data_nef_c25037_2mqk save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2MQK 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 GLY start . false 2 A 0 PRO middle . false 3 A 1 MET middle . . 4 A 2 ASN middle . . 5 A 3 ILE middle . . 6 A 4 SER middle . . 7 A 5 ASP middle . . 8 A 6 ILE middle . . 9 A 7 ARG middle . . 10 A 8 ALA middle . . 11 A 9 GLY middle . false 12 A 10 LEU middle . . 13 A 11 ARG middle . . 14 A 12 THR middle . . 15 A 13 LEU middle . . 16 A 14 VAL middle . . 17 A 15 GLU middle . . 18 A 16 ASN middle . . 19 A 17 GLU middle . . 20 A 18 GLU middle . . 21 A 19 THR middle . . 22 A 20 THR middle . . 23 A 21 PHE middle . . 24 A 22 LYS middle . . 25 A 23 GLN middle . . 26 A 24 ILE middle . . 27 A 25 ALA middle . . 28 A 26 LEU middle . . 29 A 27 GLU middle . . 30 A 28 SER middle . . 31 A 29 GLY middle . false 32 A 30 LEU middle . . 33 A 31 SER middle . . 34 A 32 THR middle . . 35 A 33 GLY middle . false 36 A 34 THR middle . . 37 A 35 ILE middle . . 38 A 36 SER middle . . 39 A 37 SER middle . . 40 A 38 PHE middle . . 41 A 39 ILE middle . . 42 A 40 ASN middle . . 43 A 41 ASP middle . . 44 A 42 LYS middle . . 45 A 43 TYR middle . . 46 A 44 ASN middle . . 47 A 45 GLY middle . false 48 A 46 ASP middle . . 49 A 47 ASN middle . . 50 A 48 GLU middle . . 51 A 49 ARG middle . . 52 A 50 VAL middle . . 53 A 51 SER middle . . 54 A 52 GLN middle . . 55 A 53 THR middle . . 56 A 54 LEU middle . . 57 A 55 GLN middle . . 58 A 56 ARG middle . . 59 A 57 TRP middle . . 60 A 58 LEU middle . . 61 A 59 GLU middle . . 62 A 60 LYS middle . . 63 A 61 TYR middle . . 64 A 62 HIS middle . . 65 A 63 ALA 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 GLY HA2 H 1 3.969 0.020 A -1 GLY HA3 H 1 3.969 0.020 A -1 GLY CA C 13 43.425 0.400 A 0 PRO HA H 1 4.556 0.020 A 0 PRO HBy H 1 2.343 0.020 A 0 PRO HBx H 1 1.967 0.020 A 0 PRO HD2 H 1 3.598 0.020 A 0 PRO HD3 H 1 3.598 0.020 A 0 PRO HG2 H 1 2.067 0.020 A 0 PRO HG3 H 1 2.067 0.020 A 0 PRO CA C 13 63.199 0.400 A 0 PRO CB C 13 32.310 0.400 A 0 PRO CD C 13 49.695 0.400 A 0 PRO CG C 13 27.223 0.400 A 1 MET H H 1 8.665 0.020 A 1 MET HA H 1 4.507 0.020 A 1 MET HBy H 1 2.069 0.020 A 1 MET HBx H 1 1.925 0.020 A 1 MET HE% H 1 2.093 0.020 A 1 MET HG2 H 1 2.611 0.020 A 1 MET HG3 H 1 2.611 0.020 A 1 MET CB C 13 34.854 0.400 A 1 MET CE C 13 17.048 0.400 A 1 MET CG C 13 32.519 0.400 A 1 MET N N 15 122.140 0.400 A 2 ASN H H 1 8.927 0.020 A 2 ASN HA H 1 4.807 0.020 A 2 ASN HB2 H 1 2.947 0.020 A 2 ASN HB3 H 1 2.947 0.020 A 2 ASN HD2y H 1 7.689 0.020 A 2 ASN HD2x H 1 6.977 0.020 A 2 ASN CB C 13 39.205 0.400 A 2 ASN N N 15 121.514 0.400 A 2 ASN ND2 N 15 113.453 0.400 A 3 ILE H H 1 8.721 0.020 A 3 ILE HA H 1 3.959 0.020 A 3 ILE HB H 1 1.990 0.020 A 3 ILE HD1% H 1 1.031 0.020 A 3 ILE HG1y H 1 1.989 0.020 A 3 ILE HG1x H 1 1.845 0.020 A 3 ILE HG2% H 1 1.030 0.020 A 3 ILE CA C 13 65.293 0.400 A 3 ILE CB C 13 38.104 0.400 A 3 ILE CD1 C 13 14.048 0.400 A 3 ILE CG1 C 13 29.636 0.400 A 3 ILE CG2 C 13 17.174 0.400 A 3 ILE N N 15 123.748 0.400 A 4 SER H H 1 8.386 0.020 A 4 SER HA H 1 4.147 0.020 A 4 SER HB2 H 1 3.949 0.020 A 4 SER HB3 H 1 3.949 0.020 A 4 SER CA C 13 61.528 0.400 A 4 SER CB C 13 62.284 0.400 A 4 SER N N 15 115.783 0.400 A 5 ASP H H 1 7.855 0.020 A 5 ASP HA H 1 4.623 0.020 A 5 ASP HBy H 1 2.917 0.020 A 5 ASP HBx H 1 2.763 0.020 A 5 ASP CB C 13 40.842 0.400 A 5 ASP N N 15 122.493 0.400 A 6 ILE H H 1 8.048 0.020 A 6 ILE HA H 1 3.797 0.020 A 6 ILE HB H 1 2.223 0.020 A 6 ILE HD1% H 1 0.988 0.020 A 6 ILE HG1y H 1 1.786 0.020 A 6 ILE HG1x H 1 1.150 0.020 A 6 ILE HG2% H 1 1.085 0.020 A 6 ILE CA C 13 64.772 0.400 A 6 ILE CB C 13 38.324 0.400 A 6 ILE CD1 C 13 14.073 0.400 A 6 ILE CG1 C 13 29.390 0.400 A 6 ILE CG2 C 13 17.665 0.400 A 6 ILE N N 15 123.982 0.400 A 7 ARG H H 1 8.285 0.020 A 7 ARG HA H 1 3.817 0.020 A 7 ARG HBy H 1 1.537 0.020 A 7 ARG HBx H 1 1.095 0.020 A 7 ARG HD2 H 1 3.074 0.020 A 7 ARG HD3 H 1 3.074 0.020 A 7 ARG HE H 1 6.182 0.020 A 7 ARG HGy H 1 1.855 0.020 A 7 ARG HGx H 1 1.791 0.020 A 7 ARG CA C 13 59.732 0.400 A 7 ARG CB C 13 30.047 0.400 A 7 ARG CD C 13 43.296 0.400 A 7 ARG CG C 13 27.752 0.400 A 7 ARG N N 15 118.105 0.400 A 7 ARG NE N 15 84.106 0.400 A 8 ALA H H 1 8.093 0.020 A 8 ALA HA H 1 4.123 0.020 A 8 ALA HB% H 1 1.564 0.020 A 8 ALA CA C 13 55.093 0.400 A 8 ALA CB C 13 18.553 0.400 A 8 ALA N N 15 118.807 0.400 A 9 GLY H H 1 8.358 0.020 A 9 GLY HAx H 1 3.829 0.020 A 9 GLY HAy H 1 3.951 0.020 A 9 GLY CA C 13 47.084 0.400 A 9 GLY N N 15 107.079 0.400 A 10 LEU H H 1 8.116 0.020 A 10 LEU HA H 1 4.130 0.020 A 10 LEU HBx H 1 1.407 0.020 A 10 LEU HBy H 1 2.071 0.020 A 10 LEU HDx% H 1 1.019 0.020 A 10 LEU HDy% H 1 0.954 0.020 A 10 LEU HG H 1 2.118 0.020 A 10 LEU CA C 13 57.979 0.400 A 10 LEU CB C 13 42.652 0.400 A 10 LEU CD1 C 13 28.090 0.400 A 10 LEU CD2 C 13 24.461 0.400 A 10 LEU CG C 13 27.522 0.400 A 10 LEU N N 15 121.077 0.400 A 11 ARG H H 1 8.472 0.020 A 11 ARG HA H 1 3.803 0.020 A 11 ARG HB2 H 1 1.985 0.020 A 11 ARG HB3 H 1 1.985 0.020 A 11 ARG HD2 H 1 3.226 0.020 A 11 ARG HD3 H 1 3.226 0.020 A 11 ARG HGy H 1 1.743 0.020 A 11 ARG HGx H 1 1.571 0.020 A 11 ARG CA C 13 60.425 0.400 A 11 ARG CB C 13 30.321 0.400 A 11 ARG CD C 13 43.461 0.400 A 11 ARG CG C 13 27.755 0.400 A 11 ARG N N 15 118.227 0.400 A 12 THR H H 1 8.180 0.020 A 12 THR HA H 1 3.965 0.020 A 12 THR HB H 1 4.232 0.020 A 12 THR HG2% H 1 1.299 0.020 A 12 THR CA C 13 66.730 0.400 A 12 THR CB C 13 69.178 0.400 A 12 THR CG2 C 13 21.682 0.400 A 12 THR N N 15 114.121 0.400 A 13 LEU H H 1 7.156 0.020 A 13 LEU HA H 1 4.100 0.020 A 13 LEU HBx H 1 1.160 0.020 A 13 LEU HBy H 1 1.917 0.020 A 13 LEU HDx% H 1 0.576 0.020 A 13 LEU HDy% H 1 0.750 0.020 A 13 LEU HG H 1 1.915 0.020 A 13 LEU CA C 13 58.068 0.400 A 13 LEU CB C 13 43.019 0.400 A 13 LEU CD1 C 13 26.257 0.400 A 13 LEU CD2 C 13 22.997 0.400 A 13 LEU CG C 13 26.522 0.400 A 13 LEU N N 15 119.606 0.400 A 14 VAL H H 1 7.785 0.020 A 14 VAL HA H 1 3.808 0.020 A 14 VAL HB H 1 1.923 0.020 A 14 VAL HGx% H 1 0.568 0.020 A 14 VAL HGy% H 1 0.589 0.020 A 14 VAL CA C 13 65.464 0.400 A 14 VAL CB C 13 31.895 0.400 A 14 VAL CG1 C 13 22.077 0.400 A 14 VAL CG2 C 13 21.010 0.400 A 14 VAL N N 15 117.777 0.400 A 15 GLU H H 1 8.961 0.020 A 15 GLU HA H 1 4.069 0.020 A 15 GLU HBy H 1 2.171 0.020 A 15 GLU HBx H 1 2.061 0.020 A 15 GLU HGy H 1 2.497 0.020 A 15 GLU HGx H 1 2.336 0.020 A 15 GLU CA C 13 57.624 0.400 A 15 GLU CB C 13 29.196 0.400 A 15 GLU CG C 13 37.098 0.400 A 15 GLU N N 15 123.041 0.400 A 16 ASN H H 1 7.863 0.020 A 16 ASN HA H 1 4.827 0.020 A 16 ASN HBy H 1 3.108 0.020 A 16 ASN HBx H 1 2.940 0.020 A 16 ASN HD2y H 1 7.863 0.020 A 16 ASN HD2x H 1 6.913 0.020 A 16 ASN CB C 13 38.526 0.400 A 16 ASN N N 15 114.935 0.400 A 16 ASN ND2 N 15 112.250 0.400 A 17 GLU H H 1 8.008 0.020 A 17 GLU HA H 1 4.070 0.020 A 17 GLU HB2 H 1 2.201 0.020 A 17 GLU HB3 H 1 2.201 0.020 A 17 GLU HGy H 1 2.342 0.020 A 17 GLU HGx H 1 2.278 0.020 A 17 GLU CA C 13 57.624 0.400 A 17 GLU CB C 13 29.144 0.400 A 17 GLU CG C 13 36.388 0.400 A 17 GLU N N 15 113.841 0.400 A 18 GLU H H 1 8.517 0.020 A 18 GLU HA H 1 4.310 0.020 A 18 GLU HB2 H 1 1.957 0.020 A 18 GLU HB3 H 1 1.957 0.020 A 18 GLU HGx H 1 2.299 0.020 A 18 GLU HGy H 1 2.354 0.020 A 18 GLU CA C 13 58.253 0.400 A 18 GLU CB C 13 30.377 0.400 A 18 GLU CG C 13 37.296 0.400 A 18 GLU N N 15 117.787 0.400 A 19 THR H H 1 7.457 0.020 A 19 THR HA H 1 4.562 0.020 A 19 THR HB H 1 4.212 0.020 A 19 THR HG2% H 1 0.821 0.020 A 19 THR CB C 13 68.196 0.400 A 19 THR CG2 C 13 19.903 0.400 A 19 THR N N 15 110.292 0.400 A 20 THR H H 1 8.188 0.020 A 20 THR HA H 1 4.633 0.020 A 20 THR HB H 1 4.507 0.020 A 20 THR HG2% H 1 1.217 0.020 A 20 THR CG2 C 13 21.641 0.400 A 20 THR N N 15 109.626 0.400 A 21 PHE H H 1 8.714 0.020 A 21 PHE HA H 1 4.238 0.020 A 21 PHE HBx H 1 3.032 0.020 A 21 PHE HBy H 1 3.103 0.020 A 21 PHE HD1 H 1 7.144 0.020 A 21 PHE HD2 H 1 7.144 0.020 A 21 PHE HE1 H 1 7.282 0.020 A 21 PHE HE2 H 1 7.282 0.020 A 21 PHE HZ H 1 7.346 0.020 A 21 PHE CA C 13 60.267 0.400 A 21 PHE CB C 13 37.796 0.400 A 21 PHE N N 15 118.935 0.400 A 22 LYS H H 1 8.234 0.020 A 22 LYS HA H 1 3.881 0.020 A 22 LYS HBy H 1 1.879 0.020 A 22 LYS HBx H 1 1.794 0.020 A 22 LYS HD2 H 1 1.704 0.020 A 22 LYS HD3 H 1 1.704 0.020 A 22 LYS HE2 H 1 3.014 0.020 A 22 LYS HE3 H 1 3.014 0.020 A 22 LYS HGy H 1 1.531 0.020 A 22 LYS HGx H 1 1.426 0.020 A 22 LYS CA C 13 59.589 0.400 A 22 LYS CB C 13 32.513 0.400 A 22 LYS CD C 13 29.172 0.400 A 22 LYS CE C 13 42.001 0.400 A 22 LYS CG C 13 25.145 0.400 A 22 LYS N N 15 116.962 0.400 A 23 GLN H H 1 7.859 0.020 A 23 GLN HA H 1 3.975 0.020 A 23 GLN HB2 H 1 2.148 0.020 A 23 GLN HB3 H 1 2.148 0.020 A 23 GLN HE2y H 1 8.281 0.020 A 23 GLN HE2x H 1 6.987 0.020 A 23 GLN HGy H 1 2.496 0.020 A 23 GLN HGx H 1 2.438 0.020 A 23 GLN CA C 13 58.974 0.400 A 23 GLN CB C 13 27.940 0.400 A 23 GLN CG C 13 33.116 0.400 A 23 GLN N N 15 121.042 0.400 A 23 GLN NE2 N 15 113.134 0.400 A 24 ILE H H 1 7.871 0.020 A 24 ILE HA H 1 2.842 0.020 A 24 ILE HB H 1 1.297 0.020 A 24 ILE HD1% H 1 0.209 0.020 A 24 ILE HG1y H 1 1.504 0.020 A 24 ILE HG1x H 1 -0.614 0.020 A 24 ILE HG2% H 1 -0.205 0.020 A 24 ILE CA C 13 65.094 0.400 A 24 ILE CB C 13 37.778 0.400 A 24 ILE CD1 C 13 13.808 0.400 A 24 ILE CG1 C 13 26.797 0.400 A 24 ILE CG2 C 13 16.980 0.400 A 24 ILE N N 15 118.125 0.400 A 25 ALA H H 1 8.452 0.020 A 25 ALA HA H 1 3.855 0.020 A 25 ALA HB% H 1 1.433 0.020 A 25 ALA CA C 13 55.982 0.400 A 25 ALA CB C 13 19.314 0.400 A 25 ALA N N 15 125.380 0.400 A 26 LEU H H 1 7.936 0.020 A 26 LEU HA H 1 4.041 0.020 A 26 LEU HBx H 1 1.762 0.020 A 26 LEU HBy H 1 1.858 0.020 A 26 LEU HDx% H 1 0.945 0.020 A 26 LEU HDy% H 1 0.947 0.020 A 26 LEU HG H 1 1.756 0.020 A 26 LEU CA C 13 57.976 0.400 A 26 LEU CB C 13 42.337 0.400 A 26 LEU CD1 C 13 24.616 0.400 A 26 LEU CD2 C 13 24.978 0.400 A 26 LEU CG C 13 26.953 0.400 A 26 LEU N N 15 119.285 0.400 A 27 GLU H H 1 8.050 0.020 A 27 GLU HA H 1 4.209 0.020 A 27 GLU HBy H 1 2.342 0.020 A 27 GLU HBx H 1 2.290 0.020 A 27 GLU HGy H 1 2.757 0.020 A 27 GLU HGx H 1 2.362 0.020 A 27 GLU CA C 13 58.243 0.400 A 27 GLU CB C 13 30.836 0.400 A 27 GLU CG C 13 37.389 0.400 A 27 GLU N N 15 115.748 0.400 A 28 SER H H 1 8.476 0.020 A 28 SER HA H 1 4.597 0.020 A 28 SER HBx H 1 3.595 0.020 A 28 SER HBy H 1 3.710 0.020 A 28 SER HG H 1 4.553 0.020 A 28 SER CB C 13 65.743 0.400 A 28 SER N N 15 113.421 0.400 A 29 GLY H H 1 8.074 0.020 A 29 GLY HAy H 1 4.204 0.020 A 29 GLY HAx H 1 3.869 0.020 A 29 GLY CA C 13 45.893 0.400 A 29 GLY N N 15 112.001 0.400 A 30 LEU H H 1 7.545 0.020 A 30 LEU HA H 1 4.609 0.020 A 30 LEU HBx H 1 1.183 0.020 A 30 LEU HBy H 1 1.511 0.020 A 30 LEU HDx% H 1 0.624 0.020 A 30 LEU HDy% H 1 0.876 0.020 A 30 LEU HG H 1 1.480 0.020 A 30 LEU CB C 13 44.177 0.400 A 30 LEU CD1 C 13 26.757 0.400 A 30 LEU CD2 C 13 22.934 0.400 A 30 LEU CG C 13 26.718 0.400 A 30 LEU N N 15 120.750 0.400 A 31 SER H H 1 8.326 0.020 A 31 SER HA H 1 4.568 0.020 A 31 SER HBy H 1 4.318 0.020 A 31 SER HBx H 1 4.036 0.020 A 31 SER CB C 13 64.928 0.400 A 31 SER N N 15 113.993 0.400 A 32 THR HA H 1 3.606 0.020 A 32 THR HB H 1 4.107 0.020 A 32 THR HG2% H 1 1.201 0.020 A 32 THR CA C 13 66.547 0.400 A 32 THR CB C 13 67.740 0.400 A 32 THR CG2 C 13 22.844 0.400 A 33 GLY H H 1 7.877 0.020 A 33 GLY HAy H 1 3.859 0.020 A 33 GLY HAx H 1 3.794 0.020 A 33 GLY CA C 13 46.761 0.400 A 34 THR H H 1 7.877 0.020 A 34 THR HA H 1 3.737 0.020 A 34 THR HB H 1 4.257 0.020 A 34 THR HG2% H 1 0.734 0.020 A 34 THR CA C 13 66.578 0.400 A 34 THR CB C 13 67.956 0.400 A 34 THR CG2 C 13 22.194 0.400 A 34 THR N N 15 121.948 0.400 A 35 ILE H H 1 7.750 0.020 A 35 ILE HA H 1 3.199 0.020 A 35 ILE HB H 1 1.648 0.020 A 35 ILE HD1% H 1 0.500 0.020 A 35 ILE HG1y H 1 1.426 0.020 A 35 ILE HG1x H 1 0.805 0.020 A 35 ILE HG2% H 1 0.696 0.020 A 35 ILE CA C 13 65.514 0.400 A 35 ILE CB C 13 37.869 0.400 A 35 ILE CD1 C 13 13.722 0.400 A 35 ILE CG1 C 13 29.053 0.400 A 35 ILE CG2 C 13 18.117 0.400 A 35 ILE N N 15 120.301 0.400 A 36 SER H H 1 8.322 0.020 A 36 SER HA H 1 3.535 0.020 A 36 SER HBy H 1 3.459 0.020 A 36 SER HBx H 1 3.346 0.020 A 36 SER CA C 13 61.365 0.400 A 36 SER CB C 13 62.114 0.400 A 36 SER N N 15 113.120 0.400 A 37 SER H H 1 8.096 0.020 A 37 SER HA H 1 4.196 0.020 A 37 SER HBy H 1 3.968 0.020 A 37 SER HBx H 1 3.862 0.020 A 37 SER CA C 13 61.201 0.400 A 37 SER CB C 13 63.821 0.400 A 37 SER N N 15 116.941 0.400 A 38 PHE H H 1 8.541 0.020 A 38 PHE HA H 1 4.354 0.020 A 38 PHE HBy H 1 3.058 0.020 A 38 PHE HBx H 1 2.815 0.020 A 38 PHE HD1 H 1 7.097 0.020 A 38 PHE HD2 H 1 7.097 0.020 A 38 PHE HE1 H 1 7.186 0.020 A 38 PHE HE2 H 1 7.186 0.020 A 38 PHE HZ H 1 7.154 0.020 A 38 PHE CA C 13 61.899 0.400 A 38 PHE CB C 13 39.310 0.400 A 38 PHE N N 15 123.225 0.400 A 39 ILE H H 1 8.619 0.020 A 39 ILE HA H 1 3.430 0.020 A 39 ILE HB H 1 1.968 0.020 A 39 ILE HD1% H 1 0.893 0.020 A 39 ILE HG1y H 1 1.913 0.020 A 39 ILE HG1x H 1 1.279 0.020 A 39 ILE HG2% H 1 1.003 0.020 A 39 ILE CA C 13 65.804 0.400 A 39 ILE CB C 13 37.858 0.400 A 39 ILE CD1 C 13 15.049 0.400 A 39 ILE CG1 C 13 29.706 0.400 A 39 ILE CG2 C 13 17.432 0.400 A 39 ILE N N 15 121.189 0.400 A 40 ASN H H 1 7.547 0.020 A 40 ASN HA H 1 4.648 0.020 A 40 ASN HBy H 1 2.907 0.020 A 40 ASN HBx H 1 2.641 0.020 A 40 ASN HD2y H 1 7.415 0.020 A 40 ASN HD2x H 1 7.036 0.020 A 40 ASN CB C 13 39.243 0.400 A 40 ASN N N 15 115.447 0.400 A 40 ASN ND2 N 15 113.471 0.400 A 41 ASP H H 1 7.933 0.020 A 41 ASP HA H 1 4.393 0.020 A 41 ASP HBy H 1 3.178 0.020 A 41 ASP HBx H 1 2.049 0.020 A 41 ASP CA C 13 54.531 0.400 A 41 ASP CB C 13 39.581 0.400 A 41 ASP N N 15 119.335 0.400 A 42 LYS H H 1 8.418 0.020 A 42 LYS HA H 1 4.520 0.020 A 42 LYS HBy H 1 1.999 0.020 A 42 LYS HBx H 1 1.504 0.020 A 42 LYS HDy H 1 1.700 0.020 A 42 LYS HDx H 1 1.597 0.020 A 42 LYS HE2 H 1 2.980 0.020 A 42 LYS HE3 H 1 2.980 0.020 A 42 LYS HGy H 1 1.373 0.020 A 42 LYS HGx H 1 1.277 0.020 A 42 LYS CB C 13 33.693 0.400 A 42 LYS CD C 13 28.935 0.400 A 42 LYS CE C 13 42.067 0.400 A 42 LYS CG C 13 24.502 0.400 A 42 LYS N N 15 117.025 0.400 A 43 TYR H H 1 8.437 0.020 A 43 TYR HA H 1 4.663 0.020 A 43 TYR HBy H 1 3.290 0.020 A 43 TYR HBx H 1 2.810 0.020 