data_nef_c17913_2lj1 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 17912 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLN start . . 2 A 2 THR middle . . 3 A 3 SER middle . . 4 A 4 GLN middle . . 5 A 5 ASP middle . . 6 A 6 LEU middle . . 7 A 7 PHE middle . . 8 A 8 SER middle . . 9 A 9 TYR middle . . 10 A 10 GLN middle . . 11 A 11 ALA middle . . 12 A 12 LEU middle . . 13 A 13 TYR middle . . 14 A 14 SER middle . . 15 A 15 TYR middle . . 16 A 16 ILE middle . . 17 A 17 PRO middle . false 18 A 18 GLN middle . . 19 A 19 ASN middle . . 20 A 20 ASP middle . . 21 A 21 ASP middle . . 22 A 22 GLU middle . . 23 A 23 LEU middle . . 24 A 24 GLU middle . . 25 A 25 LEU middle . . 26 A 26 ARG middle . . 27 A 27 ASP middle . . 28 A 28 GLY middle . false 29 A 29 ASP middle . . 30 A 30 ILE middle . . 31 A 31 VAL middle . . 32 A 32 ASP middle . . 33 A 33 VAL middle . . 34 A 34 MET middle . . 35 A 35 GLU middle . . 36 A 36 LYS middle . . 37 A 37 CYS middle . . 38 A 38 ASP middle . . 39 A 39 ASP middle . . 40 A 40 GLY middle . false 41 A 41 TRP middle . . 42 A 42 PHE middle . . 43 A 43 VAL middle . . 44 A 44 GLY middle . false 45 A 45 THR middle . . 46 A 46 SER middle . . 47 A 47 ARG middle . . 48 A 48 ARG middle . . 49 A 49 THR middle . . 50 A 50 LYS middle . . 51 A 51 GLN middle . . 52 A 52 PHE middle . . 53 A 53 GLY middle . false 54 A 54 THR middle . . 55 A 55 PHE middle . . 56 A 56 PRO middle . false 57 A 57 GLY middle . false 58 A 58 ASN middle . . 59 A 59 TYR middle . . 60 A 60 VAL middle . . 61 A 61 LYS middle . . 62 A 62 PRO middle . false 63 A 63 LEU middle . . 64 A 64 TYR 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 GLN H1 H 1 8.635 0.002 A 1 GLN HA H 1 4.404 0.001 A 1 GLN HBy H 1 2.091 0.002 A 1 GLN HGy H 1 2.324 0.005 A 1 GLN CA C 13 56.190 0.086 A 1 GLN CB C 13 29.302 0.005 A 1 GLN CG C 13 33.860 0.000 A 1 GLN N N 15 122.327 0.000 A 2 THR H H 1 8.268 0.013 A 2 THR HA H 1 4.359 0.007 A 2 THR HB H 1 4.218 0.004 A 2 THR HG2% H 1 1.158 0.009 A 2 THR CA C 13 61.918 0.124 A 2 THR CB C 13 70.007 0.168 A 2 THR CG2 C 13 21.605 0.010 A 2 THR N N 15 115.123 0.043 A 3 SER H H 1 8.329 0.007 A 3 SER HA H 1 4.393 0.006 A 3 SER HBy H 1 3.831 0.008 A 3 SER CA C 13 58.538 0.128 A 3 SER CB C 13 63.865 0.007 A 3 SER N N 15 117.860 0.045 A 4 GLN H H 1 8.359 0.005 A 4 GLN HA H 1 4.287 0.007 A 4 GLN HBy H 1 2.037 0.006 A 4 GLN HGy H 1 2.278 0.004 A 4 GLN CA C 13 55.929 0.095 A 4 GLN CB C 13 29.431 0.123 A 4 GLN CG C 13 33.812 0.021 A 4 GLN N N 15 121.904 0.031 A 5 ASP H H 1 8.222 0.009 A 5 ASP HA H 1 4.515 0.005 A 5 ASP HBy H 1 2.500 0.007 A 5 ASP CA C 13 54.622 0.118 A 5 ASP CB C 13 41.180 0.024 A 5 ASP N N 15 121.274 0.032 A 6 LEU H H 1 7.787 0.006 A 6 LEU HA H 1 4.256 0.007 A 6 LEU HBy H 1 1.377 0.006 A 6 LEU HDx% H 1 0.721 0.009 A 6 LEU HDy% H 1 0.649 0.005 A 6 LEU HG H 1 1.367 0.004 A 6 LEU CA C 13 55.057 0.105 A 6 LEU CB C 13 42.710 0.052 A 6 LEU CDy C 13 24.920 0.029 A 6 LEU CDx C 13 23.618 0.101 A 6 LEU CG C 13 26.783 0.118 A 6 LEU N N 15 121.060 0.031 A 7 PHE H H 1 8.240 0.010 A 7 PHE HA H 1 4.852 0.009 A 7 PHE HBy H 1 3.401 0.009 A 7 PHE HDy H 1 7.172 0.012 A 7 PHE CA C 13 56.964 0.165 A 7 PHE CB C 13 40.497 0.047 A 7 PHE N N 15 119.312 0.051 A 8 SER H H 1 8.201 0.008 A 8 SER HA H 1 5.341 0.009 A 8 SER HBy H 1 3.793 0.010 A 8 SER CA C 13 58.530 0.094 A 8 SER CB C 13 64.615 0.152 A 8 SER N N 15 117.645 0.035 A 9 TYR H H 1 9.312 0.008 A 9 TYR HA H 1 5.071 0.007 A 9 TYR HBy H 1 2.778 0.007 A 9 TYR HDy H 1 6.936 0.012 A 9 TYR CA C 13 56.623 0.084 A 9 TYR CB C 13 42.716 0.071 A 9 TYR N N 15 123.973 0.027 A 10 GLN H H 1 9.448 0.012 A 10 GLN HA H 1 5.449 0.009 A 10 GLN HBy H 1 1.986 0.006 A 10 GLN HGy H 1 1.999 0.010 A 10 GLN CA C 13 53.206 0.118 A 10 GLN CB C 13 32.834 0.064 A 10 GLN CG C 13 33.520 0.065 A 10 GLN N N 15 119.777 0.020 A 11 ALA H H 1 9.603 0.006 A 11 ALA HA H 1 4.674 0.005 A 11 ALA HB% H 1 1.462 0.005 A 11 ALA CA C 13 52.798 0.114 A 11 ALA CB C 13 19.060 0.045 A 11 ALA N N 15 128.040 0.069 A 12 LEU H H 1 9.231 0.008 A 12 LEU HA H 1 3.959 0.008 A 12 LEU HBy H 1 0.779 0.007 A 12 LEU HDx% H 1 0.613 0.010 A 12 LEU HDy% H 1 0.608 0.005 A 12 LEU HG H 1 1.255 0.007 A 12 LEU CA C 13 55.132 0.122 A 12 LEU CB C 13 43.791 0.101 A 12 LEU CDy C 13 25.489 0.069 A 12 LEU CDx C 13 22.706 0.154 A 12 LEU CG C 13 26.848 0.054 A 12 LEU N N 15 126.475 0.050 A 13 TYR H H 1 7.013 0.009 A 13 TYR HA H 1 4.753 0.007 A 13 TYR HBy H 1 3.162 0.006 A 13 TYR HDx H 1 6.594 0.009 A 13 TYR CA C 13 53.592 0.014 A 13 TYR CB C 13 42.569 0.061 A 13 TYR N N 15 112.484 0.063 A 14 SER H H 1 8.308 0.008 A 14 SER HA H 1 4.397 0.007 A 14 SER HBy H 1 3.912 0.018 A 14 SER CA C 13 58.401 0.131 A 14 SER CB C 13 64.028 0.182 A 14 SER N N 15 113.568 0.029 A 15 TYR H H 1 8.962 0.006 A 15 TYR HA H 1 4.694 0.008 A 15 TYR HBy H 1 2.930 0.006 A 15 TYR HDy H 1 7.012 0.010 A 15 TYR CA C 13 59.127 0.030 A 15 TYR CB C 13 42.084 0.064 A 15 TYR N N 15 122.458 0.035 A 16 ILE H H 1 7.426 0.007 A 16 ILE HA H 1 4.333 0.007 A 16 ILE HB H 1 1.534 0.008 A 16 ILE HD1% H 1 0.736 0.005 A 16 ILE HG1y H 1 1.367 0.006 A 16 ILE HG2% H 1 0.752 0.004 A 16 ILE CA C 13 56.360 0.147 A 16 ILE CB C 13 37.998 0.063 A 16 ILE CD1 C 13 11.525 0.061 A 16 ILE CG1 C 13 27.228 0.087 A 16 ILE CG2 C 13 16.614 0.088 A 16 ILE N N 15 129.002 0.049 A 17 PRO HA H 1 4.375 0.009 A 17 PRO HBy H 1 2.389 0.005 A 17 PRO HBx H 1 1.940 0.006 A 17 PRO HDy H 1 3.813 0.008 A 17 PRO HGy H 1 2.129 0.005 A 17 PRO CA C 13 63.614 0.127 A 17 PRO CB C 13 34.016 0.037 A 17 PRO CD C 13 51.014 0.027 A 17 PRO CG C 13 27.805 0.099 A 18 GLN H H 1 9.032 0.009 A 18 GLN HA H 1 4.326 0.005 A 18 GLN HBy H 1 2.271 0.004 A 18 GLN HGy H 1 2.535 0.012 A 18 GLN CA C 13 54.774 0.047 A 18 GLN CB C 13 30.867 0.087 A 18 GLN CG C 13 34.111 0.019 A 18 GLN N N 15 120.610 0.024 A 19 ASN H H 1 7.278 0.008 A 19 ASN HA H 1 4.877 0.004 A 19 ASN HBy H 1 2.676 0.006 A 19 ASN CA C 13 52.046 0.102 A 19 ASN CB C 13 44.116 0.057 A 19 ASN N N 15 114.130 0.038 A 20 ASP H H 1 8.844 0.008 A 20 ASP HA H 1 4.409 0.009 A 20 ASP HBy H 1 2.732 0.004 A 20 ASP CA C 13 56.761 0.193 A 20 ASP CB C 13 40.427 0.041 A 20 ASP N N 15 119.849 0.026 A 21 ASP H H 1 8.259 0.009 A 21 ASP HA H 1 4.716 0.006 A 21 ASP HBy H 1 3.072 0.005 A 21 ASP CA C 13 52.903 0.006 A 21 ASP CB C 13 39.519 0.050 A 21 ASP N N 15 116.249 0.045 A 22 GLU H H 1 7.540 0.008 A 22 GLU HA H 1 5.306 0.007 A 22 GLU HBy H 1 2.482 0.005 A 22 GLU HGy H 1 2.374 0.011 A 22 GLU CA C 13 54.842 0.090 A 22 GLU CB C 13 31.813 0.137 A 22 GLU CG C 13 37.357 0.061 A 22 GLU N N 15 119.836 0.019 A 23 LEU H H 1 8.710 0.007 A 23 LEU HA H 1 4.351 0.007 A 23 LEU HBy H 1 1.623 0.005 A 23 LEU HDx% H 1 0.694 0.006 A 23 LEU HDy% H 1 0.493 0.007 A 23 LEU HG H 1 1.343 0.008 A 23 LEU CA C 13 53.197 0.119 A 23 LEU CB C 13 45.612 0.083 A 23 LEU CDx C 13 24.941 0.143 A 23 LEU CDy C 13 25.666 0.089 A 23 LEU CG C 13 26.272 0.000 A 23 LEU N N 15 124.087 0.027 A 24 GLU H H 1 8.042 0.009 A 24 GLU HA H 1 4.564 0.006 A 24 GLU HBy H 1 1.946 0.008 A 24 GLU HGy H 1 2.553 0.010 A 24 GLU CA C 13 56.198 0.118 A 24 GLU CB C 13 29.835 0.071 A 24 GLU CG C 13 36.272 0.069 A 24 GLU N N 15 122.201 0.059 A 25 LEU H H 1 8.733 0.009 A 25 LEU HA H 1 4.611 0.012 A 25 LEU HBy H 1 1.931 0.007 A 25 LEU HDx% H 1 0.587 0.007 A 25 LEU HDy% H 1 0.276 0.004 A 25 LEU HG H 1 1.660 0.006 A 25 LEU CA C 13 53.546 0.091 A 25 LEU CB C 13 45.114 0.083 A 25 LEU CDy C 13 25.209 0.124 A 25 LEU CDx C 13 22.954 0.048 A 25 LEU CG C 13 26.119 0.053 A 25 LEU N N 15 125.205 0.054 A 26 ARG H H 1 8.597 0.010 A 26 ARG HA H 1 4.725 0.005 A 26 ARG HBy H 1 1.752 0.007 A 26 ARG HDy H 1 3.119 0.005 