data_nef_c17105_2l1t save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 MET middle . . 3 A 3 SER middle . . 4 A 4 ALA middle . . 5 A 5 ASP middle . . 6 A 6 GLY middle . false 7 A 7 SER middle . . 8 A 8 GLU middle . . 9 A 9 TYR middle . . 10 A 10 GLY middle . false 11 A 11 ARG middle . . 12 A 12 TYR middle . . 13 A 13 PHE middle . . 14 A 14 GLU middle . . 15 A 15 GLN middle . . 16 A 16 LEU middle . . 17 A 17 GLN middle . . 18 A 18 LYS middle . . 19 A 19 VAL middle . . 20 A 20 ASN middle . . 21 A 21 LEU middle . . 22 A 22 THR middle . . 23 A 23 VAL middle . . 24 A 24 ARG middle . . 25 A 25 LEU middle . . 26 A 26 GLY middle . false 27 A 27 ASP middle . . 28 A 28 THR middle . . 29 A 29 GLY middle . false 30 A 30 SER middle . . 31 A 31 PHE middle . . 32 A 32 ASP middle . . 33 A 33 GLY middle . false 34 A 34 THR middle . . 35 A 35 ALA middle . . 36 A 36 ALA middle . . 37 A 37 ILE middle . . 38 A 38 THR middle . . 39 A 39 SER middle . . 40 A 40 LEU middle . . 41 A 41 LYS middle . . 42 A 42 GLY middle . false 43 A 43 SER middle . . 44 A 44 LEU middle . . 45 A 45 ALA middle . . 46 A 46 TRP middle . . 47 A 47 LEU middle . . 48 A 48 GLU middle . . 49 A 49 LEU middle . . 50 A 50 PHE middle . . 51 A 51 GLY middle . false 52 A 52 ALA middle . . 53 A 53 GLU middle . . 54 A 54 GLN middle . . 55 A 55 PRO middle . false 56 A 56 PRO middle . false 57 A 57 PRO middle . false 58 A 58 ASN middle . . 59 A 59 THR middle . . 60 A 60 LEU middle . . 61 A 61 SER middle . . 62 A 62 GLU middle . . 63 A 63 GLY middle . false 64 A 64 ALA middle . . 65 A 65 GLU middle . . 66 A 66 VAL middle . . 67 A 67 SER middle . . 68 A 68 VAL middle . . 69 A 69 SER middle . . 70 A 70 VAL middle . . 71 A 71 TRP middle . . 72 A 72 THR middle . . 73 A 73 GLY middle . false 74 A 74 GLY middle . false 75 A 75 ALA middle . . 76 A 76 LEU middle . . 77 A 77 CYS middle . . 78 A 78 ARG middle . . 79 A 79 CYS middle . . 80 A 80 ASP middle . . 81 A 81 GLY middle . false 82 A 82 ARG middle . . 83 A 83 VAL middle . . 84 A 84 GLU middle . . 85 A 85 THR middle . . 86 A 86 LEU middle . . 87 A 87 ARG middle . . 88 A 88 ASP middle . . 89 A 89 ASP middle . . 90 A 90 ARG middle . . 91 A 91 GLN middle . . 92 A 92 PHE middle . . 93 A 93 ALA middle . . 94 A 94 ILE middle . . 95 A 95 ARG middle . . 96 A 96 LEU middle . . 97 A 97 VAL middle . . 98 A 98 GLY middle . false 99 A 99 ARG middle . . 100 A 100 VAL middle . . 101 A 101 ARG middle . . 102 A 102 GLU middle . . 103 A 103 LEU middle . . 104 A 104 GLN middle . . 105 A 105 ARG middle . . 106 A 106 ARG middle . . 107 A 107 GLU middle . . 108 A 108 TYR middle . . 109 A 109 PHE 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 2 MET HGy H 1 2.519 0.003 A 2 MET HGx H 1 2.486 0.003 A 2 MET CE C 13 16.895 0.16 A 2 MET CG C 13 31.863 0.16 A 3 SER HA H 1 4.380 0.003 A 3 SER HBx H 1 3.809 0.003 A 3 SER HBy H 1 3.809 0.003 A 3 SER CA C 13 58.339 0.16 A 3 SER CB C 13 63.934 0.16 A 4 ALA H H 1 8.473 0.003 A 4 ALA HA H 1 4.296 0.003 A 4 ALA HB% H 1 1.319 0.003 A 4 ALA CA C 13 52.645 0.16 A 4 ALA CB C 13 19.067 0.16 A 4 ALA N N 15 126.381 0.13 A 5 ASP H H 1 8.222 0.003 A 5 ASP HA H 1 4.510 0.003 A 5 ASP HBy H 1 2.688 0.003 A 5 ASP HBx H 1 2.610 0.003 A 5 ASP CA C 13 54.378 0.16 A 5 ASP CB C 13 41.305 0.16 A 5 ASP N N 15 119.180 0.13 A 6 GLY H H 1 8.370 0.003 A 6 GLY HAy H 1 3.934 0.003 A 6 GLY HAx H 1 3.883 0.003 A 6 GLY CA C 13 45.916 0.16 A 6 GLY N N 15 109.634 0.13 A 7 SER H H 1 8.105 0.003 A 7 SER HA H 1 4.243 0.003 A 7 SER HBx H 1 3.769 0.003 A 7 SER HBy H 1 3.769 0.003 A 7 SER CA C 13 59.237 0.16 A 7 SER CB C 13 63.832 0.16 A 7 SER N N 15 115.650 0.13 A 8 GLU H H 1 8.594 0.003 A 8 GLU HA H 1 4.111 0.003 A 8 GLU HBy H 1 1.845 0.003 A 8 GLU HBx H 1 1.748 0.003 A 8 GLU HGx H 1 1.994 0.003 A 8 GLU HGy H 1 1.994 0.003 A 8 GLU CA C 13 57.220 0.16 A 8 GLU CB C 13 29.224 0.16 A 8 GLU CG C 13 35.846 0.16 A 8 GLU N N 15 122.639 0.13 A 9 TYR H H 1 7.210 0.003 A 9 TYR HA H 1 4.352 0.003 A 9 TYR HBx H 1 2.848 0.003 A 9 TYR HBy H 1 3.216 0.003 A 9 TYR HDx H 1 6.938 0.003 A 9 TYR HDy H 1 6.938 0.003 A 9 TYR HEx H 1 6.814 0.003 A 9 TYR HEy H 1 6.814 0.003 A 9 TYR CA C 13 61.239 0.16 A 9 TYR CB C 13 37.973 0.16 A 9 TYR CDx C 13 132.035 0.16 A 9 TYR CDy C 13 132.035 0.16 A 9 TYR CEx C 13 119.191 0.16 A 9 TYR CEy C 13 119.191 0.16 A 9 TYR N N 15 118.053 0.13 A 10 GLY H H 1 8.350 0.003 A 10 GLY HAx H 1 3.816 0.003 A 10 GLY HAy H 1 4.377 0.003 A 10 GLY CA C 13 46.117 0.16 A 10 GLY N N 15 106.445 0.13 A 11 ARG H H 1 7.461 0.003 A 11 ARG HA H 1 3.978 0.003 A 11 ARG HBy H 1 1.463 0.003 A 11 ARG HBx H 1 1.290 0.003 A 11 ARG HDx H 1 2.893 0.003 A 11 ARG HDy H 1 2.893 0.003 A 11 ARG HGy H 1 1.264 0.003 A 11 ARG HGx H 1 1.116 0.003 A 11 ARG CA C 13 57.083 0.16 A 11 ARG CB C 13 29.962 0.16 A 11 ARG CD C 13 43.332 0.16 A 11 ARG CG C 13 27.163 0.16 A 11 ARG N N 15 117.325 0.13 A 12 TYR H H 1 7.295 0.003 A 12 TYR HA H 1 4.117 0.003 A 12 TYR HBy H 1 2.087 0.003 A 12 TYR HBx H 1 2.012 0.003 A 12 TYR HDx H 1 6.923 0.003 A 12 TYR HDy H 1 6.923 0.003 A 12 TYR HEx H 1 6.643 0.003 A 12 TYR HEy H 1 6.643 0.003 A 12 TYR CA C 13 59.150 0.16 A 12 TYR CB C 13 41.119 0.16 A 12 TYR CDx C 13 133.966 0.16 A 12 TYR CDy C 13 133.966 0.16 A 12 TYR CEx C 13 118.015 0.16 A 12 TYR CEy C 13 118.015 0.16 A 12 TYR N N 15 115.320 0.13 A 13 PHE H H 1 7.787 0.003 A 13 PHE HA H 1 5.624 0.003 A 13 PHE HBx H 1 2.526 0.003 A 13 PHE HBy H 1 2.838 0.003 A 13 PHE HDx H 1 7.237 0.003 A 13 PHE HDy H 1 7.237 0.003 A 13 PHE HEx H 1 6.848 0.003 A 13 PHE HEy H 1 6.848 0.003 A 13 PHE HZ H 1 6.690 0.003 A 13 PHE CA C 13 55.588 0.16 A 13 PHE CB C 13 41.324 0.16 A 13 PHE CDx C 13 132.056 0.16 A 13 PHE CEx C 13 130.121 0.16 A 13 PHE CZ C 13 128.153 0.16 A 13 PHE N N 15 116.588 0.13 A 14 GLU H H 1 7.765 0.003 A 14 GLU HA H 1 4.466 0.003 A 14 GLU HBx H 1 1.815 0.003 A 14 GLU HBy H 1 1.963 0.003 A 14 GLU HGx H 1 2.130 0.003 A 14 GLU HGy H 1 2.130 0.003 A 14 GLU CA C 13 54.324 0.16 A 14 GLU CB C 13 33.505 0.16 A 14 GLU CG C 13 37.300 0.16 A 14 GLU N N 15 115.889 0.13 A 15 GLN H H 1 8.551 0.003 A 15 GLN HA H 1 3.668 0.003 A 15 GLN HBx H 1 1.967 0.003 A 15 GLN HBy H 1 1.967 0.003 A 15 GLN HE2y H 1 7.481 0.003 A 15 GLN HE2x H 1 6.831 0.003 A 15 GLN HGx H 1 2.264 0.003 A 15 GLN HGy H 1 2.264 0.003 A 15 GLN CA C 13 58.281 0.16 A 15 GLN CB C 13 28.298 0.16 A 15 GLN CG C 13 34.161 0.16 A 15 GLN N N 15 119.738 0.13 A 15 GLN NE2 N 15 111.789 0.13 A 16 LEU H H 1 9.207 0.003 A 16 LEU HA H 1 3.780 0.003 A 16 LEU HBx H 1 1.591 0.003 A 16 LEU HBy H 1 2.239 0.003 A 16 LEU HDx% H 1 0.863 0.003 A 16 LEU HDy% H 1 0.851 0.003 A 16 LEU HG H 1 1.429 0.003 A 16 LEU CA C 13 57.562 0.16 A 16 LEU CB C 13 39.149 0.16 A 16 LEU CDy C 13 25.179 0.16 A 16 LEU CDx C 13 22.357 0.16 A 16 LEU CG C 13 27.705 0.16 A 16 LEU N N 15 118.312 0.13 A 17 GLN H H 1 7.721 0.003 A 17 GLN HA H 1 4.184 0.003 A 17 GLN HBy H 1 2.299 0.003 A 17 GLN HBx H 1 2.120 0.003 A 17 GLN HE2x H 1 6.806 0.003 A 17 GLN HE2y H 1 7.373 0.003 A 17 GLN HGx H 1 2.341 0.003 A 17 GLN HGy H 1 2.430 0.003 A 17 GLN CA C 13 56.602 0.16 A 17 GLN CB C 13 31.700 0.16 A 17 GLN CG C 13 34.143 0.16 A 17 GLN N N 15 121.470 0.13 A 17 GLN NE2 N 15 109.103 0.13 A 18 LYS H H 1 8.289 0.003 A 18 LYS HA H 1 5.098 0.003 A 18 LYS HBy H 1 1.779 0.003 A 18 LYS HBx H 1 1.695 0.003 A 18 LYS HDx H 1 1.436 0.003 A 18 LYS HDy H 1 1.436 0.003 A 18 LYS HEy H 1 2.551 0.003 A 18 LYS HEx H 1 2.512 0.003 A 18 LYS HGy H 1 1.437 0.003 A 18 LYS HGx H 1 1.190 0.003 A 18 LYS CA C 13 55.562 0.16 A 18 LYS CB C 13 33.039 0.16 A 18 LYS CD C 13 29.066 0.16 A 18 LYS CE C 13 41.864 0.16 A 18 LYS CG C 13 25.447 0.16 A 18 LYS N N 15 122.844 0.13 A 19 VAL H H 1 9.359 0.003 A 19 VAL HA H 1 4.947 0.003 A 19 VAL HB H 1 2.184 0.003 A 19 VAL HGx% H 1 0.821 0.003 A 19 VAL HGy% H 1 0.565 0.003 A 19 VAL CA C 13 58.612 0.16 A 19 VAL CB C 13 34.671 0.16 A 19 VAL CGy C 13 21.820 0.16 A 19 VAL CGx C 13 18.437 0.16 A 19 VAL N N 15 116.052 0.13 A 20 ASN H H 1 8.896 0.003 A 20 ASN HA H 1 5.149 0.003 A 20 ASN HBx H 1 2.689 0.003 A 20 ASN HBy H 1 2.742 0.003 A 20 ASN HD2x H 1 6.964 0.003 A 20 ASN HD2y H 1 7.228 0.003 A 20 ASN CA C 13 53.020 0.16 A 20 ASN CB C 13 39.753 0.16 A 20 ASN N N 15 119.601 0.13 A 20 ASN ND2 N 15 112.688 0.13 A 21 LEU H H 1 8.794 0.003 A 21 LEU HA H 1 5.148 0.003 A 21 LEU HBx H 1 1.110 0.003 A 21 LEU HBy H 1 1.464 0.003 A 21 LEU HDx% H 1 0.692 0.003 A 21 LEU HDy% H 1 0.545 0.003 A 21 LEU HG H 1 0.738 0.003 A 21 LEU CA C 13 53.405 0.16 A 21 LEU CB C 13 46.333 0.16 A 21 LEU CDy C 13 24.591 0.16 A 21 LEU CDx C 13 22.391 0.16 A 21 LEU CG C 13 26.929 0.16 A 21 LEU N N 15 125.980 0.13 A 22 THR H H 1 8.727 0.003 A 22 THR HA H 1 5.424 0.003 A 22 THR HB H 1 3.717 0.003 A 22 THR HG2% H 1 1.055 0.003 A 22 THR CA C 13 61.038 0.16 A 22 THR CB C 13 71.215 0.16 A 22 THR CG2 C 13 21.580 0.16 A 22 THR N N 15 121.593 0.13 A 23 VAL H H 1 9.341 0.003 A 23 VAL HA H 1 4.557 0.003 A 23 VAL HB H 1 1.887 0.003 A 23 VAL HGx% H 1 0.692 0.003 A 23 VAL HGy% H 1 0.770 0.003 A 23 VAL CA C 13 60.417 0.16 A 23 VAL CB C 13 34.818 0.16 A 23 VAL CGy C 13 22.306 0.16 A 23 VAL CGx C 13 20.739 0.16 A 23 VAL N N 15 125.649 0.13 A 24 ARG H H 1 8.574 0.003 A 24 ARG HA H 1 4.250 0.003 A 24 ARG HBx H 1 1.720 0.003 A 24 ARG HBy H 1 1.882 0.003 A 24 ARG HDx H 1 3.084 0.003 A 24 ARG HDy H 1 3.084 0.003 A 24 ARG HGy H 1 1.587 0.003 A 24 ARG HGx H 1 1.535 0.003 A 24 ARG CA C 13 56.883 0.16 A 24 ARG CB C 13 30.497 0.16 A 24 ARG CD C 13 43.169 0.16 A 24 ARG CG C 13 27.267 0.16 A 24 ARG N N 15 127.633 0.13 A 25 LEU H H 1 7.989 0.003 A 25 LEU HA H 1 4.483 0.003 A 25 LEU HBy H 1 1.393 0.003 A 25 LEU HBx H 1 1.294 0.003 A 25 LEU HDx% H 1 0.739 0.003 A 25 LEU HDy% H 1 0.624 0.003 A 25 LEU HG H 1 1.418 0.003 A 25 LEU CA C 13 53.112 0.16 A 25 LEU CB C 13 41.422 0.16 A 25 LEU CDy C 13 25.938 0.16 A 25 LEU CDx C 13 23.079 0.16 A 25 LEU CG C 13 26.427 0.16 A 25 LEU N N 15 125.950 0.13 A 26 GLY H H 1 8.082 0.003 A 26 GLY HAx H 1 3.692 0.003 A 26 GLY HAy H 1 3.956 0.003 A 26 GLY CA C 13 45.956 0.16 A 26 GLY N N 15 110.290 0.13 A 27 ASP H H 1 8.652 0.003 A 27 ASP HA H 1 4.521 0.003 A 27 ASP HBx H 1 2.605 0.003 A 27 ASP HBy H 1 2.682 0.003 A 27 ASP CA C 13 55.599 0.16 A 27 ASP CB C 13 41.021 0.16 A 27 ASP N N 15 122.702 0.13 A 28 THR H H 1 8.026 0.003 A 28 THR HA H 1 4.342 0.003 A 28 THR HB H 1 4.271 0.003 A 28 THR HG2% H 1 1.092 0.003 A 28 THR CA C 13 62.205 0.16 A 28 THR CB C 13 70.139 0.16 A 28 THR CG2 C 13 21.511 0.16 A 28 THR N N 15 109.054 0.13 A 29 GLY H H 1 7.686 0.003 A 29 GLY HAx H 1 4.095 0.003 A 29 GLY HAy H 1 4.095 0.003 A 29 GLY CA C 13 45.024 0.16 A 29 GLY N N 15 109.776 0.13 A 30 SER H H 1 8.441 0.003 A 30 SER HA H 1 5.058 0.003 A 30 SER HBy H 1 3.638 0.003 A 30 SER HBx H 1 3.538 0.003 A 30 SER CA C 13 57.878 0.16 A 30 SER CB C 13 65.478 0.16 A 30 SER N N 15 115.054 0.13 A 31 PHE H H 1 8.846 0.003 A 31 PHE HA H 1 4.784 0.003 A 31 PHE HBy H 1 3.031 0.003 A 31 PHE HBx H 1 2.578 0.003 A 31 PHE HDx H 1 7.018 0.003 A 31 PHE HDy H 1 7.018 0.003 A 31 PHE HEx H 1 6.975 0.003 A 31 PHE HEy H 1 6.975 0.003 A 31 PHE CA C 13 56.744 0.16 A 31 PHE CB C 13 42.354 0.16 A 31 PHE CDx C 13 131.745 0.16 A 31 PHE CEy C 13 131.286 0.16 A 31 PHE N N 15 122.939 0.13 A 32 ASP H H 1 7.672 0.003 A 32 ASP HA H 1 5.329 0.003 A 32 ASP HBy H 1 2.345 0.003 A 32 ASP HBx H 1 2.166 0.003 A 32 ASP CA C 13 52.339 0.16 A 32 ASP CB C 13 43.394 0.16 A 32 ASP N N 15 127.591 0.13 A 33 GLY H H 1 8.548 0.003 A 33 GLY HAx H 1 3.586 0.003 A 33 GLY HAy H 1 4.335 0.003 A 33 GLY CA C 13 44.843 0.16 A 33 GLY N N 15 108.141 0.13 A 34 THR H H 1 8.796 0.003 A 34 THR HA H 1 5.160 0.003 A 34 THR HB H 1 3.933 0.003 A 34 THR HG2% H 1 1.132 0.003 A 34 THR CA C 13 60.881 0.16 A 34 THR CB C 13 71.475 0.16 A 34 THR CG2 C 13 21.840 0.16 A 34 THR N N 15 115.774 0.13 A 35 ALA H H 1 8.969 0.003 A 35 ALA HA H 1 5.173 0.003 A 35 ALA HB% H 1 1.113 0.003 A 35 ALA CA C 13 50.307 0.16 A 35 ALA CB C 13 24.783 0.16 A 35 ALA N N 15 124.464 0.13 A 36 ALA H H 1 8.813 0.003 A 36 ALA HA H 1 5.373 0.003 A 36 ALA HB% H 1 1.197 0.003 A 36 ALA CA C 13 50.041 0.16 A 36 ALA CB C 13 21.264 0.16 A 36 ALA N N 15 121.716 0.13 A 37 ILE H H 1 8.325 0.003 A 37 ILE HA H 1 4.467 0.003 A 37 ILE HB H 1 2.128 0.003 A 37 ILE HD1% H 1 0.788 0.003 A 37 ILE HG1y H 1 1.693 0.003 A 37 ILE HG1x H 1 0.729 0.003 A 37 ILE HG2% H 1 0.691 0.003 A 37 ILE CA C 13 61.119 0.16 A 37 ILE CB C 13 37.486 0.16 A 37 ILE CD1 C 13 12.826 0.16 A 37 ILE CG1 C 13 27.545 0.16 A 37 ILE CG2 C 13 18.001 0.16 A 37 ILE N N 15 120.209 0.13 A 38 THR H H 1 9.420 0.003 A 38 THR HA H 1 4.238 0.003 A 38 THR HB H 1 4.089 0.003 A 38 THR HG2% H 1 1.109 0.003 A 38 THR CA C 13 63.434 0.16 A 38 THR CB C 13 68.759 0.16 A 38 THR CG2 C 13 22.388 0.16 A 38 THR N N 15 124.301 0.13 A 39 SER H H 1 7.484 0.003 A 39 SER HA H 1 4.418 0.003 A 39 SER HBx H 1 3.795 0.003 A 39 SER HBy H 1 3.795 0.003 A 39 SER CA C 13 58.305 0.16 A 39 SER CB C 13 64.604 0.16 A 39 SER N N 15 113.739 0.13 A 40 LEU H H 1 8.791 0.003 A 40 LEU HA H 1 5.037 0.003 A 40 LEU HBy H 1 1.722 0.003 A 40 LEU HBx H 1 1.064 0.003 A 40 LEU HDx% H 1 0.616 0.003 A 40 LEU HDy% H 1 0.883 0.003 A 40 LEU HG H 1 1.336 0.003 A 40 LEU CA C 13 54.708 0.16 A 40 LEU CB C 13 45.125 0.16 A 40 LEU CDy C 13 23.549 0.16 A 40 LEU CDx C 13 20.078 0.16 A 40 LEU CG C 13 27.567 0.16 A 40 LEU N N 15 126.778 0.13 A 41 LYS H H 1 8.618 0.003 A 41 LYS HA H 1 4.563 0.003 A 41 LYS HBx H 1 1.749 0.003 A 41 LYS HBy H 1 1.796 0.003 A 41 LYS HDx H 1 1.684 0.003 A 41 LYS HDy H 1 1.684 0.003 A 41 LYS HEx H 1 2.941 0.003 A 41 LYS HEy H 1 2.941 0.003 A 41 LYS HGy H 1 1.395 0.003 A 41 LYS HGx H 1 1.316 0.003 A 41 LYS CA C 13 55.023 0.16 A 41 LYS CB C 13 34.011 0.16 A 41 LYS CD C 13 29.053 0.16 A 41 LYS CE C 13 42.270 0.16 A 41 LYS CG C 13 24.614 0.16 A 41 LYS N N 15 128.900 0.13 A 42 GLY H H 1 9.198 0.003 A 42 GLY HAy H 1 4.102 0.003 A 42 GLY HAx H 1 3.653 0.003 A 42 GLY CA C 13 47.315 0.16 A 42 GLY N N 15 118.954 0.13 A 43 SER H H 1 8.490 0.003 A 43 SER HA H 1 4.392 0.003 A 43 SER HBx H 1 3.892 0.003 A 43 SER HBy H 1 4.495 0.003 A 43 SER CA C 13 56.295 0.16 A 43 SER CB C 13 64.414 0.16 A 43 SER N N 15 119.093 0.13 A 44 LEU H H 1 8.002 0.003 A 44 LEU HA H 1 4.846 0.003 A 44 LEU HBy H 1 2.017 0.003 A 44 LEU HBx H 1 1.064 0.003 A 44 LEU HDx% H 1 0.413 0.003 A 44 LEU HDy% H 1 0.730 0.003 A 44 LEU HG H 1 0.962 0.003 A 44 LEU CA C 13 53.785 0.16 A 44 LEU CB C 13 44.325 0.16 A 44 LEU CDx C 13 22.922 0.16 A 44 LEU CDy C 13 25.678 0.16 A 44 LEU CG C 13 26.864 0.16 A 44 LEU N N 15 124.386 0.13 A 45 ALA H H 1 8.997 0.003 A 45 ALA HA H 1 5.258 0.003 A 45 ALA HB% H 1 0.882 0.003 A 45 ALA CA C 13 49.502 0.16 A 45 ALA CB C 13 20.220 0.16 A 45 ALA N N 15 131.713 0.13 A 46 TRP H H 1 8.825 0.003 A 46 TRP HA H 1 4.402 0.003 A 46 TRP HBx H 1 2.936 0.003 A 46 TRP HBy H 1 3.078 0.003 A 46 TRP HD1 H 1 7.110 0.003 A 46 TRP HE1 H 1 10.044 0.003 A 46 TRP HE3 H 1 7.281 0.003 A 46 TRP HH2 H 1 6.851 0.003 A 46 TRP HZ2 H 1 7.275 0.003 A 46 TRP HZ3 H 1 6.535 0.003 A 46 TRP CA C 13 58.636 0.16 A 46 TRP CB C 13 29.656 0.16 A 46 TRP CD1 C 13 125.940 0.16 A 46 TRP CE3 C 13 120.319 0.16 A 46 TRP CH2 C 13 123.755 0.16 A 46 TRP CZ2 C 13 114.497 0.16 A 46 TRP CZ3 C 13 120.399 0.16 A 46 TRP N N 15 124.026 0.13 A 46 TRP NE1 N 15 128.865 0.13 A 47 LEU H H 1 9.020 0.003 A 47 LEU HA H 1 5.405 0.003 A 47 LEU HBy H 1 0.906 0.003 A 47 LEU HBx H 1 0.822 0.003 A 47 LEU HDx% H 1 0.410 0.003 A 47 LEU HDy% H 1 0.441 0.003 A 47 LEU HG H 1 1.351 0.003 A 47 LEU CA C 13 53.126 0.16 A 47 LEU CB C 13 45.555 0.16 A 47 LEU CDy C 13 26.529 0.16 A 47 LEU CDx C 13 25.617 0.16 A 47 LEU CG C 13 27.575 0.16 A 47 LEU N N 15 122.056 0.13 A 48 GLU H H 1 8.689 0.003 A 48 GLU HA H 1 5.211 0.003 A 48 GLU HBx H 1 1.848 0.003 A 48 GLU HBy H 1 1.848 0.003 A 48 GLU HGy H 1 2.148 0.003 A 48 GLU HGx H 1 2.061 0.003 A 48 GLU CA C 13 54.285 0.16 A 48 GLU CB C 13 33.170 0.16 A 48 GLU CG C 13 36.350 0.16 A 48 GLU N N 15 120.698 0.13 A 49 LEU H H 1 9.156 0.003 A 49 LEU HA H 1 4.466 0.003 A 49 LEU HBx H 1 1.698 0.003 A 49 LEU HBy H 1 1.816 0.003 A 49 LEU HDx% H 1 1.042 0.003 A 49 LEU HDy% H 1 0.995 0.003 A 49 LEU HG H 1 1.916 0.003 A 49 LEU CA C 13 56.206 0.16 A 49 LEU CB C 13 42.583 0.16 A 49 LEU CDy C 13 26.199 0.16 A 49 LEU CDx C 13 23.840 0.16 A 49 LEU CG C 13 27.419 0.16 A 49 LEU N N 15 127.673 0.13 A 50 PHE H H 1 8.441 0.003 A 50 PHE HA H 1 4.814 0.003 A 50 PHE HBx H 1 2.954 0.003 A 50 PHE HBy H 1 2.954 0.003 A 50 PHE HDx H 1 7.176 0.003 A 50 PHE HDy H 1 7.176 0.003 A 50 PHE HEx H 1 7.240 0.003 A 50 PHE HEy H 1 7.240 0.003 A 50 PHE CA C 13 56.960 0.16 A 50 PHE CB C 13 41.428 0.16 A 50 PHE CDx C 13 131.785 0.16 A 50 PHE CEx C 13 131.484 0.16 A 50 PHE CZ C 13 129.648 0.16 A 50 PHE N N 15 121.151 0.13 A 51 GLY H H 1 8.420 0.003 A 51 GLY HAx H 1 3.686 0.003 A 51 GLY HAy H 1 4.264 0.003 A 51 GLY CA C 13 44.399 0.16 A 51 GLY N N 15 110.735 0.13 A 52 ALA H H 1 8.403 0.003 A 52 ALA HA H 1 4.141 0.003 A 52 ALA HB% H 1 1.360 0.003 A 52 ALA CA C 13 53.702 0.16 A 52 ALA CB C 13 19.485 0.16 A 52 ALA N N 15 121.850 0.13 A 53 GLU H H 1 8.174 0.003 A 53 GLU HA H 1 4.351 0.003 A 53 GLU HBx H 1 2.096 0.003 A 53 GLU HBy H 1 2.132 0.003 A 53 GLU HGy H 1 2.352 0.003 A 53 GLU HGx H 1 2.301 0.003 A 53 GLU CA C 13 56.917 0.16 A 53 GLU CB C 13 29.888 0.16 A 53 GLU CG C 13 36.478 0.16 A 53 GLU N N 15 117.444 0.13 A 54 GLN H H 1 8.323 0.003 A 54 GLN HA H 1 4.527 0.003 A 54 GLN HBy H 1 1.948 0.003 A 54 GLN HBx H 1 1.738 0.003 A 54 GLN HE2y H 1 7.618 0.003 A 54 GLN HE2x H 1 6.678 0.003 A 54 GLN HGx H 1 2.185 0.003 A 54 GLN HGy H 1 2.185 0.003 A 54 GLN CA C 13 52.951 0.16 A 54 GLN CB C 13 30.005 0.16 A 54 GLN CG C 13 33.068 0.16 A 54 GLN N N 15 120.912 0.13 A 54 GLN NE2 N 15 112.087 0.13 A 55 PRO HA H 1 4.039 0.003 A 55 PRO HBx H 1 1.288 0.003 A 55 PRO HBy H 1 1.465 0.003 A 55 PRO HDy H 1 3.393 0.003 A 55 PRO HDx H 1 2.884 0.003 A 55 PRO HGy H 1 1.591 0.003 A 55 PRO HGx H 1 1.041 0.003 A 55 PRO CA C 13 60.876 0.16 A 55 PRO CB C 13 29.442 0.16 A 55 PRO CD C 13 49.700 0.16 A 55 PRO CG C 13 26.521 0.16 A 56 PRO HA H 1 4.532 0.003 A 56 PRO HBy H 1 2.302 0.003 A 56 PRO HBx H 1 1.647 0.003 A 56 PRO HDy H 1 3.698 0.003 A 56 PRO HDx H 1 3.215 0.003 A 56 PRO HGx H 1 1.943 0.003 A 56 PRO HGy H 1 1.943 0.003 A 56 PRO CA C 13 61.102 0.16 A 56 PRO CB C 13 