data_nef_c16478_2kna 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 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 SER middle . . 3 A 3 ALA middle . . 4 A 4 MET middle . . 5 A 5 ALA middle . . 6 A 6 ASP middle . . 7 A 7 ILE middle . . 8 A 8 GLY middle . false 9 A 9 SER middle . . 10 A 10 GLU middle . . 11 A 11 PHE middle . . 12 A 12 GLU middle . . 13 A 13 LYS middle . . 14 A 14 THR middle . . 15 A 15 PRO middle . false 16 A 16 SER middle . . 17 A 17 LEU middle . . 18 A 18 THR middle . . 19 A 19 ARG middle . . 20 A 20 ARG middle . . 21 A 21 ILE middle . . 22 A 22 ASP middle . . 23 A 23 ASP middle . . 24 A 24 THR middle . . 25 A 25 ILE middle . . 26 A 26 PHE middle . . 27 A 27 GLN middle . . 28 A 28 ASN middle . . 29 A 29 PRO middle . false 30 A 30 MET middle . . 31 A 31 VAL middle . . 32 A 32 GLN middle . . 33 A 33 GLU middle . . 34 A 34 ALA middle . . 35 A 35 ILE middle . . 36 A 36 ARG middle . . 37 A 37 MET middle . . 38 A 38 GLY middle . false 39 A 39 PHE middle . . 40 A 40 SER middle . . 41 A 41 PHE middle . . 42 A 42 LYS middle . . 43 A 43 ASP middle . . 44 A 44 ILE middle . . 45 A 45 LYS middle . . 46 A 46 LYS middle . . 47 A 47 ILE middle . . 48 A 48 MET middle . . 49 A 49 GLU middle . . 50 A 50 GLU middle . . 51 A 51 LYS middle . . 52 A 52 ILE middle . . 53 A 53 GLN middle . . 54 A 54 ILE middle . . 55 A 55 SER middle . . 56 A 56 GLY middle . false 57 A 57 SER middle . . 58 A 58 ASN middle . . 59 A 59 TYR middle . . 60 A 60 LYS middle . . 61 A 61 SER middle . . 62 A 62 LEU middle . . 63 A 63 GLU middle . . 64 A 64 VAL middle . . 65 A 65 LEU middle . . 66 A 66 VAL middle . . 67 A 67 ALA middle . . 68 A 68 ASP middle . . 69 A 69 LEU middle . . 70 A 70 VAL middle . . 71 A 71 ASN middle . . 72 A 72 ALA middle . . 73 A 73 GLN middle . . 74 A 74 LYS middle . . 75 A 75 ASP middle . . 76 A 76 SER middle . . 77 A 77 MET middle . . 78 A 78 GLN middle . . 79 A 79 ASP middle . . 80 A 80 GLU middle . . 81 A 81 SER middle . . 82 A 82 SER middle . . 83 A 83 GLN middle . . 84 A 84 THR middle . . 85 A 85 SER middle . . 86 A 86 LEU middle . . 87 A 87 GLN middle . . 88 A 88 LYS middle . . 89 A 89 GLU middle . . 90 A 90 ILE middle . . 91 A 91 SER middle . . 92 A 92 THR middle . . 93 A 93 GLU middle . . 94 A 94 GLU middle . . 95 A 95 GLN middle . . 96 A 96 LEU middle . . 97 A 97 ARG middle . . 98 A 98 ARG middle . . 99 A 99 LEU middle . . 100 A 100 GLN middle . . 101 A 101 GLU middle . . 102 A 102 GLU middle . . 103 A 103 LYS middle . . 104 A 104 LEU end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HAx H 1 3.872 0.001 A 1 GLY HAy H 1 3.872 0.001 A 1 GLY CA C 13 43.237 0.052 A 2 SER HA H 1 4.481 0.030 A 2 SER HBx H 1 3.861 0.030 A 2 SER HBy H 1 3.861 0.030 A 2 SER C C 13 174.254 0.044 A 2 SER CA C 13 58.264 0.300 A 2 SER CB C 13 64.047 0.300 A 3 ALA H H 1 8.554 0.002 A 3 ALA HA H 1 4.334 0.001 A 3 ALA HB% H 1 1.388 0.030 A 3 ALA C C 13 177.843 0.030 A 3 ALA CA C 13 52.687 0.008 A 3 ALA CB C 13 19.166 0.001 A 3 ALA N N 15 126.285 0.024 A 4 MET H H 1 8.345 0.002 A 4 MET HA H 1 4.404 0.004 A 4 MET HBx H 1 1.998 0.018 A 4 MET HBy H 1 1.998 0.018 A 4 MET HE% H 1 1.896 0.030 A 4 MET HGx H 1 2.564 0.030 A 4 MET HGy H 1 2.564 0.030 A 4 MET C C 13 176.061 0.031 A 4 MET CA C 13 55.607 0.004 A 4 MET CB C 13 32.915 0.002 A 4 MET CE C 13 17.451 0.300 A 4 MET CG C 13 32.061 0.001 A 4 MET N N 15 119.525 0.008 A 5 ALA H H 1 8.232 0.001 A 5 ALA HA H 1 4.269 0.001 A 5 ALA HB% H 1 1.355 0.002 A 5 ALA C C 13 177.348 0.013 A 5 ALA CA C 13 52.575 0.001 A 5 ALA CB C 13 19.376 0.001 A 5 ALA N N 15 124.660 0.028 A 6 ASP H H 1 8.277 0.002 A 6 ASP HA H 1 4.578 0.001 A 6 ASP HBx H 1 2.578 0.030 A 6 ASP HBy H 1 2.674 0.030 A 6 ASP C C 13 176.427 0.044 A 6 ASP CA C 13 54.282 0.016 A 6 ASP CB C 13 41.124 0.059 A 6 ASP N N 15 119.734 0.025 A 7 ILE H H 1 8.061 0.001 A 7 ILE HA H 1 4.168 0.003 A 7 ILE HB H 1 1.887 0.005 A 7 ILE HD1% H 1 0.840 0.007 A 7 ILE HG1y H 1 1.471 0.003 A 7 ILE HG1x H 1 1.200 0.003 A 7 ILE HG2% H 1 0.914 0.004 A 7 ILE C C 13 176.972 0.020 A 7 ILE CA C 13 61.663 0.044 A 7 ILE CB C 13 38.751 0.044 A 7 ILE CD1 C 13 13.133 0.021 A 7 ILE CG1 C 13 27.332 0.060 A 7 ILE CG2 C 13 17.564 0.030 A 7 ILE N N 15 120.697 0.023 A 8 GLY H H 1 8.544 0.002 A 8 GLY HAx H 1 3.961 0.030 A 8 GLY HAy H 1 4.024 0.030 A 8 GLY C C 13 174.515 0.032 A 8 GLY CA C 13 45.317 0.010 A 8 GLY N N 15 112.517 0.008 A 9 SER H H 1 8.196 0.003 A 9 SER HA H 1 4.437 0.030 A 9 SER HBx H 1 3.872 0.030 A 9 SER HBy H 1 3.872 0.030 A 9 SER C C 13 175.003 0.035 A 9 SER CA C 13 58.676 0.300 A 9 SER CB C 13 63.925 0.300 A 9 SER N N 15 115.781 0.041 A 10 GLU H H 1 8.657 0.004 A 10 GLU HA H 1 4.171 0.003 A 10 GLU HBx H 1 1.820 0.001 A 10 GLU HBy H 1 1.868 0.003 A 10 GLU HGx H 1 1.991 0.004 A 10 GLU HGy H 1 2.086 0.003 A 10 GLU C C 13 176.495 0.045 A 10 GLU CA C 13 57.211 0.019 A 10 GLU CB C 13 29.788 0.013 A 10 GLU CG C 13 36.104 0.027 A 10 GLU N N 15 122.597 0.036 A 11 PHE H H 1 8.052 0.001 A 11 PHE HA H 1 4.578 0.003 A 11 PHE HBx H 1 2.968 0.001 A 11 PHE HBy H 1 3.180 0.001 A 11 PHE HDx H 1 7.236 0.002 A 11 PHE HDy H 1 7.237 0.030 A 11 PHE HEx H 1 7.338 0.030 A 11 PHE HEy H 1 7.338 0.030 A 11 PHE HZ H 1 7.312 0.030 A 11 PHE C C 13 175.861 0.021 A 11 PHE CA C 13 57.943 0.021 A 11 PHE CB C 13 39.479 0.050 A 11 PHE N N 15 119.723 0.010 A 12 GLU H H 1 8.133 0.001 A 12 GLU HA H 1 4.217 0.006 A 12 GLU HBx H 1 1.978 0.004 A 12 GLU HBy H 1 1.978 0.004 A 12 GLU HGx H 1 2.200 0.004 A 12 GLU HGy H 1 2.200 0.004 A 12 GLU C C 13 176.215 0.039 A 12 GLU CA C 13 56.636 0.004 A 12 GLU CB C 13 30.277 0.039 A 12 GLU CG C 13 36.446 0.067 A 12 GLU N N 15 121.572 0.021 A 13 LYS H H 1 8.254 0.006 A 13 LYS HA H 1 4.328 0.001 A 13 LYS HBx H 1 1.754 0.002 A 13 LYS HBy H 1 1.843 0.030 A 13 LYS HDx H 1 1.670 0.001 A 13 LYS HDy H 1 1.670 0.001 A 13 LYS HEx H 1 2.977 0.002 A 13 LYS HEy H 1 2.977 0.002 A 13 LYS HGx H 1 1.431 0.002 A 13 LYS HGy H 1 1.431 0.002 A 13 LYS C C 13 176.607 0.034 A 13 LYS CA C 13 56.422 0.300 A 13 LYS CB C 13 33.063 0.029 A 13 LYS CD C 13 28.867 0.001 A 13 LYS CE C 13 42.062 0.013 A 13 LYS CG C 13 24.763 0.001 A 13 LYS N N 15 122.141 0.038 A 14 THR H H 1 8.144 0.002 A 14 THR HA H 1 4.567 0.001 A 14 THR HB H 1 4.152 0.003 A 14 THR HG2% H 1 1.225 0.004 A 14 THR C C 13 172.901 0.300 A 14 THR CA C 13 59.866 0.063 A 14 THR CB C 13 69.609 0.056 A 14 THR CG2 C 13 21.534 0.027 A 14 THR N N 15 117.273 0.012 A 15 PRO HA H 1 4.413 0.002 A 15 PRO HBx H 1 1.899 0.003 A 15 PRO HBy H 1 2.291 0.003 A 15 PRO HDx H 1 3.703 0.005 A 15 PRO HDy H 1 3.818 0.004 A 15 PRO HGx H 1 1.977 0.001 A 15 PRO HGy H 1 2.025 0.003 A 15 PRO C C 13 177.084 0.019 A 15 PRO CA C 13 63.575 0.015 A 15 PRO CB C 13 32.171 0.046 A 15 PRO CD C 13 51.186 0.013 A 15 PRO CG C 13 27.523 0.019 A 16 SER H H 1 8.405 0.002 A 16 SER HA H 1 4.380 0.030 A 16 SER HBx H 1 3.862 0.030 A 16 SER HBy H 1 3.862 0.030 A 16 SER C C 13 174.973 0.018 A 16 SER CA C 13 58.517 0.300 A 16 SER CB C 13 63.693 0.300 A 16 SER N N 15 116.009 0.003 A 17 LEU H H 1 8.352 0.002 A 17 LEU HA H 1 4.378 0.001 A 17 LEU HBx H 1 1.640 0.030 A 17 LEU HBy H 1 1.640 0.030 A 17 LEU HDx% H 1 0.860 0.001 A 17 LEU HDy% H 1 0.913 0.003 A 17 LEU HG H 1 1.625 0.003 A 17 LEU C C 13 177.627 0.030 A 17 LEU CA C 13 55.675 0.300 A 17 LEU CB C 13 42.334 0.010 A 17 LEU CDx C 13 23.622 0.002 A 17 LEU CDy C 13 24.934 0.023 A 17 LEU CG C 13 27.145 0.002 A 17 LEU N N 15 124.278 0.018 A 18 THR H H 1 8.088 0.001 A 18 THR HA H 1 4.260 0.001 A 18 THR HB H 1 4.236 0.030 A 18 THR HG2% H 1 1.169 0.002 A 18 THR C C 13 174.451 0.029 A 18 THR CA C 13 62.208 0.008 A 18 THR CB C 13 69.586 0.300 A 18 THR CG2 C 13 21.663 0.003 A 18 THR N N 15 114.571 0.014 A 19 ARG H H 1 8.230 0.004 A 19 ARG HA H 1 4.310 0.030 A 19 ARG HBx H 1 1.860 0.003 A 19 ARG HBy H 1 1.860 0.003 A 19 ARG HDx H 1 3.178 0.003 A 19 ARG HDy H 1 3.178 0.003 A 19 ARG HGx H 1 1.658 0.030 A 19 ARG HGy H 1 1.658 0.030 A 19 ARG C C 13 175.937 0.034 A 19 ARG CA C 13 56.167 0.300 A 19 ARG CB C 13 30.879 0.014 A 19 ARG CD C 13 43.261 0.300 A 19 ARG CG C 13 27.188 0.300 A 19 ARG N N 15 123.493 0.065 A 20 ARG H H 1 8.398 0.003 A 20 ARG HA H 1 4.299 0.030 A 20 ARG HBx H 1 1.747 0.030 A 20 ARG HBy H 1 1.842 0.030 A 20 ARG HDx H 1 3.169 0.030 A 20 ARG HDy H 1 3.169 0.030 A 20 ARG HGx H 1 1.641 0.030 A 20 ARG HGy H 1 1.641 0.030 A 20 ARG C C 13 176.666 0.021 A 20 ARG CA C 13 56.161 0.300 A 20 ARG CB C 13 30.829 0.006 A 20 ARG CD C 13 43.300 0.300 A 20 ARG CG C 13 27.226 0.300 A 20 ARG N N 15 122.375 0.010 A 21 ILE H H 1 8.435 0.002 A 21 ILE HA H 1 4.132 0.002 A 21 ILE HB H 1 1.883 0.002 A 21 ILE HD1% H 1 0.811 0.030 A 21 ILE HG1x H 1 1.216 0.001 A 21 ILE HG1y H 1 1.419 0.002 A 21 ILE HG2% H 1 0.882 0.001 A 21 ILE C C 13 175.745 0.013 A 21 ILE CA C 13 61.174 0.022 A 21 ILE CB C 13 38.374 0.300 A 21 ILE CD1 C 13 13.129 0.002 A 21 ILE CG1 C 13 27.475 0.003 A 21 ILE CG2 C 13 17.812 0.026 A 21 ILE N N 15 122.163 0.018 A 22 ASP H H 1 8.274 0.001 A 22 ASP HA H 1 4.630 0.030 A 22 ASP HBx H 1 2.708 0.030 A 22 ASP HBy H 1 2.708 0.030 A 22 ASP C C 13 176.549 0.045 A 22 ASP CA C 13 54.414 0.300 A 22 ASP CB C 13 41.376 0.300 A 22 ASP N N 15 123.882 0.013 A 23 ASP H H 1 8.288 0.004 A 23 ASP HA H 1 4.650 0.030 A 23 ASP HBx H 1 2.744 0.030 A 23 ASP HBy H 1 2.744 0.030 A 23 ASP C C 13 178.011 0.031 A 23 ASP CA C 13 56.197 0.300 A 23 ASP CB C 13 41.048 0.300 A 23 ASP N N 15 119.593 0.026 A 24 THR H H 1 8.386 0.002 A 24 THR HA H 1 4.259 0.004 A 24 THR HB H 1 4.361 0.002 A 24 THR HG2% H 1 1.296 0.001 A 24 THR C C 13 176.905 0.023 A 24 THR CA C 13 64.275 0.008 A 24 THR CB C 13 69.358 0.019 A 24 THR CG2 C 13 21.816 0.036 A 24 THR N N 15 113.560 0.005 A 25 ILE H H 1 8.008 0.001 A 25 ILE HA H 1 4.170 0.002 A 25 ILE HB H 1 2.090 0.004 A 25 ILE HD1% H 1 0.875 0.001 A 25 ILE HG1x H 1 1.348 0.005 A 25 ILE HG1y H 1 1.553 0.008 A 25 ILE HG2% H 1 0.949 0.001 A 25 ILE C C 13 176.546 0.039 A 25 ILE CA C 13 63.173 0.035 A 25 ILE CB C 13 38.380 0.022 A 25 ILE CD1 C 13 13.750 0.038 A 25 ILE CG1 C 13 28.787 0.013 A 25 ILE CG2 C 13 18.059 0.009 A 25 ILE N N 15 121.784 0.035 A 26 PHE H H 1 7.948 0.001 A 26 PHE HA H 1 4.090 0.001 A 26 PHE HBx H 1 2.931 0.030 A 26 PHE HBy H 1 3.019 0.030 A 26 PHE HDy H 1 6.787 0.004 A 26 PHE HDx H 1 6.783 0.030 A 26 PHE HEy H 1 7.116 0.010 A 26 PHE HEx H 1 7.112 0.013 A 26 PHE HZ H 1 6.806 0.030 A 26 PHE C C 13 175.601 0.021 A 26 PHE CA C 13 60.841 0.013 A 26 PHE CB C 13 39.272 0.051 A 26 PHE N N 15 119.214 0.026 A 27 GLN H H 1 7.635 0.001 A 27 GLN HA H 1 4.122 0.002 A 27 GLN HBx H 1 1.998 0.003 A 27 GLN HBy H 1 2.268 0.005 A 27 GLN HE2x H 1 6.861 0.030 A 27 GLN HE2y H 1 7.548 0.030 A 27 GLN HGx H 1 2.418 0.004 A 27 GLN HGy H 1 2.418 0.004 A 27 GLN C C 13 175.760 0.027 A 27 GLN CA C 13 55.572 0.015 A 27 GLN CB C 13 28.568 0.001 A 27 GLN CG C 13 34.023 0.002 A 27 GLN N N 15 112.895 0.007 A 27 GLN NE2 N 15 111.775 0.011 A 28 ASN H H 1 7.687 0.002 A 28 ASN HA H 1 4.825 0.002 A 28 ASN HBx H 1 2.954 0.030 A 28 ASN HBy H 1 3.057 0.030 A 28 ASN HD2y H 1 7.931 0.001 A 28 ASN HD2x H 1 7.222 0.001 A 28 ASN C C 13 174.905 0.300 A 28 ASN CA C 13 51.752 0.009 A 28 ASN CB C 13 39.605 0.002 A 28 ASN N N 15 122.169 0.027 A 28 ASN ND2 N 15 113.461 0.003 A 29 PRO HA H 1 4.229 0.002 A 29 PRO HBx H 1 2.018 0.030 A 29 PRO HBy H 1 2.409 0.002 A 29 PRO HDx H 1 3.813 0.003 A 29 PRO HDy H 1 4.059 0.004 A 29 PRO HGx H 1 2.076 0.030 A 29 PRO HGy H 1 2.108 0.030 A 29 PRO C C 13 178.757 0.006 A 29 PRO CA C 13 65.477 0.040 A 29 PRO CB C 13 32.467 0.300 A 29 PRO CD C 13 51.328 0.024 A 29 PRO CG C 13 27.646 0.015 A 30 MET H H 1 8.260 0.002 A 30 MET HA H 1 4.110 0.003 A 30 MET HBx H 1 1.831 0.006 A 30 MET HBy H 1 2.110 0.005 A 30 MET HE% H 1 1.839 0.030 A 30 MET HGx H 1 2.256 0.005 A 30 MET HGy H 1 2.423 0.002 A 30 MET C C 13 177.889 0.042 A 30 MET CA C 13 59.056 0.032 A 30 MET CB C 13 33.762 0.042 A 30 MET CE C 13 16.543 0.300 A 30 MET CG C 13 31.856 0.034 A 30 MET N N 15 117.515 0.033 A 31 VAL H H 1 7.333 0.002 A 31 VAL HA H 1 3.351 0.001 A 31 VAL HB H 1 2.495 0.004 A 31 VAL HGx% H 1 1.018 0.002 A 31 VAL HGy% H 1 1.049 0.001 A 31 VAL C C 13 177.650 0.031 A 31 VAL CA C 13 66.732 0.014 A 31 VAL CB C 13 31.368 0.009 A 31 VAL CGx C 13 21.534 0.039 A 31 VAL CGy C 13 23.844 0.009 A 31 VAL N N 15 118.811 0.036 A 32 GLN H H 1 7.675 0.002 A 32 GLN HA H 1 3.662 0.004 A 32 GLN HBx H 1 2.009 0.004 A 32 GLN HBy H 1 2.009 0.004 A 32 GLN HE2x H 1 5.792 0.030 A 32 GLN HE2y H 1 7.412 0.030 A 32 GLN HGx H 1 2.130 0.030 A 32 GLN HGy H 1 2.279 0.007 A 32 GLN C C 13 178.943 0.026 A 32 GLN CA C 13 58.787 0.062 A 32 GLN CB C 13 27.986 0.001 A 32 GLN CG C 13 33.346 0.003 A 32 GLN N N 15 115.563 0.005 A 32 GLN NE2 N 15 112.687 0.024 A 33 GLU H H 1 7.884 0.003 A 33 GLU HA H 1 4.109 0.002 A 33 GLU HBx H 1 1.985 0.030 A 33 GLU HBy H 1 1.985 0.030 A 33 GLU HGx H 1 2.327 0.030 A 33 GLU HGy H 1 2.327 0.030 A 33 GLU C C 13 178.302 0.045 A 33 GLU CA C 13 59.127 0.300 A 33 GLU CB C 13 29.517 0.300 A 33 GLU CG C 13 36.247 0.005 A 33 GLU N N 15 119.201 0.021 A 34 ALA H H 1 7.987 0.001 A 34 ALA HA H 1 4.222 0.001 A 34 ALA HB% H 1 1.304 0.030 A 34 ALA C C 13 179.998 0.027 A 34 ALA CA C 13 55.510 0.300 A 34 ALA CB C 13 17.145 0.001 A 34 ALA N N 15 122.261 0.012 A 35 ILE H H 1 8.444 0.002 A 35 ILE HA H 1 4.533 0.002 A 35 ILE HB H 1 1.914 0.002 A 35 ILE HD1% H 1 0.877 0.001 A 35 ILE HG1x H 1 1.827 0.006 A 35 ILE HG1y H 1 1.827 0.006 A 35 ILE HG2% H 1 0.977 0.004 A 35 ILE C C 13 181.651 0.034 A 35 ILE CA C 13 64.325 0.020 A 35 ILE CB C 13 38.136 0.023 A 35 ILE CD1 C 13 14.596 0.040 A 35 ILE CG1 C 13 29.156 0.017 A 35 ILE CG2 C 13 16.915 0.022 A 35 ILE N N 15 120.796 0.021 A 36 ARG H H 1 8.046 0.002 A 36 ARG HA H 1 4.021 0.001 A 36 ARG HBx H 1 2.012 0.003 A 36 ARG HBy H 1 2.012 0.003 A 36 ARG HDx H 1 3.223 0.002 A 36 ARG HDy H 1 3.223 0.002 A 36 ARG HE H 1 7.553 0.030 A 36 ARG HGx H 1 1.832 0.030 A 36 ARG HGy H 1 1.832 0.030 A 36 ARG C C 13 178.499 0.024 A 36 ARG CA C 13 59.684 0.001 A 36 ARG CB C 13 29.973 0.300 A 36 ARG CD C 13 43.395 0.004 A 36 ARG CG C 13 27.994 0.033 A 36 ARG N N 15 123.384 0.005 A 36 ARG NE N 15 83.917 0.300 A 37 MET H H 1 7.761 0.002 A 37 MET HA H 1 4.201 0.001 A 37 MET HBx H 1 2.402 0.005 A 37 MET HBy H 1 2.402 0.005 A 37 MET HE% H 1 2.185 0.030 A 37 MET HGx H 1 2.596 0.006 A 37 MET HGy H 1 2.939 0.005 A 37 MET C C 13 175.920 0.024 A 37 MET CA C 13 57.106 0.007 A 37 MET CB C 13 34.018 0.300 A 37 MET CE C 13 17.435 0.300 A 37 MET CG C 13 32.787 0.059 A 37 MET N N 15 116.255 0.037 A 38 GLY H H 1 7.941 0.001 A 38 GLY HAx H 1 3.587 0.001 A 38 GLY HAy H 1 4.166 0.001 A 38 GLY C C 13 174.433 0.036 A 38 GLY CA C 13 44.704 0.067 A 38 GLY N N 15 105.619 0.009 A 39 PHE H H 1 7.630 0.002 A 39 PHE HA H 1 4.603 0.030 A 39 PHE HBx H 1 2.567 0.005 A 39 PHE HBy H 1 2.997 0.030 A 39 PHE HDx H 1 7.470 0.016 A 39 PHE HDy H 1 7.478 0.007 A 39 PHE HEx H 1 7.191 0.013 A 39 PHE HEy H 1 7.193 0.014 A 39 PHE HZ H 1 6.777 0.030 A 39 PHE C C 13 174.928 0.030 A 39 PHE CA C 13 58.403 0.002 A 39 PHE CB C 13 39.448 0.022 A 39 PHE N N 15 120.168 0.007 A 40 SER H H 1 9.447 