data_nef_c18732_2lyx save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 18733 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 GLU middle . . 3 A 3 GLU middle . . 4 A 4 THR middle . . 5 A 5 PRO middle . false 6 A 6 LEU middle . . 7 A 7 VAL middle . . 8 A 8 THR middle . . 9 A 9 ALA middle . . 10 A 10 ARG middle . . 11 A 11 HIS middle . . 12 A 12 MET middle . . 13 A 13 SER middle . . 14 A 14 LYS middle . . 15 A 15 TRP middle . . 16 A 16 GLU middle . . 17 A 17 GLU middle . . 18 A 18 ILE middle . . 19 A 19 ALA middle . . 20 A 20 VAL middle . . 21 A 21 LYS middle . . 22 A 22 GLU middle . . 23 A 23 ALA middle . . 24 A 24 LYS middle . . 25 A 25 LYS middle . . 26 A 26 ARG middle . . 27 A 27 TYR middle . . 28 A 28 PRO middle . false 29 A 29 LEU middle . . 30 A 30 ALA middle . . 31 A 31 GLN middle . . 32 A 32 VAL middle . . 33 A 33 LEU middle . . 34 A 34 PHE middle . . 35 A 35 LYS middle . . 36 A 36 GLN middle . . 37 A 37 LYS middle . . 38 A 38 VAL middle . . 39 A 39 TRP middle . . 40 A 40 ASP middle . . 41 A 41 ARG middle . . 42 A 42 LYS middle . . 43 A 43 ARG middle . . 44 A 44 LYS middle . . 45 A 45 ASP middle . . 46 A 46 GLU middle . . 47 A 47 ALA middle . . 48 A 48 VAL middle . . 49 A 49 LYS middle . . 50 A 50 GLN middle . . 51 A 51 TYR middle . . 52 A 52 HIS middle . . 53 A 53 LEU middle . . 54 A 54 THR middle . . 55 A 55 LEU middle . . 56 A 56 ARG middle . . 57 A 57 GLU middle . . 58 A 58 GLY middle . false 59 A 59 SER middle . . 60 A 60 LYS middle . . 61 A 61 GLU middle . . 62 A 62 PHE middle . . 63 A 63 GLY middle . false 64 A 64 VAL middle . . 65 A 65 PHE middle . . 66 A 66 VAL middle . . 67 A 67 THR middle . . 68 A 68 ILE middle . . 69 A 69 SER middle . . 70 A 70 PHE middle . . 71 A 71 ASP middle . . 72 A 72 PRO middle . false 73 A 73 TYR middle . . 74 A 74 SER middle . . 75 A 75 GLN middle . . 76 A 76 LYS middle . . 77 A 77 VAL middle . . 78 A 78 ASN middle . . 79 A 79 LYS middle . . 80 A 80 ILE middle . . 81 A 81 ALA middle . . 82 A 82 ILE middle . . 83 A 83 LEU middle . . 84 A 84 GLU middle . . 85 A 85 GLU middle . . 86 A 86 TYR middle . . 87 A 87 GLN end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HA3 H 1 3.952 0.000 A 1 GLY CA C 13 40.894 0.000 A 2 GLU H H 1 8.700 0.000 A 2 GLU CA C 13 53.965 0.000 A 2 GLU CB C 13 27.978 0.000 A 2 GLU N N 15 120.598 0.000 A 3 GLU H H 1 8.087 0.000 A 3 GLU HA H 1 4.198 0.000 A 3 GLU HB2 H 1 2.150 0.000 A 3 GLU HB3 H 1 2.150 0.000 A 3 GLU HG2 H 1 0.993 0.000 A 3 GLU HG3 H 1 0.993 0.000 A 3 GLU CA C 13 60.035 0.000 A 3 GLU CB C 13 30.268 0.000 A 3 GLU N N 15 120.984 0.000 A 4 THR H H 1 8.243 0.000 A 4 THR HA H 1 4.665 0.000 A 4 THR HB H 1 4.219 0.000 A 4 THR HG2% H 1 1.305 0.000 A 4 THR CA C 13 57.307 0.000 A 4 THR CB C 13 67.215 0.000 A 4 THR CG2 C 13 19.062 0.000 A 4 THR N N 15 117.936 0.000 A 5 PRO HD2 H 1 3.901 0.000 A 5 PRO HD3 H 1 3.776 0.000 A 5 PRO HG2 H 1 2.047 0.000 A 5 PRO HG3 H 1 2.047 0.000 A 5 PRO CA C 13 60.740 0.000 A 5 PRO CB C 13 29.700 0.000 A 5 PRO CD C 13 48.560 0.000 A 5 PRO CG C 13 24.964 0.000 A 6 LEU H H 1 8.233 0.000 A 6 LEU HA H 1 4.381 0.000 A 6 LEU HB2 H 1 1.691 0.000 A 6 LEU HB3 H 1 1.641 0.000 A 6 LEU HD1% H 1 0.930 0.000 A 6 LEU HD2% H 1 0.975 0.000 A 6 LEU HG H 1 1.684 0.000 A 6 LEU CA C 13 53.015 0.000 A 6 LEU CB C 13 40.054 0.000 A 6 LEU CD1 C 13 21.439 0.000 A 6 LEU CD2 C 13 22.518 0.000 A 6 LEU CG C 13 24.735 0.000 A 6 LEU N N 15 122.097 0.000 A 8 THR H H 1 8.079 0.000 A 8 THR HA H 1 4.348 0.000 A 8 THR HB H 1 4.248 0.000 A 8 THR HG2% H 1 1.253 0.000 A 8 THR CA C 13 59.340 0.000 A 8 THR CB C 13 67.234 0.000 A 8 THR CG2 C 13 19.303 0.000 A 8 THR N N 15 116.987 0.000 A 9 ALA H H 1 8.164 0.000 A 9 ALA HA H 1 4.374 0.000 A 9 ALA HB% H 1 1.427 0.000 A 9 ALA CA C 13 50.009 0.000 A 9 ALA CB C 13 16.807 0.000 A 9 ALA N N 15 125.944 0.000 A 10 ARG H H 1 8.149 0.000 A 10 ARG HA H 1 4.323 0.000 A 10 ARG HB2 H 1 1.844 0.000 A 10 ARG HB3 H 1 1.776 0.000 A 10 ARG HD2 H 1 3.233 0.000 A 10 ARG HD3 H 1 3.233 0.000 A 10 ARG HG2 H 1 1.623 0.000 A 10 ARG HG3 H 1 1.623 0.000 A 10 ARG CA C 13 53.532 0.000 A 10 ARG CB C 13 28.492 0.000 A 10 ARG CD C 13 41.056 0.000 A 10 ARG CG C 13 24.782 0.000 A 10 ARG N N 15 119.637 0.000 A 11 HIS H H 1 8.436 0.000 A 11 HIS HA H 1 4.717 0.000 A 11 HIS HB2 H 1 3.284 0.000 A 11 HIS HB3 H 1 3.206 0.000 A 11 HIS HD2 H 1 7.296 0.000 A 11 HIS HE1 H 1 7.179 0.000 A 11 HIS CA C 13 52.790 0.000 A 11 HIS CB C 13 27.033 0.000 A 11 HIS CD2 C 13 117.770 0.000 A 11 HIS CE1 C 13 130.758 0.000 A 11 HIS N N 15 119.667 0.000 A 12 MET H H 1 8.402 0.000 A 12 MET HA H 1 4.543 0.000 A 12 MET HB2 H 1 2.583 0.000 A 12 MET HB3 H 1 2.512 0.000 A 12 MET HE% H 1 2.077 0.000 A 12 MET HG2 H 1 2.062 0.000 A 12 MET HG3 H 1 2.043 0.000 A 12 MET CA C 13 53.058 0.000 A 12 MET CB C 13 29.647 0.000 A 12 MET CE C 13 14.640 0.000 A 12 MET CG C 13 32.070 0.000 A 12 MET N N 15 122.280 0.000 A 13 SER H H 1 8.672 0.000 A 13 SER HA H 1 4.515 0.000 A 13 SER HB2 H 1 4.181 0.000 A 13 SER HB3 H 1 4.012 0.000 A 13 SER CA C 13 55.083 0.000 A 13 SER CB C 13 62.243 0.000 A 13 SER N N 15 118.363 0.000 A 14 LYS H H 1 8.550 0.000 A 14 LYS HA H 1 3.926 0.000 A 14 LYS HB2 H 1 1.529 0.000 A 14 LYS HB3 H 1 1.066 0.000 A 14 LYS HD2 H 1 1.192 0.000 A 14 LYS HD3 H 1 1.192 0.000 A 14 LYS HE2 H 1 2.296 0.000 A 14 LYS HE3 H 1 2.364 0.000 A 14 LYS HG2 H 1 0.439 0.000 A 14 LYS HG3 H 1 0.564 0.000 A 14 LYS CA C 13 55.880 0.000 A 14 LYS CB C 13 29.495 0.000 A 14 LYS CD C 13 26.346 0.000 A 14 LYS CE C 13 39.329 0.000 A 14 LYS CG C 13 21.039 0.000 A 14 LYS N N 15 123.039 0.000 A 15 TRP H H 1 6.944 0.000 A 15 TRP HA H 1 4.379 0.000 A 15 TRP HB2 H 1 3.384 0.000 A 15 TRP HD1 H 1 7.386 0.000 A 15 TRP HE1 H 1 9.925 0.000 A 15 TRP HE3 H 1 7.257 0.000 A 15 TRP HH2 H 1 6.605 0.000 A 15 TRP HZ2 H 1 6.768 0.000 A 15 TRP HZ3 H 1 6.636 0.000 A 15 TRP CA C 13 55.569 0.000 A 15 TRP CB C 13 27.426 0.000 A 15 TRP CD1 C 13 124.539 0.000 A 15 TRP CE3 C 13 117.034 0.000 A 15 TRP CH2 C 13 121.958 0.000 A 15 TRP CZ2 C 13 112.367 0.000 A 15 TRP CZ3 C 13 118.638 0.000 A 15 TRP N N 15 118.585 0.000 A 15 TRP NE1 N 15 128.712 0.000 A 16 GLU H H 1 7.529 0.000 A 16 GLU HA H 1 2.976 0.000 A 16 GLU HB2 H 1 2.077 0.000 A 16 GLU HB3 H 1 1.907 0.000 A 16 GLU HG2 H 1 2.067 0.000 A 16 GLU HG3 H 1 2.034 0.000 A 16 GLU CA C 13 56.540 0.000 A 16 GLU CB C 13 27.787 0.000 A 16 GLU CG C 13 34.692 0.000 A 16 GLU N N 15 119.418 0.000 A 17 GLU H H 1 7.762 0.000 A 17 GLU HA H 1 3.910 0.000 A 17 GLU HB2 H 1 2.030 0.000 A 17 GLU HB3 H 1 2.030 0.000 A 17 GLU HG2 H 1 2.157 0.000 A 17 GLU HG3 H 1 2.278 0.000 A 17 GLU CA C 13 56.898 0.000 A 17 GLU CB C 13 26.853 0.000 A 17 GLU CG C 13 34.072 0.000 A 17 GLU N N 15 117.377 0.000 A 18 ILE H H 1 7.677 0.000 A 18 ILE HA H 1 3.668 0.000 A 18 ILE HB H 1 2.069 0.000 A 18 ILE HD1% H 1 0.723 0.000 A 18 ILE HG12 H 1 1.737 0.000 A 18 ILE HG13 H 1 1.149 0.000 A 18 ILE HG2% H 1 1.054 0.000 A 18 ILE CA C 13 62.745 0.000 A 18 ILE CB C 13 35.663 0.000 A 18 ILE CD1 C 13 11.237 0.000 A 18 ILE CG1 C 13 27.081 0.000 A 18 ILE CG2 C 13 15.292 0.000 A 18 ILE N N 15 119.807 0.000 A 19 ALA H H 1 7.929 0.000 A 19 ALA HA H 1 3.955 0.000 A 19 ALA HB% H 1 1.225 0.000 A 19 ALA CA C 13 53.443 0.000 A 19 ALA CB C 13 15.274 0.000 A 19 ALA N N 15 121.744 0.000 A 20 VAL H H 1 8.043 0.000 A 20 VAL HA H 1 3.399 0.000 A 20 VAL HB H 1 2.113 0.000 A 20 VAL HG1% H 1 0.981 0.000 A 20 VAL HG2% H 1 0.936 0.000 A 20 VAL CA C 13 64.329 0.000 A 20 VAL CB C 13 29.404 0.000 A 20 VAL CG1 C 13 20.985 0.000 A 20 VAL CG2 C 13 19.057 0.000 A 20 VAL N N 15 115.918 0.000 A 21 LYS H H 1 8.392 0.000 A 21 LYS HA H 1 3.921 0.000 A 21 LYS HB2 H 1 1.875 0.000 A 21 LYS HB3 H 1 1.875 0.000 A 21 LYS HD2 H 1 1.684 0.000 A 21 LYS HD3 H 1 1.684 0.000 A 21 LYS HE2 H 1 2.972 0.000 A 21 LYS HE3 H 1 2.972 0.000 A 21 LYS HG2 H 1 1.654 0.000 A 21 LYS HG3 H 1 1.423 0.000 A 21 LYS CA C 13 57.442 0.000 A 21 LYS CB C 13 33.512 0.000 A 21 LYS CD C 13 26.979 0.000 A 21 LYS CE C 13 39.631 0.000 A 21 LYS CG C 13 23.367 0.000 A 21 LYS N N 15 119.785 0.000 A 22 GLU H H 1 8.541 0.000 A 22 GLU HA H 1 4.069 0.000 A 22 GLU HB2 H 1 2.097 0.000 A 22 GLU HB3 H 1 2.097 0.000 A 22 GLU HG2 H 1 2.511 0.000 A 22 GLU HG3 H 1 2.284 0.000 A 22 GLU CA C 13 56.261 0.000 A 22 GLU CB C 13 26.096 0.000 A 22 GLU CG C 13 33.594 0.000 A 22 GLU N N 15 118.955 0.000 A 23 ALA H H 1 8.143 0.000 A 23 ALA HA H 1 4.101 0.000 A 23 ALA HB% H 1 1.454 0.000 A 23 ALA CA C 13 53.226 0.000 A 23 ALA CB C 13 15.509 0.000 A 23 ALA N N 15 122.253 0.000 A 24 LYS H H 1 8.346 0.000 A 24 LYS HA H 1 4.019 0.000 A 24 LYS HB2 H 1 1.892 0.000 A 24 LYS HB3 H 1 1.916 0.000 A 24 LYS HD2 H 1 1.691 0.000 A 24 LYS HD3 H 1 1.796 0.000 A 24 LYS HE2 H 1 3.073 0.000 A 24 LYS HE3 H 1 3.073 0.000 A 24 LYS HG2 H 1 1.496 0.000 A 24 LYS HG3 H 1 1.684 0.000 A 24 LYS CA C 13 55.745 0.000 A 24 LYS CB C 13 29.185 0.000 A 24 LYS CD C 13 26.177 0.000 A 24 LYS CE C 13 39.483 0.000 A 24 LYS CG C 13 22.790 0.000 A 24 LYS N N 15 116.889 0.000 A 25 LYS H H 1 7.579 0.000 A 25 LYS HA H 1 4.023 0.000 A 25 LYS HB2 H 1 1.932 0.000 A 25 LYS HB3 H 1 1.932 0.000 A 25 LYS HD2 H 1 1.732 0.000 A 25 LYS HD3 H 1 1.732 0.000 A 25 LYS HE2 H 1 2.920 0.000 A 25 LYS HE3 H 1 2.920 0.000 A 25 LYS HG2 H 1 1.664 0.000 A 25 LYS HG3 H 1 1.429 0.000 A 25 LYS CA C 13 56.340 0.000 A 25 LYS CB C 13 30.202 0.000 A 25 LYS CD C 13 27.273 0.000 A 25 LYS CE C 13 39.578 0.000 A 25 LYS CG C 13 22.848 0.000 A 25 LYS N N 15 117.772 0.000 A 26 ARG H H 1 7.208 0.000 A 26 ARG HA H 1 4.057 0.000 A 26 ARG HB2 H 1 1.675 0.000 A 26 ARG HB3 H 1 1.573 0.000 A 26 ARG HD2 H 1 3.117 0.000 A 26 ARG HD3 H 1 3.117 0.000 A 26 ARG HG2 H 1 1.279 0.000 A 26 ARG HG3 H 1 1.162 0.000 A 26 ARG CA C 13 53.991 0.000 A 26 ARG CB C 13 28.034 0.000 A 26 ARG CD C 13 40.184 0.000 A 26 ARG CG C 13 24.919 0.000 A 26 ARG N N 15 117.176 0.000 A 27 TYR H H 1 7.991 0.000 A 27 TYR HA H 1 5.082 0.000 A 27 TYR HB2 H 1 3.048 0.000 A 27 TYR HB3 H 1 2.899 0.000 A 27 TYR HD1 H 1 7.307 0.000 A 27 TYR HD2 H 1 7.307 0.000 A 27 TYR HE1 H 1 6.681 0.000 A 27 TYR HE2 H 1 6.681 0.000 A 27 TYR CA C 13 52.558 0.000 A 27 TYR CB C 13 35.987 0.000 A 27 TYR CD1 C 13 131.870 0.000 A 27 TYR CD2 C 13 131.874 0.000 A 27 TYR CE1 C 13 115.610 0.000 A 27 TYR CE2 C 13 115.613 0.000 A 27 TYR N N 15 117.344 0.000 A 28 PRO HA H 1 4.749 0.000 A 28 PRO HB2 H 1 2.444 0.000 A 28 PRO HB3 H 1 1.992 0.000 A 28 PRO HD2 H 1 3.660 0.000 A 28 PRO HD3 H 1 3.321 0.000 A 28 PRO HG2 H 1 2.055 0.000 A 28 PRO HG3 H 1 1.959 0.000 A 28 PRO CA C 13 62.393 0.000 A 28 PRO CB C 13 29.855 0.000 A 28 PRO CD C 13 47.782 0.000 A 28 PRO CG C 13 24.908 0.000 A 29 LEU H H 1 8.824 0.000 A 29 LEU HA H 1 4.589 0.000 A 29 LEU HB2 H 1 1.847 0.000 A 29 LEU HB3 H 1 1.774 0.000 A 29 LEU HD1% H 1 0.922 0.000 A 29 LEU HD2% H 1 0.996 0.000 A 29 LEU HG H 1 1.680 0.000 A 29 LEU CA C 13 51.574 0.000 A 29 LEU CB C 13 38.890 0.000 A 29 LEU CD1 C 13 20.123 0.000 A 29 LEU CD2 C 13 22.882 0.000 A 29 LEU CG C 13 24.946 0.000 A 29 LEU N N 15 117.758 0.000 A 30 ALA H H 1 7.829 0.000 A 30 ALA HA H 1 4.851 0.000 A 30 ALA HB% H 1 1.492 0.000 A 30 ALA CA C 13 48.855 0.000 A 30 ALA CB C 13 19.668 0.000 A 30 ALA N N 15 122.493 0.000 A 31 GLN H H 1 8.835 0.000 A 31 GLN HA H 1 4.639 0.000 A 31 GLN HB2 H 1 1.985 0.000 A 31 GLN HB3 H 1 1.924 0.000 A 31 GLN HE21 H 1 6.815 0.000 A 31 GLN HE22 H 1 7.437 0.000 A 31 GLN HG2 H 1 2.388 0.000 A 31 GLN HG3 H 1 2.329 0.000 A 31 GLN CA C 13 51.271 0.000 A 31 GLN CB C 13 28.843 0.000 A 31 GLN CG C 13 31.290 0.000 A 31 GLN N N 15 118.936 0.000 A 31 GLN NE2 N 15 111.799 0.000 A 32 VAL H H 1 8.785 0.000 A 32 VAL HA H 1 4.665 0.000 A 32 VAL HB H 1 2.062 0.000 A 32 VAL HG1% H 1 0.867 0.000 A 32 VAL HG2% H 1 0.769 0.000 A 32 VAL CA C 13 60.265 0.000 A 32 VAL CB C 13 28.878 0.000 A 32 VAL CG1 C 13 18.786 0.000 A 32 VAL CG2 C 13 19.504 0.000 A 32 VAL N N 15 123.815 0.000 A 33 LEU H H 1 9.037 0.000 A 33 LEU HA H 1 4.242 0.000 A 33 LEU HB2 H 1 1.136 0.000 A 33 LEU HB3 H 1 1.310 0.000 A 33 LEU HD1% H 1 0.633 0.000 A 33 LEU HD2% H 1 0.716 0.000 A 33 LEU HG H 1 1.312 0.000 A 33 LEU CA C 13 53.383 0.000 A 33 LEU CB C 13 41.123 0.000 A 33 LEU CD1 C 13 20.243 0.000 A 33 LEU CD2 C 13 23.039 0.000 A 33 LEU CG C 13 24.289 0.000 A 33 LEU N N 15 128.709 0.000 A 34 PHE H H 1 7.405 0.000 A 34 PHE HA H 1 3.906 0.000 A 34 PHE HB2 H 1 2.904 0.000 A 34 PHE HB3 H 1 3.097 0.000 A 34 PHE HD1 H 1 7.229 0.000 A 34 PHE HD2 H 1 7.229 0.000 A 34 PHE HE1 H 1 7.340 0.000 A 34 PHE HE2 H 1 7.340 0.000 A 34 PHE HZ H 1 7.331 0.000 A 34 PHE CA C 13 53.915 0.000 A 34 PHE CB C 13 40.653 0.000 A 34 PHE CD1 C 13 129.810 0.000 A 34 PHE CD2 C 13 129.810 0.000 A 34 PHE CE1 C 13 128.950 0.000 A 34 PHE CE2 C 13 128.950 0.000 A 34 PHE CZ C 13 127.633 0.000 A 34 PHE N N 15 114.779 0.000 A 35 LYS H H 1 8.247 0.000 A 35 LYS HA H 1 5.238 0.000 A 35 LYS HB2 H 1 1.629 0.000 A 35 LYS HB3 H 1 1.629 0.000 A 35 LYS HD2 H 1 2.913 0.000 A 35 LYS HD3 H 1 2.913 0.000 A 35 LYS HG2 H 1 1.472 0.000 A 35 LYS HG3 H 1 1.472 0.000 A 35 LYS CA C 13 52.297 0.000 A 35 LYS CB C 13 32.998 0.000 A 35 LYS CD C 13 39.561 0.000 A 35 LYS CG C 13 27.270 0.000 A 35 LYS N N 15 120.077 0.000 A 36 GLN H H 1 8.691 0.000 A 36 GLN HA H 1 5.236 0.000 A 36 GLN HB3 H 1 2.161 0.000 A 36 GLN HG2 H 1 2.396 0.000 A 36 GLN HG3 H 1 2.396 0.000 A 36 GLN CA C 13 52.197 0.000 A 36 GLN CB C 13 30.609 0.000 A 36 GLN CG C 13 31.165 0.000 A 36 GLN N N 15 119.491 0.000 A 37 LYS H H 1 9.218 0.000 A 37 LYS HA H 1 4.795 0.000 A 37 LYS HB2 H 1 2.392 0.000 A 37 LYS HB3 H 1 2.160 0.000 A 37 LYS CA C 13 54.661 0.000 A 37 LYS CB C 13 31.273 0.000 A 37 LYS CE C 13 39.160 0.000 A 37 LYS CG C 13 22.329 0.000 A 37 LYS N N 15 128.471 0.000 A 38 VAL H H 1 8.886 0.000 A 38 VAL HA H 1 4.337 0.000 A 38 VAL HB H 1 1.935 0.000 A 38 VAL HG2% H 1 1.006 0.000 A 38 VAL CA C 13 60.252 0.000 A 38 VAL CB C 13 30.720 0.000 A 38 VAL CG1 C 13 18.729 0.000 A 38 VAL CG2 C 13 19.706 0.000 A 38 VAL N N 15 125.112 0.000 A 39 TRP H H 1 8.012 0.000 A 39 TRP HA H 1 4.849 0.000 A 39 TRP HB2 H 1 3.206 0.000 A 39 TRP HB3 H 1 3.322 0.000 A 39 TRP HD1 H 1 7.075 0.000 A 39 TRP HE1 H 1 9.922 0.000 A 39 TRP HE3 H 1 7.378 