data_nef_c25688_2n50 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 25687 PDB 2N50 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 THR middle . . 3 A 3 ARG middle . . 4 A 4 GLU middle . . 5 A 5 GLU middle . . 6 A 6 VAL middle . . 7 A 7 LEU middle . . 8 A 8 GLN middle . . 9 A 9 LYS middle . . 10 A 10 VAL middle . . 11 A 11 ALA middle . . 12 A 12 LYS middle . . 13 A 13 ILE middle . . 14 A 14 ILE middle . . 15 A 15 SER middle . . 16 A 16 ASN middle . . 17 A 17 HIS middle . . 18 A 18 PHE middle . . 19 A 19 ASP middle . . 20 A 20 ILE middle . . 21 A 21 GLU middle . . 22 A 22 ALA middle . . 23 A 23 ASP middle . . 24 A 24 GLN middle . . 25 A 25 VAL middle . . 26 A 26 THR middle . . 27 A 27 ASP middle . . 28 A 28 GLN middle . . 29 A 29 LEU middle . . 30 A 30 ASN middle . . 31 A 31 ILE middle . . 32 A 32 LYS middle . . 33 A 33 ASP middle . . 34 A 34 ASP middle . . 35 A 35 LEU middle . . 36 A 36 ASN middle . . 37 A 37 ALA middle . . 38 A 38 ASP middle . . 39 A 39 SER middle . . 40 A 40 ILE middle . . 41 A 41 SER middle . . 42 A 42 VAL middle . . 43 A 43 MET middle . . 44 A 44 GLU middle . . 45 A 45 PHE middle . . 46 A 46 VAL middle . . 47 A 47 LEU middle . . 48 A 48 GLU middle . . 49 A 49 LEU middle . . 50 A 50 GLU middle . . 51 A 51 ASP middle . . 52 A 52 GLU middle . . 53 A 53 PHE middle . . 54 A 54 GLY middle . false 55 A 55 THR middle . . 56 A 56 GLU middle . . 57 A 57 ILE middle . . 58 A 58 SER middle . . 59 A 59 ASP middle . . 60 A 60 GLU middle . . 61 A 61 ASP middle . . 62 A 62 ALA middle . . 63 A 63 GLU middle . . 64 A 64 LYS middle . . 65 A 65 ILE middle . . 66 A 66 GLU middle . . 67 A 67 THR middle . . 68 A 68 VAL middle . . 69 A 69 GLY middle . false 70 A 70 ALA middle . . 71 A 71 ALA middle . . 72 A 72 VAL middle . . 73 A 73 ASP middle . . 74 A 74 TYR middle . . 75 A 75 ILE middle . . 76 A 76 VAL middle . . 77 A 77 SER middle . . 78 A 78 ASN middle . . 79 A 79 SER end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET CA C 13 56.067 0.000 A 1 MET CB C 13 35.110 0.000 A 2 THR H H 1 9.030 0.011 A 2 THR HA H 1 4.526 0.013 A 2 THR HB H 1 4.525 0.009 A 2 THR HG2% H 1 1.339 0.003 A 2 THR CA C 13 60.675 0.563 A 2 THR CB C 13 72.146 0.478 A 2 THR CG2 C 13 21.809 0.268 A 2 THR N N 15 115.001 0.034 A 3 ARG H H 1 9.059 0.008 A 3 ARG HA H 1 3.637 0.012 A 3 ARG HBy H 1 1.860 0.005 A 3 ARG HBx H 1 1.424 0.008 A 3 ARG HDy H 1 3.197 0.009 A 3 ARG HDx H 1 3.157 0.008 A 3 ARG HGx H 1 1.711 0.007 A 3 ARG HGy H 1 1.711 0.007 A 3 ARG CA C 13 60.732 0.170 A 3 ARG CB C 13 29.347 0.215 A 3 ARG CD C 13 42.874 0.064 A 3 ARG CG C 13 29.223 0.118 A 3 ARG N N 15 121.859 0.062 A 4 GLU H H 1 8.711 0.005 A 4 GLU HA H 1 3.974 0.012 A 4 GLU HBy H 1 2.085 0.005 A 4 GLU HBx H 1 1.931 0.002 A 4 GLU HGx H 1 2.542 0.002 A 4 GLU HGy H 1 2.542 0.002 A 4 GLU CA C 13 60.239 0.505 A 4 GLU CB C 13 29.380 0.268 A 4 GLU CG C 13 36.793 0.000 A 4 GLU N N 15 117.138 0.058 A 5 GLU H H 1 7.701 0.006 A 5 GLU HA H 1 4.056 0.021 A 5 GLU HBy H 1 2.345 0.007 A 5 GLU HBx H 1 2.030 0.005 A 5 GLU HGx H 1 2.634 0.024 A 5 GLU HGy H 1 2.634 0.024 A 5 GLU CA C 13 59.592 0.202 A 5 GLU CB C 13 30.197 0.246 A 5 GLU CG C 13 36.903 0.105 A 5 GLU N N 15 120.237 0.084 A 6 VAL H H 1 8.121 0.008 A 6 VAL HA H 1 3.734 0.016 A 6 VAL HB H 1 2.195 0.011 A 6 VAL HGx% H 1 0.830 0.010 A 6 VAL HGy% H 1 1.010 0.010 A 6 VAL CA C 13 67.696 0.405 A 6 VAL CB C 13 31.300 0.235 A 6 VAL CGy C 13 23.345 0.119 A 6 VAL CGx C 13 21.498 0.047 A 6 VAL N N 15 121.083 0.071 A 7 LEU H H 1 8.868 0.003 A 7 LEU HA H 1 3.940 0.011 A 7 LEU HBy H 1 2.014 0.005 A 7 LEU HBx H 1 1.550 0.015 A 7 LEU HDx% H 1 0.939 0.007 A 7 LEU HDy% H 1 0.780 0.005 A 7 LEU HG H 1 1.547 0.007 A 7 LEU CA C 13 58.970 0.318 A 7 LEU CB C 13 41.053 0.257 A 7 LEU CDx C 13 23.680 0.194 A 7 LEU CG C 13 25.570 0.000 A 7 LEU N N 15 121.074 0.057 A 8 GLN H H 1 7.951 0.004 A 8 GLN HA H 1 4.045 0.008 A 8 GLN HBx H 1 2.196 0.013 A 8 GLN HBy H 1 2.196 0.013 A 8 GLN HGx H 1 2.599 0.005 A 8 GLN HGy H 1 2.599 0.005 A 8 GLN CA C 13 59.336 0.159 A 8 GLN CB C 13 28.779 0.096 A 8 GLN CG C 13 34.155 0.056 A 8 GLN N N 15 116.719 0.017 A 9 LYS H H 1 7.762 0.008 A 9 LYS HA H 1 4.178 0.011 A 9 LYS HBy H 1 2.214 0.005 A 9 LYS HBx H 1 1.945 0.005 A 9 LYS HDx H 1 1.733 0.014 A 9 LYS HDy H 1 1.733 0.014 A 9 LYS HEx H 1 3.707 0.020 A 9 LYS HEy H 1 3.707 0.020 A 9 LYS HGx H 1 1.451 0.015 A 9 LYS HGy H 1 1.451 0.015 A 9 LYS CA C 13 59.793 0.285 A 9 LYS CB C 13 33.575 0.143 A 9 LYS CD C 13 25.810 0.073 A 9 LYS CG C 13 25.545 0.258 A 9 LYS N N 15 119.603 0.039 A 10 VAL H H 1 9.283 0.006 A 10 VAL HA H 1 3.716 0.023 A 10 VAL HB H 1 2.228 0.008 A 10 VAL HGx% H 1 0.827 0.005 A 10 VAL HGy% H 1 1.073 0.026 A 10 VAL CA C 13 67.706 0.199 A 10 VAL CB C 13 31.544 0.153 A 10 VAL CGy C 13 23.349 0.214 A 10 VAL CGx C 13 21.510 0.031 A 10 VAL N N 15 121.142 0.043 A 11 ALA H H 1 9.354 0.004 A 11 ALA HA H 1 3.979 0.011 A 11 ALA HB% H 1 1.617 0.005 A 11 ALA CA C 13 56.217 0.260 A 11 ALA CB C 13 17.867 0.401 A 11 ALA N N 15 122.653 0.064 A 12 LYS H H 1 7.459 0.005 A 12 LYS HA H 1 4.037 0.013 A 12 LYS HBy H 1 2.105 0.005 A 12 LYS HBx H 1 1.997 0.013 A 12 LYS HEx H 1 2.993 0.013 A 12 LYS HEy H 1 2.993 0.013 A 12 LYS HGy H 1 1.592 0.013 A 12 LYS HGx H 1 1.452 0.010 A 12 LYS CA C 13 59.282 0.128 A 12 LYS CB C 13 32.022 0.136 A 12 LYS CD C 13 29.169 0.000 A 12 LYS CG C 13 25.246 0.130 A 12 LYS N N 15 117.599 0.016 A 13 ILE H H 1 7.908 0.008 A 13 ILE HA H 1 3.929 0.015 A 13 ILE HB H 1 2.232 0.012 A 13 ILE HD1% H 1 0.844 0.006 A 13 ILE HG1y H 1 1.982 0.005 A 13 ILE HG1x H 1 1.212 0.013 A 13 ILE HG2% H 1 1.188 0.005 A 13 ILE CA C 13 66.132 0.246 A 13 ILE CB C 13 38.785 0.178 A 13 ILE CD1 C 13 14.694 0.022 A 13 ILE CG1 C 13 28.887 0.082 A 13 ILE CG2 C 13 18.325 0.082 A 13 ILE N N 15 121.205 0.086 A 14 ILE H H 1 9.178 0.006 A 14 ILE HA H 1 3.885 0.021 A 14 ILE HB H 1 2.373 0.013 A 14 ILE HD1% H 1 0.334 0.012 A 14 ILE HG1y H 1 1.514 0.016 A 14 ILE HG1x H 1 1.361 0.020 A 14 ILE HG2% H 1 0.737 0.010 A 14 ILE CA C 13 64.169 0.239 A 14 ILE CB C 13 36.055 0.147 A 14 ILE CD1 C 13 12.584 0.047 A 14 ILE CG1 C 13 29.061 0.058 A 14 ILE CG2 C 13 18.079 0.047 A 14 ILE N N 15 121.498 0.094 A 15 SER H H 1 8.297 0.009 A 15 SER HA H 1 4.658 0.008 A 15 SER HBy H 1 4.207 0.008 A 15 SER HBx H 1 3.936 0.009 A 15 SER CA C 13 61.294 0.143 A 15 SER CB C 13 63.906 0.114 A 15 SER N N 15 115.799 0.022 A 16 ASN H H 1 7.401 0.009 A 16 ASN HA H 1 4.805 0.007 A 16 ASN HBy H 1 2.695 0.010 A 16 ASN HBx H 1 2.099 0.006 A 16 ASN HD2y H 1 6.658 0.007 A 16 ASN HD2x H 1 6.530 0.046 A 16 ASN CA C 13 54.562 0.000 A 16 ASN CB C 13 39.930 0.126 A 16 ASN N N 15 118.370 0.025 A 17 HIS H H 1 7.849 0.009 A 17 HIS HA H 1 4.354 0.010 A 17 HIS HBx H 1 2.560 0.007 A 17 HIS HBy H 1 2.560 0.007 A 17 HIS HD2 H 1 7.427 0.000 A 17 HIS HE1 H 1 8.478 0.002 A 17 HIS CA C 13 57.164 0.262 A 17 HIS CB C 13 31.465 0.194 A 17 HIS CD2 C 13 7.424 0.002 A 17 HIS N N 15 115.522 0.032 A 18 PHE H H 1 8.434 0.007 A 18 PHE HA H 1 4.960 0.004 A 18 PHE HBy H 1 3.279 0.009 A 18 PHE HBx H 1 2.595 0.007 A 18 PHE HDx H 1 7.477 0.003 A 18 PHE HDy H 1 7.477 0.003 A 18 PHE HEx H 1 6.803 0.003 A 18 PHE HEy H 1 6.803 0.003 A 18 PHE HZ H 1 6.682 0.025 A 18 PHE CA C 13 56.635 0.211 A 18 PHE CB C 13 41.815 0.137 A 18 PHE N N 15 117.284 0.045 A 19 ASP H H 1 8.615 0.009 A 19 ASP HA H 1 4.732 0.009 A 19 ASP HBy H 1 2.893 0.009 A 19 ASP HBx H 1 2.575 0.007 A 19 ASP CA C 13 54.196 0.286 A 19 ASP CB C 13 38.993 0.204 A 19 ASP N N 15 120.589 0.029 A 20 ILE H H 1 7.937 0.009 A 20 ILE HA H 1 4.411 0.014 A 20 ILE HB H 1 1.684 0.011 A 20 ILE HD1% H 1 0.708 0.021 A 20 ILE HG1y H 1 1.472 0.004 A 20 ILE HG1x H 1 1.227 0.010 A 20 ILE HG2% H 1 0.556 0.015 A 20 ILE CA C 13 60.044 0.171 A 20 ILE CB C 13 40.521 0.123 A 20 ILE CD1 C 13 14.694 0.044 A 20 ILE CG1 C 13 28.057 0.063 A 20 ILE CG2 C 13 16.447 0.099 A 20 ILE N N 15 121.099 0.089 A 21 GLU H H 1 8.191 0.011 A 21 GLU HA H 1 4.388 0.015 A 21 GLU HBx H 1 1.855 0.037 A 21 GLU HBy H 1 1.855 0.037 A 21 GLU HGx H 1 2.306 0.007 A 21 GLU HGy H 1 2.306 0.007 A 21 GLU CA C 13 56.847 0.116 A 21 GLU CB C 13 30.645 0.419 A 21 GLU CG C 13 36.527 0.051 A 21 GLU N N 15 125.091 0.061 A 22 ALA H H 1 9.011 0.004 A 22 ALA HA H 1 3.891 0.011 A 22 ALA HB% H 1 1.418 0.008 A 22 ALA CA C 13 56.073 0.300 A 22 ALA CB C 13 18.004 0.190 A 22 ALA N N 15 125.431 0.157 A 23 ASP H H 1 8.452 0.003 A 23 ASP HA H 1 4.388 0.016 A 23 ASP HBy H 1 2.767 0.025 A 23 ASP HBx H 1 2.244 0.019 A 23 ASP CA C 13 55.718 0.266 A 23 ASP CB C 13 40.072 0.185 A 23 ASP N N 15 113.394 0.056 A 24 GLN H H 1 7.805 0.006 A 24 GLN HA H 1 4.319 0.012 A 24 GLN HBy H 1 2.312 0.008 A 24 GLN HBx H 1 2.096 0.004 A 24 GLN HGx H 1 2.368 0.011 A 24 GLN HGy H 1 2.368 0.011 A 24 GLN CA C 13 55.293 0.128 A 24 GLN CB C 13 29.495 0.146 A 24 GLN CG C 13 34.274 0.085 A 24 GLN N N 15 116.571 0.026 A 25 VAL H H 1 7.416 0.007 A 25 VAL HA H 1 3.603 0.011 A 25 VAL HB H 1 2.312 0.013 A 25 VAL HG11 H 1 1.023 0.021 A 25 VAL HG12 H 1 0.881 0.007 A 25 VAL HG13 H 1 1.023 0.021 A 25 VAL HGy% H 1 0.930 0.003 A 25 VAL CA C 13 64.923 0.245 A 25 VAL CB C 13 31.708 0.150 A 25 VAL CGy C 13 22.839 0.122 A 25 VAL CGx C 13 21.285 0.020 A 25 VAL N N 15 121.068 0.051 A 26 THR H H 1 6.819 0.007 A 26 THR HA H 1 4.740 0.010 A 26 THR HB H 1 4.508 0.008 A 26 THR HG2% H 1 1.146 0.007 A 26 THR CA C 13 58.834 0.724 A 26 THR CB C 13 72.672 0.193 A 26 THR CG2 C 13 21.349 0.234 A 26 THR N N 15 116.219 0.032 A 27 ASP H H 1 8.717 0.006 A 27 ASP HA H 1 4.018 0.010 A 27 ASP HBx H 1 2.545 0.010 A 27 ASP HBy H 1 2.545 0.010 A 27 ASP CA C 13 56.643 0.185 A 27 ASP CB C 13 41.696 0.206 A 27 ASP N N 15 117.482 0.038 A 28 GLN H H 1 7.781 0.004 A 28 GLN HA H 1 4.164 0.012 A 28 GLN HBy H 1 2.173 0.006 A 28 GLN HBx H 1 1.949 0.006 A 28 GLN HGx H 1 2.377 0.020 A 28 GLN HGy H 1 2.377 0.020 A 28 GLN CA C 13 56.556 0.176 A 28 GLN CB C 13 28.919 0.258 A 28 GLN CG C 13 34.212 0.005 A 28 GLN N N 15 114.554 0.046 A 29 LEU H H 1 7.133 0.008 A 29 LEU HA H 1 3.992 0.009 A 29 LEU HBy H 1 1.724 0.025 A 29 LEU HBx H 1 1.638 0.007 A 29 LEU CA C 13 56.911 0.186 A 29 LEU CB C 13 42.095 0.171 A 29 LEU N N 15 121.505 0.027 A 30 ASN H H 1 9.634 0.004 A 30 ASN HA H 1 4.972 0.010 A 30 ASN HBy H 1 2.766 0.007 A 30 ASN HBx H 1 2.579 0.005 A 30 ASN HD2x H 1 7.799 0.007 A 30 ASN CA C 13 52.906 0.184 A 30 ASN CB C 13 40.703 0.173 A 30 ASN N N 15 127.369 0.132 A 31 ILE H H 1 8.245 0.010 A 31 ILE HA H 1 3.123 0.016 A 31 ILE HB H 1 1.403 0.014 A 31 ILE HG1y H 1 1.155 0.007 A 31 ILE HG1x H 1 0.641 0.009 A 31 ILE HG2% H 1 0.292 0.008 A 31 ILE CA C 13 65.078 0.161 A 31 ILE CB C 13 37.818 0.131 A 31 ILE CD1 C 13 13.267 0.106 A 31 ILE CG1 C 13 27.953 0.092 A 31 ILE CG2 C 13 17.502 0.066 A 31 ILE N N 15 125.769 0.115 A 32 LYS H H 1 8.087 0.008 A 32 LYS HA H 1 4.083 0.021 A 32 LYS HBy H 1 1.832 0.010 A 32 LYS HBx H 1 1.781 0.013 A 32 LYS HDx H 1 1.311 0.012 A 32 LYS HDy H 1 1.311 0.012 A 32 LYS HEx H 1 2.985 0.009 A 32 LYS HEy H 1 2.985 0.009 A 32 LYS HGx H 1 1.458 0.021 A 32 LYS HGy H 1 1.458 0.021 A 32 LYS CA C 13 59.430 0.156 A 32 LYS CB C 13 32.632 0.124 A 32 LYS CD C 13 25.446 0.059 A 32 LYS CG C 13 29.482 0.188 A 32 LYS N N 15 117.526 0.025 A 33 ASP H H 1 8.411 0.004 A 33 ASP HA H 1 4.485 0.008 A 33 ASP HBy H 1 2.649 0.008 A 33 ASP HBx H 1 2.203 0.008 A 33 ASP CA C 13 56.442 0.224 A 33 ASP CB C 13 41.081 0.197 A 33 ASP N N 15 117.165 0.036 A 34 ASP H H 1 8.419 0.007 A 34 ASP HA H 1 4.779 0.007 A 34 ASP HBy H 1 2.855 0.017 A 34 ASP HBx H 1 2.592 0.005 A 34 ASP CA C 13 56.825 0.002 A 34 ASP CB C 13 41.631 0.166 A 34 ASP N N 15 115.976 0.035 A 35 LEU H H 1 6.650 0.012 A 35 LEU HA H 1 4.455 0.008 A 35 LEU HBy H 1 1.765 0.004 A 35 LEU HBx H 1 1.166 0.008 A 35 LEU HDx% H 1 0.621 0.010 A 35 LEU HG H 1 0.160 0.008 A 35 LEU CA C 13 53.991 0.285 A 35 LEU CB C 13 40.522 0.155 A 35 LEU CDx C 13 22.765 0.091 A 35 LEU CG C 13 25.443 0.039 A 35 LEU N N 15 114.532 0.035 A 36 ASN H H 1 7.237 0.005 A 36 ASN HA H 1 4.533 0.015 A 36 ASN HBy H 1 3.038 0.008 A 36 ASN HBx H 1 2.732 0.009 A 36 ASN HD2x H 1 7.586 0.012 A 36 ASN HD2y H 1 7.586 0.012 A 36 ASN CA C 13 54.018 0.236 A 36 ASN CB C 13 37.197 0.175 A 36 ASN N N 15 114.878 0.056 A 37 ALA H H 1 7.625 0.009 A 37 ALA HA H 1 4.389 0.008 A 37 ALA HB% H 1 1.192 0.005 A 37 ALA CA C 13 53.633 0.235 A 37 ALA CB C 13 21.874 0.145 A 37 ALA N N 15 119.952 0.063 A 38 ASP H H 1 8.186 0.011 A 38 ASP HA H 1 4.784 0.007 A 38 ASP HBy H 1 3.202 0.025 A 38 ASP HBx H 1 2.867 0.012 A 38 ASP CA C 13 52.822 0.000 A 38 ASP CB C 13 41.926 0.142 A 38 ASP N N 15 121.225 0.023 A 39 SER H H 1 8.919 0.073 A 39 SER HA H 1 4.138 0.055 A 39 SER HBx H 1 4.097 0.037 A 39 SER HBy H 1 4.097 0.037 A 39 SER CA C 13 63.220 0.000 A 39 SER N N 15 113.722 0.016 A 40 ILE H H 1 7.844 0.037 A 40 ILE HA H 1 3.904 0.014 A 40 ILE HB H 1 2.053 0.010 A 40 ILE HD1% H 1 0.909 0.003 A 40 ILE HG1y H 1 1.613 0.032 A 40 ILE HG1x H 1 1.247 0.013 A 40 ILE HG2% H 1 0.912 0.005 A 40 ILE CA C 13 64.350 0.289 A 40 ILE CB C 13 37.141 0.316 A 40 ILE CD1 C 13 12.595 0.015 A 40 ILE CG1 C 13 28.903 0.148 A 40 ILE CG2 C 13 17.465 0.195 A 40 ILE N N 15 123.493 0.532 A 41 SER H H 1 8.381 0.018 A 41 SER HA H 1 4.398 0.017 A 41 SER HBx H 1 4.050 0.044 A 41 SER HBy H 1 4.050 0.044 A 41 SER CA C 13 62.204 0.401 A 41 SER CB C 13 63.445 0.481 A 41 SER N N 15 117.881 0.031 A 42 VAL H H 1 8.336 0.021 A 42 VAL HA H 1 3.737 