data_nef_c16064_2kc7 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code TargetDB BfR218 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 ASP middle . . 3 A 3 GLN middle . . 4 A 4 LEU middle . . 5 A 5 LYS middle . . 6 A 6 THR middle . . 7 A 7 ILE middle . . 8 A 8 LYS middle . . 9 A 9 GLU middle . . 10 A 10 LEU middle . . 11 A 11 ILE middle . . 12 A 12 ASN middle . . 13 A 13 GLN middle . . 14 A 14 GLY middle . false 15 A 15 ASP middle . . 16 A 16 ILE middle . . 17 A 17 GLU middle . . 18 A 18 ASN middle . . 19 A 19 ALA middle . . 20 A 20 LEU middle . . 21 A 21 GLN middle . . 22 A 22 ALA middle . . 23 A 23 LEU middle . . 24 A 24 GLU middle . . 25 A 25 GLU middle . . 26 A 26 PHE middle . . 27 A 27 LEU middle . . 28 A 28 GLN middle . . 29 A 29 THR middle . . 30 A 30 GLU middle . . 31 A 31 PRO middle . false 32 A 32 VAL middle . . 33 A 33 GLY middle . false 34 A 34 LYS middle . . 35 A 35 ASP middle . . 36 A 36 GLU middle . . 37 A 37 ALA middle . . 38 A 38 TYR middle . . 39 A 39 TYR middle . . 40 A 40 LEU middle . . 41 A 41 MET middle . . 42 A 42 GLY middle . false 43 A 43 ASN middle . . 44 A 44 ALA middle . . 45 A 45 TYR middle . . 46 A 46 ARG middle . . 47 A 47 LYS middle . . 48 A 48 LEU middle . . 49 A 49 GLY middle . false 50 A 50 ASP middle . . 51 A 51 TRP middle . . 52 A 52 GLN middle . . 53 A 53 LYS middle . . 54 A 54 ALA middle . . 55 A 55 LEU middle . . 56 A 56 ASN middle . . 57 A 57 ASN middle . . 58 A 58 TYR middle . . 59 A 59 GLN middle . . 60 A 60 SER middle . . 61 A 61 ALA middle . . 62 A 62 ILE middle . . 63 A 63 GLU middle . . 64 A 64 LEU middle . . 65 A 65 ASN middle . . 66 A 66 PRO middle . false 67 A 67 ASP middle . . 68 A 68 SER middle . . 69 A 69 PRO middle . false 70 A 70 ALA middle . . 71 A 71 LEU middle . . 72 A 72 GLN middle . . 73 A 73 ALA middle . . 74 A 74 ARG middle . . 75 A 75 LYS middle . . 76 A 76 MET middle . . 77 A 77 VAL middle . . 78 A 78 MET middle . . 79 A 79 ASP middle . . 80 A 80 ILE middle . . 81 A 81 LEU middle . . 82 A 82 ASN middle . . 83 A 83 PHE middle . . 84 A 84 TYR middle . . 85 A 85 ASN middle . . 86 A 86 LYS middle . . 87 A 87 ASP middle . . 88 A 88 MET middle . . 89 A 89 TYR middle . . 90 A 90 ASN middle . . 91 A 91 GLN middle . . 92 A 92 LEU middle . . 93 A 93 GLU middle . . 94 A 94 HIS middle . . 95 A 95 HIS middle . . 96 A 96 HIS middle . . 97 A 97 HIS middle . . 98 A 98 HIS middle . . 99 A 99 HIS 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 ASP HA H 1 4.708 0.02 A 2 ASP HBx H 1 2.672 0.02 A 2 ASP HBy H 1 2.826 0.02 A 2 ASP C C 13 176.847 0.2 A 2 ASP CA C 13 53.800 0.2 A 2 ASP CB C 13 40.922 0.2 A 3 GLN H H 1 9.117 0.02 A 3 GLN HA H 1 4.139 0.02 A 3 GLN HBx H 1 2.053 0.02 A 3 GLN HBy H 1 2.053 0.02 A 3 GLN HE21 H 1 7.000 0.02 A 3 GLN HE22 H 1 7.647 0.02 A 3 GLN HGx H 1 2.493 0.02 A 3 GLN HGy H 1 2.493 0.02 A 3 GLN C C 13 177.725 0.2 A 3 GLN CA C 13 58.612 0.2 A 3 GLN CB C 13 28.880 0.2 A 3 GLN CG C 13 33.994 0.2 A 3 GLN N N 15 124.129 0.2 A 3 GLN NE2 N 15 111.813 0.2 A 4 LEU H H 1 8.285 0.02 A 4 LEU HA H 1 3.947 0.02 A 4 LEU HB2 H 1 1.715 0.02 A 4 LEU HB3 H 1 1.276 0.02 A 4 LEU HD1% H 1 0.703 0.02 A 4 LEU HD2% H 1 0.121 0.02 A 4 LEU HG H 1 1.250 0.02 A 4 LEU C C 13 178.111 0.2 A 4 LEU CA C 13 56.421 0.2 A 4 LEU CB C 13 40.690 0.2 A 4 LEU CD1 C 13 24.921 0.2 A 4 LEU CD2 C 13 22.301 0.2 A 4 LEU CG C 13 26.646 0.2 A 4 LEU N N 15 117.977 0.2 A 5 LYS H H 1 7.624 0.02 A 5 LYS HA H 1 3.837 0.02 A 5 LYS HBx H 1 1.901 0.02 A 5 LYS HBy H 1 1.901 0.02 A 5 LYS HDx H 1 1.705 0.02 A 5 LYS HDy H 1 1.705 0.02 A 5 LYS HEx H 1 2.986 0.02 A 5 LYS HEy H 1 2.986 0.02 A 5 LYS HGy H 1 1.486 0.02 A 5 LYS HGx H 1 1.372 0.02 A 5 LYS C C 13 178.775 0.2 A 5 LYS CA C 13 59.939 0.2 A 5 LYS CB C 13 32.344 0.2 A 5 LYS CD C 13 29.186 0.2 A 5 LYS CE C 13 41.998 0.2 A 5 LYS CG C 13 24.895 0.2 A 5 LYS N N 15 121.000 0.2 A 6 THR H H 1 7.852 0.02 A 6 THR HA H 1 3.908 0.02 A 6 THR HB H 1 4.207 0.02 A 6 THR HG2% H 1 1.178 0.02 A 6 THR C C 13 176.483 0.2 A 6 THR CA C 13 66.062 0.2 A 6 THR CB C 13 68.255 0.2 A 6 THR CG2 C 13 21.434 0.2 A 6 THR N N 15 115.606 0.2 A 7 ILE H H 1 7.791 0.02 A 7 ILE HA H 1 3.422 0.02 A 7 ILE HB H 1 1.679 0.02 A 7 ILE HD1% H 1 0.560 0.02 A 7 ILE HG12 H 1 0.835 0.02 A 7 ILE HG13 H 1 1.733 0.02 A 7 ILE HG2% H 1 0.776 0.02 A 7 ILE C C 13 177.219 0.2 A 7 ILE CA C 13 65.799 0.2 A 7 ILE CB C 13 37.619 0.2 A 7 ILE CD1 C 13 13.106 0.2 A 7 ILE CG1 C 13 30.188 0.2 A 7 ILE CG2 C 13 17.943 0.2 A 7 ILE N N 15 122.292 0.2 A 8 LYS H H 1 8.233 0.02 A 8 LYS HA H 1 3.721 0.02 A 8 LYS HBx H 1 1.891 0.02 A 8 LYS HBy H 1 1.891 0.02 A 8 LYS HD2 H 1 1.719 0.02 A 8 LYS HD3 H 1 1.596 0.02 A 8 LYS HEy H 1 2.893 0.02 A 8 LYS HEx H 1 2.780 0.02 A 8 LYS HGy H 1 1.494 0.02 A 8 LYS HGx H 1 1.362 0.02 A 8 LYS C C 13 179.054 0.2 A 8 LYS CA C 13 60.378 0.2 A 8 LYS CB C 13 31.990 0.2 A 8 LYS CD C 13 29.365 0.2 A 8 LYS CE C 13 42.424 0.2 A 8 LYS CG C 13 26.698 0.2 A 8 LYS N N 15 119.853 0.2 A 9 GLU H H 1 7.677 0.02 A 9 GLU HA H 1 4.138 0.02 A 9 GLU HBy H 1 2.170 0.02 A 9 GLU HBx H 1 2.064 0.02 A 9 GLU HGx H 1 2.290 0.02 A 9 GLU HGy H 1 2.415 0.02 A 9 GLU C C 13 178.839 0.2 A 9 GLU CA C 13 59.045 0.2 A 9 GLU CB C 13 28.877 0.2 A 9 GLU CG C 13 35.866 0.2 A 9 GLU N N 15 118.933 0.2 A 10 LEU H H 1 7.996 0.02 A 10 LEU HA H 1 4.027 0.02 A 10 LEU HBy H 1 2.092 0.02 A 10 LEU HBx H 1 1.503 0.02 A 10 LEU HD1% H 1 0.674 0.02 A 10 LEU HD2% H 1 0.907 0.02 A 10 LEU HG H 1 1.895 0.02 A 10 LEU C C 13 179.717 0.2 A 10 LEU CA C 13 58.212 0.2 A 10 LEU CB C 13 41.994 0.2 A 10 LEU CD1 C 13 25.070 0.2 A 10 LEU CD2 C 13 22.324 0.2 A 10 LEU CG C 13 26.038 0.2 A 10 LEU N N 15 120.361 0.2 A 11 ILE H H 1 8.059 0.02 A 11 ILE HA H 1 3.233 0.02 A 11 ILE HB H 1 1.807 0.02 A 11 ILE HD1% H 1 0.705 0.02 A 11 ILE HG1x H 1 0.393 0.02 A 11 ILE HG1y H 1 1.784 0.02 A 11 ILE HG2% H 1 0.710 0.02 A 11 ILE C C 13 179.525 0.2 A 11 ILE CA C 13 65.782 0.2 A 11 ILE CB C 13 37.620 0.2 A 11 ILE CD1 C 13 14.702 0.2 A 11 ILE CG1 C 13 30.163 0.2 A 11 ILE CG2 C 13 16.604 0.2 A 11 ILE N N 15 118.455 0.2 A 12 ASN H H 1 8.219 0.02 A 12 ASN HA H 1 4.355 0.02 A 12 ASN HBx H 1 2.908 0.02 A 12 ASN HBy H 1 2.908 0.02 A 12 ASN HD2y H 1 7.708 0.02 A 12 ASN HD2x H 1 6.834 0.02 A 12 ASN C C 13 177.168 0.2 A 12 ASN CA C 13 55.945 0.2 A 12 ASN CB C 13 38.012 0.2 A 12 ASN N N 15 120.732 0.2 A 12 ASN ND2 N 15 112.311 0.2 A 13 GLN H H 1 8.028 0.02 A 13 GLN HA H 1 4.295 0.02 A 13 GLN HBx H 1 2.150 0.02 A 13 GLN HBy H 1 2.263 0.02 A 13 GLN HE21 H 1 7.568 0.02 A 13 GLN HE22 H 1 6.778 0.02 A 13 GLN HGx H 1 2.540 0.02 A 13 GLN HGy H 1 2.540 0.02 A 13 GLN C C 13 176.418 0.2 A 13 GLN CA C 13 55.821 0.2 A 13 GLN CB C 13 28.852 0.2 A 13 GLN CG C 13 33.669 0.2 A 13 GLN N N 15 116.080 0.2 A 13 GLN NE2 N 15 111.356 0.2 A 14 GLY H H 1 7.853 0.02 A 14 GLY HAy H 1 4.337 0.02 A 14 GLY HAx H 1 3.511 0.02 A 14 GLY C C 13 174.233 0.2 A 14 GLY CA C 13 45.063 0.2 A 14 GLY N N 15 107.118 0.2 A 15 ASP H H 1 8.325 0.02 A 15 ASP HA H 1 4.973 0.02 A 15 ASP HBy H 1 2.937 0.02 A 15 ASP HBx H 1 2.385 0.02 A 15 ASP C C 13 176.427 0.2 A 15 ASP CA C 13 51.828 0.2 A 15 ASP CB C 13 38.583 0.2 A 15 ASP N N 15 125.524 0.2 A 16 ILE H H 1 7.615 0.02 A 16 ILE HA H 1 3.353 0.02 A 16 ILE HB H 1 1.948 0.02 A 16 ILE HD1% H 1 0.742 0.02 A 16 ILE HG1x H 1 1.351 0.02 A 16 ILE HG1y H 1 1.351 0.02 A 16 ILE HG2% H 1 0.741 0.02 A 16 ILE C C 13 177.618 0.2 A 16 ILE CA C 13 62.996 0.2 A 16 ILE CB C 13 35.856 0.2 A 16 ILE CD1 C 13 10.886 0.2 A 16 ILE CG1 C 13 28.001 0.2 A 16 ILE CG2 C 13 18.564 0.2 A 16 ILE N N 15 119.875 0.2 A 17 GLU H H 1 8.844 0.02 A 17 GLU HA H 1 3.887 0.02 A 17 GLU HBy H 1 2.031 0.02 A 17 GLU HBx H 1 1.952 0.02 A 17 GLU HGx H 1 2.246 0.02 A 17 GLU HGy H 1 2.246 0.02 A 17 GLU C C 13 179.739 0.2 A 17 GLU CA C 13 60.364 0.2 A 17 GLU CB C 13 28.670 0.2 A 17 GLU CG C 13 36.311 0.2 A 17 GLU N N 15 120.080 0.2 A 18 ASN H H 1 7.768 0.02 A 18 ASN HA H 1 4.535 0.02 A 18 ASN HB2 H 1 2.652 0.02 A 18 ASN HB3 H 1 2.541 0.02 A 18 ASN HD2x H 1 6.893 0.02 A 18 ASN HD2y H 1 8.790 0.02 A 18 ASN C C 13 178.197 0.2 A 18 ASN CA C 13 55.682 0.2 A 18 ASN CB C 13 37.615 0.2 A 18 ASN N N 15 116.056 0.2 A 18 ASN ND2 N 15 116.089 0.2 A 19 ALA H H 1 7.989 0.02 A 19 ALA HA H 1 3.870 0.02 A 19 ALA HB% H 1 1.327 0.02 A 19 ALA C C 13 178.732 0.2 A 19 ALA CA C 13 55.543 0.2 A 19 ALA CB C 13 18.362 0.2 A 19 ALA N N 15 123.900 0.2 A 20 LEU H H 1 8.589 0.02 A 20 LEU HA H 1 3.856 0.02 A 20 LEU HB2 H 1 1.325 0.02 A 20 LEU HB3 H 1 1.843 0.02 A 20 LEU HD1% H 1 0.431 0.02 A 20 LEU HD2% H 1 0.347 0.02 A 20 LEU HG H 1 1.434 0.02 A 20 LEU C C 13 179.139 0.2 A 20 LEU CA C 13 58.169 0.2 A 20 LEU CB C 13 41.569 0.2 A 20 LEU CD1 C 13 25.309 0.2 A 20 LEU CD2 C 13 23.178 0.2 A 20 LEU CG C 13 26.668 0.2 A 20 LEU N N 15 117.052 0.2 A 21 GLN H H 1 7.439 0.02 A 21 GLN HA H 1 4.029 0.02 A 21 GLN HBx H 1 2.129 0.02 A 21 GLN HBy H 1 2.129 0.02 A 21 GLN HE21 H 1 7.606 0.02 A 21 GLN HE22 H 1 6.777 0.02 A 21 GLN HGy H 1 2.488 0.02 A 21 GLN HGx H 1 2.383 0.02 A 21 GLN C C 13 178.411 0.2 A 21 GLN CA C 13 58.730 0.2 A 21 GLN CB C 13 28.002 0.2 A 21 GLN CG C 13 33.405 0.2 A 21 GLN N N 15 118.218 0.2 A 21 GLN NE2 N 15 112.280 0.2 A 22 ALA H H 1 7.848 0.02 A 22 ALA HA H 1 4.191 0.02 A 22 ALA HB% H 1 1.406 0.02 A 22 ALA C C 13 181.475 0.2 A 22 ALA CA C 13 54.631 0.2 A 22 ALA CB C 13 17.907 0.2 A 22 ALA N N 15 121.474 0.2 A 23 LEU H H 1 8.751 0.02 A 23 LEU HA H 1 3.906 0.02 A 23 LEU HB2 H 1 2.099 0.02 A 23 LEU HB3 H 1 1.355 0.02 A 23 LEU HD1% H 1 0.596 0.02 A 23 LEU HD2% H 1 0.916 0.02 A 23 LEU HG H 1 1.674 0.02 A 23 LEU C C 13 177.996 0.2 A 23 LEU CA C 13 58.155 0.2 A 23 LEU CB C 13 42.020 0.2 A 23 LEU CD1 C 13 24.087 0.2 A 23 LEU CD2 C 13 24.072 0.2 A 23 LEU CG C 13 27.553 0.2 A 23 LEU N N 15 122.246 0.2 A 24 GLU H H 1 8.247 0.02 A 24 GLU HA H 1 3.971 0.02 A 24 GLU HBy H 1 2.157 0.02 A 24 GLU HBx H 1 2.062 0.02 A 24 GLU HGy H 1 2.428 0.02 A 24 GLU HGx H 1 2.253 0.02 A 24 GLU C C 13 179.751 0.2 A 24 GLU CA C 13 59.506 0.2 A 24 GLU CB C 13 28.849 0.2 A 24 GLU CG C 13 35.857 0.2 A 24 GLU N N 15 119.875 0.2 A 25 GLU H H 1 7.736 0.02 A 25 GLU HA H 1 4.013 0.02 A 25 GLU HBx H 1 2.093 0.02 A 25 GLU HBy H 1 2.093 0.02 A 25 GLU HGy H 1 2.433 0.02 A 25 GLU HGx H 1 2.248 0.02 A 25 GLU C C 13 179.204 0.2 A 25 GLU CA C 13 59.058 0.2 A 25 GLU CB C 13 29.238 0.2 A 25 GLU CG C 13 36.269 0.2 A 25 GLU N N 15 118.451 0.2 A 26 PHE H H 1 8.389 0.02 A 26 PHE HA H 1 4.218 0.02 A 26 PHE HBx H 1 3.195 0.02 A 26 PHE HBy H 1 3.195 0.02 A 26 PHE HD1 H 1 6.948 0.02 A 26 PHE HD2 H 1 6.948 0.02 A 26 PHE HE1 H 1 7.149 0.02 A 26 PHE HE2 H 1 7.149 0.02 A 26 PHE HZ H 1 7.421 0.02 A 26 PHE C C 13 178.732 0.2 A 26 PHE CA C 13 61.020 0.2 A 26 PHE CB C 13 39.383 0.2 A 26 PHE CD1 C 13 130.944 0.2 A 26 PHE CE1 C 13 131.237 0.2 A 26 PHE CZ C 13 130.806 0.2 A 26 PHE N N 15 122.243 0.2 A 27 LEU H H 1 8.643 0.02 A 27 LEU HA H 1 3.666 0.02 A 27 LEU HB2 H 1 1.964 0.02 A 27 LEU HB3 H 1 1.367 0.02 A 27 LEU HD1% H 1 0.593 0.02 A 27 LEU HD2% H 1 0.446 0.02 A 27 LEU HG H 1 1.641 0.02 A 27 LEU C C 13 179.172 0.2 A 27 LEU CA C 13 57.728 0.2 A 27 LEU CB C 13 42.008 0.2 A 27 LEU CD1 C 13 25.585 0.2 A 27 LEU CD2 C 13 23.175 0.2 A 27 LEU CG C 13 27.146 0.2 A 27 LEU N N 15 119.374 0.2 A 28 GLN H H 1 7.536 0.02 A 28 GLN HA H 1 4.215 0.02 A 28 GLN HBx H 1 2.225 0.02 A 28 GLN HBy H 1 2.225 0.02 A 28 GLN HE2x H 1 6.834 0.02 A 28 GLN HE2y H 1 7.473 0.02 A 28 GLN HGy H 1 2.583 0.02 A 28 GLN HGx H 1 2.508 0.02 A 28 GLN C C 13 177.261 0.2 A 28 GLN CA C 13 57.287 0.2 A 28 GLN CB C 13 28.832 0.2 A 28 GLN CG C 13 33.677 0.2 A 28 GLN N N 15 116.095 0.2 A 28 GLN NE2 N 15 111.843 0.2 A 29 THR H H 1 7.480 0.02 A 29 THR HA H 1 4.332 0.02 A 29 THR HB H 1 4.234 0.02 A 29 THR HG2% H 1 1.262 0.02 A 29 THR C C 13 174.092 0.2 A 29 THR CA C 13 62.533 0.2 A 29 THR CB C 13 70.435 0.2 A 29 THR CG2 C 13 21.410 0.2 A 29 THR N N 15 108.609 0.2 A 30 GLU H H 1 7.935 0.02 A 30 GLU HA H 1 4.221 0.02 A 30 GLU HBy H 1 1.781 0.02 A 30 GLU HBx H 1 1.547 0.02 A 30 GLU HGy H 1 2.026 0.02 A 30 GLU HGx H 1 1.891 0.02 A 30 GLU CA C 13 54.719 0.2 A 30 GLU CB C 13 28.002 0.2 A 30 GLU CG C 13 35.030 0.2 A 30 GLU N N 15 119.400 0.2 A 31 PRO HA H 1 4.430 0.02 A 31 PRO HB2 H 1 1.754 0.02 A 31 PRO HB3 H 1 1.905 0.02 A 31 PRO HD2 H 1 3.605 0.02 A 31 PRO HD3 H 1 3.436 0.02 A 31 PRO HG2 H 1 1.536 0.02 A 31 PRO HG3 H 1 1.285 0.02 A 31 PRO C C 13 177.447 0.2 A 31 PRO CA C 13 62.992 0.2 A 31 PRO CB C 13 32.354 0.2 A 31 PRO CD C 13 50.072 0.2 A 31 PRO CG C 13 26.238 0.2 A 32 VAL H H 1 7.989 0.02 A 32 VAL HA H 1 4.211 0.02 A 32 VAL HB H 1 2.121 0.02 A 32 VAL HGx% H 1 1.039 0.02 A 32 VAL HGy% H 1 1.039 0.02 A 32 VAL C C 13 176.778 0.2 A 32 VAL CA C 13 62.755 0.2 A 32 VAL CB C 13 32.697 0.2 A 32 VAL CG1 C 13 20.978 0.2 A 32 VAL N N 15 118.439 0.2 A 33 GLY H H 1 8.764 0.02 A 33 GLY HAx H 1 4.195 0.02 A 33 GLY HAy H 1 4.195 0.02 A 33 GLY C C 13 176.287 0.2 A 33 GLY CA C 13 45.917 0.2 A 33 GLY N N 15 111.588 0.2 A 34 LYS H H 1 8.296 0.02 A 34 LYS HA H 1 3.839 0.02 A 34 LYS HBy H 1 1.988 0.02 A 34 LYS HBx H 1 1.833 0.02 A 34 LYS HDx H 1 1.824 0.02 A 34 LYS HDy H 1 1.824 0.02 A 34 LYS HEx H 1 3.073 0.02 A 34 LYS HEy H 1 3.073 0.02 A 34 LYS HG2 H 1 1.356 0.02 A 34 LYS HG3 H 1 1.494 0.02 A 34 LYS C C 13 177.040 0.2 A 34 LYS CA C 13 59.883 0.2 A 34 LYS CB C 13 32.883 0.2 A 34 LYS CD C 13 29.733 0.2 A 34 LYS CE C 13 42.003 0.2 A 34 LYS CG C 13 26.207 0.2 A 34 LYS N N 15 119.887 0.2 A 35 ASP H H 1 9.065 0.02 A 35 ASP HA H 1 4.362 0.02 A 35 ASP HBx H 1 2.841 0.02 A 35 ASP HBy H 1 2.918 0.02 A 35 ASP C C 13 177.018 0.2 A 35 ASP CA C 13 57.636 0.2 A 35 ASP CB C 13 41.086 0.2 A 35 ASP N N 15 115.065 0.2 A 36 GLU H H 1 7.474 0.02 A 36 GLU HA H 1 4.275 0.02 A 36 GLU HBx H 1 2.061 0.02 A 36 GLU HBy H 1 2.061 0.02 A 36 GLU HGx H 1 2.275 0.02 A 36 GLU HGy H 1 2.438 0.02 A 36 GLU C C 13 178.261 0.2 A 36 GLU CA C 13 59.046 0.2 A 36 GLU CB C 13 29.283 0.2 A 36 GLU CG C 13 36.103 0.2 A 36 GLU N N 15 121.291 0.2 A 37 ALA H H 1 7.674 0.02 A 37 ALA HA H 1 3.887 0.02 A 37 ALA HB% H 1 1.377 0.02 A 37 ALA C C 13 179.161 0.2 A 37 ALA CA C 13 55.091 0.2 A 37 ALA CB C 13 17.925 0.2 A 37 ALA N N 15 120.365 0.2 A 38 TYR H H 1 8.175 0.02 A 38 TYR HA H 1 4.422 0.02 A 38 TYR HB2 H 1 3.770 0.02 A 38 TYR HB3 H 1 2.764 0.02 A 38 TYR HD1 H 1 7.294 0.02 A 38 TYR HD2 H 1 7.294 0.02 A 38 TYR HE1 H 1 6.775 0.02 A 38 TYR HE2 H 1 6.775 0.02 A 38 TYR C C 13 178.497 0.2 A 38 TYR CA C 13 62.662 0.2 A 38 TYR CB C 13 37.996 0.2 A 38 TYR CD1 C 13 132.977 0.2 A 38 TYR CE1 C 13 118.124 0.2 A 38 TYR N N 15 117.027 0.2 A 39 TYR H H 1 8.321 0.02 A 39 TYR HA H 1 4.413 0.02 A 39 TYR HB2 H 1 3.438 0.02 A 39 TYR HB3 H 1 3.237 0.02 A 39 TYR HD1 H 1 7.035 0.02 A 39 TYR HD2 H 1 7.035 0.02 A 39 TYR HE1 H 1 6.648 0.02 A 39 TYR HE2 H 1 6.648 0.02 A 39 TYR C C 13 176.311 0.2 A 39 TYR CA C 13 60.856 0.2 A 39 TYR CB C 13 38.015 0.2 A 39 TYR CD1 C 13 132.811 0.2 A 39 TYR CE1 C 13 118.123 0.2 A 39 TYR N N 15 120.527 0.2 A 40 LEU H H 1 8.508 0.02 A 40 LEU HA H 1 3.585 0.02 A 40 LEU HB2 H 1 1.916 0.02 A 40 LEU HB3 H 1 1.072 0.02 A 40 LEU HD1% H 1 0.788 0.02 A 40 LEU HD2% H 1 0.756 0.02 A 40 LEU HG H 1 2.055 0.02 A 40 LEU C C 13 178.857 0.2 A 40 LEU CA C 13 57.723 0.2 A 40 LEU CB C 13 41.543 0.2 A 40 LEU CD1 C 13 27.096 0.2 A 40 LEU CD2 C 13 22.373 0.2 A 40 LEU CG C 13 26.622 0.2 A 40 LEU N N 15 118.925 0.2 A 41 MET H H 1 8.661 0.02 A 41 MET HA H 1 3.611 0.02 A 41 MET HBx H 1 2.432 0.02 A 41 MET HBy H 1 2.509 0.02 A 41 MET HE% H 1 2.058 0.02 A 41 MET HGx H 1 2.234 0.02 A 41 MET HGy H 1 2.234 0.02 A 41 MET C C 13 178.325 0.2 A 41 MET CA C 13 59.498 0.2 A 41 MET CB C 13 32.806 0.2 A 41 MET CE C 13 17.851 0.2 A 41 MET CG C 13 33.237 0.2 A 41 MET N N 15 119.892 0.2 A 42 GLY H H 1 8.531 0.02 A 42 GLY HAy H 1 3.564 0.02 A 42 GLY HAx H 1 3.164 0.02 A 42 GLY C C 13 174.726 0.2 A 42 GLY CA C 13 48.104 0.2 A 42 GLY N N 15 107.064 0.2 A 43 ASN H H 1 8.260 0.02 A 43 ASN HA H 1 4.334 0.02 A 43 ASN HBy H 1 2.952 0.02 A 43 ASN HBx H 1 2.693 0.02 A 43 ASN HD2y H 1 7.276 0.02 A 43 ASN HD2x H 1 5.447 0.02 A 43 ASN C C 13 178.111 0.2 A 43 ASN CA C 13 54.966 0.2 A 43 ASN CB C 13 36.326 0.2 A 43 ASN N N 15 120.815 0.2 A 43 ASN ND2 N 15 107.009 0.2 A 44 ALA H H 1 8.487 0.02 A 44 ALA HA H 1 3.788 0.02 A 44 ALA HB% H 1 1.163 0.02 A 44 ALA C C 13 178.389 0.2 A 44 ALA CA C 13 55.152 0.2 A 44 ALA CB C 13 16.897 0.2 A 44 ALA N N 15 125.304 0.2 A 45 TYR H H 1 8.160 0.02 A 45 TYR HA H 1 4.168 0.02 A 45 TYR HBx H 1 2.422 0.02 A 45 TYR HBy H 1 3.333 0.02 A 45 TYR HD1 H 1 6.935 0.02 A 45 TYR HD2 H 1 6.935 0.02 A 45 TYR HE1 H 1 6.677 0.02 A 45 TYR HE2 H 1 6.677 0.02 A 45 TYR C C 13 178.775 0.2 A 45 TYR CA C 13 62.995 0.2 A 45 TYR CB C 13 36.944 0.2 A 45 TYR CD1 C 13 132.528 0.2 A 45 TYR CE1 C 13 118.542 0.2 A 45 TYR N N 15 115.156 0.2 A 46 ARG H H 1 8.901 0.02 A 46 ARG HA H 1 3.677 0.02 A 46 ARG HBy H 1 2.233 0.02 A 46 ARG HBx H 1 1.973 0.02 A 46 ARG HDy H 1 3.354 0.02 A 46 ARG HDx H 1 3.257 0.02 A 46 ARG HGx H 1 1.784 0.02 A 46 ARG HGy H 1 1.784 0.02 A 46 ARG C C 13 179.396 0.2 A 46 ARG CA C 13 59.924 0.2 A 46 ARG CB C 13 30.131 0.2 A 46 ARG CD C 13 44.165 0.2 A 46 ARG CG C 13 27.104 0.2 A 46 ARG N N 15 121.781 0.2 A 47 LYS H H 1 7.813 0.02 A 47 LYS HA H 1 4.058 0.02 A 47 LYS HBx H 1 1.958 0.02 A 47 LYS HBy H 1 1.958 0.02 A 47 LYS HDx H 1 1.631 0.02 A 47 LYS HDy H 1 1.631 0.02 A 47 LYS HEx H 1 2.965 0.02 A 47 LYS HEy H 1 2.965 0.02 A 47 LYS HGx H 1 1.496 0.02 A 47 LYS HGy H 1 1.559 0.02 A 47 LYS C C 13 178.111 0.2 A 47 LYS CA C 13 58.950 0.2 A 47 LYS CB C 13 31.906 0.2 A 47 LYS CD C 13 28.873 0.2 A 47 LYS CE C 13 41.978 0.2 A 47 LYS CG C 13 25.370 0.2 A 47 LYS N N 15 120.818 0.2 A 48 LEU H H 1 7.312 0.02 A 48 LEU HA H 1 4.228 0.02 A 48 LEU HBy H 1 1.859 0.02 A 48 LEU HBx H 1 1.706 0.02 A 48 LEU HD1% H 1 0.797 0.02 A 48 LEU HD2% H 1 0.835 0.02 A 48 LEU HG H 1 1.775 0.02 A 48 LEU C C 13 177.254 0.2 A 48 LEU CA C 13 54.908 0.2 A 48 LEU CB C 13 42.475 0.2 A 48 LEU CD1 C 13 25.332 0.2 A 48 LEU CD2 C 13 22.322 0.2 A 48 LEU CG C 13 25.811 0.2 A 48 LEU N N 15 116.553 0.2 A 49 GLY H H 1 7.564 0.02 A 49 GLY HAy H 1 3.607 0.02 A 49 GLY HAx H 1 2.316 0.02 A 49 GLY C C 13 172.900 0.2 A 49 GLY CA C 13 44.184 0.2 A 49 GLY N N 15 107.326 0.2 A 50 ASP H H 1 7.670 0.02 A 50 ASP HA H 1 4.564 0.02 A 50 ASP HBy H 1 2.971 0.02 A 50 ASP HBx H 1 2.202 0.02 A 50 ASP C C 13 175.681 0.2 A 50 ASP CA C 13 51.083 0.2 A 50 ASP CB C 13 39.169 0.2 A 50 ASP N N 15 120.356 0.2 A 51 TRP H H 1 6.939 0.02 A 51 TRP HA H 1 4.314 0.02 A 51 TRP HB2 H 1 3.233 0.02 A 51 TRP HB3 H 1 3.111 0.02 A 51 TRP HD1 H 1 7.229 0.02 A 51 TRP HE1 H 1 10.006 0.02 A 51 TRP HE3 H 1 7.326 0.02 A 51 TRP HH2 H 1 7.229 0.02 A 51 TRP HZ2 H 1 7.502 0.02 A 51 TRP HZ3 H 1 7.064 0.02 A 51 TRP C C 13 178.047 0.2 A 51 TRP CA C 13 58.473 0.2 A 51 TRP CB C 13 30.099 0.2 A 51 TRP CD1 C 13 128.168 0.2 A 51 TRP CE3 C 13 118.988 0.2 A 51 TRP CH2 C 13 124.558 0.2 A 51 TRP CZ2 C 13 115.031 0.2 A 51 TRP CZ3 C 13 121.650 0.2 A 51 TRP N N 15 121.784 0.2 A 51 TRP NE1 N 15 129.407 0.2 A 52 GLN H H 1 8.677 0.02 A 52 GLN HA H 1 3.960 0.02 A 52 GLN HBx H 1 2.012 0.02 A 52 GLN HBy H 1 2.012 0.02 A 52 GLN HE2y H 1 7.441 0.02 A 52 GLN HE2x H 1 6.884 0.02 A 52 GLN HGy H 1 2.291 0.02 A 52 GLN HGx H 1 2.224 0.02 A 52 GLN C C 13 178.454 0.2 A 52 GLN CA C 13 58.925 0.2 A 52 GLN CB C 13 28.183 0.2 A 52 GLN CG C 13 33.683 0.2 A 52 GLN N N 15 117.018 0.2 A 52 GLN NE2 N 15 113.246 0.2 A 53 LYS H H 1 7.392 0.02 A 53 LYS HA H 1 3.774 0.02 A 53 LYS HBy H 1 0.682 0.02 A 53 LYS HBx H 1 0.363 0.02 A 53 LYS HDx H 1 0.980 0.02 A 53 LYS HDy H 1 0.980 0.02 A 53 LYS HEy H 1 2.781 0.02 A 53 LYS HEx H 1 2.722 0.02 A 53 LYS HGy H 1 1.230 0.02 A 53 LYS HGx H 1 0.799 0.02 A 53 LYS C C 13 180.361 0.2 A 53 LYS CA C 13 59.764 0.2 A 53 LYS CB C 13 30.802 0.2 A 53 LYS CD C 13 29.030 0.2 A 53 LYS CE C 13 41.721 0.2 A 53 LYS CG C 13 26.198 0.2 A 53 LYS N N 15 117.913 0.2 A 54 ALA H H 1 8.223 0.02 A 54 ALA HA H 1 4.012 0.02 A 54 ALA HB% H 1 1.402 0.02 A 54 ALA C C 13 177.635 0.2 A 54 ALA CA C 13 55.792 0.2 A 54 ALA CB C 13 17.045 0.2 A 54 ALA N N 15 123.665 0.2 A 55 LEU H H 1 8.425 0.02 A 55 LEU HA H 1 4.010 0.02 A 55 LEU HBx H 1 1.672 0.02 A 55 LEU HBy H 1 2.022 0.02 A 55 LEU HD1% H 1 0.965 0.02 A 55 LEU HD2% H 1 1.043 0.02 A 55 LEU HG H 1 2.014 0.02 A 55 LEU C C 13 179.568 0.2 A 55 LEU CA C 13 58.611 0.2 A 55 LEU CB C 13 41.500 0.2 A 55 LEU CD1 C 13 25.372 0.2 A 55 LEU CD2 C 13 24.926 0.2 A 55 LEU CG C 13 27.023 0.2 A 55 LEU N N 15 116.583 0.2 A 56 ASN H H 1 8.284 0.02 A 56 ASN HA H 1 4.360 0.02 A 56 ASN HBx H 1 2.784 0.02 A 56 ASN HBy H 1 2.784 0.02 A 56 ASN HD2y H 1 7.482 0.02 A 56 ASN HD2x H 1 6.913 0.02 A 56 ASN C C 13 177.790 0.2 A 56 ASN CA C 13 55.852 0.2 A 56 ASN CB C 13 37.882 0.2 A 56 ASN N N 15 117.763 0.2 A 56 ASN ND2 N 15 110.424 0.2 A 57 ASN H H 1 7.600 0.02 A 57 ASN HA H 1 4.425 0.02 A 57 ASN HB2 H 1 2.372 0.02 A 57 ASN HB3 H 1 3.333 0.02 A 57 ASN HD2y H 1 7.350 0.02 A 57 ASN HD2x H 1 7.114 0.02 A 57 ASN C C 13 177.404 0.2 A 57 ASN CA C 13 58.105 0.2 A 57 ASN CB C 13 38.931 0.2 A 57 ASN N N 15 118.927 0.2 A 57 ASN ND2 N 15 112.318 0.2 A 58 TYR H H 1 8.838 0.02 A 58 TYR HA H 1 4.667 0.02 A 58 TYR HB2 H 1 3.138 0.02 A 58 TYR HB3 H 1 3.269 0.02 A 58 TYR HD1 H 1 6.926 0.02 A 58 TYR HD2 H 1 6.926 0.02 A 58 TYR HE1 H 1 6.839 0.02 A 58 TYR HE2 H 1 6.839 0.02 A 58 TYR C C 13 178.047 0.2 A 58 TYR CA C 13 58.430 0.2 A 58 TYR CB C 13 36.743 0.2 A 58 TYR CD1 C 13 129.950 0.2 A 58 TYR CE1 C 13 118.102 0.2 A 58 TYR N N 15 118.473 0.2 A 59 GLN H H 1 8.572 0.02 A 59 GLN HA H 1 4.022 0.02 A 59 GLN HBx H 1 2.176 0.02 A 59 GLN HBy H 1 2.280 0.02 A 59 GLN HE2y H 1 7.740 0.02 A 59 GLN HE2x H 1 6.726 0.02 A 59 GLN HGy H 1 2.389 0.02 A 59 GLN HGx H 1 2.344 0.02 A 59 GLN C C 13 178.040 0.2 A 