0.000 A 39 TRP HH2 H 1 6.997 0.000 A 39 TRP HZ2 H 1 7.273 0.000 A 39 TRP HZ3 H 1 6.847 0.000 A 39 TRP CA C 13 54.206 0.000 A 39 TRP CB C 13 30.461 0.000 A 39 TRP CD1 C 13 125.200 0.000 A 39 TRP CE3 C 13 118.865 0.000 A 39 TRP CH2 C 13 121.750 0.000 A 39 TRP CZ2 C 13 112.208 0.000 A 39 TRP CZ3 C 13 118.938 0.000 A 39 TRP N N 15 123.085 0.000 A 39 TRP NE1 N 15 129.411 0.000 A 40 ASP H H 1 7.986 0.000 A 40 ASP HA H 1 5.128 0.000 A 40 ASP HB2 H 1 2.415 0.000 A 40 ASP HB3 H 1 2.862 0.000 A 40 ASP CA C 13 51.105 0.000 A 40 ASP CB C 13 41.077 0.000 A 40 ASP N N 15 123.000 0.000 A 41 ARG H H 1 8.894 0.000 A 41 ARG HA H 1 4.548 0.000 A 41 ARG HB2 H 1 1.616 0.000 A 41 ARG HB3 H 1 1.355 0.000 A 41 ARG HD2 H 1 2.722 0.000 A 41 ARG HD3 H 1 2.917 0.000 A 41 ARG HG2 H 1 1.355 0.000 A 41 ARG HG3 H 1 1.355 0.000 A 41 ARG CA C 13 52.623 0.000 A 41 ARG CB C 13 31.417 0.000 A 41 ARG CD C 13 40.886 0.000 A 41 ARG CG C 13 24.721 0.000 A 41 ARG N N 15 123.259 0.000 A 42 LYS H H 1 8.673 0.000 A 42 LYS HA H 1 4.688 0.000 A 42 LYS HB2 H 1 1.834 0.000 A 42 LYS HB3 H 1 1.750 0.000 A 42 LYS HD2 H 1 1.356 0.000 A 42 LYS HD3 H 1 1.356 0.000 A 42 LYS HE2 H 1 2.965 0.000 A 42 LYS HE3 H 1 2.965 0.000 A 42 LYS HG2 H 1 1.352 0.000 A 42 LYS HG3 H 1 1.352 0.000 A 42 LYS CA C 13 53.773 0.000 A 42 LYS CB C 13 31.787 0.000 A 42 LYS CD C 13 24.690 0.000 A 42 LYS CE C 13 39.738 0.000 A 42 LYS CG C 13 22.410 0.000 A 42 LYS N N 15 124.798 0.000 A 43 ARG H H 1 8.382 0.000 A 43 ARG HA H 1 4.649 0.000 A 43 ARG HB2 H 1 1.878 0.000 A 43 ARG HB3 H 1 2.077 0.000 A 43 ARG HD2 H 1 3.218 0.000 A 43 ARG HD3 H 1 3.218 0.000 A 43 ARG HG2 H 1 1.611 0.000 A 43 ARG HG3 H 1 1.611 0.000 A 43 ARG CA C 13 52.179 0.000 A 43 ARG CB C 13 30.149 0.000 A 43 ARG CD C 13 41.039 0.000 A 43 ARG CG C 13 25.030 0.000 A 43 ARG N N 15 124.461 0.000 A 44 LYS H H 1 8.605 0.000 A 44 LYS HA H 1 4.023 0.000 A 44 LYS HB2 H 1 1.898 0.000 A 44 LYS HB3 H 1 2.041 0.000 A 44 LYS HD2 H 1 1.533 0.000 A 44 LYS HD3 H 1 1.533 0.000 A 44 LYS CA C 13 56.636 0.000 A 44 LYS CB C 13 30.112 0.000 A 44 LYS CG C 13 22.456 0.000 A 44 LYS N N 15 121.297 0.000 A 45 ASP H H 1 8.478 0.000 A 45 ASP HA H 1 4.750 0.000 A 45 ASP HB2 H 1 2.813 0.000 A 45 ASP HB3 H 1 2.852 0.000 A 45 ASP CA C 13 51.100 0.000 A 45 ASP CB C 13 38.693 0.000 A 45 ASP N N 15 115.145 0.000 A 46 GLU H H 1 7.501 0.000 A 46 GLU HA H 1 4.467 0.000 A 46 GLU HB2 H 1 1.900 0.000 A 46 GLU HB3 H 1 1.900 0.000 A 46 GLU HG2 H 1 2.079 0.000 A 46 GLU HG3 H 1 2.079 0.000 A 46 GLU CA C 13 53.722 0.000 A 46 GLU CB C 13 30.070 0.000 A 46 GLU CG C 13 33.536 0.000 A 46 GLU N N 15 118.274 0.000 A 47 ALA H H 1 8.531 0.000 A 47 ALA HA H 1 4.694 0.000 A 47 ALA HB% H 1 0.457 0.000 A 47 ALA CA C 13 48.108 0.000 A 47 ALA CB C 13 18.842 0.000 A 47 ALA N N 15 127.506 0.000 A 48 VAL H H 1 8.313 0.000 A 48 VAL HA H 1 5.345 0.000 A 48 VAL HB H 1 1.898 0.000 A 48 VAL HG1% H 1 0.872 0.000 A 48 VAL HG2% H 1 0.872 0.000 A 48 VAL CA C 13 57.625 0.000 A 48 VAL CB C 13 33.496 0.000 A 48 VAL CG1 C 13 18.829 0.000 A 48 VAL CG2 C 13 18.829 0.000 A 48 VAL N N 15 118.088 0.000 A 49 LYS H H 1 8.985 0.000 A 49 LYS HA H 1 5.357 0.000 A 49 LYS HD2 H 1 1.306 0.000 A 49 LYS HD3 H 1 1.306 0.000 A 49 LYS HE2 H 1 2.566 0.000 A 49 LYS HG2 H 1 1.564 0.000 A 49 LYS CA C 13 52.039 0.000 A 49 LYS CD C 13 27.625 0.000 A 49 LYS CE C 13 40.010 0.000 A 49 LYS CG C 13 23.625 0.000 A 49 LYS N N 15 124.725 0.000 A 50 GLN H H 1 8.254 0.000 A 50 GLN HA H 1 4.986 0.000 A 50 GLN HB2 H 1 1.298 0.000 A 50 GLN HB3 H 1 1.556 0.000 A 50 GLN HE21 H 1 6.629 0.000 A 50 GLN HE22 H 1 6.329 0.000 A 50 GLN HG2 H 1 1.743 0.000 A 50 GLN HG3 H 1 1.661 0.000 A 50 GLN CA C 13 52.113 0.000 A 50 GLN CB C 13 23.684 0.000 A 50 GLN CG C 13 35.673 0.000 A 50 GLN N N 15 121.028 0.000 A 50 GLN NE2 N 15 108.299 0.000 A 51 TYR H H 1 9.398 0.000 A 51 TYR HA H 1 5.218 0.000 A 51 TYR HB2 H 1 2.776 0.000 A 51 TYR HB3 H 1 2.593 0.000 A 51 TYR HD1 H 1 6.855 0.000 A 51 TYR HD2 H 1 6.855 0.000 A 51 TYR HE1 H 1 6.763 0.000 A 51 TYR HE2 H 1 6.763 0.000 A 51 TYR CA C 13 54.550 0.000 A 51 TYR CB C 13 40.280 0.000 A 51 TYR CD1 C 13 129.788 0.000 A 51 TYR CD2 C 13 129.790 0.000 A 51 TYR CE1 C 13 115.469 0.000 A 51 TYR CE2 C 13 115.470 0.000 A 51 TYR N N 15 124.549 0.000 A 52 HIS H H 1 9.640 0.000 A 52 HIS HA H 1 5.219 0.000 A 52 HIS HB2 H 1 3.040 0.000 A 52 HIS HB3 H 1 2.743 0.000 A 52 HIS HD1 H 1 9.046 0.000 A 52 HIS HE1 H 1 8.333 0.000 A 52 HIS CA C 13 51.708 0.000 A 52 HIS CB C 13 28.907 0.000 A 52 HIS CE1 C 13 134.086 0.000 A 52 HIS N N 15 121.301 0.000 A 52 HIS ND1 N 15 199.745 0.000 A 53 LEU H H 1 9.057 0.000 A 53 LEU HA H 1 5.208 0.000 A 53 LEU HB2 H 1 1.425 0.000 A 53 LEU HB3 H 1 1.342 0.000 A 53 LEU HD1% H 1 0.775 0.000 A 53 LEU HD2% H 1 0.781 0.000 A 53 LEU HG H 1 1.624 0.000 A 53 LEU CA C 13 50.887 0.000 A 53 LEU CB C 13 42.084 0.000 A 53 LEU CD1 C 13 19.347 0.000 A 53 LEU CD2 C 13 23.158 0.000 A 53 LEU CG C 13 25.982 0.000 A 53 LEU N N 15 127.743 0.000 A 54 THR H H 1 8.443 0.000 A 54 THR HA H 1 4.600 0.000 A 54 THR HB H 1 3.912 0.000 A 54 THR HG2% H 1 1.178 0.000 A 54 THR CA C 13 59.774 0.000 A 54 THR CB C 13 67.153 0.000 A 54 THR CG2 C 13 19.626 0.000 A 54 THR N N 15 117.996 0.000 A 55 LEU H H 1 9.064 0.000 A 55 LEU HA H 1 5.074 0.000 A 55 LEU HB2 H 1 0.123 0.000 A 55 LEU HB3 H 1 0.745 0.000 A 55 LEU HD1% H 1 0.370 0.000 A 55 LEU HD2% H 1 0.503 0.000 A 55 LEU HG H 1 1.191 0.000 A 55 LEU CA C 13 50.769 0.000 A 55 LEU CB C 13 42.090 0.000 A 55 LEU CD1 C 13 24.112 0.000 A 55 LEU CD2 C 13 24.137 0.000 A 55 LEU CG C 13 26.196 0.000 A 55 LEU N N 15 129.329 0.000 A 56 ARG H H 1 8.542 0.000 A 56 ARG HA H 1 5.357 0.000 A 56 ARG HB2 H 1 1.559 0.000 A 56 ARG HB3 H 1 1.559 0.000 A 56 ARG HD2 H 1 3.176 0.000 A 56 ARG HD3 H 1 3.176 0.000 A 56 ARG HG2 H 1 1.462 0.000 A 56 ARG HG3 H 1 1.462 0.000 A 56 ARG CA C 13 51.875 0.000 A 56 ARG CB C 13 31.945 0.000 A 56 ARG CD C 13 41.394 0.000 A 56 ARG CG C 13 24.899 0.000 A 56 ARG N N 15 117.231 0.000 A 57 GLU H H 1 9.080 0.000 A 57 GLU HA H 1 4.691 0.000 A 57 GLU HB2 H 1 2.202 0.000 A 57 GLU HB3 H 1 1.971 0.000 A 57 GLU HG2 H 1 2.132 0.000 A 57 GLU HG3 H 1 2.209 0.000 A 57 GLU CA C 13 52.864 0.000 A 57 GLU CB C 13 29.942 0.000 A 57 GLU CG C 13 33.526 0.000 A 57 GLU N N 15 128.411 0.000 A 58 GLY H H 1 9.146 0.000 A 58 GLY HA3 H 1 4.164 0.000 A 58 GLY CA C 13 44.943 0.000 A 58 GLY N N 15 118.265 0.000 A 59 SER H H 1 8.953 0.000 A 59 SER HA H 1 4.567 0.000 A 59 SER HB2 H 1 4.099 0.000 A 59 SER HB3 H 1 3.977 0.000 A 59 SER CA C 13 55.730 0.000 A 59 SER CB C 13 61.262 0.000 A 59 SER N N 15 122.061 0.000 A 60 LYS H H 1 8.164 0.000 A 60 LYS HA H 1 4.620 0.000 A 60 LYS HB2 H 1 2.121 0.000 A 60 LYS HB3 H 1 1.964 0.000 A 60 LYS HE2 H 1 2.836 0.000 A 60 LYS HE3 H 1 2.836 0.000 A 60 LYS HG2 H 1 1.398 0.000 A 60 LYS HG3 H 1 1.575 0.000 A 60 LYS CA C 13 53.444 0.000 A 60 LYS CB C 13 32.144 0.000 A 60 LYS CD C 13 27.176 0.000 A 60 LYS CE C 13 39.661 0.000 A 60 LYS CG C 13 22.581 0.000 A 60 LYS N N 15 124.154 0.000 A 61 GLU H H 1 8.522 0.000 A 61 GLU HA H 1 5.514 0.000 A 61 GLU HB2 H 1 1.952 0.000 A 61 GLU HB3 H 1 1.952 0.000 A 61 GLU HG2 H 1 2.251 0.000 A 61 GLU HG3 H 1 2.088 0.000 A 61 GLU CA C 13 52.106 0.000 A 61 GLU CB C 13 29.540 0.000 A 61 GLU CG C 13 33.922 0.000 A 61 GLU N N 15 125.701 0.000 A 62 PHE H H 1 8.956 0.000 A 62 PHE HA H 1 5.046 0.000 A 62 PHE HB2 H 1 3.135 0.000 A 62 PHE HB3 H 1 3.135 0.000 A 62 PHE HD1 H 1 6.809 0.000 A 62 PHE HD2 H 1 6.809 0.000 A 62 PHE HE1 H 1 6.464 0.000 A 62 PHE HE2 H 1 6.464 0.000 A 62 PHE HZ H 1 6.439 0.000 A 62 PHE CA C 13 53.363 0.000 A 62 PHE CB C 13 37.799 0.000 A 62 PHE CD1 C 13 130.230 0.000 A 62 PHE CD2 C 13 130.232 0.000 A 62 PHE CE1 C 13 128.115 0.000 A 62 PHE CE2 C 13 128.120 0.000 A 62 PHE CZ C 13 127.254 0.000 A 62 PHE N N 15 121.360 0.000 A 63 GLY H H 1 8.561 0.000 A 63 GLY HA3 H 1 3.878 0.000 A 63 GLY CA C 13 41.632 0.000 A 63 GLY N N 15 107.546 0.000 A 64 VAL H H 1 8.458 0.000 A 64 VAL HA H 1 5.020 0.000 A 64 VAL HB H 1 1.939 0.000 A 64 VAL HG1% H 1 0.781 0.000 A 64 VAL HG2% H 1 0.986 0.000 A 64 VAL CA C 13 57.030 0.000 A 64 VAL CB C 13 34.152 0.000 A 64 VAL CG1 C 13 19.159 0.000 A 64 VAL CG2 C 13 20.089 0.000 A 64 VAL N N 15 115.031 0.000 A 65 PHE H H 1 9.475 0.000 A 65 PHE HA H 1 5.632 0.000 A 65 PHE HB2 H 1 3.025 0.000 A 65 PHE HB3 H 1 2.891 0.000 A 65 PHE HD1 H 1 7.057 0.000 A 65 PHE HD2 H 1 7.057 0.000 A 65 PHE HE1 H 1 7.081 0.000 A 65 PHE HE2 H 1 7.081 0.000 A 65 PHE CA C 13 54.000 0.000 A 65 PHE CB C 13 39.295 0.000 A 65 PHE CD1 C 13 129.130 0.000 A 65 PHE CD2 C 13 129.127 0.000 A 65 PHE CE1 C 13 128.960 0.000 A 65 PHE CE2 C 13 128.962 0.000 A 65 PHE N N 15 122.208 0.000 A 66 VAL H H 1 9.340 0.000 A 66 VAL HA H 1 5.157 0.000 A 66 VAL HB H 1 2.093 0.000 A 66 VAL HG1% H 1 1.066 0.000 A 66 VAL HG2% H 1 1.043 0.000 A 66 VAL CA C 13 58.634 0.000 A 66 VAL CB C 13 32.312 0.000 A 66 VAL CG1 C 13 18.674 0.000 A 66 VAL CG2 C 13 18.353 0.000 A 66 VAL N N 15 123.832 0.000 A 67 THR H H 1 9.488 0.000 A 67 THR HB H 1 4.011 0.000 A 67 THR HG2% H 1 1.071 0.000 A 67 THR CA C 13 57.150 0.000 A 67 THR CB C 13 67.050 0.000 A 67 THR CG2 C 13 19.060 0.000 A 67 THR N N 15 125.293 0.000 A 68 ILE H H 1 9.547 0.000 A 68 ILE HA H 1 4.863 0.000 A 68 ILE HB H 1 1.983 0.000 A 68 ILE HD1% H 1 1.218 0.000 A 68 ILE HG12 H 1 1.866 0.000 A 68 ILE HG13 H 1 1.866 0.000 A 68 ILE HG2% H 1 1.149 0.000 A 68 ILE CA C 13 58.233 0.000 A 68 ILE CB C 13 39.314 0.000 A 68 ILE CD1 C 13 13.688 0.000 A 68 ILE CG1 C 13 25.753 0.000 A 68 ILE CG2 C 13 16.293 0.000 A 68 ILE N N 15 128.624 0.000 A 69 SER H H 1 8.994 0.000 A 69 SER HA H 1 5.804 0.000 A 69 SER HB2 H 1 3.946 0.000 A 69 SER HB3 H 1 3.946 0.000 A 69 SER CA C 13 53.530 0.000 A 69 SER CB C 13 61.921 0.000 A 69 SER N N 15 122.023 0.000 A 70 PHE H H 1 9.326 0.000 A 70 PHE HA H 1 5.377 0.000 A 70 PHE HB2 H 1 2.610 0.000 A 70 PHE HB3 H 1 2.811 0.000 A 70 PHE HD1 H 1 6.518 0.000 A 70 PHE HD2 H 1 6.518 0.000 A 70 PHE HE1 H 1 6.627 0.000 A 70 PHE HE2 H 1 6.721 0.000 A 70 PHE HZ H 1 6.605 0.000 A 70 PHE CA C 13 53.143 0.000 A 70 PHE CB C 13 40.368 0.000 A 70 PHE CD1 C 13 130.090 0.000 A 70 PHE CD2 C 13 130.090 0.000 A 70 PHE CE1 C 13 127.080 0.000 A 70 PHE CE2 C 13 127.080 0.000 A 70 PHE CZ C 13 121.958 0.000 A 70 PHE N N 15 123.800 0.000 A 71 ASP H H 1 8.654 0.000 A 71 ASP HA H 1 5.099 0.000 A 71 ASP HB2 H 1 3.217 0.000 A 71 ASP HB3 H 1 2.900 0.000 A 71 ASP CA C 13 48.222 0.000 A 71 ASP CB C 13 40.845 0.000 A 71 ASP N N 15 121.547 0.000 A 72 PRO HA H 1 4.365 0.000 A 72 PRO HB2 H 1 1.698 0.000 A 72 PRO HB3 H 1 1.698 0.000 A 72 PRO HD2 H 1 3.796 0.000 A 72 PRO HD3 H 1 3.796 0.000 A 72 PRO HG2 H 1 1.695 0.000 A 72 PRO HG3 H 1 1.695 0.000 A 72 PRO CA C 13 61.599 0.000 A 72 PRO CB C 13 29.666 0.000 A 72 PRO CD C 13 47.953 0.000 A 72 PRO CG C 13 25.003 0.000 A 73 TYR H H 1 8.400 0.000 A 73 TYR HA H 1 4.626 0.000 A 73 TYR HB2 H 1 3.274 0.000 A 73 TYR HB3 H 1 3.274 0.000 A 73 TYR HD1 H 1 7.350 0.000 A 73 TYR HD2 H 1 7.350 0.000 A 73 TYR HE1 H 1 6.975 0.000 A 73 TYR HE2 H 1 6.975 0.000 A 73 TYR CA C 13 57.330 0.000 A 73 TYR CB C 13 35.580 0.000 A 73 TYR CD1 C 13 130.863 0.000 A 73 TYR CD2 C 13 130.860 0.000 A 73 TYR CE1 C 13 116.066 0.000 A 73 TYR CE2 C 13 116.070 0.000 A 73 TYR N N 15 118.085 0.000 A 74 SER H H 1 8.382 0.000 A 74 SER HA H 1 4.506 0.000 A 74 SER HB2 H 1 4.158 0.000 A 74 SER HB3 H 1 4.018 0.000 A 74 SER CA C 13 56.253 0.000 A 74 SER CB C 13 62.670 0.000 A 74 SER N N 15 113.942 0.000 A 75 GLN H H 1 8.569 0.000 A 75 GLN HA H 1 4.244 0.000 A 75 GLN HB2 H 1 2.474 0.000 A 75 GLN HB3 H 1 2.532 0.000 A 75 GLN HE21 H 1 6.884 0.000 A 75 GLN HE22 H 1 7.551 0.000 A 75 GLN HG2 H 1 2.471 0.000 A 75 GLN HG3 H 1 2.312 0.000 A 75 GLN CA C 13 55.572 0.000 A 75 GLN CB C 13 23.623 0.000 A 75 GLN CG C 13 32.155 0.000 A 75 GLN N N 15 115.717 0.000 A 75 GLN NE2 N 15 112.541 0.000 A 76 LYS H H 1 7.850 0.000 A 76 LYS HA H 1 4.444 0.000 A 76 LYS HB2 H 1 1.862 0.000 A 76 LYS HB3 H 1 1.862 0.000 A 76 LYS HD2 H 1 1.815 0.000 A 76 LYS HD3 H 1 1.815 0.000 A 76 LYS HG2 H 1 1.478 0.000 A 76 LYS HG3 H 1 1.553 0.000 A 76 LYS CA C 13 54.013 0.000 A 76 LYS CB C 13 31.375 0.000 A 76 LYS CD C 13 26.873 0.000 A 76 LYS CG C 13 22.517 0.000 A 76 LYS N N 15 119.205 0.000 A 77 VAL H H 1 8.735 0.000 A 77 VAL HA H 1 4.004 0.000 A 77 VAL HB H 1 2.175 0.000 A 77 VAL HG1% H 1 1.067 0.000 A 77 VAL HG2% H 1 1.302 0.000 A 77 VAL CA C 13 61.558 0.000 A 77 VAL CB C 13 30.401 0.000 A 77 VAL CG1 C 13 19.366 0.000 A 77 VAL CG2 C 13 20.842 0.000 A 77 VAL N N 15 125.587 0.000 A 78 ASN H H 1 9.528 0.000 A 78 ASN HA H 1 4.950 0.000 A 78 ASN HB2 H 1 2.692 0.000 A 78 ASN HB3 H 1 2.850 0.000 A 78 ASN HD21 H 1 7.022 0.000 A 78 ASN HD22 H 1 7.649 0.000 A 78 ASN CA C 13 51.577 0.000 A 78 ASN CB C 13 37.361 0.000 A 78 ASN N N 15 126.604 0.000 A 78 ASN ND2 N 15 111.863 0.000 A 79 LYS H H 1 7.822 0.000 A 79 LYS HA H 1 4.618 0.000 A 79 LYS HB2 H 1 1.875 0.000 A 79 LYS HB3 H 1 1.875 0.000 A 79 LYS HG2 H 1 1.396 0.000 A 79 LYS HG3 H 1 1.396 0.000 A 79 LYS CA C 13 53.572 0.000 A 79 LYS CB C 13 33.529 0.000 A 79 LYS CG C 13 22.433 0.000 A 79 LYS N N 15 118.463 0.000 A 80 ILE H H 1 8.447 0.000 A 80 ILE HA H 1 5.071 0.000 A 80 ILE HB H 1 1.748 0.000 A 80 ILE HD1% H 1 0.929 0.000 A 80 ILE HG12 H 1 1.680 0.000 A 80 ILE HG13 H 1 1.095 0.000 A 80 ILE HG2% H 1 0.843 0.000 A 80 ILE CA C 13 57.696 0.000 A 80 ILE CB C 13 38.260 0.000 A 80 ILE CD1 C 13 11.777 0.000 A 80 ILE CG1 C 13 25.718 0.000 A 80 ILE CG2 C 13 15.063 0.000 A 80 ILE N N 15 123.294 0.000 A 81 ALA H H 1 9.069 0.000 A 81 ALA HA H 1 5.036 0.000 A 81 ALA HB% H 1 1.500 0.000 A 81 ALA CA C 13 48.222 0.000 A 81 ALA CB C 13 20.074 0.000 A 81 ALA N N 15 130.466 0.000 A 82 ILE H H 1 8.718 0.000 A 82 ILE HA H 1 5.242 0.000 A 82 ILE HB H 1 1.885 0.000 A 82 ILE HD1% H 1 0.908 0.000 A 82 ILE HG12 H 1 1.703 0.000 A 82 ILE HG13 H 1 1.202 0.000 A 82 ILE HG2% H 1 1.046 0.000 A 82 ILE CA C 13 57.675 0.000 A 82 ILE CB C 13 37.792 0.000 A 82 ILE CD1 C 13 11.601 0.000 A 82 ILE CG1 C 13 26.041 0.000 A 82 ILE CG2 C 13 14.841 0.000 A 82 ILE N N 15 122.249 0.000 A 83 LEU H H 1 9.126 0.000 A 83 LEU HA H 1 4.954 0.000 A 83 LEU HB2 H 1 1.908 0.000 A 83 LEU HB3 H 1 1.698 0.000 A 83 LEU HD1% H 1 0.967 0.000 A 83 LEU HD2% H 1 1.034 0.000 A 83 LEU HG H 1 1.731 0.000 A 83 LEU CA C 13 51.332 0.000 A 83 LEU CB C 13 43.475 0.000 A 83 LEU CD1 C 13 23.007 0.000 A 83 LEU CD2 C 13 22.193 0.000 A 83 LEU CG C 13 24.894 0.000 A 83 LEU N N 15 129.605 0.000 A 84 GLU H H 1 8.970 0.000 A 84 GLU HA H 1 4.712 0.000 A 84 GLU HB2 H 1 2.138 0.000 A 84 GLU HB3 H 1 2.138 0.000 A 84 GLU HG2 H 1 2.441 0.000 A 84 GLU HG3 H 1 2.512 0.000 A 84 GLU CA C 13 54.390 0.000 A 84 GLU CB C 13 28.122 0.000 A 84 GLU CG C 13 34.393 0.000 A 84 GLU N N 15 125.594 0.000 A 85 GLU H H 1 8.396 0.000 A 85 GLU HA H 1 4.429 0.000 A 85 GLU HB2 H 1 2.071 0.000 A 85 GLU HB3 H 1 1.866 0.000 A 85 GLU HG2 H 1 2.220 0.000 A 85 GLU HG3 H 1 2.287 0.000 A 85 GLU CA C 13 53.896 0.000 A 85 GLU CB C 13 28.642 0.000 A 85 GLU CG C 13 33.637 0.000 A 85 GLU N N 15 123.904 0.000 A 86 TYR H H 1 8.412 0.000 A 86 TYR HA H 1 4.721 0.000 A 86 TYR HB2 H 1 3.004 0.000 A 86 TYR HB3 H 1 3.145 0.000 A 86 TYR HD1 H 1 7.180 0.000 A 86 TYR HD2 H 1 7.180 0.000 A 86 TYR HE1 H 1 6.838 0.000 A 86 TYR HE2 H 1 6.838 0.000 A 86 TYR CA C 13 53.909 0.000 A 86 TYR CB C 13 36.596 0.000 A 86 TYR CD1 C 13 130.767 0.000 A 86 TYR CD2 C 13 130.771 0.000 A 86 TYR CE1 C 13 116.062 0.000 A 86 TYR CE2 C 13 116.066 0.000 A 86 TYR N N 15 123.323 0.000 A 87 GLN H H 1 7.921 0.000 A 87 GLN HA H 1 4.230 0.000 A 87 GLN HB2 H 1 1.983 0.000 A 87 GLN HB3 H 1 2.141 0.000 A 87 GLN HE21 H 1 7.542 0.000 A 87 GLN HE22 H 1 6.814 0.000 A 87 GLN HG2 H 1 2.310 0.000 A 87 GLN HG3 H 1 2.310 0.000 A 87 GLN CA C 13 54.780 0.000 A 87 GLN CB C 13 28.452 0.000 A 87 GLN CG C 13 31.835 0.000 A 87 GLN N N 15 126.221 0.000 A 87 GLN NE2 N 15 111.789 0.000 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 67 THR H A 81 ALA H 1.0 . 