data_nef_c17912_2lj0 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 17913 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 middle . . 65 A 65 LEU end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLN H1 H 1 8.666 0.000 A 1 GLN HA H 1 4.459 0.000 A 1 GLN N N 15 122.370 0.000 A 2 THR H H 1 8.299 0.000 A 2 THR HA H 1 4.421 0.005 A 2 THR C C 13 174.670 0.000 A 2 THR N N 15 115.102 0.011 A 3 SER H H 1 8.364 0.009 A 3 SER HA H 1 4.437 0.004 A 3 SER HBx H 1 3.898 0.013 A 3 SER CA C 13 58.631 0.009 A 3 SER CB C 13 63.886 0.000 A 3 SER N N 15 117.894 0.011 A 4 GLN H H 1 8.403 0.000 A 4 GLN HA H 1 4.338 0.006 A 4 GLN HBy H 1 2.102 0.009 A 4 GLN HBx H 1 1.954 0.009 A 4 GLN HGx H 1 2.335 0.008 A 4 GLN CA C 13 56.038 0.037 A 4 GLN CB C 13 29.636 0.071 A 4 GLN CG C 13 33.952 0.032 A 4 GLN N N 15 122.020 0.013 A 5 ASP H H 1 8.268 0.007 A 5 ASP HA H 1 4.568 0.003 A 5 ASP HBx H 1 2.563 0.006 A 5 ASP C C 13 175.558 0.000 A 5 ASP CA C 13 54.664 0.081 A 5 ASP CB C 13 41.320 0.019 A 5 ASP N N 15 121.296 0.039 A 6 LEU H H 1 7.833 0.005 A 6 LEU HA H 1 4.316 0.011 A 6 LEU HBy H 1 1.447 0.006 A 6 LEU HBx H 1 1.312 0.006 A 6 LEU HDx% H 1 0.773 0.010 A 6 LEU HDy% H 1 0.722 0.003 A 6 LEU HG H 1 1.436 0.003 A 6 LEU C C 13 176.489 0.000 A 6 LEU CB C 13 42.830 0.028 A 6 LEU CDy C 13 23.692 0.077 A 6 LEU CG C 13 26.962 0.063 A 6 LEU N N 15 121.230 0.013 A 7 PHE H H 1 8.285 0.004 A 7 PHE HA H 1 4.897 0.003 A 7 PHE HBy H 1 3.423 0.006 A 7 PHE HBx H 1 3.049 0.006 A 7 PHE HDx H 1 7.220 0.001 A 7 PHE HEx H 1 6.756 0.001 A 7 PHE C C 13 175.228 0.000 A 7 PHE CA C 13 57.049 0.001 A 7 PHE CB C 13 40.687 0.042 A 7 PHE N N 15 119.516 0.049 A 8 SER H H 1 8.256 0.017 A 8 SER HA H 1 5.364 0.007 A 8 SER HBy H 1 3.828 0.005 A 8 SER HBx H 1 3.716 0.004 A 8 SER C C 13 173.206 0.000 A 8 SER CA C 13 58.572 0.023 A 8 SER CB C 13 64.695 0.026 A 8 SER N N 15 117.412 0.031 A 9 TYR H H 1 9.285 0.005 A 9 TYR HA H 1 5.079 0.009 A 9 TYR HBy H 1 2.798 0.012 A 9 TYR HBx H 1 2.748 0.014 A 9 TYR HDy H 1 6.934 0.011 A 9 TYR HEy H 1 6.765 0.008 A 9 TYR C C 13 173.446 0.000 A 9 TYR CA C 13 56.844 0.067 A 9 TYR CB C 13 42.746 0.034 A 9 TYR N N 15 123.596 0.064 A 10 GLN H H 1 9.509 0.003 A 10 GLN HA H 1 5.486 0.007 A 10 GLN HBy H 1 1.823 0.007 A 10 GLN HBx H 1 1.741 0.005 A 10 GLN HE2y H 1 7.533 0.000 A 10 GLN HE2x H 1 6.807 0.003 A 10 GLN HGy H 1 2.052 0.007 A 10 GLN HGx H 1 1.876 0.000 A 10 GLN C C 13 175.648 0.000 A 10 GLN CA C 13 53.377 0.019 A 10 GLN CB C 13 33.081 0.115 A 10 GLN CG C 13 33.608 0.090 A 10 GLN N N 15 120.038 0.040 A 10 GLN NE2 N 15 111.314 0.003 A 11 ALA H H 1 9.584 0.009 A 11 ALA HA H 1 4.722 0.007 A 11 ALA HB% H 1 1.484 0.007 A 11 ALA C C 13 178.266 0.000 A 11 ALA CA C 13 52.723 0.144 A 11 ALA CB C 13 19.046 0.063 A 11 ALA N N 15 128.248 0.062 A 12 LEU H H 1 9.298 0.004 A 12 LEU HA H 1 4.064 0.005 A 12 LEU HBy H 1 0.923 0.008 A 12 LEU HBx H 1 0.656 0.009 A 12 LEU HDx% H 1 0.703 0.005 A 12 LEU HDy% H 1 0.686 0.009 A 12 LEU HG H 1 1.342 0.009 A 12 LEU C C 13 175.182 0.000 A 12 LEU CA C 13 55.373 0.045 A 12 LEU CB C 13 43.758 0.041 A 12 LEU CDy C 13 25.528 0.050 A 12 LEU CDx C 13 22.891 0.035 A 12 LEU CG C 13 27.010 0.086 A 12 LEU N N 15 126.548 0.069 A 13 TYR H H 1 7.115 0.007 A 13 TYR HA H 1 4.814 0.007 A 13 TYR HBy H 1 3.286 0.004 A 13 TYR HBx H 1 2.482 0.013 A 13 TYR HDx H 1 6.732 0.010 A 13 TYR HEx H 1 6.982 0.013 A 13 TYR C C 13 173.882 0.000 A 13 TYR CA C 13 53.835 0.001 A 13 TYR CB C 13 42.324 0.160 A 13 TYR N N 15 112.997 0.035 A 14 SER H H 1 8.367 0.004 A 14 SER HA H 1 4.424 0.004 A 14 SER HBy H 1 3.945 0.008 A 14 SER C C 13 173.315 0.000 A 14 SER CA C 13 58.675 0.026 A 14 SER CB C 13 63.973 0.006 A 14 SER N N 15 113.679 0.046 A 15 TYR H H 1 9.012 0.006 A 15 TYR HA H 1 4.682 0.008 A 15 TYR HBy H 1 2.726 0.007 A 15 TYR HBx H 1 2.584 0.008 A 15 TYR HDy H 1 6.999 0.012 A 15 TYR HEy H 1 6.783 0.000 A 15 TYR C C 13 173.334 0.000 A 15 TYR CA C 13 58.746 0.059 A 15 TYR CB C 13 42.071 0.066 A 15 TYR N N 15 123.628 0.032 A 16 ILE H H 1 7.493 0.005 A 16 ILE HA H 1 4.369 0.005 A 16 ILE HB H 1 1.583 0.005 A 16 ILE HD1% H 1 0.781 0.003 A 16 ILE HG1y H 1 1.413 0.003 A 16 ILE HG1x H 1 1.200 0.004 A 16 ILE HG2% H 1 0.782 0.003 A 16 ILE CA C 13 56.482 0.031 A 16 ILE CB C 13 37.995 0.048 A 16 ILE CD1 C 13 11.646 0.021 A 16 ILE CG2 C 13 16.608 0.004 A 16 ILE N N 15 129.105 0.049 A 17 PRO HA H 1 4.447 0.004 A 17 PRO HBy H 1 2.330 0.007 A 17 PRO HBx H 1 2.044 0.005 A 17 PRO HDy H 1 3.834 0.008 A 17 PRO HDx H 1 3.780 0.018 A 17 PRO HGy H 1 2.158 0.005 A 17 PRO HGx H 1 1.832 0.004 A 17 PRO C C 13 177.502 0.000 A 17 PRO CA C 13 63.106 0.009 A 17 PRO CB C 13 34.053 0.060 A 17 PRO CD C 13 51.086 0.056 A 17 PRO CG C 13 27.788 0.042 A 18 GLN H H 1 9.296 0.001 A 18 GLN HA H 1 4.284 0.005 A 18 GLN HBy H 1 2.316 0.008 A 18 GLN HBx H 1 2.111 0.006 A 18 GLN HE2y H 1 7.566 0.000 A 18 GLN HE2x H 1 6.884 0.000 A 18 GLN HGy H 1 2.559 0.006 A 18 GLN HGx H 1 2.428 0.001 A 18 GLN C C 13 175.436 0.000 A 18 GLN CA C 13 55.065 0.116 A 18 GLN CB C 13 30.401 0.033 A 18 GLN CG C 13 34.315 0.030 A 18 GLN N N 15 120.769 0.048 A 18 GLN NE2 N 15 114.272 0.007 A 19 ASN H H 1 7.493 0.003 A 19 ASN HA H 1 4.787 0.004 A 19 ASN HBy H 1 2.922 0.007 A 19 ASN HBx H 1 2.808 0.007 A 19 ASN HD2y H 1 7.565 0.000 A 19 ASN HD2x H 1 6.711 0.006 A 19 ASN C C 13 175.773 0.000 A 19 ASN CA C 13 52.239 0.002 A 19 ASN CB C 13 41.637 0.038 A 19 ASN N N 15 113.052 0.038 A 19 ASN ND2 N 15 115.031 0.003 A 20 ASP H H 1 8.682 0.005 A 20 ASP HA H 1 4.554 0.006 A 20 ASP HBy H 1 2.841 0.007 A 20 ASP HBx H 1 2.710 0.004 A 20 ASP C C 13 176.051 0.000 A 20 ASP CA C 13 56.688 0.128 A 20 ASP CB C 13 40.775 0.014 A 20 ASP N N 15 118.402 0.038 A 21 ASP H H 1 8.576 0.001 A 21 ASP HA H 1 4.808 0.006 A 21 ASP HBy H 1 2.901 0.010 A 21 ASP HBx H 1 2.771 0.011 A 21 ASP C C 13 176.439 0.000 A 21 ASP CA C 13 54.362 0.001 A 21 ASP CB C 13 40.707 0.046 A 21 ASP N N 15 116.989 0.011 A 22 GLU H H 1 7.529 0.008 A 22 GLU HA H 1 5.290 0.006 A 22 GLU HBy H 1 2.541 0.006 A 22 GLU HBx H 1 2.319 0.007 A 22 GLU HGy H 1 2.580 0.013 A 22 GLU HGx H 1 2.503 0.003 A 22 GLU C C 13 175.427 0.000 A 22 GLU CA C 13 55.243 0.034 A 22 GLU CB C 13 32.529 0.124 A 22 GLU CG C 13 36.813 0.075 A 22 GLU N N 15 119.572 0.028 A 23 LEU H H 1 8.799 0.004 A 23 LEU HA H 1 4.355 0.006 A 23 LEU HBy H 1 1.700 0.006 A 23 LEU HBx H 1 0.825 0.005 A 23 LEU HDx% H 1 1.338 0.004 A 23 LEU HDy% H 1 0.747 0.008 A 23 LEU HG H 1 0.548 0.006 A 23 LEU C C 13 173.919 0.000 A 23 LEU CA C 13 53.322 0.024 A 23 LEU CB C 13 45.768 0.032 A 23 LEU CDy C 13 25.865 0.000 A 23 LEU CDx C 13 24.881 0.026 A 23 LEU CG C 13 26.067 0.047 A 23 LEU N N 15 124.349 0.034 A 24 GLU H H 1 8.078 0.003 A 24 GLU HA H 1 4.551 0.009 A 24 GLU HBy H 1 2.003 0.010 A 24 GLU HGy H 1 2.561 0.007 A 24 GLU HGx H 1 1.924 0.010 A 24 GLU C C 13 176.413 0.000 A 24 GLU CA C 13 56.379 0.001 A 24 GLU CB C 13 29.971 0.000 A 24 GLU CG C 13 36.421 0.023 A 24 GLU N N 15 122.615 0.053 A 25 LEU H H 1 8.697 0.005 A 25 LEU HA H 1 4.637 0.008 A 25 LEU HBy H 1 1.878 0.004 A 25 LEU HBx H 1 1.176 0.005 A 25 LEU HDx% H 1 0.386 0.008 A 25 LEU HDy% H 1 0.322 0.009 A 25 LEU HG H 1 1.563 0.013 A 25 LEU C C 13 176.236 0.000 A 25 LEU CA C 13 53.699 0.046 A 25 LEU CB C 13 45.305 0.025 A 25 LEU CDy C 13 24.893 0.037 A 25 LEU CDx C 13 23.348 0.034 A 25 LEU CG C 13 25.917 0.118 A 25 LEU N N 15 125.666 0.049 A 26 ARG H H 1 8.695 0.004 A 26 ARG HA H 1 4.750 0.008 A 26 ARG HBy H 1 1.806 0.008 A 26 ARG HBx H 1 1.643 0.006 A 26 ARG HDy H 1 3.166 0.006 A 26 ARG HDx H 1 3.055 0.005 A 26 ARG HGy H 1 1.676 0.004 A 26 ARG HGx H 1 1.585 0.002 A 26 ARG C C 13 174.830 0.000 A 26 ARG CB C 13 32.685 0.033 A 26 ARG CD C 13 43.782 0.027 A 26 ARG CG C 13 27.082 0.029 A 26 ARG N N 15 124.689 0.041 A 27 ASP H H 1 8.218 0.006 A 27 ASP HA H 1 3.495 0.006 A 27 ASP HBy H 1 2.394 0.016 A 27 ASP HBx H 1 2.335 0.007 A 27 ASP C C 13 176.106 0.000 A 27 ASP CA C 13 56.136 0.010 A 27 ASP CB C 13 40.327 0.005 A 27 ASP N N 15 121.139 0.041 A 28 GLY H H 1 8.563 0.003 A 28 GLY HAy H 1 4.462 0.006 A 28 GLY HAx H 1 3.533 0.008 A 28 GLY C C 13 174.968 0.000 A 28 GLY CA C 13 45.033 0.032 A 28 GLY N N 15 113.430 0.087 A 29 ASP H H 1 8.469 0.004 A 29 ASP HA H 1 4.510 0.006 A 29 ASP HBy H 1 2.737 0.003 A 29 ASP HBx H 1 2.648 0.009 A 29 ASP C C 13 175.229 0.000 A 29 ASP CB C 13 41.609 0.010 A 29 ASP N N 15 122.391 0.037 A 30 ILE H H 1 8.630 0.004 A 30 ILE HA H 1 5.027 0.002 A 30 ILE HB H 1 1.734 0.005 A 30 ILE HD1% H 1 0.868 0.006 A 30 ILE HG1y H 1 1.774 0.007 A 30 ILE HG1x H 1 1.179 0.006 A 30 ILE HG2% H 1 0.897 0.008 A 30 ILE C C 13 175.466 0.000 A 30 ILE CA C 13 60.038 0.011 A 30 ILE CB C 13 38.343 0.063 A 30 ILE CD1 C 13 12.255 0.042 A 30 ILE CG1 C 13 28.083 0.023 A 30 ILE CG2 C 13 17.077 0.029 A 30 ILE N N 15 121.551 0.041 A 31 VAL H H 1 9.325 0.008 A 31 VAL HA H 1 4.861 0.008 A 31 VAL HB H 1 1.632 0.004 A 31 VAL HGx% H 1 0.619 0.006 A 31 VAL HGy% H 1 0.573 0.009 A 31 VAL C C 13 174.298 0.000 A 31 VAL CA C 13 59.348 0.014 A 31 VAL CB C 13 35.556 0.040 A 31 VAL CGy C 13 21.187 0.027 A 31 VAL CGx C 13 20.762 0.041 A 31 VAL N N 15 126.077 0.084 A 32 ASP H H 1 8.648 0.006 A 32 ASP HA H 1 5.399 0.007 A 32 ASP HBx H 1 2.602 0.007 A 32 ASP C C 13 175.878 0.000 A 32 ASP CA C 13 54.058 0.063 A 32 ASP CB C 13 42.186 0.029 A 32 ASP N N 15 125.845 0.050 A 33 VAL H H 1 9.417 0.005 A 33 VAL HA H 1 4.225 0.008 A 33 VAL HB H 1 2.237 0.013 A 33 VAL HGx% H 1 0.891 0.010 A 33 VAL HGy% H 1 0.596 0.010 A 33 VAL C C 13 174.990 0.000 A 33 VAL CA C 13 64.187 0.038 A 33 VAL