data_nef_c25439_2my1 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2MY1 BMRB 25440 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 1 122 CYS SG 2 3 ZN ZN 1 150 CYS SG 2 1 ZN ZN 1 106 CYS SG 2 1 ZN ZN 1 155 CYS SG 2 2 ZN ZN 1 124 CYS SG 2 3 ZN ZN 1 110 CYS SG 2 1 ZN ZN 1 110 CYS SG 2 3 ZN ZN 1 152 CYS SG 2 2 ZN ZN 1 107 CYS SG 2 1 ZN ZN 1 147 CYS SG 2 3 ZN ZN 1 106 CYS SG 2 2 ZN ZN 1 124 CYS SG 2 2 ZN ZN 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 -1 GLY start . false 2 A 0 GLY middle . false 3 A 1 SER middle . . 4 A 2 PRO middle . false 5 A 3 ARG middle . . 6 A 4 ILE middle . . 7 A 5 LYS middle . . 8 A 6 THR middle . . 9 A 7 ARG middle . . 10 A 8 ARG middle . . 11 A 9 SER middle . . 12 A 10 LYS middle . . 13 A 11 PRO middle . false 14 A 12 ALA middle . . 15 A 13 PRO middle . false 16 A 14 ASP middle . . 17 A 15 GLY middle . false 18 A 16 PHE middle . . 19 A 17 GLU middle . . 20 A 18 LYS middle . . 21 A 19 ILE middle . . 22 A 20 LYS middle . . 23 A 21 PRO middle . false 24 A 22 THR middle . . 25 A 23 LEU middle . . 26 A 24 THR middle . . 27 A 25 ASP middle . . 28 A 26 PHE middle . . 29 A 27 GLU middle . . 30 A 28 ILE middle . . 31 A 29 GLN middle . . 32 A 30 LEU middle . . 33 A 31 ARG middle . . 34 A 32 ASP middle . . 35 A 33 ALA middle . . 36 A 34 GLN middle . . 37 A 35 LYS middle . . 38 A 36 ASP middle . . 39 A 37 LYS middle . . 40 A 38 SER middle . . 41 A 39 SER middle . . 42 A 40 LYS middle . . 43 A 41 LEU middle . . 44 A 42 ALA middle . . 45 A 43 ALA middle . . 46 A 44 LYS middle . . 47 A 45 SER middle . . 48 A 46 ASN middle . . 49 A 47 GLU middle . . 50 A 48 GLN middle . . 51 A 49 LEU middle . . 52 A 50 TRP middle . . 53 A 51 GLU middle . . 54 A 52 ILE middle . . 55 A 53 MET middle . . 56 A 54 GLN middle . . 57 A 55 LEU middle . . 58 A 56 HIS middle . . 59 A 57 HIS middle . . 60 A 58 GLN middle . . 61 A 59 ARG middle . . 62 A 60 SER middle . . 63 A 61 ARG middle . . 64 A 62 TYR middle . . 65 A 63 ILE middle . . 66 A 64 TYR middle . . 67 A 65 THR middle . . 68 A 66 LEU middle . . 69 A 67 TYR middle . . 70 A 68 TYR middle . . 71 A 69 LYS middle . . 72 A 70 ARG middle . . 73 A 71 LYS middle . . 74 A 72 ALA middle . . 75 A 73 ILE middle . . 76 A 74 SER middle . . 77 A 75 LYS middle . . 78 A 76 ASP middle . . 79 A 77 LEU middle . . 80 A 78 TYR middle . . 81 A 79 ASP middle . . 82 A 80 TRP middle . . 83 A 81 LEU middle . . 84 A 82 ILE middle . . 85 A 83 LYS middle . . 86 A 84 GLU middle . . 87 A 85 LYS middle . . 88 A 86 TYR middle . . 89 A 87 ALA middle . . 90 A 88 ASP middle . . 91 A 89 LYS middle . . 92 A 90 LEU middle . . 93 A 91 LEU middle . . 94 A 92 ILE middle . . 95 A 93 ALA middle . . 96 A 94 LYS middle . . 97 A 95 TRP middle . . 98 A 96 ARG middle . . 99 A 97 LYS middle . . 100 A 98 THR middle . . 101 A 99 GLY middle . false 102 A 100 TYR middle . . 103 A 101 GLU middle . . 104 A 102 LYS middle . . 105 A 103 LEU middle . . 106 A 104 CYS middle -HG . 107 A 105 CYS middle -HG . 108 A 106 LEU middle . . 109 A 107 ARG middle . . 110 A 108 CYS middle -HG . 111 A 109 ILE middle . . 112 A 110 GLN middle . . 113 A 111 LYS middle . . 114 A 112 ASN middle . . 115 A 113 GLU middle . . 116 A 114 THR middle . . 117 A 115 ASN middle . . 118 A 116 ASN middle . . 119 A 117 GLY middle . false 120 A 118 SER middle . . 121 A 119 THR middle . . 122 A 120 CYS middle -HG . 123 A 121 ILE middle . . 124 A 122 CYS middle -HG . 125 A 123 ARG middle . . 126 A 124 VAL middle . . 127 A 125 PRO middle . false 128 A 126 ARG middle . . 129 A 127 ALA middle . . 130 A 128 GLN middle . . 131 A 129 LEU middle . . 132 A 130 GLU middle . . 133 A 131 GLU middle . . 134 A 132 GLU middle . . 135 A 133 ALA middle . . 136 A 134 ARG middle . . 137 A 135 LYS middle . . 138 A 136 LYS middle . . 139 A 137 GLY middle . false 140 A 138 THR middle . . 141 A 139 GLN middle . . 142 A 140 VAL middle . . 143 A 141 SER middle . . 144 A 142 PHE middle . . 145 A 143 HIS middle . . 146 A 144 GLN middle . . 147 A 145 CYS middle -HG . 148 A 146 VAL middle . . 149 A 147 HIS middle . . 150 A 148 CYS middle -HG . 151 A 149 GLY middle . false 152 A 150 CYS middle -HG . 153 A 151 ARG middle . . 154 A 152 GLY middle . false 155 A 153 CYS middle -HG . 156 A 154 ALA middle . . 157 A 155 SER middle . . 158 A 156 THR middle . . 159 A 157 ASP end . . 160 B 1 ZN . . . 161 B 2 ZN . . . 162 B 3 ZN . . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A -1 GLY HA2 H 1 4.065 0.020 A -1 GLY HA3 H 1 4.065 0.020 A -1 GLY CA C 13 44.963 0.100 A 0 GLY HA2 H 1 3.870 0.020 A 0 GLY HA3 H 1 3.870 0.020 A 0 GLY CA C 13 43.750 0.100 A 1 SER H H 1 8.381 0.020 A 1 SER HA H 1 4.809 0.020 A 1 SER HBx H 1 3.845 0.020 A 1 SER HBy H 1 3.893 0.020 A 1 SER CA C 13 56.525 0.100 A 1 SER CB C 13 63.385 0.100 A 1 SER N N 15 117.201 0.100 A 2 PRO HA H 1 4.468 0.020 A 2 PRO HBx H 1 1.912 0.020 A 2 PRO HBy H 1 2.310 0.020 A 2 PRO HDx H 1 3.735 0.020 A 2 PRO HDy H 1 3.854 0.020 A 2 PRO HG2 H 1 2.031 0.020 A 2 PRO HG3 H 1 2.031 0.020 A 2 PRO CA C 13 63.292 0.100 A 2 PRO CB C 13 32.174 0.100 A 2 PRO CD C 13 50.847 0.100 A 2 PRO CG C 13 27.401 0.100 A 3 ARG H H 1 8.428 0.020 A 3 ARG HA H 1 4.324 0.020 A 3 ARG HBx H 1 1.773 0.020 A 3 ARG HBy H 1 1.835 0.020 A 3 ARG CA C 13 56.226 0.100 A 3 ARG CB C 13 30.732 0.100 A 3 ARG N N 15 121.649 0.100 A 4 ILE H H 1 8.165 0.020 A 4 ILE HA H 1 4.181 0.020 A 4 ILE HB H 1 1.869 0.020 A 4 ILE HD1% H 1 0.870 0.020 A 4 ILE HG1x H 1 1.214 0.020 A 4 ILE HG1y H 1 1.483 0.020 A 4 ILE HG2% H 1 0.916 0.020 A 4 ILE CA C 13 60.943 0.100 A 4 ILE CB C 13 38.751 0.100 A 4 ILE CD1 C 13 12.784 0.100 A 4 ILE CG1 C 13 27.303 0.100 A 4 ILE CG2 C 13 17.573 0.100 A 4 ILE N N 15 122.500 0.100 A 5 LYS H H 1 8.500 0.020 A 5 LYS HA H 1 4.402 0.020 A 5 LYS HBx H 1 1.772 0.020 A 5 LYS HBy H 1 1.863 0.020 A 5 LYS CA C 13 56.422 0.100 A 5 LYS CB C 13 33.130 0.100 A 5 LYS N N 15 126.237 0.100 A 6 THR H H 1 8.194 0.020 A 6 THR HA H 1 4.323 0.020 A 6 THR HB H 1 4.194 0.020 A 6 THR HG2% H 1 1.220 0.020 A 6 THR CA C 13 61.918 0.100 A 6 THR CB C 13 69.963 0.100 A 6 THR CG2 C 13 21.732 0.100 A 6 THR N N 15 116.495 0.100 A 7 ARG H H 1 8.458 0.020 A 7 ARG HA H 1 4.396 0.020 A 7 ARG HBx H 1 1.801 0.020 A 7 ARG HBy H 1 1.892 0.020 A 7 ARG CA C 13 56.128 0.100 A 7 ARG CB C 13 30.953 0.100 A 7 ARG N N 15 124.128 0.100 A 8 ARG H H 1 8.526 0.020 A 8 ARG HA H 1 4.424 0.020 A 8 ARG HBx H 1 1.796 0.020 A 8 ARG HBy H 1 1.903 0.020 A 8 ARG CA C 13 56.011 0.100 A 8 ARG CB C 13 31.058 0.100 A 8 ARG N N 15 123.384 0.100 A 9 SER H H 1 8.450 0.020 A 9 SER HA H 1 4.473 0.020 A 9 SER HBx H 1 3.868 0.020 A 9 SER HBy H 1 3.906 0.020 A 9 SER CA C 13 58.568 0.100 A 9 SER CB C 13 63.986 0.100 A 9 SER N N 15 118.446 0.100 A 10 LYS H H 1 8.426 0.020 A 10 LYS HA H 1 4.673 0.020 A 10 LYS HBx H 1 1.811 0.020 A 10 LYS HBy H 1 1.893 0.020 A 10 LYS CA C 13 54.412 0.100 A 10 LYS CB C 13 32.693 0.100 A 10 LYS N N 15 124.117 0.100 A 11 PRO HA H 1 4.360 0.020 A 11 PRO HBx H 1 1.825 0.020 A 11 PRO HBy H 1 2.235 0.020 A 11 PRO HDx H 1 3.639 0.020 A 11 PRO HDy H 1 3.819 0.020 A 11 PRO HG2 H 1 1.993 0.020 A 11 PRO HG3 H 1 1.993 0.020 A 11 PRO CA C 13 62.861 0.100 A 11 PRO CB C 13 32.106 0.100 A 11 PRO CD C 13 50.683 0.100 A 11 PRO CG C 13 27.388 0.100 A 12 ALA H H 1 7.890 0.020 A 12 ALA HA H 1 2.889 0.020 A 12 ALA HB% H 1 0.014 0.020 A 12 ALA CA C 13 49.735 0.100 A 12 ALA CB C 13 18.066 0.100 A 12 ALA N N 15 124.420 0.100 A 13 PRO HA H 1 4.207 0.020 A 13 PRO HBx H 1 1.436 0.020 A 13 PRO HBy H 1 2.242 0.020 A 13 PRO HDx H 1 2.081 0.020 A 13 PRO HDy H 1 2.486 0.020 A 13 PRO CA C 13 62.111 0.100 A 13 PRO CB C 13 32.582 0.100 A 13 PRO CD C 13 49.878 0.100 A 14 ASP H H 1 8.206 0.020 A 14 ASP HA H 1 4.379 0.020 A 14 ASP HBx H 1 2.604 0.020 A 14 ASP HBy H 1 2.637 0.020 A 14 ASP CA C 13 56.427 0.100 A 14 ASP CB C 13 41.177 0.100 A 14 ASP N N 15 119.535 0.100 A 15 GLY H H 1 8.723 0.020 A 15 GLY HAx H 1 3.728 0.020 A 15 GLY HAy H 1 4.562 0.020 A 15 GLY CA C 13 45.146 0.100 A 15 GLY N N 15 113.273 0.100 A 16 PHE H H 1 8.127 0.020 A 16 PHE HA H 1 4.125 0.020 A 16 PHE HB2 H 1 2.996 0.020 A 16 PHE HB3 H 1 2.814 0.020 A 16 PHE HD1 H 1 7.015 0.020 A 16 PHE HD2 H 1 7.015 0.020 A 16 PHE HE1 H 1 7.172 0.020 A 16 PHE HE2 H 1 7.172 0.020 A 16 PHE HZ H 1 7.402 0.020 A 16 PHE CA C 13 60.715 0.100 A 16 PHE CB C 13 39.639 0.100 A 16 PHE CD1 C 13 131.356 0.100 A 16 PHE CD2 C 13 131.356 0.100 A 16 PHE CE1 C 13 131.407 0.100 A 16 PHE CE2 C 13 131.407 0.100 A 16 PHE CZ C 13 129.321 0.100 A 16 PHE N N 15 123.113 0.100 A 17 GLU H H 1 9.088 0.020 A 17 GLU HA H 1 3.768 0.020 A 17 GLU HB2 H 1 2.125 0.020 A 17 GLU HB3 H 1 2.023 0.020 A 17 GLU HG2 H 1 2.331 0.020 A 17 GLU HG3 H 1 2.471 0.020 A 17 GLU CA C 13 59.234 0.100 A 17 GLU CB C 13 28.495 0.100 A 17 GLU CG C 13 36.177 0.100 A 17 GLU N N 15 115.695 0.100 A 18 LYS H H 1 7.285 0.020 A 18 LYS HA H 1 4.165 0.020 A 18 LYS HB2 H 1 1.917 0.020 A 18 LYS HB3 H 1 1.956 0.020 A 18 LYS HGx H 1 1.509 0.020 A 18 LYS HGy H 1 1.555 0.020 A 18 LYS CA C 13 58.249 0.100 A 18 LYS CB C 13 32.725 0.100 A 18 LYS CG C 13 25.340 0.100 A 18 LYS N N 15 115.887 0.100 A 19 ILE H H 1 7.031 0.020 A 19 ILE HA H 1 4.722 0.020 A 19 ILE HB H 1 2.434 0.020 A 19 ILE HD1% H 1 0.969 0.020 A 19 ILE HG1x H 1 1.305 0.020 A 19 ILE HG1y H 1 1.377 0.020 A 19 ILE HG2% H 1 0.901 0.020 A 19 ILE CA C 13 61.093 0.100 A 19 ILE CB C 13 39.139 0.100 A 19 ILE CD1 C 13 16.228 0.100 A 19 ILE CG1 C 13 26.345 0.100 A 19 ILE CG2 C 13 18.073 0.100 A 19 ILE N N 15 110.277 0.100 A 20 LYS H H 1 7.666 0.020 A 20 LYS HA H 1 3.603 0.020 A 20 LYS HB2 H 1 1.028 0.020 A 20 LYS HB3 H 1 1.548 0.020 A 20 LYS HE2 H 1 2.996 0.020 A 20 LYS HE3 H 1 2.996 0.020 A 20 LYS CA C 13 60.917 0.100 A 20 LYS CB C 13 30.210 0.100 A 20 LYS CE C 13 42.098 0.100 A 20 LYS N N 15 124.540 0.100 A 21 PRO HA H 1 4.292 0.020 A 21 PRO HBx H 1 1.929 0.020 A 21 PRO HBy H 1 2.370 0.020 A 21 PRO HDx H 1 3.391 0.020 A 21 PRO HDy H 1 3.687 0.020 A 21 PRO CA C 13 66.990 0.100 A 21 PRO CB C 13 30.779 0.100 A 21 PRO CD C 13 50.462 0.100 A 22 THR H H 1 7.331 0.020 A 22 THR HA H 1 3.866 0.020 A 22 THR HB H 1 4.167 0.020 A 22 THR HG2% H 1 0.541 0.020 A 22 THR CA C 13 66.575 0.100 A 22 THR CB C 13 68.731 0.100 A 22 THR CG2 C 13 21.815 0.100 A 22 THR N N 15 114.917 0.100 A 23 LEU H H 1 7.991 0.020 A 23 LEU HA H 1 4.397 0.020 A 23 LEU HB2 H 1 2.081 0.020 A 23 LEU HB3 H 1 1.838 0.020 A 23 LEU HDx% H 1 1.116 0.020 A 23 LEU HDy% H 1 0.757 0.020 A 23 LEU HG H 1 1.990 0.020 A 23 LEU CA C 13 58.740 0.100 A 23 LEU CB C 13 40.489 0.100 A 23 LEU CDx C 13 22.642 0.100 A 23 LEU CDy C 13 26.143 0.100 A 23 LEU CG C 13 26.886 0.100 A 23 LEU N N 15 120.152 0.100 A 24 THR H H 1 9.175 0.020 A 24 THR HA H 1 4.095 0.020 A 24 THR HB H 1 4.364 0.020 A 24 THR HG2% H 1 1.346 0.020 A 24 THR CA C 13 66.834 0.100 A 24 THR CB C 13 68.614 0.100 A 24 THR CG2 C 13 21.717 0.100 A 24 THR N N 15 119.365 0.100 A 25 ASP H H 1 7.714 0.020 A 25 ASP HA H 1 4.483 0.020 A 25 ASP HBx H 1 2.541 0.020 A 25 ASP HBy H 1 2.693 0.020 A 25 ASP CA C 13 58.158 0.100 A 25 ASP CB C 13 40.329 0.100 A 25 ASP N N 15 122.865 0.100 A 26 PHE H H 1 7.816 0.020 A 26 PHE HA H 1 4.457 0.020 A 26 PHE HB2 H 1 3.308 0.020 A 26 PHE HB3 H 1 3.176 0.020 A 26 PHE HD1 H 1 7.310 0.020 A 26 PHE HD2 H 1 7.310 0.020 A 26 PHE HE1 H 1 7.206 0.020 A 26 PHE HE2 H 1 7.206 0.020 A 26 PHE HZ H 1 7.239 0.020 A 26 PHE CA C 13 62.531 0.100 A 26 PHE CB C 13 39.468 0.100 A 26 PHE CD1 C 13 131.153 0.100 A 26 PHE CD2 C 13 131.153 0.100 A 26 PHE CE1 C 13 130.491 0.100 A 26 PHE CE2 C 13 130.491 0.100 A 26 PHE CZ C 13 131.509 0.100 A 26 PHE N N 15 116.182 0.100 A 27 GLU H H 1 8.068 0.020 A 27 GLU HA H 1 4.113 0.020 A 27 GLU HB2 H 1 2.453 0.020 A 27 GLU HB3 H 1 2.453 0.020 A 27 GLU HG2 H 1 2.540 0.020 A 27 GLU HG3 H 1 2.540 0.020 A 27 GLU CA C 13 59.852 0.100 A 27 GLU CB C 13 29.692 0.100 A 27 GLU CG C 13 36.288 0.100 A 27 GLU N N 15 120.107 0.100 A 28 ILE H H 1 8.531 0.020 A 28 ILE HA H 1 3.718 0.020 A 28 ILE HB H 1 2.103 0.020 A 28 ILE HD1% H 1 0.912 0.020 A 28 ILE HG1x H 1 1.259 0.020 A 28 ILE HG1y H 1 1.809 0.020 A 28 ILE HG2% H 1 0.971 0.020 A 28 ILE CA C 13 65.002 0.100 A 28 ILE CB C 13 38.023 0.100 A 28 ILE CD1 C 13 13.060 0.100 A 28 ILE CG1 C 13 29.095 0.100 A 28 ILE CG2 C 13 17.284 0.100 A 28 ILE N N 15 121.494 0.100 A 29 GLN H H 1 8.117 0.020 A 29 GLN HA H 1 4.180 0.020 A 29 GLN HB2 H 1 2.282 0.020 A 29 GLN HB3 H 1 2.282 0.020 A 29 GLN HE2x H 1 6.581 0.020 A 29 GLN HE2y H 1 7.171 0.020 A 29 GLN HGx H 1 2.382 0.020 A 29 GLN HGy H 1 2.664 0.020 A 29 GLN CA C 13 59.507 0.100 A 29 GLN CB C 13 29.783 0.100 A 29 GLN CG C 13 35.091 0.100 A 29 GLN N N 15 118.941 0.100 A 29 GLN NE2 N 15 110.959 0.100 A 30 LEU H H 1 8.677 0.020 A 30 LEU HA H 1 4.032 0.020 A 30 LEU HBx H 1 1.599 0.020 A 30 LEU HBy H 1 2.031 0.020 A 30 LEU HDx% H 1 0.838 0.020 A 30 LEU HD2% H 1 0.951 0.020 A 30 LEU HG H 1 1.711 0.020 A 30 LEU CA C 13 58.333 0.100 A 30 LEU CB C 13 42.339 0.100 A 30 LEU CDx C 13 24.807 0.100 A 30 LEU CDy C 13 25.791 0.100 A 30 LEU CG C 13 27.995 0.100 A 30 LEU N N 15 121.724 0.100 A 31 ARG H H 1 8.227 0.020 A 31 ARG HA H 1 4.105 0.020 A 31 ARG HB2 H 1 2.096 0.020 A 31 ARG HB3 H 1 2.096 0.020 A 31 ARG HD2 H 1 3.275 0.020 A 31 ARG HD3 H 1 3.275 0.020 A 31 ARG CA C 13 59.340 0.100 A 31 ARG CB C 13 30.044 0.100 A 31 ARG CD C 13 43.748 0.100 A 31 ARG N N 15 120.629 0.100 A 32 ASP H H 1 8.407 0.020 A 32 ASP HA H 1 4.484 0.020 A 32 ASP HB2 H 1 2.769 0.020 A 32 ASP HB3 H 1 2.721 0.020 A 32 ASP CA C 13 57.199 0.100 A 32 ASP CB C 13 40.202 0.100 A 32 ASP N N 15 120.233 0.100 A 33 ALA H H 1 8.057 0.020 A 33 ALA HA H 1 4.321 0.020 A 33 ALA HB% H 1 1.522 0.020 A 33 ALA CA C 13 54.207 0.100 A 33 ALA CB C 13 18.738 0.100 A 33 ALA N N 15 121.939 0.100 A 34 GLN H H 1 7.746 0.020 A 34 GLN HA H 1 4.248 0.020 A 34 GLN HB2 H 1 2.139 0.020 A 34 GLN HB3 H 1 2.267 0.020 A 34 GLN HE2x H 1 6.941 0.020 A 34 GLN HE2y H 1 7.292 0.020 A 34 GLN HGx H 1 2.409 0.020 A 34 GLN HGy H 1 2.607 0.020 A 34 GLN CA C 13 56.567 0.100 A 34 GLN CB C 13 29.743 0.100 A 34 GLN CG C 13 34.725 0.100 A 34 GLN N N 15 114.736 0.100 A 34 GLN NE2 N 15 111.018 0.100 A 35 LYS H H 1 7.570 0.020 A 35 LYS HA H 1 4.232 0.020 A 35 LYS HB2 H 1 1.948 0.020 A 35 LYS HB3 H 1 1.876 0.020 A 35 LYS CA C 13 57.427 0.100 A 35 LYS CB C 13 32.887 0.100 A 35 LYS N N 15 120.534 0.100 A 36 ASP H H 1 8.375 0.020 A 36 ASP HA H 1 4.595 0.020 A 36 ASP HBx H 1 2.682 0.020 A 36 ASP HBy H 1 2.778 0.020 A 36 ASP CA C 13 54.983 0.100 A 36 ASP CB C 13 41.129 0.100 A 36 ASP N N 15 120.943 0.100 A 37 LYS H H 1 8.446 0.020 A 37 LYS HA H 1 4.365 0.020 A 37 LYS HBx H 1 1.829 0.020 A 37 LYS HBy H 1 1.946 0.020 A 37 LYS CA C 13 56.725 0.100 A 37 LYS CB C 13 32.823 0.100 A 37 LYS N N 15 122.598 0.100 A 38 SER H H 1 8.392 0.020 A 38 SER HA H 1 4.423 0.020 A 38 SER HB2 H 1 3.933 0.020 A 38 SER HB3 H 1 3.933 0.020 A 38 SER CA C 13 59.193 0.100 A 38 SER CB C 13 63.744 0.100 A 38 SER N N 15 115.849 0.100 A 39 SER H H 1 8.283 0.020 A 39 SER HA H 1 4.445 0.020 A 39 SER HBx H 1 3.907 0.020 A 39 SER HBy H 1 3.989 0.020 A 39 SER CA C 13 58.933 0.100 A 39 SER CB C 13 63.711 0.100 A 39 SER N N 15 117.258 0.100 A 40 LYS H H 1 8.263 0.020 A 40 LYS HA H 1 4.321 0.020 A 40 LYS HBx H 1 1.789 0.020 A 40 LYS HBy H 1 1.893 0.020 A 40 LYS CA C 13 56.847 0.100 A 40 LYS CB C 13 32.764 0.100 A 40 LYS N N 15 122.427 0.100 A 41 LEU H H 1 8.068 0.020 A 41 LEU HA H 1 4.308 0.020 A 41 LEU HBx H 1 1.613 0.020 A 41 LEU HBy H 1 1.670 0.020 A 41 LEU HDx% H 1 0.896 0.020 A 41 LEU HDy% H 1 0.951 0.020 A 41 LEU HG H 1 1.626 0.020 A 41 LEU CA C 13 55.335 0.100 A 41 LEU CB C 13 42.212 0.100 A 41 LEU CDx C 13 23.457 0.100 A 41 LEU CDy C 13 25.041 0.100 A 41 LEU CG C 13 27.232 0.100 A 41 LEU N N 15 121.281 0.100 A 42 ALA H H 1 8.111 0.020 A 42 ALA HA H 1 4.274 0.020 A 42 ALA HB% H 1 1.411 0.020 A 42 ALA CA C 13 52.851 0.100 A 42 ALA CB C 13 19.135 0.100 A 42 ALA N N 15 123.964 0.100 A 43 ALA H H 1 8.101 0.020 A 43 ALA HA H 1 4.297 0.020 A 43 ALA HB% H 1 1.409 0.020 A 43 ALA CA C 13 52.727 0.100 A 43 ALA CB C 13 19.318 0.100 A 43 ALA N N 15 122.146 0.100 A 44 LYS H H 1 8.198 0.020 A 44 LYS HA H 1 4.349 0.020 A 44 LYS HBx H 1 1.764 0.020 A 44 LYS HBy H 1 1.846 0.020 A 44 LYS CA C 13 56.267 0.100 A 44 LYS CB C 13 32.825 0.100 A 44 LYS N N 15 119.454 0.100 A 45 SER H H 1 8.251 0.020 A 45 SER HA H 1 4.368 0.020 A 45 SER HBx H 1 3.873 0.020 A 45 SER HBy H 1 3.977 0.020 A 45 SER CA C 13 58.477 0.100 A 45 SER CB C 13 64.063 0.100 A 45 SER N N 15 116.660 0.100 A 46 ASN H H 1 8.498 0.020 A 46 ASN HA H 1 4.361 0.020 A 46 ASN HBx H 1 2.254 0.020 A 46 ASN HBy H 1 2.306 0.020 A 46 ASN HD2x H 1 6.956 0.020 A 46 ASN HD2y H 1 7.391 0.020 A 46 ASN CA C 13 54.657 0.100 A 46 ASN CB C 13 37.649 0.100 A 46 ASN N N 15 120.516 0.100 A 46 ASN ND2 N 15 112.581 0.100 A 47 GLU H H 1 8.016 0.020 A 47 GLU HA H 1 3.350 0.020 A 47 GLU HB2 H 1 1.803 0.020 A 47 GLU HB3 H 1 1.837 0.020 A 47 GLU HG2 H 1 2.028 0.020 A 47 GLU HG3 H 1 2.028 0.020 A 47 GLU CA C 13 59.213 0.100 A 47 GLU CB C 13 28.998 0.100 A 47 GLU CG C 13 36.614 0.100 A 47 GLU N N 15 117.964 0.100 A 48 GLN H H 1 7.892 0.020 A 48 GLN HA H 1 4.250 0.020 A 48 GLN HB2 H 1 2.125 0.020 A 48 GLN HB3 H 1 2.125 0.020 A 48 GLN HE2x H 1 6.896 0.020 A 48 GLN HE2y H 1 7.682 0.020 A 48 GLN HGx H 1 2.373 0.020 A 48 GLN HGy H 1 2.520 0.020 A 48 GLN CA C 13 58.529 0.100 A 48 GLN CB C 13 28.902 0.100 A 48 GLN CG C 13 34.370 0.100 A 48 GLN N N 15 119.468 0.100 A 48 GLN NE2 N 15 112.178 0.100 A 49 LEU H H 1 7.699 0.020 A 49 LEU HA H 1 4.232 0.020 A 49 LEU HB2 H 1 1.806 0.020 A 49 LEU HB3 H 1 1.834 0.020 A 49 LEU HDx% H 1 1.033 0.020 A 49 LEU HDy% H 1 1.042 0.020 A 49 LEU HG H 1 1.783 0.020 A 49 LEU CA C 13 57.479 0.100 A 49 LEU CB C 13 41.391 0.100 A 49 LEU CDx C 13 24.396 0.100 A 49 LEU CDy C 13 24.517 0.100 A 49 LEU CG C 13 27.238 0.100 A 49 LEU N N 15 120.145 0.100 A 50 TRP H H 1 8.385 0.020 A 50 TRP HA H 1 4.520 0.020 A 50 TRP HB2 H 1 3.160 0.020 A 50 TRP HB3 H 1 3.423 0.020 A 50 TRP HD1 H 1 6.689 0.020 A 50 TRP HE1 H 1 9.148 0.020 A 50 TRP HE3 H 1 7.548 0.020 A 50 TRP HH2 H 1 7.011 0.020 A 50 TRP HZ2 H 1 7.343 0.020 A 50 TRP HZ3 H 1 7.004 0.020 A 50 TRP CA C 13 58.353 0.100 A 50 TRP CB C 13 28.880 0.100 A 50 TRP CD1 C 13 123.011 0.100 A 50 TRP CE3 C 13 120.491 0.100 A 50 TRP CH2 C 13 124.308 0.100 A 50 TRP CZ2 C 13 115.784 0.100 A 50 TRP CZ3 C 13 121.891 0.100 A 50 TRP N N 15 119.596 0.100 A 50 TRP NE1 N 15 126.465 0.100 A 51 GLU H H 1 8.223 0.020 A 51 GLU HA H 1 4.145 0.020 A 51 GLU HBx H 1 2.223 0.020 A 51 GLU HBy H 1 2.302 0.020 A 51 GLU HG2 H 1 2.509 0.020 A 51 GLU HG3 H 1 2.509 0.020 A 51 GLU CA C 13 60.035 0.100 A 51 GLU CB C 13 29.675 0.100 A 51 GLU CG C 13 36.235 0.100 A 51 GLU N N 15 119.362 0.100 A 52 ILE H H 1 7.801 0.020 A 52 ILE HA H 1 3.673 0.020 A 52 ILE HB H 1 2.127 0.020 A 52 ILE HD1% H 1 0.951 0.020 A 52 ILE HG1y H 1 1.876 0.020 A 52 ILE HG1x H 1 1.078 0.020 A 52 ILE HG2% H 1 0.990 0.020 A 52 ILE CA C 13 65.511 0.100 A 52 ILE CB C 13 38.532 0.100 A 52 ILE CD1 C 13 14.129 0.100 A 52 ILE CG1 C 13 30.047 0.100 A 52 ILE CG2 C 13 17.453 0.100 A 52 ILE N N 15 119.018 0.100 A 53 MET H H 1 8.411 0.020 A 53 MET HA H 1 4.452 0.020 A 53 MET HB2 H 1 2.233 0.020 A 53 MET HB3 H 1 2.494 0.020 A 53 MET HE% H 1 2.312 0.020 A 53 MET HGx H 1 2.964 0.020 A 53 MET HGy H 1 3.026 0.020 A 53 MET CA C 13 58.216 0.100 A 53 MET CB C 13 31.838 0.100 A 53 MET CE C 13 17.656 0.100 A 53 MET CG C 13 32.269 0.100 A 53 MET N N 15 118.133 0.100 A 54 GLN H H 1 8.860 0.020 A 54 GLN HA H 1 4.333 0.020 A 54 GLN HB2 H 1 2.306 0.020 A 54 GLN HB3 H 1 2.335 0.020 A 54 GLN HE2x H 1 6.745 0.020 A 54 GLN HE2y H 1 7.602 0.020 A 54 GLN HGx H 1 2.644 0.020 A 54 GLN HGy H 1 2.713 0.020 A 54 GLN CA C 13 59.004 0.100 A 54 GLN CB C 13 27.824 0.100 A 54 GLN CG C 13 34.239 0.100 A 54 GLN N N 15 120.855 0.100 A 54 GLN NE2 N 15 110.893 0.100 A 55 LEU H H 1 8.298 0.020 A 55 LEU HA H 1 4.302 0.020 A 55 LEU HB2 H 1 2.256 0.020 A 55 LEU HB3 H 1 1.372 0.020 A 55 LEU HDx% H 1 1.145 0.020 A 55 LEU HDy% H 1 0.954 0.020 A 55 LEU HG H 1 2.032 0.020 A 55 LEU CA C 13 58.685 0.100 A 55 LEU CB C 13 42.695 0.100 A 55 LEU CDx C 13 23.672 0.100 A 55 LEU CDy C 13 25.908 0.100 A 55 LEU CG C 13 27.839 0.100 A 55 LEU N N 15 122.788 0.100 A 56 HIS H H 1 8.416 0.020 A 56 HIS HA H 1 4.317 0.020 A 56 HIS HB2 H 1 3.284 0.020 A 56 HIS HB3 H 1 3.399 0.020 A 56 HIS HD2 H 1 7.068 0.020 A 56 HIS HE1 H 1 7.750 0.020 A 56 HIS CA C 13 60.732 0.100 A 56 HIS CB C 13 30.530 0.100 A 56 HIS CD2 C 13 119.245 0.100 A 56 HIS CE1 C 13 138.825 0.100 A 56 HIS N N 15 118.426 0.100 A 57 HIS H H 1 8.608 0.020 A 57 HIS HA H 1 4.318 0.020 A 57 HIS HB2 H 1 3.916 0.020 A 57 HIS HB3 H 1 3.661 0.020 A 57 HIS HD2 H 1 6.816 0.020 A 57 HIS HE1 H 1 7.911 0.020 A 57 HIS CA C 13 60.739 0.100 A 57 HIS CB C 13 28.726 0.100 A 57 HIS CD2 C 13 127.031 0.100 A 57 HIS CE1 C 13 138.672 0.100 A 57 HIS N N 15 121.197 0.100 A 58 GLN H H 1 9.206 0.020 A 58 GLN HA H 1 4.202 0.020 A 58 GLN HB2 H 1 2.450 0.020 A 58 GLN HB3 H 1 2.450 0.020 A 58 GLN HE2x H 1 6.994 0.020 A 58 GLN HE2y H 1 7.542 0.020 A 58 GLN HGx H 1 2.762 0.020 A 58 GLN HGy H 1 2.918 0.020 A 58 GLN CA C 13 59.507 0.100 A 58 GLN CB C 13 29.111 0.100 A 58 GLN CG C 13 34.291 0.100 A 58 GLN N N 15 118.739 0.100 A 58 GLN NE2 N 15 111.256 0.100 A 59 ARG H H 1 8.623 0.020 A 59 ARG HA H 1 3.437 0.020 A 59 ARG CA C 13 60.361 0.100 A 59 ARG N N 15 122.498 0.100 A 60 SER H H 1 7.993 0.020 A 60 SER HA H 1 4.515 0.020 A 60 SER HB2 H 1 3.911 0.020 A 60 SER HB3 H 1 3.959 0.020 A 60 SER CA C 13 64.832 0.100 A 60 SER CB C 13 63.583 0.100 A 60 SER N N 15 114.930 0.100 A 61 ARG H H 1 9.569 0.020 A 61 ARG HA H 1 4.204 0.020 A 61 ARG HB2 H 1 1.790 0.020 A 61 ARG HB3 H 1 2.114 0.020 A 61 ARG CA C 13 58.852 0.100 A 61 ARG CB C 13 29.077 0.100 A 61 ARG N N 15 124.417 0.100 A 62 TYR H H 1 8.622 0.020 A 62 TYR HA H 1 4.676 0.020 A 62 TYR HB2 H 1 3.676 0.020 A 62 TYR HB3 H 1 3.540 0.020 A 62 TYR HD1 H 1 7.294 0.020 A 62 TYR HD2 H 1 7.294 0.020 A 62 TYR HE1 H 1 6.813 0.020 A 62 TYR HE2 H 1 6.813 0.020 A 62 TYR CA C 13 61.006 0.100 A 62 TYR CB C 13 38.392 0.100 A 62 TYR CD1 C 13 132.883 0.100 A 62 TYR CD2 C 13 132.883 0.100 A 62 TYR CE1 C 13 118.380 0.100 A 62 TYR CE2 C 13 118.380 0.100 A 62 TYR N N 15 124.484 0.100 A 63 ILE H H 1 7.588 0.020 A 63 ILE HA H 1 3.492 0.020 A 63 ILE HB H 1 2.089 0.020 A 63 ILE HD1% H 1 1.035 0.020 A 63 ILE HG1x H 1 1.295 0.020 A 63 ILE HG1y H 1 2.106 0.020 A 63 ILE HG2% H 1 1.064 0.020 A 63 ILE CA C 13 65.693 0.100 A 63 ILE CB C 13 38.023 0.100 A 63 ILE CD1 C 13 14.970 0.100 A 63 ILE CG1 C 13 30.181 0.100 A 63 ILE CG2 C 13 17.799 0.100 A 63 ILE N N 15 119.789 0.100 A 64 TYR H H 1 9.166 0.020 A 64 TYR HA H 1 4.577 0.020 A 64 TYR HB2 H 1 3.631 0.020 A 64 TYR HB3 H 1 3.681 0.020 A 64 TYR HD1 H 1 7.265 0.020 A 64 TYR HD2 H 1 7.265 0.020 A 64 TYR HE1 H 1 6.537 0.020 A 64 TYR HE2 H 1 6.537 0.020 A 64 TYR CA C 13 61.759 0.100 A 64 TYR CB C 13 39.772 0.100 A 64 TYR CD1 C 13 133.545 0.100 A 64 TYR CD2 C 13 133.545 0.100 A 64 TYR CE1 C 13 118.100 0.100 A 64 TYR CE2 C 13 118.100 0.100 A 64 TYR N N 15 120.485 0.100 A 65 THR H H 1 8.987 0.020 A 65 THR HA H 1 3.562 0.020 A 65 THR HB H 1 4.537 0.020 A 65 THR HG2% H 1 1.275 0.020 A 65 THR CA C 13 67.016 0.100 A 65 THR CB C 13 68.711 0.100 A 65 THR CG2 C 13 21.782 0.100 A 65 THR N N 15 117.072 0.100 A 66 LEU H H 1 8.286 0.020 A 66 LEU HA H 1 3.782 0.020 A 66 LEU HB2 H 1 1.215 0.020 A 66 LEU HB3 H 1 2.026 0.020 A 66 LEU HDx% H 1 0.717 0.020 A 66 LEU HDy% H 1 0.537 0.020 A 66 LEU HG H 1 1.421 0.020 A 66 LEU CA C 13 58.476 0.100 A 66 LEU CB C 13 43.183 0.100 A 66 LEU CDx C 13 22.864 0.100 A 66 LEU CDy C 13 26.195 0.100 A 66 LEU CG C 13 26.064 0.100 A 66 LEU N N 15 122.107 0.100 A 67 TYR H H 1 7.983 0.020 A 67 TYR HA H 1 4.344 0.020 A 67 TYR HB2 H 1 2.623 0.020 A 67 TYR HB3 H 1 2.623 0.020 A 67 TYR HD1 H 1 5.745 0.020 A 67 TYR HD2 H 1 5.745 0.020 A 67 TYR HE1 H 1 6.081 0.020 A 67 TYR HE2 H 1 6.081 0.020 A 67 TYR CA C 13 60.830 0.100 A 67 TYR CB C 13 40.376 0.100 A 67 TYR CD1 C 13 132.832 0.100 A 67 TYR CD2 C 13 132.832 0.100 A 67 TYR CE1 C 13 117.209 0.100 A 67 TYR CE2 C 13 117.209 0.100 A 67 TYR N N 15 115.264 0.100 A 68 TYR H H 1 8.297 0.020 A 68 TYR HA H 1 3.699 0.020 A 68 TYR HB2 H 1 2.201 0.020 A 68 TYR HB3 H 1 2.748 0.020 A 68 TYR HD1 H 1 7.153 0.020 A 68 TYR HD2 H 1 7.153 0.020 A 68 TYR HE1 H 1 7.050 0.020 A 68 TYR HE2 H 1 7.050 0.020 A 68 TYR CA C 13 62.030 0.100 A 68 TYR CB C 13 38.046 0.100 A 68 TYR CD1 C 13 133.138 0.100 A 68 TYR CD2 C 13 133.138 0.100 A 68 TYR CE1 C 13 118.176 0.100 A 68 TYR CE2 C 13 118.176 0.100 A 68 TYR N N 15 113.945 0.100 A 69 LYS H H 1 7.084 0.020 A 69 LYS HA H 1 4.564 