0.001 A 40 SER HA H 1 4.618 0.004 A 40 SER HBx H 1 4.075 0.030 A 40 SER HBy H 1 4.201 0.001 A 40 SER C C 13 175.969 0.027 A 40 SER CA C 13 57.227 0.039 A 40 SER CB C 13 64.673 0.059 A 40 SER N N 15 117.395 0.006 A 41 PHE H H 1 9.538 0.001 A 41 PHE HA H 1 4.225 0.002 A 41 PHE HBx H 1 3.081 0.006 A 41 PHE HBy H 1 3.378 0.003 A 41 PHE HDx H 1 7.162 0.030 A 41 PHE HDy H 1 7.162 0.030 A 41 PHE HEx H 1 7.173 0.030 A 41 PHE HEy H 1 7.210 0.006 A 41 PHE HZ H 1 6.770 0.030 A 41 PHE C C 13 176.242 0.037 A 41 PHE CA C 13 61.639 0.005 A 41 PHE CB C 13 38.826 0.044 A 41 PHE N N 15 125.530 0.014 A 42 LYS H H 1 8.529 0.001 A 42 LYS HA H 1 3.677 0.001 A 42 LYS HBx H 1 1.748 0.030 A 42 LYS HBy H 1 1.849 0.030 A 42 LYS HDx H 1 1.686 0.002 A 42 LYS HDy H 1 1.686 0.002 A 42 LYS HEx H 1 3.011 0.001 A 42 LYS HEy H 1 3.011 0.001 A 42 LYS HGx H 1 1.374 0.001 A 42 LYS HGy H 1 1.492 0.004 A 42 LYS C C 13 178.748 0.019 A 42 LYS CA C 13 59.808 0.007 A 42 LYS CB C 13 32.065 0.010 A 42 LYS CD C 13 29.383 0.003 A 42 LYS CE C 13 41.898 0.300 A 42 LYS CG C 13 24.629 0.014 A 42 LYS N N 15 116.407 0.040 A 43 ASP H H 1 7.349 0.003 A 43 ASP HA H 1 4.439 0.009 A 43 ASP HBx H 1 2.562 0.001 A 43 ASP HBy H 1 2.864 0.008 A 43 ASP C C 13 178.109 0.024 A 43 ASP CA C 13 57.215 0.017 A 43 ASP CB C 13 40.360 0.022 A 43 ASP N N 15 119.908 0.035 A 44 ILE H H 1 8.052 0.001 A 44 ILE HA H 1 3.439 0.002 A 44 ILE HB H 1 1.712 0.002 A 44 ILE HD1% H 1 0.829 0.006 A 44 ILE HG1x H 1 0.596 0.007 A 44 ILE HG1y H 1 1.777 0.009 A 44 ILE HG2% H 1 0.945 0.002 A 44 ILE C C 13 176.856 0.037 A 44 ILE CA C 13 65.221 0.004 A 44 ILE CB C 13 39.178 0.044 A 44 ILE CD1 C 13 17.244 0.023 A 44 ILE CG1 C 13 29.275 0.045 A 44 ILE CG2 C 13 18.930 0.005 A 44 ILE N N 15 121.653 0.013 A 45 LYS H H 1 8.540 0.002 A 45 LYS HA H 1 3.530 0.002 A 45 LYS HBx H 1 0.992 0.006 A 45 LYS HBy H 1 1.369 0.005 A 45 LYS HDx H 1 1.434 0.008 A 45 LYS HDy H 1 1.434 0.008 A 45 LYS HEx H 1 2.697 0.004 A 45 LYS HEy H 1 2.824 0.003 A 45 LYS HGx H 1 1.013 0.030 A 45 LYS HGy H 1 1.095 0.002 A 45 LYS C C 13 177.658 0.029 A 45 LYS CA C 13 60.286 0.032 A 45 LYS CB C 13 32.191 0.044 A 45 LYS CD C 13 29.806 0.033 A 45 LYS CE C 13 41.765 0.013 A 45 LYS CG C 13 25.031 0.021 A 45 LYS N N 15 118.535 0.009 A 46 LYS H H 1 7.218 0.003 A 46 LYS HA H 1 4.081 0.004 A 46 LYS HBx H 1 1.899 0.004 A 46 LYS HBy H 1 1.899 0.004 A 46 LYS HDx H 1 1.709 0.030 A 46 LYS HDy H 1 1.709 0.030 A 46 LYS HEx H 1 2.971 0.001 A 46 LYS HEy H 1 2.971 0.001 A 46 LYS HGx H 1 1.378 0.001 A 46 LYS HGy H 1 1.462 0.030 A 46 LYS C C 13 178.762 0.017 A 46 LYS CA C 13 59.357 0.027 A 46 LYS CB C 13 32.823 0.001 A 46 LYS CD C 13 29.473 0.300 A 46 LYS CE C 13 41.977 0.300 A 46 LYS CG C 13 24.610 0.300 A 46 LYS N N 15 116.610 0.008 A 47 ILE H H 1 7.768 0.002 A 47 ILE HA H 1 4.190 0.002 A 47 ILE HB H 1 1.885 0.001 A 47 ILE HD1% H 1 0.752 0.003 A 47 ILE HG1x H 1 1.584 0.004 A 47 ILE HG1y H 1 1.584 0.004 A 47 ILE HG2% H 1 1.027 0.001 A 47 ILE C C 13 178.997 0.042 A 47 ILE CA C 13 64.327 0.017 A 47 ILE CB C 13 38.284 0.054 A 47 ILE CD1 C 13 14.394 0.019 A 47 ILE CG1 C 13 30.634 0.042 A 47 ILE CG2 C 13 18.498 0.008 A 47 ILE N N 15 119.478 0.003 A 48 MET H H 1 8.466 0.002 A 48 MET HA H 1 4.266 0.002 A 48 MET HBx H 1 2.015 0.005 A 48 MET HBy H 1 2.145 0.006 A 48 MET HE% H 1 1.947 0.030 A 48 MET HGx H 1 2.775 0.009 A 48 MET HGy H 1 3.192 0.004 A 48 MET C C 13 177.706 0.031 A 48 MET CA C 13 61.155 0.009 A 48 MET CB C 13 33.023 0.006 A 48 MET CE C 13 18.732 0.300 A 48 MET CG C 13 34.736 0.121 A 48 MET N N 15 122.638 0.012 A 49 GLU H H 1 8.464 0.002 A 49 GLU HA H 1 3.835 0.002 A 49 GLU HBx H 1 1.946 0.030 A 49 GLU HBy H 1 2.005 0.030 A 49 GLU HGx H 1 2.181 0.004 A 49 GLU HGy H 1 2.531 0.002 A 49 GLU C C 13 179.881 0.031 A 49 GLU CA C 13 60.239 0.006 A 49 GLU CB C 13 29.215 0.300 A 49 GLU CG C 13 37.482 0.034 A 49 GLU N N 15 118.310 0.024 A 50 GLU H H 1 7.985 0.002 A 50 GLU HA H 1 4.031 0.007 A 50 GLU HBx H 1 2.017 0.030 A 50 GLU HBy H 1 2.017 0.030 A 50 GLU HGx H 1 2.246 0.003 A 50 GLU HGy H 1 2.467 0.004 A 50 GLU C C 13 177.870 0.045 A 50 GLU CA C 13 59.537 0.002 A 50 GLU CB C 13 29.335 0.300 A 50 GLU CG C 13 36.637 0.068 A 50 GLU N N 15 119.577 0.011 A 51 LYS H H 1 8.069 0.002 A 51 LYS HA H 1 4.041 0.005 A 51 LYS HBx H 1 1.877 0.001 A 51 LYS HBy H 1 2.014 0.001 A 51 LYS HDx H 1 1.025 0.004 A 51 LYS HDy H 1 1.287 0.002 A 51 LYS HEx H 1 2.312 0.002 A 51 LYS HEy H 1 2.367 0.001 A 51 LYS HGx H 1 0.311 0.006 A 51 LYS HGy H 1 1.373 0.002 A 51 LYS C C 13 180.630 0.017 A 51 LYS CA C 13 58.240 0.006 A 51 LYS CB C 13 32.209 0.002 A 51 LYS CD C 13 27.539 0.016 A 51 LYS CE C 13 41.977 0.045 A 51 LYS CG C 13 22.892 0.047 A 51 LYS N N 15 121.567 0.051 A 52 ILE H H 1 8.431 0.002 A 52 ILE HA H 1 3.390 0.002 A 52 ILE HB H 1 1.665 0.003 A 52 ILE HD1% H 1 0.732 0.003 A 52 ILE HG1x H 1 0.546 0.003 A 52 ILE HG1y H 1 1.581 0.006 A 52 ILE HG2% H 1 0.715 0.005 A 52 ILE C C 13 179.235 0.038 A 52 ILE CA C 13 65.051 0.024 A 52 ILE CB C 13 38.597 0.023 A 52 ILE CD1 C 13 14.205 0.013 A 52 ILE CG1 C 13 29.339 0.045 A 52 ILE CG2 C 13 17.471 0.017 A 52 ILE N N 15 122.451 0.028 A 53 GLN H H 1 8.029 0.002 A 53 GLN HA H 1 3.953 0.006 A 53 GLN HBx H 1 2.217 0.012 A 53 GLN HBy H 1 2.217 0.012 A 53 GLN HE2x H 1 6.815 0.030 A 53 GLN HE2y H 1 7.450 0.030 A 53 GLN HGx H 1 2.429 0.009 A 53 GLN HGy H 1 2.429 0.009 A 53 GLN C C 13 178.010 0.026 A 53 GLN CA C 13 59.177 0.025 A 53 GLN CB C 13 28.563 0.066 A 53 GLN CG C 13 33.802 0.001 A 53 GLN N N 15 120.692 0.043 A 53 GLN NE2 N 15 111.699 0.002 A 54 ILE H H 1 8.208 0.003 A 54 ILE HA H 1 4.034 0.002 A 54 ILE HB H 1 1.900 0.001 A 54 ILE HD1% H 1 0.828 0.001 A 54 ILE HG1x H 1 1.316 0.004 A 54 ILE HG1y H 1 1.605 0.003 A 54 ILE HG2% H 1 0.924 0.002 A 54 ILE C C 13 177.737 0.026 A 54 ILE CA C 13 63.052 0.027 A 54 ILE CB C 13 38.813 0.003 A 54 ILE CD1 C 13 13.000 0.006 A 54 ILE CG1 C 13 28.474 0.073 A 54 ILE CG2 C 13 17.375 0.010 A 54 ILE N N 15 115.889 0.011 A 55 SER H H 1 8.499 0.001 A 55 SER HA H 1 4.731 0.002 A 55 SER HBx H 1 3.879 0.005 A 55 SER HBy H 1 3.987 0.008 A 55 SER C C 13 175.645 0.019 A 55 SER CA C 13 59.243 0.032 A 55 SER CB C 13 66.921 0.038 A 55 SER N N 15 114.588 0.008 A 56 GLY H H 1 8.294 0.002 A 56 GLY HAx H 1 3.801 0.001 A 56 GLY HAy H 1 4.358 0.001 A 56 GLY C C 13 173.236 0.027 A 56 GLY CA C 13 45.741 0.027 A 56 GLY N N 15 113.509 0.015 A 57 SER H H 1 7.787 0.003 A 57 SER HA H 1 4.592 0.001 A 57 SER HBx H 1 3.642 0.030 A 57 SER HBy H 1 3.730 0.030 A 57 SER C C 13 171.098 0.026 A 57 SER CA C 13 56.926 0.006 A 57 SER CB C 13 65.622 0.002 A 57 SER N N 15 113.719 0.004 A 58 ASN H H 1 8.314 0.003 A 58 ASN HA H 1 4.535 0.001 A 58 ASN HBx H 1 2.618 0.005 A 58 ASN HBy H 1 2.917 0.006 A 58 ASN HD2y H 1 7.825 0.001 A 58 ASN HD2x H 1 6.953 0.002 A 58 ASN C C 13 176.240 0.038 A 58 ASN CA C 13 50.701 0.013 A 58 ASN CB C 13 39.098 0.037 A 58 ASN N N 15 118.202 0.082 A 58 ASN ND2 N 15 108.917 0.001 A 59 TYR H H 1 9.371 0.030 A 59 TYR HA H 1 3.979 0.002 A 59 TYR HBx H 1 2.471 0.003 A 59 TYR HBy H 1 2.823 0.001 A 59 TYR HDx H 1 7.251 0.030 A 59 TYR HDy H 1 7.251 0.030 A 59 TYR HEx H 1 6.793 0.030 A 59 TYR HEy H 1 6.793 0.030 A 59 TYR C C 13 176.249 0.034 A 59 TYR CA C 13 60.847 0.007 A 59 TYR CB C 13 40.641 0.014 A 59 TYR CEx C 13 118.425 0.300 A 59 TYR CEy C 13 118.425 0.300 A 59 TYR N N 15 119.946 0.002 A 60 LYS H H 1 9.198 0.002 A 60 LYS HA H 1 4.382 0.004 A 60 LYS HBx H 1 1.773 0.001 A 60 LYS HBy H 1 1.945 0.007 A 60 LYS HDx H 1 1.664 0.030 A 60 LYS HDy H 1 1.664 0.030 A 60 LYS HEx H 1 2.979 0.030 A 60 LYS HEy H 1 2.979 0.030 A 60 LYS HGx H 1 1.461 0.005 A 60 LYS HGy H 1 1.461 0.005 A 60 LYS C C 13 176.274 0.037 A 60 LYS CA C 13 55.944 0.300 A 60 LYS CB C 13 34.029 0.045 A 60 LYS CD C 13 28.648 0.003 A 60 LYS CE C 13 42.007 0.003 A 60 LYS CG C 13 24.832 0.300 A 60 LYS N N 15 119.507 0.011 A 61 SER H H 1 7.433 0.002 A 61 SER HA H 1 4.784 0.002 A 61 SER HBx H 1 3.855 0.003 A 61 SER HBy H 1 4.000 0.004 A 61 SER C C 13 174.030 0.023 A 61 SER CA C 13 56.004 0.052 A 61 SER CB C 13 65.031 0.142 A 61 SER N N 15 112.753 0.027 A 62 LEU H H 1 9.080 0.001 A 62 LEU HA H 1 3.992 0.003 A 62 LEU HBx H 1 1.570 0.030 A 62 LEU HBy H 1 1.776 0.004 A 62 LEU HDx% H 1 0.896 0.030 A 62 LEU HDy% H 1 0.927 0.006 A 62 LEU HG H 1 1.544 0.001 A 62 LEU C C 13 177.266 0.022 A 62 LEU CA C 13 57.642 0.016 A 62 LEU CB C 13 42.277 0.016 A 62 LEU CDx C 13 23.963 0.002 A 62 LEU CDy C 13 26.342 0.018 A 62 LEU CG C 13 26.863 0.001 A 62 LEU N N 15 128.464 0.013 A 63 GLU H H 1 8.709 0.002 A 63 GLU HA H 1 3.830 0.002 A 63 GLU HBx H 1 1.983 0.030 A 63 GLU HBy H 1 1.983 0.030 A 63 GLU HGx H 1 2.253 0.001 A 63 GLU HGy H 1 2.341 0.005 A 63 GLU C C 13 179.187 0.024 A 63 GLU CA C 13 60.281 0.026 A 63 GLU CB C 13 29.002 0.001 A 63 GLU CG C 13 36.919 0.009 A 63 GLU N N 15 116.160 0.008 A 64 VAL H H 1 7.150 0.002 A 64 VAL HA H 1 3.761 0.001 A 64 VAL HB H 1 2.273 0.004 A 64 VAL HGx% H 1 1.098 0.007 A 64 VAL HGy% H 1 1.187 0.004 A 64 VAL C C 13 176.810 0.031 A 64 VAL CA C 13 65.569 0.015 A 64 VAL CB C 13 32.102 0.015 A 64 VAL CGy C 13 22.343 0.007 A 64 VAL CGx C 13 22.001 0.003 A 64 VAL N N 15 119.872 0.006 A 65 LEU H H 1 7.067 0.003 A 65 LEU HA H 1 3.006 0.002 A 65 LEU HBx H 1 0.716 0.002 A 65 LEU HBy H 1 1.793 0.004 A 65 LEU HDx% H 1 0.233 0.003 A 65 LEU HDy% H 1 0.502 0.002 A 65 LEU HG H 1 1.003 0.006 A 65 LEU C C 13 177.819 0.031 A 65 LEU CA C 13 58.446 0.018 A 65 LEU CB C 13 41.082 0.054 A 65 LEU CDx C 13 23.906 0.013 A 65 LEU CDy C 13 26.633 0.024 A 65 LEU CG C 13 26.996 0.026 A 65 LEU N N 15 121.773 0.012 A 66 VAL H H 1 8.548 0.002 A 66 VAL HA H 1 3.057 0.001 A 66 VAL HB H 1 1.932 0.001 A 66 VAL HGx% H 1 0.903 0.002 A 66 VAL HGy% H 1 0.937 0.002 A 66 VAL C C 13 177.035 0.029 A 66 VAL CA C 13 66.710 0.009 A 66 VAL CB C 13 31.692 0.009 A 66 VAL CGy C 13 23.548 0.021 A 66 VAL CGx C 13 21.396 0.020 A 66 VAL N N 15 116.430 0.008 A 67 ALA H H 1 7.518 0.003 A 67 ALA HA H 1 4.031 0.002 A 67 ALA HB% H 1 1.479 0.030 A 67 ALA C C 13 180.651 0.026 A 67 ALA CA C 13 55.272 0.002 A 67 ALA CB C 13 17.661 0.002 A 67 ALA N N 15 120.833 0.016 A 68 ASP H H 1 7.885 0.002 A 68 ASP HA H 1 4.463 0.030 A 68 ASP HBx H 1 2.623 0.030 A 68 ASP HBy H 1 2.827 0.030 A 68 ASP C C 13 179.698 0.037 A 68 ASP CA C 13 56.944 0.300 A 68 ASP CB C 13 38.918 0.008 A 68 ASP N N 15 119.003 0.011 A 69 LEU H H 1 8.331 0.003 A 69 LEU HA H 1 3.768 0.002 A 69 LEU HBx H 1 0.734 0.003 A 69 LEU HBy H 1 1.337 0.005 A 69 LEU HDx% H 1 0.039 0.002 A 69 LEU HDy% H 1 0.532 0.003 A 69 LEU HG H 1 1.327 0.001 A 69 LEU C C 13 179.683 0.032 A 69 LEU CA C 13 58.273 0.009 A 69 LEU CB C 13 41.627 0.042 A 69 LEU CDy C 13 25.663 0.003 A 69 LEU CDx C 13 23.684 0.027 A 69 LEU CG C 13 26.626 0.040 A 69 LEU N N 15 124.605 0.037 A 70 VAL H H 1 8.607 0.002 A 70 VAL HA H 1 3.770 0.002 A 70 VAL HB H 1 2.180 0.010 A 70 VAL HGx% H 1 0.992 0.002 A 70 VAL HGy% H 1 1.202 0.001 A 70 VAL C C 13 179.416 0.028 A 70 VAL CA C 13 66.257 0.036 A 70 VAL CB C 13 31.994 0.017 A 70 VAL CGx C 13 21.239 0.039 A 70 VAL CGy C 13 23.206 0.013 A 70 VAL N N 15 120.013 0.021 A 71 ASN H H 1 8.015 0.001 A 71 ASN HA H 1 4.524 0.030 A 71 ASN HBx H 1 2.864 0.001 A 71 ASN HBy H 1 2.864 0.001 A 71 ASN HD2y H 1 7.876 0.001 A 71 ASN HD2x H 1 6.911 0.002 A 71 ASN C C 13 176.926 0.033 A 71 ASN CA C 13 55.721 0.002 A 71 ASN CB C 13 38.584 0.006 A 71 ASN N N 15 118.497 0.035 A 71 ASN ND2 N 15 113.589 0.002 A 72 ALA H H 1 7.879 0.001 A 72 ALA HA H 1 4.245 0.030 A 72 ALA HB% H 1 1.501 0.030 A 72 ALA C C 13 179.149 0.025 A 72 ALA CA C 13 53.965 0.300 A 72 ALA CB C 13 18.507 0.001 A 72 ALA N N 15 121.681 0.020 A 73 GLN H H 1 7.845 0.001 A 73 GLN HA H 1 4.250 0.001 A 73 GLN HBx H 1 2.238 0.002 A 73 GLN HBy H 1 2.238 0.002 A 73 GLN HE2x H 1 6.858 0.030 A 73 GLN HE2y H 1 7.639 0.030 A 73 GLN HGx H 1 2.493 0.002 A 73 GLN HGy H 1 2.649 0.003 A 73 GLN C C 13 177.291 0.021 A 73 GLN CA C 13 56.968 0.010 A 73 GLN CB C 13 28.736 0.006 A 73 GLN CG C 13 34.007 0.016 A 73 GLN N N 15 117.617 0.032 A 73 GLN NE2 N 15 111.464 0.010 A 74 LYS H H 1 7.902 0.001 A 74 LYS HA H 1 4.243 0.006 A 74 LYS HBx H 1 1.899 0.003 A 74 LYS HBy H 1 1.899 0.003 A 74 LYS HDx H 1 1.702 0.003 A 74 LYS HDy H 1 1.702 0.003 A 74 LYS HEx H 1 2.992 0.004 A 74 LYS HEy H 1 2.992 0.004 A 74 LYS HGx H 1 1.475 0.030 A 74 LYS HGy H 1 1.549 0.030 A 74 LYS C C 13 177.334 0.062 A 74 LYS CA C 13 57.594 0.033 A 74 LYS CB C 13 32.714 0.022 A 74 LYS CD C 13 29.014 0.300 A 74 LYS CE C 13 42.003 0.002 A 74 LYS CG C 13 24.793 0.002 A 74 LYS N N 15 120.792 0.011 A 75 ASP H H 1 8.267 0.002 A 75 ASP HA H 1 4.606 0.030 A 75 ASP HBx H 1 2.714 0.030 A 75 ASP HBy H 1 2.714 0.030 A 75 ASP C C 13 176.858 0.037 A 75 ASP CA C 13 55.133 0.300 A 75 ASP CB C 13 41.093 0.300 A 75 ASP N N 15 120.458 0.016 A 76 SER H H 1 8.104 0.001 A 76 SER HA H 1 4.413 0.030 A 76 SER HBx H 1 3.924 0.030 A 76 SER HBy H 1 3.924 0.030 A 76 SER C C 13 174.975 0.300 A 76 SER CA C 13 59.032 0.300 A 76 SER CB C 13 63.794 0.300 A 76 SER N N 15 115.624 0.032 A 77 MET H H 1 8.257 0.002 A 77 MET HA H 1 4.482 0.003 A 77 MET HBx H 1 2.058 0.030 A 77 MET HBy H 1 2.141 0.030 A 77 MET HE% H 1 2.089 0.030 A 77 MET HGx H 1 2.552 0.001 A 77 MET HGy H 1 2.646 0.001 A 77 MET C C 13 176.460 0.006 A 77 MET CA C 13 55.803 0.036 A 77 MET CB C 13 32.590 0.045 A 77 MET CE C 13 16.944 0.300 A 77 MET CG C 13 32.152 0.023 A 77 MET N N 15 121.594 0.006 A 78 GLN H H 1 8.258 0.002 A 78 GLN HA H 1 4.319 0.003 A 78 GLN HBx H 1 2.078 0.030 A 78 GLN HBy H 1 2.078 0.030 A 78 GLN HGx H 1 2.353 0.030 A 78 GLN HGy H 1 2.353 0.030 A 78 GLN C C 13 175.756 0.021 A 78 GLN CA C 13 55.965 0.300 A 78 GLN CB C 13 29.473 0.300 A 78 GLN CG C 13 33.775 0.004 A 78 GLN N N 15 120.840 0.034 A 79 ASP H H 1 8.375 0.001 A 79 ASP HA H 1 4.609 0.030 A 79 ASP HBx H 1 2.710 0.030 A 79 ASP HBy H 1 2.710 0.030 A 79 ASP C C 13 176.703 0.029 A 79 ASP CA C 13 54.389 0.300 A 79 ASP CB C 13 41.335 0.300 A 79 ASP N N 15 121.785 0.034 A 80 GLU H H 1 8.589 0.001 A 80 GLU HA H 1 4.291 0.030 A 80 GLU HBx H 1 1.972 0.030 A 80 GLU HBy H 1 2.109 0.002 A 80 GLU HGx H 1 2.285 0.003 A 80 GLU HGy H 1 2.285 0.003 A 80 GLU C C 13 177.234 0.014 A 80 GLU CA C 13 57.332 0.300 A 80 GLU CB C 13 30.011 0.005 A 80 GLU CG C 13 36.331 0.009 A 80 GLU N N 15 122.478 0.004 A 81 SER H H 1 8.465 0.002 A 81 SER HA H 1 4.415 0.030 A 81 SER HBx H 1 3.920 0.030 A 81 SER HBy H 1 3.920 0.030 A 81 SER C C 13 175.190 0.300 A 81 SER CA C 13 59.282 0.300 A 81 SER CB C 13 63.688 0.300 A 81 SER N N 15 116.548 0.008 A 82 SER H H 1 8.259 0.002 A 82 SER HA H 1 4.466 0.030 A 82 SER HBx H 1 3.917 0.030 A 82 SER HBy H 1 3.917 0.030 A 82 SER C C 13 174.958 0.300 A 82 SER CA C 13 58.956 0.300 A 82 SER CB C 13 63.667 0.300 A 82 SER N N 15 117.544 0.011 A 83 GLN H H 1 8.313 0.001 A 83 GLN HA H 1 4.389 0.002 A 83 GLN HBx H 1 2.013 0.001 A 83 GLN HBy H 1 2.167 0.030 A 83 GLN HGx H 1 2.380 0.002 A 83 GLN HGy H 1 2.380 0.002 A 83 GLN C C 13 176.539 0.031 A 83 GLN CA C 13 56.212 0.010 A 83 GLN CB C 13 29.354 0.300 A 83 GLN CG C 13 33.847 0.001 A 83 GLN N N 15 121.721 0.021 A 84 THR H H 1 