CB C 13 33.269 0.048 A 33 VAL CGy C 13 24.447 0.044 A 33 VAL CGx C 13 20.976 0.057 A 33 VAL N N 15 127.691 0.041 A 34 MET H H 1 9.372 0.006 A 34 MET HA H 1 4.676 0.009 A 34 MET HBx H 1 2.152 0.008 A 34 MET HE% H 1 0.767 0.004 A 34 MET HGx H 1 2.652 0.004 A 34 MET C C 13 175.448 0.000 A 34 MET CA C 13 56.116 0.064 A 34 MET CB C 13 35.470 0.102 A 34 MET CG C 13 32.118 0.017 A 34 MET N N 15 126.727 0.067 A 35 GLU H H 1 7.739 0.006 A 35 GLU HA H 1 4.521 0.010 A 35 GLU HBx H 1 1.889 0.007 A 35 GLU HGx H 1 2.148 0.007 A 35 GLU C C 13 173.316 0.000 A 35 GLU CA C 13 55.788 0.123 A 35 GLU CB C 13 33.524 0.062 A 35 GLU CG C 13 36.017 0.089 A 35 GLU N N 15 118.079 0.068 A 36 LYS H H 1 8.577 0.004 A 36 LYS HA H 1 4.430 0.010 A 36 LYS HBx H 1 1.558 0.007 A 36 LYS HDx H 1 1.328 0.004 A 36 LYS HEx H 1 2.533 0.002 A 36 LYS HGy H 1 0.791 0.005 A 36 LYS HGx H 1 -0.074 0.063 A 36 LYS C C 13 175.797 0.000 A 36 LYS CA C 13 55.560 0.039 A 36 LYS CB C 13 32.974 0.036 A 36 LYS CD C 13 29.474 0.042 A 36 LYS CG C 13 23.754 0.030 A 36 LYS N N 15 124.081 0.045 A 37 CYS H H 1 8.675 0.003 A 37 CYS HA H 1 4.599 0.007 A 37 CYS HBy H 1 3.325 0.008 A 37 CYS HBx H 1 3.174 0.008 A 37 CYS C C 13 176.540 0.000 A 37 CYS CA C 13 58.542 0.040 A 37 CYS CB C 13 29.399 0.065 A 37 CYS N N 15 122.585 0.055 A 38 ASP H H 1 9.039 0.007 A 38 ASP HA H 1 4.435 0.005 A 38 ASP HBx H 1 2.732 0.005 A 38 ASP C C 13 176.151 0.000 A 38 ASP CA C 13 56.722 0.015 A 38 ASP CB C 13 40.498 0.000 A 38 ASP N N 15 123.650 0.022 A 39 ASP H H 1 8.029 0.004 A 39 ASP HA H 1 4.558 0.005 A 39 ASP HBy H 1 3.093 0.008 A 39 ASP HBx H 1 2.635 0.006 A 39 ASP C C 13 177.152 0.000 A 39 ASP CA C 13 53.457 0.039 A 39 ASP CB C 13 40.102 0.010 A 39 ASP N N 15 117.104 0.013 A 40 GLY H H 1 8.068 0.011 A 40 GLY HAy H 1 4.277 0.002 A 40 GLY HAx H 1 3.736 0.006 A 40 GLY C C 13 174.808 0.000 A 40 GLY CA C 13 45.336 0.008 A 40 GLY N N 15 106.440 0.062 A 41 TRP H H 1 8.081 0.001 A 41 TRP HA H 1 4.315 0.005 A 41 TRP HBy H 1 3.067 0.007 A 41 TRP HBx H 1 2.870 0.006 A 41 TRP HD1 H 1 6.957 0.002 A 41 TRP HE3 H 1 7.401 0.001 A 41 TRP C C 13 174.465 0.000 A 41 TRP CA C 13 58.274 0.040 A 41 TRP CB C 13 27.994 0.071 A 41 TRP N N 15 122.773 0.048 A 42 PHE H H 1 8.665 0.007 A 42 PHE HA H 1 5.341 0.008 A 42 PHE HBy H 1 2.570 0.017 A 42 PHE HBx H 1 1.797 0.007 A 42 PHE HDx H 1 6.757 0.006 A 42 PHE HEx H 1 6.894 0.017 A 42 PHE C C 13 175.553 0.000 A 42 PHE CA C 13 52.264 0.028 A 42 PHE CB C 13 41.401 0.041 A 42 PHE N N 15 120.693 0.043 A 43 VAL H H 1 8.644 0.005 A 43 VAL HA H 1 4.656 0.006 A 43 VAL HB H 1 1.871 0.007 A 43 VAL HGx% H 1 0.741 0.006 A 43 VAL HGy% H 1 0.787 0.009 A 43 VAL C C 13 176.743 0.000 A 43 VAL CA C 13 60.952 0.023 A 43 VAL CB C 13 34.578 0.031 A 43 VAL CGy C 13 22.572 0.030 A 43 VAL CGx C 13 20.693 0.041 A 43 VAL N N 15 119.702 0.079 A 44 GLY H H 1 8.932 0.005 A 44 GLY HAy H 1 4.665 0.008 A 44 GLY HAx H 1 4.366 0.006 A 44 GLY C C 13 169.281 0.000 A 44 GLY CA C 13 46.949 0.040 A 44 GLY N N 15 113.197 0.034 A 45 THR H H 1 8.501 0.007 A 45 THR HA H 1 5.559 0.006 A 45 THR HB H 1 4.023 0.007 A 45 THR HG1 H 1 5.685 0.009 A 45 THR HG2% H 1 1.141 0.007 A 45 THR C C 13 175.202 0.000 A 45 THR CA C 13 60.470 0.028 A 45 THR CB C 13 71.148 0.029 A 45 THR CG2 C 13 21.241 0.040 A 45 THR N N 15 112.783 0.062 A 46 SER H H 1 8.637 0.007 A 46 SER HA H 1 4.544 0.008 A 46 SER HBy H 1 4.136 0.011 A 46 SER HBx H 1 3.907 0.010 A 46 SER C C 13 176.997 0.000 A 46 SER CA C 13 56.959 0.133 A 46 SER CB C 13 63.941 0.055 A 46 SER N N 15 120.544 0.044 A 47 ARG H H 1 9.086 0.008 A 47 ARG HA H 1 4.266 0.009 A 47 ARG HBx H 1 1.912 0.011 A 47 ARG HDy H 1 3.199 0.007 A 47 ARG HDx H 1 2.908 0.009 A 47 ARG HGx H 1 1.703 0.012 A 47 ARG C C 13 177.356 0.000 A 47 ARG CA C 13 59.508 0.136 A 47 ARG CB C 13 30.116 0.050 A 47 ARG CD C 13 43.949 0.041 A 47 ARG CG C 13 28.613 0.189 A 47 ARG N N 15 129.066 0.048 A 48 ARG H H 1 8.533 0.004 A 48 ARG HA H 1 4.273 0.005 A 48 ARG HBy H 1 1.856 0.008 A 48 ARG HBx H 1 1.618 0.008 A 48 ARG HDy H 1 3.439 0.009 A 48 ARG HDx H 1 3.154 0.007 A 48 ARG HGy H 1 1.503 0.009 A 48 ARG HGx H 1 1.430 0.018 A 48 ARG C C 13 177.895 0.000 A 48 ARG CA C 13 59.240 0.019 A 48 ARG CB C 13 30.911 0.098 A 48 ARG CD C 13 42.231 0.033 A 48 ARG CG C 13 27.074 0.052 A 48 ARG N N 15 118.892 0.031 A 49 THR H H 1 7.809 0.002 A 49 THR HA H 1 4.375 0.003 A 49 THR HB H 1 4.494 0.007 A 49 THR HG1 H 1 5.788 0.004 A 49 THR HG2% H 1 1.199 0.007 A 49 THR C C 13 176.037 0.000 A 49 THR CA C 13 61.513 0.053 A 49 THR CB C 13 70.686 0.039 A 49 THR CG2 C 13 21.337 0.092 A 49 THR N N 15 105.127 0.027 A 50 LYS H H 1 8.037 0.004 A 50 LYS HA H 1 4.096 0.004 A 50 LYS HBy H 1 2.257 0.003 A 50 LYS HBx H 1 2.113 0.008 A 50 LYS HDx H 1 1.684 0.008 A 50 LYS HEx H 1 3.041 0.007 A 50 LYS HGy H 1 1.441 0.005 A 50 LYS HGx H 1 1.365 0.006 A 50 LYS C C 13 175.503 0.000 A 50 LYS CA C 13 57.925 0.027 A 50 LYS CB C 13 29.210 0.044 A 50 LYS CD C 13 28.906 0.183 A 50 LYS CE C 13 42.504 0.051 A 50 LYS CG C 13 25.304 0.050 A 50 LYS N N 15 115.682 0.045 A 51 GLN H H 1 7.763 0.008 A 51 GLN HA H 1 4.445 0.013 A 51 GLN HBy H 1 2.188 0.007 A 51 GLN HBx H 1 1.922 0.006 A 51 GLN HE2y H 1 7.562 0.000 A 51 GLN HE2x H 1 7.001 0.000 A 51 GLN HGy H 1 2.475 0.008 A 51 GLN HGx H 1 2.438 0.012 A 51 GLN C C 13 173.051 0.000 A 51 GLN CA C 13 55.634 0.031 A 51 GLN CB C 13 29.853 0.042 A 51 GLN CG C 13 34.149 0.050 A 51 GLN N N 15 118.240 0.057 A 51 GLN NE2 N 15 113.307 0.002 A 52 PHE H H 1 8.566 0.007 A 52 PHE HA H 1 5.695 0.004 A 52 PHE HBy H 1 3.106 0.004 A 52 PHE HBx H 1 2.949 0.008 A 52 PHE HDx H 1 7.253 0.004 A 52 PHE C C 13 175.869 0.000 A 52 PHE CA C 13 55.531 0.036 A 52 PHE CB C 13 43.175 0.027 A 52 PHE N N 15 122.141 0.036 A 53 GLY H H 1 8.561 0.005 A 53 GLY HAy H 1 4.022 0.012 A 53 GLY HAx H 1 3.943 0.014 A 53 GLY C C 13 170.867 0.000 A 53 GLY CA C 13 45.757 0.038 A 53 GLY N N 15 112.949 0.045 A 54 THR H H 1 8.493 0.005 A 54 THR HA H 1 5.973 0.006 A 54 THR HB H 1 4.096 0.004 A 54 THR HG1 H 1 5.297 0.007 A 54 THR HG2% H 1 1.189 0.005 A 54 THR C C 13 173.257 0.000 A 54 THR CA C 13 58.605 0.021 A 54 THR CB C 13 71.662 0.053 A 54 THR CG2 C 13 20.772 0.065 A 54 THR N N 15 112.887 0.022 A 55 PHE H H 1 8.254 0.006 A 55 PHE HA H 1 4.642 0.009 A 55 PHE HBy H 1 3.215 0.007 A 55 PHE HBx H 1 2.169 0.008 A 55 PHE HDx H 1 6.777 0.006 A 55 PHE HEx H 1 7.376 0.000 A 55 PHE CA C 13 55.409 0.021 A 55 PHE CB C 13 36.711 0.056 A 55 PHE N N 15 120.587 0.043 A 56 PRO HA H 1 2.804 0.005 A 56 PRO HBy H 1 1.434 0.004 A 56 PRO HBx H 1 1.141 0.009 A 56 PRO HDy H 1 1.853 0.012 A 56 PRO HDx H 1 1.796 0.006 A 56 PRO HGy H 1 0.746 0.006 A 56 PRO HGx H 1 0.177 0.006 A 56 PRO C C 13 178.203 0.000 A 56 PRO CA C 13 62.073 0.071 A 56 PRO CB C 13 30.616 0.086 A 56 PRO CD C 13 49.043 0.028 A 56 PRO CG C 13 27.157 0.045 A 57 GLY H H 1 7.812 0.007 A 57 GLY HAy H 1 2.438 0.006 A 57 GLY HAx H 1 2.329 0.005 A 57 GLY C C 13 174.153 0.000 A 57 GLY CA C 13 45.295 0.024 A 57 GLY N N 15 112.103 0.039 A 58 ASN H H 1 8.024 0.005 A 58 ASN HA H 1 4.602 0.007 A 58 ASN HBy H 1 2.900 0.003 A 58 ASN HBx H 1 2.652 0.005 A 58 ASN C C 13 175.621 0.000 A 58 ASN CA C 13 53.590 0.000 A 58 ASN CB C 13 36.235 0.027 A 58 ASN N N 15 113.060 0.075 A 59 TYR H H 1 7.782 0.006 A 59 TYR HA H 1 4.477 0.004 A 59 TYR HBy H 1 3.208 0.007 A 59 TYR HBx H 1 3.089 0.005 A 59 TYR HDy H 1 7.037 0.007 A 59 TYR HEy H 1 6.770 0.006 A 59 TYR C C 13 175.251 0.000 A 59 TYR CA C 13 59.528 0.056 A 59 TYR CB C 13 38.319 0.043 A 59 TYR N N 15 118.964 0.063 A 60 VAL H H 1 7.512 0.007 A 60 VAL HA H 1 5.509 0.005 A 60 VAL HB H 1 2.212 0.007 A 60 VAL HGx% H 1 0.627 0.010 A 60 VAL HGy% H 1 0.965 0.007 A 60 VAL C C 13 173.950 0.000 A 60 VAL CA C 13 58.301 0.013 A 60 VAL CB C 13 36.827 0.056 A 60 VAL CGy C 13 21.135 0.035 A 60 VAL CGx C 13 20.830 0.039 A 60 VAL N N 15 108.904 0.039 A 61 LYS H H 1 8.980 0.007 A 61 LYS HA H 1 5.267 0.009 A 61 LYS HBy H 1 1.919 0.013 A 61 LYS HBx H 1 1.786 0.009 A 61 LYS HDx H 1 1.669 0.010 A 61 LYS HEx H 1 2.869 0.000 A 61 LYS HEy H 1 3.756 0.000 A 61 LYS HGy H 1 1.424 0.008 A 61 LYS HGx H 1 1.361 0.011 A 61 LYS CA C 13 52.637 0.054 A 61 LYS CB C 13 34.793 0.042 A 61 LYS N N 15 118.497 0.060 A 62 PRO HA H 1 3.619 0.025 A 62 PRO HBy H 1 1.727 0.009 A 62 PRO HBx H 1 1.398 0.014 A 62 PRO HDy H 1 3.926 0.009 A 62 PRO HDx H 1 3.772 0.007 A 62 PRO HGy H 1 2.043 0.015 A 62 PRO HGx H 1 1.959 0.008 A 62 PRO C C 13 176.069 0.000 A 62 PRO CA C 13 63.271 0.082 A 62 PRO CB C 13 31.976 0.046 A 62 PRO CD C 13 50.736 0.024 A 62 PRO CG C 13 27.548 0.063 A 63 LEU H H 1 7.961 0.010 A 63 LEU HA H 1 4.240 0.009 A 63 LEU HBy H 1 1.312 0.013 A 63 LEU HBx H 1 1.187 0.012 A 63 LEU HDx% H 1 0.784 0.007 A 63 LEU HG H 1 1.269 0.018 A 63 LEU C C 13 176.177 0.000 A 63 LEU CA C 13 54.882 0.090 A 63 LEU CB C 13 42.964 0.041 A 63 LEU CDx C 13 24.450 0.058 A 63 LEU CG C 13 27.033 0.025 A 63 LEU N N 15 122.887 0.063 A 64 TYR H H 1 8.085 0.006 A 64 TYR HA H 1 4.552 0.009 A 64 TYR HBy H 1 2.953 0.017 A 64 TYR HBx H 1 2.891 0.007 A 64 TYR HDx H 1 7.036 0.002 A 64 TYR HEx H 1 6.731 0.005 A 64 TYR C C 13 175.025 0.000 A 64 TYR CB C 13 38.767 0.030 A 64 TYR N N 15 120.687 0.058 A 65 LEU H H 1 7.996 0.006 A 65 LEU HA H 1 4.297 0.002 A 65 LEU HBy H 1 1.474 0.003 A 65 LEU HBx H 1 1.317 0.000 A 65 LEU HDx% H 1 0.816 0.000 A 65 LEU C C 13 176.648 0.000 A 65 LEU CB C 13 42.801 0.021 A 65 LEU N N 15 123.853 0.034 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 22 GLU HA A 22 GLU HBx 1.0 1.576 2.740 2 2 A 22 GLU HA A 54 THR HG2% 1.0 1.840 3.898 