 LEU HBx 1.0 1.8 5.0 2076 1566 A 98 LEU HBy A 95 ILE HA 1.0 1.8 5.0 2077 1567 A 99 LYS H A 95 ILE HA 1.0 1.8 5.0 2078 1568 A 95 ILE HG2% A 98 LEU H 1.0 1.8 5.0 2079 1569 A 95 ILE HB A 96 THR H 1.0 1.8 3.5 2080 1570 A -3 PHE HZ A 95 ILE HB 1.0 1.8 5.0 2081 1571 A -3 PHE HZ A 95 ILE HG2% 1.0 1.8 5.0 2082 1572 A 95 ILE HG2% A 61 GLU H 1.0 1.8 6.0 2083 1573 A 95 ILE HG2% A 65 SER H 1.0 1.8 6.0 2084 1574 A 94 LEU H A 95 ILE HG1y 1.0 1.8 5.0 2085 1574 A 95 ILE HG1x A 94 LEU H 1.0 1.8 5.0 2086 1575 A 99 LYS H A 95 ILE HG1y 1.0 1.8 5.0 2087 1575 A 99 LYS H A 95 ILE HG1x 1.0 1.8 5.0 2088 1576 A 95 ILE HG1x A 98 LEU HDx% 1.0 1.8 3.5 2089 1576 A 95 ILE HG1y A 98 LEU HDx% 1.0 1.8 3.5 2090 1577 A 98 LEU HDy% A 95 ILE HG1y 1.0 1.8 5.0 2091 1577 A 98 LEU HDy% A 95 ILE HG1x 1.0 1.8 5.0 2092 1578 A 95 ILE HG2% A 94 LEU H 1.0 1.8 6.0 2093 1579 A 95 ILE HG2% A 99 LYS H 1.0 1.8 5.0 2094 1580 A 95 ILE HG2% A 99 LYS HA 1.0 1.8 5.0 2095 1581 A 96 THR HA A 96 THR H 1.0 1.8 3.5 2096 1582 A 96 THR HG2% A 96 THR HA 1.0 1.8 2.9 2097 1583 A 96 THR H A 96 THR HB 1.0 1.8 3.5 2098 1584 A 96 THR HG2% A 96 THR H 1.0 1.8 3.5 2099 1585 A 96 THR HA A 96 THR HB 1.0 1.8 5.0 2100 1586 A 97 TYR H A 96 THR H 1.0 1.8 3.5 2101 1587 A 98 LEU H A 96 THR H 1.0 1.8 5.0 2102 1588 A -3 PHE HZ A 96 THR HA 1.0 1.8 5.0 2103 1589 A 96 THR HA A 97 TYR H 1.0 1.8 3.5 2104 1590 A 96 THR HA A 98 LEU H 1.0 1.8 5.0 2105 1591 A 96 THR HA A 99 LYS H 1.0 1.8 5.0 2106 1592 A 96 THR HA A 100 LYS H 1.0 1.8 5.0 2107 1593 A 96 THR HA A 99 LYS HBy 1.0 1.8 5.0 2108 1593 A 96 THR HA A 99 LYS HBx 1.0 1.8 5.0 2109 1594 A 96 THR HA A 99 LYS HDx 1.0 1.8 5.0 2110 1594 A 96 THR HA A 99 LYS HDy 1.0 1.8 5.0 2111 1595 A 97 TYR H A 96 THR HB 1.0 1.8 3.5 2112 1596 A 96 THR HG2% A 1 GLY H 1.0 1.8 6.0 2113 1597 A -3 PHE HZ A 96 THR HG2% 1.0 1.8 5.0 2114 1598 A 97 TYR H A 97 TYR HBy 1.0 1.8 3.5 2115 1599 A 97 TYR H A 97 TYR HBx 1.0 1.8 3.5 2116 1600 A 97 TYR HBy A 97 TYR HA 1.0 1.8 3.5 2117 1601 A 97 TYR HA A 97 TYR HBx 1.0 1.8 3.5 2118 1602 A 97 TYR H A 97 TYR HA 1.0 1.8 2.9 2119 1603 A 7 ALA H A 97 TYR HBy 1.0 1.8 5.0 2120 1604 A 7 ALA H A 97 TYR HBx 1.0 1.8 5.0 2121 1605 A 98 LEU H A 97 TYR HBy 1.0 1.8 5.0 2122 1606 A 98 LEU H A 97 TYR HBx 1.0 1.8 5.0 2123 1607 A 97 TYR