29.890 0.16 A 56 PRO CD C 13 50.000 0.16 A 56 PRO CG C 13 27.561 0.16 A 57 PRO HA H 1 4.231 0.003 A 57 PRO HBy H 1 2.189 0.003 A 57 PRO HBx H 1 1.716 0.003 A 57 PRO HDx H 1 3.452 0.003 A 57 PRO HDy H 1 3.693 0.003 A 57 PRO HGy H 1 1.942 0.003 A 57 PRO HGx H 1 1.913 0.003 A 57 PRO CA C 13 63.431 0.16 A 57 PRO CB C 13 31.901 0.16 A 57 PRO CD C 13 50.234 0.16 A 57 PRO CG C 13 27.455 0.16 A 58 ASN H H 1 9.050 0.003 A 58 ASN HA H 1 4.235 0.003 A 58 ASN HBy H 1 2.846 0.003 A 58 ASN HBx H 1 2.808 0.003 A 58 ASN HD2y H 1 7.485 0.003 A 58 ASN HD2x H 1 6.808 0.003 A 58 ASN CA C 13 54.593 0.16 A 58 ASN CB C 13 37.512 0.16 A 58 ASN N N 15 115.936 0.13 A 58 ASN ND2 N 15 113.473 0.13 A 59 THR H H 1 7.890 0.003 A 59 THR HA H 1 4.038 0.003 A 59 THR HB H 1 3.713 0.003 A 59 THR HG2% H 1 0.869 0.003 A 59 THR CA C 13 64.294 0.16 A 59 THR CB C 13 69.757 0.16 A 59 THR CG2 C 13 21.832 0.16 A 59 THR N N 15 111.504 0.13 A 60 LEU H H 1 8.216 0.003 A 60 LEU HA H 1 3.885 0.003 A 60 LEU HBy H 1 1.190 0.003 A 60 LEU HBx H 1 0.905 0.003 A 60 LEU HDx% H 1 0.185 0.003 A 60 LEU HDy% H 1 0.033 0.003 A 60 LEU HG H 1 1.010 0.003 A 60 LEU CA C 13 54.517 0.16 A 60 LEU CB C 13 41.760 0.16 A 60 LEU CDy C 13 25.127 0.16 A 60 LEU CDx C 13 23.710 0.16 A 60 LEU CG C 13 26.659 0.16 A 60 LEU N N 15 123.507 0.13 A 61 SER H H 1 6.826 0.003 A 61 SER HA H 1 4.346 0.003 A 61 SER HBx H 1 3.549 0.003 A 61 SER HBy H 1 3.585 0.003 A 61 SER CA C 13 56.447 0.16 A 61 SER CB C 13 65.477 0.16 A 61 SER N N 15 114.573 0.13 A 62 GLU H H 1 8.867 0.003 A 62 GLU HA H 1 3.406 0.003 A 62 GLU HBx H 1 1.789 0.003 A 62 GLU HBy H 1 1.789 0.003 A 62 GLU HGx H 1 2.010 0.003 A 62 GLU HGy H 1 2.144 0.003 A 62 GLU CA C 13 59.039 0.16 A 62 GLU CB C 13 28.747 0.16 A 62 GLU CG C 13 36.973 0.16 A 62 GLU N N 15 122.050 0.13 A 63 GLY H H 1 9.143 0.003 A 63 GLY HAx H 1 3.420 0.003 A 63 GLY HAy H 1 4.327 0.003 A 63 GLY CA C 13 44.700 0.16 A 63 GLY N N 15 113.325 0.13 A 64 ALA H H 1 7.551 0.003 A 64 ALA HA H 1 4.145 0.003 A 64 ALA HB% H 1 1.339 0.003 A 64 ALA CA C 13 52.999 0.16 A 64 ALA CB C 13 18.427 0.16 A 64 ALA N N 15 123.273 0.13 A 65 GLU H H 1 8.678 0.003 A 65 GLU HA H 1 4.394 0.003 A 65 GLU HBx H 1 1.913 0.003 A 65 GLU HBy H 1 2.050 0.003 A 65 GLU HGx H 1 2.199 0.003 A 65 GLU HGy H 1 2.383 0.003 A 65 GLU CA C 13 57.287 0.16 A 65 GLU CB C 13 30.693 0.16 A 65 GLU CG C 13 36.822 0.16 A 65 GLU N N 15 121.936 0.13 A 66 VAL H H 1 8.141 0.003 A 66 VAL HA H 1 5.312 0.003 A 66 VAL HB H 1 1.906 0.003 A 66 VAL HGx% H 1 0.693 0.003 A 66 VAL HGy% H 1 0.430 0.003 A 66 VAL CA C 13 58.210 0.16 A 66 VAL CB C 13 35.743 0.16 A 66 VAL CGy C 13 22.297 0.16 A 66 VAL CGx C 13 19.799 0.16 A 66 VAL N N 15 115.987 0.13 A 67 SER H H 1 8.706 0.003 A 67 SER HA H 1 5.095 0.003 A 67 SER HBx H 1 3.489 0.003 A 67 SER HBy H 1 3.618 0.003 A 67 SER CA C 13 57.855 0.16 A 67 SER CB C 13 65.632 0.16 A 67 SER N N 15 115.693 0.13 A 68 VAL H H 1 9.031 0.003 A 68 VAL HA H 1 5.108 0.003 A 68 VAL HB H 1 1.689 0.003 A 68 VAL HGx% H 1 0.544 0.003 A 68 VAL HGy% H 1 0.414 0.003 A 68 VAL CA C 13 59.645 0.16 A 68 VAL CB C 13 34.458 0.16 A 68 VAL CGy C 13 22.394 0.16 A 68 VAL CGx C 13 20.034 0.16 A 68 VAL N N 15 122.454 0.13 A 69 SER H H 1 8.834 0.003 A 69 SER HA H 1 5.917 0.003 A 69 SER HBx H 1 3.587 0.003 A 69 SER HBy H 1 3.587 0.003 A 69 SER CA C 13 56.581 0.16 A 69 SER CB C 13 66.309 0.16 A 69 SER N N 15 117.477 0.13 A 70 VAL H H 1 8.840 0.003 A 70 VAL HA H 1 4.674 0.003 A 70 VAL HB H 1 2.141 0.003 A 70 VAL HGx% H 1 1.034 0.003 A 70 VAL HGy% H 1 0.707 0.003 A 70 VAL CA C 13 59.900 0.16 A 70 VAL CB C 13 36.238 0.16 A 70 VAL CGy C 13 21.346 0.16 A 70 VAL CGx C 13 19.889 0.16 A 70 VAL N N 15 120.222 0.13 A 71 TRP H H 1 8.545 0.003 A 71 TRP HA H 1 5.248 0.003 A 71 TRP HBy H 1 3.078 0.003 A 71 TRP HBx H 1 2.997 0.003 A 71 TRP HD1 H 1 7.127 0.003 A 71 TRP HE1 H 1 10.044 0.003 A 71 TRP HE3 H 1 7.127 0.003 A 71 TRP HH2 H 1 6.913 0.003 A 71 TRP HZ2 H 1 7.275 0.003 A 71 TRP HZ3 H 1 6.814 0.003 A 71 TRP CA C 13 56.583 0.16 A 71 TRP CB C 13 29.034 0.16 A 71 TRP CD1 C 13 127.052 0.16 A 71 TRP CE3 C 13 120.522 0.16 A 71 TRP CH2 C 13 124.102 0.16 A 71 TRP CZ2 C 13 114.503 0.16 A 71 TRP CZ3 C 13 121.847 0.16 A 71 TRP N N 15 127.121 0.13 A 71 TRP NE1 N 15 128.902 0.13 A 72 THR H H 1 9.112 0.003 A 72 THR HA H 1 4.603 0.003 A 72 THR HB H 1 4.127 0.003 A 72 THR HG2% H 1 1.244 0.003 A 72 THR CA C 13 60.452 0.16 A 72 THR CB C 13 69.960 0.16 A 72 THR CG2 C 13 20.847 0.16 A 72 THR N N 15 121.250 0.13 A 73 GLY H H 1 8.781 0.003 A 73 GLY HAy H 1 3.851 0.003 A 73 GLY HAx H 1 3.684 0.003 A 73 GLY CA C 13 46.902 0.16 A 73 GLY N N 15 117.227 0.13 A 74 GLY H H 1 8.419 0.003 A 74 GLY HAx H 1 3.667 0.003 A 74 GLY HAy H 1 4.014 0.003 A 74 GLY CA C 13 45.264 0.16 A 74 GLY N N 15 106.186 0.13 A 75 ALA H H 1 7.579 0.003 A 75 ALA HA H 1 4.784 0.003 A 75 ALA HB% H 1 1.127 0.003 A 75 ALA CA C 13 50.548 0.16 A 75 ALA CB C 13 22.130 0.16 A 75 ALA N N 15 122.260 0.13 A 76 LEU H H 1 8.047 0.003 A 76 LEU HA H 1 3.998 0.003 A 76 LEU HBy H 1 1.183 0.003 A 76 LEU HBx H 1 -0.187 0.003 A 76 LEU HDx% H 1 0.104 0.003 A 76 LEU HDy% H 1 0.493 0.003 A 76 LEU HG H 1 0.890 0.003 A 76 LEU CA C 13 53.867 0.16 A 76 LEU CB C 13 41.423 0.16 A 76 LEU CDx C 13 21.729 0.16 A 76 LEU CDy C 13 25.379 0.16 A 76 LEU CG C 13 26.934 0.16 A 76 LEU N N 15 124.431 0.13 A 77 CYS H H 1 8.876 0.003 A 77 CYS HA H 1 5.173 0.003 A 77 CYS HBy H 1 2.520 0.003 A 77 CYS HBx H 1 1.919 0.003 A 77 CYS CA C 13 57.506 0.16 A 77 CYS CB C 13 29.489 0.16 A 77 CYS N N 15 125.827 0.13 A 78 ARG H H 1 8.845 0.003 A 78 ARG HA H 1 5.521 0.003 A 78 ARG HBx H 1 1.444 0.003 A 78 ARG HBy H 1 1.444 0.003 A 78 ARG HDx H 1 2.936 0.003 A 78 ARG HDy H 1 2.936 0.003 A 78 ARG HGy H 1 1.447 0.003 A 78 ARG HGx H 1 1.348 0.003 A 78 ARG CA C 13 54.016 0.16 A 78 ARG CB C 13 35.050 0.16 A 78 ARG CD C 13 43.576 0.16 A 78 ARG CG C 13 26.993 0.16 A 78 ARG N N 15 122.046 0.13 A 79 CYS H H 1 9.252 0.003 A 79 CYS HA H 1 4.731 0.003 A 79 CYS HBy H 1 2.658 0.003 A 79 CYS HBx H 1 2.388 0.003 A 79 CYS CA C 13 58.540 0.16 A 79 CYS CB C 13 31.840 0.16 A 79 CYS N N 15 125.668 0.13 A 80 ASP H H 1 8.927 0.003 A 80 ASP HA H 1 5.253 0.003 A 80 ASP HBy H 1 2.831 0.003 A 80 ASP HBx H 1 2.587 0.003 A 80 ASP CA C 13 54.601 0.16 A 80 ASP CB C 13 42.579 0.16 A 80 ASP N N 15 128.034 0.13 A 81 GLY H H 1 8.248 0.003 A 81 GLY HAx H 1 3.546 0.003 A 81 GLY HAy H 1 4.779 0.003 A 81 GLY CA C 13 46.298 0.16 A 81 GLY N N 15 103.432 0.13 A 82 ARG H H 1 8.638 0.003 A 82 ARG HA H 1 5.405 0.003 A 82 ARG HBx H 1 1.492 0.003 A 82 ARG HBy H 1 1.492 0.003 A 82 ARG HDy H 1 3.102 0.003 A 82 ARG HDx H 1 3.032 0.003 A 82 ARG HGx H 1 1.339 0.003 A 82 ARG HGy H 1 1.339 0.003 A 82 ARG CA C 13 53.694 0.16 A 82 ARG CB C 13 34.245 0.16 A 82 ARG CD C 13 43.219 0.16 A 82 ARG CG C 13 27.274 0.16 A 82 ARG N N 15 119.685 0.13 A 83 VAL H H 1 8.998 0.003 A 83 VAL HA H 1 3.844 0.003 A 83 VAL HB H 1 2.207 0.003 A 83 VAL HGx% H 1 0.643 0.003 A 83 VAL HGy% H 1 0.522 0.003 A 83 VAL CA C 13 64.524 0.16 A 83 VAL CB C 13 31.051 0.16 A 83 VAL CGy C 13 22.224 0.16 A 83 VAL CGx C 13 21.743 0.16 A 83 VAL N N 15 123.235 0.13 A 84 GLU H H 1 9.322 0.003 A 84 GLU HA H 1 4.404 0.003 A 84 GLU HBy H 1 1.755 0.003 A 84 GLU HBx H 1 1.435 0.003 A 84 GLU HGy H 1 2.040 0.003 A 84 GLU HGx H 1 1.990 0.003 A 84 GLU CA C 13 57.874 0.16 A 84 GLU CB C 13 32.554 0.16 A 84 GLU CG C 13 36.845 0.16 A 84 GLU N N 15 133.169 0.13 A 85 THR H H 1 6.992 0.003 A 85 THR HA H 1 4.524 0.003 A 85 THR HB H 1 3.505 0.003 A 85 THR HG2% H 1 1.238 0.003 A 85 THR CA C 13 61.325 0.16 A 85 THR CB C 13 71.655 0.16 A 85 THR CG2 C 13 22.366 0.16 A 85 THR N N 15 111.246 0.13 A 86 LEU H H 1 9.303 0.003 A 86 LEU HA H 1 4.661 0.003 A 86 LEU HBy H 1 1.603 0.003 A 86 LEU HBx H 1 1.401 0.003 A 86 LEU HDx% H 1 0.639 0.003 A 86 LEU HDy% H 1 0.537 0.003 A 86 LEU HG H 1 1.400 0.003 A 86 LEU CA C 13 54.539 0.16 A 86 LEU CB C 13 43.295 0.16 A 86 LEU CDy C 13 25.580 0.16 A 86 LEU CDx C 13 25.059 0.16 A 86 LEU CG C 13 27.582 0.16 A 86 LEU N N 15 127.732 0.13 A 87 ARG H H 1 8.577 0.003 A 87 ARG HA H 1 4.533 0.003 A 87 ARG HBx H 1 1.932 0.003 A 87 ARG HBy H 1 2.005 0.003 A 87 ARG HDy H 1 3.012 0.003 A 87 ARG HDx H 1 2.865 0.003 A 87 ARG HGy H 1 1.649 0.003 A 87 ARG HGx H 1 1.547 0.003 A 87 ARG CA C 13 58.238 0.16 A 87 ARG CB C 13 31.971 0.16 A 87 ARG CD C 13 43.372 0.16 A 87 ARG CG C 13 27.034 0.16 A 87 ARG N N 15 124.294 0.13 A 88 ASP H H 1 8.731 0.003 A 88 ASP HA H 1 4.487 0.003 A 88 ASP HBx H 1 2.913 0.003 A 88 ASP HBy H 1 3.010 0.003 A 88 ASP CA C 13 54.015 0.16 A 88 ASP CB C 13 40.810 0.16 A 88 ASP N N 15 118.917 0.13 A 89 ASP H H 1 8.042 0.003 A 89 ASP HA H 1 4.367 0.003 A 89 ASP HBy H 1 2.607 0.003 A 89 ASP HBx H 1 2.528 0.003 A 89 ASP CA C 13 56.150 0.16 A 89 ASP CB C 13 40.619 0.16 A 89 ASP N N 15 113.768 0.13 A 90 ARG H H 1 8.370 0.003 A 90 ARG HA H 1 4.545 0.003 A 90 ARG HBx H 1 1.849 0.003 A 90 ARG HBy H 1 2.107 0.003 A 90 ARG HDx H 1 3.113 0.003 A 90 ARG HDy H 1 3.247 0.003 A 90 ARG HGy H 1 1.587 0.003 A 90 ARG HGx H 1 1.438 0.003 A 90 ARG CA C 13 55.702 0.16 A 90 ARG CB C 13 32.586 0.16 A 90 ARG CD C 13 43.085 0.16 A 90 ARG CG C 13 27.963 0.16 A 90 ARG N N 15 112.561 0.13 A 91 GLN H H 1 7.947 0.003 A 91 GLN HA H 1 5.371 0.003 A 91 GLN HBy H 1 2.105 0.003 A 91 GLN HBx H 1 2.017 0.003 A 91 GLN HE2x H 1 6.693 0.003 A 91 GLN HE2y H 1 7.967 0.003 A 91 GLN HGx H 1 2.106 0.003 A 91 GLN HGy H 1 2.600 0.003 A 91 GLN CA C 13 55.243 0.16 A 91 GLN CB C 13 32.930 0.16 A 91 GLN CG C 13 34.952 0.16 A 91 GLN N N 15 118.333 0.13 A 91 GLN NE2 N 15 112.654 0.13 A 92 PHE H H 1 7.910 0.003 A 92 PHE HA H 1 4.874 0.003 A 92 PHE HBy H 1 3.469 0.003 A 92 PHE HBx H 1 2.872 0.003 A 92 PHE HDx H 1 6.731 0.003 A 92 PHE HDy H 1 6.731 0.003 A 92 PHE HEx H 1 6.778 0.003 A 92 PHE HEy H 1 6.778 0.003 A 92 PHE HZ H 1 6.690 0.003 A 92 PHE CA C 13 55.720 0.16 A 92 PHE CB C 13 40.461 0.16 A 92 PHE CDy C 13 132.601 0.16 A 92 PHE CDx C 13 132.595 0.16 A 92 PHE CEy C 13 130.068 0.16 A 92 PHE CEx C 13 130.064 0.16 A 92 PHE CZ C 13 128.153 0.16 A 92 PHE N N 15 118.388 0.13 A 93 ALA H H 1 8.583 0.003 A 93 ALA HA H 1 4.672 0.003 A 93 ALA HB% H 1 -0.410 0.003 A 93 ALA CA C 13 49.005 0.16 A 93 ALA CB C 13 19.061 0.16 A 93 ALA N N 15 122.229 0.13 A 94 ILE H H 1 9.132 0.003 A 94 ILE HA H 1 4.663 0.003 A 94 ILE HB H 1 1.346 0.003 A 94 ILE HD1% H 1 0.424 0.003 A 94 ILE HG1y H 1 1.261 0.003 A 94 ILE HG1x H 1 0.958 0.003 A 94 ILE HG2% H 1 0.563 0.003 A 94 ILE CA C 13 57.594 0.16 A 94 ILE CB C 13 40.256 0.16 A 94 ILE CD1 C 13 14.710 0.16 A 94 ILE CG1 C 13 26.289 0.16 A 94 ILE CG2 C 13 18.046 0.16 A 94 ILE N N 15 118.229 0.13 A 95 ARG H H 1 8.945 0.003 A 95 ARG HA H 1 4.729 0.003 A 95 ARG HBy H 1 1.733 0.003 A 95 ARG HBx H 1 1.632 0.003 A 95 ARG HDx H 1 3.043 0.003 A 95 ARG HDy H 1 3.113 0.003 A 95 ARG HE H 1 8.641 0.003 A 95 ARG HGy H 1 1.516 0.003 A 95 ARG HGx H 1 1.317 0.003 A 95 ARG CA C 13 51.922 0.16 A 95 ARG CB C 13 30.135 0.16 A 95 ARG CD C 13 43.255 0.16 A 95 ARG CG C 13 24.682 0.16 A 95 ARG N N 15 126.075 0.13 A 95 ARG NE N 15 86.629 0.13 A 96 LEU H H 1 8.978 0.003 A 96 LEU HA H 1 4.213 0.003 A 96 LEU HBx H 1 0.603 0.003 A 96 LEU HBy H 1 0.603 0.003 A 96 LEU HDx% H 1 0.134 0.003 A 96 LEU HDy% H 1 0.066 0.003 A 96 LEU HG H 1 1.116 0.003 A 96 LEU CA C 13 55.152 0.16 A 96 LEU CB C 13 40.228 0.16 A 96 LEU CDx C 13 22.144 0.16 A 96 LEU CDy C 13 25.603 0.16 A 96 LEU CG C 13 26.695 0.16 A 96 LEU N N 15 130.135 0.13 A 97 VAL H H 1 8.007 0.003 A 97 VAL HA H 1 4.382 0.003 A 97 VAL HB H 1 1.818 0.003 A 97 VAL HGx% H 1 0.736 0.003 A 97 VAL HGy% H 1 0.638 0.003 A 97 VAL CA C 13 60.219 0.16 A 97 VAL CB C 13 35.371 0.16 A 97 VAL CGy C 13 21.010 0.16 A 97 VAL CGx C 13 19.414 0.16 A 97 VAL N N 15 116.809 0.13 A 98 GLY H H 1 8.317 0.003 A 98 GLY HAx H 1 3.826 0.003 A 98 GLY HAy H 1 4.088 0.003 A 98 GLY CA C 13 44.616 0.16 A 98 GLY N N 15 108.216 0.13 A 99 ARG H H 1 8.450 0.003 A 99 ARG HA H 1 4.530 0.003 A 99 ARG HBy H 1 1.715 0.003 A 99 ARG HBx H 1 1.595 0.003 A 99 ARG HDx H 1 3.112 0.003 A 99 ARG HDy H 1 3.112 0.003 A 99 ARG HGx H 1 1.565 0.003 A 99 ARG HGy H 1 1.565 0.003 A 99 ARG CA C 13 54.754 0.16 A 99 ARG CB C 13 31.598 0.16 A 99 ARG CD C 13 43.174 0.16 A 99 ARG CG C 13 26.764 0.16 A 99 ARG N N 15 118.972 0.13 A 100 VAL H H 1 8.758 0.003 A 100 VAL HA H 1 3.956 0.003 A 100 VAL HB H 1 1.277 0.003 A 100 VAL HGx% H 1 -0.171 0.003 A 100 VAL HGy% H 1 0.881 0.003 A 100 VAL CA C 13 63.131 0.16 A 100 VAL CB C 13 31.538 0.16 A 100 VAL CGx C 13 20.531 0.16 A 100 VAL CGy C 13 22.374 0.16 A 100 VAL N N 15 124.345 0.13 A 101 ARG H H 1 8.810 0.003 A 101 ARG HA H 1 4.485 0.003 A 101 ARG HBx H 1 1.594 0.003 A 101 ARG HBy H 1 1.594 0.003 A 101 ARG HDx H 1 3.070 0.003 A 101 ARG HDy H 1 3.070 0.003 A 101 ARG HGx H 1 1.487 0.003 A 101 ARG HGy H 1 1.487 0.003 A 101 ARG CA C 13 54.231 0.16 A 101 ARG CB C 13 32.170 0.16 A 101 ARG CD C 13 43.124 0.16 A 101 ARG CG C 13 27.030 0.16 A 101 ARG N N 15 127.305 0.13 A 102 GLU H H 1 8.533 0.003 A 102 GLU HA H 1 4.584 0.003 A 102 GLU HBy H 1 1.821 0.003 A 102 GLU HBx H 1 1.720 0.003 A 102 GLU HGx H 1 2.080 0.003 A 102 GLU HGy H 1 2.080 0.003 A 102 GLU CA C 13 55.458 0.16 A 102 GLU CB C 13 30.277 0.16 A 102 GLU CG C 13 36.305 0.16 A 102 GLU N N 15 123.398 0.13 A 103 LEU H H 1 9.072 0.003 A 103 LEU HA H 1 4.322 0.003 A 103 LEU HBx H 1 1.476 0.003 A 103 LEU HBy H 1 1.476 0.003 A 103 LEU HDx% H 1 0.663 0.003 A 103 LEU HDy% H 1 0.663 0.003 A 103 LEU HG H 1 1.435 0.003 A 103 LEU CA C 13 55.242 0.16 A 103 LEU CB C 13 42.729 0.16 A 103 LEU CDx C 13 23.354 0.16 A 103 LEU CDy C 13 25.173 0.16 A 103 LEU CG C 13 27.203 0.16 A 103 LEU N N 15 126.621 0.13 A 104 GLN H H 1 7.952 0.003 A 104 GLN HA H 1 4.369 0.003 A 104 GLN HBx H 1 1.913 0.003 A 104 GLN HBy H 1 2.077 0.003 A 104 GLN HE2y H 1 7.449 0.003 A 104 GLN HE2x H 1 6.915 0.003 A 104 GLN HGx H 1 2.275 0.003 A 104 GLN HGy H 1 2.275 0.003 A 104 GLN CA C 13 55.452 0.16 A 104 GLN CB C 13 30.596 0.16 A 104 GLN CG C 13 33.933 0.16 A 104 GLN N N 15 117.819 0.13 A 104 GLN NE2 N 15 111.507 0.13 A 105 ARG H H 1 8.461 0.003 A 105 ARG HA H 1 4.595 0.003 A 105 ARG HBy H 1 1.781 0.003 A 105 ARG HBx H 1 1.647 0.003 A 105 ARG HDx H 1 3.049 0.003 A 105 ARG HDy H 1 3.049 0.003 A 105 ARG HGx H 1 1.458 0.003 A 105 ARG HGy H 1 1.527 0.003 A 105 ARG CA C 13 56.014 0.16 A 105 ARG CB C 13 31.776 0.16 A 105 ARG CD C 13 43.195 0.16 A 105 ARG CG C 13 27.288 0.16 A 105 ARG N N 15 121.603 0.13 A 106 ARG H H 1 8.480 0.003 A 106 ARG HA H 1 4.267 0.003 A 106 ARG HBx H 1 1.645 0.003 A 106 ARG HBy H 1 1.645 0.003 A 106 ARG HDx H 1 2.859 0.003 A 106 ARG HDy H 1 2.859 0.003 A 106 ARG HGx H 1 1.420 0.003 A 106 ARG HGy H 1 1.420 0.003 A 106 ARG CA C 13 56.137 0.16 A 106 ARG CB C 13 31.163 0.16 A 106 ARG CD C 13 43.283 0.16 A 106 ARG CG C 13 26.749 0.16 A 106 ARG N N 15 122.078 0.13 A 107 GLU H H 1 8.300 0.003 A 107 GLU HA H 1 4.134 0.003 A 107 GLU HBy H 1 1.794 0.003 A 107 GLU HBx H 1 1.722 0.003 A 107 GLU HGy H 1 2.058 0.003 A 107 GLU HGx H 1 1.994 0.003 A 107 GLU CA C 13 56.450 0.16 A 107 GLU CB C 13 30.855 0.16 A 107 GLU CG C 13 36.121 0.16 A 107 GLU N N 15 121.335 0.13 A 108 TYR H H 1 7.922 0.003 A 108 TYR HA H 1 4.391 0.003 A 108 TYR HBx H 1 2.714 0.003 A 108 TYR HBy H 1 2.887 0.003 A 108 TYR HDx H 1 6.941 0.003 A 108 TYR HDy H 1 6.941 0.003 A 108 TYR HEx H 1 6.667 0.003 A 108 TYR HEy H 1 6.667 0.003 A 108 TYR CA C 13 57.520 0.16 A 108 TYR CB C 13 39.138 0.16 A 108 TYR CDx C 13 133.233 0.16 A 108 TYR CEx C 13 118.148 0.16 A 108 TYR N N 15 119.901 0.13 A 109 PHE H H 1 7.572 0.003 A 109 PHE HA H 1 4.273 0.003 A 109 PHE HBx H 1 2.829 0.003 A 109 PHE HBy H 1 3.026 0.003 A 109 PHE HDx H 1 7.078 0.003 A 109 PHE HDy H 1 7.078 0.003 A 109 PHE HEx H 1 7.237 0.003 A 109 PHE HEy H 1 7.237 0.003 A 109 PHE HZ H 1 6.848 0.003 A 109 PHE CA C 13 59.058 0.16 A 109 PHE CB C 13 40.274 0.16 A 109 PHE CDx C 13 131.982 0.16 A 109 PHE CEx C 13 131.548 0.16 A 109 PHE CZ C 13 130.094 0.16 A 109 PHE N N 15 125.874 0.13 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 75 ALA HA A 76 LEU H 1.0 . 2.87 2 2 A 56 PRO HDy A 59 THR HG2% 1.0 . 5.16 3 3 A 36 ALA HA A 37 ILE H 1.0 . 2.93 4 4 A 36 ALA HA A 18 LYS HA 1.0 . 3.24 5 5 A 36 ALA HA A 37 ILE HG1x 1.0 . 5.10 6 6 A 36 ALA HA A 18 LYS HBx 1.0 . 4.92 7 7 A 56 PRO HDy A 31 PHE HD% 1.0 . 4.90 8 8 A 25 LEU HDy% A 56 PRO HDx 1.0 . 5.50 9 9 A 56 PRO HDx A 55 PRO HBy 1.0 . 4.15 10 10 A 56 PRO HDx A 55 PRO HBx 1.0 . 4.12 11 11 A 31 PHE HD% A 56 PRO HDx 1.0 . 4.89 12 12 A 36 ALA HA A 48 GLU H 1.0 . 5.26 13 13 A 31 PHE HE% A 55 PRO HDy 1.0 . 5.14 14 14 A 55 PRO HDy A 60 LEU HDy% 1.0 . 5.50 15 15 A 60 LEU HDy% A 55 PRO HDx 1.0 . 5.50 16 16 A 45 ALA HA A 46 TRP HBx 1.0 . 4.72 17 17 A 45 ALA HA A 46 TRP H 1.0 . 2.97 18 18 A 45 ALA HA A 40 LEU HA 1.0 . 3.40 19 19 A 45 ALA HA A 40 LEU HBy 1.0 . 4.83 20 20 A 45 ALA HA A 44 LEU HDy% 1.0 . 4.69 21 21 A 45 ALA HA A 46 TRP HA 1.0 . 4.63 22 22 A 46 TRP HA A 93 ALA HA 1.0 . 3.50 23 23 A 93 ALA HA A 94 ILE H 1.0 . 3.12 24 24 A 41 LYS H A 42 GLY HAx 1.0 . 5.05 25 25 A 42 GLY HAy A 44 LEU H 1.0 . 4.39 26 26 A 73 GLY HAy A 75 ALA H 1.0 . 5.09 27 27 A 81 GLY HAx A 95 ARG H 1.0 . 5.13 28 28 A 81 GLY HAx A 82 ARG HGx 1.0 . 5.42 29 28 A 81 GLY HAx A 82 ARG HGy 1.0 . 5.42 30 29 A 21 LEU HBy A 66 VAL HGy% 1.0 . 4.99 31 30 A 21 LEU HBx A 33 GLY H 1.0 . 5.02 32 31 A 81 GLY HAy A 82 ARG HGx 1.0 . 3.92 33 31 A 82 ARG HGy A 81 GLY HAy 1.0 . 3.92 34 32 A 81 GLY HAx A 97 VAL H 1.0 . 4.00 35 33 A 21 LEU HBy A 21 LEU H 1.0 . 3.88 36 34 A 21 LEU HBy A 21 LEU HDx% 1.0 . 3.64 37 35 A 10 GLY HAy A 12 TYR H 1.0 . 4.81 38 36 A 12 TYR H A 10 GLY HAx 1.0 . 4.93 39 37 A 10 GLY HAx A 9 TYR H 1.0 . 4.94 40 38 A 10 GLY HAx A 13 PHE H 1.0 . 4.71 41 39 A 6 GLY HAy A 9 TYR HE% 1.0 . 5.19 42 40 A 6 GLY HAy A 9 TYR HD% 1.0 . 4.66 43 41 A 9 TYR HE% A 6 GLY HAx 1.0 . 4.84 44 42 A 25 LEU HA A 26 GLY HAx 1.0 . 4.55 45 43 A 47 LEU HBy A 48 GLU HA 1.0 . 5.24 46 44 A 47 LEU HBy A 47 LEU H 1.0 . 4.05 47 45 A 48 GLU H A 47 LEU HBy 1.0 . 4.29 48 46 A 47 LEU HBy A 35 ALA HB% 1.0 . 4.11 49 47 A 48 GLU HA A 47 LEU HBx 1.0 . 4.93 50 48 A 47 LEU H A 47 LEU HBx 1.0 . 4.06 51 49 A 47 LEU HBx A 47 LEU HDy% 1.0 . 3.87 52 50 A 48 GLU H A 47 LEU HBx 1.0 . 4.23 53 51 A 47 LEU HBx A 36 ALA H 1.0 . 5.26 54 52 A 30 SER HBy A 29 GLY HAx 1.0 . 