data_nef_c19845_2mm4 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2MM4 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 8 GLU start . . 2 A 9 THR middle . . 3 A 10 GLY middle . false 4 A 11 THR middle . . 5 A 12 LEU middle . . 6 A 13 ILE middle . . 7 A 14 VAL middle . . 8 A 15 ASN middle . . 9 A 16 SER middle . . 10 A 17 VAL middle . . 11 A 18 LEU middle . . 12 A 19 LEU middle . . 13 A 20 PHE middle . . 14 A 21 LEU middle . . 15 A 22 ALA middle . . 16 A 23 PHE middle . . 17 A 24 VAL middle . . 18 A 25 VAL middle . . 19 A 26 PHE middle . . 20 A 27 LEU middle . . 21 A 28 LEU middle . . 22 A 29 VAL middle . . 23 A 30 THR middle . . 24 A 31 LEU middle . . 25 A 32 ALA middle . . 26 A 33 ILE middle . . 27 A 34 LEU middle . . 28 A 35 THR middle . . 29 A 36 ALA middle . . 30 A 37 LEU middle . . 31 A 38 ARG middle . . 32 A 39 LEU middle . . 33 A 40 ALA middle . . 34 A 41 ALA middle . . 35 A 42 TYR middle . . 36 A 43 ALA middle . . 37 A 44 ALA middle . . 38 A 45 ASN middle . . 39 A 46 ILE middle . . 40 A 47 VAL middle . . 41 A 48 ASN middle . . 42 A 49 VAL middle . . 43 A 50 SER middle . . 44 A 51 LEU middle . . 45 A 52 VAL middle . . 46 A 53 LYS middle . . 47 A 54 PRO middle . false 48 A 55 THR middle . . 49 A 56 VAL middle . . 50 A 57 TYR middle . . 51 A 58 VAL middle . . 52 A 59 TYR middle . . 53 A 60 SER middle . . 54 A 61 ARG middle . . 55 A 62 VAL middle . . 56 A 63 LYS middle . . 57 A 64 ASN middle . . 58 A 65 LEU end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 8 GLU H1 H 1 8.117 0.020 A 8 GLU HA H 1 4.294 0.020 A 8 GLU HBy H 1 2.062 0.020 A 8 GLU HBx H 1 1.950 0.020 A 8 GLU HGy H 1 2.308 0.020 A 8 GLU HGx H 1 2.253 0.020 A 8 GLU C C 13 174.138 0.300 A 8 GLU CA C 13 56.779 0.300 A 8 GLU CB C 13 29.545 0.300 A 8 GLU CG C 13 34.845 0.300 A 8 GLU N N 15 120.937 0.300 A 9 THR H H 1 7.930 0.020 A 9 THR HA H 1 4.213 0.020 A 9 THR HB H 1 4.217 0.020 A 9 THR HG2% H 1 1.174 0.020 A 9 THR C C 13 172.757 0.300 A 9 THR CA C 13 62.810 0.300 A 9 THR CB C 13 69.878 0.300 A 9 THR CG2 C 13 21.852 0.300 A 9 THR N N 15 113.692 0.300 A 10 GLY H H 1 8.266 0.020 A 10 GLY HAy H 1 4.011 0.020 A 10 GLY HAx H 1 3.903 0.020 A 10 GLY C C 13 171.923 0.300 A 10 GLY CA C 13 46.099 0.300 A 10 GLY N N 15 110.842 0.300 A 11 THR H H 1 7.753 0.020 A 11 THR HA H 1 4.220 0.020 A 11 THR HB H 1 4.217 0.020 A 11 THR HG2% H 1 1.147 0.020 A 11 THR C C 13 171.906 0.300 A 11 THR CA C 13 62.721 0.300 A 11 THR CB C 13 69.549 0.300 A 11 THR CG2 C 13 22.103 0.300 A 11 THR N N 15 113.754 0.300 A 12 LEU H H 1 7.980 0.020 A 12 LEU HA H 1 4.240 0.020 A 12 LEU HBy H 1 1.660 0.020 A 12 LEU HBx H 1 1.495 0.020 A 12 LEU HDx% H 1 0.877 0.020 A 12 LEU HDy% H 1 0.835 0.020 A 12 LEU HG H 1 1.571 0.020 A 12 LEU C C 13 175.221 0.300 A 12 LEU CA C 13 56.799 0.300 A 12 LEU CB C 13 42.536 0.300 A 12 LEU CDy C 13 25.111 0.300 A 12 LEU CDx C 13 25.000 0.300 A 12 LEU CG C 13 27.295 0.300 A 12 LEU N N 15 123.669 0.300 A 13 ILE H H 1 7.861 0.020 A 13 ILE HA H 1 3.913 0.020 A 13 ILE HB H 1 1.880 0.020 A 13 ILE HD1% H 1 0.796 0.020 A 13 ILE HG1y H 1 1.511 0.020 A 13 ILE HG1x H 1 1.084 0.020 A 13 ILE HG2% H 1 0.826 0.020 A 13 ILE C C 13 173.425 0.300 A 13 ILE CA C 13 62.889 0.300 A 13 ILE CB C 13 38.249 0.300 A 13 ILE CD1 C 13 13.103 0.300 A 13 ILE CG1 C 13 28.368 0.300 A 13 ILE CG2 C 13 17.524 0.300 A 13 ILE N N 15 120.086 0.300 A 14 VAL H H 1 7.549 0.020 A 14 VAL HA H 1 3.790 0.020 A 14 VAL HB H 1 2.050 0.020 A 14 VAL HGx% H 1 0.871 0.020 A 14 VAL HGy% H 1 0.934 0.020 A 14 VAL C C 13 173.429 0.300 A 14 VAL CA C 13 64.409 0.300 A 14 VAL CB C 13 32.007 0.300 A 14 VAL CGx C 13 21.232 0.300 A 14 VAL CGy C 13 21.830 0.300 A 14 VAL N N 15 119.785 0.300 A 15 ASN H H 1 8.010 0.020 A 15 ASN HA H 1 4.549 0.020 A 15 ASN HBy H 1 2.860 0.020 A 15 ASN HBx H 1 2.703 0.020 A 15 ASN HD2y H 1 7.439 0.020 A 15 ASN HD2x H 1 6.733 0.020 A 15 ASN C C 13 173.619 0.300 A 15 ASN CA C 13 54.805 0.300 A 15 ASN CB C 13 38.824 0.300 A 15 ASN N N 15 119.567 0.300 A 15 ASN ND2 N 15 113.209 0.300 A 16 SER H H 1 8.039 0.020 A 16 SER HA H 1 4.177 0.020 A 16 SER HBx H 1 3.795 0.020 A 16 SER HBy H 1 3.795 0.020 A 16 SER CA C 13 61.705 0.300 A 16 SER CB C 13 63.752 0.300 A 16 SER N N 15 116.730 0.300 A 17 VAL H H 1 7.896 0.020 A 17 VAL HA H 1 3.677 0.020 A 17 VAL HB H 1 2.185 0.020 A 17 VAL HGx% H 1 1.019 0.020 A 17 VAL HGy% H 1 0.937 0.020 A 17 VAL C C 13 174.474 0.300 A 17 VAL CA C 13 66.671 0.300 A 17 VAL CB C 13 31.531 0.300 A 17 VAL CGy C 13 23.154 0.300 A 17 VAL CGx C 13 21.471 0.300 A 17 VAL N N 15 122.062 0.300 A 18 LEU H H 1 7.857 0.020 A 18 LEU HA H 1 3.998 0.020 A 18 LEU HBy H 1 1.867 0.020 A 18 LEU HBx H 1 1.472 0.020 A 18 LEU HDx% H 1 0.915 0.020 A 18 LEU HDy% H 1 0.841 0.020 A 18 LEU HG H 1 1.802 0.020 A 18 LEU C C 13 175.511 0.300 A 18 LEU CA C 13 58.107 0.300 A 18 LEU CB C 13 41.593 0.300 A 18 LEU CDy C 13 25.612 0.300 A 18 LEU CDx C 13 23.558 0.300 A 18 LEU CG C 13 27.220 0.300 A 18 LEU N N 15 119.103 0.300 A 19 LEU H H 1 7.745 0.020 A 19 LEU HA H 1 4.152 0.020 A 19 LEU HBy H 1 1.750 0.020 A 19 LEU HBx H 1 1.569 0.020 A 19 LEU HDx% H 1 0.849 0.020 A 19 LEU HG H 1 1.663 0.020 A 19 LEU C C 13 175.156 0.300 A 19 LEU CA C 13 58.011 0.300 A 19 LEU CB C 13 42.027 0.300 A 19 LEU CDx C 13 25.040 0.300 A 19 LEU CG C 13 27.218 0.300 A 19 LEU N N 15 118.291 0.300 A 20 PHE H H 1 8.002 0.020 A 20 PHE HA H 1 4.188 0.020 A 20 PHE HBy H 1 3.239 0.020 A 20 PHE HBx H 1 3.134 0.020 A 20 PHE HDx H 1 7.032 0.020 A 20 PHE HDy H 1 7.032 0.020 A 20 PHE HEx H 1 6.965 0.020 A 20 PHE HEy H 1 6.965 0.020 A 20 PHE C C 13 174.260 0.300 A 20 PHE CA C 13 61.626 0.300 A 20 PHE CB C 13 38.643 0.300 A 20 PHE CDx C 13 131.983 0.300 A 20 PHE CEx C 13 131.000 0.300 A 20 PHE N N 15 118.415 0.300 A 21 LEU H H 1 8.456 0.020 A 21 LEU HA H 1 3.797 0.020 A 21 LEU HBy H 1 1.885 0.020 A 21 LEU HBx H 1 1.783 0.020 A 21 LEU HDx% H 1 0.808 0.020 A 21 LEU HDy% H 1 0.789 0.020 A 21 LEU HG H 1 1.928 0.020 A 21 LEU C C 13 175.324 0.300 A 21 LEU CA C 13 58.128 0.300 A 21 LEU CB C 13 41.957 0.300 A 21 LEU CDy C 13 23.474 0.300 A 21 LEU CDx C 13 23.192 0.300 A 21 LEU CG C 13 26.796 0.300 A 21 LEU N N 15 118.571 0.300 A 22 ALA H H 1 8.353 0.020 A 22 ALA HA H 1 3.779 0.020 A 22 ALA HB% H 1 1.405 0.020 A 22 ALA C C 13 175.697 0.300 A 22 ALA CA C 13 55.721 0.300 A 22 ALA CB C 13 17.788 0.300 A 22 ALA N N 15 120.775 0.300 A 23 PHE H H 1 8.121 0.020 A 23 PHE HA H 1 4.108 0.020 A 23 PHE HBy H 1 3.215 0.020 A 23 PHE HBx H 1 3.078 0.020 A 23 PHE HDx H 1 6.951 0.020 A 23 PHE HDy H 1 6.951 0.020 A 23 PHE HEx H 1 6.985 0.020 A 23 PHE HEy H 1 6.985 0.020 A 23 PHE C C 13 173.859 0.300 A 23 PHE CA C 13 61.271 0.300 A 23 PHE CB C 13 38.853 0.300 A 23 PHE CDy C 13 131.456 0.300 A 23 PHE CEy C 13 129.290 0.300 A 23 PHE N N 15 117.860 0.300 A 24 VAL H H 1 8.124 0.020 A 24 VAL HA H 1 3.134 0.020 A 24 VAL HB H 1 2.031 0.020 A 24 VAL HGx% H 1 0.677 0.020 A 24 VAL HGy% H 1 0.596 0.020 A 24 VAL C C 13 174.684 0.300 A 24 VAL CA C 13 67.419 0.300 A 24 VAL CB C 13 31.106 0.300 A 24 VAL CGx C 13 21.279 0.300 A 24 VAL CGy C 13 23.299 0.300 A 24 VAL N N 15 119.181 0.300 A 25 VAL H H 1 8.250 0.020 A 25 VAL HA H 1 3.324 0.020 A 25 VAL HB H 1 2.107 0.020 A 25 VAL HGx% H 1 0.727 0.020 A 25 VAL HGy% H 1 0.897 0.020 A 25 VAL C C 13 174.244 0.300 A 25 VAL CA C 13 67.740 0.300 A 25 VAL CB C 13 31.270 0.300 A 25 VAL CGx C 13 21.660 0.300 A 25 VAL CGy C 13 23.520 0.300 A 25 VAL N N 15 119.215 0.300 A 26 PHE H H 1 8.413 0.020 A 26 PHE HA H 1 3.900 0.020 A 26 PHE HBy H 1 3.132 0.020 A 26 PHE HBx H 1 2.997 0.020 A 26 PHE HDx H 1 6.833 0.020 A 26 PHE HDy H 1 6.833 0.020 A 26 PHE HEx H 1 6.856 0.020 A 26 PHE HEy H 1 6.856 0.020 A 26 PHE C C 13 175.371 0.300 A 26 PHE CA C 13 61.651 0.300 A 26 PHE CB C 13 38.760 0.300 A 26 PHE CDy C 13 132.001 0.300 A 26 PHE N N 15 119.875 0.300 A 27 LEU H H 1 8.453 0.020 A 27 LEU HA H 1 3.533 0.020 A 27 LEU HBy H 1 1.433 0.020 A 27 LEU HBx H 1 1.337 0.020 A 27 LEU HDx% H 1 0.574 0.020 A 27 LEU HDy% H 1 0.610 0.020 A 27 LEU HG H 1 1.385 0.020 A 27 LEU C C 13 175.256 