0.013 A 42 VAL HB H 1 2.146 0.020 A 42 VAL HGx% H 1 0.992 0.013 A 42 VAL CA C 13 67.910 0.187 A 42 VAL CB C 13 31.642 0.170 A 42 VAL CGx C 13 23.234 0.162 A 42 VAL N N 15 121.117 0.066 A 43 MET H H 1 7.739 0.035 A 43 MET HA H 1 4.187 0.010 A 43 MET HBy H 1 2.605 0.015 A 43 MET HBx H 1 2.271 0.018 A 43 MET HGx H 1 2.714 0.018 A 43 MET HGy H 1 2.714 0.018 A 43 MET CA C 13 58.827 0.206 A 43 MET CB C 13 31.892 0.102 A 43 MET CG C 13 31.944 0.038 A 43 MET N N 15 119.377 0.155 A 44 GLU H H 1 8.448 0.034 A 44 GLU HA H 1 3.946 0.033 A 44 GLU HBx H 1 1.958 0.017 A 44 GLU HBy H 1 1.958 0.017 A 44 GLU HGx H 1 2.639 0.010 A 44 GLU HGy H 1 2.639 0.010 A 44 GLU CA C 13 59.754 0.240 A 44 GLU CB C 13 29.654 0.174 A 44 GLU CG C 13 36.740 0.038 A 44 GLU N N 15 118.457 0.083 A 45 PHE H H 1 8.044 0.013 A 45 PHE HA H 1 3.920 0.014 A 45 PHE HBy H 1 3.590 0.006 A 45 PHE HBx H 1 2.959 0.008 A 45 PHE HDx H 1 6.887 0.003 A 45 PHE HDy H 1 6.887 0.003 A 45 PHE HEy H 1 7.160 0.002 A 45 PHE HEx H 1 7.104 0.003 A 45 PHE HZ H 1 7.476 0.002 A 45 PHE CA C 13 61.060 0.257 A 45 PHE CB C 13 38.863 0.135 A 45 PHE N N 15 121.629 0.054 A 46 VAL H H 1 8.351 0.012 A 46 VAL HA H 1 2.997 0.017 A 46 VAL HB H 1 2.162 0.014 A 46 VAL HGx% H 1 0.983 0.007 A 46 VAL HGy% H 1 0.774 0.007 A 46 VAL CA C 13 67.527 0.207 A 46 VAL CB C 13 31.529 0.245 A 46 VAL CGy C 13 23.557 0.169 A 46 VAL CGx C 13 21.966 0.141 A 46 VAL N N 15 120.564 0.080 A 47 LEU H H 1 8.093 0.027 A 47 LEU HA H 1 4.196 0.013 A 47 LEU HBy H 1 1.847 0.016 A 47 LEU HBx H 1 1.556 0.012 A 47 LEU HDx% H 1 0.903 0.008 A 47 LEU CA C 13 58.312 0.270 A 47 LEU CB C 13 41.665 0.184 A 47 LEU CDx C 13 23.506 0.155 A 47 LEU CG C 13 25.570 0.000 A 47 LEU N N 15 118.809 0.071 A 48 GLU H H 1 7.700 0.011 A 48 GLU HA H 1 4.231 0.012 A 48 GLU HBy H 1 2.294 0.008 A 48 GLU HBx H 1 2.033 0.011 A 48 GLU HGy H 1 2.612 0.017 A 48 GLU HGx H 1 2.359 0.018 A 48 GLU CA C 13 59.855 0.210 A 48 GLU CB C 13 28.790 0.256 A 48 GLU CG C 13 36.980 0.276 A 48 GLU N N 15 119.870 0.096 A 49 LEU H H 1 8.131 0.013 A 49 LEU HA H 1 3.991 0.007 A 49 LEU HBy H 1 1.962 0.009 A 49 LEU HBx H 1 1.257 0.024 A 49 LEU HDx% H 1 0.765 0.011 A 49 LEU HG H 1 0.451 0.012 A 49 LEU CA C 13 58.728 0.197 A 49 LEU CB C 13 42.362 0.159 A 49 LEU CDx C 13 23.616 0.213 A 49 LEU CG C 13 25.529 0.042 A 49 LEU N N 15 120.332 0.134 A 50 GLU H H 1 8.326 0.015 A 50 GLU HA H 1 3.965 0.006 A 50 GLU HBx H 1 2.015 0.017 A 50 GLU HBy H 1 2.015 0.017 A 50 GLU HGx H 1 2.367 0.004 A 50 GLU HGy H 1 2.367 0.004 A 50 GLU CA C 13 59.885 0.216 A 50 GLU CB C 13 29.781 0.232 A 50 GLU N N 15 117.635 0.067 A 51 ASP H H 1 7.958 0.006 A 51 ASP HA H 1 4.408 0.009 A 51 ASP HBy H 1 2.832 0.005 A 51 ASP HBx H 1 2.764 0.011 A 51 ASP CA C 13 56.975 0.163 A 51 ASP CB C 13 41.617 0.173 A 51 ASP N N 15 118.717 0.045 A 52 GLU H H 1 8.619 0.036 A 52 GLU HA H 1 3.987 0.032 A 52 GLU HBy H 1 1.978 0.008 A 52 GLU HBx H 1 1.474 0.008 A 52 GLU HGx H 1 2.621 0.002 A 52 GLU HGy H 1 2.621 0.002 A 52 GLU CA C 13 59.346 0.075 A 52 GLU CB C 13 29.832 0.072 A 52 GLU CG C 13 33.900 0.065 A 52 GLU N N 15 118.793 0.101 A 53 PHE H H 1 8.040 0.012 A 53 PHE HA H 1 4.620 0.008 A 53 PHE HBy H 1 3.333 0.006 A 53 PHE HBx H 1 2.849 0.005 A 53 PHE HDx H 1 7.169 0.003 A 53 PHE HDy H 1 7.169 0.003 A 53 PHE HEx H 1 7.585 0.003 A 53 PHE HEy H 1 7.585 0.003 A 53 PHE HZ H 1 7.323 0.001 A 53 PHE CA C 13 59.090 0.117 A 53 PHE CB C 13 39.471 0.173 A 53 PHE N N 15 112.017 0.058 A 54 GLY H H 1 7.902 0.007 A 54 GLY HAy H 1 4.021 0.013 A 54 GLY HAx H 1 3.946 0.012 A 54 GLY CA C 13 47.380 0.157 A 54 GLY N N 15 111.599 0.033 A 55 THR H H 1 7.652 0.005 A 55 THR HA H 1 4.631 0.010 A 55 THR HB H 1 3.829 0.012 A 55 THR HG2% H 1 1.031 0.008 A 55 THR CA C 13 59.672 0.262 A 55 THR CB C 13 70.866 0.149 A 55 THR CG2 C 13 19.902 0.069 A 55 THR N N 15 113.034 0.034 A 56 GLU H H 1 8.237 0.006 A 56 GLU HA H 1 4.368 0.012 A 56 GLU HBx H 1 1.896 0.005 A 56 GLU HBy H 1 1.896 0.005 A 56 GLU HGx H 1 2.149 0.016 A 56 GLU HGy H 1 2.149 0.016 A 56 GLU CA C 13 56.035 0.244 A 56 GLU CB C 13 31.008 0.179 A 56 GLU CG C 13 36.188 0.167 A 56 GLU N N 15 124.034 0.049 A 57 ILE H H 1 9.623 0.721 A 57 ILE HA H 1 4.214 0.013 A 57 ILE HB H 1 1.536 0.014 A 57 ILE HD1% H 1 0.506 0.008 A 57 ILE HG1x H 1 0.776 0.009 A 57 ILE HG1y H 1 0.776 0.009 A 57 ILE HG2% H 1 0.493 0.007 A 57 ILE CA C 13 60.964 0.206 A 57 ILE CB C 13 38.672 0.151 A 57 ILE CD1 C 13 13.073 0.051 A 57 ILE CG1 C 13 27.448 0.148 A 57 ILE CG2 C 13 16.201 0.036 A 57 ILE N N 15 128.249 0.142 A 58 SER H H 1 9.295 0.016 A 58 SER HA H 1 4.432 0.013 A 58 SER HBy H 1 4.298 0.008 A 58 SER HBx H 1 4.066 0.015 A 58 SER CA C 13 58.130 0.288 A 58 SER CB C 13 64.660 0.172 A 58 SER N N 15 126.591 0.096 A 59 ASP H H 1 8.899 0.008 A 59 ASP HA H 1 4.246 0.013 A 59 ASP HBy H 1 2.680 0.015 A 59 ASP HBx H 1 2.583 0.010 A 59 ASP CA C 13 58.093 0.349 A 59 ASP CB C 13 39.810 0.135 A 59 ASP N N 15 122.348 0.107 A 60 GLU H H 1 8.554 0.019 A 60 GLU HA H 1 4.020 0.021 A 60 GLU HBx H 1 1.973 0.025 A 60 GLU HBy H 1 1.973 0.025 A 60 GLU HGx H 1 2.258 0.004 A 60 GLU HGy H 1 2.258 0.004 A 60 GLU CA C 13 59.385 0.111 A 60 GLU CB C 13 29.555 0.184 A 60 GLU CG C 13 31.942 0.000 A 60 GLU N N 15 118.382 0.081 A 61 ASP H H 1 7.746 0.006 A 61 ASP HA H 1 4.419 0.009 A 61 ASP HBy H 1 2.632 0.004 A 61 ASP HBx H 1 2.253 0.010 A 61 ASP CA C 13 56.888 0.160 A 61 ASP CB C 13 41.119 0.252 A 61 ASP N N 15 119.970 0.039 A 62 ALA H H 1 8.465 0.006 A 62 ALA HA H 1 3.653 0.013 A 62 ALA HB% H 1 1.372 0.008 A 62 ALA CA C 13 55.165 0.186 A 62 ALA CB C 13 18.429 0.135 A 62 ALA N N 15 122.725 0.084 A 63 GLU H H 1 7.447 0.024 A 63 GLU HA H 1 3.989 0.030 A 63 GLU HBx H 1 2.047 0.010 A 63 GLU HBy H 1 2.047 0.010 A 63 GLU HGx H 1 2.320 0.014 A 63 GLU HGy H 1 2.320 0.014 A 63 GLU CA C 13 58.852 0.233 A 63 GLU CB C 13 29.829 0.178 A 63 GLU CG C 13 35.679 0.337 A 63 GLU N N 15 114.767 0.036 A 64 LYS H H 1 7.212 0.011 A 64 LYS HA H 1 4.303 0.015 A 64 LYS HBy H 1 2.036 0.015 A 64 LYS HBx H 1 1.879 0.005 A 64 LYS HDx H 1 2.054 0.005 A 64 LYS HDy H 1 2.054 0.005 A 64 LYS HEx H 1 2.974 0.030 A 64 LYS HEy H 1 2.974 0.030 A 64 LYS HGy H 1 1.590 0.005 A 64 LYS HGx H 1 1.458 0.013 A 64 LYS CA C 13 56.480 0.205 A 64 LYS CB C 13 32.944 0.194 A 64 LYS CD C 13 29.729 0.076 A 64 LYS CG C 13 25.248 0.079 A 64 LYS N N 15 115.365 0.034 A 65 ILE H H 1 7.278 0.016 A 65 ILE HA H 1 3.941 0.015 A 65 ILE HB H 1 1.917 0.009 A 65 ILE HD1% H 1 0.419 0.017 A 65 ILE HG1y H 1 1.648 0.013 A 65 ILE HG1x H 1 0.768 0.009 A 65 ILE HG2% H 1 0.763 0.008 A 65 ILE CA C 13 61.376 0.237 A 65 ILE CB C 13 36.920 0.144 A 65 ILE CD1 C 13 12.750 0.088 A 65 ILE CG1 C 13 27.234 0.096 A 65 ILE CG2 C 13 17.647 0.070 A 65 ILE N N 15 119.443 0.048 A 66 GLU H H 1 7.991 0.019 A 66 GLU HA H 1 4.362 0.012 A 66 GLU HBy H 1 2.148 0.008 A 66 GLU HBx H 1 2.038 0.006 A 66 GLU HGx H 1 2.259 0.007 A 66 GLU HGy H 1 2.259 0.007 A 66 GLU CA C 13 57.157 0.270 A 66 GLU CB C 13 31.560 0.276 A 66 GLU CG C 13 36.659 0.002 A 66 GLU N N 15 121.135 0.153 A 67 THR H H 1 7.221 0.016 A 67 THR HA H 1 5.437 0.004 A 67 THR HB H 1 4.461 0.014 A 67 THR HG2% H 1 1.167 0.007 A 67 THR CA C 13 58.353 0.264 A 67 THR CB C 13 72.869 0.115 A 67 THR CG2 C 13 21.929 0.041 A 67 THR N N 15 106.492 0.089 A 68 VAL H H 1 8.426 0.007 A 68 VAL HA H 1 3.394 0.012 A 68 VAL HB H 1 2.345 0.006 A 68 VAL HGx% H 1 0.905 0.011 A 68 VAL HGy% H 1 0.646 0.007 A 68 VAL CA C 13 67.329 0.211 A 68 VAL CB C 13 31.346 0.156 A 68 VAL CGy C 13 24.891 0.111 A 68 VAL CGx C 13 21.121 0.044 A 68 VAL N N 15 121.769 0.084 A 69 GLY H H 1 9.303 0.003 A 69 GLY HAy H 1 3.944 0.013 A 69 GLY HAx H 1 3.653 0.004 A 69 GLY CA C 13 47.471 0.178 A 69 GLY N N 15 107.148 0.049 A 70 ALA H H 1 7.755 0.018 A 70 ALA HA H 1 4.298 0.015 A 70 ALA HB% H 1 1.648 0.006 A 70 ALA CA C 13 55.008 0.169 A 70 ALA CB C 13 19.073 0.518 A 70 ALA N N 15 122.039 0.043 A 71 ALA H H 1 7.917 0.011 A 71 ALA HA H 1 3.983 0.010 A 71 ALA HB% H 1 1.606 0.020 A 71 ALA CA C 13 56.013 0.177 A 71 ALA CB C 13 17.879 0.216 A 71 ALA N N 15 122.840 0.135 A 72 VAL H H 1 8.392 0.015 A 72 VAL HA H 1 3.301 0.011 A 72 VAL HB H 1 2.264 0.009 A 72 VAL HG11 H 1 1.003 0.007 A 72 VAL HG12 H 1 0.834 0.013 A 72 VAL HG13 H 1 1.003 0.007 A 72 VAL HGy% H 1 0.877 0.006 A 72 VAL CA C 13 66.486 0.167 A 72 VAL CB C 13 31.930 0.169 A 72 VAL CGy C 13 23.296 0.108 A 72 VAL CGx C 13 21.935 0.086 A 72 VAL N N 15 117.746 0.066 A 73 ASP H H 1 8.645 0.008 A 73 ASP HA H 1 4.314 0.008 A 73 ASP HBy H 1 2.690 0.008 A 73 ASP HBx H 1 2.652 0.012 A 73 ASP CA C 13 57.597 0.206 A 73 ASP CB C 13 40.059 0.172 A 73 ASP N N 15 118.392 0.057 A 74 TYR H H 1 8.072 0.004 A 74 TYR HA H 1 3.899 0.010 A 74 TYR HBy H 1 3.137 0.012 A 74 TYR HBx H 1 3.037 0.013 A 74 TYR HDx H 1 6.634 0.007 A 74 TYR HDy H 1 6.829 0.007 A 74 TYR HEx H 1 6.499 0.111 A 74 TYR HEy H 1 6.580 0.132 A 74 TYR CA C 13 62.369 0.224 A 74 TYR CB C 13 38.290 0.172 A 74 TYR N N 15 121.820 0.098 A 75 ILE H H 1 8.067 0.007 A 75 ILE HA H 1 3.418 0.016 A 75 ILE HB H 1 1.761 0.008 A 75 ILE HD1% H 1 0.296 0.012 A 75 ILE HG1y H 1 1.279 0.017 A 75 ILE HG1x H 1 1.045 0.020 A 75 ILE HG2% H 1 0.052 0.006 A 75 ILE CA C 13 63.464 0.131 A 75 ILE CB C 13 36.323 0.124 A 75 ILE CD1 C 13 11.301 0.039 A 75 ILE CG1 C 13 27.224 0.117 A 75 ILE CG2 C 13 17.123 0.037 A 75 ILE N N 15 120.879 0.101 A 76 VAL H H 1 8.681 0.006 A 76 VAL HA H 1 3.598 0.017 A 76 VAL HB H 1 2.133 0.013 A 76 VAL HGx% H 1 0.981 0.010 A 76 VAL HGy% H 1 0.925 0.006 A 76 VAL CA C 13 66.145 0.333 A 76 VAL CB C 13 31.861 0.176 A 76 VAL CGy C 13 22.941 0.098 A 76 VAL CGx C 13 21.296 0.021 A 76 VAL N N 15 119.356 0.081 A 77 SER H H 1 7.846 0.004 A 77 SER HA H 1 4.280 0.008 A 77 SER HBx H 1 3.815 0.007 A 77 SER HBy H 1 3.815 0.007 A 77 SER CA C 13 60.976 0.223 A 77 SER CB C 13 63.696 0.169 A 77 SER N N 15 113.582 0.028 A 78 ASN H H 1 7.801 0.011 A 78 ASN HA H 1 4.728 0.023 A 78 ASN HBy H 1 3.012 0.004 A 78 ASN HBx H 1 2.706 0.009 A 78 ASN CA C 13 54.727 0.008 A 78 ASN CB C 13 39.142 0.232 A 78 ASN N N 15 118.061 0.028 A 79 SER H H 1 7.399 0.003 A 79 SER N N 15 121.089 0.023 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 2 THR H A 2 THR HG2% 1.0 . 3.66 2 2 A 2 THR HG2% A 5 GLU H 1.0 . 5.22 3 3 A 3 ARG HA A 3 ARG HDy 1.0 . 5.35 4 4 A 3 ARG HA A 6 VAL HB 1.0 . 4.18 5 5 A 44 GLU HA A 43 MET HGx 1.0 . 5.10 6 5 A 43 MET HGy A 44 GLU HA 1.0 . 5.10 7 6 A 65 ILE HA A 70 ALA HB% 1.0 . 3.63 8 7 A 3 ARG HA A 3 ARG HGx 1.0 . 3.85 9 7 A 3 ARG HA A 3 ARG HGy 1.0 . 3.85 10 8 A 76 VAL HGx% A 3 ARG HBy 1.0 . 4.59 11 9 A 76 VAL HGx% A 3 ARG HBx 1.0 . 4.59 12 10 A 76 VAL HGx% A 3 ARG HGx 1.0 . 4.05 13 10 A 3 ARG HGy A 76 VAL HGx% 1.0 . 4.05 14 11 A 76 VAL HGx% A 3 ARG HDx 1.0 . 4.97 15 12 A 76 VAL HGx% A 3 ARG HDy 1.0 . 4.97 16 13 A 27 ASP H A 28 GLN HBy 1.0 . 4.68 17 14 A 47 LEU HBx A 48 GLU HGy 1.0 . 5.73 18 15 A 6 VAL HA A 53 PHE HD% 1.0 . 4.41 19 16 A 6 VAL HA A 9 LYS HBy 1.0 . 4.49 20 17 A 10 VAL HGx% A 11 ALA HA 1.0 . 6.00 21 18 A 7 LEU HA A 8 GLN HGx 1.0 . 5.58 22 18 A 7 LEU HA A 8 GLN HGy 1.0 . 5.58 23 19 A 7 LEU HA A 10 VAL HB 1.0 . 3.58 24 20 A 10 VAL H A 49 LEU HD21 1.0 . 5.15 25 21 A 8 GLN HA A 11 ALA HB% 1.0 . 4.14 26 22 A 5 GLU HA A 8 GLN HBx 1.0 . 4.13 27 22 A 5 GLU HA A 8 GLN HBy 1.0 . 4.13 28 23 A 7 LEU HG A 8 GLN HGx 1.0 . 6.00 29 23 A 8 GLN HGy A 7 LEU HG 1.0 . 6.00 30 24 A 6 VAL HA A 9 LYS HBx 1.0 . 5.83 31 25 A 9 LYS HBx A 9 LYS HEx 1.0 . 6.00 32 25 A 9 LYS HBx A 9 LYS HEy 1.0 . 6.00 33 26 A 9 LYS HBx A 9 LYS HDx 1.0 . 3.96 34 26 A 9 LYS HBx A 9 LYS HDy 1.0 . 3.96 35 27 A 9 LYS HBy A 9 LYS HDx 1.0 . 4.11 36 27 A 9 LYS HBy A 9 LYS HDy 1.0 . 4.11 37 28 A 10 VAL HA A 13 ILE HB 1.0 . 4.45 38 29 A 9 LYS HBx A 10 VAL HA 1.0 . 5.26 39 30 A 10 VAL HB A 7 LEU HG 1.0 . 6.00 40 31 A 10 VAL HGy% A 72 VAL H 1.0 . 5.66 41 32 A 10 VAL HGy% A 13 ILE H 1.0 . 5.47 42 33 A 10 VAL HGy% A 49 LEU HA 1.0 . 4.36 43 34 A 10 VAL HA A 10 VAL HGy% 1.0 . 3.88 44 35 A 9 LYS HBx A 10 VAL HGy% 1.0 . 4.94 45 36 A 10 VAL HGy% A 49 LEU HBx 1.0 . 5.66 46 37 A 49 LEU HD21 A 10 VAL HGy% 1.0 . 3.42 47 38 A 10 VAL HGy% A 14 ILE HD1% 1.0 . 3.90 48 39 A 11 ALA HA A 10 VAL HA 1.0 . 5.00 49 40 A 11 ALA HB% A 11 ALA H 1.0 . 3.61 50 41 A 11 ALA HB% A 12 LYS HBy 1.0 . 4.20 51 42 A 12 LYS HBx A 13 ILE HD1% 1.0 . 5.66 52 43 A 13 ILE HA A 12 LYS HEx 1.0 . 4.41 53 43 A 12 LYS HEy A 13 ILE HA 1.0 . 4.41 54 44 A 13 ILE HD1% A 13 ILE HA 1.0 . 5.38 55 45 A 9 LYS HBx A 13 ILE HB 1.0 . 5.09 56 46 A 10 VAL HA A 13 ILE HD1% 1.0 . 3.97 57 47 A 13 ILE HD1% A 14 ILE H 1.0 . 5.35 58 48 A 13 ILE H A 13 ILE HD1% 1.0 . 4.39 59 49 A 48 GLU HGy A 13 ILE HD1% 1.0 . 5.55 60 50 A 13 ILE HD1% A 52 GLU HGx 1.0 . 5.84 61 50 A 13 ILE HD1% A 52 GLU HGy 1.0 . 5.84 62 51 A 13 ILE HB A 13 ILE HD1% 1.0 . 3.59 63 52 A 9 LYS HBx A 13 ILE HD1% 1.0 . 3.69 64 53 A 13 ILE HD1% A 13 ILE HG2% 1.0 . 3.01 65 54 A 13 ILE HG2% A 16 ASN H 1.0 . 4.82 66 55 A 13 ILE HG2% A 9 LYS HA 1.0 . 6.00 67 56 A 13 ILE HA A 13 ILE HG2% 1.0 . 3.67 68 57 A 13 ILE HG2% A 12 LYS HEx 1.0 . 5.16 69 57 A 12 LYS HEy A 13 ILE HG2% 1.0 . 5.16 70 58 A 48 GLU HGy A 13 ILE HG2% 1.0 . 4.81 71 59 A 13 ILE HG2% A 48 GLU HBy 1.0 . 4.52 72 60 A 14 ILE HD1% A 13 ILE HG2% 1.0 . 5.06 73 61 A 14 ILE HA A 45 PHE HEy 1.0 . 5.35 74 62 A 14 ILE HD1% A 14 ILE HB 1.0 . 4.18 75 63 A 14 ILE HD1% A 14 ILE H 1.0 . 4.99 76 64 A 14 ILE HD1% A 18 PHE HD% 1.0 . 4.69 77 65 A 14 ILE HD1% A 14 ILE HA 1.0 . 