3 3 A 22 GLU HA A 22 GLU HGx 1.0 1.937 4.645 4 4 A 22 GLU HA A 22 GLU HBy 1.0 1.937 4.643 5 5 A 22 GLU HBx A 17 PRO HA 1.0 1.890 4.238 6 6 A 22 GLU HBy A 17 PRO HA 1.0 1.958 4.876 7 7 A 23 LEU HA A 24 GLU HBx 1.0 1.212 11.810 8 8 A 23 LEU HA A 23 LEU HDy% 1.0 1.802 3.680 9 9 A 25 LEU HA A 25 LEU HDx% 1.0 1.937 4.645 10 10 A 50 LYS HGx A 50 LYS HA 1.0 1.755 3.445 11 11 A 35 GLU HA A 35 GLU HGy 1.0 1.609 2.855 12 12 A 35 GLU HA A 36 LYS HGx 1.0 1.872 4.104 13 13 A 58 ASN HBx A 58 ASN HA 1.0 1.512 2.538 14 14 A 24 GLU HGx A 24 GLU HA 1.0 1.511 2.531 15 15 A 24 GLU HA A 24 GLU HGy 1.0 1.840 3.898 16 16 A 23 LEU HA A 24 GLU HGy 1.0 1.953 4.817 17 17 A 24 GLU HGx A 16 ILE HA 1.0 1.900 4.312 18 18 A 24 GLU HGy A 17 PRO HDy 1.0 1.999 5.787 19 19 A 24 GLU HGx A 24 GLU HGy 1.0 1.631 2.935 20 20 A 24 GLU HGx A 16 ILE HD1% 1.0 1.894 4.268 21 21 A 25 LEU HA A 25 LEU HBx 1.0 1.857 4.005 22 22 A 25 LEU HA A 25 LEU HBy 1.0 1.836 3.876 23 23 A 25 LEU HBx A 25 LEU HBy 1.0 1.705 3.225 24 24 A 25 LEU HBx A 25 LEU HG 1.0 1.790 3.618 25 25 A 25 LEU HBy A 25 LEU HDy% 1.0 1.835 3.865 26 26 A 25 LEU HBx A 25 LEU HDy% 1.0 1.820 3.782 27 27 A 26 ARG HDy A 26 ARG HBy 1.0 1.608 2.852 28 28 A 26 ARG HGx A 26 ARG HA 1.0 1.848 3.948 29 29 A 26 ARG HA A 26 ARG HGy 1.0 1.846 3.930 30 30 A 26 ARG HA A 26 ARG HBx 1.0 1.827 3.821 31 31 A 26 ARG HBy A 26 ARG HA 1.0 1.845 3.931 32 32 A 27 ASP HA A 11 ALA HB% 1.0 1.829 3.833 33 33 A 27 ASP HA A 27 ASP HBx 1.0 1.798 3.662 34 34 A 27 ASP HA A 27 ASP HBy 1.0 1.803 3.685 35 35 A 27 ASP HBx A 13 TYR HA 1.0 1.890 4.236 36 36 A 27 ASP HBy A 13 TYR HA 1.0 1.907 4.373 37 37 A 28 GLY HAy A 10 GLN HGx 1.0 1.865 4.059 38 38 A 28 GLY HAy A 28 GLY H 1.0 1.735 3.355 39 39 A 51 GLN HA A 51 GLN HGy 1.0 1.881 4.169 40 40 A 51 GLN HA A 51 GLN HBx 1.0 1.536 2.610 41 41 A 51 GLN HA A 51 GLN HBy 1.0 1.624 2.906 42 42 A 42 PHE HBx A 42 PHE HBy 1.0 1.479 2.435 43 43 A 20 ASP HBy A 20 ASP HA 1.0 1.660 3.040 44 44 A 21 ASP HBy A 21 ASP HA 1.0 1.697 3.193 45 45 A 21 ASP HA A 21 ASP HBx 1.0 1.591 2.793 46 46 A 30 ILE HA A 30 ILE HG1x 1.0 1.803 3.687 47 47 A 30 ILE HA A 30 ILE HG2% 1.0 1.751 3.429 48 48 A 30 ILE HA A 30 ILE HG1y 1.0 1.812 3.736 49 49 A 30 ILE HA A 30 ILE HB 1.0 1.941 4.677 50 50 A 30 ILE HB A 47 ARG HDy 1.0 1.933 4.603 51 51 A 30 ILE HG1y A 30 ILE HB 1.0 1.877 4.135 52 52 A 31 VAL HB A 31 VAL HA 1.0 1.692 3.170 53 53 A 31 VAL HB A 30 ILE HG2% 1.0 1.976 5.142 54 54 A 31 VAL HB A 32 ASP H 1.0 1.934 4.612 55 55 A 31 VAL HB A 31 VAL H 1.0 1.851 3.961 56 56 A 60 VAL HGx% A 11 ALA HB% 1.0 1.857 4.003 57 57 A 60 VAL HGx% A 60 VAL HA 1.0 1.730 3.328 58 58 A 60 VAL HGx% A 11 ALA HA 1.0 1.742 3.384 59 59 A 31 VAL HA A 31 VAL HGx% 1.0 1.681 3.123 60 60 A 32 ASP HA A 33 VAL H 1.0 1.367 2.133 61 61 A 34 MET HBy A 34 MET HGy 1.0 1.526 2.582 62 62 A 34 MET HBy A 34 MET HA 1.0 1.487 2.463 63 63 A 34 MET HBy A 34 MET HE% 1.0 1.971 5.053 64 64 A 34 MET HGy A 43 VAL HGx% 1.0 1.826 3.814 65 65 A 34 MET HGy A 35 GLU HBy 1.0 1.923 4.507 66 66 A 34 MET HGy A 34 MET HA 1.0 1.827 3.817 67 67 A 58 ASN HA A 58 ASN HBy 1.0 1.716 3.266 68 68 A 35 GLU HGy A 35 GLU HBy 1.0 1.669 3.077 69 69 A 35 GLU HA A 35 GLU HBy 1.0 1.725 3.307 70 70 A 34 MET HE% A 35 GLU HBy 1.0 1.355 2.101 71 71 A 36 LYS HGx A 36 LYS HA 1.0 1.657 3.027 72 72 A 36 LYS HA A 36 LYS HBy 1.0 1.645 2.987 73 73 A 36 LYS HGx A 36 LYS HBy 1.0 1.793 3.633 74 74 A 36 LYS HDy A 36 LYS HGy 1.0 1.798 3.658 75 75 A 36 LYS HGx A 36 LYS HDy 1.0 1.720 3.290 76 76 A 36 LYS HDy A 36 LYS HEy 1.0 1.767 3.501 77 77 A 36 LYS HGx A 36 LYS HGy 1.0 1.453 2.363 78 78 A 36 LYS HBy A 36 LYS HGy 1.0 1.816 3.756 79 79 A 37 CYS HA A 37 CYS HBy 1.0 1.621 2.895 80 80 A 37 CYS HA A 37 CYS HBx 1.0 1.876 4.128 81 81 A 37 CYS HBy A 40 GLY H 1.0 1.923 4.509 82 82 A 38 ASP HA A 39 ASP H 1.0 1.769 3.513 83 83 A 38 ASP HA A 38 ASP HBy 1.0 1.605 2.839 84 84 A 39 ASP HA A 39 ASP HBy 1.0 1.499 2.497 85 85 A 39 ASP HBy A 39 ASP HBx 1.0 1.578 2.748 86 86 A 39 ASP HA A 39 ASP HBx 1.0 1.709 3.239 87 87 A 39 ASP H A 39 ASP HBy 1.0 1.536 2.610 88 88 A 41 TRP HA A 57 GLY H 1.0 1.743 3.389 89 89 A 41 TRP HA A 42 PHE H 1.0 1.652 3.012 90 90 A 41 TRP HBx A 41 TRP HBy 1.0 1.681 3.125 91 91 A 41 TRP HA A 41 TRP HBy 1.0 1.888 4.218 92 92 A 41 TRP HA A 41 TRP HBx 1.0 1.783 3.583 93 93 A 41 TRP HBx A 41 TRP HD1 1.0 1.946 4.740 94 94 A 41 TRP HBx A 41 TRP HE3 1.0 1.933 4.609 95 95 A 41 TRP HBy A 41 TRP HE3 1.0 1.897 4.289 96 96 A 42 PHE HBy A 42 PHE HA 1.0 1.765 3.495 97 97 A 42 PHE HBx A 42 PHE HA 1.0 1.613 2.869 98 98 A 36 LYS HA A 42 PHE HA 1.0 1.797 3.655 99 99 A 42 PHE HA A 33 VAL HGy% 1.0 1.913 4.421 100 100 A 42 PHE HA A 43 VAL HGy% 1.0 1.891 4.239 101 101 A 42 PHE HA A 42 PHE HDx 1.0 1.755 3.445 102 102 A 42 PHE HBy A 42 PHE HDx 1.0 1.826 3.814 103 103 A 42 PHE HBy A 33 VAL HGy% 1.0 1.883 4.179 104 104 A 32 ASP HA A 32 ASP HBy 1.0 1.697 3.193 105 105 A 43 VAL HA A 43 VAL HB 1.0 1.827 3.821 106 106 A 61 LYS HBx A 61 LYS HA 1.0 1.567 2.713 107 107 A 43 VAL HB A 43 VAL HGx% 1.0 1.524 2.572 108 108 A 43 VAL HGy% A 43 VAL HA 1.0 1.727 3.315 109 109 A 43 VAL HGy% A 43 VAL HB 1.0 1.647 2.991 110 110 A 34 MET HGy A 43 VAL HGy% 1.0 1.990 5.434 111 111 A 42 PHE HA A 43 VAL HGy% 1.0 1.997 5.703 112 112 A 43 VAL HGy% A 55 PHE HDx 1.0 1.998 5.724 113 113 A 43 VAL HGy% A 52 PHE HDy 1.0 2.000 5.964 114 114 A 43 VAL HGy% A 35 GLU H 1.0 1.990 5.450 115 115 A 43 VAL HGy% A 44 GLY H 1.0 1.780 3.570 116 116 A 43 VAL HA A 43 VAL HGx% 1.0 1.802 3.680 117 117 A 34 MET HBy A 43 VAL HGx% 1.0 1.891 4.239 118 118 A 52 PHE HDy A 43 VAL HGx% 1.0 1.876 4.138 119 119 A 33 VAL HGy% A 44 GLY HAy 1.0 1.921 4.491 120 120 A 44 GLY HAy A 33 VAL HGx% 1.0 1.970 7.020 121 121 A 45 THR HA A 45 THR HB 1.0 1.790 3.618 122 122 A 45 THR HA A 45 THR HG2% 1.0 1.802 3.684 123 123 A 45 THR HA A 45 THR HG1 1.0 1.419 2.271 124 124 A 45 THR HA A 52 PHE HBy 1.0 1.998 5.820 125 125 A 45 THR HA A 52 PHE HBx 1.0 1.895 4.273 126 126 A 45 THR HA A 23 LEU HDy% 1.0 1.929 4.563 127 127 A 45 THR HA A 31 VAL HGy% 1.0 1.917 4.459 128 128 A 45 THR HB A 45 THR HG2% 1.0 1.636 2.952 129 129 A 32 ASP HBy A 45 THR HB 1.0 1.835 3.867 130 130 A 45 THR HG2% A 50 LYS HBy 1.0 1.969 5.033 131 131 A 46 SER HA A 46 SER HBy 1.0 1.757 3.455 132 132 A 31 VAL HB A 46 SER HA 1.0 1.943 4.707 133 133 A 51 GLN HBy A 23 LEU HDy% 1.0 1.621 2.893 134 134 A 47 ARG HBy A 30 ILE HD1% 1.0 1.976 5.148 135 135 A 47 ARG HBy A 47 ARG HDx 1.0 1.619 2.891 136 136 A 47 ARG HBy A 47 ARG HA 1.0 1.664 3.058 137 137 A 47 ARG HDy A 47 ARG HGy 1.0 1.499 2.495 138 138 A 47 ARG HDx A 47 ARG HA 1.0 1.931 4.583 139 139 A 30 ILE HD1% A 47 ARG HDx 1.0 1.862 4.038 140 140 A 47 ARG HDy A 30 ILE HD1% 1.0 1.888 4.220 141 141 A 26 ARG HBy A 26 ARG HDx 1.0 1.683 3.131 142 142 A 47 ARG HDy A 47 ARG HBy 1.0 1.681 3.123 143 143 A 47 ARG HA A 50 LYS HDy 1.0 1.706 3.228 144 144 A 48 ARG HDy A 48 ARG HBx 1.0 1.430 2.298 145 145 A 48 ARG HBy A 48 ARG HA 1.0 1.633 2.943 146 146 A 6 LEU HBx A 6 LEU HA 1.0 1.483 2.451 147 147 A 48 ARG HDy A 48 ARG HGy 1.0 1.553 2.663 148 148 A 49 THR HA A 49 THR HG1 1.0 1.822 3.790 149 149 A 49 THR HA A 49 THR HG2% 1.0 1.824 3.802 150 150 A 48 ARG HGy A 49 THR HA 1.0 1.913 4.419 151 151 A 49 THR HG2% A 49 THR HB 1.0 1.680 3.120 152 152 A 49 THR HG1 A 49 THR HB 1.0 1.657 3.027 153 153 A 49 THR HG1 A 49 THR HG2% 1.0 1.563 2.697 154 154 A 48 ARG HBx A 49 THR HG2% 1.0 1.890 4.238 155 155 A 50 LYS HA A 50 LYS HBy 1.0 1.672 3.088 156 156 A 50 LYS HGx A 50 LYS HBx 1.0 1.673 3.091 157 157 A 50 LYS HBx A 50 LYS HGy 1.0 1.718 3.282 158 158 A 50 LYS HA A 50 LYS HDy 1.0 1.583 2.765 159 159 A 50 LYS HBy A 50 LYS HDy 1.0 1.849 3.949 160 160 A 51 GLN HBy A 51 GLN HGx 1.0 1.677 3.111 161 161 A 51 GLN HGy A 51 GLN HBy 1.0 1.586 2.772 162 162 A 51 GLN HA A 51 GLN HGx 1.0 1.905 4.349 163 163 A 49 THR HG2% A 51 GLN HGx 1.0 1.773 3.531 164 164 A 51 GLN HGy A 49 THR HG2% 1.0 1.989 5.427 165 165 A 23 LEU HDy% A 51 GLN HGx 1.0 1.851 3.967 166 166 A 51 GLN HBx A 49 THR HG1 1.0 1.739 3.369 167 167 A 51 GLN HBy A 49 THR HG1 1.0 1.962 4.940 168 168 A 45 THR HA A 52 PHE HA 1.0 1.474 2.424 169 169 A 52 PHE HBy A 52 PHE HA 1.0 1.845 3.929 170 170 A 52 PHE HBx A 52 PHE HA 1.0 1.788 3.604 171 171 A 45 THR HG2% A 52 PHE HBx 1.0 1.797 3.655 172 172 A 45 THR HG2% A 52 PHE HBy 1.0 1.956 4.860 173 173 A 52 PHE HDy A 52 PHE HBy 1.0 1.811 3.729 174 174 A 52 PHE HDy A 52 PHE HBx 1.0 1.796 3.648 175 175 A 53 GLY HAy A 54 THR HG1 1.0 1.993 6.499 176 176 A 54 THR HG2% A 53 GLY HAy 1.0 1.895 4.277 177 177 A 54 THR HA A 43 VAL HGx% 1.0 1.988 5.396 178 178 A 43 VAL HA A 54 THR HA 1.0 1.535 2.609 179 179 A 55 PHE HDx A 54 THR HA 1.0 1.911 4.405 180 180 A 54 THR HA A 54 THR HB 1.0 1.628 2.924 181 181 A 54 THR HG2% A 54 THR HB 1.0 1.668 3.074 182 182 A 54 THR HB A 43 VAL HGx% 1.0 1.979 5.199 183 183 A 54 THR HG2% A 54 THR HA 1.0 1.820 3.782 184 184 A 54 THR HG2% A 54 THR HG1 1.0 1.689 3.157 185 185 A 55 PHE HA A 56 PRO HDx 1.0 1.626 2.914 186 186 A 55 PHE HA A 55 PHE HBx 1.0 1.830 3.840 187 187 A 55 PHE HDx A 55 PHE HBx 1.0 1.809 3.721 188 188 A 55 PHE HBx A 55 PHE HBy 1.0 1.709 3.243 189 189 A 55 PHE HA A 55 PHE HBy 1.0 1.500 2.502 190 190 A 55 PHE HDx A 55 PHE HBy 1.0 1.609 2.855 191 191 A 41 TRP HA A 56 PRO HA 1.0 1.647 2.993 192 192 A 55 PHE HDx A 56 PRO HA 1.0 1.979 6.833 193 193 A 57 GLY H A 56 PRO HA 1.0 1.596 2.810 194 194 A 56 PRO HA A 56 PRO HBx 1.0 1.709 3.239 195 195 A 56 PRO HGx A 56 PRO HDy 1.0 1.854 3.984 196 196 A 57 GLY H A 57 GLY HAy 1.0 1.631 2.933 197 197 A 59 TYR HA A 59 TYR HBx 1.0 1.835 3.871 198 198 A 59 TYR