5.12 55 52 A 29 GLY HAy A 30 SER HBy 1.0 . 5.12 56 53 A 25 LEU H A 29 GLY HAx 1.0 . 4.09 57 53 A 29 GLY HAy A 25 LEU H 1.0 . 4.09 58 54 A 25 LEU HBx A 29 GLY HAx 1.0 . 3.86 59 54 A 29 GLY HAy A 25 LEU HBx 1.0 . 3.86 60 55 A 40 LEU HBy A 41 LYS H 1.0 . 4.68 61 56 A 40 LEU H A 40 LEU HBx 1.0 . 4.06 62 57 A 41 LYS H A 40 LEU HBx 1.0 . 4.73 63 58 A 30 SER H A 29 GLY HAx 1.0 . 2.82 64 58 A 29 GLY HAy A 30 SER H 1.0 . 2.82 65 59 A 25 LEU HBy A 29 GLY HAx 1.0 . 3.63 66 59 A 29 GLY HAy A 25 LEU HBy 1.0 . 3.63 67 60 A 31 PHE HE% A 33 GLY HAy 1.0 . 4.31 68 61 A 33 GLY HAy A 34 THR H 1.0 . 3.19 69 62 A 63 GLY HAy A 82 ARG HBx 1.0 . 4.79 70 62 A 63 GLY HAy A 82 ARG HBy 1.0 . 4.79 71 63 A 21 LEU HBx A 33 GLY HAx 1.0 . 4.96 72 64 A 33 GLY HAx A 34 THR HG2% 1.0 . 5.35 73 65 A 31 PHE HE% A 33 GLY HAx 1.0 . 4.50 74 66 A 33 GLY HAx A 34 THR HA 1.0 . 4.98 75 67 A 63 GLY HAx A 82 ARG HGx 1.0 . 4.87 76 67 A 82 ARG HGy A 63 GLY HAx 1.0 . 4.87 77 68 A 97 VAL HA A 98 GLY HAx 1.0 . 4.47 78 69 A 63 GLY HAx A 62 GLU HBx 1.0 . 5.22 79 69 A 63 GLY HAx A 62 GLU HBy 1.0 . 5.22 80 70 A 50 PHE HD% A 51 GLY HAy 1.0 . 5.25 81 71 A 98 GLY HAx A 99 ARG HBx 1.0 . 5.10 82 72 A 51 GLY HAy A 53 GLU H 1.0 . 4.73 83 73 A 99 ARG HBx A 98 GLY HAy 1.0 . 4.36 84 74 A 44 LEU HBy A 45 ALA H 1.0 . 4.84 85 75 A 44 LEU HBy A 95 ARG HA 1.0 . 4.47 86 76 A 45 ALA H A 44 LEU HBx 1.0 . 4.75 87 77 A 44 LEU HBx A 44 LEU HDx% 1.0 . 4.12 88 78 A 46 TRP HZ3 A 87 ARG HDy 1.0 . 5.32 89 79 A 87 ARG HDy A 87 ARG HA 1.0 . 4.92 90 80 A 79 CYS H A 78 ARG HDx 1.0 . 4.84 91 80 A 78 ARG HDy A 79 CYS H 1.0 . 4.84 92 81 A 78 ARG H A 78 ARG HDx 1.0 . 5.27 93 81 A 78 ARG HDy A 78 ARG H 1.0 . 5.27 94 82 A 67 SER HBx A 78 ARG HDx 1.0 . 4.78 95 82 A 78 ARG HDy A 67 SER HBx 1.0 . 4.78 96 83 A 78 ARG HDx A 103 LEU HDx% 1.0 . 3.90 97 83 A 103 LEU HDy% A 78 ARG HDx 1.0 . 3.90 98 83 A 78 ARG HDy A 103 LEU HDy% 1.0 . 3.90 99 83 A 78 ARG HDy A 103 LEU HDx% 1.0 . 3.90 100 84 A 79 CYS HA A 78 ARG HDx 1.0 . 3.13 101 84 A 78 ARG HDy A 79 CYS HA 1.0 . 3.13 102 85 A 78 ARG HBx A 78 ARG HDx 1.0 . 3.04 103 85 A 78 ARG HBy A 78 ARG HDx 1.0 . 3.04 104 85 A 78 ARG HDy A 78 ARG HBx 1.0 . 3.04 105 85 A 78 ARG HDy A 78 ARG HBy 1.0 . 3.04 106 86 A 67 SER HBy A 78 ARG HDx 1.0 . 4.31 107 86 A 78 ARG HDy A 67 SER HBy 1.0 . 4.31 108 87 A 86 LEU HBy A 92 PHE HD% 1.0 . 5.27 109 88 A 101 ARG HDy A 103 LEU HDx% 1.0 . 4.58 110 88 A 101 ARG HDx A 103 LEU HDx% 1.0 . 4.58 111 88 A 103 LEU HDy% A 101 ARG HDx 1.0 . 4.58 112 88 A 103 LEU HDy% A 101 ARG HDy 1.0 . 4.58 113 89 A 87 ARG HDy A 46 TRP HH2 1.0 . 5.12 114 90 A 87 ARG HDy A 87 ARG HBy 1.0 . 4.17 115 91 A 11 ARG HA A 11 ARG HDx 1.0 . 4.41 116 91 A 11 ARG HA A 11 ARG HDy 1.0 . 4.41 117 92 A 12 TYR HD% A 11 ARG HDx 1.0 . 5.50 118 92 A 11 ARG HDy A 12 TYR HD% 1.0 . 5.50 119 93 A 87 ARG H A 87 ARG HDx 1.0 . 5.34 120 94 A 106 ARG HBx A 106 ARG HDx 1.0 . 3.34 121 94 A 106 ARG HBy A 106 ARG HDx 1.0 . 3.34 122 94 A 106 ARG HDy A 106 ARG HBx 1.0 . 3.34 123 94 A 106 ARG HBy A 106 ARG HDy 1.0 . 3.34 124 95 A 32 ASP H A 32 ASP HBy 1.0 . 3.69 125 96 A 32 ASP HBy A 23 VAL H 1.0 . 5.05 126 97 A 31 PHE HA A 32 ASP HBx 1.0 . 4.98 127 98 A 32 ASP HBx A 22 THR HG2% 1.0 . 5.50 128 99 A 33 GLY H A 32 ASP HBx 1.0 . 4.38 129 100 A 86 LEU HBy A 86 LEU H 1.0 . 3.70 130 101 A 86 LEU HBy A 92 PHE HBy 1.0 . 4.78 131 102 A 87 ARG HA A 86 LEU HBx 1.0 . 4.58 132 103 A 86 LEU HBx A 86 LEU HDy% 1.0 . 3.99 133 104 A 90 ARG HBx A 90 ARG HDy 1.0 . 4.14 134 105 A 82 ARG HA A 82 ARG HDy 1.0 . 4.29 135 106 A 82 ARG HDy A 65 GLU HA 1.0 . 4.86 136 107 A 24 ARG H A 24 ARG HDx 1.0 . 4.70 137 107 A 24 ARG H A 24 ARG HDy 1.0 . 4.70 138 108 A 105 ARG HBy A 105 ARG HDx 1.0 . 3.59 139 108 A 105 ARG HBy A 105 ARG HDy 1.0 . 3.59 140 109 A 105 ARG HBx A 105 ARG HDx 1.0 . 3.39 141 109 A 105 ARG HDy A 105 ARG HBx 1.0 . 3.39 142 110 A 75 ALA HB% A 105 ARG HDx 1.0 . 5.43 143 110 A 105 ARG HDy A 75 ALA HB% 1.0 . 5.43 144 111 A 95 ARG HA A 95 ARG HDx 1.0 . 2.96 145 111 A 95 ARG HA A 95 ARG HDy 1.0 . 2.96 146 112 A 82 ARG HDx A 82 ARG HBx 1.0 . 2.82 147 112 A 82 ARG HBy A 82 ARG HDx 1.0 . 2.82 148 113 A 82 ARG HA A 82 ARG HDx 1.0 . 4.31 149 114 A 21 LEU H A 32 ASP HBy 1.0 . 5.11 150 115 A 86 LEU HBy A 62 GLU HGy 1.0 . 5.20 151 116 A 86 LEU HBy A 85 THR HA 1.0 . 4.89 152 117 A 86 LEU HBx A 62 GLU HGx 1.0 . 5.09 153 118 A 87 ARG H A 86 LEU HBx 1.0 . 4.09 154 119 A 92 PHE HBy A 86 LEU HBx 1.0 . 5.09 155 120 A 90 ARG HDy A 90 ARG H 1.0 . 4.98 156 121 A 90 ARG HDy A 90 ARG HBy 1.0 . 4.19 157 122 A 90 ARG HDy A 49 LEU HBx 1.0 . 5.04 158 123 A 90 ARG HDy A 90 ARG HA 1.0 . 4.61 159 124 A 100 VAL H A 99 ARG HDx 1.0 . 4.79 160 124 A 99 ARG HDy A 100 VAL H 1.0 . 4.79 161 125 A 99 ARG HA A 99 ARG HDx 1.0 . 3.77 162 125 A 99 ARG HDy A 99 ARG HA 1.0 . 3.77 163 126 A 99 ARG HBy A 99 ARG HDx 1.0 . 3.54 164 126 A 99 ARG HDy A 99 ARG HBy 1.0 . 3.54 165 127 A 99 ARG HDy A 99 ARG HGx 1.0 . 2.73 166 127 A 99 ARG HDx A 99 ARG HGx 1.0 . 2.73 167 127 A 99 ARG HGy A 99 ARG HDx 1.0 . 2.73 168 127 A 99 ARG HDy A 99 ARG HGy 1.0 . 2.73 169 128 A 24 ARG HA A 24 ARG HDx 1.0 . 4.33 170 128 A 24 ARG HDy A 24 ARG HA 1.0 . 4.33 171 129 A 65 GLU H A 24 ARG HDx 1.0 . 4.74 172 129 A 24 ARG HDy A 65 GLU H 1.0 . 4.74 173 130 A 24 ARG HBy A 24 ARG HDx 1.0 . 3.67 174 130 A 24 ARG HDy A 24 ARG HBy 1.0 . 3.67 175 131 A 101 ARG HDy A 103 LEU HBx 1.0 . 3.66 176 131 A 101 ARG HDx A 103 LEU HBx 1.0 . 3.66 177 131 A 103 LEU HBy A 101 ARG HDx 1.0 . 3.66 178 131 A 101 ARG HDy A 103 LEU HBy 1.0 . 3.66 179 132 A 99 ARG H A 99 ARG HDx 1.0 . 4.63 180 132 A 99 ARG HDy A 99 ARG H 1.0 . 4.63 181 133 A 104 GLN HBy A 103 LEU HBx 1.0 . 5.13 182 133 A 103 LEU HBy A 104 GLN HBy 1.0 . 5.13 183 134 A 48 GLU HA A 49 LEU HBy 1.0 . 5.50 184 135 A 49 LEU HBx A 90 ARG HGx 1.0 . 4.92 185 136 A 102 GLU HA A 103 LEU HBx 1.0 . 4.86 186 136 A 103 LEU HBy A 102 GLU HA 1.0 . 4.86 187 137 A 103 LEU HBy A 104 GLN HGx 1.0 . 4.74 188 137 A 103 LEU HBx A 104 GLN HGx 1.0 . 4.74 189 137 A 104 GLN HGy A 103 LEU HBx 1.0 . 4.74 190 137 A 103 LEU HBy A 104 GLN HGy 1.0 . 4.74 191 138 A 103 LEU HBx A 103 LEU HDx% 1.0 . 3.33 192 138 A 103 LEU HBy A 103 LEU HDx% 1.0 . 3.33 193 138 A 103 LEU HDy% A 103 LEU HBx 1.0 . 3.33 194 138 A 103 LEU HDy% A 103 LEU HBy 1.0 . 3.33 195 139 A 49 LEU HBy A 35 ALA HA 1.0 . 5.06 196 140 A 49 LEU HBy A 49 LEU HDy% 1.0 . 3.71 197 141 A 49 LEU HBx A 50 PHE H 1.0 . 4.32 198 142 A 90 ARG HBy A 49 LEU HBx 1.0 . 4.81 199 143 A 49 LEU HBx A 92 PHE HE% 1.0 . 5.30 200 144 A 49 LEU HBx A 49 LEU HDy% 1.0 . 3.77 201 145 A 23 VAL H A 31 PHE HBy 1.0 . 4.92 202 146 A 31 PHE HBy A 31 PHE H 1.0 . 3.85 203 147 A 31 PHE HBy A 23 VAL HB 1.0 . 4.05 204 148 A 32 ASP H A 31 PHE HBy 1.0 . 4.18 205 149 A 31 PHE HBy A 55 PRO HA 1.0 . 4.85 206 150 A 44 LEU HDy% A 41 LYS HEx 1.0 . 5.50 207 150 A 44 LEU HDy% A 41 LYS HEy 1.0 . 5.50 208 151 A 41 LYS HA A 41 LYS HEx 1.0 . 4.86 209 151 A 41 LYS HEy A 41 LYS HA 1.0 . 4.86 210 152 A 41 LYS HDx A 41 LYS HEx 1.0 . 2.90 211 152 A 41 LYS HDy A 41 LYS HEx 1.0 . 2.90 212 152 A 41 LYS HEy A 41 LYS HDx 1.0 . 2.90 213 152 A 41 LYS HEy A 41 LYS HDy 1.0 . 2.90 214 153 A 41 LYS HGx A 41 LYS HEx 1.0 . 3.67 215 153 A 41 LYS HEy A 41 LYS HGx 1.0 . 3.67 216 154 A 55 PRO HBx A 31 PHE HBx 1.0 . 5.17 217 155 A 32 ASP H A 31 PHE HBx 1.0 . 4.65 218 156 A 31 PHE HBx A 25 LEU HDx% 1.0 . 4.01 219 157 A 55 PRO HBy A 31 PHE HBy 1.0 . 4.42 220 158 A 18 LYS HGx A 18 LYS HEy 1.0 . 4.01 221 159 A 18 LYS HGx A 18 LYS HEx 1.0 . 4.01 222 160 A 60 LEU HBy A 61 SER H 1.0 . 4.56 223 161 A 60 LEU HBy A 86 LEU HDx% 1.0 . 4.31 224 162 A 60 LEU HBy A 59 THR H 1.0 . 5.06 225 163 A 26 GLY HAx A 25 LEU HBx 1.0 . 5.07 226 164 A 59 THR HG2% A 25 LEU HBx 1.0 . 5.50 227 165 A 75 ALA HA A 76 LEU HBy 1.0 . 5.11 228 166 A 76 LEU HBy A 103 LEU H 1.0 . 4.90 229 167 A 26 GLY HAx A 25 LEU HBy 1.0 . 5.16 230 168 A 25 LEU HBy A 25 LEU HDx% 1.0 . 3.85 231 169 A 25 LEU HBy A 30 SER HA 1.0 . 4.63 232 170 A 25 LEU HBx A 30 SER HA 1.0 . 5.10 233 171 A 25 LEU HBx A 25 LEU HDx% 1.0 . 3.94 234 172 A 25 LEU H A 25 LEU HBx 1.0 . 4.14 235 173 A 25 LEU HDy% A 25 LEU HBx 1.0 . 4.24 236 174 A 76 LEU HBy A 104 GLN HBx 1.0 . 4.88 237 175 A 76 LEU H A 76 LEU HBy 1.0 . 3.64 238 176 A 75 ALA HA A 76 LEU HBx 1.0 . 5.02 239 177 A 76 LEU HBx A 104 GLN HGx 1.0 . 5.37 240 177 A 104 GLN HGy A 76 LEU HBx 1.0 . 5.37 241 178 A 34 THR H A 50 PHE HBx 1.0 . 4.74 242 178 A 34 THR H A 50 PHE HBy 1.0 . 4.74 243 179 A 50 PHE H A 50 PHE HBx 1.0 . 3.19 244 179 A 50 PHE H A 50 PHE HBy 1.0 . 3.19 245 180 A 35 ALA HA A 50 PHE HBx 1.0 . 4.17 246 180 A 35 ALA HA A 50 PHE HBy 1.0 . 4.17 247 181 A 49 LEU HA A 50 PHE HBx 1.0 . 4.63 248 181 A 50 PHE HBy A 49 LEU HA 1.0 . 4.63 249 182 A 34 THR HB A 50 PHE HBx 1.0 . 4.21 250 182 A 50 PHE HBy A 34 THR HB 1.0 . 4.21 251 183 A 51 GLY HAx A 50 PHE HBx 1.0 . 4.96 252 183 A 50 PHE HBy A 51 GLY HAx 1.0 . 4.96 253 184 A 13 PHE HBy A 14 GLU H 1.0 . 3.65 254 185 A 76 LEU HBy A 71 TRP HE3 1.0 . 5.17 255 186 A 13 PHE HBy A 40 LEU HDx% 1.0 . 5.48 256 187 A 13 PHE H A 12 TYR HBy 1.0 . 4.22 257 188 A 12 TYR H A 12 TYR HBy 1.0 . 3.88 258 189 A 12 TYR HBy A 70 VAL HGy% 1.0 . 5.50 259 190 A 70 VAL HGy% A 12 TYR HBx 1.0 . 5.49 260 191 A 12 TYR H A 12 TYR HBx 1.0 . 4.05 261 192 A 12 TYR HBx A 100 VAL HGx% 1.0 . 5.34 262 193 A 27 ASP HBy A 28 THR HG2% 1.0 . 5.09 263 194 A 28 THR HG2% A 27 ASP HBx 1.0 . 5.28 264 195 A 12 TYR HBy A 100 VAL HGy% 1.0 . 5.44 265 196 A 27 ASP HBy A 28 THR H 1.0 . 4.90 266 197 A 54 GLN HE2x A 89 ASP HBy 1.0 . 5.17 267 198 A 89 ASP HBy A 90 ARG HGy 1.0 . 5.50 268 199 A 86 LEU HDx% A 88 ASP HBy 1.0 . 5.50 269 200 A 87 ARG HGx A 88 ASP HBx 1.0 . 5.20 270 201 A 88 ASP HBx A 89 ASP H 1.0 . 3.43 271 202 A 90 ARG H A 88 ASP HBx 1.0 . 4.75 272 203 A 89 ASP HBy A 89 ASP H 1.0 . 3.70 273 204 A 54 GLN HE2x A 89 ASP HBx 1.0 . 5.05 274 205 A 90 ARG HGy A 89 ASP HBx 1.0 . 5.23 275 206 A 90 ARG H A 89 ASP HBx 1.0 . 4.57 276 207 A 92 PHE HBy A 86 LEU HA 1.0 . 3.79 277 208 A 92 PHE HBy A 86 LEU HDx% 1.0 . 4.77 278 209 A 109 PHE H A 109 PHE HBy 1.0 . 4.04 279 210 A 87 ARG H A 92 PHE HBx 1.0 . 3.52 280 211 A 86 LEU HA A 92 PHE HBx 1.0 . 3.73 281 212 A 92 PHE HBx A 86 LEU HG 1.0 . 5.11 282 213 A 90 ARG HA A 89 ASP HBx 1.0 . 4.97 283 214 A 95 ARG H A 94 ILE HB 1.0 . 3.66 284 215 A 94 ILE HB A 94 ILE HD1% 1.0 . 3.53 285 216 A 94 ILE H A 94 ILE HB 1.0 . 3.76 286 217 A 94 ILE HB A 82 ARG H 1.0 . 4.56 287 218 A 95 ARG HA A 96 LEU HBx 1.0 . 4.70 288 218 A 95 ARG HA A 96 LEU HBy 1.0 . 4.70 289 219 A 97 VAL H A 96 LEU HBx 1.0 . 4.31 290 219 A 97 VAL H A 96 LEU HBy 1.0 . 4.31 291 220 A 94 ILE HB A 83 VAL HA 1.0 . 4.58 292 221 A 9 TYR HBy A 96 LEU HBx 1.0 . 5.14 293 221 A 96 LEU HBy A 9 TYR HBy 1.0 . 5.14 294 222 A 20 ASN HBy A 69 SER HBx 1.0 . 3.92 295 222 A 20 ASN HBy A 69 SER HBy 1.0 . 3.92 296 223 A 20 ASN HBy A 20 ASN H 1.0 . 3.43 297 224 A 20 ASN HBy A 19 VAL HB 1.0 . 5.16 298 225 A 109 PHE H A 108 TYR HBy 1.0 . 4.81 299 226 A 100 VAL HGy% A 9 TYR HBy 1.0 . 5.50 300 227 A 59 THR H A 58 ASN HBy 1.0 . 5.24 301 228 A 59 THR H A 58 ASN HBx 1.0 . 4.82 302 229 A 17 GLN H A 37 ILE HB 1.0 . 3.82 303 230 A 36 ALA HA A 37 ILE HB 1.0 . 4.66 304 231 A 62 GLU HGy A 61 SER HBx 1.0 . 5.46 305 232 A 14 GLU HA A 14 GLU HGx 1.0 . 4.19 306 232 A 14 GLU HA A 14 GLU HGy 1.0 . 4.19 307 233 A 37 ILE HB A 16 LEU H 1.0 . 4.04 308 234 A 86 LEU HBx A 62 GLU HGy 1.0 . 4.49 309 235 A 86 LEU H A 62 GLU HGy 1.0 . 4.68 310 236 A 62 GLU HGy A 62 GLU HA 1.0 . 3.83 311 237 A 62 GLU HGy A 83 VAL HGy% 1.0 . 4.51 312 238 A 62 GLU HGx A 62 GLU HA 1.0 . 3.83 313 239 A 62 GLU HGx A 62 GLU H 1.0 . 3.74 314 240 A 62 GLU HGx A 61 SER HBx 1.0 . 4.99 315 241 A 86 LEU H A 62 GLU HGx 1.0 . 4.34 316 242 A 62 GLU HGx A 63 GLY H 1.0 . 4.78 317 243 A 84 GLU HGx A 93 ALA HB% 1.0 . 5.44 318 244 A 65 GLU HGy A 24 ARG HDx 1.0 . 5.13 319 244 A 24 ARG HDy A 65 GLU HGy 1.0 . 5.13 320 245 A 65 GLU H A 65 GLU HGy 1.0 . 3.66 321 246 A 65 GLU HGy A 64 ALA HA 1.0 . 4.77 322 247 A 65 GLU HA A 65 GLU HGy 1.0 . 3.97 323 248 A 64 ALA HA A 65 GLU HGx 1.0 . 4.97 324 249 A 65 GLU H A 65 GLU HGx 1.0 . 3.83 325 250 A 65 GLU HA A 65 GLU HGx 1.0 . 3.96 326 251 A 65 GLU HGx A 24 ARG HDx 1.0 . 4.92 327 251 A 24 ARG HDy A 65 GLU HGx 1.0 . 4.92 328 252 A 65 GLU HGx A 64 ALA HB% 1.0 . 5.50 329 253 A 65 GLU HGx A 66 VAL H 1.0 . 4.64 330 254 A 62 GLU HGy A 62 GLU HBx 1.0 . 2.99 331 254 A 62 GLU HBy A 62 GLU HGy 1.0 . 2.99 332 255 A 44 LEU HDx% A 84 GLU HGy 1.0 . 5.12 333 256 A 84 GLU HGy A 85 THR H 1.0 . 4.92 334 257 A 62 GLU HGx A 62 GLU HBx 1.0 . 2.96 335 257 A 62 GLU HBy A 62 GLU HGx 1.0 . 2.96 336 258 A 84 GLU HGx A 84 GLU HA 1.0 . 3.64 337 259 A 44 LEU HDx% A 84 GLU HGx 1.0 . 5.15 338 260 A 52 ALA HB% A 53 GLU HGy 1.0 . 5.47 339 261 A 53 GLU HGy A 53 GLU HBx 1.0 . 2.75 340 261 A 53 GLU HGy A 53 GLU HBy 1.0 . 2.75 341 262 A 53 GLU H A 53 GLU HGy 1.0 . 4.17 342 263 A 53 GLU HGy A 53 GLU HA 1.0 . 3.79 343 264 A 53 GLU HGy A 54 GLN H 1.0 . 4.76 344 265 A 53 GLU HGx A 53 GLU HBx 1.0 . 2.86 345 265 A 53 GLU HBy A 53 GLU HGx 1.0 . 2.86 346 266 A 54 GLN H A 53 GLU HGx 1.0 . 4.78 347 267 A 53 GLU HA A 53 GLU HGx 1.0 . 3.89 348 268 A 48 GLU H A 48 GLU HGx 1.0 . 5.08 349 269 A 48 GLU HA A 48 GLU HGy 1.0 . 4.13 350 270 A 102 GLU HA A 102 GLU HGx 1.0 . 3.67 351 270 A 102 GLU HA A 102 GLU HGy 1.0 . 3.67 352 271 A 102 GLU H A 102 GLU HGx 1.0 . 3.88 353 271 A 102 GLU HGy A 102 GLU H 1.0 . 3.88 354 272 A 100 VAL HGx% A 102 GLU HGx 1.0 . 5.08 355 272 A 100 VAL HGx% A 102 GLU HGy 1.0 . 5.08 356 273 A 48 GLU HGx A 49 LEU H 1.0 . 4.84 357 274 A 107 GLU HGy A 108 TYR H 1.0 . 5.50 358 275 A 102 GLU HBy A 102 GLU HGx 1.0 . 2.84 359 275 A 102 GLU HGy A 102 GLU HBy 1.0 . 2.84 360 276 A 107 GLU HGy A 107 GLU HA 1.0 . 4.12 361 277 A 107 GLU HGy A 107 GLU H 1.0 . 4.94 362 278 A 8 GLU HGx A 11 ARG HDx 1.0 . 4.99 363 278 A 8 GLU HGy A 11 ARG HDx 1.0 . 4.99 364 278 A 11 ARG HDy A 8 GLU HGx 1.0 . 4.99 365 278 A 11 ARG HDy A 8 GLU HGy 1.0 . 4.99 366 279 A 13 PHE HD% A 70 VAL HB 1.0 . 4.87 367 280 A 70 VAL HB A 19 VAL HA 1.0 . 4.30 368 281 A 70 VAL HB A 19 VAL HGx% 1.0 . 3.71 369 282 A 8 GLU HBx A 8 GLU HGx 1.0 . 2.84 370 282 A 8 GLU HGy A 8 GLU HBx 1.0 . 2.84 371 283 A 70 VAL HB A 71 TRP H 1.0 . 3.95 372 284 A 70 VAL HB A 76 LEU HDx% 1.0 . 5.50 373 285 A 70 VAL HB A 69 SER HA 1.0 . 5.06 374 286 A 9 TYR H A 8 GLU HGx 1.0 . 4.84 375 286 A 9 TYR H A 8 GLU HGy 1.0 . 4.84 376 287 A 64 ALA HB% A 66 VAL HB 1.0 . 5.50 377 288 A 66 VAL HB A 67 SER H 1.0 . 3.15 378 289 A 66 VAL HB A 23 VAL HA 1.0 . 4.41 379 290 A 66 VAL HB A 67 SER HA 1.0 . 4.91 380 291 A 97 VAL HB A 98 GLY H 1.0 . 3.58 381 292 A 97 VAL H A 97 VAL HB 1.0 . 3.73 382 293 A 81 GLY HAy A 97 VAL HB 1.0 . 4.90 383 294 A 91 GLN HGy A 48 GLU HBx 1.0 . 4.17 384 294 A 48 GLU HBy A 91 GLN HGy 1.0 . 4.17 385 295 A 90 ARG H A 91 GLN HGy 1.0 . 5.40 386 296 A 88 ASP H A 91 GLN HGx 1.0 . 5.30 387 297 A 48 GLU HA A 91 GLN HGx 1.0 . 4.45 388 298 A 91 GLN HGx A 91 GLN HA 1.0 . 3.87 389 299 A 23 VAL HB A 25 LEU HG 1.0 . 5.32 390 300 A 79 CYS HA A 78 ARG HBx 1.0 . 4.72 391 300 A 79 CYS HA A 78 ARG HBy 1.0 . 4.72 392 301 A 78 ARG HBy A 103 LEU HDx% 1.0 . 4.08 393 301 A 78 ARG HBx A 103 LEU HDx% 1.0 . 4.08 394 301 A 103 LEU HDy% A 78 ARG HBx 1.0 . 4.08 395 301 A 103 LEU HDy% A 78 ARG HBy 1.0 . 4.08 396 302 A 79 CYS H A 78 ARG HBx 1.0 . 4.26 397 302 A 79 CYS H A 78 ARG HBy 1.0 . 4.26 398 303 A 91 GLN HGy A 91 GLN HA 1.0 . 4.15 399 304 A 48 GLU HA A 91 GLN HGy 1.0 . 4.87 400 305 A 91 GLN HGy A 91 GLN HE2y 1.0 . 3.77 401 306 A 24 ARG H A 23 VAL HB 1.0 . 4.80 402 307 A 23 VAL HB A 31 PHE HBx 1.0 . 3.66 403 308 A 31 PHE HA A 23 VAL HB 1.0 . 5.12 404 309 A 19 VAL HB A 68 VAL HA 1.0 . 4.45 405 310 A 19 VAL HB A 68 VAL HB 1.0 . 4.38 406 311 A 20 ASN H A 19 VAL HB 1.0 . 3.18 407 312 A 70 VAL HGy% A 19 VAL HB 1.0 . 4.73 408 313 A 68 VAL HB A 69 SER H 1.0 . 3.82 409 314 A 68 VAL HB A 68 VAL H 1.0 . 3.61 410 315 A 68 VAL HB A 79 CYS HBy 1.0 . 4.60 411 316 A 69 SER HA A 68 VAL HB 1.0 . 4.92 412 317 A 79 CYS H A 68 VAL HB 1.0 . 4.36 413 318 A 13 PHE HA A 17 GLN HGy 1.0 . 5.36 414 319 A 17 GLN HGy A 70 VAL HGx% 1.0 . 4.68 415 320 A 70 VAL HGy% A 17 GLN HGx 1.0 . 5.43 416 321 A 16 LEU HA A 15 GLN HGx 1.0 . 4.80 417 321 A 15 GLN HGy A 16 LEU HA 1.0 . 4.80 418 322 A 16 LEU H A 15 GLN HGx 1.0 . 4.07 419 322 A 16 LEU H A 15 GLN HGy 1.0 . 4.07 420 323 A 63 GLY H A 82 ARG HBx 1.0 . 5.05 421 323 A 82 ARG HBy A 63 GLY H 1.0 . 5.05 422 324 A 81 GLY HAx A 82 ARG HBx 1.0 . 5.04 423 324 A 81 GLY HAx A 82 ARG HBy 1.0 . 5.04 424 325 A 66 VAL HGy% A 82 ARG HBx 1.0 . 5.50 425 325 A 66 VAL HGy% A 82 ARG HBy 1.0 . 5.50 426 326 A 83 VAL HGx% A 82 ARG HBx 1.0 . 4.59 427 326 A 82 ARG HBy A 83 VAL HGx% 1.0 . 4.59 428 327 A 83 VAL H A 82 ARG HBx 1.0 . 3.65 429 327 A 82 ARG HBy A 83 VAL H 1.0 . 3.65 430 328 A 63 GLY HAx A 82 ARG HBx 1.0 . 4.20 431 328 A 82 ARG HBy A 63 GLY HAx 1.0 . 4.20 432 329 A 65 GLU HA A 82 ARG HBx 1.0 . 4.11 433 329 A 82 ARG HBy A 65 GLU HA 1.0 . 4.11 434 330 A 83 VAL HB A 82 ARG HBx 1.0 . 4.95 435 330 A 82 ARG HBy A 83 VAL HB 1.0 . 4.95 436 331 A 17 GLN HGy A 18 LYS H 1.0 . 4.08 437 332 A 17 GLN H A 17 GLN HGy 1.0 . 4.04 438 333 A 17 GLN HGx A 18 LYS H 1.0 . 4.10 439 334 A 17 GLN HGx A 17 GLN HE2y 1.0 . 3.76 440 335 A 17 GLN HGx A 17 GLN HA 1.0 . 3.95 441 336 A 15 GLN HE2y A 15 GLN HGx 1.0 . 3.70 442 336 A 15 GLN HGy A 15 GLN HE2y 1.0 . 3.70 443 337 A 16 LEU HG A 15 GLN HGx 1.0 . 3.77 444 337 A 15 GLN HGy A 16 LEU HG 1.0 . 3.77 445 338 A 37 ILE HG2% A 15 GLN HGx 1.0 . 4.80 446 338 A 15 GLN HGy A 37 ILE HG2% 1.0 . 4.80 447 339 A 15 GLN H A 15 GLN HGx 1.0 . 4.02 448 339 A 15 GLN HGy A 15 GLN H 1.0 . 4.02 449 340 A 64 ALA H A 82 ARG HBx 1.0 . 5.12 450 340 A 82 ARG HBy A 64 ALA H 1.0 . 5.12 451 341 A 64 ALA HA A 82 ARG HBx 1.0 . 5.09 452 341 A 82 ARG HBy A 64 ALA HA 1.0 . 5.09 453 342 A 104 GLN H A 104 GLN HGx 1.0 . 3.98 454 342 A 104 GLN HGy A 104 GLN H 1.0 . 3.98 455 343 A 104 GLN HA A 104 GLN HGx 1.0 . 3.49 456 343 A 104 GLN HGy A 104 GLN HA 1.0 . 3.49 457 344 A 104 GLN HBy A 104 GLN HGx 1.0 . 2.64 458 344 A 104 GLN HBy A 104 GLN HGy 1.0 . 2.64 459 345 A 104 GLN HBx A 104 GLN HGx 1.0 . 2.94 460 345 A 104 GLN HGy A 104 GLN HBx 1.0 . 2.94 461 346 A 76 LEU HBy A 104 GLN HGx 1.0 . 4.70 462 346 A 104 GLN HGy A 76 LEU HBy 1.0 . 4.70 463 347 A 44 LEU HDy% A 41 LYS HBy 1.0 . 4.85 464 348 A 41 LYS H A 41 LYS HBy 1.0 . 