0.300 A 27 LEU CA C 13 58.211 0.300 A 27 LEU CB C 13 41.564 0.300 A 27 LEU CDy C 13 24.562 0.300 A 27 LEU CDx C 13 24.053 0.300 A 27 LEU CG C 13 26.437 0.300 A 27 LEU N N 15 122.548 0.300 A 28 LEU H H 1 8.248 0.020 A 28 LEU HA H 1 3.799 0.020 A 28 LEU HBy H 1 1.808 0.020 A 28 LEU HBx H 1 1.284 0.020 A 28 LEU HDx% H 1 0.667 0.020 A 28 LEU HDy% H 1 0.649 0.020 A 28 LEU HG H 1 1.765 0.020 A 28 LEU C C 13 175.881 0.300 A 28 LEU CA C 13 58.492 0.300 A 28 LEU CB C 13 41.760 0.300 A 28 LEU CDy C 13 25.323 0.300 A 28 LEU CDx C 13 22.973 0.300 A 28 LEU CG C 13 26.746 0.300 A 28 LEU N N 15 119.385 0.300 A 29 VAL H H 1 8.446 0.020 A 29 VAL HA H 1 3.319 0.020 A 29 VAL HB H 1 1.953 0.020 A 29 VAL HGx% H 1 0.723 0.020 A 29 VAL HGy% H 1 0.682 0.020 A 29 VAL C C 13 174.734 0.300 A 29 VAL CA C 13 67.192 0.300 A 29 VAL CB C 13 31.175 0.300 A 29 VAL CGx C 13 21.261 0.300 A 29 VAL CGy C 13 21.694 0.300 A 29 VAL N N 15 118.515 0.300 A 30 THR H H 1 7.923 0.020 A 30 THR HA H 1 3.432 0.020 A 30 THR HB H 1 3.896 0.020 A 30 THR HG2% H 1 0.834 0.020 A 30 THR CA C 13 68.606 0.300 A 30 THR CB C 13 67.147 0.300 A 30 THR CG2 C 13 21.245 0.300 A 30 THR N N 15 117.313 0.300 A 31 LEU H H 1 8.382 0.020 A 31 LEU HA H 1 3.858 0.020 A 31 LEU HBy H 1 1.771 0.020 A 31 LEU HBx H 1 1.416 0.020 A 31 LEU HDx% H 1 0.710 0.020 A 31 LEU HDy% H 1 0.704 0.020 A 31 LEU HG H 1 1.709 0.020 A 31 LEU C C 13 177.164 0.300 A 31 LEU CA C 13 58.145 0.300 A 31 LEU CB C 13 41.615 0.300 A 31 LEU CDy C 13 24.996 0.300 A 31 LEU CDx C 13 23.534 0.300 A 31 LEU CG C 13 26.825 0.300 A 31 LEU N N 15 120.629 0.300 A 32 ALA H H 1 8.517 0.020 A 32 ALA HA H 1 3.836 0.020 A 32 ALA HB% H 1 1.387 0.020 A 32 ALA C C 13 175.968 0.300 A 32 ALA CA C 13 55.918 0.300 A 32 ALA CB C 13 17.802 0.300 A 32 ALA N N 15 125.216 0.300 A 33 ILE H H 1 8.288 0.020 A 33 ILE HA H 1 3.481 0.020 A 33 ILE HB H 1 1.910 0.020 A 33 ILE HD1% H 1 0.672 0.020 A 33 ILE HG1y H 1 1.821 0.020 A 33 ILE HG1x H 1 0.867 0.020 A 33 ILE HG2% H 1 0.773 0.020 A 33 ILE C C 13 175.004 0.300 A 33 ILE CA C 13 65.554 0.300 A 33 ILE CB C 13 37.657 0.300 A 33 ILE CD1 C 13 13.625 0.300 A 33 ILE CG1 C 13 29.478 0.300 A 33 ILE CG2 C 13 17.208 0.300 A 33 ILE N N 15 118.722 0.300 A 34 LEU H H 1 8.493 0.020 A 34 LEU HA H 1 3.893 0.020 A 34 LEU HBy H 1 1.837 0.020 A 34 LEU HBx H 1 1.423 0.020 A 34 LEU HDx% H 1 0.777 0.020 A 34 LEU HDy% H 1 0.788 0.020 A 34 LEU HG H 1 1.836 0.020 A 34 LEU C C 13 176.439 0.300 A 34 LEU CA C 13 58.436 0.300 A 34 LEU CB C 13 42.152 0.300 A 34 LEU CDy C 13 25.642 0.300 A 34 LEU CDx C 13 23.493 0.300 A 34 LEU CG C 13 26.782 0.300 A 34 LEU N N 15 118.987 0.300 A 35 THR H H 1 8.215 0.020 A 35 THR HA H 1 3.652 0.020 A 35 THR HB H 1 4.202 0.020 A 35 THR HG2% H 1 1.060 0.020 A 35 THR C C 13 173.366 0.300 A 35 THR CA C 13 68.153 0.300 A 35 THR CB C 13 68.162 0.300 A 35 THR CG2 C 13 21.272 0.300 A 35 THR N N 15 116.630 0.300 A 36 ALA H H 1 8.358 0.020 A 36 ALA HA H 1 3.864 0.020 A 36 ALA HB% H 1 1.414 0.020 A 36 ALA C C 13 176.510 0.300 A 36 ALA CA C 13 55.758 0.300 A 36 ALA CB C 13 18.054 0.300 A 36 ALA N N 15 124.667 0.300 A 37 LEU H H 1 8.360 0.020 A 37 LEU HA H 1 3.973 0.020 A 37 LEU HBx H 1 1.458 0.020 A 37 LEU HBy H 1 1.458 0.020 A 37 LEU HDx% H 1 0.848 0.020 A 37 LEU HDy% H 1 0.707 0.020 A 37 LEU HG H 1 1.896 0.020 A 37 LEU C C 13 176.538 0.300 A 37 LEU CA C 13 57.853 0.300 A 37 LEU CB C 13 42.018 0.300 A 37 LEU CDy C 13 24.800 0.300 A 37 LEU CDx C 13 24.289 0.300 A 37 LEU CG C 13 26.695 0.300 A 37 LEU N N 15 116.565 0.300 A 38 ARG H H 1 8.082 0.020 A 38 ARG HA H 1 4.104 0.020 A 38 ARG HBy H 1 2.002 0.020 A 38 ARG HBx H 1 1.943 0.020 A 38 ARG HDy H 1 3.188 0.020 A 38 ARG HDx H 1 3.116 0.020 A 38 ARG HE H 1 7.226 0.020 A 38 ARG HGy H 1 1.688 0.020 A 38 ARG HGx H 1 1.661 0.020 A 38 ARG C C 13 176.208 0.300 A 38 ARG CA C 13 58.100 0.300 A 38 ARG CB C 13 29.502 0.300 A 38 ARG CD C 13 43.128 0.300 A 38 ARG CG C 13 27.348 0.300 A 38 ARG N N 15 119.392 0.300 A 38 ARG NE N 15 84.642 0.300 A 39 LEU H H 1 8.446 0.020 A 39 LEU HA H 1 4.243 0.020 A 39 LEU HBy H 1 1.818 0.020 A 39 LEU HBx H 1 1.342 0.020 A 39 LEU HDx% H 1 0.825 0.020 A 39 LEU HDy% H 1 0.757 0.020 A 39 LEU HG H 1 1.789 0.020 A 39 LEU C C 13 175.702 0.300 A 39 LEU CA C 13 56.979 0.300 A 39 LEU CB C 13 41.893 0.300 A 39 LEU CDy C 13 25.143 0.300 A 39 LEU CDx C 13 25.139 0.300 A 39 LEU CG C 13 27.335 0.300 A 39 LEU N N 15 120.438 0.300 A 40 ALA H H 1 8.321 0.020 A 40 ALA HA H 1 3.975 0.020 A 40 ALA HB% H 1 1.428 0.020 A 40 ALA C C 13 175.838 0.300 A 40 ALA CA C 13 54.710 0.300 A 40 ALA CB C 13 18.319 0.300 A 40 ALA N N 15 122.512 0.300 A 41 ALA H H 1 8.038 0.020 A 41 ALA HA H 1 4.024 0.020 A 41 ALA HB% H 1 1.349 0.020 A 41 ALA C C 13 176.517 0.300 A 41 ALA CA C 13 54.486 0.300 A 41 ALA CB C 13 18.468 0.300 A 41 ALA N N 15 119.754 0.300 A 42 TYR H H 1 7.814 0.020 A 42 TYR HA H 1 4.326 0.020 A 42 TYR HBy H 1 3.094 0.020 A 42 TYR HBx H 1 3.018 0.020 A 42 TYR HDx H 1 7.046 0.020 A 42 TYR HDy H 1 7.046 0.020 A 42 TYR HEx H 1 6.707 0.020 A 42 TYR HEy H 1 6.707 0.020 A 42 TYR C C 13 174.633 0.300 A 42 TYR CA C 13 60.098 0.300 A 42 TYR CB C 13 38.936 0.300 A 42 TYR CDx C 13 131.963 0.300 A 42 TYR CEx C 13 116.643 0.300 A 42 TYR N N 15 118.272 0.300 A 43 ALA H H 1 8.172 0.020 A 43 ALA HA H 1 4.111 0.020 A 43 ALA HB% H 1 1.412 0.020 A 43 ALA C C 13 175.241 0.300 A 43 ALA CA C 13 53.842 0.300 A 43 ALA CB C 13 18.427 0.300 A 43 ALA N N 15 122.908 0.300 A 44 ALA H H 1 7.953 0.020 A 44 ALA HA H 1 4.051 0.020 A 44 ALA HB% H 1 1.393 0.020 A 44 ALA C C 13 175.092 0.300 A 44 ALA CA C 13 53.611 0.300 A 44 ALA CB C 13 18.689 0.300 A 44 ALA N N 15 119.906 0.300 A 45 ASN H H 1 7.847 0.020 A 45 ASN HA H 1 4.541 0.020 A 45 ASN HBy H 1 2.798 0.020 A 45 ASN HBx H 1 2.702 0.020 A 45 ASN HD2x H 1 6.773 0.020 A 45 ASN HD2y H 1 7.392 0.020 A 45 ASN CA C 13 54.506 0.300 A 45 ASN CB C 13 38.602 0.300 A 45 ASN N N 15 114.984 0.300 A 45 ASN ND2 N 15 113.566 0.300 A 46 ILE H H 1 7.790 0.020 A 46 ILE HA H 1 4.033 0.020 A 46 ILE HB H 1 1.864 0.020 A 46 ILE HD1% H 1 0.748 0.020 A 46 ILE HG1y H 1 1.434 0.020 A 46 ILE HG1x H 1 1.137 0.020 A 46 ILE HG2% H 1 0.850 0.020 A 46 ILE C C 13 173.344 0.300 A 46 ILE CA C 13 62.357 0.300 A 46 ILE CB C 13 38.657 0.300 A 46 ILE CD1 C 13 13.494 0.300 A 46 ILE CG1 C 13 27.847 0.300 A 46 ILE CG2 C 13 17.895 0.300 A 46 ILE N N 15 119.155 0.300 A 47 VAL H H 1 7.582 0.020 A 47 VAL HA H 1 4.133 0.020 A 47 VAL HB H 1 2.119 0.020 A 47 VAL HGx% H 1 0.875 0.020 A 47 VAL HGy% H 1 0.875 0.020 A 47 VAL C C 13 172.672 0.300 A 47 VAL CA C 13 62.149 0.300 A 47 VAL CB C 13 32.807 0.300 A 47 VAL CGx C 13 21.897 0.300 A 47 VAL N N 15 117.526 0.300 A 48 ASN H H 1 8.053 0.020 A 48 ASN HA H 1 4.658 0.020 A 48 ASN HBy H 1 2.851 0.020 A 48 ASN HBx H 1 2.671 0.020 A 48 ASN HD2y H 1 7.401 0.020 A 48 ASN HD2x H 1 6.780 0.020 A 48 ASN CA C 13 53.478 0.300 A 48 ASN CB C 13 38.573 0.300 A 48 ASN N N 15 120.091 0.300 A 48 ASN ND2 N 15 113.787 0.300 A 49 VAL H H 1 7.685 0.020 A 49 VAL HA H 1 4.133 0.020 A 49 VAL HB H 1 2.062 0.020 A 49 VAL HGx% H 1 0.878 0.020 A 49 VAL HGy% H 1 0.859 0.020 A 49 VAL C C 13 172.595 0.300 A 49 VAL CA C 13 62.049 0.300 A 49 VAL CB C 13 33.271 0.300 A 49 VAL CGy C 13 21.753 0.300 A 49 VAL CGx C 13 20.172 0.300 A 49 VAL N N 15 118.854 0.300 A 50 SER H H 1 8.075 0.020 A 50 SER HA H 1 4.466 0.020 A 50 SER HBx H 1 3.793 0.020 A 50 SER HBy H 1 3.793 0.020 A 50 SER C C 13 171.430 0.300 A 50 SER CA C 13 58.128 0.300 A 50 SER CB C 13 63.916 0.300 A 50 SER N N 15 118.689 0.300 A 51 LEU H H 1 7.991 0.020 A 51 LEU HA H 1 4.305 0.020 A 51 LEU HBx H 1 1.503 0.020 A 51 LEU HBy H 1 1.503 0.020 A 51 LEU HDx% H 1 0.855 0.020 A 51 LEU HG H 1 1.606 0.020 A 51 LEU C C 13 174.110 0.300 A 51 LEU CA C 13 55.145 0.300 A 51 LEU CB C 13 42.674 0.300 A 51 LEU CDx C 13 25.620 0.300 A 51 LEU CG C 13 27.208 0.300 A 51 LEU N N 15 123.536 0.300 A 52 VAL H H 1 7.536 0.020 A 52 VAL HA H 1 3.992 0.020 A 52 VAL HB H 1 2.018 0.020 A 52 VAL HGx% H 1 0.861 0.020 A 52 VAL HGy% H 1 0.855 0.020 A 52 VAL C C 13 172.476 0.300 