3.81 78 66 A 10 VAL HGy% A 14 ILE HG1x 1.0 . 4.51 79 67 A 14 ILE HG2% A 15 SER HA 1.0 . 5.30 80 68 A 14 ILE HA A 14 ILE HG2% 1.0 . 3.99 81 69 A 14 ILE HG2% A 17 HIS HBx 1.0 . 5.19 82 69 A 14 ILE HG2% A 17 HIS HBy 1.0 . 5.19 83 70 A 14 ILE HG2% A 18 PHE HBx 1.0 . 5.67 84 71 A 14 ILE HG2% A 25 VAL HG11 1.0 . 4.35 85 72 A 14 ILE HG2% A 31 ILE HG2% 1.0 . 3.70 86 73 A 22 ALA HB% A 15 SER HBx 1.0 . 4.82 87 74 A 14 ILE HA A 17 HIS HBx 1.0 . 4.78 88 74 A 14 ILE HA A 17 HIS HBy 1.0 . 4.78 89 75 A 35 LEU HG A 18 PHE HBx 1.0 . 5.09 90 76 A 35 LEU HG A 18 PHE HBy 1.0 . 5.09 91 77 A 20 ILE HA A 20 ILE HG1x 1.0 . 3.86 92 78 A 20 ILE HA A 35 LEU HD21 1.0 . 4.11 93 79 A 35 LEU HD21 A 20 ILE HB 1.0 . 3.67 94 80 A 20 ILE HD1% A 21 GLU H 1.0 . 4.86 95 81 A 20 ILE HA A 20 ILE HD1% 1.0 . 4.33 96 82 A 15 SER HA A 20 ILE HD1% 1.0 . 5.49 97 83 A 20 ILE HD1% A 22 ALA HA 1.0 . 5.55 98 84 A 20 ILE HD1% A 25 VAL HA 1.0 . 4.39 99 85 A 20 ILE HD1% A 25 VAL HB 1.0 . 4.74 100 86 A 20 ILE HB A 20 ILE HD1% 1.0 . 3.77 101 87 A 20 ILE HD1% A 31 ILE HG1x 1.0 . 3.46 102 88 A 22 ALA HA A 20 ILE HG1y 1.0 . 5.01 103 89 A 15 SER HA A 20 ILE HG2% 1.0 . 4.29 104 90 A 20 ILE HG2% A 21 GLU HA 1.0 . 5.03 105 91 A 20 ILE HG2% A 15 SER HBx 1.0 . 5.74 106 92 A 22 ALA HA A 20 ILE HG2% 1.0 . 5.50 107 93 A 20 ILE HG2% A 18 PHE HBx 1.0 . 5.06 108 94 A 20 ILE HG1x A 20 ILE HG2% 1.0 . 4.17 109 95 A 20 ILE HG1y A 20 ILE HG2% 1.0 . 3.98 110 96 A 31 ILE HG2% A 20 ILE HG2% 1.0 . 3.73 111 97 A 21 GLU HA A 21 GLU HGx 1.0 . 3.90 112 97 A 21 GLU HA A 21 GLU HGy 1.0 . 3.90 113 98 A 22 ALA HB% A 21 GLU HA 1.0 . 4.98 114 99 A 22 ALA HA A 25 VAL HB 1.0 . 5.10 115 100 A 11 ALA HB% A 22 ALA HA 1.0 . 4.50 116 101 A 22 ALA HB% A 23 ASP H 1.0 . 4.22 117 102 A 22 ALA HB% A 25 VAL H 1.0 . 5.05 118 103 A 22 ALA HB% A 21 GLU HGx 1.0 . 5.75 119 103 A 22 ALA HB% A 21 GLU HGy 1.0 . 5.75 120 104 A 22 ALA HB% A 25 VAL HB 1.0 . 6.00 121 105 A 22 ALA HB% A 20 ILE HG2% 1.0 . 5.11 122 106 A 25 VAL H A 23 ASP HA 1.0 . 4.87 123 107 A 21 GLU H A 24 GLN HGx 1.0 . 5.22 124 107 A 21 GLU H A 24 GLN HGy 1.0 . 5.22 125 108 A 24 GLN HA A 24 GLN HGx 1.0 . 3.93 126 108 A 24 GLN HGy A 24 GLN HA 1.0 . 3.93 127 109 A 25 VAL HB A 24 GLN HA 1.0 . 6.00 128 110 A 11 ALA HB% A 25 VAL HB 1.0 . 3.98 129 111 A 25 VAL HB A 68 VAL HGy% 1.0 . 4.55 130 112 A 26 THR H A 25 VAL HG11 1.0 . 5.76 131 113 A 22 ALA HA A 25 VAL HG11 1.0 . 3.45 132 114 A 11 ALA HA A 25 VAL HG11 1.0 . 3.81 133 115 A 25 VAL HA A 25 VAL HG11 1.0 . 3.69 134 116 A 14 ILE HD1% A 25 VAL HG11 1.0 . 4.55 135 117 A 26 THR HB A 27 ASP HBx 1.0 . 5.92 136 117 A 26 THR HB A 27 ASP HBy 1.0 . 5.92 137 118 A 26 THR HA A 26 THR HG2% 1.0 . 3.63 138 119 A 26 THR H A 26 THR HG2% 1.0 . 4.14 139 120 A 25 VAL HA A 26 THR HG2% 1.0 . 4.92 140 121 A 27 ASP HA A 68 VAL HA 1.0 . 5.52 141 122 A 27 ASP HA A 68 VAL HB 1.0 . 3.87 142 123 A 27 ASP HA A 68 VAL HGx% 1.0 . 3.78 143 124 A 26 THR HG2% A 28 GLN HA 1.0 . 4.60 144 125 A 29 LEU HA A 30 ASN H 1.0 . 3.51 145 126 A 26 THR H A 29 LEU HBy 1.0 . 5.16 146 127 A 68 VAL HB A 29 LEU HBy 1.0 . 5.66 147 128 A 68 VAL HGy% A 29 LEU HBy 1.0 . 4.08 148 129 A 68 VAL HGy% A 29 LEU HBx 1.0 . 4.53 149 130 A 29 LEU H A 30 ASN HBy 1.0 . 5.43 150 131 A 29 LEU H A 30 ASN HBx 1.0 . 6.00 151 132 A 30 ASN HBy A 67 THR HG2% 1.0 . 4.73 152 133 A 31 ILE HG1x A 31 ILE HA 1.0 . 3.99 153 134 A 30 ASN HA A 31 ILE HB 1.0 . 5.71 154 135 A 31 ILE HG1x A 30 ASN HA 1.0 . 5.43 155 136 A 31 ILE HG2% A 31 ILE HG1x 1.0 . 4.22 156 137 A 31 ILE HG2% A 31 ILE HG1y 1.0 . 4.16 157 138 A 31 ILE HG2% A 35 LEU HBx 1.0 . 4.57 158 139 A 31 ILE HG2% A 32 LYS HA 1.0 . 5.09 159 140 A 31 ILE HG2% A 31 ILE HA 1.0 . 3.86 160 141 A 31 ILE HG2% A 35 LEU HBy 1.0 . 3.45 161 142 A 31 ILE HG2% A 35 LEU HD21 1.0 . 3.56 162 143 A 31 ILE HB A 32 LYS HBx 1.0 . 5.22 163 144 A 31 ILE HB A 32 LYS HBy 1.0 . 4.72 164 145 A 2 THR HG2% A 5 GLU HA 1.0 . 4.56 165 146 A 32 LYS HA A 35 LEU HBy 1.0 . 4.93 166 147 A 32 LYS H A 32 LYS HDx 1.0 . 4.82 167 147 A 32 LYS H A 32 LYS HDy 1.0 . 4.82 168 148 A 32 LYS HA A 32 LYS HDx 1.0 . 4.50 169 148 A 32 LYS HA A 32 LYS HDy 1.0 . 4.50 170 149 A 32 LYS HBx A 32 LYS HDx 1.0 . 3.85 171 149 A 32 LYS HBx A 32 LYS HDy 1.0 . 3.85 172 150 A 32 LYS HBy A 32 LYS HDx 1.0 . 4.18 173 150 A 32 LYS HBy A 32 LYS HDy 1.0 . 4.18 174 151 A 53 PHE HD% A 52 GLU HBx 1.0 . 6.00 175 152 A 33 ASP HA A 34 ASP HA 1.0 . 5.10 176 153 A 34 ASP H A 33 ASP HBx 1.0 . 4.39 177 154 A 30 ASN H A 34 ASP HBy 1.0 . 5.41 178 155 A 30 ASN H A 34 ASP HBx 1.0 . 5.41 179 156 A 34 ASP HA A 35 LEU HA 1.0 . 5.69 180 157 A 31 ILE HA A 35 LEU HBx 1.0 . 5.15 181 158 A 31 ILE HA A 35 LEU HBy 1.0 . 5.16 182 159 A 18 PHE HD% A 35 LEU HD21 1.0 . 5.45 183 160 A 35 LEU HD21 A 35 LEU H 1.0 . 5.07 184 161 A 35 LEU HD21 A 18 PHE HA 1.0 . 5.77 185 162 A 35 LEU HD21 A 35 LEU HA 1.0 . 3.41 186 163 A 35 LEU HD21 A 35 LEU HBy 1.0 . 3.35 187 164 A 20 ILE HG1x A 35 LEU HD21 1.0 . 4.24 188 165 A 35 LEU HG A 18 PHE HZ 1.0 . 5.65 189 166 A 35 LEU HG A 31 ILE HA 1.0 . 4.49 190 167 A 35 LEU HG A 20 ILE HG1x 1.0 . 5.84 191 168 A 35 LEU HG A 31 ILE HG1y 1.0 . 4.39 192 169 A 36 ASN HA A 36 ASN HD2y 1.0 . 4.99 193 169 A 36 ASN HA A 36 ASN HD2x 1.0 . 4.99 194 170 A 32 LYS HA A 36 ASN HA 1.0 . 5.71 195 171 A 36 ASN HBx A 37 ALA HA 1.0 . 4.79 196 172 A 37 ALA HB% A 38 ASP H 1.0 . 4.07 197 173 A 37 ALA HB% A 37 ALA H 1.0 . 3.57 198 174 A 32 LYS HA A 37 ALA HB% 1.0 . 3.93 199 175 A 37 ALA HB% A 32 LYS HGx 1.0 . 3.66 200 175 A 37 ALA HB% A 32 LYS HGy 1.0 . 3.66 201 176 A 31 ILE HG2% A 37 ALA HB% 1.0 . 3.71 202 177 A 40 ILE HD1% A 41 SER H 1.0 . 5.10 203 178 A 40 ILE HD1% A 40 ILE HA 1.0 . 4.02 204 179 A 40 ILE HD1% A 43 MET HGx 1.0 . 5.59 205 179 A 43 MET HGy A 40 ILE HD1% 1.0 . 5.59 206 180 A 40 ILE HD1% A 40 ILE HB 1.0 . 3.97 207 181 A 13 ILE H A 13 ILE HG1x 1.0 . 4.25 208 182 A 40 ILE HG2% A 41 SER HA 1.0 . 5.01 209 183 A 40 ILE HA A 40 ILE HG2% 1.0 . 3.70 210 184 A 40 ILE HG2% A 44 GLU HGx 1.0 . 4.28 211 184 A 40 ILE HG2% A 44 GLU HGy 1.0 . 4.28 212 185 A 41 SER HA A 44 GLU HGx 1.0 . 4.97 213 185 A 41 SER HA A 44 GLU HGy 1.0 . 4.97 214 186 A 41 SER HA A 44 GLU HBx 1.0 . 4.78 215 186 A 41 SER HA A 44 GLU HBy 1.0 . 4.78 216 187 A 37 ALA HB% A 41 SER HA 1.0 . 6.00 217 188 A 74 TYR H A 72 VAL HG11 1.0 . 5.10 218 189 A 75 ILE H A 76 VAL HGy% 1.0 . 5.33 219 190 A 43 MET HA A 46 VAL H 1.0 . 4.69 220 191 A 10 VAL HB A 10 VAL H 1.0 . 3.99 221 192 A 43 MET H A 43 MET HGx 1.0 . 5.18 222 192 A 43 MET HGy A 43 MET H 1.0 . 5.18 223 193 A 40 ILE HG2% A 43 MET HGx 1.0 . 5.01 224 193 A 43 MET HGy A 40 ILE HG2% 1.0 . 5.01 225 194 A 46 VAL H A 45 PHE HBy 1.0 . 4.90 226 195 A 45 PHE HBy A 45 PHE HEx 1.0 . 4.63 227 196 A 45 PHE HEx A 45 PHE HBx 1.0 . 5.24 228 197 A 45 PHE HBx A 46 VAL HGx% 1.0 . 6.00 229 198 A 49 LEU HBx A 46 VAL HA 1.0 . 4.76 230 199 A 46 VAL HA A 49 LEU HG 1.0 . 4.06 231 200 A 43 MET HA A 46 VAL HGx% 1.0 . 4.08 232 201 A 46 VAL HGx% A 47 LEU HBy 1.0 . 3.68 233 202 A 46 VAL HGy% A 57 ILE H 1.0 . 5.34 234 203 A 46 VAL HGy% A 47 LEU H 1.0 . 4.73 235 204 A 46 VAL HGy% A 49 LEU H 1.0 . 5.38 236 205 A 46 VAL HGy% A 47 LEU HA 1.0 . 4.44 237 206 A 46 VAL HA A 46 VAL HGy% 1.0 . 3.89 238 207 A 46 VAL HGy% A 57 ILE HG2% 1.0 . 3.21 239 208 A 47 LEU HBy A 46 VAL HGy% 1.0 . 5.41 240 209 A 44 GLU HA A 47 LEU HBy 1.0 . 4.56 241 210 A 48 GLU HA A 52 GLU H 1.0 . 5.66 242 211 A 48 GLU HA A 51 ASP H 1.0 . 4.65 243 212 A 13 ILE HG2% A 48 GLU HBx 1.0 . 4.66 244 213 A 49 LEU HA A 48 GLU HGx 1.0 . 4.00 245 214 A 47 LEU HBx A 48 GLU HGx 1.0 . 5.40 246 215 A 48 GLU HGx A 49 LEU HBy 1.0 . 4.60 247 216 A 49 LEU HD21 A 48 GLU HGx 1.0 . 4.08 248 217 A 46 VAL HGy% A 49 LEU HBy 1.0 . 5.72 249 218 A 53 PHE HD% A 49 LEU HD21 1.0 . 3.80 250 219 A 49 LEU HD21 A 49 LEU HA 1.0 . 3.64 251 220 A 10 VAL HB A 49 LEU HD21 1.0 . 4.32 252 221 A 49 LEU HD21 A 48 GLU HBy 1.0 . 4.60 253 222 A 49 LEU HD21 A 49 LEU HBy 1.0 . 3.79 254 223 A 10 VAL HGy% A 49 LEU HG 1.0 . 4.49 255 224 A 4 GLU HA A 8 GLN H 1.0 . 5.08 256 225 A 50 GLU HA A 50 GLU HGx 1.0 . 3.51 257 225 A 50 GLU HA A 50 GLU HGy 1.0 . 3.51 258 226 A 47 LEU HA A 51 ASP HBx 1.0 . 5.71 259 227 A 47 LEU HA A 51 ASP HBy 1.0 . 5.71 260 228 A 45 PHE HEy A 44 GLU HBx 1.0 . 6.00 261 228 A 45 PHE HEy A 44 GLU HBy 1.0 . 6.00 262 229 A 53 PHE HD% A 52 GLU HBy 1.0 . 6.00 263 230 A 53 PHE HA A 53 PHE HE% 1.0 . 5.00 264 231 A 53 PHE HBy A 75 ILE HD1% 1.0 . 5.27 265 232 A 53 PHE HBy A 75 ILE HG2% 1.0 . 5.07 266 233 A 53 PHE HBx A 55 THR HG2% 1.0 . 5.20 267 234 A 53 PHE HBy A 55 THR HB 1.0 . 5.66 268 235 A 55 THR HG2% A 55 THR H 1.0 . 4.16 269 236 A 55 THR HG2% A 74 TYR HEx 1.0 . 4.96 270 237 A 55 THR HG2% A 56 GLU HA 1.0 . 5.18 271 238 A 53 PHE HBy A 55 THR HG2% 1.0 . 4.72 272 239 A 55 THR HG2% A 57 ILE HB 1.0 . 5.00 273 240 A 55 THR HG2% A 57 ILE HG1x 1.0 . 3.37 274 240 A 55 THR HG2% A 57 ILE HG1y 1.0 . 3.37 275 241 A 56 GLU HA A 56 GLU HGx 1.0 . 3.54 276 241 A 56 GLU HA A 56 GLU HGy 1.0 . 3.54 277 242 A 57 ILE H A 56 GLU HBx 1.0 . 4.99 278 242 A 57 ILE H A 56 GLU HBy 1.0 . 4.99 279 243 A 57 ILE H A 56 GLU HGx 1.0 . 5.27 280 243 A 57 ILE H A 56 GLU HGy 1.0 . 5.27 281 244 A 74 TYR HEx A 57 ILE HA 1.0 . 5.32 282 245 A 57 ILE HA A 57 ILE HG1x 1.0 . 4.07 283 245 A 57 ILE HG1y A 57 ILE HA 1.0 . 4.07 284 246 A 57 ILE HG2% A 57 ILE HA 1.0 . 3.75 285 247 A 46 VAL HGy% A 57 ILE HB 1.0 . 4.63 286 248 A 57 ILE H A 57 ILE HD1% 1.0 . 5.34 287 249 A 53 PHE HD% A 57 ILE HD1% 1.0 . 5.73 288 250 A 47 LEU HA A 57 ILE HD1% 1.0 . 5.45 289 251 A 57 ILE HA A 57 ILE HD1% 1.0 . 5.70 290 252 A 50 GLU HA A 57 ILE HD1% 1.0 . 5.41 291 253 A 49 LEU HBx A 57 ILE HD1% 1.0 . 4.27 292 254 A 57 ILE HB A 57 ILE HD1% 1.0 . 3.31 293 255 A 55 THR HG2% A 57 ILE HD1% 1.0 . 4.20 294 256 A 46 VAL HGy% A 57 ILE HD1% 1.0 . 3.35 295 257 A 49 LEU HBy A 57 ILE HB 1.0 . 6.00 296 258 A 62 ALA HA A 65 ILE HG1x 1.0 . 3.18 297 259 A 57 ILE HG2% A 57 ILE HG1x 1.0 . 3.48 298 259 A 57 ILE HG2% A 57 ILE HG1y 1.0 . 3.48 299 260 A 57 ILE H A 57 ILE HG2% 1.0 . 5.17 300 261 A 57 ILE HG2% A 58 SER HA 1.0 . 4.86 301 262 A 57 ILE HG2% A 62 ALA HA 1.0 . 4.16 302 263 A 57 ILE HG2% A 61 ASP HBy 1.0 . 4.20 303 264 A 57 ILE HG2% A 61 ASP HBx 1.0 . 4.20 304 265 A 57 ILE HG2% A 65 ILE HB 1.0 . 5.34 305 266 A 59 ASP HA A 62 ALA H 1.0 . 4.55 306 267 A 59 ASP HA A 62 ALA HB% 1.0 . 3.83 307 268 A 60 GLU HA A 60 GLU HGx 1.0 . 3.90 308 268 A 60 GLU HA A 60 GLU HGy 1.0 . 3.90 309 269 A 52 GLU H A 52 GLU HBy 1.0 . 4.17 310 270 A 61 ASP HA A 64 LYS H 1.0 . 5.38 311 271 A 21 GLU HA A 23 ASP H 1.0 . 5.39 312 272 A 62 ALA HA A 65 ILE H 1.0 . 4.95 313 273 A 62 ALA HA A 61 ASP HBy 1.0 . 6.00 314 274 A 62 ALA HA A 65 ILE HB 1.0 . 4.97 315 275 A 62 ALA HA A 65 ILE HG1y 1.0 . 4.48 316 276 A 62 ALA H A 62 ALA HB% 1.0 . 3.54 317 277 A 62 ALA HB% A 63 GLU HA 1.0 . 4.88 318 278 A 46 VAL HA A 62 ALA HB% 1.0 . 5.71 319 279 A 62 ALA HB% A 63 GLU HBx 1.0 . 4.31 320 279 A 62 ALA HB% A 63 GLU HBy 1.0 . 4.31 321 280 A 62 ALA HB% A 65 ILE HG1y 1.0 . 4.08 322 281 A 57 ILE HG2% A 62 ALA HB% 1.0 . 3.53 323 282 A 63 GLU HA A 63 GLU HGx 1.0 . 3.78 324 282 A 63 GLU HA A 63 GLU HGy 1.0 . 3.78 325 283 A 63 GLU H A 63 GLU HGx 1.0 . 5.04 326 283 A 63 GLU HGy A 63 GLU H 1.0 . 5.04 327 284 A 64 LYS HA A 64 LYS HGy 1.0 . 4.13 328 285 A 64 LYS HA A 64 LYS HGx 1.0 . 4.13 329 286 A 65 ILE HB A 71 ALA HA 1.0 . 5.13 330 287 A 62 ALA H A 65 ILE HD1% 1.0 . 5.62 331 288 A 65 ILE HD1% A 66 GLU H 1.0 . 5.11 332 289 A 64 LYS H A 65 ILE HD1% 1.0 . 5.32 333 290 A 65 ILE HD1% A 74 TYR HDx 1.0 . 3.12 334 291 A 62 ALA HA A 65 ILE HD1% 1.0 . 3.93 335 292 A 65 ILE HA A 65 ILE HD1% 1.0 . 4.04 336 293 A 65 ILE HD1% A 66 GLU HGx 1.0 . 5.46 337 293 A 65 ILE HD1% A 66 GLU HGy 1.0 . 5.46 338 294 A 62 ALA HB% A 65 ILE HD1% 1.0 . 4.48 339 295 A 65 ILE H A 65 ILE HG1y 1.0 . 4.44 340 296 A 65 ILE HG1y A 64 LYS HA 1.0 . 6.00 341 297 A 64 LYS H A 65 ILE HG2% 1.0 . 4.25 342 298 A 74 TYR HDx A 65 ILE HG2% 1.0 . 3.69 343 299 A 65 ILE HG2% A 66 GLU HA 1.0 . 5.84 344 300 A 65 ILE HA A 65 ILE HG2% 1.0 . 3.55 345 301 A 62 ALA HA A 65 ILE HG2% 1.0 . 5.96 346 302 A 65 ILE HG1y A 65 ILE HG2% 1.0 . 3.32 347 303 A 65 ILE HD1% A 65 ILE HG2% 1.0 . 3.83 348 304 A 66 GLU HA A 66 GLU HGx 1.0 . 3.73 349 304 A 66 GLU HGy A 66 GLU HA 1.0 . 3.73 350 305 A 67 THR HG2% A 66 GLU HBx 1.0 . 5.16 351 306 A 65 ILE HA A 66 GLU HGx 1.0 . 4.60 352 306 A 65 ILE HA A 66 GLU HGy 1.0 . 4.60 353 307 A 68 VAL HGy% A 67 THR HA 1.0 . 4.71 354 308 A 68 VAL HGx% A 67 THR HB 1.0 . 5.77 355 309 A 70 ALA HB% A 67 THR HB 1.0 . 5.22 356 310 A 68 VAL HB A 67 THR HB 1.0 . 5.96 357 311 A 30 ASN HA A 67 THR HB 1.0 . 5.12 358 312 A 67 THR HB A 70 ALA H 1.0 . 5.83 359 313 A 67 THR HG2% A 67 THR H 1.0 . 3.99 360 314 A 67 THR HG2% A 33 ASP H 1.0 . 5.07 361 315 A 67 THR HG2% A 30 ASN HA 1.0 . 3.66 362 316 A 37 ALA HB% A 41 SER HBx 1.0 . 4.85 363 316 A 37 ALA HB% A 41 SER HBy 1.0 . 4.85 364 317 A 32 LYS HBy A 37 ALA HB% 1.0 . 4.29 365 318 A 70 ALA HB% A 67 THR HG2% 1.0 . 3.65 366 319 A 14 ILE HD1% A 68 VAL HA 1.0 . 4.59 367 320 A 68 VAL HGy% A 68 VAL H 1.0 . 3.89 368 321 A 68 VAL HGy% A 67 THR HB 1.0 . 5.01 369 322 A 68 VAL HGy% A 68 VAL HA 1.0 . 3.75 370 323 A 31 ILE HG1x A 68 VAL HGy% 1.0 . 3.79 371 324 A 14 ILE HD1% A 68 VAL HGy% 1.0 . 3.68 372 325 A 68 VAL HGx% A 69 GLY H 1.0 . 4.84 373 326 A 68 VAL HGx% A 68 VAL H 1.0 . 4.81 374 327 A 72 VAL H A 68 VAL HGx% 1.0 . 5.49 375 328 A 68 VAL HGx% A 29 LEU H 1.0 . 5.65 376 329 A 68 VAL HA A 68 VAL HGx% 1.0 . 