data_nef_c34195_6ewu 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 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6EWU 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 2 ILE middle . . 3 A 3 ASP middle . . 4 A 4 ALA middle . . 5 A 5 ALA middle . . 6 A 6 GLN middle . . 7 A 7 ILE middle . . 8 A 8 VAL middle . . 9 A 9 ASP middle . . 10 A 10 GLU middle . . 11 A 11 ALA middle . . 12 A 12 LEU middle . . 13 A 13 GLU middle . . 14 A 14 GLN middle . . 15 A 15 GLY middle . false 16 A 16 ILE middle . . 17 A 17 THR middle . . 18 A 18 LEU middle . . 19 A 19 PHE middle . . 20 A 20 VAL middle . . 21 A 21 VAL middle . . 22 A 22 ASN middle . . 23 A 23 ASN middle . . 24 A 24 ARG middle . . 25 A 25 LEU middle . . 26 A 26 GLN middle . . 27 A 27 TYR middle . . 28 A 28 GLU middle . . 29 A 29 THR middle . . 30 A 30 SER middle . . 31 A 31 ARG middle . . 32 A 32 ASP middle . . 33 A 33 SER middle . . 34 A 34 ILE middle . . 35 A 35 PRO middle . false 36 A 36 THR middle . . 37 A 37 GLU middle . . 38 A 38 LEU middle . . 39 A 39 LEU middle . . 40 A 40 ASN middle . . 41 A 41 LYS middle . . 42 A 42 TRP middle . . 43 A 43 LYS middle . . 44 A 44 GLN middle . . 45 A 45 HIS middle . . 46 A 46 LYS middle . . 47 A 47 GLN middle . . 48 A 48 GLU middle . . 49 A 49 LEU middle . . 50 A 50 ILE middle . . 51 A 51 ASP middle . . 52 A 52 PHE middle . . 53 A 53 LEU middle . . 54 A 54 ASN middle . . 55 A 55 GLN middle . . 56 A 56 LEU middle . . 57 A 57 ASP middle . . 58 A 58 SER middle . . 59 A 59 GLU middle . . 60 A 60 GLU middle . . 61 A 61 GLN middle . . 62 A 62 THR middle . . 63 A 63 LYS end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_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 HAy H 1 3.894 0.020 A 1 GLY HAx H 1 3.855 0.020 A 1 GLY C C 13 170.237 0.3 A 1 GLY CA C 13 43.307 0.3 A 2 ILE H H 1 8.362 0.020 A 2 ILE HA H 1 4.224 0.020 A 2 ILE HB H 1 1.658 0.020 A 2 ILE HD1% H 1 0.640 0.020 A 2 ILE HG1x H 1 0.915 0.020 A 2 ILE HG1y H 1 1.232 0.020 A 2 ILE HG2% H 1 0.620 0.020 A 2 ILE C C 13 174.736 0.3 A 2 ILE CA C 13 60.312 0.3 A 2 ILE CB C 13 39.453 0.3 A 2 ILE CD1 C 13 13.394 0.3 A 2 ILE CG1 C 13 26.905 0.3 A 2 ILE CG2 C 13 17.833 0.3 A 2 ILE N N 15 118.892 0.3 A 3 ASP H H 1 8.144 0.020 A 3 ASP HA H 1 4.607 0.020 A 3 ASP HBy H 1 2.744 0.020 A 3 ASP HBx H 1 2.593 0.020 A 3 ASP C C 13 176.053 0.3 A 3 ASP CA C 13 52.885 0.3 A 3 ASP CB C 13 41.162 0.3 A 3 ASP N N 15 123.532 0.3 A 4 ALA H H 1 8.367 0.020 A 4 ALA HA H 1 3.556 0.020 A 4 ALA HB% H 1 0.991 0.020 A 4 ALA C C 13 177.545 0.3 A 4 ALA CA C 13 55.112 0.3 A 4 ALA CB C 13 19.183 0.3 A 4 ALA N N 15 125.128 0.3 A 5 ALA H H 1 7.626 0.020 A 5 ALA HA H 1 3.272 0.020 A 5 ALA HB% H 1 1.252 0.020 A 5 ALA C C 13 180.004 0.3 A 5 ALA CA C 13 54.948 0.3 A 5 ALA CB C 13 17.977 0.3 A 5 ALA N N 15 118.364 0.3 A 6 GLN H H 1 7.400 0.020 A 6 GLN HA H 1 4.021 0.020 A 6 GLN HBy H 1 2.130 0.020 A 6 GLN HBx H 1 2.069 0.020 A 6 GLN HE21 H 1 6.684 0.020 A 6 GLN HE22 H 1 7.579 0.020 A 6 GLN HGy H 1 2.487 0.020 A 6 GLN HGx H 1 2.350 0.020 A 6 GLN C C 13 178.753 0.3 A 6 GLN CA C 13 58.605 0.3 A 6 GLN CB C 13 28.196 0.3 A 6 GLN CG C 13 33.782 0.3 A 6 GLN N N 15 116.741 0.3 A 6 GLN NE2 N 15 111.762 0.3 A 7 ILE H H 1 7.482 0.020 A 7 ILE HA H 1 3.705 0.020 A 7 ILE HB H 1 1.963 0.020 A 7 ILE HD1% H 1 0.489 0.020 A 7 ILE HG1x H 1 0.853 0.020 A 7 ILE HG1y H 1 1.777 0.020 A 7 ILE HG2% H 1 1.083 0.020 A 7 ILE C C 13 179.067 0.3 A 7 ILE CA C 13 65.159 0.3 A 7 ILE CB C 13 37.300 0.3 A 7 ILE CD1 C 13 12.763 0.3 A 7 ILE CG1 C 13 28.975 0.3 A 7 ILE CG2 C 13 18.874 0.3 A 7 ILE N N 15 120.783 0.3 A 8 VAL H H 1 8.169 0.020 A 8 VAL HA H 1 3.534 0.020 A 8 VAL HB H 1 2.197 0.020 A 8 VAL HGx% H 1 1.145 0.020 A 8 VAL HGy% H 1 1.021 0.020 A 8 VAL C C 13 178.375 0.3 A 8 VAL CA C 13 67.429 0.3 A 8 VAL CB C 13 31.630 0.3 A 8 VAL CG1 C 13 21.564 0.3 A 8 VAL CG2 C 13 23.875 0.3 A 8 VAL N N 15 122.541 0.3 A 9 ASP H H 1 8.311 0.020 A 9 ASP HA H 1 4.532 0.020 A 9 ASP HBy H 1 2.752 0.020 A 9 ASP HBx H 1 2.671 0.020 A 9 ASP C C 13 178.745 0.3 A 9 ASP CA C 13 57.658 0.3 A 9 ASP CB C 13 40.348 0.3 A 9 ASP N N 15 121.736 0.3 A 10 GLU H H 1 8.391 0.020 A 10 GLU HA H 1 4.101 0.020 A 10 GLU HBx H 1 2.200 0.020 A 10 GLU HBy H 1 2.246 0.020 A 10 GLU HGy H 1 2.341 0.020 A 10 GLU HGx H 1 2.107 0.020 A 10 GLU C C 13 178.365 0.3 A 10 GLU CA C 13 59.082 0.3 A 10 GLU CB C 13 30.200 0.3 A 10 GLU CG C 13 36.790 0.3 A 10 GLU N N 15 121.907 0.3 A 11 ALA H H 1 7.959 0.020 A 11 ALA HA H 1 4.118 0.020 A 11 ALA HB% H 1 1.625 0.020 A 11 ALA C C 13 180.004 0.3 A 11 ALA CA C 13 55.948 0.3 A 11 ALA CB C 13 17.266 0.3 A 11 ALA N N 15 121.956 0.3 A 12 LEU H H 1 8.240 0.020 A 12 LEU HA H 1 4.213 0.020 A 12 LEU HBx H 1 1.838 0.020 A 12 LEU HBy H 1 1.929 0.020 A 12 LEU HDx% H 1 0.989 0.020 A 12 LEU HDy% H 1 0.981 0.020 A 12 LEU HG H 1 1.821 0.020 A 12 LEU C C 13 182.257 0.3 A 12 LEU CA C 13 58.179 0.3 A 12 LEU CB C 13 41.740 0.3 A 12 LEU CD1 C 13 24.508 0.3 A 12 LEU CD2 C 13 24.252 0.3 A 12 LEU CG C 13 26.940 0.3 A 12 LEU N N 15 120.741 0.3 A 13 GLU H H 1 8.392 0.020 A 13 GLU HA H 1 4.087 0.020 A 13 GLU HB2 H 1 2.273 0.020 A 13 GLU HB3 H 1 2.273 0.020 A 13 GLU HGx H 1 2.357 0.020 A 13 GLU HGy H 1 2.465 0.020 A 13 GLU C C 13 178.248 0.3 A 13 GLU CA C 13 59.156 0.3 A 13 GLU CB C 13 29.322 0.3 A 13 GLU CG C 13 36.275 0.3 A 13 GLU N N 15 122.135 0.3 A 14 GLN H H 1 7.573 0.020 A 14 GLN HA H 1 4.439 0.020 A 14 GLN HB2 H 1 2.460 0.020 A 14 GLN HB3 H 1 2.460 0.020 A 14 GLN HE21 H 1 7.613 0.020 A 14 GLN HE22 H 1 6.846 0.020 A 14 GLN HG2 H 1 2.566 0.020 A 14 GLN HG3 H 1 2.566 0.020 A 14 GLN C C 13 175.358 0.3 A 14 GLN CA C 13 54.989 0.3 A 14 GLN CB C 13 28.640 0.3 A 14 GLN CG C 13 33.698 0.3 A 14 GLN N N 15 115.785 0.3 A 14 GLN NE2 N 15 113.173 0.3 A 15 GLY H H 1 8.153 0.020 A 15 GLY HAx H 1 3.954 0.020 A 15 GLY HAy H 1 4.256 0.020 A 15 GLY C C 13 175.753 0.3 A 15 GLY CA C 13 46.078 0.3 A 15 GLY N N 15 106.907 0.3 A 16 ILE H H 1 8.918 0.020 A 16 ILE HA H 1 4.652 0.020 A 16 ILE HB H 1 1.721 0.020 A 16 ILE HD1% H 1 1.087 0.020 A 16 ILE HG1y H 1 1.560 0.020 A 16 ILE HG1x H 1 0.973 0.020 A 16 ILE HG2% H 1 0.820 0.020 A 16 ILE C C 13 174.107 0.3 A 16 ILE CA C 13 61.046 0.3 A 16 ILE CB C 13 40.804 0.3 A 16 ILE CD1 C 13 16.753 0.3 A 16 ILE CG1 C 13 27.766 0.3 A 16 ILE CG2 C 13 20.172 0.3 A 16 ILE N N 15 125.504 0.3 A 17 THR H H 1 8.961 0.020 A 17 THR HA H 1 4.226 0.020 A 17 THR HB H 1 4.118 0.020 A 17 THR HG2% H 1 1.153 0.020 A 17 THR C C 13 173.697 0.3 A 17 THR CA C 13 62.241 0.3 A 17 THR CB C 13 70.004 0.3 A 17 THR CG2 C 13 21.244 0.3 A 17 THR N N 15 124.398 0.3 A 18 LEU H H 1 7.829 0.020 A 18 LEU HA H 1 5.013 0.020 A 18 LEU HBy H 1 1.554 0.020 A 18 LEU HBx H 1 1.059 0.020 A 18 LEU HDx% H 1 0.072 0.020 A 18 LEU HDy% H 1 -0.335 0.020 A 18 LEU HG H 1 0.042 0.020 A 18 LEU C C 13 175.365 0.3 A 18 LEU CA C 13 53.723 0.3 A 18 LEU CB C 13 44.086 0.3 A 18 LEU CD1 C 13 25.101 0.3 A 18 LEU CD2 C 13 21.878 0.3 A 18 LEU CG C 13 24.671 0.3 A 18 LEU N N 15 127.737 0.3 A 19 PHE H H 1 8.581 0.020 A 19 PHE HA H 1 4.785 0.020 A 19 PHE HBy H 1 3.106 0.020 A 19 PHE HBx H 1 2.971 0.020 A 19 PHE HD1 H 1 6.890 0.020 A 19 PHE HE1 H 1 6.984 0.020 A 19 PHE HZ H 1 7.118 0.020 A 19 PHE C C 13 171.334 0.3 A 19 PHE CA C 13 56.386 0.3 A 19 PHE CB C 13 39.516 0.3 A 19 PHE CD1 C 13 132.466 0.3 A 19 PHE CE1 C 13 130.581 0.3 A 19 PHE CZ C 13 130.581 0.3 A 19 PHE N N 15 117.371 0.3 A 20 VAL H H 1 8.666 0.020 A 20 VAL HA H 1 4.911 0.020 A 20 VAL HB H 1 1.784 0.020 A 20 VAL HGx% H 1 0.848 0.020 A 20 VAL HGy% H 1 0.826 0.020 A 20 VAL C C 13 175.739 0.3 A 20 VAL CA C 13 59.899 0.3 A 20 VAL CB C 13 34.538 0.3 A 20 VAL CG1 C 13 23.050 0.3 A 20 VAL CG2 C 13 21.648 0.3 A 20 VAL N N 15 118.252 0.3 A 21 VAL H H 1 8.292 0.020 A 21 VAL HA H 1 4.232 0.020 A 21 VAL HB H 1 1.806 0.020 A 21 VAL HGx% H 1 0.895 0.020 A 21 VAL HGy% H 1 0.987 0.020 A 21 VAL C C 13 176.228 0.3 A 21 VAL CA C 13 61.343 0.3 A 21 VAL CB C 13 34.855 0.3 A 21 VAL CG1 C 13 20.601 0.3 A 21 VAL CG2 C 13 21.651 0.3 A 21 VAL N N 15 125.254 0.3 A 22 ASN H H 1 9.623 0.020 A 22 ASN HA H 1 4.287 0.020 A 22 ASN HBy H 1 3.019 0.020 A 22 ASN HBx H 1 2.663 0.020 A 22 ASN HD21 H 1 7.571 0.020 A 22 ASN HD22 H 1 6.901 0.020 A 22 ASN C C 13 174.297 0.3 A 22 ASN CA C 13 54.344 0.3 A 22 ASN CB C 13 37.052 0.3 A 22 ASN N N 15 128.063 0.3 A 22 ASN ND2 N 15 112.467 0.3 A 23 ASN H H 1 8.819 0.020 A 23 ASN HA H 1 3.966 0.020 A 23 ASN HBy H 1 3.070 0.020 A 23 ASN HBx H 1 2.809 0.020 A 23 ASN HD21 H 1 6.809 0.020 A 23 ASN HD22 H 1 7.476 0.020 A 23 ASN C C 13 172.754 0.3 A 23 ASN CA C 13 54.756 0.3 A 23 ASN CB C 13 37.940 0.3 A 23 ASN N N 15 109.550 0.3 A 23 ASN ND2 N 15 112.671 0.3 A 24 ARG H H 1 7.717 0.020 A 24 ARG HA H 1 4.625 0.020 A 24 ARG HB2 H 1 1.766 0.020 A 24 ARG HB3 H 1 1.766 0.020 A 24 ARG HD2 H 1 3.193 0.020 A 24 ARG HD3 H 1 3.193 0.020 A 24 ARG HGy H 1 1.692 0.020 A 24 ARG HGx H 1 1.579 0.020 A 24 ARG C C 13 174.876 0.3 A 24 ARG CA C 13 54.439 0.3 A 24 ARG CB C 13 32.342 0.3 A 24 ARG CD C 13 43.294 0.3 A 24 ARG CG C 13 27.111 0.3 A 24 ARG N N 15 117.267 0.3 A 25 LEU H H 1 8.638 0.020 A 25 LEU HA H 1 4.277 0.020 A 25 LEU HBx H 1 1.182 0.020 A 25 LEU HBy H 1 1.770 0.020 A 25 LEU HDx% H 1 0.709 0.020 A 25 LEU HDy% H 1 0.836 0.020 A 25 LEU HG H 1 1.395 0.020 A 25 LEU C C 13 175.365 0.3 A 25 LEU CA C 13 55.021 0.3 A 25 LEU CB C 13 42.637 0.3 A 25 LEU CD1 C 13 24.236 0.3 A 25 LEU CD2 C 13 26.668 0.3 A 25 LEU CG C 13 26.873 0.3 A 25 LEU N N 15 124.702 0.3 A 26 GLN H H 1 8.935 0.020 A 26 GLN HA H 1 4.206 0.020 A 26 GLN HB2 H 1 1.308 0.020 A 26 GLN HB3 H 1 1.308 0.020 A 26 GLN HE21 H 1 6.713 0.020 A 26 GLN HE22 H 1 6.889 0.020 A 26 GLN HGx H 1 1.788 0.020 A 26 GLN HGy H 1 1.915 0.020 A 26 GLN C C 13 172.233 0.3 A 26 GLN CA C 13 53.061 0.3 A 26 GLN CB C 13 31.932 0.3 A 26 GLN CG C 13 33.522 0.3 A 26 GLN N N 15 127.315 0.3 A 26 GLN NE2 N 15 111.795 0.3 A 27 TYR H H 1 7.366 0.020 A 27 TYR HA H 1 5.622 0.020 A 27 TYR HBy H 1 2.579 0.020 A 27 TYR HBx H 1 2.491 0.020 A 27 TYR HD1 H 1 6.645 0.020 A 27 TYR HE1 H 1 6.760 0.020 A 27 TYR C C 13 175.241 0.3 A 27 TYR CA C 13 54.261 0.3 A 27 TYR CB C 13 40.954 0.3 A 27 TYR CD1 C 13 133.539 0.3 A 27 TYR CE1 C 13 117.759 0.3 A 27 TYR N N 15 112.754 0.3 A 28 GLU H H 1 8.786 0.020 A 28 GLU HA H 1 4.935 0.020 A 28 GLU HB2 H 1 2.046 0.020 A 28 GLU HB3 H 1 2.046 0.020 A 28 GLU HG2 H 1 2.267 0.020 A 28 GLU HG3 H 1 2.267 0.020 A 28 GLU C C 13 174.487 0.3 A 28 GLU CA C 13 54.622 0.3 A 28 GLU CB C 13 33.208 0.3 A 28 GLU CG C 13 36.041 0.3 A 28 GLU N N 15 120.921 0.3 A 29 THR H H 1 8.816 0.020 A 29 THR HA H 1 4.953 0.020 A 29 THR HB H 1 4.392 0.020 A 29 THR HG2% H 1 1.239 0.020 A 29 THR C C 13 171.399 0.3 A 29 THR CA C 13 60.569 0.3 A 29 THR CB C 13 69.655 0.3 A 29 THR CG2 C 13 18.176 0.3 A 29 THR N N 15 119.014 0.3 A 30 SER H H 1 8.833 0.020 A 30 SER HA H 1 4.747 0.020 A 30 SER HB2 H 1 3.989 0.020 A 30 SER HB3 H 1 3.989 0.020 A 30 SER C C 13 175.233 0.3 A 30 SER CA C 13 58.213 0.3 A 30 SER CB C 13 63.681 0.3 A 30 SER N N 15 120.903 0.3 A 31 ARG H H 1 8.520 0.020 A 31 ARG HA H 1 4.337 0.020 A 31 ARG HB2 H 1 1.747 0.020 A 31 ARG HB3 H 1 1.747 0.020 A 31 ARG HDy H 1 3.697 0.020 A 31 ARG HDx H 1 3.068 0.020 A 31 ARG HG2 H 1 1.830 0.020 A 31 ARG HG3 H 1 1.830 0.020 A 31 ARG C C 13 176.629 0.3 A 31 ARG CA C 13 56.376 0.3 A 31 ARG CB C 13 32.057 0.3 A 31 ARG CD C 13 43.967 0.3 A 31 ARG CG C 13 27.498 0.3 A 31 ARG N N 15 123.865 0.3 A 32 ASP H H 1 8.618 0.020 A 32 ASP HA H 1 4.490 0.020 A 32 ASP HB2 H 1 2.755 0.020 A 32 ASP HB3 H 1 2.755 0.020 A 32 ASP C C 13 177.000 0.3 A 32 ASP CA C 13 55.640 0.3 A 32 ASP CB C 13 41.170 0.3 A 32 ASP N N 15 119.641 0.3 A 33 SER H H 1 7.582 0.020 A 33 SER HA H 1 4.205 0.020 A 33 SER CA C 13 56.811 0.3 A 33 SER N N 15 111.277 0.3 A 34 ILE H H 1 8.809 0.020 A 34 ILE HA H 1 4.467 0.020 A 34 ILE HB H 1 1.605 0.020 A 34 ILE HD1% H 1 0.702 0.020 A 34 ILE HG1x H 1 1.443 0.020 A 34 ILE HG1y H 1 1.830 0.020 A 34 ILE HG2% H 1 0.734 0.020 A 34 ILE CA C 13 57.386 0.3 A 34 ILE CB C 13 39.855 0.3 A 34 ILE CD1 C 13 13.310 0.3 A 34 ILE CG1 C 13 27.280 0.3 A 34 ILE CG2 C 13 17.361 0.3 A 35 PRO HA H 1 4.496 0.020 A 35 PRO HB2 H 1 1.726 0.020 A 35 PRO HB3 H 1 1.726 0.020 A 35 PRO HDy H 1 3.936 0.020 A 35 PRO HDx H 1 3.369 0.020 A 35 PRO HGx H 1 2.030 0.020 A 35 PRO HGy H 1 2.091 0.020 A 35 PRO CA C 13 63.769 0.3 A 35 PRO CB C 13 32.696 0.3 A 35 PRO CD C 13 51.343 0.3 A 35 PRO CG C 13 27.669 0.3 A 36 THR H H 1 8.711 0.020 A 36 THR HA H 1 3.626 0.020 A 36 THR HB H 1 4.042 0.020 A 36 THR HG2% H 1 1.196 0.020 A 36 THR CA C 13 65.966 0.3 A 36 THR CB C 13 68.446 0.3 A 36 THR CG2 C 13 22.187 0.3 A 36 THR N N 15 122.441 0.3 A 37 GLU H H 1 9.255 0.020 A 37 GLU HA H 1 3.955 0.020 A 37 GLU HB2 H 1 1.839 0.020 A 37 GLU HB3 H 1 1.839 0.020 A 37 GLU HG2 H 1 2.213 0.020 A 37 GLU HG3 H 1 2.213 0.020 A 37 GLU CA C 13 59.312 0.3 A 37 GLU CB C 13 28.616 0.3 A 37 GLU CG C 13 35.860 0.3 A 37 GLU N N 15 119.100 0.3 A 38 LEU H H 1 6.739 0.020 A 38 LEU HA H 1 3.570 0.020 A 38 LEU HBx H 1 0.686 0.020 A 38 LEU HBy H 1 1.133 0.020 A 38 LEU HDx% H 1 0.798 0.020 A 38 LEU HDy% H 1 0.721 0.020 A 38 LEU HG H 1 1.395 0.020 A 38 LEU CA C 13 56.963 0.3 A 38 LEU CB C 13 40.011 0.3 A 38 LEU CD1 C 13 24.711 0.3 A 38 LEU CD2 C 13 22.755 0.3 A 38 LEU CG C 13 26.924 0.3 A 38 LEU N N 15 118.603 0.3 A 39 LEU H H 1 6.553 0.020 A 39 LEU HA H 1 3.129 0.020 A 39 LEU HBy H 1 1.483 0.020 A 39 LEU HBx H 1 1.367 0.020 A 39 LEU HDx% H 1 0.797 0.020 A 39 LEU HDy% H 1 0.724 0.020 A 39 LEU HG H 1 1.177 0.020 A 39 LEU C C 13 180.261 0.3 A 39 LEU CA C 13 57.647 0.3 A 39 LEU CB C 13 41.628 0.3 A 39 LEU CD1 C 13 25.437 0.3 A 39 LEU CD2 C 13 23.667 0.3 A 39 LEU CG C 13 26.410 0.3 A 39 LEU N N 15 116.912 0.3 A 40 ASN H H 1 8.171 0.020 A 40 ASN HA H 1 4.344 0.020 A 40 ASN HB2 H 1 2.673 0.020 A 40 ASN HB3 H 1 2.673 0.020 A 40 ASN HD21 H 1 6.895 0.020 A 40 ASN HD22 H 1 7.547 0.020 A 40 ASN C C 13 177.363 0.3 A 40 ASN CA C 13 55.432 0.3 A 40 ASN CB C 13 37.540 0.3 A 40 ASN N N 15 114.850 0.3 A 40 ASN ND2 N 15 111.894 0.3 A 41 LYS H H 1 7.211 0.020 A 41 LYS HA H 1 4.162 0.020 A 41 LYS HBy H 1 1.958 0.020 A 41 LYS HBx H 1 1.847 0.020 A 41 LYS HD2 H 1 1.764 0.020 A 41 LYS HD3 H 1 1.764 0.020 A 41 LYS HE2 H 1 2.853 0.020 A 41 LYS HE3 H 1 2.853 0.020 A 41 LYS HGy H 1 1.690 0.020 A 41 LYS HGx H 1 1.478 0.020 A 41 LYS C C 13 178.628 0.3 A 41 LYS CA C 13 59.610 0.3 A 41 LYS CB C 13 31.986 0.3 A 41 LYS CD C 13 29.909 0.3 A 41 LYS CE C 13 41.220 0.3 A 41 LYS CG C 13 25.301 0.3 A 41 LYS N N 15 123.329 0.3 A 42 TRP H H 1 8.142 0.020 A 42 TRP HA H 1 4.453 0.020 A 42 TRP HBy H 1 3.283 0.020 A 42 TRP HBx H 1 2.979 0.020 A 42 TRP HD1 H 1 6.459 0.020 A 42 TRP HE1 H 1 10.750 0.020 A 42 TRP HE3 H 1 7.172 0.020 A 42 TRP HH2 H 1 6.678 0.020 A 42 TRP HZ2 H 1 7.001 0.020 A 42 TRP HZ3 H 1 6.033 0.020 A 42 TRP C C 13 178.365 0.3 A 42 TRP CA C 13 57.285 0.3 A 42 TRP CB C 13 27.769 0.3 A 42 TRP CD1 C 13 123.317 0.3 A 42 TRP CE3 C 13 120.668 0.3 A 42 TRP CH2 C 13 123.608 0.3 A 42 TRP CZ2 C 13 112.700 0.3 A 42 TRP CZ3 C 13 120.271 0.3 A 42 