A 52 VAL CA C 13 62.772 0.300 A 52 VAL CB C 13 33.066 0.300 A 52 VAL CGx C 13 20.864 0.300 A 52 VAL CGy C 13 21.467 0.300 A 52 VAL N N 15 119.649 0.300 A 53 LYS H H 1 8.038 0.020 A 53 LYS HA H 1 4.354 0.020 A 53 LYS HBy H 1 1.868 0.020 A 53 LYS HBx H 1 1.778 0.020 A 53 LYS HDy H 1 1.692 0.020 A 53 LYS HDx H 1 1.643 0.020 A 53 LYS HEx H 1 2.970 0.020 A 53 LYS HEy H 1 2.970 0.020 A 53 LYS HGy H 1 1.501 0.020 A 53 LYS HGx H 1 1.416 0.020 A 53 LYS CA C 13 56.567 0.300 A 53 LYS CB C 13 31.689 0.300 A 53 LYS CD C 13 29.449 0.300 A 53 LYS CE C 13 42.104 0.300 A 53 LYS CG C 13 25.097 0.300 A 53 LYS N N 15 122.004 0.300 A 54 PRO HA H 1 4.353 0.020 A 54 PRO HBy H 1 2.190 0.020 A 54 PRO HBx H 1 1.883 0.020 A 54 PRO HDy H 1 3.810 0.020 A 54 PRO HDx H 1 3.765 0.020 A 54 PRO HGy H 1 2.050 0.020 A 54 PRO HGx H 1 1.888 0.020 A 54 PRO CA C 13 65.103 0.300 A 54 PRO CB C 13 32.193 0.300 A 54 PRO CD C 13 50.245 0.300 A 54 PRO CG C 13 27.772 0.300 A 55 THR H H 1 7.722 0.020 A 55 THR HA H 1 3.910 0.020 A 55 THR HB H 1 4.121 0.020 A 55 THR HG2% H 1 1.172 0.020 A 55 THR C C 13 172.822 0.300 A 55 THR CA C 13 65.030 0.300 A 55 THR CB C 13 68.882 0.300 A 55 THR CG2 C 13 22.319 0.300 A 55 THR N N 15 111.485 0.300 A 56 VAL H H 1 7.597 0.020 A 56 VAL HA H 1 3.772 0.020 A 56 VAL HB H 1 2.113 0.020 A 56 VAL HGx% H 1 0.896 0.020 A 56 VAL HGy% H 1 0.946 0.020 A 56 VAL C C 13 174.904 0.300 A 56 VAL CA C 13 64.971 0.300 A 56 VAL CB C 13 31.989 0.300 A 56 VAL CGx C 13 21.196 0.300 A 56 VAL CGy C 13 21.773 0.300 A 56 VAL N N 15 121.165 0.300 A 57 TYR H H 1 7.964 0.020 A 57 TYR HA H 1 4.227 0.020 A 57 TYR HBx H 1 3.024 0.020 A 57 TYR HBy H 1 3.024 0.020 A 57 TYR HDx H 1 6.995 0.020 A 57 TYR HDy H 1 6.995 0.020 A 57 TYR HEx H 1 6.708 0.020 A 57 TYR HEy H 1 6.708 0.020 A 57 TYR C C 13 174.969 0.300 A 57 TYR CA C 13 60.755 0.300 A 57 TYR CB C 13 38.453 0.300 A 57 TYR CDy C 13 132.020 0.300 A 57 TYR CEy C 13 117.758 0.300 A 57 TYR N N 15 122.177 0.300 A 58 VAL H H 1 8.018 0.020 A 58 VAL HA H 1 3.529 0.020 A 58 VAL HB H 1 2.126 0.020 A 58 VAL HGx% H 1 1.068 0.020 A 58 VAL HGy% H 1 0.882 0.020 A 58 VAL C C 13 174.250 0.300 A 58 VAL CA C 13 66.223 0.300 A 58 VAL CB C 13 31.803 0.300 A 58 VAL CGy C 13 22.739 0.300 A 58 VAL CGx C 13 21.699 0.300 A 58 VAL N N 15 119.069 0.300 A 59 TYR H H 1 8.142 0.020 A 59 TYR HA H 1 4.115 0.020 A 59 TYR HBx H 1 3.016 0.020 A 59 TYR HBy H 1 3.016 0.020 A 59 TYR HDx H 1 6.943 0.020 A 59 TYR HDy H 1 6.943 0.020 A 59 TYR HEx H 1 6.692 0.020 A 59 TYR HEy H 1 6.692 0.020 A 59 TYR C C 13 173.899 0.300 A 59 TYR CA C 13 60.929 0.300 A 59 TYR CB C 13 38.602 0.300 A 59 TYR CDy C 13 131.980 0.300 A 59 TYR CEy C 13 117.244 0.300 A 59 TYR N N 15 120.360 0.300 A 60 SER H H 1 8.057 0.020 A 60 SER HA H 1 3.979 0.020 A 60 SER HBx H 1 3.871 0.020 A 60 SER HBy H 1 3.871 0.020 A 60 SER C C 13 172.887 0.300 A 60 SER CA C 13 60.987 0.300 A 60 SER CB C 13 63.267 0.300 A 60 SER N N 15 113.480 0.300 A 61 ARG H H 1 7.606 0.020 A 61 ARG HA H 1 4.103 0.020 A 61 ARG HBy H 1 1.811 0.020 A 61 ARG HBx H 1 1.722 0.020 A 61 ARG HDy H 1 3.035 0.020 A 61 ARG HDx H 1 2.963 0.020 A 61 ARG HE H 1 7.039 0.020 A 61 ARG HGy H 1 1.497 0.020 A 61 ARG HGx H 1 1.451 0.020 A 61 ARG C C 13 175.399 0.300 A 61 ARG CA C 13 57.427 0.300 A 61 ARG CB C 13 30.008 0.300 A 61 ARG CD C 13 42.811 0.300 A 61 ARG CG C 13 27.275 0.300 A 61 ARG N N 15 120.962 0.300 A 61 ARG NE N 15 84.354 0.300 A 62 VAL H H 1 7.848 0.020 A 62 VAL HA H 1 3.805 0.020 A 62 VAL HB H 1 2.068 0.020 A 62 VAL HGx% H 1 0.944 0.020 A 62 VAL HGy% H 1 0.882 0.020 A 62 VAL C C 13 174.155 0.300 A 62 VAL CA C 13 64.458 0.300 A 62 VAL CB C 13 31.969 0.300 A 62 VAL CGy C 13 22.263 0.300 A 62 VAL CGx C 13 21.552 0.300 A 62 VAL N N 15 117.852 0.300 A 63 LYS H H 1 7.759 0.020 A 63 LYS HA H 1 4.051 0.020 A 63 LYS HBy H 1 1.572 0.020 A 63 LYS HBx H 1 1.502 0.020 A 63 LYS HDx H 1 1.457 0.020 A 63 LYS HDy H 1 1.457 0.020 A 63 LYS HEy H 1 2.868 0.020 A 63 LYS HEx H 1 2.815 0.020 A 63 LYS HGx H 1 1.150 0.020 A 63 LYS HGy H 1 1.150 0.020 A 63 LYS C C 13 173.615 0.300 A 63 LYS CA C 13 56.727 0.300 A 63 LYS CB C 13 32.105 0.300 A 63 LYS CD C 13 28.869 0.300 A 63 LYS CE C 13 42.115 0.300 A 63 LYS CG C 13 24.482 0.300 A 63 LYS N N 15 119.254 0.300 A 64 ASN H H 1 7.615 0.020 A 64 ASN HA H 1 4.642 0.020 A 64 ASN HBy H 1 2.863 0.020 A 64 ASN HBx H 1 2.626 0.020 A 64 ASN HD2x H 1 6.751 0.020 A 64 ASN HD2y H 1 7.465 0.020 A 64 ASN C C 13 171.750 0.300 A 64 ASN CA C 13 53.313 0.300 A 64 ASN CB C 13 39.260 0.300 A 64 ASN N N 15 117.696 0.300 A 64 ASN ND2 N 15 113.802 0.300 A 65 LEU H H 1 7.492 0.020 A 65 LEU HA H 1 4.067 0.020 A 65 LEU HBy H 1 1.626 0.020 A 65 LEU HBx H 1 1.510 0.020 A 65 LEU HDx% H 1 0.863 0.020 A 65 LEU HDy% H 1 0.808 0.020 A 65 LEU HG H 1 1.655 0.020 A 65 LEU C C 13 178.928 0.300 A 65 LEU CA C 13 56.778 0.300 A 65 LEU CB C 13 42.873 0.300 A 65 LEU CDy C 13 25.454 0.300 A 65 LEU CDx C 13 23.620 0.300 A 65 LEU CG C 13 27.062 0.300 A 65 LEU N N 15 126.142 0.300 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 20 PHE HA A 20 PHE HD% 1.0 . 3.90 2 2 A 26 PHE HD% A 30 THR HG2% 1.0 . 4.89 3 3 A 59 TYR HD% A 62 VAL HGy% 1.0 . 3.98 4 4 A 59 TYR HD% A 59 TYR H 1.0 . 4.60 5 5 A 59 TYR HD% A 60 SER H 1.0 . 4.44 6 6 A 59 TYR HD% A 59 TYR HA 1.0 . 3.85 7 7 A 59 TYR HD% A 60 SER HBx 1.0 . 4.67 8 7 A 59 TYR HD% A 60 SER HBy 1.0 . 4.67 9 8 A 26 PHE HD% A 30 THR H 1.0 . 5.06 10 9 A 23 PHE HA A 23 PHE HD% 1.0 . 3.86 11 10 A 62 VAL HGy% A 59 TYR HE% 1.0 . 4.44 12 11 A 59 TYR HA A 59 TYR HE% 1.0 . 4.64 13 12 A 57 TYR H A 57 TYR HE% 1.0 . 4.51 14 13 A 57 TYR HE% A 58 VAL HGx% 1.0 . 3.64 15 14 A 42 TYR H A 42 TYR HE% 1.0 . 4.66 16 15 A 42 TYR HD% A 46 ILE HG1y 1.0 . 4.81 17 16 A 20 PHE HD% A 21 LEU H 1.0 . 4.38 18 17 A 42 TYR HD% A 42 TYR HA 1.0 . 3.84 19 18 A 42 TYR HD% A 46 ILE HD1% 1.0 . 3.77 20 19 A 42 TYR H A 42 TYR HD% 1.0 . 4.28 21 20 A 57 TYR HA A 57 TYR HD% 1.0 . 4.23 22 21 A 58 VAL HGx% A 57 TYR HD% 1.0 . 3.99 23 22 A 56 VAL H A 56 VAL HGy% 1.0 . 3.78 24 23 A 56 VAL HGy% A 53 LYS HGx 1.0 . 4.44 25 24 A 37 LEU H A 37 LEU HBx 1.0 . 3.79 26 24 A 37 LEU H A 37 LEU HBy 1.0 . 3.79 27 25 A 39 LEU HBx A 39 LEU HDx% 1.0 . 3.28 28 26 A 58 VAL HGy% A 62 VAL HGx% 1.0 . 3.06 29 27 A 62 VAL HGy% A 62 VAL HA 1.0 . 3.89 30 28 A 11 THR HA A 14 VAL H 1.0 . 5.37 31 29 A 13 ILE HD1% A 17 VAL HB 1.0 . 4.27 32 30 A 17 VAL HB A 20 PHE HBx 1.0 . 5.50 33 31 A 17 VAL HB A 18 LEU H 1.0 . 4.17 34 32 A 17 VAL HB A 13 ILE HB 1.0 . 5.46 35 33 A 14 VAL H A 13 ILE HB 1.0 . 4.07 36 34 A 13 ILE HB A 17 VAL HGx% 1.0 . 5.19 37 35 A 23 PHE HA A 23 PHE HE% 1.0 . 4.59 38 36 A 23 PHE HA A 26 PHE HBy 1.0 . 3.84 39 37 A 23 PHE HA A 27 LEU HDx% 1.0 . 5.50 40 38 A 23 PHE HA A 27 LEU HDy% 1.0 . 5.50 41 39 A 45 ASN HBy A 46 ILE H 1.0 . 3.98 42 40 A 48 ASN HA A 49 VAL HB 1.0 . 5.39 43 41 A 62 VAL HGx% A 62 VAL HA 1.0 . 3.19 44 42 A 62 VAL HGx% A 62 VAL H 1.0 . 3.24 45 43 A 56 VAL HGy% A 56 VAL HA 1.0 . 3.65 46 44 A 56 VAL HA A 59 TYR HBx 1.0 . 4.33 47 44 A 56 VAL HA A 59 TYR HBy 1.0 . 4.33 48 45 A 59 TYR H A 56 VAL HA 1.0 . 3.97 49 46 A 57 TYR H A 56 VAL HA 1.0 . 3.53 50 47 A 56 VAL HA A 56 VAL HGx% 1.0 . 3.69 51 48 A 11 THR HA A 11 THR HG2% 1.0 . 3.92 52 49 A 8 GLU HBx A 9 THR HA 1.0 . 5.50 53 50 A 11 THR HA A 8 GLU HBx 1.0 . 5.50 54 51 A 9 THR HA A 8 GLU HBy 1.0 . 5.50 55 52 A 11 THR HA A 8 GLU HBy 1.0 . 5.50 56 53 A 58 VAL HA A 61 ARG HBy 1.0 . 4.73 57 54 A 52 VAL HGy% A 55 THR H 1.0 . 3.93 58 55 A 52 VAL HGy% A 52 VAL HA 1.0 . 3.04 59 56 A 31 LEU HBx A 31 LEU HDx% 1.0 . 3.23 60 57 A 31 LEU HDx% A 31 LEU HA 1.0 . 3.99 61 58 A 31 LEU HDx% A 31 LEU H 1.0 . 4.33 62 59 A 47 VAL H A 47 VAL HGx% 1.0 . 3.42 63 59 A 47 VAL H A 47 VAL HGy% 1.0 . 3.42 64 60 A 54 PRO HGy A 55 THR HA 1.0 . 4.72 65 61 A 35 THR HA A 38 ARG HBx 1.0 . 5.27 66 62 A 45 ASN HBx A 45 ASN HD2y 1.0 . 4.01 67 63 A 46 ILE H A 45 ASN HBx 1.0 . 4.09 68 64 A 45 ASN HBx A 45 ASN H 1.0 . 4.11 69 65 A 60 SER HA A 63 LYS HDx 1.0 . 4.24 70 65 A 60 SER HA A 63 LYS HDy 1.0 . 4.24 71 66 A 60 SER HA A 63 LYS HBx 1.0 . 4.48 72 67 A 60 SER HA A 64 ASN HD2x 1.0 . 