3.97 2 2 A 81 ALA H A 80 ILE HA 1.0 . 2.94 3 3 A 81 ALA H A 67 THR HB 1.0 . 4.17 4 4 A 81 ALA H A 82 ILE HG12 1.0 . 4.60 5 5 A 81 ALA H A 67 THR HG2% 1.0 . 4.21 6 6 A 81 ALA H A 68 ILE HA 1.0 . 4.58 7 7 A 65 PHE H A 83 LEU H 1.0 . 3.93 8 8 A 83 LEU H A 82 ILE H 1.0 . 5.05 9 9 A 83 LEU H A 82 ILE HA 1.0 . 3.03 10 10 A 83 LEU H A 65 PHE HB2 1.0 . 4.54 11 11 A 83 LEU H A 83 LEU HB3 1.0 . 3.60 12 12 A 83 LEU H A 65 PHE HD% 1.0 . 5.50 13 13 A 39 TRP HE1 A 41 ARG HD2 1.0 . 5.50 14 14 A 39 TRP HE1 A 41 ARG HB2 1.0 . 5.50 15 15 A 39 TRP HE1 A 41 ARG HB3 1.0 . 4.74 16 16 A 55 LEU H A 62 PHE HD% 1.0 . 5.50 17 17 A 55 LEU H A 54 THR HB 1.0 . 4.23 18 18 A 55 LEU H A 62 PHE HB2 1.0 . 5.50 19 18 A 55 LEU H A 62 PHE HB3 1.0 . 5.50 20 19 A 55 LEU H A 55 LEU HB2 1.0 . 3.70 21 20 A 15 TRP HB2 A 15 TRP HE1 1.0 . 4.85 22 21 A 15 TRP HE1 A 49 LYS HE2 1.0 . 4.47 23 22 A 15 TRP HE1 A 75 GLN HG3 1.0 . 5.48 24 23 A 15 TRP HE1 A 14 LYS HB3 1.0 . 4.69 25 24 A 68 ILE H A 69 SER H 1.0 . 4.38 26 25 A 67 THR HB A 68 ILE H 1.0 . 5.06 27 26 A 33 LEU H A 34 PHE H 1.0 . 3.69 28 27 A 33 LEU H A 55 LEU HA 1.0 . 3.88 29 28 A 33 LEU H A 32 VAL HG2% 1.0 . 4.04 30 29 A 33 LEU H A 34 PHE HB2 1.0 . 5.50 31 30 A 37 LYS H A 37 LYS HB3 1.0 . 4.12 32 31 A 57 GLU H A 60 LYS H 1.0 . 4.27 33 32 A 57 GLU H A 56 ARG HA 1.0 . 3.07 34 33 A 57 GLU H A 56 ARG H 1.0 . 4.68 35 34 A 53 LEU H A 54 THR H 1.0 . 4.63 36 35 A 65 PHE HD% A 52 HIS HD1 1.0 . 5.50 37 36 A 53 LEU H A 65 PHE HA 1.0 . 4.22 38 37 A 53 LEU H A 52 HIS HA 1.0 . 3.17 39 38 A 52 HIS HD1 A 38 VAL HG2% 1.0 . 5.50 40 39 A 53 LEU H A 55 LEU HD1% 1.0 . 5.50 41 40 A 52 HIS HD1 A 63 GLY HA3 1.0 . 5.50 42 41 A 53 LEU H A 52 HIS H 1.0 . 5.50 43 42 A 46 GLU H A 47 ALA H 1.0 . 4.80 44 43 A 47 ALA H A 48 VAL HG1% 1.0 . 5.50 45 43 A 47 ALA H A 48 VAL HG2% 1.0 . 5.50 46 44 A 47 ALA H A 70 PHE H 1.0 . 3.97 47 45 A 47 ALA H A 48 VAL H 1.0 . 4.42 48 46 A 47 ALA H A 69 SER HA 1.0 . 5.06 49 47 A 47 ALA H A 72 PRO HD2 1.0 . 3.88 50 47 A 47 ALA H A 72 PRO HD3 1.0 . 3.88 51 48 A 47 ALA H A 48 VAL HA 1.0 . 5.50 52 49 A 70 PHE H A 78 ASN H 1.0 . 5.50 53 50 A 78 ASN H A 71 ASP H 1.0 . 4.59 54 51 A 78 ASN H A 70 PHE HD% 1.0 . 5.50 55 52 A 78 ASN H A 70 PHE HB3 1.0 . 3.86 56 53 A 78 ASN H A 78 ASN HB2 1.0 . 3.73 57 54 A 78 ASN H A 77 VAL HG2% 1.0 . 4.85 58 55 A 86 TYR H A 87 GLN H 1.0 . 4.26 59 56 A 87 GLN H A 87 GLN HE21 1.0 . 5.46 60 57 A 87 GLN H A 87 GLN HE22 1.0 . 5.50 61 58 A 87 GLN H A 86 TYR HA 1.0 . 3.15 62 59 A 87 GLN H A 86 TYR HB3 1.0 . 4.01 63 60 A 87 GLN H A 87 GLN HG2 1.0 . 4.21 64 60 A 87 GLN H A 87 GLN HG3 1.0 . 4.21 65 61 A 9 ALA H A 10 ARG HG2 1.0 . 5.33 66 61 A 9 ALA H A 10 ARG HG3 1.0 . 5.33 67 62 A 9 ALA H A 8 THR HA 1.0 . 3.05 68 63 A 9 ALA H A 8 THR HG2% 1.0 . 5.47 69 64 A 60 LYS H A 61 GLU H 1.0 . 4.56 70 65 A 62 PHE HD% A 61 GLU H 1.0 . 5.25 71 66 A 61 GLU H A 62 PHE HB2 1.0 . 5.20 72 66 A 62 PHE HB3 A 61 GLU H 1.0 . 5.20 73 67 A 61 GLU H A 60 LYS HG2 1.0 . 4.49 74 68 A 83 LEU HB2 A 84 GLU H 1.0 . 4.07 75 69 A 84 GLU H A 85 GLU H 1.0 . 4.70 76 70 A 78 ASN H A 77 VAL H 1.0 . 4.88 77 71 A 77 VAL H A 76 LYS H 1.0 . 4.55 78 72 A 77 VAL H A 15 TRP HH2 1.0 . 5.29 79 73 A 77 VAL H A 70 PHE HA 1.0 . 5.50 80 74 A 77 VAL H A 75 GLN HA 1.0 . 5.17 81 75 A 70 PHE HB3 A 77 VAL H 1.0 . 5.50 82 76 A 67 THR H A 66 VAL HA 1.0 . 3.22 83 77 A 67 THR H A 67 THR HB 1.0 . 3.91 84 78 A 67 THR H A 66 VAL HB 1.0 . 5.45 85 79 A 41 ARG H A 42 LYS H 1.0 . 5.07 86 80 A 41 ARG HD2 A 42 LYS H 1.0 . 5.50 87 81 A 42 LYS H A 41 ARG HG2 1.0 . 3.94 88 81 A 42 LYS H A 41 ARG HG3 1.0 . 3.94 89 82 A 42 LYS H A 47 ALA HB% 1.0 . 5.50 90 83 A 48 VAL HA A 49 LYS H 1.0 . 3.19 91 84 A 49 LYS H A 50 GLN HA 1.0 . 4.93 92 85 A 49 LYS H A 50 GLN HG3 1.0 . 4.01 93 86 A 49 LYS H A 48 VAL HG1% 1.0 . 3.96 94 86 A 48 VAL HG2% A 49 LYS H 1.0 . 3.96 95 87 A 42 LYS H A 43 ARG H 1.0 . 5.25 96 88 A 50 GLN H A 51 TYR H 1.0 . 5.42 97 89 A 51 TYR H A 51 TYR HB3 1.0 . 4.08 98 90 A 66 VAL HB A 51 TYR H 1.0 . 4.81 99 91 A 51 TYR H A 50 GLN HG2 1.0 . 4.52 100 92 A 51 TYR H A 66 VAL HG1% 1.0 . 5.17 101 93 A 43 ARG H A 42 LYS HE2 1.0 . 5.50 102 93 A 43 ARG H A 42 LYS HE3 1.0 . 5.50 103 94 A 46 GLU H A 43 ARG H 1.0 . 4.50 104 95 A 43 ARG H A 44 LYS HA 1.0 . 5.50 105 96 A 43 ARG H A 44 LYS H 1.0 . 4.49 106 97 A 43 ARG H A 42 LYS HB2 1.0 . 3.62 107 98 A 43 ARG H A 48 VAL HG1% 1.0 . 5.50 108 98 A 48 VAL HG2% A 43 ARG H 1.0 . 5.50 109 99 A 47 ALA HB% A 43 ARG H 1.0 . 5.04 110 100 A 60 LYS H A 59 SER H 1.0 . 3.32 111 101 A 60 LYS H A 56 ARG HA 1.0 . 5.05 112 102 A 60 LYS H A 58 GLY HA3 1.0 . 4.15 113 103 A 60 LYS H A 58 GLY HAx 1.0 . 4.83 114 104 A 60 LYS H A 60 LYS HB2 1.0 . 3.27 115 105 A 60 LYS H A 60 LYS HE2 1.0 . 5.50 116 105 A 60 LYS H A 60 LYS HE3 1.0 . 5.50 117 106 A 85 GLU H A 84 GLU HA 1.0 . 3.18 118 107 A 63 GLY HA3 A 85 GLU H 1.0 . 5.50 119 108 A 85 GLU H A 85 GLU HB2 1.0 . 3.42 120 109 A 85 GLU H A 85 GLU HB3 1.0 . 3.64 121 110 A 85 GLU H A 64 VAL HG1% 1.0 . 5.50 122 111 A 65 PHE HA A 66 VAL H 1.0 . 3.12 123 112 A 70 PHE H A 46 GLU HB2 1.0 . 5.00 124 112 A 70 PHE H A 46 GLU HB3 1.0 . 5.00 125 113 A 70 PHE H A 46 GLU HA 1.0 . 5.33 126 114 A 70 PHE H A 69 SER HA 1.0 . 3.20 127 115 A 70 PHE H A 69 SER HB2 1.0 . 3.98 128 115 A 70 PHE H A 69 SER HB3 1.0 . 3.98 129 116 A 24 LYS HA A 32 VAL H 1.0 . 3.99 130 117 A 32 VAL H A 24 LYS HE2 1.0 . 5.50 131 117 A 32 VAL H A 24 LYS HE3 1.0 . 5.50 132 118 A 32 VAL H A 30 ALA HB% 1.0 . 5.50 133 119 A 32 VAL H A 55 LEU HD2% 1.0 . 5.50 134 120 A 81 ALA H A 80 ILE H 1.0 . 4.86 135 121 A 80 ILE H A 79 LYS HA 1.0 . 3.06 136 122 A 80 ILE H A 77 VAL HG1% 1.0 . 4.40 137 123 A 86 TYR H A 85 GLU HB2 1.0 . 4.40 138 124 A 86 TYR H A 87 GLN HA 1.0 . 5.50 139 125 A 48 VAL H A 41 ARG H 1.0 . 4.85 140 126 A 80 ILE H A 69 SER HB2 1.0 . 5.50 141 126 A 69 SER HB3 A 80 ILE H 1.0 . 5.50 142 127 A 14 LYS H A 16 GLU H 1.0 . 5.50 143 128 A 14 LYS H A 13 SER HA 1.0 . 3.19 144 129 A 14 LYS H A 13 SER HB2 1.0 . 3.74 145 130 A 15 TRP HB2 A 14 LYS H 1.0 . 5.50 146 131 A 14 LYS H A 16 GLU HG3 1.0 . 5.27 147 132 A 14 LYS H A 14 LYS HB2 1.0 . 3.59 148 133 A 14 LYS HB3 A 14 LYS H 1.0 . 3.58 149 134 A 29 LEU H A 30 ALA H 1.0 . 3.04 150 135 A 30 ALA H A 62 PHE HZ 1.0 . 5.50 151 136 A 30 ALA H A 27 TYR HB2 1.0 . 4.12 152 137 A 30 ALA H A 27 TYR HA 1.0 . 5.50 153 138 A 67 THR H A 82 ILE H 1.0 . 5.50 154 139 A 81 ALA H A 82 ILE H 1.0 . 4.69 155 140 A 82 ILE H A 81 ALA HA 1.0 . 2.92 156 141 A 82 ILE H A 82 ILE HG2% 1.0 . 4.21 157 142 A 11 HIS HA A 12 MET H 1.0 . 2.99 158 143 A 12 MET H A 12 MET HG3 1.0 . 4.37 159 144 A 22 GLU H A 23 ALA H 1.0 . 3.53 160 145 A 23 ALA H A 24 LYS H 1.0 . 3.49 161 146 A 23 ALA H A 26 ARG H 1.0 . 5.50 162 147 A 23 ALA H A 22 GLU HG2 1.0 . 4.90 163 148 A 23 ALA H A 22 GLU HB2 1.0 . 3.43 164 148 A 23 ALA H A 22 GLU HB3 1.0 . 3.43 165 149 A 23 ALA H A 20 VAL HA 1.0 . 4.14 166 150 A 23 ALA H A 19 ALA HB% 1.0 . 5.15 167 151 A 23 ALA H A 25 LYS H 1.0 . 5.19 168 152 A 65 PHE H A 85 GLU H 1.0 . 4.54 169 153 A 65 PHE H A 84 GLU HA 1.0 . 4.59 170 154 A 65 PHE H A 83 LEU HB2 1.0 . 3.75 171 155 A 65 PHE H A 83 LEU HB3 1.0 . 4.75 172 156 A 65 PHE H A 64 VAL HG2% 1.0 . 4.29 173 157 A 65 PHE H A 65 PHE HB2 1.0 . 3.86 174 158 A 67 THR HB A 82 ILE H 1.0 . 5.50 175 159 A 6 LEU H A 6 LEU HG 1.0 . 3.44 176 160 A 6 LEU H A 6 LEU HD2% 1.0 . 5.38 177 161 A 69 SER H A 78 ASN H 1.0 . 5.02 178 162 A 69 SER H A 70 PHE HD% 1.0 . 5.50 179 163 A 80 ILE HA A 69 SER H 1.0 . 4.54 180 164 A 69 SER H A 68 ILE HG12 1.0 . 4.42 181 164 A 69 SER H A 68 ILE HG13 1.0 . 4.42 182 165 A 69 SER H A 48 VAL HG1% 1.0 . 5.09 183 165 A 69 SER H A 48 VAL HG2% 1.0 . 5.09 184 166 A 69 SER H A 69 SER HB2 1.0 . 3.42 185 166 A 69 SER H A 69 SER HB3 1.0 . 3.42 186 167 A 59 SER H A 58 GLY HA3 1.0 . 3.07 187 168 A 59 SER H A 58 GLY HAx 1.0 . 3.43 188 169 A 59 SER H A 60 LYS HB2 1.0 . 4.96 189 170 A 19 ALA H A 51 TYR HD% 1.0 . 5.50 190 171 A 19 ALA H A 15 TRP HA 1.0 . 4.76 191 172 A 19 ALA H A 16 GLU HA 1.0 . 4.13 192 173 A 19 ALA H A 18 ILE HB 1.0 . 3.33 193 174 A 19 ALA H A 18 ILE HG12 1.0 . 4.73 194 175 A 70 PHE H A 71 ASP H 1.0 . 5.14 195 176 A 71 ASP H A 76 LYS H 1.0 . 4.34 196 177 A 71 ASP H A 78 ASN HD21 1.0 . 5.36 197 178 A 71 ASP H A 70 PHE HA 1.0 . 3.30 198 179 A 71 ASP H A 77 VAL HA 1.0 . 4.32 199 180 A 71 ASP H A 71 ASP HB2 1.0 . 3.45 200 181 A 71 ASP H A 70 PHE HB2 1.0 . 3.84 201 182 A 71 ASP H A 77 VAL HG2% 1.0 . 5.50 202 183 A 52 HIS H A 36 GLN HG2 1.0 . 5.50 203 183 A 52 HIS H A 36 GLN HG3 1.0 . 5.50 204 184 A 52 HIS H A 38 VAL H 1.0 . 5.11 205 185 A 61 GLU H A 62 PHE H 1.0 . 4.47 206 186 A 62 PHE H A 61 GLU HA 1.0 . 2.93 207 187 A 62 PHE H A 54 THR HA 1.0 . 5.44 208 188 A 62 PHE H A 62 PHE HB2 1.0 . 3.93 209 188 A 62 PHE HB3 A 62 PHE H 1.0 . 3.93 210 189 A 62 PHE H A 61 GLU HG2 1.0 . 4.48 211 190 A 62 PHE H A 61 GLU HB2 1.0 . 3.68 212 190 A 62 PHE H A 61 GLU HB3 1.0 . 3.68 213 191 A 62 PHE H A 54 THR HG2% 1.0 . 4.66 214 192 A 62 PHE H A 55 LEU HB3 1.0 . 5.47 215 193 A 55 LEU HB2 A 62 PHE H 1.0 . 4.71 216 194 A 65 PHE HD% A 52 HIS H 1.0 . 5.50 217 195 A 52 HIS H A 36 GLN H 1.0 . 4.26 218 196 A 52 HIS H A 51 TYR HA 1.0 . 3.17 219 197 A 52 HIS H A 52 HIS HB2 1.0 . 3.85 220 198 A 52 HIS H A 52 HIS HB3 1.0 . 3.67 221 199 A 65 PHE HA A 52 HIS H 1.0 . 5.50 222 200 A 46 GLU H A 44 LYS H 1.0 . 5.18 223 201 A 44 LYS H A 43 ARG HA 1.0 . 3.22 224 202 A 44 LYS H A 44 LYS HB2 1.0 . 3.11 225 203 A 44 LYS H A 44 LYS HD2 1.0 . 4.05 226 203 A 44 LYS H A 44 LYS HD3 1.0 . 4.05 227 204 A 2 GLU H A 3 GLU H 1.0 . 5.50 228 205 A 3 GLU H A 3 GLU HG2 1.0 . 3.78 229 205 A 3 GLU H A 3 GLU HG3 1.0 . 3.78 230 206 A 35 LYS H A 53 LEU HD1% 1.0 . 5.50 231 207 A 36 GLN H A 35 LYS H 1.0 . 5.50 232 208 A 35 LYS H A 34 PHE HB3 1.0 . 4.44 233 209 A 35 LYS H A 36 GLN HB3 1.0 . 5.50 234 210 A 19 ALA H A 18 ILE H 1.0 . 3.43 235 211 A 15 TRP HA A 18 ILE H 1.0 . 4.09 236 212 A 16 GLU HA A 18 ILE H 1.0 . 5.07 237 213 A 18 ILE HB A 18 ILE H 1.0 . 2.96 238 214 A 18 ILE HG12 A 18 ILE H 1.0 . 3.57 239 215 A 20 VAL H A 21 LYS H 1.0 . 3.59 240 216 A 21 LYS H A 18 ILE HA 1.0 . 4.12 241 217 A 21 LYS H A 21 LYS HE2 1.0 . 5.50 242 217 A 21 LYS H A 21 LYS HE3 1.0 . 5.50 243 218 A 21 LYS H A 21 LYS HG2 1.0 . 3.62 244 219 A 8 THR HG2% A 10 ARG H 1.0 . 5.50 245 220 A 36 GLN H A 37 LYS HA 1.0 . 5.19 246 221 A 10 ARG H A 9 ALA HA 1.0 . 3.06 247 222 A 10 ARG H A 10 ARG HD2 1.0 . 5.50 248 222 A 10 ARG H A 10 ARG HD3 1.0 . 5.50 249 223 A 10 ARG H A 10 ARG HB3 1.0 . 3.51 250 224 A 10 ARG H A 9 ALA HB% 1.0 . 4.50 251 225 A 36 GLN H A 53 LEU HB3 1.0 . 5.39 252 226 A 37 LYS H A 36 GLN H 1.0 . 5.50 253 227 A 36 GLN H A 53 LEU HD1% 1.0 . 5.50 254 228 A 16 GLU H A 15 TRP H 1.0 . 3.51 255 229 A 16 GLU H A 14 LYS HA 1.0 . 4.50 256 230 A 15 TRP HB2 A 16 GLU H 1.0 . 4.13 257 231 A 14 LYS HB3 A 16 GLU H 1.0 . 5.50 258 232 A 76 LYS H A 71 ASP HA 1.0 . 5.50 259 233 A 76 LYS H A 75 GLN HB2 1.0 . 4.64 260 234 A 76 LYS H A 75 GLN H 1.0 . 3.47 261 235 A 76 LYS H A 78 ASN HD22 1.0 . 5.20 262 236 A 76 LYS H A 70 PHE HA 1.0 . 5.50 263 237 A 76 LYS H A 71 ASP HB2 1.0 . 3.62 264 238 A 76 LYS H A 71 ASP HB3 1.0 . 4.01 265 239 A 62 PHE HZ A 31 GLN H 1.0 . 5.50 266 240 A 56 ARG H A 31 GLN H 1.0 . 3.72 267 241 A 30 ALA H A 31 GLN H 1.0 . 4.68 268 242 A 55 LEU HA A 31 GLN H 1.0 . 4.83 269 243 A 31 GLN H A 31 GLN HB3 1.0 . 3.32 270 244 A 55 LEU HB3 A 31 GLN H 1.0 . 4.85 271 245 A 55 LEU HB2 A 31 GLN H 1.0 . 5.50 272 246 A 22 GLU H A 18 ILE HA 1.0 . 4.77 273 247 A 22 GLU H A 20 VAL HA 1.0 . 5.15 274 248 A 22 GLU H A 22 GLU HG2 1.0 . 3.85 275 249 A 22 GLU H A 22 GLU HB2 1.0 . 3.09 276 249 A 22 GLU H A 22 GLU HB3 1.0 . 3.09 277 250 A 15 TRP HE1 A 15 TRP H 1.0 . 5.22 278 251 A 14 LYS H A 15 TRP H 1.0 . 3.80 279 252 A 13 SER HB2 A 15 TRP H 1.0 . 4.47 280 253 A 15 TRP HB2 A 15 TRP H 1.0 . 3.30 281 254 A 14 LYS HB3 A 15 TRP H 1.0 . 3.67 282 255 A 78 ASN H A 79 LYS H 1.0 . 3.23 283 256 A 69 SER H A 79 LYS H 1.0 . 3.93 284 257 A 80 ILE H A 79 LYS H 1.0 . 4.76 285 258 A 69 SER HA A 79 LYS H 1.0 . 5.50 286 259 A 70 PHE HA A 79 LYS H 1.0 . 4.41 287 260 A 79 LYS H A 69 SER HB2 1.0 . 3.43 288 260 A 69 SER HB3 A 79 LYS H 1.0 . 3.43 289 261 A 78 ASN HB2 A 79 LYS H 1.0 . 3.55 290 262 A 12 MET HB3 A 13 SER H 1.0 . 4.66 291 263 A 13 SER H A 17 GLU H 1.0 . 5.50 292 264 A 16 GLU H A 13 SER H 1.0 . 