59 GLN CA C 13 59.054 0.2 A 59 GLN CB C 13 27.126 0.2 A 59 GLN CG C 13 32.836 0.2 A 59 GLN N N 15 118.483 0.2 A 59 GLN NE2 N 15 111.813 0.2 A 60 SER H H 1 7.696 0.02 A 60 SER HA H 1 3.931 0.02 A 60 SER HBy H 1 3.274 0.02 A 60 SER HBx H 1 2.482 0.02 A 60 SER C C 13 175.926 0.2 A 60 SER CA C 13 62.121 0.2 A 60 SER CB C 13 61.244 0.2 A 60 SER N N 15 116.103 0.2 A 61 ALA H H 1 7.739 0.02 A 61 ALA HA H 1 4.075 0.02 A 61 ALA HB% H 1 1.792 0.02 A 61 ALA C C 13 178.686 0.2 A 61 ALA CA C 13 56.019 0.2 A 61 ALA CB C 13 18.790 0.2 A 61 ALA N N 15 122.319 0.2 A 62 ILE H H 1 7.991 0.02 A 62 ILE HA H 1 3.857 0.02 A 62 ILE HB H 1 1.768 0.02 A 62 ILE HD1% H 1 0.756 0.02 A 62 ILE HG12 H 1 0.760 0.02 A 62 ILE HG13 H 1 1.848 0.02 A 62 ILE HG2% H 1 0.886 0.02 A 62 ILE C C 13 178.131 0.2 A 62 ILE CA C 13 63.418 0.2 A 62 ILE CB C 13 39.119 0.2 A 62 ILE CD1 C 13 14.850 0.2 A 62 ILE CG1 C 13 29.745 0.2 A 62 ILE CG2 C 13 17.493 0.2 A 62 ILE N N 15 117.981 0.2 A 63 GLU H H 1 7.988 0.02 A 63 GLU HA H 1 3.902 0.02 A 63 GLU HBx H 1 2.020 0.02 A 63 GLU HBy H 1 2.020 0.02 A 63 GLU HGy H 1 2.471 0.02 A 63 GLU HGx H 1 2.269 0.02 A 63 GLU C C 13 178.564 0.2 A 63 GLU CA C 13 58.594 0.2 A 63 GLU CB C 13 29.278 0.2 A 63 GLU CG C 13 36.307 0.2 A 63 GLU N N 15 118.190 0.2 A 64 LEU H H 1 7.024 0.02 A 64 LEU HA H 1 4.347 0.02 A 64 LEU HBy H 1 1.930 0.02 A 64 LEU HBx H 1 1.695 0.02 A 64 LEU HD1% H 1 1.101 0.02 A 64 LEU HD2% H 1 1.033 0.02 A 64 LEU HG H 1 1.909 0.02 A 64 LEU C C 13 177.496 0.2 A 64 LEU CA C 13 55.810 0.2 A 64 LEU CB C 13 43.746 0.2 A 64 LEU CD1 C 13 26.202 0.2 A 64 LEU CD2 C 13 22.311 0.2 A 64 LEU CG C 13 26.678 0.2 A 64 LEU N N 15 116.109 0.2 A 65 ASN H H 1 8.270 0.02 A 65 ASN HA H 1 5.068 0.02 A 65 ASN HBy H 1 2.943 0.02 A 65 ASN HBx H 1 2.723 0.02 A 65 ASN HD2y H 1 7.693 0.02 A 65 ASN HD2x H 1 7.052 0.02 A 65 ASN C C 13 172.512 0.2 A 65 ASN CA C 13 49.457 0.2 A 65 ASN CB C 13 38.936 0.2 A 65 ASN N N 15 116.544 0.2 A 65 ASN ND2 N 15 109.877 0.2 A 66 PRO HA H 1 4.467 0.02 A 66 PRO HBx H 1 1.968 0.02 A 66 PRO HBy H 1 2.411 0.02 A 66 PRO HDy H 1 3.942 0.02 A 66 PRO HDx H 1 3.605 0.02 A 66 PRO HGy H 1 2.076 0.02 A 66 PRO HGx H 1 2.001 0.02 A 66 PRO C C 13 176.054 0.2 A 66 PRO CA C 13 63.894 0.2 A 66 PRO CB C 13 31.935 0.2 A 66 PRO CD C 13 50.310 0.2 A 66 PRO CG C 13 26.663 0.2 A 67 ASP H H 1 7.326 0.02 A 67 ASP HA H 1 4.863 0.02 A 67 ASP HBy H 1 2.866 0.02 A 67 ASP HBx H 1 2.408 0.02 A 67 ASP C C 13 175.647 0.2 A 67 ASP CA C 13 53.273 0.2 A 67 ASP CB C 13 41.453 0.2 A 67 ASP N N 15 114.579 0.2 A 68 SER H H 1 7.670 0.02 A 68 SER HA H 1 4.315 0.02 A 68 SER HBx H 1 3.451 0.02 A 68 SER HBy H 1 4.334 0.02 A 68 SER HG H 1 7.173 0.02 A 68 SER C C 13 175.108 0.2 A 68 SER CA C 13 56.422 0.2 A 68 SER CB C 13 63.880 0.2 A 68 SER N N 15 115.624 0.2 A 69 PRO HA H 1 4.588 0.02 A 69 PRO HBx H 1 1.332 0.02 A 69 PRO HBy H 1 2.167 0.02 A 69 PRO HDx H 1 3.489 0.02 A 69 PRO HDy H 1 3.565 0.02 A 69 PRO HGy H 1 1.686 0.02 A 69 PRO HGx H 1 0.857 0.02 A 69 PRO C C 13 177.083 0.2 A 69 PRO CA C 13 63.870 0.2 A 69 PRO CB C 13 30.612 0.2 A 69 PRO CD C 13 51.154 0.2 A 69 PRO CG C 13 26.538 0.2 A 70 ALA H H 1 8.442 0.02 A 70 ALA HA H 1 3.679 0.02 A 70 ALA HB% H 1 1.565 0.02 A 70 ALA C C 13 177.667 0.2 A 70 ALA CA C 13 54.025 0.2 A 70 ALA CB C 13 20.741 0.2 A 70 ALA N N 15 121.749 0.2 A 71 LEU H H 1 7.956 0.02 A 71 LEU HA H 1 3.883 0.02 A 71 LEU HB2 H 1 1.589 0.02 A 71 LEU HB3 H 1 1.765 0.02 A 71 LEU HD1% H 1 0.997 0.02 A 71 LEU HD2% H 1 0.952 0.02 A 71 LEU HG H 1 1.581 0.02 A 71 LEU C C 13 179.241 0.2 A 71 LEU CA C 13 58.602 0.2 A 71 LEU CB C 13 41.987 0.2 A 71 LEU CD1 C 13 24.499 0.2 A 71 LEU CD2 C 13 24.780 0.2 A 71 LEU CG C 13 27.110 0.2 A 71 LEU N N 15 119.448 0.2 A 72 GLN H H 1 7.464 0.02 A 72 GLN HA H 1 4.049 0.02 A 72 GLN HBy H 1 2.154 0.02 A 72 GLN HBx H 1 2.042 0.02 A 72 GLN HE2y H 1 7.496 0.02 A 72 GLN HE2x H 1 6.872 0.02 A 72 GLN HGx H 1 2.389 0.02 A 72 GLN HGy H 1 2.487 0.02 A 72 GLN C C 13 178.432 0.2 A 72 GLN CA C 13 58.626 0.2 A 72 GLN CB C 13 27.557 0.2 A 72 GLN CG C 13 33.900 0.2 A 72 GLN N N 15 117.976 0.2 A 72 GLN NE2 N 15 111.837 0.2 A 73 ALA H H 1 7.296 0.02 A 73 ALA HA H 1 4.017 0.02 A 73 ALA HB% H 1 0.992 0.02 A 73 ALA C C 13 178.775 0.2 A 73 ALA CA C 13 54.688 0.2 A 73 ALA CB C 13 17.473 0.2 A 73 ALA N N 15 123.083 0.2 A 74 ARG H H 1 8.328 0.02 A 74 ARG HA H 1 3.820 0.02 A 74 ARG HBy H 1 1.989 0.02 A 74 ARG HBx H 1 1.758 0.02 A 74 ARG HDy H 1 3.136 0.02 A 74 ARG HDx H 1 3.058 0.02 A 74 ARG HE H 1 7.441 0.02 A 74 ARG HGx H 1 1.716 0.02 A 74 ARG HGy H 1 1.716 0.02 A 74 ARG C C 13 177.297 0.2 A 74 ARG CA C 13 59.805 0.2 A 74 ARG CB C 13 29.773 0.2 A 74 ARG CD C 13 43.736 0.2 A 74 ARG CG C 13 27.548 0.2 A 74 ARG N N 15 117.535 0.2 A 74 ARG NE N 15 83.882 0.2 A 75 LYS H H 1 7.123 0.02 A 75 LYS HA H 1 3.960 0.02 A 75 LYS HBx H 1 1.944 0.02 A 75 LYS HBy H 1 1.944 0.02 A 75 LYS HDx H 1 1.709 0.02 A 75 LYS HDy H 1 1.709 0.02 A 75 LYS HEx H 1 2.989 0.02 A 75 LYS HEy H 1 2.989 0.02 A 75 LYS HGx H 1 1.445 0.02 A 75 LYS HGy H 1 1.541 0.02 A 75 LYS C C 13 178.071 0.2 A 75 LYS CA C 13 59.488 0.2 A 75 LYS CB C 13 31.928 0.2 A 75 LYS CD C 13 28.863 0.2 A 75 LYS CE C 13 41.998 0.2 A 75 LYS CG C 13 24.933 0.2 A 75 LYS N N 15 119.136 0.2 A 76 MET H H 1 7.673 0.02 A 76 MET HA H 1 4.205 0.02 A 76 MET HBx H 1 2.145 0.02 A 76 MET HBy H 1 2.261 0.02 A 76 MET HE% H 1 2.072 0.02 A 76 MET HGy H 1 2.751 0.02 A 76 MET HGx H 1 2.565 0.02 A 76 MET C C 13 178.925 0.2 A 76 MET CA C 13 58.637 0.2 A 76 MET CB C 13 32.344 0.2 A 76 MET CE C 13 17.212 0.2 A 76 MET CG C 13 31.935 0.2 A 76 MET N N 15 116.794 0.2 A 77 VAL H H 1 7.928 0.02 A 77 VAL HA H 1 3.601 0.02 A 77 VAL HB H 1 2.347 0.02 A 77 VAL HG1% H 1 1.179 0.02 A 77 VAL HG2% H 1 1.327 0.02 A 77 VAL C C 13 177.318 0.2 A 77 VAL CA C 13 66.468 0.2 A 77 VAL CB C 13 31.477 0.2 A 77 VAL CG1 C 13 22.756 0.2 A 77 VAL CG2 C 13 24.052 0.2 A 77 VAL N N 15 117.999 0.2 A 78 MET H H 1 8.446 0.02 A 78 MET HA H 1 4.136 0.02 A 78 MET HB2 H 1 2.232 0.02 A 78 MET HB3 H 1 2.112 0.02 A 78 MET HE% H 1 2.008 0.02 A 78 MET HGy H 1 2.746 0.02 A 78 MET HGx H 1 2.557 0.02 A 78 MET C C 13 178.542 0.2 A 78 MET CA C 13 58.514 0.2 A 78 MET CB C 13 31.036 0.2 A 78 MET CE C 13 16.189 0.2 A 78 MET CG C 13 32.357 0.2 A 78 MET N N 15 119.079 0.2 A 79 ASP H H 1 8.202 0.02 A 79 ASP HA H 1 4.419 0.02 A 79 ASP HBy H 1 2.870 0.02 A 79 ASP HBx H 1 2.597 0.02 A 79 ASP C C 13 179.097 0.2 A 79 ASP CA C 13 57.277 0.2 A 79 ASP CB C 13 39.813 0.2 A 79 ASP N N 15 119.422 0.2 A 80 ILE H H 1 7.625 0.02 A 80 ILE HA H 1 3.643 0.02 A 80 ILE HB H 1 1.668 0.02 A 80 ILE HD1% H 1 0.561 0.02 A 80 ILE HG1y H 1 1.582 0.02 A 80 ILE HG1x H 1 0.862 0.02 A 80 ILE HG2% H 1 0.249 0.02 A 80 ILE C C 13 178.024 0.2 A 80 ILE CA C 13 64.717 0.2 A 80 ILE CB C 13 37.661 0.2 A 80 ILE CD1 C 13 13.529 0.2 A 80 ILE CG1 C 13 28.869 0.2 A 80 ILE CG2 C 13 16.183 0.2 A 80 ILE N N 15 121.750 0.2 A 81 LEU H H 1 8.071 0.02 A 81 LEU HA H 1 3.908 0.02 A 81 LEU HB2 H 1 1.750 0.02 A 81 LEU HB3 H 1 1.406 0.02 A 81 LEU HD1% H 1 0.741 0.02 A 81 LEU HD2% H 1 0.605 0.02 A 81 LEU HG H 1 1.592 0.02 A 81 LEU C C 13 178.852 0.2 A 81 LEU CA C 13 57.329 0.2 A 81 LEU CB C 13 41.544 0.2 A 81 LEU CD1 C 13 25.779 0.2 A 81 LEU CD2 C 13 22.760 0.2 A 81 LEU CG C 13 26.659 0.2 A 81 LEU N N 15 119.850 0.2 A 82 ASN H H 1 8.188 0.02 A 82 ASN HA H 1 4.417 0.02 A 82 ASN HBx H 1 2.704 0.02 A 82 ASN HBy H 1 2.704 0.02 A 82 ASN HD2y H 1 7.452 0.02 A 82 ASN HD2x H 1 6.785 0.02 A 82 ASN C C 13 176.440 0.2 A 82 ASN CA C 13 55.011 0.2 A 82 ASN CB C 13 38.461 0.2 A 82 ASN N N 15 116.186 0.2 A 82 ASN ND2 N 15 111.915 0.2 A 83 PHE H H 1 7.779 0.02 A 83 PHE HA H 1 4.352 0.02 A 83 PHE HBx H 1 3.030 0.02 A 83 PHE HBy H 1 3.030 0.02 A 83 PHE HD1 H 1 6.883 0.02 A 83 PHE HD2 H 1 6.883 0.02 A 83 PHE HE1 H 1 7.185 0.02 A 83 PHE HE2 H 1 7.185 0.02 A 83 PHE HZ H 1 7.174 0.02 A 83 PHE C C 13 176.767 0.2 A 83 PHE CA C 13 59.557 0.2 A 83 PHE CB C 13 38.944 0.2 A 83 PHE CD1 C 13 131.362 0.2 A 83 PHE CE1 C 13 131.223 0.2 A 83 PHE CZ C 13 129.489 0.2 A 83 PHE N N 15 118.925 0.2 A 84 TYR H H 1 8.057 0.02 A 84 TYR HA H 1 4.388 0.02 A 84 TYR HBx H 1 2.899 0.02 A 84 TYR HBy H 1 3.138 0.02 A 84 TYR HD1 H 1 7.175 0.02 A 84 TYR HD2 H 1 7.175 0.02 A 84 TYR HE1 H 1 6.846 0.02 A 84 TYR HE2 H 1 6.846 0.02 A 84 TYR C C 13 176.233 0.2 A 84 TYR CA C 13 59.261 0.2 A 84 TYR CB C 13 38.503 0.2 A 84 TYR CD1 C 13 133.003 0.2 A 84 TYR CE1 C 13 118.114 0.2 A 84 TYR N N 15 118.223 0.2 A 85 ASN H H 1 8.192 0.02 A 85 ASN HA H 1 4.679 0.02 A 85 ASN HBy H 1 2.890 0.02 A 85 ASN HBx H 1 2.774 0.02 A 85 ASN HD2y H 1 7.614 0.02 A 85 ASN HD2x H 1 6.947 0.02 A 85 ASN C C 13 175.367 0.2 A 85 ASN CA C 13 53.261 0.2 A 85 ASN CB C 13 38.501 0.2 A 85 ASN N N 15 118.935 0.2 A 85 ASN ND2 N 15 111.862 0.2 A 86 LYS H H 1 8.151 0.02 A 86 LYS HA H 1 4.151 0.02 A 86 LYS HBx H 1 1.833 0.02 A 86 LYS HBy H 1 1.833 0.02 A 86 LYS HDx H 1 1.649 0.02 A 86 LYS HDy H 1 1.649 0.02 A 86 LYS HEx H 1 2.971 0.02 A 86 LYS HEy H 1 2.971 0.02 A 86 LYS HGx H 1 1.434 0.02 A 86 LYS HGy H 1 1.434 0.02 A 86 LYS C C 13 176.981 0.2 A 86 LYS CA C 13 57.714 0.2 A 86 LYS CB C 13 32.368 0.2 A 86 LYS CD C 13 28.849 0.2 A 86 LYS CE C 13 41.985 0.2 A 86 LYS CG C 13 24.471 0.2 A 86 LYS N N 15 121.533 0.2 A 87 ASP H H 1 8.269 0.02 A 87 ASP HA H 1 4.553 0.02 A 87 ASP HBx H 1 2.604 0.02 A 87 ASP HBy H 1 2.703 0.02 A 87 ASP C C 13 177.209 0.2 A 87 ASP CA C 13 55.538 0.2 A 87 ASP CB C 13 40.677 0.2 A 87 ASP N N 15 119.408 0.2 A 88 MET H H 1 7.941 0.02 A 88 MET HA H 1 4.257 0.02 A 88 MET HBx H 1 1.900 0.02 A 88 MET HBy H 1 1.900 0.02 A 88 MET HE% H 1 1.997 0.02 A 88 MET HGx H 1 2.346 0.02 A 88 MET HGy H 1 2.346 0.02 A 88 MET C C 13 176.851 0.2 A 88 MET CA C 13 56.461 0.2 A 88 MET CB C 13 32.371 0.2 A 88 MET CE C 13 16.622 0.2 A 88 MET CG C 13 31.920 0.2 A 88 MET N N 15 119.377 0.2 A 89 TYR H H 1 8.094 0.02 A 89 TYR HA H 1 4.350 0.02 A 89 TYR HBx H 1 2.903 0.02 A 89 TYR HBy H 1 3.120 0.02 A 89 TYR HD1 H 1 7.073 0.02 A 89 TYR HD2 H 1 7.073 0.02 A 89 TYR HE1 H 1 6.759 0.02 A 89 TYR HE2 H 1 6.759 0.02 A 89 TYR C C 13 176.252 0.2 A 89 TYR CA C 13 59.097 0.2 A 89 TYR CB C 13 38.051 0.2 A 89 TYR CD1 C 13 133.001 0.2 A 89 TYR CE1 C 13 118.128 0.2 A 89 TYR N N 15 119.418 0.2 A 90 ASN H H 1 8.244 0.02 A 90 ASN HA H 1 4.573 0.02 A 90 ASN HBx H 1 2.816 0.02 A 90 ASN HBy H 1 2.816 0.02 A 90 ASN HD2y H 1 7.708 0.02 A 90 ASN HD2x H 1 6.902 0.02 A 90 ASN C C 13 175.907 0.2 A 90 ASN CA C 13 53.867 0.2 A 90 ASN CB C 13 38.479 0.2 A 90 ASN N N 15 118.918 0.2 A 90 ASN ND2 N 15 112.346 0.2 A 91 GLN H H 1 8.176 0.02 A 91 GLN HA H 1 4.216 0.02 A 91 GLN HBy H 1 2.157 0.02 A 91 GLN HBx H 1 2.037 0.02 A 91 GLN HE2y H 1 7.487 0.02 A 91 GLN HE2x H 1 6.831 0.02 A 91 GLN HGx H 1 2.375 0.02 A 91 GLN HGy H 1 2.375 0.02 A 91 GLN C C 13 176.568 0.2 A 91 GLN CA C 13 56.600 0.2 A 91 GLN CB C 13 28.859 0.2 A 91 GLN CG C 13 33.684 0.2 A 91 GLN N N 15 119.648 0.2 A 91 GLN NE2 N 15 112.301 0.2 A 92 LEU H H 1 8.015 0.02 A 92 LEU HA H 1 4.214 0.02 A 92 LEU HBy H 1 1.631 0.02 A 92 LEU HBx H 1 1.481 0.02 A 92 LEU HDx% H 1 0.860 0.02 A 92 LEU HDy% H 1 0.819 0.02 A 92 LEU HG H 1 1.640 0.02 A 92 LEU C C 13 177.661 0.2 A 92 LEU CA C 13 55.550 0.2 A 92 LEU CB C 13 41.994 0.2 A 92 LEU CD1 C 13 25.090 0.2 A 92 LEU CD2 C 13 23.150 0.2 A 92 LEU CG C 13 26.695 0.2 A 92 LEU N N 15 121.059 0.2 A 93 GLU H H 1 8.132 0.02 A 93 GLU HA H 1 4.099 0.02 A 93 GLU HBx H 1 1.831 0.02 A 93 GLU HBy H 1 1.831 0.02 A 93 GLU HGy H 1 2.127 0.02 A 93 GLU HGx H 1 2.074 0.02 A 93 GLU C C 13 176.461 0.2 A 93 GLU CA C 13 56.838 0.2 A 93 GLU CB C 13 29.803 0.2 A 93 GLU CG C 13 35.868 0.2 A 93 GLU N N 15 119.896 0.2 A 94 HIS H H 1 8.134 0.02 A 94 HIS C C 13 174.994 0.2 A 94 HIS CA C 13 56.075 0.2 A 94 HIS CB C 13 29.997 0.2 A 94 HIS N N 15 118.751 0.2 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 3 GLN H A 4 LEU HG 1.0 . 5.73 2 2 A 3 GLN H A 3 GLN HBx 1.0 . 3.82 3 2 A 3 GLN H A 3 GLN HBy 1.0 . 3.82 4 3 A 3 GLN H A 3 GLN HGx 1.0 . 4.21 5 3 A 3 GLN H A 3 GLN HGy 1.0 . 4.21 6 4 A 3 GLN H A 5 LYS H 1.0 . 5.75 7 5 A 3 GLN HE21 A 3 GLN HBx 1.0 . 5.34 8 5 A 3 GLN HBy A 3 GLN HE21 1.0 . 5.34 9 6 A 4 LEU H A 4 LEU HD2% 1.0 . 4.56 10 7 A 4 LEU H A 7 ILE HD1% 1.0 . 5.40 11 8 A 4 LEU H A 4 LEU HD1% 1.0 . 4.27 12 9 A 4 LEU H A 40 LEU HD1% 1.0 . 5.04 13 10 A 4 LEU HG A 4 LEU H 1.0 . 3.43 14 11 A 4 LEU H A 3 GLN HBx 1.0 . 3.69 15 11 A 3 GLN HBy A 4 LEU H 1.0 . 3.69 16 12 A 4 LEU H A 3 GLN HGx 1.0 . 5.34 17 12 A 3 GLN HGy A 4 LEU H 1.0 . 5.34 18 13 A 4 LEU H A 26 PHE HE% 1.0 . 5.30 19 14 A 4 LEU H A 6 THR H 1.0 . 4.85 20 15 A 3 GLN H A 4 LEU H 1.0 . 4.42 21 16 A 5 LYS H A 4 LEU HD1% 1.0 . 5.44 22 17 A 5 LYS H A 5 LYS HGx 1.0 . 4.73 23 18 A 5 LYS H A 4 LEU HB3 1.0 . 4.56 24 19 A 5 LYS H A 5 LYS HGy 1.0 . 4.73 25 20 A 5 LYS H A 4 LEU HB2 1.0 . 4.56 26 21 A 5 LYS H A 5 LYS HBx 1.0 . 3.29 27 21 A 5 LYS H A 5 LYS HBy 1.0 . 3.29 28 22 A 5 LYS H A 6 THR HB 1.0 . 5.28 29 23 A 5 LYS H A 6 THR H 1.0 . 3.82 30 24 A 5 LYS H A 4 LEU H 1.0 . 3.76 31 25 A 6 THR H A 6 THR HG2% 1.0 . 4.46 32 26 A 6 THR H A 5 LYS HGx 1.0 . 5.38 33 27 A 6 THR H A 5 LYS HGy 1.0 . 5.38 34 28 A 6 THR H A 5 LYS HDx 1.0 . 5.63 35 28 A 6 THR H A 5 LYS HDy 1.0 . 5.63 36 29 A 6 THR H A 7 ILE HB 1.0 . 6.00 37 30 A 6 THR H A 7 ILE HG13 1.0 . 6.00 38 31 A 6 THR H A 5 LYS HBx 1.0 . 3.75 39 31 A 6 THR H A 5 LYS HBy 1.0 . 3.75 40 32 A 6 THR H A 3 GLN HBx 1.0 . 5.31 41 32 A 3 GLN HBy A 6 THR H 1.0 . 5.31 42 33 A 6 THR H A 6 THR HB 1.0 . 3.56 43 34 A 6 THR H A 8 LYS H 1.0 . 5.93 44 35 A 7 ILE H A 7 ILE HG2% 1.0 . 3.98 45 36 A 6 THR HG2% A 7 ILE H 1.0 . 4.70 46 37 A 7 ILE HB A 7 ILE H 1.0 . 3.87 47 38 A 7 ILE HG13 A 7 ILE H 1.0 . 4.03 48 39 A 7 ILE H A 4 LEU HA 1.0 . 4.46 49 40 A 6 THR HB A 7 ILE H 1.0 . 4.04 50 41 A 8 LYS H A 7 ILE HG2% 1.0 . 4.25 51 42 A 40 LEU HD1% A 8 LYS H 1.0 . 4.76 52 43 A 7 ILE HB A 8 LYS H 1.0 . 3.78 53 44 A 8 LYS H A 8 LYS HBx 1.0 . 3.43 54 44 A 8 LYS H A 8 LYS HBy 1.0 . 3.43 55 45 A 8 LYS H A 7 ILE H 1.0 . 3.71 56 46 A 8 LYS H A 9 GLU H 1.0 . 3.75 57 47 A 9 GLU H A 10 LEU HD1% 1.0 . 5.22 58 48 A 9 GLU H A 10 LEU HD2% 1.0 . 5.99 59 49 A 9 GLU H A 5 LYS HGx 1.0 . 5.74 60 50 A 9 GLU H A 8 LYS HGx 1.0 . 6.00 61 51 A 9 GLU H A 5 LYS HGy 1.0 . 5.74 62 52 A 9 GLU H A 8 LYS HGy 1.0 . 6.00 63 53 A 9 GLU H A 8 LYS HBx 1.0 . 3.69 64 53 A 8 LYS HBy A 9 GLU H 1.0 . 3.69 65 54 A 9 GLU H A 9 GLU HBx 1.0 . 3.65 66 55 A 9 GLU H A 9 GLU HBy 1.0 . 3.65 67 56 A 9 GLU H A 9 GLU HGx 1.0 . 4.01 68 57 A 9 GLU H A 9 GLU HGy 1.0 . 4.01 69 58 A 9 GLU H A 6 THR HA 1.0 . 4.38 70 59 A 9 GLU H A 10 LEU H 1.0 . 3.70 71 60 A 10 LEU HD1% A 10 LEU H 1.0 . 4.07 72 61 A 10 LEU HD2% A 10 LEU H 1.0 . 4.21 73 62 A 10 LEU H A 19 ALA HB% 1.0 . 4.74 74 63 A 10 LEU H A 10 LEU HBx 1.0 . 4.06 75 64 A 10 LEU H A 10 LEU HG 1.0 . 3.52 76 65 A 10 LEU H A 10 LEU HBy 1.0 . 4.06 77 66 A 10 LEU H A 9 GLU HBy 1.0 . 4.55 78 67 A 10 LEU H A 9 GLU HGx 1.0 . 5.29 79 68 A 10 LEU H A 9 GLU HGy 1.0 . 5.29 80 69 A 10 LEU H A 7 ILE HA 1.0 . 4.47 81 70 A 6 THR HA A 10 LEU H 1.0 . 4.77 82 71 A 11 ILE H A 11 ILE HG1x 1.0 . 4.82 83 72 A 11 ILE H A 11 ILE HG2% 1.0 . 4.14 84 73 A 11 ILE H A 11 ILE HD1% 1.0 . 4.32 85 74 A 19 ALA HB% A 11 ILE H 1.0 . 4.29 86 75 A 11 ILE H A 10 LEU HBx 1.0 . 4.65 87 76 A 11 ILE H A 11 ILE HB 1.0 . 3.39 88 77 A 11 ILE H A 10 LEU HBy 1.0 . 4.65 89 78 A 7 ILE HA A 11 ILE H 1.0 . 5.37 90 79 A 11 ILE H A 8 LYS HA 1.0 . 4.81 91 80 A 12 ASN HD2y A 8 LYS HBx 1.0 . 5.21 92 80 A 8 LYS HBy A 12 ASN HD2y 1.0 . 5.21 93 81 A 12 ASN HD2y A 12 ASN HA 1.0 . 5.74 94 82 A 12 ASN HD2x A 8 LYS HBx 1.0 . 5.21 95 82 A 8 LYS HBy A 12 ASN HD2x 1.0 . 5.21 96 83 A 12 ASN HD2x A 12 ASN HBx 1.0 . 3.96 97 83 A 12 ASN HBy A 12 ASN HD2x 1.0 . 3.96 98 84 A 11 ILE HG2% A 13 GLN H 1.0 . 6.00 99 85 A 10 LEU HD2% A 13 GLN H 1.0 . 5.77 100 86 A 13 GLN H A 13 GLN HBx 1.0 . 3.91 101 87 A 13 GLN H A 13 GLN HBy 1.0 . 3.91 102 88 A 13 GLN H A 13 GLN HGx 1.0 . 3.74 103 88 A 13 GLN H A 13 GLN HGy 1.0 . 3.74 104 89 A 13 GLN H A 12 ASN HBx 1.0 . 3.88 105 89 A 12 ASN HBy A 13 GLN H 1.0 . 3.88 106 90 A 13 GLN H A 11 ILE HA 1.0 . 5.74 107 91 A 13 GLN H A 10 LEU HA 1.0 . 4.70 108 92 A 9 GLU HA A 13 GLN H 1.0 . 5.17 109 93 A 10 LEU HD2% A 13 GLN HE22 1.0 . 4.96 110 94 A 13 GLN HE22 A 13 GLN HBy 1.0 . 5.29 111 95 A 10 LEU HA A 13 GLN HE22 1.0 . 5.76 112 96 A 10 LEU HD2% A 13 GLN HE21 1.0 . 4.78 113 97 A 10 LEU HG A 13 GLN HE21 1.0 . 5.90 114 98 A 13 GLN HE21 A 13 GLN HBx 1.0 . 5.14 115 99 A 13 GLN HE21 A 13 GLN HBy 1.0 . 5.14 116 100 A 13 GLN HE21 A 12 ASN HBx 1.0 . 5.16 117 100 A 12 ASN HBy A 13 GLN HE21 1.0 . 5.16 118 101 A 13 GLN HE21 A 13 GLN HA 1.0 . 5.37 119 102 A 14 GLY H A 16 ILE HD1% 1.0 . 4.67 120 103 A 14 GLY H A 13 GLN HBx 1.0 . 5.13 121 104 A 14 GLY H A 13 GLN HBy 1.0 . 5.13 122 105 A 14 GLY H A 15 ASP HBx 1.0 . 6.00 123 106 A 14 GLY H A 13 GLN HGx 1.0 . 5.33 124 106 A 13 GLN HGy A 14 GLY H 1.0 . 5.33 125 107 A 14 GLY H A 12 ASN HBx 1.0 . 5.62 126 107 A 12 ASN HBy A 14 GLY H 1.0 . 5.62 127 108 A 14 GLY H A 15 ASP HBy 1.0 . 6.00 128 109 A 11 ILE HA A 14 GLY H 1.0 . 5.12 129 110 A 13 GLN H A 14 GLY H 1.0 . 3.64 130 111 A 14 GLY H A 15 ASP H 1.0 . 3.58 131 112 A 16 ILE HD1% A 15 ASP H 1.0 . 4.58 132 113 A 10 LEU HD2% A 15 ASP H 1.0 . 4.82 133 114 A 15 ASP H A 16 ILE HG1x 1.0 . 5.50 134 114 A 15 ASP H A 16 ILE HG1y 1.0 . 5.50 135 115 A 19 ALA HB% A 15 ASP H 1.0 . 6.00 136 116 A 15 ASP H A 13 GLN HBx 1.0 . 4.66 137 117 A 15 ASP H A 15 ASP HBx 1.0 . 3.74 138 118 A 15 ASP H A 13 GLN HGx 1.0 . 4.65 139 118 A 13 GLN HGy A 15 ASP H 1.0 . 4.65 140 119 A 15 ASP H A 15 ASP HBy 1.0 . 3.74 141 120 A 11 ILE HA A 15 ASP H 1.0 . 5.00 142 121 A 10 LEU HA A 15 ASP H 1.0 . 5.04 143 122 A 15 ASP H A 16 ILE H 1.0 . 4.77 144 123 A 13 GLN H A 15 ASP H 1.0 . 4.46 145 124 A 16 ILE HD1% A 16 ILE H 1.0 . 3.87 146 125 A 16 ILE H A 16 ILE HG1x 1.0 . 3.39 147 125 A 16 ILE HG1y A 16 ILE H 1.0 . 3.39 148 126 A 16 ILE H A 16 ILE HB 1.0 . 3.58 149 127 A 16 ILE H A 15 ASP HBx 1.0 . 4.93 150 128 A 16 ILE H A 15 ASP HBy 1.0 . 4.93 151 129 A 16 ILE H A 15 ASP HA 1.0 . 3.31 152 130 A 16 ILE H A 17 GLU H 1.0 . 3.78 153 131 A 17 GLU H A 20 LEU HD1% 1.0 . 5.74 154 132 A 17 GLU H A 16 ILE HG2% 1.0 . 4.32 155 133 A 17 GLU H A 16 ILE HG1x 1.0 . 4.63 156 133 A 16 ILE HG1y A 17 GLU H 1.0 . 4.63 157 134 A 16 ILE HB A 17 GLU H 1.0 . 3.36 158 135 A 17 GLU H A 17 GLU HBy 1.0 . 4.14 159 136 A 17 GLU H A 17 GLU HGx 1.0 . 3.84 160 136 A 17 GLU H A 17 GLU HGy 1.0 . 3.84 161 137 A 17 GLU H A 18 ASN HB2 1.0 . 5.31 162 138 A 15 ASP HA A 17 GLU H 1.0 . 4.84 163 139 A 10 LEU HD1% A 18 ASN HD2x 1.0 . 5.51 164 140 A 10 LEU HD2% A 18 ASN HD2x 1.0 . 5.06 165 141 A 18 ASN HB2 A 18 ASN HD2x 1.0 . 4.05 166 142 A 18 ASN HD2x A 18 ASN HA 1.0 . 5.65 167 143 A 10 LEU HD1% A 18 ASN HD2y 1.0 . 5.51 168 144 A 10 LEU HD2% A 18 ASN HD2y 1.0 . 5.06 169 145 A 18 ASN HB2 A 18 ASN HD2y 1.0 . 4.05 170 146 A 18 ASN HA A 18 ASN HD2y 1.0 . 5.65 171 147 A 19 ALA H A 11 ILE HG1x 1.0 . 5.90 172 148 A 19 ALA HB% A 19 ALA H 1.0 . 3.43 173 149 A 10 LEU HG A 19 ALA H 1.0 . 6.00 174 150 A 16 ILE HB A 19 ALA H 1.0 . 6.00 175 151 A 19 ALA H A 10 LEU HBy 1.0 . 5.13 176 152 A 19 ALA H A 11 ILE HG1y 1.0 . 5.90 177 153 A 18 ASN HB3 A 19 ALA H 1.0 . 4.51 178 154 A 18 ASN HB2 A 19 ALA H 1.0 . 4.32 179 155 A 16 ILE HA A 19 ALA H 1.0 . 4.47 180 156 A 16 ILE H A 19 ALA H 1.0 . 5.09 181 157 A 19 ALA H A 20 LEU H 1.0 . 3.98 182 158 A 17 GLU H A 19 ALA H 1.0 . 4.91 183 159 A 20 LEU H A 20 LEU HD2% 1.0 . 4.23 184 160 A 20 LEU HD1% A 20 LEU H 1.0 . 4.17 185 161 A 16 ILE HG2% A 20 LEU H 1.0 . 4.49 186 162 A 20 LEU H A 44 ALA HB% 1.0 . 5.06 187 163 A 20 LEU H A 20 LEU HB2 1.0 . 3.56 188 164 A 20 LEU H A 20 LEU HG 1.0 . 3.67 189 165 A 20 LEU H A 20 LEU HB3 1.0 . 3.79 190 166 A 20 LEU H A 21 GLN HBx 1.0 . 5.58 191 166 A 20 LEU H A 21 GLN HBy 1.0 . 5.58 192 167 A 16 ILE HA A 20 LEU H 1.0 . 5.62 193 168 A 20 LEU H A 18 ASN HA 1.0 . 6.00 194 169 A 20 LEU HD1% A 21 GLN H 1.0 . 4.82 195 170 A 20 LEU HB2 A 21 GLN H 1.0 . 4.13 196 171 A 20 LEU HB3 A 21 GLN H 1.0 . 4.05 197 172 A 21 GLN H A 21 GLN HBx 1.0 . 3.21 198 172 A 21 GLN HBy A 21 GLN H 1.0 . 3.21 199 173 A 21 GLN H A 21 GLN HGx 1.0 . 4.39 200 174 A 21 GLN H A 21 GLN HGy 1.0 . 4.39 201 175 A 21 GLN H A 17 GLU HA 1.0 . 4.78 202 176 A 18 ASN HA A 21 GLN H 1.0 . 4.32 203 177 A 20 LEU H A 21 GLN H 1.0 . 3.97 204 178 A 21 GLN H A 23 LEU H 1.0 . 4.87 205 179 A 22 ALA H A 22 ALA HB% 1.0 . 3.26 206 180 A 22 ALA H A 21 GLN HBx 1.0 . 3.54 207 180 A 21 GLN HBy A 22 ALA H 1.0 . 3.54 208 181 A 22 ALA H A 21 GLN HGx 1.0 . 5.29 209 182 A 22 ALA H A 21 GLN HGy 1.0 . 5.29 210 183 A 22 ALA H A 19 ALA HA 1.0 . 4.22 211 184 A 18 ASN HA A 22 ALA H 1.0 . 5.05 212 185 A 21 GLN H A 22 ALA H 1.0 . 3.65 213 186 A 22 ALA H A 24 GLU H 1.0 . 4.98 214 187 A 23 LEU H A 22 ALA H 1.0 . 3.85 215 188 A 20 LEU HD2% A 23 LEU H 1.0 . 5.40 216 189 A 7 ILE HD1% A 23 LEU H 1.0 . 4.61 217 190 A 23 LEU H A 23 LEU HD1% 1.0 . 4.82 218 191 A 7 ILE HG2% A 23 LEU H 1.0 . 4.73 219 192 A 23 LEU H A 23 LEU HD2% 1.0 . 4.52 220 193 A 23 LEU H A 22 ALA HB% 1.0 . 3.70 221 194 A 23 LEU H A 23 LEU HG 1.0 . 4.07 222 195 A 23 LEU H A 21 GLN HA 1.0 . 5.19 223 196 A 20 LEU HD2% A 24 GLU H 1.0 . 5.74 224 197 A 7 ILE HD1% A 8 LYS H 1.0 . 4.45 225 198 A 24 GLU H A 23 LEU HD2% 1.0 . 5.05 226 199 A 24 GLU H A 23 LEU HB3 1.0 . 3.85 227 200 A 24 GLU H A 23 LEU HB2 1.0 . 3.85 228 201 A 24 GLU H A 24 GLU HGx 1.0 . 3.85 229 202 A 24 GLU H A 24 GLU HGy 1.0 . 3.85 230 203 A 24 GLU H A 25 GLU H 1.0 . 3.56 231 204 A 23 LEU H A 24 GLU H 1.0 . 3.74 232 205 A 7 ILE HD1% A 25 GLU H 1.0 . 6.00 233 206 A 22 ALA HB% A 25 GLU H 1.0 . 5.10 234 207 A 25 GLU H A 25 GLU HBx 1.0 . 3.10 235 207 A 25 GLU H A 25 GLU HBy 1.0 . 3.10 236 208 A 25 GLU H A 24 GLU HGx 1.0 . 