TRP N N 15 120.249 0.3 A 42 TRP NE1 N 15 127.942 0.3 A 43 LYS H H 1 7.738 0.020 A 43 LYS HA H 1 4.073 0.020 A 43 LYS HB2 H 1 1.983 0.020 A 43 LYS HB3 H 1 1.983 0.020 A 43 LYS HD2 H 1 1.706 0.020 A 43 LYS HD3 H 1 1.706 0.020 A 43 LYS HE2 H 1 2.971 0.020 A 43 LYS HE3 H 1 2.971 0.020 A 43 LYS HG2 H 1 1.463 0.020 A 43 LYS HG3 H 1 1.463 0.020 A 43 LYS C C 13 179.734 0.3 A 43 LYS CA C 13 59.601 0.3 A 43 LYS CB C 13 32.528 0.3 A 43 LYS CD C 13 29.579 0.3 A 43 LYS CE C 13 42.046 0.3 A 43 LYS CG C 13 25.010 0.3 A 43 LYS N N 15 115.894 0.3 A 44 GLN H H 1 7.978 0.020 A 44 GLN HA H 1 3.992 0.020 A 44 GLN HBy H 1 2.055 0.020 A 44 GLN HBx H 1 1.820 0.020 A 44 GLN HE21 H 1 7.357 0.020 A 44 GLN HE22 H 1 6.812 0.020 A 44 GLN HGx H 1 2.049 0.020 A 44 GLN HGy H 1 2.239 0.020 A 44 GLN C C 13 177.062 0.3 A 44 GLN CA C 13 58.052 0.3 A 44 GLN CB C 13 28.565 0.3 A 44 GLN CG C 13 33.201 0.3 A 44 GLN N N 15 118.493 0.3 A 44 GLN NE2 N 15 111.521 0.3 A 45 HIS H H 1 7.583 0.020 A 45 HIS HA H 1 5.117 0.020 A 45 HIS HBy H 1 3.479 0.020 A 45 HIS HBx H 1 2.713 0.020 A 45 HIS HD2 H 1 7.248 0.020 A 45 HIS HE1 H 1 8.151 0.020 A 45 HIS C C 13 174.861 0.3 A 45 HIS CA C 13 54.367 0.3 A 45 HIS CB C 13 28.488 0.3 A 45 HIS CD2 C 13 124.008 0.3 A 45 HIS CE1 C 13 137.801 0.3 A 45 HIS N N 15 115.233 0.3 A 46 LYS H H 1 6.918 0.020 A 46 LYS HA H 1 3.952 0.020 A 46 LYS HBy H 1 2.220 0.020 A 46 LYS HBx H 1 1.929 0.020 A 46 LYS HD2 H 1 1.852 0.020 A 46 LYS HD3 H 1 1.852 0.020 A 46 LYS HE2 H 1 3.081 0.020 A 46 LYS HE3 H 1 3.081 0.020 A 46 LYS HG2 H 1 1.498 0.020 A 46 LYS HG3 H 1 1.498 0.020 A 46 LYS C C 13 177.370 0.3 A 46 LYS CA C 13 61.490 0.3 A 46 LYS CB C 13 32.835 0.3 A 46 LYS CD C 13 29.630 0.3 A 46 LYS CE C 13 41.679 0.3 A 46 LYS CG C 13 24.039 0.3 A 46 LYS N N 15 121.445 0.3 A 47 GLN H H 1 8.655 0.020 A 47 GLN HA H 1 3.883 0.020 A 47 GLN HBy H 1 2.178 0.020 A 47 GLN HBx H 1 2.046 0.020 A 47 GLN HE21 H 1 7.895 0.020 A 47 GLN HE22 H 1 6.999 0.020 A 47 GLN HG2 H 1 2.438 0.020 A 47 GLN HG3 H 1 2.438 0.020 A 47 GLN C C 13 177.627 0.3 A 47 GLN CA C 13 58.605 0.3 A 47 GLN CB C 13 28.217 0.3 A 47 GLN CG C 13 33.666 0.3 A 47 GLN N N 15 117.778 0.3 A 47 GLN NE2 N 15 116.470 0.3 A 48 GLU H H 1 8.474 0.020 A 48 GLU HA H 1 4.196 0.020 A 48 GLU HB2 H 1 2.269 0.020 A 48 GLU HB3 H 1 2.269 0.020 A 48 GLU HGy H 1 2.505 0.020 A 48 GLU HGx H 1 2.447 0.020 A 48 GLU C C 13 180.516 0.3 A 48 GLU CA C 13 59.618 0.3 A 48 GLU CB C 13 29.203 0.3 A 48 GLU CG C 13 37.116 0.3 A 48 GLU N N 15 118.474 0.3 A 49 LEU H H 1 8.364 0.020 A 49 LEU HA H 1 4.021 0.020 A 49 LEU HBy H 1 2.188 0.020 A 49 LEU HBx H 1 1.171 0.020 A 49 LEU HDx% H 1 0.760 0.020 A 49 LEU HDy% H 1 0.953 0.020 A 49 LEU HG H 1 1.768 0.020 A 49 LEU C C 13 177.809 0.3 A 49 LEU CA C 13 58.308 0.3 A 49 LEU CB C 13 42.420 0.3 A 49 LEU CD1 C 13 23.901 0.3 A 49 LEU CD2 C 13 26.256 0.3 A 49 LEU CG C 13 27.161 0.3 A 49 LEU N N 15 120.506 0.3 A 50 ILE H H 1 8.523 0.020 A 50 ILE HA H 1 3.411 0.020 A 50 ILE HB H 1 1.858 0.020 A 50 ILE HD1% H 1 0.795 0.020 A 50 ILE HG1y H 1 1.839 0.020 A 50 ILE HG1x H 1 0.642 0.020 A 50 ILE HG2% H 1 0.817 0.020 A 50 ILE C C 13 177.575 0.3 A 50 ILE CA C 13 65.882 0.3 A 50 ILE CB C 13 38.330 0.3 A 50 ILE CD1 C 13 13.966 0.3 A 50 ILE CG1 C 13 30.116 0.3 A 50 ILE CG2 C 13 16.849 0.3 A 50 ILE N N 15 120.894 0.3 A 51 ASP H H 1 8.559 0.020 A 51 ASP HA H 1 4.387 0.020 A 51 ASP HBy H 1 2.760 0.020 A 51 ASP HBx H 1 2.693 0.020 A 51 ASP C C 13 178.870 0.3 A 51 ASP CA C 13 57.363 0.3 A 51 ASP CB C 13 40.080 0.3 A 51 ASP N N 15 118.252 0.3 A 52 PHE H H 1 7.882 0.020 A 52 PHE HA H 1 4.291 0.020 A 52 PHE HBy H 1 3.270 0.020 A 52 PHE HBx H 1 3.014 0.020 A 52 PHE HD1 H 1 7.094 0.020 A 52 PHE HE1 H 1 7.133 0.020 A 52 PHE HZ H 1 7.349 0.020 A 52 PHE C C 13 177.618 0.3 A 52 PHE CA C 13 60.934 0.3 A 52 PHE CB C 13 40.465 0.3 A 52 PHE CD1 C 13 131.420 0.3 A 52 PHE CE1 C 13 131.213 0.3 A 52 PHE CZ C 13 131.474 0.3 A 52 PHE N N 15 119.989 0.3 A 53 LEU H H 1 8.683 0.020 A 53 LEU HA H 1 3.832 0.020 A 53 LEU HBx H 1 1.398 0.020 A 53 LEU HBy H 1 1.845 0.020 A 53 LEU HDx% H 1 0.986 0.020 A 53 LEU HDy% H 1 1.923 0.020 A 53 LEU HG H 1 0.544 0.020 A 53 LEU C C 13 179.799 0.3 A 53 LEU CA C 13 57.362 0.3 A 53 LEU CB C 13 41.888 0.3 A 53 LEU CD1 C 13 22.682 0.3 A 53 LEU CD2 C 13 27.661 0.3 A 53 LEU CG C 13 26.687 0.3 A 53 LEU N N 15 120.335 0.3 A 54 ASN H H 1 8.594 0.020 A 54 ASN HA H 1 4.596 0.020 A 54 ASN HBy H 1 2.994 0.020 A 54 ASN HBx H 1 2.785 0.020 A 54 ASN HD21 H 1 7.587 0.020 A 54 ASN HD22 H 1 6.765 0.020 A 54 ASN C C 13 177.370 0.3 A 54 ASN CA C 13 54.425 0.3 A 54 ASN CB C 13 38.043 0.3 A 54 ASN N N 15 118.392 0.3 A 54 ASN ND2 N 15 110.530 0.3 A 55 GLN H H 1 7.638 0.020 A 55 GLN HA H 1 4.207 0.020 A 55 GLN HB2 H 1 2.131 0.020 A 55 GLN HB3 H 1 2.131 0.020 A 55 GLN HE21 H 1 6.810 0.020 A 55 GLN HE22 H 1 7.464 0.020 A 55 GLN HGx H 1 2.346 0.020 A 55 GLN HGy H 1 2.510 0.020 A 55 GLN C C 13 176.989 0.3 A 55 GLN CA C 13 56.927 0.3 A 55 GLN CB C 13 28.166 0.3 A 55 GLN CG C 13 33.615 0.3 A 55 GLN N N 15 119.131 0.3 A 55 GLN NE2 N 15 112.562 0.3 A 56 LEU H H 1 7.563 0.020 A 56 LEU HA H 1 4.054 0.020 A 56 LEU HBy H 1 1.534 0.020 A 56 LEU HBx H 1 1.481 0.020 A 56 LEU HDx% H 1 0.806 0.020 A 56 LEU HDy% H 1 0.723 0.020 A 56 LEU HG H 1 1.452 0.020 A 56 LEU C C 13 177.867 0.3 A 56 LEU CA C 13 56.190 0.3 A 56 LEU CB C 13 42.048 0.3 A 56 LEU CD1 C 13 24.957 0.3 A 56 LEU CD2 C 13 23.317 0.3 A 56 LEU CG C 13 26.238 0.3 A 56 LEU N N 15 121.329 0.3 A 57 ASP H H 1 8.012 0.020 A 57 ASP HA H 1 4.598 0.020 A 57 ASP HBy H 1 2.739 0.020 A 57 ASP HBx H 1 2.649 0.020 A 57 ASP C C 13 176.623 0.3 A 57 ASP CA C 13 54.684 0.3 A 57 ASP CB C 13 41.163 0.3 A 57 ASP N N 15 119.934 0.3 A 58 SER H H 1 8.049 0.020 A 58 SER HA H 1 4.388 0.020 A 58 SER HBy H 1 3.936 0.020 A 58 SER HBx H 1 3.879 0.020 A 58 SER C C 13 175.080 0.3 A 58 SER CA C 13 58.888 0.3 A 58 SER CB C 13 63.754 0.3 A 58 SER N N 15 115.723 0.3 A 59 GLU H H 1 8.336 0.020 A 59 GLU HA H 1 4.260 0.020 A 59 GLU HBy H 1 2.058 0.020 A 59 GLU HBx H 1 1.978 0.020 A 59 GLU HGx H 1 2.251 0.020 A 59 GLU HGy H 1 2.318 0.020 A 59 GLU C C 13 176.872 0.3 A 59 GLU CA C 13 56.863 0.3 A 59 GLU CB C 13 30.024 0.3 A 59 GLU CG C 13 36.224 0.3 A 59 GLU N N 15 122.613 0.3 A 60 GLU H H 1 8.319 0.020 A 60 GLU HA H 1 4.228 0.020 A 60 GLU HBy H 1 2.040 0.020 A 60 GLU HBx H 1 1.981 0.020 A 60 GLU HG2 H 1 2.259 0.020 A 60 GLU HG3 H 1 2.259 0.020 A 60 GLU C C 13 176.711 0.3 A 60 GLU CA C 13 56.785 0.3 A 60 GLU CB C 13 30.079 0.3 A 60 GLU CG C 13 36.120 0.3 A 60 GLU N N 15 121.446 0.3 A 61 GLN H H 1 8.359 0.020 A 61 GLN HA H 1 4.379 0.020 A 61 GLN HBy H 1 2.150 0.020 A 61 GLN HBx H 1 1.999 0.020 A 61 GLN HE21 H 1 6.895 0.020 A 61 GLN HE22 H 1 7.580 0.020 A 61 GLN HG2 H 1 2.401 0.020 A 61 GLN C C 13 176.243 0.3 A 61 GLN CA C 13 55.825 0.3 A 61 GLN CB C 13 29.374 0.3 A 61 GLN CG C 13 33.659 0.3 A 61 GLN N N 15 121.044 0.3 A 61 GLN NE2 N 15 112.959 0.3 A 62 THR H H 1 8.208 0.020 A 62 THR HA H 1 4.313 0.020 A 62 THR HB H 1 4.225 0.020 A 62 THR C C 13 173.676 0.3 A 62 THR CA C 13 61.876 0.3 A 62 THR CB C 13 69.604 0.3 A 62 THR N N 15 115.879 0.3 A 63 LYS H H 1 7.974 0.020 A 63 LYS HA H 1 4.164 0.020 A 63 LYS HBy H 1 1.819 0.020 A 63 LYS HBx H 1 1.714 0.020 A 63 LYS HD2 H 1 1.653 0.020 A 63 LYS HD3 H 1 1.653 0.020 A 63 LYS HE2 H 1 2.974 0.020 A 63 LYS HE3 H 1 2.974 0.020 A 63 LYS HG2 H 1 1.380 0.020 A 63 LYS HG3 H 1 1.380 0.020 A 63 LYS CA C 13 57.779 0.3 A 63 LYS CB C 13 33.645 0.3 A 63 LYS CD C 13 29.192 0.3 A 63 LYS CE C 13 42.143 0.3 A 63 LYS CG C 13 24.584 0.3 A 63 LYS N N 15 129.158 0.3 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 63 LYS H A 63 LYS HG2 1.0 . 5.11 2 2 A 63 LYS H A 63 LYS HG3 1.0 . 5.11 3 3 A 63 LYS H A 62 THR H 1.0 . 4.82 4 4 A 63 LYS H A 62 THR HG21 1.0 . 4.61 5 5 A 22 ASN H A 21 VAL HGx% 1.0 . 4.24 6 6 A 22 ASN H A 21 VAL HGy% 1.0 . 4.24 7 7 A 11 ALA HB% A 42 TRP HE1 1.0 . 4.27 8 8 A 42 TRP HE1 A 18 LEU HG 1.0 . 5.17 9 9 A 42 TRP HE1 A 18 LEU HDy% 1.0 . 5.34 10 10 A 42 TRP HE1 A 38 LEU HA 1.0 . 5.17 11 11 A 42 TRP HE1 A 7 ILE HG2% 1.0 . 3.67 12 12 A 18 LEU H A 19 PHE H 1.0 . 4.78 13 13 A 18 LEU H A 18 LEU HBy 1.0 . 3.14 14 14 A 18 LEU H A 17 THR HG2% 1.0 . 2.94 15 15 A 18 LEU H A 18 LEU HBx 1.0 . 3.61 16 16 A 18 LEU HDy% A 18 LEU H 1.0 . 4.38 17 17 A 18 LEU H A 12 LEU HG 1.0 . 4.27 18 18 A 18 LEU H A 27 TYR HA 1.0 . 5.34 19 19 A 18 LEU H A 53 LEU HG 1.0 . 5.50 20 20 A 18 LEU H A 18 LEU HDx% 1.0 . 4.53 21 21 A 26 GLN H A 26 GLN HGx 1.0 . 3.83 22 22 A 26 GLN H A 25 LEU HG 1.0 . 3.97 23 23 A 26 GLN H A 25 LEU HBx 1.0 . 4.74 24 24 A 26 GLN H A 26 GLN HB2 1.0 . 3.73 25 24 A 26 GLN H A 26 GLN HB3 1.0 . 3.73 26 25 A 26 GLN H A 26 GLN HGy 1.0 . 4.07 27 26 A 18 LEU HDy% A 26 GLN H 1.0 . 5.49 28 27 A 12 LEU HDy% A 16 ILE H 1.0 . 4.61 29 28 A 16 ILE H A 16 ILE HG2% 1.0 . 4.72 30 29 A 26 GLN HGy A 21 VAL H 1.0 . 3.60 31 30 A 21 VAL H A 20 VAL H 1.0 . 4.39 32 31 A 21 VAL H A 21 VAL HB 1.0 . 3.28 33 32 A 4 ALA H A 5 ALA HA 1.0 . 5.50 34 33 A 4 ALA H A 3 ASP HBy 1.0 . 4.07 35 34 A 4 ALA H A 3 ASP HBx 1.0 . 3.71 36 35 A 4 ALA H A 2 ILE HG1y 1.0 . 4.32 37 36 A 4 ALA H A 4 ALA HB% 1.0 . 2.66 38 37 A 4 ALA H A 7 ILE HD1% 1.0 . 4.39 39 38 A 4 ALA H A 49 LEU HDy% 1.0 . 5.01 40 39 A 25 LEU H A 25 LEU HBy 1.0 . 4.11 41 40 A 25 LEU H A 25 LEU HDy% 1.0 . 5.03 42 41 A 27 TYR HA A 17 THR H 1.0 . 4.88 43 42 A 18 LEU H A 17 THR H 1.0 . 4.65 44 43 A 17 THR H A 28 GLU HG2 1.0 . 4.58 45 43 A 17 THR H A 28 GLU HG3 1.0 . 4.58 46 44 A 17 THR H A 16 ILE HG1x 1.0 . 4.79 47 45 A 17 THR H A 29 THR HG2% 1.0 . 4.69 48 46 A 17 THR HG2% A 17 THR H 1.0 . 3.65 49 47 A 12 LEU HDy% A 17 THR H 1.0 . 4.36 50 48 A 16 ILE HG2% A 17 THR H 1.0 . 3.13 51 49 A 17 THR H A 27 TYR HBy 1.0 . 4.60 52 50 A 17 THR H A 16 ILE HB 1.0 . 4.34 53 51 A 29 THR HG2% A 31 ARG H 1.0 . 3.84 54 52 A 2 ILE H A 3 ASP H 1.0 . 4.97 55 53 A 4 ALA H A 3 ASP H 1.0 . 5.31 56 54 A 3 ASP HBy A 3 ASP H 1.0 . 3.20 57 55 A 3 ASP HBx A 3 ASP H 1.0 . 3.70 58 56 A 3 ASP H A 2 ILE HG1x 1.0 . 4.22 59 57 A 3 ASP H A 2 ILE HD1% 1.0 . 3.32 60 58 A 3 ASP H A 6 GLN HBx 1.0 . 4.60 61 59 A 2 ILE HG1y A 3 ASP H 1.0 . 3.90 62 60 A 41 LYS H A 41 LYS HBy 1.0 . 3.74 63 61 A 57 ASP HBy A 59 GLU H 1.0 . 5.50 64 62 A 36 THR H A 36 THR HG2% 1.0 . 3.95 65 63 A 59 GLU H A 58 SER HBy 1.0 . 4.32 66 64 A 59 GLU H A 59 GLU HGy 1.0 . 4.28 67 65 A 7 ILE HG1y A 8 VAL H 1.0 . 4.37 68 66 A 8 VAL H A 5 ALA HB% 1.0 . 4.64 69 67 A 8 VAL H A 7 ILE HG1x 1.0 . 5.19 70 68 A 59 GLU H A 59 GLU HGx 1.0 . 4.28 71 69 A 8 VAL H A 9 ASP HBy 1.0 . 5.50 72 70 A 8 VAL H A 9 ASP H 1.0 . 4.46 73 71 A 8 VAL H A 8 VAL HB 1.0 . 2.83 74 72 A 8 VAL H A 7 ILE HB 1.0 . 3.18 75 73 A 8 VAL H A 8 VAL HGy% 1.0 . 2.77 76 74 A 7 ILE HD1% A 8 VAL H 1.0 . 4.65 77 75 A 13 GLU H A 13 GLU HGx 1.0 . 3.51 78 76 A 13 GLU H A 12 LEU HBy 1.0 . 3.83 79 77 A 13 GLU H A 12 LEU HBx 1.0 . 3.33 80 78 A 13 GLU H A 13 GLU HB2 1.0 . 2.55 81 78 A 13 GLU H A 13 GLU HB3 1.0 . 2.55 82 79 A 18 LEU HG A 11 ALA H 1.0 . 5.15 83 80 A 8 VAL HGy% A 11 ALA H 1.0 . 5.50 84 81 A 9 ASP HBy A 10 GLU H 1.0 . 3.95 85 82 A 10 GLU H A 10 GLU HGy 1.0 . 3.53 86 83 A 11 ALA H A 10 GLU H 1.0 . 3.06 87 84 A 11 ALA H A 12 LEU H 1.0 . 3.18 88 85 A 11 ALA H A 10 GLU HGy 1.0 . 3.69 89 86 A 11 ALA HB% A 11 ALA H 1.0 . 2.75 90 87 A 7 ILE HG2% A 11 ALA H 1.0 . 4.20 91 88 A 10 GLU H A 7 ILE HA 1.0 . 3.83 92 89 A 10 GLU H A 9 ASP HBx 1.0 . 3.40 93 90 A 5 ALA HB% A 9 ASP H 1.0 . 5.50 94 91 A 5 ALA HA A 9 ASP H 1.0 . 4.23 95 92 A 9 ASP H A 6 GLN HA 1.0 . 4.07 96 93 A 9 ASP H A 7 ILE HA 1.0 . 4.54 97 94 A 9 ASP HBy A 9 ASP H 1.0 . 2.80 98 95 A 9 ASP H A 9 ASP HBx 1.0 . 3.20 99 96 A 9 ASP H A 8 VAL HB 1.0 . 2.91 100 97 A 9 ASP H A 8 VAL HGy% 1.0 . 4.08 101 98 A 44 GLN H A 46 LYS H 1.0 . 4.42 102 99 A 46 LYS H A 45 HIS H 1.0 . 3.24 103 100 A 46 LYS H A 49 LEU HDx% 1.0 . 4.47 104 101 A 46 LYS H A 45 HIS HBy 1.0 . 4.38 105 102 A 46 LYS H A 46 LYS HBy 1.0 . 2.92 106 103 A 46 LYS H A 46 LYS HBx 1.0 . 3.00 107 104 A 54 ASN H A 56 LEU H 1.0 . 4.14 108 105 A 56 LEU H A 57 ASP H 1.0 . 3.06 109 106 A 56 LEU H A 55 GLN HGy 1.0 . 3.97 110 107 A 56 LEU H A 55 GLN HB2 1.0 . 3.90 111 107 A 56 LEU H A 55 GLN HB3 1.0 . 3.90 112 108 A 56 LEU H A 56 LEU HBy 1.0 . 3.32 113 109 A 56 LEU H A 56 LEU HDy% 1.0 . 4.37 114 110 A 56 LEU H A 56 LEU HDx% 1.0 . 4.37 115 111 A 56 LEU H A 54 ASN HBx 1.0 . 5.50 116 112 A 56 LEU H A 57 ASP HBx 1.0 . 5.50 117 113 A 61 GLN H A 61 GLN HBy 1.0 . 3.76 118 114 A 61 GLN H A 61 GLN HG2 1.0 . 3.54 119 114 A 61 GLN H A 61 GLN HGy 1.0 . 3.54 120 115 A 61 GLN H A 61 GLN HBx 1.0 . 3.76 121 116 A 30 SER H A 31 ARG HG2 1.0 . 5.50 122 117 A 30 SER H A 31 ARG HG3 1.0 . 5.50 123 118 A 17 THR H A 28 GLU H 1.0 . 3.36 124 119 A 28 GLU H A 19 PHE HE% 1.0 . 3.85 125 120 A 28 GLU H A 19 PHE HD% 1.0 . 4.01 126 121 A 27 TYR HA A 28 GLU H 1.0 . 2.97 127 122 A 27 TYR HBy A 28 GLU H 1.0 . 3.51 128 123 A 28 GLU H A 28 GLU HG2 1.0 . 3.90 129 123 A 28 GLU HG3 A 28 GLU H 1.0 . 3.90 130 124 A 28 GLU H A 28 GLU HB2 1.0 . 3.23 131 124 A 28 GLU H A 28 GLU HB3 1.0 . 3.23 132 125 A 17 THR HG2% A 28 GLU H 1.0 . 4.11 133 126 A 16 ILE HG2% A 28 GLU H 1.0 . 3.70 134 127 A 31 ARG H A 30 SER H 1.0 . 4.23 135 128 A 29 THR HG2% A 30 SER H 1.0 . 5.50 136 129 A 28 GLU H A 19 PHE HZ 1.0 . 5.50 137 130 A 28 GLU H A 27 TYR HD% 1.0 . 4.22 138 131 A 50 ILE H A 50 ILE HB 1.0 . 3.21 139 132 A 50 ILE H A 50 ILE HG1x 1.0 . 3.31 140 133 A 50 ILE H A 49 LEU HBx 1.0 . 3.76 141 134 A 49 LEU HDx% A 50 ILE H 1.0 . 4.02 142 135 A 18 LEU HG A 12 LEU H 1.0 . 5.50 143 136 A 18 LEU HDy% A 12 LEU H 1.0 . 5.50 144 137 A 50 ILE H A 49 LEU H 1.0 . 4.35 145 138 A 13 GLU H A 12 LEU H 1.0 . 4.42 146 139 A 12 LEU H A 9 ASP HBx 1.0 . 5.50 147 140 A 12 LEU HBx A 12 LEU H 1.0 . 2.88 148 141 A 12 LEU H A 8 VAL HGx% 1.0 . 5.50 149 142 A 12 LEU H A 12 LEU HDx% 1.0 . 3.57 150 143 A 3 ASP HBy A 7 ILE H 1.0 . 4.22 151 144 A 4 ALA H A 7 ILE H 1.0 . 5.36 152 145 A 10 GLU H A 7 ILE H 1.0 . 5.50 153 146 A 9 ASP H A 7 ILE H 1.0 . 5.50 154 147 A 8 VAL H A 7 ILE H 1.0 . 3.16 155 148 A 6 GLN HBx A 7 ILE H 1.0 . 3.71 156 149 A 5 ALA HB% A 7 ILE H 1.0 . 4.56 157 150 A 7 ILE HD1% A 7 ILE H 1.0 . 3.57 158 151 A 12 LEU H A 8 VAL HA 1.0 . 4.44 159 152 A 7 ILE H A 4 ALA HA 1.0 . 3.68 160 153 A 7 ILE HB A 7 ILE H 1.0 . 2.89 161 154 A 7 ILE HG1y A 7 ILE H 1.0 . 3.04 162 155 A 7 ILE HG1x A 7 ILE H 1.0 . 3.55 163 156 A 49 LEU H A 48 GLU H 1.0 . 2.87 164 157 A 49 LEU H A 45 HIS HBx 1.0 . 4.49 165 158 A 49 LEU H A 49 LEU HBy 1.0 . 3.05 166 159 A 49 LEU H A 49 LEU HG 1.0 . 3.20 167 160 A 49 LEU HBx A 49 LEU H 1.0 . 3.66 168 161 A 49 LEU HDx% A 49 LEU H 1.0 . 3.40 169 162 A 49 LEU HDy% A 49 LEU H 1.0 . 3.90 170 163 A 45 HIS HBy A 49 LEU H 1.0 . 4.32 171 164 A 54 ASN H A 53 LEU H 1.0 . 5.19 172 165 A 53 LEU H A 55 GLN H 1.0 . 4.68 173 166 A 53 LEU H A 52 PHE HD% 1.0 . 3.37 174 167 A 53 LEU H A 52 PHE HBx 1.0 . 3.58 175 168 A 53 LEU H A 52 PHE HBy 1.0 . 3.90 176 169 A 53 LEU H A 53 LEU HDy% 1.0 . 2.93 177 170 A 53 LEU H A 53 LEU HDx% 1.0 . 3.60 178 171 A 53 LEU HG A 53 LEU H 1.0 . 4.02 179 172 A 53 LEU H A 50 ILE HA 1.0 . 