8.165 0.003 A 84 THR HA H 1 4.327 0.001 A 84 THR HB H 1 4.241 0.030 A 84 THR HG2% H 1 1.203 0.001 A 84 THR C C 13 174.873 0.030 A 84 THR CA C 13 62.257 0.013 A 84 THR CB C 13 69.755 0.300 A 84 THR CG2 C 13 21.556 0.007 A 84 THR N N 15 114.712 0.027 A 85 SER H H 1 8.307 0.003 A 85 SER HA H 1 4.437 0.030 A 85 SER HBx H 1 3.876 0.030 A 85 SER HBy H 1 3.876 0.030 A 85 SER C C 13 174.811 0.300 A 85 SER CA C 13 58.819 0.300 A 85 SER CB C 13 63.645 0.300 A 85 SER N N 15 118.012 0.056 A 86 LEU H H 1 8.193 0.002 A 86 LEU HA H 1 4.327 0.030 A 86 LEU HBx H 1 1.608 0.030 A 86 LEU HBy H 1 1.608 0.030 A 86 LEU HDx% H 1 0.860 0.030 A 86 LEU HDy% H 1 0.912 0.030 A 86 LEU HG H 1 1.619 0.030 A 86 LEU C C 13 177.508 0.010 A 86 LEU CA C 13 55.687 0.300 A 86 LEU CB C 13 42.340 0.004 A 86 LEU CDx C 13 23.556 0.001 A 86 LEU CDy C 13 24.880 0.001 A 86 LEU CG C 13 27.112 0.016 A 86 LEU N N 15 123.858 0.004 A 87 GLN H H 1 8.247 0.005 A 87 GLN HA H 1 4.253 0.001 A 87 GLN HBx H 1 2.017 0.002 A 87 GLN HBy H 1 2.017 0.002 A 87 GLN HGx H 1 2.358 0.002 A 87 GLN HGy H 1 2.358 0.002 A 87 GLN C C 13 176.135 0.005 A 87 GLN CA C 13 55.998 0.300 A 87 GLN CB C 13 29.348 0.009 A 87 GLN CG C 13 33.908 0.008 A 87 GLN N N 15 120.726 0.012 A 88 LYS H H 1 8.251 0.004 A 88 LYS HA H 1 4.289 0.030 A 88 LYS HBx H 1 1.785 0.030 A 88 LYS HBy H 1 1.785 0.030 A 88 LYS HDx H 1 1.644 0.030 A 88 LYS HDy H 1 1.644 0.030 A 88 LYS HEx H 1 2.979 0.030 A 88 LYS HEy H 1 2.979 0.030 A 88 LYS HGx H 1 1.415 0.030 A 88 LYS HGy H 1 1.415 0.030 A 88 LYS C C 13 176.569 0.300 A 88 LYS CA C 13 56.481 0.300 A 88 LYS CB C 13 33.143 0.300 A 88 LYS CD C 13 28.810 0.300 A 88 LYS CE C 13 41.874 0.300 A 88 LYS CG C 13 24.739 0.300 A 88 LYS N N 15 122.496 0.008 A 89 GLU H H 1 8.422 0.030 A 89 GLU HA H 1 4.246 0.030 A 89 GLU HBx H 1 2.005 0.003 A 89 GLU HBy H 1 2.005 0.003 A 89 GLU HGx H 1 2.245 0.010 A 89 GLU HGy H 1 2.245 0.010 A 89 GLU C C 13 176.537 0.031 A 89 GLU CA C 13 56.712 0.048 A 89 GLU CB C 13 30.252 0.005 A 89 GLU CG C 13 36.474 0.300 A 89 GLU N N 15 122.217 0.018 A 90 ILE H H 1 8.238 0.004 A 90 ILE HA H 1 4.215 0.002 A 90 ILE HB H 1 1.863 0.030 A 90 ILE HD1% H 1 0.820 0.001 A 90 ILE HG1x H 1 1.194 0.001 A 90 ILE HG1y H 1 1.480 0.001 A 90 ILE HG2% H 1 0.913 0.030 A 90 ILE C C 13 176.445 0.041 A 90 ILE CA C 13 61.089 0.078 A 90 ILE CB C 13 38.864 0.300 A 90 ILE CD1 C 13 12.953 0.002 A 90 ILE CG1 C 13 27.249 0.019 A 90 ILE CG2 C 13 17.577 0.004 A 90 ILE N N 15 121.978 0.053 A 91 SER H H 1 8.550 0.001 A 91 SER HA H 1 4.536 0.030 A 91 SER HBx H 1 3.940 0.030 A 91 SER HBy H 1 4.082 0.030 A 91 SER C C 13 175.270 0.017 A 91 SER CA C 13 58.346 0.300 A 91 SER CB C 13 64.428 0.300 A 91 SER N N 15 120.815 0.010 A 92 THR H H 1 8.529 0.002 A 92 THR HA H 1 4.155 0.030 A 92 THR HB H 1 4.266 0.030 A 92 THR HG2% H 1 1.251 0.001 A 92 THR C C 13 175.809 0.038 A 92 THR CA C 13 64.087 0.016 A 92 THR CB C 13 69.337 0.001 A 92 THR CG2 C 13 22.024 0.001 A 92 THR N N 15 117.081 0.038 A 93 GLU H H 1 8.660 0.049 A 93 GLU HA H 1 4.063 0.002 A 93 GLU HBx H 1 2.011 0.001 A 93 GLU HBy H 1 2.011 0.001 A 93 GLU HGx H 1 2.290 0.006 A 93 GLU HGy H 1 2.290 0.006 A 93 GLU C C 13 178.392 0.020 A 93 GLU CA C 13 59.204 0.002 A 93 GLU CB C 13 29.480 0.007 A 93 GLU CG C 13 36.543 0.001 A 93 GLU N N 15 121.497 0.049 A 94 GLU H H 1 8.211 0.002 A 94 GLU HA H 1 4.090 0.003 A 94 GLU HBx H 1 2.077 0.030 A 94 GLU HBy H 1 2.077 0.030 A 94 GLU HGx H 1 2.265 0.002 A 94 GLU HGy H 1 2.265 0.002 A 94 GLU C C 13 178.210 0.036 A 94 GLU CA C 13 58.548 0.009 A 94 GLU CB C 13 29.607 0.300 A 94 GLU CG C 13 36.466 0.002 A 94 GLU N N 15 120.821 0.021 A 95 GLN H H 1 8.218 0.002 A 95 GLN HA H 1 4.053 0.001 A 95 GLN HBx H 1 2.134 0.030 A 95 GLN HBy H 1 2.134 0.030 A 95 GLN HE2x H 1 6.896 0.030 A 95 GLN HE2y H 1 7.386 0.030 A 95 GLN HGx H 1 2.352 0.030 A 95 GLN HGy H 1 2.405 0.030 A 95 GLN C C 13 178.056 0.039 A 95 GLN CA C 13 58.212 0.014 A 95 GLN CB C 13 28.767 0.300 A 95 GLN CG C 13 33.962 0.013 A 95 GLN N N 15 120.086 0.057 A 95 GLN NE2 N 15 111.978 0.009 A 96 LEU H H 1 8.078 0.007 A 96 LEU HA H 1 4.158 0.001 A 96 LEU HBx H 1 1.566 0.030 A 96 LEU HBy H 1 1.759 0.030 A 96 LEU HDx% H 1 0.864 0.030 A 96 LEU HDy% H 1 0.894 0.030 A 96 LEU HG H 1 1.701 0.003 A 96 LEU C C 13 178.895 0.022 A 96 LEU CA C 13 57.025 0.004 A 96 LEU CB C 13 41.845 0.017 A 96 LEU CDx C 13 23.467 0.006 A 96 LEU CDy C 13 24.887 0.002 A 96 LEU CG C 13 27.024 0.003 A 96 LEU N N 15 120.257 0.049 A 97 ARG H H 1 7.968 0.004 A 97 ARG HA H 1 4.156 0.030 A 97 ARG HBx H 1 1.866 0.002 A 97 ARG HBy H 1 1.866 0.002 A 97 ARG HDx H 1 3.193 0.003 A 97 ARG HDy H 1 3.193 0.003 A 97 ARG HGx H 1 1.616 0.002 A 97 ARG HGy H 1 1.616 0.002 A 97 ARG C C 13 177.975 0.049 A 97 ARG CA C 13 58.173 0.300 A 97 ARG CB C 13 30.198 0.002 A 97 ARG CD C 13 43.336 0.001 A 97 ARG CG C 13 27.323 0.006 A 97 ARG N N 15 120.296 0.027 A 98 ARG H H 1 8.031 0.003 A 98 ARG HA H 1 4.142 0.030 A 98 ARG HBx H 1 1.869 0.002 A 98 ARG HBy H 1 1.869 0.002 A 98 ARG HDx H 1 3.175 0.005 A 98 ARG HDy H 1 3.175 0.005 A 98 ARG HGx H 1 1.743 0.030 A 98 ARG HGy H 1 1.743 0.030 A 98 ARG C C 13 177.751 0.020 A 98 ARG CA C 13 57.835 0.300 A 98 ARG CB C 13 30.257 0.002 A 98 ARG CD C 13 43.364 0.027 A 98 ARG CG C 13 27.402 0.300 A 98 ARG N N 15 119.631 0.078 A 99 LEU H H 1 7.928 0.016 A 99 LEU HA H 1 4.217 0.030 A 99 LEU HBx H 1 1.618 0.030 A 99 LEU HBy H 1 1.779 0.030 A 99 LEU HDx% H 1 0.874 0.030 A 99 LEU HDy% H 1 0.919 0.030 A 99 LEU HG H 1 1.716 0.030 A 99 LEU C C 13 178.419 0.020 A 99 LEU CA C 13 56.469 0.300 A 99 LEU CB C 13 42.187 0.008 A 99 LEU CDx C 13 23.462 0.001 A 99 LEU CDy C 13 25.029 0.003 A 99 LEU CG C 13 27.048 0.008 A 99 LEU N N 15 120.641 0.113 A 100 GLN H H 1 7.997 0.013 A 100 GLN HA H 1 4.226 0.004 A 100 GLN HBx H 1 2.101 0.030 A 100 GLN HBy H 1 2.101 0.030 A 100 GLN HGx H 1 2.410 0.004 A 100 GLN HGy H 1 2.410 0.004 A 100 GLN C C 13 176.778 0.012 A 100 GLN CA C 13 56.694 0.300 A 100 GLN CB C 13 29.107 0.300 A 100 GLN CG C 13 33.916 0.004 A 100 GLN N N 15 118.672 0.068 A 101 GLU H H 1 8.128 0.014 A 101 GLU HA H 1 4.222 0.007 A 101 GLU HBx H 1 2.003 0.003 A 101 GLU HBy H 1 2.003 0.003 A 101 GLU HGx H 1 2.326 0.004 A 101 GLU HGy H 1 2.326 0.004 A 101 GLU C C 13 176.818 0.030 A 101 GLU CA C 13 56.994 0.091 A 101 GLU CB C 13 30.267 0.012 A 101 GLU CG C 13 36.447 0.300 A 101 GLU N N 15 120.333 0.047 A 102 GLU H H 1 8.187 0.002 A 102 GLU HA H 1 4.242 0.001 A 102 GLU HBx H 1 2.027 0.030 A 102 GLU HBy H 1 2.027 0.030 A 102 GLU HGx H 1 2.214 0.030 A 102 GLU HGy H 1 2.324 0.005 A 102 GLU C C 13 176.181 0.030 A 102 GLU CA C 13 56.841 0.046 A 102 GLU CB C 13 30.372 0.045 A 102 GLU CG C 13 36.401 0.300 A 102 GLU N N 15 121.032 0.007 A 103 LYS H H 1 8.156 0.001 A 103 LYS HA H 1 4.339 0.030 A 103 LYS HBx H 1 1.851 0.003 A 103 LYS HBy H 1 1.851 0.003 A 103 LYS HDx H 1 1.676 0.003 A 103 LYS HDy H 1 1.676 0.003 A 103 LYS HEx H 1 2.984 0.003 A 103 LYS HEy H 1 2.984 0.003 A 103 LYS HGx H 1 1.439 0.001 A 103 LYS HGy H 1 1.439 0.001 A 103 LYS C C 13 175.478 0.018 A 103 LYS CA C 13 56.093 0.300 A 103 LYS CB C 13 32.858 0.300 A 103 LYS CD C 13 29.017 0.014 A 103 LYS CE C 13 41.962 0.014 A 103 LYS CG C 13 24.743 0.009 A 103 LYS N N 15 122.610 0.021 A 104 LEU H H 1 7.878 0.030 A 104 LEU HA H 1 4.174 0.002 A 104 LEU HBx H 1 1.573 0.002 A 104 LEU HBy H 1 1.573 0.002 A 104 LEU HDx% H 1 0.851 0.004 A 104 LEU HDy% H 1 0.892 0.002 A 104 LEU HG H 1 1.608 0.008 A 104 LEU C C 13 182.560 0.300 A 104 LEU CA C 13 56.776 0.006 A 104 LEU CB C 13 43.385 0.006 A 104 LEU CDx C 13 23.525 0.031 A 104 LEU CDy C 13 25.166 0.002 A 104 LEU CG C 13 27.377 0.002 A 104 LEU N N 15 129.687 0.012 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 41 PHE H A 41 PHE HDx 1.0 . 4.41 2 2 A 41 PHE H A 40 SER HA 1.0 . 3.47 3 3 A 41 PHE H A 41 PHE HBx 1.0 . 4.00 4 4 A 41 PHE H A 41 PHE HBy 1.0 . 3.97 5 5 A 41 PHE H A 35 ILE HD1% 1.0 . 4.44 6 6 A 92 THR H A 92 THR HB 1.0 . 3.78 7 7 A 92 THR HB A 93 GLU H 1.0 . 4.00 8 8 A 93 GLU H A 93 GLU HGx 1.0 . 4.15 9 8 A 93 GLU H A 93 GLU HGy 1.0 . 4.15 10 9 A 93 GLU H A 93 GLU HBx 1.0 . 3.20 11 9 A 93 GLU H A 93 GLU HBy 1.0 . 3.20 12 10 A 94 GLU HA A 95 GLN H 1.0 . 3.49 13 11 A 96 LEU H A 96 LEU HDx% 1.0 . 4.55 14 12 A 96 LEU H A 96 LEU HDy% 1.0 . 4.55 15 13 A 95 GLN H A 95 GLN HGx 1.0 . 4.25 16 14 A 101 GLU H A 101 GLU HGx 1.0 . 4.56 17 14 A 101 GLU H A 101 GLU HGy 1.0 . 4.56 18 15 A 101 GLU H A 100 GLN HA 1.0 . 3.33 19 16 A 97 ARG H A 97 ARG HBx 1.0 . 3.00 20 16 A 97 ARG H A 97 ARG HBy 1.0 . 3.00 21 17 A 98 ARG H A 98 ARG HBx 1.0 . 3.08 22 17 A 98 ARG H A 98 ARG HBy 1.0 . 3.08 23 18 A 61 SER H A 64 VAL HB 1.0 . 4.95 24 19 A 7 ILE HG2% A 8 GLY H 1.0 . 4.50 25 20 A 8 GLY H A 7 ILE HB 1.0 . 4.82 26 21 A 8 GLY H A 7 ILE H 1.0 . 4.28 27 22 A 54 ILE H A 53 GLN HGx 1.0 . 4.31 28 22 A 53 GLN HGy A 54 ILE H 1.0 . 4.31 29 23 A 54 ILE H A 53 GLN HBx 1.0 . 3.45 30 23 A 54 ILE H A 53 GLN HBy 1.0 . 3.45 31 24 A 54 ILE H A 54 ILE HG1x 1.0 . 3.59 32 25 A 54 ILE H A 54 ILE HG1y 1.0 . 3.92 33 26 A 51 LYS H A 52 ILE H 1.0 . 4.66 34 27 A 9 SER H A 10 GLU H 1.0 . 4.41 35 28 A 10 GLU H A 9 SER HBx 1.0 . 4.47 36 28 A 10 GLU H A 9 SER HBy 1.0 . 4.47 37 29 A 11 PHE HA A 12 GLU H 1.0 . 3.29 38 30 A 12 GLU H A 12 GLU HBx 1.0 . 3.42 39 30 A 12 GLU H A 12 GLU HBy 1.0 . 3.42 40 31 A 12 GLU H A 12 GLU HGx 1.0 . 3.98 41 31 A 12 GLU H A 12 GLU HGy 1.0 . 3.98 42 32 A 88 LYS H A 88 LYS HBx 1.0 . 3.23 43 32 A 88 LYS H A 88 LYS HBy 1.0 . 3.23 44 33 A 89 GLU H A 88 LYS HBx 1.0 . 3.48 45 33 A 88 LYS HBy A 89 GLU H 1.0 . 3.48 46 34 A 14 THR H A 13 LYS HBy 1.0 . 4.20 47 35 A 14 THR H A 14 THR HB 1.0 . 3.81 48 36 A 17 LEU H A 17 LEU HBx 1.0 . 3.48 49 36 A 17 LEU H A 17 LEU HBy 1.0 . 3.48 50 37 A 18 THR H A 17 LEU HBx 1.0 . 4.04 51 37 A 17 LEU HBy A 18 THR H 1.0 . 4.04 52 38 A 18 THR H A 16 SER HBx 1.0 . 5.37 53 38 A 18 THR H A 16 SER HBy 1.0 . 5.37 54 39 A 18 THR H A 18 THR HB 1.0 . 3.97 55 40 A 18 THR HB A 19 ARG H 1.0 . 4.35 56 41 A 90 ILE HG2% A 91 SER H 1.0 . 4.09 57 42 A 91 SER H A 90 ILE HB 1.0 . 4.46 58 43 A 91 SER H A 90 ILE HA 1.0 . 3.25 59 44 A 14 THR H A 14 THR HG2% 1.0 . 4.58 60 45 A 92 THR H A 92 THR HG2% 1.0 . 4.93 61 46 A 97 ARG H A 97 ARG HGx 1.0 . 4.07 62 46 A 97 ARG H A 97 ARG HGy 1.0 . 4.07 63 47 A 103 LYS HA A 104 LEU H 1.0 . 3.52 64 48 A 104 LEU H A 104 LEU HBx 1.0 . 3.80 65 48 A 104 LEU H A 104 LEU HBy 1.0 . 3.80 66 49 A 70 VAL H A 71 ASN H 1.0 . 3.67 67 50 A 71 ASN H A 71 ASN HBx 1.0 . 3.09 68 50 A 71 ASN H A 71 ASN HBy 1.0 . 3.09 69 51 A 100 GLN H A 100 GLN HGx 1.0 . 4.07 70 51 A 100 GLN H A 100 GLN HGy 1.0 . 4.07 71 52 A 100 GLN H A 100 GLN HBx 1.0 . 3.23 72 52 A 100 GLN H A 100 GLN HBy 1.0 . 3.23 73 53 A 71 ASN H A 70 VAL HB 1.0 . 4.11 74 54 A 100 GLN H A 99 LEU HBy 1.0 . 4.25 75 55 A 100 GLN H A 99 LEU HBx 1.0 . 4.25 76 56 A 100 GLN H A 99 LEU HDy% 1.0 . 4.70 77 57 A 94 GLU H A 93 GLU HGx 1.0 . 4.64 78 57 A 93 GLU HGy A 94 GLU H 1.0 . 4.64 79 58 A 94 GLU H A 94 GLU HGx 1.0 . 4.86 80 58 A 94 GLU H A 94 GLU HGy 1.0 . 4.86 81 59 A 95 GLN H A 95 GLN HBx 1.0 . 3.21 82 59 A 95 GLN H A 95 GLN HBy 1.0 . 3.21 83 60 A 96 LEU H A 95 GLN HBx 1.0 . 3.55 84 60 A 96 LEU H A 95 GLN HBy 1.0 . 3.55 85 61 A 95 GLN H A 95 GLN HGy 1.0 . 4.25 86 62 A 7 ILE HG2% A 6 ASP H 1.0 . 4.15 87 63 A 48 MET H A 45 LYS HDx 1.0 . 5.50 88 63 A 45 LYS HDy A 48 MET H 1.0 . 5.50 89 64 A 10 GLU H A 11 PHE HBx 1.0 . 5.50 90 65 A 21 ILE HA A 22 ASP H 1.0 . 3.38 91 66 A 22 ASP H A 25 ILE HD1% 1.0 . 4.57 92 67 A 19 ARG H A 18 THR HG2% 1.0 . 4.90 93 68 A 22 ASP H A 21 ILE HB 1.0 . 4.33 94 69 A 24 THR H A 23 ASP HBx 1.0 . 4.02 95 69 A 23 ASP HBy A 24 THR H 1.0 . 4.02 96 70 A 25 ILE H A 25 ILE HB 1.0 . 3.44 97 71 A 26 PHE H A 26 PHE HDy 1.0 . 5.16 98 72 A 26 PHE H A 26 PHE HDx 1.0 . 5.50 99 73 A 27 GLN H A 27 GLN HGx 1.0 . 3.48 100 73 A 27 GLN H A 27 GLN HGy 1.0 . 3.48 101 74 A 27 GLN H A 27 GLN HBy 1.0 . 3.88 102 75 A 27 GLN H A 27 GLN HBx 1.0 . 3.88 103 76 A 27 GLN H A 25 ILE HG2% 1.0 . 4.72 104 77 A 27 GLN H A 24 THR HG2% 1.0 . 5.10 105 78 A 26 PHE HDx A 28 ASN H 1.0 . 5.50 106 79 A 28 ASN H A 27 GLN HBy 1.0 . 4.53 107 80 A 28 ASN H A 27 GLN HBx 1.0 . 4.53 108 81 A 30 MET H A 31 VAL H 1.0 . 3.62 109 82 A 30 MET H A 28 ASN HA 1.0 . 3.78 110 83 A 82 SER H A 82 SER HBx 1.0 . 3.80 111 83 A 82 SER H A 82 SER HBy 1.0 . 3.80 112 84 A 30 MET H A 30 MET HGx 1.0 . 4.00 113 85 A 30 MET H A 29 PRO HGx 1.0 . 3.23 114 86 A 30 MET H A 30 MET HBx 1.0 . 3.49 115 87 A 31 VAL H A 31 VAL HGy% 1.0 . 3.95 116 88 A 31 VAL H A 30 MET HBy 1.0 . 4.03 117 89 A 31 VAL H A 31 VAL HB 1.0 . 3.66 118 90 A 31 VAL H A 28 ASN HD2y 1.0 . 4.71 119 91 A 33 GLU H A 33 GLU HGx 1.0 . 3.93 120 91 A 33 GLU H A 33 GLU HGy 1.0 . 3.93 121 92 A 35 ILE HD1% A 34 ALA H 1.0 . 4.36 122 93 A 7 ILE HG2% A 7 ILE H 1.0 . 3.87 123 94 A 34 ALA H A 35 ILE H 1.0 . 3.59 124 95 A 35 ILE HG2% A 36 ARG H 1.0 . 3.95 125 96 A 19 ARG H A 19 ARG HGx 1.0 . 4.31 126 96 A 19 ARG H A 19 ARG HGy 1.0 . 4.31 127 97 A 36 ARG H A 36 ARG HBx 1.0 . 3.17 128 97 A 36 ARG H A 36 ARG HBy 1.0 . 3.17 129 98 A 19 ARG H A 19 ARG HBx 1.0 . 3.49 130 98 A 19 ARG H A 19 ARG HBy 1.0 . 3.49 131 99 A 36 ARG H A 37 MET HBx 1.0 . 4.80 132 99 A 36 ARG H A 37 MET HBy 1.0 . 4.80 133 100 A 36 ARG H A 36 ARG HDx 1.0 . 4.59 134 100 A 36 ARG H A 36 ARG HDy 1.0 . 4.59 135 101 A 34 ALA HB% A 37 MET H 1.0 . 5.12 136 102 A 37 MET H A 66 VAL HGx% 1.0 . 5.50 137 103 A 37 MET H A 36 ARG HBx 1.0 . 3.73 138 103 A 36 ARG HBy A 37 MET H 1.0 . 3.73 139 104 A 37 MET H A 37 MET HBx 1.0 . 3.43 140 104 A 37 MET HBy A 37 MET H 1.0 . 3.43 141 105 A 37 MET H A 37 MET HGx 1.0 . 3.91 142 106 A 37 MET H A 37 MET HGy 1.0 . 3.91 143 107 A 37 MET H A 34 ALA HA 1.0 . 3.98 144 108 A 37 MET H A 35 ILE HA 1.0 . 5.14 145 109 A 37 MET H A 39 PHE HEx 1.0 . 5.50 146 110 A 37 MET H A 36 ARG HDx 1.0 . 5.50 147 110 A 36 ARG HDy A 37 MET H 1.0 . 5.50 148 111 A 38 GLY H A 36 ARG HBx 1.0 . 4.89 149 111 A 36 ARG HBy A 38 GLY H 1.0 . 4.89 150 112 A 38 GLY H A 39 PHE HBx 1.0 . 4.66 151 113 A 38 GLY H A 37 MET HBx 1.0 . 4.40 152 113 A 37 MET HBy A 38 GLY H 1.0 . 4.40 153 114 A 38 GLY H A 39 PHE HBy 1.0 . 5.50 154 115 A 35 ILE HA A 38 GLY H 1.0 . 4.30 155 116 A 35 ILE H A 38 GLY H 1.0 . 5.45 156 117 A 43 ASP H A 44 ILE HG1y 1.0 . 5.50 157 118 A 97 ARG H A 96 LEU HDx% 1.0 . 4.88 158 119 A 34 ALA HB% A 39 PHE H 1.0 . 4.85 159 120 A 39 PHE HBy A 39 PHE H 1.0 . 3.84 160 121 A 43 ASP H A 46 LYS H 1.0 . 4.93 161 122 A 35 ILE H A 39 PHE H 1.0 . 5.50 162 123 A 40 SER H A 44 ILE H 1.0 . 5.40 163 124 A 40 SER H A 39 PHE HDy 1.0 . 3.95 164 125 A 40 SER H A 39 PHE HEy 1.0 . 5.37 165 126 A 40 SER H A 39 PHE HA 1.0 . 3.09 166 127 A 39 PHE HBy A 40 SER H 1.0 . 3.79 167 128 A 40 SER H A 43 ASP HBy 1.0 . 4.50 168 129 A 40 SER H A 69 LEU HBy 1.0 . 5.50 169 130 A 40 SER H A 69 LEU HDx% 1.0 . 5.50 170 131 A 41 PHE HBy A 42 LYS H 1.0 . 3.89 171 132 A 65 LEU HBy A 66 VAL H 1.0 . 3.13 172 133 A 42 LYS H A 42 LYS HGx 1.0 . 4.63 173 134 A 42 LYS H A 42 LYS HGy 1.0 . 4.63 174 135 A 66 VAL H A 67 ALA HB% 1.0 . 5.14 175 136 A 66 VAL HGx% A 66 VAL H 1.0 . 3.56 176 137 A 66 VAL H A 65 LEU H 1.0 . 