data_nef_c17534_2lvl save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 SER middle . . 3 A 3 THR middle . . 4 A 4 MET middle . . 5 A 5 HIS middle . . 6 A 6 PHE middle . . 7 A 7 THR middle . . 8 A 8 ASP middle . . 9 A 9 ASP middle . . 10 A 10 ASN middle . . 11 A 11 GLU middle . . 12 A 12 ASN middle . . 13 A 13 ASP middle . . 14 A 14 THR middle . . 15 A 15 SER middle . . 16 A 16 GLU middle . . 17 A 17 THR middle . . 18 A 18 MET middle . . 19 A 19 GLU middle . . 20 A 20 SER middle . . 21 A 21 LEU middle . . 22 A 22 ILE middle . . 23 A 23 ASP middle . . 24 A 24 LYS middle . . 25 A 25 GLY middle . false 26 A 26 LYS middle . . 27 A 27 LEU middle . . 28 A 28 ASP middle . . 29 A 29 GLN middle . . 30 A 30 VAL middle . . 31 A 31 VAL middle . . 32 A 32 TYR middle . . 33 A 33 ASP middle . . 34 A 34 ASP middle . . 35 A 35 GLN middle . . 36 A 36 LEU middle . . 37 A 37 TYR middle . . 38 A 38 HIS middle . . 39 A 39 LEU middle . . 40 A 40 LYS middle . . 41 A 41 GLU middle . . 42 A 42 LYS middle . . 43 A 43 VAL middle . . 44 A 44 ASP middle . . 45 A 45 GLU middle . . 46 A 46 ASP middle . . 47 A 47 LYS middle . . 48 A 48 LYS middle . . 49 A 49 GLY middle . false 50 A 50 LYS middle . . 51 A 51 VAL middle . . 52 A 52 ILE middle . . 53 A 53 GLY middle . false 54 A 54 ALA middle . . 55 A 55 ILE middle . . 56 A 56 GLY middle . false 57 A 57 GLN middle . . 58 A 58 THR middle . . 59 A 59 PHE middle . . 60 A 60 PHE middle . . 61 A 61 VAL middle . . 62 A 62 ASP middle . . 63 A 63 GLY middle . false 64 A 64 ASP middle . . 65 A 65 GLY middle . false 66 A 66 LYS middle . . 67 A 67 ARG middle . . 68 A 68 TRP middle . . 69 A 69 SER middle . . 70 A 70 GLU middle . . 71 A 71 GLU middle . . 72 A 72 GLU middle . . 73 A 73 LEU middle . . 74 A 74 LYS middle . . 75 A 75 GLU middle . . 76 A 76 PRO middle . false 77 A 77 TYR middle . . 78 A 78 ILE middle . . 79 A 79 SER middle . . 80 A 80 ASN middle . . 81 A 81 ASN middle . . 82 A 82 PRO middle . false 83 A 83 ASP middle . . 84 A 84 GLU middle . . 85 A 85 ILE middle . . 86 A 86 ARG middle . . 87 A 87 GLU middle . . 88 A 88 LYS middle . . 89 A 89 LYS middle . . 90 A 90 PRO middle . false 91 A 91 LEU middle . . 92 A 92 ARG middle . . 93 A 93 TYR middle . . 94 A 94 GLY middle . false 95 A 95 LYS middle . . 96 A 96 VAL middle . . 97 A 97 TYR middle . . 98 A 98 SER middle . . 99 A 99 THR middle . . 100 A 100 ASN middle . . 101 A 101 GLU middle . . 102 A 102 ASP middle . . 103 A 103 SER middle . . 104 A 104 ASP middle . . 105 A 105 ALA middle . . 106 A 106 LYS middle . . 107 A 107 ASP middle . . 108 A 108 GLU middle . . 109 A 109 ILE middle . . 110 A 110 ILE middle . . 111 A 111 VAL middle . . 112 A 112 GLU middle . . 113 A 113 PHE middle . . 114 A 114 ASN middle . . 115 A 115 ARG middle . . 116 A 116 GLU middle . . 117 A 117 TYR middle . . 118 A 118 TYR middle . . 119 A 119 ARG middle . . 120 A 120 ALA middle . . 121 A 121 VAL middle . . 122 A 122 LEU middle . . 123 A 123 ILE middle . . 124 A 124 LYS middle . . 125 A 125 ASN middle . . 126 A 126 GLU middle . . 127 A 127 LYS middle . . 128 A 128 GLU 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 SER HA H 1 4.587 0.050 A 2 SER HB2 H 1 3.901 0.050 A 2 SER HB3 H 1 3.901 0.050 A 2 SER C C 13 174.822 0.200 A 2 SER CA C 13 58.305 0.200 A 2 SER CB C 13 63.996 0.200 A 3 THR H H 1 8.367 0.050 A 3 THR HA H 1 4.296 0.050 A 3 THR HB H 1 4.190 0.050 A 3 THR HG2% H 1 1.154 0.050 A 3 THR C C 13 174.381 0.200 A 3 THR CA C 13 61.627 0.200 A 3 THR CB C 13 69.700 0.200 A 3 THR CG2 C 13 21.587 0.200 A 3 THR N N 15 116.560 0.300 A 4 MET H H 1 8.364 0.050 A 4 MET HA H 1 4.372 0.050 A 4 MET HB2 H 1 1.877 0.050 A 4 MET HB3 H 1 1.877 0.050 A 4 MET HGy H 1 2.460 0.050 A 4 MET HGx H 1 2.413 0.050 A 4 MET C C 13 175.449 0.200 A 4 MET CA C 13 55.461 0.200 A 4 MET CB C 13 32.976 0.200 A 4 MET CG C 13 31.958 0.200 A 4 MET N N 15 122.663 0.300 A 5 HIS H H 1 8.344 0.050 A 5 HIS HA H 1 4.648 0.050 A 5 HIS HBy H 1 3.130 0.050 A 5 HIS HBx H 1 3.040 0.050 A 5 HIS HD2 H 1 7.129 0.050 A 5 HIS C C 13 174.161 0.200 A 5 HIS CA C 13 55.318 0.200 A 5 HIS CB C 13 29.832 0.200 A 5 HIS CD2 C 13 119.887 0.200 A 5 HIS N N 15 120.166 0.300 A 6 PHE H H 1 8.389 0.050 A 6 PHE HA H 1 4.695 0.050 A 6 PHE HBy H 1 3.167 0.050 A 6 PHE HBx H 1 2.997 0.050 A 6 PHE HDx H 1 7.254 0.050 A 6 PHE HDy H 1 7.254 0.050 A 6 PHE C C 13 175.751 0.200 A 6 PHE CA C 13 57.862 0.200 A 6 PHE CB C 13 39.701 0.200 A 6 PHE CDx C 13 132.057 0.200 A 6 PHE CDy C 13 132.057 0.200 A 6 PHE N N 15 122.458 0.300 A 7 THR H H 1 8.154 0.050 A 7 THR HA H 1 4.330 0.050 A 7 THR HB H 1 4.194 0.050 A 7 THR HG2% H 1 1.158 0.050 A 7 THR C C 13 173.946 0.200 A 7 THR CA C 13 61.614 0.200 A 7 THR CB C 13 69.871 0.200 A 7 THR CG2 C 13 21.586 0.200 A 7 THR N N 15 115.320 0.300 A 8 ASP H H 1 8.324 0.050 A 8 ASP HA H 1 4.578 0.050 A 8 ASP HBy H 1 2.730 0.050 A 8 ASP HBx H 1 2.618 0.050 A 8 ASP C C 13 175.922 0.200 A 8 ASP CA C 13 54.457 0.200 A 8 ASP CB C 13 41.155 0.200 A 8 ASP N N 15 122.453 0.300 A 9 ASP H H 1 8.296 0.050 A 9 ASP HA H 1 4.555 0.050 A 9 ASP HBy H 1 2.726 0.050 A 9 ASP HBx H 1 2.612 0.050 A 9 ASP C C 13 176.053 0.200 A 9 ASP CA C 13 54.648 0.200 A 9 ASP CB C 13 41.230 0.200 A 9 ASP N N 15 120.750 0.300 A 10 ASN H H 1 8.402 0.050 A 10 ASN HA H 1 4.665 0.050 A 10 ASN HBy H 1 2.820 0.050 A 10 ASN HBx H 1 2.735 0.050 A 10 ASN HD21 H 1 6.947 0.050 A 10 ASN HD22 H 1 7.655 0.050 A 10 ASN C C 13 175.451 0.200 A 10 ASN CA C 13 53.528 0.200 A 10 ASN CB C 13 39.219 0.200 A 10 ASN N N 15 118.729 0.300 A 10 ASN ND2 N 15 113.789 0.300 A 11 GLU H H 1 8.378 0.050 A 11 GLU HA H 1 4.217 0.050 A 11 GLU HBy H 1 2.047 0.050 A 11 GLU HBx H 1 1.938 0.050 A 11 GLU HG2 H 1 2.192 0.050 A 11 GLU HG3 H 1 2.192 0.050 A 11 GLU C C 13 176.267 0.200 A 11 GLU CA C 13 57.053 0.200 A 11 GLU CB C 13 30.057 0.200 A 11 GLU CG C 13 36.272 0.200 A 11 GLU N N 15 121.015 0.300 A 12 ASN H H 1 8.397 0.050 A 12 ASN HA H 1 4.736 0.050 A 12 ASN HBy H 1 2.816 0.050 A 12 ASN HBx H 1 2.690 0.050 A 12 ASN HD21 H 1 6.901 0.050 A 12 ASN HD22 H 1 7.658 0.050 A 12 ASN C C 13 174.764 0.200 A 12 ASN CA C 13 53.226 0.200 A 12 ASN CB C 13 39.309 0.200 A 12 ASN N N 15 118.846 0.300 A 12 ASN ND2 N 15 113.411 0.300 A 13 ASP H H 1 8.261 0.050 A 13 ASP HA H 1 4.684 0.050 A 13 ASP HBy H 1 2.728 0.050 A 13 ASP HBx H 1 2.613 0.050 A 13 ASP C C 13 176.310 0.200 A 13 ASP CA C 13 54.277 0.200 A 13 ASP CB C 13 41.323 0.200 A 13 ASP N N 15 121.304 0.300 A 14 THR H H 1 8.171 0.050 A 14 THR HA H 1 4.418 0.050 A 14 THR HB H 1 4.197 0.050 A 14 THR HG2% H 1 1.099 0.050 A 14 THR C C 13 174.332 0.200 A 14 THR CA C 13 61.299 0.200 A 14 THR CB C 13 69.706 0.200 A 14 THR CG2 C 13 21.026 0.200 A 14 THR N N 15 114.723 0.300 A 15 SER H H 1 8.352 0.050 A 15 SER HA H 1 4.484 0.050 A 15 SER HB2 H 1 3.847 0.050 A 15 SER HB3 H 1 3.847 0.050 A 15 SER C C 13 174.420 0.200 A 15 SER CA C 13 58.324 0.200 A 15 SER CB C 13 64.010 0.200 A 15 SER N N 15 119.759 0.300 A 16 GLU H H 1 8.385 0.050 A 16 GLU HA H 1 4.452 0.050 A 16 GLU HBy H 1 1.892 0.050 A 16 GLU HBx H 1 1.563 0.050 A 16 GLU HG2 H 1 2.197 0.050 A 16 GLU HG3 H 1 2.197 0.050 A 16 GLU C C 13 175.408 0.200 A 16 GLU CA C 13 55.777 0.200 A 16 GLU CB C 13 30.581 0.200 A 16 GLU CG C 13 34.870 0.200 A 16 GLU N N 15 122.850 0.300 A 17 THR H H 1 8.710 0.050 A 17 THR HA H 1 4.532 0.050 A 17 THR HB H 1 4.637 0.050 A 17 THR HG2% H 1 1.221 0.050 A 17 THR C C 13 174.626 0.200 A 17 THR CA C 13 59.222 0.200 A 17 THR CB C 13 72.785 0.200 A 17 THR CG2 C 13 21.967 0.200 A 17 THR N N 15 111.537 0.300 A 18 MET H H 1 8.976 0.050 A 18 MET HA H 1 4.284 0.050 A 18 MET HBy H 1 2.009 0.050 A 18 MET HBx H 1 1.664 0.050 A 18 MET HGy H 1 2.576 0.050 A 18 MET HGx H 1 2.353 0.050 A 18 MET C C 13 177.814 0.200 A 18 MET CA C 13 56.487 0.200 A 18 MET CB C 13 29.653 0.200 A 18 MET CG C 13 31.129 0.200 A 18 MET N N 15 118.640 0.300 A 19 GLU H H 1 8.876 0.050 A 19 GLU HA H 1 3.157 0.050 A 19 GLU HBy H 1 2.015 0.050 A 19 GLU HBx H 1 1.782 0.050 A 19 GLU HGy H 1 2.389 0.050 A 19 GLU HGx H 1 2.176 0.050 A 19 GLU C C 13 177.256 0.200 A 19 GLU CA C 13 61.266 0.200 A 19 GLU CB C 13 29.520 0.200 A 19 GLU CG C 13 37.945 0.200 A 19 GLU N N 15 116.332 0.300 A 20 SER H H 1 7.835 0.050 A 20 SER HA H 1 4.131 0.050 A 20 SER HBy H 1 3.993 0.050 A 20 SER HBx H 1 3.871 0.050 A 20 SER C C 13 177.832 0.200 A 20 SER CA C 13 61.593 0.200 A 20 SER CB C 13 62.703 0.200 A 20 SER N N 15 114.730 0.300 A 21 LEU H H 1 8.089 0.050 A 21 LEU HA H 1 3.826 0.050 A 21 LEU HBy H 1 1.905 0.050 A 21 LEU HBx H 1 1.349 0.050 A 21 LEU HD1% H 1 0.625 0.050 A 21 LEU HD2% H 1 0.680 0.050 A 21 LEU HG H 1 1.782 0.050 A 21 LEU C C 13 179.661 0.200 A 21 LEU CA C 13 58.308 0.200 A 21 LEU CB C 13 41.234 0.200 A 21 LEU CD1 C 13 26.012 0.200 A 21 LEU CD2 C 13 22.761 0.200 A 21 LEU CG C 13 26.193 0.200 A 21 LEU N N 15 124.029 0.300 A 22 ILE H H 1 7.987 0.050 A 22 ILE HA H 1 3.352 0.050 A 22 ILE HB H 1 1.483 0.050 A 22 ILE HD1% H 1 0.220 0.050 A 22 ILE HG1y H 1 1.290 0.050 A 22 ILE HG1x H 1 0.815 0.050 A 22 ILE HG2% H 1 0.664 0.050 A 22 ILE C C 13 180.736 0.200 A 22 ILE CA C 13 64.923 0.200 A 22 ILE CB C 13 37.189 0.200 A 22 ILE CD1 C 13 13.538 0.200 A 22 ILE CG1 C 13 28.747 0.200 A 22 ILE CG2 C 13 17.574 0.200 A 22 ILE N N 15 120.311 0.300 A 23 ASP H H 1 8.599 0.050 A 23 ASP HA H 1 4.416 0.050 A 23 ASP HBy H 1 2.816 0.050 A 23 ASP HBx H 1 2.685 0.050 A 23 ASP C C 13 178.544 0.200 A 23 ASP CA C 13 57.383 0.200 A 23 ASP CB C 13 39.401 0.200 A 23 ASP N N 15 123.007 0.300 A 24 LYS H H 1 7.696 0.050 A 24 LYS HA H 1 4.333 0.050 A 24 LYS HBy H 1 1.983 0.050 A 24 LYS HBx H 1 1.755 0.050 A 24 LYS HDy H 1 1.696 0.050 A 24 LYS HDx H 1 1.661 0.050 A 24 LYS HE2 H 1 2.908 0.050 A 24 LYS HE3 H 1 2.908 0.050 A 24 LYS HG2 H 1 1.462 0.050 A 24 LYS HG3 H 1 1.462 0.050 A 24 LYS C C 13 176.610 0.200 A 24 LYS CA C 13 56.596 0.200 A 24 LYS CB C 13 33.552 0.200 A 24 LYS CD C 13 29.518 0.200 A 24 LYS CE C 13 41.977 0.200 A 24 LYS CG C 13 25.978 0.200 A 24 LYS N N 15 117.684 0.300 A 25 GLY H H 1 8.178 0.050 A 25 GLY HAx H 1 3.724 0.050 A 25 GLY HAy H 1 4.137 0.050 A 25 GLY C C 13 175.278 0.200 A 25 GLY CA C 13 45.898 0.200 A 25 GLY N N 15 109.511 0.300 A 26 LYS H H 1 8.360 0.050 A 26 LYS HA H 1 4.571 0.050 A 26 LYS HB2 H 1 1.562 0.050 A 26 LYS HB3 H 1 1.562 0.050 A 26 LYS HD2 H 1 1.569 0.050 A 26 LYS HD3 H 1 1.569 0.050 A 26 LYS HE2 H 1 2.854 0.050 A 26 LYS HE3 H 1 2.854 0.050 A 26 LYS HG2 H 1 1.247 0.050 A 26 LYS HG3 H 1 1.247 0.050 A 26 LYS C C 13 175.365 0.200 A 26 LYS CA C 13 53.790 0.200 A 26 LYS CB C 13 29.278 0.200 A 26 LYS CD C 13 29.075 0.200 A 26 LYS CE C 13 41.991 0.200 A 26 LYS CG C 13 24.340 0.200 A 26 LYS N N 15 124.022 0.300 A 27 LEU H H 1 7.384 0.050 A 27 LEU HA H 1 4.182 0.050 A 27 LEU HB2 H 1 1.621 0.050 A 27 LEU HB3 H 1 1.621 0.050 A 27 LEU HD1% H 1 0.859 0.050 A 27 LEU HD2% H 1 0.973 0.050 A 27 LEU HG H 1 1.565 0.050 A 27 LEU C C 13 177.685 0.200 A 27 LEU CA C 13 55.811 0.200 A 27 LEU CB C 13 40.598 0.200 A 27 LEU CD1 C 13 23.801 0.200 A 27 LEU CD2 C 13 25.347 0.200 A 27 LEU CG C 13 28.193 0.200 A 27 LEU N N 15 117.052 0.300 A 28 ASP H H 1 8.636 0.050 A 28 ASP HA H 1 4.446 0.050 A 28 ASP HBy H 1 3.158 0.050 A 28 ASP HBx H 1 2.560 0.050 A 28 ASP C C 13 174.118 0.200 A 28 ASP CA C 13 52.442 0.200 A 28 ASP CB C 13 39.597 0.200 A 28 ASP N N 15 117.807 0.300 A 29 GLN H H 1 7.493 0.050 A 29 GLN HA H 1 5.401 0.050 A 29 GLN HB2 H 1 1.804 0.050 A 29 GLN HB3 H 1 1.804 0.050 A 29 GLN HE21 H 1 6.200 0.050 A 29 GLN HE22 H 1 6.990 0.050 A 29 GLN HGx H 1 1.873 0.050 A 29 GLN HGy H 1 1.994 0.050 A 29 GLN C C 13 174.161 0.200 A 29 GLN CA C 13 54.290 0.200 A 29 GLN CB C 13 32.803 0.200 A 29 GLN CG C 13 33.950 0.200 A 29 GLN N N 15 119.366 0.300 A 29 GLN NE2 N 15 106.404 0.300 A 30 VAL H H 1 8.394 0.050 A 30 VAL HA H 1 4.267 0.050 A 30 VAL HB H 1 1.887 0.050 A 30 VAL HG1% H 1 0.537 0.050 A 30 VAL HG2% H 1 0.677 0.050 A 30 VAL C C 13 173.215 0.200 A 30 VAL CA C 13 59.037 0.200 A 30 VAL CB C 13 36.288 0.200 A 30 VAL CG1 C 13 19.200 0.200 A 30 VAL CG2 C 13 22.782 0.200 A 30 VAL N N 15 108.580 0.300 A 31 VAL H H 1 6.807 0.050 A 31 VAL HA H 1 5.137 0.050 A 31 VAL HB H 1 1.585 0.050 A 31 VAL HG1% H 1 0.647 0.050 A 31 VAL HG2% H 1 0.751 0.050 A 31 VAL C C 13 174.719 0.200 A 31 VAL CA C 13 59.930 0.200 A 31 VAL CB C 13 33.833 0.200 A 31 VAL CG1 C 13 21.026 0.200 A 31 VAL CG2 C 13 20.485 0.200 A 31 VAL N N 15 120.659 0.300 A 32 TYR H H 1 9.063 0.050 A 32 TYR HA H 1 4.624 0.050 A 32 TYR HB2 H 1 2.471 0.050 A 32 TYR HB3 H 1 2.471 0.050 A 32 TYR HDx H 1 6.807 0.050 A 32 TYR HDy H 1 6.807 0.050 A 32 TYR HEx H 1 6.592 0.050 A 32 TYR HEy H 1 6.592 0.050 A 32 TYR C C 13 174.807 0.200 A 32 TYR CA C 13 57.582 0.200 A 32 TYR CB C 13 40.315 0.200 A 32 TYR CDx C 13 132.953 0.200 A 32 TYR CDy C 13 132.953 0.200 A 32 TYR CEx C 13 118.325 0.200 A 32 TYR CEy C 13 118.325 0.200 A 32 TYR N N 15 125.430 0.300 A 33 ASP H H 1 8.620 0.050 A 33 ASP HA H 1 3.894 0.050 A 33 ASP HBy H 1 2.734 0.050 A 33 ASP HBx H 1 1.477 0.050 A 33 ASP C C 13 174.676 0.200 A 33 ASP CA C 13 54.747 0.200 A 33 ASP CB C 13 39.018 0.200 A 33 ASP N N 15 132.180 0.300 A 34 ASP H H 1 8.376 0.050 A 34 ASP HA H 1 4.007 0.050 A 34 ASP HBy H 1 2.934 0.050 A 34 ASP HBx H 1 2.820 0.050 A 34 ASP C C 13 174.290 0.200 A 34 ASP CA C 13 56.215 0.200 A 34 ASP CB C 13 39.941 0.200 A 34 ASP N N 15 108.307 0.300 A 35 GLN H H 1 7.807 0.050 A 35 GLN HA H 1 4.633 0.050 A 35 GLN HBy H 1 2.006 0.050 A 35 GLN HBx H 1 1.884 0.050 A 35 GLN HE21 H 1 6.828 0.050 A 35 GLN HE22 H 1 7.537 0.050 A 35 GLN HGy H 1 2.430 0.050 A 35 GLN HGx H 1 2.225 0.050 A 35 GLN C C 13 173.130 0.200 A 35 GLN CA C 13 54.325 0.200 A 35 GLN CB C 13 32.442 0.200 A 35 GLN CG C 13 34.429 0.200 A 35 GLN N N 15 117.416 0.300 A 35 GLN NE2 N 15 112.263 0.300 A 36 LEU H H 1 8.277 0.050 A 36 LEU HA H 1 4.938 0.050 A 36 LEU HBy H 1 1.530 0.050 A 36 LEU HBx H 1 1.441 0.050 A 36 LEU HD1% H 1 0.788 0.050 A 36 LEU HD2% H 1 0.878 0.050 A 36 LEU HG H 1 1.472 0.050 A 36 LEU C C 13 175.667 0.200 A 36 LEU CA C 13 54.313 0.200 A 36 LEU CB C 13 44.538 0.200 A 36 LEU CD1 C 13 25.651 0.200 A 36 LEU CD2 C 13 25.068 0.200 A 36 LEU CG C 13 27.309 0.200 A 36 LEU N N 15 122.240 0.300 A 37 TYR H H 1 9.173 0.050 A 37 TYR HA H 1 5.098 0.050 A 37 TYR HB2 H 1 2.548 0.050 A 37 TYR HB3 H 1 2.548 0.050 A 37 TYR HDx H 1 6.779 0.050 A 37 TYR HDy H 1 6.779 0.050 A 37 TYR C C 13 174.805 0.200 A 37 TYR CA C 13 56.643 0.200 A 37 TYR CB C 13 42.749 0.200 A 37 TYR N N 15 121.192 0.300 A 38 HIS H H 1 9.437 0.050 A 38 HIS HA H 1 5.198 0.050 A 38 HIS HBy H 1 3.225 0.050 A 38 HIS HBx H 1 2.946 0.050 A 38 HIS HD2 H 1 7.350 0.050 A 38 HIS C C 13 175.450 0.200 A 38 HIS CA C 13 53.376 0.200 A 38 HIS CB C 13 32.291 0.200 A 38 HIS CD2 C 13 119.339 0.200 A 38 HIS N N 15 119.805 0.300 A 39 LEU H H 1 9.030 0.050 A 39 LEU HA H 1 4.194 0.050 A 39 LEU HBy H 1 1.541 0.050 A 39 LEU HBx H 1 1.092 0.050 A 39 LEU HD1% H 1 0.275 0.050 A 39 LEU HD2% H 1 0.381 0.050 A 39 LEU HG H 1 1.217 0.050 A 39 LEU C C 13 175.750 0.200 A 39 LEU CA C 13 56.237 0.200 A 39 LEU CB C 13 41.402 0.200 A 39 LEU CD1 C 13 23.430 0.200 A 39 LEU CD2 C 13 24.960 0.200 A 39 LEU CG C 13 27.469 0.200 A 39 LEU N N 15 127.165 0.300 A 40 LYS H H 1 9.247 0.050 A 40 LYS HA H 1 4.354 0.050 A 40 LYS HBy H 1 1.956 0.050 A 40 LYS HBx H 1 1.629 0.050 A 40 LYS HD2 H 1 1.564 0.050 A 40 LYS HD3 H 1 1.564 0.050 A 40 LYS HEy H 1 2.961 0.050 A 40 LYS HEx H 1 2.855 0.050 A 40 LYS HG2 H 1 1.449 0.050 A 40 LYS HG3 H 1 1.449 0.050 A 40 LYS C C 13 175.493 0.200 A 40 LYS CA C 13 54.647 0.200 A 40 LYS CB C 13 32.051 0.200 A 40 LYS CD C 13 28.019 0.200 A 40 LYS CE C 13 41.795 0.200 A 40 LYS CG C 13 24.360 0.200 A 40 LYS N N 15 125.938 0.300 A 41 GLU H H 1 8.503 0.050 A 41 GLU HA H 1 4.548 0.050 A 41 GLU HBy H 1 2.191 0.050 A 41 GLU HBx H 1 2.070 0.050 A 41 GLU HGx H 1 2.209 0.050 A 41 GLU HGy H 1 2.280 0.050 A 41 GLU C C 13 174.461 0.200 A 41 GLU CA C 13 55.750 0.200 A 41 GLU CB C 13 30.388 0.200 A 41 GLU CG C 13 35.136 0.200 A 41 GLU N N 15 118.437 0.300 A 42 LYS H H 1 8.318 0.050 A 42 LYS HA H 1 4.451 0.050 A 42 LYS HBy H 1 1.541 0.050 A 42 LYS HBx H 1 1.453 0.050 A 42 LYS HD2 H 1 1.478 0.050 A 42 LYS HD3 H 1 1.478 0.050 A 42 LYS HE2 H 1 2.858 0.050 A 42 LYS HE3 H 1 2.858 0.050 A 42 LYS HGx H 1 0.784 0.050 A 42 LYS HGy H 1 1.049 0.050 A 42 LYS C C 13 177.298 0.200 A 42 LYS CA C 13 56.315 0.200 A 42 LYS CB C 13 33.265 0.200 A 42 LYS CD C 13 29.510 0.200 A 42 LYS CE C 13 41.990 0.200 A 42 LYS CG C 13 25.346 0.200 A 42 LYS N N 15 122.218 0.300 A 43 VAL H H 1 8.724 0.050 A 43 VAL HA H 1 4.571 0.050 A 43 VAL HB H 1 1.984 0.050 A 43 VAL HG1% H 1 0.564 0.050 A 43 VAL HG2% H 1 0.842 0.050 A 43 VAL C C 13 174.440 0.200 A 43 VAL CA C 13 58.725 0.200 A 43 VAL CB C 13 35.371 0.200 A 43 VAL CG1 C 13 19.202 0.200 A 43 VAL CG2 C 13 21.956 0.200 A 43 VAL N N 15 118.735 0.300 A 44 ASP H H 1 8.060 0.050 A 44 ASP HA H 1 4.556 0.050 A 44 ASP HBy H 1 2.783 0.050 A 44 ASP HBx H 1 2.475 0.050 A 44 ASP C C 13 177.124 0.200 A 44 ASP CA C 13 53.942 0.200 A 44 ASP CB C 13 42.120 0.200 A 44 ASP N N 15 121.083 0.300 A 45 GLU H H 1 8.643 0.050 A 45 GLU HA H 1 3.216 0.050 A 45 GLU HB2 H 1 1.944 0.050 A 45 GLU HB3 H 1 1.944 0.050 A 45 GLU HGy H 1 2.068 0.050 A 45 GLU HGx H 1 1.965 0.050 A 45 GLU C C 13 176.697 0.200 A 45 GLU CA C 13 59.049 0.200 A 45 GLU CB C 13 29.693 0.200 A 45 GLU CG C 13 35.719 0.200 A 45 GLU N N 15 120.102 0.300 A 46 ASP H H 1 8.277 0.050 A 46 ASP HA H 1 4.359 0.050 A 46 ASP HBy H 1 2.700 0.050 A 46 ASP HBx H 1 2.561 0.050 A 46 ASP C C 13 176.954 0.200 A 46 ASP CA C 13 54.632 0.200 A 46 ASP CB C 13 39.767 0.200 A 46 ASP N N 15 115.291 0.300 A 47 LYS H H 1 7.692 0.050 A 47 LYS HA H 1 4.270 0.050 A 47 LYS HBy H 1 1.849 0.050 A 47 LYS HBx H 1 1.716 0.050 A 47 LYS HD2 H 1 1.560 0.050 A 47 LYS HD3 H 1 1.560 0.050 A 47 LYS HE2 H 1 2.977 0.050 A 47 LYS HE3 H 1 2.977 0.050 A 47 LYS HGx H 1 1.369 0.050 A 47 LYS HGy H 1 1.458 0.050 A 47 LYS C C 13 176.009 0.200 A 47 LYS CA C 13 54.752 0.200 A 47 LYS CB C 13 31.577 0.200 A 47 LYS CD C 13 28.110 0.200 A 47 LYS CE C 13 42.182 0.200 A 47 LYS CG C 13 24.689 0.200 A 47 LYS N N 15 118.975 0.300 A 48 LYS H H 1 6.978 0.050 A 48 LYS HA H 1 3.952 0.050 A 48 LYS HBy H 1 1.190 0.050 A 48 LYS HBx H 1 0.900 0.050 A 48 LYS HDx H 1 -0.285 0.050 A 48 LYS HDy H 1 0.241 0.050 A 48 LYS HE2 H 1 2.160 0.050 A 48 LYS HE3 H 1 2.160 0.050 A 48 LYS HG2 H 1 0.680 0.050 A 48 LYS HG3 H 1 0.680 0.050 A 48 LYS C C 13 174.848 0.200 A 48 LYS CA C 13 55.866 0.200 A 48 LYS CB C 13 33.654 0.200 A 48 LYS CD C 13 28.840 0.200 A 48 LYS CE C 13 41.445 0.200 A 48 LYS CG C 13 22.690 0.200 A 48 LYS N N 15 116.606 0.300 A 49 GLY H H 1 7.800 0.050 A 49 GLY HAy H 1 4.122 0.050 A 49 GLY HAx H 1 3.365 0.050 A 49 GLY C C 13 173.258 0.200 A 49 GLY CA C 13 43.952 0.200 A 49 GLY N N 15 109.875 0.300 A 50 LYS H H 1 7.867 0.050 A 50 LYS HA H 1 4.451 0.050 A 50 LYS HB2 H 1 1.822 0.050 A 50 LYS HB3 H 1 1.822 0.050 A 50 LYS HD2 H 1 1.663 0.050 A 50 LYS HD3 H 1 1.663 0.050 A 50 LYS HE2 H 1 2.977 0.050 A 50 LYS HE3 H 1 2.977 0.050 A 50 LYS HGx H 1 1.373 0.050 A 50 LYS HGy H 1 1.501 0.050 A 50 LYS C C 13 176.180 0.200 A 50 LYS CA C 13 55.378 0.200 A 50 LYS CB C 13 33.995 0.200 A 50 LYS CD C 13 29.336 0.200 A 50 LYS CE C 13 42.188 0.200 A 50 LYS CG C 13 24.340 0.200 A 50 LYS N N 15 122.060 0.300 A 51 VAL H H 1 8.560 0.050 A 51 VAL HA H 1 3.696 0.050 A 51 VAL HB H 1 1.960 0.050 A 51 VAL HG1% H 1 0.853 0.050 A 51 VAL HG2% H 1 0.911 0.050 A 51 VAL C C 13 176.696 0.200 A 51 VAL CA C 13 63.631 0.200 A 51 VAL CB C 13 32.178 0.200 A 51 VAL CG1 C 13 23.262 0.200 A 51 VAL CG2 C 13 20.875 0.200 A 51 VAL N N 15 122.532 0.300 A 52 ILE H H 1 8.992 0.050 A 52 ILE HA H 1 4.688 0.050 A 52 ILE HB H 1 2.060 0.050 A 52 ILE HD1% H 1 0.726 0.050 A 52 ILE HG12 H 1 0.954 0.050 A 52 ILE HG13 H 1 0.954 0.050 A 52 ILE HG2% H 1 0.963 0.050 A 52 ILE C C 13 175.622 0.200 A 52 ILE CA C 13 61.240 0.200 A 52 ILE CB C 13 40.049 0.200 A 52 ILE CD1 C 13 13.557 0.200 A 52 ILE CG1 C 13 25.813 0.200 A 52 ILE CG2 C 13 18.115 0.200 A 52 ILE N N 15 121.088 0.300 A 53 GLY H H 1 7.673 0.050 A 53 GLY HAx H 1 3.973 0.050 A 53 GLY HAy H 1 4.565 0.050 A 53 GLY CA C 13 45.840 0.200 A 53 GLY N N 15 109.977 0.300 A 54 ALA H H 1 9.013 0.050 A 54 ALA HA H 1 4.672 0.050 A 54 ALA HB% H 1 1.360 0.050 A 54 ALA C C 13 176.094 0.200 A 54 ALA CA C 13 52.829 0.200 A 54 ALA CB C 13 21.542 0.200 A 54 ALA N N 15 121.763 0.300 A 55 ILE H H 1 8.473 0.050 A 55 ILE HA H 1 4.290 0.050 A 55 ILE HB H 1 1.805 0.050 A 55 ILE HD1% H 1 0.841 0.050 A 55 ILE HG1y H 1 1.663 0.050 A 55 ILE HG1x H 1 1.361 0.050 A 55 ILE HG2% H 1 1.038 0.050 A 55 ILE C C 13 177.858 0.200 A 55 ILE CA C 13 64.244 0.200 A 55 ILE CB C 13 38.847 0.200 A 55 ILE CD1 C 13 13.545 0.200 A 55 ILE CG1 C 13 28.216 0.200 A 55 ILE CG2 C 13 17.921 0.200 A 55 ILE N N 15 121.528 0.300 A 56 GLY H H 1 7.701 0.050 A 56 GLY HAy H 1 4.148 0.050 A 56 GLY HAx H 1 3.723 0.050 A 56 GLY C C 13 174.805 0.200 A 56 GLY CA C 13 48.388 0.200 A 56 GLY N N 15 106.647 0.300 A 57 GLN H H 1 7.937 0.050 A 57 GLN HA H 1 4.725 0.050 A 57 GLN HB2 H 1 1.592 0.050 A 57 GLN HB3 H 1 1.592 0.050 A 57 GLN HE21 H 1 7.047 0.050 A 57 GLN HE22 H 1 7.308 0.050 A 57 GLN HGy H 1 2.321 0.050 A 57 GLN HGx H 1 2.272 0.050 A 57 GLN C C 13 173.947 0.200 A 57 GLN CA C 13 55.099 0.200 A 57 GLN CB C 13 35.678 0.200 A 57 GLN CG C 13 34.627 0.200 A 57 GLN N N 15 116.187 0.300 A 57 GLN NE2 N 15 111.523 0.300 A 58 THR H H 1 8.346 0.050 A 58 THR HA H 1 5.172 0.050 A 58 THR HB H 1 3.707 0.050 A 58 THR HG2% H 1 0.631 0.050 A 58 THR C C 13 172.571 0.200 A 58 THR CA C 13 61.417 0.200 A 58 THR CB C 13 71.141 0.200 A 58 THR CG2 C 13 22.290 0.200 A 58 THR N N 15 119.112 0.300 A 59 PHE H H 1 8.820 0.050 A 59 PHE HA H 1 4.784 0.050 A 59 PHE HBy H 1 3.196 0.050 A 59 PHE HBx H 1 2.774 0.050 A 59 PHE HDx H 1 7.420 0.050 A 59 PHE HDy H 1 7.420 0.050 A 59 PHE HEx H 1 7.194 0.050 A 59 PHE HEy H 1 7.194 0.050 A 59 PHE C C 13 172.355 0.200 A 59 PHE CA C 13 55.553 0.200 A 59 PHE CB C 13 43.933 0.200 A 59 PHE CDx C 13 132.301 0.200 A 59 PHE CDy C 13 132.301 0.200 A 59 PHE CEx C 13 130.930 0.200 A 59 PHE CEy C 13 130.930 0.200 A 59 PHE N N 15 125.434 0.300 A 60 PHE H H 1 9.617 0.050 A 60 PHE HA H 1 5.495 0.050 A 60 PHE HBy H 1 2.503 0.050 A 60 PHE HBx H 1 2.249 0.050 A 60 PHE HDx H 1 6.771 0.050 A 60 PHE HDy H 1 6.771 0.050 A 60 PHE HEx H 1 7.126 0.050 A 60 PHE HEy H 1 7.126 0.050 A 60 PHE C C 13 175.964 0.200 A 60 PHE CA C 13 56.496 0.200 A 60 PHE CB C 13 42.355 0.200 A 60 PHE CDx C 13 132.125 0.200 A 60 PHE CDy C 13 132.125 0.200 A 60 PHE CEx C 13 130.750 0.200 A 60 PHE CEy C 13 130.750 0.200 A 60 PHE N N 15 117.699 0.300 A 61 VAL H H 1 9.140 0.050 A 61 VAL HA H 1 5.703 0.050 A 61 VAL HB H 1 1.960 0.050 A 61 VAL HG1% H 1 0.839 0.050 A 61 VAL HG2% H 1 0.984 0.050 A 61 VAL C C 13 175.193 0.200 A 61 VAL CA C 13 58.437 0.200 A 61 VAL CB C 13 36.516 0.200 A 61 VAL CG1 C 13 21.836 0.200 A 61 VAL CG2 C 13 18.616 0.200 A 61 VAL N N 15 114.768 0.300 A 62 ASP H H 1 8.378 0.050 A 62 ASP HA H 1 5.475 0.050 A 62 ASP HBy H 1 3.506 0.050 A 62 ASP HBx H 1 2.828 0.050 A 62 ASP C C 13 179.341 0.200 A 62 ASP CA C 13 51.512 0.200 A 62 ASP CB C 13 43.403 0.200 A 62 ASP N N 15 120.954 0.300 A 63 GLY H H 1 9.059 0.050 A 63 GLY HAx H 1 3.908 0.050 A 63 GLY HAy H 1 3.989 0.050 A 63 GLY C C 13 174.763 0.200 A 63 GLY CA C 13 46.548 0.200 A 63 GLY N N 15 106.547 0.300 A 64 ASP H H 1 8.462 0.050 A 64 ASP HA H 1 4.947 0.050 A 64 ASP HBy H 1 2.902 0.050 A 64 ASP HBx H 1 2.670 0.050 A 64 ASP C C 13 176.417 0.200 A 64 ASP CA C 13 53.907 0.200 A 64 ASP CB C 13 41.988 0.200 A 64 ASP N N 15 119.209 0.300 A 65 GLY H H 1 8.126 0.050 A 65 GLY HAx H 1 3.504 0.050 A 65 GLY HAy H 1 4.235 0.050 A 65 GLY C C 13 173.559 0.200 A 65 GLY CA C 13 45.317 0.200 A 65 GLY N N 15 108.724 0.300 A 66 LYS H H 1 8.432 0.050 A 66 LYS HA H 1 4.283 0.050 A 66 LYS HB2 H 1 1.896 0.050 A 66 LYS HB3 H 1 1.896 0.050 A 66 LYS HD2 H 1 1.657 0.050 A 66 LYS HD3 H 1 1.657 0.050 A 66 LYS HE2 H 1 2.977 0.050 A 66 LYS HE3 H 1 2.977 0.050 A 66 LYS HG2 H 1 1.381 0.050 A 66 LYS HG3 H 1 1.381 0.050 A 66 LYS C C 13 176.481 0.200 A 66 LYS CA C 13 55.631 0.200 A 66 LYS CB C 13 32.410 0.200 A 66 LYS CD C 13 29.031 0.200 A 66 LYS CE C 13 42.184 0.200 A 66 LYS CG C 13 24.830 0.200 A 66 LYS N N 15 122.757 0.300 A 67 ARG H H 1 8.989 0.050 A 67 ARG HA H 1 4.965 0.050 A 67 ARG HBx H 1 1.998 0.050 A 67 ARG HBy H 1 1.998 0.050 A 67 ARG HDy H 1 3.664 0.050 A 67 ARG HDx H 1 2.774 0.050 A 67 ARG HE H 1 8.818 0.050 A 67 ARG HG2 H 1 1.804 0.050 A 67 ARG HG3 H 1 1.804 0.050 A 67 ARG C C 13 178.072 0.200 A 67 ARG CA C 13 56.394 0.200 A 67 ARG CB C 13 32.242 0.200 A 67 ARG CD C 13 43.649 0.200 A 67 ARG CG C 13 28.472 0.200 A 67 ARG N N 15 125.874 0.300 A 67 ARG NE N 15 111.365 0.300 A 68 TRP H H 1 9.356 0.050 A 68 TRP HA H 1 4.497 0.050 A 68 TRP HB2 H 1 3.269 0.050 A 68 TRP HB3 H 1 3.269 0.050 A 68 TRP HD1 H 1 6.919 0.050 A 68 TRP HE1 H 1 10.434 0.050 A 68 TRP HE3 H 1 6.824 0.050 A 68 TRP HH2 H 1 7.034 0.050 A 68 TRP HZ2 H 1 7.132 0.050 A 68 TRP HZ3 H 1 7.242 0.050 A 68 TRP C C 13 176.524 0.200 A 68 TRP CA C 13 58.270 0.200 A 68 TRP CB C 13 29.091 0.200 A 68 TRP CD1 C 13 124.589 0.200 A 68 TRP CE3 C 13 118.260 0.200 A 68 TRP CH2 C 13 121.753 0.200 A 68 TRP CZ2 C 13 114.515 0.200 A 68 TRP CZ3 C 13 120.190 0.200 A 68 TRP N N 15 129.312 0.300 A 68 TRP NE1 N 15 129.259 0.300 A 69 SER H H 1 9.254 0.050 A 69 SER HA H 1 4.731 0.050 A 69 SER HBy H 1 4.492 0.050 A 69 SER HBx H 1 4.048 0.050 A 69 SER C C 13 174.678 0.200 A 69 SER CA C 13 56.814 0.200 A 69 SER CB C 13 65.713 0.200 A 69 SER N N 15 122.127 0.300 A 70 GLU H H 1 9.127 0.050 A 70 GLU HA H 1 4.095 0.050 A 70 GLU HB2 H 1 2.110 0.050 A 70 GLU HB3 H 1 2.110 0.050 A 70 GLU HG2 H 1 2.476 0.050 A 70 GLU HG3 H 1 2.476 0.050 A 70 GLU C C 13 179.531 0.200 A 70 GLU CA C 13 59.979 0.200 A 70 GLU CB C 13 29.434 0.200 A 70 GLU CG C 13 36.560 0.200 A 70 GLU N N 15 120.891 0.300 A 71 GLU H H 1 8.644 0.050 A 71 GLU HA H 1 4.031 0.050 A 71 GLU HB2 H 1 2.019 0.050 A 71 GLU HB3 H 1 2.019 0.050 A 71 GLU HG2 H 1 2.405 0.050 A 71 GLU HG3 H 1 2.405 0.050 A 71 GLU C C 13 179.705 0.200 A 71 GLU CA C 13 59.859 0.200 A 71 GLU CB C 13 29.382 0.200 A 71 GLU CG C 13 36.615 0.200 A 71 GLU N N 15 117.648 0.300 A 72 GLU H H 1 7.906 0.050 A 72 GLU HA H 1 4.116 0.050 A 72 GLU HB2 H 1 2.023 0.050 A 72 GLU HB3 H 1 2.023 0.050 A 72 GLU HG2 H 1 2.193 0.050 A 72 GLU HG3 H 1 2.193 0.050 A 72 GLU C C 13 179.705 0.200 A 72 GLU CA C 13 58.481 0.200 A 72 GLU CB C 13 29.554 0.200 A 72 GLU CG C 13 36.712 0.200 A 72 GLU N N 15 120.187 0.300 A 73 LEU H H 1 8.109 0.050 A 73 LEU HA H 1 4.143 0.050 A 73 LEU HBy H 1 1.951 0.050 A 73 LEU HBx H 1 1.414 0.050 A 73 LEU HD1% H 1 0.216 0.050 A 73 LEU HD2% H 1 0.951 0.050 A 73 LEU HG H 1 2.031 0.050 A 73 LEU C C 13 178.157 0.200 A 73 LEU CA C 13 56.414 0.200 A 73 LEU CB C 13 42.363 0.200 A 73 LEU CD1 C 13 22.969 0.200 A 73 LEU CD2 C 13 25.879 0.200 A 73 LEU CG C 13 26.917 0.200 A 73 LEU N N 15 118.027 0.300 A 74 LYS H H 1 7.414 0.050 A 74 LYS HA H 1 4.199 0.050 A 74 LYS HB2 H 1 1.914 0.050 A 74 LYS HB3 H 1 1.914 0.050 A 74 LYS HD2 H 1 1.662 0.050 A 74 LYS HD3 H 1 1.662 0.050 A 74 LYS HE2 H 1 2.973 0.050 A 74 LYS HE3 H 1 2.973 0.050 A 74 LYS HGy H 1 1.649 0.050 A 74 LYS HGx H 1 1.497 0.050 A 74 LYS C C 13 176.739 0.200 A 74 LYS CA C 13 57.220 0.200 A 74 LYS CB C 13 33.286 0.200 A 74 LYS CD C 13 29.123 0.200 A 74 LYS CE C 13 42.157 0.200 A 74 LYS CG C 13 25.074 0.200 A 74 LYS N N 15 117.599 0.300 A 75 GLU H H 1 7.409 0.050 A 75 GLU HA H 1 4.608 0.050 A 75 GLU HB2 H 1 2.011 0.050 A 75 GLU HB3 H 1 2.011 0.050 A 75 GLU HGy H 1 2.403 0.050 A 75 GLU HGx H 1 2.335 0.050 A 75 GLU CA C 13 54.336 0.200 A 75 GLU CB C 13 29.881 0.200 A 75 GLU CG C 13 35.784 0.200 A 75 GLU N N 15 120.023 0.300 A 76 PRO HA H 1 4.412 0.050 A 76 PRO HBy H 1 2.260 0.050 A 76 PRO HBx H 1 1.824 0.050 A 76 PRO HDy H 1 3.817 0.050 A 76 PRO HDx H 1 3.691 0.050 A 76 PRO HG2 H 1 2.005 0.050 A 76 PRO HG3 H 1 2.005 0.050 A 76 PRO C C 13 176.672 0.200 A 76 PRO CA C 13 63.476 0.200 A 76 PRO CB C 13 31.945 0.200 A 76 PRO CD C 13 50.640 0.200 A 76 PRO CG C 13 27.195 0.200 A 77 TYR H H 1 8.436 0.050 A 77 TYR HA H 1 4.632 0.050 A 77 TYR HBy H 1 3.065 0.050 A 77 TYR HBx H 1 2.988 0.050 A 77 TYR HDx H 1 7.174 0.050 A 77 TYR HDy H 1 7.174 0.050 A 77 TYR HEx H 1 6.887 0.050 A 77 TYR HEy H 1 6.887 0.050 A 77 TYR C C 13 175.279 0.200 A 77 TYR CA C 13 58.027 0.200 A 77 TYR CB C 13 38.790 0.200 A 77 TYR CDx C 13 133.262 0.200 A 77 TYR CDy C 13 133.262 0.200 A 77 TYR CEx C 13 118.371 0.200 A 77 TYR CEy C 13 118.371 0.200 A 77 TYR N N 15 122.948 0.300 A 78 ILE H H 1 8.034 0.050 A 78 ILE HA H 1 4.115 0.050 A 78 ILE HB H 1 1.759 0.050 A 78 ILE HD1% H 1 0.809 0.050 A 78 ILE HG1y H 1 1.396 0.050 A 78 ILE HG1x H 1 1.108 0.050 A 78 ILE HG2% H 1 0.828 0.050 A 78 ILE C C 13 175.360 0.200 A 78 ILE CA C 13 60.395 0.200 A 78 ILE CB C 13 39.072 0.200 A 78 ILE CD1 C 13 12.694 0.200 A 78 ILE CG1 C 13 26.965 0.200 A 78 ILE CG2 C 13 17.439 0.200 A 78 ILE N N 15 125.952 0.300 A 79 SER H H 1 8.213 0.050 A 79 SER HA H 1 4.345 0.050 A 79 SER HBy H 1 3.895 0.050 A 79 SER HBx H 1 3.722 0.050 A 79 SER C C 13 174.376 0.200 A 79 SER CA C 13 57.722 0.200 A 79 SER CB C 13 63.939 0.200 A 79 SER N N 15 119.408 0.300 A 80 ASN H H 1 8.476 0.050 A 80 ASN HA H 1 4.638 0.050 A 80 ASN HB2 H 1 2.779 0.050 A 80 ASN HB3 H 1 2.779 0.050 A 80 ASN HD21 H 1 6.902 0.050 A 80 ASN HD22 H 1 7.542 0.050 A 80 ASN C C 13 174.590 0.200 A 80 ASN CA C 13 53.567 0.200 A 80 ASN CB C 13 38.717 0.200 A 80 ASN N N 15 120.848 0.300 A 80 ASN ND2 N 15 113.064 0.300 A 81 ASN H H 1 8.199 0.050 A 81 ASN HA H 1 5.009 0.050 A 81 ASN HBy H 1 2.922 0.050 A 81 ASN HBx H 1 2.690 0.050 A 81 ASN HD21 H 1 7.095 0.050 A 81 ASN HD22 H 1 7.652 0.050 A 81 ASN CA C 13 50.659 0.200 A 81 ASN CB C 13 39.105 0.200 A 81 ASN N N 15 118.794 0.300 A 81 ASN ND2 N 15 113.066 0.300 A 82 PRO HA H 1 4.308 0.050 A 82 PRO HBy H 1 2.300 0.050 A 82 PRO HBx H 1 1.997 0.050 A 82 PRO HD2 H 1 3.826 0.050 A 82 PRO HD3 H 1 3.826 0.050 A 82 PRO HG2 H 1 2.002 0.050 A 82 PRO HG3 H 1 2.002 0.050 A 82 PRO C C 13 177.102 0.200 A 82 PRO CA C 13 64.363 0.200 A 82 PRO CB C 13 32.057 0.200 A 82 PRO CD C 13 50.920 0.200 A 82 PRO CG C 13 27.140 0.200 A 83 ASP H H 1 8.109 0.050 A 83 ASP HA H 1 4.576 0.050 A 83 ASP HBy H 1 2.768 0.050 A 83 ASP HBx H 1 2.606 0.050 A 83 ASP C C 13 176.138 0.200 A 83 ASP CA C 13 54.837 0.200 A 83 ASP CB C 13 41.050 0.200 A 83 ASP N N 15 116.763 0.300 A 84 GLU H H 1 7.767 0.050 A 84 GLU HA H 1 4.403 0.050 A 84 GLU HBy H 1 2.130 0.050 A 84 GLU HBx H 1 1.887 0.050 A 84 GLU HG2 H 1 2.181 0.050 A 84 GLU HG3 H 1 2.181 0.050 A 84 GLU C C 13 175.536 0.200 A 84 GLU CA C 13 55.699 0.200 A 84 GLU CB C 13 30.677 0.200 A 84 GLU CG C 13 36.270 0.200 A 84 GLU N N 15 119.806 0.300 A 85 ILE H H 1 7.898 0.050 A 85 ILE HA H 1 4.175 0.050 A 85 ILE HB H 1 1.842 0.050 A 85 ILE HD1% H 1 0.827 0.050 A 85 ILE HG1y H 1 1.494 0.050 A 85 ILE HG1x H 1 1.162 0.050 A 85 ILE HG2% H 1 0.876 0.050 A 85 ILE C C 13 175.579 0.200 A 85 ILE CA C 13 61.089 0.200 A 85 ILE CB C 13 39.297 0.200 A 85 ILE CD1 C 13 13.168 0.200 A 85 ILE CG1 C 13 27.492 0.200 A 85 ILE CG2 C 13 17.419 0.200 A 85 ILE N N 15 122.573 0.300 A 86 ARG H H 1 8.458 0.050 A 86 ARG HA H 1 4.478 0.050 A 86 ARG HBy H 1 1.881 0.050 A 86 ARG HBx H 1 1.716 0.050 A 86 ARG HD2 H 1 2.828 0.050 A 86 ARG HD3 H 1 2.828 0.050 A 86 ARG HE H 1 8.163 0.050 A 86 ARG HGy H 1 1.561 0.050 A 86 ARG HGx H 1 1.468 0.050 A 86 ARG C C 13 175.815 0.200 A 86 ARG CA C 13 56.292 0.200 A 86 ARG CB C 13 31.760 0.200 A 86 ARG CD C 13 43.434 0.200 A 86 ARG CG C 13 27.996 0.200 A 86 ARG N N 15 128.912 0.300 A 86 ARG NE N 15 114.011 0.300 A 87 GLU H H 1 9.000 0.050 A 87 GLU HA H 1 4.223 0.050 A 87 GLU HBy H 1 2.095 0.050 A 87 GLU HBx H 1 1.987 0.050 A 87 GLU HGy H 1 2.421 0.050 A 87 GLU HGx H 1 2.317 0.050 A 87 GLU C C 13 175.019 0.200 A 87 GLU CA C 13 57.528 0.200 A 87 GLU CB C 13 31.651 0.200 A 87 GLU CG C 13 37.062 0.200 A 87 GLU N N 15 128.150 0.300 A 88 LYS H H 1 8.737 0.050 A 88 LYS HA H 1 4.243 0.050 A 88 LYS HBy H 1 1.265 0.050 A 88 LYS HBx H 1 1.094 0.050 A 88 LYS HDy H 1 0.387 0.050 A 88 LYS HDx H 1 0.241 0.050 A 88 LYS HEy H 1 1.359 0.050 A 88 LYS HEx H 1 1.128 0.050 A 88 LYS HGy H 1 0.042 0.050 A 88 LYS HGx H 1 -0.252 0.050 A 88 LYS C C 13 174.376 0.200 A 88 LYS CA C 13 55.780 0.200 A 88 LYS CB C 13 33.895 0.200 A 88 LYS CD C 13 28.773 0.200 A 88 LYS CE C 13 40.610 0.200 A 88 LYS CG C 13 24.741 0.200 A 88 LYS N N 15 124.830 0.300 A 89 LYS H H 1 9.521 0.050 A 89 LYS HA H 1 4.922 0.050 A 89 LYS HB2 H 1 1.895 0.050 A 89 LYS HB3 H 1 1.895 0.050 A 89 LYS HDy H 1 1.650 0.050 A 89 LYS HDx H 1 1.574 0.050 A 89 LYS HEy H 1 2.978 0.050 A 89 LYS HEx H 1 2.862 0.050 A 89 LYS HGx H 1 1.375 0.050 A 89 LYS HGy H 1 1.469 0.050 A 89 LYS CA C 13 53.609 0.200 A 89 LYS CB C 13 32.238 0.200 A 89 LYS CD C 13 29.100 0.200 A 89 LYS CE C 13 42.149 0.200 A 89 LYS CG C 13 24.681 0.200 A 89 LYS N N 15 128.015 0.300 A 90 PRO HA H 1 4.374 0.050 A 90 PRO HBy H 1 1.917 0.050 A 90 PRO HBx H 1 1.604 0.050 A 90 PRO HDy H 1 4.096 0.050 A 90 PRO HDx H 1 3.823 0.050 A 90 PRO HG2 H 1 2.126 0.050 A 90 PRO HG3 H 1 2.126 0.050 A 90 PRO C C 13 176.608 0.200 A 90 PRO CA C 13 62.572 0.200 A 90 PRO CB C 13 32.672 0.200 A 90 PRO CD C 13 51.100 0.200 A 90 PRO CG C 13 27.230 0.200 A 91 LEU H H 1 8.932 0.050 A 91 LEU HA H 1 4.363 0.050 A 91 LEU HBy H 1 2.052 0.050 A 91 LEU HBx H 1 1.585 0.050 A 91 LEU HD1% H 1 1.029 0.050 A 91 LEU HD2% H 1 1.039 0.050 A 91 LEU HG H 1 1.665 0.050 A 91 LEU C C 13 173.774 0.200 A 91 LEU CA C 13 54.248 0.200 A 91 LEU CB C 13 43.146 0.200 A 91 LEU CD1 C 13 28.183 0.200 A 91 LEU CD2 C 13 23.954 0.200 A 91 LEU CG C 13 26.364 0.200 A 91 LEU N N 15 123.690 0.300 A 92 ARG H H 1 8.185 0.050 A 92 ARG HA H 1 4.713 0.050 A 92 ARG HB2 H 1 1.603 0.050 A 92 ARG HB3 H 1 1.603 0.050 A 92 ARG HDy H 1 3.077 0.050 A 92 ARG HDx H 1 2.997 0.050 A 92 ARG HG2 H 1 1.434 0.050 A 92 ARG HG3 H 1 1.434 0.050 A 92 ARG C C 13 175.213 0.200 A 92 ARG CA C 13 55.134 0.200 A 92 ARG CB C 13 31.030 0.200 A 92 ARG CD C 13 43.446 0.200 A 92 ARG CG C 13 27.680 0.200 A 92 ARG N N 15 122.320 0.300 A 93 TYR H H 1 9.064 0.050 A 93 TYR HA H 1 5.092 0.050 A 93 TYR HBy H 1 3.296 0.050 A 93 TYR HBx H 1 2.875 0.050 A 93 TYR HDx H 1 6.984 0.050 A 93 TYR HDy H 1 6.984 0.050 A 93 TYR HEx H 1 6.400 0.050 A 93 TYR HEy H 1 6.400 0.050 A 93 TYR C C 13 177.083 0.200 A 93 TYR CA C 13 57.974 0.200 A 93 TYR CB C 13 40.086 0.200 A 93 TYR CDx C 13 132.302 0.200 A 93 TYR CDy C 13 132.302 0.200 A 93 TYR CEx C 13 119.542 0.200 A 93 TYR CEy C 13 119.542 0.200 A 93 TYR N N 15 127.147 0.300 A 94 GLY H H 1 9.275 0.050 A 94 GLY HAx H 1 3.773 0.050 A 94 GLY HAy H 1 4.716 0.050 A 94 GLY C C 13 173.946 0.200 A 94 GLY CA C 13 45.163 0.200 A 94 GLY N N 15 