3.70 180 173 A 54 ASN HBx A 53 LEU H 1.0 . 5.50 181 174 A 53 LEU H A 53 LEU HBx 1.0 . 3.34 182 175 A 41 LYS H A 42 TRP H 1.0 . 4.08 183 176 A 42 TRP H A 42 TRP HD1 1.0 . 4.28 184 177 A 42 TRP H A 41 LYS HBy 1.0 . 4.20 185 178 A 53 LEU H A 52 PHE H 1.0 . 3.24 186 179 A 52 PHE HD% A 52 PHE H 1.0 . 4.76 187 180 A 52 PHE HBx A 52 PHE H 1.0 . 2.98 188 181 A 52 PHE HBy A 52 PHE H 1.0 . 3.01 189 182 A 53 LEU HDy% A 52 PHE H 1.0 . 4.06 190 183 A 53 LEU HBx A 52 PHE H 1.0 . 5.50 191 184 A 4 ALA HB% A 52 PHE H 1.0 . 3.77 192 185 A 52 PHE H A 50 ILE HG2% 1.0 . 4.71 193 186 A 57 ASP H A 59 GLU HA 1.0 . 5.50 194 187 A 57 ASP H A 57 ASP HBx 1.0 . 3.18 195 188 A 57 ASP HBy A 57 ASP H 1.0 . 2.91 196 189 A 57 ASP H A 55 GLN HB2 1.0 . 5.50 197 189 A 57 ASP H A 55 GLN HB3 1.0 . 5.50 198 190 A 57 ASP H A 56 LEU HBy 1.0 . 4.14 199 191 A 57 ASP H A 56 LEU HDy% 1.0 . 4.88 200 192 A 57 ASP H A 56 LEU HDx% 1.0 . 4.88 201 193 A 16 ILE HG2% A 29 THR H 1.0 . 4.73 202 194 A 55 GLN H A 53 LEU HA 1.0 . 5.50 203 195 A 57 ASP H A 55 GLN H 1.0 . 5.50 204 196 A 55 GLN H A 52 PHE HA 1.0 . 5.15 205 197 A 54 ASN HBx A 55 GLN H 1.0 . 3.60 206 198 A 55 GLN H A 55 GLN HGx 1.0 . 3.66 207 199 A 55 GLN HGy A 55 GLN H 1.0 . 3.46 208 200 A 55 GLN H A 55 GLN HB2 1.0 . 2.66 209 200 A 55 GLN HB3 A 55 GLN H 1.0 . 2.66 210 201 A 29 THR H A 28 GLU HG2 1.0 . 3.31 211 201 A 28 GLU HG3 A 29 THR H 1.0 . 3.31 212 202 A 29 THR H A 28 GLU HB2 1.0 . 3.79 213 202 A 28 GLU HB3 A 29 THR H 1.0 . 3.79 214 203 A 29 THR HG2% A 29 THR H 1.0 . 2.86 215 204 A 29 THR H A 34 ILE HD1% 1.0 . 5.18 216 205 A 27 TYR HD% A 29 THR H 1.0 . 4.26 217 206 A 4 ALA HB% A 48 GLU H 1.0 . 5.42 218 207 A 54 ASN H A 52 PHE H 1.0 . 5.50 219 208 A 54 ASN H A 53 LEU HDx% 1.0 . 4.87 220 209 A 48 GLU H A 45 HIS HBx 1.0 . 5.50 221 210 A 48 GLU H A 48 GLU HGy 1.0 . 3.00 222 211 A 48 GLU H A 48 GLU HB2 1.0 . 2.95 223 211 A 48 GLU H A 48 GLU HB3 1.0 . 2.95 224 212 A 48 GLU H A 47 GLN HBy 1.0 . 3.42 225 213 A 48 GLU H A 47 GLN HBx 1.0 . 3.29 226 214 A 48 GLU H A 50 ILE HD1% 1.0 . 4.72 227 215 A 44 GLN H A 43 LYS H 1.0 . 3.44 228 216 A 44 GLN H A 45 HIS H 1.0 . 3.31 229 217 A 44 GLN H A 43 LYS HB3 1.0 . 4.26 230 218 A 44 GLN H A 44 GLN HBy 1.0 . 2.80 231 219 A 44 GLN H A 44 GLN HBx 1.0 . 3.44 232 220 A 3 ASP HBx A 5 ALA H 1.0 . 4.40 233 221 A 5 ALA H A 6 GLN HBy 1.0 . 4.87 234 222 A 54 ASN H A 55 GLN H 1.0 . 3.05 235 223 A 54 ASN H A 50 ILE HA 1.0 . 3.83 236 224 A 54 ASN H A 54 ASN HBy 1.0 . 2.84 237 225 A 54 ASN H A 54 ASN HBx 1.0 . 3.12 238 226 A 54 ASN H A 55 GLN HB2 1.0 . 4.88 239 226 A 54 ASN H A 55 GLN HB3 1.0 . 4.88 240 227 A 54 ASN H A 53 LEU HBx 1.0 . 3.61 241 228 A 47 GLN HBx A 51 ASP H 1.0 . 5.50 242 229 A 45 HIS HBy A 48 GLU H 1.0 . 5.50 243 230 A 44 GLN H A 43 LYS HE2 1.0 . 5.50 244 231 A 44 GLN H A 43 LYS HE3 1.0 . 5.50 245 232 A 41 LYS H A 44 GLN H 1.0 . 5.34 246 233 A 44 GLN H A 45 HIS HD2 1.0 . 5.50 247 234 A 4 ALA H A 5 ALA H 1.0 . 3.08 248 235 A 8 VAL H A 5 ALA H 1.0 . 4.99 249 236 A 5 ALA HB% A 5 ALA H 1.0 . 2.43 250 237 A 4 ALA HB% A 5 ALA H 1.0 . 2.91 251 238 A 20 VAL H A 19 PHE HD% 1.0 . 3.46 252 239 A 20 VAL H A 19 PHE HBy 1.0 . 3.06 253 240 A 20 VAL H A 19 PHE HBx 1.0 . 3.85 254 241 A 20 VAL H A 20 VAL HGx% 1.0 . 4.41 255 242 A 53 LEU HG A 20 VAL H 1.0 . 4.08 256 243 A 52 PHE H A 51 ASP H 1.0 . 3.22 257 244 A 51 ASP H A 47 GLN HA 1.0 . 4.44 258 245 A 52 PHE HBx A 51 ASP H 1.0 . 5.50 259 246 A 51 ASP H A 51 ASP HBy 1.0 . 2.88 260 247 A 49 LEU HBy A 51 ASP H 1.0 . 5.50 261 248 A 50 ILE HB A 51 ASP H 1.0 . 2.94 262 249 A 4 ALA HB% A 51 ASP H 1.0 . 5.50 263 250 A 51 ASP H A 50 ILE HG1y 1.0 . 5.08 264 251 A 20 VAL H A 53 LEU HBx 1.0 . 4.80 265 252 A 20 VAL H A 53 LEU HDx% 1.0 . 5.16 266 253 A 48 GLU H A 47 GLN H 1.0 . 3.47 267 254 A 46 LYS H A 47 GLN H 1.0 . 3.58 268 255 A 47 GLN H A 47 GLN HG2 1.0 . 3.83 269 256 A 47 GLN HBy A 47 GLN H 1.0 . 2.79 270 257 A 47 GLN HBx A 47 GLN H 1.0 . 3.49 271 258 A 46 LYS HBx A 47 GLN H 1.0 . 3.20 272 259 A 19 PHE H A 27 TYR HBy 1.0 . 5.50 273 260 A 19 PHE H A 26 GLN H 1.0 . 3.49 274 261 A 19 PHE H A 19 PHE HE% 1.0 . 4.73 275 262 A 19 PHE H A 19 PHE HD% 1.0 . 3.32 276 263 A 19 PHE H A 27 TYR HD% 1.0 . 5.50 277 264 A 19 PHE H A 19 PHE HBy 1.0 . 4.08 278 265 A 19 PHE H A 19 PHE HBx 1.0 . 4.06 279 266 A 19 PHE H A 53 LEU HBy 1.0 . 5.07 280 267 A 19 PHE H A 18 LEU HBy 1.0 . 4.07 281 268 A 19 PHE H A 18 LEU HBx 1.0 . 3.28 282 269 A 19 PHE H A 18 LEU HDx% 1.0 . 3.92 283 270 A 23 ASN HBx A 24 ARG H 1.0 . 4.23 284 271 A 24 ARG H A 23 ASN HBy 1.0 . 4.72 285 272 A 24 ARG H A 23 ASN H 1.0 . 3.29 286 273 A 21 VAL H A 24 ARG H 1.0 . 3.37 287 274 A 34 ILE HG2% A 39 LEU H 1.0 . 3.64 288 275 A 39 LEU H A 39 LEU HBy 1.0 . 4.15 289 276 A 36 THR H A 39 LEU H 1.0 . 4.77 290 277 A 4 ALA H A 6 GLN H 1.0 . 4.25 291 278 A 8 VAL H A 6 GLN H 1.0 . 4.29 292 279 A 5 ALA H A 6 GLN H 1.0 . 2.79 293 280 A 7 ILE HA A 6 GLN H 1.0 . 5.47 294 281 A 3 ASP HBy A 6 GLN H 1.0 . 3.64 295 282 A 6 GLN H A 6 GLN HGy 1.0 . 3.50 296 283 A 7 ILE HG1y A 6 GLN H 1.0 . 5.50 297 284 A 4 ALA HB% A 6 GLN H 1.0 . 4.53 298 285 A 47 GLN HG2 A 47 GLN HE21 1.0 . 2.86 299 286 A 50 ILE HG2% A 47 GLN HE21 1.0 . 3.56 300 287 A 47 GLN HBy A 47 GLN HE21 1.0 . 4.29 301 288 A 50 ILE HB A 47 GLN HE21 1.0 . 4.08 302 289 A 51 ASP H A 47 GLN HE22 1.0 . 4.59 303 290 A 51 ASP HBy A 47 GLN HE22 1.0 . 5.50 304 291 A 47 GLN HG2 A 47 GLN HE22 1.0 . 3.71 305 292 A 47 GLN HBx A 47 GLN HE22 1.0 . 4.47 306 293 A 50 ILE HB A 47 GLN HE22 1.0 . 4.19 307 294 A 50 ILE HD1% A 47 GLN HE22 1.0 . 4.52 308 295 A 51 ASP H A 47 GLN HE21 1.0 . 4.39 309 296 A 47 GLN HBx A 47 GLN HE21 1.0 . 4.29 310 297 A 47 GLN HA A 47 GLN HE21 1.0 . 4.13 311 298 A 47 GLN HA A 47 GLN HE22 1.0 . 4.12 312 299 A 47 GLN HBy A 47 GLN HE22 1.0 . 5.14 313 300 A 62 THR H A 61 GLN HG2 1.0 . 5.50 314 300 A 62 THR H A 61 GLN HGy 1.0 . 5.50 315 301 A 42 TRP H A 43 LYS H 1.0 . 5.50 316 302 A 43 LYS H A 43 LYS HD2 1.0 . 5.50 317 303 A 43 LYS H A 43 LYS HD3 1.0 . 5.50 318 304 A 62 THR H A 61 GLN HBy 1.0 . 4.40 319 305 A 62 THR H A 61 GLN HBx 1.0 . 4.40 320 306 A 43 LYS H A 42 TRP HBx 1.0 . 4.19 321 307 A 43 LYS H A 42 TRP HBy 1.0 . 3.96 322 308 A 11 ALA H A 14 GLN H 1.0 . 5.50 323 309 A 62 THR H A 62 THR HG21 1.0 . 4.21 324 310 A 43 LYS H A 43 LYS HG2 1.0 . 5.50 325 311 A 14 GLN H A 14 GLN HB2 1.0 . 3.05 326 311 A 14 GLN H A 14 GLN HB3 1.0 . 3.05 327 312 A 13 GLU H A 14 GLN H 1.0 . 3.09 328 313 A 14 GLN H A 15 GLY H 1.0 . 3.12 329 314 A 14 GLN H A 15 GLY HAy 1.0 . 5.14 330 315 A 14 GLN H A 13 GLU HB2 1.0 . 3.10 331 315 A 13 GLU HB3 A 14 GLN H 1.0 . 3.10 332 316 A 16 ILE H A 14 GLN H 1.0 . 3.95 333 317 A 45 HIS H A 45 HIS HD2 1.0 . 3.91 334 318 A 45 HIS H A 45 HIS HBx 1.0 . 4.04 335 319 A 45 HIS H A 45 HIS HBy 1.0 . 3.43 336 320 A 45 HIS H A 44 GLN HBy 1.0 . 3.97 337 321 A 45 HIS H A 44 GLN HBx 1.0 . 3.78 338 322 A 45 HIS H A 44 GLN HGy 1.0 . 4.03 339 323 A 41 LYS H A 40 ASN H 1.0 . 3.31 340 324 A 39 LEU H A 40 ASN H 1.0 . 3.38 341 325 A 40 ASN H A 36 THR HA 1.0 . 3.70 342 326 A 36 THR HG2% A 40 ASN H 1.0 . 5.12 343 327 A 40 ASN H A 39 LEU HDy% 1.0 . 4.34 344 328 A 40 ASN H A 39 LEU HDx% 1.0 . 4.34 345 329 A 14 GLN HE21 A 16 ILE HD1% 1.0 . 5.50 346 330 A 14 GLN HE21 A 38 LEU HDy% 1.0 . 5.50 347 331 A 14 GLN HE21 A 38 LEU HDx% 1.0 . 5.50 348 332 A 14 GLN HE22 A 38 LEU HDy% 1.0 . 5.50 349 333 A 14 GLN HE22 A 38 LEU HDx% 1.0 . 5.50 350 334 A 26 GLN HGx A 27 TYR H 1.0 . 4.91 351 335 A 50 ILE HG2% A 23 ASN HD22 1.0 . 5.50 352 336 A 55 GLN HE21 A 56 LEU HDy% 1.0 . 5.50 353 337 A 26 GLN HGy A 27 TYR H 1.0 . 5.50 354 338 A 27 TYR HD% A 27 TYR H 1.0 . 3.93 355 339 A 27 TYR H A 26 GLN HB2 1.0 . 3.31 356 339 A 26 GLN HB3 A 27 TYR H 1.0 . 3.31 357 340 A 23 ASN H A 23 ASN HD21 1.0 . 5.50 358 341 A 53 LEU HDx% A 55 GLN HE21 1.0 . 5.50 359 342 A 55 GLN HE21 A 56 LEU HDx% 1.0 . 5.50 360 343 A 50 ILE HB A 23 ASN HD22 1.0 . 5.50 361 344 A 55 GLN HE21 A 55 GLN HB2 1.0 . 5.50 362 344 A 55 GLN HB3 A 55 GLN HE21 1.0 . 5.50 363 345 A 55 GLN HE21 A 56 LEU HG 1.0 . 5.50 364 346 A 23 ASN HD21 A 20 VAL HB 1.0 . 5.50 365 347 A 23 ASN H A 23 ASN HD22 1.0 . 5.50 366 348 A 50 ILE HG2% A 23 ASN HD21 1.0 . 5.50 367 349 A 36 THR HA A 40 ASN HD21 1.0 . 5.50 368 350 A 36 THR HA A 40 ASN HD22 1.0 . 5.50 369 351 A 40 ASN H A 40 ASN HD21 1.0 . 5.50 370 352 A 36 THR HG2% A 40 ASN HD21 1.0 . 5.43 371 353 A 40 ASN H A 40 ASN HD22 1.0 . 5.50 372 354 A 36 THR HG2% A 40 ASN HD22 1.0 . 5.43 373 355 A 6 GLN HGy A 6 GLN HE22 1.0 . 4.02 374 356 A 6 GLN HGy A 6 GLN HE21 1.0 . 4.02 375 357 A 44 GLN HGy A 44 GLN HE21 1.0 . 3.99 376 358 A 44 GLN HGy A 44 GLN HE22 1.0 . 3.99 377 359 A 34 ILE HD1% A 33 SER H 1.0 . 5.50 378 360 A 53 LEU HBx A 54 ASN HD21 1.0 . 5.50 379 361 A 54 ASN H A 54 ASN HD22 1.0 . 5.50 380 362 A 54 ASN HBx A 54 ASN HD21 1.0 . 3.42 381 363 A 54 ASN HBy A 54 ASN HD22 1.0 . 3.47 382 364 A 54 ASN H A 54 ASN HD21 1.0 . 4.44 383 365 A 54 ASN HBy A 54 ASN HD21 1.0 . 3.24 384 366 A 50 ILE HB A 54 ASN HD21 1.0 . 5.50 385 367 A 23 ASN H A 54 ASN HD22 1.0 . 5.50 386 368 A 23 ASN HBy A 23 ASN H 1.0 . 3.65 387 369 A 22 ASN H A 23 ASN H 1.0 . 3.87 388 370 A 23 ASN HBx A 23 ASN H 1.0 . 3.78 389 371 A 23 ASN H A 22 ASN HBx 1.0 . 4.68 390 372 A 16 ILE HB A 15 GLY H 1.0 . 4.95 391 373 A 16 ILE H A 15 GLY H 1.0 . 3.13 392 374 A 13 GLU H A 15 GLY H 1.0 . 5.50 393 375 A 15 GLY H A 14 GLN HB2 1.0 . 4.00 394 375 A 14 GLN HB3 A 15 GLY H 1.0 . 4.00 395 376 A 12 LEU HBx A 15 GLY H 1.0 . 5.36 396 377 A 15 GLY H A 16 ILE HD1% 1.0 . 4.14 397 378 A 4 ALA H A 6 GLN HBy 1.0 . 5.37 398 379 A 7 ILE H A 5 ALA H 1.0 . 4.40 399 380 A 7 ILE HG1y A 5 ALA H 1.0 . 5.47 400 381 A 3 ASP HBx A 6 GLN H 1.0 . 3.95 401 382 A 49 LEU HDy% A 7 ILE H 1.0 . 3.90 402 383 A 8 VAL HGy% A 7 ILE H 1.0 . 4.14 403 384 A 7 ILE H A 6 GLN HGy 1.0 . 4.82 404 385 A 16 ILE H A 12 LEU H 1.0 . 4.87 405 386 A 12 LEU H A 13 GLU HB2 1.0 . 4.53 406 386 A 13 GLU HB3 A 12 LEU H 1.0 . 4.53 407 387 A 15 GLY H A 13 GLU HB2 1.0 . 4.77 408 387 A 13 GLU HB3 A 15 GLY H 1.0 . 4.77 409 388 A 19 PHE H A 53 LEU HDy% 1.0 . 4.67 410 389 A 19 PHE H A 17 THR HG2% 1.0 . 4.66 411 390 A 19 PHE H A 53 LEU HDx% 1.0 . 3.94 412 391 A 19 PHE H A 26 GLN HB2 1.0 . 5.08 413 391 A 19 PHE H A 26 GLN HB3 1.0 . 5.08 414 392 A 19 PHE H A 25 LEU HG 1.0 . 5.50 415 393 A 19 PHE H A 53 LEU HBx 1.0 . 5.50 416 394 A 21 VAL H A 23 ASN H 1.0 . 4.64 417 395 A 26 GLN H A 21 VAL H 1.0 . 4.07 418 396 A 21 VAL H A 25 LEU HA 1.0 . 3.99 419 397 A 22 ASN H A 21 VAL HB 1.0 . 4.68 420 398 A 26 GLN H A 20 VAL H 1.0 . 5.03 421 399 A 39 LEU H A 39 LEU HBx 1.0 . 4.15 422 400 A 44 GLN H A 42 TRP H 1.0 . 4.04 423 401 A 49 LEU H A 48 GLU HGx 1.0 . 4.26 424 402 A 49 LEU H A 48 GLU HB2 1.0 . 3.33 425 402 A 49 LEU H A 48 GLU HB3 1.0 . 3.33 426 403 A 52 PHE H A 51 ASP HBx 1.0 . 3.72 427 404 A 50 ILE HA A 52 PHE H 1.0 . 4.12 428 405 A 54 ASN H A 52 PHE HBx 1.0 . 4.92 429 406 A 50 ILE HA A 54 ASN HD21 1.0 . 5.14 430 407 A 55 GLN H A 52 PHE H 1.0 . 4.78 431 408 A 57 ASP HBy A 56 LEU H 1.0 . 5.16 432 409 A 59 GLU H A 57 ASP H 1.0 . 3.74 433 410 A 57 ASP HBy A 58 SER H 1.0 . 3.80 434 411 A 57 ASP HBx A 58 SER H 1.0 . 3.48 435 412 A 59 GLU H A 58 SER H 1.0 . 2.97 436 413 A 60 GLU H A 60 GLU HG2 1.0 . 3.60 437 413 A 60 GLU H A 60 GLU HG3 1.0 . 3.60 438 414 A 60 GLU H A 61 GLN HG2 1.0 . 5.18 439 414 A 61 GLN HGy A 60 GLU H 1.0 . 5.18 440 415 A 17 THR H A 17 THR HB 1.0 . 3.32 441 416 A 28 GLU H A 17 THR HB 1.0 . 3.68 442 417 A 18 LEU H A 17 THR HB 1.0 . 4.63 443 418 A 17 THR HB A 16 ILE HA 1.0 . 5.50 444 419 A 17 THR H A 29 THR HB 1.0 . 5.13 445 420 A 17 THR HB A 28 GLU HA 1.0 . 5.50 446 421 A 17 THR HB A 29 THR HA 1.0 . 5.50 447 422 A 36 THR H A 36 THR HB 1.0 . 3.61 448 423 A 18 LEU HDy% A 8 VAL HA 1.0 . 4.56 449 424 A 11 ALA H A 8 VAL HA 1.0 . 4.17 450 425 A 11 ALA HB% A 8 VAL HA 1.0 . 3.39 451 426 A 8 VAL HGx% A 8 VAL HA 1.0 . 3.01 452 427 A 8 VAL HGy% A 8 VAL HA 1.0 . 2.91 453 428 A 49 LEU HDy% A 8 VAL HA 1.0 . 4.10 454 429 A 18 LEU HG A 8 VAL HA 1.0 . 3.35 455 430 A 18 LEU HDx% A 8 VAL HA 1.0 . 3.61 456 431 A 36 THR HA A 39 LEU HBy 1.0 . 3.81 457 432 A 36 THR HG2% A 36 THR HA 1.0 . 3.30 458 433 A 52 PHE HBx A 50 ILE HA 1.0 . 5.50 459 434 A 50 ILE HG1x A 50 ILE HA 1.0 . 3.46 460 435 A 50 ILE HA A 53 LEU HBx 1.0 . 3.94 461 436 A 50 ILE HA A 20 VAL HGx% 1.0 . 4.03 462 437 A 50 ILE HA A 50 ILE HG1y 1.0 . 3.26 463 438 A 50 ILE HA A 54 ASN HBy 1.0 . 5.50 464 439 A 7 ILE HA A 8 VAL HA 1.0 . 5.41 465 440 A 7 ILE HG1y A 7 ILE HA 1.0 . 3.31 466 441 A 7 ILE HG2% A 7 ILE HA 1.0 . 3.16 467 442 A 7 ILE HG1x A 7 ILE HA 1.0 . 3.39 468 443 A 11 ALA H A 7 ILE HA 1.0 . 4.38 469 444 A 59 GLU H A 58 SER HBx 1.0 . 4.32 470 445 A 12 LEU HG A 17 THR HA 1.0 . 5.40 471 446 A 18 LEU H A 17 THR HA 1.0 . 2.97 472 447 A 62 THR HG21 A 62 THR HA 1.0 . 3.63 473 448 A 22 ASN H A 21 VAL HA 1.0 . 3.54 474 449 A 49 LEU H A 46 LYS HA 1.0 . 3.84 475 450 A 49 LEU HBy A 46 LYS HA 1.0 . 3.46 476 451 A 46 LYS HA A 46 LYS HG2 1.0 . 3.73 477 452 A 46 LYS HA A 46 LYS HG3 1.0 . 3.73 478 453 A 49 LEU HBx A 46 LYS HA 1.0 . 5.12 479 454 A 49 LEU HDx% A 46 LYS HA 1.0 . 3.33 480 455 A 46 LYS HA A 25 LEU HDy% 1.0 . 4.59 481 456 A 29 THR HG2% A 16 ILE HA 1.0 . 4.57 482 457 A 52 PHE HD% A 52 PHE HA 1.0 . 3.22 483 458 A 21 VAL HA A 21 VAL HGy% 1.0 . 3.33 484 459 A 21 VAL HA A 20 VAL HA 1.0 . 5.40 485 460 A 17 THR H A 16 ILE HA 1.0 . 3.09 486 461 A 52 PHE HA A 55 GLN HB2 1.0 . 4.14 487 461 A 55 GLN HB3 A 52 PHE HA 1.0 . 4.14 488 462 A 29 THR HA A 16 ILE HG1y 1.0 . 5.50 489 463 A 3 ASP H A 2 ILE HA 1.0 . 2.73 490 464 A 2 ILE HA A 2 ILE HB 1.0 . 2.84 491 465 A 2 ILE HG1y A 2 ILE HA 1.0 . 3.38 492 466 A 2 ILE HG1x A 2 ILE HA 1.0 . 3.84 493 467 A 2 ILE HD1% A 2 ILE HA 1.0 . 2.67 494 468 A 2 ILE HA A 3 ASP HA 1.0 . 5.21 495 469 A 45 HIS H A 41 LYS HA 1.0 . 5.50 496 470 A 46 LYS H A 43 LYS HA 1.0 . 3.81 497 471 A 48 GLU HGy A 48 GLU HA 1.0 . 2.86 498 472 A 44 GLN HBy A 41 LYS HA 1.0 . 2.99 499 473 A 44 GLN H A 41 LYS HA 1.0 . 3.66 500 474 A 44 GLN HBx A 41 LYS HA 1.0 . 3.03 501 475 A 42 TRP HBx A 43 LYS HA 1.0 . 5.50 502 476 A 43 LYS HG2 A 43 LYS HA 1.0 . 3.80 503 477 A 40 ASN HD21 A 37 GLU HA 1.0 . 5.50 504 478 A 36 THR H A 37 GLU HA 1.0 . 5.50 505 479 A 9 ASP HA A 10 GLU HA 1.0 . 5.50 506 480 A 13 GLU HGx A 13 GLU HA 1.0 . 2.99 507 481 A 14 GLN H A 13 GLU HA 1.0 . 3.52 508 482 A 40 ASN HD22 A 37 GLU HA 1.0 . 5.50 509 483 A 40 ASN H A 37 GLU HA 1.0 . 4.34 510 484 A 36 THR HG2% A 37 GLU HA 1.0 . 4.50 511 485 A 59 GLU H A 58 SER HA 1.0 . 3.52 512 486 A 59 GLU HA A 58 SER HA 1.0 . 5.37 513 487 A 10 GLU HA A 10 GLU HBx 1.0 . 2.91 514 488 A 52 PHE HA A 49 LEU HA 1.0 . 5.50 515 489 A 6 GLN HA A 6 GLN HGy 1.0 . 3.10 516 490 A 6 GLN HBx A 6 GLN HA 1.0 . 2.80 517 491 A 50 ILE H A 47 GLN HA 1.0 . 3.82 518 492 A 50 ILE HB A 47 GLN HA 1.0 . 2.98 519 493 A 50 ILE HD1% A 47 GLN HA 1.0 . 2.97 520 494 A 47 GLN HA A 50 ILE HG1y 1.0 . 5.37 521 495 A 47 GLN HA A 47 GLN HG2 1.0 . 3.16 522 496 A 15 GLY H A 12 LEU HA 1.0 . 3.37 523 497 A 52 PHE HBx A 49 LEU HA 1.0 . 3.57 524 498 A 52 PHE HBy A 49 LEU HA 1.0 . 