A 26 ARG HGy H 1 1.639 0.005 A 26 ARG CA C 13 54.196 0.026 A 26 ARG CB C 13 32.565 0.101 A 26 ARG CD C 13 43.676 0.057 A 26 ARG CG C 13 26.917 0.030 A 26 ARG N N 15 124.847 0.035 A 27 ASP H H 1 8.136 0.008 A 27 ASP HA H 1 3.429 0.004 A 27 ASP HBy H 1 2.334 0.008 A 27 ASP CA C 13 56.050 0.131 A 27 ASP CB C 13 40.214 0.060 A 27 ASP N N 15 121.325 0.042 A 28 GLY H H 1 8.505 0.008 A 28 GLY HAy H 1 4.415 0.006 A 28 GLY CA C 13 44.889 0.033 A 28 GLY N N 15 113.421 0.052 A 29 ASP H H 1 8.441 0.009 A 29 ASP HA H 1 4.456 0.008 A 29 ASP HBy H 1 2.612 0.017 A 29 ASP CA C 13 55.528 0.104 A 29 ASP CB C 13 41.558 0.072 A 29 ASP N N 15 122.317 0.028 A 30 ILE H H 1 8.577 0.011 A 30 ILE HA H 1 5.001 0.006 A 30 ILE HB H 1 1.676 0.006 A 30 ILE HD1% H 1 0.807 0.005 A 30 ILE HG1y H 1 1.717 0.007 A 30 ILE HG2% H 1 0.842 0.011 A 30 ILE CA C 13 59.890 0.102 A 30 ILE CB C 13 38.220 0.043 A 30 ILE CD1 C 13 12.206 0.100 A 30 ILE CG1 C 13 27.961 0.102 A 30 ILE CG2 C 13 17.036 0.122 A 30 ILE N N 15 121.394 0.067 A 31 VAL H H 1 9.248 0.009 A 31 VAL HA H 1 4.874 0.006 A 31 VAL HB H 1 1.535 0.003 A 31 VAL HGx% H 1 0.462 0.008 A 31 VAL CA C 13 58.941 0.103 A 31 VAL CB C 13 35.084 0.096 A 31 VAL CGy C 13 20.827 0.161 A 31 VAL CGx C 13 20.352 0.076 A 31 VAL N N 15 124.770 0.043 A 32 ASP H H 1 8.595 0.010 A 32 ASP HA H 1 5.369 0.008 A 32 ASP HBy H 1 2.536 0.009 A 32 ASP CA C 13 54.018 0.108 A 32 ASP CB C 13 42.325 0.038 A 32 ASP N N 15 124.983 0.076 A 33 VAL H H 1 9.377 0.009 A 33 VAL HA H 1 4.155 0.005 A 33 VAL HB H 1 2.230 0.009 A 33 VAL HGx% H 1 0.892 0.005 A 33 VAL HGy% H 1 0.545 0.009 A 33 VAL CA C 13 64.228 0.171 A 33 VAL CB C 13 33.262 0.061 A 33 VAL CGy C 13 24.918 0.051 A 33 VAL CGx C 13 21.045 0.039 A 33 VAL N N 15 127.010 0.067 A 34 MET H H 1 9.404 0.011 A 34 MET HA H 1 4.646 0.012 A 34 MET HBy H 1 2.097 0.007 A 34 MET HGy H 1 2.615 0.006 A 34 MET CA C 13 56.039 0.134 A 34 MET CB C 13 35.364 0.143 A 34 MET CG C 13 32.068 0.038 A 34 MET N N 15 126.236 0.073 A 35 GLU H H 1 7.699 0.007 A 35 GLU HA H 1 4.474 0.012 A 35 GLU HBy H 1 1.842 0.011 A 35 GLU HGy H 1 2.088 0.004 A 35 GLU CA C 13 55.556 0.117 A 35 GLU CB C 13 33.470 0.032 A 35 GLU CG C 13 35.759 0.083 A 35 GLU N N 15 118.007 0.035 A 36 LYS H H 1 8.586 0.007 A 36 LYS HA H 1 4.361 0.009 A 36 LYS HBy H 1 1.468 0.005 A 36 LYS HDy H 1 1.194 0.003 A 36 LYS HEy H 1 2.433 0.004 A 36 LYS HGy H 1 0.683 0.007 A 36 LYS CA C 13 55.577 0.127 A 36 LYS CB C 13 32.981 0.073 A 36 LYS CD C 13 29.346 0.017 A 36 LYS CE C 13 41.703 0.030 A 36 LYS CG C 13 23.555 0.062 A 36 LYS N N 15 124.151 0.040 A 37 CYS H H 1 8.689 0.008 A 37 CYS HA H 1 4.592 0.007 A 37 CYS HBy H 1 3.504 0.008 A 37 CYS CA C 13 58.377 0.090 A 37 CYS CB C 13 29.217 0.117 A 37 CYS N N 15 122.385 0.043 A 38 ASP H H 1 9.056 0.009 A 38 ASP HA H 1 4.355 0.009 A 38 ASP HBy H 1 2.698 0.009 A 38 ASP CA C 13 56.755 0.073 A 38 ASP CB C 13 40.300 0.047 A 38 ASP N N 15 123.591 0.032 A 39 ASP H H 1 7.885 0.008 A 39 ASP HA H 1 4.472 0.006 A 39 ASP HBy H 1 3.421 0.005 A 39 ASP CA C 13 53.216 0.112 A 39 ASP CB C 13 40.130 0.061 A 39 ASP N N 15 117.190 0.010 A 40 GLY H H 1 8.032 0.007 A 40 GLY HAy H 1 4.243 0.006 A 40 GLY CA C 13 44.975 0.052 A 40 GLY N N 15 105.575 0.059 A 41 TRP H H 1 8.319 0.006 A 41 TRP HA H 1 4.057 0.006 A 41 TRP HBy H 1 3.208 0.004 A 41 TRP HD1 H 1 7.458 0.007 A 41 TRP CA C 13 58.452 0.132 A 41 TRP CB C 13 27.230 0.103 A 41 TRP N N 15 123.669 0.050 A 42 PHE H H 1 8.567 0.007 A 42 PHE HA H 1 5.342 0.006 A 42 PHE HBy H 1 2.594 0.007 A 42 PHE HDx H 1 6.634 0.013 A 42 PHE CA C 13 51.448 0.075 A 42 PHE CB C 13 40.630 0.055 A 42 PHE N N 15 120.474 0.057 A 43 VAL H H 1 8.915 0.007 A 43 VAL HA H 1 4.623 0.007 A 43 VAL HB H 1 1.833 0.004 A 43 VAL HGx% H 1 0.688 0.007 A 43 VAL HGy% H 1 0.737 0.011 A 43 VAL CA C 13 61.175 0.180 A 43 VAL CB C 13 34.518 0.122 A 43 VAL CGy C 13 22.633 0.044 A 43 VAL CGx C 13 20.659 0.100 A 43 VAL N N 15 121.847 0.042 A 44 GLY H H 1 8.897 0.008 A 44 GLY HAy H 1 4.530 0.008 A 44 GLY CA C 13 46.888 0.045 A 44 GLY N N 15 113.784 0.039 A 45 THR H H 1 8.424 0.008 A 45 THR HA H 1 5.506 0.009 A 45 THR HB H 1 3.970 0.008 A 45 THR HG2% H 1 1.085 0.003 A 45 THR CA C 13 60.396 0.108 A 45 THR CB C 13 71.151 0.135 A 45 THR CG2 C 13 21.366 0.027 A 45 THR N N 15 112.652 0.038 A 46 SER H H 1 8.540 0.016 A 46 SER HA H 1 4.496 0.009 A 46 SER HBy H 1 4.075 0.006 A 46 SER CA C 13 57.007 0.012 A 46 SER CB C 13 63.816 0.121 A 46 SER N N 15 119.945 0.033 A 47 ARG H H 1 9.019 0.004 A 47 ARG HA H 1 4.217 0.005 A 47 ARG HBy H 1 1.845 0.008 A 47 ARG HDy H 1 3.149 0.003 A 47 ARG HGy H 1 1.644 0.008 A 47 ARG CA C 13 59.482 0.155 A 47 ARG CB C 13 29.995 0.109 A 47 ARG CD C 13 43.774 0.113 A 47 ARG CG C 13 28.280 0.031 A 47 ARG N N 15 128.825 0.059 A 48 ARG H H 1 8.498 0.008 A 48 ARG HA H 1 4.216 0.005 A 48 ARG HBy H 1 1.798 0.010 A 48 ARG HDy H 1 3.386 0.005 A 48 ARG HGy H 1 1.436 0.015 A 48 ARG CA C 13 59.206 0.075 A 48 ARG CB C 13 30.978 0.156 A 48 ARG CD C 13 42.050 0.081 A 48 ARG CG C 13 26.888 0.000 A 48 ARG N N 15 118.813 0.029 A 49 THR H H 1 7.720 0.007 A 49 THR HA H 1 4.320 0.008 A 49 THR HB H 1 4.435 0.008 A 49 THR HG2% H 1 1.151 0.007 A 49 THR CA C 13 61.456 0.131 A 49 THR CB C 13 70.527 0.101 A 49 THR CG2 C 13 21.472 0.035 A 49 THR N N 15 105.015 0.090 A 50 LYS H H 1 7.977 0.008 A 50 LYS HA H 1 4.045 0.009 A 50 LYS HBy H 1 2.193 0.010 A 50 LYS HDy H 1 1.633 0.007 A 50 LYS HEy H 1 3.006 0.004 A 50 LYS HGy H 1 1.379 0.009 A 50 LYS CA C 13 57.858 0.125 A 50 LYS CB C 13 29.040 0.090 A 50 LYS CD C 13 28.706 0.014 A 50 LYS CE C 13 42.343 0.019 A 50 LYS CG C 13 25.283 0.102 A 50 LYS N N 15 115.674 0.027 A 51 GLN H H 1 7.672 0.005 A 51 GLN HA H 1 4.402 0.006 A 51 GLN HBy H 1 2.125 0.004 A 51 GLN HGy H 1 2.396 0.009 A 51 GLN CA C 13 55.577 0.032 A 51 GLN CB C 13 29.802 0.005 A 51 GLN CG C 13 34.072 0.032 A 51 GLN N N 15 118.027 0.034 A 52 PHE H H 1 8.506 0.006 A 52 PHE HA H 1 5.577 0.013 A 52 PHE HBy H 1 3.056 0.010 A 52 PHE HDx H 1 7.197 0.001 A 52 PHE CA C 13 55.515 0.121 A 52 PHE CB C 13 42.919 0.026 A 52 PHE N N 15 122.149 0.040 A 53 GLY H H 1 8.493 0.009 A 53 GLY HAy H 1 3.903 0.015 A 53 GLY CA C 13 45.554 0.039 A 53 GLY N N 15 113.270 0.059 A 54 THR H H 1 8.530 0.007 A 54 THR HA H 1 6.034 0.007 A 54 THR HB H 1 3.937 0.011 A 54 THR HG2% H 1 1.096 0.003 A 54 THR CA C 13 57.841 0.055 A 54 THR CB C 13 71.605 0.172 A 54 THR CG2 C 13 19.543 0.063 A 54 THR N N 15 113.615 0.035 A 55 PHE H H 1 8.339 0.009 A 55 PHE HA H 1 4.850 0.007 A 55 PHE HBy H 1 3.124 0.005 A 55 PHE HDx H 1 6.709 0.011 A 55 PHE CA C 13 55.052 0.127 A 55 PHE CB C 13 37.218 0.063 A 55 PHE N N 15 123.708 0.032 A 56 PRO HA H 1 2.269 0.004 A 56 PRO HBy H 1 1.443 0.005 A 56 PRO HBx H 1 0.634 0.008 A 56 PRO HDy H 1 2.061 0.005 A 56 PRO HGy H 1 0.313 0.004 A 56 PRO CA C 13 61.844 0.138 A 56 PRO CB C 13 31.045 0.065 A 56 PRO CD C 13 48.490 0.051 A 56 PRO CG C 13 26.832 0.058 A 57 GLY H H 1 7.808 0.005 A 57 GLY HAy H 1 2.231 0.020 A 57 GLY CA C 13 44.596 0.065 A 57 GLY N N 15 112.583 0.064 A 58 ASN H H 1 7.962 0.004 A 58 ASN HA H 1 4.623 0.006 A 58 ASN HBy H 1 3.015 0.009 A 58 ASN CA C 13 52.873 0.141 A 58 ASN CB C 13 35.033 0.048 A 58 ASN N N 15 112.820 0.040 A 59 TYR H H 1 7.649 0.005 A 59 TYR HA H 1 4.656 0.008 A 59 TYR HBy H 1 3.234 0.005 A 59 TYR HDx H 1 6.977 0.005 A 59 TYR CA C 13 58.197 0.107 A 59 TYR CB C 13 37.501 0.033 A 59 TYR N N 15 119.700 0.027 A 60 VAL H H 1 7.300 0.004 A 60 VAL HA H 1 5.454 0.006 A 60 VAL HB H 1 2.164 0.007 A 60 VAL HGx% H 1 0.896 0.005 A 60 VAL HGy% H 1 0.622 0.006 A 60 VAL CA C 13 58.191 0.092 A 60 VAL CB C 13 36.682 0.069 A 60 VAL CGx C 13 20.694 0.058 A 60 