HA A 59 TYR HBy 1.0 1.848 3.948 199 199 A 59 TYR HBy A 25 LEU HDx% 1.0 1.882 4.176 200 200 A 59 TYR HBx A 25 LEU HDx% 1.0 1.884 4.194 201 201 A 60 VAL HGx% A 59 TYR HBx 1.0 1.950 4.780 202 202 A 60 VAL HA A 60 VAL HB 1.0 1.645 2.985 203 203 A 60 VAL HB A 60 VAL HGy% 1.0 1.512 2.538 204 204 A 60 VAL HGx% A 60 VAL HB 1.0 1.514 2.542 205 205 A 60 VAL HB A 9 TYR HDx 1.0 1.723 3.299 206 206 A 60 VAL HA A 60 VAL HGy% 1.0 1.812 3.734 207 207 A 33 VAL HGy% A 33 VAL HB 1.0 1.584 2.766 208 208 A 61 LYS HA A 62 PRO HDy 1.0 1.328 2.034 209 209 A 61 LYS HA A 61 LYS HBy 1.0 1.438 2.320 210 210 A 61 LYS HA A 12 LEU HDx% 1.0 1.914 4.426 211 211 A 50 LYS HA A 50 LYS HBx 1.0 1.638 2.958 212 212 A 61 LYS HBy A 61 LYS HGy 1.0 1.914 4.428 213 213 A 61 LYS HBx A 61 LYS HGy 1.0 1.972 5.094 214 214 A 61 LYS HBy A 61 LYS HGx 1.0 1.763 3.483 215 215 A 61 LYS HBx A 61 LYS HGx 1.0 1.740 3.374 216 216 A 62 PRO HA A 9 TYR HA 1.0 1.760 3.466 217 217 A 62 PRO HA A 63 LEU H 1.0 1.551 2.661 218 218 A 62 PRO HA A 62 PRO HBy 1.0 1.623 2.903 219 219 A 62 PRO HA A 62 PRO HGy 1.0 1.874 4.122 220 220 A 62 PRO HA A 9 TYR HBy 1.0 1.883 4.181 221 221 A 16 ILE HA A 17 PRO HDy 1.0 1.711 3.251 222 222 A 61 LYS HA A 62 PRO HDx 1.0 1.604 2.838 223 223 A 62 PRO HA A 62 PRO HBx 1.0 1.580 2.756 224 224 A 24 GLU HGx A 17 PRO HDy 1.0 1.903 4.331 225 225 A 65 LEU HBy A 5 ASP HA 1.0 1.950 4.780 226 226 A 6 LEU HBy A 6 LEU HDx% 1.0 1.909 4.391 227 227 A 6 LEU HBy A 7 PHE H 1.0 1.932 4.592 228 228 A 65 LEU HBx A 65 LEU HA 1.0 1.534 2.604 229 229 A 63 LEU HBy A 63 LEU HA 1.0 1.705 3.225 230 230 A 63 LEU HA A 63 LEU HG 1.0 1.716 3.266 231 231 A 63 LEU HA A 64 TYR H 1.0 1.586 2.776 232 232 A 63 LEU HA A 63 LEU HDx% 1.0 1.964 4.976 233 233 A 64 TYR HBy A 64 TYR HA 1.0 1.643 2.977 234 234 A 64 TYR HA A 64 TYR HBx 1.0 1.657 3.027 235 235 A 5 ASP HA A 5 ASP HBy 1.0 1.679 3.117 236 236 A 4 GLN HA A 4 GLN HGy 1.0 1.927 4.541 237 237 A 4 GLN HA A 4 GLN HBy 1.0 1.659 3.037 238 238 A 22 GLU HA A 22 GLU HGy 1.0 1.906 4.362 239 239 A 31 VAL HB A 31 VAL HGx% 1.0 1.760 3.472 240 240 A 3 SER HA A 3 SER HBy 1.0 1.598 2.816 241 241 A 25 LEU HBx A 14 SER HA 1.0 1.811 3.733 242 242 A 6 LEU HBx A 3 SER HA 1.0 1.960 4.910 243 243 A 3 SER HA A 3 SER H 1.0 1.665 3.063 244 244 A 14 SER HA A 27 ASP H 1.0 1.563 2.699 245 245 A 26 ARG HA A 14 SER HA 1.0 1.670 3.082 246 246 A 43 VAL HGy% A 54 THR HA 1.0 1.932 4.592 247 247 A 46 SER HBy A 23 LEU HG 1.0 1.978 5.188 248 248 A 23 LEU HDy% A 46 SER HBy 1.0 1.773 3.531 249 249 A 46 SER HBy A 51 GLN H 1.0 1.805 3.697 250 250 A 14 SER HBx A 15 TYR H 1.0 1.765 3.489 251 251 A 14 SER HBx A 14 SER H 1.0 1.801 3.675 252 252 A 4 GLN HA A 4 GLN HBx 1.0 1.988 5.390 253 253 A 6 LEU HBx A 6 LEU H 1.0 1.649 3.001 254 254 A 6 LEU HBy A 6 LEU H 1.0 1.511 2.533 255 255 A 6 LEU HA A 6 LEU HDy% 1.0 1.913 4.423 256 256 A 7 PHE HBx A 7 PHE HA 1.0 1.828 3.826 257 257 A 7 PHE HA A 7 PHE HBy 1.0 1.859 4.017 258 258 A 7 PHE HBy A 7 PHE HDy 1.0 1.840 3.898 259 259 A 7 PHE HBy A 7 PHE HEy 1.0 1.998 5.776 260 260 A 7 PHE HBx A 7 PHE HEy 1.0 2.000 5.878 261 261 A 7 PHE HBy A 8 SER H 1.0 1.862 4.034 262 262 A 7 PHE HBx A 8 SER H 1.0 1.940 4.680 263 263 A 7 PHE HBx A 7 PHE HBy 1.0 1.598 2.818 264 264 A 9 TYR HDx A 8 SER HA 1.0 2.000 5.890 265 265 A 8 SER HA A 9 TYR H 1.0 1.673 3.091 266 266 A 9 TYR HBy A 8 SER HA 1.0 1.955 7.239 267 267 A 8 SER HA A 8 SER HBx 1.0 1.817 3.767 268 268 A 8 SER HA A 8 SER HBy 1.0 1.841 3.905 269 269 A 8 SER HBx A 30 ILE HG2% 1.0 1.895 4.275 270 270 A 63 LEU HDx% A 8 SER HBx 1.0 1.912 4.412 271 271 A 8 SER HBy A 63 LEU HBx 1.0 1.977 5.159 272 272 A 63 LEU HBy A 8 SER HBy 1.0 1.673 3.093 273 273 A 8 SER HBx A 63 LEU HBx 1.0 2.000 5.926 274 274 A 63 LEU HBy A 8 SER HBx 1.0 1.995 5.617 275 275 A 8 SER H A 8 SER HBx 1.0 1.914 4.430 276 276 A 9 TYR HDx A 9 TYR HA 1.0 1.936 4.630 277 277 A 9 TYR HA A 9 TYR HBy 1.0 1.692 3.166 278 278 A 9 TYR HA A 63 LEU HG 1.0 1.826 3.812 279 279 A 9 TYR HA A 63 LEU HDx% 1.0 1.760 3.466 280 280 A 9 TYR HA A 63 LEU H 1.0 1.751 3.429 281 281 A 9 TYR HBx A 9 TYR HEx 1.0 1.987 5.347 282 282 A 9 TYR HDx A 9 TYR HBx 1.0 1.057 12.439 283 283 A 9 TYR HDx A 9 TYR HBy 1.0 1.703 3.213 284 284 A 9 TYR HBy A 9 TYR HEx 1.0 1.978 5.188 285 285 A 60 VAL HGy% A 9 TYR HBx 1.0 0.905 13.017 286 286 A 60 VAL HGy% A 9 TYR HBy 1.0 1.925 4.525 287 287 A 60 VAL HGx% A 9 TYR HBx 1.0 1.878 4.144 288 288 A 30 ILE HA A 10 GLN HA 1.0 1.810 3.726 289 289 A 10 GLN HA A 11 ALA H 1.0 1.668 3.074 290 290 A 31 VAL H A 10 GLN HA 1.0 1.727 3.315 291 291 A 10 GLN HGx A 10 GLN HA 1.0 1.599 2.821 292 292 A 30 ILE HG1x A 10 GLN HA 1.0 1.872 4.110 293 293 A 10 GLN HA A 11 ALA HB% 1.0 1.931 4.577 294 294 A 30 ILE HD1% A 10 GLN HA 1.0 1.895 4.277 295 295 A 30 ILE HG1y A 10 GLN HA 1.0 1.812 3.734 296 296 A 10 GLN HA A 10 GLN HBx 1.0 1.796 3.648 297 297 A 10 GLN HA A 10 GLN HBy 1.0 1.760 3.466 298 298 A 63 LEU HDx% A 10 GLN HBy 1.0 1.993 5.555 299 299 A 63 LEU HDx% A 10 GLN HBx 1.0 1.903 4.329 300 300 A 26 ARG HDy A 26 ARG HBx 1.0 1.971 5.073 301 301 A 10 GLN HGx A 11 ALA HB% 1.0 1.871 4.097 302 302 A 10 GLN HGx A 61 LYS HGy 1.0 1.914 4.430 303 303 A 60 VAL HA A 11 ALA HA 1.0 1.351 2.091 304 304 A 29 ASP HBx A 11 ALA HB% 1.0 1.894 4.260 305 305 A 28 GLY HAy A 11 ALA HB% 1.0 1.866 4.064 306 306 A 11 ALA HA A 11 ALA HB% 1.0 1.734 3.346 307 307 A 12 LEU H A 11 ALA HB% 1.0 1.886 4.202 308 308 A 28 GLY H A 11 ALA HB% 1.0 1.779 3.563 309 309 A 10 GLN HGy A 11 ALA HB% 1.0 1.962 4.940 310 310 A 59 TYR HA A 12 LEU HBx 1.0 1.677 3.111 311 311 A 59 TYR HA A 12 LEU HDx% 1.0 1.670 3.080 312 312 A 46 SER HBy A 47 ARG HA 1.0 1.985 5.333 313 313 A 59 TYR HA A 59 TYR HDx 1.0 1.974 5.126 314 314 A 12 LEU HA A 12 LEU HDy% 1.0 1.610 2.856 315 315 A 12 LEU HBx A 12 LEU HA 1.0 1.861 4.027 316 316 A 27 ASP HA A 12 LEU HA 1.0 1.952 4.802 317 317 A 12 LEU H A 12 LEU HA 1.0 1.873 4.113 318 318 A 12 LEU HBx A 12 LEU HG 1.0 1.861 4.029 319 319 A 12 LEU HG A 12 LEU HBy 1.0 1.903 4.339 320 320 A 12 LEU HBx A 12 LEU HBy 1.0 1.652 3.010 321 321 A 12 LEU HA A 12 LEU HBy 1.0 1.850 3.960 322 322 A 12 LEU HBy A 13 TYR HDx 1.0 1.712 3.254 323 323 A 12 LEU HBx A 13 TYR HDx 1.0 1.797 3.655 324 324 A 12 LEU HBy A 13 TYR H 1.0 1.872 4.104 325 325 A 12 LEU HDx% A 12 LEU HBx 1.0 1.681 3.125 326 326 A 12 LEU HDx% A 12 LEU HBy 1.0 1.838 3.888 327 327 A 12 LEU HDx% A 12 LEU HA 1.0 1.954 4.840 328 328 A 11 ALA HA A 12 LEU HDx% 1.0 1.999 6.175 329 329 A 60 VAL HA A 12 LEU HDx% 1.0 1.773 3.531 330 330 A 12 LEU HDx% A 13 TYR H 1.0 1.975 5.121 331 331 A 12 LEU HDx% A 13 TYR HDx 1.0 1.948 4.758 332 332 A 12 LEU HDx% A 60 VAL H 1.0 1.533 2.601 333 333 A 13 TYR HDx A 13 TYR HBx 1.0 1.798 3.660 334 334 A 13 TYR HDx A 13 TYR HBy 1.0 1.493 2.479 335 335 A 13 TYR HBy A 13 TYR HEx 1.0 1.986 5.354 336 336 A 48 ARG HGy A 48 ARG HDx 1.0 1.859 4.017 337 337 A 13 TYR HBx A 13 TYR HBy 1.0 1.604 2.838 338 338 A 13 TYR HA A 13 TYR HBx 1.0 1.774 3.538 339 339 A 13 TYR HA A 13 TYR HBy 1.0 1.709 3.243 340 340 A 12 LEU HDx% A 61 LYS HDy 1.0 1.983 5.287 341 341 A 61 LYS HBy A 12 LEU HDx% 1.0 1.928 4.558 342 342 A 61 LYS HBx A 12 LEU HDx% 1.0 1.944 7.396 343 343 A 12 LEU HDx% A 12 LEU HG 1.0 1.429 2.297 344 344 A 12 LEU HDx% A 61 LYS HEy 1.0 1.918 4.466 345 345 A 12 LEU HA A 12 LEU HG 1.0 1.511 2.533 346 346 A 11 ALA HA A 12 LEU HG 1.0 1.943 4.713 347 347 A 12 LEU HG A 61 LYS H 1.0 1.979 5.199 348 348 A 13 TYR HBx A 13 TYR HEx 1.0 1.899 7.905 349 349 A 13 TYR H A 13 TYR HBx 1.0 1.884 4.192 350 350 A 27 ASP HBy A 14 SER HA 1.0 1.984 5.306 351 351 A 27 ASP HBx A 14 SER HA 1.0 1.899 4.305 352 352 A 51 GLN H A 46 SER HBx 1.0 1.752 3.434 353 353 A 52 PHE HBx A 53 GLY H 1.0 1.867 4.067 354 354 A 51 GLN HA A 52 PHE HBy 1.0 1.903 4.331 355 355 A 51 GLN HA A 52 PHE HBx 1.0 1.945 4.723 356 356 A 52 PHE HA A 23 LEU HG 1.0 1.974 5.116 357 357 A 23 LEU HDy% A 52 PHE HA 1.0 1.897 4.285 358 358 A 45 THR HG2% A 52 PHE HA 1.0 1.918 4.466 359 359 A 45 THR HB A 52 PHE HA 1.0 1.993 5.513 360 360 A 52 PHE HDy A 52 PHE HA 1.0 1.900 4.314 361 361 A 52 PHE HA A 53 GLY H 1.0 1.648 2.996 362 362 A 46 SER HBy A 52 PHE HA 1.0 1.943 7.413 363 363 A 15 TYR HA A 15 TYR HBy 1.0 1.846 3.930 364 364 A 15 TYR HA A 15 TYR HBx 1.0 1.801 3.675 365 365 A 15 TYR HA A 16 ILE HB 1.0 1.914 4.428 366 366 A 15 TYR HA A 16 ILE HG1x 1.0 1.934 4.606 367 367 A 15 TYR HA A 15 TYR HDx 1.0 1.903 4.339 368 368 A 15 TYR HBy A 15 TYR HDx 1.0 1.985 5.319 369 369 A 15 TYR HBx A 15 TYR HEx 1.0 1.985 5.319 370 370 A 25 LEU HDx% A 15 TYR HBy 1.0 1.683 3.131 371 371 A 16 ILE HA A 16 ILE HB 1.0 1.660 3.042 372 372 A 17 PRO HDy A 16 ILE HB 1.0 1.982 5.254 373 373 A 16 ILE HD1% A 16 ILE HG1x 1.0 1.718 3.278 374 374 A 16 ILE HD1% A 16 ILE HB 1.0 1.812 3.736 375 375 A 24 GLU HGy A 16 ILE HD1% 1.0 1.974 5.110 376 376 A 16 ILE HD1% A 14 SER HBx 1.0 1.995 5.627 377 377 A 16 ILE HA A 16 ILE HD1% 1.0 1.867 4.071 378 378 A 16 ILE HD1% A 16 ILE HG1y 1.0 1.705 3.225 379 379 A 16 ILE HG2% A 16 ILE H 1.0 1.935 4.627 380 380 A 17 PRO HDy A 17 PRO HBx 1.0 1.831 3.841 381 381 A 16 ILE HD1% A 17 PRO HDx 1.0 1.822 3.790 382 382 A 17 PRO HDy A 16 ILE HD1% 1.0 1.840 3.896 383 383 A 24 GLU HA A 17 PRO HDx 1.0 1.834 3.864 384 384 A 24 GLU HA A 17 PRO HDy 1.0 1.779 3.563 385 385 A 16 ILE HA A 17 PRO HDx 1.0 1.757 3.455 386 386 A 17 PRO HA A 18 GLN HGx 1.0 1.783 3.583 387 387 A 17 PRO HA A 17 PRO HBx 1.0 1.735 3.355 388 388 A 17 PRO HA A 17 PRO HGx 1.0 1.976 5.142 389 389 A 17 PRO HA A 17 PRO HGy 1.0 1.914 4.432 390 390 A 24 GLU HGy A 17 PRO HDx 1.0 1.917 4.449 391 391 A 24 GLU HGx A 17 PRO HDx 