H A 98 LEU H 1.0 1.8 3.5 2124 1608 A 97 TYR H A 98 LEU HDx% 1.0 1.8 5.0 2125 1609 A 97 TYR H A 98 LEU HDy% 1.0 1.8 5.0 2126 1610 A 97 TYR H A 99 LYS H 1.0 1.8 5.0 2127 1611 A 98 LEU H A 97 TYR HA 1.0 1.8 3.5 2128 1612 A 99 LYS H A 97 TYR HA 1.0 1.8 5.0 2129 1613 A 100 LYS H A 97 TYR HA 1.0 1.8 5.0 2130 1614 A 97 TYR HA A 100 LYS HBx 1.0 1.8 5.0 2131 1615 A 97 TYR HA A 100 LYS HBy 1.0 1.8 5.0 2132 1616 A 97 TYR HA A 101 ALA H 1.0 1.8 5.0 2133 1617 A 98 LEU HA A 98 LEU HDx% 1.0 1.8 5.0 2134 1618 A 98 LEU HDy% A 98 LEU HA 1.0 1.8 5.0 2135 1619 A 98 LEU H A 98 LEU HA 1.0 1.8 2.9 2136 1620 A 98 LEU H A 98 LEU HDx% 1.0 1.8 5.0 2137 1621 A 98 LEU HDy% A 98 LEU H 1.0 1.8 5.0 2138 1622 A 98 LEU HBy A 98 LEU HDx% 1.0 1.8 5.0 2139 1622 A 98 LEU HBx A 98 LEU HDx% 1.0 1.8 5.0 2140 1623 A 98 LEU HDy% A 98 LEU HBy 1.0 1.8 5.0 2141 1623 A 98 LEU HDy% A 98 LEU HBx 1.0 1.8 5.0 2142 1624 A 98 LEU H A 98 LEU HG 1.0 1.8 5.0 2143 1625 A 98 LEU H A 100 LYS H 1.0 1.8 5.0 2144 1626 A 99 LYS H A 98 LEU HA 1.0 1.8 3.5 2145 1627 A 100 LYS H A 98 LEU HA 1.0 1.8 5.0 2146 1628 A 101 ALA H A 98 LEU HA 1.0 1.8 5.0 2147 1629 A 98 LEU HA A 102 THR H 1.0 1.8 5.0 2148 1630 A 101 ALA HB% A 98 LEU HA 1.0 1.8 5.0 2149 1631 A 99 LYS H A 98 LEU HBx 1.0 1.8 3.5 2150 1631 A 99 LYS H A 98 LEU HBy 1.0 1.8 3.5 2151 1632 A 97 TYR HE% A 98 LEU HG 1.0 1.8 5.0 2152 1633 A 36 PHE HD% A 98 LEU HDx% 1.0 1.8 5.0 2153 1634 A 98 LEU HDy% A 36 PHE HD% 1.0 1.8 5.0 2154 1635 A 99 LYS H A 98 LEU HDx% 1.0 1.8 5.0 2155 1636 A 98 LEU HDy% A 99 LYS H 1.0 1.8 5.0 2156 1637 A 102 THR H A 98 LEU HDx% 1.0 1.8 5.0 2157 1637 A 98 LEU HDy% A 102 THR H 1.0 1.8 5.0 2158 1638 B 1 HEC HMB1 A 98 LEU HDx% 1.0 1.8 5.0 2159 1639 A 98 LEU HDy% B 1 HEC HMB1 1.0 1.8 5.0 2160 1640 A 99 LYS HA A 99 LYS HBx 1.0 1.8 2.9 2161 1641 A 99 LYS HA A 99 LYS HBy 1.0 1.8 2.9 2162 1642 A 99 LYS HA A 99 LYS HDx 1.0 1.8 5.0 2163 1642 A 99 LYS HA A 99 LYS HDy 1.0 1.8 5.0 2164 1643 A 99 LYS HA A 99 LYS HGx 1.0 1.8 3.5 2165 1643 A 99 LYS HA A 99 LYS HGy 1.0 1.8 3.5 2166 1644 A 99 LYS HA A 99 LYS H 1.0 1.8 2.9 2167 1645 A 99 LYS H A 99 LYS HBx 1.0 1.8 3.5 2168 1646 A 99 LYS H A 99 LYS HBy 1.0 1.8 3.5 2169 1647 A 99 LYS H A 99 LYS HDx 1.0 1.8 5.0 2170 1647 A 99 LYS H A 99 LYS HDy 1.0 1.8 5.0 