115.960 0.300 A 95 LYS H H 1 8.947 0.050 A 95 LYS HA H 1 4.304 0.050 A 95 LYS HBy H 1 1.902 0.050 A 95 LYS HBx H 1 1.575 0.050 A 95 LYS HD2 H 1 1.707 0.050 A 95 LYS HD3 H 1 1.707 0.050 A 95 LYS HE2 H 1 3.065 0.050 A 95 LYS HE3 H 1 3.065 0.050 A 95 LYS HGy H 1 1.713 0.050 A 95 LYS HGx H 1 1.475 0.050 A 95 LYS C C 13 172.442 0.200 A 95 LYS CA C 13 57.330 0.200 A 95 LYS CB C 13 35.049 0.200 A 95 LYS CD C 13 29.326 0.200 A 95 LYS CE C 13 42.129 0.200 A 95 LYS CG C 13 26.613 0.200 A 95 LYS N N 15 128.643 0.300 A 96 VAL H H 1 7.767 0.050 A 96 VAL HA H 1 4.720 0.050 A 96 VAL HB H 1 0.785 0.050 A 96 VAL HG1% H 1 -0.003 0.050 A 96 VAL HG2% H 1 0.406 0.050 A 96 VAL C C 13 173.860 0.200 A 96 VAL CA C 13 60.987 0.200 A 96 VAL CB C 13 34.549 0.200 A 96 VAL CG1 C 13 22.184 0.200 A 96 VAL CG2 C 13 21.669 0.200 A 96 VAL N N 15 117.590 0.300 A 97 TYR H H 1 9.662 0.050 A 97 TYR HA H 1 5.281 0.050 A 97 TYR HB2 H 1 2.578 0.050 A 97 TYR HB3 H 1 2.578 0.050 A 97 TYR HDx H 1 6.992 0.050 A 97 TYR HDy H 1 6.992 0.050 A 97 TYR HEx H 1 6.741 0.050 A 97 TYR HEy H 1 6.741 0.050 A 97 TYR C C 13 175.728 0.200 A 97 TYR CA C 13 55.871 0.200 A 97 TYR CB C 13 42.032 0.200 A 97 TYR CDx C 13 133.477 0.200 A 97 TYR CDy C 13 133.477 0.200 A 97 TYR CEx C 13 118.249 0.200 A 97 TYR CEy C 13 118.249 0.200 A 97 TYR N N 15 125.232 0.300 A 98 SER H H 1 9.003 0.050 A 98 SER HA H 1 4.947 0.050 A 98 SER HBy H 1 4.288 0.050 A 98 SER HBx H 1 4.015 0.050 A 98 SER C C 13 175.579 0.200 A 98 SER CA C 13 57.236 0.200 A 98 SER CB C 13 65.003 0.200 A 98 SER N N 15 114.093 0.300 A 99 THR H H 1 8.604 0.050 A 99 THR HA H 1 4.444 0.050 A 99 THR HB H 1 4.459 0.050 A 99 THR HG2% H 1 1.126 0.050 A 99 THR C C 13 175.321 0.200 A 99 THR CA C 13 61.774 0.200 A 99 THR CB C 13 69.368 0.200 A 99 THR CG2 C 13 21.860 0.200 A 99 THR N N 15 110.070 0.300 A 100 ASN H H 1 8.388 0.050 A 100 ASN HA H 1 4.692 0.050 A 100 ASN HB2 H 1 2.736 0.050 A 100 ASN HB3 H 1 2.736 0.050 A 100 ASN HD21 H 1 6.889 0.050 A 100 ASN HD22 H 1 7.621 0.050 A 100 ASN C C 13 175.323 0.200 A 100 ASN CA C 13 53.409 0.200 A 100 ASN CB C 13 39.010 0.200 A 100 ASN N N 15 119.390 0.300 A 100 ASN ND2 N 15 112.854 0.300 A 101 GLU H H 1 8.611 0.050 A 101 GLU HA H 1 4.165 0.050 A 101 GLU HBy H 1 2.080 0.050 A 101 GLU HBx H 1 1.955 0.050 A 101 GLU HG2 H 1 2.255 0.050 A 101 GLU HG3 H 1 2.255 0.050 A 101 GLU C C 13 176.009 0.200 A 101 GLU CA C 13 57.761 0.200 A 101 GLU CB C 13 29.871 0.200 A 101 GLU CG C 13 36.125 0.200 A 101 GLU N N 15 120.756 0.300 A 102 ASP H H 1 8.303 0.050 A 102 ASP HA H 1 4.684 0.050 A 102 ASP HBy H 1 2.811 0.050 A 102 ASP HBx H 1 2.615 0.050 A 102 ASP C C 13 176.138 0.200 A 102 ASP CA C 13 54.293 0.200 A 102 ASP CB C 13 41.047 0.200 A 102 ASP N N 15 119.341 0.300 A 103 SER H H 1 8.047 0.050 A 103 SER HA H 1 4.509 0.050 A 103 SER HB2 H 1 3.967 0.050 A 103 SER HB3 H 1 3.967 0.050 A 103 SER C C 13 174.462 0.200 A 103 SER CA C 13 58.156 0.200 A 103 SER CB C 13 64.375 0.200 A 103 SER N N 15 115.614 0.300 A 104 ASP H H 1 8.517 0.050 A 104 ASP HA H 1 4.744 0.050 A 104 ASP HBx H 1 2.759 0.050 A 104 ASP HBy H 1 2.759 0.050 A 104 ASP C C 13 175.837 0.200 A 104 ASP CA C 13 54.179 0.200 A 104 ASP CB C 13 41.400 0.200 A 104 ASP N N 15 123.021 0.300 A 105 ALA H H 1 8.049 0.050 A 105 ALA HA H 1 4.368 0.050 A 105 ALA HB% H 1 1.477 0.050 A 105 ALA C C 13 177.772 0.200 A 105 ALA CA C 13 52.748 0.200 A 105 ALA CB C 13 19.433 0.200 A 105 ALA N N 15 124.036 0.300 A 106 LYS H H 1 8.590 0.050 A 106 LYS HA H 1 4.522 0.050 A 106 LYS HBy H 1 1.935 0.050 A 106 LYS HBx H 1 1.800 0.050 A 106 LYS HD2 H 1 1.777 0.050 A 106 LYS HD3 H 1 1.777 0.050 A 106 LYS HE2 H 1 3.065 0.050 A 106 LYS HE3 H 1 3.065 0.050 A 106 LYS HG2 H 1 1.435 0.050 A 106 LYS HG3 H 1 1.435 0.050 A 106 LYS C C 13 176.396 0.200 A 106 LYS CA C 13 55.744 0.200 A 106 LYS CB C 13 32.828 0.200 A 106 LYS CD C 13 29.323 0.200 A 106 LYS CE C 13 42.156 0.200 A 106 LYS CG C 13 24.591 0.200 A 106 LYS N N 15 118.842 0.300 A 107 ASP H H 1 8.499 0.050 A 107 ASP HA H 1 4.581 0.050 A 107 ASP HB2 H 1 2.797 0.050 A 107 ASP HB3 H 1 2.797 0.050 A 107 ASP C C 13 175.366 0.200 A 107 ASP CA C 13 55.925 0.200 A 107 ASP CB C 13 40.700 0.200 A 107 ASP N N 15 120.043 0.300 A 108 GLU H H 1 7.724 0.050 A 108 GLU HA H 1 5.436 0.050 A 108 GLU HBx H 1 2.054 0.050 A 108 GLU HBy H 1 2.054 0.050 A 108 GLU HG2 H 1 2.244 0.050 A 108 GLU HG3 H 1 2.243 0.050 A 108 GLU C C 13 174.849 0.200 A 108 GLU CA C 13 55.048 0.200 A 108 GLU CB C 13 33.229 0.200 A 108 GLU CG C 13 36.828 0.200 A 108 GLU N N 15 117.614 0.300 A 109 ILE H H 1 8.743 0.050 A 109 ILE HA H 1 4.804 0.050 A 109 ILE HB H 1 1.682 0.050 A 109 ILE HD1% H 1 -0.542 0.050 A 109 ILE HG1y H 1 0.785 0.050 A 109 ILE HG1x H 1 0.521 0.050 A 109 ILE HG2% H 1 0.591 0.050 A 109 ILE C C 13 173.473 0.200 A 109 ILE CA C 13 59.917 0.200 A 109 ILE CB C 13 42.353 0.200 A 109 ILE CD1 C 13 11.009 0.200 A 109 ILE CG1 C 13 25.458 0.200 A 109 ILE CG2 C 13 17.454 0.200 A 109 ILE N N 15 115.997 0.300 A 110 ILE H H 1 9.059 0.050 A 110 ILE HA H 1 5.276 0.050 A 110 ILE HB H 1 1.717 0.050 A 110 ILE HD1% H 1 0.745 0.050 A 110 ILE HG1y H 1 1.397 0.050 A 110 ILE HG1x H 1 1.111 0.050 A 110 ILE HG2% H 1 0.829 0.050 A 110 ILE C C 13 175.150 0.200 A 110 ILE CA C 13 58.601 0.200 A 110 ILE CB C 13 39.320 0.200 A 110 ILE CD1 C 13 12.732 0.200 A 110 ILE CG1 C 13 27.080 0.200 A 110 ILE CG2 C 13 17.370 0.200 A 110 ILE N N 15 119.890 0.300 A 111 VAL H H 1 9.486 0.050 A 111 VAL HA H 1 4.678 0.050 A 111 VAL HB H 1 1.815 0.050 A 111 VAL HG1% H 1 0.703 0.050 A 111 VAL HG2% H 1 0.875 0.050 A 111 VAL C C 13 174.633 0.200 A 111 VAL CA C 13 60.707 0.200 A 111 VAL CB C 13 35.938 0.200 A 111 VAL CG1 C 13 21.884 0.200 A 111 VAL CG2 C 13 20.977 0.200 A 111 VAL N N 15 125.973 0.300 A 112 GLU H H 1 8.354 0.050 A 112 GLU HA H 1 4.796 0.050 A 112 GLU HBy H 1 2.563 0.050 A 112 GLU HBx H 1 1.998 0.050 A 112 GLU HGy H 1 2.099 0.050 A 112 GLU HGx H 1 1.832 0.050 A 112 GLU C C 13 174.633 0.200 A 112 GLU CA C 13 55.088 0.200 A 112 GLU CB C 13 31.503 0.200 A 112 GLU CG C 13 35.412 0.200 A 112 GLU N N 15 127.784 0.300 A 113 PHE H H 1 9.404 0.050 A 113 PHE HA H 1 5.430 0.050 A 113 PHE HBy H 1 2.838 0.050 A 113 PHE HBx H 1 2.679 0.050 A 113 PHE HDx H 1 6.304 0.050 A 113 PHE HDy H 1 6.304 0.050 A 113 PHE HEx H 1 6.744 0.050 A 113 PHE HEy H 1 6.744 0.050 A 113 PHE HZ H 1 7.023 0.050 A 113 PHE C C 13 174.979 0.200 A 113 PHE CA C 13 54.831 0.200 A 113 PHE CB C 13 40.344 0.200 A 113 PHE CDx C 13 130.750 0.200 A 113 PHE CDy C 13 130.750 0.200 A 113 PHE CEx C 13 130.743 0.200 A 113 PHE CEy C 13 130.743 0.200 A 113 PHE CZ C 13 128.992 0.200 A 113 PHE N N 15 129.690 0.300 A 114 ASN H H 1 9.410 0.050 A 114 ASN HA H 1 4.097 0.050 A 114 ASN HBy H 1 2.749 0.050 A 114 ASN HBx H 1 1.944 0.050 A 114 ASN HD21 H 1 6.640 0.050 A 114 ASN HD22 H 1 7.183 0.050 A 114 ASN C C 13 173.905 0.200 A 114 ASN CA C 13 53.879 0.200 A 114 ASN CB C 13 36.094 0.200 A 114 ASN N N 15 129.780 0.300 A 114 ASN ND2 N 15 111.468 0.300 A 115 ARG H H 1 8.897 0.050 A 115 ARG HA H 1 3.645 0.050 A 115 ARG HB2 H 1 2.038 0.050 A 115 ARG HB3 H 1 2.038 0.050 A 115 ARG HD2 H 1 3.130 0.050 A 115 ARG HD3 H 1 3.130 0.050 A 115 ARG HG2 H 1 1.468 0.050 A 115 ARG HG3 H 1 1.468 0.050 A 115 ARG C C 13 174.332 0.200 A 115 ARG CA C 13 57.670 0.200 A 115 ARG CB C 13 27.495 0.200 A 115 ARG CD C 13 43.170 0.200 A 115 ARG CG C 13 28.100 0.200 A 115 ARG N N 15 107.935 0.300 A 116 GLU H H 1 7.633 0.050 A 116 GLU HA H 1 4.356 0.050 A 116 GLU HB2 H 1 1.942 0.050 A 116 GLU HB3 H 1 1.942 0.050 A 116 GLU HGy H 1 2.260 0.050 A 116 GLU HGx H 1 2.099 0.050 A 116 GLU C C 13 172.615 0.200 A 116 GLU CA C 13 54.402 0.200 A 116 GLU CB C 13 33.340 0.200 A 116 GLU CG C 13 37.933 0.200 A 116 GLU N N 15 119.376 0.300 A 117 TYR H H 1 8.735 0.050 A 117 TYR HA H 1 5.131 0.050 A 117 TYR HBy H 1 2.713 0.050 A 117 TYR HBx H 1 2.295 0.050 A 117 TYR HDx H 1 6.804 0.050 A 117 TYR HDy H 1 6.804 0.050 A 117 TYR C C 13 174.591 0.200 A 117 TYR CA C 13 57.769 0.200 A 117 TYR CB C 13 39.741 0.200 A 117 TYR CDx C 13 132.109 0.200 A 117 TYR CDy C 13 132.109 0.200 A 117 TYR N N 15 118.855 0.300 A 118 TYR H H 1 9.042 0.050 A 118 TYR HA H 1 5.164 0.050 A 118 TYR HB2 H 1 2.649 0.050 A 118 TYR HB3 H 1 2.649 0.050 A 118 TYR HDx H 1 7.155 0.050 A 118 TYR HDy H 1 7.155 0.050 A 118 TYR HEx H 1 7.007 0.050 A 118 TYR HEy H 1 7.007 0.050 A 118 TYR C C 13 176.010 0.200 A 118 TYR CA C 13 56.455 0.200 A 118 TYR CB C 13 42.250 0.200 A 118 TYR CDx C 13 133.282 0.200 A 118 TYR CDy C 13 133.282 0.200 A 118 TYR CEx C 13 118.234 0.200 A 118 TYR CEy C 13 118.234 0.200 A 118 TYR N N 15 119.610 0.300 A 119 ARG H H 1 8.870 0.050 A 119 ARG HA H 1 4.691 0.050 A 119 ARG HBy H 1 1.810 0.050 A 119 ARG HBx H 1 1.584 0.050 A 119 ARG HDx H 1 3.202 0.050 A 119 ARG HDy H 1 3.267 0.050 A 119 ARG HE H 1 8.197 0.050 A 119 ARG HG2 H 1 1.360 0.050 A 119 ARG HG3 H 1 1.360 0.050 A 119 ARG C C 13 173.991 0.200 A 119 ARG CA C 13 56.455 0.200 A 119 ARG CB C 13 31.379 0.200 A 119 ARG CD C 13 43.080 0.200 A 119 ARG CG C 13 28.062 0.200 A 119 ARG N N 15 123.962 0.300 A 119 ARG NE N 15 111.899 0.300 A 120 ALA H H 1 9.540 0.050 A 120 ALA HA H 1 5.549 0.050 A 120 ALA HB% H 1 1.046 0.050 A 120 ALA C C 13 175.471 0.200 A 120 ALA CA C 13 50.233 0.200 A 120 ALA CB C 13 22.313 0.200 A 120 ALA N N 15 130.481 0.300 A 121 VAL H H 1 8.534 0.050 A 121 VAL HA H 1 5.180 0.050 A 121 VAL HB H 1 2.208 0.050 A 121 VAL HG1% H 1 1.028 0.050 A 121 VAL HG2% H 1 1.075 0.050 A 121 VAL C C 13 175.536 0.200 A 121 VAL CA C 13 59.501 0.200 A 121 VAL CB C 13 35.149 0.200 A 121 VAL CG1 C 13 20.493 0.200 A 121 VAL CG2 C 13 21.585 0.200 A 121 VAL N N 15 115.939 0.300 A 122 LEU H H 1 8.373 0.050 A 122 LEU HA H 1 3.641 0.050 A 122 LEU HB2 H 1 1.497 0.050 A 122 LEU HB3 H 1 1.497 0.050 A 122 LEU HD1% H 1 0.529 0.050 A 122 LEU HD2% H 1 0.626 0.050 A 122 LEU HG H 1 1.327 0.050 A 122 LEU C C 13 177.471 0.200 A 122 LEU CA C 13 55.921 0.200 A 122 LEU CB C 13 43.309 0.200 A 122 LEU CD1 C 13 25.289 0.200 A 122 LEU CD2 C 13 24.734 0.200 A 122 LEU CG C 13 26.745 0.200 A 122 LEU N N 15 128.194 0.300 A 123 ILE H H 1 8.396 0.050 A 123 ILE HA H 1 3.981 0.050 A 123 ILE HB H 1 1.575 0.050 A 123 ILE HD1% H 1 0.569 0.050 A 123 ILE HG1y H 1 1.387 0.050 A 123 ILE HG1x H 1 0.963 0.050 A 123 ILE HG2% H 1 0.776 0.050 A 123 ILE C C 13 176.313 0.200 A 123 ILE CA C 13 62.365 0.200 A 123 ILE CB C 13 37.776 0.200 A 123 ILE CD1 C 13 12.860 0.200 A 123 ILE CG1 C 13 28.227 0.200 A 123 ILE CG2 C 13 17.099 0.200 A 123 ILE N N 15 127.116 0.300 A 124 LYS H H 1 8.417 0.050 A 124 LYS HA H 1 4.298 0.050 A 124 LYS HBy H 1 1.868 0.050 A 124 LYS HBx H 1 1.748 0.050 A 124 LYS HD2 H 1 1.673 0.050 A 124 LYS HD3 H 1 1.673 0.050 A 124 LYS HE2 H 1 2.978 0.050 A 124 LYS HE3 H 1 2.978 0.050 A 124 LYS HG2 H 1 1.312 0.050 A 124 LYS HG3 H 1 1.312 0.050 A 124 LYS C C 13 176.051 0.200 A 124 LYS CA C 13 56.305 0.200 A 124 LYS CB C 13 33.159 0.200 A 124 LYS CD C 13 29.116 0.200 A 124 LYS CE C 13 42.156 0.200 A 124 LYS CG C 13 24.930 0.200 A 124 LYS N N 15 124.380 0.300 A 125 ASN H H 1 8.200 0.050 A 125 ASN HA H 1 4.728 0.050 A 125 ASN HBy H 1 2.890 0.050 A 125 ASN HBx H 1 2.736 0.050 A 125 ASN HD21 H 1 6.974 0.050 A 125 ASN HD22 H 1 7.703 0.050 A 125 ASN C C 13 175.235 0.200 A 125 ASN CA C 13 53.018 0.200 A 125 ASN CB C 13 38.938 0.200 A 125 ASN N N 15 119.520 0.300 A 125 ASN ND2 N 15 112.866 0.300 A 126 GLU H H 1 8.262 0.050 A 126 GLU HA H 1 4.289 0.050 A 126 GLU HBy H 1 2.067 0.050 A 126 GLU HBx H 1 1.983 0.050 A 126 GLU HGy H 1 2.290 0.050 A 126 GLU HGx H 1 2.191 0.050 A 126 GLU C C 13 176.117 0.200 A 126 GLU CA C 13 56.677 0.200 A 126 GLU CB C 13 30.389 0.200 A 126 GLU CG C 13 36.267 0.200 A 126 GLU N N 15 122.020 0.300 A 127 LYS H H 1 8.322 0.050 A 127 LYS HA H 1 4.337 0.050 A 127 LYS HBy H 1 1.858 0.050 A 127 LYS HBx H 1 1.751 0.050 A 127 LYS HD2 H 1 1.655 0.050 A 127 LYS HD3 H 1 1.655 0.050 A 127 LYS HE2 H 1 2.977 0.050 A 127 LYS HE3 H 1 2.977 0.050 A 127 LYS HG2 H 1 1.435 0.050 A 127 LYS HG3 H 1 1.435 0.050 A 127 LYS C C 13 175.623 0.200 A 127 LYS CA C 13 56.130 0.200 A 127 LYS CB C 13 33.161 0.200 A 127 LYS CD C 13 29.268 0.200 A 127 LYS CE C 13 42.183 0.200 A 127 LYS CG C 13 24.535 0.200 A 127 LYS N N 15 122.694 0.300 A 128 GLU H H 1 8.019 0.050 A 128 GLU HA H 1 4.095 0.050 A 128 GLU HB2 H 1 1.877 0.050 A 128 GLU HB3 H 1 1.877 0.050 A 128 GLU HG2 H 1 2.193 0.050 A 128 GLU HG3 H 1 2.193 0.050 A 128 GLU C C 13 181.167 0.200 A 128 GLU CA C 13 58.163 0.200 A 128 GLU CB C 13 31.138 0.200 A 128 GLU CG C 13 36.519 0.200 A 128 GLU N N 15 127.389 0.300 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 95 LYS HD3 A 51 VAL HG1% 1.0 . 3.56 2 1 A 51 VAL HG1% A 95 LYS HD2 1.0 . 3.56 3 2 A 52 ILE HG2% A 50 LYS HD2 1.0 . 4.57 4 2 A 50 LYS HD3 A 52 ILE HG2% 1.0 . 4.57 5 3 A 43 VAL HG2% A 47 LYS HBx 1.0 . 4.39 6 4 A 43 VAL HG2% A 110 ILE HB 1.0 . 4.63 7 5 A 43 VAL HG2% A 110 ILE HG1x 1.0 . 4.58 8 6 A 30 VAL HG1% A 39 LEU HD2% 1.0 . 3.93 9 7 A 30 VAL HG1% A 39 LEU HD1% 1.0 . 3.93 10 8 A 110 ILE HG2% A 117 TYR HD% 1.0 . 3.94 11 9 A 110 ILE HG2% A 97 TYR HE% 1.0 . 4.43 12 10 A 110 ILE HG2% A 48 LYS HA 1.0 . 4.94 13 11 A 110 ILE HG2% A 117 TYR HBy 1.0 . 3.87 14 12 A 110 ILE HG2% A 97 TYR HB3 1.0 . 5.50 15 13 A 110 ILE HG2% A 112 GLU HBy 1.0 . 5.50 16 14 A 61 VAL HG2% A 89 LYS HDx 1.0 . 3.95 17 15 A 61 VAL HG2% A 89 LYS HGy 1.0 . 4.02 18 16 A 110 ILE HG2% A 119 ARG HG2 1.0 . 4.18 19 17 A 22 ILE HA A 22 ILE HG1y 1.0 . 3.93 20 18 A 22 ILE HA A 27 LEU HD2% 1.0 . 4.24 21 19 A 52 ILE HG2% A 98 SER HBy 1.0 . 3.66 22 20 A 52 ILE HG2% A 98 SER HBx 1.0 . 3.59 23 21 A 22 ILE HA A 27 LEU HD1% 1.0 . 4.24 24 22 A 98 SER HBy A 52 ILE HD1% 1.0 . 4.21 25 23 A 98 SER HBx A 52 ILE HD1% 1.0 . 4.15 26 24 A 22 ILE HA A 22 ILE HG2% 1.0 . 3.37 27 25 A 22 ILE HA A 22 ILE HD1% 1.0 . 4.01 28 26 A 109 ILE HG2% A 110 ILE H 1.0 . 4.09 29 27 A 109 ILE HG2% A 96 VAL HG1% 1.0 . 3.86 30 28 A 32 TYR HD% A 55 ILE HA 1.0 . 4.92 31 29 A 55 ILE HA A 55 ILE HG1x 1.0 . 3.99 32 30 A 55 ILE HA A 55 ILE HG1y 1.0 . 3.73 33 31 A 55 ILE HA A 55 ILE HG2% 1.0 . 3.34 34 32 A 82 PRO HA A 85 ILE HD1% 1.0 . 3.86 35 33 A 55 ILE HA A 96 VAL HG2% 1.0 . 4.56 36 34 A 51 VAL HA A 97 TYR HD% 1.0 . 3.98 37 35 A 97 TYR HE% A 51 VAL HA 1.0 . 5.04 38 36 A 60 PHE HE% A 90 PRO HA 1.0 . 3.88 39 37 A 90 PRO HA A 60 PHE HD% 1.0 . 3.54 40 38 A 90 PRO HA A 60 PHE HA 1.0 . 3.63 41 39 A 90 PRO HA A 60 PHE HBx 1.0 . 4.63 42 40 A 123 ILE HA A 126 GLU HGx 1.0 . 4.65 43 41 A 123 ILE HA A 123 ILE HG1x 1.0 . 3.63 44 42 A 123 ILE HA A 123 ILE HG1y 1.0 . 3.54 45 43 A 123 ILE HA A 123 ILE HG2% 1.0 . 3.11 46 44 A 123 ILE HA A 123 ILE HD1% 1.0 . 3.90 47 45 A 48 LYS HA A 99 THR HA 1.0 . 4.51 48 46 A 110 ILE HG1x A 99 THR HA 1.0 . 5.09 49 47 A 20 SER HA A 23 ASP HBy 1.0 . 3.95 50 48 A 20 SER HA A 23 ASP HBx 1.0 . 3.95 51 49 A 58 THR HA A 93 TYR HD% 1.0 . 4.57 52 50 A 58 THR HA A 92 ARG HB2 1.0 . 5.50 53 50 A 58 THR HA A 92 ARG HB3 1.0 . 5.50 54 51 A 58 THR HA A 92 ARG HG2 1.0 . 4.44 55 51 A 58 THR HA A 92 ARG HG3 1.0 . 4.44 56 52 A 58 THR HA A 58 THR HG2% 1.0 . 3.19 57 53 A 18 MET HE1 A 59 PHE HD% 1.0 . 4.69 58 54 A 19 GLU HA A 59 PHE HE% 1.0 . 4.33 59 55 A 14 THR HA A 14 THR HB 1.0 . 2.81 60 56 A 19 GLU HA A 59 PHE HBy 1.0 . 5.50 61 57 A 18 MET HE1 A 18 MET HBy 1.0 . 3.86 62 58 A 18 MET HE1 A 21 LEU HG 1.0 . 4.58 63 59 A 18 MET HE1 A 18 MET HBx 1.0 . 3.86 64 60 A 19 GLU HA A 22 ILE HB 1.0 . 3.99 65 61 A 55 ILE HG2% A 18 MET HE1 1.0 . 3.94 66 62 A 22 ILE HG2% A 19 GLU HA 1.0 . 4.97 67 63 A 18 MET HE1 A 21 LEU HD1% 1.0 . 3.60 68 64 A 18 MET HE1 A 30 VAL HG1% 1.0 . 4.46 69 65 A 18 MET HE1 A 59 PHE HE% 1.0 . 4.30 70 66 A 52 ILE HA A 53 GLY HAx 1.0 . 4.57 71 67 A 85 ILE HA A 85 ILE HG1y 1.0 . 3.85 72 68 A 52 ILE HG2% A 52 ILE HA 1.0 . 3.10 73 69 A 85 ILE HA A 85 ILE HG2% 1.0 . 3.14 74 70 A 85 ILE HD1% A 85 ILE HA 1.0 . 4.30 75 71 A 97 TYR HD% A 96 VAL HA 1.0 . 4.13 76 72 A 96 VAL HG2% A 96 VAL HA 1.0 . 3.43 77 73 A 96 VAL HG1% A 96 VAL HA 1.0 . 3.58 78 74 A 111 VAL HA A 112 GLU H 1.0 . 3.46 79 75 A 22 ILE HD1% A 59 PHE HD% 1.0 . 3.71 80 76 A 22 ILE HD1% A 59 PHE HE% 1.0 . 4.05 81 77 A 97 TYR HE% A 111 VAL HA 1.0 . 5.49 82 78 A 22 ILE HD1% A 93 TYR HE% 1.0 . 3.79 83 79 A 22 ILE HD1% A 59 PHE HBx 1.0 . 4.16 84 80 A 55 ILE HD1% A 93 TYR HBx 1.0 . 4.22 85 81 A 22 ILE HD1% A 59 PHE HBy 1.0 . 3.93 86 82 A 112 GLU HBy A 111 VAL HA 1.0 . 4.76 87 83 A 22 ILE HD1% A 18 MET HBy 1.0 . 4.72 88 84 A 55 ILE HD1% A 30 VAL HB 1.0 . 3.68 89 85 A 55 ILE HD1% A 55 ILE HB 1.0 . 3.56 90 86 A 22 ILE HD1% A 67 ARG HG2 1.0 . 4.44 91 86 A 22 ILE HD1% A 67 ARG HG3 1.0 . 4.44 92 87 A 22 ILE HD1% A 18 MET HBx 1.0 . 4.72 93 88 A 22 ILE HD1% A 91 LEU HG 1.0 . 4.75 94 89 A 22 ILE HD1% A 22 ILE HB 1.0 . 3.64 95 90 A 22 ILE HD1% A 91 LEU HD1% 1.0 . 4.55 96 91 A 22 ILE HD1% A 61 VAL HG1% 1.0 . 4.37 97 92 A 22 ILE HG2% A 22 ILE HD1% 1.0 . 3.24 98 93 A 52 ILE HD1% A 109 ILE HG2% 1.0 . 3.55 99 94 A 55 ILE HA A 55 ILE HD1% 1.0 . 4.03 100 95 A 22 ILE HD1% A 91 LEU HBx 1.0 . 4.46 101 96 A 78 ILE HA A 78 ILE HG1x 1.0 . 3.96 102 97 A 78 ILE HA A 78 ILE HG2% 1.0 . 3.22 103 98 A 71 GLU HA A 74 LYS HE2 1.0 . 4.48 104 98 A 71 GLU HA A 74 LYS HE3 1.0 . 4.48 105 99 A 70 GLU HA A 73 LEU HBy 1.0 . 4.20 106 100 A 31 VAL HA A 31 VAL HG2% 1.0 . 3.71 107 101 A 123 ILE HD1% A 38 HIS HBx 1.0 . 4.06 108 102 A 123 ILE HD1% A 38 HIS HBy 1.0 . 3.80 109 103 A 123 ILE HD1% A 29 GLN HGy 1.0 . 4.11 110 104 A 123 ILE HD1% A 123 ILE HB 1.0 . 3.41 111 105 A 123 ILE HD1% A 36 LEU HD1% 1.0 . 3.54 112 106 A 110 ILE HD1% A 111 VAL H 1.0 . 5.38 113 107 A 110 ILE HD1% A 110 ILE HA 1.0 . 4.00 114 108 A 99 THR HA A 110 ILE HD1% 1.0 . 3.49 115 109 A 78 ILE HA A 78 ILE HD1% 1.0 . 4.32 116 110 A 110 ILE HD1% A 47 LYS HBy 1.0 . 4.58 117 111 A 108 GLU HG2 A 121 VAL HA 1.0 . 4.63 118 112 A 121 VAL HA A 108 GLU HBy 1.0 . 4.69 119 113 A 17 THR HA A 17 THR HG2% 1.0 . 3.24 120 114 A 17 THR HA A 31 VAL HG2% 1.0 . 3.67 121 115 A 30 VAL HA A 30 VAL HG1% 1.0 . 4.05 122 116 A 117 TYR HD% A 45 GLU HA 1.0 . 3.81 123 117 A 45 GLU HA A 48 LYS HE2 1.0 . 4.51 124 117 A 45 GLU HA A 48 LYS HE3 1.0 . 4.51 125 118 A 55 ILE HD1% A 30 VAL HA 1.0 . 4.73 126 119 A 30 VAL HA A 30 VAL HG2% 1.0 . 4.05 127 120 A 45 GLU HA A 48 LYS HDy 1.0 . 4.94 128 121 A 43 VAL HA A 43 VAL HG1% 1.0 . 3.03 129 122 A 43 VAL HG2% A 43 VAL HA 1.0 . 3.60 130 123 A 110 ILE HA A 120 ALA H 1.0 . 4.59 131 124 A 110 ILE HA A 111 VAL HB 1.0 . 5.35 132 125 A 110 ILE HA A 119 ARG HBy 1.0 . 5.50 133 126 A 110 ILE HA A 119 ARG HG2 1.0 . 4.86 134 127 A 110 ILE HA A 120 ALA HB% 1.0 . 4.14 135 128 A 110 ILE HA A 43 VAL HG1% 1.0 . 5.29 136 129 A 110 ILE HG2% A 110 ILE HA 1.0 . 3.48 137 130 A 21 LEU HA A 24 LYS HBy 1.0 . 5.50 138 131 A 29 GLN HGy A 21 LEU HA 1.0 . 5.50 139 132 A 21 LEU HA A 24 LYS HBx 1.0 . 4.30 140 133 A 21 LEU HA A 24 LYS HG2 1.0 . 4.02 141 134 A 21 LEU HA A 26 LYS HB2 1.0 . 3.96 142 134 A 21 LEU HA A 26 LYS HB3 1.0 . 3.96 143 135 A 21 LEU HA A 24 LYS HG3 1.0 . 4.22 144 136 A 21 LEU HA A 26 LYS HG2 1.0 . 4.36 145 136 A 21 LEU HA A 26 LYS HG3 1.0 . 4.36 146 137 A 21 LEU HA A 21 LEU HD2% 1.0 . 3.06 147 138 A 21 LEU HD1% A 21 LEU HA 1.0 . 3.95 148 139 A 32 TYR HD% A 109 ILE HD1% 1.0 . 3.84 149 140 A 109 ILE HD1% A 32 TYR HE% 1.0 . 5.12 150 141 A 15 SER HA A 15 SER HB2 1.0 . 2.79 151 141 A 15 SER HA A 15 SER HB3 1.0 . 2.79 152 142 A 68 TRP HA A 72 GLU HB3 1.0 . 5.50 153 143 A 68 TRP HA A 73 LEU HG 1.0 . 5.50 154 144 A 55 ILE HB A 93 TYR HA 1.0 . 4.79 155 145 A 55 ILE HG2% A 93 TYR HA 1.0 . 4.35 156 146 A 109 ILE HG2% A 109 ILE HD1% 1.0 . 3.26 157 147 A 96 VAL HG2% A 109 ILE HD1% 1.0 . 3.96 158 148 A 96 VAL HG1% A 109 ILE HD1% 1.0 . 3.57 159 149 A 77 TYR HA A 77 TYR HD% 1.0 . 3.16 160 150 A 93 TYR HD% A 93 TYR HA 1.0 . 3.70 161 151 A 77 TYR HA A 77 TYR HE% 1.0 . 4.85 162 152 A 93 TYR HA A 113 PHE HD% 1.0 . 3.95 163 153 A 93 TYR HA A 113 PHE HA 1.0 . 3.57 164 154 A 55 ILE HD1% A 93 TYR HA 1.0 . 4.67 165 155 A 117 TYR HA A 118 TYR HD% 1.0 . 4.15 166 156 A 117 TYR HD% A 117 TYR HA 1.0 . 3.70 167 157 A 97 TYR HE% A 117 TYR HA 1.0 . 4.43 168 158 A 112 GLU HGy A 115 ARG HA 1.0 . 4.20 169 159 A 115 ARG HA A 115 ARG HG2 1.0 . 3.24 170 159 A 115 ARG HA A 115 ARG HG3 1.0 . 3.24 171 160 A 78 ILE HG2% A 79 SER HA 1.0 . 5.50 172 161 A 78 ILE HD1% A 79 SER HA 1.0 . 5.50 173 162 A 110 ILE HG2% A 117 TYR HA 1.0 . 4.02 174 163 A 32 TYR HD% A 32 TYR HA 1.0 . 3.41 175 164 A 32 TYR HE% A 32 TYR HA 1.0 . 4.73 176 165 A 55 ILE HD1% A 32 TYR HA 1.0 . 5.36 177 166 A 32 TYR HA A 31 VAL HG2% 1.0 . 5.50 178 167 A 95 LYS HA A 51 VAL HG1% 1.0 . 5.50 179 168 A 55 ILE HD1% A 95 LYS HA 1.0 . 5.50 180 169 A 22 ILE HG2% A 23 ASP HA 1.0 . 4.54 181 170 A 95 LYS HA A 54 ALA HA 1.0 . 3.24 182 171 A 95 LYS HA A 95 LYS HGy 1.0 . 3.79 183 172 A 74 LYS HA A 74 LYS HD2 1.0 . 4.53 184 172 A 74 LYS HA A 74 LYS HD3 1.0 . 4.53 185 173 A 95 LYS HA A 54 ALA HB% 1.0 . 3.37 186 174 A 52 ILE HG2% A 98 SER HA 1.0 . 4.20 187 175 A 52 ILE HD1% A 98 SER HA 1.0 . 3.99 188 176 A 109 ILE HG2% A 98 SER HA 1.0 . 4.16 189 177 A 96 VAL HG2% A 95 LYS HA 1.0 . 4.23 190 178 A 37 TYR HA A 122 LEU HA 1.0 . 3.53 191 179 A 123 ILE HG1x A 37 TYR HA 1.0 . 4.41 192 180 A 123 ILE HD1% A 37 TYR HA 1.0 . 4.01 193 181 A 111 VAL H A 119 ARG HA 1.0 . 4.45 194 182 A 24 LYS HA A 24 LYS HE2 1.0 . 4.56 195 182 A 24 LYS HA A 24 LYS HE3 1.0 . 4.56 196 183 A 42 LYS HBx A 118 TYR HA 1.0 . 5.32 197 184 A 24 LYS HG3 A 24 LYS HA 1.0 . 3.70 198 185 A 119 ARG HA A 119 ARG HG2 1.0 . 4.00 199 186 A 120 ALA HB% A 119 ARG HA 1.0 . 4.12 200 187 A 43 VAL HG1% A 119 ARG HA 1.0 . 4.51 201 188 A 37 TYR HA A 36 LEU HD2% 1.0 . 5.50 202 189 A 123 ILE HG2% A 37 TYR HA 1.0 . 5.50 203 190 A 110 ILE HG2% A 119 ARG HA 1.0 . 3.88 204 191 A 73 LEU HA A 73 LEU HD1% 1.0 . 3.98 205 192 A 73 LEU HA A 68 TRP HZ3 1.0 . 4.37 206 193 A 60 PHE HE% A 60 PHE HA 1.0 . 4.83 207 194 A 118 TYR HA A 118 TYR HE% 1.0 . 4.89 208 195 A 67 ARG HA A 68 TRP HD1 1.0 . 4.13 209 196 A 60 PHE HD% A 60 PHE HA 1.0 . 3.58 210 197 A 110 ILE HA A 119 ARG HA 1.0 . 4.04 211 198 A 118 TYR HA A 42 LYS HA 1.0 . 3.35 212 199 A 67 ARG HA A 67 ARG HDx 1.0 . 4.63 213 200 A 42 LYS HA A 118 TYR HB2 1.0 . 4.09 214 200 A 42 LYS HA A 118 TYR HB3 1.0 . 4.09 215 201 A 119 ARG HA A 119 ARG HG3 1.0 . 4.01 216 202 A 18 MET HE1 A 18 MET HA 1.0 . 3.37 217 203 A 61 VAL HG2% A 67 ARG HA 1.0 . 4.79 218 204 A 73 LEU HA A 73 LEU HD2% 1.0 . 3.98 219 205 A 61 VAL HG1% A 67 ARG HA 1.0 . 3.22 220 206 A 42 LYS HA A 42 LYS HGy 1.0 . 3.84 221 207 A 110 ILE HG2% A 118 TYR HA 1.0 . 4.72 222 208 A 21 LEU HD2% A 18 MET HA 1.0 . 4.17 223 209 A 22 ILE HG2% A 67 ARG HA 1.0 . 4.29 224 210 A 21 LEU HD1% A 18 MET HA 1.0 . 3.63 225 211 A 43 VAL HG2% A 42 LYS HA 1.0 . 4.50 226 212 A 39 LEU HA A 39 LEU HD1% 1.0 . 3.95 227 213 A 39 LEU HA A 121 VAL H 1.0 . 4.50 228 214 A 123 ILE HA A 124 LYS HA 1.0 . 4.93 229 215 A 120 ALA HB% A 39 LEU HA 1.0 . 3.48 230 216 A 123 ILE HG2% A 124 LYS HA 1.0 . 3.99 231 217 A 39 LEU HA A 39 LEU HD2% 1.0 . 3.95 232 218 A 97 TYR HE% A 97 TYR HA 1.0 . 4.95 233 219 A 51 VAL HA A 97 TYR HA 1.0 . 3.37 234 220 A 107 ASP HA A 107 ASP HB2 1.0 . 3.00 235 220 A 107 ASP HA A 107 ASP HB3 1.0 . 3.00 236 221 A 107 ASP HA A 122 LEU HG 1.0 . 5.15 237 222 A 122 LEU HA A 122 LEU HG 1.0 . 4.15 238 223 A 52 ILE HG2% A 97 TYR HA 1.0 . 4.24 239 224 A 97 TYR HA A 52 ILE HG12 1.0 . 4.80 240 225 A 97 TYR HA A 51 VAL HG2% 1.0 . 4.25 241 226 A 97 TYR HA A 51 VAL HG1% 1.0 . 4.25 242 227 A 52 ILE HD1% A 97 TYR HA 1.0 . 4.18 243 228 A 122 LEU HA A 122 LEU HD2% 1.0 . 3.89 244 229 A 97 TYR HA A 52 ILE HG13 1.0 . 4.80 245 230 A 107 ASP HA A 122 LEU HD1% 1.0 . 4.52 246 231 A 41 GLU HA A 41 GLU HGy 1.0 . 3.96 247 232 A 106 LYS HA A 106 LYS HD2 1.0 . 3.74 248 232 A 106 LYS HA A 106 LYS HD3 1.0 . 3.74 249 233 A 27 LEU HA A 27 LEU HG 1.0 . 3.70 250 234 A 106 LYS HA A 106 LYS HG2 1.0 . 3.60 251 235 A 106 LYS HA A 106 LYS HG3 1.0 . 3.60 252 236 A 110 ILE HG1x A 48 LYS HA 1.0 . 4.74 253 237 A 17 THR HG2% A 16 GLU HA 1.0 . 4.33 254 238 A 27 LEU HA A 27 LEU HD2% 1.0 . 3.59 255 239 A 27 LEU HA A 27 LEU HD1% 1.0 . 3.59 256 240 A 16 GLU HA A 31 VAL HG2% 1.0 . 5.50 257 241 A 52 ILE HD1% A 106 LYS HA 1.0 . 5.50 258 242 A 109 ILE HG2% A 106 LYS HA 1.0 . 4.18 259 243 A 88 LYS HA A 88 LYS HGx 1.0 . 4.21 260 244 A 88 LYS HA A 88 LYS HGy 1.0 . 4.18 261 245 A 59 PHE HD% A 59 PHE HA 1.0 . 3.60 262 246 A 66 LYS HA A 66 LYS HB2 1.0 . 2.94 263 246 A 66 LYS HA A 66 LYS HB3 1.0 . 2.94 264 247 A 66 LYS HA A 66 LYS HG3 1.0 . 3.71 265 248 A 21 LEU HD2% A 16 GLU HA 1.0 . 5.50 266 249 A 59 PHE HE% A 59 PHE HA 1.0 . 4.71 267 250 A 60 PHE HD% A 59 PHE HA 1.0 . 4.44 268 251 A 50 LYS HA A 50 LYS HB2 1.0 . 2.96 269 251 A 50 LYS HA A 50 LYS HB3 1.0 . 2.96 270 252 A 50 LYS HA A 50 LYS HD2 1.0 . 4.62 271 252 A 50 LYS HD3 A 50 LYS HA 1.0 . 4.62 272 253 A 50 LYS HA A 50 LYS HGy 1.0 . 3.99 273 254 A 50 LYS HA A 51 VAL HG1% 1.0 . 5.50 274 255 A 108 GLU HA A 109 ILE H 1.0 . 3.45 275 256 A 118 TYR HE% A 112 GLU HA 1.0 . 4.71 276 257 A 57 GLN HA A 58 THR HB 1.0 . 5.50 277 258 A 58 THR HB A 92 ARG HA 1.0 . 5.50 278 259 A 120 ALA HB% A 108 GLU HA 1.0 . 5.45 279 260 A 55 ILE HG2% A 57 GLN HA 1.0 . 4.45 280 261 A 58 THR HG2% A 92 ARG HA 1.0 . 3.56 281 262 A 93 TYR HD% A 92 ARG HA 1.0 . 4.70 282 263 A 117 TYR HD% A 112 GLU HA 1.0 . 4.09 283 264 A 97 TYR HE% A 112 GLU HA 1.0 . 4.13 284 265 A 121 VAL HA A 108 GLU HA 1.0 . 3.57 285 266 A 58 THR HA A 92 ARG HA 1.0 . 3.20 286 267 A 57 GLN HA A 57 GLN HGy 1.0 . 3.57 287 268 A 57 GLN HA A 57 GLN HGx 1.0 . 3.64 288 269 A 112 GLU HA A 112 GLU HGx 1.0 . 3.95 289 270 A 112 GLU HGy A 112 GLU HA 1.0 . 3.86 290 271 A 92 ARG HA A 92 ARG HG2 1.0 . 3.79 291 271 A 92 ARG HG3 A 92 ARG HA 1.0 . 3.79 292 272 A 108 GLU HA A 99 THR HG2% 1.0 . 4.64 293 273 A 113 PHE HA A 113 PHE HE% 1.0 . 4.45 294 274 A 40 LYS HA A 40 LYS HD2 1.0 . 2.98 295 274 A 40 LYS HA A 40 LYS HD3 1.0 . 2.98 296 275 A 40 LYS HA A 40 LYS HG2 1.0 . 3.29 297 275 A 40 LYS HA A 40 LYS HG3 1.0 . 3.29 298 276 A 93 TYR HD% A 113 PHE HA 1.0 . 5.29 299 277 A 113 PHE HA A 118 TYR HE% 1.0 . 5.50 300 278 A 113 PHE HD% A 113 PHE HA 1.0 . 3.43 301 279 A 33 ASP HA A 34 ASP HBx 1.0 . 5.07 302 280 A 44 ASP HBx A 47 LYS HA 1.0 . 5.50 303 281 A 47 LYS HA A 47 LYS HGx 1.0 . 3.69 304 282 A 116 GLU HA A 116 GLU HGy 1.0 . 3.78 305 283 A 36 LEU HA A 37 TYR H 1.0 . 3.47 306 284 A 117 TYR HD% A 116 GLU HA 1.0 . 4.47 307 285 A 31 VAL HA A 36 LEU HA 1.0 . 3.88 308 286 A 14 THR HB A 13 ASP HA 1.0 . 5.50 309 287 A 14 THR HB A 35 GLN HA 1.0 . 5.50 310 288 A 101 GLU HA A 102 ASP HA 1.0 . 5.50 311 289 A 35 GLN HA A 35 GLN HGx 1.0 . 3.75 312 290 A 29 GLN HA A 29 GLN HGx 1.0 . 3.82 313 291 A 35 GLN HA A 35 GLN HGy 1.0 . 3.54 314 292 A 29 GLN HA A 39 LEU HG 1.0 . 4.67 315 293 A 35 GLN HA A 14 THR HG2% 1.0 . 3.83 316 294 A 36 LEU HD1% A 36 LEU HA 1.0 . 3.46 317 295 A 36 LEU HD2% A 36 LEU HA 1.0 . 3.85 318 296 A 29 GLN HA A 30 VAL HG2% 1.0 . 5.13 319 297 A 36 LEU HA A 31 VAL HG1% 1.0 . 4.88 320 298 A 21 LEU HD1% A 29 GLN HA 1.0 . 4.82 321 299 A 123 ILE HD1% A 29 GLN HA 1.0 . 4.65 322 300 A 123 ILE HD1% A 36 LEU HA 1.0 . 4.63 323 301 A 29 GLN HA A 39 LEU HD1% 1.0 . 5.25 324 302 A 91 LEU HA A 113 PHE HZ 1.0 . 4.18 325 303 A 113 PHE HE% A 91 LEU HA 1.0 . 3.37 326 304 A 113 PHE HD% A 91 LEU HA 1.0 . 4.78 327 305 A 91 LEU HG A 91 LEU HA 1.0 . 3.94 328 306 A 114 ASN HA A 92 ARG HB2 1.0 . 3.67 329 306 A 92 ARG HB3 A 114 ASN HA 1.0 . 3.67 330 307 A 89 LYS HA A 89 LYS HDx 1.0 . 4.91 331 308 A 24 LYS HG3 A 26 LYS HA 1.0 . 4.28 332 309 A 44 ASP HA A 42 LYS HD2 1.0 . 4.54 333 309 A 42 LYS HD3 A 44 ASP HA 1.0 . 4.54 334 310 A 114 ASN HA A 115 ARG HG2 1.0 . 4.02 335 310 A 115 ARG HG3 A 114 ASN HA 1.0 . 4.02 336 311 A 89 LYS HA A 90 PRO HDy 1.0 . 3.30 337 312 A 89 LYS HA A 90 PRO HDx 1.0 . 3.24 338 313 A 89 LYS HA A 90 PRO HG2 1.0 . 4.38 339 314 A 89 LYS HA A 90 PRO HG3 1.0 . 4.49 340 315 A 89 LYS HGy A 89 LYS HA 1.0 . 4.25 341 316 A 89 LYS HA A 89 LYS HGx 1.0 . 4.07 342 317 A 29 GLN HA A 38 HIS HA 1.0 . 3.54 343 318 A 49 GLY HAx A 100 ASN HA 1.0 . 4.25 344 319 A 29 GLN HGx A 38 HIS HA 1.0 . 5.06 345 320 A 123 ILE HD1% A 38 HIS HA 1.0 . 4.33 346 321 A 54 ALA HA A 95 LYS HBy 1.0 . 4.67 347 322 A 54 ALA HA A 95 LYS HGy 1.0 . 4.26 348 323 A 54 ALA HA A 95 LYS HD2 1.0 . 4.93 349 323 A 95 LYS HD3 A 54 ALA HA 1.0 . 4.93 350 324 A 54 ALA HA A 95 LYS HBx 1.0 . 4.56 351 325 A 54 ALA HA A 95 LYS HGx 1.0 . 4.28 352 326 A 54 ALA HA A 96 VAL HB 1.0 . 4.38 353 327 A 27 LEU HA A 28 ASP HA 1.0 . 4.70 354 328 A 39 LEU HG A 28 ASP HA 1.0 . 4.47 355 329 A 28 ASP HA A 39 LEU HBx 1.0 . 4.68 356 330 A 61 VAL HB A 62 ASP HA 1.0 . 4.75 357 331 A 82 PRO HD3 A 81 ASN HBy 1.0 . 4.34 358 331 A 81 ASN HBy A 82 PRO HD2 1.0 . 4.34 359 332 A 81 ASN HA A 82 PRO HD2 1.0 . 2.78 360 332 A 82 PRO HD3 A 81 ASN HA 1.0 . 2.78 361 333 A 81 ASN HA A 82 PRO HG2 1.0 . 4.15 362 333 A 81 ASN HA A 82 PRO HG3 1.0 . 4.15 363 334 A 120 ALA HA A 40 LYS HD2 1.0 . 4.83 364 334 A 40 LYS HD3 A 120 ALA HA 1.0 . 4.83 365 335 A 120 ALA HA A 39 LEU HBy 1.0 . 5.50 366 336 A 121 VAL H A 120 ALA HA 1.0 . 3.47 367 337 A 39 LEU HA A 120 ALA HA 1.0 . 3.65 368 338 A 120 ALA HA A 39 LEU HD2% 1.0 . 5.50 369 339 A 54 ALA HB% A 56 GLY HAy 1.0 . 4.98 370 340 A 32 TYR HE% A 53 GLY HAy 1.0 . 3.91 371 341 A 24 LYS HDy A 25 GLY HAy 1.0 . 4.70 372 342 A 25 GLY HAx A 26 LYS HB2 1.0 . 5.44 373 342 A 26 LYS HB3 A 25 GLY HAx 1.0 . 5.44 374 343 A 27 LEU HG A 25 GLY HAx 1.0 . 5.50 375 344 A 54 ALA HB% A 53 GLY HAy 1.0 . 4.68 376 345 A 25 GLY HAx A 27 LEU HD2% 1.0 . 4.34 377 346 A 25 GLY HAy A 27 LEU HD2% 1.0 . 4.97 378 347 A 25 GLY HAy A 27 LEU HD1% 1.0 . 4.97 379 348 A 25 GLY HAx A 27 LEU HD1% 1.0 . 4.34 380 349 A 53 GLY HAx A 32 TYR HE% 1.0 . 3.97 381 350 A 61 VAL HG1% A 65 GLY HAy 1.0 . 4.94 382 351 A 112 GLU HBy A 94 GLY HAx 1.0 . 5.18 383 352 A 37 TYR H A 36 LEU HBx 1.0 . 4.91 384 353 A 14 THR HG2% A 36 LEU HBy 1.0 . 4.89 385 354 A 59 PHE HBy A 22 ILE HB 1.0 . 5.21 386 355 A 22 ILE HG2% A 67 ARG HDy 1.0 . 4.74 387 356 A 22 ILE HG2% A 59 PHE HBy 1.0 . 4.48 388 357 A 22 ILE HG2% A 67 ARG HDx 1.0 . 4.74 389 358 A 92 ARG HB2 A 92 ARG HDx 1.0 . 3.38 390 358 A 92 ARG HB3 A 92 ARG HDx 1.0 . 3.38 391 359 A 58 THR HG2% A 92 ARG HDx 1.0 . 4.57 392 360 A 122 LEU HB2 A 122 LEU HD2% 1.0 . 3.37 393 361 A 122 LEU HD1% A 122 LEU HB2 1.0 . 3.37 394 362 A 113 PHE HE% A 91 LEU HBy 1.0 . 4.35 395 363 A 93 TYR HE% A 91 LEU HBy 1.0 . 4.39 396 364 A 115 ARG HD3 A 115 ARG HB3 1.0 . 3.60 397 364 A 115 ARG HB3 A 115 ARG HD2 1.0 . 3.60 398 365 A 119 ARG HBx A 119 ARG HDx 1.0 . 3.83 399 366 A 91 LEU HBy A 91 LEU HD1% 1.0 . 4.07 400 367 A 91 LEU HBx A 91 LEU HD1% 1.0 . 3.96 401 368 A 43 VAL HG1% A 119 ARG HDx 1.0 . 5.13 402 369 A 59 PHE HBx A 91 LEU HBy 1.0 . 4.70 403 370 A 119 ARG HDx A 40 LYS HBy 1.0 . 4.85 404 371 A 119 ARG HBy A 119 ARG HDx 1.0 . 4.11 405 372 A 70 GLU HA A 73 LEU HBx 1.0 . 4.20 406 373 A 111 VAL HB A 118 TYR HB2 1.0 . 4.93 407 373 A 111 VAL HB A 118 TYR HB3 1.0 . 4.93 408 374 A 73 LEU HBx A 73 LEU HD2% 1.0 . 3.75 409 375 A 52 ILE HD1% A 109 ILE HB 1.0 . 4.44 410 376 A 110 ILE HA A 118 TYR HB2 1.0 . 5.05 411 376 A 110 ILE HA A 118 TYR HB3 1.0 . 5.05 412 377 A 64 ASP HBx A 66 LYS HB2 1.0 . 4.61 413 377 A 66 LYS HB3 A 64 ASP HBx 1.0 . 4.61 414 378 A 97 TYR HB3 A 110 ILE HD1% 1.0 . 4.23 415 379 A 47 LYS HGx A 47 LYS HE2 1.0 . 3.57 416 379 A 47 LYS HGx A 47 LYS HE3 1.0 . 3.57 417 380 A 47 LYS HGx A 44 ASP HBy 1.0 . 4.40 418 381 A 24 LYS HG3 A 24 LYS HE2 1.0 . 2.78 419 381 A 24 LYS HG3 A 24 LYS HE3 1.0 . 2.78 420 382 A 42 LYS HGx A 42 LYS HE2 1.0 . 4.10 421 383 A 39 LEU HBx A 39 LEU HD2% 1.0 . 3.86 422 384 A 117 TYR HD% A 48 LYS HE2 1.0 . 5.29 423 384 A 117 TYR HD% A 48 LYS HE3 1.0 . 5.29 424 385 A 97 TYR HE% A 48 LYS HE2 1.0 . 3.36 425 385 A 97 TYR HE% A 48 LYS HE3 1.0 . 3.36 426 386 A 18 MET HA A 21 LEU HBx 1.0 . 4.88 427 387 A 30 VAL HA A 21 LEU HBx 1.0 . 5.19 428 388 A 48 LYS HE3 A 48 LYS HBy 1.0 . 4.32 429 388 A 48 LYS HBy A 48 LYS HE2 1.0 . 4.32 430 389 A 48 LYS HG2 A 48 LYS HE2 1.0 . 3.79 431 389 A 48 LYS HE3 A 48 LYS HG2 1.0 . 3.79 432 390 A 21 LEU HD1% A 21 LEU HBy 1.0 . 3.61 433 391 A 21 LEU HD1% A 21 LEU HBx 1.0 . 3.60 434 392 A 83 ASP HA A 83 ASP HBy 1.0 . 2.93 435 393 A 83 ASP HBy A 82 PRO HBy 1.0 . 4.92 436 394 A 108 GLU HG3 A 107 ASP HB2 1.0 . 4.67 437 394 A 107 ASP HB3 A 108 GLU HG3 1.0 . 4.67 438 395 A 27 LEU HB3 A 91 LEU HD1% 1.0 . 5.50 439 396 A 27 LEU HB3 A 91 LEU HD2% 1.0 . 5.50 440 397 A 27 LEU HB2 A 27 LEU HD2% 1.0 . 3.57 441 398 A 27 LEU HB3 A 27 LEU HD1% 1.0 . 3.41 442 399 A 107 ASP HB3 A 122 LEU HD1% 1.0 . 4.97 443 399 A 122 LEU HD1% A 107 ASP HB2 1.0 . 4.97 444 400 A 118 TYR HD% A 113 PHE HBx 1.0 . 4.37 445 401 A 93 TYR HD% A 113 PHE HBy 1.0 . 4.87 446 402 A 109 ILE HD1% A 32 TYR HB2 1.0 . 5.13 447 403 A 55 ILE HD1% A 113 PHE HBy 1.0 . 5.24 448 404 A 52 ILE HD1% A 52 ILE HB 1.0 . 3.62 449 405 A 55 ILE HB A 93 TYR HBy 1.0 . 4.19 450 406 A 97 TYR HE% A 117 TYR HBy 1.0 . 5.43 451 407 A 97 TYR HE% A 117 TYR HBx 1.0 . 4.30 452 408 A 110 ILE HG2% A 117 TYR HBx 1.0 . 3.87 453 409 A 110 ILE HB A 97 TYR HB2 1.0 . 4.30 454 410 A 110 ILE HB A 97 TYR HB3 1.0 . 4.15 455 411 A 84 GLU HG3 A 81 ASN HBy 1.0 . 4.81 456 411 A 81 ASN HBy A 84 GLU HG2 1.0 . 4.81 457 412 A 78 ILE HD1% A 78 ILE HB 1.0 . 3.31 458 413 A 93 TYR HBx A 55 ILE HB 1.0 . 4.17 459 414 A 59 PHE HD% A 19 GLU HGx 1.0 . 5.03 460 415 A 116 GLU HA A 116 GLU HGx 1.0 . 3.78 461 416 A 19 GLU HA A 19 GLU HGy 1.0 . 3.84 462 417 A 59 PHE HE% A 19 GLU HGx 1.0 . 3.85 463 418 A 19 GLU HA A 19 GLU HGx 1.0 . 3.84 464 419 A 123 ILE HB A 36 LEU HD1% 1.0 . 4.98 465 420 A 22 ILE HB A 67 ARG HG2 1.0 . 4.67 466 420 A 22 ILE HB A 67 ARG HG3 1.0 . 4.67 467 421 A 87 GLU HA A 87 GLU HGy 1.0 . 3.61 468 422 A 108 GLU HG2 A 108 GLU HA 1.0 . 3.93 469 423 A 121 VAL HA A 108 GLU HG3 1.0 . 4.15 470 424 A 61 VAL HB A 65 GLY HAx 1.0 . 3.98 471 425 A 71 GLU HA A 71 GLU HG2 1.0 . 3.17 472 426 A 61 VAL HB A 65 GLY HAy 1.0 . 4.48 473 427 A 126 GLU HA A 126 GLU HGy 1.0 . 3.88 474 428 A 70 GLU HA A 70 GLU HG3 1.0 . 3.55 475 429 A 84 GLU HA A 84 GLU HG2 1.0 . 3.20 476 429 A 84 GLU HG3 A 84 GLU HA 1.0 . 3.20 477 430 A 101 GLU HA A 101 GLU HG3 1.0 . 3.83 478 431 A 21 LEU HD1% A 30 VAL HB 1.0 . 3.96 479 432 A 11 GLU HA A 11 GLU HG2 1.0 . 3.89 480 433 A 111 VAL HB A 39 LEU HD1% 1.0 . 5.20 481 434 A 111 VAL H A 111 VAL HB 1.0 . 3.77 482 435 A 75 GLU HA A 75 GLU HGx 1.0 . 3.58 483 436 A 72 GLU HA A 75 GLU HGy 1.0 . 4.18 484 437 A 111 VAL HB A 39 LEU HD2% 1.0 . 5.20 485 438 A 96 VAL HG2% A 111 VAL HB 1.0 . 4.42 486 439 A 59 PHE HE% A 57 GLN HB2 1.0 . 4.40 487 440 A 59 PHE HE% A 57 GLN HB3 1.0 . 4.40 488 441 A 117 TYR HD% A 43 VAL HB 1.0 . 5.50 489 442 A 45 GLU HA A 45 GLU HGx 1.0 . 3.98 490 443 A 117 TYR HD% A 112 GLU HGy 1.0 . 4.49 491 444 A 117 TYR HD% A 112 GLU HGx 1.0 . 4.16 492 445 A 117 TYR HA A 112 GLU HGx 1.0 . 4.36 493 446 A 115 ARG HA A 112 GLU HGx 1.0 . 4.57 494 447 A 110 ILE HD1% A 43 VAL HB 1.0 . 