3.85 177 138 A 41 PHE H A 43 ASP H 1.0 . 5.24 178 139 A 43 ASP H A 42 LYS H 1.0 . 3.65 179 140 A 43 ASP H A 44 ILE H 1.0 . 3.63 180 141 A 40 SER HA A 43 ASP H 1.0 . 5.02 181 142 A 43 ASP H A 40 SER HBy 1.0 . 4.22 182 143 A 43 ASP H A 44 ILE HA 1.0 . 5.37 183 144 A 43 ASP H A 43 ASP HBx 1.0 . 3.49 184 145 A 39 PHE HBx A 39 PHE H 1.0 . 3.67 185 146 A 43 ASP H A 45 LYS HDx 1.0 . 5.08 186 146 A 45 LYS HDy A 43 ASP H 1.0 . 5.08 187 147 A 43 ASP H A 44 ILE HD1% 1.0 . 4.80 188 148 A 43 ASP H A 69 LEU HDy% 1.0 . 5.07 189 149 A 44 ILE H A 41 PHE HA 1.0 . 4.54 190 150 A 44 ILE H A 44 ILE HB 1.0 . 3.47 191 151 A 45 LYS H A 45 LYS HBy 1.0 . 3.47 192 152 A 44 ILE HB A 45 LYS H 1.0 . 3.78 193 153 A 45 LYS H A 46 LYS HBx 1.0 . 4.57 194 153 A 45 LYS H A 46 LYS HBy 1.0 . 4.57 195 154 A 45 LYS H A 47 ILE H 1.0 . 5.10 196 155 A 47 ILE H A 49 GLU H 1.0 . 5.48 197 156 A 44 ILE H A 45 LYS H 1.0 . 3.98 198 157 A 46 LYS H A 45 LYS HGx 1.0 . 4.52 199 158 A 46 LYS H A 45 LYS HBx 1.0 . 3.90 200 159 A 46 LYS H A 46 LYS HBx 1.0 . 3.02 201 159 A 46 LYS H A 46 LYS HBy 1.0 . 3.02 202 160 A 46 LYS H A 49 GLU HGx 1.0 . 5.50 203 161 A 46 LYS H A 43 ASP HBx 1.0 . 5.50 204 162 A 46 LYS H A 44 ILE HD1% 1.0 . 5.50 205 163 A 46 LYS H A 44 ILE H 1.0 . 4.97 206 164 A 46 LYS H A 45 LYS H 1.0 . 3.74 207 165 A 47 ILE H A 47 ILE HD1% 1.0 . 4.48 208 166 A 69 LEU HDy% A 47 ILE H 1.0 . 4.97 209 167 A 47 ILE H A 48 MET HBx 1.0 . 5.09 210 168 A 48 MET HBx A 50 GLU H 1.0 . 5.50 211 169 A 47 ILE H A 46 LYS HBx 1.0 . 3.29 212 169 A 46 LYS HBy A 47 ILE H 1.0 . 3.29 213 170 A 47 ILE H A 47 ILE HG1x 1.0 . 4.01 214 170 A 47 ILE H A 47 ILE HG1y 1.0 . 4.01 215 171 A 44 ILE HA A 47 ILE H 1.0 . 4.82 216 172 A 46 LYS H A 47 ILE H 1.0 . 3.78 217 173 A 49 GLU H A 50 GLU H 1.0 . 3.69 218 174 A 57 SER H A 58 ASN H 1.0 . 5.50 219 175 A 49 GLU H A 46 LYS HA 1.0 . 4.23 220 176 A 49 GLU H A 48 MET HGx 1.0 . 5.24 221 177 A 49 GLU H A 49 GLU HGx 1.0 . 3.71 222 178 A 45 LYS H A 45 LYS HGx 1.0 . 4.75 223 179 A 44 ILE HD1% A 45 LYS H 1.0 . 4.62 224 180 A 48 MET H A 47 ILE H 1.0 . 3.75 225 181 A 50 GLU H A 49 GLU HGy 1.0 . 3.16 226 182 A 51 LYS H A 50 GLU HBx 1.0 . 3.33 227 182 A 51 LYS H A 50 GLU HBy 1.0 . 3.33 228 183 A 52 ILE H A 51 LYS HBy 1.0 . 3.07 229 184 A 20 ARG H A 19 ARG HGx 1.0 . 3.77 230 184 A 19 ARG HGy A 20 ARG H 1.0 . 3.77 231 185 A 52 ILE H A 52 ILE HG1x 1.0 . 4.02 232 186 A 52 ILE H A 53 GLN HBx 1.0 . 4.41 233 186 A 53 GLN HBy A 52 ILE H 1.0 . 4.41 234 187 A 20 ARG HA A 21 ILE H 1.0 . 3.15 235 188 A 89 GLU H A 88 LYS HA 1.0 . 3.13 236 189 A 52 ILE H A 53 GLN H 1.0 . 3.56 237 190 A 53 GLN H A 53 GLN HGx 1.0 . 4.14 238 190 A 53 GLN HGy A 53 GLN H 1.0 . 4.14 239 191 A 53 GLN H A 53 GLN HBx 1.0 . 3.07 240 191 A 53 GLN HBy A 53 GLN H 1.0 . 3.07 241 192 A 53 GLN H A 52 ILE HB 1.0 . 3.54 242 193 A 53 GLN H A 52 ILE HG2% 1.0 . 3.65 243 194 A 55 SER H A 53 GLN HBx 1.0 . 5.13 244 194 A 53 GLN HBy A 55 SER H 1.0 . 5.13 245 195 A 54 ILE HG1y A 55 SER H 1.0 . 4.82 246 196 A 55 SER H A 51 LYS HGy 1.0 . 5.50 247 197 A 55 SER H A 52 ILE HA 1.0 . 4.73 248 198 A 55 SER H A 51 LYS HA 1.0 . 3.87 249 199 A 55 SER H A 55 SER HBx 1.0 . 3.80 250 200 A 53 GLN H A 55 SER H 1.0 . 4.82 251 201 A 52 ILE HG2% A 56 GLY H 1.0 . 4.65 252 202 A 52 ILE HB A 56 GLY H 1.0 . 5.26 253 203 A 24 THR H A 24 THR HB 1.0 . 3.55 254 204 A 56 GLY H A 57 SER HA 1.0 . 5.50 255 205 A 57 SER H A 52 ILE HG2% 1.0 . 4.36 256 206 A 57 SER H A 55 SER H 1.0 . 4.47 257 207 A 57 SER H A 56 GLY H 1.0 . 3.49 258 208 A 58 ASN H A 57 SER HA 1.0 . 3.24 259 209 A 85 SER H A 85 SER HBx 1.0 . 4.08 260 209 A 85 SER H A 85 SER HBy 1.0 . 4.08 261 210 A 58 ASN H A 58 ASN HBx 1.0 . 3.76 262 211 A 85 SER H A 86 LEU HG 1.0 . 5.50 263 212 A 58 ASN H A 52 ILE HG2% 1.0 . 5.37 264 213 A 59 TYR H A 52 ILE HG1y 1.0 . 5.50 265 214 A 59 TYR H A 51 LYS HGx 1.0 . 5.50 266 215 A 59 TYR H A 59 TYR HBx 1.0 . 3.83 267 216 A 59 TYR H A 59 TYR HBy 1.0 . 3.82 268 217 A 59 TYR H A 59 TYR HDx 1.0 . 3.45 269 218 A 58 ASN H A 59 TYR H 1.0 . 5.50 270 219 A 59 TYR HDy A 60 LYS H 1.0 . 5.50 271 220 A 61 SER H A 59 TYR HBx 1.0 . 4.77 272 221 A 61 SER H A 61 SER HBx 1.0 . 4.18 273 222 A 61 SER H A 62 LEU H 1.0 . 5.50 274 223 A 62 LEU H A 61 SER HBy 1.0 . 4.39 275 224 A 30 MET HGx A 62 LEU H 1.0 . 5.22 276 225 A 62 LEU H A 62 LEU HBy 1.0 . 3.61 277 226 A 62 LEU H A 62 LEU HBx 1.0 . 3.61 278 227 A 61 SER H A 63 GLU H 1.0 . 5.39 279 228 A 63 GLU H A 64 VAL H 1.0 . 3.67 280 229 A 63 GLU H A 61 SER HBy 1.0 . 3.96 281 230 A 16 SER H A 16 SER HBx 1.0 . 3.58 282 230 A 16 SER HBy A 16 SER H 1.0 . 3.58 283 231 A 63 GLU H A 63 GLU HBx 1.0 . 3.16 284 231 A 63 GLU H A 63 GLU HBy 1.0 . 3.16 285 232 A 43 ASP H A 42 LYS HEx 1.0 . 5.50 286 232 A 43 ASP H A 42 LYS HEy 1.0 . 5.50 287 233 A 64 VAL H A 65 LEU HA 1.0 . 5.50 288 234 A 64 VAL H A 63 GLU HBx 1.0 . 3.80 289 234 A 64 VAL H A 63 GLU HBy 1.0 . 3.80 290 235 A 43 ASP H A 42 LYS HGy 1.0 . 5.27 291 236 A 35 ILE HD1% A 43 ASP H 1.0 . 5.50 292 237 A 66 VAL HGx% A 64 VAL H 1.0 . 5.50 293 238 A 65 LEU H A 62 LEU HA 1.0 . 4.16 294 239 A 65 LEU H A 59 TYR HBx 1.0 . 5.50 295 240 A 65 LEU H A 68 ASP HBx 1.0 . 5.50 296 241 A 64 VAL HB A 65 LEU H 1.0 . 3.99 297 242 A 65 LEU HBy A 65 LEU H 1.0 . 3.69 298 243 A 65 LEU H A 66 VAL HGy% 1.0 . 4.29 299 244 A 65 LEU H A 65 LEU HBx 1.0 . 3.76 300 245 A 65 LEU H A 67 ALA H 1.0 . 4.83 301 246 A 74 LYS H A 75 ASP H 1.0 . 4.86 302 247 A 67 ALA H A 64 VAL HA 1.0 . 3.83 303 248 A 68 ASP HBx A 67 ALA H 1.0 . 4.93 304 249 A 67 ALA H A 37 MET HE% 1.0 . 5.50 305 250 A 66 VAL HGy% A 67 ALA H 1.0 . 3.57 306 251 A 66 VAL H A 68 ASP H 1.0 . 4.97 307 252 A 70 VAL H A 68 ASP H 1.0 . 5.36 308 253 A 68 ASP H A 69 LEU H 1.0 . 3.71 309 254 A 64 VAL HA A 68 ASP H 1.0 . 4.49 310 255 A 68 ASP HBx A 68 ASP H 1.0 . 3.49 311 256 A 68 ASP H A 68 ASP HBy 1.0 . 3.77 312 257 A 68 ASP H A 69 LEU HG 1.0 . 4.73 313 258 A 69 LEU H A 70 VAL HGy% 1.0 . 4.43 314 259 A 69 LEU H A 69 LEU HBx 1.0 . 3.83 315 260 A 69 LEU HDx% A 69 LEU H 1.0 . 4.26 316 261 A 5 ALA H A 5 ALA HB% 1.0 . 3.50 317 262 A 69 LEU H A 69 LEU HG 1.0 . 4.00 318 263 A 69 LEU H A 66 VAL HA 1.0 . 4.21 319 264 A 68 ASP HBx A 69 LEU H 1.0 . 4.38 320 265 A 69 LEU H A 68 ASP HBy 1.0 . 4.57 321 266 A 67 ALA H A 69 LEU H 1.0 . 4.88 322 267 A 70 VAL H A 69 LEU HDx% 1.0 . 4.81 323 268 A 70 VAL H A 69 LEU HDy% 1.0 . 4.97 324 269 A 70 VAL H A 69 LEU HBx 1.0 . 4.23 325 270 A 70 VAL H A 66 VAL HA 1.0 . 4.47 326 271 A 70 VAL H A 39 PHE HEy 1.0 . 4.40 327 272 A 70 VAL H A 67 ALA H 1.0 . 5.23 328 273 A 69 LEU HA A 72 ALA H 1.0 . 3.99 329 274 A 44 ILE H A 43 ASP HBx 1.0 . 3.79 330 275 A 72 ALA H A 71 ASN HBx 1.0 . 4.06 331 275 A 71 ASN HBy A 72 ALA H 1.0 . 4.06 332 276 A 71 ASN HA A 73 GLN H 1.0 . 5.13 333 277 A 69 LEU HA A 73 GLN H 1.0 . 4.38 334 278 A 73 GLN H A 73 GLN HGy 1.0 . 3.88 335 279 A 73 GLN H A 73 GLN HGx 1.0 . 3.88 336 280 A 73 GLN H A 73 GLN HBx 1.0 . 3.02 337 280 A 73 GLN H A 73 GLN HBy 1.0 . 3.02 338 281 A 74 LYS H A 74 LYS HBx 1.0 . 2.99 339 281 A 74 LYS H A 74 LYS HBy 1.0 . 2.99 340 282 A 99 LEU H A 98 ARG HBx 1.0 . 3.29 341 282 A 98 ARG HBy A 99 LEU H 1.0 . 3.29 342 283 A 75 ASP H A 75 ASP HBx 1.0 . 3.02 343 283 A 75 ASP H A 75 ASP HBy 1.0 . 3.02 344 284 A 87 GLN H A 87 GLN HBx 1.0 . 3.18 345 284 A 87 GLN H A 87 GLN HBy 1.0 . 3.18 346 285 A 94 GLU H A 93 GLU HBx 1.0 . 3.55 347 285 A 93 GLU HBy A 94 GLU H 1.0 . 3.55 348 286 A 76 SER H A 75 ASP HBx 1.0 . 3.93 349 286 A 75 ASP HBy A 76 SER H 1.0 . 3.93 350 287 A 76 SER H A 76 SER HBx 1.0 . 3.26 351 287 A 76 SER H A 76 SER HBy 1.0 . 3.26 352 288 A 76 SER H A 75 ASP HA 1.0 . 3.53 353 289 A 82 SER HA A 83 GLN H 1.0 . 3.09 354 290 A 79 ASP H A 79 ASP HBx 1.0 . 3.40 355 290 A 79 ASP H A 79 ASP HBy 1.0 . 3.40 356 291 A 79 ASP H A 78 GLN HGx 1.0 . 5.11 357 291 A 79 ASP H A 78 GLN HGy 1.0 . 5.11 358 292 A 83 GLN H A 83 GLN HGx 1.0 . 5.30 359 292 A 83 GLN H A 83 GLN HGy 1.0 . 5.30 360 293 A 79 ASP H A 78 GLN HA 1.0 . 3.03 361 294 A 79 ASP HA A 80 GLU H 1.0 . 3.21 362 295 A 80 GLU H A 79 ASP HBx 1.0 . 4.01 363 295 A 79 ASP HBy A 80 GLU H 1.0 . 4.01 364 296 A 80 GLU H A 80 GLU HGx 1.0 . 4.18 365 296 A 80 GLU H A 80 GLU HGy 1.0 . 4.18 366 297 A 88 LYS H A 87 GLN HBx 1.0 . 3.96 367 297 A 88 LYS H A 87 GLN HBy 1.0 . 3.96 368 298 A 89 GLU H A 89 GLU HBx 1.0 . 4.02 369 298 A 89 GLU H A 89 GLU HBy 1.0 . 4.02 370 299 A 81 SER H A 81 SER HBx 1.0 . 3.69 371 299 A 81 SER H A 81 SER HBy 1.0 . 3.69 372 300 A 40 SER HA A 42 LYS H 1.0 . 4.35 373 301 A 84 THR H A 84 THR HG2% 1.0 . 4.26 374 302 A 86 LEU H A 86 LEU HBx 1.0 . 3.70 375 302 A 86 LEU H A 86 LEU HBy 1.0 . 3.70 376 303 A 86 LEU HG A 86 LEU H 1.0 . 3.97 377 304 A 86 LEU H A 85 SER HBx 1.0 . 4.16 378 304 A 85 SER HBy A 86 LEU H 1.0 . 4.16 379 305 A 88 LYS H A 88 LYS HGx 1.0 . 4.79 380 305 A 88 LYS H A 88 LYS HGy 1.0 . 4.79 381 306 A 89 GLU H A 88 LYS HGx 1.0 . 4.80 382 306 A 89 GLU H A 88 LYS HGy 1.0 . 4.80 383 307 A 89 GLU HA A 90 ILE H 1.0 . 3.32 384 308 A 71 ASN H A 70 VAL HGy% 1.0 . 3.91 385 309 A 96 LEU H A 96 LEU HG 1.0 . 4.38 386 310 A 8 GLY H A 6 ASP HA 1.0 . 4.71 387 311 A 31 VAL HB A 32 GLN H 1.0 . 3.91 388 312 A 32 GLN H A 32 GLN HGy 1.0 . 4.25 389 313 A 32 GLN H A 32 GLN HBx 1.0 . 3.40 390 313 A 32 GLN H A 32 GLN HBy 1.0 . 3.40 391 314 A 32 GLN H A 29 PRO HA 1.0 . 4.22 392 315 A 32 GLN H A 28 ASN HBy 1.0 . 5.50 393 316 A 30 MET H A 32 GLN H 1.0 . 4.98 394 317 A 28 ASN HD2x A 65 LEU HG 1.0 . 5.50 395 318 A 71 ASN HD2y A 71 ASN HBx 1.0 . 3.79 396 318 A 71 ASN HBy A 71 ASN HD2y 1.0 . 3.79 397 319 A 71 ASN HD2x A 71 ASN HBx 1.0 . 3.79 398 319 A 71 ASN HBy A 71 ASN HD2x 1.0 . 3.79 399 320 A 26 PHE H A 23 ASP HA 1.0 . 4.54 400 321 A 44 ILE HG1y A 69 LEU HDx% 1.0 . 4.42 401 322 A 39 PHE HBx A 44 ILE HG1y 1.0 . 4.70 402 323 A 54 ILE H A 54 ILE HB 1.0 . 3.40 403 324 A 14 THR HA A 15 PRO HDx 1.0 . 3.60 404 325 A 14 THR HA A 15 PRO HDy 1.0 . 3.60 405 326 A 86 LEU HA A 86 LEU HDy% 1.0 . 4.68 406 327 A 17 LEU HA A 17 LEU HG 1.0 . 3.97 407 328 A 17 LEU H A 17 LEU HG 1.0 . 4.80 408 329 A 18 THR HA A 17 LEU HBx 1.0 . 4.46 409 329 A 17 LEU HBy A 18 THR HA 1.0 . 4.46 410 330 A 90 ILE HG2% A 91 SER HA 1.0 . 4.00 411 331 A 7 ILE HG2% A 6 ASP HA 1.0 . 4.73 412 332 A 25 ILE HD1% A 22 ASP HA 1.0 . 4.89 413 333 A 61 SER HA A 62 LEU HDx% 1.0 . 5.18 414 334 A 27 GLN H A 24 THR HA 1.0 . 4.53 415 335 A 50 GLU H A 47 ILE HA 1.0 . 4.39 416 336 A 24 THR HB A 48 MET HBy 1.0 . 5.06 417 337 A 27 GLN H A 25 ILE HA 1.0 . 4.70 418 338 A 28 ASN H A 25 ILE HA 1.0 . 4.91 419 339 A 25 ILE HA A 41 PHE HEy 1.0 . 5.20 420 340 A 25 ILE HA A 28 ASN HBx 1.0 . 4.72 421 341 A 25 ILE HA A 25 ILE HG1x 1.0 . 3.85 422 342 A 47 ILE HB A 72 ALA HB% 1.0 . 4.54 423 343 A 25 ILE HB A 41 PHE HEy 1.0 . 4.53 424 344 A 24 THR H A 25 ILE HB 1.0 . 5.06 425 345 A 25 ILE HD1% A 25 ILE HB 1.0 . 3.08 426 346 A 25 ILE H A 25 ILE HG1y 1.0 . 4.17 427 347 A 41 PHE HEy A 25 ILE HG1x 1.0 . 4.67 428 348 A 25 ILE HG2% A 25 ILE HG1x 1.0 . 3.20 429 349 A 25 ILE HG2% A 25 ILE HA 1.0 . 3.19 430 350 A 25 ILE HG2% A 41 PHE HEy 1.0 . 3.11 431 351 A 26 PHE H A 25 ILE HG2% 1.0 . 3.39 432 352 A 25 ILE HG2% A 26 PHE HA 1.0 . 3.49 433 353 A 26 PHE HA A 27 GLN HGx 1.0 . 5.50 434 353 A 27 GLN HGy A 26 PHE HA 1.0 . 5.50 435 354 A 26 PHE HDx A 26 PHE HA 1.0 . 3.78 436 355 A 28 ASN HBy A 31 VAL HGx% 1.0 . 5.16 437 356 A 35 ILE HG2% A 39 PHE HBy 1.0 . 5.50 438 357 A 31 VAL H A 29 PRO HA 1.0 . 4.81 439 358 A 33 GLU H A 29 PRO HA 1.0 . 5.11 440 359 A 28 ASN H A 29 PRO HDy 1.0 . 4.84 441 360 A 28 ASN H A 29 PRO HDx 1.0 . 5.32 442 361 A 28 ASN HA A 29 PRO HDx 1.0 . 3.36 443 362 A 29 PRO HGx A 30 MET HA 1.0 . 4.42 444 363 A 33 GLU HA A 36 ARG HBx 1.0 . 3.20 445 363 A 36 ARG HBy A 33 GLU HA 1.0 . 3.20 446 364 A 33 GLU HA A 33 GLU HGx 1.0 . 3.40 447 364 A 33 GLU HGy A 33 GLU HA 1.0 . 3.40 448 365 A 29 PRO HDx A 30 MET HGy 1.0 . 3.82 449 366 A 28 ASN HD2y A 30 MET HGy 1.0 . 4.88 450 367 A 30 MET HGy A 65 LEU HDx% 1.0 . 4.35 451 368 A 30 MET HGx A 65 LEU HDx% 1.0 . 4.35 452 369 A 34 ALA H A 31 VAL HA 1.0 . 4.40 453 370 A 31 VAL HA A 31 VAL HGx% 1.0 . 3.28 454 371 A 32 GLN H A 31 VAL HGy% 1.0 . 4.11 455 372 A 31 VAL H A 32 GLN HA 1.0 . 5.50 456 373 A 34 ALA H A 32 GLN HA 1.0 . 4.47 457 374 A 35 ILE H A 32 GLN HA 1.0 . 4.53 458 375 A 25 ILE HG2% A 32 GLN HGx 1.0 . 4.76 459 376 A 25 ILE HG2% A 32 GLN HGy 1.0 . 4.76 460 377 A 32 GLN H A 32 GLN HGx 1.0 . 4.25 461 378 A 52 ILE HA A 53 GLN HA 1.0 . 4.81 462 379 A 17 LEU HA A 17 LEU HDy% 1.0 . 4.44 463 380 A 66 VAL HGx% A 34 ALA HA 1.0 . 5.11 464 381 A 49 GLU HGx A 47 ILE HA 1.0 . 5.08 465 382 A 35 ILE HA A 39 PHE H 1.0 . 4.25 466 383 A 36 ARG H A 35 ILE HB 1.0 . 3.91 467 384 A 32 GLN HA A 35 ILE HB 1.0 . 4.15 468 385 A 47 ILE HD1% A 65 LEU HA 1.0 . 3.87 469 386 A 41 PHE HBx A 35 ILE HD1% 1.0 . 4.08 470 387 A 35 ILE HD1% A 32 GLN HA 1.0 . 3.49 471 388 A 35 ILE HD1% A 35 ILE HA 1.0 . 3.72 472 389 A 35 ILE HD1% A 41 PHE HDy 1.0 . 3.08 473 390 A 35 ILE HD1% A 32 GLN H 1.0 . 4.10 474 391 A 35 ILE HD1% A 36 ARG H 1.0 . 4.56 475 392 A 35 ILE HD1% A 44 ILE H 1.0 . 4.92 476 393 A 35 ILE HD1% A 35 ILE H 1.0 . 3.78 477 394 A 41 PHE HDx A 35 ILE HG2% 1.0 . 3.50 478 395 A 35 ILE HG2% A 35 ILE HA 1.0 . 3.21 479 396 A 35 ILE HG2% A 36 ARG HA 1.0 . 3.87 480 397 A 42 LYS HA A 42 LYS HDx 1.0 . 3.93 481 397 A 42 LYS HA A 42 LYS HDy 1.0 . 3.93 482 398 A 50 GLU HA A 50 GLU HGy 1.0 . 3.69 483 399 A 25 ILE HG2% A 32 GLN HBx 1.0 . 5.30 484 399 A 25 ILE HG2% A 32 GLN HBy 1.0 . 5.30 485 400 A 39 PHE HDy A 39 PHE HA 1.0 . 3.78 486 401 A 39 PHE HBx A 44 ILE HG1x 1.0 . 4.80 487 402 A 34 ALA HB% A 39 PHE HBx 1.0 . 4.56 488 403 A 39 PHE HBx A 69 LEU HDy% 1.0 . 4.70 489 404 A 10 GLU H A 11 PHE HBy 1.0 . 5.50 490 405 A 40 SER H A 40 SER HBx 1.0 . 3.49 491 406 A 42 LYS H A 40 SER HBy 1.0 . 4.33 492 407 A 43 ASP HBy A 40 SER HBx 1.0 . 4.48 493 408 A 41 PHE HA A 41 PHE HDy 1.0 . 3.66 494 409 A 46 LYS H A 42 LYS HA 1.0 . 4.31 495 410 A 42 LYS HA A 45 LYS HDx 1.0 . 3.58 496 410 A 45 LYS HDy A 42 LYS HA 1.0 . 3.58 497 411 A 36 ARG HA A 36 ARG HGx 1.0 . 3.25 498 411 A 36 ARG HA A 36 ARG HGy 1.0 . 3.25 499 412 A 42 LYS H A 42 LYS HBx 1.0 . 3.84 500 413 A 42 LYS HEy A 42 LYS HBx 1.0 . 5.43 501 413 A 42 LYS HBx A 42 LYS HEx 1.0 . 5.43 502 414 A 42 LYS HEy A 42 LYS HBy 1.0 . 5.43 503 414 A 42 LYS HBy A 42 LYS HEx 1.0 . 5.43 504 415 A 46 LYS H A 46 LYS HGy 1.0 . 4.82 505 416 A 43 ASP HA A 45 LYS HDx 1.0 . 4.94 506 416 A 45 LYS HDy A 43 ASP HA 1.0 . 4.94 507 417 A 43 ASP HA A 46 LYS HBx 1.0 . 4.04 508 417 A 46 LYS HBy A 43 ASP HA 1.0 . 4.04 509 418 A 65 LEU HBy A 59 TYR HBy 1.0 . 5.31 510 419 A 44 ILE HA A 69 LEU HG 1.0 . 4.33 511 420 A 44 ILE HA A 41 PHE HA 1.0 . 5.48 512 421 A 46 LYS H A 44 ILE HA 1.0 . 4.84 513 422 A 48 MET H A 44 ILE HA 1.0 . 4.62 514 423 A 46 LYS H A 44 ILE HB 1.0 . 5.15 515 424 A 41 PHE HA A 44 ILE HB 1.0 . 4.24 516 425 A 69 LEU HDy% A 44 ILE HB 1.0 . 4.61 517 426 A 34 ALA HB% A 44 ILE HB 1.0 . 4.79 518 427 A 69 LEU HDx% A 44 ILE HD1% 1.0 . 3.87 519 428 A 39 PHE HBx A 44 ILE HD1% 1.0 . 3.52 520 429 A 39 PHE HBy A 44 ILE HD1% 1.0 . 3.46 521 430 A 44 ILE HA A 44 ILE HD1% 1.0 . 3.72 522 431 A 34 ALA HA A 44 ILE HD1% 1.0 . 