VAL CGy C 13 21.133 0.066 A 60 VAL N N 15 108.984 0.033 A 61 LYS H H 1 8.995 0.008 A 61 LYS HA H 1 5.247 0.006 A 61 LYS HBy H 1 1.880 0.004 A 61 LYS HDy H 1 1.610 0.006 A 61 LYS HEy H 1 2.814 0.004 A 61 LYS HGy H 1 1.375 0.008 A 61 LYS CA C 13 52.652 0.130 A 61 LYS CB C 13 34.744 0.059 A 61 LYS CD C 13 29.639 0.103 A 61 LYS CE C 13 42.332 0.137 A 61 LYS CG C 13 23.519 0.018 A 61 LYS N N 15 118.836 0.032 A 62 PRO HA H 1 3.516 0.007 A 62 PRO HBy H 1 1.669 0.007 A 62 PRO HBx H 1 1.345 0.004 A 62 PRO HDy H 1 3.880 0.009 A 62 PRO HGy H 1 2.007 0.004 A 62 PRO CA C 13 62.930 0.063 A 62 PRO CB C 13 31.833 0.090 A 62 PRO CD C 13 50.608 0.023 A 62 PRO CG C 13 27.403 0.087 A 63 LEU H H 1 7.933 0.009 A 63 LEU HA H 1 4.194 0.008 A 63 LEU HBy H 1 1.245 0.014 A 63 LEU HDx% H 1 0.795 0.008 A 63 LEU HDy% H 1 0.742 0.010 A 63 LEU HG H 1 1.200 0.008 A 63 LEU CA C 13 54.689 0.054 A 63 LEU CB C 13 42.768 0.043 A 63 LEU CDy C 13 24.635 0.156 A 63 LEU CDx C 13 24.128 0.050 A 63 LEU CG C 13 26.870 0.000 A 63 LEU N N 15 122.539 0.063 A 64 TYR H H 1 8.010 0.014 A 64 TYR HA H 1 4.488 0.006 A 64 TYR HBy H 1 2.900 0.014 A 64 TYR HDx H 1 6.977 0.003 A 64 TYR CA C 13 57.263 0.120 A 64 TYR CB C 13 38.535 0.046 A 64 TYR N N 15 120.151 0.029 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-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 TRP HBx A 41 TRP HBy 1.0 1.557 2.679 2 2 A 24 GLU H A 23 LEU HA 1.0 1.566 2.706 3 3 A 23 LEU HA A 23 LEU H 1.0 1.802 3.680 4 4 A 22 GLU HA A 53 GLY HAx 1.0 1.786 3.596 5 5 A 44 GLY HAx A 33 VAL HA 1.0 1.617 2.883 6 6 A 33 VAL HA A 34 MET H 1.0 1.545 2.641 7 7 A 44 GLY HAx A 45 THR H 1.0 1.591 2.793 8 8 A 44 GLY HAx A 44 GLY H 1.0 1.704 3.220 9 9 A 44 GLY HAx A 34 MET H 1.0 1.758 3.456 10 10 A 42 PHE HA A 42 PHE HBy 1.0 1.700 3.202 11 11 A 42 PHE HA A 42 PHE HBx 1.0 1.733 3.341 12 12 A 42 PHE HA A 36 LYS HA 1.0 1.629 2.925 13 13 A 36 LYS HA A 37 CYS H 1.0 1.630 2.930 14 14 A 42 PHE HA A 43 VAL H 1.0 1.621 2.895 15 15 A 42 PHE HA A 37 CYS H 1.0 1.692 3.168 16 16 A 36 LYS H A 35 GLU HA 1.0 1.373 2.149 17 17 A 36 LYS HA A 43 VAL H 1.0 1.816 3.754 18 18 A 32 ASP H A 32 ASP HA 1.0 1.683 3.133 19 19 A 32 ASP HA A 33 VAL H 1.0 1.510 2.532 20 20 A 31 VAL H A 30 ILE HA 1.0 1.545 2.637 21 21 A 10 GLN H A 9 TYR HA 1.0 1.639 2.965 22 22 A 30 ILE HA A 10 GLN HA 1.0 1.673 3.091 23 23 A 10 GLN HA A 11 ALA H 1.0 1.568 2.716 24 24 A 10 GLN HA A 10 GLN HBy 1.0 1.525 2.579 25 25 A 10 GLN HA A 10 GLN HBx 1.0 1.671 3.085 26 26 A 43 VAL HA A 54 THR HA 1.0 1.635 2.945 27 27 A 54 THR HA A 54 THR HB 1.0 1.721 3.289 28 28 A 54 THR HA A 54 THR HG2% 1.0 1.854 3.988 29 29 A 43 VAL HA A 43 VAL HB 1.0 1.810 3.726 30 30 A 53 GLY H A 45 THR HA 1.0 1.632 2.938 31 31 A 56 PRO HA A 57 GLY H 1.0 1.623 2.905 32 32 A 41 TRP HBx A 41 TRP HA 1.0 1.735 3.353 33 33 A 56 PRO HA A 41 TRP HA 1.0 1.650 3.004 34 34 A 50 LYS HA A 45 THR HG2% 1.0 1.743 3.391 35 35 A 41 TRP HBy A 41 TRP HA 1.0 1.856 3.996 36 36 A 41 TRP HA A 42 PHE H 1.0 1.596 2.808 37 37 A 57 GLY H A 41 TRP HA 1.0 1.592 2.796 38 38 A 44 GLY H A 54 THR HA 1.0 1.858 4.012 39 39 A 53 GLY H A 52 PHE HA 1.0 1.490 2.472 40 40 A 45 THR HB A 32 ASP HBy 1.0 1.746 3.400 41 41 A 45 THR HG2% A 45 THR HB 1.0 1.504 2.510 42 42 A 34 MET HBy A 43 VAL HGx% 1.0 1.555 2.673 43 43 A 35 GLU HA A 35 GLU HGy 1.0 1.630 2.930 44 44 A 31 VAL H A 30 ILE HG2% 1.0 1.630 2.932 45 45 A 9 TYR HBy A 9 TYR HDx 1.0 1.709 3.241 46 46 A 9 TYR HDx A 9 TYR HBx 1.0 1.727 3.319 47 47 A 9 TYR HBx A 60 VAL HB 1.0 1.859 4.021 48 48 A 60 VAL HB A 60 VAL HGy% 1.0 1.621 2.895 49 49 A 9 TYR HBy A 60 VAL HGx% 1.0 1.758 3.456 50 50 A 9 TYR HBy A 60 VAL HGy% 1.0 1.604 2.838 51 51 A 9 TYR HBx A 60 VAL HGx% 1.0 1.654 3.016 52 52 A 60 VAL HB A 60 VAL HGx% 1.0 1.640 2.964 53 53 A 60 VAL HGx% A 60 VAL HA 1.0 1.816 3.754 54 54 A 9 TYR HDx A 60 VAL HGx% 1.0 1.622 2.900 55 55 A 60 VAL HGx% A 60 VAL H 1.0 1.671 3.083 56 56 A 60 VAL HGx% A 59 TYR H 1.0 1.886 4.202 57 57 A 9 TYR HA A 63 LEU H 1.0 1.642 2.974 58 58 A 9 TYR HA A 9 TYR HDx 1.0 1.827 3.819 59 59 A 9 TYR HA A 9 TYR HBy 1.0 1.740 3.376 60 60 A 9 TYR HA A 9 TYR HBx 1.0 1.717 3.277 61 61 A 9 TYR HA A 63 LEU HG 1.0 1.782 3.578 62 62 A 9 TYR HA A 62 PRO HA 1.0 1.641 2.971 63 63 A 63 LEU H A 62 PRO HA 1.0 1.558 2.682 64 64 A 9 TYR HDx A 62 PRO HA 1.0 1.819 3.777 65 65 A 7 PHE HBx A 7 PHE HBy 1.0 1.450 2.354 66 66 A 7 PHE HBy A 8 SER H 1.0 1.758 3.456 67 67 A 7 PHE HBx A 7 PHE HDx 1.0 1.729 3.327 68 68 A 7 PHE HBy A 7 PHE HDx 1.0 1.802 3.680 69 69 A 8 SER H A 7 PHE HA 1.0 1.649 3.001 70 70 A 7 PHE HBy A 7 PHE HA 1.0 1.679 3.117 71 71 A 7 PHE HBx A 7 PHE HA 1.0 1.764 3.488 72 72 A 13 TYR HBx A 13 TYR HBy 1.0 1.504 2.512 73 73 A 13 TYR HBx A 13 TYR HA 1.0 1.732 3.338 74 74 A 13 TYR HBy A 13 TYR HA 1.0 1.608 2.852 75 75 A 13 TYR HBx A 13 TYR H 1.0 1.774 3.538 76 76 A 13 TYR HBy A 14 SER H 1.0 1.768 3.510 77 77 A 13 TYR HBx A 13 TYR HDx 1.0 1.616 2.878 78 78 A 13 TYR HBy A 13 TYR HDx 1.0 1.803 3.685 79 79 A 13 TYR HBy A 13 TYR H 1.0 1.854 3.988 80 80 A 11 ALA H A 11 ALA HB% 1.0 1.635 2.947 81 81 A 12 LEU H A 11 ALA HB% 1.0 1.794 3.636 82 82 A 29 ASP H A 11 ALA HB% 1.0 1.597 2.811 83 83 A 13 TYR H A 11 ALA HB% 1.0 1.782 3.574 84 84 A 60 VAL HB A 60 VAL HA 1.0 1.738 3.364 85 85 A 10 GLN HA A 30 ILE HD1% 1.0 1.794 3.636 86 86 A 15 TYR HBx A 15 TYR HBy 1.0 1.608 2.850 87 87 A 15 TYR HBy A 15 TYR HA 1.0 1.786 3.600 88 88 A 15 TYR HBx A 15 TYR HA 1.0 1.854 3.980 89 89 A 15 TYR HBx A 15 TYR HDx 1.0 1.799 3.665 90 90 A 15 TYR HBy A 15 TYR HDx 1.0 1.780 3.566 91 91 A 15 TYR HBx A 25 LEU HBy 1.0 1.744 3.394 92 92 A 15 TYR HBx A 25 LEU HBx 1.0 1.741 3.379 93 93 A 42 PHE HBy A 42 PHE HBx 1.0 1.529 2.589 94 94 A 42 PHE HBy A 42 PHE H 1.0 1.749 3.413 95 95 A 42 PHE HBy A 43 VAL H 1.0 1.761 3.477 96 96 A 42 PHE HBx A 43 VAL H 1.0 1.801 3.675 97 97 A 42 PHE HBy A 42 PHE HDx 1.0 1.809 3.721 98 98 A 42 PHE HBx A 42 PHE HDx 1.0 1.808 3.716 99 99 A 55 PHE HBy A 55 PHE HDx 1.0 1.805 3.695 100 100 A 55 PHE HBx A 55 PHE HDy 1.0 1.788 3.604 101 101 A 55 PHE HBy A 55 PHE HBx 1.0 1.571 2.721 102 102 A 55 PHE HBx A 56 PRO HDx 1.0 1.806 3.700 103 103 A 55 PHE HBy A 56 PRO HDx 1.0 1.712 3.252 104 104 A 55 PHE HBy A 56 PRO HDy 1.0 1.394 2.202 105 105 A 55 PHE HBx A 56 PRO HDy 1.0 1.756 3.450 106 106 A 55 PHE HDy A 56 PRO HDy 1.0 1.774 3.538 107 107 A 56 PRO HDy A 55 PHE HA 1.0 1.722 3.292 108 108 A 56 PRO HDx A 55 PHE HA 1.0 1.667 3.069 109 109 A 56 PRO HDx A 56 PRO HDy 1.0 1.555 2.673 110 110 A 56 PRO HDy A 56 PRO HGy 1.0 1.786 3.596 111 111 A 56 PRO HDx A 56 PRO HGy 1.0 1.851 3.965 112 112 A 56 PRO HDx A 56 PRO HBy 1.0 1.878 4.150 113 113 A 56 PRO HDy A 56 PRO HBy 1.0 1.706 3.226 114 114 A 56 PRO HDy A 56 PRO HBx 1.0 1.866 4.064 115 115 A 41 TRP HBx A 41 TRP H 1.0 1.838 3.884 116 116 A 53 GLY H A 52 PHE HBy 1.0 1.833 3.857 117 117 A 52 PHE H A 52 PHE HBx 1.0 1.723 3.301 118 118 A 52 PHE HBy A 52 PHE HDx 1.0 1.709 3.243 119 119 A 52 PHE HBx A 52 PHE HDx 1.0 1.783 3.583 120 120 A 52 PHE HBy A 52 PHE HBx 1.0 1.481 2.445 121 121 A 52 PHE HA A 52 PHE HDx 1.0 1.793 3.631 122 122 A 52 PHE HA A 52 PHE HBy 1.0 1.706 3.224 123 123 A 52 PHE HA A 52 PHE HBx 1.0 1.806 3.700 124 124 A 45 THR HG2% A 52 PHE HA 1.0 1.851 3.965 125 125 A 45 THR HG2% A 52 PHE HA 1.0 1.756 3.446 126 126 A 59 TYR H A 59 TYR HBy 1.0 1.803 3.685 127 127 A 59 TYR HBy A 59 TYR HDx 1.0 1.844 3.920 128 128 A 59 TYR HDx A 59 TYR HBx 1.0 1.715 3.265 129 129 A 59 TYR HBy A 59 TYR HA 1.0 1.765 3.491 130 130 A 59 TYR HBx A 59 TYR HA 1.0 1.777 3.553 131 131 A 59 TYR HDx A 59 TYR HA 1.0 1.901 4.313 132 132 A 59 TYR H A 59 TYR HA 1.0 1.704 3.222 133 133 A 41 TRP HBx A 41 TRP HD1 1.0 1.819 