A 43 TYR HD1 H 1 7.234 0.020 A 43 TYR HD2 H 1 7.234 0.020 A 43 TYR HE1 H 1 6.732 0.020 A 43 TYR HE2 H 1 6.732 0.020 A 43 TYR CB C 13 38.132 0.400 A 43 TYR N N 15 122.804 0.400 A 44 ASN HBy H 1 2.760 0.020 A 44 ASN HBx H 1 2.645 0.020 A 44 ASN HD2y H 1 7.515 0.020 A 44 ASN HD2x H 1 6.814 0.020 A 44 ASN CB C 13 38.647 0.400 A 44 ASN ND2 N 15 112.238 0.400 A 45 GLY HAy H 1 4.061 0.020 A 45 GLY HAx H 1 3.314 0.020 A 45 GLY CA C 13 45.034 0.400 A 46 ASP HBy H 1 3.085 0.020 A 46 ASP HBx H 1 2.633 0.020 A 46 ASP CB C 13 40.065 0.400 A 47 ASN H H 1 8.291 0.020 A 47 ASN HA H 1 4.520 0.020 A 47 ASN HBy H 1 3.054 0.020 A 47 ASN HBx H 1 2.769 0.020 A 47 ASN HD2y H 1 7.624 0.020 A 47 ASN HD2x H 1 7.080 0.020 A 47 ASN CA C 13 54.705 0.400 A 47 ASN CB C 13 40.262 0.400 A 47 ASN ND2 N 15 112.966 0.400 A 48 GLU H H 1 8.695 0.020 A 48 GLU HA H 1 4.127 0.020 A 48 GLU HB2 H 1 2.218 0.020 A 48 GLU HB3 H 1 2.218 0.020 A 48 GLU HG2 H 1 2.346 0.020 A 48 GLU HG3 H 1 2.346 0.020 A 48 GLU CA C 13 60.052 0.400 A 48 GLU CB C 13 29.155 0.400 A 48 GLU CG C 13 36.559 0.400 A 48 GLU N N 15 121.849 0.400 A 49 ARG H H 1 7.958 0.020 A 49 ARG HA H 1 4.105 0.020 A 49 ARG HBy H 1 1.905 0.020 A 49 ARG HBx H 1 1.856 0.020 A 49 ARG HD2 H 1 3.262 0.020 A 49 ARG HD3 H 1 3.262 0.020 A 49 ARG HGy H 1 1.717 0.020 A 49 ARG HGx H 1 1.596 0.020 A 49 ARG CA C 13 59.130 0.400 A 49 ARG CB C 13 30.078 0.400 A 49 ARG CD C 13 43.136 0.400 A 49 ARG CG C 13 27.310 0.400 A 49 ARG N N 15 120.467 0.400 A 50 VAL H H 1 7.767 0.020 A 50 VAL HA H 1 3.362 0.020 A 50 VAL HB H 1 1.701 0.020 A 50 VAL HGx% H 1 0.029 0.020 A 50 VAL HGy% H 1 0.784 0.020 A 50 VAL CA C 13 67.008 0.400 A 50 VAL CB C 13 31.759 0.400 A 50 VAL CG1 C 13 21.046 0.400 A 50 VAL CG2 C 13 23.682 0.400 A 50 VAL N N 15 119.496 0.400 A 51 SER H H 1 8.296 0.020 A 51 SER HA H 1 3.665 0.020 A 51 SER HBy H 1 4.201 0.020 A 51 SER HBx H 1 4.061 0.020 A 51 SER CA C 13 62.288 0.400 A 51 SER CB C 13 62.823 0.400 A 51 SER N N 15 114.856 0.400 A 52 GLN H H 1 8.012 0.020 A 52 GLN HA H 1 4.167 0.020 A 52 GLN HBx H 1 2.158 0.020 A 52 GLN HBy H 1 2.258 0.020 A 52 GLN HE2y H 1 7.643 0.020 A 52 GLN HE2x H 1 6.862 0.020 A 52 GLN HGx H 1 2.489 0.020 A 52 GLN HGy H 1 2.652 0.020 A 52 GLN CA C 13 59.179 0.400 A 52 GLN CB C 13 28.441 0.400 A 52 GLN CG C 13 34.259 0.400 A 52 GLN N N 15 120.482 0.400 A 52 GLN NE2 N 15 111.839 0.400 A 53 THR H H 1 7.960 0.020 A 53 THR HA H 1 3.981 0.020 A 53 THR HB H 1 4.279 0.020 A 53 THR HG2% H 1 1.275 0.020 A 53 THR CA C 13 67.070 0.400 A 53 THR CB C 13 68.860 0.400 A 53 THR CG2 C 13 22.312 0.400 A 53 THR N N 15 117.745 0.400 A 54 LEU H H 1 8.376 0.020 A 54 LEU HA H 1 4.334 0.020 A 54 LEU HBx H 1 1.305 0.020 A 54 LEU HBy H 1 1.644 0.020 A 54 LEU HDx% H 1 0.161 0.020 A 54 LEU HDy% H 1 0.504 0.020 A 54 LEU HG H 1 1.416 0.020 A 54 LEU CA C 13 57.483 0.400 A 54 LEU CB C 13 41.080 0.400 A 54 LEU CD1 C 13 26.329 0.400 A 54 LEU CD2 C 13 22.059 0.400 A 54 LEU CG C 13 26.711 0.400 A 54 LEU N N 15 122.166 0.400 A 55 GLN H H 1 9.086 0.020 A 55 GLN HA H 1 4.060 0.020 A 55 GLN HBy H 1 2.348 0.020 A 55 GLN HBx H 1 2.242 0.020 A 55 GLN HE2y H 1 7.716 0.020 A 55 GLN HE2x H 1 6.834 0.020 A 55 GLN HGy H 1 2.492 0.020 A 55 GLN HGx H 1 2.351 0.020 A 55 GLN CA C 13 59.427 0.400 A 55 GLN CB C 13 27.548 0.400 A 55 GLN CG C 13 33.754 0.400 A 55 GLN N N 15 122.381 0.400 A 55 GLN NE2 N 15 111.575 0.400 A 56 ARG H H 1 7.690 0.020 A 56 ARG HA H 1 4.179 0.020 A 56 ARG HBy H 1 2.102 0.020 A 56 ARG HBx H 1 2.010 0.020 A 56 ARG HD2 H 1 3.313 0.020 A 56 ARG HD3 H 1 3.313 0.020 A 56 ARG HE H 1 5.985 0.020 A 56 ARG HGy H 1 1.906 0.020 A 56 ARG HGx H 1 1.781 0.020 A 56 ARG CA C 13 57.448 0.400 A 56 ARG CB C 13 30.192 0.400 A 56 ARG CD C 13 43.536 0.400 A 56 ARG CG C 13 27.774 0.400 A 56 ARG N N 15 117.595 0.400 A 56 ARG NE N 15 75.463 0.400 A 57 TRP H H 1 7.754 0.020 A 57 TRP HA H 1 4.096 0.020 A 57 TRP HBy H 1 3.713 0.020 A 57 TRP HBx H 1 3.238 0.020 A 57 TRP HD1 H 1 7.108 0.020 A 57 TRP HE1 H 1 11.244 0.020 A 57 TRP HE3 H 1 7.329 0.020 A 57 TRP HH2 H 1 6.568 0.020 A 57 TRP HZ2 H 1 7.372 0.020 A 57 TRP HZ3 H 1 6.570 0.020 A 57 TRP CA C 13 58.856 0.400 A 57 TRP CB C 13 28.557 0.400 A 57 TRP N N 15 120.743 0.400 A 57 TRP NE1 N 15 132.408 0.400 A 58 LEU H H 1 8.699 0.020 A 58 LEU HA H 1 3.680 0.020 A 58 LEU HBx H 1 1.844 0.020 A 58 LEU HBy H 1 2.058 0.020 A 58 LEU HDx% H 1 1.053 0.020 A 58 LEU HDy% H 1 1.086 0.020 A 58 LEU HG H 1 1.985 0.020 A 58 LEU CA C 13 58.178 0.400 A 58 LEU CB C 13 42.947 0.400 A 58 LEU CD1 C 13 25.213 0.400 A 58 LEU CD2 C 13 25.745 0.400 A 58 LEU CG C 13 27.452 0.400 A 58 LEU N N 15 121.472 0.400 A 59 GLU H H 1 8.301 0.020 A 59 GLU HA H 1 3.957 0.020 A 59 GLU HBy H 1 2.184 0.020 A 59 GLU HBx H 1 1.987 0.020 A 59 GLU HGy H 1 2.592 0.020 A 59 GLU HGx H 1 2.283 0.020 A 59 GLU CA C 13 58.835 0.400 A 59 GLU CB C 13 29.824 0.400 A 59 GLU CG C 13 37.109 0.400 A 59 GLU N N 15 117.216 0.400 A 60 LYS H H 1 7.499 0.020 A 60 LYS HA H 1 4.023 0.020 A 60 LYS HB2 H 1 1.678 0.020 A 60 LYS HB3 H 1 1.678 0.020 A 60 LYS HD2 H 1 1.565 0.020 A 60 LYS HD3 H 1 1.565 0.020 A 60 LYS HE2 H 1 2.876 0.020 A 60 LYS HE3 H 1 2.876 0.020 A 60 LYS HGy H 1 1.286 0.020 A 60 LYS HGx H 1 1.052 0.020 A 60 LYS CA C 13 57.884 0.400 A 60 LYS CB C 13 32.425 0.400 A 60 LYS CD C 13 29.146 0.400 A 60 LYS CE C 13 42.100 0.400 A 60 LYS CG C 13 24.674 0.400 A 60 LYS N N 15 118.414 0.400 A 61 TYR H H 1 7.852 0.020 A 61 TYR HA H 1 3.749 0.020 A 61 TYR HBy H 1 2.415 0.020 A 61 TYR HBx H 1 1.689 0.020 A 61 TYR HD1 H 1 6.401 0.020 A 61 TYR HD2 H 1 6.401 0.020 A 61 TYR HE1 H 1 6.679 0.020 A 61 TYR HE2 H 1 6.679 0.020 A 61 TYR CA C 13 59.050 0.400 A 61 TYR CB C 13 38.630 0.400 A 61 TYR N N 15 120.082 0.400 A 62 HIS H H 1 7.600 0.020 A 62 HIS HA H 1 4.502 0.020 A 62 HIS HBy H 1 3.311 0.020 A 62 HIS HBx H 1 2.842 0.020 A 62 HIS HD2 H 1 6.817 0.020 A 62 HIS CA C 13 55.698 0.400 A 62 HIS CB C 13 30.235 0.400 A 62 HIS N N 15 117.180 0.400 A 63 ALA H H 1 7.401 0.020 A 63 ALA HA H 1 4.030 0.020 A 63 ALA HB% H 1 1.371 0.020 A 63 ALA CA C 13 54.394 0.400 A 63 ALA CB C 13 19.765 0.400 A 63 ALA N N 15 129.366 0.400 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 27 GLU H A 57 TRP HE1 1.0 . 4.72 2 2 A 57 TRP HE1 A 24 ILE HA 1.0 . 4.18 3 3 A 15 GLU H A 14 VAL HGy% 1.0 . 4.23 4 4 A 15 GLU H A 15 GLU HGy 1.0 . 4.29 5 5 A 38 PHE HBy A 39 ILE H 1.0 . 4.15 6 6 A 39 ILE H A 38 PHE H 1.0 . 3.34 7 7 A 38 PHE H A 38 PHE HD% 1.0 . 4.19 8 8 A 8 ALA HA A 11 ARG H 1.0 . 4.92 9 9 A 53 THR HG2% A 54 LEU H 1.0 . 4.05 10 10 A 9 GLY H A 58 LEU HDy% 1.0 . 5.08 11 11 A 47 ASN H A 48 GLU H 1.0 . 3.78 12 12 A 5 ASP H A 6 ILE H 1.0 . 3.51 13 13 A 7 ARG H A 7 ARG HGx 1.0 . 3.70 14 14 A 6 ILE HD1% A 51 SER H 1.0 . 5.50 15 15 A 19 THR HG2% A 20 THR H 1.0 . 3.82 16 16 A 20 THR H A 24 ILE H 1.0 . 5.15 17 17 A 10 LEU H A 58 LEU HDx% 1.0 . 4.58 18 18 A 10 LEU H A 11 ARG HB2 1.0 . 5.13 19 18 A 10 LEU H A 11 ARG HB3 1.0 . 5.13 20 19 A 34 THR HG2% A 37 SER H 1.0 . 4.73 21 20 A 7 ARG H A 8 ALA H 1.0 . 3.38 22 21 A 16 ASN H A 17 GLU H 1.0 . 3.22 23 22 A 59 GLU H A 61 TYR H 1.0 . 4.24 24 23 A 12 THR H A 14 VAL H 1.0 . 4.77 25 24 A 14 VAL H A 14 VAL HGy% 1.0 . 3.63 26 25 A 49 ARG H A 50 VAL H 1.0 . 3.65 27 26 A 55 GLN HBx A 55 GLN HE2x 1.0 . 4.13 28 27 A 62 HIS H A 62 HIS HD2 1.0 . 4.56 29 28 A 43 TYR HBx A 47 ASN HD2x 1.0 . 4.79 30 29 A 61 TYR H A 62 HIS H 1.0 . 3.52 31 30 A 40 ASN H A 42 LYS H 1.0 . 4.73 32 31 A 30 LEU H A 31 SER H 1.0 . 4.59 33 32 A 30 LEU H A 25 ALA HB% 1.0 . 4.20 34 33 A 62 HIS H A 63 ALA H 1.0 . 3.57 35 34 A 63 ALA H A 63 ALA HB% 1.0 . 3.22 36 35 A 61 TYR H A 63 ALA H 1.0 . 4.42 37 36 A 24 ILE HA A 57 TRP HZ2 1.0 . 4.32 38 37 A 57 TRP HE3 A 58 LEU HDx% 1.0 . 4.39 39 38 A 38 PHE H A 43 TYR HD% 1.0 . 4.97 40 39 A 38 PHE HE% A 47 ASN HBy 1.0 . 4.74 41 40 A 7 ARG H A 38 PHE HE% 1.0 . 3.92 42 41 A 7 ARG HGy A 38 PHE HZ 1.0 . 5.50 43 42 A 38 PHE HE% A 6 ILE HB 1.0 . 4.38 44 43 A 38 PHE HE% A 39 ILE HG1y 1.0 . 4.66 45 44 A 21 PHE HD% A 32 THR HG2% 1.0 . 5.04 46 45 A 21 PHE HD% A 39 ILE HD1% 1.0 . 4.05 47 46 A 21 PHE HD% A 24 ILE HG2% 1.0 . 5.22 48 47 A 38 PHE HD% A 43 TYR HBx 1.0 . 4.95 49 48 A 38 PHE HD% A 35 ILE HA 1.0 . 4.43 50 49 A 62 HIS HD2 A 58 LEU HDy% 1.0 . 4.44 51 50 A 43 TYR HE% A 50 VAL HGy% 1.0 . 4.44 52 51 A 34 THR HG2% A 43 TYR HE% 1.0 . 3.89 53 52 A 57 TRP HZ2 A 61 TYR HE% 1.0 . 4.74 54 53 A 61 TYR HE% A 27 GLU HBx 1.0 . 5.47 55 54 A 61 TYR HE% A 13 LEU HDx% 1.0 . 4.41 56 55 A 57 TRP HZ3 A 58 LEU HDy% 1.0 . 3.86 57 56 A 57 TRP HH2 A 13 LEU HDx% 1.0 . 4.13 58 57 A 57 TRP HZ3 A 24 ILE HD1% 1.0 . 4.58 59 58 A 57 TRP HH2 A 24 ILE HD1% 1.0 . 4.71 60 59 A 57 TRP HZ3 A 10 LEU HDx% 1.0 . 4.54 61 60 A 24 ILE HG2% A 57 TRP HZ3 1.0 . 5.08 62 61 A 24 ILE HG2% A 57 TRP HH2 1.0 . 5.49 63 62 A 57 TRP HZ2 A 61 TYR HD% 1.0 . 4.11 64 63 A 43 TYR HD% A 43 TYR HA 1.0 . 3.18 65 64 A 43 TYR HE% A 43 TYR HA 1.0 . 4.88 66 65 A 39 ILE HG2% A 40 ASN HA 1.0 . 4.33 67 66 A 20 THR HA A 22 LYS H 1.0 . 4.40 68 67 A 20 THR HA A 20 THR HG2% 1.0 . 3.11 69 68 A 7 ARG H A 5 ASP HA 1.0 . 4.98 70 69 A 5 ASP HA A 8 ALA HB% 1.0 . 3.30 71 70 A 30 LEU HA A 30 LEU HG 1.0 . 3.96 72 71 A 30 LEU HA A 30 LEU HDy% 1.0 . 2.99 73 72 A 30 LEU HA A 30 LEU HDx% 1.0 . 4.14 74 73 A 28 SER HG A 29 GLY H 1.0 . 4.62 75 74 A 28 SER HA A 57 TRP HD1 1.0 . 4.15 76 75 A 53 THR HG2% A 28 SER HA 1.0 . 3.86 77 76 A 25 ALA HB% A 31 SER HA 1.0 . 4.70 78 77 A 19 THR HG2% A 19 THR HA 1.0 . 3.97 79 78 A 28 SER HG A 25 ALA HA 1.0 . 3.65 80 79 A 28 SER HG A 35 ILE HD1% 1.0 . 4.20 81 80 A 24 ILE HG2% A 28 SER HG 1.0 . 3.81 82 81 A 43 TYR HD% A 47 ASN HA 1.0 . 3.61 83 82 A 38 PHE HE% A 47 ASN HA 1.0 . 4.60 84 83 A 38 PHE HD% A 47 ASN HA 1.0 . 4.16 85 84 A 47 ASN HA A 47 ASN HD2y 1.0 . 4.99 86 85 A 43 TYR HE% A 47 ASN HA 1.0 . 3.90 87 86 A 47 ASN HA A 50 VAL HB 1.0 . 4.09 88 87 A 47 ASN HA A 50 VAL HGy% 1.0 . 5.20 89 88 A 20 THR HB A 21 PHE H 1.0 . 4.71 90 89 A 62 HIS HD2 A 62 HIS HA 1.0 . 4.64 91 90 A 61 TYR HD% A 62 HIS HA 1.0 . 5.28 92 91 A 57 TRP HE3 A 54 LEU HA 1.0 . 4.65 93 92 A 43 TYR HD% A 38 PHE HA 1.0 . 4.50 94 93 A 38 PHE HE% A 38 PHE HA 1.0 . 4.92 95 94 A 38 PHE HD% A 38 PHE HA 1.0 . 3.45 96 95 A 43 TYR HBx A 38 PHE HA 1.0 . 3.94 97 96 A 38 PHE HA A 43 TYR HBy 1.0 . 4.08 98 97 A 54 LEU HA A 54 LEU HDx% 1.0 . 4.65 99 98 A 54 LEU HA A 58 LEU H 1.0 . 4.37 100 99 A 54 LEU HA A 57 TRP H 1.0 . 3.58 101 100 A 54 LEU HA A 57 TRP HBy 1.0 . 3.76 102 101 A 54 LEU HA A 54 LEU HG 1.0 . 3.78 103 102 A 54 LEU HA A 54 LEU HDy% 1.0 . 2.91 104 103 A 18 GLU HA A 18 GLU HGx 1.0 . 3.21 105 104 A 18 GLU HA A 18 GLU HGy 1.0 . 3.87 106 105 A 50 VAL HA A 53 THR HB 1.0 . 3.57 107 106 A 30 LEU HDy% A 53 THR HB 1.0 . 4.04 108 107 A 30 LEU HDx% A 53 THR HB 1.0 . 3.52 109 108 A 31 SER H A 34 THR HB 1.0 . 3.65 110 109 A 34 THR HB A 35 ILE HB 1.0 . 5.47 111 110 A 53 THR HB A 54 LEU HBx 1.0 . 5.50 112 111 A 34 THR HB A 35 ILE HG1x 1.0 . 4.16 113 112 A 54 LEU HG A 53 THR HB 1.0 . 4.72 114 113 A 34 THR HB A 30 LEU HBy 1.0 . 4.03 115 114 A 34 THR HB A 35 ILE HG1y 1.0 . 5.27 116 115 A 53 THR HB A 50 VAL HGy% 1.0 . 5.50 117 116 A 21 PHE HA A 24 ILE HG1x 1.0 . 5.08 118 117 A 30 LEU HG A 53 THR HB 1.0 . 5.50 119 118 A 35 ILE HD1% A 21 PHE HA 1.0 . 3.97 120 119 A 21 PHE HA A 25 ALA H 1.0 . 4.71 121 120 A 21 PHE HA A 21 PHE HE% 1.0 . 5.10 122 121 A 12 THR HB A 13 LEU H 1.0 . 3.24 123 122 A 21 PHE HD% A 21 PHE HA 1.0 . 3.50 124 123 A 21 PHE HA A 35 ILE HG2% 1.0 . 4.28 125 124 A 24 ILE HD1% A 21 PHE HA 1.0 . 3.42 126 125 A 24 ILE HG2% A 21 PHE HA 1.0 . 4.70 127 126 A 57 TRP HD1 A 27 GLU HA 1.0 . 5.21 128 127 A 61 TYR HE% A 19 THR HB 1.0 . 4.56 129 128 A 57 TRP HH2 A 19 THR HB 1.0 . 4.67 130 129 A 27 GLU HA A 27 GLU HGx 1.0 . 3.86 131 130 A 37 SER HA A 42 LYS HBy 1.0 . 4.16 132 131 A 37 SER HA A 43 TYR H 1.0 . 5.30 133 132 A 27 GLU HA A 26 LEU H 1.0 . 5.50 134 133 A 37 SER HA A 41 ASP H 1.0 . 5.50 135 134 A 3 ILE HG2% A 51 SER HBx 1.0 . 5.20 136 135 A 56 ARG HA A 60 LYS H 1.0 . 4.88 137 136 A 56 ARG HA A 56 ARG HD2 1.0 . 4.61 138 136 A 56 ARG HA A 56 ARG HD3 1.0 . 4.61 139 137 A 52 GLN HA A 55 GLN HGx 1.0 . 4.76 140 138 A 4 SER HA A 7 ARG HD2 1.0 . 4.08 141 138 A 4 SER HA A 7 ARG HD3 1.0 . 4.08 142 139 A 57 TRP HZ3 A 10 LEU HA 1.0 . 4.57 143 140 A 10 LEU HA A 58 LEU HDy% 1.0 . 5.31 144 141 A 10 LEU HA A 10 LEU HDy% 1.0 . 3.28 145 142 A 21 PHE HBy A 32 THR HB 1.0 . 4.42 146 143 A 8 ALA HA A 11 ARG HB2 1.0 . 3.97 147 143 A 8 ALA HA A 11 ARG HB3 1.0 . 3.97 148 144 A 60 LYS H A 57 TRP HA 1.0 . 4.35 149 145 A 57 TRP HD1 A 57 TRP HA 1.0 . 3.64 150 146 A 61 TYR HE% A 13 LEU HA 1.0 . 5.50 151 147 A 61 TYR HD% A 57 TRP HA 1.0 . 5.24 152 148 A 13 LEU HA A 16 ASN HBx 1.0 . 5.50 153 149 A 32 THR HB A 21 PHE HBx 1.0 . 5.50 154 150 A 13 LEU HA A 16 ASN HBy 1.0 . 4.31 155 151 A 57 TRP HA A 60 LYS HB2 1.0 . 4.48 156 151 A 57 TRP HA A 60 LYS HB3 1.0 . 4.48 157 152 A 13 LEU HA A 12 THR HG2% 1.0 . 4.39 158 153 A 19 THR HG2% A 13 LEU HA 1.0 . 4.42 159 154 A 13 LEU HA A 13 LEU HDy% 1.0 . 4.02 160 155 A 35 ILE HD1% A 32 THR HB 1.0 . 4.87 161 156 A 57 TRP HE3 A 57 TRP HA 1.0 . 4.81 162 157 A 17 GLU HA A 18 GLU H 1.0 . 3.57 163 158 A 17 GLU HA A 19 THR H 1.0 . 4.27 164 159 A 55 GLN HA A 58 LEU HBx 1.0 . 3.67 165 160 A 54 LEU H A 55 GLN HA 1.0 . 5.50 166 161 A 51 SER H A 51 SER HBy 1.0 . 3.58 167 162 A 38 PHE HE% A 51 SER HBy 1.0 . 4.08 168 163 A 55 GLN HGx A 55 GLN HA 1.0 . 4.20 169 164 A 55 GLN HA A 55 GLN HGy 1.0 . 3.69 170 165 A 3 ILE HG2% A 51 SER HBy 1.0 . 5.20 171 166 A 26 LEU HA A 28 SER H 1.0 . 4.80 172 167 A 29 GLY H A 26 LEU HA 1.0 . 4.46 173 168 A 26 LEU HA A 26 LEU HG 1.0 . 4.15 174 169 A 60 LYS HA A 60 LYS HD2 1.0 . 4.77 175 169 A 60 LYS HA A 60 LYS HD3 1.0 . 4.77 176 170 A 25 ALA HB% A 26 LEU HA 1.0 . 4.33 177 171 A 26 LEU H A 23 GLN HA 1.0 . 3.89 178 172 A 5 ASP H A 4 SER HB2 1.0 . 3.69 179 172 A 5 ASP H A 4 SER HB3 1.0 . 3.69 180 173 A 57 TRP H A 53 THR HA 1.0 . 5.22 181 174 A 43 TYR HD% A 37 SER HBx 1.0 . 3.99 182 175 A 12 THR HA A 15 GLU HGx 1.0 . 4.29 183 176 A 12 THR HA A 15 GLU HGy 1.0 . 4.29 184 177 A 23 GLN HA A 26 LEU HBy 1.0 . 3.57 185 178 A 12 THR HG2% A 12 THR HA 1.0 . 3.24 186 179 A 53 THR HG2% A 53 THR HA 1.0 . 3.48 187 180 A 15 GLU H A 12 THR HA 1.0 . 