5.26 495 448 A 38 HIS HBx A 121 VAL HB 1.0 . 5.10 496 449 A 119 ARG HDx A 41 GLU HGx 1.0 . 5.50 497 450 A 38 HIS HBy A 121 VAL HB 1.0 . 5.20 498 451 A 41 GLU HGy A 41 GLU HBx 1.0 . 2.99 499 452 A 121 VAL HB A 40 LYS HG2 1.0 . 4.36 500 452 A 40 LYS HG3 A 121 VAL HB 1.0 . 4.36 501 453 A 43 VAL HG1% A 41 GLU HGy 1.0 . 3.61 502 454 A 95 LYS HBx A 51 VAL HG1% 1.0 . 5.02 503 455 A 16 GLU HA A 16 GLU HG2 1.0 . 3.72 504 455 A 16 GLU HA A 16 GLU HG3 1.0 . 3.72 505 456 A 21 LEU HG A 16 GLU HG2 1.0 . 4.51 506 456 A 21 LEU HG A 16 GLU HG3 1.0 . 4.51 507 457 A 119 ARG HBy A 41 GLU HGx 1.0 . 4.78 508 458 A 36 LEU HD1% A 16 GLU HG2 1.0 . 3.73 509 458 A 36 LEU HD1% A 16 GLU HG3 1.0 . 3.73 510 459 A 36 LEU HD2% A 16 GLU HG2 1.0 . 3.67 511 459 A 36 LEU HD2% A 16 GLU HG3 1.0 . 3.67 512 460 A 21 LEU HD2% A 16 GLU HG2 1.0 . 3.53 513 460 A 21 LEU HD2% A 16 GLU HG3 1.0 . 3.53 514 461 A 55 ILE HG2% A 57 GLN HGx 1.0 . 4.00 515 462 A 96 VAL HB A 52 ILE HG12 1.0 . 4.70 516 463 A 96 VAL HB A 52 ILE HG13 1.0 . 4.70 517 464 A 59 PHE HE% A 57 GLN HGy 1.0 . 4.80 518 465 A 32 TYR HE% A 96 VAL HB 1.0 . 4.54 519 466 A 35 GLN HGx A 122 LEU HD2% 1.0 . 4.57 520 467 A 21 LEU HD1% A 16 GLU HG2 1.0 . 4.06 521 467 A 21 LEU HD1% A 16 GLU HG3 1.0 . 4.06 522 468 A 35 GLN HGx A 122 LEU HD1% 1.0 . 4.57 523 469 A 98 SER HBx A 50 LYS HB2 1.0 . 4.67 524 469 A 98 SER HBx A 50 LYS HB3 1.0 . 4.67 525 470 A 50 LYS HB3 A 50 LYS HE2 1.0 . 4.13 526 470 A 50 LYS HB2 A 50 LYS HE2 1.0 . 4.13 527 470 A 50 LYS HE3 A 50 LYS HB2 1.0 . 4.13 528 470 A 50 LYS HB3 A 50 LYS HE3 1.0 . 4.13 529 471 A 29 GLN HGx A 26 LYS HB2 1.0 . 4.68 530 471 A 26 LYS HB3 A 29 GLN HGx 1.0 . 4.68 531 472 A 60 PHE HD% A 88 LYS HBx 1.0 . 4.57 532 473 A 52 ILE HG2% A 50 LYS HB2 1.0 . 4.23 533 473 A 52 ILE HG2% A 50 LYS HB3 1.0 . 4.23 534 474 A 88 LYS HBx A 88 LYS HDx 1.0 . 4.09 535 475 A 24 LYS HBy A 24 LYS HE2 1.0 . 4.19 536 475 A 24 LYS HBy A 24 LYS HE3 1.0 . 4.19 537 476 A 48 LYS HDy A 48 LYS HBy 1.0 . 4.20 538 477 A 48 LYS HBy A 48 LYS HDx 1.0 . 4.20 539 478 A 24 LYS HBx A 24 LYS HE2 1.0 . 4.89 540 478 A 24 LYS HBx A 24 LYS HE3 1.0 . 4.89 541 479 A 24 LYS HBx A 26 LYS HE2 1.0 . 5.42 542 480 A 24 LYS HBx A 24 LYS HDy 1.0 . 3.72 543 481 A 24 LYS HBx A 26 LYS HG2 1.0 . 4.43 544 481 A 24 LYS HBx A 26 LYS HG3 1.0 . 4.43 545 482 A 42 LYS HBx A 118 TYR HE% 1.0 . 4.38 546 483 A 124 LYS HA A 124 LYS HBy 1.0 . 3.00 547 483 A 124 LYS HA A 124 LYS HBx 1.0 . 3.00 548 484 A 124 LYS HBy A 124 LYS HE2 1.0 . 4.28 549 484 A 124 LYS HBx A 124 LYS HE2 1.0 . 4.28 550 484 A 124 LYS HE3 A 124 LYS HBy 1.0 . 4.28 551 484 A 124 LYS HBx A 124 LYS HE3 1.0 . 4.28 552 485 A 42 LYS HBy A 42 LYS HE3 1.0 . 4.47 553 486 A 42 LYS HBx A 42 LYS HE2 1.0 . 4.48 554 487 A 99 THR HG2% A 108 GLU HBx 1.0 . 3.62 555 488 A 118 TYR HD% A 42 LYS HBx 1.0 . 4.98 556 489 A 118 TYR HA A 42 LYS HBy 1.0 . 4.59 557 490 A 106 LYS HE3 A 106 LYS HBy 1.0 . 4.60 558 490 A 106 LYS HBy A 106 LYS HE2 1.0 . 4.60 559 491 A 60 PHE HE% A 90 PRO HBx 1.0 . 4.00 560 492 A 60 PHE HD% A 90 PRO HBy 1.0 . 4.56 561 493 A 38 HIS HBx A 120 ALA HB% 1.0 . 5.50 562 494 A 58 THR HG2% A 90 PRO HBy 1.0 . 4.44 563 495 A 38 HIS HBy A 40 LYS HD2 1.0 . 4.89 564 495 A 38 HIS HBy A 40 LYS HD3 1.0 . 4.89 565 496 A 38 HIS HBy A 123 ILE HB 1.0 . 5.50 566 497 A 38 HIS HBx A 121 VAL HG1% 1.0 . 5.50 567 498 A 38 HIS HBy A 121 VAL HG1% 1.0 . 5.50 568 499 A 123 ILE HG1y A 38 HIS HBy 1.0 . 4.38 569 500 A 89 LYS HB3 A 89 LYS HDx 1.0 . 3.69 570 500 A 89 LYS HDx A 89 LYS HB2 1.0 . 3.69 571 501 A 22 ILE HG2% A 67 ARG HBx 1.0 . 4.90 572 502 A 22 ILE HG2% A 67 ARG HBy 1.0 . 4.90 573 503 A 97 TYR HD% A 51 VAL HB 1.0 . 4.37 574 504 A 97 TYR HE% A 51 VAL HB 1.0 . 4.87 575 505 A 40 LYS HD3 A 40 LYS HBx 1.0 . 3.82 576 505 A 40 LYS HBx A 40 LYS HD2 1.0 . 3.82 577 506 A 62 ASP HA A 87 GLU HBy 1.0 . 4.66 578 507 A 97 TYR HE% A 112 GLU HBx 1.0 . 3.78 579 508 A 112 GLU HBy A 94 GLY HAy 1.0 . 4.34 580 509 A 43 VAL HG2% A 119 ARG HBy 1.0 . 3.96 581 510 A 43 VAL HG1% A 119 ARG HBy 1.0 . 3.91 582 511 A 110 ILE HG2% A 119 ARG HBy 1.0 . 4.60 583 512 A 110 ILE HD1% A 119 ARG HBy 1.0 . 5.23 584 513 A 59 PHE HE% A 18 MET HGx 1.0 . 4.59 585 514 A 59 PHE HE% A 18 MET HGy 1.0 . 5.25 586 515 A 58 THR HG2% A 92 ARG HB2 1.0 . 3.99 587 515 A 92 ARG HB3 A 58 THR HG2% 1.0 . 3.99 588 516 A 36 LEU HD2% A 16 GLU HBx 1.0 . 5.00 589 517 A 16 GLU HBy A 31 VAL HG1% 1.0 . 5.46 590 518 A 16 GLU HBx A 31 VAL HG1% 1.0 . 5.50 591 519 A 24 LYS HDy A 26 LYS HG2 1.0 . 3.91 592 519 A 26 LYS HG3 A 24 LYS HDy 1.0 . 3.91 593 520 A 76 PRO HDy A 75 GLU HB2 1.0 . 4.27 594 521 A 75 GLU HB2 A 76 PRO HDx 1.0 . 4.27 595 522 A 59 PHE HE% A 18 MET HBx 1.0 . 4.29 596 523 A 24 LYS HA A 24 LYS HDx 1.0 . 4.88 597 524 A 50 LYS HD3 A 50 LYS HE2 1.0 . 2.80 598 524 A 50 LYS HD2 A 50 LYS HE2 1.0 . 2.80 599 524 A 50 LYS HE3 A 50 LYS HD2 1.0 . 2.80 600 524 A 50 LYS HD3 A 50 LYS HE3 1.0 . 2.80 601 525 A 95 LYS HBy A 95 LYS HD2 1.0 . 3.08 602 525 A 95 LYS HD3 A 95 LYS HBy 1.0 . 3.08 603 526 A 95 LYS HGx A 95 LYS HD2 1.0 . 2.71 604 526 A 95 LYS HD3 A 95 LYS HGx 1.0 . 2.71 605 527 A 26 LYS HA A 26 LYS HD2 1.0 . 3.91 606 527 A 26 LYS HA A 26 LYS HD3 1.0 . 3.91 607 528 A 21 LEU HD2% A 26 LYS HD2 1.0 . 3.63 608 528 A 21 LEU HD2% A 26 LYS HD3 1.0 . 3.63 609 529 A 48 LYS HA A 48 LYS HDx 1.0 . 5.30 610 530 A 60 PHE HBy A 68 TRP HB2 1.0 . 4.67 611 531 A 22 ILE HG2% A 22 ILE HG1x 1.0 . 3.88 612 532 A 97 TYR HE% A 48 LYS HDy 1.0 . 4.15 613 533 A 48 LYS HBx A 48 LYS HDx 1.0 . 4.20 614 534 A 48 LYS HBx A 48 LYS HDy 1.0 . 4.20 615 535 A 22 ILE HG1y A 22 ILE HG2% 1.0 . 3.93 616 536 A 61 VAL HG1% A 67 ARG HG2 1.0 . 3.89 617 536 A 67 ARG HG3 A 61 VAL HG1% 1.0 . 3.89 618 537 A 22 ILE HG2% A 67 ARG HG2 1.0 . 4.05 619 537 A 22 ILE HG2% A 67 ARG HG3 1.0 . 4.05 620 538 A 67 ARG HA A 67 ARG HG2 1.0 . 3.79 621 538 A 67 ARG HG3 A 67 ARG HA 1.0 . 3.79 622 539 A 113 PHE HZ A 91 LEU HD1% 1.0 . 4.52 623 540 A 32 TYR HD% A 55 ILE HG1y 1.0 . 4.67 624 541 A 39 LEU HA A 40 LYS HD2 1.0 . 4.60 625 541 A 39 LEU HA A 40 LYS HD3 1.0 . 4.60 626 542 A 123 ILE HG1y A 38 HIS HBx 1.0 . 4.43 627 543 A 121 VAL HG1% A 40 LYS HD2 1.0 . 4.52 628 543 A 40 LYS HD3 A 121 VAL HG1% 1.0 . 4.52 629 544 A 123 ILE HG1y A 123 ILE HG2% 1.0 . 3.44 630 545 A 47 LYS HA A 47 LYS HD2 1.0 . 3.24 631 545 A 47 LYS HA A 47 LYS HD3 1.0 . 3.24 632 546 A 40 LYS HD3 A 40 LYS HBy 1.0 . 3.82 633 546 A 40 LYS HBy A 40 LYS HD2 1.0 . 3.82 634 547 A 55 ILE HG1y A 55 ILE HG2% 1.0 . 3.46 635 548 A 123 ILE HG1x A 123 ILE HG2% 1.0 . 3.55 636 549 A 58 THR HG2% A 92 ARG HG2 1.0 . 3.55 637 549 A 92 ARG HG3 A 58 THR HG2% 1.0 . 3.55 638 550 A 39 LEU HA A 39 LEU HG 1.0 . 4.08 639 551 A 85 ILE HG2% A 85 ILE HG1y 1.0 . 3.30 640 552 A 85 ILE HG2% A 85 ILE HG1x 1.0 . 3.30 641 553 A 60 PHE HE% A 90 PRO HG3 1.0 . 4.02 642 554 A 60 PHE HD% A 73 LEU HG 1.0 . 5.28 643 555 A 60 PHE HD% A 90 PRO HG3 1.0 . 5.50 644 556 A 78 ILE HG2% A 78 ILE HG1x 1.0 . 4.17 645 557 A 73 LEU HG A 68 TRP HZ3 1.0 . 5.50 646 558 A 91 LEU HG A 113 PHE HE% 1.0 . 5.21 647 559 A 21 LEU HD1% A 29 GLN HGy 1.0 . 4.35 648 560 A 24 LYS HG2 A 26 LYS HB2 1.0 . 4.17 649 560 A 24 LYS HG2 A 26 LYS HB3 1.0 . 4.17 650 561 A 21 LEU HD1% A 26 LYS HB2 1.0 . 4.13 651 561 A 21 LEU HD1% A 26 LYS HB3 1.0 . 4.13 652 562 A 24 LYS HG3 A 26 LYS HB2 1.0 . 4.26 653 562 A 26 LYS HB3 A 24 LYS HG3 1.0 . 4.26 654 563 A 35 GLN HBx A 122 LEU HD1% 1.0 . 4.45 655 564 A 17 THR HB A 31 VAL HG2% 1.0 . 5.50 656 565 A 17 THR HB A 31 VAL HG1% 1.0 . 5.50 657 566 A 21 LEU HD1% A 36 LEU HD2% 1.0 . 4.07 658 567 A 42 LYS HA A 42 LYS HGx 1.0 . 4.01 659 568 A 14 THR HA A 36 LEU HD2% 1.0 . 4.41 660 569 A 122 LEU HA A 122 LEU HD1% 1.0 . 3.89 661 570 A 124 LYS HE3 A 122 LEU HD1% 1.0 . 4.49 662 570 A 122 LEU HD1% A 124 LYS HE2 1.0 . 4.49 663 571 A 42 LYS HGx A 42 LYS HE3 1.0 . 4.10 664 572 A 42 LYS HGy A 42 LYS HE3 1.0 . 4.22 665 573 A 118 TYR HD% A 39 LEU HD1% 1.0 . 5.23 666 574 A 71 GLU HA A 74 LYS HGy 1.0 . 5.25 667 575 A 71 GLU HA A 74 LYS HGx 1.0 . 5.25 668 576 A 44 ASP HBx A 47 LYS HGx 1.0 . 4.40 669 577 A 44 ASP HBy A 47 LYS HGy 1.0 . 4.48 670 578 A 36 LEU HD1% A 21 LEU HBx 1.0 . 4.68 671 579 A 21 LEU HG A 36 LEU HD1% 1.0 . 4.12 672 580 A 39 LEU HBy A 39 LEU HD1% 1.0 . 3.86 673 581 A 43 VAL HG1% A 47 LYS HGy 1.0 . 4.22 674 582 A 39 LEU HD1% A 30 VAL HG2% 1.0 . 3.93 675 583 A 21 LEU HD1% A 36 LEU HD1% 1.0 . 3.62 676 584 A 66 LYS HA A 66 LYS HG2 1.0 . 3.71 677 585 A 60 PHE HE% A 88 LYS HGy 1.0 . 4.44 678 586 A 88 LYS HGx A 68 TRP HZ2 1.0 . 4.97 679 587 A 106 LYS HE3 A 106 LYS HG3 1.0 . 3.51 680 587 A 106 LYS HE2 A 106 LYS HG3 1.0 . 3.51 681 588 A 60 PHE HBx A 88 LYS HGx 1.0 . 4.64 682 589 A 60 PHE HBx A 88 LYS HGy 1.0 . 4.58 683 590 A 43 VAL HG2% A 47 LYS HGx 1.0 . 3.82 684 591 A 124 LYS HE3 A 122 LEU HD2% 1.0 . 4.49 685 591 A 122 LEU HD2% A 124 LYS HE2 1.0 . 4.49 686 592 A 107 ASP HB3 A 122 LEU HD2% 1.0 . 4.97 687 592 A 107 ASP HB2 A 122 LEU HD2% 1.0 . 4.97 688 593 A 35 GLN HBx A 122 LEU HD2% 1.0 . 4.45 689 594 A 50 LYS HGx A 50 LYS HD2 1.0 . 2.90 690 594 A 50 LYS HD3 A 50 LYS HGx 1.0 . 2.90 691 595 A 113 PHE HD% A 118 TYR HE% 1.0 . 4.70 692 596 A 26 LYS HA A 26 LYS HG2 1.0 . 3.30 693 596 A 26 LYS HG3 A 26 LYS HA 1.0 . 3.30 694 597 A 118 TYR HE% A 113 PHE HBy 1.0 . 4.21 695 598 A 29 GLN HGy A 26 LYS HG2 1.0 . 3.97 696 598 A 29 GLN HGy A 26 LYS HG3 1.0 . 3.97 697 599 A 40 LYS HD3 A 40 LYS HG2 1.0 . 2.79 698 599 A 40 LYS HD2 A 40 LYS HG2 1.0 . 2.79 699 599 A 40 LYS HG3 A 40 LYS HD2 1.0 . 2.79 700 599 A 40 LYS HD3 A 40 LYS HG3 1.0 . 2.79 701 600 A 40 LYS HG3 A 121 VAL HG1% 1.0 . 4.50 702 600 A 121 VAL HG1% A 40 LYS HG2 1.0 . 4.50 703 601 A 21 LEU HD2% A 26 LYS HG2 1.0 . 4.03 704 601 A 26 LYS HG3 A 21 LEU HD2% 1.0 . 4.03 705 602 A 50 LYS HA A 50 LYS HGx 1.0 . 4.04 706 603 A 91 LEU HBy A 91 LEU HD2% 1.0 . 4.07 707 604 A 91 LEU HBx A 91 LEU HD2% 1.0 . 3.96 708 605 A 39 LEU HD2% A 111 VAL HG2% 1.0 . 4.75 709 606 A 51 VAL HA A 51 VAL HG1% 1.0 . 3.55 710 607 A 95 LYS HGy A 51 VAL HG1% 1.0 . 4.36 711 608 A 60 PHE HE% A 73 LEU HD1% 1.0 . 5.38 712 609 A 60 PHE HD% A 73 LEU HD1% 1.0 . 3.94 713 610 A 68 TRP HB2 A 73 LEU HD1% 1.0 . 4.36 714 611 A 60 PHE HBx A 73 LEU HD1% 1.0 . 4.93 715 612 A 73 LEU HD1% A 73 LEU HBy 1.0 . 3.75 716 613 A 73 LEU HD1% A 73 LEU HBx 1.0 . 3.75 717 614 A 21 LEU HD2% A 21 LEU HBx 1.0 . 3.58 718 615 A 21 LEU HD2% A 36 LEU HG 1.0 . 4.46 719 616 A 120 ALA HB% A 30 VAL HG2% 1.0 . 5.11 720 617 A 21 LEU HD2% A 26 LYS HB2 1.0 . 3.47 721 617 A 26 LYS HB3 A 21 LEU HD2% 1.0 . 3.47 722 618 A 120 ALA HB% A 37 TYR HB3 1.0 . 3.90 723 619 A 111 VAL HB A 120 ALA HB% 1.0 . 4.40 724 620 A 58 THR HG2% A 90 PRO HBx 1.0 . 4.44 725 621 A 110 ILE HD1% A 99 THR HB 1.0 . 4.53 726 622 A 120 ALA HB% A 30 VAL HG1% 1.0 . 5.11 727 623 A 120 ALA HB% A 109 ILE HG1x 1.0 . 3.96 728 624 A 60 PHE HE% A 58 THR HG2% 1.0 . 3.65 729 625 A 96 VAL HG1% A 32 TYR HD% 1.0 . 4.22 730 626 A 96 VAL HG1% A 32 TYR HE% 1.0 . 4.08 731 627 A 90 PRO HA A 58 THR HG2% 1.0 . 4.39 732 628 A 60 PHE HBx A 61 VAL HG1% 1.0 . 5.13 733 629 A 96 VAL HG1% A 109 ILE HB 1.0 . 3.89 734 630 A 96 VAL HG1% A 52 ILE HG12 1.0 . 4.09 735 631 A 96 VAL HG1% A 111 VAL HG1% 1.0 . 4.65 736 632 A 96 VAL HG1% A 52 ILE HG13 1.0 . 4.09 737 633 A 43 VAL HG1% A 119 ARG HBx 1.0 . 3.65 738 634 A 22 ILE HB A 61 VAL HG1% 1.0 . 4.45 739 635 A 43 VAL HG1% A 42 LYS HD2 1.0 . 5.01 740 635 A 43 VAL HG1% A 42 LYS HD3 1.0 . 5.01 741 636 A 43 VAL HG1% A 47 LYS HGx 1.0 . 4.74 742 637 A 43 VAL HG1% A 119 ARG HG2 1.0 . 4.96 743 638 A 110 ILE HD1% A 99 THR HG2% 1.0 . 3.39 744 639 A 111 VAL HG1% A 39 LEU HD2% 1.0 . 4.75 745 640 A 39 LEU HD1% A 111 VAL HG1% 1.0 . 4.75 746 641 A 99 THR HA A 99 THR HG2% 1.0 . 3.14 747 642 A 96 VAL HG2% A 55 ILE HD1% 1.0 . 3.54 748 643 A 96 VAL HG2% A 111 VAL HG1% 1.0 . 3.46 749 644 A 96 VAL HG2% A 55 ILE HB 1.0 . 4.55 750 645 A 40 LYS HD2 A 121 VAL HG2% 1.0 . 4.52 751 645 A 40 LYS HD3 A 121 VAL HG2% 1.0 . 4.52 752 646 A 40 LYS HG3 A 121 VAL HG2% 1.0 . 4.50 753 646 A 40 LYS HG2 A 121 VAL HG2% 1.0 . 4.50 754 647 A 55 ILE HG1y A 96 VAL HG2% 1.0 . 3.65 755 648 A 31 VAL HA A 31 VAL HG1% 1.0 . 3.71 756 649 A 17 THR HA A 31 VAL HG1% 1.0 . 3.67 757 650 A 34 ASP HA A 31 VAL HG1% 1.0 . 5.14 758 651 A 14 THR HA A 14 THR HG2% 1.0 . 3.32 759 652 A 95 LYS HD3 A 51 VAL HG2% 1.0 . 3.56 760 652 A 51 VAL HG2% A 95 LYS HD2 1.0 . 3.56 761 653 A 14 THR HG2% A 31 VAL HG2% 1.0 . 4.34 762 654 A 34 ASP HA A 31 VAL HG2% 1.0 . 5.14 763 655 A 119 ARG HDx A 121 VAL HG1% 1.0 . 5.50 764 656 A 31 VAL H A 30 VAL HG1% 1.0 . 4.10 765 657 A 43 VAL HG2% A 118 TYR HA 1.0 . 4.45 766 658 A 43 VAL HG2% A 47 LYS HD2 1.0 . 5.50 767 658 A 43 VAL HG2% A 47 LYS HD3 1.0 . 5.50 768 659 A 43 VAL HG2% A 119 ARG HBx 1.0 . 5.50 769 660 A 43 VAL HG2% A 42 LYS HD2 1.0 . 4.67 770 660 A 43 VAL HG2% A 42 LYS HD3 1.0 . 4.67 771 661 A 123 ILE HA A 38 HIS HBy 1.0 . 4.75 772 662 A 123 ILE HA A 121 VAL HG1% 1.0 . 5.18 773 663 A 51 VAL HA A 52 ILE HA 1.0 . 4.77 774 664 A 96 VAL HA A 95 LYS HGy 1.0 . 5.02 775 665 A 110 ILE HB A 96 VAL HA 1.0 . 5.50 776 666 A 17 THR HA A 31 VAL HB 1.0 . 4.83 777 667 A 43 VAL HA A 47 LYS HD2 1.0 . 5.45 778 667 A 43 VAL HA A 47 LYS HD3 1.0 . 5.45 779 668 A 60 PHE HA A 90 PRO HBy 1.0 . 5.50 780 669 A 38 HIS HBy A 29 GLN HA 1.0 . 5.50 781 670 A 29 GLN HA A 39 LEU HBy 1.0 . 4.73 782 671 A 75 GLU HGy A 76 PRO HDx 1.0 . 5.09 783 672 A 59 PHE HBy A 91 LEU HBy 1.0 . 4.76 784 673 A 118 TYR HB3 A 111 VAL HG2% 1.0 . 5.14 785 673 A 111 VAL HG2% A 118 TYR HB2 1.0 . 5.14 786 674 A 21 LEU HBx A 26 LYS HB2 1.0 . 4.79 787 674 A 26 LYS HB3 A 21 LEU HBx 1.0 . 4.79 788 675 A 24 LYS HG2 A 21 LEU HBx 1.0 . 5.37 789 676 A 34 ASP HBx A 35 GLN HGx 1.0 . 5.50 790 677 A 34 ASP HBx A 35 GLN HGy 1.0 . 4.72 791 678 A 112 GLU H A 112 GLU HGy 1.0 . 4.71 792 679 A 117 TYR HD% A 112 GLU HBx 1.0 . 4.77 793 680 A 123 ILE HG1x A 38 HIS HBx 1.0 . 4.77 794 681 A 14 THR HB A 36 LEU HG 1.0 . 4.69 795 682 A 14 THR HB A 36 LEU HBy 1.0 . 4.81 796 683 A 80 ASN HA A 82 PRO HD2 1.0 . 4.55 797 683 A 82 PRO HD3 A 80 ASN HA 1.0 . 4.55 798 684 A 84 GLU HG3 A 81 ASN HBx 1.0 . 4.81 799 684 A 81 ASN HBx A 84 GLU HG2 1.0 . 4.81 800 685 A 21 LEU HD2% A 16 GLU HBx 1.0 . 4.34 801 686 A 16 GLU HBx A 31 VAL HG2% 1.0 . 5.50 802 687 A 16 GLU HBy A 31 VAL HG2% 1.0 . 5.46 803 688 A 16 GLU HG3 A 31 VAL HG2% 1.0 . 4.43 804 688 A 16 GLU HG2 A 31 VAL HG2% 1.0 . 4.43 805 689 A 17 THR HA A 18 MET HA 1.0 . 4.72 806 690 A 118 TYR HE% A 42 LYS HA 1.0 . 4.71 807 691 A 21 LEU HD1% A 18 MET HGy 1.0 . 5.10 808 692 A 18 MET HGy A 31 VAL HG1% 1.0 . 5.49 809 693 A 18 MET HGy A 31 VAL HB 1.0 . 4.77 810 694 A 117 TYR HD% A 112 GLU HBy 1.0 . 4.93 811 695 A 59 PHE HD% A 19 GLU HA 1.0 . 4.87 812 696 A 97 TYR HE% A 95 LYS HD2 1.0 . 4.77 813 696 A 95 LYS HD3 A 97 TYR HE% 1.0 . 4.77 814 697 A 72 GLU HB3 A 68 TRP HZ3 1.0 . 4.22 815 698 A 59 PHE HD% A 19 GLU HGy 1.0 . 5.03 816 699 A 21 LEU HA A 24 LYS HDx 1.0 . 5.50 817 700 A 21 LEU HA A 16 GLU HG2 1.0 . 5.38 818 700 A 21 LEU HA A 16 GLU HG3 1.0 . 5.38 819 701 A 21 LEU HBy A 22 ILE HG1x 1.0 . 5.12 820 702 A 36 LEU HD1% A 21 LEU HBy 1.0 . 5.13 821 703 A 22 ILE HB A 21 LEU HBy 1.0 . 4.95 822 704 A 61 VAL HG2% A 22 ILE HD1% 1.0 . 4.97 823 705 A 22 ILE HD1% A 93 TYR HD% 1.0 . 4.79 824 706 A 24 LYS HBx A 26 LYS HE3 1.0 . 5.42 825 707 A 47 LYS HGx A 44 ASP HA 1.0 . 4.77 826 708 A 43 VAL HG2% A 44 ASP HA 1.0 . 4.84 827 709 A 21 LEU HD2% A 26 LYS HA 1.0 . 5.50 828 710 A 21 LEU HA A 26 LYS HD2 1.0 . 4.67 829 710 A 21 LEU HA A 26 LYS HD3 1.0 . 4.67 830 711 A 21 LEU HD2% A 26 LYS HE3 1.0 . 4.49 831 712 A 42 LYS HGy A 42 LYS HE2 1.0 . 4.22 832 713 A 40 LYS HA A 40 LYS HEy 1.0 . 4.85 833 714 A 40 LYS HA A 40 LYS HEx 1.0 . 4.85 834 715 A 120 ALA HB% A 40 LYS HG2 1.0 . 4.85 835 715 A 120 ALA HB% A 40 LYS HG3 1.0 . 4.85 836 716 A 97 TYR HE% A 45 GLU HA 1.0 . 5.50 837 717 A 118 TYR HE% A 112 GLU HGx 1.0 . 5.50 838 718 A 22 ILE HA A 27 LEU HA 1.0 . 5.11 839 719 A 60 PHE HD% A 88 LYS HA 1.0 . 5.16 840 720 A 97 TYR HD% A 50 LYS HA 1.0 . 4.70 841 721 A 27 LEU HD1% A 27 LEU HB2 1.0 . 3.57 842 722 A 27 LEU HB3 A 27 LEU HD2% 1.0 . 3.41 843 723 A 31 VAL HA A 36 LEU HD1% 1.0 . 4.70 844 724 A 118 TYR HA A 42 LYS HGy 1.0 . 5.22 845 725 A 111 VAL H A 119 ARG HG2 1.0 . 5.50 846 726 A 110 ILE H A 119 ARG HG2 1.0 . 5.50 847 727 A 29 GLN HA A 39 LEU HD2% 1.0 . 5.25 848 728 A 29 GLN HA A 30 VAL HG1% 1.0 . 5.13 849 729 A 38 HIS HBx A 29 GLN HA 1.0 . 5.50 850 730 A 89 LYS HB2 A 91 LEU HD2% 1.0 . 5.07 851 730 A 89 LYS HB3 A 91 LEU HD2% 1.0 . 5.07 852 731 A 14 THR HG2% A 35 GLN HBy 1.0 . 5.35 853 732 A 29 GLN HGy A 38 HIS HA 1.0 . 5.17 854 733 A 29 GLN HGy A 21 LEU HD2% 1.0 . 4.86 855 734 A 22 ILE HD1% A 60 PHE HA 1.0 . 5.50 856 735 A 60 PHE HA A 88 LYS HGx 1.0 . 5.15 857 736 A 60 PHE HA A 88 LYS HGy 1.0 . 5.29 858 737 A 60 PHE HA A 91 LEU HG 1.0 . 5.50 859 738 A 60 PHE HA A 59 PHE HBx 1.0 . 5.17 860 739 A 60 PHE HA A 68 TRP HB2 1.0 . 5.50 861 740 A 60 PHE HA A 88 LYS HA 1.0 . 5.48 862 741 A 60 PHE HA A 68 TRP HD1 1.0 . 5.23 863 742 A 60 PHE HBx A 61 VAL HA 1.0 . 5.03 864 743 A 88 LYS HGy A 60 PHE HBy 1.0 . 5.01 865 744 A 59 PHE HBx A 61 VAL HG1% 1.0 . 4.48 866 745 A 22 ILE HG2% A 61 VAL HA 1.0 . 4.80 867 746 A 61 VAL HG1% A 61 VAL HA 1.0 . 3.23 868 747 A 61 VAL HG2% A 61 VAL HA 1.0 . 3.95 869 748 A 61 VAL HA A 67 ARG HG2 1.0 . 4.90 870 748 A 67 ARG HG3 A 61 VAL HA 1.0 . 4.90 871 749 A 60 PHE HA A 61 VAL HA 1.0 . 5.00 872 750 A 62 ASP HA A 61 VAL HA 1.0 . 5.33 873 751 A 68 TRP HD1 A 61 VAL HA 1.0 . 3.38 874 752 A 61 VAL HG2% A 67 ARG HG2 1.0 . 5.27 875 752 A 61 VAL HG2% A 67 ARG HG3 1.0 . 5.27 876 753 A 89 LYS HGy A 62 ASP HA 1.0 . 5.50 877 754 A 61 VAL HG2% A 62 ASP HA 1.0 . 5.43 878 755 A 68 TRP HA A 68 TRP HD1 1.0 . 4.88 879 756 A 15 SER HA A 16 GLU HG2 1.0 . 5.10 880 756 A 15 SER HA A 16 GLU HG3 1.0 . 5.10 881 757 A 15 SER HA A 14 THR HG2% 1.0 . 4.99 882 758 A 60 PHE HD% A 68 TRP HB3 1.0 . 4.89 883 759 A 73 LEU HG A 68 TRP HB2 1.0 . 5.50 884 760 A 68 TRP HB3 A 73 LEU HD2% 1.0 . 4.29 885 761 A 108 GLU HA A 109 ILE HG1x 1.0 . 5.07 886 762 A 108 GLU HA A 109 ILE HG1y 1.0 . 5.16 887 763 A 109 ILE HG2% A 108 GLU HBy 1.0 . 5.08 888 764 A 74 LYS HE3 A 74 LYS HB2 1.0 . 4.54 889 764 A 74 LYS HB2 A 74 LYS HE2 1.0 . 4.54 890 765 A 107 ASP HB3 A 122 LEU HB2 1.0 . 3.89 891 765 A 107 ASP HB2 A 122 LEU HB2 1.0 . 3.89 892 766 A 108 GLU HG2 A 121 VAL HG1% 1.0 . 3.89 893 767 A 108 GLU HG2 A 99 THR HG2% 1.0 . 4.20 894 768 A 120 ALA HA A 121 VAL HB 1.0 . 5.10 895 769 A 120 ALA HA A 39 LEU HD1% 1.0 . 5.50 896 770 A 109 ILE HG2% A 120 ALA HB% 1.0 . 5.35 897 771 A 123 ILE HD1% A 120 ALA HB% 1.0 . 5.50 898 772 A 30 VAL HA A 31 VAL HG2% 1.0 . 5.50 899 773 A 93 TYR HD% A 30 VAL HG1% 1.0 . 4.84 900 774 A 21 LEU HD2% A 26 LYS HE2 1.0 . 4.49 901 775 A 48 LYS HE3 A 48 LYS HG3 1.0 . 3.79 902 775 A 48 LYS HE2 A 48 LYS HG3 1.0 . 3.79 903 776 A 24 LYS HG2 A 21 LEU HD2% 1.0 . 4.21 904 777 A 21 LEU HD2% A 21 LEU HBy 1.0 . 3.67 905 778 A 36 LEU HD1% A 31 VAL HB 1.0 . 4.68 906 779 A 16 GLU HA A 31 VAL HG1% 1.0 . 5.50 907 780 A 32 TYR HA A 31 VAL HG1% 1.0 . 5.50 908 781 A 55 ILE HG1y A 32 TYR HA 1.0 . 4.85 909 782 A 36 LEU HA A 14 THR HG2% 1.0 . 4.75 910 783 A 36 LEU HA A 37 TYR HD% 1.0 . 4.87 911 784 A 36 LEU HD1% A 36 LEU HBy 1.0 . 3.47 912 785 A 118 TYR HD% A 39 LEU HBx 1.0 . 4.91 913 786 A 118 TYR HD% A 39 LEU HBy 1.0 . 5.50 914 787 A 28 ASP HA A 39 LEU HBy 1.0 . 3.85 915 788 A 120 ALA HB% A 39 LEU HD1% 1.0 . 4.37 916 789 A 37 TYR HA A 122 LEU HG 1.0 . 5.50 917 790 A 123 ILE HG2% A 38 HIS HA 1.0 . 5.50 918 791 A 120 ALA HB% A 38 HIS HA 1.0 . 5.00 919 792 A 38 HIS HA A 39 LEU HBy 1.0 . 5.35 920 793 A 38 HIS HA A 40 LYS HD2 1.0 . 5.50 921 793 A 40 LYS HD3 A 38 HIS HA 1.0 . 5.50 922 794 A 38 HIS HA A 29 GLN HB3 1.0 . 4.81 923 795 A 123 ILE HG2% A 38 HIS HBx 1.0 . 5.38 924 796 A 38 HIS HBy A 121 VAL HG2% 1.0 . 5.50 925 797 A 38 HIS HBy A 36 LEU HG 1.0 . 5.50 926 798 A 38 HIS HBy A 40 LYS HG2 1.0 . 5.50 927 798 A 38 HIS HBy A 40 LYS HG3 1.0 . 5.50 928 799 A 43 VAL HG2% A 47 LYS HA 1.0 . 5.50 929 800 A 40 LYS HA A 39 LEU HBx 1.0 . 4.93 930 801 A 45 GLU HA A 46 ASP HA 1.0 . 4.91 931 802 A 119 ARG HDx A 40 LYS HBx 1.0 . 4.85 932 803 A 44 ASP HBx A 47 LYS HD2 1.0 . 4.51 933 803 A 44 ASP HBx A 47 LYS HD3 1.0 . 4.51 934 804 A 119 ARG HBx A 41 GLU HGx 1.0 . 4.09 935 805 A 43 VAL HA A 42 LYS HD2 1.0 . 5.17 936 805 A 43 VAL HA A 42 LYS HD3 1.0 . 5.17 937 806 A 43 VAL HA A 47 LYS HGy 1.0 . 5.46 938 807 A 45 GLU HA A 48 LYS HDx 1.0 . 4.94 939 808 A 47 LYS HBy A 47 LYS HE2 1.0 . 4.86 940 808 A 47 LYS HBy A 47 LYS HE3 1.0 . 4.86 941 809 A 47 LYS HBx A 47 LYS HD2 1.0 . 3.85 942 809 A 47 LYS HBx A 47 LYS HD3 1.0 . 3.85 943 810 A 120 ALA HB% A 40 LYS HD2 1.0 . 5.01 944 810 A 120 ALA HB% A 40 LYS HD3 1.0 . 5.01 945 811 A 48 LYS HA A 48 LYS HDy 1.0 . 5.30 946 812 A 48 LYS HA A 110 ILE HD1% 1.0 . 3.51 947 813 A 47 LYS HBx A 48 LYS HA 1.0 . 5.46 948 814 A 110 ILE HB A 48 LYS HA 1.0 . 5.50 949 815 A 48 LYS HE3 A 48 LYS HBx 1.0 . 4.32 950 815 A 48 LYS HBx A 48 LYS HE2 1.0 . 4.32 951 816 A 50 LYS HA A 49 GLY HAx 1.0 . 5.50 952 817 A 99 THR HA A 49 GLY HAx 1.0 . 5.50 953 818 A 48 LYS HA A 49 GLY HAy 1.0 . 4.96 954 819 A 50 LYS HA A 49 GLY HAy 1.0 . 4.86 955 820 A 50 LYS HA A 51 VAL HG2% 1.0 . 5.50 956 821 A 51 VAL HA A 50 LYS HA 1.0 . 4.95 957 822 A 96 VAL HG1% A 111 VAL HG2% 1.0 . 4.65 958 823 A 95 LYS HBy A 51 VAL HG1% 1.0 . 5.37 959 824 A 51 VAL HA A 95 LYS HGy 1.0 . 5.17 960 825 A 51 VAL HA A 95 LYS HD2 1.0 . 5.50 961 825 A 95 LYS HD3 A 51 VAL HA 1.0 . 5.50 962 826 A 51 VAL HA A 97 TYR HB2 1.0 . 5.03 963 827 A 52 ILE HA A 50 LYS HE2 1.0 . 5.09 964 827 A 52 ILE HA A 50 LYS HE3 1.0 . 5.09 965 828 A 96 VAL HG1% A 52 ILE HB 1.0 . 5.39 966 829 A 52 ILE HG2% A 96 VAL HG1% 1.0 . 4.91 967 830 A 55 ILE HG2% A 31 VAL H 1.0 . 4.97 968 831 A 96 VAL HB A 53 GLY HAy 1.0 . 4.96 969 832 A 55 ILE HD1% A 54 ALA HA 1.0 . 5.50 970 833 A 54 ALA HB% A 95 LYS HBx 1.0 . 4.47 971 834 A 54 ALA HB% A 95 LYS HGx 1.0 . 3.56 972 835 A 96 VAL HG2% A 54 ALA HB% 1.0 . 4.21 973 836 A 82 PRO HA A 85 ILE HG2% 1.0 . 4.37 974 837 A 58 THR HA A 59 PHE HE% 1.0 . 5.48 975 838 A 58 THR HA A 59 PHE HD% 1.0 . 4.92 976 839 A 60 PHE HE% A 58 THR HB 1.0 . 4.77 977 840 A 22 ILE HD1% A 59 PHE HA 1.0 . 4.60 978 841 A 60 PHE HE% A 59 PHE HA 1.0 . 4.78 979 842 A 59 PHE HBy A 93 TYR HE% 1.0 . 4.73 980 843 A 93 TYR HE% A 59 PHE HBx 1.0 . 5.10 981 844 A 59 PHE HBx A 67 ARG HG2 1.0 . 4.97 982 844 A 59 PHE HBx A 67 ARG HG3 1.0 . 4.97 983 845 A 59 PHE HBx A 91 LEU HG 1.0 . 5.50 984 846 A 67 ARG HA A 61 VAL HB 1.0 . 4.29 985 847 A 67 ARG HA A 67 ARG HDy 1.0 . 4.63 986 848 A 61 VAL HG1% A 67 ARG HDy 1.0 . 4.89 987 849 A 61 VAL HG1% A 67 ARG HDx 1.0 . 4.89 988 850 A 127 LYS HA A 128 GLU HA 1.0 . 4.61 989 851 A 68 TRP HZ3 A 72 GLU HA 1.0 . 4.67 990 852 A 60 PHE HBx A 73 LEU HD2% 1.0 . 4.93 991 853 A 73 LEU HG A 73 LEU HA 1.0 . 4.08 992 854 A 74 LYS HGy A 74 LYS HE2 1.0 . 4.06 993 854 A 74 LYS HE3 A 74 LYS HGy 1.0 . 4.06 994 855 A 74 LYS HE2 A 74 LYS HGx 1.0 . 4.06 995 855 A 74 LYS HE3 A 74 LYS HGx 1.0 . 4.06 996 856 A 75 GLU HA A 76 PRO HDy 1.0 . 3.03 997 857 A 75 GLU HA A 76 PRO HG2 1.0 . 4.26 998 857 A 75 GLU HA A 76 PRO HG3 1.0 . 4.26 999 858 A 110 ILE HB A 110 ILE HD1% 1.0 . 3.87 1000 859 A 97 TYR HA A 51 VAL HB 1.0 . 5.14 1001 860 A 14 THR HG2% A 16 GLU HBy 1.0 . 4.93 1002 861 A 86 ARG HA A 86 ARG HGy 1.0 . 3.83 1003 862 A 86 ARG HA A 86 ARG HGx 1.0 . 3.83 1004 863 A 71 GLU HG3 A 74 LYS HD2 1.0 . 5.18 1005 863 A 74 LYS HD3 A 71 GLU HG3 1.0 . 5.18 1006 864 A 108 GLU HG2 A 40 LYS HD2 1.0 . 5.50 1007 864 A 108 GLU HG2 A 40 LYS HD3 1.0 . 5.50 1008 865 A 89 LYS HGy A 87 GLU HGx 1.0 . 4.31 1009 866 A 108 GLU HG2 A 119 ARG HG2 1.0 . 5.50 1010 867 A 88 LYS HBy A 88 LYS HDx 1.0 . 4.19 1011 868 A 88 LYS HGx A 60 PHE HBy 1.0 . 5.20 1012 869 A 61 VAL HG2% A 89 LYS HA 1.0 . 4.75 1013 870 A 89 LYS HA A 89 LYS HDy 1.0 . 4.91 1014 871 A 90 PRO HA A 91 LEU HD2% 1.0 . 5.50 1015 872 A 90 PRO HA A 91 LEU HG 1.0 . 5.50 1016 873 A 90 PRO HA A 60 PHE HBy 1.0 . 5.15 1017 874 A 60 PHE HA A 90 PRO HBx 1.0 . 5.50 1018 875 A 59 PHE HBy A 91 LEU HBx 1.0 . 4.75 1019 876 A 91 LEU HBx A 113 PHE HZ 1.0 . 5.07 1020 877 A 59 PHE HD% A 91 LEU HBx 1.0 . 5.08 1021 878 A 61 VAL HG1% A 91 LEU HBy 1.0 . 5.50 1022 879 A 61 VAL HG2% A 91 LEU HG 1.0 . 3.87 1023 880 A 93 TYR HE% A 91 LEU HG 1.0 . 5.50 1024 881 A 91 LEU HD1% A 89 LYS HB2 1.0 . 5.07 1025 881 A 89 LYS HB3 A 91 LEU HD1% 1.0 . 5.07 1026 882 A 93 TYR HE% A 91 LEU HD2% 1.0 . 5.05 1027 883 A 93 TYR HE% A 93 TYR HA 1.0 . 4.70 1028 884 A 112 GLU HGy A 94 GLY HAx 1.0 . 5.10 1029 885 A 112 GLU HGx A 94 GLY HAy 1.0 . 5.35 1030 886 A 95 LYS HA A 51 VAL HG2% 1.0 . 5.50 1031 887 A 95 LYS HA A 95 LYS HGx 1.0 . 3.79 1032 888 A 95 LYS HA A 95 LYS HE2 1.0 . 5.02 1033 888 A 95 LYS HA A 95 LYS HE3 1.0 . 5.02 1034 889 A 95 LYS HBx A 51 VAL HG2% 1.0 . 5.02 1035 890 A 95 LYS HBy A 51 VAL HG2% 1.0 . 5.37 1036 891 A 97 TYR HE% A 95 LYS HBy 1.0 . 5.03 1037 892 A 112 GLU HGy A 118 TYR HE% 1.0 . 5.50 1038 893 A 95 LYS HD2 A 95 LYS HE2 1.0 . 2.69 1039 893 A 95 LYS HD3 A 95 LYS HE2 1.0 . 2.69 1040 893 A 95 LYS HE3 A 95 LYS HD2 1.0 . 2.69 1041 893 A 95 LYS HD3 A 95 LYS HE3 1.0 . 2.69 1042 894 A 111 VAL HA A 111 VAL HG2% 1.0 . 3.62 1043 895 A 97 TYR HE% A 96 VAL HA 1.0 . 4.67 1044 896 A 52 ILE HD1% A 96 VAL HB 1.0 . 4.75 1045 897 A 54 ALA HB% A 96 VAL HB 1.0 . 5.08 1046 898 A 96 VAL HG1% A 120 ALA HB% 1.0 . 4.85 1047 899 A 96 VAL HG1% A 55 ILE HG1y 1.0 . 5.34 1048 900 A 96 VAL HG2% A 95 LYS HGy 1.0 . 4.74 1049 901 A 96 VAL HG1% A 97 TYR HA 1.0 . 4.87 1050 902 A 95 LYS HGy A 97 TYR HA 1.0 . 5.38 1051 903 A 110 ILE HB A 97 TYR HA 1.0 . 5.50 1052 904 A 110 ILE H A 98 SER HA 1.0 . 4.63 1053 905 A 98 SER HBx A 109 ILE HG2% 1.0 . 5.48 1054 906 A 98 SER HBy A 109 ILE HG2% 1.0 . 5.03 1055 907 A 120 ALA HB% A 109 ILE HA 1.0 . 5.50 1056 908 A 96 VAL HG1% A 109 ILE HA 1.0 . 4.86 1057 909 A 120 ALA HB% A 109 ILE HB 1.0 . 5.13 1058 910 A 111 VAL HB A 109 ILE HD1% 1.0 . 5.08 1059 911 A 109 ILE HG2% A 99 THR HG2% 1.0 . 4.86 1060 912 A 109 ILE HG2% A 96 VAL HG2% 1.0 . 5.38 1061 913 A 109 ILE HG2% A 109 ILE HG1x 1.0 . 4.03 1062 914 A 43 VAL HG2% A 110 ILE HA 1.0 . 4.87 1063 915 A 110 ILE HB A 111 VAL H 1.0 . 5.15 1064 916 A 110 ILE HB A 97 TYR HE% 1.0 . 5.08 1065 917 A 110 ILE HB A 117 TYR HD% 1.0 . 5.50 1066 918 A 110 ILE HD1% A 119 ARG HG2 1.0 . 3.97 1067 919 A 111 VAL HA A 111 VAL HG1% 1.0 . 3.62 1068 920 A 111 VAL HA A 37 TYR HD% 1.0 . 5.50 1069 921 A 93 TYR HD% A 111 VAL HG1% 1.0 . 5.50 1070 922 A 118 TYR HB3 A 111 VAL HG1% 1.0 . 5.14 1071 922 A 111 VAL HG1% A 118 TYR HB2 1.0 . 5.14 1072 923 A 95 LYS HGy A 51 VAL HG2% 1.0 . 4.36 1073 924 A 112 GLU HA A 118 TYR H 1.0 . 4.74 1074 925 A 110 ILE HG2% A 112 GLU HA 1.0 . 4.97 1075 926 A 114 ASN HA A 92 ARG HDx 1.0 . 4.74 1076 927 A 114 ASN HA A 92 ARG HG2 1.0 . 5.01 1077 927 A 92 ARG HG3 A 114 ASN HA 1.0 . 5.01 1078 928 A 118 TYR HD% A 116 GLU HB2 1.0 . 5.03 1079 928 A 118 TYR HD% A 116 GLU HB3 1.0 . 5.03 1080 929 A 117 TYR HA A 112 GLU HBx 1.0 . 4.83 1081 930 A 43 VAL HG1% A 117 TYR HBx 1.0 . 5.11 1082 931 A 119 ARG HA A 120 ALA HA 1.0 . 5.15 1083 932 A 120 ALA HB% A 119 ARG HDx 1.0 . 5.50 1084 933 A 108 GLU HG3 A 119 ARG HDy 1.0 . 5.11 1085 934 A 121 VAL HA A 99 THR HG2% 1.0 . 5.50 1086 935 A 121 VAL HA A 40 LYS HG2 1.0 . 5.50 1087 935 A 121 VAL HA A 40 LYS HG3 1.0 . 5.50 1088 936 A 121 VAL HA A 108 GLU HBx 1.0 . 4.88 1089 937 A 41 GLU HGx A 119 ARG HG2 1.0 . 5.50 1090 938 A 38 HIS HBx A 121 VAL HG2% 1.0 . 5.50 1091 939 A 35 GLN HBy A 122 LEU HD1% 1.0 . 5.28 1092 940 A 122 LEU HA A 37 TYR HD% 1.0 . 5.07 1093 941 A 123 ILE HA A 121 VAL HG2% 1.0 . 5.18 1094 942 A 123 ILE HA A 38 HIS HBx 1.0 . 5.50 1095 943 A 123 ILE HB A 36 LEU HG 1.0 . 4.08 1096 944 A 123 ILE HD1% A 36 LEU HG 1.0 . 3.81 1097 945 A 124 LYS HA A 124 LYS HE2 1.0 . 4.80 1098 945 A 124 LYS HA A 124 LYS HE3 1.0 . 4.80 1099 946 A 43 VAL HG2% A 47 LYS HBy 1.0 . 4.36 1100 947 A 43 VAL HG2% A 110 ILE HG2% 1.0 . 3.25 1101 948 A 110 ILE HG2% A 97 TYR HB2 1.0 . 4.76 1102 949 A 119 ARG HA A 118 TYR HA 1.0 . 4.55 1103 950 A 122 LEU HG A 107 ASP HB2 1.0 . 5.50 1104 950 A 107 ASP HB3 A 122 LEU HG 1.0 . 5.50 1105 951 A 106 LYS HA A 106 LYS HE2 1.0 . 5.21 1106 951 A 106 LYS HA A 106 LYS HE3 1.0 . 5.21 1107 952 A 11 GLU HA A 11 GLU HG3 1.0 . 3.89 1108 953 A 24 LYS HA A 24 LYS HDy 1.0 . 3.96 1109 954 A 34 ASP HA A 34 ASP HBy 1.0 . 2.97 1110 955 A 36 LEU HD1% A 36 LEU HBx 1.0 . 3.54 1111 956 A 36 LEU HD2% A 36 LEU HBx 1.0 . 3.51 1112 957 A 123 ILE HD1% A 36 LEU HBy 1.0 . 4.03 1113 958 A 41 GLU HA A 41 GLU HGx 1.0 . 3.74 1114 959 A 42 LYS HBy A 42 LYS HE2 1.0 . 4.47 1115 960 A 42 LYS HBx A 42 LYS HE3 1.0 . 4.48 1116 961 A 118 TYR HE% A 42 LYS HBy 1.0 . 4.18 1117 962 A 118 TYR HD% A 42 LYS HBy 1.0 . 4.72 1118 963 A 45 GLU HB2 A 45 GLU HGy 1.0 . 2.71 1119 963 A 45 GLU HB3 A 45 GLU HGy 1.0 . 2.71 1120 964 A 45 GLU HGx A 45 GLU HB2 1.0 . 2.71 1121 964 A 45 GLU HB3 A 45 GLU HGx 1.0 . 2.71 1122 965 A 55 ILE HG2% A 57 GLN HGy 1.0 . 4.03 1123 966 A 124 LYS HE3 A 124 LYS HG2 1.0 . 3.31 1124 966 A 124 LYS HE2 A 124 LYS HG2 1.0 . 3.31 1125 966 A 124 LYS HG3 A 124 LYS HE2 1.0 . 3.31 1126 966 A 124 LYS HE3 A 124 LYS HG3 1.0 . 3.31 1127 967 A 124 LYS HA A 124 LYS HG2 1.0 . 3.55 1128 967 A 124 LYS HA A 124 LYS HG3 1.0 . 3.55 1129 968 A 68 TRP HZ3 A 68 TRP HB3 1.0 . 4.86 1130 969 A 72 GLU HB3 A 68 TRP HB3 1.0 . 5.50 1131 970 A 73 LEU HG A 68 TRP HB3 1.0 . 5.50 1132 971 A 68 TRP HB2 A 73 LEU HD2% 1.0 . 4.36 1133 972 A 68 TRP HB3 A 73 LEU HD1% 1.0 . 4.29 1134 973 A 70 GLU HA A 70 GLU HG2 1.0 . 3.55 1135 974 A 71 GLU HA A 71 GLU HG3 1.0 . 3.41 1136 975 A 74 LYS HE3 A 74 LYS HB3 1.0 . 4.54 1137 975 A 74 LYS HB3 A 74 LYS HE2 1.0 . 4.54 1138 976 A 75 GLU HB3 A 76 PRO HDx 1.0 . 4.27 1139 977 A 75 GLU HB3 A 76 PRO HDy 1.0 . 4.27 1140 978 A 76 PRO HDy A 75 GLU HGy 1.0 . 5.09 1141 979 A 75 GLU HGx A 76 PRO HDx 1.0 . 5.09 1142 980 A 72 GLU HA A 75 GLU HGx 1.0 . 4.18 1143 981 A 75 GLU HA A 75 GLU HGy 1.0 . 3.58 1144 982 A 75 GLU HA A 76 PRO HDx 1.0 . 3.03 1145 983 A 75 GLU HGx A 76 PRO HDy 1.0 . 5.09 1146 984 A 88 LYS HA A 87 GLU HGx 1.0 . 5.10 1147 985 A 88 LYS HBy A 88 LYS HDy 1.0 . 4.19 1148 986 A 88 LYS HBx A 88 LYS HDy 1.0 . 4.09 1149 987 A 60 PHE HD% A 90 PRO HG2 1.0 . 5.15 1150 988 A 114 ASN HA A 92 ARG HDy 1.0 . 4.74 1151 989 A 92 ARG HDy A 92 ARG HB2 1.0 . 3.38 1152 989 A 92 ARG HB3 A 92 ARG HDy 1.0 . 3.38 1153 990 A 101 GLU HA A 101 GLU HG2 1.0 . 3.83 1154 991 A 106 LYS HE3 A 106 LYS HBx 1.0 . 4.60 1155 991 A 106 LYS HBx A 106 LYS HE2 1.0 . 4.60 1156 992 A 106 LYS HG2 A 106 LYS HE2 1.0 . 3.51 1157 992 A 106 LYS HE3 A 106 LYS HG2 1.0 . 3.51 1158 993 A 108 GLU HA A 108 GLU HG3 1.0 . 3.80 1159 994 A 109 ILE HG2% A 108 GLU HBx 1.0 . 5.23 1160 995 A 99 THR HG2% A 108 GLU HG3 1.0 . 4.99 1161 996 A 108 GLU HG3 A 121 VAL HG2% 1.0 . 4.26 1162 997 A 108 GLU HG3 A 121 VAL HG1% 1.0 . 4.26 1163 998 A 108 GLU HBy A 121 VAL HG1% 1.0 . 5.50 1164 999 A 108 GLU HBy A 121 VAL HG2% 1.0 . 5.50 1165 1000 A 108 GLU HBy A 99 THR HG2% 1.0 . 3.76 1166 1001 A 115 ARG HD3 A 115 ARG HB2 1.0 . 3.60 1167 1001 A 115 ARG HB2 A 115 ARG HD2 1.0 . 3.60 1168 1002 A 119 ARG HDy A 110 ILE HG1y 1.0 . 5.37 1169 1003 A 119 ARG HDy A 121 VAL HG2% 1.0 . 5.50 1170 1004 A 119 ARG HBx A 119 ARG HDy 1.0 . 3.76 1171 1005 A 122 LEU HB3 A 122 LEU HD1% 1.0 . 3.37 1172 1006 A 122 LEU HB3 A 122 LEU HD2% 1.0 . 3.37 1173 1007 A 122 LEU HB3 A 107 ASP HB2 1.0 . 3.89 1174 1007 A 107 ASP HB3 A 122 LEU HB3 1.0 . 3.89 1175 1008 A 126 GLU HGx A 126 GLU HA 1.0 . 3.79 1176 1009 A 109 ILE HD1% A 32 TYR HB3 1.0 . 4.67 1177 1010 A 55 ILE HD1% A 32 TYR HB3 1.0 . 5.31 1178 1011 A 67 ARG HA A 61 VAL HA 1.0 . 3.32 1179 1012 A 6 PHE HA A 7 THR H 1.0 . 3.21 1180 1013 A 7 THR HA A 8 ASP H 1.0 . 2.76 1181 1014 A 126 GLU HA A 127 LYS H 1.0 . 3.18 1182 1015 A 8 ASP HA A 9 ASP H 1.0 . 2.94 1183 1016 A 12 ASN H A 13 ASP H 1.0 . 3.36 1184 1017 A 10 ASN H A 10 ASN HBy 1.0 . 3.74 1185 1018 A 12 ASN H A 12 ASN HBy 1.0 . 3.92 1186 1019 A 11 GLU H A 11 GLU HG2 1.0 . 4.37 1187 1020 A 11 GLU H A 10 ASN HBx 1.0 . 4.33 1188 1021 A 11 GLU H A 10 ASN HA 1.0 . 3.13 1189 1022 A 11 GLU H A 10 ASN HBy 1.0 . 4.33 1190 1023 A 10 ASN H A 9 ASP HA 1.0 . 3.07 1191 1024 A 57 GLN HA A 58 THR H 1.0 . 3.15 1192 1025 A 12 ASN H A 11 GLU HG2 1.0 . 5.50 1193 1026 A 12 ASN H A 11 GLU HG3 1.0 . 5.50 1194 1027 A 12 ASN H A 11 GLU HBy 1.0 . 4.61 1195 1028 A 12 ASN H A 11 GLU HBx 1.0 . 4.61 1196 1029 A 13 ASP H A 12 ASN HA 1.0 . 3.08 1197 1030 A 13 ASP HA A 14 THR H 1.0 . 2.85 1198 1031 A 14 THR HB A 14 THR H 1.0 . 3.50 1199 1032 A 15 SER H A 15 SER HB2 1.0 . 3.25 1200 1032 A 15 SER HB3 A 15 SER H 1.0 . 3.25 1201 1033 A 14 THR HB A 15 SER H 1.0 . 4.01 1202 1034 A 16 GLU H A 15 SER HB2 1.0 . 4.11 1203 1034 A 15 SER HB3 A 16 GLU H 1.0 . 4.11 1204 1035 A 4 MET H A 4 MET HB2 1.0 . 3.57 1205 1035 A 4 MET H A 4 MET HB3 1.0 . 3.57 1206 1036 A 16 GLU HA A 17 THR H 1.0 . 3.47 1207 1037 A 17 THR HB A 18 MET H 1.0 . 3.89 1208 1038 A 17 THR HA A 18 MET H 1.0 . 3.52 1209 1039 A 21 LEU HG A 18 MET H 1.0 . 4.64 1210 1040 A 18 MET HE1 A 18 MET H 1.0 . 4.36 1211 1041 A 18 MET H A 31 VAL HG1% 1.0 . 4.20 1212 1042 A 18 MET H A 19 GLU H 1.0 . 3.76 1213 1043 A 17 THR HB A 19 GLU H 1.0 . 4.70 1214 1044 A 17 THR HA A 19 GLU H 1.0 . 4.71 1215 1045 A 19 GLU H A 19 GLU HGy 1.0 . 3.88 1216 1046 A 19 GLU H A 19 GLU HBx 1.0 . 3.70 1217 1047 A 19 GLU H A 18 MET HBx 1.0 . 4.03 1218 1048 A 17 THR HB A 20 SER H 1.0 . 4.91 1219 1049 A 20 SER H A 20 SER HBy 1.0 . 4.11 1220 1050 A 20 SER H A 20 SER HBx 1.0 . 4.11 1221 1051 A 21 LEU HG A 20 SER H 1.0 . 4.67 1222 1052 A 18 MET HA A 21 LEU H 1.0 . 4.10 1223 1053 A 21 LEU H A 16 GLU HG2 1.0 . 4.52 1224 1053 A 16 GLU HG3 A 21 LEU H 1.0 . 4.52 1225 1054 A 22 ILE HB A 21 LEU H 1.0 . 4.99 1226 1055 A 21 LEU HG A 22 ILE H 1.0 . 4.19 1227 1056 A 22 ILE HG1y A 22 ILE H 1.0 . 4.03 1228 1057 A 20 SER HA A 23 ASP H 1.0 . 3.97 1229 1058 A 24 LYS HBx A 23 ASP H 1.0 . 5.50 1230 1059 A 22 ILE HG1x A 23 ASP H 1.0 . 4.28 1231 1060 A 22 ILE HD1% A 23 ASP H 1.0 . 4.46 1232 1061 A 20 SER HA A 24 LYS H 1.0 . 4.62 1233 1062 A 24 LYS HG2 A 25 GLY H 1.0 . 4.41 1234 1063 A 24 LYS HG2 A 26 LYS H 1.0 . 4.26 1235 1064 A 27 LEU H A 27 LEU HB2 1.0 . 3.15 1236 1065 A 26 LYS HA A 27 LEU H 1.0 . 3.25 1237 1066 A 26 LYS HA A 28 ASP H 1.0 . 3.76 1238 1067 A 28 ASP H A 26 LYS HB2 1.0 . 3.80 1239 1067 A 26 LYS HB3 A 28 ASP H 1.0 . 3.80 1240 1068 A 29 GLN HGy A 29 GLN H 1.0 . 3.66 1241 1069 A 29 GLN HB3 A 29 GLN H 1.0 . 3.69 1242 1070 A 29 GLN H A 26 LYS HB2 1.0 . 3.90 1243 1070 A 26 LYS HB3 A 29 GLN H 1.0 . 3.90 1244 1071 A 21 LEU HD1% A 29 GLN H 1.0 . 4.58 1245 1072 A 29 GLN HGy A 30 VAL H 1.0 . 4.69 1246 1073 A 37 TYR HD% A 30 VAL H 1.0 . 5.08 1247 1074 A 30 VAL H A 29 GLN HE21 1.0 . 5.32 1248 1075 A 30 VAL H A 39 LEU H 1.0 . 4.64 1249 1076 A 21 LEU HD1% A 31 VAL H 1.0 . 3.64 1250 1077 A 31 VAL HA A 32 TYR H 1.0 . 3.34 1251 1078 A 36 LEU HA A 32 TYR H 1.0 . 