4.45 523 432 A 44 ILE HD1% A 41 PHE HA 1.0 . 4.71 524 433 A 35 ILE HA A 44 ILE HD1% 1.0 . 3.94 525 434 A 44 ILE H A 44 ILE HD1% 1.0 . 3.61 526 435 A 55 SER H A 54 ILE HG2% 1.0 . 3.78 527 436 A 40 SER H A 44 ILE HD1% 1.0 . 4.16 528 437 A 44 ILE HG2% A 65 LEU HDy% 1.0 . 3.57 529 438 A 44 ILE HA A 44 ILE HG2% 1.0 . 3.11 530 439 A 47 ILE H A 44 ILE HG2% 1.0 . 5.14 531 440 A 48 MET H A 44 ILE HG2% 1.0 . 4.32 532 441 A 25 ILE HA A 45 LYS HA 1.0 . 5.50 533 442 A 45 LYS HA A 48 MET HGy 1.0 . 4.82 534 443 A 44 ILE HB A 45 LYS HBy 1.0 . 4.79 535 444 A 45 LYS HBy A 48 MET HBx 1.0 . 5.39 536 445 A 45 LYS HBx A 48 MET HBx 1.0 . 5.50 537 446 A 46 LYS H A 45 LYS HBy 1.0 . 4.51 538 447 A 46 LYS H A 45 LYS HDx 1.0 . 3.92 539 447 A 45 LYS HDy A 46 LYS H 1.0 . 3.92 540 448 A 46 LYS H A 45 LYS HGy 1.0 . 4.52 541 449 A 45 LYS H A 45 LYS HGy 1.0 . 4.75 542 450 A 42 LYS HEy A 46 LYS HBx 1.0 . 4.76 543 450 A 42 LYS HEx A 46 LYS HBx 1.0 . 4.76 544 450 A 46 LYS HBy A 42 LYS HEx 1.0 . 4.76 545 450 A 46 LYS HBy A 42 LYS HEy 1.0 . 4.76 546 451 A 48 MET HBx A 47 ILE HG2% 1.0 . 3.75 547 452 A 47 ILE HD1% A 47 ILE HA 1.0 . 3.82 548 453 A 47 ILE HA A 47 ILE HG1x 1.0 . 3.26 549 453 A 47 ILE HG1y A 47 ILE HA 1.0 . 3.26 550 454 A 92 THR HA A 95 GLN HBx 1.0 . 3.43 551 454 A 95 GLN HBy A 92 THR HA 1.0 . 3.43 552 455 A 47 ILE H A 47 ILE HB 1.0 . 3.49 553 456 A 35 ILE HB A 41 PHE HEx 1.0 . 4.66 554 457 A 35 ILE H A 35 ILE HB 1.0 . 3.58 555 458 A 52 ILE H A 52 ILE HB 1.0 . 3.58 556 459 A 35 ILE HD1% A 35 ILE HB 1.0 . 3.15 557 460 A 47 ILE HD1% A 68 ASP HBy 1.0 . 3.11 558 461 A 49 GLU HA A 52 ILE HD1% 1.0 . 3.33 559 462 A 35 ILE HD1% A 41 PHE HA 1.0 . 3.21 560 463 A 52 ILE H A 52 ILE HD1% 1.0 . 3.47 561 464 A 48 MET H A 47 ILE HG1x 1.0 . 4.75 562 464 A 48 MET H A 47 ILE HG1y 1.0 . 4.75 563 465 A 48 MET HGy A 47 ILE HG1x 1.0 . 5.30 564 465 A 47 ILE HG1y A 48 MET HGy 1.0 . 5.30 565 466 A 65 LEU HDy% A 47 ILE HG2% 1.0 . 3.09 566 467 A 47 ILE HG2% A 47 ILE HG1x 1.0 . 3.04 567 467 A 47 ILE HG1y A 47 ILE HG2% 1.0 . 3.04 568 468 A 43 ASP HBy A 47 ILE HG2% 1.0 . 4.28 569 469 A 48 MET HGy A 47 ILE HG2% 1.0 . 3.60 570 470 A 44 ILE HA A 47 ILE HG2% 1.0 . 3.45 571 471 A 47 ILE HA A 47 ILE HG2% 1.0 . 3.32 572 472 A 46 LYS H A 47 ILE HG2% 1.0 . 3.88 573 473 A 47 ILE H A 47 ILE HG2% 1.0 . 3.43 574 474 A 44 ILE H A 47 ILE HG2% 1.0 . 4.37 575 475 A 48 MET H A 47 ILE HG2% 1.0 . 3.38 576 476 A 48 MET HA A 59 TYR HEx 1.0 . 3.77 577 477 A 51 LYS HGy A 48 MET HA 1.0 . 4.61 578 478 A 51 LYS HGx A 48 MET HA 1.0 . 4.46 579 479 A 48 MET HA A 47 ILE HG1x 1.0 . 4.38 580 479 A 47 ILE HG1y A 48 MET HA 1.0 . 4.38 581 480 A 48 MET HGy A 48 MET HA 1.0 . 3.79 582 481 A 48 MET HGx A 48 MET HA 1.0 . 4.04 583 482 A 48 MET HBx A 44 ILE HG2% 1.0 . 4.36 584 483 A 89 GLU HA A 88 LYS HBx 1.0 . 4.64 585 483 A 88 LYS HBy A 89 GLU HA 1.0 . 4.64 586 484 A 87 GLN HA A 88 LYS HBx 1.0 . 5.22 587 484 A 88 LYS HBy A 87 GLN HA 1.0 . 5.22 588 485 A 49 GLU H A 48 MET HBx 1.0 . 4.48 589 486 A 48 MET H A 48 MET HGy 1.0 . 4.30 590 487 A 59 TYR HDx A 48 MET HGy 1.0 . 4.97 591 488 A 65 LEU HDy% A 48 MET HGy 1.0 . 4.56 592 489 A 44 ILE HG2% A 48 MET HGy 1.0 . 4.18 593 490 A 66 VAL HGy% A 63 GLU HA 1.0 . 3.39 594 491 A 49 GLU HGx A 49 GLU HA 1.0 . 3.96 595 492 A 53 GLN H A 49 GLU HA 1.0 . 4.83 596 493 A 41 PHE HDx A 35 ILE HG1x 1.0 . 4.61 597 493 A 41 PHE HDx A 35 ILE HG1y 1.0 . 4.61 598 494 A 49 GLU HGy A 49 GLU HA 1.0 . 4.19 599 495 A 49 GLU HGx A 46 LYS HA 1.0 . 4.68 600 496 A 45 LYS HBx A 49 GLU HGx 1.0 . 5.50 601 497 A 52 ILE HA A 58 ASN HA 1.0 . 4.62 602 498 A 35 ILE H A 35 ILE HG1x 1.0 . 3.97 603 498 A 35 ILE H A 35 ILE HG1y 1.0 . 3.97 604 499 A 52 ILE H A 52 ILE HG2% 1.0 . 3.94 605 500 A 7 ILE HG2% A 5 ALA HA 1.0 . 5.17 606 501 A 55 SER HBx A 54 ILE HG2% 1.0 . 3.91 607 502 A 52 ILE HG2% A 53 GLN HBx 1.0 . 4.60 608 502 A 53 GLN HBy A 52 ILE HG2% 1.0 . 4.60 609 503 A 30 MET HGx A 30 MET HA 1.0 . 3.80 610 504 A 52 ILE HB A 53 GLN HA 1.0 . 4.48 611 505 A 52 ILE HG2% A 53 GLN HA 1.0 . 4.12 612 506 A 24 THR HG2% A 25 ILE HA 1.0 . 4.06 613 507 A 54 ILE HG1y A 54 ILE HG2% 1.0 . 3.01 614 508 A 54 ILE HG1x A 54 ILE HA 1.0 . 3.65 615 509 A 54 ILE HG2% A 54 ILE HA 1.0 . 2.84 616 510 A 51 LYS HGy A 58 ASN HA 1.0 . 4.57 617 511 A 58 ASN HA A 48 MET HE% 1.0 . 4.47 618 512 A 59 TYR HDx A 58 ASN HA 1.0 . 4.68 619 513 A 65 LEU HBy A 62 LEU HA 1.0 . 4.01 620 514 A 62 LEU HA A 33 GLU HGx 1.0 . 4.49 621 514 A 33 GLU HGy A 62 LEU HA 1.0 . 4.49 622 515 A 67 ALA H A 63 GLU HA 1.0 . 4.65 623 516 A 64 VAL HA A 64 VAL HGy% 1.0 . 3.28 624 517 A 65 LEU HA A 59 TYR HEx 1.0 . 4.78 625 518 A 65 LEU HA A 59 TYR HEy 1.0 . 5.01 626 519 A 65 LEU HA A 65 LEU HG 1.0 . 3.89 627 520 A 62 LEU HA A 65 LEU HBx 1.0 . 4.55 628 521 A 66 VAL H A 65 LEU HBx 1.0 . 4.48 629 522 A 65 LEU HBy A 65 LEU HDx% 1.0 . 4.11 630 523 A 65 LEU HBy A 66 VAL HGy% 1.0 . 4.54 631 524 A 59 TYR HBy A 65 LEU HDy% 1.0 . 4.71 632 525 A 65 LEU HA A 65 LEU HDy% 1.0 . 3.15 633 526 A 69 LEU HDy% A 47 ILE HA 1.0 . 5.22 634 527 A 39 PHE HEy A 69 LEU HDy% 1.0 . 3.88 635 528 A 68 ASP H A 65 LEU HDy% 1.0 . 4.90 636 529 A 48 MET H A 65 LEU HDy% 1.0 . 4.53 637 530 A 66 VAL H A 65 LEU HDx% 1.0 . 4.30 638 531 A 65 LEU H A 65 LEU HDx% 1.0 . 4.27 639 532 A 62 LEU HA A 65 LEU HDx% 1.0 . 4.03 640 533 A 65 LEU HDx% A 31 VAL HA 1.0 . 4.30 641 534 A 65 LEU HA A 65 LEU HDx% 1.0 . 3.86 642 535 A 65 LEU HDx% A 30 MET HE% 1.0 . 3.22 643 536 A 34 ALA HB% A 65 LEU HDx% 1.0 . 3.43 644 537 A 65 LEU HDx% A 44 ILE HG2% 1.0 . 3.00 645 538 A 65 LEU HG A 30 MET HE% 1.0 . 4.35 646 539 A 31 VAL HA A 44 ILE HG2% 1.0 . 3.21 647 540 A 70 VAL H A 70 VAL HGy% 1.0 . 3.91 648 541 A 70 VAL HGy% A 67 ALA HA 1.0 . 4.27 649 542 A 14 THR HG2% A 15 PRO HDy 1.0 . 4.43 650 543 A 66 VAL HGy% A 66 VAL HA 1.0 . 3.33 651 544 A 66 VAL HGy% A 67 ALA HA 1.0 . 3.90 652 545 A 70 VAL H A 67 ALA HA 1.0 . 4.26 653 546 A 70 VAL H A 67 ALA HB% 1.0 . 5.10 654 547 A 67 ALA HB% A 68 ASP H 1.0 . 3.26 655 548 A 67 ALA HB% A 67 ALA H 1.0 . 2.95 656 549 A 67 ALA HB% A 64 VAL H 1.0 . 4.46 657 550 A 69 LEU HBy A 69 LEU HDx% 1.0 . 3.96 658 551 A 69 LEU HBy A 66 VAL HA 1.0 . 4.17 659 552 A 39 PHE HEy A 69 LEU HBy 1.0 . 4.78 660 553 A 69 LEU HBy A 69 LEU H 1.0 . 4.12 661 554 A 70 VAL H A 69 LEU HBy 1.0 . 4.40 662 555 A 69 LEU HDx% A 66 VAL H 1.0 . 4.30 663 556 A 34 ALA H A 69 LEU HDx% 1.0 . 5.11 664 557 A 69 LEU HDx% A 39 PHE HDx 1.0 . 4.42 665 558 A 39 PHE HDy A 69 LEU HDx% 1.0 . 4.72 666 559 A 39 PHE HEx A 69 LEU HDx% 1.0 . 4.62 667 560 A 39 PHE HEy A 69 LEU HDx% 1.0 . 4.94 668 561 A 34 ALA HB% A 69 LEU HDx% 1.0 . 3.36 669 562 A 69 LEU HDx% A 65 LEU HBy 1.0 . 3.75 670 563 A 39 PHE HBx A 69 LEU HDx% 1.0 . 4.30 671 564 A 69 LEU HDx% A 66 VAL HA 1.0 . 3.46 672 565 A 69 LEU HDx% A 44 ILE HA 1.0 . 4.21 673 566 A 69 LEU HDx% A 69 LEU HA 1.0 . 4.13 674 567 A 66 VAL HGx% A 69 LEU HDx% 1.0 . 3.58 675 568 A 69 LEU HDx% A 65 LEU HDy% 1.0 . 3.19 676 569 A 69 LEU HDy% A 47 ILE HG2% 1.0 . 2.94 677 570 A 69 LEU HBy A 69 LEU HDy% 1.0 . 3.16 678 571 A 65 LEU HDy% A 30 MET HE% 1.0 . 3.84 679 572 A 43 ASP HBy A 69 LEU HDy% 1.0 . 3.34 680 573 A 44 ILE HA A 69 LEU HDy% 1.0 . 3.24 681 574 A 69 LEU HDy% A 69 LEU HA 1.0 . 3.00 682 575 A 66 VAL HGx% A 39 PHE HEx 1.0 . 4.03 683 576 A 66 VAL HGx% A 39 PHE HDx 1.0 . 4.60 684 577 A 39 PHE HDy A 69 LEU HDy% 1.0 . 4.76 685 578 A 100 GLN H A 99 LEU HDx% 1.0 . 4.70 686 579 A 69 LEU HDy% A 69 LEU H 1.0 . 4.17 687 580 A 65 LEU HA A 69 LEU HG 1.0 . 5.42 688 581 A 69 LEU HG A 66 VAL HA 1.0 . 5.50 689 582 A 44 ILE HD1% A 69 LEU HG 1.0 . 4.05 690 583 A 72 ALA HB% A 70 VAL HA 1.0 . 5.43 691 584 A 39 PHE HEy A 70 VAL HA 1.0 . 4.09 692 585 A 70 VAL H A 70 VAL HB 1.0 . 3.62 693 586 A 70 VAL HB A 71 ASN HA 1.0 . 5.50 694 587 A 70 VAL HGy% A 70 VAL HA 1.0 . 3.33 695 588 A 70 VAL HGy% A 74 LYS HEx 1.0 . 3.87 696 588 A 70 VAL HGy% A 74 LYS HEy 1.0 . 3.87 697 589 A 32 GLN H A 31 VAL HGx% 1.0 . 4.11 698 590 A 70 VAL H A 70 VAL HGx% 1.0 . 3.12 699 591 A 69 LEU H A 70 VAL HGx% 1.0 . 4.25 700 592 A 71 ASN H A 70 VAL HGx% 1.0 . 3.79 701 593 A 39 PHE HEy A 70 VAL HGx% 1.0 . 3.09 702 594 A 67 ALA HA A 70 VAL HGx% 1.0 . 3.49 703 595 A 66 VAL HA A 70 VAL HGx% 1.0 . 4.17 704 596 A 70 VAL H A 71 ASN HBx 1.0 . 4.56 705 596 A 70 VAL H A 71 ASN HBy 1.0 . 4.56 706 597 A 69 LEU HA A 71 ASN HBx 1.0 . 5.50 707 597 A 71 ASN HBy A 69 LEU HA 1.0 . 5.50 708 598 A 70 VAL HA A 71 ASN HBx 1.0 . 5.50 709 598 A 71 ASN HBy A 70 VAL HA 1.0 . 5.50 710 599 A 70 VAL HGy% A 71 ASN HBx 1.0 . 4.49 711 599 A 71 ASN HBy A 70 VAL HGy% 1.0 . 4.49 712 600 A 67 ALA HB% A 71 ASN HBx 1.0 . 4.50 713 600 A 71 ASN HBy A 67 ALA HB% 1.0 . 4.50 714 601 A 71 ASN HBy A 74 LYS HBx 1.0 . 4.98 715 601 A 71 ASN HBx A 74 LYS HBx 1.0 . 4.98 716 601 A 74 LYS HBy A 71 ASN HBx 1.0 . 4.98 717 601 A 71 ASN HBy A 74 LYS HBy 1.0 . 4.98 718 602 A 72 ALA H A 72 ALA HB% 1.0 . 2.85 719 603 A 73 GLN H A 72 ALA HB% 1.0 . 3.18 720 604 A 69 LEU HA A 72 ALA HB% 1.0 . 3.41 721 605 A 87 GLN HA A 87 GLN HGx 1.0 . 4.19 722 605 A 87 GLN HA A 87 GLN HGy 1.0 . 4.19 723 606 A 100 GLN HA A 100 GLN HGx 1.0 . 4.18 724 606 A 100 GLN HA A 100 GLN HGy 1.0 . 4.18 725 607 A 75 ASP H A 74 LYS HA 1.0 . 3.51 726 608 A 74 LYS HA A 74 LYS HGy 1.0 . 3.97 727 609 A 104 LEU H A 103 LYS HGx 1.0 . 4.02 728 609 A 104 LEU H A 103 LYS HGy 1.0 . 4.02 729 610 A 77 MET HE% A 77 MET HGx 1.0 . 4.12 730 611 A 77 MET HE% A 77 MET HGy 1.0 . 4.12 731 612 A 5 ALA H A 4 MET HGx 1.0 . 4.85 732 612 A 5 ALA H A 4 MET HGy 1.0 . 4.85 733 613 A 20 ARG H A 19 ARG HA 1.0 . 3.24 734 614 A 60 LYS HA A 60 LYS HDx 1.0 . 4.29 735 614 A 60 LYS HA A 60 LYS HDy 1.0 . 4.29 736 615 A 71 ASN HA A 74 LYS HDx 1.0 . 4.74 737 615 A 71 ASN HA A 74 LYS HDy 1.0 . 4.74 738 616 A 55 SER H A 54 ILE HB 1.0 . 3.68 739 617 A 92 THR HG2% A 92 THR HA 1.0 . 3.79 740 618 A 3 ALA H A 2 SER HBx 1.0 . 3.96 741 618 A 2 SER HBy A 3 ALA H 1.0 . 3.96 742 619 A 46 LYS HA A 45 LYS HDx 1.0 . 3.46 743 619 A 45 LYS HDy A 46 LYS HA 1.0 . 3.46 744 620 A 39 PHE HEy A 69 LEU HA 1.0 . 4.95 745 621 A 51 LYS HA A 54 ILE HG2% 1.0 . 4.53 746 622 A 96 LEU HA A 96 LEU HDx% 1.0 . 4.00 747 623 A 97 ARG H A 96 LEU HG 1.0 . 5.33 748 624 A 100 GLN H A 99 LEU HG 1.0 . 5.50 749 625 A 97 ARG HBy A 97 ARG HDx 1.0 . 4.00 750 625 A 97 ARG HBx A 97 ARG HDx 1.0 . 4.00 751 625 A 97 ARG HDy A 97 ARG HBx 1.0 . 4.00 752 625 A 97 ARG HBy A 97 ARG HDy 1.0 . 4.00 753 626 A 98 ARG H A 97 ARG HBx 1.0 . 3.96 754 626 A 97 ARG HBy A 98 ARG H 1.0 . 3.96 755 627 A 13 LYS HA A 13 LYS HGx 1.0 . 3.72 756 627 A 13 LYS HA A 13 LYS HGy 1.0 . 3.72 757 628 A 88 LYS HA A 88 LYS HGx 1.0 . 4.20 758 628 A 88 LYS HA A 88 LYS HGy 1.0 . 4.20 759 629 A 51 LYS H A 51 LYS HGy 1.0 . 5.01 760 630 A 48 MET HGx A 65 LEU HDy% 1.0 . 4.52 761 631 A 48 MET HGx A 47 ILE HG1x 1.0 . 4.90 762 631 A 47 ILE HG1y A 48 MET HGx 1.0 . 4.90 763 632 A 48 MET HGx A 59 TYR HDx 1.0 . 4.47 764 633 A 48 MET H A 48 MET HGx 1.0 . 4.04 765 634 A 44 ILE HG1y A 44 ILE HA 1.0 . 4.19 766 635 A 44 ILE HG1y A 41 PHE HA 1.0 . 4.95 767 636 A 44 ILE HG1y A 44 ILE H 1.0 . 4.49 768 637 A 52 ILE H A 51 LYS HGy 1.0 . 5.27 769 638 A 51 LYS HGx A 48 MET HE% 1.0 . 4.83 770 639 A 35 ILE HD1% A 39 PHE HBy 1.0 . 4.89 771 640 A 18 THR HG2% A 19 ARG HBx 1.0 . 3.83 772 640 A 18 THR HG2% A 19 ARG HBy 1.0 . 3.83 773 641 A 24 THR HA A 23 ASP HBx 1.0 . 3.98 774 641 A 23 ASP HBy A 24 THR HA 1.0 . 3.98 775 642 A 23 ASP HA A 24 THR HA 1.0 . 5.06 776 643 A 24 THR HB A 27 GLN HGx 1.0 . 5.50 777 643 A 27 GLN HGy A 24 THR HB 1.0 . 5.50 778 644 A 24 THR HG2% A 48 MET HGy 1.0 . 4.23 779 645 A 24 THR HG2% A 48 MET HE% 1.0 . 4.04 780 646 A 25 ILE H A 24 THR HG2% 1.0 . 4.12 781 647 A 25 ILE HB A 27 GLN H 1.0 . 5.50 782 648 A 39 PHE H A 35 ILE HB 1.0 . 5.50 783 649 A 25 ILE HD1% A 41 PHE HEy 1.0 . 3.85 784 650 A 32 GLN H A 25 ILE HG1x 1.0 . 5.50 785 651 A 3 ALA H A 4 MET HA 1.0 . 5.50 786 652 A 70 VAL H A 71 ASN HA 1.0 . 5.50 787 653 A 26 PHE HDx A 27 GLN HA 1.0 . 5.33 788 654 A 28 ASN HD2y A 29 PRO HDx 1.0 . 5.06 789 655 A 28 ASN HD2x A 29 PRO HDx 1.0 . 4.67 790 656 A 59 TYR HBy A 30 MET HE% 1.0 . 3.37 791 657 A 30 MET HE% A 60 LYS HA 1.0 . 4.05 792 658 A 28 ASN HD2x A 30 MET HE% 1.0 . 3.77 793 659 A 30 MET H A 30 MET HE% 1.0 . 4.91 794 660 A 62 LEU H A 30 MET HE% 1.0 . 3.55 795 661 A 63 GLU H A 30 MET HE% 1.0 . 4.58 796 662 A 59 TYR H A 30 MET HE% 1.0 . 4.25 797 663 A 61 SER H A 30 MET HE% 1.0 . 3.75 798 664 A 28 ASN HA A 30 MET HGy 1.0 . 5.44 799 665 A 30 MET HGx A 61 SER HA 1.0 . 4.83 800 666 A 35 ILE H A 31 VAL HA 1.0 . 5.07 801 667 A 31 VAL HB A 28 ASN HD2y 1.0 . 5.36 802 668 A 30 MET H A 31 VAL HB 1.0 . 5.22 803 669 A 32 GLN HA A 41 PHE HZ 1.0 . 5.17 804 670 A 35 ILE HD1% A 34 ALA HB% 1.0 . 3.05 805 671 A 34 ALA HB% A 69 LEU HDy% 1.0 . 3.20 806 672 A 34 ALA HB% A 35 ILE HG1x 1.0 . 3.59 807 672 A 34 ALA HB% A 35 ILE HG1y 1.0 . 3.59 808 673 A 34 ALA HB% A 31 VAL HA 1.0 . 3.49 809 674 A 34 ALA HB% A 39 PHE HBy 1.0 . 3.79 810 675 A 34 ALA HB% A 39 PHE HDx 1.0 . 3.65 811 676 A 35 ILE H A 34 ALA HB% 1.0 . 3.64 812 677 A 34 ALA H A 34 ALA HB% 1.0 . 3.05 813 678 A 35 ILE HD1% A 41 PHE HZ 1.0 . 3.89 814 679 A 41 PHE HA A 35 ILE HG1x 1.0 . 4.72 815 679 A 41 PHE HA A 35 ILE HG1y 1.0 . 4.72 816 680 A 41 PHE HBx A 35 ILE HG2% 1.0 . 3.79 817 681 A 37 MET H A 36 ARG HGx 1.0 . 4.97 818 681 A 37 MET H A 36 ARG HGy 1.0 . 4.97 819 682 A 66 VAL H A 37 MET HE% 1.0 . 4.78 820 683 A 37 MET H A 37 MET HE% 1.0 . 4.52 821 684 A 39 PHE HEx A 37 MET HE% 1.0 . 3.25 822 685 A 37 MET HE% A 39 PHE HDx 1.0 . 3.92 823 686 A 34 ALA HB% A 37 MET HE% 1.0 . 4.18 824 687 A 44 ILE H A 40 SER HBy 1.0 . 5.50 825 688 A 44 ILE H A 40 SER HBx 1.0 . 5.50 826 689 A 41 PHE HBx A 40 SER HBy 1.0 . 5.18 827 690 A 90 ILE HG2% A 91 SER HBx 1.0 . 5.50 828 691 A 90 ILE HG2% A 91 SER HBy 1.0 . 5.50 829 692 A 40 SER HA A 41 PHE HBx 1.0 . 4.73 830 693 A 51 LYS HBy A 58 ASN HA 1.0 . 5.00 831 694 A 35 ILE HA A 35 ILE HG1x 1.0 . 3.74 832 694 A 35 ILE HA A 35 ILE HG1y 1.0 . 3.74 833 695 A 88 LYS HA A 87 GLN HBx 1.0 . 4.19 834 695 A 88 LYS HA A 87 GLN HBy 1.0 . 4.19 835 696 A 46 LYS H A 46 LYS HGx 1.0 . 4.82 836 697 A 44 ILE HA A 43 ASP HBx 1.0 . 4.96 837 698 A 43 ASP HBy A 44 ILE HA 1.0 . 5.06 838 699 A 69 LEU HDx% A 44 ILE HB 1.0 . 5.18 839 700 A 43 ASP HBx A 44 ILE HB 1.0 . 5.50 840 701 A 44 ILE HD1% A 69 LEU HA 1.0 . 5.50 841 702 A 69 LEU HDx% A 44 ILE HG1x 1.0 . 4.69 842 703 A 45 LYS H A 45 LYS HDx 1.0 . 4.83 843 703 A 45 LYS HDy A 45 LYS H 1.0 . 4.83 844 704 A 47 ILE HA A 65 LEU HDy% 1.0 . 5.50 845 705 A 47 ILE HB A 59 TYR HEx 1.0 . 5.06 846 706 A 44 ILE HA A 47 ILE HB 1.0 . 4.61 847 707 A 39 PHE HBx A 35 ILE HB 1.0 . 5.44 848 708 A 43 ASP HBy A 47 ILE HB 1.0 . 5.50 849 709 A 35 ILE HD1% A 41 PHE HEy 1.0 . 5.17 850 710 A 59 TYR HDx A 47 ILE HG1x 1.0 . 4.95 851 710 A 47 ILE HG1y A 59 TYR HDx 1.0 . 4.95 852 711 A 65 LEU HDx% A 48 MET HE% 1.0 . 2.85 853 712 A 65 LEU HDy% A 48 MET HE% 1.0 . 3.04 854 713 A 59 TYR HBy A 48 MET HE% 1.0 . 4.17 855 714 A 48 MET HGx A 48 MET HE% 1.0 . 3.12 856 715 A 59 TYR HBx A 48 MET HE% 1.0 . 2.97 857 716 A 48 MET HA A 48 MET HE% 1.0 . 3.65 858 717 A 28 ASN HD2x A 48 MET HE% 1.0 . 