4.48 188 181 A 38 PHE H A 37 SER HBx 1.0 . 4.05 189 182 A 11 ARG H A 9 GLY HAx 1.0 . 5.01 190 183 A 25 ALA H A 23 GLN HA 1.0 . 5.31 191 184 A 6 ILE H A 3 ILE HA 1.0 . 3.69 192 185 A 38 PHE HZ A 3 ILE HA 1.0 . 4.38 193 186 A 12 THR HB A 9 GLY HAx 1.0 . 4.82 194 187 A -1 GLY HA3 A 0 PRO HD2 1.0 . 3.15 195 187 A -1 GLY HA2 A 0 PRO HD2 1.0 . 3.15 196 187 A 0 PRO HD3 A -1 GLY HA2 1.0 . 3.15 197 187 A -1 GLY HA3 A 0 PRO HD3 1.0 . 3.15 198 188 A 43 TYR HBy A 37 SER HBx 1.0 . 4.62 199 189 A -1 GLY HA3 A 0 PRO HG2 1.0 . 4.31 200 189 A 0 PRO HG3 A -1 GLY HA2 1.0 . 4.31 201 189 A -1 GLY HA3 A 0 PRO HG3 1.0 . 4.31 202 189 A -1 GLY HA2 A 0 PRO HG2 1.0 . 4.31 203 190 A 3 ILE HA A 3 ILE HG1y 1.0 . 3.91 204 191 A 23 GLN HA A 26 LEU HBx 1.0 . 3.94 205 192 A 3 ILE HA A 6 ILE HG2% 1.0 . 4.70 206 193 A 3 ILE HG2% A 3 ILE HA 1.0 . 3.40 207 194 A 3 ILE HA A 3 ILE HD1% 1.0 . 3.77 208 195 A 6 ILE HD1% A 3 ILE HA 1.0 . 3.39 209 196 A 4 SER H A 4 SER HB2 1.0 . 3.30 210 196 A 4 SER HB3 A 4 SER H 1.0 . 3.30 211 197 A 62 HIS H A 59 GLU HA 1.0 . 4.49 212 198 A 59 GLU HA A 59 GLU HGx 1.0 . 3.89 213 199 A 32 THR HG2% A 22 LYS HA 1.0 . 3.16 214 200 A 38 PHE H A 37 SER HBy 1.0 . 4.05 215 201 A 43 TYR HD% A 37 SER HBy 1.0 . 3.99 216 202 A 43 TYR HBy A 37 SER HBy 1.0 . 4.62 217 203 A 22 LYS HA A 22 LYS HGx 1.0 . 3.95 218 204 A 25 ALA HA A 30 LEU HBx 1.0 . 4.39 219 205 A 25 ALA HA A 35 ILE HD1% 1.0 . 3.16 220 206 A 24 ILE HG2% A 25 ALA HA 1.0 . 4.29 221 207 A 10 LEU H A 7 ARG HA 1.0 . 3.85 222 208 A 7 ARG HA A 39 ILE HA 1.0 . 4.28 223 209 A 39 ILE HG1y A 7 ARG HA 1.0 . 4.59 224 210 A 18 GLU H A 14 VAL HA 1.0 . 4.51 225 211 A 38 PHE HE% A 7 ARG HA 1.0 . 3.76 226 212 A 38 PHE HD% A 7 ARG HA 1.0 . 4.43 227 213 A 1 MET HE% A 6 ILE HA 1.0 . 3.95 228 214 A 7 ARG HA A 10 LEU HBx 1.0 . 4.46 229 215 A 7 ARG HGx A 7 ARG HA 1.0 . 3.85 230 216 A 10 LEU HDx% A 7 ARG HA 1.0 . 3.35 231 217 A 39 ILE HD1% A 7 ARG HA 1.0 . 4.49 232 218 A 39 ILE HD1% A 11 ARG HA 1.0 . 4.67 233 219 A 19 THR HG2% A 14 VAL HA 1.0 . 3.94 234 220 A 11 ARG HA A 11 ARG HGx 1.0 . 3.94 235 221 A 6 ILE HA A 6 ILE HG1y 1.0 . 3.70 236 222 A 6 ILE HG2% A 6 ILE HA 1.0 . 3.10 237 223 A 61 TYR HE% A 61 TYR HA 1.0 . 4.93 238 224 A 61 TYR HD% A 61 TYR HA 1.0 . 3.55 239 225 A 43 TYR HD% A 34 THR HA 1.0 . 3.97 240 226 A 43 TYR HE% A 34 THR HA 1.0 . 4.22 241 227 A 34 THR HG2% A 34 THR HA 1.0 . 3.39 242 228 A 53 THR HG2% A 28 SER HBx 1.0 . 3.38 243 229 A 30 LEU HDx% A 28 SER HBx 1.0 . 4.22 244 230 A 54 LEU HDy% A 28 SER HBx 1.0 . 3.57 245 231 A 24 ILE HG2% A 28 SER HBx 1.0 . 4.49 246 232 A 24 ILE HG2% A 57 TRP HBx 1.0 . 4.88 247 233 A 57 TRP HE3 A 58 LEU HA 1.0 . 3.50 248 234 A 61 TYR H A 58 LEU HA 1.0 . 4.02 249 235 A 62 HIS H A 58 LEU HA 1.0 . 4.54 250 236 A 60 LYS H A 58 LEU HA 1.0 . 4.71 251 237 A 62 HIS HD2 A 58 LEU HA 1.0 . 4.46 252 238 A 57 TRP HZ3 A 58 LEU HA 1.0 . 4.08 253 239 A 58 LEU HA A 61 TYR HBx 1.0 . 3.83 254 240 A 58 LEU HA A 58 LEU HG 1.0 . 3.79 255 241 A 58 LEU HA A 61 TYR HBy 1.0 . 3.75 256 242 A 6 ILE HG2% A 51 SER HA 1.0 . 3.36 257 243 A 38 PHE HE% A 51 SER HA 1.0 . 4.23 258 244 A 38 PHE HZ A 51 SER HA 1.0 . 4.17 259 245 A 54 LEU HBx A 51 SER HA 1.0 . 3.88 260 246 A 54 LEU HDx% A 51 SER HA 1.0 . 4.09 261 247 A 32 THR HA A 36 SER H 1.0 . 4.57 262 248 A 25 ALA HB% A 32 THR HA 1.0 . 3.37 263 249 A 32 THR HG2% A 32 THR HA 1.0 . 3.28 264 250 A 35 ILE HG2% A 32 THR HA 1.0 . 4.74 265 251 A 35 ILE HD1% A 32 THR HA 1.0 . 3.43 266 252 A 27 GLU H A 28 SER HBy 1.0 . 5.34 267 253 A 57 TRP HD1 A 28 SER HBy 1.0 . 4.12 268 254 A 53 THR HG2% A 28 SER HBy 1.0 . 3.78 269 255 A 24 ILE HG2% A 28 SER HBy 1.0 . 4.04 270 256 A 21 PHE HZ A 36 SER HA 1.0 . 4.54 271 257 A 21 PHE HE% A 36 SER HA 1.0 . 4.24 272 258 A 39 ILE HD1% A 36 SER HA 1.0 . 4.02 273 259 A 21 PHE HD% A 36 SER HA 1.0 . 4.98 274 260 A 37 SER H A 36 SER HBx 1.0 . 4.06 275 261 A 21 PHE HD% A 36 SER HBx 1.0 . 5.30 276 262 A 38 PHE HD% A 39 ILE HA 1.0 . 3.98 277 263 A 7 ARG HGx A 39 ILE HA 1.0 . 4.67 278 264 A 39 ILE HA A 7 ARG HBx 1.0 . 3.98 279 265 A 39 ILE HG2% A 39 ILE HA 1.0 . 3.27 280 266 A 53 THR HG2% A 50 VAL HA 1.0 . 4.49 281 267 A 50 VAL HA A 50 VAL HGy% 1.0 . 3.37 282 268 A 50 VAL HA A 50 VAL HGx% 1.0 . 3.37 283 269 A 57 TRP HE3 A 57 TRP HBy 1.0 . 4.11 284 270 A 57 TRP HD1 A 57 TRP HBy 1.0 . 3.44 285 271 A 8 ALA HA A 11 ARG HD2 1.0 . 4.03 286 271 A 8 ALA HA A 11 ARG HD3 1.0 . 4.03 287 272 A 57 TRP HBy A 28 SER H 1.0 . 5.37 288 273 A 35 ILE HA A 35 ILE HD1% 1.0 . 4.36 289 274 A 35 ILE HA A 54 LEU HDy% 1.0 . 4.62 290 275 A 37 SER H A 35 ILE HA 1.0 . 4.85 291 276 A 34 THR HG2% A 35 ILE HA 1.0 . 4.20 292 277 A 57 TRP HBy A 54 LEU HDy% 1.0 . 4.51 293 278 A 41 ASP H A 41 ASP HBx 1.0 . 4.10 294 279 A 16 ASN H A 16 ASN HBx 1.0 . 3.80 295 280 A 18 GLU HGx A 16 ASN HBx 1.0 . 4.14 296 281 A 18 GLU HGy A 16 ASN HBx 1.0 . 4.64 297 282 A 22 LYS H A 21 PHE HBx 1.0 . 4.02 298 283 A 41 ASP H A 7 ARG HD2 1.0 . 4.26 299 283 A 41 ASP H A 7 ARG HD3 1.0 . 4.26 300 284 A 39 ILE HA A 7 ARG HD2 1.0 . 3.83 301 284 A 7 ARG HD3 A 39 ILE HA 1.0 . 3.83 302 285 A 39 ILE H A 38 PHE HBx 1.0 . 3.68 303 286 A 38 PHE HE% A 47 ASN HBx 1.0 . 4.74 304 287 A 39 ILE HG2% A 7 ARG HD2 1.0 . 3.78 305 287 A 39 ILE HG2% A 7 ARG HD3 1.0 . 3.78 306 288 A 22 LYS H A 21 PHE HBy 1.0 . 4.19 307 289 A 32 THR HG2% A 21 PHE HBy 1.0 . 3.72 308 290 A 35 ILE HD1% A 21 PHE HBy 1.0 . 4.94 309 291 A 21 PHE HBy A 32 THR HA 1.0 . 4.39 310 292 A 21 PHE HBy A 22 LYS HA 1.0 . 4.90 311 293 A 22 LYS HA A 22 LYS HE2 1.0 . 5.31 312 293 A 22 LYS HA A 22 LYS HE3 1.0 . 5.31 313 294 A 16 ASN HBy A 12 THR HG2% 1.0 . 4.43 314 295 A 61 TYR HE% A 60 LYS HE2 1.0 . 4.98 315 295 A 61 TYR HE% A 60 LYS HE3 1.0 . 4.98 316 296 A 27 GLU H A 24 ILE HA 1.0 . 4.20 317 297 A 24 ILE HA A 27 GLU HBy 1.0 . 3.84 318 298 A 38 PHE HBy A 35 ILE HA 1.0 . 3.87 319 299 A 38 PHE HBy A 34 THR HG2% 1.0 . 4.68 320 300 A 34 THR HG2% A 43 TYR HBy 1.0 . 5.34 321 301 A 38 PHE HBy A 50 VAL HGx% 1.0 . 5.21 322 302 A 3 ILE HD1% A 47 ASN HBy 1.0 . 5.11 323 303 A 57 TRP HE1 A 27 GLU HGx 1.0 . 4.68 324 304 A 15 GLU H A 15 GLU HGx 1.0 . 4.29 325 305 A 57 TRP HZ2 A 23 GLN HGx 1.0 . 5.39 326 306 A 52 GLN H A 52 GLN HGy 1.0 . 4.00 327 307 A 23 GLN H A 23 GLN HGx 1.0 . 4.81 328 308 A 55 GLN HGx A 52 GLN HE2x 1.0 . 5.50 329 309 A 55 GLN HGx A 52 GLN HE2y 1.0 . 5.50 330 310 A 62 HIS HD2 A 61 TYR HBx 1.0 . 4.46 331 311 A 52 GLN HA A 55 GLN HGy 1.0 . 4.52 332 312 A 55 GLN HBx A 56 ARG HA 1.0 . 5.13 333 313 A 48 GLU H A 48 GLU HG2 1.0 . 4.63 334 313 A 48 GLU H A 48 GLU HG3 1.0 . 4.63 335 314 A 18 GLU HGx A 18 GLU H 1.0 . 3.43 336 315 A 48 GLU HA A 48 GLU HG2 1.0 . 4.13 337 315 A 48 GLU HG3 A 48 GLU HA 1.0 . 4.13 338 316 A 48 GLU HB2 A 48 GLU HG2 1.0 . 2.92 339 316 A 48 GLU HB3 A 48 GLU HG2 1.0 . 2.92 340 316 A 48 GLU HG3 A 48 GLU HB2 1.0 . 2.92 341 316 A 48 GLU HG3 A 48 GLU HB3 1.0 . 2.92 342 317 A 16 ASN H A 18 GLU HGx 1.0 . 4.28 343 318 A 6 ILE HD1% A 55 GLN HGy 1.0 . 3.37 344 319 A 18 GLU HGy A 16 ASN HBy 1.0 . 4.27 345 320 A 28 SER H A 27 GLU HBy 1.0 . 3.71 346 321 A 57 TRP HD1 A 27 GLU HBy 1.0 . 3.11 347 322 A 26 LEU HBy A 27 GLU HBy 1.0 . 4.85 348 323 A 59 GLU HA A 59 GLU HGy 1.0 . 3.89 349 324 A 54 LEU H A 52 GLN HBx 1.0 . 5.39 350 325 A 54 LEU H A 55 GLN HBy 1.0 . 5.50 351 326 A 38 PHE HZ A 6 ILE HB 1.0 . 4.13 352 327 A 48 GLU H A 48 GLU HB2 1.0 . 4.12 353 327 A 48 GLU H A 48 GLU HB3 1.0 . 4.12 354 328 A 18 GLU H A 17 GLU HB2 1.0 . 4.51 355 328 A 18 GLU H A 17 GLU HB3 1.0 . 4.51 356 329 A 15 GLU H A 15 GLU HBx 1.0 . 3.93 357 330 A 24 ILE HA A 23 GLN HB2 1.0 . 4.41 358 330 A 24 ILE HA A 23 GLN HB3 1.0 . 4.41 359 331 A 24 ILE HD1% A 10 LEU HG 1.0 . 5.33 360 332 A 56 ARG HD3 A 56 ARG HBx 1.0 . 4.11 361 332 A 56 ARG HBx A 56 ARG HD2 1.0 . 4.11 362 333 A 9 GLY H A 10 LEU HBx 1.0 . 5.03 363 334 A 10 LEU H A 10 LEU HBx 1.0 . 3.31 364 335 A 1 MET HBx A 5 ASP HBx 1.0 . 5.50 365 336 A 15 GLU H A 15 GLU HBy 1.0 . 3.93 366 337 A 16 ASN H A 15 GLU HBy 1.0 . 3.67 367 338 A 57 TRP HE3 A 58 LEU HBx 1.0 . 3.87 368 339 A 58 LEU HBx A 58 LEU HDy% 1.0 . 3.36 369 340 A 58 LEU HBx A 58 LEU HDx% 1.0 . 3.36 370 341 A 56 ARG HD3 A 56 ARG HBy 1.0 . 4.11 371 341 A 56 ARG HBy A 56 ARG HD2 1.0 . 4.11 372 342 A 4 SER H A 3 ILE HB 1.0 . 4.43 373 343 A 57 TRP HE3 A 58 LEU HG 1.0 . 3.40 374 344 A 57 TRP HZ3 A 58 LEU HG 1.0 . 4.48 375 345 A 11 ARG HB3 A 11 ARG HD2 1.0 . 3.29 376 345 A 11 ARG HB2 A 11 ARG HD2 1.0 . 3.29 377 345 A 11 ARG HD3 A 11 ARG HB2 1.0 . 3.29 378 345 A 11 ARG HB3 A 11 ARG HD3 1.0 . 3.29 379 346 A 21 PHE HE% A 39 ILE HB 1.0 . 4.39 380 347 A 36 SER HA A 39 ILE HB 1.0 . 3.89 381 348 A 21 PHE HE% A 14 VAL HB 1.0 . 4.58 382 349 A 21 PHE HE% A 39 ILE HG1x 1.0 . 5.14 383 350 A 57 TRP HH2 A 13 LEU HG 1.0 . 4.49 384 351 A 19 THR HG2% A 13 LEU HBx 1.0 . 3.70 385 352 A 19 THR HG2% A 13 LEU HG 1.0 . 3.98 386 353 A 35 ILE HG2% A 39 ILE HG1x 1.0 . 4.19 387 354 A 24 ILE HD1% A 13 LEU HBx 1.0 . 4.87 388 355 A 15 GLU H A 14 VAL HB 1.0 . 4.03 389 356 A 39 ILE H A 39 ILE HG1x 1.0 . 3.28 390 357 A 38 PHE HD% A 39 ILE HG1x 1.0 . 3.62 391 358 A 39 ILE HA A 39 ILE HG1x 1.0 . 3.75 392 359 A 22 LYS H A 22 LYS HBx 1.0 . 3.58 393 360 A 23 GLN H A 22 LYS HBx 1.0 . 3.88 394 361 A 57 TRP HE3 A 58 LEU HBy 1.0 . 4.71 395 362 A 62 HIS HD2 A 58 LEU HBy 1.0 . 4.60 396 363 A 58 LEU HBy A 58 LEU HDx% 1.0 . 3.91 397 364 A 22 LYS H A 22 LYS HBy 1.0 . 3.58 398 365 A 23 GLN H A 22 LYS HBy 1.0 . 3.88 399 366 A 43 TYR HE% A 50 VAL HB 1.0 . 4.36 400 367 A 34 THR HG2% A 50 VAL HB 1.0 . 4.54 401 368 A 38 PHE HE% A 50 VAL HB 1.0 . 4.60 402 369 A 38 PHE HD% A 50 VAL HB 1.0 . 4.10 403 370 A 62 HIS HD2 A 61 TYR HBy 1.0 . 4.58 404 371 A 21 PHE HD% A 35 ILE HB 1.0 . 4.49 405 372 A 35 ILE HB A 32 THR HA 1.0 . 3.56 406 373 A 54 LEU HBx A 6 ILE HG2% 1.0 . 3.55 407 374 A 10 LEU HDx% A 54 LEU HBx 1.0 . 4.20 408 375 A 30 LEU HDx% A 54 LEU HBx 1.0 . 4.58 409 376 A 54 LEU HDx% A 54 LEU HBx 1.0 . 3.29 410 377 A 49 ARG H A 49 ARG HGy 1.0 . 4.69 411 378 A 11 ARG HA A 11 ARG HGy 1.0 . 3.94 412 379 A 38 PHE HD% A 7 ARG HBx 1.0 . 4.85 413 380 A 61 TYR HE% A 60 LYS HD2 1.0 . 5.33 414 380 A 61 TYR HE% A 60 LYS HD3 1.0 . 5.33 415 381 A 22 LYS H A 22 LYS HGx 1.0 . 4.88 416 382 A 22 LYS HE3 A 22 LYS HGx 1.0 . 4.24 417 382 A 22 LYS HE2 A 22 LYS HGx 1.0 . 4.24 418 383 A 7 ARG HD3 A 7 ARG HBx 1.0 . 3.66 419 383 A 7 ARG HBx A 7 ARG HD2 1.0 . 3.66 420 384 A 35 ILE HD1% A 30 LEU HBx 1.0 . 3.37 421 385 A 24 ILE H A 24 ILE HG1x 1.0 . 3.09 422 386 A 57 TRP HZ2 A 24 ILE HG1x 1.0 . 4.66 423 387 A 57 TRP HH2 A 24 ILE HG1x 1.0 . 4.69 424 388 A 24 ILE HA A 24 ILE HG1x 1.0 . 3.84 425 389 A 24 ILE HG1x A 23 GLN HB2 1.0 . 4.11 426 389 A 24 ILE HG1x A 23 GLN HB3 1.0 . 4.11 427 390 A 24 ILE HG1x A 35 ILE HG2% 1.0 . 4.87 428 391 A 24 ILE HG2% A 24 ILE HG1x 1.0 . 3.65 429 392 A 34 THR HG2% A 30 LEU HBx 1.0 . 4.16 430 393 A 25 ALA HB% A 25 ALA H 1.0 . 2.95 431 394 A 31 SER H A 25 ALA HB% 1.0 . 4.86 432 395 A 31 SER H A 35 ILE HG1x 1.0 . 5.50 433 396 A 34 THR HG2% A 35 ILE HG1x 1.0 . 3.96 434 397 A 35 ILE HG2% A 10 LEU HBy 1.0 . 3.97 435 398 A 24 ILE HG2% A 10 LEU HBy 1.0 . 4.73 436 399 A 25 ALA HB% A 24 ILE HG2% 1.0 . 5.32 437 400 A 24 ILE HG2% A 35 ILE HG1x 1.0 . 5.30 438 401 A 22 LYS H A 22 LYS HGy 1.0 . 4.88 439 402 A 25 ALA HB% A 22 LYS H 1.0 . 5.50 440 403 A 35 ILE HA A 35 ILE HG1x 1.0 . 3.72 441 404 A 22 LYS HE3 A 22 LYS HGy 1.0 . 4.24 442 404 A 22 LYS HGy A 22 LYS HE2 1.0 . 4.24 443 405 A 25 ALA HB% A 35 ILE HD1% 1.0 . 2.88 444 406 A 10 LEU H A 10 LEU HBy 1.0 . 3.65 445 407 A 24 ILE HD1% A 10 LEU HBy 1.0 . 3.99 446 408 A 42 LYS H A 42 LYS HGx 1.0 . 4.37 447 409 A 54 LEU HBy A 55 GLN H 1.0 . 4.32 448 410 A 51 SER HA A 54 LEU HBy 1.0 . 4.55 449 411 A 54 LEU HDx% A 54 LEU HBy 1.0 . 3.31 450 412 A 54 LEU H A 54 LEU HBy 1.0 . 3.77 451 413 A 12 THR H A 12 THR HG2% 1.0 . 3.83 452 414 A 12 THR HG2% A 16 ASN HD2x 1.0 . 3.75 453 415 A 61 TYR H A 60 LYS HGx 1.0 . 4.44 454 416 A 13 LEU H A 12 THR HG2% 1.0 . 3.77 455 417 A 24 ILE HD1% A 24 ILE HB 1.0 . 3.29 456 418 A 38 PHE HD% A 39 ILE HG1y 1.0 . 3.85 457 419 A 42 LYS HGy A 40 ASN HBx 1.0 . 4.97 458 420 A 53 THR HG2% A 53 THR H 1.0 . 4.05 459 421 A 53 THR HG2% A 30 LEU H 1.0 . 4.36 460 422 A 39 ILE HG1y A 36 SER HA 1.0 . 5.16 461 423 A 39 ILE HG1y A 39 ILE HA 1.0 . 3.60 462 424 A 20 THR H A 20 THR HG2% 1.0 . 3.92 463 425 A 32 THR HG2% A 25 ALA H 1.0 . 4.52 464 426 A 20 THR HG2% A 21 PHE HBx 1.0 . 4.83 465 427 A 32 THR HG2% A 21 PHE HBx 1.0 . 5.28 466 428 A 32 THR HG2% A 22 LYS HE2 1.0 . 4.67 467 428 A 32 THR HG2% A 22 LYS HE3 1.0 . 4.67 468 429 A 25 ALA HB% A 32 THR HG2% 1.0 . 3.00 469 430 A 30 LEU HDy% A 30 LEU HBy 1.0 . 3.23 470 431 A 30 LEU HDx% A 30 LEU HBy 1.0 . 3.31 471 432 A 13 LEU H A 13 LEU HBy 1.0 . 3.65 472 433 A 55 GLN HGy A 6 ILE HG1y 1.0 . 3.99 473 434 A 19 THR HG2% A 13 LEU HBy 1.0 . 3.35 474 435 A 13 LEU HBy A 13 LEU HDx% 1.0 . 3.41 475 436 A 6 ILE H A 6 ILE HG1y 1.0 . 3.75 476 437 A 39 ILE HA A 7 ARG HBy 1.0 . 3.98 477 438 A 7 ARG HD3 A 7 ARG HBy 1.0 . 3.66 478 438 A 7 ARG HBy A 7 ARG HD2 1.0 . 3.66 479 439 A 7 ARG H A 6 ILE HG2% 1.0 . 3.79 480 440 A 6 ILE H A 6 ILE HG2% 1.0 . 3.78 481 441 A 38 PHE HE% A 6 ILE HG2% 1.0 . 3.10 482 442 A 38 PHE HZ A 6 ILE HG2% 1.0 . 3.88 483 443 A 38 PHE HD% A 6 ILE HG2% 1.0 . 4.39 484 444 A 38 PHE HD% A 7 ARG HBy 1.0 . 4.85 485 445 A 54 LEU HDy% A 6 ILE HG2% 1.0 . 4.67 486 446 A 10 LEU H A 58 LEU HDy% 1.0 . 4.58 487 447 A 55 GLN HGx A 6 ILE HG2% 1.0 . 4.36 488 448 A 55 GLN HGy A 6 ILE HG2% 1.0 . 3.64 489 449 A 62 HIS HD2 A 58 LEU HDx% 1.0 . 4.44 490 450 A 60 LYS H A 60 LYS HGy 1.0 . 4.28 491 451 A 57 TRP HE3 A 58 LEU HDy% 1.0 . 4.39 492 452 A 57 TRP HZ3 A 58 LEU HDx% 1.0 . 3.86 493 453 A 3 ILE HG2% A 4 SER H 1.0 . 4.00 494 454 A 39 ILE HG1y A 10 LEU HDx% 1.0 . 3.47 495 455 A 39 ILE HG1y A 39 ILE HG2% 1.0 . 3.71 496 456 A 7 ARG H A 3 ILE HG2% 1.0 . 5.50 497 457 A 38 PHE HE% A 3 ILE HG2% 1.0 . 4.19 498 458 A 38 PHE HE% A 3 ILE HD1% 1.0 . 3.95 499 459 A 10 LEU HDx% A 38 PHE HBx 1.0 . 4.74 500 460 A 3 ILE HD1% A 47 ASN HBx 1.0 . 5.11 501 461 A 10 LEU HDx% A 10 LEU HBx 1.0 . 3.16 502 462 A 10 LEU HDx% A 54 LEU HDy% 1.0 . 3.44 503 463 A 24 ILE HD1% A 10 LEU HDx% 1.0 . 4.08 504 464 A 24 ILE HG2% A 10 LEU HDx% 1.0 . 