3.771 134 134 A 8 SER HBx A 8 SER HA 1.0 1.730 3.330 135 135 A 8 SER HA A 8 SER HBy 1.0 1.633 2.939 136 136 A 8 SER H A 8 SER HBy 1.0 1.716 3.272 137 137 A 8 SER H A 8 SER HBx 1.0 1.857 4.005 138 138 A 8 SER HBy A 9 TYR H 1.0 1.798 3.660 139 139 A 8 SER HBx A 63 LEU HDx% 1.0 1.682 3.126 140 140 A 8 SER HBy A 63 LEU HDx% 1.0 1.575 2.737 141 141 A 63 LEU HG A 8 SER HBx 1.0 1.832 3.850 142 142 A 16 ILE HG2% A 16 ILE HA 1.0 1.638 2.958 143 143 A 8 SER HA A 9 TYR H 1.0 1.529 2.589 144 144 A 8 SER HA A 9 TYR HDy 1.0 1.882 4.178 145 145 A 60 VAL HGy% A 60 VAL HA 1.0 1.634 2.946 146 146 A 60 VAL HA A 12 LEU HG 1.0 1.799 3.665 147 147 A 12 LEU H A 12 LEU HBx 1.0 1.831 3.845 148 148 A 12 LEU H A 12 LEU HBy 1.0 1.819 3.777 149 149 A 13 TYR H A 12 LEU HBy 1.0 1.813 3.743 150 150 A 13 TYR HDx A 12 LEU HBy 1.0 1.852 3.972 151 151 A 13 TYR HDx A 12 LEU HBx 1.0 1.865 4.055 152 152 A 12 LEU HBy A 12 LEU HA 1.0 1.838 3.884 153 153 A 12 LEU HG A 12 LEU HBx 1.0 1.774 3.538 154 154 A 12 LEU HG A 12 LEU HBy 1.0 1.802 3.680 155 155 A 12 LEU HBx A 12 LEU HBy 1.0 1.623 2.903 156 156 A 12 LEU HBx A 12 LEU HDy% 1.0 1.643 2.977 157 157 A 12 LEU HBy A 12 LEU HDx% 1.0 1.508 2.526 158 158 A 37 CYS H A 37 CYS HBy 1.0 1.758 3.460 159 159 A 39 ASP H A 37 CYS HBx 1.0 1.859 4.021 160 160 A 37 CYS HBx A 38 ASP H 1.0 1.803 3.685 161 161 A 37 CYS HBy A 37 CYS HA 1.0 1.694 3.174 162 162 A 37 CYS HBx A 37 CYS HA 1.0 1.527 2.581 163 163 A 37 CYS HBy A 37 CYS HBx 1.0 1.433 2.309 164 164 A 38 ASP H A 37 CYS HA 1.0 1.742 3.388 165 165 A 37 CYS H A 37 CYS HA 1.0 1.690 3.164 166 166 A 55 PHE HBx A 55 PHE HA 1.0 1.681 3.125 167 167 A 55 PHE HBy A 55 PHE HA 1.0 1.659 3.037 168 168 A 58 ASN HA A 58 ASN HBx 1.0 1.681 3.125 169 169 A 59 TYR H A 58 ASN HA 1.0 1.883 4.183 170 170 A 58 ASN HA A 58 ASN HBy 1.0 1.664 3.056 171 171 A 58 ASN HBx A 58 ASN HBy 1.0 1.518 2.554 172 172 A 57 GLY H A 57 GLY HAy 1.0 1.656 3.026 173 173 A 57 GLY HAy A 57 GLY HAx 1.0 1.474 2.424 174 174 A 60 VAL HGx% A 57 GLY HAx 1.0 1.805 3.695 175 175 A 60 VAL HGx% A 57 GLY HAy 1.0 1.836 3.870 176 176 A 33 VAL HGx% A 33 VAL HB 1.0 1.574 2.732 177 177 A 62 PRO HGy A 62 PRO HDx 1.0 1.534 2.604 178 178 A 62 PRO HGy A 61 LYS HEy 1.0 1.767 3.503 179 179 A 61 LYS HEy A 62 PRO HGx 1.0 1.903 4.333 180 180 A 2 THR HB A 2 THR HG2% 1.0 1.704 3.220 181 181 A 2 THR HA A 2 THR H 1.0 1.808 3.710 182 182 A 2 THR HG2% A 2 THR HA 1.0 1.544 2.634 183 183 A 44 GLY HAx A 34 MET HGy 1.0 1.887 4.217 184 184 A 19 ASN HBy A 19 ASN HBx 1.0 1.492 2.476 185 185 A 19 ASN HBy A 20 ASP H 1.0 1.883 4.183 186 186 A 19 ASN HBy A 22 GLU H 1.0 1.808 3.710 187 187 A 19 ASN HBy A 19 ASN H 1.0 1.892 4.250 188 188 A 19 ASN HBx A 22 GLU H 1.0 1.751 3.429 189 189 A 19 ASN HBy A 19 ASN HA 1.0 1.664 3.054 190 190 A 19 ASN HBx A 19 ASN HA 1.0 1.783 3.583 191 191 A 19 ASN H A 19 ASN HA 1.0 1.765 3.491 192 192 A 20 ASP H A 19 ASN HA 1.0 1.746 3.400 193 193 A 19 ASN H A 17 PRO HA 1.0 1.898 4.298 194 194 A 28 GLY HAx A 10 GLN HGy 1.0 1.719 3.285 195 195 A 53 GLY HAx A 23 LEU HBx 1.0 1.665 3.061 196 196 A 53 GLY HAx A 53 GLY H 1.0 1.500 2.500 197 197 A 64 TYR H A 64 TYR HBx 1.0 1.744 3.394 198 198 A 64 TYR H A 64 TYR HBy 1.0 1.686 3.146 199 199 A 64 TYR HBy A 64 TYR HDx 1.0 1.678 3.110 200 200 A 64 TYR HBx A 64 TYR HDx 1.0 1.805 3.695 201 201 A 64 TYR HBx A 64 TYR HA 1.0 1.684 3.134 202 202 A 64 TYR HBy A 64 TYR HA 1.0 1.558 2.682 203 203 A 64 TYR HDx A 64 TYR HA 1.0 1.796 3.650 204 204 A 17 PRO HA A 17 PRO HBy 1.0 1.667 3.069 205 205 A 17 PRO HA A 18 GLN H 1.0 1.590 2.788 206 206 A 17 PRO HA A 17 PRO HBx 1.0 1.640 2.968 207 207 A 5 ASP H A 5 ASP HA 1.0 1.712 3.250 208 208 A 5 ASP HA A 6 LEU H 1.0 1.572 2.728 209 209 A 5 ASP HA A 5 ASP HBy 1.0 1.628 2.922 210 210 A 5 ASP H A 5 ASP HBy 1.0 1.688 3.150 211 211 A 29 ASP HBy A 25 LEU HDx% 1.0 1.858 4.012 212 212 A 32 ASP HA A 32 ASP HBy 1.0 1.639 2.961 213 213 A 46 SER H A 46 SER HBx 1.0 1.747 3.407 214 214 A 46 SER H A 46 SER HBy 1.0 1.678 3.110 215 215 A 46 SER HBy A 46 SER HA 1.0 1.667 3.067 216 216 A 54 THR HB A 43 VAL HGx% 1.0 1.805 3.695 217 217 A 46 SER HBx A 46 SER HA 1.0 1.622 2.900 218 218 A 3 SER HA A 3 SER H 1.0 1.684 3.136 219 219 A 15 TYR H A 14 SER HA 1.0 1.605 2.839 220 220 A 3 SER HA A 3 SER HBy 1.0 1.665 3.059 221 221 A 17 PRO HBy A 17 PRO HGy 1.0 1.632 2.938 222 222 A 17 PRO HBy A 17 PRO HGx 1.0 1.484 2.454 223 223 A 17 PRO HGy A 17 PRO HGx 1.0 1.540 2.626 224 224 A 17 PRO HBx A 17 PRO HGx 1.0 1.692 3.166 225 225 A 17 PRO HGy A 17 PRO HDx 1.0 1.667 3.069 226 226 A 17 PRO HGy A 24 GLU HA 1.0 1.883 4.183 227 227 A 17 PRO HA A 17 PRO HGy 1.0 1.854 3.988 228 228 A 17 PRO HGx A 24 GLU HA 1.0 1.811 3.731 229 229 A 17 PRO HA A 17 PRO HGx 1.0 1.758 3.460 230 230 A 30 ILE HG1y A 30 ILE H 1.0 1.813 3.737 231 231 A 16 ILE HA A 17 PRO HDy 1.0 1.603 2.831 232 232 A 17 PRO HDx A 24 GLU HGy 1.0 1.819 3.771 233 233 A 16 ILE HG2% A 17 PRO HDx 1.0 1.734 3.350 234 234 A 62 PRO HGx A 62 PRO HDy 1.0 1.556 2.674 235 235 A 62 PRO HDx A 62 PRO HGx 1.0 1.534 2.604 236 236 A 62 PRO HDy A 61 LYS HA 1.0 1.607 2.847 237 237 A 17 PRO HGy A 17 PRO HDy 1.0 1.806 3.700 238 238 A 17 PRO HGx A 17 PRO HDx 1.0 1.672 3.090 239 239 A 17 PRO HGx A 17 PRO HDy 1.0 1.742 3.382 240 240 A 17 PRO HDx A 24 GLU HA 1.0 1.726 3.314 241 241 A 24 GLU HA A 17 PRO HDy 1.0 1.429 2.297 242 242 A 16 ILE HA A 17 PRO HDx 1.0 1.535 2.607 243 243 A 17 PRO HDy A 24 GLU HGy 1.0 1.690 3.162 244 244 A 17 PRO HDy A 24 GLU HGx 1.0 1.492 2.476 245 245 A 17 PRO HDx A 16 ILE HD1% 1.0 1.737 3.361 246 246 A 16 ILE HG2% A 17 PRO HDy 1.0 1.761 3.477 247 247 A 17 PRO HBy A 17 PRO HDx 1.0 1.854 3.980 248 248 A 56 PRO HA A 56 PRO HGy 1.0 1.873 4.111 249 249 A 56 PRO HA A 56 PRO HGx 1.0 1.797 3.655 250 250 A 56 PRO HDy A 56 PRO HGx 1.0 1.703 3.213 251 251 A 55 PHE HBy A 56 PRO HGy 1.0 1.901 4.319 252 252 A 56 PRO HDx A 56 PRO HGx 1.0 1.635 2.949 253 253 A 56 PRO HGy A 56 PRO HGx 1.0 1.571 2.725 254 254 A 56 PRO HBy A 56 PRO HBx 1.0 1.542 2.628 255 255 A 56 PRO HGy A 56 PRO HBx 1.0 1.801 3.675 256 256 A 56 PRO HBx A 56 PRO HGx 1.0 1.933 4.605 257 257 A 56 PRO HBy A 56 PRO HGx 1.0 1.822 3.788 258 258 A 56 PRO HGy A 56 PRO HBy 1.0 1.822 3.788 259 259 A 56 PRO HA A 56 PRO HBy 1.0 1.651 3.005 260 260 A 56 PRO HA A 56 PRO HBx 1.0 1.791 3.627 261 261 A 62 PRO HA A 62 PRO HGy 1.0 1.825 3.807 262 262 A 62 PRO HGy A 62 PRO HDy 1.0 1.970 5.050 263 263 A 62 PRO HGy A 62 PRO HBy 1.0 1.730 3.330 264 264 A 62 PRO HGy A 61 LYS HA 1.0 1.897 4.287 265 265 A 62 PRO HGy A 62 PRO HBx 1.0 1.819 3.777 266 266 A 62 PRO HDx A 62 PRO HBy 1.0 1.887 4.215 267 267 A 62 PRO HA A 62 PRO HBy 1.0 1.763 3.481 268 268 A 62 PRO HDy A 62 PRO HBx 1.0 1.859 4.021 269 269 A 62 PRO HBy A 62 PRO HBx 1.0 1.474 2.424 270 270 A 62 PRO HGx A 62 PRO HBx 1.0 1.460 2.382 271 271 A 62 PRO HGx A 62 PRO HBy 1.0 1.634 2.942 272 272 A 63 LEU H A 62 PRO HBx 1.0 1.854 3.980 273 273 A 62 PRO HA A 62 PRO HGx 1.0 1.852 3.972 274 274 A 62 PRO HA A 62 PRO HBx 1.0 1.667 3.071 275 275 A 63 LEU HG A 62 PRO HA 1.0 1.854 3.988 276 276 A 42 PHE HA A 42 PHE HDx 1.0 1.742 3.388 277 277 A 42 PHE HBy A 33 VAL HGy% 1.0 1.742 3.388 278 278 A 50 LYS HA A 50 LYS H 1.0 1.565 2.705 279 279 A 41 TRP H A 37 CYS HBx 1.0 1.996 5.638 280 280 A 34 MET H A 34 MET HA 1.0 1.807 3.705 281 281 A 34 MET HBy A 35 GLU H 1.0 1.739 3.373 282 282 A 34 MET H A 34 MET HBy 1.0 1.712 3.250 283 283 A 34 MET HBy A 34 MET HA 1.0 1.664 3.056 284 284 A 34 MET HGy A 34 MET HA 1.0 1.635 2.945 285 285 A 34 MET H A 34 MET HGy 1.0 1.796 3.650 286 286 A 34 MET HBy A 34 MET HGy 1.0 1.580 2.756 287 287 A 43 VAL HB A 34 MET HGy 1.0 1.803 3.685 288 288 A 43 VAL HGx% A 34 MET