3.54 859 718 A 59 TYR HDx A 48 MET HE% 1.0 . 3.68 860 719 A 59 TYR H A 48 MET HE% 1.0 . 4.10 861 720 A 30 MET H A 48 MET HE% 1.0 . 4.79 862 721 A 81 SER H A 80 GLU HGx 1.0 . 5.09 863 721 A 80 GLU HGy A 81 SER H 1.0 . 5.09 864 722 A 52 ILE H A 51 LYS HGx 1.0 . 4.98 865 723 A 51 LYS H A 51 LYS HGx 1.0 . 4.80 866 724 A 51 LYS HGx A 59 TYR HDx 1.0 . 5.36 867 725 A 51 LYS HGx A 59 TYR HDy 1.0 . 5.50 868 726 A 44 ILE HA A 48 MET HE% 1.0 . 5.50 869 727 A 41 PHE HBx A 35 ILE HG1x 1.0 . 4.76 870 727 A 41 PHE HBx A 35 ILE HG1y 1.0 . 4.76 871 728 A 55 SER HBx A 54 ILE HB 1.0 . 5.23 872 729 A 55 SER HBx A 51 LYS HEy 1.0 . 5.43 873 730 A 52 ILE HG2% A 56 GLY HAx 1.0 . 4.64 874 731 A 51 LYS HGy A 59 TYR HA 1.0 . 4.88 875 732 A 28 ASN HA A 30 MET HBx 1.0 . 5.50 876 733 A 61 SER HA A 60 LYS HBx 1.0 . 5.50 877 734 A 61 SER HA A 60 LYS HBy 1.0 . 5.50 878 735 A 62 LEU HA A 66 VAL HA 1.0 . 5.50 879 736 A 66 VAL H A 62 LEU HA 1.0 . 4.70 880 737 A 64 VAL HB A 65 LEU HA 1.0 . 5.50 881 738 A 59 TYR HBy A 65 LEU HBx 1.0 . 5.16 882 739 A 59 TYR H A 65 LEU HDy% 1.0 . 5.25 883 740 A 34 ALA H A 65 LEU HDx% 1.0 . 4.55 884 741 A 62 LEU H A 65 LEU HDx% 1.0 . 5.34 885 742 A 61 SER H A 65 LEU HDx% 1.0 . 5.50 886 743 A 39 PHE HEy A 69 LEU HG 1.0 . 5.38 887 744 A 65 LEU H A 65 LEU HG 1.0 . 5.26 888 745 A 28 ASN HD2y A 31 VAL HA 1.0 . 5.30 889 746 A 67 ALA HB% A 66 VAL HGy% 1.0 . 3.37 890 747 A 69 LEU H A 67 ALA HA 1.0 . 5.16 891 748 A 34 ALA HA A 66 VAL HA 1.0 . 5.50 892 749 A 66 VAL HA A 67 ALA HA 1.0 . 5.50 893 750 A 68 ASP HBy A 47 ILE HG2% 1.0 . 5.32 894 751 A 68 ASP HBy A 47 ILE HG1x 1.0 . 4.78 895 751 A 47 ILE HG1y A 68 ASP HBy 1.0 . 4.78 896 752 A 69 LEU HG A 69 LEU HA 1.0 . 4.03 897 753 A 51 LYS HA A 53 GLN HBx 1.0 . 5.50 898 753 A 53 GLN HBy A 51 LYS HA 1.0 . 5.50 899 754 A 43 ASP HBy A 69 LEU HA 1.0 . 4.98 900 755 A 39 PHE HEy A 69 LEU HBx 1.0 . 4.44 901 756 A 69 LEU HDx% A 69 LEU HBx 1.0 . 3.96 902 757 A 69 LEU HBx A 66 VAL HA 1.0 . 4.23 903 758 A 69 LEU HBy A 72 ALA H 1.0 . 5.50 904 759 A 39 PHE HA A 69 LEU HDx% 1.0 . 5.48 905 760 A 69 LEU HDy% A 43 ASP HA 1.0 . 4.30 906 761 A 40 SER H A 69 LEU HDy% 1.0 . 4.95 907 762 A 70 VAL H A 69 LEU HG 1.0 . 5.22 908 763 A 73 GLN H A 70 VAL HA 1.0 . 4.07 909 764 A 66 VAL HGy% A 39 PHE HZ 1.0 . 4.93 910 765 A 70 VAL HGy% A 39 PHE HZ 1.0 . 5.50 911 766 A 14 THR HG2% A 42 LYS HEx 1.0 . 3.54 912 766 A 14 THR HG2% A 42 LYS HEy 1.0 . 3.54 913 767 A 67 ALA H A 70 VAL HGx% 1.0 . 5.50 914 768 A 47 ILE HD1% A 72 ALA HA 1.0 . 5.27 915 769 A 69 LEU H A 72 ALA HB% 1.0 . 4.71 916 770 A 39 PHE HEx A 37 MET HBx 1.0 . 5.26 917 770 A 37 MET HBy A 39 PHE HEx 1.0 . 5.26 918 771 A 66 VAL HGy% A 37 MET HBx 1.0 . 5.50 919 771 A 37 MET HBy A 66 VAL HGy% 1.0 . 5.50 920 772 A 43 ASP H A 42 LYS HGx 1.0 . 5.27 921 773 A 3 ALA HB% A 4 MET HGx 1.0 . 5.04 922 773 A 4 MET HGy A 3 ALA HB% 1.0 . 5.04 923 774 A 99 LEU HG A 99 LEU HA 1.0 . 4.13 924 775 A 28 ASN HBy A 25 ILE HA 1.0 . 4.84 925 776 A 20 ARG H A 19 ARG HBx 1.0 . 4.46 926 776 A 19 ARG HBy A 20 ARG H 1.0 . 4.46 927 777 A 25 ILE H A 23 ASP HA 1.0 . 4.46 928 778 A 24 THR HB A 23 ASP H 1.0 . 5.07 929 779 A 52 ILE H A 51 LYS HBx 1.0 . 5.08 930 780 A 14 THR H A 13 LYS HBx 1.0 . 4.20 931 781 A 14 THR H A 13 LYS HA 1.0 . 3.22 932 782 A 63 GLU H A 61 SER HA 1.0 . 4.55 933 783 A 17 LEU H A 16 SER HA 1.0 . 3.45 934 784 A 18 THR H A 18 THR HG2% 1.0 . 4.41 935 785 A 36 ARG H A 36 ARG HGx 1.0 . 4.09 936 785 A 36 ARG H A 36 ARG HGy 1.0 . 4.09 937 786 A 19 ARG H A 18 THR HA 1.0 . 3.46 938 787 A 52 ILE H A 52 ILE HG1y 1.0 . 4.02 939 788 A 90 ILE HG2% A 90 ILE H 1.0 . 4.08 940 789 A 13 LYS H A 13 LYS HGx 1.0 . 5.08 941 789 A 13 LYS HGy A 13 LYS H 1.0 . 5.08 942 790 A 21 ILE H A 20 ARG HGx 1.0 . 4.61 943 790 A 21 ILE H A 20 ARG HGy 1.0 . 4.61 944 791 A 89 GLU H A 88 LYS HDx 1.0 . 4.70 945 791 A 89 GLU H A 88 LYS HDy 1.0 . 4.70 946 792 A 22 ASP H A 22 ASP HBx 1.0 . 3.60 947 792 A 22 ASP H A 22 ASP HBy 1.0 . 3.60 948 793 A 22 ASP H A 21 ILE HD1% 1.0 . 4.67 949 794 A 22 ASP HA A 23 ASP H 1.0 . 3.39 950 795 A 23 ASP H A 23 ASP HBx 1.0 . 2.99 951 795 A 23 ASP HBy A 23 ASP H 1.0 . 2.99 952 796 A 4 MET H A 4 MET HGx 1.0 . 4.45 953 796 A 4 MET HGy A 4 MET H 1.0 . 4.45 954 797 A 49 GLU HGx A 50 GLU H 1.0 . 4.71 955 798 A 24 THR H A 24 THR HG2% 1.0 . 3.92 956 799 A 24 THR H A 22 ASP HA 1.0 . 4.68 957 800 A 25 ILE H A 25 ILE HG2% 1.0 . 4.36 958 801 A 65 LEU HA A 68 ASP H 1.0 . 3.93 959 802 A 26 PHE H A 24 THR HB 1.0 . 5.44 960 803 A 27 GLN H A 28 ASN HBx 1.0 . 4.57 961 804 A 30 MET H A 30 MET HGy 1.0 . 4.20 962 805 A 30 MET H A 29 PRO HDx 1.0 . 3.83 963 806 A 32 GLN H A 25 ILE HA 1.0 . 5.25 964 807 A 25 ILE HB A 26 PHE H 1.0 . 3.50 965 808 A 33 GLU H A 32 GLN HBx 1.0 . 3.95 966 808 A 33 GLU H A 32 GLN HBy 1.0 . 3.95 967 809 A 33 GLU H A 33 GLU HBx 1.0 . 4.08 968 809 A 33 GLU H A 33 GLU HBy 1.0 . 4.08 969 810 A 13 LYS H A 12 GLU HBx 1.0 . 4.37 970 810 A 12 GLU HBy A 13 LYS H 1.0 . 4.37 971 811 A 34 ALA H A 33 GLU HBx 1.0 . 4.64 972 811 A 34 ALA H A 33 GLU HBy 1.0 . 4.64 973 812 A 34 ALA H A 33 GLU HGx 1.0 . 4.33 974 812 A 33 GLU HGy A 34 ALA H 1.0 . 4.33 975 813 A 35 ILE H A 37 MET H 1.0 . 4.49 976 814 A 7 ILE HB A 7 ILE H 1.0 . 4.08 977 815 A 91 SER H A 90 ILE HG1x 1.0 . 5.29 978 816 A 36 ARG H A 32 GLN HA 1.0 . 4.76 979 817 A 38 GLY H A 39 PHE HA 1.0 . 5.05 980 818 A 97 ARG H A 96 LEU HDy% 1.0 . 4.88 981 819 A 39 PHE H A 40 SER H 1.0 . 5.05 982 820 A 40 SER H A 40 SER HBy 1.0 . 3.84 983 821 A 40 SER H A 43 ASP HBx 1.0 . 4.18 984 822 A 39 PHE HBx A 40 SER H 1.0 . 4.02 985 823 A 40 SER H A 44 ILE HG1x 1.0 . 5.18 986 824 A 66 VAL H A 66 VAL HGy% 1.0 . 3.46 987 825 A 41 PHE HBx A 42 LYS H 1.0 . 4.10 988 826 A 66 VAL H A 64 VAL H 1.0 . 4.72 989 827 A 41 PHE H A 42 LYS H 1.0 . 4.06 990 828 A 43 ASP H A 40 SER HBx 1.0 . 4.35 991 829 A 43 ASP H A 43 ASP HBy 1.0 . 3.97 992 830 A 43 ASP H A 44 ILE HG1x 1.0 . 4.67 993 831 A 44 ILE H A 44 ILE HG2% 1.0 . 4.81 994 832 A 44 ILE H A 44 ILE HG1x 1.0 . 3.67 995 833 A 44 ILE H A 42 LYS H 1.0 . 4.50 996 834 A 45 LYS H A 45 LYS HBx 1.0 . 3.76 997 835 A 46 LYS H A 42 LYS HDx 1.0 . 4.99 998 835 A 46 LYS H A 42 LYS HDy 1.0 . 4.99 999 836 A 46 LYS H A 46 LYS HDx 1.0 . 5.50 1000 836 A 46 LYS H A 46 LYS HDy 1.0 . 5.50 1001 837 A 46 LYS H A 43 ASP HA 1.0 . 4.04 1002 838 A 47 ILE H A 43 ASP HA 1.0 . 4.56 1003 839 A 48 MET H A 47 ILE HD1% 1.0 . 5.06 1004 840 A 48 MET H A 46 LYS HBx 1.0 . 4.86 1005 840 A 48 MET H A 46 LYS HBy 1.0 . 4.86 1006 841 A 10 GLU H A 10 GLU HGy 1.0 . 4.10 1007 842 A 49 GLU H A 52 ILE HD1% 1.0 . 4.78 1008 843 A 58 ASN H A 52 ILE HD1% 1.0 . 5.02 1009 844 A 49 GLU H A 50 GLU HA 1.0 . 5.50 1010 845 A 41 PHE HA A 45 LYS H 1.0 . 4.33 1011 846 A 50 GLU H A 50 GLU HBx 1.0 . 3.91 1012 846 A 50 GLU H A 50 GLU HBy 1.0 . 3.91 1013 847 A 51 LYS H A 51 LYS HBy 1.0 . 3.89 1014 848 A 20 ARG H A 20 ARG HGx 1.0 . 4.31 1015 848 A 20 ARG H A 20 ARG HGy 1.0 . 4.31 1016 849 A 54 ILE HG1x A 55 SER H 1.0 . 4.37 1017 850 A 55 SER H A 55 SER HBy 1.0 . 3.84 1018 851 A 56 GLY H A 55 SER HBy 1.0 . 4.39 1019 852 A 52 ILE HA A 56 GLY H 1.0 . 4.11 1020 853 A 56 GLY H A 54 ILE HB 1.0 . 5.14 1021 854 A 57 SER H A 51 LYS HGy 1.0 . 4.99 1022 855 A 57 SER H A 52 ILE HA 1.0 . 3.52 1023 856 A 57 SER H A 55 SER HBy 1.0 . 4.21 1024 857 A 28 ASN HA A 28 ASN HD2y 1.0 . 4.30 1025 858 A 58 ASN H A 58 ASN HBy 1.0 . 3.76 1026 859 A 51 LYS HGy A 59 TYR H 1.0 . 4.96 1027 860 A 51 LYS HBy A 59 TYR H 1.0 . 5.50 1028 861 A 59 TYR H A 48 MET HA 1.0 . 5.19 1029 862 A 61 SER H A 61 SER HBy 1.0 . 4.18 1030 863 A 61 SER H A 60 LYS H 1.0 . 4.35 1031 864 A 62 LEU H A 61 SER HA 1.0 . 3.43 1032 865 A 62 LEU H A 61 SER HBx 1.0 . 4.39 1033 866 A 62 LEU H A 62 LEU HG 1.0 . 4.31 1034 867 A 42 LYS H A 42 LYS HBy 1.0 . 3.84 1035 868 A 63 GLU H A 61 SER HBx 1.0 . 3.96 1036 869 A 64 VAL HB A 64 VAL H 1.0 . 3.41 1037 870 A 65 LEU H A 65 LEU HDy% 1.0 . 4.60 1038 871 A 66 VAL H A 67 ALA H 1.0 . 3.63 1039 872 A 9 SER H A 10 GLU HA 1.0 . 4.88 1040 873 A 25 ILE H A 23 ASP HBx 1.0 . 4.75 1041 873 A 23 ASP HBy A 25 ILE H 1.0 . 4.75 1042 874 A 10 GLU H A 10 GLU HGx 1.0 . 4.10 1043 875 A 88 LYS H A 87 GLN HGx 1.0 . 4.26 1044 875 A 88 LYS H A 87 GLN HGy 1.0 . 4.26 1045 876 A 35 ILE H A 37 MET HBx 1.0 . 5.50 1046 876 A 35 ILE H A 37 MET HBy 1.0 . 5.50 1047 877 A 91 SER H A 90 ILE HG1y 1.0 . 5.29 1048 878 A 66 VAL H A 66 VAL HB 1.0 . 3.75 1049 879 A 43 ASP H A 40 SER H 1.0 . 4.71 1050 880 A 54 ILE H A 54 ILE HG2% 1.0 . 3.79 1051 881 A 60 LYS H A 60 LYS HGx 1.0 . 5.50 1052 881 A 60 LYS H A 60 LYS HGy 1.0 . 5.50 1053 882 A 59 TYR HBx A 60 LYS H 1.0 . 5.50 1054 883 A 60 LYS H A 61 SER HA 1.0 . 5.13 1055 884 A 25 ILE H A 24 THR HB 1.0 . 3.48 1056 885 A 56 GLY H A 54 ILE HG2% 1.0 . 5.50 1057 886 A 31 VAL H A 30 MET HBx 1.0 . 5.34 1058 887 A 31 VAL H A 28 ASN HBy 1.0 . 5.08 1059 888 A 34 ALA HB% A 40 SER H 1.0 . 5.41 1060 889 A 41 PHE H A 35 ILE HG1x 1.0 . 5.18 1061 889 A 41 PHE H A 35 ILE HG1y 1.0 . 5.18 1062 890 A 41 PHE H A 40 SER HBy 1.0 . 5.32 1063 891 A 59 TYR H A 59 TYR HEx 1.0 . 5.07 1064 892 A 62 LEU H A 64 VAL H 1.0 . 5.07 1065 893 A 65 LEU H A 63 GLU H 1.0 . 5.09 1066 894 A 75 ASP H A 74 LYS HBx 1.0 . 3.63 1067 894 A 75 ASP H A 74 LYS HBy 1.0 . 3.63 1068 895 A 59 TYR H A 52 ILE HD1% 1.0 . 5.27 1069 896 A 59 TYR H A 52 ILE HG1x 1.0 . 5.50 1070 897 A 59 TYR H A 65 LEU HDx% 1.0 . 5.50 1071 898 A 61 SER H A 65 LEU HG 1.0 . 5.50 1072 899 A 28 ASN HA A 28 ASN HD2x 1.0 . 4.81 1073 900 A 28 ASN HD2x A 30 MET HA 1.0 . 5.50 1074 901 A 67 ALA H A 66 VAL HB 1.0 . 3.85 1075 902 A 95 GLN H A 94 GLU HBx 1.0 . 3.70 1076 902 A 95 GLN H A 94 GLU HBy 1.0 . 3.70 1077 903 A 101 GLU H A 100 GLN HBx 1.0 . 4.04 1078 903 A 101 GLU H A 100 GLN HBy 1.0 . 4.04 1079 904 A 34 ALA HB% A 44 ILE HG1y 1.0 . 4.62 1080 905 A 74 LYS HA A 75 ASP HBx 1.0 . 5.32 1081 905 A 75 ASP HBy A 74 LYS HA 1.0 . 5.32 1082 906 A 51 LYS HA A 54 ILE HB 1.0 . 3.36 1083 907 A 11 PHE HA A 11 PHE HDx 1.0 . 4.64 1084 908 A 11 PHE HA A 11 PHE HDy 1.0 . 4.88 1085 909 A 39 PHE HBy A 44 ILE HG1x 1.0 . 4.50 1086 910 A 14 THR HB A 42 LYS HDx 1.0 . 4.52 1087 910 A 14 THR HB A 42 LYS HDy 1.0 . 4.52 1088 911 A 14 THR HG2% A 14 THR HA 1.0 . 3.32 1089 912 A 31 VAL H A 31 VAL HGx% 1.0 . 3.95 1090 913 A 64 VAL HB A 59 TYR HDy 1.0 . 4.32 1091 914 A 59 TYR HEx A 51 LYS HBx 1.0 . 5.03 1092 915 A 14 THR HG2% A 15 PRO HDx 1.0 . 4.43 1093 916 A 17 LEU HA A 17 LEU HDx% 1.0 . 4.44 1094 917 A 86 LEU HA A 86 LEU HDx% 1.0 . 4.68 1095 918 A 17 LEU HA A 17 LEU HBx 1.0 . 2.96 1096 918 A 17 LEU HBy A 17 LEU HA 1.0 . 2.96 1097 919 A 60 LYS HA A 60 LYS HGx 1.0 . 3.66 1098 919 A 60 LYS HA A 60 LYS HGy 1.0 . 3.66 1099 920 A 19 ARG HA A 19 ARG HGx 1.0 . 3.37 1100 920 A 19 ARG HGy A 19 ARG HA 1.0 . 3.37 1101 921 A 18 THR HG2% A 18 THR HA 1.0 . 3.29 1102 922 A 18 THR HA A 19 ARG HGx 1.0 . 5.33 1103 922 A 19 ARG HGy A 18 THR HA 1.0 . 5.33 1104 923 A 18 THR HA A 19 ARG HBx 1.0 . 4.62 1105 923 A 19 ARG HBy A 18 THR HA 1.0 . 4.62 1106 924 A 51 LYS HBy A 48 MET HA 1.0 . 4.16 1107 925 A 21 ILE HA A 21 ILE HG2% 1.0 . 3.30 1108 926 A 61 SER HA A 62 LEU HDy% 1.0 . 5.18 1109 927 A 26 PHE HDy A 23 ASP HA 1.0 . 5.49 1110 928 A 24 THR HG2% A 24 THR HA 1.0 . 3.22 1111 929 A 25 ILE HD1% A 24 THR HB 1.0 . 5.18 1112 930 A 84 THR HG2% A 84 THR HA 1.0 . 2.70 1113 931 A 25 ILE HA A 41 PHE HDy 1.0 . 5.50 1114 932 A 25 ILE HA A 25 ILE HG1y 1.0 . 3.93 1115 933 A 25 ILE HB A 22 ASP HA 1.0 . 5.50 1116 934 A 25 ILE HB A 23 ASP HA 1.0 . 5.42 1117 935 A 47 ILE HB A 46 LYS HEx 1.0 . 5.17 1118 935 A 47 ILE HB A 46 LYS HEy 1.0 . 5.17 1119 936 A 25 ILE HD1% A 25 ILE HA 1.0 . 3.95 1120 937 A 25 ILE HD1% A 41 PHE HDy 1.0 . 3.62 1121 938 A 25 ILE HG1x A 41 PHE HDy 1.0 . 5.31 1122 939 A 41 PHE HBy A 25 ILE HG1x 1.0 . 4.91 1123 940 A 25 ILE HG2% A 25 ILE HG1y 1.0 . 3.33 1124 941 A 34 ALA HA A 33 GLU HGx 1.0 . 3.33 1125 941 A 33 GLU HGy A 34 ALA HA 1.0 . 3.33 1126 942 A 28 ASN HA A 29 PRO HDy 1.0 . 3.67 1127 943 A 28 ASN HA A 27 GLN HGx 1.0 . 5.50 1128 943 A 27 GLN HGy A 28 ASN HA 1.0 . 5.50 1129 944 A 28 ASN HBy A 31 VAL HGy% 1.0 . 5.16 1130 945 A 98 ARG HA A 98 ARG HGx 1.0 . 3.81 1131 945 A 98 ARG HA A 98 ARG HGy 1.0 . 3.81 1132 946 A 28 ASN HA A 29 PRO HGy 1.0 . 4.69 1133 947 A 28 ASN HA A 29 PRO HGx 1.0 . 4.98 1134 948 A 33 GLU HA A 36 ARG HDx 1.0 . 4.25 1135 948 A 36 ARG HDy A 33 GLU HA 1.0 . 4.25 1136 949 A 93 GLU HA A 93 GLU HGx 1.0 . 3.35 1137 949 A 93 GLU HGy A 93 GLU HA 1.0 . 3.35 1138 950 A 30 MET HGx A 62 LEU HG 1.0 . 5.00 1139 951 A 25 ILE HA A 31 VAL HA 1.0 . 5.40 1140 952 A 31 VAL HA A 31 VAL HGy% 1.0 . 3.28 1141 953 A 25 ILE HG2% A 32 GLN HA 1.0 . 4.98 1142 954 A 34 ALA HA A 39 PHE HDx 1.0 . 4.14 1143 955 A 34 ALA HA A 37 MET HBx 1.0 . 3.82 1144 955 A 37 MET HBy A 34 ALA HA 1.0 . 3.82 1145 956 A 47 ILE HD1% A 59 TYR HEx 1.0 . 4.85 1146 957 A 35 ILE HD1% A 31 VAL HA 1.0 . 3.99 1147 958 A 41 PHE HBy A 35 ILE HD1% 1.0 . 4.01 1148 959 A 47 ILE HD1% A 47 ILE HB 1.0 . 2.99 1149 960 A 54 ILE HG1x A 50 GLU HA 1.0 . 3.70 1150 961 A 50 GLU HA A 50 GLU HGx 1.0 . 3.69 1151 962 A 36 ARG HA A 36 ARG HDx 1.0 . 4.38 1152 962 A 36 ARG HDy A 36 ARG HA 1.0 . 4.38 1153 963 A 36 ARG HBx A 36 ARG HDx 1.0 . 3.04 1154 963 A 36 ARG HBy A 36 ARG HDx 1.0 . 3.04 1155 963 A 36 ARG HDy A 36 ARG HBx 1.0 . 3.04 1156 963 A 36 ARG HBy A 36 ARG HDy 1.0 . 3.04 1157 964 A 41 PHE HEx A 32 GLN HBx 1.0 . 5.50 1158 964 A 32 GLN HBy A 41 PHE HEx 1.0 . 5.50 1159 965 A 37 MET HGx A 36 ARG HBx 1.0 . 5.00 1160 965 A 36 ARG HBy A 37 MET HGx 1.0 . 5.00 1161 966 A 36 ARG HBx A 37 MET HGy 1.0 . 5.00 1162 966 A 36 ARG HBy A 37 MET HGy 1.0 . 5.00 1163 967 A 91 SER HA A 92 THR HA 1.0 . 5.37 1164 968 A 43 ASP HBx A 40 SER HBx 1.0 . 4.79 1165 969 A 46 LYS HDx A 46 LYS HEx 1.0 . 2.97 1166 969 A 46 LYS HDy A 46 LYS HEx 1.0 . 2.97 1167 969 A 46 LYS HEy A 46 LYS HDx 1.0 . 2.97 1168 969 A 46 LYS HDy A 46 LYS HEy 1.0 . 2.97 1169 970 A 43 ASP HA A 42 LYS HDx 1.0 . 4.57 1170 970 A 42 LYS HDy A 43 ASP HA 1.0 . 4.57 1171 971 A 40 SER HBy A 43 ASP HBx 1.0 . 5.26 1172 972 A 44 ILE HA A 65 LEU HDy% 1.0 . 4.77 1173 973 A 34 ALA HB% A 44 ILE HA 1.0 . 5.10 1174 974 A 44 ILE HB A 41 PHE HDy 1.0 . 4.82 1175 975 A 43 ASP HBy A 44 ILE HD1% 1.0 . 3.77 1176 976 A 52 ILE HG2% A 57 SER HA 1.0 . 3.71 1177 977 A 44 ILE HG2% A 48 MET HE% 1.0 . 3.70 1178 978 A 39 PHE HBy A 44 ILE HG2% 1.0 . 5.09 1179 979 A 44 ILE HG2% A 59 TYR HEx 1.0 . 5.49 1180 980 A 48 MET HBx A 45 LYS HA 1.0 . 4.21 1181 981 A 45 LYS HA A 45 LYS HDx 1.0 . 4.91 1182 981 A 45 LYS HDy A 45 LYS HA 1.0 . 4.91 1183 982 A 46 LYS H A 45 LYS HEx 1.0 . 5.50 1184 983 A 46 LYS H A 45 LYS HEy 1.0 . 5.50 1185 984 A 47 ILE HD1% A 69 LEU HA 1.0 . 3.35 1186 985 A 47 ILE HD1% A 68 ASP HBx 1.0 . 3.48 1187 986 A 47 ILE HD1% A 69 LEU HG 1.0 . 3.23 1188 987 A 59 TYR HEx A 47 ILE HG1x 1.0 . 4.27 1189 987 A 47 ILE HG1y A 59 TYR HEx 1.0 . 4.27 1190 988 A 69 LEU HDy% A 47 ILE HG1x 1.0 . 4.59 1191 988 A 69 LEU HDy% A 47 ILE HG1y 1.0 . 4.59 1192 989 A 68 ASP HBx A 47 ILE HG2% 1.0 . 4.86 1193 990 A 69 LEU HA A 47 ILE HG2% 1.0 . 4.53 1194 991 A 47 ILE HG2% A 59 TYR HEx 1.0 . 3.43 1195 992 A 59 TYR HDx A 47 ILE HG2% 1.0 . 4.84 1196 993 A 59 TYR HDx A 48 MET HA 1.0 . 