0.020 A 69 LYS HB2 H 1 2.188 0.020 A 69 LYS HB3 H 1 2.001 0.020 A 69 LYS HD2 H 1 1.666 0.020 A 69 LYS HD3 H 1 1.666 0.020 A 69 LYS HEx H 1 2.958 0.020 A 69 LYS HEy H 1 3.017 0.020 A 69 LYS HGx H 1 1.295 0.020 A 69 LYS HGy H 1 1.461 0.020 A 69 LYS CA C 13 56.821 0.100 A 69 LYS CB C 13 31.980 0.100 A 69 LYS CD C 13 28.248 0.100 A 69 LYS CE C 13 42.073 0.100 A 69 LYS CG C 13 24.346 0.100 A 69 LYS N N 15 114.346 0.100 A 70 ARG H H 1 8.178 0.020 A 70 ARG HA H 1 4.251 0.020 A 70 ARG HBx H 1 1.887 0.020 A 70 ARG HBy H 1 2.034 0.020 A 70 ARG HDx H 1 3.117 0.020 A 70 ARG HDy H 1 3.162 0.020 A 70 ARG CA C 13 56.314 0.100 A 70 ARG CB C 13 31.128 0.100 A 70 ARG CD C 13 43.319 0.100 A 70 ARG N N 15 114.676 0.100 A 71 LYS H H 1 6.843 0.020 A 71 LYS HA H 1 4.036 0.020 A 71 LYS HB2 H 1 1.834 0.020 A 71 LYS HB3 H 1 1.834 0.020 A 71 LYS HE2 H 1 2.870 0.020 A 71 LYS HE3 H 1 2.870 0.020 A 71 LYS CA C 13 57.121 0.100 A 71 LYS CB C 13 28.897 0.100 A 71 LYS CE C 13 42.345 0.100 A 71 LYS N N 15 115.371 0.100 A 72 ALA H H 1 8.560 0.020 A 72 ALA HA H 1 4.395 0.020 A 72 ALA HB% H 1 1.364 0.020 A 72 ALA CA C 13 52.597 0.100 A 72 ALA CB C 13 21.560 0.100 A 72 ALA N N 15 117.701 0.100 A 73 ILE H H 1 7.074 0.020 A 73 ILE HB H 1 2.090 0.020 A 73 ILE HD1% H 1 0.907 0.020 A 73 ILE HG1x H 1 0.744 0.020 A 73 ILE HG1y H 1 1.683 0.020 A 73 ILE HG2% H 1 0.941 0.020 A 73 ILE CB C 13 42.724 0.100 A 73 ILE CD1 C 13 14.331 0.100 A 73 ILE CG1 C 13 24.279 0.100 A 73 ILE CG2 C 13 18.549 0.100 A 73 ILE N N 15 107.605 0.100 A 74 SER H H 1 8.797 0.020 A 74 SER HA H 1 4.484 0.020 A 74 SER HBx H 1 4.135 0.020 A 74 SER HBy H 1 4.477 0.020 A 74 SER CA C 13 57.082 0.100 A 74 SER CB C 13 65.396 0.100 A 74 SER N N 15 118.425 0.100 A 75 LYS H H 1 9.024 0.020 A 75 LYS HA H 1 3.851 0.020 A 75 LYS HBx H 1 1.861 0.020 A 75 LYS HBy H 1 2.117 0.020 A 75 LYS HE2 H 1 3.126 0.020 A 75 LYS HE3 H 1 3.126 0.020 A 75 LYS CA C 13 59.624 0.100 A 75 LYS CB C 13 32.368 0.100 A 75 LYS CE C 13 42.593 0.100 A 75 LYS N N 15 121.891 0.100 A 76 ASP H H 1 8.161 0.020 A 76 ASP HA H 1 4.423 0.020 A 76 ASP HB2 H 1 2.653 0.020 A 76 ASP HB3 H 1 2.578 0.020 A 76 ASP CA C 13 57.362 0.100 A 76 ASP CB C 13 40.391 0.100 A 76 ASP N N 15 115.908 0.100 A 77 LEU H H 1 8.345 0.020 A 77 LEU HA H 1 4.180 0.020 A 77 LEU HDx% H 1 1.057 0.020 A 77 LEU HDy% H 1 0.987 0.020 A 77 LEU CA C 13 57.818 0.100 A 77 LEU CDx C 13 23.510 0.100 A 77 LEU CDy C 13 25.759 0.100 A 77 LEU N N 15 121.705 0.100 A 78 TYR H H 1 8.598 0.020 A 78 TYR HA H 1 3.789 0.020 A 78 TYR HB2 H 1 2.214 0.020 A 78 TYR HB3 H 1 2.421 0.020 A 78 TYR HD1 H 1 6.555 0.020 A 78 TYR HD2 H 1 6.555 0.020 A 78 TYR HE1 H 1 6.622 0.020 A 78 TYR HE2 H 1 6.622 0.020 A 78 TYR CA C 13 62.857 0.100 A 78 TYR CB C 13 38.369 0.100 A 78 TYR CD1 C 13 132.680 0.100 A 78 TYR CD2 C 13 132.680 0.100 A 78 TYR CE1 C 13 117.871 0.100 A 78 TYR CE2 C 13 117.871 0.100 A 78 TYR N N 15 121.511 0.100 A 79 ASP H H 1 9.106 0.020 A 79 ASP HA H 1 4.066 0.020 A 79 ASP HB2 H 1 2.566 0.020 A 79 ASP HB3 H 1 2.819 0.020 A 79 ASP CA C 13 57.219 0.100 A 79 ASP CB C 13 40.003 0.100 A 79 ASP N N 15 117.189 0.100 A 80 TRP H H 1 7.931 0.020 A 80 TRP HA H 1 4.160 0.020 A 80 TRP HB2 H 1 3.296 0.020 A 80 TRP HB3 H 1 3.563 0.020 A 80 TRP HD1 H 1 7.233 0.020 A 80 TRP HE1 H 1 9.858 0.020 A 80 TRP HE3 H 1 7.141 0.020 A 80 TRP HH2 H 1 6.708 0.020 A 80 TRP HZ2 H 1 7.263 0.020 A 80 TRP HZ3 H 1 6.395 0.020 A 80 TRP CA C 13 62.368 0.100 A 80 TRP CB C 13 29.969 0.100 A 80 TRP CD1 C 13 126.827 0.100 A 80 TRP CE3 C 13 118.939 0.100 A 80 TRP CH2 C 13 124.664 0.100 A 80 TRP CZ2 C 13 114.512 0.100 A 80 TRP CZ3 C 13 122.578 0.100 A 80 TRP N N 15 123.400 0.100 A 80 TRP NE1 N 15 129.199 0.100 A 81 LEU H H 1 8.814 0.020 A 81 LEU HA H 1 3.971 0.020 A 81 LEU HB2 H 1 2.384 0.020 A 81 LEU HB3 H 1 1.280 0.020 A 81 LEU HDx% H 1 0.972 0.020 A 81 LEU HDy% H 1 0.907 0.020 A 81 LEU CA C 13 58.294 0.100 A 81 LEU CB C 13 41.818 0.100 A 81 LEU CDx C 13 24.227 0.100 A 81 LEU CDy C 13 27.741 0.100 A 81 LEU N N 15 119.674 0.100 A 82 ILE H H 1 7.886 0.020 A 82 ILE HA H 1 3.861 0.020 A 82 ILE HB H 1 1.943 0.020 A 82 ILE HD1% H 1 0.409 0.020 A 82 ILE HG1y H 1 0.954 0.020 A 82 ILE HG1x H 1 0.866 0.020 A 82 ILE HG2% H 1 0.840 0.020 A 82 ILE CA C 13 62.734 0.100 A 82 ILE CB C 13 36.236 0.100 A 82 ILE CD1 C 13 10.609 0.100 A 82 ILE CG1 C 13 27.212 0.100 A 82 ILE CG2 C 13 18.060 0.100 A 82 ILE N N 15 118.746 0.100 A 83 LYS H H 1 8.224 0.020 A 83 LYS HA H 1 3.911 0.020 A 83 LYS HB2 H 1 1.873 0.020 A 83 LYS HB3 H 1 1.873 0.020 A 83 LYS CA C 13 59.643 0.100 A 83 LYS CB C 13 32.027 0.100 A 83 LYS N N 15 124.819 0.100 A 84 GLU H H 1 8.138 0.020 A 84 GLU HA H 1 3.841 0.020 A 84 GLU HB2 H 1 1.109 0.020 A 84 GLU HB3 H 1 1.864 0.020 A 84 GLU HGx H 1 0.503 0.020 A 84 GLU HGy H 1 1.069 0.020 A 84 GLU CA C 13 55.582 0.100 A 84 GLU CB C 13 29.459 0.100 A 84 GLU CG C 13 34.601 0.100 A 84 GLU N N 15 115.404 0.100 A 85 LYS H H 1 7.719 0.020 A 85 LYS HA H 1 3.820 0.020 A 85 LYS HBx H 1 1.873 0.020 A 85 LYS HBy H 1 1.994 0.020 A 85 LYS CA C 13 57.890 0.100 A 85 LYS CB C 13 28.005 0.100 A 85 LYS N N 15 111.563 0.100 A 86 TYR H H 1 8.521 0.020 A 86 TYR HA H 1 4.137 0.020 A 86 TYR HB2 H 1 2.804 0.020 A 86 TYR HB3 H 1 2.932 0.020 A 86 TYR HD1 H 1 7.127 0.020 A 86 TYR HD2 H 1 7.127 0.020 A 86 TYR HE1 H 1 6.877 0.020 A 86 TYR HE2 H 1 6.877 0.020 A 86 TYR CA C 13 61.228 0.100 A 86 TYR CB C 13 39.535 0.100 A 86 TYR CD1 C 13 132.985 0.100 A 86 TYR CD2 C 13 132.985 0.100 A 86 TYR CE1 C 13 118.838 0.100 A 86 TYR CE2 C 13 118.838 0.100 A 86 TYR N N 15 116.916 0.100 A 87 ALA H H 1 6.959 0.020 A 87 ALA HA H 1 4.738 0.020 A 87 ALA HB% H 1 1.267 0.020 A 87 ALA CA C 13 49.121 0.100 A 87 ALA CB C 13 23.295 0.100 A 87 ALA N N 15 113.715 0.100 A 88 ASP H H 1 7.870 0.020 A 88 ASP HA H 1 4.544 0.020 A 88 ASP HB2 H 1 2.430 0.020 A 88 ASP HB3 H 1 2.769 0.020 A 88 ASP CA C 13 52.714 0.100 A 88 ASP CB C 13 41.845 0.100 A 88 ASP N N 15 119.344 0.100 A 89 LYS H H 1 8.467 0.020 A 89 LYS HA H 1 3.834 0.020 A 89 LYS HB2 H 1 1.801 0.020 A 89 LYS HB3 H 1 1.982 0.020 A 89 LYS CA C 13 59.409 0.100 A 89 LYS CB C 13 32.848 0.100 A 89 LYS N N 15 125.312 0.100 A 90 LEU H H 1 8.076 0.020 A 90 LEU HA H 1 4.023 0.020 A 90 LEU HBx H 1 1.313 0.020 A 90 LEU HBy H 1 1.855 0.020 A 90 LEU HDx% H 1 0.775 0.020 A 90 LEU HDy% H 1 0.875 0.020 A 90 LEU HG H 1 1.592 0.020 A 90 LEU CA C 13 57.049 0.100 A 90 LEU CB C 13 41.099 0.100 A 90 LEU CDx C 13 22.623 0.100 A 90 LEU CDy C 13 24.918 0.100 A 90 LEU CG C 13 27.441 0.100 A 90 LEU N N 15 119.899 0.100 A 91 LEU H H 1 7.120 0.020 A 91 LEU HA H 1 3.498 0.020 A 91 LEU HB2 H 1 0.953 0.020 A 91 LEU HB3 H 1 1.113 0.020 A 91 LEU HDx% H 1 0.362 0.020 A 91 LEU HDy% H 1 0.679 0.020 A 91 LEU HG H 1 -0.200 0.020 A 91 LEU CA C 13 56.971 0.100 A 91 LEU CB C 13 41.823 0.100 A 91 LEU CDx C 13 21.899 0.100 A 91 LEU CDy C 13 26.456 0.100 A 91 LEU CG C 13 25.661 0.100 A 91 LEU N N 15 123.148 0.100 A 92 ILE H H 1 7.384 0.020 A 92 ILE HA H 1 3.265 0.020 A 92 ILE HB H 1 1.688 0.020 A 92 ILE HD1% H 1 1.204 0.020 A 92 ILE HG12 H 1 1.336 0.020 A 92 ILE HG13 H 1 1.336 0.020 A 92 ILE HG2% H 1 1.344 0.020 A 92 ILE CA C 13 65.178 0.100 A 92 ILE CB C 13 38.209 0.100 A 92 ILE CD1 C 13 14.272 0.100 A 92 ILE CG1 C 13 31.786 0.100 A 92 ILE CG2 C 13 17.590 0.100 A 92 ILE N N 15 116.780 0.100 A 93 ALA H H 1 7.437 0.020 A 93 ALA HA H 1 3.930 0.020 A 93 ALA HB% H 1 1.398 0.020 A 93 ALA CA C 13 54.839 0.100 A 93 ALA CB C 13 18.125 0.100 A 93 ALA N N 15 117.061 0.100 A 94 LYS H H 1 7.012 0.020 A 94 LYS HA H 1 3.803 0.020 A 94 LYS HB2 H 1 1.872 0.020 A 94 LYS HB3 H 1 1.426 0.020 A 94 LYS HD2 H 1 1.127 0.020 A 94 LYS HD3 H 1 1.127 0.020 A 94 LYS HEx H 1 2.349 0.020 A 94 LYS HEy H 1 2.432 0.020 A 94 LYS HG2 H 1 1.401 0.020 A 94 LYS HG3 H 1 1.401 0.020 A 94 LYS CA C 13 56.945 0.100 A 94 LYS CB C 13 31.047 0.100 A 94 LYS CD C 13 27.578 0.100 A 94 LYS CE C 13 41.760 0.100 A 94 LYS CG C 13 23.859 0.100 A 94 LYS N N 15 116.036 0.100 A 95 TRP H H 1 7.611 0.020 A 95 TRP HA H 1 4.814 0.020 A 95 TRP HB2 H 1 3.035 0.020 A 95 TRP HB3 H 1 2.612 0.020 A 95 TRP HD1 H 1 7.693 0.020 A 95 TRP HE1 H 1 11.318 0.020 A 95 TRP HE3 H 1 6.530 0.020 A 95 TRP HH2 H 1 6.996 0.020 A 95 TRP HZ2 H 1 6.281 0.020 A 95 TRP HZ3 H 1 6.451 0.020 A 95 TRP CA C 13 57.136 0.100 A 95 TRP CB C 13 28.171 0.100 A 95 TRP CD1 C 13 125.402 0.100 A 95 TRP CE3 C 13 118.303 0.100 A 95 TRP CH2 C 13 123.494 0.100 A 95 TRP CZ2 C 13 113.978 0.100 A 95 TRP CZ3 C 13 119.779 0.100 A 95 TRP N N 15 118.700 0.100 A 95 TRP NE1 N 15 130.138 0.100 A 96 ARG H H 1 7.066 0.020 A 96 ARG HA H 1 4.233 0.020 A 96 ARG HB2 H 1 1.630 0.020 A 96 ARG HB3 H 1 2.171 0.020 A 96 ARG HD2 H 1 2.715 0.020 A 96 ARG HD3 H 1 2.715 0.020 A 96 ARG CA C 13 56.234 0.100 A 96 ARG CB C 13 30.245 0.100 A 96 ARG CD C 13 42.848 0.100 A 96 ARG N N 15 113.031 0.100 A 97 LYS H H 1 8.467 0.020 A 97 LYS HA H 1 4.634 0.020 A 97 LYS HB2 H 1 2.002 0.020 A 97 LYS HB3 H 1 2.032 0.020 A 97 LYS HD2 H 1 1.491 0.020 A 97 LYS HD3 H 1 1.491 0.020 A 97 LYS HE2 H 1 2.970 0.020 A 97 LYS HE3 H 1 2.970 0.020 A 97 LYS HGx H 1 1.525 0.020 A 97 LYS HGy H 1 1.594 0.020 A 97 LYS CA C 13 54.937 0.100 A 97 LYS CB C 13 34.166 0.100 A 97 LYS CD C 13 29.111 0.100 A 97 LYS CE C 13 42.192 0.100 A 97 LYS CG C 13 24.446 0.100 A 97 LYS N N 15 123.252 0.100 A 98 THR H H 1 8.329 0.020 A 98 THR HA H 1 4.224 0.020 A 98 THR HB H 1 4.054 0.020 A 98 THR HG2% H 1 1.334 0.020 A 98 THR CA C 13 64.670 0.100 A 98 THR CB C 13 69.200 0.100 A 98 THR CG2 C 13 21.880 0.100 A 98 THR N N 15 119.993 0.100 A 99 GLY H H 1 9.273 0.020 A 99 GLY HAx H 1 3.657 0.020 A 99 GLY HAy H 1 4.326 0.020 A 99 GLY CA C 13 45.047 0.100 A 99 GLY N N 15 116.645 0.100 A 100 TYR H H 1 8.457 0.020 A 100 TYR HA H 1 4.704 0.020 A 100 TYR HB2 H 1 3.480 0.020 A 100 TYR HB3 H 1 3.154 0.020 A 100 TYR HD1 H 1 6.958 0.020 A 100 TYR HD2 H 1 6.958 0.020 A 100 TYR HE1 H 1 6.875 0.020 A 100 TYR HE2 H 1 6.875 0.020 A 100 TYR CA C 13 57.697 0.100 A 100 TYR CB C 13 39.413 0.100 A 100 TYR CD1 C 13 133.494 0.100 A 100 TYR CD2 C 13 133.494 0.100 A 100 TYR CE1 C 13 117.871 0.100 A 100 TYR CE2 C 13 117.871 0.100 A 100 TYR N N 15 120.784 0.100 A 101 GLU H H 1 9.836 0.020 A 101 GLU HA H 1 4.601 0.020 A 101 GLU HB2 H 1 2.029 0.020 A 101 GLU HB3 H 1 2.029 0.020 A 101 GLU CA C 13 61.207 0.100 A 101 GLU CB C 13 29.648 0.100 A 101 GLU N N 15 119.482 0.100 A 102 LYS H H 1 8.291 0.020 A 102 LYS HA H 1 4.295 0.020 A 102 LYS HB2 H 1 1.602 0.020 A 102 LYS HB3 H 1 1.925 0.020 A 102 LYS HE2 H 1 2.883 0.020 A 102 LYS HE3 H 1 2.883 0.020 A 102 LYS HGx H 1 1.258 0.020 A 102 LYS HGy H 1 1.292 0.020 A 102 LYS CA C 13 54.207 0.100 A 102 LYS CB C 13 32.489 0.100 A 102 LYS CE C 13 42.098 0.100 A 102 LYS CG C 13 24.919 0.100 A 102 LYS N N 15 115.179 0.100 A 103 LEU H H 1 7.642 0.020 A 103 LEU HA H 1 4.385 0.020 A 103 LEU HBx H 1 1.787 0.020 A 103 LEU HBy H 1 2.040 0.020 A 103 LEU HDx% H 1 1.262 0.020 A 103 LEU HDy% H 1 0.779 0.020 A 103 LEU CA C 13 56.549 0.100 A 103 LEU CB C 13 43.864 0.100 A 103 LEU CDx C 13 24.592 0.100 A 103 LEU CDy C 13 27.395 0.100 A 103 LEU N N 15 119.637 0.100 A 104 CYS H H 1 8.638 0.020 A 104 CYS HA H 1 4.498 0.020 A 104 CYS HB2 H 1 3.405 0.020 A 104 CYS HB3 H 1 3.335 0.020 A 104 CYS CA C 13 58.076 0.100 A 104 CYS CB C 13 32.301 0.100 A 104 CYS N N 15 129.651 0.100 A 105 CYS H H 1 8.158 0.020 A 105 CYS HA H 1 4.806 0.020 A 105 CYS HBx H 1 3.001 0.020 A 105 CYS HBy H 1 3.059 0.020 A 105 CYS CA C 13 58.271 0.100 A 105 CYS CB C 13 32.062 0.100 A 105 CYS N N 15 120.206 0.100 A 106 LEU H H 1 8.466 0.020 A 106 LEU HA H 1 4.054 0.020 A 106 LEU HB2 H 1 1.613 0.020 A 106 LEU HB3 H 1 1.411 0.020 A 106 LEU HDx% H 1 0.562 0.020 A 106 LEU HDy% H 1 0.769 0.020 A 106 LEU HG H 1 1.505 0.020 A 106 LEU CA C 13 56.110 0.100 A 106 LEU CB C 13 41.227 0.100 A 106 LEU CD1 C 13 22.734 0.100 A 106 LEU CDy C 13 25.863 0.100 A 106 LEU CDx C 13 22.734 0.100 A 106 LEU CG C 13 27.311 0.100 A 106 LEU N N 15 115.513 0.100 A 107 ARG H H 1 8.131 0.020 A 107 ARG HA H 1 3.993 0.020 A 107 ARG HB2 H 1 1.955 0.020 A 107 ARG HB3 H 1 1.981 0.020 A 107 ARG HD2 H 1 3.167 0.020 A 107 ARG HD3 H 1 3.167 0.020 A 107 ARG CA C 13 58.311 0.100 A 107 ARG CB C 13 28.965 0.100 A 107 ARG CD C 13 42.841 0.100 A 107 ARG N N 15 122.711 0.100 A 108 CYS H H 1 8.010 0.020 A 108 CYS HA H 1 4.101 0.020 A 108 CYS HB2 H 1 3.061 0.020 A 108 CYS HB3 H 1 2.782 0.020 A 108 CYS CA C 13 63.936 0.100 A 108 CYS CB C 13 30.934 0.100 A 108 CYS N N 15 119.055 0.100 A 109 ILE H H 1 7.105 0.020 A 109 ILE HA H 1 4.684 0.020 A 109 ILE HB H 1 2.474 0.020 A 109 ILE HD1% H 1 0.822 0.020 A 109 ILE HG1x H 1 1.186 0.020 A 109 ILE HG1y H 1 1.427 0.020 A 109 ILE HG2% H 1 1.069 0.020 A 109 ILE CA C 13 60.483 0.100 A 109 ILE CB C 13 38.320 0.100 A 109 ILE CD1 C 13 15.517 0.100 A 109 ILE CG1 C 13 26.511 0.100 A 109 ILE CG2 C 13 20.146 0.100 A 109 ILE N N 15 107.315 0.100 A 110 GLN H H 1 7.156 0.020 A 110 GLN HA H 1 4.268 0.020 A 110 GLN HB2 H 1 2.009 0.020 A 110 GLN HB3 H 1 2.009 0.020 A 110 GLN HE2x H 1 6.821 0.020 A 110 GLN HE2y H 1 7.437 0.020 A 110 GLN HGx H 1 2.366 0.020 A 110 GLN HGy H 1 2.444 0.020 A 110 GLN CA C 13 55.981 0.100 A 110 GLN CB C 13 29.656 0.100 A 110 GLN CG C 13 33.952 0.100 A 110 GLN N N 15 122.468 0.100 A 110 GLN NE2 N 15 111.684 0.100 A 111 LYS H H 1 8.522 0.020 A 111 LYS HA H 1 4.246 0.020 A 111 LYS HB2 H 1 1.692 0.020 A 111 LYS HB3 H 1 1.692 0.020 A 111 LYS HE2 H 1 2.994 0.020 A 111 LYS HE3 H 1 2.994 0.020 A 111 LYS CA C 13 56.546 0.100 A 111 LYS CB C 13 32.846 0.100 A 111 LYS CE C 13 42.191 0.100 A 111 LYS N N 15 124.650 0.100 A 112 ASN H H 1 8.360 0.020 A 112 ASN HA H 1 4.778 0.020 A 112 ASN HB2 H 1 2.953 0.020 A 112 ASN HB3 H 1 2.953 0.020 A 112 ASN HD2x H 1 6.904 0.020 A 112 ASN HD2y H 1 7.668 0.020 A 112 ASN CA C 13 52.902 0.100 A 112 ASN CB C 13 39.328 0.100 A 112 ASN N N 15 120.972 0.100 A 112 ASN ND2 N 15 113.563 0.100 A 113 GLU H H 1 9.023 0.020 A 113 GLU HA H 1 4.248 0.020 A 113 GLU HBx H 1 2.056 0.020 A 113 GLU HBy H 1 2.152 0.020 A 113 GLU HG2 H 1 2.320 0.020 A 113 GLU HG3 H 1 2.320 0.020 A 113 GLU CA C 13 58.611 0.100 A 113 GLU CB C 13 29.590 0.100 A 113 GLU CG C 13 36.333 0.100 A 113 GLU N N 15 121.710 0.100 A 114 THR H H 1 8.112 0.020 A 114 THR HA H 1 4.321 0.020 A 114 THR HB H 1 4.308 0.020 A 114 THR HG2% H 1 1.239 0.020 A 114 THR CA C 13 63.161 0.100 A 114 THR CB C 13 69.481 0.100 A 114 THR CG2 C 13 21.939 0.100 A 114 THR N N 15 112.186 0.100 A 115 ASN H H 1 8.047 0.020 A 115 ASN HA H 1 4.829 0.020 A 115 ASN HBx H 1 2.789 0.020 A 115 ASN HBy H 1 2.903 0.020 A 115 ASN HD2x H 1 6.851 0.020 A 115 ASN HD2y H 1 7.665 0.020 A 115 ASN CA C 13 53.110 0.100 A 115 ASN CB C 13 38.659 0.100 A 115 ASN N N 15 119.112 0.100 A 115 ASN ND2 N 15 112.198 0.100 A 116 ASN H H 1 8.364 0.020 A 116 ASN HA H 1 4.615 0.020 A 116 ASN HBx H 1 2.813 0.020 A 116 ASN HBy H 1 2.989 0.020 A 116 ASN HD2x H 1 6.912 0.020 A 116 ASN HD2y H 1 7.608 0.020 A 116 ASN CA C 13 53.965 0.100 A 116 ASN CB C 13 38.173 0.100 A 116 ASN N N 15 117.175 0.100 A 116 ASN ND2 N 15 112.700 0.100 A 117 GLY H H 1 8.264 0.020 A 117 GLY HAx H 1 3.798 0.020 A 117 GLY HAy H 1 4.056 0.020 A 117 GLY CA C 13 45.882 0.100 A 117 GLY N N 15 107.294 0.100 A 118 SER H H 1 7.905 0.020 A 118 SER HA H 1 4.586 0.020 A 118 SER HB2 H 1 3.920 0.020 A 118 SER HB3 H 1 3.953 0.020 A 118 SER CA C 13 57.974 0.100 A 118 SER CB C 13 64.479 0.100 A 118 SER N N 15 115.475 0.100 A 119 THR H H 1 8.044 0.020 A 119 THR HA H 1 4.450 0.020 A 119 THR HB H 1 4.569 0.020 A 119 THR HG2% H 1 1.196 0.020 A 119 THR CA C 13 61.215 0.100 A 119 THR CB C 13 70.569 0.100 A 119 THR CG2 C 13 22.154 0.100 A 119 THR N N 15 111.360 0.100 A 120 CYS H H 1 8.045 0.020 A 120 CYS HA H 1 4.255 0.020 A 120 CYS HB2 H 1 3.312 0.020 A 120 CYS HB3 H 1 3.155 0.020 A 120 CYS CA C 13 61.469 0.100 A 120 CYS CB C 13 30.892 0.100 A 120 CYS N N 15 122.708 0.100 A 121 ILE H H 1 8.237 0.020 A 121 ILE HA H 1 4.025 0.020 A 121 ILE HB H 1 1.730 0.020 A 121 ILE HD1% H 1 0.827 0.020 A 121 ILE HG1x H 1 0.912 0.020 A 121 ILE HG1y H 1 1.331 0.020 A 121 ILE HG2% H 1 0.601 0.020 A 121 ILE CA C 13 63.353 0.100 A 121 ILE CB C 13 38.222 0.100 A 121 ILE CD1 C 13 13.979 0.100 A 121 ILE CG1 C 13 28.716 0.100 A 121 ILE CG2 C 13 17.753 0.100 A 121 ILE N N 15 132.463 0.100 A 122 CYS H H 1 9.355 0.020 A 122 CYS HA H 1 4.233 0.020 A 122 CYS HB2 H 1 3.844 0.020 A 122 CYS HB3 H 1 2.976 0.020 A 122 CYS CA C 13 60.230 0.100 A 122 CYS CB C 13 30.602 0.100 A 122 CYS N N 15 123.931 0.100 A 123 ARG H H 1 7.677 0.020 A 123 ARG HA H 1 4.150 0.020 A 123 ARG HB2 H 1 1.959 0.020 A 123 ARG HB3 H 1 1.959 0.020 A 123 ARG CA C 13 53.177 0.100 A 123 ARG CB C 13 27.961 0.100 A 123 ARG N N 15 119.561 0.100 A 124 VAL H H 1 7.578 0.020 A 124 VAL HA H 1 4.081 0.020 A 124 VAL HB H 1 2.025 0.020 A 124 VAL HGx% H 1 0.989 0.020 A 124 VAL HGy% H 1 0.949 0.020 A 124 VAL CA C 13 60.647 0.100 A 124 VAL CB C 13 32.857 0.100 A 124 VAL CGx C 13 20.589 0.100 A 124 VAL CGy C 13 22.336 0.100 A 124 VAL N N 15 122.794 0.100 A 125 PRO HA H 1 4.263 0.020 A 125 PRO HBx H 1 1.844 0.020 A 125 PRO HBy H 1 2.437 0.020 A 125 PRO HDx H 1 3.589 0.020 A 125 PRO HDy H 1 4.052 0.020 A 125 PRO HGx H 1 1.895 0.020 A 125 PRO HGy H 1 2.141 0.020 A 125 PRO CA C 13 63.268 0.100 A 125 PRO CB C 13 32.379 0.100 A 125 PRO CD C 13 51.088 0.100 A 125 PRO CG C 13 28.333 0.100 A 126 ARG H H 1 9.534 0.020 A 126 ARG HA H 1 3.912 0.020 A 126 ARG HBx H 1 1.952 0.020 A 126 ARG HBy H 1 2.080 0.020 A 126 ARG HD2 H 1 3.330 0.020 A 126 ARG HD3 H 1 3.330 0.020 A 126 ARG CA C 13 59.653 0.100 A 126 ARG CB C 13 29.339 0.100 A 126 ARG CD C 13 43.057 0.100 A 126 ARG N N 15 128.350 0.100 A 127 ALA H H 1 9.263 0.020 A 127 ALA HA H 1 4.192 0.020 A 127 ALA HB% H 1 1.451 0.020 A 127 ALA CA C 13 55.227 0.100 A 127 ALA CB C 13 18.363 0.100 A 127 ALA N N 15 119.169 0.100 A 128 GLN H H 1 7.448 0.020 A 128 GLN HA H 1 4.209 0.020 A 128 GLN HB2 H 1 2.134 0.020 A 128 GLN HB3 H 1 2.134 0.020 A 128 GLN HE2x H 1 6.786 0.020 A 128 GLN HE2y H 1 7.711 0.020 A 128 GLN HGx H 1 2.295 0.020 A 128 GLN HGy H 1 2.444 0.020 A 128 GLN CA C 13 58.506 0.100 A 128 GLN CB C 13 28.220 0.100 A 128 GLN CG C 13 33.743 0.100 A 128 GLN N N 15 117.345 0.100 A 128 GLN NE2 N 15 111.737 0.100 A 129 LEU H H 1 7.622 0.020 A 129 LEU HA H 1 4.088 0.020 A 129 LEU HB2 H 1 2.036 0.020 A 129 LEU HB3 H 1 1.588 0.020 A 129 LEU HDx% H 1 0.855 0.020 A 129 LEU HDy% H 1 0.929 0.020 A 129 LEU HG H 1 1.628 0.020 A 129 LEU CA C 13 57.952 0.100 A 129 LEU CB C 13 41.817 0.100 A 129 LEU CDx C 13 23.003 0.100 A 129 LEU CDy C 13 26.000 0.100 A 129 LEU CG C 13 26.149 0.100 A 129 LEU N N 15 120.561 0.100 A 130 GLU H H 1 8.656 0.020 A 130 GLU HA H 1 3.956 0.020 A 130 GLU HB2 H 1 2.141 0.020 A 130 GLU HB3 H 1 2.141 0.020 A 130 GLU HGx H 1 2.307 0.020 A 130 GLU HGy H 1 2.500 0.020 A 130 GLU CA C 13 59.353 0.100 A 130 GLU CB C 13 29.337 0.100 A 130 GLU CG C 13 36.659 0.100 A 130 GLU N N 15 119.122 0.100 A 131 GLU H H 1 7.922 0.020 A 131 GLU HA H 1 4.163 0.020 A 131 GLU HBx H 1 2.105 0.020 A 131 GLU HBy H 1 2.222 0.020 A 131 GLU HG2 H 1 2.335 0.020 A 131 GLU HG3 H 1 2.335 0.020 A 131 GLU CA C 13 59.288 0.100 A 131 GLU CB C 13 29.422 0.100 A 131 GLU CG C 13 35.808 0.100 A 131 GLU N N 15 121.469 0.100 A 132 GLU H H 1 8.099 0.020 A 132 GLU HA H 1 3.998 0.020 A 132 GLU HB2 H 1 2.094 0.020 A 132 GLU HB3 H 1 2.094 0.020 A 132 GLU HGx H 1 2.284 0.020 A 132 GLU HGy H 1 2.445 0.020 A 132 GLU CA C 13 59.327 0.100 A 132 GLU CB C 13 29.421 0.100 A 132 GLU CG C 13 36.467 0.100 A 132 GLU N N 15 119.241 0.100 A 133 ALA H H 1 7.795 0.020 A 133 ALA HA H 1 4.053 0.020 A 133 ALA HB% H 1 1.355 0.020 A 133 ALA CA C 13 54.973 0.100 A 133 ALA CB C 13 18.154 0.100 A 133 ALA N N 15 121.302 0.100 A 134 ARG H H 1 8.145 0.020 A 134 ARG HA H 1 4.143 0.020 A 134 ARG HBx H 1 1.981 0.020 A 134 ARG HBy H 1 2.035 0.020 A 134 ARG HD2 H 1 3.283 0.020 A 134 ARG HD3 H 1 3.283 0.020 A 134 ARG CA C 13 59.438 0.100 A 134 ARG CB C 13 30.148 0.100 A 134 ARG CD C 13 43.422 0.100 A 134 ARG N N 15 118.757 0.100 A 135 LYS H H 1 8.036 0.020 A 135 LYS HA H 1 4.073 0.020 A 135 LYS HB2 H 1 1.963 0.020 A 135 LYS HB3 H 1 1.963 0.020 A 135 LYS HE2 H 1 2.977 0.020 A 135 LYS HE3 H 1 2.977 0.020 A 135 LYS HGx H 1 1.493 0.020 A 135 LYS HGy H 1 1.688 0.020 A 135 LYS CA C 13 59.327 0.100 A 135 LYS CB C 13 32.539 0.100 A 135 LYS CE C 13 42.096 0.100 A 135 LYS CG C 13 25.623 0.100 A 135 LYS N N 15 119.496 0.100 A 136 LYS H H 1 7.682 0.020 A 136 LYS HA H 1 4.362 0.020 A 136 LYS HBx H 1 1.882 0.020 A 136 LYS HBy H 1 2.002 0.020 A 136 LYS HE2 H 1 2.982 0.020 A 136 LYS HE3 H 1 2.982 0.020 A 136 LYS HGx H 1 1.494 0.020 A 136 LYS HGy H 1 1.628 0.020 A 136 LYS CA C 13 56.575 0.100 A 136 LYS CB C 13 33.629 0.100 A 136 LYS CE C 13 42.207 0.100 A 136 LYS CG C 13 25.519 0.100 A 136 LYS N N 15 116.645 0.100 A 137 GLY H H 1 8.064 0.020 A 137 GLY HAx H 1 3.960 0.020 A 137 GLY HAy H 1 4.093 0.020 A 137 GLY CA C 13 46.358 0.100 A 137 GLY N N 15 109.349 0.100 A 138 THR H H 1 8.111 0.020 A 138 THR HA H 1 4.735 0.020 A 138 THR HB H 1 4.211 0.020 A 138 THR HG2% H 1 1.155 0.020 A 138 THR CA C 13 59.308 0.100 A 138 THR CB C 13 70.755 0.100 A 138 THR CG2 C 13 20.543 0.100 A 138 THR N N 15 112.870 0.100 A 139 GLN H H 1 8.227 0.020 A 139 GLN HA H 1 4.609 0.020 A 139 GLN HB2 H 1 1.911 0.020 A 139 GLN HB3 H 1 2.102 0.020 A 139 GLN HE2x H 1 6.874 0.020 A 139 GLN HE2y H 1 7.558 0.020 A 139 GLN HG2 H 1 2.366 0.020 A 139 GLN HG3 H 1 2.366 0.020 A 139 GLN CA C 13 54.435 0.100 A 139 GLN CB C 13 30.777 0.100 A 139 GLN CG C 13 33.918 0.100 A 139 GLN N N 15 118.177 0.100 A 139 GLN NE2 N 15 112.824 0.100 A 140 VAL H H 1 8.839 0.020 A 140 VAL HA H 1 3.790 0.020 A 140 VAL HB H 1 2.144 0.020 A 140 VAL HGx% H 1 1.043 0.020 A 140 VAL HGy% H 1 0.935 0.020 A 140 VAL CA C 13 63.934 0.100 A 140 VAL CB C 13 32.154 0.100 A 140 VAL CGx C 13 21.912 0.100 A 140 VAL CGy C 13 22.969 0.100 A 140 VAL N N 15 123.601 0.100 A 141 SER HA H 1 4.524 0.020 A 141 SER HBx H 1 3.794 0.020 A 141 SER HBy H 1 3.944 0.020 A 141 SER CA C 13 57.841 0.100 A 141 SER CB C 13 64.174 0.100 A 142 PHE H H 1 7.534 0.020 A 142 PHE HA H 1 4.458 0.020 A 142 PHE HB2 H 1 2.610 0.020 A 142 PHE HB3 H 1 3.190 0.020 A 142 PHE HD1 H 1 7.060 0.020 A 142 PHE HD2 H 1 7.060 0.020 A 142 PHE HE1 H 1 6.891 0.020 A 142 PHE HE2 H 1 6.891 0.020 A 142 PHE HZ H 1 7.114 0.020 A 142 PHE CA C 13 58.673 0.100 A 142 PHE CB C 13 40.055 0.100 A 142 PHE CD1 C 13 132.069 0.100 A 142 PHE CD2 C 13 132.069 0.100 A 142 PHE CE1 C 13 130.898 0.100 A 142 PHE CE2 C 13 130.898 0.100 A 142 PHE CZ C 13 128.952 0.100 A 142 PHE N N 15 123.726 0.100 A 143 HIS H H 1 8.308 0.020 A 143 HIS HA H 1 4.336 0.020 A 143 HIS HBx H 1 2.880 0.020 A 143 HIS HBy H 1 2.999 0.020 A 143 HIS HD2 H 1 6.997 0.020 A 143 HIS HE1 H 1 7.939 0.020 A 143 HIS CA C 13 56.837 0.100 A 143 HIS CB C 13 31.949 0.100 A 143 HIS CD2 C 13 120.415 0.100 A 143 HIS CE1 C 13 137.908 0.100 A 143 HIS N N 15 126.548 0.100 A 144 GLN H H 1 7.203 0.020 A 144 GLN HA H 1 4.433 0.020 A 144 GLN HBx H 1 1.243 0.020 A 144 GLN HBy H 1 1.441 0.020 A 144 GLN HE2x H 1 7.080 0.020 A 144 GLN HE2y H 1 7.673 0.020 A 144 GLN HGx H 1 1.657 0.020 A 144 GLN HGy H 1 1.862 0.020 A 144 GLN CA C 13 54.210 0.100 A 144 GLN CB C 13 32.925 0.100 A 144 GLN CG C 13 35.009 0.100 A 144 GLN N N 15 115.094 0.100 A 144 GLN NE2 N 15 113.061 0.100 A 145 CYS H H 1 8.668 0.020 A 145 CYS HA H 1 4.961 0.020 A 145 CYS HB2 H 1 3.504 0.020 A 145 CYS HB3 H 1 3.079 0.020 A 145 CYS CA C 13 57.978 0.100 A 145 CYS CB C 13 33.555 0.100 A 145 CYS N N 15 123.088 0.100 A 146 VAL H H 1 8.198 0.020 A 146 VAL HA H 1 4.238 0.020 A 146 VAL HB H 1 2.184 0.020 A 146 VAL HGx% H 1 0.792 0.020 A 146 VAL HGy% H 1 0.839 0.020 A 146 VAL CA C 13 64.001 0.100 A 146 VAL CB C 13 32.157 0.100 A 146 VAL CGx C 13 19.611 0.100 A 146 VAL CGy C 13 20.217 0.100 A 146 VAL N N 15 113.265 0.100 A 147 HIS H H 1 7.151 0.020 A 147 HIS HA H 1 4.604 0.020 A 147 HIS HB2 H 1 3.301 0.020 A 147 HIS HB3 H 1 2.829 0.020 A 147 HIS HD2 H 1 7.939 0.020 A 147 HIS HE1 H 1 7.712 0.020 A 147 HIS CA C 13 58.708 0.100 A 147 HIS CB C 13 32.204 0.100 A 147 HIS CD2 C 13 121.128 0.100 A 147 HIS CE1 C 13 138.749 0.100 A 147 HIS N N 15 120.556 0.100 A 148 CYS H H 1 7.413 0.020 A 148 CYS HA H 1 4.889 0.020 A 148 CYS HB2 H 1 3.211 0.020 A 148 CYS HB3 H 1 2.699 0.020 A 148 CYS CA C 13 57.952 0.100 A 148 CYS CB C 13 32.956 0.100 A 148 CYS N N 15 112.110 0.100 A 149 GLY H H 1 6.949 0.020 A 149 GLY HAx H 1 2.234 0.020 A 149 GLY HAy H 1 2.625 0.020 A 149 GLY CA C 13 45.327 0.100 A 149 GLY N N 15 112.797 0.100 A 150 CYS H H 1 8.240 0.020 A 150 CYS HA H 1 3.932 0.020 A 150 CYS HB2 H 1 3.151 0.020 A 150 CYS HB3 H 1 3.594 0.020 A 150 CYS