3.70 465 349 A 40 LEU HA A 41 LYS HBy 1.0 . 5.27 466 350 A 13 PHE HA A 14 GLU HBy 1.0 . 5.02 467 351 A 15 GLN H A 14 GLU HBy 1.0 . 3.85 468 352 A 14 GLU H A 14 GLU HBy 1.0 . 3.95 469 353 A 14 GLU H A 14 GLU HBx 1.0 . 3.82 470 354 A 54 GLN H A 54 GLN HGx 1.0 . 3.51 471 354 A 54 GLN H A 54 GLN HGy 1.0 . 3.51 472 355 A 54 GLN HE2y A 54 GLN HGx 1.0 . 3.48 473 355 A 54 GLN HGy A 54 GLN HE2y 1.0 . 3.48 474 356 A 54 GLN HA A 54 GLN HGx 1.0 . 3.69 475 356 A 54 GLN HGy A 54 GLN HA 1.0 . 3.69 476 357 A 53 GLU HA A 54 GLN HGx 1.0 . 4.72 477 357 A 53 GLU HA A 54 GLN HGy 1.0 . 4.72 478 358 A 49 LEU HDy% A 54 GLN HGx 1.0 . 4.70 479 358 A 49 LEU HDy% A 54 GLN HGy 1.0 . 4.70 480 359 A 55 PRO HDy A 54 GLN HGx 1.0 . 4.36 481 359 A 55 PRO HDy A 54 GLN HGy 1.0 . 4.36 482 360 A 55 PRO HDx A 54 GLN HGx 1.0 . 4.71 483 360 A 55 PRO HDx A 54 GLN HGy 1.0 . 4.71 484 361 A 54 GLN HBy A 54 GLN HGx 1.0 . 3.01 485 361 A 54 GLN HGy A 54 GLN HBy 1.0 . 3.01 486 362 A 36 ALA H A 48 GLU HBx 1.0 . 4.82 487 362 A 36 ALA H A 48 GLU HBy 1.0 . 4.82 488 363 A 87 ARG HDx A 91 GLN HBy 1.0 . 5.24 489 364 A 46 TRP HE3 A 91 GLN HBx 1.0 . 5.32 490 365 A 91 GLN HBx A 91 GLN H 1.0 . 4.01 491 366 A 49 LEU H A 48 GLU HBx 1.0 . 4.40 492 366 A 49 LEU H A 48 GLU HBy 1.0 . 4.40 493 367 A 18 LYS HBy A 50 PHE HE% 1.0 . 4.75 494 368 A 18 LYS HBx A 50 PHE HE% 1.0 . 4.58 495 369 A 88 ASP H A 91 GLN HBy 1.0 . 4.72 496 370 A 91 GLN HBy A 91 GLN H 1.0 . 3.71 497 371 A 18 LYS HBx A 19 VAL H 1.0 . 4.29 498 372 A 18 LYS HBx A 18 LYS H 1.0 . 3.60 499 373 A 90 ARG H A 90 ARG HBy 1.0 . 4.14 500 374 A 91 GLN HBy A 91 GLN HE2x 1.0 . 5.21 501 375 A 90 ARG HBy A 49 LEU H 1.0 . 4.33 502 376 A 90 ARG HBx A 91 GLN H 1.0 . 4.92 503 377 A 85 THR H A 84 GLU HBy 1.0 . 4.29 504 378 A 84 GLU HBy A 84 GLU H 1.0 . 3.80 505 379 A 90 ARG HBy A 49 LEU HDy% 1.0 . 5.28 506 380 A 90 ARG HGx A 91 GLN HBx 1.0 . 4.51 507 381 A 95 ARG H A 84 GLU HBy 1.0 . 4.59 508 382 A 84 GLU H A 84 GLU HBx 1.0 . 3.69 509 383 A 84 GLU HBx A 94 ILE HA 1.0 . 4.59 510 384 A 83 VAL HGy% A 84 GLU HBx 1.0 . 5.50 511 385 A 100 VAL HGx% A 101 ARG HBx 1.0 . 5.50 512 385 A 100 VAL HGx% A 101 ARG HBy 1.0 . 5.50 513 386 A 87 ARG HBy A 85 THR HG2% 1.0 . 5.17 514 387 A 101 ARG HBy A 103 LEU HDx% 1.0 . 4.16 515 387 A 101 ARG HBx A 103 LEU HDx% 1.0 . 4.16 516 387 A 103 LEU HDy% A 101 ARG HBx 1.0 . 4.16 517 387 A 103 LEU HDy% A 101 ARG HBy 1.0 . 4.16 518 388 A 79 CYS HBy A 100 VAL HA 1.0 . 4.52 519 389 A 56 PRO HA A 57 PRO HBy 1.0 . 4.90 520 390 A 57 PRO HBy A 58 ASN H 1.0 . 4.28 521 391 A 57 PRO HBy A 58 ASN HBy 1.0 . 5.50 522 392 A 46 TRP HH2 A 87 ARG HBy 1.0 . 4.53 523 393 A 88 ASP H A 87 ARG HBx 1.0 . 4.05 524 394 A 46 TRP HZ3 A 87 ARG HBx 1.0 . 4.54 525 395 A 87 ARG H A 87 ARG HBx 1.0 . 3.88 526 396 A 57 PRO HBx A 58 ASN HBy 1.0 . 4.81 527 397 A 58 ASN H A 57 PRO HBx 1.0 . 4.49 528 398 A 100 VAL HA A 101 ARG HBx 1.0 . 5.00 529 398 A 101 ARG HBy A 100 VAL HA 1.0 . 5.00 530 399 A 79 CYS HBx A 96 LEU HDx% 1.0 . 5.01 531 400 A 70 VAL HGx% A 17 GLN HBy 1.0 . 5.38 532 401 A 17 GLN HE2y A 17 GLN HBy 1.0 . 5.10 533 402 A 18 LYS H A 17 GLN HBx 1.0 . 4.22 534 403 A 70 VAL HGx% A 17 GLN HBx 1.0 . 5.43 535 404 A 17 GLN HBx A 37 ILE HD1% 1.0 . 4.18 536 405 A 105 ARG HBy A 75 ALA HB% 1.0 . 5.50 537 406 A 99 ARG HA A 100 VAL HB 1.0 . 4.91 538 407 A 99 ARG HBy A 99 ARG H 1.0 . 3.93 539 408 A 12 TYR HD% A 100 VAL HB 1.0 . 4.52 540 409 A 108 TYR H A 106 ARG HBx 1.0 . 5.16 541 409 A 106 ARG HBy A 108 TYR H 1.0 . 5.16 542 410 A 107 GLU H A 106 ARG HBx 1.0 . 4.52 543 410 A 106 ARG HBy A 107 GLU H 1.0 . 4.52 544 411 A 63 GLY H A 83 VAL HB 1.0 . 3.66 545 412 A 82 ARG HA A 83 VAL HB 1.0 . 4.91 546 413 A 104 GLN HBy A 76 LEU HBx 1.0 . 5.00 547 414 A 65 GLU HBy A 24 ARG HDx 1.0 . 5.32 548 414 A 24 ARG HDy A 65 GLU HBy 1.0 . 5.32 549 415 A 65 GLU H A 65 GLU HBy 1.0 . 3.61 550 416 A 104 GLN HBx A 76 LEU HBx 1.0 . 5.07 551 417 A 107 GLU H A 107 GLU HBy 1.0 . 4.14 552 418 A 85 THR H A 85 THR HB 1.0 . 4.12 553 419 A 46 TRP HH2 A 85 THR HB 1.0 . 5.22 554 420 A 93 ALA HB% A 85 THR HB 1.0 . 4.00 555 421 A 85 THR HB A 93 ALA H 1.0 . 4.58 556 422 A 85 THR HB A 46 TRP HZ2 1.0 . 5.06 557 423 A 104 GLN HBy A 76 LEU HBy 1.0 . 4.67 558 424 A 24 ARG HBy A 26 GLY H 1.0 . 4.87 559 425 A 102 GLU HBx A 103 LEU HDx% 1.0 . 5.43 560 425 A 103 LEU HDy% A 102 GLU HBx 1.0 . 5.43 561 426 A 34 THR HB A 50 PHE HE% 1.0 . 4.58 562 427 A 67 SER HBx A 22 THR HB 1.0 . 4.39 563 428 A 104 GLN HBy A 105 ARG HA 1.0 . 5.50 564 429 A 25 LEU H A 24 ARG HBy 1.0 . 4.34 565 430 A 23 VAL HGx% A 24 ARG HBx 1.0 . 5.50 566 431 A 103 LEU H A 102 GLU HBy 1.0 . 4.68 567 432 A 75 ALA HB% A 102 GLU HBy 1.0 . 4.75 568 433 A 104 GLN H A 102 GLU HBx 1.0 . 5.01 569 434 A 95 ARG HBy A 97 VAL HGx% 1.0 . 5.50 570 435 A 44 LEU HDx% A 95 ARG HBy 1.0 . 5.11 571 436 A 103 LEU H A 102 GLU HBx 1.0 . 4.50 572 437 A 24 ARG HBx A 24 ARG HDx 1.0 . 4.04 573 437 A 24 ARG HDy A 24 ARG HBx 1.0 . 4.04 574 438 A 24 ARG H A 24 ARG HBx 1.0 . 3.34 575 439 A 75 ALA HB% A 102 GLU HBx 1.0 . 5.32 576 440 A 95 ARG H A 95 ARG HBx 1.0 . 4.04 577 441 A 54 GLN HE2y A 54 GLN HBx 1.0 . 5.09 578 442 A 97 VAL HGx% A 95 ARG HBx 1.0 . 5.50 579 443 A 44 LEU HDx% A 95 ARG HBx 1.0 . 5.22 580 444 A 56 PRO HBy A 57 PRO HDx 1.0 . 3.86 581 445 A 59 THR HG2% A 56 PRO HBy 1.0 . 4.61 582 446 A 54 GLN H A 53 GLU HBx 1.0 . 4.07 583 446 A 53 GLU HBy A 54 GLN H 1.0 . 4.07 584 447 A 53 GLU H A 53 GLU HBx 1.0 . 3.62 585 447 A 53 GLU H A 53 GLU HBy 1.0 . 3.62 586 448 A 54 GLN H A 54 GLN HBy 1.0 . 4.10 587 449 A 55 PRO HDy A 54 GLN HBy 1.0 . 3.81 588 450 A 55 PRO HDx A 54 GLN HBy 1.0 . 4.40 589 451 A 49 LEU HDy% A 54 GLN HBy 1.0 . 4.75 590 452 A 55 PRO HDy A 54 GLN HBx 1.0 . 3.81 591 453 A 55 PRO HDx A 54 GLN HBx 1.0 . 4.38 592 454 A 49 LEU HDy% A 54 GLN HBx 1.0 . 5.19 593 455 A 57 PRO HDx A 56 PRO HBx 1.0 . 4.13 594 456 A 54 GLN HE2y A 54 GLN HBy 1.0 . 5.07 595 457 A 11 ARG HBy A 11 ARG HDx 1.0 . 3.97 596 457 A 11 ARG HDy A 11 ARG HBy 1.0 . 3.97 597 458 A 11 ARG HBy A 11 ARG H 1.0 . 3.55 598 459 A 11 ARG HBx A 11 ARG HDx 1.0 . 4.00 599 459 A 11 ARG HDy A 11 ARG HBx 1.0 . 4.00 600 460 A 11 ARG HBx A 12 TYR HE% 1.0 . 5.22 601 461 A 38 THR H A 46 TRP HBy 1.0 . 5.07 602 462 A 46 TRP HBx A 47 LEU H 1.0 . 4.61 603 463 A 69 SER HA A 77 CYS HBy 1.0 . 5.50 604 464 A 12 TYR HD% A 77 CYS HBx 1.0 . 4.59 605 465 A 12 TYR HD% A 11 ARG HBx 1.0 . 4.74 606 466 A 55 PRO HBx A 56 PRO HGx 1.0 . 5.05 607 466 A 55 PRO HBx A 56 PRO HGy 1.0 . 5.05 608 467 A 55 PRO HBx A 25 LEU HDx% 1.0 . 5.06 609 468 A 59 THR HG2% A 55 PRO HBx 1.0 . 4.95 610 469 A 77 CYS HBy A 77 CYS H 1.0 . 3.45 611 470 A 70 VAL HGy% A 77 CYS HBy 1.0 . 4.07 612 471 A 77 CYS HBx A 77 CYS H 1.0 . 3.38 613 472 A 100 VAL HGx% A 77 CYS HBx 1.0 . 3.49 614 473 A 56 PRO HDy A 55 PRO HBy 1.0 . 4.02 615 474 A 55 PRO HBy A 60 LEU HDy% 1.0 . 5.30 616 475 A 55 PRO HBy A 54 GLN HA 1.0 . 5.06 617 476 A 55 PRO HBy A 60 LEU HDx% 1.0 . 5.45 618 477 A 55 PRO HBx A 60 LEU HDy% 1.0 . 5.41 619 478 A 25 LEU HDy% A 55 PRO HBx 1.0 . 5.26 620 479 A 31 PHE HD% A 55 PRO HBx 1.0 . 4.92 621 480 A 56 PRO HDy A 55 PRO HBx 1.0 . 4.12 622 481 A 55 PRO HBx A 60 LEU HDx% 1.0 . 5.47 623 482 A 8 GLU HBy A 11 ARG HDx 1.0 . 5.12 624 482 A 11 ARG HDy A 8 GLU HBy 1.0 . 5.12 625 483 A 41 LYS HA A 41 LYS HDx 1.0 . 4.31 626 483 A 41 LYS HA A 41 LYS HDy 1.0 . 4.31 627 484 A 41 LYS H A 41 LYS HDx 1.0 . 5.40 628 484 A 41 LYS H A 41 LYS HDy 1.0 . 5.40 629 485 A 36 ALA HA A 18 LYS HDx 1.0 . 4.66 630 485 A 36 ALA HA A 18 LYS HDy 1.0 . 4.66 631 486 A 18 LYS HA A 18 LYS HDx 1.0 . 4.05 632 486 A 18 LYS HA A 18 LYS HDy 1.0 . 4.05 633 487 A 18 LYS HBy A 18 LYS HDx 1.0 . 3.54 634 487 A 18 LYS HBy A 18 LYS HDy 1.0 . 3.54 635 488 A 18 LYS HGx A 18 LYS HDx 1.0 . 2.90 636 488 A 18 LYS HGx A 18 LYS HDy 1.0 . 2.90 637 489 A 44 LEU HDy% A 41 LYS HDx 1.0 . 5.50 638 489 A 44 LEU HDy% A 41 LYS HDy 1.0 . 5.50 639 490 A 71 TRP H A 71 TRP HBy 1.0 . 3.66 640 491 A 71 TRP HBx A 72 THR H 1.0 . 4.98 641 492 A 62 GLU HBy A 61 SER HBx 1.0 . 4.94 642 492 A 61 SER HBx A 62 GLU HBx 1.0 . 4.94 643 493 A 83 VAL HGy% A 62 GLU HBx 1.0 . 4.62 644 493 A 62 GLU HBy A 83 VAL HGy% 1.0 . 4.62 645 494 A 25 LEU HDx% A 59 THR HB 1.0 . 5.16 646 495 A 55 PRO HBx A 59 THR HB 1.0 . 4.63 647 496 A 56 PRO HBx A 59 THR HB 1.0 . 5.06 648 497 A 55 PRO HBy A 59 THR HB 1.0 . 4.91 649 498 A 59 THR HB A 56 PRO HGx 1.0 . 4.84 650 498 A 56 PRO HGy A 59 THR HB 1.0 . 4.84 651 499 A 15 GLN HE2y A 15 GLN HBx 1.0 . 4.73 652 499 A 15 GLN HE2y A 15 GLN HBy 1.0 . 4.73 653 500 A 16 LEU H A 15 GLN HBx 1.0 . 3.76 654 500 A 16 LEU H A 15 GLN HBy 1.0 . 3.76 655 501 A 40 LEU H A 15 GLN HBx 1.0 . 4.48 656 501 A 40 LEU H A 15 GLN HBy 1.0 . 4.48 657 502 A 15 GLN H A 15 GLN HBx 1.0 . 2.84 658 502 A 15 GLN H A 15 GLN HBy 1.0 . 2.84 659 503 A 17 GLN H A 15 GLN HBx 1.0 . 4.68 660 503 A 17 GLN H A 15 GLN HBy 1.0 . 4.68 661 504 A 14 GLU HA A 15 GLN HBx 1.0 . 4.21 662 504 A 14 GLU HA A 15 GLN HBy 1.0 . 4.21 663 505 A 15 GLN HBy A 15 GLN HGx 1.0 . 2.98 664 505 A 15 GLN HBx A 15 GLN HGx 1.0 . 2.98 665 505 A 15 GLN HGy A 15 GLN HBx 1.0 . 2.98 666 505 A 15 GLN HGy A 15 GLN HBy 1.0 . 2.98 667 506 A 16 LEU HG A 15 GLN HBx 1.0 . 4.02 668 506 A 16 LEU HG A 15 GLN HBy 1.0 . 4.02 669 507 A 16 LEU HDy% A 15 GLN HBx 1.0 . 4.34 670 507 A 15 GLN HBy A 16 LEU HDy% 1.0 . 4.34 671 508 A 49 LEU HDy% A 90 ARG HGy 1.0 . 4.75 672 509 A 54 GLN HE2x A 90 ARG HGy 1.0 . 5.47 673 510 A 90 ARG H A 90 ARG HGx 1.0 . 4.52 674 511 A 90 ARG HA A 90 ARG HGx 1.0 . 3.96 675 512 A 90 ARG HGx A 91 GLN HGx 1.0 . 4.22 676 513 A 38 THR HB A 39 SER H 1.0 . 4.06 677 514 A 16 LEU HA A 16 LEU HG 1.0 . 4.06 678 515 A 87 ARG HA A 86 LEU HG 1.0 . 4.70 679 516 A 47 LEU H A 47 LEU HG 1.0 . 4.03 680 517 A 37 ILE HG1x A 17 GLN HBy 1.0 . 5.10 681 518 A 38 THR H A 38 THR HB 1.0 . 3.98 682 519 A 46 TRP HBy A 38 THR HB 1.0 . 4.91 683 520 A 25 LEU HDy% A 56 PRO HGx 1.0 . 5.50 684 520 A 25 LEU HDy% A 56 PRO HGy 1.0 . 5.50 685 521 A 58 ASN H A 57 PRO HGy 1.0 . 5.45 686 521 A 58 ASN H A 57 PRO HGx 1.0 . 5.45 687 522 A 59 THR H A 56 PRO HGx 1.0 . 5.37 688 522 A 59 THR H A 56 PRO HGy 1.0 . 5.37 689 523 A 25 LEU HDx% A 56 PRO HGx 1.0 . 4.78 690 523 A 25 LEU HDx% A 56 PRO HGy 1.0 . 4.78 691 524 A 50 PHE H A 49 LEU HG 1.0 . 4.94 692 525 A 17 GLN H A 37 ILE HG1y 1.0 . 5.31 693 526 A 37 ILE HG1y A 47 LEU HA 1.0 . 4.73 694 527 A 92 PHE HBy A 86 LEU HG 1.0 . 4.47 695 528 A 86 LEU HG A 88 ASP HA 1.0 . 5.38 696 529 A 82 ARG HA A 82 ARG HGx 1.0 . 3.97 697 529 A 82 ARG HGy A 82 ARG HA 1.0 . 3.97 698 530 A 41 LYS H A 40 LEU HG 1.0 . 4.01 699 531 A 48 GLU HA A 49 LEU HG 1.0 . 4.93 700 532 A 25 LEU H A 24 ARG HGy 1.0 . 4.59 701 533 A 24 ARG HA A 24 ARG HGy 1.0 . 4.14 702 534 A 24 ARG H A 24 ARG HGy 1.0 . 4.21 703 535 A 88 ASP H A 87 ARG HGy 1.0 . 5.17 704 536 A 46 TRP HH2 A 87 ARG HGy 1.0 . 5.07 705 537 A 75 ALA HB% A 105 ARG HGx 1.0 . 3.72 706 538 A 103 LEU H A 103 LEU HG 1.0 . 3.82 707 539 A 78 ARG H A 78 ARG HGx 1.0 . 5.12 708 540 A 12 TYR HD% A 11 ARG HGy 1.0 . 5.50 709 541 A 11 ARG HA A 11 ARG HGy 1.0 . 4.08 710 542 A 11 ARG H A 11 ARG HGy 1.0 . 4.13 711 543 A 11 ARG H A 11 ARG HGx 1.0 . 4.19 712 544 A 12 TYR HD% A 11 ARG HGx 1.0 . 5.27 713 545 A 87 ARG H A 87 ARG HGy 1.0 . 5.22 714 546 A 87 ARG HA A 87 ARG HGy 1.0 . 3.89 715 547 A 87 ARG HA A 87 ARG HGx 1.0 . 3.53 716 548 A 46 TRP HH2 A 87 ARG HGx 1.0 . 5.43 717 549 A 101 ARG H A 101 ARG HGx 1.0 . 4.06 718 549 A 101 ARG H A 101 ARG HGy 1.0 . 4.06 719 550 A 101 ARG HA A 101 ARG HGx 1.0 . 4.13 720 550 A 101 ARG HGy A 101 ARG HA 1.0 . 4.13 721 551 A 78 ARG HA A 78 ARG HGy 1.0 . 4.11 722 552 A 78 ARG HGy A 69 SER HBx 1.0 . 5.29 723 552 A 69 SER HBy A 78 ARG HGy 1.0 . 5.29 724 553 A 103 LEU HG A 76 LEU HDy% 1.0 . 5.50 725 554 A 78 ARG HGx A 69 SER HBx 1.0 . 4.67 726 554 A 69 SER HBy A 78 ARG HGx 1.0 . 4.67 727 555 A 79 CYS H A 78 ARG HGx 1.0 . 4.37 728 556 A 76 LEU HG A 69 SER HBx 1.0 . 4.51 729 556 A 69 SER HBy A 76 LEU HG 1.0 . 4.51 730 557 A 76 LEU H A 76 LEU HG 1.0 . 4.94 731 558 A 100 VAL H A 99 ARG HGx 1.0 . 4.22 732 558 A 100 VAL H A 99 ARG HGy 1.0 . 4.22 733 559 A 78 ARG H A 78 ARG HGy 1.0 . 4.61 734 560 A 106 ARG HBy A 106 ARG HGx 1.0 . 2.71 735 560 A 106 ARG HBx A 106 ARG HGx 1.0 . 2.71 736 560 A 106 ARG HGy A 106 ARG HBx 1.0 . 2.71 737 560 A 106 ARG HBy A 106 ARG HGy 1.0 . 2.71 738 561 A 44 LEU H A 44 LEU HG 1.0 . 5.28 739 562 A 44 LEU HG A 44 LEU HA 1.0 . 4.22 740 563 A 45 ALA H A 44 LEU HG 1.0 . 4.38 741 564 A 77 CYS H A 76 LEU HG 1.0 . 4.46 742 565 A 76 LEU HG A 78 ARG HBx 1.0 . 4.23 743 565 A 78 ARG HBy A 76 LEU HG 1.0 . 4.23 744 566 A 21 LEU HG A 35 ALA H 1.0 . 5.20 745 567 A 21 LEU H A 21 LEU HG 1.0 . 3.71 746 568 A 21 LEU HBx A 21 LEU HG 1.0 . 2.74 747 569 A 31 PHE H A 25 LEU HG 1.0 . 4.70 748 570 A 60 LEU H A 60 LEU HG 1.0 . 3.73 749 571 A 33 GLY H A 21 LEU HG 1.0 . 3.95 750 572 A 21 LEU HG A 20 ASN HD2y 1.0 . 4.78 751 573 A 93 ALA HB% A 47 LEU HDx% 1.0 . 5.50 752 574 A 31 PHE HE% A 55 PRO HGy 1.0 . 5.31 753 575 A 25 LEU H A 25 LEU HG 1.0 . 4.06 754 576 A 59 THR HB A 60 LEU HG 1.0 . 4.79 755 577 A 94 ILE H A 47 LEU HDx% 1.0 . 4.47 756 578 A 93 ALA HA A 47 LEU HDx% 1.0 . 4.55 757 579 A 47 LEU HBy A 47 LEU HDx% 1.0 . 2.97 758 580 A 47 LEU H A 47 LEU HDx% 1.0 . 4.13 759 581 A 46 TRP H A 47 LEU HDx% 1.0 . 5.24 760 582 A 48 GLU H A 47 LEU HDx% 1.0 . 5.42 761 583 A 47 LEU HA A 47 LEU HDx% 1.0 . 4.19 762 584 A 47 LEU HDx% A 37 ILE HA 1.0 . 4.76 763 585 A 35 ALA HB% A 47 LEU HDx% 1.0 . 3.67 764 586 A 96 LEU HDx% A 94 ILE HG1y 1.0 . 5.50 765 587 A 37 ILE HG1y A 47 LEU HDx% 1.0 . 5.50 766 588 A 92 PHE HE% A 94 ILE HG1y 1.0 . 5.19 767 589 A 93 ALA HA A 94 ILE HG1y 1.0 . 4.58 768 590 A 94 ILE H A 94 ILE HG1y 1.0 . 4.00 769 591 A 45 ALA H A 94 ILE HG1y 1.0 . 4.64 770 592 A 34 THR H A 49 LEU HDx% 1.0 . 4.99 771 593 A 50 PHE H A 49 LEU HDx% 1.0 . 4.76 772 594 A 49 LEU H A 49 LEU HDx% 1.0 . 4.31 773 595 A 54 GLN H A 49 LEU HDx% 1.0 . 5.44 774 596 A 50 PHE HD% A 49 LEU HDx% 1.0 . 4.99 775 597 A 92 PHE HE% A 49 LEU HDx% 1.0 . 4.51 776 598 A 35 ALA HA A 49 LEU HDx% 1.0 . 4.95 777 599 A 54 GLN HA A 49 LEU HDx% 1.0 . 3.09 778 600 A 49 LEU HBy A 49 LEU HDx% 1.0 . 3.32 779 601 A 49 LEU HBx A 49 LEU HDx% 1.0 . 3.27 780 602 A 60 LEU HDx% A 55 PRO HGx 1.0 . 4.01 781 603 A 94 ILE H A 94 ILE HG1x 1.0 . 3.89 782 604 A 30 SER H A 25 LEU HDx% 1.0 . 4.87 783 605 A 25 LEU HDx% A 29 GLY HAx 1.0 . 4.22 784 605 A 29 GLY HAy A 25 LEU HDx% 1.0 . 4.22 785 606 A 56 PRO HDy A 25 LEU HDx% 1.0 . 4.08 786 607 A 56 PRO HDx A 25 LEU HDx% 1.0 . 4.27 787 608 A 31 PHE HBy A 25 LEU HDx% 1.0 . 3.71 788 609 A 31 PHE H A 25 LEU HDx% 1.0 . 4.33 789 610 A 25 LEU H A 25 LEU HDx% 1.0 . 4.08 790 611 A 31 PHE HD% A 25 LEU HDx% 1.0 . 4.79 791 612 A 44 LEU HDy% A 44 LEU HA 1.0 . 4.20 792 613 A 44 LEU HDy% A 45 ALA H 1.0 . 4.37 793 614 A 44 LEU HDy% A 44 LEU HBy 1.0 . 3.25 794 615 A 44 LEU HDy% A 41 LYS HBx 1.0 . 4.96 795 616 A 44 LEU HDy% A 93 ALA HB% 1.0 . 3.95 796 617 A 69 SER H A 69 SER HBx 1.0 . 3.10 797 617 A 69 SER HBy A 69 SER H 1.0 . 3.10 798 618 A 34 THR HB A 18 LYS HGy 1.0 . 5.05 799 619 A 18 LYS HGx A 35 ALA H 1.0 . 5.29 800 620 A 44 LEU HDy% A 46 TRP HE1 1.0 . 3.83 801 621 A 92 PHE HD% A 86 LEU HDx% 1.0 . 4.31 802 622 A 86 LEU HDx% A 60 LEU HG 1.0 . 4.56 803 623 A 60 LEU HDy% A 86 LEU HDx% 1.0 . 4.32 804 624 A 86 LEU HDx% A 88 ASP H 1.0 . 5.38 805 625 A 87 ARG H A 86 LEU HDx% 1.0 . 4.28 806 626 A 86 LEU HDx% A 86 LEU HA 1.0 . 4.02 807 627 A 87 ARG HA A 86 LEU HDx% 1.0 . 4.55 808 628 A 86 LEU HDx% A 61 SER HA 1.0 . 3.31 809 629 A 86 LEU HDx% A 92 PHE HBx 1.0 . 4.23 810 630 A 62 GLU HGy A 86 LEU HDx% 1.0 . 3.96 811 631 A 62 GLU HGx A 86 LEU HDx% 1.0 . 4.64 812 632 A 86 LEU HBy A 86 LEU HDx% 1.0 . 3.68 813 633 A 86 LEU HBx A 86 LEU HDx% 1.0 . 3.06 814 634 A 47 LEU HDy% A 39 SER H 1.0 . 5.50 815 635 A 47 LEU HDy% A 38 THR H 1.0 . 4.12 816 636 A 47 LEU H A 47 LEU HDy% 1.0 . 4.30 817 637 A 46 TRP H A 47 LEU HDy% 1.0 . 4.43 818 638 A 48 GLU H A 47 LEU HDy% 1.0 . 4.11 819 639 A 37 ILE H A 47 LEU HDy% 1.0 . 4.61 820 640 A 47 LEU HDy% A 47 LEU HA 1.0 . 3.21 821 641 A 47 LEU HDy% A 37 ILE HA 1.0 . 3.30 822 642 A 47 LEU HDy% A 37 ILE HB 1.0 . 4.61 823 643 A 47 LEU HDy% A 37 ILE HG1y 1.0 . 3.87 824 644 A 37 ILE HG1x A 47 LEU HDy% 1.0 . 3.01 825 645 A 96 LEU H A 96 LEU HDy% 1.0 . 4.08 826 646 A 96 LEU HDy% A 43 SER HA 1.0 . 3.97 827 647 A 96 LEU HDy% A 96 LEU HA 1.0 . 4.67 828 648 A 9 TYR HBy A 96 LEU HDy% 1.0 . 3.76 829 649 A 96 LEU HDy% A 9 TYR HBx 1.0 . 4.04 830 650 A 96 LEU HDy% A 13 PHE HBx 1.0 . 5.35 831 651 A 96 LEU HDy% A 96 LEU HBx 1.0 . 2.94 832 651 A 96 LEU HBy A 96 LEU HDy% 1.0 . 2.94 833 652 A 96 LEU HDy% A 68 VAL HGy% 1.0 . 4.60 834 653 A 44 LEU H A 96 LEU HDy% 1.0 . 5.04 835 654 A 69 SER HBy A 78 ARG HDx 1.0 . 4.95 836 654 A 69 SER HBx A 78 ARG HDx 1.0 . 4.95 837 654 A 78 ARG HDy A 69 SER HBx 1.0 . 4.95 838 654 A 78 ARG HDy A 69 SER HBy 1.0 . 4.95 839 655 A 78 ARG HA A 69 SER HBx 1.0 . 3.96 840 655 A 69 SER HBy A 78 ARG HA 1.0 . 3.96 841 656 A 20 ASN HBx A 69 SER HBx 1.0 . 3.60 842 656 A 69 SER HBy A 20 ASN HBx 1.0 . 3.60 843 657 A 69 SER HBx A 78 ARG HBx 1.0 . 3.64 844 657 A 69 SER HBy A 78 ARG HBx 1.0 . 3.64 845 657 A 78 ARG HBy A 69 SER HBx 1.0 . 3.64 846 657 A 78 ARG HBy A 69 SER HBy 1.0 . 3.64 847 658 A 70 VAL HGy% A 69 SER HBx 1.0 . 5.46 848 658 A 70 VAL HGy% A 69 SER HBy 1.0 . 5.46 849 659 A 18 LYS HEy A 18 LYS HGy 1.0 . 4.20 850 660 A 18 LYS HA A 18 LYS HGy 1.0 . 3.90 851 661 A 50 PHE HE% A 18 LYS HGy 1.0 . 4.42 852 662 A 19 VAL H A 18 LYS HGy 1.0 . 4.57 853 663 A 36 ALA HA A 18 LYS HGy 1.0 . 4.71 854 664 A 18 LYS HGx A 18 LYS H 1.0 . 4.28 855 665 A 36 ALA HA A 18 LYS HGx 1.0 . 4.61 856 666 A 18 LYS HGx A 19 VAL H 1.0 . 4.86 857 667 A 76 LEU HDy% A 71 TRP HE1 1.0 . 5.13 858 668 A 103 LEU H A 76 LEU HDy% 1.0 . 5.35 859 669 A 76 LEU H A 76 LEU HDy% 1.0 . 4.53 860 670 A 71 TRP HE3 A 76 LEU HDy% 1.0 . 5.50 861 671 A 76 LEU HDy% A 76 LEU HA 1.0 . 4.32 862 672 A 76 LEU HDy% A 69 SER HBx 1.0 . 4.11 863 672 A 69 SER HBy A 76 LEU HDy% 1.0 . 4.11 864 673 A 76 LEU HDy% A 104 GLN HGx 1.0 . 4.44 865 673 A 104 GLN HGy A 76 LEU HDy% 1.0 . 4.44 866 674 A 76 LEU HBy A 76 LEU HDy% 1.0 . 3.31 867 675 A 76 LEU HBx A 76 LEU HDy% 1.0 . 3.40 868 676 A 104 GLN HBy A 76 LEU HDy% 1.0 . 4.97 869 677 A 104 GLN HBx A 76 LEU HDy% 1.0 . 