4.03 1197 994 A 21 ILE HA A 21 ILE HD1% 1.0 . 4.41 1198 995 A 48 MET HGy A 59 TYR HEx 1.0 . 5.14 1199 996 A 45 LYS HBy A 48 MET HGy 1.0 . 5.50 1200 997 A 65 LEU HG A 48 MET HGy 1.0 . 5.50 1201 998 A 66 VAL HGx% A 63 GLU HA 1.0 . 4.89 1202 999 A 52 ILE HB A 49 GLU HA 1.0 . 3.81 1203 1000 A 49 GLU HGx A 47 ILE HG2% 1.0 . 5.42 1204 1001 A 49 GLU HGx A 45 LYS HDx 1.0 . 4.92 1205 1001 A 45 LYS HDy A 49 GLU HGx 1.0 . 4.92 1206 1002 A 88 LYS HDy A 89 GLU HGx 1.0 . 5.03 1207 1002 A 88 LYS HDx A 89 GLU HGx 1.0 . 5.03 1208 1002 A 89 GLU HGy A 88 LYS HDx 1.0 . 5.03 1209 1002 A 88 LYS HDy A 89 GLU HGy 1.0 . 5.03 1210 1003 A 52 ILE HA A 56 GLY HAx 1.0 . 4.51 1211 1004 A 52 ILE HB A 58 ASN HA 1.0 . 5.24 1212 1005 A 52 ILE HB A 52 ILE HD1% 1.0 . 3.65 1213 1006 A 48 MET HBx A 52 ILE HD1% 1.0 . 4.21 1214 1007 A 52 ILE HA A 52 ILE HD1% 1.0 . 4.00 1215 1008 A 52 ILE HG2% A 52 ILE HA 1.0 . 3.24 1216 1009 A 52 ILE HG2% A 56 GLY HAy 1.0 . 4.47 1217 1010 A 46 LYS HA A 43 ASP HA 1.0 . 5.50 1218 1011 A 54 ILE HA A 53 GLN HBx 1.0 . 4.57 1219 1011 A 53 GLN HBy A 54 ILE HA 1.0 . 4.57 1220 1012 A 54 ILE HA A 53 GLN HGx 1.0 . 4.83 1221 1012 A 53 GLN HGy A 54 ILE HA 1.0 . 4.83 1222 1013 A 34 ALA HB% A 44 ILE HD1% 1.0 . 3.01 1223 1014 A 54 ILE HG2% A 55 SER HA 1.0 . 4.14 1224 1015 A 55 SER HBx A 51 LYS HEx 1.0 . 5.43 1225 1016 A 58 ASN HA A 52 ILE HG1x 1.0 . 4.26 1226 1017 A 52 ILE HD1% A 58 ASN HA 1.0 . 3.99 1227 1018 A 51 LYS HGx A 58 ASN HA 1.0 . 4.35 1228 1019 A 58 ASN HA A 52 ILE HG1y 1.0 . 4.26 1229 1020 A 59 TYR HDy A 59 TYR HA 1.0 . 3.71 1230 1021 A 30 MET HE% A 61 SER HBx 1.0 . 5.22 1231 1022 A 30 MET HE% A 61 SER HBy 1.0 . 5.22 1232 1023 A 30 MET HGx A 62 LEU HA 1.0 . 4.82 1233 1024 A 86 LEU HG A 86 LEU HA 1.0 . 3.78 1234 1025 A 59 TYR HDy A 64 VAL HGx% 1.0 . 3.98 1235 1026 A 64 VAL HA A 64 VAL HGx% 1.0 . 3.28 1236 1027 A 59 TYR HDy A 64 VAL HGy% 1.0 . 3.98 1237 1028 A 59 TYR HDx A 65 LEU HA 1.0 . 5.36 1238 1029 A 59 TYR HDy A 65 LEU HA 1.0 . 5.50 1239 1030 A 69 LEU HDx% A 65 LEU HBx 1.0 . 4.80 1240 1031 A 59 TYR HDx A 65 LEU HBx 1.0 . 5.50 1241 1032 A 59 TYR HDy A 65 LEU HBx 1.0 . 5.50 1242 1033 A 59 TYR HBx A 65 LEU HDy% 1.0 . 4.36 1243 1034 A 68 ASP HBx A 65 LEU HDy% 1.0 . 4.66 1244 1035 A 65 LEU HDy% A 47 ILE HG1x 1.0 . 4.08 1245 1035 A 47 ILE HG1y A 65 LEU HDy% 1.0 . 4.08 1246 1036 A 47 ILE HD1% A 65 LEU HDy% 1.0 . 3.58 1247 1037 A 69 LEU HDy% A 47 ILE HD1% 1.0 . 3.84 1248 1038 A 62 LEU HA A 65 LEU HDy% 1.0 . 4.99 1249 1039 A 65 LEU HDy% A 59 TYR HEx 1.0 . 3.72 1250 1040 A 59 TYR HDx A 65 LEU HDy% 1.0 . 3.67 1251 1041 A 28 ASN HD2x A 65 LEU HDx% 1.0 . 5.14 1252 1042 A 59 TYR HDx A 65 LEU HDx% 1.0 . 5.49 1253 1043 A 65 LEU HDx% A 59 TYR HEx 1.0 . 5.27 1254 1044 A 59 TYR HBx A 65 LEU HDx% 1.0 . 4.57 1255 1045 A 59 TYR HBy A 65 LEU HDx% 1.0 . 4.91 1256 1046 A 65 LEU HDx% A 62 LEU HG 1.0 . 5.50 1257 1047 A 69 LEU HDx% A 65 LEU HDx% 1.0 . 3.95 1258 1048 A 69 LEU HDx% A 65 LEU HG 1.0 . 4.75 1259 1049 A 39 PHE HEx A 66 VAL HA 1.0 . 4.96 1260 1050 A 66 VAL HA A 69 LEU HA 1.0 . 5.29 1261 1051 A 69 LEU HDy% A 66 VAL HA 1.0 . 4.49 1262 1052 A 69 LEU HDx% A 66 VAL HGy% 1.0 . 4.13 1263 1053 A 67 ALA HA A 66 VAL HB 1.0 . 5.50 1264 1054 A 67 ALA HB% A 64 VAL HA 1.0 . 3.13 1265 1055 A 39 PHE HDy A 69 LEU HBy 1.0 . 5.39 1266 1056 A 34 ALA HA A 69 LEU HDx% 1.0 . 4.97 1267 1057 A 69 LEU HDx% A 47 ILE HD1% 1.0 . 3.75 1268 1058 A 69 LEU HDx% A 44 ILE HG2% 1.0 . 3.22 1269 1059 A 43 ASP HBx A 69 LEU HDy% 1.0 . 3.67 1270 1060 A 104 LEU HA A 104 LEU HDx% 1.0 . 4.53 1271 1061 A 70 VAL HA A 73 GLN HGx 1.0 . 5.07 1272 1062 A 70 VAL HGy% A 71 ASN HA 1.0 . 4.09 1273 1063 A 39 PHE HDy A 70 VAL HGx% 1.0 . 5.02 1274 1064 A 70 VAL HA A 70 VAL HGx% 1.0 . 3.00 1275 1065 A 71 ASN HA A 74 LYS HBx 1.0 . 4.15 1276 1065 A 71 ASN HA A 74 LYS HBy 1.0 . 4.15 1277 1066 A 71 ASN HA A 71 ASN HBx 1.0 . 2.87 1278 1066 A 71 ASN HBy A 71 ASN HA 1.0 . 2.87 1279 1067 A 72 ALA HA A 71 ASN HBx 1.0 . 4.48 1280 1067 A 71 ASN HBy A 72 ALA HA 1.0 . 4.48 1281 1068 A 71 ASN HA A 72 ALA HB% 1.0 . 5.20 1282 1069 A 72 ALA HB% A 71 ASN HBx 1.0 . 4.13 1283 1069 A 71 ASN HBy A 72 ALA HB% 1.0 . 4.13 1284 1070 A 68 ASP HBy A 72 ALA HB% 1.0 . 4.06 1285 1071 A 72 ALA HB% A 73 GLN HBx 1.0 . 4.34 1286 1071 A 73 GLN HBy A 72 ALA HB% 1.0 . 4.34 1287 1072 A 47 ILE HD1% A 72 ALA HB% 1.0 . 3.14 1288 1073 A 72 ALA HB% A 47 ILE HG2% 1.0 . 4.72 1289 1074 A 66 VAL HGy% A 63 GLU HBx 1.0 . 4.16 1290 1074 A 63 GLU HBy A 66 VAL HGy% 1.0 . 4.16 1291 1075 A 24 THR HA A 27 GLN HGx 1.0 . 4.10 1292 1075 A 27 GLN HGy A 24 THR HA 1.0 . 4.10 1293 1076 A 70 VAL HA A 73 GLN HGy 1.0 . 5.07 1294 1077 A 74 LYS HA A 73 GLN HBx 1.0 . 4.47 1295 1077 A 73 GLN HBy A 74 LYS HA 1.0 . 4.47 1296 1078 A 74 LYS HA A 74 LYS HGx 1.0 . 3.97 1297 1079 A 77 MET HE% A 77 MET HA 1.0 . 3.79 1298 1080 A 4 MET HA A 4 MET HGx 1.0 . 3.98 1299 1080 A 4 MET HGy A 4 MET HA 1.0 . 3.98 1300 1081 A 53 GLN HA A 53 GLN HGx 1.0 . 3.56 1301 1081 A 53 GLN HGy A 53 GLN HA 1.0 . 3.56 1302 1082 A 78 GLN HA A 78 GLN HGx 1.0 . 3.61 1303 1082 A 78 GLN HGy A 78 GLN HA 1.0 . 3.61 1304 1083 A 22 ASP HBx A 45 LYS HDx 1.0 . 4.93 1305 1083 A 22 ASP HBy A 45 LYS HDx 1.0 . 4.93 1306 1083 A 45 LYS HDy A 22 ASP HBx 1.0 . 4.93 1307 1083 A 45 LYS HDy A 22 ASP HBy 1.0 . 4.93 1308 1084 A 7 ILE HG2% A 6 ASP HBx 1.0 . 5.50 1309 1085 A 7 ILE HG2% A 6 ASP HBy 1.0 . 5.50 1310 1086 A 103 LYS HA A 103 LYS HGx 1.0 . 4.08 1311 1086 A 103 LYS HA A 103 LYS HGy 1.0 . 4.08 1312 1087 A 27 GLN HA A 27 GLN HGx 1.0 . 3.47 1313 1087 A 27 GLN HGy A 27 GLN HA 1.0 . 3.47 1314 1088 A 90 ILE HG2% A 90 ILE HA 1.0 . 4.12 1315 1089 A 54 ILE HA A 54 ILE HD1% 1.0 . 3.03 1316 1090 A 51 LYS HGy A 51 LYS HA 1.0 . 4.18 1317 1091 A 69 LEU HA A 47 ILE HG1x 1.0 . 5.04 1318 1091 A 47 ILE HG1y A 69 LEU HA 1.0 . 5.04 1319 1092 A 54 ILE HG1x A 51 LYS HA 1.0 . 5.50 1320 1093 A 96 LEU HA A 96 LEU HDy% 1.0 . 4.00 1321 1094 A 104 LEU HA A 104 LEU HDy% 1.0 . 4.53 1322 1095 A 19 ARG HDy A 19 ARG HGx 1.0 . 2.91 1323 1095 A 19 ARG HDx A 19 ARG HGx 1.0 . 2.91 1324 1095 A 19 ARG HGy A 19 ARG HDx 1.0 . 2.91 1325 1095 A 19 ARG HGy A 19 ARG HDy 1.0 . 2.91 1326 1096 A 48 MET HGx A 65 LEU HG 1.0 . 4.41 1327 1097 A 48 MET HGx A 59 TYR HEx 1.0 . 4.98 1328 1098 A 59 TYR HEy A 51 LYS HDx 1.0 . 5.50 1329 1099 A 59 TYR HEy A 51 LYS HDy 1.0 . 5.50 1330 1100 A 51 LYS HBy A 51 LYS HEx 1.0 . 5.50 1331 1101 A 51 LYS HBy A 51 LYS HEy 1.0 . 5.50 1332 1102 A 59 TYR HEy A 51 LYS HEx 1.0 . 5.01 1333 1103 A 59 TYR HEy A 51 LYS HEy 1.0 . 5.01 1334 1104 A 52 ILE HG2% A 51 LYS HGy 1.0 . 5.50 1335 1105 A 51 LYS HGy A 52 ILE HD1% 1.0 . 5.50 1336 1106 A 51 LYS HGy A 47 ILE HG1x 1.0 . 5.50 1337 1106 A 47 ILE HG1y A 51 LYS HGy 1.0 . 5.50 1338 1107 A 51 LYS HGy A 59 TYR HEx 1.0 . 5.01 1339 1108 A 51 LYS HGy A 59 TYR HDx 1.0 . 5.50 1340 1109 A 51 LYS HGx A 59 TYR HEx 1.0 . 5.18 1341 1110 A 25 ILE HD1% A 45 LYS HA 1.0 . 4.09 1342 1111 A 61 SER HA A 30 MET HE% 1.0 . 3.17 1343 1112 A 62 LEU HA A 30 MET HE% 1.0 . 3.17 1344 1113 A 59 TYR HBx A 30 MET HE% 1.0 . 3.35 1345 1114 A 30 MET HGx A 30 MET HE% 1.0 . 2.88 1346 1115 A 30 MET HGy A 30 MET HE% 1.0 . 3.55 1347 1116 A 59 TYR HDx A 30 MET HE% 1.0 . 4.50 1348 1117 A 69 LEU HDx% A 31 VAL HA 1.0 . 5.50 1349 1118 A 31 VAL HB A 41 PHE HDy 1.0 . 5.50 1350 1119 A 33 GLU HA A 32 GLN HA 1.0 . 5.06 1351 1120 A 37 MET HA A 36 ARG HGx 1.0 . 4.09 1352 1120 A 36 ARG HGy A 37 MET HA 1.0 . 4.09 1353 1121 A 35 ILE HD1% A 35 ILE HG2% 1.0 . 3.47 1354 1122 A 34 ALA HB% A 44 ILE HG1x 1.0 . 4.27 1355 1123 A 34 ALA HB% A 65 LEU HBy 1.0 . 4.74 1356 1124 A 34 ALA HB% A 39 PHE HEx 1.0 . 4.18 1357 1125 A 41 PHE HDx A 35 ILE HA 1.0 . 5.50 1358 1126 A 35 ILE HA A 39 PHE HBx 1.0 . 5.50 1359 1127 A 35 ILE HA A 39 PHE HBy 1.0 . 5.50 1360 1128 A 35 ILE HG2% A 32 GLN HA 1.0 . 4.41 1361 1129 A 41 PHE HBy A 35 ILE HG2% 1.0 . 4.95 1362 1130 A 34 ALA HA A 37 MET HE% 1.0 . 3.26 1363 1131 A 66 VAL HGx% A 37 MET HE% 1.0 . 2.40 1364 1132 A 39 PHE HDx A 37 MET HGx 1.0 . 5.50 1365 1133 A 39 PHE HDx A 37 MET HGy 1.0 . 5.50 1366 1134 A 41 PHE HBy A 44 ILE HG1x 1.0 . 5.50 1367 1135 A 41 PHE HBx A 44 ILE HG1x 1.0 . 5.50 1368 1136 A 41 PHE HA A 44 ILE HG2% 1.0 . 4.39 1369 1137 A 45 LYS HA A 48 MET HA 1.0 . 5.50 1370 1138 A 49 GLU HA A 48 MET HA 1.0 . 5.50 1371 1139 A 45 LYS HBx A 46 LYS HA 1.0 . 5.50 1372 1140 A 35 ILE HD1% A 41 PHE HEx 1.0 . 4.40 1373 1141 A 47 ILE HD1% A 67 ALA H 1.0 . 5.50 1374 1142 A 44 ILE HA A 47 ILE HG1x 1.0 . 5.18 1375 1142 A 44 ILE HA A 47 ILE HG1y 1.0 . 5.18 1376 1143 A 69 LEU HDx% A 47 ILE HG2% 1.0 . 3.92 1377 1144 A 59 TYR HEx A 48 MET HE% 1.0 . 4.00 1378 1145 A 48 MET HGy A 48 MET HE% 1.0 . 3.56 1379 1146 A 31 VAL HB A 48 MET HE% 1.0 . 4.97 1380 1147 A 65 LEU HG A 48 MET HE% 1.0 . 2.58 1381 1148 A 52 ILE HA A 51 LYS HGx 1.0 . 5.18 1382 1149 A 54 ILE HB A 55 SER HA 1.0 . 5.32 1383 1150 A 51 LYS HGy A 55 SER HBx 1.0 . 5.50 1384 1151 A 51 LYS HGy A 55 SER HBy 1.0 . 5.50 1385 1152 A 52 ILE HB A 56 GLY HAx 1.0 . 5.50 1386 1153 A 58 ASN HA A 59 TYR HA 1.0 . 5.20 1387 1154 A 61 SER HA A 30 MET HGy 1.0 . 5.50 1388 1155 A 69 LEU HDy% A 47 ILE HB 1.0 . 3.50 1389 1156 A 66 VAL HA A 65 LEU HDy% 1.0 . 5.26 1390 1157 A 39 PHE HDy A 69 LEU HBx 1.0 . 5.38 1391 1158 A 69 LEU HBy A 73 GLN H 1.0 . 5.50 1392 1159 A 69 LEU HDy% A 72 ALA HB% 1.0 . 4.17 1393 1160 A 19 ARG HBy A 19 ARG HDx 1.0 . 3.84 1394 1160 A 19 ARG HDy A 19 ARG HBx 1.0 . 3.84 1395 1160 A 19 ARG HBy A 19 ARG HDy 1.0 . 3.84 1396 1160 A 19 ARG HBx A 19 ARG HDx 1.0 . 3.84 1397 1161 A 9 SER H A 8 GLY HAx 1.0 . 3.06 1398 1161 A 9 SER H A 8 GLY HAy 1.0 . 3.06 1399 1162 A 11 PHE H A 11 PHE HBy 1.0 . 3.30 1400 1162 A 11 PHE H A 11 PHE HBx 1.0 . 3.30 1401 1163 A 13 LYS H A 13 LYS HBy 1.0 . 3.07 1402 1163 A 13 LYS H A 13 LYS HBx 1.0 . 3.07 1403 1164 A 14 THR H A 13 LYS HBy 1.0 . 3.69 1404 1164 A 14 THR H A 13 LYS HBx 1.0 . 3.69 1405 1165 A 14 THR HA A 13 LYS HBy 1.0 . 4.62 1406 1165 A 14 THR HA A 13 LYS HBx 1.0 . 4.62 1407 1166 A 14 THR H A 15 PRO HDy 1.0 . 5.14 1408 1166 A 14 THR H A 15 PRO HDx 1.0 . 5.14 1409 1167 A 14 THR HA A 15 PRO HGx 1.0 . 4.60 1410 1167 A 14 THR HA A 15 PRO HGy 1.0 . 4.60 1411 1168 A 14 THR HA A 15 PRO HDy 1.0 . 3.10 1412 1168 A 14 THR HA A 15 PRO HDx 1.0 . 3.10 1413 1169 A 14 THR HB A 15 PRO HDy 1.0 . 3.66 1414 1169 A 14 THR HB A 15 PRO HDx 1.0 . 3.66 1415 1170 A 14 THR HG2% A 15 PRO HDy 1.0 . 3.87 1416 1170 A 14 THR HG2% A 15 PRO HDx 1.0 . 3.87 1417 1171 A 16 SER H A 15 PRO HBx 1.0 . 3.58 1418 1171 A 16 SER H A 15 PRO HBy 1.0 . 3.58 1419 1172 A 15 PRO HDy A 42 LYS HEx 1.0 . 4.15 1420 1172 A 15 PRO HDx A 42 LYS HEx 1.0 . 4.15 1421 1172 A 42 LYS HEy A 15 PRO HDy 1.0 . 4.15 1422 1172 A 42 LYS HEy A 15 PRO HDx 1.0 . 4.15 1423 1173 A 17 LEU HA A 17 LEU HDx% 1.0 . 3.65 1424 1173 A 17 LEU HA A 17 LEU HDy% 1.0 . 3.65 1425 1174 A 18 THR H A 17 LEU HDx% 1.0 . 4.55 1426 1174 A 18 THR H A 17 LEU HDy% 1.0 . 4.55 1427 1175 A 20 ARG H A 20 ARG HBx 1.0 . 3.62 1428 1175 A 20 ARG H A 20 ARG HBy 1.0 . 3.62 1429 1176 A 20 ARG HBy A 20 ARG HGx 1.0 . 2.39 1430 1176 A 20 ARG HBx A 20 ARG HGx 1.0 . 2.39 1431 1176 A 20 ARG HGy A 20 ARG HBx 1.0 . 2.39 1432 1176 A 20 ARG HGy A 20 ARG HBy 1.0 . 2.39 1433 1177 A 20 ARG HBx A 20 ARG HDx 1.0 . 3.52 1434 1177 A 20 ARG HBy A 20 ARG HDx 1.0 . 3.52 1435 1177 A 20 ARG HDy A 20 ARG HBx 1.0 . 3.52 1436 1177 A 20 ARG HBy A 20 ARG HDy 1.0 . 3.52 1437 1178 A 21 ILE H A 20 ARG HBx 1.0 . 4.31 1438 1178 A 21 ILE H A 20 ARG HBy 1.0 . 4.31 1439 1179 A 21 ILE H A 21 ILE HG1x 1.0 . 4.48 1440 1179 A 21 ILE H A 21 ILE HG1y 1.0 . 4.48 1441 1180 A 21 ILE HA A 21 ILE HG1x 1.0 . 3.60 1442 1180 A 21 ILE HA A 21 ILE HG1y 1.0 . 3.60 1443 1181 A 22 ASP H A 21 ILE HG1x 1.0 . 5.34 1444 1181 A 22 ASP H A 21 ILE HG1y 1.0 . 5.34 1445 1182 A 22 ASP HA A 21 ILE HG1x 1.0 . 4.82 1446 1182 A 22 ASP HA A 21 ILE HG1y 1.0 . 4.82 1447 1183 A 21 ILE HG1x A 22 ASP HBx 1.0 . 4.56 1448 1183 A 21 ILE HG1y A 22 ASP HBx 1.0 . 4.56 1449 1183 A 22 ASP HBy A 21 ILE HG1x 1.0 . 4.56 1450 1183 A 22 ASP HBy A 21 ILE HG1y 1.0 . 4.56 1451 1184 A 22 ASP H A 45 LYS HEy 1.0 . 4.15 1452 1184 A 22 ASP H A 45 LYS HEx 1.0 . 4.15 1453 1185 A 22 ASP HA A 45 LYS HEy 1.0 . 3.89 1454 1185 A 22 ASP HA A 45 LYS HEx 1.0 . 3.89 1455 1186 A 22 ASP HBx A 45 LYS HGy 1.0 . 4.26 1456 1186 A 22 ASP HBy A 45 LYS HGy 1.0 . 4.26 1457 1186 A 45 LYS HGx A 22 ASP HBx 1.0 . 4.26 1458 1186 A 22 ASP HBy A 45 LYS HGx 1.0 . 4.26 1459 1187 A 23 ASP HA A 27 GLN HBy 1.0 . 5.34 1460 1187 A 23 ASP HA A 27 GLN HBx 1.0 . 5.34 1461 1188 A 24 THR H A 27 GLN HBy 1.0 . 5.24 1462 1188 A 24 THR H A 27 GLN HBx 1.0 . 5.24 1463 1189 A 24 THR H A 27 GLN HE2x 1.0 . 5.05 1464 1189 A 24 THR H A 27 GLN HE2y 1.0 . 5.05 1465 1190 A 24 THR HA A 27 GLN HBy 1.0 . 3.29 1466 1190 A 24 THR HA A 27 GLN HBx 1.0 . 3.29 1467 1191 A 25 ILE HG2% A 26 PHE HBx 1.0 . 3.93 1468 1191 A 25 ILE HG2% A 26 PHE HBy 1.0 . 3.93 1469 1192 A 25 ILE HG2% A 32 GLN HGx 1.0 . 3.98 1470 1192 A 25 ILE HG2% A 32 GLN HGy 1.0 . 3.98 1471 1193 A 25 ILE HD1% A 45 LYS HEy 1.0 . 3.96 1472 1193 A 25 ILE HD1% A 45 LYS HEx 1.0 . 3.96 1473 1194 A 26 PHE H A 26 PHE HBx 1.0 . 3.68 1474 1194 A 26 PHE H A 26 PHE HBy 1.0 . 3.68 1475 1195 A 27 GLN H A 26 PHE HBx 1.0 . 3.70 1476 1195 A 27 GLN H A 26 PHE HBy 1.0 . 3.70 1477 1196 A 27 GLN H A 27 GLN HBy 1.0 . 3.33 1478 1196 A 27 GLN H A 27 GLN HBx 1.0 . 3.33 1479 1197 A 28 ASN H A 31 VAL HGy% 1.0 . 3.82 1480 1197 A 28 ASN H A 31 VAL HGx% 1.0 . 3.82 1481 1198 A 28 ASN HA A 29 PRO HBx 1.0 . 5.23 1482 1198 A 28 ASN HA A 29 PRO HBy 1.0 . 5.23 1483 1199 A 28 ASN HA A 31 VAL HGy% 1.0 . 4.93 1484 1199 A 28 ASN HA A 31 VAL HGx% 1.0 . 4.93 1485 1200 A 28 ASN HBy A 31 VAL HGy% 1.0 . 3.90 1486 1200 A 28 ASN HBy A 31 VAL HGx% 1.0 . 3.90 1487 1201 A 28 ASN HD2y A 31 VAL HGy% 1.0 . 4.15 1488 1201 A 28 ASN HD2y A 31 VAL HGx% 1.0 . 4.15 1489 1202 A 28 ASN HD2x A 31 VAL HGy% 1.0 . 5.29 1490 1202 A 28 ASN HD2x A 31 VAL HGx% 1.0 . 5.29 1491 1203 A 29 PRO HA A 31 VAL HGy% 1.0 . 4.93 1492 1203 A 29 PRO HA A 31 VAL HGx% 1.0 . 4.93 1493 1204 A 29 PRO HA A 32 GLN HGx 1.0 . 4.54 1494 1204 A 29 PRO HA A 32 GLN HGy 1.0 . 4.54 1495 1205 A 30 MET H A 31 VAL HGy% 1.0 . 4.24 1496 1205 A 30 MET H A 31 VAL HGx% 1.0 . 4.24 1497 1206 A 30 MET HA A 62 LEU HDx% 1.0 . 3.45 1498 1206 A 30 MET HA A 62 LEU HDy% 1.0 . 3.45 1499 1207 A 30 MET HBy A 62 LEU HDx% 1.0 . 4.29 1500 1207 A 30 MET HBy A 62 LEU HDy% 1.0 . 4.29 1501 1208 A 30 MET HGx A 62 LEU HDx% 1.0 . 3.68 1502 1208 A 30 MET HGx A 62 LEU HDy% 1.0 . 3.68 1503 1209 A 30 MET HE% A 61 SER HBx 1.0 . 4.46 1504 1209 A 30 MET HE% A 61 SER HBy 1.0 . 4.46 1505 1210 A 30 MET HE% A 62 LEU HDx% 1.0 . 3.14 1506 1210 A 30 MET HE% A 62 LEU HDy% 1.0 . 3.14 1507 1211 A 31 VAL H A 31 VAL HGy% 1.0 . 3.25 1508 1211 A 31 VAL H A 31 VAL HGx% 1.0 . 3.25 1509 1212 A 31 VAL HA A 31 VAL HGy% 1.0 . 2.84 1510 1212 A 31 VAL HA A 31 VAL HGx% 1.0 . 2.84 1511 1213 A 32 GLN H A 31 VAL HGy% 1.0 . 3.45 1512 1213 A 32 GLN H A 31 VAL HGx% 1.0 . 3.45 1513 1214 A 41 PHE HZ A 31 VAL HGy% 1.0 . 5.28 1514 1214 A 41 PHE HZ A 31 VAL HGx% 1.0 . 5.28 1515 1215 A 41 PHE HEy A 31 VAL HGy% 1.0 . 3.04 1516 1215 A 41 PHE HEy A 31 VAL HGx% 1.0 . 