1.0 1.873 4.111 392 392 A 17 PRO HDy A 17 PRO HBy 1.0 1.939 4.667 393 393 A 17 PRO HDx A 17 PRO HBy 1.0 1.945 4.723 394 394 A 17 PRO HBx A 17 PRO HDx 1.0 1.640 2.964 395 395 A 17 PRO HA A 17 PRO HBy 1.0 1.771 3.519 396 396 A 17 PRO HBy A 19 ASN H 1.0 1.801 3.679 397 397 A 24 GLU HA A 17 PRO HGy 1.0 1.901 4.321 398 398 A 24 GLU HA A 17 PRO HGx 1.0 1.910 4.400 399 399 A 17 PRO HDx A 17 PRO HGy 1.0 1.930 4.580 400 400 A 17 PRO HDy A 17 PRO HGy 1.0 1.735 3.355 401 401 A 17 PRO HDx A 17 PRO HGx 1.0 1.889 4.229 402 402 A 17 PRO HDy A 17 PRO HGx 1.0 1.796 3.648 403 403 A 24 GLU HGx A 17 PRO HGy 1.0 1.895 4.277 404 404 A 24 GLU HGx A 17 PRO HGx 1.0 1.939 4.661 405 405 A 18 GLN HGx A 18 GLN HA 1.0 1.862 4.042 406 406 A 18 GLN HA A 18 GLN HBx 1.0 1.748 3.408 407 407 A 18 GLN HA A 19 ASN HBx 1.0 1.992 5.496 408 408 A 19 ASN H A 18 GLN HA 1.0 1.865 4.059 409 409 A 18 GLN HA A 18 GLN HBy 1.0 1.558 2.680 410 410 A 18 GLN HA A 18 GLN HGy 1.0 1.828 3.826 411 411 A 19 ASN HBx A 19 ASN HA 1.0 1.762 3.478 412 412 A 19 ASN HBy A 22 GLU H 1.0 1.797 3.655 413 413 A 19 ASN HBx A 22 GLU H 1.0 1.889 4.223 414 414 A 19 ASN HA A 19 ASN HBy 1.0 1.576 2.738 415 415 A 20 ASP HA A 20 ASP HBx 1.0 1.534 2.604 416 416 A 23 LEU HDy% A 46 SER HA 1.0 1.893 4.251 417 417 A 51 GLN HGy A 49 THR HG1 1.0 1.842 3.906 418 418 A 49 THR HG1 A 51 GLN HGx 1.0 1.780 3.570 419 419 A 22 GLU HA A 53 GLY HAy 1.0 1.911 4.409 420 420 A 22 GLU HA A 54 THR H 1.0 1.683 3.135 421 421 A 22 GLU HA A 54 THR HB 1.0 1.991 5.481 422 422 A 31 VAL HGx% A 44 GLY HAy 1.0 1.868 4.080 423 423 A 60 VAL HGx% A 9 TYR HBy 1.0 1.958 4.880 424 424 A 31 VAL HB A 31 VAL HGy% 1.0 1.731 3.333 425 425 A 31 VAL HGy% A 10 GLN HA 1.0 1.706 9.362 426 426 A 60 VAL HGx% A 10 GLN HA 1.0 1.973 5.089 427 427 A 42 PHE HBx A 33 VAL HGy% 1.0 1.467 2.403 428 428 A 31 VAL HGy% A 46 SER HA 1.0 1.573 2.733 429 429 A 31 VAL HGx% A 46 SER HA 1.0 1.985 5.333 430 430 A 31 VAL HA A 31 VAL HGy% 1.0 1.601 2.827 431 431 A 55 PHE HBy A 25 LEU HDx% 1.0 1.994 5.564 432 432 A 55 PHE HBx A 25 LEU HDx% 1.0 1.928 4.560 433 433 A 55 PHE HBx A 56 PRO HDy 1.0 1.783 3.583 434 434 A 23 LEU HBy A 23 LEU HDx% 1.0 1.879 4.155 435 435 A 23 LEU HG A 23 LEU HBy 1.0 1.848 3.944 436 436 A 23 LEU HG A 23 LEU HBx 1.0 1.832 3.850 437 437 A 23 LEU HDx% A 23 LEU HBx 1.0 1.885 4.197 438 438 A 23 LEU HBy A 23 LEU HBx 1.0 1.658 3.034 439 439 A 55 PHE HBx A 23 LEU HBx 1.0 1.895 4.279 440 440 A 55 PHE HBx A 23 LEU HBy 1.0 1.753 3.439 441 441 A 55 PHE HBy A 23 LEU HBx 1.0 1.883 4.179 442 442 A 55 PHE HBy A 23 LEU HBy 1.0 1.667 3.069 443 443 A 23 LEU HA A 23 LEU HBy 1.0 1.869 4.089 444 444 A 23 LEU HA A 23 LEU HBx 1.0 1.879 4.153 445 445 A 55 PHE HDx A 23 LEU HBy 1.0 1.885 4.199 446 446 A 55 PHE HDx A 23 LEU HBx 1.0 1.830 3.838 447 447 A 23 LEU HA A 23 LEU HG 1.0 1.802 3.678 448 448 A 46 SER HA A 23 LEU HG 1.0 1.915 4.437 449 449 A 45 THR HA A 23 LEU HG 1.0 2.000 5.902 450 450 A 45 THR HG1 A 23 LEU HG 1.0 1.928 7.588 451 451 A 23 LEU HG A 24 GLU H 1.0 1.998 5.744 452 452 A 23 LEU HG A 23 LEU HDx% 1.0 1.742 3.384 453 453 A 51 GLN HBy A 23 LEU HG 1.0 1.976 5.148 454 454 A 55 PHE HBy A 23 LEU HG 1.0 1.989 5.419 455 455 A 51 GLN HBx A 23 LEU HDy% 1.0 1.874 4.120 456 456 A 51 GLN HGy A 23 LEU HDy% 1.0 1.356 2.104 457 457 A 23 LEU HA A 23 LEU HDx% 1.0 1.859 4.017 458 458 A 25 LEU HA A 25 LEU HG 1.0 1.916 4.442 459 459 A 25 LEU HBx A 15 TYR HBx 1.0 1.831 3.847 460 460 A 25 LEU HBx A 15 TYR HBy 1.0 1.916 4.444 461 461 A 25 LEU HBy A 15 TYR HBx 1.0 1.953 4.825 462 462 A 25 LEU HBy A 15 TYR HBy 1.0 1.914 4.430 463 463 A 25 LEU HG A 15 TYR HBy 1.0 1.935 4.621 464 464 A 25 LEU HDx% A 15 TYR HBx 1.0 1.891 4.247 465 465 A 59 TYR HBx A 25 LEU HDx% 1.0 1.870 4.086 466 466 A 59 TYR HBy A 25 LEU HDx% 1.0 1.921 4.489 467 467 A 25 LEU HG A 25 LEU HDx% 1.0 1.675 3.099 468 468 A 25 LEU HDx% A 17 PRO HGx 1.0 1.993 5.539 469 469 A 25 LEU HBx A 25 LEU HDx% 1.0 1.794 3.640 470 470 A 25 LEU HBy A 25 LEU HDx% 1.0 1.827 3.817 471 471 A 25 LEU HDx% A 15 TYR HDx 1.0 1.883 4.177 472 472 A 25 LEU HDx% A 59 TYR HEx 1.0 1.875 4.123 473 473 A 25 LEU HA A 25 LEU HDy% 1.0 1.736 3.360 474 474 A 25 LEU HDy% A 55 PHE HBy 1.0 1.985 5.319 475 475 A 25 LEU HG A 25 LEU HDy% 1.0 1.649 3.001 476 476 A 25 LEU HDy% A 15 TYR HBy 1.0 1.989 5.419 477 477 A 26 ARG HBx A 26 ARG HDx 1.0 1.418 2.266 478 478 A 26 ARG HGx A 26 ARG HDx 1.0 1.903 4.329 479 479 A 26 ARG HGy A 26 ARG HDx 1.0 1.718 3.274 480 480 A 26 ARG HDy A 26 ARG HGx 1.0 1.760 3.466 481 481 A 26 ARG HDy A 26 ARG HGy 1.0 1.925 4.517 482 482 A 29 ASP HBy A 11 ALA HB% 1.0 1.749 3.413 483 483 A 30 ILE HB A 29 ASP HA 1.0 1.923 4.507 484 484 A 30 ILE HB A 47 ARG HDx 1.0 1.975 5.131 485 485 A 10 GLN HGx A 30 ILE HD1% 1.0 1.854 3.988 486 486 A 30 ILE HA A 30 ILE HD1% 1.0 1.846 3.934 487 487 A 30 ILE HD1% A 29 ASP HA 1.0 1.999 6.175 488 488 A 30 ILE HD1% A 10 GLN HE2x 1.0 1.965 4.967 489 489 A 30 ILE HD1% A 10 GLN HE2y 1.0 1.980 5.224 490 490 A 31 VAL H A 30 ILE HD1% 1.0 1.987 5.367 491 491 A 30 ILE HD1% A 11 ALA H 1.0 1.971 5.053 492 492 A 30 ILE HG1x A 30 ILE HG1y 1.0 1.623 2.903 493 493 A 30 ILE HG1x A 30 ILE HD1% 1.0 1.641 2.971 494 494 A 30 ILE HG1y A 30 ILE HD1% 1.0 1.505 2.513 495 495 A 30 ILE HB A 30 ILE HG2% 1.0 1.641 2.969 496 496 A 30 ILE HG1y A 30 ILE HG2% 1.0 1.822 3.796 497 497 A 47 ARG HDy A 30 ILE HG2% 1.0 1.892 4.248 498 498 A 8 SER HBx A 30 ILE HG2% 1.0 1.923 4.507 499 499 A 8 SER HBy A 30 ILE HG2% 1.0 1.971 5.073 500 500 A 30 ILE HG2% A 10 GLN HA 1.0 1.998 5.744 501 501 A 8 SER HA A 30 ILE HG2% 1.0 1.985 5.319 502 502 A 31 VAL HA A 47 ARG HA 1.0 1.977 5.159 503 503 A 48 ARG HA A 48 ARG HGx 1.0 1.672 3.088 504 504 A 47 ARG HA A 30 ILE HG2% 1.0 2.000 5.878 505 505 A 31 VAL HB A 9 TYR HBx 1.0 1.988 6.624 506 506 A 30 ILE HA A 31 VAL HB 1.0 1.948 4.758 507 507 A 31 VAL HB A 9 TYR HDx 1.0 1.588 10.046 508 508 A 31 VAL HGy% A 45 THR H 1.0 1.914 4.426 509 509 A 32 ASP HA A 33 VAL HB 1.0 1.952 4.810 510 510 A 32 ASP HA A 33 VAL HGx% 1.0 1.944 4.716 511 511 A 32 ASP HBy A 45 THR HG2% 1.0 1.973 5.089 512 512 A 45 THR HB A 46 SER H 1.0 1.844 3.922 513 513 A 44 GLY HAy A 33 VAL HA 1.0 1.374 2.150 514 514 A 33 VAL HB A 33 VAL HA 1.0 1.560 2.686 515 515 A 33 VAL HGx% A 33 VAL HA 1.0 1.851 3.967 516 516 A 33 VAL HGy% A 33 VAL HA 1.0 1.501 2.503 517 517 A 9 TYR HDx A 33 VAL HB 1.0 1.861 4.029 518 518 A 33 VAL HB A 9 TYR HEx 1.0 1.836 3.876 519 519 A 33 VAL HB A 8 SER HA 1.0 1.980 5.230 520 520 A 33 VAL HB A 7 PHE HBy 1.0 1.927 4.549 521 521 A 33 VAL HGx% A 9 TYR HEx 1.0 1.954 4.828 522 522 A 33 VAL HGx% A 9 TYR HDx 1.0 1.760 3.466 523 523 A 33 VAL HGx% A 8 SER HA 1.0 1.932 4.594 524 524 A 33 VAL HGx% A 7 PHE HBy 1.0 1.980 6.836 525 525 A 42 PHE HBx A 33 VAL HGx% 1.0 1.998 5.754 526 526 A 33 VAL HGx% A 33 VAL HB 1.0 1.734 3.346 527 527 A 33 VAL HGx% A 9 TYR HBx 1.0 0.000 41.823 528 528 A 34 MET HBy A 33 VAL HA 1.0 1.909 4.385 529 529 A 34 MET HGy A 44 GLY HAy 1.0 1.861 4.035 530 530 A 34 MET HGy A 35 GLU H 1.0 1.976 5.154 531 531 A 35 GLU HBy A 36 LYS H 1.0 1.844 3.922 532 532 A 36 LYS HBy A 36 LYS HEy 1.0 1.948 4.758 533 533 A 36 LYS HBy A 42 PHE HDx 1.0 1.961 4.931 534 534 A 36 LYS HBy A 42 PHE HEx 1.0 1.889 4.231 535 535 A 36 LYS HA A 36 LYS HDy 1.0 1.902 4.326 536 536 A 36 LYS HDy A 42 PHE HEx 1.0 1.928 4.558 537 537 A 36 LYS HDy A 42 PHE HDx 1.0 1.982 5.248 538 538 A 36 LYS HGy A 33 VAL HGy% 1.0 1.901 4.319 539 539 A 36 LYS HGy A 36 LYS HEy 1.0 1.862 4.036 540 540 A 36 LYS HA A 36 LYS HGy 1.0 1.908 4.380 541 541 A 37 CYS HBx A 40 GLY H 1.0 1.617 2.881 542 542 A 41 TRP HA A 56 PRO HBy 1.0 1.968 5.014 543 543 A 42 PHE HBy A 33 VAL HGx% 1.0 1.905 7.845 544 544 A 43 VAL HA A 54 THR HB 1.0 1.803 3.687 545 545 A 43 VAL HB A 35 GLU H 1.0 1.779 3.563 546 546 A 43 VAL HGy% A 55 PHE H 1.0 1.986 6.688 547 547 A 32 ASP HBy A 44 GLY HAy 1.0 1.926 4.536 548 548 A 34 MET HBy A 44 GLY HAy 1.0 1.991 5.473 549 549 A 52 PHE HDy A 45 THR HG2% 1.0 1.929 4.569 550 550 A 45 THR HG2% A 51 GLN H 1.0 1.716 3.266 551 551 A 45 THR HG2% A 50 LYS H 1.0 1.970 5.048 552 552 A 45 THR HG2% A 45 THR HG1 1.0 1.640 2.964 553 553 A 45 THR HG2% A 50 LYS HDy 1.0 1.964 4.976 554 554 A 46 SER HA A 46 SER HBx 1.0 1.591 2.791 555 555 A 46 SER HBy A 46 SER HBx 1.0 1.532 2.598 556 556 A 46 SER HBy A 49 THR HG1 1.0 1.889 4.229 557 557 A 49 THR HG1 A 46 SER HBx 1.0 1.991 5.465 558 558 A 49 THR HG2% A 46 SER HBx 1.0 1.727 3.319 559 559 A 23 LEU HDy% A 46 SER HBx 1.0 1.748 3.408 560 560 A 23 LEU HG A 46 SER HBx 1.0 1.725 3.307 561 561 A 47 ARG HBy A 30 ILE HG2% 1.0 1.811 3.729 562 562 A 48 ARG HA A 48 ARG HDx 1.0 1.990 5.450 563 563 A 47 ARG HDy A 47 ARG HA 1.0 1.928 4.552 564 564 A 47 ARG HDx A 30 ILE HG2% 1.0 1.942 4.700 565 565 A 47 ARG HDy A 47 ARG HDx 1.0 1.457 2.375 566 566 A 47 ARG HDx A 47 ARG HGy 1.0 1.740 3.374 567 567 A 47 ARG HA A 47 ARG HGy 1.0 1.631 2.933 568 568 A 50 LYS HDy A 50 LYS HEy 1.0 1.497 2.491 569 569 A 50 LYS HDy A 50 LYS HBx 1.0 1.868 4.078 570 570 A 48 ARG HBy A 48 ARG HDx 1.0 1.851 3.961 571 571 A 48 ARG HBx A 49 THR HG2% 1.0 1.887 4.211 572 572 A 48 ARG HBy A 49 THR HG2% 1.0 1.872 4.110 573 573 A 48 ARG HBx A 49 THR H 1.0 1.596 2.810 574 574 A 48 ARG HBy A 49 THR H 1.0 1.869 4.085 575 575 A 48 ARG HDy A 48 ARG HDx 1.0 1.497 2.491 576 576 A 48 ARG HBx A 48 ARG HDx 1.0 1.811 3.731 577 577 A 48 ARG HDx A 48 ARG HGx 1.0 1.641 2.969 578 578 A 48 ARG HDy A 48 ARG HGx 1.0 1.641 2.973 579 579 A 49 THR HB A 46 SER HBx 1.0 2.000 5.854 580 580 A 49 THR HB A 51 GLN HGx 1.0 1.971 5.053 581 581 A 46 SER HBy A 49 THR HG2% 1.0 1.456 2.374 