5.09 237 209 A 25 GLU H A 24 GLU HGy 1.0 . 5.09 238 210 A 25 GLU H A 22 ALA HA 1.0 . 4.28 239 211 A 25 GLU H A 26 PHE H 1.0 . 3.78 240 212 A 25 GLU H A 27 LEU H 1.0 . 5.15 241 213 A 23 LEU H A 25 GLU H 1.0 . 5.01 242 214 A 26 PHE H A 27 LEU HD1% 1.0 . 5.90 243 215 A 23 LEU HD2% A 26 PHE H 1.0 . 5.71 244 216 A 22 ALA HB% A 26 PHE H 1.0 . 5.53 245 217 A 26 PHE H A 37 ALA HB% 1.0 . 6.00 246 218 A 26 PHE H A 25 GLU HBx 1.0 . 3.75 247 218 A 25 GLU HBy A 26 PHE H 1.0 . 3.75 248 219 A 26 PHE H A 28 GLN HBx 1.0 . 6.00 249 219 A 26 PHE H A 28 GLN HBy 1.0 . 6.00 250 220 A 26 PHE H A 26 PHE HBx 1.0 . 3.47 251 220 A 26 PHE H A 26 PHE HBy 1.0 . 3.47 252 221 A 26 PHE H A 23 LEU HA 1.0 . 4.33 253 222 A 26 PHE H A 26 PHE HD% 1.0 . 4.73 254 223 A 26 PHE H A 27 LEU H 1.0 . 3.94 255 224 A 23 LEU H A 26 PHE H 1.0 . 5.24 256 225 A 27 LEU H A 27 LEU HD2% 1.0 . 4.59 257 226 A 27 LEU H A 27 LEU HD1% 1.0 . 4.15 258 227 A 27 LEU H A 27 LEU HB3 1.0 . 3.94 259 228 A 27 LEU H A 27 LEU HG 1.0 . 3.84 260 229 A 27 LEU H A 27 LEU HB2 1.0 . 3.73 261 230 A 27 LEU H A 26 PHE HBx 1.0 . 4.07 262 230 A 27 LEU H A 26 PHE HBy 1.0 . 4.07 263 231 A 27 LEU H A 24 GLU HA 1.0 . 4.44 264 232 A 27 LEU H A 26 PHE HD% 1.0 . 4.83 265 233 A 24 GLU H A 27 LEU H 1.0 . 5.04 266 234 A 27 LEU HD2% A 28 GLN H 1.0 . 5.44 267 235 A 27 LEU HD1% A 28 GLN H 1.0 . 5.23 268 236 A 28 GLN H A 29 THR HG2% 1.0 . 4.65 269 237 A 27 LEU HB3 A 28 GLN H 1.0 . 4.44 270 238 A 27 LEU HG A 28 GLN H 1.0 . 5.46 271 239 A 27 LEU HB2 A 28 GLN H 1.0 . 4.15 272 240 A 28 GLN H A 28 GLN HBx 1.0 . 3.31 273 240 A 28 GLN HBy A 28 GLN H 1.0 . 3.31 274 241 A 28 GLN H A 28 GLN HGy 1.0 . 4.01 275 242 A 28 GLN H A 28 GLN HGx 1.0 . 4.01 276 243 A 28 GLN H A 26 PHE HBx 1.0 . 5.72 277 243 A 26 PHE HBy A 28 GLN H 1.0 . 5.72 278 244 A 28 GLN H A 25 GLU HA 1.0 . 4.28 279 245 A 28 GLN H A 30 GLU H 1.0 . 5.03 280 246 A 26 PHE H A 28 GLN H 1.0 . 5.13 281 247 A 27 LEU H A 28 GLN H 1.0 . 3.92 282 248 A 29 THR HG2% A 29 THR H 1.0 . 3.74 283 249 A 29 THR H A 34 LYS HDx 1.0 . 5.88 284 249 A 29 THR H A 34 LYS HDy 1.0 . 5.88 285 250 A 29 THR H A 28 GLN HBx 1.0 . 4.40 286 250 A 28 GLN HBy A 29 THR H 1.0 . 4.40 287 251 A 29 THR H A 27 LEU HA 1.0 . 5.13 288 252 A 29 THR H A 26 PHE HA 1.0 . 4.17 289 253 A 29 THR HG2% A 30 GLU H 1.0 . 4.71 290 254 A 88 MET H A 88 MET HBx 1.0 . 3.43 291 254 A 88 MET H A 88 MET HBy 1.0 . 3.43 292 255 A 30 GLU H A 31 PRO HD2 1.0 . 4.22 293 256 A 30 GLU H A 31 PRO HD3 1.0 . 4.22 294 257 A 32 VAL H A 32 VAL HGx% 1.0 . 3.34 295 257 A 32 VAL H A 32 VAL HGy% 1.0 . 3.34 296 258 A 32 VAL H A 32 VAL HB 1.0 . 3.36 297 259 A 32 VAL H A 34 LYS HEx 1.0 . 5.26 298 259 A 32 VAL H A 34 LYS HEy 1.0 . 5.26 299 260 A 32 VAL H A 31 PRO HD2 1.0 . 4.93 300 261 A 32 VAL H A 31 PRO HD3 1.0 . 4.93 301 262 A 32 VAL H A 31 PRO HA 1.0 . 3.39 302 263 A 32 VAL H A 33 GLY H 1.0 . 4.57 303 264 A 33 GLY H A 32 VAL HGx% 1.0 . 3.81 304 264 A 32 VAL HGy% A 33 GLY H 1.0 . 3.81 305 265 A 32 VAL HB A 33 GLY H 1.0 . 4.22 306 266 A 33 GLY H A 36 GLU H 1.0 . 5.81 307 267 A 33 GLY H A 35 ASP H 1.0 . 5.26 308 268 A 34 LYS H A 32 VAL HGx% 1.0 . 4.83 309 268 A 32 VAL HGy% A 34 LYS H 1.0 . 4.83 310 269 A 34 LYS H A 34 LYS HG3 1.0 . 4.20 311 270 A 34 LYS H A 34 LYS HG2 1.0 . 4.20 312 271 A 34 LYS H A 34 LYS HBx 1.0 . 3.71 313 272 A 34 LYS H A 34 LYS HBy 1.0 . 3.71 314 273 A 34 LYS H A 37 ALA H 1.0 . 5.28 315 274 A 33 GLY H A 34 LYS H 1.0 . 3.83 316 275 A 27 LEU HD2% A 35 ASP H 1.0 . 6.00 317 276 A 35 ASP H A 64 LEU HD1% 1.0 . 4.24 318 277 A 35 ASP H A 34 LYS HG3 1.0 . 5.59 319 278 A 35 ASP H A 34 LYS HG2 1.0 . 5.59 320 279 A 35 ASP H A 34 LYS HBx 1.0 . 4.38 321 280 A 35 ASP H A 34 LYS HBy 1.0 . 4.38 322 281 A 35 ASP H A 35 ASP HBx 1.0 . 4.07 323 282 A 35 ASP H A 35 ASP HBy 1.0 . 4.07 324 283 A 35 ASP H A 33 GLY HAx 1.0 . 4.47 325 283 A 35 ASP H A 33 GLY HAy 1.0 . 4.47 326 284 A 35 ASP H A 61 ALA HA 1.0 . 5.19 327 285 A 36 GLU H A 35 ASP H 1.0 . 3.78 328 286 A 35 ASP H A 37 ALA H 1.0 . 5.05 329 287 A 35 ASP H A 34 LYS H 1.0 . 3.85 330 288 A 4 LEU HD1% A 36 GLU H 1.0 . 5.11 331 289 A 36 GLU H A 36 GLU HBx 1.0 . 3.37 332 289 A 36 GLU H A 36 GLU HBy 1.0 . 3.37 333 290 A 36 GLU H A 36 GLU HGx 1.0 . 4.86 334 291 A 36 GLU H A 36 GLU HGy 1.0 . 4.86 335 292 A 36 GLU H A 34 LYS HA 1.0 . 5.28 336 293 A 36 GLU H A 37 ALA H 1.0 . 3.62 337 294 A 36 GLU H A 34 LYS H 1.0 . 5.17 338 295 A 23 LEU HD2% A 37 ALA H 1.0 . 5.74 339 296 A 37 ALA HB% A 37 ALA H 1.0 . 3.41 340 297 A 37 ALA H A 36 GLU HBx 1.0 . 3.91 341 297 A 37 ALA H A 36 GLU HBy 1.0 . 3.91 342 298 A 4 LEU HD1% A 37 ALA H 1.0 . 4.58 343 299 A 50 ASP H A 48 LEU HBx 1.0 . 4.91 344 300 A 26 PHE HD% A 37 ALA H 1.0 . 5.18 345 301 A 50 ASP H A 45 TYR HD% 1.0 . 5.76 346 302 A 50 ASP H A 48 LEU H 1.0 . 4.47 347 303 A 37 ALA H A 38 TYR H 1.0 . 3.85 348 304 A 27 LEU HD2% A 38 TYR H 1.0 . 5.04 349 305 A 64 LEU HD1% A 38 TYR H 1.0 . 5.78 350 306 A 37 ALA HB% A 38 TYR H 1.0 . 3.89 351 307 A 38 TYR H A 36 GLU HBx 1.0 . 5.85 352 307 A 36 GLU HBy A 38 TYR H 1.0 . 5.85 353 308 A 38 TYR H A 39 TYR H 1.0 . 4.12 354 309 A 40 LEU HD1% A 39 TYR H 1.0 . 5.79 355 310 A 39 TYR H A 61 ALA HB% 1.0 . 4.14 356 311 A 39 TYR H A 38 TYR HB3 1.0 . 5.36 357 312 A 39 TYR H A 38 TYR HB2 1.0 . 5.36 358 313 A 39 TYR H A 36 GLU HA 1.0 . 4.41 359 314 A 39 TYR H A 40 LEU H 1.0 . 4.08 360 315 A 23 LEU HD1% A 40 LEU H 1.0 . 5.58 361 316 A 40 LEU HD1% A 40 LEU H 1.0 . 4.27 362 317 A 40 LEU H A 40 LEU HD2% 1.0 . 4.57 363 318 A 23 LEU HD2% A 40 LEU H 1.0 . 5.08 364 319 A 40 LEU H A 40 LEU HB2 1.0 . 4.05 365 320 A 40 LEU H A 40 LEU HG 1.0 . 3.77 366 321 A 40 LEU H A 39 TYR HB3 1.0 . 4.82 367 322 A 40 LEU H A 39 TYR HB2 1.0 . 4.82 368 323 A 40 LEU H A 37 ALA HA 1.0 . 4.95 369 324 A 36 GLU HA A 40 LEU H 1.0 . 5.29 370 325 A 23 LEU HD1% A 41 MET H 1.0 . 4.25 371 326 A 7 ILE HG2% A 41 MET H 1.0 . 5.22 372 327 A 40 LEU HD1% A 41 MET H 1.0 . 5.75 373 328 A 23 LEU HD2% A 41 MET H 1.0 . 4.69 374 329 A 41 MET H A 40 LEU HB3 1.0 . 4.73 375 330 A 40 LEU HB2 A 41 MET H 1.0 . 4.18 376 331 A 41 MET H A 41 MET HGx 1.0 . 3.60 377 331 A 41 MET H A 41 MET HGy 1.0 . 3.60 378 332 A 37 ALA HA A 41 MET H 1.0 . 5.04 379 333 A 41 MET H A 38 TYR HA 1.0 . 4.82 380 334 A 41 MET H A 45 TYR HE% 1.0 . 6.00 381 335 A 41 MET H A 38 TYR HD% 1.0 . 5.47 382 336 A 40 LEU H A 41 MET H 1.0 . 3.94 383 337 A 42 GLY H A 41 MET HGx 1.0 . 4.19 384 337 A 41 MET HGy A 42 GLY H 1.0 . 4.19 385 338 A 42 GLY H A 57 ASN HB3 1.0 . 4.60 386 339 A 42 GLY H A 57 ASN HB2 1.0 . 4.60 387 340 A 42 GLY H A 54 ALA HA 1.0 . 4.98 388 341 A 42 GLY H A 39 TYR HA 1.0 . 4.98 389 342 A 42 GLY H A 58 TYR HE% 1.0 . 5.30 390 343 A 45 TYR HD% A 42 GLY H 1.0 . 5.13 391 344 A 41 MET H A 42 GLY H 1.0 . 3.92 392 345 A 20 LEU HD2% A 44 ALA H 1.0 . 5.58 393 346 A 11 ILE HG2% A 44 ALA H 1.0 . 4.97 394 347 A 44 ALA HB% A 44 ALA H 1.0 . 3.57 395 348 A 44 ALA H A 43 ASN HBx 1.0 . 5.04 396 349 A 44 ALA H A 43 ASN HBy 1.0 . 5.04 397 350 A 44 ALA H A 41 MET HA 1.0 . 4.48 398 351 A 44 ALA H A 46 ARG H 1.0 . 5.11 399 352 A 20 LEU HD2% A 45 TYR H 1.0 . 5.07 400 353 A 16 ILE HG2% A 45 TYR H 1.0 . 5.26 401 354 A 44 ALA HB% A 45 TYR H 1.0 . 3.77 402 355 A 45 TYR H A 54 ALA HB% 1.0 . 5.03 403 356 A 45 TYR H A 47 LYS HBx 1.0 . 5.74 404 356 A 45 TYR H A 47 LYS HBy 1.0 . 5.74 405 357 A 41 MET HA A 45 TYR H 1.0 . 4.91 406 358 A 54 ALA HA A 45 TYR H 1.0 . 5.41 407 359 A 45 TYR HE% A 45 TYR H 1.0 . 5.38 408 360 A 44 ALA H A 45 TYR H 1.0 . 4.05 409 361 A 46 ARG H A 45 TYR H 1.0 . 4.05 410 362 A 44 ALA HB% A 46 ARG H 1.0 . 5.68 411 363 A 46 ARG H A 54 ALA HB% 1.0 . 4.32 412 364 A 46 ARG H A 46 ARG HGx 1.0 . 4.71 413 364 A 46 ARG H A 46 ARG HGy 1.0 . 4.71 414 365 A 46 ARG H A 46 ARG HBx 1.0 . 4.17 415 366 A 46 ARG H A 46 ARG HBy 1.0 . 4.17 416 367 A 46 ARG H A 45 TYR HBx 1.0 . 5.37 417 368 A 46 ARG H A 45 TYR HBy 1.0 . 5.37 418 369 A 54 ALA HA A 46 ARG H 1.0 . 5.90 419 370 A 46 ARG H A 43 ASN HA 1.0 . 5.18 420 371 A 45 TYR HD% A 46 ARG H 1.0 . 5.53 421 372 A 48 LEU H A 46 ARG H 1.0 . 5.53 422 373 A 16 ILE HG2% A 47 LYS H 1.0 . 5.71 423 374 A 44 ALA HB% A 47 LYS H 1.0 . 5.32 424 375 A 47 LYS H A 47 LYS HGy 1.0 . 4.43 425 376 A 47 LYS H A 47 LYS HGx 1.0 . 4.43 426 377 A 47 LYS H A 47 LYS HDx 1.0 . 4.52 427 377 A 47 LYS H A 47 LYS HDy 1.0 . 4.52 428 378 A 47 LYS H A 46 ARG HGx 1.0 . 4.54 429 378 A 46 ARG HGy A 47 LYS H 1.0 . 4.54 430 379 A 47 LYS H A 47 LYS HBx 1.0 . 3.40 431 379 A 47 LYS HBy A 47 LYS H 1.0 . 3.40 432 380 A 47 LYS H A 47 LYS HEx 1.0 . 5.49 433 380 A 47 LYS H A 47 LYS HEy 1.0 . 5.49 434 381 A 47 LYS H A 44 ALA HA 1.0 . 4.45 435 382 A 43 ASN HA A 47 LYS H 1.0 . 5.52 436 383 A 48 LEU H A 47 LYS H 1.0 . 3.98 437 384 A 46 ARG H A 47 LYS H 1.0 . 4.17 438 385 A 48 LEU H A 48 LEU HD1% 1.0 . 4.35 439 386 A 16 ILE HG2% A 48 LEU H 1.0 . 4.66 440 387 A 16 ILE HD1% A 48 LEU H 1.0 . 5.18 441 388 A 48 LEU H A 48 LEU HG 1.0 . 3.78 442 389 A 48 LEU H A 48 LEU HBy 1.0 . 4.08 443 390 A 48 LEU H A 48 LEU HBx 1.0 . 4.08 444 391 A 48 LEU H A 47 LYS HBx 1.0 . 4.09 445 391 A 48 LEU H A 47 LYS HBy 1.0 . 4.09 446 392 A 48 LEU HD1% A 49 GLY H 1.0 . 5.23 447 393 A 49 GLY H A 47 LYS HBx 1.0 . 5.51 448 393 A 47 LYS HBy A 49 GLY H 1.0 . 5.51 449 394 A 49 GLY H A 47 LYS HA 1.0 . 5.63 450 395 A 48 LEU H A 49 GLY H 1.0 . 3.95 451 396 A 50 ASP H A 49 GLY H 1.0 . 3.86 452 397 A 47 LYS H A 49 GLY H 1.0 . 4.94 453 398 A 40 LEU HD1% A 37 ALA H 1.0 . 5.30 454 399 A 50 ASP H A 48 LEU HD1% 1.0 . 5.58 455 400 A 50 ASP H A 50 ASP HBx 1.0 . 4.20 456 401 A 50 ASP H A 50 ASP HBy 1.0 . 4.20 457 402 A 37 ALA H A 38 TYR HA 1.0 . 5.39 458 403 A 51 TRP H A 52 GLN HBx 1.0 . 6.00 459 403 A 51 TRP H A 52 GLN HBy 1.0 . 6.00 460 404 A 51 TRP H A 50 ASP HBx 1.0 . 5.42 461 405 A 51 TRP H A 50 ASP HBy 1.0 . 5.42 462 406 A 51 TRP H A 53 LYS H 1.0 . 5.22 463 407 A 50 ASP H A 51 TRP H 1.0 . 5.60 464 408 A 52 GLN H A 52 GLN HBx 1.0 . 3.79 465 408 A 52 GLN HBy A 52 GLN H 1.0 . 3.79 466 409 A 52 GLN H A 51 TRP HB3 1.0 . 5.07 467 410 A 52 GLN H A 51 TRP HB2 1.0 . 5.27 468 411 A 52 GLN H A 50 ASP HA 1.0 . 5.09 469 412 A 51 TRP H A 52 GLN H 1.0 . 4.68 470 413 A 52 GLN H A 54 ALA H 1.0 . 5.85 471 414 A 52 GLN HE2y A 88 MET HE% 1.0 . 5.55 472 415 A 53 LYS H A 53 LYS HGx 1.0 . 4.33 473 416 A 53 LYS H A 53 LYS HDx 1.0 . 4.57 474 416 A 53 LYS H A 53 LYS HDy 1.0 . 4.57 475 417 A 53 LYS H A 53 LYS HGy 1.0 . 4.33 476 418 A 54 ALA HB% A 53 LYS H 1.0 . 4.78 477 419 A 53 LYS H A 52 GLN HBx 1.0 . 3.86 478 419 A 52 GLN HBy A 53 LYS H 1.0 . 3.86 479 420 A 53 LYS H A 52 GLN H 1.0 . 4.01 480 421 A 54 ALA H A 53 LYS HBx 1.0 . 5.03 481 422 A 54 ALA H A 53 LYS HBy 1.0 . 5.03 482 423 A 54 ALA H A 53 LYS HGx 1.0 . 5.08 483 424 A 54 ALA H A 53 LYS HDx 1.0 . 5.48 484 424 A 54 ALA H A 53 LYS HDy 1.0 . 5.48 485 425 A 54 ALA H A 53 LYS HGy 1.0 . 5.08 486 426 A 54 ALA HB% A 54 ALA H 1.0 . 3.53 487 427 A 54 ALA H A 52 GLN HBx 1.0 . 5.14 488 427 A 52 GLN HBy A 54 ALA H 1.0 . 5.14 489 428 A 54 ALA H A 55 LEU HG 1.0 . 5.57 490 429 A 54 ALA H A 45 TYR HBx 1.0 . 4.91 491 430 A 54 ALA H A 45 TYR HBy 1.0 . 4.91 492 431 A 54 ALA H A 51 TRP HA 1.0 . 4.70 493 432 A 45 TYR HD% A 54 ALA H 1.0 . 5.29 494 433 A 53 LYS H A 54 ALA H 1.0 . 3.79 495 434 A 54 ALA H A 55 LEU H 1.0 . 3.95 496 435 A 55 LEU H A 55 LEU HD1% 1.0 . 4.45 497 436 A 55 LEU H A 55 LEU HD2% 1.0 . 4.81 498 437 A 55 LEU H A 77 VAL HG1% 1.0 . 5.06 499 438 A 54 ALA HB% A 55 LEU H 1.0 . 3.89 500 439 A 55 LEU HG A 55 LEU H 1.0 . 3.51 501 440 A 51 TRP HA A 55 LEU H 1.0 . 5.89 502 441 A 55 LEU H A 58 TYR HD% 1.0 . 5.48 503 442 A 53 LYS H A 55 LEU H 1.0 . 5.52 504 443 A 53 LYS HA A 56 ASN HD2y 1.0 . 5.04 505 444 A 56 ASN HD2y A 56 ASN HA 1.0 . 5.86 506 445 A 56 ASN HD2x A 52 GLN HBx 1.0 . 6.00 507 445 A 52 GLN HBy A 56 ASN HD2x 1.0 . 6.00 508 446 A 56 ASN HD2x A 52 GLN HGx 1.0 . 6.00 509 447 A 53 LYS HA A 56 ASN HD2x 1.0 . 5.04 510 448 A 56 ASN HA A 56 ASN HD2x 1.0 . 5.86 511 449 A 57 ASN HD2y A 41 MET HBy 1.0 . 6.00 512 450 A 57 ASN HD2x A 41 MET HBy 1.0 . 6.00 513 451 A 55 LEU HD2% A 58 TYR H 1.0 . 5.51 514 452 A 58 TYR H A 70 ALA HB% 1.0 . 5.55 515 453 A 61 ALA HB% A 58 TYR H 1.0 . 5.60 516 454 A 58 TYR H A 57 ASN HB3 1.0 . 4.64 517 455 A 58 TYR H A 58 TYR HB2 1.0 . 4.14 518 456 A 58 TYR H A 58 TYR HB3 1.0 . 4.14 519 457 A 58 TYR H A 57 ASN HB2 1.0 . 4.64 520 458 A 54 ALA HA A 58 TYR H 1.0 . 4.74 521 459 A 58 TYR H A 55 LEU HA 1.0 . 5.01 522 460 A 58 TYR HD% A 58 TYR H 1.0 . 4.44 523 461 A 59 GLN H A 58 TYR H 1.0 . 4.04 524 462 A 59 GLN H A 62 ILE HD1% 1.0 . 5.20 525 463 A 61 ALA HB% A 59 GLN H 1.0 . 5.28 526 464 A 59 GLN H A 59 GLN HBx 1.0 . 3.88 527 465 A 59 GLN H A 59 GLN HBy 1.0 . 3.88 528 466 A 59 GLN H A 59 GLN HGy 1.0 . 5.08 529 467 A 59 GLN H A 58 TYR HB2 1.0 . 4.74 530 468 A 59 GLN H A 58 TYR HB3 1.0 . 4.74 531 469 A 56 ASN HA A 59 GLN H 1.0 . 4.81 532 470 A 58 TYR HD% A 59 GLN H 1.0 . 5.33 533 471 A 62 ILE HD1% A 59 GLN HE2y 1.0 . 5.77 534 472 A 59 GLN HE2y A 63 GLU HBx 1.0 . 5.27 535 472 A 59 GLN HE2y A 63 GLU HBy 1.0 . 5.27 536 473 A 59 GLN HE2x A 62 ILE HG2% 1.0 . 5.29 537 474 A 62 ILE HD1% A 59 GLN HE2x 1.0 . 5.77 538 475 A 59 GLN HE2x A 63 GLU HBx 1.0 . 5.27 539 475 A 63 GLU HBy A 59 GLN HE2x 1.0 . 5.27 540 476 A 61 ALA HB% A 60 SER H 1.0 . 5.01 541 477 A 60 SER H A 59 GLN HBx 1.0 . 4.05 542 478 A 60 SER H A 59 GLN HBy 1.0 . 4.05 543 479 A 60 SER H A 60 SER HBx 1.0 . 4.11 544 480 A 60 SER H A 60 SER HBy 1.0 . 4.11 545 481 A 60 SER H A 57 ASN HA 1.0 . 4.14 546 482 A 59 GLN H A 60 SER H 1.0 . 3.94 547 483 A 58 TYR H A 60 SER H 1.0 . 5.30 548 484 A 62 ILE HD1% A 61 ALA H 1.0 . 5.23 549 485 A 62 ILE HG2% A 61 ALA H 1.0 . 6.00 550 486 A 70 ALA HB% A 61 ALA H 1.0 . 5.09 551 487 A 61 ALA HB% A 61 ALA H 1.0 . 3.52 552 488 A 61 ALA H A 60 SER HBx 1.0 . 4.89 553 489 A 61 ALA H A 38 TYR HB3 1.0 . 4.77 554 490 A 61 ALA H A 60 SER HBy 1.0 . 4.89 555 491 A 61 ALA H A 38 TYR HB2 1.0 . 4.77 556 492 A 57 ASN HA A 61 ALA H 1.0 . 5.04 557 493 A 61 ALA H A 58 TYR HA 1.0 . 4.97 558 494 A 61 ALA H A 62 ILE H 1.0 . 3.95 559 495 A 39 TYR H A 61 ALA H 1.0 . 5.41 560 496 A 59 GLN H A 61 ALA H 1.0 . 5.66 561 497 A 58 TYR HD% A 61 ALA H 1.0 . 5.86 562 498 A 62 ILE H A 62 ILE HG12 1.0 . 4.09 563 499 A 62 ILE HD1% A 62 ILE H 1.0 . 4.27 564 500 A 62 ILE HG2% A 62 ILE H 1.0 . 4.26 565 501 A 62 ILE HG2% A 63 GLU H 1.0 . 4.51 566 502 A 61 ALA HB% A 62 ILE H 1.0 . 3.61 567 503 A 62 ILE H A 62 ILE HB 1.0 . 3.91 568 504 A 62 ILE H A 59 GLN HA 1.0 . 4.45 569 505 A 59 GLN H A 62 ILE H 1.0 . 5.01 570 506 A 63 GLU H A 63 GLU HBx 1.0 . 3.40 571 506 A 63 GLU HBy A 63 GLU H 1.0 . 3.40 572 507 A 63 GLU H A 63 GLU HGx 1.0 . 4.14 573 508 A 63 GLU H A 63 GLU HGy 1.0 . 4.14 574 509 A 64 LEU H A 64 LEU HD2% 1.0 . 4.17 575 510 A 64 LEU HD1% A 64 LEU H 1.0 . 4.37 576 511 A 64 LEU H A 64 LEU HBx 1.0 . 4.14 577 512 A 64 LEU H A 64 LEU HBy 1.0 . 4.14 578 513 A 64 LEU H A 64 LEU HG 1.0 . 3.99 579 514 A 64 LEU H A 63 GLU HBx 1.0 . 3.82 580 514 A 63 GLU HBy A 64 LEU H 1.0 . 3.82 581 515 A 64 LEU H A 63 GLU HGx 1.0 . 5.69 582 516 A 64 LEU H A 63 GLU HGy 1.0 . 5.69 583 517 A 63 GLU H A 64 LEU H 1.0 . 3.90 584 518 A 67 ASP H A 66 PRO HGx 1.0 . 5.26 585 519 A 67 ASP H A 67 ASP HBx 1.0 . 4.04 586 520 A 67 ASP H A 67 ASP HBy 1.0 . 4.04 587 521 A 67 ASP H A 66 PRO HDx 1.0 . 5.06 588 522 A 67 ASP H A 66 PRO HDy 1.0 . 5.06 589 523 A 67 ASP H A 65 ASN HA 1.0 . 4.84 590 524 A 68 SER H A 67 ASP H 1.0 . 3.61 591 525 A 62 ILE HA A 68 SER H 1.0 . 5.17 592 526 A 66 PRO HA A 68 SER H 1.0 . 4.64 593 527 A 68 SER H A 65 ASN HA 1.0 . 5.91 594 528 A 68 SER H A 70 ALA H 1.0 . 5.21 595 529 A 70 ALA H A 69 PRO HGx 1.0 . 4.89 596 530 A 70 ALA H A 71 LEU HD1% 1.0 . 5.40 597 531 A 70 ALA HB% A 70 ALA H 1.0 . 3.64 598 532 A 61 ALA HB% A 70 ALA H 1.0 . 4.80 599 533 A 70 ALA H A 69 PRO HDx 1.0 . 4.74 600 534 A 70 ALA H A 39 TYR HD% 1.0 . 4.85 601 535 A 70 ALA H A 68 SER HG 1.0 . 4.59 602 536 A 88 MET H A 81 LEU HD2% 1.0 . 6.00 603 537 A 62 ILE HG12 A 71 LEU H 1.0 . 4.70 604 538 A 71 LEU HD1% A 71 LEU H 1.0 . 4.37 605 539 A 71 LEU H A 71 LEU HB2 1.0 . 3.32 606 540 A 71 LEU H A 71 LEU HB3 1.0 . 3.47 607 541 A 71 LEU H A 39 TYR HE% 1.0 . 5.28 608 542 A 71 LEU H A 73 ALA H 1.0 . 4.92 609 543 A 70 ALA H A 71 LEU H 1.0 . 4.03 610 544 A 62 ILE HD1% A 72 GLN H 1.0 . 5.33 611 545 A 71 LEU HD1% A 72 GLN H 1.0 . 4.91 612 546 A 72 GLN H A 71 LEU HD2% 1.0 . 5.64 613 547 A 71 LEU HB2 A 72 GLN H 1.0 . 3.90 614 548 A 71 LEU HB3 A 72 GLN H 1.0 . 3.82 615 549 A 72 GLN H A 72 GLN HBx 1.0 . 3.67 616 550 A 72 GLN H A 72 GLN HBy 1.0 . 3.67 617 551 A 72 GLN H A 70 ALA HA 1.0 . 5.44 618 552 A 73 ALA H A 72 GLN H 1.0 . 3.71 619 553 A 71 LEU H A 72 GLN H 1.0 . 3.88 620 554 A 73 ALA H A 73 ALA HB% 1.0 . 3.58 621 555 A 70 ALA HB% A 73 ALA H 1.0 . 5.17 622 556 A 71 LEU HB3 A 73 ALA H 1.0 . 5.14 623 557 A 73 ALA H A 72 GLN HBx 1.0 . 4.37 624 558 A 73 ALA H A 72 GLN HBy 1.0 . 4.37 625 559 A 73 ALA H A 72 GLN HGx 1.0 . 5.59 626 560 A 73 ALA H A 70 ALA HA 1.0 . 4.85 627 561 A 73 ALA H A 76 MET H 1.0 . 5.42 628 562 A 70 ALA H A 73 ALA H 1.0 . 5.42 629 563 A 62 ILE HD1% A 74 ARG H 1.0 . 5.09 630 564 A 73 ALA HB% A 74 ARG H 1.0 . 3.85 631 565 A 70 ALA HB% A 74 ARG H 1.0 . 4.99 632 566 A 74 ARG H A 74 ARG HBx 1.0 . 3.78 633 567 A 74 ARG H A 74 ARG HBy 1.0 . 3.78 634 568 A 74 ARG H A 58 TYR HB2 1.0 . 5.87 635 569 A 70 ALA HA A 74 ARG H 1.0 . 5.14 636 570 A 58 TYR HD% A 74 ARG H 1.0 . 5.06 637 571 A 74 ARG H A 75 LYS H 1.0 . 4.05 638 572 A 73 ALA H A 74 ARG H 1.0 . 4.00 639 573 A 73 ALA HB% A 75 LYS H 1.0 . 5.44 640 574 A 75 LYS H A 75 LYS HBx 1.0 . 3.54 641 574 A 75 LYS H A 75 LYS HBy 1.0 . 3.54 642 575 A 75 LYS H A 72 GLN HA 1.0 . 4.65 643 576 A 75 LYS H A 78 MET H 1.0 . 5.68 644 577 A 73 ALA HB% A 76 MET H 1.0 . 5.33 645 578 A 76 MET H A 75 LYS HBx 1.0 . 3.97 646 578 A 76 MET H A 75 LYS HBy 1.0 . 3.97 647 579 A 76 MET H A 76 MET HBx 1.0 . 4.04 648 580 A 76 MET H A 76 MET HBy 1.0 . 4.04 649 581 A 76 MET H A 76 MET HGx 1.0 . 4.61 650 582 A 76 MET H A 76 MET HGy 1.0 . 4.61 651 583 A 76 MET H A 72 GLN HA 1.0 . 4.85 652 584 A 76 MET H A 73 ALA HA 1.0 . 5.05 653 585 A 76 MET H A 75 LYS H 1.0 . 4.07 654 586 A 76 MET H A 77 VAL H 1.0 . 4.34 655 587 A 55 LEU HD2% A 77 VAL H 1.0 . 5.08 656 588 A 73 ALA HB% A 77 VAL H 1.0 . 5.69 657 589 A 77 VAL HG1% A 77 VAL H 1.0 . 4.79 658 590 A 77 VAL H A 77 VAL HG2% 1.0 . 3.93 659 591 A 77 VAL H A 76 MET HBx 1.0 . 4.37 660 592 A 77 VAL H A 77 VAL HB 1.0 . 3.90 661 593 A 77 VAL H A 76 MET HGx 1.0 . 5.69 662 594 A 77 VAL H A 74 ARG HA 1.0 . 5.09 663 595 A 73 ALA HA A 77 VAL H 1.0 . 5.36 664 596 A 75 LYS H A 77 VAL H 1.0 . 5.70 665 597 A 77 VAL HG1% A 78 MET H 1.0 . 5.20 666 598 A 78 MET H A 77 VAL HG2% 1.0 . 5.05 667 599 A 78 MET H A 74 ARG HGx 1.0 . 5.45 668 599 A 78 MET H A 74 ARG HGy 1.0 . 5.45 669 600 A 78 MET H A 78 MET HE% 1.0 . 4.81 670 601 A 78 MET H A 77 VAL HB 1.0 . 4.31 671 602 A 78 MET H A 78 MET HGx 1.0 . 4.46 672 603 A 78 MET H A 78 MET HGy 1.0 . 4.46 673 604 A 76 MET H A 78 MET H 1.0 . 5.98 674 605 A 78 MET H A 80 ILE H 1.0 . 6.00 675 606 A 78 MET H A 77 VAL H 1.0 . 4.20 676 607 A 79 ASP H A 78 MET HB2 1.0 . 4.44 677 608 A 79 ASP H A 78 MET HB3 1.0 . 4.44 678 609 A 80 ILE H A 79 ASP H 1.0 . 4.28 679 610 A 78 MET H A 79 ASP H 1.0 . 4.10 680 611 A 80 ILE H A 80 ILE HG2% 1.0 . 5.17 681 612 A 80 ILE H A 80 ILE HG1x 1.0 . 4.94 682 613 A 80 ILE H A 80 ILE HB 1.0 . 3.94 683 614 A 80 ILE H A 79 ASP HBx 1.0 . 5.12 684 615 A 80 ILE H A 79 ASP HBy 1.0 . 5.12 685 616 A 80 ILE H A 81 LEU H 1.0 . 4.25 686 617 A 80 ILE HG2% A 81 LEU H 1.0 . 5.08 687 618 A 81 LEU HD2% A 81 LEU H 1.0 . 5.14 688 619 A 81 LEU H A 81 LEU HD1% 1.0 . 4.74 689 620 A 81 LEU H A 81 LEU HG 1.0 . 3.98 690 621 A 81 LEU H A 81 LEU HB2 1.0 . 4.13 691 622 A 81 LEU H A 78 MET HA 1.0 . 4.83 692 623 A 83 PHE H A 82 ASN HBx 1.0 . 4.47 693 623 A 82 ASN HBy A 83 PHE H 1.0 . 4.47 694 624 A 83 PHE H A 83 PHE HBx 1.0 . 3.80 695 624 A 83 PHE H A 83 PHE HBy 1.0 . 3.80 696 625 A 83 PHE H A 80 ILE HA 1.0 . 5.66 697 626 A 83 PHE H A 84 TYR HD% 1.0 . 5.81 698 627 A 84 TYR H A 83 PHE H 1.0 . 4.12 699 628 A 84 TYR H A 83 PHE HBx 1.0 . 4.43 700 628 A 84 TYR H A 83 PHE HBy 1.0 . 4.43 701 629 A 86 LYS H A 86 LYS HGx 1.0 . 4.64 702 629 A 86 LYS H A 86 LYS HGy 1.0 . 4.64 703 630 A 86 LYS H A 86 LYS HDx 1.0 . 5.15 704 630 A 86 LYS H A 86 LYS HDy 1.0 . 5.15 705 631 A 86 LYS H A 86 LYS HBx 1.0 . 3.86 706 631 A 86 LYS H A 86 LYS HBy 1.0 . 3.86 707 632 A 86 LYS H A 85 ASN HBy 1.0 . 5.26 708 633 A 87 ASP H A 86 LYS HGx 1.0 . 4.28 709 633 A 86 LYS HGy A 87 ASP H 1.0 . 4.28 710 634 A 87 ASP H A 86 LYS HBx 1.0 . 3.99 711 634 A 86 LYS HBy A 87 ASP H 1.0 . 3.99 712 635 A 87 ASP H A 87 ASP HBx 1.0 . 3.87 713 636 A 87 ASP H A 87 ASP HBy 1.0 . 3.87 714 637 A 88 MET H A 88 MET HGx 1.0 . 4.27 715 637 A 88 MET H A 88 MET HGy 1.0 . 4.27 716 638 A 88 MET H A 87 ASP HBx 1.0 . 4.84 717 639 A 88 MET H A 87 ASP HBy 1.0 . 4.84 718 640 A 71 LEU H A 69 PRO HA 1.0 . 4.26 719 641 A 30 GLU H A 29 THR H 1.0 . 3.55 720 642 A 88 MET H A 87 ASP H 1.0 . 3.86 721 643 A 89 TYR H A 88 MET HBx 1.0 . 4.01 722 643 A 88 MET HBy A 89 TYR H 1.0 . 4.01 723 644 A 89 TYR H A 88 MET HGx 1.0 . 5.02 724 644 A 88 MET HGy A 89 TYR H 1.0 . 5.02 725 645 A 89 TYR H A 89 TYR HBx 1.0 . 3.92 726 646 A 89 TYR H A 89 TYR HBy 1.0 . 3.92 727 647 A 89 TYR H A 87 ASP HA 1.0 . 4.91 728 648 A 88 MET H A 89 TYR H 1.0 . 3.64 729 649 A 90 ASN HD2y A 90 ASN HBx 1.0 . 4.00 730 649 A 90 ASN HBy A 90 ASN HD2y 1.0 . 4.00 731 650 A 12 ASN HD2y A 12 ASN HBx 1.0 . 3.96 732 650 A 12 ASN HBy A 12 ASN HD2y 1.0 . 3.96 733 651 A 90 ASN HD2y A 90 ASN HA 1.0 . 4.89 734 652 A 90 ASN HD2x A 86 LYS HGx 1.0 . 5.59 735 652 A 86 LYS HGy A 90 ASN HD2x 1.0 . 5.59 736 653 A 90 ASN HD2x A 90 ASN HBx 1.0 . 4.00 737 653 A 90 ASN HBy A 90 ASN HD2x 1.0 . 4.00 738 654 A 90 ASN HA A 90 ASN HD2x 1.0 . 