2171 1648 A 99 LYS H A 99 LYS HGx 1.0 1.8 5.0 2172 1648 A 99 LYS HGy A 99 LYS H 1.0 1.8 5.0 2173 1649 A 98 LEU H A 99 LYS H 1.0 1.8 3.5 2174 1650 A 99 LYS H A 100 LYS H 1.0 1.8 3.5 2175 1651 A 99 LYS H A 101 ALA H 1.0 1.8 5.0 2176 1652 A 36 PHE HE% A 99 LYS HBx 1.0 1.8 5.0 2177 1653 A 36 PHE HE% A 99 LYS HBy 1.0 1.8 5.0 2178 1654 A 99 LYS HBx A 100 LYS H 1.0 1.8 5.0 2179 1655 A 100 LYS H A 99 LYS HBy 1.0 1.8 5.0 2180 1656 A 99 LYS HA A 100 LYS H 1.0 1.8 3.5 2181 1657 A 99 LYS HA A 102 THR H 1.0 1.8 5.0 2182 1658 A 99 LYS HA A 102 THR HB 1.0 1.8 5.0 2183 1659 A 100 LYS HA A 100 LYS HBy 1.0 1.8 3.5 2184 1659 A 100 LYS HA A 100 LYS HBx 1.0 1.8 3.5 2185 1660 A 100 LYS H A 100 LYS HA 1.0 1.8 2.9 2186 1661 A 100 LYS H A 100 LYS HBx 1.0 1.8 2.9 2187 1662 A 100 LYS H A 100 LYS HBy 1.0 1.8 2.9 2188 1663 A 100 LYS H A 102 THR H 1.0 1.8 5.0 2189 1664 A 101 ALA H A 100 LYS HA 1.0 1.8 3.5 2190 1665 A 100 LYS HA A 103 GLU H 1.0 1.8 5.0 2191 1666 A 100 LYS HA A 103 GLU HBx 1.0 1.8 5.0 2192 1666 A 100 LYS HA A 103 GLU HBy 1.0 1.8 5.0 2193 1667 A 101 ALA H A 100 LYS HBx 1.0 1.8 3.5 2194 1668 A 101 ALA H A 100 LYS HBy 1.0 1.8 3.5 2195 1669 A 101 ALA H A 101 ALA HA 1.0 1.8 2.9 2196 1670 A 101 ALA HB% A 101 ALA H 1.0 1.8 3.5 2197 1671 A 100 LYS H A 101 ALA H 1.0 1.8 2.9 2198 1672 A 101 ALA H A 102 THR H 1.0 1.8 2.9 2199 1673 A 101 ALA H A 103 GLU H 1.0 1.8 3.5 2200 1674 A 103 GLU H A 101 ALA HA 1.0 1.8 5.0 2201 1675 A 101 ALA HB% A 102 THR H 1.0 1.8 3.5 2202 1676 A 102 THR H A 102 THR HA 1.0 1.8 3.5 2203 1677 A 102 THR HB A 103 GLU H 1.0 1.8 2.9 2204 1678 A 102 THR H A 103 GLU H 1.0 1.8 2.9 2205 1679 A 103 GLU H A 102 THR HA 1.0 1.8 5.0 2206 1680 A 103 GLU H A 103 GLU HA 1.0 1.8 2.9 2207 1681 A 103 GLU H A 103 GLU HBy 1.0 1.8 2.9 2208 1682 A 103 GLU H A 103 GLU HBx 1.0 1.8 2.9 2209 1683 B 1 HEC HHA B 1 HEC HAAx 1.0 1.8 3.5 2210 1683 B 1 HEC HHA B 1 HEC HAAy 1.0 1.8 3.5 2211 1684 B 1 HEC HAAx B 1 HEC HBAx 1.0 1.8 2.9 2212 1684 B 1 HEC HAAy B 1 HEC HBAx 1.0 1.8 2.9 2213 1684 B 1 HEC HBAy B 1 HEC HAAx 1.0 1.8 2.9 2214 1684 B 1 HEC HBAy B 1 HEC HAAy 1.0 1.8 2.9 2215 1685 B 1 HEC HHA B 1 HEC HAAx 1.0 1.8 2.9 2216 1685 B 1 HEC HHA B 1 HEC HAAy 1.0 1.8 2.9 2217 1686 B 1 HEC HMA1 B 1 HEC HAAx 1.0 1.8 5.0 2218 1686 