5.09 293 265 A 15 TRP H A 13 SER H 1.0 . 5.50 294 266 A 13 SER H A 12 MET HA 1.0 . 2.88 295 267 A 13 SER HB2 A 13 SER H 1.0 . 3.88 296 268 A 13 SER H A 13 SER HB3 1.0 . 3.58 297 269 A 13 SER H A 16 GLU HG3 1.0 . 3.44 298 270 A 59 SER H A 58 GLY H 1.0 . 4.24 299 271 A 58 GLY H A 57 GLU HA 1.0 . 3.03 300 272 A 58 GLY H A 56 ARG HG2 1.0 . 4.66 301 272 A 58 GLY H A 56 ARG HG3 1.0 . 4.66 302 273 A 60 LYS H A 58 GLY H 1.0 . 5.50 303 274 A 56 ARG HA A 58 GLY H 1.0 . 5.50 304 275 A 58 GLY H A 57 GLU HB3 1.0 . 4.49 305 276 A 46 GLU H A 45 ASP H 1.0 . 3.23 306 277 A 46 GLU H A 44 LYS HA 1.0 . 5.04 307 278 A 46 GLU H A 72 PRO HD2 1.0 . 4.79 308 278 A 46 GLU H A 72 PRO HD3 1.0 . 4.79 309 279 A 46 GLU H A 45 ASP HB2 1.0 . 4.45 310 280 A 46 GLU H A 43 ARG HB3 1.0 . 3.80 311 281 A 46 GLU H A 46 GLU HB2 1.0 . 3.34 312 281 A 46 GLU H A 46 GLU HB3 1.0 . 3.34 313 282 A 46 GLU H A 72 PRO HB2 1.0 . 4.62 314 282 A 46 GLU H A 72 PRO HB3 1.0 . 4.62 315 283 A 46 GLU H A 47 ALA HB% 1.0 . 5.50 316 284 A 75 GLN H A 73 TYR H 1.0 . 4.41 317 285 A 73 TYR H A 72 PRO HD2 1.0 . 3.92 318 285 A 72 PRO HD3 A 73 TYR H 1.0 . 3.92 319 286 A 73 TYR H A 72 PRO HG2 1.0 . 3.77 320 286 A 73 TYR H A 72 PRO HG3 1.0 . 3.77 321 287 A 47 ALA HB% A 73 TYR H 1.0 . 5.50 322 288 A 48 VAL H A 47 ALA HA 1.0 . 3.23 323 289 A 48 VAL H A 48 VAL HB 1.0 . 3.84 324 290 A 33 LEU H A 54 THR H 1.0 . 4.28 325 291 A 34 PHE H A 54 THR H 1.0 . 4.12 326 292 A 54 THR H A 53 LEU HA 1.0 . 3.12 327 293 A 54 THR HB A 54 THR H 1.0 . 3.64 328 294 A 34 PHE HB2 A 54 THR H 1.0 . 4.63 329 295 A 54 THR H A 53 LEU HB3 1.0 . 3.77 330 296 A 54 THR H A 53 LEU HD1% 1.0 . 4.29 331 297 A 4 THR H A 4 THR HB 1.0 . 4.17 332 298 A 4 THR H A 4 THR HG2% 1.0 . 5.18 333 299 A 29 LEU H A 27 TYR HA 1.0 . 4.49 334 300 A 29 LEU H A 28 PRO HD2 1.0 . 4.39 335 301 A 30 ALA HB% A 29 LEU H 1.0 . 4.67 336 302 A 22 GLU H A 25 LYS H 1.0 . 5.50 337 303 A 25 LYS H A 27 TYR H 1.0 . 4.79 338 304 A 25 LYS H A 82 ILE HD1% 1.0 . 5.50 339 305 A 24 LYS H A 25 LYS H 1.0 . 3.44 340 306 A 26 ARG H A 25 LYS H 1.0 . 3.27 341 307 A 25 LYS H A 25 LYS HG2 1.0 . 3.43 342 308 A 27 TYR H A 28 PRO HA 1.0 . 5.50 343 309 A 29 LEU H A 27 TYR H 1.0 . 5.50 344 310 A 16 GLU H A 17 GLU H 1.0 . 3.39 345 311 A 15 TRP H A 17 GLU H 1.0 . 5.35 346 312 A 17 GLU H A 17 GLU HB2 1.0 . 2.84 347 312 A 17 GLU H A 17 GLU HB3 1.0 . 2.84 348 313 A 26 ARG H A 27 TYR H 1.0 . 3.19 349 314 A 27 TYR H A 27 TYR HE% 1.0 . 5.34 350 315 A 27 TYR H A 26 ARG HA 1.0 . 3.50 351 316 A 27 TYR H A 28 PRO HD3 1.0 . 4.53 352 317 A 27 TYR HB2 A 27 TYR H 1.0 . 3.88 353 318 A 27 TYR H A 27 TYR HB3 1.0 . 3.69 354 319 A 15 TRP HA A 17 GLU H 1.0 . 5.50 355 320 A 56 ARG H A 62 PHE HZ 1.0 . 5.50 356 321 A 55 LEU HA A 56 ARG H 1.0 . 3.24 357 322 A 56 ARG H A 30 ALA HA 1.0 . 5.24 358 323 A 56 ARG H A 31 GLN HB3 1.0 . 4.56 359 324 A 56 ARG H A 30 ALA HB% 1.0 . 3.89 360 325 A 56 ARG H A 55 LEU HB3 1.0 . 3.83 361 326 A 27 TYR HA A 26 ARG H 1.0 . 5.38 362 327 A 26 ARG H A 28 PRO HD3 1.0 . 5.50 363 328 A 26 ARG H A 26 ARG HD2 1.0 . 4.73 364 328 A 26 ARG H A 26 ARG HD3 1.0 . 4.73 365 329 A 26 ARG H A 27 TYR HB3 1.0 . 5.13 366 330 A 26 ARG H A 25 LYS HB2 1.0 . 3.41 367 330 A 26 ARG H A 25 LYS HB3 1.0 . 3.41 368 331 A 26 ARG H A 82 ILE HD1% 1.0 . 5.30 369 332 A 8 THR HG2% A 8 THR H 1.0 . 4.66 370 333 A 6 LEU HD2% A 8 THR H 1.0 . 4.63 371 334 A 24 LYS H A 24 LYS HE2 1.0 . 5.50 372 334 A 24 LYS HE3 A 24 LYS H 1.0 . 5.50 373 335 A 22 GLU H A 24 LYS H 1.0 . 4.64 374 336 A 24 LYS H A 26 ARG H 1.0 . 4.86 375 337 A 24 LYS H A 20 VAL HA 1.0 . 4.97 376 338 A 24 LYS H A 24 LYS HB2 1.0 . 2.98 377 339 A 18 ILE H A 20 VAL H 1.0 . 5.12 378 340 A 51 TYR HD% A 20 VAL H 1.0 . 5.50 379 341 A 20 VAL H A 17 GLU HA 1.0 . 3.72 380 342 A 20 VAL H A 18 ILE HA 1.0 . 5.42 381 343 A 16 GLU HA A 20 VAL H 1.0 . 4.88 382 344 A 20 VAL H A 20 VAL HB 1.0 . 3.08 383 345 A 20 VAL H A 21 LYS HG2 1.0 . 5.01 384 346 A 20 VAL H A 23 ALA HB% 1.0 . 5.08 385 347 A 19 ALA HB% A 20 VAL H 1.0 . 3.72 386 348 A 53 LEU HD1% A 20 VAL H 1.0 . 4.61 387 349 A 75 GLN H A 74 SER H 1.0 . 3.27 388 350 A 75 GLN H A 74 SER HB3 1.0 . 4.69 389 351 A 75 GLN H A 71 ASP HB3 1.0 . 4.59 390 352 A 75 GLN H A 75 GLN HG2 1.0 . 3.76 391 353 A 75 GLN H A 76 LYS HB2 1.0 . 4.90 392 353 A 75 GLN H A 76 LYS HB3 1.0 . 4.90 393 354 A 71 ASP HA A 75 GLN H 1.0 . 5.50 394 355 A 45 ASP H A 45 ASP HB2 1.0 . 3.59 395 356 A 44 LYS HB2 A 45 ASP H 1.0 . 3.23 396 357 A 65 PHE H A 64 VAL H 1.0 . 5.22 397 358 A 55 LEU H A 64 VAL H 1.0 . 3.91 398 359 A 64 VAL H A 63 GLY HAx 1.0 . 3.32 399 360 A 64 VAL HG2% A 64 VAL H 1.0 . 4.98 400 361 A 34 PHE H A 33 LEU HB2 1.0 . 5.33 401 362 A 76 LYS H A 74 SER H 1.0 . 4.54 402 363 A 74 SER H A 73 TYR HD% 1.0 . 5.20 403 364 A 70 PHE HD% A 74 SER H 1.0 . 5.50 404 365 A 71 ASP HA A 74 SER H 1.0 . 5.50 405 366 A 74 SER H A 74 SER HB2 1.0 . 3.83 406 367 A 74 SER H A 74 SER HB3 1.0 . 3.76 407 368 A 74 SER H A 72 PRO HD2 1.0 . 5.34 408 368 A 72 PRO HD3 A 74 SER H 1.0 . 5.34 409 369 A 74 SER H A 73 TYR HB2 1.0 . 3.28 410 369 A 74 SER H A 73 TYR HB3 1.0 . 3.28 411 370 A 71 ASP HB3 A 74 SER H 1.0 . 4.82 412 371 A 74 SER H A 76 LYS HB2 1.0 . 5.46 413 371 A 74 SER H A 76 LYS HB3 1.0 . 5.46 414 372 A 74 SER H A 72 PRO HB2 1.0 . 5.50 415 372 A 72 PRO HB3 A 74 SER H 1.0 . 5.50 416 373 A 75 GLN HE22 A 72 PRO HB2 1.0 . 5.50 417 373 A 72 PRO HB3 A 75 GLN HE22 1.0 . 5.50 418 374 A 15 TRP HE1 A 75 GLN HE22 1.0 . 5.50 419 375 A 75 GLN H A 75 GLN HE22 1.0 . 5.50 420 376 A 75 GLN HE22 A 72 PRO HA 1.0 . 5.50 421 377 A 15 TRP HE1 A 75 GLN HE21 1.0 . 5.50 422 378 A 75 GLN H A 75 GLN HE21 1.0 . 5.50 423 379 A 72 PRO HA A 75 GLN HE21 1.0 . 5.43 424 380 A 75 GLN HE21 A 72 PRO HB2 1.0 . 5.50 425 380 A 72 PRO HB3 A 75 GLN HE21 1.0 . 5.50 426 381 A 78 ASN H A 78 ASN HD22 1.0 . 5.46 427 382 A 70 PHE H A 78 ASN HD22 1.0 . 5.50 428 383 A 71 ASP H A 78 ASN HD22 1.0 . 5.50 429 384 A 71 ASP HA A 78 ASN HD22 1.0 . 5.50 430 385 A 78 ASN HD22 A 78 ASN HA 1.0 . 5.50 431 386 A 78 ASN HD22 A 69 SER HB2 1.0 . 5.13 432 386 A 69 SER HB3 A 78 ASN HD22 1.0 . 5.13 433 387 A 78 ASN HB2 A 78 ASN HD22 1.0 . 3.88 434 388 A 78 ASN HD22 A 46 GLU HG2 1.0 . 4.88 435 388 A 78 ASN HD22 A 46 GLU HG3 1.0 . 4.88 436 389 A 78 ASN HD22 A 46 GLU HB2 1.0 . 4.98 437 389 A 46 GLU HB3 A 78 ASN HD22 1.0 . 4.98 438 390 A 78 ASN HD21 A 79 LYS H 1.0 . 5.50 439 391 A 78 ASN HD21 A 69 SER HB2 1.0 . 5.20 440 391 A 69 SER HB3 A 78 ASN HD21 1.0 . 5.20 441 392 A 78 ASN HB2 A 78 ASN HD21 1.0 . 4.06 442 393 A 78 ASN H A 78 ASN HD21 1.0 . 5.50 443 394 A 70 PHE H A 78 ASN HD21 1.0 . 5.50 444 395 A 87 GLN HE21 A 62 PHE HA 1.0 . 5.50 445 396 A 87 GLN HE21 A 86 TYR HA 1.0 . 5.50 446 397 A 87 GLN HE21 A 87 GLN HA 1.0 . 5.50 447 398 A 87 GLN HE21 A 87 GLN HB3 1.0 . 5.50 448 399 A 87 GLN HE21 A 62 PHE HB2 1.0 . 5.50 449 399 A 62 PHE HB3 A 87 GLN HE21 1.0 . 5.50 450 400 A 32 VAL H A 31 GLN HE22 1.0 . 5.50 451 401 A 57 GLU HA A 31 GLN HE22 1.0 . 5.50 452 402 A 30 ALA HB% A 31 GLN HE22 1.0 . 5.50 453 403 A 31 GLN HE22 A 33 LEU HD1% 1.0 . 5.50 454 404 A 87 GLN HE22 A 86 TYR HA 1.0 . 5.14 455 405 A 87 GLN HE22 A 62 PHE HB2 1.0 . 5.50 456 405 A 62 PHE HB3 A 87 GLN HE22 1.0 . 5.50 457 406 A 54 THR HG2% A 63 GLY H 1.0 . 5.50 458 407 A 62 PHE HD% A 63 GLY H 1.0 . 4.67 459 408 A 63 GLY H A 62 PHE HB2 1.0 . 3.59 460 408 A 62 PHE HB3 A 63 GLY H 1.0 . 3.59 461 409 A 85 GLU HB2 A 63 GLY H 1.0 . 5.14 462 410 A 85 GLU HB3 A 63 GLY H 1.0 . 5.39 463 411 A 87 GLN HE21 A 63 GLY H 1.0 . 5.50 464 412 A 58 GLY HA3 A 59 SER HA 1.0 . 5.50 465 413 A 58 GLY HAx A 57 GLU HG2 1.0 . 5.50 466 414 A 82 ILE HA A 83 LEU HB2 1.0 . 5.46 467 415 A 83 LEU HB2 A 84 GLU HA 1.0 . 5.50 468 416 A 83 LEU HB3 A 84 GLU H 1.0 . 4.17 469 417 A 83 LEU H A 83 LEU HB2 1.0 . 3.61 470 418 A 65 PHE HB2 A 83 LEU HB2 1.0 . 3.69 471 419 A 83 LEU HB2 A 83 LEU HD1% 1.0 . 3.60 472 420 A 83 LEU HB3 A 65 PHE HD% 1.0 . 4.89 473 421 A 65 PHE HB2 A 83 LEU HB3 1.0 . 3.98 474 422 A 83 LEU HB3 A 65 PHE HB3 1.0 . 4.57 475 423 A 55 LEU H A 55 LEU HB3 1.0 . 3.90 476 424 A 62 PHE HZ A 55 LEU HB3 1.0 . 4.70 477 425 A 53 LEU H A 53 LEU HB2 1.0 . 4.15 478 426 A 54 THR H A 53 LEU HB2 1.0 . 4.13 479 427 A 55 LEU HD1% A 53 LEU HB2 1.0 . 4.60 480 428 A 53 LEU HD1% A 53 LEU HB3 1.0 . 3.42 481 429 A 55 LEU HD1% A 53 LEU HB3 1.0 . 4.42 482 430 A 53 LEU H A 53 LEU HB3 1.0 . 4.03 483 431 A 55 LEU HD1% A 55 LEU HB3 1.0 . 4.19 484 432 A 55 LEU HB2 A 54 THR HA 1.0 . 5.05 485 433 A 55 LEU HB2 A 56 ARG H 1.0 . 4.21 486 434 A 85 GLU HB2 A 63 GLY HAx 1.0 . 5.45 487 435 A 64 VAL HG1% A 63 GLY HAx 1.0 . 5.50 488 436 A 54 THR HG2% A 63 GLY HAx 1.0 . 5.50 489 437 A 55 LEU H A 63 GLY HAx 1.0 . 5.50 490 438 A 55 LEU H A 63 GLY HA3 1.0 . 4.70 491 439 A 63 GLY HA3 A 64 VAL H 1.0 . 3.52 492 440 A 63 GLY HA3 A 54 THR HA 1.0 . 4.20 493 441 A 63 GLY HA3 A 64 VAL HG1% 1.0 . 5.50 494 442 A 63 GLY HA3 A 54 THR HG2% 1.0 . 5.50 495 443 A 43 ARG HB3 A 43 ARG HD2 1.0 . 3.47 496 443 A 43 ARG HB3 A 43 ARG HD3 1.0 . 3.47 497 444 A 43 ARG HD3 A 48 VAL HG1% 1.0 . 4.99 498 444 A 43 ARG HD2 A 48 VAL HG1% 1.0 . 4.99 499 444 A 48 VAL HG2% A 43 ARG HD2 1.0 . 4.99 500 444 A 48 VAL HG2% A 43 ARG HD3 1.0 . 4.99 501 445 A 33 LEU H A 33 LEU HB3 1.0 . 3.68 502 446 A 33 LEU HB3 A 34 PHE HA 1.0 . 4.77 503 447 A 43 ARG HB2 A 43 ARG HD2 1.0 . 3.24 504 447 A 43 ARG HD3 A 43 ARG HB2 1.0 . 3.24 505 448 A 43 ARG HD2 A 43 ARG HG2 1.0 . 2.91 506 448 A 43 ARG HD3 A 43 ARG HG2 1.0 . 2.91 507 448 A 43 ARG HG3 A 43 ARG HD2 1.0 . 2.91 508 448 A 43 ARG HD3 A 43 ARG HG3 1.0 . 2.91 509 449 A 43 ARG HA A 43 ARG HD2 1.0 . 3.26 510 449 A 43 ARG HA A 43 ARG HD3 1.0 . 3.26 511 450 A 41 ARG H A 40 ASP HB2 1.0 . 4.47 512 451 A 34 PHE HB3 A 33 LEU HB3 1.0 . 4.73 513 452 A 33 LEU HB3 A 34 PHE HD% 1.0 . 5.06 514 453 A 34 PHE H A 33 LEU HB3 1.0 . 4.42 515 454 A 33 LEU H A 33 LEU HB2 1.0 . 3.97 516 455 A 33 LEU HB2 A 34 PHE HD% 1.0 . 5.50 517 456 A 43 ARG H A 43 ARG HD2 1.0 . 5.50 518 456 A 43 ARG H A 43 ARG HD3 1.0 . 5.50 519 457 A 70 PHE HA A 71 ASP HB2 1.0 . 4.64 520 458 A 41 ARG HD3 A 42 LYS HA 1.0 . 3.79 521 459 A 71 ASP HB3 A 73 TYR H 1.0 . 4.93 522 460 A 41 ARG H A 40 ASP HB3 1.0 . 4.82 523 461 A 41 ARG HD2 A 41 ARG HA 1.0 . 5.27 524 462 A 71 ASP HB2 A 72 PRO HD2 1.0 . 4.79 525 462 A 72 PRO HD3 A 71 ASP HB2 1.0 . 4.79 526 463 A 33 LEU H A 34 PHE HB3 1.0 . 5.22 527 464 A 54 THR H A 34 PHE HB3 1.0 . 4.60 528 465 A 41 ARG HD3 A 39 TRP HH2 1.0 . 5.06 529 466 A 71 ASP HB3 A 73 TYR HD% 1.0 . 4.98 530 467 A 42 LYS H A 41 ARG HD3 1.0 . 3.56 531 468 A 34 PHE HB2 A 35 LYS H 1.0 . 4.40 532 469 A 71 ASP H A 70 PHE HB3 1.0 . 3.91 533 470 A 34 PHE H A 34 PHE HB3 1.0 . 4.05 534 471 A 75 GLN HA A 70 PHE HB2 1.0 . 5.27 535 472 A 78 ASN H A 70 PHE HB2 1.0 . 4.40 536 473 A 52 HIS H A 51 TYR HB2 1.0 . 4.28 537 474 A 52 HIS H A 51 TYR HB3 1.0 . 5.27 538 475 A 8 THR H A 6 LEU HB3 1.0 . 4.57 539 476 A 6 LEU H A 6 LEU HB2 1.0 . 3.70 540 477 A 8 THR H A 6 LEU HB2 1.0 . 4.22 541 478 A 4 THR HB A 6 LEU HB2 1.0 . 5.34 542 479 A 6 LEU HD2% A 6 LEU HB2 1.0 . 4.09 543 480 A 6 LEU H A 6 LEU HB3 1.0 . 3.69 544 481 A 47 ALA HB% A 42 LYS HE2 1.0 . 4.98 545 481 A 47 ALA HB% A 42 LYS HE3 1.0 . 4.98 546 482 A 62 PHE HE% A 60 LYS HE2 1.0 . 4.93 547 482 A 60 LYS HE3 A 62 PHE HE% 1.0 . 4.93 548 483 A 21 LYS HB3 A 21 LYS HE2 1.0 . 3.87 549 483 A 21 LYS HB2 A 21 LYS HE2 1.0 . 3.87 550 483 A 21 LYS HE3 A 21 LYS HB2 1.0 . 3.87 551 483 A 21 LYS HE3 A 21 LYS HB3 1.0 . 3.87 552 484 A 21 LYS HD3 A 21 LYS HE2 1.0 . 2.56 553 484 A 21 LYS HD2 A 21 LYS HE2 1.0 . 2.56 554 484 A 21 LYS HE3 A 21 LYS HD2 1.0 . 2.56 555 484 A 21 LYS HE3 A 21 LYS HD3 1.0 . 2.56 556 485 A 53 LEU HD1% A 35 LYS HD2 1.0 . 4.38 557 485 A 53 LEU HD1% A 35 LYS HD3 1.0 . 4.38 558 486 A 25 LYS H A 25 LYS HE2 1.0 . 5.13 559 486 A 25 LYS H A 25 LYS HE3 1.0 . 5.13 560 487 A 22 GLU HA A 25 LYS HE2 1.0 . 4.43 561 487 A 25 LYS HE3 A 22 GLU HA 1.0 . 4.43 562 488 A 20 VAL HG1% A 24 LYS HE2 1.0 . 3.80 563 488 A 24 LYS HE3 A 20 VAL HG1% 1.0 . 3.80 564 489 A 35 LYS HA A 35 LYS HD2 1.0 . 5.25 565 489 A 35 LYS HD3 A 35 LYS HA 1.0 . 5.25 566 490 A 65 PHE HB2 A 64 VAL HA 1.0 . 5.15 567 491 A 65 PHE HB2 A 66 VAL H 1.0 . 4.58 568 492 A 65 PHE HB2 A 83 LEU HD1% 1.0 . 4.95 569 493 A 66 VAL H A 65 PHE HB3 1.0 . 4.51 570 494 A 65 PHE H A 65 PHE HB3 1.0 . 3.99 571 495 A 83 LEU HB2 A 65 PHE HB3 1.0 . 3.71 572 496 A 14 LYS HE2 A 18 ILE HD1% 1.0 . 4.47 573 497 A 14 LYS HA A 14 LYS HE2 1.0 . 5.30 574 498 A 14 LYS HB2 A 14 LYS HE2 1.0 . 5.29 575 499 A 14 LYS HE2 A 14 LYS HG3 1.0 . 4.21 576 500 A 14 LYS HE2 A 15 TRP HZ2 1.0 . 5.46 577 501 A 15 TRP HH2 A 14 LYS HE2 1.0 . 5.27 578 502 A 69 SER H A 68 ILE HB 1.0 . 4.42 579 503 A 70 PHE HD% A 68 ILE HB 1.0 . 5.12 580 504 A 68 ILE H A 68 ILE HB 1.0 . 3.49 581 505 A 50 GLN HG3 A 68 ILE HB 1.0 . 4.21 582 506 A 45 ASP HB2 A 72 PRO HD2 1.0 . 5.29 583 506 A 72 PRO HD3 A 45 ASP HB2 1.0 . 5.29 584 507 A 30 ALA H A 29 LEU HB2 1.0 . 4.42 585 508 A 29 LEU HB2 A 29 LEU HD2% 1.0 . 3.57 586 509 A 29 LEU H A 29 LEU HB2 1.0 . 3.63 587 510 A 29 LEU HB2 A 57 GLU HG3 1.0 . 4.93 588 511 A 30 ALA H A 29 LEU HB3 1.0 . 4.51 589 512 A 29 LEU H A 29 LEU HB3 1.0 . 3.55 590 513 A 46 GLU H A 45 ASP HB3 1.0 . 4.60 591 514 A 45 ASP HB3 A 45 ASP HA 1.0 . 3.01 592 515 A 45 ASP H A 45 ASP HB3 1.0 . 3.71 593 516 A 80 ILE H A 80 ILE HB 1.0 . 3.26 594 517 A 81 ALA H A 80 ILE HB 1.0 . 4.47 595 518 A 82 ILE H A 82 ILE HB 1.0 . 3.25 596 519 A 82 ILE HD1% A 82 ILE HB 1.0 . 3.63 597 520 A 83 LEU H A 82 ILE HB 1.0 . 4.45 598 521 A 60 LYS HE2 A 62 PHE HB2 1.0 . 5.50 599 521 A 60 LYS HE3 A 62 PHE HB2 1.0 . 5.50 600 521 A 62 PHE HB3 A 60 LYS HE2 1.0 . 5.50 601 521 A 62 PHE HB3 A 60 LYS HE3 1.0 . 5.50 602 522 A 78 ASN H A 78 ASN HB3 1.0 . 3.68 603 523 A 78 ASN HB3 A 69 SER HB2 1.0 . 3.89 604 523 A 69 SER HB3 A 78 ASN HB3 1.0 . 3.89 605 524 A 79 LYS H A 78 ASN HB3 1.0 . 3.58 606 525 A 78 ASN HD22 A 78 ASN HB3 1.0 . 3.69 607 526 A 78 ASN HB3 A 79 LYS HB2 1.0 . 4.44 608 526 A 78 ASN HB3 A 79 LYS HB3 1.0 . 4.44 609 527 A 70 PHE HA A 78 ASN HB3 1.0 . 4.53 610 528 A 78 ASN HB3 A 79 LYS HG2 1.0 . 5.36 611 528 A 78 ASN HB3 A 79 LYS HG3 1.0 . 5.36 612 529 A 78 ASN HB2 A 69 SER HB2 1.0 . 4.02 613 529 A 78 ASN HB2 A 69 SER HB3 1.0 . 