3.84 377 330 A 14 ILE HD1% A 68 VAL HGx% 1.0 . 4.57 378 331 A 26 THR HG2% A 68 VAL HGx% 1.0 . 4.84 379 332 A 68 VAL H A 69 GLY HAy 1.0 . 6.00 380 333 A 69 GLY HAy A 27 ASP HBx 1.0 . 4.64 381 333 A 27 ASP HBy A 69 GLY HAy 1.0 . 4.64 382 334 A 27 ASP HBx A 69 GLY HAx 1.0 . 4.64 383 334 A 27 ASP HBy A 69 GLY HAx 1.0 . 4.64 384 335 A 70 ALA HB% A 69 GLY HAx 1.0 . 5.56 385 336 A 70 ALA HB% A 69 GLY HAy 1.0 . 5.56 386 337 A 67 THR H A 70 ALA HA 1.0 . 5.09 387 338 A 71 ALA HA A 65 ILE HG2% 1.0 . 3.70 388 339 A 68 VAL HA A 71 ALA HB% 1.0 . 4.99 389 340 A 10 VAL HGy% A 71 ALA HB% 1.0 . 4.51 390 341 A 65 ILE HD1% A 71 ALA HB% 1.0 . 4.83 391 342 A 49 LEU HD21 A 71 ALA HB% 1.0 . 4.24 392 343 A 72 VAL HA A 76 VAL H 1.0 . 6.00 393 344 A 74 TYR H A 72 VAL HA 1.0 . 6.00 394 345 A 75 ILE H A 72 VAL HA 1.0 . 6.00 395 346 A 72 VAL HA A 75 ILE HB 1.0 . 4.51 396 347 A 72 VAL HB A 73 ASP H 1.0 . 4.58 397 348 A 72 VAL HA A 72 VAL HG11 1.0 . 3.50 398 349 A 72 VAL H A 72 VAL HG11 1.0 . 3.27 399 350 A 73 ASP HA A 77 SER H 1.0 . 5.15 400 351 A 73 ASP HA A 76 VAL HA 1.0 . 6.00 401 352 A 73 ASP HA A 76 VAL HB 1.0 . 3.97 402 353 A 73 ASP H A 74 TYR HA 1.0 . 6.00 403 354 A 74 TYR HDx A 74 TYR HA 1.0 . 4.61 404 355 A 74 TYR HA A 75 ILE HA 1.0 . 5.95 405 356 A 65 ILE HG2% A 74 TYR HBy 1.0 . 2.85 406 357 A 65 ILE HG2% A 74 TYR HBx 1.0 . 2.85 407 358 A 75 ILE HA A 79 SER H 1.0 . 4.94 408 359 A 76 VAL HB A 75 ILE HA 1.0 . 5.98 409 360 A 75 ILE HD1% A 75 ILE HA 1.0 . 4.65 410 361 A 75 ILE HG2% A 75 ILE HA 1.0 . 3.83 411 362 A 75 ILE HD1% A 76 VAL H 1.0 . 5.29 412 363 A 72 VAL H A 75 ILE HD1% 1.0 . 5.97 413 364 A 75 ILE H A 75 ILE HD1% 1.0 . 4.40 414 365 A 53 PHE HE% A 75 ILE HD1% 1.0 . 4.24 415 366 A 53 PHE HD% A 75 ILE HD1% 1.0 . 4.64 416 367 A 75 ILE HD1% A 74 TYR HEx 1.0 . 4.85 417 368 A 75 ILE HD1% A 74 TYR HA 1.0 . 5.53 418 369 A 75 ILE HD1% A 53 PHE HBx 1.0 . 5.02 419 370 A 75 ILE HD1% A 75 ILE HB 1.0 . 4.11 420 371 A 53 PHE HD% A 75 ILE HG2% 1.0 . 4.86 421 372 A 75 ILE HG2% A 53 PHE HBx 1.0 . 5.49 422 373 A 49 LEU HBy A 75 ILE HG2% 1.0 . 5.33 423 374 A 75 ILE HG2% A 6 VAL HGy% 1.0 . 3.90 424 375 A 75 ILE HG2% A 55 THR HG2% 1.0 . 4.27 425 376 A 75 ILE HG2% A 6 VAL HGx% 1.0 . 3.90 426 377 A 75 ILE HD1% A 75 ILE HG2% 1.0 . 5.18 427 378 A 76 VAL HGy% A 73 ASP HA 1.0 . 4.17 428 379 A 3 ARG HA A 76 VAL HGy% 1.0 . 3.32 429 380 A 76 VAL HGy% A 76 VAL HA 1.0 . 3.79 430 381 A 76 VAL HGy% A 75 ILE HG2% 1.0 . 4.65 431 382 A 76 VAL HGx% A 77 SER HA 1.0 . 4.53 432 383 A 76 VAL HGx% A 75 ILE HG2% 1.0 . 5.17 433 384 A 76 VAL H A 77 SER HA 1.0 . 5.85 434 385 A 79 SER H A 77 SER HA 1.0 . 4.59 435 386 A 79 SER H A 77 SER HBx 1.0 . 4.89 436 386 A 79 SER H A 77 SER HBy 1.0 . 4.89 437 387 A 76 VAL HB A 77 SER HBx 1.0 . 5.60 438 387 A 76 VAL HB A 77 SER HBy 1.0 . 5.60 439 388 A 76 VAL HGy% A 77 SER HBx 1.0 . 6.00 440 388 A 76 VAL HGy% A 77 SER HBy 1.0 . 6.00 441 389 A 76 VAL HGx% A 77 SER HBx 1.0 . 6.00 442 389 A 76 VAL HGx% A 77 SER HBy 1.0 . 6.00 443 390 A 3 ARG HA A 3 ARG HDx 1.0 . 5.35 444 391 A 8 GLN HA A 7 LEU H 1.0 . 6.00 445 392 A 11 ALA H A 7 LEU HBy 1.0 . 6.00 446 393 A 11 ALA H A 7 LEU HBx 1.0 . 6.00 447 394 A 11 ALA H A 8 GLN HGx 1.0 . 6.00 448 394 A 8 GLN HGy A 11 ALA H 1.0 . 6.00 449 395 A 12 LYS H A 8 GLN HGx 1.0 . 6.00 450 395 A 8 GLN HGy A 12 LYS H 1.0 . 6.00 451 396 A 9 LYS HA A 9 LYS HEx 1.0 . 5.08 452 396 A 9 LYS HEy A 9 LYS HA 1.0 . 5.08 453 397 A 9 LYS HA A 9 LYS HDx 1.0 . 4.08 454 397 A 9 LYS HDy A 9 LYS HA 1.0 . 4.08 455 398 A 9 LYS HA A 9 LYS HGx 1.0 . 3.91 456 398 A 9 LYS HA A 9 LYS HGy 1.0 . 3.91 457 399 A 9 LYS HBy A 53 PHE HZ 1.0 . 4.40 458 400 A 9 LYS HBx A 53 PHE HZ 1.0 . 4.45 459 401 A 9 LYS HBy A 10 VAL HGy% 1.0 . 4.69 460 402 A 9 LYS HBy A 13 ILE HD1% 1.0 . 5.93 461 403 A 14 ILE HG2% A 12 LYS HA 1.0 . 6.00 462 404 A 11 ALA H A 12 LYS HBx 1.0 . 6.00 463 405 A 12 LYS HBx A 13 ILE HG2% 1.0 . 5.44 464 406 A 13 ILE HA A 16 ASN H 1.0 . 4.73 465 407 A 13 ILE HG2% A 45 PHE HEy 1.0 . 4.30 466 408 A 13 ILE HG2% A 18 PHE HE% 1.0 . 5.23 467 409 A 13 ILE HG2% A 17 HIS HA 1.0 . 5.37 468 410 A 13 ILE HD1% A 53 PHE HE% 1.0 . 5.03 469 411 A 14 ILE HD1% A 18 PHE HE% 1.0 . 4.04 470 412 A 14 ILE HG2% A 18 PHE HBy 1.0 . 5.67 471 413 A 22 ALA HB% A 15 SER HBy 1.0 . 4.82 472 414 A 20 ILE HG2% A 15 SER HBy 1.0 . 5.74 473 415 A 18 PHE HA A 17 HIS HBx 1.0 . 6.00 474 415 A 17 HIS HBy A 18 PHE HA 1.0 . 6.00 475 416 A 20 ILE HD1% A 31 ILE HA 1.0 . 6.00 476 417 A 20 ILE HD1% A 25 VAL H 1.0 . 5.32 477 418 A 15 SER HA A 20 ILE HG1y 1.0 . 6.00 478 419 A 15 SER HA A 20 ILE HG1x 1.0 . 6.00 479 420 A 20 ILE HG2% A 18 PHE HE% 1.0 . 6.00 480 421 A 20 ILE HG2% A 18 PHE HBy 1.0 . 5.06 481 422 A 22 ALA HB% A 23 ASP HA 1.0 . 4.44 482 423 A 25 VAL HA A 24 GLN H 1.0 . 6.00 483 424 A 20 ILE HB A 25 VAL HA 1.0 . 5.94 484 425 A 24 GLN H A 25 VAL HG11 1.0 . 6.00 485 426 A 25 VAL HA A 25 VAL HG11 1.0 . 3.61 486 427 A 29 LEU HA A 31 ILE HA 1.0 . 6.00 487 428 A 29 LEU HBy A 28 GLN H 1.0 . 6.00 488 429 A 29 LEU HBy A 68 VAL H 1.0 . 6.00 489 430 A 29 LEU HBx A 34 ASP H 1.0 . 6.00 490 431 A 29 LEU HBx A 68 VAL H 1.0 . 6.00 491 432 A 25 VAL HA A 29 LEU HBy 1.0 . 6.00 492 433 A 25 VAL HA A 29 LEU HBx 1.0 . 5.87 493 434 A 30 ASN HA A 31 ILE HG1y 1.0 . 6.00 494 435 A 29 LEU HA A 30 ASN HBx 1.0 . 5.17 495 436 A 30 ASN HBx A 67 THR HA 1.0 . 6.00 496 437 A 30 ASN HBx A 33 ASP H 1.0 . 4.77 497 438 A 30 ASN HBx A 34 ASP H 1.0 . 5.19 498 439 A 30 ASN HBy A 33 ASP H 1.0 . 4.69 499 440 A 31 ILE HA A 30 ASN HA 1.0 . 6.00 500 441 A 31 ILE HB A 67 THR HA 1.0 . 6.00 501 442 A 31 ILE HB A 66 GLU HA 1.0 . 5.86 502 443 A 31 ILE HG2% A 37 ALA HA 1.0 . 5.72 503 444 A 32 LYS HBx A 32 LYS HEx 1.0 . 6.00 504 444 A 32 LYS HBx A 32 LYS HEy 1.0 . 6.00 505 445 A 35 LEU HD21 A 34 ASP HA 1.0 . 5.52 506 446 A 35 LEU HBy A 36 ASN HA 1.0 . 6.00 507 447 A 36 ASN HA A 37 ALA HB% 1.0 . 6.00 508 448 A 35 LEU HBy A 36 ASN HBy 1.0 . 6.00 509 449 A 37 ALA HB% A 36 ASN HBy 1.0 . 6.00 510 450 A 72 VAL HB A 72 VAL HG11 1.0 . 2.94 511 451 A 43 MET HA A 47 LEU H 1.0 . 5.00 512 452 A 43 MET HA A 47 LEU HBy 1.0 . 4.95 513 453 A 43 MET HBx A 44 GLU HGx 1.0 . 3.18 514 453 A 44 GLU HGy A 43 MET HBx 1.0 . 3.18 515 454 A 46 VAL HA A 48 GLU H 1.0 . 6.00 516 455 A 53 PHE HD% A 49 LEU HBy 1.0 . 6.00 517 456 A 53 PHE HD% A 49 LEU HBx 1.0 . 6.00 518 457 A 49 LEU HD21 A 46 VAL HA 1.0 . 5.69 519 458 A 49 LEU HA A 53 PHE HBx 1.0 . 6.00 520 459 A 50 GLU HA A 53 PHE HBy 1.0 . 6.00 521 460 A 55 THR HA A 54 GLY HAx 1.0 . 6.00 522 461 A 55 THR HA A 54 GLY HAy 1.0 . 6.00 523 462 A 55 THR HB A 57 ILE HG1x 1.0 . 6.00 524 462 A 55 THR HB A 57 ILE HG1y 1.0 . 6.00 525 463 A 55 THR HG2% A 53 PHE H 1.0 . 5.54 526 464 A 57 ILE HG2% A 56 GLU HBx 1.0 . 6.00 527 464 A 57 ILE HG2% A 56 GLU HBy 1.0 . 6.00 528 465 A 57 ILE HG2% A 56 GLU HGx 1.0 . 6.00 529 465 A 57 ILE HG2% A 56 GLU HGy 1.0 . 6.00 530 466 A 57 ILE HA A 56 GLU HGx 1.0 . 4.41 531 466 A 56 GLU HGy A 57 ILE HA 1.0 . 4.41 532 467 A 57 ILE HB A 50 GLU HGx 1.0 . 6.00 533 467 A 50 GLU HGy A 57 ILE HB 1.0 . 6.00 534 468 A 58 SER HA A 62 ALA H 1.0 . 5.59 535 469 A 58 SER HA A 60 GLU HGx 1.0 . 5.25 536 469 A 58 SER HA A 60 GLU HGy 1.0 . 5.25 537 470 A 62 ALA HA A 61 ASP H 1.0 . 6.00 538 471 A 62 ALA HA A 66 GLU H 1.0 . 6.00 539 472 A 62 ALA HA A 61 ASP HBx 1.0 . 6.00 540 473 A 62 ALA HA A 66 GLU HGx 1.0 . 6.00 541 473 A 62 ALA HA A 66 GLU HGy 1.0 . 6.00 542 474 A 62 ALA HB% A 63 GLU H 1.0 . 4.23 543 475 A 62 ALA HB% A 64 LYS H 1.0 . 5.59 544 476 A 67 THR HA A 70 ALA H 1.0 . 5.65 545 477 A 30 ASN HBx A 67 THR HG2% 1.0 . 4.54 546 478 A 68 VAL HA A 67 THR HB 1.0 . 6.00 547 479 A 70 ALA HB% A 72 VAL H 1.0 . 5.54 548 480 A 70 ALA HB% A 66 GLU HBy 1.0 . 4.90 549 481 A 70 ALA HB% A 65 ILE HG2% 1.0 . 3.77 550 482 A 70 ALA HB% A 65 ILE HD1% 1.0 . 4.95 551 483 A 76 VAL HA A 79 SER H 1.0 . 4.60 552 484 A 78 ASN HA A 77 SER HBx 1.0 . 5.73 553 484 A 77 SER HBy A 78 ASN HA 1.0 . 5.73 554 485 A 73 ASP HBy A 77 SER HBx 1.0 . 6.00 555 485 A 77 SER HBy A 73 ASP HBy 1.0 . 6.00 556 486 A 76 VAL HB A 3 ARG H 1.0 . 6.00 557 487 A 2 THR HG2% A 3 ARG H 1.0 . 4.39 558 488 A 76 VAL HGy% A 3 ARG H 1.0 . 4.99 559 489 A 76 VAL HGx% A 3 ARG H 1.0 . 5.55 560 490 A 2 THR H A 4 GLU H 1.0 . 5.15 561 491 A 5 GLU H A 5 GLU HBy 1.0 . 3.61 562 492 A 5 GLU H A 4 GLU HGx 1.0 . 5.36 563 492 A 5 GLU H A 4 GLU HGy 1.0 . 5.36 564 493 A 4 GLU H A 4 GLU HGx 1.0 . 3.84 565 493 A 4 GLU H A 4 GLU HGy 1.0 . 3.84 566 494 A 5 GLU H A 5 GLU HBx 1.0 . 3.61 567 495 A 5 GLU H A 5 GLU HGx 1.0 . 4.43 568 495 A 5 GLU H A 5 GLU HGy 1.0 . 4.43 569 496 A 4 GLU HA A 6 VAL H 1.0 . 4.68 570 497 A 6 VAL H A 5 GLU HGx 1.0 . 5.26 571 497 A 5 GLU HGy A 6 VAL H 1.0 . 5.26 572 498 A 6 VAL H A 5 GLU HBy 1.0 . 4.17 573 499 A 7 LEU H A 8 GLN HGx 1.0 . 5.74 574 499 A 8 GLN HGy A 7 LEU H 1.0 . 5.74 575 500 A 7 LEU H A 6 VAL HGx% 1.0 . 4.69 576 501 A 5 GLU H A 8 GLN H 1.0 . 4.97 577 502 A 8 GLN H A 7 LEU HBy 1.0 . 4.22 578 503 A 10 VAL HGy% A 9 LYS H 1.0 . 4.85 579 504 A 13 ILE HD1% A 9 LYS H 1.0 . 5.95 580 505 A 10 VAL H A 9 LYS H 1.0 . 4.01 581 506 A 10 VAL H A 53 PHE HZ 1.0 . 4.96 582 507 A 7 LEU HA A 10 VAL H 1.0 . 4.47 583 508 A 10 VAL HGx% A 10 VAL H 1.0 . 6.00 584 509 A 10 VAL H A 13 ILE HD1% 1.0 . 6.00 585 510 A 9 LYS HBy A 10 VAL H 1.0 . 3.82 586 511 A 10 VAL H A 11 ALA HB% 1.0 . 4.70 587 512 A 10 VAL HB A 11 ALA H 1.0 . 3.88 588 513 A 10 VAL HGx% A 11 ALA H 1.0 . 5.53 589 514 A 11 ALA H A 12 LYS H 1.0 . 4.08 590 515 A 10 VAL HGx% A 12 LYS H 1.0 . 5.98 591 516 A 13 ILE HD1% A 12 LYS H 1.0 . 6.00 592 517 A 12 LYS HBy A 12 LYS H 1.0 . 3.72 593 518 A 11 ALA HB% A 12 LYS H 1.0 . 3.65 594 519 A 13 ILE H A 9 LYS HEx 1.0 . 4.74 595 519 A 9 LYS HEy A 13 ILE H 1.0 . 4.74 596 520 A 13 ILE H A 12 LYS HEx 1.0 . 5.78 597 520 A 13 ILE H A 12 LYS HEy 1.0 . 5.78 598 521 A 13 ILE H A 9 LYS HGx 1.0 . 5.34 599 521 A 13 ILE H A 9 LYS HGy 1.0 . 5.34 600 522 A 14 ILE H A 14 ILE HG1y 1.0 . 4.14 601 523 A 15 SER H A 25 VAL HG11 1.0 . 5.59 602 524 A 17 HIS H A 17 HIS HD2 1.0 . 5.25 603 525 A 14 ILE HA A 17 HIS H 1.0 . 4.92 604 526 A 18 PHE H A 17 HIS HBx 1.0 . 3.98 605 526 A 17 HIS HBy A 18 PHE H 1.0 . 3.98 606 527 A 35 LEU HBy A 19 ASP H 1.0 . 6.00 607 528 A 35 LEU HD21 A 19 ASP H 1.0 . 5.30 608 529 A 21 GLU H A 20 ILE H 1.0 . 4.71 609 530 A 20 ILE H A 19 ASP HA 1.0 . 3.46 610 531 A 20 ILE H A 19 ASP HBy 1.0 . 5.05 611 532 A 20 ILE H A 19 ASP HBx 1.0 . 5.05 612 533 A 20 ILE HG2% A 20 ILE H 1.0 . 3.77 613 534 A 20 ILE HG1x A 20 ILE H 1.0 . 5.14 614 535 A 21 GLU H A 23 ASP H 1.0 . 5.21 615 536 A 21 GLU H A 20 ILE HG1y 1.0 . 4.26 616 537 A 21 GLU H A 21 GLU HBx 1.0 . 4.09 617 537 A 21 GLU H A 21 GLU HBy 1.0 . 4.09 618 538 A 22 ALA H A 21 GLU HBx 1.0 . 4.67 619 538 A 21 GLU HBy A 22 ALA H 1.0 . 4.67 620 539 A 22 ALA H A 25 VAL HG11 1.0 . 5.42 621 540 A 22 ALA H A 21 GLU HGx 1.0 . 4.40 622 540 A 21 GLU HGy A 22 ALA H 1.0 . 4.40 623 541 A 23 ASP H A 21 GLU HBx 1.0 . 4.63 624 541 A 23 ASP H A 21 GLU HBy 1.0 . 4.63 625 542 A 23 ASP H A 25 VAL HG11 1.0 . 5.56 626 543 A 21 GLU H A 24 GLN H 1.0 . 5.10 627 544 A 22 ALA HA A 24 GLN H 1.0 . 5.18 628 545 A 24 GLN H A 21 GLU HBx 1.0 . 5.05 629 545 A 24 GLN H A 21 GLU HBy 1.0 . 5.05 630 546 A 22 ALA HB% A 24 GLN H 1.0 . 5.04 631 547 A 20 ILE HD1% A 24 GLN H 1.0 . 5.51 632 548 A 23 ASP H A 25 VAL H 1.0 . 5.40 633 549 A 11 ALA HB% A 25 VAL H 1.0 . 5.70 634 550 A 25 VAL H A 25 VAL HG11 1.0 . 3.61 635 551 A 25 VAL H A 25 VAL HG11 1.0 . 4.28 636 552 A 25 VAL HA A 26 THR H 1.0 . 3.42 637 553 A 25 VAL HB A 26 THR H 1.0 . 5.12 638 554 A 26 THR H A 29 LEU HBx 1.0 . 4.48 639 555 A 68 VAL HGy% A 26 THR H 1.0 . 3.68 640 556 A 25 VAL HB A 25 VAL H 1.0 . 3.92 641 557 A 26 THR H A 28 GLN H 1.0 . 5.48 642 558 A 26 THR HA A 28 GLN H 1.0 . 4.24 643 559 A 26 THR HB A 28 GLN H 1.0 . 4.20 644 560 A 28 GLN H A 27 ASP HBx 1.0 . 4.02 645 560 A 27 ASP HBy A 28 GLN H 1.0 . 4.02 646 561 A 27 ASP H A 68 VAL HGy% 1.0 . 4.46 647 562 A 28 GLN H A 28 GLN HBx 1.0 . 4.17 648 563 A 28 GLN H A 28 GLN HGx 1.0 . 4.27 649 563 A 28 GLN H A 28 GLN HGy 1.0 . 4.27 650 564 A 30 ASN H A 29 LEU H 1.0 . 5.29 651 565 A 26 THR H A 29 LEU H 1.0 . 4.81 652 566 A 26 THR HA A 29 LEU H 1.0 . 4.97 653 567 A 29 LEU H A 67 THR HB 1.0 . 5.30 654 568 A 27 ASP HA A 29 LEU H 1.0 . 4.44 655 569 A 25 VAL HA A 29 LEU H 1.0 . 5.75 656 570 A 68 VAL HB A 29 LEU H 1.0 . 4.31 657 571 A 26 THR HG2% A 29 LEU H 1.0 . 4.89 658 572 A 68 VAL HGy% A 29 LEU H 1.0 . 4.22 659 573 A 29 LEU H A 28 GLN HBx 1.0 . 5.02 660 574 A 28 GLN HBy A 29 LEU H 1.0 . 4.73 661 575 A 29 LEU HBx A 29 LEU H 1.0 . 3.82 662 576 A 29 LEU HBy A 29 LEU H 1.0 . 3.40 663 577 A 30 ASN H A 67 THR HG2% 1.0 . 5.57 664 578 A 68 VAL HGy% A 30 ASN H 1.0 . 5.31 665 579 A 30 ASN H A 29 LEU HBx 1.0 . 5.24 666 580 A 30 ASN H A 29 LEU HBy 1.0 . 5.25 667 581 A 29 LEU HBx A 31 ILE H 1.0 . 5.70 668 582 A 68 VAL HGy% A 31 ILE H 1.0 . 5.25 669 583 A 31 ILE HG1y A 31 ILE H 1.0 . 4.24 670 584 A 32 LYS H A 66 GLU HBy 1.0 . 5.04 671 585 A 32 LYS HBx A 32 LYS H 1.0 . 3.55 672 586 A 31 ILE HG1y A 32 LYS H 1.0 . 5.88 673 587 A 35 LEU HD21 A 32 LYS H 1.0 . 6.00 674 588 A 31 ILE HG2% A 32 LYS H 1.0 . 4.75 675 589 A 32 LYS HBy A 32 LYS H 1.0 . 3.74 676 590 A 31 ILE HG1x A 32 LYS H 1.0 . 5.23 677 591 A 67 THR HG2% A 32 LYS H 1.0 . 5.43 678 592 A 33 ASP H A 33 ASP HBx 1.0 . 3.79 679 593 A 31 ILE HB A 32 LYS H 1.0 . 3.84 680 594 A 31 ILE HB A 33 ASP H 1.0 . 5.39 681 595 A 34 ASP H A 36 ASN H 1.0 . 