582 582 A 51 GLN HBy A 49 THR HG2% 1.0 1.972 5.078 583 583 A 50 LYS HA A 45 THR HG2% 1.0 1.657 3.029 584 584 A 50 LYS HA A 50 LYS HGy 1.0 1.847 3.939 585 585 A 50 LYS HBy A 50 LYS HGy 1.0 1.651 3.007 586 586 A 50 LYS HGx A 50 LYS HBy 1.0 1.674 3.096 587 587 A 50 LYS HGy A 50 LYS HEy 1.0 1.708 3.236 588 588 A 50 LYS HGx A 50 LYS HEy 1.0 1.800 3.668 589 589 A 50 LYS HA A 50 LYS HEy 1.0 1.251 1.853 590 590 A 47 ARG HA A 50 LYS HEy 1.0 1.824 3.802 591 591 A 50 LYS HGx A 50 LYS HDy 1.0 1.588 2.782 592 592 A 50 LYS HDy A 50 LYS HGy 1.0 1.711 3.251 593 593 A 43 VAL HGy% A 53 GLY HAy 1.0 1.966 5.004 594 594 A 54 THR HA A 55 PHE H 1.0 1.647 2.991 595 595 A 44 GLY H A 54 THR HA 1.0 1.817 3.759 596 596 A 54 THR HB A 55 PHE HA 1.0 1.994 5.590 597 597 A 43 VAL HGy% A 54 THR HB 1.0 1.800 3.670 598 598 A 54 THR HG2% A 22 GLU HGy 1.0 1.531 2.597 599 599 A 54 THR HG2% A 22 GLU HGx 1.0 1.515 2.545 600 600 A 55 PHE HA A 56 PRO HDy 1.0 1.782 3.576 601 601 A 55 PHE HBx A 23 LEU HG 1.0 1.859 8.265 602 602 A 56 PRO HDx A 56 PRO HA 1.0 1.980 5.206 603 603 A 56 PRO HA A 56 PRO HBy 1.0 1.643 2.977 604 604 A 56 PRO HA A 56 PRO HGx 1.0 1.846 3.930 605 605 A 42 PHE H A 56 PRO HA 1.0 1.793 3.633 606 606 A 56 PRO HA A 56 PRO HDy 1.0 1.842 3.910 607 607 A 57 GLY H A 56 PRO HBy 1.0 1.847 3.937 608 608 A 56 PRO HBx A 58 ASN H 1.0 1.801 3.673 609 609 A 56 PRO HDy A 56 PRO HBy 1.0 1.884 4.194 610 610 A 56 PRO HGx A 56 PRO HBy 1.0 1.684 3.138 611 611 A 56 PRO HBx A 56 PRO HGx 1.0 1.643 2.977 612 612 A 56 PRO HBy A 56 PRO HGy 1.0 1.708 3.236 613 613 A 56 PRO HBx A 56 PRO HGy 1.0 1.709 3.243 614 614 A 56 PRO HBx A 56 PRO HBy 1.0 1.481 2.445 615 615 A 56 PRO HDx A 56 PRO HGy 1.0 1.693 3.173 616 616 A 56 PRO HDy A 56 PRO HGy 1.0 1.837 3.879 617 617 A 56 PRO HDx A 56 PRO HBx 1.0 1.753 3.439 618 618 A 56 PRO HBx A 56 PRO HDy 1.0 1.957 4.873 619 619 A 56 PRO HDx A 55 PHE HBy 1.0 1.867 4.071 620 620 A 56 PRO HDx A 55 PHE HBx 1.0 1.817 3.763 621 621 A 55 PHE HDx A 56 PRO HDy 1.0 1.998 5.766 622 622 A 56 PRO HGx A 56 PRO HGy 1.0 1.502 2.504 623 623 A 56 PRO HDx A 56 PRO HGx 1.0 1.711 3.247 624 624 A 56 PRO HA A 56 PRO HGy 1.0 1.731 3.337 625 625 A 55 PHE HA A 56 PRO HGy 1.0 1.938 4.654 626 626 A 55 PHE HA A 56 PRO HGx 1.0 1.915 4.435 627 627 A 57 GLY HAy A 9 TYR HEx 1.0 1.906 4.358 628 628 A 57 GLY HAy A 9 TYR HDx 1.0 1.906 4.354 629 629 A 57 GLY HAy A 60 VAL HGy% 1.0 1.798 3.660 630 630 A 56 PRO HA A 57 GLY HAy 1.0 1.916 4.446 631 631 A 58 ASN HBx A 58 ASN HBy 1.0 1.396 2.208 632 632 A 58 ASN HBx A 41 TRP HE3 1.0 1.714 3.262 633 633 A 59 TYR HBx A 59 TYR HEx 1.0 1.994 5.590 634 634 A 59 TYR HBx A 59 TYR HDx 1.0 1.798 3.658 635 635 A 59 TYR HBy A 59 TYR HDx 1.0 1.701 3.203 636 636 A 59 TYR HBy A 59 TYR HEx 1.0 1.966 4.990 637 637 A 60 VAL HGx% A 59 TYR HBy 1.0 1.971 5.073 638 638 A 60 VAL HA A 11 ALA HB% 1.0 1.940 4.674 639 639 A 60 VAL HA A 12 LEU HG 1.0 1.801 3.675 640 640 A 60 VAL HA A 9 TYR HBy 1.0 1.882 4.172 641 641 A 60 VAL HA A 9 TYR HDx 1.0 1.998 5.754 642 642 A 60 VAL HA A 61 LYS H 1.0 1.597 2.811 643 643 A 60 VAL HA A 12 LEU H 1.0 1.662 3.048 644 644 A 60 VAL HA A 10 GLN H 1.0 1.998 5.724 645 645 A 60 VAL HB A 9 TYR HBy 1.0 1.254 1.860 646 646 A 60 VAL HB A 10 GLN H 1.0 1.782 3.576 647 647 A 60 VAL HB A 9 TYR HBx 1.0 1.397 2.211 648 648 A 60 VAL HGy% A 9 TYR HDx 1.0 1.564 2.702 649 649 A 60 VAL HGy% A 61 LYS H 1.0 1.826 3.812 650 650 A 60 VAL HGy% A 10 GLN H 1.0 1.988 5.382 651 651 A 61 LYS HA A 61 LYS HGx 1.0 1.851 3.965 652 652 A 62 PRO HDy A 61 LYS HBy 1.0 1.879 4.153 653 653 A 61 LYS HBx A 62 PRO HDy 1.0 1.876 4.128 654 654 A 62 PRO HA A 63 LEU HA 1.0 1.915 4.437 655 655 A 62 PRO HA A 9 TYR HBx 1.0 1.978 6.856 656 656 A 62 PRO HBy A 62 PRO HGx 1.0 1.641 2.971 657 657 A 62 PRO HBy A 62 PRO HGy 1.0 1.621 2.899 658 658 A 62 PRO HDx A 62 PRO HGx 1.0 1.808 3.710 659 659 A 62 PRO HDy A 62 PRO HGx 1.0 1.424 2.284 660 660 A 62 PRO HGy A 62 PRO HDx 1.0 1.438 2.320 661 661 A 62 PRO HDy A 62 PRO HGy 1.0 1.566 2.708 662 662 A 63 LEU HA A 63 LEU HBx 1.0 1.540 2.622 663 663 A 6 LEU HBx A 5 ASP H 1.0 1.956 4.852 664 664 A 63 LEU HDx% A 8 SER HBy 1.0 1.763 3.483 665 665 A 64 TYR HBx A 64 TYR HDx 1.0 1.641 2.973 666 666 A 64 TYR HBy A 64 TYR HDx 1.0 1.851 3.967 667 667 A 64 TYR HBx A 64 TYR HEx 1.0 1.969 5.033 668 668 A 64 TYR HBy A 64 TYR HEx 1.0 2.000 5.952 669 669 A 12 LEU HA A 11 ALA HB% 1.0 1.981 6.787 670 670 A 61 LYS HGy A 10 GLN HBx 1.0 1.909 4.385 671 671 A 57 GLY H A 58 ASN H 1.0 1.856 4.000 672 672 A 11 ALA H A 12 LEU H 1.0 1.947 4.753 673 673 A 11 ALA H A 30 ILE H 1.0 1.952 4.810 674 674 A 11 ALA H A 29 ASP H 1.0 1.888 4.224 675 675 A 30 ILE HA A 11 ALA H 1.0 1.910 4.396 676 676 A 11 ALA HA A 11 ALA H 1.0 1.916 4.442 677 677 A 11 ALA H A 29 ASP HA 1.0 1.962 4.934 678 678 A 10 GLN HGx A 11 ALA H 1.0 1.815 3.753 679 679 A 11 ALA H A 10 GLN HBy 1.0 1.864 4.052 680 680 A 11 ALA H A 11 ALA HB% 1.0 1.730 3.328 681 681 A 33 VAL H A 33 VAL HB 1.0 1.845 3.927 682 682 A 33 VAL H A 32 ASP HBy 1.0 1.881 4.167 683 683 A 33 VAL H A 33 VAL HA 1.0 1.723 3.303 684 684 A 47 ARG HBy A 47 ARG H 1.0 1.786 3.600 685 685 A 31 VAL HA A 47 ARG H 1.0 1.852 3.974 686 686 A 46 SER HA A 47 ARG H 1.0 1.711 3.247 687 687 A 47 ARG HA A 47 ARG H 1.0 1.868 4.078 688 688 A 46 SER HBy A 47 ARG H 1.0 1.923 4.511 689 689 A 46 SER HBx A 47 ARG H 1.0 1.979 5.191 690 690 A 15 TYR HA A 16 ILE H 1.0 1.646 2.988 691 691 A 16 ILE HA A 16 ILE H 1.0 1.856 3.996 692 692 A 15 TYR HBx A 16 ILE H 1.0 1.892 4.250 693 693 A 15 TYR HBy A 16 ILE H 1.0 1.920 4.474 694 694 A 16 ILE HB A 16 ILE H 1.0 1.714 3.260 695 695 A 16 ILE HG1x A 16 ILE H 1.0 1.853 3.977 696 696 A 16 ILE HG1y A 16 ILE H 1.0 1.898 4.290 697 697 A 16 ILE HD1% A 16 ILE H 1.0 1.827 3.817 698 698 A 15 TYR HDx A 16 ILE H 1.0 1.873 4.115 699 699 A 15 TYR HEx A 16 ILE H 1.0 1.708 9.346 700 700 A 17 PRO HDy A 16 ILE H 1.0 1.913 4.417 701 701 A 5 ASP HA A 6 LEU H 1.0 1.691 3.165 702 702 A 6 LEU HA A 6 LEU H 1.0 1.831 3.845 703 703 A 5 ASP HBy A 6 LEU H 1.0 1.901 4.321 704 704 A 7 PHE H A 7 PHE HBy 1.0 1.867 4.069 705 705 A 6 LEU HA A 7 PHE H 1.0 1.782 3.576 706 706 A 7 PHE H A 7 PHE HDy 1.0 1.981 5.233 707 707 A 7 PHE H A 6 LEU H 1.0 1.722 3.298 708 708 A 7 PHE H A 7 PHE HBx 1.0 1.951 4.805 709 709 A 8 SER H A 8 SER HA 1.0 1.653 3.013 710 710 A 7 PHE HA A 8 SER H 1.0 1.651 3.007 711 711 A 8 SER H A 8 SER HBy 1.0 1.585 2.773 712 712 A 9 TYR H A 8 SER HBy 1.0 1.899 4.301 713 713 A 9 TYR HA A 9 TYR H 1.0 1.784 3.586 714 714 A 9 TYR HBy A 9 TYR H 1.0 1.949 4.771 715 715 A 9 TYR HBy A 10 GLN H 1.0 1.836 3.876 716 716 A 62 PRO HA A 10 GLN H 1.0 1.969 5.033 717 717 A 9 TYR HA A 10 GLN H 1.0 1.738 3.366 718 718 A 10 GLN HA A 10 GLN H 1.0 1.843 3.919 719 719 A 9 TYR H A 10 GLN H 1.0 1.997 6.303 720 720 A 10 GLN HGx A 10 GLN H 1.0 1.945 4.725 721 721 A 10 GLN HBx A 10 GLN H 1.0 1.911 4.407 722 722 A 11 ALA HA A 12 LEU H 1.0 1.733 3.345 723 723 A 13 TYR H A 13 TYR HBy 1.0 1.862 4.038 724 724 A 13 TYR H A 11 ALA HB% 1.0 1.900 4.308 725 725 A 12 LEU HG A 13 TYR H 1.0 1.933 4.609 726 726 A 13 TYR HA A 13 TYR H 1.0 1.768 3.510 727 727 A 13 TYR HDx A 13 TYR H 1.0 1.836 3.872 728 728 A 14 SER H A 13 TYR H 1.0 1.980 5.212 729 729 A 12 LEU H A 13 TYR H 1.0 1.734 3.350 730 730 A 59 TYR HA A 13 TYR H 1.0 1.911 4.407 731 731 A 12 LEU HA A 13 TYR H 1.0 1.954 4.832 732 732 A 27 ASP HA A 13 TYR H 1.0 2.000 6.056 733 733 A 12 LEU HBx A 13 TYR H 1.0 1.846 3.934 734 734 A 12 LEU HDy% A 13 TYR H 1.0 1.986 6.688 735 735 A 13 TYR HA A 14 SER H 1.0 1.646 2.988 736 736 A 14 SER HA A 14 SER H 1.0 1.887 4.211 737 737 A 27 ASP HA A 14 SER H 1.0 1.981 5.233 738 738 A 14 SER H A 13 TYR HBx 1.0 1.811 3.729 739 739 A 14 SER H A 13 TYR HBy 1.0 1.761 3.475 740 740 A 15 TYR H A 14 SER H 1.0 2.000 5.892 741 741 A 14 SER H A 13 TYR HDx 1.0 1.969 7.035 742 742 A 15 TYR H A 15 TYR HDx 1.0 1.979 5.191 743 743 A 15 TYR H A 16 ILE H 1.0 1.969 5.039 744 744 A 15 TYR H A 25 LEU H 1.0 1.853 3.973 745 745 A 14 SER HA A 15 TYR H 1.0 1.712 3.252 746 746 A 15 TYR H A 15 TYR HBx 1.0 1.950 4.792 747 747 A 15 TYR H A 15 TYR HBy 1.0 1.867 4.069 748 748 A 25 LEU HBx A 15 TYR H 1.0 1.846 3.930 749 749 A 25 LEU HG A 15 TYR H 1.0 1.985 6.723 750 750 A 25 LEU HBy A 15 TYR H 1.0 1.998 5.762 751 751 A 25 LEU HDx% A 15 TYR H 1.0 1.938 4.656 752 752 A 19 ASN H A 18 GLN HBx 1.0 1.748 3.412 753 753 A 18 GLN HGx A 19 ASN H 1.0 1.924 4.514 754 754 A 19 ASN H A 19 ASN HBy 1.0 1.899 4.301 755 755 A 19 ASN H A 19 ASN HBx 1.0 1.931 4.581 756 756 A 17 PRO HA A 19 ASN H 1.0 1.854 3.984 757 757 A 19 ASN H A 19 ASN HA 1.0 1.787 3.603 758 758 A 19 ASN H A 18 GLN H 1.0 1.719 3.279 759 759 A 19 ASN HA A 20 ASP H 1.0 1.571 2.725 760 760 A 20 ASP HA A 20 ASP H 1.0 1.847 3.939 761 761 A 22 GLU H A 20 ASP H 1.0 1.924 4.520 762 762 A 20 ASP HBy A 20 ASP H 1.0 1.997 6.309 763 763 A 19 ASN HBy A 20 ASP H 1.0 1.646 2.988 764 764 A 21 ASP HBx A 21 ASP H 1.0 1.777 3.553 765 765 A 21 ASP HBy A 21 ASP H 1.0 1.752 3.430 766 766 A 20 ASP HA A 21 ASP H 1.0 1.888 4.220 767 767 A 21 ASP HA A 21 ASP H 1.0 1.768 3.510 768 768 A 21 ASP HA A 22 GLU H 1.0 1.870 4.088 769 769 A 20 ASP HA A 22 GLU H 1.0 1.879 4.155 770 770 A 22 GLU HA A 22 GLU H 1.0 1.867 4.071 771 771 A 22 GLU H A 21 ASP H 1.0 1.735 3.355 772 772 A 21 ASP HBy A 22 GLU H 1.0 1.722 3.298 773 773 A 22 GLU HBx A 22 GLU H 1.0 1.833 3.853 774 774 A 22 GLU HBy A 22 GLU H 1.0 1.753 3.437 775 775 A 17 PRO HBy A 22 GLU H 1.0 1.821 3.789 776 776 A 21 ASP HBx A 22 GLU H 1.0 1.956 4.860 777 777 A 22 GLU HBx A 23 LEU H 1.0 1.852 3.972 778 778 A 23 LEU HBx A 23 LEU