4.02 614 530 A 78 ASN HB2 A 79 LYS HB2 1.0 . 4.51 615 530 A 78 ASN HB2 A 79 LYS HB3 1.0 . 4.51 616 531 A 78 ASN HB2 A 79 LYS HG2 1.0 . 5.14 617 531 A 78 ASN HB2 A 79 LYS HG3 1.0 . 5.14 618 532 A 86 TYR H A 86 TYR HB2 1.0 . 3.56 619 533 A 87 GLN H A 86 TYR HB2 1.0 . 4.12 620 534 A 27 TYR HB2 A 28 PRO HD2 1.0 . 4.72 621 535 A 55 LEU HD1% A 27 TYR HB2 1.0 . 5.25 622 536 A 29 LEU H A 27 TYR HB2 1.0 . 5.10 623 537 A 30 ALA H A 27 TYR HB3 1.0 . 5.04 624 538 A 30 ALA HB% A 27 TYR HB3 1.0 . 4.03 625 539 A 50 GLN H A 50 GLN HG2 1.0 . 5.05 626 540 A 50 GLN HA A 50 GLN HG3 1.0 . 4.21 627 541 A 75 GLN H A 73 TYR HB2 1.0 . 4.70 628 541 A 75 GLN H A 73 TYR HB3 1.0 . 4.70 629 542 A 73 TYR H A 73 TYR HB2 1.0 . 3.02 630 542 A 73 TYR H A 73 TYR HB3 1.0 . 3.02 631 543 A 72 PRO HG3 A 73 TYR HB2 1.0 . 4.99 632 543 A 73 TYR HB3 A 72 PRO HG2 1.0 . 4.99 633 543 A 72 PRO HG3 A 73 TYR HB3 1.0 . 4.99 634 543 A 72 PRO HG2 A 73 TYR HB2 1.0 . 4.99 635 544 A 15 TRP HA A 18 ILE HB 1.0 . 3.63 636 545 A 18 ILE HB A 19 ALA HA 1.0 . 4.52 637 546 A 50 GLN HG3 A 50 GLN H 1.0 . 4.86 638 547 A 13 SER H A 16 GLU HG2 1.0 . 4.70 639 547 A 13 SER H A 16 GLU HG3 1.0 . 4.70 640 548 A 51 TYR HE% A 16 GLU HG2 1.0 . 4.28 641 548 A 16 GLU HG3 A 51 TYR HE% 1.0 . 4.28 642 549 A 16 GLU HA A 16 GLU HG2 1.0 . 3.52 643 549 A 16 GLU HA A 16 GLU HG3 1.0 . 3.52 644 550 A 17 GLU H A 16 GLU HG2 1.0 . 4.68 645 550 A 17 GLU H A 16 GLU HG3 1.0 . 4.68 646 551 A 16 GLU H A 16 GLU HG2 1.0 . 3.83 647 551 A 16 GLU H A 16 GLU HG3 1.0 . 3.83 648 552 A 65 PHE HA A 64 VAL HB 1.0 . 5.43 649 553 A 27 TYR HE% A 84 GLU HG3 1.0 . 5.23 650 554 A 85 GLU H A 84 GLU HG3 1.0 . 4.07 651 555 A 64 VAL HG2% A 84 GLU HG3 1.0 . 4.08 652 556 A 84 GLU HA A 84 GLU HG3 1.0 . 3.43 653 557 A 62 PHE HE% A 84 GLU HG3 1.0 . 5.39 654 558 A 84 GLU HA A 84 GLU HG2 1.0 . 3.41 655 559 A 64 VAL HG1% A 84 GLU HG2 1.0 . 5.01 656 560 A 64 VAL HG2% A 84 GLU HG2 1.0 . 4.10 657 561 A 85 GLU H A 84 GLU HG2 1.0 . 4.06 658 562 A 62 PHE HD% A 84 GLU HG2 1.0 . 4.29 659 563 A 62 PHE HE% A 84 GLU HG2 1.0 . 4.88 660 564 A 83 LEU H A 64 VAL HB 1.0 . 4.33 661 565 A 64 VAL H A 64 VAL HB 1.0 . 3.77 662 566 A 65 PHE H A 64 VAL HB 1.0 . 3.37 663 567 A 84 GLU HA A 64 VAL HB 1.0 . 4.27 664 568 A 55 LEU HD1% A 64 VAL HB 1.0 . 4.33 665 569 A 17 GLU HA A 17 GLU HG3 1.0 . 3.42 666 570 A 17 GLU H A 17 GLU HG3 1.0 . 3.76 667 571 A 56 ARG HA A 61 GLU HG2 1.0 . 4.44 668 572 A 61 GLU HA A 61 GLU HG2 1.0 . 3.79 669 573 A 61 GLU HG2 A 33 LEU HD2% 1.0 . 4.55 670 574 A 61 GLU HG2 A 56 ARG HD2 1.0 . 4.87 671 574 A 61 GLU HG2 A 56 ARG HD3 1.0 . 4.87 672 575 A 17 GLU H A 17 GLU HG2 1.0 . 3.73 673 576 A 17 GLU HA A 17 GLU HG2 1.0 . 3.39 674 577 A 17 GLU HG2 A 21 LYS HE2 1.0 . 4.83 675 577 A 21 LYS HE3 A 17 GLU HG2 1.0 . 4.83 676 578 A 61 GLU HA A 61 GLU HG3 1.0 . 3.83 677 579 A 61 GLU HG3 A 56 ARG HG2 1.0 . 4.49 678 579 A 56 ARG HG3 A 61 GLU HG3 1.0 . 4.49 679 580 A 54 THR HG2% A 61 GLU HG3 1.0 . 4.63 680 581 A 33 LEU HD2% A 61 GLU HG3 1.0 . 4.40 681 582 A 62 PHE H A 61 GLU HG3 1.0 . 3.93 682 583 A 18 ILE HA A 22 GLU HG3 1.0 . 5.26 683 584 A 17 GLU HG2 A 20 VAL HG2% 1.0 . 4.76 684 585 A 56 ARG HA A 61 GLU HG3 1.0 . 4.33 685 586 A 78 ASN H A 79 LYS HB2 1.0 . 4.77 686 586 A 78 ASN H A 79 LYS HB3 1.0 . 4.77 687 587 A 22 GLU HG2 A 18 ILE HG2% 1.0 . 4.25 688 588 A 86 TYR H A 85 GLU HG3 1.0 . 3.84 689 589 A 22 GLU H A 22 GLU HG3 1.0 . 3.74 690 590 A 22 GLU HG2 A 82 ILE HD1% 1.0 . 4.24 691 591 A 85 GLU HG3 A 85 GLU HA 1.0 . 3.90 692 592 A 82 ILE HD1% A 22 GLU HG3 1.0 . 3.94 693 593 A 23 ALA H A 22 GLU HG3 1.0 . 5.48 694 594 A 62 PHE HA A 85 GLU HG3 1.0 . 5.50 695 595 A 22 GLU HA A 22 GLU HG3 1.0 . 4.02 696 596 A 22 GLU HG3 A 18 ILE HG2% 1.0 . 4.02 697 597 A 86 TYR H A 85 GLU HG2 1.0 . 3.94 698 598 A 85 GLU HG2 A 65 PHE HE% 1.0 . 5.21 699 599 A 85 GLU HA A 85 GLU HG2 1.0 . 3.92 700 600 A 30 ALA HB% A 57 GLU HG3 1.0 . 4.44 701 601 A 57 GLU HA A 57 GLU HG3 1.0 . 3.51 702 602 A 57 GLU HB3 A 57 GLU HG3 1.0 . 2.90 703 603 A 78 ASN HD21 A 46 GLU HG2 1.0 . 4.34 704 603 A 78 ASN HD21 A 46 GLU HG3 1.0 . 4.34 705 604 A 46 GLU HG2 A 48 VAL HG1% 1.0 . 3.83 706 604 A 46 GLU HG3 A 48 VAL HG1% 1.0 . 3.83 707 604 A 48 VAL HG2% A 46 GLU HG2 1.0 . 3.83 708 604 A 48 VAL HG2% A 46 GLU HG3 1.0 . 3.83 709 605 A 70 PHE H A 46 GLU HG2 1.0 . 4.23 710 605 A 70 PHE H A 46 GLU HG3 1.0 . 4.23 711 606 A 47 ALA H A 46 GLU HG2 1.0 . 3.33 712 606 A 47 ALA H A 46 GLU HG3 1.0 . 3.33 713 607 A 46 GLU HB2 A 46 GLU HG2 1.0 . 2.40 714 607 A 46 GLU HG3 A 46 GLU HB2 1.0 . 2.40 715 607 A 46 GLU HB3 A 46 GLU HG3 1.0 . 2.40 716 607 A 46 GLU HB3 A 46 GLU HG2 1.0 . 2.40 717 608 A 46 GLU HA A 46 GLU HG2 1.0 . 3.23 718 608 A 46 GLU HA A 46 GLU HG3 1.0 . 3.23 719 609 A 46 GLU HG3 A 69 SER HB2 1.0 . 4.30 720 609 A 69 SER HB3 A 46 GLU HG2 1.0 . 4.30 721 609 A 69 SER HB3 A 46 GLU HG3 1.0 . 4.30 722 609 A 46 GLU HG2 A 69 SER HB2 1.0 . 4.30 723 610 A 80 ILE H A 79 LYS HB2 1.0 . 3.43 724 610 A 80 ILE H A 79 LYS HB3 1.0 . 3.43 725 611 A 69 SER HB3 A 79 LYS HB2 1.0 . 3.22 726 611 A 69 SER HB2 A 79 LYS HB2 1.0 . 3.22 727 611 A 79 LYS HB3 A 69 SER HB2 1.0 . 3.22 728 611 A 69 SER HB3 A 79 LYS HB3 1.0 . 3.22 729 612 A 79 LYS H A 79 LYS HB2 1.0 . 3.40 730 612 A 79 LYS H A 79 LYS HB3 1.0 . 3.40 731 613 A 79 LYS HA A 79 LYS HB2 1.0 . 2.95 732 613 A 79 LYS HA A 79 LYS HB3 1.0 . 2.95 733 614 A 77 VAL HG1% A 79 LYS HB2 1.0 . 4.69 734 614 A 77 VAL HG1% A 79 LYS HB3 1.0 . 4.69 735 615 A 62 PHE HE% A 57 GLU HG3 1.0 . 4.58 736 616 A 46 GLU HG3 A 72 PRO HD2 1.0 . 4.73 737 616 A 46 GLU HG2 A 72 PRO HD2 1.0 . 4.73 738 616 A 72 PRO HD3 A 46 GLU HG2 1.0 . 4.73 739 616 A 72 PRO HD3 A 46 GLU HG3 1.0 . 4.73 740 617 A 78 ASN HB3 A 46 GLU HG2 1.0 . 4.49 741 617 A 46 GLU HG3 A 78 ASN HB3 1.0 . 4.49 742 618 A 48 VAL HB A 39 TRP HZ3 1.0 . 4.27 743 619 A 35 LYS H A 35 LYS HB2 1.0 . 4.14 744 619 A 35 LYS H A 35 LYS HB3 1.0 . 4.14 745 620 A 36 GLN H A 35 LYS HB2 1.0 . 4.03 746 620 A 36 GLN H A 35 LYS HB3 1.0 . 4.03 747 621 A 35 LYS HB2 A 35 LYS HD2 1.0 . 4.16 748 621 A 35 LYS HD3 A 35 LYS HB2 1.0 . 4.16 749 621 A 35 LYS HD3 A 35 LYS HB3 1.0 . 4.16 750 621 A 35 LYS HB3 A 35 LYS HD2 1.0 . 4.16 751 622 A 20 VAL HG2% A 35 LYS HB2 1.0 . 4.68 752 622 A 20 VAL HG2% A 35 LYS HB3 1.0 . 4.68 753 623 A 53 LEU HD1% A 35 LYS HB2 1.0 . 3.51 754 623 A 53 LEU HD1% A 35 LYS HB3 1.0 . 3.51 755 624 A 76 LYS H A 75 GLN HG2 1.0 . 5.43 756 625 A 66 VAL HB A 51 TYR HB2 1.0 . 4.66 757 626 A 66 VAL HB A 19 ALA HB% 1.0 . 3.80 758 627 A 66 VAL HB A 66 VAL H 1.0 . 3.53 759 628 A 15 TRP HH2 A 75 GLN HG2 1.0 . 4.71 760 629 A 86 TYR H A 87 GLN HG2 1.0 . 4.63 761 629 A 86 TYR H A 87 GLN HG3 1.0 . 4.63 762 630 A 87 GLN HE21 A 87 GLN HG2 1.0 . 3.97 763 630 A 87 GLN HE21 A 87 GLN HG3 1.0 . 3.97 764 631 A 75 GLN HG3 A 15 TRP HH2 1.0 . 4.67 765 632 A 87 GLN HA A 87 GLN HG2 1.0 . 3.29 766 632 A 87 GLN HG3 A 87 GLN HA 1.0 . 3.29 767 633 A 61 GLU H A 60 LYS HB2 1.0 . 3.90 768 634 A 66 VAL HB A 19 ALA HA 1.0 . 4.25 769 635 A 12 MET H A 12 MET HG2 1.0 . 4.62 770 636 A 13 SER H A 12 MET HG2 1.0 . 4.20 771 637 A 59 SER H A 60 LYS HB3 1.0 . 4.79 772 638 A 60 LYS H A 60 LYS HB3 1.0 . 3.28 773 639 A 57 GLU H A 60 LYS HB3 1.0 . 4.21 774 640 A 61 GLU H A 60 LYS HB3 1.0 . 4.02 775 641 A 60 LYS HB3 A 60 LYS HE2 1.0 . 4.29 776 641 A 60 LYS HE3 A 60 LYS HB3 1.0 . 4.29 777 642 A 61 GLU HG3 A 56 ARG HB2 1.0 . 2.89 778 642 A 61 GLU HG3 A 56 ARG HB3 1.0 . 2.89 779 643 A 33 LEU HD2% A 56 ARG HB2 1.0 . 4.57 780 643 A 33 LEU HD2% A 56 ARG HB3 1.0 . 4.57 781 644 A 57 GLU H A 56 ARG HB2 1.0 . 4.80 782 644 A 57 GLU H A 56 ARG HB3 1.0 . 4.80 783 645 A 47 ALA HB% A 42 LYS HB2 1.0 . 4.63 784 646 A 42 LYS HB3 A 42 LYS HE2 1.0 . 4.99 785 646 A 42 LYS HE3 A 42 LYS HB3 1.0 . 4.99 786 647 A 42 LYS H A 42 LYS HB3 1.0 . 3.73 787 648 A 43 ARG H A 42 LYS HB3 1.0 . 3.93 788 649 A 47 ALA HB% A 42 LYS HB3 1.0 . 4.65 789 650 A 42 LYS HB2 A 42 LYS HE2 1.0 . 4.57 790 650 A 42 LYS HE3 A 42 LYS HB2 1.0 . 4.57 791 651 A 41 ARG HB3 A 42 LYS H 1.0 . 4.84 792 652 A 41 ARG HB2 A 42 LYS H 1.0 . 4.92 793 653 A 31 GLN HA A 31 GLN HG2 1.0 . 3.69 794 654 A 56 ARG H A 31 GLN HG3 1.0 . 5.32 795 655 A 31 GLN HA A 31 GLN HG3 1.0 . 3.57 796 656 A 31 GLN H A 31 GLN HG3 1.0 . 3.84 797 657 A 30 ALA HB% A 31 GLN HG3 1.0 . 4.86 798 658 A 76 LYS H A 76 LYS HB2 1.0 . 2.94 799 658 A 76 LYS H A 76 LYS HB3 1.0 . 2.94 800 659 A 77 VAL H A 76 LYS HB2 1.0 . 3.81 801 659 A 77 VAL H A 76 LYS HB3 1.0 . 3.81 802 660 A 76 LYS HA A 76 LYS HB2 1.0 . 2.93 803 660 A 76 LYS HB3 A 76 LYS HA 1.0 . 2.93 804 661 A 71 ASP HB3 A 76 LYS HB2 1.0 . 3.98 805 661 A 71 ASP HB3 A 76 LYS HB3 1.0 . 3.98 806 662 A 41 ARG HB2 A 42 LYS HA 1.0 . 5.02 807 663 A 41 ARG HB2 A 48 VAL H 1.0 . 5.48 808 664 A 37 LYS H A 36 GLN HG2 1.0 . 4.07 809 664 A 37 LYS H A 36 GLN HG3 1.0 . 4.07 810 665 A 36 GLN H A 36 GLN HG2 1.0 . 4.16 811 665 A 36 GLN HG3 A 36 GLN H 1.0 . 4.16 812 666 A 51 TYR HA A 38 VAL HB 1.0 . 5.50 813 667 A 37 LYS H A 36 GLN HB3 1.0 . 4.31 814 668 A 52 HIS HB2 A 36 GLN HB3 1.0 . 4.77 815 669 A 36 GLN HB3 A 34 PHE HE% 1.0 . 5.05 816 670 A 78 ASN H A 77 VAL HB 1.0 . 4.77 817 671 A 77 VAL H A 77 VAL HB 1.0 . 2.90 818 672 A 79 LYS H A 77 VAL HB 1.0 . 5.47 819 673 A 77 VAL HB A 15 TRP HZ3 1.0 . 5.26 820 674 A 3 GLU H A 3 GLU HB2 1.0 . 3.49 821 674 A 3 GLU H A 3 GLU HB3 1.0 . 3.49 822 675 A 3 GLU HB3 A 3 GLU HG2 1.0 . 2.80 823 675 A 3 GLU HB2 A 3 GLU HG2 1.0 . 2.80 824 675 A 3 GLU HG3 A 3 GLU HB2 1.0 . 2.80 825 675 A 3 GLU HG3 A 3 GLU HB3 1.0 . 2.80 826 676 A 25 LYS H A 25 LYS HB2 1.0 . 2.83 827 676 A 25 LYS H A 25 LYS HB3 1.0 . 2.83 828 677 A 25 LYS HA A 25 LYS HB2 1.0 . 2.69 829 677 A 25 LYS HB3 A 25 LYS HA 1.0 . 2.69 830 678 A 27 TYR H A 25 LYS HB2 1.0 . 4.69 831 678 A 27 TYR H A 25 LYS HB3 1.0 . 4.69 832 679 A 56 ARG HA A 57 GLU HB2 1.0 . 5.50 833 680 A 44 LYS H A 43 ARG HB3 1.0 . 3.95 834 681 A 46 GLU HA A 43 ARG HB3 1.0 . 4.97 835 682 A 25 LYS HG2 A 25 LYS HB2 1.0 . 2.80 836 682 A 25 LYS HG2 A 25 LYS HB3 1.0 . 2.80 837 683 A 47 ALA HB% A 46 GLU HB2 1.0 . 5.10 838 683 A 47 ALA HB% A 46 GLU HB3 1.0 . 5.10 839 684 A 29 LEU H A 28 PRO HB2 1.0 . 4.56 840 685 A 62 PHE HD% A 57 GLU HB2 1.0 . 5.50 841 686 A 57 GLU H A 57 GLU HB2 1.0 . 3.86 842 687 A 70 PHE HB3 A 77 VAL HB 1.0 . 5.50 843 688 A 43 ARG H A 43 ARG HB3 1.0 . 3.81 844 689 A 28 PRO HB3 A 29 LEU HD1% 1.0 . 4.91 845 690 A 78 ASN HD21 A 46 GLU HB2 1.0 . 4.87 846 690 A 46 GLU HB3 A 78 ASN HD21 1.0 . 4.87 847 691 A 13 SER H A 12 MET HB2 1.0 . 5.11 848 692 A 47 ALA H A 46 GLU HB2 1.0 . 3.05 849 692 A 47 ALA H A 46 GLU HB3 1.0 . 3.05 850 693 A 73 TYR HD% A 72 PRO HB2 1.0 . 5.20 851 693 A 72 PRO HB3 A 73 TYR HD% 1.0 . 5.20 852 694 A 11 HIS HA A 12 MET HB2 1.0 . 4.56 853 695 A 61 GLU H A 61 GLU HB2 1.0 . 3.00 854 695 A 61 GLU H A 61 GLU HB3 1.0 . 3.00 855 696 A 56 ARG HA A 61 GLU HB2 1.0 . 4.36 856 696 A 56 ARG HA A 61 GLU HB3 1.0 . 4.36 857 697 A 73 TYR H A 72 PRO HB2 1.0 . 4.32 858 697 A 72 PRO HB3 A 73 TYR H 1.0 . 4.32 859 698 A 71 ASP HA A 72 PRO HB2 1.0 . 4.99 860 698 A 71 ASP HA A 72 PRO HB3 1.0 . 4.99 861 699 A 14 LYS HB2 A 15 TRP H 1.0 . 3.96 862 700 A 14 LYS HB2 A 14 LYS HE3 1.0 . 5.13 863 701 A 21 LYS H A 20 VAL HB 1.0 . 3.47 864 702 A 17 GLU HA A 20 VAL HB 1.0 . 3.42 865 703 A 17 GLU H A 20 VAL HB 1.0 . 5.40 866 704 A 24 LYS H A 24 LYS HB2 1.0 . 3.16 867 704 A 24 LYS H A 24 LYS HB3 1.0 . 3.16 868 705 A 24 LYS HA A 24 LYS HB2 1.0 . 2.82 869 705 A 24 LYS HA A 24 LYS HB3 1.0 . 2.82 870 706 A 24 LYS HG2 A 24 LYS HB2 1.0 . 2.97 871 706 A 24 LYS HB3 A 24 LYS HG2 1.0 . 2.97 872 707 A 14 LYS HB3 A 18 ILE HD1% 1.0 . 5.30 873 708 A 14 LYS HB3 A 13 SER HA 1.0 . 5.02 874 709 A 75 GLN HG3 A 14 LYS HB3 1.0 . 4.43 875 710 A 20 VAL HB A 23 ALA HB% 1.0 . 5.47 876 711 A 24 LYS HB3 A 24 LYS HE2 1.0 . 3.97 877 711 A 24 LYS HB2 A 24 LYS HE2 1.0 . 3.97 878 711 A 24 LYS HE3 A 24 LYS HB2 1.0 . 3.97 879 711 A 24 LYS HE3 A 24 LYS HB3 1.0 . 3.97 880 712 A 52 HIS HB3 A 65 PHE HE% 1.0 . 5.43 881 713 A 33 LEU H A 32 VAL HB 1.0 . 4.39 882 714 A 52 HIS HB2 A 65 PHE HE% 1.0 . 5.50 883 715 A 33 LEU HD1% A 32 VAL HB 1.0 . 5.23 884 716 A 32 VAL H A 32 VAL HB 1.0 . 3.20 885 717 A 24 LYS HA A 32 VAL HB 1.0 . 3.88 886 718 A 33 LEU HD1% A 31 GLN HB2 1.0 . 5.26 887 719 A 84 GLU HA A 85 GLU HB3 1.0 . 5.36 888 720 A 87 GLN HE22 A 87 GLN HB2 1.0 . 5.50 889 721 A 87 GLN HE21 A 87 GLN HB2 1.0 . 5.50 890 722 A 10 ARG HB2 A 10 ARG HD2 1.0 . 4.10 891 722 A 10 ARG HD3 A 10 ARG HB2 1.0 . 4.10 892 723 A 10 ARG H A 10 ARG HB2 1.0 . 3.90 893 724 A 10 ARG HB3 A 10 ARG HD2 1.0 . 4.21 894 724 A 10 ARG HD3 A 10 ARG HB3 1.0 . 4.21 895 725 A 87 GLN H A 87 GLN HB3 1.0 . 3.95 896 726 A 87 GLN HB2 A 87 GLN HG2 1.0 . 2.69 897 726 A 87 GLN HG3 A 87 GLN HB2 1.0 . 2.69 898 727 A 87 GLN H A 87 GLN HB2 1.0 . 3.84 899 728 A 11 HIS HA A 10 ARG HB3 1.0 . 5.12 900 729 A 87 GLN HB3 A 87 GLN HG2 1.0 . 2.46 901 729 A 87 GLN HG3 A 87 GLN HB3 1.0 . 2.46 902 730 A 62 PHE HE% A 84 GLU HB2 1.0 . 5.24 903 730 A 62 PHE HE% A 84 GLU HB3 1.0 . 5.24 904 731 A 84 GLU H A 84 GLU HB2 1.0 . 3.01 905 731 A 84 GLU H A 84 GLU HB3 1.0 . 3.01 906 732 A 85 GLU H A 84 GLU HB2 1.0 . 3.43 907 732 A 85 GLU H A 84 GLU HB3 1.0 . 3.43 908 733 A 64 VAL HG2% A 84 GLU HB2 1.0 . 4.12 909 733 A 64 VAL HG2% A 84 GLU HB3 1.0 . 4.12 910 734 A 62 PHE HD% A 84 GLU HB2 1.0 . 4.88 911 734 A 62 PHE HD% A 84 GLU HB3 1.0 . 4.88 912 735 A 82 ILE HD1% A 26 ARG HB2 1.0 . 4.96 913 736 A 27 TYR HE% A 26 ARG HB2 1.0 . 4.44 914 737 A 26 ARG HB2 A 26 ARG HD2 1.0 . 4.03 915 737 A 26 ARG HD3 A 26 ARG HB2 1.0 . 4.03 916 738 A 26 ARG H A 26 ARG HB2 1.0 . 3.30 917 739 A 82 ILE HD1% A 26 ARG HB3 1.0 . 4.49 918 740 A 26 ARG H A 26 ARG HB3 1.0 . 3.28 919 741 A 82 ILE HG2% A 26 ARG HB3 1.0 . 5.35 920 742 A 25 LYS H A 26 ARG HB3 1.0 . 5.09 921 743 A 26 ARG HB3 A 26 ARG HD2 1.0 . 4.09 922 743 A 26 ARG HD3 A 26 ARG HB3 1.0 . 4.09 923 744 A 17 GLU H A 16 GLU HB2 1.0 . 4.03 924 745 A 13 SER HA A 16 GLU HB2 1.0 . 5.00 925 746 A 16 GLU H A 16 GLU HB2 1.0 . 3.65 926 747 A 13 SER H A 16 GLU HB3 1.0 . 4.88 927 748 A 17 GLU H A 16 GLU HB3 1.0 . 4.03 928 749 A 16 GLU H A 16 GLU HB3 1.0 . 3.74 929 750 A 51 TYR HE% A 16 GLU HB3 1.0 . 5.16 930 751 A 13 SER H A 16 GLU HB2 1.0 . 