4.70 870 678 A 16 LEU H A 16 LEU HDx% 1.0 . 4.75 871 679 A 16 LEU HA A 16 LEU HDx% 1.0 . 4.00 872 680 A 16 LEU HDx% A 16 LEU HBy 1.0 . 2.98 873 681 A 16 LEU HDx% A 15 GLN HBx 1.0 . 4.65 874 681 A 15 GLN HBy A 16 LEU HDx% 1.0 . 4.65 875 682 A 16 LEU HDx% A 16 LEU HBx 1.0 . 3.08 876 683 A 17 GLN H A 16 LEU HDx% 1.0 . 5.41 877 684 A 86 LEU HDx% A 62 GLU H 1.0 . 4.46 878 685 A 86 LEU HDx% A 60 LEU HBx 1.0 . 3.51 879 686 A 86 LEU H A 86 LEU HDy% 1.0 . 4.30 880 687 A 86 LEU HDy% A 85 THR H 1.0 . 5.26 881 688 A 86 LEU HDy% A 86 LEU HA 1.0 . 3.50 882 689 A 86 LEU HDy% A 60 LEU HA 1.0 . 4.89 883 690 A 92 PHE HBy A 86 LEU HDy% 1.0 . 3.66 884 691 A 86 LEU HDy% A 92 PHE HBx 1.0 . 3.84 885 692 A 86 LEU HBy A 86 LEU HDy% 1.0 . 3.47 886 693 A 86 LEU HDy% A 60 LEU HBy 1.0 . 3.95 887 694 A 86 LEU HDy% A 60 LEU HDx% 1.0 . 4.11 888 695 A 87 ARG H A 86 LEU HDy% 1.0 . 4.08 889 696 A 86 LEU HDy% A 60 LEU H 1.0 . 5.10 890 697 A 86 LEU HDy% A 62 GLU HGy 1.0 . 4.52 891 698 A 86 LEU HDy% A 60 LEU HBx 1.0 . 3.53 892 699 A 55 PRO HDx A 60 LEU HDx% 1.0 . 5.21 893 700 A 60 LEU HDx% A 60 LEU H 1.0 . 4.37 894 701 A 31 PHE HD% A 60 LEU HDx% 1.0 . 4.94 895 702 A 92 PHE HE% A 60 LEU HDx% 1.0 . 3.69 896 703 A 60 LEU HDx% A 89 ASP HA 1.0 . 3.93 897 704 A 60 LEU HDx% A 60 LEU HA 1.0 . 3.73 898 705 A 55 PRO HDy A 60 LEU HDx% 1.0 . 5.13 899 706 A 60 LEU HDx% A 55 PRO HGy 1.0 . 4.30 900 707 A 64 ALA HB% A 60 LEU HDx% 1.0 . 5.06 901 708 A 60 LEU HBy A 60 LEU HDx% 1.0 . 3.38 902 709 A 60 LEU HDx% A 60 LEU HBx 1.0 . 3.48 903 710 A 60 LEU HDx% A 23 VAL HGy% 1.0 . 3.67 904 711 A 86 LEU HDx% A 60 LEU HDx% 1.0 . 3.70 905 712 A 86 LEU HDy% A 88 ASP H 1.0 . 5.18 906 713 A 35 ALA HB% A 19 VAL H 1.0 . 5.03 907 714 A 35 ALA HB% A 49 LEU H 1.0 . 5.38 908 715 A 35 ALA HB% A 35 ALA H 1.0 . 3.37 909 716 A 35 ALA HB% A 36 ALA H 1.0 . 3.18 910 717 A 48 GLU H A 35 ALA HB% 1.0 . 3.81 911 718 A 35 ALA HB% A 50 PHE H 1.0 . 4.19 912 719 A 35 ALA HB% A 47 LEU HA 1.0 . 3.95 913 720 A 35 ALA HB% A 49 LEU HA 1.0 . 3.36 914 721 A 35 ALA HB% A 50 PHE HBx 1.0 . 5.16 915 721 A 35 ALA HB% A 50 PHE HBy 1.0 . 5.16 916 722 A 35 ALA HB% A 47 LEU HBx 1.0 . 3.13 917 723 A 35 ALA HB% A 21 LEU HDy% 1.0 . 3.38 918 724 A 35 ALA HB% A 47 LEU HDy% 1.0 . 3.36 919 725 A 35 ALA HB% A 48 GLU HGy 1.0 . 5.50 920 726 A 67 SER HBx A 68 VAL HGy% 1.0 . 5.49 921 727 A 95 ARG H A 95 ARG HGy 1.0 . 4.94 922 728 A 41 LYS H A 41 LYS HGy 1.0 . 5.18 923 729 A 41 LYS H A 41 LYS HGx 1.0 . 5.14 924 730 A 95 ARG H A 95 ARG HGx 1.0 . 4.98 925 731 A 41 LYS HA A 41 LYS HGx 1.0 . 4.13 926 732 A 97 VAL HGx% A 95 ARG HGx 1.0 . 5.24 927 733 A 30 SER HBy A 25 LEU HDx% 1.0 . 5.50 928 734 A 30 SER HBy A 23 VAL H 1.0 . 4.74 929 735 A 30 SER HBy A 31 PHE H 1.0 . 3.60 930 736 A 30 SER HBy A 25 LEU H 1.0 . 4.67 931 737 A 30 SER HBy A 24 ARG HA 1.0 . 4.24 932 738 A 30 SER HBy A 22 THR HG2% 1.0 . 3.88 933 739 A 67 SER HBy A 68 VAL H 1.0 . 3.84 934 740 A 67 SER HBy A 67 SER H 1.0 . 3.61 935 741 A 61 SER H A 61 SER HBy 1.0 . 3.70 936 742 A 64 ALA H A 61 SER HBx 1.0 . 4.85 937 743 A 62 GLU H A 61 SER HBx 1.0 . 3.24 938 744 A 23 VAL H A 30 SER HBx 1.0 . 4.97 939 745 A 25 LEU H A 30 SER HBx 1.0 . 4.61 940 746 A 67 SER HBx A 68 VAL H 1.0 . 3.91 941 747 A 67 SER HBx A 67 SER H 1.0 . 3.67 942 748 A 67 SER HBx A 22 THR HG2% 1.0 . 4.87 943 749 A 86 LEU HDy% A 61 SER HBy 1.0 . 5.50 944 750 A 62 GLU H A 61 SER HBy 1.0 . 3.37 945 751 A 83 VAL HGx% A 61 SER HBy 1.0 . 5.47 946 752 A 61 SER H A 61 SER HBx 1.0 . 3.78 947 753 A 64 ALA HB% A 61 SER HBx 1.0 . 4.99 948 754 A 83 VAL HA A 64 ALA H 1.0 . 4.99 949 755 A 45 ALA HA A 40 LEU HDx% 1.0 . 3.82 950 756 A 40 LEU HA A 40 LEU HDx% 1.0 . 3.15 951 757 A 40 LEU HDx% A 9 TYR HBx 1.0 . 3.92 952 758 A 13 PHE H A 40 LEU HDx% 1.0 . 4.97 953 759 A 40 LEU HDx% A 13 PHE HD% 1.0 . 4.76 954 760 A 40 LEU HBy A 40 LEU HDx% 1.0 . 3.61 955 761 A 60 LEU HDy% A 60 LEU H 1.0 . 4.27 956 762 A 31 PHE HD% A 60 LEU HDy% 1.0 . 4.79 957 763 A 60 LEU HDy% A 60 LEU HA 1.0 . 3.11 958 764 A 60 LEU HDy% A 60 LEU HBy 1.0 . 4.17 959 765 A 60 LEU HDy% A 60 LEU HBx 1.0 . 3.23 960 766 A 60 LEU HDy% A 23 VAL HGy% 1.0 . 3.25 961 767 A 60 LEU HDy% A 83 VAL HGx% 1.0 . 3.37 962 768 A 60 LEU HDy% A 86 LEU HDy% 1.0 . 4.00 963 769 A 60 LEU HDy% A 23 VAL HB 1.0 . 4.72 964 770 A 60 LEU HDy% A 55 PRO HGy 1.0 . 4.48 965 771 A 83 VAL HA A 84 GLU H 1.0 . 3.43 966 772 A 46 TRP HBy A 39 SER HBx 1.0 . 4.27 967 772 A 46 TRP HBy A 39 SER HBy 1.0 . 4.27 968 773 A 46 TRP HBx A 39 SER HBx 1.0 . 3.71 969 773 A 46 TRP HBx A 39 SER HBy 1.0 . 3.71 970 774 A 46 TRP H A 39 SER HBx 1.0 . 3.52 971 774 A 46 TRP H A 39 SER HBy 1.0 . 3.52 972 775 A 41 LYS H A 40 LEU HDx% 1.0 . 3.38 973 776 A 44 LEU H A 40 LEU HDx% 1.0 . 4.30 974 777 A 40 LEU HDx% A 9 TYR HBy 1.0 . 4.39 975 778 A 40 LEU HDx% A 13 PHE HBx 1.0 . 4.04 976 779 A 40 LEU HBx A 40 LEU HDx% 1.0 . 3.25 977 780 A 40 LEU HDx% A 45 ALA HB% 1.0 . 3.17 978 781 A 40 LEU HDx% A 96 LEU HDy% 1.0 . 3.57 979 782 A 45 ALA H A 40 LEU HDx% 1.0 . 4.47 980 783 A 95 ARG HA A 43 SER HBy 1.0 . 3.78 981 784 A 43 SER HBy A 96 LEU HBx 1.0 . 3.75 982 784 A 96 LEU HBy A 43 SER HBy 1.0 . 3.75 983 785 A 96 LEU HDy% A 43 SER HBx 1.0 . 5.50 984 786 A 43 SER HBx A 96 LEU HBx 1.0 . 3.97 985 786 A 96 LEU HBy A 43 SER HBx 1.0 . 3.97 986 787 A 92 PHE HE% A 83 VAL HA 1.0 . 5.21 987 788 A 83 VAL HA A 94 ILE HA 1.0 . 3.43 988 789 A 83 VAL HA A 84 GLU HBy 1.0 . 4.89 989 790 A 38 THR H A 39 SER HBx 1.0 . 5.09 990 790 A 38 THR H A 39 SER HBy 1.0 . 5.09 991 791 A 46 TRP HE1 A 39 SER HBx 1.0 . 5.38 992 791 A 46 TRP HE1 A 39 SER HBy 1.0 . 5.38 993 792 A 100 VAL HGx% A 103 LEU HDx% 1.0 . 5.50 994 792 A 103 LEU HDy% A 100 VAL HGx% 1.0 . 5.50 995 793 A 103 LEU H A 103 LEU HDx% 1.0 . 4.11 996 793 A 103 LEU HDy% A 103 LEU H 1.0 . 4.11 997 794 A 78 ARG H A 103 LEU HDx% 1.0 . 4.55 998 794 A 78 ARG H A 103 LEU HDy% 1.0 . 4.55 999 795 A 104 GLN H A 103 LEU HDx% 1.0 . 4.82 1000 795 A 103 LEU HDy% A 104 GLN H 1.0 . 4.82 1001 796 A 79 CYS HA A 103 LEU HDx% 1.0 . 3.99 1002 796 A 103 LEU HDy% A 79 CYS HA 1.0 . 3.99 1003 797 A 103 LEU HA A 103 LEU HDx% 1.0 . 2.97 1004 797 A 103 LEU HDy% A 103 LEU HA 1.0 . 2.97 1005 798 A 96 LEU H A 43 SER HBx 1.0 . 4.40 1006 799 A 25 LEU HDy% A 31 PHE H 1.0 . 4.52 1007 800 A 25 LEU HDy% A 60 LEU H 1.0 . 4.89 1008 801 A 25 LEU HDy% A 25 LEU H 1.0 . 4.20 1009 802 A 25 LEU HDy% A 25 LEU HA 1.0 . 3.01 1010 803 A 25 LEU HDy% A 59 THR HA 1.0 . 4.40 1011 804 A 25 LEU HDy% A 60 LEU HA 1.0 . 4.15 1012 805 A 25 LEU HDy% A 59 THR HB 1.0 . 3.83 1013 806 A 25 LEU HDy% A 31 PHE HBy 1.0 . 4.13 1014 807 A 25 LEU HDy% A 31 PHE HBx 1.0 . 4.18 1015 808 A 25 LEU HDy% A 23 VAL HB 1.0 . 4.13 1016 809 A 25 LEU HDy% A 61 SER H 1.0 . 5.30 1017 810 A 44 LEU H A 44 LEU HDx% 1.0 . 4.48 1018 811 A 44 LEU HDx% A 85 THR H 1.0 . 5.02 1019 812 A 45 ALA HA A 44 LEU HDx% 1.0 . 5.21 1020 813 A 8 GLU H A 7 SER HBx 1.0 . 5.17 1021 813 A 7 SER HBy A 8 GLU H 1.0 . 5.17 1022 814 A 8 GLU HA A 7 SER HBx 1.0 . 4.53 1023 814 A 7 SER HBy A 8 GLU HA 1.0 . 4.53 1024 815 A 44 LEU HDx% A 46 TRP HE1 1.0 . 4.79 1025 816 A 94 ILE H A 44 LEU HDx% 1.0 . 4.20 1026 817 A 45 ALA H A 44 LEU HDx% 1.0 . 3.40 1027 818 A 44 LEU HDx% A 44 LEU HA 1.0 . 3.07 1028 819 A 95 ARG HA A 44 LEU HDx% 1.0 . 3.25 1029 820 A 44 LEU HDx% A 85 THR HB 1.0 . 4.84 1030 821 A 44 LEU HDx% A 95 ARG HDx 1.0 . 5.37 1031 821 A 44 LEU HDx% A 95 ARG HDy 1.0 . 5.37 1032 822 A 44 LEU HBy A 44 LEU HDx% 1.0 . 3.43 1033 823 A 44 LEU HDx% A 84 GLU HBy 1.0 . 3.88 1034 824 A 44 LEU HDx% A 84 GLU HBx 1.0 . 3.87 1035 825 A 44 LEU HDx% A 93 ALA HB% 1.0 . 3.32 1036 826 A 9 TYR HE% A 7 SER HBx 1.0 . 5.21 1037 826 A 9 TYR HE% A 7 SER HBy 1.0 . 5.21 1038 827 A 48 GLU HA A 38 THR HG2% 1.0 . 4.62 1039 828 A 47 LEU HDy% A 38 THR HG2% 1.0 . 5.36 1040 829 A 46 TRP HBx A 38 THR HG2% 1.0 . 5.22 1041 830 A 38 THR HB A 38 THR HA 1.0 . 2.96 1042 831 A 58 ASN H A 57 PRO HA 1.0 . 3.08 1043 832 A 59 THR H A 57 PRO HA 1.0 . 4.38 1044 833 A 44 LEU HDx% A 85 THR HG2% 1.0 . 5.50 1045 834 A 86 LEU H A 85 THR HG2% 1.0 . 3.31 1046 835 A 85 THR H A 85 THR HG2% 1.0 . 3.98 1047 836 A 46 TRP HZ3 A 85 THR HG2% 1.0 . 5.16 1048 837 A 85 THR HG2% A 92 PHE HA 1.0 . 4.74 1049 838 A 85 THR HA A 85 THR HG2% 1.0 . 3.11 1050 839 A 83 VAL HGy% A 85 THR HG2% 1.0 . 5.37 1051 840 A 93 ALA HB% A 85 THR HG2% 1.0 . 3.90 1052 841 A 37 ILE HA A 38 THR HG2% 1.0 . 4.19 1053 842 A 38 THR H A 38 THR HG2% 1.0 . 3.37 1054 843 A 48 GLU H A 38 THR HG2% 1.0 . 3.74 1055 844 A 37 ILE H A 38 THR HG2% 1.0 . 5.50 1056 845 A 39 SER H A 38 THR HG2% 1.0 . 4.33 1057 846 A 47 LEU HA A 38 THR HG2% 1.0 . 3.92 1058 847 A 38 THR HG2% A 38 THR HA 1.0 . 3.03 1059 848 A 38 THR HG2% A 39 SER HBx 1.0 . 5.24 1060 848 A 39 SER HBy A 38 THR HG2% 1.0 . 5.24 1061 849 A 46 TRP HBy A 38 THR HG2% 1.0 . 5.43 1062 850 A 38 THR HG2% A 48 GLU HBx 1.0 . 3.08 1063 850 A 48 GLU HBy A 38 THR HG2% 1.0 . 3.08 1064 851 A 100 VAL HGy% A 13 PHE HD% 1.0 . 5.06 1065 852 A 99 ARG HA A 100 VAL HGy% 1.0 . 4.20 1066 853 A 100 VAL H A 100 VAL HGy% 1.0 . 3.13 1067 854 A 100 VAL HGy% A 9 TYR HA 1.0 . 3.92 1068 855 A 100 VAL HGy% A 100 VAL HA 1.0 . 3.32 1069 856 A 100 VAL HGy% A 79 CYS HBy 1.0 . 4.04 1070 857 A 100 VAL HGy% A 79 CYS HBx 1.0 . 3.53 1071 858 A 16 LEU H A 16 LEU HDy% 1.0 . 3.56 1072 859 A 17 GLN H A 16 LEU HDy% 1.0 . 4.89 1073 860 A 15 GLN HE2y A 16 LEU HDy% 1.0 . 5.23 1074 861 A 16 LEU HDy% A 38 THR HA 1.0 . 3.87 1075 862 A 16 LEU HA A 16 LEU HDy% 1.0 . 2.88 1076 863 A 16 LEU HDy% A 15 GLN HGx 1.0 . 3.34 1077 863 A 15 GLN HGy A 16 LEU HDy% 1.0 . 3.34 1078 864 A 16 LEU HDy% A 16 LEU HBx 1.0 . 3.11 1079 865 A 38 THR H A 16 LEU HDy% 1.0 . 5.22 1080 866 A 23 VAL H A 23 VAL HGx% 1.0 . 5.09 1081 867 A 24 ARG H A 23 VAL HGx% 1.0 . 4.45 1082 868 A 67 SER HA A 66 VAL HGx% 1.0 . 4.93 1083 869 A 83 VAL HA A 66 VAL HGx% 1.0 . 4.89 1084 870 A 64 ALA HB% A 23 VAL HGx% 1.0 . 4.06 1085 871 A 23 VAL HGx% A 60 LEU HDx% 1.0 . 5.13 1086 872 A 68 VAL H A 68 VAL HGx% 1.0 . 4.07 1087 873 A 69 SER H A 68 VAL HGx% 1.0 . 3.59 1088 874 A 13 PHE HD% A 68 VAL HGx% 1.0 . 4.87 1089 875 A 68 VAL HA A 68 VAL HGx% 1.0 . 3.08 1090 876 A 19 VAL HA A 68 VAL HGx% 1.0 . 4.33 1091 877 A 79 CYS HBy A 68 VAL HGx% 1.0 . 5.42 1092 878 A 19 VAL HB A 68 VAL HGx% 1.0 . 3.49 1093 879 A 19 VAL HGx% A 68 VAL HGx% 1.0 . 3.64 1094 880 A 96 LEU HDx% A 68 VAL HGx% 1.0 . 4.34 1095 881 A 100 VAL HA A 12 TYR HE% 1.0 . 5.27 1096 882 A 83 VAL H A 66 VAL HGx% 1.0 . 3.95 1097 883 A 67 SER H A 66 VAL HGx% 1.0 . 3.67 1098 884 A 66 VAL H A 66 VAL HGx% 1.0 . 3.79 1099 885 A 66 VAL HGx% A 66 VAL HA 1.0 . 3.36 1100 886 A 23 VAL HA A 23 VAL HGx% 1.0 . 3.58 1101 887 A 65 GLU HA A 66 VAL HGx% 1.0 . 4.62 1102 888 A 60 LEU HDy% A 23 VAL HGx% 1.0 . 4.48 1103 889 A 83 VAL HGx% A 84 GLU H 1.0 . 4.28 1104 890 A 63 GLY H A 83 VAL HGx% 1.0 . 4.28 1105 891 A 83 VAL HGx% A 83 VAL H 1.0 . 3.06 1106 892 A 83 VAL HGx% A 64 ALA H 1.0 . 4.05 1107 893 A 92 PHE HD% A 83 VAL HGx% 1.0 . 3.85 1108 894 A 82 ARG HA A 83 VAL HGx% 1.0 . 4.30 1109 895 A 83 VAL HGx% A 94 ILE HA 1.0 . 4.70 1110 896 A 83 VAL HA A 83 VAL HGx% 1.0 . 3.26 1111 897 A 66 VAL HB A 83 VAL HGx% 1.0 . 5.46 1112 898 A 83 VAL HGx% A 60 LEU HDx% 1.0 . 4.47 1113 899 A 82 ARG H A 96 LEU HDx% 1.0 . 4.98 1114 900 A 100 VAL HA A 99 ARG HGx 1.0 . 5.24 1115 900 A 99 ARG HGy A 100 VAL HA 1.0 . 5.24 1116 901 A 79 CYS HA A 100 VAL HA 1.0 . 3.99 1117 902 A 100 VAL HA A 101 ARG H 1.0 . 2.88 1118 903 A 100 VAL HA A 79 CYS HBx 1.0 . 4.26 1119 904 A 99 ARG HA A 100 VAL HA 1.0 . 4.46 1120 905 A 76 LEU H A 75 ALA HB% 1.0 . 3.28 1121 906 A 75 ALA H A 75 ALA HB% 1.0 . 3.29 1122 907 A 75 ALA HB% A 105 ARG HA 1.0 . 3.93 1123 908 A 75 ALA HB% A 102 GLU HGx 1.0 . 3.78 1124 908 A 75 ALA HB% A 102 GLU HGy 1.0 . 3.78 1125 909 A 96 LEU HDx% A 96 LEU H 1.0 . 3.94 1126 910 A 97 VAL H A 96 LEU HDx% 1.0 . 3.98 1127 911 A 13 PHE HD% A 96 LEU HDx% 1.0 . 5.20 1128 912 A 96 LEU HDx% A 13 PHE HE% 1.0 . 4.31 1129 913 A 96 LEU HDx% A 13 PHE HZ 1.0 . 5.15 1130 914 A 95 ARG HA A 96 LEU HDx% 1.0 . 4.07 1131 915 A 96 LEU HDx% A 43 SER HA 1.0 . 4.81 1132 916 A 96 LEU HDx% A 96 LEU HA 1.0 . 3.15 1133 917 A 81 GLY HAx A 96 LEU HDx% 1.0 . 4.14 1134 918 A 79 CYS HBy A 96 LEU HDx% 1.0 . 3.82 1135 919 A 68 VAL HB A 96 LEU HDx% 1.0 . 4.60 1136 920 A 96 LEU HDx% A 68 VAL HGy% 1.0 . 3.19 1137 921 A 34 THR HG2% A 19 VAL H 1.0 . 4.77 1138 922 A 34 THR HG2% A 35 ALA H 1.0 . 3.47 1139 923 A 34 THR H A 34 THR HG2% 1.0 . 4.11 1140 924 A 34 THR HG2% A 50 PHE HE% 1.0 . 4.47 1141 925 A 34 THR HG2% A 34 THR HA 1.0 . 2.97 1142 926 A 34 THR HG2% A 50 PHE HBx 1.0 . 3.85 1143 926 A 34 THR HG2% A 50 PHE HBy 1.0 . 3.85 1144 927 A 34 THR HG2% A 18 LYS HEy 1.0 . 4.49 1145 928 A 34 THR HG2% A 18 LYS HGy 1.0 . 3.62 1146 929 A 75 ALA HB% A 76 LEU HBx 1.0 . 5.20 1147 930 A 59 THR HG2% A 59 THR H 1.0 . 3.83 1148 931 A 59 THR HG2% A 59 THR HA 1.0 . 3.09 1149 932 A 59 THR HG2% A 56 PRO HDx 1.0 . 4.19 1150 933 A 59 THR HG2% A 56 PRO HGx 1.0 . 3.97 1151 933 A 59 THR HG2% A 56 PRO HGy 1.0 . 3.97 1152 934 A 59 THR HG2% A 56 PRO HBx 1.0 . 3.66 1153 935 A 59 THR HG2% A 60 LEU HDy% 1.0 . 4.76 1154 936 A 20 ASN H A 19 VAL HGx% 1.0 . 3.88 1155 937 A 19 VAL HGx% A 18 LYS H 1.0 . 4.37 1156 938 A 19 VAL HGx% A 17 GLN HE2y 1.0 . 5.23 1157 939 A 18 LYS HA A 19 VAL HGx% 1.0 . 4.64 1158 940 A 19 VAL HA A 19 VAL HGx% 1.0 . 3.22 1159 941 A 19 VAL HGx% A 17 GLN HBy 1.0 . 3.61 1160 942 A 47 LEU HDy% A 19 VAL HGx% 1.0 . 4.02 1161 943 A 36 ALA HA A 19 VAL HGx% 1.0 . 5.50 1162 944 A 19 VAL HGx% A 70 VAL HA 1.0 . 4.70 1163 945 A 59 THR HG2% A 60 LEU H 1.0 . 4.23 1164 946 A 59 THR HG2% A 31 PHE HBy 1.0 . 4.76 1165 947 A 59 THR HG2% A 31 PHE HBx 1.0 . 4.76 1166 948 A 14 GLU H A 19 VAL HGx% 1.0 . 5.02 1167 949 A 19 VAL HGx% A 19 VAL H 1.0 . 3.70 1168 950 A 19 VAL HGx% A 13 PHE HE% 1.0 . 4.16 1169 951 A 13 PHE HBy A 19 VAL HGx% 1.0 . 5.50 1170 952 A 85 THR HA A 83 VAL HGy% 1.0 . 5.50 1171 953 A 86 LEU H A 83 VAL HGy% 1.0 . 3.54 1172 954 A 83 VAL HGy% A 63 GLY H 1.0 . 4.07 1173 955 A 83 VAL HGy% A 93 ALA H 1.0 . 4.41 1174 956 A 83 VAL HGy% A 64 ALA H 1.0 . 4.34 1175 957 A 83 VAL HGy% A 85 THR H 1.0 . 3.73 1176 958 A 92 PHE HD% A 83 VAL HGy% 1.0 . 3.91 1177 959 A 86 LEU HA A 83 VAL HGy% 1.0 . 4.18 1178 960 A 83 VAL HGy% A 84 GLU HA 1.0 . 5.17 1179 961 A 83 VAL HA A 83 VAL HGy% 1.0 . 3.27 1180 962 A 62 GLU HA A 83 VAL HGy% 1.0 . 3.21 1181 963 A 92 PHE HBx A 83 VAL HGy% 1.0 . 3.85 1182 964 A 86 LEU HBx A 83 VAL HGy% 1.0 . 3.78 1183 965 A 83 VAL HGy% A 60 LEU HBx 1.0 . 5.07 1184 966 A 60 LEU HDy% A 83 VAL HGy% 1.0 . 4.86 1185 967 A 83 VAL HGy% A 93 ALA HB% 1.0 . 5.50 1186 968 A 76 LEU HDx% A 70 VAL H 1.0 . 3.24 1187 969 A 71 TRP H A 76 LEU HDx% 1.0 . 4.60 1188 970 A 76 LEU H A 76 LEU HDx% 1.0 . 4.66 1189 971 A 76 LEU HDx% A 69 SER HA 1.0 . 4.90 1190 972 A 76 LEU HDx% A 71 TRP HA 1.0 . 3.99 1191 973 A 76 LEU HDx% A 70 VAL HA 1.0 . 4.11 1192 974 A 76 LEU HDx% A 76 LEU HA 1.0 . 3.17 1193 975 A 76 LEU HDx% A 69 SER HBx 1.0 . 3.32 1194 975 A 69 SER HBy A 76 LEU HDx% 1.0 . 3.32 1195 976 A 76 LEU HDx% A 78 ARG HBx 1.0 . 4.65 1196 976 A 78 ARG HBy A 76 LEU HDx% 1.0 . 4.65 1197 977 A 76 LEU HBy A 76 LEU HDx% 1.0 . 4.07 1198 978 A 76 LEU HBx A 76 LEU HDx% 1.0 . 3.39 1199 979 A 76 LEU HDx% A 71 TRP HE1 1.0 . 4.46 1200 980 A 28 THR HG2% A 28 THR H 1.0 . 4.80 1201 981 A 28 THR HG2% A 29 GLY H 1.0 . 5.11 1202 982 A 28 THR HG2% A 27 ASP HA 1.0 . 5.50 1203 983 A 23 VAL H A 22 THR HG2% 1.0 . 3.43 1204 984 A 22 THR HG2% A 22 THR H 1.0 . 3.75 1205 985 A 22 THR HG2% A 22 THR HA 1.0 . 3.31 1206 986 A 22 THR HG2% A 30 SER HBx 1.0 . 3.58 1207 987 A 70 VAL HGx% A 71 TRP HBy 1.0 . 4.74 1208 988 A 22 THR HG2% A 30 SER HA 1.0 . 5.13 1209 989 A 22 THR HG2% A 23 VAL HA 1.0 . 4.72 1210 990 A 22 THR HG2% A 24 ARG HA 1.0 . 5.33 1211 991 A 22 THR HG2% A 23 VAL HB 1.0 . 5.47 1212 992 A 13 PHE HA A 70 VAL HGx% 1.0 . 5.38 1213 993 A 70 VAL HGx% A 71 TRP HA 1.0 . 5.50 1214 994 A 70 VAL HGx% A 70 VAL HA 1.0 . 3.20 1215 995 A 19 VAL HGx% A 70 VAL HGx% 1.0 . 3.49 1216 996 A 71 TRP H A 70 VAL HGx% 1.0 . 3.26 1217 997 A 14 GLU H A 70 VAL HGx% 1.0 . 5.14 1218 998 A 70 VAL HGx% A 17 GLN HE2x 1.0 . 4.09 1219 999 A 70 VAL HGx% A 17 GLN HGx 1.0 . 4.23 1220 1000 A 28 THR HG2% A 28 THR HA 1.0 . 3.33 1221 1001 A 36 ALA H A 36 ALA HB% 1.0 . 3.10 1222 1002 A 48 GLU H A 36 ALA HB% 1.0 . 4.22 1223 1003 A 37 ILE H A 36 ALA HB% 1.0 . 3.33 1224 1004 A 50 PHE HE% A 36 ALA HB% 1.0 . 4.05 1225 1005 A 18 LYS HA A 36 ALA HB% 1.0 . 4.43 1226 1006 A 38 THR HA A 36 ALA HB% 1.0 . 5.00 1227 1007 A 16 LEU HA A 36 ALA HB% 1.0 . 4.04 1228 1008 A 37 ILE HB A 36 ALA HB% 1.0 . 4.91 1229 1009 A 36 ALA HB% A 18 LYS HDx 1.0 . 3.58 1230 1009 A 18 LYS HDy A 36 ALA HB% 1.0 . 3.58 1231 1010 A 47 LEU HDy% A 36 ALA HB% 1.0 . 5.50 1232 1011 A 37 ILE HA A 36 ALA HB% 1.0 . 4.67 1233 1012 A 36 ALA HB% A 50 PHE HBx 1.0 . 5.24 1234 1012 A 50 PHE HBy A 36 ALA HB% 1.0 . 5.24 1235 1013 A 70 VAL HGx% A 70 VAL H 1.0 . 3.90 1236 1014 A 76 LEU HDx% A 70 VAL HGx% 1.0 . 5.50 1237 1015 A 70 VAL HGx% A 17 GLN HE2y 1.0 . 4.15 1238 1016 A 13 PHE HD% A 70 VAL HGx% 1.0 . 4.79 1239 1017 A 19 VAL HA A 70 VAL HGx% 1.0 . 3.94 1240 1018 A 70 VAL HGx% A 72 THR HB 1.0 . 4.02 1241 1019 A 70 VAL HGx% A 71 TRP HBx 1.0 . 4.96 1242 1020 A 100 VAL HGx% A 72 THR HG2% 1.0 . 5.50 1243 1021 A 95 ARG H A 97 VAL HGx% 1.0 . 5.25 1244 1022 A 82 ARG H A 97 VAL HGx% 1.0 . 4.47 1245 1023 A 81 GLY HAx A 97 VAL HGx% 1.0 . 4.57 1246 1024 A 97 VAL HGx% A 95 ARG HGy 1.0 . 4.21 1247 1025 A 12 TYR HE% A 72 THR HG2% 1.0 . 4.92 1248 1026 A 72 THR H A 72 THR HG2% 1.0 . 3.43 1249 1027 A 77 CYS H A 72 THR HG2% 1.0 . 4.57 1250 1028 A 12 TYR HD% A 72 THR HG2% 1.0 . 3.61 1251 1029 A 17 GLN HE2x A 72 THR HG2% 1.0 . 4.36 1252 1030 A 72 THR HG2% A 72 THR HA 1.0 . 3.80 1253 1031 A 77 CYS HBx A 72 THR HG2% 1.0 . 3.77 1254 1032 A 70 VAL HGx% A 72 THR HG2% 1.0 . 3.89 1255 1033 A 70 VAL HGy% A 72 THR HG2% 1.0 . 3.47 1256 1034 A 98 GLY H A 97 VAL HGx% 1.0 . 3.91 1257 1035 A 97 VAL H A 97 VAL HGx% 1.0 . 3.82 1258 1036 A 81 GLY HAy A 97 VAL HGx% 1.0 . 3.91 1259 1037 A 97 VAL HA A 97 VAL HGx% 1.0 . 3.36 1260 1038 A 98 GLY HAx A 97 VAL HGx% 1.0 . 5.35 1261 1039 A 82 ARG HDy A 97 VAL HGx% 1.0 . 5.08 1262 1040 A 71 TRP H A 72 THR HG2% 1.0 . 5.50 1263 1041 A 17 GLN HE2y A 72 THR HG2% 1.0 . 5.28 1264 1042 A 71 TRP HA A 72 THR HG2% 1.0 . 4.45 1265 1043 A 73 GLY HAy A 72 THR HG2% 1.0 . 