3.65 525 499 A 4 ALA HB% A 49 LEU HA 1.0 . 3.00 526 500 A 16 ILE H A 12 LEU HA 1.0 . 3.32 527 501 A 14 GLN H A 12 LEU HA 1.0 . 5.50 528 502 A 12 LEU HBy A 12 LEU HA 1.0 . 2.99 529 503 A 12 LEU HG A 12 LEU HA 1.0 . 3.57 530 504 A 16 ILE HD1% A 12 LEU HA 1.0 . 5.21 531 505 A 12 LEU HDy% A 12 LEU HA 1.0 . 2.71 532 506 A 52 PHE H A 49 LEU HA 1.0 . 5.21 533 507 A 43 LYS HG3 A 44 GLN HA 1.0 . 4.09 534 508 A 46 LYS H A 44 GLN HA 1.0 . 5.42 535 509 A 44 GLN HGy A 44 GLN HA 1.0 . 3.17 536 510 A 8 VAL HB A 9 ASP HA 1.0 . 4.64 537 511 A 43 LYS H A 39 LEU HA 1.0 . 5.50 538 512 A 42 TRP HBy A 39 LEU HA 1.0 . 4.89 539 513 A 42 TRP H A 39 LEU HA 1.0 . 4.14 540 514 A 39 LEU HA A 39 LEU HG 1.0 . 3.84 541 515 A 39 LEU HA A 39 LEU HDx% 1.0 . 4.18 542 516 A 39 LEU HA A 42 TRP HZ3 1.0 . 4.35 543 517 A 12 LEU HDx% A 9 ASP HA 1.0 . 3.24 544 518 A 34 ILE HA A 35 PRO HDy 1.0 . 3.77 545 519 A 49 LEU HDy% A 42 TRP HA 1.0 . 5.43 546 520 A 42 TRP HD1 A 42 TRP HA 1.0 . 3.11 547 521 A 55 GLN H A 51 ASP HA 1.0 . 4.41 548 522 A 53 LEU HDx% A 53 LEU HA 1.0 . 2.81 549 523 A 56 LEU H A 53 LEU HA 1.0 . 3.83 550 524 A 52 PHE HD% A 53 LEU HA 1.0 . 4.03 551 525 A 36 THR HA A 39 LEU HA 1.0 . 5.50 552 526 A 51 ASP HBy A 51 ASP HA 1.0 . 2.87 553 527 A 53 LEU HG A 53 LEU HA 1.0 . 3.84 554 528 A 59 GLU H A 59 GLU HA 1.0 . 2.85 555 529 A 59 GLU HA A 60 GLU H 1.0 . 3.23 556 530 A 54 ASN H A 55 GLN HA 1.0 . 5.50 557 531 A 55 GLN HA A 55 GLN HB2 1.0 . 2.60 558 531 A 55 GLN HB3 A 55 GLN HA 1.0 . 2.60 559 532 A 54 ASN HBx A 55 GLN HA 1.0 . 5.41 560 533 A 33 SER HA A 34 ILE HB 1.0 . 4.97 561 534 A 38 LEU HA A 37 GLU HA 1.0 . 5.50 562 535 A 38 LEU HA A 40 ASN H 1.0 . 5.10 563 536 A 38 LEU HA A 42 TRP H 1.0 . 5.50 564 537 A 38 LEU HA A 41 LYS H 1.0 . 3.83 565 538 A 38 LEU HA A 41 LYS HE2 1.0 . 3.86 566 538 A 38 LEU HA A 41 LYS HE3 1.0 . 3.86 567 539 A 38 LEU HA A 41 LYS HBx 1.0 . 3.62 568 540 A 38 LEU HA A 38 LEU HG 1.0 . 3.66 569 541 A 38 LEU HA A 38 LEU HDx% 1.0 . 3.83 570 542 A 55 GLN HA A 54 ASN HA 1.0 . 5.28 571 543 A 55 GLN HGy A 55 GLN HA 1.0 . 3.67 572 544 A 57 ASP H A 55 GLN HA 1.0 . 5.13 573 545 A 54 ASN HBy A 55 GLN HA 1.0 . 5.50 574 546 A 29 THR HG2% A 31 ARG HA 1.0 . 5.50 575 547 A 56 LEU HA A 56 LEU HDy% 1.0 . 3.88 576 548 A 11 ALA HA A 14 GLN HB2 1.0 . 3.94 577 548 A 14 GLN HB3 A 11 ALA HA 1.0 . 3.94 578 549 A 16 ILE HD1% A 11 ALA HA 1.0 . 3.43 579 550 A 11 ALA HA A 38 LEU HDy% 1.0 . 4.17 580 551 A 43 LYS HG2 A 40 ASN HA 1.0 . 5.47 581 552 A 16 ILE HB A 11 ALA HA 1.0 . 3.51 582 553 A 32 ASP HA A 32 ASP HB2 1.0 . 2.58 583 553 A 32 ASP HA A 32 ASP HB3 1.0 . 2.58 584 554 A 43 LYS HG3 A 40 ASN HA 1.0 . 5.15 585 555 A 20 VAL HB A 25 LEU HA 1.0 . 5.21 586 556 A 8 VAL H A 4 ALA HA 1.0 . 4.49 587 557 A 2 ILE HD1% A 4 ALA HA 1.0 . 4.50 588 558 A 4 ALA HA A 3 ASP HA 1.0 . 5.50 589 559 A 14 GLN HA A 14 GLN HB2 1.0 . 2.84 590 559 A 14 GLN HB3 A 14 GLN HA 1.0 . 2.84 591 560 A 26 GLN H A 25 LEU HA 1.0 . 2.97 592 561 A 25 LEU HA A 20 VAL HGx% 1.0 . 3.91 593 562 A 25 LEU HA A 20 VAL HGy% 1.0 . 3.91 594 563 A 22 ASN HA A 23 ASN HA 1.0 . 4.95 595 564 A 4 ALA HA A 6 GLN H 1.0 . 4.50 596 565 A 5 ALA HA A 4 ALA HA 1.0 . 5.29 597 566 A 4 ALA HA A 52 PHE HBx 1.0 . 5.50 598 567 A 4 ALA HA A 49 LEU HA 1.0 . 4.24 599 568 A 7 ILE HB A 4 ALA HA 1.0 . 3.37 600 569 A 7 ILE HG1y A 4 ALA HA 1.0 . 3.79 601 570 A 4 ALA HA A 49 LEU HG 1.0 . 4.19 602 571 A 5 ALA HA A 8 VAL H 1.0 . 3.60 603 572 A 5 ALA HA A 8 VAL HA 1.0 . 5.50 604 573 A 5 ALA HA A 8 VAL HB 1.0 . 3.16 605 574 A 5 ALA HA A 8 VAL HGx% 1.0 . 4.29 606 575 A 5 ALA HA A 8 VAL HGy% 1.0 . 3.18 607 576 A 5 ALA HA A 6 GLN HA 1.0 . 4.80 608 577 A 57 ASP HBy A 57 ASP HA 1.0 . 2.81 609 578 A 54 ASN HBx A 54 ASN HA 1.0 . 3.00 610 579 A 20 VAL HB A 23 ASN HA 1.0 . 4.78 611 580 A 23 ASN H A 23 ASN HA 1.0 . 2.79 612 581 A 24 ARG H A 23 ASN HA 1.0 . 3.42 613 582 A 54 ASN HD21 A 23 ASN HA 1.0 . 4.21 614 583 A 54 ASN HD22 A 23 ASN HA 1.0 . 4.28 615 584 A 23 ASN HBy A 23 ASN HA 1.0 . 3.01 616 585 A 5 ALA HA A 52 PHE HE% 1.0 . 5.50 617 586 A 27 TYR HA A 27 TYR HD% 1.0 . 3.76 618 587 A 45 HIS HBx A 45 HIS HA 1.0 . 2.98 619 588 A 18 LEU HDy% A 27 TYR HA 1.0 . 3.47 620 589 A 27 TYR HA A 28 GLU HB2 1.0 . 4.01 621 589 A 27 TYR HA A 28 GLU HB3 1.0 . 4.01 622 590 A 27 TYR HA A 16 ILE HG2% 1.0 . 3.95 623 591 A 19 PHE H A 27 TYR HA 1.0 . 3.81 624 592 A 48 GLU HGy A 45 HIS HA 1.0 . 5.00 625 593 A 29 THR HG2% A 28 GLU HA 1.0 . 3.96 626 594 A 23 ASN H A 22 ASN HA 1.0 . 3.04 627 595 A 24 ARG H A 22 ASN HA 1.0 . 5.47 628 596 A 27 TYR HA A 17 THR HA 1.0 . 5.50 629 597 A 17 THR HG2% A 18 LEU HA 1.0 . 4.41 630 598 A 8 VAL HGy% A 18 LEU HA 1.0 . 5.50 631 599 A 4 ALA H A 3 ASP HA 1.0 . 2.60 632 600 A 3 ASP HBx A 3 ASP HA 1.0 . 2.82 633 601 A 34 ILE HA A 35 PRO HDx 1.0 . 3.77 634 602 A 34 ILE HG2% A 35 PRO HDx 1.0 . 3.77 635 603 A 18 LEU HBx A 25 LEU HDx% 1.0 . 5.27 636 604 A 18 LEU HBx A 53 LEU HG 1.0 . 4.09 637 605 A 24 ARG HB3 A 24 ARG HD2 1.0 . 3.23 638 606 A 24 ARG HB3 A 24 ARG HD3 1.0 . 3.23 639 607 A 24 ARG HA A 24 ARG HD2 1.0 . 5.19 640 608 A 24 ARG HA A 24 ARG HD3 1.0 . 5.19 641 609 A 25 LEU H A 25 LEU HBx 1.0 . 4.11 642 610 A 53 LEU HG A 49 LEU HBx 1.0 . 5.50 643 611 A 57 ASP H A 56 LEU HBx 1.0 . 4.14 644 612 A 50 ILE HA A 53 LEU HBy 1.0 . 4.62 645 613 A 9 ASP HBy A 12 LEU HBx 1.0 . 5.50 646 614 A 20 VAL H A 53 LEU HBy 1.0 . 4.06 647 615 A 56 LEU HBy A 56 LEU HDy% 1.0 . 3.71 648 616 A 56 LEU H A 56 LEU HBx 1.0 . 3.32 649 617 A 53 LEU HDx% A 56 LEU HBx 1.0 . 4.00 650 618 A 56 LEU HDx% A 56 LEU HBx 1.0 . 3.71 651 619 A 53 LEU HA A 56 LEU HBx 1.0 . 3.99 652 620 A 50 ILE HD1% A 46 LYS HE3 1.0 . 5.04 653 621 A 25 LEU HBx A 46 LYS HE2 1.0 . 5.50 654 622 A 25 LEU HBx A 46 LYS HE3 1.0 . 5.50 655 623 A 12 LEU HBy A 12 LEU H 1.0 . 3.76 656 624 A 12 LEU HBy A 9 ASP HA 1.0 . 4.87 657 625 A 12 LEU HBy A 13 GLU HA 1.0 . 5.50 658 626 A 12 LEU HBx A 9 ASP HA 1.0 . 3.71 659 627 A 45 HIS HD2 A 41 LYS HE2 1.0 . 5.35 660 627 A 45 HIS HD2 A 41 LYS HE3 1.0 . 5.35 661 628 A 41 LYS HA A 41 LYS HE2 1.0 . 5.50 662 628 A 41 LYS HA A 41 LYS HE3 1.0 . 5.50 663 629 A 41 LYS HE3 A 41 LYS HBy 1.0 . 3.34 664 629 A 41 LYS HBy A 41 LYS HE2 1.0 . 3.34 665 630 A 41 LYS HE3 A 41 LYS HBx 1.0 . 3.34 666 630 A 41 LYS HBx A 41 LYS HE2 1.0 . 3.34 667 631 A 41 LYS HD3 A 41 LYS HE2 1.0 . 2.93 668 631 A 41 LYS HD2 A 41 LYS HE2 1.0 . 2.93 669 631 A 41 LYS HE3 A 41 LYS HD2 1.0 . 2.93 670 631 A 41 LYS HE3 A 41 LYS HD3 1.0 . 2.93 671 632 A 41 LYS HGx A 41 LYS HE2 1.0 . 3.67 672 632 A 41 LYS HE3 A 41 LYS HGx 1.0 . 3.67 673 633 A 7 ILE HG2% A 41 LYS HE2 1.0 . 3.99 674 633 A 7 ILE HG2% A 41 LYS HE3 1.0 . 3.99 675 634 A 7 ILE HG1x A 41 LYS HE2 1.0 . 4.04 676 634 A 7 ILE HG1x A 41 LYS HE3 1.0 . 4.04 677 635 A 2 ILE HD1% A 41 LYS HE2 1.0 . 5.48 678 635 A 2 ILE HD1% A 41 LYS HE3 1.0 . 5.48 679 636 A 42 TRP HA A 41 LYS HE2 1.0 . 5.50 680 636 A 42 TRP HA A 41 LYS HE3 1.0 . 5.50 681 637 A 3 ASP HBy A 2 ILE HA 1.0 . 5.50 682 638 A 3 ASP HBx A 2 ILE HA 1.0 . 5.50 683 639 A 3 ASP HBy A 5 ALA H 1.0 . 4.08 684 640 A 3 ASP HBx A 5 ALA HB% 1.0 . 4.58 685 641 A 16 ILE H A 16 ILE HB 1.0 . 3.58 686 642 A 16 ILE HB A 12 LEU HA 1.0 . 4.40 687 643 A 16 ILE HB A 42 TRP HZ2 1.0 . 4.72 688 644 A 11 ALA HB% A 16 ILE HB 1.0 . 4.38 689 645 A 16 ILE HB A 42 TRP HH2 1.0 . 4.36 690 646 A 52 PHE HBx A 53 LEU HDy% 1.0 . 4.43 691 647 A 49 LEU HDy% A 52 PHE HBy 1.0 . 5.50 692 648 A 9 ASP HBy A 6 GLN HA 1.0 . 3.71 693 649 A 52 PHE H A 51 ASP HBy 1.0 . 4.03 694 650 A 50 ILE HG2% A 51 ASP HBx 1.0 . 5.50 695 651 A 51 ASP H A 51 ASP HBx 1.0 . 3.47 696 652 A 51 ASP HBx A 48 GLU HA 1.0 . 3.73 697 653 A 39 LEU H A 38 LEU HBy 1.0 . 4.38 698 654 A 42 TRP HZ2 A 38 LEU HBx 1.0 . 5.50 699 655 A 39 LEU H A 38 LEU HBx 1.0 . 4.38 700 656 A 53 LEU HDx% A 19 PHE HBy 1.0 . 5.28 701 657 A 53 LEU HG A 19 PHE HBx 1.0 . 5.50 702 658 A 2 ILE HB A 45 HIS HE1 1.0 . 3.77 703 659 A 45 HIS HBy A 2 ILE HB 1.0 . 5.50 704 660 A 2 ILE HD1% A 2 ILE HB 1.0 . 3.19 705 661 A 7 ILE HD1% A 2 ILE HB 1.0 . 4.11 706 662 A 50 ILE HB A 49 LEU H 1.0 . 5.07 707 663 A 23 ASN HBy A 23 ASN HD22 1.0 . 3.87 708 664 A 54 ASN HBy A 51 ASP HA 1.0 . 4.13 709 665 A 54 ASN HBx A 51 ASP HA 1.0 . 5.37 710 666 A 23 ASN HBy A 22 ASN HA 1.0 . 4.70 711 667 A 23 ASN H A 22 ASN HBy 1.0 . 4.68 712 668 A 48 GLU H A 48 GLU HGx 1.0 . 3.47 713 669 A 48 GLU HGx A 48 GLU HA 1.0 . 3.57 714 670 A 45 HIS HBx A 48 GLU HGx 1.0 . 5.50 715 671 A 48 GLU HGy A 47 GLN HBx 1.0 . 3.91 716 672 A 49 LEU H A 48 GLU HGy 1.0 . 4.80 717 673 A 11 ALA H A 10 GLU HGx 1.0 . 5.50 718 674 A 10 GLU H A 10 GLU HGx 1.0 . 4.92 719 675 A 9 ASP H A 10 GLU HGx 1.0 . 5.50 720 676 A 7 ILE HG2% A 10 GLU HGx 1.0 . 5.50 721 677 A 13 GLU HGx A 14 GLN H 1.0 . 5.50 722 678 A 10 GLU HA A 13 GLU HGy 1.0 . 3.66 723 679 A 13 GLU HA A 13 GLU HGy 1.0 . 4.07 724 680 A 10 GLU H A 13 GLU HGy 1.0 . 5.50 725 681 A 28 GLU HA A 28 GLU HG2 1.0 . 3.45 726 681 A 28 GLU HG3 A 28 GLU HA 1.0 . 3.45 727 682 A 29 THR HA A 28 GLU HG2 1.0 . 3.95 728 682 A 28 GLU HG3 A 29 THR HA 1.0 . 3.95 729 683 A 28 GLU HB2 A 28 GLU HG2 1.0 . 2.50 730 683 A 28 GLU HB3 A 28 GLU HG2 1.0 . 2.50 731 683 A 28 GLU HG3 A 28 GLU HB2 1.0 . 2.50 732 683 A 28 GLU HG3 A 28 GLU HB3 1.0 . 2.50 733 684 A 17 THR HB A 28 GLU HG2 1.0 . 3.71 734 684 A 28 GLU HG3 A 17 THR HB 1.0 . 3.71 735 685 A 24 ARG H A 20 VAL HB 1.0 . 5.50 736 686 A 21 VAL HB A 24 ARG H 1.0 . 5.50 737 687 A 21 VAL HB A 19 PHE HD% 1.0 . 4.45 738 688 A 20 VAL H A 20 VAL HB 1.0 . 3.88 739 689 A 6 GLN H A 6 GLN HGx 1.0 . 3.69 740 690 A 14 GLN HA A 14 GLN HG2 1.0 . 4.16 741 691 A 14 GLN HA A 14 GLN HG3 1.0 . 4.16 742 692 A 52 PHE HA A 55 GLN HGx 1.0 . 5.50 743 693 A 56 LEU H A 55 GLN HGx 1.0 . 5.50 744 694 A 47 GLN H A 47 GLN HG3 1.0 . 5.44 745 695 A 48 GLU H A 47 GLN HG2 1.0 . 5.06 746 696 A 50 ILE HD1% A 47 GLN HG2 1.0 . 3.67 747 697 A 23 ASN HD21 A 61 GLN HG2 1.0 . 5.50 748 697 A 61 GLN HGy A 23 ASN HD21 1.0 . 5.50 749 698 A 26 GLN HGy A 21 VAL HGx% 1.0 . 4.56 750 699 A 54 ASN H A 55 GLN HGx 1.0 . 5.50 751 700 A 19 PHE HE% A 28 GLU HB2 1.0 . 3.83 752 700 A 19 PHE HE% A 28 GLU HB3 1.0 . 3.83 753 701 A 26 GLN HGy A 21 VAL HA 1.0 . 5.50 754 702 A 44 GLN H A 44 GLN HGy 1.0 . 4.59 755 703 A 19 PHE HD% A 28 GLU HB2 1.0 . 4.45 756 703 A 19 PHE HD% A 28 GLU HB3 1.0 . 4.45 757 704 A 17 THR HB A 28 GLU HB2 1.0 . 3.89 758 704 A 28 GLU HB3 A 17 THR HB 1.0 . 3.89 759 705 A 44 GLN HA A 44 GLN HGx 1.0 . 3.91 760 706 A 17 THR H A 28 GLU HB2 1.0 . 4.64 761 706 A 17 THR H A 28 GLU HB3 1.0 . 4.64 762 707 A 46 LYS HBy A 47 GLN H 1.0 . 4.20 763 708 A 46 LYS HBx A 48 GLU H 1.0 . 5.50 764 709 A 44 GLN H A 43 LYS HB2 1.0 . 4.26 765 710 A 32 ASP H A 31 ARG HB2 1.0 . 4.19 766 710 A 31 ARG HB3 A 32 ASP H 1.0 . 4.19 767 711 A 24 ARG H A 24 ARG HB2 1.0 . 3.69 768 712 A 42 TRP H A 41 LYS HBx 1.0 . 4.20 769 713 A 41 LYS H A 41 LYS HBx 1.0 . 3.74 770 714 A 8 VAL HB A 5 ALA H 1.0 . 5.50 771 715 A 8 VAL HB A 7 ILE H 1.0 . 5.50 772 716 A 50 ILE HG2% A 50 ILE HG1y 1.0 . 3.55 773 717 A 7 ILE HA A 10 GLU HBy 1.0 . 5.50 774 718 A 41 LYS HA A 41 LYS HD2 1.0 . 5.50 775 718 A 41 LYS HA A 41 LYS HD3 1.0 . 5.50 776 719 A 7 ILE HG2% A 41 LYS HD2 1.0 . 3.71 777 719 A 7 ILE HG2% A 41 LYS HD3 1.0 . 3.71 778 720 A 45 HIS HD2 A 41 LYS HD2 1.0 . 4.19 779 720 A 45 HIS HD2 A 41 LYS HD3 1.0 . 4.19 780 721 A 45 HIS HBy A 41 LYS HD2 1.0 . 5.50 781 721 A 45 HIS HBy A 41 LYS HD3 1.0 . 5.50 782 722 A 7 ILE HD1% A 41 LYS HD2 1.0 . 3.70 783 722 A 7 ILE HD1% A 41 LYS HD3 1.0 . 3.70 784 723 A 50 ILE H A 50 ILE HG1y 1.0 . 4.14 785 724 A 38 LEU HA A 41 LYS HD2 1.0 . 5.50 786 724 A 38 LEU HA A 41 LYS HD3 1.0 . 5.50 787 725 A 42 TRP HD1 A 41 LYS HD2 1.0 . 5.50 788 725 A 42 TRP HD1 A 41 LYS HD3 1.0 . 5.50 789 726 A 25 LEU H A 46 LYS HD2 1.0 . 5.13 790 727 A 25 LEU H A 46 LYS HD3 1.0 . 5.13 791 728 A 13 GLU HGx A 13 GLU HB2 1.0 . 2.94 792 728 A 13 GLU HGx A 13 GLU HB3 1.0 . 2.94 793 729 A 10 GLU HA A 13 GLU HB2 1.0 . 3.27 794 729 A 13 GLU HB3 A 10 GLU HA 1.0 . 3.27 795 730 A 45 HIS HBx A 48 GLU HB2 1.0 . 4.77 796 730 A 45 HIS HBx A 48 GLU HB3 1.0 . 4.77 797 731 A 3 ASP H A 7 ILE HG1y 1.0 . 5.50 798 732 A 7 ILE HG2% A 7 ILE HG1x 1.0 . 4.01 799 733 A 7 ILE HG1x A 49 LEU HDx% 1.0 . 5.50 800 734 A 7 ILE HG1x A 41 LYS HGy 1.0 . 3.86 801 735 A 44 GLN HBy A 45 HIS HD2 1.0 . 5.50 802 736 A 45 HIS HBx A 49 LEU HG 1.0 . 4.76 803 737 A 3 ASP H A 6 GLN HBy 1.0 . 5.50 804 738 A 47 GLN HBx A 47 GLN HG3 1.0 . 2.85 805 739 A 6 GLN HBx A 7 ILE HG1x 1.0 . 5.50 806 740 A 54 ASN HA A 55 GLN HB2 1.0 . 5.40 807 740 A 55 GLN HB3 A 54 ASN HA 1.0 . 5.40 808 741 A 6 GLN HBx A 6 GLN H 1.0 . 3.57 809 742 A 3 ASP HBy A 6 GLN HBx 1.0 . 3.99 810 743 A 55 GLN HGy A 55 GLN HB2 1.0 . 2.65 811 743 A 55 GLN HGy A 55 GLN HB3 1.0 . 2.65 812 744 A 2 ILE HD1% A 6 GLN HBx 1.0 . 5.50 813 745 A 6 GLN HBy A 6 GLN H 1.0 . 3.39 814 746 A 44 GLN HBy A 43 LYS HG3 1.0 . 4.34 815 747 A 16 ILE H A 16 ILE HG1x 1.0 . 4.00 816 748 A 16 ILE HG1x A 29 THR HB 1.0 . 4.21 817 749 A 16 ILE H A 16 ILE HG1y 1.0 . 4.53 818 750 A 42 TRP HBy A 40 ASN H 1.0 . 5.50 819 751 A 49 LEU HDy% A 42 TRP HBx 1.0 . 4.58 820 752 A 42 TRP HBx A 25 LEU HDy% 1.0 . 5.17 821 753 A 34 ILE HA A 35 PRO HGx 1.0 . 5.50 822 754 A 34 ILE HA A 35 PRO HGy 1.0 . 4.59 823 755 A 52 PHE HD% A 53 LEU HDy% 1.0 . 3.97 824 756 A 16 ILE HG1x A 16 ILE HA 1.0 . 3.95 825 757 A 16 ILE HG1y A 34 ILE HG1x 1.0 . 3.84 826 758 A 29 THR HB A 16 ILE HG1y 1.0 . 5.50 827 759 A 12 LEU HG A 9 ASP HA 1.0 . 4.26 828 760 A 24 ARG H A 24 ARG HGy 1.0 . 4.06 829 761 A 24 ARG HA A 24 ARG HGy 1.0 . 3.86 830 762 A 24 ARG HA A 24 ARG HGx 1.0 . 3.86 831 763 A 29 THR HG2% A 34 ILE HG1x 1.0 . 4.53 832 764 A 38 LEU HG A 35 PRO HB2 1.0 . 5.50 833 765 A 38 LEU HG A 41 LYS HGy 1.0 . 5.50 834 766 A 38 LEU HG A 10 GLU HBy 1.0 . 5.50 835 767 A 38 LEU HG A 38 LEU H 1.0 . 4.83 836 768 A 12 LEU HG A 12 LEU H 1.0 . 3.52 837 769 A 25 LEU H A 24 ARG HGy 1.0 . 5.50 838 770 A 25 LEU H A 24 ARG HGx 1.0 . 5.50 839 771 A 24 ARG H A 24 ARG HGx 1.0 . 4.06 840 772 A 12 LEU HG A 13 GLU H 1.0 . 4.78 841 773 A 25 LEU HBx A 25 LEU HDy% 1.0 . 4.02 842 774 A 18 LEU HBx A 25 LEU HDy% 1.0 . 5.27 843 775 A 25 LEU HA A 25 LEU HDy% 1.0 . 3.91 844 776 A 25 LEU HBy A 25 LEU HDy% 1.0 . 4.02 845 777 A 18 LEU HDx% A 25 LEU HDy% 1.0 . 4.21 846 778 A 18 LEU HDy% A 25 LEU HDy% 1.0 . 4.49 847 779 A 56 LEU H A 56 LEU HG 1.0 . 4.35 848 780 A 53 LEU HDx% A 56 LEU HG 1.0 . 5.50 849 781 A 39 LEU H A 39 LEU HG 1.0 . 5.50 850 782 A 36 THR HA A 39 LEU HG 1.0 . 5.50 851 783 A 49 LEU HDx% A 42 TRP HA 1.0 . 3.37 852 784 A 49 LEU HDx% A 42 TRP HBx 1.0 . 3.96 853 785 A 18 LEU HG A 49 LEU HDx% 1.0 . 5.50 854 786 A 18 LEU HDy% A 49 LEU HDx% 1.0 . 5.50 855 787 A 49 LEU HDx% A 45 HIS HBy 1.0 . 4.15 856 788 A 19 PHE H A 53 LEU HG 1.0 . 3.89 857 789 A 53 LEU HG A 52 PHE HD% 1.0 . 5.00 858 790 A 53 LEU HG A 19 PHE HA 1.0 . 3.49 859 791 A 53 LEU HG A 50 ILE HA 1.0 . 4.77 860 792 A 53 LEU HG A 19 PHE HBy 1.0 . 4.81 861 793 A 18 LEU HBy A 53 LEU HG 1.0 . 4.09 862 794 A 53 LEU HG A 18 LEU HDx% 1.0 . 4.04 863 795 A 18 LEU HDy% A 53 LEU HG 1.0 . 5.26 864 796 A 57 ASP H A 56 LEU HG 1.0 . 5.41 865 797 A 53 LEU HA A 56 LEU HG 1.0 . 