5.20 73 68 A 60 SER HA A 64 ASN H 1.0 . 5.36 74 69 A 20 PHE H A 20 PHE HBy 1.0 . 4.18 75 70 A 62 VAL HA A 65 LEU HBy 1.0 . 4.45 76 71 A 52 VAL H A 52 VAL HB 1.0 . 3.81 77 72 A 52 VAL HB A 53 LYS H 1.0 . 4.54 78 73 A 16 SER HA A 19 LEU HBy 1.0 . 5.30 79 74 A 20 PHE HA A 19 LEU HBy 1.0 . 5.50 80 75 A 16 SER HA A 19 LEU H 1.0 . 5.26 81 76 A 38 ARG HDx A 38 ARG HH1% 1.0 . 4.34 82 77 A 38 ARG HDx A 38 ARG HH2% 1.0 . 4.60 83 78 A 38 ARG HDx A 38 ARG HA 1.0 . 4.41 84 79 A 14 VAL HB A 15 ASN H 1.0 . 4.12 85 80 A 35 THR HG2% A 36 ALA HA 1.0 . 3.98 86 81 A 35 THR HA A 35 THR HG2% 1.0 . 3.68 87 82 A 35 THR HG2% A 35 THR H 1.0 . 4.14 88 83 A 35 THR HG2% A 36 ALA H 1.0 . 4.03 89 84 A 35 THR HG2% A 39 LEU HG 1.0 . 4.05 90 85 A 46 ILE HG1y A 45 ASN HA 1.0 . 5.50 91 86 A 46 ILE HG1y A 46 ILE HA 1.0 . 4.07 92 87 A 53 LYS HA A 53 LYS HDx 1.0 . 5.50 93 88 A 20 PHE H A 19 LEU HBy 1.0 . 4.37 94 89 A 19 LEU HBy A 19 LEU HDx% 1.0 . 3.54 95 90 A 11 THR H A 11 THR HB 1.0 . 3.84 96 91 A 11 THR HB A 12 LEU H 1.0 . 4.52 97 92 A 51 LEU HDx% A 51 LEU HBx 1.0 . 2.59 98 92 A 51 LEU HBy A 51 LEU HDx% 1.0 . 2.59 99 93 A 65 LEU HBx A 65 LEU HDx% 1.0 . 2.89 100 94 A 28 LEU H A 28 LEU HDx% 1.0 . 4.03 101 95 A 28 LEU HDx% A 28 LEU HA 1.0 . 4.07 102 96 A 28 LEU HDx% A 28 LEU HBx 1.0 . 3.42 103 97 A 28 LEU HDx% A 29 VAL H 1.0 . 4.36 104 98 A 28 LEU HDx% A 28 LEU HBy 1.0 . 3.42 105 99 A 28 LEU HBy A 28 LEU HDy% 1.0 . 3.81 106 100 A 21 LEU HBx A 22 ALA HB% 1.0 . 4.42 107 101 A 28 LEU HBy A 29 VAL HA 1.0 . 5.50 108 102 A 17 VAL HB A 13 ILE HG2% 1.0 . 5.24 109 103 A 13 ILE HG2% A 13 ILE HG1x 1.0 . 3.27 110 104 A 12 LEU H A 13 ILE HG2% 1.0 . 4.02 111 105 A 13 ILE HG2% A 13 ILE HG1y 1.0 . 3.51 112 106 A 13 ILE HG2% A 13 ILE HA 1.0 . 3.55 113 107 A 40 ALA H A 42 TYR HBy 1.0 . 5.50 114 108 A 42 TYR HBy A 43 ALA H 1.0 . 4.42 115 109 A 27 LEU HDy% A 27 LEU H 1.0 . 3.83 116 110 A 27 LEU HDy% A 27 LEU HBx 1.0 . 2.87 117 111 A 23 PHE HD% A 27 LEU HDy% 1.0 . 3.40 118 112 A 27 LEU HDy% A 27 LEU HA 1.0 . 3.98 119 113 A 27 LEU HDy% A 27 LEU HBy 1.0 . 2.87 120 114 A 27 LEU HDy% A 24 VAL H 1.0 . 4.59 121 115 A 42 TYR HD% A 46 ILE HG1x 1.0 . 5.41 122 116 A 46 ILE HA A 46 ILE HG1x 1.0 . 4.20 123 117 A 53 LYS HDx A 53 LYS HBy 1.0 . 4.22 124 118 A 56 VAL HGx% A 53 LYS HBy 1.0 . 5.50 125 119 A 53 LYS HBy A 53 LYS HDy 1.0 . 3.69 126 120 A 8 GLU HBx A 9 THR H 1.0 . 3.88 127 121 A 13 ILE HD1% A 13 ILE HB 1.0 . 3.51 128 122 A 13 ILE HD1% A 13 ILE H 1.0 . 4.61 129 123 A 13 ILE HD1% A 13 ILE HA 1.0 . 3.86 130 124 A 42 TYR HBx A 50 SER HBx 1.0 . 5.12 131 124 A 42 TYR HBx A 50 SER HBy 1.0 . 5.12 132 125 A 27 LEU HA A 26 PHE HBx 1.0 . 5.50 133 126 A 43 ALA H A 43 ALA HB% 1.0 . 3.39 134 127 A 27 LEU HBx A 27 LEU HG 1.0 . 3.02 135 128 A 27 LEU HBx A 30 THR HB 1.0 . 5.16 136 129 A 33 ILE HG2% A 33 ILE HG1x 1.0 . 4.20 137 130 A 63 LYS HEy A 64 ASN HA 1.0 . 4.94 138 131 A 63 LYS HEy A 63 LYS HA 1.0 . 5.32 139 132 A 63 LYS HBx A 63 LYS HEy 1.0 . 4.62 140 133 A 63 LYS HEy A 63 LYS H 1.0 . 5.28 141 134 A 63 LYS HEy A 63 LYS HBy 1.0 . 5.01 142 135 A 35 THR HG2% A 32 ALA HA 1.0 . 4.98 143 136 A 35 THR H A 32 ALA HA 1.0 . 4.19 144 137 A 31 LEU HDx% A 32 ALA HA 1.0 . 5.08 145 138 A 32 ALA HA A 31 LEU HDy% 1.0 . 5.50 146 139 A 32 ALA HA A 35 THR HB 1.0 . 4.65 147 140 A 36 ALA HA A 35 THR HB 1.0 . 5.08 148 141 A 27 LEU H A 24 VAL HA 1.0 . 5.50 149 142 A 20 PHE HD% A 24 VAL HA 1.0 . 5.46 150 143 A 24 VAL HA A 24 VAL HGy% 1.0 . 3.11 151 144 A 27 LEU HDy% A 24 VAL HA 1.0 . 3.30 152 145 A 27 LEU HBx A 24 VAL HA 1.0 . 4.75 153 146 A 27 LEU HG A 24 VAL HA 1.0 . 4.66 154 147 A 27 LEU HBy A 24 VAL HA 1.0 . 4.61 155 148 A 24 VAL HA A 26 PHE H 1.0 . 5.22 156 149 A 12 LEU HA A 12 LEU HDx% 1.0 . 3.78 157 150 A 32 ALA HB% A 33 ILE HD1% 1.0 . 4.85 158 151 A 33 ILE HD1% A 33 ILE HB 1.0 . 3.43 159 152 A 33 ILE HD1% A 30 THR HA 1.0 . 4.00 160 153 A 33 ILE HD1% A 33 ILE H 1.0 . 3.87 161 154 A 12 LEU H A 10 GLY HAy 1.0 . 5.18 162 155 A 30 THR H A 26 PHE HBx 1.0 . 5.34 163 156 A 42 TYR HBx A 44 ALA H 1.0 . 5.50 164 157 A 57 TYR H A 59 TYR HBx 1.0 . 5.50 165 157 A 57 TYR H A 59 TYR HBy 1.0 . 5.50 166 158 A 58 VAL H A 59 TYR HBx 1.0 . 4.27 167 158 A 59 TYR HBy A 58 VAL H 1.0 . 4.27 168 159 A 37 LEU HDx% A 37 LEU HBx 1.0 . 3.01 169 159 A 37 LEU HBy A 37 LEU HDx% 1.0 . 3.01 170 160 A 37 LEU HDx% A 37 LEU HA 1.0 . 3.21 171 161 A 11 THR HB A 13 ILE HG2% 1.0 . 4.44 172 162 A 29 VAL HA A 29 VAL HGy% 1.0 . 3.99 173 163 A 29 VAL HA A 33 ILE H 1.0 . 4.81 174 164 A 27 LEU HG A 24 VAL HGx% 1.0 . 4.46 175 165 A 23 PHE HD% A 27 LEU HG 1.0 . 5.13 176 166 A 22 ALA HA A 25 VAL HB 1.0 . 5.27 177 167 A 22 ALA HA A 23 PHE HBy 1.0 . 5.50 178 168 A 22 ALA HA A 25 VAL H 1.0 . 4.22 179 169 A 26 PHE H A 22 ALA HA 1.0 . 4.68 180 170 A 22 ALA HA A 21 LEU HDy% 1.0 . 5.37 181 171 A 20 PHE HD% A 24 VAL HGx% 1.0 . 4.79 182 172 A 24 VAL HA A 24 VAL HGx% 1.0 . 3.58 183 173 A 24 VAL HGx% A 25 VAL H 1.0 . 3.89 184 174 A 28 LEU HA A 24 VAL HGx% 1.0 . 5.50 185 175 A 24 VAL HGx% A 28 LEU HG 1.0 . 3.91 186 176 A 11 THR HB A 13 ILE H 1.0 . 4.77 187 177 A 11 THR HB A 10 GLY H 1.0 . 4.78 188 178 A 8 GLU HBx A 11 THR HB 1.0 . 4.28 189 179 A 63 LYS HA A 63 LYS HGx 1.0 . 4.01 190 179 A 63 LYS HA A 63 LYS HGy 1.0 . 4.01 191 180 A 19 LEU H A 18 LEU HBy 1.0 . 4.71 192 181 A 52 VAL HB A 51 LEU HA 1.0 . 4.36 193 182 A 11 THR HG2% A 11 THR H 1.0 . 3.88 194 183 A 27 LEU H A 30 THR HB 1.0 . 5.50 195 184 A 29 VAL H A 30 THR HB 1.0 . 5.50 196 185 A 26 PHE HBy A 30 THR HB 1.0 . 5.50 197 186 A 30 THR HG2% A 26 PHE HBx 1.0 . 4.76 198 187 A 58 VAL HA A 57 TYR HBx 1.0 . 5.29 199 187 A 58 VAL HA A 57 TYR HBy 1.0 . 5.29 200 188 A 58 VAL HA A 61 ARG HDy 1.0 . 5.50 201 189 A 58 VAL HA A 61 ARG HBx 1.0 . 5.04 202 190 A 60 SER H A 58 VAL HA 1.0 . 4.30 203 191 A 58 VAL HGy% A 58 VAL HA 1.0 . 3.82 204 192 A 53 LYS HBy A 54 PRO HDx 1.0 . 4.42 205 193 A 54 PRO HDx A 53 LYS HBx 1.0 . 4.24 206 194 A 39 LEU HA A 39 LEU HDy% 1.0 . 3.97 207 195 A 63 LYS HA A 63 LYS HDx 1.0 . 4.25 208 195 A 63 LYS HDy A 63 LYS HA 1.0 . 4.25 209 196 A 63 LYS HA A 63 LYS HEx 1.0 . 5.29 210 197 A 39 LEU HA A 50 SER H 1.0 . 3.76 211 198 A 38 ARG HBx A 39 LEU HA 1.0 . 3.89 212 199 A 12 LEU HA A 15 ASN HBx 1.0 . 4.26 213 200 A 21 LEU H A 21 LEU HG 1.0 . 4.52 214 201 A 48 ASN HBy A 48 ASN HD2y 1.0 . 4.03 215 202 A 15 ASN HBy A 16 SER H 1.0 . 4.47 216 203 A 48 ASN HBy A 49 VAL HA 1.0 . 4.74 217 204 A 65 LEU HBy A 65 LEU HDy% 1.0 . 2.51 218 205 A 59 TYR H A 58 VAL HGx% 1.0 . 4.23 219 206 A 58 VAL HGx% A 58 VAL HA 1.0 . 3.45 220 207 A 58 VAL HGx% A 55 THR HA 1.0 . 4.16 221 208 A 58 VAL HGx% A 58 VAL H 1.0 . 3.35 222 209 A 30 THR HG2% A 30 THR HA 1.0 . 3.61 223 210 A 14 VAL HA A 14 VAL HGx% 1.0 . 3.62 224 211 A 56 VAL H A 56 VAL HGx% 1.0 . 3.36 225 212 A 56 VAL HGx% A 57 TYR HBx 1.0 . 3.93 226 212 A 56 VAL HGx% A 57 TYR HBy 1.0 . 3.93 227 213 A 57 TYR H A 56 VAL HGx% 1.0 . 3.18 228 214 A 39 LEU HDx% A 35 THR HA 1.0 . 5.45 229 215 A 35 THR HA A 38 ARG H 1.0 . 5.50 230 216 A 11 THR HA A 13 ILE HG2% 1.0 . 3.86 231 217 A 16 SER H A 16 SER HBx 1.0 . 3.86 232 217 A 16 SER H A 16 SER HBy 1.0 . 3.86 233 218 A 17 VAL H A 16 SER HBx 1.0 . 3.99 234 218 A 16 SER HBy A 17 VAL H 1.0 . 3.99 235 219 A 13 ILE HA A 16 SER HBx 1.0 . 2.45 236 219 A 13 ILE HA A 16 SER HBy 1.0 . 2.45 237 220 A 44 ALA H A 44 ALA HB% 1.0 . 3.22 238 221 A 45 ASN H A 44 ALA HB% 1.0 . 3.48 239 222 A 62 VAL HGy% A 63 LYS HA 1.0 . 3.90 240 223 A 64 ASN HD2x A 63 LYS HA 1.0 . 5.48 241 224 A 65 LEU HA A 65 LEU HG 1.0 . 3.65 242 225 A 65 LEU HBy A 65 LEU HDx% 1.0 . 2.50 243 226 A 12 LEU HBx A 12 LEU HDy% 1.0 . 3.15 244 227 A 23 PHE HBy A 23 PHE H 1.0 . 3.63 245 228 A 20 PHE HBy A 21 LEU HA 1.0 . 5.44 246 229 A 59 TYR HA A 62 VAL HB 1.0 . 5.39 247 230 A 56 VAL H A 55 THR HB 1.0 . 4.48 248 231 A 52 VAL HGy% A 55 THR HB 1.0 . 4.15 249 232 A 23 PHE HD% A 26 PHE HBy 1.0 . 5.40 250 233 A 65 LEU HDy% A 65 LEU HA 1.0 . 2.93 251 234 A 65 LEU HBx A 65 LEU HDy% 1.0 . 3.21 252 235 A 61 ARG HDy A 61 ARG HH2% 1.0 . 4.81 253 236 A 61 ARG HDy A 61 ARG HH1% 1.0 . 