4.62 931 752 A 49 LYS H A 49 LYS HD2 1.0 . 5.01 932 752 A 49 LYS H A 49 LYS HD3 1.0 . 5.01 933 753 A 6 LEU H A 4 THR HB 1.0 . 5.01 934 754 A 54 THR HB A 34 PHE HD% 1.0 . 4.67 935 755 A 54 THR HB A 34 PHE HB3 1.0 . 4.46 936 756 A 54 THR HB A 34 PHE HB2 1.0 . 4.24 937 757 A 26 ARG H A 25 LYS HD2 1.0 . 4.79 938 757 A 26 ARG H A 25 LYS HD3 1.0 . 4.79 939 758 A 53 LEU HD1% A 35 LYS HG2 1.0 . 3.61 940 758 A 53 LEU HD1% A 35 LYS HG3 1.0 . 3.61 941 759 A 35 LYS H A 35 LYS HG2 1.0 . 4.29 942 759 A 35 LYS H A 35 LYS HG3 1.0 . 4.29 943 760 A 10 ARG HA A 11 HIS HB3 1.0 . 5.50 944 761 A 25 LYS HG3 A 25 LYS HD2 1.0 . 2.68 945 761 A 25 LYS HD3 A 25 LYS HG3 1.0 . 2.68 946 762 A 18 ILE HA A 21 LYS HD2 1.0 . 3.94 947 762 A 18 ILE HA A 21 LYS HD3 1.0 . 3.94 948 763 A 21 LYS HA A 21 LYS HD2 1.0 . 4.84 949 763 A 21 LYS HD3 A 21 LYS HA 1.0 . 4.84 950 764 A 22 GLU H A 21 LYS HD2 1.0 . 5.29 951 764 A 22 GLU H A 21 LYS HD3 1.0 . 5.29 952 765 A 18 ILE H A 18 ILE HG13 1.0 . 3.77 953 766 A 15 TRP HA A 18 ILE HG13 1.0 . 4.91 954 767 A 18 ILE HA A 18 ILE HG13 1.0 . 3.47 955 768 A 18 ILE HG13 A 15 TRP HE3 1.0 . 5.50 956 769 A 19 ALA H A 17 GLU HB2 1.0 . 5.50 957 769 A 19 ALA H A 17 GLU HB3 1.0 . 5.50 958 770 A 77 VAL HG2% A 76 LYS HD2 1.0 . 5.50 959 770 A 77 VAL HG2% A 76 LYS HD3 1.0 . 5.50 960 771 A 77 VAL H A 76 LYS HD2 1.0 . 4.59 961 771 A 77 VAL H A 76 LYS HD3 1.0 . 4.59 962 772 A 18 ILE HG12 A 18 ILE HA 1.0 . 3.59 963 773 A 21 LYS H A 21 LYS HD2 1.0 . 3.81 964 773 A 21 LYS H A 21 LYS HD3 1.0 . 3.81 965 774 A 19 ALA H A 18 ILE HG13 1.0 . 5.43 966 775 A 15 TRP HA A 17 GLU HB2 1.0 . 5.22 967 775 A 15 TRP HA A 17 GLU HB3 1.0 . 5.22 968 776 A 17 GLU HA A 17 GLU HB2 1.0 . 2.92 969 776 A 17 GLU HB3 A 17 GLU HA 1.0 . 2.92 970 777 A 76 LYS H A 76 LYS HD2 1.0 . 4.79 971 777 A 76 LYS H A 76 LYS HD3 1.0 . 4.79 972 778 A 76 LYS HA A 76 LYS HD2 1.0 . 4.28 973 778 A 76 LYS HA A 76 LYS HD3 1.0 . 4.28 974 779 A 76 LYS HG3 A 76 LYS HD2 1.0 . 2.93 975 779 A 76 LYS HD3 A 76 LYS HG3 1.0 . 2.93 976 780 A 32 VAL HA A 55 LEU HG 1.0 . 4.95 977 781 A 56 ARG H A 55 LEU HG 1.0 . 4.62 978 782 A 23 ALA HB% A 22 GLU HB2 1.0 . 5.48 979 782 A 22 GLU HB3 A 23 ALA HB% 1.0 . 5.48 980 783 A 25 LYS H A 22 GLU HB2 1.0 . 4.87 981 783 A 22 GLU HB3 A 25 LYS H 1.0 . 4.87 982 784 A 32 VAL H A 24 LYS HD3 1.0 . 5.50 983 785 A 82 ILE HG12 A 82 ILE H 1.0 . 3.95 984 786 A 82 ILE HG12 A 82 ILE HA 1.0 . 3.64 985 787 A 53 LEU H A 53 LEU HG 1.0 . 4.03 986 788 A 36 GLN H A 53 LEU HG 1.0 . 5.50 987 789 A 82 ILE H A 82 ILE HG13 1.0 . 4.27 988 790 A 82 ILE HA A 82 ILE HG13 1.0 . 3.63 989 791 A 82 ILE HG13 A 26 ARG HD2 1.0 . 5.50 990 791 A 26 ARG HD3 A 82 ILE HG13 1.0 . 5.50 991 792 A 22 GLU HB2 A 26 ARG HD2 1.0 . 4.68 992 792 A 22 GLU HB3 A 26 ARG HD2 1.0 . 4.68 993 792 A 26 ARG HD3 A 22 GLU HB2 1.0 . 4.68 994 792 A 22 GLU HB3 A 26 ARG HD3 1.0 . 4.68 995 793 A 20 VAL HA A 22 GLU HB2 1.0 . 5.50 996 793 A 22 GLU HB3 A 20 VAL HA 1.0 . 5.50 997 794 A 25 LYS H A 24 LYS HD2 1.0 . 5.36 998 795 A 67 THR H A 82 ILE HG12 1.0 . 5.05 999 796 A 68 ILE HA A 68 ILE HG12 1.0 . 3.90 1000 796 A 68 ILE HA A 68 ILE HG13 1.0 . 3.90 1001 797 A 68 ILE H A 68 ILE HG12 1.0 . 3.96 1002 797 A 68 ILE H A 68 ILE HG13 1.0 . 3.96 1003 798 A 80 ILE HA A 68 ILE HG12 1.0 . 4.55 1004 798 A 80 ILE HA A 68 ILE HG13 1.0 . 4.55 1005 799 A 80 ILE H A 80 ILE HG12 1.0 . 3.94 1006 800 A 80 ILE HA A 80 ILE HG12 1.0 . 3.84 1007 801 A 68 ILE HA A 80 ILE HG12 1.0 . 5.07 1008 802 A 82 ILE HB A 82 ILE HG13 1.0 . 2.91 1009 803 A 80 ILE H A 80 ILE HG13 1.0 . 4.24 1010 804 A 80 ILE HA A 80 ILE HG13 1.0 . 3.82 1011 805 A 68 ILE HA A 80 ILE HG13 1.0 . 4.51 1012 806 A 79 LYS HA A 80 ILE HG13 1.0 . 5.50 1013 807 A 81 ALA H A 80 ILE HG13 1.0 . 5.01 1014 808 A 44 LYS H A 43 ARG HG2 1.0 . 4.26 1015 808 A 44 LYS H A 43 ARG HG3 1.0 . 4.26 1016 809 A 43 ARG H A 43 ARG HG2 1.0 . 3.76 1017 809 A 43 ARG H A 43 ARG HG3 1.0 . 3.76 1018 810 A 43 ARG HA A 43 ARG HG2 1.0 . 3.07 1019 810 A 43 ARG HA A 43 ARG HG3 1.0 . 3.07 1020 811 A 29 LEU H A 28 PRO HG2 1.0 . 4.13 1021 812 A 27 TYR HA A 28 PRO HG2 1.0 . 4.34 1022 813 A 6 LEU HD1% A 5 PRO HG2 1.0 . 4.55 1023 813 A 5 PRO HG3 A 6 LEU HD1% 1.0 . 4.55 1024 814 A 29 LEU H A 28 PRO HG3 1.0 . 4.25 1025 815 A 27 TYR H A 28 PRO HG3 1.0 . 5.12 1026 816 A 29 LEU HA A 29 LEU HG 1.0 . 3.66 1027 817 A 60 LYS H A 56 ARG HG2 1.0 . 5.06 1028 817 A 60 LYS H A 56 ARG HG3 1.0 . 5.06 1029 818 A 57 GLU H A 56 ARG HG2 1.0 . 3.87 1030 818 A 57 GLU H A 56 ARG HG3 1.0 . 3.87 1031 819 A 56 ARG H A 56 ARG HG2 1.0 . 4.11 1032 819 A 56 ARG H A 56 ARG HG3 1.0 . 4.11 1033 820 A 33 LEU HD2% A 56 ARG HG2 1.0 . 4.49 1034 820 A 56 ARG HG3 A 33 LEU HD2% 1.0 . 4.49 1035 821 A 61 GLU HA A 56 ARG HG2 1.0 . 4.44 1036 821 A 61 GLU HA A 56 ARG HG3 1.0 . 4.44 1037 822 A 26 ARG HA A 26 ARG HG2 1.0 . 3.67 1038 823 A 27 TYR H A 26 ARG HG3 1.0 . 4.90 1039 824 A 26 ARG HA A 26 ARG HG3 1.0 . 3.65 1040 825 A 65 PHE HB2 A 83 LEU HG 1.0 . 4.26 1041 826 A 65 PHE H A 83 LEU HG 1.0 . 4.88 1042 827 A 65 PHE HD% A 83 LEU HG 1.0 . 4.68 1043 828 A 83 LEU HG A 83 LEU HA 1.0 . 3.80 1044 829 A 10 ARG H A 10 ARG HG2 1.0 . 4.85 1045 829 A 10 ARG HG3 A 10 ARG H 1.0 . 4.85 1046 830 A 31 GLN H A 56 ARG HG2 1.0 . 5.28 1047 830 A 31 GLN H A 56 ARG HG3 1.0 . 5.28 1048 831 A 39 TRP HZ3 A 41 ARG HG2 1.0 . 4.94 1049 831 A 41 ARG HG3 A 39 TRP HZ3 1.0 . 4.94 1050 832 A 41 ARG HB2 A 41 ARG HG2 1.0 . 2.72 1051 832 A 41 ARG HB2 A 41 ARG HG3 1.0 . 2.72 1052 833 A 42 LYS HA A 42 LYS HD2 1.0 . 3.92 1053 833 A 42 LYS HA A 42 LYS HD3 1.0 . 3.92 1054 834 A 41 ARG H A 41 ARG HG2 1.0 . 4.67 1055 834 A 41 ARG H A 41 ARG HG3 1.0 . 4.67 1056 835 A 39 TRP HE1 A 41 ARG HG2 1.0 . 5.13 1057 835 A 39 TRP HE1 A 41 ARG HG3 1.0 . 5.13 1058 836 A 20 VAL HA A 53 LEU HD1% 1.0 . 4.22 1059 837 A 6 LEU HG A 6 LEU HA 1.0 . 3.69 1060 838 A 33 LEU HA A 33 LEU HG 1.0 . 4.18 1061 839 A 34 PHE H A 33 LEU HG 1.0 . 4.93 1062 840 A 33 LEU H A 33 LEU HG 1.0 . 3.70 1063 841 A 55 LEU HD2% A 27 TYR H 1.0 . 4.77 1064 842 A 55 LEU H A 55 LEU HD1% 1.0 . 3.40 1065 843 A 55 LEU HD1% A 64 VAL H 1.0 . 4.12 1066 844 A 55 LEU HD1% A 27 TYR HD% 1.0 . 3.68 1067 845 A 55 LEU HA A 55 LEU HD1% 1.0 . 3.62 1068 846 A 55 LEU HD1% A 54 THR HA 1.0 . 4.56 1069 847 A 55 LEU HD1% A 27 TYR HB3 1.0 . 4.03 1070 848 A 55 LEU HD1% A 23 ALA HB% 1.0 . 3.22 1071 849 A 55 LEU HD1% A 64 VAL HG1% 1.0 . 3.00 1072 850 A 55 LEU HB2 A 55 LEU HD1% 1.0 . 3.47 1073 851 A 55 LEU HD2% A 31 GLN H 1.0 . 4.52 1074 852 A 56 ARG H A 55 LEU HD2% 1.0 . 4.25 1075 853 A 55 LEU HD2% A 30 ALA H 1.0 . 4.73 1076 854 A 55 LEU HD2% A 27 TYR HD% 1.0 . 3.69 1077 855 A 62 PHE HD% A 55 LEU HD2% 1.0 . 5.32 1078 856 A 55 LEU HA A 55 LEU HD2% 1.0 . 3.14 1079 857 A 55 LEU HD2% A 31 GLN HA 1.0 . 4.69 1080 858 A 55 LEU HD2% A 27 TYR HB2 1.0 . 3.63 1081 859 A 55 LEU HD2% A 27 TYR HB3 1.0 . 3.62 1082 860 A 55 LEU HD2% A 32 VAL HB 1.0 . 4.23 1083 861 A 55 LEU HD2% A 31 GLN HB3 1.0 . 4.47 1084 862 A 30 ALA HB% A 55 LEU HD2% 1.0 . 3.03 1085 863 A 55 LEU HD2% A 55 LEU HB3 1.0 . 2.82 1086 864 A 55 LEU HB2 A 55 LEU HD2% 1.0 . 3.58 1087 865 A 15 TRP HH2 A 75 GLN HB3 1.0 . 5.29 1088 866 A 15 TRP HZ2 A 75 GLN HB3 1.0 . 5.13 1089 867 A 75 GLN HB2 A 15 TRP HZ2 1.0 . 5.17 1090 868 A 40 ASP HA A 49 LYS HG2 1.0 . 4.78 1091 869 A 49 LYS H A 49 LYS HG2 1.0 . 4.85 1092 870 A 49 LYS HG2 A 70 PHE HE2 1.0 . 4.84 1093 871 A 50 GLN HB2 A 50 GLN HE21 1.0 . 4.41 1094 872 A 76 LYS H A 75 GLN HB3 1.0 . 5.41 1095 873 A 21 LYS H A 21 LYS HG3 1.0 . 3.94 1096 874 A 21 LYS HA A 21 LYS HG3 1.0 . 3.47 1097 875 A 21 LYS HG2 A 21 LYS HE2 1.0 . 3.75 1098 875 A 21 LYS HE3 A 21 LYS HG2 1.0 . 3.75 1099 876 A 52 HIS H A 53 LEU HD2% 1.0 . 4.62 1100 877 A 53 LEU H A 53 LEU HD2% 1.0 . 4.00 1101 878 A 20 VAL H A 53 LEU HD2% 1.0 . 4.84 1102 879 A 20 VAL HA A 53 LEU HD2% 1.0 . 3.22 1103 880 A 51 TYR HB2 A 53 LEU HD2% 1.0 . 3.76 1104 881 A 51 TYR HB3 A 53 LEU HD2% 1.0 . 4.04 1105 882 A 66 VAL HB A 53 LEU HD2% 1.0 . 3.70 1106 883 A 53 LEU HB2 A 53 LEU HD2% 1.0 . 2.57 1107 884 A 19 ALA HB% A 53 LEU HD2% 1.0 . 3.26 1108 885 A 55 LEU HD1% A 53 LEU HD2% 1.0 . 4.57 1109 886 A 55 LEU HA A 33 LEU HD2% 1.0 . 4.99 1110 887 A 20 VAL HG1% A 21 LYS HG3 1.0 . 5.13 1111 888 A 56 ARG HA A 33 LEU HD2% 1.0 . 4.43 1112 889 A 33 LEU HD2% A 56 ARG HD2 1.0 . 3.86 1113 889 A 33 LEU HD2% A 56 ARG HD3 1.0 . 3.86 1114 890 A 33 LEU H A 33 LEU HD2% 1.0 . 3.85 1115 891 A 33 LEU HB3 A 33 LEU HD2% 1.0 . 2.67 1116 892 A 33 LEU HB2 A 33 LEU HD2% 1.0 . 2.79 1117 893 A 18 ILE HA A 21 LYS HE2 1.0 . 5.32 1118 893 A 18 ILE HA A 21 LYS HE3 1.0 . 5.32 1119 894 A 18 ILE HA A 17 GLU HA 1.0 . 5.11 1120 895 A 18 ILE HA A 18 ILE HD1% 1.0 . 4.62 1121 896 A 23 ALA H A 25 LYS HG2 1.0 . 5.38 1122 897 A 26 ARG H A 25 LYS HG2 1.0 . 5.10 1123 898 A 25 LYS H A 25 LYS HG3 1.0 . 3.90 1124 899 A 21 LYS HG3 A 21 LYS HE2 1.0 . 3.67 1125 899 A 21 LYS HE3 A 21 LYS HG3 1.0 . 3.67 1126 900 A 25 LYS HG3 A 25 LYS HB2 1.0 . 2.92 1127 900 A 25 LYS HB3 A 25 LYS HG3 1.0 . 2.92 1128 901 A 29 LEU HD2% A 29 LEU HB3 1.0 . 2.98 1129 902 A 83 LEU HB3 A 83 LEU HD1% 1.0 . 2.65 1130 903 A 24 LYS H A 24 LYS HG3 1.0 . 3.46 1131 904 A 24 LYS HG3 A 24 LYS HE2 1.0 . 4.06 1132 904 A 24 LYS HE3 A 24 LYS HG3 1.0 . 4.06 1133 905 A 24 LYS HG3 A 24 LYS HB2 1.0 . 2.79 1134 905 A 24 LYS HB3 A 24 LYS HG3 1.0 . 2.79 1135 906 A 62 PHE HA A 60 LYS HG3 1.0 . 5.10 1136 907 A 24 LYS H A 24 LYS HG2 1.0 . 3.76 1137 908 A 61 GLU H A 60 LYS HG3 1.0 . 4.26 1138 909 A 60 LYS HG3 A 60 LYS HA 1.0 . 3.77 1139 910 A 60 LYS H A 60 LYS HG3 1.0 . 4.55 1140 911 A 62 PHE HD% A 60 LYS HG3 1.0 . 4.26 1141 912 A 60 LYS HG3 A 60 LYS HE2 1.0 . 4.00 1142 912 A 60 LYS HE3 A 60 LYS HG3 1.0 . 4.00 1143 913 A 24 LYS HG2 A 24 LYS HE2 1.0 . 3.55 1144 913 A 24 LYS HE3 A 24 LYS HG2 1.0 . 3.55 1145 914 A 74 SER HB2 A 76 LYS HG2 1.0 . 5.10 1146 915 A 76 LYS H A 76 LYS HG2 1.0 . 4.31 1147 916 A 77 VAL H A 76 LYS HG2 1.0 . 4.12 1148 917 A 76 LYS HA A 76 LYS HG2 1.0 . 3.77 1149 918 A 60 LYS HG2 A 62 PHE HB2 1.0 . 4.47 1150 918 A 62 PHE HB3 A 60 LYS HG2 1.0 . 4.47 1151 919 A 60 LYS HG2 A 60 LYS HB2 1.0 . 2.81 1152 920 A 60 LYS H A 60 LYS HG2 1.0 . 4.61 1153 921 A 60 LYS HG2 A 60 LYS HE2 1.0 . 3.96 1154 921 A 60 LYS HG2 A 60 LYS HE3 1.0 . 3.96 1155 922 A 60 LYS HG2 A 62 PHE HE% 1.0 . 5.20 1156 923 A 16 GLU H A 13 SER HB2 1.0 . 4.87 1157 924 A 13 SER HB2 A 16 GLU HB3 1.0 . 5.20 1158 925 A 14 LYS H A 13 SER HB3 1.0 . 4.38 1159 926 A 62 PHE HE% A 60 LYS HG3 1.0 . 5.50 1160 927 A 57 GLU H A 60 LYS HG2 1.0 . 5.27 1161 928 A 60 LYS HG2 A 62 PHE HA 1.0 . 5.46 1162 929 A 79 LYS H A 79 LYS HG2 1.0 . 4.44 1163 929 A 79 LYS H A 79 LYS HG3 1.0 . 4.44 1164 930 A 79 LYS HB2 A 79 LYS HG2 1.0 . 2.70 1165 930 A 79 LYS HB3 A 79 LYS HG2 1.0 . 2.70 1166 930 A 79 LYS HG3 A 79 LYS HB2 1.0 . 2.70 1167 930 A 79 LYS HB3 A 79 LYS HG3 1.0 . 2.70 1168 931 A 69 SER HB2 A 79 LYS HG2 1.0 . 4.67 1169 931 A 69 SER HB3 A 79 LYS HG2 1.0 . 4.67 1170 931 A 79 LYS HG3 A 69 SER HB2 1.0 . 4.67 1171 931 A 69 SER HB3 A 79 LYS HG3 1.0 . 4.67 1172 932 A 80 ILE H A 79 LYS HG2 1.0 . 3.79 1173 932 A 80 ILE H A 79 LYS HG3 1.0 . 3.79 1174 933 A 79 LYS HA A 79 LYS HG2 1.0 . 3.29 1175 933 A 79 LYS HA A 79 LYS HG3 1.0 . 3.29 1176 934 A 6 LEU HD2% A 6 LEU HA 1.0 . 3.95 1177 935 A 13 SER HB2 A 16 GLU HG2 1.0 . 4.79 1178 935 A 13 SER HB2 A 16 GLU HG3 1.0 . 4.79 1179 936 A 16 GLU H A 13 SER HB3 1.0 . 5.19 1180 937 A 15 TRP H A 13 SER HB3 1.0 . 5.26 1181 938 A 13 SER HB3 A 16 GLU HG2 1.0 . 4.51 1182 938 A 13 SER HB3 A 16 GLU HG3 1.0 . 4.51 1183 939 A 13 SER HB3 A 16 GLU HB3 1.0 . 4.96 1184 940 A 42 LYS H A 42 LYS HG2 1.0 . 4.10 1185 940 A 42 LYS H A 42 LYS HG3 1.0 . 4.10 1186 941 A 43 ARG H A 42 LYS HG2 1.0 . 3.79 1187 941 A 43 ARG H A 42 LYS HG3 1.0 . 3.79 1188 942 A 47 ALA HB% A 42 LYS HG2 1.0 . 3.86 1189 942 A 47 ALA HB% A 42 LYS HG3 1.0 . 3.86 1190 943 A 42 LYS HA A 42 LYS HG2 1.0 . 3.84 1191 943 A 42 LYS HA A 42 LYS HG3 1.0 . 3.84 1192 944 A 42 LYS HE3 A 42 LYS HG2 1.0 . 3.55 1193 944 A 42 LYS HG3 A 42 LYS HE2 1.0 . 3.55 1194 944 A 42 LYS HE3 A 42 LYS HG3 1.0 . 3.55 1195 944 A 42 LYS HE2 A 42 LYS HG2 1.0 . 3.55 1196 945 A 46 GLU H A 42 LYS HG2 1.0 . 5.50 1197 945 A 46 GLU H A 42 LYS HG3 1.0 . 5.50 1198 946 A 83 LEU HB2 A 83 LEU HD2% 1.0 . 3.42 1199 947 A 70 PHE HA A 69 SER HB2 1.0 . 4.85 1200 947 A 70 PHE HA A 69 SER HB3 1.0 . 4.85 1201 948 A 77 VAL HG1% A 69 SER HB2 1.0 . 4.76 1202 948 A 69 SER HB3 A 77 VAL HG1% 1.0 . 4.76 1203 949 A 84 GLU HA A 83 LEU HD2% 1.0 . 4.17 1204 950 A 65 PHE HB2 A 83 LEU HD2% 1.0 . 4.24 1205 951 A 83 LEU H A 83 LEU HD2% 1.0 . 4.31 1206 952 A 84 GLU H A 83 LEU HD2% 1.0 . 3.43 1207 953 A 65 PHE HD% A 83 LEU HD2% 1.0 . 4.65 1208 954 A 65 PHE H A 83 LEU HD2% 1.0 . 4.76 1209 955 A 65 PHE HB3 A 83 LEU HD2% 1.0 . 4.13 1210 956 A 78 ASN H A 77 VAL HA 1.0 . 3.18 1211 957 A 77 VAL HG1% A 77 VAL HA 1.0 . 3.91 1212 958 A 78 ASN H A 69 SER HB2 1.0 . 4.61 1213 958 A 78 ASN H A 69 SER HB3 1.0 . 4.61 1214 959 A 47 ALA HB% A 72 PRO HA 1.0 . 4.84 1215 960 A 72 PRO HA A 73 TYR HA 1.0 . 5.12 1216 961 A 75 GLN H A 72 PRO HA 1.0 . 5.50 1217 962 A 77 VAL HA A 70 PHE HB2 1.0 . 3.80 1218 963 A 77 VAL HG2% A 77 VAL HA 1.0 . 3.88 1219 964 A 77 VAL HA A 79 LYS H 1.0 . 4.09 1220 965 A 70 PHE HB3 A 77 VAL HA 1.0 . 3.87 1221 966 A 70 PHE H A 77 VAL HA 1.0 . 5.50 1222 967 A 60 LYS H A 59 SER HB2 1.0 . 4.86 1223 968 A 60 LYS H A 59 SER HB3 1.0 . 5.07 1224 969 A 14 LYS H A 14 LYS HG3 1.0 . 4.91 1225 970 A 15 TRP HA A 14 LYS HG3 1.0 . 5.13 1226 971 A 14 LYS HA A 14 LYS HG3 1.0 . 3.85 1227 972 A 14 LYS HG3 A 14 LYS HE3 1.0 . 4.06 1228 973 A 15 TRP H A 14 LYS HG3 1.0 . 4.52 1229 974 A 15 TRP HZ3 A 14 LYS HG2 1.0 . 5.50 1230 975 A 15 TRP HA A 14 LYS HG2 1.0 . 4.94 1231 976 A 15 TRP H A 14 LYS HG2 1.0 . 4.39 1232 977 A 14 LYS HA A 14 LYS HG2 1.0 . 3.85 1233 978 A 14 LYS HE3 A 14 LYS HG2 1.0 . 4.04 1234 979 A 15 TRP HE1 A 14 LYS HG2 1.0 . 5.50 1235 980 A 77 VAL HG2% A 15 TRP HE3 1.0 . 4.23 1236 981 A 77 VAL HG2% A 76 LYS HA 1.0 . 3.68 1237 982 A 77 VAL HG2% A 77 VAL H 1.0 . 2.91 1238 983 A 77 VAL HG2% A 15 TRP HZ3 1.0 . 3.02 1239 984 A 20 VAL H A 20 VAL HG2% 1.0 . 2.86 1240 985 A 17 GLU HA A 20 VAL HG2% 1.0 . 3.31 1241 986 A 20 VAL HA A 20 VAL HG2% 1.0 . 