4.89 739 655 A 91 GLN H A 91 GLN HBx 1.0 . 3.98 740 656 A 91 GLN H A 91 GLN HBy 1.0 . 3.98 741 657 A 91 GLN H A 91 GLN HGx 1.0 . 4.08 742 657 A 91 GLN H A 91 GLN HGy 1.0 . 4.08 743 658 A 91 GLN H A 90 ASN HBx 1.0 . 4.22 744 658 A 90 ASN HBy A 91 GLN H 1.0 . 4.22 745 659 A 91 GLN HE2y A 91 GLN HBx 1.0 . 5.28 746 660 A 91 GLN HE2y A 91 GLN HBy 1.0 . 5.28 747 661 A 91 GLN HE2y A 88 MET HA 1.0 . 6.00 748 662 A 91 GLN HE2x A 91 GLN HBx 1.0 . 5.28 749 663 A 91 GLN HE2x A 91 GLN HBy 1.0 . 5.28 750 664 A 92 LEU H A 92 LEU HDx% 1.0 . 4.87 751 665 A 92 LEU H A 92 LEU HDy% 1.0 . 4.87 752 666 A 92 LEU H A 92 LEU HBx 1.0 . 3.93 753 667 A 92 LEU H A 92 LEU HBy 1.0 . 3.93 754 668 A 92 LEU H A 92 LEU HG 1.0 . 4.09 755 669 A 92 LEU H A 91 GLN HBx 1.0 . 3.99 756 670 A 92 LEU H A 91 GLN HBy 1.0 . 3.99 757 671 A 92 LEU H A 91 GLN HGx 1.0 . 5.02 758 671 A 91 GLN HGy A 92 LEU H 1.0 . 5.02 759 672 A 90 ASN HA A 92 LEU H 1.0 . 5.32 760 673 A 93 GLU H A 92 LEU HDx% 1.0 . 5.42 761 674 A 93 GLU H A 92 LEU HBx 1.0 . 4.23 762 675 A 93 GLU H A 92 LEU HBy 1.0 . 4.23 763 676 A 93 GLU H A 93 GLU HBx 1.0 . 3.36 764 676 A 93 GLU H A 93 GLU HBy 1.0 . 3.36 765 677 A 93 GLU H A 93 GLU HGy 1.0 . 5.50 766 678 A 93 GLU H A 93 GLU HGx 1.0 . 5.50 767 679 A 93 GLU H A 92 LEU HA 1.0 . 3.47 768 680 A 90 ASN HA A 93 GLU H 1.0 . 4.62 769 681 A 94 HIS H A 93 GLU HBx 1.0 . 4.80 770 681 A 93 GLU HBy A 94 HIS H 1.0 . 4.80 771 682 A 71 LEU HD2% A 72 GLN HE2y 1.0 . 4.70 772 683 A 71 LEU HB3 A 72 GLN HE2y 1.0 . 5.78 773 684 A 71 LEU HD2% A 72 GLN HE2x 1.0 . 4.70 774 685 A 71 LEU HB3 A 72 GLN HE2x 1.0 . 5.78 775 686 A 40 LEU HD2% A 43 ASN HD2y 1.0 . 4.61 776 687 A 40 LEU HA A 43 ASN HD2y 1.0 . 5.62 777 688 A 40 LEU HD2% A 43 ASN HD2x 1.0 . 4.61 778 689 A 40 LEU HA A 43 ASN HD2x 1.0 . 5.62 779 690 A 21 GLN HE21 A 21 GLN HBx 1.0 . 5.20 780 690 A 21 GLN HBy A 21 GLN HE21 1.0 . 5.20 781 691 A 21 GLN HE21 A 17 GLU HGx 1.0 . 5.04 782 691 A 17 GLU HGy A 21 GLN HE21 1.0 . 5.04 783 692 A 18 ASN HA A 21 GLN HE21 1.0 . 5.37 784 693 A 17 GLU H A 21 GLN HE21 1.0 . 5.97 785 694 A 21 GLN HE22 A 21 GLN HBx 1.0 . 5.24 786 694 A 21 GLN HBy A 21 GLN HE22 1.0 . 5.24 787 695 A 18 ASN HA A 21 GLN HE22 1.0 . 5.57 788 696 A 4 LEU H A 26 PHE HD% 1.0 . 6.00 789 697 A 10 LEU HD2% A 11 ILE H 1.0 . 5.12 790 698 A 90 ASN HD2y A 86 LYS HGx 1.0 . 5.59 791 698 A 86 LYS HGy A 90 ASN HD2y 1.0 . 5.59 792 699 A 90 ASN HD2y A 86 LYS HDx 1.0 . 5.74 793 699 A 86 LYS HDy A 90 ASN HD2y 1.0 . 5.74 794 700 A 12 ASN HD2x A 12 ASN HA 1.0 . 5.74 795 701 A 13 GLN HE22 A 13 GLN HBx 1.0 . 5.29 796 702 A 14 GLY H A 16 ILE H 1.0 . 5.40 797 703 A 15 ASP H A 13 GLN HBy 1.0 . 4.66 798 704 A 10 LEU HD1% A 19 ALA H 1.0 . 4.32 799 705 A 7 ILE HG2% A 19 ALA H 1.0 . 5.38 800 706 A 16 ILE HG2% A 19 ALA H 1.0 . 5.82 801 707 A 19 ALA H A 10 LEU HBx 1.0 . 5.13 802 708 A 19 ALA H A 21 GLN H 1.0 . 5.79 803 709 A 20 LEU H A 23 LEU HD1% 1.0 . 5.34 804 710 A 17 GLU H A 20 LEU H 1.0 . 5.08 805 711 A 7 ILE HD1% A 22 ALA H 1.0 . 5.68 806 712 A 22 ALA H A 23 LEU HD1% 1.0 . 5.98 807 713 A 10 LEU HD1% A 22 ALA H 1.0 . 5.21 808 714 A 7 ILE HG2% A 22 ALA H 1.0 . 5.36 809 715 A 22 ALA H A 23 LEU HG 1.0 . 5.02 810 716 A 22 ALA H A 21 GLN HE21 1.0 . 4.76 811 717 A 20 LEU H A 22 ALA H 1.0 . 5.43 812 718 A 26 PHE H A 27 LEU HB2 1.0 . 5.20 813 719 A 27 LEU H A 25 GLU HBx 1.0 . 4.98 814 719 A 25 GLU HBy A 27 LEU H 1.0 . 4.98 815 720 A 23 LEU HD2% A 27 LEU H 1.0 . 5.56 816 721 A 28 GLN H A 34 LYS HDx 1.0 . 5.59 817 721 A 28 GLN H A 34 LYS HDy 1.0 . 5.59 818 722 A 26 PHE H A 29 THR H 1.0 . 5.85 819 723 A 27 LEU H A 29 THR H 1.0 . 5.66 820 724 A 31 PRO HA A 33 GLY H 1.0 . 5.39 821 725 A 27 LEU HD2% A 34 LYS H 1.0 . 5.88 822 726 A 34 LYS H A 64 LEU HD1% 1.0 . 5.38 823 727 A 26 PHE HE% A 34 LYS H 1.0 . 5.59 824 728 A 35 ASP H A 38 TYR HD% 1.0 . 5.93 825 729 A 50 ASP H A 48 LEU HBy 1.0 . 4.91 826 730 A 37 ALA H A 40 LEU HB2 1.0 . 5.48 827 731 A 37 ALA H A 33 GLY HAx 1.0 . 5.38 828 731 A 37 ALA H A 33 GLY HAy 1.0 . 5.38 829 732 A 50 ASP H A 45 TYR HA 1.0 . 5.85 830 733 A 37 ALA H A 39 TYR H 1.0 . 5.04 831 734 A 38 TYR H A 61 ALA HB% 1.0 . 4.84 832 735 A 36 GLU H A 38 TYR H 1.0 . 5.31 833 736 A 38 TYR H A 40 LEU H 1.0 . 5.11 834 737 A 38 TYR H A 41 MET H 1.0 . 5.65 835 738 A 35 ASP H A 38 TYR H 1.0 . 6.00 836 739 A 37 ALA HB% A 40 LEU H 1.0 . 5.64 837 740 A 40 LEU H A 41 MET HGx 1.0 . 4.89 838 740 A 40 LEU H A 41 MET HGy 1.0 . 4.89 839 741 A 42 GLY H A 58 TYR H 1.0 . 5.57 840 742 A 23 LEU HD1% A 44 ALA H 1.0 . 5.70 841 743 A 44 ALA H A 47 LYS HBx 1.0 . 6.00 842 743 A 44 ALA H A 47 LYS HBy 1.0 . 6.00 843 744 A 20 LEU HD1% A 45 TYR H 1.0 . 5.93 844 745 A 45 TYR H A 48 LEU HD1% 1.0 . 5.63 845 746 A 45 TYR H A 41 MET HGx 1.0 . 6.00 846 746 A 41 MET HGy A 45 TYR H 1.0 . 6.00 847 747 A 46 ARG H A 44 ALA HA 1.0 . 5.45 848 748 A 45 TYR H A 47 LYS H 1.0 . 5.15 849 749 A 48 LEU H A 44 ALA HA 1.0 . 5.93 850 750 A 48 LEU H A 46 ARG HA 1.0 . 5.68 851 751 A 54 ALA H A 45 TYR HA 1.0 . 6.00 852 752 A 52 GLN H A 55 LEU H 1.0 . 5.45 853 753 A 56 ASN HD2y A 52 GLN HBx 1.0 . 6.00 854 753 A 52 GLN HBy A 56 ASN HD2y 1.0 . 6.00 855 754 A 56 ASN HD2y A 52 GLN HGy 1.0 . 6.00 856 755 A 56 ASN HD2y A 52 GLN HGx 1.0 . 6.00 857 756 A 55 LEU H A 58 TYR H 1.0 . 6.00 858 757 A 59 GLN HE2y A 63 GLU HA 1.0 . 6.00 859 758 A 60 SER H A 62 ILE H 1.0 . 4.62 860 759 A 61 ALA HA A 64 LEU H 1.0 . 5.72 861 760 A 67 ASP H A 66 PRO HGy 1.0 . 5.26 862 761 A 62 ILE HG12 A 68 SER H 1.0 . 6.00 863 762 A 62 ILE HG2% A 68 SER H 1.0 . 5.92 864 763 A 68 SER H A 71 LEU HD1% 1.0 . 5.68 865 764 A 70 ALA HB% A 68 SER H 1.0 . 6.00 866 765 A 68 SER H A 71 LEU HB2 1.0 . 6.00 867 766 A 62 ILE HG12 A 70 ALA H 1.0 . 5.90 868 767 A 70 ALA H A 69 PRO HGy 1.0 . 4.89 869 768 A 62 ILE HA A 70 ALA H 1.0 . 6.00 870 769 A 70 ALA H A 71 LEU HA 1.0 . 6.00 871 770 A 39 TYR HA A 70 ALA H 1.0 . 5.69 872 771 A 70 ALA H A 69 PRO HDy 1.0 . 4.74 873 772 A 73 ALA H A 71 LEU HA 1.0 . 5.60 874 773 A 74 ARG H A 58 TYR HB3 1.0 . 5.87 875 774 A 72 GLN H A 74 ARG H 1.0 . 5.07 876 775 A 73 ALA H A 75 LYS H 1.0 . 5.05 877 776 A 77 VAL H A 76 MET HBy 1.0 . 4.37 878 777 A 78 MET H A 81 LEU HD1% 1.0 . 5.49 879 778 A 80 ILE H A 76 MET HA 1.0 . 6.00 880 779 A 77 VAL HG1% A 81 LEU H 1.0 . 6.00 881 780 A 81 LEU H A 84 TYR HD% 1.0 . 5.94 882 781 A 84 TYR H A 81 LEU HA 1.0 . 4.86 883 782 A 89 TYR H A 86 LYS HA 1.0 . 4.52 884 783 A 88 MET HA A 91 GLN HE2x 1.0 . 6.00 885 784 A 9 GLU H A 12 ASN HBx 1.0 . 6.00 886 784 A 9 GLU H A 12 ASN HBy 1.0 . 6.00 887 785 A 10 LEU H A 8 LYS HA 1.0 . 5.81 888 786 A 20 LEU HG A 21 GLN H 1.0 . 4.90 889 787 A 21 GLN H A 24 GLU H 1.0 . 5.73 890 788 A 36 GLU H A 39 TYR H 1.0 . 5.67 891 789 A 37 ALA H A 40 LEU H 1.0 . 5.92 892 790 A 57 ASN HD2y A 41 MET HBx 1.0 . 6.00 893 791 A 58 TYR H A 61 ALA H 1.0 . 6.00 894 792 A 70 ALA HB% A 62 ILE H 1.0 . 4.27 895 793 A 39 TYR HD% A 71 LEU H 1.0 . 5.87 896 794 A 68 SER HG A 71 LEU H 1.0 . 5.66 897 795 A 72 GLN H A 69 PRO HA 1.0 . 4.58 898 796 A 90 ASN HD2x A 86 LYS HDx 1.0 . 5.74 899 796 A 86 LYS HDy A 90 ASN HD2x 1.0 . 5.74 900 797 A 5 LYS HDy A 2 ASP HBx 1.0 . 6.00 901 797 A 2 ASP HBx A 5 LYS HDx 1.0 . 6.00 902 798 A 5 LYS HBy A 2 ASP HBx 1.0 . 5.06 903 798 A 2 ASP HBx A 5 LYS HBx 1.0 . 5.06 904 799 A 5 LYS HDy A 2 ASP HBy 1.0 . 6.00 905 799 A 2 ASP HBy A 5 LYS HDx 1.0 . 6.00 906 800 A 5 LYS HBy A 2 ASP HBy 1.0 . 5.06 907 800 A 2 ASP HBy A 5 LYS HBx 1.0 . 5.06 908 801 A 4 LEU HD2% A 3 GLN HBx 1.0 . 5.62 909 801 A 3 GLN HBy A 4 LEU HD2% 1.0 . 5.62 910 802 A 4 LEU HD1% A 3 GLN HBx 1.0 . 5.38 911 802 A 3 GLN HBy A 4 LEU HD1% 1.0 . 5.38 912 803 A 22 ALA HB% A 3 GLN HBx 1.0 . 5.84 913 803 A 3 GLN HBy A 22 ALA HB% 1.0 . 5.84 914 804 A 3 GLN HE22 A 3 GLN HBx 1.0 . 5.34 915 804 A 3 GLN HBy A 3 GLN HE22 1.0 . 5.34 916 805 A 26 PHE HE% A 3 GLN HBx 1.0 . 5.16 917 805 A 3 GLN HBy A 26 PHE HE% 1.0 . 5.16 918 806 A 7 ILE HD1% A 3 GLN HGx 1.0 . 4.72 919 806 A 3 GLN HGy A 7 ILE HD1% 1.0 . 4.72 920 807 A 29 THR HG2% A 3 GLN HGx 1.0 . 5.23 921 807 A 3 GLN HGy A 29 THR HG2% 1.0 . 5.23 922 808 A 3 GLN HA A 3 GLN HGx 1.0 . 3.91 923 808 A 3 GLN HGy A 3 GLN HA 1.0 . 3.91 924 809 A 40 LEU HD1% A 4 LEU HA 1.0 . 4.70 925 810 A 4 LEU HB2 A 8 LYS HEx 1.0 . 6.00 926 811 A 8 LYS HEx A 4 LEU HB3 1.0 . 6.00 927 812 A 4 LEU HG A 36 GLU HBx 1.0 . 6.00 928 812 A 4 LEU HG A 36 GLU HBy 1.0 . 6.00 929 813 A 4 LEU HG A 5 LYS H 1.0 . 5.95 930 814 A 4 LEU HD1% A 4 LEU HB3 1.0 . 3.95 931 815 A 4 LEU HD1% A 4 LEU HB2 1.0 . 3.95 932 816 A 4 LEU HD1% A 36 GLU HBx 1.0 . 3.75 933 816 A 4 LEU HD1% A 36 GLU HBy 1.0 . 3.75 934 817 A 4 LEU HD1% A 36 GLU HGx 1.0 . 4.62 935 818 A 4 LEU HD1% A 33 GLY HAx 1.0 . 4.67 936 818 A 4 LEU HD1% A 33 GLY HAy 1.0 . 4.67 937 819 A 4 LEU HD1% A 26 PHE HD% 1.0 . 5.73 938 820 A 4 LEU HD1% A 26 PHE HE% 1.0 . 4.79 939 821 A 4 LEU HD1% A 26 PHE HZ 1.0 . 4.66 940 822 A 4 LEU HD2% A 7 ILE HD1% 1.0 . 3.67 941 823 A 4 LEU HD2% A 23 LEU HD2% 1.0 . 3.85 942 824 A 4 LEU HD2% A 4 LEU HB3 1.0 . 3.98 943 825 A 4 LEU HD2% A 37 ALA HB% 1.0 . 3.87 944 826 A 4 LEU HD2% A 4 LEU HB2 1.0 . 3.98 945 827 A 4 LEU HD2% A 40 LEU HB2 1.0 . 5.13 946 828 A 4 LEU HD2% A 36 GLU HBx 1.0 . 4.65 947 828 A 4 LEU HD2% A 36 GLU HBy 1.0 . 4.65 948 829 A 4 LEU HD2% A 3 GLN HGx 1.0 . 5.96 949 829 A 3 GLN HGy A 4 LEU HD2% 1.0 . 5.96 950 830 A 4 LEU HD2% A 26 PHE HBx 1.0 . 5.96 951 830 A 4 LEU HD2% A 26 PHE HBy 1.0 . 5.96 952 831 A 4 LEU HD2% A 4 LEU HA 1.0 . 3.51 953 832 A 4 LEU HD2% A 33 GLY HAx 1.0 . 5.67 954 832 A 4 LEU HD2% A 33 GLY HAy 1.0 . 5.67 955 833 A 4 LEU HD2% A 26 PHE HD% 1.0 . 4.85 956 834 A 4 LEU HD2% A 26 PHE HE% 1.0 . 4.69 957 835 A 4 LEU HD2% A 26 PHE HZ 1.0 . 5.04 958 836 A 4 LEU HD2% A 37 ALA H 1.0 . 4.99 959 837 A 4 LEU HD2% A 7 ILE H 1.0 . 5.65 960 838 A 4 LEU HD2% A 40 LEU H 1.0 . 6.00 961 839 A 40 LEU HD1% A 5 LYS HA 1.0 . 5.77 962 840 A 62 ILE HD1% A 74 ARG HA 1.0 . 6.00 963 841 A 31 PRO HB3 A 32 VAL HGx% 1.0 . 5.63 964 841 A 32 VAL HGy% A 31 PRO HB3 1.0 . 5.63 965 842 A 5 LYS HEy A 5 LYS HGx 1.0 . 3.77 966 842 A 5 LYS HEx A 5 LYS HGx 1.0 . 3.77 967 843 A 5 LYS HGy A 5 LYS HEx 1.0 . 3.77 968 843 A 5 LYS HEy A 5 LYS HGy 1.0 . 3.77 969 844 A 5 LYS HBy A 5 LYS HEx 1.0 . 4.60 970 844 A 5 LYS HEy A 5 LYS HBx 1.0 . 4.60 971 844 A 5 LYS HBy A 5 LYS HEy 1.0 . 4.60 972 844 A 5 LYS HBx A 5 LYS HEx 1.0 . 4.60 973 845 A 75 LYS HBx A 75 LYS HEx 1.0 . 4.86 974 845 A 75 LYS HBy A 75 LYS HEx 1.0 . 4.86 975 845 A 75 LYS HEy A 75 LYS HBx 1.0 . 4.86 976 845 A 75 LYS HBy A 75 LYS HEy 1.0 . 4.86 977 846 A 5 LYS H A 5 LYS HEx 1.0 . 6.00 978 846 A 5 LYS H A 5 LYS HEy 1.0 . 6.00 979 847 A 76 MET H A 75 LYS HEx 1.0 . 6.00 980 847 A 76 MET H A 75 LYS HEy 1.0 . 6.00 981 848 A 6 THR HA A 5 LYS HBx 1.0 . 5.97 982 848 A 5 LYS HBy A 6 THR HA 1.0 . 5.97 983 849 A 6 THR HA A 10 LEU HG 1.0 . 6.00 984 850 A 6 THR HA A 9 GLU HBy 1.0 . 4.85 985 851 A 6 THR HA A 9 GLU HBx 1.0 . 4.85 986 852 A 6 THR HB A 7 ILE HG13 1.0 . 4.81 987 853 A 6 THR HG2% A 10 LEU HD1% 1.0 . 3.73 988 854 A 6 THR HG2% A 7 ILE HG13 1.0 . 5.04 989 855 A 6 THR HG2% A 10 LEU HG 1.0 . 4.17 990 856 A 6 THR HG2% A 7 ILE HA 1.0 . 4.96 991 857 A 6 THR HG2% A 6 THR HA 1.0 . 3.58 992 858 A 6 THR HG2% A 9 GLU H 1.0 . 5.43 993 859 A 6 THR HG2% A 10 LEU H 1.0 . 5.01 994 860 A 6 THR HG2% A 8 LYS H 1.0 . 6.00 995 861 A 10 LEU HD1% A 7 ILE HA 1.0 . 4.16 996 862 A 19 ALA HB% A 7 ILE HA 1.0 . 5.58 997 863 A 7 ILE HA A 10 LEU HBx 1.0 . 5.42 998 864 A 10 LEU HG A 7 ILE HA 1.0 . 5.05 999 865 A 7 ILE HA A 10 LEU HBy 1.0 . 5.42 1000 866 A 7 ILE HA A 19 ALA HA 1.0 . 5.55 1001 867 A 4 LEU HD2% A 7 ILE HB 1.0 . 5.25 1002 868 A 40 LEU HD1% A 7 ILE HB 1.0 . 4.74 1003 869 A 7 ILE HB A 4 LEU HA 1.0 . 4.61 1004 870 A 80 ILE HB A 51 TRP HH2 1.0 . 6.00 1005 871 A 80 ILE HB A 84 TYR HD% 1.0 . 6.00 1006 872 A 23 LEU HA A 7 ILE HG12 1.0 . 6.00 1007 873 A 7 ILE H A 7 ILE HG12 1.0 . 5.12 1008 874 A 7 ILE HG13 A 4 LEU HA 1.0 . 6.00 1009 875 A 4 LEU HD2% A 7 ILE HG2% 1.0 . 4.85 1010 876 A 7 ILE HD1% A 7 ILE HG2% 1.0 . 3.31 1011 877 A 7 ILE HG2% A 19 ALA HB% 1.0 . 3.73 1012 878 A 7 ILE HG2% A 23 LEU HG 1.0 . 3.93 1013 879 A 7 ILE HG2% A 7 ILE HA 1.0 . 4.10 1014 880 A 7 ILE HG2% A 8 LYS HA 1.0 . 5.27 1015 881 A 7 ILE HG2% A 19 ALA HA 1.0 . 4.27 1016 882 A 6 THR HB A 7 ILE HG2% 1.0 . 5.82 1017 883 A 7 ILE HG2% A 10 LEU H 1.0 . 5.46 1018 884 A 7 ILE HG2% A 40 LEU H 1.0 . 6.00 1019 885 A 7 ILE HG2% A 44 ALA H 1.0 . 6.00 1020 886 A 7 ILE HD1% A 40 LEU HD1% 1.0 . 3.66 1021 887 A 7 ILE HD1% A 6 THR HG2% 1.0 . 4.75 1022 888 A 7 ILE HD1% A 7 ILE HB 1.0 . 3.43 1023 889 A 7 ILE HD1% A 23 LEU HG 1.0 . 3.75 1024 890 A 7 ILE HD1% A 3 GLN HBx 1.0 . 4.32 1025 890 A 3 GLN HBy A 7 ILE HD1% 1.0 . 4.32 1026 891 A 7 ILE HD1% A 26 PHE HBx 1.0 . 4.65 1027 891 A 7 ILE HD1% A 26 PHE HBy 1.0 . 4.65 1028 892 A 7 ILE HD1% A 7 ILE HA 1.0 . 4.71 1029 893 A 7 ILE HD1% A 4 LEU HA 1.0 . 3.86 1030 894 A 7 ILE HD1% A 6 THR HB 1.0 . 4.67 1031 895 A 7 ILE HD1% A 7 ILE H 1.0 . 4.33 1032 896 A 7 ILE HD1% A 26 PHE H 1.0 . 5.24 1033 897 A 40 LEU HD2% A 8 LYS HBx 1.0 . 5.16 1034 897 A 8 LYS HBy A 40 LEU HD2% 1.0 . 5.16 1035 898 A 11 ILE HD1% A 8 LYS HGy 1.0 . 5.19 1036 899 A 40 LEU HD2% A 8 LYS HGy 1.0 . 4.80 1037 900 A 40 LEU HD1% A 8 LYS HEy 1.0 . 5.03 1038 901 A 40 LEU HD1% A 8 LYS HEx 1.0 . 5.03 1039 902 A 40 LEU HD2% A 8 LYS HEx 1.0 . 5.06 1040 903 A 8 LYS HBy A 8 LYS HEx 1.0 . 5.27 1041 903 A 8 LYS HEx A 8 LYS HBx 1.0 . 5.27 1042 904 A 8 LYS HA A 8 LYS HD2 1.0 . 5.61 1043 905 A 8 LYS HA A 8 LYS HD3 1.0 . 5.61 1044 906 A 9 GLU HA A 9 GLU HGx 1.0 . 4.25 1045 907 A 9 GLU HA A 12 ASN HBx 1.0 . 3.97 1046 907 A 12 ASN HBy A 9 GLU HA 1.0 . 3.97 1047 908 A 11 ILE H A 9 GLU HA 1.0 . 5.27 1048 909 A 4 LEU HG A 3 GLN HBx 1.0 . 5.32 1049 909 A 4 LEU HG A 3 GLN HBy 1.0 . 5.32 1050 910 A 29 THR HG2% A 3 GLN HBx 1.0 . 5.97 1051 910 A 3 GLN HBy A 29 THR HG2% 1.0 . 5.97 1052 911 A 9 GLU HA A 9 GLU HGy 1.0 . 4.25 1053 912 A 10 LEU HD1% A 10 LEU HA 1.0 . 4.80 1054 913 A 10 LEU HG A 10 LEU HA 1.0 . 4.21 1055 914 A 10 LEU HD1% A 10 LEU HBx 1.0 . 4.03 1056 915 A 10 LEU HD1% A 22 ALA HB% 1.0 . 4.03 1057 916 A 10 LEU HD1% A 10 LEU HBy 1.0 . 4.03 1058 917 A 10 LEU HD1% A 18 ASN HB3 1.0 . 4.67 1059 918 A 10 LEU HD1% A 18 ASN HB2 1.0 . 4.95 1060 919 A 10 LEU HD1% A 19 ALA HA 1.0 . 4.01 1061 920 A 6 THR HB A 10 LEU HD1% 1.0 . 5.44 1062 921 A 7 ILE H A 10 LEU HD1% 1.0 . 5.48 1063 922 A 10 LEU HD2% A 10 LEU HBx 1.0 . 4.08 1064 923 A 10 LEU HD2% A 10 LEU HBy 1.0 . 4.08 1065 924 A 10 LEU HD2% A 15 ASP HBx 1.0 . 4.20 1066 925 A 10 LEU HD2% A 18 ASN HB3 1.0 . 4.36 1067 926 A 10 LEU HD2% A 18 ASN HB2 1.0 . 4.48 1068 927 A 10 LEU HD2% A 15 ASP HBy 1.0 . 4.20 1069 928 A 10 LEU HD2% A 10 LEU HA 1.0 . 3.40 1070 929 A 10 LEU HD2% A 18 ASN HA 1.0 . 6.00 1071 930 A 10 LEU HD2% A 15 ASP HA 1.0 . 5.56 1072 931 A 10 LEU HD2% A 19 ALA H 1.0 . 4.84 1073 932 A 11 ILE HA A 16 ILE HG1x 1.0 . 5.21 1074 932 A 11 ILE HA A 16 ILE HG1y 1.0 . 5.21 1075 933 A 11 ILE H A 11 ILE HG1y 1.0 . 4.82 1076 934 A 11 ILE HG2% A 11 ILE HG1x 1.0 . 4.04 1077 935 A 11 ILE HG2% A 44 ALA HB% 1.0 . 4.83 1078 936 A 11 ILE HG2% A 47 LYS HGx 1.0 . 5.51 1079 937 A 11 ILE HG2% A 11 ILE HG1y 1.0 . 4.04 1080 938 A 11 ILE HG2% A 11 ILE HA 1.0 . 3.89 1081 939 A 11 ILE HG2% A 12 ASN HA 1.0 . 4.87 1082 940 A 11 ILE HG2% A 14 GLY H 1.0 . 5.77 1083 941 A 11 ILE HD1% A 44 ALA HB% 1.0 . 4.05 1084 942 A 11 ILE HD1% A 11 ILE HB 1.0 . 3.77 1085 943 A 11 ILE HD1% A 40 LEU HG 1.0 . 5.16 1086 944 A 11 ILE HD1% A 43 ASN HBx 1.0 . 5.85 1087 945 A 11 ILE HD1% A 43 ASN HBy 1.0 . 5.85 1088 946 A 11 ILE HD1% A 11 ILE HA 1.0 . 4.82 1089 947 A 11 ILE HD1% A 40 LEU HA 1.0 . 5.09 1090 948 A 11 ILE HD1% A 41 MET HA 1.0 . 5.51 1091 949 A 11 ILE HD1% A 8 LYS HA 1.0 . 4.21 1092 950 A 11 ILE HD1% A 19 ALA HA 1.0 . 4.76 1093 951 A 8 LYS H A 11 ILE HD1% 1.0 . 5.17 1094 952 A 11 ILE HD1% A 44 ALA H 1.0 . 4.82 1095 953 A 11 ILE HD1% A 41 MET H 1.0 . 5.68 1096 954 A 13 GLN HA A 13 GLN HGx 1.0 . 4.05 1097 954 A 13 GLN HGy A 13 GLN HA 1.0 . 4.05 1098 955 A 16 ILE HG1y A 14 GLY HAx 1.0 . 5.95 1099 955 A 14 GLY HAx A 16 ILE HG1x 1.0 . 5.95 1100 956 A 16 ILE HG2% A 16 ILE HA 1.0 . 3.82 1101 957 A 16 ILE HA A 16 ILE HG1x 1.0 . 4.20 1102 957 A 16 ILE HG1y A 16 ILE HA 1.0 . 4.20 1103 958 A 16 ILE HA A 17 GLU HA 1.0 . 6.00 1104 959 A 15 ASP HA A 16 ILE HA 1.0 . 5.77 1105 960 A 16 ILE HB A 15 ASP HA 1.0 . 5.58 1106 961 A 20 LEU HD1% A 16 ILE HG1x 1.0 . 6.00 1107 961 A 16 ILE HG1y A 20 LEU HD1% 1.0 . 6.00 1108 962 A 15 ASP HA A 16 ILE HG1x 1.0 . 5.85 1109 962 A 16 ILE HG1y A 15 ASP HA 1.0 . 5.85 1110 963 A 20 LEU HD1% A 16 ILE HG2% 1.0 . 3.68 1111 964 A 16 ILE HG2% A 16 ILE HG1x 1.0 . 3.53 1112 964 A 16 ILE HG1y A 16 ILE HG2% 1.0 . 3.53 1113 965 A 16 ILE HG2% A 44 ALA HA 1.0 . 5.00 1114 966 A 16 ILE HG2% A 17 GLU HA 1.0 . 4.50 1115 967 A 16 ILE HG2% A 48 LEU HA 1.0 . 5.51 1116 968 A 16 ILE HG2% A 45 TYR HD% 1.0 . 6.00 1117 969 A 16 ILE H A 16 ILE HG2% 1.0 . 4.72 1118 970 A 16 ILE HG2% A 44 ALA H 1.0 . 6.00 1119 971 A 16 ILE HD1% A 11 ILE HG1x 1.0 . 4.36 1120 972 A 16 ILE HD1% A 44 ALA HB% 1.0 . 4.16 1121 973 A 16 ILE HD1% A 47 LYS HDx 1.0 . 4.02 1122 973 A 16 ILE HD1% A 47 LYS HDy 1.0 . 4.02 1123 974 A 16 ILE HD1% A 11 ILE HG1y 1.0 . 4.36 1124 975 A 16 ILE HD1% A 16 ILE HB 1.0 . 3.94 1125 976 A 16 ILE HD1% A 47 LYS HBx 1.0 . 4.22 1126 976 A 16 ILE HD1% A 47 LYS HBy 1.0 . 4.22 1127 977 A 16 ILE HD1% A 47 LYS HEx 1.0 . 4.53 1128 977 A 16 ILE HD1% A 47 LYS HEy 1.0 . 4.53 1129 978 A 11 ILE HA A 16 ILE HD1% 1.0 . 3.82 1130 979 A 16 ILE HD1% A 16 ILE HA 1.0 . 3.61 1131 980 A 16 ILE HD1% A 14 GLY HAx 1.0 . 4.65 1132 981 A 16 ILE HD1% A 44 ALA HA 1.0 . 4.25 1133 982 A 16 ILE HD1% A 47 LYS HA 1.0 . 5.34 1134 983 A 16 ILE HD1% A 48 LEU HA 1.0 . 5.58 1135 984 A 16 ILE HD1% A 14 GLY HAy 1.0 . 4.65 1136 985 A 16 ILE HD1% A 15 ASP HA 1.0 . 5.66 1137 986 A 16 ILE HD1% A 47 LYS H 1.0 . 5.50 1138 987 A 11 ILE H A 16 ILE HD1% 1.0 . 5.77 1139 988 A 13 GLN H A 16 ILE HD1% 1.0 . 6.00 1140 989 A 16 ILE HD1% A 45 TYR H 1.0 . 6.00 1141 990 A 16 ILE HD1% A 44 ALA H 1.0 . 6.00 1142 991 A 16 ILE HD1% A 17 GLU H 1.0 . 5.59 1143 992 A 20 LEU HB2 A 17 GLU HA 1.0 . 4.58 1144 993 A 20 LEU HG A 17 GLU HA 1.0 . 5.00 1145 994 A 20 LEU HB3 A 17 GLU HA 1.0 . 4.43 1146 995 A 20 LEU H A 17 GLU HA 1.0 . 4.94 1147 996 A 17 GLU H A 17 GLU HBx 1.0 . 4.14 1148 997 A 20 LEU HD1% A 17 GLU HGx 1.0 . 5.15 1149 997 A 20 LEU HD1% A 17 GLU HGy 1.0 . 5.15 1150 998 A 16 ILE HG2% A 17 GLU HGx 1.0 . 4.38 1151 998 A 16 ILE HG2% A 17 GLU HGy 1.0 . 4.38 1152 999 A 44 ALA HB% A 17 GLU HGx 1.0 . 6.00 1153 999 A 17 GLU HGy A 44 ALA HB% 1.0 . 6.00 1154 1000 A 16 ILE HG1y A 17 GLU HGx 1.0 . 5.66 1155 1000 A 16 ILE HG1x A 17 GLU HGx 1.0 . 5.66 1156 1000 A 17 GLU HGy A 16 ILE HG1x 1.0 . 5.66 1157 1000 A 16 ILE HG1y A 17 GLU HGy 1.0 . 5.66 1158 1001 A 17 GLU HA A 17 GLU HGx 1.0 . 3.59 1159 1001 A 17 GLU HGy A 17 GLU HA 1.0 . 3.59 1160 1002 A 18 ASN HA A 17 GLU HGx 1.0 . 6.00 1161 1002 A 17 GLU HGy A 18 ASN HA 1.0 . 6.00 1162 1003 A 21 GLN HE22 A 17 GLU HGx 1.0 . 5.69 1163 1003 A 17 GLU HGy A 21 GLN HE22 1.0 . 5.69 1164 1004 A 16 ILE H A 17 GLU HGx 1.0 . 5.59 1165 1004 A 16 ILE H A 17 GLU HGy 1.0 . 5.59 1166 1005 A 26 PHE H A 25 GLU HGx 1.0 . 5.40 1167 1006 A 19 ALA HB% A 18 ASN HB2 1.0 . 6.00 1168 1007 A 19 ALA HB% A 11 ILE HG1x 1.0 . 4.01 1169 1008 A 19 ALA HB% A 11 ILE HD1% 1.0 . 3.37 1170 1009 A 10 LEU HD2% A 19 ALA HB% 1.0 . 4.28 1171 1010 A 19 ALA HB% A 11 ILE HG1y 1.0 . 4.01 1172 1011 A 19 ALA HB% A 11 ILE HA 1.0 . 4.74 1173 1012 A 19 ALA HB% A 16 ILE HA 1.0 . 3.84 1174 1013 A 19 ALA HB% A 10 LEU HA 1.0 . 4.87 1175 1014 A 19 ALA HB% A 21 GLN H 1.0 . 5.63 1176 1015 A 19 ALA HB% A 20 LEU H 1.0 . 4.11 1177 1016 A 19 ALA HB% A 17 GLU H 1.0 . 5.66 1178 1017 A 23 LEU HD1% A 20 LEU HA 1.0 . 4.60 1179 1018 A 23 LEU H A 20 LEU HA 1.0 . 4.91 1180 1019 A 16 ILE HG2% A 20 LEU HG 1.0 . 4.91 1181 1020 A 44 ALA HB% A 20 LEU HG 1.0 . 5.10 1182 1021 A 20 LEU HD1% A 44 ALA HB% 1.0 . 4.65 1183 1022 A 20 LEU HD1% A 20 LEU HB2 1.0 . 3.97 1184 1023 A 20 LEU HD1% A 20 LEU HB3 1.0 . 3.96 1185 1024 A 20 LEU HD1% A 41 MET HE% 1.0 . 5.55 1186 1025 A 20 LEU HD1% A 17 GLU HA 1.0 . 4.21 1187 1026 A 20 LEU HD1% A 45 TYR HD% 1.0 . 6.00 1188 1027 A 20 LEU HD2% A 23 LEU HD1% 1.0 . 3.82 1189 1028 A 20 LEU HD2% A 20 LEU HB2 1.0 . 4.12 1190 1029 A 20 LEU HD2% A 20 LEU HB3 1.0 . 4.18 1191 1030 A 20 LEU HD2% A 41 MET HGx 1.0 . 5.06 1192 1030 A 20 LEU HD2% A 41 MET HGy 1.0 . 5.06 1193 1031 A 20 LEU HD2% A 41 MET HBx 1.0 . 4.62 1194 1032 A 20 LEU HD2% A 41 MET HA 1.0 . 4.76 1195 1033 A 20 LEU HD2% A 20 LEU HA 1.0 . 3.97 1196 1034 A 20 LEU HD2% A 45 TYR HA 1.0 . 5.88 1197 1035 A 20 LEU HD2% A 21 GLN H 1.0 . 5.91 1198 1036 A 20 LEU HB2 A 21 GLN HA 1.0 . 5.43 1199 1037 A 55 LEU HA A 77 VAL HG2% 1.0 . 5.66 1200 1038 A 21 GLN HA A 21 GLN HGy 1.0 . 4.14 1201 1039 A 22 ALA HB% A 21 GLN HBx 1.0 . 5.06 1202 1039 A 21 GLN HBy A 22 ALA HB% 1.0 . 5.06 1203 1040 A 18 ASN HA A 21 GLN HBx 1.0 . 4.25 1204 1040 A 18 ASN HA A 21 GLN HBy 1.0 . 4.25 1205 1041 A 23 LEU H A 21 GLN HBx 1.0 . 5.60 1206 1041 A 21 GLN HBy A 23 LEU H 1.0 . 5.60 1207 1042 A 22 ALA HB% A 21 GLN HGy 1.0 . 5.69 1208 1043 A 18 ASN HA A 21 GLN HGy 1.0 . 5.39 1209 1044 A 22 ALA HB% A 21 GLN HGx 1.0 . 5.69 1210 1045 A 21 GLN HA A 21 GLN HGx 1.0 . 4.14 1211 1046 A 18 ASN HA A 21 GLN HGx 1.0 . 5.39 1212 1047 A 22 ALA HA A 25 GLU HBx 1.0 . 4.32 1213 1047 A 25 GLU HBy A 22 ALA HA 1.0 . 4.32 1214 1048 A 7 ILE HD1% A 22 ALA HB% 1.0 . 3.55 1215 1049 A 22 ALA HB% A 7 ILE HG12 1.0 . 3.76 1216 1050 A 7 ILE HG13 A 22 ALA HB% 1.0 . 3.94 1217 1051 A 22 ALA HB% A 25 GLU HBx 1.0 . 4.31 1218 1051 A 22 ALA HB% A 25 GLU HBy 1.0 . 4.31 1219 1052 A 7 ILE HA A 22 ALA HB% 1.0 . 5.12 1220 1053 A 21 GLN H A 22 ALA HB% 1.0 . 