4.58 866 798 A 56 LEU HG A 56 LEU HA 1.0 . 3.79 867 799 A 49 LEU HDx% A 42 TRP HBy 1.0 . 4.08 868 800 A 49 LEU HDx% A 49 LEU HBy 1.0 . 3.49 869 801 A 41 LYS HA A 41 LYS HGy 1.0 . 3.81 870 802 A 45 HIS HD2 A 41 LYS HGx 1.0 . 5.19 871 803 A 43 LYS HA A 43 LYS HG3 1.0 . 3.91 872 804 A 49 LEU HDx% A 41 LYS HGx 1.0 . 5.50 873 805 A 18 LEU HDx% A 8 VAL H 1.0 . 4.56 874 806 A 18 LEU HG A 18 LEU H 1.0 . 4.07 875 807 A 18 LEU HDx% A 42 TRP HD1 1.0 . 4.30 876 808 A 38 LEU H A 38 LEU HDy% 1.0 . 5.50 877 809 A 56 LEU HA A 56 LEU HDx% 1.0 . 3.88 878 810 A 18 LEU HDx% A 49 LEU HBy 1.0 . 4.29 879 811 A 18 LEU HDx% A 49 LEU HDy% 1.0 . 3.10 880 812 A 11 ALA HB% A 18 LEU HG 1.0 . 3.11 881 813 A 18 LEU HBx A 18 LEU HDx% 1.0 . 2.77 882 814 A 18 LEU HDx% A 42 TRP HA 1.0 . 5.50 883 815 A 18 LEU HG A 42 TRP HZ2 1.0 . 5.50 884 816 A 18 LEU HDx% A 42 TRP HZ2 1.0 . 5.50 885 817 A 57 ASP HA A 56 LEU HDx% 1.0 . 5.50 886 818 A 38 LEU HA A 38 LEU HDy% 1.0 . 3.83 887 819 A 52 PHE HE% A 56 LEU HDx% 1.0 . 5.50 888 820 A 12 LEU HDy% A 14 GLN H 1.0 . 5.50 889 821 A 12 LEU HDy% A 12 LEU H 1.0 . 4.50 890 822 A 11 ALA H A 12 LEU HDx% 1.0 . 5.50 891 823 A 12 LEU HDy% A 17 THR HA 1.0 . 3.23 892 824 A 12 LEU HDy% A 15 GLY HAx 1.0 . 5.41 893 825 A 42 TRP HZ2 A 38 LEU HDy% 1.0 . 5.50 894 826 A 12 LEU HBx A 12 LEU HDx% 1.0 . 2.96 895 827 A 12 LEU HBy A 12 LEU HDx% 1.0 . 3.29 896 828 A 12 LEU HDy% A 12 LEU HBy 1.0 . 3.43 897 829 A 42 TRP HBx A 25 LEU HDx% 1.0 . 5.17 898 830 A 25 LEU HA A 25 LEU HDx% 1.0 . 3.91 899 831 A 25 LEU HDx% A 25 LEU HBx 1.0 . 4.02 900 832 A 18 LEU HDx% A 25 LEU HDx% 1.0 . 4.21 901 833 A 46 LYS H A 46 LYS HG2 1.0 . 5.33 902 834 A 46 LYS H A 46 LYS HG3 1.0 . 5.33 903 835 A 49 LEU HDy% A 8 VAL H 1.0 . 3.61 904 836 A 49 LEU HDy% A 49 LEU HA 1.0 . 2.92 905 837 A 49 LEU HDy% A 4 ALA HA 1.0 . 3.18 906 838 A 49 LEU HDy% A 49 LEU HBy 1.0 . 3.22 907 839 A 49 LEU HDy% A 7 ILE HB 1.0 . 3.09 908 840 A 49 LEU HDy% A 8 VAL HGy% 1.0 . 2.93 909 841 A 53 LEU HG A 8 VAL HGy% 1.0 . 4.34 910 842 A 18 LEU HDy% A 8 VAL HGy% 1.0 . 5.50 911 843 A 8 VAL HGy% A 52 PHE HZ 1.0 . 4.12 912 844 A 8 VAL HGy% A 52 PHE HD% 1.0 . 3.54 913 845 A 8 VAL HGy% A 52 PHE HE% 1.0 . 3.87 914 846 A 18 LEU HDx% A 8 VAL HGy% 1.0 . 3.13 915 847 A 49 LEU HDy% A 45 HIS HBy 1.0 . 5.50 916 848 A 56 LEU HBx A 56 LEU HDy% 1.0 . 3.71 917 849 A 19 PHE HA A 20 VAL HGx% 1.0 . 5.50 918 850 A 57 ASP HA A 56 LEU HDy% 1.0 . 5.50 919 851 A 53 LEU HDx% A 52 PHE HZ 1.0 . 5.34 920 852 A 53 LEU HDx% A 19 PHE HBx 1.0 . 3.84 921 853 A 42 TRP HZ2 A 38 LEU HDx% 1.0 . 5.50 922 854 A 8 VAL HGx% A 53 LEU HDx% 1.0 . 4.08 923 855 A 52 PHE HD% A 53 LEU HDx% 1.0 . 3.54 924 856 A 53 LEU HDx% A 52 PHE HE% 1.0 . 4.02 925 857 A 53 LEU HDx% A 53 LEU HBx 1.0 . 3.26 926 858 A 36 THR HG2% A 37 GLU HB2 1.0 . 5.50 927 858 A 36 THR HG2% A 37 GLU HB3 1.0 . 5.50 928 859 A 36 THR HG2% A 34 ILE HG2% 1.0 . 5.17 929 860 A 54 ASN HBx A 20 VAL HGy% 1.0 . 5.50 930 861 A 20 VAL H A 20 VAL HGy% 1.0 . 4.41 931 862 A 19 PHE HA A 20 VAL HGy% 1.0 . 5.50 932 863 A 18 LEU HDy% A 19 PHE H 1.0 . 3.49 933 864 A 18 LEU HDy% A 27 TYR HD% 1.0 . 3.71 934 865 A 18 LEU HDy% A 42 TRP HZ3 1.0 . 4.58 935 866 A 18 LEU HDy% A 18 LEU HA 1.0 . 3.02 936 867 A 18 LEU HDy% A 17 THR HA 1.0 . 4.06 937 868 A 18 LEU HDy% A 27 TYR HBx 1.0 . 3.12 938 869 A 18 LEU HDy% A 18 LEU HBy 1.0 . 3.20 939 870 A 18 LEU HDy% A 18 LEU HBx 1.0 . 2.84 940 871 A 18 LEU HDy% A 16 ILE HG2% 1.0 . 2.84 941 872 A 18 LEU HDy% A 25 LEU HDx% 1.0 . 4.49 942 873 A 17 THR HG2% A 19 PHE HBx 1.0 . 3.99 943 874 A 8 VAL HGx% A 12 LEU HDx% 1.0 . 3.83 944 875 A 9 ASP H A 8 VAL HGx% 1.0 . 3.60 945 876 A 8 VAL HGx% A 52 PHE HZ 1.0 . 4.14 946 877 A 21 VAL HA A 21 VAL HGx% 1.0 . 3.33 947 878 A 50 ILE HA A 20 VAL HGy% 1.0 . 4.03 948 879 A 18 LEU H A 8 VAL HGx% 1.0 . 3.82 949 880 A 17 THR HG2% A 19 PHE HBy 1.0 . 4.62 950 881 A 17 THR HG2% A 27 TYR HBx 1.0 . 5.50 951 882 A 18 LEU HBy A 8 VAL HGx% 1.0 . 3.47 952 883 A 18 LEU HDx% A 8 VAL HGx% 1.0 . 5.50 953 884 A 18 LEU HDy% A 8 VAL HGx% 1.0 . 5.50 954 885 A 8 VAL H A 8 VAL HGx% 1.0 . 3.89 955 886 A 17 THR HG2% A 17 THR HA 1.0 . 2.97 956 887 A 16 ILE HG2% A 18 LEU HA 1.0 . 5.50 957 888 A 16 ILE HG2% A 28 GLU HB2 1.0 . 5.50 958 888 A 16 ILE HG2% A 28 GLU HB3 1.0 . 5.50 959 889 A 16 ILE HG2% A 42 TRP HZ2 1.0 . 3.71 960 890 A 16 ILE HG2% A 42 TRP HH2 1.0 . 3.00 961 891 A 16 ILE HG2% A 42 TRP HZ3 1.0 . 3.79 962 892 A 16 ILE HG2% A 29 THR HB 1.0 . 3.40 963 893 A 16 ILE HG2% A 27 TYR HBx 1.0 . 3.47 964 894 A 16 ILE HG2% A 27 TYR HBy 1.0 . 3.16 965 895 A 11 ALA HB% A 16 ILE HG2% 1.0 . 3.02 966 896 A 16 ILE HG2% A 29 THR HG2% 1.0 . 3.29 967 897 A 16 ILE HG2% A 16 ILE HD1% 1.0 . 2.89 968 898 A 18 LEU HG A 16 ILE HG2% 1.0 . 4.32 969 899 A 18 LEU HDx% A 16 ILE HG2% 1.0 . 4.75 970 900 A 4 ALA HB% A 52 PHE HD% 1.0 . 3.58 971 901 A 4 ALA HB% A 52 PHE HBx 1.0 . 3.22 972 902 A 4 ALA HB% A 52 PHE HBy 1.0 . 3.43 973 903 A 4 ALA HB% A 48 GLU HB2 1.0 . 3.79 974 903 A 4 ALA HB% A 48 GLU HB3 1.0 . 3.79 975 904 A 4 ALA HB% A 7 ILE HD1% 1.0 . 3.95 976 905 A 7 ILE HG2% A 49 LEU HA 1.0 . 5.50 977 906 A 7 ILE HG2% A 49 LEU HDx% 1.0 . 4.18 978 907 A 7 ILE HG2% A 49 LEU HDy% 1.0 . 4.12 979 908 A 7 ILE HG2% A 10 GLU H 1.0 . 5.50 980 909 A 7 ILE HG2% A 8 VAL H 1.0 . 3.80 981 910 A 7 ILE HG2% A 7 ILE H 1.0 . 3.85 982 911 A 7 ILE HG2% A 42 TRP HA 1.0 . 5.47 983 912 A 7 ILE HG2% A 8 VAL HA 1.0 . 3.82 984 913 A 7 ILE HG2% A 7 ILE HG1y 1.0 . 3.23 985 914 A 7 ILE HG2% A 18 LEU HDx% 1.0 . 3.67 986 915 A 4 ALA HB% A 3 ASP HA 1.0 . 4.11 987 916 A 4 ALA HB% A 49 LEU HDy% 1.0 . 3.04 988 917 A 7 ILE HG2% A 41 LYS HGx 1.0 . 3.99 989 918 A 18 LEU HDy% A 7 ILE HG2% 1.0 . 5.50 990 919 A 29 THR HG2% A 16 ILE HG1y 1.0 . 3.10 991 920 A 29 THR HG2% A 29 THR HA 1.0 . 3.64 992 921 A 4 ALA H A 5 ALA HB% 1.0 . 4.61 993 922 A 5 ALA HB% A 6 GLN H 1.0 . 2.75 994 923 A 5 ALA HB% A 3 ASP HA 1.0 . 5.33 995 924 A 5 ALA HB% A 6 GLN HA 1.0 . 3.78 996 925 A 29 THR HG2% A 27 TYR HBy 1.0 . 4.55 997 926 A 2 ILE HG1y A 2 ILE HG2% 1.0 . 3.27 998 927 A 2 ILE HG1x A 2 ILE HG2% 1.0 . 2.88 999 928 A 45 HIS H A 2 ILE HG2% 1.0 . 5.47 1000 929 A 2 ILE HA A 2 ILE HG2% 1.0 . 3.21 1001 930 A 2 ILE HG2% A 48 GLU HB2 1.0 . 5.50 1002 930 A 48 GLU HB3 A 2 ILE HG2% 1.0 . 5.50 1003 931 A 34 ILE HG2% A 42 TRP HH2 1.0 . 4.07 1004 932 A 34 ILE HG2% A 42 TRP HZ3 1.0 . 4.09 1005 933 A 11 ALA HB% A 10 GLU H 1.0 . 4.86 1006 934 A 11 ALA HB% A 13 GLU H 1.0 . 5.30 1007 935 A 11 ALA HB% A 18 LEU H 1.0 . 4.37 1008 936 A 11 ALA HB% A 7 ILE HG2% 1.0 . 3.56 1009 937 A 11 ALA HB% A 16 ILE HD1% 1.0 . 3.85 1010 938 A 11 ALA HB% A 38 LEU HDx% 1.0 . 4.94 1011 939 A 11 ALA HB% A 18 LEU HDy% 1.0 . 3.63 1012 940 A 11 ALA HB% A 16 ILE H 1.0 . 4.39 1013 941 A 11 ALA HB% A 12 LEU H 1.0 . 3.24 1014 942 A 11 ALA HB% A 14 GLN H 1.0 . 4.70 1015 943 A 11 ALA HB% A 42 TRP HZ2 1.0 . 3.21 1016 944 A 11 ALA HB% A 42 TRP HH2 1.0 . 4.39 1017 945 A 11 ALA HB% A 38 LEU HDy% 1.0 . 4.94 1018 946 A 34 ILE HG2% A 42 TRP HZ2 1.0 . 5.38 1019 947 A 34 ILE HG2% A 34 ILE HA 1.0 . 3.68 1020 948 A 34 ILE HG2% A 35 PRO HDy 1.0 . 3.77 1021 949 A 34 ILE HG2% A 39 LEU HA 1.0 . 5.50 1022 950 A 34 ILE HG2% A 39 LEU HG 1.0 . 3.24 1023 951 A 34 ILE HG2% A 16 ILE HD1% 1.0 . 3.71 1024 952 A 34 ILE HG2% A 16 ILE HG1y 1.0 . 5.12 1025 953 A 50 ILE HG2% A 51 ASP HA 1.0 . 3.69 1026 954 A 50 ILE HG2% A 54 ASN HA 1.0 . 5.27 1027 955 A 54 ASN HBx A 50 ILE HG2% 1.0 . 4.00 1028 956 A 16 ILE H A 16 ILE HD1% 1.0 . 3.65 1029 957 A 14 GLN H A 16 ILE HD1% 1.0 . 4.29 1030 958 A 16 ILE HD1% A 42 TRP HZ3 1.0 . 4.36 1031 959 A 16 ILE HD1% A 16 ILE HA 1.0 . 3.99 1032 960 A 16 ILE HD1% A 35 PRO HDy 1.0 . 3.95 1033 961 A 16 ILE HD1% A 35 PRO HDx 1.0 . 3.95 1034 962 A 16 ILE HD1% A 14 GLN HB2 1.0 . 3.43 1035 962 A 14 GLN HB3 A 16 ILE HD1% 1.0 . 3.43 1036 963 A 16 ILE HD1% A 35 PRO HGy 1.0 . 3.89 1037 964 A 16 ILE HB A 16 ILE HD1% 1.0 . 3.02 1038 965 A 29 THR HG2% A 16 ILE HD1% 1.0 . 3.64 1039 966 A 18 LEU HDy% A 16 ILE HD1% 1.0 . 4.51 1040 967 A 25 LEU H A 50 ILE HG2% 1.0 . 5.38 1041 968 A 53 LEU H A 50 ILE HG2% 1.0 . 5.50 1042 969 A 50 ILE HG2% A 54 ASN HD21 1.0 . 3.31 1043 970 A 50 ILE HG2% A 47 GLN HE22 1.0 . 3.87 1044 971 A 50 ILE HG2% A 54 ASN HBy 1.0 . 3.76 1045 972 A 50 ILE HG2% A 51 ASP H 1.0 . 3.23 1046 973 A 50 ILE HG2% A 54 ASN HD22 1.0 . 4.08 1047 974 A 50 ILE HG2% A 23 ASN HA 1.0 . 3.65 1048 975 A 50 ILE HA A 50 ILE HG2% 1.0 . 3.09 1049 976 A 46 LYS HBy A 50 ILE HD1% 1.0 . 4.34 1050 977 A 50 ILE HD1% A 24 ARG HA 1.0 . 4.08 1051 978 A 50 ILE HD1% A 25 LEU HA 1.0 . 4.71 1052 979 A 50 ILE HD1% A 46 LYS HE2 1.0 . 5.04 1053 980 A 25 LEU H A 50 ILE HD1% 1.0 . 3.73 1054 981 A 50 ILE HD1% A 47 GLN H 1.0 . 4.06 1055 982 A 50 ILE H A 50 ILE HD1% 1.0 . 3.37 1056 983 A 50 ILE HA A 50 ILE HD1% 1.0 . 3.90 1057 984 A 50 ILE HB A 50 ILE HD1% 1.0 . 2.93 1058 985 A 34 ILE HD1% A 42 TRP HZ2 1.0 . 5.50 1059 986 A 34 ILE HD1% A 42 TRP HH2 1.0 . 3.31 1060 987 A 34 ILE HD1% A 42 TRP HZ3 1.0 . 3.80 1061 988 A 2 ILE H A 2 ILE HD1% 1.0 . 5.50 1062 989 A 4 ALA H A 2 ILE HD1% 1.0 . 5.50 1063 990 A 2 ILE HD1% A 7 ILE H 1.0 . 5.50 1064 991 A 2 ILE HD1% A 7 ILE HG1y 1.0 . 5.34 1065 992 A 2 ILE HD1% A 41 LYS HD2 1.0 . 5.50 1066 992 A 2 ILE HD1% A 41 LYS HD3 1.0 . 5.50 1067 993 A 34 ILE HD1% A 29 THR HB 1.0 . 5.50 1068 994 A 34 ILE HD1% A 16 ILE HD1% 1.0 . 3.02 1069 995 A 34 ILE HD1% A 16 ILE HG1y 1.0 . 2.88 1070 996 A 34 ILE HD1% A 27 TYR HE% 1.0 . 3.44 1071 997 A 34 ILE HD1% A 34 ILE HA 1.0 . 3.75 1072 998 A 7 ILE HD1% A 45 HIS HD2 1.0 . 3.61 1073 999 A 7 ILE HD1% A 4 ALA HA 1.0 . 3.11 1074 1000 A 7 ILE HD1% A 41 LYS HE2 1.0 . 3.86 1075 1000 A 7 ILE HD1% A 41 LYS HE3 1.0 . 3.86 1076 1001 A 7 ILE HD1% A 49 LEU HDx% 1.0 . 3.08 1077 1002 A 7 ILE HD1% A 42 TRP HD1 1.0 . 4.13 1078 1003 A 7 ILE HD1% A 6 GLN H 1.0 . 5.19 1079 1004 A 7 ILE HD1% A 42 TRP HA 1.0 . 4.32 1080 1005 A 7 ILE HD1% A 41 LYS HA 1.0 . 5.07 1081 1006 A 7 ILE HD1% A 7 ILE HA 1.0 . 4.02 1082 1007 A 7 ILE HD1% A 45 HIS HBy 1.0 . 3.53 1083 1008 A 7 ILE HD1% A 7 ILE HB 1.0 . 3.06 1084 1009 A 7 ILE HD1% A 41 LYS HGx 1.0 . 3.53 1085 1010 A 7 ILE HG2% A 7 ILE HD1% 1.0 . 2.78 1086 1011 A 7 ILE HD1% A 2 ILE HD1% 1.0 . 3.70 1087 1012 A 7 ILE HD1% A 49 LEU H 1.0 . 5.50 1088 1013 A 7 ILE HD1% A 3 ASP H 1.0 . 4.30 1089 1014 A 7 ILE HD1% A 45 HIS HA 1.0 . 5.50 1090 1015 A 7 ILE HD1% A 3 ASP HA 1.0 . 5.50 1091 1016 A 7 ILE HD1% A 2 ILE HA 1.0 . 4.80 1092 1017 A 2 ILE HB A 41 LYS HD2 1.0 . 4.84 1093 1017 A 2 ILE HB A 41 LYS HD3 1.0 . 4.84 1094 1018 A 2 ILE HD1% A 7 ILE HB 1.0 . 4.42 1095 1019 A 2 ILE HD1% A 6 GLN HBy 1.0 . 3.59 1096 1020 A 2 ILE HD1% A 6 GLN HGx 1.0 . 4.62 1097 1021 A 3 ASP HBy A 2 ILE HD1% 1.0 . 3.92 1098 1022 A 3 ASP HBx A 2 ILE HD1% 1.0 . 5.10 1099 1023 A 2 ILE HG1y A 3 ASP HA 1.0 . 5.09 1100 1024 A 2 ILE HG1y A 6 GLN HBy 1.0 . 4.95 1101 1025 A 2 ILE HG1y A 7 ILE HD1% 1.0 . 4.56 1102 1026 A 48 GLU HGx A 2 ILE HG2% 1.0 . 3.87 1103 1027 A 45 HIS HBy A 2 ILE HG2% 1.0 . 4.15 1104 1028 A 45 HIS HBx A 2 ILE HG2% 1.0 . 4.26 1105 1029 A 3 ASP HA A 2 ILE HG2% 1.0 . 4.29 1106 1030 A 28 GLU H A 27 TYR HBx 1.0 . 4.23 1107 1031 A 2 ILE HG1y A 4 ALA HA 1.0 . 4.00 1108 1032 A 4 ALA HB% A 5 ALA HB% 1.0 . 3.90 1109 1033 A 4 ALA HB% A 49 LEU HG 1.0 . 3.73 1110 1034 A 4 ALA HB% A 53 LEU HDy% 1.0 . 3.78 1111 1035 A 3 ASP HBy A 4 ALA HB% 1.0 . 5.50 1112 1036 A 4 ALA HB% A 45 HIS HBy 1.0 . 5.50 1113 1037 A 5 ALA HB% A 6 GLN HBy 1.0 . 4.50 1114 1038 A 6 GLN HA A 6 GLN HGx 1.0 . 3.75 1115 1039 A 9 ASP HBx A 6 GLN HA 1.0 . 3.29 1116 1040 A 3 ASP HBy A 6 GLN HBy 1.0 . 4.01 1117 1041 A 6 GLN HBy A 3 ASP HA 1.0 . 4.69 1118 1042 A 51 ASP HA A 55 GLN HB2 1.0 . 4.67 1119 1042 A 55 GLN HB3 A 51 ASP HA 1.0 . 4.67 1120 1043 A 55 GLN HGy A 54 ASN HBx 1.0 . 4.89 1121 1044 A 55 GLN HGy A 52 PHE HA 1.0 . 4.28 1122 1045 A 7 ILE HA A 6 GLN HA 1.0 . 4.90 1123 1046 A 7 ILE HA A 10 GLU HGx 1.0 . 4.03 1124 1047 A 10 GLU HGy A 7 ILE HA 1.0 . 3.90 1125 1048 A 2 ILE HD1% A 7 ILE HA 1.0 . 4.40 1126 1049 A 7 ILE HB A 49 LEU HDx% 1.0 . 4.06 1127 1050 A 8 VAL HB A 7 ILE HB 1.0 . 5.10 1128 1051 A 7 ILE HD1% A 49 LEU HDy% 1.0 . 3.03 1129 1052 A 7 ILE HD1% A 41 LYS HGy 1.0 . 3.28 1130 1053 A 7 ILE HD1% A 48 GLU HB2 1.0 . 4.22 1131 1053 A 7 ILE HD1% A 48 GLU HB3 1.0 . 4.22 1132 1054 A 7 ILE HD1% A 48 GLU HGx 1.0 . 5.50 1133 1055 A 7 ILE HD1% A 49 LEU HA 1.0 . 4.67 1134 1056 A 7 ILE HD1% A 45 HIS H 1.0 . 4.38 1135 1057 A 7 ILE HG1y A 2 ILE HG2% 1.0 . 5.07 1136 1058 A 49 LEU HDy% A 7 ILE HG1y 1.0 . 4.13 1137 1059 A 7 ILE HG2% A 2 ILE HD1% 1.0 . 4.02 1138 1060 A 7 ILE HG2% A 41 LYS HGy 1.0 . 3.81 1139 1061 A 7 ILE HG2% A 42 TRP HBy 1.0 . 5.03 1140 1062 A 7 ILE HG2% A 9 ASP H 1.0 . 5.15 1141 1063 A 7 ILE HB A 8 VAL HA 1.0 . 4.48 1142 1064 A 12 LEU HG A 8 VAL HA 1.0 . 4.46 1143 1065 A 7 ILE H A 8 VAL HA 1.0 . 5.42 1144 1066 A 18 LEU HDx% A 8 VAL HB 1.0 . 5.16 1145 1067 A 49 LEU HDy% A 8 VAL HB 1.0 . 5.04 1146 1068 A 5 ALA HB% A 8 VAL HB 1.0 . 4.28 1147 1069 A 9 ASP HBy A 8 VAL HB 1.0 . 4.80 1148 1070 A 8 VAL HB A 52 PHE HZ 1.0 . 4.14 1149 1071 A 18 LEU HG A 8 VAL HGx% 1.0 . 3.83 1150 1072 A 17 THR HG2% A 28 GLU HB2 1.0 . 3.57 1151 1072 A 17 THR HG2% A 28 GLU HB3 1.0 . 3.57 1152 1073 A 8 VAL HGx% A 52 PHE HE% 1.0 . 4.19 1153 1074 A 11 ALA HB% A 8 VAL HGy% 1.0 . 4.33 1154 1075 A 8 VAL HGy% A 53 LEU HDy% 1.0 . 3.46 1155 1076 A 9 ASP HBx A 10 GLU HBy 1.0 . 4.32 1156 1077 A 10 GLU HGy A 10 GLU HA 1.0 . 3.76 1157 1078 A 11 ALA HB% A 10 GLU HBy 1.0 . 5.50 1158 1079 A 11 ALA H A 10 GLU HBy 1.0 . 4.31 1159 1080 A 7 ILE HA A 10 GLU HBx 1.0 . 5.31 1160 1081 A 11 ALA HB% A 10 GLU HBx 1.0 . 5.10 1161 1082 A 7 ILE HG2% A 10 GLU HBx 1.0 . 5.50 1162 1083 A 7 ILE HB A 10 GLU HGy 1.0 . 4.93 1163 1084 A 11 ALA HA A 10 GLU HGx 1.0 . 3.48 1164 1085 A 11 ALA HA A 38 LEU HDx% 1.0 . 4.17 1165 1086 A 11 ALA HA A 14 GLN HG2 1.0 . 4.91 1166 1087 A 11 ALA HA A 14 GLN HG3 1.0 . 4.91 1167 1088 A 15 GLY H A 11 ALA HA 1.0 . 5.38 1168 1089 A 11 ALA HB% A 12 LEU HDy% 1.0 . 4.20 1169 1090 A 11 ALA HB% A 8 VAL HB 1.0 . 5.48 1170 1091 A 11 ALA HB% A 12 LEU HA 1.0 . 3.89 1171 1092 A 12 LEU HBx A 13 GLU HB2 1.0 . 4.80 1172 1092 A 12 LEU HBx A 13 GLU HB3 1.0 . 4.80 1173 1093 A 11 ALA HB% A 12 LEU HBx 1.0 . 4.68 1174 1094 A 12 LEU HBx A 8 VAL HGx% 1.0 . 4.42 1175 1095 A 12 LEU HBx A 10 GLU HA 1.0 . 5.27 1176 1096 A 12 LEU HBx A 14 GLN H 1.0 . 5.48 1177 1097 A 56 LEU H A 53 LEU HBy 1.0 . 5.50 1178 1098 A 12 LEU HBx A 11 ALA H 1.0 . 5.15 1179 1099 A 54 ASN H A 53 LEU HBy 1.0 . 4.45 1180 1100 A 12 LEU HBy A 8 VAL HGx% 1.0 . 5.15 1181 1101 A 11 ALA HB% A 12 LEU HBy 1.0 . 5.38 1182 1102 A 12 LEU HBy A 14 GLN H 1.0 . 5.40 1183 1103 A 12 LEU HDy% A 17 THR HB 1.0 . 4.27 1184 1104 A 12 LEU HG A 16 ILE H 1.0 . 5.50 1185 1105 A 12 LEU HG A 11 ALA H 1.0 . 5.07 1186 1106 A 14 GLN H A 13 GLU HGy 1.0 . 5.36 1187 1107 A 16 ILE HA A 15 GLY HAx 1.0 . 4.52 1188 1108 A 15 GLY HAy A 29 THR HB 1.0 . 5.34 1189 1109 A 16 ILE HA A 29 THR HB 1.0 . 3.21 1190 1110 A 16 ILE HB A 11 ALA H 1.0 . 5.50 1191 1111 A 16 ILE HB A 29 THR HB 1.0 . 4.83 1192 1112 A 16 ILE HB A 14 GLN HB2 1.0 . 