4.35 505 465 A 11 ARG H A 10 LEU HDx% 1.0 . 4.73 506 466 A 11 ARG H A 39 ILE HG2% 1.0 . 4.91 507 467 A 38 PHE HD% A 10 LEU HDx% 1.0 . 3.33 508 468 A 39 ILE HG2% A 36 SER HA 1.0 . 4.63 509 469 A 39 ILE HG2% A 11 ARG HD2 1.0 . 4.11 510 469 A 39 ILE HG2% A 11 ARG HD3 1.0 . 4.11 511 470 A 10 LEU HDx% A 39 ILE HG1x 1.0 . 3.39 512 471 A 39 ILE HG2% A 39 ILE HG1x 1.0 . 3.73 513 472 A 10 LEU HDx% A 10 LEU HBy 1.0 . 3.23 514 473 A 10 LEU HDx% A 35 ILE HG2% 1.0 . 3.73 515 474 A 10 LEU HDx% A 21 PHE HE% 1.0 . 4.96 516 475 A 39 ILE HG2% A 21 PHE HE% 1.0 . 5.29 517 476 A 6 ILE HD1% A 1 MET HG2 1.0 . 5.35 518 476 A 6 ILE HD1% A 1 MET HG3 1.0 . 5.35 519 477 A 39 ILE HG2% A 40 ASN HBy 1.0 . 5.50 520 478 A 6 ILE HD1% A 51 SER HA 1.0 . 4.21 521 479 A 6 ILE HD1% A 55 GLN HGx 1.0 . 4.08 522 480 A 6 ILE HD1% A 6 ILE HB 1.0 . 3.27 523 481 A 58 LEU H A 58 LEU HDx% 1.0 . 4.57 524 482 A 58 LEU H A 10 LEU HDy% 1.0 . 4.99 525 483 A 10 LEU H A 10 LEU HDy% 1.0 . 4.05 526 484 A 57 TRP HE3 A 10 LEU HDy% 1.0 . 3.33 527 485 A 57 TRP HZ3 A 10 LEU HDy% 1.0 . 3.28 528 486 A 10 LEU HDy% A 10 LEU HBx 1.0 . 3.34 529 487 A 10 LEU HDy% A 10 LEU HBy 1.0 . 3.91 530 488 A 54 LEU HDy% A 10 LEU HDy% 1.0 . 3.53 531 489 A 24 ILE HD1% A 10 LEU HDy% 1.0 . 3.27 532 490 A 54 LEU HDx% A 10 LEU HDy% 1.0 . 3.95 533 491 A 24 ILE HG2% A 10 LEU HDy% 1.0 . 3.76 534 492 A 26 LEU H A 26 LEU HDy% 1.0 . 4.93 535 493 A 26 LEU HBx A 26 LEU HDx% 1.0 . 3.84 536 494 A 26 LEU HBx A 26 LEU HDy% 1.0 . 3.84 537 495 A 10 LEU HDy% A 54 LEU HBy 1.0 . 3.47 538 496 A 39 ILE H A 39 ILE HD1% 1.0 . 4.07 539 497 A 39 ILE HD1% A 21 PHE HZ 1.0 . 3.83 540 498 A 39 ILE HD1% A 21 PHE HE% 1.0 . 3.52 541 499 A 38 PHE HE% A 39 ILE HD1% 1.0 . 5.50 542 500 A 39 ILE HD1% A 39 ILE HA 1.0 . 3.97 543 501 A 39 ILE HD1% A 39 ILE HB 1.0 . 3.24 544 502 A 38 PHE HD% A 39 ILE HD1% 1.0 . 4.24 545 503 A 39 ILE HD1% A 10 LEU HBy 1.0 . 3.47 546 504 A 53 THR HG2% A 30 LEU HDy% 1.0 . 3.50 547 505 A 39 ILE HD1% A 35 ILE HG2% 1.0 . 3.10 548 506 A 39 ILE HD1% A 24 ILE HD1% 1.0 . 4.04 549 507 A 30 LEU HDy% A 50 VAL HA 1.0 . 4.08 550 508 A 19 THR HG2% A 19 THR H 1.0 . 3.82 551 509 A 19 THR HG2% A 57 TRP HZ2 1.0 . 4.03 552 510 A 19 THR HG2% A 13 LEU H 1.0 . 5.48 553 511 A 21 PHE HD% A 35 ILE HG1y 1.0 . 5.50 554 512 A 19 THR HG2% A 61 TYR HE% 1.0 . 4.78 555 513 A 19 THR HG2% A 57 TRP HH2 1.0 . 3.34 556 514 A 19 THR HG2% A 24 ILE HG1x 1.0 . 3.48 557 515 A 19 THR HG2% A 24 ILE HD1% 1.0 . 3.10 558 516 A 35 ILE HG1y A 36 SER H 1.0 . 5.04 559 517 A 35 ILE HG1y A 28 SER HBy 1.0 . 5.50 560 518 A 35 ILE HG1y A 32 THR HA 1.0 . 5.50 561 519 A 35 ILE HA A 35 ILE HG1y 1.0 . 3.59 562 520 A 54 LEU HDy% A 35 ILE HG1y 1.0 . 3.44 563 521 A 38 PHE HD% A 50 VAL HGy% 1.0 . 4.49 564 522 A 54 LEU HDx% A 35 ILE HG1y 1.0 . 3.81 565 523 A 43 TYR HD% A 50 VAL HGy% 1.0 . 4.63 566 524 A 61 TYR HE% A 13 LEU HDy% 1.0 . 4.41 567 525 A 57 TRP HH2 A 13 LEU HDy% 1.0 . 4.13 568 526 A 61 TYR HD% A 13 LEU HDy% 1.0 . 4.41 569 527 A 18 GLU HGy A 13 LEU HDy% 1.0 . 5.45 570 528 A 13 LEU HBy A 13 LEU HDy% 1.0 . 3.41 571 529 A 34 THR HG2% A 34 THR H 1.0 . 4.09 572 530 A 34 THR HG2% A 35 ILE H 1.0 . 3.86 573 531 A 38 PHE HD% A 35 ILE HG2% 1.0 . 4.47 574 532 A 21 PHE HE% A 35 ILE HG2% 1.0 . 3.98 575 533 A 21 PHE HD% A 35 ILE HG2% 1.0 . 3.40 576 534 A 35 ILE HG2% A 36 SER HA 1.0 . 4.33 577 535 A 35 ILE HA A 35 ILE HG2% 1.0 . 3.23 578 536 A 35 ILE HG2% A 38 PHE HBx 1.0 . 4.23 579 537 A 35 ILE HG1x A 35 ILE HG2% 1.0 . 3.41 580 538 A 35 ILE HG2% A 24 ILE HB 1.0 . 3.58 581 539 A 35 ILE HD1% A 35 ILE HG2% 1.0 . 3.00 582 540 A 54 LEU HDx% A 35 ILE HG2% 1.0 . 3.75 583 541 A 31 SER H A 30 LEU HDx% 1.0 . 4.53 584 542 A 30 LEU HDx% A 28 SER HBy 1.0 . 4.45 585 543 A 30 LEU HDx% A 50 VAL HA 1.0 . 3.80 586 544 A 35 ILE HA A 30 LEU HDx% 1.0 . 4.37 587 545 A 30 LEU HDx% A 30 LEU HBx 1.0 . 3.12 588 546 A 53 THR HG2% A 30 LEU HDx% 1.0 . 3.10 589 547 A 30 LEU HDx% A 54 LEU HDx% 1.0 . 3.51 590 548 A 15 GLU H A 14 VAL HGx% 1.0 . 4.23 591 549 A 11 ARG H A 14 VAL HGx% 1.0 . 5.41 592 550 A 11 ARG H A 14 VAL HGy% 1.0 . 5.41 593 551 A 21 PHE HZ A 14 VAL HGx% 1.0 . 4.26 594 552 A 21 PHE HZ A 14 VAL HGy% 1.0 . 4.26 595 553 A 21 PHE HE% A 14 VAL HGx% 1.0 . 3.92 596 554 A 21 PHE HE% A 14 VAL HGy% 1.0 . 3.92 597 555 A 61 TYR HD% A 13 LEU HDx% 1.0 . 4.41 598 556 A 35 ILE HD1% A 36 SER H 1.0 . 4.30 599 557 A 30 LEU H A 35 ILE HD1% 1.0 . 4.23 600 558 A 57 TRP HE3 A 54 LEU HDy% 1.0 . 4.33 601 559 A 21 PHE HD% A 35 ILE HD1% 1.0 . 4.36 602 560 A 38 PHE HD% A 54 LEU HDy% 1.0 . 4.80 603 561 A 57 TRP HZ3 A 54 LEU HDy% 1.0 . 4.99 604 562 A 54 LEU HDy% A 38 PHE HBx 1.0 . 5.50 605 563 A 24 ILE HA A 35 ILE HD1% 1.0 . 4.84 606 564 A 35 ILE HD1% A 35 ILE HB 1.0 . 3.23 607 565 A 35 ILE HD1% A 24 ILE HB 1.0 . 3.24 608 566 A 54 LEU HDy% A 54 LEU HBy 1.0 . 3.55 609 567 A 32 THR HG2% A 35 ILE HD1% 1.0 . 3.61 610 568 A 24 ILE HD1% A 35 ILE HD1% 1.0 . 3.51 611 569 A 24 ILE HG2% A 35 ILE HD1% 1.0 . 2.81 612 570 A 30 LEU HDx% A 54 LEU HDy% 1.0 . 2.82 613 571 A 57 TRP HZ2 A 24 ILE HD1% 1.0 . 4.72 614 572 A 21 PHE HD% A 24 ILE HD1% 1.0 . 3.78 615 573 A 24 ILE HD1% A 25 ALA H 1.0 . 4.78 616 574 A 24 ILE HD1% A 21 PHE HE% 1.0 . 4.72 617 575 A 24 ILE HA A 24 ILE HD1% 1.0 . 4.22 618 576 A 24 ILE HD1% A 35 ILE HG2% 1.0 . 3.38 619 577 A 38 PHE HE% A 54 LEU HDx% 1.0 . 3.58 620 578 A 38 PHE HD% A 54 LEU HDx% 1.0 . 3.29 621 579 A 35 ILE HA A 54 LEU HDx% 1.0 . 3.96 622 580 A 54 LEU HDx% A 38 PHE HBx 1.0 . 4.38 623 581 A 38 PHE HBy A 54 LEU HDx% 1.0 . 4.53 624 582 A 54 LEU HDx% A 6 ILE HG2% 1.0 . 3.65 625 583 A 10 LEU HDx% A 54 LEU HDx% 1.0 . 3.13 626 584 A 43 TYR HD% A 50 VAL HGx% 1.0 . 4.63 627 585 A 38 PHE HE% A 50 VAL HGx% 1.0 . 5.46 628 586 A 38 PHE HD% A 50 VAL HGx% 1.0 . 4.49 629 587 A 43 TYR HE% A 50 VAL HGx% 1.0 . 4.44 630 588 A 38 PHE HBx A 50 VAL HGx% 1.0 . 5.50 631 589 A 57 TRP HZ2 A 24 ILE HG2% 1.0 . 4.66 632 590 A 57 TRP HE3 A 24 ILE HG2% 1.0 . 4.52 633 591 A 24 ILE HG2% A 57 TRP HD1 1.0 . 4.76 634 592 A 24 ILE HA A 24 ILE HG2% 1.0 . 3.19 635 593 A 24 ILE HG2% A 35 ILE HG2% 1.0 . 3.48 636 594 A 24 ILE HG2% A 24 ILE HD1% 1.0 . 2.94 637 595 A 24 ILE HG2% A 54 LEU HDx% 1.0 . 4.47 638 596 A 57 TRP HZ2 A 24 ILE HG1y 1.0 . 4.11 639 597 A 57 TRP HH2 A 24 ILE HG1y 1.0 . 4.13 640 598 A 24 ILE HA A 24 ILE HG1y 1.0 . 3.61 641 599 A 24 ILE HG2% A 24 ILE HG1y 1.0 . 3.41 642 600 A 3 ILE HA A 3 ILE HG1x 1.0 . 3.91 643 601 A 57 TRP HE3 A 57 TRP HBx 1.0 . 3.64 644 602 A 54 LEU HA A 57 TRP HBx 1.0 . 4.19 645 603 A 13 LEU HA A 13 LEU HDx% 1.0 . 4.02 646 604 A 57 TRP H A 56 ARG H 1.0 . 3.13 647 605 A 1 MET HE% A 6 ILE HG1x 1.0 . 4.37 648 606 A 52 GLN HA A 52 GLN HGx 1.0 . 4.18 649 607 A 52 GLN HA A 55 GLN HBy 1.0 . 4.08 650 608 A 11 ARG H A 10 LEU HBy 1.0 . 4.03 651 609 A 10 LEU H A 10 LEU HG 1.0 . 3.40 652 610 A 23 GLN H A 22 LYS HGy 1.0 . 5.05 653 611 A 24 ILE HG1x A 25 ALA H 1.0 . 5.17 654 612 A 11 ARG H A 10 LEU HG 1.0 . 4.35 655 613 A 34 THR HG2% A 43 TYR HD% 1.0 . 4.32 656 614 A 7 ARG HA A 7 ARG HD2 1.0 . 4.93 657 614 A 7 ARG HD3 A 7 ARG HA 1.0 . 4.93 658 615 A 7 ARG HA A 10 LEU HBy 1.0 . 5.23 659 616 A 11 ARG HA A 10 LEU HBy 1.0 . 5.50 660 617 A 6 ILE HD1% A 6 ILE HA 1.0 . 4.25 661 618 A 39 ILE HG2% A 7 ARG HA 1.0 . 4.72 662 619 A 39 ILE HG2% A 11 ARG HA 1.0 . 4.76 663 620 A 22 LYS HA A 22 LYS HGy 1.0 . 3.95 664 621 A 25 ALA HB% A 22 LYS HA 1.0 . 3.62 665 622 A 7 ARG H A 38 PHE HZ 1.0 . 4.83 666 623 A 51 SER H A 38 PHE HZ 1.0 . 5.50 667 624 A 50 VAL H A 52 GLN H 1.0 . 4.48 668 625 A 49 ARG H A 49 ARG HD2 1.0 . 5.50 669 625 A 49 ARG H A 49 ARG HD3 1.0 . 5.50 670 626 A 35 ILE HA A 38 PHE HBx 1.0 . 3.65 671 627 A 43 TYR H A 42 LYS HBx 1.0 . 4.44 672 628 A 30 LEU HDx% A 54 LEU HG 1.0 . 3.46 673 629 A 30 LEU HDy% A 30 LEU HBx 1.0 . 3.47 674 630 A 28 SER HA A 54 LEU HDy% 1.0 . 5.11 675 631 A 28 SER HG A 28 SER H 1.0 . 3.15 676 632 A 38 PHE HE% A 51 SER HBx 1.0 . 4.08 677 633 A 38 PHE HE% A 3 ILE HA 1.0 . 4.77 678 634 A 5 ASP H A 4 SER H 1.0 . 4.51 679 635 A 58 LEU HBy A 58 LEU HDy% 1.0 . 3.91 680 636 A 34 THR H A 31 SER HBy 1.0 . 5.50 681 637 A 6 ILE HA A 6 ILE HG1x 1.0 . 3.70 682 638 A 7 ARG HGy A 4 SER HA 1.0 . 4.22 683 639 A 7 ARG HGx A 4 SER HA 1.0 . 4.69 684 640 A 8 ALA HA A 7 ARG HGx 1.0 . 4.72 685 641 A 10 LEU HA A 58 LEU HDx% 1.0 . 5.31 686 642 A 10 LEU HA A 13 LEU HBx 1.0 . 3.97 687 643 A 38 PHE HZ A 7 ARG HA 1.0 . 5.41 688 644 A 34 THR HG2% A 50 VAL H 1.0 . 5.50 689 645 A 14 VAL H A 12 THR HA 1.0 . 4.81 690 646 A 18 GLU H A 16 ASN HA 1.0 . 4.75 691 647 A 18 GLU HB3 A 13 LEU HDy% 1.0 . 3.75 692 647 A 13 LEU HDy% A 18 GLU HB2 1.0 . 3.75 693 648 A 18 GLU HGy A 19 THR H 1.0 . 5.06 694 649 A 20 THR H A 19 THR H 1.0 . 5.20 695 650 A 20 THR H A 24 ILE HG1x 1.0 . 4.79 696 651 A 32 THR HG2% A 33 GLY H 1.0 . 4.77 697 652 A 23 GLN HE2x A 23 GLN HB2 1.0 . 5.06 698 652 A 23 GLN HB3 A 23 GLN HE2x 1.0 . 5.06 699 653 A 54 LEU HA A 53 THR HA 1.0 . 5.15 700 654 A 19 THR HG2% A 24 ILE H 1.0 . 4.38 701 655 A 24 ILE HG2% A 35 ILE HG1y 1.0 . 4.18 702 656 A 19 THR HG2% A 24 ILE HG1y 1.0 . 3.99 703 657 A 25 ALA HB% A 29 GLY H 1.0 . 5.50 704 658 A 24 ILE HA A 27 GLU HBx 1.0 . 5.10 705 659 A 22 LYS HA A 32 THR HA 1.0 . 5.23 706 660 A 25 ALA HA A 28 SER HBy 1.0 . 4.36 707 661 A 30 LEU HDy% A 28 SER HBx 1.0 . 5.50 708 662 A 31 SER HA A 33 GLY H 1.0 . 5.50 709 663 A 31 SER HA A 34 THR H 1.0 . 5.50 710 664 A 31 SER H A 34 THR H 1.0 . 5.09 711 665 A 35 ILE HG1y A 35 ILE HG2% 1.0 . 3.65 712 666 A 24 ILE H A 35 ILE HG2% 1.0 . 5.50 713 667 A 38 PHE HBy A 37 SER H 1.0 . 5.50 714 668 A 37 SER H A 43 TYR HBy 1.0 . 5.50 715 669 A 38 PHE H A 43 TYR HBx 1.0 . 4.95 716 670 A 38 PHE H A 36 SER HA 1.0 . 4.87 717 671 A 42 LYS H A 38 PHE HA 1.0 . 5.31 718 672 A 38 PHE HBy A 43 TYR HE% 1.0 . 5.50 719 673 A 47 ASN HA A 50 VAL HGx% 1.0 . 5.20 720 674 A 38 PHE HBy A 50 VAL HGy% 1.0 . 5.21 721 675 A 7 ARG H A 54 LEU HDx% 1.0 . 5.50 722 676 A 51 SER H A 54 LEU HDx% 1.0 . 5.50 723 677 A 54 LEU H A 52 GLN H 1.0 . 4.61 724 678 A 52 GLN HGy A 53 THR H 1.0 . 5.50 725 679 A 55 GLN HGx A 53 THR H 1.0 . 5.50 726 680 A 54 LEU HDx% A 50 VAL HA 1.0 . 5.00 727 681 A 54 LEU H A 55 GLN HGy 1.0 . 4.95 728 682 A 6 ILE HD1% A 4 SER H 1.0 . 5.46 729 683 A 54 LEU HDx% A 55 GLN H 1.0 . 5.23 730 684 A 57 TRP HBx A 56 ARG H 1.0 . 4.93 731 685 A 38 PHE HD% A 50 VAL H 1.0 . 5.50 732 686 A 53 THR HG2% A 57 TRP H 1.0 . 4.58 733 687 A 53 THR HG2% A 57 TRP HBy 1.0 . 5.14 734 688 A 62 HIS HD2 A 58 LEU HG 1.0 . 4.51 735 689 A 57 TRP HZ3 A 58 LEU HBx 1.0 . 4.97 736 690 A 57 TRP HZ3 A 61 TYR HBy 1.0 . 5.08 737 691 A 57 TRP HZ3 A 61 TYR HBx 1.0 . 5.50 738 692 A 57 TRP HH2 A 61 TYR HBx 1.0 . 5.50 739 693 A 60 LYS H A 59 GLU HGy 1.0 . 5.30 740 694 A 61 TYR HE% A 27 GLU HBy 1.0 . 4.93 741 695 A 60 LYS HB3 A 60 LYS HE2 1.0 . 4.44 742 695 A 60 LYS HB2 A 60 LYS HE2 1.0 . 4.44 743 695 A 60 LYS HE3 A 60 LYS HB2 1.0 . 4.44 744 695 A 60 LYS HB3 A 60 LYS HE3 1.0 . 4.44 745 696 A 62 HIS H A 60 LYS HA 1.0 . 5.50 746 697 A 62 HIS H A 63 ALA HA 1.0 . 5.50 747 698 A 63 ALA H A 62 HIS HBx 1.0 . 4.92 748 699 A 57 TRP HE1 A 61 TYR HE% 1.0 . 5.03 749 700 A 57 TRP HE1 A 61 TYR HD% 1.0 . 5.08 750 701 A 1 MET HE% A 1 MET HG2 1.0 . 4.01 751 701 A 1 MET HE% A 1 MET HG3 1.0 . 4.01 752 702 A 7 ARG H A 4 SER HA 1.0 . 4.10 753 703 A 38 PHE HE% A 39 ILE HA 1.0 . 4.86 754 704 A 38 PHE HD% A 38 PHE HZ 1.0 . 3.94 755 705 A 38 PHE HD% A 51 SER H 1.0 . 5.19 756 706 A 38 PHE HE% A 50 VAL HGy% 1.0 . 5.46 757 707 A 21 PHE HD% A 21 PHE HZ 1.0 . 3.99 758 708 A 21 PHE HD% A 36 SER HBy 1.0 . 5.30 759 709 A 39 ILE HG2% A 21 PHE HZ 1.0 . 5.12 760 710 A 57 TRP HE3 A 10 LEU HDx% 1.0 . 5.50 761 711 A 29 GLY H A 35 ILE HD1% 1.0 . 5.13 762 712 A 24 ILE HG2% A 57 TRP HBy 1.0 . 5.16 763 713 A 57 TRP HH2 A 61 TYR HD% 1.0 . 4.11 764 714 A 57 TRP HE1 A 28 SER H 1.0 . 5.37 765 715 A 57 TRP HZ2 A 27 GLU HBy 1.0 . 4.95 766 716 A 24 ILE HD1% A 14 VAL HA 1.0 . 4.89 767 717 A 30 LEU HBx A 28 SER HBy 1.0 . 4.85 768 718 A 30 LEU HBx A 28 SER HBx 1.0 . 5.23 769 719 A 61 TYR HD% A 57 TRP HD1 1.0 . 4.96 770 720 A 62 HIS HD2 A 61 TYR HD% 1.0 . 4.87 771 721 A 24 ILE HG2% A 54 LEU HA 1.0 . 5.14 772 722 A 57 TRP HZ2 A 23 GLN HGy 1.0 . 5.39 773 723 A 63 ALA H A 61 TYR HBx 1.0 . 5.50 774 724 A 24 ILE HD1% A 10 LEU HA 1.0 . 5.15 775 725 A 53 THR HB A 50 VAL HGx% 1.0 . 5.50 776 726 A 58 LEU H A 54 LEU HBy 1.0 . 5.28 777 727 A 18 GLU HB3 A 13 LEU HDx% 1.0 . 3.75 778 727 A 13 LEU HDx% A 18 GLU HB2 1.0 . 3.75 779 728 A 13 LEU HBy A 18 GLU HB2 1.0 . 3.35 780 728 A 13 LEU HBy A 18 GLU HB3 1.0 . 3.35 781 729 A 24 ILE HG2% A 30 LEU HDx% 1.0 . 4.43 782 730 A 19 THR HG2% A 18 GLU HGx 1.0 . 5.50 783 731 A 19 THR HG2% A 18 GLU HGy 1.0 . 5.04 784 732 A 18 GLU HGy A 13 LEU HDx% 1.0 . 5.45 785 733 A 16 ASN H A 14 VAL H 1.0 . 4.32 786 734 A 61 TYR HD% A 58 LEU HA 1.0 . 4.76 787 735 A 24 ILE HD1% A 21 PHE HZ 1.0 . 5.47 788 736 A 57 TRP HE3 A 24 ILE HD1% 1.0 . 5.50 789 737 A 57 TRP HZ2 A 61 TYR HBy 1.0 . 5.50 790 738 A 63 ALA H A 61 TYR HBy 1.0 . 5.50 791 739 A 30 LEU H A 28 SER HG 1.0 . 4.04 792 740 A 20 THR H A 23 GLN HGx 1.0 . 5.28 793 741 A 20 THR H A 23 GLN HGy 1.0 . 5.28 794 742 A 23 GLN HE2y A 23 GLN HB2 1.0 . 5.06 795 742 A 23 GLN HB3 A 23 GLN HE2y 1.0 . 5.06 796 743 A 18 GLU HGx A 16 ASN HBy 1.0 . 4.29 797 744 A 4 SER H A 2 ASN HB2 1.0 . 5.08 798 744 A 4 SER H A 2 ASN HB3 1.0 . 5.08 799 745 A 7 ARG HE A 7 ARG HBy 1.0 . 5.50 800 746 A 7 ARG HE A 7 ARG HBx 1.0 . 5.50 801 747 A 8 ALA HB% A 7 ARG HE 1.0 . 5.50 802 748 A 41 ASP HA A 7 ARG HD2 1.0 . 5.40 803 748 A 7 ARG HD3 A 41 ASP HA 1.0 . 5.40 804 749 A 6 ILE HB A 3 ILE HA 1.0 . 3.93 805 750 A 38 PHE HD% A 54 LEU HG 1.0 . 5.14 806 751 A 57 TRP HE1 A 27 GLU HA 1.0 . 5.08 807 752 A 27 GLU HA A 27 GLU HGy 1.0 . 3.86 808 753 A 12 THR HB A 13 LEU HBx 1.0 . 5.01 809 754 A 19 THR HB A 13 LEU HG 1.0 . 5.50 810 755 A 61 TYR HE% A 57 TRP HD1 1.0 . 4.91 811 756 A 3 ILE HG2% A 4 SER HA 1.0 . 4.36 812 757 A 10 LEU HDx% A 10 LEU HA 1.0 . 4.84 813 758 A 61 TYR H A 60 LYS HGy 1.0 . 4.44 814 759 A 16 ASN HBx A 12 THR HG2% 1.0 . 5.50 815 760 A 27 GLU HBx A 57 TRP HD1 1.0 . 4.29 816 761 A 55 GLN HGy A 6 ILE HG1x 1.0 . 3.99 817 762 A 7 ARG HA A 10 LEU HG 1.0 . 5.50 818 763 A 5 ASP HBy A 1 MET HBx 1.0 . 