4.27 1252 1079 A 32 TYR H A 31 VAL HG1% 1.0 . 4.21 1253 1080 A 36 LEU HD1% A 32 TYR H 1.0 . 4.84 1254 1081 A 32 TYR HA A 33 ASP H 1.0 . 3.34 1255 1082 A 34 ASP HA A 33 ASP H 1.0 . 5.10 1256 1083 A 32 TYR HB2 A 33 ASP H 1.0 . 4.22 1257 1084 A 32 TYR HA A 34 ASP H 1.0 . 4.22 1258 1085 A 33 ASP HA A 34 ASP H 1.0 . 3.50 1259 1086 A 34 ASP HBx A 34 ASP H 1.0 . 4.04 1260 1087 A 31 VAL HA A 35 GLN H 1.0 . 4.55 1261 1088 A 34 ASP HBx A 35 GLN H 1.0 . 4.23 1262 1089 A 35 GLN H A 31 VAL HG1% 1.0 . 4.93 1263 1090 A 36 LEU HBx A 36 LEU H 1.0 . 3.47 1264 1091 A 36 LEU HD1% A 36 LEU H 1.0 . 4.36 1265 1092 A 36 LEU HD2% A 36 LEU H 1.0 . 5.13 1266 1093 A 123 ILE HG2% A 126 GLU H 1.0 . 5.50 1267 1094 A 35 GLN HBy A 36 LEU H 1.0 . 3.81 1268 1095 A 126 GLU H A 126 GLU HBy 1.0 . 3.88 1269 1096 A 35 GLN HGx A 36 LEU H 1.0 . 4.70 1270 1097 A 126 GLU H A 126 GLU HBx 1.0 . 3.88 1271 1098 A 123 ILE HA A 126 GLU H 1.0 . 4.35 1272 1099 A 35 GLN HA A 36 LEU H 1.0 . 3.36 1273 1100 A 36 LEU H A 35 GLN HE21 1.0 . 4.34 1274 1101 A 31 VAL HA A 37 TYR H 1.0 . 4.19 1275 1102 A 120 ALA HA A 38 HIS H 1.0 . 4.45 1276 1103 A 38 HIS HBy A 38 HIS H 1.0 . 4.16 1277 1104 A 38 HIS H A 38 HIS HD2 1.0 . 5.12 1278 1105 A 39 LEU H A 38 HIS H 1.0 . 4.62 1279 1106 A 29 GLN HE21 A 39 LEU H 1.0 . 5.50 1280 1107 A 38 HIS HBy A 39 LEU H 1.0 . 4.62 1281 1108 A 39 LEU H A 40 LYS HG2 1.0 . 5.25 1282 1108 A 40 LYS HG3 A 39 LEU H 1.0 . 5.25 1283 1109 A 39 LEU H A 29 GLN HB2 1.0 . 4.74 1284 1110 A 120 ALA HA A 40 LYS H 1.0 . 4.08 1285 1111 A 39 LEU HBy A 40 LYS H 1.0 . 4.36 1286 1112 A 120 ALA HB% A 40 LYS H 1.0 . 4.74 1287 1113 A 41 GLU H A 119 ARG H 1.0 . 4.19 1288 1114 A 41 GLU H A 40 LYS HBy 1.0 . 3.42 1289 1115 A 41 GLU H A 40 LYS HBx 1.0 . 3.42 1290 1116 A 42 LYS HBy A 42 LYS H 1.0 . 3.50 1291 1117 A 42 LYS HGx A 42 LYS H 1.0 . 4.59 1292 1118 A 41 GLU HBx A 42 LYS H 1.0 . 3.67 1293 1119 A 42 LYS HGy A 42 LYS H 1.0 . 4.93 1294 1120 A 42 LYS HA A 43 VAL H 1.0 . 3.27 1295 1121 A 42 LYS H A 43 VAL H 1.0 . 4.65 1296 1122 A 119 ARG H A 43 VAL H 1.0 . 4.13 1297 1123 A 117 TYR HBx A 117 TYR H 1.0 . 3.68 1298 1124 A 116 GLU HA A 117 TYR H 1.0 . 3.22 1299 1125 A 43 VAL H A 42 LYS HD2 1.0 . 3.91 1300 1125 A 42 LYS HD3 A 43 VAL H 1.0 . 3.91 1301 1126 A 117 TYR H A 42 LYS HD2 1.0 . 4.45 1302 1126 A 42 LYS HD3 A 117 TYR H 1.0 . 4.45 1303 1127 A 110 ILE HG2% A 43 VAL H 1.0 . 4.14 1304 1128 A 44 ASP H A 45 GLU H 1.0 . 4.60 1305 1129 A 43 VAL HA A 44 ASP H 1.0 . 3.00 1306 1130 A 47 LYS HBy A 44 ASP H 1.0 . 4.26 1307 1131 A 44 ASP H A 47 LYS HD2 1.0 . 3.97 1308 1131 A 47 LYS HD3 A 44 ASP H 1.0 . 3.97 1309 1132 A 47 LYS HBx A 44 ASP H 1.0 . 4.52 1310 1133 A 43 VAL HG1% A 44 ASP H 1.0 . 3.93 1311 1134 A 44 ASP HA A 45 GLU H 1.0 . 2.98 1312 1135 A 44 ASP HA A 46 ASP H 1.0 . 4.06 1313 1136 A 46 ASP H A 46 ASP HBy 1.0 . 3.60 1314 1137 A 44 ASP HBy A 46 ASP H 1.0 . 4.00 1315 1138 A 46 ASP H A 45 GLU HB2 1.0 . 3.85 1316 1138 A 45 GLU HB3 A 46 ASP H 1.0 . 3.85 1317 1139 A 47 LYS HGy A 46 ASP H 1.0 . 5.06 1318 1140 A 47 LYS HGx A 46 ASP H 1.0 . 4.18 1319 1141 A 47 LYS H A 46 ASP HBy 1.0 . 4.28 1320 1142 A 47 LYS HGy A 47 LYS H 1.0 . 3.82 1321 1143 A 47 LYS HBy A 48 LYS H 1.0 . 4.53 1322 1144 A 47 LYS HBx A 48 LYS H 1.0 . 4.22 1323 1145 A 48 LYS H A 48 LYS HDy 1.0 . 4.90 1324 1146 A 97 TYR HD% A 50 LYS H 1.0 . 4.28 1325 1147 A 97 TYR HB2 A 50 LYS H 1.0 . 4.83 1326 1148 A 50 LYS HGy A 51 VAL H 1.0 . 4.55 1327 1149 A 97 TYR HA A 52 ILE H 1.0 . 4.29 1328 1150 A 97 TYR HA A 53 GLY H 1.0 . 4.18 1329 1151 A 51 VAL HA A 53 GLY H 1.0 . 3.82 1330 1152 A 52 ILE HB A 53 GLY H 1.0 . 4.25 1331 1153 A 52 ILE HD1% A 53 GLY H 1.0 . 4.25 1332 1154 A 54 ALA H A 55 ILE H 1.0 . 4.52 1333 1155 A 54 ALA H A 96 VAL H 1.0 . 4.27 1334 1156 A 53 GLY HAy A 54 ALA H 1.0 . 3.38 1335 1157 A 53 GLY HAx A 54 ALA H 1.0 . 3.36 1336 1158 A 94 GLY HAx A 56 GLY H 1.0 . 5.17 1337 1159 A 95 LYS HA A 56 GLY H 1.0 . 4.99 1338 1160 A 58 THR H A 57 GLN H 1.0 . 4.55 1339 1161 A 57 GLN HGx A 57 GLN H 1.0 . 4.58 1340 1162 A 55 ILE HB A 57 GLN H 1.0 . 4.40 1341 1163 A 57 GLN H A 57 GLN HB2 1.0 . 3.93 1342 1164 A 57 GLN HGy A 58 THR H 1.0 . 4.34 1343 1165 A 58 THR H A 57 GLN HB3 1.0 . 3.87 1344 1166 A 58 THR HG2% A 58 THR H 1.0 . 4.11 1345 1167 A 58 THR HA A 59 PHE H 1.0 . 3.57 1346 1168 A 92 ARG HA A 59 PHE H 1.0 . 4.23 1347 1169 A 91 LEU HBx A 59 PHE H 1.0 . 4.62 1348 1170 A 59 PHE HBx A 60 PHE H 1.0 . 4.06 1349 1171 A 60 PHE HA A 61 VAL H 1.0 . 3.55 1350 1172 A 63 GLY H A 62 ASP HBx 1.0 . 4.25 1351 1173 A 87 GLU HBy A 63 GLY H 1.0 . 4.92 1352 1174 A 64 ASP H A 66 LYS HB2 1.0 . 4.53 1353 1174 A 66 LYS HB3 A 64 ASP H 1.0 . 4.53 1354 1175 A 64 ASP HBy A 65 GLY H 1.0 . 4.45 1355 1176 A 65 GLY H A 66 LYS HB2 1.0 . 4.36 1356 1176 A 66 LYS HB3 A 65 GLY H 1.0 . 4.36 1357 1177 A 66 LYS H A 66 LYS HB2 1.0 . 3.15 1358 1177 A 66 LYS HB3 A 66 LYS H 1.0 . 3.15 1359 1178 A 66 LYS H A 64 ASP HA 1.0 . 5.50 1360 1179 A 67 ARG HA A 66 LYS H 1.0 . 5.50 1361 1180 A 66 LYS H A 67 ARG H 1.0 . 4.50 1362 1181 A 68 TRP HD1 A 66 LYS H 1.0 . 5.14 1363 1182 A 67 ARG H A 67 ARG HG2 1.0 . 4.18 1364 1182 A 67 ARG HG3 A 67 ARG H 1.0 . 4.18 1365 1183 A 67 ARG H A 67 ARG HBy 1.0 . 3.76 1366 1184 A 61 VAL HB A 68 TRP H 1.0 . 5.31 1367 1185 A 68 TRP H A 73 LEU HD2% 1.0 . 5.13 1368 1186 A 68 TRP H A 73 LEU HD1% 1.0 . 5.13 1369 1187 A 69 SER H A 72 GLU H 1.0 . 4.51 1370 1188 A 68 TRP HA A 69 SER H 1.0 . 3.53 1371 1189 A 69 SER H A 72 GLU HB2 1.0 . 4.18 1372 1190 A 69 SER HA A 70 GLU H 1.0 . 3.55 1373 1191 A 70 GLU H A 70 GLU HG3 1.0 . 3.88 1374 1192 A 28 ASP H A 27 LEU HB2 1.0 . 3.92 1375 1193 A 69 SER HA A 71 GLU H 1.0 . 4.48 1376 1194 A 72 GLU H A 69 SER HA 1.0 . 4.73 1377 1195 A 72 GLU HB3 A 73 LEU H 1.0 . 4.38 1378 1196 A 73 LEU H A 73 LEU HBy 1.0 . 3.81 1379 1197 A 74 LYS H A 75 GLU HGy 1.0 . 5.18 1380 1198 A 74 LYS H A 74 LYS HGy 1.0 . 4.49 1381 1199 A 74 LYS H A 73 LEU HD2% 1.0 . 4.95 1382 1200 A 75 GLU H A 75 GLU HB3 1.0 . 3.78 1383 1201 A 75 GLU H A 74 LYS HD2 1.0 . 4.63 1384 1201 A 74 LYS HD3 A 75 GLU H 1.0 . 4.63 1385 1202 A 77 TYR H A 77 TYR HBx 1.0 . 3.76 1386 1203 A 77 TYR H A 76 PRO HBx 1.0 . 4.21 1387 1204 A 77 TYR H A 78 ILE H 1.0 . 4.64 1388 1205 A 78 ILE H A 77 TYR HBx 1.0 . 3.99 1389 1206 A 78 ILE HB A 78 ILE H 1.0 . 4.05 1390 1207 A 79 SER H A 79 SER HBx 1.0 . 3.99 1391 1208 A 78 ILE HA A 79 SER H 1.0 . 2.96 1392 1209 A 79 SER H A 79 SER HBy 1.0 . 3.99 1393 1210 A 125 ASN H A 125 ASN HBx 1.0 . 3.65 1394 1211 A 125 ASN H A 124 LYS HBy 1.0 . 4.34 1395 1211 A 124 LYS HBx A 125 ASN H 1.0 . 4.34 1396 1212 A 78 ILE HD1% A 79 SER H 1.0 . 4.72 1397 1213 A 80 ASN H A 79 SER HBy 1.0 . 4.32 1398 1214 A 81 ASN H A 81 ASN HBx 1.0 . 3.93 1399 1215 A 81 ASN H A 80 ASN HB2 1.0 . 5.40 1400 1216 A 81 ASN H A 80 ASN HB3 1.0 . 5.40 1401 1217 A 81 ASN HA A 83 ASP H 1.0 . 4.17 1402 1218 A 84 GLU HA A 83 ASP H 1.0 . 5.13 1403 1219 A 82 PRO HBy A 83 ASP H 1.0 . 4.03 1404 1220 A 83 ASP HBy A 84 GLU H 1.0 . 3.93 1405 1221 A 85 ILE H A 84 GLU HG2 1.0 . 4.92 1406 1221 A 84 GLU HG3 A 85 ILE H 1.0 . 4.92 1407 1222 A 85 ILE H A 85 ILE HB 1.0 . 3.67 1408 1223 A 83 ASP H A 85 ILE H 1.0 . 4.32 1409 1224 A 85 ILE HB A 86 ARG H 1.0 . 3.79 1410 1225 A 85 ILE HG2% A 86 ARG H 1.0 . 3.86 1411 1226 A 62 ASP HA A 87 GLU H 1.0 . 4.58 1412 1227 A 87 GLU HA A 88 LYS H 1.0 . 3.07 1413 1228 A 87 GLU HGx A 88 LYS H 1.0 . 4.26 1414 1229 A 90 PRO HDy A 89 LYS H 1.0 . 4.72 1415 1230 A 89 LYS H A 89 LYS HDx 1.0 . 4.94 1416 1231 A 89 LYS HGx A 89 LYS H 1.0 . 4.27 1417 1232 A 88 LYS HBy A 89 LYS H 1.0 . 4.76 1418 1233 A 60 PHE HA A 91 LEU H 1.0 . 4.37 1419 1234 A 91 LEU HBy A 91 LEU H 1.0 . 4.10 1420 1235 A 91 LEU H A 90 PRO HBx 1.0 . 4.15 1421 1236 A 58 THR HG2% A 91 LEU H 1.0 . 4.09 1422 1237 A 92 ARG H A 114 ASN H 1.0 . 4.36 1423 1238 A 92 ARG H A 114 ASN HD22 1.0 . 4.39 1424 1239 A 91 LEU HBy A 92 ARG H 1.0 . 4.45 1425 1240 A 59 PHE H A 93 TYR H 1.0 . 5.16 1426 1241 A 58 THR H A 93 TYR H 1.0 . 5.11 1427 1242 A 58 THR HA A 93 TYR H 1.0 . 3.92 1428 1243 A 93 TYR H A 92 ARG HG2 1.0 . 4.43 1429 1243 A 92 ARG HG3 A 93 TYR H 1.0 . 4.43 1430 1244 A 93 TYR H A 94 GLY H 1.0 . 4.74 1431 1245 A 95 LYS HGx A 95 LYS H 1.0 . 4.43 1432 1246 A 54 ALA HA A 96 VAL H 1.0 . 3.67 1433 1247 A 95 LYS HBx A 96 VAL H 1.0 . 3.87 1434 1248 A 54 ALA HB% A 96 VAL H 1.0 . 3.80 1435 1249 A 95 LYS HGx A 96 VAL H 1.0 . 4.04 1436 1250 A 110 ILE H A 97 TYR H 1.0 . 4.39 1437 1251 A 97 TYR HE% A 97 TYR H 1.0 . 4.63 1438 1252 A 52 ILE HD1% A 97 TYR H 1.0 . 4.90 1439 1253 A 110 ILE HG2% A 97 TYR H 1.0 . 5.41 1440 1254 A 98 SER HBy A 98 SER H 1.0 . 4.13 1441 1255 A 98 SER HBx A 98 SER H 1.0 . 4.02 1442 1256 A 98 SER H A 99 THR H 1.0 . 4.58 1443 1257 A 99 THR H A 100 ASN H 1.0 . 4.64 1444 1258 A 98 SER HA A 99 THR H 1.0 . 3.46 1445 1259 A 109 ILE HA A 99 THR H 1.0 . 4.14 1446 1260 A 98 SER HBy A 99 THR H 1.0 . 3.90 1447 1261 A 98 SER HBx A 99 THR H 1.0 . 4.21 1448 1262 A 52 ILE HD1% A 99 THR H 1.0 . 4.80 1449 1263 A 110 ILE HD1% A 99 THR H 1.0 . 5.12 1450 1264 A 99 THR HA A 100 ASN H 1.0 . 3.55 1451 1265 A 99 THR HB A 100 ASN H 1.0 . 4.09 1452 1266 A 10 ASN H A 10 ASN HBx 1.0 . 3.74 1453 1267 A 99 THR HG2% A 100 ASN H 1.0 . 4.33 1454 1268 A 11 GLU HA A 12 ASN H 1.0 . 3.07 1455 1269 A 100 ASN H A 101 GLU H 1.0 . 4.39 1456 1270 A 100 ASN HA A 101 GLU H 1.0 . 3.53 1457 1271 A 101 GLU H A 101 GLU HG2 1.0 . 5.10 1458 1272 A 101 GLU H A 101 GLU HG3 1.0 . 5.10 1459 1273 A 102 ASP H A 101 GLU HG2 1.0 . 5.50 1460 1274 A 102 ASP H A 101 GLU HG3 1.0 . 5.50 1461 1275 A 102 ASP HA A 103 SER H 1.0 . 3.20 1462 1276 A 103 SER H A 103 SER HB3 1.0 . 4.11 1463 1277 A 103 SER H A 102 ASP HBy 1.0 . 4.66 1464 1278 A 103 SER H A 102 ASP HBx 1.0 . 4.66 1465 1279 A 103 SER HA A 104 ASP H 1.0 . 3.12 1466 1280 A 104 ASP H A 103 SER HB2 1.0 . 4.18 1467 1281 A 104 ASP H A 103 SER HB3 1.0 . 4.18 1468 1282 A 104 ASP H A 104 ASP HBy 1.0 . 3.66 1469 1283 A 104 ASP H A 104 ASP HBx 1.0 . 3.66 1470 1284 A 104 ASP HA A 105 ALA H 1.0 . 3.47 1471 1285 A 105 ALA H A 103 SER HB2 1.0 . 4.40 1472 1286 A 105 ALA H A 104 ASP HBx 1.0 . 4.66 1473 1287 A 106 LYS H A 107 ASP H 1.0 . 3.54 1474 1288 A 108 GLU HA A 107 ASP H 1.0 . 5.24 1475 1289 A 107 ASP H A 105 ALA HA 1.0 . 4.65 1476 1290 A 108 GLU HBx A 107 ASP H 1.0 . 4.11 1477 1291 A 109 ILE H A 108 GLU H 1.0 . 4.46 1478 1292 A 22 ILE H A 24 LYS H 1.0 . 4.32 1479 1293 A 108 GLU H A 107 ASP HB2 1.0 . 4.07 1480 1293 A 107 ASP HB3 A 108 GLU H 1.0 . 4.07 1481 1294 A 108 GLU HG2 A 108 GLU H 1.0 . 4.88 1482 1295 A 24 LYS HG3 A 24 LYS H 1.0 . 3.87 1483 1296 A 99 THR HG2% A 108 GLU H 1.0 . 5.04 1484 1297 A 108 GLU H A 122 LEU H 1.0 . 5.07 1485 1298 A 121 VAL HA A 109 ILE H 1.0 . 4.15 1486 1299 A 110 ILE H A 109 ILE HB 1.0 . 3.67 1487 1300 A 112 GLU H A 95 LYS H 1.0 . 5.06 1488 1301 A 97 TYR HD% A 112 GLU H 1.0 . 4.45 1489 1302 A 112 GLU HBy A 112 GLU H 1.0 . 3.97 1490 1303 A 114 ASN H A 93 TYR H 1.0 . 5.21 1491 1304 A 118 TYR HE% A 113 PHE H 1.0 . 4.12 1492 1305 A 117 TYR HD% A 113 PHE H 1.0 . 4.99 1493 1306 A 117 TYR HA A 113 PHE H 1.0 . 4.20 1494 1307 A 113 PHE HBy A 113 PHE H 1.0 . 3.85 1495 1308 A 113 PHE H A 116 GLU H 1.0 . 3.73 1496 1309 A 118 TYR HE% A 116 GLU H 1.0 . 4.09 1497 1310 A 114 ASN HA A 116 GLU H 1.0 . 4.73 1498 1311 A 113 PHE HBx A 116 GLU H 1.0 . 5.03 1499 1312 A 117 TYR HA A 118 TYR H 1.0 . 3.49 1500 1313 A 117 TYR HD% A 118 TYR H 1.0 . 4.47 1501 1314 A 118 TYR H A 119 ARG H 1.0 . 4.43 1502 1315 A 118 TYR HD% A 119 ARG H 1.0 . 4.61 1503 1316 A 42 LYS HA A 119 ARG H 1.0 . 3.90 1504 1317 A 110 ILE H A 120 ALA H 1.0 . 4.70 1505 1318 A 120 ALA H A 119 ARG HG2 1.0 . 4.20 1506 1319 A 108 GLU HA A 122 LEU H 1.0 . 4.47 1507 1320 A 108 GLU HG3 A 122 LEU H 1.0 . 4.13 1508 1321 A 122 LEU H A 122 LEU HB2 1.0 . 4.06 1509 1322 A 122 LEU H A 122 LEU HB3 1.0 . 4.06 1510 1323 A 122 LEU HG A 122 LEU H 1.0 . 4.72 1511 1324 A 122 LEU H A 122 LEU HD2% 1.0 . 4.36 1512 1325 A 37 TYR HA A 123 ILE H 1.0 . 4.05 1513 1326 A 123 ILE HD1% A 123 ILE H 1.0 . 4.01 1514 1327 A 122 LEU HG A 124 LYS H 1.0 . 4.60 1515 1328 A 123 ILE HD1% A 124 LYS H 1.0 . 4.25 1516 1329 A 123 ILE HG1y A 124 LYS H 1.0 . 4.92 1517 1330 A 126 GLU H A 125 ASN HBy 1.0 . 3.95 1518 1331 A 127 LYS H A 126 GLU HBx 1.0 . 4.34 1519 1332 A 11 GLU HA A 13 ASP H 1.0 . 5.47 1520 1333 A 7 THR HA A 7 THR HG2% 1.0 . 3.72 1521 1334 A 8 ASP H A 7 THR HB 1.0 . 3.82 1522 1335 A 14 THR HB A 36 LEU HBx 1.0 . 3.94 1523 1336 A 9 ASP H A 8 ASP HBy 1.0 . 4.14 1524 1337 A 12 ASN H A 12 ASN HBx 1.0 . 3.92 1525 1338 A 14 THR HA A 13 ASP HA 1.0 . 4.39 1526 1339 A 36 LEU HD1% A 14 THR HG2% 1.0 . 3.42 1527 1340 A 15 SER HA A 16 GLU HBx 1.0 . 5.01 1528 1341 A 31 VAL HG1% A 16 GLU HG2 1.0 . 4.43 1529 1341 A 16 GLU HG3 A 31 VAL HG1% 1.0 . 4.43 1530 1342 A 17 THR HG2% A 18 MET HGy 1.0 . 5.45 1531 1343 A 105 ALA HB% A 107 ASP HB2 1.0 . 3.83 1532 1343 A 107 ASP HB3 A 105 ALA HB% 1.0 . 3.83 1533 1344 A 104 ASP HA A 105 ALA HB% 1.0 . 4.72 1534 1345 A 43 VAL HG2% A 117 TYR HBx 1.0 . 3.69 1535 1346 A 43 VAL HG2% A 117 TYR HA 1.0 . 4.62 1536 1347 A 43 VAL HG2% A 117 TYR HBy 1.0 . 3.68 1537 1348 A 61 VAL HG2% A 60 PHE HA 1.0 . 4.12 1538 1349 A 61 VAL HG2% A 89 LYS HB2 1.0 . 3.09 1539 1349 A 61 VAL HG2% A 89 LYS HB3 1.0 . 3.09 1540 1350 A 61 VAL HG2% A 65 GLY HAx 1.0 . 3.89 1541 1351 A 61 VAL HG2% A 65 GLY HAy 1.0 . 4.74 1542 1352 A 61 VAL HG2% A 89 LYS HDy 1.0 . 3.95 1543 1353 A 110 ILE HG2% A 118 TYR HB2 1.0 . 4.17 1544 1353 A 110 ILE HG2% A 118 TYR HB3 1.0 . 4.17 1545 1354 A 110 ILE HG2% A 119 ARG HG3 1.0 . 3.97 1546 1354 A 110 ILE HG2% A 119 ARG HG2 1.0 . 3.97 1547 1355 A 52 ILE HG2% A 52 ILE H 1.0 . 3.85 1548 1356 A 52 ILE HG2% A 52 ILE HD1% 1.0 . 3.11 1549 1357 A 52 ILE HG2% A 50 LYS HGy 1.0 . 4.08 1550 1358 A 22 ILE HA A 22 ILE HG1x 1.0 . 3.50 1551 1359 A 55 ILE HG2% A 93 TYR HBy 1.0 . 3.87 1552 1360 A 55 ILE HG2% A 93 TYR HBx 1.0 . 3.79 1553 1361 A 55 ILE HG2% A 18 MET HGy 1.0 . 4.14 1554 1362 A 55 ILE HG2% A 18 MET HGx 1.0 . 3.84 1555 1363 A 55 ILE HG1x A 55 ILE HG2% 1.0 . 3.50 1556 1364 A 55 ILE HG2% A 55 ILE HD1% 1.0 . 3.10 1557 1365 A 22 ILE HG2% A 61 VAL HB 1.0 . 4.27 1558 1366 A 22 ILE HG2% A 61 VAL HG1% 1.0 . 3.32 1559 1367 A 78 ILE HG2% A 79 SER H 1.0 . 4.10 1560 1368 A 109 ILE HG2% A 109 ILE HA 1.0 . 3.71 1561 1369 A 105 ALA H A 103 SER HB3 1.0 . 4.40 1562 1370 A 123 ILE HG2% A 123 ILE HD1% 1.0 . 2.98 1563 1371 A 80 ASN H A 79 SER HBx 1.0 . 4.32 1564 1372 A 123 ILE HG2% A 38 HIS HBy 1.0 . 4.28 1565 1373 A 51 VAL HA A 51 VAL HG2% 1.0 . 3.55 1566 1374 A 3 THR HA A 3 THR HG2% 1.0 . 3.80 1567 1375 A 18 MET HE1 A 31 VAL H 1.0 . 3.87 1568 1376 A 18 MET HE1 A 18 MET HGy 1.0 . 3.75 1569 1377 A 18 MET HE1 A 30 VAL HB 1.0 . 3.53 1570 1378 A 85 ILE HA A 85 ILE HG1x 1.0 . 3.85 1571 1379 A 93 TYR HD% A 18 MET HE1 1.0 . 3.95 1572 1380 A 18 MET HE1 A 93 TYR HE% 1.0 . 3.60 1573 1381 A 18 MET HE1 A 30 VAL HA 1.0 . 3.61 1574 1382 A 18 MET HE1 A 18 MET HGx 1.0 . 3.61 1575 1383 A 18 MET HE1 A 30 VAL HG2% 1.0 . 4.46 1576 1384 A 22 ILE HD1% A 18 MET HE1 1.0 . 3.65 1577 1385 A 55 ILE HD1% A 31 VAL H 1.0 . 3.91 1578 1386 A 111 VAL HA A 55 ILE HD1% 1.0 . 4.19 1579 1387 A 55 ILE HD1% A 32 TYR HB2 1.0 . 4.14 1580 1388 A 85 ILE HD1% A 85 ILE HB 1.0 . 3.41 1581 1389 A 55 ILE HD1% A 93 TYR HBy 1.0 . 4.26 1582 1390 A 52 ILE HD1% A 106 LYS HG3 1.0 . 4.18 1583 1390 A 52 ILE HD1% A 106 LYS HG2 1.0 . 4.18 1584 1391 A 52 ILE HD1% A 52 ILE H 1.0 . 4.32 1585 1392 A 52 ILE HD1% A 52 ILE HA 1.0 . 4.30 1586 1393 A 22 ILE HD1% A 19 GLU HA 1.0 . 4.06 1587 1394 A 78 ILE HA A 78 ILE HG1y 1.0 . 3.96 1588 1395 A 71 GLU HA A 74 LYS H 1.0 . 4.11 1589 1396 A 71 GLU HA A 74 LYS HD2 1.0 . 4.00 1590 1396 A 71 GLU HA A 74 LYS HD3 1.0 . 4.00 1591 1397 A 110 ILE HD1% A 119 ARG HA 1.0 . 4.16 1592 1398 A 110 ILE HD1% A 119 ARG HG3 1.0 . 3.61 1593 1398 A 110 ILE HD1% A 119 ARG HG2 1.0 . 3.61 1594 1399 A 123 ILE HD1% A 36 LEU HBx 1.0 . 3.35 1595 1400 A 21 LEU HD1% A 30 VAL HA 1.0 . 3.54 1596 1401 A 72 GLU HA A 72 GLU HG2 1.0 . 3.76 1597 1401 A 72 GLU HA A 72 GLU HG3 1.0 . 3.76 1598 1402 A 21 LEU HG A 21 LEU HA 1.0 . 3.61 1599 1403 A 20 SER HA A 21 LEU HA 1.0 . 4.90 1600 1404 A 109 ILE HD1% A 109 ILE HB 1.0 . 3.92 1601 1405 A 79 SER HA A 80 ASN H 1.0 . 3.43 1602 1406 A 127 LYS HA A 127 LYS HG2 1.0 . 3.43 1603 1406 A 127 LYS HA A 127 LYS HG3 1.0 . 3.43 1604 1407 A 18 MET HA A 21 LEU HBy 1.0 . 3.32 1605 1408 A 48 LYS HA A 49 GLY H 1.0 . 3.56 1606 1409 A 123 ILE HD1% A 122 LEU HA 1.0 . 4.58 1607 1410 A 66 LYS HA A 66 LYS HE2 1.0 . 3.79 1608 1410 A 66 LYS HA A 66 LYS HE3 1.0 . 3.79 1609 1411 A 47 LYS HA A 46 ASP H 1.0 . 4.94 1610 1412 A 82 PRO HD3 A 81 ASN HBx 1.0 . 4.34 1611 1412 A 81 ASN HBx A 82 PRO HD2 1.0 . 4.34 1612 1413 A 54 ALA HB% A 56 GLY HAx 1.0 . 4.20 1613 1414 A 25 GLY HAy A 27 LEU H 1.0 . 4.79 1614 1415 A 50 LYS HGx A 49 GLY HAy 1.0 . 4.39 1615 1416 A 115 ARG HB2 A 115 ARG HD2 1.0 . 2.99 1616 1416 A 115 ARG HB3 A 115 ARG HD2 1.0 . 2.99 1617 1416 A 115 ARG HD3 A 115 ARG HB3 1.0 . 2.99 1618 1416 A 115 ARG HD3 A 115 ARG HB2 1.0 . 2.99 1619 1417 A 115 ARG HA A 115 ARG HD2 1.0 . 3.89 1620 1417 A 115 ARG HA A 115 ARG HD3 1.0 . 3.89 1621 1418 A 107 ASP HB3 A 122 LEU HB2 1.0 . 4.20 1622 1418 A 107 ASP HB2 A 122 LEU HB2 1.0 . 4.20 1623 1418 A 122 LEU HB3 A 107 ASP HB2 1.0 . 4.20 1624 1418 A 107 ASP HB3 A 122 LEU HB3 1.0 . 4.20 1625 1419 A 115 ARG H A 115 ARG HD2 1.0 . 3.84 1626 1419 A 115 ARG HD3 A 115 ARG H 1.0 . 3.84 1627 1420 A 115 ARG HD2 A 115 ARG HG2 1.0 . 2.81 1628 1420 A 115 ARG HG3 A 115 ARG HD2 1.0 . 2.81 1629 1420 A 115 ARG HG3 A 115 ARG HD3 1.0 . 2.81 1630 1420 A 115 ARG HD3 A 115 ARG HG2 1.0 . 2.81 1631 1421 A 95 LYS HGx A 95 LYS HE2 1.0 . 3.46 1632 1421 A 95 LYS HGx A 95 LYS HE3 1.0 . 3.46 1633 1422 A 110 ILE HD1% A 97 TYR HB2 1.0 . 3.63 1634 1423 A 66 LYS HB3 A 66 LYS HE2 1.0 . 4.12 1635 1423 A 66 LYS HB2 A 66 LYS HE2 1.0 . 4.12 1636 1423 A 66 LYS HE3 A 66 LYS HB2 1.0 . 4.12 1637 1423 A 66 LYS HB3 A 66 LYS HE3 1.0 . 4.12 1638 1424 A 50 LYS HGy A 50 LYS HE2 1.0 . 3.12 1639 1424 A 50 LYS HGy A 50 LYS HE3 1.0 . 3.12 1640 1425 A 66 LYS HE3 A 66 LYS HG3 1.0 . 3.09 1641 1425 A 66 LYS HE2 A 66 LYS HG3 1.0 . 3.09 1642 1425 A 66 LYS HG2 A 66 LYS HE2 1.0 . 3.09 1643 1425 A 66 LYS HE3 A 66 LYS HG2 1.0 . 3.09 1644 1426 A 44 ASP HBy A 47 LYS HE2 1.0 . 3.24 1645 1426 A 47 LYS HE3 A 44 ASP HBy 1.0 . 3.24 1646 1427 A 24 LYS HE3 A 26 LYS HG2 1.0 . 3.57 1647 1427 A 24 LYS HE2 A 26 LYS HG2 1.0 . 3.57 1648 1427 A 26 LYS HG3 A 24 LYS HE2 1.0 . 3.57 1649 1427 A 26 LYS HG3 A 24 LYS HE3 1.0 . 3.57 1650 1428 A 26 LYS HE2 A 26 LYS HG2 1.0 . 3.30 1651 1428 A 26 LYS HE3 A 26 LYS HG2 1.0 . 3.30 1652 1428 A 26 LYS HG3 A 26 LYS HE3 1.0 . 3.30 1653 1428 A 26 LYS HG3 A 26 LYS HE2 1.0 . 3.30 1654 1429 A 52 ILE HG2% A 50 LYS HE2 1.0 . 3.58 1655 1429 A 52 ILE HG2% A 50 LYS HE3 1.0 . 3.58 1656 1430 A 21 LEU HBx A 26 LYS HE3 1.0 . 3.97 1657 1430 A 21 LEU HBx A 26 LYS HE2 1.0 . 3.97 1658 1431 A 45 GLU HB3 A 48 LYS HE2 1.0 . 3.70 1659 1431 A 45 GLU HB2 A 48 LYS HE2 1.0 . 3.70 1660 1431 A 48 LYS HE3 A 45 GLU HB2 1.0 . 3.70 1661 1431 A 48 LYS HE3 A 45 GLU HB3 1.0 . 3.70 1662 1432 A 48 LYS HE3 A 48 LYS HG3 1.0 . 3.31 1663 1432 A 48 LYS HE2 A 48 LYS HG3 1.0 . 3.31 1664 1432 A 48 LYS HG2 A 48 LYS HE2 1.0 . 3.31 1665 1432 A 48 LYS HE3 A 48 LYS HG2 1.0 . 3.31 1666 1433 A 102 ASP H A 102 ASP HBy 1.0 . 3.79 1667 1434 A 59 PHE HE% A 19 GLU HGy 1.0 . 3.85 1668 1435 A 71 GLU HG3 A 71 GLU H 1.0 . 4.03 1669 1436 A 126 GLU HGx A 127 LYS HA 1.0 . 4.03 1670 1437 A 11 GLU H A 11 GLU HG3 1.0 . 4.37 1671 1438 A 75 GLU H A 75 GLU HGx 1.0 . 4.05 1672 1439 A 45 GLU HA A 45 GLU HGy 1.0 . 3.98 1673 1440 A 121 VAL HB A 122 LEU H 1.0 . 4.27 1674 1441 A 43 VAL HB A 47 LYS HGy 1.0 . 4.26 1675 1442 A 47 LYS HBx A 43 VAL HB 1.0 . 4.07 1676 1443 A 17 THR HA A 16 GLU HG2 1.0 . 4.11 1677 1443 A 17 THR HA A 16 GLU HG3 1.0 . 4.11 1678 1444 A 35 GLN HGy A 36 LEU H 1.0 . 5.06 1679 1445 A 110 ILE HD1% A 48 LYS HBy 1.0 . 4.49 1680 1446 A 42 LYS HBx A 42 LYS HD2 1.0 . 2.85 1681 1446 A 42 LYS HBx A 42 LYS HD3 1.0 . 2.85 1682 1447 A 42 LYS HBy A 42 LYS HD2 1.0 . 3.60 1683 1447 A 42 LYS HD3 A 42 LYS HBy 1.0 . 3.60 1684 1448 A 36 LEU HG A 29 GLN HB2 1.0 . 3.61 1685 1449 A 66 LYS HB3 A 66 LYS HD2 1.0 . 3.45 1686 1449 A 66 LYS HB2 A 66 LYS HD2 1.0 . 3.45 1687 1449 A 66 LYS HD3 A 66 LYS HB2 1.0 . 3.45 1688 1449 A 66 LYS HB3 A 66 LYS HD3 1.0 . 3.45 1689 1450 A 89 LYS HB3 A 89 LYS HDy 1.0 . 3.69 1690 1450 A 89 LYS HB2 A 89 LYS HDy 1.0 . 3.69 1691 1451 A 90 PRO HDy A 89 LYS HB2 1.0 . 4.06 1692 1451 A 90 PRO HDy A 89 LYS HB3 1.0 . 4.06 1693 1452 A 89 LYS HGy A 87 GLU HBy 1.0 . 4.11 1694 1453 A 47 LYS HBy A 43 VAL HB 1.0 . 3.51 1695 1454 A 21 LEU HD2% A 16 GLU HBy 1.0 . 4.10 1696 1455 A 11 GLU H A 11 GLU HBy 1.0 . 3.86 1697 1456 A 97 TYR HE% A 45 GLU HB2 1.0 . 5.17 1698 1456 A 97 TYR HE% A 45 GLU HB3 1.0 . 5.17 1699 1457 A 95 LYS HA A 95 LYS HD2 1.0 . 4.34 1700 1457 A 95 LYS HD3 A 95 LYS HA 1.0 . 4.34 1701 1458 A 71 GLU H A 71 GLU HB2 1.0 . 3.10 1702 1458 A 71 GLU H A 71 GLU HB3 1.0 . 3.10 1703 1459 A 66 LYS HA A 66 LYS HD2 1.0 . 4.08 1704 1459 A 66 LYS HA A 66 LYS HD3 1.0 . 4.08 1705 1460 A 55 ILE HG1x A 96 VAL HB 1.0 . 5.01 1706 1461 A 27 LEU HG A 27 LEU H 1.0 . 4.19 1707 1462 A 121 VAL HB A 40 LYS HD2 1.0 . 4.14 1708 1462 A 40 LYS HD3 A 121 VAL HB 1.0 . 4.14 1709 1463 A 93 TYR HE% A 91 LEU HD1% 1.0 . 5.05 1710 1464 A 90 PRO HA A 91 LEU HD1% 1.0 . 5.50 1711 1465 A 22 ILE HG2% A 91 LEU HD1% 1.0 . 4.41 1712 1466 A 44 ASP HBy A 47 LYS HD2 1.0 . 4.17 1713 1466 A 44 ASP HBy A 47 LYS HD3 1.0 . 4.17 1714 1467 A 38 HIS HBx A 40 LYS HD2 1.0 . 4.02 1715 1467 A 38 HIS HBx A 40 LYS HD3 1.0 . 4.02 1716 1468 A 21 LEU HD1% A 29 GLN HB2 1.0 . 3.65 1717 1469 A 73 LEU HBy A 73 LEU HD2% 1.0 . 3.75 1718 1470 A 36 LEU HD2% A 36 LEU HBy 1.0 . 3.28 1719 1471 A 27 LEU HB3 A 27 LEU HD2% 1.0 . 3.10 1720 1471 A 27 LEU HB2 A 27 LEU HD2% 1.0 . 3.10 1721 1472 A 36 LEU HD1% A 30 VAL HA 1.0 . 4.24 1722 1473 A 122 LEU H A 122 LEU HD1% 1.0 . 4.36 1723 1474 A 122 LEU HD1% A 122 LEU HB2 1.0 . 3.45 1724 1474 A 122 LEU HB3 A 122 LEU HD1% 1.0 . 3.45 1725 1475 A 29 GLN HGy A 36 LEU HD1% 1.0 . 3.97 1726 1476 A 36 LEU HD1% A 29 GLN HB2 1.0 . 3.97 1727 1477 A 118 TYR HB3 A 39 LEU HD1% 1.0 . 4.03 1728 1477 A 39 LEU HD1% A 118 TYR HB2 1.0 . 4.03 1729 1478 A 39 LEU HD1% A 111 VAL HG2% 1.0 . 4.75 1730 1479 A 66 LYS HA A 66 LYS HG3 1.0 . 2.95 1731 1479 A 66 LYS HA A 66 LYS HG2 1.0 . 2.95 1732 1480 A 38 HIS HBx A 40 LYS HG2 1.0 . 4.82 1733 1480 A 38 HIS HBx A 40 LYS HG3 1.0 . 4.82 1734 1481 A 119 ARG HDy A 40 LYS HG2 1.0 . 5.04 1735 1481 A 40 LYS HG3 A 119 ARG HDy 1.0 . 5.04 1736 1482 A 47 LYS HGy A 47 LYS HE2 1.0 . 4.02 1737 1482 A 47 LYS HE3 A 47 LYS HGy 1.0 . 4.02 1738 1483 A 66 LYS H A 66 LYS HG3 1.0 . 3.94 1739 1483 A 66 LYS H A 66 LYS HG2 1.0 . 3.94 1740 1484 A 122 LEU HB2 A 122 LEU HD2% 1.0 . 3.45 1741 1484 A 122 LEU HB3 A 122 LEU HD2% 1.0 . 3.45 1742 1485 A 107 ASP HA A 122 LEU HD2% 1.0 . 4.52 1743 1486 A 35 GLN HBy A 122 LEU HD2% 1.0 . 5.28 1744 1487 A 44 ASP HA A 47 LYS HGy 1.0 . 5.04 1745 1488 A 21 LEU HD1% A 26 LYS HG2 1.0 . 4.90 1746 1488 A 21 LEU HD1% A 26 LYS HG3 1.0 . 4.90 1747 1489 A 35 GLN HGy A 122 LEU HD2% 1.0 . 5.50 1748 1490 A 24 LYS HBy A 26 LYS HG2 1.0 . 4.61 1749 1490 A 24 LYS HBy A 26 LYS HG3 1.0 . 4.61 1750 1491 A 24 LYS HG3 A 26 LYS HG2 1.0 . 3.74 1751 1491 A 24 LYS HG3 A 26 LYS HG3 1.0 . 3.74 1752 1492 A 59 PHE HA A 58 THR HB 1.0 . 4.50 1753 1493 A 113 PHE HZ A 91 LEU HD2% 1.0 . 4.52 1754 1494 A 22 ILE HG2% A 91 LEU HD2% 1.0 . 4.41 1755 1495 A 25 GLY H A 27 LEU HD1% 1.0 . 4.56 1756 1496 A 27 LEU HB3 A 27 LEU HD1% 1.0 . 3.10 1757 1496 A 27 LEU HD1% A 27 LEU HB2 1.0 . 3.10 1758 1497 A 118 TYR HB3 A 39 LEU HD2% 1.0 . 4.03 1759 1497 A 39 LEU HD2% A 118 TYR HB2 1.0 . 4.03 1760 1498 A 39 LEU HBy A 39 LEU HD2% 1.0 . 3.86 1761 1499 A 120 ALA HB% A 39 LEU HD2% 1.0 . 4.37 1762 1500 A 30 VAL HG2% A 39 LEU HD2% 1.0 . 3.93 1763 1501 A 52 ILE H A 51 VAL HG1% 1.0 . 3.84 1764 1502 A 31 VAL H A 30 VAL HG2% 1.0 . 4.10 1765 1503 A 31 VAL HA A 21 LEU HD2% 1.0 . 5.15 1766 1504 A 14 THR HB A 16 GLU HG2 1.0 . 4.15 1767 1504 A 14 THR HB A 16 GLU HG3 1.0 . 4.15 1768 1505 A 120 ALA HB% A 37 TYR HD% 1.0 . 4.12 1769 1506 A 121 VAL HA A 120 ALA HB% 1.0 . 4.23 1770 1507 A 120 ALA HB% A 109 ILE HD1% 1.0 . 3.78 1771 1508 A 120 ALA HB% A 121 VAL H 1.0 . 3.72 1772 1509 A 120 ALA HB% A 37 TYR HB2 1.0 . 3.90 1773 1510 A 120 ALA HB% A 39 LEU HBy 1.0 . 5.29 1774 1511 A 17 THR HG2% A 21 LEU HD2% 1.0 . 4.82 1775 1512 A 117 TYR HBy A 43 VAL HG1% 1.0 . 5.11 1776 1513 A 60 PHE HA A 61 VAL HG1% 1.0 . 4.35 1777 1514 A 58 THR HG2% A 59 PHE HA 1.0 . 4.22 1778 1515 A 96 VAL HG1% A 111 VAL HA 1.0 . 3.90 1779 1516 A 52 ILE HD1% A 96 VAL HG1% 1.0 . 3.37 1780 1517 A 96 VAL HG1% A 109 ILE HG1y 1.0 . 3.90 1781 1518 A 61 VAL HG1% A 68 TRP HB2 1.0 . 5.33 1782 1519 A 43 VAL HG1% A 118 TYR HA 1.0 . 4.11 1783 1520 A 91 LEU HG A 61 VAL HG1% 1.0 . 4.18 1784 1521 A 43 VAL HG1% A 42 LYS HA 1.0 . 4.08 1785 1522 A 61 VAL HG1% A 65 GLY HAx 1.0 . 4.24 1786 1523 A 118 TYR H A 111 VAL HG1% 1.0 . 5.50 1787 1524 A 109 ILE HD1% A 111 VAL HG1% 1.0 . 4.15 1788 1525 A 99 THR HG2% A 109 ILE HA 1.0 . 3.64 1789 1526 A 98 SER HA A 99 THR HG2% 1.0 . 4.06 1790 1527 A 54 ALA HB% A 56 GLY H 1.0 . 3.91 1791 1528 A 95 LYS HGy A 54 ALA HB% 1.0 . 3.96 1792 1529 A 54 ALA HB% A 95 LYS HD2 1.0 . 4.13 1793 1529 A 95 LYS HD3 A 54 ALA HB% 1.0 . 4.13 1794 1530 A 121 VAL H A 121 VAL HG2% 1.0 . 4.09 1795 1531 A 121 VAL HA A 121 VAL HG2% 1.0 . 3.69 1796 1532 A 108 GLU HG2 A 121 VAL HG2% 1.0 . 3.89 1797 1533 A 96 VAL HG2% A 37 TYR HD% 1.0 . 5.14 1798 1534 A 96 VAL HG2% A 54 ALA HA 1.0 . 3.65 1799 1535 A 96 VAL HG2% A 111 VAL HA 1.0 . 4.12 1800 1536 A 55 ILE HG1x A 96 VAL HG2% 1.0 . 3.84 1801 1537 A 53 GLY HAx A 54 ALA HB% 1.0 . 4.10 1802 1538 A 54 ALA HB% A 95 LYS HBy 1.0 . 4.10 1803 1539 A 14 THR HG2% A 31 VAL HG1% 1.0 . 4.34 1804 1540 A 14 THR HG2% A 34 ASP HA 1.0 . 4.15 1805 1541 A 96 VAL HG2% A 111 VAL HG2% 1.0 . 3.46 1806 1542 A 109 ILE HD1% A 111 VAL HG2% 1.0 . 4.15 1807 1543 A 16 GLU H A 31 VAL HG1% 1.0 . 4.66 1808 1544 A 18 MET HA A 31 VAL HG1% 1.0 . 4.46 1809 1545 A 30 VAL HA A 31 VAL HG1% 1.0 . 5.50 1810 1546 A 14 THR HG2% A 36 LEU HBx 1.0 . 4.08 1811 1547 A 14 THR HG2% A 16 GLU HBx 1.0 . 4.08 1812 1548 A 14 THR HG2% A 31 VAL HB 1.0 . 4.64 1813 1549 A 52 ILE H A 51 VAL HG2% 1.0 . 3.84 1814 1550 A 51 VAL H A 51 VAL HG2% 1.0 . 3.69 1815 1551 A 93 TYR HD% A 111 VAL HG2% 1.0 . 5.50 1816 1552 A 31 VAL H A 31 VAL HG2% 1.0 . 3.79 1817 1553 A 122 LEU H A 121 VAL HG1% 1.0 . 4.39 1818 1554 A 121 VAL HA A 121 VAL HG1% 1.0 . 3.69 1819 1555 A 119 ARG HDy A 121 VAL HG1% 1.0 . 5.50 1820 1556 A 36 LEU HA A 31 VAL HG2% 1.0 . 4.88 1821 1557 A 18 MET HA A 31 VAL HG2% 1.0 . 4.46 1822 1558 A 21 LEU HD1% A 21 LEU H 1.0 . 4.41 1823 1559 A 97 TYR HB3 A 48 LYS HG3 1.0 . 4.65 1824 1559 A 97 TYR HB3 A 48 LYS HG2 1.0 . 4.65 1825 1560 A 22 ILE HD1% A 21 LEU HBy 1.0 . 4.44 1826 1561 A 22 ILE HD1% A 91 LEU HBy 1.0 . 4.55 1827 1562 A 42 LYS HBx A 42 LYS HE3 1.0 . 2.90 1828 1562 A 42 LYS HBx A 42 LYS HE2 1.0 . 2.90 1829 1563 A 26 LYS HA A 25 GLY HAx 1.0 . 4.80 1830 1564 A 36 LEU HD1% A 21 LEU HD2% 1.0 . 3.19 1831 1565 A 41 GLU H A 40 LYS HD2 1.0 . 4.84 1832 1565 A 40 LYS HD3 A 41 GLU H 1.0 . 4.84 1833 1566 A 29 GLN HA A 28 ASP H 1.0 . 4.98 1834 1567 A 29 GLN HA A 38 HIS HD2 1.0 . 4.22 1835 1568 A 123 ILE HD1% A 29 GLN HB2 1.0 . 4.54 1836 1569 A 60 PHE HA A 89 LYS HB2 1.0 . 4.48 1837 1569 A 60 PHE HA A 89 LYS HB3 1.0 . 4.48 1838 1570 A 65 GLY HAx A 61 VAL HA 1.0 . 5.48 1839 1571 A 88 LYS HA A 61 VAL HA 1.0 . 5.50 1840 1572 A 61 VAL HG2% A 65 GLY H 1.0 . 4.35 1841 1573 A 88 LYS HA A 62 ASP HA 1.0 . 4.18 1842 1574 A 62 ASP HA A 63 GLY HAy 1.0 . 4.72 1843 1575 A 109 ILE HG2% A 108 GLU HA 1.0 . 3.91 1844 1576 A 120 ALA HA A 40 LYS HG2 1.0 . 4.34 1845 1576 A 40 LYS HG3 A 120 ALA HA 1.0 . 4.34 1846 1577 A 120 ALA HB% A 39 LEU H 1.0 . 4.44 1847 1578 A 18 MET HA A 31 VAL HB 1.0 . 5.50 1848 1579 A 31 VAL HB A 32 TYR H 1.0 . 4.36 1849 1580 A 18 MET HGy A 31 VAL HG2% 1.0 . 5.49 1850 1581 A 123 ILE HD1% A 36 LEU HD2% 1.0 . 3.03 1851 1582 A 31 VAL HA A 36 LEU HD2% 1.0 . 5.50 1852 1583 A 14 THR HB A 36 LEU HD1% 1.0 . 4.46 1853 1584 A 34 ASP H A 33 ASP HBy 1.0 . 4.74 1854 1585 A 53 GLY HAy A 33 ASP HBy 1.0 . 5.50 1855 1586 A 45 GLU H A 47 LYS HD2 1.0 . 5.50 1856 1586 A 47 LYS HD3 A 45 GLU H 1.0 . 5.50 1857 1587 A 119 ARG HE A 40 LYS HG2 1.0 . 4.56 1858 1587 A 40 LYS HG3 A 119 ARG HE 1.0 . 4.56 1859 1588 A 75 GLU H A 74 LYS HGx 1.0 . 5.31 1860 1589 A 41 GLU HGy A 41 GLU H 1.0 . 4.31 1861 1590 A 41 GLU HGy A 42 LYS H 1.0 . 4.36 1862 1591 A 36 LEU HBy A 16 GLU HG2 1.0 . 4.60 1863 1591 A 36 LEU HBy A 16 GLU HG3 1.0 . 4.60 1864 1592 A 42 LYS HBy A 43 VAL H 1.0 . 4.55 1865 1593 A 42 LYS HA A 42 LYS HD2 1.0 . 4.35 1866 1593 A 42 LYS HA A 42 LYS HD3 1.0 . 4.35 1867 1594 A 42 LYS H A 42 LYS HD2 1.0 . 4.49 1868 1594 A 42 LYS HD3 A 42 LYS H 1.0 . 4.49 1869 1595 A 42 LYS HGx A 116 GLU HB2 1.0 . 4.86 1870 1595 A 42 LYS HGx A 116 GLU HB3 1.0 . 4.86 1871 1596 A 36 LEU HD2% A 37 TYR H 1.0 . 4.77 1872 1597 A 43 VAL HG2% A 45 GLU HA 1.0 . 4.79 1873 1598 A 45 GLU HA A 44 ASP HA 1.0 . 4.60 1874 1599 A 47 LYS HBx A 47 LYS HE2 1.0 . 4.77 1875 1599 A 47 LYS HBx A 47 LYS HE3 1.0 . 4.77 1876 1600 A 89 LYS HGx A 87 GLU HGx 1.0 . 5.08 1877 1601 A 75 GLU H A 74 LYS HGy 1.0 . 5.31 1878 1602 A 110 ILE HD1% A 48 LYS HBx 1.0 . 4.49 1879 1603 A 49 GLY HAx A 50 LYS HB2 1.0 . 4.77 1880 1603 A 50 LYS HB3 A 49 GLY HAx 1.0 . 4.77 1881 1604 A 49 GLY HAy A 50 LYS HB2 1.0 . 4.59 1882 1604 A 50 LYS HB3 A 49 GLY HAy 1.0 . 4.59 1883 1605 A 97 TYR HD% A 50 LYS HB2 1.0 . 5.50 1884 1605 A 97 TYR HD% A 50 LYS HB3 1.0 . 5.50 1885 1606 A 50 LYS H A 50 LYS HD2 1.0 . 4.88 1886 1606 A 50 LYS HD3 A 50 LYS H 1.0 . 4.88 1887 1607 A 52 ILE HG2% A 51 VAL HA 1.0 . 4.57 1888 1608 A 52 ILE HD1% A 109 ILE HD1% 1.0 . 4.59 1889 1609 A 52 ILE HD1% A 106 LYS HD2 1.0 . 4.52 1890 1609 A 52 ILE HD1% A 106 LYS HD3 1.0 . 4.52 1891 1610 A 52 ILE HD1% A 106 LYS HE2 1.0 . 4.80 1892 1610 A 52 ILE HD1% A 106 LYS HE3 1.0 . 4.80 1893 1611 A 52 ILE HD1% A 51 VAL HA 1.0 . 5.21 1894 1612 A 32 TYR HE% A 54 ALA HB% 1.0 . 5.50 1895 1613 A 123 ILE HG1x A 38 HIS HBy 1.0 . 4.38 1896 1614 A 55 ILE HG2% A 94 GLY HAy 1.0 . 5.50 1897 1615 A 55 ILE HG2% A 96 VAL HG2% 1.0 . 4.67 1898 1616 A 57 GLN HA A 56 GLY HAx 1.0 . 4.63 1899 1617 A 58 THR HG2% A 92 ARG HDy 1.0 . 4.57 1900 1618 A 58 THR HG2% A 91 LEU HA 1.0 . 5.46 1901 1619 A 58 THR HG2% A 113 PHE HE% 1.0 . 5.50 1902 1620 A 62 ASP HA A 63 GLY HAx 1.0 . 4.72 1903 1621 A 83 ASP H A 82 PRO HBx 1.0 . 4.49 1904 1622 A 60 PHE HA A 59 PHE HBy 1.0 . 5.05 1905 1623 A 43 VAL HG2% A 110 ILE HD1% 1.0 . 3.29 1906 1624 A 78 ILE HG2% A 77 TYR H 1.0 . 4.96 1907 1625 A 78 ILE HG2% A 78 ILE HG1y 1.0 . 4.17 1908 1626 A 60 PHE HE% A 90 PRO HDy 1.0 . 5.50 1909 1627 A 86 ARG HA A 86 ARG HD2 1.0 . 4.82 1910 1627 A 86 ARG HA A 86 ARG HD3 1.0 . 4.82 1911 1628 A 94 GLY HAx A 112 GLU HBx 1.0 . 4.36 1912 1629 A 60 PHE HE% A 88 LYS HGx 1.0 . 5.50 1913 1630 A 60 PHE HBx A 88 LYS HBx 1.0 . 4.86 1914 1631 A 91 LEU HA A 90 PRO HG2 1.0 . 5.10 1915 1632 A 60 PHE HE% A 90 PRO HG2 1.0 . 4.97 1916 1633 A 60 PHE HE% A 90 PRO HDx 1.0 . 4.46 1917 1634 A 22 ILE HD1% A 91 LEU HD2% 1.0 . 4.55 1918 1635 A 60 PHE HA A 91 LEU HBy 1.0 . 5.07 1919 1636 A 113 PHE HA A 92 ARG HB2 1.0 . 5.29 1920 1636 A 92 ARG HB3 A 113 PHE HA 1.0 . 5.29 1921 1637 A 95 LYS HGy A 95 LYS H 1.0 . 4.61 1922 1638 A 95 LYS H A 95 LYS HD2 1.0 . 4.63 1923 1638 A 95 LYS HD3 A 95 LYS H 1.0 . 4.63 1924 1639 A 96 VAL HG2% A 32 TYR HB2 1.0 . 4.49 1925 1640 A 96 VAL HG2% A 32 TYR HE% 1.0 . 4.38 1926 1641 A 110 ILE HG1x A 96 VAL HG1% 1.0 . 5.50 1927 1642 A 96 VAL HG1% A 95 LYS HA 1.0 . 5.50 1928 1643 A 98 SER HBy A 96 VAL HG1% 1.0 . 5.50 1929 1644 A 106 LYS HA A 105 ALA HB% 1.0 . 4.00 1930 1645 A 109 ILE HG2% A 106 LYS HG3 1.0 . 4.47 1931 1645 A 109 ILE HG2% A 106 LYS HG2 1.0 . 4.47 1932 1646 A 42 LYS HGy A 43 VAL H 1.0 . 4.70 1933 1647 A 35 GLN HGy A 122 LEU HD1% 1.0 . 5.50 1934 1648 A 108 GLU HG2 A 109 ILE HG1x 1.0 . 5.50 1935 1649 A 112 GLU H A 109 ILE HD1% 1.0 . 5.50 1936 1650 A 109 ILE HD1% A 109 ILE HA 1.0 . 4.39 1937 1651 A 110 ILE HD1% A 45 GLU HA 1.0 . 5.50 1938 1652 A 110 ILE HD1% A 119 ARG HDy 1.0 . 5.50 1939 1653 A 110 ILE HD1% A 117 TYR HBx 1.0 . 4.99 1940 1654 A 110 ILE HD1% A 48 LYS H 1.0 . 4.73 1941 1655 A 97 TYR HD% A 110 ILE HD1% 1.0 . 5.06 1942 1656 A 110 ILE HD1% A 120 ALA H 1.0 . 5.03 1943 1657 A 96 VAL HG1% A 111 VAL HB 1.0 . 4.70 1944 1658 A 112 GLU HGy A 113 PHE H 1.0 . 4.42 1945 1659 A 97 TYR HE% A 112 GLU HGx 1.0 . 4.38 1946 1660 A 112 GLU H A 112 GLU HGx 1.0 . 4.68 1947 1661 A 112 GLU HBy A 96 VAL HA 1.0 . 5.14 1948 1662 A 113 PHE HA A 114 ASN HA 1.0 . 4.57 1949 1663 A 116 GLU H A 115 ARG HG2 1.0 . 4.84 1950 1663 A 115 ARG HG3 A 116 GLU H 1.0 . 4.84 1951 1664 A 115 ARG HA A 114 ASN HA 1.0 . 4.99 1952 1665 A 115 ARG HA A 116 GLU HA 1.0 . 4.84 1953 1666 A 117 TYR H A 116 GLU HGy 1.0 . 5.09 1954 1667 A 117 TYR HBx A 43 VAL H 1.0 . 5.39 1955 1668 A 119 ARG HDx A 110 ILE HG1y 1.0 . 5.50 1956 1669 A 119 ARG HDx A 121 VAL HG2% 1.0 . 5.50 1957 1670 A 99 THR HG2% A 119 ARG HDy 1.0 . 4.65 1958 1671 A 108 GLU HG2 A 119 ARG HDy 1.0 . 4.65 1959 1672 A 43 VAL HG1% A 119 ARG HDy 1.0 . 5.26 1960 1673 A 123 ILE HG1x A 122 LEU HA 1.0 . 4.25 1961 1674 A 107 ASP HA A 122 LEU HB2 1.0 . 3.93 1962 1674 A 107 ASP HA A 122 LEU HB3 1.0 . 3.93 1963 1675 A 37 TYR HA A 122 LEU HB2 1.0 . 4.88 1964 1675 A 37 TYR HA A 122 LEU HB3 1.0 . 4.88 1965 1676 A 123 ILE HD1% A 29 GLN HGx 1.0 . 4.59 1966 1677 A 123 ILE HB A 37 TYR HA 1.0 . 4.77 1967 1678 A 123 ILE HB A 122 LEU HA 1.0 . 4.70 1968 1679 A 124 LYS HE3 A 124 LYS HBy 1.0 . 5.43 1969 1679 A 124 LYS HBy A 124 LYS HE2 1.0 . 5.43 1970 1680 A 124 LYS HBx A 124 LYS HE3 1.0 . 5.43 1971 1680 A 124 LYS HBx A 124 LYS HE2 1.0 . 5.43 1972 1681 A 18 MET HE1 A 22 ILE H 1.0 . 4.37 1973 1682 A 18 MET HE1 A 22 ILE HG1x 1.0 . 3.96 1974 1683 A 18 MET HE1 A 55 ILE HD1% 1.0 . 4.31 1975 1684 A 110 ILE HG2% A 43 VAL HB 1.0 . 4.50 1976 1685 A 65 GLY HAx A 64 ASP H 1.0 . 4.56 1977 1686 A 44 ASP HBx A 47 LYS HE2 1.0 . 3.12 1978 1686 A 44 ASP HBx A 47 LYS HE3 1.0 . 3.12 1979 1687 A 122 LEU HG A 123 ILE H 1.0 . 4.61 1980 1688 A 39 LEU HBx A 39 LEU HD1% 1.0 . 3.86 1981 1689 A 32 TYR HD% A 33 ASP HA 1.0 . 4.21 1982 1690 A 32 TYR HD% A 33 ASP HBy 1.0 . 3.99 1983 1691 A 52 ILE HD1% A 32 TYR HD% 1.0 . 4.39 1984 1692 A 32 TYR HD% A 109 ILE HG1y 1.0 . 4.65 1985 1693 A 109 ILE HG2% A 32 TYR HD% 1.0 . 4.46 1986 1694 A 32 TYR HD% A 96 VAL HG2% 1.0 . 3.82 1987 1695 A 32 TYR HD% A 32 TYR H 1.0 . 4.43 1988 1696 A 32 TYR HD% A 34 ASP H 1.0 . 5.11 1989 1697 A 32 TYR HE% A 33 ASP HBx 1.0 . 4.56 1990 1698 A 32 TYR HE% A 106 LYS HD2 1.0 . 5.01 1991 1698 A 32 TYR HE% A 106 LYS HD3 1.0 . 5.01 1992 1699 A 32 TYR HE% A 33 ASP HBy 1.0 . 3.80 1993 1700 A 52 ILE HG2% A 32 TYR HE% 1.0 . 