2.86 1242 987 A 20 VAL HG2% A 35 LYS HD2 1.0 . 3.53 1243 987 A 35 LYS HD3 A 20 VAL HG2% 1.0 . 3.53 1244 988 A 20 VAL HG2% A 35 LYS HG2 1.0 . 3.21 1245 988 A 20 VAL HG2% A 35 LYS HG3 1.0 . 3.21 1246 989 A 14 LYS H A 14 LYS HG2 1.0 . 4.61 1247 990 A 19 ALA HB% A 20 VAL HG2% 1.0 . 3.49 1248 991 A 28 PRO HD3 A 29 LEU HD1% 1.0 . 4.77 1249 992 A 3 GLU HA A 3 GLU HG2 1.0 . 3.50 1250 992 A 3 GLU HG3 A 3 GLU HA 1.0 . 3.50 1251 993 A 67 THR H A 81 ALA HB% 1.0 . 4.06 1252 994 A 30 ALA H A 29 LEU HD1% 1.0 . 4.33 1253 995 A 33 LEU H A 33 LEU HD1% 1.0 . 4.07 1254 996 A 56 ARG H A 33 LEU HD1% 1.0 . 4.70 1255 997 A 33 LEU HD1% A 31 GLN HG3 1.0 . 4.84 1256 998 A 33 LEU HB2 A 33 LEU HD1% 1.0 . 3.09 1257 999 A 34 PHE H A 33 LEU HD1% 1.0 . 5.17 1258 1000 A 55 LEU HA A 33 LEU HD1% 1.0 . 5.07 1259 1001 A 33 LEU HD1% A 32 VAL HA 1.0 . 5.49 1260 1002 A 33 LEU HD1% A 56 ARG HD2 1.0 . 3.95 1261 1002 A 33 LEU HD1% A 56 ARG HD3 1.0 . 3.95 1262 1003 A 81 ALA H A 81 ALA HB% 1.0 . 3.12 1263 1004 A 82 ILE H A 81 ALA HB% 1.0 . 3.32 1264 1005 A 67 THR HB A 81 ALA HB% 1.0 . 3.19 1265 1006 A 85 GLU H A 64 VAL HG2% 1.0 . 3.57 1266 1007 A 55 LEU HD1% A 64 VAL HG2% 1.0 . 3.43 1267 1008 A 29 LEU H A 29 LEU HD1% 1.0 . 3.49 1268 1009 A 29 LEU HD1% A 29 LEU HA 1.0 . 2.59 1269 1010 A 28 PRO HB2 A 29 LEU HD1% 1.0 . 4.67 1270 1011 A 55 LEU H A 54 THR HA 1.0 . 3.22 1271 1012 A 54 THR HA A 63 GLY HAx 1.0 . 3.86 1272 1013 A 64 VAL HG2% A 27 TYR HE% 1.0 . 3.46 1273 1014 A 64 VAL HG2% A 62 PHE HE% 1.0 . 3.58 1274 1015 A 64 VAL HG2% A 64 VAL HA 1.0 . 3.20 1275 1016 A 84 GLU HA A 64 VAL HG2% 1.0 . 3.06 1276 1017 A 64 VAL HG2% A 27 TYR HD% 1.0 . 4.36 1277 1018 A 30 ALA HB% A 57 GLU HA 1.0 . 4.24 1278 1019 A 38 VAL HG2% A 38 VAL H 1.0 . 5.11 1279 1020 A 38 VAL HG2% A 52 HIS HB2 1.0 . 4.37 1280 1021 A 38 VAL HG2% A 52 HIS HB3 1.0 . 5.06 1281 1022 A 38 VAL HG2% A 65 PHE HE% 1.0 . 4.18 1282 1023 A 38 VAL HG2% A 38 VAL HA 1.0 . 3.65 1283 1024 A 8 THR HA A 9 ALA HB% 1.0 . 5.44 1284 1025 A 30 ALA HB% A 27 TYR HB2 1.0 . 3.16 1285 1026 A 30 ALA HB% A 31 GLN H 1.0 . 3.18 1286 1027 A 30 ALA HB% A 30 ALA H 1.0 . 2.97 1287 1028 A 30 ALA HB% A 62 PHE HZ 1.0 . 3.55 1288 1029 A 30 ALA HB% A 57 GLU HB2 1.0 . 3.29 1289 1030 A 30 ALA HB% A 57 GLU HB3 1.0 . 4.40 1290 1031 A 30 ALA HB% A 55 LEU HB3 1.0 . 3.42 1291 1032 A 55 LEU HB2 A 30 ALA HB% 1.0 . 3.86 1292 1033 A 38 VAL HG2% A 52 HIS H 1.0 . 5.30 1293 1034 A 32 VAL HG2% A 32 VAL H 1.0 . 3.77 1294 1035 A 32 VAL HG2% A 33 LEU HA 1.0 . 4.46 1295 1036 A 55 LEU HD1% A 30 ALA HB% 1.0 . 4.23 1296 1037 A 62 PHE HD% A 54 THR HG2% 1.0 . 5.50 1297 1038 A 55 LEU H A 54 THR HG2% 1.0 . 3.24 1298 1039 A 54 THR H A 54 THR HG2% 1.0 . 3.87 1299 1040 A 54 THR HG2% A 34 PHE HE% 1.0 . 4.28 1300 1041 A 55 LEU HA A 54 THR HG2% 1.0 . 4.51 1301 1042 A 54 THR HA A 54 THR HG2% 1.0 . 3.09 1302 1043 A 54 THR HG2% A 34 PHE HB3 1.0 . 4.31 1303 1044 A 61 GLU HG2 A 54 THR HG2% 1.0 . 4.20 1304 1045 A 54 THR HG2% A 33 LEU HD2% 1.0 . 3.37 1305 1046 A 55 LEU HB2 A 54 THR HG2% 1.0 . 5.06 1306 1047 A 61 GLU HA A 54 THR HG2% 1.0 . 4.63 1307 1048 A 69 SER H A 77 VAL HG1% 1.0 . 4.79 1308 1049 A 77 VAL H A 77 VAL HG1% 1.0 . 3.85 1309 1050 A 77 VAL HG1% A 15 TRP HZ3 1.0 . 4.51 1310 1051 A 79 LYS HA A 77 VAL HG1% 1.0 . 4.06 1311 1052 A 34 PHE H A 32 VAL HG2% 1.0 . 3.79 1312 1053 A 32 VAL HG2% A 24 LYS HE2 1.0 . 5.46 1313 1053 A 32 VAL HG2% A 24 LYS HE3 1.0 . 5.46 1314 1054 A 8 THR HA A 8 THR HG2% 1.0 . 4.17 1315 1055 A 77 VAL HG1% A 79 LYS H 1.0 . 3.26 1316 1056 A 70 PHE HA A 77 VAL HG1% 1.0 . 4.32 1317 1057 A 77 VAL HG1% A 80 ILE HG12 1.0 . 3.09 1318 1058 A 32 VAL HG2% A 55 LEU HD2% 1.0 . 3.89 1319 1059 A 4 THR HG2% A 5 PRO HD3 1.0 . 4.48 1320 1060 A 4 THR HG2% A 35 LYS HB2 1.0 . 3.84 1321 1060 A 4 THR HG2% A 35 LYS HB3 1.0 . 3.84 1322 1061 A 78 ASN H A 77 VAL HG1% 1.0 . 3.25 1323 1062 A 20 VAL HG1% A 21 LYS HA 1.0 . 3.41 1324 1063 A 64 VAL HG1% A 64 VAL H 1.0 . 3.31 1325 1064 A 53 LEU HD1% A 34 PHE HB3 1.0 . 5.20 1326 1065 A 64 VAL HG1% A 55 LEU HD2% 1.0 . 3.84 1327 1066 A 4 THR HG2% A 6 LEU HD1% 1.0 . 4.13 1328 1067 A 4 THR HG2% A 4 THR HA 1.0 . 3.85 1329 1068 A 4 THR HG2% A 35 LYS HG2 1.0 . 2.41 1330 1068 A 4 THR HG2% A 35 LYS HG3 1.0 . 2.41 1331 1069 A 35 LYS H A 4 THR HG2% 1.0 . 4.44 1332 1070 A 20 VAL HG1% A 35 LYS HD2 1.0 . 5.26 1333 1070 A 35 LYS HD3 A 20 VAL HG1% 1.0 . 5.26 1334 1071 A 21 LYS H A 20 VAL HG1% 1.0 . 3.51 1335 1072 A 20 VAL HA A 20 VAL HG1% 1.0 . 2.97 1336 1073 A 65 PHE H A 64 VAL HG1% 1.0 . 4.08 1337 1074 A 64 VAL HG1% A 84 GLU HG3 1.0 . 4.97 1338 1075 A 64 VAL HG1% A 64 VAL HA 1.0 . 3.59 1339 1076 A 83 LEU H A 66 VAL HA 1.0 . 5.03 1340 1077 A 65 PHE HA A 66 VAL HA 1.0 . 5.50 1341 1078 A 67 THR HB A 66 VAL HA 1.0 . 4.81 1342 1079 A 67 THR H A 66 VAL HG1% 1.0 . 3.25 1343 1080 A 41 ARG HD2 A 48 VAL HG1% 1.0 . 5.00 1344 1080 A 41 ARG HD2 A 48 VAL HG2% 1.0 . 5.00 1345 1081 A 48 VAL H A 48 VAL HG1% 1.0 . 3.42 1346 1081 A 48 VAL HG2% A 48 VAL H 1.0 . 3.42 1347 1082 A 39 TRP HZ3 A 48 VAL HG1% 1.0 . 4.37 1348 1082 A 48 VAL HG2% A 39 TRP HZ3 1.0 . 4.37 1349 1083 A 69 SER HA A 48 VAL HG1% 1.0 . 3.60 1350 1083 A 48 VAL HG2% A 69 SER HA 1.0 . 3.60 1351 1084 A 48 VAL HA A 48 VAL HG1% 1.0 . 3.29 1352 1084 A 48 VAL HG2% A 48 VAL HA 1.0 . 3.29 1353 1085 A 32 VAL HA A 32 VAL HG1% 1.0 . 3.27 1354 1086 A 66 VAL HG1% A 19 ALA H 1.0 . 4.42 1355 1087 A 66 VAL HA A 66 VAL HG1% 1.0 . 2.99 1356 1088 A 66 VAL HG1% A 19 ALA HA 1.0 . 2.90 1357 1089 A 55 LEU HA A 32 VAL HG1% 1.0 . 4.25 1358 1090 A 55 LEU HD2% A 32 VAL HG1% 1.0 . 3.10 1359 1091 A 47 ALA HB% A 71 ASP HA 1.0 . 5.41 1360 1092 A 70 PHE H A 47 ALA HB% 1.0 . 4.73 1361 1093 A 47 ALA H A 47 ALA HB% 1.0 . 3.58 1362 1094 A 48 VAL H A 47 ALA HB% 1.0 . 3.74 1363 1095 A 69 SER HA A 47 ALA HB% 1.0 . 5.50 1364 1096 A 47 ALA HB% A 72 PRO HB2 1.0 . 3.82 1365 1096 A 47 ALA HB% A 72 PRO HB3 1.0 . 3.82 1366 1097 A 48 VAL HA A 47 ALA HB% 1.0 . 4.95 1367 1098 A 47 ALA HB% A 72 PRO HD2 1.0 . 4.37 1368 1098 A 72 PRO HD3 A 47 ALA HB% 1.0 . 4.37 1369 1099 A 66 VAL HG1% A 66 VAL H 1.0 . 3.96 1370 1100 A 66 VAL HG1% A 51 TYR HD% 1.0 . 4.59 1371 1101 A 81 ALA H A 66 VAL HG1% 1.0 . 4.73 1372 1102 A 66 VAL HG1% A 23 ALA H 1.0 . 4.77 1373 1103 A 68 ILE HA A 69 SER HB2 1.0 . 4.88 1374 1103 A 68 ILE HA A 69 SER HB3 1.0 . 4.88 1375 1104 A 68 ILE HA A 69 SER H 1.0 . 3.14 1376 1105 A 80 ILE HA A 68 ILE HA 1.0 . 3.69 1377 1106 A 66 VAL H A 66 VAL HG2% 1.0 . 3.48 1378 1107 A 83 LEU H A 66 VAL HG2% 1.0 . 4.90 1379 1108 A 23 ALA H A 66 VAL HG2% 1.0 . 4.32 1380 1109 A 65 PHE HA A 66 VAL HG2% 1.0 . 4.13 1381 1110 A 66 VAL HA A 66 VAL HG2% 1.0 . 3.06 1382 1111 A 53 LEU HD2% A 66 VAL HG2% 1.0 . 3.07 1383 1112 A 67 THR H A 82 ILE HA 1.0 . 4.45 1384 1113 A 48 VAL HA A 49 LYS HD2 1.0 . 5.50 1385 1113 A 48 VAL HA A 49 LYS HD3 1.0 . 5.50 1386 1114 A 25 LYS H A 21 LYS HA 1.0 . 5.34 1387 1115 A 21 LYS HG2 A 21 LYS HA 1.0 . 3.71 1388 1116 A 21 LYS HA A 21 LYS HE2 1.0 . 5.21 1389 1116 A 21 LYS HE3 A 21 LYS HA 1.0 . 5.21 1390 1117 A 85 GLU H A 64 VAL HA 1.0 . 3.62 1391 1118 A 65 PHE H A 64 VAL HA 1.0 . 3.16 1392 1119 A 8 THR HG2% A 9 ALA HB% 1.0 . 3.71 1393 1120 A 9 ALA H A 9 ALA HB% 1.0 . 3.35 1394 1121 A 44 LYS HA A 45 ASP H 1.0 . 3.56 1395 1122 A 25 LYS HA A 24 LYS HG2 1.0 . 3.53 1396 1123 A 51 TYR HD% A 16 GLU HA 1.0 . 5.50 1397 1124 A 16 GLU HA A 20 VAL HG2% 1.0 . 5.50 1398 1125 A 25 LYS H A 22 GLU HA 1.0 . 3.84 1399 1126 A 22 GLU HA A 25 LYS HD2 1.0 . 3.84 1400 1126 A 22 GLU HA A 25 LYS HD3 1.0 . 3.84 1401 1127 A 22 GLU HA A 25 LYS HG3 1.0 . 4.63 1402 1128 A 82 ILE HD1% A 22 GLU HA 1.0 . 4.95 1403 1129 A 26 ARG H A 22 GLU HA 1.0 . 4.91 1404 1130 A 44 LYS HA A 43 ARG HA 1.0 . 4.83 1405 1131 A 74 SER HA A 73 TYR HB2 1.0 . 4.79 1406 1131 A 73 TYR HB3 A 74 SER HA 1.0 . 4.79 1407 1132 A 22 GLU HG2 A 22 GLU HA 1.0 . 4.17 1408 1133 A 80 ILE HA A 68 ILE HG2% 1.0 . 4.20 1409 1134 A 25 LYS HG2 A 25 LYS HA 1.0 . 3.75 1410 1135 A 79 LYS H A 68 ILE HG2% 1.0 . 5.31 1411 1136 A 70 PHE HB3 A 68 ILE HG2% 1.0 . 4.40 1412 1137 A 68 ILE H A 68 ILE HG2% 1.0 . 3.91 1413 1138 A 70 PHE H A 68 ILE HG2% 1.0 . 5.32 1414 1139 A 69 SER H A 68 ILE HG2% 1.0 . 3.30 1415 1140 A 15 TRP HE3 A 68 ILE HG2% 1.0 . 3.56 1416 1141 A 69 SER HA A 68 ILE HG2% 1.0 . 4.48 1417 1142 A 70 PHE HA A 68 ILE HG2% 1.0 . 5.11 1418 1143 A 68 ILE HA A 68 ILE HG2% 1.0 . 3.15 1419 1144 A 15 TRP HB2 A 68 ILE HG2% 1.0 . 5.19 1420 1145 A 68 ILE HG2% A 80 ILE HD1% 1.0 . 4.53 1421 1146 A 18 ILE HD1% A 68 ILE HG2% 1.0 . 4.87 1422 1147 A 15 TRP HA A 68 ILE HG2% 1.0 . 4.48 1423 1148 A 24 LYS HA A 24 LYS HG2 1.0 . 3.53 1424 1149 A 75 GLN HA A 71 ASP HB2 1.0 . 5.50 1425 1150 A 75 GLN HA A 76 LYS HB2 1.0 . 5.42 1426 1150 A 75 GLN HA A 76 LYS HB3 1.0 . 5.42 1427 1151 A 24 LYS HA A 24 LYS HE2 1.0 . 4.48 1428 1151 A 24 LYS HA A 24 LYS HE3 1.0 . 4.48 1429 1152 A 59 SER HA A 56 ARG HG2 1.0 . 5.00 1430 1152 A 56 ARG HG3 A 59 SER HA 1.0 . 5.00 1431 1153 A 75 GLN HA A 74 SER H 1.0 . 4.35 1432 1154 A 75 GLN HA A 75 GLN HG2 1.0 . 3.21 1433 1155 A 75 GLN HG3 A 75 GLN HA 1.0 . 3.72 1434 1156 A 14 LYS HB3 A 15 TRP HA 1.0 . 4.64 1435 1157 A 23 ALA HB% A 66 VAL HG2% 1.0 . 3.35 1436 1158 A 55 LEU HD2% A 23 ALA HB% 1.0 . 3.80 1437 1159 A 22 GLU H A 23 ALA HB% 1.0 . 4.57 1438 1160 A 24 LYS H A 23 ALA HB% 1.0 . 3.24 1439 1161 A 23 ALA H A 23 ALA HB% 1.0 . 2.87 1440 1162 A 25 LYS H A 23 ALA HB% 1.0 . 4.84 1441 1163 A 23 ALA HB% A 27 TYR HD% 1.0 . 4.13 1442 1164 A 20 VAL HA A 23 ALA HB% 1.0 . 3.28 1443 1165 A 23 ALA HB% A 53 LEU HD2% 1.0 . 3.15 1444 1166 A 51 TYR H A 19 ALA HB% 1.0 . 5.30 1445 1167 A 19 ALA HB% A 21 LYS H 1.0 . 5.06 1446 1168 A 20 VAL HA A 19 ALA HB% 1.0 . 4.47 1447 1169 A 19 ALA HB% A 19 ALA H 1.0 . 2.97 1448 1170 A 19 ALA HB% A 51 TYR HA 1.0 . 5.21 1449 1171 A 19 ALA HB% A 51 TYR HB2 1.0 . 4.19 1450 1172 A 22 GLU H A 18 ILE HG2% 1.0 . 4.79 1451 1173 A 15 TRP HA A 18 ILE HG2% 1.0 . 4.31 1452 1174 A 19 ALA H A 18 ILE HG2% 1.0 . 3.69 1453 1175 A 18 ILE HA A 18 ILE HG2% 1.0 . 3.07 1454 1176 A 13 SER HA A 14 LYS HB2 1.0 . 5.11 1455 1177 A 19 ALA HB% A 18 ILE H 1.0 . 5.23 1456 1178 A 19 ALA HB% A 16 GLU HA 1.0 . 3.35 1457 1179 A 66 VAL HG1% A 19 ALA HB% 1.0 . 3.07 1458 1180 A 18 ILE HG2% A 15 TRP HE3 1.0 . 4.17 1459 1181 A 82 ILE HG12 A 82 ILE HG2% 1.0 . 3.21 1460 1182 A 80 ILE H A 80 ILE HG2% 1.0 . 4.03 1461 1183 A 68 ILE HA A 80 ILE HG2% 1.0 . 4.30 1462 1184 A 67 THR H A 80 ILE HG2% 1.0 . 4.25 1463 1185 A 81 ALA H A 80 ILE HG2% 1.0 . 3.21 1464 1186 A 82 ILE H A 80 ILE HG2% 1.0 . 5.37 1465 1187 A 80 ILE HA A 80 ILE HG2% 1.0 . 3.02 1466 1188 A 80 ILE HG13 A 80 ILE HG2% 1.0 . 2.59 1467 1189 A 82 ILE HG2% A 27 TYR HE% 1.0 . 3.56 1468 1190 A 38 VAL H A 51 TYR HA 1.0 . 4.02 1469 1191 A 37 LYS HA A 38 VAL HA 1.0 . 4.76 1470 1192 A 82 ILE HG2% A 23 ALA HA 1.0 . 4.00 1471 1193 A 83 LEU H A 82 ILE HG2% 1.0 . 3.31 1472 1194 A 82 ILE HA A 82 ILE HG2% 1.0 . 3.11 1473 1195 A 82 ILE HG2% A 26 ARG HD2 1.0 . 3.91 1474 1195 A 82 ILE HG2% A 26 ARG HD3 1.0 . 3.91 1475 1196 A 84 GLU H A 82 ILE HG2% 1.0 . 5.01 1476 1197 A 20 VAL H A 12 MET HE% 1.0 . 5.24 1477 1198 A 12 MET HA A 12 MET HE% 1.0 . 4.89 1478 1199 A 16 GLU HB3 A 12 MET HE% 1.0 . 3.06 1479 1200 A 12 MET HE% A 35 LYS HB2 1.0 . 3.67 1480 1200 A 35 LYS HB3 A 12 MET HE% 1.0 . 3.67 1481 1201 A 20 VAL HG2% A 12 MET HE% 1.0 . 3.39 1482 1202 A 12 MET H A 12 MET HE% 1.0 . 5.50 1483 1203 A 17 GLU H A 12 MET HE% 1.0 . 4.60 1484 1204 A 12 MET HE% A 35 LYS HD2 1.0 . 4.28 1485 1204 A 35 LYS HD3 A 12 MET HE% 1.0 . 4.28 1486 1205 A 12 MET HB2 A 12 MET HE% 1.0 . 3.81 1487 1206 A 12 MET HE% A 35 LYS HG2 1.0 . 4.49 1488 1206 A 35 LYS HG3 A 12 MET HE% 1.0 . 4.49 1489 1207 A 26 ARG HA A 25 LYS HB2 1.0 . 4.73 1490 1207 A 26 ARG HA A 25 LYS HB3 1.0 . 4.73 1491 1208 A 65 PHE HA A 52 HIS HA 1.0 . 3.81 1492 1209 A 77 VAL H A 76 LYS HA 1.0 . 2.85 1493 1210 A 26 ARG HA A 28 PRO HD3 1.0 . 5.12 1494 1211 A 26 ARG HA A 26 ARG HD2 1.0 . 3.64 1495 1211 A 26 ARG HA A 26 ARG HD3 1.0 . 3.64 1496 1212 A 65 PHE HD% A 85 GLU HA 1.0 . 4.88 1497 1213 A 86 TYR H A 85 GLU HA 1.0 . 3.14 1498 1214 A 43 ARG H A 42 LYS HA 1.0 . 3.42 1499 1215 A 47 ALA HB% A 46 GLU HA 1.0 . 4.95 1500 1216 A 47 ALA H A 46 GLU HA 1.0 . 3.06 1501 1217 A 46 GLU HA A 72 PRO HD2 1.0 . 3.45 1502 1217 A 72 PRO HD3 A 46 GLU HA 1.0 . 3.45 1503 1218 A 61 GLU H A 60 LYS HA 1.0 . 2.77 1504 1219 A 46 GLU HA A 71 ASP HA 1.0 . 3.53 1505 1220 A 46 GLU HA A 72 PRO HG2 1.0 . 4.99 1506 1220 A 46 GLU HA A 72 PRO HG3 1.0 . 4.99 1507 1221 A 10 ARG HA A 10 ARG HD2 1.0 . 4.64 1508 1221 A 10 ARG HD3 A 10 ARG HA 1.0 . 4.64 1509 1222 A 10 ARG HA A 10 ARG HG2 1.0 . 3.86 1510 1222 A 10 ARG HG3 A 10 ARG HA 1.0 . 3.86 1511 1223 A 19 ALA HA A 22 GLU HB2 1.0 . 3.85 1512 1223 A 22 GLU HB3 A 19 ALA HA 1.0 . 3.85 1513 1224 A 23 ALA H A 19 ALA HA 1.0 . 5.50 1514 1225 A 18 ILE HA A 68 ILE HD1% 1.0 . 5.49 1515 1226 A 15 TRP HB2 A 68 ILE HD1% 1.0 . 3.58 1516 1227 A 16 GLU HA A 68 ILE HD1% 1.0 . 5.49 1517 1228 A 19 ALA H A 68 ILE HD1% 1.0 . 3.71 1518 1229 A 18 ILE H A 68 ILE HD1% 1.0 . 4.53 1519 1230 A 15 TRP HE3 A 68 ILE HD1% 1.0 . 3.67 1520 1231 A 68 ILE HA A 68 ILE HD1% 1.0 . 4.15 1521 1232 A 15 TRP HA A 68 ILE HD1% 1.0 . 3.84 1522 1233 A 68 ILE HB A 68 ILE HD1% 1.0 . 3.23 1523 1234 A 18 ILE HD1% A 68 ILE HD1% 1.0 . 4.58 1524 1235 A 19 ALA HA A 68 ILE HD1% 1.0 . 3.69 1525 1236 A 47 ALA H A 70 PHE HA 1.0 . 5.50 1526 1237 A 62 PHE HA A 63 GLY H 1.0 . 3.20 1527 1238 A 63 GLY HA3 A 62 PHE HA 1.0 . 4.55 1528 1239 A 62 PHE HA A 62 PHE HB2 1.0 . 2.90 1529 1239 A 62 PHE HB3 A 62 PHE HA 1.0 . 2.90 1530 1240 A 33 LEU HD1% A 33 LEU HA 1.0 . 3.96 1531 1241 A 26 ARG H A 23 ALA HA 1.0 . 4.84 1532 1242 A 22 GLU H A 19 ALA HA 1.0 . 4.62 1533 1243 A 62 PHE HA A 61 GLU HB2 1.0 . 5.07 1534 1243 A 61 GLU HB3 A 62 PHE HA 1.0 . 5.07 1535 1244 A 66 VAL HG2% A 23 ALA HA 1.0 . 4.80 1536 1245 A 53 LEU HD2% A 23 ALA HA 1.0 . 5.50 1537 1246 A 78 ASN H A 70 PHE HA 1.0 . 3.41 1538 1247 A 70 PHE HA A 77 VAL HA 1.0 . 3.42 1539 1248 A 77 VAL HG2% A 70 PHE HA 1.0 . 4.83 1540 1249 A 70 PHE HA A 78 ASN HD22 1.0 . 5.23 1541 1250 A 70 PHE HA A 78 ASN HD21 1.0 . 5.26 1542 1251 A 42 LYS H A 41 ARG HA 1.0 . 2.93 1543 1252 A 12 MET HA A 12 MET HG2 1.0 . 