H 1.0 1.838 3.890 779 779 A 22 GLU HBy A 23 LEU H 1.0 1.784 3.584 780 780 A 54 THR HG2% A 23 LEU H 1.0 1.965 4.971 781 781 A 23 LEU HBy A 23 LEU H 1.0 1.835 3.867 782 782 A 23 LEU HG A 23 LEU H 1.0 1.995 5.601 783 783 A 22 GLU HA A 23 LEU H 1.0 1.774 3.540 784 784 A 23 LEU HA A 23 LEU H 1.0 1.923 4.501 785 785 A 53 GLY HAy A 23 LEU H 1.0 1.987 5.357 786 786 A 55 PHE HBx A 23 LEU H 1.0 1.988 5.382 787 787 A 25 LEU HBx A 25 LEU H 1.0 1.849 3.953 788 788 A 24 GLU HGx A 25 LEU H 1.0 1.774 3.538 789 789 A 24 GLU HA A 25 LEU H 1.0 1.683 3.131 790 790 A 17 PRO HDy A 25 LEU H 1.0 1.987 5.373 791 791 A 15 TYR HDx A 25 LEU H 1.0 1.999 5.787 792 792 A 27 ASP HA A 28 GLY H 1.0 1.560 2.686 793 793 A 10 GLN HGx A 28 GLY H 1.0 1.918 4.454 794 794 A 27 ASP HBy A 28 GLY H 1.0 1.943 4.713 795 795 A 28 GLY H A 11 ALA H 1.0 1.943 4.713 796 796 A 52 PHE HDy A 53 GLY H 1.0 1.924 4.514 797 797 A 30 ILE HA A 30 ILE H 1.0 1.888 4.218 798 798 A 29 ASP HA A 30 ILE H 1.0 1.661 3.045 799 799 A 31 VAL H A 30 ILE H 1.0 1.989 5.399 800 800 A 29 ASP HBy A 30 ILE H 1.0 1.962 4.940 801 801 A 30 ILE HB A 30 ILE H 1.0 1.746 3.400 802 802 A 11 ALA HB% A 30 ILE H 1.0 1.997 6.319 803 803 A 30 ILE HG1y A 30 ILE H 1.0 1.878 4.144 804 804 A 30 ILE HD1% A 30 ILE H 1.0 1.774 3.534 805 805 A 32 ASP H A 31 VAL HGy% 1.0 1.930 4.568 806 806 A 32 ASP H A 32 ASP HBy 1.0 1.743 3.389 807 807 A 32 ASP H A 47 ARG H 1.0 1.961 4.925 808 808 A 32 ASP H A 31 VAL H 1.0 1.953 4.819 809 809 A 32 ASP H A 45 THR H 1.0 1.907 4.375 810 810 A 39 ASP H A 38 ASP H 1.0 1.954 4.828 811 811 A 39 ASP H A 39 ASP HA 1.0 1.824 3.802 812 812 A 37 CYS HBx A 39 ASP H 1.0 1.918 4.466 813 813 A 42 PHE HBx A 43 VAL H 1.0 1.617 2.883 814 814 A 43 VAL HB A 43 VAL H 1.0 1.773 3.531 815 815 A 36 LYS HA A 43 VAL H 1.0 1.985 5.325 816 816 A 43 VAL HA A 43 VAL H 1.0 1.969 5.039 817 817 A 42 PHE HA A 43 VAL H 1.0 1.775 3.539 818 818 A 42 PHE HDx A 43 VAL H 1.0 1.847 3.939 819 819 A 44 GLY H A 43 VAL H 1.0 1.945 4.737 820 820 A 50 LYS HDy A 51 GLN H 1.0 1.979 5.191 821 821 A 50 LYS HGx A 51 GLN H 1.0 1.708 9.346 822 822 A 50 LYS HGy A 51 GLN H 1.0 1.997 6.287 823 823 A 51 GLN HBx A 51 GLN H 1.0 1.828 3.826 824 824 A 51 GLN HBy A 51 GLN H 1.0 1.825 3.809 825 825 A 50 LYS HA A 51 GLN H 1.0 1.890 4.232 826 826 A 52 PHE HBy A 53 GLY H 1.0 1.894 4.262 827 827 A 63 LEU H A 63 LEU HG 1.0 1.945 4.725 828 828 A 63 LEU H A 63 LEU HA 1.0 1.863 4.041 829 829 A 2 THR H A 1 GLN HA 1.0 1.883 4.185 830 830 A 3 SER H A 2 THR HA 1.0 1.874 4.122 831 831 A 3 SER HBy A 3 SER H 1.0 1.922 4.498 832 832 A 3 SER HA A 4 GLN H 1.0 1.737 3.361 833 833 A 3 SER HBy A 4 GLN H 1.0 1.989 5.417 834 834 A 4 GLN HGy A 4 GLN H 1.0 1.947 4.749 835 835 A 4 GLN HBx A 4 GLN H 1.0 1.958 4.884 836 836 A 4 GLN HBy A 4 GLN H 1.0 1.887 4.207 837 837 A 5 ASP HBy A 5 ASP H 1.0 1.784 3.588 838 838 A 4 GLN HGy A 5 ASP H 1.0 1.245 1.841 839 839 A 4 GLN HBx A 5 ASP H 1.0 1.916 4.442 840 840 A 4 GLN HBy A 5 ASP H 1.0 1.311 1.993 841 841 A 4 GLN HA A 5 ASP H 1.0 1.834 3.858 842 842 A 5 ASP HA A 5 ASP H 1.0 1.821 3.781 843 843 A 6 LEU H A 5 ASP H 1.0 1.892 4.256 844 844 A 6 LEU H A 6 LEU HG 1.0 1.972 5.080 845 845 A 6 LEU H A 6 LEU HDx% 1.0 1.997 6.295 846 846 A 6 LEU H A 6 LEU HDy% 1.0 1.984 6.726 847 847 A 6 LEU HBx A 7 PHE H 1.0 1.925 4.523 848 848 A 7 PHE H A 6 LEU HDy% 1.0 1.995 5.601 849 849 A 7 PHE H A 6 LEU HDx% 1.0 2.000 5.856 850 850 A 9 TYR H A 30 ILE HG2% 1.0 1.909 4.391 851 851 A 9 TYR H A 9 TYR HBx 1.0 1.647 2.993 852 852 A 9 TYR H A 8 SER HBx 1.0 1.883 4.181 853 853 A 9 TYR HDx A 9 TYR H 1.0 1.968 5.010 854 854 A 31 VAL HGx% A 9 TYR H 1.0 1.998 5.762 855 855 A 10 GLN HBy A 10 GLN H 1.0 1.766 3.496 856 856 A 61 LYS HGy A 10 GLN H 1.0 1.815 3.749 857 857 A 63 LEU HDx% A 10 GLN H 1.0 1.976 5.150 858 858 A 60 VAL HGx% A 10 GLN H 1.0 1.982 5.248 859 859 A 11 ALA H A 29 ASP HBy 1.0 1.997 5.713 860 860 A 11 ALA H A 29 ASP HBx 1.0 1.962 7.142 861 861 A 60 VAL HGx% A 11 ALA H 1.0 1.838 3.884 862 862 A 11 ALA HB% A 29 ASP H 1.0 1.764 3.488 863 863 A 10 GLN HGx A 29 ASP H 1.0 1.983 5.293 864 864 A 56 PRO HBx A 59 TYR H 1.0 2.000 6.006 865 865 A 61 LYS HGx A 61 LYS H 1.0 1.772 3.524 866 866 A 12 LEU H A 12 LEU HG 1.0 1.853 3.977 867 867 A 12 LEU H A 12 LEU HBy 1.0 1.957 4.865 868 868 A 12 LEU H A 12 LEU HBx 1.0 1.636 2.952 869 869 A 12 LEU H A 12 LEU HDy% 1.0 1.951 4.801 870 870 A 12 LEU HDx% A 12 LEU H 1.0 1.900 7.890 871 871 A 37 CYS HA A 38 ASP H 1.0 1.648 2.996 872 872 A 37 CYS HBy A 38 ASP H 1.0 1.814 3.746 873 873 A 38 ASP HBy A 38 ASP H 1.0 1.828 3.826 874 874 A 18 GLN HA A 18 GLN H 1.0 1.615 2.875 875 875 A 17 PRO HA A 18 GLN H 1.0 1.723 3.303 876 876 A 15 TYR HEx A 18 GLN H 1.0 1.982 5.256 877 877 A 19 ASN HBy A 18 GLN H 1.0 1.997 6.341 878 878 A 18 GLN HGx A 18 GLN H 1.0 1.933 4.601 879 879 A 18 GLN HGy A 18 GLN H 1.0 1.864 4.050 880 880 A 18 GLN HBx A 18 GLN H 1.0 1.878 4.148 881 881 A 18 GLN HBy A 18 GLN H 1.0 1.803 3.685 882 882 A 17 PRO HGy A 19 ASN H 1.0 1.991 6.529 883 883 A 19 ASN H A 18 GLN HBy 1.0 1.940 4.674 884 884 A 19 ASN HBx A 20 ASP H 1.0 1.865 8.209 885 885 A 52 PHE HDy A 45 THR H 1.0 1.931 4.581 886 886 A 54 THR HA A 54 THR H 1.0 1.987 5.357 887 887 A 54 THR HG1 A 54 THR H 1.0 1.894 4.262 888 888 A 44 GLY HAy A 45 THR H 1.0 1.723 3.303 889 889 A 45 THR HB A 45 THR H 1.0 1.529 2.587 890 890 A 45 THR HA A 45 THR H 1.0 1.752 3.430 891 891 A 54 THR H A 23 LEU H 1.0 1.852 3.976 892 892 A 44 GLY H A 45 THR H 1.0 1.979 5.191 893 893 A 54 THR HG2% A 54 THR H 1.0 1.735 3.355 894 894 A 34 MET HGy A 45 THR H 1.0 1.531 10.345 895 895 A 33 VAL H A 45 THR H 1.0 1.963 4.945 896 896 A 31 VAL H A 11 ALA H 1.0 1.962 4.934 897 897 A 30 ILE HA A 31 VAL H 1.0 1.678 3.110 898 898 A 31 VAL HA A 31 VAL H 1.0 1.940 4.682 899 899 A 31 VAL H A 9 TYR HBx 1.0 1.932 4.598 900 900 A 30 ILE HB A 31 VAL H 1.0 1.873 4.107 901 901 A 31 VAL H A 30 ILE HG2% 1.0 1.663 3.051 902 902 A 30 ILE HG1y A 31 VAL H 1.0 1.832 3.852 903 903 A 32 ASP H A 31 VAL HGx% 1.0 1.847 3.939 904 904 A 31 VAL H A 31 VAL HGy% 1.0 1.894 4.264 905 905 A 55 PHE HA A 23 LEU H 1.0 1.988 5.382 906 906 A 22 GLU H A 23 LEU H 1.0 1.929 4.565 907 907 A 24 GLU H A 23 LEU H 1.0 1.994 5.558 908 908 A 55 PHE HDx A 55 PHE H 1.0 1.986 5.348 909 909 A 42 PHE H A 55 PHE H 1.0 1.926 4.536 910 910 A 42 PHE H A 42 PHE HDx 1.0 1.883 4.185 911 911 A 45 THR HG1 A 46 SER H 1.0 1.878 4.146 912 912 A 45 THR HA A 46 SER H 1.0 1.708 3.234 913 913 A 42 PHE H A 42 PHE HA 1.0 1.694 3.176 914 914 A 42 PHE H A 41 TRP HBx 1.0 1.787 3.599 915 915 A 42 PHE HBx A 42 PHE H 1.0 1.788 3.608 916 916 A 42 PHE HBy A 42 PHE H 1.0 1.615 2.877 917 917 A 42 PHE H A 41 TRP HBy 1.0 1.847 3.941 918 918 A 40 GLY H A 37 CYS H 1.0 2.000 5.956 919 919 A 40 GLY H A 42 PHE HDx 1.0 1.916 4.448 920 920 A 40 GLY H A 39 ASP HA 1.0 1.983 5.277 921 921 A 40 GLY H A 38 ASP HA 1.0 1.904 4.342 922 922 A 40 GLY H A 40 GLY HAy 1.0 1.735 3.355 923 923 A 40 GLY H A 39 ASP HBx 1.0 1.950 4.792 924 924 A 46 SER HA A 46 SER H 1.0 1.921 4.495 925 925 A 23 LEU HDy% A 52 PHE H 1.0 1.933 4.605 926 926 A 45 THR HG2% A 52 PHE H 1.0 1.940 4.670 927 927 A 23 LEU HDy% A 24 GLU H 1.0 1.817 3.763 928 928 A 24 GLU HGx A 24 GLU H 1.0 1.938 4.652 929 929 A 17 PRO HGx A 24 GLU H 1.0 1.983 5.293 930 930 A 24 GLU HBx A 24 GLU H 1.0 1.772 3.524 931 931 A 23 LEU HBx A 24 GLU H 1.0 1.999 5.809 932 932 A 23 LEU HDx% A 24 GLU H 1.0 1.956 4.860 933 933 A 24 GLU HGy A 24 GLU H 1.0 1.836 3.874 934 934 A 42 PHE H A 41 TRP H 1.0 1.993 5.519 935 935 A 41 TRP HD1 A 41 TRP H 1.0 1.834 3.864 936 936 A 24 GLU HA A 24 GLU H 1.0 1.862 4.036 937 937 A 23 LEU HA A 24 GLU H 1.0 1.633 2.939 938 938 A 41 TRP HBy A 41 TRP H 1.0 1.829 3.831 939 939 A 41 TRP HBx A 41 TRP H 1.0 1.796 3.646 940 940 A 37 CYS HBx A 41 TRP H 1.0 1.811 3.731 941 941 A 40 GLY HAy A 41 TRP H 1.0 1.762 3.482 942 942 A 25 LEU HBy A 25 LEU H 1.0 1.908 4.372 943 943 A 25 LEU HDy% A 25 LEU H 1.0 1.946 7.374 944 944 A 25 LEU HDx% A 25 LEU H 1.0 1.862 4.038 945 945 A 17 PRO HDx A 25 LEU H 1.0 1.970 5.056 946 946 A 15 TYR HBx A 25 LEU H 1.0 1.945 4.733 947 947 A 25 LEU HG A 25 LEU H 1.0 1.891 4.241 948 948 A 25 LEU HDy% A 26 ARG H 1.0 1.887 4.215 949 949 A 25 LEU HBy A 26 ARG H 1.0 1.892 4.254 950 950 A 25 LEU HG A 26 ARG H 1.0 1.994 5.558 951 951 A 26 ARG HBx A 26 ARG H 1.0 1.854 3.984 952 952 A 26 ARG HBy A 26 ARG H 1.0 1.871 4.099 953 953 A 26 ARG HA A 26 ARG H 1.0 1.828 3.826 954 954 A 25 LEU HA A 26 ARG H 1.0 1.670 3.080 955 955 A 29 ASP H A 26 ARG H 1.0 1.979 5.191 956 956 A 15 TYR H A 26 ARG H 1.0 1.896 4.276 957 957 A 14 SER HA A 26 ARG H 1.0 1.962 4.940 958 958 A 28 GLY H A 27 ASP H 1.0 1.930 4.578 959 959 A 27 ASP H A 26 ARG H 1.0 1.963 4.945 960 960 A 26 ARG HA A 27 ASP H 1.0 1.457 2.375 961 961 A 27 ASP H A 14 SER HBx 1.0 1.937 4.637 962 962 A 27 ASP HA A 27 ASP H 1.0 1.800 3.670 963 963 A 26 ARG HDx A 27 ASP H 1.0 1.998 6.206 964 964 A 27 ASP HBy A 27 ASP H 1.0 1.783 3.583 965 965 A 27 ASP HBx A 27 ASP H 1.0 1.813 3.745 966 966 A 27 ASP H A 11 ALA HB% 1.0 1.999 5.847 967 967 A 26 ARG HBx A 27 ASP H 1.0 1.867 4.073 968 968 A 26 ARG HBy A 27 ASP H 1.0 1.817 3.763 969 969 A 27 ASP H A 15 TYR H 1.0 1.992 5.500 970 970 A 28 GLY H A 11 ALA HA 1.0 1.990 5.434 971 971 A 45 THR HA A 53 GLY H 1.0 1.918 4.462 972 972 A 44 GLY HAy A 53 GLY H 1.0 1.988 5.390 973 973 A 46 SER HBy A 53 GLY H 1.0 1.687 9.477 974 974 A 23 LEU HG A 53 GLY H 1.0 1.917 4.451 975 975 A 23 LEU HDy% A 53 GLY H 1.0 1.989 5.425 976 976 A 29 ASP HBx A 29 ASP H 1.0 1.762 3.482 977 977 A 29 ASP HBy A 29 ASP H 1.0 1.829 3.829 978 