5.63 682 596 A 35 LEU HBy A 34 ASP H 1.0 . 5.22 683 597 A 34 ASP H A 33 ASP HBy 1.0 . 4.39 684 598 A 34 ASP H A 34 ASP HBx 1.0 . 4.00 685 599 A 35 LEU H A 34 ASP HBx 1.0 . 4.95 686 600 A 33 ASP H A 36 ASN H 1.0 . 5.84 687 601 A 34 ASP HA A 36 ASN H 1.0 . 5.29 688 602 A 32 LYS HA A 36 ASN H 1.0 . 5.18 689 603 A 35 LEU HBx A 36 ASN H 1.0 . 4.98 690 604 A 35 LEU HBy A 36 ASN H 1.0 . 4.64 691 605 A 35 LEU HD21 A 36 ASN H 1.0 . 5.68 692 606 A 33 ASP HA A 36 ASN H 1.0 . 4.20 693 607 A 33 ASP HA A 37 ALA H 1.0 . 4.87 694 608 A 35 LEU HBx A 37 ALA H 1.0 . 4.61 695 609 A 31 ILE HB A 37 ALA H 1.0 . 6.00 696 610 A 38 ASP HA A 40 ILE H 1.0 . 5.41 697 611 A 40 ILE H A 38 ASP HBy 1.0 . 5.49 698 612 A 40 ILE H A 38 ASP HBx 1.0 . 5.49 699 613 A 40 ILE HB A 40 ILE H 1.0 . 3.63 700 614 A 40 ILE H A 40 ILE HG1y 1.0 . 4.22 701 615 A 40 ILE H A 40 ILE HG1x 1.0 . 4.22 702 616 A 40 ILE HG2% A 40 ILE H 1.0 . 4.25 703 617 A 40 ILE HD1% A 40 ILE H 1.0 . 4.56 704 618 A 41 SER H A 40 ILE H 1.0 . 3.72 705 619 A 41 SER H A 38 ASP HA 1.0 . 5.09 706 620 A 72 VAL H A 71 ALA HB% 1.0 . 4.23 707 621 A 41 SER H A 40 ILE HG2% 1.0 . 3.76 708 622 A 41 SER H A 40 ILE HB 1.0 . 3.86 709 623 A 38 ASP HA A 42 VAL H 1.0 . 6.00 710 624 A 42 VAL H A 42 VAL HB 1.0 . 3.67 711 625 A 43 MET H A 42 VAL H 1.0 . 4.03 712 626 A 43 MET H A 46 VAL HGx% 1.0 . 5.01 713 627 A 43 MET H A 42 VAL HB 1.0 . 3.90 714 628 A 43 MET H A 43 MET HBx 1.0 . 3.64 715 629 A 41 SER HA A 44 GLU H 1.0 . 4.73 716 630 A 40 ILE HG2% A 44 GLU H 1.0 . 4.49 717 631 A 45 PHE HEy A 45 PHE H 1.0 . 5.34 718 632 A 46 VAL H A 47 LEU H 1.0 . 3.98 719 633 A 46 VAL H A 46 VAL HB 1.0 . 3.56 720 634 A 46 VAL H A 49 LEU HBy 1.0 . 6.00 721 635 A 46 VAL H A 49 LEU HG 1.0 . 5.39 722 636 A 47 LEU H A 48 GLU H 1.0 . 4.12 723 637 A 44 GLU HA A 47 LEU H 1.0 . 4.68 724 638 A 47 LEU H A 45 PHE HA 1.0 . 5.21 725 639 A 48 GLU HGy A 47 LEU H 1.0 . 5.40 726 640 A 47 LEU H A 46 VAL HB 1.0 . 4.17 727 641 A 47 LEU HBy A 47 LEU H 1.0 . 3.38 728 642 A 46 VAL HGx% A 47 LEU H 1.0 . 5.12 729 643 A 48 GLU HBx A 48 GLU H 1.0 . 3.39 730 644 A 48 GLU HGy A 48 GLU H 1.0 . 4.30 731 645 A 48 GLU HGx A 48 GLU H 1.0 . 3.41 732 646 A 47 LEU HBy A 48 GLU H 1.0 . 4.04 733 647 A 48 GLU HBy A 49 LEU H 1.0 . 4.38 734 648 A 48 GLU H A 50 GLU H 1.0 . 5.83 735 649 A 46 VAL HA A 50 GLU H 1.0 . 5.46 736 650 A 50 GLU H A 50 GLU HGx 1.0 . 3.74 737 650 A 50 GLU HGy A 50 GLU H 1.0 . 3.74 738 651 A 57 ILE HB A 50 GLU H 1.0 . 5.60 739 652 A 49 LEU HBy A 50 GLU H 1.0 . 4.40 740 653 A 46 VAL HGx% A 50 GLU H 1.0 . 5.10 741 654 A 50 GLU H A 57 ILE HG1x 1.0 . 6.00 742 654 A 57 ILE HG1y A 50 GLU H 1.0 . 6.00 743 655 A 57 ILE HD1% A 50 GLU H 1.0 . 4.73 744 656 A 49 LEU HBx A 50 GLU H 1.0 . 4.00 745 657 A 47 LEU HA A 51 ASP H 1.0 . 4.31 746 658 A 49 LEU HA A 51 ASP H 1.0 . 5.43 747 659 A 51 ASP H A 50 GLU HGx 1.0 . 3.93 748 659 A 51 ASP H A 50 GLU HGy 1.0 . 3.93 749 660 A 51 ASP H A 57 ILE HD1% 1.0 . 5.69 750 661 A 51 ASP H A 50 GLU H 1.0 . 4.28 751 662 A 51 ASP H A 51 ASP HBx 1.0 . 3.38 752 663 A 51 ASP H A 51 ASP HBy 1.0 . 3.38 753 664 A 52 GLU H A 51 ASP H 1.0 . 4.07 754 665 A 73 ASP H A 69 GLY HAy 1.0 . 4.81 755 666 A 52 GLU H A 52 GLU HBx 1.0 . 4.17 756 667 A 52 GLU H A 52 GLU HGx 1.0 . 4.15 757 667 A 52 GLU HGy A 52 GLU H 1.0 . 4.15 758 668 A 53 PHE HE% A 53 PHE H 1.0 . 4.25 759 669 A 50 GLU HA A 53 PHE H 1.0 . 4.63 760 670 A 53 PHE H A 52 GLU HBy 1.0 . 4.83 761 671 A 52 GLU H A 53 PHE HBy 1.0 . 5.46 762 672 A 52 GLU H A 54 GLY H 1.0 . 5.55 763 673 A 54 GLY H A 50 GLU HBx 1.0 . 5.50 764 673 A 54 GLY H A 50 GLU HBy 1.0 . 5.50 765 674 A 57 ILE H A 50 GLU HGx 1.0 . 5.26 766 674 A 57 ILE H A 50 GLU HGy 1.0 . 5.26 767 675 A 57 ILE H A 58 SER H 1.0 . 5.42 768 676 A 62 ALA HA A 58 SER H 1.0 . 6.00 769 677 A 58 SER H A 61 ASP HBy 1.0 . 5.18 770 678 A 58 SER H A 61 ASP HBx 1.0 . 5.18 771 679 A 57 ILE HB A 58 SER H 1.0 . 5.23 772 680 A 58 SER H A 57 ILE HG1x 1.0 . 5.56 773 680 A 57 ILE HG1y A 58 SER H 1.0 . 5.56 774 681 A 58 SER H A 58 SER HBy 1.0 . 4.14 775 682 A 57 ILE HG2% A 58 SER H 1.0 . 4.34 776 683 A 58 SER H A 59 ASP H 1.0 . 5.40 777 684 A 60 GLU HA A 59 ASP H 1.0 . 5.38 778 685 A 59 ASP H A 59 ASP HBx 1.0 . 4.15 779 686 A 59 ASP H A 60 GLU HBx 1.0 . 5.69 780 686 A 59 ASP H A 60 GLU HBy 1.0 . 5.69 781 687 A 59 ASP H A 60 GLU HGx 1.0 . 5.87 782 687 A 60 GLU HGy A 59 ASP H 1.0 . 5.87 783 688 A 62 ALA HB% A 59 ASP H 1.0 . 5.76 784 689 A 59 ASP H A 58 SER HBy 1.0 . 4.30 785 690 A 58 SER H A 60 GLU H 1.0 . 6.00 786 691 A 60 GLU H A 59 ASP HBx 1.0 . 4.27 787 692 A 61 ASP H A 60 GLU HBx 1.0 . 4.11 788 692 A 61 ASP H A 60 GLU HBy 1.0 . 4.11 789 693 A 57 ILE HG2% A 61 ASP H 1.0 . 5.01 790 694 A 61 ASP H A 60 GLU HGx 1.0 . 4.13 791 694 A 60 GLU HGy A 61 ASP H 1.0 . 4.13 792 695 A 62 ALA H A 59 ASP H 1.0 . 4.95 793 696 A 62 ALA H A 61 ASP H 1.0 . 4.04 794 697 A 62 ALA H A 63 GLU H 1.0 . 4.10 795 698 A 62 ALA H A 64 LYS H 1.0 . 5.59 796 699 A 62 ALA H A 60 GLU HA 1.0 . 5.15 797 700 A 62 ALA H A 61 ASP HBy 1.0 . 4.63 798 701 A 62 ALA H A 61 ASP HBx 1.0 . 4.63 799 702 A 62 ALA H A 60 GLU HBx 1.0 . 5.32 800 702 A 62 ALA H A 60 GLU HBy 1.0 . 5.32 801 703 A 46 VAL HGy% A 62 ALA H 1.0 . 6.00 802 704 A 62 ALA H A 65 ILE HG2% 1.0 . 6.00 803 705 A 65 ILE HG1x A 62 ALA H 1.0 . 6.00 804 706 A 57 ILE HG2% A 62 ALA H 1.0 . 3.93 805 707 A 59 ASP HA A 63 GLU H 1.0 . 5.60 806 708 A 63 GLU H A 63 GLU HBx 1.0 . 3.47 807 708 A 63 GLU HBy A 63 GLU H 1.0 . 3.47 808 709 A 64 LYS H A 63 GLU H 1.0 . 3.85 809 710 A 62 ALA HA A 64 LYS H 1.0 . 5.39 810 711 A 64 LYS H A 64 LYS HGy 1.0 . 4.35 811 712 A 65 ILE HG1x A 64 LYS H 1.0 . 6.00 812 713 A 64 LYS H A 63 GLU HBx 1.0 . 4.05 813 713 A 64 LYS H A 63 GLU HBy 1.0 . 4.05 814 714 A 64 LYS H A 63 GLU HGx 1.0 . 5.52 815 714 A 64 LYS H A 63 GLU HGy 1.0 . 5.52 816 715 A 64 LYS H A 64 LYS HGx 1.0 . 4.35 817 716 A 64 LYS H A 64 LYS HEx 1.0 . 5.98 818 716 A 64 LYS H A 64 LYS HEy 1.0 . 5.98 819 717 A 65 ILE H A 66 GLU HGx 1.0 . 5.75 820 717 A 65 ILE H A 66 GLU HGy 1.0 . 5.75 821 718 A 65 ILE HB A 65 ILE H 1.0 . 4.04 822 719 A 65 ILE H A 65 ILE HD1% 1.0 . 5.79 823 720 A 65 ILE H A 65 ILE HG2% 1.0 . 4.59 824 721 A 65 ILE HG1x A 65 ILE H 1.0 . 4.76 825 722 A 65 ILE HB A 66 GLU H 1.0 . 4.69 826 723 A 66 GLU H A 66 GLU HGx 1.0 . 4.24 827 723 A 66 GLU H A 66 GLU HGy 1.0 . 4.24 828 724 A 66 GLU H A 66 GLU HBx 1.0 . 3.97 829 725 A 67 THR H A 68 VAL H 1.0 . 5.63 830 726 A 65 ILE HA A 67 THR H 1.0 . 4.71 831 727 A 70 ALA HB% A 67 THR H 1.0 . 3.76 832 728 A 31 ILE HB A 67 THR H 1.0 . 6.00 833 729 A 65 ILE HG2% A 67 THR H 1.0 . 5.64 834 730 A 65 ILE HG1x A 67 THR H 1.0 . 6.00 835 731 A 67 THR H A 66 GLU HGx 1.0 . 5.49 836 731 A 66 GLU HGy A 67 THR H 1.0 . 5.49 837 732 A 67 THR H A 66 GLU HBy 1.0 . 4.59 838 733 A 66 GLU HBx A 67 THR H 1.0 . 4.60 839 734 A 26 THR HA A 68 VAL H 1.0 . 6.00 840 735 A 27 ASP HA A 68 VAL H 1.0 . 4.91 841 736 A 68 VAL H A 69 GLY HAx 1.0 . 6.00 842 737 A 70 ALA HB% A 68 VAL H 1.0 . 5.18 843 738 A 68 VAL H A 71 ALA HB% 1.0 . 5.52 844 739 A 14 ILE HD1% A 68 VAL H 1.0 . 5.19 845 740 A 26 THR HA A 69 GLY H 1.0 . 5.86 846 741 A 67 THR HB A 69 GLY H 1.0 . 4.35 847 742 A 68 VAL HB A 69 GLY H 1.0 . 4.12 848 743 A 70 ALA HB% A 69 GLY H 1.0 . 5.47 849 744 A 69 GLY H A 71 ALA HB% 1.0 . 6.00 850 745 A 70 ALA H A 73 ASP H 1.0 . 5.63 851 746 A 70 ALA H A 68 VAL H 1.0 . 5.42 852 747 A 72 VAL H A 70 ALA H 1.0 . 6.00 853 748 A 68 VAL HA A 70 ALA H 1.0 . 5.92 854 749 A 30 ASN HBy A 70 ALA H 1.0 . 6.00 855 750 A 67 THR HG2% A 70 ALA H 1.0 . 5.16 856 751 A 65 ILE HG2% A 70 ALA H 1.0 . 5.80 857 752 A 69 GLY H A 71 ALA H 1.0 . 5.68 858 753 A 73 ASP H A 71 ALA H 1.0 . 5.16 859 754 A 72 VAL H A 71 ALA H 1.0 . 3.86 860 755 A 68 VAL HA A 71 ALA H 1.0 . 4.43 861 756 A 73 ASP HBy A 71 ALA H 1.0 . 5.85 862 757 A 72 VAL HB A 71 ALA H 1.0 . 5.35 863 758 A 71 ALA H A 72 VAL HG11 1.0 . 4.72 864 759 A 65 ILE HG2% A 71 ALA H 1.0 . 5.17 865 760 A 65 ILE HD1% A 71 ALA H 1.0 . 5.72 866 761 A 70 ALA HB% A 71 ALA H 1.0 . 4.33 867 762 A 71 ALA HB% A 71 ALA H 1.0 . 3.85 868 763 A 72 VAL H A 69 GLY H 1.0 . 5.52 869 764 A 72 VAL H A 72 VAL HB 1.0 . 3.61 870 765 A 52 GLU H A 48 GLU H 1.0 . 5.82 871 766 A 73 ASP H A 73 ASP HBy 1.0 . 3.56 872 767 A 74 TYR H A 73 ASP HBx 1.0 . 4.10 873 768 A 70 ALA HB% A 74 TYR H 1.0 . 5.77 874 769 A 74 TYR H A 71 ALA HB% 1.0 . 5.98 875 770 A 74 TYR H A 65 ILE HG2% 1.0 . 4.17 876 771 A 74 TYR H A 74 TYR HBy 1.0 . 3.65 877 772 A 74 TYR H A 74 TYR HBx 1.0 . 3.65 878 773 A 74 TYR H A 74 TYR HDy 1.0 . 5.25 879 774 A 74 TYR H A 74 TYR HDx 1.0 . 4.76 880 775 A 75 ILE H A 73 ASP H 1.0 . 4.55 881 776 A 75 ILE H A 73 ASP HA 1.0 . 5.20 882 777 A 75 ILE H A 73 ASP HBx 1.0 . 5.54 883 778 A 75 ILE H A 75 ILE HB 1.0 . 3.69 884 779 A 75 ILE H A 74 TYR HBy 1.0 . 3.85 885 780 A 75 ILE H A 74 TYR HBx 1.0 . 3.85 886 781 A 76 VAL H A 76 VAL HB 1.0 . 3.68 887 782 A 76 VAL HGy% A 76 VAL H 1.0 . 3.43 888 783 A 76 VAL HGx% A 76 VAL H 1.0 . 4.32 889 784 A 77 SER H A 79 SER H 1.0 . 4.35 890 785 A 77 SER H A 73 ASP HBx 1.0 . 6.00 891 786 A 75 ILE H A 78 ASN H 1.0 . 4.79 892 787 A 74 TYR HA A 78 ASN H 1.0 . 4.07 893 788 A 78 ASN H A 78 ASN HBy 1.0 . 4.16 894 789 A 78 ASN H A 78 ASN HBx 1.0 . 4.16 895 790 A 22 ALA HA A 25 VAL H 1.0 . 3.97 896 791 A 38 ASP HA A 39 SER H 1.0 . 3.44 897 792 A 2 THR H A 5 GLU HBy 1.0 . 4.46 898 793 A 2 THR H A 5 GLU HBx 1.0 . 4.46 899 794 A 2 THR H A 5 GLU HGx 1.0 . 4.32 900 794 A 2 THR H A 5 GLU HGy 1.0 . 4.32 901 795 A 2 THR H A 5 GLU H 1.0 . 5.07 902 796 A 11 ALA H A 9 LYS HA 1.0 . 5.40 903 797 A 8 GLN HA A 11 ALA H 1.0 . 4.33 904 798 A 11 ALA H A 14 ILE HB 1.0 . 6.00 905 799 A 10 VAL HGy% A 11 ALA H 1.0 . 4.72 906 800 A 57 ILE H A 55 THR HG2% 1.0 . 6.00 907 801 A 57 ILE H A 57 ILE HG1x 1.0 . 4.88 908 801 A 57 ILE H A 57 ILE HG1y 1.0 . 4.88 909 802 A 11 ALA H A 68 VAL HGx% 1.0 . 6.00 910 803 A 69 GLY H A 27 ASP HBx 1.0 . 4.48 911 803 A 27 ASP HBy A 69 GLY H 1.0 . 4.48 912 804 A 27 ASP HA A 69 GLY H 1.0 . 3.87 913 805 A 67 THR HG2% A 69 GLY H 1.0 . 4.92 914 806 A 68 VAL HGy% A 69 GLY H 1.0 . 5.44 915 807 A 10 VAL H A 11 ALA H 1.0 . 3.72 916 808 A 10 VAL H A 12 LYS H 1.0 . 5.39 917 809 A 58 SER H A 58 SER HBx 1.0 . 4.14 918 810 A 10 VAL H A 9 LYS HBx 1.0 . 4.40 919 811 A 10 VAL H A 9 LYS HDx 1.0 . 5.39 920 811 A 10 VAL H A 9 LYS HDy 1.0 . 5.39 921 812 A 10 VAL H A 9 LYS HGx 1.0 . 5.37 922 812 A 10 VAL H A 9 LYS HGy 1.0 . 5.37 923 813 A 10 VAL H A 10 VAL HGy% 1.0 . 3.98 924 814 A 69 GLY H A 72 VAL HG11 1.0 . 4.56 925 815 A 14 ILE H A 12 LYS H 1.0 . 4.67 926 816 A 14 ILE H A 12 LYS HA 1.0 . 5.21 927 817 A 11 ALA HA A 14 ILE H 1.0 . 4.15 928 818 A 10 VAL HA A 14 ILE H 1.0 . 4.73 929 819 A 14 ILE H A 14 ILE HB 1.0 . 3.50 930 820 A 13 ILE HB A 14 ILE H 1.0 . 3.96 931 821 A 12 LYS HBx A 14 ILE H 1.0 . 5.24 932 822 A 11 ALA HB% A 14 ILE H 1.0 . 6.00 933 823 A 57 ILE H A 57 ILE HB 1.0 . 3.97 934 824 A 14 ILE H A 14 ILE HG1x 1.0 . 3.90 935 825 A 14 ILE H A 13 ILE HG2% 1.0 . 4.12 936 826 A 10 VAL HGy% A 14 ILE H 1.0 . 5.61 937 827 A 10 VAL HGx% A 14 ILE H 1.0 . 5.96 938 828 A 14 ILE H A 14 ILE HG2% 1.0 . 3.95 939 829 A 3 ARG H A 4 GLU H 1.0 . 3.83 940 830 A 3 ARG H A 2 THR HA 1.0 . 3.23 941 831 A 6 VAL HB A 3 ARG H 1.0 . 5.33 942 832 A 3 ARG H A 3 ARG HGx 1.0 . 3.66 943 832 A 3 ARG HGy A 3 ARG H 1.0 . 3.66 944 833 A 21 GLU H A 22 ALA H 1.0 . 4.71 945 834 A 24 GLN H A 22 ALA H 1.0 . 5.06 946 835 A 15 SER HA A 22 ALA H 1.0 . 5.10 947 836 A 21 GLU HA A 22 ALA H 1.0 . 3.03 948 837 A 22 ALA H A 15 SER HBy 1.0 . 4.48 949 838 A 2 THR H A 5 GLU HA 1.0 . 5.49 950 839 A 22 ALA H A 15 SER HBx 1.0 . 4.48 951 840 A 11 ALA HB% A 22 ALA H 1.0 . 6.00 952 841 A 22 ALA HB% A 22 ALA H 1.0 . 3.65 953 842 A 59 ASP H A 58 SER HBx 1.0 . 4.30 954 843 A 59 ASP H A 59 ASP HBy 1.0 . 4.15 955 844 A 11 ALA H A 12 LYS HBy 1.0 . 5.75 956 845 A 14 ILE H A 15 SER HA 1.0 . 5.54 957 846 A 10 VAL H A 7 LEU H 1.0 . 5.52 958 847 A 7 LEU H A 4 GLU H 1.0 . 5.21 959 848 A 7 LEU H A 6 VAL H 1.0 . 3.63 960 849 A 7 LEU H A 9 LYS H 1.0 . 5.12 961 850 A 5 GLU H A 7 LEU H 1.0 . 4.96 962 851 A 5 GLU HA A 7 LEU H 1.0 . 5.07 963 852 A 3 ARG HA A 7 LEU H 1.0 . 4.60 964 853 A 72 VAL HA A 7 LEU H 1.0 . 5.78 965 854 A 6 VAL HB A 7 LEU H 1.0 . 3.55 966 855 A 7 LEU H A 7 LEU HBy 1.0 . 3.47 967 856 A 7 LEU H A 3 ARG HGx 1.0 . 5.44 968 856 A 3 ARG HGy A 7 LEU H 1.0 . 5.44 969 857 A 7 LEU H A 7 LEU HBx 1.0 . 3.47 970 858 A 10 VAL HGy% A 7 LEU H 1.0 . 5.88 971 859 A 7 LEU H A 6 VAL HGy% 1.0 . 4.69 972 860 A 27 ASP H A 28 GLN H 1.0 . 3.80 973 861 A 27 ASP H A 69 GLY H 1.0 . 5.34 974 862 A 27 ASP H A 29 LEU H 1.0 . 5.06 975 863 A 27 ASP H A 26 THR H 1.0 . 5.02 976 864 A 27 ASP H A 26 THR HA 1.0 . 3.03 977 865 A 27 ASP H A 26 THR HB 1.0 . 3.77 978 866 A 27 ASP H A 28 GLN HA 1.0 . 5.30 979 867 A 27 ASP H A 27 ASP HBx 1.0 . 4.03 980 867 A 27 ASP H A 27 ASP HBy 1.0 . 4.03 981 868 A 27 ASP H A 26 THR HG2% 1.0 . 3.63 982 869 A 27 ASP H A 68 VAL HGx% 1.0 . 5.60 983 870 A 4 GLU H A 6 VAL H 1.0 . 4.91 984 871 A 5 GLU H A 4 GLU H 1.0 . 3.76 985 872 A 4 GLU H A 4 GLU HBy 1.0 . 3.79 986 873 A 4 GLU H A 4 GLU HBx 1.0 . 3.79 987 874 A 4 GLU H A 3 ARG HGx 1.0 . 3.83 988 874 A 3 ARG HGy A 4 GLU H 1.0 . 3.83 989 875 A 2 THR HG2% A 4 GLU H 1.0 . 4.30 990 876 A 29 LEU H A 69 GLY H 1.0 . 5.89 991 877 A 11 ALA H A 14 ILE H 1.0 . 5.49 992 878 A 12 LYS HBy A 14 ILE H 1.0 . 5.95 993 879 A 3 ARG H A 6 VAL H 1.0 . 5.86 994 880 A 5 GLU H A 3 ARG H 1.0 . 