4.67 254 237 A 61 ARG HDy A 61 ARG HA 1.0 . 4.34 255 238 A 31 LEU HDx% A 31 LEU HBy 1.0 . 3.58 256 239 A 47 VAL HB A 48 ASN H 1.0 . 4.33 257 240 A 47 VAL H A 47 VAL HB 1.0 . 3.86 258 241 A 38 ARG HH1% A 38 ARG HDy 1.0 . 4.49 259 242 A 38 ARG HH2% A 38 ARG HDy 1.0 . 4.71 260 243 A 38 ARG HA A 38 ARG HDy 1.0 . 4.42 261 244 A 27 LEU HA A 29 VAL HGx% 1.0 . 5.16 262 245 A 27 LEU HA A 31 LEU HDy% 1.0 . 5.50 263 246 A 26 PHE HBy A 27 LEU HA 1.0 . 5.01 264 247 A 27 LEU HA A 27 LEU HG 1.0 . 4.19 265 248 A 27 LEU HA A 30 THR HB 1.0 . 4.43 266 249 A 31 LEU H A 27 LEU HA 1.0 . 4.78 267 250 A 26 PHE HD% A 27 LEU HA 1.0 . 5.50 268 251 A 22 ALA HA A 25 VAL HGx% 1.0 . 3.75 269 252 A 22 ALA HB% A 25 VAL HGx% 1.0 . 3.47 270 253 A 26 PHE H A 25 VAL HGx% 1.0 . 3.61 271 254 A 25 VAL HGx% A 25 VAL HA 1.0 . 3.37 272 255 A 15 ASN H A 15 ASN HBx 1.0 . 4.03 273 256 A 15 ASN HBx A 14 VAL HGx% 1.0 . 3.98 274 257 A 54 PRO HBy A 55 THR HG2% 1.0 . 5.07 275 258 A 55 THR H A 54 PRO HBy 1.0 . 4.52 276 259 A 19 LEU H A 19 LEU HG 1.0 . 4.77 277 260 A 19 LEU HG A 19 LEU HBx 1.0 . 2.66 278 261 A 39 LEU HDx% A 38 ARG HBx 1.0 . 3.50 279 262 A 12 LEU HDy% A 12 LEU HBy 1.0 . 3.21 280 263 A 12 LEU H A 12 LEU HDy% 1.0 . 4.29 281 264 A 28 LEU H A 28 LEU HDy% 1.0 . 4.10 282 265 A 28 LEU HA A 28 LEU HDy% 1.0 . 3.31 283 266 A 28 LEU HBx A 28 LEU HDy% 1.0 . 3.42 284 267 A 28 LEU HDy% A 27 LEU H 1.0 . 5.33 285 268 A 34 LEU HA A 34 LEU HG 1.0 . 4.17 286 269 A 34 LEU HG A 34 LEU H 1.0 . 4.63 287 270 A 52 VAL H A 51 LEU HBx 1.0 . 4.52 288 270 A 52 VAL H A 51 LEU HBy 1.0 . 4.52 289 271 A 54 PRO HDx A 53 LYS HGy 1.0 . 5.42 290 272 A 53 LYS H A 53 LYS HGy 1.0 . 4.89 291 273 A 62 VAL H A 61 ARG HGx 1.0 . 4.79 292 274 A 28 LEU HA A 32 ALA H 1.0 . 5.11 293 275 A 31 LEU H A 28 LEU HA 1.0 . 4.49 294 276 A 28 LEU HA A 28 LEU HG 1.0 . 3.87 295 277 A 18 LEU HBy A 18 LEU HDy% 1.0 . 3.00 296 278 A 18 LEU HDy% A 18 LEU HBx 1.0 . 3.35 297 279 A 18 LEU HDy% A 18 LEU HA 1.0 . 3.34 298 280 A 16 SER H A 14 VAL HA 1.0 . 4.99 299 281 A 14 VAL HA A 14 VAL HGy% 1.0 . 3.38 300 282 A 62 VAL HA A 65 LEU HDx% 1.0 . 3.51 301 283 A 37 LEU HDy% A 37 LEU HBx 1.0 . 3.36 302 283 A 37 LEU HBy A 37 LEU HDy% 1.0 . 3.36 303 284 A 37 LEU H A 37 LEU HDy% 1.0 . 3.86 304 285 A 40 ALA H A 41 ALA HB% 1.0 . 4.42 305 286 A 46 ILE HB A 47 VAL HA 1.0 . 5.40 306 287 A 46 ILE HD1% A 46 ILE HB 1.0 . 3.79 307 288 A 53 LYS HDx A 53 LYS HBx 1.0 . 3.74 308 289 A 56 VAL HGx% A 53 LYS HBx 1.0 . 5.48 309 290 A 19 LEU H A 18 LEU HBx 1.0 . 4.53 310 291 A 8 GLU H1 A 8 GLU HGx 1.0 . 4.55 311 292 A 11 THR HB A 8 GLU HGx 1.0 . 3.42 312 293 A 10 GLY H A 8 GLU HGx 1.0 . 4.62 313 294 A 11 THR HG2% A 8 GLU HGx 1.0 . 4.42 314 295 A 8 GLU HBx A 8 GLU HGx 1.0 . 2.90 315 296 A 14 VAL H A 13 ILE HG1x 1.0 . 5.05 316 297 A 13 ILE HG1x A 13 ILE H 1.0 . 4.74 317 298 A 36 ALA H A 34 LEU HA 1.0 . 4.63 318 299 A 37 LEU H A 34 LEU HA 1.0 . 4.81 319 300 A 38 ARG H A 34 LEU HA 1.0 . 5.21 320 301 A 45 ASN H A 43 ALA HA 1.0 . 4.69 321 302 A 61 ARG HA A 65 LEU H 1.0 . 4.52 322 303 A 58 VAL HA A 61 ARG HA 1.0 . 5.33 323 304 A 61 ARG HH1% A 61 ARG HA 1.0 . 4.62 324 305 A 61 ARG HA A 61 ARG HGx 1.0 . 4.08 325 306 A 53 LYS HBy A 51 LEU HBx 1.0 . 3.83 326 306 A 51 LEU HBy A 53 LYS HBy 1.0 . 3.83 327 307 A 32 ALA HB% A 33 ILE HG1y 1.0 . 3.92 328 308 A 32 ALA HB% A 32 ALA H 1.0 . 3.28 329 309 A 32 ALA HB% A 29 VAL HGy% 1.0 . 4.40 330 310 A 29 VAL HA A 32 ALA HB% 1.0 . 3.84 331 311 A 33 ILE HG2% A 36 ALA HB% 1.0 . 3.24 332 312 A 32 ALA HB% A 33 ILE H 1.0 . 3.49 333 313 A 51 LEU H A 50 SER HBx 1.0 . 3.92 334 313 A 50 SER HBy A 51 LEU H 1.0 . 3.92 335 314 A 24 VAL HGx% A 21 LEU HA 1.0 . 4.88 336 315 A 25 VAL H A 21 LEU HA 1.0 . 4.95 337 316 A 22 ALA HB% A 21 LEU HA 1.0 . 5.12 338 317 A 23 PHE H A 21 LEU HA 1.0 . 4.35 339 318 A 23 PHE HD% A 27 LEU HBy 1.0 . 5.50 340 319 A 30 THR H A 31 LEU HBx 1.0 . 4.96 341 320 A 27 LEU HBy A 30 THR HB 1.0 . 5.23 342 321 A 31 LEU HBx A 30 THR HB 1.0 . 5.47 343 322 A 33 ILE HG2% A 33 ILE HD1% 1.0 . 2.40 344 323 A 36 ALA H A 33 ILE HG2% 1.0 . 4.31 345 324 A 33 ILE HG2% A 33 ILE HA 1.0 . 3.76 346 325 A 33 ILE HG2% A 33 ILE HG1y 1.0 . 3.37 347 326 A 33 ILE HG2% A 34 LEU HA 1.0 . 3.97 348 327 A 63 LYS HBx A 63 LYS HDx 1.0 . 2.55 349 327 A 63 LYS HDy A 63 LYS HBx 1.0 . 2.55 350 328 A 63 LYS H A 63 LYS HDx 1.0 . 4.93 351 328 A 63 LYS HDy A 63 LYS H 1.0 . 4.93 352 329 A 20 PHE HD% A 17 VAL HA 1.0 . 5.33 353 330 A 20 PHE HBy A 17 VAL HA 1.0 . 4.60 354 331 A 20 PHE H A 17 VAL HA 1.0 . 4.56 355 332 A 20 PHE HBx A 17 VAL HA 1.0 . 4.53 356 333 A 18 LEU H A 19 LEU HBx 1.0 . 4.78 357 334 A 22 ALA HB% A 19 LEU HA 1.0 . 3.48 358 335 A 23 PHE HD% A 22 ALA HB% 1.0 . 4.99 359 336 A 37 LEU HDy% A 36 ALA HB% 1.0 . 3.09 360 337 A 26 PHE HBy A 22 ALA HB% 1.0 . 5.07 361 338 A 22 ALA HB% A 23 PHE H 1.0 . 3.36 362 339 A 33 ILE HB A 30 THR HA 1.0 . 4.84 363 340 A 32 ALA HB% A 33 ILE HB 1.0 . 5.28 364 341 A 33 ILE HB A 34 LEU HBx 1.0 . 5.50 365 342 A 39 LEU HDy% A 39 LEU H 1.0 . 4.37 366 343 A 43 ALA H A 42 TYR HBx 1.0 . 4.23 367 344 A 42 TYR H A 42 TYR HBx 1.0 . 4.05 368 345 A 63 LYS HBx A 64 ASN H 1.0 . 4.88 369 346 A 63 LYS HBx A 63 LYS H 1.0 . 4.15 370 347 A 51 LEU HDx% A 51 LEU HA 1.0 . 3.82 371 348 A 51 LEU HA A 51 LEU HG 1.0 . 3.69 372 349 A 37 LEU H A 34 LEU HDy% 1.0 . 3.90 373 350 A 45 ASN HBy A 45 ASN H 1.0 . 4.15 374 351 A 65 LEU HA A 64 ASN HBx 1.0 . 4.96 375 352 A 28 LEU HBx A 29 VAL HA 1.0 . 5.50 376 353 A 20 PHE HBx A 21 LEU HDx% 1.0 . 4.71 377 354 A 20 PHE HBx A 17 VAL H 1.0 . 5.12 378 355 A 26 PHE HBy A 27 LEU HG 1.0 . 5.46 379 356 A 26 PHE HBy A 25 VAL HGx% 1.0 . 5.13 380 357 A 55 THR HA A 58 VAL HB 1.0 . 4.39 381 358 A 39 LEU HBx A 39 LEU HDy% 1.0 . 3.75 382 359 A 9 THR HA A 10 GLY HAx 1.0 . 4.98 383 360 A 10 GLY HAx A 9 THR HB 1.0 . 5.50 384 361 A 11 THR HA A 10 GLY HAx 1.0 . 5.50 385 362 A 12 LEU H A 10 GLY HAx 1.0 . 5.41 386 363 A 21 LEU HBx A 17 VAL HA 1.0 . 5.50 387 364 A 17 VAL H A 17 VAL HGy% 1.0 . 3.90 388 365 A 17 VAL HA A 17 VAL HGy% 1.0 . 3.30 389 366 A 11 THR HG2% A 13 ILE H 1.0 . 3.52 390 367 A 10 GLY HAx A 9 THR HG2% 1.0 . 4.64 391 368 A 10 GLY H A 9 THR HG2% 1.0 . 4.35 392 369 A 11 THR HG2% A 8 GLU HBx 1.0 . 4.45 393 370 A 49 VAL H A 47 VAL HGx% 1.0 . 4.58 394 370 A 47 VAL HGy% A 49 VAL H 1.0 . 4.58 395 371 A 49 VAL H A 49 VAL HGx% 1.0 . 4.73 396 372 A 31 LEU HBx A 30 THR HA 1.0 . 5.50 397 373 A 30 THR HA A 33 ILE HG1y 1.0 . 4.81 398 374 A 39 LEU HG A 39 LEU H 1.0 . 4.01 399 375 A 31 LEU HBx A 32 ALA H 1.0 . 4.20 400 376 A 31 LEU HBx A 28 LEU HA 1.0 . 3.98 401 377 A 62 VAL HA A 65 LEU HBx 1.0 . 4.83 402 378 A 54 PRO HGy A 55 THR HG2% 1.0 . 4.01 403 379 A 52 VAL HB A 55 THR HG2% 1.0 . 3.93 404 380 A 56 VAL H A 55 THR HG2% 1.0 . 3.99 405 381 A 55 THR HA A 55 THR HG2% 1.0 . 3.36 406 382 A 13 ILE HB A 11 THR HG2% 1.0 . 4.57 407 383 A 55 THR H A 55 THR HG2% 1.0 . 3.67 408 384 A 38 ARG HH1% A 38 ARG HGy 1.0 . 5.50 409 385 A 38 ARG HH1% A 38 ARG HGx 1.0 . 5.50 410 386 A 45 ASN HA A 45 ASN HD2x 1.0 . 4.08 411 387 A 20 PHE HA A 23 PHE HBy 1.0 . 4.16 412 388 A 20 PHE HA A 20 PHE HE% 1.0 . 4.87 413 389 A 20 PHE HA A 23 PHE HD% 1.0 . 5.10 414 390 A 20 PHE HA A 23 PHE HBx 1.0 . 3.76 415 391 A 20 PHE HA A 23 PHE H 1.0 . 3.67 416 392 A 65 LEU HDx% A 65 LEU HA 1.0 . 3.93 417 393 A 12 LEU HDx% A 12 LEU HBx 1.0 . 2.82 418 394 A 53 LYS H A 52 VAL HGx% 1.0 . 3.19 419 395 A 52 VAL HA A 52 VAL HGx% 1.0 . 3.29 420 396 A 31 LEU HA A 31 LEU HDy% 1.0 . 2.40 421 397 A 31 LEU HA A 31 LEU HG 1.0 . 4.10 422 398 A 31 LEU HA A 35 THR H 1.0 . 5.50 423 399 A 31 LEU HA A 34 LEU HBy 1.0 . 4.14 424 400 A 49 VAL HA A 49 VAL HGx% 1.0 . 4.05 425 401 A 48 ASN HA A 47 VAL HA 1.0 . 4.86 426 402 A 48 ASN HA A 49 VAL HA 1.0 . 5.24 427 403 A 55 THR HG2% A 54 PRO HBx 1.0 . 4.09 428 404 A 53 LYS HGx A 54 PRO HBx 1.0 . 5.32 429 405 A 37 LEU HA A 37 LEU HDy% 1.0 . 3.20 430 406 A 21 LEU H A 18 LEU HA 1.0 . 4.33 431 407 A 40 ALA H A 37 LEU HA 1.0 . 4.12 432 408 A 28 LEU HDx% A 25 VAL HA 1.0 . 3.80 433 409 A 28 LEU HBy A 25 VAL HA 1.0 . 4.86 434 410 A 28 LEU HBx A 25 VAL HA 1.0 . 