4.95 1193 1112 A 16 ILE HB A 14 GLN HB3 1.0 . 4.95 1194 1113 A 16 ILE HB A 34 ILE HD1% 1.0 . 5.32 1195 1114 A 18 LEU HG A 16 ILE HB 1.0 . 5.10 1196 1115 A 16 ILE HD1% A 34 ILE HG1x 1.0 . 3.54 1197 1116 A 16 ILE HD1% A 34 ILE HG1y 1.0 . 3.89 1198 1117 A 16 ILE HD1% A 14 GLN HG2 1.0 . 4.80 1199 1118 A 16 ILE HD1% A 14 GLN HG3 1.0 . 4.80 1200 1119 A 16 ILE HD1% A 14 GLN HA 1.0 . 4.86 1201 1120 A 16 ILE HD1% A 29 THR HB 1.0 . 5.20 1202 1121 A 16 ILE HD1% A 34 ILE HA 1.0 . 4.39 1203 1122 A 16 ILE HD1% A 14 GLN HE22 1.0 . 5.50 1204 1123 A 11 ALA H A 16 ILE HD1% 1.0 . 5.50 1205 1124 A 13 GLU H A 16 ILE HD1% 1.0 . 5.50 1206 1125 A 16 ILE HG1x A 34 ILE HD1% 1.0 . 3.83 1207 1126 A 26 GLN HGy A 21 VAL HGy% 1.0 . 4.56 1208 1127 A 16 ILE HG2% A 11 ALA HA 1.0 . 4.78 1209 1128 A 16 ILE HG2% A 17 THR HB 1.0 . 5.15 1210 1129 A 16 ILE HG2% A 27 TYR HE% 1.0 . 4.21 1211 1130 A 18 LEU H A 16 ILE HG2% 1.0 . 4.56 1212 1131 A 16 ILE HG2% A 17 THR HA 1.0 . 4.10 1213 1132 A 53 LEU HG A 8 VAL HGx% 1.0 . 5.14 1214 1133 A 17 THR HG2% A 28 GLU HG2 1.0 . 4.04 1215 1133 A 17 THR HG2% A 28 GLU HG3 1.0 . 4.04 1216 1134 A 17 THR HG2% A 28 GLU HA 1.0 . 5.43 1217 1135 A 8 VAL HGx% A 9 ASP HA 1.0 . 3.96 1218 1136 A 9 ASP HBy A 8 VAL HGx% 1.0 . 4.88 1219 1137 A 12 LEU HG A 8 VAL HGx% 1.0 . 3.65 1220 1138 A 8 VAL HGx% A 53 LEU HDy% 1.0 . 3.73 1221 1139 A 27 TYR HA A 18 LEU HA 1.0 . 3.29 1222 1140 A 18 LEU HBx A 25 LEU HG 1.0 . 5.50 1223 1141 A 18 LEU HBx A 53 LEU HBx 1.0 . 5.50 1224 1142 A 18 LEU HBy A 16 ILE HG2% 1.0 . 5.33 1225 1143 A 18 LEU HBy A 17 THR HA 1.0 . 4.99 1226 1144 A 18 LEU HDy% A 17 THR HG2% 1.0 . 4.13 1227 1145 A 18 LEU HDy% A 16 ILE HB 1.0 . 3.82 1228 1146 A 18 LEU HDy% A 27 TYR HBy 1.0 . 3.32 1229 1147 A 18 LEU HDy% A 42 TRP HBx 1.0 . 4.20 1230 1148 A 18 LEU HDy% A 27 TYR HE% 1.0 . 5.14 1231 1149 A 18 LEU HDy% A 42 TRP HZ2 1.0 . 4.12 1232 1150 A 18 LEU HDx% A 49 LEU HDx% 1.0 . 3.04 1233 1151 A 18 LEU HDx% A 18 LEU HA 1.0 . 4.94 1234 1152 A 18 LEU HDx% A 53 LEU HDy% 1.0 . 4.25 1235 1153 A 54 ASN HBx A 20 VAL HGx% 1.0 . 5.50 1236 1154 A 23 ASN HBy A 54 ASN HD21 1.0 . 5.50 1237 1155 A 25 LEU HA A 20 VAL HA 1.0 . 3.51 1238 1156 A 25 LEU HDx% A 25 LEU HBy 1.0 . 4.02 1239 1157 A 26 GLN H A 25 LEU HBy 1.0 . 4.74 1240 1158 A 46 LYS HE2 A 25 LEU HBy 1.0 . 5.50 1241 1159 A 25 LEU HBy A 46 LYS HE3 1.0 . 5.50 1242 1160 A 49 LEU HBy A 25 LEU HDx% 1.0 . 4.18 1243 1161 A 25 LEU H A 25 LEU HDx% 1.0 . 5.03 1244 1162 A 26 GLN HGy A 26 GLN HA 1.0 . 3.86 1245 1163 A 19 PHE HE% A 26 GLN HB2 1.0 . 4.74 1246 1163 A 26 GLN HB3 A 19 PHE HE% 1.0 . 4.74 1247 1164 A 27 TYR HA A 26 GLN HB2 1.0 . 4.34 1248 1164 A 27 TYR HA A 26 GLN HB3 1.0 . 4.34 1249 1165 A 27 TYR HA A 28 GLU HA 1.0 . 4.66 1250 1166 A 27 TYR HA A 19 PHE HD% 1.0 . 3.79 1251 1167 A 27 TYR HA A 19 PHE HE% 1.0 . 3.85 1252 1168 A 27 TYR HBy A 16 ILE HD1% 1.0 . 5.50 1253 1169 A 27 TYR HBy A 18 LEU HA 1.0 . 4.61 1254 1170 A 18 LEU HBx A 27 TYR HBx 1.0 . 5.17 1255 1171 A 3 ASP HBx A 4 ALA HB% 1.0 . 5.09 1256 1172 A 19 PHE HZ A 28 GLU HB2 1.0 . 4.31 1257 1172 A 28 GLU HB3 A 19 PHE HZ 1.0 . 4.31 1258 1173 A 2 ILE HG1x A 44 GLN HGx 1.0 . 5.50 1259 1174 A 16 ILE HG1x A 29 THR HG2% 1.0 . 3.59 1260 1175 A 29 THR HG2% A 28 GLU HG2 1.0 . 4.77 1261 1175 A 28 GLU HG3 A 29 THR HG2% 1.0 . 4.77 1262 1176 A 31 ARG H A 30 SER HB2 1.0 . 5.25 1263 1177 A 31 ARG H A 30 SER HB3 1.0 . 5.25 1264 1178 A 29 THR HG2% A 31 ARG HB2 1.0 . 4.75 1265 1178 A 29 THR HG2% A 31 ARG HB3 1.0 . 4.75 1266 1179 A 30 SER HA A 31 ARG HG2 1.0 . 5.50 1267 1180 A 30 SER HA A 31 ARG HG3 1.0 . 5.50 1268 1181 A 29 THR HG2% A 34 ILE HD1% 1.0 . 2.91 1269 1182 A 34 ILE HD1% A 39 LEU HA 1.0 . 5.41 1270 1183 A 34 ILE HG2% A 34 ILE HG1x 1.0 . 3.46 1271 1184 A 34 ILE HG2% A 35 PRO HB2 1.0 . 4.26 1272 1185 A 34 ILE HG2% A 35 PRO HGy 1.0 . 4.26 1273 1186 A 34 ILE HG2% A 35 PRO HA 1.0 . 4.40 1274 1187 A 34 ILE HG2% A 27 TYR HE% 1.0 . 4.54 1275 1188 A 34 ILE HG2% A 35 PRO HB3 1.0 . 5.41 1276 1189 A 34 ILE HA A 35 PRO HB3 1.0 . 4.94 1277 1190 A 35 PRO HGy A 14 GLN HB2 1.0 . 3.71 1278 1190 A 14 GLN HB3 A 35 PRO HGy 1.0 . 3.71 1279 1191 A 35 PRO HGy A 38 LEU H 1.0 . 4.94 1280 1192 A 34 ILE HG2% A 35 PRO HGx 1.0 . 4.18 1281 1193 A 35 PRO HGx A 38 LEU H 1.0 . 5.13 1282 1194 A 34 ILE HG2% A 36 THR HA 1.0 . 3.50 1283 1195 A 36 THR HA A 39 LEU HBx 1.0 . 3.81 1284 1196 A 39 LEU H A 36 THR HA 1.0 . 3.92 1285 1197 A 38 LEU HA A 41 LYS HBy 1.0 . 3.62 1286 1198 A 38 LEU HA A 42 TRP HD1 1.0 . 5.50 1287 1199 A 42 TRP HZ2 A 38 LEU HBy 1.0 . 5.50 1288 1200 A 38 LEU H A 38 LEU HDx% 1.0 . 5.50 1289 1201 A 39 LEU HA A 39 LEU HDy% 1.0 . 4.18 1290 1202 A 39 LEU HA A 42 TRP HH2 1.0 . 4.18 1291 1203 A 40 ASN H A 39 LEU HG 1.0 . 4.87 1292 1204 A 41 LYS HA A 41 LYS HGx 1.0 . 3.48 1293 1205 A 41 LYS HGy A 41 LYS HE2 1.0 . 3.66 1294 1205 A 41 LYS HE3 A 41 LYS HGy 1.0 . 3.66 1295 1206 A 2 ILE HG1y A 41 LYS HE2 1.0 . 5.46 1296 1206 A 2 ILE HG1y A 41 LYS HE3 1.0 . 5.46 1297 1207 A 41 LYS HGx A 2 ILE HG2% 1.0 . 5.24 1298 1208 A 44 GLN H A 43 LYS HG3 1.0 . 4.53 1299 1209 A 42 TRP H A 41 LYS HGx 1.0 . 4.58 1300 1210 A 2 ILE HD1% A 41 LYS HGy 1.0 . 4.92 1301 1211 A 42 TRP HBx A 39 LEU HA 1.0 . 5.47 1302 1212 A 45 HIS H A 43 LYS HA 1.0 . 4.50 1303 1213 A 43 LYS H A 44 GLN HA 1.0 . 5.20 1304 1214 A 2 ILE HG1x A 45 HIS HBx 1.0 . 4.88 1305 1215 A 49 LEU HDx% A 45 HIS HBx 1.0 . 5.27 1306 1216 A 7 ILE HD1% A 45 HIS HBx 1.0 . 4.26 1307 1217 A 45 HIS HBy A 49 LEU HG 1.0 . 4.99 1308 1218 A 46 LYS HA A 25 LEU HDx% 1.0 . 4.59 1309 1219 A 50 ILE HG1x A 46 LYS HA 1.0 . 3.89 1310 1220 A 50 ILE H A 46 LYS HA 1.0 . 4.06 1311 1221 A 46 LYS HBx A 47 GLN HG2 1.0 . 4.96 1312 1222 A 46 LYS HBx A 46 LYS HE2 1.0 . 5.29 1313 1223 A 46 LYS HBx A 46 LYS HE3 1.0 . 5.29 1314 1224 A 46 LYS HBy A 46 LYS HE2 1.0 . 5.46 1315 1225 A 46 LYS HBy A 46 LYS HE3 1.0 . 5.46 1316 1226 A 49 LEU H A 47 GLN HA 1.0 . 4.75 1317 1227 A 51 ASP H A 48 GLU HA 1.0 . 3.94 1318 1228 A 49 LEU H A 48 GLU HA 1.0 . 3.56 1319 1229 A 45 HIS HBy A 48 GLU HB2 1.0 . 4.50 1320 1229 A 45 HIS HBy A 48 GLU HB3 1.0 . 4.50 1321 1230 A 14 GLN HA A 13 GLU HB2 1.0 . 4.86 1322 1230 A 13 GLU HB3 A 14 GLN HA 1.0 . 4.86 1323 1231 A 48 GLU HGy A 2 ILE HG2% 1.0 . 4.63 1324 1232 A 45 HIS HBx A 48 GLU HGy 1.0 . 4.61 1325 1233 A 8 VAL H A 6 GLN HA 1.0 . 4.59 1326 1234 A 49 LEU HBy A 25 LEU HDy% 1.0 . 4.18 1327 1235 A 50 ILE H A 49 LEU HBy 1.0 . 4.26 1328 1236 A 49 LEU HDy% A 49 LEU HBx 1.0 . 2.84 1329 1237 A 49 LEU HDx% A 49 LEU HBx 1.0 . 3.24 1330 1238 A 49 LEU HDx% A 50 ILE HG1x 1.0 . 4.57 1331 1239 A 49 LEU HBx A 50 ILE HA 1.0 . 5.36 1332 1240 A 49 LEU HBy A 50 ILE HA 1.0 . 4.36 1333 1241 A 50 ILE HB A 51 ASP HA 1.0 . 4.85 1334 1242 A 47 GLN HBx A 50 ILE HD1% 1.0 . 4.77 1335 1243 A 50 ILE HD1% A 46 LYS HA 1.0 . 3.92 1336 1244 A 50 ILE HG1y A 20 VAL HB 1.0 . 5.08 1337 1245 A 50 ILE HG2% A 47 GLN HA 1.0 . 4.32 1338 1246 A 4 ALA HB% A 51 ASP HBx 1.0 . 4.53 1339 1247 A 50 ILE HB A 51 ASP HBx 1.0 . 5.12 1340 1248 A 10 GLU HGy A 9 ASP HBx 1.0 . 4.44 1341 1249 A 51 ASP HBy A 48 GLU HA 1.0 . 4.25 1342 1250 A 50 ILE HB A 51 ASP HBy 1.0 . 4.51 1343 1251 A 4 ALA HB% A 52 PHE HA 1.0 . 4.01 1344 1252 A 53 LEU HA A 56 LEU HBy 1.0 . 3.99 1345 1253 A 53 LEU HDy% A 53 LEU HA 1.0 . 3.36 1346 1254 A 18 LEU HBy A 53 LEU HDx% 1.0 . 3.55 1347 1255 A 53 LEU HDx% A 53 LEU HBy 1.0 . 3.15 1348 1256 A 56 LEU HA A 57 ASP HA 1.0 . 4.75 1349 1257 A 55 GLN HE21 A 56 LEU HA 1.0 . 4.17 1350 1258 A 56 LEU HDx% A 56 LEU HBy 1.0 . 3.71 1351 1259 A 53 LEU HDx% A 56 LEU HBy 1.0 . 4.00 1352 1260 A 60 GLU HA A 60 GLU HG2 1.0 . 3.47 1353 1260 A 60 GLU HG3 A 60 GLU HA 1.0 . 3.47 1354 1261 A 44 GLN HBx A 45 HIS HE1 1.0 . 5.08 1355 1262 A 2 ILE HG1x A 45 HIS HE1 1.0 . 4.64 1356 1263 A 45 HIS HE1 A 44 GLN HGx 1.0 . 3.59 1357 1264 A 2 ILE HG1y A 45 HIS HE1 1.0 . 5.50 1358 1265 A 45 HIS HE1 A 2 ILE HG2% 1.0 . 3.13 1359 1266 A 29 THR HG2% A 27 TYR HD% 1.0 . 4.12 1360 1267 A 27 TYR HD% A 34 ILE HD1% 1.0 . 4.34 1361 1268 A 27 TYR HD% A 42 TRP HE3 1.0 . 4.03 1362 1269 A 16 ILE HG2% A 27 TYR HD% 1.0 . 3.38 1363 1270 A 26 GLN HGy A 19 PHE HD% 1.0 . 4.89 1364 1271 A 19 PHE HD% A 19 PHE HA 1.0 . 4.36 1365 1272 A 19 PHE HD% A 20 VAL HGx% 1.0 . 5.50 1366 1273 A 19 PHE HD% A 20 VAL HGy% 1.0 . 5.50 1367 1274 A 17 THR HG2% A 19 PHE HD% 1.0 . 3.42 1368 1275 A 5 ALA HB% A 52 PHE HD% 1.0 . 4.25 1369 1276 A 8 VAL HGx% A 52 PHE HD% 1.0 . 4.63 1370 1277 A 5 ALA HB% A 52 PHE HZ 1.0 . 3.73 1371 1278 A 5 ALA HB% A 52 PHE HE% 1.0 . 4.37 1372 1279 A 52 PHE HE% A 56 LEU HDy% 1.0 . 5.50 1373 1280 A 19 PHE HZ A 28 GLU HA 1.0 . 4.78 1374 1281 A 45 HIS HD2 A 44 GLN HGy 1.0 . 4.57 1375 1282 A 45 HIS HD2 A 41 LYS HGy 1.0 . 3.57 1376 1283 A 45 HIS HBy A 45 HIS HD2 1.0 . 3.47 1377 1284 A 45 HIS HBx A 45 HIS HD2 1.0 . 3.93 1378 1285 A 45 HIS HD2 A 44 GLN HGx 1.0 . 3.61 1379 1286 A 44 GLN HBx A 45 HIS HD2 1.0 . 3.44 1380 1287 A 45 HIS HD2 A 2 ILE HG2% 1.0 . 4.04 1381 1288 A 45 HIS HD2 A 42 TRP HA 1.0 . 4.96 1382 1289 A 45 HIS HD2 A 41 LYS HA 1.0 . 3.52 1383 1290 A 11 ALA HB% A 42 TRP HD1 1.0 . 4.52 1384 1291 A 16 ILE HD1% A 42 TRP HH2 1.0 . 3.54 1385 1292 A 42 TRP HH2 A 14 GLN HB2 1.0 . 5.48 1386 1292 A 14 GLN HB3 A 42 TRP HH2 1.0 . 5.48 1387 1293 A 7 ILE HG2% A 42 TRP HD1 1.0 . 2.87 1388 1294 A 49 LEU HDx% A 42 TRP HD1 1.0 . 3.40 1389 1295 A 43 LYS H A 42 TRP HE3 1.0 . 4.81 1390 1296 A 43 LYS HG2 A 42 TRP HE3 1.0 . 5.43 1391 1297 A 34 ILE HG1x A 27 TYR HE% 1.0 . 5.50 1392 1298 A 29 THR HG2% A 27 TYR HE% 1.0 . 3.70 1393 1299 A 27 TYR HE% A 39 LEU HDx% 1.0 . 4.90 1394 1300 A 29 THR HB A 27 TYR HE% 1.0 . 5.50 1395 1301 A 27 TYR HE% A 39 LEU HDy% 1.0 . 4.90 1396 1302 A 11 ALA HA A 42 TRP HZ2 1.0 . 4.24 1397 1303 A 16 ILE HD1% A 42 TRP HZ2 1.0 . 3.65 1398 1304 A 2 ILE HA A 1 GLY HAy 1.0 . 4.30 1399 1304 A 2 ILE HA A 1 GLY HAx 1.0 . 4.30 1400 1305 A 2 ILE HB A 1 GLY HAy 1.0 . 4.86 1401 1305 A 2 ILE HB A 1 GLY HAx 1.0 . 4.86 1402 1306 A 2 ILE HG2% A 1 GLY HAy 1.0 . 3.92 1403 1306 A 2 ILE HG2% A 1 GLY HAx 1.0 . 3.92 1404 1307 A 6 GLN HGy A 6 GLN HE21 1.0 . 3.30 1405 1307 A 6 GLN HGy A 6 GLN HE22 1.0 . 3.30 1406 1308 A 9 ASP HBy A 6 GLN HE21 1.0 . 5.34 1407 1308 A 9 ASP HBy A 6 GLN HE22 1.0 . 5.34 1408 1309 A 7 ILE HG2% A 41 LYS HBx 1.0 . 4.61 1409 1309 A 7 ILE HG2% A 41 LYS HBy 1.0 . 4.61 1410 1310 A 7 ILE HG1x A 41 LYS HBx 1.0 . 5.00 1411 1310 A 7 ILE HG1x A 41 LYS HBy 1.0 . 5.00 1412 1311 A 8 VAL HGx% A 56 LEU HDy% 1.0 . 3.52 1413 1311 A 8 VAL HGx% A 56 LEU HDx% 1.0 . 3.52 1414 1312 A 14 GLN HE21 A 10 GLU HBx 1.0 . 3.78 1415 1312 A 14 GLN HE22 A 10 GLU HBx 1.0 . 3.78 1416 1313 A 10 GLU HGy A 14 GLN HE21 1.0 . 5.34 1417 1313 A 10 GLU HGy A 14 GLN HE22 1.0 . 5.34 1418 1314 A 10 GLU HGy A 38 LEU HDy% 1.0 . 4.88 1419 1314 A 10 GLU HGy A 38 LEU HDx% 1.0 . 4.88 1420 1315 A 14 GLN HE21 A 10 GLU HGx 1.0 . 4.31 1421 1315 A 14 GLN HE22 A 10 GLU HGx 1.0 . 4.31 1422 1316 A 10 GLU HGx A 38 LEU HDy% 1.0 . 5.44 1423 1316 A 10 GLU HGx A 38 LEU HDx% 1.0 . 5.44 1424 1317 A 11 ALA H A 14 GLN HE21 1.0 . 5.34 1425 1317 A 11 ALA H A 14 GLN HE22 1.0 . 5.34 1426 1318 A 11 ALA H A 38 LEU HDy% 1.0 . 4.19 1427 1318 A 11 ALA H A 38 LEU HDx% 1.0 . 4.19 1428 1319 A 11 ALA HA A 14 GLN HG3 1.0 . 4.25 1429 1319 A 11 ALA HA A 14 GLN HG2 1.0 . 4.25 1430 1320 A 14 GLN HE21 A 11 ALA HA 1.0 . 4.38 1431 1320 A 14 GLN HE22 A 11 ALA HA 1.0 . 4.38 1432 1321 A 11 ALA HA A 38 LEU HDy% 1.0 . 3.23 1433 1321 A 11 ALA HA A 38 LEU HDx% 1.0 . 3.23 1434 1322 A 11 ALA HB% A 38 LEU HDy% 1.0 . 3.53 1435 1322 A 11 ALA HB% A 38 LEU HDx% 1.0 . 3.53 1436 1323 A 13 GLU H A 14 GLN HG3 1.0 . 5.34 1437 1323 A 13 GLU H A 14 GLN HG2 1.0 . 5.34 1438 1324 A 14 GLN H A 14 GLN HG3 1.0 . 3.11 1439 1324 A 14 GLN H A 14 GLN HG2 1.0 . 3.11 1440 1325 A 14 GLN H A 38 LEU HDy% 1.0 . 4.40 1441 1325 A 14 GLN H A 38 LEU HDx% 1.0 . 4.40 1442 1326 A 14 GLN HA A 14 GLN HG3 1.0 . 3.60 1443 1326 A 14 GLN HA A 14 GLN HG2 1.0 . 3.60 1444 1327 A 14 GLN HE21 A 14 GLN HB2 1.0 . 4.20 1445 1327 A 14 GLN HB3 A 14 GLN HE22 1.0 . 4.20 1446 1327 A 14 GLN HB3 A 14 GLN HE21 1.0 . 4.20 1447 1327 A 14 GLN HE22 A 14 GLN HB2 1.0 . 4.20 1448 1328 A 14 GLN HB2 A 38 LEU HDy% 1.0 . 4.60 1449 1328 A 14 GLN HB3 A 38 LEU HDy% 1.0 . 4.60 1450 1328 A 38 LEU HDx% A 14 GLN HB2 1.0 . 4.60 1451 1328 A 14 GLN HB3 A 38 LEU HDx% 1.0 . 4.60 1452 1329 A 14 GLN HE21 A 14 GLN HG2 1.0 . 3.19 1453 1329 A 14 GLN HE22 A 14 GLN HG3 1.0 . 3.19 1454 1329 A 14 GLN HE22 A 14 GLN HG2 1.0 . 3.19 1455 1329 A 14 GLN HE21 A 14 GLN HG3 1.0 . 3.19 1456 1330 A 15 GLY H A 14 GLN HG3 1.0 . 4.41 1457 1330 A 15 GLY H A 14 GLN HG2 1.0 . 4.41 1458 1331 A 16 ILE HD1% A 14 GLN HG3 1.0 . 4.05 1459 1331 A 16 ILE HD1% A 14 GLN HG2 1.0 . 4.05 1460 1332 A 35 PRO HGy A 14 GLN HG3 1.0 . 3.34 1461 1332 A 35 PRO HGy A 14 GLN HG2 1.0 . 3.34 1462 1333 A 14 GLN HG2 A 38 LEU HBy 1.0 . 4.76 1463 1333 A 14 GLN HG3 A 38 LEU HBy 1.0 . 4.76 1464 1333 A 38 LEU HBx A 14 GLN HG3 1.0 . 4.76 1465 1333 A 14 GLN HG2 A 38 LEU HBx 1.0 . 4.76 1466 1334 A 14 GLN HG2 A 38 LEU HDy% 1.0 . 3.55 1467 1334 A 14 GLN HG3 A 38 LEU HDy% 1.0 . 3.55 1468 1334 A 38 LEU HDx% A 14 GLN HG3 1.0 . 3.55 1469 1334 A 38 LEU HDx% A 14 GLN HG2 1.0 . 3.55 1470 1335 A 14 GLN HE21 A 35 PRO HGx 1.0 . 4.79 1471 1335 A 14 GLN HE22 A 35 PRO HGx 1.0 . 4.79 1472 1336 A 14 GLN HE22 A 38 LEU HBy 1.0 . 5.18 1473 1336 A 14 GLN HE21 A 38 LEU HBx 1.0 . 5.18 1474 1336 A 14 GLN HE22 A 38 LEU HBx 1.0 . 5.18 1475 1336 A 14 GLN HE21 A 38 LEU HBy 1.0 . 5.18 1476 1337 A 14 GLN HE21 A 38 LEU HDx% 1.0 . 3.72 1477 1337 A 14 GLN HE22 A 38 LEU HDx% 1.0 . 3.72 1478 1337 A 14 GLN HE21 A 38 LEU HDy% 1.0 . 3.72 1479 1337 A 14 GLN HE22 A 38 LEU HDy% 1.0 . 3.72 1480 1338 A 16 ILE HB A 38 LEU HDy% 1.0 . 5.44 1481 1338 A 16 ILE HB A 38 LEU HDx% 1.0 . 5.44 1482 1339 A 16 ILE HG1y A 31 ARG HDy 1.0 . 5.34 1483 1339 A 16 ILE HG1y A 31 ARG HDx 1.0 . 5.34 1484 1340 A 16 ILE HG1x A 31 ARG HDy 1.0 . 4.84 1485 1340 A 16 ILE HG1x A 31 ARG HDx 1.0 . 4.84 1486 1341 A 16 ILE HD1% A 31 ARG HDy 1.0 . 4.44 1487 1341 A 16 ILE HD1% A 31 ARG HDx 1.0 . 4.44 1488 1342 A 16 ILE HD1% A 38 LEU HDy% 1.0 . 2.88 1489 1342 A 16 ILE HD1% A 38 LEU HDx% 1.0 . 2.88 1490 1343 A 18 LEU HBy A 25 LEU HDy% 1.0 . 4.82 1491 1343 A 18 LEU HBy A 25 LEU HDx% 1.0 . 4.82 1492 1344 A 18 LEU HBx A 20 VAL HGy% 1.0 . 5.44 1493 1344 A 18 LEU HBx A 20 VAL HGx% 1.0 . 5.44 1494 1345 A 18 LEU HBx A 25 LEU HDy% 1.0 . 3.93 1495 1345 A 18 LEU HBx A 25 LEU HDx% 1.0 . 3.93 1496 1346 A 18 LEU HDx% A 25 LEU HDy% 1.0 . 3.39 1497 1346 A 18 LEU HDx% A 25 LEU HDx% 1.0 . 3.39 1498 1347 A 18 LEU HDy% A 25 LEU HDy% 1.0 . 3.13 1499 1347 A 18 LEU HDy% A 25 LEU HDx% 1.0 . 3.13 1500 1348 A 19 PHE H A 20 VAL HGy% 1.0 . 4.36 1501 1348 A 19 PHE H A 20 VAL HGx% 1.0 . 4.36 1502 1349 A 19 PHE H A 25 LEU HDy% 1.0 . 3.62 1503 1349 A 19 PHE H A 25 LEU HDx% 1.0 . 3.62 1504 1350 A 19 PHE HA A 20 VAL HGy% 1.0 . 4.38 1505 1350 A 19 PHE HA A 20 VAL HGx% 1.0 . 4.38 1506 1351 A 19 PHE HBy A 21 VAL HGy% 1.0 . 4.96 1507 1351 A 19 PHE HBy A 21 VAL HGx% 1.0 . 4.96 1508 1352 A 19 PHE HD% A 20 VAL HGy% 1.0 . 4.80 1509 1352 A 19 PHE HD% A 20 VAL HGx% 1.0 . 4.80 1510 1353 A 19 PHE HD% A 21 VAL HGy% 1.0 . 