B 1 HEC HMA1 B 1 HEC HAAy 1.0 1.8 5.0 2219 1687 B 1 HEC HAB B 1 HEC HMB1 1.0 1.8 3.5 2220 1688 B 1 HEC HMD1 B 1 HEC HADx 1.0 1.8 3.5 2221 1689 B 1 HEC HMD1 B 1 HEC HADy 1.0 1.8 3.5 2222 1690 B 1 HEC HMA1 B 1 HEC HBAx 1.0 1.8 5.0 2223 1690 B 1 HEC HBAy B 1 HEC HMA1 1.0 1.8 5.0 2224 1691 B 1 HEC HBB1 B 1 HEC HMB1 1.0 1.8 2.9 2225 1692 B 1 HEC HBB1 B 1 HEC HMB1 1.0 1.8 3.5 2226 1693 B 1 HEC HMC1 B 1 HEC HBC1 1.0 1.8 3.5 2227 1694 B 1 HEC HBDy B 1 HEC HADx 1.0 1.8 5.0 2228 1694 B 1 HEC HADx B 1 HEC HBDx 1.0 1.8 5.0 2229 1695 B 1 HEC HBDy B 1 HEC HADy 1.0 1.8 5.0 2230 1695 B 1 HEC HADy B 1 HEC HBDx 1.0 1.8 5.0 2231 1696 B 1 HEC HMD1 B 1 HEC HBDx 1.0 1.8 3.5 2232 1697 B 1 HEC HMD1 B 1 HEC HBDy 1.0 1.8 3.5 2233 1698 B 1 HEC HHA B 1 HEC HAAx 1.0 1.8 3.5 2234 1699 B 1 HEC HMA1 B 1 HEC HHB 1.0 1.8 3.5 2235 1700 B 1 HEC HMB1 B 1 HEC HHB 1.0 1.8 3.5 2236 1701 B 1 HEC HHC B 1 HEC HMC1 1.0 1.8 5.0 2237 1702 B 1 HEC HAB B 1 HEC HHC 1.0 1.8 5.0 2238 1703 B 1 HEC HHD B 1 HEC HAC 1.0 1.8 5.0 2239 1704 B 1 HEC HHD B 1 HEC HBC1 1.0 1.8 5.0 2240 1705 B 1 HEC HMD1 B 1 HEC HHD 1.0 1.8 3.5 2241 1706 B 1 HEC HMA1 B 1 HEC HAAx 1.0 1.8 3.5 2242 1707 B 1 HEC HMA1 B 1 HEC HAAy 1.0 1.8 3.5 2243 1708 B 1 HEC HMA1 B 1 HEC HBAx 1.0 1.8 5.0 2244 1709 B 1 HEC HBAy B 1 HEC HMA1 1.0 1.8 5.0 2245 1710 B 1 HEC HMA1 B 1 HEC HHB 1.0 1.8 3.5 2246 1711 B 1 HEC HMB1 B 1 HEC HHB 1.0 1.8 2.9 2247 1712 B 1 HEC HBB1 B 1 HEC HMB1 1.0 1.8 2.9 2248 1713 B 1 HEC HMC1 B 1 HEC HBC1 1.0 1.8 3.5 2249 1714 B 1 HEC HHC B 1 HEC HMC1 1.0 1.8 2.9 2250 1715 B 1 HEC HMD1 B 1 HEC HADx 1.0 1.8 3.5 2251 1716 B 1 HEC HMD1 B 1 HEC HADy 1.0 1.8 3.5 2252 1717 B 1 HEC HMD1 B 1 HEC HHD 1.0 1.8 2.9 2253 1718 A 13 ARG HBy B 1 HEC HAB 1.0 1.8 5.0 2254 1719 B 1 HEC HAB A 13 ARG HBx 1.0 1.8 5.0 2255 1720 B 1 HEC HAB A 14 CYS HBy 1.0 1.8 5.0 2256 1720 A 14 CYS HBx B 1 HEC HAB 1.0 1.8 5.0 2257 1721 A 18 HIS HD2 B 1 HEC HAC 1.0 1.8 6.0 2258 1722 A 28 VAL HGx% B 1 HEC HAC 1.0 1.8 5.0 2259 1722 B 1 HEC HAC A 28 VAL HGy% 1.0 1.8 5.0 2260 1723 A 30 PRO HDy B 1 HEC HADx 1.0 1.8 5.0 2261 1723 A 30 PRO HDx B 1 HEC HADx 1.0 1.8 5.0 2262 1723 B 1 HEC HADy A 30 PRO HDx 1.0 1.8 5.0 2263 1723 A 30 PRO HDy B 1 HEC HADy 1.0 1.8 5.0 2264 1724 A 46 TYR HDx B 1 HEC HADy 1.0 1.8 6.0 