5.50 819 764 A 1 MET HE% A 5 ASP HBy 1.0 . 5.11 820 765 A 1 MET HE% A 5 ASP HBx 1.0 . 5.11 821 766 A 39 ILE HG2% A 40 ASN HBx 1.0 . 5.50 822 767 A 27 GLU HA A 26 LEU HBy 1.0 . 4.68 823 768 A 27 GLU HA A 26 LEU HG 1.0 . 5.31 824 769 A 35 ILE H A 33 GLY HAx 1.0 . 5.50 825 770 A 35 ILE H A 33 GLY HAy 1.0 . 5.50 826 771 A 40 ASN H A 39 ILE HG1x 1.0 . 4.65 827 772 A 24 ILE HD1% A 35 ILE HG1y 1.0 . 5.02 828 773 A 30 LEU HDx% A 28 SER HG 1.0 . 5.09 829 774 A 58 LEU H A 54 LEU HDy% 1.0 . 5.27 830 775 A 55 GLN HE2y A 1 MET HBx 1.0 . 5.50 831 776 A 36 SER H A 34 THR H 1.0 . 5.50 832 777 A 32 THR HB A 33 GLY H 1.0 . 4.62 833 778 A 31 SER H A 25 ALA HA 1.0 . 5.50 834 779 A 61 TYR H A 60 LYS HD2 1.0 . 5.50 835 779 A 61 TYR H A 60 LYS HD3 1.0 . 5.50 836 780 A 53 THR HA A 56 ARG HD2 1.0 . 4.93 837 780 A 56 ARG HD3 A 53 THR HA 1.0 . 4.93 838 781 A 43 TYR HD% A 37 SER HA 1.0 . 5.50 839 782 A 43 TYR HD% A 50 VAL HB 1.0 . 4.97 840 783 A 1 MET HBy A 5 ASP HBy 1.0 . 5.50 841 784 A 1 MET HBy A 5 ASP HBx 1.0 . 5.50 842 785 A 52 GLN HE2y A 52 GLN HBx 1.0 . 5.50 843 786 A 55 GLN HE2y A 1 MET HBy 1.0 . 5.50 844 787 A 6 ILE HD1% A 1 MET HE% 1.0 . 4.67 845 788 A 39 ILE HG2% A 10 LEU HBx 1.0 . 4.90 846 789 A 1 MET HE% A 6 ILE HG1y 1.0 . 4.37 847 790 A 20 THR HG2% A 14 VAL HA 1.0 . 5.50 848 791 A 35 ILE HG1y A 38 PHE HBx 1.0 . 5.50 849 792 A 38 PHE HBx A 50 VAL HGy% 1.0 . 5.50 850 793 A 13 LEU H A 10 LEU HBy 1.0 . 5.50 851 794 A 25 ALA HB% A 21 PHE HD% 1.0 . 5.50 852 795 A 63 ALA H A 59 GLU HA 1.0 . 5.50 853 796 A 2 ASN H A 1 MET HBy 1.0 . 4.92 854 797 A 40 ASN HBy A 42 LYS HGx 1.0 . 4.97 855 798 A 40 ASN HBy A 42 LYS HGy 1.0 . 4.97 856 799 A 38 PHE HZ A 3 ILE HB 1.0 . 5.50 857 800 A 38 PHE HZ A 3 ILE HG2% 1.0 . 3.77 858 801 A 38 PHE HZ A 3 ILE HD1% 1.0 . 3.96 859 802 A 61 TYR HD% A 60 LYS HD2 1.0 . 5.16 860 802 A 61 TYR HD% A 60 LYS HD3 1.0 . 5.16 861 803 A 47 ASN H A 49 ARG H 1.0 . 5.50 862 804 A 51 SER H A 49 ARG H 1.0 . 5.50 863 805 A 51 SER H A 53 THR H 1.0 . 5.50 864 806 A 34 THR H A 35 ILE H 1.0 . 3.63 865 807 A 8 ALA HB% A 9 GLY HAx 1.0 . 4.04 866 808 A 40 ASN HBx A 42 LYS HGx 1.0 . 4.97 867 809 A 61 TYR HA A 60 LYS HE2 1.0 . 5.50 868 809 A 61 TYR HA A 60 LYS HE3 1.0 . 5.50 869 810 A 54 LEU HA A 6 ILE HG2% 1.0 . 5.50 870 811 A 30 LEU H A 25 ALA HA 1.0 . 3.43 871 812 A 30 LEU H A 28 SER HBx 1.0 . 3.98 872 813 A 30 LEU H A 30 LEU HBx 1.0 . 3.12 873 814 A 30 LEU H A 30 LEU HBy 1.0 . 3.74 874 815 A 30 LEU H A 30 LEU HDy% 1.0 . 3.81 875 816 A 30 LEU H A 30 LEU HDx% 1.0 . 3.95 876 817 A 30 LEU H A 28 SER H 1.0 . 4.17 877 818 A 30 LEU H A 29 GLY H 1.0 . 3.01 878 819 A 22 LYS H A 20 THR HB 1.0 . 3.64 879 820 A 22 LYS H A 20 THR HG2% 1.0 . 4.10 880 821 A 32 THR HG2% A 22 LYS H 1.0 . 4.64 881 822 A 22 LYS H A 23 GLN H 1.0 . 3.57 882 823 A 14 VAL H A 13 LEU HBx 1.0 . 3.06 883 824 A 14 VAL H A 13 LEU HBy 1.0 . 3.64 884 825 A 14 VAL H A 14 VAL HGx% 1.0 . 3.63 885 826 A 14 VAL H A 13 LEU H 1.0 . 3.15 886 827 A 15 GLU H A 14 VAL H 1.0 . 3.23 887 828 A 37 SER H A 37 SER HBx 1.0 . 3.12 888 829 A 37 SER H A 37 SER HBy 1.0 . 3.12 889 830 A 37 SER H A 34 THR HA 1.0 . 4.05 890 831 A 37 SER H A 36 SER HBy 1.0 . 4.06 891 832 A 27 GLU H A 27 GLU HBy 1.0 . 2.84 892 833 A 27 GLU H A 26 LEU HBx 1.0 . 3.85 893 834 A 27 GLU H A 26 LEU HBy 1.0 . 3.17 894 835 A 27 GLU H A 26 LEU HDx% 1.0 . 5.41 895 836 A 27 GLU H A 26 LEU HDy% 1.0 . 5.41 896 837 A 27 GLU H A 28 SER H 1.0 . 3.08 897 838 A 24 ILE H A 21 PHE HA 1.0 . 3.81 898 839 A 24 ILE H A 23 GLN HB2 1.0 . 3.00 899 839 A 24 ILE H A 23 GLN HB3 1.0 . 3.00 900 840 A 24 ILE H A 25 ALA HB% 1.0 . 4.59 901 841 A 24 ILE H A 24 ILE HB 1.0 . 3.01 902 842 A 24 ILE H A 24 ILE HD1% 1.0 . 3.77 903 843 A 24 ILE H A 24 ILE HG2% 1.0 . 3.83 904 844 A 24 ILE H A 24 ILE HG1y 1.0 . 3.64 905 845 A 24 ILE H A 25 ALA H 1.0 . 3.29 906 846 A 25 ALA HA A 28 SER H 1.0 . 3.70 907 847 A 28 SER H A 28 SER HBx 1.0 . 3.61 908 848 A 28 SER H A 28 SER HBy 1.0 . 3.20 909 849 A 24 ILE HG2% A 28 SER H 1.0 . 4.13 910 850 A 42 LYS H A 41 ASP HA 1.0 . 3.15 911 851 A 42 LYS H A 42 LYS HBx 1.0 . 3.77 912 852 A 42 LYS H A 42 LYS HBy 1.0 . 3.31 913 853 A 42 LYS H A 42 LYS HGy 1.0 . 4.37 914 854 A 10 LEU H A 9 GLY HAy 1.0 . 3.01 915 855 A 10 LEU H A 10 LEU HDx% 1.0 . 3.71 916 856 A 11 ARG H A 10 LEU H 1.0 . 3.03 917 857 A 6 ILE H A 5 ASP HBx 1.0 . 3.76 918 858 A 6 ILE H A 5 ASP HBy 1.0 . 3.76 919 859 A 6 ILE H A 6 ILE HB 1.0 . 2.91 920 860 A 6 ILE H A 6 ILE HG1x 1.0 . 3.75 921 861 A 6 ILE H A 6 ILE HD1% 1.0 . 3.61 922 862 A 41 ASP H A 41 ASP HA 1.0 . 2.74 923 863 A 41 ASP H A 40 ASN HBy 1.0 . 4.50 924 864 A 41 ASP H A 41 ASP HBy 1.0 . 4.10 925 865 A 26 LEU H A 26 LEU HBx 1.0 . 2.98 926 866 A 26 LEU H A 26 LEU HBy 1.0 . 2.93 927 867 A 25 ALA HB% A 26 LEU H 1.0 . 3.03 928 868 A 26 LEU H A 26 LEU HDx% 1.0 . 4.93 929 869 A 40 ASN H A 41 ASP H 1.0 . 3.21 930 870 A 25 ALA H A 26 LEU H 1.0 . 3.05 931 871 A 42 LYS H A 41 ASP H 1.0 . 3.38 932 872 A 38 PHE H A 35 ILE HA 1.0 . 3.72 933 873 A 38 PHE H A 38 PHE HBx 1.0 . 3.14 934 874 A 38 PHE HBy A 38 PHE H 1.0 . 2.89 935 875 A 38 PHE H A 37 SER H 1.0 . 3.29 936 876 A 39 ILE H A 36 SER HA 1.0 . 3.91 937 877 A 39 ILE H A 39 ILE HB 1.0 . 2.83 938 878 A 39 ILE H A 39 ILE HG1y 1.0 . 3.59 939 879 A 39 ILE H A 39 ILE HG2% 1.0 . 3.80 940 880 A 39 ILE H A 38 PHE HD% 1.0 . 3.61 941 881 A 52 GLN HA A 55 GLN H 1.0 . 3.79 942 882 A 55 GLN HGx A 55 GLN H 1.0 . 3.61 943 883 A 55 GLN HGy A 55 GLN H 1.0 . 2.88 944 884 A 55 GLN HBy A 55 GLN H 1.0 . 2.87 945 885 A 54 LEU HBx A 55 GLN H 1.0 . 3.40 946 886 A 6 ILE HG2% A 55 GLN H 1.0 . 3.59 947 887 A 6 ILE HD1% A 55 GLN H 1.0 . 3.92 948 888 A 55 GLN H A 56 ARG H 1.0 . 3.03 949 889 A 31 SER H A 30 LEU HA 1.0 . 2.62 950 890 A 31 SER H A 31 SER HBx 1.0 . 3.54 951 891 A 31 SER H A 31 SER HBy 1.0 . 3.54 952 892 A 31 SER H A 30 LEU HBx 1.0 . 3.44 953 893 A 31 SER H A 30 LEU HBy 1.0 . 3.10 954 894 A 31 SER H A 30 LEU HDy% 1.0 . 3.73 955 895 A 34 THR HG2% A 31 SER H 1.0 . 3.90 956 896 A 7 ARG H A 7 ARG HD2 1.0 . 4.49 957 896 A 7 ARG H A 7 ARG HD3 1.0 . 4.49 958 897 A 7 ARG H A 7 ARG HGy 1.0 . 3.16 959 898 A 7 ARG H A 3 ILE HA 1.0 . 5.14 960 899 A 7 ARG H A 6 ILE HB 1.0 . 3.43 961 900 A 11 ARG H A 11 ARG HA 1.0 . 2.93 962 901 A 11 ARG H A 11 ARG HD2 1.0 . 4.04 963 901 A 11 ARG H A 11 ARG HD3 1.0 . 4.04 964 902 A 11 ARG H A 10 LEU HBx 1.0 . 3.21 965 903 A 11 ARG H A 11 ARG HB2 1.0 . 2.73 966 903 A 11 ARG H A 11 ARG HB3 1.0 . 2.73 967 904 A 11 ARG H A 11 ARG HGx 1.0 . 3.71 968 905 A 11 ARG H A 11 ARG HGy 1.0 . 3.71 969 906 A 11 ARG H A 39 ILE HD1% 1.0 . 4.14 970 907 A 53 THR HB A 53 THR H 1.0 . 2.71 971 908 A 53 THR H A 49 ARG HA 1.0 . 4.63 972 909 A 50 VAL HA A 53 THR H 1.0 . 3.61 973 910 A 52 GLN HBx A 53 THR H 1.0 . 3.41 974 911 A 53 THR H A 52 GLN HBy 1.0 . 3.71 975 912 A 30 LEU HDx% A 53 THR H 1.0 . 4.28 976 913 A 43 TYR H A 42 LYS HA 1.0 . 3.50 977 914 A 38 PHE HA A 43 TYR H 1.0 . 3.98 978 915 A 43 TYR HBx A 43 TYR H 1.0 . 3.31 979 916 A 43 TYR HBy A 43 TYR H 1.0 . 3.37 980 917 A 2 ASN H A 1 MET HA 1.0 . 3.52 981 918 A 25 ALA H A 24 ILE HB 1.0 . 3.36 982 919 A 35 ILE HD1% A 25 ALA H 1.0 . 3.43 983 920 A 24 ILE HG2% A 25 ALA H 1.0 . 3.87 984 921 A 50 VAL H A 47 ASN HA 1.0 . 4.20 985 922 A 50 VAL H A 50 VAL HB 1.0 . 2.80 986 923 A 50 VAL H A 50 VAL HGy% 1.0 . 3.95 987 924 A 50 VAL H A 50 VAL HGx% 1.0 . 3.95 988 925 A 51 SER H A 50 VAL H 1.0 . 3.21 989 926 A 51 SER H A 51 SER HBx 1.0 . 3.58 990 927 A 51 SER H A 50 VAL HB 1.0 . 3.06 991 928 A 51 SER H A 50 VAL HGy% 1.0 . 3.90 992 929 A 51 SER H A 50 VAL HGx% 1.0 . 3.90 993 930 A 51 SER H A 38 PHE HE% 1.0 . 4.09 994 931 A 55 GLN HBx A 55 GLN HE2y 1.0 . 4.13 995 932 A 12 THR H A 12 THR HB 1.0 . 2.72 996 933 A 12 THR H A 10 LEU HA 1.0 . 4.35 997 934 A 12 THR H A 11 ARG HA 1.0 . 3.56 998 935 A 12 THR H A 11 ARG HB2 1.0 . 3.55 999 935 A 11 ARG HB3 A 12 THR H 1.0 . 3.55 1000 936 A 12 THR H A 13 LEU H 1.0 . 3.23 1001 937 A 11 ARG H A 12 THR H 1.0 . 3.08 1002 938 A 29 GLY H A 28 SER H 1.0 . 2.87 1003 939 A 18 GLU H A 18 GLU HB2 1.0 . 3.22 1004 939 A 18 GLU H A 18 GLU HB3 1.0 . 3.22 1005 940 A 16 ASN H A 12 THR HA 1.0 . 4.41 1006 941 A 16 ASN H A 16 ASN HBy 1.0 . 2.82 1007 942 A 16 ASN H A 15 GLU HBx 1.0 . 3.67 1008 943 A 15 GLU H A 16 ASN H 1.0 . 3.26 1009 944 A 16 ASN H A 18 GLU H 1.0 . 4.37 1010 945 A 53 THR HA A 56 ARG H 1.0 . 4.09 1011 946 A 55 GLN HGx A 56 ARG H 1.0 . 4.84 1012 947 A 55 GLN HBx A 56 ARG H 1.0 . 3.82 1013 948 A 55 GLN HBy A 56 ARG H 1.0 . 3.14 1014 949 A 56 ARG H A 56 ARG HGx 1.0 . 3.86 1015 950 A 56 ARG H A 56 ARG HGy 1.0 . 3.86 1016 951 A 36 SER H A 36 SER HBx 1.0 . 3.54 1017 952 A 36 SER H A 36 SER HBy 1.0 . 3.54 1018 953 A 35 ILE HB A 36 SER H 1.0 . 3.01 1019 954 A 35 ILE HG2% A 36 SER H 1.0 . 3.59 1020 955 A 36 SER H A 35 ILE H 1.0 . 3.29 1021 956 A 34 THR HB A 35 ILE H 1.0 . 3.16 1022 957 A 35 ILE HB A 35 ILE H 1.0 . 2.77 1023 958 A 35 ILE HG1x A 35 ILE H 1.0 . 3.10 1024 959 A 35 ILE HG1y A 35 ILE H 1.0 . 3.65 1025 960 A 35 ILE HD1% A 35 ILE H 1.0 . 3.45 1026 961 A 30 LEU HBy A 35 ILE H 1.0 . 4.80 1027 962 A 35 ILE HG2% A 35 ILE H 1.0 . 3.77 1028 963 A 8 ALA H A 5 ASP HA 1.0 . 3.49 1029 964 A 8 ALA HA A 8 ALA H 1.0 . 2.87 1030 965 A 7 ARG HGx A 8 ALA H 1.0 . 3.34 1031 966 A 8 ALA H A 8 ALA HB% 1.0 . 2.43 1032 967 A 20 THR H A 19 THR HA 1.0 . 3.18 1033 968 A 20 THR H A 23 GLN HB2 1.0 . 3.16 1034 968 A 20 THR H A 23 GLN HB3 1.0 . 3.16 1035 969 A 20 THR H A 23 GLN H 1.0 . 3.96 1036 970 A 49 ARG H A 48 GLU HB2 1.0 . 3.31 1037 970 A 49 ARG H A 48 GLU HB3 1.0 . 3.31 1038 971 A 49 ARG H A 49 ARG HBx 1.0 . 3.47 1039 972 A 49 ARG H A 49 ARG HGx 1.0 . 4.69 1040 973 A 40 ASN H A 37 SER HA 1.0 . 4.67 1041 974 A 40 ASN H A 39 ILE HB 1.0 . 3.24 1042 975 A 40 ASN H A 39 ILE HG2% 1.0 . 3.78 1043 976 A 39 ILE H A 40 ASN H 1.0 . 3.37 1044 977 A 54 LEU H A 53 THR HB 1.0 . 3.03 1045 978 A 54 LEU H A 51 SER HA 1.0 . 3.68 1046 979 A 54 LEU H A 54 LEU HBx 1.0 . 2.85 1047 980 A 54 LEU H A 54 LEU HG 1.0 . 2.78 1048 981 A 54 LEU H A 30 LEU HDx% 1.0 . 3.71 1049 982 A 54 LEU H A 54 LEU HDy% 1.0 . 3.67 1050 983 A 54 LEU H A 54 LEU HDx% 1.0 . 3.86 1051 984 A 54 LEU H A 53 THR H 1.0 . 3.06 1052 985 A 54 LEU H A 55 GLN H 1.0 . 3.01 1053 986 A 61 TYR H A 61 TYR HBx 1.0 . 3.43 1054 987 A 61 TYR H A 61 TYR HBy 1.0 . 2.83 1055 988 A 61 TYR H A 60 LYS H 1.0 . 2.94 1056 989 A 61 TYR H A 61 TYR HD% 1.0 . 3.63 1057 990 A 23 GLN H A 23 GLN HGy 1.0 . 4.81 1058 991 A 23 GLN H A 23 GLN HB2 1.0 . 2.90 1059 991 A 23 GLN H A 23 GLN HB3 1.0 . 2.90 1060 992 A 20 THR HB A 23 GLN H 1.0 . 3.95 1061 993 A 25 ALA HB% A 23 GLN H 1.0 . 5.50 1062 994 A 20 THR HG2% A 23 GLN H 1.0 . 4.27 1063 995 A 60 LYS H A 60 LYS HB2 1.0 . 2.61 1064 995 A 60 LYS H A 60 LYS HB3 1.0 . 2.61 1065 996 A 60 LYS H A 60 LYS HGx 1.0 . 4.28 1066 997 A 60 LYS H A 59 GLU HBx 1.0 . 3.81 1067 998 A 60 LYS H A 59 GLU HBy 1.0 . 3.81 1068 999 A 58 LEU H A 55 GLN HA 1.0 . 3.62 1069 1000 A 58 LEU H A 57 TRP HBx 1.0 . 3.03 1070 1001 A 58 LEU H A 57 TRP HBy 1.0 . 4.16 1071 1002 A 58 LEU H A 58 LEU HBx 1.0 . 2.77 1072 1003 A 58 LEU H A 58 LEU HG 1.0 . 3.77 1073 1004 A 58 LEU H A 58 LEU HBy 1.0 . 3.58 1074 1005 A 57 TRP HE3 A 58 LEU H 1.0 . 3.19 1075 1006 A 19 THR HB A 19 THR H 1.0 . 4.19 1076 1007 A 19 THR H A 14 VAL HA 1.0 . 3.93 1077 1008 A 19 THR H A 18 GLU HB2 1.0 . 3.91 1078 1008 A 19 THR H A 18 GLU HB3 1.0 . 3.91 1079 1009 A 18 GLU H A 19 THR H 1.0 . 3.20 1080 1010 A 52 GLN H A 52 GLN HGx 1.0 . 3.06 1081 1011 A 52 GLN H A 52 GLN HBx 1.0 . 2.78 1082 1012 A 52 GLN H A 52 GLN HBy 1.0 . 3.70 1083 1013 A 34 THR HB A 34 THR H 1.0 . 3.26 1084 1014 A 13 LEU H A 10 LEU HA 1.0 . 3.82 1085 1015 A 13 LEU H A 13 LEU HBx 1.0 . 2.83 1086 1016 A 13 LEU H A 13 LEU HDy% 1.0 . 3.90 1087 1017 A 13 LEU H A 13 LEU HDx% 1.0 . 3.90 1088 1018 A 12 THR HG2% A 16 ASN HD2y 1.0 . 3.75 1089 1019 A 57 TRP H A 57 TRP HBx 1.0 . 2.79 1090 1020 A 57 TRP H A 57 TRP HBy 1.0 . 2.79 1091 1021 A 57 TRP H A 56 ARG HBx 1.0 . 3.52 1092 1022 A 57 TRP H A 56 ARG HBy 1.0 . 3.52 1093 1023 A 58 LEU H A 57 TRP H 1.0 . 2.94 1094 1024 A 17 GLU H A 17 GLU HA 1.0 . 2.74 1095 1025 A 17 GLU H A 14 VAL HA 1.0 . 3.82 1096 1026 A 17 GLU H A 17 GLU HB2 1.0 . 3.29 1097 1026 A 17 GLU H A 17 GLU HB3 1.0 . 3.29 1098 1027 A 17 GLU H A 18 GLU H 1.0 . 3.27 1099 1028 A 62 HIS H A 62 HIS HBx 1.0 . 3.67 1100 1029 A 62 HIS H A 62 HIS HBy 1.0 . 3.67 1101 1030 A 62 HIS H A 61 TYR HBx 1.0 . 3.46 1102 1031 A 62 HIS H A 61 TYR HBy 1.0 . 3.82 1103 1032 A 62 HIS H A 61 TYR HD% 1.0 . 4.54 1104 1033 A 9 GLY H A 9 GLY HAx 1.0 . 2.94 1105 1034 A 9 GLY H A 9 GLY HAy 1.0 . 2.59 1106 1035 A 9 GLY H A 8 ALA HB% 1.0 . 3.06 1107 1036 A 9 GLY H A 58 LEU HDx% 1.0 . 5.08 1108 1037 A 59 GLU H A 55 GLN HA 1.0 . 4.28 1109 1038 A 59 GLU H A 56 ARG HA 1.0 . 3.73 1110 1039 A 59 GLU H A 59 GLU HBx 1.0 . 3.61 1111 1040 A 59 GLU H A 59 GLU HBy 1.0 . 3.61 1112 1041 A 59 GLU H A 58 LEU HBy 1.0 . 3.48 1113 1042 A 59 GLU H A 58 LEU HDx% 1.0 . 5.50 1114 1043 A 59 GLU H A 58 LEU HDy% 1.0 . 5.50 1115 1044 A 59 GLU H A 60 LYS H 1.0 . 3.01 1116 1045 A 59 GLU H A 58 LEU H 1.0 . 3.10 1117 1046 A 59 GLU H A 58 LEU HBx 1.0 . 3.51 1118 1047 A 58 LEU H A 58 LEU HDy% 1.0 . 4.57 1119 1048 A 54 LEU H A 50 VAL HA 1.0 . 4.42 1120 1049 A 54 LEU H A 6 ILE HG2% 1.0 . 4.51 1121 1050 A 55 GLN H A 53 THR H 1.0 . 4.40 1122 1051 A 54 LEU HG A 53 THR H 1.0 . 4.65 1123 1052 A 51 SER H A 3 ILE HD1% 1.0 . 4.35 1124 1053 A 51 SER H A 52 GLN H 1.0 . 3.28 1125 1054 A 52 GLN H A 49 ARG HA 1.0 . 4.81 1126 1055 A 53 THR H A 52 GLN HGx 1.0 . 5.02 1127 1056 A 32 THR HA A 35 ILE H 1.0 . 3.78 1128 1057 A 30 LEU HG A 29 GLY H 1.0 . 4.61 1129 1058 A 35 ILE HD1% A 28 SER H 1.0 . 4.65 1130 1059 A 25 ALA HB% A 28 SER H 1.0 . 5.04 1131 1060 A 29 GLY H A 28 SER HBx 1.0 . 4.54 1132 1061 A 29 GLY H A 28 SER HBy 1.0 . 4.34 1133 1062 A 9 GLY H A 5 ASP HA 1.0 . 4.73 1134 1063 A 9 GLY H A 10 LEU H 1.0 . 3.52 1135 1064 A 9 GLY H A 10 LEU HG 1.0 . 5.02 1136 1065 A 20 THR H A 19 THR HB 1.0 . 4.66 1137 1066 A 16 ASN HBy A 18 GLU H 1.0 . 4.67 1138 1067 A 13 LEU HA A 19 THR H 1.0 . 5.37 1139 1068 A 18 GLU HGx A 19 THR H 1.0 . 4.48 1140 1069 A 17 GLU H A 19 THR H 1.0 . 5.15 1141 1070 A 23 GLN H A 22 LYS HGx 1.0 . 