3.33 1511 1353 A 19 PHE HD% A 21 VAL HGx% 1.0 . 3.33 1512 1354 A 19 PHE HD% A 25 LEU HDy% 1.0 . 4.94 1513 1354 A 19 PHE HD% A 25 LEU HDx% 1.0 . 4.94 1514 1355 A 19 PHE HE% A 21 VAL HGy% 1.0 . 3.18 1515 1355 A 19 PHE HE% A 21 VAL HGx% 1.0 . 3.18 1516 1356 A 19 PHE HZ A 21 VAL HGy% 1.0 . 4.73 1517 1356 A 19 PHE HZ A 21 VAL HGx% 1.0 . 4.73 1518 1357 A 20 VAL H A 20 VAL HGy% 1.0 . 2.97 1519 1357 A 20 VAL H A 20 VAL HGx% 1.0 . 2.97 1520 1358 A 20 VAL H A 21 VAL HGy% 1.0 . 4.84 1521 1358 A 20 VAL H A 21 VAL HGx% 1.0 . 4.84 1522 1359 A 21 VAL H A 20 VAL HGy% 1.0 . 3.04 1523 1359 A 21 VAL H A 20 VAL HGx% 1.0 . 3.04 1524 1360 A 21 VAL HA A 20 VAL HGy% 1.0 . 5.44 1525 1360 A 21 VAL HA A 20 VAL HGx% 1.0 . 5.44 1526 1361 A 23 ASN H A 20 VAL HGy% 1.0 . 3.02 1527 1361 A 23 ASN H A 20 VAL HGx% 1.0 . 3.02 1528 1362 A 23 ASN HA A 20 VAL HGy% 1.0 . 2.86 1529 1362 A 23 ASN HA A 20 VAL HGx% 1.0 . 2.86 1530 1363 A 23 ASN HBy A 20 VAL HGy% 1.0 . 4.66 1531 1363 A 23 ASN HBy A 20 VAL HGx% 1.0 . 4.66 1532 1364 A 23 ASN HBx A 20 VAL HGy% 1.0 . 5.44 1533 1364 A 23 ASN HBx A 20 VAL HGx% 1.0 . 5.44 1534 1365 A 23 ASN HD21 A 20 VAL HGy% 1.0 . 5.44 1535 1365 A 23 ASN HD21 A 20 VAL HGx% 1.0 . 5.44 1536 1366 A 24 ARG H A 20 VAL HGy% 1.0 . 3.00 1537 1366 A 24 ARG H A 20 VAL HGx% 1.0 . 3.00 1538 1367 A 24 ARG HA A 20 VAL HGy% 1.0 . 4.04 1539 1367 A 24 ARG HA A 20 VAL HGx% 1.0 . 4.04 1540 1368 A 20 VAL HGy% A 24 ARG HGx 1.0 . 5.28 1541 1368 A 24 ARG HGy A 20 VAL HGy% 1.0 . 5.28 1542 1368 A 20 VAL HGx% A 24 ARG HGy 1.0 . 5.28 1543 1368 A 20 VAL HGx% A 24 ARG HGx 1.0 . 5.28 1544 1369 A 25 LEU H A 20 VAL HGy% 1.0 . 4.61 1545 1369 A 25 LEU H A 20 VAL HGx% 1.0 . 4.61 1546 1370 A 25 LEU HA A 20 VAL HGy% 1.0 . 3.25 1547 1370 A 25 LEU HA A 20 VAL HGx% 1.0 . 3.25 1548 1371 A 20 VAL HGx% A 25 LEU HBy 1.0 . 4.05 1549 1371 A 20 VAL HGy% A 25 LEU HBy 1.0 . 4.05 1550 1371 A 25 LEU HBx A 20 VAL HGy% 1.0 . 4.05 1551 1371 A 20 VAL HGx% A 25 LEU HBx 1.0 . 4.05 1552 1372 A 25 LEU HG A 20 VAL HGy% 1.0 . 5.23 1553 1372 A 25 LEU HG A 20 VAL HGx% 1.0 . 5.23 1554 1373 A 50 ILE H A 20 VAL HGy% 1.0 . 4.66 1555 1373 A 50 ILE H A 20 VAL HGx% 1.0 . 4.66 1556 1374 A 50 ILE HA A 20 VAL HGy% 1.0 . 2.68 1557 1374 A 50 ILE HA A 20 VAL HGx% 1.0 . 2.68 1558 1375 A 50 ILE HG1y A 20 VAL HGy% 1.0 . 4.84 1559 1375 A 50 ILE HG1y A 20 VAL HGx% 1.0 . 4.84 1560 1376 A 52 PHE HBx A 20 VAL HGy% 1.0 . 5.44 1561 1376 A 52 PHE HBx A 20 VAL HGx% 1.0 . 5.44 1562 1377 A 53 LEU H A 20 VAL HGy% 1.0 . 3.70 1563 1377 A 53 LEU H A 20 VAL HGx% 1.0 . 3.70 1564 1378 A 53 LEU HA A 20 VAL HGy% 1.0 . 4.82 1565 1378 A 53 LEU HA A 20 VAL HGx% 1.0 . 4.82 1566 1379 A 53 LEU HBx A 20 VAL HGy% 1.0 . 3.46 1567 1379 A 53 LEU HBx A 20 VAL HGx% 1.0 . 3.46 1568 1380 A 53 LEU HBy A 20 VAL HGy% 1.0 . 3.66 1569 1380 A 53 LEU HBy A 20 VAL HGx% 1.0 . 3.66 1570 1381 A 53 LEU HG A 20 VAL HGy% 1.0 . 3.12 1571 1381 A 53 LEU HG A 20 VAL HGx% 1.0 . 3.12 1572 1382 A 53 LEU HDx% A 20 VAL HGy% 1.0 . 3.99 1573 1382 A 53 LEU HDx% A 20 VAL HGx% 1.0 . 3.99 1574 1383 A 53 LEU HDy% A 20 VAL HGy% 1.0 . 3.40 1575 1383 A 53 LEU HDy% A 20 VAL HGx% 1.0 . 3.40 1576 1384 A 54 ASN H A 20 VAL HGy% 1.0 . 3.40 1577 1384 A 54 ASN H A 20 VAL HGx% 1.0 . 3.40 1578 1385 A 54 ASN HBy A 20 VAL HGy% 1.0 . 3.94 1579 1385 A 54 ASN HBy A 20 VAL HGx% 1.0 . 3.94 1580 1386 A 54 ASN HBx A 20 VAL HGy% 1.0 . 4.61 1581 1386 A 54 ASN HBx A 20 VAL HGx% 1.0 . 4.61 1582 1387 A 54 ASN HD21 A 20 VAL HGy% 1.0 . 3.21 1583 1387 A 54 ASN HD21 A 20 VAL HGx% 1.0 . 3.21 1584 1388 A 21 VAL H A 21 VAL HGy% 1.0 . 3.33 1585 1388 A 21 VAL H A 21 VAL HGx% 1.0 . 3.33 1586 1389 A 21 VAL HA A 21 VAL HGy% 1.0 . 2.74 1587 1389 A 21 VAL HA A 21 VAL HGx% 1.0 . 2.74 1588 1390 A 21 VAL HA A 22 ASN HD22 1.0 . 5.34 1589 1390 A 21 VAL HA A 22 ASN HD21 1.0 . 5.34 1590 1391 A 22 ASN H A 21 VAL HGy% 1.0 . 3.67 1591 1391 A 22 ASN H A 21 VAL HGx% 1.0 . 3.67 1592 1392 A 22 ASN HA A 21 VAL HGy% 1.0 . 4.14 1593 1392 A 22 ASN HA A 21 VAL HGx% 1.0 . 4.14 1594 1393 A 21 VAL HGy% A 22 ASN HBx 1.0 . 3.26 1595 1393 A 21 VAL HGx% A 22 ASN HBx 1.0 . 3.26 1596 1393 A 22 ASN HBy A 21 VAL HGy% 1.0 . 3.26 1597 1393 A 21 VAL HGx% A 22 ASN HBy 1.0 . 3.26 1598 1394 A 21 VAL HGx% A 22 ASN HD22 1.0 . 3.44 1599 1394 A 21 VAL HGy% A 22 ASN HD22 1.0 . 3.44 1600 1394 A 22 ASN HD21 A 21 VAL HGy% 1.0 . 3.44 1601 1394 A 21 VAL HGx% A 22 ASN HD21 1.0 . 3.44 1602 1395 A 24 ARG H A 21 VAL HGy% 1.0 . 5.01 1603 1395 A 24 ARG H A 21 VAL HGx% 1.0 . 5.01 1604 1396 A 26 GLN H A 21 VAL HGy% 1.0 . 4.30 1605 1396 A 26 GLN H A 21 VAL HGx% 1.0 . 4.30 1606 1397 A 21 VAL HGx% A 26 GLN HB2 1.0 . 4.71 1607 1397 A 21 VAL HGy% A 26 GLN HB2 1.0 . 4.71 1608 1397 A 26 GLN HB3 A 21 VAL HGy% 1.0 . 4.71 1609 1397 A 26 GLN HB3 A 21 VAL HGx% 1.0 . 4.71 1610 1398 A 26 GLN HGx A 21 VAL HGy% 1.0 . 5.32 1611 1398 A 26 GLN HGx A 21 VAL HGx% 1.0 . 5.32 1612 1399 A 26 GLN HGy A 21 VAL HGy% 1.0 . 3.64 1613 1399 A 26 GLN HGy A 21 VAL HGx% 1.0 . 3.64 1614 1400 A 22 ASN HA A 22 ASN HBx 1.0 . 2.62 1615 1400 A 22 ASN HA A 22 ASN HBy 1.0 . 2.62 1616 1401 A 22 ASN HBy A 22 ASN HD22 1.0 . 3.04 1617 1401 A 22 ASN HBx A 22 ASN HD22 1.0 . 3.04 1618 1401 A 22 ASN HD21 A 22 ASN HBx 1.0 . 3.04 1619 1401 A 22 ASN HD21 A 22 ASN HBy 1.0 . 3.04 1620 1402 A 23 ASN H A 22 ASN HBx 1.0 . 4.06 1621 1402 A 23 ASN H A 22 ASN HBy 1.0 . 4.06 1622 1403 A 24 ARG H A 22 ASN HBx 1.0 . 4.36 1623 1403 A 24 ARG H A 22 ASN HBy 1.0 . 4.36 1624 1404 A 24 ARG HB2 A 22 ASN HBx 1.0 . 4.30 1625 1404 A 24 ARG HB2 A 22 ASN HBy 1.0 . 4.30 1626 1405 A 22 ASN HBy A 24 ARG HD2 1.0 . 4.76 1627 1405 A 22 ASN HBx A 24 ARG HD2 1.0 . 4.76 1628 1405 A 24 ARG HD3 A 22 ASN HBx 1.0 . 4.76 1629 1405 A 22 ASN HBy A 24 ARG HD3 1.0 . 4.76 1630 1406 A 24 ARG HB2 A 22 ASN HD22 1.0 . 5.32 1631 1406 A 24 ARG HB2 A 22 ASN HD21 1.0 . 5.32 1632 1407 A 23 ASN HBy A 24 ARG HGx 1.0 . 5.34 1633 1407 A 23 ASN HBy A 24 ARG HGy 1.0 . 5.34 1634 1408 A 23 ASN HBy A 61 GLN HE22 1.0 . 5.34 1635 1408 A 23 ASN HBy A 61 GLN HE21 1.0 . 5.34 1636 1409 A 24 ARG HA A 24 ARG HD2 1.0 . 4.49 1637 1409 A 24 ARG HA A 24 ARG HD3 1.0 . 4.49 1638 1410 A 24 ARG HB3 A 24 ARG HD2 1.0 . 2.82 1639 1410 A 24 ARG HB3 A 24 ARG HD3 1.0 . 2.82 1640 1411 A 25 LEU H A 25 LEU HBy 1.0 . 3.59 1641 1411 A 25 LEU H A 25 LEU HBx 1.0 . 3.59 1642 1412 A 25 LEU H A 25 LEU HDy% 1.0 . 4.06 1643 1412 A 25 LEU H A 25 LEU HDx% 1.0 . 4.06 1644 1413 A 25 LEU H A 46 LYS HG3 1.0 . 5.34 1645 1413 A 25 LEU H A 46 LYS HG2 1.0 . 5.34 1646 1414 A 25 LEU H A 46 LYS HD3 1.0 . 4.38 1647 1414 A 25 LEU H A 46 LYS HD2 1.0 . 4.38 1648 1415 A 25 LEU HA A 25 LEU HDy% 1.0 . 2.89 1649 1415 A 25 LEU HA A 25 LEU HDx% 1.0 . 2.89 1650 1416 A 25 LEU HBx A 25 LEU HDy% 1.0 . 2.72 1651 1416 A 25 LEU HDx% A 25 LEU HBy 1.0 . 2.72 1652 1416 A 25 LEU HDx% A 25 LEU HBx 1.0 . 2.72 1653 1416 A 25 LEU HBy A 25 LEU HDy% 1.0 . 2.72 1654 1417 A 26 GLN H A 25 LEU HBy 1.0 . 4.12 1655 1417 A 26 GLN H A 25 LEU HBx 1.0 . 4.12 1656 1418 A 46 LYS HA A 25 LEU HBy 1.0 . 4.54 1657 1418 A 46 LYS HA A 25 LEU HBx 1.0 . 4.54 1658 1419 A 25 LEU HBx A 46 LYS HE3 1.0 . 4.34 1659 1419 A 25 LEU HBy A 46 LYS HE3 1.0 . 4.34 1660 1419 A 46 LYS HE2 A 25 LEU HBy 1.0 . 4.34 1661 1419 A 25 LEU HBx A 46 LYS HE2 1.0 . 4.34 1662 1420 A 50 ILE HA A 25 LEU HBy 1.0 . 4.79 1663 1420 A 50 ILE HA A 25 LEU HBx 1.0 . 4.79 1664 1421 A 50 ILE HG1y A 25 LEU HBy 1.0 . 4.43 1665 1421 A 50 ILE HG1y A 25 LEU HBx 1.0 . 4.43 1666 1422 A 50 ILE HG1x A 25 LEU HBy 1.0 . 3.93 1667 1422 A 50 ILE HG1x A 25 LEU HBx 1.0 . 3.93 1668 1423 A 50 ILE HD1% A 25 LEU HBy 1.0 . 3.32 1669 1423 A 50 ILE HD1% A 25 LEU HBx 1.0 . 3.32 1670 1424 A 26 GLN H A 25 LEU HDy% 1.0 . 3.17 1671 1424 A 26 GLN H A 25 LEU HDx% 1.0 . 3.17 1672 1425 A 26 GLN HA A 25 LEU HDy% 1.0 . 3.61 1673 1425 A 26 GLN HA A 25 LEU HDx% 1.0 . 3.61 1674 1426 A 27 TYR HBy A 25 LEU HDy% 1.0 . 5.01 1675 1426 A 27 TYR HBy A 25 LEU HDx% 1.0 . 5.01 1676 1427 A 27 TYR HD% A 25 LEU HDy% 1.0 . 3.90 1677 1427 A 27 TYR HD% A 25 LEU HDx% 1.0 . 3.90 1678 1428 A 42 TRP HA A 25 LEU HDy% 1.0 . 4.71 1679 1428 A 42 TRP HA A 25 LEU HDx% 1.0 . 4.71 1680 1429 A 42 TRP HBy A 25 LEU HDy% 1.0 . 4.71 1681 1429 A 42 TRP HBy A 25 LEU HDx% 1.0 . 4.71 1682 1430 A 42 TRP HBx A 25 LEU HDy% 1.0 . 4.04 1683 1430 A 42 TRP HBx A 25 LEU HDx% 1.0 . 4.04 1684 1431 A 42 TRP HD1 A 25 LEU HDy% 1.0 . 5.44 1685 1431 A 42 TRP HD1 A 25 LEU HDx% 1.0 . 5.44 1686 1432 A 46 LYS H A 25 LEU HDy% 1.0 . 5.44 1687 1432 A 46 LYS H A 25 LEU HDx% 1.0 . 5.44 1688 1433 A 46 LYS HA A 25 LEU HDy% 1.0 . 3.24 1689 1433 A 46 LYS HA A 25 LEU HDx% 1.0 . 3.24 1690 1434 A 46 LYS HBy A 25 LEU HDy% 1.0 . 4.48 1691 1434 A 46 LYS HBy A 25 LEU HDx% 1.0 . 4.48 1692 1435 A 25 LEU HDy% A 46 LYS HG3 1.0 . 3.67 1693 1435 A 25 LEU HDx% A 46 LYS HG3 1.0 . 3.67 1694 1435 A 46 LYS HG2 A 25 LEU HDy% 1.0 . 3.67 1695 1435 A 25 LEU HDx% A 46 LYS HG2 1.0 . 3.67 1696 1436 A 25 LEU HDx% A 46 LYS HD3 1.0 . 3.91 1697 1436 A 25 LEU HDy% A 46 LYS HD3 1.0 . 3.91 1698 1436 A 46 LYS HD2 A 25 LEU HDy% 1.0 . 3.91 1699 1436 A 25 LEU HDx% A 46 LYS HD2 1.0 . 3.91 1700 1437 A 47 GLN H A 25 LEU HDy% 1.0 . 5.44 1701 1437 A 47 GLN H A 25 LEU HDx% 1.0 . 5.44 1702 1438 A 49 LEU HBy A 25 LEU HDy% 1.0 . 3.65 1703 1438 A 49 LEU HBy A 25 LEU HDx% 1.0 . 3.65 1704 1439 A 49 LEU HDx% A 25 LEU HDy% 1.0 . 3.64 1705 1439 A 49 LEU HDx% A 25 LEU HDx% 1.0 . 3.64 1706 1440 A 50 ILE H A 25 LEU HDy% 1.0 . 3.47 1707 1440 A 50 ILE H A 25 LEU HDx% 1.0 . 3.47 1708 1441 A 50 ILE HA A 25 LEU HDy% 1.0 . 5.07 1709 1441 A 50 ILE HA A 25 LEU HDx% 1.0 . 5.07 1710 1442 A 50 ILE HG1x A 25 LEU HDy% 1.0 . 3.73 1711 1442 A 50 ILE HG1x A 25 LEU HDx% 1.0 . 3.73 1712 1443 A 53 LEU HDy% A 25 LEU HDy% 1.0 . 3.92 1713 1443 A 53 LEU HDy% A 25 LEU HDx% 1.0 . 3.92 1714 1444 A 27 TYR HD% A 39 LEU HDy% 1.0 . 4.46 1715 1444 A 27 TYR HD% A 39 LEU HDx% 1.0 . 4.46 1716 1445 A 27 TYR HE% A 39 LEU HDy% 1.0 . 3.69 1717 1445 A 27 TYR HE% A 39 LEU HDx% 1.0 . 3.69 1718 1446 A 29 THR HG2% A 31 ARG HG3 1.0 . 3.90 1719 1446 A 29 THR HG2% A 31 ARG HG2 1.0 . 3.90 1720 1447 A 29 THR HG2% A 31 ARG HDy 1.0 . 4.41 1721 1447 A 29 THR HG2% A 31 ARG HDx 1.0 . 4.41 1722 1448 A 30 SER H A 31 ARG HG3 1.0 . 4.81 1723 1448 A 30 SER H A 31 ARG HG2 1.0 . 4.81 1724 1449 A 30 SER HB2 A 31 ARG HG3 1.0 . 4.76 1725 1449 A 31 ARG HG2 A 30 SER HB2 1.0 . 4.76 1726 1449 A 31 ARG HG2 A 30 SER HB3 1.0 . 4.76 1727 1449 A 30 SER HB3 A 31 ARG HG3 1.0 . 4.76 1728 1450 A 31 ARG H A 31 ARG HG3 1.0 . 3.09 1729 1450 A 31 ARG H A 31 ARG HG2 1.0 . 3.09 1730 1451 A 31 ARG H A 31 ARG HDy 1.0 . 5.34 1731 1451 A 31 ARG H A 31 ARG HDx 1.0 . 5.34 1732 1452 A 31 ARG HA A 31 ARG HG3 1.0 . 3.73 1733 1452 A 31 ARG HA A 31 ARG HG2 1.0 . 3.73 1734 1453 A 31 ARG HA A 31 ARG HDy 1.0 . 4.88 1735 1453 A 31 ARG HA A 31 ARG HDx 1.0 . 4.88 1736 1454 A 31 ARG HB2 A 31 ARG HDy 1.0 . 3.61 1737 1454 A 31 ARG HB3 A 31 ARG HDy 1.0 . 3.61 1738 1454 A 31 ARG HDx A 31 ARG HB2 1.0 . 3.61 1739 1454 A 31 ARG HB3 A 31 ARG HDx 1.0 . 3.61 1740 1455 A 34 ILE HD1% A 31 ARG HDy 1.0 . 4.86 1741 1455 A 34 ILE HD1% A 31 ARG HDx 1.0 . 4.86 1742 1456 A 34 ILE HA A 35 PRO HDx 1.0 . 3.21 1743 1456 A 34 ILE HA A 35 PRO HDy 1.0 . 3.21 1744 1457 A 34 ILE HG2% A 35 PRO HDx 1.0 . 3.28 1745 1457 A 34 ILE HG2% A 35 PRO HDy 1.0 . 3.28 1746 1458 A 34 ILE HG2% A 37 GLU HG2 1.0 . 5.34 1747 1458 A 34 ILE HG2% A 37 GLU HG3 1.0 . 5.34 1748 1459 A 34 ILE HG2% A 39 LEU HBx 1.0 . 3.95 1749 1459 A 34 ILE HG2% A 39 LEU HBy 1.0 . 3.95 1750 1460 A 34 ILE HG1x A 35 PRO HDx 1.0 . 5.35 1751 1460 A 34 ILE HG1x A 35 PRO HDy 1.0 . 5.35 1752 1461 A 35 PRO HB2 A 37 GLU HG2 1.0 . 4.21 1753 1461 A 35 PRO HB2 A 37 GLU HG3 1.0 . 4.21 1754 1462 A 35 PRO HB2 A 38 LEU HBy 1.0 . 5.34 1755 1462 A 35 PRO HB2 A 38 LEU HBx 1.0 . 5.34 1756 1463 A 35 PRO HB2 A 38 LEU HDy% 1.0 . 5.44 1757 1463 A 35 PRO HB2 A 38 LEU HDx% 1.0 . 5.44 1758 1464 A 35 PRO HB3 A 38 LEU HDy% 1.0 . 5.44 1759 1464 A 35 PRO HB3 A 38 LEU HDx% 1.0 . 5.44 1760 1465 A 35 PRO HGx A 38 LEU HDy% 1.0 . 3.91 1761 1465 A 35 PRO HGx A 38 LEU HDx% 1.0 . 3.91 1762 1466 A 35 PRO HGy A 38 LEU HDy% 1.0 . 3.87 1763 1466 A 35 PRO HGy A 38 LEU HDx% 1.0 . 3.87 1764 1467 A 36 THR H A 35 PRO HDx 1.0 . 4.96 1765 1467 A 36 THR H A 35 PRO HDy 1.0 . 4.96 1766 1468 A 35 PRO HDx A 38 LEU HDy% 1.0 . 4.18 1767 1468 A 35 PRO HDy A 38 LEU HDy% 1.0 . 4.18 1768 1468 A 38 LEU HDx% A 35 PRO HDx 1.0 . 4.18 1769 1468 A 38 LEU HDx% A 35 PRO HDy 1.0 . 4.18 1770 1469 A 36 THR HA A 39 LEU HBx 1.0 . 3.32 1771 1469 A 36 THR HA A 39 LEU HBy 1.0 . 3.32 1772 1470 A 36 THR HA A 39 LEU HDy% 1.0 . 3.23 1773 1470 A 36 THR HA A 39 LEU HDx% 1.0 . 3.23 1774 1471 A 40 ASN HD21 A 36 THR HB 1.0 . 5.34 1775 1471 A 40 ASN HD22 A 36 THR HB 1.0 . 5.34 1776 1472 A 36 THR HG2% A 40 ASN HD21 1.0 . 4.79 1777 1472 A 36 THR HG2% A 40 ASN HD22 1.0 . 4.79 1778 1473 A 37 GLU HA A 37 GLU HG2 1.0 . 3.49 1779 1473 A 37 GLU HA A 37 GLU HG3 1.0 . 3.49 1780 1474 A 37 GLU HA A 40 ASN HB2 1.0 . 3.54 1781 1474 A 37 GLU HA A 40 ASN HB3 1.0 . 3.54 1782 1475 A 38 LEU HA A 37 GLU HG2 1.0 . 4.54 1783 1475 A 38 LEU HA A 37 GLU HG3 1.0 . 4.54 1784 1476 A 38 LEU HG A 37 GLU HG2 1.0 . 5.34 1785 1476 A 38 LEU HG A 37 GLU HG3 1.0 . 5.34 1786 1477 A 38 LEU H A 38 LEU HDy% 1.0 . 4.14 1787 1477 A 38 LEU H A 38 LEU HDx% 1.0 . 4.14 1788 1478 A 38 LEU HA A 38 LEU HDy% 1.0 . 2.71 1789 1478 A 38 LEU HA A 38 LEU HDx% 1.0 . 2.71 1790 1479 A 38 LEU HA A 41 LYS HBx 1.0 . 3.14 1791 1479 A 38 LEU HA A 41 LYS HBy 1.0 . 3.14 1792 1480 A 42 TRP HZ2 A 38 LEU HBy 1.0 . 4.68 1793 1480 A 42 TRP HZ2 A 38 LEU HBx 1.0 . 4.68 1794 1481 A 39 LEU H A 38 LEU HDy% 1.0 . 4.68 1795 1481 A 39 LEU H A 38 LEU HDx% 1.0 . 4.68 1796 1482 A 38 LEU HDy% A 41 LYS HBx 1.0 . 3.47 1797 1482 A 38 LEU HDx% A 41 LYS HBx 1.0 . 3.47 1798 1482 A 41 LYS HBy A 38 LEU HDy% 1.0 . 3.47 1799 1482 A 41 LYS HBy A 38 LEU HDx% 1.0 . 3.47 1800 1483 A 38 LEU HDy% A 41 LYS HE2 1.0 . 3.56 1801 1483 A 38 LEU HDx% A 41 LYS HE2 1.0 . 3.56 1802 1483 A 41 LYS HE3 A 38 LEU HDy% 1.0 . 3.56 1803 1483 A 41 LYS HE3 A 38 LEU HDx% 1.0 . 3.56 1804 1484 A 42 TRP HE1 A 38 LEU HDy% 1.0 . 4.23 1805 1484 A 42 TRP HE1 A 38 LEU HDx% 1.0 . 4.23 1806 1485 A 42 TRP HZ2 A 38 LEU HDy% 1.0 . 4.46 1807 1485 A 42 TRP HZ2 A 38 LEU HDx% 1.0 . 4.46 1808 1486 A 42 TRP HH2 A 38 LEU HDy% 1.0 . 5.44 1809 1486 A 42 TRP HH2 A 38 LEU HDx% 1.0 . 5.44 1810 1487 A 39 LEU H A 39 LEU HBx 1.0 . 3.52 1811 1487 A 39 LEU H A 39 LEU HBy 1.0 . 3.52 1812 1488 A 39 LEU H A 39 LEU HDy% 1.0 . 4.95 1813 1488 A 39 LEU H A 39 LEU HDx% 1.0 . 4.95 1814 1489 A 39 LEU HA A 39 LEU HDy% 1.0 . 2.76 1815 1489 A 39 LEU HA A 39 LEU HDx% 1.0 . 2.76 1816 1490 A 40 ASN H A 39 LEU HBx 1.0 . 3.18 1817 1490 A 40 ASN H A 39 LEU HBy 1.0 . 3.18 1818 1491 A 40 ASN HD21 A 39 LEU HBx 1.0 . 5.18 1819 1491 A 40 ASN HD21 A 39 LEU HBy 1.0 . 5.18 1820 1491 A 40 ASN HD22 A 39 LEU HBx 1.0 . 5.18 1821 1491 A 40 ASN HD22 A 39 LEU HBy 1.0 . 5.18 1822 1492 A 42 TRP HBy A 39 LEU HDy% 1.0 . 5.44 1823 1492 A 42 TRP HBy A 39 LEU HDx% 1.0 . 5.44 1824 1493 A 42 TRP HE3 A 39 LEU HDy% 1.0 . 3.72 1825 1493 A 42 TRP HE3 A 39 LEU HDx% 1.0 . 3.72 1826 1494 A 42 TRP HZ3 A 39 LEU HDy% 1.0 . 