3.21 1544 1253 A 8 THR H A 6 LEU HA 1.0 . 3.16 1545 1254 A 41 ARG HD3 A 41 ARG HA 1.0 . 4.54 1546 1255 A 41 ARG HA A 41 ARG HG2 1.0 . 3.56 1547 1255 A 41 ARG HG3 A 41 ARG HA 1.0 . 3.56 1548 1256 A 27 TYR HA A 28 PRO HG3 1.0 . 4.58 1549 1257 A 27 TYR HA A 28 PRO HD2 1.0 . 3.33 1550 1258 A 27 TYR HA A 28 PRO HD3 1.0 . 3.53 1551 1259 A 30 ALA HB% A 27 TYR HA 1.0 . 5.36 1552 1260 A 57 GLU HA A 57 GLU HG2 1.0 . 3.99 1553 1261 A 27 TYR HA A 27 TYR HE% 1.0 . 5.20 1554 1262 A 27 TYR HA A 26 ARG HA 1.0 . 5.17 1555 1263 A 53 LEU HB3 A 35 LYS HA 1.0 . 4.59 1556 1264 A 56 ARG HA A 61 GLU HA 1.0 . 3.38 1557 1265 A 61 GLU HA A 62 PHE HA 1.0 . 5.20 1558 1266 A 53 LEU HD1% A 35 LYS HA 1.0 . 4.60 1559 1267 A 61 GLU HA A 60 LYS HA 1.0 . 4.86 1560 1268 A 43 ARG HA A 42 LYS HG2 1.0 . 4.86 1561 1268 A 43 ARG HA A 42 LYS HG3 1.0 . 4.86 1562 1269 A 56 ARG HA A 55 LEU HB3 1.0 . 4.91 1563 1270 A 56 ARG HA A 56 ARG HD2 1.0 . 5.08 1564 1270 A 56 ARG HA A 56 ARG HD3 1.0 . 5.08 1565 1271 A 56 ARG HA A 56 ARG HG2 1.0 . 3.60 1566 1271 A 56 ARG HA A 56 ARG HG3 1.0 . 3.60 1567 1272 A 55 LEU HA A 56 ARG HA 1.0 . 5.29 1568 1273 A 55 LEU HB2 A 56 ARG HA 1.0 . 5.46 1569 1274 A 68 ILE HA A 80 ILE HD1% 1.0 . 4.17 1570 1275 A 80 ILE H A 80 ILE HD1% 1.0 . 4.30 1571 1276 A 77 VAL HG1% A 80 ILE HD1% 1.0 . 2.40 1572 1277 A 77 VAL HA A 78 ASN HA 1.0 . 4.96 1573 1278 A 32 VAL H A 31 GLN HA 1.0 . 2.96 1574 1279 A 83 LEU HA A 84 GLU HB2 1.0 . 4.23 1575 1279 A 84 GLU HB3 A 83 LEU HA 1.0 . 4.23 1576 1280 A 84 GLU H A 83 LEU HA 1.0 . 2.89 1577 1281 A 83 LEU HA A 83 LEU HD2% 1.0 . 3.67 1578 1282 A 22 GLU H A 82 ILE HD1% 1.0 . 5.09 1579 1283 A 83 LEU H A 82 ILE HD1% 1.0 . 4.61 1580 1284 A 82 ILE HD1% A 27 TYR HD% 1.0 . 4.57 1581 1285 A 82 ILE HD1% A 27 TYR HE% 1.0 . 4.10 1582 1286 A 82 ILE HD1% A 23 ALA HA 1.0 . 2.97 1583 1287 A 82 ILE HD1% A 26 ARG HD2 1.0 . 3.78 1584 1287 A 82 ILE HD1% A 26 ARG HD3 1.0 . 3.78 1585 1288 A 82 ILE HD1% A 22 GLU HB2 1.0 . 3.56 1586 1288 A 22 GLU HB3 A 82 ILE HD1% 1.0 . 3.56 1587 1289 A 82 ILE H A 82 ILE HD1% 1.0 . 4.24 1588 1290 A 23 ALA H A 82 ILE HD1% 1.0 . 4.03 1589 1291 A 82 ILE HA A 82 ILE HD1% 1.0 . 3.81 1590 1292 A 82 ILE HD1% A 23 ALA HB% 1.0 . 3.39 1591 1293 A 67 THR H A 82 ILE HD1% 1.0 . 5.03 1592 1294 A 45 ASP HA A 72 PRO HG2 1.0 . 3.89 1593 1294 A 72 PRO HG3 A 45 ASP HA 1.0 . 3.89 1594 1295 A 40 ASP HA A 39 TRP HA 1.0 . 5.42 1595 1296 A 41 ARG HB3 A 40 ASP HA 1.0 . 5.07 1596 1297 A 18 ILE H A 18 ILE HD1% 1.0 . 3.65 1597 1298 A 14 LYS HA A 18 ILE HD1% 1.0 . 5.14 1598 1299 A 15 TRP HB2 A 18 ILE HD1% 1.0 . 5.30 1599 1300 A 18 ILE HD1% A 14 LYS HG2 1.0 . 4.11 1600 1301 A 19 ALA H A 18 ILE HD1% 1.0 . 4.57 1601 1302 A 15 TRP H A 18 ILE HD1% 1.0 . 5.50 1602 1303 A 15 TRP HA A 18 ILE HD1% 1.0 . 3.39 1603 1304 A 18 ILE HD1% A 14 LYS HE3 1.0 . 4.02 1604 1305 A 18 ILE HB A 18 ILE HD1% 1.0 . 3.10 1605 1306 A 18 ILE HD1% A 18 ILE HG2% 1.0 . 2.87 1606 1307 A 36 GLN H A 53 LEU HA 1.0 . 5.50 1607 1308 A 34 PHE HB2 A 53 LEU HA 1.0 . 5.50 1608 1309 A 53 LEU HD1% A 53 LEU HA 1.0 . 4.00 1609 1310 A 53 LEU HA A 53 LEU HG 1.0 . 4.11 1610 1311 A 54 THR HB A 53 LEU HA 1.0 . 4.87 1611 1312 A 55 LEU HA A 55 LEU HG 1.0 . 4.11 1612 1313 A 55 LEU HA A 30 ALA HB% 1.0 . 5.50 1613 1314 A 31 GLN H A 30 ALA HA 1.0 . 3.06 1614 1315 A 30 ALA HA A 57 GLU HB2 1.0 . 3.89 1615 1316 A 6 LEU H A 5 PRO HD2 1.0 . 5.50 1616 1317 A 6 LEU H A 5 PRO HD3 1.0 . 5.18 1617 1318 A 4 THR HA A 5 PRO HD2 1.0 . 3.41 1618 1319 A 4 THR HB A 5 PRO HD2 1.0 . 4.74 1619 1320 A 4 THR HG2% A 5 PRO HD2 1.0 . 5.50 1620 1321 A 4 THR HB A 5 PRO HD3 1.0 . 4.70 1621 1322 A 5 PRO HD3 A 4 THR HA 1.0 . 3.43 1622 1323 A 71 ASP HA A 46 GLU HG2 1.0 . 5.21 1623 1323 A 71 ASP HA A 46 GLU HG3 1.0 . 5.21 1624 1324 A 47 ALA H A 71 ASP HA 1.0 . 4.79 1625 1325 A 78 ASN HD21 A 71 ASP HA 1.0 . 5.21 1626 1326 A 71 ASP HA A 72 PRO HD2 1.0 . 3.15 1627 1326 A 72 PRO HD3 A 71 ASP HA 1.0 . 3.15 1628 1327 A 71 ASP HA A 72 PRO HG2 1.0 . 4.57 1629 1327 A 71 ASP HA A 72 PRO HG3 1.0 . 4.57 1630 1328 A 71 ASP HA A 73 TYR H 1.0 . 5.01 1631 1329 A 81 ALA HA A 80 ILE HG2% 1.0 . 5.08 1632 1330 A 81 ALA HA A 82 ILE HB 1.0 . 4.63 1633 1331 A 82 ILE HG12 A 81 ALA HA 1.0 . 4.87 1634 1332 A 71 ASP HB3 A 72 PRO HD2 1.0 . 5.14 1635 1332 A 72 PRO HD3 A 71 ASP HB3 1.0 . 5.14 1636 1333 A 30 ALA H A 28 PRO HD2 1.0 . 5.19 1637 1334 A 28 PRO HD2 A 29 LEU HD1% 1.0 . 5.50 1638 1335 A 28 PRO HD2 A 27 TYR H 1.0 . 4.68 1639 1336 A 29 LEU H A 28 PRO HD3 1.0 . 4.77 1640 1337 A 63 GLY HAx A 52 HIS HE1 1.0 . 4.62 1641 1338 A 63 GLY HA3 A 52 HIS HE1 1.0 . 4.37 1642 1339 A 27 TYR HD% A 23 ALA HA 1.0 . 3.55 1643 1340 A 62 PHE HE% A 27 TYR HD% 1.0 . 3.54 1644 1341 A 27 TYR HA A 27 TYR HD% 1.0 . 3.17 1645 1342 A 30 ALA HB% A 27 TYR HD% 1.0 . 3.30 1646 1343 A 27 TYR H A 27 TYR HD% 1.0 . 3.43 1647 1344 A 64 VAL HG1% A 27 TYR HD% 1.0 . 4.84 1648 1345 A 29 LEU H A 27 TYR HD% 1.0 . 4.91 1649 1346 A 73 TYR HD% A 45 ASP HB3 1.0 . 5.50 1650 1347 A 71 ASP HA A 73 TYR HD% 1.0 . 4.90 1651 1348 A 73 TYR HD% A 72 PRO HG2 1.0 . 3.76 1652 1348 A 72 PRO HG3 A 73 TYR HD% 1.0 . 3.76 1653 1349 A 73 TYR H A 73 TYR HD% 1.0 . 3.37 1654 1350 A 73 TYR HD% A 73 TYR HA 1.0 . 3.11 1655 1351 A 73 TYR HD% A 72 PRO HD2 1.0 . 4.07 1656 1351 A 72 PRO HD3 A 73 TYR HD% 1.0 . 4.07 1657 1352 A 86 TYR HD% A 84 GLU HB2 1.0 . 4.24 1658 1352 A 84 GLU HB3 A 86 TYR HD% 1.0 . 4.24 1659 1353 A 86 TYR H A 86 TYR HD% 1.0 . 3.66 1660 1354 A 87 GLN H A 86 TYR HD% 1.0 . 4.03 1661 1355 A 87 GLN HA A 86 TYR HD% 1.0 . 4.65 1662 1356 A 85 GLU HA A 86 TYR HD% 1.0 . 4.79 1663 1357 A 62 PHE HD% A 57 GLU H 1.0 . 3.89 1664 1358 A 62 PHE HD% A 85 GLU H 1.0 . 4.73 1665 1359 A 62 PHE HD% A 61 GLU HA 1.0 . 3.64 1666 1360 A 62 PHE HD% A 56 ARG HA 1.0 . 4.38 1667 1361 A 62 PHE HD% A 62 PHE HA 1.0 . 3.70 1668 1362 A 62 PHE HD% A 84 GLU HA 1.0 . 4.75 1669 1363 A 62 PHE HD% A 63 GLY HA3 1.0 . 5.50 1670 1364 A 62 PHE HD% A 60 LYS HE2 1.0 . 4.76 1671 1364 A 62 PHE HD% A 60 LYS HE3 1.0 . 4.76 1672 1365 A 62 PHE HD% A 84 GLU HG3 1.0 . 3.96 1673 1366 A 62 PHE HD% A 60 LYS HB3 1.0 . 4.26 1674 1367 A 62 PHE HD% A 60 LYS HG2 1.0 . 3.56 1675 1368 A 62 PHE HD% A 64 VAL HG2% 1.0 . 3.52 1676 1369 A 62 PHE HD% A 55 LEU HD1% 1.0 . 4.23 1677 1370 A 62 PHE HD% A 55 LEU HB2 1.0 . 4.87 1678 1371 A 62 PHE HD% A 62 PHE H 1.0 . 3.27 1679 1372 A 70 PHE HD% A 71 ASP HA 1.0 . 5.05 1680 1373 A 75 GLN HG3 A 70 PHE HD% 1.0 . 4.78 1681 1374 A 70 PHE H A 70 PHE HD% 1.0 . 3.54 1682 1375 A 70 PHE HD% A 49 LYS H 1.0 . 4.31 1683 1376 A 71 ASP H A 70 PHE HD% 1.0 . 3.82 1684 1377 A 70 PHE HD% A 75 GLN H 1.0 . 4.00 1685 1378 A 69 SER HA A 70 PHE HD% 1.0 . 3.97 1686 1379 A 70 PHE HD% A 70 PHE HA 1.0 . 3.68 1687 1380 A 70 PHE HD% A 75 GLN HA 1.0 . 3.32 1688 1381 A 70 PHE HD% A 77 VAL HA 1.0 . 4.72 1689 1382 A 70 PHE HD% A 68 ILE HG2% 1.0 . 3.25 1690 1383 A 70 PHE HD% A 47 ALA HB% 1.0 . 3.84 1691 1384 A 70 PHE HD% A 76 LYS H 1.0 . 4.77 1692 1385 A 70 PHE HD% A 71 ASP HB2 1.0 . 5.50 1693 1386 A 70 PHE HD% A 72 PRO HD2 1.0 . 5.50 1694 1386 A 72 PRO HD3 A 70 PHE HD% 1.0 . 5.50 1695 1387 A 33 LEU H A 34 PHE HD% 1.0 . 5.29 1696 1388 A 35 LYS H A 34 PHE HD% 1.0 . 4.12 1697 1389 A 34 PHE HA A 34 PHE HD% 1.0 . 3.49 1698 1390 A 54 THR HG2% A 34 PHE HD% 1.0 . 3.45 1699 1391 A 51 TYR HD% A 37 LYS HA 1.0 . 5.21 1700 1392 A 52 HIS H A 51 TYR HD% 1.0 . 4.24 1701 1393 A 51 TYR H A 51 TYR HD% 1.0 . 3.61 1702 1394 A 51 TYR HD% A 51 TYR HA 1.0 . 3.58 1703 1395 A 19 ALA HB% A 51 TYR HD% 1.0 . 3.18 1704 1396 A 51 TYR HD% A 53 LEU HD2% 1.0 . 4.17 1705 1397 A 36 GLN HB3 A 34 PHE HD% 1.0 . 5.12 1706 1398 A 54 THR H A 34 PHE HD% 1.0 . 4.53 1707 1399 A 53 LEU HA A 34 PHE HD% 1.0 . 5.50 1708 1400 A 34 PHE HD% A 33 LEU HA 1.0 . 5.49 1709 1401 A 34 PHE HD% A 36 GLN HG2 1.0 . 5.01 1710 1401 A 36 GLN HG3 A 34 PHE HD% 1.0 . 5.01 1711 1402 A 51 TYR HD% A 36 GLN H 1.0 . 5.23 1712 1403 A 37 LYS H A 51 TYR HD% 1.0 . 5.41 1713 1404 A 51 TYR HD% A 38 VAL H 1.0 . 4.81 1714 1405 A 15 TRP HB2 A 51 TYR HD% 1.0 . 5.12 1715 1406 A 51 TYR HD% A 19 ALA HA 1.0 . 5.50 1716 1407 A 65 PHE HD% A 53 LEU H 1.0 . 5.50 1717 1408 A 54 THR HB A 34 PHE HE% 1.0 . 4.94 1718 1409 A 65 PHE HD% A 66 VAL H 1.0 . 4.85 1719 1410 A 65 PHE H A 65 PHE HD% 1.0 . 3.96 1720 1411 A 65 PHE HD% A 65 PHE HA 1.0 . 3.80 1721 1412 A 65 PHE HD% A 64 VAL HA 1.0 . 4.93 1722 1413 A 65 PHE HD% A 52 HIS HA 1.0 . 4.27 1723 1414 A 65 PHE HD% A 52 HIS HB3 1.0 . 4.45 1724 1415 A 65 PHE HD% A 83 LEU HB2 1.0 . 4.05 1725 1416 A 65 PHE HD% A 84 GLU HA 1.0 . 4.78 1726 1417 A 64 VAL HA A 65 PHE HE% 1.0 . 5.50 1727 1418 A 65 PHE HD% A 85 GLU H 1.0 . 5.28 1728 1419 A 62 PHE H A 62 PHE HE% 1.0 . 5.05 1729 1420 A 56 ARG HA A 62 PHE HE% 1.0 . 5.25 1730 1421 A 57 GLU HA A 62 PHE HE% 1.0 . 4.43 1731 1422 A 57 GLU H A 62 PHE HE% 1.0 . 4.16 1732 1423 A 61 GLU HA A 62 PHE HE% 1.0 . 5.50 1733 1424 A 62 PHE HE% A 57 GLU HB2 1.0 . 3.60 1734 1425 A 57 GLU HB3 A 62 PHE HE% 1.0 . 3.75 1735 1426 A 55 LEU HB3 A 62 PHE HE% 1.0 . 3.77 1736 1427 A 55 LEU HD2% A 62 PHE HE% 1.0 . 4.17 1737 1428 A 30 ALA HB% A 62 PHE HE% 1.0 . 3.83 1738 1429 A 55 LEU HD1% A 62 PHE HE% 1.0 . 3.83 1739 1430 A 55 LEU HB2 A 62 PHE HE% 1.0 . 4.39 1740 1431 A 56 ARG H A 62 PHE HE% 1.0 . 5.37 1741 1432 A 31 GLN H A 62 PHE HE% 1.0 . 5.50 1742 1433 A 70 PHE H A 70 PHE HE2 1.0 . 5.50 1743 1434 A 55 LEU HB2 A 62 PHE HZ 1.0 . 5.40 1744 1435 A 62 PHE HZ A 27 TYR HD% 1.0 . 4.37 1745 1436 A 55 LEU HD2% A 62 PHE HZ 1.0 . 4.63 1746 1437 A 55 LEU HD1% A 62 PHE HZ 1.0 . 4.54 1747 1438 A 49 LYS H A 70 PHE HE2 1.0 . 5.15 1748 1439 A 69 SER HA A 70 PHE HE2 1.0 . 5.50 1749 1440 A 48 VAL HA A 70 PHE HE2 1.0 . 5.11 1750 1441 A 70 PHE HE2 A 49 LYS HD2 1.0 . 3.85 1751 1441 A 49 LYS HD3 A 70 PHE HE2 1.0 . 3.85 1752 1442 A 15 TRP HE1 A 70 PHE HE2 1.0 . 5.28 1753 1443 A 47 ALA HA A 70 PHE HE2 1.0 . 4.71 1754 1444 A 47 ALA HB% A 70 PHE HE2 1.0 . 3.76 1755 1445 A 62 PHE HZ A 27 TYR HB2 1.0 . 4.56 1756 1446 A 62 PHE HZ A 57 GLU HB3 1.0 . 4.94 1757 1447 A 72 PRO HA A 70 PHE HE1 1.0 . 4.59 1758 1448 A 70 PHE HE1 A 72 PRO HB2 1.0 . 4.77 1759 1448 A 72 PRO HB3 A 70 PHE HE1 1.0 . 4.77 1760 1449 A 70 PHE HE1 A 49 LYS HD2 1.0 . 4.42 1761 1449 A 49 LYS HD3 A 70 PHE HE1 1.0 . 4.42 1762 1450 A 47 ALA HB% A 70 PHE HE1 1.0 . 4.16 1763 1451 A 15 TRP HE1 A 70 PHE HE1 1.0 . 5.50 1764 1452 A 39 TRP HD1 A 40 ASP H 1.0 . 5.50 1765 1453 A 39 TRP HA A 39 TRP HD1 1.0 . 3.98 1766 1454 A 39 TRP HD1 A 39 TRP HB3 1.0 . 3.84 1767 1455 A 14 LYS H A 15 TRP HD1 1.0 . 5.50 1768 1456 A 14 LYS HG3 A 15 TRP HD1 1.0 . 5.37 1769 1457 A 14 LYS HB2 A 15 TRP HD1 1.0 . 5.20 1770 1458 A 70 PHE HE2 A 15 TRP HD1 1.0 . 4.98 1771 1459 A 15 TRP H A 15 TRP HD1 1.0 . 3.42 1772 1460 A 15 TRP HA A 15 TRP HD1 1.0 . 4.48 1773 1461 A 15 TRP HB2 A 15 TRP HD1 1.0 . 3.20 1774 1462 A 49 LYS HE2 A 15 TRP HD1 1.0 . 3.69 1775 1463 A 15 TRP HD1 A 49 LYS HD2 1.0 . 4.05 1776 1463 A 49 LYS HD3 A 15 TRP HD1 1.0 . 4.05 1777 1464 A 14 LYS HB3 A 15 TRP HD1 1.0 . 4.33 1778 1465 A 14 LYS HG2 A 15 TRP HD1 1.0 . 5.08 1779 1466 A 15 TRP HH2 A 75 GLN HA 1.0 . 4.45 1780 1467 A 15 TRP HH2 A 70 PHE HA 1.0 . 5.16 1781 1468 A 15 TRP HH2 A 77 VAL HA 1.0 . 5.22 1782 1469 A 70 PHE HB3 A 15 TRP HH2 1.0 . 4.75 1783 1470 A 15 TRP HH2 A 75 GLN HB2 1.0 . 4.00 1784 1471 A 77 VAL HG2% A 15 TRP HH2 1.0 . 3.67 1785 1472 A 15 TRP HH2 A 18 ILE HD1% 1.0 . 4.67 1786 1473 A 15 TRP HE1 A 70 PHE HZ 1.0 . 5.24 1787 1474 A 47 ALA HA A 70 PHE HZ 1.0 . 5.50 1788 1475 A 15 TRP HH2 A 77 VAL HG1% 1.0 . 4.82 1789 1476 A 47 ALA HB% A 70 PHE HZ 1.0 . 5.46 1790 1477 A 41 ARG HD2 A 39 TRP HH2 1.0 . 5.50 1791 1478 A 41 ARG HB2 A 39 TRP HH2 1.0 . 5.50 1792 1479 A 39 TRP HH2 A 41 ARG HG2 1.0 . 5.10 1793 1479 A 41 ARG HG3 A 39 TRP HH2 1.0 . 5.10 1794 1480 A 48 VAL HB A 39 TRP HE3 1.0 . 4.96 1795 1481 A 39 TRP HZ3 A 39 TRP HB2 1.0 . 5.41 1796 1482 A 41 ARG H A 39 TRP HE3 1.0 . 5.50 1797 1483 A 77 VAL H A 15 TRP HZ3 1.0 . 5.34 1798 1484 A 77 VAL HA A 15 TRP HZ3 1.0 . 5.13 1799 1485 A 15 TRP HZ3 A 68 ILE HG2% 1.0 . 3.57 1800 1486 A 18 ILE HD1% A 15 TRP HZ3 1.0 . 3.77 1801 1487 A 70 PHE HB3 A 15 TRP HZ3 1.0 . 5.50 1802 1488 A 11 HIS HA A 11 HIS HD2 1.0 . 3.76 1803 1489 A 11 HIS HB3 A 11 HIS HD2 1.0 . 3.80 1804 1490 A 18 ILE H A 15 TRP HE3 1.0 . 5.50 1805 1491 A 15 TRP HA A 15 TRP HE3 1.0 . 3.10 1806 1492 A 18 ILE HB A 15 TRP HE3 1.0 . 3.99 1807 1493 A 18 ILE HG12 A 15 TRP HE3 1.0 . 4.80 1808 1494 A 18 ILE HD1% A 15 TRP HE3 1.0 . 3.46 1809 1495 A 15 TRP HE3 A 14 LYS HG2 1.0 . 5.28 1810 1496 A 73 TYR HE% A 72 PRO HD2 1.0 . 4.39 1811 1496 A 72 PRO HD3 A 73 TYR HE% 1.0 . 4.39 1812 1497 A 73 TYR HE% A 72 PRO HG2 1.0 . 3.84 1813 1497 A 72 PRO HG3 A 73 TYR HE% 1.0 . 3.84 1814 1498 A 45 ASP HB2 A 73 TYR HE% 1.0 . 4.64 1815 1499 A 86 TYR H A 86 TYR HE% 1.0 . 5.18 1816 1500 A 73 TYR H A 73 TYR HE% 1.0 . 4.72 1817 1501 A 87 GLN HA A 86 TYR HE% 1.0 . 5.50 1818 1502 A 84 GLU H A 86 TYR HE% 1.0 . 5.50 1819 1503 A 27 TYR HE% A 62 PHE HE% 1.0 . 3.81 1820 1504 A 27 TYR HE% A 26 ARG HB3 1.0 . 3.93 1821 1505 A 55 LEU HD1% A 27 TYR HE% 1.0 . 4.10 1822 1506 A 27 TYR HE% A 23 ALA HA 1.0 . 4.14 1823 1507 A 27 TYR HE% A 23 ALA HB% 1.0 . 4.03 1824 1508 A 27 TYR HE% A 26 ARG HG2 1.0 . 3.94 1825 1509 A 64 VAL HG1% A 27 TYR HE% 1.0 . 3.62 1826 1510 A 55 LEU HD2% A 27 TYR HE% 1.0 . 4.42 1827 1511 A 15 TRP HA A 51 TYR HE% 1.0 . 4.94 1828 1512 A 16 GLU HA A 51 TYR HE% 1.0 . 4.31 1829 1513 A 16 GLU H A 51 TYR HE% 1.0 . 4.94 1830 1514 A 51 TYR HA A 51 TYR HE% 1.0 . 4.91 1831 1515 A 15 TRP HB2 A 51 TYR HE% 1.0 . 3.54 1832 1516 A 51 TYR H A 51 TYR HE% 1.0 . 4.97 1833 1517 A 37 LYS HA A 51 TYR HE% 1.0 . 5.50 1834 1518 A 75 GLN HG2 A 15 TRP HZ2 1.0 . 3.69 1835 1519 A 75 GLN HG3 A 15 TRP HZ2 1.0 . 3.94 1836 1520 A 75 GLN HA A 15 TRP HZ2 1.0 . 4.39 1837 1521 A 77 VAL HG2% A 15 TRP HZ2 1.0 . 5.23 1838 1522 A 15 TRP HZ2 A 14 LYS HG2 1.0 . 5.41 1839 1523 A 41 ARG HD2 A 39 TRP HZ2 1.0 . 5.47 1840 1524 A 41 ARG HB2 A 39 TRP HZ2 1.0 . 5.50 1841 1525 A 75 GLN H A 15 TRP HZ2 1.0 . 5.50 1842 1526 A 18 ILE HD1% A 15 TRP HZ2 1.0 . 5.50 1843 1527 A 41 ARG HD3 A 39 TRP HZ2 1.0 . 5.20 1844 1528 A 39 TRP HZ2 A 41 ARG HG2 1.0 . 4.67 1845 1528 A 41 ARG HG3 A 39 TRP HZ2 1.0 . 4.67 stop_ save_