4.97 1994 1701 A 52 ILE HD1% A 32 TYR HE% 1.0 . 3.55 1995 1702 A 109 ILE HG2% A 32 TYR HE% 1.0 . 4.30 1996 1703 A 29 GLN HGy A 38 HIS HD2 1.0 . 5.09 1997 1704 A 39 LEU HBy A 38 HIS HD2 1.0 . 4.59 1998 1705 A 39 LEU HG A 38 HIS HD2 1.0 . 4.36 1999 1706 A 38 HIS HA A 38 HIS HD2 1.0 . 3.65 2000 1707 A 39 LEU H A 38 HIS HD2 1.0 . 3.74 2001 1708 A 30 VAL H A 38 HIS HD2 1.0 . 5.50 2002 1709 A 38 HIS HBx A 38 HIS HD2 1.0 . 3.90 2003 1710 A 29 GLN HGx A 38 HIS HD2 1.0 . 4.19 2004 1711 A 123 ILE HD1% A 38 HIS HD2 1.0 . 4.19 2005 1712 A 59 PHE HD% A 67 ARG HG2 1.0 . 4.92 2006 1712 A 59 PHE HD% A 67 ARG HG3 1.0 . 4.92 2007 1713 A 59 PHE HE% A 18 MET HBy 1.0 . 4.29 2008 1714 A 55 ILE HG2% A 59 PHE HE% 1.0 . 4.71 2009 1715 A 59 PHE HE% A 93 TYR HE% 1.0 . 4.37 2010 1716 A 60 PHE HD% A 59 PHE HBx 1.0 . 5.21 2011 1717 A 60 PHE HD% A 90 PRO HBx 1.0 . 4.56 2012 1718 A 60 PHE HD% A 73 LEU HD2% 1.0 . 3.94 2013 1719 A 60 PHE HD% A 58 THR HG2% 1.0 . 4.55 2014 1720 A 60 PHE HD% A 88 LYS HGx 1.0 . 3.58 2015 1721 A 60 PHE HD% A 88 LYS HGy 1.0 . 3.80 2016 1722 A 60 PHE HD% A 61 VAL H 1.0 . 4.24 2017 1723 A 60 PHE HD% A 91 LEU H 1.0 . 4.34 2018 1724 A 60 PHE HE% A 90 PRO HBy 1.0 . 4.00 2019 1725 A 60 PHE HE% A 73 LEU HD2% 1.0 . 5.38 2020 1726 A 68 TRP HD1 A 88 LYS HA 1.0 . 4.48 2021 1727 A 68 TRP HD1 A 60 PHE HBy 1.0 . 4.35 2022 1728 A 60 PHE HBx A 68 TRP HD1 1.0 . 4.37 2023 1729 A 68 TRP HD1 A 61 VAL HB 1.0 . 4.46 2024 1730 A 61 VAL HG2% A 68 TRP HD1 1.0 . 4.44 2025 1731 A 61 VAL HG1% A 68 TRP HD1 1.0 . 4.00 2026 1732 A 68 TRP HD1 A 68 TRP H 1.0 . 3.85 2027 1733 A 68 TRP HD1 A 61 VAL H 1.0 . 4.48 2028 1734 A 68 TRP HD1 A 62 ASP HA 1.0 . 4.15 2029 1735 A 72 GLU HB3 A 68 TRP HH2 1.0 . 4.64 2030 1736 A 68 TRP HZ2 A 86 ARG HBy 1.0 . 3.97 2031 1737 A 68 TRP HZ2 A 86 ARG HBx 1.0 . 3.97 2032 1738 A 68 TRP HZ2 A 88 LYS HBy 1.0 . 4.08 2033 1739 A 68 TRP HZ3 A 72 GLU HB2 1.0 . 4.29 2034 1740 A 118 TYR HD% A 42 LYS HA 1.0 . 3.96 2035 1741 A 118 TYR HD% A 113 PHE HBy 1.0 . 3.70 2036 1742 A 118 TYR HD% A 118 TYR HA 1.0 . 3.83 2037 1743 A 118 TYR HD% A 39 LEU HD2% 1.0 . 5.23 2038 1744 A 93 TYR HD% A 55 ILE HB 1.0 . 4.10 2039 1745 A 55 ILE HG2% A 93 TYR HD% 1.0 . 3.81 2040 1746 A 93 TYR HD% A 55 ILE HD1% 1.0 . 3.66 2041 1747 A 93 TYR HD% A 30 VAL HG2% 1.0 . 4.84 2042 1748 A 93 TYR HD% A 59 PHE HD% 1.0 . 4.13 2043 1749 A 93 TYR HD% A 59 PHE HE% 1.0 . 4.43 2044 1750 A 93 TYR HE% A 91 LEU HA 1.0 . 5.20 2045 1751 A 93 TYR HE% A 91 LEU HBx 1.0 . 4.09 2046 1752 A 55 ILE HG2% A 93 TYR HE% 1.0 . 4.37 2047 1753 A 93 TYR HE% A 55 ILE HD1% 1.0 . 4.22 2048 1754 A 93 TYR HE% A 93 TYR H 1.0 . 4.56 2049 1755 A 59 PHE HD% A 93 TYR HE% 1.0 . 4.01 2050 1756 A 93 TYR HE% A 113 PHE HE% 1.0 . 4.30 2051 1757 A 97 TYR HD% A 48 LYS HE2 1.0 . 4.33 2052 1757 A 97 TYR HD% A 48 LYS HE3 1.0 . 4.33 2053 1758 A 110 ILE HB A 97 TYR HD% 1.0 . 3.83 2054 1759 A 97 TYR HD% A 97 TYR HA 1.0 . 3.82 2055 1760 A 110 ILE HG2% A 97 TYR HD% 1.0 . 3.59 2056 1761 A 96 VAL HG1% A 97 TYR HD% 1.0 . 4.21 2057 1762 A 97 TYR HD% A 98 SER H 1.0 . 4.26 2058 1763 A 97 TYR HE% A 112 GLU HBy 1.0 . 3.70 2059 1764 A 97 TYR HE% A 95 LYS HGy 1.0 . 4.72 2060 1765 A 97 TYR HE% A 95 LYS HBx 1.0 . 3.88 2061 1766 A 97 TYR HE% A 48 LYS HDx 1.0 . 4.15 2062 1767 A 93 TYR HD% A 113 PHE HD% 1.0 . 4.39 2063 1768 A 91 LEU HBx A 113 PHE HE% 1.0 . 3.75 2064 1769 A 113 PHE HE% A 92 ARG HG2 1.0 . 5.36 2065 1769 A 92 ARG HG3 A 113 PHE HE% 1.0 . 5.36 2066 1770 A 113 PHE HZ A 27 LEU HB2 1.0 . 5.50 2067 1770 A 113 PHE HZ A 27 LEU HB3 1.0 . 5.50 2068 1771 A 91 LEU HG A 113 PHE HZ 1.0 . 5.50 2069 1772 A 113 PHE HD% A 113 PHE HZ 1.0 . 4.08 2070 1773 A 117 TYR HD% A 45 GLU HB2 1.0 . 3.73 2071 1773 A 117 TYR HD% A 45 GLU HB3 1.0 . 3.73 2072 1774 A 118 TYR HE% A 113 PHE HBx 1.0 . 3.46 2073 1775 A 118 TYR HE% A 116 GLU HGy 1.0 . 5.00 2074 1776 A 118 TYR HE% A 116 GLU HA 1.0 . 4.75 2075 1777 A 118 TYR HE% A 116 GLU HGx 1.0 . 5.00 2076 1778 A 118 TYR HE% A 116 GLU HB2 1.0 . 3.42 2077 1778 A 118 TYR HE% A 116 GLU HB3 1.0 . 3.42 2078 1779 A 118 TYR HE% A 42 LYS HD2 1.0 . 4.54 2079 1779 A 118 TYR HE% A 42 LYS HD3 1.0 . 4.54 2080 1780 A 118 TYR HE% A 42 LYS HGx 1.0 . 3.93 2081 1781 A 118 TYR HE% A 42 LYS HGy 1.0 . 4.21 2082 1782 A 118 TYR HE% A 118 TYR H 1.0 . 5.11 2083 1783 A 117 TYR HA A 118 TYR HE% 1.0 . 5.36 2084 1784 A 86 ARG HA A 68 TRP HH2 1.0 . 5.50 2085 1785 A 68 TRP HZ2 A 86 ARG HA 1.0 . 4.65 2086 1786 A 88 LYS HA A 68 TRP HZ2 1.0 . 4.62 2087 1787 A 7 THR H A 7 THR HB 1.0 . 3.94 2088 1788 A 7 THR H A 7 THR HG2% 1.0 . 3.63 2089 1789 A 8 ASP H A 8 ASP HBy 1.0 . 3.71 2090 1790 A 8 ASP H A 8 ASP HBx 1.0 . 3.71 2091 1791 A 41 GLU HGx A 42 LYS H 1.0 . 4.13 2092 1792 A 9 ASP H A 8 ASP HBx 1.0 . 4.14 2093 1793 A 100 ASN H A 100 ASN HB2 1.0 . 3.59 2094 1793 A 100 ASN H A 100 ASN HB3 1.0 . 3.59 2095 1794 A 10 ASN HD21 A 10 ASN HBy 1.0 . 3.78 2096 1795 A 10 ASN HD21 A 10 ASN HBx 1.0 . 3.78 2097 1796 A 10 ASN HD22 A 10 ASN HBy 1.0 . 3.78 2098 1797 A 10 ASN HD22 A 10 ASN HBx 1.0 . 3.78 2099 1798 A 14 THR H A 15 SER H 1.0 . 3.18 2100 1799 A 14 THR HG2% A 14 THR H 1.0 . 2.83 2101 1800 A 14 THR HG2% A 15 SER H 1.0 . 3.58 2102 1801 A 15 SER HA A 16 GLU H 1.0 . 2.94 2103 1802 A 16 GLU H A 16 GLU HG2 1.0 . 3.05 2104 1802 A 16 GLU HG3 A 16 GLU H 1.0 . 3.05 2105 1803 A 16 GLU HBy A 16 GLU H 1.0 . 4.09 2106 1804 A 16 GLU HBx A 16 GLU H 1.0 . 3.35 2107 1805 A 14 THR HG2% A 16 GLU H 1.0 . 3.69 2108 1806 A 16 GLU H A 31 VAL HG2% 1.0 . 4.66 2109 1807 A 16 GLU H A 17 THR H 1.0 . 4.45 2110 1808 A 17 THR H A 16 GLU HG2 1.0 . 3.76 2111 1808 A 16 GLU HG3 A 17 THR H 1.0 . 3.76 2112 1809 A 16 GLU HBy A 17 THR H 1.0 . 3.73 2113 1810 A 16 GLU HBx A 17 THR H 1.0 . 3.97 2114 1811 A 17 THR HG2% A 17 THR H 1.0 . 3.93 2115 1812 A 21 LEU HD2% A 17 THR H 1.0 . 4.85 2116 1813 A 59 PHE HE% A 18 MET H 1.0 . 5.28 2117 1814 A 18 MET HGy A 18 MET H 1.0 . 3.62 2118 1815 A 18 MET HGx A 18 MET H 1.0 . 3.70 2119 1816 A 18 MET H A 18 MET HBy 1.0 . 3.73 2120 1817 A 18 MET H A 18 MET HBx 1.0 . 3.73 2121 1818 A 17 THR HG2% A 18 MET H 1.0 . 3.63 2122 1819 A 18 MET H A 31 VAL HG2% 1.0 . 4.20 2123 1820 A 59 PHE HE% A 19 GLU H 1.0 . 4.31 2124 1821 A 18 MET HGy A 19 GLU H 1.0 . 4.73 2125 1822 A 19 GLU H A 19 GLU HGx 1.0 . 3.88 2126 1823 A 19 GLU H A 18 MET HBy 1.0 . 4.03 2127 1824 A 19 GLU H A 19 GLU HBy 1.0 . 3.70 2128 1825 A 17 THR HG2% A 19 GLU H 1.0 . 4.20 2129 1826 A 20 SER H A 16 GLU HG2 1.0 . 5.40 2130 1826 A 16 GLU HG3 A 20 SER H 1.0 . 5.40 2131 1827 A 20 SER H A 19 GLU HBy 1.0 . 3.84 2132 1828 A 20 SER H A 19 GLU HBx 1.0 . 3.84 2133 1829 A 21 LEU HD2% A 20 SER H 1.0 . 4.38 2134 1830 A 19 GLU H A 20 SER H 1.0 . 3.65 2135 1831 A 17 THR H A 20 SER H 1.0 . 4.31 2136 1832 A 20 SER H A 21 LEU H 1.0 . 3.63 2137 1833 A 21 LEU HBx A 21 LEU H 1.0 . 3.65 2138 1834 A 21 LEU HG A 21 LEU H 1.0 . 3.23 2139 1835 A 21 LEU HBy A 21 LEU H 1.0 . 3.61 2140 1836 A 21 LEU HD2% A 21 LEU H 1.0 . 3.14 2141 1837 A 21 LEU HBx A 22 ILE H 1.0 . 3.63 2142 1838 A 22 ILE HB A 22 ILE H 1.0 . 3.36 2143 1839 A 21 LEU HBy A 22 ILE H 1.0 . 3.57 2144 1840 A 22 ILE HG1x A 22 ILE H 1.0 . 3.46 2145 1841 A 22 ILE HG2% A 22 ILE H 1.0 . 3.95 2146 1842 A 22 ILE HD1% A 22 ILE H 1.0 . 3.76 2147 1843 A 22 ILE H A 23 ASP H 1.0 . 3.66 2148 1844 A 23 ASP H A 24 LYS H 1.0 . 3.53 2149 1845 A 19 GLU HA A 23 ASP H 1.0 . 4.02 2150 1846 A 23 ASP H A 23 ASP HBy 1.0 . 3.54 2151 1847 A 23 ASP H A 23 ASP HBx 1.0 . 3.54 2152 1848 A 23 ASP H A 67 ARG HG2 1.0 . 3.86 2153 1848 A 67 ARG HG3 A 23 ASP H 1.0 . 3.86 2154 1849 A 22 ILE HB A 23 ASP H 1.0 . 3.41 2155 1850 A 22 ILE HG2% A 23 ASP H 1.0 . 3.54 2156 1851 A 24 LYS HBy A 24 LYS H 1.0 . 3.67 2157 1852 A 24 LYS HBx A 24 LYS H 1.0 . 3.13 2158 1853 A 24 LYS HG2 A 24 LYS H 1.0 . 3.84 2159 1854 A 24 LYS H A 25 GLY H 1.0 . 3.37 2160 1855 A 25 GLY H A 26 LYS H 1.0 . 3.16 2161 1856 A 22 ILE HA A 25 GLY H 1.0 . 4.13 2162 1857 A 24 LYS HBy A 25 GLY H 1.0 . 4.52 2163 1858 A 24 LYS HBx A 25 GLY H 1.0 . 4.04 2164 1859 A 25 GLY H A 26 LYS HB2 1.0 . 4.02 2165 1859 A 26 LYS HB3 A 25 GLY H 1.0 . 4.02 2166 1860 A 25 GLY H A 26 LYS HG2 1.0 . 4.65 2167 1860 A 26 LYS HG3 A 25 GLY H 1.0 . 4.65 2168 1861 A 25 GLY H A 27 LEU HD2% 1.0 . 4.56 2169 1862 A 22 ILE HG2% A 25 GLY H 1.0 . 4.35 2170 1863 A 23 ASP H A 25 GLY H 1.0 . 4.17 2171 1864 A 22 ILE HA A 26 LYS H 1.0 . 4.00 2172 1865 A 24 LYS HG3 A 26 LYS H 1.0 . 3.22 2173 1866 A 26 LYS H A 26 LYS HB2 1.0 . 3.37 2174 1866 A 26 LYS HB3 A 26 LYS H 1.0 . 3.37 2175 1867 A 26 LYS H A 26 LYS HG2 1.0 . 3.28 2176 1867 A 26 LYS HG3 A 26 LYS H 1.0 . 3.28 2177 1868 A 26 LYS H A 27 LEU HD1% 1.0 . 4.61 2178 1869 A 22 ILE HG2% A 26 LYS H 1.0 . 4.65 2179 1870 A 23 ASP H A 26 LYS H 1.0 . 4.98 2180 1871 A 27 LEU H A 27 LEU HB2 1.0 . 2.78 2181 1871 A 27 LEU H A 27 LEU HB3 1.0 . 2.78 2182 1872 A 27 LEU H A 27 LEU HD2% 1.0 . 3.55 2183 1873 A 27 LEU H A 27 LEU HD1% 1.0 . 3.55 2184 1874 A 26 LYS H A 27 LEU H 1.0 . 4.10 2185 1875 A 28 ASP H A 29 GLN H 1.0 . 3.10 2186 1876 A 27 LEU H A 28 ASP H 1.0 . 3.19 2187 1877 A 28 ASP H A 28 ASP HBy 1.0 . 3.79 2188 1878 A 28 ASP H A 28 ASP HBx 1.0 . 3.79 2189 1879 A 28 ASP H A 27 LEU HB2 1.0 . 3.59 2190 1879 A 28 ASP H A 27 LEU HB3 1.0 . 3.59 2191 1880 A 27 LEU HA A 29 GLN H 1.0 . 3.99 2192 1881 A 29 GLN HGx A 29 GLN H 1.0 . 3.55 2193 1882 A 29 GLN H A 29 GLN HB2 1.0 . 3.93 2194 1883 A 29 GLN H A 30 VAL H 1.0 . 4.44 2195 1884 A 29 GLN H A 27 LEU HD1% 1.0 . 5.50 2196 1885 A 29 GLN HGy A 29 GLN HE22 1.0 . 3.81 2197 1886 A 29 GLN HE22 A 26 LYS HD2 1.0 . 4.04 2198 1886 A 26 LYS HD3 A 29 GLN HE22 1.0 . 4.04 2199 1887 A 36 LEU HD2% A 29 GLN HE22 1.0 . 4.65 2200 1888 A 123 ILE HG2% A 29 GLN HE22 1.0 . 4.90 2201 1889 A 123 ILE HD1% A 29 GLN HE22 1.0 . 3.87 2202 1890 A 29 GLN HE21 A 26 LYS HD2 1.0 . 4.04 2203 1890 A 26 LYS HD3 A 29 GLN HE21 1.0 . 4.04 2204 1891 A 123 ILE HD1% A 29 GLN HE21 1.0 . 3.84 2205 1892 A 29 GLN HGx A 30 VAL H 1.0 . 5.01 2206 1893 A 35 GLN HGy A 34 ASP H 1.0 . 5.29 2207 1894 A 29 GLN HB3 A 30 VAL H 1.0 . 4.18 2208 1895 A 30 VAL HB A 30 VAL H 1.0 . 4.01 2209 1896 A 120 ALA HB% A 30 VAL H 1.0 . 4.54 2210 1897 A 36 LEU HD1% A 30 VAL H 1.0 . 4.07 2211 1898 A 30 VAL H A 30 VAL HG2% 1.0 . 3.44 2212 1899 A 30 VAL H A 30 VAL HG1% 1.0 . 3.44 2213 1900 A 30 VAL HA A 31 VAL H 1.0 . 3.20 2214 1901 A 30 VAL HB A 31 VAL H 1.0 . 3.22 2215 1902 A 31 VAL H A 31 VAL HB 1.0 . 3.81 2216 1903 A 31 VAL H A 31 VAL HG1% 1.0 . 3.79 2217 1904 A 32 TYR HB2 A 32 TYR H 1.0 . 3.91 2218 1905 A 32 TYR HB3 A 32 TYR H 1.0 . 3.90 2219 1906 A 32 TYR H A 31 VAL HG2% 1.0 . 4.21 2220 1907 A 32 TYR HD% A 33 ASP H 1.0 . 3.62 2221 1908 A 33 ASP H A 33 ASP HBx 1.0 . 3.81 2222 1909 A 33 ASP H A 33 ASP HBy 1.0 . 3.61 2223 1910 A 34 ASP HBy A 34 ASP H 1.0 . 3.41 2224 1911 A 33 ASP H A 34 ASP H 1.0 . 3.32 2225 1912 A 34 ASP HBy A 35 GLN H 1.0 . 4.45 2226 1913 A 35 GLN HGx A 35 GLN H 1.0 . 4.33 2227 1914 A 35 GLN HGy A 35 GLN H 1.0 . 3.49 2228 1915 A 35 GLN HBx A 35 GLN H 1.0 . 3.83 2229 1916 A 35 GLN HBy A 35 GLN H 1.0 . 3.70 2230 1917 A 35 GLN H A 31 VAL HG2% 1.0 . 4.93 2231 1918 A 32 TYR H A 35 GLN H 1.0 . 3.62 2232 1919 A 34 ASP H A 35 GLN H 1.0 . 3.40 2233 1920 A 35 GLN HGx A 35 GLN HE22 1.0 . 3.79 2234 1921 A 35 GLN HGx A 35 GLN HE21 1.0 . 3.45 2235 1922 A 35 GLN HE21 A 122 LEU HD2% 1.0 . 4.02 2236 1923 A 36 LEU HBy A 36 LEU H 1.0 . 3.29 2237 1924 A 37 TYR H A 30 VAL H 1.0 . 3.93 2238 1925 A 37 TYR H A 37 TYR HD% 1.0 . 4.04 2239 1926 A 37 TYR H A 37 TYR HB2 1.0 . 4.09 2240 1927 A 37 TYR H A 37 TYR HB3 1.0 . 4.09 2241 1928 A 37 TYR H A 36 LEU HBy 1.0 . 4.52 2242 1929 A 37 TYR H A 36 LEU HG 1.0 . 3.80 2243 1930 A 120 ALA HB% A 37 TYR H 1.0 . 4.92 2244 1931 A 36 LEU HD1% A 37 TYR H 1.0 . 3.64 2245 1932 A 123 ILE HD1% A 37 TYR H 1.0 . 4.53 2246 1933 A 38 HIS H A 123 ILE H 1.0 . 4.22 2247 1934 A 37 TYR HD% A 38 HIS H 1.0 . 4.45 2248 1935 A 38 HIS HBx A 38 HIS H 1.0 . 3.68 2249 1936 A 38 HIS H A 37 TYR HB2 1.0 . 4.27 2250 1937 A 38 HIS H A 37 TYR HB3 1.0 . 4.27 2251 1938 A 38 HIS H A 40 LYS HD2 1.0 . 4.55 2252 1938 A 40 LYS HD3 A 38 HIS H 1.0 . 4.55 2253 1939 A 123 ILE HG1x A 38 HIS H 1.0 . 4.19 2254 1940 A 120 ALA HB% A 38 HIS H 1.0 . 3.83 2255 1941 A 123 ILE HD1% A 38 HIS H 1.0 . 3.81 2256 1942 A 29 GLN HA A 39 LEU H 1.0 . 4.10 2257 1943 A 38 HIS HA A 39 LEU H 1.0 . 3.53 2258 1944 A 38 HIS HBx A 39 LEU H 1.0 . 3.96 2259 1945 A 29 GLN HGx A 39 LEU H 1.0 . 5.35 2260 1946 A 39 LEU HBy A 39 LEU H 1.0 . 3.56 2261 1947 A 39 LEU HG A 39 LEU H 1.0 . 4.02 2262 1948 A 39 LEU HBx A 39 LEU H 1.0 . 3.67 2263 1949 A 39 LEU H A 39 LEU HD2% 1.0 . 4.05 2264 1950 A 39 LEU H A 39 LEU HD1% 1.0 . 4.05 2265 1951 A 39 LEU HA A 40 LYS H 1.0 . 3.45 2266 1952 A 40 LYS H A 40 LYS HBy 1.0 . 3.92 2267 1953 A 40 LYS H A 40 LYS HBx 1.0 . 3.92 2268 1954 A 40 LYS H A 40 LYS HG2 1.0 . 3.73 2269 1954 A 40 LYS HG3 A 40 LYS H 1.0 . 3.73 2270 1955 A 39 LEU HBx A 40 LYS H 1.0 . 3.46 2271 1956 A 119 ARG HDx A 41 GLU H 1.0 . 4.54 2272 1957 A 41 GLU H A 118 TYR HB2 1.0 . 4.71 2273 1957 A 118 TYR HB3 A 41 GLU H 1.0 . 4.71 2274 1958 A 41 GLU HGx A 41 GLU H 1.0 . 3.12 2275 1959 A 41 GLU HBx A 41 GLU H 1.0 . 3.36 2276 1960 A 41 GLU H A 40 LYS HG2 1.0 . 3.62 2277 1960 A 40 LYS HG3 A 41 GLU H 1.0 . 3.62 2278 1961 A 40 LYS H A 41 GLU H 1.0 . 3.66 2279 1962 A 42 LYS H A 41 GLU HBy 1.0 . 3.20 2280 1963 A 42 LYS HBx A 42 LYS H 1.0 . 3.15 2281 1964 A 42 LYS HBx A 43 VAL H 1.0 . 4.20 2282 1965 A 42 LYS HGx A 43 VAL H 1.0 . 3.78 2283 1966 A 43 VAL HG1% A 43 VAL H 1.0 . 3.37 2284 1967 A 43 VAL HG2% A 43 VAL H 1.0 . 3.24 2285 1968 A 44 ASP HBx A 44 ASP H 1.0 . 3.26 2286 1969 A 44 ASP HBy A 44 ASP H 1.0 . 3.14 2287 1970 A 43 VAL HB A 44 ASP H 1.0 . 3.03 2288 1971 A 43 VAL HG2% A 44 ASP H 1.0 . 3.60 2289 1972 A 44 ASP HBx A 45 GLU H 1.0 . 3.26 2290 1973 A 44 ASP HBy A 45 GLU H 1.0 . 4.05 2291 1974 A 45 GLU H A 45 GLU HB2 1.0 . 2.95 2292 1974 A 45 GLU HB3 A 45 GLU H 1.0 . 2.95 2293 1975 A 45 GLU H A 45 GLU HGx 1.0 . 3.27 2294 1976 A 46 ASP H A 47 LYS H 1.0 . 3.05 2295 1977 A 45 GLU HA A 46 ASP H 1.0 . 3.41 2296 1978 A 44 ASP HBx A 46 ASP H 1.0 . 3.05 2297 1979 A 46 ASP H A 46 ASP HBx 1.0 . 3.60 2298 1980 A 45 GLU H A 46 ASP H 1.0 . 3.18 2299 1981 A 45 GLU HA A 47 LYS H 1.0 . 3.87 2300 1982 A 44 ASP HBx A 47 LYS H 1.0 . 3.82 2301 1983 A 47 LYS H A 46 ASP HBx 1.0 . 4.28 2302 1984 A 47 LYS HBy A 47 LYS H 1.0 . 3.23 2303 1985 A 47 LYS HBx A 47 LYS H 1.0 . 3.73 2304 1986 A 47 LYS H A 47 LYS HD2 1.0 . 3.94 2305 1986 A 47 LYS HD3 A 47 LYS H 1.0 . 3.94 2306 1987 A 47 LYS HGx A 47 LYS H 1.0 . 3.66 2307 1988 A 47 LYS HA A 48 LYS H 1.0 . 3.49 2308 1989 A 45 GLU HA A 48 LYS H 1.0 . 4.07 2309 1990 A 48 LYS H A 48 LYS HE2 1.0 . 4.52 2310 1990 A 48 LYS HE3 A 48 LYS H 1.0 . 4.52 2311 1991 A 47 LYS HGx A 48 LYS H 1.0 . 4.11 2312 1992 A 48 LYS H A 48 LYS HBy 1.0 . 3.60 2313 1993 A 48 LYS H A 48 LYS HBx 1.0 . 3.60 2314 1994 A 48 LYS H A 48 LYS HG3 1.0 . 3.37 2315 1994 A 48 LYS H A 48 LYS HG2 1.0 . 3.37 2316 1995 A 47 LYS H A 48 LYS H 1.0 . 3.10 2317 1996 A 48 LYS H A 49 GLY H 1.0 . 4.74 2318 1997 A 49 GLY H A 48 LYS HBy 1.0 . 4.30 2319 1998 A 49 GLY H A 48 LYS HBx 1.0 . 4.30 2320 1999 A 110 ILE HD1% A 49 GLY H 1.0 . 3.97 2321 2000 A 49 GLY HAx A 50 LYS H 1.0 . 3.34 2322 2001 A 50 LYS H A 50 LYS HB2 1.0 . 3.53 2323 2001 A 50 LYS HB3 A 50 LYS H 1.0 . 3.53 2324 2002 A 50 LYS HGx A 50 LYS H 1.0 . 3.72 2325 2003 A 50 LYS HGy A 50 LYS H 1.0 . 4.18 2326 2004 A 50 LYS H A 98 SER H 1.0 . 4.11 2327 2005 A 50 LYS H A 51 VAL H 1.0 . 4.32 2328 2006 A 97 TYR HD% A 51 VAL H 1.0 . 4.12 2329 2007 A 50 LYS HA A 51 VAL H 1.0 . 2.93 2330 2008 A 97 TYR HB3 A 51 VAL H 1.0 . 5.19 2331 2009 A 51 VAL HB A 51 VAL H 1.0 . 2.94 2332 2010 A 51 VAL H A 50 LYS HB2 1.0 . 3.17 2333 2010 A 50 LYS HB3 A 51 VAL H 1.0 . 3.17 2334 2011 A 51 VAL H A 51 VAL HG1% 1.0 . 3.69 2335 2012 A 51 VAL H A 52 ILE H 1.0 . 4.59 2336 2013 A 51 VAL HB A 52 ILE H 1.0 . 4.47 2337 2014 A 52 ILE H A 52 ILE HG13 1.0 . 3.56 2338 2014 A 52 ILE H A 52 ILE HG12 1.0 . 3.56 2339 2015 A 96 VAL HB A 52 ILE H 1.0 . 5.01 2340 2016 A 54 ALA HB% A 53 GLY H 1.0 . 4.98 2341 2017 A 53 GLY H A 52 ILE HG13 1.0 . 3.50 2342 2017 A 53 GLY H A 52 ILE HG12 1.0 . 3.50 2343 2018 A 96 VAL HB A 53 GLY H 1.0 . 3.93 2344 2019 A 96 VAL HG1% A 53 GLY H 1.0 . 4.39 2345 2020 A 32 TYR HE% A 53 GLY H 1.0 . 4.71 2346 2021 A 52 ILE H A 53 GLY H 1.0 . 3.30 2347 2022 A 53 GLY H A 54 ALA H 1.0 . 4.45 2348 2023 A 32 TYR HD% A 54 ALA H 1.0 . 4.38 2349 2024 A 32 TYR HE% A 54 ALA H 1.0 . 3.70 2350 2025 A 54 ALA HB% A 54 ALA H 1.0 . 3.30 2351 2026 A 96 VAL HB A 54 ALA H 1.0 . 4.47 2352 2027 A 96 VAL HG2% A 54 ALA H 1.0 . 4.45 2353 2028 A 55 ILE H A 56 GLY H 1.0 . 3.82 2354 2029 A 95 LYS HA A 55 ILE H 1.0 . 3.95 2355 2030 A 56 GLY HAy A 55 ILE H 1.0 . 5.07 2356 2031 A 55 ILE H A 56 GLY HAx 1.0 . 4.92 2357 2032 A 55 ILE HB A 55 ILE H 1.0 . 3.83 2358 2033 A 55 ILE HG1x A 55 ILE H 1.0 . 4.14 2359 2034 A 54 ALA HB% A 55 ILE H 1.0 . 3.63 2360 2035 A 55 ILE HG1y A 55 ILE H 1.0 . 4.06 2361 2036 A 55 ILE HG2% A 55 ILE H 1.0 . 4.10 2362 2037 A 55 ILE HD1% A 55 ILE H 1.0 . 3.97 2363 2038 A 96 VAL HG2% A 55 ILE H 1.0 . 4.12 2364 2039 A 55 ILE HB A 56 GLY H 1.0 . 3.77 2365 2040 A 55 ILE HG2% A 56 GLY H 1.0 . 3.78 2366 2041 A 55 ILE HD1% A 56 GLY H 1.0 . 4.71 2367 2042 A 93 TYR HD% A 57 GLN H 1.0 . 3.98 2368 2043 A 93 TYR HBy A 57 GLN H 1.0 . 3.76 2369 2044 A 93 TYR HBx A 57 GLN H 1.0 . 4.08 2370 2045 A 57 GLN HGy A 57 GLN H 1.0 . 3.65 2371 2046 A 57 GLN H A 57 GLN HB3 1.0 . 3.93 2372 2047 A 55 ILE HG2% A 57 GLN H 1.0 . 3.36 2373 2048 A 55 ILE HD1% A 57 GLN H 1.0 . 5.26 2374 2049 A 57 GLN H A 93 TYR H 1.0 . 4.33 2375 2050 A 55 ILE H A 57 GLN H 1.0 . 5.50 2376 2051 A 56 GLY H A 57 GLN H 1.0 . 3.73 2377 2052 A 55 ILE HA A 57 GLN HE21 1.0 . 4.71 2378 2053 A 18 MET HGy A 57 GLN HE21 1.0 . 4.52 2379 2054 A 18 MET HGx A 57 GLN HE21 1.0 . 3.62 2380 2055 A 55 ILE HG2% A 57 GLN HE21 1.0 . 3.92 2381 2056 A 18 MET HGx A 57 GLN HE22 1.0 . 3.40 2382 2057 A 57 GLN HE22 A 18 MET HBy 1.0 . 4.62 2383 2058 A 57 GLN HE22 A 18 MET HBx 1.0 . 4.62 2384 2059 A 55 ILE HG2% A 57 GLN HE22 1.0 . 4.61 2385 2060 A 59 PHE HE% A 58 THR H 1.0 . 4.44 2386 2061 A 58 THR HB A 58 THR H 1.0 . 3.63 2387 2062 A 58 THR H A 57 GLN HB2 1.0 . 3.87 2388 2063 A 59 PHE HD% A 59 PHE H 1.0 . 3.78 2389 2064 A 59 PHE HE% A 59 PHE H 1.0 . 5.41 2390 2065 A 93 TYR HE% A 59 PHE H 1.0 . 4.65 2391 2066 A 58 THR HB A 59 PHE H 1.0 . 4.40 2392 2067 A 59 PHE HBx A 59 PHE H 1.0 . 4.10 2393 2068 A 59 PHE HBy A 59 PHE H 1.0 . 4.02 2394 2069 A 59 PHE H A 92 ARG HG2 1.0 . 4.67 2395 2069 A 92 ARG HG3 A 59 PHE H 1.0 . 4.67 2396 2070 A 58 THR HG2% A 59 PHE H 1.0 . 3.46 2397 2071 A 22 ILE HD1% A 59 PHE H 1.0 . 4.62 2398 2072 A 59 PHE HD% A 60 PHE H 1.0 . 4.15 2399 2073 A 60 PHE HD% A 60 PHE H 1.0 . 3.88 2400 2074 A 59 PHE HBy A 60 PHE H 1.0 . 4.68 2401 2075 A 60 PHE H A 67 ARG HDx 1.0 . 4.84 2402 2076 A 22 ILE HD1% A 60 PHE H 1.0 . 4.71 2403 2077 A 60 PHE HBy A 61 VAL H 1.0 . 4.10 2404 2078 A 60 PHE HBx A 61 VAL H 1.0 . 3.88 2405 2079 A 61 VAL H A 89 LYS HB2 1.0 . 3.67 2406 2079 A 89 LYS HB3 A 61 VAL H 1.0 . 3.67 2407 2080 A 61 VAL HG2% A 61 VAL H 1.0 . 3.19 2408 2081 A 61 VAL HG1% A 61 VAL H 1.0 . 3.87 2409 2082 A 61 VAL H A 89 LYS H 1.0 . 3.97 2410 2083 A 63 GLY H A 86 ARG HE 1.0 . 4.93 2411 2084 A 63 GLY H A 62 ASP HBy 1.0 . 4.25 2412 2085 A 63 GLY H A 87 GLU HBx 1.0 . 4.92 2413 2086 A 62 ASP HA A 64 ASP H 1.0 . 4.27 2414 2087 A 64 ASP H A 64 ASP HBy 1.0 . 3.29 2415 2088 A 64 ASP HBx A 64 ASP H 1.0 . 3.29 2416 2089 A 63 GLY H A 64 ASP H 1.0 . 3.45 2417 2090 A 64 ASP HBx A 65 GLY H 1.0 . 3.93 2418 2091 A 61 VAL HB A 65 GLY H 1.0 . 3.73 2419 2092 A 63 GLY H A 65 GLY H 1.0 . 4.26 2420 2093 A 64 ASP H A 65 GLY H 1.0 . 2.95 2421 2094 A 65 GLY H A 66 LYS H 1.0 . 3.36 2422 2095 A 61 VAL HA A 67 ARG H 1.0 . 5.05 2423 2096 A 66 LYS HA A 67 ARG H 1.0 . 3.00 2424 2097 A 67 ARG H A 67 ARG HBx 1.0 . 3.76 2425 2098 A 67 ARG H A 66 LYS HB2 1.0 . 3.34 2426 2098 A 66 LYS HB3 A 67 ARG H 1.0 . 3.34 2427 2099 A 67 ARG H A 66 LYS HG3 1.0 . 4.54 2428 2099 A 67 ARG H A 66 LYS HG2 1.0 . 4.54 2429 2100 A 61 VAL HG1% A 67 ARG H 1.0 . 4.15 2430 2101 A 22 ILE HG2% A 67 ARG H 1.0 . 4.51 2431 2102 A 67 ARG H A 68 TRP H 1.0 . 4.60 2432 2103 A 67 ARG HE A 67 ARG HG2 1.0 . 3.86 2433 2103 A 67 ARG HG3 A 67 ARG HE 1.0 . 3.86 2434 2104 A 22 ILE HG2% A 67 ARG HE 1.0 . 5.19 2435 2105 A 61 VAL HA A 68 TRP H 1.0 . 4.07 2436 2106 A 68 TRP HB2 A 68 TRP H 1.0 . 3.99 2437 2107 A 60 PHE HBy A 68 TRP H 1.0 . 4.60 2438 2108 A 60 PHE HBx A 68 TRP H 1.0 . 4.86 2439 2109 A 68 TRP H A 67 ARG HG2 1.0 . 4.21 2440 2109 A 67 ARG HG3 A 68 TRP H 1.0 . 4.21 2441 2110 A 61 VAL HG2% A 68 TRP H 1.0 . 5.33 2442 2111 A 61 VAL HG1% A 68 TRP H 1.0 . 3.94 2443 2112 A 88 LYS HA A 68 TRP HE1 1.0 . 3.58 2444 2113 A 60 PHE HBx A 68 TRP HE1 1.0 . 5.04 2445 2114 A 88 LYS HBy A 68 TRP HE1 1.0 . 4.29 2446 2115 A 68 TRP HB2 A 69 SER H 1.0 . 4.25 2447 2116 A 72 GLU HB3 A 69 SER H 1.0 . 4.41 2448 2117 A 70 GLU H A 70 GLU HG2 1.0 . 3.88 2449 2118 A 70 GLU H A 70 GLU HB2 1.0 . 3.00 2450 2119 A 72 GLU H A 71 GLU H 1.0 . 3.71 2451 2120 A 71 GLU HG2 A 71 GLU H 1.0 . 3.26 2452 2121 A 71 GLU H A 70 GLU HB2 1.0 . 3.16 2453 2122 A 70 GLU H A 71 GLU H 1.0 . 3.54 2454 2123 A 71 GLU HG3 A 72 GLU H 1.0 . 4.16 2455 2124 A 72 GLU H A 72 GLU HB2 1.0 . 3.46 2456 2125 A 72 GLU H A 73 LEU H 1.0 . 3.82 2457 2126 A 68 TRP HZ3 A 73 LEU H 1.0 . 5.02 2458 2127 A 72 GLU HB2 A 73 LEU H 1.0 . 3.37 2459 2128 A 73 LEU HG A 73 LEU H 1.0 . 3.77 2460 2129 A 73 LEU H A 73 LEU HBx 1.0 . 3.81 2461 2130 A 73 LEU H A 73 LEU HD2% 1.0 . 3.84 2462 2131 A 73 LEU H A 73 LEU HD1% 1.0 . 3.84 2463 2132 A 71 GLU H A 73 LEU H 1.0 . 4.47 2464 2133 A 74 LYS H A 75 GLU HGx 1.0 . 5.18 2465 2134 A 74 LYS H A 74 LYS HB2 1.0 . 3.56 2466 2134 A 74 LYS H A 74 LYS HB3 1.0 . 3.56 2467 2135 A 74 LYS H A 74 LYS HD2 1.0 . 3.80 2468 2135 A 74 LYS HD3 A 74 LYS H 1.0 . 3.80 2469 2136 A 74 LYS H A 74 LYS HGx 1.0 . 4.49 2470 2137 A 74 LYS H A 73 LEU HD1% 1.0 . 4.95 2471 2138 A 73 LEU H A 74 LYS H 1.0 . 3.46 2472 2139 A 72 GLU H A 74 LYS H 1.0 . 4.24 2473 2140 A 73 LEU H A 75 GLU H 1.0 . 4.16 2474 2141 A 75 GLU H A 76 PRO HDy 1.0 . 5.13 2475 2142 A 75 GLU H A 76 PRO HDx 1.0 . 5.13 2476 2143 A 75 GLU H A 75 GLU HGy 1.0 . 4.05 2477 2144 A 75 GLU H A 75 GLU HB2 1.0 . 3.78 2478 2145 A 72 GLU H A 75 GLU H 1.0 . 5.33 2479 2146 A 61 VAL HA A 66 LYS H 1.0 . 4.41 2480 2147 A 65 GLY HAx A 66 LYS H 1.0 . 3.52 2481 2148 A 77 TYR H A 76 PRO HBy 1.0 . 4.21 2482 2149 A 64 ASP HBx A 66 LYS H 1.0 . 3.93 2483 2150 A 61 VAL HB A 66 LYS H 1.0 . 3.28 2484 2151 A 61 VAL HG1% A 66 LYS H 1.0 . 4.16 2485 2152 A 77 TYR H A 76 PRO HA 1.0 . 2.82 2486 2153 A 77 TYR H A 77 TYR HBy 1.0 . 3.76 2487 2154 A 77 TYR HD% A 78 ILE H 1.0 . 3.66 2488 2155 A 78 ILE H A 77 TYR HBy 1.0 . 3.99 2489 2156 A 78 ILE H A 78 ILE HG1y 1.0 . 3.59 2490 2157 A 78 ILE H A 78 ILE HG1x 1.0 . 3.59 2491 2158 A 78 ILE HG2% A 78 ILE H 1.0 . 3.36 2492 2159 A 78 ILE H A 79 SER H 1.0 . 4.74 2493 2160 A 78 ILE HB A 79 SER H 1.0 . 3.24 2494 2161 A 79 SER H A 80 ASN H 1.0 . 4.40 2495 2162 A 80 ASN H A 80 ASN HB3 1.0 . 3.60 2496 2162 A 80 ASN H A 80 ASN HB2 1.0 . 3.60 2497 2163 A 80 ASN HD21 A 80 ASN HB3 1.0 . 3.66 2498 2163 A 80 ASN HB2 A 80 ASN HD21 1.0 . 3.66 2499 2164 A 80 ASN HD22 A 80 ASN HB3 1.0 . 3.66 2500 2164 A 80 ASN HB2 A 80 ASN HD22 1.0 . 3.66 2501 2165 A 81 ASN H A 82 PRO HD2 1.0 . 3.64 2502 2165 A 82 PRO HD3 A 81 ASN H 1.0 . 3.64 2503 2166 A 81 ASN H A 81 ASN HBy 1.0 . 3.93 2504 2167 A 80 ASN H A 81 ASN H 1.0 . 3.62 2505 2168 A 81 ASN HD21 A 84 GLU HG2 1.0 . 4.09 2506 2168 A 84 GLU HG3 A 81 ASN HD21 1.0 . 4.09 2507 2169 A 81 ASN HD22 A 84 GLU HG2 1.0 . 4.09 2508 2169 A 84 GLU HG3 A 81 ASN HD22 1.0 . 4.09 2509 2170 A 82 PRO HA A 83 ASP H 1.0 . 3.40 2510 2171 A 83 ASP H A 82 PRO HD2 1.0 . 3.29 2511 2171 A 82 PRO HD3 A 83 ASP H 1.0 . 3.29 2512 2172 A 83 ASP HBy A 83 ASP H 1.0 . 3.14 2513 2173 A 83 ASP H A 83 ASP HBx 1.0 . 2.96 2514 2174 A 83 ASP H A 84 GLU HG2 1.0 . 4.64 2515 2174 A 84 GLU HG3 A 83 ASP H 1.0 . 4.64 2516 2175 A 83 ASP H A 82 PRO HG2 1.0 . 3.09 2517 2175 A 82 PRO HG3 A 83 ASP H 1.0 . 3.09 2518 2176 A 84 GLU H A 83 ASP HBx 1.0 . 3.56 2519 2177 A 84 GLU H A 84 GLU HG2 1.0 . 3.05 2520 2177 A 84 GLU HG3 A 84 GLU H 1.0 . 3.05 2521 2178 A 83 ASP H A 84 GLU H 1.0 . 2.81 2522 2179 A 85 ILE H A 85 ILE HG1y 1.0 . 3.61 2523 2180 A 85 ILE H A 85 ILE HG1x 1.0 . 3.61 2524 2181 A 85 ILE HG2% A 85 ILE H 1.0 . 3.23 2525 2182 A 84 GLU H A 85 ILE H 1.0 . 3.08 2526 2183 A 85 ILE H A 86 ARG H 1.0 . 4.72 2527 2184 A 68 TRP HZ2 A 86 ARG H 1.0 . 4.14 2528 2185 A 85 ILE HA A 86 ARG H 1.0 . 2.82 2529 2186 A 86 ARG H A 86 ARG HBy 1.0 . 3.56 2530 2187 A 86 ARG H A 86 ARG HBx 1.0 . 3.56 2531 2188 A 86 ARG H A 87 GLU H 1.0 . 4.67 2532 2189 A 64 ASP HBy A 86 ARG HE 1.0 . 4.47 2533 2190 A 64 ASP HBx A 86 ARG HE 1.0 . 5.21 2534 2191 A 86 ARG HA A 87 GLU H 1.0 . 3.32 2535 2192 A 87 GLU HGy A 87 GLU H 1.0 . 3.54 2536 2193 A 87 GLU HGx A 87 GLU H 1.0 . 3.76 2537 2194 A 87 GLU H A 87 GLU HBx 1.0 . 3.43 2538 2195 A 87 GLU HBy A 87 GLU H 1.0 . 3.77 2539 2196 A 87 GLU HGy A 88 LYS H 1.0 . 4.61 2540 2197 A 88 LYS H A 87 GLU HBx 1.0 . 3.85 2541 2198 A 87 GLU HBy A 88 LYS H 1.0 . 3.76 2542 2199 A 88 LYS HBx A 88 LYS H 1.0 . 3.68 2543 2200 A 88 LYS HBy A 88 LYS H 1.0 . 3.66 2544 2201 A 88 LYS HGx A 88 LYS H 1.0 . 5.03 2545 2202 A 88 LYS HGy A 88 LYS H 1.0 . 4.88 2546 2203 A 88 LYS H A 89 LYS H 1.0 . 4.07 2547 2204 A 87 GLU H A 88 LYS H 1.0 . 4.73 2548 2205 A 60 PHE HD% A 89 LYS H 1.0 . 4.85 2549 2206 A 88 LYS HA A 89 LYS H 1.0 . 3.31 2550 2207 A 60 PHE HBx A 89 LYS H 1.0 . 4.14 2551 2208 A 89 LYS H A 89 LYS HB2 1.0 . 3.33 2552 2208 A 89 LYS HB3 A 89 LYS H 1.0 . 3.33 2553 2209 A 89 LYS H A 89 LYS HDy 1.0 . 4.94 2554 2210 A 89 LYS HGy A 89 LYS H 1.0 . 3.91 2555 2211 A 88 LYS HBx A 89 LYS H 1.0 . 4.74 2556 2212 A 61 VAL HG2% A 89 LYS H 1.0 . 3.88 2557 2213 A 88 LYS HGx A 89 LYS H 1.0 . 4.63 2558 2214 A 88 LYS HGy A 89 LYS H 1.0 . 4.47 2559 2215 A 89 LYS H A 68 TRP HE1 1.0 . 4.71 2560 2216 A 60 PHE HE% A 91 LEU H 1.0 . 5.01 2561 2217 A 90 PRO HA A 91 LEU H 1.0 . 3.31 2562 2218 A 59 PHE HBy A 91 LEU H 1.0 . 4.59 2563 2219 A 60 PHE HBx A 91 LEU H 1.0 . 5.50 2564 2220 A 91 LEU H A 90 PRO HBy 1.0 . 4.15 2565 2221 A 91 LEU HG A 91 LEU H 1.0 . 4.42 2566 2222 A 91 LEU H A 91 LEU HD1% 1.0 . 4.35 2567 2223 A 91 LEU H A 91 LEU HD2% 1.0 . 4.35 2568 2224 A 93 TYR HD% A 92 ARG H 1.0 . 5.50 2569 2225 A 113 PHE HZ A 92 ARG H 1.0 . 5.50 2570 2226 A 113 PHE HE% A 92 ARG H 1.0 . 4.01 2571 2227 A 92 ARG H A 114 ASN HD21 1.0 . 4.39 2572 2228 A 113 PHE HD% A 92 ARG H 1.0 . 4.23 2573 2229 A 91 LEU HA A 92 ARG H 1.0 . 3.24 2574 2230 A 92 ARG H A 92 ARG HDy 1.0 . 4.73 2575 2231 A 92 ARG H A 92 ARG HDx 1.0 . 4.73 2576 2232 A 92 ARG H A 92 ARG HB2 1.0 . 3.29 2577 2232 A 92 ARG HB3 A 92 ARG H 1.0 . 3.29 2578 2233 A 92 ARG H A 92 ARG HG2 1.0 . 3.89 2579 2233 A 92 ARG HG3 A 92 ARG H 1.0 . 3.89 2580 2234 A 91 LEU H A 92 ARG H 1.0 . 4.48 2581 2235 A 93 TYR HD% A 93 TYR H 1.0 . 3.53 2582 2236 A 93 TYR HBy A 93 TYR H 1.0 . 3.92 2583 2237 A 93 TYR H A 92 ARG HB2 1.0 . 3.80 2584 2237 A 92 ARG HB3 A 93 TYR H 1.0 . 3.80 2585 2238 A 55 ILE HG2% A 93 TYR H 1.0 . 4.46 2586 2239 A 58 THR HG2% A 93 TYR H 1.0 . 4.12 2587 2240 A 93 TYR HD% A 94 GLY H 1.0 . 4.22 2588 2241 A 113 PHE HD% A 94 GLY H 1.0 . 4.99 2589 2242 A 93 TYR HBy A 94 GLY H 1.0 . 4.50 2590 2243 A 93 TYR HBx A 94 GLY H 1.0 . 4.41 2591 2244 A 112 GLU HBy A 94 GLY H 1.0 . 4.70 2592 2245 A 112 GLU HGx A 94 GLY H 1.0 . 5.30 2593 2246 A 112 GLU HGy A 94 GLY H 1.0 . 4.42 2594 2247 A 55 ILE HD1% A 94 GLY H 1.0 . 4.36 2595 2248 A 94 GLY H A 113 PHE H 1.0 . 4.91 2596 2249 A 114 ASN H A 94 GLY H 1.0 . 5.25 2597 2250 A 97 TYR HE% A 95 LYS H 1.0 . 4.88 2598 2251 A 95 LYS H A 95 LYS HE2 1.0 . 4.78 2599 2251 A 95 LYS HE3 A 95 LYS H 1.0 . 4.78 2600 2252 A 112 GLU HBy A 95 LYS H 1.0 . 4.23 2601 2253 A 95 LYS HBy A 95 LYS H 1.0 . 3.89 2602 2254 A 94 GLY H A 95 LYS H 1.0 . 4.49 2603 2255 A 95 LYS HGy A 96 VAL H 1.0 . 3.64 2604 2256 A 96 VAL HB A 96 VAL H 1.0 . 3.58 2605 2257 A 96 VAL HG2% A 96 VAL H 1.0 . 3.82 2606 2258 A 96 VAL HG1% A 96 VAL H 1.0 . 4.13 2607 2259 A 55 ILE H A 96 VAL H 1.0 . 4.19 2608 2260 A 97 TYR HD% A 97 TYR H 1.0 . 3.71 2609 2261 A 110 ILE HB A 97 TYR H 1.0 . 4.25 2610 2262 A 96 VAL HB A 97 TYR H 1.0 . 4.48 2611 2263 A 96 VAL HG2% A 97 TYR H 1.0 . 4.28 2612 2264 A 96 VAL HG1% A 97 TYR H 1.0 . 3.80 2613 2265 A 51 VAL HA A 98 SER H 1.0 . 4.01 2614 2266 A 97 TYR HB2 A 98 SER H 1.0 . 3.96 2615 2267 A 97 TYR HB3 A 98 SER H 1.0 . 4.26 2616 2268 A 98 SER H A 50 LYS HB2 1.0 . 4.78 2617 2268 A 50 LYS HB3 A 98 SER H 1.0 . 4.78 2618 2269 A 52 ILE HG2% A 98 SER H 1.0 . 3.62 2619 2270 A 52 ILE HD1% A 98 SER H 1.0 . 4.25 2620 2271 A 110 ILE HD1% A 98 SER H 1.0 . 4.81 2621 2272 A 109 ILE HG2% A 98 SER H 1.0 . 4.94 2622 2273 A 99 THR HG2% A 99 THR H 1.0 . 3.41 2623 2274 A 52 ILE HG2% A 99 THR H 1.0 . 5.24 2624 2275 A 49 GLY HAx A 100 ASN H 1.0 . 5.19 2625 2276 A 110 ILE HD1% A 100 ASN H 1.0 . 4.87 2626 2277 A 101 GLU H A 100 ASN HB2 1.0 . 3.99 2627 2277 A 101 GLU H A 100 ASN HB3 1.0 . 3.99 2628 2278 A 101 GLU H A 101 GLU HG2 1.0 . 3.58 2629 2278 A 101 GLU H A 101 GLU HG3 1.0 . 3.58 2630 2279 A 101 GLU H A 101 GLU HBy 1.0 . 3.95 2631 2280 A 101 GLU H A 101 GLU HBx 1.0 . 3.95 2632 2281 A 101 GLU HA A 102 ASP H 1.0 . 3.35 2633 2282 A 102 ASP H A 102 ASP HBx 1.0 . 3.79 2634 2283 A 101 GLU H A 102 ASP H 1.0 . 3.42 2635 2284 A 103 SER H A 104 ASP HA 1.0 . 5.05 2636 2285 A 103 SER H A 103 SER HB2 1.0 . 4.11 2637 2286 A 103 SER H A 104 ASP H 1.0 . 4.52 2638 2287 A 102 ASP H A 103 SER H 1.0 . 3.40 2639 2288 A 104 ASP H A 105 ALA H 1.0 . 3.12 2640 2289 A 104 ASP H A 105 ALA HB% 1.0 . 4.24 2641 2290 A 103 SER HA A 105 ALA H 1.0 . 4.39 2642 2291 A 105 ALA H A 104 ASP HBy 1.0 . 4.66 2643 2292 A 105 ALA H A 105 ALA HB% 1.0 . 2.63 2644 2293 A 105 ALA H A 106 LYS H 1.0 . 4.16 2645 2294 A 106 LYS H A 108 GLU H 1.0 . 4.57 2646 2295 A 106 LYS H A 107 ASP HB2 1.0 . 5.15 2647 2295 A 107 ASP HB3 A 106 LYS H 1.0 . 5.15 2648 2296 A 106 LYS H A 101 GLU HG2 1.0 . 4.37 2649 2296 A 106 LYS H A 101 GLU HG3 1.0 . 4.37 2650 2297 A 106 LYS H A 106 LYS HBy 1.0 . 4.16 2651 2298 A 106 LYS H A 106 LYS HBx 1.0 . 4.16 2652 2299 A 106 LYS H A 105 ALA HB% 1.0 . 2.92 2653 2300 A 107 ASP H A 107 ASP HB2 1.0 . 3.12 2654 2300 A 107 ASP HB3 A 107 ASP H 1.0 . 3.12 2655 2301 A 107 ASP H A 106 LYS HBy 1.0 . 4.73 2656 2302 A 107 ASP H A 106 LYS HBx 1.0 . 4.73 2657 2303 A 107 ASP H A 105 ALA HB% 1.0 . 3.30 2658 2304 A 108 GLU HG3 A 108 GLU H 1.0 . 4.16 2659 2305 A 108 GLU HBy A 108 GLU H 1.0 . 3.76 2660 2306 A 108 GLU HBx A 108 GLU H 1.0 . 3.33 2661 2307 A 109 ILE HG2% A 108 GLU H 1.0 . 3.99 2662 2308 A 107 ASP H A 108 GLU H 1.0 . 3.03 2663 2309 A 24 LYS H A 26 LYS H 1.0 . 4.12 2664 2310 A 108 GLU HG2 A 109 ILE H 1.0 . 3.89 2665 2311 A 108 GLU HBy A 109 ILE H 1.0 . 3.75 2666 2312 A 109 ILE H A 108 GLU HBx 1.0 . 4.41 2667 2313 A 120 ALA HB% A 109 ILE H 1.0 . 3.78 2668 2314 A 109 ILE H A 109 ILE HG1y 1.0 . 4.04 2669 2315 A 109 ILE HG2% A 109 ILE H 1.0 . 3.81 2670 2316 A 109 ILE H A 109 ILE HG1x 1.0 . 3.95 2671 2317 A 109 ILE HD1% A 109 ILE H 1.0 . 3.97 2672 2318 A 120 ALA H A 109 ILE H 1.0 . 4.20 2673 2319 A 110 ILE H A 97 TYR HD% 1.0 . 4.56 2674 2320 A 97 TYR HB3 A 110 ILE H 1.0 . 5.35 2675 2321 A 112 GLU HBy A 118 TYR H 1.0 . 5.50 2676 2322 A 110 ILE HB A 110 ILE H 1.0 . 3.47 2677 2323 A 110 ILE HG1x A 110 ILE H 1.0 . 4.44 2678 2324 A 110 ILE H A 110 ILE HG1y 1.0 . 3.81 2679 2325 A 110 ILE HG2% A 118 TYR H 1.0 . 3.45 2680 2326 A 110 ILE H A 110 ILE HD1% 1.0 . 3.92 2681 2327 A 43 VAL HG2% A 118 TYR H 1.0 . 4.27 2682 2328 A 110 ILE H A 96 VAL HG1% 1.0 . 4.00 2683 2329 A 110 ILE H A 109 ILE HD1% 1.0 . 4.26 2684 2330 A 111 VAL H A 118 TYR H 1.0 . 4.04 2685 2331 A 111 VAL H A 118 TYR HD% 1.0 . 5.41 2686 2332 A 111 VAL H A 110 ILE HA 1.0 . 3.41 2687 2333 A 111 VAL H A 118 TYR HB2 1.0 . 4.11 2688 2333 A 111 VAL H A 118 TYR HB3 1.0 . 4.11 2689 2334 A 111 VAL H A 117 TYR HBx 1.0 . 5.36 2690 2335 A 110 ILE HG1x A 111 VAL H 1.0 . 5.50 2691 2336 A 111 VAL H A 119 ARG HG3 1.0 . 5.50 2692 2336 A 111 VAL H A 119 ARG HG2 1.0 . 5.50 2693 2337 A 111 VAL H A 120 ALA HB% 1.0 . 3.83 2694 2338 A 111 VAL H A 111 VAL HG2% 1.0 . 3.88 2695 2339 A 110 ILE HG2% A 111 VAL H 1.0 . 3.35 2696 2340 A 111 VAL H A 111 VAL HG1% 1.0 . 3.88 2697 2341 A 111 VAL H A 109 ILE HD1% 1.0 . 4.79 2698 2342 A 97 TYR HE% A 112 GLU H 1.0 . 4.11 2699 2343 A 112 GLU H A 112 GLU HBx 1.0 . 3.81 2700 2344 A 112 GLU H A 111 VAL HB 1.0 . 4.41 2701 2345 A 112 GLU H A 111 VAL HG2% 1.0 . 4.22 2702 2346 A 112 GLU H A 111 VAL HG1% 1.0 . 4.22 2703 2347 A 96 VAL HG2% A 112 GLU H 1.0 . 4.55 2704 2348 A 112 GLU H A 111 VAL H 1.0 . 4.52 2705 2349 A 118 TYR H A 113 PHE H 1.0 . 4.66 2706 2350 A 118 TYR HD% A 113 PHE H 1.0 . 3.97 2707 2351 A 113 PHE HD% A 114 ASN H 1.0 . 3.79 2708 2352 A 92 ARG HA A 114 ASN H 1.0 . 5.50 2709 2353 A 115 ARG HA A 113 PHE H 1.0 . 5.44 2710 2354 A 115 ARG HA A 114 ASN H 1.0 . 5.50 2711 2355 A 114 ASN H A 115 ARG HD2 1.0 . 4.80 2712 2355 A 115 ARG HD3 A 114 ASN H 1.0 . 4.80 2713 2356 A 113 PHE HBx A 113 PHE H 1.0 . 3.93 2714 2357 A 113 PHE H A 116 GLU HB2 1.0 . 3.78 2715 2357 A 116 GLU HB3 A 113 PHE H 1.0 . 3.78 2716 2358 A 114 ASN H A 92 ARG HB2 1.0 . 3.95 2717 2358 A 92 ARG HB3 A 114 ASN H 1.0 . 3.95 2718 2359 A 114 ASN H A 115 ARG HG2 1.0 . 4.93 2719 2359 A 115 ARG HG3 A 114 ASN H 1.0 . 4.93 2720 2360 A 113 PHE HE% A 114 ASN H 1.0 . 4.44 2721 2361 A 91 LEU HA A 114 ASN HD21 1.0 . 4.24 2722 2362 A 90 PRO HG2 A 114 ASN HD21 1.0 . 5.45 2723 2363 A 91 LEU HA A 114 ASN HD22 1.0 . 4.24 2724 2364 A 115 ARG H A 115 ARG HG2 1.0 . 3.36 2725 2364 A 115 ARG HG3 A 115 ARG H 1.0 . 3.36 2726 2365 A 114 ASN H A 115 ARG H 1.0 . 3.84 2727 2366 A 118 TYR HD% A 116 GLU H 1.0 . 5.16 2728 2367 A 117 TYR HD% A 116 GLU H 1.0 . 4.87 2729 2368 A 115 ARG HA A 116 GLU H 1.0 . 3.47 2730 2369 A 116 GLU H A 115 ARG HD2 1.0 . 5.17 2731 2369 A 115 ARG HD3 A 116 GLU H 1.0 . 5.17 2732 2370 A 112 GLU HGx A 116 GLU H 1.0 . 3.21 2733 2371 A 116 GLU H A 116 GLU HB2 1.0 . 3.12 2734 2371 A 116 GLU HB3 A 116 GLU H 1.0 . 3.12 2735 2372 A 116 GLU H A 115 ARG H 1.0 . 3.46 2736 2373 A 117 TYR H A 116 GLU H 1.0 . 4.29 2737 2374 A 118 TYR HD% A 43 VAL H 1.0 . 4.67 2738 2375 A 117 TYR HD% A 117 TYR H 1.0 . 3.53 2739 2376 A 117 TYR HBy A 117 TYR H 1.0 . 3.61 2740 2377 A 117 TYR H A 116 GLU HB2 1.0 . 3.38 2741 2377 A 116 GLU HB3 A 117 TYR H 1.0 . 3.38 2742 2378 A 118 TYR H A 43 VAL H 1.0 . 4.99 2743 2379 A 118 TYR H A 117 TYR H 1.0 . 5.41 2744 2380 A 118 TYR HE% A 43 VAL H 1.0 . 5.50 2745 2381 A 118 TYR HE% A 117 TYR H 1.0 . 5.50 2746 2382 A 118 TYR HD% A 118 TYR H 1.0 . 3.56 2747 2383 A 118 TYR H A 118 TYR HB2 1.0 . 3.56 2748 2383 A 118 TYR HB3 A 118 TYR H 1.0 . 3.56 2749 2384 A 117 TYR HBx A 118 TYR H 1.0 . 4.11 2750 2385 A 111 VAL HB A 118 TYR H 1.0 . 