CA C 13 61.362 0.100 A 150 CYS CB C 13 30.632 0.100 A 150 CYS N N 15 127.277 0.100 A 151 ARG H H 1 8.492 0.020 A 151 ARG HA H 1 4.775 0.020 A 151 ARG HB2 H 1 2.174 0.020 A 151 ARG HB3 H 1 2.174 0.020 A 151 ARG HD2 H 1 3.174 0.020 A 151 ARG HD3 H 1 3.174 0.020 A 151 ARG CA C 13 56.164 0.100 A 151 ARG CB C 13 30.354 0.100 A 151 ARG CD C 13 43.515 0.100 A 151 ARG N N 15 125.476 0.100 A 152 GLY H H 1 9.812 0.020 A 152 GLY HAx H 1 4.470 0.020 A 152 GLY HAy H 1 4.544 0.020 A 152 GLY CA C 13 45.523 0.100 A 152 GLY N N 15 117.275 0.100 A 153 CYS H H 1 8.930 0.020 A 153 CYS HA H 1 4.842 0.020 A 153 CYS HB2 H 1 3.589 0.020 A 153 CYS HB3 H 1 2.396 0.020 A 153 CYS CA C 13 57.130 0.100 A 153 CYS CB C 13 31.368 0.100 A 153 CYS N N 15 126.187 0.100 A 154 ALA H H 1 8.616 0.020 A 154 ALA HA H 1 4.159 0.020 A 154 ALA HB% H 1 1.276 0.020 A 154 ALA CA C 13 53.187 0.100 A 154 ALA CB C 13 18.937 0.100 A 154 ALA N N 15 125.869 0.100 A 155 SER H H 1 9.358 0.020 A 155 SER HA H 1 4.283 0.020 A 155 SER HB2 H 1 3.975 0.020 A 155 SER HB3 H 1 3.950 0.020 A 155 SER CA C 13 60.136 0.100 A 155 SER CB C 13 63.575 0.100 A 155 SER N N 15 116.724 0.100 A 156 THR H H 1 7.638 0.020 A 156 THR HA H 1 4.358 0.020 A 156 THR HB H 1 4.353 0.020 A 156 THR HG2% H 1 1.192 0.020 A 156 THR CA C 13 61.264 0.100 A 156 THR CB C 13 69.999 0.100 A 156 THR CG2 C 13 21.525 0.100 A 156 THR N N 15 111.893 0.100 A 157 ASP H H 1 7.734 0.020 A 157 ASP HA H 1 4.487 0.020 A 157 ASP HB2 H 1 2.523 0.020 A 157 ASP HB3 H 1 2.756 0.020 A 157 ASP CA C 13 56.127 0.100 A 157 ASP CB C 13 42.287 0.100 A 157 ASP N N 15 127.814 0.100 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 2 PRO HA A 2 PRO HBx 1.0 0.0 5.0 2 1 A 2 PRO HA A 2 PRO HBy 1.0 0.0 5.0 3 2 A 2 PRO HA A 2 PRO HG2 1.0 0.0 5.0 4 2 A 2 PRO HA A 2 PRO HG3 1.0 0.0 5.0 5 3 A 2 PRO HBx A 2 PRO HDx 1.0 0.0 5.0 6 3 A 2 PRO HDy A 2 PRO HBx 1.0 0.0 5.0 7 3 A 2 PRO HBy A 2 PRO HDy 1.0 0.0 5.0 8 3 A 2 PRO HBy A 2 PRO HDx 1.0 0.0 5.0 9 4 A 2 PRO HDx A 2 PRO HG2 1.0 0.0 5.0 10 4 A 2 PRO HDy A 2 PRO HG2 1.0 0.0 5.0 11 4 A 2 PRO HG3 A 2 PRO HDx 1.0 0.0 5.0 12 4 A 2 PRO HG3 A 2 PRO HDy 1.0 0.0 5.0 13 5 A 2 PRO HA A 3 ARG H 1.0 0.0 3.5 14 6 A 3 ARG HA A 3 ARG HBx 1.0 0.0 5.0 15 6 A 3 ARG HA A 3 ARG HBy 1.0 0.0 5.0 16 7 A 3 ARG HA A 4 ILE H 1.0 0.0 3.5 17 8 A 4 ILE H A 4 ILE HA 1.0 0.0 5.0 18 9 A 4 ILE HA A 4 ILE HB 1.0 0.0 5.0 19 10 A 4 ILE HA A 4 ILE HG1x 1.0 0.0 5.0 20 10 A 4 ILE HA A 4 ILE HG1y 1.0 0.0 5.0 21 11 A 4 ILE HA A 4 ILE HG2% 1.0 0.0 5.0 22 12 A 4 ILE HA A 4 ILE HD1% 1.0 0.0 5.0 23 13 A 4 ILE HB A 4 ILE HG1x 1.0 0.0 5.0 24 13 A 4 ILE HB A 4 ILE HG1y 1.0 0.0 5.0 25 14 A 4 ILE HB A 4 ILE HG2% 1.0 0.0 5.0 26 15 A 4 ILE HB A 4 ILE HD1% 1.0 0.0 5.0 27 16 A 4 ILE HD1% A 4 ILE HG1x 1.0 0.0 5.0 28 16 A 4 ILE HG1y A 4 ILE HD1% 1.0 0.0 5.0 29 17 A 4 ILE HA A 5 LYS H 1.0 0.0 3.5 30 18 A 6 THR H A 6 THR HG2% 1.0 0.0 5.0 31 19 A 6 THR HA A 6 THR HB 1.0 0.0 5.0 32 20 A 6 THR HG2% A 6 THR HA 1.0 0.0 5.0 33 21 A 6 THR HG2% A 6 THR HB 1.0 0.0 5.0 34 22 A 7 ARG HA A 7 ARG HDx 1.0 0.0 5.0 35 22 A 7 ARG HA A 7 ARG HDy 1.0 0.0 5.0 36 23 A 8 ARG HA A 8 ARG HDx 1.0 0.0 5.0 37 23 A 8 ARG HA A 8 ARG HDy 1.0 0.0 5.0 38 24 A 9 SER HA A 9 SER HBx 1.0 0.0 5.0 39 24 A 9 SER HA A 9 SER HBy 1.0 0.0 5.0 40 25 A 10 LYS HA A 11 PRO HG2 1.0 0.0 5.0 41 25 A 10 LYS HA A 11 PRO HG3 1.0 0.0 5.0 42 26 A 10 LYS HA A 11 PRO HDx 1.0 0.0 2.3 43 26 A 10 LYS HA A 11 PRO HDy 1.0 0.0 2.3 44 27 A 11 PRO HA A 11 PRO HDx 1.0 0.0 5.0 45 27 A 11 PRO HDy A 11 PRO HA 1.0 0.0 5.0 46 28 A 11 PRO HBx A 11 PRO HDx 1.0 0.0 5.0 47 28 A 11 PRO HBy A 11 PRO HDx 1.0 0.0 5.0 48 28 A 11 PRO HDy A 11 PRO HBx 1.0 0.0 5.0 49 28 A 11 PRO HDy A 11 PRO HBy 1.0 0.0 5.0 50 29 A 11 PRO HDx A 11 PRO HG2 1.0 0.0 5.0 51 29 A 11 PRO HG3 A 11 PRO HDx 1.0 0.0 5.0 52 29 A 11 PRO HG3 A 11 PRO HDy 1.0 0.0 5.0 53 29 A 11 PRO HDy A 11 PRO HG2 1.0 0.0 5.0 54 30 A 11 PRO HA A 12 ALA H 1.0 0.0 2.3 55 31 A 12 ALA H A 11 PRO HBx 1.0 0.0 2.8 56 31 A 11 PRO HBy A 12 ALA H 1.0 0.0 2.8 57 32 A 12 ALA H A 11 PRO HG2 1.0 0.0 5.0 58 32 A 11 PRO HG3 A 12 ALA H 1.0 0.0 5.0 59 33 A 12 ALA H A 12 ALA HA 1.0 0.0 3.5 60 34 A 12 ALA H A 12 ALA HB% 1.0 0.0 2.8 61 35 A 12 ALA HA A 13 PRO HDx 1.0 0.0 2.3 62 35 A 12 ALA HA A 13 PRO HDy 1.0 0.0 2.3 63 36 A 12 ALA HB% A 13 PRO HDx 1.0 0.0 2.8 64 36 A 12 ALA HB% A 13 PRO HDy 1.0 0.0 2.8 65 37 A 12 ALA HB% A 16 PHE H 1.0 0.0 5.0 66 38 A 12 ALA HB% A 16 PHE HA 1.0 0.0 5.0 67 39 A 12 ALA HB% A 16 PHE HB3 1.0 0.0 2.8 68 39 A 12 ALA HB% A 16 PHE HB2 1.0 0.0 2.8 69 40 A 12 ALA HB% A 16 PHE HD% 1.0 0.0 2.8 70 41 A 12 ALA HA A 77 LEU HDx% 1.0 0.0 3.5 71 41 A 12 ALA HA A 77 LEU HDy% 1.0 0.0 3.5 72 42 A 12 ALA HB% A 77 LEU HA 1.0 0.0 5.0 73 43 A 12 ALA HB% A 77 LEU HDx% 1.0 0.0 3.5 74 43 A 12 ALA HB% A 77 LEU HDy% 1.0 0.0 3.5 75 44 A 12 ALA HB% A 80 TRP HE1 1.0 0.0 5.0 76 45 A 12 ALA HB% A 80 TRP HE3 1.0 0.0 2.8 77 46 A 12 ALA HB% A 80 TRP HZ2 1.0 0.0 2.8 78 47 A 12 ALA HB% A 80 TRP HZ3 1.0 0.0 2.8 79 48 A 12 ALA HB% A 80 TRP HH2 1.0 0.0 2.8 80 49 A 13 PRO HA A 13 PRO HBx 1.0 0.0 5.0 81 49 A 13 PRO HA A 13 PRO HBy 1.0 0.0 5.0 82 50 A 13 PRO HA A 13 PRO HGx 1.0 0.0 5.0 83 50 A 13 PRO HA A 13 PRO HGy 1.0 0.0 5.0 84 51 A 13 PRO HDx A 13 PRO HGx 1.0 0.0 5.0 85 51 A 13 PRO HGy A 13 PRO HDx 1.0 0.0 5.0 86 51 A 13 PRO HDy A 13 PRO HGy 1.0 0.0 5.0 87 51 A 13 PRO HDy A 13 PRO HGx 1.0 0.0 5.0 88 52 A 13 PRO HA A 14 ASP H 1.0 0.0 2.3 89 53 A 13 PRO HA A 14 ASP HBx 1.0 0.0 5.0 90 53 A 13 PRO HA A 14 ASP HBy 1.0 0.0 5.0 91 54 A 14 ASP H A 13 PRO HBx 1.0 0.0 5.0 92 54 A 13 PRO HBy A 14 ASP H 1.0 0.0 5.0 93 55 A 14 ASP H A 13 PRO HGx 1.0 0.0 5.0 94 55 A 13 PRO HGy A 14 ASP H 1.0 0.0 5.0 95 56 A 13 PRO HBx A 77 LEU HDx% 1.0 0.0 5.0 96 56 A 13 PRO HBy A 77 LEU HDx% 1.0 0.0 5.0 97 56 A 77 LEU HDy% A 13 PRO HBx 1.0 0.0 5.0 98 56 A 77 LEU HDy% A 13 PRO HBy 1.0 0.0 5.0 99 57 A 13 PRO HGy A 77 LEU HDx% 1.0 0.0 3.5 100 57 A 13 PRO HGx A 77 LEU HDx% 1.0 0.0 3.5 101 57 A 77 LEU HDy% A 13 PRO HGx 1.0 0.0 3.5 102 57 A 77 LEU HDy% A 13 PRO HGy 1.0 0.0 3.5 103 58 A 13 PRO HDx A 77 LEU HDx% 1.0 0.0 2.8 104 58 A 13 PRO HDy A 77 LEU HDx% 1.0 0.0 2.8 105 58 A 77 LEU HDy% A 13 PRO HDx 1.0 0.0 2.8 106 58 A 13 PRO HDy A 77 LEU HDy% 1.0 0.0 2.8 107 59 A 14 ASP H A 14 ASP HBx 1.0 0.0 3.5 108 59 A 14 ASP H A 14 ASP HBy 1.0 0.0 3.5 109 60 A 14 ASP HA A 14 ASP HBx 1.0 0.0 5.0 110 60 A 14 ASP HBy A 14 ASP HA 1.0 0.0 5.0 111 61 A 14 ASP H A 15 GLY H 1.0 0.0 3.5 112 62 A 14 ASP HA A 15 GLY H 1.0 0.0 3.5 113 63 A 15 GLY H A 14 ASP HBx 1.0 0.0 5.0 114 63 A 14 ASP HBy A 15 GLY H 1.0 0.0 5.0 115 64 A 16 PHE H A 14 ASP H 1.0 0.0 5.0 116 65 A 16 PHE H A 15 GLY H 1.0 0.0 3.5 117 66 A 17 GLU H A 15 GLY HAx 1.0 0.0 5.0 118 66 A 15 GLY HAy A 17 GLU H 1.0 0.0 5.0 119 67 A 18 LYS H A 15 GLY HAx 1.0 0.0 3.5 120 67 A 15 GLY HAy A 18 LYS H 1.0 0.0 3.5 121 68 A 15 GLY HAy A 77 LEU HDx% 1.0 0.0 2.8 122 68 A 15 GLY HAx A 77 LEU HDx% 1.0 0.0 2.8 123 68 A 77 LEU HDy% A 15 GLY HAx 1.0 0.0 2.8 124 68 A 77 LEU HDy% A 15 GLY HAy 1.0 0.0 2.8 125 69 A 16 PHE H A 16 PHE HA 1.0 0.0 5.0 126 70 A 16 PHE H A 16 PHE HB3 1.0 0.0 2.8 127 71 A 16 PHE H A 16 PHE HB2 1.0 0.0 2.8 128 72 A 16 PHE H A 16 PHE HD% 1.0 0.0 5.0 129 73 A 16 PHE HA A 16 PHE HB2 1.0 0.0 2.8 130 74 A 16 PHE HA A 16 PHE HD% 1.0 0.0 5.0 131 75 A 16 PHE HD% A 16 PHE HB3 1.0 0.0 5.0 132 75 A 16 PHE HB2 A 16 PHE HD% 1.0 0.0 5.0 133 76 A 16 PHE HD% A 16 PHE HE% 1.0 0.0 5.0 134 77 A 16 PHE HE% A 16 PHE HZ 1.0 0.0 5.0 135 78 A 16 PHE H A 17 GLU H 1.0 0.0 2.8 136 79 A 16 PHE HA A 17 GLU H 1.0 0.0 3.5 137 80 A 17 GLU HA A 16 PHE HB3 1.0 0.0 5.0 138 80 A 16 PHE HB2 A 17 GLU HA 1.0 0.0 5.0 139 81 A 16 PHE HD% A 17 GLU HA 1.0 0.0 5.0 140 82 A 16 PHE H A 18 LYS H 1.0 0.0 5.0 141 83 A 16 PHE HA A 18 LYS H 1.0 0.0 5.0 142 84 A 16 PHE HA A 19 ILE HG1x 1.0 0.0 5.0 143 84 A 16 PHE HA A 19 ILE HG1y 1.0 0.0 5.0 144 85 A 16 PHE HA A 19 ILE HG2% 1.0 0.0 5.0 145 86 A 16 PHE HA A 19 ILE HD1% 1.0 0.0 5.0 146 87 A 19 ILE HD1% A 16 PHE HB3 1.0 0.0 5.0 147 87 A 16 PHE HB2 A 19 ILE HD1% 1.0 0.0 5.0 148 88 A 16 PHE HD% A 19 ILE HB 1.0 0.0 5.0 149 89 A 16 PHE HD% A 19 ILE HG2% 1.0 0.0 5.0 150 90 A 16 PHE HD% A 19 ILE HD1% 1.0 0.0 5.0 151 91 A 16 PHE HE% A 19 ILE HD1% 1.0 0.0 5.0 152 92 A 16 PHE HZ A 19 ILE HD1% 1.0 0.0 5.0 153 93 A 16 PHE HD% A 23 LEU HDx% 1.0 0.0 3.5 154 93 A 16 PHE HD% A 23 LEU HDy% 1.0 0.0 3.5 155 94 A 16 PHE HE% A 23 LEU HDx% 1.0 0.0 2.8 156 94 A 16 PHE HE% A 23 LEU HDy% 1.0 0.0 2.8 157 95 A 16 PHE HZ A 23 LEU HDx% 1.0 0.0 2.8 158 95 A 16 PHE HZ A 23 LEU HDy% 1.0 0.0 2.8 159 96 A 16 PHE H A 77 LEU HDx% 1.0 0.0 3.5 160 96 A 16 PHE H A 77 LEU HDy% 1.0 0.0 3.5 161 97 A 16 PHE HB2 A 77 LEU HDx% 1.0 0.0 2.8 162 97 A 16 PHE HB3 A 77 LEU HDx% 1.0 0.0 2.8 163 97 A 77 LEU HDy% A 16 PHE HB3 1.0 0.0 2.8 164 97 A 16 PHE HB2 A 77 LEU HDy% 1.0 0.0 2.8 165 98 A 16 PHE HD% A 77 LEU HDx% 1.0 0.0 2.8 166 98 A 16 PHE HD% A 77 LEU HDy% 1.0 0.0 2.8 167 99 A 16 PHE HD% A 81 LEU HDx% 1.0 0.0 3.5 168 99 A 16 PHE HD% A 81 LEU HDy% 1.0 0.0 3.5 169 100 A 17 GLU H A 17 GLU HB3 1.0 0.0 2.8 170 101 A 17 GLU H A 17 GLU HB2 1.0 0.0 2.8 171 102 A 17 GLU H A 17 GLU HB3 1.0 0.0 5.0 172 102 A 17 GLU H A 17 GLU HB2 1.0 0.0 5.0 173 103 A 17 GLU H A 17 GLU HG2 1.0 0.0 5.0 174 103 A 17 GLU H A 17 GLU HG3 1.0 0.0 5.0 175 104 A 17 GLU HA A 17 GLU HB2 1.0 0.0 2.8 176 105 A 17 GLU H A 18 LYS H 1.0 0.0 2.8 177 106 A 18 LYS H A 17 GLU HA 1.0 0.0 3.5 178 107 A 18 LYS H A 17 GLU HB3 1.0 0.0 5.0 179 107 A 18 LYS H A 17 GLU HB2 1.0 0.0 5.0 180 108 A 17 GLU HA A 19 ILE H 1.0 0.0 5.0 181 109 A 17 GLU HA A 20 LYS H 1.0 0.0 3.5 182 110 A 18 LYS H A 18 LYS HB2 1.0 0.0 2.8 183 111 A 18 LYS H A 18 LYS HB3 1.0 0.0 5.0 184 111 A 18 LYS H A 18 LYS HB2 1.0 0.0 5.0 185 112 A 18 LYS H A 18 LYS HGx 1.0 0.0 5.0 186 112 A 18 LYS H A 18 LYS HGy 1.0 0.0 5.0 187 113 A 18 LYS HA A 18 LYS HB3 1.0 0.0 2.8 188 114 A 18 LYS HA A 18 LYS HB3 1.0 0.0 5.0 189 114 A 18 LYS HB2 A 18 LYS HA 1.0 0.0 5.0 190 115 A 18 LYS HA A 18 LYS HGx 1.0 0.0 5.0 191 115 A 18 LYS HGy A 18 LYS HA 1.0 0.0 5.0 192 116 A 18 LYS HDy A 18 LYS HGx 1.0 0.0 5.0 193 116 A 18 LYS HGy A 18 LYS HDx 1.0 0.0 5.0 194 116 A 18 LYS HGy A 18 LYS HDy 1.0 0.0 5.0 195 116 A 18 LYS HDx A 18 LYS HGx 1.0 0.0 5.0 196 117 A 18 LYS H A 19 ILE H 1.0 0.0 2.8 197 118 A 19 ILE H A 18 LYS HA 1.0 0.0 3.5 198 119 A 19 ILE H A 18 LYS HB3 1.0 0.0 5.0 199 119 A 19 ILE H A 18 LYS HB2 1.0 0.0 5.0 200 120 A 18 LYS H A 20 LYS H 1.0 0.0 5.0 201 121 A 20 LYS H A 18 LYS HA 1.0 0.0 5.0 202 122 A 20 LYS H A 18 LYS HB3 1.0 0.0 5.0 203 122 A 20 LYS H A 18 LYS HB2 1.0 0.0 5.0 204 123 A 18 LYS H A 77 LEU HDx% 1.0 0.0 5.0 205 123 A 77 LEU HDy% A 18 LYS H 1.0 0.0 5.0 206 124 A 19 ILE HB A 19 ILE HA 1.0 0.0 5.0 207 125 A 19 ILE HG2% A 19 ILE HA 1.0 0.0 5.0 208 126 A 19 ILE HD1% A 19 ILE HA 1.0 0.0 5.0 209 127 A 19 ILE HG2% A 19 ILE HB 1.0 0.0 5.0 210 128 A 19 ILE HD1% A 19 ILE HB 1.0 0.0 5.0 211 129 A 19 ILE HD1% A 19 ILE HG1x 1.0 0.0 5.0 212 129 A 19 ILE HG1y A 19 ILE HD1% 1.0 0.0 5.0 213 130 A 19 ILE HG2% A 19 ILE HD1% 1.0 0.0 5.0 214 131 A 19 ILE H A 20 LYS H 1.0 0.0 2.8 215 132 A 20 LYS H A 19 ILE HA 1.0 0.0 3.5 216 133 A 19 ILE HB A 22 THR HG2% 1.0 0.0 5.0 217 134 A 19 ILE HD1% A 23 LEU HG 1.0 0.0 5.0 218 135 A 19 ILE HD1% A 23 LEU HDx% 1.0 0.0 5.0 219 135 A 19 ILE HD1% A 23 LEU HDy% 1.0 0.0 5.0 220 136 A 19 ILE HB A 62 TYR HD% 1.0 0.0 5.0 221 137 A 19 ILE HB A 62 TYR HE% 1.0 0.0 2.8 222 138 A 19 ILE HG2% A 62 TYR HD% 1.0 0.0 5.0 223 139 A 19 ILE HG2% A 62 TYR HE% 1.0 0.0 2.8 224 140 A 19 ILE HD1% A 62 TYR HD% 1.0 0.0 3.5 225 141 A 19 ILE HD1% A 62 TYR HE% 1.0 0.0 2.3 226 142 A 19 ILE HD1% A 63 ILE HG2% 1.0 0.0 5.0 227 143 A 19 ILE HB A 66 LEU HDx% 1.0 0.0 3.5 228 143 A 19 ILE HB A 66 LEU HDy% 1.0 0.0 3.5 229 144 A 19 ILE HG1y A 66 LEU HDx% 1.0 0.0 3.5 230 144 A 19 ILE HG1x A 66 LEU HDx% 1.0 0.0 3.5 231 144 A 66 LEU HDy% A 19 ILE HG1x 1.0 0.0 3.5 232 144 A 19 ILE HG1y A 66 LEU HDy% 1.0 0.0 3.5 233 145 A 19 ILE HG2% A 66 LEU HDx% 1.0 0.0 2.3 234 145 A 19 ILE HG2% A 66 LEU HDy% 1.0 0.0 2.3 235 146 A 19 ILE HD1% A 66 LEU HDx% 1.0 0.0 2.8 236 146 A 19 ILE HD1% A 66 LEU HDy% 1.0 0.0 2.8 237 147 A 19 ILE H A 77 LEU HDx% 1.0 0.0 5.0 238 147 A 77 LEU HDy% A 19 ILE H 1.0 0.0 5.0 239 148 A 19 ILE HG1x A 77 LEU HDx% 1.0 0.0 3.5 240 148 A 19 ILE HG1y A 77 LEU HDx% 1.0 0.0 3.5 241 148 A 77 LEU HDy% A 19 ILE HG1x 1.0 0.0 3.5 242 148 A 77 LEU HDy% A 19 ILE HG1y 1.0 0.0 3.5 243 149 A 19 ILE HG2% A 77 LEU HDx% 1.0 0.0 3.5 244 149 A 77 LEU HDy% A 19 ILE HG2% 1.0 0.0 3.5 245 150 A 19 ILE HD1% A 77 LEU HDx% 1.0 0.0 2.8 246 150 A 77 LEU HDy% A 19 ILE HD1% 1.0 0.0 2.8 247 151 A 19 ILE HD1% A 81 LEU HDx% 1.0 0.0 2.8 248 152 A 19 ILE HD1% A 86 TYR HD% 1.0 0.0 5.0 249 153 A 19 ILE HD1% A 86 TYR HE% 1.0 0.0 3.5 250 154 A 20 LYS H A 20 LYS HB3 1.0 0.0 2.8 251 155 A 20 LYS H A 20 LYS HB2 1.0 0.0 2.8 252 156 A 20 LYS HB2 A 20 LYS HA 1.0 0.0 2.8 253 157 A 20 LYS H A 22 THR H 1.0 0.0 5.0 254 158 A 20 LYS HA A 23 LEU H 1.0 0.0 5.0 255 159 A 20 LYS HA A 23 LEU HB3 1.0 0.0 3.5 256 159 A 20 LYS HA A 23 LEU HB2 1.0 0.0 3.5 257 160 A 20 LYS HA A 23 LEU HDx% 1.0 0.0 3.5 258 160 A 23 LEU HDy% A 20 LYS HA 1.0 0.0 3.5 259 161 A 24 THR HG2% A 20 LYS HE2 1.0 0.0 3.5 260 161 A 20 LYS HE3 A 24 THR HG2% 1.0 0.0 3.5 261 162 A 21 PRO HA A 21 PRO HBx 1.0 0.0 5.0 262 162 A 21 PRO HA A 21 PRO HBy 1.0 0.0 5.0 263 163 A 22 THR H A 21 PRO HA 1.0 0.0 5.0 264 164 A 23 LEU H A 21 PRO HA 1.0 0.0 5.0 265 165 A 21 PRO HA A 24 THR H 1.0 0.0 3.5 266 166 A 21 PRO HA A 24 THR HB 1.0 0.0 3.5 267 167 A 24 THR HG2% A 21 PRO HA 1.0 0.0 5.0 268 168 A 22 THR H A 22 THR HA 1.0 0.0 5.0 269 169 A 22 THR H A 22 THR HB 1.0 0.0 5.0 270 170 A 22 THR HG2% A 22 THR H 1.0 0.0 5.0 271 171 A 22 THR HA A 22 THR HB 1.0 0.0 5.0 272 172 A 22 THR HG2% A 22 THR HA 1.0 0.0 5.0 273 173 A 22 THR HG2% A 22 THR HB 1.0 0.0 5.0 274 174 A 22 THR H A 23 LEU H 1.0 0.0 2.8 275 175 A 23 LEU H A 22 THR HA 1.0 0.0 3.5 276 176 A 23 LEU H A 22 THR HB 1.0 0.0 5.0 277 177 A 22 THR HG2% A 23 LEU H 1.0 0.0 3.5 278 178 A 22 THR HG2% A 23 LEU HDx% 1.0 0.0 5.0 279 178 A 23 LEU HDy% A 22 THR HG2% 1.0 0.0 5.0 280 179 A 22 THR H A 24 THR H 1.0 0.0 5.0 281 180 A 24 THR H A 22 THR HA 1.0 0.0 5.0 282 181 A 22 THR HA A 25 ASP H 1.0 0.0 3.5 283 182 A 22 THR HA A 25 ASP HBx 1.0 0.0 3.5 284 182 A 22 THR HA A 25 ASP HBy 1.0 0.0 3.5 285 183 A 22 THR HG2% A 25 ASP HBx 1.0 0.0 3.5 286 183 A 22 THR HG2% A 25 ASP HBy 1.0 0.0 3.5 287 184 A 22 THR HG2% A 26 PHE HD% 1.0 0.0 5.0 288 185 A 22 THR HG2% A 26 PHE HE% 1.0 0.0 5.0 289 186 A 22 THR HG2% A 26 PHE HZ 1.0 0.0 5.0 290 187 A 22 THR HG2% A 62 TYR HD% 1.0 0.0 2.8 291 188 A 22 THR HG2% A 62 TYR HE% 1.0 0.0 2.3 292 189 A 23 LEU H A 23 LEU HB2 1.0 0.0 2.8 293 190 A 23 LEU H A 23 LEU HDx% 1.0 0.0 5.0 294 190 A 23 LEU HDy% A 23 LEU H 1.0 0.0 5.0 295 191 A 23 LEU HA A 23 LEU HB3 1.0 0.0 2.8 296 192 A 23 LEU HA A 23 LEU HDx% 1.0 0.0 5.0 297 192 A 23 LEU HDy% A 23 LEU HA 1.0 0.0 5.0 298 193 A 23 LEU HB3 A 23 LEU HDx% 1.0 0.0 5.0 299 193 A 23 LEU HB2 A 23 LEU HDx% 1.0 0.0 5.0 300 193 A 23 LEU HDy% A 23 LEU HB3 1.0 0.0 5.0 301 193 A 23 LEU HDy% A 23 LEU HB2 1.0 0.0 5.0 302 194 A 23 LEU HG A 23 LEU HDx% 1.0 0.0 5.0 303 194 A 23 LEU HDy% A 23 LEU HG 1.0 0.0 5.0 304 195 A 23 LEU H A 24 THR H 1.0 0.0 2.8 305 196 A 24 THR H A 23 LEU HDx% 1.0 0.0 5.0 306 196 A 23 LEU HDy% A 24 THR H 1.0 0.0 5.0 307 197 A 23 LEU H A 25 ASP H 1.0 0.0 5.0 308 198 A 23 LEU HA A 26 PHE H 1.0 0.0 3.5 309 199 A 26 PHE HD% A 23 LEU HDx% 1.0 0.0 5.0 310 199 A 23 LEU HDy% A 26 PHE HD% 1.0 0.0 5.0 311 200 A 62 TYR HD% A 23 LEU HDx% 1.0 0.0 5.0 312 200 A 23 LEU HDy% A 62 TYR HD% 1.0 0.0 5.0 313 201 A 62 TYR HE% A 23 LEU HDx% 1.0 0.0 3.5 314 201 A 23 LEU HDy% A 62 TYR HE% 1.0 0.0 3.5 315 202 A 63 ILE HD1% A 23 LEU HDx% 1.0 0.0 3.5 316 202 A 23 LEU HDy% A 63 ILE HD1% 1.0 0.0 3.5 317 203 A 23 LEU HDx% A 81 LEU HDx% 1.0 0.0 2.8 318 203 A 23 LEU HDy% A 81 LEU HDx% 1.0 0.0 2.8 319 203 A 81 LEU HDy% A 23 LEU HDx% 1.0 0.0 2.8 320 203 A 23 LEU HDy% A 81 LEU HDy% 1.0 0.0 2.8 321 204 A 23 LEU HDy% A 86 TYR HB2 1.0 0.0 3.5 322 204 A 23 LEU HDx% A 86 TYR HB2 1.0 0.0 3.5 323 204 A 86 TYR HB3 A 23 LEU HDx% 1.0 0.0 3.5 324 204 A 23 LEU HDy% A 86 TYR HB3 1.0 0.0 3.5 325 205 A 86 TYR HD% A 23 LEU HDx% 1.0 0.0 2.8 326 205 A 23 LEU HDy% A 86 TYR HD% 1.0 0.0 2.8 327 206 A 86 TYR HE% A 23 LEU HDx% 1.0 0.0 2.8 328 206 A 23 LEU HDy% A 86 TYR HE% 1.0 0.0 2.8 329 207 A 24 THR H A 24 THR HA 1.0 0.0 5.0 330 208 A 24 THR H A 24 THR HB 1.0 0.0 5.0 331 209 A 24 THR HG2% A 24 THR H 1.0 0.0 5.0 332 210 A 24 THR HB A 24 THR HA 1.0 0.0 5.0 333 211 A 24 THR HG2% A 24 THR HA 1.0 0.0 5.0 334 212 A 24 THR HG2% A 24 THR HB 1.0 0.0 5.0 335 213 A 24 THR H A 25 ASP H 1.0 0.0 2.8 336 214 A 25 ASP H A 24 THR HA 1.0 0.0 3.5 337 215 A 24 THR HB A 25 ASP H 1.0 0.0 5.0 338 216 A 24 THR HG2% A 25 ASP H 1.0 0.0 5.0 339 217 A 24 THR H A 26 PHE H 1.0 0.0 5.0 340 218 A 26 PHE H A 24 THR HA 1.0 0.0 5.0 341 219 A 24 THR HA A 27 GLU H 1.0 0.0 3.5 342 220 A 24 THR HA A 27 GLU HB2 1.0 0.0 3.5 343 220 A 24 THR HA A 27 GLU HB3 1.0 0.0 3.5 344 221 A 24 THR HA A 27 GLU HG2 1.0 0.0 3.5 345 221 A 24 THR HA A 27 GLU HG3 1.0 0.0 3.5 346 222 A 24 THR HG2% A 27 GLU HB2 1.0 0.0 3.5 347 222 A 24 THR HG2% A 27 GLU HB3 1.0 0.0 3.5 348 223 A 24 THR HG2% A 27 GLU HG2 1.0 0.0 3.5 349 223 A 24 THR HG2% A 27 GLU HG3 1.0 0.0 3.5 350 224 A 24 THR HA A 28 ILE HD1% 1.0 0.0 5.0 351 225 A 24 THR HB A 28 ILE HD1% 1.0 0.0 5.0 352 226 A 24 THR HG2% A 28 ILE HG1x 1.0 0.0 5.0 353 226 A 24 THR HG2% A 28 ILE HG1y 1.0 0.0 5.0 354 227 A 24 THR HG2% A 28 ILE HD1% 1.0 0.0 5.0 355 228 A 25 ASP H A 25 ASP HA 1.0 0.0 5.0 356 229 A 25 ASP H A 25 ASP HBx 1.0 0.0 5.0 357 229 A 25 ASP H A 25 ASP HBy 1.0 0.0 5.0 358 230 A 25 ASP H A 26 PHE H 1.0 0.0 2.8 359 231 A 26 PHE H A 25 ASP HA 1.0 0.0 5.0 360 232 A 26 PHE H A 25 ASP HBx 1.0 0.0 3.5 361 232 A 25 ASP HBy A 26 PHE H 1.0 0.0 3.5 362 233 A 25 ASP H A 27 GLU H 1.0 0.0 5.0 363 234 A 25 ASP HA A 28 ILE H 1.0 0.0 3.5 364 235 A 28 ILE HD1% A 25 ASP HA 1.0 0.0 3.5 365 236 A 28 ILE HD1% A 25 ASP HBx 1.0 0.0 5.0 366 236 A 25 ASP HBy A 28 ILE HD1% 1.0 0.0 5.0 367 237 A 26 PHE H A 26 PHE HA 1.0 0.0 5.0 368 238 A 26 PHE H A 26 PHE HB2 1.0 0.0 2.8 369 239 A 26 PHE HD% A 26 PHE H 1.0 0.0 5.0 370 240 A 26 PHE HE% A 26 PHE H 1.0 0.0 5.0 371 241 A 26 PHE HA A 26 PHE HB3 1.0 0.0 2.8 372 242 A 26 PHE HA A 26 PHE HB3 1.0 0.0 5.0 373 242 A 26 PHE HA A 26 PHE HB2 1.0 0.0 5.0 374 243 A 26 PHE HD% A 26 PHE HA 1.0 0.0 5.0 375 244 A 26 PHE HD% A 26 PHE HB3 1.0 0.0 5.0 376 244 A 26 PHE HD% A 26 PHE HB2 1.0 0.0 5.0 377 245 A 26 PHE H A 27 GLU H 1.0 0.0 2.8 378 246 A 27 GLU H A 26 PHE HA 1.0 0.0 5.0 379 247 A 27 GLU H A 26 PHE HB3 1.0 0.0 5.0 380 247 A 27 GLU H A 26 PHE HB2 1.0 0.0 5.0 381 248 A 26 PHE HA A 29 GLN H 1.0 0.0 3.5 382 249 A 26 PHE HA A 29 GLN HB2 1.0 0.0 3.5 383 249 A 26 PHE HA A 29 GLN HB3 1.0 0.0 3.5 384 250 A 26 PHE HD% A 30 LEU HDx% 1.0 0.0 3.5 385 250 A 26 PHE HD% A 30 LEU HD2% 1.0 0.0 3.5 386 251 A 26 PHE HD% A 55 LEU HA 1.0 0.0 5.0 387 252 A 26 PHE HD% A 55 LEU HDx% 1.0 0.0 2.3 388 252 A 26 PHE HD% A 55 LEU HDy% 1.0 0.0 2.3 389 253 A 26 PHE HE% A 55 LEU HA 1.0 0.0 3.5 390 254 A 26 PHE HE% A 55 LEU HDx% 1.0 0.0 2.3 391 254 A 26 PHE HE% A 55 LEU HDy% 1.0 0.0 2.3 392 255 A 26 PHE HZ A 55 LEU HA 1.0 0.0 5.0 393 256 A 26 PHE HZ A 55 LEU HDx% 1.0 0.0 3.5 394 256 A 26 PHE HZ A 55 LEU HDy% 1.0 0.0 3.5 395 257 A 26 PHE HE% A 58 GLN HB2 1.0 0.0 2.8 396 257 A 26 PHE HE% A 58 GLN HB3 1.0 0.0 2.8 397 258 A 26 PHE HZ A 58 GLN HB2 1.0 0.0 2.8 398 258 A 26 PHE HZ A 58 GLN HB3 1.0 0.0 2.8 399 259 A 26 PHE HZ A 58 GLN HGx 1.0 0.0 2.8 400 259 A 26 PHE HZ A 58 GLN HGy 1.0 0.0 2.8 401 260 A 26 PHE HD% A 59 ARG HA 1.0 0.0 5.0 402 261 A 26 PHE HD% A 59 ARG HDx 1.0 0.0 2.8 403 261 A 26 PHE HD% A 59 ARG HDy 1.0 0.0 2.8 404 262 A 26 PHE HE% A 59 ARG HDx 1.0 0.0 2.8 405 262 A 26 PHE HE% A 59 ARG HDy 1.0 0.0 2.8 406 263 A 26 PHE HZ A 59 ARG HA 1.0 0.0 3.5 407 264 A 27 GLU H A 27 GLU HA 1.0 0.0 5.0 408 265 A 27 GLU H A 27 GLU HB2 1.0 0.0 5.0 409 265 A 27 GLU H A 27 GLU HB3 1.0 0.0 5.0 410 266 A 27 GLU HA A 27 GLU HB2 1.0 0.0 5.0 411 266 A 27 GLU HB3 A 27 GLU HA 1.0 0.0 5.0 412 267 A 27 GLU H A 28 ILE H 1.0 0.0 2.8 413 268 A 28 ILE H A 27 GLU HA 1.0 0.0 3.5 414 269 A 28 ILE H A 27 GLU HB2 1.0 0.0 3.5 415 269 A 27 GLU HB3 A 28 ILE H 1.0 0.0 3.5 416 270 A 27 GLU HA A 30 LEU H 1.0 0.0 3.5 417 271 A 27 GLU HA A 30 LEU HBx 1.0 0.0 3.5 418 271 A 27 GLU HA A 30 LEU HBy 1.0 0.0 3.5 419 272 A 27 GLU HA A 30 LEU HDx% 1.0 0.0 5.0 420 272 A 30 LEU HD2% A 27 GLU HA 1.0 0.0 5.0 421 273 A 27 GLU HB3 A 30 LEU HBx 1.0 0.0 5.0 422 273 A 27 GLU HB2 A 30 LEU HBx 1.0 0.0 5.0 423 273 A 30 LEU HBy A 27 GLU HB2 1.0 0.0 5.0 424 273 A 27 GLU HB3 A 30 LEU HBy 1.0 0.0 5.0 425 274 A 27 GLU HA A 31 ARG HD2 1.0 0.0 5.0 426 274 A 27 GLU HA A 31 ARG HD3 1.0 0.0 5.0 427 275 A 28 ILE H A 28 ILE HA 1.0 0.0 5.0 428 276 A 28 ILE HD1% A 28 ILE H 1.0 0.0 5.0 429 277 A 28 ILE HA A 28 ILE HG1x 1.0 0.0 5.0 430 277 A 28 ILE HG1y A 28 ILE HA 1.0 0.0 5.0 431 278 A 28 ILE HA A 28 ILE HG2% 1.0 0.0 5.0 432 279 A 28 ILE HD1% A 28 ILE HA 1.0 0.0 5.0 433 280 A 28 ILE HD1% A 28 ILE HB 1.0 0.0 5.0 434 281 A 28 ILE HG2% A 28 ILE HG1x 1.0 0.0 5.0 435 281 A 28 ILE HG1y A 28 ILE HG2% 1.0 0.0 5.0 436 282 A 28 ILE HD1% A 28 ILE HG1x 1.0 0.0 5.0 437 282 A 28 ILE HD1% A 28 ILE HG1y 1.0 0.0 5.0 438 283 A 28 ILE H A 29 GLN H 1.0 0.0 2.8 439 284 A 29 GLN H A 28 ILE HA 1.0 0.0 5.0 440 285 A 28 ILE HD1% A 29 GLN H 1.0 0.0 5.0 441 286 A 28 ILE H A 30 LEU H 1.0 0.0 5.0 442 287 A 28 ILE HA A 31 ARG H 1.0 0.0 3.5 443 288 A 28 ILE HA A 31 ARG HB2 1.0 0.0 5.0 444 288 A 28 ILE HA A 31 ARG HB3 1.0 0.0 5.0 445 289 A 28 ILE HA A 31 ARG HD2 1.0 0.0 3.5 446 289 A 31 ARG HD3 A 28 ILE HA 1.0 0.0 3.5 447 290 A 28 ILE HG2% A 31 ARG HD2 1.0 0.0 3.5 448 290 A 31 ARG HD3 A 28 ILE HG2% 1.0 0.0 3.5 449 291 A 28 ILE HD1% A 31 ARG HD2 1.0 0.0 3.5 450 291 A 28 ILE HD1% A 31 ARG HD3 1.0 0.0 3.5 451 292 A 28 ILE HG2% A 32 ASP HB3 1.0 0.0 5.0 452 292 A 28 ILE HG2% A 32 ASP HB2 1.0 0.0 5.0 453 293 A 29 GLN H A 29 GLN HA 1.0 0.0 5.0 454 294 A 29 GLN H A 29 GLN HB2 1.0 0.0 5.0 455 294 A 29 GLN H A 29 GLN HB3 1.0 0.0 5.0 456 295 A 29 GLN H A 29 GLN HGx 1.0 0.0 5.0 457 295 A 29 GLN H A 29 GLN HGy 1.0 0.0 5.0 458 296 A 29 GLN HA A 29 GLN HGx 1.0 0.0 5.0 459 296 A 29 GLN HA A 29 GLN HGy 1.0 0.0 5.0 460 297 A 29 GLN HE2x A 29 GLN HGx 1.0 0.0 5.0 461 297 A 29 GLN HGy A 29 GLN HE2x 1.0 0.0 5.0 462 298 A 29 GLN HE2y A 29 GLN HGx 1.0 0.0 5.0 463 298 A 29 GLN HGy A 29 GLN HE2y 1.0 0.0 5.0 464 299 A 29 GLN H A 30 LEU H 1.0 0.0 2.8 465 300 A 30 LEU H A 29 GLN HA 1.0 0.0 5.0 466 301 A 30 LEU H A 29 GLN HGx 1.0 0.0 5.0 467 301 A 30 LEU H A 29 GLN HGy 1.0 0.0 5.0 468 302 A 31 ARG H A 29 GLN HA 1.0 0.0 5.0 469 303 A 29 GLN HA A 32 ASP H 1.0 0.0 3.5 470 304 A 29 GLN HA A 32 ASP HB3 1.0 0.0 5.0 471 304 A 32 ASP HB2 A 29 GLN HA 1.0 0.0 5.0 472 305 A 29 GLN H A 55 LEU HDx% 1.0 0.0 5.0 473 305 A 29 GLN H A 55 LEU HDy% 1.0 0.0 5.0 474 306 A 29 GLN HA A 55 LEU HDx% 1.0 0.0 5.0 475 306 A 55 LEU HDy% A 29 GLN HA 1.0 0.0 5.0 476 307 A 29 GLN HB3 A 55 LEU HDx% 1.0 0.0 2.3 477 307 A 55 LEU HDy% A 29 GLN HB2 1.0 0.0 2.3 478 307 A 29 GLN HB3 A 55 LEU HDy% 1.0 0.0 2.3 479 307 A 29 GLN HB2 A 55 LEU HDx% 1.0 0.0 2.3 480 308 A 29 GLN HGy A 55 LEU HDx% 1.0 0.0 2.3 481 308 A 29 GLN HGx A 55 LEU HDx% 1.0 0.0 2.3 482 308 A 55 LEU HDy% A 29 GLN HGx 1.0 0.0 2.3 483 308 A 55 LEU HDy% A 29 GLN HGy 1.0 0.0 2.3 484 309 A 30 LEU H A 30 LEU HA 1.0 0.0 5.0 485 310 A 30 LEU H A 30 LEU HBx 1.0 0.0 5.0 486 310 A 30 LEU H A 30 LEU HBy 1.0 0.0 5.0 487 311 A 30 LEU H A 30 LEU HDx% 1.0 0.0 5.0 488 311 A 30 LEU HD2% A 30 LEU H 1.0 0.0 5.0 489 312 A 30 LEU HA A 30 LEU HBx 1.0 0.0 5.0 490 312 A 30 LEU HBy A 30 LEU HA 1.0 0.0 5.0 491 313 A 30 LEU HA A 30 LEU HDx% 1.0 0.0 5.0 492 313 A 30 LEU HD2% A 30 LEU HA 1.0 0.0 5.0 493 314 A 30 LEU HG A 30 LEU HBx 1.0 0.0 5.0 494 314 A 30 LEU HBy A 30 LEU HG 1.0 0.0 5.0 495 315 A 30 LEU HBx A 30 LEU HDx% 1.0 0.0 5.0 496 315 A 30 LEU HBy A 30 LEU HDx% 1.0 0.0 5.0 497 315 A 30 LEU HD2% A 30 LEU HBx 1.0 0.0 5.0 498 315 A 30 LEU HD2% A 30 LEU HBy 1.0 0.0 5.0 499 316 A 30 LEU HG A 30 LEU HDx% 1.0 0.0 5.0 500 316 A 30 LEU HD2% A 30 LEU HG 1.0 0.0 5.0 501 317 A 30 LEU H A 31 ARG H 1.0 0.0 2.8 502 318 A 31 ARG H A 30 LEU HA 1.0 0.0 5.0 503 319 A 31 ARG H A 30 LEU HBx 1.0 0.0 3.5 504 319 A 30 LEU HBy A 31 ARG H 1.0 0.0 3.5 505 320 A 31 ARG H A 30 LEU HDx% 1.0 0.0 5.0 506 320 A 30 LEU HD2% A 31 ARG H 1.0 0.0 5.0 507 321 A 30 LEU H A 32 ASP H 1.0 0.0 5.0 508 322 A 30 LEU HA A 33 ALA H 1.0 0.0 3.5 509 323 A 30 LEU HA A 33 ALA HB% 1.0 0.0 3.5 510 324 A 33 ALA HB% A 30 LEU HDx% 1.0 0.0 3.5 511 324 A 30 LEU HD2% A 33 ALA HB% 1.0 0.0 3.5 512 325 A 