2265 1724 A 46 TYR HDx B 1 HEC HADx 1.0 1.8 6.0 2266 1724 A 46 TYR HDy B 1 HEC HADy 1.0 1.8 6.0 2267 1724 A 46 TYR HDy B 1 HEC HADx 1.0 1.8 6.0 2268 1725 A 79 LYS HEy B 1 HEC HADx 1.0 1.8 5.0 2269 1725 A 79 LYS HEx B 1 HEC HADx 1.0 1.8 5.0 2270 1725 B 1 HEC HADy A 79 LYS HEy 1.0 1.8 5.0 2271 1725 A 79 LYS HEx B 1 HEC HADy 1.0 1.8 5.0 2272 1726 A 79 LYS HGy B 1 HEC HADx 1.0 1.8 5.0 2273 1726 A 79 LYS HGx B 1 HEC HADx 1.0 1.8 5.0 2274 1726 B 1 HEC HADy A 79 LYS HGy 1.0 1.8 5.0 2275 1726 A 79 LYS HGx B 1 HEC HADy 1.0 1.8 5.0 2276 1727 B 1 HEC HMA1 A 32 LEU HDx% 1.0 1.8 2.9 2277 1727 A 32 LEU HDy% B 1 HEC HMA1 1.0 1.8 2.9 2278 1728 B 1 HEC HMA1 A 59 TRP HE3 1.0 1.8 6.0 2279 1729 B 1 HEC HMA1 A 64 MET HE% 1.0 1.8 3.5 2280 1730 B 1 HEC HMB1 A 14 CYS HBy 1.0 1.8 5.0 2281 1730 A 14 CYS HBx B 1 HEC HMB1 1.0 1.8 5.0 2282 1731 B 1 HEC HMC1 A 82 PHE HA 1.0 1.8 6.0 2283 1732 A 35 ILE HG1x B 1 HEC HAAx 1.0 1.8 6.0 2284 1732 B 1 HEC HAAy A 35 ILE HG1y 1.0 1.8 6.0 2285 1732 A 35 ILE HG1x B 1 HEC HAAy 1.0 1.8 6.0 2286 1732 A 35 ILE HG1y B 1 HEC HAAx 1.0 1.8 6.0 2287 1733 A 52 ASN HD2x B 1 HEC HAAx 1.0 1.8 5.0 2288 1733 A 52 ASN HD2x B 1 HEC HAAy 1.0 1.8 5.0 2289 1734 A 52 ASN HD2y B 1 HEC HAAx 1.0 1.8 5.0 2290 1734 A 52 ASN HD2y B 1 HEC HAAy 1.0 1.8 5.0 2291 1735 A 59 TRP HE1 B 1 HEC HAAx 1.0 1.8 5.0 2292 1735 A 59 TRP HE1 B 1 HEC HAAy 1.0 1.8 5.0 2293 1736 A 59 TRP HZ2 B 1 HEC HAAx 1.0 1.8 5.0 2294 1737 A 59 TRP HZ2 B 1 HEC HAAy 1.0 1.8 5.0 2295 1738 A 35 ILE HG1y B 1 HEC HBAx 1.0 1.8 5.0 2296 1738 A 35 ILE HG1x B 1 HEC HBAx 1.0 1.8 5.0 2297 1738 B 1 HEC HBAy A 35 ILE HG1y 1.0 1.8 5.0 2298 1738 B 1 HEC HBAy A 35 ILE HG1x 1.0 1.8 5.0 2299 1739 B 1 HEC HBB1 A 68 LEU HDx% 1.0 1.8 6.0 2300 1740 B 1 HEC HBB1 A 68 LEU HDy% 1.0 1.8 6.0 2301 1741 A 82 PHE HZ B 1 HEC HBB1 1.0 1.8 5.0 2302 1742 B 1 HEC HBB1 A 85 LEU HG 1.0 1.8 5.0 2303 1743 B 1 HEC HBB1 A 94 LEU HDx% 1.0 1.8 5.0 2304 1743 A 94 LEU HDy% B 1 HEC HBB1 1.0 1.8 5.0 2305 1744 A 28 VAL HGx% B 1 HEC HBC1 1.0 1.8 5.0 2306 1744 B 1 HEC HBC1 A 28 VAL HGy% 1.0 1.8 5.0 2307 1745 A 80 MET H B 1 HEC HBDx 1.0 1.8 6.0 2308 1745 A 80 MET H B 1 HEC HBDy 1.0 1.8 6.0 2309 1746 A 71 HIS HD2 B 1 HEC HHB 1.0 1.8 6.0 2310 1746 A 71 HIS HD1 B 1 HEC HHB 1.0 1.8 6.0 stop_ save_