5.43 2751 2386 A 42 LYS HGx A 118 TYR H 1.0 . 5.49 2752 2387 A 110 ILE H A 120 ALA HB% 1.0 . 5.50 2753 2388 A 118 TYR H A 111 VAL HG2% 1.0 . 5.50 2754 2389 A 112 GLU HBx A 118 TYR H 1.0 . 5.50 2755 2390 A 118 TYR H A 116 GLU HB2 1.0 . 5.50 2756 2390 A 118 TYR H A 116 GLU HB3 1.0 . 5.50 2757 2391 A 118 TYR HA A 119 ARG H 1.0 . 3.52 2758 2392 A 119 ARG HDx A 119 ARG H 1.0 . 5.01 2759 2393 A 119 ARG H A 118 TYR HB2 1.0 . 3.72 2760 2393 A 118 TYR HB3 A 119 ARG H 1.0 . 3.72 2761 2394 A 41 GLU HGy A 119 ARG H 1.0 . 4.64 2762 2395 A 119 ARG HBy A 119 ARG H 1.0 . 3.60 2763 2396 A 119 ARG HBx A 119 ARG H 1.0 . 3.57 2764 2397 A 39 LEU HBx A 119 ARG H 1.0 . 5.50 2765 2398 A 42 LYS HGx A 119 ARG H 1.0 . 5.50 2766 2399 A 120 ALA HB% A 119 ARG H 1.0 . 5.50 2767 2400 A 43 VAL HG1% A 119 ARG H 1.0 . 3.63 2768 2401 A 43 VAL HG2% A 119 ARG H 1.0 . 4.14 2769 2402 A 41 GLU HGy A 119 ARG HE 1.0 . 4.72 2770 2403 A 119 ARG HBy A 119 ARG HE 1.0 . 4.06 2771 2404 A 119 ARG HBx A 119 ARG HE 1.0 . 3.75 2772 2405 A 43 VAL HG1% A 119 ARG HE 1.0 . 4.75 2773 2406 A 41 GLU H A 119 ARG HE 1.0 . 4.73 2774 2407 A 120 ALA H A 119 ARG H 1.0 . 4.68 2775 2408 A 120 ALA H A 119 ARG HDx 1.0 . 4.57 2776 2409 A 120 ALA H A 118 TYR HB2 1.0 . 5.22 2777 2409 A 120 ALA H A 118 TYR HB3 1.0 . 5.22 2778 2410 A 120 ALA H A 119 ARG HBy 1.0 . 4.59 2779 2411 A 120 ALA H A 119 ARG HBx 1.0 . 4.26 2780 2412 A 120 ALA H A 119 ARG HG3 1.0 . 4.00 2781 2412 A 120 ALA H A 119 ARG HG2 1.0 . 4.00 2782 2413 A 120 ALA H A 120 ALA HB% 1.0 . 3.36 2783 2414 A 110 ILE HG2% A 120 ALA H 1.0 . 4.10 2784 2415 A 43 VAL HG2% A 120 ALA H 1.0 . 5.50 2785 2416 A 109 ILE HG2% A 120 ALA H 1.0 . 5.50 2786 2417 A 120 ALA H A 109 ILE HD1% 1.0 . 4.70 2787 2418 A 38 HIS HBx A 121 VAL H 1.0 . 4.24 2788 2419 A 121 VAL H A 37 TYR HB2 1.0 . 4.62 2789 2420 A 121 VAL H A 37 TYR HB3 1.0 . 4.62 2790 2421 A 121 VAL H A 121 VAL HB 1.0 . 3.63 2791 2422 A 121 VAL H A 40 LYS HD2 1.0 . 4.04 2792 2422 A 121 VAL H A 40 LYS HD3 1.0 . 4.04 2793 2423 A 121 VAL H A 40 LYS HG2 1.0 . 4.08 2794 2423 A 121 VAL H A 40 LYS HG3 1.0 . 4.08 2795 2424 A 121 VAL H A 121 VAL HG1% 1.0 . 4.09 2796 2425 A 123 ILE HD1% A 121 VAL H 1.0 . 5.34 2797 2426 A 121 VAL H A 38 HIS H 1.0 . 3.95 2798 2427 A 121 VAL H A 40 LYS H 1.0 . 4.86 2799 2428 A 37 TYR HD% A 122 LEU H 1.0 . 4.32 2800 2429 A 121 VAL HA A 122 LEU H 1.0 . 3.38 2801 2430 A 122 LEU H A 107 ASP HB2 1.0 . 4.08 2802 2430 A 107 ASP HB3 A 122 LEU H 1.0 . 4.08 2803 2431 A 108 GLU HG2 A 122 LEU H 1.0 . 4.29 2804 2432 A 122 LEU H A 122 LEU HB2 1.0 . 3.13 2805 2432 A 122 LEU H A 122 LEU HB3 1.0 . 3.13 2806 2433 A 122 LEU H A 121 VAL HG2% 1.0 . 4.39 2807 2434 A 109 ILE H A 122 LEU H 1.0 . 4.84 2808 2435 A 122 LEU HA A 123 ILE H 1.0 . 3.41 2809 2436 A 123 ILE H A 124 LYS HBy 1.0 . 5.50 2810 2437 A 124 LYS HBx A 123 ILE H 1.0 . 5.50 2811 2438 A 123 ILE HB A 123 ILE H 1.0 . 3.33 2812 2439 A 123 ILE HG1x A 123 ILE H 1.0 . 3.70 2813 2440 A 123 ILE HG1y A 123 ILE H 1.0 . 4.08 2814 2441 A 123 ILE HG2% A 123 ILE H 1.0 . 3.82 2815 2442 A 124 LYS H A 124 LYS HE2 1.0 . 4.72 2816 2442 A 124 LYS HE3 A 124 LYS H 1.0 . 4.72 2817 2443 A 124 LYS H A 124 LYS HBy 1.0 . 3.37 2818 2444 A 124 LYS HBx A 124 LYS H 1.0 . 3.37 2819 2445 A 123 ILE HB A 124 LYS H 1.0 . 3.87 2820 2446 A 124 LYS H A 124 LYS HG2 1.0 . 3.17 2821 2446 A 124 LYS HG3 A 124 LYS H 1.0 . 3.17 2822 2447 A 123 ILE HG2% A 124 LYS H 1.0 . 3.23 2823 2448 A 125 ASN H A 125 ASN HBy 1.0 . 3.65 2824 2449 A 125 ASN HD21 A 107 ASP HB2 1.0 . 3.70 2825 2449 A 107 ASP HB3 A 125 ASN HD21 1.0 . 3.70 2826 2450 A 125 ASN HD21 A 122 LEU HB2 1.0 . 4.37 2827 2450 A 122 LEU HB3 A 125 ASN HD21 1.0 . 4.37 2828 2451 A 125 ASN HD22 A 107 ASP HB2 1.0 . 3.70 2829 2451 A 107 ASP HB3 A 125 ASN HD22 1.0 . 3.70 2830 2452 A 125 ASN HD22 A 122 LEU HB2 1.0 . 4.37 2831 2452 A 122 LEU HB3 A 125 ASN HD22 1.0 . 4.37 2832 2453 A 126 GLU H A 125 ASN HBx 1.0 . 3.95 2833 2454 A 35 GLN HBx A 36 LEU H 1.0 . 2.89 2834 2455 A 127 LYS H A 126 GLU HBy 1.0 . 4.34 2835 2456 A 127 LYS H A 127 LYS HG2 1.0 . 3.48 2836 2456 A 127 LYS H A 127 LYS HG3 1.0 . 3.48 2837 2457 A 127 LYS HA A 128 GLU H 1.0 . 3.16 2838 2458 A 126 GLU HGx A 128 GLU H 1.0 . 4.40 2839 2459 A 128 GLU H A 128 GLU HG2 1.0 . 4.91 2840 2459 A 128 GLU H A 128 GLU HG3 1.0 . 4.91 2841 2460 A 128 GLU H A 128 GLU HB3 1.0 . 3.62 2842 2461 A 128 GLU H A 128 GLU HB2 1.0 . 3.62 2843 2462 A 127 LYS H A 128 GLU H 1.0 . 3.34 2844 2463 A 15 SER H A 16 GLU HG2 1.0 . 4.70 2845 2463 A 16 GLU HG3 A 15 SER H 1.0 . 4.70 2846 2464 A 5 HIS H A 4 MET HB2 1.0 . 4.38 2847 2464 A 4 MET HB3 A 5 HIS H 1.0 . 4.38 2848 2465 A 16 GLU HBx A 15 SER H 1.0 . 5.03 2849 2466 A 36 LEU HD2% A 15 SER H 1.0 . 5.50 2850 2467 A 17 THR H A 21 LEU H 1.0 . 4.94 2851 2468 A 22 ILE HD1% A 19 GLU H 1.0 . 5.06 2852 2469 A 17 THR HG2% A 20 SER H 1.0 . 4.44 2853 2470 A 21 LEU HBy A 20 SER H 1.0 . 5.05 2854 2471 A 21 LEU H A 24 LYS H 1.0 . 5.01 2855 2472 A 22 ILE HA A 21 LEU H 1.0 . 5.44 2856 2473 A 19 GLU HA A 21 LEU H 1.0 . 4.66 2857 2474 A 22 ILE HG1x A 21 LEU H 1.0 . 4.51 2858 2475 A 19 GLU H A 21 LEU H 1.0 . 4.55 2859 2476 A 21 LEU H A 23 ASP H 1.0 . 4.34 2860 2477 A 21 LEU H A 22 ILE H 1.0 . 3.81 2861 2478 A 20 SER H A 22 ILE H 1.0 . 4.72 2862 2479 A 22 ILE HG1y A 23 ASP H 1.0 . 5.18 2863 2480 A 21 LEU HA A 24 LYS H 1.0 . 4.04 2864 2481 A 25 GLY HAx A 24 LYS H 1.0 . 4.64 2865 2482 A 22 ILE HA A 24 LYS H 1.0 . 4.31 2866 2483 A 22 ILE HG2% A 24 LYS H 1.0 . 4.65 2867 2484 A 26 LYS H A 24 LYS HE2 1.0 . 4.45 2868 2484 A 24 LYS HE3 A 26 LYS H 1.0 . 4.45 2869 2485 A 26 LYS H A 27 LEU HD2% 1.0 . 4.61 2870 2486 A 21 LEU HA A 26 LYS H 1.0 . 4.11 2871 2487 A 25 GLY HAx A 27 LEU H 1.0 . 4.50 2872 2488 A 22 ILE HA A 27 LEU H 1.0 . 5.03 2873 2489 A 27 LEU H A 24 LYS HE2 1.0 . 4.79 2874 2489 A 24 LYS HE3 A 27 LEU H 1.0 . 4.79 2875 2490 A 29 GLN HGx A 27 LEU H 1.0 . 4.95 2876 2491 A 27 LEU H A 26 LYS HG2 1.0 . 4.56 2877 2491 A 26 LYS HG3 A 27 LEU H 1.0 . 4.56 2878 2492 A 25 GLY H A 27 LEU H 1.0 . 5.50 2879 2493 A 28 ASP H A 27 LEU HD2% 1.0 . 4.52 2880 2494 A 28 ASP H A 27 LEU HD1% 1.0 . 4.52 2881 2495 A 68 TRP HD1 A 62 ASP H 1.0 . 4.04 2882 2496 A 61 VAL HA A 62 ASP H 1.0 . 3.47 2883 2497 A 62 ASP H A 62 ASP HBy 1.0 . 3.90 2884 2498 A 62 ASP H A 62 ASP HBx 1.0 . 3.90 2885 2499 A 11 GLU H A 11 GLU HBx 1.0 . 3.86 2886 2500 A 61 VAL HB A 62 ASP H 1.0 . 3.26 2887 2501 A 61 VAL HG2% A 62 ASP H 1.0 . 3.78 2888 2502 A 61 VAL HG1% A 62 ASP H 1.0 . 3.80 2889 2503 A 29 GLN H A 27 LEU HD2% 1.0 . 5.50 2890 2504 A 29 GLN H A 26 LYS HG2 1.0 . 5.07 2891 2504 A 26 LYS HG3 A 29 GLN H 1.0 . 5.07 2892 2505 A 39 LEU HG A 29 GLN H 1.0 . 5.48 2893 2506 A 29 GLN H A 39 LEU H 1.0 . 4.95 2894 2507 A 38 HIS HBy A 29 GLN HE22 1.0 . 5.15 2895 2508 A 29 GLN HE22 A 26 LYS HG2 1.0 . 4.77 2896 2508 A 26 LYS HG3 A 29 GLN HE22 1.0 . 4.77 2897 2509 A 38 HIS HD2 A 29 GLN HE22 1.0 . 4.51 2898 2510 A 36 LEU HD2% A 29 GLN HE21 1.0 . 4.50 2899 2511 A 123 ILE HG2% A 29 GLN HE21 1.0 . 5.12 2900 2512 A 38 HIS HBy A 29 GLN HE21 1.0 . 4.71 2901 2513 A 29 GLN HE21 A 29 GLN HB2 1.0 . 4.38 2902 2514 A 29 GLN H A 29 GLN HE21 1.0 . 5.42 2903 2515 A 39 LEU HG A 30 VAL H 1.0 . 5.50 2904 2516 A 18 MET HE1 A 30 VAL H 1.0 . 4.71 2905 2517 A 36 LEU HG A 30 VAL H 1.0 . 5.23 2906 2518 A 30 VAL H A 38 HIS H 1.0 . 5.50 2907 2519 A 18 MET HGx A 31 VAL H 1.0 . 4.65 2908 2520 A 18 MET HGy A 31 VAL H 1.0 . 4.34 2909 2521 A 31 VAL H A 30 VAL H 1.0 . 4.52 2910 2522 A 31 VAL H A 32 TYR H 1.0 . 4.67 2911 2523 A 35 GLN HBy A 32 TYR H 1.0 . 4.53 2912 2524 A 35 GLN HBx A 32 TYR H 1.0 . 5.10 2913 2525 A 35 GLN HGy A 32 TYR H 1.0 . 4.74 2914 2526 A 34 ASP HBy A 33 ASP H 1.0 . 5.50 2915 2527 A 32 TYR HE% A 33 ASP H 1.0 . 4.35 2916 2528 A 32 TYR H A 33 ASP H 1.0 . 4.27 2917 2529 A 32 TYR H A 34 ASP H 1.0 . 4.09 2918 2530 A 14 THR HG2% A 35 GLN H 1.0 . 4.39 2919 2531 A 35 GLN H A 33 ASP HBy 1.0 . 5.14 2920 2532 A 31 VAL HB A 35 GLN H 1.0 . 4.74 2921 2533 A 33 ASP H A 35 GLN H 1.0 . 4.43 2922 2534 A 35 GLN H A 35 GLN HE22 1.0 . 5.40 2923 2535 A 35 GLN HE22 A 124 LYS HE2 1.0 . 4.51 2924 2535 A 124 LYS HE3 A 35 GLN HE22 1.0 . 4.51 2925 2536 A 34 ASP HBx A 35 GLN HE22 1.0 . 4.59 2926 2537 A 35 GLN HBx A 35 GLN HE22 1.0 . 4.07 2927 2538 A 35 GLN HBy A 35 GLN HE22 1.0 . 5.14 2928 2539 A 35 GLN H A 35 GLN HE21 1.0 . 5.02 2929 2540 A 35 GLN HE21 A 124 LYS HE2 1.0 . 4.12 2930 2540 A 124 LYS HE3 A 35 GLN HE21 1.0 . 4.12 2931 2541 A 35 GLN HBx A 35 GLN HE21 1.0 . 3.97 2932 2542 A 35 GLN HBy A 35 GLN HE21 1.0 . 4.09 2933 2543 A 35 GLN HE21 A 122 LEU HD1% 1.0 . 4.02 2934 2544 A 126 GLU HGx A 126 GLU H 1.0 . 3.69 2935 2545 A 126 GLU HGy A 126 GLU H 1.0 . 3.28 2936 2546 A 37 TYR H A 36 LEU H 1.0 . 4.31 2937 2547 A 37 TYR H A 38 HIS H 1.0 . 4.50 2938 2548 A 122 LEU HA A 37 TYR H 1.0 . 5.27 2939 2549 A 29 GLN HGy A 37 TYR H 1.0 . 5.50 2940 2550 A 37 TYR H A 35 GLN HBx 1.0 . 5.50 2941 2551 A 21 LEU HD1% A 37 TYR H 1.0 . 5.17 2942 2552 A 121 VAL HB A 38 HIS H 1.0 . 5.25 2943 2553 A 123 ILE HG2% A 38 HIS H 1.0 . 5.22 2944 2554 A 39 LEU H A 40 LYS H 1.0 . 4.77 2945 2555 A 123 ILE HD1% A 39 LEU H 1.0 . 4.61 2946 2556 A 41 GLU HGx A 40 LYS H 1.0 . 4.83 2947 2557 A 40 LYS H A 118 TYR HB2 1.0 . 4.48 2948 2557 A 118 TYR HB3 A 40 LYS H 1.0 . 4.48 2949 2558 A 39 LEU HG A 40 LYS H 1.0 . 5.30 2950 2559 A 39 LEU HBx A 41 GLU H 1.0 . 5.36 2951 2560 A 41 GLU H A 42 LYS H 1.0 . 4.43 2952 2561 A 118 TYR HA A 42 LYS H 1.0 . 4.93 2953 2562 A 126 GLU HGx A 127 LYS H 1.0 . 3.61 2954 2563 A 8 ASP H A 7 THR HG2% 1.0 . 4.10 2955 2564 A 43 VAL H A 44 ASP H 1.0 . 4.68 2956 2565 A 47 LYS HGx A 44 ASP H 1.0 . 4.31 2957 2566 A 47 LYS HGy A 44 ASP H 1.0 . 4.07 2958 2567 A 44 ASP H A 47 LYS HE2 1.0 . 3.93 2959 2567 A 47 LYS HE3 A 44 ASP H 1.0 . 3.93 2960 2568 A 45 GLU H A 45 GLU HGy 1.0 . 3.27 2961 2569 A 117 TYR HD% A 45 GLU H 1.0 . 4.37 2962 2570 A 45 GLU H A 48 LYS H 1.0 . 5.50 2963 2571 A 45 GLU H A 47 LYS H 1.0 . 4.44 2964 2572 A 46 ASP H A 47 LYS HE2 1.0 . 4.73 2965 2572 A 47 LYS HE3 A 46 ASP H 1.0 . 4.73 2966 2573 A 46 ASP H A 48 LYS H 1.0 . 4.19 2967 2574 A 110 ILE HD1% A 47 LYS H 1.0 . 5.50 2968 2575 A 43 VAL HG2% A 47 LYS H 1.0 . 4.44 2969 2576 A 47 LYS H A 47 LYS HE2 1.0 . 4.70 2970 2576 A 47 LYS HE3 A 47 LYS H 1.0 . 4.70 2971 2577 A 44 ASP HBx A 48 LYS H 1.0 . 5.50 2972 2578 A 97 TYR HB3 A 48 LYS H 1.0 . 5.50 2973 2579 A 48 LYS H A 47 LYS HD2 1.0 . 4.66 2974 2579 A 47 LYS HD3 A 48 LYS H 1.0 . 4.66 2975 2580 A 48 LYS H A 48 LYS HDx 1.0 . 4.90 2976 2581 A 97 TYR HB2 A 48 LYS H 1.0 . 5.50 2977 2582 A 100 ASN H A 49 GLY H 1.0 . 5.48 2978 2583 A 97 TYR HB3 A 49 GLY H 1.0 . 4.83 2979 2584 A 49 GLY H A 50 LYS HB2 1.0 . 5.34 2980 2584 A 50 LYS HB3 A 49 GLY H 1.0 . 5.34 2981 2585 A 97 TYR HB3 A 50 LYS H 1.0 . 4.94 2982 2586 A 52 ILE HG2% A 50 LYS H 1.0 . 5.20 2983 2587 A 50 LYS HGx A 51 VAL H 1.0 . 5.45 2984 2588 A 97 TYR HE% A 51 VAL H 1.0 . 5.50 2985 2589 A 97 TYR HD% A 52 ILE H 1.0 . 4.98 2986 2590 A 53 GLY HAy A 52 ILE H 1.0 . 4.76 2987 2591 A 96 VAL HG1% A 52 ILE H 1.0 . 4.80 2988 2592 A 95 LYS HGx A 54 ALA H 1.0 . 4.42 2989 2593 A 93 TYR HBy A 56 GLY H 1.0 . 4.81 2990 2594 A 57 GLN HGy A 56 GLY H 1.0 . 5.50 2991 2595 A 57 GLN HGx A 56 GLY H 1.0 . 5.50 2992 2596 A 55 ILE HG1x A 56 GLY H 1.0 . 4.68 2993 2597 A 96 VAL HG2% A 56 GLY H 1.0 . 5.13 2994 2598 A 18 MET H A 57 GLN HE21 1.0 . 4.34 2995 2599 A 18 MET H A 57 GLN HE22 1.0 . 4.31 2996 2600 A 18 MET HA A 57 GLN HE22 1.0 . 5.50 2997 2601 A 18 MET HGy A 57 GLN HE22 1.0 . 4.52 2998 2602 A 18 MET HE1 A 57 GLN HE22 1.0 . 5.50 2999 2603 A 58 THR H A 59 PHE H 1.0 . 4.53 3000 2604 A 59 PHE H A 60 PHE H 1.0 . 5.05 3001 2605 A 60 PHE H A 67 ARG HE 1.0 . 5.38 3002 2606 A 60 PHE HE% A 60 PHE H 1.0 . 4.90 3003 2607 A 60 PHE H A 67 ARG HDy 1.0 . 4.84 3004 2608 A 60 PHE H A 67 ARG HG2 1.0 . 5.20 3005 2608 A 67 ARG HG3 A 60 PHE H 1.0 . 5.20 3006 2609 A 22 ILE HG2% A 60 PHE H 1.0 . 4.98 3007 2610 A 61 VAL HG1% A 60 PHE H 1.0 . 4.82 3008 2611 A 91 LEU HG A 61 VAL H 1.0 . 5.28 3009 2612 A 89 LYS HGy A 61 VAL H 1.0 . 5.30 3010 2613 A 61 VAL H A 62 ASP H 1.0 . 4.71 3011 2614 A 61 VAL HG2% A 64 ASP H 1.0 . 5.50 3012 2615 A 61 VAL HG1% A 65 GLY H 1.0 . 5.20 3013 2616 A 61 VAL HG2% A 66 LYS H 1.0 . 4.48 3014 2617 A 77 TYR HD% A 77 TYR H 1.0 . 4.36 3015 2618 A 59 PHE HD% A 67 ARG HE 1.0 . 4.58 3016 2619 A 68 TRP H A 67 ARG HE 1.0 . 5.14 3017 2620 A 67 ARG H A 67 ARG HE 1.0 . 5.50 3018 2621 A 68 TRP H A 62 ASP H 1.0 . 5.12 3019 2622 A 88 LYS HGy A 68 TRP HE1 1.0 . 5.50 3020 2623 A 88 LYS HGx A 68 TRP HE1 1.0 . 4.63 3021 2624 A 61 VAL HG1% A 68 TRP HE1 1.0 . 5.50 3022 2625 A 88 LYS HBx A 68 TRP HE1 1.0 . 5.50 3023 2626 A 61 VAL HA A 68 TRP HE1 1.0 . 4.76 3024 2627 A 63 GLY H A 68 TRP HE1 1.0 . 4.84 3025 2628 A 69 SER H A 73 LEU H 1.0 . 5.05 3026 2629 A 69 SER H A 70 GLU H 1.0 . 4.76 3027 2630 A 72 GLU H A 70 GLU H 1.0 . 4.81 3028 2631 A 71 GLU H A 74 LYS H 1.0 . 5.13 3029 2632 A 74 LYS H A 74 LYS HE2 1.0 . 4.99 3030 2632 A 74 LYS HE3 A 74 LYS H 1.0 . 4.99 3031 2633 A 77 TYR HE% A 78 ILE H 1.0 . 5.50 3032 2634 A 126 GLU HGy A 125 ASN H 1.0 . 4.80 3033 2635 A 125 ASN H A 124 LYS H 1.0 . 3.39 3034 2636 A 81 ASN H A 82 PRO HBx 1.0 . 5.50 3035 2637 A 81 ASN H A 82 PRO HG2 1.0 . 5.50 3036 2637 A 82 PRO HG3 A 81 ASN H 1.0 . 5.50 3037 2638 A 81 ASN H A 84 GLU HG2 1.0 . 5.43 3038 2638 A 84 GLU HG3 A 81 ASN H 1.0 . 5.43 3039 2639 A 85 ILE HG2% A 84 GLU H 1.0 . 4.49 3040 2640 A 84 GLU H A 82 PRO HD2 1.0 . 4.68 3041 2640 A 82 PRO HD3 A 84 GLU H 1.0 . 4.68 3042 2641 A 85 ILE H A 83 ASP HBx 1.0 . 5.42 3043 2642 A 64 ASP H A 86 ARG HE 1.0 . 4.96 3044 2643 A 87 GLU H A 86 ARG HE 1.0 . 5.19 3045 2644 A 68 TRP HZ2 A 87 GLU H 1.0 . 4.63 3046 2645 A 68 TRP HZ2 A 88 LYS H 1.0 . 5.50 3047 2646 A 89 LYS HGy A 88 LYS H 1.0 . 4.58 3048 2647 A 59 PHE HBx A 91 LEU H 1.0 . 5.50 3049 2648 A 92 ARG H A 93 TYR H 1.0 . 4.65 3050 2649 A 58 THR HG2% A 92 ARG H 1.0 . 4.82 3051 2650 A 55 ILE HG2% A 94 GLY H 1.0 . 4.88 3052 2651 A 56 GLY H A 95 LYS H 1.0 . 4.82 3053 2652 A 95 LYS HBy A 96 VAL H 1.0 . 3.98 3054 2653 A 109 ILE HD1% A 97 TYR H 1.0 . 4.86 3055 2654 A 109 ILE HG2% A 97 TYR H 1.0 . 5.10 3056 2655 A 110 ILE HG1y A 97 TYR H 1.0 . 5.50 3057 2656 A 96 VAL H A 97 TYR H 1.0 . 5.01 3058 2657 A 110 ILE HB A 98 SER H 1.0 . 5.22 3059 2658 A 51 VAL H A 98 SER H 1.0 . 5.28 3060 2659 A 109 ILE HG2% A 99 THR H 1.0 . 4.79 3061 2660 A 49 GLY HAx A 101 GLU H 1.0 . 5.50 3062 2661 A 103 SER H A 101 GLU HG2 1.0 . 5.00 3063 2661 A 103 SER H A 101 GLU HG3 1.0 . 5.00 3064 2662 A 103 SER H A 105 ALA HB% 1.0 . 4.57 3065 2663 A 106 LYS H A 106 LYS HE2 1.0 . 5.49 3066 2663 A 106 LYS HE3 A 106 LYS H 1.0 . 5.49 3067 2664 A 107 ASP H A 101 GLU HG2 1.0 . 4.75 3068 2664 A 107 ASP H A 101 GLU HG3 1.0 . 4.75 3069 2665 A 109 ILE H A 119 ARG HG3 1.0 . 4.72 3070 2665 A 109 ILE H A 119 ARG HG2 1.0 . 4.72 3071 2666 A 109 ILE H A 122 LEU HB2 1.0 . 5.50 3072 2666 A 109 ILE H A 122 LEU HB3 1.0 . 5.50 3073 2667 A 110 ILE H A 109 ILE H 1.0 . 4.94 3074 2668 A 111 VAL H A 37 TYR HD% 1.0 . 5.50 3075 2669 A 97 TYR HD% A 111 VAL H 1.0 . 5.08 3076 2670 A 96 VAL HG1% A 112 GLU H 1.0 . 4.84 3077 2671 A 112 GLU H A 94 GLY H 1.0 . 5.11 3078 2672 A 112 GLU HGx A 113 PHE H 1.0 . 3.95 3079 2673 A 90 PRO HG2 A 114 ASN HD22 1.0 . 5.45 3080 2674 A 112 GLU HGx A 117 TYR H 1.0 . 4.41 3081 2675 A 117 TYR H A 116 GLU HGx 1.0 . 5.09 3082 2676 A 118 TYR HA A 43 VAL H 1.0 . 4.11 3083 2677 A 110 ILE HG2% A 119 ARG H 1.0 . 4.19 3084 2678 A 119 ARG H A 119 ARG HG3 1.0 . 4.78 3085 2678 A 119 ARG H A 119 ARG HG2 1.0 . 4.78 3086 2679 A 119 ARG H A 119 ARG HE 1.0 . 5.50 3087 2680 A 120 ALA H A 121 VAL H 1.0 . 4.74 3088 2681 A 121 VAL H A 37 TYR HD% 1.0 . 5.13 3089 2682 A 122 LEU HA A 121 VAL H 1.0 . 5.13 3090 2683 A 121 VAL H A 122 LEU H 1.0 . 4.56 3091 2684 A 38 HIS HBy A 123 ILE H 1.0 . 4.86 3092 2685 A 123 ILE H A 124 LYS HE2 1.0 . 5.50 3093 2685 A 124 LYS HE3 A 123 ILE H 1.0 . 5.50 3094 2686 A 37 TYR HD% A 123 ILE H 1.0 . 4.74 3095 2687 A 122 LEU HA A 38 HIS H 1.0 . 4.24 3096 2688 A 72 GLU HB3 A 72 GLU H 1.0 . 3.70 3097 2689 A 6 PHE H A 5 HIS HBy 1.0 . 4.12 3098 2689 A 5 HIS HBx A 6 PHE H 1.0 . 4.12 3099 2690 A 7 THR H A 6 PHE HBy 1.0 . 3.76 3100 2690 A 7 THR H A 6 PHE HBx 1.0 . 3.76 3101 2691 A 7 THR HG2% A 6 PHE HBy 1.0 . 4.47 3102 2691 A 7 THR HG2% A 6 PHE HBx 1.0 . 4.47 3103 2692 A 8 ASP H A 8 ASP HBy 1.0 . 3.13 3104 2692 A 8 ASP H A 8 ASP HBx 1.0 . 3.13 3105 2693 A 9 ASP H A 8 ASP HBy 1.0 . 3.55 3106 2693 A 9 ASP H A 8 ASP HBx 1.0 . 3.55 3107 2694 A 9 ASP H A 9 ASP HBy 1.0 . 3.44 3108 2694 A 9 ASP H A 9 ASP HBx 1.0 . 3.44 3109 2695 A 10 ASN H A 9 ASP HBy 1.0 . 3.28 3110 2695 A 10 ASN H A 9 ASP HBx 1.0 . 3.28 3111 2696 A 10 ASN H A 10 ASN HBx 1.0 . 3.20 3112 2696 A 10 ASN H A 10 ASN HBy 1.0 . 3.20 3113 2697 A 10 ASN HD21 A 10 ASN HBy 1.0 . 2.80 3114 2697 A 10 ASN HD21 A 10 ASN HBx 1.0 . 2.80 3115 2697 A 10 ASN HD22 A 10 ASN HBx 1.0 . 2.80 3116 2697 A 10 ASN HD22 A 10 ASN HBy 1.0 . 2.80 3117 2698 A 11 GLU H A 10 ASN HBx 1.0 . 3.60 3118 2698 A 11 GLU H A 10 ASN HBy 1.0 . 3.60 3119 2699 A 11 GLU H A 11 GLU HBy 1.0 . 3.02 3120 2699 A 11 GLU H A 11 GLU HBx 1.0 . 3.02 3121 2700 A 11 GLU H A 11 GLU HG2 1.0 . 3.61 3122 2700 A 11 GLU H A 11 GLU HG3 1.0 . 3.61 3123 2701 A 12 ASN H A 11 GLU HBy 1.0 . 3.76 3124 2701 A 12 ASN H A 11 GLU HBx 1.0 . 3.76 3125 2702 A 12 ASN H A 12 ASN HBx 1.0 . 3.38 3126 2702 A 12 ASN H A 12 ASN HBy 1.0 . 3.38 3127 2703 A 12 ASN HBy A 12 ASN HD21 1.0 . 2.83 3128 2703 A 12 ASN HBx A 12 ASN HD21 1.0 . 2.83 3129 2703 A 12 ASN HD22 A 12 ASN HBx 1.0 . 2.83 3130 2703 A 12 ASN HBy A 12 ASN HD22 1.0 . 2.83 3131 2704 A 13 ASP H A 13 ASP HBy 1.0 . 2.96 3132 2704 A 13 ASP H A 13 ASP HBx 1.0 . 2.96 3133 2705 A 14 THR H A 13 ASP HBy 1.0 . 3.73 3134 2705 A 14 THR H A 13 ASP HBx 1.0 . 3.73 3135 2706 A 14 THR HG2% A 31 VAL HG2% 1.0 . 3.14 3136 2706 A 14 THR HG2% A 31 VAL HG1% 1.0 . 3.14 3137 2707 A 14 THR HG2% A 122 LEU HD2% 1.0 . 5.43 3138 2707 A 14 THR HG2% A 122 LEU HD1% 1.0 . 5.43 3139 2708 A 16 GLU H A 31 VAL HG2% 1.0 . 3.82 3140 2708 A 16 GLU H A 31 VAL HG1% 1.0 . 3.82 3141 2709 A 16 GLU HA A 31 VAL HG2% 1.0 . 4.76 3142 2709 A 16 GLU HA A 31 VAL HG1% 1.0 . 4.76 3143 2710 A 16 GLU HBy A 31 VAL HG2% 1.0 . 4.19 3144 2710 A 16 GLU HBy A 31 VAL HG1% 1.0 . 4.19 3145 2711 A 16 GLU HBx A 31 VAL HG2% 1.0 . 4.26 3146 2711 A 16 GLU HBx A 31 VAL HG1% 1.0 . 4.26 3147 2712 A 16 GLU HG3 A 31 VAL HG2% 1.0 . 3.56 3148 2712 A 16 GLU HG2 A 31 VAL HG2% 1.0 . 3.56 3149 2712 A 31 VAL HG1% A 16 GLU HG2 1.0 . 3.56 3150 2712 A 16 GLU HG3 A 31 VAL HG1% 1.0 . 3.56 3151 2713 A 17 THR H A 20 SER HBx 1.0 . 4.25 3152 2713 A 17 THR H A 20 SER HBy 1.0 . 4.25 3153 2714 A 17 THR H A 31 VAL HG2% 1.0 . 5.09 3154 2714 A 17 THR H A 31 VAL HG1% 1.0 . 5.09 3155 2715 A 17 THR HB A 31 VAL HG2% 1.0 . 4.26 3156 2715 A 17 THR HB A 31 VAL HG1% 1.0 . 4.26 3157 2716 A 17 THR HG2% A 19 GLU HBy 1.0 . 4.71 3158 2716 A 17 THR HG2% A 19 GLU HBx 1.0 . 4.71 3159 2717 A 17 THR HG2% A 31 VAL HG2% 1.0 . 4.87 3160 2717 A 17 THR HG2% A 31 VAL HG1% 1.0 . 4.87 3161 2718 A 18 MET H A 18 MET HBy 1.0 . 3.21 3162 2718 A 18 MET H A 18 MET HBx 1.0 . 3.21 3163 2719 A 18 MET H A 31 VAL HG2% 1.0 . 3.54 3164 2719 A 18 MET H A 31 VAL HG1% 1.0 . 3.54 3165 2720 A 18 MET HA A 31 VAL HG2% 1.0 . 3.72 3166 2720 A 18 MET HA A 31 VAL HG1% 1.0 . 3.72 3167 2721 A 18 MET HE1 A 18 MET HBy 1.0 . 3.38 3168 2721 A 18 MET HE1 A 18 MET HBx 1.0 . 3.38 3169 2722 A 19 GLU H A 18 MET HBy 1.0 . 3.27 3170 2722 A 19 GLU H A 18 MET HBx 1.0 . 3.27 3171 2723 A 21 LEU HD1% A 18 MET HBy 1.0 . 4.35 3172 2723 A 21 LEU HD1% A 18 MET HBx 1.0 . 4.35 3173 2724 A 22 ILE HD1% A 18 MET HBy 1.0 . 4.00 3174 2724 A 22 ILE HD1% A 18 MET HBx 1.0 . 4.00 3175 2725 A 57 GLN HE21 A 18 MET HBy 1.0 . 4.59 3176 2725 A 57 GLN HE21 A 18 MET HBx 1.0 . 4.59 3177 2726 A 57 GLN HE22 A 18 MET HBy 1.0 . 3.98 3178 2726 A 57 GLN HE22 A 18 MET HBx 1.0 . 3.98 3179 2727 A 59 PHE HD% A 18 MET HBy 1.0 . 4.21 3180 2727 A 59 PHE HD% A 18 MET HBx 1.0 . 4.21 3181 2728 A 59 PHE HE% A 18 MET HBy 1.0 . 3.61 3182 2728 A 59 PHE HE% A 18 MET HBx 1.0 . 3.61 3183 2729 A 18 MET HGy A 31 VAL HG2% 1.0 . 4.17 3184 2729 A 18 MET HGy A 31 VAL HG1% 1.0 . 4.17 3185 2730 A 18 MET HGx A 31 VAL HG2% 1.0 . 4.85 3186 2730 A 18 MET HGx A 31 VAL HG1% 1.0 . 4.85 3187 2731 A 18 MET HE1 A 30 VAL HG2% 1.0 . 3.03 3188 2731 A 18 MET HE1 A 30 VAL HG1% 1.0 . 3.03 3189 2732 A 18 MET HE1 A 31 VAL HG2% 1.0 . 4.41 3190 2732 A 18 MET HE1 A 31 VAL HG1% 1.0 . 4.41 3191 2733 A 19 GLU H A 19 GLU HGy 1.0 . 3.30 3192 2733 A 19 GLU H A 19 GLU HGx 1.0 . 3.30 3193 2734 A 19 GLU H A 31 VAL HG2% 1.0 . 5.44 3194 2734 A 19 GLU H A 31 VAL HG1% 1.0 . 5.44 3195 2735 A 19 GLU HA A 19 GLU HGy 1.0 . 3.28 3196 2735 A 19 GLU HA A 19 GLU HGx 1.0 . 3.28 3197 2736 A 19 GLU HA A 67 ARG HDx 1.0 . 4.63 3198 2736 A 19 GLU HA A 67 ARG HDy 1.0 . 4.63 3199 2737 A 20 SER H A 19 GLU HBy 1.0 . 3.27 3200 2737 A 20 SER H A 19 GLU HBx 1.0 . 3.27 3201 2738 A 21 LEU H A 19 GLU HBy 1.0 . 5.34 3202 2738 A 21 LEU H A 19 GLU HBx 1.0 . 5.34 3203 2739 A 23 ASP H A 19 GLU HBy 1.0 . 5.09 3204 2739 A 23 ASP H A 19 GLU HBx 1.0 . 5.09 3205 2740 A 59 PHE HE% A 19 GLU HBy 1.0 . 4.91 3206 2740 A 59 PHE HE% A 19 GLU HBx 1.0 . 4.91 3207 2741 A 20 SER H A 19 GLU HGy 1.0 . 5.34 3208 2741 A 20 SER H A 19 GLU HGx 1.0 . 5.34 3209 2742 A 59 PHE HD% A 19 GLU HGy 1.0 . 4.21 3210 2742 A 59 PHE HD% A 19 GLU HGx 1.0 . 4.21 3211 2743 A 19 GLU HGy A 67 ARG HDx 1.0 . 4.58 3212 2743 A 19 GLU HGx A 67 ARG HDx 1.0 . 4.58 3213 2743 A 67 ARG HDy A 19 GLU HGy 1.0 . 4.58 3214 2743 A 19 GLU HGx A 67 ARG HDy 1.0 . 4.58 3215 2744 A 20 SER H A 20 SER HBx 1.0 . 3.46 3216 2744 A 20 SER H A 20 SER HBy 1.0 . 3.46 3217 2745 A 21 LEU H A 20 SER HBx 1.0 . 4.16 3218 2745 A 21 LEU H A 20 SER HBy 1.0 . 4.16 3219 2746 A 21 LEU H A 23 ASP HBy 1.0 . 4.70 3220 2746 A 21 LEU H A 23 ASP HBx 1.0 . 4.70 3221 2747 A 21 LEU HA A 26 LYS HE3 1.0 . 4.36 3222 2747 A 21 LEU HA A 26 LYS HE2 1.0 . 4.36 3223 2748 A 21 LEU HBx A 26 LYS HE3 1.0 . 3.97 3224 2748 A 21 LEU HBx A 26 LYS HE2 1.0 . 3.97 3225 2749 A 21 LEU HBx A 31 VAL HG2% 1.0 . 5.40 3226 2749 A 21 LEU HBx A 31 VAL HG1% 1.0 . 5.40 3227 2750 A 21 LEU HG A 31 VAL HG2% 1.0 . 4.20 3228 2750 A 21 LEU HG A 31 VAL HG1% 1.0 . 4.20 3229 2751 A 22 ILE H A 23 ASP HBy 1.0 . 4.68 3230 2751 A 22 ILE H A 23 ASP HBx 1.0 . 4.68 3231 2752 A 22 ILE HA A 27 LEU HD2% 1.0 . 3.17 3232 2752 A 22 ILE HA A 27 LEU HD1% 1.0 . 3.17 3233 2753 A 22 ILE HA A 91 LEU HD2% 1.0 . 5.18 3234 2753 A 22 ILE HA A 91 LEU HD1% 1.0 . 5.18 3235 2754 A 22 ILE HB A 27 LEU HD2% 1.0 . 4.68 3236 2754 A 22 ILE HB A 27 LEU HD1% 1.0 . 4.68 3237 2755 A 22 ILE HB A 67 ARG HDx 1.0 . 4.48 3238 2755 A 22 ILE HB A 67 ARG HDy 1.0 . 4.48 3239 2756 A 22 ILE HB A 91 LEU HD2% 1.0 . 4.78 3240 2756 A 22 ILE HB A 91 LEU HD1% 1.0 . 4.78 3241 2757 A 22 ILE HG2% A 27 LEU HD2% 1.0 . 3.16 3242 2757 A 22 ILE HG2% A 27 LEU HD1% 1.0 . 3.16 3243 2758 A 22 ILE HG2% A 67 ARG HBy 1.0 . 4.13 3244 2758 A 22 ILE HG2% A 67 ARG HBx 1.0 . 4.13 3245 2759 A 22 ILE HG2% A 67 ARG HDx 1.0 . 4.01 3246 2759 A 22 ILE HG2% A 67 ARG HDy 1.0 . 4.01 3247 2760 A 22 ILE HG2% A 91 LEU HD2% 1.0 . 3.36 3248 2760 A 22 ILE HG2% A 91 LEU HD1% 1.0 . 3.36 3249 2761 A 22 ILE HG1y A 27 LEU HD2% 1.0 . 3.94 3250 2761 A 22 ILE HG1y A 27 LEU HD1% 1.0 . 3.94 3251 2762 A 22 ILE HG1y A 91 LEU HD2% 1.0 . 4.16 3252 2762 A 22 ILE HG1y A 91 LEU HD1% 1.0 . 4.16 3253 2763 A 22 ILE HG1x A 91 LEU HD2% 1.0 . 4.90 3254 2763 A 22 ILE HG1x A 91 LEU HD1% 1.0 . 4.90 3255 2764 A 22 ILE HD1% A 27 LEU HD2% 1.0 . 3.99 3256 2764 A 22 ILE HD1% A 27 LEU HD1% 1.0 . 3.99 3257 2765 A 22 ILE HD1% A 67 ARG HDx 1.0 . 4.65 3258 2765 A 22 ILE HD1% A 67 ARG HDy 1.0 . 4.65 3259 2766 A 22 ILE HD1% A 91 LEU HD2% 1.0 . 3.22 3260 2766 A 22 ILE HD1% A 91 LEU HD1% 1.0 . 3.22 3261 2767 A 23 ASP H A 23 ASP HBy 1.0 . 3.02 3262 2767 A 23 ASP H A 23 ASP HBx 1.0 . 3.02 3263 2768 A 23 ASP H A 67 ARG HBy 1.0 . 4.82 3264 2768 A 23 ASP H A 67 ARG HBx 1.0 . 4.82 3265 2769 A 23 ASP H A 67 ARG HDx 1.0 . 5.27 3266 2769 A 23 ASP H A 67 ARG HDy 1.0 . 5.27 3267 2770 A 24 LYS H A 23 ASP HBy 1.0 . 3.17 3268 2770 A 24 LYS H A 23 ASP HBx 1.0 . 3.17 3269 2771 A 25 GLY H A 23 ASP HBy 1.0 . 4.97 3270 2771 A 25 GLY H A 23 ASP HBx 1.0 . 4.97 3271 2772 A 24 LYS HBx A 26 LYS HE3 1.0 . 4.70 3272 2772 A 24 LYS HBx A 26 LYS HE2 1.0 . 4.70 3273 2773 A 24 LYS HG2 A 26 LYS HE3 1.0 . 3.77 3274 2773 A 24 LYS HG2 A 26 LYS HE2 1.0 . 3.77 3275 2774 A 25 GLY H A 27 LEU HD2% 1.0 . 3.93 3276 2774 A 25 GLY H A 27 LEU HD1% 1.0 . 3.93 3277 2775 A 25 GLY HAy A 27 LEU HD2% 1.0 . 4.22 3278 2775 A 25 GLY HAy A 27 LEU HD1% 1.0 . 4.22 3279 2776 A 26 LYS H A 27 LEU HD2% 1.0 . 3.85 3280 2776 A 26 LYS H A 27 LEU HD1% 1.0 . 3.85 3281 2777 A 26 LYS HA A 27 LEU HD2% 1.0 . 4.51 3282 2777 A 26 LYS HA A 27 LEU HD1% 1.0 . 4.51 3283 2778 A 26 LYS HB3 A 28 ASP HBy 1.0 . 5.34 3284 2778 A 26 LYS HB2 A 28 ASP HBy 1.0 . 5.34 3285 2778 A 28 ASP HBx A 26 LYS HB2 1.0 . 5.34 3286 2778 A 26 LYS HB3 A 28 ASP HBx 1.0 . 5.34 3287 2779 A 26 LYS HE2 A 26 LYS HG2 1.0 . 3.30 3288 2779 A 26 LYS HE3 A 26 LYS HG2 1.0 . 3.30 3289 2779 A 26 LYS HG3 A 26 LYS HE3 1.0 . 3.30 3290 2779 A 26 LYS HG3 A 26 LYS HE2 1.0 . 3.30 3291 2780 A 27 LEU H A 27 LEU HD2% 1.0 . 3.09 3292 2780 A 27 LEU H A 27 LEU HD1% 1.0 . 3.09 3293 2781 A 27 LEU H A 28 ASP HBy 1.0 . 4.70 3294 2781 A 27 LEU H A 28 ASP HBx 1.0 . 4.70 3295 2782 A 27 LEU HA A 27 LEU HD2% 1.0 . 2.79 3296 2782 A 27 LEU HA A 27 LEU HD1% 1.0 . 2.79 3297 2783 A 27 LEU HD1% A 27 LEU HB2 1.0 . 2.91 3298 2783 A 27 LEU HB2 A 27 LEU HD2% 1.0 . 2.91 3299 2784 A 27 LEU HB3 A 27 LEU HD1% 1.0 . 2.99 3300 2784 A 27 LEU HB3 A 27 LEU HD2% 1.0 . 2.99 3301 2785 A 27 LEU HB3 A 91 LEU HD1% 1.0 . 4.83 3302 2785 A 27 LEU HB3 A 91 LEU HD2% 1.0 . 4.83 3303 2786 A 27 LEU HB3 A 27 LEU HD2% 1.0 . 2.65 3304 2786 A 27 LEU HB2 A 27 LEU HD2% 1.0 . 2.65 3305 2786 A 27 LEU HD1% A 27 LEU HB2 1.0 . 2.65 3306 2786 A 27 LEU HB3 A 27 LEU HD1% 1.0 . 2.65 3307 2787 A 28 ASP H A 27 LEU HD2% 1.0 . 3.81 3308 2787 A 28 ASP H A 27 LEU HD1% 1.0 . 3.81 3309 2788 A 29 GLN H A 27 LEU HD2% 1.0 . 4.69 3310 2788 A 29 GLN H A 27 LEU HD1% 1.0 . 4.69 3311 2789 A 91 LEU HBy A 27 LEU HD2% 1.0 . 5.29 3312 2789 A 91 LEU HBy A 27 LEU HD1% 1.0 . 5.29 3313 2790 A 27 LEU HD2% A 91 LEU HD2% 1.0 . 2.92 3314 2790 A 27 LEU HD1% A 91 LEU HD2% 1.0 . 2.92 3315 2790 A 91 LEU HD1% A 27 LEU HD2% 1.0 . 2.92 3316 2790 A 27 LEU HD1% A 91 LEU HD1% 1.0 . 2.92 3317 2791 A 113 PHE HE% A 27 LEU HD2% 1.0 . 4.23 3318 2791 A 113 PHE HE% A 27 LEU HD1% 1.0 . 4.23 3319 2792 A 113 PHE HZ A 27 LEU HD2% 1.0 . 4.28 3320 2792 A 113 PHE HZ A 27 LEU HD1% 1.0 . 4.28 3321 2793 A 28 ASP H A 28 ASP HBy 1.0 . 3.19 3322 2793 A 28 ASP H A 28 ASP HBx 1.0 . 3.19 3323 2794 A 28 ASP H A 30 VAL HG2% 1.0 . 5.44 3324 2794 A 28 ASP H A 30 VAL HG1% 1.0 . 5.44 3325 2795 A 28 ASP HA A 39 LEU HD2% 1.0 . 3.54 3326 2795 A 28 ASP HA A 39 LEU HD1% 1.0 . 3.54 3327 2796 A 29 GLN H A 28 ASP HBy 1.0 . 3.98 3328 2796 A 29 GLN H A 28 ASP HBx 1.0 . 3.98 3329 2797 A 38 HIS HD2 A 28 ASP HBy 1.0 . 4.17 3330 2797 A 38 HIS HD2 A 28 ASP HBx 1.0 . 4.17 3331 2798 A 39 LEU H A 28 ASP HBy 1.0 . 5.21 3332 2798 A 39 LEU H A 28 ASP HBx 1.0 . 5.21 3333 2799 A 39 LEU HBy A 28 ASP HBy 1.0 . 4.44 3334 2799 A 39 LEU HBy A 28 ASP HBx 1.0 . 4.44 3335 2800 A 28 ASP HBx A 39 LEU HD2% 1.0 . 4.29 3336 2800 A 28 ASP HBy A 39 LEU HD2% 1.0 . 4.29 3337 2800 A 39 LEU HD1% A 28 ASP HBy 1.0 . 4.29 3338 2800 A 28 ASP HBx A 39 LEU HD1% 1.0 . 4.29 3339 2801 A 29 GLN H A 30 VAL HG2% 1.0 . 4.23 3340 2801 A 29 GLN H A 30 VAL HG1% 1.0 . 4.23 3341 2802 A 29 GLN H A 39 LEU HD2% 1.0 . 4.40 3342 2802 A 29 GLN H A 39 LEU HD1% 1.0 . 4.40 3343 2803 A 29 GLN HA A 30 VAL HG2% 1.0 . 4.13 3344 2803 A 29 GLN HA A 30 VAL HG1% 1.0 . 4.13 3345 2804 A 29 GLN HA A 39 LEU HD2% 1.0 . 4.38 3346 2804 A 29 GLN HA A 39 LEU HD1% 1.0 . 4.38 3347 2805 A 29 GLN HB2 A 39 LEU HD2% 1.0 . 5.44 3348 2805 A 29 GLN HB2 A 39 LEU HD1% 1.0 . 5.44 3349 2806 A 29 GLN HB3 A 39 LEU HD2% 1.0 . 5.34 3350 2806 A 29 GLN HB3 A 39 LEU HD1% 1.0 . 5.34 3351 2807 A 30 VAL H A 37 TYR HB3 1.0 . 4.03 3352 2807 A 30 VAL H A 37 TYR HB2 1.0 . 4.03 3353 2808 A 30 VAL H A 111 VAL HG2% 1.0 . 4.84 3354 2808 A 30 VAL H A 111 VAL HG1% 1.0 . 4.84 3355 2809 A 30 VAL HA A 31 VAL HG2% 1.0 . 4.30 3356 2809 A 30 VAL HA A 31 VAL HG1% 1.0 . 4.30 3357 2810 A 30 VAL HB A 111 VAL HG2% 1.0 . 4.32 3358 2810 A 30 VAL HB A 111 VAL HG1% 1.0 . 4.32 3359 2811 A 31 VAL HA A 30 VAL HG2% 1.0 . 4.17 3360 2811 A 31 VAL HA A 30 VAL HG1% 1.0 . 4.17 3361 2812 A 32 TYR HB2 A 30 VAL HG2% 1.0 . 4.03 3362 2812 A 32 TYR HB2 A 30 VAL HG1% 1.0 . 4.03 3363 2813 A 32 TYR HB3 A 30 VAL HG2% 1.0 . 4.30 3364 2813 A 32 TYR HB3 A 30 VAL HG1% 1.0 . 4.30 3365 2814 A 37 TYR H A 30 VAL HG2% 1.0 . 4.36 3366 2814 A 37 TYR H A 30 VAL HG1% 1.0 . 4.36 3367 2815 A 37 TYR HA A 30 VAL HG2% 1.0 . 5.39 3368 2815 A 37 TYR HA A 30 VAL HG1% 1.0 . 5.39 3369 2816 A 30 VAL HG2% A 37 TYR HB3 1.0 . 3.76 3370 2816 A 37 TYR HB2 A 30 VAL HG2% 1.0 . 3.76 3371 2816 A 30 VAL HG1% A 37 TYR HB2 1.0 . 3.76 3372 2816 A 30 VAL HG1% A 37 TYR HB3 1.0 . 3.76 3373 2817 A 37 TYR HD% A 30 VAL HG2% 1.0 . 4.32 3374 2817 A 37 TYR HD% A 30 VAL HG1% 1.0 . 4.32 3375 2818 A 39 LEU HG A 30 VAL HG2% 1.0 . 4.26 3376 2818 A 39 LEU HG A 30 VAL HG1% 1.0 . 4.26 3377 2819 A 30 VAL HG1% A 39 LEU HD2% 1.0 . 2.88 3378 2819 A 30 VAL HG2% A 39 LEU HD2% 1.0 . 2.88 3379 2819 A 39 LEU HD1% A 30 VAL HG2% 1.0 . 2.88 3380 2819 A 30 VAL HG1% A 39 LEU HD1% 1.0 . 2.88 3381 2820 A 55 ILE HG2% A 30 VAL HG2% 1.0 . 4.49 3382 2820 A 55 ILE HG2% A 30 VAL HG1% 1.0 . 4.49 3383 2821 A 55 ILE HD1% A 30 VAL HG2% 1.0 . 3.55 3384 2821 A 55 ILE HD1% A 30 VAL HG1% 1.0 . 3.55 3385 2822 A 93 TYR HBy A 30 VAL HG2% 1.0 . 5.44 3386 2822 A 93 TYR HBy A 30 VAL HG1% 1.0 . 5.44 3387 2823 A 93 TYR HBx A 30 VAL HG2% 1.0 . 4.61 3388 2823 A 93 TYR HBx A 30 VAL HG1% 1.0 . 4.61 3389 2824 A 93 TYR HD% A 30 VAL HG2% 1.0 . 3.51 3390 2824 A 93 TYR HD% A 30 VAL HG1% 1.0 . 3.51 3391 2825 A 93 TYR HE% A 30 VAL HG2% 1.0 . 3.59 3392 2825 A 93 TYR HE% A 30 VAL HG1% 1.0 . 3.59 3393 2826 A 109 ILE HD1% A 30 VAL HG2% 1.0 . 3.83 3394 2826 A 109 ILE HD1% A 30 VAL HG1% 1.0 . 3.83 3395 2827 A 111 VAL HB A 30 VAL HG2% 1.0 . 4.61 3396 2827 A 111 VAL HB A 30 VAL HG1% 1.0 . 4.61 3397 2828 A 30 VAL HG1% A 111 VAL HG2% 1.0 . 2.81 3398 2828 A 30 VAL HG2% A 111 VAL HG2% 1.0 . 2.81 3399 2828 A 111 VAL HG1% A 30 VAL HG2% 1.0 . 2.81 3400 2828 A 30 VAL HG1% A 111 VAL HG1% 1.0 . 2.81 3401 2829 A 113 PHE HE% A 30 VAL HG2% 1.0 . 5.18 3402 2829 A 113 PHE HE% A 30 VAL HG1% 1.0 . 5.18 3403 2830 A 120 ALA HB% A 30 VAL HG2% 1.0 . 3.64 3404 2830 A 120 ALA HB% A 30 VAL HG1% 1.0 . 3.64 3405 2831 A 31 VAL H A 31 VAL HG2% 1.0 . 3.11 3406 2831 A 31 VAL H A 31 VAL HG1% 1.0 . 3.11 3407 2832 A 32 TYR H A 31 VAL HG2% 1.0 . 3.22 3408 2832 A 32 TYR H A 31 VAL HG1% 1.0 . 3.22 3409 2833 A 32 TYR HA A 31 VAL HG2% 1.0 . 4.32 3410 2833 A 32 TYR HA A 31 VAL HG1% 1.0 . 4.32 3411 2834 A 33 ASP H A 31 VAL HG2% 1.0 . 4.45 3412 2834 A 33 ASP H A 31 VAL HG1% 1.0 . 4.45 3413 2835 A 34 ASP H A 31 VAL HG2% 1.0 . 3.58 3414 2835 A 34 ASP H A 31 VAL HG1% 1.0 . 3.58 3415 2836 A 34 ASP HA A 31 VAL HG2% 1.0 . 3.88 3416 2836 A 34 ASP HA A 31 VAL HG1% 1.0 . 3.88 3417 2837 A 35 GLN H A 31 VAL HG2% 1.0 . 3.87 3418 2837 A 35 GLN H A 31 VAL HG1% 1.0 . 3.87 3419 2838 A 36 LEU HA A 31 VAL HG2% 1.0 . 3.73 3420 2838 A 36 LEU HA A 31 VAL HG1% 1.0 . 3.73 3421 2839 A 36 LEU HBy A 31 VAL HG2% 1.0 . 4.41 3422 2839 A 36 LEU HBy A 31 VAL HG1% 1.0 . 4.41 3423 2840 A 36 LEU HBx A 31 VAL HG2% 1.0 . 4.96 3424 2840 A 36 LEU HBx A 31 VAL HG1% 1.0 . 4.96 3425 2841 A 36 LEU HG A 31 VAL HG2% 1.0 . 4.42 3426 2841 A 36 LEU HG A 31 VAL HG1% 1.0 . 4.42 3427 2842 A 36 LEU HD1% A 31 VAL HG2% 1.0 . 3.21 3428 2842 A 36 LEU HD1% A 31 VAL HG1% 1.0 . 3.21 3429 2843 A 36 LEU HD2% A 31 VAL HG2% 1.0 . 4.24 3430 2843 A 36 LEU HD2% A 31 VAL HG1% 1.0 . 4.24 3431 2844 A 37 TYR H A 31 VAL HG2% 1.0 . 5.44 3432 2844 A 37 TYR H A 31 VAL HG1% 1.0 . 5.44 3433 2845 A 32 TYR HD% A 111 VAL HG2% 1.0 . 5.09 3434 2845 A 32 TYR HD% A 111 VAL HG1% 1.0 . 5.09 3435 2846 A 32 TYR HE% A 52 ILE HG13 1.0 . 4.65 3436 2846 A 32 TYR HE% A 52 ILE HG12 1.0 . 4.65 3437 2847 A 35 GLN HA A 122 LEU HD2% 1.0 . 4.24 3438 2847 A 35 GLN HA A 122 LEU HD1% 1.0 . 4.24 3439 2848 A 35 GLN HBy A 122 LEU HD2% 1.0 . 4.21 3440 2848 A 35 GLN HBy A 122 LEU HD1% 1.0 . 4.21 3441 2849 A 35 GLN HBx A 122 LEU HD2% 1.0 . 3.75 3442 2849 A 35 GLN HBx A 122 LEU HD1% 1.0 . 3.75 3443 2850 A 35 GLN HGy A 122 LEU HD2% 1.0 . 4.75 3444 2850 A 35 GLN HGy A 122 LEU HD1% 1.0 . 4.75 3445 2851 A 35 GLN HGx A 122 LEU HD2% 1.0 . 3.77 3446 2851 A 35 GLN HGx A 122 LEU HD1% 1.0 . 3.77 3447 2852 A 35 GLN HE21 A 122 LEU HD2% 1.0 . 3.51 3448 2852 A 35 GLN HE21 A 122 LEU HD1% 1.0 . 3.51 3449 2853 A 35 GLN HE22 A 122 LEU HD2% 1.0 . 4.48 3450 2853 A 35 GLN HE22 A 122 LEU HD1% 1.0 . 4.48 3451 2854 A 36 LEU H A 122 LEU HD2% 1.0 . 3.75 3452 2854 A 36 LEU H A 122 LEU HD1% 1.0 . 3.75 3453 2855 A 37 TYR H A 37 TYR HB3 1.0 . 3.56 3454 2855 A 37 TYR H A 37 TYR HB2 1.0 . 3.56 3455 2856 A 37 TYR HA A 122 LEU HD2% 1.0 . 4.54 3456 2856 A 37 TYR HA A 122 LEU HD1% 1.0 . 4.54 3457 2857 A 37 TYR HB3 A 39 LEU HD2% 1.0 . 5.28 3458 2857 A 37 TYR HB2 A 39 LEU HD2% 1.0 . 5.28 3459 2857 A 39 LEU HD1% A 37 TYR HB3 1.0 . 5.28 3460 2857 A 39 LEU HD1% A 37 TYR HB2 1.0 . 5.28 3461 2858 A 109 ILE H A 37 TYR HB3 1.0 . 4.78 3462 2858 A 109 ILE H A 37 TYR HB2 1.0 . 4.78 3463 2859 A 109 ILE HG1x A 37 TYR HB3 1.0 . 5.18 3464 2859 A 109 ILE HG1x A 37 TYR HB2 1.0 . 5.18 3465 2860 A 109 ILE HD1% A 37 TYR HB3 1.0 . 4.50 3466 2860 A 109 ILE HD1% A 37 TYR HB2 1.0 . 4.50 3467 2861 A 37 TYR HB2 A 111 VAL HG2% 1.0 . 4.04 3468 2861 A 37 TYR HB3 A 111 VAL HG2% 1.0 . 4.04 3469 2861 A 111 VAL HG1% A 37 TYR HB3 1.0 . 4.04 3470 2861 A 37 TYR HB2 A 111 VAL HG1% 1.0 . 4.04 3471 2862 A 120 ALA HB% A 37 TYR HB3 1.0 . 3.36 3472 2862 A 120 ALA HB% A 37 TYR HB2 1.0 . 3.36 3473 2863 A 37 TYR HD% A 111 VAL HG2% 1.0 . 4.63 3474 2863 A 37 TYR HD% A 111 VAL HG1% 1.0 . 4.63 3475 2864 A 38 HIS H A 121 VAL HG2% 1.0 . 4.05 3476 2864 A 38 HIS H A 121 VAL HG1% 1.0 . 4.05 3477 2865 A 38 HIS HBy A 121 VAL HG2% 1.0 . 4.36 3478 2865 A 38 HIS HBy A 121 VAL HG1% 1.0 . 4.36 3479 2866 A 38 HIS HBx A 40 LYS HEx 1.0 . 5.34 3480 2866 A 38 HIS HBx A 40 LYS HEy 1.0 . 5.34 3481 2867 A 38 HIS HBx A 121 VAL HG2% 1.0 . 3.97 3482 2867 A 38 HIS HBx A 121 VAL HG1% 1.0 . 3.97 3483 2868 A 39 LEU HA A 39 LEU HD2% 1.0 . 3.16 3484 2868 A 39 LEU HA A 39 LEU HD1% 1.0 . 3.16 3485 2869 A 40 LYS H A 39 LEU HD2% 1.0 . 3.89 3486 2869 A 40 LYS H A 39 LEU HD1% 1.0 . 3.89 3487 2870 A 41 GLU H A 39 LEU HD2% 1.0 . 5.23 3488 2870 A 41 GLU H A 39 LEU HD1% 1.0 . 5.23 3489 2871 A 93 TYR HE% A 39 LEU HD2% 1.0 . 5.30 3490 2871 A 93 TYR HE% A 39 LEU HD1% 1.0 . 5.30 3491 2872 A 111 VAL H A 39 LEU HD2% 1.0 . 4.43 3492 2872 A 111 VAL H A 39 LEU HD1% 1.0 . 4.43 3493 2873 A 111 VAL HB A 39 LEU HD2% 1.0 . 