4.78 1221 1054 A 7 ILE HD1% A 23 LEU HA 1.0 . 4.42 1222 1055 A 23 LEU HD2% A 23 LEU HA 1.0 . 3.92 1223 1056 A 23 LEU HA A 26 PHE HBx 1.0 . 4.54 1224 1056 A 26 PHE HBy A 23 LEU HA 1.0 . 4.54 1225 1057 A 27 LEU HB3 A 28 GLN HA 1.0 . 5.85 1226 1058 A 23 LEU HG A 26 PHE HBx 1.0 . 5.51 1227 1058 A 23 LEU HG A 26 PHE HBy 1.0 . 5.51 1228 1059 A 19 ALA HB% A 23 LEU HD1% 1.0 . 5.58 1229 1060 A 23 LEU HD1% A 41 MET HA 1.0 . 4.15 1230 1061 A 7 ILE HD1% A 23 LEU HD2% 1.0 . 3.61 1231 1062 A 23 LEU HD2% A 41 MET HGx 1.0 . 5.17 1232 1062 A 23 LEU HD2% A 41 MET HGy 1.0 . 5.17 1233 1063 A 23 LEU HD2% A 41 MET HA 1.0 . 4.98 1234 1064 A 23 LEU HD2% A 37 ALA HA 1.0 . 4.12 1235 1065 A 75 LYS HA A 78 MET HGx 1.0 . 5.13 1236 1066 A 25 GLU HA A 25 GLU HGx 1.0 . 4.13 1237 1067 A 27 LEU HD1% A 27 LEU HA 1.0 . 5.08 1238 1068 A 27 LEU HA A 34 LYS HDx 1.0 . 4.92 1239 1068 A 34 LYS HDy A 27 LEU HA 1.0 . 4.92 1240 1069 A 27 LEU HA A 26 PHE HA 1.0 . 5.46 1241 1070 A 27 LEU HA A 28 GLN HA 1.0 . 5.80 1242 1071 A 30 GLU H A 27 LEU HA 1.0 . 5.94 1243 1072 A 27 LEU HB2 A 24 GLU HA 1.0 . 5.30 1244 1073 A 27 LEU HB2 A 28 GLN HA 1.0 . 6.00 1245 1074 A 27 LEU HB3 A 24 GLU HA 1.0 . 5.70 1246 1075 A 27 LEU HG A 26 PHE HBx 1.0 . 5.94 1247 1075 A 26 PHE HBy A 27 LEU HG 1.0 . 5.94 1248 1076 A 27 LEU HD1% A 27 LEU HB3 1.0 . 3.98 1249 1077 A 27 LEU HD1% A 27 LEU HB2 1.0 . 4.03 1250 1078 A 27 LEU HD1% A 24 GLU HA 1.0 . 4.55 1251 1079 A 27 LEU HD1% A 38 TYR HA 1.0 . 5.57 1252 1080 A 37 ALA HB% A 27 LEU HD2% 1.0 . 3.40 1253 1081 A 27 LEU HD2% A 34 LYS HG2 1.0 . 4.66 1254 1082 A 27 LEU HD2% A 34 LYS HBx 1.0 . 5.13 1255 1083 A 27 LEU HD2% A 34 LYS HBy 1.0 . 5.13 1256 1084 A 27 LEU HD2% A 27 LEU HA 1.0 . 3.56 1257 1085 A 27 LEU HD2% A 34 LYS HA 1.0 . 4.69 1258 1086 A 27 LEU HD2% A 24 GLU HA 1.0 . 5.59 1259 1087 A 27 LEU HD2% A 26 PHE HA 1.0 . 6.00 1260 1088 A 27 LEU HD2% A 33 GLY HAx 1.0 . 6.00 1261 1088 A 27 LEU HD2% A 33 GLY HAy 1.0 . 6.00 1262 1089 A 27 LEU HD2% A 38 TYR HA 1.0 . 6.00 1263 1090 A 26 PHE HD% A 27 LEU HD2% 1.0 . 5.14 1264 1091 A 26 PHE HE% A 27 LEU HD2% 1.0 . 5.63 1265 1092 A 27 LEU HD2% A 37 ALA H 1.0 . 6.00 1266 1093 A 25 GLU HA A 28 GLN HBx 1.0 . 4.47 1267 1093 A 28 GLN HBy A 25 GLU HA 1.0 . 4.47 1268 1094 A 27 LEU HB3 A 28 GLN HGy 1.0 . 6.00 1269 1095 A 28 GLN HA A 28 GLN HGy 1.0 . 4.09 1270 1096 A 28 GLN HA A 28 GLN HGx 1.0 . 4.09 1271 1097 A 30 GLU H A 29 THR HB 1.0 . 5.28 1272 1098 A 7 ILE HD1% A 29 THR HG2% 1.0 . 5.96 1273 1099 A 29 THR HG2% A 28 GLN HBx 1.0 . 4.45 1274 1099 A 28 GLN HBy A 29 THR HG2% 1.0 . 4.45 1275 1100 A 29 THR HG2% A 25 GLU HA 1.0 . 5.33 1276 1101 A 29 THR HG2% A 26 PHE HA 1.0 . 3.32 1277 1102 A 29 THR HG2% A 29 THR HA 1.0 . 3.47 1278 1103 A 26 PHE HD% A 29 THR HG2% 1.0 . 5.59 1279 1104 A 26 PHE HD% A 30 GLU HGy 1.0 . 5.71 1280 1105 A 31 PRO HB2 A 32 VAL HA 1.0 . 5.68 1281 1106 A 32 VAL HB A 34 LYS H 1.0 . 6.00 1282 1107 A 31 PRO HB2 A 32 VAL HGx% 1.0 . 5.78 1283 1107 A 32 VAL HGy% A 31 PRO HB2 1.0 . 5.78 1284 1108 A 32 VAL HGy% A 31 PRO HD2 1.0 . 5.62 1285 1108 A 31 PRO HD2 A 32 VAL HGx% 1.0 . 5.62 1286 1109 A 32 VAL HGy% A 31 PRO HD3 1.0 . 5.62 1287 1109 A 31 PRO HD3 A 32 VAL HGx% 1.0 . 5.62 1288 1110 A 32 VAL HA A 32 VAL HGx% 1.0 . 3.18 1289 1110 A 32 VAL HGy% A 32 VAL HA 1.0 . 3.18 1290 1111 A 31 PRO HA A 32 VAL HGx% 1.0 . 4.82 1291 1111 A 32 VAL HGy% A 31 PRO HA 1.0 . 4.82 1292 1112 A 37 ALA HB% A 34 LYS HA 1.0 . 4.33 1293 1113 A 64 LEU HD1% A 34 LYS HBy 1.0 . 4.84 1294 1114 A 64 LEU HD1% A 34 LYS HBx 1.0 . 4.84 1295 1115 A 64 LEU HD1% A 34 LYS HG2 1.0 . 4.74 1296 1116 A 27 LEU HD2% A 34 LYS HG3 1.0 . 4.66 1297 1117 A 27 LEU HD2% A 34 LYS HDx 1.0 . 4.32 1298 1117 A 27 LEU HD2% A 34 LYS HDy 1.0 . 4.32 1299 1118 A 64 LEU HD1% A 34 LYS HDx 1.0 . 4.37 1300 1118 A 34 LYS HDy A 64 LEU HD1% 1.0 . 4.37 1301 1119 A 27 LEU HB3 A 34 LYS HDx 1.0 . 4.33 1302 1119 A 27 LEU HB3 A 34 LYS HDy 1.0 . 4.33 1303 1120 A 38 TYR HE% A 34 LYS HDx 1.0 . 4.76 1304 1120 A 34 LYS HDy A 38 TYR HE% 1.0 . 4.76 1305 1121 A 34 LYS H A 34 LYS HDx 1.0 . 5.18 1306 1121 A 34 LYS HDy A 34 LYS H 1.0 . 5.18 1307 1122 A 27 LEU HD2% A 34 LYS HEx 1.0 . 4.47 1308 1122 A 27 LEU HD2% A 34 LYS HEy 1.0 . 4.47 1309 1123 A 27 LEU HD1% A 34 LYS HEx 1.0 . 5.83 1310 1123 A 27 LEU HD1% A 34 LYS HEy 1.0 . 5.83 1311 1124 A 64 LEU HD1% A 34 LYS HEx 1.0 . 4.84 1312 1124 A 34 LYS HEy A 64 LEU HD1% 1.0 . 4.84 1313 1125 A 34 LYS HEx A 34 LYS HG3 1.0 . 4.12 1314 1125 A 34 LYS HEy A 34 LYS HG3 1.0 . 4.12 1315 1126 A 34 LYS HG2 A 34 LYS HEx 1.0 . 4.12 1316 1126 A 34 LYS HEy A 34 LYS HG2 1.0 . 4.12 1317 1127 A 27 LEU HA A 34 LYS HEx 1.0 . 5.31 1318 1127 A 27 LEU HA A 34 LYS HEy 1.0 . 5.31 1319 1128 A 34 LYS HA A 34 LYS HEx 1.0 . 6.00 1320 1128 A 34 LYS HEy A 34 LYS HA 1.0 . 6.00 1321 1129 A 32 VAL HA A 34 LYS HEx 1.0 . 5.18 1322 1129 A 34 LYS HEy A 32 VAL HA 1.0 . 5.18 1323 1130 A 31 PRO HA A 34 LYS HEx 1.0 . 4.98 1324 1130 A 34 LYS HEy A 31 PRO HA 1.0 . 4.98 1325 1131 A 38 TYR HD% A 35 ASP HA 1.0 . 4.95 1326 1132 A 61 ALA HA A 35 ASP HBx 1.0 . 6.00 1327 1133 A 36 GLU HA A 39 TYR HB3 1.0 . 5.46 1328 1134 A 4 LEU HD1% A 36 GLU HGy 1.0 . 4.62 1329 1135 A 4 LEU HD2% A 37 ALA HA 1.0 . 5.69 1330 1136 A 23 LEU HD1% A 37 ALA HA 1.0 . 4.97 1331 1137 A 40 LEU HD1% A 37 ALA HA 1.0 . 4.47 1332 1138 A 40 LEU HB2 A 37 ALA HA 1.0 . 5.29 1333 1139 A 37 ALA HA A 36 GLU HBx 1.0 . 5.20 1334 1139 A 36 GLU HBy A 37 ALA HA 1.0 . 5.20 1335 1140 A 40 LEU HG A 37 ALA HA 1.0 . 5.45 1336 1141 A 4 LEU HD1% A 37 ALA HB% 1.0 . 3.96 1337 1142 A 23 LEU HD2% A 37 ALA HB% 1.0 . 3.68 1338 1143 A 37 ALA HB% A 27 LEU HG 1.0 . 4.11 1339 1144 A 37 ALA HB% A 36 GLU HBx 1.0 . 4.20 1340 1144 A 37 ALA HB% A 36 GLU HBy 1.0 . 4.20 1341 1145 A 37 ALA HB% A 26 PHE HBx 1.0 . 5.37 1342 1145 A 37 ALA HB% A 26 PHE HBy 1.0 . 5.37 1343 1146 A 37 ALA HB% A 38 TYR HA 1.0 . 5.42 1344 1147 A 37 ALA HB% A 36 GLU H 1.0 . 4.87 1345 1148 A 37 ALA HB% A 35 ASP H 1.0 . 5.85 1346 1149 A 38 TYR HA A 41 MET HGx 1.0 . 4.88 1347 1149 A 41 MET HGy A 38 TYR HA 1.0 . 4.88 1348 1150 A 31 PRO HA A 34 LYS H 1.0 . 6.00 1349 1151 A 40 LEU HA A 39 TYR HD% 1.0 . 5.85 1350 1152 A 23 LEU HD1% A 40 LEU HB2 1.0 . 4.84 1351 1153 A 23 LEU HD2% A 40 LEU HB2 1.0 . 4.99 1352 1154 A 7 ILE HG2% A 40 LEU HB3 1.0 . 4.87 1353 1155 A 37 ALA HA A 40 LEU HB3 1.0 . 6.00 1354 1156 A 40 LEU HD1% A 37 ALA HB% 1.0 . 5.44 1355 1157 A 40 LEU HD1% A 36 GLU HGx 1.0 . 5.40 1356 1158 A 40 LEU HD1% A 36 GLU HGy 1.0 . 5.40 1357 1159 A 40 LEU HD1% A 40 LEU HA 1.0 . 5.18 1358 1160 A 4 LEU HD2% A 40 LEU HD2% 1.0 . 5.54 1359 1161 A 40 LEU HD2% A 40 LEU HB3 1.0 . 3.99 1360 1162 A 40 LEU HD2% A 8 LYS HGx 1.0 . 4.80 1361 1163 A 40 LEU HD2% A 40 LEU HB2 1.0 . 4.13 1362 1164 A 40 LEU HD2% A 36 GLU HGx 1.0 . 6.00 1363 1165 A 40 LEU HD2% A 36 GLU HGy 1.0 . 6.00 1364 1166 A 40 LEU HD2% A 43 ASN HBx 1.0 . 5.87 1365 1167 A 40 LEU HD2% A 8 LYS HEy 1.0 . 5.06 1366 1168 A 40 LEU HD2% A 43 ASN HBy 1.0 . 5.87 1367 1169 A 40 LEU HD2% A 40 LEU HA 1.0 . 3.66 1368 1170 A 8 LYS HA A 40 LEU HD2% 1.0 . 4.69 1369 1171 A 40 LEU HD2% A 37 ALA HA 1.0 . 5.69 1370 1172 A 8 LYS H A 40 LEU HD2% 1.0 . 5.11 1371 1173 A 40 LEU HD2% A 41 MET H 1.0 . 5.82 1372 1174 A 7 ILE HG2% A 41 MET HA 1.0 . 5.38 1373 1175 A 23 LEU HD1% A 41 MET HBx 1.0 . 4.81 1374 1176 A 23 LEU HD2% A 41 MET HBx 1.0 . 6.00 1375 1177 A 45 TYR HD% A 41 MET HBx 1.0 . 5.21 1376 1178 A 57 ASN HD2x A 41 MET HBx 1.0 . 6.00 1377 1179 A 42 GLY H A 41 MET HBx 1.0 . 5.83 1378 1180 A 20 LEU HD2% A 41 MET HBy 1.0 . 4.62 1379 1181 A 23 LEU HD1% A 41 MET HBy 1.0 . 4.81 1380 1182 A 23 LEU HD2% A 41 MET HBy 1.0 . 6.00 1381 1183 A 45 TYR HE% A 41 MET HBy 1.0 . 4.90 1382 1184 A 45 TYR HD% A 41 MET HBy 1.0 . 5.21 1383 1185 A 42 GLY H A 41 MET HBy 1.0 . 5.83 1384 1186 A 23 LEU HD1% A 41 MET HGx 1.0 . 4.80 1385 1186 A 23 LEU HD1% A 41 MET HGy 1.0 . 4.80 1386 1187 A 38 TYR HD% A 41 MET HGx 1.0 . 6.00 1387 1187 A 41 MET HGy A 38 TYR HD% 1.0 . 6.00 1388 1188 A 20 LEU HD2% A 41 MET HE% 1.0 . 3.63 1389 1189 A 23 LEU HD1% A 41 MET HE% 1.0 . 3.57 1390 1190 A 27 LEU HD1% A 41 MET HE% 1.0 . 3.68 1391 1191 A 23 LEU HD2% A 41 MET HE% 1.0 . 4.20 1392 1192 A 27 LEU HD2% A 41 MET HE% 1.0 . 4.46 1393 1193 A 44 ALA HB% A 41 MET HE% 1.0 . 5.90 1394 1194 A 27 LEU HG A 41 MET HE% 1.0 . 4.41 1395 1195 A 20 LEU HB3 A 41 MET HE% 1.0 . 4.11 1396 1196 A 41 MET HA A 41 MET HE% 1.0 . 4.66 1397 1197 A 24 GLU HA A 41 MET HE% 1.0 . 3.74 1398 1198 A 20 LEU HA A 41 MET HE% 1.0 . 4.16 1399 1199 A 38 TYR HA A 41 MET HE% 1.0 . 4.62 1400 1200 A 45 TYR HE% A 41 MET HE% 1.0 . 4.19 1401 1201 A 45 TYR HD% A 41 MET HE% 1.0 . 5.98 1402 1202 A 38 TYR HD% A 41 MET HE% 1.0 . 4.54 1403 1203 A 25 GLU H A 41 MET HE% 1.0 . 5.22 1404 1204 A 24 GLU H A 41 MET HE% 1.0 . 4.14 1405 1205 A 41 MET H A 41 MET HE% 1.0 . 4.80 1406 1206 A 23 LEU H A 41 MET HE% 1.0 . 4.71 1407 1207 A 42 GLY HAy A 57 ASN HB3 1.0 . 6.00 1408 1208 A 42 GLY HAx A 57 ASN HB3 1.0 . 6.00 1409 1209 A 54 ALA HA A 42 GLY HAx 1.0 . 4.85 1410 1210 A 40 LEU HA A 43 ASN HBy 1.0 . 5.48 1411 1211 A 40 LEU HA A 43 ASN HBx 1.0 . 5.48 1412 1212 A 20 LEU HD2% A 44 ALA HA 1.0 . 6.00 1413 1213 A 11 ILE HG2% A 44 ALA HA 1.0 . 4.34 1414 1214 A 20 LEU HD2% A 44 ALA HB% 1.0 . 3.74 1415 1215 A 16 ILE HG2% A 44 ALA HB% 1.0 . 3.56 1416 1216 A 44 ALA HB% A 41 MET HA 1.0 . 4.18 1417 1217 A 44 ALA HB% A 45 TYR HA 1.0 . 5.92 1418 1218 A 44 ALA HB% A 45 TYR HD% 1.0 . 5.93 1419 1219 A 54 ALA HB% A 46 ARG HA 1.0 . 4.90 1420 1220 A 74 ARG HBy A 58 TYR HB3 1.0 . 6.00 1421 1221 A 77 VAL HG2% A 46 ARG HDy 1.0 . 4.91 1422 1222 A 58 TYR HE% A 46 ARG HDy 1.0 . 6.00 1423 1223 A 58 TYR HE% A 46 ARG HDx 1.0 . 6.00 1424 1224 A 44 ALA HA A 47 LYS HBx 1.0 . 4.53 1425 1224 A 47 LYS HBy A 44 ALA HA 1.0 . 4.53 1426 1225 A 72 GLN HA A 75 LYS HBx 1.0 . 4.38 1427 1225 A 75 LYS HBy A 72 GLN HA 1.0 . 4.38 1428 1226 A 11 ILE HG2% A 47 LYS HDx 1.0 . 4.13 1429 1226 A 11 ILE HG2% A 47 LYS HDy 1.0 . 4.13 1430 1227 A 47 LYS HBx A 47 LYS HDx 1.0 . 3.68 1431 1227 A 47 LYS HDy A 47 LYS HBx 1.0 . 3.68 1432 1227 A 47 LYS HBy A 47 LYS HDy 1.0 . 3.68 1433 1227 A 47 LYS HBy A 47 LYS HDx 1.0 . 3.68 1434 1228 A 44 ALA HA A 47 LYS HDx 1.0 . 5.48 1435 1228 A 47 LYS HDy A 44 ALA HA 1.0 . 5.48 1436 1229 A 47 LYS HA A 47 LYS HDx 1.0 . 4.27 1437 1229 A 47 LYS HDy A 47 LYS HA 1.0 . 4.27 1438 1230 A 12 ASN HA A 47 LYS HDx 1.0 . 5.87 1439 1230 A 12 ASN HA A 47 LYS HDy 1.0 . 5.87 1440 1231 A 89 TYR HD% A 86 LYS HDx 1.0 . 5.55 1441 1231 A 86 LYS HDy A 89 TYR HD% 1.0 . 5.55 1442 1232 A 48 LEU H A 47 LYS HDx 1.0 . 6.00 1443 1232 A 48 LEU H A 47 LYS HDy 1.0 . 6.00 1444 1233 A 16 ILE H A 47 LYS HDx 1.0 . 5.83 1445 1233 A 16 ILE H A 47 LYS HDy 1.0 . 5.83 1446 1234 A 11 ILE H A 47 LYS HDx 1.0 . 6.00 1447 1234 A 11 ILE H A 47 LYS HDy 1.0 . 6.00 1448 1235 A 13 GLN H A 47 LYS HDx 1.0 . 6.00 1449 1235 A 13 GLN H A 47 LYS HDy 1.0 . 6.00 1450 1236 A 11 ILE HG2% A 47 LYS HEx 1.0 . 3.91 1451 1236 A 11 ILE HG2% A 47 LYS HEy 1.0 . 3.91 1452 1237 A 47 LYS HBx A 47 LYS HEx 1.0 . 4.12 1453 1237 A 47 LYS HBy A 47 LYS HEx 1.0 . 4.12 1454 1237 A 47 LYS HEy A 47 LYS HBx 1.0 . 4.12 1455 1237 A 47 LYS HBy A 47 LYS HEy 1.0 . 4.12 1456 1238 A 47 LYS HA A 47 LYS HEx 1.0 . 5.44 1457 1238 A 47 LYS HEy A 47 LYS HA 1.0 . 5.44 1458 1239 A 12 ASN HA A 47 LYS HEx 1.0 . 4.83 1459 1239 A 12 ASN HA A 47 LYS HEy 1.0 . 4.83 1460 1240 A 89 TYR HE% A 86 LYS HEx 1.0 . 6.00 1461 1240 A 86 LYS HEy A 89 TYR HE% 1.0 . 6.00 1462 1241 A 89 TYR H A 86 LYS HEx 1.0 . 6.00 1463 1241 A 89 TYR H A 86 LYS HEy 1.0 . 6.00 1464 1242 A 20 LEU HD1% A 48 LEU HD1% 1.0 . 3.98 1465 1243 A 48 LEU HD1% A 17 GLU HGx 1.0 . 5.36 1466 1243 A 17 GLU HGy A 48 LEU HD1% 1.0 . 5.36 1467 1244 A 48 LEU HD1% A 45 TYR HA 1.0 . 4.32 1468 1245 A 47 LYS H A 48 LEU HD1% 1.0 . 6.00 1469 1246 A 20 LEU HD1% A 48 LEU HD2% 1.0 . 4.68 1470 1247 A 48 LEU HD2% A 16 ILE HG1x 1.0 . 4.66 1471 1247 A 16 ILE HG1y A 48 LEU HD2% 1.0 . 4.66 1472 1248 A 16 ILE HB A 48 LEU HD2% 1.0 . 4.25 1473 1249 A 48 LEU HD2% A 17 GLU HGx 1.0 . 5.43 1474 1249 A 17 GLU HGy A 48 LEU HD2% 1.0 . 5.43 1475 1250 A 16 ILE HA A 48 LEU HD2% 1.0 . 6.00 1476 1251 A 48 LEU HA A 48 LEU HD2% 1.0 . 3.40 1477 1252 A 45 TYR HE% A 48 LEU HD2% 1.0 . 6.00 1478 1253 A 45 TYR HD% A 48 LEU HD2% 1.0 . 5.99 1479 1254 A 48 LEU H A 48 LEU HD2% 1.0 . 4.68 1480 1255 A 16 ILE H A 48 LEU HD2% 1.0 . 5.16 1481 1256 A 47 LYS H A 48 LEU HD2% 1.0 . 5.93 1482 1257 A 17 GLU H A 48 LEU HD2% 1.0 . 5.89 1483 1258 A 51 TRP HB3 A 51 TRP HZ3 1.0 . 5.79 1484 1259 A 81 LEU HD1% A 52 GLN HA 1.0 . 5.56 1485 1260 A 52 GLN HA A 56 ASN HBx 1.0 . 5.70 1486 1260 A 56 ASN HBy A 52 GLN HA 1.0 . 5.70 1487 1261 A 52 GLN HA A 52 GLN HE2x 1.0 . 5.23 1488 1262 A 52 GLN HE2y A 52 GLN HA 1.0 . 5.23 1489 1263 A 55 LEU H A 52 GLN HA 1.0 . 4.54 1490 1264 A 56 ASN HD2x A 52 GLN HGy 1.0 . 6.00 1491 1265 A 52 GLN H A 52 GLN HGy 1.0 . 5.03 1492 1266 A 52 GLN H A 52 GLN HGx 1.0 . 5.03 1493 1267 A 53 LYS HA A 53 LYS HDx 1.0 . 5.04 1494 1267 A 53 LYS HA A 53 LYS HDy 1.0 . 5.04 1495 1268 A 53 LYS HA A 55 LEU H 1.0 . 5.49 1496 1269 A 45 TYR HD% A 53 LYS HDx 1.0 . 5.45 1497 1269 A 45 TYR HD% A 53 LYS HDy 1.0 . 5.45 1498 1270 A 53 LYS HBx A 53 LYS HEy 1.0 . 5.55 1499 1271 A 53 LYS HBy A 53 LYS HEy 1.0 . 5.55 1500 1272 A 45 TYR HE% A 53 LYS HEy 1.0 . 5.81 1501 1273 A 53 LYS H A 53 LYS HEy 1.0 . 6.00 1502 1274 A 53 LYS HBx A 53 LYS HEx 1.0 . 5.55 1503 1275 A 53 LYS HEx A 53 LYS HBy 1.0 . 5.55 1504 1276 A 45 TYR HE% A 53 LYS HEx 1.0 . 5.81 1505 1277 A 53 LYS H A 53 LYS HEx 1.0 . 6.00 1506 1278 A 54 ALA HA A 57 ASN HB2 1.0 . 6.00 1507 1279 A 54 ALA HA A 42 GLY HAy 1.0 . 4.85 1508 1280 A 54 ALA HB% A 55 LEU HG 1.0 . 5.18 1509 1281 A 54 ALA HB% A 45 TYR HBx 1.0 . 5.26 1510 1282 A 54 ALA HB% A 45 TYR HBy 1.0 . 5.26 1511 1283 A 54 ALA HB% A 51 TRP HA 1.0 . 4.16 1512 1284 A 58 TYR HE% A 54 ALA HB% 1.0 . 4.97 1513 1285 A 45 TYR HD% A 54 ALA HB% 1.0 . 5.35 1514 1286 A 54 ALA HB% A 58 TYR HD% 1.0 . 5.61 1515 1287 A 54 ALA HB% A 51 TRP HZ3 1.0 . 5.80 1516 1288 A 55 LEU HG A 55 LEU HA 1.0 . 4.21 1517 1289 A 58 TYR HD% A 55 LEU HA 1.0 . 4.42 1518 1290 A 55 LEU HD1% A 77 VAL HB 1.0 . 6.00 1519 1291 A 55 LEU HD1% A 78 MET HGx 1.0 . 5.47 1520 1292 A 55 LEU HD1% A 78 MET HGy 1.0 . 5.47 1521 1293 A 51 TRP HB3 A 55 LEU HD1% 1.0 . 5.22 1522 1294 A 55 LEU HD1% A 52 GLN HA 1.0 . 4.21 1523 1295 A 55 LEU HD1% A 51 TRP HD1 1.0 . 6.00 1524 1296 A 55 LEU HD1% A 51 TRP HE3 1.0 . 5.59 1525 1297 A 55 LEU HD2% A 55 LEU HBx 1.0 . 4.22 1526 1298 A 55 LEU HD2% A 74 ARG HGx 1.0 . 4.36 1527 1298 A 55 LEU HD2% A 74 ARG HGy 1.0 . 4.36 1528 1299 A 55 LEU HD2% A 55 LEU HBy 1.0 . 4.22 1529 1300 A 55 LEU HD2% A 77 VAL HB 1.0 . 4.19 1530 1301 A 55 LEU HD2% A 78 MET HGx 1.0 . 4.74 1531 1302 A 55 LEU HD2% A 58 TYR HB2 1.0 . 5.47 1532 1303 A 55 LEU HD2% A 74 ARG HDy 1.0 . 5.44 1533 1304 A 55 LEU HD2% A 58 TYR HB3 1.0 . 5.47 1534 1305 A 55 LEU HD2% A 74 ARG HA 1.0 . 4.44 1535 1306 A 55 LEU HD2% A 55 LEU HA 1.0 . 3.74 1536 1307 A 55 LEU HD2% A 78 MET HA 1.0 . 4.79 1537 1308 A 55 LEU HD2% A 58 TYR HD% 1.0 . 4.43 1538 1309 A 55 LEU HD2% A 51 TRP HZ3 1.0 . 6.00 1539 1310 A 55 LEU HD2% A 89 TYR HD% 1.0 . 6.00 1540 1311 A 55 LEU HD2% A 74 ARG HE 1.0 . 6.00 1541 1312 A 55 LEU HD2% A 74 ARG H 1.0 . 6.00 1542 1313 A 55 LEU HD2% A 78 MET H 1.0 . 5.15 1543 1314 A 56 ASN HA A 59 GLN HBx 1.0 . 4.82 1544 1315 A 56 ASN HA A 59 GLN HBy 1.0 . 4.82 1545 1316 A 53 LYS HA A 56 ASN HBx 1.0 . 4.41 1546 1316 A 53 LYS HA A 56 ASN HBy 1.0 . 4.41 1547 1317 A 57 ASN HA A 60 SER HBx 1.0 . 5.54 1548 1318 A 54 ALA HA A 57 ASN HB3 1.0 . 6.00 1549 1319 A 58 TYR HB2 A 74 ARG HBx 1.0 . 6.00 1550 1320 A 74 ARG HGy A 58 TYR HB2 1.0 . 6.00 1551 1320 A 58 TYR HB2 A 74 ARG HGx 1.0 . 6.00 1552 1321 A 58 TYR HB3 A 74 ARG HBx 1.0 . 6.00 1553 1322 A 74 ARG HGy A 58 TYR HB3 1.0 . 6.00 1554 1322 A 58 TYR HB3 A 74 ARG HGx 1.0 . 6.00 1555 1323 A 62 ILE HB A 59 GLN HA 1.0 . 4.20 1556 1324 A 25 GLU HA A 25 GLU HGy 1.0 . 4.13 1557 1325 A 59 GLN H A 59 GLN HGx 1.0 . 5.08 1558 1326 A 63 GLU H A 60 SER HA 1.0 . 5.61 1559 1327 A 57 ASN HA A 60 SER HBy 1.0 . 5.54 1560 1328 A 64 LEU HD1% A 61 ALA HA 1.0 . 4.73 1561 1329 A 61 ALA HB% A 62 ILE HD1% 1.0 . 5.08 1562 1330 A 64 LEU HD1% A 61 ALA HB% 1.0 . 5.62 1563 1331 A 61 ALA HB% A 70 ALA HB% 1.0 . 3.64 1564 1332 A 61 ALA HB% A 38 TYR HB3 1.0 . 4.33 1565 1333 A 61 ALA HB% A 39 TYR HB3 1.0 . 4.74 1566 1334 A 61 ALA HB% A 39 TYR HB2 1.0 . 4.74 1567 1335 A 61 ALA HB% A 38 TYR HB2 1.0 . 4.33 1568 1336 A 61 ALA HB% A 35 ASP HA 1.0 . 4.33 1569 1337 A 61 ALA HB% A 39 TYR HA 1.0 . 4.80 1570 1338 A 61 ALA HB% A 58 TYR HA 1.0 . 4.41 1571 1339 A 61 ALA HB% A 58 TYR HD% 1.0 . 4.80 1572 1340 A 61 ALA HB% A 39 TYR HD% 1.0 . 4.92 1573 1341 A 61 ALA HB% A 68 SER HG 1.0 . 5.16 1574 1342 A 61 ALA HB% A 38 TYR HD% 1.0 . 4.87 1575 1343 A 36 GLU H A 61 ALA HB% 1.0 . 6.00 1576 1344 A 35 ASP H A 61 ALA HB% 1.0 . 6.00 1577 1345 A 62 ILE HG12 A 62 ILE HA 1.0 . 4.17 1578 1346 A 62 ILE HA A 68 SER HBy 1.0 . 5.90 1579 1347 A 62 ILE HA A 66 PRO HA 1.0 . 5.21 1580 1348 A 64 LEU H A 62 ILE HA 1.0 . 5.82 1581 1349 A 63 GLU H A 62 ILE HB 1.0 . 4.86 1582 1350 A 70 ALA HB% A 62 ILE HG12 1.0 . 5.19 1583 1351 A 62 ILE HG12 A 71 LEU HG 1.0 . 5.89 1584 1352 A 62 ILE HG12 A 71 LEU HA 1.0 . 5.76 1585 1353 A 62 ILE HG12 A 59 GLN HA 1.0 . 6.00 1586 1354 A 62 ILE H A 62 ILE HG13 1.0 . 4.61 1587 1355 A 70 ALA H A 62 ILE HG13 1.0 . 6.00 1588 1356 A 62 ILE HG2% A 71 LEU HG 1.0 . 4.27 1589 1357 A 62 ILE HG2% A 62 ILE HG13 1.0 . 4.00 1590 1358 A 62 ILE HG2% A 63 GLU HBx 1.0 . 5.11 1591 1358 A 63 GLU HBy A 62 ILE HG2% 1.0 . 5.11 1592 1359 A 62 ILE HG2% A 62 ILE HA 1.0 . 3.68 1593 1360 A 62 ILE HG2% A 59 GLN HA 1.0 . 4.64 1594 1361 A 62 ILE HG2% A 66 PRO HA 1.0 . 3.95 1595 1362 A 62 ILE HG2% A 64 LEU H 1.0 . 5.83 1596 1363 A 62 ILE HG2% A 68 SER HG 1.0 . 6.00 1597 1364 A 62 ILE HG2% A 67 ASP H 1.0 . 6.00 1598 1365 A 59 GLN HE2y A 62 ILE HG2% 1.0 . 5.29 1599 1366 A 62 ILE HD1% A 62 ILE HG2% 1.0 . 3.47 1600 1367 A 62 ILE HD1% A 71 LEU HD1% 1.0 . 3.86 1601 1368 A 70 ALA HB% A 62 ILE HD1% 1.0 . 4.00 1602 1369 A 62 ILE HD1% A 62 ILE HB 1.0 . 3.49 1603 1370 A 62 ILE HD1% A 59 GLN HBx 1.0 . 6.00 1604 1371 A 62 ILE HD1% A 59 GLN HBy 1.0 . 6.00 1605 1372 A 62 ILE HD1% A 74 ARG HDx 1.0 . 4.59 1606 1373 A 62 ILE HD1% A 71 LEU HA 1.0 . 3.66 1607 1374 A 62 ILE HD1% A 59 GLN HA 1.0 . 4.10 1608 1375 A 58 TYR HD% A 62 ILE HD1% 1.0 . 5.96 1609 1376 A 62 ILE HD1% A 74 ARG HE 1.0 . 6.00 1610 1377 A 62 ILE HD1% A 71 LEU H 1.0 . 4.80 1611 1378 A 62 ILE HD1% A 70 ALA H 1.0 . 6.00 1612 1379 A 62 ILE HG2% A 63 GLU HA 1.0 . 3.96 1613 1380 A 63 GLU HA A 63 GLU HGx 1.0 . 4.19 1614 1381 A 60 SER HA A 63 GLU HBx 1.0 . 4.31 1615 1381 A 63 GLU HBy A 60 SER HA 1.0 . 4.31 1616 1382 A 63 GLU HA A 63 GLU HGy 1.0 . 4.19 1617 1383 A 64 LEU HD1% A 64 LEU HA 1.0 . 4.91 1618 1384 A 63 GLU H A 64 LEU HG 1.0 . 5.32 1619 1385 A 64 LEU HD1% A 34 LYS HG3 1.0 . 4.74 1620 1386 A 64 LEU HD1% A 64 LEU HBx 1.0 . 4.15 1621 1387 A 64 LEU HD1% A 64 LEU HBy 1.0 . 4.15 1622 1388 A 64 LEU HD1% A 35 ASP HBx 1.0 . 5.14 1623 1389 A 64 LEU HD1% A 35 ASP HBy 1.0 . 5.14 1624 1390 A 64 LEU HD1% A 34 LYS HA 1.0 . 5.74 1625 1391 A 64 LEU HD1% A 35 ASP HA 1.0 . 4.31 1626 1392 A 37 ALA H A 64 LEU HD1% 1.0 . 6.00 1627 1393 A 64 LEU HD1% A 62 ILE H 1.0 . 6.00 1628 1394 A 64 LEU HD1% A 63 GLU H 1.0 . 6.00 1629 1395 A 64 LEU HD2% A 34 LYS HEx 1.0 . 5.45 1630 1395 A 34 LYS HEy A 64 LEU HD2% 1.0 . 5.45 1631 1396 A 64 LEU HD2% A 60 SER HA 1.0 . 6.00 1632 1397 A 64 LEU HD2% A 63 GLU HA 1.0 . 6.00 1633 1398 A 61 ALA HA A 64 LEU HD2% 1.0 . 6.00 1634 1399 A 64 LEU HD2% A 64 LEU HA 1.0 . 3.28 1635 1400 A 64 LEU HD2% A 38 TYR HE% 1.0 . 5.44 1636 1401 A 38 TYR HD% A 64 LEU HD2% 1.0 . 5.58 1637 1402 A 63 GLU H A 64 LEU HD2% 1.0 . 5.77 1638 1403 A 35 ASP H A 64 LEU HD2% 1.0 . 5.84 1639 1404 A 65 ASN HA A 66 PRO HGy 1.0 . 5.23 1640 1405 A 65 ASN HA A 66 PRO HBx 1.0 . 6.00 1641 1406 A 65 ASN HA A 66 PRO HGx 1.0 . 5.23 1642 1407 A 65 ASN HA A 66 PRO HDy 1.0 . 4.05 1643 1408 A 65 ASN HA A 66 PRO HDx 1.0 . 4.05 1644 1409 A 62 ILE HA A 68 SER HBx 1.0 . 5.90 1645 1410 A 68 SER HA A 69 PRO HGy 1.0 . 5.75 1646 1411 A 39 TYR HE% A 69 PRO HGy 1.0 . 5.84 1647 1412 A 39 TYR HD% A 69 PRO HGy 1.0 . 6.00 1648 1413 A 68 SER HA A 69 PRO HGx 1.0 . 5.75 1649 1414 A 39 TYR HE% A 69 PRO HGx 1.0 . 5.84 1650 1415 A 39 TYR HD% A 69 PRO HGx 1.0 . 6.00 1651 1416 A 68 SER HG A 69 PRO HDx 1.0 . 6.00 1652 1417 A 68 SER HG A 69 PRO HDy 1.0 . 6.00 1653 1418 A 58 TYR HD% A 70 ALA HA 1.0 . 5.67 1654 1419 A 70 ALA HB% A 62 ILE HG13 1.0 . 4.51 1655 1420 A 70 ALA HB% A 58 TYR HB2 1.0 . 4.87 1656 1421 A 70 ALA HB% A 58 TYR HB3 1.0 . 4.87 1657 1422 A 70 ALA HB% A 62 ILE HA 1.0 . 5.59 1658 1423 A 70 ALA HB% A 71 LEU HA 1.0 . 5.95 1659 1424 A 70 ALA HB% A 59 GLN HA 1.0 . 5.43 1660 1425 A 39 TYR HA A 70 ALA HB% 1.0 . 5.01 1661 1426 A 70 ALA HB% A 58 TYR HA 1.0 . 4.47 1662 1427 A 58 TYR HE% A 70 ALA HB% 1.0 . 5.15 1663 1428 A 58 TYR HD% A 70 ALA HB% 1.0 . 4.31 1664 1429 A 70 ALA HB% A 68 SER HG 1.0 . 5.22 1665 1430 A 70 ALA HB% A 72 GLN H 1.0 . 6.00 1666 1431 A 70 ALA HB% A 71 LEU H 1.0 . 5.20 1667 1432 A 39 TYR H A 70 ALA HB% 1.0 . 5.71 1668 1433 A 59 GLN H A 70 ALA HB% 1.0 . 5.52 1669 1434 A 71 LEU HA A 71 LEU HG 1.0 . 4.21 1670 1435 A 71 LEU HB3 A 72 GLN HA 1.0 . 5.64 1671 1436 A 62 ILE HG12 A 71 LEU HB2 1.0 . 5.24 1672 1437 A 62 ILE HD1% A 71 LEU HB2 1.0 . 5.67 1673 1438 A 72 GLN H A 71 LEU HG 1.0 . 5.24 1674 1439 A 71 LEU H A 71 LEU HG 1.0 . 4.46 1675 1440 A 62 ILE HG12 A 71 LEU HD1% 1.0 . 4.07 1676 1441 A 71 LEU HD1% A 71 LEU HB2 1.0 . 3.68 1677 1442 A 71 LEU HD1% A 71 LEU HB3 1.0 . 4.07 1678 1443 A 71 LEU HD1% A 75 LYS HEx 1.0 . 5.67 1679 1443 A 71 LEU HD1% A 75 LYS HEy 1.0 . 5.67 1680 1444 A 71 LEU HD1% A 71 LEU HA 1.0 . 