HGy 1.0 1.816 3.754 289 289 A 20 ASP H A 20 ASP HA 1.0 1.920 4.486 290 290 A 20 ASP HA A 21 ASP H 1.0 1.734 3.346 291 291 A 11 ALA HA A 11 ALA HB% 1.0 1.621 2.895 292 292 A 27 ASP HA A 11 ALA HB% 1.0 1.745 3.397 293 293 A 29 ASP HBy A 11 ALA HB% 1.0 1.692 3.170 294 294 A 25 LEU HDx% A 11 ALA HB% 1.0 1.750 3.422 295 295 A 11 ALA HB% A 25 LEU HDy% 1.0 1.761 3.473 296 296 A 25 LEU HBx A 25 LEU HDy% 1.0 1.646 2.988 297 297 A 25 LEU HDy% A 25 LEU HG 1.0 1.671 3.085 298 298 A 11 ALA HB% A 25 LEU HDy% 1.0 1.730 3.330 299 299 A 25 LEU HBy A 25 LEU HDy% 1.0 1.797 3.655 300 300 A 25 LEU HBx A 25 LEU HG 1.0 1.724 3.306 301 301 A 25 LEU HBy A 25 LEU HG 1.0 1.780 3.570 302 302 A 28 GLY H A 28 GLY HAy 1.0 1.615 2.877 303 303 A 28 GLY HAx A 28 GLY H 1.0 1.612 2.864 304 304 A 28 GLY HAx A 28 GLY HAy 1.0 1.398 2.214 305 305 A 40 GLY HAx A 40 GLY HAy 1.0 1.426 2.288 306 306 A 10 GLN HGy A 28 GLY HAy 1.0 1.761 3.473 307 307 A 13 TYR HA A 27 ASP HBx 1.0 1.851 3.965 308 308 A 27 ASP HA A 27 ASP HBx 1.0 1.763 3.481 309 309 A 13 TYR HA A 27 ASP HBy 1.0 1.816 3.760 310 310 A 28 GLY H A 27 ASP HBx 1.0 1.838 3.884 311 311 A 27 ASP HBx A 27 ASP H 1.0 1.715 3.267 312 312 A 27 ASP HA A 28 GLY H 1.0 1.504 2.510 313 313 A 27 ASP HA A 27 ASP H 1.0 1.728 3.322 314 314 A 13 TYR H A 27 ASP HA 1.0 1.858 4.012 315 315 A 13 TYR HA A 27 ASP HA 1.0 1.888 4.220 316 316 A 27 ASP HA A 27 ASP HBy 1.0 1.656 3.028 317 317 A 44 GLY HAx A 34 MET HBy 1.0 1.946 4.750 318 318 A 53 GLY HAx A 23 LEU HDy% 1.0 1.690 3.164 319 319 A 23 LEU HA A 23 LEU HDy% 1.0 1.876 4.130 320 320 A 52 PHE HA A 23 LEU HDy% 1.0 1.822 3.788 321 321 A 55 PHE HDx A 23 LEU HDy% 1.0 1.774 3.538 322 322 A 40 GLY HAy A 40 GLY H 1.0 1.651 3.005 323 323 A 40 GLY HAx A 40 GLY H 1.0 1.672 3.086 324 324 A 15 TYR HBx A 25 LEU HDx% 1.0 1.760 3.470 325 325 A 15 TYR HBy A 25 LEU HDx% 1.0 1.866 4.064 326 326 A 29 ASP HBy A 29 ASP HA 1.0 1.637 2.957 327 327 A 39 ASP HBx A 39 ASP HBy 1.0 1.477 2.433 328 328 A 38 ASP HBy A 38 ASP HA 1.0 1.635 2.949 329 329 A 39 ASP HBy A 39 ASP HA 1.0 1.594 2.800 330 330 A 39 ASP HBx A 39 ASP HA 1.0 1.648 2.996 331 331 A 40 GLY H A 39 ASP HA 1.0 1.791 3.627 332 332 A 20 ASP HA A 20 ASP HBy 1.0 1.524 2.574 333 333 A 39 ASP H A 38 ASP HA 1.0 1.851 3.965 334 334 A 20 ASP H A 20 ASP HBy 1.0 1.801 3.675 335 335 A 21 ASP H A 20 ASP HBy 1.0 1.906 4.358 336 336 A 21 ASP HBy A 21 ASP HA 1.0 1.644 2.982 337 337 A 21 ASP HA A 21 ASP HBx 1.0 1.652 3.012 338 338 A 21 ASP HBy A 21 ASP HBx 1.0 1.472 2.416 339 339 A 21 ASP H A 21 ASP HBx 1.0 1.802 3.680 340 340 A 21 ASP H A 21 ASP HBy 1.0 1.854 3.988 341 341 A 54 THR HG2% A 54 THR H 1.0 1.630 2.930 342 342 A 22 GLU HA A 54 THR HG2% 1.0 1.752 3.432 343 343 A 54 THR HG2% A 21 ASP HBy 1.0 1.834 3.864 344 344 A 54 THR HG2% A 22 GLU HGy 1.0 1.646 2.988 345 345 A 54 THR HB A 54 THR HG2% 1.0 1.651 3.007 346 346 A 54 THR HA A 54 THR H 1.0 1.872 4.100 347 347 A 45 THR HG2% A 46 SER H 1.0 1.634 2.944 348 348 A 25 LEU HBy A 25 LEU HBx 1.0 1.568 2.714 349 349 A 25 LEU HBx A 25 LEU HDx% 1.0 1.798 3.660 350 350 A 15 TYR HBy A 25 LEU HBy 1.0 1.832 3.850 351 351 A 25 LEU HBy A 25 LEU HA 1.0 1.830 3.838 352 352 A 25 LEU HBx A 25 LEU HA 1.0 1.767 3.503 353 353 A 15 TYR HBx A 25 LEU HG 1.0 1.808 3.716 354 354 A 29 ASP HBy A 25 LEU HDy% 1.0 1.817 3.765 355 355 A 25 LEU HDy% A 25 LEU HA 1.0 1.663 3.053 356 356 A 25 LEU HDy% A 26 ARG H 1.0 1.737 3.361 357 357 A 13 TYR HDx A 12 LEU HDx% 1.0 1.859 4.021 358 358 A 25 LEU HDx% A 25 LEU H 1.0 1.945 4.733 359 359 A 25 LEU HDx% A 15 TYR H 1.0 1.780 3.566 360 360 A 25 LEU HDx% A 25 LEU HA 1.0 1.768 3.510 361 361 A 12 LEU H A 12 LEU HDx% 1.0 1.734 3.350 362 362 A 52 PHE H A 23 LEU HDx% 1.0 1.849 3.949 363 363 A 43 VAL HB A 43 VAL HGy% 1.0 1.640 2.966 364 364 A 43 VAL HB A 35 GLU H 1.0 1.736 3.358 365 365 A 44 GLY H A 43 VAL HB 1.0 1.696 3.184 366 366 A 43 VAL HB A 43 VAL HGx% 1.0 1.484 2.454 367 367 A 43 VAL HA A 43 VAL HGx% 1.0 1.704 3.218 368 368 A 44 GLY H A 43 VAL HGx% 1.0 1.616 2.880 369 369 A 54 THR HB A 43 VAL HGy% 1.0 1.554 2.670 370 370 A 43 VAL H A 43 VAL HGy% 1.0 1.793 3.631 371 371 A 54 THR HA A 43 VAL HGy% 1.0 1.845 3.927 372 372 A 42 PHE HA A 43 VAL HGy% 1.0 1.883 4.179 373 373 A 43 VAL HA A 43 VAL HGy% 1.0 1.728 3.324 374 374 A 54 THR HA A 43 VAL HGx% 1.0 1.857 4.005 375 375 A 18 GLN HGy A 18 GLN HA 1.0 1.735 3.353 376 376 A 18 GLN H A 18 GLN HGy 1.0 1.953 4.817 377 377 A 18 GLN HGy A 18 GLN HBx 1.0 1.637 2.955 378 378 A 51 GLN H A 51 GLN HGy 1.0 1.623 2.905 379 379 A 18 GLN HA A 18 GLN HBy 1.0 1.684 3.134 380 380 A 18 GLN HGy A 18 GLN HBy 1.0 1.642 2.974 381 381 A 18 GLN HBx A 18 GLN HBy 1.0 1.414 2.256 382 382 A 18 GLN HA A 18 GLN HBx 1.0 1.751 3.429 383 383 A 18 GLN HA A 18 GLN HGx 1.0 1.773 3.533 384 384 A 18 GLN H A 18 GLN HA 1.0 1.627 2.917 385 385 A 23 LEU HBy A 23 LEU HG 1.0 1.749 3.419 386 386 A 23 LEU HBx A 23 LEU HG 1.0 1.813 3.743 387 387 A 23 LEU HBx A 23 LEU HBy 1.0 1.549 2.651 388 388 A 23 LEU HBx A 23 LEU HDy% 1.0 1.777 3.553 389 389 A 55 PHE HBx A 23 LEU HBy 1.0 1.899 4.309 390 390 A 23 LEU HA A 23 LEU HBy 1.0 1.861 4.029 391 391 A 23 LEU HA A 23 LEU HBx 1.0 1.777 3.549 392 392 A 55 PHE HDx A 23 LEU HBy 1.0 1.767 3.503 393 393 A 55 PHE HDx A 23 LEU HBx 1.0 1.903 4.339 394 394 A 23 LEU H A 23 LEU HBy 1.0 1.791 3.623 395 395 A 23 LEU H A 23 LEU HBx 1.0 1.827 3.819 396 396 A 6 LEU HG A 6 LEU HA 1.0 1.587 2.777 397 397 A 16 ILE HD1% A 16 ILE HG1y 1.0 1.578 2.750 398 398 A 23 LEU HDy% A 23 LEU HBy 1.0 1.640 2.964 399 399 A 23 LEU HDy% A 23 LEU HG 1.0 1.617 2.883 400 400 A 52 PHE HA A 23 LEU HDx% 1.0 1.713 3.255 401 401 A 23 LEU HA A 23 LEU HDx% 1.0 1.582 2.760 402 402 A 53 GLY HAx A 23 LEU HDx% 1.0 1.523 2.571 403 403 A 23 LEU HA A 23 LEU HG 1.0 1.868 4.078 404 404 A 10 GLN HA A 10 GLN HGy 1.0 1.724 3.308 405 405 A 10 GLN HBy A 10 GLN HBx 1.0 1.408 2.240 406 406 A 10 GLN HBy A 63 LEU HDy% 1.0 1.648 2.996 407 407 A 31 VAL H A 10 GLN HA 1.0 1.849 3.957 408 408 A 36 LYS HEy A 36 LYS HDy 1.0 1.682 3.126 409 409 A 36 LYS HDy A 36 LYS HEx 1.0 1.684 3.138 410 410 A 36 LYS HEy A 36 LYS HGy 1.0 1.714 3.260 411 411 A 36 LYS HEx A 36 LYS HGy 1.0 1.707 3.229 412 412 A 36 LYS HEy A 36 LYS HGx 1.0 1.865 4.057 413 413 A 36 LYS HEy A 36 LYS HBy 1.0 1.881 4.169 414 414 A 36 LYS HEx A 36 LYS HBy 1.0 1.920 4.486 415 415 A 36 LYS HDy A 36 LYS HGx 1.0 1.672 3.090 416 416 A 36 LYS HDy A 36 LYS HGy 1.0 1.671 3.081 417 417 A 36 LYS HEx A 36 LYS HGx 1.0 1.806 3.700 418 418 A 36 LYS HA A 36 LYS HGx 1.0 1.914 4.432 419 419 A 36 LYS HGy A 36 LYS HGx 1.0 1.513 2.539 420 420 A 36 LYS H A 36 LYS HBy 1.0 1.676 3.102 421 421 A 36 LYS HDy A 36 LYS HBy 1.0 1.564 2.702 422 422 A 36 LYS HGy A 36 LYS HBy 1.0 1.578 2.746 423 423 A 36 LYS HGx A 36 LYS HBy 1.0 1.681 3.125 424 424 A 36 LYS HA A 42 PHE HDx 1.0 1.772 3.526 425 425 A 36 LYS HA A 36 LYS HBy 1.0 1.643 2.977 426 426 A 23 LEU H A 22 GLU HA 1.0 1.607 2.845 427 427 A 22 GLU HA A 54 THR H 1.0 1.587 2.775 428 428 A 22 GLU HA A 22 GLU HGy 1.0 1.791 3.627 429 429 A 22 GLU H A 22 GLU HGy 1.0 1.770 3.518 430 430 A 22 GLU HA A 22 GLU H 1.0 1.805 3.695 431 431 A 22 GLU HA A 22 GLU HBy 1.0 1.723 3.303 432 432 A 47 ARG HDx A 47 ARG HGy 1.0 1.519 2.559 433 433 A 30 ILE HG2% A 47 ARG HDx 1.0 1.757 3.453 434 434 A 47 ARG HDx A 47 ARG HDy 1.0 1.598 2.816 435 435 A 30 ILE H A 47 ARG HDy 1.0 1.869 4.083 436 436 A 30 ILE H A 47 ARG HDx 1.0 1.726 3.316 437 437 A 48 ARG HDx A 48 ARG HDy 1.0 1.521 2.565 438 438 A 48 ARG HDy A 48 ARG HBy 1.0 1.840 3.898 439 439 A 48 ARG HDy A 48 ARG HGy 1.0 1.569 2.717 440 440 A 48 ARG HDx A 48 ARG HGy 1.0 1.573 2.729 441 441 A 48 ARG HDx A 48 ARG HBy 1.0 1.660 3.042 442 442 