5.05 1142 1071 A 24 ILE HG1x A 23 GLN H 1.0 . 5.15 1143 1072 A 24 ILE H A 23 GLN HGx 1.0 . 5.00 1144 1073 A 24 ILE H A 23 GLN HGy 1.0 . 5.00 1145 1074 A 24 ILE H A 22 LYS HA 1.0 . 5.44 1146 1075 A 24 ILE H A 25 ALA HA 1.0 . 5.50 1147 1076 A 24 ILE H A 35 ILE HD1% 1.0 . 4.40 1148 1077 A 41 ASP H A 40 ASN HBx 1.0 . 4.50 1149 1078 A 6 ILE H A 7 ARG H 1.0 . 3.28 1150 1079 A 27 GLU H A 26 LEU H 1.0 . 3.42 1151 1080 A 27 GLU H A 27 GLU HBx 1.0 . 4.01 1152 1081 A 27 GLU H A 25 ALA HB% 1.0 . 4.76 1153 1082 A 57 TRP HD1 A 28 SER H 1.0 . 4.49 1154 1083 A 24 ILE HA A 28 SER H 1.0 . 4.36 1155 1084 A 53 THR HG2% A 28 SER H 1.0 . 5.09 1156 1085 A 27 GLU HBx A 28 SER H 1.0 . 4.06 1157 1086 A 29 GLY H A 27 GLU HBy 1.0 . 4.87 1158 1087 A 8 ALA H A 7 ARG HD2 1.0 . 4.67 1159 1087 A 8 ALA H A 7 ARG HD3 1.0 . 4.67 1160 1088 A 8 ALA H A 7 ARG HGy 1.0 . 3.28 1161 1089 A 8 ALA H A 10 LEU HDx% 1.0 . 5.50 1162 1090 A 8 ALA H A 39 ILE HG2% 1.0 . 5.50 1163 1091 A 9 GLY H A 8 ALA H 1.0 . 3.26 1164 1092 A 7 ARG H A 6 ILE HD1% 1.0 . 4.99 1165 1093 A 7 ARG H A 10 LEU HDx% 1.0 . 5.43 1166 1094 A 6 ILE H A 4 SER HA 1.0 . 5.50 1167 1095 A 35 ILE HG1x A 36 SER H 1.0 . 4.44 1168 1096 A 37 SER H A 36 SER H 1.0 . 3.18 1169 1097 A 37 SER H A 38 PHE HBx 1.0 . 4.90 1170 1098 A 37 SER H A 35 ILE HG2% 1.0 . 5.50 1171 1099 A 37 SER H A 35 ILE HB 1.0 . 5.05 1172 1100 A 38 PHE H A 34 THR HA 1.0 . 4.80 1173 1101 A 38 PHE H A 39 ILE HB 1.0 . 5.28 1174 1102 A 38 PHE H A 39 ILE HG1x 1.0 . 5.50 1175 1103 A 38 PHE H A 34 THR HG2% 1.0 . 4.29 1176 1104 A 39 ILE H A 35 ILE HA 1.0 . 4.49 1177 1105 A 39 ILE H A 35 ILE HG2% 1.0 . 4.52 1178 1106 A 40 ASN H A 38 PHE HA 1.0 . 5.28 1179 1107 A 40 ASN H A 39 ILE HG1y 1.0 . 5.39 1180 1108 A 40 ASN H A 39 ILE HD1% 1.0 . 5.15 1181 1109 A 41 ASP H A 39 ILE HA 1.0 . 4.50 1182 1110 A 42 LYS H A 37 SER HA 1.0 . 4.25 1183 1111 A 43 TYR H A 41 ASP HA 1.0 . 3.99 1184 1112 A 38 PHE HD% A 43 TYR H 1.0 . 5.50 1185 1113 A 43 TYR HD% A 43 TYR H 1.0 . 4.28 1186 1114 A 42 LYS HBy A 43 TYR H 1.0 . 5.13 1187 1115 A 49 ARG H A 49 ARG HBy 1.0 . 3.47 1188 1116 A 48 GLU H A 49 ARG H 1.0 . 5.50 1189 1117 A 12 THR H A 11 ARG HD2 1.0 . 4.68 1190 1117 A 12 THR H A 11 ARG HD3 1.0 . 4.68 1191 1118 A 11 ARG H A 39 ILE HG1y 1.0 . 4.78 1192 1119 A 13 LEU H A 11 ARG HA 1.0 . 5.11 1193 1120 A 19 THR HG2% A 14 VAL H 1.0 . 4.74 1194 1121 A 15 GLU H A 11 ARG HA 1.0 . 4.79 1195 1122 A 16 ASN H A 12 THR HG2% 1.0 . 4.61 1196 1123 A 16 ASN H A 18 GLU HB2 1.0 . 4.74 1197 1123 A 16 ASN H A 18 GLU HB3 1.0 . 4.74 1198 1124 A 16 ASN H A 14 VAL HA 1.0 . 4.44 1199 1125 A 17 GLU H A 16 ASN HBy 1.0 . 4.02 1200 1126 A 17 GLU H A 16 ASN HBx 1.0 . 4.64 1201 1127 A 17 GLU H A 16 ASN HA 1.0 . 3.52 1202 1128 A 15 GLU H A 17 GLU H 1.0 . 4.42 1203 1129 A 43 TYR HBx A 47 ASN HD2y 1.0 . 4.79 1204 1130 A 11 ARG H A 13 LEU H 1.0 . 4.61 1205 1131 A 15 GLU H A 13 LEU H 1.0 . 5.10 1206 1132 A 14 VAL H A 12 THR HB 1.0 . 5.40 1207 1133 A 14 VAL H A 12 THR HG2% 1.0 . 5.44 1208 1134 A 16 ASN HBx A 18 GLU H 1.0 . 5.05 1209 1135 A 19 THR HG2% A 18 GLU H 1.0 . 4.79 1210 1136 A 18 GLU H A 13 LEU HBy 1.0 . 4.77 1211 1137 A 18 GLU HGy A 18 GLU H 1.0 . 4.06 1212 1138 A 19 THR H A 13 LEU HBy 1.0 . 5.14 1213 1139 A 21 PHE HD% A 22 LYS H 1.0 . 5.50 1214 1140 A 25 ALA H A 23 GLN H 1.0 . 4.68 1215 1141 A 25 ALA H A 24 ILE HG1y 1.0 . 5.42 1216 1142 A 35 ILE HD1% A 26 LEU H 1.0 . 5.33 1217 1143 A 24 ILE HG2% A 26 LEU H 1.0 . 5.20 1218 1144 A 26 LEU H A 24 ILE HB 1.0 . 5.50 1219 1145 A 27 GLU H A 28 SER HG 1.0 . 4.85 1220 1146 A 27 GLU H A 23 GLN HA 1.0 . 4.71 1221 1147 A 30 LEU H A 28 SER HBy 1.0 . 4.42 1222 1148 A 30 LEU H A 24 ILE HG2% 1.0 . 5.42 1223 1149 A 31 SER H A 35 ILE HD1% 1.0 . 4.89 1224 1150 A 34 THR H A 31 SER HBx 1.0 . 5.50 1225 1151 A 35 ILE HG1x A 34 THR H 1.0 . 4.79 1226 1152 A 30 LEU HBy A 34 THR H 1.0 . 5.50 1227 1153 A 32 THR HG2% A 34 THR H 1.0 . 5.50 1228 1154 A 54 LEU HDx% A 35 ILE H 1.0 . 5.50 1229 1155 A 25 ALA HA A 35 ILE H 1.0 . 5.50 1230 1156 A 34 THR HA A 36 SER H 1.0 . 5.50 1231 1157 A 21 PHE HBy A 36 SER H 1.0 . 5.50 1232 1158 A 36 SER H A 38 PHE HBx 1.0 . 5.50 1233 1159 A 38 PHE H A 40 ASN H 1.0 . 5.50 1234 1160 A 38 PHE H A 54 LEU HDx% 1.0 . 5.50 1235 1161 A 39 ILE H A 37 SER HA 1.0 . 5.39 1236 1162 A 40 ASN H A 42 LYS HBy 1.0 . 4.88 1237 1163 A 40 ASN H A 36 SER HA 1.0 . 4.87 1238 1164 A 50 VAL HA A 52 GLN H 1.0 . 5.00 1239 1165 A 55 GLN HBx A 52 GLN HE2x 1.0 . 5.50 1240 1166 A 55 GLN HGy A 52 GLN HE2x 1.0 . 5.50 1241 1167 A 52 GLN HE2x A 52 GLN HBx 1.0 . 5.50 1242 1168 A 55 GLN HBx A 52 GLN HE2y 1.0 . 5.50 1243 1169 A 55 GLN HGy A 52 GLN HE2y 1.0 . 5.50 1244 1170 A 51 SER HA A 53 THR H 1.0 . 5.20 1245 1171 A 54 LEU HBx A 53 THR H 1.0 . 4.95 1246 1172 A 50 VAL HB A 53 THR H 1.0 . 5.50 1247 1173 A 53 THR H A 50 VAL HGy% 1.0 . 5.35 1248 1174 A 30 LEU HDy% A 53 THR H 1.0 . 5.25 1249 1175 A 53 THR H A 50 VAL HGx% 1.0 . 5.35 1250 1176 A 54 LEU HDy% A 53 THR H 1.0 . 5.50 1251 1177 A 54 LEU HDx% A 53 THR H 1.0 . 5.50 1252 1178 A 54 LEU H A 6 ILE HD1% 1.0 . 4.90 1253 1179 A 54 LEU HDy% A 55 GLN H 1.0 . 4.85 1254 1180 A 54 LEU HG A 55 GLN H 1.0 . 4.85 1255 1181 A 51 SER HA A 55 GLN H 1.0 . 4.53 1256 1182 A 53 THR HA A 55 GLN H 1.0 . 4.79 1257 1183 A 55 GLN HE2x A 1 MET HBy 1.0 . 5.50 1258 1184 A 58 LEU H A 56 ARG H 1.0 . 4.74 1259 1185 A 54 LEU H A 56 ARG H 1.0 . 4.48 1260 1186 A 54 LEU HA A 56 ARG H 1.0 . 4.85 1261 1187 A 56 ARG H A 56 ARG HD2 1.0 . 4.35 1262 1187 A 56 ARG HD3 A 56 ARG H 1.0 . 4.35 1263 1188 A 53 THR HG2% A 56 ARG H 1.0 . 5.19 1264 1189 A 57 TRP HE3 A 57 TRP H 1.0 . 4.60 1265 1190 A 57 TRP HD1 A 57 TRP H 1.0 . 5.32 1266 1191 A 57 TRP H A 55 GLN H 1.0 . 4.48 1267 1192 A 57 TRP H A 56 ARG HGx 1.0 . 5.17 1268 1193 A 57 TRP H A 56 ARG HGy 1.0 . 5.17 1269 1194 A 57 TRP H A 54 LEU HDy% 1.0 . 5.04 1270 1195 A 57 TRP HZ3 A 58 LEU H 1.0 . 5.13 1271 1196 A 59 GLU H A 60 LYS HB2 1.0 . 5.35 1272 1196 A 59 GLU H A 60 LYS HB3 1.0 . 5.35 1273 1197 A 59 GLU H A 61 TYR HBy 1.0 . 5.50 1274 1198 A 60 LYS H A 61 TYR HBx 1.0 . 5.50 1275 1199 A 60 LYS H A 59 GLU HGx 1.0 . 5.30 1276 1200 A 62 HIS H A 63 ALA HB% 1.0 . 5.50 1277 1201 A 63 ALA H A 62 HIS HBy 1.0 . 4.92 1278 1202 A 1 MET H A 1 MET HG2 1.0 . 5.50 1279 1202 A 1 MET HG3 A 1 MET H 1.0 . 5.50 1280 1203 A 47 ASN HD2x A 47 ASN HA 1.0 . 4.99 1281 1204 A 5 ASP H A 6 ILE HB 1.0 . 4.84 1282 1205 A 5 ASP H A 7 ARG HGy 1.0 . 5.50 1283 1206 A 5 ASP H A 8 ALA HB% 1.0 . 5.50 1284 1207 A 5 ASP H A 1 MET HE% 1.0 . 5.50 1285 1208 A 5 ASP H A 3 ILE HG2% 1.0 . 5.12 1286 1209 A 57 TRP HE1 A 27 GLU HBy 1.0 . 2.95 1287 1210 A 57 TRP HE1 A 27 GLU HBx 1.0 . 4.11 1288 1211 A 57 TRP HE1 A 27 GLU HGy 1.0 . 4.68 1289 1212 A 30 LEU H A 30 LEU HG 1.0 . 2.64 1290 1213 A 62 HIS H A 58 LEU HG 1.0 . 5.50 1291 1214 A 49 ARG H A 48 GLU HG2 1.0 . 4.96 1292 1214 A 49 ARG H A 48 GLU HG3 1.0 . 4.96 1293 1215 A 35 ILE HB A 34 THR H 1.0 . 5.11 1294 1216 A 16 ASN H A 18 GLU HGy 1.0 . 4.24 1295 1217 A 14 VAL H A 24 ILE HD1% 1.0 . 5.50 1296 1218 A 57 TRP HE1 A 24 ILE HG2% 1.0 . 4.46 1297 1219 A 1 MET HE% A 55 GLN HE2y 1.0 . 5.50 1298 1220 A 55 GLN HE2x A 1 MET HBx 1.0 . 5.50 1299 1221 A 55 GLN HE2x A 1 MET HE% 1.0 . 5.50 1300 1222 A 42 LYS H A 37 SER HBy 1.0 . 5.50 1301 1223 A 42 LYS H A 37 SER HBx 1.0 . 5.50 1302 1224 A 16 ASN H A 13 LEU HA 1.0 . 4.13 1303 1225 A 5 ASP H A 1 MET HG2 1.0 . 5.50 1304 1225 A 5 ASP H A 1 MET HG3 1.0 . 5.50 1305 1226 A 5 ASP H A 1 MET HA 1.0 . 5.50 1306 1227 A 10 LEU H A 8 ALA HB% 1.0 . 5.42 1307 1228 A 51 SER H A 47 ASN HA 1.0 . 5.35 1308 1229 A 2 ASN H A 2 ASN HB2 1.0 . 4.16 1309 1229 A 2 ASN HB3 A 2 ASN H 1.0 . 4.16 1310 1230 A 2 ASN H A 1 MET HBx 1.0 . 4.92 1311 1231 A 1 MET HE% A 2 ASN H 1.0 . 5.50 1312 1232 A 2 ASN H A 1 MET HG2 1.0 . 5.29 1313 1232 A 1 MET HG3 A 2 ASN H 1.0 . 5.29 1314 1233 A 43 TYR HBx A 42 LYS H 1.0 . 5.24 1315 1234 A 14 VAL H A 15 GLU HGy 1.0 . 5.50 1316 1235 A 14 VAL H A 18 GLU HGy 1.0 . 5.50 1317 1236 A 14 VAL H A 15 GLU HGx 1.0 . 5.50 1318 1237 A 14 VAL H A 10 LEU HBx 1.0 . 5.50 1319 1238 A 55 GLN HE2y A 0 PRO HA 1.0 . 4.30 1320 1238 A 55 GLN HE2x A 0 PRO HA 1.0 . 4.30 1321 1239 A 55 GLN HE2y A 1 MET H 1.0 . 4.91 1322 1239 A 55 GLN HE2x A 1 MET H 1.0 . 4.91 1323 1240 A 1 MET HE% A 1 MET HBx 1.0 . 4.06 1324 1240 A 1 MET HE% A 1 MET HBy 1.0 . 4.06 1325 1241 A 2 ASN H A 1 MET HBx 1.0 . 4.12 1326 1241 A 2 ASN H A 1 MET HBy 1.0 . 4.12 1327 1242 A 5 ASP H A 1 MET HBx 1.0 . 4.31 1328 1242 A 5 ASP H A 1 MET HBy 1.0 . 4.31 1329 1243 A 1 MET HBx A 5 ASP HBx 1.0 . 3.79 1330 1243 A 1 MET HBy A 5 ASP HBx 1.0 . 3.79 1331 1243 A 5 ASP HBy A 1 MET HBx 1.0 . 3.79 1332 1243 A 1 MET HBy A 5 ASP HBy 1.0 . 3.79 1333 1244 A 55 GLN HE2y A 1 MET HBx 1.0 . 4.28 1334 1244 A 55 GLN HE2x A 1 MET HBx 1.0 . 4.28 1335 1244 A 55 GLN HE2x A 1 MET HBy 1.0 . 4.28 1336 1244 A 55 GLN HE2y A 1 MET HBy 1.0 . 4.28 1337 1245 A 1 MET HG3 A 55 GLN HE2y 1.0 . 3.98 1338 1245 A 55 GLN HE2y A 1 MET HG2 1.0 . 3.98 1339 1245 A 55 GLN HE2x A 1 MET HG2 1.0 . 3.98 1340 1245 A 55 GLN HE2x A 1 MET HG3 1.0 . 3.98 1341 1246 A 1 MET HE% A 5 ASP HBx 1.0 . 4.25 1342 1246 A 1 MET HE% A 5 ASP HBy 1.0 . 4.25 1343 1247 A 1 MET HE% A 6 ILE HG1x 1.0 . 3.74 1344 1247 A 1 MET HE% A 6 ILE HG1y 1.0 . 3.74 1345 1248 A 3 ILE HA A 3 ILE HG1x 1.0 . 3.36 1346 1248 A 3 ILE HA A 3 ILE HG1y 1.0 . 3.36 1347 1249 A 3 ILE HA A 6 ILE HG1x 1.0 . 4.42 1348 1249 A 3 ILE HA A 6 ILE HG1y 1.0 . 4.42 1349 1250 A 3 ILE HB A 51 SER HBy 1.0 . 5.34 1350 1250 A 3 ILE HB A 51 SER HBx 1.0 . 5.34 1351 1251 A 3 ILE HG2% A 51 SER HBy 1.0 . 4.35 1352 1251 A 3 ILE HG2% A 51 SER HBx 1.0 . 4.35 1353 1252 A 4 SER H A 3 ILE HG1x 1.0 . 4.92 1354 1252 A 4 SER H A 3 ILE HG1y 1.0 . 4.92 1355 1253 A 38 PHE HE% A 3 ILE HG1x 1.0 . 4.27 1356 1253 A 38 PHE HE% A 3 ILE HG1y 1.0 . 4.27 1357 1254 A 38 PHE HZ A 3 ILE HG1x 1.0 . 4.13 1358 1254 A 38 PHE HZ A 3 ILE HG1y 1.0 . 4.13 1359 1255 A 3 ILE HG1y A 51 SER HBy 1.0 . 5.18 1360 1255 A 3 ILE HG1x A 51 SER HBy 1.0 . 5.18 1361 1255 A 51 SER HBx A 3 ILE HG1x 1.0 . 5.18 1362 1255 A 3 ILE HG1y A 51 SER HBx 1.0 . 5.18 1363 1256 A 3 ILE HD1% A 47 ASN HBx 1.0 . 4.31 1364 1256 A 3 ILE HD1% A 47 ASN HBy 1.0 . 4.31 1365 1257 A 3 ILE HD1% A 51 SER HBy 1.0 . 4.54 1366 1257 A 3 ILE HD1% A 51 SER HBx 1.0 . 4.54 1367 1258 A 4 SER HA A 7 ARG HBx 1.0 . 4.92 1368 1258 A 4 SER HA A 7 ARG HBy 1.0 . 4.92 1369 1259 A 5 ASP H A 5 ASP HBx 1.0 . 3.10 1370 1259 A 5 ASP H A 5 ASP HBy 1.0 . 3.10 1371 1260 A 5 ASP H A 6 ILE HG1x 1.0 . 5.34 1372 1260 A 5 ASP H A 6 ILE HG1y 1.0 . 5.34 1373 1261 A 6 ILE H A 5 ASP HBx 1.0 . 3.19 1374 1261 A 6 ILE H A 5 ASP HBy 1.0 . 3.19 1375 1262 A 6 ILE HD1% A 5 ASP HBx 1.0 . 5.34 1376 1262 A 6 ILE HD1% A 5 ASP HBy 1.0 . 5.34 1377 1263 A 6 ILE H A 6 ILE HG1x 1.0 . 3.11 1378 1263 A 6 ILE H A 6 ILE HG1y 1.0 . 3.11 1379 1264 A 6 ILE HA A 6 ILE HG1x 1.0 . 3.24 1380 1264 A 6 ILE HA A 6 ILE HG1y 1.0 . 3.24 1381 1265 A 6 ILE HG2% A 6 ILE HG1x 1.0 . 3.32 1382 1265 A 6 ILE HG2% A 6 ILE HG1y 1.0 . 3.32 1383 1266 A 6 ILE HG2% A 51 SER HBy 1.0 . 3.81 1384 1266 A 6 ILE HG2% A 51 SER HBx 1.0 . 3.81 1385 1267 A 38 PHE HZ A 6 ILE HG1x 1.0 . 5.34 1386 1267 A 38 PHE HZ A 6 ILE HG1y 1.0 . 5.34 1387 1268 A 55 GLN HGy A 6 ILE HG1x 1.0 . 3.46 1388 1268 A 55 GLN HGy A 6 ILE HG1y 1.0 . 3.46 1389 1269 A 55 GLN HGx A 6 ILE HG1x 1.0 . 4.00 1390 1269 A 55 GLN HGx A 6 ILE HG1y 1.0 . 4.00 1391 1270 A 55 GLN HE2y A 6 ILE HG1y 1.0 . 3.92 1392 1270 A 55 GLN HE2x A 6 ILE HG1y 1.0 . 3.92 1393 1270 A 55 GLN HE2y A 6 ILE HG1x 1.0 . 3.92 1394 1270 A 55 GLN HE2x A 6 ILE HG1x 1.0 . 3.92 1395 1271 A 6 ILE HD1% A 51 SER HBy 1.0 . 3.32 1396 1271 A 6 ILE HD1% A 51 SER HBx 1.0 . 3.32 1397 1272 A 7 ARG H A 7 ARG HBx 1.0 . 3.37 1398 1272 A 7 ARG H A 7 ARG HBy 1.0 . 3.37 1399 1273 A 7 ARG HBy A 7 ARG HD2 1.0 . 3.17 1400 1273 A 7 ARG HD3 A 7 ARG HBx 1.0 . 3.17 1401 1273 A 7 ARG HD3 A 7 ARG HBy 1.0 . 3.17 1402 1273 A 7 ARG HBx A 7 ARG HD2 1.0 . 3.17 1403 1274 A 7 ARG HE A 7 ARG HBx 1.0 . 4.71 1404 1274 A 7 ARG HE A 7 ARG HBy 1.0 . 4.71 1405 1275 A 8 ALA H A 7 ARG HBx 1.0 . 4.38 1406 1275 A 8 ALA H A 7 ARG HBy 1.0 . 4.38 1407 1276 A 10 LEU HDx% A 7 ARG HBx 1.0 . 4.43 1408 1276 A 10 LEU HDx% A 7 ARG HBy 1.0 . 4.43 1409 1277 A 38 PHE HE% A 7 ARG HBx 1.0 . 4.16 1410 1277 A 38 PHE HE% A 7 ARG HBy 1.0 . 4.16 1411 1278 A 38 PHE HZ A 7 ARG HBx 1.0 . 4.85 1412 1278 A 38 PHE HZ A 7 ARG HBy 1.0 . 4.85 1413 1279 A 39 ILE HA A 7 ARG HBx 1.0 . 3.40 1414 1279 A 39 ILE HA A 7 ARG HBy 1.0 . 3.40 1415 1280 A 39 ILE HG2% A 7 ARG HBx 1.0 . 4.71 1416 1280 A 39 ILE HG2% A 7 ARG HBy 1.0 . 4.71 1417 1281 A 54 LEU HDx% A 7 ARG HBx 1.0 . 4.79 1418 1281 A 54 LEU HDx% A 7 ARG HBy 1.0 . 4.79 1419 1282 A 8 ALA HA A 11 ARG HGx 1.0 . 3.18 1420 1282 A 8 ALA HA A 11 ARG HGy 1.0 . 3.18 1421 1283 A 9 GLY H A 58 LEU HDy% 1.0 . 4.46 1422 1283 A 9 GLY H A 58 LEU HDx% 1.0 . 4.46 1423 1284 A 9 GLY HAx A 58 LEU HDy% 1.0 . 5.09 1424 1284 A 9 GLY HAx A 58 LEU HDx% 1.0 . 5.09 1425 1285 A 9 GLY HAy A 58 LEU HDy% 1.0 . 3.61 1426 1285 A 9 GLY HAy A 58 LEU HDx% 1.0 . 3.61 1427 1286 A 10 LEU H A 11 ARG HGx 1.0 . 5.34 1428 1286 A 10 LEU H A 11 ARG HGy 1.0 . 5.34 1429 1287 A 10 LEU H A 13 LEU HDy% 1.0 . 4.93 1430 1287 A 10 LEU H A 13 LEU HDx% 1.0 . 4.93 1431 1288 A 10 LEU H A 58 LEU HDy% 1.0 . 3.63 1432 1288 A 10 LEU H A 58 LEU HDx% 1.0 . 3.63 1433 1289 A 10 LEU HA A 13 LEU HDy% 1.0 . 3.39 1434 1289 A 10 LEU HA A 13 LEU HDx% 1.0 . 3.39 1435 1290 A 10 LEU HA A 58 LEU HDy% 1.0 . 4.13 1436 1290 A 10 LEU HA A 58 LEU HDx% 1.0 . 4.13 1437 1291 A 10 LEU HBx A 14 VAL HGy% 1.0 . 4.93 1438 1291 A 10 LEU HBx A 14 VAL HGx% 1.0 . 4.93 1439 1292 A 10 LEU HG A 58 LEU HDy% 1.0 . 3.14 1440 1292 A 10 LEU HG A 58 LEU HDx% 1.0 . 3.14 1441 1293 A 10 LEU HDy% A 13 LEU HDy% 1.0 . 3.67 1442 1293 A 10 LEU HDy% A 13 LEU HDx% 1.0 . 3.67 1443 1294 A 11 ARG H A 11 ARG HGx 1.0 . 3.23 1444 1294 A 11 ARG H A 11 ARG HGy 1.0 . 3.23 1445 1295 A 11 ARG H A 14 VAL HGy% 1.0 . 4.71 1446 1295 A 11 ARG H A 14 VAL HGx% 1.0 . 4.71 1447 1296 A 11 ARG HA A 14 VAL HGy% 1.0 . 3.29 1448 1296 A 11 ARG HA A 14 VAL HGx% 1.0 . 3.29 1449 1297 A 12 THR H A 11 ARG HGx 1.0 . 3.74 1450 1297 A 12 THR H A 11 ARG HGy 1.0 . 3.74 1451 1298 A 12 THR H A 13 LEU HDy% 1.0 . 4.77 1452 1298 A 12 THR H A 13 LEU HDx% 1.0 . 