34 GLN H A 30 LEU HDx% 1.0 0.0 5.0 513 325 A 30 LEU HD2% A 34 GLN H 1.0 0.0 5.0 514 326 A 30 LEU HA A 52 ILE HD1% 1.0 0.0 3.5 515 327 A 30 LEU HG A 52 ILE HD1% 1.0 0.0 3.5 516 328 A 52 ILE HA A 30 LEU HDx% 1.0 0.0 2.8 517 328 A 30 LEU HD2% A 52 ILE HA 1.0 0.0 2.8 518 329 A 52 ILE HG2% A 30 LEU HDx% 1.0 0.0 2.8 519 329 A 30 LEU HD2% A 52 ILE HG2% 1.0 0.0 2.8 520 330 A 52 ILE HD1% A 30 LEU HDx% 1.0 0.0 2.8 521 330 A 30 LEU HD2% A 52 ILE HD1% 1.0 0.0 2.8 522 331 A 30 LEU H A 55 LEU HDx% 1.0 0.0 2.8 523 331 A 55 LEU HDy% A 30 LEU H 1.0 0.0 2.8 524 332 A 30 LEU HA A 55 LEU HDx% 1.0 0.0 2.8 525 332 A 55 LEU HDy% A 30 LEU HA 1.0 0.0 2.8 526 333 A 55 LEU HA A 30 LEU HDx% 1.0 0.0 5.0 527 333 A 30 LEU HD2% A 55 LEU HA 1.0 0.0 5.0 528 334 A 30 LEU HDx% A 55 LEU HDx% 1.0 0.0 2.3 529 334 A 30 LEU HD2% A 55 LEU HDx% 1.0 0.0 2.3 530 334 A 55 LEU HDy% A 30 LEU HDx% 1.0 0.0 2.3 531 334 A 30 LEU HD2% A 55 LEU HDy% 1.0 0.0 2.3 532 335 A 31 ARG H A 31 ARG HA 1.0 0.0 5.0 533 336 A 31 ARG H A 31 ARG HB2 1.0 0.0 5.0 534 336 A 31 ARG H A 31 ARG HB3 1.0 0.0 5.0 535 337 A 31 ARG H A 32 ASP H 1.0 0.0 2.8 536 338 A 32 ASP H A 31 ARG HA 1.0 0.0 5.0 537 339 A 32 ASP H A 31 ARG HB2 1.0 0.0 3.5 538 339 A 31 ARG HB3 A 32 ASP H 1.0 0.0 3.5 539 340 A 31 ARG H A 33 ALA H 1.0 0.0 5.0 540 341 A 34 GLN H A 31 ARG HA 1.0 0.0 3.5 541 342 A 31 ARG HA A 34 GLN HGx 1.0 0.0 5.0 542 342 A 31 ARG HA A 34 GLN HGy 1.0 0.0 5.0 543 343 A 31 ARG HA A 35 LYS H 1.0 0.0 5.0 544 344 A 32 ASP H A 32 ASP HA 1.0 0.0 5.0 545 345 A 32 ASP HB2 A 32 ASP H 1.0 0.0 2.8 546 346 A 32 ASP H A 32 ASP HB3 1.0 0.0 5.0 547 346 A 32 ASP HB2 A 32 ASP H 1.0 0.0 5.0 548 347 A 32 ASP HA A 32 ASP HB3 1.0 0.0 2.8 549 348 A 32 ASP H A 33 ALA H 1.0 0.0 2.8 550 349 A 33 ALA H A 32 ASP HA 1.0 0.0 5.0 551 350 A 33 ALA H A 32 ASP HB3 1.0 0.0 3.5 552 350 A 32 ASP HB2 A 33 ALA H 1.0 0.0 3.5 553 351 A 32 ASP H A 34 GLN H 1.0 0.0 5.0 554 352 A 34 GLN H A 32 ASP HA 1.0 0.0 5.0 555 353 A 35 LYS H A 32 ASP HA 1.0 0.0 3.5 556 354 A 33 ALA H A 33 ALA HB% 1.0 0.0 5.0 557 355 A 33 ALA HB% A 33 ALA HA 1.0 0.0 5.0 558 356 A 33 ALA H A 34 GLN H 1.0 0.0 2.8 559 357 A 34 GLN H A 33 ALA HA 1.0 0.0 5.0 560 358 A 33 ALA HB% A 34 GLN H 1.0 0.0 5.0 561 359 A 33 ALA HB% A 34 GLN HGx 1.0 0.0 5.0 562 359 A 33 ALA HB% A 34 GLN HGy 1.0 0.0 5.0 563 360 A 33 ALA H A 35 LYS H 1.0 0.0 5.0 564 361 A 35 LYS H A 33 ALA HA 1.0 0.0 5.0 565 362 A 33 ALA HB% A 35 LYS H 1.0 0.0 5.0 566 363 A 33 ALA HA A 36 ASP H 1.0 0.0 3.5 567 364 A 33 ALA HB% A 36 ASP H 1.0 0.0 5.0 568 365 A 33 ALA HB% A 36 ASP HBx 1.0 0.0 5.0 569 365 A 33 ALA HB% A 36 ASP HBy 1.0 0.0 5.0 570 366 A 33 ALA HB% A 48 GLN HB2 1.0 0.0 3.5 571 366 A 33 ALA HB% A 48 GLN HB3 1.0 0.0 3.5 572 367 A 33 ALA HB% A 48 GLN HGx 1.0 0.0 2.8 573 367 A 33 ALA HB% A 48 GLN HGy 1.0 0.0 2.8 574 368 A 33 ALA HB% A 49 LEU HA 1.0 0.0 3.5 575 369 A 33 ALA HB% A 49 LEU HDx% 1.0 0.0 3.5 576 369 A 33 ALA HB% A 49 LEU HDy% 1.0 0.0 3.5 577 370 A 33 ALA H A 52 ILE HD1% 1.0 0.0 5.0 578 371 A 33 ALA HB% A 52 ILE HA 1.0 0.0 5.0 579 372 A 33 ALA HB% A 52 ILE HB 1.0 0.0 5.0 580 373 A 33 ALA HB% A 52 ILE HG1y 1.0 0.0 2.3 581 373 A 33 ALA HB% A 52 ILE HG1x 1.0 0.0 2.3 582 374 A 33 ALA HB% A 52 ILE HG2% 1.0 0.0 3.5 583 375 A 33 ALA HB% A 52 ILE HD1% 1.0 0.0 2.3 584 376 A 34 GLN H A 34 GLN HA 1.0 0.0 5.0 585 377 A 34 GLN H A 34 GLN HB2 1.0 0.0 2.8 586 378 A 34 GLN H A 34 GLN HB2 1.0 0.0 5.0 587 378 A 34 GLN H A 34 GLN HB3 1.0 0.0 5.0 588 379 A 34 GLN H A 34 GLN HGx 1.0 0.0 5.0 589 379 A 34 GLN H A 34 GLN HGy 1.0 0.0 5.0 590 380 A 34 GLN HA A 34 GLN HB3 1.0 0.0 2.8 591 381 A 34 GLN HA A 34 GLN HB2 1.0 0.0 5.0 592 381 A 34 GLN HA A 34 GLN HB3 1.0 0.0 5.0 593 382 A 34 GLN HA A 34 GLN HGx 1.0 0.0 5.0 594 382 A 34 GLN HGy A 34 GLN HA 1.0 0.0 5.0 595 383 A 34 GLN H A 35 LYS H 1.0 0.0 2.8 596 384 A 34 GLN H A 36 ASP H 1.0 0.0 5.0 597 385 A 34 GLN H A 52 ILE HG2% 1.0 0.0 5.0 598 386 A 52 ILE HD1% A 34 GLN HA 1.0 0.0 2.8 599 387 A 52 ILE HD1% A 34 GLN HGx 1.0 0.0 2.3 600 387 A 52 ILE HD1% A 34 GLN HGy 1.0 0.0 2.3 601 388 A 35 LYS H A 35 LYS HB2 1.0 0.0 2.8 602 389 A 35 LYS HA A 35 LYS HB3 1.0 0.0 2.8 603 390 A 35 LYS H A 36 ASP H 1.0 0.0 2.8 604 391 A 36 ASP H A 35 LYS HA 1.0 0.0 3.5 605 392 A 35 LYS HA A 38 SER H 1.0 0.0 3.5 606 393 A 36 ASP H A 36 ASP HA 1.0 0.0 5.0 607 394 A 36 ASP H A 36 ASP HBx 1.0 0.0 5.0 608 394 A 36 ASP H A 36 ASP HBy 1.0 0.0 5.0 609 395 A 36 ASP H A 37 LYS H 1.0 0.0 2.8 610 396 A 36 ASP HA A 37 LYS H 1.0 0.0 5.0 611 397 A 37 LYS H A 37 LYS HA 1.0 0.0 5.0 612 398 A 37 LYS H A 37 LYS HBx 1.0 0.0 5.0 613 398 A 37 LYS H A 37 LYS HBy 1.0 0.0 5.0 614 399 A 38 SER H A 38 SER HA 1.0 0.0 5.0 615 400 A 38 SER HA A 41 LEU HBx 1.0 0.0 5.0 616 400 A 38 SER HA A 41 LEU HBy 1.0 0.0 5.0 617 401 A 38 SER HA A 41 LEU HDx% 1.0 0.0 5.0 618 401 A 38 SER HA A 41 LEU HDy% 1.0 0.0 5.0 619 402 A 40 LYS H A 40 LYS HA 1.0 0.0 5.0 620 403 A 41 LEU H A 41 LEU HA 1.0 0.0 5.0 621 404 A 41 LEU H A 41 LEU HBx 1.0 0.0 5.0 622 404 A 41 LEU HBy A 41 LEU H 1.0 0.0 5.0 623 405 A 41 LEU HA A 41 LEU HG 1.0 0.0 5.0 624 406 A 41 LEU HA A 41 LEU HDx% 1.0 0.0 5.0 625 406 A 41 LEU HDy% A 41 LEU HA 1.0 0.0 5.0 626 407 A 41 LEU HG A 41 LEU HDx% 1.0 0.0 5.0 627 407 A 41 LEU HDy% A 41 LEU HG 1.0 0.0 5.0 628 408 A 41 LEU H A 42 ALA H 1.0 0.0 3.5 629 409 A 41 LEU HA A 42 ALA H 1.0 0.0 5.0 630 410 A 42 ALA H A 41 LEU HBx 1.0 0.0 5.0 631 410 A 41 LEU HBy A 42 ALA H 1.0 0.0 5.0 632 411 A 42 ALA H A 42 ALA HA 1.0 0.0 5.0 633 412 A 42 ALA H A 42 ALA HB% 1.0 0.0 5.0 634 413 A 42 ALA HA A 42 ALA HB% 1.0 0.0 5.0 635 414 A 42 ALA HB% A 43 ALA H 1.0 0.0 3.5 636 415 A 43 ALA H A 43 ALA HA 1.0 0.0 5.0 637 416 A 43 ALA H A 43 ALA HB% 1.0 0.0 5.0 638 417 A 43 ALA HA A 44 LYS H 1.0 0.0 2.8 639 418 A 43 ALA HB% A 44 LYS H 1.0 0.0 3.5 640 419 A 44 LYS H A 44 LYS HA 1.0 0.0 5.0 641 420 A 44 LYS HA A 45 SER H 1.0 0.0 3.5 642 421 A 45 SER H A 44 LYS HBx 1.0 0.0 5.0 643 421 A 45 SER H A 44 LYS HBy 1.0 0.0 5.0 644 422 A 44 LYS HA A 47 GLU HG2 1.0 0.0 3.5 645 422 A 44 LYS HA A 47 GLU HG3 1.0 0.0 3.5 646 423 A 45 SER H A 45 SER HA 1.0 0.0 3.5 647 424 A 45 SER H A 45 SER HBx 1.0 0.0 3.5 648 424 A 45 SER H A 45 SER HBy 1.0 0.0 3.5 649 425 A 45 SER HA A 46 ASN H 1.0 0.0 3.5 650 426 A 46 ASN H A 45 SER HBx 1.0 0.0 3.5 651 426 A 45 SER HBy A 46 ASN H 1.0 0.0 3.5 652 427 A 45 SER HA A 47 GLU H 1.0 0.0 5.0 653 428 A 47 GLU H A 45 SER HBx 1.0 0.0 5.0 654 428 A 45 SER HBy A 47 GLU H 1.0 0.0 5.0 655 429 A 45 SER HA A 48 GLN H 1.0 0.0 3.5 656 430 A 45 SER HA A 48 GLN HB2 1.0 0.0 3.5 657 430 A 48 GLN HB3 A 45 SER HA 1.0 0.0 3.5 658 431 A 48 GLN H A 45 SER HBx 1.0 0.0 5.0 659 431 A 45 SER HBy A 48 GLN H 1.0 0.0 5.0 660 432 A 46 ASN HA A 46 ASN HBx 1.0 0.0 5.0 661 432 A 46 ASN HA A 46 ASN HBy 1.0 0.0 5.0 662 433 A 46 ASN HA A 46 ASN HD2x 1.0 0.0 5.0 663 434 A 46 ASN H A 47 GLU H 1.0 0.0 2.8 664 435 A 47 GLU H A 46 ASN HA 1.0 0.0 5.0 665 436 A 46 ASN HA A 49 LEU H 1.0 0.0 3.5 666 437 A 46 ASN HA A 49 LEU HB3 1.0 0.0 3.5 667 437 A 46 ASN HA A 49 LEU HB2 1.0 0.0 3.5 668 438 A 46 ASN HA A 49 LEU HDx% 1.0 0.0 5.0 669 438 A 49 LEU HDy% A 46 ASN HA 1.0 0.0 5.0 670 439 A 46 ASN HBx A 49 LEU HB3 1.0 0.0 5.0 671 439 A 46 ASN HBy A 49 LEU HB3 1.0 0.0 5.0 672 439 A 49 LEU HB2 A 46 ASN HBx 1.0 0.0 5.0 673 439 A 46 ASN HBy A 49 LEU HB2 1.0 0.0 5.0 674 440 A 46 ASN HBx A 49 LEU HDx% 1.0 0.0 5.0 675 440 A 46 ASN HBy A 49 LEU HDx% 1.0 0.0 5.0 676 440 A 49 LEU HDy% A 46 ASN HBx 1.0 0.0 5.0 677 440 A 49 LEU HDy% A 46 ASN HBy 1.0 0.0 5.0 678 441 A 50 TRP HZ2 A 46 ASN HBx 1.0 0.0 5.0 679 441 A 46 ASN HBy A 50 TRP HZ2 1.0 0.0 5.0 680 442 A 47 GLU H A 47 GLU HA 1.0 0.0 5.0 681 443 A 47 GLU H A 47 GLU HB2 1.0 0.0 2.8 682 444 A 47 GLU H A 47 GLU HG2 1.0 0.0 5.0 683 444 A 47 GLU HG3 A 47 GLU H 1.0 0.0 5.0 684 445 A 47 GLU HA A 47 GLU HB3 1.0 0.0 2.8 685 446 A 47 GLU HA A 47 GLU HB3 1.0 0.0 5.0 686 446 A 47 GLU HA A 47 GLU HB2 1.0 0.0 5.0 687 447 A 47 GLU HA A 47 GLU HG2 1.0 0.0 5.0 688 447 A 47 GLU HG3 A 47 GLU HA 1.0 0.0 5.0 689 448 A 47 GLU H A 48 GLN H 1.0 0.0 2.8 690 449 A 48 GLN H A 47 GLU HA 1.0 0.0 5.0 691 450 A 48 GLN H A 47 GLU HB3 1.0 0.0 5.0 692 450 A 48 GLN H A 47 GLU HB2 1.0 0.0 5.0 693 451 A 48 GLN H A 47 GLU HG2 1.0 0.0 5.0 694 451 A 47 GLU HG3 A 48 GLN H 1.0 0.0 5.0 695 452 A 47 GLU H A 49 LEU H 1.0 0.0 5.0 696 453 A 49 LEU H A 47 GLU HA 1.0 0.0 5.0 697 454 A 47 GLU HA A 50 TRP H 1.0 0.0 3.5 698 455 A 47 GLU HA A 50 TRP HE3 1.0 0.0 3.5 699 456 A 47 GLU HA A 50 TRP HH2 1.0 0.0 5.0 700 457 A 50 TRP HE3 A 47 GLU HG2 1.0 0.0 3.5 701 457 A 47 GLU HG3 A 50 TRP HE3 1.0 0.0 3.5 702 458 A 50 TRP HZ3 A 47 GLU HG2 1.0 0.0 3.5 703 458 A 47 GLU HG3 A 50 TRP HZ3 1.0 0.0 3.5 704 459 A 48 GLN H A 48 GLN HA 1.0 0.0 5.0 705 460 A 48 GLN H A 48 GLN HB2 1.0 0.0 5.0 706 460 A 48 GLN HB3 A 48 GLN H 1.0 0.0 5.0 707 461 A 48 GLN H A 48 GLN HGx 1.0 0.0 5.0 708 461 A 48 GLN HGy A 48 GLN H 1.0 0.0 5.0 709 462 A 48 GLN HE2x A 48 GLN HGx 1.0 0.0 5.0 710 462 A 48 GLN HGy A 48 GLN HE2x 1.0 0.0 5.0 711 463 A 48 GLN H A 49 LEU H 1.0 0.0 2.8 712 464 A 49 LEU H A 48 GLN HB2 1.0 0.0 5.0 713 464 A 48 GLN HB3 A 49 LEU H 1.0 0.0 5.0 714 465 A 48 GLN HB3 A 49 LEU HB3 1.0 0.0 5.0 715 465 A 48 GLN HB2 A 49 LEU HB3 1.0 0.0 5.0 716 465 A 49 LEU HB2 A 48 GLN HB2 1.0 0.0 5.0 717 465 A 48 GLN HB3 A 49 LEU HB2 1.0 0.0 5.0 718 466 A 49 LEU H A 48 GLN HGx 1.0 0.0 5.0 719 466 A 48 GLN HGy A 49 LEU H 1.0 0.0 5.0 720 467 A 48 GLN HGx A 49 LEU HDx% 1.0 0.0 5.0 721 467 A 48 GLN HGy A 49 LEU HDx% 1.0 0.0 5.0 722 467 A 49 LEU HDy% A 48 GLN HGx 1.0 0.0 5.0 723 467 A 48 GLN HGy A 49 LEU HDy% 1.0 0.0 5.0 724 468 A 48 GLN H A 50 TRP H 1.0 0.0 5.0 725 469 A 52 ILE HD1% A 48 GLN HGx 1.0 0.0 5.0 726 469 A 52 ILE HD1% A 48 GLN HGy 1.0 0.0 5.0 727 470 A 52 ILE HD1% A 48 GLN HE2x 1.0 0.0 5.0 728 471 A 49 LEU HA A 49 LEU H 1.0 0.0 5.0 729 472 A 49 LEU H A 49 LEU HB2 1.0 0.0 2.8 730 473 A 49 LEU H A 49 LEU HB3 1.0 0.0 5.0 731 473 A 49 LEU H A 49 LEU HB2 1.0 0.0 5.0 732 474 A 49 LEU H A 49 LEU HDx% 1.0 0.0 5.0 733 474 A 49 LEU HDy% A 49 LEU H 1.0 0.0 5.0 734 475 A 49 LEU HA A 49 LEU HB3 1.0 0.0 2.8 735 476 A 49 LEU HA A 49 LEU HDx% 1.0 0.0 5.0 736 476 A 49 LEU HA A 49 LEU HDy% 1.0 0.0 5.0 737 477 A 49 LEU HB2 A 49 LEU HDx% 1.0 0.0 5.0 738 477 A 49 LEU HB3 A 49 LEU HDx% 1.0 0.0 5.0 739 477 A 49 LEU HDy% A 49 LEU HB3 1.0 0.0 5.0 740 477 A 49 LEU HDy% A 49 LEU HB2 1.0 0.0 5.0 741 478 A 49 LEU HG A 49 LEU HDx% 1.0 0.0 5.0 742 478 A 49 LEU HDy% A 49 LEU HG 1.0 0.0 5.0 743 479 A 49 LEU H A 50 TRP H 1.0 0.0 2.8 744 480 A 49 LEU HA A 50 TRP H 1.0 0.0 5.0 745 481 A 50 TRP H A 49 LEU HB3 1.0 0.0 5.0 746 481 A 49 LEU HB2 A 50 TRP H 1.0 0.0 5.0 747 482 A 50 TRP H A 49 LEU HDx% 1.0 0.0 5.0 748 482 A 49 LEU HDy% A 50 TRP H 1.0 0.0 5.0 749 483 A 49 LEU HA A 52 ILE H 1.0 0.0 3.5 750 484 A 52 ILE HG2% A 49 LEU HA 1.0 0.0 5.0 751 485 A 52 ILE HD1% A 49 LEU HB3 1.0 0.0 5.0 752 485 A 52 ILE HD1% A 49 LEU HB2 1.0 0.0 5.0 753 486 A 52 ILE H A 49 LEU HDx% 1.0 0.0 5.0 754 486 A 49 LEU HDy% A 52 ILE H 1.0 0.0 5.0 755 487 A 52 ILE HB A 49 LEU HDx% 1.0 0.0 5.0 756 487 A 49 LEU HDy% A 52 ILE HB 1.0 0.0 5.0 757 488 A 53 MET HE% A 49 LEU HB3 1.0 0.0 5.0 758 488 A 49 LEU HB2 A 53 MET HE% 1.0 0.0 5.0 759 489 A 49 LEU HDx% A 53 MET HGx 1.0 0.0 5.0 760 489 A 49 LEU HDy% A 53 MET HGx 1.0 0.0 5.0 761 489 A 53 MET HGy A 49 LEU HDx% 1.0 0.0 5.0 762 489 A 49 LEU HDy% A 53 MET HGy 1.0 0.0 5.0 763 490 A 50 TRP H A 50 TRP HA 1.0 0.0 5.0 764 491 A 50 TRP H A 50 TRP HB2 1.0 0.0 2.8 765 492 A 50 TRP H A 50 TRP HB2 1.0 0.0 5.0 766 492 A 50 TRP H A 50 TRP HB3 1.0 0.0 5.0 767 493 A 50 TRP HA A 50 TRP HB3 1.0 0.0 2.8 768 494 A 50 TRP HA A 50 TRP HD1 1.0 0.0 5.0 769 495 A 50 TRP HA A 50 TRP HE1 1.0 0.0 5.0 770 496 A 50 TRP HE3 A 50 TRP HB2 1.0 0.0 5.0 771 496 A 50 TRP HE3 A 50 TRP HB3 1.0 0.0 5.0 772 497 A 50 TRP HD1 A 50 TRP HE1 1.0 0.0 5.0 773 498 A 50 TRP HZ2 A 50 TRP HE1 1.0 0.0 5.0 774 499 A 50 TRP HZ2 A 50 TRP HH2 1.0 0.0 5.0 775 500 A 50 TRP H A 51 GLU H 1.0 0.0 2.8 776 501 A 50 TRP HA A 51 GLU H 1.0 0.0 5.0 777 502 A 51 GLU H A 50 TRP HB2 1.0 0.0 3.5 778 502 A 50 TRP HB3 A 51 GLU H 1.0 0.0 3.5 779 503 A 50 TRP HA A 53 MET H 1.0 0.0 3.5 780 504 A 53 MET HE% A 50 TRP HD1 1.0 0.0 3.5 781 505 A 50 TRP HA A 54 GLN H 1.0 0.0 5.0 782 506 A 50 TRP HB3 A 54 GLN HE2y 1.0 0.0 5.0 783 506 A 50 TRP HB2 A 54 GLN HE2y 1.0 0.0 5.0 784 506 A 54 GLN HE2x A 50 TRP HB2 1.0 0.0 5.0 785 506 A 50 TRP HB3 A 54 GLN HE2x 1.0 0.0 5.0 786 507 A 50 TRP HH2 A 144 GLN HBx 1.0 0.0 5.0 787 507 A 50 TRP HH2 A 144 GLN HBy 1.0 0.0 5.0 788 508 A 50 TRP HH2 A 144 GLN HGx 1.0 0.0 3.5 789 508 A 50 TRP HH2 A 144 GLN HGy 1.0 0.0 3.5 790 509 A 50 TRP HE1 A 146 VAL HA 1.0 0.0 3.5 791 510 A 50 TRP HE1 A 146 VAL HGx% 1.0 0.0 5.0 792 510 A 50 TRP HE1 A 146 VAL HGy% 1.0 0.0 5.0 793 511 A 50 TRP HZ2 A 146 VAL HA 1.0 0.0 2.8 794 512 A 50 TRP HZ2 A 146 VAL HB 1.0 0.0 5.0 795 513 A 50 TRP HZ2 A 146 VAL HGx% 1.0 0.0 3.5 796 513 A 50 TRP HZ2 A 146 VAL HGy% 1.0 0.0 3.5 797 514 A 50 TRP HH2 A 146 VAL HA 1.0 0.0 3.5 798 515 A 50 TRP HH2 A 146 VAL HGx% 1.0 0.0 5.0 799 515 A 50 TRP HH2 A 146 VAL HGy% 1.0 0.0 5.0 800 516 A 50 TRP HD1 A 148 CYS H 1.0 0.0 5.0 801 517 A 50 TRP HD1 A 148 CYS HA 1.0 0.0 3.5 802 518 A 50 TRP HD1 A 148 CYS HB3 1.0 0.0 5.0 803 519 A 50 TRP HE1 A 148 CYS H 1.0 0.0 5.0 804 520 A 50 TRP HE1 A 148 CYS HA 1.0 0.0 5.0 805 521 A 50 TRP HA A 149 GLY H 1.0 0.0 5.0 806 522 A 50 TRP HA A 149 GLY HAx 1.0 0.0 5.0 807 522 A 50 TRP HA A 149 GLY HAy 1.0 0.0 5.0 808 523 A 149 GLY H A 50 TRP HB2 1.0 0.0 2.8 809 523 A 50 TRP HB3 A 149 GLY H 1.0 0.0 2.8 810 524 A 50 TRP HB2 A 149 GLY HAx 1.0 0.0 2.8 811 524 A 50 TRP HB3 A 149 GLY HAx 1.0 0.0 2.8 812 524 A 149 GLY HAy A 50 TRP HB2 1.0 0.0 2.8 813 524 A 50 TRP HB3 A 149 GLY HAy 1.0 0.0 2.8 814 525 A 50 TRP HZ3 A 149 GLY HAx 1.0 0.0 3.5 815 525 A 50 TRP HZ3 A 149 GLY HAy 1.0 0.0 3.5 816 526 A 51 GLU H A 51 GLU HA 1.0 0.0 5.0 817 527 A 51 GLU H A 51 GLU HBx 1.0 0.0 5.0 818 527 A 51 GLU H A 51 GLU HBy 1.0 0.0 5.0 819 528 A 51 GLU H A 51 GLU HG2 1.0 0.0 5.0 820 528 A 51 GLU H A 51 GLU HG3 1.0 0.0 5.0 821 529 A 52 ILE H A 51 GLU H 1.0 0.0 2.8 822 530 A 52 ILE H A 51 GLU HA 1.0 0.0 5.0 823 531 A 54 GLN H A 51 GLU HA 1.0 0.0 3.5 824 532 A 51 GLU HA A 54 GLN HB2 1.0 0.0 3.5 825 532 A 51 GLU HA A 54 GLN HB3 1.0 0.0 3.5 826 533 A 51 GLU HA A 55 LEU H 1.0 0.0 5.0 827 534 A 52 ILE HA A 52 ILE H 1.0 0.0 5.0 828 535 A 52 ILE HB A 52 ILE H 1.0 0.0 5.0 829 536 A 52 ILE HG2% A 52 ILE H 1.0 0.0 5.0 830 537 A 52 ILE HA A 52 ILE HB 1.0 0.0 5.0 831 538 A 52 ILE HA A 52 ILE HG1y 1.0 0.0 5.0 832 538 A 52 ILE HA A 52 ILE HG1x 1.0 0.0 5.0 833 539 A 52 ILE HA A 52 ILE HG2% 1.0 0.0 5.0 834 540 A 52 ILE HD1% A 52 ILE HA 1.0 0.0 5.0 835 541 A 52 ILE HG2% A 52 ILE HB 1.0 0.0 5.0 836 542 A 52 ILE HD1% A 52 ILE HB 1.0 0.0 5.0 837 543 A 52 ILE HG2% A 52 ILE HG1y 1.0 0.0 5.0 838 543 A 52 ILE HG2% A 52 ILE HG1x 1.0 0.0 5.0 839 544 A 52 ILE HD1% A 52 ILE HG1y 1.0 0.0 5.0 840 544 A 52 ILE HD1% A 52 ILE HG1x 1.0 0.0 5.0 841 545 A 52 ILE H A 53 MET H 1.0 0.0 2.8 842 546 A 52 ILE HA A 53 MET H 1.0 0.0 5.0 843 547 A 52 ILE HD1% A 53 MET H 1.0 0.0 5.0 844 548 A 52 ILE HA A 55 LEU H 1.0 0.0 3.5 845 549 A 52 ILE HA A 55 LEU HDx% 1.0 0.0 3.5 846 549 A 55 LEU HDy% A 52 ILE HA 1.0 0.0 3.5 847 550 A 52 ILE HG2% A 56 HIS H 1.0 0.0 5.0 848 551 A 53 MET H A 53 MET HA 1.0 0.0 5.0 849 552 A 53 MET HE% A 53 MET HGx 1.0 0.0 5.0 850 552 A 53 MET HE% A 53 MET HGy 1.0 0.0 5.0 851 553 A 53 MET H A 54 GLN H 1.0 0.0 2.8 852 554 A 54 GLN H A 53 MET HA 1.0 0.0 5.0 853 555 A 56 HIS H A 53 MET HA 1.0 0.0 3.5 854 556 A 53 MET HA A 56 HIS HB3 1.0 0.0 3.5 855 556 A 53 MET HA A 56 HIS HB2 1.0 0.0 3.5 856 557 A 56 HIS H A 53 MET HB3 1.0 0.0 5.0 857 557 A 56 HIS H A 53 MET HB2 1.0 0.0 5.0 858 558 A 148 CYS HA A 53 MET HB3 1.0 0.0 5.0 859 558 A 148 CYS HA A 53 MET HB2 1.0 0.0 5.0 860 559 A 148 CYS HB3 A 53 MET HB3 1.0 0.0 5.0 861 560 A 53 MET HB2 A 148 CYS HB2 1.0 0.0 5.0 862 561 A 53 MET HGy A 148 CYS HB3 1.0 0.0 3.5 863 561 A 148 CYS HB3 A 53 MET HGx 1.0 0.0 3.5 864 562 A 53 MET HGx A 148 CYS HB2 1.0 0.0 3.5 865 562 A 53 MET HGy A 148 CYS HB2 1.0 0.0 3.5 866 563 A 53 MET HE% A 148 CYS HB3 1.0 0.0 2.8 867 564 A 53 MET HE% A 148 CYS HB2 1.0 0.0 2.8 868 565 A 54 GLN H A 54 GLN HA 1.0 0.0 5.0 869 566 A 54 GLN H A 54 GLN HB2 1.0 0.0 2.8 870 567 A 54 GLN H A 54 GLN HB2 1.0 0.0 5.0 871 567 A 54 GLN H A 54 GLN HB3 1.0 0.0 5.0 872 568 A 54 GLN HB3 A 54 GLN HA 1.0 0.0 2.8 873 569 A 54 GLN HA A 54 GLN HB2 1.0 0.0 5.0 874 569 A 54 GLN HB3 A 54 GLN HA 1.0 0.0 5.0 875 570 A 54 GLN HA A 54 GLN HGx 1.0 0.0 5.0 876 570 A 54 GLN HA A 54 GLN HGy 1.0 0.0 5.0 877 571 A 54 GLN H A 55 LEU H 1.0 0.0 2.8 878 572 A 55 LEU H A 54 GLN HA 1.0 0.0 5.0 879 573 A 55 LEU H A 54 GLN HB2 1.0 0.0 5.0 880 573 A 54 GLN HB3 A 55 LEU H 1.0 0.0 5.0 881 574 A 54 GLN HA A 57 HIS H 1.0 0.0 3.5 882 575 A 54 GLN HA A 57 HIS HB2 1.0 0.0 3.5 883 575 A 54 GLN HA A 57 HIS HB3 1.0 0.0 3.5 884 576 A 55 LEU HA A 55 LEU H 1.0 0.0 5.0 885 577 A 55 LEU H A 55 LEU HB2 1.0 0.0 2.8 886 578 A 55 LEU H A 55 LEU HDx% 1.0 0.0 5.0 887 578 A 55 LEU HDy% A 55 LEU H 1.0 0.0 5.0 888 579 A 55 LEU HA A 55 LEU HB3 1.0 0.0 2.8 889 580 A 55 LEU HA A 55 LEU HG 1.0 0.0 5.0 890 581 A 55 LEU HA A 55 LEU HDx% 1.0 0.0 5.0 891 581 A 55 LEU HA A 55 LEU HDy% 1.0 0.0 5.0 892 582 A 55 LEU HB3 A 55 LEU HDx% 1.0 0.0 5.0 893 582 A 55 LEU HB2 A 55 LEU HDx% 1.0 0.0 5.0 894 582 A 55 LEU HDy% A 55 LEU HB3 1.0 0.0 5.0 895 582 A 55 LEU HDy% A 55 LEU HB2 1.0 0.0 5.0 896 583 A 55 LEU HG A 55 LEU HDx% 1.0 0.0 5.0 897 583 A 55 LEU HDy% A 55 LEU HG 1.0 0.0 5.0 898 584 A 55 LEU H A 56 HIS H 1.0 0.0 2.8 899 585 A 55 LEU HA A 58 GLN H 1.0 0.0 3.5 900 586 A 55 LEU HA A 58 GLN HB2 1.0 0.0 3.5 901 586 A 55 LEU HA A 58 GLN HB3 1.0 0.0 3.5 902 587 A 55 LEU HDx% A 58 GLN HGx 1.0 0.0 5.0 903 587 A 55 LEU HDy% A 58 GLN HGx 1.0 0.0 5.0 904 587 A 58 GLN HGy A 55 LEU HDx% 1.0 0.0 5.0 905 587 A 55 LEU HDy% A 58 GLN HGy 1.0 0.0 5.0 906 588 A 59 ARG H A 55 LEU HDx% 1.0 0.0 5.0 907 588 A 55 LEU HDy% A 59 ARG H 1.0 0.0 5.0 908 589 A 56 HIS H A 56 HIS HB3 1.0 0.0 2.8 909 590 A 56 HIS H A 56 HIS HB2 1.0 0.0 2.8 910 591 A 56 HIS HB2 A 56 HIS HA 1.0 0.0 2.8 911 592 A 56 HIS HD2 A 56 HIS HB3 1.0 0.0 2.8 912 592 A 56 HIS HB2 A 56 HIS HD2 1.0 0.0 2.8 913 593 A 56 HIS H A 57 HIS H 1.0 0.0 2.8 914 594 A 57 HIS H A 56 HIS HA 1.0 0.0 5.0 915 595 A 57 HIS H A 56 HIS HB3 1.0 0.0 3.5 916 595 A 56 HIS HB2 A 57 HIS H 1.0 0.0 3.5 917 596 A 57 HIS H A 56 HIS HD2 1.0 0.0 5.0 918 597 A 59 ARG H A 56 HIS HA 1.0 0.0 3.5 919 598 A 56 HIS HD2 A 91 LEU HDx% 1.0 0.0 5.0 920 598 A 56 HIS HD2 A 91 LEU HDy% 1.0 0.0 5.0 921 599 A 57 HIS H A 58 GLN H 1.0 0.0 2.8 922 600 A 58 GLN H A 57 HIS HA 1.0 0.0 5.0 923 601 A 58 GLN H A 57 HIS HB2 1.0 0.0 5.0 924 601 A 57 HIS HB3 A 58 GLN H 1.0 0.0 5.0 925 602 A 57 HIS HA A 60 SER H 1.0 0.0 3.5 926 603 A 57 HIS HA A 91 LEU HDx% 1.0 0.0 5.0 927 603 A 91 LEU HDy% A 57 HIS HA 1.0 0.0 5.0 928 604 A 57 HIS HB3 A 91 LEU HDx% 1.0 0.0 5.0 929 604 A 91 LEU HDy% A 57 HIS HB2 1.0 0.0 5.0 930 604 A 57 HIS HB3 A 91 LEU HDy% 1.0 0.0 5.0 931 604 A 57 HIS HB2 A 91 LEU HDx% 1.0 0.0 5.0 932 605 A 57 HIS HD2 A 91 LEU HG 1.0 0.0 5.0 933 606 A 57 HIS HD2 A 91 LEU HDx% 1.0 0.0 2.8 934 606 A 91 LEU HDy% A 57 HIS HD2 1.0 0.0 2.8 935 607 A 57 HIS HE1 A 95 TRP HZ2 1.0 0.0 2.8 936 608 A 57 HIS HE1 A 95 TRP HH2 1.0 0.0 3.5 937 609 A 57 HIS HE1 A 104 CYS HA 1.0 0.0 2.3 938 610 A 57 HIS HE1 A 104 CYS HB2 1.0 0.0 3.5 939 610 A 57 HIS HE1 A 104 CYS HB3 1.0 0.0 3.5 940 611 A 58 GLN H A 58 GLN HA 1.0 0.0 5.0 941 612 A 58 GLN H A 58 GLN HB2 1.0 0.0 5.0 942 612 A 58 GLN HB3 A 58 GLN H 1.0 0.0 5.0 943 613 A 58 GLN H A 58 GLN HGx 1.0 0.0 5.0 944 613 A 58 GLN HGy A 58 GLN H 1.0 0.0 5.0 945 614 A 58 GLN HA A 58 GLN HB2 1.0 0.0 5.0 946 614 A 58 GLN HB3 A 58 GLN HA 1.0 0.0 5.0 947 615 A 58 GLN HB2 A 58 GLN HGx 1.0 0.0 5.0 948 615 A 58 GLN HB3 A 58 GLN HGx 1.0 0.0 5.0 949 615 A 58 GLN HGy A 58 GLN HB2 1.0 0.0 5.0 950 615 A 58 GLN HB3 A 58 GLN HGy 1.0 0.0 5.0 951 616 A 58 GLN H A 59 ARG H 1.0 0.0 2.8 952 617 A 59 ARG H A 58 GLN HB2 1.0 0.0 5.0 953 617 A 58 GLN HB3 A 59 ARG H 1.0 0.0 5.0 954 618 A 60 SER H A 58 GLN HA 1.0 0.0 5.0 955 619 A 58 GLN HA A 61 ARG H 1.0 0.0 3.5 956 620 A 59 ARG HA A 59 ARG H 1.0 0.0 5.0 957 621 A 59 ARG HA A 59 ARG HBx 1.0 0.0 5.0 958 621 A 59 ARG HA A 59 ARG HBy 1.0 0.0 5.0 959 622 A 59 ARG H A 60 SER H 1.0 0.0 2.8 960 623 A 59 ARG HA A 62 TYR H 1.0 0.0 3.5 961 624 A 60 SER H A 60 SER HA 1.0 0.0 5.0 962 625 A 60 SER H A 60 SER HB3 1.0 0.0 2.8 963 626 A 60 SER H A 60 SER HB3 1.0 0.0 5.0 964 626 A 60 SER H A 60 SER HB2 1.0 0.0 5.0 965 627 A 60 SER HA A 60 SER HB3 1.0 0.0 2.8 966 628 A 60 SER HA A 60 SER HB2 1.0 0.0 2.8 967 629 A 60 SER H A 61 ARG H 1.0 0.0 2.8 968 630 A 61 ARG H A 60 SER HA 1.0 0.0 5.0 969 631 A 60 SER HA A 63 ILE H 1.0 0.0 3.5 970 632 A 60 SER HA A 63 ILE HG1x 1.0 0.0 5.0 971 632 A 60 SER HA A 63 ILE HG1y 1.0 0.0 5.0 972 633 A 63 ILE HD1% A 60 SER HA 1.0 0.0 5.0 973 634 A 60 SER HA A 87 ALA HB% 1.0 0.0 2.8 974 635 A 87 ALA HB% A 60 SER HB3 1.0 0.0 3.5 975 635 A 60 SER HB2 A 87 ALA HB% 1.0 0.0 3.5 976 636 A 60 SER H A 92 ILE HD1% 1.0 0.0 5.0 977 637 A 92 ILE HG2% A 60 SER HB3 1.0 0.0 5.0 978 637 A 60 SER HB2 A 92 ILE HG2% 1.0 0.0 5.0 979 638 A 92 ILE HD1% A 60 SER HB3 1.0 0.0 2.8 980 638 A 60 SER HB2 A 92 ILE HD1% 1.0 0.0 2.8 981 639 A 61 ARG H A 61 ARG HA 1.0 0.0 5.0 982 640 A 61 ARG H A 61 ARG HB3 1.0 0.0 2.8 983 641 A 61 ARG H A 61 ARG HB2 1.0 0.0 2.8 984 642 A 61 ARG HA A 61 ARG HB2 1.0 0.0 2.8 985 643 A 61 ARG H A 62 TYR H 1.0 0.0 2.8 986 644 A 62 TYR H A 61 ARG HA 1.0 0.0 5.0 987 645 A 61 ARG HA A 64 TYR H 1.0 0.0 3.5 988 646 A 61 ARG HA A 64 TYR HB2 1.0 0.0 3.5 989 646 A 61 ARG HA A 64 TYR HB3 1.0 0.0 3.5 990 647 A 61 ARG HA A 64 TYR HD% 1.0 0.0 5.0 991 648 A 62 TYR H A 62 TYR HA 1.0 0.0 5.0 992 649 A 62 TYR H A 62 TYR HB3 1.0 0.0 2.8 993 650 A 62 TYR H A 62 TYR HB2 1.0 0.0 2.8 994 651 A 62 TYR H A 62 TYR HB2 1.0 0.0 5.0 995 651 A 62 TYR H A 62 TYR HB3 1.0 0.0 5.0 996 652 A 62 TYR HD% A 62 TYR H 1.0 0.0 5.0 997 653 A 62 TYR HA A 62 TYR HB2 1.0 0.0 2.8 998 654 A 62 TYR HA A 62 TYR HB2 1.0 0.0 5.0 999 654 A 62 TYR HA A 62 TYR HB3 1.0 0.0 5.0 1000 655 A 62 TYR HD% A 62 TYR HA 1.0 0.0 5.0 1001 656 A 62 TYR HD% A 62 TYR HB2 1.0 0.0 5.0 1002 656 A 62 TYR HD% A 62 TYR HB3 1.0 0.0 5.0 1003 657 A 62 TYR HE% A 62 TYR HB2 1.0 0.0 5.0 1004 657 A 62 TYR HE% A 62 TYR HB3 1.0 0.0 5.0 1005 658 A 62 TYR HD% A 62 TYR HE% 1.0 0.0 5.0 1006 659 A 62 TYR H A 63 ILE H 1.0 0.0 2.8 1007 660 A 63 ILE H A 62 TYR HA 1.0 0.0 5.0 1008 661 A 62 TYR HD% A 63 ILE H 1.0 0.0 5.0 1009 662 A 62 TYR H A 64 TYR H 1.0 0.0 5.0 1010 663 A 65 THR H A 62 TYR HB2 1.0 0.0 5.0 1011 663 A 62 TYR HB3 A 65 THR H 1.0 0.0 5.0 1012 664 A 62 TYR HB2 A 66 LEU HDx% 1.0 0.0 5.0 1013 664 A 66 LEU HDy% A 62 TYR HB2 1.0 0.0 5.0 1014 664 A 66 LEU HDy% A 62 TYR HB3 1.0 0.0 5.0 1015 664 A 62 TYR HB3 A 66 LEU HDx% 1.0 0.0 5.0 1016 665 A 62 TYR HD% A 66 LEU HDx% 1.0 0.0 5.0 1017 665 A 62 TYR HD% A 66 LEU HDy% 1.0 0.0 5.0 1018 666 A 62 TYR HE% A 66 LEU HDx% 1.0 0.0 5.0 1019 666 A 62 TYR HE% A 66 LEU HDy% 1.0 0.0 5.0 1020 667 A 63 ILE H A 63 ILE HA 1.0 0.0 5.0 1021 668 A 63 ILE H A 63 ILE HG1x 1.0 0.0 5.0 1022 668 A 63 ILE H A 63 ILE HG1y 1.0 0.0 5.0 1023 669 A 63 ILE HG2% A 63 ILE H 1.0 0.0 5.0 1024 670 A 63 ILE HA A 63 ILE HG1x 1.0 0.0 5.0 1025 670 A 63 ILE HG1y A 63 ILE HA 1.0 0.0 5.0 1026 671 A 63 ILE HG2% A 63 ILE HA 1.0 0.0 5.0 1027 672 A 63 ILE H A 64 TYR H 1.0 0.0 2.8 1028 673 A 64 TYR H A 63 ILE HA 1.0 0.0 5.0 1029 674 A 64 TYR H A 63 ILE HB 1.0 0.0 5.0 1030 675 A 63 ILE HG2% A 64 TYR H 1.0 0.0 5.0 1031 676 A 63 ILE HA A 66 LEU H 1.0 0.0 3.5 1032 677 A 63 ILE HA A 66 LEU HDx% 1.0 0.0 3.5 1033 677 A 66 LEU HDy% A 63 ILE HA 1.0 0.0 3.5 1034 678 A 63 ILE HG2% A 66 LEU HDx% 1.0 0.0 5.0 1035 678 A 63 ILE HG2% A 66 LEU HDy% 1.0 0.0 5.0 1036 679 A 63 ILE HA A 67 TYR H 1.0 0.0 5.0 1037 680 A 63 ILE HG2% A 67 TYR HD% 1.0 0.0 5.0 1038 681 A 63 ILE HG2% A 78 TYR HA 1.0 0.0 5.0 1039 682 A 63 ILE HG2% A 78 TYR HB2 1.0 0.0 5.0 1040 682 A 63 ILE HG2% A 78 TYR HB3 1.0 0.0 5.0 1041 683 A 63 ILE HG2% A 78 TYR HD% 1.0 0.0 3.5 1042 684 A 63 ILE HG2% A 78 TYR HE% 1.0 0.0 3.5 1043 685 A 63 ILE HD1% A 78 TYR HA 1.0 0.0 5.0 1044 686 A 63 ILE HD1% A 78 TYR HD% 1.0 0.0 3.5 1045 687 A 63 ILE HD1% A 78 TYR HE% 1.0 0.0 3.5 1046 688 A 63 ILE HG2% A 81 LEU HDx% 1.0 0.0 2.8 1047 688 A 81 LEU HDy% A 63 ILE HG2% 1.0 0.0 2.8 1048 689 A 63 ILE HD1% A 81 LEU HA 1.0 0.0 5.0 1049 690 A 63 ILE HD1% A 81 LEU HB3 1.0 0.0 2.8 1050 690 A 63 ILE HD1% A 81 LEU HB2 1.0 0.0 2.8 1051 691 A 63 ILE HD1% A 81 LEU HDx% 1.0 0.0 2.3 1052 691 A 81 LEU HDy% A 63 ILE HD1% 1.0 0.0 2.3 1053 692 A 63 ILE HG2% A 82 ILE HD1% 1.0 0.0 3.5 1054 693 A 63 