5.50 995 881 A 4 GLU HA A 3 ARG H 1.0 . 5.47 996 882 A 20 ILE HD1% A 22 ALA H 1.0 . 6.00 997 883 A 20 ILE HG2% A 22 ALA H 1.0 . 5.46 998 884 A 61 ASP H A 59 ASP H 1.0 . 6.00 999 885 A 76 VAL H A 79 SER H 1.0 . 4.93 1000 886 A 76 VAL H A 73 ASP HA 1.0 . 4.19 1001 887 A 76 VAL H A 74 TYR HA 1.0 . 5.05 1002 888 A 76 VAL H A 77 SER HBx 1.0 . 4.80 1003 888 A 76 VAL H A 77 SER HBy 1.0 . 4.80 1004 889 A 72 VAL H A 73 ASP H 1.0 . 3.62 1005 890 A 74 TYR H A 73 ASP H 1.0 . 3.68 1006 891 A 73 ASP H A 69 GLY HAx 1.0 . 4.81 1007 892 A 73 ASP H A 74 TYR HBy 1.0 . 5.42 1008 893 A 73 ASP H A 74 TYR HBx 1.0 . 5.42 1009 894 A 73 ASP H A 73 ASP HBx 1.0 . 3.57 1010 895 A 73 ASP H A 76 VAL HB 1.0 . 5.14 1011 896 A 70 ALA HB% A 73 ASP H 1.0 . 5.63 1012 897 A 73 ASP H A 72 VAL HG11 1.0 . 3.85 1013 898 A 76 VAL H A 75 ILE HB 1.0 . 3.79 1014 899 A 75 ILE HG2% A 76 VAL H 1.0 . 3.97 1015 900 A 59 ASP H A 60 GLU H 1.0 . 4.18 1016 901 A 58 SER HA A 60 GLU H 1.0 . 4.68 1017 902 A 60 GLU H A 59 ASP HBy 1.0 . 4.27 1018 903 A 60 GLU H A 60 GLU HGx 1.0 . 4.24 1019 903 A 60 GLU HGy A 60 GLU H 1.0 . 4.24 1020 904 A 60 GLU H A 60 GLU HBx 1.0 . 3.80 1021 904 A 60 GLU HBy A 60 GLU H 1.0 . 3.80 1022 905 A 62 ALA HB% A 60 GLU H 1.0 . 6.00 1023 906 A 30 ASN HA A 67 THR HA 1.0 . 3.50 1024 907 A 66 GLU HA A 67 THR HA 1.0 . 5.90 1025 908 A 68 VAL HA A 67 THR HA 1.0 . 4.78 1026 909 A 30 ASN HBy A 67 THR HA 1.0 . 5.07 1027 910 A 68 VAL HB A 67 THR HA 1.0 . 5.15 1028 911 A 67 THR HA A 66 GLU HBy 1.0 . 5.52 1029 912 A 66 GLU HBx A 67 THR HA 1.0 . 5.88 1030 913 A 70 ALA HB% A 67 THR HA 1.0 . 4.67 1031 914 A 67 THR HG2% A 67 THR HA 1.0 . 3.28 1032 915 A 31 ILE HG1y A 67 THR HA 1.0 . 6.00 1033 916 A 68 VAL HGx% A 67 THR HA 1.0 . 6.00 1034 917 A 31 ILE HG2% A 67 THR HA 1.0 . 5.63 1035 918 A 29 LEU H A 67 THR HA 1.0 . 6.00 1036 919 A 67 THR HA A 69 GLY H 1.0 . 4.76 1037 920 A 30 ASN H A 67 THR HA 1.0 . 5.43 1038 921 A 16 ASN H A 16 ASN HD2x 1.0 . 4.63 1039 922 A 74 TYR HA A 74 TYR HEy 1.0 . 4.75 1040 923 A 32 LYS H A 35 LEU H 1.0 . 5.35 1041 924 A 74 TYR HEx A 75 ILE HA 1.0 . 5.32 1042 925 A 74 TYR HEx A 65 ILE HD1% 1.0 . 4.41 1043 926 A 57 ILE HG2% A 74 TYR HEx 1.0 . 5.21 1044 927 A 35 LEU H A 37 ALA H 1.0 . 4.98 1045 928 A 35 LEU H A 36 ASN H 1.0 . 3.83 1046 929 A 35 LEU H A 36 ASN HA 1.0 . 4.89 1047 930 A 35 LEU H A 34 ASP HBy 1.0 . 4.95 1048 931 A 35 LEU HBx A 35 LEU H 1.0 . 4.09 1049 932 A 35 LEU HBy A 35 LEU H 1.0 . 3.91 1050 933 A 35 LEU HG A 35 LEU H 1.0 . 4.36 1051 934 A 16 ASN H A 16 ASN HD2y 1.0 . 4.63 1052 935 A 74 TYR HA A 74 TYR HDy 1.0 . 4.35 1053 936 A 45 PHE HEy A 18 PHE HE% 1.0 . 5.12 1054 937 A 75 ILE H A 74 TYR HDx 1.0 . 3.78 1055 938 A 71 ALA HA A 74 TYR HDx 1.0 . 4.52 1056 939 A 14 ILE HA A 18 PHE HE% 1.0 . 3.84 1057 940 A 74 TYR HDx A 75 ILE HA 1.0 . 4.08 1058 941 A 74 TYR HDx A 74 TYR HBy 1.0 . 3.65 1059 942 A 74 TYR HDx A 74 TYR HBx 1.0 . 3.65 1060 943 A 57 ILE HG2% A 74 TYR HDx 1.0 . 4.06 1061 944 A 75 ILE HG2% A 74 TYR HDx 1.0 . 5.15 1062 945 A 17 HIS HA A 17 HIS HD2 1.0 . 4.57 1063 946 A 25 VAL H A 29 LEU HBy 1.0 . 6.00 1064 947 A 65 ILE H A 63 GLU H 1.0 . 5.46 1065 948 A 18 PHE HD% A 18 PHE HA 1.0 . 4.02 1066 949 A 18 PHE HD% A 17 HIS HBx 1.0 . 3.99 1067 949 A 18 PHE HD% A 17 HIS HBy 1.0 . 3.99 1068 950 A 18 PHE HD% A 35 LEU HBy 1.0 . 5.66 1069 951 A 18 PHE HD% A 14 ILE HG2% 1.0 . 3.67 1070 952 A 18 PHE HD% A 20 ILE HG2% 1.0 . 4.71 1071 953 A 18 PHE HD% A 35 LEU HG 1.0 . 4.27 1072 954 A 18 PHE HD% A 31 ILE HG2% 1.0 . 5.23 1073 955 A 12 LYS HBx A 12 LYS H 1.0 . 3.93 1074 956 A 9 LYS HA A 12 LYS H 1.0 . 4.91 1075 957 A 22 ALA HB% A 12 LYS H 1.0 . 6.00 1076 958 A 52 GLU H A 53 PHE HE% 1.0 . 5.90 1077 959 A 53 PHE HE% A 6 VAL H 1.0 . 5.33 1078 960 A 49 LEU H A 53 PHE HE% 1.0 . 5.84 1079 961 A 49 LEU HA A 53 PHE HE% 1.0 . 3.74 1080 962 A 6 VAL HA A 53 PHE HE% 1.0 . 5.42 1081 963 A 9 LYS HBy A 53 PHE HE% 1.0 . 4.30 1082 964 A 49 LEU HBx A 53 PHE HE% 1.0 . 4.31 1083 965 A 53 PHE HE% A 9 LYS HGx 1.0 . 4.50 1084 965 A 53 PHE HE% A 9 LYS HGy 1.0 . 4.50 1085 966 A 49 LEU HBy A 53 PHE HE% 1.0 . 4.46 1086 967 A 10 VAL HGy% A 53 PHE HE% 1.0 . 5.23 1087 968 A 49 LEU HG A 53 PHE HE% 1.0 . 4.44 1088 969 A 53 PHE HE% A 75 ILE HG2% 1.0 . 3.82 1089 970 A 37 ALA H A 36 ASN H 1.0 . 3.96 1090 971 A 35 LEU HA A 37 ALA H 1.0 . 5.53 1091 972 A 32 LYS HA A 37 ALA H 1.0 . 3.62 1092 973 A 31 ILE HA A 37 ALA H 1.0 . 5.50 1093 974 A 37 ALA H A 36 ASN HBy 1.0 . 4.57 1094 975 A 36 ASN HBx A 37 ALA H 1.0 . 5.01 1095 976 A 32 LYS HBy A 37 ALA H 1.0 . 5.67 1096 977 A 35 LEU HD21 A 37 ALA H 1.0 . 6.00 1097 978 A 31 ILE HG2% A 37 ALA H 1.0 . 4.92 1098 979 A 35 LEU HG A 37 ALA H 1.0 . 5.65 1099 980 A 55 THR H A 56 GLU HBx 1.0 . 6.00 1100 980 A 55 THR H A 56 GLU HBy 1.0 . 6.00 1101 981 A 53 PHE HBx A 55 THR H 1.0 . 5.45 1102 982 A 53 PHE HBy A 55 THR H 1.0 . 5.44 1103 983 A 50 GLU HA A 55 THR H 1.0 . 3.96 1104 984 A 55 THR H A 53 PHE H 1.0 . 5.30 1105 985 A 55 THR H A 56 GLU H 1.0 . 5.10 1106 986 A 55 THR H A 50 GLU H 1.0 . 5.77 1107 987 A 5 GLU H A 2 THR HA 1.0 . 6.00 1108 988 A 5 GLU H A 2 THR HB 1.0 . 6.00 1109 989 A 5 GLU H A 3 ARG HGx 1.0 . 5.53 1110 989 A 5 GLU H A 3 ARG HGy 1.0 . 5.53 1111 990 A 5 GLU H A 6 VAL H 1.0 . 3.55 1112 991 A 49 LEU H A 48 GLU H 1.0 . 3.77 1113 992 A 51 ASP H A 48 GLU H 1.0 . 5.86 1114 993 A 47 LEU HBx A 48 GLU H 1.0 . 4.27 1115 994 A 49 LEU HG A 48 GLU H 1.0 . 5.83 1116 995 A 70 ALA HB% A 70 ALA H 1.0 . 3.15 1117 996 A 62 ALA HB% A 61 ASP H 1.0 . 5.42 1118 997 A 65 ILE HG2% A 61 ASP H 1.0 . 6.00 1119 998 A 65 ILE HD1% A 61 ASP H 1.0 . 6.00 1120 999 A 70 ALA H A 67 THR H 1.0 . 4.61 1121 1000 A 61 ASP H A 60 GLU H 1.0 . 3.95 1122 1001 A 43 MET H A 44 GLU H 1.0 . 3.99 1123 1002 A 70 ALA H A 69 GLY H 1.0 . 4.29 1124 1003 A 11 ALA H A 9 LYS H 1.0 . 4.70 1125 1004 A 6 VAL H A 9 LYS H 1.0 . 4.93 1126 1005 A 6 VAL HA A 9 LYS H 1.0 . 5.03 1127 1006 A 9 LYS H A 9 LYS HEx 1.0 . 5.68 1128 1006 A 9 LYS HEy A 9 LYS H 1.0 . 5.68 1129 1007 A 9 LYS H A 8 GLN HBx 1.0 . 3.70 1130 1007 A 8 GLN HBy A 9 LYS H 1.0 . 3.70 1131 1008 A 9 LYS HBy A 9 LYS H 1.0 . 3.87 1132 1009 A 9 LYS H A 9 LYS HDx 1.0 . 3.96 1133 1009 A 9 LYS HDy A 9 LYS H 1.0 . 3.96 1134 1010 A 9 LYS H A 9 LYS HGx 1.0 . 4.27 1135 1010 A 9 LYS HGy A 9 LYS H 1.0 . 4.27 1136 1011 A 28 GLN HBy A 28 GLN H 1.0 . 3.63 1137 1012 A 30 ASN H A 28 GLN H 1.0 . 6.00 1138 1013 A 29 LEU H A 28 GLN H 1.0 . 3.04 1139 1014 A 26 THR HG2% A 28 GLN H 1.0 . 3.98 1140 1015 A 25 VAL H A 24 GLN H 1.0 . 3.72 1141 1016 A 79 SER H A 78 ASN H 1.0 . 3.94 1142 1017 A 76 VAL HA A 78 ASN H 1.0 . 5.42 1143 1018 A 24 GLN H A 24 GLN HGx 1.0 . 3.63 1144 1018 A 24 GLN HGy A 24 GLN H 1.0 . 3.63 1145 1019 A 24 GLN H A 24 GLN HBy 1.0 . 3.79 1146 1020 A 24 GLN H A 24 GLN HBx 1.0 . 3.79 1147 1021 A 24 GLN H A 25 VAL HG11 1.0 . 4.38 1148 1022 A 76 VAL H A 77 SER H 1.0 . 3.63 1149 1023 A 74 TYR H A 77 SER H 1.0 . 5.00 1150 1024 A 75 ILE H A 77 SER H 1.0 . 5.33 1151 1025 A 16 ASN H A 17 HIS H 1.0 . 3.55 1152 1026 A 77 SER H A 78 ASN HA 1.0 . 5.47 1153 1027 A 77 SER H A 77 SER HBx 1.0 . 3.26 1154 1027 A 77 SER H A 77 SER HBy 1.0 . 3.26 1155 1028 A 77 SER H A 75 ILE HA 1.0 . 5.25 1156 1029 A 77 SER H A 76 VAL HB 1.0 . 3.77 1157 1030 A 76 VAL HGy% A 77 SER H 1.0 . 4.77 1158 1031 A 76 VAL HGx% A 77 SER H 1.0 . 4.82 1159 1032 A 18 PHE HD% A 17 HIS H 1.0 . 4.56 1160 1033 A 18 PHE HA A 17 HIS H 1.0 . 5.55 1161 1034 A 17 HIS H A 17 HIS HBx 1.0 . 3.87 1162 1034 A 17 HIS HBy A 17 HIS H 1.0 . 3.87 1163 1035 A 55 THR H A 54 GLY H 1.0 . 3.87 1164 1036 A 54 GLY H A 51 ASP HA 1.0 . 4.79 1165 1037 A 55 THR HB A 54 GLY H 1.0 . 5.10 1166 1038 A 53 PHE HBy A 54 GLY H 1.0 . 5.07 1167 1039 A 53 PHE HBx A 54 GLY H 1.0 . 4.76 1168 1040 A 13 ILE H A 14 ILE H 1.0 . 3.83 1169 1041 A 13 ILE H A 11 ALA H 1.0 . 5.01 1170 1042 A 13 ILE H A 12 LYS H 1.0 . 3.70 1171 1043 A 13 ILE H A 9 LYS HA 1.0 . 4.88 1172 1044 A 10 VAL HA A 13 ILE H 1.0 . 4.15 1173 1045 A 13 ILE H A 14 ILE HB 1.0 . 5.54 1174 1046 A 54 GLY H A 50 GLU HGx 1.0 . 5.99 1175 1046 A 50 GLU HGy A 54 GLY H 1.0 . 5.99 1176 1047 A 13 ILE HB A 13 ILE H 1.0 . 3.52 1177 1048 A 13 ILE H A 12 LYS HBy 1.0 . 3.89 1178 1049 A 13 ILE H A 12 LYS HBx 1.0 . 3.78 1179 1050 A 13 ILE H A 13 ILE HG1y 1.0 . 4.25 1180 1051 A 13 ILE H A 14 ILE HG1x 1.0 . 5.18 1181 1052 A 13 ILE H A 13 ILE HG2% 1.0 . 4.26 1182 1053 A 11 ALA H A 8 GLN H 1.0 . 5.31 1183 1054 A 10 VAL H A 8 GLN H 1.0 . 4.97 1184 1055 A 8 GLN H A 7 LEU H 1.0 . 3.77 1185 1056 A 8 GLN H A 6 VAL H 1.0 . 4.86 1186 1057 A 49 LEU H A 51 ASP H 1.0 . 5.06 1187 1058 A 8 GLN H A 9 LYS H 1.0 . 3.71 1188 1059 A 18 PHE HD% A 20 ILE H 1.0 . 5.66 1189 1060 A 6 VAL HA A 8 GLN H 1.0 . 5.31 1190 1061 A 8 GLN H A 8 GLN HGx 1.0 . 3.89 1191 1061 A 8 GLN HGy A 8 GLN H 1.0 . 3.89 1192 1062 A 8 GLN H A 8 GLN HBx 1.0 . 3.21 1193 1062 A 8 GLN HBy A 8 GLN H 1.0 . 3.21 1194 1063 A 51 ASP H A 50 GLU HBx 1.0 . 3.80 1195 1063 A 51 ASP H A 50 GLU HBy 1.0 . 3.80 1196 1064 A 8 GLN H A 7 LEU HBx 1.0 . 4.22 1197 1065 A 10 VAL HGy% A 8 GLN H 1.0 . 6.00 1198 1066 A 8 GLN H A 6 VAL HGy% 1.0 . 6.00 1199 1067 A 8 GLN H A 6 VAL HGx% 1.0 . 6.00 1200 1068 A 65 ILE H A 66 GLU H 1.0 . 4.45 1201 1069 A 66 GLU H A 67 THR H 1.0 . 3.58 1202 1070 A 66 GLU H A 67 THR HA 1.0 . 5.93 1203 1071 A 65 ILE HA A 66 GLU H 1.0 . 3.41 1204 1072 A 66 GLU H A 66 GLU HBy 1.0 . 3.88 1205 1073 A 70 ALA HB% A 66 GLU H 1.0 . 3.72 1206 1074 A 67 THR HG2% A 66 GLU H 1.0 . 4.88 1207 1075 A 66 GLU H A 65 ILE HG2% 1.0 . 4.79 1208 1076 A 65 ILE HG1x A 66 GLU H 1.0 . 5.06 1209 1077 A 53 PHE H A 54 GLY H 1.0 . 3.71 1210 1078 A 52 GLU H A 53 PHE H 1.0 . 3.94 1211 1079 A 53 PHE HBy A 53 PHE H 1.0 . 4.09 1212 1080 A 53 PHE HBx A 53 PHE H 1.0 . 3.96 1213 1081 A 53 PHE H A 52 GLU HBx 1.0 . 4.83 1214 1082 A 44 GLU H A 45 PHE H 1.0 . 3.69 1215 1083 A 43 MET H A 45 PHE H 1.0 . 4.73 1216 1084 A 53 PHE HD% A 53 PHE H 1.0 . 3.90 1217 1085 A 45 PHE HEx A 45 PHE H 1.0 . 5.02 1218 1086 A 43 MET HA A 45 PHE H 1.0 . 5.09 1219 1087 A 45 PHE H A 42 VAL HA 1.0 . 4.17 1220 1088 A 45 PHE HBy A 45 PHE H 1.0 . 3.65 1221 1089 A 45 PHE HBx A 45 PHE H 1.0 . 3.62 1222 1090 A 45 PHE H A 44 GLU HBx 1.0 . 4.04 1223 1090 A 44 GLU HBy A 45 PHE H 1.0 . 4.04 1224 1091 A 47 LEU HBy A 45 PHE H 1.0 . 5.44 1225 1092 A 46 VAL HGx% A 45 PHE H 1.0 . 5.46 1226 1093 A 75 ILE H A 76 VAL H 1.0 . 3.66 1227 1094 A 74 TYR H A 77 SER HBx 1.0 . 4.95 1228 1094 A 74 TYR H A 77 SER HBy 1.0 . 4.95 1229 1095 A 75 ILE H A 75 ILE HG1y 1.0 . 3.82 1230 1096 A 75 ILE H A 75 ILE HG1x 1.0 . 3.82 1231 1097 A 47 LEU H A 57 ILE HD1% 1.0 . 6.00 1232 1098 A 75 ILE H A 57 ILE HD1% 1.0 . 6.00 1233 1099 A 75 ILE H A 75 ILE HG2% 1.0 . 3.85 1234 1100 A 32 LYS H A 33 ASP H 1.0 . 3.58 1235 1101 A 32 LYS H A 37 ALA H 1.0 . 5.65 1236 1102 A 32 LYS H A 36 ASN H 1.0 . 6.00 1237 1103 A 32 LYS H A 67 THR H 1.0 . 6.00 1238 1104 A 30 ASN HA A 32 LYS H 1.0 . 4.91 1239 1105 A 32 LYS H A 33 ASP HA 1.0 . 5.90 1240 1106 A 32 LYS H A 67 THR HB 1.0 . 6.00 1241 1107 A 32 LYS H A 32 LYS HGx 1.0 . 4.05 1242 1107 A 32 LYS H A 32 LYS HGy 1.0 . 4.05 1243 1108 A 6 VAL H A 6 VAL HGy% 1.0 . 4.58 1244 1109 A 75 ILE HG2% A 6 VAL H 1.0 . 5.59 1245 1110 A 6 VAL H A 6 VAL HGx% 1.0 . 4.58 1246 1111 A 6 VAL H A 5 GLU HBx 1.0 . 4.17 1247 1112 A 6 VAL HB A 6 VAL H 1.0 . 3.24 1248 1113 A 49 LEU H A 48 GLU HGx 1.0 . 4.49 1249 1114 A 3 ARG HA A 6 VAL H 1.0 . 4.17 1250 1115 A 2 THR H A 6 VAL H 1.0 . 5.70 1251 1116 A 49 LEU H A 48 GLU HBx 1.0 . 4.28 1252 1117 A 49 LEU HBx A 49 LEU H 1.0 . 3.71 1253 1118 A 49 LEU H A 50 GLU H 1.0 . 3.76 1254 1119 A 49 LEU H A 52 GLU H 1.0 . 5.49 1255 1120 A 53 PHE HD% A 6 VAL H 1.0 . 5.65 1256 1121 A 53 PHE HD% A 49 LEU H 1.0 . 6.00 1257 1122 A 49 LEU H A 47 LEU HA 1.0 . 4.94 1258 1123 A 46 VAL HA A 49 LEU H 1.0 . 4.09 1259 1124 A 49 LEU H A 51 ASP HBy 1.0 . 5.86 1260 1125 A 49 LEU H A 51 ASP HBx 1.0 . 5.86 1261 1126 A 48 GLU HGy A 49 LEU H 1.0 . 5.04 1262 1127 A 2 THR HG2% A 6 VAL H 1.0 . 3.63 1263 1128 A 49 LEU H A 49 LEU HBy 1.0 . 3.91 1264 1129 A 49 LEU HD21 A 49 LEU H 1.0 . 4.80 1265 1130 A 49 LEU H A 57 ILE HD1% 1.0 . 5.77 1266 1131 A 49 LEU HG A 49 LEU H 1.0 . 4.07 1267 1132 A 38 ASP H A 37 ALA H 1.0 . 4.80 1268 1133 A 38 ASP H A 41 SER HBx 1.0 . 4.08 1269 1133 A 38 ASP H A 41 SER HBy 1.0 . 4.08 1270 1134 A 21 GLU H A 20 ILE HG2% 1.0 . 4.22 1271 1135 A 35 LEU HD21 A 21 GLU H 1.0 . 6.00 1272 1136 A 20 ILE HG1x A 21 GLU H 1.0 . 3.80 1273 1137 A 20 ILE HB A 21 GLU H 1.0 . 4.03 1274 1138 A 21 GLU H A 24 GLN HBx 1.0 . 4.61 1275 1139 A 21 GLU H A 21 GLU HGx 1.0 . 4.35 1276 1139 A 21 GLU H A 21 GLU HGy 1.0 . 4.35 1277 1140 A 21 GLU H A 24 GLN HBy 1.0 . 4.61 1278 1141 A 20 ILE HA A 21 GLU H 1.0 . 3.10 1279 1142 A 37 ALA HA A 38 ASP H 1.0 . 3.26 1280 1143 A 57 ILE H A 56 GLU H 1.0 . 5.46 1281 1144 A 55 THR HA A 56 GLU H 1.0 . 3.28 1282 1145 A 55 THR HB A 56 GLU H 1.0 . 4.47 1283 1146 A 56 GLU H A 56 GLU HGx 1.0 . 4.12 1284 1146 A 56 GLU HGy A 56 GLU H 1.0 . 4.12 1285 1147 A 56 GLU H A 56 GLU HBx 1.0 . 3.49 1286 1147 A 56 GLU HBy A 56 GLU H 1.0 . 3.49 1287 1148 A 30 ASN HA A 31 ILE H 1.0 . 3.41 1288 1149 A 67 THR HA A 31 ILE H 1.0 . 3.82 1289 1150 A 67 THR H A 31 ILE H 1.0 . 5.41 1290 1151 A 32 LYS H A 31 ILE H 1.0 . 3.92 1291 1152 A 68 VAL H A 31 ILE H 1.0 . 4.43 1292 1153 A 30 ASN H A 31 ILE H 1.0 . 5.02 1293 1154 A 30 ASN HBy A 31 ILE H 1.0 . 4.91 1294 1155 A 30 ASN HBx A 31 ILE H 1.0 . 4.97 1295 1156 A 31 ILE HB A 31 ILE H 1.0 . 