3.64 1681 1445 A 66 PRO HA A 71 LEU HD1% 1.0 . 5.51 1682 1446 A 71 LEU HD1% A 67 ASP HA 1.0 . 5.15 1683 1447 A 71 LEU HB2 A 71 LEU HD2% 1.0 . 3.94 1684 1448 A 71 LEU HB3 A 71 LEU HD2% 1.0 . 3.71 1685 1449 A 71 LEU HD2% A 71 LEU HA 1.0 . 4.37 1686 1450 A 71 LEU H A 71 LEU HD2% 1.0 . 4.93 1687 1451 A 71 LEU HB2 A 72 GLN HGx 1.0 . 5.29 1688 1452 A 6 THR H A 3 GLN HGx 1.0 . 5.84 1689 1452 A 3 GLN HGy A 6 THR H 1.0 . 5.84 1690 1453 A 73 ALA HA A 76 MET HBy 1.0 . 4.96 1691 1454 A 73 ALA HB% A 77 VAL HG2% 1.0 . 4.80 1692 1455 A 70 ALA HB% A 73 ALA HB% 1.0 . 4.84 1693 1456 A 73 ALA HB% A 74 ARG HBx 1.0 . 5.51 1694 1457 A 73 ALA HB% A 74 ARG HBy 1.0 . 5.51 1695 1458 A 70 ALA HA A 73 ALA HB% 1.0 . 3.97 1696 1459 A 58 TYR HE% A 73 ALA HB% 1.0 . 4.49 1697 1460 A 72 GLN H A 73 ALA HB% 1.0 . 5.20 1698 1461 A 71 LEU H A 73 ALA HB% 1.0 . 5.98 1699 1462 A 70 ALA H A 73 ALA HB% 1.0 . 5.49 1700 1463 A 5 LYS HA A 8 LYS HD2 1.0 . 4.71 1701 1464 A 58 TYR HD% A 74 ARG HA 1.0 . 4.86 1702 1465 A 34 LYS HA A 38 TYR H 1.0 . 5.39 1703 1466 A 78 MET H A 74 ARG HA 1.0 . 5.32 1704 1467 A 58 TYR HB2 A 74 ARG HBy 1.0 . 6.00 1705 1468 A 58 TYR HD% A 74 ARG HGx 1.0 . 5.91 1706 1468 A 58 TYR HD% A 74 ARG HGy 1.0 . 5.91 1707 1469 A 74 ARG H A 74 ARG HGx 1.0 . 5.60 1708 1469 A 74 ARG H A 74 ARG HGy 1.0 . 5.60 1709 1470 A 62 ILE HD1% A 74 ARG HDy 1.0 . 4.59 1710 1471 A 74 ARG HA A 74 ARG HDy 1.0 . 6.00 1711 1472 A 55 LEU HA A 74 ARG HDy 1.0 . 6.00 1712 1473 A 59 GLN HA A 74 ARG HDy 1.0 . 6.00 1713 1474 A 55 LEU HD2% A 74 ARG HDx 1.0 . 5.44 1714 1475 A 74 ARG HA A 74 ARG HDx 1.0 . 6.00 1715 1476 A 55 LEU HA A 74 ARG HDx 1.0 . 6.00 1716 1477 A 59 GLN HA A 74 ARG HDx 1.0 . 6.00 1717 1478 A 78 MET H A 75 LYS HA 1.0 . 4.75 1718 1479 A 76 MET HA A 79 ASP HBx 1.0 . 5.15 1719 1480 A 76 MET HA A 79 ASP HBy 1.0 . 5.15 1720 1481 A 73 ALA HA A 76 MET HBx 1.0 . 4.96 1721 1482 A 80 ILE HD1% A 76 MET HGy 1.0 . 5.34 1722 1483 A 77 VAL H A 76 MET HGy 1.0 . 5.69 1723 1484 A 80 ILE HG2% A 76 MET HE% 1.0 . 5.41 1724 1485 A 77 VAL HG1% A 76 MET HE% 1.0 . 4.84 1725 1486 A 76 MET HE% A 76 MET HGx 1.0 . 4.44 1726 1487 A 76 MET HE% A 76 MET HGy 1.0 . 4.44 1727 1488 A 73 ALA HA A 76 MET HE% 1.0 . 4.39 1728 1489 A 76 MET HA A 76 MET HE% 1.0 . 4.91 1729 1490 A 58 TYR HD% A 76 MET HE% 1.0 . 6.00 1730 1491 A 51 TRP HH2 A 76 MET HE% 1.0 . 5.18 1731 1492 A 51 TRP HZ3 A 76 MET HE% 1.0 . 5.43 1732 1493 A 76 MET HE% A 51 TRP HZ2 1.0 . 6.00 1733 1494 A 76 MET H A 76 MET HE% 1.0 . 5.51 1734 1495 A 80 ILE H A 76 MET HE% 1.0 . 5.97 1735 1496 A 77 VAL H A 76 MET HE% 1.0 . 6.00 1736 1497 A 81 LEU H A 76 MET HE% 1.0 . 6.00 1737 1498 A 80 ILE HG2% A 77 VAL HA 1.0 . 5.91 1738 1499 A 77 VAL HA A 80 ILE HG1x 1.0 . 6.00 1739 1500 A 77 VAL HG2% A 77 VAL HA 1.0 . 4.24 1740 1501 A 80 ILE HB A 77 VAL HA 1.0 . 4.81 1741 1502 A 58 TYR HE% A 77 VAL HA 1.0 . 6.00 1742 1503 A 51 TRP HZ3 A 77 VAL HA 1.0 . 6.00 1743 1504 A 80 ILE H A 77 VAL HA 1.0 . 5.34 1744 1505 A 79 ASP H A 77 VAL HA 1.0 . 5.64 1745 1506 A 77 VAL HB A 74 ARG HA 1.0 . 5.26 1746 1507 A 58 TYR HD% A 77 VAL HB 1.0 . 5.79 1747 1508 A 77 VAL HG1% A 81 LEU HD1% 1.0 . 4.04 1748 1509 A 77 VAL HG1% A 80 ILE HD1% 1.0 . 5.26 1749 1510 A 77 VAL HG1% A 81 LEU HD2% 1.0 . 5.45 1750 1511 A 77 VAL HG1% A 81 LEU HG 1.0 . 4.63 1751 1512 A 55 LEU HG A 77 VAL HG1% 1.0 . 4.37 1752 1513 A 51 TRP HB2 A 77 VAL HG1% 1.0 . 4.82 1753 1514 A 51 TRP HB3 A 77 VAL HG1% 1.0 . 5.33 1754 1515 A 51 TRP HA A 77 VAL HG1% 1.0 . 5.55 1755 1516 A 77 VAL HG1% A 58 TYR HD% 1.0 . 5.53 1756 1517 A 58 TYR HE% A 77 VAL HG1% 1.0 . 5.94 1757 1518 A 77 VAL HG1% A 51 TRP HZ3 1.0 . 5.79 1758 1519 A 77 VAL HG2% A 80 ILE HD1% 1.0 . 5.10 1759 1520 A 77 VAL HG2% A 46 ARG HGx 1.0 . 5.27 1760 1520 A 46 ARG HGy A 77 VAL HG2% 1.0 . 5.27 1761 1521 A 77 VAL HG2% A 46 ARG HDx 1.0 . 4.91 1762 1522 A 73 ALA HA A 77 VAL HG2% 1.0 . 6.00 1763 1523 A 77 VAL HG2% A 51 TRP HZ3 1.0 . 4.87 1764 1524 A 76 MET H A 77 VAL HG2% 1.0 . 5.63 1765 1525 A 46 ARG H A 77 VAL HG2% 1.0 . 6.00 1766 1526 A 55 LEU HD2% A 78 MET HGy 1.0 . 4.74 1767 1527 A 78 MET HGy A 74 ARG HGx 1.0 . 5.12 1768 1527 A 74 ARG HGy A 78 MET HGy 1.0 . 5.12 1769 1528 A 75 LYS HA A 78 MET HGy 1.0 . 5.13 1770 1529 A 74 ARG HGx A 78 MET HGx 1.0 . 5.12 1771 1529 A 74 ARG HGy A 78 MET HGx 1.0 . 5.12 1772 1530 A 55 LEU HD1% A 78 MET HE% 1.0 . 4.19 1773 1531 A 78 MET HE% A 74 ARG HDy 1.0 . 5.53 1774 1532 A 78 MET HE% A 74 ARG HDx 1.0 . 5.53 1775 1533 A 78 MET HE% A 75 LYS HA 1.0 . 5.58 1776 1534 A 78 MET HE% A 78 MET HA 1.0 . 4.44 1777 1535 A 78 MET HE% A 89 TYR HE% 1.0 . 4.63 1778 1536 A 78 MET HE% A 79 ASP H 1.0 . 6.00 1779 1537 A 79 ASP HA A 82 ASN HBx 1.0 . 4.24 1780 1537 A 82 ASN HBy A 79 ASP HA 1.0 . 4.24 1781 1538 A 80 ILE HA A 80 ILE HD1% 1.0 . 5.24 1782 1539 A 80 ILE HA A 83 PHE HBx 1.0 . 5.07 1783 1539 A 83 PHE HBy A 80 ILE HA 1.0 . 5.07 1784 1540 A 77 VAL HG1% A 80 ILE HB 1.0 . 5.88 1785 1541 A 7 ILE HB A 19 ALA HB% 1.0 . 6.00 1786 1542 A 80 ILE HB A 81 LEU H 1.0 . 5.24 1787 1543 A 80 ILE H A 80 ILE HG1y 1.0 . 4.94 1788 1544 A 80 ILE HG2% A 80 ILE HD1% 1.0 . 3.74 1789 1545 A 80 ILE HD1% A 76 MET HGx 1.0 . 5.34 1790 1546 A 80 ILE HD1% A 77 VAL HA 1.0 . 4.28 1791 1547 A 51 TRP HH2 A 80 ILE HD1% 1.0 . 4.70 1792 1548 A 80 ILE H A 80 ILE HD1% 1.0 . 4.65 1793 1549 A 81 LEU H A 80 ILE HD1% 1.0 . 5.30 1794 1550 A 80 ILE HG2% A 81 LEU HA 1.0 . 5.51 1795 1551 A 81 LEU HD2% A 81 LEU HA 1.0 . 4.07 1796 1552 A 81 LEU HB2 A 78 MET HA 1.0 . 5.54 1797 1553 A 78 MET H A 81 LEU HB2 1.0 . 5.63 1798 1554 A 78 MET HA A 81 LEU HB3 1.0 . 5.94 1799 1555 A 88 MET HE% A 81 LEU HD1% 1.0 . 5.41 1800 1556 A 51 TRP HB3 A 81 LEU HD1% 1.0 . 5.42 1801 1557 A 51 TRP HB2 A 81 LEU HD1% 1.0 . 5.73 1802 1558 A 81 LEU HD1% A 81 LEU HA 1.0 . 5.47 1803 1559 A 81 LEU HD1% A 78 MET HA 1.0 . 5.08 1804 1560 A 81 LEU HD2% A 80 ILE HG2% 1.0 . 4.81 1805 1561 A 51 TRP HB3 A 81 LEU HD2% 1.0 . 5.40 1806 1562 A 51 TRP HB2 A 81 LEU HD2% 1.0 . 5.68 1807 1563 A 81 LEU HD2% A 51 TRP HZ3 1.0 . 6.00 1808 1564 A 81 LEU HD2% A 89 TYR HD% 1.0 . 6.00 1809 1565 A 81 LEU HD2% A 51 TRP HD1 1.0 . 4.89 1810 1566 A 81 LEU HD2% A 80 ILE H 1.0 . 6.00 1811 1567 A 81 LEU HD2% A 85 ASN HD2y 1.0 . 6.00 1812 1568 A 84 TYR HD% A 83 PHE HBx 1.0 . 6.00 1813 1568 A 83 PHE HBy A 84 TYR HD% 1.0 . 6.00 1814 1569 A 81 LEU HD2% A 84 TYR HBx 1.0 . 6.00 1815 1570 A 81 LEU HD2% A 84 TYR HBy 1.0 . 6.00 1816 1571 A 86 LYS H A 85 ASN HBx 1.0 . 5.26 1817 1572 A 86 LYS HA A 89 TYR HBx 1.0 . 4.99 1818 1573 A 86 LYS HA A 89 TYR HBy 1.0 . 4.99 1819 1574 A 86 LYS HDy A 86 LYS HGx 1.0 . 2.81 1820 1574 A 86 LYS HDx A 86 LYS HGx 1.0 . 2.81 1821 1574 A 86 LYS HGy A 86 LYS HDx 1.0 . 2.81 1822 1574 A 86 LYS HGy A 86 LYS HDy 1.0 . 2.81 1823 1575 A 86 LYS HA A 86 LYS HDx 1.0 . 4.32 1824 1575 A 86 LYS HDy A 86 LYS HA 1.0 . 4.32 1825 1576 A 87 ASP H A 86 LYS HDx 1.0 . 6.00 1826 1576 A 86 LYS HDy A 87 ASP H 1.0 . 6.00 1827 1577 A 86 LYS HEx A 86 LYS HGx 1.0 . 3.54 1828 1577 A 86 LYS HEy A 86 LYS HGx 1.0 . 3.54 1829 1577 A 86 LYS HGy A 86 LYS HEx 1.0 . 3.54 1830 1577 A 86 LYS HGy A 86 LYS HEy 1.0 . 3.54 1831 1578 A 86 LYS HBy A 86 LYS HEx 1.0 . 4.13 1832 1578 A 86 LYS HEy A 86 LYS HBx 1.0 . 4.13 1833 1578 A 86 LYS HBy A 86 LYS HEy 1.0 . 4.13 1834 1578 A 86 LYS HBx A 86 LYS HEx 1.0 . 4.13 1835 1579 A 88 MET HA A 88 MET HGx 1.0 . 4.05 1836 1579 A 88 MET HGy A 88 MET HA 1.0 . 4.05 1837 1580 A 33 GLY H A 31 PRO HB3 1.0 . 6.00 1838 1581 A 88 MET HE% A 81 LEU HD2% 1.0 . 4.83 1839 1582 A 78 MET HE% A 81 LEU HD1% 1.0 . 4.71 1840 1583 A 92 LEU HG A 89 TYR HA 1.0 . 6.00 1841 1584 A 11 ILE HG2% A 12 ASN HBx 1.0 . 6.00 1842 1584 A 11 ILE HG2% A 12 ASN HBy 1.0 . 6.00 1843 1585 A 91 GLN HA A 91 GLN HGx 1.0 . 4.09 1844 1585 A 91 GLN HGy A 91 GLN HA 1.0 . 4.09 1845 1586 A 92 LEU HA A 92 LEU HDy% 1.0 . 4.68 1846 1587 A 89 TYR HA A 92 LEU HBy 1.0 . 5.95 1847 1588 A 92 LEU HDx% A 92 LEU HBx 1.0 . 4.13 1848 1589 A 89 TYR HA A 92 LEU HBx 1.0 . 5.95 1849 1590 A 92 LEU HG A 93 GLU H 1.0 . 5.36 1850 1591 A 92 LEU HBy A 92 LEU HDx% 1.0 . 4.13 1851 1592 A 92 LEU HA A 92 LEU HDx% 1.0 . 4.68 1852 1593 A 92 LEU HBx A 92 LEU HDy% 1.0 . 4.13 1853 1594 A 92 LEU HBy A 92 LEU HDy% 1.0 . 4.13 1854 1595 A 93 GLU H A 92 LEU HDy% 1.0 . 5.42 1855 1596 A 94 HIS H A 93 GLU HGy 1.0 . 5.88 1856 1597 A 94 HIS H A 93 GLU HGx 1.0 . 5.88 1857 1598 A 88 MET HE% A 77 VAL HG1% 1.0 . 5.54 1858 1599 A 88 MET HE% A 88 MET HGx 1.0 . 4.00 1859 1599 A 88 MET HE% A 88 MET HGy 1.0 . 4.00 1860 1600 A 88 MET HE% A 88 MET HA 1.0 . 5.08 1861 1601 A 88 MET HE% A 89 TYR HA 1.0 . 5.38 1862 1602 A 88 MET HE% A 52 GLN HE2x 1.0 . 5.55 1863 1603 A 88 MET HE% A 51 TRP HD1 1.0 . 4.67 1864 1604 A 88 MET H A 88 MET HE% 1.0 . 5.59 1865 1605 A 88 MET HE% A 81 LEU H 1.0 . 6.00 1866 1606 A 88 MET HE% A 92 LEU H 1.0 . 6.00 1867 1607 A 88 MET HE% A 87 ASP H 1.0 . 6.00 1868 1608 A 3 GLN HBx A 26 PHE HBx 1.0 . 6.00 1869 1608 A 3 GLN HBy A 26 PHE HBx 1.0 . 6.00 1870 1608 A 26 PHE HBy A 3 GLN HBx 1.0 . 6.00 1871 1608 A 3 GLN HBy A 26 PHE HBy 1.0 . 6.00 1872 1609 A 22 ALA HB% A 3 GLN HGx 1.0 . 5.47 1873 1609 A 3 GLN HGy A 22 ALA HB% 1.0 . 5.47 1874 1610 A 4 LEU HB2 A 8 LYS HEy 1.0 . 6.00 1875 1611 A 4 LEU HG A 7 ILE HD1% 1.0 . 5.85 1876 1612 A 4 LEU HD1% A 8 LYS HEx 1.0 . 6.00 1877 1613 A 4 LEU HD1% A 8 LYS HEy 1.0 . 6.00 1878 1614 A 4 LEU HD1% A 4 LEU HA 1.0 . 4.43 1879 1615 A 4 LEU HD2% A 40 LEU HD1% 1.0 . 3.50 1880 1616 A 5 LYS HA A 5 LYS HEx 1.0 . 6.00 1881 1616 A 5 LYS HA A 5 LYS HEy 1.0 . 6.00 1882 1617 A 8 LYS HBy A 8 LYS HEy 1.0 . 5.27 1883 1617 A 8 LYS HBx A 8 LYS HEy 1.0 . 5.27 1884 1618 A 5 LYS HBx A 5 LYS HDx 1.0 . 3.70 1885 1618 A 5 LYS HBy A 5 LYS HDx 1.0 . 3.70 1886 1618 A 5 LYS HDy A 5 LYS HBx 1.0 . 3.70 1887 1618 A 5 LYS HBy A 5 LYS HDy 1.0 . 3.70 1888 1619 A 5 LYS H A 5 LYS HDx 1.0 . 5.68 1889 1619 A 5 LYS H A 5 LYS HDy 1.0 . 5.68 1890 1620 A 6 THR HA A 5 LYS HDx 1.0 . 6.00 1891 1620 A 5 LYS HDy A 6 THR HA 1.0 . 6.00 1892 1621 A 7 ILE HG13 A 6 THR HA 1.0 . 6.00 1893 1622 A 6 THR HG2% A 10 LEU HD2% 1.0 . 4.03 1894 1623 A 10 LEU HD2% A 7 ILE HA 1.0 . 4.73 1895 1624 A 7 ILE HB A 23 LEU HD2% 1.0 . 5.04 1896 1625 A 80 ILE HB A 76 MET HE% 1.0 . 6.00 1897 1626 A 6 THR HB A 7 ILE HB 1.0 . 6.00 1898 1627 A 51 TRP HZ3 A 80 ILE HD1% 1.0 . 4.99 1899 1628 A 11 ILE HB A 8 LYS HA 1.0 . 4.22 1900 1629 A 11 ILE HD1% A 8 LYS HGx 1.0 . 5.19 1901 1630 A 5 LYS HA A 8 LYS HD3 1.0 . 4.71 1902 1631 A 4 LEU HB3 A 8 LYS HEy 1.0 . 6.00 1903 1632 A 5 LYS HA A 8 LYS HEy 1.0 . 6.00 1904 1633 A 5 LYS HA A 8 LYS HEx 1.0 . 6.00 1905 1634 A 10 LEU H A 9 GLU HBx 1.0 . 4.55 1906 1635 A 5 LYS HDy A 9 GLU HGx 1.0 . 6.00 1907 1635 A 5 LYS HDx A 9 GLU HGx 1.0 . 6.00 1908 1636 A 9 GLU HGy A 5 LYS HDx 1.0 . 6.00 1909 1636 A 5 LYS HDy A 9 GLU HGy 1.0 . 6.00 1910 1637 A 10 LEU HD1% A 18 ASN HA 1.0 . 6.00 1911 1638 A 10 LEU HD1% A 11 ILE H 1.0 . 5.21 1912 1639 A 10 LEU HD1% A 23 LEU H 1.0 . 6.00 1913 1640 A 11 ILE HG2% A 16 ILE HG1x 1.0 . 5.76 1914 1640 A 11 ILE HG2% A 16 ILE HG1y 1.0 . 5.76 1915 1641 A 19 ALA HB% A 11 ILE HG2% 1.0 . 6.00 1916 1642 A 11 ILE HG2% A 16 ILE HA 1.0 . 5.71 1917 1643 A 11 ILE HG2% A 8 LYS HA 1.0 . 4.89 1918 1644 A 7 ILE HA A 11 ILE HD1% 1.0 . 6.00 1919 1645 A 11 ILE HB A 12 ASN HBx 1.0 . 6.00 1920 1645 A 11 ILE HB A 12 ASN HBy 1.0 . 6.00 1921 1646 A 12 ASN HBx A 13 GLN HGx 1.0 . 5.00 1922 1646 A 12 ASN HBy A 13 GLN HGx 1.0 . 5.00 1923 1646 A 13 GLN HGy A 12 ASN HBx 1.0 . 5.00 1924 1646 A 12 ASN HBy A 13 GLN HGy 1.0 . 5.00 1925 1647 A 16 ILE HG1y A 14 GLY HAy 1.0 . 5.95 1926 1647 A 14 GLY HAy A 16 ILE HG1x 1.0 . 5.95 1927 1648 A 16 ILE HA A 44 ALA HB% 1.0 . 5.52 1928 1649 A 44 ALA HB% A 16 ILE HG1x 1.0 . 5.21 1929 1649 A 16 ILE HG1y A 44 ALA HB% 1.0 . 5.21 1930 1650 A 16 ILE HG2% A 48 LEU HG 1.0 . 4.11 1931 1651 A 44 ALA HB% A 20 LEU HA 1.0 . 5.88 1932 1652 A 20 LEU HB3 A 23 LEU HD1% 1.0 . 5.45 1933 1653 A 16 ILE HG2% A 20 LEU HB3 1.0 . 5.21 1934 1654 A 20 LEU HB3 A 45 TYR HE% 1.0 . 6.00 1935 1655 A 20 LEU HB2 A 17 GLU HGx 1.0 . 5.98 1936 1655 A 17 GLU HGy A 20 LEU HB2 1.0 . 5.98 1937 1656 A 16 ILE HB A 20 LEU HD1% 1.0 . 4.96 1938 1657 A 27 LEU HB3 A 28 GLN HGx 1.0 . 6.00 1939 1658 A 20 LEU HD2% A 23 LEU HD2% 1.0 . 6.00 1940 1659 A 23 LEU HD2% A 26 PHE HBx 1.0 . 6.00 1941 1659 A 23 LEU HD2% A 26 PHE HBy 1.0 . 6.00 1942 1660 A 26 PHE H A 25 GLU HGy 1.0 . 5.40 1943 1661 A 25 GLU H A 26 PHE HBx 1.0 . 6.00 1944 1661 A 25 GLU H A 26 PHE HBy 1.0 . 6.00 1945 1662 A 29 THR HG2% A 27 LEU HA 1.0 . 5.11 1946 1663 A 27 LEU HD1% A 26 PHE HD% 1.0 . 6.00 1947 1664 A 29 THR HG2% A 30 GLU HGx 1.0 . 6.00 1948 1665 A 29 THR HG2% A 30 GLU HGy 1.0 . 6.00 1949 1666 A 26 PHE HE% A 30 GLU HGx 1.0 . 6.00 1950 1667 A 81 LEU HD2% A 88 MET HBx 1.0 . 5.88 1951 1667 A 88 MET HBy A 81 LEU HD2% 1.0 . 5.88 1952 1668 A 30 GLU HA A 31 PRO HG2 1.0 . 6.00 1953 1669 A 30 GLU HA A 31 PRO HG3 1.0 . 6.00 1954 1670 A 34 LYS H A 32 VAL HA 1.0 . 5.41 1955 1671 A 32 VAL HB A 31 PRO HB2 1.0 . 5.26 1956 1672 A 32 VAL HB A 31 PRO HA 1.0 . 5.79 1957 1673 A 32 VAL HGx% A 33 GLY HAx 1.0 . 4.90 1958 1673 A 32 VAL HGy% A 33 GLY HAx 1.0 . 4.90 1959 1673 A 33 GLY HAy A 32 VAL HGx% 1.0 . 4.90 1960 1673 A 32 VAL HGy% A 33 GLY HAy 1.0 . 4.90 1961 1674 A 27 LEU HD1% A 34 LYS HDx 1.0 . 5.38 1962 1674 A 27 LEU HD1% A 34 LYS HDy 1.0 . 5.38 1963 1675 A 31 PRO HA A 34 LYS HDx 1.0 . 6.00 1964 1675 A 34 LYS HDy A 31 PRO HA 1.0 . 6.00 1965 1676 A 36 GLU HA A 39 TYR HB2 1.0 . 5.46 1966 1677 A 40 LEU HD1% A 36 GLU HBx 1.0 . 5.05 1967 1677 A 40 LEU HD1% A 36 GLU HBy 1.0 . 5.05 1968 1678 A 37 ALA HA A 41 MET HGx 1.0 . 6.00 1969 1678 A 37 ALA HA A 41 MET HGy 1.0 . 6.00 1970 1679 A 39 TYR HA A 58 TYR HD% 1.0 . 4.85 1971 1680 A 19 ALA HB% A 40 LEU HB3 1.0 . 6.00 1972 1681 A 44 ALA HB% A 23 LEU HD1% 1.0 . 4.35 1973 1682 A 48 LEU H A 45 TYR HA 1.0 . 5.41 1974 1683 A 76 MET HE% A 46 ARG HDy 1.0 . 6.00 1975 1684 A 76 MET HE% A 46 ARG HDx 1.0 . 6.00 1976 1685 A 16 ILE HD1% A 47 LYS HGx 1.0 . 5.96 1977 1686 A 11 ILE HG2% A 47 LYS HGy 1.0 . 5.51 1978 1687 A 16 ILE HD1% A 47 LYS HGy 1.0 . 5.96 1979 1688 A 44 ALA HB% A 48 LEU HD2% 1.0 . 5.01 1980 1689 A 47 LYS HA A 48 LEU HD2% 1.0 . 6.00 1981 1690 A 49 GLY H A 48 LEU HD2% 1.0 . 5.61 1982 1691 A 50 ASP H A 48 LEU HD2% 1.0 . 5.98 1983 1692 A 54 ALA HB% A 51 TRP HB2 1.0 . 6.00 1984 1693 A 54 ALA HB% A 52 GLN H 1.0 . 6.00 1985 1694 A 55 LEU HA A 58 TYR HB3 1.0 . 5.34 1986 1695 A 55 LEU HA A 58 TYR HB2 1.0 . 5.34 1987 1696 A 55 LEU HD1% A 81 LEU HD1% 1.0 . 3.73 1988 1697 A 55 LEU HD1% A 77 VAL HG1% 1.0 . 4.07 1989 1698 A 51 TRP HB2 A 55 LEU HD1% 1.0 . 5.86 1990 1699 A 55 LEU HD1% A 78 MET HA 1.0 . 5.42 1991 1700 A 55 LEU HD2% A 77 VAL HG1% 1.0 . 3.96 1992 1701 A 55 LEU HD2% A 77 VAL HG2% 1.0 . 4.58 1993 1702 A 55 LEU HD2% A 81 LEU HG 1.0 . 4.49 1994 1703 A 55 LEU H A 56 ASN HBx 1.0 . 5.93 1995 1703 A 55 LEU H A 56 ASN HBy 1.0 . 5.93 1996 1704 A 57 ASN HB2 A 42 GLY HAx 1.0 . 6.00 1997 1705 A 57 ASN HB2 A 42 GLY HAy 1.0 . 6.00 1998 1706 A 60 SER HA A 59 GLN HBx 1.0 . 6.00 1999 1707 A 60 SER HA A 59 GLN HBy 1.0 . 6.00 2000 1708 A 61 ALA HA A 35 ASP HBy 1.0 . 6.00 2001 1709 A 61 ALA HA A 35 ASP HA 1.0 . 4.43 2002 1710 A 61 ALA HB% A 71 LEU HD1% 1.0 . 5.82 2003 1711 A 61 ALA H A 62 ILE HA 1.0 . 6.00 2004 1712 A 62 ILE HB A 63 GLU HBx 1.0 . 5.74 2005 1712 A 63 GLU HBy A 62 ILE HB 1.0 . 5.74 2006 1713 A 62 ILE HB A 71 LEU HD1% 1.0 . 6.00 2007 1714 A 62 ILE HG12 A 71 LEU HD2% 1.0 . 5.16 2008 1715 A 63 GLU HA A 64 LEU HA 1.0 . 5.67 2009 1716 A 59 GLN HE2x A 63 GLU HA 1.0 . 6.00 2010 1717 A 65 ASN HA A 66 PRO HBy 1.0 . 6.00 2011 1718 A 61 ALA HB% A 70 ALA HA 1.0 . 6.00 2012 1719 A 62 ILE HG12 A 71 LEU HB3 1.0 . 6.00 2013 1720 A 62 ILE HD1% A 71 LEU HB3 1.0 . 6.00 2014 1721 A 71 LEU HB3 A 72 GLN HBx 1.0 . 5.84 2015 1722 A 71 LEU HB3 A 72 GLN HBy 1.0 . 5.84 2016 1723 A 66 PRO HA A 71 LEU HD2% 1.0 . 5.71 2017 1724 A 71 LEU HD2% A 67 ASP HA 1.0 . 5.29 2018 1725 A 72 GLN HA A 75 LYS HEx 1.0 . 6.00 2019 1725 A 72 GLN HA A 75 LYS HEy 1.0 . 6.00 2020 1726 A 73 ALA H A 72 GLN HGy 1.0 . 5.59 2021 1727 A 71 LEU HB2 A 72 GLN HGy 1.0 . 5.29 2022 1728 A 73 ALA HB% A 74 ARG HA 1.0 . 5.16 2023 1729 A 71 LEU HD2% A 75 LYS HEx 1.0 . 5.64 2024 1729 A 71 LEU HD2% A 75 LYS HEy 1.0 . 5.64 2025 1730 A 77 VAL HA A 80 ILE HG1y 1.0 . 6.00 2026 1731 A 81 LEU HG A 77 VAL HA 1.0 . 6.00 2027 1732 A 81 LEU H A 77 VAL HA 1.0 . 6.00 2028 1733 A 77 VAL HG2% A 76 MET HBy 1.0 . 5.62 2029 1734 A 77 VAL HG2% A 76 MET HBx 1.0 . 5.62 2030 1735 A 77 VAL HG1% A 78 MET HE% 1.0 . 5.50 2031 1736 A 77 VAL HG1% A 80 ILE HG2% 1.0 . 6.00 2032 1737 A 51 TRP HB3 A 80 ILE HG2% 1.0 . 6.00 2033 1738 A 51 TRP H A 81 LEU HD2% 1.0 . 6.00 2034 1739 A 81 LEU HD2% A 85 ASN HD2x 1.0 . 6.00 2035 1740 A 84 TYR H A 82 ASN HBx 1.0 . 5.44 2036 1740 A 84 TYR H A 82 ASN HBy 1.0 . 5.44 2037 1741 A 7 ILE H A 19 ALA HB% 1.0 . 5.60 2038 1742 A 4 LEU HG A 26 PHE HD% 1.0 . 6.00 2039 1743 A 7 ILE HD1% A 26 PHE HD% 1.0 . 5.09 2040 1744 A 23 LEU HD2% A 26 PHE HD% 1.0 . 5.46 2041 1745 A 37 ALA HB% A 26 PHE HD% 1.0 . 3.98 2042 1746 A 26 PHE HD% A 27 LEU HG 1.0 . 5.19 2043 1747 A 26 PHE HD% A 3 GLN HBx 1.0 . 4.91 2044 1747 A 3 GLN HBy A 26 PHE HD% 1.0 . 4.91 2045 1748 A 26 PHE HD% A 27 LEU HA 1.0 . 5.00 2046 1749 A 23 LEU HA A 26 PHE HD% 1.0 . 5.54 2047 1750 A 26 PHE HD% A 34 LYS HA 1.0 . 5.99 2048 1751 A 26 PHE HD% A 26 PHE HA 1.0 . 4.35 2049 1752 A 26 PHE HD% A 26 PHE HZ 1.0 . 4.17 2050 1753 A 4 LEU HG A 26 PHE HE% 1.0 . 5.13 2051 1754 A 26 PHE HE% A 37 ALA HB% 1.0 . 4.12 2052 1755 A 26 PHE HE% A 30 GLU HGy 1.0 . 6.00 2053 1756 A 26 PHE HE% A 34 LYS HA 1.0 . 4.60 2054 1757 A 26 PHE HE% A 33 GLY HAx 1.0 . 5.16 2055 1757 A 26 PHE HE% A 33 GLY HAy 1.0 . 5.16 2056 1758 A 80 ILE HA A 83 PHE HD% 1.0 . 5.16 2057 1759 A 83 PHE HD% A 83 PHE HA 1.0 . 4.30 2058 1760 A 83 PHE H A 83 PHE HD% 1.0 . 4.96 2059 1761 A 84 TYR H A 83 PHE HD% 1.0 . 5.00 2060 1762 A 27 LEU HD2% A 38 TYR HD% 1.0 . 4.91 2061 1763 A 27 LEU HD1% A 38 TYR HD% 1.0 . 4.64 2062 1764 A 64 LEU HD1% A 38 TYR HD% 1.0 . 3.81 2063 1765 A 38 TYR HD% A 60 SER HBx 1.0 . 5.33 2064 1766 A 38 TYR HD% A 60 SER HBy 1.0 . 5.33 2065 1767 A 61 ALA HA A 38 TYR HD% 1.0 . 4.85 2066 1768 A 38 TYR HA A 38 TYR HD% 1.0 . 3.35 2067 1769 A 38 TYR HD% A 61 ALA H 1.0 . 4.71 2068 1770 A 38 TYR H A 38 TYR HD% 1.0 . 4.18 2069 1771 A 39 TYR H A 38 TYR HD% 1.0 . 5.17 2070 1772 A 27 LEU HD2% A 38 TYR HE% 1.0 . 3.96 2071 1773 A 27 LEU HD1% A 38 TYR HE% 1.0 . 3.75 2072 1774 A 64 LEU HD1% A 38 TYR HE% 1.0 . 3.44 2073 1775 A 27 LEU HB3 A 38 TYR HE% 1.0 . 5.89 2074 1776 A 37 ALA HB% A 38 TYR HE% 1.0 . 6.00 2075 1777 A 41 MET HE% A 38 TYR HE% 1.0 . 4.07 2076 1778 A 38 TYR HE% A 34 LYS HEx 1.0 . 4.80 2077 1778 A 34 LYS HEy A 38 TYR HE% 1.0 . 4.80 2078 1779 A 38 TYR HA A 38 TYR HE% 1.0 . 4.29 2079 1780 A 40 LEU HD2% A 39 TYR HD% 1.0 . 4.17 2080 1781 A 39 TYR HD% A 73 ALA HB% 1.0 . 4.35 2081 1782 A 70 ALA HB% A 39 TYR HD% 1.0 . 3.80 2082 1783 A 40 LEU HG A 39 TYR HD% 1.0 . 4.30 2083 1784 A 39 TYR HD% A 70 ALA HA 1.0 . 4.01 2084 1785 A 39 TYR HA A 39 TYR HD% 1.0 . 3.86 2085 1786 A 39 TYR H A 39 TYR HD% 1.0 . 4.46 2086 1787 A 40 LEU H A 39 TYR HD% 1.0 . 4.72 2087 1788 A 40 LEU HD2% A 39 TYR HE% 1.0 . 3.92 2088 1789 A 39 TYR HE% A 73 ALA HB% 1.0 . 3.34 2089 1790 A 70 ALA HB% A 39 TYR HE% 1.0 . 4.53 2090 1791 A 39 TYR HE% A 70 ALA HA 1.0 . 3.91 2091 1792 A 39 TYR HE% A 43 ASN HD2x 1.0 . 4.70 2092 1793 A 39 TYR HE% A 43 ASN HD2y 1.0 . 4.70 2093 1794 A 39 TYR HE% A 73 ALA H 1.0 . 4.80 2094 1795 A 70 ALA H A 39 TYR HE% 1.0 . 5.30 2095 1796 A 20 LEU HD2% A 45 TYR HD% 1.0 . 4.64 2096 1797 A 45 TYR HD% A 53 LYS HBx 1.0 . 4.98 2097 1798 A 45 TYR HD% A 53 LYS HBy 1.0 . 4.98 2098 1799 A 45 TYR HD% A 48 LEU HD1% 1.0 . 4.07 2099 1800 A 45 TYR HD% A 50 ASP HBx 1.0 . 4.27 2100 1801 A 45 TYR HD% A 50 ASP HBy 1.0 . 4.27 2101 1802 A 45 TYR HD% A 45 TYR HA 1.0 . 3.71 2102 1803 A 45 TYR HD% A 45 TYR H 1.0 . 4.28 2103 1804 A 20 LEU HD2% A 45 TYR HE% 1.0 . 3.75 2104 1805 A 20 LEU HD1% A 45 TYR HE% 1.0 . 3.97 2105 1806 A 45 TYR HE% A 48 LEU HD1% 1.0 . 4.17 2106 1807 A 45 TYR HE% A 53 LYS HDx 1.0 . 3.67 2107 1807 A 45 TYR HE% A 53 LYS HDy 1.0 . 3.67 2108 1808 A 45 TYR HE% A 41 MET HGx 1.0 . 4.38 2109 1808 A 41 MET HGy A 45 TYR HE% 1.0 . 4.38 2110 1809 A 45 TYR HE% A 41 MET HBx 1.0 . 4.90 2111 1810 A 45 TYR HE% A 45 TYR HA 1.0 . 4.66 2112 1811 A 58 TYR HD% A 58 TYR HA 1.0 . 4.54 2113 1812 A 80 ILE HG2% A 84 TYR HD% 1.0 . 3.99 2114 1813 A 81 LEU HD2% A 84 TYR HD% 1.0 . 4.51 2115 1814 A 81 LEU HD1% A 84 TYR HD% 1.0 . 5.37 2116 1815 A 81 LEU HG A 84 TYR HD% 1.0 . 5.07 2117 1816 A 80 ILE HA A 84 TYR HD% 1.0 . 5.05 2118 1817 A 84 TYR HD% A 81 LEU HA 1.0 . 4.71 2119 1818 A 84 TYR HD% A 84 TYR HA 1.0 . 3.58 2120 1819 A 84 TYR H A 84 TYR HD% 1.0 . 4.06 2121 1820 A 80 ILE HG2% A 84 TYR HE% 1.0 . 3.99 2122 1821 A 80 ILE HD1% A 84 TYR HE% 1.0 . 4.78 2123 1822 A 58 TYR HE% A 55 LEU HG 1.0 . 6.00 2124 1823 A 39 TYR HA A 58 TYR HE% 1.0 . 4.31 2125 1824 A 51 TRP HZ2 A 84 TYR HE% 1.0 . 4.16 2126 1825 A 81 LEU HD1% A 89 TYR HD% 1.0 . 4.82 2127 1826 A 89 TYR HD% A 86 LYS HBx 1.0 . 4.48 2128 1826 A 86 LYS HBy A 89 TYR HD% 1.0 . 4.48 2129 1827 A 78 MET HE% A 89 TYR HD% 1.0 . 4.75 2130 1828 A 86 LYS HA A 89 TYR HD% 1.0 . 4.48 2131 1829 A 89 TYR HD% A 89 TYR HA 1.0 . 3.45 2132 1830 A 90 ASN HA A 89 TYR HD% 1.0 . 4.29 2133 1831 A 89 TYR H A 89 TYR HD% 1.0 . 3.87 2134 1832 A 80 ILE HG2% A 51 TRP HZ3 1.0 . 5.46 2135 1833 A 51 TRP HZ3 A 46 ARG HGx 1.0 . 4.42 2136 1833 A 46 ARG HGy A 51 TRP HZ3 1.0 . 4.42 2137 1834 A 46 ARG HA A 51 TRP HZ3 1.0 . 4.91 2138 1835 A 51 TRP HA A 51 TRP HZ3 1.0 . 5.40 2139 1836 A 81 LEU HD1% A 51 TRP HD1 1.0 . 5.41 2140 1837 A 51 TRP HA A 51 TRP HD1 1.0 . 4.78 2141 1838 A 51 TRP H A 51 TRP HD1 1.0 . 4.44 2142 1839 A 80 ILE HG2% A 51 TRP HH2 1.0 . 