3.04 1517 1216 A 41 PHE HDy A 31 VAL HGy% 1.0 . 3.17 1518 1216 A 41 PHE HDy A 31 VAL HGx% 1.0 . 3.17 1519 1217 A 48 MET HE% A 31 VAL HGy% 1.0 . 3.60 1520 1217 A 48 MET HE% A 31 VAL HGx% 1.0 . 3.60 1521 1218 A 32 GLN H A 32 GLN HGx 1.0 . 3.51 1522 1218 A 32 GLN H A 32 GLN HGy 1.0 . 3.51 1523 1219 A 32 GLN HA A 32 GLN HGx 1.0 . 3.63 1524 1219 A 32 GLN HA A 32 GLN HGy 1.0 . 3.63 1525 1220 A 32 GLN HBx A 32 GLN HE2x 1.0 . 4.15 1526 1220 A 32 GLN HE2y A 32 GLN HBx 1.0 . 4.15 1527 1220 A 32 GLN HBy A 32 GLN HE2y 1.0 . 4.15 1528 1220 A 32 GLN HBy A 32 GLN HE2x 1.0 . 4.15 1529 1221 A 35 ILE HD1% A 32 GLN HE2x 1.0 . 5.34 1530 1221 A 35 ILE HD1% A 32 GLN HE2y 1.0 . 5.34 1531 1222 A 33 GLU HGy A 62 LEU HDx% 1.0 . 3.42 1532 1222 A 33 GLU HGx A 62 LEU HDx% 1.0 . 3.42 1533 1222 A 62 LEU HDy% A 33 GLU HGx 1.0 . 3.42 1534 1222 A 33 GLU HGy A 62 LEU HDy% 1.0 . 3.42 1535 1223 A 34 ALA HA A 37 MET HGy 1.0 . 4.20 1536 1223 A 34 ALA HA A 37 MET HGx 1.0 . 4.20 1537 1224 A 34 ALA HB% A 37 MET HGy 1.0 . 5.19 1538 1224 A 34 ALA HB% A 37 MET HGx 1.0 . 5.19 1539 1225 A 36 ARG HBx A 37 MET HGy 1.0 . 4.33 1540 1225 A 36 ARG HBy A 37 MET HGy 1.0 . 4.33 1541 1225 A 37 MET HGx A 36 ARG HBx 1.0 . 4.33 1542 1225 A 36 ARG HBy A 37 MET HGx 1.0 . 4.33 1543 1226 A 37 MET H A 37 MET HGy 1.0 . 3.43 1544 1226 A 37 MET H A 37 MET HGx 1.0 . 3.43 1545 1227 A 37 MET H A 38 GLY HAx 1.0 . 5.11 1546 1227 A 37 MET H A 38 GLY HAy 1.0 . 5.11 1547 1228 A 37 MET HA A 37 MET HGy 1.0 . 3.48 1548 1228 A 37 MET HA A 37 MET HGx 1.0 . 3.48 1549 1229 A 37 MET HE% A 37 MET HGy 1.0 . 3.16 1550 1229 A 37 MET HE% A 37 MET HGx 1.0 . 3.16 1551 1230 A 66 VAL HGx% A 37 MET HGy 1.0 . 4.72 1552 1230 A 66 VAL HGx% A 37 MET HGx 1.0 . 4.72 1553 1231 A 39 PHE HA A 38 GLY HAx 1.0 . 4.88 1554 1231 A 39 PHE HA A 38 GLY HAy 1.0 . 4.88 1555 1232 A 40 SER HBx A 42 LYS HGy 1.0 . 5.34 1556 1232 A 40 SER HBx A 42 LYS HGx 1.0 . 5.34 1557 1233 A 40 SER HBy A 42 LYS HBy 1.0 . 4.64 1558 1233 A 40 SER HBy A 42 LYS HBx 1.0 . 4.64 1559 1234 A 40 SER HBy A 42 LYS HGy 1.0 . 5.34 1560 1234 A 40 SER HBy A 42 LYS HGx 1.0 . 5.34 1561 1235 A 41 PHE HBx A 42 LYS HBy 1.0 . 5.34 1562 1235 A 41 PHE HBx A 42 LYS HBx 1.0 . 5.34 1563 1236 A 42 LYS HA A 45 LYS HGy 1.0 . 3.99 1564 1236 A 42 LYS HA A 45 LYS HGx 1.0 . 3.99 1565 1237 A 42 LYS HA A 45 LYS HEy 1.0 . 4.47 1566 1237 A 42 LYS HA A 45 LYS HEx 1.0 . 4.47 1567 1238 A 42 LYS HBy A 42 LYS HEx 1.0 . 4.71 1568 1238 A 42 LYS HBx A 42 LYS HEx 1.0 . 4.71 1569 1238 A 42 LYS HEy A 42 LYS HBy 1.0 . 4.71 1570 1238 A 42 LYS HEy A 42 LYS HBx 1.0 . 4.71 1571 1239 A 43 ASP H A 42 LYS HBy 1.0 . 3.98 1572 1239 A 43 ASP H A 42 LYS HBx 1.0 . 3.98 1573 1240 A 43 ASP H A 42 LYS HGy 1.0 . 4.56 1574 1240 A 43 ASP H A 42 LYS HGx 1.0 . 4.56 1575 1241 A 43 ASP HA A 42 LYS HGy 1.0 . 4.98 1576 1241 A 43 ASP HA A 42 LYS HGx 1.0 . 4.98 1577 1242 A 43 ASP HA A 46 LYS HGy 1.0 . 5.32 1578 1242 A 43 ASP HA A 46 LYS HGx 1.0 . 5.32 1579 1243 A 43 ASP HBy A 46 LYS HGy 1.0 . 5.34 1580 1243 A 43 ASP HBy A 46 LYS HGx 1.0 . 5.34 1581 1244 A 45 LYS HBx A 45 LYS HEy 1.0 . 4.71 1582 1244 A 45 LYS HBx A 45 LYS HEx 1.0 . 4.71 1583 1245 A 45 LYS HEy A 45 LYS HGy 1.0 . 3.23 1584 1245 A 45 LYS HEx A 45 LYS HGy 1.0 . 3.23 1585 1245 A 45 LYS HGx A 45 LYS HEy 1.0 . 3.23 1586 1245 A 45 LYS HEx A 45 LYS HGx 1.0 . 3.23 1587 1246 A 46 LYS H A 45 LYS HGy 1.0 . 3.93 1588 1246 A 46 LYS H A 45 LYS HGx 1.0 . 3.93 1589 1247 A 45 LYS HEy A 46 LYS HBx 1.0 . 4.68 1590 1247 A 45 LYS HEx A 46 LYS HBx 1.0 . 4.68 1591 1247 A 46 LYS HBy A 45 LYS HEy 1.0 . 4.68 1592 1247 A 46 LYS HBy A 45 LYS HEx 1.0 . 4.68 1593 1248 A 46 LYS HA A 46 LYS HGy 1.0 . 3.53 1594 1248 A 46 LYS HA A 46 LYS HGx 1.0 . 3.53 1595 1249 A 47 ILE H A 46 LYS HGy 1.0 . 4.14 1596 1249 A 47 ILE H A 46 LYS HGx 1.0 . 4.14 1597 1250 A 47 ILE HB A 46 LYS HGy 1.0 . 4.22 1598 1250 A 47 ILE HB A 46 LYS HGx 1.0 . 4.22 1599 1251 A 48 MET H A 46 LYS HGy 1.0 . 5.34 1600 1251 A 48 MET H A 46 LYS HGx 1.0 . 5.34 1601 1252 A 49 GLU HGx A 46 LYS HGy 1.0 . 5.34 1602 1252 A 49 GLU HGx A 46 LYS HGx 1.0 . 5.34 1603 1253 A 47 ILE HA A 50 GLU HGy 1.0 . 4.62 1604 1253 A 47 ILE HA A 50 GLU HGx 1.0 . 4.62 1605 1254 A 48 MET HA A 52 ILE HG1x 1.0 . 5.34 1606 1254 A 48 MET HA A 52 ILE HG1y 1.0 . 5.34 1607 1255 A 48 MET HGx A 58 ASN HD2x 1.0 . 5.08 1608 1255 A 48 MET HGx A 58 ASN HD2y 1.0 . 5.08 1609 1256 A 48 MET HGy A 58 ASN HD2x 1.0 . 5.34 1610 1256 A 48 MET HGy A 58 ASN HD2y 1.0 . 5.34 1611 1257 A 48 MET HE% A 58 ASN HD2x 1.0 . 3.35 1612 1257 A 48 MET HE% A 58 ASN HD2y 1.0 . 3.35 1613 1258 A 49 GLU H A 49 GLU HBx 1.0 . 3.34 1614 1258 A 49 GLU H A 49 GLU HBy 1.0 . 3.34 1615 1259 A 49 GLU HA A 52 ILE HG1x 1.0 . 4.82 1616 1259 A 49 GLU HA A 52 ILE HG1y 1.0 . 4.82 1617 1260 A 50 GLU H A 50 GLU HGy 1.0 . 3.97 1618 1260 A 50 GLU H A 50 GLU HGx 1.0 . 3.97 1619 1261 A 50 GLU HA A 50 GLU HGy 1.0 . 3.04 1620 1261 A 50 GLU HA A 50 GLU HGx 1.0 . 3.04 1621 1262 A 54 ILE HG1x A 50 GLU HGy 1.0 . 4.30 1622 1262 A 54 ILE HG1x A 50 GLU HGx 1.0 . 4.30 1623 1263 A 54 ILE HD1% A 50 GLU HGy 1.0 . 4.20 1624 1263 A 54 ILE HD1% A 50 GLU HGx 1.0 . 4.20 1625 1264 A 51 LYS H A 51 LYS HDy 1.0 . 4.89 1626 1264 A 51 LYS H A 51 LYS HDx 1.0 . 4.89 1627 1265 A 51 LYS H A 52 ILE HG1x 1.0 . 4.60 1628 1265 A 51 LYS H A 52 ILE HG1y 1.0 . 4.60 1629 1266 A 51 LYS HA A 51 LYS HDy 1.0 . 3.62 1630 1266 A 51 LYS HA A 51 LYS HDx 1.0 . 3.62 1631 1267 A 51 LYS HBy A 52 ILE HG1x 1.0 . 4.10 1632 1267 A 51 LYS HBy A 52 ILE HG1y 1.0 . 4.10 1633 1268 A 51 LYS HGx A 52 ILE HG1x 1.0 . 4.41 1634 1268 A 51 LYS HGx A 52 ILE HG1y 1.0 . 4.41 1635 1269 A 55 SER HA A 51 LYS HDy 1.0 . 5.34 1636 1269 A 55 SER HA A 51 LYS HDx 1.0 . 5.34 1637 1270 A 55 SER HBx A 51 LYS HDy 1.0 . 4.88 1638 1270 A 55 SER HBx A 51 LYS HDx 1.0 . 4.88 1639 1271 A 58 ASN HA A 51 LYS HDy 1.0 . 5.34 1640 1271 A 58 ASN HA A 51 LYS HDx 1.0 . 5.34 1641 1272 A 59 TYR HEx A 51 LYS HDy 1.0 . 5.34 1642 1272 A 59 TYR HEx A 51 LYS HDx 1.0 . 5.34 1643 1273 A 59 TYR HDy A 51 LYS HDy 1.0 . 5.34 1644 1273 A 59 TYR HDy A 51 LYS HDx 1.0 . 5.34 1645 1274 A 55 SER HBy A 51 LYS HEy 1.0 . 4.19 1646 1274 A 55 SER HBy A 51 LYS HEx 1.0 . 4.19 1647 1275 A 58 ASN HA A 51 LYS HEy 1.0 . 5.34 1648 1275 A 58 ASN HA A 51 LYS HEx 1.0 . 5.34 1649 1276 A 59 TYR HA A 51 LYS HEy 1.0 . 4.39 1650 1276 A 59 TYR HA A 51 LYS HEx 1.0 . 4.39 1651 1277 A 59 TYR HEy A 51 LYS HEy 1.0 . 4.40 1652 1277 A 59 TYR HEy A 51 LYS HEx 1.0 . 4.40 1653 1278 A 59 TYR HDy A 51 LYS HEy 1.0 . 4.39 1654 1278 A 59 TYR HDy A 51 LYS HEx 1.0 . 4.39 1655 1279 A 52 ILE HA A 52 ILE HG1x 1.0 . 3.26 1656 1279 A 52 ILE HA A 52 ILE HG1y 1.0 . 3.26 1657 1280 A 52 ILE HG2% A 57 SER HBx 1.0 . 5.25 1658 1280 A 52 ILE HG2% A 57 SER HBy 1.0 . 5.25 1659 1281 A 57 SER H A 52 ILE HG1x 1.0 . 5.10 1660 1281 A 57 SER H A 52 ILE HG1y 1.0 . 5.10 1661 1282 A 57 SER HA A 52 ILE HG1x 1.0 . 4.94 1662 1282 A 57 SER HA A 52 ILE HG1y 1.0 . 4.94 1663 1283 A 58 ASN HA A 52 ILE HG1x 1.0 . 3.67 1664 1283 A 58 ASN HA A 52 ILE HG1y 1.0 . 3.67 1665 1284 A 52 ILE HG1y A 58 ASN HBy 1.0 . 5.18 1666 1284 A 52 ILE HG1x A 58 ASN HBy 1.0 . 5.18 1667 1284 A 58 ASN HBx A 52 ILE HG1x 1.0 . 5.18 1668 1284 A 52 ILE HG1y A 58 ASN HBx 1.0 . 5.18 1669 1285 A 53 GLN HBx A 53 GLN HE2x 1.0 . 4.44 1670 1285 A 53 GLN HBy A 53 GLN HE2x 1.0 . 4.44 1671 1285 A 53 GLN HE2y A 53 GLN HBx 1.0 . 4.44 1672 1285 A 53 GLN HBy A 53 GLN HE2y 1.0 . 4.44 1673 1286 A 58 ASN H A 57 SER HBx 1.0 . 3.89 1674 1286 A 58 ASN H A 57 SER HBy 1.0 . 3.89 1675 1287 A 57 SER HBy A 58 ASN HBy 1.0 . 4.76 1676 1287 A 57 SER HBx A 58 ASN HBy 1.0 . 4.76 1677 1287 A 58 ASN HBx A 57 SER HBx 1.0 . 4.76 1678 1287 A 57 SER HBy A 58 ASN HBx 1.0 . 4.76 1679 1288 A 58 ASN H A 58 ASN HD2x 1.0 . 4.84 1680 1288 A 58 ASN H A 58 ASN HD2y 1.0 . 4.84 1681 1289 A 58 ASN HA A 58 ASN HD2x 1.0 . 4.66 1682 1289 A 58 ASN HA A 58 ASN HD2y 1.0 . 4.66 1683 1290 A 59 TYR H A 58 ASN HBy 1.0 . 4.39 1684 1290 A 59 TYR H A 58 ASN HBx 1.0 . 4.39 1685 1291 A 59 TYR HA A 64 VAL HGy% 1.0 . 4.37 1686 1291 A 59 TYR HA A 64 VAL HGx% 1.0 . 4.37 1687 1292 A 59 TYR HEy A 64 VAL HGy% 1.0 . 3.01 1688 1292 A 59 TYR HEy A 64 VAL HGx% 1.0 . 3.01 1689 1293 A 59 TYR HDy A 64 VAL HGy% 1.0 . 3.08 1690 1293 A 59 TYR HDy A 64 VAL HGx% 1.0 . 3.08 1691 1294 A 60 LYS HA A 64 VAL HGy% 1.0 . 4.96 1692 1294 A 60 LYS HA A 64 VAL HGx% 1.0 . 4.96 1693 1295 A 60 LYS HBx A 64 VAL HGy% 1.0 . 3.90 1694 1295 A 60 LYS HBy A 64 VAL HGy% 1.0 . 3.90 1695 1295 A 64 VAL HGx% A 60 LYS HBy 1.0 . 3.90 1696 1295 A 64 VAL HGx% A 60 LYS HBx 1.0 . 3.90 1697 1296 A 61 SER H A 64 VAL HGy% 1.0 . 4.62 1698 1296 A 61 SER H A 64 VAL HGx% 1.0 . 4.62 1699 1297 A 61 SER HA A 62 LEU HDx% 1.0 . 4.14 1700 1297 A 61 SER HA A 62 LEU HDy% 1.0 . 4.14 1701 1298 A 61 SER HA A 64 VAL HGy% 1.0 . 5.09 1702 1298 A 61 SER HA A 64 VAL HGx% 1.0 . 5.09 1703 1299 A 62 LEU H A 61 SER HBx 1.0 . 3.69 1704 1299 A 62 LEU H A 61 SER HBy 1.0 . 3.69 1705 1300 A 61 SER HBy A 62 LEU HDx% 1.0 . 4.51 1706 1300 A 61 SER HBx A 62 LEU HDx% 1.0 . 4.51 1707 1300 A 62 LEU HDy% A 61 SER HBx 1.0 . 4.51 1708 1300 A 62 LEU HDy% A 61 SER HBy 1.0 . 4.51 1709 1301 A 63 GLU H A 61 SER HBx 1.0 . 3.45 1710 1301 A 63 GLU H A 61 SER HBy 1.0 . 3.45 1711 1302 A 61 SER HBx A 63 GLU HGx 1.0 . 4.08 1712 1302 A 61 SER HBy A 63 GLU HGx 1.0 . 4.08 1713 1302 A 63 GLU HGy A 61 SER HBx 1.0 . 4.08 1714 1302 A 61 SER HBy A 63 GLU HGy 1.0 . 4.08 1715 1303 A 64 VAL H A 61 SER HBx 1.0 . 4.11 1716 1303 A 64 VAL H A 61 SER HBy 1.0 . 4.11 1717 1304 A 64 VAL HB A 61 SER HBx 1.0 . 5.34 1718 1304 A 64 VAL HB A 61 SER HBy 1.0 . 5.34 1719 1305 A 61 SER HBx A 64 VAL HGy% 1.0 . 3.84 1720 1305 A 61 SER HBy A 64 VAL HGy% 1.0 . 3.84 1721 1305 A 64 VAL HGx% A 61 SER HBx 1.0 . 3.84 1722 1305 A 61 SER HBy A 64 VAL HGx% 1.0 . 3.84 1723 1306 A 62 LEU H A 62 LEU HDx% 1.0 . 4.03 1724 1306 A 62 LEU H A 62 LEU HDy% 1.0 . 4.03 1725 1307 A 62 LEU H A 63 GLU HGx 1.0 . 4.71 1726 1307 A 62 LEU H A 63 GLU HGy 1.0 . 4.71 1727 1308 A 62 LEU HA A 62 LEU HDx% 1.0 . 3.26 1728 1308 A 62 LEU HA A 62 LEU HDy% 1.0 . 3.26 1729 1309 A 62 LEU HBy A 62 LEU HDx% 1.0 . 2.79 1730 1309 A 62 LEU HBx A 62 LEU HDx% 1.0 . 2.79 1731 1309 A 62 LEU HDy% A 62 LEU HBy 1.0 . 2.79 1732 1309 A 62 LEU HDy% A 62 LEU HBx 1.0 . 2.79 1733 1310 A 63 GLU H A 62 LEU HBy 1.0 . 3.95 1734 1310 A 63 GLU H A 62 LEU HBx 1.0 . 3.95 1735 1311 A 65 LEU HDx% A 62 LEU HBy 1.0 . 5.11 1736 1311 A 65 LEU HDx% A 62 LEU HBx 1.0 . 5.11 1737 1312 A 66 VAL H A 62 LEU HBy 1.0 . 5.34 1738 1312 A 66 VAL H A 62 LEU HBx 1.0 . 5.34 1739 1313 A 63 GLU H A 62 LEU HDx% 1.0 . 4.30 1740 1313 A 63 GLU H A 62 LEU HDy% 1.0 . 4.30 1741 1314 A 65 LEU HDx% A 62 LEU HDx% 1.0 . 4.16 1742 1314 A 65 LEU HDx% A 62 LEU HDy% 1.0 . 4.16 1743 1315 A 63 GLU H A 63 GLU HGx 1.0 . 3.56 1744 1315 A 63 GLU H A 63 GLU HGy 1.0 . 3.56 1745 1316 A 63 GLU H A 64 VAL HGy% 1.0 . 4.36 1746 1316 A 63 GLU H A 64 VAL HGx% 1.0 . 4.36 1747 1317 A 63 GLU HA A 63 GLU HGx 1.0 . 3.05 1748 1317 A 63 GLU HA A 63 GLU HGy 1.0 . 3.05 1749 1318 A 63 GLU HBx A 64 VAL HGy% 1.0 . 4.25 1750 1318 A 63 GLU HBy A 64 VAL HGy% 1.0 . 4.25 1751 1318 A 64 VAL HGx% A 63 GLU HBx 1.0 . 4.25 1752 1318 A 63 GLU HBy A 64 VAL HGx% 1.0 . 4.25 1753 1319 A 64 VAL H A 64 VAL HGy% 1.0 . 2.97 1754 1319 A 64 VAL H A 64 VAL HGx% 1.0 . 2.97 1755 1320 A 64 VAL HA A 64 VAL HGy% 1.0 . 2.78 1756 1320 A 64 VAL HA A 64 VAL HGx% 1.0 . 2.78 1757 1321 A 67 ALA H A 64 VAL HGy% 1.0 . 5.28 1758 1321 A 67 ALA H A 64 VAL HGx% 1.0 . 5.28 1759 1322 A 70 VAL H A 73 GLN HGx 1.0 . 5.34 1760 1322 A 70 VAL H A 73 GLN HGy 1.0 . 5.34 1761 1323 A 70 VAL HA A 73 GLN HGx 1.0 . 4.31 1762 1323 A 70 VAL HA A 73 GLN HGy 1.0 . 4.31 1763 1324 A 70 VAL HA A 74 LYS HGy 1.0 . 5.34 1764 1324 A 70 VAL HA A 74 LYS HGx 1.0 . 5.34 1765 1325 A 70 VAL HB A 74 LYS HGy 1.0 . 5.32 1766 1325 A 70 VAL HB A 74 LYS HGx 1.0 . 5.32 1767 1326 A 71 ASN HA A 71 ASN HD2y 1.0 . 4.28 1768 1326 A 71 ASN HA A 71 ASN HD2x 1.0 . 4.28 1769 1327 A 71 ASN HA A 74 LYS HGy 1.0 . 4.37 1770 1327 A 71 ASN HA A 74 LYS HGx 1.0 . 4.37 1771 1328 A 71 ASN HD2y A 71 ASN HBx 1.0 . 3.27 1772 1328 A 71 ASN HBy A 71 ASN HD2y 1.0 . 3.27 1773 1328 A 71 ASN HBy A 71 ASN HD2x 1.0 . 3.27 1774 1328 A 71 ASN HD2x A 71 ASN HBx 1.0 . 3.27 1775 1329 A 71 ASN HD2y A 72 ALA HB% 1.0 . 5.15 1776 1329 A 71 ASN HD2x A 72 ALA HB% 1.0 . 5.15 1777 1330 A 71 ASN HD2x A 74 LYS HBx 1.0 . 5.34 1778 1330 A 74 LYS HBy A 71 ASN HD2y 1.0 . 5.34 1779 1330 A 74 LYS HBy A 71 ASN HD2x 1.0 . 5.34 1780 1330 A 71 ASN HD2y A 74 LYS HBx 1.0 . 5.34 1781 1331 A 72 ALA HA A 73 GLN HGx 1.0 . 5.33 1782 1331 A 72 ALA HA A 73 GLN HGy 1.0 . 5.33 1783 1332 A 72 ALA HB% A 73 GLN HGx 1.0 . 4.65 1784 1332 A 72 ALA HB% A 73 GLN HGy 1.0 . 4.65 1785 1333 A 73 GLN H A 73 GLN HGx 1.0 . 3.38 1786 1333 A 73 GLN H A 73 GLN HGy 1.0 . 3.38 1787 1334 A 74 LYS H A 74 LYS HGy 1.0 . 3.32 1788 1334 A 74 LYS H A 74 LYS HGx 1.0 . 3.32 1789 1335 A 74 LYS HA A 74 LYS HGy 1.0 . 3.37 1790 1335 A 74 LYS HA A 74 LYS HGx 1.0 . 3.37 1791 1336 A 77 MET H A 77 MET HBx 1.0 . 3.45 1792 1336 A 77 MET H A 77 MET HBy 1.0 . 3.45 1793 1337 A 77 MET H A 77 MET HGy 1.0 . 3.89 1794 1337 A 77 MET H A 77 MET HGx 1.0 . 3.89 1795 1338 A 78 GLN H A 77 MET HBx 1.0 . 2.90 1796 1338 A 77 MET HBy A 78 GLN H 1.0 . 2.90 1797 1339 A 77 MET HE% A 77 MET HGy 1.0 . 3.38 1798 1339 A 77 MET HE% A 77 MET HGx 1.0 . 3.38 1799 1340 A 86 LEU H A 86 LEU HDx% 1.0 . 4.12 1800 1340 A 86 LEU H A 86 LEU HDy% 1.0 . 4.12 1801 1341 A 86 LEU HA A 86 LEU HDx% 1.0 . 4.03 1802 1341 A 86 LEU HA A 86 LEU HDy% 1.0 . 4.03 1803 1342 A 90 ILE H A 90 ILE HG1x 1.0 . 5.00 1804 1342 A 90 ILE H A 90 ILE HG1y 1.0 . 5.00 1805 1343 A 91 SER H A 90 ILE HG1x 1.0 . 4.46 1806 1343 A 91 SER H A 90 ILE HG1y 1.0 . 4.46 1807 1344 A 92 THR HA A 95 GLN HGx 1.0 . 2.92 1808 1344 A 92 THR HA A 95 GLN HGy 1.0 . 2.92 1809 1345 A 92 THR HB A 95 GLN HGx 1.0 . 5.34 1810 1345 A 92 THR HB A 95 GLN HGy 1.0 . 5.34 1811 1346 A 94 GLU H A 95 GLN HGx 1.0 . 5.34 1812 1346 A 94 GLU H A 95 GLN HGy 1.0 . 5.34 1813 1347 A 95 GLN H A 95 GLN HGx 1.0 . 3.42 1814 1347 A 95 GLN H A 95 GLN HGy 1.0 . 3.42 1815 1348 A 95 GLN HA A 95 GLN HGx 1.0 . 3.67 1816 1348 A 95 GLN HGy A 95 GLN HA 1.0 . 3.67 1817 1349 A 95 GLN HBx A 96 LEU HDx% 1.0 . 4.40 1818 1349 A 95 GLN HBy A 96 LEU HDx% 1.0 . 4.40 1819 1349 A 96 LEU HDy% A 95 GLN HBx 1.0 . 4.40 1820 1349 A 95 GLN HBy A 96 LEU HDy% 1.0 . 4.40 1821 1350 A 96 LEU H A 96 LEU HBx 1.0 . 3.55 1822 1350 A 96 LEU H A 96 LEU HBy 1.0 . 3.55 1823 1351 A 96 LEU H A 96 LEU HDx% 1.0 . 3.92 1824 1351 A 96 LEU H A 96 LEU HDy% 1.0 . 3.92 1825 1352 A 97 ARG H A 96 LEU HBx 1.0 . 4.04 1826 1352 A 97 ARG H A 96 LEU HBy 1.0 . 4.04 1827 1353 A 97 ARG H A 96 LEU HDx% 1.0 . 4.21 1828 1353 A 97 ARG H A 96 LEU HDy% 1.0 . 4.21 1829 1354 A 100 GLN H A 99 LEU HBy 1.0 . 3.66 1830 1354 A 100 GLN H A 99 LEU HBx 1.0 . 3.66 1831 1355 A 100 GLN H A 99 LEU HDx% 1.0 . 3.95 1832 1355 A 100 GLN H A 99 LEU HDy% 1.0 . 3.95 1833 1356 A 102 GLU H A 102 GLU HGx 1.0 . 3.95 1834 1356 A 102 GLU H A 102 GLU HGy 1.0 . 3.95 1835 1357 A 104 LEU HA A 104 LEU HDx% 1.0 . 3.93 1836 1357 A 104 LEU HA A 104 LEU HDy% 1.0 . 3.93 stop_ save_