5.50 1266 1044 A 77 CYS HBy A 72 THR HG2% 1.0 . 4.04 1267 1045 A 12 TYR HBy A 72 THR HG2% 1.0 . 3.84 1268 1046 A 75 ALA H A 72 THR HG2% 1.0 . 5.14 1269 1047 A 66 VAL HGy% A 23 VAL HGy% 1.0 . 3.72 1270 1048 A 23 VAL H A 23 VAL HGy% 1.0 . 3.32 1271 1049 A 31 PHE H A 23 VAL HGy% 1.0 . 4.17 1272 1050 A 23 VAL HGy% A 22 THR HA 1.0 . 4.28 1273 1051 A 23 VAL HGy% A 66 VAL HA 1.0 . 3.80 1274 1052 A 23 VAL HA A 23 VAL HGy% 1.0 . 2.93 1275 1053 A 60 LEU HA A 23 VAL HGy% 1.0 . 4.41 1276 1054 A 31 PHE HBx A 23 VAL HGy% 1.0 . 3.72 1277 1055 A 64 ALA HB% A 23 VAL HGy% 1.0 . 3.29 1278 1056 A 100 VAL HGx% A 101 ARG H 1.0 . 3.19 1279 1057 A 100 VAL HGx% A 77 CYS HA 1.0 . 4.22 1280 1058 A 79 CYS HA A 100 VAL HGx% 1.0 . 4.29 1281 1059 A 100 VAL HGx% A 100 VAL HA 1.0 . 3.31 1282 1060 A 100 VAL HGx% A 77 CYS HBy 1.0 . 3.88 1283 1061 A 100 VAL HGx% A 79 CYS HBx 1.0 . 4.21 1284 1062 A 12 TYR HBy A 100 VAL HGx% 1.0 . 3.87 1285 1063 A 100 VAL HGx% A 79 CYS HBy 1.0 . 4.65 1286 1064 A 23 VAL HB A 22 THR HA 1.0 . 4.96 1287 1065 A 31 PHE H A 22 THR HA 1.0 . 4.74 1288 1066 A 23 VAL H A 22 THR HA 1.0 . 2.94 1289 1067 A 56 PRO HA A 57 PRO HDy 1.0 . 2.96 1290 1068 A 56 PRO HA A 57 PRO HDx 1.0 . 3.12 1291 1069 A 86 LEU H A 85 THR HA 1.0 . 2.87 1292 1070 A 86 LEU HBx A 85 THR HA 1.0 . 4.82 1293 1071 A 33 GLY H A 22 THR HA 1.0 . 4.34 1294 1072 A 12 TYR HBx A 9 TYR HA 1.0 . 5.50 1295 1073 A 96 LEU HDy% A 9 TYR HA 1.0 . 5.46 1296 1074 A 55 PRO HA A 56 PRO HGx 1.0 . 4.19 1297 1074 A 55 PRO HA A 56 PRO HGy 1.0 . 4.19 1298 1075 A 94 ILE H A 45 ALA HB% 1.0 . 4.23 1299 1076 A 45 ALA H A 45 ALA HB% 1.0 . 3.32 1300 1077 A 46 TRP H A 45 ALA HB% 1.0 . 3.85 1301 1078 A 40 LEU HA A 45 ALA HB% 1.0 . 4.56 1302 1079 A 44 LEU HA A 45 ALA HB% 1.0 . 4.90 1303 1080 A 93 ALA HA A 45 ALA HB% 1.0 . 5.50 1304 1081 A 94 ILE HG1y A 45 ALA HB% 1.0 . 3.72 1305 1082 A 94 ILE HD1% A 45 ALA HB% 1.0 . 3.47 1306 1083 A 13 PHE HD% A 68 VAL HGy% 1.0 . 5.31 1307 1084 A 19 VAL HB A 68 VAL HGy% 1.0 . 4.90 1308 1085 A 34 THR HA A 21 LEU HDy% 1.0 . 5.28 1309 1086 A 37 ILE HG1y A 37 ILE HA 1.0 . 4.07 1310 1087 A 39 SER H A 37 ILE HA 1.0 . 4.43 1311 1088 A 56 PRO HDy A 55 PRO HA 1.0 . 3.01 1312 1089 A 56 PRO HDx A 55 PRO HA 1.0 . 3.37 1313 1090 A 93 ALA HB% A 45 ALA HB% 1.0 . 5.50 1314 1091 A 70 VAL HGy% A 17 GLN HE2y 1.0 . 4.34 1315 1092 A 70 VAL HGy% A 69 SER HA 1.0 . 4.53 1316 1093 A 70 VAL HGy% A 76 LEU HDx% 1.0 . 5.50 1317 1094 A 66 VAL HGy% A 65 GLU HA 1.0 . 4.33 1318 1095 A 66 VAL HGy% A 67 SER H 1.0 . 4.08 1319 1096 A 66 VAL HGy% A 66 VAL H 1.0 . 3.32 1320 1097 A 66 VAL HGy% A 82 ARG HA 1.0 . 4.09 1321 1098 A 66 VAL HGy% A 66 VAL HA 1.0 . 4.12 1322 1099 A 66 VAL HGy% A 23 VAL HA 1.0 . 4.78 1323 1100 A 81 GLY HAx A 68 VAL HGy% 1.0 . 3.72 1324 1101 A 66 VAL HGy% A 64 ALA HB% 1.0 . 4.09 1325 1102 A 68 VAL H A 68 VAL HGy% 1.0 . 3.37 1326 1103 A 79 CYS H A 68 VAL HGy% 1.0 . 4.60 1327 1104 A 69 SER H A 68 VAL HGy% 1.0 . 4.56 1328 1105 A 68 VAL HGy% A 13 PHE HZ 1.0 . 4.08 1329 1106 A 68 VAL HA A 68 VAL HGy% 1.0 . 3.50 1330 1107 A 79 CYS HBy A 68 VAL HGy% 1.0 . 3.98 1331 1108 A 79 CYS HBx A 68 VAL HGy% 1.0 . 5.05 1332 1109 A 68 VAL HGy% A 96 LEU HG 1.0 . 5.43 1333 1110 A 55 PRO HA A 54 GLN HA 1.0 . 4.39 1334 1111 A 70 VAL HGy% A 70 VAL H 1.0 . 3.29 1335 1112 A 70 VAL HGy% A 71 TRP H 1.0 . 4.37 1336 1113 A 70 VAL HGy% A 13 PHE HD% 1.0 . 3.95 1337 1114 A 70 VAL HGy% A 13 PHE HA 1.0 . 4.78 1338 1115 A 70 VAL HGy% A 19 VAL HA 1.0 . 4.16 1339 1116 A 70 VAL HGy% A 70 VAL HA 1.0 . 3.67 1340 1117 A 70 VAL HGy% A 72 THR HB 1.0 . 3.87 1341 1118 A 70 VAL HGy% A 77 CYS HBx 1.0 . 4.25 1342 1119 A 66 VAL HGy% A 83 VAL HA 1.0 . 5.17 1343 1120 A 34 THR HA A 21 LEU HG 1.0 . 5.31 1344 1121 A 70 VAL HGy% A 72 THR HA 1.0 . 5.11 1345 1122 A 70 VAL HGx% A 72 THR HA 1.0 . 4.63 1346 1123 A 71 TRP HA A 72 THR HA 1.0 . 4.65 1347 1124 A 52 ALA HB% A 52 ALA H 1.0 . 3.63 1348 1125 A 53 GLU H A 52 ALA HB% 1.0 . 3.71 1349 1126 A 52 ALA HB% A 53 GLU HA 1.0 . 4.20 1350 1127 A 51 GLY HAy A 52 ALA HB% 1.0 . 4.20 1351 1128 A 51 GLY HAx A 52 ALA HB% 1.0 . 4.78 1352 1129 A 52 ALA HB% A 53 GLU HGx 1.0 . 4.78 1353 1130 A 52 ALA HB% A 53 GLU HBx 1.0 . 5.07 1354 1130 A 52 ALA HB% A 53 GLU HBy 1.0 . 5.07 1355 1131 A 80 ASP H A 97 VAL HGy% 1.0 . 4.92 1356 1132 A 82 ARG H A 97 VAL HGy% 1.0 . 4.06 1357 1133 A 97 VAL H A 97 VAL HGy% 1.0 . 3.28 1358 1134 A 96 LEU HA A 97 VAL HGy% 1.0 . 4.11 1359 1135 A 81 GLY HAx A 97 VAL HGy% 1.0 . 3.98 1360 1136 A 82 ARG HDy A 97 VAL HGy% 1.0 . 5.11 1361 1137 A 97 VAL HGy% A 80 ASP HBy 1.0 . 3.96 1362 1138 A 97 VAL HGy% A 82 ARG HGx 1.0 . 4.61 1363 1138 A 82 ARG HGy A 97 VAL HGy% 1.0 . 4.61 1364 1139 A 64 ALA HB% A 23 VAL HA 1.0 . 4.23 1365 1140 A 98 GLY H A 97 VAL HGy% 1.0 . 4.00 1366 1141 A 81 GLY HAy A 97 VAL HGy% 1.0 . 3.39 1367 1142 A 97 VAL HA A 97 VAL HGy% 1.0 . 3.52 1368 1143 A 98 GLY HAy A 97 VAL HGy% 1.0 . 4.79 1369 1144 A 97 VAL HGy% A 80 ASP HBx 1.0 . 3.80 1370 1145 A 96 LEU HDx% A 97 VAL HGy% 1.0 . 5.50 1371 1146 A 98 GLY HAx A 97 VAL HGy% 1.0 . 5.50 1372 1147 A 97 VAL HA A 98 GLY H 1.0 . 2.95 1373 1148 A 4 ALA HB% A 5 ASP H 1.0 . 5.09 1374 1149 A 93 ALA HB% A 84 GLU HBy 1.0 . 4.60 1375 1150 A 93 ALA HB% A 84 GLU HBx 1.0 . 3.96 1376 1151 A 93 ALA HB% A 44 LEU HG 1.0 . 3.90 1377 1152 A 4 ALA HB% A 5 ASP HA 1.0 . 5.21 1378 1153 A 4 ALA HB% A 3 SER HBx 1.0 . 4.99 1379 1153 A 4 ALA HB% A 3 SER HBy 1.0 . 4.99 1380 1154 A 93 ALA HB% A 46 TRP HE1 1.0 . 4.50 1381 1155 A 94 ILE H A 93 ALA HB% 1.0 . 3.51 1382 1156 A 45 ALA H A 93 ALA HB% 1.0 . 4.18 1383 1157 A 93 ALA HB% A 93 ALA H 1.0 . 3.23 1384 1158 A 93 ALA HB% A 85 THR H 1.0 . 3.54 1385 1159 A 93 ALA HB% A 92 PHE HA 1.0 . 4.28 1386 1160 A 85 THR HA A 93 ALA HB% 1.0 . 5.08 1387 1161 A 46 TRP HA A 93 ALA HB% 1.0 . 3.72 1388 1162 A 71 TRP H A 70 VAL HA 1.0 . 3.00 1389 1163 A 67 SER H A 68 VAL HA 1.0 . 5.15 1390 1164 A 64 ALA HB% A 83 VAL H 1.0 . 4.18 1391 1165 A 61 SER H A 64 ALA HB% 1.0 . 3.37 1392 1166 A 64 ALA HB% A 60 LEU HA 1.0 . 4.05 1393 1167 A 63 GLY H A 64 ALA HB% 1.0 . 4.59 1394 1168 A 65 GLU H A 64 ALA HB% 1.0 . 3.37 1395 1169 A 24 ARG H A 64 ALA HB% 1.0 . 5.01 1396 1170 A 64 ALA HB% A 64 ALA H 1.0 . 2.93 1397 1171 A 64 ALA HB% A 83 VAL HB 1.0 . 3.70 1398 1172 A 64 ALA HB% A 83 VAL HGx% 1.0 . 3.32 1399 1173 A 68 VAL HA A 69 SER H 1.0 . 2.83 1400 1174 A 60 LEU HDy% A 64 ALA HB% 1.0 . 4.90 1401 1175 A 64 ALA HB% A 61 SER HBy 1.0 . 4.42 1402 1176 A 62 GLU HA A 64 ALA HB% 1.0 . 4.74 1403 1177 A 37 ILE H A 19 VAL HGy% 1.0 . 4.68 1404 1178 A 13 PHE HD% A 19 VAL HGy% 1.0 . 5.50 1405 1179 A 19 VAL H A 19 VAL HGy% 1.0 . 3.15 1406 1180 A 36 ALA HA A 19 VAL HGy% 1.0 . 4.99 1407 1181 A 37 ILE HG1y A 19 VAL HGy% 1.0 . 3.81 1408 1182 A 35 ALA HB% A 19 VAL HGy% 1.0 . 3.40 1409 1183 A 9 TYR H A 7 SER HA 1.0 . 4.90 1410 1184 A 7 SER HA A 7 SER HBx 1.0 . 2.78 1411 1184 A 7 SER HBy A 7 SER HA 1.0 . 2.78 1412 1185 A 70 VAL HGy% A 12 TYR HA 1.0 . 5.50 1413 1186 A 95 ARG H A 94 ILE HG2% 1.0 . 3.54 1414 1187 A 94 ILE HD1% A 94 ILE HG2% 1.0 . 2.65 1415 1188 A 72 THR HG2% A 12 TYR HA 1.0 . 4.04 1416 1189 A 62 GLU HA A 83 VAL H 1.0 . 5.09 1417 1190 A 62 GLU HA A 63 GLY H 1.0 . 3.20 1418 1191 A 62 GLU HA A 64 ALA H 1.0 . 4.03 1419 1192 A 62 GLU HA A 83 VAL HB 1.0 . 3.43 1420 1193 A 62 GLU HA A 83 VAL HGx% 1.0 . 4.41 1421 1194 A 62 GLU HA A 85 THR H 1.0 . 5.24 1422 1195 A 37 ILE HG2% A 47 LEU HA 1.0 . 4.89 1423 1196 A 40 LEU HA A 37 ILE HG2% 1.0 . 4.83 1424 1197 A 13 PHE HBy A 37 ILE HG2% 1.0 . 4.85 1425 1198 A 37 ILE HG2% A 38 THR H 1.0 . 3.62 1426 1199 A 16 LEU H A 37 ILE HG2% 1.0 . 3.96 1427 1200 A 46 TRP H A 37 ILE HG2% 1.0 . 4.07 1428 1201 A 37 ILE H A 37 ILE HG2% 1.0 . 4.07 1429 1202 A 17 GLN H A 37 ILE HG2% 1.0 . 4.28 1430 1203 A 37 ILE HG2% A 39 SER H 1.0 . 3.31 1431 1204 A 37 ILE HG2% A 37 ILE HA 1.0 . 3.19 1432 1205 A 37 ILE HG2% A 38 THR HA 1.0 . 4.87 1433 1206 A 37 ILE HG2% A 15 GLN HA 1.0 . 3.23 1434 1207 A 37 ILE HG2% A 37 ILE HG1y 1.0 . 3.56 1435 1208 A 40 LEU HBx A 37 ILE HG2% 1.0 . 3.40 1436 1209 A 47 LEU HDy% A 37 ILE HG2% 1.0 . 4.09 1437 1210 A 94 ILE H A 94 ILE HG2% 1.0 . 4.15 1438 1211 A 82 ARG H A 94 ILE HG2% 1.0 . 4.09 1439 1212 A 94 ILE HA A 94 ILE HG2% 1.0 . 3.31 1440 1213 A 83 VAL HA A 94 ILE HG2% 1.0 . 3.44 1441 1214 A 94 ILE HG1x A 94 ILE HG2% 1.0 . 3.53 1442 1215 A 96 LEU HDx% A 94 ILE HG2% 1.0 . 4.08 1443 1216 A 62 GLU HA A 61 SER HA 1.0 . 4.38 1444 1217 A 37 ILE HG2% A 15 GLN HBx 1.0 . 4.55 1445 1217 A 37 ILE HG2% A 15 GLN HBy 1.0 . 4.55 1446 1218 A 85 THR H A 94 ILE HG2% 1.0 . 5.35 1447 1219 A 93 ALA HB% A 94 ILE HG2% 1.0 . 5.50 1448 1220 A 20 ASN H A 19 VAL HA 1.0 . 2.94 1449 1221 A 79 CYS HA A 80 ASP H 1.0 . 3.01 1450 1222 A 46 TRP HA A 47 LEU H 1.0 . 2.96 1451 1223 A 46 TRP HA A 47 LEU HDx% 1.0 . 5.11 1452 1224 A 4 ALA HB% A 3 SER HA 1.0 . 4.95 1453 1225 A 87 ARG HA A 87 ARG HDx 1.0 . 4.59 1454 1226 A 39 SER HA A 15 GLN HGx 1.0 . 4.09 1455 1226 A 15 GLN HGy A 39 SER HA 1.0 . 4.09 1456 1227 A 39 SER HA A 39 SER HBx 1.0 . 2.92 1457 1227 A 39 SER HBy A 39 SER HA 1.0 . 2.92 1458 1228 A 37 ILE HG2% A 39 SER HA 1.0 . 4.77 1459 1229 A 3 SER HA A 3 SER HBx 1.0 . 2.97 1460 1229 A 3 SER HBy A 3 SER HA 1.0 . 2.97 1461 1230 A 16 LEU HG A 15 GLN HA 1.0 . 5.27 1462 1231 A 38 THR H A 15 GLN HA 1.0 . 4.61 1463 1232 A 38 THR HA A 15 GLN HA 1.0 . 5.06 1464 1233 A 14 GLU HA A 15 GLN HA 1.0 . 4.42 1465 1234 A 37 ILE HB A 15 GLN HA 1.0 . 3.56 1466 1235 A 15 GLN HA A 15 GLN HGx 1.0 . 3.72 1467 1235 A 15 GLN HGy A 15 GLN HA 1.0 . 3.72 1468 1236 A 23 VAL HA A 66 VAL HA 1.0 . 3.29 1469 1237 A 67 SER H A 66 VAL HA 1.0 . 2.92 1470 1238 A 65 GLU HA A 66 VAL HA 1.0 . 4.85 1471 1239 A 40 LEU H A 15 GLN HA 1.0 . 4.95 1472 1240 A 31 PHE HBy A 30 SER HA 1.0 . 4.80 1473 1241 A 31 PHE HBx A 30 SER HA 1.0 . 5.08 1474 1242 A 67 SER HA A 81 GLY H 1.0 . 3.92 1475 1243 A 67 SER HA A 68 VAL HGx% 1.0 . 5.50 1476 1244 A 67 SER HA A 80 ASP HA 1.0 . 3.18 1477 1245 A 67 SER HA A 68 VAL HGy% 1.0 . 4.15 1478 1246 A 25 LEU HDy% A 30 SER HA 1.0 . 5.50 1479 1247 A 25 LEU H A 30 SER HA 1.0 . 3.37 1480 1248 A 30 SER HA A 25 LEU HG 1.0 . 3.60 1481 1249 A 31 PHE H A 30 SER HA 1.0 . 2.96 1482 1250 A 24 ARG HA A 30 SER HA 1.0 . 3.40 1483 1251 A 25 LEU HDx% A 30 SER HA 1.0 . 4.93 1484 1252 A 30 SER HA A 29 GLY HAx 1.0 . 4.82 1485 1252 A 29 GLY HAy A 30 SER HA 1.0 . 4.82 1486 1253 A 23 VAL H A 30 SER HA 1.0 . 5.00 1487 1254 A 95 ARG H A 94 ILE HA 1.0 . 3.14 1488 1255 A 84 GLU HGy A 84 GLU HA 1.0 . 3.27 1489 1256 A 103 LEU H A 77 CYS HA 1.0 . 3.80 1490 1257 A 78 ARG H A 77 CYS HA 1.0 . 2.96 1491 1258 A 102 GLU HA A 77 CYS HA 1.0 . 3.32 1492 1259 A 77 CYS HA A 78 ARG HBx 1.0 . 4.20 1493 1259 A 78 ARG HBy A 77 CYS HA 1.0 . 4.20 1494 1260 A 77 CYS HA A 103 LEU HDx% 1.0 . 5.39 1495 1260 A 103 LEU HDy% A 77 CYS HA 1.0 . 5.39 1496 1261 A 8 GLU HA A 8 GLU HGx 1.0 . 3.83 1497 1261 A 8 GLU HGy A 8 GLU HA 1.0 . 3.83 1498 1262 A 16 LEU HA A 38 THR HA 1.0 . 4.85 1499 1263 A 16 LEU HA A 38 THR H 1.0 . 5.02 1500 1264 A 16 LEU HA A 15 GLN HBx 1.0 . 5.18 1501 1264 A 16 LEU HA A 15 GLN HBy 1.0 . 5.18 1502 1265 A 77 CYS HA A 102 GLU HGx 1.0 . 4.82 1503 1265 A 102 GLU HGy A 77 CYS HA 1.0 . 4.82 1504 1266 A 65 GLU HA A 83 VAL H 1.0 . 4.27 1505 1267 A 65 GLU HA A 66 VAL H 1.0 . 2.83 1506 1268 A 8 GLU HA A 10 GLY H 1.0 . 4.60 1507 1269 A 9 TYR H A 8 GLU HA 1.0 . 3.33 1508 1270 A 8 GLU HA A 11 ARG HDx 1.0 . 4.61 1509 1270 A 11 ARG HDy A 8 GLU HA 1.0 . 4.61 1510 1271 A 11 ARG HBy A 8 GLU HA 1.0 . 4.95 1511 1272 A 11 ARG HGy A 8 GLU HA 1.0 . 4.26 1512 1273 A 11 ARG HGx A 8 GLU HA 1.0 . 5.10 1513 1274 A 50 PHE HA A 50 PHE HBx 1.0 . 2.94 1514 1274 A 50 PHE HBy A 50 PHE HA 1.0 . 2.94 1515 1275 A 11 ARG HA A 10 GLY H 1.0 . 5.23 1516 1276 A 13 PHE H A 11 ARG HA 1.0 . 5.05 1517 1277 A 11 ARG HA A 11 ARG HGx 1.0 . 3.74 1518 1278 A 53 GLU HA A 54 GLN H 1.0 . 2.71 1519 1279 A 24 ARG HA A 30 SER HBx 1.0 . 4.72 1520 1280 A 25 LEU H A 24 ARG HA 1.0 . 2.83 1521 1281 A 24 ARG HA A 24 ARG HGx 1.0 . 3.94 1522 1282 A 25 LEU HDy% A 24 ARG HA 1.0 . 5.34 1523 1283 A 69 SER HA A 70 VAL H 1.0 . 2.85 1524 1284 A 69 SER HA A 78 ARG HBx 1.0 . 4.85 1525 1284 A 78 ARG HBy A 69 SER HA 1.0 . 4.85 1526 1285 A 32 ASP H A 31 PHE HA 1.0 . 2.86 1527 1286 A 31 PHE HD% A 31 PHE HA 1.0 . 3.31 1528 1287 A 25 LEU HA A 24 ARG HA 1.0 . 4.51 1529 1288 A 69 SER HA A 78 ARG HA 1.0 . 3.31 1530 1289 A 69 SER HA A 68 VAL HA 1.0 . 4.69 1531 1290 A 77 CYS H A 71 TRP HA 1.0 . 4.20 1532 1291 A 76 LEU HA A 71 TRP HA 1.0 . 3.43 1533 1292 A 64 ALA HB% A 61 SER HA 1.0 . 4.56 1534 1293 A 86 LEU HDy% A 61 SER HA 1.0 . 4.36 1535 1294 A 18 LYS H A 17 GLN HA 1.0 . 2.66 1536 1295 A 17 GLN HGy A 17 GLN HA 1.0 . 3.76 1537 1296 A 17 GLN HA A 18 LYS HBy 1.0 . 4.50 1538 1297 A 17 GLN HA A 18 LYS HDx 1.0 . 4.63 1539 1297 A 17 GLN HA A 18 LYS HDy 1.0 . 4.63 1540 1298 A 76 LEU HBx A 71 TRP HA 1.0 . 4.94 1541 1299 A 95 ARG HA A 43 SER HA 1.0 . 4.35 1542 1300 A 62 GLU H A 61 SER HA 1.0 . 2.81 1543 1301 A 61 SER HA A 61 SER HBx 1.0 . 2.95 1544 1302 A 107 GLU HA A 108 TYR HD% 1.0 . 5.23 1545 1303 A 107 GLU HA A 107 GLU HGx 1.0 . 3.73 1546 1304 A 35 ALA HA A 49 LEU HA 1.0 . 3.19 1547 1305 A 9 TYR HD% A 43 SER HA 1.0 . 3.63 1548 1306 A 43 SER HA A 9 TYR HBx 1.0 . 4.44 1549 1307 A 43 SER HA A 96 LEU HBx 1.0 . 3.64 1550 1307 A 96 LEU HBy A 43 SER HA 1.0 . 3.64 1551 1308 A 105 ARG HA A 105 ARG HDx 1.0 . 3.92 1552 1308 A 105 ARG HDy A 105 ARG HA 1.0 . 3.92 1553 1309 A 90 ARG HA A 90 ARG HGy 1.0 . 3.79 1554 1310 A 92 PHE HD% A 90 ARG HA 1.0 . 4.55 1555 1311 A 107 GLU H A 106 ARG HA 1.0 . 3.24 1556 1312 A 106 ARG HA A 106 ARG HDx 1.0 . 4.19 1557 1312 A 106 ARG HDy A 106 ARG HA 1.0 . 4.19 1558 1313 A 106 ARG HA A 106 ARG HBx 1.0 . 2.96 1559 1313 A 106 ARG HBy A 106 ARG HA 1.0 . 2.96 1560 1314 A 106 ARG HA A 106 ARG HGx 1.0 . 3.55 1561 1314 A 106 ARG HGy A 106 ARG HA 1.0 . 3.55 1562 1315 A 90 ARG HA A 49 LEU HDy% 1.0 . 3.94 1563 1316 A 94 ILE HD1% A 96 LEU HA 1.0 . 5.46 1564 1317 A 86 LEU HDy% A 92 PHE HA 1.0 . 5.24 1565 1318 A 93 ALA H A 92 PHE HA 1.0 . 3.04 1566 1319 A 105 ARG HA A 105 ARG HGx 1.0 . 3.72 1567 1320 A 94 ILE HD1% A 94 ILE HA 1.0 . 4.18 1568 1321 A 94 ILE H A 94 ILE HD1% 1.0 . 4.45 1569 1322 A 45 ALA H A 94 ILE HD1% 1.0 . 4.35 1570 1323 A 94 ILE HD1% A 96 LEU HG 1.0 . 4.73 1571 1324 A 94 ILE HD1% A 96 LEU HDx% 1.0 . 3.61 1572 1325 A 12 TYR HBy A 13 PHE HA 1.0 . 4.53 1573 1326 A 13 PHE HA A 17 GLN HE2y 1.0 . 4.42 1574 1327 A 14 GLU H A 13 PHE HA 1.0 . 2.94 1575 1328 A 13 PHE HA A 17 GLN HE2x 1.0 . 3.87 1576 1329 A 18 LYS HA A 18 LYS HGx 1.0 . 3.70 1577 1330 A 18 LYS HA A 19 VAL H 1.0 . 2.89 1578 1331 A 18 LYS HA A 35 ALA H 1.0 . 4.42 1579 1332 A 78 ARG H A 102 GLU HA 1.0 . 4.09 1580 1333 A 102 GLU HA A 104 GLN H 1.0 . 4.69 1581 1334 A 27 ASP HBy A 27 ASP HA 1.0 . 2.97 1582 1335 A 13 PHE HA A 14 GLU HBx 1.0 . 5.04 1583 1336 A 91 GLN HA A 48 GLU HBx 1.0 . 4.54 1584 1336 A 48 GLU HBy A 91 GLN HA 1.0 . 4.54 1585 1337 A 88 ASP H A 91 GLN HA 1.0 . 5.05 1586 1338 A 18 LYS HA A 19 VAL HGy% 1.0 . 4.52 1587 1339 A 102 GLU HA A 103 LEU H 1.0 . 3.00 1588 1340 A 75 ALA HB% A 104 GLN HA 1.0 . 4.97 1589 1341 A 91 GLN HA A 92 PHE H 1.0 . 2.95 1590 1342 A 41 LYS HA A 41 LYS HGy 1.0 . 4.17 1591 1343 A 103 LEU HA A 103 LEU HBx 1.0 . 2.96 1592 1343 A 103 LEU HBy A 103 LEU HA 1.0 . 2.96 1593 1344 A 41 LYS HA A 42 GLY H 1.0 . 3.57 1594 1345 A 97 VAL H A 96 LEU HA 1.0 . 3.00 1595 1346 A 81 GLY HAy A 96 LEU HA 1.0 . 3.66 1596 1347 A 81 GLY HAx A 96 LEU HA 1.0 . 3.81 1597 1348 A 96 LEU HA A 68 VAL HGy% 1.0 . 5.49 1598 1349 A 40 LEU HA A 45 ALA H 1.0 . 5.12 1599 1350 A 40 LEU H A 41 LYS HA 1.0 . 4.97 1600 1351 A 96 LEU HA A 81 GLY H 1.0 . 5.19 1601 1352 A 87 ARG H A 86 LEU HA 1.0 . 2.91 1602 1353 A 100 VAL H A 99 ARG HA 1.0 . 2.87 1603 1354 A 67 SER HBx A 80 ASP HA 1.0 . 4.58 1604 1355 A 68 VAL HGy% A 80 ASP HA 1.0 . 5.11 1605 1356 A 81 GLY H A 80 ASP HA 1.0 . 3.05 1606 1357 A 67 SER HBy A 80 ASP HA 1.0 . 4.46 1607 1358 A 79 CYS HA A 80 ASP HA 1.0 . 4.56 1608 1359 A 60 LEU H A 58 ASN HA 1.0 . 4.71 1609 1360 A 58 ASN HA A 58 ASN HBy 1.0 . 2.98 1610 1361 A 86 LEU HA A 86 LEU HG 1.0 . 3.48 1611 1362 A 100 VAL HGx% A 101 ARG HA 1.0 . 4.65 1612 1363 A 61 SER H A 60 LEU HA 1.0 . 2.80 1613 1364 A 61 SER HA A 60 LEU HA 1.0 . 4.72 1614 1365 A 60 LEU HG A 60 LEU HA 1.0 . 4.18 1615 1366 A 86 LEU HDx% A 60 LEU HA 1.0 . 4.38 1616 1367 A 79 CYS HBy A 78 ARG HA 1.0 . 5.00 1617 1368 A 48 GLU HA A 49 LEU H 1.0 . 3.00 1618 1369 A 48 GLU HA A 91 GLN HA 1.0 . 3.41 1619 1370 A 48 GLU HA A 48 GLU HGx 1.0 . 3.62 1620 1371 A 14 GLU HA A 15 GLN H 1.0 . 2.81 1621 1372 A 100 VAL HGx% A 78 ARG HA 1.0 . 5.50 1622 1373 A 79 CYS HA A 78 ARG HA 1.0 . 5.13 1623 1374 A 78 ARG HA A 13 PHE HZ 1.0 . 5.28 1624 1375 A 78 ARG HA A 78 ARG HDx 1.0 . 5.08 1625 1375 A 78 ARG HDy A 78 ARG HA 1.0 . 5.08 1626 1376 A 90 ARG H A 88 ASP HA 1.0 . 4.07 1627 1377 A 89 ASP H A 88 ASP HA 1.0 . 3.30 1628 1378 A 78 ARG HA A 103 LEU HDx% 1.0 . 5.27 1629 1378 A 103 LEU HDy% A 78 ARG HA 1.0 . 5.27 1630 1379 A 68 VAL H A 78 ARG HA 1.0 . 5.27 1631 1380 A 82 ARG HA A 65 GLU HBx 1.0 . 5.19 1632 1381 A 45 ALA H A 44 LEU HA 1.0 . 2.93 1633 1382 A 72 THR H A 76 LEU HA 1.0 . 4.15 1634 1383 A 77 CYS H A 76 LEU HA 1.0 . 3.04 1635 1384 A 77 CYS HBx A 76 LEU HA 1.0 . 4.82 1636 1385 A 37 ILE HD1% A 38 THR H 1.0 . 5.41 1637 1386 A 15 GLN H A 37 ILE HD1% 1.0 . 5.38 1638 1387 A 37 ILE HD1% A 13 PHE HE% 1.0 . 5.31 1639 1388 A 37 ILE H A 37 ILE HD1% 1.0 . 4.06 1640 1389 A 14 GLU H A 37 ILE HD1% 1.0 . 3.67 1641 1390 A 13 PHE HD% A 37 ILE HD1% 1.0 . 3.90 1642 1391 A 13 PHE HA A 37 ILE HD1% 1.0 . 4.51 1643 1392 A 37 ILE HD1% A 37 ILE HA 1.0 . 4.02 1644 1393 A 37 ILE HD1% A 15 GLN HA 1.0 . 5.31 1645 1394 A 13 PHE HBy A 37 ILE HD1% 1.0 . 3.50 1646 1395 A 37 ILE HD1% A 13 PHE HBx 1.0 . 4.06 1647 1396 A 17 GLN HBy A 37 ILE HD1% 1.0 . 3.94 1648 1397 A 37 ILE HB A 37 ILE HD1% 1.0 . 3.31 1649 1398 A 37 ILE HD1% A 19 VAL HGy% 1.0 . 3.75 1650 1399 A 47 LEU HDy% A 37 ILE HD1% 1.0 . 3.97 1651 1400 A 82 ARG HA A 83 VAL H 1.0 . 2.89 1652 1401 A 82 ARG HA A 66 VAL H 1.0 . 3.72 1653 1402 A 82 ARG HA A 65 GLU HA 1.0 . 3.39 1654 1403 A 82 ARG HA A 66 VAL HGx% 1.0 . 4.17 1655 1404 A 95 ARG HA A 44 LEU HA 1.0 . 3.52 1656 1405 A 21 LEU HDy% A 21 LEU HA 1.0 . 4.42 1657 1406 A 66 VAL HGy% A 21 LEU HA 1.0 . 4.88 1658 1407 A 25 LEU HA A 24 ARG HGy 1.0 . 