3.72 1296 1157 A 31 ILE HG1x A 31 ILE H 1.0 . 3.55 1297 1158 A 55 THR HG2% A 56 GLU H 1.0 . 4.15 1298 1159 A 31 ILE HG2% A 31 ILE H 1.0 . 3.86 1299 1160 A 14 ILE H A 15 SER H 1.0 . 3.78 1300 1161 A 15 SER H A 22 ALA H 1.0 . 5.91 1301 1162 A 13 ILE H A 15 SER H 1.0 . 4.99 1302 1163 A 12 LYS H A 15 SER H 1.0 . 5.32 1303 1164 A 18 PHE HD% A 15 SER H 1.0 . 5.90 1304 1165 A 15 SER H A 15 SER HBy 1.0 . 3.85 1305 1166 A 12 LYS HA A 15 SER H 1.0 . 4.23 1306 1167 A 15 SER H A 15 SER HBx 1.0 . 3.85 1307 1168 A 14 ILE HB A 15 SER H 1.0 . 3.68 1308 1169 A 11 ALA HB% A 15 SER H 1.0 . 6.00 1309 1170 A 14 ILE HG1y A 15 SER H 1.0 . 5.19 1310 1171 A 22 ALA HB% A 15 SER H 1.0 . 5.32 1311 1172 A 14 ILE HG1x A 15 SER H 1.0 . 4.94 1312 1173 A 14 ILE HG2% A 15 SER H 1.0 . 3.90 1313 1174 A 20 ILE HG2% A 15 SER H 1.0 . 4.70 1314 1175 A 14 ILE HD1% A 15 SER H 1.0 . 5.97 1315 1176 A 42 VAL H A 44 GLU H 1.0 . 5.22 1316 1177 A 46 VAL H A 44 GLU H 1.0 . 5.54 1317 1178 A 46 VAL H A 45 PHE H 1.0 . 3.88 1318 1179 A 47 LEU HA A 50 GLU H 1.0 . 3.95 1319 1180 A 46 VAL H A 42 VAL HA 1.0 . 5.54 1320 1181 A 46 VAL H A 45 PHE HBx 1.0 . 4.36 1321 1182 A 46 VAL H A 46 VAL HGx% 1.0 . 3.95 1322 1183 A 46 VAL H A 46 VAL HGy% 1.0 . 4.06 1323 1184 A 46 VAL HGy% A 50 GLU H 1.0 . 4.49 1324 1185 A 23 ASP H A 22 ALA H 1.0 . 3.78 1325 1186 A 23 ASP H A 24 GLN H 1.0 . 3.59 1326 1187 A 14 ILE HA A 18 PHE H 1.0 . 4.36 1327 1188 A 68 VAL HB A 68 VAL H 1.0 . 3.54 1328 1189 A 67 THR HG2% A 68 VAL H 1.0 . 4.07 1329 1190 A 35 LEU HD21 A 34 ASP H 1.0 . 5.21 1330 1191 A 31 ILE HG2% A 18 PHE H 1.0 . 5.94 1331 1192 A 35 LEU HG A 18 PHE H 1.0 . 5.62 1332 1193 A 67 THR HB A 68 VAL H 1.0 . 3.53 1333 1194 A 67 THR HA A 68 VAL H 1.0 . 3.42 1334 1195 A 29 LEU H A 68 VAL H 1.0 . 4.94 1335 1196 A 68 VAL H A 69 GLY H 1.0 . 4.06 1336 1197 A 30 ASN H A 34 ASP H 1.0 . 4.78 1337 1198 A 34 ASP H A 35 LEU H 1.0 . 3.68 1338 1199 A 34 ASP H A 34 ASP HBy 1.0 . 4.00 1339 1200 A 33 ASP H A 33 ASP HBy 1.0 . 3.79 1340 1201 A 32 LYS HBy A 33 ASP H 1.0 . 3.86 1341 1202 A 32 LYS HBx A 33 ASP H 1.0 . 3.76 1342 1203 A 31 ILE HB A 68 VAL H 1.0 . 5.99 1343 1204 A 33 ASP H A 32 LYS HDx 1.0 . 4.96 1344 1204 A 32 LYS HDy A 33 ASP H 1.0 . 4.96 1345 1205 A 53 PHE HD% A 10 VAL H 1.0 . 6.00 1346 1206 A 41 SER H A 39 SER H 1.0 . 5.44 1347 1207 A 42 VAL H A 39 SER H 1.0 . 5.81 1348 1208 A 38 ASP H A 39 SER H 1.0 . 4.80 1349 1209 A 40 ILE H A 39 SER H 1.0 . 3.99 1350 1210 A 40 ILE HA A 39 SER H 1.0 . 5.55 1351 1211 A 39 SER H A 38 ASP HBy 1.0 . 3.91 1352 1212 A 39 SER H A 38 ASP HBx 1.0 . 3.91 1353 1213 A 40 ILE HB A 39 SER H 1.0 . 5.22 1354 1214 A 37 ALA HB% A 39 SER H 1.0 . 6.00 1355 1215 A 40 ILE HG2% A 39 SER H 1.0 . 6.00 1356 1216 A 40 ILE HD1% A 39 SER H 1.0 . 6.00 1357 1217 A 45 PHE HEy A 18 PHE HZ 1.0 . 4.76 1358 1218 A 37 ALA HB% A 45 PHE HEx 1.0 . 5.01 1359 1219 A 53 PHE HD% A 6 VAL HGy% 1.0 . 6.00 1360 1220 A 53 PHE HD% A 55 THR HG2% 1.0 . 6.00 1361 1221 A 18 PHE HD% A 37 ALA HA 1.0 . 5.52 1362 1222 A 14 ILE HA A 18 PHE HD% 1.0 . 3.83 1363 1223 A 75 ILE H A 74 TYR HEx 1.0 . 6.00 1364 1224 A 57 ILE HA A 74 TYR HDx 1.0 . 4.69 1365 1225 A 74 TYR HDy A 77 SER HBx 1.0 . 4.52 1366 1225 A 77 SER HBy A 74 TYR HDy 1.0 . 4.52 1367 1226 A 31 ILE HA A 35 LEU H 1.0 . 4.77 1368 1227 A 74 TYR HEx A 65 ILE HB 1.0 . 6.00 1369 1228 A 65 ILE HB A 74 TYR HDy 1.0 . 6.00 1370 1229 A 65 ILE HG2% A 74 TYR HEy 1.0 . 6.00 1371 1230 A 74 TYR HEx A 57 ILE HG1x 1.0 . 6.00 1372 1230 A 74 TYR HEx A 57 ILE HG1y 1.0 . 6.00 1373 1231 A 75 ILE HG2% A 74 TYR HEx 1.0 . 6.00 1374 1232 A 17 HIS H A 18 PHE H 1.0 . 3.52 1375 1233 A 18 PHE HD% A 18 PHE H 1.0 . 3.94 1376 1234 A 18 PHE HE% A 18 PHE H 1.0 . 5.29 1377 1235 A 30 ASN HA A 68 VAL H 1.0 . 4.41 1378 1236 A 18 PHE H A 19 ASP HA 1.0 . 5.43 1379 1237 A 15 SER HA A 18 PHE H 1.0 . 4.67 1380 1238 A 14 ILE HG2% A 18 PHE H 1.0 . 4.43 1381 1239 A 20 ILE HG2% A 18 PHE H 1.0 . 4.64 1382 1240 A 18 PHE HA A 18 PHE HE% 1.0 . 5.06 1383 1241 A 18 PHE H A 19 ASP H 1.0 . 4.63 1384 1242 A 19 ASP H A 20 ILE H 1.0 . 4.48 1385 1243 A 73 ASP H A 77 SER H 1.0 . 5.67 1386 1244 A 18 PHE HD% A 19 ASP H 1.0 . 4.27 1387 1245 A 18 PHE HA A 19 ASP H 1.0 . 3.51 1388 1246 A 19 ASP H A 18 PHE HBy 1.0 . 4.05 1389 1247 A 19 ASP H A 19 ASP HBy 1.0 . 4.07 1390 1248 A 19 ASP H A 18 PHE HBx 1.0 . 4.05 1391 1249 A 19 ASP H A 19 ASP HBx 1.0 . 4.07 1392 1250 A 14 ILE HG2% A 19 ASP H 1.0 . 6.00 1393 1251 A 20 ILE HD1% A 19 ASP H 1.0 . 6.00 1394 1252 A 20 ILE HG2% A 19 ASP H 1.0 . 4.81 1395 1253 A 35 LEU HG A 19 ASP H 1.0 . 5.26 1396 1254 A 38 ASP H A 45 PHE HZ 1.0 . 6.00 1397 1255 A 38 ASP H A 18 PHE HE% 1.0 . 4.84 1398 1256 A 18 PHE HZ A 38 ASP H 1.0 . 5.71 1399 1257 A 18 PHE HE% A 17 HIS HBx 1.0 . 4.40 1400 1257 A 17 HIS HBy A 18 PHE HE% 1.0 . 4.40 1401 1258 A 31 ILE HG2% A 18 PHE HZ 1.0 . 4.50 1402 1259 A 31 ILE HG2% A 35 LEU H 1.0 . 4.77 1403 1260 A 75 ILE HD1% A 74 TYR HDx 1.0 . 4.18 1404 1261 A 35 LEU HG A 18 PHE HE% 1.0 . 4.43 1405 1262 A 14 ILE HB A 12 LYS H 1.0 . 6.00 1406 1263 A 14 ILE HB A 18 PHE HD% 1.0 . 6.00 1407 1264 A 18 PHE HZ A 45 PHE HZ 1.0 . 3.97 1408 1265 A 37 ALA HA A 18 PHE HE% 1.0 . 3.96 1409 1266 A 18 PHE HZ A 37 ALA HA 1.0 . 4.65 1410 1267 A 31 ILE HA A 18 PHE HE% 1.0 . 6.00 1411 1268 A 18 PHE HZ A 37 ALA HB% 1.0 . 4.44 1412 1269 A 37 ALA HB% A 18 PHE HE% 1.0 . 4.16 1413 1270 A 14 ILE HG2% A 18 PHE HZ 1.0 . 5.38 1414 1271 A 14 ILE HG2% A 18 PHE HE% 1.0 . 4.35 1415 1272 A 20 ILE HD1% A 26 THR H 1.0 . 4.98 1416 1273 A 14 ILE HA A 18 PHE HZ 1.0 . 5.64 1417 1274 A 6 VAL HA A 53 PHE HZ 1.0 . 5.90 1418 1275 A 10 VAL HB A 53 PHE HZ 1.0 . 6.00 1419 1276 A 53 PHE HZ A 9 LYS HGx 1.0 . 6.00 1420 1276 A 9 LYS HGy A 53 PHE HZ 1.0 . 6.00 1421 1277 A 10 VAL HGy% A 53 PHE HZ 1.0 . 5.28 1422 1278 A 53 PHE HZ A 6 VAL HGy% 1.0 . 6.00 1423 1279 A 53 PHE HZ A 6 VAL HGx% 1.0 . 6.00 1424 1280 A 53 PHE HD% A 10 VAL HGy% 1.0 . 5.56 1425 1281 A 53 PHE HD% A 6 VAL HGx% 1.0 . 6.00 1426 1282 A 53 PHE HE% A 75 ILE HA 1.0 . 5.95 1427 1283 A 45 PHE HEy A 45 PHE HD% 1.0 . 4.19 1428 1284 A 45 PHE HEx A 45 PHE HD% 1.0 . 3.29 1429 1285 A 14 ILE HD1% A 45 PHE HD% 1.0 . 5.42 1430 1286 A 31 ILE HG2% A 33 ASP H 1.0 . 5.33 1431 1287 A 31 ILE HG2% A 34 ASP H 1.0 . 5.81 1432 1288 A 45 PHE HEy A 17 HIS HD2 1.0 . 5.33 1433 1289 A 45 PHE HEx A 17 HIS HD2 1.0 . 6.00 1434 1290 A 18 PHE HZ A 17 HIS HE1 1.0 . 6.00 1435 1291 A 18 PHE HE% A 17 HIS HD2 1.0 . 6.00 1436 1292 A 25 VAL H A 26 THR H 1.0 . 6.00 1437 1293 A 17 HIS HE1 A 17 HIS HBx 1.0 . 4.72 1438 1293 A 17 HIS HBy A 17 HIS HE1 1.0 . 4.72 1439 1294 A 23 ASP H A 24 GLN HGx 1.0 . 4.11 1440 1294 A 23 ASP H A 24 GLN HGy 1.0 . 4.11 1441 1295 A 44 GLU H A 44 GLU HBx 1.0 . 3.42 1442 1295 A 44 GLU HBy A 44 GLU H 1.0 . 3.42 1443 1296 A 13 ILE HG2% A 17 HIS HE1 1.0 . 6.00 1444 1297 A 46 VAL HGx% A 44 GLU H 1.0 . 6.00 1445 1298 A 12 LYS HBx A 16 ASN H 1.0 . 6.00 1446 1299 A 63 GLU H A 60 GLU HBx 1.0 . 6.00 1447 1299 A 63 GLU H A 60 GLU HBy 1.0 . 6.00 1448 1300 A 18 PHE HZ A 45 PHE HBy 1.0 . 5.64 1449 1301 A 18 PHE HE% A 17 HIS H 1.0 . 5.96 1450 1302 A 45 PHE HBx A 18 PHE HE% 1.0 . 5.25 1451 1303 A 18 PHE HZ A 45 PHE HBx 1.0 . 5.65 1452 1304 A 31 ILE HB A 18 PHE HZ 1.0 . 6.00 1453 1305 A 31 ILE HB A 35 LEU H 1.0 . 6.00 1454 1306 A 14 ILE HD1% A 18 PHE HZ 1.0 . 5.81 1455 1307 A 44 GLU H A 44 GLU HGx 1.0 . 3.62 1456 1307 A 44 GLU HGy A 44 GLU H 1.0 . 3.62 1457 1308 A 62 ALA H A 64 LYS HEx 1.0 . 5.69 1458 1308 A 62 ALA H A 64 LYS HEy 1.0 . 5.69 1459 1309 A 45 PHE HBy A 44 GLU H 1.0 . 4.80 1460 1310 A 13 ILE HB A 45 PHE HD% 1.0 . 6.00 1461 1311 A 14 ILE HG1x A 45 PHE HD% 1.0 . 5.74 1462 1312 A 2 THR H A 5 GLU HBx 1.0 . 3.67 1463 1312 A 2 THR H A 5 GLU HBy 1.0 . 3.67 1464 1313 A 2 THR H A 6 VAL HGy% 1.0 . 5.50 1465 1313 A 2 THR H A 6 VAL HGx% 1.0 . 5.50 1466 1314 A 2 THR HG2% A 3 ARG HBx 1.0 . 4.94 1467 1314 A 2 THR HG2% A 3 ARG HBy 1.0 . 4.94 1468 1315 A 2 THR HG2% A 5 GLU HBx 1.0 . 4.24 1469 1315 A 2 THR HG2% A 5 GLU HBy 1.0 . 4.24 1470 1316 A 3 ARG H A 3 ARG HBx 1.0 . 3.45 1471 1316 A 3 ARG H A 3 ARG HBy 1.0 . 3.45 1472 1317 A 3 ARG H A 3 ARG HDy 1.0 . 4.97 1473 1317 A 3 ARG H A 3 ARG HDx 1.0 . 4.97 1474 1318 A 3 ARG HA A 3 ARG HDy 1.0 . 4.71 1475 1318 A 3 ARG HA A 3 ARG HDx 1.0 . 4.71 1476 1319 A 4 GLU H A 3 ARG HBx 1.0 . 3.92 1477 1319 A 4 GLU H A 3 ARG HBy 1.0 . 3.92 1478 1320 A 7 LEU H A 3 ARG HBx 1.0 . 5.18 1479 1320 A 7 LEU H A 3 ARG HBy 1.0 . 5.18 1480 1321 A 76 VAL HGx% A 3 ARG HBx 1.0 . 3.86 1481 1321 A 76 VAL HGx% A 3 ARG HBy 1.0 . 3.86 1482 1322 A 76 VAL HGy% A 3 ARG HBx 1.0 . 3.29 1483 1322 A 76 VAL HGy% A 3 ARG HBy 1.0 . 3.29 1484 1323 A 4 GLU H A 3 ARG HDy 1.0 . 5.19 1485 1323 A 4 GLU H A 3 ARG HDx 1.0 . 5.19 1486 1324 A 76 VAL HGx% A 3 ARG HDy 1.0 . 4.32 1487 1324 A 76 VAL HGx% A 3 ARG HDx 1.0 . 4.32 1488 1325 A 4 GLU H A 4 GLU HBx 1.0 . 3.22 1489 1325 A 4 GLU H A 4 GLU HBy 1.0 . 3.22 1490 1326 A 4 GLU H A 7 LEU HBx 1.0 . 5.35 1491 1326 A 4 GLU H A 7 LEU HBy 1.0 . 5.35 1492 1327 A 4 GLU H A 7 LEU HDx% 1.0 . 5.92 1493 1327 A 4 GLU H A 7 LEU HDy% 1.0 . 5.92 1494 1328 A 4 GLU HA A 7 LEU HBx 1.0 . 3.93 1495 1328 A 4 GLU HA A 7 LEU HBy 1.0 . 3.93 1496 1329 A 5 GLU H A 4 GLU HBx 1.0 . 4.01 1497 1329 A 5 GLU H A 4 GLU HBy 1.0 . 4.01 1498 1330 A 5 GLU HA A 4 GLU HBx 1.0 . 4.07 1499 1330 A 5 GLU HA A 4 GLU HBy 1.0 . 4.07 1500 1331 A 5 GLU H A 7 LEU HBx 1.0 . 5.46 1501 1331 A 5 GLU H A 7 LEU HBy 1.0 . 5.46 1502 1332 A 6 VAL H A 5 GLU HBx 1.0 . 3.58 1503 1332 A 6 VAL H A 5 GLU HBy 1.0 . 3.58 1504 1333 A 7 LEU H A 5 GLU HBx 1.0 . 5.24 1505 1333 A 7 LEU H A 5 GLU HBy 1.0 . 5.24 1506 1334 A 6 VAL H A 6 VAL HGy% 1.0 . 3.64 1507 1334 A 6 VAL H A 6 VAL HGx% 1.0 . 3.64 1508 1335 A 6 VAL HA A 7 LEU HBx 1.0 . 5.81 1509 1335 A 6 VAL HA A 7 LEU HBy 1.0 . 5.81 1510 1336 A 7 LEU H A 6 VAL HGy% 1.0 . 4.10 1511 1336 A 7 LEU H A 6 VAL HGx% 1.0 . 4.10 1512 1337 A 7 LEU HA A 6 VAL HGy% 1.0 . 5.56 1513 1337 A 7 LEU HA A 6 VAL HGx% 1.0 . 5.56 1514 1338 A 8 GLN H A 6 VAL HGy% 1.0 . 5.21 1515 1338 A 8 GLN H A 6 VAL HGx% 1.0 . 5.21 1516 1339 A 9 LYS H A 6 VAL HGy% 1.0 . 5.50 1517 1339 A 9 LYS H A 6 VAL HGx% 1.0 . 5.50 1518 1340 A 9 LYS HBy A 6 VAL HGy% 1.0 . 5.63 1519 1340 A 9 LYS HBy A 6 VAL HGx% 1.0 . 5.63 1520 1341 A 10 VAL H A 6 VAL HGy% 1.0 . 5.92 1521 1341 A 10 VAL H A 6 VAL HGx% 1.0 . 5.92 1522 1342 A 53 PHE HE% A 6 VAL HGy% 1.0 . 5.02 1523 1342 A 53 PHE HE% A 6 VAL HGx% 1.0 . 5.02 1524 1343 A 72 VAL HA A 6 VAL HGy% 1.0 . 3.63 1525 1343 A 72 VAL HA A 6 VAL HGx% 1.0 . 3.63 1526 1344 A 72 VAL HB A 6 VAL HGy% 1.0 . 4.17 1527 1344 A 72 VAL HB A 6 VAL HGx% 1.0 . 4.17 1528 1345 A 75 ILE H A 6 VAL HGy% 1.0 . 4.67 1529 1345 A 75 ILE H A 6 VAL HGx% 1.0 . 4.67 1530 1346 A 75 ILE HB A 6 VAL HGy% 1.0 . 4.05 1531 1346 A 75 ILE HB A 6 VAL HGx% 1.0 . 4.05 1532 1347 A 76 VAL H A 6 VAL HGy% 1.0 . 5.00 1533 1347 A 76 VAL H A 6 VAL HGx% 1.0 . 5.00 1534 1348 A 7 LEU H A 7 LEU HDx% 1.0 . 4.15 1535 1348 A 7 LEU H A 7 LEU HDy% 1.0 . 4.15 1536 1349 A 7 LEU H A 72 VAL HGy% 1.0 . 3.89 1537 1349 A 7 LEU H A 72 VAL HG11 1.0 . 3.89 1538 1350 A 7 LEU HA A 7 LEU HDx% 1.0 . 4.27 1539 1350 A 7 LEU HA A 7 LEU HDy% 1.0 . 4.27 1540 1351 A 7 LEU HA A 72 VAL HGy% 1.0 . 3.95 1541 1351 A 7 LEU HA A 72 VAL HG11 1.0 . 3.95 1542 1352 A 8 GLN H A 7 LEU HBx 1.0 . 3.60 1543 1352 A 8 GLN H A 7 LEU HBy 1.0 . 3.60 1544 1353 A 7 LEU HBx A 8 GLN HGx 1.0 . 5.37 1545 1353 A 7 LEU HBy A 8 GLN HGx 1.0 . 5.37 1546 1353 A 8 GLN HGy A 7 LEU HBx 1.0 . 5.37 1547 1353 A 8 GLN HGy A 7 LEU HBy 1.0 . 5.37 1548 1354 A 10 VAL HB A 7 LEU HBx 1.0 . 5.81 1549 1354 A 10 VAL HB A 7 LEU HBy 1.0 . 5.81 1550 1355 A 7 LEU HBy A 72 VAL HGy% 1.0 . 3.83 1551 1355 A 7 LEU HBx A 72 VAL HGy% 1.0 . 3.83 1552 1355 A 72 VAL HG11 A 7 LEU HBx 1.0 . 3.83 1553 1355 A 7 LEU HBy A 72 VAL HG11 1.0 . 3.83 1554 1356 A 8 GLN H A 7 LEU HDx% 1.0 . 4.62 1555 1356 A 8 GLN H A 7 LEU HDy% 1.0 . 4.62 1556 1357 A 11 ALA HB% A 7 LEU HDx% 1.0 . 4.06 1557 1357 A 11 ALA HB% A 7 LEU HDy% 1.0 . 4.06 1558 1358 A 9 LYS HGy A 13 ILE HG1x 1.0 . 3.71 1559 1358 A 9 LYS HGx A 13 ILE HG1x 1.0 . 3.71 1560 1358 A 13 ILE HG1y A 9 LYS HGx 1.0 . 3.71 1561 1358 A 9 LYS HGy A 13 ILE HG1y 1.0 . 3.71 1562 1359 A 10 VAL HA A 13 ILE HG1x 1.0 . 5.74 1563 1359 A 10 VAL HA A 13 ILE HG1y 1.0 . 5.74 1564 1360 A 11 ALA HB% A 25 VAL HGy% 1.0 . 4.28 1565 1360 A 11 ALA HB% A 25 VAL HG11 1.0 . 4.28 1566 1361 A 12 LYS H A 12 LYS HGy 1.0 . 4.40 1567 1361 A 12 LYS H A 12 LYS HGx 1.0 . 4.40 1568 1362 A 12 LYS HA A 12 LYS HGy 1.0 . 3.52 1569 1362 A 12 LYS HA A 12 LYS HGx 1.0 . 3.52 1570 1363 A 13 ILE H A 12 LYS HGy 1.0 . 4.42 1571 1363 A 13 ILE H A 12 LYS HGx 1.0 . 4.42 1572 1364 A 14 ILE H A 12 LYS HGy 1.0 . 5.81 1573 1364 A 14 ILE H A 12 LYS HGx 1.0 . 5.81 1574 1365 A 15 SER H A 12 LYS HGy 1.0 . 5.81 1575 1365 A 15 SER H A 12 LYS HGx 1.0 . 5.81 1576 1366 A 13 ILE H A 13 ILE HG1x 1.0 . 3.64 1577 1366 A 13 ILE H A 13 ILE HG1y 1.0 . 3.64 1578 1367 A 13 ILE HA A 16 ASN HBy 1.0 . 4.78 1579 1367 A 13 ILE HA A 16 ASN HBx 1.0 . 4.78 1580 1368 A 14 ILE H A 13 ILE HG1x 1.0 . 5.07 1581 1368 A 14 ILE H A 13 ILE HG1y 1.0 . 5.07 1582 1369 A 14 ILE HG2% A 18 PHE HBx 1.0 . 4.97 1583 1369 A 14 ILE HG2% A 18 PHE HBy 1.0 . 4.97 1584 1370 A 15 SER H A 15 SER HBy 1.0 . 3.24 1585 1370 A 15 SER H A 15 SER HBx 1.0 . 3.24 1586 1371 A 22 ALA H A 15 SER HBy 1.0 . 3.85 1587 1371 A 22 ALA H A 15 SER HBx 1.0 . 3.85 1588 1372 A 22 ALA HB% A 15 SER HBy 1.0 . 4.19 1589 1372 A 22 ALA HB% A 15 SER HBx 1.0 . 