3.74 3494 2873 A 111 VAL HB A 39 LEU HD1% 1.0 . 3.74 3495 2874 A 39 LEU HD2% A 111 VAL HG2% 1.0 . 3.06 3496 2874 A 39 LEU HD1% A 111 VAL HG2% 1.0 . 3.06 3497 2874 A 111 VAL HG1% A 39 LEU HD2% 1.0 . 3.06 3498 2874 A 39 LEU HD1% A 111 VAL HG1% 1.0 . 3.06 3499 2875 A 113 PHE HBy A 39 LEU HD2% 1.0 . 4.86 3500 2875 A 113 PHE HBy A 39 LEU HD1% 1.0 . 4.86 3501 2876 A 113 PHE HBx A 39 LEU HD2% 1.0 . 5.25 3502 2876 A 113 PHE HBx A 39 LEU HD1% 1.0 . 5.25 3503 2877 A 113 PHE HD% A 39 LEU HD2% 1.0 . 3.85 3504 2877 A 113 PHE HD% A 39 LEU HD1% 1.0 . 3.85 3505 2878 A 113 PHE HE% A 39 LEU HD2% 1.0 . 4.92 3506 2878 A 113 PHE HE% A 39 LEU HD1% 1.0 . 4.92 3507 2879 A 118 TYR H A 39 LEU HD2% 1.0 . 4.62 3508 2879 A 118 TYR H A 39 LEU HD1% 1.0 . 4.62 3509 2880 A 118 TYR HA A 39 LEU HD2% 1.0 . 4.42 3510 2880 A 118 TYR HA A 39 LEU HD1% 1.0 . 4.42 3511 2881 A 39 LEU HD2% A 118 TYR HB2 1.0 . 3.31 3512 2881 A 118 TYR HB3 A 39 LEU HD2% 1.0 . 3.31 3513 2881 A 118 TYR HB3 A 39 LEU HD1% 1.0 . 3.31 3514 2881 A 39 LEU HD1% A 118 TYR HB2 1.0 . 3.31 3515 2882 A 118 TYR HD% A 39 LEU HD2% 1.0 . 3.79 3516 2882 A 118 TYR HD% A 39 LEU HD1% 1.0 . 3.79 3517 2883 A 118 TYR HE% A 39 LEU HD2% 1.0 . 5.30 3518 2883 A 118 TYR HE% A 39 LEU HD1% 1.0 . 5.30 3519 2884 A 120 ALA HA A 39 LEU HD2% 1.0 . 3.97 3520 2884 A 120 ALA HA A 39 LEU HD1% 1.0 . 3.97 3521 2885 A 120 ALA HB% A 39 LEU HD2% 1.0 . 3.10 3522 2885 A 120 ALA HB% A 39 LEU HD1% 1.0 . 3.10 3523 2886 A 121 VAL H A 39 LEU HD2% 1.0 . 4.95 3524 2886 A 121 VAL H A 39 LEU HD1% 1.0 . 4.95 3525 2887 A 40 LYS H A 40 LYS HBy 1.0 . 3.40 3526 2887 A 40 LYS H A 40 LYS HBx 1.0 . 3.40 3527 2888 A 40 LYS H A 121 VAL HG2% 1.0 . 4.61 3528 2888 A 40 LYS H A 121 VAL HG1% 1.0 . 4.61 3529 2889 A 40 LYS HA A 40 LYS HEx 1.0 . 4.24 3530 2889 A 40 LYS HA A 40 LYS HEy 1.0 . 4.24 3531 2890 A 40 LYS HBy A 40 LYS HD2 1.0 . 3.34 3532 2890 A 40 LYS HBx A 40 LYS HD2 1.0 . 3.34 3533 2890 A 40 LYS HD3 A 40 LYS HBy 1.0 . 3.34 3534 2890 A 40 LYS HD3 A 40 LYS HBx 1.0 . 3.34 3535 2891 A 40 LYS HBx A 40 LYS HEx 1.0 . 3.89 3536 2891 A 40 LYS HEy A 40 LYS HBy 1.0 . 3.89 3537 2891 A 40 LYS HEy A 40 LYS HBx 1.0 . 3.89 3538 2891 A 40 LYS HBy A 40 LYS HEx 1.0 . 3.89 3539 2892 A 40 LYS HBy A 121 VAL HG2% 1.0 . 4.21 3540 2892 A 40 LYS HBx A 121 VAL HG2% 1.0 . 4.21 3541 2892 A 121 VAL HG1% A 40 LYS HBy 1.0 . 4.21 3542 2892 A 121 VAL HG1% A 40 LYS HBx 1.0 . 4.21 3543 2893 A 40 LYS HG3 A 121 VAL HG2% 1.0 . 3.26 3544 2893 A 40 LYS HG2 A 121 VAL HG2% 1.0 . 3.26 3545 2893 A 121 VAL HG1% A 40 LYS HG2 1.0 . 3.26 3546 2893 A 40 LYS HG3 A 121 VAL HG1% 1.0 . 3.26 3547 2894 A 40 LYS HD2 A 121 VAL HG2% 1.0 . 3.26 3548 2894 A 40 LYS HD3 A 121 VAL HG2% 1.0 . 3.26 3549 2894 A 121 VAL HG1% A 40 LYS HD2 1.0 . 3.26 3550 2894 A 40 LYS HD3 A 121 VAL HG1% 1.0 . 3.26 3551 2895 A 121 VAL H A 40 LYS HEx 1.0 . 5.34 3552 2895 A 121 VAL H A 40 LYS HEy 1.0 . 5.34 3553 2896 A 121 VAL HB A 40 LYS HEx 1.0 . 4.06 3554 2896 A 121 VAL HB A 40 LYS HEy 1.0 . 4.06 3555 2897 A 40 LYS HEx A 121 VAL HG2% 1.0 . 3.18 3556 2897 A 121 VAL HG1% A 40 LYS HEx 1.0 . 3.18 3557 2897 A 121 VAL HG1% A 40 LYS HEy 1.0 . 3.18 3558 2897 A 40 LYS HEy A 121 VAL HG2% 1.0 . 3.18 3559 2898 A 41 GLU H A 121 VAL HG2% 1.0 . 5.44 3560 2898 A 41 GLU H A 121 VAL HG1% 1.0 . 5.44 3561 2899 A 42 LYS HBy A 42 LYS HE3 1.0 . 3.83 3562 2899 A 42 LYS HBy A 42 LYS HE2 1.0 . 3.83 3563 2900 A 42 LYS HBx A 42 LYS HE3 1.0 . 2.90 3564 2900 A 42 LYS HBx A 42 LYS HE2 1.0 . 2.90 3565 2901 A 42 LYS HGy A 42 LYS HE3 1.0 . 3.61 3566 2901 A 42 LYS HGy A 42 LYS HE2 1.0 . 3.61 3567 2902 A 42 LYS HD3 A 116 GLU HGy 1.0 . 5.34 3568 2902 A 116 GLU HGx A 42 LYS HD2 1.0 . 5.34 3569 2902 A 42 LYS HD3 A 116 GLU HGx 1.0 . 5.34 3570 2902 A 42 LYS HD2 A 116 GLU HGy 1.0 . 5.34 3571 2903 A 42 LYS HE3 A 116 GLU HB2 1.0 . 4.50 3572 2903 A 42 LYS HE2 A 116 GLU HB2 1.0 . 4.50 3573 2903 A 116 GLU HB3 A 42 LYS HE3 1.0 . 4.50 3574 2903 A 116 GLU HB3 A 42 LYS HE2 1.0 . 4.50 3575 2904 A 42 LYS HE2 A 116 GLU HGy 1.0 . 4.69 3576 2904 A 42 LYS HE3 A 116 GLU HGy 1.0 . 4.69 3577 2904 A 116 GLU HGx A 42 LYS HE3 1.0 . 4.69 3578 2904 A 42 LYS HE2 A 116 GLU HGx 1.0 . 4.69 3579 2905 A 44 ASP HBx A 45 GLU HGy 1.0 . 4.54 3580 2905 A 44 ASP HBx A 45 GLU HGx 1.0 . 4.54 3581 2906 A 45 GLU HA A 45 GLU HGy 1.0 . 3.43 3582 2906 A 45 GLU HA A 45 GLU HGx 1.0 . 3.43 3583 2907 A 46 ASP H A 45 GLU HGy 1.0 . 2.98 3584 2907 A 46 ASP H A 45 GLU HGx 1.0 . 2.98 3585 2908 A 45 GLU HGx A 48 LYS HE2 1.0 . 4.92 3586 2908 A 45 GLU HGy A 48 LYS HE2 1.0 . 4.92 3587 2908 A 48 LYS HE3 A 45 GLU HGy 1.0 . 4.92 3588 2908 A 48 LYS HE3 A 45 GLU HGx 1.0 . 4.92 3589 2909 A 117 TYR HD% A 45 GLU HGy 1.0 . 5.34 3590 2909 A 117 TYR HD% A 45 GLU HGx 1.0 . 5.34 3591 2910 A 46 ASP H A 46 ASP HBy 1.0 . 2.94 3592 2910 A 46 ASP H A 46 ASP HBx 1.0 . 2.94 3593 2911 A 47 LYS H A 46 ASP HBy 1.0 . 3.64 3594 2911 A 47 LYS H A 46 ASP HBx 1.0 . 3.64 3595 2912 A 46 ASP HBx A 47 LYS HD2 1.0 . 4.33 3596 2912 A 46 ASP HBy A 47 LYS HD2 1.0 . 4.33 3597 2912 A 47 LYS HD3 A 46 ASP HBy 1.0 . 4.33 3598 2912 A 47 LYS HD3 A 46 ASP HBx 1.0 . 4.33 3599 2913 A 48 LYS H A 46 ASP HBy 1.0 . 5.34 3600 2913 A 48 LYS H A 46 ASP HBx 1.0 . 5.34 3601 2914 A 47 LYS H A 48 LYS HBy 1.0 . 4.57 3602 2914 A 47 LYS H A 48 LYS HBx 1.0 . 4.57 3603 2915 A 48 LYS H A 48 LYS HBy 1.0 . 2.93 3604 2915 A 48 LYS H A 48 LYS HBx 1.0 . 2.93 3605 2916 A 48 LYS H A 48 LYS HG3 1.0 . 3.37 3606 2916 A 48 LYS H A 48 LYS HG2 1.0 . 3.37 3607 2917 A 48 LYS H A 48 LYS HDx 1.0 . 4.26 3608 2917 A 48 LYS H A 48 LYS HDy 1.0 . 4.26 3609 2918 A 48 LYS HA A 48 LYS HG3 1.0 . 3.68 3610 2918 A 48 LYS HA A 48 LYS HG2 1.0 . 3.68 3611 2919 A 48 LYS HA A 48 LYS HDx 1.0 . 4.51 3612 2919 A 48 LYS HA A 48 LYS HDy 1.0 . 4.51 3613 2920 A 48 LYS HBx A 48 LYS HDx 1.0 . 3.26 3614 2920 A 48 LYS HBy A 48 LYS HDx 1.0 . 3.26 3615 2920 A 48 LYS HDy A 48 LYS HBy 1.0 . 3.26 3616 2920 A 48 LYS HBx A 48 LYS HDy 1.0 . 3.26 3617 2921 A 48 LYS HBx A 48 LYS HE2 1.0 . 3.77 3618 2921 A 48 LYS HBy A 48 LYS HE2 1.0 . 3.77 3619 2921 A 48 LYS HE3 A 48 LYS HBy 1.0 . 3.77 3620 2921 A 48 LYS HE3 A 48 LYS HBx 1.0 . 3.77 3621 2922 A 49 GLY H A 48 LYS HBy 1.0 . 3.65 3622 2922 A 49 GLY H A 48 LYS HBx 1.0 . 3.65 3623 2923 A 48 LYS HBx A 51 VAL HG2% 1.0 . 4.47 3624 2923 A 48 LYS HBy A 51 VAL HG2% 1.0 . 4.47 3625 2923 A 51 VAL HG1% A 48 LYS HBy 1.0 . 4.47 3626 2923 A 48 LYS HBx A 51 VAL HG1% 1.0 . 4.47 3627 2924 A 97 TYR HB2 A 48 LYS HBy 1.0 . 4.81 3628 2924 A 97 TYR HB2 A 48 LYS HBx 1.0 . 4.81 3629 2925 A 97 TYR HD% A 48 LYS HBy 1.0 . 4.67 3630 2925 A 97 TYR HD% A 48 LYS HBx 1.0 . 4.67 3631 2926 A 97 TYR HE% A 48 LYS HBy 1.0 . 4.97 3632 2926 A 97 TYR HE% A 48 LYS HBx 1.0 . 4.97 3633 2927 A 110 ILE HD1% A 48 LYS HBy 1.0 . 3.88 3634 2927 A 110 ILE HD1% A 48 LYS HBx 1.0 . 3.88 3635 2928 A 48 LYS HE3 A 48 LYS HG3 1.0 . 3.31 3636 2928 A 48 LYS HE2 A 48 LYS HG3 1.0 . 3.31 3637 2928 A 48 LYS HG2 A 48 LYS HE2 1.0 . 3.31 3638 2928 A 48 LYS HE3 A 48 LYS HG2 1.0 . 3.31 3639 2929 A 49 GLY H A 48 LYS HG3 1.0 . 4.35 3640 2929 A 49 GLY H A 48 LYS HG2 1.0 . 4.35 3641 2930 A 97 TYR HE% A 48 LYS HG3 1.0 . 5.34 3642 2930 A 97 TYR HE% A 48 LYS HG2 1.0 . 5.34 3643 2931 A 49 GLY H A 48 LYS HDx 1.0 . 5.34 3644 2931 A 49 GLY H A 48 LYS HDy 1.0 . 5.34 3645 2932 A 48 LYS HDx A 51 VAL HG2% 1.0 . 3.90 3646 2932 A 48 LYS HDy A 51 VAL HG2% 1.0 . 3.90 3647 2932 A 51 VAL HG1% A 48 LYS HDx 1.0 . 3.90 3648 2932 A 48 LYS HDy A 51 VAL HG1% 1.0 . 3.90 3649 2933 A 97 TYR HD% A 48 LYS HDx 1.0 . 4.24 3650 2933 A 97 TYR HD% A 48 LYS HDy 1.0 . 4.24 3651 2934 A 97 TYR HE% A 48 LYS HDx 1.0 . 3.52 3652 2934 A 97 TYR HE% A 48 LYS HDy 1.0 . 3.52 3653 2935 A 48 LYS HE2 A 51 VAL HG2% 1.0 . 4.54 3654 2935 A 48 LYS HE3 A 51 VAL HG2% 1.0 . 4.54 3655 2935 A 51 VAL HG1% A 48 LYS HE2 1.0 . 4.54 3656 2935 A 48 LYS HE3 A 51 VAL HG1% 1.0 . 4.54 3657 2936 A 50 LYS HA A 51 VAL HG2% 1.0 . 4.15 3658 2936 A 50 LYS HA A 51 VAL HG1% 1.0 . 4.15 3659 2937 A 50 LYS HB3 A 51 VAL HG2% 1.0 . 5.21 3660 2937 A 50 LYS HB2 A 51 VAL HG2% 1.0 . 5.21 3661 2937 A 51 VAL HG1% A 50 LYS HB2 1.0 . 5.21 3662 2937 A 50 LYS HB3 A 51 VAL HG1% 1.0 . 5.21 3663 2938 A 51 VAL H A 51 VAL HG2% 1.0 . 2.84 3664 2938 A 51 VAL H A 51 VAL HG1% 1.0 . 2.84 3665 2939 A 51 VAL HA A 51 VAL HG2% 1.0 . 3.06 3666 2939 A 51 VAL HA A 51 VAL HG1% 1.0 . 3.06 3667 2940 A 51 VAL HA A 52 ILE HG13 1.0 . 5.02 3668 2940 A 51 VAL HA A 52 ILE HG12 1.0 . 5.02 3669 2941 A 52 ILE HA A 51 VAL HG2% 1.0 . 3.87 3670 2941 A 52 ILE HA A 51 VAL HG1% 1.0 . 3.87 3671 2942 A 52 ILE HB A 51 VAL HG2% 1.0 . 5.16 3672 2942 A 52 ILE HB A 51 VAL HG1% 1.0 . 5.16 3673 2943 A 53 GLY H A 51 VAL HG2% 1.0 . 3.29 3674 2943 A 53 GLY H A 51 VAL HG1% 1.0 . 3.29 3675 2944 A 53 GLY HAx A 51 VAL HG2% 1.0 . 4.41 3676 2944 A 53 GLY HAx A 51 VAL HG1% 1.0 . 4.41 3677 2945 A 53 GLY HAy A 51 VAL HG2% 1.0 . 4.77 3678 2945 A 53 GLY HAy A 51 VAL HG1% 1.0 . 4.77 3679 2946 A 54 ALA HA A 51 VAL HG2% 1.0 . 5.44 3680 2946 A 54 ALA HA A 51 VAL HG1% 1.0 . 5.44 3681 2947 A 54 ALA HB% A 51 VAL HG2% 1.0 . 4.86 3682 2947 A 54 ALA HB% A 51 VAL HG1% 1.0 . 4.86 3683 2948 A 95 LYS HBy A 51 VAL HG2% 1.0 . 4.30 3684 2948 A 95 LYS HBy A 51 VAL HG1% 1.0 . 4.30 3685 2949 A 95 LYS HBx A 51 VAL HG2% 1.0 . 4.01 3686 2949 A 95 LYS HBx A 51 VAL HG1% 1.0 . 4.01 3687 2950 A 95 LYS HGy A 51 VAL HG2% 1.0 . 3.43 3688 2950 A 95 LYS HGy A 51 VAL HG1% 1.0 . 3.43 3689 2951 A 95 LYS HGx A 51 VAL HG2% 1.0 . 4.47 3690 2951 A 95 LYS HGx A 51 VAL HG1% 1.0 . 4.47 3691 2952 A 51 VAL HG2% A 95 LYS HD2 1.0 . 2.97 3692 2952 A 51 VAL HG1% A 95 LYS HD2 1.0 . 2.97 3693 2952 A 95 LYS HD3 A 51 VAL HG2% 1.0 . 2.97 3694 2952 A 95 LYS HD3 A 51 VAL HG1% 1.0 . 2.97 3695 2953 A 51 VAL HG2% A 95 LYS HE2 1.0 . 3.98 3696 2953 A 95 LYS HE3 A 51 VAL HG2% 1.0 . 3.98 3697 2953 A 95 LYS HE3 A 51 VAL HG1% 1.0 . 3.98 3698 2953 A 51 VAL HG1% A 95 LYS HE2 1.0 . 3.98 3699 2954 A 97 TYR H A 51 VAL HG2% 1.0 . 4.88 3700 2954 A 97 TYR H A 51 VAL HG1% 1.0 . 4.88 3701 2955 A 97 TYR HA A 51 VAL HG2% 1.0 . 3.67 3702 2955 A 97 TYR HA A 51 VAL HG1% 1.0 . 3.67 3703 2956 A 97 TYR HD% A 51 VAL HG2% 1.0 . 3.51 3704 2956 A 97 TYR HD% A 51 VAL HG1% 1.0 . 3.51 3705 2957 A 97 TYR HE% A 51 VAL HG2% 1.0 . 3.14 3706 2957 A 97 TYR HE% A 51 VAL HG1% 1.0 . 3.14 3707 2958 A 52 ILE H A 52 ILE HG13 1.0 . 3.56 3708 2958 A 52 ILE H A 52 ILE HG12 1.0 . 3.56 3709 2959 A 53 GLY H A 52 ILE HG13 1.0 . 3.50 3710 2959 A 53 GLY H A 52 ILE HG12 1.0 . 3.50 3711 2960 A 96 VAL HG1% A 52 ILE HG13 1.0 . 3.38 3712 2960 A 96 VAL HG1% A 52 ILE HG12 1.0 . 3.38 3713 2961 A 96 VAL HG2% A 52 ILE HG13 1.0 . 5.05 3714 2961 A 96 VAL HG2% A 52 ILE HG12 1.0 . 5.05 3715 2962 A 98 SER H A 52 ILE HG13 1.0 . 4.12 3716 2962 A 98 SER H A 52 ILE HG12 1.0 . 4.12 3717 2963 A 98 SER HBx A 52 ILE HG13 1.0 . 4.96 3718 2963 A 98 SER HBx A 52 ILE HG12 1.0 . 4.96 3719 2964 A 52 ILE HD1% A 106 LYS HG3 1.0 . 4.18 3720 2964 A 52 ILE HD1% A 106 LYS HG2 1.0 . 4.18 3721 2965 A 55 ILE HG2% A 57 GLN HB2 1.0 . 4.07 3722 2965 A 55 ILE HG2% A 57 GLN HB3 1.0 . 4.07 3723 2966 A 58 THR H A 57 GLN HB2 1.0 . 3.38 3724 2966 A 58 THR H A 57 GLN HB3 1.0 . 3.38 3725 2967 A 58 THR HA A 57 GLN HB2 1.0 . 5.20 3726 2967 A 58 THR HA A 57 GLN HB3 1.0 . 5.20 3727 2968 A 93 TYR H A 57 GLN HB2 1.0 . 4.66 3728 2968 A 93 TYR H A 57 GLN HB3 1.0 . 4.66 3729 2969 A 58 THR HG2% A 92 ARG HDx 1.0 . 3.88 3730 2969 A 58 THR HG2% A 92 ARG HDy 1.0 . 3.88 3731 2970 A 59 PHE H A 91 LEU HD2% 1.0 . 4.16 3732 2970 A 59 PHE H A 91 LEU HD1% 1.0 . 4.16 3733 2971 A 59 PHE HBy A 91 LEU HD2% 1.0 . 4.10 3734 2971 A 59 PHE HBy A 91 LEU HD1% 1.0 . 4.10 3735 2972 A 59 PHE HBx A 67 ARG HBy 1.0 . 5.34 3736 2972 A 59 PHE HBx A 67 ARG HBx 1.0 . 5.34 3737 2973 A 59 PHE HBx A 91 LEU HD2% 1.0 . 4.19 3738 2973 A 59 PHE HBx A 91 LEU HD1% 1.0 . 4.19 3739 2974 A 59 PHE HD% A 67 ARG HDx 1.0 . 4.16 3740 2974 A 59 PHE HD% A 67 ARG HDy 1.0 . 4.16 3741 2975 A 59 PHE HD% A 91 LEU HD2% 1.0 . 4.14 3742 2975 A 59 PHE HD% A 91 LEU HD1% 1.0 . 4.14 3743 2976 A 59 PHE HE% A 67 ARG HDx 1.0 . 4.73 3744 2976 A 59 PHE HE% A 67 ARG HDy 1.0 . 4.73 3745 2977 A 59 PHE HE% A 91 LEU HD2% 1.0 . 5.44 3746 2977 A 59 PHE HE% A 91 LEU HD1% 1.0 . 5.44 3747 2978 A 60 PHE H A 67 ARG HDx 1.0 . 4.26 3748 2978 A 60 PHE H A 67 ARG HDy 1.0 . 4.26 3749 2979 A 60 PHE H A 91 LEU HD2% 1.0 . 4.52 3750 2979 A 60 PHE H A 91 LEU HD1% 1.0 . 4.52 3751 2980 A 60 PHE HA A 67 ARG HDx 1.0 . 5.34 3752 2980 A 60 PHE HA A 67 ARG HDy 1.0 . 5.34 3753 2981 A 60 PHE HA A 88 LYS HDy 1.0 . 5.34 3754 2981 A 60 PHE HA A 88 LYS HDx 1.0 . 5.34 3755 2982 A 60 PHE HA A 90 PRO HBx 1.0 . 4.83 3756 2982 A 60 PHE HA A 90 PRO HBy 1.0 . 4.83 3757 2983 A 60 PHE HA A 91 LEU HD2% 1.0 . 4.50 3758 2983 A 60 PHE HA A 91 LEU HD1% 1.0 . 4.50 3759 2984 A 60 PHE HBy A 67 ARG HDx 1.0 . 5.00 3760 2984 A 60 PHE HBy A 67 ARG HDy 1.0 . 5.00 3761 2985 A 60 PHE HBy A 73 LEU HD2% 1.0 . 4.31 3762 2985 A 60 PHE HBy A 73 LEU HD1% 1.0 . 4.31 3763 2986 A 60 PHE HBy A 88 LYS HDy 1.0 . 5.08 3764 2986 A 60 PHE HBy A 88 LYS HDx 1.0 . 5.08 3765 2987 A 60 PHE HBx A 73 LEU HD2% 1.0 . 4.14 3766 2987 A 60 PHE HBx A 73 LEU HD1% 1.0 . 4.14 3767 2988 A 60 PHE HBx A 88 LYS HDy 1.0 . 5.34 3768 2988 A 60 PHE HBx A 88 LYS HDx 1.0 . 5.34 3769 2989 A 60 PHE HD% A 73 LEU HD2% 1.0 . 3.14 3770 2989 A 60 PHE HD% A 73 LEU HD1% 1.0 . 3.14 3771 2990 A 60 PHE HD% A 88 LYS HDy 1.0 . 4.62 3772 2990 A 60 PHE HD% A 88 LYS HDx 1.0 . 4.62 3773 2991 A 60 PHE HD% A 88 LYS HEy 1.0 . 3.94 3774 2991 A 60 PHE HD% A 88 LYS HEx 1.0 . 3.94 3775 2992 A 60 PHE HD% A 90 PRO HBx 1.0 . 3.91 3776 2992 A 60 PHE HD% A 90 PRO HBy 1.0 . 3.91 3777 2993 A 60 PHE HE% A 73 LEU HD2% 1.0 . 3.97 3778 2993 A 60 PHE HE% A 73 LEU HD1% 1.0 . 3.97 3779 2994 A 60 PHE HE% A 88 LYS HDy 1.0 . 5.34 3780 2994 A 60 PHE HE% A 88 LYS HDx 1.0 . 5.34 3781 2995 A 60 PHE HE% A 88 LYS HEy 1.0 . 4.06 3782 2995 A 60 PHE HE% A 88 LYS HEx 1.0 . 4.06 3783 2996 A 60 PHE HE% A 90 PRO HBx 1.0 . 3.43 3784 2996 A 60 PHE HE% A 90 PRO HBy 1.0 . 3.43 3785 2997 A 61 VAL H A 89 LYS HDy 1.0 . 4.64 3786 2997 A 61 VAL H A 89 LYS HDx 1.0 . 4.64 3787 2998 A 61 VAL H A 89 LYS HEy 1.0 . 5.34 3788 2998 A 61 VAL H A 89 LYS HEx 1.0 . 5.34 3789 2999 A 61 VAL HA A 67 ARG HBy 1.0 . 5.34 3790 2999 A 61 VAL HA A 67 ARG HBx 1.0 . 5.34 3791 3000 A 61 VAL HA A 67 ARG HDx 1.0 . 4.75 3792 3000 A 61 VAL HA A 67 ARG HDy 1.0 . 4.75 3793 3001 A 61 VAL HA A 91 LEU HD2% 1.0 . 5.02 3794 3001 A 61 VAL HA A 91 LEU HD1% 1.0 . 5.02 3795 3002 A 61 VAL HB A 91 LEU HD2% 1.0 . 4.60 3796 3002 A 61 VAL HB A 91 LEU HD1% 1.0 . 4.60 3797 3003 A 61 VAL HG1% A 67 ARG HBy 1.0 . 4.55 3798 3003 A 61 VAL HG1% A 67 ARG HBx 1.0 . 4.55 3799 3004 A 61 VAL HG1% A 91 LEU HD2% 1.0 . 3.49 3800 3004 A 61 VAL HG1% A 91 LEU HD1% 1.0 . 3.49 3801 3005 A 61 VAL HG2% A 89 LYS HDy 1.0 . 3.42 3802 3005 A 61 VAL HG2% A 89 LYS HDx 1.0 . 3.42 3803 3006 A 61 VAL HG2% A 89 LYS HEy 1.0 . 3.90 3804 3006 A 61 VAL HG2% A 89 LYS HEx 1.0 . 3.90 3805 3007 A 62 ASP H A 62 ASP HBy 1.0 . 3.19 3806 3007 A 62 ASP H A 62 ASP HBx 1.0 . 3.19 3807 3008 A 62 ASP HA A 86 ARG HBx 1.0 . 4.59 3808 3008 A 62 ASP HA A 86 ARG HBy 1.0 . 4.59 3809 3009 A 62 ASP HA A 86 ARG HGx 1.0 . 5.19 3810 3009 A 62 ASP HA A 86 ARG HGy 1.0 . 5.19 3811 3010 A 62 ASP HA A 89 LYS HDy 1.0 . 4.68 3812 3010 A 62 ASP HA A 89 LYS HDx 1.0 . 4.68 3813 3011 A 63 GLY H A 62 ASP HBy 1.0 . 3.48 3814 3011 A 63 GLY H A 62 ASP HBx 1.0 . 3.48 3815 3012 A 64 ASP H A 62 ASP HBy 1.0 . 3.42 3816 3012 A 64 ASP H A 62 ASP HBx 1.0 . 3.42 3817 3013 A 62 ASP HBy A 66 LYS HB2 1.0 . 3.88 3818 3013 A 62 ASP HBx A 66 LYS HB2 1.0 . 3.88 3819 3013 A 66 LYS HB3 A 62 ASP HBy 1.0 . 3.88 3820 3013 A 66 LYS HB3 A 62 ASP HBx 1.0 . 3.88 3821 3014 A 68 TRP HE1 A 62 ASP HBy 1.0 . 3.89 3822 3014 A 68 TRP HE1 A 62 ASP HBx 1.0 . 3.89 3823 3015 A 62 ASP HBx A 86 ARG HBx 1.0 . 4.21 3824 3015 A 62 ASP HBy A 86 ARG HBx 1.0 . 4.21 3825 3015 A 86 ARG HBy A 62 ASP HBy 1.0 . 4.21 3826 3015 A 62 ASP HBx A 86 ARG HBy 1.0 . 4.21 3827 3016 A 86 ARG HE A 62 ASP HBy 1.0 . 4.03 3828 3016 A 86 ARG HE A 62 ASP HBx 1.0 . 4.03 3829 3017 A 87 GLU H A 62 ASP HBy 1.0 . 4.27 3830 3017 A 87 GLU H A 62 ASP HBx 1.0 . 4.27 3831 3018 A 63 GLY H A 89 LYS HEy 1.0 . 3.74 3832 3018 A 63 GLY H A 89 LYS HEx 1.0 . 3.74 3833 3019 A 65 GLY H A 63 GLY HAy 1.0 . 4.30 3834 3019 A 65 GLY H A 63 GLY HAx 1.0 . 4.30 3835 3020 A 63 GLY HAy A 89 LYS HEy 1.0 . 3.85 3836 3020 A 63 GLY HAx A 89 LYS HEy 1.0 . 3.85 3837 3020 A 89 LYS HEx A 63 GLY HAy 1.0 . 3.85 3838 3020 A 89 LYS HEx A 63 GLY HAx 1.0 . 3.85 3839 3021 A 64 ASP HBy A 66 LYS HG3 1.0 . 5.34 3840 3021 A 64 ASP HBy A 66 LYS HG2 1.0 . 5.34 3841 3022 A 64 ASP HBx A 66 LYS HG3 1.0 . 4.26 3842 3022 A 64 ASP HBx A 66 LYS HG2 1.0 . 4.26 3843 3023 A 66 LYS HA A 66 LYS HG3 1.0 . 2.95 3844 3023 A 66 LYS HA A 66 LYS HG2 1.0 . 2.95 3845 3024 A 66 LYS HA A 67 ARG HBy 1.0 . 4.58 3846 3024 A 66 LYS HA A 67 ARG HBx 1.0 . 4.58 3847 3025 A 66 LYS HE3 A 66 LYS HG3 1.0 . 3.09 3848 3025 A 66 LYS HE2 A 66 LYS HG3 1.0 . 3.09 3849 3025 A 66 LYS HG2 A 66 LYS HE2 1.0 . 3.09 3850 3025 A 66 LYS HE3 A 66 LYS HG2 1.0 . 3.09 3851 3026 A 67 ARG H A 67 ARG HBy 1.0 . 3.12 3852 3026 A 67 ARG H A 67 ARG HBx 1.0 . 3.12 3853 3027 A 67 ARG H A 67 ARG HDx 1.0 . 4.61 3854 3027 A 67 ARG H A 67 ARG HDy 1.0 . 4.61 3855 3028 A 67 ARG HA A 91 LEU HD2% 1.0 . 5.23 3856 3028 A 67 ARG HA A 91 LEU HD1% 1.0 . 5.23 3857 3029 A 67 ARG HBx A 67 ARG HDx 1.0 . 3.28 3858 3029 A 67 ARG HBy A 67 ARG HDx 1.0 . 3.28 3859 3029 A 67 ARG HDy A 67 ARG HBy 1.0 . 3.28 3860 3029 A 67 ARG HDy A 67 ARG HBx 1.0 . 3.28 3861 3030 A 67 ARG HE A 67 ARG HBy 1.0 . 4.02 3862 3030 A 67 ARG HE A 67 ARG HBx 1.0 . 4.02 3863 3031 A 68 TRP H A 67 ARG HBy 1.0 . 3.94 3864 3031 A 68 TRP H A 67 ARG HBx 1.0 . 3.94 3865 3032 A 68 TRP H A 67 ARG HDx 1.0 . 4.65 3866 3032 A 68 TRP H A 67 ARG HDy 1.0 . 4.65 3867 3033 A 68 TRP H A 73 LEU HD2% 1.0 . 4.48 3868 3033 A 68 TRP H A 73 LEU HD1% 1.0 . 4.48 3869 3034 A 68 TRP HA A 73 LEU HD2% 1.0 . 5.39 3870 3034 A 68 TRP HA A 73 LEU HD1% 1.0 . 5.39 3871 3035 A 68 TRP HB2 A 73 LEU HD2% 1.0 . 3.71 3872 3035 A 68 TRP HB2 A 73 LEU HD1% 1.0 . 3.71 3873 3036 A 68 TRP HB3 A 73 LEU HD2% 1.0 . 3.71 3874 3036 A 68 TRP HB3 A 73 LEU HD1% 1.0 . 3.71 3875 3037 A 68 TRP HZ3 A 73 LEU HD2% 1.0 . 3.77 3876 3037 A 68 TRP HZ3 A 73 LEU HD1% 1.0 . 3.77 3877 3038 A 68 TRP HZ2 A 73 LEU HD2% 1.0 . 5.44 3878 3038 A 68 TRP HZ2 A 73 LEU HD1% 1.0 . 5.44 3879 3039 A 68 TRP HH2 A 73 LEU HD2% 1.0 . 4.83 3880 3039 A 68 TRP HH2 A 73 LEU HD1% 1.0 . 4.83 3881 3040 A 69 SER H A 73 LEU HD2% 1.0 . 4.82 3882 3040 A 69 SER H A 73 LEU HD1% 1.0 . 4.82 3883 3041 A 70 GLU H A 69 SER HBy 1.0 . 3.83 3884 3041 A 70 GLU H A 69 SER HBx 1.0 . 3.83 3885 3042 A 71 GLU H A 69 SER HBy 1.0 . 4.15 3886 3042 A 71 GLU H A 69 SER HBx 1.0 . 4.15 3887 3043 A 72 GLU H A 69 SER HBy 1.0 . 4.22 3888 3043 A 72 GLU H A 69 SER HBx 1.0 . 4.22 3889 3044 A 70 GLU H A 70 GLU HG2 1.0 . 3.26 3890 3044 A 70 GLU H A 70 GLU HG3 1.0 . 3.26 3891 3045 A 70 GLU H A 73 LEU HD2% 1.0 . 4.74 3892 3045 A 70 GLU H A 73 LEU HD1% 1.0 . 4.74 3893 3046 A 70 GLU HA A 73 LEU HBy 1.0 . 3.58 3894 3046 A 70 GLU HA A 73 LEU HBx 1.0 . 3.58 3895 3047 A 70 GLU HA A 73 LEU HD2% 1.0 . 3.44 3896 3047 A 70 GLU HA A 73 LEU HD1% 1.0 . 3.44 3897 3048 A 70 GLU HB2 A 73 LEU HD2% 1.0 . 5.44 3898 3048 A 70 GLU HB2 A 73 LEU HD1% 1.0 . 5.44 3899 3049 A 70 GLU HB3 A 73 LEU HD2% 1.0 . 4.78 3900 3049 A 73 LEU HD1% A 70 GLU HB3 1.0 . 4.78 3901 3050 A 70 GLU HG2 A 73 LEU HD2% 1.0 . 3.93 3902 3050 A 73 LEU HD1% A 70 GLU HG2 1.0 . 3.93 3903 3050 A 73 LEU HD1% A 70 GLU HG3 1.0 . 3.93 3904 3050 A 70 GLU HG3 A 73 LEU HD2% 1.0 . 3.93 3905 3051 A 71 GLU H A 71 GLU HB2 1.0 . 3.10 3906 3051 A 71 GLU H A 71 GLU HB3 1.0 . 3.10 3907 3052 A 71 GLU HA A 74 LYS HB2 1.0 . 4.71 3908 3052 A 71 GLU HA A 74 LYS HB3 1.0 . 4.71 3909 3053 A 71 GLU HA A 74 LYS HGx 1.0 . 4.53 3910 3053 A 71 GLU HA A 74 LYS HGy 1.0 . 4.53 3911 3054 A 72 GLU H A 71 GLU HB2 1.0 . 4.15 3912 3054 A 72 GLU H A 71 GLU HB3 1.0 . 4.15 3913 3055 A 72 GLU H A 73 LEU HD2% 1.0 . 4.68 3914 3055 A 72 GLU H A 73 LEU HD1% 1.0 . 4.68 3915 3056 A 72 GLU HB2 A 73 LEU HD2% 1.0 . 3.86 3916 3056 A 72 GLU HB2 A 73 LEU HD1% 1.0 . 3.86 3917 3057 A 73 LEU H A 73 LEU HBy 1.0 . 3.32 3918 3057 A 73 LEU H A 73 LEU HBx 1.0 . 3.32 3919 3058 A 73 LEU H A 73 LEU HD2% 1.0 . 3.37 3920 3058 A 73 LEU H A 73 LEU HD1% 1.0 . 3.37 3921 3059 A 73 LEU H A 75 GLU HGy 1.0 . 5.24 3922 3059 A 73 LEU H A 75 GLU HGx 1.0 . 5.24 3923 3060 A 73 LEU HA A 73 LEU HD2% 1.0 . 3.05 3924 3060 A 73 LEU HA A 73 LEU HD1% 1.0 . 3.05 3925 3061 A 73 LEU HA A 88 LYS HEy 1.0 . 4.52 3926 3061 A 73 LEU HA A 88 LYS HEx 1.0 . 4.52 3927 3062 A 73 LEU HBy A 73 LEU HD2% 1.0 . 2.84 3928 3062 A 73 LEU HBx A 73 LEU HD2% 1.0 . 2.84 3929 3062 A 73 LEU HD1% A 73 LEU HBy 1.0 . 2.84 3930 3062 A 73 LEU HD1% A 73 LEU HBx 1.0 . 2.84 3931 3063 A 74 LYS H A 73 LEU HBy 1.0 . 3.38 3932 3063 A 74 LYS H A 73 LEU HBx 1.0 . 3.38 3933 3064 A 74 LYS H A 73 LEU HD2% 1.0 . 4.31 3934 3064 A 74 LYS H A 73 LEU HD1% 1.0 . 4.31 3935 3065 A 75 GLU H A 73 LEU HD2% 1.0 . 5.44 3936 3065 A 75 GLU H A 73 LEU HD1% 1.0 . 5.44 3937 3066 A 88 LYS HGy A 73 LEU HD2% 1.0 . 4.99 3938 3066 A 88 LYS HGy A 73 LEU HD1% 1.0 . 4.99 3939 3067 A 73 LEU HD2% A 88 LYS HDy 1.0 . 4.43 3940 3067 A 73 LEU HD1% A 88 LYS HDy 1.0 . 4.43 3941 3067 A 88 LYS HDx A 73 LEU HD2% 1.0 . 4.43 3942 3067 A 88 LYS HDx A 73 LEU HD1% 1.0 . 4.43 3943 3068 A 73 LEU HD1% A 88 LYS HEy 1.0 . 3.54 3944 3068 A 73 LEU HD2% A 88 LYS HEy 1.0 . 3.54 3945 3068 A 88 LYS HEx A 73 LEU HD2% 1.0 . 3.54 3946 3068 A 73 LEU HD1% A 88 LYS HEx 1.0 . 3.54 3947 3069 A 74 LYS H A 74 LYS HGx 1.0 . 3.81 3948 3069 A 74 LYS H A 74 LYS HGy 1.0 . 3.81 3949 3070 A 74 LYS H A 75 GLU HGy 1.0 . 4.42 3950 3070 A 74 LYS H A 75 GLU HGx 1.0 . 4.42 3951 3071 A 74 LYS HA A 74 LYS HGx 1.0 . 3.56 3952 3071 A 74 LYS HA A 74 LYS HGy 1.0 . 3.56 3953 3072 A 74 LYS HE2 A 74 LYS HGx 1.0 . 3.39 3954 3072 A 74 LYS HE3 A 74 LYS HGx 1.0 . 3.39 3955 3072 A 74 LYS HGy A 74 LYS HE2 1.0 . 3.39 3956 3072 A 74 LYS HE3 A 74 LYS HGy 1.0 . 3.39 3957 3073 A 75 GLU H A 75 GLU HB2 1.0 . 3.28 3958 3073 A 75 GLU H A 75 GLU HB3 1.0 . 3.28 3959 3074 A 75 GLU H A 75 GLU HGy 1.0 . 3.35 3960 3074 A 75 GLU H A 75 GLU HGx 1.0 . 3.35 3961 3075 A 75 GLU H A 76 PRO HDx 1.0 . 4.42 3962 3075 A 75 GLU H A 76 PRO HDy 1.0 . 4.42 3963 3076 A 75 GLU HB3 A 76 PRO HDx 1.0 . 3.23 3964 3076 A 76 PRO HDy A 75 GLU HB2 1.0 . 3.23 3965 3076 A 75 GLU HB3 A 76 PRO HDy 1.0 . 3.23 3966 3076 A 75 GLU HB2 A 76 PRO HDx 1.0 . 3.23 3967 3077 A 75 GLU HGx A 76 PRO HDx 1.0 . 3.78 3968 3077 A 75 GLU HGy A 76 PRO HDx 1.0 . 3.78 3969 3077 A 76 PRO HDy A 75 GLU HGy 1.0 . 3.78 3970 3077 A 75 GLU HGx A 76 PRO HDy 1.0 . 3.78 3971 3078 A 76 PRO HA A 77 TYR HBx 1.0 . 5.33 3972 3078 A 76 PRO HA A 77 TYR HBy 1.0 . 5.33 3973 3079 A 77 TYR H A 76 PRO HBx 1.0 . 3.51 3974 3079 A 77 TYR H A 76 PRO HBy 1.0 . 3.51 3975 3080 A 77 TYR H A 77 TYR HBx 1.0 . 2.95 3976 3080 A 77 TYR H A 77 TYR HBy 1.0 . 2.95 3977 3081 A 78 ILE H A 77 TYR HBx 1.0 . 3.33 3978 3081 A 78 ILE H A 77 TYR HBy 1.0 . 3.33 3979 3082 A 78 ILE HA A 77 TYR HBx 1.0 . 4.58 3980 3082 A 78 ILE HA A 77 TYR HBy 1.0 . 4.58 3981 3083 A 78 ILE H A 78 ILE HG1x 1.0 . 3.15 3982 3083 A 78 ILE H A 78 ILE HG1y 1.0 . 3.15 3983 3084 A 78 ILE HA A 78 ILE HG1x 1.0 . 3.46 3984 3084 A 78 ILE HA A 78 ILE HG1y 1.0 . 3.46 3985 3085 A 78 ILE HA A 79 SER HBx 1.0 . 4.68 3986 3085 A 78 ILE HA A 79 SER HBy 1.0 . 4.68 3987 3086 A 79 SER H A 78 ILE HG1x 1.0 . 3.99 3988 3086 A 79 SER H A 78 ILE HG1y 1.0 . 3.99 3989 3087 A 79 SER H A 79 SER HBx 1.0 . 3.44 3990 3087 A 79 SER H A 79 SER HBy 1.0 . 3.44 3991 3088 A 81 ASN H A 79 SER HBx 1.0 . 4.38 3992 3088 A 81 ASN H A 79 SER HBy 1.0 . 4.38 3993 3089 A 80 ASN HD21 A 80 ASN HB3 1.0 . 3.08 3994 3089 A 80 ASN HB2 A 80 ASN HD22 1.0 . 3.08 3995 3089 A 80 ASN HB2 A 80 ASN HD21 1.0 . 3.08 3996 3089 A 80 ASN HD22 A 80 ASN HB3 1.0 . 3.08 3997 3090 A 81 ASN H A 81 ASN HBx 1.0 . 3.34 3998 3090 A 81 ASN H A 81 ASN HBy 1.0 . 3.34 3999 3091 A 81 ASN HD21 A 81 ASN HBx 1.0 . 2.98 4000 3091 A 81 ASN HD22 A 81 ASN HBx 1.0 . 2.98 4001 3091 A 81 ASN HD21 A 81 ASN HBy 1.0 . 2.98 4002 3091 A 81 ASN HD22 A 81 ASN HBy 1.0 . 2.98 4003 3092 A 81 ASN HBx A 82 PRO HD2 1.0 . 3.82 4004 3092 A 81 ASN HBy A 82 PRO HD2 1.0 . 3.82 4005 3092 A 82 PRO HD3 A 81 ASN HBx 1.0 . 3.82 4006 3092 A 82 PRO HD3 A 81 ASN HBy 1.0 . 3.82 4007 3093 A 83 ASP H A 81 ASN HBx 1.0 . 3.71 4008 3093 A 83 ASP H A 81 ASN HBy 1.0 . 3.71 4009 3094 A 84 GLU H A 81 ASN HBx 1.0 . 3.71 4010 3094 A 84 GLU H A 81 ASN HBy 1.0 . 3.71 4011 3095 A 81 ASN HBy A 84 GLU HBy 1.0 . 3.68 4012 3095 A 81 ASN HBx A 84 GLU HBy 1.0 . 3.68 4013 3095 A 84 GLU HBx A 81 ASN HBx 1.0 . 3.68 4014 3095 A 81 ASN HBy A 84 GLU HBx 1.0 . 3.68 4015 3096 A 81 ASN HBx A 84 GLU HG2 1.0 . 3.98 4016 3096 A 81 ASN HBy A 84 GLU HG2 1.0 . 3.98 4017 3096 A 84 GLU HG3 A 81 ASN HBx 1.0 . 3.98 4018 3096 A 84 GLU HG3 A 81 ASN HBy 1.0 . 3.98 4019 3097 A 82 PRO HD3 A 81 ASN HD21 1.0 . 5.34 4020 3097 A 81 ASN HD21 A 82 PRO HD2 1.0 . 5.34 4021 3097 A 82 PRO HD3 A 81 ASN HD22 1.0 . 5.34 4022 3097 A 81 ASN HD22 A 82 PRO HD2 1.0 . 5.34 4023 3098 A 83 ASP H A 81 ASN HD21 1.0 . 5.31 4024 3098 A 83 ASP H A 81 ASN HD22 1.0 . 5.31 4025 3099 A 84 GLU H A 81 ASN HD21 1.0 . 4.34 4026 3099 A 84 GLU H A 81 ASN HD22 1.0 . 4.34 4027 3100 A 81 ASN HD21 A 84 GLU HBy 1.0 . 3.97 4028 3100 A 81 ASN HD21 A 84 GLU HBx 1.0 . 3.97 4029 3100 A 81 ASN HD22 A 84 GLU HBx 1.0 . 3.97 4030 3100 A 81 ASN HD22 A 84 GLU HBy 1.0 . 3.97 4031 3101 A 81 ASN HD21 A 84 GLU HG2 1.0 . 3.53 4032 3101 A 84 GLU HG3 A 81 ASN HD21 1.0 . 3.53 4033 3101 A 84 GLU HG3 A 81 ASN HD22 1.0 . 3.53 4034 3101 A 81 ASN HD22 A 84 GLU HG2 1.0 . 3.53 4035 3102 A 85 ILE HG2% A 81 ASN HD21 1.0 . 5.33 4036 3102 A 85 ILE HG2% A 81 ASN HD22 1.0 . 5.33 4037 3103 A 82 PRO HA A 85 ILE HG1x 1.0 . 4.18 4038 3103 A 82 PRO HA A 85 ILE HG1y 1.0 . 4.18 4039 3104 A 83 ASP H A 84 GLU HBy 1.0 . 4.38 4040 3104 A 83 ASP H A 84 GLU HBx 1.0 . 4.38 4041 3105 A 84 GLU H A 84 GLU HBy 1.0 . 2.95 4042 3105 A 84 GLU H A 84 GLU HBx 1.0 . 2.95 4043 3106 A 85 ILE H A 84 GLU HBy 1.0 . 3.25 4044 3106 A 85 ILE H A 84 GLU HBx 1.0 . 3.25 4045 3107 A 85 ILE HA A 84 GLU HBy 1.0 . 5.01 4046 3107 A 85 ILE HA A 84 GLU HBx 1.0 . 5.01 4047 3108 A 85 ILE HG2% A 84 GLU HBy 1.0 . 4.03 4048 3108 A 85 ILE HG2% A 84 GLU HBx 1.0 . 4.03 4049 3109 A 84 GLU HBy A 85 ILE HG1x 1.0 . 5.18 4050 3109 A 84 GLU HBx A 85 ILE HG1x 1.0 . 5.18 4051 3109 A 85 ILE HG1y A 84 GLU HBy 1.0 . 5.18 4052 3109 A 84 GLU HBx A 85 ILE HG1y 1.0 . 5.18 4053 3110 A 85 ILE H A 85 ILE HG1x 1.0 . 3.09 4054 3110 A 85 ILE H A 85 ILE HG1y 1.0 . 3.09 4055 3111 A 85 ILE HG2% A 85 ILE HG1x 1.0 . 2.88 4056 3111 A 85 ILE HG2% A 85 ILE HG1y 1.0 . 2.88 4057 3112 A 86 ARG H A 85 ILE HG1x 1.0 . 4.17 4058 3112 A 86 ARG H A 85 ILE HG1y 1.0 . 4.17 4059 3113 A 86 ARG H A 86 ARG HBx 1.0 . 3.03 4060 3113 A 86 ARG H A 86 ARG HBy 1.0 . 3.03 4061 3114 A 86 ARG HE A 86 ARG HBx 1.0 . 4.40 4062 3114 A 86 ARG HE A 86 ARG HBy 1.0 . 4.40 4063 3115 A 87 GLU H A 86 ARG HBx 1.0 . 3.89 4064 3115 A 87 GLU H A 86 ARG HBy 1.0 . 3.89 4065 3116 A 87 GLU HGx A 86 ARG HGx 1.0 . 4.92 4066 3116 A 87 GLU HGx A 86 ARG HGy 1.0 . 4.92 4067 3117 A 87 GLU HBy A 89 LYS HEy 1.0 . 4.26 4068 3117 A 87 GLU HBy A 89 LYS HEx 1.0 . 4.26 4069 3118 A 87 GLU HBx A 89 LYS HEy 1.0 . 5.00 4070 3118 A 87 GLU HBx A 89 LYS HEx 1.0 . 5.00 4071 3119 A 87 GLU HGy A 89 LYS HEy 1.0 . 4.68 4072 3119 A 87 GLU HGy A 89 LYS HEx 1.0 . 4.68 4073 3120 A 87 GLU HGx A 89 LYS HDy 1.0 . 4.46 4074 3120 A 87 GLU HGx A 89 LYS HDx 1.0 . 4.46 4075 3121 A 88 LYS H A 88 LYS HDy 1.0 . 5.08 4076 3121 A 88 LYS H A 88 LYS HDx 1.0 . 5.08 4077 3122 A 88 LYS HBy A 88 LYS HDy 1.0 . 3.67 4078 3122 A 88 LYS HBy A 88 LYS HDx 1.0 . 3.67 4079 3123 A 88 LYS HBy A 88 LYS HEy 1.0 . 4.48 4080 3123 A 88 LYS HBy A 88 LYS HEx 1.0 . 4.48 4081 3124 A 88 LYS HBx A 88 LYS HEy 1.0 . 4.27 4082 3124 A 88 LYS HBx A 88 LYS HEx 1.0 . 4.27 4083 3125 A 89 LYS H A 89 LYS HDy 1.0 . 4.19 4084 3125 A 89 LYS H A 89 LYS HDx 1.0 . 4.19 4085 3126 A 89 LYS H A 89 LYS HEy 1.0 . 4.49 4086 3126 A 89 LYS H A 89 LYS HEx 1.0 . 4.49 4087 3127 A 89 LYS HA A 89 LYS HDy 1.0 . 4.22 4088 3127 A 89 LYS HA A 89 LYS HDx 1.0 . 4.22 4089 3128 A 89 LYS HB3 A 89 LYS HDy 1.0 . 3.10 4090 3128 A 89 LYS HB2 A 89 LYS HDy 1.0 . 3.10 4091 3128 A 89 LYS HDx A 89 LYS HB2 1.0 . 3.10 4092 3128 A 89 LYS HB3 A 89 LYS HDx 1.0 . 3.10 4093 3129 A 89 LYS HB3 A 89 LYS HEy 1.0 . 4.28 4094 3129 A 89 LYS HEx A 89 LYS HB2 1.0 . 4.28 4095 3129 A 89 LYS HB3 A 89 LYS HEx 1.0 . 4.28 4096 3129 A 89 LYS HB2 A 89 LYS HEy 1.0 . 4.28 4097 3130 A 89 LYS HB3 A 91 LEU HD2% 1.0 . 3.80 4098 3130 A 89 LYS HB2 A 91 LEU HD2% 1.0 . 3.80 4099 3130 A 91 LEU HD1% A 89 LYS HB2 1.0 . 3.80 4100 3130 A 89 LYS HB3 A 91 LEU HD1% 1.0 . 3.80 4101 3131 A 89 LYS HGx A 89 LYS HEy 1.0 . 3.53 4102 3131 A 89 LYS HGx A 89 LYS HEx 1.0 . 3.53 4103 3132 A 90 PRO HA A 91 LEU HD2% 1.0 . 4.39 4104 3132 A 90 PRO HA A 91 LEU HD1% 1.0 . 4.39 4105 3133 A 90 PRO HBx A 92 ARG HG2 1.0 . 4.14 4106 3133 A 92 ARG HG3 A 90 PRO HBx 1.0 . 4.14 4107 3133 A 92 ARG HG3 A 90 PRO HBy 1.0 . 4.14 4108 3133 A 90 PRO HBy A 92 ARG HG2 1.0 . 4.14 4109 3134 A 90 PRO HG2 A 114 ASN HD21 1.0 . 4.74 4110 3134 A 90 PRO HG2 A 114 ASN HD22 1.0 . 4.74 4111 3135 A 90 PRO HDy A 91 LEU HD2% 1.0 . 4.83 4112 3135 A 90 PRO HDy A 91 LEU HD1% 1.0 . 4.83 4113 3136 A 91 LEU H A 91 LEU HD2% 1.0 . 3.69 4114 3136 A 91 LEU H A 91 LEU HD1% 1.0 . 3.69 4115 3137 A 91 LEU HA A 91 LEU HD2% 1.0 . 2.97 4116 3137 A 91 LEU HA A 91 LEU HD1% 1.0 . 2.97 4117 3138 A 92 ARG H A 91 LEU HD2% 1.0 . 4.17 4118 3138 A 92 ARG H A 91 LEU HD1% 1.0 . 4.17 4119 3139 A 93 TYR HE% A 91 LEU HD2% 1.0 . 4.01 4120 3139 A 93 TYR HE% A 91 LEU HD1% 1.0 . 4.01 4121 3140 A 113 PHE HD% A 91 LEU HD2% 1.0 . 4.86 4122 3140 A 113 PHE HD% A 91 LEU HD1% 1.0 . 4.86 4123 3141 A 113 PHE HE% A 91 LEU HD2% 1.0 . 3.23 4124 3141 A 113 PHE HE% A 91 LEU HD1% 1.0 . 3.23 4125 3142 A 113 PHE HZ A 91 LEU HD2% 1.0 . 3.16 4126 3142 A 113 PHE HZ A 91 LEU HD1% 1.0 . 3.16 4127 3143 A 114 ASN HD22 A 91 LEU HD2% 1.0 . 3.96 4128 3143 A 114 ASN HD21 A 91 LEU HD2% 1.0 . 3.96 4129 3143 A 114 ASN HD22 A 91 LEU HD1% 1.0 . 3.96 4130 3143 A 114 ASN HD21 A 91 LEU HD1% 1.0 . 3.96 4131 3144 A 92 ARG H A 92 ARG HDx 1.0 . 4.05 4132 3144 A 92 ARG H A 92 ARG HDy 1.0 . 4.05 4133 3145 A 92 ARG H A 114 ASN HBy 1.0 . 5.12 4134 3145 A 92 ARG H A 114 ASN HBx 1.0 . 5.12 4135 3146 A 92 ARG H A 114 ASN HD22 1.0 . 3.78 4136 3146 A 92 ARG H A 114 ASN HD21 1.0 . 3.78 4137 3147 A 92 ARG HA A 92 ARG HDx 1.0 . 4.64 4138 3147 A 92 ARG HA A 92 ARG HDy 1.0 . 4.64 4139 3148 A 92 ARG HB2 A 114 ASN HBy 1.0 . 5.34 4140 3148 A 92 ARG HB3 A 114 ASN HBy 1.0 . 5.34 4141 3148 A 114 ASN HBx A 92 ARG HB2 1.0 . 5.34 4142 3148 A 92 ARG HB3 A 114 ASN HBx 1.0 . 5.34 4143 3149 A 114 ASN HA A 92 ARG HDx 1.0 . 4.11 4144 3149 A 114 ASN HA A 92 ARG HDy 1.0 . 4.11 4145 3150 A 93 TYR HA A 111 VAL HG2% 1.0 . 5.35 4146 3150 A 93 TYR HA A 111 VAL HG1% 1.0 . 5.35 4147 3151 A 93 TYR HD% A 111 VAL HG2% 1.0 . 4.02 4148 3151 A 93 TYR HD% A 111 VAL HG1% 1.0 . 4.02 4149 3152 A 94 GLY H A 111 VAL HG2% 1.0 . 4.91 4150 3152 A 94 GLY H A 111 VAL HG1% 1.0 . 4.91 4151 3153 A 96 VAL HB A 111 VAL HG2% 1.0 . 5.18 4152 3153 A 96 VAL HB A 111 VAL HG1% 1.0 . 5.18 4153 3154 A 96 VAL HG1% A 111 VAL HG2% 1.0 . 3.77 4154 3154 A 96 VAL HG1% A 111 VAL HG1% 1.0 . 3.77 4155 3155 A 97 TYR HD% A 111 VAL HG2% 1.0 . 5.44 4156 3155 A 97 TYR HD% A 111 VAL HG1% 1.0 . 5.44 4157 3156 A 101 GLU H A 101 GLU HBy 1.0 . 3.31 4158 3156 A 101 GLU H A 101 GLU HBx 1.0 . 3.31 4159 3157 A 101 GLU H A 101 GLU HG2 1.0 . 3.58 4160 3157 A 101 GLU H A 101 GLU HG3 1.0 . 3.58 4161 3158 A 101 GLU HA A 101 GLU HG2 1.0 . 3.05 4162 3158 A 101 GLU HA A 101 GLU HG3 1.0 . 3.05 4163 3159 A 102 ASP H A 101 GLU HBy 1.0 . 3.33 4164 3159 A 102 ASP H A 101 GLU HBx 1.0 . 3.33 4165 3160 A 103 SER H A 101 GLU HBy 1.0 . 4.20 4166 3160 A 103 SER H A 101 GLU HBx 1.0 . 4.20 4167 3161 A 106 LYS H A 101 GLU HBy 1.0 . 4.25 4168 3161 A 106 LYS H A 101 GLU HBx 1.0 . 4.25 4169 3162 A 102 ASP H A 101 GLU HG2 1.0 . 4.32 4170 3162 A 102 ASP H A 101 GLU HG3 1.0 . 4.32 4171 3163 A 102 ASP H A 102 ASP HBy 1.0 . 3.06 4172 3163 A 102 ASP H A 102 ASP HBx 1.0 . 3.06 4173 3164 A 103 SER H A 102 ASP HBy 1.0 . 4.08 4174 3164 A 103 SER H A 102 ASP HBx 1.0 . 4.08 4175 3165 A 102 ASP HBx A 103 SER HB3 1.0 . 5.18 4176 3165 A 102 ASP HBy A 103 SER HB3 1.0 . 5.18 4177 3165 A 103 SER HB2 A 102 ASP HBy 1.0 . 5.18 4178 3165 A 102 ASP HBx A 103 SER HB2 1.0 . 5.18 4179 3166 A 103 SER H A 103 SER HB3 1.0 . 3.32 4180 3166 A 103 SER H A 103 SER HB2 1.0 . 3.32 4181 3167 A 103 SER HB2 A 104 ASP HBx 1.0 . 4.41 4182 3167 A 103 SER HB3 A 104 ASP HBx 1.0 . 4.41 4183 3167 A 104 ASP HBy A 103 SER HB3 1.0 . 4.41 4184 3167 A 103 SER HB2 A 104 ASP HBy 1.0 . 4.41 4185 3168 A 105 ALA H A 103 SER HB3 1.0 . 3.86 4186 3168 A 105 ALA H A 103 SER HB2 1.0 . 3.86 4187 3169 A 104 ASP H A 104 ASP HBx 1.0 . 3.20 4188 3169 A 104 ASP H A 104 ASP HBy 1.0 . 3.20 4189 3170 A 104 ASP HA A 104 ASP HBx 1.0 . 2.61 4190 3170 A 104 ASP HA A 104 ASP HBy 1.0 . 2.61 4191 3171 A 105 ALA H A 104 ASP HBx 1.0 . 3.93 4192 3171 A 105 ALA H A 104 ASP HBy 1.0 . 3.93 4193 3172 A 106 LYS H A 106 LYS HBy 1.0 . 3.50 4194 3172 A 106 LYS H A 106 LYS HBx 1.0 . 3.50 4195 3173 A 106 LYS HA A 106 LYS HG3 1.0 . 3.14 4196 3173 A 106 LYS HA A 106 LYS HG2 1.0 . 3.14 4197 3174 A 106 LYS HBy A 106 LYS HE2 1.0 . 4.01 4198 3174 A 106 LYS HBx A 106 LYS HE2 1.0 . 4.01 4199 3174 A 106 LYS HE3 A 106 LYS HBy 1.0 . 4.01 4200 3174 A 106 LYS HE3 A 106 LYS HBx 1.0 . 4.01 4201 3175 A 107 ASP H A 106 LYS HBy 1.0 . 4.08 4202 3175 A 107 ASP H A 106 LYS HBx 1.0 . 4.08 4203 3176 A 107 ASP HA A 122 LEU HB2 1.0 . 3.93 4204 3176 A 107 ASP HA A 122 LEU HB3 1.0 . 3.93 4205 3177 A 107 ASP HA A 122 LEU HD2% 1.0 . 3.50 4206 3177 A 107 ASP HA A 122 LEU HD1% 1.0 . 3.50 4207 3178 A 107 ASP HB3 A 121 VAL HG2% 1.0 . 4.01 4208 3178 A 107 ASP HB2 A 121 VAL HG2% 1.0 . 4.01 4209 3178 A 121 VAL HG1% A 107 ASP HB2 1.0 . 4.01 4210 3178 A 107 ASP HB3 A 121 VAL HG1% 1.0 . 4.01 4211 3179 A 107 ASP HB3 A 122 LEU HD2% 1.0 . 3.70 4212 3179 A 107 ASP HB2 A 122 LEU HD2% 1.0 . 3.70 4213 3179 A 122 LEU HD1% A 107 ASP HB2 1.0 . 3.70 4214 3179 A 107 ASP HB3 A 122 LEU HD1% 1.0 . 3.70 4215 3180 A 125 ASN HD22 A 107 ASP HB2 1.0 . 3.23 4216 3180 A 125 ASN HD21 A 107 ASP HB2 1.0 . 3.23 4217 3180 A 107 ASP HB3 A 125 ASN HD22 1.0 . 3.23 4218 3180 A 107 ASP HB3 A 125 ASN HD21 1.0 . 3.23 4219 3181 A 108 GLU H A 121 VAL HG2% 1.0 . 5.17 4220 3181 A 108 GLU H A 121 VAL HG1% 1.0 . 5.17 4221 3182 A 108 GLU HA A 121 VAL HG2% 1.0 . 3.88 4222 3182 A 108 GLU HA A 121 VAL HG1% 1.0 . 3.88 4223 3183 A 108 GLU HBx A 121 VAL HG2% 1.0 . 4.11 4224 3183 A 108 GLU HBx A 121 VAL HG1% 1.0 . 4.11 4225 3184 A 108 GLU HBy A 121 VAL HG2% 1.0 . 4.28 4226 3184 A 108 GLU HBy A 121 VAL HG1% 1.0 . 