4.77 1453 1299 A 12 THR H A 14 VAL HGy% 1.0 . 5.03 1454 1299 A 12 THR H A 14 VAL HGx% 1.0 . 5.03 1455 1300 A 12 THR H A 15 GLU HGy 1.0 . 5.34 1456 1300 A 12 THR H A 15 GLU HGx 1.0 . 5.34 1457 1301 A 12 THR HA A 15 GLU HBx 1.0 . 3.11 1458 1301 A 12 THR HA A 15 GLU HBy 1.0 . 3.11 1459 1302 A 12 THR HB A 13 LEU HDy% 1.0 . 4.39 1460 1302 A 12 THR HB A 13 LEU HDx% 1.0 . 4.39 1461 1303 A 12 THR HG2% A 13 LEU HDy% 1.0 . 4.06 1462 1303 A 12 THR HG2% A 13 LEU HDx% 1.0 . 4.06 1463 1304 A 12 THR HG2% A 16 ASN HD2x 1.0 . 3.22 1464 1304 A 12 THR HG2% A 16 ASN HD2y 1.0 . 3.22 1465 1305 A 13 LEU H A 13 LEU HDy% 1.0 . 3.42 1466 1305 A 13 LEU H A 13 LEU HDx% 1.0 . 3.42 1467 1306 A 13 LEU HA A 13 LEU HDy% 1.0 . 2.88 1468 1306 A 13 LEU HA A 13 LEU HDx% 1.0 . 2.88 1469 1307 A 13 LEU HBy A 14 VAL HGy% 1.0 . 3.90 1470 1307 A 13 LEU HBy A 14 VAL HGx% 1.0 . 3.90 1471 1308 A 14 VAL H A 13 LEU HDy% 1.0 . 4.73 1472 1308 A 14 VAL H A 13 LEU HDx% 1.0 . 4.73 1473 1309 A 18 GLU H A 13 LEU HDy% 1.0 . 4.59 1474 1309 A 18 GLU H A 13 LEU HDx% 1.0 . 4.59 1475 1310 A 13 LEU HDx% A 18 GLU HB2 1.0 . 3.08 1476 1310 A 13 LEU HDy% A 18 GLU HB2 1.0 . 3.08 1477 1310 A 18 GLU HB3 A 13 LEU HDy% 1.0 . 3.08 1478 1310 A 18 GLU HB3 A 13 LEU HDx% 1.0 . 3.08 1479 1311 A 18 GLU HGx A 13 LEU HDy% 1.0 . 3.73 1480 1311 A 18 GLU HGx A 13 LEU HDx% 1.0 . 3.73 1481 1312 A 18 GLU HGy A 13 LEU HDy% 1.0 . 4.04 1482 1312 A 18 GLU HGy A 13 LEU HDx% 1.0 . 4.04 1483 1313 A 19 THR HG2% A 13 LEU HDy% 1.0 . 3.52 1484 1313 A 19 THR HG2% A 13 LEU HDx% 1.0 . 3.52 1485 1314 A 24 ILE HG2% A 13 LEU HDy% 1.0 . 5.44 1486 1314 A 24 ILE HG2% A 13 LEU HDx% 1.0 . 5.44 1487 1315 A 57 TRP HZ3 A 13 LEU HDy% 1.0 . 3.84 1488 1315 A 57 TRP HZ3 A 13 LEU HDx% 1.0 . 3.84 1489 1316 A 13 LEU HDy% A 58 LEU HDy% 1.0 . 3.18 1490 1316 A 13 LEU HDx% A 58 LEU HDy% 1.0 . 3.18 1491 1316 A 58 LEU HDx% A 13 LEU HDy% 1.0 . 3.18 1492 1316 A 58 LEU HDx% A 13 LEU HDx% 1.0 . 3.18 1493 1317 A 61 TYR HD% A 13 LEU HDy% 1.0 . 3.80 1494 1317 A 61 TYR HD% A 13 LEU HDx% 1.0 . 3.80 1495 1318 A 61 TYR HE% A 13 LEU HDy% 1.0 . 3.29 1496 1318 A 61 TYR HE% A 13 LEU HDx% 1.0 . 3.29 1497 1319 A 62 HIS HD2 A 13 LEU HDy% 1.0 . 4.91 1498 1319 A 62 HIS HD2 A 13 LEU HDx% 1.0 . 4.91 1499 1320 A 14 VAL H A 14 VAL HGy% 1.0 . 2.97 1500 1320 A 14 VAL H A 14 VAL HGx% 1.0 . 2.97 1501 1321 A 14 VAL H A 15 GLU HBx 1.0 . 4.42 1502 1321 A 14 VAL H A 15 GLU HBy 1.0 . 4.42 1503 1322 A 14 VAL H A 15 GLU HGy 1.0 . 4.78 1504 1322 A 14 VAL H A 15 GLU HGx 1.0 . 4.78 1505 1323 A 14 VAL HA A 14 VAL HGy% 1.0 . 2.95 1506 1323 A 14 VAL HA A 14 VAL HGx% 1.0 . 2.95 1507 1324 A 15 GLU HA A 14 VAL HGy% 1.0 . 4.43 1508 1324 A 14 VAL HGx% A 15 GLU HA 1.0 . 4.43 1509 1325 A 14 VAL HGx% A 15 GLU HBx 1.0 . 5.28 1510 1325 A 14 VAL HGy% A 15 GLU HBx 1.0 . 5.28 1511 1325 A 15 GLU HBy A 14 VAL HGy% 1.0 . 5.28 1512 1325 A 14 VAL HGx% A 15 GLU HBy 1.0 . 5.28 1513 1326 A 14 VAL HGy% A 15 GLU HGy 1.0 . 4.50 1514 1326 A 14 VAL HGx% A 15 GLU HGy 1.0 . 4.50 1515 1326 A 15 GLU HGx A 14 VAL HGy% 1.0 . 4.50 1516 1326 A 14 VAL HGx% A 15 GLU HGx 1.0 . 4.50 1517 1327 A 16 ASN H A 14 VAL HGy% 1.0 . 4.48 1518 1327 A 16 ASN H A 14 VAL HGx% 1.0 . 4.48 1519 1328 A 17 GLU H A 14 VAL HGy% 1.0 . 5.03 1520 1328 A 17 GLU H A 14 VAL HGx% 1.0 . 5.03 1521 1329 A 18 GLU H A 14 VAL HGy% 1.0 . 5.17 1522 1329 A 18 GLU H A 14 VAL HGx% 1.0 . 5.17 1523 1330 A 19 THR H A 14 VAL HGy% 1.0 . 4.26 1524 1330 A 19 THR H A 14 VAL HGx% 1.0 . 4.26 1525 1331 A 19 THR HG2% A 14 VAL HGy% 1.0 . 3.65 1526 1331 A 19 THR HG2% A 14 VAL HGx% 1.0 . 3.65 1527 1332 A 20 THR H A 14 VAL HGy% 1.0 . 5.44 1528 1332 A 20 THR H A 14 VAL HGx% 1.0 . 5.44 1529 1333 A 20 THR HA A 14 VAL HGy% 1.0 . 4.29 1530 1333 A 20 THR HA A 14 VAL HGx% 1.0 . 4.29 1531 1334 A 20 THR HG2% A 14 VAL HGy% 1.0 . 5.22 1532 1334 A 20 THR HG2% A 14 VAL HGx% 1.0 . 5.22 1533 1335 A 21 PHE H A 14 VAL HGy% 1.0 . 5.29 1534 1335 A 21 PHE H A 14 VAL HGx% 1.0 . 5.29 1535 1336 A 21 PHE HA A 14 VAL HGy% 1.0 . 4.75 1536 1336 A 21 PHE HA A 14 VAL HGx% 1.0 . 4.75 1537 1337 A 21 PHE HE% A 14 VAL HGy% 1.0 . 3.31 1538 1337 A 21 PHE HE% A 14 VAL HGx% 1.0 . 3.31 1539 1338 A 21 PHE HZ A 14 VAL HGy% 1.0 . 3.68 1540 1338 A 21 PHE HZ A 14 VAL HGx% 1.0 . 3.68 1541 1339 A 24 ILE HG2% A 14 VAL HGy% 1.0 . 5.44 1542 1339 A 24 ILE HG2% A 14 VAL HGx% 1.0 . 5.44 1543 1340 A 24 ILE HD1% A 14 VAL HGy% 1.0 . 3.12 1544 1340 A 24 ILE HD1% A 14 VAL HGx% 1.0 . 3.12 1545 1341 A 39 ILE HD1% A 14 VAL HGy% 1.0 . 3.63 1546 1341 A 39 ILE HD1% A 14 VAL HGx% 1.0 . 3.63 1547 1342 A 15 GLU H A 15 GLU HBx 1.0 . 3.28 1548 1342 A 15 GLU H A 15 GLU HBy 1.0 . 3.28 1549 1343 A 15 GLU H A 15 GLU HGy 1.0 . 3.64 1550 1343 A 15 GLU H A 15 GLU HGx 1.0 . 3.64 1551 1344 A 15 GLU HA A 15 GLU HGy 1.0 . 3.51 1552 1344 A 15 GLU HGx A 15 GLU HA 1.0 . 3.51 1553 1345 A 16 ASN H A 15 GLU HBx 1.0 . 3.17 1554 1345 A 16 ASN H A 15 GLU HBy 1.0 . 3.17 1555 1346 A 16 ASN HD2x A 15 GLU HBy 1.0 . 4.24 1556 1346 A 16 ASN HD2y A 15 GLU HBy 1.0 . 4.24 1557 1346 A 16 ASN HD2y A 15 GLU HBx 1.0 . 4.24 1558 1346 A 16 ASN HD2x A 15 GLU HBx 1.0 . 4.24 1559 1347 A 16 ASN H A 15 GLU HGy 1.0 . 4.85 1560 1347 A 16 ASN H A 15 GLU HGx 1.0 . 4.85 1561 1348 A 16 ASN HD2x A 15 GLU HGy 1.0 . 5.18 1562 1348 A 16 ASN HD2y A 15 GLU HGx 1.0 . 5.18 1563 1348 A 16 ASN HD2y A 15 GLU HGy 1.0 . 5.18 1564 1348 A 16 ASN HD2x A 15 GLU HGx 1.0 . 5.18 1565 1349 A 16 ASN H A 16 ASN HD2y 1.0 . 4.62 1566 1349 A 16 ASN H A 16 ASN HD2x 1.0 . 4.62 1567 1350 A 18 GLU HGy A 16 ASN HD2y 1.0 . 5.34 1568 1350 A 18 GLU HGy A 16 ASN HD2x 1.0 . 5.34 1569 1351 A 17 GLU H A 17 GLU HGy 1.0 . 3.31 1570 1351 A 17 GLU H A 17 GLU HGx 1.0 . 3.31 1571 1352 A 17 GLU HA A 17 GLU HGy 1.0 . 3.36 1572 1352 A 17 GLU HA A 17 GLU HGx 1.0 . 3.36 1573 1353 A 20 THR HB A 22 LYS HBy 1.0 . 4.66 1574 1353 A 20 THR HB A 22 LYS HBx 1.0 . 4.66 1575 1354 A 21 PHE HD% A 36 SER HBy 1.0 . 4.56 1576 1354 A 21 PHE HD% A 36 SER HBx 1.0 . 4.56 1577 1355 A 21 PHE HE% A 36 SER HBy 1.0 . 4.30 1578 1355 A 21 PHE HE% A 36 SER HBx 1.0 . 4.30 1579 1356 A 21 PHE HZ A 36 SER HBy 1.0 . 4.62 1580 1356 A 21 PHE HZ A 36 SER HBx 1.0 . 4.62 1581 1357 A 22 LYS H A 22 LYS HGx 1.0 . 4.25 1582 1357 A 22 LYS H A 22 LYS HGy 1.0 . 4.25 1583 1358 A 22 LYS HA A 22 LYS HGx 1.0 . 3.18 1584 1358 A 22 LYS HA A 22 LYS HGy 1.0 . 3.18 1585 1359 A 22 LYS HBx A 22 LYS HE2 1.0 . 5.01 1586 1359 A 22 LYS HBy A 22 LYS HE2 1.0 . 5.01 1587 1359 A 22 LYS HE3 A 22 LYS HBy 1.0 . 5.01 1588 1359 A 22 LYS HE3 A 22 LYS HBx 1.0 . 5.01 1589 1360 A 23 GLN H A 22 LYS HBy 1.0 . 3.26 1590 1360 A 23 GLN H A 22 LYS HBx 1.0 . 3.26 1591 1361 A 23 GLN H A 23 GLN HGy 1.0 . 4.22 1592 1361 A 23 GLN H A 23 GLN HGx 1.0 . 4.22 1593 1362 A 23 GLN HA A 23 GLN HGy 1.0 . 3.56 1594 1362 A 23 GLN HA A 23 GLN HGx 1.0 . 3.56 1595 1363 A 23 GLN HA A 23 GLN HE2y 1.0 . 4.16 1596 1363 A 23 GLN HA A 23 GLN HE2x 1.0 . 4.16 1597 1364 A 23 GLN HA A 26 LEU HDy% 1.0 . 4.98 1598 1364 A 23 GLN HA A 26 LEU HDx% 1.0 . 4.98 1599 1365 A 23 GLN HB3 A 23 GLN HE2x 1.0 . 4.26 1600 1365 A 23 GLN HE2y A 23 GLN HB2 1.0 . 4.26 1601 1365 A 23 GLN HB3 A 23 GLN HE2y 1.0 . 4.26 1602 1365 A 23 GLN HE2x A 23 GLN HB2 1.0 . 4.26 1603 1366 A 24 ILE H A 23 GLN HGy 1.0 . 4.19 1604 1366 A 24 ILE H A 23 GLN HGx 1.0 . 4.19 1605 1367 A 57 TRP HZ2 A 23 GLN HGy 1.0 . 4.54 1606 1367 A 57 TRP HZ2 A 23 GLN HGx 1.0 . 4.54 1607 1368 A 61 TYR HE% A 23 GLN HGy 1.0 . 5.34 1608 1368 A 61 TYR HE% A 23 GLN HGx 1.0 . 5.34 1609 1369 A 26 LEU HBx A 23 GLN HE2y 1.0 . 5.22 1610 1369 A 26 LEU HBx A 23 GLN HE2x 1.0 . 5.22 1611 1370 A 23 GLN HE2x A 26 LEU HDy% 1.0 . 4.29 1612 1370 A 23 GLN HE2y A 26 LEU HDx% 1.0 . 4.29 1613 1370 A 23 GLN HE2x A 26 LEU HDx% 1.0 . 4.29 1614 1370 A 23 GLN HE2y A 26 LEU HDy% 1.0 . 4.29 1615 1371 A 23 GLN HE2x A 27 GLU HGy 1.0 . 3.82 1616 1371 A 23 GLN HE2y A 27 GLU HGx 1.0 . 3.82 1617 1371 A 23 GLN HE2x A 27 GLU HGx 1.0 . 3.82 1618 1371 A 23 GLN HE2y A 27 GLU HGy 1.0 . 3.82 1619 1372 A 24 ILE HA A 27 GLU HGy 1.0 . 5.25 1620 1372 A 24 ILE HA A 27 GLU HGx 1.0 . 5.25 1621 1373 A 26 LEU H A 26 LEU HDy% 1.0 . 3.86 1622 1373 A 26 LEU H A 26 LEU HDx% 1.0 . 3.86 1623 1374 A 26 LEU H A 27 GLU HGy 1.0 . 4.56 1624 1374 A 26 LEU H A 27 GLU HGx 1.0 . 4.56 1625 1375 A 26 LEU HA A 26 LEU HDy% 1.0 . 3.34 1626 1375 A 26 LEU HA A 26 LEU HDx% 1.0 . 3.34 1627 1376 A 26 LEU HBy A 27 GLU HGy 1.0 . 4.76 1628 1376 A 26 LEU HBy A 27 GLU HGx 1.0 . 4.76 1629 1377 A 27 GLU H A 26 LEU HDy% 1.0 . 4.63 1630 1377 A 27 GLU H A 26 LEU HDx% 1.0 . 4.63 1631 1378 A 27 GLU H A 27 GLU HGy 1.0 . 2.93 1632 1378 A 27 GLU H A 27 GLU HGx 1.0 . 2.93 1633 1379 A 27 GLU HA A 27 GLU HGy 1.0 . 3.38 1634 1379 A 27 GLU HA A 27 GLU HGx 1.0 . 3.38 1635 1380 A 28 SER H A 27 GLU HGy 1.0 . 4.62 1636 1380 A 28 SER H A 27 GLU HGx 1.0 . 4.62 1637 1381 A 57 TRP HE1 A 27 GLU HGy 1.0 . 4.05 1638 1381 A 57 TRP HE1 A 27 GLU HGx 1.0 . 4.05 1639 1382 A 61 TYR HE% A 27 GLU HGy 1.0 . 5.34 1640 1382 A 61 TYR HE% A 27 GLU HGx 1.0 . 5.34 1641 1383 A 29 GLY H A 29 GLY HAy 1.0 . 2.53 1642 1383 A 29 GLY H A 29 GLY HAx 1.0 . 2.53 1643 1384 A 30 LEU HDx% A 50 VAL HGy% 1.0 . 3.22 1644 1384 A 30 LEU HDx% A 50 VAL HGx% 1.0 . 3.22 1645 1385 A 30 LEU HDy% A 50 VAL HGy% 1.0 . 3.90 1646 1385 A 30 LEU HDy% A 50 VAL HGx% 1.0 . 3.90 1647 1386 A 31 SER H A 31 SER HBy 1.0 . 2.85 1648 1386 A 31 SER H A 31 SER HBx 1.0 . 2.85 1649 1387 A 33 GLY H A 31 SER HBy 1.0 . 5.34 1650 1387 A 33 GLY H A 31 SER HBx 1.0 . 5.34 1651 1388 A 34 THR H A 31 SER HBy 1.0 . 4.70 1652 1388 A 34 THR H A 31 SER HBx 1.0 . 4.70 1653 1389 A 32 THR HG2% A 33 GLY HAx 1.0 . 5.34 1654 1389 A 32 THR HG2% A 33 GLY HAy 1.0 . 5.34 1655 1390 A 36 SER H A 33 GLY HAx 1.0 . 5.34 1656 1390 A 36 SER H A 33 GLY HAy 1.0 . 5.34 1657 1391 A 34 THR HB A 50 VAL HGy% 1.0 . 5.44 1658 1391 A 34 THR HB A 50 VAL HGx% 1.0 . 5.44 1659 1392 A 34 THR HG2% A 50 VAL HGy% 1.0 . 3.23 1660 1392 A 34 THR HG2% A 50 VAL HGx% 1.0 . 3.23 1661 1393 A 35 ILE H A 50 VAL HGy% 1.0 . 5.03 1662 1393 A 35 ILE H A 50 VAL HGx% 1.0 . 5.03 1663 1394 A 35 ILE HA A 50 VAL HGy% 1.0 . 4.89 1664 1394 A 35 ILE HA A 50 VAL HGx% 1.0 . 4.89 1665 1395 A 35 ILE HG2% A 36 SER HBy 1.0 . 4.88 1666 1395 A 35 ILE HG2% A 36 SER HBx 1.0 . 4.88 1667 1396 A 36 SER H A 36 SER HBy 1.0 . 3.01 1668 1396 A 36 SER H A 36 SER HBx 1.0 . 3.01 1669 1397 A 36 SER H A 37 SER HBy 1.0 . 5.34 1670 1397 A 36 SER H A 37 SER HBx 1.0 . 5.34 1671 1398 A 37 SER H A 36 SER HBy 1.0 . 3.30 1672 1398 A 37 SER H A 36 SER HBx 1.0 . 3.30 1673 1399 A 37 SER HA A 40 ASN HBx 1.0 . 3.99 1674 1399 A 37 SER HA A 40 ASN HBy 1.0 . 3.99 1675 1400 A 38 PHE H A 37 SER HBy 1.0 . 3.54 1676 1400 A 38 PHE H A 37 SER HBx 1.0 . 3.54 1677 1401 A 42 LYS H A 37 SER HBy 1.0 . 4.73 1678 1401 A 42 LYS H A 37 SER HBx 1.0 . 4.73 1679 1402 A 42 LYS HBy A 37 SER HBy 1.0 . 4.60 1680 1402 A 42 LYS HBy A 37 SER HBx 1.0 . 4.60 1681 1403 A 42 LYS HBx A 37 SER HBy 1.0 . 5.34 1682 1403 A 42 LYS HBx A 37 SER HBx 1.0 . 5.34 1683 1404 A 43 TYR H A 37 SER HBy 1.0 . 5.34 1684 1404 A 43 TYR H A 37 SER HBx 1.0 . 5.34 1685 1405 A 43 TYR HA A 37 SER HBy 1.0 . 4.31 1686 1405 A 43 TYR HA A 37 SER HBx 1.0 . 4.31 1687 1406 A 43 TYR HBy A 37 SER HBy 1.0 . 4.01 1688 1406 A 43 TYR HBy A 37 SER HBx 1.0 . 4.01 1689 1407 A 38 PHE H A 50 VAL HGy% 1.0 . 4.80 1690 1407 A 38 PHE H A 50 VAL HGx% 1.0 . 4.80 1691 1408 A 47 ASN HD2y A 38 PHE HA 1.0 . 5.34 1692 1408 A 47 ASN HD2x A 38 PHE HA 1.0 . 5.34 1693 1409 A 38 PHE HBy A 50 VAL HGy% 1.0 . 3.80 1694 1409 A 38 PHE HBy A 50 VAL HGx% 1.0 . 3.80 1695 1410 A 38 PHE HBx A 50 VAL HGy% 1.0 . 4.04 1696 1410 A 38 PHE HBx A 50 VAL HGx% 1.0 . 4.04 1697 1411 A 38 PHE HD% A 47 ASN HBx 1.0 . 4.32 1698 1411 A 38 PHE HD% A 47 ASN HBy 1.0 . 4.32 1699 1412 A 38 PHE HD% A 50 VAL HGy% 1.0 . 3.38 1700 1412 A 38 PHE HD% A 50 VAL HGx% 1.0 . 3.38 1701 1413 A 38 PHE HD% A 51 SER HBy 1.0 . 4.73 1702 1413 A 38 PHE HD% A 51 SER HBx 1.0 . 4.73 1703 1414 A 38 PHE HE% A 47 ASN HBx 1.0 . 3.88 1704 1414 A 38 PHE HE% A 47 ASN HBy 1.0 . 3.88 1705 1415 A 38 PHE HE% A 50 VAL HGy% 1.0 . 4.24 1706 1415 A 38 PHE HE% A 50 VAL HGx% 1.0 . 4.24 1707 1416 A 38 PHE HZ A 50 VAL HGy% 1.0 . 5.44 1708 1416 A 38 PHE HZ A 50 VAL HGx% 1.0 . 5.44 1709 1417 A 38 PHE HZ A 51 SER HBy 1.0 . 5.04 1710 1417 A 38 PHE HZ A 51 SER HBx 1.0 . 5.04 1711 1418 A 39 ILE HG2% A 40 ASN HD2x 1.0 . 5.20 1712 1418 A 39 ILE HG2% A 40 ASN HD2y 1.0 . 5.20 1713 1419 A 40 ASN H A 40 ASN HBx 1.0 . 2.86 1714 1419 A 40 ASN H A 40 ASN HBy 1.0 . 2.86 1715 1420 A 40 ASN H A 42 LYS HGx 1.0 . 5.34 1716 1420 A 40 ASN H A 42 LYS HGy 1.0 . 5.34 1717 1421 A 40 ASN HBx A 40 ASN HD2x 1.0 . 3.22 1718 1421 A 40 ASN HD2y A 40 ASN HBx 1.0 . 3.22 1719 1421 A 40 ASN HBy A 40 ASN HD2y 1.0 . 3.22 1720 1421 A 40 ASN HBy A 40 ASN HD2x 1.0 . 3.22 1721 1422 A 41 ASP H A 40 ASN HBx 1.0 . 3.74 1722 1422 A 41 ASP H A 40 ASN HBy 1.0 . 3.74 1723 1423 A 42 LYS H A 40 ASN HBx 1.0 . 4.24 1724 1423 A 42 LYS H A 40 ASN HBy 1.0 . 4.24 1725 1424 A 42 LYS HBy A 40 ASN HBx 1.0 . 5.04 1726 1424 A 42 LYS HBy A 40 ASN HBy 1.0 . 5.04 1727 1425 A 40 ASN HBx A 42 LYS HGx 1.0 . 3.85 1728 1425 A 40 ASN HBy A 42 LYS HGx 1.0 . 3.85 1729 1425 A 42 LYS HGy A 40 ASN HBx 1.0 . 3.85 1730 1425 A 40 ASN HBy A 42 LYS HGy 1.0 . 3.85 1731 1426 A 41 ASP H A 41 ASP HBx 1.0 . 3.27 1732 1426 A 41 ASP H A 41 ASP HBy 1.0 . 3.27 1733 1427 A 41 ASP H A 42 LYS HGx 1.0 . 5.34 1734 1427 A 41 ASP H A 42 LYS HGy 1.0 . 5.34 1735 1428 A 42 LYS H A 42 LYS HGx 1.0 . 3.56 1736 1428 A 42 LYS H A 42 LYS HGy 1.0 . 3.56 1737 1429 A 42 LYS H A 42 LYS HDy 1.0 . 5.34 1738 1429 A 42 LYS H A 42 LYS HDx 1.0 . 5.34 1739 1430 A 42 LYS HA A 42 LYS HGx 1.0 . 3.73 1740 1430 A 42 LYS HA A 42 LYS HGy 1.0 . 3.73 1741 1431 A 42 LYS HA A 42 LYS HDy 1.0 . 3.78 1742 1431 A 42 LYS HA A 42 LYS HDx 1.0 . 3.78 1743 1432 A 42 LYS HBx A 42 LYS HDy 1.0 . 3.51 1744 1432 A 42 LYS HBx A 42 LYS HDx 1.0 . 3.51 1745 1433 A 43 TYR H A 42 LYS HDy 1.0 . 5.34 1746 1433 A 43 TYR H A 42 LYS HDx 1.0 . 5.34 1747 1434 A 47 ASN HD2x A 43 TYR H 1.0 . 5.34 1748 1434 A 47 ASN HD2y A 43 TYR H 1.0 . 5.34 1749 1435 A 43 TYR HBx A 47 ASN HD2y 1.0 . 4.21 1750 1435 A 43 TYR HBx A 47 ASN HD2x 1.0 . 4.21 1751 1436 A 43 TYR HD% A 45 GLY HAy 1.0 . 4.87 1752 1436 A 43 TYR HD% A 45 GLY HAx 1.0 . 