4.19 1590 1373 A 25 VAL HG11 A 15 SER HBy 1.0 . 4.41 1591 1373 A 25 VAL HG11 A 15 SER HBx 1.0 . 4.41 1592 1374 A 16 ASN H A 16 ASN HBy 1.0 . 3.70 1593 1374 A 16 ASN H A 16 ASN HBx 1.0 . 3.70 1594 1375 A 16 ASN H A 16 ASN HD2y 1.0 . 3.90 1595 1375 A 16 ASN H A 16 ASN HD2x 1.0 . 3.90 1596 1376 A 16 ASN HD2y A 16 ASN HBy 1.0 . 3.15 1597 1376 A 16 ASN HD2x A 16 ASN HBy 1.0 . 3.15 1598 1376 A 16 ASN HD2y A 16 ASN HBx 1.0 . 3.15 1599 1376 A 16 ASN HD2x A 16 ASN HBx 1.0 . 3.15 1600 1377 A 17 HIS H A 16 ASN HBy 1.0 . 4.33 1601 1377 A 17 HIS H A 16 ASN HBx 1.0 . 4.33 1602 1378 A 17 HIS H A 16 ASN HD2y 1.0 . 5.07 1603 1378 A 17 HIS H A 16 ASN HD2x 1.0 . 5.07 1604 1379 A 18 PHE H A 18 PHE HBx 1.0 . 3.66 1605 1379 A 18 PHE H A 18 PHE HBy 1.0 . 3.66 1606 1380 A 18 PHE HA A 19 ASP HBx 1.0 . 5.19 1607 1380 A 18 PHE HA A 19 ASP HBy 1.0 . 5.19 1608 1381 A 19 ASP H A 18 PHE HBx 1.0 . 3.34 1609 1381 A 19 ASP H A 18 PHE HBy 1.0 . 3.34 1610 1382 A 19 ASP HA A 18 PHE HBx 1.0 . 4.83 1611 1382 A 19 ASP HA A 18 PHE HBy 1.0 . 4.83 1612 1383 A 20 ILE H A 18 PHE HBx 1.0 . 4.14 1613 1383 A 20 ILE H A 18 PHE HBy 1.0 . 4.14 1614 1384 A 20 ILE HG2% A 18 PHE HBx 1.0 . 4.21 1615 1384 A 20 ILE HG2% A 18 PHE HBy 1.0 . 4.21 1616 1385 A 31 ILE HG1y A 18 PHE HBx 1.0 . 5.60 1617 1385 A 31 ILE HG1y A 18 PHE HBy 1.0 . 5.60 1618 1386 A 35 LEU HBy A 18 PHE HBx 1.0 . 5.18 1619 1386 A 35 LEU HBy A 18 PHE HBy 1.0 . 5.18 1620 1387 A 35 LEU HD21 A 18 PHE HBx 1.0 . 4.46 1621 1387 A 35 LEU HD21 A 18 PHE HBy 1.0 . 4.46 1622 1388 A 19 ASP H A 19 ASP HBx 1.0 . 3.45 1623 1388 A 19 ASP H A 19 ASP HBy 1.0 . 3.45 1624 1389 A 20 ILE H A 19 ASP HBx 1.0 . 4.39 1625 1389 A 20 ILE H A 19 ASP HBy 1.0 . 4.39 1626 1390 A 20 ILE HG1y A 24 GLN HBy 1.0 . 4.50 1627 1390 A 20 ILE HG1y A 24 GLN HBx 1.0 . 4.50 1628 1391 A 20 ILE HD1% A 24 GLN HBy 1.0 . 4.17 1629 1391 A 20 ILE HD1% A 24 GLN HBx 1.0 . 4.17 1630 1392 A 21 GLU H A 24 GLN HBy 1.0 . 4.06 1631 1392 A 21 GLU H A 24 GLN HBx 1.0 . 4.06 1632 1393 A 22 ALA HB% A 25 VAL HGy% 1.0 . 5.56 1633 1393 A 22 ALA HB% A 25 VAL HG11 1.0 . 5.56 1634 1394 A 24 GLN H A 23 ASP HBy 1.0 . 4.39 1635 1394 A 24 GLN H A 23 ASP HBx 1.0 . 4.39 1636 1395 A 24 GLN H A 24 GLN HBy 1.0 . 3.33 1637 1395 A 24 GLN H A 24 GLN HBx 1.0 . 3.33 1638 1396 A 24 GLN HBx A 24 GLN HGx 1.0 . 2.31 1639 1396 A 24 GLN HBy A 24 GLN HGx 1.0 . 2.31 1640 1396 A 24 GLN HGy A 24 GLN HBy 1.0 . 2.31 1641 1396 A 24 GLN HGy A 24 GLN HBx 1.0 . 2.31 1642 1397 A 25 VAL H A 24 GLN HBy 1.0 . 3.56 1643 1397 A 25 VAL H A 24 GLN HBx 1.0 . 3.56 1644 1398 A 27 ASP HA A 69 GLY HAx 1.0 . 4.44 1645 1398 A 27 ASP HA A 69 GLY HAy 1.0 . 4.44 1646 1399 A 27 ASP HBx A 69 GLY HAx 1.0 . 4.01 1647 1399 A 27 ASP HBy A 69 GLY HAx 1.0 . 4.01 1648 1399 A 69 GLY HAy A 27 ASP HBx 1.0 . 4.01 1649 1399 A 27 ASP HBy A 69 GLY HAy 1.0 . 4.01 1650 1400 A 29 LEU HBx A 34 ASP HBx 1.0 . 5.18 1651 1400 A 29 LEU HBx A 34 ASP HBy 1.0 . 5.18 1652 1401 A 30 ASN H A 30 ASN HD2y 1.0 . 5.81 1653 1401 A 30 ASN H A 30 ASN HD2x 1.0 . 5.81 1654 1402 A 30 ASN H A 34 ASP HBx 1.0 . 4.55 1655 1402 A 30 ASN H A 34 ASP HBy 1.0 . 4.55 1656 1403 A 30 ASN HA A 33 ASP HBx 1.0 . 5.81 1657 1403 A 30 ASN HA A 33 ASP HBy 1.0 . 5.81 1658 1404 A 30 ASN HBy A 30 ASN HD2y 1.0 . 3.53 1659 1404 A 30 ASN HBy A 30 ASN HD2x 1.0 . 3.53 1660 1405 A 30 ASN HBx A 33 ASP HBx 1.0 . 4.27 1661 1405 A 30 ASN HBx A 33 ASP HBy 1.0 . 4.27 1662 1406 A 31 ILE H A 30 ASN HD2y 1.0 . 5.37 1663 1406 A 31 ILE H A 30 ASN HD2x 1.0 . 5.37 1664 1407 A 31 ILE HB A 30 ASN HD2y 1.0 . 5.81 1665 1407 A 31 ILE HB A 30 ASN HD2x 1.0 . 5.81 1666 1408 A 67 THR H A 30 ASN HD2y 1.0 . 5.30 1667 1408 A 67 THR H A 30 ASN HD2x 1.0 . 5.30 1668 1409 A 67 THR HA A 30 ASN HD2y 1.0 . 5.42 1669 1409 A 67 THR HA A 30 ASN HD2x 1.0 . 5.42 1670 1410 A 67 THR HG2% A 30 ASN HD2y 1.0 . 4.02 1671 1410 A 67 THR HG2% A 30 ASN HD2x 1.0 . 4.02 1672 1411 A 31 ILE H A 34 ASP HBx 1.0 . 5.25 1673 1411 A 31 ILE H A 34 ASP HBy 1.0 . 5.25 1674 1412 A 31 ILE HG1y A 34 ASP HBx 1.0 . 5.81 1675 1412 A 31 ILE HG1y A 34 ASP HBy 1.0 . 5.81 1676 1413 A 32 LYS H A 33 ASP HBx 1.0 . 5.81 1677 1413 A 32 LYS H A 33 ASP HBy 1.0 . 5.81 1678 1414 A 34 ASP H A 33 ASP HBx 1.0 . 3.71 1679 1414 A 34 ASP H A 33 ASP HBy 1.0 . 3.71 1680 1415 A 34 ASP H A 34 ASP HBx 1.0 . 3.50 1681 1415 A 34 ASP H A 34 ASP HBy 1.0 . 3.50 1682 1416 A 35 LEU H A 34 ASP HBx 1.0 . 4.16 1683 1416 A 35 LEU H A 34 ASP HBy 1.0 . 4.16 1684 1417 A 35 LEU HBy A 34 ASP HBx 1.0 . 4.31 1685 1417 A 35 LEU HBy A 34 ASP HBy 1.0 . 4.31 1686 1418 A 35 LEU HD21 A 34 ASP HBx 1.0 . 4.50 1687 1418 A 35 LEU HD21 A 34 ASP HBy 1.0 . 4.50 1688 1419 A 38 ASP H A 38 ASP HBx 1.0 . 3.65 1689 1419 A 38 ASP H A 38 ASP HBy 1.0 . 3.65 1690 1420 A 39 SER H A 38 ASP HBx 1.0 . 3.31 1691 1420 A 39 SER H A 38 ASP HBy 1.0 . 3.31 1692 1421 A 40 ILE H A 38 ASP HBx 1.0 . 4.72 1693 1421 A 40 ILE H A 38 ASP HBy 1.0 . 4.72 1694 1422 A 39 SER H A 40 ILE HG1x 1.0 . 5.81 1695 1422 A 39 SER H A 40 ILE HG1y 1.0 . 5.81 1696 1423 A 40 ILE H A 40 ILE HG1x 1.0 . 3.66 1697 1423 A 40 ILE H A 40 ILE HG1y 1.0 . 3.66 1698 1424 A 40 ILE HA A 40 ILE HG1x 1.0 . 3.65 1699 1424 A 40 ILE HA A 40 ILE HG1y 1.0 . 3.65 1700 1425 A 41 SER H A 40 ILE HG1x 1.0 . 5.14 1701 1425 A 41 SER H A 40 ILE HG1y 1.0 . 5.14 1702 1426 A 43 MET HBy A 40 ILE HG1x 1.0 . 5.81 1703 1426 A 40 ILE HG1y A 43 MET HBy 1.0 . 5.81 1704 1427 A 42 VAL H A 42 VAL HGx% 1.0 . 4.14 1705 1427 A 42 VAL H A 42 VAL HG21 1.0 . 4.14 1706 1428 A 43 MET H A 42 VAL HGx% 1.0 . 4.50 1707 1428 A 43 MET H A 42 VAL HG21 1.0 . 4.50 1708 1429 A 43 MET HA A 42 VAL HGx% 1.0 . 4.96 1709 1429 A 43 MET HA A 42 VAL HG21 1.0 . 4.96 1710 1430 A 45 PHE H A 42 VAL HGx% 1.0 . 5.20 1711 1430 A 45 PHE H A 42 VAL HG21 1.0 . 5.20 1712 1431 A 45 PHE HBy A 42 VAL HGx% 1.0 . 3.47 1713 1431 A 45 PHE HBy A 42 VAL HG21 1.0 . 3.47 1714 1432 A 45 PHE HBx A 42 VAL HGx% 1.0 . 5.63 1715 1432 A 45 PHE HBx A 42 VAL HG21 1.0 . 5.63 1716 1433 A 62 ALA H A 42 VAL HGx% 1.0 . 5.92 1717 1433 A 62 ALA H A 42 VAL HG21 1.0 . 5.92 1718 1434 A 63 GLU H A 42 VAL HGx% 1.0 . 5.92 1719 1434 A 63 GLU H A 42 VAL HG21 1.0 . 5.92 1720 1435 A 43 MET HGx A 47 LEU HDx% 1.0 . 4.37 1721 1435 A 47 LEU HD21 A 43 MET HGx 1.0 . 4.37 1722 1435 A 43 MET HGy A 47 LEU HD21 1.0 . 4.37 1723 1435 A 43 MET HGy A 47 LEU HDx% 1.0 . 4.37 1724 1436 A 47 LEU H A 47 LEU HDx% 1.0 . 4.63 1725 1436 A 47 LEU H A 47 LEU HD21 1.0 . 4.63 1726 1437 A 47 LEU HA A 47 LEU HDx% 1.0 . 3.46 1727 1437 A 47 LEU HA A 47 LEU HD21 1.0 . 3.46 1728 1438 A 47 LEU HA A 51 ASP HBx 1.0 . 4.88 1729 1438 A 47 LEU HA A 51 ASP HBy 1.0 . 4.88 1730 1439 A 48 GLU H A 47 LEU HDx% 1.0 . 5.28 1731 1439 A 48 GLU H A 47 LEU HD21 1.0 . 5.28 1732 1440 A 48 GLU HA A 51 ASP HBx 1.0 . 3.99 1733 1440 A 48 GLU HA A 51 ASP HBy 1.0 . 3.99 1734 1441 A 49 LEU HA A 52 GLU HBx 1.0 . 5.08 1735 1441 A 49 LEU HA A 52 GLU HBy 1.0 . 5.08 1736 1442 A 50 GLU HA A 51 ASP HBx 1.0 . 5.81 1737 1442 A 50 GLU HA A 51 ASP HBy 1.0 . 5.81 1738 1443 A 52 GLU H A 51 ASP HBx 1.0 . 3.75 1739 1443 A 52 GLU H A 51 ASP HBy 1.0 . 3.75 1740 1444 A 52 GLU HA A 51 ASP HBx 1.0 . 5.81 1741 1444 A 51 ASP HBy A 52 GLU HA 1.0 . 5.81 1742 1445 A 51 ASP HBy A 52 GLU HBx 1.0 . 5.17 1743 1445 A 51 ASP HBx A 52 GLU HBx 1.0 . 5.17 1744 1445 A 52 GLU HBy A 51 ASP HBx 1.0 . 5.17 1745 1445 A 51 ASP HBy A 52 GLU HBy 1.0 . 5.17 1746 1446 A 52 GLU H A 52 GLU HBx 1.0 . 3.65 1747 1446 A 52 GLU H A 52 GLU HBy 1.0 . 3.65 1748 1447 A 53 PHE H A 52 GLU HBx 1.0 . 3.96 1749 1447 A 53 PHE H A 52 GLU HBy 1.0 . 3.96 1750 1448 A 53 PHE HE% A 52 GLU HBx 1.0 . 5.12 1751 1448 A 53 PHE HE% A 52 GLU HBy 1.0 . 5.12 1752 1449 A 54 GLY H A 52 GLU HBx 1.0 . 5.28 1753 1449 A 54 GLY H A 52 GLU HBy 1.0 . 5.28 1754 1450 A 53 PHE HA A 54 GLY HAx 1.0 . 5.81 1755 1450 A 53 PHE HA A 54 GLY HAy 1.0 . 5.81 1756 1451 A 53 PHE HBx A 54 GLY HAx 1.0 . 5.81 1757 1451 A 53 PHE HBx A 54 GLY HAy 1.0 . 5.81 1758 1452 A 53 PHE HE% A 75 ILE HG1x 1.0 . 4.77 1759 1452 A 53 PHE HE% A 75 ILE HG1y 1.0 . 4.77 1760 1453 A 53 PHE HZ A 75 ILE HG1x 1.0 . 5.81 1761 1453 A 53 PHE HZ A 75 ILE HG1y 1.0 . 5.81 1762 1454 A 55 THR HA A 54 GLY HAx 1.0 . 5.25 1763 1454 A 55 THR HA A 54 GLY HAy 1.0 . 5.25 1764 1455 A 58 SER H A 58 SER HBy 1.0 . 3.50 1765 1455 A 58 SER H A 58 SER HBx 1.0 . 3.50 1766 1456 A 58 SER H A 61 ASP HBx 1.0 . 4.35 1767 1456 A 58 SER H A 61 ASP HBy 1.0 . 4.35 1768 1457 A 59 ASP H A 58 SER HBy 1.0 . 3.49 1769 1457 A 59 ASP H A 58 SER HBx 1.0 . 3.49 1770 1458 A 60 GLU H A 58 SER HBy 1.0 . 4.32 1771 1458 A 60 GLU H A 58 SER HBx 1.0 . 4.32 1772 1459 A 61 ASP H A 58 SER HBy 1.0 . 3.67 1773 1459 A 61 ASP H A 58 SER HBx 1.0 . 3.67 1774 1460 A 59 ASP H A 59 ASP HBx 1.0 . 3.49 1775 1460 A 59 ASP H A 59 ASP HBy 1.0 . 3.49 1776 1461 A 60 GLU H A 59 ASP HBx 1.0 . 3.69 1777 1461 A 60 GLU H A 59 ASP HBy 1.0 . 3.69 1778 1462 A 61 ASP H A 61 ASP HBx 1.0 . 3.57 1779 1462 A 61 ASP H A 61 ASP HBy 1.0 . 3.57 1780 1463 A 62 ALA H A 61 ASP HBx 1.0 . 3.88 1781 1463 A 62 ALA H A 61 ASP HBy 1.0 . 3.88 1782 1464 A 62 ALA HA A 61 ASP HBx 1.0 . 5.27 1783 1464 A 62 ALA HA A 61 ASP HBy 1.0 . 5.27 1784 1465 A 62 ALA HB% A 61 ASP HBx 1.0 . 4.58 1785 1465 A 62 ALA HB% A 61 ASP HBy 1.0 . 4.58 1786 1466 A 63 GLU H A 61 ASP HBx 1.0 . 5.58 1787 1466 A 63 GLU H A 61 ASP HBy 1.0 . 5.58 1788 1467 A 65 ILE HD1% A 61 ASP HBx 1.0 . 4.87 1789 1467 A 65 ILE HD1% A 61 ASP HBy 1.0 . 4.87 1790 1468 A 62 ALA H A 64 LYS HGy 1.0 . 5.00 1791 1468 A 62 ALA H A 64 LYS HGx 1.0 . 5.00 1792 1469 A 63 GLU H A 64 LYS HGy 1.0 . 4.99 1793 1469 A 63 GLU H A 64 LYS HGx 1.0 . 4.99 1794 1470 A 64 LYS H A 64 LYS HBy 1.0 . 3.56 1795 1470 A 64 LYS H A 64 LYS HBx 1.0 . 3.56 1796 1471 A 64 LYS H A 64 LYS HGy 1.0 . 3.68 1797 1471 A 64 LYS H A 64 LYS HGx 1.0 . 3.68 1798 1472 A 64 LYS HA A 64 LYS HGy 1.0 . 3.59 1799 1472 A 64 LYS HA A 64 LYS HGx 1.0 . 3.59 1800 1473 A 65 ILE H A 64 LYS HBy 1.0 . 4.23 1801 1473 A 65 ILE H A 64 LYS HBx 1.0 . 4.23 1802 1474 A 65 ILE H A 64 LYS HGy 1.0 . 4.86 1803 1474 A 65 ILE H A 64 LYS HGx 1.0 . 4.86 1804 1475 A 65 ILE HG2% A 74 TYR HBx 1.0 . 2.28 1805 1475 A 65 ILE HG2% A 74 TYR HBy 1.0 . 2.28 1806 1476 A 65 ILE HG1y A 74 TYR HBx 1.0 . 4.74 1807 1476 A 65 ILE HG1y A 74 TYR HBy 1.0 . 4.74 1808 1477 A 68 VAL HA A 69 GLY HAx 1.0 . 4.90 1809 1477 A 68 VAL HA A 69 GLY HAy 1.0 . 4.90 1810 1478 A 68 VAL HGx% A 69 GLY HAx 1.0 . 5.00 1811 1478 A 68 VAL HGx% A 69 GLY HAy 1.0 . 5.00 1812 1479 A 71 ALA H A 69 GLY HAx 1.0 . 5.76 1813 1479 A 71 ALA H A 69 GLY HAy 1.0 . 5.76 1814 1480 A 71 ALA HB% A 69 GLY HAx 1.0 . 5.81 1815 1480 A 71 ALA HB% A 69 GLY HAy 1.0 . 5.81 1816 1481 A 72 VAL H A 69 GLY HAx 1.0 . 4.68 1817 1481 A 72 VAL H A 69 GLY HAy 1.0 . 4.68 1818 1482 A 72 VAL HB A 69 GLY HAx 1.0 . 4.44 1819 1482 A 72 VAL HB A 69 GLY HAy 1.0 . 4.44 1820 1483 A 72 VAL HG11 A 69 GLY HAy 1.0 . 3.87 1821 1483 A 72 VAL HG11 A 69 GLY HAx 1.0 . 3.87 1822 1484 A 73 ASP H A 69 GLY HAx 1.0 . 4.23 1823 1484 A 73 ASP H A 69 GLY HAy 1.0 . 4.23 1824 1485 A 71 ALA HA A 74 TYR HBx 1.0 . 4.55 1825 1485 A 71 ALA HA A 74 TYR HBy 1.0 . 4.55 1826 1486 A 71 ALA HB% A 74 TYR HBx 1.0 . 5.66 1827 1486 A 71 ALA HB% A 74 TYR HBy 1.0 . 5.66 1828 1487 A 72 VAL HA A 75 ILE HG1x 1.0 . 4.41 1829 1487 A 72 VAL HA A 75 ILE HG1y 1.0 . 4.41 1830 1488 A 73 ASP H A 72 VAL HGy% 1.0 . 3.76 1831 1488 A 73 ASP H A 72 VAL HG11 1.0 . 3.76 1832 1489 A 73 ASP HA A 72 VAL HGy% 1.0 . 4.64 1833 1489 A 73 ASP HA A 72 VAL HG11 1.0 . 4.64 1834 1490 A 73 ASP HBy A 72 VAL HGy% 1.0 . 4.85 1835 1490 A 73 ASP HBy A 72 VAL HG11 1.0 . 4.85 1836 1491 A 75 ILE HB A 72 VAL HGy% 1.0 . 3.80 1837 1491 A 75 ILE HB A 72 VAL HG11 1.0 . 3.80 1838 1492 A 76 VAL H A 72 VAL HGy% 1.0 . 5.35 1839 1492 A 76 VAL H A 72 VAL HG11 1.0 . 5.35 1840 1493 A 76 VAL HA A 72 VAL HGy% 1.0 . 4.82 1841 1493 A 76 VAL HA A 72 VAL HG11 1.0 . 4.82 1842 1494 A 77 SER H A 72 VAL HGy% 1.0 . 5.26 1843 1494 A 77 SER H A 72 VAL HG11 1.0 . 5.26 1844 1495 A 73 ASP H A 74 TYR HBx 1.0 . 4.63 1845 1495 A 73 ASP H A 74 TYR HBy 1.0 . 4.63 1846 1496 A 74 TYR HA A 78 ASN HBx 1.0 . 4.29 1847 1496 A 74 TYR HA A 78 ASN HBy 1.0 . 4.29 1848 1497 A 74 TYR HDx A 74 TYR HBx 1.0 . 3.19 1849 1497 A 74 TYR HDx A 74 TYR HBy 1.0 . 3.19 1850 1498 A 76 VAL H A 74 TYR HBx 1.0 . 5.76 1851 1498 A 76 VAL H A 74 TYR HBy 1.0 . 5.76 1852 1499 A 74 TYR HDx A 75 ILE HG1x 1.0 . 4.21 1853 1499 A 74 TYR HDx A 75 ILE HG1y 1.0 . 4.21 1854 1500 A 74 TYR HDx A 78 ASN HBx 1.0 . 5.46 1855 1500 A 74 TYR HDx A 78 ASN HBy 1.0 . 5.46 1856 1501 A 74 TYR HEx A 78 ASN HBx 1.0 . 5.66 1857 1501 A 74 TYR HEx A 78 ASN HBy 1.0 . 5.66 1858 1502 A 74 TYR HEy A 78 ASN HBx 1.0 . 5.67 1859 1502 A 74 TYR HEy A 78 ASN HBy 1.0 . 5.67 1860 1503 A 74 TYR HDy A 78 ASN HBx 1.0 . 5.81 1861 1503 A 74 TYR HDy A 78 ASN HBy 1.0 . 5.81 1862 1504 A 75 ILE HA A 78 ASN HBx 1.0 . 4.90 1863 1504 A 75 ILE HA A 78 ASN HBy 1.0 . 4.90 1864 1505 A 76 VAL H A 75 ILE HG1x 1.0 . 4.89 1865 1505 A 76 VAL H A 75 ILE HG1y 1.0 . 4.89 1866 1506 A 76 VAL H A 78 ASN HBx 1.0 . 5.81 1867 1506 A 76 VAL H A 78 ASN HBy 1.0 . 5.81 1868 1507 A 77 SER H A 78 ASN HBx 1.0 . 5.06 1869 1507 A 77 SER H A 78 ASN HBy 1.0 . 5.06 1870 1508 A 77 SER HBy A 78 ASN HBx 1.0 . 5.81 1871 1508 A 77 SER HBx A 78 ASN HBx 1.0 . 5.81 1872 1508 A 78 ASN HBy A 77 SER HBx 1.0 . 5.81 1873 1508 A 77 SER HBy A 78 ASN HBy 1.0 . 5.81 1874 1509 A 78 ASN H A 78 ASN HBx 1.0 . 3.53 1875 1509 A 78 ASN H A 78 ASN HBy 1.0 . 3.53 stop_ save_