4.28 4227 3185 A 108 GLU HG2 A 121 VAL HG2% 1.0 . 3.16 4228 3185 A 108 GLU HG2 A 121 VAL HG1% 1.0 . 3.16 4229 3186 A 108 GLU HG3 A 121 VAL HG2% 1.0 . 3.38 4230 3186 A 108 GLU HG3 A 121 VAL HG1% 1.0 . 3.38 4231 3187 A 109 ILE H A 111 VAL HG2% 1.0 . 5.14 4232 3187 A 109 ILE H A 111 VAL HG1% 1.0 . 5.14 4233 3188 A 109 ILE HD1% A 111 VAL HG2% 1.0 . 3.35 4234 3188 A 109 ILE HD1% A 111 VAL HG1% 1.0 . 3.35 4235 3189 A 110 ILE H A 111 VAL HG2% 1.0 . 4.92 4236 3189 A 110 ILE H A 111 VAL HG1% 1.0 . 4.92 4237 3190 A 111 VAL H A 111 VAL HG2% 1.0 . 3.32 4238 3190 A 111 VAL H A 111 VAL HG1% 1.0 . 3.32 4239 3191 A 112 GLU H A 111 VAL HG2% 1.0 . 3.38 4240 3191 A 112 GLU H A 111 VAL HG1% 1.0 . 3.38 4241 3192 A 112 GLU HA A 111 VAL HG2% 1.0 . 5.12 4242 3192 A 112 GLU HA A 111 VAL HG1% 1.0 . 5.12 4243 3193 A 113 PHE H A 111 VAL HG2% 1.0 . 4.78 4244 3193 A 113 PHE H A 111 VAL HG1% 1.0 . 4.78 4245 3194 A 113 PHE HA A 111 VAL HG2% 1.0 . 4.96 4246 3194 A 113 PHE HA A 111 VAL HG1% 1.0 . 4.96 4247 3195 A 113 PHE HBy A 111 VAL HG2% 1.0 . 4.26 4248 3195 A 113 PHE HBy A 111 VAL HG1% 1.0 . 4.26 4249 3196 A 113 PHE HBx A 111 VAL HG2% 1.0 . 4.95 4250 3196 A 113 PHE HBx A 111 VAL HG1% 1.0 . 4.95 4251 3197 A 113 PHE HE% A 111 VAL HG2% 1.0 . 5.44 4252 3197 A 113 PHE HE% A 111 VAL HG1% 1.0 . 5.44 4253 3198 A 118 TYR H A 111 VAL HG2% 1.0 . 4.52 4254 3198 A 118 TYR H A 111 VAL HG1% 1.0 . 4.52 4255 3199 A 111 VAL HG2% A 118 TYR HB2 1.0 . 4.40 4256 3199 A 111 VAL HG1% A 118 TYR HB2 1.0 . 4.40 4257 3199 A 118 TYR HB3 A 111 VAL HG2% 1.0 . 4.40 4258 3199 A 118 TYR HB3 A 111 VAL HG1% 1.0 . 4.40 4259 3200 A 120 ALA H A 111 VAL HG2% 1.0 . 4.66 4260 3200 A 120 ALA H A 111 VAL HG1% 1.0 . 4.66 4261 3201 A 120 ALA HA A 111 VAL HG2% 1.0 . 5.21 4262 3201 A 120 ALA HA A 111 VAL HG1% 1.0 . 5.21 4263 3202 A 120 ALA HB% A 111 VAL HG2% 1.0 . 3.07 4264 3202 A 120 ALA HB% A 111 VAL HG1% 1.0 . 3.07 4265 3203 A 113 PHE HD% A 114 ASN HD21 1.0 . 4.39 4266 3203 A 113 PHE HD% A 114 ASN HD22 1.0 . 4.39 4267 3204 A 113 PHE HZ A 114 ASN HD21 1.0 . 3.88 4268 3204 A 113 PHE HZ A 114 ASN HD22 1.0 . 3.88 4269 3205 A 114 ASN HD22 A 114 ASN HBx 1.0 . 3.07 4270 3205 A 114 ASN HD21 A 114 ASN HBx 1.0 . 3.07 4271 3205 A 114 ASN HD21 A 114 ASN HBy 1.0 . 3.07 4272 3205 A 114 ASN HD22 A 114 ASN HBy 1.0 . 3.07 4273 3206 A 115 ARG H A 114 ASN HBy 1.0 . 4.20 4274 3206 A 115 ARG H A 114 ASN HBx 1.0 . 4.20 4275 3207 A 116 GLU H A 114 ASN HBy 1.0 . 4.56 4276 3207 A 116 GLU H A 114 ASN HBx 1.0 . 4.56 4277 3208 A 115 ARG H A 115 ARG HB3 1.0 . 3.54 4278 3208 A 115 ARG HB2 A 115 ARG H 1.0 . 3.54 4279 3209 A 115 ARG HB2 A 115 ARG HD2 1.0 . 2.99 4280 3209 A 115 ARG HB3 A 115 ARG HD2 1.0 . 2.99 4281 3209 A 115 ARG HD3 A 115 ARG HB3 1.0 . 2.99 4282 3209 A 115 ARG HD3 A 115 ARG HB2 1.0 . 2.99 4283 3210 A 116 GLU H A 116 GLU HGy 1.0 . 3.69 4284 3210 A 116 GLU H A 116 GLU HGx 1.0 . 3.69 4285 3211 A 116 GLU HA A 116 GLU HGy 1.0 . 3.25 4286 3211 A 116 GLU HA A 116 GLU HGx 1.0 . 3.25 4287 3212 A 117 TYR H A 116 GLU HGy 1.0 . 4.48 4288 3212 A 117 TYR H A 116 GLU HGx 1.0 . 4.48 4289 3213 A 118 TYR HE% A 116 GLU HGy 1.0 . 4.27 4290 3213 A 118 TYR HE% A 116 GLU HGx 1.0 . 4.27 4291 3214 A 119 ARG HDx A 121 VAL HG2% 1.0 . 4.37 4292 3214 A 119 ARG HDx A 121 VAL HG1% 1.0 . 4.37 4293 3215 A 119 ARG HDy A 121 VAL HG2% 1.0 . 4.32 4294 3215 A 119 ARG HDy A 121 VAL HG1% 1.0 . 4.32 4295 3216 A 120 ALA HA A 121 VAL HG2% 1.0 . 4.10 4296 3216 A 120 ALA HA A 121 VAL HG1% 1.0 . 4.10 4297 3217 A 121 VAL H A 121 VAL HG2% 1.0 . 2.98 4298 3217 A 121 VAL H A 121 VAL HG1% 1.0 . 2.98 4299 3218 A 121 VAL HA A 121 VAL HG2% 1.0 . 3.13 4300 3218 A 121 VAL HA A 121 VAL HG1% 1.0 . 3.13 4301 3219 A 121 VAL HA A 122 LEU HB2 1.0 . 5.34 4302 3219 A 121 VAL HA A 122 LEU HB3 1.0 . 5.34 4303 3220 A 122 LEU H A 121 VAL HG2% 1.0 . 3.35 4304 3220 A 122 LEU H A 121 VAL HG1% 1.0 . 3.35 4305 3221 A 122 LEU HA A 121 VAL HG2% 1.0 . 5.44 4306 3221 A 122 LEU HA A 121 VAL HG1% 1.0 . 5.44 4307 3222 A 121 VAL HG1% A 122 LEU HD2% 1.0 . 5.37 4308 3222 A 121 VAL HG2% A 122 LEU HD2% 1.0 . 5.37 4309 3222 A 122 LEU HD1% A 121 VAL HG2% 1.0 . 5.37 4310 3222 A 122 LEU HD1% A 121 VAL HG1% 1.0 . 5.37 4311 3223 A 123 ILE HA A 121 VAL HG2% 1.0 . 4.35 4312 3223 A 123 ILE HA A 121 VAL HG1% 1.0 . 4.35 4313 3224 A 122 LEU H A 122 LEU HB2 1.0 . 3.13 4314 3224 A 122 LEU H A 122 LEU HB3 1.0 . 3.13 4315 3225 A 122 LEU H A 125 ASN HBx 1.0 . 5.34 4316 3225 A 122 LEU H A 125 ASN HBy 1.0 . 5.34 4317 3226 A 122 LEU HA A 122 LEU HD2% 1.0 . 3.26 4318 3226 A 122 LEU HA A 122 LEU HD1% 1.0 . 3.26 4319 3227 A 122 LEU HB3 A 124 LYS HE2 1.0 . 5.34 4320 3227 A 122 LEU HB2 A 124 LYS HE2 1.0 . 5.34 4321 3227 A 124 LYS HE3 A 122 LEU HB2 1.0 . 5.34 4322 3227 A 124 LYS HE3 A 122 LEU HB3 1.0 . 5.34 4323 3228 A 125 ASN HD21 A 122 LEU HB2 1.0 . 3.78 4324 3228 A 122 LEU HB3 A 125 ASN HD21 1.0 . 3.78 4325 3228 A 122 LEU HB3 A 125 ASN HD22 1.0 . 3.78 4326 3228 A 125 ASN HD22 A 122 LEU HB2 1.0 . 3.78 4327 3229 A 122 LEU HG A 125 ASN HD21 1.0 . 4.80 4328 3229 A 122 LEU HG A 125 ASN HD22 1.0 . 4.80 4329 3230 A 123 ILE H A 122 LEU HD2% 1.0 . 3.47 4330 3230 A 123 ILE H A 122 LEU HD1% 1.0 . 3.47 4331 3231 A 124 LYS H A 122 LEU HD2% 1.0 . 3.96 4332 3231 A 124 LYS H A 122 LEU HD1% 1.0 . 3.96 4333 3232 A 122 LEU HD2% A 124 LYS HBy 1.0 . 4.83 4334 3232 A 122 LEU HD1% A 124 LYS HBy 1.0 . 4.83 4335 3232 A 124 LYS HBx A 122 LEU HD2% 1.0 . 4.83 4336 3232 A 124 LYS HBx A 122 LEU HD1% 1.0 . 4.83 4337 3233 A 122 LEU HD2% A 124 LYS HE2 1.0 . 3.76 4338 3233 A 124 LYS HE3 A 122 LEU HD2% 1.0 . 3.76 4339 3233 A 124 LYS HE3 A 122 LEU HD1% 1.0 . 3.76 4340 3233 A 122 LEU HD1% A 124 LYS HE2 1.0 . 3.76 4341 3234 A 125 ASN HD21 A 122 LEU HD2% 1.0 . 4.27 4342 3234 A 125 ASN HD22 A 122 LEU HD1% 1.0 . 4.27 4343 3234 A 125 ASN HD21 A 122 LEU HD1% 1.0 . 4.27 4344 3234 A 125 ASN HD22 A 122 LEU HD2% 1.0 . 4.27 4345 3235 A 123 ILE HA A 126 GLU HBy 1.0 . 4.81 4346 3235 A 123 ILE HA A 126 GLU HBx 1.0 . 4.81 4347 3236 A 124 LYS H A 124 LYS HBy 1.0 . 2.91 4348 3236 A 124 LYS HBx A 124 LYS H 1.0 . 2.91 4349 3237 A 124 LYS HBy A 124 LYS HE2 1.0 . 4.28 4350 3237 A 124 LYS HBx A 124 LYS HE2 1.0 . 4.28 4351 3237 A 124 LYS HE3 A 124 LYS HBy 1.0 . 4.28 4352 3237 A 124 LYS HBx A 124 LYS HE3 1.0 . 4.28 4353 3238 A 124 LYS HG2 A 125 ASN HBx 1.0 . 5.34 4354 3238 A 124 LYS HG3 A 125 ASN HBx 1.0 . 5.34 4355 3238 A 125 ASN HBy A 124 LYS HG2 1.0 . 5.34 4356 3238 A 124 LYS HG3 A 125 ASN HBy 1.0 . 5.34 4357 3239 A 125 ASN HD22 A 125 ASN HBy 1.0 . 2.97 4358 3239 A 125 ASN HD21 A 125 ASN HBx 1.0 . 2.97 4359 3239 A 125 ASN HD21 A 125 ASN HBy 1.0 . 2.97 4360 3239 A 125 ASN HD22 A 125 ASN HBx 1.0 . 2.97 4361 3240 A 126 GLU H A 125 ASN HBx 1.0 . 3.44 4362 3240 A 126 GLU H A 125 ASN HBy 1.0 . 3.44 4363 3241 A 126 GLU H A 126 GLU HBy 1.0 . 3.39 4364 3241 A 126 GLU H A 126 GLU HBx 1.0 . 3.39 4365 3242 A 127 LYS H A 126 GLU HBy 1.0 . 3.74 4366 3242 A 127 LYS H A 126 GLU HBx 1.0 . 3.74 4367 3243 A 127 LYS H A 127 LYS HBy 1.0 . 2.98 4368 3243 A 127 LYS H A 127 LYS HBx 1.0 . 2.98 4369 3244 A 127 LYS H A 128 GLU HB2 1.0 . 4.44 4370 3244 A 127 LYS H A 128 GLU HB3 1.0 . 4.44 4371 3245 A 127 LYS HBy A 127 LYS HE2 1.0 . 4.39 4372 3245 A 127 LYS HBx A 127 LYS HE2 1.0 . 4.39 4373 3245 A 127 LYS HE3 A 127 LYS HBy 1.0 . 4.39 4374 3245 A 127 LYS HBx A 127 LYS HE3 1.0 . 4.39 4375 3246 A 128 GLU H A 128 GLU HB2 1.0 . 2.89 4376 3246 A 128 GLU H A 128 GLU HB3 1.0 . 2.89 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _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 32 TYR H A 35 GLN O 1.0 . 2.2 2 2 A 35 GLN O A 32 TYR N 1.0 . 3.2 3 3 A 39 LEU H A 28 ASP O 1.0 . 2.2 4 4 A 28 ASP O A 39 LEU N 1.0 . 3.2 5 5 A 40 LYS H A 119 ARG O 1.0 . 2.2 6 6 A 119 ARG O A 40 LYS N 1.0 . 3.2 7 7 A 55 ILE H A 94 GLY O 1.0 . 2.2 8 8 A 94 GLY O A 55 ILE N 1.0 . 3.2 9 9 A 59 PHE H A 91 LEU O 1.0 . 2.2 10 10 A 91 LEU O A 59 PHE N 1.0 . 3.2 11 11 A 68 TRP H A 60 PHE O 1.0 . 2.2 12 12 A 60 PHE O A 68 TRP N 1.0 . 3.2 13 13 A 89 LYS H A 61 VAL O 1.0 . 2.2 14 14 A 61 VAL O A 89 LYS N 1.0 . 3.2 15 15 A 91 LEU H A 59 PHE O 1.0 . 2.2 16 16 A 59 PHE O A 91 LEU N 1.0 . 3.2 17 17 A 97 TYR H A 110 ILE O 1.0 . 2.2 18 18 A 110 ILE O A 97 TYR N 1.0 . 3.2 19 19 A 98 SER H A 50 LYS O 1.0 . 2.2 20 20 A 50 LYS O A 98 SER N 1.0 . 3.2 21 21 A 109 ILE H A 120 ALA O 1.0 . 2.2 22 22 A 120 ALA O A 109 ILE N 1.0 . 3.2 23 23 A 110 ILE H A 97 TYR O 1.0 . 2.2 24 24 A 97 TYR O A 110 ILE N 1.0 . 3.2 25 25 A 111 VAL H A 118 TYR O 1.0 . 2.2 26 26 A 118 TYR O A 111 VAL N 1.0 . 3.2 27 27 A 112 GLU H A 95 LYS O 1.0 . 2.2 28 28 A 95 LYS O A 112 GLU N 1.0 . 3.2 29 29 A 120 ALA H A 109 ILE O 1.0 . 2.2 30 30 A 109 ILE O A 120 ALA N 1.0 . 3.2 31 31 A 35 GLN H A 32 TYR O 1.0 . 2.2 32 32 A 32 TYR O A 35 GLN N 1.0 . 3.2 33 33 A 121 VAL H A 38 HIS O 1.0 . 2.2 34 34 A 38 HIS O A 121 VAL N 1.0 . 3.2 35 35 A 118 TYR H A 111 VAL O 1.0 . 2.2 36 36 A 111 VAL O A 118 TYR N 1.0 . 3.2 stop_ save_ save_DYANA/DIANA_distance_constraints_6 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_6 _nef_distance_restraint_list.restraint_origin hbond _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 32 TYR H A 35 GLN O 1.0 . 2.2 2 2 A 35 GLN O A 32 TYR N 1.0 . 3.2 3 3 A 39 LEU H A 28 ASP O 1.0 . 2.2 4 4 A 28 ASP O A 39 LEU N 1.0 . 3.2 5 5 A 40 LYS H A 119 ARG O 1.0 . 2.2 6 6 A 119 ARG O A 40 LYS N 1.0 . 3.2 7 7 A 55 ILE H A 94 GLY O 1.0 . 2.2 8 8 A 94 GLY O A 55 ILE N 1.0 . 3.2 9 9 A 59 PHE H A 91 LEU O 1.0 . 2.2 10 10 A 91 LEU O A 59 PHE N 1.0 . 3.2 11 11 A 68 TRP H A 60 PHE O 1.0 . 2.2 12 12 A 60 PHE O A 68 TRP N 1.0 . 3.2 13 13 A 89 LYS H A 61 VAL O 1.0 . 2.2 14 14 A 61 VAL O A 89 LYS N 1.0 . 3.2 15 15 A 91 LEU H A 59 PHE O 1.0 . 2.2 16 16 A 59 PHE O A 91 LEU N 1.0 . 3.2 17 17 A 97 TYR H A 110 ILE O 1.0 . 2.2 18 18 A 110 ILE O A 97 TYR N 1.0 . 3.2 19 19 A 98 SER H A 50 LYS O 1.0 . 2.2 20 20 A 50 LYS O A 98 SER N 1.0 . 3.2 21 21 A 109 ILE H A 120 ALA O 1.0 . 2.2 22 22 A 120 ALA O A 109 ILE N 1.0 . 3.2 23 23 A 110 ILE H A 97 TYR O 1.0 . 2.2 24 24 A 97 TYR O A 110 ILE N 1.0 . 3.2 25 25 A 111 VAL H A 118 TYR O 1.0 . 2.2 26 26 A 118 TYR O A 111 VAL N 1.0 . 3.2 27 27 A 112 GLU H A 95 LYS O 1.0 . 2.2 28 28 A 95 LYS O A 112 GLU N 1.0 . 3.2 29 29 A 120 ALA H A 109 ILE O 1.0 . 2.2 30 30 A 109 ILE O A 120 ALA N 1.0 . 3.2 31 31 A 35 GLN H A 32 TYR O 1.0 . 2.2 32 32 A 32 TYR O A 35 GLN N 1.0 . 3.2 33 33 A 121 VAL H A 38 HIS O 1.0 . 2.2 34 34 A 38 HIS O A 121 VAL N 1.0 . 3.2 35 35 A 118 TYR H A 111 VAL O 1.0 . 2.2 36 36 A 111 VAL O A 118 TYR N 1.0 . 3.2 37 37 A 32 TYR H A 35 GLN O 1.0 . 1.8 38 38 A 35 GLN O A 32 TYR N 1.0 . 2.7 39 39 A 39 LEU H A 28 ASP O 1.0 . 1.8 40 40 A 28 ASP O A 39 LEU N 1.0 . 2.7 41 41 A 40 LYS H A 119 ARG O 1.0 . 1.8 42 42 A 119 ARG O A 40 LYS N 1.0 . 2.7 43 43 A 55 ILE H A 94 GLY O 1.0 . 1.8 44 44 A 94 GLY O A 55 ILE N 1.0 . 2.7 45 45 A 59 PHE H A 91 LEU O 1.0 . 1.8 46 46 A 91 LEU O A 59 PHE N 1.0 . 2.7 47 47 A 68 TRP H A 60 PHE O 1.0 . 1.8 48 48 A 60 PHE O A 68 TRP N 1.0 . 2.7 49 49 A 89 LYS H A 61 VAL O 1.0 . 1.8 50 50 A 61 VAL O A 89 LYS N 1.0 . 2.7 51 51 A 91 LEU H A 59 PHE O 1.0 . 1.8 52 52 A 59 PHE O A 91 LEU N 1.0 . 2.7 53 53 A 97 TYR H A 110 ILE O 1.0 . 1.8 54 54 A 110 ILE O A 97 TYR N 1.0 . 2.7 55 55 A 98 SER H A 50 LYS O 1.0 . 1.8 56 56 A 50 LYS O A 98 SER N 1.0 . 2.7 57 57 A 109 ILE H A 120 ALA O 1.0 . 1.8 58 58 A 120 ALA O A 109 ILE N 1.0 . 2.7 59 59 A 110 ILE H A 97 TYR O 1.0 . 1.8 60 60 A 97 TYR O A 110 ILE N 1.0 . 2.7 61 61 A 111 VAL H A 118 TYR O 1.0 . 1.8 62 62 A 118 TYR O A 111 VAL N 1.0 . 2.7 63 63 A 112 GLU H A 95 LYS O 1.0 . 1.8 64 64 A 95 LYS O A 112 GLU N 1.0 . 2.7 65 65 A 120 ALA H A 109 ILE O 1.0 . 1.8 66 66 A 109 ILE O A 120 ALA N 1.0 . 2.7 67 67 A 35 GLN H A 32 TYR O 1.0 . 1.8 68 68 A 32 TYR O A 35 GLN N 1.0 . 2.7 69 69 A 121 VAL H A 38 HIS O 1.0 . 1.8 70 70 A 38 HIS O A 121 VAL N 1.0 . 2.7 71 71 A 118 TYR H A 111 VAL O 1.0 . 1.8 72 72 A 111 VAL O A 118 TYR N 1.0 . 2.7 stop_ save_ save_DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 16 GLU C A 17 THR N A 17 THR CA A 17 THR C 1.0 -153.2 -52.0 PHI 2 2 A 17 THR N A 17 THR CA A 17 THR C A 18 MET N 1.0 142.8 178.8 PSI 3 3 A 17 THR C A 18 MET N A 18 MET CA A 18 MET C 1.0 -71.8 -51.8 PHI 4 4 A 18 MET N A 18 MET CA A 18 MET C A 19 GLU N 1.0 -51.5 -29.4 PSI 5 5 A 18 MET C A 19 GLU N A 19 GLU CA A 19 GLU C 1.0 -72.1 -51.3 PHI 6 6 A 19 GLU N A 19 GLU CA A 19 GLU C A 20 SER N 1.0 -51.3 -31.3 PSI 7 7 A 19 GLU C A 20 SER N A 20 SER CA A 20 SER C 1.0 -73.8 -53.8 PHI 8 8 A 20 SER N A 20 SER CA A 20 SER C A 21 LEU N 1.0 -52.4 -32.4 PSI 9 9 A 20 SER C A 21 LEU N A 21 LEU CA A 21 LEU C 1.0 -75.4 -55.4 PHI 10 10 A 21 LEU N A 21 LEU CA A 21 LEU C A 22 ILE N 1.0 -53.5 -33.5 PSI 11 11 A 21 LEU C A 22 ILE N A 22 ILE CA A 22 ILE C 1.0 -76.2 -56.2 PHI 12 12 A 22 ILE N A 22 ILE CA A 22 ILE C A 23 ASP N 1.0 -50.8 -30.8 PSI 13 13 A 22 ILE C A 23 ASP N A 23 ASP CA A 23 ASP C 1.0 -74.2 -54.2 PHI 14 14 A 23 ASP N A 23 ASP CA A 23 ASP C A 24 LYS N 1.0 -42.7 -10.0 PSI 15 15 A 23 ASP C A 24 LYS N A 24 LYS CA A 24 LYS C 1.0 -118.6 -70.5 PHI 16 16 A 24 LYS N A 24 LYS CA A 24 LYS C A 25 GLY N 1.0 -11.1 13.6 PSI 17 17 A 24 LYS C A 25 GLY N A 25 GLY CA A 25 GLY C 1.0 58.9 116.2 PHI 18 18 A 25 GLY N A 25 GLY CA A 25 GLY C A 26 LYS N 1.0 -11.4 38.7 PSI 19 19 A 26 LYS C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -97.5 -51.0 PHI 20 20 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 ASP N 1.0 -43.4 12.5 PSI 21 21 A 27 LEU C A 28 ASP N A 28 ASP CA A 28 ASP C 1.0 -110.9 -77.8 PHI 22 22 A 28 ASP N A 28 ASP CA A 28 ASP C A 29 GLN N 1.0 -31.5 38.2 PSI 23 23 A 28 ASP C A 29 GLN N A 29 GLN CA A 29 GLN C 1.0 -169.4 -93.2 PHI 24 24 A 29 GLN N A 29 GLN CA A 29 GLN C A 30 VAL N 1.0 141.9 173.6 PSI 25 25 A 29 GLN C A 30 VAL N A 30 VAL CA A 30 VAL C 1.0 -164.1 -119.6 PHI 26 26 A 30 VAL N A 30 VAL CA A 30 VAL C A 31 VAL N 1.0 137.4 178.4 PSI 27 27 A 30 VAL C A 31 VAL N A 31 VAL CA A 31 VAL C 1.0 -144.2 -87.2 PHI 28 28 A 31 VAL N A 31 VAL CA A 31 VAL C A 32 TYR N 1.0 102.7 162.5 PSI 29 29 A 31 VAL C A 32 TYR N A 32 TYR CA A 32 TYR C 1.0 -166.1 -105.5 PHI 30 30 A 32 TYR N A 32 TYR CA A 32 TYR C A 33 ASP N 1.0 104.5 143.5 PSI 31 31 A 32 TYR C A 33 ASP N A 33 ASP CA A 33 ASP C 1.0 43.6 63.6 PHI 32 32 A 33 ASP N A 33 ASP CA A 33 ASP C A 34 ASP N 1.0 34.9 54.9 PSI 33 33 A 33 ASP C A 34 ASP N A 34 ASP CA A 34 ASP C 1.0 53.2 77.4 PHI 34 34 A 34 ASP N A 34 ASP CA A 34 ASP C A 35 GLN N 1.0 2.2 34.3 PSI 35 35 A 34 ASP C A 35 GLN N A 35 GLN CA A 35 GLN C 1.0 -149.6 -82.7 PHI 36 36 A 35 GLN N A 35 GLN CA A 35 GLN C A 36 LEU N 1.0 122.4 180.3 PSI 37 37 A 35 GLN C A 36 LEU N A 36 LEU CA A 36 LEU C 1.0 -148.0 -88.5 PHI 38 38 A 36 LEU N A 36 LEU CA A 36 LEU C A 37 TYR N 1.0 108.4 149.1 PSI 39 39 A 36 LEU C A 37 TYR N A 37 TYR CA A 37 TYR C 1.0 -156.4 -94.9 PHI 40 40 A 37 TYR N A 37 TYR CA A 37 TYR C A 38 HIS N 1.0 111.5 171.5 PSI 41 41 A 37 TYR C A 38 HIS N A 38 HIS CA A 38 HIS C 1.0 -157.1 -81.8 PHI 42 42 A 38 HIS N A 38 HIS CA A 38 HIS C A 39 LEU N 1.0 109.4 160.8 PSI 43 43 A 38 HIS C A 39 LEU N A 39 LEU CA A 39 LEU C 1.0 -142.0 -39.4 PHI 44 44 A 39 LEU N A 39 LEU CA A 39 LEU C A 40 LYS N 1.0 63.1 186.5 PSI 45 45 A 39 LEU C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -144.1 -58.4 PHI 46 46 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 GLU N 1.0 -72.2 41.8 PSI 47 47 A 42 LYS C A 43 VAL N A 43 VAL CA A 43 VAL C 1.0 -156.2 -106.4 PHI 48 48 A 43 VAL N A 43 VAL CA A 43 VAL C A 44 ASP N 1.0 145.0 179.0 PSI 49 49 A 43 VAL C A 44 ASP N A 44 ASP CA A 44 ASP C 1.0 -102.1 -54.4 PHI 50 50 A 44 ASP N A 44 ASP CA A 44 ASP C A 45 GLU N 1.0 136.2 186.0 PSI 51 51 A 44 ASP C A 45 GLU N A 45 GLU CA A 45 GLU C 1.0 -71.5 -45.9 PHI 52 52 A 45 GLU N A 45 GLU CA A 45 GLU C A 46 ASP N 1.0 -53.5 -1.3 PSI 53 53 A 45 GLU C A 46 ASP N A 46 ASP CA A 46 ASP C 1.0 -107.5 -46.4 PHI 54 54 A 46 ASP N A 46 ASP CA A 46 ASP C A 47 LYS N 1.0 -39.9 18.1 PSI 55 55 A 46 ASP C A 47 LYS N A 47 LYS CA A 47 LYS C 1.0 -127.0 -72.2 PHI 56 56 A 47 LYS N A 47 LYS CA A 47 LYS C A 48 LYS N 1.0 -23.3 37.4 PSI 57 57 A 50 LYS C A 51 VAL N A 51 VAL CA A 51 VAL C 1.0 -128.7 -32.8 PHI 58 58 A 51 VAL N A 51 VAL CA A 51 VAL C A 52 ILE N 1.0 110.0 153.3 PSI 59 59 A 51 VAL C A 52 ILE N A 52 ILE CA A 52 ILE C 1.0 -137.1 -78.5 PHI 60 60 A 52 ILE N A 52 ILE CA A 52 ILE C A 53 GLY N 1.0 -35.1 4.3 PSI 61 61 A 53 GLY C A 54 ALA N A 54 ALA CA A 54 ALA C 1.0 -151.9 -29.4 PHI 62 62 A 54 ALA N A 54 ALA CA A 54 ALA C A 55 ILE N 1.0 93.9 202.1 PSI 63 63 A 54 ALA C A 55 ILE N A 55 ILE CA A 55 ILE C 1.0 -78.4 -39.8 PHI 64 64 A 55 ILE N A 55 ILE CA A 55 ILE C A 56 GLY N 1.0 -57.9 -14.2 PSI 65 65 A 57 GLN C A 58 THR N A 58 THR CA A 58 THR C 1.0 -156.7 -98.5 PHI 66 66 A 58 THR N A 58 THR CA A 58 THR C A 59 PHE N 1.0 111.6 152.1 PSI 67 67 A 58 THR C A 59 PHE N A 59 PHE CA A 59 PHE C 1.0 -171.7 -105.9 PHI 68 68 A 59 PHE N A 59 PHE CA A 59 PHE C A 60 PHE N 1.0 134.0 179.4 PSI 69 69 A 59 PHE C A 60 PHE N A 60 PHE CA A 60 PHE C 1.0 -174.8 -80.5 PHI 70 70 A 60 PHE N A 60 PHE CA A 60 PHE C A 61 VAL N 1.0 123.8 178.1 PSI 71 71 A 60 PHE C A 61 VAL N A 61 VAL CA A 61 VAL C 1.0 -156.0 -122.6 PHI 72 72 A 61 VAL N A 61 VAL CA A 61 VAL C A 62 ASP N 1.0 128.9 185.3 PSI 73 73 A 61 VAL C A 62 ASP N A 62 ASP CA A 62 ASP C 1.0 -129.5 -64.2 PHI 74 74 A 62 ASP N A 62 ASP CA A 62 ASP C A 63 GLY N 1.0 153.7 188.7 PSI 75 75 A 62 ASP C A 63 GLY N A 63 GLY CA A 63 GLY C 1.0 -75.5 -45.5 PHI 76 76 A 63 GLY N A 63 GLY CA A 63 GLY C A 64 ASP N 1.0 -40.4 2.9 PSI 77 77 A 63 GLY C A 64 ASP N A 64 ASP CA A 64 ASP C 1.0 -124.9 -69.9 PHI 78 78 A 64 ASP N A 64 ASP CA A 64 ASP C A 65 GLY N 1.0 -19.6 18.6 PSI 79 79 A 66 LYS C A 67 ARG N A 67 ARG CA A 67 ARG C 1.0 -155.7 -46.2 PHI 80 80 A 67 ARG N A 67 ARG CA A 67 ARG C A 68 TRP N 1.0 115.6 140.3 PSI 81 81 A 67 ARG C A 68 TRP N A 68 TRP CA A 68 TRP C 1.0 -134.7 -58.0 PHI 82 82 A 68 TRP N A 68 TRP CA A 68 TRP C A 69 SER N 1.0 101.0 153.0 PSI 83 83 A 68 TRP C A 69 SER N A 69 SER CA A 69 SER C 1.0 -116.5 -63.1 PHI 84 84 A 69 SER N A 69 SER CA A 69 SER C A 70 GLU N 1.0 137.7 193.1 PSI 85 85 A 69 SER C A 70 GLU N A 70 GLU CA A 70 GLU C 1.0 -78.6 -44.0 PHI 86 86 A 70 GLU N A 70 GLU CA A 70 GLU C A 71 GLU N 1.0 -53.4 -25.4 PSI 87 87 A 70 GLU C A 71 GLU N A 71 GLU CA A 71 GLU C 1.0 -71.6 -51.6 PHI 88 88 A 71 GLU N A 71 GLU CA A 71 GLU C A 72 GLU N 1.0 -55.5 -31.0 PSI 89 89 A 71 GLU C A 72 GLU N A 72 GLU CA A 72 GLU C 1.0 -78.2 -58.2 PHI 90 90 A 72 GLU N A 72 GLU CA A 72 GLU C A 73 LEU N 1.0 -54.0 -25.8 PSI 91 91 A 72 GLU C A 73 LEU N A 73 LEU CA A 73 LEU C 1.0 -77.9 -57.4 PHI 92 92 A 73 LEU N A 73 LEU CA A 73 LEU C A 74 LYS N 1.0 -52.7 -1.5 PSI 93 93 A 86 ARG C A 87 GLU N A 87 GLU CA A 87 GLU C 1.0 -158.3 -36.9 PHI 94 94 A 87 GLU N A 87 GLU CA A 87 GLU C A 88 LYS N 1.0 109.2 162.3 PSI 95 95 A 87 GLU C A 88 LYS N A 88 LYS CA A 88 LYS C 1.0 -153.7 -50.8 PHI 96 96 A 88 LYS N A 88 LYS CA A 88 LYS C A 89 LYS N 1.0 98.4 144.0 PSI 97 97 A 88 LYS C A 89 LYS N A 89 LYS CA A 89 LYS C 1.0 -115.3 -42.9 PHI 98 98 A 89 LYS N A 89 LYS CA A 89 LYS C A 90 PRO N 1.0 97.0 167.2 PSI 99 99 A 90 PRO C A 91 LEU N A 91 LEU CA A 91 LEU C 1.0 -143.4 -67.8 PHI 100 100 A 91 LEU N A 91 LEU CA A 91 LEU C A 92 ARG N 1.0 96.8 166.4 PSI 101 101 A 91 LEU C A 92 ARG N A 92 ARG CA A 92 ARG C 1.0 -136.1 -64.3 PHI 102 102 A 92 ARG N A 92 ARG CA A 92 ARG C A 93 TYR N 1.0 90.8 154.9 PSI 103 103 A 92 ARG C A 93 TYR N A 93 TYR CA A 93 TYR C 1.0 -123.2 -85.7 PHI 104 104 A 93 TYR N A 93 TYR CA A 93 TYR C A 94 GLY N 1.0 104.6 148.8 PSI 105 105 A 93 TYR C A 94 GLY N A 94 GLY CA A 94 GLY C 1.0 -145.3 -81.0 PHI 106 106 A 94 GLY N A 94 GLY CA A 94 GLY C A 95 LYS N 1.0 96.4 157.4 PSI 107 107 A 94 GLY C A 95 LYS N A 95 LYS CA A 95 LYS C 1.0 -172.2 -69.3 PHI 108 108 A 95 LYS N A 95 LYS CA A 95 LYS C A 96 VAL N 1.0 99.6 192.2 PSI 109 109 A 95 LYS C A 96 VAL N A 96 VAL CA A 96 VAL C 1.0 -158.4 -92.5 PHI 110 110 A 96 VAL N A 96 VAL CA A 96 VAL C A 97 TYR N 1.0 108.6 166.3 PSI 111 111 A 96 VAL C A 97 TYR N A 97 TYR CA A 97 TYR C 1.0 -155.6 -101.5 PHI 112 112 A 97 TYR N A 97 TYR CA A 97 TYR C A 98 SER N 1.0 124.0 175.3 PSI 113 113 A 97 TYR C A 98 SER N A 98 SER CA A 98 SER C 1.0 -186.2 -67.9 PHI 114 114 A 98 SER N A 98 SER CA A 98 SER C A 99 THR N 1.0 126.3 182.3 PSI 115 115 A 106 LYS C A 107 ASP N A 107 ASP CA A 107 ASP C 1.0 -120.8 -53.8 PHI 116 116 A 107 ASP N A 107 ASP CA A 107 ASP C A 108 GLU N 1.0 -64.9 12.6 PSI 117 117 A 107 ASP C A 108 GLU N A 108 GLU CA A 108 GLU C 1.0 -185.1 -88.4 PHI 118 118 A 108 GLU N A 108 GLU CA A 108 GLU C A 109 ILE N 1.0 143.8 173.7 PSI 119 119 A 108 GLU C A 109 ILE N A 109 ILE CA A 109 ILE C 1.0 -165.0 -127.7 PHI 120 120 A 109 ILE N A 109 ILE CA A 109 ILE C A 110 ILE N 1.0 141.3 182.9 PSI 121 121 A 109 ILE C A 110 ILE N A 110 ILE CA A 110 ILE C 1.0 -157.2 -77.3 PHI 122 122 A 110 ILE N A 110 ILE CA A 110 ILE C A 111 VAL N 1.0 112.6 161.2 PSI 123 123 A 110 ILE C A 111 VAL N A 111 VAL CA A 111 VAL C 1.0 -172.9 -78.4 PHI 124 124 A 111 VAL N A 111 VAL CA A 111 VAL C A 112 GLU N 1.0 107.8 158.2 PSI 125 125 A 111 VAL C A 112 GLU N A 112 GLU CA A 112 GLU C 1.0 -148.9 -90.7 PHI 126 126 A 112 GLU N A 112 GLU CA A 112 GLU C A 113 PHE N 1.0 103.4 141.9 PSI 127 127 A 112 GLU C A 113 PHE N A 113 PHE CA A 113 PHE C 1.0 -171.6 -77.7 PHI 128 128 A 113 PHE N A 113 PHE CA A 113 PHE C A 114 ASN N 1.0 71.9 158.9 PSI 129 129 A 113 PHE C A 114 ASN N A 114 ASN CA A 114 ASN C 1.0 43.5 63.5 PHI 130 130 A 114 ASN N A 114 ASN CA A 114 ASN C A 115 ARG N 1.0 34.9 54.9 PSI 131 131 A 114 ASN C A 115 ARG N A 115 ARG CA A 115 ARG C 1.0 48.7 88.6 PHI 132 132 A 115 ARG N A 115 ARG CA A 115 ARG C A 116 GLU N 1.0 -14.1 41.7 PSI 133 133 A 115 ARG C A 116 GLU N A 116 GLU CA A 116 GLU C 1.0 -157.1 -71.1 PHI 134 134 A 116 GLU N A 116 GLU CA A 116 GLU C A 117 TYR N 1.0 128.9 187.4 PSI 135 135 A 116 GLU C A 117 TYR N A 117 TYR CA A 117 TYR C 1.0 -173.1 -55.7 PHI 136 136 A 117 TYR N A 117 TYR CA A 117 TYR C A 118 TYR N 1.0 130.2 162.2 PSI 137 137 A 118 TYR C A 119 ARG N A 119 ARG CA A 119 ARG C 1.0 -167.8 -55.2 PHI 138 138 A 119 ARG N A 119 ARG CA A 119 ARG C A 120 ALA N 1.0 110.1 141.7 PSI 139 139 A 119 ARG C A 120 ALA N A 120 ALA CA A 120 ALA C 1.0 -153.4 -93.9 PHI 140 140 A 120 ALA N A 120 ALA CA A 120 ALA C A 121 VAL N 1.0 97.0 190.8 PSI 141 141 A 120 ALA C A 121 VAL N A 121 VAL CA A 121 VAL C 1.0 -155.7 -100.9 PHI 142 142 A 121 VAL N A 121 VAL CA A 121 VAL C A 122 LEU N 1.0 105.4 166.3 PSI 143 143 A 121 VAL C A 122 LEU N A 122 LEU CA A 122 LEU C 1.0 -131.7 -38.4 PHI 144 144 A 122 LEU N A 122 LEU CA A 122 LEU C A 123 ILE N 1.0 110.5 147.2 PSI 145 145 A 1 GLY O A 1 GLY C A 2 SER N A 2 SER H 1.0 -180.1 -179.9 OMEGA 146 146 A 2 SER O A 2 SER C A 3 THR N A 3 THR H 1.0 -180.1 -179.9 OMEGA 147 147 A 3 THR O A 3 THR C A 4 MET N A 4 MET H 1.0 -180.1 -179.9 OMEGA 148 148 A 4 MET O A 4 MET C A 5 HIS N A 5 HIS H 1.0 -180.1 -179.9 OMEGA 149 149 A 5 HIS O A 5 HIS C A 6 PHE N A 6 PHE H 1.0 -180.1 -179.9 OMEGA 150 150 A 6 PHE O A 6 PHE C A 7 THR N A 7 THR H 1.0 -180.1 -179.9 OMEGA 151 151 A 7 THR O A 7 THR C A 8 ASP N A 8 ASP H 1.0 -180.1 -179.9 OMEGA 152 152 A 8 ASP O A 8 ASP C A 9 ASP N A 9 ASP H 1.0 -180.1 -179.9 OMEGA 153 153 A 9 ASP O A 9 ASP C A 10 ASN N A 10 ASN H 1.0 -180.1 -179.9 OMEGA 154 154 A 10 ASN O A 10 ASN C A 11 GLU N A 11 GLU H 1.0 -180.1 -179.9 OMEGA 155 155 A 11 GLU O A 11 GLU C A 12 ASN N A 12 ASN H 1.0 -180.1 -179.9 OMEGA 156 156 A 12 ASN O A 12 ASN C A 13 ASP N A 13 ASP H 1.0 -180.1 -179.9 OMEGA 157 157 A 13 ASP O A 13 ASP C A 14 THR N A 14 THR H 1.0 -180.1 -179.9 OMEGA 158 158 A 14 THR O A 14 THR C A 15 SER N A 15 SER H 1.0 -180.1 -179.9 OMEGA 159 159 A 15 SER O A 15 SER C A 16 GLU N A 16 GLU H 1.0 -180.1 -179.9 OMEGA 160 160 A 16 GLU O A 16 GLU C A 17 THR N A 17 THR H 1.0 -180.1 -179.9 OMEGA 161 161 A 17 THR O A 17 THR C A 18 MET N A 18 MET H 1.0 -180.1 -179.9 OMEGA 162 162 A 18 MET O A 18 MET C A 19 GLU N A 19 GLU H 1.0 -180.1 -179.9 OMEGA 163 163 A 19 GLU O A 19 GLU C A 20 SER N A 20 SER H 1.0 -180.1 -179.9 OMEGA 164 164 A 20 SER O A 20 SER C A 21 LEU N A 21 LEU H 1.0 -180.1 -179.9 OMEGA 165 165 A 21 LEU O A 21 LEU C A 22 ILE N A 22 ILE H 1.0 -180.1 -179.9 OMEGA 166 166 A 22 ILE O A 22 ILE C A 23 ASP N A 23 ASP H 1.0 -180.1 -179.9 OMEGA 167 167 A 23 ASP O A 23 ASP C A 24 LYS N A 24 LYS H 1.0 -180.1 -179.9 OMEGA 168 168 A 24 LYS O A 24 LYS C A 25 GLY N A 25 GLY H 1.0 -180.1 -179.9 OMEGA 169 169 A 25 GLY O A 25 GLY C A 26 LYS N A 26 LYS H 1.0 -180.1 -179.9 OMEGA 170 170 A 26 LYS O A 26 LYS C A 27 LEU N A 27 LEU H 1.0 -180.1 -179.9 OMEGA 171 171 A 27 LEU O A 27 LEU C A 28 ASP N A 28 ASP H 1.0 -180.1 -179.9 OMEGA 172 172 A 28 ASP O A 28 ASP C A 29 GLN N A 29 GLN H 1.0 -180.1 -179.9 OMEGA 173 173 A 29 GLN O A 29 GLN C A 30 VAL N A 30 VAL H 1.0 -180.1 -179.9 OMEGA 174 174 A 30 VAL O A 30 VAL C A 31 VAL N A 31 VAL H 1.0 -180.1 -179.9 OMEGA 175 175 A 31 VAL O A 31 VAL C A 32 TYR N A 32 TYR H 1.0 -180.1 -179.9 OMEGA 176 176 A 32 TYR O A 32 TYR C A 33 ASP N A 33 ASP H 1.0 -180.1 -179.9 OMEGA 177 177 A 33 ASP O A 33 ASP C A 34 ASP N A 34 ASP H 1.0 -180.1 -179.9 OMEGA 178 178 A 34 ASP O A 34 ASP C A 35 GLN N A 35 GLN H 1.0 -180.1 -179.9 OMEGA 179 179 A 35 GLN O A 35 GLN C A 36 LEU N A 36 LEU H 1.0 -180.1 -179.9 OMEGA 180 180 A 36 LEU O A 36 LEU C A 37 TYR N A 37 TYR H 1.0 -180.1 -179.9 OMEGA 181 181 A 37 TYR O A 37 TYR C A 38 HIS N A 38 HIS H 1.0 -180.1 -179.9 OMEGA 182 182 A 38 HIS O A 38 HIS C A 39 LEU N A 39 LEU H 1.0 -180.1 -179.9 OMEGA 183 183 A 39 LEU O A 39 LEU C A 40 LYS N A 40 LYS H 1.0 -180.1 -179.9 OMEGA 184 184 A 40 LYS O A 40 LYS C A 41 GLU N A 41 GLU H 1.0 -180.1 -179.9 OMEGA 185 185 A 41 GLU O A 41 GLU C A 42 LYS N A 42 LYS H 1.0 -180.1 -179.9 OMEGA 186 186 A 42 LYS O A 42 LYS C A 43 VAL N A 43 VAL H 1.0 -180.1 -179.9 OMEGA 187 187 A 43 VAL O A 43 VAL C A 44 ASP N A 44 ASP H 1.0 -180.1 -179.9 OMEGA 188 188 A 44 ASP O A 44 ASP C A 45 GLU N A 45 GLU H 1.0 -180.1 -179.9 OMEGA 189 189 A 45 GLU O A 45 GLU C A 46 ASP N A 46 ASP H 1.0 -180.1 -179.9 OMEGA 190 190 A 46 ASP O A 46 ASP C A 47 LYS N A 47 LYS H 1.0 -180.1 -179.9 OMEGA 191 191 A 47 LYS O A 47 LYS C A 48 LYS N A 48 LYS H 1.0 -180.1 -179.9 OMEGA 192 192 A 48 LYS O A 48 LYS C A 49 GLY N A 49 GLY H 1.0 -180.1 -179.9 OMEGA 193 193 A 49 GLY O A 49 GLY C A 50 LYS N A 50 LYS H 1.0 -180.1 -179.9 OMEGA 194 194 A 50 LYS O A 50 LYS C A 51 VAL N A 51 VAL H 1.0 -180.1 -179.9 OMEGA 195 195 A 51 VAL O A 51 VAL C A 52 ILE N A 52 ILE H 1.0 -180.1 -179.9 OMEGA 196 196 A 52 ILE O A 52 ILE C A 53 GLY N A 53 GLY H 1.0 -180.1 -179.9 OMEGA 197 197 A 53 GLY O A 53 GLY C A 54 ALA N A 54 ALA H 1.0 -180.1 -179.9 OMEGA 198 198 A 54 ALA O A 54 ALA C A 55 ILE N A 55 ILE H 1.0 -180.1 -179.9 OMEGA 199 199 A 55 ILE O A 55 ILE C A 56 GLY N A 56 GLY H 1.0 -180.1 -179.9 OMEGA 200 200 A 56 GLY O A 56 GLY C A 57 GLN N A 57 GLN H 1.0 -180.1 -179.9 OMEGA 201 201 A 57 GLN O A 57 GLN C A 58 THR N A 58 THR H 1.0 -180.1 -179.9 OMEGA 202 202 A 58 THR O A 58 THR C A 59 PHE N A 59 PHE H 1.0 -180.1 -179.9 OMEGA 203 203 A 59 PHE O A 59 PHE C A 60 PHE N A 60 PHE H 1.0 -180.1 -179.9 OMEGA 204 204 A 60 PHE O A 60 PHE C A 61 VAL N A 61 VAL H 1.0 -180.1 -179.9 OMEGA 205 205 A 61 VAL O A 61 VAL C A 62 ASP N A 62 ASP H 1.0 -180.1 -179.9 OMEGA 206 206 A 62 ASP O A 62 ASP C A 63 GLY N A 63 GLY H 1.0 -180.1 -179.9 OMEGA 207 207 A 63 GLY O A 63 GLY C A 64 ASP N A 64 ASP H 1.0 -180.1 -179.9 OMEGA 208 208 A 64 ASP O A 64 ASP C A 65 GLY N A 65 GLY H 1.0 -180.1 -179.9 OMEGA 209 209 A 65 GLY O A 65 GLY C A 66 LYS N A 66 LYS H 1.0 -180.1 -179.9 OMEGA 210 210 A 66 LYS O A 66 LYS C A 67 ARG N A 67 ARG H 1.0 -180.1 -179.9 OMEGA 211 211 A 67 ARG O A 67 ARG C A 68 TRP N A 68 TRP H 1.0 -180.1 -179.9 OMEGA 212 212 A 68 TRP O A 68 TRP C A 69 SER N A 69 SER H 1.0 -180.1 -179.9 OMEGA 213 213 A 69 SER O A 69 SER C A 70 GLU N A 70 GLU H 1.0 -180.1 -179.9 OMEGA 214 214 A 70 GLU O A 70 GLU C A 71 GLU N A 71 GLU H 1.0 -180.1 -179.9 OMEGA 215 215 A 71 GLU O A 71 GLU C A 72 GLU N A 72 GLU H 1.0 -180.1 -179.9 OMEGA 216 216 A 72 GLU O A 72 GLU C A 73 LEU N A 73 LEU H 1.0 -180.1 -179.9 OMEGA 217 217 A 73 LEU O A 73 LEU C A 74 LYS N A 74 LYS H 1.0 -180.1 -179.9 OMEGA 218 218 A 74 LYS O A 74 LYS C A 75 GLU N A 75 GLU H 1.0 -180.1 -179.9 OMEGA 219 219 A 75 GLU O A 75 GLU C A 76 PRO N A 76 PRO CD 1.0 -180.1 -179.9 OMEGA 220 220 A 76 PRO O A 76 PRO C A 77 TYR N A 77 TYR H 1.0 -180.1 -179.9 OMEGA 221 221 A 77 TYR O A 77 TYR C A 78 ILE N A 78 ILE H 1.0 -180.1 -179.9 OMEGA 222 222 A 78 ILE O A 78 ILE C A 79 SER N A 79 SER H 1.0 -180.1 -179.9 OMEGA 223 223 A 79 SER O A 79 SER C A 80 ASN N A 80 ASN H 1.0 -180.1 -179.9 OMEGA 224 224 A 80 ASN O A 80 ASN C A 81 ASN N A 81 ASN H 1.0 -180.1 -179.9 OMEGA 225 225 A 81 ASN O A 81 ASN C A 82 PRO N A 82 PRO CD 1.0 -180.1 -179.9 OMEGA 226 226 A 82 PRO O A 82 PRO C A 83 ASP N A 83 ASP H 1.0 -180.1 -179.9 OMEGA 227 227 A 83 ASP O A 83 ASP C A 84 GLU N A 84 GLU H 1.0 -180.1 -179.9 OMEGA 228 228 A 84 GLU O A 84 GLU C A 85 ILE N A 85 ILE H 1.0 -180.1 -179.9 OMEGA 229 229 A 85 ILE O A 85 ILE C A 86 ARG N A 86 ARG H 1.0 -180.1 -179.9 OMEGA 230 230 A 86 ARG O A 86 ARG C A 87 GLU N A 87 GLU H 1.0 -180.1 -179.9 OMEGA 231 231 A 87 GLU O A 87 GLU C A 88 LYS N A 88 LYS H 1.0 -180.1 -179.9 OMEGA 232 232 A 88 LYS O A 88 LYS C A 89 LYS N A 89 LYS H 1.0 -180.1 -179.9 OMEGA 233 233 A 89 LYS O A 89 LYS C A 90 PRO N A 90 PRO CD 1.0 -180.1 -179.9 OMEGA 234 234 A 90 PRO O A 90 PRO C A 91 LEU N A 91 LEU H 1.0 -180.1 -179.9 OMEGA 235 235 A 91 LEU O A 91 LEU C A 92 ARG N A 92 ARG H 1.0 -180.1 -179.9 OMEGA 236 236 A 92 ARG O A 92 ARG C A 93 TYR N A 93 TYR H 1.0 -180.1 -179.9 OMEGA 237 237 A 93 TYR O A 93 TYR C A 94 GLY N A 94 GLY H 1.0 -180.1 -179.9 OMEGA 238 238 A 94 GLY O A 94 GLY C A 95 LYS N A 95 LYS H 1.0 -180.1 -179.9 OMEGA 239 239 A 95 LYS O A 95 LYS C A 96 VAL N A 96 VAL H 1.0 -180.1 -179.9 OMEGA 240 240 A 96 VAL O A 96 VAL C A 97 TYR N A 97 TYR H 1.0 -180.1 -179.9 OMEGA 241 241 A 97 TYR O A 97 TYR C A 98 SER N A 98 SER H 1.0 -180.1 -179.9 OMEGA 242 242 A 98 SER O A 98 SER C A 99 THR N A 99 THR H 1.0 -180.1 -179.9 OMEGA 243 243 A 99 THR O A 99 THR C A 100 ASN N A 100 ASN H 1.0 -180.1 -179.9 OMEGA 244 244 A 100 ASN O A 100 ASN C A 101 GLU N A 101 GLU H 1.0 -180.1 -179.9 OMEGA 245 245 A 101 GLU O A 101 GLU C A 102 ASP N A 102 ASP H 1.0 -180.1 -179.9 OMEGA 246 246 A 102 ASP O A 102 ASP C A 103 SER N A 103 SER H 1.0 -180.1 -179.9 OMEGA 247 247 A 103 SER O A 103 SER C A 104 ASP N A 104 ASP H 1.0 -180.1 -179.9 OMEGA 248 248 A 104 ASP O A 104 ASP C A 105 ALA N A 105 ALA H 1.0 -180.1 -179.9 OMEGA 249 249 A 105 ALA O A 105 ALA C A 106 LYS N A 106 LYS H 1.0 -180.1 -179.9 OMEGA 250 250 A 106 LYS O A 106 LYS C A 107 ASP N A 107 ASP H 1.0 -180.1 -179.9 OMEGA 251 251 A 107 ASP O A 107 ASP C A 108 GLU N A 108 GLU H 1.0 -180.1 -179.9 OMEGA 252 252 A 108 GLU O A 108 GLU C A 109 ILE N A 109 ILE H 1.0 -180.1 -179.9 OMEGA 253 253 A 109 ILE O A 109 ILE C A 110 ILE N A 110 ILE H 1.0 -180.1 -179.9 OMEGA 254 254 A 110 ILE O A 110 ILE C A 111 VAL N A 111 VAL H 1.0 -180.1 -179.9 OMEGA 255 255 A 111 VAL O A 111 VAL C A 112 GLU N A 112 GLU H 1.0 -180.1 -179.9 OMEGA 256 256 A 112 GLU O A 112 GLU C A 113 PHE N A 113 PHE H 1.0 -180.1 -179.9 OMEGA 257 257 A 113 PHE O A 113 PHE C A 114 ASN N A 114 ASN H 1.0 -180.1 -179.9 OMEGA 258 258 A 114 ASN O A 114 ASN C A 115 ARG N A 115 ARG H 1.0 -180.1 -179.9 OMEGA 259 259 A 115 ARG O A 115 ARG C A 116 GLU N A 116 GLU H 1.0 -180.1 -179.9 OMEGA 260 260 A 116 GLU O A 116 GLU C A 117 TYR N A 117 TYR H 1.0 -180.1 -179.9 OMEGA 261 261 A 117 TYR O A 117 TYR C A 118 TYR N A 118 TYR H 1.0 -180.1 -179.9 OMEGA 262 262 A 118 TYR O A 118 TYR C A 119 ARG N A 119 ARG H 1.0 -180.1 -179.9 OMEGA 263 263 A 119 ARG O A 119 ARG C A 120 ALA N A 120 ALA H 1.0 -180.1 -179.9 OMEGA 264 264 A 120 ALA O A 120 ALA C A 121 VAL N A 121 VAL H 1.0 -180.1 -179.9 OMEGA 265 265 A 121 VAL O A 121 VAL C A 122 LEU N A 122 LEU H 1.0 -180.1 -179.9 OMEGA 266 266 A 122 LEU O A 122 LEU C A 123 ILE N A 123 ILE H 1.0 -180.1 -179.9 OMEGA 267 267 A 123 ILE O A 123 ILE C A 124 LYS N A 124 LYS H 1.0 -180.1 -179.9 OMEGA 268 268 A 124 LYS O A 124 LYS C A 125 ASN N A 125 ASN H 1.0 -180.1 -179.9 OMEGA 269 269 A 125 ASN O A 125 ASN C A 126 GLU N A 126 GLU H 1.0 -180.1 -179.9 OMEGA 270 270 A 126 GLU O A 126 GLU C A 127 LYS N A 127 LYS H 1.0 -180.1 -179.9 OMEGA 271 271 A 127 LYS O A 127 LYS C A 128 GLU N A 128 GLU H 1.0 -180.1 -179.9 OMEGA stop_ save_ save_DYANA/DIANA_dipolar_coupling_5 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode DYANA/DIANA_dipolar_coupling_5 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 17 THR N A 17 THR H 1.0 . . . 2 2 A 18 MET N A 18 MET H 1.0 . . . 3 3 A 19 GLU N A 19 GLU H 1.0 . . . 4 4 A 20 SER N A 20 SER H 1.0 . . . 5 5 A 22 ILE N A 22 ILE H 1.0 . . . 6 6 A 23 ASP N A 23 ASP H 1.0 . . . 7 7 A 25 GLY N A 25 GLY H 1.0 . . . 8 8 A 26 LYS N A 26 LYS H 1.0 . . . 9 9 A 27 LEU N A 27 LEU H 1.0 . . . 10 10 A 29 GLN N A 29 GLN H 1.0 . . . 11 11 A 30 VAL N A 30 VAL H 1.0 . . . 12 12 A 31 VAL N A 31 VAL H 1.0 . . . 13 13 A 32 TYR N A 32 TYR H 1.0 . . . 14 14 A 33 ASP N A 33 ASP H 1.0 . . . 15 15 A 34 ASP N A 34 ASP H 1.0 . . . 16 16 A 35 GLN N A 35 GLN H 1.0 . . . 17 17 A 37 TYR N A 37 TYR H 1.0 . . . 18 18 A 39 LEU N A 39 LEU H 1.0 . . . 19 19 A 40 LYS N A 40 LYS H 1.0 . . . 20 20 A 44 ASP N A 44 ASP H 1.0 . . . 21 21 A 45 GLU N A 45 GLU H 1.0 . . . 22 22 A 46 ASP N A 46 ASP H 1.0 . . . 23 23 A 49 GLY N A 49 GLY H 1.0 . . . 24 24 A 50 LYS N A 50 LYS H 1.0 . . . 25 25 A 51 VAL N A 51 VAL H 1.0 . . . 26 26 A 52 ILE N A 52 ILE H 1.0 . . . 27 27 A 53 GLY N A 53 GLY H 1.0 . . . 28 28 A 54 ALA N A 54 ALA H 1.0 . . . 29 29 A 55 ILE N A 55 ILE H 1.0 . . . 30 30 A 57 GLN N A 57 GLN H 1.0 . . . 31 31 A 59 PHE N A 59 PHE H 1.0 . . . 32 32 A 60 PHE N A 60 PHE H 1.0 . . . 33 33 A 61 VAL N A 61 VAL H 1.0 . . . 34 34 A 63 GLY N A 63 GLY H 1.0 . . . 35 35 A 65 GLY N A 65 GLY H 1.0 . . . 36 36 A 67 ARG N A 67 ARG H 1.0 . . . 37 37 A 69 SER N A 69 SER H 1.0 . . . 38 38 A 70 GLU N A 70 GLU H 1.0 . . . 39 39 A 72 GLU N A 72 GLU H 1.0 . . . 40 40 A 73 LEU N A 73 LEU H 1.0 . . . 41 41 A 74 LYS N A 74 LYS H 1.0 . . . 42 42 A 88 LYS N A 88 LYS H 1.0 . . . 43 43 A 89 LYS N A 89 LYS H 1.0 . . . 44 44 A 91 LEU N A 91 LEU H 1.0 . . . 45 45 A 92 ARG N A 92 ARG H 1.0 . . . 46 46 A 97 TYR N A 97 TYR H 1.0 . . . 47 47 A 99 THR N A 99 THR H 1.0 . . . 48 48 A 107 ASP N A 107 ASP H 1.0 . . . 49 49 A 108 GLU N A 108 GLU H 1.0 . . . 50 50 A 109 ILE N A 109 ILE H 1.0 . . . 51 51 A 111 VAL N A 111 VAL H 1.0 . . . 52 52 A 112 GLU N A 112 GLU H 1.0 . . . 53 53 A 115 ARG N A 115 ARG H 1.0 . . . 54 54 A 116 GLU N A 116 GLU H 1.0 . . . 55 55 A 119 ARG N A 119 ARG H 1.0 . . . 56 56 A 120 ALA N A 120 ALA H 1.0 . . . 57 57 A 121 VAL N A 121 VAL H 1.0 . . . 58 58 A 122 LEU N A 122 LEU H 1.0 . . . 59 59 A 123 ILE N A 123 ILE H 1.0 . . . 60 60 A 124 LYS N A 124 LYS H 1.0 . . . stop_ save_