A 50 LYS HGy A 50 LYS HBx 1.0 1.619 2.887 443 443 A 50 LYS HGy A 50 LYS HEx 1.0 1.841 3.905 444 444 A 50 LYS HEx A 50 LYS HGx 1.0 1.726 3.314 445 445 A 50 LYS H A 50 LYS HGx 1.0 1.901 4.315 446 446 A 50 LYS HGy A 50 LYS HDy 1.0 1.637 2.953 447 447 A 50 LYS HGx A 50 LYS HDy 1.0 1.544 2.638 448 448 A 50 LYS HDy A 50 LYS HEy 1.0 1.560 2.686 449 449 A 50 LYS HEx A 50 LYS HDy 1.0 1.665 3.061 450 450 A 50 LYS HGy A 50 LYS HEy 1.0 1.791 3.623 451 451 A 33 VAL HGy% A 36 LYS HGx 1.0 1.825 3.807 452 452 A 33 VAL HB A 33 VAL HGy% 1.0 1.574 2.734 453 453 A 42 PHE HBx A 33 VAL HGy% 1.0 1.679 3.117 454 454 A 33 VAL HA A 33 VAL HGy% 1.0 1.725 3.311 455 455 A 42 PHE HA A 33 VAL HGy% 1.0 1.873 4.111 456 456 A 33 VAL HGy% A 35 GLU H 1.0 1.708 3.238 457 457 A 43 VAL H A 33 VAL HGy% 1.0 1.789 3.609 458 458 A 34 MET H A 33 VAL HGy% 1.0 1.679 3.115 459 459 A 42 PHE HBx A 33 VAL HGx% 1.0 1.858 4.012 460 460 A 33 VAL HGx% A 33 VAL HGy% 1.0 1.876 4.130 461 461 A 42 PHE HBy A 33 VAL HGx% 1.0 1.832 3.850 462 462 A 33 VAL HA A 33 VAL HGx% 1.0 1.749 3.419 463 463 A 32 ASP HA A 33 VAL HGx% 1.0 1.802 3.680 464 464 A 33 VAL H A 33 VAL HGx% 1.0 1.627 2.917 465 465 A 33 VAL H A 33 VAL HB 1.0 1.670 3.080 466 466 A 33 VAL HA A 33 VAL HB 1.0 1.773 3.533 467 467 A 33 VAL HA A 34 MET HGy 1.0 1.924 4.514 468 468 A 33 VAL HA A 35 GLU H 1.0 1.780 3.566 469 469 A 31 VAL HGx% A 31 VAL HB 1.0 1.540 2.626 470 470 A 9 TYR HBx A 31 VAL HGx% 1.0 1.723 3.297 471 471 A 9 TYR HBy A 31 VAL HGx% 1.0 1.889 4.225 472 472 A 31 VAL H A 31 VAL HGx% 1.0 1.621 2.895 473 473 A 31 VAL HB A 31 VAL HA 1.0 1.776 3.546 474 474 A 32 ASP H A 31 VAL HB 1.0 1.840 3.898 475 475 A 31 VAL H A 31 VAL HB 1.0 1.791 3.627 476 476 A 60 VAL HGy% A 11 ALA HA 1.0 1.635 2.947 477 477 A 9 TYR HBx A 60 VAL HGy% 1.0 1.698 3.194 478 478 A 60 VAL HGy% A 60 VAL HGx% 1.0 1.790 3.618 479 479 A 60 VAL HA A 11 ALA HA 1.0 1.616 2.876 480 480 A 60 VAL HA A 59 TYR HDx 1.0 1.849 3.957 481 481 A 60 VAL HA A 12 LEU H 1.0 1.676 3.104 482 482 A 60 VAL HA A 61 LYS H 1.0 1.622 2.898 483 483 A 30 ILE HG2% A 30 ILE HB 1.0 1.486 2.458 484 484 A 30 ILE HA A 30 ILE HG2% 1.0 1.672 3.090 485 485 A 30 ILE HG2% A 30 ILE HG1x 1.0 1.786 3.600 486 486 A 29 ASP H A 29 ASP HBy 1.0 1.678 3.112 487 487 A 24 GLU HGy A 24 GLU HGx 1.0 1.419 2.269 488 488 A 24 GLU HGy A 16 ILE HD1% 1.0 1.816 3.760 489 489 A 26 ARG HDx A 26 ARG HA 1.0 1.874 4.120 490 490 A 26 ARG HA A 26 ARG HDy 1.0 1.443 2.337 491 491 A 26 ARG HDx A 26 ARG HGy 1.0 1.643 2.975 492 492 A 26 ARG HDy A 26 ARG HGy 1.0 1.901 4.323 493 493 A 26 ARG HDx A 26 ARG HGx 1.0 1.708 3.236 494 494 A 26 ARG HDy A 26 ARG HGx 1.0 1.900 4.312 495 495 A 26 ARG HA A 26 ARG HGx 1.0 1.797 3.655 496 496 A 26 ARG HA A 26 ARG HGy 1.0 1.779 3.561 497 497 A 26 ARG HDx A 26 ARG HBy 1.0 1.679 3.119 498 498 A 26 ARG HDy A 26 ARG HBy 1.0 1.864 4.044 499 499 A 26 ARG HDx A 26 ARG HBx 1.0 1.797 3.655 500 500 A 26 ARG HDy A 26 ARG HBx 1.0 1.919 4.471 501 501 A 26 ARG HA A 26 ARG HBy 1.0 1.746 3.404 502 502 A 26 ARG HA A 26 ARG HBx 1.0 1.733 3.343 503 503 A 26 ARG H A 26 ARG HBy 1.0 1.849 3.957 504 504 A 26 ARG H A 26 ARG HBx 1.0 1.802 3.680 505 505 A 61 LYS HA A 61 LYS H 1.0 1.789 3.609 506 506 A 49 THR HB A 49 THR H 1.0 1.665 3.059 507 507 A 49 THR H A 49 THR HG2% 1.0 1.622 2.900 508 508 A 49 THR HG2% A 49 THR HA 1.0 1.799 3.665 509 509 A 49 THR HB A 49 THR HG2% 1.0 1.576 2.742 510 510 A 48 ARG H A 47 ARG HA 1.0 1.712 3.252 511 511 A 49 THR H A 48 ARG HA 1.0 1.841 3.905 512 512 A 47 ARG HA A 47 ARG H 1.0 1.777 3.549 513 513 A 48 ARG HGy A 48 ARG HA 1.0 1.796 3.650 514 514 A 47 ARG HA A 47 ARG HGx 1.0 1.521 2.565 515 515 A 47 ARG HA A 47 ARG HBy 1.0 1.633 2.937 516 516 A 47 ARG HDx A 47 ARG HBy 1.0 1.742 3.382 517 517 A 47 ARG HGy A 47 ARG H 1.0 1.849 3.957 518 518 A 47 ARG H A 47 ARG HGx 1.0 1.822 3.794 519 519 A 30 ILE H A 47 ARG HGy 1.0 1.756 3.446 520 520 A 47 ARG HGy A 47 ARG HA 1.0 1.804 3.690 521 521 A 47 ARG HDy A 47 ARG HBy 1.0 1.651 3.009 522 522 A 47 ARG HDy A 47 ARG HA 1.0 1.701 3.207 523 523 A 45 THR HA A 45 THR HG2% 1.0 1.704 3.220 524 524 A 45 THR HA A 23 LEU HDx% 1.0 1.894 4.266 525 525 A 45 THR HA A 45 THR HB 1.0 1.685 3.141 526 526 A 45 THR H A 45 THR HB 1.0 1.657 3.033 527 527 A 25 LEU HBy A 25 LEU HDx% 1.0 1.573 2.731 528 528 A 25 LEU HDx% A 25 LEU HG 1.0 1.610 2.856 529 529 A 12 LEU HG A 12 LEU HDy% 1.0 1.465 2.397 530 530 A 16 ILE HG2% A 16 ILE HG1y 1.0 1.802 3.680 531 531 A 16 ILE HA A 16 ILE HG1x 1.0 1.718 3.282 532 532 A 16 ILE HG1y A 16 ILE H 1.0 1.845 3.927 533 533 A 16 ILE HD1% A 16 ILE HG1x 1.0 1.577 2.741 534 534 A 16 ILE HG1y A 16 ILE HG1x 1.0 1.361 2.117 535 535 A 16 ILE HD1% A 16 ILE HB 1.0 1.763 3.485 536 536 A 16 ILE HG1x A 16 ILE HB 1.0 1.706 3.226 537 537 A 16 ILE HG2% A 16 ILE HB 1.0 1.513 2.541 538 538 A 16 ILE HA A 16 ILE HB 1.0 1.744 3.394 539 539 A 16 ILE H A 16 ILE HB 1.0 1.652 3.012 540 540 A 16 ILE HA A 16 ILE HD1% 1.0 1.339 2.061 541 541 A 16 ILE HA A 16 ILE H 1.0 1.808 3.710 542 542 A 12 LEU HG A 12 LEU HDx% 1.0 1.622 2.898 543 543 A 12 LEU H A 12 LEU HG 1.0 1.774 3.538 544 544 A 12 LEU HA A 12 LEU HDy% 1.0 1.657 3.029 545 545 A 12 LEU H A 12 LEU HDy% 1.0 1.790 3.618 546 546 A 61 LYS H A 12 LEU HDy% 1.0 1.867 4.073 547 547 A 12 LEU HA A 12 LEU HDy% 1.0 1.720 3.288 548 548 A 12 LEU HBx A 12 LEU HA 1.0 1.681 3.125 549 549 A 12 LEU HG A 12 LEU HA 1.0 1.827 3.819 550 550 A 13 TYR H A 12 LEU HA 1.0 1.804 3.690 551 551 A 12 LEU H A 12 LEU HA 1.0 1.780 3.570 552 552 A 24 GLU HA A 24 GLU HGx 1.0 1.600 2.824 553 553 A 24 GLU HA A 25 LEU H 1.0 1.640 2.966 554 554 A 24 GLU HA A 24 GLU HGy 1.0 1.714 3.260 555 555 A 16 ILE HA A 24 GLU HGy 1.0 1.728 3.324 556 556 A 16 ILE HA A 24 GLU HGx 1.0 1.811 3.731 557 557 A 24 GLU H A 24 GLU HGx 1.0 1.896 4.280 558 558 A 24 GLU HGx A 25 LEU H 1.0 1.875 4.127 559 559 A 24 GLU HGx A 16 ILE HD1% 1.0 1.718 3.280 560 560 A 15 TYR H A 14 SER HBy 1.0 1.671 3.083 561 561 A 26 ARG HA A 14 SER HBy 1.0 1.662 3.046 562 562 A 14 SER HA A 14 SER HBy 1.0 1.561 2.689 563 563 A 25 LEU HBy A 14 SER HA 1.0 1.859 4.021 564 564 A 30 ILE HA A 30 ILE HG1y 1.0 1.673 3.093 565 565 A 30 ILE HA A 31 VAL HGx% 1.0 1.873 4.105 566 566 A 30 ILE HA A 30 ILE HB 1.0 1.888 4.218 567 567 A 30 ILE HB A 30 ILE HG1x 1.0 1.772 3.526 568 568 A 30 ILE HA A 30 ILE HD1% 1.0 1.704 3.222 569 569 A 30 ILE HD1% A 30 ILE HB 1.0 1.683 3.133 570 570 A 30 ILE HD1% A 30 ILE HG1y 1.0 1.462 2.390 571 571 A 30 ILE HD1% A 30 ILE H 1.0 1.803 3.685 572 572 A 30 ILE HG1y A 30 ILE HG1x 1.0 1.472 2.420 573 573 A 30 ILE HD1% A 30 ILE HG1x 1.0 1.636 2.952 574 574 A 30 ILE HA A 30 ILE HG1x 1.0 1.793 3.631 575 575 A 30 ILE H A 30 ILE HG1x 1.0 1.874 4.120 576 576 A 30 ILE HG2% A 8 SER HBx 1.0 1.880 4.162 577 577 A 30 ILE HG2% A 8 SER HBy 1.0 1.871 4.093 578 578 A 30 ILE HG2% A 8 SER HA 1.0 1.858 4.012 579 579 A 61 LYS HEy A 61 LYS HDy 1.0 1.484 2.454 580 580 A 6 LEU H A 6 LEU HG 1.0 1.801 3.675 581 581 A 6 LEU HA A 6 LEU HDy% 1.0 1.514 2.542 582 582 A 6 LEU HA A 6 LEU HBx 1.0 1.646 2.988 583 583 A 6 LEU HA A 6 LEU HBy 1.0 1.684 3.134 584 584 A 63 LEU HA A 63 LEU HBy 1.0 1.638 2.960 585 585 A 6 LEU H A 6 LEU HBy 1.0 1.763 3.481 586 586 A 6 LEU H A 6 LEU HBx 1.0 1.763 3.481 587 587 A 63 LEU HA A 63 LEU HBx 1.0 1.648 2.996 588 588 A 6 LEU HBy A 6 LEU HDx% 1.0 1.574 2.732 589 589 A 6 LEU HBx A 6 LEU HDx% 1.0 1.421 2.275 590 590 A 63 LEU HDy% A 63 LEU HBx 1.0 1.854 3.988 591 591 A 63 LEU HDy% A 63 LEU HBy 1.0 1.753 3.439 592 592 A 6 LEU HBy A 7 PHE H 1.0 1.737 3.361 593 593 A 6 LEU HBx A 7 PHE H 1.0 1.836 3.870 594 594 A 63 LEU HG A 63 LEU HDy% 1.0 1.455 2.371 595 595 A 6 LEU HDy% A 6 LEU HBx 1.0 1.796 3.650 596 