ILE HD1% A 82 ILE HD1% 1.0 0.0 3.5 1055 694 A 63 ILE HD1% A 86 TYR H 1.0 0.0 5.0 1056 695 A 63 ILE HD1% A 86 TYR HA 1.0 0.0 5.0 1057 696 A 63 ILE HD1% A 86 TYR HB2 1.0 0.0 2.3 1058 696 A 63 ILE HD1% A 86 TYR HB3 1.0 0.0 2.3 1059 697 A 86 TYR HD% A 63 ILE HD1% 1.0 0.0 2.8 1060 698 A 63 ILE HD1% A 87 ALA HB% 1.0 0.0 2.3 1061 699 A 64 TYR H A 64 TYR HA 1.0 0.0 5.0 1062 700 A 64 TYR H A 64 TYR HB3 1.0 0.0 2.8 1063 701 A 64 TYR H A 64 TYR HB2 1.0 0.0 2.8 1064 702 A 64 TYR H A 64 TYR HB2 1.0 0.0 5.0 1065 702 A 64 TYR H A 64 TYR HB3 1.0 0.0 5.0 1066 703 A 64 TYR HA A 64 TYR HB2 1.0 0.0 2.8 1067 704 A 64 TYR HD% A 64 TYR HB2 1.0 0.0 5.0 1068 704 A 64 TYR HB3 A 64 TYR HD% 1.0 0.0 5.0 1069 705 A 64 TYR HE% A 64 TYR HB2 1.0 0.0 5.0 1070 705 A 64 TYR HB3 A 64 TYR HE% 1.0 0.0 5.0 1071 706 A 64 TYR HD% A 64 TYR HE% 1.0 0.0 5.0 1072 707 A 64 TYR H A 65 THR H 1.0 0.0 2.8 1073 708 A 64 TYR HD% A 65 THR H 1.0 0.0 5.0 1074 709 A 64 TYR H A 66 LEU H 1.0 0.0 5.0 1075 710 A 64 TYR HA A 68 TYR H 1.0 0.0 3.5 1076 711 A 64 TYR HE% A 68 TYR HD% 1.0 0.0 5.0 1077 712 A 64 TYR HE% A 68 TYR HE% 1.0 0.0 5.0 1078 713 A 92 ILE HG2% A 64 TYR HA 1.0 0.0 5.0 1079 714 A 92 ILE HD1% A 64 TYR HA 1.0 0.0 5.0 1080 715 A 92 ILE HD1% A 64 TYR HB2 1.0 0.0 3.5 1081 715 A 92 ILE HD1% A 64 TYR HB3 1.0 0.0 3.5 1082 716 A 92 ILE HG2% A 64 TYR HD% 1.0 0.0 2.8 1083 717 A 92 ILE HD1% A 64 TYR HD% 1.0 0.0 2.8 1084 718 A 92 ILE HG2% A 64 TYR HE% 1.0 0.0 2.8 1085 719 A 92 ILE HD1% A 64 TYR HE% 1.0 0.0 3.5 1086 720 A 65 THR H A 65 THR HA 1.0 0.0 5.0 1087 721 A 65 THR H A 65 THR HB 1.0 0.0 5.0 1088 722 A 65 THR H A 65 THR HG2% 1.0 0.0 5.0 1089 723 A 65 THR HA A 65 THR HG2% 1.0 0.0 5.0 1090 724 A 65 THR HB A 65 THR HG2% 1.0 0.0 5.0 1091 725 A 65 THR H A 66 LEU H 1.0 0.0 2.8 1092 726 A 66 LEU H A 65 THR HB 1.0 0.0 5.0 1093 727 A 66 LEU H A 65 THR HG2% 1.0 0.0 5.0 1094 728 A 65 THR HG2% A 66 LEU HA 1.0 0.0 5.0 1095 729 A 65 THR HG2% A 66 LEU HDx% 1.0 0.0 5.0 1096 729 A 66 LEU HDy% A 65 THR HG2% 1.0 0.0 5.0 1097 730 A 68 TYR H A 65 THR HA 1.0 0.0 5.0 1098 731 A 65 THR HA A 69 LYS H 1.0 0.0 5.0 1099 732 A 65 THR HA A 69 LYS HB3 1.0 0.0 5.0 1100 732 A 65 THR HA A 69 LYS HB2 1.0 0.0 5.0 1101 733 A 65 THR HA A 69 LYS HGx 1.0 0.0 5.0 1102 733 A 65 THR HA A 69 LYS HGy 1.0 0.0 5.0 1103 734 A 65 THR HA A 69 LYS HD2 1.0 0.0 5.0 1104 734 A 65 THR HA A 69 LYS HD3 1.0 0.0 5.0 1105 735 A 65 THR HG2% A 69 LYS H 1.0 0.0 5.0 1106 736 A 65 THR HG2% A 69 LYS HB3 1.0 0.0 3.5 1107 736 A 65 THR HG2% A 69 LYS HB2 1.0 0.0 3.5 1108 737 A 65 THR HG2% A 69 LYS HGx 1.0 0.0 5.0 1109 737 A 65 THR HG2% A 69 LYS HGy 1.0 0.0 5.0 1110 738 A 65 THR HG2% A 69 LYS HD2 1.0 0.0 3.5 1111 738 A 65 THR HG2% A 69 LYS HD3 1.0 0.0 3.5 1112 739 A 65 THR HG2% A 69 LYS HEx 1.0 0.0 3.5 1113 739 A 65 THR HG2% A 69 LYS HEy 1.0 0.0 3.5 1114 740 A 65 THR HG2% A 70 ARG H 1.0 0.0 5.0 1115 741 A 65 THR HG2% A 70 ARG HDx 1.0 0.0 5.0 1116 741 A 65 THR HG2% A 70 ARG HDy 1.0 0.0 5.0 1117 742 A 66 LEU H A 66 LEU HA 1.0 0.0 5.0 1118 743 A 66 LEU H A 66 LEU HB3 1.0 0.0 2.8 1119 744 A 66 LEU H A 66 LEU HDx% 1.0 0.0 5.0 1120 744 A 66 LEU HDy% A 66 LEU H 1.0 0.0 5.0 1121 745 A 66 LEU HA A 66 LEU HB3 1.0 0.0 2.8 1122 746 A 66 LEU HA A 66 LEU HB2 1.0 0.0 2.8 1123 747 A 66 LEU HA A 66 LEU HB3 1.0 0.0 5.0 1124 747 A 66 LEU HA A 66 LEU HB2 1.0 0.0 5.0 1125 748 A 66 LEU HA A 66 LEU HDx% 1.0 0.0 5.0 1126 748 A 66 LEU HDy% A 66 LEU HA 1.0 0.0 5.0 1127 749 A 66 LEU HB2 A 66 LEU HDx% 1.0 0.0 5.0 1128 749 A 66 LEU HB3 A 66 LEU HDx% 1.0 0.0 5.0 1129 749 A 66 LEU HDy% A 66 LEU HB3 1.0 0.0 5.0 1130 749 A 66 LEU HDy% A 66 LEU HB2 1.0 0.0 5.0 1131 750 A 66 LEU H A 67 TYR H 1.0 0.0 2.8 1132 751 A 67 TYR H A 66 LEU HA 1.0 0.0 5.0 1133 752 A 67 TYR H A 66 LEU HDx% 1.0 0.0 5.0 1134 752 A 66 LEU HDy% A 67 TYR H 1.0 0.0 5.0 1135 753 A 66 LEU HA A 69 LYS HD2 1.0 0.0 5.0 1136 753 A 66 LEU HA A 69 LYS HD3 1.0 0.0 5.0 1137 754 A 66 LEU HA A 70 ARG H 1.0 0.0 3.5 1138 755 A 66 LEU HA A 70 ARG HBx 1.0 0.0 5.0 1139 755 A 66 LEU HA A 70 ARG HBy 1.0 0.0 5.0 1140 756 A 70 ARG H A 66 LEU HDx% 1.0 0.0 5.0 1141 756 A 66 LEU HDy% A 70 ARG H 1.0 0.0 5.0 1142 757 A 66 LEU HA A 72 ALA HB% 1.0 0.0 5.0 1143 758 A 72 ALA H A 66 LEU HDx% 1.0 0.0 3.5 1144 758 A 66 LEU HDy% A 72 ALA H 1.0 0.0 3.5 1145 759 A 72 ALA HB% A 66 LEU HDx% 1.0 0.0 3.5 1146 759 A 66 LEU HDy% A 72 ALA HB% 1.0 0.0 3.5 1147 760 A 73 ILE HG2% A 66 LEU HDx% 1.0 0.0 3.5 1148 760 A 66 LEU HDy% A 73 ILE HG2% 1.0 0.0 3.5 1149 761 A 73 ILE HD1% A 66 LEU HDx% 1.0 0.0 2.8 1150 761 A 66 LEU HDy% A 73 ILE HD1% 1.0 0.0 2.8 1151 762 A 66 LEU HDx% A 77 LEU HDx% 1.0 0.0 5.0 1152 762 A 66 LEU HDy% A 77 LEU HDx% 1.0 0.0 5.0 1153 762 A 77 LEU HDy% A 66 LEU HDx% 1.0 0.0 5.0 1154 762 A 77 LEU HDy% A 66 LEU HDy% 1.0 0.0 5.0 1155 763 A 67 TYR H A 67 TYR HA 1.0 0.0 5.0 1156 764 A 67 TYR H A 67 TYR HB2 1.0 0.0 5.0 1157 764 A 67 TYR H A 67 TYR HB3 1.0 0.0 5.0 1158 765 A 67 TYR H A 67 TYR HD% 1.0 0.0 5.0 1159 766 A 67 TYR HD% A 67 TYR HA 1.0 0.0 5.0 1160 767 A 67 TYR HD% A 67 TYR HB2 1.0 0.0 5.0 1161 767 A 67 TYR HD% A 67 TYR HB3 1.0 0.0 5.0 1162 768 A 67 TYR HE% A 67 TYR HB2 1.0 0.0 5.0 1163 768 A 67 TYR HB3 A 67 TYR HE% 1.0 0.0 5.0 1164 769 A 67 TYR H A 68 TYR H 1.0 0.0 2.8 1165 770 A 68 TYR H A 67 TYR HA 1.0 0.0 5.0 1166 771 A 68 TYR H A 67 TYR HB2 1.0 0.0 5.0 1167 771 A 68 TYR H A 67 TYR HB3 1.0 0.0 5.0 1168 772 A 68 TYR HE% A 67 TYR HB2 1.0 0.0 5.0 1169 772 A 68 TYR HE% A 67 TYR HB3 1.0 0.0 5.0 1170 773 A 67 TYR HD% A 68 TYR H 1.0 0.0 5.0 1171 774 A 67 TYR HD% A 68 TYR HD% 1.0 0.0 5.0 1172 775 A 67 TYR HD% A 68 TYR HE% 1.0 0.0 5.0 1173 776 A 68 TYR HD% A 67 TYR HE% 1.0 0.0 5.0 1174 777 A 68 TYR HE% A 67 TYR HE% 1.0 0.0 5.0 1175 778 A 67 TYR H A 69 LYS H 1.0 0.0 5.0 1176 779 A 69 LYS H A 67 TYR HA 1.0 0.0 5.0 1177 780 A 67 TYR H A 73 ILE HD1% 1.0 0.0 5.0 1178 781 A 73 ILE HD1% A 67 TYR HB2 1.0 0.0 2.8 1179 781 A 73 ILE HD1% A 67 TYR HB3 1.0 0.0 2.8 1180 782 A 67 TYR HD% A 73 ILE H 1.0 0.0 5.0 1181 783 A 67 TYR HD% A 73 ILE HG1x 1.0 0.0 3.5 1182 783 A 67 TYR HD% A 73 ILE HG1y 1.0 0.0 3.5 1183 784 A 67 TYR HD% A 73 ILE HG2% 1.0 0.0 2.8 1184 785 A 67 TYR HD% A 73 ILE HD1% 1.0 0.0 3.5 1185 786 A 73 ILE HD1% A 67 TYR HE% 1.0 0.0 5.0 1186 787 A 67 TYR HD% A 75 LYS HA 1.0 0.0 5.0 1187 788 A 67 TYR HE% A 75 LYS H 1.0 0.0 2.8 1188 789 A 67 TYR HE% A 75 LYS HA 1.0 0.0 2.8 1189 790 A 67 TYR HE% A 75 LYS HBx 1.0 0.0 3.5 1190 790 A 67 TYR HE% A 75 LYS HBy 1.0 0.0 3.5 1191 791 A 67 TYR HE% A 75 LYS HGx 1.0 0.0 3.5 1192 791 A 67 TYR HE% A 75 LYS HGy 1.0 0.0 3.5 1193 792 A 67 TYR HE% A 75 LYS HE2 1.0 0.0 5.0 1194 792 A 67 TYR HE% A 75 LYS HE3 1.0 0.0 5.0 1195 793 A 67 TYR HD% A 78 TYR H 1.0 0.0 5.0 1196 794 A 67 TYR HD% A 78 TYR HD% 1.0 0.0 3.5 1197 795 A 67 TYR HD% A 78 TYR HE% 1.0 0.0 5.0 1198 796 A 78 TYR HD% A 67 TYR HE% 1.0 0.0 3.5 1199 797 A 68 TYR H A 68 TYR HA 1.0 0.0 5.0 1200 798 A 68 TYR H A 68 TYR HB2 1.0 0.0 2.8 1201 799 A 68 TYR H A 68 TYR HB2 1.0 0.0 5.0 1202 799 A 68 TYR H A 68 TYR HB3 1.0 0.0 5.0 1203 800 A 68 TYR H A 68 TYR HD% 1.0 0.0 5.0 1204 801 A 68 TYR HA A 68 TYR HB3 1.0 0.0 2.8 1205 802 A 68 TYR HA A 68 TYR HB2 1.0 0.0 5.0 1206 803 A 68 TYR HD% A 68 TYR HB2 1.0 0.0 5.0 1207 803 A 68 TYR HD% A 68 TYR HB3 1.0 0.0 5.0 1208 804 A 68 TYR H A 69 LYS H 1.0 0.0 2.8 1209 805 A 69 LYS H A 68 TYR HA 1.0 0.0 3.5 1210 806 A 68 TYR HD% A 69 LYS H 1.0 0.0 5.0 1211 807 A 92 ILE HG2% A 68 TYR HD% 1.0 0.0 5.0 1212 808 A 92 ILE HD1% A 68 TYR HD% 1.0 0.0 3.5 1213 809 A 92 ILE HG2% A 68 TYR HE% 1.0 0.0 2.8 1214 810 A 92 ILE HD1% A 68 TYR HE% 1.0 0.0 3.5 1215 811 A 69 LYS H A 69 LYS HA 1.0 0.0 5.0 1216 812 A 69 LYS H A 69 LYS HB2 1.0 0.0 2.8 1217 813 A 69 LYS H A 69 LYS HB3 1.0 0.0 5.0 1218 813 A 69 LYS H A 69 LYS HB2 1.0 0.0 5.0 1219 814 A 69 LYS H A 69 LYS HGx 1.0 0.0 5.0 1220 814 A 69 LYS H A 69 LYS HGy 1.0 0.0 5.0 1221 815 A 69 LYS H A 69 LYS HD2 1.0 0.0 5.0 1222 815 A 69 LYS H A 69 LYS HD3 1.0 0.0 5.0 1223 816 A 69 LYS HA A 69 LYS HB3 1.0 0.0 2.8 1224 817 A 69 LYS HA A 69 LYS HB3 1.0 0.0 5.0 1225 817 A 69 LYS HB2 A 69 LYS HA 1.0 0.0 5.0 1226 818 A 69 LYS HA A 69 LYS HGx 1.0 0.0 5.0 1227 818 A 69 LYS HGy A 69 LYS HA 1.0 0.0 5.0 1228 819 A 69 LYS HEy A 69 LYS HGx 1.0 0.0 5.0 1229 819 A 69 LYS HEx A 69 LYS HGx 1.0 0.0 5.0 1230 819 A 69 LYS HGy A 69 LYS HEx 1.0 0.0 5.0 1231 819 A 69 LYS HGy A 69 LYS HEy 1.0 0.0 5.0 1232 820 A 69 LYS H A 70 ARG H 1.0 0.0 2.8 1233 821 A 70 ARG H A 69 LYS HB3 1.0 0.0 2.8 1234 821 A 69 LYS HB2 A 70 ARG H 1.0 0.0 2.8 1235 822 A 69 LYS H A 71 LYS H 1.0 0.0 5.0 1236 823 A 70 ARG H A 70 ARG HA 1.0 0.0 5.0 1237 824 A 70 ARG H A 70 ARG HBx 1.0 0.0 5.0 1238 824 A 70 ARG H A 70 ARG HBy 1.0 0.0 5.0 1239 825 A 70 ARG HA A 70 ARG HDx 1.0 0.0 5.0 1240 825 A 70 ARG HDy A 70 ARG HA 1.0 0.0 5.0 1241 826 A 70 ARG H A 71 LYS H 1.0 0.0 2.8 1242 827 A 71 LYS H A 70 ARG HA 1.0 0.0 5.0 1243 828 A 71 LYS H A 70 ARG HBx 1.0 0.0 2.8 1244 828 A 70 ARG HBy A 71 LYS H 1.0 0.0 2.8 1245 829 A 70 ARG H A 72 ALA H 1.0 0.0 5.0 1246 830 A 72 ALA H A 70 ARG HA 1.0 0.0 5.0 1247 831 A 72 ALA HB% A 70 ARG HDx 1.0 0.0 5.0 1248 831 A 70 ARG HDy A 72 ALA HB% 1.0 0.0 5.0 1249 832 A 71 LYS H A 71 LYS HA 1.0 0.0 5.0 1250 833 A 71 LYS H A 71 LYS HB2 1.0 0.0 5.0 1251 833 A 71 LYS H A 71 LYS HB3 1.0 0.0 5.0 1252 834 A 72 ALA H A 71 LYS H 1.0 0.0 2.8 1253 835 A 72 ALA H A 71 LYS HA 1.0 0.0 2.8 1254 836 A 72 ALA H A 71 LYS HB2 1.0 0.0 5.0 1255 836 A 72 ALA H A 71 LYS HB3 1.0 0.0 5.0 1256 837 A 73 ILE H A 71 LYS H 1.0 0.0 5.0 1257 838 A 73 ILE H A 71 LYS HA 1.0 0.0 5.0 1258 839 A 72 ALA H A 72 ALA HA 1.0 0.0 5.0 1259 840 A 72 ALA HB% A 72 ALA H 1.0 0.0 5.0 1260 841 A 72 ALA HB% A 72 ALA HA 1.0 0.0 5.0 1261 842 A 72 ALA H A 73 ILE H 1.0 0.0 2.8 1262 843 A 73 ILE H A 72 ALA HA 1.0 0.0 3.5 1263 844 A 72 ALA HB% A 73 ILE H 1.0 0.0 5.0 1264 845 A 73 ILE H A 73 ILE HB 1.0 0.0 5.0 1265 846 A 73 ILE H A 73 ILE HG1x 1.0 0.0 5.0 1266 846 A 73 ILE H A 73 ILE HG1y 1.0 0.0 5.0 1267 847 A 73 ILE HG2% A 73 ILE HB 1.0 0.0 5.0 1268 848 A 73 ILE HD1% A 73 ILE HB 1.0 0.0 5.0 1269 849 A 73 ILE HG2% A 73 ILE HG1x 1.0 0.0 5.0 1270 849 A 73 ILE HG2% A 73 ILE HG1y 1.0 0.0 5.0 1271 850 A 73 ILE HD1% A 73 ILE HG1x 1.0 0.0 5.0 1272 850 A 73 ILE HD1% A 73 ILE HG1y 1.0 0.0 5.0 1273 851 A 73 ILE H A 74 SER H 1.0 0.0 5.0 1274 852 A 74 SER H A 73 ILE HA 1.0 0.0 2.8 1275 853 A 73 ILE HB A 74 SER H 1.0 0.0 5.0 1276 854 A 73 ILE HG2% A 74 SER H 1.0 0.0 5.0 1277 855 A 73 ILE HG2% A 78 TYR H 1.0 0.0 5.0 1278 856 A 78 TYR HA A 73 ILE HG2% 1.0 0.0 5.0 1279 857 A 73 ILE HG2% A 78 TYR HB2 1.0 0.0 2.8 1280 857 A 78 TYR HB3 A 73 ILE HG2% 1.0 0.0 2.8 1281 858 A 73 ILE HD1% A 78 TYR H 1.0 0.0 5.0 1282 859 A 78 TYR HA A 73 ILE HD1% 1.0 0.0 3.5 1283 860 A 73 ILE HD1% A 78 TYR HB2 1.0 0.0 2.8 1284 860 A 78 TYR HB3 A 73 ILE HD1% 1.0 0.0 2.8 1285 861 A 78 TYR HD% A 73 ILE HD1% 1.0 0.0 3.5 1286 862 A 78 TYR HE% A 73 ILE HD1% 1.0 0.0 5.0 1287 863 A 74 SER H A 74 SER HA 1.0 0.0 5.0 1288 864 A 74 SER H A 74 SER HBx 1.0 0.0 5.0 1289 864 A 74 SER H A 74 SER HBy 1.0 0.0 5.0 1290 865 A 75 LYS H A 74 SER H 1.0 0.0 5.0 1291 866 A 75 LYS H A 74 SER HA 1.0 0.0 2.8 1292 867 A 74 SER HA A 76 ASP H 1.0 0.0 5.0 1293 868 A 74 SER HBy A 77 LEU HDx% 1.0 0.0 5.0 1294 868 A 74 SER HBx A 77 LEU HDx% 1.0 0.0 5.0 1295 868 A 77 LEU HDy% A 74 SER HBx 1.0 0.0 5.0 1296 868 A 77 LEU HDy% A 74 SER HBy 1.0 0.0 5.0 1297 869 A 75 LYS HA A 75 LYS H 1.0 0.0 5.0 1298 870 A 75 LYS H A 76 ASP H 1.0 0.0 5.0 1299 871 A 75 LYS HA A 76 ASP H 1.0 0.0 5.0 1300 872 A 75 LYS H A 77 LEU H 1.0 0.0 5.0 1301 873 A 75 LYS HA A 78 TYR H 1.0 0.0 3.5 1302 874 A 76 ASP H A 76 ASP HA 1.0 0.0 5.0 1303 875 A 76 ASP H A 76 ASP HB2 1.0 0.0 2.8 1304 876 A 76 ASP HA A 76 ASP HB3 1.0 0.0 2.8 1305 877 A 76 ASP HA A 76 ASP HB3 1.0 0.0 5.0 1306 877 A 76 ASP HA A 76 ASP HB2 1.0 0.0 5.0 1307 878 A 76 ASP H A 77 LEU H 1.0 0.0 2.8 1308 879 A 77 LEU H A 76 ASP HA 1.0 0.0 5.0 1309 880 A 77 LEU H A 76 ASP HB3 1.0 0.0 5.0 1310 880 A 77 LEU H A 76 ASP HB2 1.0 0.0 5.0 1311 881 A 76 ASP HB3 A 77 LEU HDx% 1.0 0.0 5.0 1312 881 A 77 LEU HDy% A 76 ASP HB3 1.0 0.0 5.0 1313 881 A 77 LEU HDy% A 76 ASP HB2 1.0 0.0 5.0 1314 881 A 76 ASP HB2 A 77 LEU HDx% 1.0 0.0 5.0 1315 882 A 78 TYR H A 76 ASP H 1.0 0.0 5.0 1316 883 A 76 ASP HA A 79 ASP H 1.0 0.0 3.5 1317 884 A 76 ASP HA A 79 ASP HB3 1.0 0.0 3.5 1318 884 A 76 ASP HA A 79 ASP HB2 1.0 0.0 3.5 1319 885 A 77 LEU HA A 77 LEU H 1.0 0.0 5.0 1320 886 A 77 LEU HA A 77 LEU HDx% 1.0 0.0 5.0 1321 886 A 77 LEU HDy% A 77 LEU HA 1.0 0.0 5.0 1322 887 A 78 TYR H A 77 LEU H 1.0 0.0 2.8 1323 888 A 77 LEU HA A 78 TYR H 1.0 0.0 5.0 1324 889 A 77 LEU H A 79 ASP H 1.0 0.0 5.0 1325 890 A 77 LEU HA A 79 ASP H 1.0 0.0 5.0 1326 891 A 80 TRP H A 77 LEU HDx% 1.0 0.0 5.0 1327 891 A 77 LEU HDy% A 80 TRP H 1.0 0.0 5.0 1328 892 A 77 LEU HDx% A 80 TRP HB2 1.0 0.0 5.0 1329 892 A 80 TRP HB3 A 77 LEU HDx% 1.0 0.0 5.0 1330 892 A 77 LEU HDy% A 80 TRP HB3 1.0 0.0 5.0 1331 892 A 77 LEU HDy% A 80 TRP HB2 1.0 0.0 5.0 1332 893 A 81 LEU H A 77 LEU HDx% 1.0 0.0 5.0 1333 893 A 77 LEU HDy% A 81 LEU H 1.0 0.0 5.0 1334 894 A 77 LEU HDy% A 81 LEU HB3 1.0 0.0 5.0 1335 894 A 77 LEU HDx% A 81 LEU HB3 1.0 0.0 5.0 1336 894 A 81 LEU HB2 A 77 LEU HDx% 1.0 0.0 5.0 1337 894 A 77 LEU HDy% A 81 LEU HB2 1.0 0.0 5.0 1338 895 A 78 TYR HA A 78 TYR H 1.0 0.0 5.0 1339 896 A 78 TYR HB3 A 78 TYR H 1.0 0.0 2.8 1340 897 A 78 TYR H A 78 TYR HB2 1.0 0.0 2.8 1341 898 A 78 TYR HD% A 78 TYR H 1.0 0.0 5.0 1342 899 A 78 TYR HA A 78 TYR HB2 1.0 0.0 2.8 1343 900 A 78 TYR HA A 78 TYR HB2 1.0 0.0 5.0 1344 900 A 78 TYR HA A 78 TYR HB3 1.0 0.0 5.0 1345 901 A 78 TYR HA A 78 TYR HD% 1.0 0.0 5.0 1346 902 A 78 TYR HA A 78 TYR HE% 1.0 0.0 5.0 1347 903 A 78 TYR HD% A 78 TYR HE% 1.0 0.0 5.0 1348 904 A 78 TYR H A 79 ASP H 1.0 0.0 2.8 1349 905 A 79 ASP H A 78 TYR HB2 1.0 0.0 5.0 1350 905 A 78 TYR HB3 A 79 ASP H 1.0 0.0 5.0 1351 906 A 78 TYR HD% A 79 ASP H 1.0 0.0 5.0 1352 907 A 78 TYR HA A 81 LEU HDx% 1.0 0.0 3.5 1353 907 A 81 LEU HDy% A 78 TYR HA 1.0 0.0 3.5 1354 908 A 78 TYR HB3 A 81 LEU HDx% 1.0 0.0 5.0 1355 908 A 78 TYR HB2 A 81 LEU HDx% 1.0 0.0 5.0 1356 908 A 81 LEU HDy% A 78 TYR HB2 1.0 0.0 5.0 1357 908 A 81 LEU HDy% A 78 TYR HB3 1.0 0.0 5.0 1358 909 A 78 TYR HD% A 81 LEU HDx% 1.0 0.0 5.0 1359 909 A 81 LEU HDy% A 78 TYR HD% 1.0 0.0 5.0 1360 910 A 78 TYR HD% A 82 ILE HD1% 1.0 0.0 5.0 1361 911 A 78 TYR HE% A 82 ILE HD1% 1.0 0.0 5.0 1362 912 A 87 ALA HB% A 78 TYR HE% 1.0 0.0 3.5 1363 913 A 92 ILE HG2% A 78 TYR HE% 1.0 0.0 5.0 1364 914 A 92 ILE HD1% A 78 TYR HE% 1.0 0.0 3.5 1365 915 A 79 ASP H A 79 ASP HA 1.0 0.0 5.0 1366 916 A 79 ASP H A 79 ASP HB3 1.0 0.0 2.8 1367 917 A 79 ASP H A 79 ASP HB2 1.0 0.0 2.8 1368 918 A 79 ASP H A 79 ASP HB3 1.0 0.0 5.0 1369 918 A 79 ASP H A 79 ASP HB2 1.0 0.0 5.0 1370 919 A 79 ASP HB2 A 79 ASP HA 1.0 0.0 2.8 1371 920 A 79 ASP HA A 79 ASP HB3 1.0 0.0 5.0 1372 920 A 79 ASP HB2 A 79 ASP HA 1.0 0.0 5.0 1373 921 A 79 ASP H A 80 TRP H 1.0 0.0 2.8 1374 922 A 80 TRP H A 79 ASP HA 1.0 0.0 5.0 1375 923 A 80 TRP H A 79 ASP HB3 1.0 0.0 5.0 1376 923 A 79 ASP HB2 A 80 TRP H 1.0 0.0 5.0 1377 924 A 81 LEU H A 79 ASP HA 1.0 0.0 5.0 1378 925 A 79 ASP HA A 82 ILE H 1.0 0.0 3.5 1379 926 A 79 ASP HA A 82 ILE HB 1.0 0.0 3.5 1380 927 A 79 ASP HA A 82 ILE HG2% 1.0 0.0 5.0 1381 928 A 82 ILE HD1% A 79 ASP HA 1.0 0.0 5.0 1382 929 A 79 ASP HA A 83 LYS H 1.0 0.0 5.0 1383 930 A 80 TRP H A 80 TRP HB3 1.0 0.0 2.8 1384 931 A 80 TRP H A 80 TRP HB2 1.0 0.0 2.8 1385 932 A 80 TRP HA A 80 TRP HB2 1.0 0.0 2.8 1386 933 A 80 TRP HA A 80 TRP HD1 1.0 0.0 5.0 1387 934 A 80 TRP HD1 A 80 TRP HB2 1.0 0.0 5.0 1388 934 A 80 TRP HB3 A 80 TRP HD1 1.0 0.0 5.0 1389 935 A 80 TRP HE3 A 80 TRP HZ3 1.0 0.0 5.0 1390 936 A 80 TRP HZ2 A 80 TRP HZ3 1.0 0.0 5.0 1391 937 A 80 TRP HZ2 A 80 TRP HH2 1.0 0.0 5.0 1392 938 A 80 TRP HZ3 A 80 TRP HH2 1.0 0.0 5.0 1393 939 A 80 TRP H A 81 LEU H 1.0 0.0 2.8 1394 940 A 81 LEU H A 80 TRP HA 1.0 0.0 5.0 1395 941 A 81 LEU H A 80 TRP HB2 1.0 0.0 5.0 1396 941 A 80 TRP HB3 A 81 LEU H 1.0 0.0 5.0 1397 942 A 80 TRP HE3 A 81 LEU H 1.0 0.0 5.0 1398 943 A 80 TRP HZ3 A 81 LEU HDx% 1.0 0.0 3.5 1399 943 A 80 TRP HZ3 A 81 LEU HDy% 1.0 0.0 3.5 1400 944 A 80 TRP HH2 A 81 LEU HDx% 1.0 0.0 5.0 1401 944 A 80 TRP HH2 A 81 LEU HDy% 1.0 0.0 5.0 1402 945 A 83 LYS H A 80 TRP HA 1.0 0.0 3.5 1403 946 A 80 TRP HA A 84 GLU H 1.0 0.0 5.0 1404 947 A 80 TRP HD1 A 84 GLU HGx 1.0 0.0 5.0 1405 947 A 80 TRP HD1 A 84 GLU HGy 1.0 0.0 5.0 1406 948 A 80 TRP HZ3 A 86 TYR HE% 1.0 0.0 3.5 1407 949 A 80 TRP HH2 A 86 TYR HE% 1.0 0.0 5.0 1408 950 A 81 LEU HA A 81 LEU H 1.0 0.0 5.0 1409 951 A 81 LEU HB2 A 81 LEU H 1.0 0.0 2.8 1410 952 A 81 LEU H A 81 LEU HB3 1.0 0.0 5.0 1411 952 A 81 LEU HB2 A 81 LEU H 1.0 0.0 5.0 1412 953 A 81 LEU HA A 81 LEU HB3 1.0 0.0 2.8 1413 954 A 81 LEU HA A 81 LEU HDx% 1.0 0.0 5.0 1414 954 A 81 LEU HDy% A 81 LEU HA 1.0 0.0 5.0 1415 955 A 81 LEU HB2 A 81 LEU HDx% 1.0 0.0 5.0 1416 955 A 81 LEU HB3 A 81 LEU HDx% 1.0 0.0 5.0 1417 955 A 81 LEU HDy% A 81 LEU HB3 1.0 0.0 5.0 1418 955 A 81 LEU HDy% A 81 LEU HB2 1.0 0.0 5.0 1419 956 A 81 LEU H A 82 ILE H 1.0 0.0 2.8 1420 957 A 82 ILE H A 81 LEU HDx% 1.0 0.0 5.0 1421 957 A 81 LEU HDy% A 82 ILE H 1.0 0.0 5.0 1422 958 A 81 LEU HA A 84 GLU H 1.0 0.0 3.5 1423 959 A 86 TYR HD% A 81 LEU HA 1.0 0.0 3.5 1424 960 A 86 TYR HE% A 81 LEU HA 1.0 0.0 3.5 1425 961 A 86 TYR HA A 81 LEU HDx% 1.0 0.0 5.0 1426 961 A 81 LEU HDy% A 86 TYR HA 1.0 0.0 5.0 1427 962 A 81 LEU HDy% A 86 TYR HB2 1.0 0.0 2.8 1428 962 A 81 LEU HDx% A 86 TYR HB2 1.0 0.0 2.8 1429 962 A 86 TYR HB3 A 81 LEU HDx% 1.0 0.0 2.8 1430 962 A 81 LEU HDy% A 86 TYR HB3 1.0 0.0 2.8 1431 963 A 86 TYR HD% A 81 LEU HDx% 1.0 0.0 2.8 1432 963 A 81 LEU HDy% A 86 TYR HD% 1.0 0.0 2.8 1433 964 A 86 TYR HE% A 81 LEU HDx% 1.0 0.0 2.8 1434 964 A 81 LEU HDy% A 86 TYR HE% 1.0 0.0 2.8 1435 965 A 82 ILE H A 82 ILE HA 1.0 0.0 5.0 1436 966 A 82 ILE H A 82 ILE HB 1.0 0.0 5.0 1437 967 A 82 ILE H A 82 ILE HG2% 1.0 0.0 5.0 1438 968 A 82 ILE HD1% A 82 ILE H 1.0 0.0 5.0 1439 969 A 82 ILE HB A 82 ILE HA 1.0 0.0 5.0 1440 970 A 82 ILE HG2% A 82 ILE HA 1.0 0.0 5.0 1441 971 A 82 ILE HD1% A 82 ILE HA 1.0 0.0 5.0 1442 972 A 82 ILE HB A 82 ILE HG2% 1.0 0.0 5.0 1443 973 A 82 ILE HG2% A 82 ILE HG1y 1.0 0.0 5.0 1444 973 A 82 ILE HG2% A 82 ILE HG1x 1.0 0.0 5.0 1445 974 A 82 ILE HD1% A 82 ILE HG1y 1.0 0.0 5.0 1446 974 A 82 ILE HD1% A 82 ILE HG1x 1.0 0.0 5.0 1447 975 A 82 ILE HD1% A 82 ILE HG2% 1.0 0.0 5.0 1448 976 A 82 ILE H A 83 LYS H 1.0 0.0 2.8 1449 977 A 82 ILE HG2% A 83 LYS H 1.0 0.0 5.0 1450 978 A 82 ILE HD1% A 83 LYS H 1.0 0.0 5.0 1451 979 A 87 ALA HB% A 82 ILE HA 1.0 0.0 5.0 1452 980 A 82 ILE HG2% A 87 ALA H 1.0 0.0 5.0 1453 981 A 87 ALA HB% A 82 ILE HG2% 1.0 0.0 5.0 1454 982 A 82 ILE HD1% A 87 ALA H 1.0 0.0 5.0 1455 983 A 87 ALA HB% A 82 ILE HD1% 1.0 0.0 2.3 1456 984 A 82 ILE HG2% A 88 ASP HA 1.0 0.0 5.0 1457 985 A 82 ILE HD1% A 89 LYS H 1.0 0.0 3.5 1458 986 A 82 ILE HD1% A 89 LYS HA 1.0 0.0 3.5 1459 987 A 82 ILE HD1% A 89 LYS HGx 1.0 0.0 3.5 1460 987 A 82 ILE HD1% A 89 LYS HGy 1.0 0.0 3.5 1461 988 A 92 ILE HD1% A 82 ILE HG1y 1.0 0.0 5.0 1462 988 A 92 ILE HD1% A 82 ILE HG1x 1.0 0.0 5.0 1463 989 A 92 ILE HG2% A 82 ILE HD1% 1.0 0.0 5.0 1464 990 A 92 ILE HD1% A 82 ILE HD1% 1.0 0.0 3.5 1465 991 A 83 LYS H A 83 LYS HA 1.0 0.0 5.0 1466 992 A 83 LYS H A 83 LYS HB2 1.0 0.0 5.0 1467 992 A 83 LYS H A 83 LYS HB3 1.0 0.0 5.0 1468 993 A 83 LYS H A 84 GLU H 1.0 0.0 2.8 1469 994 A 84 GLU H A 83 LYS HA 1.0 0.0 3.5 1470 995 A 84 GLU H A 83 LYS HB2 1.0 0.0 5.0 1471 995 A 84 GLU H A 83 LYS HB3 1.0 0.0 5.0 1472 996 A 84 GLU H A 84 GLU HA 1.0 0.0 5.0 1473 997 A 84 GLU H A 84 GLU HB2 1.0 0.0 2.8 1474 998 A 84 GLU H A 84 GLU HGx 1.0 0.0 5.0 1475 998 A 84 GLU H A 84 GLU HGy 1.0 0.0 5.0 1476 999 A 84 GLU HA A 84 GLU HB3 1.0 0.0 2.8 1477 1000 A 84 GLU HA A 84 GLU HB3 1.0 0.0 5.0 1478 1000 A 84 GLU HA A 84 GLU HB2 1.0 0.0 5.0 1479 1001 A 84 GLU HA A 84 GLU HGx 1.0 0.0 5.0 1480 1001 A 84 GLU HGy A 84 GLU HA 1.0 0.0 5.0 1481 1002 A 84 GLU H A 85 LYS H 1.0 0.0 5.0 1482 1003 A 84 GLU HA A 85 LYS H 1.0 0.0 3.5 1483 1004 A 85 LYS H A 84 GLU HB3 1.0 0.0 3.5 1484 1004 A 84 GLU HB2 A 85 LYS H 1.0 0.0 3.5 1485 1005 A 86 TYR HD% A 84 GLU H 1.0 0.0 5.0 1486 1006 A 86 TYR HE% A 84 GLU H 1.0 0.0 5.0 1487 1007 A 86 TYR HD% A 84 GLU HA 1.0 0.0 5.0 1488 1008 A 86 TYR HD% A 84 GLU HB3 1.0 0.0 2.8 1489 1008 A 86 TYR HD% A 84 GLU HB2 1.0 0.0 2.8 1490 1009 A 86 TYR HE% A 84 GLU HB3 1.0 0.0 2.8 1491 1009 A 86 TYR HE% A 84 GLU HB2 1.0 0.0 2.8 1492 1010 A 86 TYR HD% A 84 GLU HGx 1.0 0.0 5.0 1493 1010 A 86 TYR HD% A 84 GLU HGy 1.0 0.0 5.0 1494 1011 A 86 TYR HE% A 84 GLU HGx 1.0 0.0 3.5 1495 1011 A 86 TYR HE% A 84 GLU HGy 1.0 0.0 3.5 1496 1012 A 85 LYS H A 85 LYS HA 1.0 0.0 3.5 1497 1013 A 85 LYS H A 85 LYS HBx 1.0 0.0 5.0 1498 1013 A 85 LYS H A 85 LYS HBy 1.0 0.0 5.0 1499 1014 A 85 LYS HA A 85 LYS HBx 1.0 0.0 5.0 1500 1014 A 85 LYS HA A 85 LYS HBy 1.0 0.0 5.0 1501 1015 A 86 TYR H A 85 LYS H 1.0 0.0 5.0 1502 1016 A 86 TYR HD% A 85 LYS H 1.0 0.0 2.8 1503 1017 A 86 TYR HE% A 85 LYS H 1.0 0.0 5.0 1504 1018 A 86 TYR H A 85 LYS HA 1.0 0.0 2.8 1505 1019 A 86 TYR HD% A 85 LYS HA 1.0 0.0 3.5 1506 1020 A 86 TYR H A 85 LYS HBx 1.0 0.0 5.0 1507 1020 A 86 TYR H A 85 LYS HBy 1.0 0.0 5.0 1508 1021 A 86 TYR H A 86 TYR HB2 1.0 0.0 2.8 1509 1022 A 86 TYR HD% A 86 TYR H 1.0 0.0 3.5 1510 1023 A 86 TYR HB3 A 86 TYR HA 1.0 0.0 2.8 1511 1024 A 86 TYR HD% A 86 TYR HA 1.0 0.0 5.0 1512 1025 A 86 TYR HE% A 86 TYR HA 1.0 0.0 5.0 1513 1026 A 86 TYR HD% A 86 TYR HB2 1.0 0.0 5.0 1514 1026 A 86 TYR HD% A 86 TYR HB3 1.0 0.0 5.0 1515 1027 A 86 TYR HE% A 86 TYR HB2 1.0 0.0 5.0 1516 1027 A 86 TYR HE% A 86 TYR HB3 1.0 0.0 5.0 1517 1028 A 86 TYR H A 87 ALA H 1.0 0.0 2.8 1518 1029 A 86 TYR HA A 87 ALA H 1.0 0.0 3.5 1519 1030 A 87 ALA H A 86 TYR HB2 1.0 0.0 5.0 1520 1030 A 86 TYR HB3 A 87 ALA H 1.0 0.0 5.0 1521 1031 A 86 TYR HD% A 87 ALA H 1.0 0.0 5.0 1522 1032 A 87 ALA H A 87 ALA HA 1.0 0.0 5.0 1523 1033 A 87 ALA HB% A 87 ALA H 1.0 0.0 5.0 1524 1034 A 87 ALA HB% A 87 ALA HA 1.0 0.0 5.0 1525 1035 A 87 ALA H A 88 ASP H 1.0 0.0 5.0 1526 1036 A 87 ALA HA A 88 ASP H 1.0 0.0 2.8 1527 1037 A 87 ALA HB% A 88 ASP H 1.0 0.0 3.5 1528 1038 A 87 ALA HB% A 88 ASP HA 1.0 0.0 5.0 1529 1039 A 87 ALA HB% A 88 ASP HB3 1.0 0.0 5.0 1530 1039 A 87 ALA HB% A 88 ASP HB2 1.0 0.0 5.0 1531 1040 A 88 ASP HA A 88 ASP H 1.0 0.0 5.0 1532 1041 A 88 ASP H A 88 ASP HB3 1.0 0.0 2.8 1533 1042 A 88 ASP H A 88 ASP HB2 1.0 0.0 2.8 1534 1043 A 88 ASP HA A 88 ASP HB2 1.0 0.0 2.8 1535 1044 A 88 ASP HA A 88 ASP HB3 1.0 0.0 5.0 1536 1044 A 88 ASP HA A 88 ASP HB2 1.0 0.0 5.0 1537 1045 A 88 ASP HA A 89 LYS H 1.0 0.0 2.8 1538 1046 A 88 ASP HA A 90 LEU H 1.0 0.0 5.0 1539 1047 A 88 ASP HB3 A 91 LEU HDx% 1.0 0.0 5.0 1540 1047 A 88 ASP HB2 A 91 LEU HDx% 1.0 0.0 5.0 1541 1047 A 91 LEU HDy% A 88 ASP HB3 1.0 0.0 5.0 1542 1047 A 91 LEU HDy% A 88 ASP HB2 1.0 0.0 5.0 1543 1048 A 89 LYS H A 89 LYS HA 1.0 0.0 5.0 1544 1049 A 89 LYS H A 89 LYS HB2 1.0 0.0 2.8 1545 1050 A 89 LYS HA A 89 LYS HB3 1.0 0.0 2.8 1546 1051 A 89 LYS H A 90 LEU H 1.0 0.0 2.8 1547 1052 A 89 LYS HA A 90 LEU H 1.0 0.0 5.0 1548 1053 A 89 LYS HA A 92 ILE H 1.0 0.0 3.5 1549 1054 A 92 ILE HG2% A 89 LYS HA 1.0 0.0 5.0 1550 1055 A 89 LYS HA A 93 ALA HB% 1.0 0.0 5.0 1551 1056 A 90 LEU H A 90 LEU HA 1.0 0.0 5.0 1552 1057 A 90 LEU H A 90 LEU HBx 1.0 0.0 5.0 1553 1057 A 90 LEU H A 90 LEU HBy 1.0 0.0 5.0 1554 1058 A 90 LEU H A 90 LEU HG 1.0 0.0 5.0 1555 1059 A 90 LEU H A 90 LEU HDx% 1.0 0.0 5.0 1556 1059 A 90 LEU H A 90 LEU HDy% 1.0 0.0 5.0 1557 1060 A 90 LEU HA A 90 LEU HBx 1.0 0.0 5.0 1558 1060 A 90 LEU HA A 90 LEU HBy 1.0 0.0 5.0 1559 1061 A 90 LEU HA A 90 LEU HDx% 1.0 0.0 5.0 1560 1061 A 90 LEU HA A 90 LEU HDy% 1.0 0.0 5.0 1561 1062 A 90 LEU HG A 90 LEU HBx 1.0 0.0 5.0 1562 1062 A 90 LEU HBy A 90 LEU HG 1.0 0.0 5.0 1563 1063 A 90 LEU HBx A 90 LEU HDx% 1.0 0.0 5.0 1564 1063 A 90 LEU HBy A 90 LEU HDx% 1.0 0.0 5.0 1565 1063 A 90 LEU HDy% A 90 LEU HBx 1.0 0.0 5.0 1566 1063 A 90 LEU HBy A 90 LEU HDy% 1.0 0.0 5.0 1567 1064 A 90 LEU HG A 90 LEU HDx% 1.0 0.0 5.0 1568 1064 A 90 LEU HG A 90 LEU HDy% 1.0 0.0 5.0 1569 1065 A 90 LEU H A 91 LEU H 1.0 0.0 2.8 1570 1066 A 90 LEU HA A 91 LEU H 1.0 0.0 5.0 1571 1067 A 91 LEU H A 90 LEU HBx 1.0 0.0 5.0 1572 1067 A 90 LEU HBy A 91 LEU H 1.0 0.0 5.0 1573 1068 A 91 LEU H A 90 LEU HDx% 1.0 0.0 5.0 1574 1068 A 90 LEU HDy% A 91 LEU H 1.0 0.0 5.0 1575 1069 A 90 LEU HA A 93 ALA H 1.0 0.0 3.5 1576 1070 A 93 ALA HB% A 90 LEU HA 1.0 0.0 3.5 1577 1071 A 93 ALA H A 90 LEU HDx% 1.0 0.0 5.0 1578 1071 A 90 LEU HDy% A 93 ALA H 1.0 0.0 5.0 1579 1072 A 93 ALA HB% A 90 LEU HDx% 1.0 0.0 5.0 1580 1072 A 93 ALA HB% A 90 LEU HDy% 1.0 0.0 5.0 1581 1073 A 90 LEU HDx% A 94 LYS HB3 1.0 0.0 5.0 1582 1073 A 90 LEU HDy% A 94 LYS HB3 1.0 0.0 5.0 