4.14 1659 1408 A 48 GLU H A 47 LEU HA 1.0 . 3.01 1660 1409 A 38 THR H A 47 LEU HA 1.0 . 3.67 1661 1410 A 47 LEU HA A 37 ILE HA 1.0 . 3.47 1662 1411 A 47 LEU HA A 48 GLU HBx 1.0 . 4.56 1663 1411 A 48 GLU HBy A 47 LEU HA 1.0 . 4.56 1664 1412 A 19 VAL HB A 20 ASN HA 1.0 . 5.00 1665 1413 A 55 PRO HDy A 54 GLN HA 1.0 . 3.24 1666 1414 A 55 PRO HDx A 54 GLN HA 1.0 . 3.03 1667 1415 A 49 LEU HDy% A 54 GLN HA 1.0 . 3.86 1668 1416 A 25 LEU HA A 25 LEU HG 1.0 . 3.43 1669 1417 A 25 LEU HA A 25 LEU HDx% 1.0 . 4.31 1670 1418 A 64 ALA HA A 83 VAL HGx% 1.0 . 5.07 1671 1419 A 65 GLU H A 64 ALA HA 1.0 . 2.64 1672 1420 A 23 VAL HGy% A 32 ASP HA 1.0 . 4.89 1673 1421 A 23 VAL H A 32 ASP HA 1.0 . 4.26 1674 1422 A 21 LEU H A 32 ASP HA 1.0 . 4.52 1675 1423 A 22 THR HG2% A 32 ASP HA 1.0 . 4.74 1676 1424 A 21 LEU HBx A 32 ASP HA 1.0 . 4.23 1677 1425 A 95 ARG HA A 95 ARG HGx 1.0 . 3.45 1678 1426 A 12 TYR HD% A 77 CYS HBy 1.0 . 4.26 1679 1427 A 12 TYR H A 12 TYR HD% 1.0 . 3.12 1680 1428 A 12 TYR HD% A 9 TYR HA 1.0 . 3.27 1681 1429 A 12 TYR HD% A 12 TYR HA 1.0 . 3.08 1682 1430 A 12 TYR HD% A 100 VAL HGy% 1.0 . 3.23 1683 1431 A 12 TYR HD% A 100 VAL HGx% 1.0 . 3.43 1684 1432 A 11 ARG HA A 12 TYR HD% 1.0 . 4.86 1685 1433 A 12 TYR HD% A 11 ARG HBy 1.0 . 4.08 1686 1434 A 12 TYR HD% A 11 ARG H 1.0 . 4.74 1687 1435 A 108 TYR H A 108 TYR HD% 1.0 . 3.81 1688 1436 A 108 TYR HD% A 108 TYR HA 1.0 . 3.15 1689 1437 A 47 LEU H A 92 PHE HD% 1.0 . 4.43 1690 1438 A 92 PHE HD% A 91 GLN HA 1.0 . 4.06 1691 1439 A 92 PHE HD% A 83 VAL HA 1.0 . 4.47 1692 1440 A 92 PHE HD% A 93 ALA H 1.0 . 3.75 1693 1441 A 92 PHE HD% A 86 LEU HDy% 1.0 . 3.12 1694 1442 A 92 PHE HD% A 92 PHE HA 1.0 . 3.95 1695 1443 A 60 LEU HDy% A 92 PHE HD% 1.0 . 4.51 1696 1444 A 92 PHE HD% A 88 ASP H 1.0 . 4.53 1697 1445 A 9 TYR HBy A 13 PHE HD% 1.0 . 3.28 1698 1446 A 13 PHE H A 13 PHE HD% 1.0 . 3.17 1699 1447 A 13 PHE HD% A 13 PHE HA 1.0 . 2.94 1700 1448 A 13 PHE HD% A 9 TYR HA 1.0 . 3.77 1701 1449 A 12 TYR HBy A 13 PHE HD% 1.0 . 3.63 1702 1450 A 13 PHE HD% A 19 VAL HGx% 1.0 . 3.16 1703 1451 A 13 PHE HD% A 96 LEU HDy% 1.0 . 3.26 1704 1452 A 44 LEU H A 9 TYR HD% 1.0 . 4.49 1705 1453 A 9 TYR HD% A 10 GLY H 1.0 . 4.47 1706 1454 A 9 TYR H A 9 TYR HD% 1.0 . 3.17 1707 1455 A 9 TYR HD% A 96 LEU HBx 1.0 . 3.60 1708 1455 A 9 TYR HD% A 96 LEU HBy 1.0 . 3.60 1709 1456 A 9 TYR HD% A 9 TYR HA 1.0 . 2.73 1710 1457 A 9 TYR HD% A 43 SER HBx 1.0 . 3.38 1711 1458 A 9 TYR HD% A 100 VAL HGy% 1.0 . 2.93 1712 1459 A 9 TYR HD% A 96 LEU HDy% 1.0 . 3.30 1713 1460 A 13 PHE HD% A 68 VAL HB 1.0 . 4.81 1714 1461 A 109 PHE H A 109 PHE HD% 1.0 . 3.68 1715 1462 A 109 PHE HD% A 109 PHE HA 1.0 . 3.80 1716 1463 A 9 TYR HD% A 100 VAL HGx% 1.0 . 4.37 1717 1464 A 36 ALA H A 50 PHE HD% 1.0 . 4.04 1718 1465 A 50 PHE HD% A 50 PHE H 1.0 . 4.14 1719 1466 A 50 PHE HD% A 35 ALA HA 1.0 . 3.73 1720 1467 A 50 PHE HD% A 50 PHE HA 1.0 . 3.88 1721 1468 A 31 PHE HD% A 23 VAL H 1.0 . 4.23 1722 1469 A 50 PHE HD% A 18 LYS HGy 1.0 . 3.94 1723 1470 A 50 PHE HD% A 36 ALA HB% 1.0 . 3.43 1724 1471 A 31 PHE HD% A 55 PRO HA 1.0 . 3.87 1725 1472 A 31 PHE HD% A 23 VAL HGy% 1.0 . 3.00 1726 1473 A 31 PHE HD% A 31 PHE H 1.0 . 4.35 1727 1474 A 31 PHE HD% A 32 ASP H 1.0 . 3.91 1728 1475 A 31 PHE HD% A 23 VAL HB 1.0 . 3.76 1729 1476 A 18 LYS HGx A 50 PHE HE% 1.0 . 3.73 1730 1477 A 35 ALA HA A 50 PHE HE% 1.0 . 4.44 1731 1478 A 50 PHE HE% A 18 LYS HDx 1.0 . 4.00 1732 1478 A 50 PHE HE% A 18 LYS HDy 1.0 . 4.00 1733 1479 A 36 ALA H A 50 PHE HE% 1.0 . 4.03 1734 1480 A 68 VAL HB A 13 PHE HE% 1.0 . 4.34 1735 1481 A 79 CYS HBy A 13 PHE HE% 1.0 . 3.88 1736 1482 A 69 SER H A 13 PHE HE% 1.0 . 4.79 1737 1483 A 70 VAL HB A 13 PHE HE% 1.0 . 3.70 1738 1484 A 13 PHE H A 13 PHE HE% 1.0 . 4.67 1739 1485 A 13 PHE HE% A 13 PHE HZ 1.0 . 2.40 1740 1486 A 79 CYS HBx A 13 PHE HE% 1.0 . 3.72 1741 1487 A 70 VAL HGx% A 13 PHE HE% 1.0 . 4.52 1742 1488 A 100 VAL HGy% A 13 PHE HE% 1.0 . 3.05 1743 1489 A 70 VAL HGy% A 13 PHE HE% 1.0 . 3.12 1744 1490 A 68 VAL HGx% A 13 PHE HE% 1.0 . 3.81 1745 1491 A 96 LEU HDy% A 13 PHE HE% 1.0 . 4.02 1746 1492 A 100 VAL HGx% A 13 PHE HE% 1.0 . 4.12 1747 1493 A 68 VAL HGy% A 13 PHE HE% 1.0 . 3.65 1748 1494 A 90 ARG HA A 92 PHE HE% 1.0 . 4.07 1749 1495 A 92 PHE HE% A 49 LEU HG 1.0 . 3.59 1750 1496 A 92 PHE HE% A 94 ILE HG2% 1.0 . 3.14 1751 1497 A 92 PHE HE% A 47 LEU HDx% 1.0 . 3.01 1752 1498 A 69 SER HA A 13 PHE HE% 1.0 . 4.42 1753 1499 A 9 TYR HBy A 13 PHE HE% 1.0 . 4.61 1754 1500 A 92 PHE HE% A 49 LEU H 1.0 . 4.71 1755 1501 A 60 LEU HDy% A 92 PHE HE% 1.0 . 4.42 1756 1502 A 92 PHE HE% A 92 PHE H 1.0 . 4.73 1757 1503 A 69 SER HA A 13 PHE HZ 1.0 . 4.50 1758 1504 A 13 PHE HD% A 13 PHE HZ 1.0 . 3.76 1759 1505 A 79 CYS HBy A 13 PHE HZ 1.0 . 3.70 1760 1506 A 79 CYS HBx A 13 PHE HZ 1.0 . 4.13 1761 1507 A 49 LEU HG A 92 PHE HZ 1.0 . 4.33 1762 1508 A 68 VAL HGx% A 13 PHE HZ 1.0 . 4.12 1763 1509 A 100 VAL HGx% A 13 PHE HZ 1.0 . 4.12 1764 1510 A 79 CYS H A 13 PHE HZ 1.0 . 4.60 1765 1511 A 68 VAL HB A 13 PHE HZ 1.0 . 4.29 1766 1512 A 70 VAL HGy% A 13 PHE HZ 1.0 . 3.78 1767 1513 A 60 LEU HDy% A 92 PHE HZ 1.0 . 4.38 1768 1514 A 71 TRP HA A 71 TRP HD1 1.0 . 4.23 1769 1515 A 71 TRP H A 71 TRP HD1 1.0 . 3.38 1770 1516 A 76 LEU HA A 71 TRP HD1 1.0 . 5.36 1771 1517 A 71 TRP HBx A 71 TRP HD1 1.0 . 3.22 1772 1518 A 70 VAL HA A 71 TRP HD1 1.0 . 3.79 1773 1519 A 70 VAL HGx% A 71 TRP HD1 1.0 . 4.62 1774 1520 A 76 LEU HDx% A 71 TRP HD1 1.0 . 3.61 1775 1521 A 46 TRP H A 46 TRP HD1 1.0 . 3.71 1776 1522 A 46 TRP HD1 A 39 SER HBx 1.0 . 3.46 1777 1522 A 39 SER HBy A 46 TRP HD1 1.0 . 3.46 1778 1523 A 46 TRP HBy A 46 TRP HD1 1.0 . 3.82 1779 1524 A 46 TRP HBx A 46 TRP HD1 1.0 . 3.44 1780 1525 A 44 LEU HDy% A 46 TRP HD1 1.0 . 3.65 1781 1526 A 93 ALA HB% A 46 TRP HD1 1.0 . 4.12 1782 1527 A 46 TRP HA A 46 TRP HD1 1.0 . 4.06 1783 1528 A 44 LEU HDx% A 46 TRP HD1 1.0 . 4.28 1784 1529 A 45 ALA HA A 46 TRP HD1 1.0 . 4.36 1785 1530 A 106 ARG HA A 71 TRP HH2 1.0 . 4.82 1786 1531 A 71 TRP HH2 A 106 ARG HBx 1.0 . 4.41 1787 1531 A 106 ARG HBy A 71 TRP HH2 1.0 . 4.41 1788 1532 A 71 TRP HH2 A 106 ARG HGx 1.0 . 4.66 1789 1532 A 106 ARG HGy A 71 TRP HH2 1.0 . 4.66 1790 1533 A 76 LEU HBx A 71 TRP HH2 1.0 . 4.52 1791 1534 A 76 LEU H A 71 TRP HH2 1.0 . 4.78 1792 1535 A 46 TRP HH2 A 93 ALA HB% 1.0 . 4.18 1793 1536 A 46 TRP HH2 A 87 ARG H 1.0 . 4.64 1794 1537 A 46 TRP HH2 A 87 ARG HBx 1.0 . 3.41 1795 1538 A 46 TRP HH2 A 92 PHE HA 1.0 . 4.42 1796 1539 A 46 TRP HH2 A 85 THR HG2% 1.0 . 3.07 1797 1540 A 76 LEU HBx A 71 TRP HZ3 1.0 . 4.62 1798 1541 A 76 LEU HBy A 71 TRP HZ3 1.0 . 4.63 1799 1542 A 76 LEU H A 71 TRP HZ3 1.0 . 4.00 1800 1543 A 105 ARG HA A 71 TRP HZ3 1.0 . 4.04 1801 1544 A 71 TRP HZ3 A 106 ARG HBx 1.0 . 4.10 1802 1544 A 106 ARG HBy A 71 TRP HZ3 1.0 . 4.10 1803 1545 A 71 TRP HZ3 A 106 ARG H 1.0 . 4.37 1804 1546 A 75 ALA HA A 71 TRP HZ3 1.0 . 3.64 1805 1547 A 71 TRP HZ3 A 106 ARG HGx 1.0 . 4.49 1806 1547 A 106 ARG HGy A 71 TRP HZ3 1.0 . 4.49 1807 1548 A 71 TRP HZ3 A 106 ARG HDx 1.0 . 4.55 1808 1548 A 106 ARG HDy A 71 TRP HZ3 1.0 . 4.55 1809 1549 A 47 LEU H A 46 TRP HE3 1.0 . 4.16 1810 1550 A 46 TRP HE3 A 93 ALA H 1.0 . 4.62 1811 1551 A 46 TRP HE3 A 92 PHE H 1.0 . 4.25 1812 1552 A 71 TRP HE3 A 76 LEU HDx% 1.0 . 3.99 1813 1553 A 71 TRP HE3 A 71 TRP HA 1.0 . 3.49 1814 1554 A 75 ALA HA A 71 TRP HE3 1.0 . 4.42 1815 1555 A 71 TRP HE3 A 71 TRP HBy 1.0 . 3.25 1816 1556 A 71 TRP HE3 A 76 LEU HA 1.0 . 3.89 1817 1557 A 76 LEU HBx A 71 TRP HE3 1.0 . 4.02 1818 1558 A 46 TRP HZ3 A 92 PHE H 1.0 . 4.37 1819 1559 A 46 TRP HZ3 A 87 ARG HBy 1.0 . 4.28 1820 1560 A 46 TRP HZ3 A 87 ARG H 1.0 . 3.97 1821 1561 A 46 TRP HZ3 A 93 ALA HB% 1.0 . 4.75 1822 1562 A 46 TRP HA A 46 TRP HE3 1.0 . 4.38 1823 1563 A 46 TRP HBx A 46 TRP HE3 1.0 . 4.18 1824 1564 A 87 ARG HBy A 46 TRP HE3 1.0 . 4.42 1825 1565 A 46 TRP HE3 A 92 PHE HA 1.0 . 4.17 1826 1566 A 46 TRP HE3 A 46 TRP HBy 1.0 . 3.87 1827 1567 A 71 TRP HE3 A 106 ARG HGx 1.0 . 4.79 1828 1567 A 71 TRP HE3 A 106 ARG HGy 1.0 . 4.79 1829 1568 A 76 LEU H A 71 TRP HE3 1.0 . 4.34 1830 1569 A 46 TRP HZ3 A 87 ARG HDx 1.0 . 4.19 1831 1570 A 46 TRP HZ3 A 92 PHE HA 1.0 . 3.90 1832 1571 A 9 TYR HE% A 100 VAL H 1.0 . 4.28 1833 1572 A 9 TYR HE% A 99 ARG HDx 1.0 . 5.14 1834 1572 A 9 TYR HE% A 99 ARG HDy 1.0 . 5.14 1835 1573 A 9 TYR HE% A 43 SER HBy 1.0 . 3.32 1836 1574 A 9 TYR HE% A 43 SER HA 1.0 . 3.44 1837 1575 A 9 TYR HE% A 43 SER HBx 1.0 . 3.10 1838 1576 A 9 TYR HE% A 100 VAL HGy% 1.0 . 3.15 1839 1577 A 9 TYR HE% A 96 LEU HBx 1.0 . 3.44 1840 1577 A 9 TYR HE% A 96 LEU HBy 1.0 . 3.44 1841 1578 A 9 TYR HE% A 96 LEU HDy% 1.0 . 3.84 1842 1579 A 100 VAL HGy% A 12 TYR HE% 1.0 . 3.60 1843 1580 A 11 ARG HBy A 12 TYR HE% 1.0 . 4.00 1844 1581 A 12 TYR HE% A 11 ARG HDx 1.0 . 4.02 1845 1581 A 11 ARG HDy A 12 TYR HE% 1.0 . 4.02 1846 1582 A 100 VAL HB A 12 TYR HE% 1.0 . 3.15 1847 1583 A 100 VAL HGx% A 12 TYR HE% 1.0 . 3.51 1848 1584 A 12 TYR HE% A 11 ARG HGx 1.0 . 4.57 1849 1585 A 12 TYR HE% A 9 TYR HA 1.0 . 4.64 1850 1586 A 76 LEU HBx A 71 TRP HZ2 1.0 . 4.64 1851 1587 A 76 LEU HDx% A 71 TRP HZ2 1.0 . 4.20 1852 1588 A 76 LEU HDy% A 71 TRP HZ2 1.0 . 3.72 1853 1589 A 85 THR HG2% A 46 TRP HZ2 1.0 . 3.14 1854 1590 A 93 ALA HB% A 46 TRP HZ2 1.0 . 3.64 1855 1591 A 87 ARG HBx A 46 TRP HZ2 1.0 . 4.78 1856 1592 A 44 LEU HDy% A 46 TRP HZ2 1.0 . 4.37 1857 1593 A 84 GLU H A 94 ILE HA 1.0 . 4.40 1858 1594 A 95 ARG H A 84 GLU H 1.0 . 4.43 1859 1595 A 85 THR H A 84 GLU H 1.0 . 3.79 1860 1596 A 84 GLU HGy A 84 GLU H 1.0 . 5.36 1861 1597 A 83 VAL HGy% A 84 GLU H 1.0 . 4.09 1862 1598 A 96 LEU H A 95 ARG HGx 1.0 . 5.05 1863 1599 A 44 LEU HDx% A 96 LEU H 1.0 . 5.07 1864 1600 A 95 ARG HA A 96 LEU H 1.0 . 3.25 1865 1601 A 96 LEU H A 43 SER HBy 1.0 . 4.01 1866 1602 A 96 LEU H A 96 LEU HBx 1.0 . 3.40 1867 1602 A 96 LEU HBy A 96 LEU H 1.0 . 3.40 1868 1603 A 96 LEU H A 43 SER HA 1.0 . 4.58 1869 1604 A 85 THR HG2% A 46 TRP HE1 1.0 . 5.50 1870 1605 A 41 LYS H A 45 ALA H 1.0 . 5.28 1871 1606 A 41 LYS H A 40 LEU H 1.0 . 4.57 1872 1607 A 45 ALA HA A 41 LYS H 1.0 . 4.18 1873 1608 A 40 LEU HA A 41 LYS H 1.0 . 2.89 1874 1609 A 41 LYS H A 41 LYS HBx 1.0 . 3.48 1875 1610 A 41 LYS H A 44 LEU HBx 1.0 . 4.21 1876 1611 A 41 LYS H A 46 TRP HD1 1.0 . 5.50 1877 1612 A 41 LYS H A 44 LEU HBy 1.0 . 4.69 1878 1613 A 41 LYS H A 45 ALA HB% 1.0 . 5.50 1879 1614 A 44 LEU HDy% A 41 LYS H 1.0 . 4.82 1880 1615 A 44 LEU HG A 46 TRP HE1 1.0 . 5.50 1881 1616 A 97 VAL H A 80 ASP H 1.0 . 5.32 1882 1617 A 80 ASP H A 81 GLY H 1.0 . 4.83 1883 1618 A 80 ASP H A 80 ASP HBy 1.0 . 3.86 1884 1619 A 80 ASP H A 80 ASP HBx 1.0 . 3.39 1885 1620 A 100 VAL HA A 80 ASP H 1.0 . 5.50 1886 1621 A 79 CYS HBx A 80 ASP H 1.0 . 4.62 1887 1622 A 67 SER HA A 80 ASP H 1.0 . 5.34 1888 1623 A 87 ARG H A 86 LEU H 1.0 . 4.75 1889 1624 A 86 LEU H A 85 THR H 1.0 . 4.68 1890 1625 A 86 LEU H A 92 PHE HBy 1.0 . 4.99 1891 1626 A 86 LEU H A 86 LEU HBx 1.0 . 3.31 1892 1627 A 86 LEU H A 86 LEU HDx% 1.0 . 4.95 1893 1628 A 86 LEU H A 92 PHE HBx 1.0 . 5.50 1894 1629 A 48 GLU H A 49 LEU H 1.0 . 5.50 1895 1630 A 49 LEU H A 91 GLN HA 1.0 . 4.31 1896 1631 A 49 LEU H A 49 LEU HG 1.0 . 3.54 1897 1632 A 49 LEU HDy% A 49 LEU H 1.0 . 4.57 1898 1633 A 49 LEU HBx A 49 LEU H 1.0 . 3.53 1899 1634 A 24 ARG H A 30 SER HA 1.0 . 5.50 1900 1635 A 25 LEU H A 24 ARG H 1.0 . 4.90 1901 1636 A 24 ARG H A 66 VAL HA 1.0 . 4.08 1902 1637 A 24 ARG H A 23 VAL HA 1.0 . 3.01 1903 1638 A 24 ARG H A 24 ARG HBy 1.0 . 3.48 1904 1639 A 32 ASP H A 31 PHE H 1.0 . 4.88 1905 1640 A 33 GLY H A 32 ASP H 1.0 . 4.74 1906 1641 A 32 ASP H A 32 ASP HBx 1.0 . 3.50 1907 1642 A 101 ARG H A 77 CYS HA 1.0 . 5.18 1908 1643 A 79 CYS HBx A 101 ARG H 1.0 . 5.50 1909 1644 A 101 ARG H A 101 ARG HBx 1.0 . 3.42 1910 1644 A 101 ARG HBy A 101 ARG H 1.0 . 3.42 1911 1645 A 100 VAL HGy% A 101 ARG H 1.0 . 5.02 1912 1646 A 101 ARG H A 99 ARG HDx 1.0 . 5.50 1913 1646 A 99 ARG HDy A 101 ARG H 1.0 . 5.50 1914 1647 A 102 GLU H A 101 ARG H 1.0 . 5.15 1915 1648 A 71 TRP H A 76 LEU HA 1.0 . 5.50 1916 1649 A 71 TRP H A 71 TRP HBx 1.0 . 3.41 1917 1650 A 40 LEU H A 39 SER HA 1.0 . 2.88 1918 1651 A 40 LEU H A 39 SER HBx 1.0 . 3.54 1919 1651 A 40 LEU H A 39 SER HBy 1.0 . 3.54 1920 1652 A 40 LEU H A 15 GLN HGx 1.0 . 4.82 1921 1652 A 40 LEU H A 15 GLN HGy 1.0 . 4.82 1922 1653 A 40 LEU HBy A 40 LEU H 1.0 . 3.57 1923 1654 A 103 LEU H A 102 GLU HGx 1.0 . 4.76 1924 1654 A 103 LEU H A 102 GLU HGy 1.0 . 4.76 1925 1655 A 103 LEU H A 104 GLN H 1.0 . 3.81 1926 1656 A 103 LEU H A 103 LEU HBx 1.0 . 3.21 1927 1656 A 103 LEU HBy A 103 LEU H 1.0 . 3.21 1928 1657 A 75 ALA HB% A 103 LEU H 1.0 . 5.34 1929 1658 A 40 LEU H A 39 SER H 1.0 . 4.39 1930 1659 A 40 LEU H A 37 ILE HG2% 1.0 . 5.24 1931 1660 A 78 ARG H A 103 LEU H 1.0 . 5.08 1932 1661 A 103 LEU H A 102 GLU H 1.0 . 5.44 1933 1662 A 95 ARG H A 95 ARG HBy 1.0 . 3.59 1934 1663 A 95 ARG H A 44 LEU HDx% 1.0 . 4.72 1935 1664 A 95 ARG H A 83 VAL HA 1.0 . 4.44 1936 1665 A 95 ARG H A 96 LEU HDx% 1.0 . 5.50 1937 1666 A 21 LEU H A 20 ASN HA 1.0 . 2.79 1938 1667 A 21 LEU H A 20 ASN HBy 1.0 . 3.94 1939 1668 A 21 LEU HBx A 21 LEU H 1.0 . 3.63 1940 1669 A 21 LEU H A 21 LEU HDy% 1.0 . 5.41 1941 1670 A 70 VAL HGy% A 77 CYS H 1.0 . 5.15 1942 1671 A 76 LEU HBx A 77 CYS H 1.0 . 4.50 1943 1672 A 77 CYS H A 72 THR H 1.0 . 5.05 1944 1673 A 69 SER HA A 77 CYS H 1.0 . 5.25 1945 1674 A 76 LEU HDx% A 77 CYS H 1.0 . 4.06 1946 1675 A 25 LEU H A 29 GLY H 1.0 . 4.36 1947 1676 A 25 LEU H A 24 ARG HDx 1.0 . 5.34 1948 1676 A 25 LEU H A 24 ARG HDy 1.0 . 5.34 1949 1677 A 25 LEU H A 24 ARG HBx 1.0 . 4.81 1950 1678 A 25 LEU H A 24 ARG HGx 1.0 . 4.44 1951 1679 A 25 LEU H A 25 LEU HBy 1.0 . 3.33 1952 1680 A 25 LEU H A 31 PHE H 1.0 . 4.75 1953 1681 A 109 PHE H A 108 TYR H 1.0 . 3.95 1954 1682 A 109 PHE H A 108 TYR HD% 1.0 . 5.50 1955 1683 A 109 PHE H A 107 GLU HBy 1.0 . 5.50 1956 1684 A 109 PHE H A 108 TYR HA 1.0 . 3.10 1957 1685 A 109 PHE H A 107 GLU HA 1.0 . 5.42 1958 1686 A 109 PHE H A 109 PHE HBx 1.0 . 3.57 1959 1687 A 109 PHE H A 108 TYR HBx 1.0 . 4.18 1960 1688 A 79 CYS H A 68 VAL HGx% 1.0 . 5.50 1961 1689 A 79 CYS H A 68 VAL HA 1.0 . 4.74 1962 1690 A 79 CYS H A 79 CYS HBy 1.0 . 4.01 1963 1691 A 79 CYS H A 79 CYS HBx 1.0 . 4.20 1964 1692 A 79 CYS H A 100 VAL HGy% 1.0 . 5.50 1965 1693 A 77 CYS H A 69 SER HBx 1.0 . 5.23 1966 1693 A 69 SER HBy A 77 CYS H 1.0 . 5.23 1967 1694 A 77 CYS H A 76 LEU HDy% 1.0 . 5.50 1968 1695 A 23 VAL H A 22 THR HB 1.0 . 4.38 1969 1696 A 23 VAL H A 23 VAL HB 1.0 . 3.66 1970 1697 A 23 VAL H A 22 THR H 1.0 . 4.77 1971 1698 A 23 VAL H A 24 ARG H 1.0 . 4.75 1972 1699 A 23 VAL H A 31 PHE HBx 1.0 . 4.44 1973 1700 A 79 CYS H A 100 VAL HGx% 1.0 . 5.50 1974 1701 A 79 CYS H A 78 ARG H 1.0 . 4.70 1975 1702 A 79 CYS H A 13 PHE HE% 1.0 . 5.50 1976 1703 A 79 CYS H A 69 SER HA 1.0 . 4.21 1977 1704 A 79 CYS H A 78 ARG HA 1.0 . 3.01 1978 1705 A 79 CYS H A 78 ARG HGy 1.0 . 3.63 1979 1706 A 79 CYS H A 69 SER HBx 1.0 . 4.76 1980 1706 A 79 CYS H A 69 SER HBy 1.0 . 4.76 1981 1707 A 49 LEU HA A 35 ALA H 1.0 . 5.36 1982 1708 A 19 VAL H A 35 ALA H 1.0 . 3.67 1983 1709 A 34 THR HA A 35 ALA H 1.0 . 2.82 1984 1710 A 34 THR HB A 35 ALA H 1.0 . 3.78 1985 1711 A 35 ALA H A 21 LEU HDy% 1.0 . 4.27 1986 1712 A 36 ALA H A 35 ALA H 1.0 . 4.35 1987 1713 A 100 VAL H A 12 TYR HE% 1.0 . 5.50 1988 1714 A 76 LEU H A 77 CYS H 1.0 . 4.95 1989 1715 A 76 LEU H A 104 GLN HBx 1.0 . 5.29 1990 1716 A 76 LEU H A 105 ARG HGx 1.0 . 4.84 1991 1717 A 76 LEU H A 76 LEU HBx 1.0 . 3.67 1992 1718 A 76 LEU H A 105 ARG HA 1.0 . 4.41 1993 1719 A 76 LEU H A 104 GLN HA 1.0 . 5.50 1994 1720 A 37 ILE HB A 38 THR H 1.0 . 5.22 1995 1721 A 38 THR H A 37 ILE HG1y 1.0 . 5.50 1996 1722 A 37 ILE H A 38 THR H 1.0 . 5.09 1997 1723 A 38 THR H A 37 ILE HA 1.0 . 3.05 1998 1724 A 36 ALA HA A 35 ALA H 1.0 . 5.26 1999 1725 A 50 PHE HE% A 35 ALA H 1.0 . 5.50 2000 1726 A 9 TYR HD% A 100 VAL H 1.0 . 5.03 2001 1727 A 100 VAL H A 99 ARG HBy 1.0 . 3.79 2002 1728 A 99 ARG HBx A 100 VAL H 1.0 . 4.26 2003 1729 A 100 VAL H A 100 VAL HB 1.0 . 3.26 2004 1730 A 100 VAL H A 100 VAL HGx% 1.0 . 4.58 2005 1731 A 92 PHE HD% A 87 ARG H 1.0 . 5.50 2006 1732 A 87 ARG H A 85 THR HG2% 1.0 . 5.50 2007 1733 A 87 ARG H A 91 GLN H 1.0 . 4.99 2008 1734 A 87 ARG H A 92 PHE HA 1.0 . 3.77 2009 1735 A 87 ARG H A 92 PHE HBy 1.0 . 4.21 2010 1736 A 87 ARG HBy A 87 ARG H 1.0 . 3.62 2011 1737 A 86 LEU HBy A 87 ARG H 1.0 . 4.09 2012 1738 A 87 ARG H A 86 LEU HG 1.0 . 4.55 2013 1739 A 76 LEU H A 104 GLN HGx 1.0 . 5.50 2014 1739 A 76 LEU H A 104 GLN HGy 1.0 . 5.50 2015 1740 A 44 LEU H A 45 ALA H 1.0 . 4.51 2016 1741 A 41 LYS H A 44 LEU H 1.0 . 4.00 2017 1742 A 44 LEU H A 43 SER H 1.0 . 3.23 2018 1743 A 44 LEU H A 9 TYR HE% 1.0 . 5.50 2019 1744 A 42 GLY HAx A 44 LEU H 1.0 . 4.91 2020 1745 A 44 LEU H A 44 LEU HBy 1.0 . 3.32 2021 1746 A 44 LEU H A 41 LYS HBy 1.0 . 5.50 2022 1747 A 44 LEU H A 44 LEU HBx 1.0 . 3.53 2023 1748 A 44 LEU HDy% A 44 LEU H 1.0 . 5.06 2024 1749 A 44 LEU H A 43 SER HBx 1.0 . 5.50 2025 1750 A 46 TRP HBx A 38 THR H 1.0 . 5.16 2026 1751 A 46 TRP H A 93 ALA HA 1.0 . 5.50 2027 1752 A 46 TRP H A 46 TRP HBy 1.0 . 3.81 2028 1753 A 46 TRP H A 41 LYS H 1.0 . 5.31 2029 1754 A 46 TRP H A 40 LEU HA 1.0 . 4.19 2030 1755 A 46 TRP HBx A 46 TRP H 1.0 . 3.47 2031 1756 A 46 TRP H A 47 LEU H 1.0 . 4.63 2032 1757 A 46 TRP H A 38 THR H 1.0 . 4.89 2033 1758 A 58 ASN H A 60 LEU H 1.0 . 4.79 2034 1759 A 59 THR HB A 60 LEU H 1.0 . 3.66 2035 1760 A 61 SER H A 60 LEU H 1.0 . 4.59 2036 1761 A 60 LEU HBy A 60 LEU H 1.0 . 3.39 2037 1762 A 60 LEU H A 60 LEU HBx 1.0 . 3.59 2038 1763 A 86 LEU HDx% A 60 LEU H 1.0 . 5.50 2039 1764 A 102 GLU H A 103 LEU HDx% 1.0 . 5.50 2040 1764 A 103 LEU HDy% A 102 GLU H 1.0 . 5.50 2041 1765 A 102 GLU H A 101 ARG HA 1.0 . 2.86 2042 1766 A 102 GLU H A 102 GLU HBx 1.0 . 3.90 2043 1767 A 102 GLU H A 102 GLU HBy 1.0 . 3.54 2044 1768 A 102 GLU H A 101 ARG HBx 1.0 . 3.94 2045 1768 A 102 GLU H A 101 ARG HBy 1.0 . 3.94 2046 1769 A 100 VAL HGx% A 102 GLU H 1.0 . 5.50 2047 1770 A 102 GLU H A 77 CYS HA 1.0 . 5.35 2048 1771 A 102 GLU H A 101 ARG HDx 1.0 . 5.50 2049 1771 A 101 ARG HDy A 102 GLU H 1.0 . 5.50 2050 1772 A 83 VAL H A 64 ALA H 1.0 . 4.20 2051 1773 A 64 ALA H A 62 GLU HBx 1.0 . 5.32 2052 1773 A 62 GLU HBy A 64 ALA H 1.0 . 5.32 2053 1774 A 63 GLY H A 64 ALA H 1.0 . 3.41 2054 1775 A 64 ALA H A 61 SER HBx 1.0 . 