5.23 2143 1840 A 81 LEU HD2% A 51 TRP HE3 1.0 . 5.35 2144 1841 A 81 LEU HD1% A 51 TRP HE3 1.0 . 5.18 2145 1842 A 77 VAL HG1% A 51 TRP HE3 1.0 . 4.03 2146 1843 A 77 VAL HG2% A 51 TRP HE3 1.0 . 4.53 2147 1844 A 54 ALA HB% A 51 TRP HE3 1.0 . 4.58 2148 1845 A 51 TRP HA A 51 TRP HE3 1.0 . 3.85 2149 1846 A 80 ILE HG2% A 51 TRP HZ2 1.0 . 5.21 2150 1847 A 80 ILE HD1% A 51 TRP HZ2 1.0 . 4.93 2151 1848 A 46 ARG HA A 51 TRP HZ2 1.0 . 6.00 2152 1849 A 26 PHE HD% A 30 GLU HGx 1.0 . 5.71 2153 1850 A 80 ILE HB A 51 TRP HZ3 1.0 . 5.27 2154 1851 A 46 ARG HA A 51 TRP HE3 1.0 . 5.42 2155 1852 A 61 ALA HA A 38 TYR HE% 1.0 . 5.42 2156 1853 A 36 GLU HA A 39 TYR HD% 1.0 . 4.66 2157 1854 A 58 TYR HD% A 77 VAL HG2% 1.0 . 5.41 2158 1855 A 55 LEU HD1% A 89 TYR HD% 1.0 . 5.13 2159 1856 A 38 TYR HE% A 41 MET HGx 1.0 . 6.00 2160 1856 A 41 MET HGy A 38 TYR HE% 1.0 . 6.00 2161 1857 A 38 TYR H A 38 TYR HE% 1.0 . 5.23 2162 1858 A 58 TYR HE% A 77 VAL HG2% 1.0 . 4.17 2163 1859 A 2 ASP HBx A 4 LEU HB3 1.0 . 4.96 2164 1859 A 2 ASP HBy A 4 LEU HB3 1.0 . 4.96 2165 1859 A 4 LEU HB2 A 2 ASP HBy 1.0 . 4.96 2166 1859 A 2 ASP HBx A 4 LEU HB2 1.0 . 4.96 2167 1860 A 5 LYS H A 2 ASP HBy 1.0 . 5.22 2168 1860 A 5 LYS H A 2 ASP HBx 1.0 . 5.22 2169 1861 A 2 ASP HBx A 5 LYS HBx 1.0 . 4.26 2170 1861 A 2 ASP HBy A 5 LYS HBx 1.0 . 4.26 2171 1861 A 5 LYS HBy A 2 ASP HBy 1.0 . 4.26 2172 1861 A 5 LYS HBy A 2 ASP HBx 1.0 . 4.26 2173 1862 A 2 ASP HBy A 5 LYS HGx 1.0 . 5.53 2174 1862 A 5 LYS HGy A 2 ASP HBy 1.0 . 5.53 2175 1862 A 2 ASP HBx A 5 LYS HGy 1.0 . 5.53 2176 1862 A 2 ASP HBx A 5 LYS HGx 1.0 . 5.53 2177 1863 A 3 GLN HE21 A 4 LEU H 1.0 . 4.76 2178 1863 A 4 LEU H A 3 GLN HE22 1.0 . 4.76 2179 1864 A 22 ALA HB% A 3 GLN HE22 1.0 . 5.21 2180 1864 A 3 GLN HE21 A 22 ALA HB% 1.0 . 5.21 2181 1865 A 3 GLN HE21 A 25 GLU HBx 1.0 . 4.88 2182 1865 A 3 GLN HE21 A 25 GLU HBy 1.0 . 4.88 2183 1865 A 25 GLU HBy A 3 GLN HE22 1.0 . 4.88 2184 1865 A 3 GLN HE22 A 25 GLU HBx 1.0 . 4.88 2185 1866 A 3 GLN HE21 A 26 PHE HA 1.0 . 4.89 2186 1866 A 26 PHE HA A 3 GLN HE22 1.0 . 4.89 2187 1867 A 4 LEU H A 4 LEU HB3 1.0 . 3.42 2188 1867 A 4 LEU H A 4 LEU HB2 1.0 . 3.42 2189 1868 A 4 LEU HD1% A 4 LEU HB3 1.0 . 3.40 2190 1868 A 4 LEU HD1% A 4 LEU HB2 1.0 . 3.40 2191 1869 A 5 LYS H A 4 LEU HB3 1.0 . 3.83 2192 1869 A 5 LYS H A 4 LEU HB2 1.0 . 3.83 2193 1870 A 7 ILE HB A 4 LEU HB3 1.0 . 5.55 2194 1870 A 7 ILE HB A 4 LEU HB2 1.0 . 5.55 2195 1871 A 4 LEU HB2 A 8 LYS HEy 1.0 . 4.35 2196 1871 A 8 LYS HEx A 4 LEU HB3 1.0 . 4.35 2197 1871 A 4 LEU HB2 A 8 LYS HEx 1.0 . 4.35 2198 1871 A 4 LEU HB3 A 8 LYS HEy 1.0 . 4.35 2199 1872 A 4 LEU HB3 A 36 GLU HBx 1.0 . 5.81 2200 1872 A 4 LEU HB2 A 36 GLU HBx 1.0 . 5.81 2201 1872 A 36 GLU HBy A 4 LEU HB3 1.0 . 5.81 2202 1872 A 36 GLU HBy A 4 LEU HB2 1.0 . 5.81 2203 1873 A 4 LEU HB2 A 36 GLU HGx 1.0 . 4.74 2204 1873 A 4 LEU HB3 A 36 GLU HGx 1.0 . 4.74 2205 1873 A 36 GLU HGy A 4 LEU HB3 1.0 . 4.74 2206 1873 A 4 LEU HB2 A 36 GLU HGy 1.0 . 4.74 2207 1874 A 40 LEU HG A 4 LEU HB3 1.0 . 5.81 2208 1874 A 40 LEU HG A 4 LEU HB2 1.0 . 5.81 2209 1875 A 40 LEU HD1% A 4 LEU HB3 1.0 . 4.54 2210 1875 A 40 LEU HD1% A 4 LEU HB2 1.0 . 4.54 2211 1876 A 4 LEU HD1% A 36 GLU HGx 1.0 . 3.96 2212 1876 A 4 LEU HD1% A 36 GLU HGy 1.0 . 3.96 2213 1877 A 4 LEU HD2% A 36 GLU HGx 1.0 . 5.34 2214 1877 A 4 LEU HD2% A 36 GLU HGy 1.0 . 5.34 2215 1878 A 5 LYS H A 8 LYS HD3 1.0 . 5.81 2216 1878 A 5 LYS H A 8 LYS HD2 1.0 . 5.81 2217 1879 A 5 LYS HA A 8 LYS HD3 1.0 . 3.98 2218 1879 A 5 LYS HA A 8 LYS HD2 1.0 . 3.98 2219 1880 A 5 LYS HEy A 5 LYS HGx 1.0 . 3.18 2220 1880 A 5 LYS HGy A 5 LYS HEx 1.0 . 3.18 2221 1880 A 5 LYS HEy A 5 LYS HGy 1.0 . 3.18 2222 1880 A 5 LYS HEx A 5 LYS HGx 1.0 . 3.18 2223 1881 A 6 THR H A 5 LYS HGx 1.0 . 4.62 2224 1881 A 6 THR H A 5 LYS HGy 1.0 . 4.62 2225 1882 A 6 THR HA A 5 LYS HGx 1.0 . 4.84 2226 1882 A 6 THR HA A 5 LYS HGy 1.0 . 4.84 2227 1883 A 5 LYS HGx A 9 GLU HGx 1.0 . 4.45 2228 1883 A 9 GLU HGy A 5 LYS HGx 1.0 . 4.45 2229 1883 A 5 LYS HGy A 9 GLU HGy 1.0 . 4.45 2230 1883 A 5 LYS HGy A 9 GLU HGx 1.0 . 4.45 2231 1884 A 5 LYS HEx A 9 GLU HGx 1.0 . 5.81 2232 1884 A 9 GLU HGy A 5 LYS HEx 1.0 . 5.81 2233 1884 A 5 LYS HEy A 9 GLU HGy 1.0 . 5.81 2234 1884 A 5 LYS HEy A 9 GLU HGx 1.0 . 5.81 2235 1885 A 6 THR HA A 9 GLU HBy 1.0 . 4.14 2236 1885 A 6 THR HA A 9 GLU HBx 1.0 . 4.14 2237 1886 A 6 THR HA A 9 GLU HGx 1.0 . 5.12 2238 1886 A 6 THR HA A 9 GLU HGy 1.0 . 5.12 2239 1887 A 6 THR HG2% A 9 GLU HBy 1.0 . 4.57 2240 1887 A 6 THR HG2% A 9 GLU HBx 1.0 . 4.57 2241 1888 A 6 THR HG2% A 10 LEU HBx 1.0 . 5.51 2242 1888 A 6 THR HG2% A 10 LEU HBy 1.0 . 5.51 2243 1889 A 7 ILE HA A 10 LEU HBx 1.0 . 4.64 2244 1889 A 7 ILE HA A 10 LEU HBy 1.0 . 4.64 2245 1890 A 7 ILE HA A 11 ILE HG1y 1.0 . 5.81 2246 1890 A 7 ILE HA A 11 ILE HG1x 1.0 . 5.81 2247 1891 A 7 ILE HB A 8 LYS HGx 1.0 . 5.78 2248 1891 A 7 ILE HB A 8 LYS HGy 1.0 . 5.78 2249 1892 A 7 ILE HG2% A 10 LEU HBx 1.0 . 5.01 2250 1892 A 7 ILE HG2% A 10 LEU HBy 1.0 . 5.01 2251 1893 A 7 ILE HG2% A 23 LEU HB3 1.0 . 5.62 2252 1893 A 7 ILE HG2% A 23 LEU HB2 1.0 . 5.62 2253 1894 A 7 ILE HG2% A 41 MET HBy 1.0 . 5.81 2254 1894 A 7 ILE HG2% A 41 MET HBx 1.0 . 5.81 2255 1895 A 8 LYS H A 8 LYS HGx 1.0 . 3.72 2256 1895 A 8 LYS H A 8 LYS HGy 1.0 . 3.72 2257 1896 A 8 LYS H A 8 LYS HD3 1.0 . 5.05 2258 1896 A 8 LYS H A 8 LYS HD2 1.0 . 5.05 2259 1897 A 8 LYS H A 8 LYS HEy 1.0 . 5.76 2260 1897 A 8 LYS H A 8 LYS HEx 1.0 . 5.76 2261 1898 A 8 LYS HBy A 8 LYS HEy 1.0 . 4.64 2262 1898 A 8 LYS HBx A 8 LYS HEy 1.0 . 4.64 2263 1898 A 8 LYS HEx A 8 LYS HBx 1.0 . 4.64 2264 1898 A 8 LYS HBy A 8 LYS HEx 1.0 . 4.64 2265 1899 A 11 ILE HD1% A 8 LYS HGx 1.0 . 4.45 2266 1899 A 11 ILE HD1% A 8 LYS HGy 1.0 . 4.45 2267 1900 A 40 LEU HD1% A 8 LYS HGx 1.0 . 4.50 2268 1900 A 40 LEU HD1% A 8 LYS HGy 1.0 . 4.50 2269 1901 A 40 LEU HD2% A 8 LYS HGx 1.0 . 4.08 2270 1901 A 40 LEU HD2% A 8 LYS HGy 1.0 . 4.08 2271 1902 A 40 LEU HD1% A 8 LYS HD3 1.0 . 5.81 2272 1902 A 40 LEU HD1% A 8 LYS HD2 1.0 . 5.81 2273 1903 A 40 LEU HD2% A 8 LYS HD3 1.0 . 4.79 2274 1903 A 40 LEU HD2% A 8 LYS HD2 1.0 . 4.79 2275 1904 A 8 LYS HEy A 36 GLU HBx 1.0 . 5.81 2276 1904 A 36 GLU HBy A 8 LYS HEy 1.0 . 5.81 2277 1904 A 36 GLU HBy A 8 LYS HEx 1.0 . 5.81 2278 1904 A 8 LYS HEx A 36 GLU HBx 1.0 . 5.81 2279 1905 A 40 LEU HG A 8 LYS HEy 1.0 . 5.81 2280 1905 A 40 LEU HG A 8 LYS HEx 1.0 . 5.81 2281 1906 A 40 LEU HD1% A 8 LYS HEy 1.0 . 4.26 2282 1906 A 40 LEU HD1% A 8 LYS HEx 1.0 . 4.26 2283 1907 A 9 GLU HA A 12 ASN HD2y 1.0 . 4.21 2284 1907 A 9 GLU HA A 12 ASN HD2x 1.0 . 4.21 2285 1908 A 10 LEU H A 9 GLU HBy 1.0 . 3.71 2286 1908 A 10 LEU H A 9 GLU HBx 1.0 . 3.71 2287 1909 A 10 LEU HA A 9 GLU HBy 1.0 . 4.71 2288 1909 A 10 LEU HA A 9 GLU HBx 1.0 . 4.71 2289 1910 A 10 LEU HD1% A 9 GLU HBy 1.0 . 5.54 2290 1910 A 10 LEU HD1% A 9 GLU HBx 1.0 . 5.54 2291 1911 A 10 LEU HD2% A 9 GLU HBy 1.0 . 4.81 2292 1911 A 10 LEU HD2% A 9 GLU HBx 1.0 . 4.81 2293 1912 A 9 GLU HBy A 12 ASN HBx 1.0 . 5.73 2294 1912 A 9 GLU HBx A 12 ASN HBx 1.0 . 5.73 2295 1912 A 12 ASN HBy A 9 GLU HBy 1.0 . 5.73 2296 1912 A 12 ASN HBy A 9 GLU HBx 1.0 . 5.73 2297 1913 A 13 GLN HE21 A 9 GLU HBy 1.0 . 5.14 2298 1913 A 13 GLN HE21 A 9 GLU HBx 1.0 . 5.14 2299 1914 A 13 GLN HE22 A 9 GLU HBy 1.0 . 4.81 2300 1914 A 13 GLN HE22 A 9 GLU HBx 1.0 . 4.81 2301 1915 A 10 LEU H A 9 GLU HGx 1.0 . 4.48 2302 1915 A 10 LEU H A 9 GLU HGy 1.0 . 4.48 2303 1916 A 9 GLU HGy A 12 ASN HBx 1.0 . 5.57 2304 1916 A 9 GLU HGx A 12 ASN HBx 1.0 . 5.57 2305 1916 A 12 ASN HBy A 9 GLU HGx 1.0 . 5.57 2306 1916 A 12 ASN HBy A 9 GLU HGy 1.0 . 5.57 2307 1917 A 13 GLN HE22 A 9 GLU HGx 1.0 . 5.36 2308 1917 A 13 GLN HE22 A 9 GLU HGy 1.0 . 5.36 2309 1918 A 10 LEU H A 10 LEU HBx 1.0 . 3.42 2310 1918 A 10 LEU H A 10 LEU HBy 1.0 . 3.42 2311 1919 A 10 LEU H A 11 ILE HG1y 1.0 . 5.81 2312 1919 A 10 LEU H A 11 ILE HG1x 1.0 . 5.81 2313 1920 A 10 LEU HA A 15 ASP HBx 1.0 . 4.66 2314 1920 A 10 LEU HA A 15 ASP HBy 1.0 . 4.66 2315 1921 A 11 ILE H A 10 LEU HBx 1.0 . 3.85 2316 1921 A 11 ILE H A 10 LEU HBy 1.0 . 3.85 2317 1922 A 15 ASP H A 10 LEU HBx 1.0 . 5.70 2318 1922 A 15 ASP H A 10 LEU HBy 1.0 . 5.70 2319 1923 A 10 LEU HBy A 15 ASP HBx 1.0 . 4.67 2320 1923 A 10 LEU HBx A 15 ASP HBx 1.0 . 4.67 2321 1923 A 15 ASP HBy A 10 LEU HBx 1.0 . 4.67 2322 1923 A 10 LEU HBy A 15 ASP HBy 1.0 . 4.67 2323 1924 A 18 ASN HB2 A 10 LEU HBx 1.0 . 5.81 2324 1924 A 18 ASN HB2 A 10 LEU HBy 1.0 . 5.81 2325 1925 A 18 ASN HB3 A 10 LEU HBx 1.0 . 5.79 2326 1925 A 18 ASN HB3 A 10 LEU HBy 1.0 . 5.79 2327 1926 A 19 ALA H A 10 LEU HBx 1.0 . 4.52 2328 1926 A 19 ALA H A 10 LEU HBy 1.0 . 4.52 2329 1927 A 19 ALA HA A 10 LEU HBx 1.0 . 5.81 2330 1927 A 19 ALA HA A 10 LEU HBy 1.0 . 5.81 2331 1928 A 19 ALA HB% A 10 LEU HBx 1.0 . 4.04 2332 1928 A 19 ALA HB% A 10 LEU HBy 1.0 . 4.04 2333 1929 A 10 LEU HG A 15 ASP HBx 1.0 . 5.71 2334 1929 A 10 LEU HG A 15 ASP HBy 1.0 . 5.71 2335 1930 A 10 LEU HD1% A 15 ASP HBx 1.0 . 5.05 2336 1930 A 10 LEU HD1% A 15 ASP HBy 1.0 . 5.05 2337 1931 A 10 LEU HD1% A 18 ASN HD2x 1.0 . 4.83 2338 1931 A 10 LEU HD1% A 18 ASN HD2y 1.0 . 4.83 2339 1932 A 10 LEU HD2% A 13 GLN HBy 1.0 . 4.87 2340 1932 A 10 LEU HD2% A 13 GLN HBx 1.0 . 4.87 2341 1933 A 10 LEU HD2% A 15 ASP HBx 1.0 . 3.58 2342 1933 A 10 LEU HD2% A 15 ASP HBy 1.0 . 3.58 2343 1934 A 11 ILE H A 11 ILE HG1y 1.0 . 4.05 2344 1934 A 11 ILE H A 11 ILE HG1x 1.0 . 4.05 2345 1935 A 11 ILE HG2% A 43 ASN HBx 1.0 . 5.12 2346 1935 A 11 ILE HG2% A 43 ASN HBy 1.0 . 5.12 2347 1936 A 11 ILE HG2% A 47 LYS HGy 1.0 . 4.77 2348 1936 A 11 ILE HG2% A 47 LYS HGx 1.0 . 4.77 2349 1937 A 16 ILE HA A 11 ILE HG1y 1.0 . 5.46 2350 1937 A 16 ILE HA A 11 ILE HG1x 1.0 . 5.46 2351 1938 A 19 ALA H A 11 ILE HG1y 1.0 . 5.15 2352 1938 A 19 ALA H A 11 ILE HG1x 1.0 . 5.15 2353 1939 A 19 ALA HB% A 11 ILE HG1y 1.0 . 3.51 2354 1939 A 19 ALA HB% A 11 ILE HG1x 1.0 . 3.51 2355 1940 A 44 ALA HA A 11 ILE HG1y 1.0 . 5.81 2356 1940 A 44 ALA HA A 11 ILE HG1x 1.0 . 5.81 2357 1941 A 44 ALA HB% A 11 ILE HG1y 1.0 . 4.99 2358 1941 A 44 ALA HB% A 11 ILE HG1x 1.0 . 4.99 2359 1942 A 11 ILE HD1% A 43 ASN HBx 1.0 . 5.05 2360 1942 A 11 ILE HD1% A 43 ASN HBy 1.0 . 5.05 2361 1943 A 11 ILE HD1% A 43 ASN HD2y 1.0 . 5.70 2362 1943 A 11 ILE HD1% A 43 ASN HD2x 1.0 . 5.70 2363 1944 A 12 ASN HD2y A 12 ASN HA 1.0 . 4.91 2364 1944 A 12 ASN HD2x A 12 ASN HA 1.0 . 4.91 2365 1945 A 12 ASN HBy A 12 ASN HD2y 1.0 . 3.35 2366 1945 A 12 ASN HBy A 12 ASN HD2x 1.0 . 3.35 2367 1945 A 12 ASN HD2x A 12 ASN HBx 1.0 . 3.35 2368 1945 A 12 ASN HD2y A 12 ASN HBx 1.0 . 3.35 2369 1946 A 12 ASN HBy A 13 GLN HBy 1.0 . 5.07 2370 1946 A 12 ASN HBx A 13 GLN HBy 1.0 . 5.07 2371 1946 A 13 GLN HBx A 12 ASN HBx 1.0 . 5.07 2372 1946 A 12 ASN HBy A 13 GLN HBx 1.0 . 5.07 2373 1947 A 13 GLN H A 13 GLN HBy 1.0 . 3.35 2374 1947 A 13 GLN H A 13 GLN HBx 1.0 . 3.35 2375 1948 A 13 GLN H A 14 GLY HAx 1.0 . 5.30 2376 1948 A 13 GLN H A 14 GLY HAy 1.0 . 5.30 2377 1949 A 13 GLN HE21 A 13 GLN HBy 1.0 . 4.49 2378 1949 A 13 GLN HE21 A 13 GLN HBx 1.0 . 4.49 2379 1950 A 13 GLN HE22 A 13 GLN HBy 1.0 . 4.50 2380 1950 A 13 GLN HE22 A 13 GLN HBx 1.0 . 4.50 2381 1951 A 14 GLY H A 13 GLN HBy 1.0 . 4.39 2382 1951 A 14 GLY H A 13 GLN HBx 1.0 . 4.39 2383 1952 A 13 GLN HBx A 15 ASP HBx 1.0 . 5.61 2384 1952 A 13 GLN HBy A 15 ASP HBx 1.0 . 5.61 2385 1952 A 15 ASP HBy A 13 GLN HBy 1.0 . 5.61 2386 1952 A 15 ASP HBy A 13 GLN HBx 1.0 . 5.61 2387 1953 A 13 GLN HE21 A 15 ASP HBx 1.0 . 4.53 2388 1953 A 13 GLN HE21 A 15 ASP HBy 1.0 . 4.53 2389 1954 A 13 GLN HE22 A 15 ASP HBx 1.0 . 4.69 2390 1954 A 13 GLN HE22 A 15 ASP HBy 1.0 . 4.69 2391 1955 A 14 GLY H A 15 ASP HBx 1.0 . 5.13 2392 1955 A 14 GLY H A 15 ASP HBy 1.0 . 5.13 2393 1956 A 16 ILE H A 14 GLY HAx 1.0 . 5.27 2394 1956 A 16 ILE H A 14 GLY HAy 1.0 . 5.27 2395 1957 A 14 GLY HAy A 16 ILE HG1x 1.0 . 5.13 2396 1957 A 14 GLY HAx A 16 ILE HG1x 1.0 . 5.13 2397 1957 A 16 ILE HG1y A 14 GLY HAx 1.0 . 5.13 2398 1957 A 16 ILE HG1y A 14 GLY HAy 1.0 . 5.13 2399 1958 A 16 ILE HD1% A 14 GLY HAx 1.0 . 4.03 2400 1958 A 16 ILE HD1% A 14 GLY HAy 1.0 . 4.03 2401 1959 A 14 GLY HAx A 47 LYS HDx 1.0 . 5.81 2402 1959 A 14 GLY HAy A 47 LYS HDx 1.0 . 5.81 2403 1959 A 47 LYS HDy A 14 GLY HAx 1.0 . 5.81 2404 1959 A 47 LYS HDy A 14 GLY HAy 1.0 . 5.81 2405 1960 A 18 ASN HB3 A 15 ASP HBx 1.0 . 5.47 2406 1960 A 18 ASN HB3 A 15 ASP HBy 1.0 . 5.47 2407 1961 A 18 ASN HD2x A 15 ASP HBy 1.0 . 5.61 2408 1961 A 18 ASN HD2y A 15 ASP HBy 1.0 . 5.61 2409 1961 A 18 ASN HD2y A 15 ASP HBx 1.0 . 5.61 2410 1961 A 18 ASN HD2x A 15 ASP HBx 1.0 . 5.61 2411 1962 A 19 ALA HB% A 15 ASP HBx 1.0 . 5.81 2412 1962 A 19 ALA HB% A 15 ASP HBy 1.0 . 5.81 2413 1963 A 16 ILE HD1% A 47 LYS HGy 1.0 . 5.10 2414 1963 A 16 ILE HD1% A 47 LYS HGx 1.0 . 5.10 2415 1964 A 17 GLU H A 17 GLU HBy 1.0 . 3.34 2416 1964 A 17 GLU H A 17 GLU HBx 1.0 . 3.34 2417 1965 A 18 ASN HA A 17 GLU HBy 1.0 . 5.70 2418 1965 A 18 ASN HA A 17 GLU HBx 1.0 . 5.70 2419 1966 A 19 ALA H A 17 GLU HBy 1.0 . 5.81 2420 1966 A 19 ALA H A 17 GLU HBx 1.0 . 5.81 2421 1967 A 18 ASN HB2 A 18 ASN HD2x 1.0 . 3.55 2422 1967 A 18 ASN HB2 A 18 ASN HD2y 1.0 . 3.55 2423 1968 A 19 ALA H A 18 ASN HD2x 1.0 . 5.51 2424 1968 A 19 ALA H A 18 ASN HD2y 1.0 . 5.51 2425 1969 A 20 LEU H A 23 LEU HB3 1.0 . 5.81 2426 1969 A 20 LEU H A 23 LEU HB2 1.0 . 5.81 2427 1970 A 20 LEU HA A 23 LEU HB3 1.0 . 4.41 2428 1970 A 20 LEU HA A 23 LEU HB2 1.0 . 4.41 2429 1971 A 20 LEU HD1% A 45 TYR HBy 1.0 . 5.81 2430 1971 A 20 LEU HD1% A 45 TYR HBx 1.0 . 5.81 2431 1972 A 20 LEU HD2% A 23 LEU HB3 1.0 . 5.76 2432 1972 A 20 LEU HD2% A 23 LEU HB2 1.0 . 5.76 2433 1973 A 20 LEU HD2% A 41 MET HBy 1.0 . 4.06 2434 1973 A 20 LEU HD2% A 41 MET HBx 1.0 . 4.06 2435 1974 A 20 LEU HD2% A 57 ASN HD2y 1.0 . 5.81 2436 1974 A 20 LEU HD2% A 57 ASN HD2x 1.0 . 5.81 2437 1975 A 21 GLN H A 21 GLN HGx 1.0 . 3.83 2438 1975 A 21 GLN H A 21 GLN HGy 1.0 . 3.83 2439 1976 A 21 GLN HA A 24 GLU HGy 1.0 . 4.26 2440 1976 A 21 GLN HA A 24 GLU HGx 1.0 . 4.26 2441 1977 A 22 ALA H A 21 GLN HGx 1.0 . 4.62 2442 1977 A 22 ALA H A 21 GLN HGy 1.0 . 4.62 2443 1978 A 22 ALA HB% A 21 GLN HGx 1.0 . 4.90 2444 1978 A 22 ALA HB% A 21 GLN HGy 1.0 . 4.90 2445 1979 A 22 ALA H A 24 GLU HGy 1.0 . 5.39 2446 1979 A 22 ALA H A 24 GLU HGx 1.0 . 5.39 2447 1980 A 22 ALA HA A 25 GLU HGy 1.0 . 5.67 2448 1980 A 22 ALA HA A 25 GLU HGx 1.0 . 5.67 2449 1981 A 23 LEU H A 23 LEU HB3 1.0 . 3.48 2450 1981 A 23 LEU H A 23 LEU HB2 1.0 . 3.48 2451 1982 A 23 LEU H A 24 GLU HGy 1.0 . 5.33 2452 1982 A 23 LEU H A 24 GLU HGx 1.0 . 5.33 2453 1983 A 24 GLU H A 23 LEU HB3 1.0 . 3.19 2454 1983 A 24 GLU H A 23 LEU HB2 1.0 . 3.19 2455 1984 A 24 GLU HA A 23 LEU HB3 1.0 . 4.86 2456 1984 A 24 GLU HA A 23 LEU HB2 1.0 . 4.86 2457 1985 A 23 LEU HB3 A 24 GLU HGy 1.0 . 4.81 2458 1985 A 23 LEU HB2 A 24 GLU HGy 1.0 . 4.81 2459 1985 A 24 GLU HGx A 23 LEU HB3 1.0 . 4.81 2460 1985 A 23 LEU HB2 A 24 GLU HGx 1.0 . 4.81 2461 1986 A 26 PHE H A 23 LEU HB3 1.0 . 5.81 2462 1986 A 26 PHE H A 23 LEU HB2 1.0 . 5.81 2463 1987 A 23 LEU HB2 A 41 MET HBy 1.0 . 4.98 2464 1987 A 23 LEU HB3 A 41 MET HBy 1.0 . 4.98 2465 1987 A 41 MET HBx A 23 LEU HB3 1.0 . 4.98 2466 1987 A 23 LEU HB2 A 41 MET HBx 1.0 . 4.98 2467 1988 A 23 LEU HB2 A 41 MET HGx 1.0 . 5.12 2468 1988 A 23 LEU HB3 A 41 MET HGx 1.0 . 5.12 2469 1988 A 41 MET HGy A 23 LEU HB3 1.0 . 5.12 2470 1988 A 41 MET HGy A 23 LEU HB2 1.0 . 5.12 2471 1989 A 41 MET HE% A 23 LEU HB3 1.0 . 3.41 2472 1989 A 41 MET HE% A 23 LEU HB2 1.0 . 3.41 2473 1990 A 23 LEU HG A 24 GLU HGy 1.0 . 5.81 2474 1990 A 23 LEU HG A 24 GLU HGx 1.0 . 5.81 2475 1991 A 23 LEU HD1% A 24 GLU HGy 1.0 . 5.25 2476 1991 A 23 LEU HD1% A 24 GLU HGx 1.0 . 5.25 2477 1992 A 24 GLU H A 24 GLU HBy 1.0 . 3.21 2478 1992 A 24 GLU H A 24 GLU HBx 1.0 . 3.21 2479 1993 A 24 GLU HA A 24 GLU HGy 1.0 . 3.54 2480 1993 A 24 GLU HA A 24 GLU HGx 1.0 . 3.54 2481 1994 A 25 GLU H A 24 GLU HBy 1.0 . 4.17 2482 1994 A 25 GLU H A 24 GLU HBx 1.0 . 4.17 2483 1995 A 25 GLU HA A 24 GLU HBy 1.0 . 4.99 2484 1995 A 25 GLU HA A 24 GLU HBx 1.0 . 4.99 2485 1996 A 27 LEU HG A 24 GLU HBy 1.0 . 4.59 2486 1996 A 27 LEU HG A 24 GLU HBx 1.0 . 4.59 2487 1997 A 27 LEU HD1% A 24 GLU HBy 1.0 . 5.60 2488 1997 A 27 LEU HD1% A 24 GLU HBx 1.0 . 5.60 2489 1998 A 25 GLU H A 24 GLU HGy 1.0 . 4.42 2490 1998 A 25 GLU H A 24 GLU HGx 1.0 . 4.42 2491 1999 A 26 PHE H A 24 GLU HGy 1.0 . 5.81 2492 1999 A 26 PHE H A 24 GLU HGx 1.0 . 5.81 2493 2000 A 27 LEU H A 24 GLU HGy 1.0 . 5.81 2494 2000 A 27 LEU H A 24 GLU HGx 1.0 . 5.81 2495 2001 A 27 LEU HD1% A 24 GLU HGy 1.0 . 5.35 2496 2001 A 27 LEU HD1% A 24 GLU HGx 1.0 . 5.35 2497 2002 A 41 MET HE% A 24 GLU HGy 1.0 . 3.80 2498 2002 A 41 MET HE% A 24 GLU HGx 1.0 . 3.80 2499 2003 A 25 GLU H A 25 GLU HGy 1.0 . 3.85 2500 2003 A 25 GLU H A 25 GLU HGx 1.0 . 3.85 2501 2004 A 25 GLU HA A 25 GLU HGy 1.0 . 3.53 2502 2004 A 25 GLU HA A 25 GLU HGx 1.0 . 3.53 2503 2005 A 25 GLU HA A 28 GLN HGx 1.0 . 4.51 2504 2005 A 25 GLU HA A 28 GLN HGy 1.0 . 4.51 2505 2006 A 26 PHE HA A 25 GLU HGy 1.0 . 5.81 2506 2006 A 26 PHE HA A 25 GLU HGx 1.0 . 5.81 2507 2007 A 29 THR HG2% A 25 GLU HGy 1.0 . 5.81 2508 2007 A 29 THR HG2% A 25 GLU HGx 1.0 . 5.81 2509 2008 A 26 PHE HE% A 30 GLU HBy 1.0 . 5.32 2510 2008 A 26 PHE HE% A 30 GLU HBx 1.0 . 5.32 2511 2009 A 26 PHE HE% A 30 GLU HGy 1.0 . 5.28 2512 2009 A 26 PHE HE% A 30 GLU HGx 1.0 . 5.28 2513 2010 A 26 PHE HZ A 30 GLU HGy 1.0 . 5.81 2514 2010 A 26 PHE HZ A 30 GLU HGx 1.0 . 5.81 2515 2011 A 27 LEU H A 28 GLN HGx 1.0 . 5.81 2516 2011 A 27 LEU H A 28 GLN HGy 1.0 . 5.81 2517 2012 A 27 LEU HB2 A 28 GLN HGx 1.0 . 5.26 2518 2012 A 27 LEU HB2 A 28 GLN HGy 1.0 . 5.26 2519 2013 A 27 LEU HB3 A 28 GLN HGx 1.0 . 5.21 2520 2013 A 27 LEU HB3 A 28 GLN HGy 1.0 . 5.21 2521 2014 A 27 LEU HD2% A 34 LYS HBy 1.0 . 4.31 2522 2014 A 27 LEU HD2% A 34 LYS HBx 1.0 . 4.31 2523 2015 A 27 LEU HD2% A 34 LYS HG3 1.0 . 4.05 2524 2015 A 27 LEU HD2% A 34 LYS HG2 1.0 . 4.05 2525 2016 A 28 GLN HA A 28 GLN HGx 1.0 . 3.58 2526 2016 A 28 GLN HA A 28 GLN HGy 1.0 . 3.58 2527 2017 A 29 THR H A 28 GLN HGx 1.0 . 5.26 2528 2017 A 29 THR H A 28 GLN HGy 1.0 . 5.26 2529 2018 A 29 THR HG2% A 28 GLN HGx 1.0 . 5.57 2530 2018 A 29 THR HG2% A 28 GLN HGy 1.0 . 5.57 2531 2019 A 29 THR H A 30 GLU HBy 1.0 . 5.81 2532 2019 A 29 THR H A 30 GLU HBx 1.0 . 5.81 2533 2020 A 29 THR H A 30 GLU HGy 1.0 . 5.55 2534 2020 A 29 THR H A 30 GLU HGx 1.0 . 5.55 2535 2021 A 29 THR H A 31 PRO HD3 1.0 . 5.81 2536 2021 A 29 THR H A 31 PRO HD2 1.0 . 5.81 2537 2022 A 29 THR HA A 30 GLU HGy 1.0 . 5.81 2538 2022 A 29 THR HA A 30 GLU HGx 1.0 . 5.81 2539 2023 A 30 GLU H A 30 GLU HGy 1.0 . 3.88 2540 2023 A 30 GLU H A 30 GLU HGx 1.0 . 3.88 2541 2024 A 30 GLU H A 31 PRO HD3 1.0 . 3.69 2542 2024 A 30 GLU H A 31 PRO HD2 1.0 . 3.69 2543 2025 A 32 VAL H A 30 GLU HBy 1.0 . 5.05 2544 2025 A 32 VAL H A 30 GLU HBx 1.0 . 5.05 2545 2026 A 30 GLU HBy A 32 VAL HGx% 1.0 . 5.06 2546 2026 A 30 GLU HBx A 32 VAL HGx% 1.0 . 5.06 2547 2026 A 32 VAL HGy% A 30 GLU HBy 1.0 . 5.06 2548 2026 A 32 VAL HGy% A 30 GLU HBx 1.0 . 5.06 2549 2027 A 33 GLY H A 30 GLU HBy 1.0 . 5.11 2550 2027 A 33 GLY H A 30 GLU HBx 1.0 . 5.11 2551 2028 A 30 GLU HGy A 32 VAL HGx% 1.0 . 4.63 2552 2028 A 32 VAL HGy% A 30 GLU HGy 1.0 . 4.63 2553 2028 A 32 VAL HGy% A 30 GLU HGx 1.0 . 4.63 2554 2028 A 30 GLU HGx A 32 VAL HGx% 1.0 . 4.63 2555 2029 A 33 GLY H A 30 GLU HGy 1.0 . 5.17 2556 2029 A 33 GLY H A 30 GLU HGx 1.0 . 5.17 2557 2030 A 32 VAL H A 31 PRO HG3 1.0 . 4.44 2558 2030 A 32 VAL H A 31 PRO HG2 1.0 . 4.44 2559 2031 A 32 VAL HB A 31 PRO HG3 1.0 . 5.48 2560 2031 A 32 VAL HB A 31 PRO HG2 1.0 . 5.48 2561 2032 A 31 PRO HG2 A 32 VAL HGx% 1.0 . 4.36 2562 2032 A 31 PRO HG3 A 32 VAL HGx% 1.0 . 4.36 2563 2032 A 32 VAL HGy% A 31 PRO HG3 1.0 . 4.36 2564 2032 A 32 VAL HGy% A 31 PRO HG2 1.0 . 4.36 2565 2033 A 31 PRO HD3 A 34 LYS HG3 1.0 . 4.87 2566 2033 A 34 LYS HG2 A 31 PRO HD3 1.0 . 4.87 2567 2033 A 34 LYS HG2 A 31 PRO HD2 1.0 . 4.87 2568 2033 A 31 PRO HD2 A 34 LYS HG3 1.0 . 4.87 2569 2034 A 31 PRO HD3 A 34 LYS HDx 1.0 . 5.63 2570 2034 A 31 PRO HD2 A 34 LYS HDx 1.0 . 5.63 2571 2034 A 34 LYS HDy A 31 PRO HD3 1.0 . 5.63 2572 2034 A 34 LYS HDy A 31 PRO HD2 1.0 . 5.63 2573 2035 A 31 PRO HD2 A 34 LYS HEx 1.0 . 5.81 2574 2035 A 31 PRO HD3 A 34 LYS HEx 1.0 . 5.81 2575 2035 A 34 LYS HEy A 31 PRO HD3 1.0 . 5.81 2576 2035 A 34 LYS HEy A 31 PRO HD2 1.0 . 5.81 2577 2036 A 32 VAL HA A 34 LYS HG3 1.0 . 5.34 2578 2036 A 32 VAL HA A 34 LYS HG2 1.0 . 5.34 2579 2037 A 33 GLY H A 34 LYS HG3 1.0 . 5.66 2580 2037 A 33 GLY H A 34 LYS HG2 1.0 . 5.66 2581 2038 A 34 LYS H A 34 LYS HG3 1.0 . 3.57 2582 2038 A 34 LYS H A 34 LYS HG2 1.0 . 3.57 2583 2039 A 34 LYS HA A 34 LYS HG3 1.0 . 3.73 2584 2039 A 34 LYS HA A 34 LYS HG2 1.0 . 3.73 2585 2040 A 34 LYS HBx A 34 LYS HEx 1.0 . 4.88 2586 2040 A 34 LYS HBy A 34 LYS HEx 1.0 . 4.88 2587 2040 A 34 LYS HEy A 34 LYS HBy 1.0 . 4.88 2588 2040 A 34 LYS HEy A 34 LYS HBx 1.0 . 4.88 2589 2041 A 35 ASP H A 34 LYS HBy 1.0 . 3.84 2590 2041 A 35 ASP H A 34 LYS HBx 1.0 . 3.84 2591 2042 A 38 TYR HD% A 34 LYS HBy 1.0 . 4.55 2592 2042 A 38 TYR HD% A 34 LYS HBx 1.0 . 4.55 2593 2043 A 38 TYR HE% A 34 LYS HBy 1.0 . 3.61 2594 2043 A 38 TYR HE% A 34 LYS HBx 1.0 . 3.61 2595 2044 A 35 ASP H A 34 LYS HG3 1.0 . 4.77 2596 2044 A 35 ASP H A 34 LYS HG2 1.0 . 4.77 2597 2045 A 38 TYR HE% A 34 LYS HG3 1.0 . 5.81 2598 2045 A 38 TYR HE% A 34 LYS HG2 1.0 . 5.81 2599 2046 A 35 ASP H A 35 ASP HBy 1.0 . 3.56 2600 2046 A 35 ASP H A 35 ASP HBx 1.0 . 3.56 2601 2047 A 35 ASP H A 64 LEU HBx 1.0 . 5.15 2602 2047 A 35 ASP H A 64 LEU HBy 1.0 . 5.15 2603 2048 A 35 ASP HBy A 36 GLU HBx 1.0 . 5.62 2604 2048 A 35 ASP HBx A 36 GLU HBx 1.0 . 5.62 2605 2048 A 36 GLU HBy A 35 ASP HBy 1.0 . 5.62 2606 2048 A 36 GLU HBy A 35 ASP HBx 1.0 . 5.62 2607 2049 A 61 ALA HA A 35 ASP HBy 1.0 . 