1583 1073 A 94 LYS HB2 A 90 LEU HDx% 1.0 0.0 5.0 1584 1073 A 90 LEU HDy% A 94 LYS HB2 1.0 0.0 5.0 1585 1074 A 90 LEU HBx A 106 LEU HDx% 1.0 0.0 2.3 1586 1074 A 90 LEU HBy A 106 LEU HDx% 1.0 0.0 2.3 1587 1074 A 106 LEU HDy% A 90 LEU HBx 1.0 0.0 2.3 1588 1074 A 90 LEU HBy A 106 LEU HDy% 1.0 0.0 2.3 1589 1075 A 90 LEU HG A 106 LEU HDx% 1.0 0.0 2.3 1590 1075 A 90 LEU HG A 106 LEU HDy% 1.0 0.0 2.3 1591 1076 A 91 LEU H A 91 LEU HA 1.0 0.0 5.0 1592 1077 A 91 LEU H A 91 LEU HB3 1.0 0.0 2.8 1593 1078 A 91 LEU H A 91 LEU HB2 1.0 0.0 2.8 1594 1079 A 91 LEU HA A 91 LEU HB2 1.0 0.0 2.8 1595 1080 A 91 LEU HG A 91 LEU HA 1.0 0.0 5.0 1596 1081 A 91 LEU HA A 91 LEU HDx% 1.0 0.0 5.0 1597 1081 A 91 LEU HDy% A 91 LEU HA 1.0 0.0 5.0 1598 1082 A 91 LEU HG A 91 LEU HB3 1.0 0.0 5.0 1599 1082 A 91 LEU HG A 91 LEU HB2 1.0 0.0 5.0 1600 1083 A 91 LEU HG A 91 LEU HDx% 1.0 0.0 5.0 1601 1083 A 91 LEU HDy% A 91 LEU HG 1.0 0.0 5.0 1602 1084 A 92 ILE H A 91 LEU H 1.0 0.0 2.8 1603 1085 A 92 ILE H A 91 LEU HA 1.0 0.0 5.0 1604 1086 A 91 LEU HA A 94 LYS H 1.0 0.0 3.5 1605 1087 A 94 LYS H A 91 LEU HDx% 1.0 0.0 5.0 1606 1087 A 91 LEU HDy% A 94 LYS H 1.0 0.0 5.0 1607 1088 A 91 LEU HG A 95 TRP HH2 1.0 0.0 5.0 1608 1089 A 95 TRP HD1 A 91 LEU HDx% 1.0 0.0 5.0 1609 1089 A 91 LEU HDy% A 95 TRP HD1 1.0 0.0 5.0 1610 1090 A 95 TRP HZ2 A 91 LEU HDx% 1.0 0.0 3.5 1611 1090 A 91 LEU HDy% A 95 TRP HZ2 1.0 0.0 3.5 1612 1091 A 95 TRP HH2 A 91 LEU HDx% 1.0 0.0 3.5 1613 1091 A 91 LEU HDy% A 95 TRP HH2 1.0 0.0 3.5 1614 1092 A 91 LEU HDy% A 103 LEU HBx 1.0 0.0 5.0 1615 1092 A 91 LEU HDx% A 103 LEU HBx 1.0 0.0 5.0 1616 1092 A 103 LEU HBy A 91 LEU HDx% 1.0 0.0 5.0 1617 1092 A 91 LEU HDy% A 103 LEU HBy 1.0 0.0 5.0 1618 1093 A 91 LEU HDx% A 103 LEU HDx% 1.0 0.0 2.8 1619 1093 A 91 LEU HDy% A 103 LEU HDx% 1.0 0.0 2.8 1620 1093 A 103 LEU HDy% A 91 LEU HDx% 1.0 0.0 2.8 1621 1093 A 91 LEU HDy% A 103 LEU HDy% 1.0 0.0 2.8 1622 1094 A 105 CYS H A 91 LEU HDx% 1.0 0.0 5.0 1623 1094 A 91 LEU HDy% A 105 CYS H 1.0 0.0 5.0 1624 1095 A 105 CYS HA A 91 LEU HDx% 1.0 0.0 3.5 1625 1095 A 91 LEU HDy% A 105 CYS HA 1.0 0.0 3.5 1626 1096 A 91 LEU HDx% A 105 CYS HBx 1.0 0.0 5.0 1627 1096 A 91 LEU HDy% A 105 CYS HBx 1.0 0.0 5.0 1628 1096 A 105 CYS HBy A 91 LEU HDx% 1.0 0.0 5.0 1629 1096 A 91 LEU HDy% A 105 CYS HBy 1.0 0.0 5.0 1630 1097 A 91 LEU HA A 106 LEU HDx% 1.0 0.0 2.8 1631 1097 A 106 LEU HDy% A 91 LEU HA 1.0 0.0 2.8 1632 1098 A 91 LEU HB3 A 106 LEU HDx% 1.0 0.0 3.5 1633 1098 A 91 LEU HB2 A 106 LEU HDx% 1.0 0.0 3.5 1634 1098 A 106 LEU HDy% A 91 LEU HB3 1.0 0.0 3.5 1635 1098 A 106 LEU HDy% A 91 LEU HB2 1.0 0.0 3.5 1636 1099 A 91 LEU HG A 106 LEU HDx% 1.0 0.0 5.0 1637 1099 A 91 LEU HG A 106 LEU HDy% 1.0 0.0 5.0 1638 1100 A 106 LEU H A 91 LEU HDx% 1.0 0.0 5.0 1639 1100 A 91 LEU HDy% A 106 LEU H 1.0 0.0 5.0 1640 1101 A 106 LEU HA A 91 LEU HDx% 1.0 0.0 3.5 1641 1101 A 91 LEU HDy% A 106 LEU HA 1.0 0.0 3.5 1642 1102 A 91 LEU HDy% A 106 LEU HB3 1.0 0.0 3.5 1643 1102 A 91 LEU HDx% A 106 LEU HB3 1.0 0.0 3.5 1644 1102 A 106 LEU HB2 A 91 LEU HDx% 1.0 0.0 3.5 1645 1102 A 91 LEU HDy% A 106 LEU HB2 1.0 0.0 3.5 1646 1103 A 106 LEU HG A 91 LEU HDx% 1.0 0.0 5.0 1647 1103 A 91 LEU HDy% A 106 LEU HG 1.0 0.0 5.0 1648 1104 A 91 LEU HDy% A 106 LEU HDx% 1.0 0.0 2.3 1649 1104 A 106 LEU HDy% A 91 LEU HDx% 1.0 0.0 2.3 1650 1104 A 91 LEU HDy% A 106 LEU HDy% 1.0 0.0 2.3 1651 1104 A 91 LEU HDx% A 106 LEU HDx% 1.0 0.0 2.3 1652 1105 A 109 ILE HG2% A 91 LEU HDx% 1.0 0.0 5.0 1653 1105 A 91 LEU HDy% A 109 ILE HG2% 1.0 0.0 5.0 1654 1106 A 109 ILE HD1% A 91 LEU HDx% 1.0 0.0 5.0 1655 1106 A 91 LEU HDy% A 109 ILE HD1% 1.0 0.0 5.0 1656 1107 A 92 ILE H A 92 ILE HA 1.0 0.0 5.0 1657 1108 A 92 ILE HG2% A 92 ILE H 1.0 0.0 5.0 1658 1109 A 92 ILE HD1% A 92 ILE H 1.0 0.0 5.0 1659 1110 A 92 ILE HA A 92 ILE HB 1.0 0.0 5.0 1660 1111 A 92 ILE HG2% A 92 ILE HA 1.0 0.0 5.0 1661 1112 A 92 ILE HD1% A 92 ILE HA 1.0 0.0 5.0 1662 1113 A 92 ILE HD1% A 92 ILE HB 1.0 0.0 5.0 1663 1114 A 92 ILE HD1% A 92 ILE HG2% 1.0 0.0 5.0 1664 1115 A 92 ILE H A 93 ALA H 1.0 0.0 2.8 1665 1116 A 93 ALA H A 92 ILE HA 1.0 0.0 5.0 1666 1117 A 93 ALA H A 92 ILE HB 1.0 0.0 5.0 1667 1118 A 92 ILE HG2% A 93 ALA H 1.0 0.0 5.0 1668 1119 A 92 ILE HD1% A 93 ALA H 1.0 0.0 5.0 1669 1120 A 92 ILE HA A 95 TRP H 1.0 0.0 3.5 1670 1121 A 92 ILE HA A 95 TRP HE3 1.0 0.0 5.0 1671 1122 A 95 TRP HE3 A 92 ILE HG12 1.0 0.0 5.0 1672 1122 A 95 TRP HE3 A 92 ILE HG13 1.0 0.0 5.0 1673 1123 A 92 ILE HG2% A 96 ARG HB2 1.0 0.0 5.0 1674 1123 A 92 ILE HG2% A 96 ARG HB3 1.0 0.0 5.0 1675 1124 A 92 ILE HG2% A 96 ARG HGx 1.0 0.0 5.0 1676 1124 A 92 ILE HG2% A 96 ARG HGy 1.0 0.0 5.0 1677 1125 A 92 ILE HG2% A 96 ARG HD2 1.0 0.0 5.0 1678 1125 A 92 ILE HG2% A 96 ARG HD3 1.0 0.0 5.0 1679 1126 A 93 ALA H A 93 ALA HA 1.0 0.0 5.0 1680 1127 A 93 ALA HB% A 93 ALA H 1.0 0.0 5.0 1681 1128 A 93 ALA H A 94 LYS H 1.0 0.0 2.8 1682 1129 A 94 LYS H A 93 ALA HA 1.0 0.0 5.0 1683 1130 A 93 ALA HB% A 94 LYS H 1.0 0.0 5.0 1684 1131 A 93 ALA H A 95 TRP H 1.0 0.0 5.0 1685 1132 A 93 ALA HA A 96 ARG H 1.0 0.0 3.5 1686 1133 A 93 ALA HA A 96 ARG HD2 1.0 0.0 3.5 1687 1133 A 96 ARG HD3 A 93 ALA HA 1.0 0.0 3.5 1688 1134 A 93 ALA HB% A 97 LYS HB3 1.0 0.0 5.0 1689 1134 A 93 ALA HB% A 97 LYS HB2 1.0 0.0 5.0 1690 1135 A 93 ALA HB% A 97 LYS HE2 1.0 0.0 5.0 1691 1135 A 93 ALA HB% A 97 LYS HE3 1.0 0.0 5.0 1692 1136 A 93 ALA HB% A 106 LEU HDx% 1.0 0.0 5.0 1693 1136 A 93 ALA HB% A 106 LEU HDy% 1.0 0.0 5.0 1694 1137 A 94 LYS HB2 A 94 LYS H 1.0 0.0 2.8 1695 1138 A 94 LYS HA A 94 LYS HB3 1.0 0.0 2.8 1696 1139 A 94 LYS HA A 94 LYS HG2 1.0 0.0 5.0 1697 1139 A 94 LYS HA A 94 LYS HG3 1.0 0.0 5.0 1698 1140 A 94 LYS HA A 94 LYS HD2 1.0 0.0 5.0 1699 1140 A 94 LYS HA A 94 LYS HD3 1.0 0.0 5.0 1700 1141 A 94 LYS HEx A 94 LYS HG2 1.0 0.0 5.0 1701 1141 A 94 LYS HEy A 94 LYS HG2 1.0 0.0 5.0 1702 1141 A 94 LYS HG3 A 94 LYS HEx 1.0 0.0 5.0 1703 1141 A 94 LYS HG3 A 94 LYS HEy 1.0 0.0 5.0 1704 1142 A 94 LYS HD3 A 94 LYS HEx 1.0 0.0 5.0 1705 1142 A 94 LYS HD2 A 94 LYS HEx 1.0 0.0 5.0 1706 1142 A 94 LYS HEy A 94 LYS HD2 1.0 0.0 5.0 1707 1142 A 94 LYS HD3 A 94 LYS HEy 1.0 0.0 5.0 1708 1143 A 94 LYS H A 95 TRP H 1.0 0.0 2.8 1709 1144 A 95 TRP H A 94 LYS HA 1.0 0.0 5.0 1710 1145 A 95 TRP H A 94 LYS HB3 1.0 0.0 5.0 1711 1145 A 94 LYS HB2 A 95 TRP H 1.0 0.0 5.0 1712 1146 A 96 ARG H A 94 LYS HA 1.0 0.0 5.0 1713 1147 A 94 LYS HA A 97 LYS H 1.0 0.0 3.5 1714 1148 A 94 LYS HA A 97 LYS HB3 1.0 0.0 3.5 1715 1148 A 97 LYS HB2 A 94 LYS HA 1.0 0.0 3.5 1716 1149 A 94 LYS HA A 97 LYS HGx 1.0 0.0 5.0 1717 1149 A 94 LYS HA A 97 LYS HGy 1.0 0.0 5.0 1718 1150 A 94 LYS HA A 106 LEU HDx% 1.0 0.0 5.0 1719 1150 A 106 LEU HDy% A 94 LYS HA 1.0 0.0 5.0 1720 1151 A 94 LYS HB3 A 106 LEU HDx% 1.0 0.0 2.8 1721 1151 A 94 LYS HB2 A 106 LEU HDx% 1.0 0.0 2.8 1722 1151 A 106 LEU HDy% A 94 LYS HB3 1.0 0.0 2.8 1723 1151 A 94 LYS HB2 A 106 LEU HDy% 1.0 0.0 2.8 1724 1152 A 94 LYS HEy A 106 LEU HDx% 1.0 0.0 2.8 1725 1152 A 94 LYS HEx A 106 LEU HDx% 1.0 0.0 2.8 1726 1152 A 106 LEU HDy% A 94 LYS HEx 1.0 0.0 2.8 1727 1152 A 106 LEU HDy% A 94 LYS HEy 1.0 0.0 2.8 1728 1153 A 94 LYS HB2 A 109 ILE HD1% 1.0 0.0 3.5 1729 1153 A 109 ILE HD1% A 94 LYS HB3 1.0 0.0 3.5 1730 1154 A 109 ILE HD1% A 94 LYS HG2 1.0 0.0 2.8 1731 1154 A 94 LYS HG3 A 109 ILE HD1% 1.0 0.0 2.8 1732 1155 A 94 LYS HD3 A 109 ILE HD1% 1.0 0.0 3.5 1733 1155 A 109 ILE HD1% A 94 LYS HD2 1.0 0.0 3.5 1734 1156 A 94 LYS HEy A 109 ILE HD1% 1.0 0.0 2.3 1735 1156 A 109 ILE HD1% A 94 LYS HEx 1.0 0.0 2.3 1736 1157 A 95 TRP H A 95 TRP HA 1.0 0.0 5.0 1737 1158 A 95 TRP H A 95 TRP HB2 1.0 0.0 2.8 1738 1159 A 95 TRP H A 95 TRP HB2 1.0 0.0 5.0 1739 1159 A 95 TRP H A 95 TRP HB3 1.0 0.0 5.0 1740 1160 A 95 TRP HD1 A 95 TRP H 1.0 0.0 5.0 1741 1161 A 95 TRP H A 95 TRP HE3 1.0 0.0 5.0 1742 1162 A 95 TRP HA A 95 TRP HB3 1.0 0.0 2.8 1743 1163 A 95 TRP H A 96 ARG H 1.0 0.0 2.8 1744 1164 A 96 ARG H A 95 TRP HA 1.0 0.0 3.5 1745 1165 A 96 ARG H A 95 TRP HB2 1.0 0.0 5.0 1746 1165 A 96 ARG H A 95 TRP HB3 1.0 0.0 5.0 1747 1166 A 95 TRP HE3 A 96 ARG HD2 1.0 0.0 5.0 1748 1166 A 95 TRP HE3 A 96 ARG HD3 1.0 0.0 5.0 1749 1167 A 95 TRP H A 97 LYS H 1.0 0.0 5.0 1750 1168 A 96 ARG H A 96 ARG HA 1.0 0.0 5.0 1751 1169 A 96 ARG H A 96 ARG HB2 1.0 0.0 2.8 1752 1170 A 96 ARG H A 96 ARG HD2 1.0 0.0 5.0 1753 1170 A 96 ARG HD3 A 96 ARG H 1.0 0.0 5.0 1754 1171 A 96 ARG HB3 A 96 ARG HA 1.0 0.0 2.8 1755 1172 A 96 ARG H A 97 LYS H 1.0 0.0 2.8 1756 1173 A 97 LYS H A 96 ARG HA 1.0 0.0 3.5 1757 1174 A 97 LYS H A 97 LYS HA 1.0 0.0 5.0 1758 1175 A 97 LYS HB2 A 97 LYS H 1.0 0.0 2.8 1759 1176 A 97 LYS H A 97 LYS HB3 1.0 0.0 5.0 1760 1176 A 97 LYS HB2 A 97 LYS H 1.0 0.0 5.0 1761 1177 A 97 LYS H A 97 LYS HGx 1.0 0.0 5.0 1762 1177 A 97 LYS H A 97 LYS HGy 1.0 0.0 5.0 1763 1178 A 97 LYS HA A 97 LYS HB3 1.0 0.0 2.8 1764 1179 A 97 LYS HA A 97 LYS HB3 1.0 0.0 5.0 1765 1179 A 97 LYS HB2 A 97 LYS HA 1.0 0.0 5.0 1766 1180 A 97 LYS HA A 97 LYS HGx 1.0 0.0 5.0 1767 1180 A 97 LYS HGy A 97 LYS HA 1.0 0.0 5.0 1768 1181 A 97 LYS HB2 A 97 LYS HGx 1.0 0.0 5.0 1769 1181 A 97 LYS HGy A 97 LYS HB3 1.0 0.0 5.0 1770 1181 A 97 LYS HB2 A 97 LYS HGy 1.0 0.0 5.0 1771 1181 A 97 LYS HB3 A 97 LYS HGx 1.0 0.0 5.0 1772 1182 A 97 LYS HB3 A 97 LYS HE2 1.0 0.0 5.0 1773 1182 A 97 LYS HB2 A 97 LYS HE2 1.0 0.0 5.0 1774 1182 A 97 LYS HE3 A 97 LYS HB3 1.0 0.0 5.0 1775 1182 A 97 LYS HB2 A 97 LYS HE3 1.0 0.0 5.0 1776 1183 A 97 LYS H A 98 THR H 1.0 0.0 5.0 1777 1184 A 97 LYS HA A 98 THR H 1.0 0.0 3.5 1778 1185 A 98 THR H A 97 LYS HB3 1.0 0.0 5.0 1779 1185 A 97 LYS HB2 A 98 THR H 1.0 0.0 5.0 1780 1186 A 100 TYR H A 97 LYS HB3 1.0 0.0 5.0 1781 1186 A 97 LYS HB2 A 100 TYR H 1.0 0.0 5.0 1782 1187 A 100 TYR HD% A 97 LYS HB3 1.0 0.0 2.8 1783 1187 A 97 LYS HB2 A 100 TYR HD% 1.0 0.0 2.8 1784 1188 A 100 TYR HE% A 97 LYS HB3 1.0 0.0 2.8 1785 1188 A 97 LYS HB2 A 100 TYR HE% 1.0 0.0 2.8 1786 1189 A 100 TYR HD% A 97 LYS HGx 1.0 0.0 3.5 1787 1189 A 97 LYS HGy A 100 TYR HD% 1.0 0.0 3.5 1788 1190 A 100 TYR HE% A 97 LYS HGx 1.0 0.0 2.8 1789 1190 A 97 LYS HGy A 100 TYR HE% 1.0 0.0 2.8 1790 1191 A 98 THR H A 98 THR HA 1.0 0.0 5.0 1791 1192 A 98 THR H A 98 THR HB 1.0 0.0 5.0 1792 1193 A 98 THR H A 98 THR HG2% 1.0 0.0 5.0 1793 1194 A 98 THR HA A 98 THR HB 1.0 0.0 5.0 1794 1195 A 98 THR HA A 98 THR HG2% 1.0 0.0 5.0 1795 1196 A 98 THR H A 99 GLY H 1.0 0.0 5.0 1796 1197 A 98 THR HA A 99 GLY H 1.0 0.0 3.5 1797 1198 A 98 THR HA A 99 GLY HAx 1.0 0.0 5.0 1798 1198 A 98 THR HA A 99 GLY HAy 1.0 0.0 5.0 1799 1199 A 98 THR HB A 99 GLY H 1.0 0.0 5.0 1800 1200 A 98 THR HG2% A 99 GLY H 1.0 0.0 5.0 1801 1201 A 98 THR HG2% A 99 GLY HAx 1.0 0.0 5.0 1802 1201 A 98 THR HG2% A 99 GLY HAy 1.0 0.0 5.0 1803 1202 A 100 TYR H A 98 THR HA 1.0 0.0 3.5 1804 1203 A 100 TYR H A 98 THR HG2% 1.0 0.0 5.0 1805 1204 A 99 GLY H A 99 GLY HAx 1.0 0.0 5.0 1806 1204 A 99 GLY H A 99 GLY HAy 1.0 0.0 5.0 1807 1205 A 100 TYR H A 99 GLY H 1.0 0.0 2.8 1808 1206 A 100 TYR H A 99 GLY HAx 1.0 0.0 3.5 1809 1206 A 100 TYR H A 99 GLY HAy 1.0 0.0 3.5 1810 1207 A 99 GLY H A 101 GLU H 1.0 0.0 5.0 1811 1208 A 100 TYR H A 100 TYR HA 1.0 0.0 5.0 1812 1209 A 100 TYR H A 100 TYR HB2 1.0 0.0 2.8 1813 1210 A 100 TYR H A 100 TYR HB2 1.0 0.0 5.0 1814 1210 A 100 TYR H A 100 TYR HB3 1.0 0.0 5.0 1815 1211 A 100 TYR H A 100 TYR HD% 1.0 0.0 5.0 1816 1212 A 100 TYR H A 100 TYR HE% 1.0 0.0 5.0 1817 1213 A 100 TYR HA A 100 TYR HB3 1.0 0.0 2.8 1818 1214 A 100 TYR HD% A 100 TYR HB2 1.0 0.0 5.0 1819 1214 A 100 TYR HD% A 100 TYR HB3 1.0 0.0 5.0 1820 1215 A 100 TYR HD% A 100 TYR HE% 1.0 0.0 5.0 1821 1216 A 100 TYR H A 101 GLU H 1.0 0.0 3.5 1822 1217 A 101 GLU H A 100 TYR HA 1.0 0.0 2.8 1823 1218 A 101 GLU H A 100 TYR HB2 1.0 0.0 5.0 1824 1218 A 101 GLU H A 100 TYR HB3 1.0 0.0 5.0 1825 1219 A 100 TYR HB3 A 103 LEU HDx% 1.0 0.0 3.5 1826 1219 A 100 TYR HB2 A 103 LEU HDx% 1.0 0.0 3.5 1827 1219 A 103 LEU HDy% A 100 TYR HB2 1.0 0.0 3.5 1828 1219 A 103 LEU HDy% A 100 TYR HB3 1.0 0.0 3.5 1829 1220 A 100 TYR HD% A 103 LEU HDx% 1.0 0.0 3.5 1830 1220 A 103 LEU HDy% A 100 TYR HD% 1.0 0.0 3.5 1831 1221 A 100 TYR HE% A 103 LEU HDx% 1.0 0.0 5.0 1832 1221 A 103 LEU HDy% A 100 TYR HE% 1.0 0.0 5.0 1833 1222 A 100 TYR HB3 A 109 ILE HD1% 1.0 0.0 5.0 1834 1222 A 109 ILE HD1% A 100 TYR HB2 1.0 0.0 5.0 1835 1223 A 109 ILE HG2% A 100 TYR HD% 1.0 0.0 5.0 1836 1224 A 100 TYR HD% A 109 ILE HD1% 1.0 0.0 2.8 1837 1225 A 109 ILE HG2% A 100 TYR HE% 1.0 0.0 5.0 1838 1226 A 100 TYR HE% A 109 ILE HD1% 1.0 0.0 2.8 1839 1227 A 101 GLU H A 101 GLU HA 1.0 0.0 5.0 1840 1228 A 101 GLU H A 101 GLU HB2 1.0 0.0 5.0 1841 1228 A 101 GLU H A 101 GLU HB3 1.0 0.0 5.0 1842 1229 A 101 GLU HA A 102 LYS H 1.0 0.0 5.0 1843 1230 A 102 LYS H A 101 GLU HB2 1.0 0.0 2.8 1844 1230 A 101 GLU HB3 A 102 LYS H 1.0 0.0 2.8 1845 1231 A 102 LYS H A 102 LYS HA 1.0 0.0 3.5 1846 1232 A 102 LYS H A 102 LYS HB2 1.0 0.0 2.8 1847 1233 A 102 LYS HA A 102 LYS HB3 1.0 0.0 2.8 1848 1234 A 102 LYS H A 103 LEU H 1.0 0.0 5.0 1849 1235 A 102 LYS HA A 103 LEU H 1.0 0.0 3.5 1850 1236 A 153 CYS HA A 102 LYS HB3 1.0 0.0 3.5 1851 1236 A 102 LYS HB2 A 153 CYS HA 1.0 0.0 3.5 1852 1237 A 153 CYS HA A 102 LYS HGx 1.0 0.0 5.0 1853 1237 A 153 CYS HA A 102 LYS HGy 1.0 0.0 5.0 1854 1238 A 153 CYS HA A 102 LYS HDx 1.0 0.0 3.5 1855 1238 A 153 CYS HA A 102 LYS HDy 1.0 0.0 3.5 1856 1239 A 153 CYS HA A 102 LYS HE2 1.0 0.0 3.5 1857 1239 A 153 CYS HA A 102 LYS HE3 1.0 0.0 3.5 1858 1240 A 155 SER HA A 102 LYS HB3 1.0 0.0 2.8 1859 1240 A 102 LYS HB2 A 155 SER HA 1.0 0.0 2.8 1860 1241 A 155 SER HA A 102 LYS HGx 1.0 0.0 3.5 1861 1241 A 102 LYS HGy A 155 SER HA 1.0 0.0 3.5 1862 1242 A 102 LYS HGy A 155 SER HB3 1.0 0.0 3.5 1863 1242 A 102 LYS HGx A 155 SER HB3 1.0 0.0 3.5 1864 1242 A 155 SER HB2 A 102 LYS HGx 1.0 0.0 3.5 1865 1242 A 102 LYS HGy A 155 SER HB2 1.0 0.0 3.5 1866 1243 A 155 SER HA A 102 LYS HE2 1.0 0.0 3.5 1867 1243 A 102 LYS HE3 A 155 SER HA 1.0 0.0 3.5 1868 1244 A 103 LEU H A 103 LEU HA 1.0 0.0 5.0 1869 1245 A 103 LEU H A 103 LEU HBx 1.0 0.0 5.0 1870 1245 A 103 LEU HBy A 103 LEU H 1.0 0.0 5.0 1871 1246 A 103 LEU H A 103 LEU HDx% 1.0 0.0 5.0 1872 1246 A 103 LEU HDy% A 103 LEU H 1.0 0.0 5.0 1873 1247 A 103 LEU HA A 103 LEU HDx% 1.0 0.0 5.0 1874 1247 A 103 LEU HDy% A 103 LEU HA 1.0 0.0 5.0 1875 1248 A 103 LEU HBx A 103 LEU HDx% 1.0 0.0 5.0 1876 1248 A 103 LEU HBy A 103 LEU HDx% 1.0 0.0 5.0 1877 1248 A 103 LEU HDy% A 103 LEU HBx 1.0 0.0 5.0 1878 1248 A 103 LEU HBy A 103 LEU HDy% 1.0 0.0 5.0 1879 1249 A 103 LEU H A 104 CYS H 1.0 0.0 5.0 1880 1250 A 103 LEU HA A 104 CYS H 1.0 0.0 2.8 1881 1251 A 104 CYS H A 103 LEU HDx% 1.0 0.0 3.5 1882 1251 A 103 LEU HDy% A 104 CYS H 1.0 0.0 3.5 1883 1252 A 105 CYS H A 103 LEU HDx% 1.0 0.0 2.8 1884 1252 A 103 LEU HDy% A 105 CYS H 1.0 0.0 2.8 1885 1253 A 106 LEU HA A 103 LEU HDx% 1.0 0.0 5.0 1886 1253 A 103 LEU HDy% A 106 LEU HA 1.0 0.0 5.0 1887 1254 A 103 LEU HDy% A 106 LEU HDx% 1.0 0.0 3.5 1888 1254 A 103 LEU HDx% A 106 LEU HDx% 1.0 0.0 3.5 1889 1254 A 106 LEU HDy% A 103 LEU HDx% 1.0 0.0 3.5 1890 1254 A 106 LEU HDy% A 103 LEU HDy% 1.0 0.0 3.5 1891 1255 A 109 ILE HG2% A 103 LEU HBx 1.0 0.0 3.5 1892 1255 A 103 LEU HBy A 109 ILE HG2% 1.0 0.0 3.5 1893 1256 A 109 ILE HD1% A 103 LEU HBx 1.0 0.0 2.8 1894 1256 A 103 LEU HBy A 109 ILE HD1% 1.0 0.0 2.8 1895 1257 A 109 ILE HG2% A 103 LEU HDx% 1.0 0.0 2.8 1896 1257 A 103 LEU HDy% A 109 ILE HG2% 1.0 0.0 2.8 1897 1258 A 109 ILE HD1% A 103 LEU HDx% 1.0 0.0 2.8 1898 1258 A 103 LEU HDy% A 109 ILE HD1% 1.0 0.0 2.8 1899 1259 A 104 CYS HA A 104 CYS H 1.0 0.0 5.0 1900 1260 A 104 CYS HB3 A 104 CYS H 1.0 0.0 2.8 1901 1261 A 104 CYS HA A 104 CYS HB3 1.0 0.0 2.8 1902 1262 A 104 CYS HA A 104 CYS HB2 1.0 0.0 2.8 1903 1263 A 105 CYS H A 104 CYS H 1.0 0.0 2.8 1904 1264 A 104 CYS HA A 105 CYS H 1.0 0.0 5.0 1905 1265 A 104 CYS HB3 A 105 CYS H 1.0 0.0 5.0 1906 1266 A 105 CYS H A 104 CYS HB2 1.0 0.0 5.0 1907 1267 A 105 CYS H A 105 CYS HBx 1.0 0.0 2.8 1908 1267 A 105 CYS H A 105 CYS HBy 1.0 0.0 2.8 1909 1268 A 105 CYS HA A 105 CYS HBx 1.0 0.0 2.8 1910 1268 A 105 CYS HA A 105 CYS HBy 1.0 0.0 2.8 1911 1269 A 105 CYS H A 106 LEU H 1.0 0.0 5.0 1912 1270 A 106 LEU H A 105 CYS HBx 1.0 0.0 2.8 1913 1270 A 105 CYS HBy A 106 LEU H 1.0 0.0 2.8 1914 1271 A 107 ARG H A 105 CYS HBx 1.0 0.0 3.5 1915 1271 A 105 CYS HBy A 107 ARG H 1.0 0.0 3.5 1916 1272 A 105 CYS HBy A 108 CYS HB2 1.0 0.0 2.8 1917 1272 A 108 CYS HB3 A 105 CYS HBx 1.0 0.0 2.8 1918 1272 A 105 CYS HBy A 108 CYS HB3 1.0 0.0 2.8 1919 1272 A 105 CYS HBx A 108 CYS HB2 1.0 0.0 2.8 1920 1273 A 106 LEU H A 106 LEU HA 1.0 0.0 5.0 1921 1274 A 106 LEU H A 106 LEU HB2 1.0 0.0 2.8 1922 1275 A 106 LEU H A 106 LEU HG 1.0 0.0 5.0 1923 1276 A 106 LEU H A 106 LEU HDx% 1.0 0.0 5.0 1924 1276 A 106 LEU HDy% A 106 LEU H 1.0 0.0 5.0 1925 1277 A 106 LEU HA A 106 LEU HB3 1.0 0.0 2.8 1926 1278 A 106 LEU HA A 106 LEU HB3 1.0 0.0 5.0 1927 1278 A 106 LEU HA A 106 LEU HB2 1.0 0.0 5.0 1928 1279 A 106 LEU HA A 106 LEU HG 1.0 0.0 5.0 1929 1280 A 106 LEU HA A 106 LEU HDx% 1.0 0.0 5.0 1930 1280 A 106 LEU HDy% A 106 LEU HA 1.0 0.0 5.0 1931 1281 A 106 LEU HB2 A 106 LEU HDx% 1.0 0.0 5.0 1932 1281 A 106 LEU HB3 A 106 LEU HDx% 1.0 0.0 5.0 1933 1281 A 106 LEU HDy% A 106 LEU HB3 1.0 0.0 5.0 1934 1281 A 106 LEU HDy% A 106 LEU HB2 1.0 0.0 5.0 1935 1282 A 106 LEU HG A 106 LEU HDx% 1.0 0.0 5.0 1936 1282 A 106 LEU HDy% A 106 LEU HG 1.0 0.0 5.0 1937 1283 A 106 LEU H A 107 ARG H 1.0 0.0 2.8 1938 1284 A 106 LEU HA A 107 ARG H 1.0 0.0 5.0 1939 1285 A 107 ARG H A 106 LEU HB3 1.0 0.0 3.5 1940 1285 A 106 LEU HB2 A 107 ARG H 1.0 0.0 3.5 1941 1286 A 107 ARG H A 106 LEU HDx% 1.0 0.0 5.0 1942 1286 A 106 LEU HDy% A 107 ARG H 1.0 0.0 5.0 1943 1287 A 106 LEU H A 108 CYS H 1.0 0.0 5.0 1944 1288 A 106 LEU HA A 109 ILE HG1x 1.0 0.0 5.0 1945 1288 A 106 LEU HA A 109 ILE HG1y 1.0 0.0 5.0 1946 1289 A 106 LEU HA A 109 ILE HD1% 1.0 0.0 3.5 1947 1290 A 109 ILE HD1% A 106 LEU HDx% 1.0 0.0 3.5 1948 1290 A 106 LEU HDy% A 109 ILE HD1% 1.0 0.0 3.5 1949 1291 A 107 ARG H A 107 ARG HA 1.0 0.0 3.5 1950 1292 A 107 ARG H A 107 ARG HB3 1.0 0.0 2.8 1951 1293 A 107 ARG H A 107 ARG HB2 1.0 0.0 2.8 1952 1294 A 107 ARG HA A 107 ARG HB2 1.0 0.0 2.8 1953 1295 A 107 ARG HA A 107 ARG HD2 1.0 0.0 5.0 1954 1295 A 107 ARG HA A 107 ARG HD3 1.0 0.0 5.0 1955 1296 A 107 ARG H A 108 CYS H 1.0 0.0 2.8 1956 1297 A 108 CYS H A 107 ARG HA 1.0 0.0 5.0 1957 1298 A 108 CYS H A 107 ARG HB2 1.0 0.0 5.0 1958 1298 A 108 CYS H A 107 ARG HB3 1.0 0.0 5.0 1959 1299 A 108 CYS HA A 107 ARG HB2 1.0 0.0 5.0 1960 1299 A 107 ARG HB3 A 108 CYS HA 1.0 0.0 5.0 1961 1300 A 107 ARG H A 109 ILE H 1.0 0.0 5.0 1962 1301 A 107 ARG HA A 110 GLN H 1.0 0.0 5.0 1963 1302 A 107 ARG HA A 110 GLN HGx 1.0 0.0 5.0 1964 1302 A 107 ARG HA A 110 GLN HGy 1.0 0.0 5.0 1965 1303 A 108 CYS HB3 A 108 CYS H 1.0 0.0 2.8 1966 1304 A 108 CYS H A 108 CYS HB2 1.0 0.0 2.8 1967 1305 A 108 CYS HA A 108 CYS HB2 1.0 0.0 2.8 1968 1306 A 108 CYS H A 109 ILE H 1.0 0.0 2.8 1969 1307 A 108 CYS H A 109 ILE HG1x 1.0 0.0 3.5 1970 1307 A 108 CYS H A 109 ILE HG1y 1.0 0.0 3.5 1971 1308 A 109 ILE HG2% A 108 CYS H 1.0 0.0 5.0 1972 1309 A 108 CYS HA A 109 ILE H 1.0 0.0 5.0 1973 1310 A 108 CYS H A 110 GLN H 1.0 0.0 5.0 1974 1311 A 108 CYS HA A 110 GLN H 1.0 0.0 5.0 1975 1312 A 108 CYS HA A 120 CYS H 1.0 0.0 5.0 1976 1313 A 108 CYS HA A 120 CYS HB3 1.0 0.0 3.5 1977 1314 A 108 CYS HA A 120 CYS HB2 1.0 0.0 3.5 1978 1315 A 108 CYS HB3 A 120 CYS HB3 1.0 0.0 5.0 1979 1316 A 108 CYS HB3 A 120 CYS HB2 1.0 0.0 5.0 1980 1317 A 120 CYS HB3 A 108 CYS HB2 1.0 0.0 5.0 1981 1318 A 108 CYS HB2 A 120 CYS HB2 1.0 0.0 5.0 1982 1319 A 108 CYS HA A 147 HIS HD2 1.0 0.0 2.8 1983 1320 A 147 HIS HD2 A 108 CYS HB2 1.0 0.0 5.0 1984 1321 A 109 ILE H A 109 ILE HA 1.0 0.0 5.0 1985 1322 A 109 ILE HD1% A 109 ILE H 1.0 0.0 5.0 1986 1323 A 109 ILE HA A 109 ILE HB 1.0 0.0 5.0 1987 1324 A 109 ILE HG2% A 109 ILE HA 1.0 0.0 5.0 1988 1325 A 109 ILE HD1% A 109 ILE HA 1.0 0.0 5.0 1989 1326 A 109 ILE HG2% A 109 ILE HB 1.0 0.0 5.0 1990 1327 A 109 ILE HD1% A 109 ILE HB 1.0 0.0 5.0 1991 1328 A 109 ILE HG2% A 109 ILE HD1% 1.0 0.0 5.0 1992 1329 A 109 ILE H A 110 GLN H 1.0 0.0 3.5 1993 1330 A 110 GLN H A 109 ILE HA 1.0 0.0 3.5 1994 1331 A 110 GLN H A 109 ILE HG1x 1.0 0.0 5.0 1995 1331 A 109 ILE HG1y A 110 GLN H 1.0 0.0 5.0 1996 1332 A 109 ILE HG2% A 110 GLN H 1.0 0.0 5.0 1997 1333 A 109 ILE HD1% A 110 GLN H 1.0 0.0 5.0 1998 1334 A 109 ILE H A 119 THR HG2% 1.0 0.0 5.0 1999 1335 A 109 ILE HA A 119 THR HG2% 1.0 0.0 2.8 2000 1336 A 109 ILE HB A 119 THR HG2% 1.0 0.0 5.0 2001 1337 A 119 THR HG2% A 109 ILE HG1x 1.0 0.0 5.0 2002 1337 A 109 ILE HG1y A 119 THR HG2% 1.0 0.0 5.0 2003 1338 A 109 ILE HG2% A 119 THR HG2% 1.0 0.0 5.0 2004 1339 A 109 ILE HD1% A 119 THR HG2% 1.0 0.0 5.0 2005 1340 A 110 GLN H A 110 GLN HA 1.0 0.0 5.0 2006 1341 A 110 GLN H A 110 GLN HB2 1.0 0.0 5.0 2007 1341 A 110 GLN H A 110 GLN HB3 1.0 0.0 5.0 2008 1342 A 110 GLN H A 110 GLN HGx 1.0 0.0 5.0 2009 1342 A 110 GLN H A 110 GLN HGy 1.0 0.0 5.0 2010 1343 A 110 GLN HA A 110 GLN HGx 1.0 0.0 5.0 2011 1343 A 110 GLN HGy A 110 GLN HA 1.0 0.0 5.0 2012 1344 A 110 GLN H A 111 LYS H 1.0 0.0 5.0 2013 1345 A 110 GLN HA A 111 LYS H 1.0 0.0 2.8 2014 1346 A 111 LYS H A 110 GLN HGx 1.0 0.0 5.0 2015 1346 A 110 GLN HGy A 111 LYS H 1.0 0.0 5.0 2016 1347 A 111 LYS H A 111 LYS HB2 1.0 0.0 5.0 2017 1347 A 111 LYS H A 111 LYS HB3 1.0 0.0 5.0 2018 1348 A 111 LYS HA A 111 LYS HB2 1.0 0.0 5.0 2019 1348 A 111 LYS HB3 A 111 LYS HA 1.0 0.0 5.0 2020 1349 A 111 LYS HB2 A 111 LYS HE2 1.0 0.0 5.0 2021 1349 A 111 LYS HB3 A 111 LYS HE2 1.0 0.0 5.0 2022 1349 A 111 LYS HE3 A 111 LYS HB2 1.0 0.0 5.0 2023 1349 A 111 LYS HB3 A 111 LYS HE3 1.0 0.0 5.0 2024 1350 A 112 ASN H A 111 LYS HB2 1.0 0.0 2.8 2025 1350 A 111 LYS HB3 A 112 ASN H 1.0 0.0 2.8 2026 1351 A 119 THR HG2% A 111 LYS HA 1.0 0.0 3.5 2027 1352 A 119 THR HG2% A 111 LYS HB2 1.0 0.0 2.8 2028 1352 A 119 THR HG2% A 111 LYS HB3 1.0 0.0 2.8 2029 1353 A 119 THR HG2% A 111 LYS HE2 1.0 0.0 2.8 2030 1353 A 119 THR HG2% A 111 LYS HE3 1.0 0.0 2.8 2031 1354 A 112 ASN H A 112 ASN HB2 1.0 0.0 5.0 2032 1354 A 112 ASN H A 112 ASN HB3 1.0 0.0 5.0 2033 1355 A 112 ASN HD2x A 112 ASN HB2 1.0 0.0 5.0 2034 1355 A 112 ASN HB3 A 112 ASN HD2x 1.0 0.0 5.0 2035 1356 A 113 GLU H A 112 ASN HB2 1.0 0.0 3.5 2036 1356 A 112 ASN HB3 A 113 GLU H 1.0 0.0 3.5 2037 1357 A 113 GLU H A 113 GLU HBx 1.0 0.0 5.0 2038 1357 A 113 GLU H A 113 GLU HBy 1.0 0.0 5.0 2039 1358 A 113 GLU HA A 114 THR H 1.0 0.0 3.5 2040 1359 A 114 THR H A 114 THR HA 1.0 0.0 5.0 2041 1360 A 114 THR H A 114 THR HG2% 1.0 0.0 5.0 2042 1361 A 114 THR HA A 114 THR HG2% 1.0 0.0 5.0 2043 1362 A 114 THR HG2% A 114 THR HB 1.0 0.0 5.0 2044 1363 A 115 ASN HA A 115 ASN HBx 1.0 0.0 5.0 2045 1363 A 115 ASN HA A 115 ASN HBy 1.0 0.0 5.0 2046 1364 A 115 ASN HBy A 115 ASN HD2y 1.0 0.0 5.0 2047 1364 A 115 ASN HBx A 115 ASN HD2y 1.0 0.0 5.0 2048 1364 A 115 ASN HD2x A 115 ASN HBx 1.0 0.0 5.0 2049 1364 A 115 ASN HBy A 115 ASN HD2x 1.0 0.0 5.0 2050 1365 A 116 ASN HA A 115 ASN HBx 1.0 0.0 5.0 2051 1365 A 115 ASN HBy A 116 ASN HA 1.0 0.0 5.0 2052 1366 A 116 ASN HA A 116 ASN H 1.0 0.0 5.0 2053 1367 A 116 ASN H A 116 ASN HBx 1.0 0.0 5.0 2054 1367 A 116 ASN H A 116 ASN HBy 1.0 0.0 5.0 2055 1368 A 116 ASN HA A 116 ASN HBx 1.0 0.0 5.0 2056 1368 A 116 ASN HA A 116 ASN HBy 1.0 0.0 5.0 2057 1369 A 116 ASN HBx A 116 ASN HD2y 1.0 0.0 5.0 2058 1369 A 116 ASN HBy A 116 ASN HD2y 1.0 0.0 5.0 2059 1369 A 116 ASN HD2x A 116 ASN HBx 1.0 0.0 5.0 2060 1369 A 116 ASN HBy A 116 ASN HD2x 1.0 0.0 5.0 2061 1370 A 116 ASN HA A 117 GLY H 1.0 0.0 2.8 2062 1371 A 117 GLY H A 117 GLY HAx 1.0 0.0 5.0 2063 1371 A 117 GLY H A 117 GLY HAy 1.0 0.0 5.0 2064 1372 A 118 SER H A 117 GLY HAx 1.0 0.0 2.8 2065 1372 A 117 GLY HAy A 118 SER H 1.0 0.0 2.8 2066 1373 A 118 SER H A 118 SER HA 1.0 0.0 5.0 2067 1374 A 118 SER H A 118 SER HB2 1.0 0.0 2.8 2068 1375 A 118 SER H A 118 SER HB3 1.0 0.0 5.0 2069 1375 A 118 SER H A 118 SER HB2 1.0 0.0 5.0 2070 1376 A 118 SER HA A 118 SER HB3 1.0 0.0 2.8 2071 1377 A 118 SER HA A 119 THR H 1.0 0.0 3.5 2072 1378 A 119 THR H A 118 SER HB3 1.0 0.0 5.0 2073 1378 A 118 SER HB2 A 119 THR H 1.0 0.0 5.0 2074 1379 A 119 THR H A 119 THR HA 1.0 0.0 5.0 2075 1380 A 119 THR H A 119 THR HB 1.0 0.0 5.0 2076 1381 A 119 THR HG2% A 119 THR H 1.0 0.0 5.0 2077 1382 A 119 THR HA A 119 THR HB 1.0 0.0 5.0 2078 1383 A 119 THR HG2% A 119 THR HA 1.0 0.0 5.0 2079 1384 A 119 THR HG2% A 119 THR HB 1.0 0.0 5.0 2080 1385 A 120 CYS H A 119 THR HA 1.0 0.0 2.8 2081 1386 A 120 CYS H A 119 THR HB 1.0 0.0 3.5 2082 1387 A 120 CYS H A 119 THR HG2% 1.0 0.0 5.0 2083 1388 A 119 THR HG2% A 120 CYS HA 1.0 0.0 5.0 2084 1389 A 120 CYS H A 120 CYS HA 1.0 0.0 5.0 2085 1390 A 120 CYS H A 120 CYS HB3 1.0 0.0 2.8 2086 1391 A 120 CYS H A 120 CYS HB2 1.0 0.0 2.8 2087 1392 A 120 CYS HA A 120 CYS HB2 1.0 