596 A 6 LEU HDy% A 6 LEU HBy 1.0 1.518 2.556 597 597 A 61 LYS HEy A 61 LYS HGx 1.0 1.793 3.631 598 598 A 61 LYS HEy A 61 LYS HGy 1.0 1.682 3.126 599 599 A 62 PRO HDx A 61 LYS HEy 1.0 1.602 2.832 600 600 A 12 LEU HDy% A 61 LYS HDy 1.0 1.657 3.029 601 601 A 61 LYS HDy A 61 LYS HGy 1.0 1.637 2.955 602 602 A 61 LYS HDy A 61 LYS HGx 1.0 1.536 2.610 603 603 A 61 LYS H A 61 LYS HGy 1.0 1.805 3.695 604 604 A 61 LYS H A 61 LYS HGx 1.0 1.803 3.685 605 605 A 62 PRO HDx A 61 LYS HBx 1.0 1.816 3.754 606 606 A 62 PRO HDx A 61 LYS HBy 1.0 1.395 2.205 607 607 A 61 LYS HGx A 61 LYS HBy 1.0 1.667 3.067 608 608 A 61 LYS HGy A 61 LYS HBx 1.0 1.712 3.252 609 609 A 12 LEU HDy% A 61 LYS HBx 1.0 1.682 3.126 610 610 A 62 PRO HDx A 61 LYS HA 1.0 1.506 2.518 611 611 A 61 LYS HA A 61 LYS HBy 1.0 1.685 3.141 612 612 A 61 LYS HA A 61 LYS HBx 1.0 1.683 3.133 613 613 A 61 LYS HA A 61 LYS HGy 1.0 1.789 3.609 614 614 A 60 VAL HGy% A 61 LYS HA 1.0 1.861 4.029 615 615 A 17 PRO HBy A 17 PRO HBx 1.0 1.422 2.280 616 616 A 17 PRO HBx A 17 PRO HGy 1.0 1.601 2.825 617 617 A 63 LEU HDy% A 63 LEU HA 1.0 1.481 2.445 618 618 A 64 TYR H A 63 LEU HA 1.0 1.515 2.545 619 619 A 63 LEU H A 63 LEU HBy 1.0 1.813 3.743 620 620 A 63 LEU H A 63 LEU HBx 1.0 1.683 3.133 621 621 A 63 LEU H A 63 LEU HDy% 1.0 1.742 3.382 622 622 A 10 GLN H A 9 TYR HBy 1.0 1.679 3.115 623 623 A 8 SER HBy A 63 LEU HBx 1.0 1.917 4.455 624 624 A 35 GLU HA A 35 GLU HBy 1.0 1.660 3.042 625 625 A 35 GLU HA A 35 GLU H 1.0 1.715 3.265 626 626 A 43 VAL HGy% A 35 GLU HBy 1.0 1.885 4.195 627 627 A 35 GLU HGy A 35 GLU HBy 1.0 1.551 2.657 628 628 A 36 LYS H A 35 GLU HGy 1.0 1.729 3.327 629 629 A 48 ARG HBy A 48 ARG H 1.0 1.427 2.291 630 630 A 48 ARG HA A 48 ARG HBx 1.0 1.804 3.690 631 631 A 48 ARG HBy A 48 ARG HBx 1.0 1.594 2.802 632 632 A 50 LYS HA A 50 LYS HBy 1.0 1.507 2.523 633 633 A 50 LYS HA A 50 LYS HGx 1.0 1.829 3.831 634 634 A 50 LYS HA A 50 LYS HGy 1.0 1.878 4.144 635 635 A 50 LYS HA A 50 LYS HBx 1.0 1.761 3.477 636 636 A 50 LYS HGx A 50 LYS HBy 1.0 1.692 3.166 637 637 A 50 LYS HGy A 50 LYS HBy 1.0 1.842 3.912 638 638 A 50 LYS HBx A 50 LYS HGx 1.0 1.712 3.250 639 639 A 50 LYS HA A 50 LYS HDy 1.0 1.761 3.477 640 640 A 5 ASP H A 4 GLN HGy 1.0 1.854 3.980 641 641 A 4 GLN HBy A 4 GLN HA 1.0 1.637 2.953 642 642 A 4 GLN HA A 4 GLN HBx 1.0 1.647 2.993 643 643 A 4 GLN HGy A 4 GLN HA 1.0 1.727 3.319 644 644 A 43 VAL H A 43 VAL HA 1.0 1.886 4.202 645 645 A 51 GLN H A 51 GLN HA 1.0 1.609 2.857 646 646 A 50 LYS HA A 51 GLN H 1.0 1.748 3.412 647 647 A 34 MET H A 35 GLU H 1.0 1.703 3.211 648 648 A 43 VAL H A 35 GLU H 1.0 1.806 3.706 649 649 A 46 SER H A 51 GLN H 1.0 1.811 3.731 650 650 A 36 LYS H A 35 GLU H 1.0 1.994 5.578 651 651 A 45 THR H A 45 THR HA 1.0 1.881 4.167 652 652 A 45 THR H A 32 ASP H 1.0 1.766 3.496 653 653 A 34 MET HA A 35 GLU H 1.0 1.998 6.214 654 654 A 31 VAL H A 31 VAL HA 1.0 1.932 4.588 655 655 A 11 ALA H A 11 ALA HA 1.0 1.840 3.900 656 656 A 30 ILE HA A 11 ALA H 1.0 1.833 3.855 657 657 A 11 ALA H A 12 LEU H 1.0 1.982 5.252 658 658 A 32 ASP H A 31 VAL HA 1.0 1.683 3.135 659 659 A 25 LEU HA A 26 ARG H 1.0 1.551 2.661 660 660 A 45 THR HA A 46 SER H 1.0 1.639 2.963 661 661 A 22 GLU H A 19 ASN H 1.0 1.822 3.788 662 662 A 60 VAL H A 59 TYR H 1.0 1.716 3.270 663 663 A 59 TYR H A 58 ASN H 1.0 1.745 3.399 664 664 A 59 TYR H A 59 TYR HDx 1.0 1.820 3.784 665 665 A 10 GLN H A 61 LYS H 1.0 1.776 3.542 666 666 A 10 GLN H A 10 GLN HA 1.0 1.873 4.113 667 667 A 64 TYR H A 64 TYR HDx 1.0 1.839 3.891 668 668 A 57 GLY H A 42 PHE H 1.0 1.701 3.205 669 669 A 54 THR HA A 55 PHE H 1.0 1.703 3.213 670 670 A 42 PHE H A 55 PHE H 1.0 1.854 3.984 671 671 A 44 GLY H A 53 GLY H 1.0 1.789 3.613 672 672 A 50 LYS H A 51 GLN H 1.0 1.766 3.498 673 673 A 49 THR H A 48 ARG H 1.0 1.767 3.503 674 674 A 50 LYS H A 48 ARG H 1.0 1.859 4.017 675 675 A 50 LYS H A 49 THR H 1.0 1.650 3.004 676 676 A 48 ARG H A 47 ARG H 1.0 1.768 3.508 677 677 A 52 PHE H A 51 GLN HA 1.0 1.614 2.872 678 678 A 46 SER H A 23 LEU HDx% 1.0 1.793 3.637 679 679 A 46 SER H A 23 LEU HDy% 1.0 1.806 3.702 680 680 A 41 TRP H A 40 GLY H 1.0 1.737 3.363 681 681 A 39 ASP H A 40 GLY H 1.0 1.744 3.392 682 682 A 39 ASP H A 38 ASP H 1.0 1.917 4.449 683 683 A 8 SER H A 9 TYR H 1.0 1.997 5.691 684 684 A 11 ALA H A 29 ASP H 1.0 1.911 4.403 685 685 A 15 TYR H A 25 LEU H 1.0 1.824 3.800 686 686 A 19 ASN H A 18 GLN H 1.0 1.681 3.121 687 687 A 22 GLU H A 21 ASP H 1.0 1.718 3.278 688 688 A 20 ASP H A 21 ASP H 1.0 1.675 3.101 689 689 A 13 TYR H A 12 LEU H 1.0 1.675 3.101 690 690 A 15 TYR HDx A 16 ILE H 1.0 1.841 3.905 691 691 A 13 TYR H A 13 TYR HDx 1.0 1.873 4.107 692 692 A 6 LEU H A 7 PHE H 1.0 1.904 4.346 693 693 A 5 ASP H A 6 LEU H 1.0 1.923 4.513 694 694 A 9 TYR H A 9 TYR HDy 1.0 1.851 3.969 695 695 A 9 TYR HA A 9 TYR H 1.0 1.856 3.996 696 696 A 8 SER HBx A 9 TYR H 1.0 1.798 3.660 697 697 A 9 TYR HBx A 9 TYR H 1.0 1.672 3.086 698 698 A 9 TYR HBy A 9 TYR H 1.0 1.886 4.202 699 699 A 30 ILE HG2% A 9 TYR H 1.0 1.765 3.493 700 700 A 9 TYR H A 31 VAL HGx% 1.0 1.884 4.188 701 701 A 59 TYR H A 56 PRO HBy 1.0 1.901 4.319 702 702 A 7 PHE HDx A 7 PHE H 1.0 1.758 3.458 703 703 A 8 SER H A 8 SER HA 1.0 1.798 3.660 704 704 A 11 ALA H A 10 GLN HBx 1.0 1.920 4.480 705 705 A 11 ALA H A 10 GLN HGy 1.0 1.770 3.516 706 706 A 13 TYR HA A 13 TYR H 1.0 1.879 4.153 707 707 A 15 TYR HA A 16 ILE H 1.0 1.608 2.848 708 708 A 55 PHE HDx A 55 PHE H 1.0 1.712 3.254 709 709 A 42 PHE H A 42 PHE HDx 1.0 1.861 4.029 710 710 A 42 PHE HA A 42 PHE H 1.0 1.651 3.005 711 711 A 41 TRP HBy A 42 PHE H 1.0 1.964 4.956 712 712 A 41 TRP HBx A 42 PHE H 1.0 1.859 4.023 713 713 A 43 VAL H A 42 PHE HDx 1.0 1.917 4.459 714 714 A 41 TRP H A 41 TRP HD1 1.0 1.759 3.465 715 715 A 37 CYS HBy A 39 ASP H 1.0 1.767 3.501 716 716 A 37 CYS H A 37 CYS HBx 1.0 1.846 3.934 717 717 A 37 CYS H A 36 LYS HBy 1.0 1.888 4.224 718 718 A 60 VAL H A 59 TYR HA 1.0 1.798 3.656 719 719 A 60 VAL HA A 60 VAL H 1.0 1.854 3.984 720 720 A 60 VAL HGy% A 60 VAL H 1.0 1.923 4.513 721 721 A 38 ASP H A 38 ASP HA 1.0 1.849 3.953 722 722 A 59 TYR HDx A 58 ASN H 1.0 1.999 5.863 723 723 A 58 ASN HA A 58 ASN H 1.0 1.814 3.742 724 724 A 58 ASN HBy A 58 ASN H 1.0 1.794 3.634 725 725 A 58 ASN HBx A 58 ASN H 1.0 1.839 3.891 726 726 A 57 GLY HAx A 58 ASN H 1.0 1.883 4.181 727 727 A 57 GLY HAy A 58 ASN H 1.0 1.810 3.720 728 728 A 56 PRO HBx A 58 ASN H 1.0 1.849 3.953 729 729 A 56 PRO HBy A 58 ASN H 1.0 1.742 3.384 730 730 A 57 GLY H A 57 GLY HAx 1.0 1.616 2.880 731 731 A 57 GLY H A 56 PRO HBy 1.0 1.883 4.181 732 732 A 57 GLY H A 58 ASN H 1.0 1.805 3.699 733 733 A 19 ASN HBy A 21 ASP H 1.0 1.579 2.751 734 734 A 19 ASN HBx A 19 ASN H 1.0 1.805 3.695 735 735 A 19 ASN H A 18 GLN HGx 1.0 1.850 3.958 736 736 A 19 ASN H A 18 GLN HBx 1.0 1.535 2.607 737 737 A 19 ASN H A 18 GLN HA 1.0 1.788 3.610 738 738 A 5 ASP H A 4 GLN HA 1.0 1.468 2.406 739 739 A 32 ASP H A 32 ASP HBy 1.0 1.650 3.004 740 740 A 32 ASP H A 31 VAL HG21 1.0 1.850 3.958 741 741 A 32 ASP H A 33 VAL H 1.0 1.890 4.232 742 742 A 24 GLU H A 17 PRO HGy 1.0 1.908 4.382 743 743 A 24 GLU H A 24 GLU HBy 1.0 1.646 2.986 744 744 A 24 GLU H A 17 PRO HGx 1.0 1.839 3.891 745 745 A 13 TYR H A 12 LEU HDx% 1.0 1.943 4.703 746 746 A 13 TYR H A 12 LEU HBx 1.0 1.905 4.355 747 747 A 59 TYR H A 59 TYR HBx 1.0 1.760 3.472 748 748 A 10 GLN H A 62 PRO HA 1.0 1.817 3.761 749 749 A 42 PHE HBx A 42 PHE H 1.0 1.818 3.768 750 750 A 42 PHE H A 57 GLY HAx 1.0 1.930 4.580 751 751 A 41 TRP HBy A 41 TRP H 1.0 1.714 3.262 752 752 A 41 TRP HA A 41 TRP H 1.0 1.818 3.768 753 753 A 41 TRP H A 40 GLY HAy 1.0 1.931 4.587 754 754 A 41 TRP H A 37 CYS HBy 1.0 1.449 