978 A 28 GLY HAy A 29 ASP H 1.0 1.848 3.950 979 979 A 29 ASP HA A 29 ASP H 1.0 1.764 3.488 980 980 A 30 ILE HG1x A 30 ILE H 1.0 1.893 4.259 981 981 A 30 ILE HG2% A 30 ILE H 1.0 2.000 5.952 982 982 A 31 VAL HGy% A 30 ILE H 1.0 1.993 6.499 983 983 A 30 ILE H A 47 ARG H 1.0 1.856 4.000 984 984 A 47 ARG HA A 30 ILE H 1.0 1.997 5.701 985 985 A 32 ASP H A 30 ILE HG2% 1.0 1.988 5.408 986 986 A 32 ASP H A 45 THR HG2% 1.0 1.970 7.016 987 987 A 31 VAL HA A 32 ASP H 1.0 1.684 3.134 988 988 A 32 ASP H A 45 THR HB 1.0 1.918 4.460 989 989 A 32 ASP H A 44 GLY HAy 1.0 2.000 5.962 990 990 A 32 ASP H A 32 ASP HA 1.0 1.888 4.224 991 991 A 29 ASP HBx A 30 ILE H 1.0 1.956 7.224 992 992 A 32 ASP H A 33 VAL H 1.0 1.961 4.909 993 993 A 33 VAL H A 7 PHE HBx 1.0 1.992 6.492 994 994 A 33 VAL H A 33 VAL HGx% 1.0 1.837 3.879 995 995 A 33 VAL H A 33 VAL HGy% 1.0 1.926 4.538 996 996 A 34 MET HA A 34 MET H 1.0 1.680 3.120 997 997 A 44 GLY HAy A 34 MET H 1.0 1.788 3.608 998 998 A 33 VAL HA A 34 MET H 1.0 1.721 3.293 999 999 A 34 MET HGy A 34 MET H 1.0 1.840 3.898 1000 1000 A 34 MET HBy A 34 MET H 1.0 1.700 3.204 1001 1001 A 33 VAL HGy% A 34 MET H 1.0 1.658 3.036 1002 1002 A 33 VAL HGx% A 34 MET H 1.0 1.993 5.509 1003 1003 A 33 VAL HGy% A 35 GLU H 1.0 1.782 3.576 1004 1004 A 35 GLU H A 43 VAL HGx% 1.0 1.932 4.598 1005 1005 A 35 GLU HBy A 35 GLU H 1.0 1.726 3.314 1006 1006 A 34 MET HBy A 35 GLU H 1.0 1.894 4.264 1007 1007 A 35 GLU H A 33 VAL HA 1.0 1.869 4.081 1008 1008 A 35 GLU HA A 35 GLU H 1.0 1.657 3.031 1009 1009 A 34 MET HA A 35 GLU H 1.0 1.868 4.074 1010 1010 A 35 GLU H A 34 MET H 1.0 1.778 3.556 1011 1011 A 35 GLU H A 43 VAL H 1.0 1.720 3.288 1012 1012 A 34 MET HE% A 35 GLU H 1.0 1.862 8.236 1013 1013 A 36 LYS HGy A 36 LYS H 1.0 1.921 4.489 1014 1014 A 33 VAL HGy% A 36 LYS H 1.0 1.993 5.509 1015 1015 A 36 LYS HGx A 36 LYS H 1.0 1.897 4.283 1016 1016 A 36 LYS HDy A 36 LYS H 1.0 1.999 5.787 1017 1017 A 36 LYS HBy A 36 LYS H 1.0 1.825 3.805 1018 1018 A 35 GLU HGy A 36 LYS H 1.0 1.826 3.814 1019 1019 A 35 GLU HA A 36 LYS H 1.0 1.633 2.941 1020 1020 A 35 GLU H A 36 LYS H 1.0 1.993 5.529 1021 1021 A 36 LYS HA A 37 CYS H 1.0 1.755 3.449 1022 1022 A 37 CYS HA A 37 CYS H 1.0 1.748 3.412 1023 1023 A 42 PHE HA A 37 CYS H 1.0 1.894 4.260 1024 1024 A 42 PHE HDx A 37 CYS H 1.0 1.847 3.939 1025 1025 A 37 CYS HBy A 37 CYS H 1.0 1.915 4.431 1026 1026 A 37 CYS HBx A 37 CYS H 1.0 1.859 4.015 1027 1027 A 41 TRP HBy A 37 CYS H 1.0 1.938 7.476 1028 1028 A 35 GLU HGy A 37 CYS H 1.0 1.932 4.592 1029 1029 A 36 LYS HBy A 37 CYS H 1.0 1.896 4.274 1030 1030 A 36 LYS HGx A 37 CYS H 1.0 1.979 5.205 1031 1031 A 36 LYS HGy A 37 CYS H 1.0 1.995 6.411 1032 1032 A 42 PHE H A 56 PRO HBy 1.0 1.002 12.650 1033 1033 A 39 ASP H A 39 ASP HBx 1.0 1.892 4.250 1034 1034 A 37 CYS HBy A 39 ASP H 1.0 1.926 4.536 1035 1035 A 39 ASP H A 38 ASP HBy 1.0 1.915 4.437 1036 1036 A 33 VAL HGy% A 43 VAL H 1.0 1.510 2.532 1037 1037 A 43 VAL HGy% A 43 VAL H 1.0 1.890 4.228 1038 1038 A 44 GLY H A 53 GLY H 1.0 1.849 3.947 1039 1039 A 52 PHE HDy A 44 GLY H 1.0 1.985 5.333 1040 1040 A 44 GLY H A 45 THR HG1 1.0 1.999 6.145 1041 1041 A 43 VAL HA A 44 GLY H 1.0 1.680 3.120 1042 1042 A 44 GLY H A 44 GLY HAy 1.0 1.852 3.970 1043 1043 A 43 VAL HB A 44 GLY H 1.0 1.960 4.914 1044 1044 A 44 GLY H A 43 VAL HGx% 1.0 1.758 3.462 1045 1045 A 33 VAL HGy% A 44 GLY H 1.0 1.951 4.805 1046 1046 A 55 PHE HBy A 54 THR H 1.0 1.998 5.774 1047 1047 A 31 VAL HGx% A 45 THR H 1.0 1.452 2.358 1048 1048 A 43 VAL HGx% A 54 THR H 1.0 0.000 44.393 1049 1049 A 51 GLN H A 46 SER H 1.0 1.592 2.796 1050 1050 A 46 SER H A 50 LYS H 1.0 1.858 4.012 1051 1051 A 46 SER HBx A 46 SER H 1.0 1.794 3.640 1052 1052 A 46 SER HBy A 46 SER H 1.0 1.878 4.148 1053 1053 A 45 THR HG2% A 46 SER H 1.0 1.811 3.729 1054 1054 A 23 LEU HG A 46 SER H 1.0 1.739 3.371 1055 1055 A 23 LEU HDy% A 46 SER H 1.0 1.524 2.574 1056 1056 A 30 ILE HG2% A 47 ARG H 1.0 1.976 5.144 1057 1057 A 31 VAL HGy% A 47 ARG H 1.0 1.863 4.039 1058 1058 A 47 ARG HGy A 47 ARG H 1.0 1.923 4.507 1059 1059 A 48 ARG HA A 48 ARG H 1.0 1.794 3.638 1060 1060 A 46 SER HBy A 48 ARG H 1.0 1.941 4.685 1061 1061 A 46 SER HA A 48 ARG H 1.0 1.938 4.656 1062 1062 A 48 ARG HDy A 48 ARG H 1.0 1.987 5.373 1063 1063 A 49 THR HG2% A 48 ARG H 1.0 1.939 4.667 1064 1064 A 48 ARG HGx A 48 ARG H 1.0 1.923 4.501 1065 1065 A 48 ARG HBy A 48 ARG H 1.0 1.785 3.593 1066 1066 A 48 ARG HBx A 48 ARG H 1.0 1.867 4.073 1067 1067 A 47 ARG HBy A 48 ARG H 1.0 1.844 3.920 1068 1068 A 48 ARG HGy A 48 ARG H 1.0 1.951 4.805 1069 1069 A 49 THR H A 48 ARG H 1.0 1.815 3.753 1070 1070 A 47 ARG H A 48 ARG H 1.0 1.813 3.741 1071 1071 A 49 THR HG2% A 49 THR H 1.0 1.764 3.488 1072 1072 A 50 LYS HGx A 49 THR H 1.0 1.947 4.749 1073 1073 A 46 SER HBy A 49 THR H 1.0 1.960 4.904 1074 1074 A 46 SER HBx A 49 THR H 1.0 1.878 4.142 1075 1075 A 48 ARG HA A 49 THR H 1.0 1.847 3.937 1076 1076 A 49 THR HA A 49 THR H 1.0 1.948 4.762 1077 1077 A 49 THR HB A 49 THR H 1.0 1.925 4.529 1078 1078 A 49 THR HG1 A 49 THR H 1.0 1.911 4.407 1079 1079 A 50 LYS H A 49 THR H 1.0 1.750 3.418 1080 1080 A 49 THR H A 47 ARG H 1.0 1.964 4.966 1081 1081 A 50 LYS H A 48 ARG H 1.0 1.950 4.792 1082 1082 A 50 LYS H A 47 ARG H 1.0 1.993 6.473 1083 1083 A 49 THR HG1 A 50 LYS H 1.0 1.995 5.579 1084 1084 A 46 SER HBy A 50 LYS H 1.0 1.934 4.612 1085 1085 A 50 LYS HA A 50 LYS H 1.0 1.640 2.964 1086 1086 A 49 THR HA A 50 LYS H 1.0 1.816 3.758 1087 1087 A 49 THR HB A 50 LYS H 1.0 1.350 11.210 1088 1088 A 50 LYS HBy A 50 LYS H 1.0 1.920 4.480 1089 1089 A 50 LYS HBx A 50 LYS H 1.0 1.913 4.417 1090 1090 A 51 GLN HGy A 50 LYS H 1.0 1.999 6.169 1091 1091 A 51 GLN HBy A 50 LYS H 1.0 1.941 7.439 1092 1092 A 50 LYS HDy A 50 LYS H 1.0 1.840 3.894 1093 1093 A 50 LYS HGy A 50 LYS H 1.0 1.975 5.137 1094 1094 A 45 THR HG2% A 50 LYS H 1.0 1.819 3.777 1095 1095 A 50 LYS HGx A 50 LYS H 1.0 1.868 8.182 1096 1096 A 51 GLN HGy A 51 GLN H 1.0 1.937 4.637 1097 1097 A 51 GLN HGx A 51 GLN H 1.0 1.844 3.918 1098 1098 A 51 GLN HA A 51 GLN H 1.0 1.733 3.345 1099 1099 A 49 THR HG1 A 51 GLN H 1.0 1.858 4.012 1100 1100 A 51 GLN H A 50 LYS H 1.0 1.794 3.640 1101 1101 A 23 LEU HDy% A 51 GLN H 1.0 1.858 4.010 1102 1102 A 51 GLN HBy A 52 PHE H 1.0 1.903 4.333 1103 1103 A 51 GLN HBx A 52 PHE H 1.0 1.799 3.665 1104 1104 A 51 GLN HGx A 52 PHE H 1.0 1.997 5.713 1105 1105 A 51 GLN HGy A 52 PHE H 1.0 1.940 4.678 1106 1106 A 52 PHE HBx A 52 PHE H 1.0 1.817 3.763 1107 1107 A 52 PHE HBy A 52 PHE H 1.0 1.768 3.510 1108 1108 A 51 GLN HA A 52 PHE H 1.0 1.662 3.048 1109 1109 A 52 PHE HA A 52 PHE H 1.0 1.890 4.230 1110 1110 A 52 PHE HDy A 52 PHE H 1.0 1.977 5.171 1111 1111 A 51 GLN H A 52 PHE H 1.0 1.924 4.514 1112 1112 A 53 GLY HAy A 53 GLY H 1.0 1.746 3.400 1113 1113 A 55 PHE HA A 55 PHE H 1.0 1.843 3.915 1114 1114 A 54 THR HB A 55 PHE H 1.0 1.933 4.605 1115 1115 A 55 PHE HBx A 55 PHE H 1.0 1.991 5.471 1116 1116 A 55 PHE HBy A 55 PHE H 1.0 1.989 6.607 1117 1117 A 42 PHE HBy A 55 PHE H 1.0 1.969 5.033 1118 1118 A 56 PRO HDx A 55 PHE H 1.0 1.999 6.151 1119 1119 A 54 THR HG2% A 55 PHE H 1.0 1.900 4.316 1120 1120 A 57 GLY H A 42 PHE H 1.0 1.989 5.417 1121 1121 A 58 ASN HA A 58 ASN H 1.0 1.767 3.503 1122 1122 A 58 ASN HBy A 58 ASN H 1.0 1.702 3.212 1123 1123 A 58 ASN H A 59 TYR H 1.0 1.831 3.845 1124 1124 A 60 VAL H A 59 TYR H 1.0 1.775 3.541 1125 1125 A 59 TYR HDx A 59 TYR H 1.0 1.804 3.690 1126 1126 A 59 TYR HEx A 59 TYR H 1.0 1.972 5.080 1127 1127 A 59 TYR HA A 59 TYR H 1.0 1.655 3.021 1128 1128 A 58 ASN HA A 59 TYR H 1.0 0.904 13.016 1129 1129 A 59 TYR HBx A 59 TYR H 1.0 1.827 3.817 1130 1130 A 59 TYR HBy A 59 TYR H 1.0 1.782 3.580 1131 1131 A 60 VAL HGy% A 59 TYR H 1.0 1.962 4.940 1132 1132 A 60 VAL HGx% A 59 TYR H 1.0 1.997 5.701 1133 1133 A 25 LEU HDx% A 59 TYR H 1.0 1.903 7.861 1134 1134 A 60 VAL HA A 60 VAL H 1.0 1.899 4.301 1135 1135 A 59 TYR HA A 60 VAL H 1.0 1.793 3.633 1136 1136 A 59 TYR HBy A 60 VAL H 1.0 1.885 4.199 1137 1137 A 59 TYR HBx A 60 VAL H 1.0 1.998 5.750 1138 1138 A 60 VAL HB A 60 VAL H 1.0 1.926 4.538 1139 1139 A 60 VAL HGy% A 60 VAL H 1.0 1.704 3.216 1140 1140 A 60 VAL HGx% A 60 VAL H 1.0 1.908 4.380 1141 1141 A 12 LEU H A 60 VAL H 1.0 2.000 5.878 1142 1142 A 61 LYS HBy A 61 LYS H 1.0 1.795 3.647 1143 1143 A 60 VAL HB A 61 LYS H 1.0 1.812 3.738 1144 1144 A 9 TYR HBy A 61 LYS H 1.0 1.891 4.245 1145 1145 A 11 ALA HA A 61 LYS H 1.0 1.887 4.207 1146 1146 A 9 TYR HA A 61 LYS H 1.0 1.903 4.333 1147 1147 A 61 LYS HA A 61 LYS H 1.0 1.854 3.984 1148 1148 A 9 TYR HDx A 61 LYS H 1.0 1.988 5.382 1149 1149 A 12 LEU H A 61 LYS H 1.0 1.905 4.353 1150 1150 A 61 LYS H A 10 GLN H 1.0 1.873 4.107 1151 1151 A 60 VAL HGx% A 61 LYS H 1.0 1.869 4.085 1152 1152 A 63 LEU H A 63 LEU HBx 1.0 1.817 3.761 1153 1153 A 64 TYR H A 64 TYR HDx 1.0 1.708 3.234 1154 1154 A 9 TYR HA A 64 TYR H 1.0 1.878 8.098 1155 1155 A 64 TYR H A 64 TYR HA 1.0 1.842 3.910 1156 1156 A 64 TYR H A 64 TYR HBy 1.0 1.903 4.333 1157 1157 A 64 TYR H A 64 TYR HBx 1.0 1.806 3.700 1158 1158 A 64 TYR H A 63 LEU HBx 1.0 1.834 3.862 1159 1159 A 63 LEU HBy A 64 TYR H 1.0 1.947 4.749 1160 1160 A 64 TYR H A 63 LEU HDx% 1.0 1.924 4.520 1161 1161 A 63 LEU HG A 64 TYR H 1.0 1.976 6.902 1162 1162 A 64 TYR HA A 65 LEU H 1.0 1.753 3.437 1163 1163 A 65 LEU HA A 65 LEU H 1.0 1.854 3.984 1164 1164 A 64 TYR HBx A 65 LEU H 1.0 1.788 3.606 1165 1165 A 65 LEU HBx A 65 LEU H 1.0 1.784 3.586 1166 1166 A 19 ASN H A 19 ASN HD2x 1.0 1.999 5.787 1167 1167 A 16 ILE HD1% A 15 TYR H 1.0 1.965 7.089 1168 1168 A 24 GLU HGy A 25 LEU H 1.0 1.978 5.184 stop_ save_