0.0 2.8 2088 1393 A 120 CYS H A 121 ILE H 1.0 0.0 5.0 2089 1394 A 120 CYS HA A 121 ILE H 1.0 0.0 2.8 2090 1395 A 120 CYS HA A 121 ILE HB 1.0 0.0 5.0 2091 1396 A 121 ILE H A 120 CYS HB2 1.0 0.0 3.5 2092 1396 A 121 ILE H A 120 CYS HB3 1.0 0.0 3.5 2093 1397 A 122 CYS H A 120 CYS HB2 1.0 0.0 5.0 2094 1397 A 120 CYS HB3 A 122 CYS H 1.0 0.0 5.0 2095 1398 A 147 HIS HD2 A 120 CYS HA 1.0 0.0 3.5 2096 1399 A 147 HIS HD2 A 120 CYS HB2 1.0 0.0 5.0 2097 1399 A 147 HIS HD2 A 120 CYS HB3 1.0 0.0 5.0 2098 1400 A 121 ILE H A 121 ILE HA 1.0 0.0 5.0 2099 1401 A 121 ILE H A 121 ILE HB 1.0 0.0 5.0 2100 1402 A 121 ILE H A 121 ILE HG2% 1.0 0.0 5.0 2101 1403 A 121 ILE H A 121 ILE HD1% 1.0 0.0 5.0 2102 1404 A 121 ILE HB A 121 ILE HA 1.0 0.0 5.0 2103 1405 A 121 ILE HA A 121 ILE HG2% 1.0 0.0 5.0 2104 1406 A 121 ILE HA A 121 ILE HD1% 1.0 0.0 5.0 2105 1407 A 121 ILE HB A 121 ILE HG2% 1.0 0.0 5.0 2106 1408 A 121 ILE HB A 121 ILE HD1% 1.0 0.0 5.0 2107 1409 A 121 ILE H A 122 CYS H 1.0 0.0 2.8 2108 1410 A 122 CYS H A 121 ILE HA 1.0 0.0 5.0 2109 1411 A 121 ILE HB A 122 CYS H 1.0 0.0 5.0 2110 1412 A 122 CYS H A 121 ILE HG1x 1.0 0.0 5.0 2111 1412 A 122 CYS H A 121 ILE HG1y 1.0 0.0 5.0 2112 1413 A 121 ILE H A 123 ARG H 1.0 0.0 5.0 2113 1414 A 121 ILE HA A 123 ARG H 1.0 0.0 5.0 2114 1415 A 121 ILE HA A 124 VAL H 1.0 0.0 3.5 2115 1416 A 121 ILE HG2% A 124 VAL HB 1.0 0.0 5.0 2116 1417 A 121 ILE HG1x A 124 VAL HGx% 1.0 0.0 3.5 2117 1417 A 121 ILE HG1y A 124 VAL HGx% 1.0 0.0 3.5 2118 1417 A 124 VAL HGy% A 121 ILE HG1x 1.0 0.0 3.5 2119 1417 A 121 ILE HG1y A 124 VAL HGy% 1.0 0.0 3.5 2120 1418 A 121 ILE HG2% A 124 VAL HGx% 1.0 0.0 5.0 2121 1418 A 121 ILE HG2% A 124 VAL HGy% 1.0 0.0 5.0 2122 1419 A 121 ILE HD1% A 124 VAL HB 1.0 0.0 5.0 2123 1420 A 121 ILE HD1% A 124 VAL HGx% 1.0 0.0 3.5 2124 1420 A 121 ILE HD1% A 124 VAL HGy% 1.0 0.0 3.5 2125 1421 A 121 ILE HG2% A 142 PHE HA 1.0 0.0 5.0 2126 1422 A 121 ILE HG2% A 142 PHE HB3 1.0 0.0 5.0 2127 1422 A 121 ILE HG2% A 142 PHE HB2 1.0 0.0 5.0 2128 1423 A 121 ILE HG2% A 142 PHE HD% 1.0 0.0 2.8 2129 1424 A 121 ILE HG2% A 142 PHE HE% 1.0 0.0 2.8 2130 1425 A 121 ILE HG2% A 142 PHE HZ 1.0 0.0 2.8 2131 1426 A 121 ILE HD1% A 142 PHE HA 1.0 0.0 5.0 2132 1427 A 121 ILE HD1% A 142 PHE HB3 1.0 0.0 3.5 2133 1427 A 121 ILE HD1% A 142 PHE HB2 1.0 0.0 3.5 2134 1428 A 121 ILE HD1% A 142 PHE HD% 1.0 0.0 2.8 2135 1429 A 121 ILE HD1% A 142 PHE HE% 1.0 0.0 2.8 2136 1430 A 121 ILE HG2% A 145 CYS H 1.0 0.0 5.0 2137 1431 A 121 ILE HG2% A 145 CYS HA 1.0 0.0 5.0 2138 1432 A 121 ILE HG2% A 145 CYS HB3 1.0 0.0 2.8 2139 1433 A 121 ILE HG2% A 145 CYS HB2 1.0 0.0 2.8 2140 1434 A 122 CYS H A 122 CYS HB3 1.0 0.0 2.8 2141 1435 A 122 CYS HA A 122 CYS HB3 1.0 0.0 2.8 2142 1436 A 122 CYS HA A 122 CYS HB2 1.0 0.0 2.8 2143 1437 A 122 CYS H A 123 ARG H 1.0 0.0 3.5 2144 1438 A 122 CYS H A 124 VAL H 1.0 0.0 5.0 2145 1439 A 124 VAL H A 122 CYS HA 1.0 0.0 5.0 2146 1440 A 122 CYS H A 142 PHE HE% 1.0 0.0 5.0 2147 1441 A 122 CYS H A 142 PHE HZ 1.0 0.0 5.0 2148 1442 A 142 PHE HD% A 122 CYS HA 1.0 0.0 3.5 2149 1443 A 142 PHE HE% A 122 CYS HA 1.0 0.0 2.8 2150 1444 A 142 PHE HZ A 122 CYS HA 1.0 0.0 5.0 2151 1445 A 142 PHE HE% A 122 CYS HB3 1.0 0.0 3.5 2152 1446 A 142 PHE HE% A 122 CYS HB2 1.0 0.0 3.5 2153 1447 A 142 PHE HZ A 122 CYS HB3 1.0 0.0 2.8 2154 1448 A 142 PHE HZ A 122 CYS HB2 1.0 0.0 2.8 2155 1449 A 122 CYS H A 145 CYS H 1.0 0.0 5.0 2156 1450 A 122 CYS H A 145 CYS HA 1.0 0.0 5.0 2157 1451 A 122 CYS H A 145 CYS HB2 1.0 0.0 5.0 2158 1451 A 122 CYS H A 145 CYS HB3 1.0 0.0 5.0 2159 1452 A 145 CYS H A 122 CYS HA 1.0 0.0 5.0 2160 1453 A 145 CYS H A 122 CYS HB2 1.0 0.0 5.0 2161 1453 A 145 CYS H A 122 CYS HB3 1.0 0.0 5.0 2162 1454 A 145 CYS HA A 122 CYS HB2 1.0 0.0 5.0 2163 1454 A 145 CYS HA A 122 CYS HB3 1.0 0.0 5.0 2164 1455 A 145 CYS HB3 A 122 CYS HB3 1.0 0.0 3.5 2165 1455 A 122 CYS HB3 A 145 CYS HB2 1.0 0.0 3.5 2166 1456 A 150 CYS H A 122 CYS HB2 1.0 0.0 5.0 2167 1456 A 122 CYS HB3 A 150 CYS H 1.0 0.0 5.0 2168 1457 A 122 CYS HB2 A 150 CYS HB2 1.0 0.0 5.0 2169 1457 A 122 CYS HB3 A 150 CYS HB2 1.0 0.0 5.0 2170 1457 A 150 CYS HB3 A 122 CYS HB2 1.0 0.0 5.0 2171 1457 A 122 CYS HB3 A 150 CYS HB3 1.0 0.0 5.0 2172 1458 A 122 CYS HA A 152 GLY H 1.0 0.0 5.0 2173 1459 A 122 CYS HA A 153 CYS H 1.0 0.0 5.0 2174 1460 A 153 CYS H A 122 CYS HB2 1.0 0.0 5.0 2175 1460 A 122 CYS HB3 A 153 CYS H 1.0 0.0 5.0 2176 1461 A 123 ARG H A 123 ARG HA 1.0 0.0 5.0 2177 1462 A 123 ARG H A 124 VAL H 1.0 0.0 2.8 2178 1463 A 123 ARG HA A 125 PRO HDx 1.0 0.0 5.0 2179 1463 A 123 ARG HA A 125 PRO HDy 1.0 0.0 5.0 2180 1464 A 123 ARG HB3 A 125 PRO HDx 1.0 0.0 5.0 2181 1464 A 123 ARG HB2 A 125 PRO HDx 1.0 0.0 5.0 2182 1464 A 125 PRO HDy A 123 ARG HB2 1.0 0.0 5.0 2183 1464 A 125 PRO HDy A 123 ARG HB3 1.0 0.0 5.0 2184 1465 A 124 VAL H A 124 VAL HA 1.0 0.0 5.0 2185 1466 A 124 VAL H A 124 VAL HB 1.0 0.0 5.0 2186 1467 A 124 VAL H A 124 VAL HGx% 1.0 0.0 5.0 2187 1467 A 124 VAL H A 124 VAL HGy% 1.0 0.0 5.0 2188 1468 A 124 VAL HB A 124 VAL HA 1.0 0.0 5.0 2189 1469 A 124 VAL HA A 124 VAL HGx% 1.0 0.0 5.0 2190 1469 A 124 VAL HGy% A 124 VAL HA 1.0 0.0 5.0 2191 1470 A 124 VAL HB A 124 VAL HGx% 1.0 0.0 5.0 2192 1470 A 124 VAL HB A 124 VAL HGy% 1.0 0.0 5.0 2193 1471 A 124 VAL HA A 125 PRO HDx 1.0 0.0 5.0 2194 1471 A 125 PRO HDy A 124 VAL HA 1.0 0.0 5.0 2195 1472 A 124 VAL HGy% A 125 PRO HDx 1.0 0.0 5.0 2196 1472 A 124 VAL HGx% A 125 PRO HDx 1.0 0.0 5.0 2197 1472 A 125 PRO HDy A 124 VAL HGx% 1.0 0.0 5.0 2198 1472 A 124 VAL HGy% A 125 PRO HDy 1.0 0.0 5.0 2199 1473 A 124 VAL HA A 128 GLN HB2 1.0 0.0 5.0 2200 1473 A 124 VAL HA A 128 GLN HB3 1.0 0.0 5.0 2201 1474 A 124 VAL HA A 128 GLN HGx 1.0 0.0 5.0 2202 1474 A 124 VAL HA A 128 GLN HGy 1.0 0.0 5.0 2203 1475 A 128 GLN H A 124 VAL HGx% 1.0 0.0 5.0 2204 1475 A 124 VAL HGy% A 128 GLN H 1.0 0.0 5.0 2205 1476 A 124 VAL HGx% A 128 GLN HB2 1.0 0.0 2.8 2206 1476 A 124 VAL HGy% A 128 GLN HB2 1.0 0.0 2.8 2207 1476 A 128 GLN HB3 A 124 VAL HGx% 1.0 0.0 2.8 2208 1476 A 124 VAL HGy% A 128 GLN HB3 1.0 0.0 2.8 2209 1477 A 124 VAL HGx% A 128 GLN HGx 1.0 0.0 2.8 2210 1477 A 124 VAL HGy% A 128 GLN HGx 1.0 0.0 2.8 2211 1477 A 128 GLN HGy A 124 VAL HGx% 1.0 0.0 2.8 2212 1477 A 124 VAL HGy% A 128 GLN HGy 1.0 0.0 2.8 2213 1478 A 124 VAL H A 129 LEU HDx% 1.0 0.0 5.0 2214 1478 A 124 VAL H A 129 LEU HDy% 1.0 0.0 5.0 2215 1479 A 124 VAL HGy% A 129 LEU HB3 1.0 0.0 3.5 2216 1479 A 124 VAL HGx% A 129 LEU HB3 1.0 0.0 3.5 2217 1479 A 129 LEU HB2 A 124 VAL HGx% 1.0 0.0 3.5 2218 1479 A 124 VAL HGy% A 129 LEU HB2 1.0 0.0 3.5 2219 1480 A 124 VAL HGx% A 129 LEU HDx% 1.0 0.0 3.5 2220 1480 A 124 VAL HGy% A 129 LEU HDx% 1.0 0.0 3.5 2221 1480 A 129 LEU HDy% A 124 VAL HGx% 1.0 0.0 3.5 2222 1480 A 124 VAL HGy% A 129 LEU HDy% 1.0 0.0 3.5 2223 1481 A 154 ALA HB% A 124 VAL HGx% 1.0 0.0 5.0 2224 1481 A 124 VAL HGy% A 154 ALA HB% 1.0 0.0 5.0 2225 1482 A 125 PRO HA A 125 PRO HBx 1.0 0.0 5.0 2226 1482 A 125 PRO HA A 125 PRO HBy 1.0 0.0 5.0 2227 1483 A 125 PRO HA A 125 PRO HGx 1.0 0.0 5.0 2228 1483 A 125 PRO HA A 125 PRO HGy 1.0 0.0 5.0 2229 1484 A 125 PRO HA A 126 ARG H 1.0 0.0 3.5 2230 1485 A 128 GLN H A 125 PRO HBx 1.0 0.0 5.0 2231 1485 A 128 GLN H A 125 PRO HBy 1.0 0.0 5.0 2232 1486 A 125 PRO HDx A 128 GLN HB2 1.0 0.0 5.0 2233 1486 A 125 PRO HDy A 128 GLN HB2 1.0 0.0 5.0 2234 1486 A 128 GLN HB3 A 125 PRO HDx 1.0 0.0 5.0 2235 1486 A 125 PRO HDy A 128 GLN HB3 1.0 0.0 5.0 2236 1487 A 125 PRO HA A 154 ALA HA 1.0 0.0 5.0 2237 1488 A 154 ALA HB% A 125 PRO HA 1.0 0.0 2.8 2238 1489 A 154 ALA HB% A 125 PRO HBx 1.0 0.0 2.8 2239 1489 A 154 ALA HB% A 125 PRO HBy 1.0 0.0 2.8 2240 1490 A 154 ALA HB% A 125 PRO HGx 1.0 0.0 2.8 2241 1490 A 154 ALA HB% A 125 PRO HGy 1.0 0.0 2.8 2242 1491 A 154 ALA HA A 125 PRO HDx 1.0 0.0 3.5 2243 1491 A 125 PRO HDy A 154 ALA HA 1.0 0.0 3.5 2244 1492 A 154 ALA HB% A 125 PRO HDx 1.0 0.0 2.8 2245 1492 A 125 PRO HDy A 154 ALA HB% 1.0 0.0 2.8 2246 1493 A 126 ARG H A 126 ARG HA 1.0 0.0 3.5 2247 1494 A 126 ARG HA A 126 ARG HD2 1.0 0.0 5.0 2248 1494 A 126 ARG HA A 126 ARG HD3 1.0 0.0 5.0 2249 1495 A 126 ARG H A 127 ALA H 1.0 0.0 2.8 2250 1496 A 126 ARG HA A 127 ALA H 1.0 0.0 5.0 2251 1497 A 128 GLN H A 126 ARG H 1.0 0.0 5.0 2252 1498 A 128 GLN H A 126 ARG HA 1.0 0.0 5.0 2253 1499 A 126 ARG HA A 129 LEU H 1.0 0.0 3.5 2254 1500 A 126 ARG HA A 129 LEU HDx% 1.0 0.0 3.5 2255 1500 A 129 LEU HDy% A 126 ARG HA 1.0 0.0 3.5 2256 1501 A 126 ARG HD2 A 129 LEU HDx% 1.0 0.0 3.5 2257 1501 A 126 ARG HD3 A 129 LEU HDx% 1.0 0.0 3.5 2258 1501 A 129 LEU HDy% A 126 ARG HD2 1.0 0.0 3.5 2259 1501 A 129 LEU HDy% A 126 ARG HD3 1.0 0.0 3.5 2260 1502 A 126 ARG HA A 130 GLU H 1.0 0.0 5.0 2261 1503 A 126 ARG HD2 A 130 GLU HGx 1.0 0.0 5.0 2262 1503 A 130 GLU HGy A 126 ARG HD2 1.0 0.0 5.0 2263 1503 A 126 ARG HD3 A 130 GLU HGy 1.0 0.0 5.0 2264 1503 A 126 ARG HD3 A 130 GLU HGx 1.0 0.0 5.0 2265 1504 A 126 ARG HD2 A 140 VAL HGx% 1.0 0.0 3.5 2266 1504 A 140 VAL HGy% A 126 ARG HD2 1.0 0.0 3.5 2267 1504 A 126 ARG HD3 A 140 VAL HGy% 1.0 0.0 3.5 2268 1504 A 126 ARG HD3 A 140 VAL HGx% 1.0 0.0 3.5 2269 1505 A 154 ALA HB% A 126 ARG H 1.0 0.0 5.0 2270 1506 A 127 ALA H A 127 ALA HA 1.0 0.0 3.5 2271 1507 A 127 ALA H A 127 ALA HB% 1.0 0.0 5.0 2272 1508 A 127 ALA HA A 127 ALA HB% 1.0 0.0 5.0 2273 1509 A 128 GLN H A 127 ALA H 1.0 0.0 2.8 2274 1510 A 128 GLN H A 127 ALA HA 1.0 0.0 5.0 2275 1511 A 128 GLN H A 127 ALA HB% 1.0 0.0 5.0 2276 1512 A 127 ALA H A 129 LEU H 1.0 0.0 5.0 2277 1513 A 129 LEU H A 127 ALA HA 1.0 0.0 5.0 2278 1514 A 129 LEU H A 127 ALA HB% 1.0 0.0 5.0 2279 1515 A 130 GLU H A 127 ALA HA 1.0 0.0 3.5 2280 1516 A 127 ALA HA A 130 GLU HB3 1.0 0.0 3.5 2281 1516 A 127 ALA HA A 130 GLU HB2 1.0 0.0 3.5 2282 1517 A 127 ALA HA A 130 GLU HGx 1.0 0.0 5.0 2283 1517 A 130 GLU HGy A 127 ALA HA 1.0 0.0 5.0 2284 1518 A 130 GLU H A 127 ALA HB% 1.0 0.0 5.0 2285 1519 A 127 ALA HB% A 130 GLU HB3 1.0 0.0 5.0 2286 1519 A 127 ALA HB% A 130 GLU HB2 1.0 0.0 5.0 2287 1520 A 127 ALA HB% A 130 GLU HGx 1.0 0.0 5.0 2288 1520 A 130 GLU HGy A 127 ALA HB% 1.0 0.0 5.0 2289 1521 A 127 ALA HA A 131 GLU H 1.0 0.0 5.0 2290 1522 A 127 ALA HB% A 131 GLU H 1.0 0.0 5.0 2291 1523 A 128 GLN H A 128 GLN HA 1.0 0.0 3.5 2292 1524 A 128 GLN H A 128 GLN HB2 1.0 0.0 5.0 2293 1524 A 128 GLN HB3 A 128 GLN H 1.0 0.0 5.0 2294 1525 A 128 GLN H A 128 GLN HGx 1.0 0.0 5.0 2295 1525 A 128 GLN HGy A 128 GLN H 1.0 0.0 5.0 2296 1526 A 128 GLN HB3 A 128 GLN HGx 1.0 0.0 5.0 2297 1526 A 128 GLN HGy A 128 GLN HB2 1.0 0.0 5.0 2298 1526 A 128 GLN HB3 A 128 GLN HGy 1.0 0.0 5.0 2299 1526 A 128 GLN HB2 A 128 GLN HGx 1.0 0.0 5.0 2300 1527 A 128 GLN HE2y A 128 GLN HGx 1.0 0.0 5.0 2301 1527 A 128 GLN HGy A 128 GLN HE2y 1.0 0.0 5.0 2302 1528 A 128 GLN HGy A 128 GLN HE2x 1.0 0.0 5.0 2303 1528 A 128 GLN HE2y A 128 GLN HGx 1.0 0.0 5.0 2304 1528 A 128 GLN HGy A 128 GLN HE2y 1.0 0.0 5.0 2305 1528 A 128 GLN HE2x A 128 GLN HGx 1.0 0.0 5.0 2306 1529 A 128 GLN H A 129 LEU H 1.0 0.0 2.8 2307 1530 A 129 LEU H A 128 GLN HA 1.0 0.0 5.0 2308 1531 A 129 LEU H A 128 GLN HB2 1.0 0.0 5.0 2309 1531 A 128 GLN HB3 A 129 LEU H 1.0 0.0 5.0 2310 1532 A 129 LEU H A 128 GLN HGx 1.0 0.0 5.0 2311 1532 A 128 GLN HGy A 129 LEU H 1.0 0.0 5.0 2312 1533 A 128 GLN HGx A 129 LEU HDx% 1.0 0.0 5.0 2313 1533 A 128 GLN HGy A 129 LEU HDx% 1.0 0.0 5.0 2314 1533 A 129 LEU HDy% A 128 GLN HGx 1.0 0.0 5.0 2315 1533 A 128 GLN HGy A 129 LEU HDy% 1.0 0.0 5.0 2316 1534 A 128 GLN H A 130 GLU H 1.0 0.0 5.0 2317 1535 A 130 GLU H A 128 GLN HA 1.0 0.0 5.0 2318 1536 A 131 GLU H A 128 GLN HA 1.0 0.0 3.5 2319 1537 A 128 GLN HA A 132 GLU H 1.0 0.0 5.0 2320 1538 A 154 ALA HB% A 128 GLN HB2 1.0 0.0 5.0 2321 1538 A 128 GLN HB3 A 154 ALA HB% 1.0 0.0 5.0 2322 1539 A 129 LEU H A 129 LEU HA 1.0 0.0 3.5 2323 1540 A 129 LEU HB2 A 129 LEU H 1.0 0.0 2.8 2324 1541 A 129 LEU H A 129 LEU HDx% 1.0 0.0 5.0 2325 1541 A 129 LEU HDy% A 129 LEU H 1.0 0.0 5.0 2326 1542 A 129 LEU HA A 129 LEU HB3 1.0 0.0 2.8 2327 1543 A 129 LEU HA A 129 LEU HDx% 1.0 0.0 5.0 2328 1543 A 129 LEU HDy% A 129 LEU HA 1.0 0.0 5.0 2329 1544 A 129 LEU HB3 A 129 LEU HDx% 1.0 0.0 5.0 2330 1544 A 129 LEU HB2 A 129 LEU HDx% 1.0 0.0 5.0 2331 1544 A 129 LEU HDy% A 129 LEU HB3 1.0 0.0 5.0 2332 1544 A 129 LEU HDy% A 129 LEU HB2 1.0 0.0 5.0 2333 1545 A 129 LEU H A 130 GLU H 1.0 0.0 2.8 2334 1546 A 130 GLU H A 129 LEU HA 1.0 0.0 5.0 2335 1547 A 130 GLU H A 129 LEU HDx% 1.0 0.0 5.0 2336 1547 A 129 LEU HDy% A 130 GLU H 1.0 0.0 5.0 2337 1548 A 129 LEU H A 131 GLU H 1.0 0.0 5.0 2338 1549 A 131 GLU H A 129 LEU HA 1.0 0.0 5.0 2339 1550 A 132 GLU H A 129 LEU HA 1.0 0.0 3.5 2340 1551 A 132 GLU H A 129 LEU HDx% 1.0 0.0 5.0 2341 1551 A 129 LEU HDy% A 132 GLU H 1.0 0.0 5.0 2342 1552 A 129 LEU HDx% A 132 GLU HGx 1.0 0.0 5.0 2343 1552 A 129 LEU HDy% A 132 GLU HGx 1.0 0.0 5.0 2344 1552 A 132 GLU HGy A 129 LEU HDx% 1.0 0.0 5.0 2345 1552 A 129 LEU HDy% A 132 GLU HGy 1.0 0.0 5.0 2346 1553 A 129 LEU HB3 A 140 VAL HGx% 1.0 0.0 5.0 2347 1553 A 129 LEU HB2 A 140 VAL HGx% 1.0 0.0 5.0 2348 1553 A 140 VAL HGy% A 129 LEU HB3 1.0 0.0 5.0 2349 1553 A 129 LEU HB2 A 140 VAL HGy% 1.0 0.0 5.0 2350 1554 A 142 PHE HD% A 129 LEU HDx% 1.0 0.0 3.5 2351 1554 A 142 PHE HD% A 129 LEU HDy% 1.0 0.0 3.5 2352 1555 A 130 GLU H A 130 GLU HA 1.0 0.0 3.5 2353 1556 A 130 GLU H A 130 GLU HB2 1.0 0.0 2.8 2354 1557 A 130 GLU H A 130 GLU HGx 1.0 0.0 5.0 2355 1557 A 130 GLU H A 130 GLU HGy 1.0 0.0 5.0 2356 1558 A 130 GLU HA A 130 GLU HB3 1.0 0.0 2.8 2357 1559 A 130 GLU HA A 130 GLU HGx 1.0 0.0 5.0 2358 1559 A 130 GLU HGy A 130 GLU HA 1.0 0.0 5.0 2359 1560 A 130 GLU H A 131 GLU H 1.0 0.0 2.8 2360 1561 A 131 GLU H A 130 GLU HA 1.0 0.0 5.0 2361 1562 A 131 GLU H A 130 GLU HGx 1.0 0.0 5.0 2362 1562 A 130 GLU HGy A 131 GLU H 1.0 0.0 5.0 2363 1563 A 130 GLU H A 132 GLU H 1.0 0.0 5.0 2364 1564 A 132 GLU H A 130 GLU HA 1.0 0.0 5.0 2365 1565 A 130 GLU HA A 133 ALA H 1.0 0.0 3.5 2366 1566 A 133 ALA HB% A 130 GLU HGx 1.0 0.0 5.0 2367 1566 A 130 GLU HGy A 133 ALA HB% 1.0 0.0 5.0 2368 1567 A 130 GLU HA A 134 ARG H 1.0 0.0 5.0 2369 1568 A 130 GLU H A 140 VAL HGx% 1.0 0.0 3.5 2370 1568 A 130 GLU H A 140 VAL HGy% 1.0 0.0 3.5 2371 1569 A 130 GLU HA A 140 VAL HGx% 1.0 0.0 2.8 2372 1569 A 140 VAL HGy% A 130 GLU HA 1.0 0.0 2.8 2373 1570 A 130 GLU HGx A 140 VAL HGx% 1.0 0.0 2.8 2374 1570 A 130 GLU HGy A 140 VAL HGx% 1.0 0.0 2.8 2375 1570 A 140 VAL HGy% A 130 GLU HGx 1.0 0.0 2.8 2376 1570 A 130 GLU HGy A 140 VAL HGy% 1.0 0.0 2.8 2377 1571 A 131 GLU H A 131 GLU HA 1.0 0.0 3.5 2378 1572 A 131 GLU H A 131 GLU HG2 1.0 0.0 5.0 2379 1572 A 131 GLU H A 131 GLU HG3 1.0 0.0 5.0 2380 1573 A 131 GLU HA A 131 GLU HG2 1.0 0.0 5.0 2381 1573 A 131 GLU HA A 131 GLU HG3 1.0 0.0 5.0 2382 1574 A 131 GLU H A 132 GLU H 1.0 0.0 2.8 2383 1575 A 132 GLU H A 131 GLU HA 1.0 0.0 3.5 2384 1576 A 132 GLU H A 131 GLU HG2 1.0 0.0 5.0 2385 1576 A 132 GLU H A 131 GLU HG3 1.0 0.0 5.0 2386 1577 A 131 GLU H A 133 ALA H 1.0 0.0 5.0 2387 1578 A 133 ALA H A 131 GLU HA 1.0 0.0 5.0 2388 1579 A 134 ARG H A 131 GLU HA 1.0 0.0 3.5 2389 1580 A 131 GLU HA A 135 LYS H 1.0 0.0 5.0 2390 1581 A 131 GLU HG3 A 135 LYS HGx 1.0 0.0 5.0 2391 1581 A 131 GLU HG2 A 135 LYS HGx 1.0 0.0 5.0 2392 1581 A 135 LYS HGy A 131 GLU HG2 1.0 0.0 5.0 2393 1581 A 131 GLU HG3 A 135 LYS HGy 1.0 0.0 5.0 2394 1582 A 131 GLU HG3 A 135 LYS HE2 1.0 0.0 3.5 2395 1582 A 131 GLU HG2 A 135 LYS HE2 1.0 0.0 3.5 2396 1582 A 135 LYS HE3 A 131 GLU HG2 1.0 0.0 3.5 2397 1582 A 131 GLU HG3 A 135 LYS HE3 1.0 0.0 3.5 2398 1583 A 132 GLU H A 132 GLU HA 1.0 0.0 3.5 2399 1584 A 132 GLU H A 132 GLU HB2 1.0 0.0 2.8 2400 1585 A 132 GLU H A 132 GLU HB3 1.0 0.0 5.0 2401 1585 A 132 GLU H A 132 GLU HB2 1.0 0.0 5.0 2402 1586 A 132 GLU H A 132 GLU HGx 1.0 0.0 5.0 2403 1586 A 132 GLU H A 132 GLU HGy 1.0 0.0 5.0 2404 1587 A 132 GLU HA A 132 GLU HB3 1.0 0.0 2.8 2405 1588 A 132 GLU HA A 132 GLU HGx 1.0 0.0 5.0 2406 1588 A 132 GLU HGy A 132 GLU HA 1.0 0.0 5.0 2407 1589 A 132 GLU H A 133 ALA H 1.0 0.0 2.8 2408 1590 A 133 ALA H A 132 GLU HB3 1.0 0.0 5.0 2409 1590 A 133 ALA H A 132 GLU HB2 1.0 0.0 5.0 2410 1591 A 132 GLU H A 134 ARG H 1.0 0.0 5.0 2411 1592 A 134 ARG H A 132 GLU HA 1.0 0.0 5.0 2412 1593 A 135 LYS H A 132 GLU HA 1.0 0.0 3.5 2413 1594 A 132 GLU HA A 135 LYS HGx 1.0 0.0 5.0 2414 1594 A 135 LYS HGy A 132 GLU HA 1.0 0.0 5.0 2415 1595 A 132 GLU HA A 136 LYS H 1.0 0.0 5.0 2416 1596 A 132 GLU HGy A 136 LYS HE2 1.0 0.0 5.0 2417 1596 A 132 GLU HGx A 136 LYS HE2 1.0 0.0 5.0 2418 1596 A 136 LYS HE3 A 132 GLU HGx 1.0 0.0 5.0 2419 1596 A 132 GLU HGy A 136 LYS HE3 1.0 0.0 5.0 2420 1597 A 133 ALA H A 133 ALA HA 1.0 0.0 3.5 2421 1598 A 133 ALA H A 133 ALA HB% 1.0 0.0 5.0 2422 1599 A 133 ALA HB% A 133 ALA HA 1.0 0.0 5.0 2423 1600 A 133 ALA H A 134 ARG H 1.0 0.0 2.8 2424 1601 A 134 ARG H A 133 ALA HA 1.0 0.0 5.0 2425 1602 A 133 ALA HB% A 134 ARG H 1.0 0.0 5.0 2426 1603 A 133 ALA H A 135 LYS H 1.0 0.0 5.0 2427 1604 A 135 LYS H A 133 ALA HA 1.0 0.0 5.0 2428 1605 A 136 LYS H A 133 ALA HA 1.0 0.0 3.5 2429 1606 A 133 ALA HA A 136 LYS HBx 1.0 0.0 3.5 2430 1606 A 133 ALA HA A 136 LYS HBy 1.0 0.0 3.5 2431 1607 A 133 ALA HB% A 136 LYS H 1.0 0.0 5.0 2432 1608 A 133 ALA HA A 137 GLY H 1.0 0.0 5.0 2433 1609 A 133 ALA HA A 138 THR HG2% 1.0 0.0 2.8 2434 1610 A 133 ALA HB% A 138 THR H 1.0 0.0 3.5 2435 1611 A 133 ALA HB% A 138 THR HG2% 1.0 0.0 2.8 2436 1612 A 133 ALA HB% A 139 GLN H 1.0 0.0 3.5 2437 1613 A 133 ALA HB% A 139 GLN HA 1.0 0.0 2.8 2438 1614 A 133 ALA HB% A 139 GLN HG2 1.0 0.0 3.5 2439 1614 A 133 ALA HB% A 139 GLN HG3 1.0 0.0 3.5 2440 1615 A 133 ALA H A 140 VAL HGx% 1.0 0.0 2.8 2441 1615 A 140 VAL HGy% A 133 ALA H 1.0 0.0 2.8 2442 1616 A 133 ALA HA A 140 VAL HGx% 1.0 0.0 5.0 2443 1616 A 140 VAL HGy% A 133 ALA HA 1.0 0.0 5.0 2444 1617 A 133 ALA HB% A 140 VAL H 1.0 0.0 5.0 2445 1618 A 133 ALA HB% A 140 VAL HA 1.0 0.0 5.0 2446 1619 A 133 ALA HB% A 140 VAL HB 1.0 0.0 2.8 2447 1620 A 133 ALA HB% A 140 VAL HGx% 1.0 0.0 2.8 2448 1620 A 140 VAL HGy% A 133 ALA HB% 1.0 0.0 2.8 2449 1621 A 134 ARG H A 134 ARG HA 1.0 0.0 5.0 2450 1622 A 134 ARG H A 134 ARG HBx 1.0 0.0 5.0 2451 1622 A 134 ARG H A 134 ARG HBy 1.0 0.0 5.0 2452 1623 A 134 ARG H A 134 ARG HD2 1.0 0.0 5.0 2453 1623 A 134 ARG H A 134 ARG HD3 1.0 0.0 5.0 2454 1624 A 134 ARG HA A 134 ARG HD2 1.0 0.0 5.0 2455 1624 A 134 ARG HA A 134 ARG HD3 1.0 0.0 5.0 2456 1625 A 134 ARG H A 135 LYS H 1.0 0.0 2.8 2457 1626 A 135 LYS H A 134 ARG HA 1.0 0.0 5.0 2458 1627 A 134 ARG H A 136 LYS H 1.0 0.0 5.0 2459 1628 A 137 GLY H A 134 ARG HA 1.0 0.0 5.0 2460 1629 A 135 LYS H A 135 LYS HA 1.0 0.0 5.0 2461 1630 A 135 LYS H A 135 LYS HGx 1.0 0.0 5.0 2462 1630 A 135 LYS H A 135 LYS HGy 1.0 0.0 5.0 2463 1631 A 135 LYS HA A 135 LYS HGx 1.0 0.0 5.0 2464 1631 A 135 LYS HGy A 135 LYS HA 1.0 0.0 5.0 2465 1632 A 135 LYS H A 136 LYS H 1.0 0.0 3.5 2466 1633 A 136 LYS H A 135 LYS HA 1.0 0.0 5.0 2467 1634 A 136 LYS H A 135 LYS HB2 1.0 0.0 5.0 2468 1634 A 136 LYS H A 135 LYS HB3 1.0 0.0 5.0 2469 1635 A 136 LYS H A 135 LYS HGx 1.0 0.0 5.0 2470 1635 A 135 LYS HGy A 136 LYS H 1.0 0.0 5.0 2471 1636 A 136 LYS H A 136 LYS HA 1.0 0.0 5.0 2472 1637 A 136 LYS H A 136 LYS HBx 1.0 0.0 5.0 2473 1637 A 136 LYS H A 136 LYS HBy 1.0 0.0 5.0 2474 1638 A 136 LYS HBy A 136 LYS HGx 1.0 0.0 5.0 2475 1638 A 136 LYS HBx A 136 LYS HGx 1.0 0.0 5.0 2476 1638 A 136 LYS HGy A 136 LYS HBx 1.0 0.0 5.0 2477 1638 A 136 LYS HBy A 136 LYS HGy 1.0 0.0 5.0 2478 1639 A 136 LYS HBy A 136 LYS HE2 1.0 0.0 5.0 2479 1639 A 136 LYS HBx A 136 LYS HE2 1.0 0.0 5.0 2480 1639 A 136 LYS HE3 A 136 LYS HBx 1.0 0.0 5.0 2481 1639 A 136 LYS HE3 A 136 LYS HBy 1.0 0.0 5.0 2482 1640 A 136 LYS H A 137 GLY H 1.0 0.0 3.5 2483 1641 A 137 GLY H A 136 LYS HA 1.0 0.0 3.5 2484 1642 A 137 GLY H A 136 LYS HBx 1.0 0.0 5.0 2485 1642 A 136 LYS HBy A 137 GLY H 1.0 0.0 5.0 2486 1643 A 137 GLY H A 136 LYS HGx 1.0 0.0 5.0 2487 1643 A 137 GLY H A 136 LYS HGy 1.0 0.0 5.0 2488 1644 A 136 LYS H A 138 THR H 1.0 0.0 5.0 2489 1645 A 138 THR H A 136 LYS HA 1.0 0.0 5.0 2490 1646 A 138 THR HG2% A 136 LYS HA 1.0 0.0 5.0 2491 1647 A 138 THR H A 136 LYS HBx 1.0 0.0 5.0 2492 1647 A 136 LYS HBy A 138 THR H 1.0 0.0 5.0 2493 1648 A 138 THR HG2% A 136 LYS HBx 1.0 0.0 5.0 2494 1648 A 136 LYS HBy A 138 THR HG2% 1.0 0.0 5.0 2495 1649 A 138 THR HG2% A 136 LYS HGx 1.0 0.0 5.0 2496 1649 A 138 THR HG2% A 136 LYS HGy 1.0 0.0 5.0 2497 1650 A 138 THR HG2% A 136 LYS HE2 1.0 0.0 5.0 2498 1650 A 136 LYS HE3 A 138 THR HG2% 1.0 0.0 5.0 2499 1651 A 137 GLY H A 137 GLY HAx 1.0 0.0 5.0 2500 1651 A 137 GLY H A 137 GLY HAy 1.0 0.0 5.0 2501 1652 A 137 GLY H A 138 THR H 1.0 0.0 5.0 2502 1653 A 138 THR H A 137 GLY HAx 1.0 0.0 3.5 2503 1653 A 138 THR H A 137 GLY HAy 1.0 0.0 3.5 2504 1654 A 138 THR HG2% A 137 GLY HAx 1.0 0.0 5.0 2505 1654 A 138 THR HG2% A 137 GLY HAy 1.0 0.0 5.0 2506 1655 A 138 THR H A 138 THR HA 1.0 0.0 5.0 2507 1656 A 138 THR H A 138 THR HB 1.0 0.0 5.0 2508 1657 A 138 THR HG2% A 138 THR H 1.0 0.0 5.0 2509 1658 A 138 THR HG2% A 138 THR HA 1.0 0.0 5.0 2510 1659 A 138 THR HG2% A 138 THR HB 1.0 0.0 5.0 2511 1660 A 138 THR H A 139 GLN H 1.0 0.0 5.0 2512 1661 A 139 GLN H A 138 THR HA 1.0 0.0 3.5 2513 1662 A 139 GLN H A 138 THR HB 1.0 0.0 5.0 2514 1663 A 139 GLN H A 139 GLN HA 1.0 0.0 5.0 2515 1664 A 139 GLN H A 139 GLN HB2 1.0 0.0 2.8 2516 1665 A 139 GLN H A 139 GLN HG2 1.0 0.0 5.0 2517 1665 A 139 GLN H A 139 GLN HG3 1.0 0.0 5.0 2518 1666 A 139 GLN HA A 139 GLN HB3 1.0 0.0 2.8 2519 1667 A 139 GLN HA A 139 GLN HG2 1.0 0.0 5.0 2520 1667 A 139 GLN HA A 139 GLN HG3 1.0 0.0 5.0 2521 1668 A 139 GLN H A 140 VAL H 1.0 0.0 5.0 2522 1669 A 139 GLN HA A 140 VAL H 1.0 0.0 2.8 2523 1670 A 139 GLN HA A 140 VAL HGx% 1.0 0.0 5.0 2524 1670 A 140 VAL HGy% A 139 GLN HA 1.0 0.0 5.0 2525 1671 A 140 VAL H A 139 GLN HB2 1.0 0.0 3.5 2526 1671 A 140 VAL H A 139 GLN HB3 1.0 0.0 3.5 2527 1672 A 140 VAL H A 139 GLN HG2 1.0 0.0 5.0 2528 1672 A 139 GLN HG3 A 140 VAL H 1.0 0.0 5.0 2529 1673 A 140 VAL H A 140 VAL HA 1.0 0.0 5.0 2530 1674 A 140 VAL H A 140 VAL HB 1.0 0.0 5.0 2531 1675 A 140 VAL H A 140 VAL HGx% 1.0 0.0 5.0 2532 1675 A 140 VAL HGy% A 140 VAL H 1.0 0.0 5.0 2533 1676 A 140 VAL HA A 140 VAL HB 1.0 0.0 5.0 2534 1677 A 140 VAL HA A 140 VAL HGx% 1.0 0.0 5.0 2535 1677 A 140 VAL HGy% A 140 VAL HA 1.0 0.0 5.0 2536 1678 A 140 VAL HB A 140 VAL HGx% 1.0 0.0 5.0 2537 1678 A 140 VAL HGy% A 140 VAL HB 1.0 0.0 5.0 2538 1679 A 140 VAL HGy% A 141 SER HBx 1.0 0.0 3.5 2539 1679 A 140 VAL HGx% A 141 SER HBx 1.0 0.0 3.5 2540 1679 A 141 SER HBy A 140 VAL HGx% 1.0 0.0 3.5 2541 1679 A 140 VAL HGy% A 141 SER HBy 1.0 0.0 3.5 2542 1680 A 142 PHE H A 140 VAL HGx% 1.0 0.0 5.0 2543 1680 A 140 VAL HGy% A 142 PHE H 1.0 0.0 5.0 2544 1681 A 140 VAL HGy% A 142 PHE HB3 1.0 0.0 5.0 2545 1681 A 140 VAL HGx% A 142 PHE HB3 1.0 0.0 5.0 2546 1681 A 142 PHE HB2 A 140 VAL HGx% 1.0 0.0 5.0 2547 1681 A 142 PHE HB2 A 140 VAL HGy% 1.0 0.0 5.0 2548 1682 A 142 PHE HD% A 140 VAL HGx% 1.0 0.0 5.0 2549 1682 A 142 PHE HD% A 140 VAL HGy% 1.0 0.0 5.0 2550 1683 A 141 SER HA A 141 SER HBx 1.0 0.0 5.0 2551 1683 A 141 SER HBy A 141 SER HA 1.0 0.0 5.0 2552 1684 A 142 PHE H A 141 SER HA 1.0 0.0 3.5 2553 1685 A 142 PHE H A 141 SER HBx 1.0 0.0 5.0 2554 1685 A 141 SER HBy A 142 PHE H 1.0 0.0 5.0 2555 1686 A 142 PHE HA A 142 PHE H 1.0 0.0 3.5 2556 1687 A 142 PHE H A 142 PHE HB3 1.0 0.0 2.8 2557 1688 A 142 PHE HB2 A 142 PHE H 1.0 0.0 2.8 2558 1689 A 142 PHE HD% A 142 PHE H 1.0 0.0 5.0 2559 1690 A 142 PHE HA A 142 PHE HB2 1.0 0.0 2.8 2560 1691 A 142 PHE HA A 142 PHE HB3 1.0 0.0 5.0 2561 1691 A 142 PHE HA A 142 PHE HB2 1.0 0.0 5.0 2562 1692 A 142 PHE HA A 142 PHE HD% 1.0 0.0 5.0 2563 1693 A 142 PHE HD% A 142 PHE HB3 1.0 0.0 5.0 2564 1693 A 142 PHE HB2 A 142 PHE HD% 1.0 0.0 5.0 2565 1694 A 142 PHE HE% A 142 PHE HB3 1.0 0.0 5.0 2566 1694 A 142 PHE HB2 A 142 PHE HE% 1.0 0.0 5.0 2567 1695 A 142 PHE HD% A 142 PHE HE% 1.0 0.0 5.0 2568 1696 A 142 PHE HD% A 145 CYS HA 1.0 0.0 5.0 2569 1697 A 142 PHE HD% A 145 CYS HB2 1.0 0.0 5.0 2570 1697 A 142 PHE HD% A 145 CYS HB3 1.0 0.0 5.0 2571 1698 A 142 PHE HE% A 145 CYS H 1.0 0.0 3.5 2572 1699 A 142 PHE HE% A 145 CYS HA 1.0 0.0 2.8 2573 1700 A 142 PHE HE% A 145 CYS HB2 1.0 0.0 3.5 2574 1700 A 142 PHE HE% A 145 CYS HB3 1.0 0.0 3.5 2575 1701 A 142 PHE HZ A 145 CYS H 1.0 0.0 5.0 2576 1702 A 142 PHE HZ A 145 CYS HA 1.0 0.0 5.0 2577 1703 A 142 PHE HZ A 145 CYS HB2 1.0 0.0 5.0 2578 1703 A 142 PHE HZ A 145 CYS HB3 1.0 0.0 5.0 2579 1704 A 142 PHE HE% A 146 VAL H 1.0 0.0 5.0 2580 1705 A 142 PHE HZ A 150 CYS HB2 1.0 0.0 5.0 2581 1705 A 142 PHE HZ A 150 CYS HB3 1.0 0.0 5.0 2582 1706 A 142 PHE HE% A 152 GLY H 1.0 0.0 3.5 2583 1707 A 142 PHE HZ A 152 GLY H 1.0 0.0 5.0 2584 1708 A 143 HIS H A 143 HIS HA 1.0 0.0 3.5 2585 1709 A 143 HIS H A 143 HIS HBx 1.0 0.0 2.8 2586 1709 A 143 HIS H A 143 HIS HBy 1.0 0.0 2.8 2587 1710 A 143 HIS HA A 