4.05 1827 1494 A 42 TRP HZ3 A 39 LEU HDx% 1.0 . 4.05 1828 1495 A 42 TRP HH2 A 39 LEU HDy% 1.0 . 4.76 1829 1495 A 42 TRP HH2 A 39 LEU HDx% 1.0 . 4.76 1830 1496 A 39 LEU HDx% A 43 LYS HB3 1.0 . 5.23 1831 1496 A 39 LEU HDy% A 43 LYS HB3 1.0 . 5.23 1832 1496 A 43 LYS HB2 A 39 LEU HDy% 1.0 . 5.23 1833 1496 A 39 LEU HDx% A 43 LYS HB2 1.0 . 5.23 1834 1497 A 43 LYS HG3 A 39 LEU HDy% 1.0 . 5.44 1835 1497 A 43 LYS HG3 A 39 LEU HDx% 1.0 . 5.44 1836 1498 A 40 ASN H A 40 ASN HB2 1.0 . 3.62 1837 1498 A 40 ASN H A 40 ASN HB3 1.0 . 3.62 1838 1499 A 40 ASN H A 41 LYS HBx 1.0 . 5.34 1839 1499 A 40 ASN H A 41 LYS HBy 1.0 . 5.34 1840 1500 A 40 ASN H A 43 LYS HD3 1.0 . 5.27 1841 1500 A 40 ASN H A 43 LYS HD2 1.0 . 5.27 1842 1501 A 40 ASN HA A 43 LYS HD3 1.0 . 3.93 1843 1501 A 40 ASN HA A 43 LYS HD2 1.0 . 3.93 1844 1502 A 41 LYS H A 40 ASN HB2 1.0 . 3.83 1845 1502 A 41 LYS H A 40 ASN HB3 1.0 . 3.83 1846 1503 A 40 ASN HB2 A 41 LYS HBx 1.0 . 4.53 1847 1503 A 40 ASN HB3 A 41 LYS HBx 1.0 . 4.53 1848 1503 A 41 LYS HBy A 40 ASN HB2 1.0 . 4.53 1849 1503 A 41 LYS HBy A 40 ASN HB3 1.0 . 4.53 1850 1504 A 42 TRP HD1 A 41 LYS HBx 1.0 . 5.34 1851 1504 A 42 TRP HD1 A 41 LYS HBy 1.0 . 5.34 1852 1505 A 45 HIS HD2 A 41 LYS HBx 1.0 . 5.08 1853 1505 A 45 HIS HD2 A 41 LYS HBy 1.0 . 5.08 1854 1506 A 43 LYS H A 43 LYS HB3 1.0 . 3.07 1855 1506 A 43 LYS H A 43 LYS HB2 1.0 . 3.07 1856 1507 A 43 LYS HA A 43 LYS HB3 1.0 . 2.56 1857 1507 A 43 LYS HA A 43 LYS HB2 1.0 . 2.56 1858 1508 A 43 LYS HA A 46 LYS HG3 1.0 . 4.45 1859 1508 A 43 LYS HA A 46 LYS HG2 1.0 . 4.45 1860 1509 A 43 LYS HB3 A 43 LYS HD3 1.0 . 3.10 1861 1509 A 43 LYS HB2 A 43 LYS HD3 1.0 . 3.10 1862 1509 A 43 LYS HD2 A 43 LYS HB3 1.0 . 3.10 1863 1509 A 43 LYS HB2 A 43 LYS HD2 1.0 . 3.10 1864 1510 A 43 LYS HB3 A 43 LYS HE3 1.0 . 4.20 1865 1510 A 43 LYS HB2 A 43 LYS HE3 1.0 . 4.20 1866 1510 A 43 LYS HE2 A 43 LYS HB3 1.0 . 4.20 1867 1510 A 43 LYS HB2 A 43 LYS HE2 1.0 . 4.20 1868 1511 A 44 GLN H A 43 LYS HB3 1.0 . 3.67 1869 1511 A 44 GLN H A 43 LYS HB2 1.0 . 3.67 1870 1512 A 43 LYS HG3 A 43 LYS HE3 1.0 . 3.54 1871 1512 A 43 LYS HG3 A 43 LYS HE2 1.0 . 3.54 1872 1513 A 44 GLN HE21 A 44 GLN HA 1.0 . 4.85 1873 1513 A 44 GLN HE22 A 44 GLN HA 1.0 . 4.85 1874 1514 A 44 GLN HE21 A 44 GLN HGx 1.0 . 3.50 1875 1514 A 44 GLN HE22 A 44 GLN HGx 1.0 . 3.50 1876 1515 A 44 GLN HGy A 44 GLN HE21 1.0 . 3.48 1877 1515 A 44 GLN HGy A 44 GLN HE22 1.0 . 3.48 1878 1516 A 44 GLN HE21 A 45 HIS HE1 1.0 . 4.56 1879 1516 A 44 GLN HE22 A 45 HIS HE1 1.0 . 4.56 1880 1517 A 46 LYS H A 46 LYS HG3 1.0 . 4.59 1881 1517 A 46 LYS H A 46 LYS HG2 1.0 . 4.59 1882 1518 A 46 LYS HA A 46 LYS HG3 1.0 . 3.24 1883 1518 A 46 LYS HA A 46 LYS HG2 1.0 . 3.24 1884 1519 A 46 LYS HBy A 46 LYS HE3 1.0 . 4.60 1885 1519 A 46 LYS HBy A 46 LYS HE2 1.0 . 4.60 1886 1520 A 46 LYS HBx A 46 LYS HE3 1.0 . 4.47 1887 1520 A 46 LYS HBx A 46 LYS HE2 1.0 . 4.47 1888 1521 A 46 LYS HE2 A 46 LYS HG3 1.0 . 3.32 1889 1521 A 46 LYS HE3 A 46 LYS HG3 1.0 . 3.32 1890 1521 A 46 LYS HG2 A 46 LYS HE3 1.0 . 3.32 1891 1521 A 46 LYS HG2 A 46 LYS HE2 1.0 . 3.32 1892 1522 A 47 GLN H A 46 LYS HG3 1.0 . 4.33 1893 1522 A 47 GLN H A 46 LYS HG2 1.0 . 4.33 1894 1523 A 47 GLN HA A 46 LYS HG3 1.0 . 4.47 1895 1523 A 47 GLN HA A 46 LYS HG2 1.0 . 4.47 1896 1524 A 50 ILE HD1% A 46 LYS HG3 1.0 . 3.19 1897 1524 A 50 ILE HD1% A 46 LYS HG2 1.0 . 3.19 1898 1525 A 50 ILE HG2% A 61 GLN HE22 1.0 . 5.09 1899 1525 A 50 ILE HG2% A 61 GLN HE21 1.0 . 5.09 1900 1526 A 52 PHE HE% A 56 LEU HDy% 1.0 . 4.35 1901 1526 A 52 PHE HE% A 56 LEU HDx% 1.0 . 4.35 1902 1527 A 52 PHE HZ A 56 LEU HDy% 1.0 . 3.95 1903 1527 A 52 PHE HZ A 56 LEU HDx% 1.0 . 3.95 1904 1528 A 53 LEU H A 56 LEU HDy% 1.0 . 4.91 1905 1528 A 53 LEU H A 56 LEU HDx% 1.0 . 4.91 1906 1529 A 53 LEU HA A 56 LEU HBx 1.0 . 3.25 1907 1529 A 53 LEU HA A 56 LEU HBy 1.0 . 3.25 1908 1530 A 53 LEU HA A 56 LEU HDy% 1.0 . 3.45 1909 1530 A 53 LEU HA A 56 LEU HDx% 1.0 . 3.45 1910 1531 A 53 LEU HBy A 56 LEU HBx 1.0 . 4.64 1911 1531 A 53 LEU HBy A 56 LEU HBy 1.0 . 4.64 1912 1532 A 53 LEU HDx% A 56 LEU HDy% 1.0 . 4.42 1913 1532 A 53 LEU HDx% A 56 LEU HDx% 1.0 . 4.42 1914 1533 A 55 GLN H A 56 LEU HBx 1.0 . 4.60 1915 1533 A 55 GLN H A 56 LEU HBy 1.0 . 4.60 1916 1534 A 55 GLN HA A 58 SER HBy 1.0 . 3.94 1917 1534 A 55 GLN HA A 58 SER HBx 1.0 . 3.94 1918 1535 A 55 GLN HE21 A 56 LEU HBx 1.0 . 5.34 1919 1535 A 55 GLN HE21 A 56 LEU HBy 1.0 . 5.34 1920 1536 A 55 GLN HE22 A 56 LEU HDy% 1.0 . 3.60 1921 1536 A 56 LEU HDx% A 55 GLN HE22 1.0 . 3.60 1922 1537 A 56 LEU H A 56 LEU HBx 1.0 . 2.54 1923 1537 A 56 LEU H A 56 LEU HBy 1.0 . 2.54 1924 1538 A 56 LEU H A 56 LEU HDy% 1.0 . 3.83 1925 1538 A 56 LEU H A 56 LEU HDx% 1.0 . 3.83 1926 1539 A 56 LEU HA A 56 LEU HDy% 1.0 . 2.73 1927 1539 A 56 LEU HA A 56 LEU HDx% 1.0 . 2.73 1928 1540 A 56 LEU HBx A 56 LEU HDy% 1.0 . 2.55 1929 1540 A 56 LEU HBy A 56 LEU HDy% 1.0 . 2.55 1930 1540 A 56 LEU HDx% A 56 LEU HBx 1.0 . 2.55 1931 1540 A 56 LEU HDx% A 56 LEU HBy 1.0 . 2.55 1932 1541 A 57 ASP H A 56 LEU HBx 1.0 . 3.32 1933 1541 A 57 ASP H A 56 LEU HBy 1.0 . 3.32 1934 1542 A 58 SER H A 56 LEU HBx 1.0 . 5.16 1935 1542 A 58 SER H A 56 LEU HBy 1.0 . 5.16 1936 1543 A 57 ASP H A 56 LEU HDy% 1.0 . 4.03 1937 1543 A 57 ASP H A 56 LEU HDx% 1.0 . 4.03 1938 1544 A 57 ASP HA A 56 LEU HDy% 1.0 . 4.50 1939 1544 A 57 ASP HA A 56 LEU HDx% 1.0 . 4.50 1940 1545 A 57 ASP HBy A 56 LEU HDy% 1.0 . 4.74 1941 1545 A 57 ASP HBy A 56 LEU HDx% 1.0 . 4.74 1942 1546 A 58 SER H A 58 SER HBy 1.0 . 3.03 1943 1546 A 58 SER H A 58 SER HBx 1.0 . 3.03 1944 1547 A 58 SER HA A 58 SER HBy 1.0 . 2.56 1945 1547 A 58 SER HA A 58 SER HBx 1.0 . 2.56 1946 1548 A 59 GLU H A 58 SER HBy 1.0 . 3.71 1947 1548 A 59 GLU H A 58 SER HBx 1.0 . 3.71 1948 1549 A 60 GLU H A 58 SER HBy 1.0 . 4.93 1949 1549 A 60 GLU H A 58 SER HBx 1.0 . 4.93 1950 1550 A 59 GLU H A 59 GLU HBy 1.0 . 2.90 1951 1550 A 59 GLU H A 59 GLU HBx 1.0 . 2.90 1952 1551 A 59 GLU H A 59 GLU HGy 1.0 . 3.48 1953 1551 A 59 GLU H A 59 GLU HGx 1.0 . 3.48 1954 1552 A 59 GLU HBy A 59 GLU HGy 1.0 . 2.34 1955 1552 A 59 GLU HBx A 59 GLU HGy 1.0 . 2.34 1956 1552 A 59 GLU HGx A 59 GLU HBy 1.0 . 2.34 1957 1552 A 59 GLU HBx A 59 GLU HGx 1.0 . 2.34 1958 1553 A 60 GLU H A 59 GLU HGy 1.0 . 5.22 1959 1553 A 60 GLU H A 59 GLU HGx 1.0 . 5.22 1960 1554 A 60 GLU HA A 59 GLU HGy 1.0 . 5.06 1961 1554 A 60 GLU HA A 59 GLU HGx 1.0 . 5.06 1962 1555 A 60 GLU H A 60 GLU HBy 1.0 . 3.20 1963 1555 A 60 GLU H A 60 GLU HBx 1.0 . 3.20 1964 1556 A 61 GLN H A 61 GLN HBx 1.0 . 3.00 1965 1556 A 61 GLN H A 61 GLN HBy 1.0 . 3.00 1966 1557 A 62 THR H A 63 LYS HG3 1.0 . 5.34 1967 1557 A 62 THR H A 63 LYS HG2 1.0 . 5.34 1968 1558 A 63 LYS H A 63 LYS HBy 1.0 . 3.54 1969 1558 A 63 LYS H A 63 LYS HBx 1.0 . 3.54 1970 1559 A 63 LYS H A 63 LYS HG3 1.0 . 4.46 1971 1559 A 63 LYS H A 63 LYS HG2 1.0 . 4.46 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 1 GLY C A 2 ILE N A 2 ILE CA A 2 ILE C 1.0 -128.7 -63.4 PHI 2 2 A 2 ILE N A 2 ILE CA A 2 ILE C A 3 ASP N 1.0 114.6 170.4 PSI 3 3 A 2 ILE C A 3 ASP N A 3 ASP CA A 3 ASP C 1.0 -102.2 -57.3 PHI 4 4 A 3 ASP N A 3 ASP CA A 3 ASP C A 4 ALA N 1.0 71.6 189.1 PSI 5 5 A 3 ASP C A 4 ALA N A 4 ALA CA A 4 ALA C 1.0 -73.9 -52.4 PHI 6 6 A 4 ALA N A 4 ALA CA A 4 ALA C A 5 ALA N 1.0 -48.5 -20.0 PSI 7 7 A 4 ALA C A 5 ALA N A 5 ALA CA A 5 ALA C 1.0 -73.0 -53.0 PHI 8 8 A 5 ALA N A 5 ALA CA A 5 ALA C A 6 GLN N 1.0 -50.5 -29.0 PSI 9 9 A 5 ALA C A 6 GLN N A 6 GLN CA A 6 GLN C 1.0 -78.2 -58.2 PHI 10 10 A 6 GLN N A 6 GLN CA A 6 GLN C A 7 ILE N 1.0 -48.8 -28.8 PSI 11 11 A 6 GLN C A 7 ILE N A 7 ILE CA A 7 ILE C 1.0 -75.4 -55.4 PHI 12 12 A 7 ILE N A 7 ILE CA A 7 ILE C A 8 VAL N 1.0 -52.1 -32.1 PSI 13 13 A 7 ILE C A 8 VAL N A 8 VAL CA A 8 VAL C 1.0 -75.0 -55.0 PHI 14 14 A 8 VAL N A 8 VAL CA A 8 VAL C A 9 ASP N 1.0 -51.5 -31.5 PSI 15 15 A 8 VAL C A 9 ASP N A 9 ASP CA A 9 ASP C 1.0 -74.3 -54.3 PHI 16 16 A 9 ASP N A 9 ASP CA A 9 ASP C A 10 GLU N 1.0 -48.6 -28.6 PSI 17 17 A 9 ASP C A 10 GLU N A 10 GLU CA A 10 GLU C 1.0 -75.0 -55.0 PHI 18 18 A 10 GLU N A 10 GLU CA A 10 GLU C A 11 ALA N 1.0 -52.0 -32.0 PSI 19 19 A 10 GLU C A 11 ALA N A 11 ALA CA A 11 ALA C 1.0 -74.1 -54.1 PHI 20 20 A 11 ALA N A 11 ALA CA A 11 ALA C A 12 LEU N 1.0 -50.6 -30.6 PSI 21 21 A 11 ALA C A 12 LEU N A 12 LEU CA A 12 LEU C 1.0 -74.9 -54.9 PHI 22 22 A 12 LEU N A 12 LEU CA A 12 LEU C A 13 GLU N 1.0 -48.7 -28.7 PSI 23 23 A 12 LEU C A 13 GLU N A 13 GLU CA A 13 GLU C 1.0 -75.1 -55.1 PHI 24 24 A 13 GLU N A 13 GLU CA A 13 GLU C A 14 GLN N 1.0 -35.5 -15.5 PSI 25 25 A 13 GLU C A 14 GLN N A 14 GLN CA A 14 GLN C 1.0 -107.3 -82.0 PHI 26 26 A 14 GLN N A 14 GLN CA A 14 GLN C A 15 GLY N 1.0 -5.3 15.5 PSI 27 27 A 14 GLN C A 15 GLY N A 15 GLY CA A 15 GLY C 1.0 64.8 92.3 PHI 28 28 A 15 GLY N A 15 GLY CA A 15 GLY C A 16 ILE N 1.0 9.9 33.4 PSI 29 29 A 15 GLY C A 16 ILE N A 16 ILE CA A 16 ILE C 1.0 -121.9 -92.2 PHI 30 30 A 16 ILE N A 16 ILE CA A 16 ILE C A 17 THR N 1.0 116.9 137.0 PSI 31 31 A 16 ILE C A 17 THR N A 17 THR CA A 17 THR C 1.0 -118.5 -54.5 PHI 32 32 A 17 THR N A 17 THR CA A 17 THR C A 18 LEU N 1.0 106.1 144.9 PSI 33 33 A 17 THR C A 18 LEU N A 18 LEU CA A 18 LEU C 1.0 -140.3 -85.3 PHI 34 34 A 18 LEU N A 18 LEU CA A 18 LEU C A 19 PHE N 1.0 112.5 151.5 PSI 35 35 A 18 LEU C A 19 PHE N A 19 PHE CA A 19 PHE C 1.0 -181.7 -129.0 PHI 36 36 A 19 PHE N A 19 PHE CA A 19 PHE C A 20 VAL N 1.0 148.3 181.1 PSI 37 37 A 19 PHE C A 20 VAL N A 20 VAL CA A 20 VAL C 1.0 -136.9 -87.8 PHI 38 38 A 20 VAL N A 20 VAL CA A 20 VAL C A 21 VAL N 1.0 113.1 145.7 PSI 39 39 A 20 VAL C A 21 VAL N A 21 VAL CA A 21 VAL C 1.0 -144.5 -112.0 PHI 40 40 A 21 VAL N A 21 VAL CA A 21 VAL C A 22 ASN N 1.0 110.3 135.9 PSI 41 41 A 21 VAL C A 22 ASN N A 22 ASN CA A 22 ASN C 1.0 41.9 61.9 PHI 42 42 A 22 ASN N A 22 ASN CA A 22 ASN C A 23 ASN N 1.0 35.0 55.6 PSI 43 43 A 22 ASN C A 23 ASN N A 23 ASN CA A 23 ASN C 1.0 55.4 75.4 PHI 44 44 A 23 ASN N A 23 ASN CA A 23 ASN C A 24 ARG N 1.0 9.9 35.2 PSI 45 45 A 23 ASN C A 24 ARG N A 24 ARG CA A 24 ARG C 1.0 -147.9 -103.0 PHI 46 46 A 24 ARG N A 24 ARG CA A 24 ARG C A 25 LEU N 1.0 123.4 157.4 PSI 47 47 A 24 ARG C A 25 LEU N A 25 LEU CA A 25 LEU C 1.0 -104.4 -67.9 PHI 48 48 A 25 LEU N A 25 LEU CA A 25 LEU C A 26 GLN N 1.0 115.1 136.1 PSI 49 49 A 25 LEU C A 26 GLN N A 26 GLN CA A 26 GLN C 1.0 -152.2 -99.8 PHI 50 50 A 26 GLN N A 26 GLN CA A 26 GLN C A 27 TYR N 1.0 130.6 174.5 PSI 51 51 A 26 GLN C A 27 TYR N A 27 TYR CA A 27 TYR C 1.0 -163.0 -114.8 PHI 52 52 A 27 TYR N A 27 TYR CA A 27 TYR C A 28 GLU N 1.0 135.9 167.0 PSI 53 53 A 27 TYR C A 28 GLU N A 28 GLU CA A 28 GLU C 1.0 -153.0 -105.9 PHI 54 54 A 28 GLU N A 28 GLU CA A 28 GLU C A 29 THR N 1.0 122.2 161.7 PSI 55 55 A 28 GLU C A 29 THR N A 29 THR CA A 29 THR C 1.0 -143.1 -86.0 PHI 56 56 A 29 THR N A 29 THR CA A 29 THR C A 30 SER N 1.0 112.2 150.9 PSI 57 57 A 29 THR C A 30 SER N A 30 SER CA A 30 SER C 1.0 -131.2 -56.5 PHI 58 58 A 30 SER N A 30 SER CA A 30 SER C A 31 ARG N 1.0 108.9 158.6 PSI 59 59 A 32 ASP C A 33 SER N A 33 SER CA A 33 SER C 1.0 42.9 75.8 PHI 60 60 A 33 SER N A 33 SER CA A 33 SER C A 34 ILE N 1.0 11.6 59.6 PSI 61 61 A 33 SER C A 34 ILE N A 34 ILE CA A 34 ILE C 1.0 -133.0 -63.7 PHI 62 62 A 34 ILE N A 34 ILE CA A 34 ILE C A 35 PRO N 1.0 109.3 153.3 PSI 63 63 A 35 PRO C A 36 THR N A 36 THR CA A 36 THR C 1.0 -70.1 -50.1 PHI 64 64 A 36 THR N A 36 THR CA A 36 THR C A 37 GLU N 1.0 -47.9 -27.0 PSI 65 65 A 36 THR C A 37 GLU N A 37 GLU CA A 37 GLU C 1.0 -73.8 -53.8 PHI 66 66 A 37 GLU N A 37 GLU CA A 37 GLU C A 38 LEU N 1.0 -41.9 -21.9 PSI 67 67 A 37 GLU C A 38 LEU N A 38 LEU CA A 38 LEU C 1.0 -82.1 -62.1 PHI 68 68 A 38 LEU N A 38 LEU CA A 38 LEU C A 39 LEU N 1.0 -52.5 -29.9 PSI 69 69 A 38 LEU C A 39 LEU N A 39 LEU CA A 39 LEU C 1.0 -75.1 -54.8 PHI 70 70 A 39 LEU N A 39 LEU CA A 39 LEU C A 40 ASN N 1.0 -52.3 -28.6 PSI 71 71 A 39 LEU C A 40 ASN N A 40 ASN CA A 40 ASN C 1.0 -74.7 -54.7 PHI 72 72 A 40 ASN N A 40 ASN CA A 40 ASN C A 41 LYS N 1.0 -52.1 -25.2 PSI 73 73 A 40 ASN C A 41 LYS N A 41 LYS CA A 41 LYS C 1.0 -81.0 -57.9 PHI 74 74 A 41 LYS N A 41 LYS CA A 41 LYS C A 42 TRP N 1.0 -49.1 -26.4 PSI 75 75 A 41 LYS C A 42 TRP N A 42 TRP CA A 42 TRP C 1.0 -72.9 -52.9 PHI 76 76 A 42 TRP N A 42 TRP CA A 42 TRP C A 43 LYS N 1.0 -51.0 -27.5 PSI 77 77 A 42 TRP C A 43 LYS N A 43 LYS CA A 43 LYS C 1.0 -76.4 -54.8 PHI 78 78 A 43 LYS N A 43 LYS CA A 43 LYS C A 44 GLN N 1.0 -47.2 -19.1 PSI 79 79 A 43 LYS C A 44 GLN N A 44 GLN CA A 44 GLN C 1.0 -80.6 -53.4 PHI 80 80 A 44 GLN N A 44 GLN CA A 44 GLN C A 45 HIS N 1.0 -45.6 -6.0 PSI 81 81 A 44 GLN C A 45 HIS N A 45 HIS CA A 45 HIS C 1.0 -128.7 -97.9 PHI 82 82 A 45 HIS N A 45 HIS CA A 45 HIS C A 46 LYS N 1.0 11.1 39.2 PSI 83 83 A 45 HIS C A 46 LYS N A 46 LYS CA A 46 LYS C 1.0 -66.5 -46.5 PHI 84 84 A 46 LYS N A 46 LYS CA A 46 LYS C A 47 GLN N 1.0 -54.4 -34.4 PSI 85 85 A 46 LYS C A 47 GLN N A 47 GLN CA A 47 GLN C 1.0 -72.2 -52.2 PHI 86 86 A 47 GLN N A 47 GLN CA A 47 GLN C A 48 GLU N 1.0 -57.6 -26.2 PSI 87 87 A 47 GLN C A 48 GLU N A 48 GLU CA A 48 GLU C 1.0 -75.8 -55.8 PHI 88 88 A 48 GLU N A 48 GLU CA A 48 GLU C A 49 LEU N 1.0 -48.9 -28.9 PSI 89 89 A 48 GLU C A 49 LEU N A 49 LEU CA A 49 LEU C 1.0 -76.2 -56.2 PHI 90 90 A 49 LEU N A 49 LEU CA A 49 LEU C A 50 ILE N 1.0 -51.3 -31.3 PSI 91 91 A 49 LEU C A 50 ILE N A 50 ILE CA A 50 ILE C 1.0 -72.9 -52.9 PHI 92 92 A 50 ILE N A 50 ILE CA A 50 ILE C A 51 ASP N 1.0 -53.8 -33.8 PSI 93 93 A 50 ILE C A 51 ASP N A 51 ASP CA A 51 ASP C 1.0 -74.8 -54.8 PHI 94 94 A 51 ASP N A 51 ASP CA A 51 ASP C A 52 PHE N 1.0 -47.6 -27.6 PSI 95 95 A 51 ASP C A 52 PHE N A 52 PHE CA A 52 PHE C 1.0 -76.8 -56.8 PHI 96 96 A 52 PHE N A 52 PHE CA A 52 PHE C A 53 LEU N 1.0 -54.1 -34.1 PSI 97 97 A 52 PHE C A 53 LEU N A 53 LEU CA A 53 LEU C 1.0 -74.9 -54.7 PHI 98 98 A 53 LEU N A 53 LEU CA A 53 LEU C A 54 ASN N 1.0 -49.8 -23.3 PSI 99 99 A 53 LEU C A 54 ASN N A 54 ASN CA A 54 ASN C 1.0 -77.6 -57.3 PHI 100 100 A 54 ASN N A 54 ASN CA A 54 ASN C A 55 GLN N 1.0 -46.1 -7.8 PSI 101 101 A 54 ASN C A 55 GLN N A 55 GLN CA A 55 GLN C 1.0 -86.3 -60.7 PHI 102 102 A 55 GLN N A 55 GLN CA A 55 GLN C A 56 LEU N 1.0 -46.5 -0.2 PSI 103 103 A 55 GLN C A 56 LEU N A 56 LEU CA A 56 LEU C 1.0 -80.4 -55.1 PHI 104 104 A 56 LEU N A 56 LEU CA A 56 LEU C A 57 ASP N 1.0 -38.8 -7.3 PSI 105 105 A 56 LEU C A 57 ASP N A 57 ASP CA A 57 ASP C 1.0 -109.7 -67.4 PHI 106 106 A 57 ASP N A 57 ASP CA A 57 ASP C A 58 SER N 1.0 -27.7 18.7 PSI stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 3 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 14.0261 . . . . 2 ppm . . 61.9742 . . . . 3 ppm . . 12.0746 . . . . stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 3 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 14.0261 . . . . 2 ppm . . 28.0761 . . . . 3 ppm . . 12.0746 . . . . stop_ save_ save_spectral_peak_list_3 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_3 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 3 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 16.0288 . . . . 2 ppm . . 26.0275 . . . . 3 ppm . . 13.0234 . . . . stop_ save_