4.23 435 411 A 29 VAL H A 25 VAL HA 1.0 . 5.50 436 412 A 19 LEU HDx% A 19 LEU HA 1.0 . 3.45 437 413 A 19 LEU H A 19 LEU HDx% 1.0 . 4.36 438 414 A 54 PRO HDy A 51 LEU HBx 1.0 . 5.04 439 414 A 51 LEU HBy A 54 PRO HDy 1.0 . 5.04 440 415 A 55 THR HG2% A 54 PRO HGx 1.0 . 4.33 441 416 A 53 LYS HGx A 54 PRO HGx 1.0 . 4.79 442 417 A 53 LYS HGx A 54 PRO HDx 1.0 . 5.50 443 418 A 53 LYS HGx A 54 PRO HA 1.0 . 5.42 444 419 A 53 LYS HGx A 54 PRO HDy 1.0 . 5.50 445 420 A 62 VAL HA A 65 LEU HG 1.0 . 4.32 446 421 A 65 LEU HBx A 65 LEU HG 1.0 . 2.99 447 422 A 20 PHE H A 19 LEU HBx 1.0 . 3.80 448 423 A 16 SER HA A 19 LEU HBx 1.0 . 3.94 449 424 A 19 LEU H A 19 LEU HBx 1.0 . 4.06 450 425 A 19 LEU HDx% A 19 LEU HBx 1.0 . 3.34 451 426 A 15 ASN HBy A 14 VAL HGx% 1.0 . 4.64 452 427 A 48 ASN HBy A 49 VAL HGy% 1.0 . 4.97 453 428 A 12 LEU HDx% A 12 LEU HBy 1.0 . 3.48 454 429 A 13 ILE H A 12 LEU HBy 1.0 . 4.69 455 430 A 12 LEU HBy A 12 LEU HG 1.0 . 2.69 456 431 A 51 LEU HG A 51 LEU HBx 1.0 . 2.91 457 431 A 51 LEU HBy A 51 LEU HG 1.0 . 2.91 458 432 A 61 ARG HA A 61 ARG HGy 1.0 . 4.08 459 433 A 62 VAL H A 61 ARG HGy 1.0 . 4.45 460 434 A 46 ILE HG1y A 46 ILE HG2% 1.0 . 3.53 461 435 A 46 ILE HG1x A 46 ILE HG2% 1.0 . 3.21 462 436 A 47 VAL H A 46 ILE HG2% 1.0 . 4.08 463 437 A 46 ILE HD1% A 46 ILE HG2% 1.0 . 2.40 464 438 A 46 ILE HA A 46 ILE HG2% 1.0 . 3.31 465 439 A 56 VAL HGy% A 53 LYS HDy 1.0 . 4.25 466 440 A 53 LYS HDy A 54 PRO HDx 1.0 . 5.33 467 441 A 53 LYS HDy A 53 LYS HBx 1.0 . 2.83 468 442 A 61 ARG HBy A 61 ARG HDx 1.0 . 4.05 469 443 A 61 ARG HH2% A 61 ARG HDx 1.0 . 4.75 470 444 A 61 ARG HH1% A 61 ARG HDx 1.0 . 4.67 471 445 A 61 ARG HA A 61 ARG HDx 1.0 . 4.68 472 446 A 61 ARG HBx A 61 ARG HDx 1.0 . 3.47 473 447 A 29 VAL HA A 29 VAL HGx% 1.0 . 3.38 474 448 A 30 THR H A 29 VAL HGx% 1.0 . 4.08 475 449 A 26 PHE HBy A 29 VAL HGx% 1.0 . 5.08 476 450 A 29 VAL H A 29 VAL HGx% 1.0 . 3.51 477 451 A 29 VAL HGx% A 26 PHE HA 1.0 . 4.12 478 452 A 18 LEU HBy A 18 LEU HDx% 1.0 . 3.45 479 453 A 18 LEU HBx A 18 LEU HDx% 1.0 . 3.39 480 454 A 18 LEU H A 18 LEU HDx% 1.0 . 4.36 481 455 A 18 LEU HA A 18 LEU HDx% 1.0 . 4.14 482 456 A 34 LEU HBy A 34 LEU HDx% 1.0 . 3.04 483 457 A 39 LEU HDy% A 39 LEU HBy 1.0 . 3.90 484 458 A 42 TYR HBy A 43 ALA HB% 1.0 . 4.68 485 459 A 40 ALA H A 40 ALA HB% 1.0 . 2.97 486 460 A 37 LEU HA A 40 ALA HB% 1.0 . 3.60 487 461 A 40 ALA HB% A 41 ALA H 1.0 . 3.34 488 462 A 42 TYR HE% A 42 TYR HA 1.0 . 4.72 489 463 A 42 TYR HE% A 46 ILE HD1% 1.0 . 5.12 490 464 A 46 ILE HD1% A 46 ILE HA 1.0 . 4.19 491 465 A 53 LYS HBy A 53 LYS HEx 1.0 . 4.54 492 465 A 53 LYS HBy A 53 LYS HEy 1.0 . 4.54 493 466 A 53 LYS HGy A 53 LYS HEx 1.0 . 3.99 494 466 A 53 LYS HGy A 53 LYS HEy 1.0 . 3.99 495 467 A 53 LYS HBx A 53 LYS HEx 1.0 . 4.33 496 467 A 53 LYS HBx A 53 LYS HEy 1.0 . 4.33 497 468 A 53 LYS HGx A 53 LYS HEx 1.0 . 3.70 498 468 A 53 LYS HGx A 53 LYS HEy 1.0 . 3.70 499 469 A 53 LYS HA A 53 LYS HEx 1.0 . 5.38 500 469 A 53 LYS HA A 53 LYS HEy 1.0 . 5.38 501 470 A 54 PRO HA A 53 LYS HEx 1.0 . 5.50 502 470 A 54 PRO HA A 53 LYS HEy 1.0 . 5.50 503 471 A 23 PHE HA A 24 VAL HGy% 1.0 . 5.18 504 472 A 20 PHE HD% A 24 VAL HGy% 1.0 . 3.39 505 473 A 24 VAL H A 24 VAL HGy% 1.0 . 3.35 506 474 A 24 VAL HGy% A 21 LEU HA 1.0 . 3.71 507 475 A 21 LEU HBx A 24 VAL HGy% 1.0 . 5.50 508 476 A 24 VAL HGy% A 28 LEU HG 1.0 . 5.50 509 477 A 52 VAL HA A 54 PRO HDx 1.0 . 4.30 510 478 A 38 ARG HDx A 34 LEU HDy% 1.0 . 5.17 511 479 A 34 LEU HBx A 34 LEU HDy% 1.0 . 2.69 512 480 A 34 LEU HA A 34 LEU HDy% 1.0 . 2.79 513 481 A 34 LEU H A 34 LEU HDy% 1.0 . 4.40 514 482 A 59 TYR HA A 62 VAL HGx% 1.0 . 4.01 515 483 A 59 TYR HA A 58 VAL HA 1.0 . 5.09 516 484 A 59 TYR HA A 62 VAL H 1.0 . 4.62 517 485 A 53 LYS HA A 53 LYS HDy 1.0 . 4.38 518 486 A 21 LEU HA A 24 VAL HB 1.0 . 4.61 519 487 A 13 ILE HG1y A 13 ILE H 1.0 . 4.67 520 488 A 34 LEU HBx A 34 LEU HDx% 1.0 . 3.29 521 489 A 34 LEU HA A 34 LEU HDx% 1.0 . 3.84 522 490 A 34 LEU H A 34 LEU HDx% 1.0 . 4.17 523 491 A 37 LEU H A 37 LEU HG 1.0 . 4.13 524 492 A 22 ALA HB% A 21 LEU HBy 1.0 . 3.97 525 493 A 22 ALA HB% A 22 ALA H 1.0 . 2.58 526 494 A 36 ALA H A 36 ALA HB% 1.0 . 2.77 527 495 A 32 ALA HB% A 33 ILE HA 1.0 . 4.34 528 496 A 36 ALA HB% A 33 ILE HA 1.0 . 4.54 529 497 A 9 THR H A 9 THR HG2% 1.0 . 3.94 530 498 A 9 THR HA A 9 THR HG2% 1.0 . 2.92 531 499 A 33 ILE HG1x A 33 ILE HA 1.0 . 4.18 532 500 A 33 ILE HD1% A 33 ILE HA 1.0 . 4.20 533 501 A 36 ALA H A 33 ILE HA 1.0 . 4.52 534 502 A 27 LEU HDx% A 27 LEU H 1.0 . 3.94 535 503 A 27 LEU HDx% A 27 LEU HBx 1.0 . 3.32 536 504 A 27 LEU HDx% A 24 VAL HA 1.0 . 4.73 537 505 A 26 PHE HBy A 27 LEU HDx% 1.0 . 5.07 538 506 A 23 PHE HD% A 27 LEU HDx% 1.0 . 4.40 539 507 A 27 LEU HDx% A 27 LEU HA 1.0 . 3.90 540 508 A 23 PHE HE% A 27 LEU HDx% 1.0 . 4.59 541 509 A 27 LEU HDx% A 27 LEU HBy 1.0 . 3.31 542 510 A 64 ASN H A 63 LYS HEx 1.0 . 5.03 543 511 A 63 LYS HEx A 63 LYS HGx 1.0 . 4.20 544 511 A 63 LYS HGy A 63 LYS HEx 1.0 . 4.20 545 512 A 63 LYS HBx A 63 LYS HEx 1.0 . 4.67 546 513 A 63 LYS HBy A 63 LYS HEx 1.0 . 4.77 547 514 A 13 ILE HA A 17 VAL H 1.0 . 4.51 548 515 A 20 PHE HE% A 23 PHE HBx 1.0 . 5.50 549 516 A 23 PHE H A 23 PHE HBx 1.0 . 3.56 550 517 A 24 VAL H A 23 PHE HBx 1.0 . 3.67 551 518 A 63 LYS H A 61 ARG HA 1.0 . 4.37 552 519 A 11 THR HA A 12 LEU HG 1.0 . 4.45 553 520 A 27 LEU H A 28 LEU HG 1.0 . 5.12 554 521 A 29 VAL H A 28 LEU HG 1.0 . 5.40 555 522 A 28 LEU HG A 24 VAL HB 1.0 . 5.50 556 523 A 31 LEU HDy% A 32 ALA H 1.0 . 4.67 557 524 A 31 LEU HDy% A 31 LEU HBy 1.0 . 3.56 558 525 A 31 LEU HBx A 31 LEU HDy% 1.0 . 3.22 559 526 A 31 LEU H A 31 LEU HDy% 1.0 . 4.24 560 527 A 36 ALA HA A 36 ALA H 1.0 . 2.83 561 528 A 36 ALA HA A 39 LEU H 1.0 . 4.27 562 529 A 36 ALA HA A 39 LEU HDy% 1.0 . 4.51 563 530 A 39 LEU HBx A 36 ALA HA 1.0 . 3.93 564 531 A 36 ALA HA A 39 LEU HBy 1.0 . 5.50 565 532 A 36 ALA HA A 39 LEU HG 1.0 . 5.50 566 533 A 21 LEU HDy% A 21 LEU HBy 1.0 . 3.24 567 534 A 21 LEU HA A 21 LEU HDx% 1.0 . 3.14 568 535 A 21 LEU HDy% A 21 LEU HA 1.0 . 3.50 569 536 A 21 LEU HBx A 21 LEU HDx% 1.0 . 3.01 570 537 A 18 LEU HA A 18 LEU HG 1.0 . 4.27 571 538 A 21 LEU HBx A 18 LEU HA 1.0 . 4.74 572 539 A 18 LEU HA A 17 VAL HGy% 1.0 . 4.98 573 540 A 8 GLU HA A 8 GLU HGy 1.0 . 3.90 574 541 A 8 GLU H1 A 8 GLU HGy 1.0 . 3.97 575 542 A 15 ASN H A 14 VAL HGx% 1.0 . 3.31 576 543 A 14 VAL H A 14 VAL HGx% 1.0 . 3.21 577 544 A 65 LEU HA A 64 ASN HBy 1.0 . 4.68 578 545 A 47 VAL HA A 47 VAL HGx% 1.0 . 2.76 579 545 A 47 VAL HGy% A 47 VAL HA 1.0 . 2.76 580 546 A 62 VAL HGy% A 59 TYR HA 1.0 . 3.17 581 547 A 52 VAL HGy% A 55 THR HG2% 1.0 . 2.70 582 548 A 58 VAL HGy% A 58 VAL H 1.0 . 3.92 583 549 A 22 ALA HA A 25 VAL HGy% 1.0 . 3.88 584 550 A 25 VAL H A 25 VAL HGy% 1.0 . 3.41 585 551 A 26 PHE H A 25 VAL HGy% 1.0 . 4.15 586 552 A 25 VAL HA A 25 VAL HGy% 1.0 . 3.46 587 553 A 38 ARG HA A 38 ARG HGx 1.0 . 3.53 588 554 A 38 ARG HA A 41 ALA H 1.0 . 4.36 589 555 A 60 SER HA A 63 LYS HBy 1.0 . 4.02 590 556 A 63 LYS HBy A 63 LYS HGx 1.0 . 2.97 591 556 A 63 LYS HBy A 63 LYS HGy 1.0 . 2.97 592 557 A 63 LYS HBy A 63 LYS HDx 1.0 . 2.55 593 557 A 63 LYS HDy A 63 LYS HBy 1.0 . 2.55 594 558 A 15 ASN H A 12 LEU HA 1.0 . 4.03 595 559 A 39 LEU HA A 41 ALA H 1.0 . 4.53 596 560 A 12 LEU HA A 14 VAL HGx% 1.0 . 4.52 597 561 A 39 LEU HDx% A 39 LEU HA 1.0 . 3.70 598 562 A 12 LEU HA A 12 LEU HG 1.0 . 3.91 599 563 A 53 LYS HBy A 54 PRO HDy 1.0 . 2.88 600 564 A 53 LYS HGy A 54 PRO HDy 1.0 . 5.50 601 565 A 53 LYS HBx A 54 PRO HDy 1.0 . 4.74 602 566 A 17 VAL HGx% A 20 PHE HBy 1.0 . 5.50 603 567 A 17 VAL HGx% A 16 SER HA 1.0 . 5.09 604 568 A 13 ILE HD1% A 17 VAL HGx% 1.0 . 3.14 605 569 A 17 VAL HGx% A 17 VAL H 1.0 . 3.25 606 570 A 17 VAL HGx% A 17 VAL HA 1.0 . 3.32 607 571 A 49 VAL H A 48 ASN HBx 1.0 . 4.66 608 572 A 48 ASN H A 48 ASN HBx 1.0 . 3.71 609 573 A 39 LEU HDx% A 39 LEU HBy 1.0 . 3.84 610 574 A 29 VAL H A 28 LEU HBy 1.0 . 4.51 611 575 A 40 ALA H A 39 LEU HBy 1.0 . 4.38 612 576 A 30 THR HG2% A 26 PHE HA 1.0 . 5.50 613 577 A 26 PHE HD% A 26 PHE HA 1.0 . 5.50 614 578 A 49 VAL H A 49 VAL HGy% 1.0 . 