143 HIS HBx 1.0 0.0 5.0 2588 1710 A 143 HIS HA A 143 HIS HBy 1.0 0.0 5.0 2589 1711 A 143 HIS HD2 A 143 HIS HBx 1.0 0.0 5.0 2590 1711 A 143 HIS HBy A 143 HIS HD2 1.0 0.0 5.0 2591 1712 A 143 HIS H A 144 GLN H 1.0 0.0 2.8 2592 1713 A 143 HIS HA A 144 GLN H 1.0 0.0 3.5 2593 1714 A 144 GLN H A 143 HIS HBx 1.0 0.0 3.5 2594 1714 A 143 HIS HBy A 144 GLN H 1.0 0.0 3.5 2595 1715 A 144 GLN H A 144 GLN HA 1.0 0.0 3.5 2596 1716 A 144 GLN H A 144 GLN HBx 1.0 0.0 5.0 2597 1716 A 144 GLN HBy A 144 GLN H 1.0 0.0 5.0 2598 1717 A 144 GLN H A 144 GLN HGx 1.0 0.0 5.0 2599 1717 A 144 GLN HGy A 144 GLN H 1.0 0.0 5.0 2600 1718 A 144 GLN H A 144 GLN HE2y 1.0 0.0 5.0 2601 1718 A 144 GLN H A 144 GLN HE2x 1.0 0.0 5.0 2602 1719 A 144 GLN HA A 144 GLN HBx 1.0 0.0 3.5 2603 1719 A 144 GLN HBy A 144 GLN HA 1.0 0.0 3.5 2604 1720 A 144 GLN HA A 144 GLN HGx 1.0 0.0 3.5 2605 1720 A 144 GLN HGy A 144 GLN HA 1.0 0.0 3.5 2606 1721 A 144 GLN HA A 144 GLN HE2y 1.0 0.0 5.0 2607 1721 A 144 GLN HA A 144 GLN HE2x 1.0 0.0 5.0 2608 1722 A 144 GLN HE2y A 144 GLN HGx 1.0 0.0 5.0 2609 1722 A 144 GLN HE2x A 144 GLN HGx 1.0 0.0 5.0 2610 1722 A 144 GLN HGy A 144 GLN HE2y 1.0 0.0 5.0 2611 1722 A 144 GLN HGy A 144 GLN HE2x 1.0 0.0 5.0 2612 1723 A 145 CYS H A 144 GLN H 1.0 0.0 5.0 2613 1724 A 145 CYS H A 144 GLN HA 1.0 0.0 2.3 2614 1725 A 145 CYS H A 144 GLN HBx 1.0 0.0 3.5 2615 1725 A 144 GLN HBy A 145 CYS H 1.0 0.0 3.5 2616 1726 A 145 CYS H A 144 GLN HGx 1.0 0.0 5.0 2617 1726 A 144 GLN HGy A 145 CYS H 1.0 0.0 5.0 2618 1727 A 144 GLN HBy A 149 GLY HAx 1.0 0.0 5.0 2619 1727 A 144 GLN HBx A 149 GLY HAx 1.0 0.0 5.0 2620 1727 A 149 GLY HAy A 144 GLN HBx 1.0 0.0 5.0 2621 1727 A 144 GLN HBy A 149 GLY HAy 1.0 0.0 5.0 2622 1728 A 144 GLN HGx A 149 GLY HAx 1.0 0.0 5.0 2623 1728 A 144 GLN HGy A 149 GLY HAx 1.0 0.0 5.0 2624 1728 A 149 GLY HAy A 144 GLN HGx 1.0 0.0 5.0 2625 1728 A 144 GLN HGy A 149 GLY HAy 1.0 0.0 5.0 2626 1729 A 150 CYS H A 144 GLN HA 1.0 0.0 5.0 2627 1730 A 150 CYS H A 144 GLN HBx 1.0 0.0 5.0 2628 1730 A 144 GLN HBy A 150 CYS H 1.0 0.0 5.0 2629 1731 A 144 GLN HA A 151 ARG H 1.0 0.0 5.0 2630 1732 A 144 GLN HA A 151 ARG HA 1.0 0.0 5.0 2631 1733 A 144 GLN HA A 151 ARG HB2 1.0 0.0 5.0 2632 1733 A 144 GLN HA A 151 ARG HB3 1.0 0.0 5.0 2633 1734 A 151 ARG HA A 144 GLN HBx 1.0 0.0 5.0 2634 1734 A 144 GLN HBy A 151 ARG HA 1.0 0.0 5.0 2635 1735 A 152 GLY H A 144 GLN HA 1.0 0.0 5.0 2636 1736 A 144 GLN HA A 152 GLY HAx 1.0 0.0 3.5 2637 1736 A 144 GLN HA A 152 GLY HAy 1.0 0.0 3.5 2638 1737 A 145 CYS H A 145 CYS HA 1.0 0.0 5.0 2639 1738 A 145 CYS H A 145 CYS HB3 1.0 0.0 2.8 2640 1739 A 145 CYS HA A 145 CYS HB3 1.0 0.0 2.8 2641 1740 A 145 CYS HA A 145 CYS HB2 1.0 0.0 2.8 2642 1741 A 145 CYS H A 146 VAL H 1.0 0.0 5.0 2643 1742 A 145 CYS HA A 146 VAL H 1.0 0.0 2.8 2644 1743 A 145 CYS HA A 146 VAL HGx% 1.0 0.0 5.0 2645 1743 A 146 VAL HGy% A 145 CYS HA 1.0 0.0 5.0 2646 1744 A 145 CYS HB3 A 146 VAL H 1.0 0.0 5.0 2647 1745 A 146 VAL H A 145 CYS HB2 1.0 0.0 2.8 2648 1746 A 145 CYS HA A 147 HIS H 1.0 0.0 5.0 2649 1747 A 145 CYS HB3 A 147 HIS H 1.0 0.0 5.0 2650 1748 A 147 HIS H A 145 CYS HB2 1.0 0.0 3.5 2651 1749 A 145 CYS H A 150 CYS H 1.0 0.0 3.5 2652 1750 A 145 CYS H A 150 CYS HB2 1.0 0.0 3.5 2653 1750 A 145 CYS H A 150 CYS HB3 1.0 0.0 3.5 2654 1751 A 145 CYS H A 151 ARG HA 1.0 0.0 5.0 2655 1752 A 146 VAL HA A 146 VAL H 1.0 0.0 3.5 2656 1753 A 146 VAL HB A 146 VAL H 1.0 0.0 5.0 2657 1754 A 146 VAL H A 146 VAL HGx% 1.0 0.0 3.5 2658 1754 A 146 VAL HGy% A 146 VAL H 1.0 0.0 3.5 2659 1755 A 146 VAL HA A 146 VAL HB 1.0 0.0 3.5 2660 1756 A 146 VAL HA A 146 VAL HGx% 1.0 0.0 3.5 2661 1756 A 146 VAL HA A 146 VAL HGy% 1.0 0.0 3.5 2662 1757 A 146 VAL HB A 146 VAL HGx% 1.0 0.0 3.5 2663 1757 A 146 VAL HGy% A 146 VAL HB 1.0 0.0 3.5 2664 1758 A 146 VAL H A 147 HIS H 1.0 0.0 2.8 2665 1759 A 146 VAL HA A 147 HIS H 1.0 0.0 5.0 2666 1760 A 146 VAL HB A 147 HIS H 1.0 0.0 5.0 2667 1761 A 147 HIS H A 146 VAL HGx% 1.0 0.0 2.8 2668 1761 A 146 VAL HGy% A 147 HIS H 1.0 0.0 2.8 2669 1762 A 147 HIS HD2 A 146 VAL HGx% 1.0 0.0 5.0 2670 1762 A 146 VAL HGy% A 147 HIS HD2 1.0 0.0 5.0 2671 1763 A 148 CYS H A 146 VAL HGx% 1.0 0.0 5.0 2672 1763 A 146 VAL HGy% A 148 CYS H 1.0 0.0 5.0 2673 1764 A 147 HIS H A 147 HIS HA 1.0 0.0 3.5 2674 1765 A 147 HIS H A 147 HIS HB2 1.0 0.0 2.8 2675 1766 A 147 HIS HD2 A 147 HIS H 1.0 0.0 5.0 2676 1767 A 147 HIS HA A 147 HIS HB3 1.0 0.0 2.8 2677 1768 A 147 HIS HD2 A 147 HIS HB3 1.0 0.0 5.0 2678 1768 A 147 HIS HD2 A 147 HIS HB2 1.0 0.0 5.0 2679 1769 A 148 CYS H A 147 HIS H 1.0 0.0 3.5 2680 1770 A 148 CYS H A 147 HIS HA 1.0 0.0 5.0 2681 1771 A 148 CYS H A 147 HIS HB3 1.0 0.0 3.5 2682 1771 A 148 CYS H A 147 HIS HB2 1.0 0.0 3.5 2683 1772 A 148 CYS H A 148 CYS HB3 1.0 0.0 2.8 2684 1773 A 148 CYS HA A 148 CYS HB3 1.0 0.0 2.8 2685 1774 A 148 CYS HA A 148 CYS HB2 1.0 0.0 2.8 2686 1775 A 148 CYS H A 149 GLY H 1.0 0.0 5.0 2687 1776 A 148 CYS HA A 149 GLY H 1.0 0.0 3.5 2688 1777 A 149 GLY H A 148 CYS HB2 1.0 0.0 2.8 2689 1777 A 149 GLY H A 148 CYS HB3 1.0 0.0 2.8 2690 1778 A 148 CYS H A 150 CYS H 1.0 0.0 5.0 2691 1779 A 148 CYS HA A 150 CYS H 1.0 0.0 5.0 2692 1780 A 149 GLY H A 149 GLY HAx 1.0 0.0 3.5 2693 1780 A 149 GLY H A 149 GLY HAy 1.0 0.0 3.5 2694 1781 A 149 GLY H A 150 CYS H 1.0 0.0 5.0 2695 1782 A 150 CYS H A 149 GLY HAx 1.0 0.0 3.5 2696 1782 A 149 GLY HAy A 150 CYS H 1.0 0.0 3.5 2697 1783 A 150 CYS H A 150 CYS HA 1.0 0.0 5.0 2698 1784 A 150 CYS H A 150 CYS HB3 1.0 0.0 2.8 2699 1785 A 150 CYS H A 150 CYS HB2 1.0 0.0 2.8 2700 1786 A 150 CYS HA A 150 CYS HB2 1.0 0.0 2.8 2701 1787 A 150 CYS H A 151 ARG H 1.0 0.0 5.0 2702 1788 A 151 ARG H A 150 CYS HA 1.0 0.0 2.8 2703 1789 A 151 ARG H A 150 CYS HB2 1.0 0.0 5.0 2704 1789 A 150 CYS HB3 A 151 ARG H 1.0 0.0 5.0 2705 1790 A 152 GLY H A 150 CYS HA 1.0 0.0 5.0 2706 1791 A 151 ARG H A 151 ARG HA 1.0 0.0 5.0 2707 1792 A 151 ARG H A 151 ARG HB2 1.0 0.0 5.0 2708 1792 A 151 ARG H A 151 ARG HB3 1.0 0.0 5.0 2709 1793 A 151 ARG H A 151 ARG HGx 1.0 0.0 5.0 2710 1793 A 151 ARG H A 151 ARG HGy 1.0 0.0 5.0 2711 1794 A 152 GLY H A 151 ARG H 1.0 0.0 3.5 2712 1795 A 152 GLY H A 151 ARG HA 1.0 0.0 3.5 2713 1796 A 152 GLY H A 152 GLY HAx 1.0 0.0 2.8 2714 1796 A 152 GLY H A 152 GLY HAy 1.0 0.0 2.8 2715 1797 A 152 GLY H A 153 CYS H 1.0 0.0 3.5 2716 1798 A 153 CYS H A 152 GLY HAx 1.0 0.0 2.8 2717 1798 A 153 CYS H A 152 GLY HAy 1.0 0.0 2.8 2718 1799 A 153 CYS HA A 153 CYS H 1.0 0.0 5.0 2719 1800 A 153 CYS H A 153 CYS HB3 1.0 0.0 2.8 2720 1801 A 153 CYS HA A 153 CYS HB3 1.0 0.0 2.8 2721 1802 A 153 CYS HA A 153 CYS HB2 1.0 0.0 2.8 2722 1803 A 153 CYS H A 154 ALA H 1.0 0.0 5.0 2723 1804 A 153 CYS HA A 154 ALA H 1.0 0.0 2.8 2724 1805 A 154 ALA H A 153 CYS HB2 1.0 0.0 3.5 2725 1805 A 154 ALA H A 153 CYS HB3 1.0 0.0 3.5 2726 1806 A 154 ALA HA A 154 ALA H 1.0 0.0 3.5 2727 1807 A 154 ALA HB% A 154 ALA H 1.0 0.0 5.0 2728 1808 A 154 ALA HB% A 154 ALA HA 1.0 0.0 5.0 2729 1809 A 154 ALA H A 155 SER H 1.0 0.0 5.0 2730 1810 A 154 ALA HA A 155 SER H 1.0 0.0 2.3 2731 1811 A 154 ALA HB% A 155 SER H 1.0 0.0 5.0 2732 1812 A 154 ALA HB% A 156 THR H 1.0 0.0 5.0 2733 1813 A 154 ALA HA A 157 ASP H 1.0 0.0 5.0 2734 1814 A 154 ALA HB% A 157 ASP HB3 1.0 0.0 5.0 2735 1814 A 154 ALA HB% A 157 ASP HB2 1.0 0.0 5.0 2736 1815 A 155 SER HB2 A 155 SER H 1.0 0.0 2.8 2737 1816 A 155 SER HA A 155 SER HB3 1.0 0.0 2.8 2738 1817 A 156 THR HG2% A 155 SER HB3 1.0 0.0 5.0 2739 1817 A 155 SER HB2 A 156 THR HG2% 1.0 0.0 5.0 2740 1818 A 156 THR H A 156 THR HA 1.0 0.0 5.0 2741 1819 A 156 THR H A 156 THR HG2% 1.0 0.0 5.0 2742 1820 A 157 ASP H A 156 THR HA 1.0 0.0 3.5 2743 1821 A 157 ASP H A 156 THR HG2% 1.0 0.0 5.0 2744 1822 A 157 ASP H A 157 ASP HA 1.0 0.0 5.0 2745 1823 A 157 ASP H A 157 ASP HB2 1.0 0.0 2.8 2746 1824 A 157 ASP H A 157 ASP HB3 1.0 0.0 5.0 2747 1824 A 157 ASP H A 157 ASP HB2 1.0 0.0 5.0 2748 1825 A 157 ASP HA A 157 ASP HB3 1.0 0.0 2.8 stop_ save_ save_CNS/XPLOR_distance_constraints_7 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_7 _nef_distance_restraint_list.restraint_origin undefined _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 104 CYS SG A 108 CYS SG 1.0 3.7 3.9 2 2 A 104 CYS SG A 105 CYS SG 1.0 3.7 3.9 3 3 A 104 CYS SG A 148 CYS SG 1.0 3.7 3.9 4 4 A 108 CYS SG A 105 CYS SG 1.0 3.7 3.9 5 5 A 108 CYS SG A 148 CYS SG 1.0 3.7 3.9 6 6 A 105 CYS SG A 148 CYS SG 1.0 3.7 3.9 7 7 A 104 CYS SG A 122 CYS SG 1.0 3.7 3.9 8 8 A 104 CYS SG A 150 CYS SG 1.0 3.7 3.9 9 9 A 104 CYS SG A 153 CYS SG 1.0 3.7 3.9 10 10 A 122 CYS SG A 150 CYS SG 1.0 3.7 3.9 11 11 A 122 CYS SG A 153 CYS SG 1.0 3.7 3.9 12 12 A 150 CYS SG A 153 CYS SG 1.0 3.7 3.9 13 13 A 108 CYS SG A 122 CYS SG 1.0 3.7 3.9 14 14 A 122 CYS SG A 120 CYS SG 1.0 3.7 3.9 15 15 A 122 CYS SG A 145 CYS SG 1.0 3.7 3.9 16 16 A 108 CYS SG A 120 CYS SG 1.0 3.7 3.9 17 17 A 108 CYS SG A 145 CYS SG 1.0 3.7 3.9 18 18 A 120 CYS SG A 145 CYS SG 1.0 3.7 3.9 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 63 ILE N A 59 ARG O 1.0 0.0 3.2 2 2 A 63 ILE H A 59 ARG O 1.0 0.0 2.2 3 3 A 64 TYR N A 60 SER O 1.0 0.0 3.2 4 4 A 64 TYR H A 60 SER O 1.0 0.0 2.2 5 5 A 65 THR N A 61 ARG O 1.0 0.0 3.2 6 6 A 65 THR H A 61 ARG O 1.0 0.0 2.2 7 7 A 66 LEU N A 62 TYR O 1.0 0.0 3.2 8 8 A 66 LEU H A 62 TYR O 1.0 0.0 2.2 9 9 A 67 TYR N A 63 ILE O 1.0 0.0 3.2 10 10 A 67 TYR H A 63 ILE O 1.0 0.0 2.2 11 11 A 78 TYR N A 74 SER O 1.0 0.0 3.2 12 12 A 78 TYR H A 74 SER O 1.0 0.0 2.2 13 13 A 79 ASP N A 75 LYS O 1.0 0.0 3.2 14 14 A 79 ASP H A 75 LYS O 1.0 0.0 2.2 15 15 A 80 TRP N A 76 ASP O 1.0 0.0 3.2 16 16 A 80 TRP H A 76 ASP O 1.0 0.0 2.2 17 17 A 81 LEU N A 77 LEU O 1.0 0.0 3.2 18 18 A 81 LEU H A 77 LEU O 1.0 0.0 2.2 19 19 A 82 ILE N A 78 TYR O 1.0 0.0 3.2 20 20 A 82 ILE H A 78 TYR O 1.0 0.0 2.2 21 21 A 83 LYS N A 79 ASP O 1.0 0.0 3.2 22 22 A 83 LYS H A 79 ASP O 1.0 0.0 2.2 23 23 A 92 ILE N A 88 ASP O 1.0 0.0 3.2 24 24 A 92 ILE H A 88 ASP O 1.0 0.0 2.2 25 25 A 93 ALA N A 89 LYS O 1.0 0.0 3.2 26 26 A 93 ALA H A 89 LYS O 1.0 0.0 2.2 27 27 A 94 LYS N A 90 LEU O 1.0 0.0 3.2 28 28 A 94 LYS H A 90 LEU O 1.0 0.0 2.2 29 29 A 95 TRP N A 91 LEU O 1.0 0.0 3.2 30 30 A 95 TRP H A 91 LEU O 1.0 0.0 2.2 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 16 PHE N A 16 PHE CA A 16 PHE CB A 16 PHE CG 1.0 150.0 210.0 CHI1 2 2 A 17 GLU N A 17 GLU CA A 17 GLU CB A 17 GLU CG 1.0 150.0 210.0 CHI1 3 3 A 18 LYS N A 18 LYS CA A 18 LYS CB A 18 LYS CG 1.0 -90.0 -30.0 CHI1 4 4 A 20 LYS N A 20 LYS CA A 20 LYS CB A 20 LYS CG 1.0 150.0 210.0 CHI1 5 5 A 23 LEU N A 23 LEU CA A 23 LEU CB A 23 LEU CG 1.0 -90.0 -30.0 CHI1 6 6 A 26 PHE N A 26 PHE CA A 26 PHE CB A 26 PHE CG 1.0 -90.0 -30.0 CHI1 7 7 A 32 ASP N A 32 ASP CA A 32 ASP CB A 32 ASP CG 1.0 -90.0 -30.0 CHI1 8 8 A 34 GLN N A 34 GLN CA A 34 GLN CB A 34 GLN CG 1.0 -90.0 -30.0 CHI1 9 9 A 35 LYS N A 35 LYS CA A 35 LYS CB A 35 LYS CG 1.0 -90.0 -30.0 CHI1 10 10 A 47 GLU N A 47 GLU CA A 47 GLU CB A 47 GLU CG 1.0 -90.0 -30.0 CHI1 11 11 A 49 LEU N A 49 LEU CA A 49 LEU CB A 49 LEU CG 1.0 -90.0 -30.0 CHI1 12 12 A 50 TRP N A 50 TRP CA A 50 TRP CB A 50 TRP CG 1.0 -90.0 -30.0 CHI1 13 13 A 53 MET N A 53 MET CA A 53 MET CB A 53 MET CG 1.0 30.0 90.0 CHI1 14 14 A 54 GLN N A 54 GLN CA A 54 GLN CB A 54 GLN CG 1.0 -90.0 -30.0 CHI1 15 15 A 55 LEU N A 55 LEU CA A 55 LEU CB A 55 LEU CG 1.0 -90.0 -30.0 CHI1 16 16 A 56 HIS N A 56 HIS CA A 56 HIS CB A 56 HIS CG 1.0 150.0 210.0 CHI1 17 17 A 57 HIS N A 57 HIS CA A 57 HIS CB A 57 HIS CG 1.0 -90.0 -30.0 CHI1 18 18 A 60 SER N A 60 SER CA A 60 SER CB A 60 SER OG 1.0 30.0 90.0 CHI1 19 19 A 61 ARG N A 61 ARG CA A 61 ARG CB A 61 ARG CG 1.0 150.0 210.0 CHI1 20 20 A 62 TYR N A 62 TYR CA A 62 TYR CB A 62 TYR CG 1.0 150.0 210.0 CHI1 21 21 A 64 TYR N A 64 TYR CA A 64 TYR CB A 64 TYR CG 1.0 150.0 210.0 CHI1 22 22 A 66 LEU N A 66 LEU CA A 66 LEU CB A 66 LEU CG 1.0 30.0 90.0 CHI1 23 23 A 68 TYR N A 68 TYR CA A 68 TYR CB A 68 TYR CG 1.0 -90.0 -30.0 CHI1 24 24 A 69 LYS N A 69 LYS CA A 69 LYS CB A 69 LYS CG 1.0 -90.0 -30.0 CHI1 25 25 A 76 ASP N A 76 ASP CA A 76 ASP CB A 76 ASP CG 1.0 -90.0 -30.0 CHI1 26 26 A 78 TYR N A 78 TYR CA A 78 TYR CB A 78 TYR CG 1.0 150.0 210.0 CHI1 27 27 A 79 ASP N A 79 ASP CA A 79 ASP CB A 79 ASP CG 1.0 150.0 210.0 CHI1 28 28 A 80 TRP N A 80 TRP CA A 80 TRP CB A 80 TRP CG 1.0 150.0 210.0 CHI1 29 29 A 81 LEU N A 81 LEU CA A 81 LEU CB A 81 LEU CG 1.0 -90.0 -30.0 CHI1 30 30 A 84 GLU N A 84 GLU CA A 84 GLU CB A 84 GLU CG 1.0 -90.0 -30.0 CHI1 31 31 A 86 TYR N A 86 TYR CA A 86 TYR CB A 86 TYR CG 1.0 -90.0 -30.0 CHI1 32 32 A 88 ASP N A 88 ASP CA A 88 ASP CB A 88 ASP CG 1.0 150.0 210.0 CHI1 33 33 A 89 LYS N A 89 LYS CA A 89 LYS CB A 89 LYS CG 1.0 -90.0 -30.0 CHI1 34 34 A 91 LEU N A 91 LEU CA A 91 LEU CB A 91 LEU CG 1.0 150.0 210.0 CHI1 35 35 A 94 LYS N A 94 LYS CA A 94 LYS CB A 94 LYS CG 1.0 -90.0 -30.0 CHI1 36 36 A 95 TRP N A 95 TRP CA A 95 TRP CB A 95 TRP CG 1.0 -90.0 -30.0 CHI1 37 37 A 96 ARG N A 96 ARG CA A 96 ARG CB A 96 ARG CG 1.0 -90.0 -30.0 CHI1 38 38 A 97 LYS N A 97 LYS CA A 97 LYS CB A 97 LYS CG 1.0 -90.0 -30.0 CHI1 39 39 A 100 TYR N A 100 TYR CA A 100 TYR CB A 100 TYR CG 1.0 -90.0 -30.0 CHI1 40 40 A 102 LYS N A 102 LYS CA A 102 LYS CB A 102 LYS CG 1.0 -90.0 -30.0 CHI1 41 41 A 104 CYS N A 104 CYS CA A 104 CYS CB A 104 CYS SG 1.0 30.0 90.0 CHI1 42 42 A 106 LEU N A 106 LEU CA A 106 LEU CB A 106 LEU CG 1.0 -90.0 -30.0 CHI1 43 43 A 107 ARG N A 107 ARG CA A 107 ARG CB A 107 ARG CG 1.0 150.0 210.0 CHI1 44 44 A 108 CYS N A 108 CYS CA A 108 CYS CB A 108 CYS SG 1.0 150.0 210.0 CHI1 45 45 A 118 SER N A 118 SER CA A 118 SER CB A 118 SER OG 1.0 -90.0 -30.0 CHI1 46 46 A 120 CYS N A 120 CYS CA A 120 CYS CB A 120 CYS SG 1.0 150.0 210.0 CHI1 47 47 A 122 CYS N A 122 CYS CA A 122 CYS CB A 122 CYS SG 1.0 30.0 90.0 CHI1 48 48 A 129 LEU N A 129 LEU CA A 129 LEU CB A 129 LEU CG 1.0 -90.0 -30.0 CHI1 49 49 A 139 GLN N A 139 GLN CA A 139 GLN CB A 139 GLN CG 1.0 -90.0 -30.0 CHI1 50 50 A 142 PHE N A 142 PHE CA A 142 PHE CB A 142 PHE CG 1.0 150.0 210.0 CHI1 51 51 A 145 CYS N A 145 CYS CA A 145 CYS CB A 145 CYS SG 1.0 30.0 90.0 CHI1 52 52 A 147 HIS N A 147 HIS CA A 147 HIS CB A 147 HIS CG 1.0 -90.0 -30.0 CHI1 53 53 A 148 CYS N A 148 CYS CA A 148 CYS CB A 148 CYS SG 1.0 30.0 90.0 CHI1 54 54 A 150 CYS N A 150 CYS CA A 150 CYS CB A 150 CYS SG 1.0 150.0 210.0 CHI1 55 55 A 153 CYS N A 153 CYS CA A 153 CYS CB A 153 CYS SG 1.0 30.0 90.0 CHI1 56 56 A 155 SER N A 155 SER CA A 155 SER CB A 155 SER OG 1.0 -90.0 -30.0 CHI1 57 57 A 157 ASP N A 157 ASP CA A 157 ASP CB A 157 ASP CG 1.0 -90.0 -30.0 CHI1 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 15 GLY C A 16 PHE N A 16 PHE CA A 16 PHE C 1.0 -80.1 -32.7 PHI 2 2 A 16 PHE N A 16 PHE CA A 16 PHE C A 17 GLU N 1.0 -68.7 -4.3 PSI 3 3 A 16 PHE C A 17 GLU N A 17 GLU CA A 17 GLU C 1.0 -83.4 -38.6 PHI 4 4 A 17 GLU N A 17 GLU CA A 17 GLU C A 18 LYS N 1.0 -59.3 -9.1 PSI 5 5 A 17 GLU C A 18 LYS N A 18 LYS CA A 18 LYS C 1.0 -90.1 -41.7 PHI 6 6 A 18 LYS N A 18 LYS CA A 18 LYS C A 19 ILE N 1.0 -53.2 1.0 PSI 7 7 A 22 THR C A 23 LEU N A 23 LEU CA A 23 LEU C 1.0 -81.1 -44.3 PHI 8 8 A 23 LEU N A 23 LEU CA A 23 LEU C A 24 THR N 1.0 -59.0 -12.4 PSI 9 9 A 23 LEU C A 24 THR N A 24 THR CA A 24 THR C 1.0 -90.9 -42.7 PHI 10 10 A 24 THR N A 24 THR CA A 24 THR C A 25 ASP N 1.0 -62.7 -18.1 PSI 11 11 A 24 THR C A 25 ASP N A 25 ASP CA A 25 ASP C 1.0 -78.8 -40.0 PHI 12 12 A 25 ASP N A 25 ASP CA A 25 ASP C A 26 PHE N 1.0 -64.5 -30.1 PSI 13 13 A 25 ASP C A 26 PHE N A 26 PHE CA A 26 PHE C 1.0 -82.5 -43.7 PHI 14 14 A 26 PHE N A 26 PHE CA A 26 PHE C A 27 GLU N 1.0 -62.3 -17.5 PSI 15 15 A 26 PHE C A 27 GLU N A 27 GLU CA A 27 GLU C 1.0 -83.1 -46.5 PHI 16 16 A 27 GLU N A 27 GLU CA A 27 GLU C A 28 ILE N 1.0 -59.4 -22.6 PSI 17 17 A 27 GLU C A 28 ILE N A 28 ILE CA A 28 ILE C 1.0 -81.1 -44.3 PHI 18 18 A 28 ILE N A 28 ILE CA A 28 ILE C A 29 GLN N 1.0 -64.3 -23.7 PSI 19 19 A 28 ILE C A 29 GLN N A 29 GLN CA A 29 GLN C 1.0 -83.1 -41.5 PHI 20 20 A 29 GLN N A 29 GLN CA A 29 GLN C A 30 LEU N 1.0 -62.7 -19.7 PSI 21 21 A 29 GLN C A 30 LEU N A 30 LEU CA A 30 LEU C 1.0 -82.0 -41.4 PHI 22 22 A 30 LEU N A 30 LEU CA A 30 LEU C A 31 ARG N 1.0 -67.5 -19.9 PSI 23 23 A 30 LEU C A 31 ARG N A 31 ARG CA A 31 ARG C 1.0 -87.4 -43.2 PHI 24 24 A 31 ARG N A 31 ARG CA A 31 ARG C A 32 ASP N 1.0 -63.7 -10.1 PSI 25 25 A 31 ARG C A 32 ASP N A 32 ASP CA A 32 ASP C 1.0 -86.9 -42.9 PHI 26 26 A 32 ASP N A 32 ASP CA A 32 ASP C A 33 ALA N 1.0 -65.4 -13.8 PSI 27 27 A 32 ASP C A 33 ALA N A 33 ALA CA A 33 ALA C 1.0 -89.8 -43.2 PHI 28 28 A 33 ALA N A 33 ALA CA A 33 ALA C A 34 GLN N 1.0 -57.6 -4.6 PSI 29 29 A 33 ALA C A 34 GLN N A 34 GLN CA A 34 GLN C 1.0 -117.6 -50.8 PHI 30 30 A 34 GLN N A 34 GLN CA A 34 GLN C A 35 LYS N 1.0 -50.3 5.1 PSI 31 31 A 34 GLN C A 35 LYS N A 35 LYS CA A 35 LYS C 1.0 -100.5 -45.7 PHI 32 32 A 35 LYS N A 35 LYS CA A 35 LYS C A 36 ASP N 1.0 -62.9 -5.5 PSI 33 33 A 35 LYS C A 36 ASP N A 36 ASP CA A 36 ASP C 1.0 -93.8 -40.0 PHI 34 34 A 36 ASP N A 36 ASP CA A 36 ASP C A 37 LYS N 1.0 -60.4 -11.4 PSI 35 35 A 36 ASP C A 37 LYS N A 37 LYS CA A 37 LYS C 1.0 -95.5 -39.7 PHI 36 36 A 37 LYS N A 37 LYS CA A 37 LYS C A 38 SER N 1.0 -70.0 5.2 PSI 37 37 A 45 SER C A 46 ASN N A 46 ASN CA A 46 ASN C 1.0 -84.6 -36.0 PHI 38 38 A 46 ASN N A 46 ASN CA A 46 ASN C A 47 GLU N 1.0 -58.3 -13.9 PSI 39 39 A 46 ASN C A 47 GLU N A 47 GLU CA A 47 GLU C 1.0 -81.9 -40.7 PHI 40 40 A 47 GLU N A 47 GLU CA A 47 GLU C A 48 GLN N 1.0 -60.6 -19.4 PSI 41 41 A 47 GLU C A 48 GLN N A 48 GLN CA A 48 GLN C 1.0 -82.3 -46.3 PHI 42 42 A 48 GLN N A 48 GLN CA A 48 GLN C A 49 LEU N 1.0 -61.9 -23.1 PSI 43 43 A 48 GLN C A 49 LEU N A 49 LEU CA A 49 LEU C 1.0 -86.4 -44.8 PHI 44 44 A 49 LEU N A 49 LEU CA A 49 LEU C A 50 TRP N 1.0 -62.6 -16.2 PSI 45 45 A 49 LEU C A 50 TRP N A 50 TRP CA A 50 TRP C 1.0 -91.4 -43.2 PHI 46 46 A 50 TRP N A 50 TRP CA A 50 TRP C A 51 GLU N 1.0 -62.5 -20.5 PSI 47 47 A 50 TRP C A 51 GLU N A 51 GLU CA A 51 GLU C 1.0 -84.7 -43.9 PHI 48 48 A 51 GLU N A 51 GLU CA A 51 GLU C A 52 ILE N 1.0 -62.9 -21.1 PSI 49 49 A 51 GLU C A 52 ILE N A 52 ILE CA A 52 ILE C 1.0 -84.5 -47.3 PHI 50 50 A 52 ILE N A 52 ILE CA A 52 ILE C A 53 MET N 1.0 -60.5 -20.5 PSI 51 51 A 52 ILE C A 53 MET N A 53 MET CA A 53 MET C 1.0 -82.1 -41.9 PHI 52 52 A 53 MET N A 53 MET CA A 53 MET C A 54 GLN N 1.0 -64.3 -22.3 PSI 53 53 A 53 MET C A 54 GLN N A 54 GLN CA A 54 GLN C 1.0 -81.8 -46.8 PHI 54 54 A 54 GLN N A 54 GLN CA A 54 GLN C A 55 LEU N 1.0 -60.1 -21.3 PSI 55 55 A 54 GLN C A 55 LEU N A 55 LEU CA A 55 LEU C 1.0 -83.0 -47.2 PHI 56 56 A 55 LEU N A 55 LEU CA A 55 LEU C A 56 HIS N 1.0 -61.2 -24.6 PSI 57 57 A 55 LEU C A 56 HIS N A 56 HIS CA A 56 HIS C 1.0 -82.2 -44.6 PHI 58 58 A 56 HIS N A 56 HIS CA A 56 HIS C A 57 HIS N 1.0 -60.0 -21.6 PSI 59 59 A 56 HIS C A 57 HIS N A 57 HIS CA A 57 HIS C 1.0 -82.7 -43.7 PHI 60 60 A 57 HIS N A 57 HIS CA A 57 HIS C A 58 GLN N 1.0 -64.8 -17.4 PSI 61 61 A 57 HIS C A 58 GLN N A 58 GLN CA A 58 GLN C 1.0 -87.8 -34.8 PHI 62 62 A 58 GLN N A 58 GLN CA A 58 GLN C A 59 ARG N 1.0 -65.3 -22.9 PSI 63 63 A 58 GLN C A 59 ARG N A 59 ARG CA A 59 ARG C 1.0 -82.0 -40.6 PHI 64 64 A 59 ARG N A 59 ARG CA A 59 ARG C A 60 SER N 1.0 -61.7 -21.9 PSI 65 65 A 59 ARG C A 60 SER N A 60 SER CA A 60 SER C 1.0 -82.9 -42.1 PHI 66 66 A 60 SER N A 60 SER CA A 60 SER C A 61 ARG N 1.0 -59.1 -17.9 PSI 67 67 A 60 SER C A 61 ARG N A 61 ARG CA A 61 ARG C 1.0 -91.7 -46.7 PHI 68 68 A 61 ARG N A 61 ARG CA A 61 ARG C A 62 TYR N 1.0 -55.4 -13.0 PSI 69 69 A 61 ARG C A 62 TYR N A 62 TYR CA A 62 TYR C 1.0 -105.2 -41.2 PHI 70 70 A 62 TYR N A 62 TYR CA A 62 TYR C A 63 ILE N 1.0 -67.1 -13.9 PSI 71 71 A 62 TYR C A 63 ILE N A 63 ILE CA A 63 ILE C 1.0 -80.2 -43.0 PHI 72 72 A 63 ILE N A 63 ILE CA A 63 ILE C A 64 TYR N 1.0 -63.0 -23.8 PSI 73 73 A 63 ILE C A 64 TYR N A 64 TYR CA A 64 TYR C 1.0 -80.1 -44.7 PHI 74 74 A 64 TYR N A 64 TYR CA A 64 TYR C A 65 THR N 1.0 -58.8 -21.8 PSI 75 75 A 64 TYR C A 65 THR N A 65 THR CA A 65 THR C 1.0 -90.7 -44.3 PHI 76 76 A 65 THR N A 65 THR CA A 65 THR C A 66 LEU N 1.0 -62.5 -20.1 PSI 77 77 A 65 THR C A 66 LEU N A 66 LEU CA A 66 LEU C 1.0 -82.3 -41.5 PHI 78 78 A 66 LEU N A 66 LEU CA A 66 LEU C A 67 TYR N 1.0 -67.9 -15.9 PSI 79 79 A 66 LEU C A 67 TYR N A 67 TYR CA A 67 TYR C 1.0 -85.6 -38.6 PHI 80 80 A 67 TYR N A 67 TYR CA A 67 TYR C A 68 TYR N 1.0 -64.7 -24.9 PSI 81 81 A 67 TYR C A 68 TYR N A 68 TYR CA A 68 TYR C 1.0 -98.3 -45.1 PHI 82 82 A 68 TYR N A 68 TYR CA A 68 TYR C A 69 LYS N 1.0 -66.5 -3.5 PSI 83 83 A 74 SER C A 75 LYS N A 75 LYS CA A 75 LYS C 1.0 -79.4 -38.8 PHI 84 84 A 75 LYS N A 75 LYS CA A 75 LYS C A 76 ASP N 1.0 -60.6 -16.8 PSI 85 85 A 75 LYS C A 76 ASP N A 76 ASP CA A 76 ASP C 1.0 -81.9 -41.7 PHI 86 86 A 76 ASP N A 76 ASP CA A 76 ASP C A 77 LEU N 1.0 -61.1 -22.5 PSI 87 87 A 76 ASP C A 77 LEU N A 77 LEU CA A 77 LEU C 1.0 -81.8 -47.0 PHI 88 88 A 77 LEU N A 77 LEU CA A 77 LEU C A 78 TYR N 1.0 -63.8 -20.2 PSI 89 89 A 77 LEU C A 78 TYR N A 78 TYR CA A 78 TYR C 1.0 -85.1 -41.1 PHI 90 90 A 78 TYR N A 78 TYR CA A 78 TYR C A 79 ASP N 1.0 -71.6 -23.6 PSI 91 91 A 78 TYR C A 79 ASP N A 79 ASP CA A 79 ASP C 1.0 -85.0 -41.6 PHI 92 92 A 79 ASP N A 79 ASP CA A 79 ASP C A 80 TRP N 1.0 -58.9 -21.7 PSI 93 93 A 79 ASP C A 80 TRP N A 80 TRP CA A 80 TRP C 1.0 -92.3 -44.3 PHI 94 94 A 80 TRP N A 80 TRP CA A 80 TRP C A 81 LEU N 1.0 -62.6 -21.2 PSI 95 95 A 80 TRP C A 81 LEU N A 81 LEU CA A 81 LEU C 1.0 -81.0 -40.2 PHI 96 96 A 81 LEU N A 81 LEU CA A 81 LEU C A 82 ILE N 1.0 -59.5 -13.9 PSI 97 97 A 81 LEU C A 82 ILE N A 82 ILE CA A 82 ILE C 1.0 -87.8 -50.2 PHI 98 98 A 82 ILE N A 82 ILE CA A 82 ILE C A 83 LYS N 1.0 -56.5 -14.9 PSI 99 99 A 82 ILE C A 83 LYS N A 83 LYS CA A 83 LYS C 1.0 -89.1 -45.1 PHI 100 100 A 83 LYS N A 83 LYS CA A 83 LYS C A 84 GLU N 1.0 -57.5 -4.3 PSI 101 101 A 83 LYS C A 84 GLU N A 84 GLU CA A 84 GLU C 1.0 -114.9 -72.9 PHI 102 102 A 84 GLU N A 84 GLU CA A 84 GLU C A 85 LYS N 1.0 -7.1 39.7 PSI 103 103 A 86 TYR C A 87 ALA N A 87 ALA CA A 87 ALA C 1.0 -165.1 -101.9 PHI 104 104 A 87 ALA N A 87 ALA CA A 87 ALA C A 88 ASP N 1.0 131.4 189.2 PSI 105 105 A 87 ALA C A 88 ASP N A 88 ASP CA A 88 ASP C 1.0 -144.9 -48.5 PHI 106 106 A 88 ASP N A 88 ASP CA A 88 ASP C A 89 LYS N 1.0 102.9 171.9 PSI 107 107 A 88 ASP C A 89 LYS N A 89 LYS CA A 89 LYS C 1.0 -78.1 -37.1 PHI 108 108 A 89 LYS N A 89 LYS CA A 89 LYS C A 90 LEU N 1.0 -62.2 -9.4 PSI 109 109 A 89 LYS C A 90 LEU N A 90 LEU CA A 90 LEU C 1.0 -83.8 -48.6 PHI 110 110 A 90 LEU N A 90 LEU CA A 90 LEU C A 91 LEU N 1.0 -61.9 -18.9 PSI 111 111 A 90 LEU C A 91 LEU N A 91 LEU CA A 91 LEU C 1.0 -85.4 -46.0 PHI 112 112 A 91 LEU N A 91 LEU CA A 91 LEU C A 92 ILE N 1.0 -65.0 -24.4 PSI 113 113 A 91 LEU C A 92 ILE N A 92 ILE CA A 92 ILE C 1.0 -85.9 -40.1 PHI 114 114 A 92 ILE N A 92 ILE CA A 92 ILE C A 93 ALA N 1.0 -63.0 -26.6 PSI 115 115 A 92 ILE C A 93 ALA N A 93 ALA CA A 93 ALA C 1.0 -83.5 -43.1 PHI 116 116 A 93 ALA N A 93 ALA CA A 93 ALA C A 94 LYS N 1.0 -62.1 -9.7 PSI 117 117 A 93 ALA C A 94 LYS N A 94 LYS CA A 94 LYS C 1.0 -108.0 -43.2 PHI 118 118 A 94 LYS N A 94 LYS CA A 94 LYS C A 95 TRP N 1.0 -61.1 19.3 PSI 119 119 A 94 LYS C A 95 TRP N A 95 TRP CA A 95 TRP C 1.0 -122.4 -47.6 PHI 120 120 A 95 TRP N A 95 TRP CA A 95 TRP C A 96 ARG N 1.0 -44.6 44.8 PSI 121 121 A 125 PRO C A 126 ARG N A 126 ARG CA A 126 ARG C 1.0 -74.9 -35.3 PHI 122 122 A 126 ARG N A 126 ARG CA A 126 ARG C A 127 ALA N 1.0 -60.9 -18.1 PSI 123 123 A 126 ARG C A 127 ALA N A 127 ALA CA A 127 ALA C 1.0 -79.6 -38.6 PHI 124 124 A 127 ALA N A 127 ALA CA A 127 ALA C A 128 GLN N 1.0 -61.4 -20.0 PSI 125 125 A 127 ALA C A 128 GLN N A 128 GLN CA A 128 GLN C 1.0 -85.4 -44.4 PHI 126 126 A 128 GLN N A 128 GLN CA A 128 GLN C A 129 LEU N 1.0 -61.8 -23.2 PSI 127 127 A 128 GLN C A 129 LEU N A 129 LEU CA A 129 LEU C 1.0 -85.0 -42.2 PHI 128 128 A 129 LEU N A 129 LEU CA A 129 LEU C A 130 GLU N 1.0 -55.2 -18.4 PSI 129 129 A 129 LEU C A 130 GLU N A 130 GLU CA A 130 GLU C 1.0 -86.8 -43.4 PHI 130 130 A 130 GLU N A 130 GLU CA A 130 GLU C A 131 GLU N 1.0 -57.9 -17.1 PSI 131 131 A 130 GLU C A 131 GLU N A 131 GLU CA A 131 GLU C 1.0 -85.7 -45.3 PHI 132 132 A 131 GLU N A 131 GLU CA A 131 GLU C A 132 GLU N 1.0 -61.7 -20.1 PSI 133 133 A 131 GLU C A 132 GLU N A 132 GLU CA A 132 GLU C 1.0 -83.6 -43.4 PHI 134 134 A 132 GLU N A 132 GLU CA A 132 GLU C A 133 ALA N 1.0 -62.4 -11.6 PSI 135 135 A 132 GLU C A 133 ALA N A 133 ALA CA A 133 ALA C 1.0 -97.0 -38.4 PHI 136 136 A 133 ALA N A 133 ALA CA A 133 ALA C A 134 ARG N 1.0 -62.3 -12.1 PSI 137 137 A 133 ALA C A 134 ARG N A 134 ARG CA A 134 ARG C 1.0 -93.2 -33.4 PHI 138 138 A 134 ARG N A 134 ARG CA A 134 ARG C A 135 LYS N 1.0 -63.0 -23.6 PSI 139 139 A 134 ARG C A 135 LYS N A 135 LYS CA A 135 LYS C 1.0 -87.0 -41.4 PHI 140 140 A 135 LYS N A 135 LYS CA A 135 LYS C A 136 LYS N 1.0 -58.6 -9.6 PSI stop_ save_