4.87 1753 1437 A 43 TYR HD% A 47 ASN HBx 1.0 . 4.39 1754 1437 A 43 TYR HD% A 47 ASN HBy 1.0 . 4.39 1755 1438 A 43 TYR HD% A 50 VAL HGy% 1.0 . 3.77 1756 1438 A 43 TYR HD% A 50 VAL HGx% 1.0 . 3.77 1757 1439 A 43 TYR HE% A 45 GLY HAy 1.0 . 4.19 1758 1439 A 43 TYR HE% A 45 GLY HAx 1.0 . 4.19 1759 1440 A 43 TYR HE% A 47 ASN HBx 1.0 . 5.34 1760 1440 A 43 TYR HE% A 47 ASN HBy 1.0 . 5.34 1761 1441 A 43 TYR HE% A 50 VAL HGy% 1.0 . 3.37 1762 1441 A 43 TYR HE% A 50 VAL HGx% 1.0 . 3.37 1763 1442 A 47 ASN H A 47 ASN HD2y 1.0 . 5.09 1764 1442 A 47 ASN H A 47 ASN HD2x 1.0 . 5.09 1765 1443 A 47 ASN HA A 47 ASN HD2y 1.0 . 4.24 1766 1443 A 47 ASN HD2x A 47 ASN HA 1.0 . 4.24 1767 1444 A 47 ASN HA A 50 VAL HGy% 1.0 . 3.92 1768 1444 A 47 ASN HA A 50 VAL HGx% 1.0 . 3.92 1769 1445 A 47 ASN HD2y A 47 ASN HBy 1.0 . 3.17 1770 1445 A 47 ASN HD2y A 47 ASN HBx 1.0 . 3.17 1771 1445 A 47 ASN HD2x A 47 ASN HBy 1.0 . 3.17 1772 1445 A 47 ASN HD2x A 47 ASN HBx 1.0 . 3.17 1773 1446 A 47 ASN HBx A 50 VAL HGy% 1.0 . 5.28 1774 1446 A 50 VAL HGx% A 47 ASN HBx 1.0 . 5.28 1775 1446 A 47 ASN HBy A 50 VAL HGx% 1.0 . 5.28 1776 1446 A 47 ASN HBy A 50 VAL HGy% 1.0 . 5.28 1777 1447 A 49 ARG H A 49 ARG HBx 1.0 . 2.94 1778 1447 A 49 ARG H A 49 ARG HBy 1.0 . 2.94 1779 1448 A 49 ARG H A 49 ARG HGx 1.0 . 4.09 1780 1448 A 49 ARG H A 49 ARG HGy 1.0 . 4.09 1781 1449 A 49 ARG H A 50 VAL HGy% 1.0 . 4.66 1782 1449 A 49 ARG H A 50 VAL HGx% 1.0 . 4.66 1783 1450 A 49 ARG HBx A 49 ARG HD2 1.0 . 3.66 1784 1450 A 49 ARG HBy A 49 ARG HD2 1.0 . 3.66 1785 1450 A 49 ARG HD3 A 49 ARG HBx 1.0 . 3.66 1786 1450 A 49 ARG HD3 A 49 ARG HBy 1.0 . 3.66 1787 1451 A 50 VAL H A 49 ARG HBx 1.0 . 3.42 1788 1451 A 50 VAL H A 49 ARG HBy 1.0 . 3.42 1789 1452 A 53 THR H A 49 ARG HGx 1.0 . 5.34 1790 1452 A 53 THR H A 49 ARG HGy 1.0 . 5.34 1791 1453 A 50 VAL H A 50 VAL HGy% 1.0 . 2.74 1792 1453 A 50 VAL H A 50 VAL HGx% 1.0 . 2.74 1793 1454 A 50 VAL HA A 50 VAL HGy% 1.0 . 2.88 1794 1454 A 50 VAL HA A 50 VAL HGx% 1.0 . 2.88 1795 1455 A 51 SER H A 50 VAL HGy% 1.0 . 3.35 1796 1455 A 51 SER H A 50 VAL HGx% 1.0 . 3.35 1797 1456 A 51 SER HA A 50 VAL HGy% 1.0 . 4.48 1798 1456 A 51 SER HA A 50 VAL HGx% 1.0 . 4.48 1799 1457 A 53 THR H A 50 VAL HGy% 1.0 . 4.50 1800 1457 A 53 THR H A 50 VAL HGx% 1.0 . 4.50 1801 1458 A 53 THR HB A 50 VAL HGy% 1.0 . 4.46 1802 1458 A 53 THR HB A 50 VAL HGx% 1.0 . 4.46 1803 1459 A 54 LEU H A 50 VAL HGy% 1.0 . 4.18 1804 1459 A 54 LEU H A 50 VAL HGx% 1.0 . 4.18 1805 1460 A 54 LEU HG A 50 VAL HGy% 1.0 . 3.76 1806 1460 A 54 LEU HG A 50 VAL HGx% 1.0 . 3.76 1807 1461 A 51 SER H A 51 SER HBy 1.0 . 2.92 1808 1461 A 51 SER H A 51 SER HBx 1.0 . 2.92 1809 1462 A 52 GLN H A 51 SER HBy 1.0 . 3.95 1810 1462 A 52 GLN H A 51 SER HBx 1.0 . 3.95 1811 1463 A 54 LEU H A 51 SER HBy 1.0 . 5.34 1812 1463 A 54 LEU H A 51 SER HBx 1.0 . 5.34 1813 1464 A 52 GLN HE2y A 55 GLN HBy 1.0 . 5.34 1814 1464 A 52 GLN HE2x A 55 GLN HBy 1.0 . 5.34 1815 1465 A 55 GLN HGx A 52 GLN HE2y 1.0 . 4.79 1816 1465 A 55 GLN HGx A 52 GLN HE2x 1.0 . 4.79 1817 1466 A 53 THR HA A 56 ARG HBx 1.0 . 4.47 1818 1466 A 53 THR HA A 56 ARG HBy 1.0 . 4.47 1819 1467 A 54 LEU HA A 58 LEU HDy% 1.0 . 5.44 1820 1467 A 54 LEU HA A 58 LEU HDx% 1.0 . 5.44 1821 1468 A 54 LEU HDy% A 58 LEU HDy% 1.0 . 5.00 1822 1468 A 54 LEU HDy% A 58 LEU HDx% 1.0 . 5.00 1823 1469 A 55 GLN HA A 55 GLN HE2y 1.0 . 4.44 1824 1469 A 55 GLN HE2x A 55 GLN HA 1.0 . 4.44 1825 1470 A 55 GLN HA A 58 LEU HDy% 1.0 . 4.31 1826 1470 A 55 GLN HA A 58 LEU HDx% 1.0 . 4.31 1827 1471 A 55 GLN HBx A 55 GLN HE2y 1.0 . 3.36 1828 1471 A 55 GLN HBx A 55 GLN HE2x 1.0 . 3.36 1829 1472 A 55 GLN HGx A 55 GLN HE2y 1.0 . 3.55 1830 1472 A 55 GLN HE2x A 55 GLN HGx 1.0 . 3.55 1831 1473 A 56 ARG H A 56 ARG HBx 1.0 . 2.72 1832 1473 A 56 ARG H A 56 ARG HBy 1.0 . 2.72 1833 1474 A 56 ARG H A 56 ARG HGx 1.0 . 3.01 1834 1474 A 56 ARG H A 56 ARG HGy 1.0 . 3.01 1835 1475 A 56 ARG HA A 56 ARG HGx 1.0 . 3.69 1836 1475 A 56 ARG HA A 56 ARG HGy 1.0 . 3.69 1837 1476 A 56 ARG HA A 59 GLU HBx 1.0 . 3.70 1838 1476 A 56 ARG HA A 59 GLU HBy 1.0 . 3.70 1839 1477 A 56 ARG HA A 59 GLU HGy 1.0 . 5.34 1840 1477 A 56 ARG HA A 59 GLU HGx 1.0 . 5.34 1841 1478 A 56 ARG HBy A 56 ARG HD2 1.0 . 3.53 1842 1478 A 56 ARG HBx A 56 ARG HD2 1.0 . 3.53 1843 1478 A 56 ARG HD3 A 56 ARG HBx 1.0 . 3.53 1844 1478 A 56 ARG HD3 A 56 ARG HBy 1.0 . 3.53 1845 1479 A 57 TRP H A 56 ARG HBx 1.0 . 2.94 1846 1479 A 57 TRP H A 56 ARG HBy 1.0 . 2.94 1847 1480 A 57 TRP H A 56 ARG HGx 1.0 . 4.49 1848 1480 A 57 TRP H A 56 ARG HGy 1.0 . 4.49 1849 1481 A 57 TRP H A 60 LYS HGx 1.0 . 5.34 1850 1481 A 57 TRP H A 60 LYS HGy 1.0 . 5.34 1851 1482 A 57 TRP HA A 60 LYS HGx 1.0 . 4.45 1852 1482 A 57 TRP HA A 60 LYS HGy 1.0 . 4.45 1853 1483 A 57 TRP HE3 A 58 LEU HDy% 1.0 . 3.62 1854 1483 A 57 TRP HE3 A 58 LEU HDx% 1.0 . 3.62 1855 1484 A 57 TRP HZ3 A 58 LEU HDy% 1.0 . 3.26 1856 1484 A 57 TRP HZ3 A 58 LEU HDx% 1.0 . 3.26 1857 1485 A 58 LEU H A 58 LEU HDy% 1.0 . 3.63 1858 1485 A 58 LEU H A 58 LEU HDx% 1.0 . 3.63 1859 1486 A 58 LEU H A 60 LYS HGx 1.0 . 5.34 1860 1486 A 58 LEU H A 60 LYS HGy 1.0 . 5.34 1861 1487 A 58 LEU HA A 58 LEU HDy% 1.0 . 3.34 1862 1487 A 58 LEU HA A 58 LEU HDx% 1.0 . 3.34 1863 1488 A 58 LEU HA A 60 LYS HGx 1.0 . 5.34 1864 1488 A 58 LEU HA A 60 LYS HGy 1.0 . 5.34 1865 1489 A 58 LEU HBx A 58 LEU HDy% 1.0 . 2.93 1866 1489 A 58 LEU HBx A 58 LEU HDx% 1.0 . 2.93 1867 1490 A 58 LEU HBy A 58 LEU HDy% 1.0 . 3.07 1868 1490 A 58 LEU HBy A 58 LEU HDx% 1.0 . 3.07 1869 1491 A 58 LEU HBy A 59 GLU HGy 1.0 . 4.43 1870 1491 A 58 LEU HBy A 59 GLU HGx 1.0 . 4.43 1871 1492 A 59 GLU H A 58 LEU HDy% 1.0 . 4.81 1872 1492 A 59 GLU H A 58 LEU HDx% 1.0 . 4.81 1873 1493 A 61 TYR HBx A 58 LEU HDy% 1.0 . 4.57 1874 1493 A 61 TYR HBx A 58 LEU HDx% 1.0 . 4.57 1875 1494 A 61 TYR HD% A 58 LEU HDy% 1.0 . 5.44 1876 1494 A 61 TYR HD% A 58 LEU HDx% 1.0 . 5.44 1877 1495 A 61 TYR HE% A 58 LEU HDy% 1.0 . 5.44 1878 1495 A 61 TYR HE% A 58 LEU HDx% 1.0 . 5.44 1879 1496 A 62 HIS H A 58 LEU HDy% 1.0 . 5.37 1880 1496 A 62 HIS H A 58 LEU HDx% 1.0 . 5.37 1881 1497 A 58 LEU HDy% A 62 HIS HBy 1.0 . 5.28 1882 1497 A 58 LEU HDx% A 62 HIS HBy 1.0 . 5.28 1883 1497 A 62 HIS HBx A 58 LEU HDy% 1.0 . 5.28 1884 1497 A 58 LEU HDx% A 62 HIS HBx 1.0 . 5.28 1885 1498 A 62 HIS HD2 A 58 LEU HDy% 1.0 . 3.64 1886 1498 A 62 HIS HD2 A 58 LEU HDx% 1.0 . 3.64 1887 1499 A 59 GLU H A 59 GLU HBx 1.0 . 2.80 1888 1499 A 59 GLU H A 59 GLU HBy 1.0 . 2.80 1889 1500 A 59 GLU H A 59 GLU HGy 1.0 . 2.89 1890 1500 A 59 GLU H A 59 GLU HGx 1.0 . 2.89 1891 1501 A 59 GLU HA A 59 GLU HGy 1.0 . 3.37 1892 1501 A 59 GLU HA A 59 GLU HGx 1.0 . 3.37 1893 1502 A 59 GLU HA A 62 HIS HBy 1.0 . 4.83 1894 1502 A 59 GLU HA A 62 HIS HBx 1.0 . 4.83 1895 1503 A 60 LYS H A 59 GLU HBx 1.0 . 3.19 1896 1503 A 60 LYS H A 59 GLU HBy 1.0 . 3.19 1897 1504 A 60 LYS H A 59 GLU HGy 1.0 . 4.46 1898 1504 A 60 LYS H A 59 GLU HGx 1.0 . 4.46 1899 1505 A 60 LYS H A 60 LYS HGx 1.0 . 3.54 1900 1505 A 60 LYS H A 60 LYS HGy 1.0 . 3.54 1901 1506 A 60 LYS HA A 60 LYS HGx 1.0 . 3.62 1902 1506 A 60 LYS HA A 60 LYS HGy 1.0 . 3.62 1903 1507 A 61 TYR H A 60 LYS HGx 1.0 . 3.61 1904 1507 A 61 TYR H A 60 LYS HGy 1.0 . 3.61 1905 1508 A 61 TYR HD% A 60 LYS HGx 1.0 . 4.43 1906 1508 A 61 TYR HD% A 60 LYS HGy 1.0 . 4.43 1907 1509 A 61 TYR HE% A 60 LYS HGx 1.0 . 5.02 1908 1509 A 61 TYR HE% A 60 LYS HGy 1.0 . 5.02 1909 1510 A 62 HIS H A 62 HIS HBy 1.0 . 2.89 1910 1510 A 62 HIS H A 62 HIS HBx 1.0 . 2.89 1911 1511 A 62 HIS HD2 A 62 HIS HBy 1.0 . 3.46 1912 1511 A 62 HIS HD2 A 62 HIS HBx 1.0 . 3.46 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 2 ASN C A 3 ILE N A 3 ILE CA A 3 ILE C 1.0 -88.0 -36.0 PHI 2 2 A 3 ILE N A 3 ILE CA A 3 ILE C A 4 SER N 1.0 -75.0 5.0 PSI 3 3 A 3 ILE C A 4 SER N A 4 SER CA A 4 SER C 1.0 -72.3 -52.3 PHI 4 4 A 4 SER N A 4 SER CA A 4 SER C A 5 ASP N 1.0 -54.5 -29.6 PSI 5 5 A 4 SER C A 5 ASP N A 5 ASP CA A 5 ASP C 1.0 -80.7 -49.5 PHI 6 6 A 5 ASP N A 5 ASP CA A 5 ASP C A 6 ILE N 1.0 -54.6 -28.1 PSI 7 7 A 5 ASP C A 6 ILE N A 6 ILE CA A 6 ILE C 1.0 -88.0 -47.4 PHI 8 8 A 6 ILE N A 6 ILE CA A 6 ILE C A 7 ARG N 1.0 -62.0 -19.4 PSI 9 9 A 6 ILE C A 7 ARG N A 7 ARG CA A 7 ARG C 1.0 -71.4 -48.4 PHI 10 10 A 7 ARG N A 7 ARG CA A 7 ARG C A 8 ALA N 1.0 -60.0 -23.8 PSI 11 11 A 7 ARG C A 8 ALA N A 8 ALA CA A 8 ALA C 1.0 -93.1 -44.3 PHI 12 12 A 8 ALA N A 8 ALA CA A 8 ALA C A 9 GLY N 1.0 -73.1 7.2 PSI 13 13 A 9 GLY C A 10 LEU N A 10 LEU CA A 10 LEU C 1.0 -73.0 -53.0 PHI 14 14 A 10 LEU N A 10 LEU CA A 10 LEU C A 11 ARG N 1.0 -55.0 -35.0 PSI 15 15 A 10 LEU C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 -71.0 -51.0 PHI 16 16 A 11 ARG N A 11 ARG CA A 11 ARG C A 12 THR N 1.0 -50.0 -30.0 PSI 17 17 A 11 ARG C A 12 THR N A 12 THR CA A 12 THR C 1.0 -74.3 -54.3 PHI 18 18 A 12 THR N A 12 THR CA A 12 THR C A 13 LEU N 1.0 -56.3 -31.8 PSI 19 19 A 12 THR C A 13 LEU N A 13 LEU CA A 13 LEU C 1.0 -73.0 -49.0 PHI 20 20 A 13 LEU N A 13 LEU CA A 13 LEU C A 14 VAL N 1.0 -53.8 -29.4 PSI 21 21 A 13 LEU C A 14 VAL N A 14 VAL CA A 14 VAL C 1.0 -94.0 -46.0 PHI 22 22 A 14 VAL N A 14 VAL CA A 14 VAL C A 15 GLU N 1.0 -63.0 -19.0 PSI 23 23 A 14 VAL C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -75.0 -55.0 PHI 24 24 A 15 GLU N A 15 GLU CA A 15 GLU C A 16 ASN N 1.0 -54.6 -14.4 PSI 25 25 A 15 GLU C A 16 ASN N A 16 ASN CA A 16 ASN C 1.0 -116.0 -64.0 PHI 26 26 A 16 ASN N A 16 ASN CA A 16 ASN C A 17 GLU N 1.0 -30.0 38.0 PSI 27 27 A 16 ASN C A 17 GLU N A 17 GLU CA A 17 GLU C 1.0 39.9 81.4 PHI 28 28 A 17 GLU N A 17 GLU CA A 17 GLU C A 18 GLU N 1.0 12.7 46.3 PSI 29 29 A 17 GLU C A 18 GLU N A 18 GLU CA A 18 GLU C 1.0 -117.1 -30.9 PHI 30 30 A 18 GLU N A 18 GLU CA A 18 GLU C A 19 THR N 1.0 -74.2 -8.8 PSI 31 31 A 20 THR C A 21 PHE N A 21 PHE CA A 21 PHE C 1.0 -73.1 -53.1 PHI 32 32 A 21 PHE N A 21 PHE CA A 21 PHE C A 22 LYS N 1.0 -58.2 -25.0 PSI 33 33 A 21 PHE C A 22 LYS N A 22 LYS CA A 22 LYS C 1.0 -98.0 -42.0 PHI 34 34 A 22 LYS N A 22 LYS CA A 22 LYS C A 23 GLN N 1.0 -61.0 -5.0 PSI 35 35 A 22 LYS C A 23 GLN N A 23 GLN CA A 23 GLN C 1.0 -72.1 -52.1 PHI 36 36 A 23 GLN N A 23 GLN CA A 23 GLN C A 24 ILE N 1.0 -57.9 -37.9 PSI 37 37 A 23 GLN C A 24 ILE N A 24 ILE CA A 24 ILE C 1.0 -71.3 -51.3 PHI 38 38 A 24 ILE N A 24 ILE CA A 24 ILE C A 25 ALA N 1.0 -51.7 -30.4 PSI 39 39 A 24 ILE C A 25 ALA N A 25 ALA CA A 25 ALA C 1.0 -74.5 -52.5 PHI 40 40 A 25 ALA N A 25 ALA CA A 25 ALA C A 26 LEU N 1.0 -56.9 -34.1 PSI 41 41 A 25 ALA C A 26 LEU N A 26 LEU CA A 26 LEU C 1.0 -72.4 -52.4 PHI 42 42 A 26 LEU N A 26 LEU CA A 26 LEU C A 27 GLU N 1.0 -62.6 -27.6 PSI 43 43 A 26 LEU C A 27 GLU N A 27 GLU CA A 27 GLU C 1.0 -86.4 -51.6 PHI 44 44 A 27 GLU N A 27 GLU CA A 27 GLU C A 28 SER N 1.0 -65.7 9.8 PSI 45 45 A 27 GLU C A 28 SER N A 28 SER CA A 28 SER C 1.0 -119.0 -59.0 PHI 46 46 A 28 SER N A 28 SER CA A 28 SER C A 29 GLY N 1.0 -36.0 16.0 PSI 47 47 A 31 SER C A 32 THR N A 32 THR CA A 32 THR C 1.0 -72.5 -52.5 PHI 48 48 A 32 THR N A 32 THR CA A 32 THR C A 33 GLY N 1.0 -58.1 -31.4 PSI 49 49 A 33 GLY C A 34 THR N A 34 THR CA A 34 THR C 1.0 -70.0 -38.7 PHI 50 50 A 34 THR N A 34 THR CA A 34 THR C A 35 ILE N 1.0 -64.0 -17.3 PSI 51 51 A 34 THR C A 35 ILE N A 35 ILE CA A 35 ILE C 1.0 -76.1 -54.2 PHI 52 52 A 35 ILE N A 35 ILE CA A 35 ILE C A 36 SER N 1.0 -57.1 -30.7 PSI 53 53 A 35 ILE C A 36 SER N A 36 SER CA A 36 SER C 1.0 -70.1 -50.1 PHI 54 54 A 36 SER N A 36 SER CA A 36 SER C A 37 SER N 1.0 -50.0 -30.0 PSI 55 55 A 36 SER C A 37 SER N A 37 SER CA A 37 SER C 1.0 -76.7 -56.7 PHI 56 56 A 37 SER N A 37 SER CA A 37 SER C A 38 PHE N 1.0 -50.3 -30.3 PSI 57 57 A 37 SER C A 38 PHE N A 38 PHE CA A 38 PHE C 1.0 -75.3 -55.3 PHI 58 58 A 38 PHE N A 38 PHE CA A 38 PHE C A 39 ILE N 1.0 -53.5 -33.5 PSI 59 59 A 38 PHE C A 39 ILE N A 39 ILE CA A 39 ILE C 1.0 -73.2 -53.2 PHI 60 60 A 39 ILE N A 39 ILE CA A 39 ILE C A 40 ASN N 1.0 -56.9 -33.5 PSI 61 61 A 46 ASP C A 47 ASN N A 47 ASN CA A 47 ASN C 1.0 -70.0 -50.0 PHI 62 62 A 47 ASN N A 47 ASN CA A 47 ASN C A 48 GLU N 1.0 -52.0 -32.0 PSI 63 63 A 47 ASN C A 48 GLU N A 48 GLU CA A 48 GLU C 1.0 -76.1 -51.1 PHI 64 64 A 48 GLU N A 48 GLU CA A 48 GLU C A 49 ARG N 1.0 -55.7 -35.7 PSI 65 65 A 48 GLU C A 49 ARG N A 49 ARG CA A 49 ARG C 1.0 -74.9 -54.9 PHI 66 66 A 49 ARG N A 49 ARG CA A 49 ARG C A 50 VAL N 1.0 -54.8 -27.5 PSI 67 67 A 49 ARG C A 50 VAL N A 50 VAL CA A 50 VAL C 1.0 -73.8 -53.8 PHI 68 68 A 50 VAL N A 50 VAL CA A 50 VAL C A 51 SER N 1.0 -52.8 -28.7 PSI 69 69 A 50 VAL C A 51 SER N A 51 SER CA A 51 SER C 1.0 -69.6 -47.5 PHI 70 70 A 51 SER N A 51 SER CA A 51 SER C A 52 GLN N 1.0 -54.0 -34.0 PSI 71 71 A 51 SER C A 52 GLN N A 52 GLN CA A 52 GLN C 1.0 -77.9 -56.2 PHI 72 72 A 52 GLN N A 52 GLN CA A 52 GLN C A 53 THR N 1.0 -57.7 -16.7 PSI 73 73 A 52 GLN C A 53 THR N A 53 THR CA A 53 THR C 1.0 -85.9 -47.9 PHI 74 74 A 53 THR N A 53 THR CA A 53 THR C A 54 LEU N 1.0 -55.6 -29.0 PSI 75 75 A 53 THR C A 54 LEU N A 54 LEU CA A 54 LEU C 1.0 -77.0 -53.4 PHI 76 76 A 54 LEU N A 54 LEU CA A 54 LEU C A 55 GLN N 1.0 -48.7 -23.2 PSI 77 77 A 54 LEU C A 55 GLN N A 55 GLN CA A 55 GLN C 1.0 -74.6 -50.7 PHI 78 78 A 55 GLN N A 55 GLN CA A 55 GLN C A 56 ARG N 1.0 -58.7 -12.4 PSI 79 79 A 55 GLN C A 56 ARG N A 56 ARG CA A 56 ARG C 1.0 -78.5 -51.2 PHI 80 80 A 56 ARG N A 56 ARG CA A 56 ARG C A 57 TRP N 1.0 -52.5 -30.4 PSI 81 81 A 56 ARG C A 57 TRP N A 57 TRP CA A 57 TRP C 1.0 -83.8 -51.1 PHI 82 82 A 57 TRP N A 57 TRP CA A 57 TRP C A 58 LEU N 1.0 -57.6 -27.7 PSI 83 83 A 57 TRP C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -71.9 -51.9 PHI 84 84 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 GLU N 1.0 -57.1 -36.5 PSI 85 85 A 58 LEU C A 59 GLU N A 59 GLU CA A 59 GLU C 1.0 -74.4 -52.4 PHI 86 86 A 59 GLU N A 59 GLU CA A 59 GLU C A 60 LYS N 1.0 -50.0 -9.1 PSI 87 87 A 59 GLU C A 60 LYS N A 60 LYS CA A 60 LYS C 1.0 -82.7 -47.6 PHI 88 88 A 60 LYS N A 60 LYS CA A 60 LYS C A 61 TYR N 1.0 -54.5 -32.1 PSI 89 89 A 60 LYS C A 61 TYR N A 61 TYR CA A 61 TYR C 1.0 -93.8 -49.9 PHI 90 90 A 61 TYR N A 61 TYR CA A 61 TYR C A 62 HIS N 1.0 -65.4 5.5 PSI 91 91 A 61 TYR C A 62 HIS N A 62 HIS CA A 62 HIS C 1.0 -113.6 -49.0 PHI 92 92 A 62 HIS N A 62 HIS CA A 62 HIS C A 63 ALA N 1.0 -55.8 19.9 PSI stop_ save_