3.23 615 579 A 48 ASN H A 49 VAL HGy% 1.0 . 4.83 616 580 A 50 SER H A 49 VAL HGy% 1.0 . 4.99 617 581 A 49 VAL HA A 49 VAL HGy% 1.0 . 3.30 618 582 A 48 ASN HA A 49 VAL HGy% 1.0 . 4.25 619 583 A 15 ASN H A 16 SER HBx 1.0 . 4.96 620 583 A 15 ASN H A 16 SER HBy 1.0 . 4.96 621 584 A 15 ASN H A 17 VAL H 1.0 . 4.40 622 585 A 15 ASN H A 15 ASN HBy 1.0 . 3.86 623 586 A 14 VAL H A 15 ASN H 1.0 . 4.42 624 587 A 15 ASN H A 13 ILE HA 1.0 . 4.51 625 588 A 23 PHE HA A 27 LEU H 1.0 . 4.41 626 589 A 27 LEU H A 27 LEU HBx 1.0 . 3.79 627 590 A 27 LEU H A 27 LEU HG 1.0 . 3.19 628 591 A 26 PHE HD% A 27 LEU H 1.0 . 4.79 629 592 A 27 LEU H A 26 PHE HBx 1.0 . 4.05 630 593 A 30 THR H A 27 LEU H 1.0 . 4.84 631 594 A 23 PHE HE% A 27 LEU H 1.0 . 5.50 632 595 A 27 LEU H A 27 LEU HBy 1.0 . 3.63 633 596 A 26 PHE HBy A 27 LEU H 1.0 . 3.70 634 597 A 27 LEU H A 26 PHE H 1.0 . 2.90 635 598 A 27 LEU H A 25 VAL HA 1.0 . 5.09 636 599 A 48 ASN HD2y A 48 ASN HBx 1.0 . 4.03 637 600 A 49 VAL HB A 49 VAL H 1.0 . 3.81 638 601 A 48 ASN H A 49 VAL H 1.0 . 4.58 639 602 A 48 ASN HBy A 49 VAL H 1.0 . 4.38 640 603 A 48 ASN HA A 49 VAL H 1.0 . 3.52 641 604 A 24 VAL H A 24 VAL HGx% 1.0 . 3.95 642 605 A 24 VAL H A 22 ALA H 1.0 . 4.76 643 606 A 24 VAL H A 23 PHE HBy 1.0 . 4.19 644 607 A 24 VAL H A 25 VAL H 1.0 . 3.38 645 608 A 24 VAL H A 21 LEU HA 1.0 . 4.14 646 609 A 20 PHE HA A 24 VAL H 1.0 . 4.89 647 610 A 24 VAL H A 26 PHE H 1.0 . 4.44 648 611 A 24 VAL H A 24 VAL HB 1.0 . 3.76 649 612 A 20 PHE HD% A 20 PHE H 1.0 . 4.72 650 613 A 20 PHE H A 16 SER HA 1.0 . 4.29 651 614 A 20 PHE HBx A 20 PHE H 1.0 . 4.08 652 615 A 20 PHE HA A 20 PHE H 1.0 . 2.87 653 616 A 18 LEU H A 20 PHE H 1.0 . 4.95 654 617 A 48 ASN H A 47 VAL HGx% 1.0 . 3.77 655 617 A 47 VAL HGy% A 48 ASN H 1.0 . 3.77 656 618 A 47 VAL H A 48 ASN H 1.0 . 4.55 657 619 A 48 ASN HBy A 48 ASN H 1.0 . 4.08 658 620 A 48 ASN H A 47 VAL HA 1.0 . 3.35 659 621 A 9 THR HA A 10 GLY H 1.0 . 3.34 660 622 A 11 THR H A 10 GLY H 1.0 . 3.86 661 623 A 16 SER H A 14 VAL HGx% 1.0 . 4.65 662 624 A 15 ASN HBx A 16 SER H 1.0 . 4.31 663 625 A 13 ILE HG2% A 16 SER H 1.0 . 4.84 664 626 A 13 ILE HA A 16 SER H 1.0 . 4.13 665 627 A 12 LEU HA A 16 SER H 1.0 . 4.71 666 628 A 49 VAL HB A 50 SER H 1.0 . 4.16 667 629 A 57 TYR HE% A 56 VAL H 1.0 . 5.11 668 630 A 56 VAL H A 56 VAL HB 1.0 . 3.81 669 631 A 56 VAL H A 55 THR H 1.0 . 3.69 670 632 A 57 TYR HD% A 56 VAL H 1.0 . 4.51 671 633 A 65 LEU HBy A 65 LEU H 1.0 . 3.68 672 634 A 64 ASN HA A 65 LEU H 1.0 . 3.51 673 635 A 65 LEU HDy% A 65 LEU H 1.0 . 4.34 674 636 A 65 LEU H A 64 ASN HBx 1.0 . 4.18 675 637 A 62 VAL HA A 65 LEU H 1.0 . 4.04 676 638 A 65 LEU HDx% A 65 LEU H 1.0 . 4.34 677 639 A 65 LEU HBx A 65 LEU H 1.0 . 3.37 678 640 A 65 LEU HG A 65 LEU H 1.0 . 4.19 679 641 A 65 LEU H A 64 ASN HBy 1.0 . 4.37 680 642 A 64 ASN H A 65 LEU H 1.0 . 2.85 681 643 A 64 ASN H A 63 LYS HGx 1.0 . 4.59 682 643 A 64 ASN H A 63 LYS HGy 1.0 . 4.59 683 644 A 64 ASN H A 61 ARG HA 1.0 . 4.84 684 645 A 64 ASN H A 63 LYS HDx 1.0 . 4.84 685 645 A 63 LYS HDy A 64 ASN H 1.0 . 4.84 686 646 A 64 ASN H A 64 ASN HBx 1.0 . 3.60 687 647 A 62 VAL HA A 64 ASN H 1.0 . 4.75 688 648 A 62 VAL H A 64 ASN H 1.0 . 4.76 689 649 A 64 ASN H A 63 LYS HEy 1.0 . 4.76 690 650 A 64 ASN H A 63 LYS HBy 1.0 . 4.54 691 651 A 21 LEU H A 21 LEU HBy 1.0 . 3.69 692 652 A 21 LEU H A 20 PHE HBy 1.0 . 4.18 693 653 A 21 LEU H A 20 PHE H 1.0 . 4.47 694 654 A 21 LEU H A 19 LEU HA 1.0 . 5.50 695 655 A 21 LEU H A 20 PHE HBx 1.0 . 4.24 696 656 A 21 LEU H A 23 PHE H 1.0 . 4.96 697 657 A 21 LEU H A 21 LEU HDx% 1.0 . 2.85 698 658 A 32 ALA H A 33 ILE HG1y 1.0 . 5.50 699 659 A 33 ILE HG1x A 32 ALA H 1.0 . 4.54 700 660 A 29 VAL HA A 32 ALA H 1.0 . 4.41 701 661 A 31 LEU HBy A 32 ALA H 1.0 . 4.10 702 662 A 30 THR H A 32 ALA H 1.0 . 5.11 703 663 A 30 THR HA A 32 ALA H 1.0 . 5.15 704 664 A 32 ALA HA A 32 ALA H 1.0 . 2.91 705 665 A 31 LEU H A 32 ALA H 1.0 . 3.92 706 666 A 33 ILE H A 32 ALA H 1.0 . 3.87 707 667 A 31 LEU HDx% A 32 ALA H 1.0 . 4.31 708 668 A 59 TYR H A 59 TYR HBx 1.0 . 3.56 709 668 A 59 TYR H A 59 TYR HBy 1.0 . 3.56 710 669 A 59 TYR H A 55 THR HA 1.0 . 5.50 711 670 A 59 TYR H A 58 VAL HB 1.0 . 4.05 712 671 A 59 TYR H A 60 SER H 1.0 . 3.50 713 672 A 59 TYR H A 58 VAL H 1.0 . 3.55 714 673 A 59 TYR H A 58 VAL HGy% 1.0 . 4.22 715 674 A 62 VAL HGy% A 59 TYR H 1.0 . 4.86 716 675 A 9 THR H A 10 GLY H 1.0 . 3.51 717 676 A 9 THR H A 8 GLU HA 1.0 . 3.55 718 677 A 9 THR H A 9 THR HB 1.0 . 3.53 719 678 A 9 THR H A 8 GLU HGx 1.0 . 4.71 720 679 A 8 GLU HBy A 9 THR H 1.0 . 3.95 721 680 A 9 THR H A 8 GLU HGy 1.0 . 4.75 722 681 A 9 THR H A 8 GLU H1 1.0 . 4.65 723 682 A 13 ILE H A 12 LEU HA 1.0 . 3.45 724 683 A 13 ILE H A 12 LEU HG 1.0 . 4.45 725 684 A 46 ILE HG1y A 47 VAL H 1.0 . 4.41 726 685 A 47 VAL H A 46 ILE HG1x 1.0 . 5.04 727 686 A 46 ILE H A 47 VAL H 1.0 . 3.56 728 687 A 47 VAL H A 46 ILE HB 1.0 . 4.25 729 688 A 28 LEU H A 28 LEU HBy 1.0 . 4.05 730 689 A 28 LEU H A 27 LEU HBx 1.0 . 4.04 731 690 A 28 LEU H A 27 LEU HBy 1.0 . 3.97 732 691 A 28 LEU H A 27 LEU H 1.0 . 3.52 733 692 A 26 PHE H A 25 VAL H 1.0 . 3.38 734 693 A 28 LEU H A 28 LEU HG 1.0 . 3.87 735 694 A 57 TYR H A 56 VAL H 1.0 . 3.94 736 695 A 59 TYR H A 57 TYR H 1.0 . 4.45 737 696 A 57 TYR H A 55 THR HA 1.0 . 4.35 738 697 A 57 TYR H A 56 VAL HB 1.0 . 3.90 739 698 A 57 TYR H A 55 THR H 1.0 . 4.95 740 699 A 57 TYR H A 57 TYR HBx 1.0 . 3.49 741 699 A 57 TYR H A 57 TYR HBy 1.0 . 3.49 742 700 A 57 TYR H A 57 TYR HD% 1.0 . 4.41 743 701 A 57 TYR H A 54 PRO HA 1.0 . 4.46 744 702 A 21 LEU HBy A 22 ALA H 1.0 . 3.96 745 703 A 23 PHE H A 22 ALA H 1.0 . 3.82 746 704 A 20 PHE H A 22 ALA H 1.0 . 4.65 747 705 A 19 LEU HA A 22 ALA H 1.0 . 5.50 748 706 A 31 LEU HBx A 31 LEU H 1.0 . 3.69 749 707 A 20 PHE HA A 22 ALA H 1.0 . 4.91 750 708 A 18 LEU HA A 22 ALA H 1.0 . 5.08 751 709 A 64 ASN H A 64 ASN HD2y 1.0 . 4.06 752 710 A 64 ASN HBx A 64 ASN HD2y 1.0 . 3.56 753 711 A 63 LYS HEy A 64 ASN HD2y 1.0 . 3.80 754 712 A 15 ASN HA A 15 ASN HD2y 1.0 . 4.22 755 713 A 35 THR H A 34 LEU HBx 1.0 . 4.38 756 714 A 35 THR H A 36 ALA H 1.0 . 4.13 757 715 A 35 THR H A 33 ILE H 1.0 . 4.30 758 716 A 35 THR H A 34 LEU HBy 1.0 . 4.29 759 717 A 35 THR H A 34 LEU HDy% 1.0 . 4.31 760 718 A 35 THR H A 35 THR HB 1.0 . 4.09 761 719 A 35 THR H A 33 ILE HA 1.0 . 5.19 762 720 A 50 SER H A 49 VAL H 1.0 . 4.51 763 721 A 50 SER H A 49 VAL HA 1.0 . 2.82 764 722 A 50 SER H A 50 SER HBx 1.0 . 3.17 765 722 A 50 SER HBy A 50 SER H 1.0 . 3.17 766 723 A 50 SER H A 49 VAL HGx% 1.0 . 3.16 767 724 A 15 ASN H A 15 ASN HD2y 1.0 . 4.47 768 725 A 15 ASN HBx A 15 ASN HD2y 1.0 . 3.36 769 726 A 15 ASN HBy A 15 ASN HD2y 1.0 . 3.63 770 727 A 51 LEU H A 51 LEU HBx 1.0 . 3.45 771 727 A 51 LEU HBy A 51 LEU H 1.0 . 3.45 772 728 A 14 VAL H A 12 LEU H 1.0 . 4.85 773 729 A 52 VAL H A 51 LEU H 1.0 . 5.17 774 730 A 51 LEU H A 51 LEU HG 1.0 . 3.92 775 731 A 51 LEU H A 50 SER HA 1.0 . 3.41 776 732 A 61 ARG HBy A 61 ARG HE 1.0 . 4.32 777 733 A 61 ARG HGx A 61 ARG HE 1.0 . 3.98 778 734 A 61 ARG HBx A 61 ARG HE 1.0 . 4.53 779 735 A 61 ARG HGy A 61 ARG HE 1.0 . 4.14 780 736 A 30 THR H A 29 VAL HB 1.0 . 4.28 781 737 A 30 THR H A 32 ALA HB% 1.0 . 5.43 782 738 A 30 THR HG2% A 30 THR H 1.0 . 3.89 783 739 A 30 THR H A 27 LEU HA 1.0 . 4.65 784 740 A 30 THR H A 29 VAL H 1.0 . 3.78 785 741 A 30 THR H A 31 LEU H 1.0 . 3.78 786 742 A 30 THR H A 30 THR HB 1.0 . 4.20 787 743 A 46 ILE HG1y A 46 ILE H 1.0 . 3.78 788 744 A 46 ILE H A 46 ILE HG1x 1.0 . 4.11 789 745 A 46 ILE H A 46 ILE HB 1.0 . 3.79 790 746 A 46 ILE H A 46 ILE HG2% 1.0 . 3.73 791 747 A 46 ILE H A 45 ASN H 1.0 . 3.30 792 748 A 17 VAL HB A 17 VAL H 1.0 . 3.93 793 749 A 16 SER H A 17 VAL H 1.0 . 3.76 794 750 A 18 LEU H A 17 VAL H 1.0 . 3.10 795 751 A 36 ALA H A 33 ILE HB 1.0 . 5.50 796 752 A 36 ALA H A 34 LEU H 1.0 . 4.94 797 753 A 36 ALA H A 38 ARG H 1.0 . 5.14 798 754 A 36 ALA H A 35 THR HB 1.0 . 4.21 799 755 A 42 TYR H A 44 ALA H 1.0 . 4.39 800 756 A 43 ALA H A 44 ALA H 1.0 . 4.08 801 757 A 45 ASN H A 44 ALA H 1.0 . 3.60 802 758 A 11 THR H A 9 THR H 1.0 . 