4.98 2055 1775 A 64 ALA H A 61 SER HBy 1.0 . 4.98 2056 1776 A 83 VAL HB A 64 ALA H 1.0 . 3.36 2057 1777 A 82 ARG H A 83 VAL H 1.0 . 5.50 2058 1778 A 63 GLY HAx A 83 VAL H 1.0 . 4.72 2059 1779 A 83 VAL H A 83 VAL HB 1.0 . 3.33 2060 1780 A 83 VAL HGy% A 83 VAL H 1.0 . 4.23 2061 1781 A 66 VAL HGy% A 83 VAL H 1.0 . 4.58 2062 1782 A 82 ARG HA A 64 ALA H 1.0 . 5.50 2063 1783 A 23 VAL H A 31 PHE H 1.0 . 3.70 2064 1784 A 31 PHE H A 30 SER HBx 1.0 . 3.75 2065 1785 A 24 ARG HA A 31 PHE H 1.0 . 4.59 2066 1786 A 31 PHE H A 31 PHE HBx 1.0 . 3.61 2067 1787 A 31 PHE H A 23 VAL HB 1.0 . 4.12 2068 1788 A 22 THR HG2% A 31 PHE H 1.0 . 4.98 2069 1789 A 17 GLN H A 18 LYS H 1.0 . 4.52 2070 1790 A 18 LYS H A 18 LYS HBy 1.0 . 3.39 2071 1791 A 36 ALA HA A 18 LYS H 1.0 . 5.28 2072 1792 A 18 LYS H A 17 GLN HBy 1.0 . 3.74 2073 1793 A 18 LYS H A 18 LYS HDx 1.0 . 3.99 2074 1793 A 18 LYS H A 18 LYS HDy 1.0 . 3.99 2075 1794 A 68 VAL H A 79 CYS HBy 1.0 . 5.42 2076 1795 A 8 GLU H A 8 GLU HGx 1.0 . 5.50 2077 1795 A 8 GLU HGy A 8 GLU H 1.0 . 5.50 2078 1796 A 79 CYS H A 68 VAL H 1.0 . 3.87 2079 1797 A 68 VAL H A 80 ASP HA 1.0 . 4.10 2080 1798 A 67 SER HA A 68 VAL H 1.0 . 2.89 2081 1799 A 67 SER H A 68 VAL H 1.0 . 5.10 2082 1800 A 46 TRP HH2 A 93 ALA H 1.0 . 5.50 2083 1801 A 106 ARG H A 106 ARG HDx 1.0 . 5.50 2084 1801 A 106 ARG HDy A 106 ARG H 1.0 . 5.50 2085 1802 A 75 ALA H A 72 THR H 1.0 . 3.67 2086 1803 A 75 ALA H A 74 GLY H 1.0 . 3.89 2087 1804 A 76 LEU H A 75 ALA H 1.0 . 4.93 2088 1805 A 75 ALA H A 71 TRP HE3 1.0 . 4.91 2089 1806 A 75 ALA H A 71 TRP HA 1.0 . 4.81 2090 1807 A 78 ARG H A 77 CYS HBx 1.0 . 4.58 2091 1808 A 78 ARG H A 78 ARG HBx 1.0 . 3.36 2092 1808 A 78 ARG H A 78 ARG HBy 1.0 . 3.36 2093 1809 A 78 ARG H A 100 VAL HGx% 1.0 . 4.30 2094 1810 A 78 ARG H A 77 CYS HBy 1.0 . 4.52 2095 1811 A 86 LEU H A 93 ALA H 1.0 . 4.90 2096 1812 A 85 THR H A 93 ALA H 1.0 . 3.84 2097 1813 A 92 PHE HBy A 93 ALA H 1.0 . 3.58 2098 1814 A 92 PHE HBx A 93 ALA H 1.0 . 3.56 2099 1815 A 85 THR HG2% A 93 ALA H 1.0 . 5.29 2100 1816 A 83 VAL HGx% A 93 ALA H 1.0 . 5.50 2101 1817 A 107 GLU H A 106 ARG H 1.0 . 4.85 2102 1818 A 105 ARG HA A 106 ARG H 1.0 . 3.36 2103 1819 A 93 ALA HA A 47 LEU H 1.0 . 4.28 2104 1820 A 47 LEU H A 46 TRP HBy 1.0 . 4.29 2105 1821 A 47 LEU H A 93 ALA HB% 1.0 . 5.38 2106 1822 A 61 SER H A 62 GLU H 1.0 . 4.77 2107 1823 A 62 GLU H A 61 SER HBx 1.0 . 3.33 2108 1823 A 62 GLU H A 61 SER HBy 1.0 . 3.33 2109 1824 A 62 GLU HGy A 62 GLU H 1.0 . 3.57 2110 1825 A 62 GLU H A 62 GLU HBx 1.0 . 3.09 2111 1825 A 62 GLU HBy A 62 GLU H 1.0 . 3.09 2112 1826 A 62 GLU H A 64 ALA H 1.0 . 5.50 2113 1827 A 83 VAL HGy% A 62 GLU H 1.0 . 4.55 2114 1828 A 78 ARG H A 100 VAL HA 1.0 . 5.29 2115 1829 A 106 ARG H A 106 ARG HBx 1.0 . 3.49 2116 1829 A 106 ARG HBy A 106 ARG H 1.0 . 3.49 2117 1830 A 106 ARG H A 106 ARG HGx 1.0 . 4.07 2118 1830 A 106 ARG HGy A 106 ARG H 1.0 . 4.07 2119 1831 A 106 ARG H A 105 ARG HDx 1.0 . 5.50 2120 1831 A 105 ARG HDy A 106 ARG H 1.0 . 5.50 2121 1832 A 78 ARG H A 69 SER HA 1.0 . 5.16 2122 1833 A 65 GLU H A 64 ALA H 1.0 . 4.64 2123 1834 A 65 GLU H A 65 GLU HBx 1.0 . 3.29 2124 1835 A 65 GLU H A 24 ARG HBx 1.0 . 5.19 2125 1836 A 36 ALA H A 35 ALA HA 1.0 . 3.05 2126 1837 A 36 ALA H A 50 PHE H 1.0 . 5.36 2127 1838 A 36 ALA H A 49 LEU HA 1.0 . 4.59 2128 1839 A 36 ALA H A 50 PHE HBx 1.0 . 4.99 2129 1839 A 36 ALA H A 50 PHE HBy 1.0 . 4.99 2130 1840 A 47 LEU HDy% A 36 ALA H 1.0 . 5.50 2131 1841 A 48 GLU H A 36 ALA H 1.0 . 3.59 2132 1842 A 22 THR H A 21 LEU HA 1.0 . 2.95 2133 1843 A 22 THR HB A 22 THR H 1.0 . 3.49 2134 1844 A 21 LEU HBx A 22 THR H 1.0 . 4.53 2135 1845 A 104 GLN HA A 105 ARG H 1.0 . 3.08 2136 1846 A 105 ARG H A 104 GLN HGx 1.0 . 4.51 2137 1846 A 104 GLN HGy A 105 ARG H 1.0 . 4.51 2138 1847 A 104 GLN HBy A 105 ARG H 1.0 . 4.13 2139 1848 A 105 ARG HBy A 105 ARG H 1.0 . 3.84 2140 1849 A 105 ARG HGx A 105 ARG H 1.0 . 4.27 2141 1850 A 67 SER HBx A 22 THR H 1.0 . 5.09 2142 1851 A 66 VAL HGy% A 22 THR H 1.0 . 5.40 2143 1852 A 104 GLN H A 105 ARG H 1.0 . 4.87 2144 1853 A 104 GLN HBx A 105 ARG H 1.0 . 4.17 2145 1854 A 17 GLN H A 16 LEU H 1.0 . 3.50 2146 1855 A 17 GLN H A 15 GLN H 1.0 . 5.50 2147 1856 A 37 ILE H A 17 GLN H 1.0 . 4.11 2148 1857 A 17 GLN H A 17 GLN HBy 1.0 . 3.31 2149 1858 A 17 GLN H A 17 GLN HBx 1.0 . 3.08 2150 1859 A 17 GLN H A 37 ILE HD1% 1.0 . 4.63 2151 1860 A 107 GLU H A 106 ARG HGx 1.0 . 4.66 2152 1860 A 107 GLU H A 106 ARG HGy 1.0 . 4.66 2153 1861 A 70 VAL HGx% A 72 THR H 1.0 . 5.50 2154 1862 A 76 LEU HDx% A 72 THR H 1.0 . 5.50 2155 1863 A 71 TRP H A 72 THR H 1.0 . 4.88 2156 1864 A 71 TRP HE3 A 72 THR H 1.0 . 4.64 2157 1865 A 72 THR H A 71 TRP HA 1.0 . 2.93 2158 1866 A 72 THR H A 72 THR HB 1.0 . 4.09 2159 1867 A 71 TRP HBy A 72 THR H 1.0 . 4.39 2160 1868 A 77 CYS HBx A 72 THR H 1.0 . 4.46 2161 1869 A 70 VAL HGy% A 72 THR H 1.0 . 5.50 2162 1870 A 75 ALA HB% A 72 THR H 1.0 . 5.03 2163 1871 A 107 GLU H A 107 GLU HBx 1.0 . 3.55 2164 1872 A 50 PHE H A 49 LEU H 1.0 . 5.24 2165 1873 A 34 THR H A 50 PHE H 1.0 . 4.39 2166 1874 A 35 ALA HA A 50 PHE H 1.0 . 3.40 2167 1875 A 50 PHE H A 49 LEU HA 1.0 . 2.96 2168 1876 A 49 LEU HBy A 50 PHE H 1.0 . 3.80 2169 1877 A 49 LEU HDy% A 50 PHE H 1.0 . 4.34 2170 1878 A 50 PHE H A 34 THR HB 1.0 . 5.33 2171 1879 A 31 PHE HE% A 54 GLN H 1.0 . 4.82 2172 1880 A 55 PRO HDy A 54 GLN H 1.0 . 5.32 2173 1881 A 55 PRO HDx A 54 GLN H 1.0 . 5.31 2174 1882 A 48 GLU H A 38 THR H 1.0 . 5.34 2175 1883 A 48 GLU H A 37 ILE HA 1.0 . 4.41 2176 1884 A 48 GLU H A 48 GLU HGy 1.0 . 4.79 2177 1885 A 48 GLU H A 48 GLU HBx 1.0 . 3.59 2178 1885 A 48 GLU H A 48 GLU HBy 1.0 . 3.59 2179 1886 A 54 GLN H A 54 GLN HBx 1.0 . 3.49 2180 1887 A 37 ILE H A 37 ILE HB 1.0 . 3.22 2181 1888 A 37 ILE H A 37 ILE HG1y 1.0 . 3.56 2182 1889 A 76 LEU HA A 70 VAL H 1.0 . 5.34 2183 1890 A 13 PHE HE% A 70 VAL H 1.0 . 5.50 2184 1891 A 71 TRP H A 70 VAL H 1.0 . 5.50 2185 1892 A 78 ARG HA A 70 VAL H 1.0 . 4.32 2186 1893 A 70 VAL H A 69 SER HBx 1.0 . 3.49 2187 1893 A 69 SER HBy A 70 VAL H 1.0 . 3.49 2188 1894 A 77 CYS HBy A 70 VAL H 1.0 . 4.67 2189 1895 A 77 CYS HBx A 70 VAL H 1.0 . 5.11 2190 1896 A 37 ILE H A 36 ALA H 1.0 . 5.27 2191 1897 A 37 ILE H A 16 LEU HA 1.0 . 4.72 2192 1898 A 37 ILE H A 18 LYS HA 1.0 . 4.25 2193 1899 A 37 ILE H A 37 ILE HG1x 1.0 . 3.82 2194 1900 A 108 TYR H A 107 GLU H 1.0 . 3.95 2195 1901 A 108 TYR HBy A 108 TYR H 1.0 . 4.04 2196 1902 A 108 TYR H A 108 TYR HBx 1.0 . 3.59 2197 1903 A 108 TYR H A 106 ARG HGx 1.0 . 5.39 2198 1903 A 108 TYR H A 106 ARG HGy 1.0 . 5.39 2199 1904 A 108 TYR H A 107 GLU HA 1.0 . 3.15 2200 1905 A 16 LEU H A 15 GLN H 1.0 . 4.64 2201 1906 A 108 TYR H A 106 ARG HA 1.0 . 4.85 2202 1907 A 20 ASN H A 69 SER HBx 1.0 . 4.89 2203 1907 A 69 SER HBy A 20 ASN H 1.0 . 4.89 2204 1908 A 95 ARG H A 82 ARG H 1.0 . 3.64 2205 1909 A 82 ARG H A 96 LEU HA 1.0 . 4.62 2206 1910 A 81 GLY HAx A 82 ARG H 1.0 . 3.37 2207 1911 A 95 ARG HBy A 95 ARG HE 1.0 . 4.55 2208 1912 A 82 ARG H A 95 ARG HBx 1.0 . 4.98 2209 1913 A 82 ARG H A 82 ARG HBx 1.0 . 3.62 2210 1913 A 82 ARG HBy A 82 ARG H 1.0 . 3.62 2211 1914 A 82 ARG H A 82 ARG HGx 1.0 . 3.98 2212 1914 A 82 ARG HGy A 82 ARG H 1.0 . 3.98 2213 1915 A 15 GLN H A 14 GLU HBx 1.0 . 3.63 2214 1916 A 40 LEU HBx A 15 GLN H 1.0 . 5.50 2215 1917 A 37 ILE HG2% A 15 GLN H 1.0 . 4.71 2216 1918 A 14 GLU H A 15 GLN H 1.0 . 4.45 2217 1919 A 20 ASN H A 68 VAL HB 1.0 . 5.50 2218 1920 A 20 ASN H A 19 VAL H 1.0 . 5.15 2219 1921 A 20 ASN H A 20 ASN HBx 1.0 . 3.41 2220 1922 A 70 VAL HGy% A 20 ASN H 1.0 . 5.50 2221 1923 A 20 ASN H A 19 VAL HGy% 1.0 . 4.40 2222 1924 A 44 LEU HBx A 43 SER H 1.0 . 5.34 2223 1925 A 9 TYR HD% A 43 SER H 1.0 . 5.50 2224 1926 A 42 GLY HAy A 43 SER H 1.0 . 3.04 2225 1927 A 43 SER HBx A 43 SER H 1.0 . 4.00 2226 1928 A 42 GLY HAx A 43 SER H 1.0 . 3.44 2227 1929 A 42 GLY H A 43 SER H 1.0 . 5.08 2228 1930 A 9 TYR HE% A 43 SER H 1.0 . 5.26 2229 1931 A 9 TYR HE% A 99 ARG H 1.0 . 5.50 2230 1932 A 87 ARG H A 88 ASP H 1.0 . 3.22 2231 1933 A 88 ASP H A 91 GLN H 1.0 . 3.78 2232 1934 A 92 PHE HBy A 88 ASP H 1.0 . 5.34 2233 1935 A 87 ARG HBy A 88 ASP H 1.0 . 3.44 2234 1936 A 87 ARG HGx A 88 ASP H 1.0 . 4.58 2235 1937 A 86 LEU HG A 88 ASP H 1.0 . 5.25 2236 1938 A 100 VAL H A 99 ARG H 1.0 . 4.84 2237 1939 A 99 ARG H A 98 GLY H 1.0 . 4.13 2238 1940 A 98 GLY HAy A 99 ARG H 1.0 . 3.12 2239 1941 A 98 GLY HAx A 99 ARG H 1.0 . 3.38 2240 1942 A 99 ARG HBx A 99 ARG H 1.0 . 3.50 2241 1943 A 16 LEU H A 16 LEU HG 1.0 . 5.10 2242 1944 A 92 PHE HD% A 91 GLN H 1.0 . 4.46 2243 1945 A 88 ASP HBx A 91 GLN H 1.0 . 5.50 2244 1946 A 90 ARG H A 91 GLN H 1.0 . 2.94 2245 1947 A 91 GLN HGy A 91 GLN H 1.0 . 4.13 2246 1948 A 91 GLN HBy A 92 PHE H 1.0 . 3.98 2247 1949 A 47 LEU HDx% A 92 PHE H 1.0 . 5.50 2248 1950 A 47 LEU H A 92 PHE H 1.0 . 3.90 2249 1951 A 93 ALA H A 92 PHE H 1.0 . 4.80 2250 1952 A 92 PHE HD% A 92 PHE H 1.0 . 4.20 2251 1953 A 48 GLU HA A 92 PHE H 1.0 . 4.35 2252 1954 A 91 GLN HGy A 92 PHE H 1.0 . 5.05 2253 1955 A 91 GLN HBx A 92 PHE H 1.0 . 4.06 2254 1956 A 47 LEU HBy A 92 PHE H 1.0 . 4.96 2255 1957 A 49 LEU H A 92 PHE H 1.0 . 5.20 2256 1958 A 37 ILE H A 16 LEU H 1.0 . 5.50 2257 1959 A 16 LEU H A 15 GLN HA 1.0 . 3.50 2258 1960 A 16 LEU H A 16 LEU HBy 1.0 . 4.08 2259 1961 A 91 GLN HGx A 91 GLN H 1.0 . 3.52 2260 1962 A 48 GLU HA A 91 GLN H 1.0 . 5.38 2261 1963 A 46 TRP HA A 92 PHE H 1.0 . 5.09 2262 1964 A 94 ILE H A 45 ALA H 1.0 . 3.84 2263 1965 A 94 ILE H A 93 ALA H 1.0 . 5.06 2264 1966 A 46 TRP HA A 94 ILE H 1.0 . 4.55 2265 1967 A 9 TYR H A 8 GLU H 1.0 . 4.38 2266 1968 A 9 TYR H A 10 GLY H 1.0 . 3.46 2267 1969 A 9 TYR H A 11 ARG H 1.0 . 5.22 2268 1970 A 9 TYR H A 9 TYR HBy 1.0 . 3.97 2269 1971 A 9 TYR H A 9 TYR HBx 1.0 . 3.55 2270 1972 A 9 TYR H A 8 GLU HBy 1.0 . 4.21 2271 1973 A 9 TYR H A 96 LEU HDy% 1.0 . 5.50 2272 1974 A 9 TYR H A 8 GLU HBx 1.0 . 4.25 2273 1975 A 104 GLN HBx A 104 GLN H 1.0 . 4.00 2274 1976 A 104 GLN H A 103 LEU HA 1.0 . 3.39 2275 1977 A 104 GLN H A 103 LEU HBx 1.0 . 3.85 2276 1977 A 103 LEU HBy A 104 GLN H 1.0 . 3.85 2277 1978 A 76 LEU HBy A 104 GLN H 1.0 . 5.22 2278 1979 A 76 LEU HBx A 104 GLN H 1.0 . 5.37 2279 1980 A 19 VAL HA A 69 SER H 1.0 . 4.87 2280 1981 A 70 VAL HGy% A 69 SER H 1.0 . 5.50 2281 1982 A 69 SER H A 78 ARG HA 1.0 . 5.50 2282 1983 A 20 ASN HBy A 69 SER H 1.0 . 4.13 2283 1984 A 19 VAL HB A 69 SER H 1.0 . 4.12 2284 1985 A 69 SER H A 68 VAL H 1.0 . 4.48 2285 1986 A 53 GLU H A 52 ALA H 1.0 . 3.72 2286 1987 A 53 GLU H A 51 GLY HAx 1.0 . 4.63 2287 1988 A 53 GLU H A 53 GLU HGx 1.0 . 3.82 2288 1989 A 53 GLU H A 53 GLU HBy 1.0 . 3.13 2289 1990 A 11 ARG H A 10 GLY H 1.0 . 3.53 2290 1991 A 13 PHE H A 11 ARG H 1.0 . 4.56 2291 1992 A 12 TYR H A 11 ARG H 1.0 . 3.46 2292 1993 A 11 ARG H A 8 GLU HA 1.0 . 4.59 2293 1994 A 11 ARG H A 11 ARG HDx 1.0 . 4.90 2294 1994 A 11 ARG HDy A 11 ARG H 1.0 . 4.90 2295 1995 A 11 ARG H A 11 ARG HBx 1.0 . 3.37 2296 1996 A 97 VAL H A 96 LEU H 1.0 . 4.57 2297 1997 A 97 VAL H A 98 GLY H 1.0 . 4.57 2298 1998 A 97 VAL H A 80 ASP HBx 1.0 . 5.50 2299 1999 A 97 VAL H A 96 LEU HG 1.0 . 5.50 2300 2000 A 97 VAL H A 82 ARG H 1.0 . 5.02 2301 2001 A 81 GLY HAy A 97 VAL H 1.0 . 3.93 2302 2002 A 13 PHE H A 9 TYR HBy 1.0 . 5.50 2303 2003 A 12 TYR H A 13 PHE H 1.0 . 3.02 2304 2004 A 13 PHE H A 12 TYR HD% 1.0 . 4.87 2305 2005 A 10 GLY HAy A 13 PHE H 1.0 . 4.16 2306 2006 A 13 PHE H A 13 PHE HBy 1.0 . 3.91 2307 2007 A 13 PHE H A 12 TYR HBx 1.0 . 3.73 2308 2008 A 13 PHE H A 13 PHE HBx 1.0 . 3.52 2309 2009 A 18 LYS H A 19 VAL H 1.0 . 4.59 2310 2010 A 36 ALA HA A 19 VAL H 1.0 . 4.00 2311 2011 A 58 ASN H A 58 ASN HA 1.0 . 2.78 2312 2012 A 64 ALA HB% A 66 VAL H 1.0 . 5.50 2313 2013 A 66 VAL H A 83 VAL H 1.0 . 4.94 2314 2014 A 65 GLU H A 66 VAL H 1.0 . 4.29 2315 2015 A 65 GLU HGy A 66 VAL H 1.0 . 5.50 2316 2016 A 66 VAL H A 65 GLU HBy 1.0 . 4.09 2317 2017 A 66 VAL H A 66 VAL HB 1.0 . 3.94 2318 2018 A 66 VAL H A 82 ARG HBx 1.0 . 5.25 2319 2018 A 82 ARG HBy A 66 VAL H 1.0 . 5.25 2320 2019 A 14 GLU H A 13 PHE HBx 1.0 . 4.15 2321 2020 A 34 THR H A 34 THR HB 1.0 . 3.57 2322 2021 A 34 THR H A 33 GLY HAx 1.0 . 3.19 2323 2022 A 14 GLU H A 17 GLN HE2x 1.0 . 4.49 2324 2023 A 14 GLU H A 17 GLN HBy 1.0 . 4.02 2325 2024 A 14 GLU H A 17 GLN HBx 1.0 . 3.64 2326 2025 A 14 GLU H A 17 GLN HE2y 1.0 . 5.41 2327 2026 A 31 PHE HE% A 34 THR H 1.0 . 5.13 2328 2027 A 34 THR H A 50 PHE HD% 1.0 . 5.16 2329 2028 A 66 VAL H A 67 SER H 1.0 . 5.21 2330 2029 A 67 SER H A 23 VAL HA 1.0 . 4.59 2331 2030 A 22 THR HG2% A 67 SER H 1.0 . 5.02 2332 2031 A 7 SER H A 7 SER HBx 1.0 . 3.95 2333 2031 A 7 SER HBy A 7 SER H 1.0 . 3.95 2334 2032 A 12 TYR H A 10 GLY H 1.0 . 5.28 2335 2033 A 12 TYR H A 13 PHE HA 1.0 . 5.50 2336 2034 A 12 TYR H A 11 ARG HBy 1.0 . 4.50 2337 2035 A 12 TYR H A 11 ARG HBx 1.0 . 4.33 2338 2036 A 12 TYR H A 12 TYR HE% 1.0 . 5.50 2339 2037 A 12 TYR H A 9 TYR HA 1.0 . 4.32 2340 2038 A 12 TYR H A 13 PHE HBx 1.0 . 4.88 2341 2039 A 30 SER H A 31 PHE H 1.0 . 4.81 2342 2040 A 25 LEU H A 30 SER H 1.0 . 5.11 2343 2041 A 30 SER HBy A 30 SER H 1.0 . 4.12 2344 2042 A 30 SER H A 30 SER HBx 1.0 . 4.01 2345 2043 A 30 SER H A 25 LEU HBy 1.0 . 4.84 2346 2044 A 61 SER H A 83 VAL HB 1.0 . 5.48 2347 2045 A 61 SER H A 64 ALA H 1.0 . 4.83 2348 2046 A 86 LEU HDy% A 61 SER H 1.0 . 4.95 2349 2047 A 61 SER H A 60 LEU HDx% 1.0 . 4.97 2350 2048 A 60 LEU HDy% A 61 SER H 1.0 . 4.83 2351 2049 A 61 SER H A 61 SER HBx 1.0 . 3.73 2352 2049 A 61 SER H A 61 SER HBy 1.0 . 3.73 2353 2050 A 61 SER H A 60 LEU HG 1.0 . 5.18 2354 2051 A 61 SER H A 60 LEU HBx 1.0 . 4.28 2355 2052 A 61 SER H A 23 VAL HGy% 1.0 . 5.46 2356 2053 A 61 SER H A 83 VAL HGx% 1.0 . 4.59 2357 2054 A 89 ASP H A 88 ASP H 1.0 . 4.70 2358 2055 A 90 ARG H A 89 ASP H 1.0 . 3.56 2359 2056 A 88 ASP HBy A 89 ASP H 1.0 . 3.08 2360 2057 A 89 ASP H A 89 ASP HBx 1.0 . 3.47 2361 2058 A 90 ARG HGy A 89 ASP H 1.0 . 5.30 2362 2059 A 38 THR H A 39 SER H 1.0 . 3.03 2363 2060 A 46 TRP H A 39 SER H 1.0 . 3.57 2364 2061 A 39 SER H A 47 LEU HA 1.0 . 5.02 2365 2062 A 45 ALA HA A 39 SER H 1.0 . 4.96 2366 2063 A 39 SER H A 39 SER HBx 1.0 . 3.77 2367 2063 A 39 SER H A 39 SER HBy 1.0 . 3.77 2368 2064 A 46 TRP HBy A 39 SER H 1.0 . 4.16 2369 2065 A 46 TRP HBx A 39 SER H 1.0 . 3.71 2370 2066 A 58 ASN HD2y A 58 ASN HBx 1.0 . 3.45 2371 2066 A 58 ASN HBy A 58 ASN HD2y 1.0 . 3.45 2372 2067 A 57 PRO HBx A 58 ASN HD2y 1.0 . 4.81 2373 2068 A 58 ASN HA A 58 ASN HD2x 1.0 . 5.50 2374 2069 A 57 PRO HBx A 58 ASN HD2x 1.0 . 5.30 2375 2070 A 63 GLY H A 62 GLU HBx 1.0 . 3.94 2376 2070 A 62 GLU HBy A 63 GLY H 1.0 . 3.94 2377 2071 A 62 GLU H A 63 GLY H 1.0 . 5.08 2378 2072 A 63 GLY H A 83 VAL H 1.0 . 4.61 2379 2073 A 63 GLY HAx A 63 GLY H 1.0 . 2.95 2380 2074 A 87 ARG HDy A 91 GLN HE2y 1.0 . 5.50 2381 2075 A 91 GLN HA A 91 GLN HE2y 1.0 . 5.50 2382 2076 A 20 ASN H A 20 ASN HD2y 1.0 . 5.02 2383 2077 A 21 LEU H A 20 ASN HD2y 1.0 . 4.83 2384 2078 A 20 ASN HD2y A 20 ASN HA 1.0 . 4.55 2385 2079 A 20 ASN HD2y A 20 ASN HBx 1.0 . 3.87 2386 2080 A 34 THR HG2% A 20 ASN HD2y 1.0 . 5.50 2387 2081 A 34 THR HG2% A 20 ASN HD2x 1.0 . 5.50 2388 2082 A 20 ASN H A 20 ASN HD2x 1.0 . 5.50 2389 2083 A 20 ASN HA A 20 ASN HD2x 1.0 . 5.10 2390 2084 A 87 ARG HDy A 91 GLN HE2x 1.0 . 5.44 2391 2085 A 87 ARG HDx A 91 GLN HE2x 1.0 . 5.50 2392 2086 A 90 ARG H A 88 ASP H 1.0 . 4.85 2393 2087 A 90 ARG H A 89 ASP HBy 1.0 . 4.30 2394 2088 A 90 ARG HBx A 90 ARG H 1.0 . 3.67 2395 2089 A 90 ARG H A 90 ARG HGy 1.0 . 4.21 2396 2090 A 92 PHE HD% A 90 ARG H 1.0 . 5.44 2397 2091 A 90 ARG H A 91 GLN HA 1.0 . 5.45 2398 2092 A 90 ARG H A 88 ASP HBy 1.0 . 4.63 2399 2093 A 89 ASP HBx A 54 GLN HE2y 1.0 . 5.50 2400 2094 A 104 GLN HE2y A 104 GLN HGx 1.0 . 3.61 2401 2094 A 104 GLN HGy A 104 GLN HE2y 1.0 . 3.61 2402 2095 A 59 THR H A 58 ASN HA 1.0 . 3.48 2403 2096 A 59 THR H A 59 THR HB 1.0 . 3.53 2404 2097 A 59 THR H A 58 ASN H 1.0 . 3.66 2405 2098 A 59 THR H A 60 LEU H 1.0 . 3.02 2406 2099 A 59 THR H A 58 ASN HBx 1.0 . 4.64 2407 2099 A 59 THR H A 58 ASN HBy 1.0 . 4.64 2408 2100 A 59 THR H A 60 LEU HG 1.0 . 5.50 2409 2101 A 85 THR H A 94 ILE HA 1.0 . 4.74 2410 2102 A 83 VAL HA A 85 THR H 1.0 . 4.26 2411 2103 A 84 GLU HGx A 85 THR H 1.0 . 4.88 2412 2104 A 85 THR H A 84 GLU HBx 1.0 . 3.75 2413 2105 A 50 PHE HD% A 51 GLY H 1.0 . 4.86 2414 2106 A 51 GLY H A 50 PHE HBx 1.0 . 3.75 2415 2106 A 50 PHE HBy A 51 GLY H 1.0 . 3.75 2416 2107 A 24 ARG HA A 26 GLY H 1.0 . 5.24 2417 2108 A 26 GLY H A 24 ARG HGx 1.0 . 4.93 2418 2109 A 26 GLY H A 27 ASP H 1.0 . 5.24 2419 2110 A 25 LEU H A 26 GLY H 1.0 . 3.90 2420 2111 A 25 LEU HA A 26 GLY H 1.0 . 3.19 2421 2112 A 26 GLY HAx A 26 GLY H 1.0 . 2.93 2422 2113 A 25 LEU HBy A 26 GLY H 1.0 . 4.44 2423 2114 A 25 LEU HBx A 26 GLY H 1.0 . 4.33 2424 2115 A 25 LEU HDy% A 26 GLY H 1.0 . 5.01 2425 2116 A 30 SER H A 29 GLY H 1.0 . 4.53 2426 2117 A 28 THR H A 29 GLY H 1.0 . 3.61 2427 2118 A 29 GLY H A 27 ASP HA 1.0 . 5.17 2428 2119 A 25 LEU HBy A 29 GLY H 1.0 . 4.47 2429 2120 A 27 ASP HBx A 29 GLY H 1.0 . 5.50 2430 2121 A 25 LEU HDx% A 29 GLY H 1.0 . 5.50 2431 2122 A 27 ASP HBx A 28 THR H 1.0 . 5.50 2432 2123 A 17 GLN HE2y A 72 THR HB 1.0 . 4.71 2433 2124 A 17 GLN HGy A 17 GLN HE2y 1.0 . 3.73 2434 2125 A 17 GLN HE2y A 17 GLN HBx 1.0 . 4.62 2435 2126 A 17 GLN HE2x A 72 THR HB 1.0 . 4.74 2436 2127 A 17 GLN HBx A 17 GLN HE2x 1.0 . 5.20 2437 2128 A 70 VAL HGy% A 17 GLN HE2x 1.0 . 5.15 2438 2129 A 13 PHE HBy A 17 GLN HE2x 1.0 . 5.50 2439 2130 A 28 THR H A 27 ASP H 1.0 . 5.27 2440 2131 A 9 TYR HE% A 98 GLY H 1.0 . 5.50 2441 2132 A 33 GLY H A 23 VAL H 1.0 . 5.16 2442 2133 A 33 GLY H A 21 LEU H 1.0 . 3.66 2443 2134 A 31 PHE HE% A 33 GLY H 1.0 . 4.74 2444 2135 A 33 GLY H A 32 ASP HA 1.0 . 2.90 2445 2136 A 33 GLY H A 32 ASP HBy 1.0 . 4.08 2446 2137 A 21 LEU HBy A 33 GLY H 1.0 . 4.43 2447 2138 A 40 LEU HDx% A 10 GLY H 1.0 . 5.50 2448 2139 A 11 ARG HBx A 10 GLY H 1.0 . 5.50 2449 2140 A 9 TYR HBy A 10 GLY H 1.0 . 4.61 2450 2141 A 9 TYR HBx A 10 GLY H 1.0 . 4.10 2451 2142 A 80 ASP HBx A 81 GLY H 1.0 . 4.04 2452 2143 A 96 LEU HDx% A 81 GLY H 1.0 . 5.50 2453 2144 A 68 VAL H A 81 GLY H 1.0 . 5.17 2454 2145 A 82 ARG H A 81 GLY H 1.0 . 5.43 2455 2146 A 65 GLU HA A 81 GLY H 1.0 . 5.12 2456 2147 A 80 ASP HBy A 81 GLY H 1.0 . 3.58 2457 2148 A 97 VAL HGy% A 81 GLY H 1.0 . 5.50 2458 2149 A 68 VAL HGy% A 81 GLY H 1.0 . 4.25 stop_ save_