2.351 755 755 A 34 MET H A 43 VAL H 1.0 1.997 5.687 756 756 A 34 MET H A 43 VAL HB 1.0 1.904 4.338 757 757 A 11 ALA H A 60 VAL HGy% 1.0 1.888 4.224 758 758 A 11 ALA H A 28 GLY H 1.0 1.857 4.001 759 759 A 11 ALA HB% A 28 GLY H 1.0 1.802 3.682 760 760 A 28 GLY H A 27 ASP HBy 1.0 1.751 3.429 761 761 A 27 ASP H A 26 ARG HA 1.0 1.625 2.911 762 762 A 14 SER HA A 27 ASP H 1.0 1.832 3.850 763 763 A 27 ASP HBy A 27 ASP H 1.0 1.789 3.613 764 764 A 27 ASP H A 26 ARG HBy 1.0 1.853 3.979 765 765 A 27 ASP H A 26 ARG HBx 1.0 1.838 3.886 766 766 A 27 ASP H A 14 SER HBy 1.0 1.677 3.109 767 767 A 44 GLY H A 54 THR HB 1.0 1.858 4.012 768 768 A 44 GLY H A 43 VAL HA 1.0 1.676 3.106 769 769 A 53 GLY H A 52 PHE HBx 1.0 1.960 4.908 770 770 A 53 GLY H A 23 LEU HDx% 1.0 1.811 3.731 771 771 A 53 GLY H A 23 LEU HDy% 1.0 1.673 3.093 772 772 A 52 PHE H A 23 LEU HDx% 1.0 1.912 4.410 773 773 A 37 CYS HBy A 40 GLY H 1.0 1.917 4.457 774 774 A 37 CYS HBx A 40 GLY H 1.0 1.904 4.346 775 775 A 40 GLY H A 39 ASP HBx 1.0 1.999 5.815 776 776 A 64 TYR H A 64 TYR HA 1.0 1.773 3.531 777 777 A 64 TYR H A 63 LEU HBy 1.0 1.695 3.181 778 778 A 64 TYR H A 63 LEU HDy% 1.0 1.791 3.621 779 779 A 52 PHE HBy A 52 PHE H 1.0 1.817 3.761 780 780 A 52 PHE H A 51 GLN HBy 1.0 1.811 3.727 781 781 A 52 PHE H A 51 GLN HGy 1.0 1.932 4.594 782 782 A 52 PHE H A 51 GLN HBx 1.0 1.880 4.160 783 783 A 52 PHE HA A 52 PHE H 1.0 1.768 3.506 784 784 A 39 ASP H A 38 ASP HBy 1.0 1.758 3.460 785 785 A 39 ASP H A 39 ASP HA 1.0 1.727 3.317 786 786 A 38 ASP H A 38 ASP HBy 1.0 1.766 3.496 787 787 A 37 CYS HBy A 38 ASP H 1.0 1.901 4.319 788 788 A 21 ASP H A 21 ASP HA 1.0 1.775 3.545 789 789 A 19 ASN HBx A 21 ASP H 1.0 1.753 3.433 790 790 A 54 THR HB A 54 THR H 1.0 1.660 3.040 791 791 A 23 LEU H A 54 THR H 1.0 1.818 3.772 792 792 A 25 LEU HBy A 15 TYR H 1.0 1.794 3.640 793 793 A 25 LEU HBx A 15 TYR H 1.0 1.895 4.271 794 794 A 46 SER H A 46 SER HA 1.0 1.859 4.017 795 795 A 7 PHE HBx A 8 SER H 1.0 1.625 2.909 796 796 A 51 GLN H A 51 GLN HBx 1.0 1.790 3.618 797 797 A 35 GLU H A 35 GLU HBy 1.0 1.738 3.370 798 798 A 51 GLN H A 51 GLN HBy 1.0 1.668 3.074 799 799 A 18 GLN H A 18 GLN HBx 1.0 1.779 3.561 800 800 A 18 GLN H A 18 GLN HGx 1.0 1.659 3.037 801 801 A 23 LEU H A 53 GLY HAx 1.0 1.997 5.667 802 802 A 10 GLN H A 9 TYR HDx 1.0 1.910 4.392 803 803 A 10 GLN H A 9 TYR HBx 1.0 1.854 3.984 804 804 A 10 GLN H A 10 GLN HBy 1.0 1.753 3.435 805 805 A 10 GLN H A 10 GLN HBx 1.0 1.747 3.407 806 806 A 10 GLN H A 63 LEU HG 1.0 1.818 3.772 807 807 A 10 GLN H A 63 LEU HDy% 1.0 1.822 3.788 808 808 A 36 LYS H A 36 LYS HGx 1.0 1.867 4.069 809 809 A 36 LYS H A 36 LYS HGy 1.0 1.738 3.370 810 810 A 36 LYS H A 35 GLU HBy 1.0 1.904 4.346 811 811 A 23 LEU H A 22 GLU HBx 1.0 1.851 3.963 812 812 A 23 LEU H A 22 GLU HBy 1.0 1.735 3.351 813 813 A 22 GLU H A 22 GLU HBx 1.0 1.649 2.999 814 814 A 22 GLU H A 22 GLU HBy 1.0 1.788 3.610 815 815 A 22 GLU H A 21 ASP HA 1.0 1.867 4.069 816 816 A 22 GLU H A 20 ASP HA 1.0 1.859 4.017 817 817 A 33 VAL H A 32 ASP HBy 1.0 1.949 4.783 818 818 A 33 VAL H A 33 VAL HGy% 1.0 1.932 4.594 819 819 A 31 VAL H A 30 ILE HG1y 1.0 1.906 4.364 820 820 A 12 LEU H A 11 ALA HA 1.0 1.699 3.197 821 821 A 12 LEU H A 59 TYR HBy 1.0 1.959 7.187 822 822 A 60 VAL HB A 60 VAL H 1.0 1.787 3.601 823 823 A 60 VAL H A 59 TYR HBx 1.0 1.782 3.578 824 824 A 29 ASP H A 28 GLY HAy 1.0 1.805 3.699 825 825 A 29 ASP H A 28 GLY HAx 1.0 1.613 2.867 826 826 A 29 ASP H A 29 ASP HA 1.0 1.943 7.411 827 827 A 25 LEU HBy A 26 ARG H 1.0 1.967 5.017 828 828 A 25 LEU HBx A 26 ARG H 1.0 1.912 4.410 829 829 A 49 THR H A 49 THR HA 1.0 1.701 3.205 830 830 A 46 SER HBy A 49 THR H 1.0 1.868 4.082 831 831 A 48 ARG HBy A 49 THR H 1.0 1.824 3.800 832 832 A 49 THR H A 48 ARG HBx 1.0 1.851 3.963 833 833 A 48 ARG HGy A 49 THR H 1.0 1.910 4.394 834 834 A 46 SER HA A 47 ARG H 1.0 1.696 3.186 835 835 A 46 SER HBx A 47 ARG H 1.0 1.967 5.001 836 836 A 47 ARG H A 47 ARG HBy 1.0 1.790 3.618 837 837 A 25 LEU HA A 25 LEU H 1.0 1.301 11.431 838 838 A 25 LEU HBy A 25 LEU H 1.0 1.723 3.299 839 839 A 24 GLU HGy A 25 LEU H 1.0 1.773 3.529 840 840 A 17 PRO HDy A 25 LEU H 1.0 1.770 3.518 841 841 A 25 LEU HBx A 25 LEU H 1.0 1.708 3.232 842 842 A 25 LEU HDy% A 25 LEU H 1.0 1.918 4.462 843 843 A 24 GLU H A 25 LEU H 1.0 1.922 4.502 844 844 A 15 TYR HDx A 25 LEU H 1.0 1.905 4.355 845 845 A 16 ILE HG1x A 16 ILE H 1.0 1.806 3.702 846 846 A 16 ILE HG2% A 16 ILE H 1.0 1.904 4.346 847 847 A 15 TYR HBy A 16 ILE H 1.0 1.854 3.984 848 848 A 17 PRO HDy A 16 ILE H 1.0 2.000 6.142 849 849 A 60 VAL HGy% A 61 LYS H 1.0 1.788 3.610 850 850 A 24 GLU H A 24 GLU HA 1.0 1.885 4.195 851 851 A 24 GLU H A 23 LEU HDx% 1.0 1.822 3.792 852 852 A 24 GLU H A 23 LEU HG 1.0 1.847 3.943 853 853 A 24 GLU H A 24 GLU HGy 1.0 1.927 4.547 854 854 A 13 TYR HA A 14 SER H 1.0 1.634 2.946 855 855 A 14 SER H A 14 SER HA 1.0 1.795 3.643 856 856 A 14 SER H A 14 SER HBy 1.0 1.798 3.662 857 857 A 13 TYR HBx A 14 SER H 1.0 1.765 3.493 858 858 A 14 SER H A 27 ASP HA 1.0 1.784 3.592 859 859 A 14 SER H A 27 ASP H 1.0 1.950 4.784 860 860 A 30 ILE H A 30 ILE HB 1.0 1.617 2.883 861 861 A 30 ILE HG2% A 30 ILE H 1.0 1.904 4.346 862 862 A 29 ASP HBy A 30 ILE H 1.0 1.859 4.023 863 863 A 30 ILE H A 29 ASP HA 1.0 1.596 2.808 864 864 A 30 ILE HA A 30 ILE H 1.0 1.764 3.488 865 865 A 6 LEU H A 6 LEU HA 1.0 1.757 3.451 866 866 A 6 LEU H A 5 ASP HBy 1.0 1.774 3.536 867 867 A 6 LEU H A 6 LEU HDx% 1.0 1.891 4.247 868 868 A 9 TYR HDx A 61 LYS H 1.0 1.867 4.069 869 869 A 9 TYR HA A 61 LYS H 1.0 1.986 5.360 870 870 A 11 ALA HA A 61 LYS H 1.0 1.918 4.464 871 871 A 9 TYR HBx A 61 LYS H 1.0 1.922 4.502 872 872 A 9 TYR HBy A 61 LYS H 1.0 1.859 4.017 873 873 A 60 VAL HB A 61 LYS H 1.0 1.857 4.001 874 874 A 61 LYS H A 61 LYS HBy 1.0 1.882 4.174 875 875 A 61 LYS H A 61 LYS HBx 1.0 1.999 6.129 876 876 A 60 VAL HGx% A 61 LYS H 1.0 1.796 3.650 877 877 A 35 GLU H A 43 VAL HGy% 1.0 1.798 3.660 878 878 A 46 SER HBx A 51 GLN H 1.0 1.965 4.977 879 879 A 45 THR HG2% A 51 GLN H 1.0 1.841 3.905 880 880 A 63 LEU H A 63 LEU HA 1.0 1.957 4.879 881 881 A 63 LEU H A 62 PRO HBy 1.0 1.744 3.394 882 882 A 7 PHE HBx A 7 PHE H 1.0 1.817 3.765 883 883 A 7 PHE HBy A 7 PHE H 1.0 1.874 4.120 884 884 A 6 LEU HDx% A 7 PHE H 1.0 1.906 4.364 885 885 A 6 LEU HA A 7 PHE H 1.0 1.631 2.931 886 886 A 7 PHE HA A 7 PHE H 1.0 1.688 3.156 887 887 A 15 TYR HBy A 15 TYR H 1.0 1.898 4.294 888 888 A 15 TYR HBx A 15 TYR H 1.0 1.865 4.057 889 889 A 15 TYR HA A 15 TYR H 1.0 1.766 3.496 890 890 A 15 TYR H A 25 LEU HG 1.0 1.907 4.373 891 891 A 46 SER HA A 48 ARG H 1.0 1.820 3.784 892 892 A 46 SER HBx A 48 ARG H 1.0 1.876 4.132 893 893 A 48 ARG H A 48 ARG HBx 1.0 1.788 3.610 894 894 A 49 THR HG2% A 48 ARG H 1.0 1.910 4.392 895 895 A 48 ARG HGy A 48 ARG H 1.0 1.703 3.213 896 896 A 50 LYS H A 50 LYS HDy 1.0 1.899 4.303 897 897 A 50 LYS H A 50 LYS HGy 1.0 1.841 3.905 898 898 A 50 LYS H A 49 THR HG2% 1.0 1.801 3.679 899 899 A 50 LYS H A 49 THR HA 1.0 1.746 3.402 900 900 A 50 LYS H A 50 LYS HBx 1.0 1.820 3.776 901 901 A 50 LYS H A 50 LYS HBy 1.0 1.999 6.129 902 902 A 4 GLN HBy A 4 GLN H 1.0 1.865 4.057 903 903 A 4 GLN HBx A 4 GLN H 1.0 1.873 4.107 904 904 A 4 GLN HGy A 4 GLN H 1.0 1.873 4.107 905 905 A 3 SER HBy A 4 GLN H 1.0 1.791 3.625 906 906 A 3 SER HA A 4 GLN H 1.0 1.750 3.420 907 907 A 4 GLN HA A 4 GLN H 1.0 1.856 3.996 908 908 A 2 THR HA A 3 SER H 1.0 1.794 3.640 909 909 A 3 SER H A 3 SER HBy 1.0 1.896 4.278 910 910 A 2 THR HG2% A 3 SER H 1.0 1.998 6.262 911 911 A 2 THR H A 1 GLN HA 1.0 1.801 3.675 912 912 A 2 THR HB A 2 THR H 1.0 1.927 4.541 913 913 A 2 THR HG2% A 2 THR H 1.0 1.933 4.601 stop_ save_