4.23 803 759 A 8 GLU HBy A 11 THR H 1.0 . 5.20 804 760 A 52 VAL H A 51 LEU HA 1.0 . 3.47 805 761 A 55 THR H A 52 VAL H 1.0 . 5.16 806 762 A 52 VAL H A 51 LEU HG 1.0 . 4.49 807 763 A 25 VAL HB A 25 VAL H 1.0 . 3.76 808 764 A 25 VAL H A 25 VAL HGx% 1.0 . 3.55 809 765 A 25 VAL H A 24 VAL HB 1.0 . 4.02 810 766 A 39 LEU HDx% A 39 LEU H 1.0 . 4.22 811 767 A 38 ARG HBx A 39 LEU H 1.0 . 4.65 812 768 A 39 LEU H A 40 ALA HB% 1.0 . 4.50 813 769 A 39 LEU H A 38 ARG HBy 1.0 . 4.55 814 770 A 35 THR HA A 39 LEU H 1.0 . 5.33 815 771 A 40 ALA H A 39 LEU H 1.0 . 4.00 816 772 A 37 LEU HA A 39 LEU H 1.0 . 4.94 817 773 A 42 TYR HD% A 39 LEU H 1.0 . 5.50 818 774 A 35 THR HB A 39 LEU H 1.0 . 5.50 819 775 A 20 PHE H A 19 LEU H 1.0 . 4.09 820 776 A 19 LEU H A 18 LEU HDy% 1.0 . 4.46 821 777 A 18 LEU H A 19 LEU H 1.0 . 4.81 822 778 A 53 LYS H A 53 LYS HDx 1.0 . 5.50 823 779 A 53 LYS H A 53 LYS HBy 1.0 . 3.61 824 780 A 53 LYS H A 54 PRO HDx 1.0 . 2.72 825 781 A 53 LYS H A 51 LEU HBx 1.0 . 3.97 826 781 A 53 LYS H A 51 LEU HBy 1.0 . 3.97 827 782 A 53 LYS H A 53 LYS HBx 1.0 . 3.68 828 783 A 53 LYS HGx A 53 LYS H 1.0 . 4.33 829 784 A 53 LYS H A 53 LYS HDy 1.0 . 4.76 830 785 A 53 LYS H A 53 LYS HEx 1.0 . 5.50 831 785 A 53 LYS H A 53 LYS HEy 1.0 . 5.50 832 786 A 52 VAL HA A 53 LYS H 1.0 . 3.48 833 787 A 53 LYS H A 54 PRO HDy 1.0 . 3.65 834 788 A 34 LEU H A 34 LEU HBx 1.0 . 3.78 835 789 A 35 THR H A 34 LEU H 1.0 . 4.28 836 790 A 34 LEU H A 34 LEU HBy 1.0 . 2.55 837 791 A 33 ILE HB A 34 LEU H 1.0 . 3.86 838 792 A 30 THR HA A 34 LEU H 1.0 . 5.14 839 793 A 31 LEU HA A 34 LEU H 1.0 . 4.51 840 794 A 33 ILE H A 34 LEU H 1.0 . 4.28 841 795 A 33 ILE HG2% A 34 LEU H 1.0 . 3.67 842 796 A 60 SER HA A 63 LYS H 1.0 . 3.55 843 797 A 63 LYS H A 65 LEU H 1.0 . 4.01 844 798 A 63 LYS H A 63 LYS HGx 1.0 . 4.11 845 798 A 63 LYS H A 63 LYS HGy 1.0 . 4.11 846 799 A 63 LYS H A 62 VAL HB 1.0 . 3.92 847 800 A 62 VAL HA A 63 LYS H 1.0 . 3.56 848 801 A 62 VAL H A 63 LYS H 1.0 . 2.89 849 802 A 63 LYS H A 63 LYS HBy 1.0 . 3.31 850 803 A 64 ASN H A 63 LYS H 1.0 . 2.85 851 804 A 39 LEU HDx% A 40 ALA H 1.0 . 4.61 852 805 A 39 LEU HBx A 40 ALA H 1.0 . 2.85 853 806 A 42 TYR HD% A 40 ALA H 1.0 . 5.50 854 807 A 42 TYR H A 40 ALA H 1.0 . 4.73 855 808 A 39 LEU HG A 40 ALA H 1.0 . 5.50 856 809 A 43 ALA H A 41 ALA HA 1.0 . 4.62 857 810 A 37 LEU H A 37 LEU HDx% 1.0 . 4.12 858 811 A 37 LEU H A 35 THR H 1.0 . 5.44 859 812 A 37 LEU H A 36 ALA HB% 1.0 . 4.11 860 813 A 29 VAL H A 29 VAL HB 1.0 . 3.82 861 814 A 21 LEU H A 21 LEU HBx 1.0 . 3.73 862 815 A 28 LEU H A 29 VAL H 1.0 . 3.91 863 816 A 29 VAL H A 28 LEU HDy% 1.0 . 5.05 864 817 A 28 LEU HBx A 29 VAL H 1.0 . 4.20 865 818 A 29 VAL H A 29 VAL HGy% 1.0 . 3.79 866 819 A 29 VAL H A 26 PHE HA 1.0 . 4.24 867 820 A 23 PHE HA A 26 PHE H 1.0 . 4.39 868 821 A 26 PHE H A 23 PHE H 1.0 . 5.44 869 822 A 26 PHE H A 25 VAL HB 1.0 . 4.03 870 823 A 26 PHE HBx A 26 PHE H 1.0 . 3.70 871 824 A 26 PHE HBy A 26 PHE H 1.0 . 3.59 872 825 A 26 PHE HD% A 26 PHE H 1.0 . 4.82 873 826 A 64 ASN HD2x A 64 ASN H 1.0 . 3.88 874 827 A 64 ASN HD2x A 64 ASN HBx 1.0 . 3.59 875 828 A 64 ASN HD2x A 63 LYS HEy 1.0 . 4.11 876 829 A 15 ASN HBx A 15 ASN HD2x 1.0 . 3.68 877 830 A 15 ASN HBy A 15 ASN HD2x 1.0 . 3.99 878 831 A 31 LEU H A 30 THR HB 1.0 . 3.45 879 832 A 30 THR HG2% A 31 LEU H 1.0 . 3.85 880 833 A 31 LEU H A 31 LEU HG 1.0 . 4.63 881 834 A 21 LEU HBx A 22 ALA H 1.0 . 3.94 882 835 A 21 LEU H A 22 ALA H 1.0 . 2.94 883 836 A 38 ARG HA A 38 ARG HE 1.0 . 4.96 884 837 A 41 ALA HB% A 41 ALA H 1.0 . 3.40 885 838 A 39 LEU H A 41 ALA H 1.0 . 4.72 886 839 A 40 ALA H A 41 ALA H 1.0 . 4.09 887 840 A 42 TYR H A 41 ALA H 1.0 . 3.65 888 841 A 55 THR H A 54 PRO HGy 1.0 . 4.48 889 842 A 55 THR H A 54 PRO HDx 1.0 . 4.24 890 843 A 55 THR H A 55 THR HB 1.0 . 4.15 891 844 A 55 THR H A 54 PRO HBx 1.0 . 4.08 892 845 A 55 THR H A 53 LYS HA 1.0 . 4.38 893 846 A 33 ILE HG1x A 33 ILE H 1.0 . 3.99 894 847 A 33 ILE H A 34 LEU HA 1.0 . 5.50 895 848 A 33 ILE HG2% A 33 ILE H 1.0 . 3.98 896 849 A 33 ILE HB A 33 ILE H 1.0 . 3.87 897 850 A 30 THR HA A 33 ILE H 1.0 . 4.34 898 851 A 33 ILE H A 33 ILE HG1y 1.0 . 3.86 899 852 A 12 LEU H A 12 LEU HDx% 1.0 . 3.72 900 853 A 51 LEU HDx% A 51 LEU H 1.0 . 4.02 901 854 A 52 VAL HA A 51 LEU H 1.0 . 5.50 902 855 A 11 THR HG2% A 12 LEU H 1.0 . 3.74 903 856 A 11 THR H A 12 LEU H 1.0 . 4.43 904 857 A 12 LEU H A 13 ILE HA 1.0 . 4.85 905 858 A 12 LEU H A 12 LEU HBy 1.0 . 3.31 906 859 A 12 LEU H A 13 ILE H 1.0 . 3.27 907 860 A 12 LEU H A 12 LEU HG 1.0 . 3.48 908 861 A 11 THR HA A 12 LEU H 1.0 . 2.94 909 862 A 52 VAL H A 53 LYS H 1.0 . 3.65 910 863 A 14 VAL H A 11 THR HB 1.0 . 4.73 911 864 A 14 VAL H A 12 LEU HA 1.0 . 4.93 912 865 A 52 VAL H A 53 LYS HBy 1.0 . 4.87 913 866 A 14 VAL H A 14 VAL HB 1.0 . 3.57 914 867 A 14 VAL H A 13 ILE HG2% 1.0 . 3.26 915 868 A 14 VAL H A 14 VAL HGy% 1.0 . 3.80 916 869 A 52 VAL H A 54 PRO HDx 1.0 . 4.62 917 870 A 14 VAL H A 13 ILE H 1.0 . 4.45 918 871 A 52 VAL H A 52 VAL HGx% 1.0 . 3.63 919 872 A 60 SER H A 58 VAL HGy% 1.0 . 5.47 920 873 A 62 VAL HGy% A 60 SER H 1.0 . 5.50 921 874 A 60 SER H A 56 VAL HA 1.0 . 5.05 922 875 A 60 SER H A 59 TYR HBx 1.0 . 3.82 923 875 A 60 SER H A 59 TYR HBy 1.0 . 3.82 924 876 A 60 SER H A 60 SER HBx 1.0 . 3.60 925 876 A 60 SER H A 60 SER HBy 1.0 . 3.60 926 877 A 62 VAL HGy% A 62 VAL H 1.0 . 3.54 927 878 A 62 VAL H A 61 ARG HBy 1.0 . 4.14 928 879 A 62 VAL H A 58 VAL HA 1.0 . 4.54 929 880 A 62 VAL H A 62 VAL HB 1.0 . 3.72 930 881 A 62 VAL H A 61 ARG HBx 1.0 . 4.08 931 882 A 62 VAL H A 65 LEU HBx 1.0 . 5.50 932 883 A 60 SER H A 62 VAL H 1.0 . 4.94 933 884 A 62 VAL H A 61 ARG H 1.0 . 3.34 934 885 A 38 ARG H A 37 LEU HBx 1.0 . 4.14 935 885 A 37 LEU HBy A 38 ARG H 1.0 . 4.14 936 886 A 38 ARG HBx A 38 ARG H 1.0 . 3.76 937 887 A 38 ARG HDx A 38 ARG H 1.0 . 4.36 938 888 A 38 ARG H A 38 ARG HBy 1.0 . 4.17 939 889 A 38 ARG H A 38 ARG HDy 1.0 . 5.50 940 890 A 37 LEU H A 38 ARG H 1.0 . 2.70 941 891 A 36 ALA HA A 38 ARG H 1.0 . 4.67 942 892 A 38 ARG H A 39 LEU H 1.0 . 3.91 943 893 A 40 ALA H A 38 ARG H 1.0 . 4.21 944 894 A 38 ARG H A 38 ARG HGy 1.0 . 5.04 945 895 A 38 ARG H A 38 ARG HGx 1.0 . 5.37 946 896 A 38 ARG H A 38 ARG HE 1.0 . 5.13 947 897 A 56 VAL HA A 58 VAL H 1.0 . 3.92 948 898 A 56 VAL H A 58 VAL H 1.0 . 4.37 949 899 A 57 TYR H A 58 VAL H 1.0 . 3.01 950 900 A 58 VAL H A 58 VAL HB 1.0 . 3.80 951 901 A 58 VAL H A 57 TYR HBx 1.0 . 4.22 952 901 A 58 VAL H A 57 TYR HBy 1.0 . 4.22 953 902 A 11 THR HA A 13 ILE H 1.0 . 3.93 954 903 A 13 ILE HB A 13 ILE H 1.0 . 3.75 955 904 A 13 ILE HG2% A 13 ILE H 1.0 . 3.84 956 905 A 13 ILE H A 12 LEU HBx 1.0 . 4.90 957 906 A 24 VAL HGy% A 23 PHE H 1.0 . 4.49 958 907 A 23 PHE HD% A 23 PHE H 1.0 . 5.50 959 908 A 18 LEU H A 15 ASN H 1.0 . 5.50 960 909 A 18 LEU H A 16 SER H 1.0 . 4.22 961 910 A 18 LEU H A 18 LEU HG 1.0 . 4.62 962 911 A 18 LEU H A 18 LEU HDy% 1.0 . 4.21 963 912 A 18 LEU H A 17 VAL HGy% 1.0 . 4.92 964 913 A 46 ILE HD1% A 46 ILE H 1.0 . 4.02 965 914 A 62 VAL HGy% A 63 LYS H 1.0 . 2.78 966 915 A 61 ARG HBy A 61 ARG H 1.0 . 3.45 967 916 A 58 VAL HA A 61 ARG H 1.0 . 4.24 968 917 A 56 VAL H A 57 TYR HBx 1.0 . 5.28 969 917 A 56 VAL H A 57 TYR HBy 1.0 . 5.28 970 918 A 61 ARG H A 59 TYR HBx 1.0 . 5.50 971 918 A 59 TYR HBy A 61 ARG H 1.0 . 5.50 972 919 A 61 ARG HDy A 61 ARG H 1.0 . 5.50 973 920 A 61 ARG HGx A 61 ARG H 1.0 . 3.82 974 921 A 63 LYS H A 61 ARG H 1.0 . 4.10 975 922 A 61 ARG HBx A 61 ARG H 1.0 . 3.77 976 923 A 61 ARG HGy A 61 ARG H 1.0 . 3.82 977 924 A 61 ARG HDx A 61 ARG H 1.0 . 4.69 978 925 A 60 SER H A 61 ARG H 1.0 . 3.68 979 926 A 61 ARG H A 60 SER HBx 1.0 . 3.74 980 926 A 60 SER HBy A 61 ARG H 1.0 . 3.74 981 927 A 8 GLU HBx A 8 GLU H1 1.0 . 3.75 982 928 A 8 GLU HBy A 8 GLU H1 1.0 . 4.08 983 929 A 45 ASN HD2y A 45 ASN H 1.0 . 4.93 984 930 A 42 TYR HA A 45 ASN H 1.0 . 4.62 985 931 A 42 TYR H A 42 TYR HBy 1.0 . 4.09 986 932 A 42 TYR H A 40 ALA HA 1.0 . 4.58 987 933 A 42 TYR H A 41 ALA HB% 1.0 . 4.06 988 934 A 42 TYR H A 38 ARG HGx 1.0 . 5.50 989 935 A 42 TYR H A 43 ALA H 1.0 . 4.29 stop_ save_