5.24 2608 2049 A 61 ALA HA A 35 ASP HBx 1.0 . 5.24 2609 2050 A 61 ALA HB% A 35 ASP HBy 1.0 . 5.00 2610 2050 A 61 ALA HB% A 35 ASP HBx 1.0 . 5.00 2611 2051 A 64 LEU H A 35 ASP HBy 1.0 . 5.17 2612 2051 A 64 LEU H A 35 ASP HBx 1.0 . 5.17 2613 2052 A 35 ASP HBx A 64 LEU HBx 1.0 . 4.73 2614 2052 A 64 LEU HBy A 35 ASP HBy 1.0 . 4.73 2615 2052 A 35 ASP HBx A 64 LEU HBy 1.0 . 4.73 2616 2052 A 35 ASP HBy A 64 LEU HBx 1.0 . 4.73 2617 2053 A 64 LEU HG A 35 ASP HBy 1.0 . 5.81 2618 2053 A 64 LEU HG A 35 ASP HBx 1.0 . 5.81 2619 2054 A 64 LEU HD1% A 35 ASP HBy 1.0 . 4.52 2620 2054 A 64 LEU HD1% A 35 ASP HBx 1.0 . 4.52 2621 2055 A 64 LEU HD2% A 35 ASP HBy 1.0 . 5.26 2622 2055 A 64 LEU HD2% A 35 ASP HBx 1.0 . 5.26 2623 2056 A 36 GLU HA A 39 TYR HB3 1.0 . 4.75 2624 2056 A 36 GLU HA A 39 TYR HB2 1.0 . 4.75 2625 2057 A 37 ALA H A 36 GLU HGx 1.0 . 4.90 2626 2057 A 37 ALA H A 36 GLU HGy 1.0 . 4.90 2627 2058 A 37 ALA HA A 36 GLU HGx 1.0 . 5.81 2628 2058 A 37 ALA HA A 36 GLU HGy 1.0 . 5.81 2629 2059 A 37 ALA HB% A 36 GLU HGx 1.0 . 5.81 2630 2059 A 37 ALA HB% A 36 GLU HGy 1.0 . 5.81 2631 2060 A 39 TYR HD% A 36 GLU HGx 1.0 . 4.93 2632 2060 A 39 TYR HD% A 36 GLU HGy 1.0 . 4.93 2633 2061 A 40 LEU H A 36 GLU HGx 1.0 . 5.81 2634 2061 A 40 LEU H A 36 GLU HGy 1.0 . 5.81 2635 2062 A 40 LEU HD1% A 36 GLU HGx 1.0 . 4.62 2636 2062 A 40 LEU HD1% A 36 GLU HGy 1.0 . 4.62 2637 2063 A 37 ALA HB% A 41 MET HBy 1.0 . 5.81 2638 2063 A 37 ALA HB% A 41 MET HBx 1.0 . 5.81 2639 2064 A 38 TYR H A 38 TYR HB3 1.0 . 3.64 2640 2064 A 38 TYR H A 38 TYR HB2 1.0 . 3.64 2641 2065 A 60 SER HA A 38 TYR HB3 1.0 . 5.41 2642 2065 A 60 SER HA A 38 TYR HB2 1.0 . 5.41 2643 2066 A 38 TYR HB3 A 60 SER HBy 1.0 . 5.54 2644 2066 A 60 SER HBx A 38 TYR HB3 1.0 . 5.54 2645 2066 A 38 TYR HB2 A 60 SER HBx 1.0 . 5.54 2646 2066 A 38 TYR HB2 A 60 SER HBy 1.0 . 5.54 2647 2067 A 61 ALA H A 38 TYR HB3 1.0 . 4.20 2648 2067 A 61 ALA H A 38 TYR HB2 1.0 . 4.20 2649 2068 A 61 ALA HA A 38 TYR HB3 1.0 . 5.14 2650 2068 A 61 ALA HA A 38 TYR HB2 1.0 . 5.14 2651 2069 A 61 ALA HB% A 38 TYR HB3 1.0 . 3.78 2652 2069 A 61 ALA HB% A 38 TYR HB2 1.0 . 3.78 2653 2070 A 38 TYR HD% A 57 ASN HB3 1.0 . 5.81 2654 2070 A 38 TYR HD% A 57 ASN HB2 1.0 . 5.81 2655 2071 A 38 TYR HD% A 60 SER HBy 1.0 . 4.46 2656 2071 A 38 TYR HD% A 60 SER HBx 1.0 . 4.46 2657 2072 A 40 LEU H A 39 TYR HB3 1.0 . 4.17 2658 2072 A 40 LEU H A 39 TYR HB2 1.0 . 4.17 2659 2073 A 61 ALA H A 39 TYR HB3 1.0 . 5.81 2660 2073 A 61 ALA H A 39 TYR HB2 1.0 . 5.81 2661 2074 A 70 ALA H A 39 TYR HB3 1.0 . 4.87 2662 2074 A 70 ALA H A 39 TYR HB2 1.0 . 4.87 2663 2075 A 70 ALA HB% A 39 TYR HB3 1.0 . 4.47 2664 2075 A 70 ALA HB% A 39 TYR HB2 1.0 . 4.47 2665 2076 A 39 TYR HE% A 43 ASN HD2y 1.0 . 4.08 2666 2076 A 39 TYR HE% A 43 ASN HD2x 1.0 . 4.08 2667 2077 A 39 TYR HE% A 69 PRO HBx 1.0 . 4.25 2668 2077 A 39 TYR HE% A 69 PRO HBy 1.0 . 4.25 2669 2078 A 39 TYR HE% A 69 PRO HGx 1.0 . 5.08 2670 2078 A 39 TYR HE% A 69 PRO HGy 1.0 . 5.08 2671 2079 A 40 LEU H A 41 MET HBy 1.0 . 5.81 2672 2079 A 40 LEU H A 41 MET HBx 1.0 . 5.81 2673 2080 A 40 LEU HA A 43 ASN HBx 1.0 . 4.76 2674 2080 A 40 LEU HA A 43 ASN HBy 1.0 . 4.76 2675 2081 A 41 MET HE% A 41 MET HBy 1.0 . 4.29 2676 2081 A 41 MET HE% A 41 MET HBx 1.0 . 4.29 2677 2082 A 44 ALA HB% A 41 MET HBy 1.0 . 5.81 2678 2082 A 44 ALA HB% A 41 MET HBx 1.0 . 5.81 2679 2083 A 45 TYR HE% A 41 MET HBy 1.0 . 4.18 2680 2083 A 45 TYR HE% A 41 MET HBx 1.0 . 4.18 2681 2084 A 57 ASN HD2x A 41 MET HBy 1.0 . 4.51 2682 2084 A 57 ASN HD2y A 41 MET HBx 1.0 . 4.51 2683 2084 A 57 ASN HD2x A 41 MET HBx 1.0 . 4.51 2684 2084 A 57 ASN HD2y A 41 MET HBy 1.0 . 4.51 2685 2085 A 41 MET HGy A 42 GLY HAx 1.0 . 5.81 2686 2085 A 41 MET HGx A 42 GLY HAx 1.0 . 5.81 2687 2085 A 42 GLY HAy A 41 MET HGx 1.0 . 5.81 2688 2085 A 41 MET HGy A 42 GLY HAy 1.0 . 5.81 2689 2086 A 41 MET HGy A 57 ASN HB3 1.0 . 5.81 2690 2086 A 41 MET HGx A 57 ASN HB3 1.0 . 5.81 2691 2086 A 57 ASN HB2 A 41 MET HGx 1.0 . 5.81 2692 2086 A 41 MET HGy A 57 ASN HB2 1.0 . 5.81 2693 2087 A 41 MET HGy A 57 ASN HD2x 1.0 . 5.36 2694 2087 A 57 ASN HD2x A 41 MET HGx 1.0 . 5.36 2695 2087 A 57 ASN HD2y A 41 MET HGx 1.0 . 5.36 2696 2087 A 41 MET HGy A 57 ASN HD2y 1.0 . 5.36 2697 2088 A 41 MET HE% A 57 ASN HB3 1.0 . 5.81 2698 2088 A 41 MET HE% A 57 ASN HB2 1.0 . 5.81 2699 2089 A 57 ASN HD2y A 41 MET HE% 1.0 . 4.78 2700 2089 A 57 ASN HD2x A 41 MET HE% 1.0 . 4.78 2701 2090 A 41 MET HE% A 60 SER HBy 1.0 . 5.81 2702 2090 A 41 MET HE% A 60 SER HBx 1.0 . 5.81 2703 2091 A 42 GLY HAx A 45 TYR HBy 1.0 . 5.61 2704 2091 A 42 GLY HAy A 45 TYR HBy 1.0 . 5.61 2705 2091 A 45 TYR HBx A 42 GLY HAx 1.0 . 5.61 2706 2091 A 45 TYR HBx A 42 GLY HAy 1.0 . 5.61 2707 2092 A 45 TYR HD% A 42 GLY HAx 1.0 . 5.06 2708 2092 A 45 TYR HD% A 42 GLY HAy 1.0 . 5.06 2709 2093 A 42 GLY HAy A 46 ARG HBx 1.0 . 5.61 2710 2093 A 42 GLY HAx A 46 ARG HBx 1.0 . 5.61 2711 2093 A 46 ARG HBy A 42 GLY HAx 1.0 . 5.61 2712 2093 A 42 GLY HAy A 46 ARG HBy 1.0 . 5.61 2713 2094 A 54 ALA H A 42 GLY HAx 1.0 . 5.75 2714 2094 A 54 ALA H A 42 GLY HAy 1.0 . 5.75 2715 2095 A 54 ALA HB% A 42 GLY HAx 1.0 . 4.75 2716 2095 A 54 ALA HB% A 42 GLY HAy 1.0 . 4.75 2717 2096 A 42 GLY HAy A 57 ASN HB3 1.0 . 4.65 2718 2096 A 42 GLY HAx A 57 ASN HB3 1.0 . 4.65 2719 2096 A 57 ASN HB2 A 42 GLY HAx 1.0 . 4.65 2720 2096 A 57 ASN HB2 A 42 GLY HAy 1.0 . 4.65 2721 2097 A 57 ASN HD2y A 42 GLY HAy 1.0 . 5.34 2722 2097 A 57 ASN HD2x A 42 GLY HAx 1.0 . 5.34 2723 2097 A 57 ASN HD2y A 42 GLY HAx 1.0 . 5.34 2724 2097 A 57 ASN HD2x A 42 GLY HAy 1.0 . 5.34 2725 2098 A 58 TYR HD% A 42 GLY HAx 1.0 . 5.38 2726 2098 A 58 TYR HD% A 42 GLY HAy 1.0 . 5.38 2727 2099 A 43 ASN HA A 46 ARG HBx 1.0 . 4.68 2728 2099 A 43 ASN HA A 46 ARG HBy 1.0 . 4.68 2729 2100 A 44 ALA H A 43 ASN HBx 1.0 . 4.33 2730 2100 A 44 ALA H A 43 ASN HBy 1.0 . 4.33 2731 2101 A 44 ALA H A 46 ARG HBx 1.0 . 5.81 2732 2101 A 44 ALA H A 46 ARG HBy 1.0 . 5.81 2733 2102 A 44 ALA HB% A 45 TYR HBy 1.0 . 5.81 2734 2102 A 44 ALA HB% A 45 TYR HBx 1.0 . 5.81 2735 2103 A 45 TYR H A 45 TYR HBy 1.0 . 3.67 2736 2103 A 45 TYR H A 45 TYR HBx 1.0 . 3.67 2737 2104 A 45 TYR H A 46 ARG HBx 1.0 . 5.81 2738 2104 A 45 TYR H A 46 ARG HBy 1.0 . 5.81 2739 2105 A 45 TYR HA A 48 LEU HBx 1.0 . 4.56 2740 2105 A 45 TYR HA A 48 LEU HBy 1.0 . 4.56 2741 2106 A 46 ARG HA A 45 TYR HBy 1.0 . 5.81 2742 2106 A 46 ARG HA A 45 TYR HBx 1.0 . 5.81 2743 2107 A 45 TYR HBx A 50 ASP HBx 1.0 . 4.71 2744 2107 A 45 TYR HBy A 50 ASP HBx 1.0 . 4.71 2745 2107 A 50 ASP HBy A 45 TYR HBy 1.0 . 4.71 2746 2107 A 45 TYR HBx A 50 ASP HBy 1.0 . 4.71 2747 2108 A 54 ALA H A 45 TYR HBy 1.0 . 4.22 2748 2108 A 54 ALA H A 45 TYR HBx 1.0 . 4.22 2749 2109 A 54 ALA HA A 45 TYR HBy 1.0 . 5.15 2750 2109 A 54 ALA HA A 45 TYR HBx 1.0 . 5.15 2751 2110 A 54 ALA HB% A 45 TYR HBy 1.0 . 4.54 2752 2110 A 54 ALA HB% A 45 TYR HBx 1.0 . 4.54 2753 2111 A 57 ASN HD2x A 45 TYR HBy 1.0 . 5.61 2754 2111 A 57 ASN HD2x A 45 TYR HBx 1.0 . 5.61 2755 2111 A 57 ASN HD2y A 45 TYR HBx 1.0 . 5.61 2756 2111 A 57 ASN HD2y A 45 TYR HBy 1.0 . 5.61 2757 2112 A 45 TYR HD% A 48 LEU HBx 1.0 . 5.74 2758 2112 A 45 TYR HD% A 48 LEU HBy 1.0 . 5.74 2759 2113 A 45 TYR HD% A 57 ASN HD2y 1.0 . 4.34 2760 2113 A 45 TYR HD% A 57 ASN HD2x 1.0 . 4.34 2761 2114 A 45 TYR HE% A 53 LYS HBy 1.0 . 4.82 2762 2114 A 45 TYR HE% A 53 LYS HBx 1.0 . 4.82 2763 2115 A 45 TYR HE% A 53 LYS HGx 1.0 . 4.41 2764 2115 A 45 TYR HE% A 53 LYS HGy 1.0 . 4.41 2765 2116 A 45 TYR HE% A 53 LYS HEy 1.0 . 5.07 2766 2116 A 45 TYR HE% A 53 LYS HEx 1.0 . 5.07 2767 2117 A 45 TYR HE% A 57 ASN HB3 1.0 . 5.81 2768 2117 A 45 TYR HE% A 57 ASN HB2 1.0 . 5.81 2769 2118 A 45 TYR HE% A 57 ASN HD2y 1.0 . 3.82 2770 2118 A 45 TYR HE% A 57 ASN HD2x 1.0 . 3.82 2771 2119 A 46 ARG H A 46 ARG HBx 1.0 . 3.65 2772 2119 A 46 ARG H A 46 ARG HBy 1.0 . 3.65 2773 2120 A 46 ARG HA A 46 ARG HDx 1.0 . 5.81 2774 2120 A 46 ARG HA A 46 ARG HDy 1.0 . 5.81 2775 2121 A 47 LYS H A 46 ARG HBx 1.0 . 4.30 2776 2121 A 47 LYS H A 46 ARG HBy 1.0 . 4.30 2777 2122 A 54 ALA HB% A 46 ARG HBx 1.0 . 4.67 2778 2122 A 54 ALA HB% A 46 ARG HBy 1.0 . 4.67 2779 2123 A 58 TYR HE% A 46 ARG HBx 1.0 . 5.81 2780 2123 A 58 TYR HE% A 46 ARG HBy 1.0 . 5.81 2781 2124 A 77 VAL HG2% A 46 ARG HBx 1.0 . 5.02 2782 2124 A 77 VAL HG2% A 46 ARG HBy 1.0 . 5.02 2783 2125 A 51 TRP HZ3 A 46 ARG HDx 1.0 . 5.81 2784 2125 A 51 TRP HZ3 A 46 ARG HDy 1.0 . 5.81 2785 2126 A 54 ALA HB% A 46 ARG HDx 1.0 . 5.47 2786 2126 A 54 ALA HB% A 46 ARG HDy 1.0 . 5.47 2787 2127 A 76 MET HE% A 46 ARG HDx 1.0 . 5.29 2788 2127 A 76 MET HE% A 46 ARG HDy 1.0 . 5.29 2789 2128 A 77 VAL HG2% A 46 ARG HDx 1.0 . 4.24 2790 2128 A 77 VAL HG2% A 46 ARG HDy 1.0 . 4.24 2791 2129 A 47 LYS H A 47 LYS HGy 1.0 . 3.87 2792 2129 A 47 LYS H A 47 LYS HGx 1.0 . 3.87 2793 2130 A 48 LEU H A 47 LYS HGy 1.0 . 5.22 2794 2130 A 48 LEU H A 47 LYS HGx 1.0 . 5.22 2795 2131 A 48 LEU H A 48 LEU HBx 1.0 . 3.51 2796 2131 A 48 LEU H A 48 LEU HBy 1.0 . 3.51 2797 2132 A 48 LEU H A 49 GLY HAy 1.0 . 5.09 2798 2132 A 48 LEU H A 49 GLY HAx 1.0 . 5.09 2799 2133 A 50 ASP H A 48 LEU HBx 1.0 . 4.05 2800 2133 A 50 ASP H A 48 LEU HBy 1.0 . 4.05 2801 2134 A 48 LEU HD2% A 50 ASP HBx 1.0 . 5.81 2802 2134 A 48 LEU HD2% A 50 ASP HBy 1.0 . 5.81 2803 2135 A 51 TRP H A 49 GLY HAy 1.0 . 5.81 2804 2135 A 51 TRP H A 49 GLY HAx 1.0 . 5.81 2805 2136 A 51 TRP HD1 A 49 GLY HAy 1.0 . 5.81 2806 2136 A 51 TRP HD1 A 49 GLY HAx 1.0 . 5.81 2807 2137 A 51 TRP HE1 A 49 GLY HAy 1.0 . 5.81 2808 2137 A 49 GLY HAx A 51 TRP HE1 1.0 . 5.81 2809 2138 A 50 ASP H A 50 ASP HBx 1.0 . 3.64 2810 2138 A 50 ASP H A 50 ASP HBy 1.0 . 3.64 2811 2139 A 53 LYS H A 50 ASP HBx 1.0 . 4.64 2812 2139 A 53 LYS H A 50 ASP HBy 1.0 . 4.64 2813 2140 A 50 ASP HBx A 53 LYS HGx 1.0 . 5.62 2814 2140 A 50 ASP HBy A 53 LYS HGx 1.0 . 5.62 2815 2140 A 53 LYS HGy A 50 ASP HBx 1.0 . 5.62 2816 2140 A 50 ASP HBy A 53 LYS HGy 1.0 . 5.62 2817 2141 A 52 GLN H A 52 GLN HGx 1.0 . 4.19 2818 2141 A 52 GLN H A 52 GLN HGy 1.0 . 4.19 2819 2142 A 52 GLN H A 53 LYS HGx 1.0 . 5.74 2820 2142 A 52 GLN H A 53 LYS HGy 1.0 . 5.74 2821 2143 A 52 GLN HA A 52 GLN HGx 1.0 . 3.60 2822 2143 A 52 GLN HA A 52 GLN HGy 1.0 . 3.60 2823 2144 A 52 GLN HA A 55 LEU HBy 1.0 . 4.34 2824 2144 A 52 GLN HA A 55 LEU HBx 1.0 . 4.34 2825 2145 A 52 GLN HE2y A 52 GLN HBx 1.0 . 4.66 2826 2145 A 52 GLN HE2x A 52 GLN HBx 1.0 . 4.66 2827 2145 A 52 GLN HBy A 52 GLN HE2y 1.0 . 4.66 2828 2145 A 52 GLN HBy A 52 GLN HE2x 1.0 . 4.66 2829 2146 A 52 GLN HE2y A 52 GLN HGy 1.0 . 3.23 2830 2146 A 52 GLN HE2x A 52 GLN HGx 1.0 . 3.23 2831 2146 A 52 GLN HE2x A 52 GLN HGy 1.0 . 3.23 2832 2146 A 52 GLN HE2y A 52 GLN HGx 1.0 . 3.23 2833 2147 A 55 LEU HD1% A 52 GLN HGx 1.0 . 5.47 2834 2147 A 55 LEU HD1% A 52 GLN HGy 1.0 . 5.47 2835 2148 A 56 ASN HD2y A 52 GLN HGy 1.0 . 4.32 2836 2148 A 56 ASN HD2x A 52 GLN HGy 1.0 . 4.32 2837 2148 A 56 ASN HD2x A 52 GLN HGx 1.0 . 4.32 2838 2148 A 56 ASN HD2y A 52 GLN HGx 1.0 . 4.32 2839 2149 A 81 LEU HD1% A 52 GLN HGx 1.0 . 5.81 2840 2149 A 81 LEU HD1% A 52 GLN HGy 1.0 . 5.81 2841 2150 A 52 GLN HE2x A 55 LEU HBy 1.0 . 5.16 2842 2150 A 52 GLN HE2y A 55 LEU HBx 1.0 . 5.16 2843 2150 A 52 GLN HE2x A 55 LEU HBx 1.0 . 5.16 2844 2150 A 52 GLN HE2y A 55 LEU HBy 1.0 . 5.16 2845 2151 A 52 GLN HE2y A 55 LEU HD1% 1.0 . 4.85 2846 2151 A 55 LEU HD1% A 52 GLN HE2x 1.0 . 4.85 2847 2152 A 52 GLN HE2y A 55 LEU HD2% 1.0 . 5.76 2848 2152 A 55 LEU HD2% A 52 GLN HE2x 1.0 . 5.76 2849 2153 A 52 GLN HE2y A 81 LEU HD2% 1.0 . 5.51 2850 2153 A 81 LEU HD2% A 52 GLN HE2x 1.0 . 5.51 2851 2154 A 52 GLN HE2y A 88 MET HE% 1.0 . 4.78 2852 2154 A 88 MET HE% A 52 GLN HE2x 1.0 . 4.78 2853 2155 A 52 GLN HE2y A 92 LEU HBy 1.0 . 5.61 2854 2155 A 52 GLN HE2x A 92 LEU HBx 1.0 . 5.61 2855 2155 A 52 GLN HE2x A 92 LEU HBy 1.0 . 5.61 2856 2155 A 52 GLN HE2y A 92 LEU HBx 1.0 . 5.61 2857 2156 A 52 GLN HE2y A 92 LEU HG 1.0 . 5.81 2858 2156 A 92 LEU HG A 52 GLN HE2x 1.0 . 5.81 2859 2157 A 52 GLN HE2y A 92 LEU HDx% 1.0 . 5.27 2860 2157 A 52 GLN HE2y A 92 LEU HDy% 1.0 . 5.27 2861 2157 A 52 GLN HE2x A 92 LEU HDx% 1.0 . 5.27 2862 2157 A 52 GLN HE2x A 92 LEU HDy% 1.0 . 5.27 2863 2158 A 53 LYS H A 53 LYS HBy 1.0 . 3.64 2864 2158 A 53 LYS H A 53 LYS HBx 1.0 . 3.64 2865 2159 A 53 LYS H A 53 LYS HGx 1.0 . 3.72 2866 2159 A 53 LYS H A 53 LYS HGy 1.0 . 3.72 2867 2160 A 53 LYS HA A 53 LYS HEy 1.0 . 4.81 2868 2160 A 53 LYS HA A 53 LYS HEx 1.0 . 4.81 2869 2161 A 53 LYS HA A 56 ASN HD2y 1.0 . 4.44 2870 2161 A 53 LYS HA A 56 ASN HD2x 1.0 . 4.44 2871 2162 A 53 LYS HA A 57 ASN HD2y 1.0 . 5.40 2872 2162 A 53 LYS HA A 57 ASN HD2x 1.0 . 5.40 2873 2163 A 53 LYS HBy A 53 LYS HEy 1.0 . 4.24 2874 2163 A 53 LYS HBx A 53 LYS HEy 1.0 . 4.24 2875 2163 A 53 LYS HEx A 53 LYS HBy 1.0 . 4.24 2876 2163 A 53 LYS HBx A 53 LYS HEx 1.0 . 4.24 2877 2164 A 54 ALA H A 53 LYS HBy 1.0 . 4.24 2878 2164 A 54 ALA H A 53 LYS HBx 1.0 . 4.24 2879 2165 A 57 ASN HD2x A 53 LYS HBy 1.0 . 4.74 2880 2165 A 57 ASN HD2x A 53 LYS HBx 1.0 . 4.74 2881 2165 A 57 ASN HD2y A 53 LYS HBx 1.0 . 4.74 2882 2165 A 57 ASN HD2y A 53 LYS HBy 1.0 . 4.74 2883 2166 A 56 ASN HD2y A 53 LYS HGy 1.0 . 5.61 2884 2166 A 56 ASN HD2x A 53 LYS HGy 1.0 . 5.61 2885 2166 A 56 ASN HD2x A 53 LYS HGx 1.0 . 5.61 2886 2166 A 56 ASN HD2y A 53 LYS HGx 1.0 . 5.61 2887 2167 A 57 ASN HD2y A 53 LYS HEx 1.0 . 4.94 2888 2167 A 57 ASN HD2x A 53 LYS HEx 1.0 . 4.94 2889 2167 A 57 ASN HD2y A 53 LYS HEy 1.0 . 4.94 2890 2167 A 57 ASN HD2x A 53 LYS HEy 1.0 . 4.94 2891 2168 A 54 ALA HA A 57 ASN HD2y 1.0 . 5.81 2892 2168 A 54 ALA HA A 57 ASN HD2x 1.0 . 5.81 2893 2169 A 54 ALA HB% A 57 ASN HD2y 1.0 . 5.81 2894 2169 A 54 ALA HB% A 57 ASN HD2x 1.0 . 5.81 2895 2170 A 77 VAL HG1% A 55 LEU HBy 1.0 . 5.45 2896 2170 A 77 VAL HG1% A 55 LEU HBx 1.0 . 5.45 2897 2171 A 55 LEU HD2% A 74 ARG HDx 1.0 . 4.73 2898 2171 A 55 LEU HD2% A 74 ARG HDy 1.0 . 4.73 2899 2172 A 55 LEU HD2% A 78 MET HGx 1.0 . 4.17 2900 2172 A 55 LEU HD2% A 78 MET HGy 1.0 . 4.17 2901 2173 A 56 ASN HA A 59 GLN HBy 1.0 . 4.15 2902 2173 A 56 ASN HA A 59 GLN HBx 1.0 . 4.15 2903 2174 A 56 ASN HA A 59 GLN HGx 1.0 . 5.56 2904 2174 A 56 ASN HA A 59 GLN HGy 1.0 . 5.56 2905 2175 A 57 ASN HA A 60 SER HBy 1.0 . 4.80 2906 2175 A 57 ASN HA A 60 SER HBx 1.0 . 4.80 2907 2176 A 58 TYR H A 57 ASN HB3 1.0 . 3.97 2908 2176 A 58 TYR H A 57 ASN HB2 1.0 . 3.97 2909 2177 A 57 ASN HD2y A 58 TYR H 1.0 . 5.19 2910 2177 A 57 ASN HD2x A 58 TYR H 1.0 . 5.19 2911 2178 A 58 TYR H A 58 TYR HB3 1.0 . 3.62 2912 2178 A 58 TYR H A 58 TYR HB2 1.0 . 3.62 2913 2179 A 59 GLN H A 58 TYR HB3 1.0 . 4.10 2914 2179 A 59 GLN H A 58 TYR HB2 1.0 . 4.10 2915 2180 A 59 GLN HA A 58 TYR HB3 1.0 . 5.49 2916 2180 A 59 GLN HA A 58 TYR HB2 1.0 . 5.49 2917 2181 A 62 ILE HD1% A 58 TYR HB3 1.0 . 4.55 2918 2181 A 62 ILE HD1% A 58 TYR HB2 1.0 . 4.55 2919 2182 A 70 ALA HB% A 58 TYR HB3 1.0 . 4.02 2920 2182 A 70 ALA HB% A 58 TYR HB2 1.0 . 4.02 2921 2183 A 73 ALA HB% A 58 TYR HB3 1.0 . 5.81 2922 2183 A 73 ALA HB% A 58 TYR HB2 1.0 . 5.81 2923 2184 A 74 ARG H A 58 TYR HB3 1.0 . 5.08 2924 2184 A 74 ARG H A 58 TYR HB2 1.0 . 5.08 2925 2185 A 58 TYR HB2 A 74 ARG HBx 1.0 . 4.73 2926 2185 A 58 TYR HB3 A 74 ARG HBx 1.0 . 4.73 2927 2185 A 74 ARG HBy A 58 TYR HB3 1.0 . 4.73 2928 2185 A 58 TYR HB2 A 74 ARG HBy 1.0 . 4.73 2929 2186 A 58 TYR HE% A 74 ARG HBx 1.0 . 5.81 2930 2186 A 58 TYR HE% A 74 ARG HBy 1.0 . 5.81 2931 2187 A 58 TYR HE% A 76 MET HGx 1.0 . 5.81 2932 2187 A 58 TYR HE% A 76 MET HGy 1.0 . 5.81 2933 2188 A 59 GLN H A 59 GLN HBy 1.0 . 3.39 2934 2188 A 59 GLN H A 59 GLN HBx 1.0 . 3.39 2935 2189 A 59 GLN HA A 59 GLN HGx 1.0 . 3.71 2936 2189 A 59 GLN HA A 59 GLN HGy 1.0 . 3.71 2937 2190 A 59 GLN HE2y A 59 GLN HA 1.0 . 4.62 2938 2190 A 59 GLN HE2x A 59 GLN HA 1.0 . 4.62 2939 2191 A 59 GLN HE2y A 59 GLN HBy 1.0 . 4.32 2940 2191 A 59 GLN HE2x A 59 GLN HBy 1.0 . 4.32 2941 2191 A 59 GLN HE2x A 59 GLN HBx 1.0 . 4.32 2942 2191 A 59 GLN HE2y A 59 GLN HBx 1.0 . 4.32 2943 2192 A 60 SER H A 59 GLN HBy 1.0 . 3.56 2944 2192 A 60 SER H A 59 GLN HBx 1.0 . 3.56 2945 2193 A 59 GLN HE2y A 59 GLN HGy 1.0 . 3.14 2946 2193 A 59 GLN HE2x A 59 GLN HGx 1.0 . 3.14 2947 2193 A 59 GLN HE2x A 59 GLN HGy 1.0 . 3.14 2948 2193 A 59 GLN HE2y A 59 GLN HGx 1.0 . 3.14 2949 2194 A 59 GLN HE2y A 62 ILE H 1.0 . 5.37 2950 2194 A 59 GLN HE2x A 62 ILE H 1.0 . 5.37 2951 2195 A 59 GLN HE2y A 62 ILE HA 1.0 . 5.81 2952 2195 A 59 GLN HE2x A 62 ILE HA 1.0 . 5.81 2953 2196 A 59 GLN HE2y A 62 ILE HB 1.0 . 5.38 2954 2196 A 59 GLN HE2x A 62 ILE HB 1.0 . 5.38 2955 2197 A 59 GLN HE2y A 62 ILE HG2% 1.0 . 4.66 2956 2197 A 59 GLN HE2x A 62 ILE HG2% 1.0 . 4.66 2957 2198 A 62 ILE HD1% A 59 GLN HE2y 1.0 . 5.02 2958 2198 A 62 ILE HD1% A 59 GLN HE2x 1.0 . 5.02 2959 2199 A 59 GLN HE2y A 63 GLU H 1.0 . 4.56 2960 2199 A 59 GLN HE2x A 63 GLU H 1.0 . 4.56 2961 2200 A 59 GLN HE2y A 63 GLU HA 1.0 . 5.27 2962 2200 A 59 GLN HE2x A 63 GLU HA 1.0 . 5.27 2963 2201 A 59 GLN HE2x A 63 GLU HGy 1.0 . 3.77 2964 2201 A 59 GLN HE2y A 63 GLU HGx 1.0 . 3.77 2965 2201 A 59 GLN HE2x A 63 GLU HGx 1.0 . 3.77 2966 2201 A 59 GLN HE2y A 63 GLU HGy 1.0 . 3.77 2967 2202 A 59 GLN HE2y A 71 LEU HD1% 1.0 . 5.81 2968 2202 A 59 GLN HE2x A 71 LEU HD1% 1.0 . 5.81 2969 2203 A 60 SER H A 60 SER HBy 1.0 . 3.55 2970 2203 A 60 SER H A 60 SER HBx 1.0 . 3.55 2971 2204 A 60 SER HA A 63 GLU HGy 1.0 . 5.81 2972 2204 A 60 SER HA A 63 GLU HGx 1.0 . 5.81 2973 2205 A 61 ALA H A 60 SER HBy 1.0 . 4.06 2974 2205 A 61 ALA H A 60 SER HBx 1.0 . 4.06 2975 2206 A 61 ALA HB% A 60 SER HBy 1.0 . 5.00 2976 2206 A 61 ALA HB% A 60 SER HBx 1.0 . 5.00 2977 2207 A 61 ALA HB% A 68 SER HBx 1.0 . 5.81 2978 2207 A 61 ALA HB% A 68 SER HBy 1.0 . 5.81 2979 2208 A 62 ILE H A 68 SER HBx 1.0 . 5.81 2980 2208 A 62 ILE H A 68 SER HBy 1.0 . 5.81 2981 2209 A 62 ILE HA A 68 SER HBx 1.0 . 5.10 2982 2209 A 62 ILE HA A 68 SER HBy 1.0 . 5.10 2983 2210 A 62 ILE HG2% A 63 GLU HGy 1.0 . 5.59 2984 2210 A 62 ILE HG2% A 63 GLU HGx 1.0 . 5.59 2985 2211 A 62 ILE HG2% A 66 PRO HBx 1.0 . 4.83 2986 2211 A 62 ILE HG2% A 66 PRO HBy 1.0 . 4.83 2987 2212 A 62 ILE HG2% A 68 SER HBx 1.0 . 5.72 2988 2212 A 62 ILE HG2% A 68 SER HBy 1.0 . 5.72 2989 2213 A 62 ILE HG2% A 74 ARG HDx 1.0 . 5.81 2990 2213 A 62 ILE HG2% A 74 ARG HDy 1.0 . 5.81 2991 2214 A 62 ILE HD1% A 74 ARG HBx 1.0 . 4.36 2992 2214 A 62 ILE HD1% A 74 ARG HBy 1.0 . 4.36 2993 2215 A 63 GLU H A 63 GLU HGy 1.0 . 3.56 2994 2215 A 63 GLU H A 63 GLU HGx 1.0 . 3.56 2995 2216 A 64 LEU HD2% A 63 GLU HGy 1.0 . 5.81 2996 2216 A 64 LEU HD2% A 63 GLU HGx 1.0 . 5.81 2997 2217 A 64 LEU H A 64 LEU HBx 1.0 . 3.49 2998 2217 A 64 LEU H A 64 LEU HBy 1.0 . 3.49 2999 2218 A 64 LEU HBy A 65 ASN HBy 1.0 . 5.61 3000 2218 A 65 ASN HBx A 64 LEU HBx 1.0 . 5.61 3001 2218 A 64 LEU HBy A 65 ASN HBx 1.0 . 5.61 3002 2218 A 64 LEU HBx A 65 ASN HBy 1.0 . 5.61 3003 2219 A 65 ASN HA A 66 PRO HGx 1.0 . 4.53 3004 2219 A 65 ASN HA A 66 PRO HGy 1.0 . 4.53 3005 2220 A 67 ASP H A 65 ASN HBy 1.0 . 5.60 3006 2220 A 67 ASP H A 65 ASN HBx 1.0 . 5.60 3007 2221 A 68 SER H A 65 ASN HBy 1.0 . 5.78 3008 2221 A 68 SER H A 65 ASN HBx 1.0 . 5.78 3009 2222 A 67 ASP H A 65 ASN HD2x 1.0 . 5.53 3010 2222 A 67 ASP H A 65 ASN HD2y 1.0 . 5.53 3011 2223 A 65 ASN HD2y A 67 ASP HBx 1.0 . 4.66 3012 2223 A 65 ASN HD2x A 67 ASP HBx 1.0 . 4.66 3013 2223 A 67 ASP HBy A 65 ASN HD2x 1.0 . 4.66 3014 2223 A 65 ASN HD2y A 67 ASP HBy 1.0 . 4.66 3015 2224 A 68 SER HA A 65 ASN HD2x 1.0 . 4.81 3016 2224 A 68 SER HA A 65 ASN HD2y 1.0 . 4.81 3017 2225 A 65 ASN HD2y A 68 SER HBx 1.0 . 4.31 3018 2225 A 65 ASN HD2x A 68 SER HBx 1.0 . 4.31 3019 2225 A 68 SER HBy A 65 ASN HD2x 1.0 . 4.31 3020 2225 A 68 SER HBy A 65 ASN HD2y 1.0 . 4.31 3021 2226 A 65 ASN HD2x A 69 PRO HDy 1.0 . 5.61 3022 2226 A 65 ASN HD2y A 69 PRO HDy 1.0 . 5.61 3023 2226 A 69 PRO HDx A 65 ASN HD2x 1.0 . 5.61 3024 2226 A 65 ASN HD2y A 69 PRO HDx 1.0 . 5.61 3025 2227 A 71 LEU HD1% A 66 PRO HBx 1.0 . 5.66 3026 2227 A 71 LEU HD1% A 66 PRO HBy 1.0 . 5.66 3027 2228 A 67 ASP H A 66 PRO HGx 1.0 . 4.59 3028 2228 A 67 ASP H A 66 PRO HGy 1.0 . 4.59 3029 2229 A 67 ASP H A 66 PRO HDx 1.0 . 4.30 3030 2229 A 67 ASP H A 66 PRO HDy 1.0 . 4.30 3031 2230 A 68 SER H A 66 PRO HDx 1.0 . 5.68 3032 2230 A 68 SER H A 66 PRO HDy 1.0 . 5.68 3033 2231 A 67 ASP H A 67 ASP HBx 1.0 . 3.40 3034 2231 A 67 ASP H A 67 ASP HBy 1.0 . 3.40 3035 2232 A 67 ASP H A 68 SER HBx 1.0 . 5.28 3036 2232 A 67 ASP H A 68 SER HBy 1.0 . 5.28 3037 2233 A 71 LEU HD1% A 67 ASP HBx 1.0 . 5.81 3038 2233 A 71 LEU HD1% A 67 ASP HBy 1.0 . 5.81 3039 2234 A 71 LEU HD2% A 67 ASP HBx 1.0 . 5.81 3040 2234 A 71 LEU HD2% A 67 ASP HBy 1.0 . 5.81 3041 2235 A 68 SER H A 68 SER HBx 1.0 . 3.59 3042 2235 A 68 SER H A 68 SER HBy 1.0 . 3.59 3043 2236 A 68 SER H A 69 PRO HDy 1.0 . 4.84 3044 2236 A 68 SER H A 69 PRO HDx 1.0 . 4.84 3045 2237 A 68 SER HA A 69 PRO HGx 1.0 . 5.03 3046 2237 A 68 SER HA A 69 PRO HGy 1.0 . 5.03 3047 2238 A 68 SER HBx A 69 PRO HGx 1.0 . 5.18 3048 2238 A 68 SER HBy A 69 PRO HGx 1.0 . 5.18 3049 2238 A 69 PRO HGy A 68 SER HBx 1.0 . 5.18 3050 2238 A 69 PRO HGy A 68 SER HBy 1.0 . 5.18 3051 2239 A 68 SER HBy A 69 PRO HDy 1.0 . 4.78 3052 2239 A 68 SER HBx A 69 PRO HDy 1.0 . 4.78 3053 2239 A 69 PRO HDx A 68 SER HBx 1.0 . 4.78 3054 2239 A 68 SER HBy A 69 PRO HDx 1.0 . 4.78 3055 2240 A 70 ALA H A 68 SER HBx 1.0 . 4.63 3056 2240 A 70 ALA H A 68 SER HBy 1.0 . 4.63 3057 2241 A 70 ALA HB% A 68 SER HBx 1.0 . 4.72 3058 2241 A 70 ALA HB% A 68 SER HBy 1.0 . 4.72 3059 2242 A 71 LEU H A 68 SER HBx 1.0 . 5.81 3060 2242 A 71 LEU H A 68 SER HBy 1.0 . 5.81 3061 2243 A 68 SER HG A 69 PRO HDy 1.0 . 5.25 3062 2243 A 68 SER HG A 69 PRO HDx 1.0 . 5.25 3063 2244 A 73 ALA HB% A 69 PRO HBx 1.0 . 5.67 3064 2244 A 73 ALA HB% A 69 PRO HBy 1.0 . 5.67 3065 2245 A 70 ALA H A 69 PRO HGx 1.0 . 4.26 3066 2245 A 70 ALA H A 69 PRO HGy 1.0 . 4.26 3067 2246 A 70 ALA H A 69 PRO HDy 1.0 . 4.00 3068 2246 A 70 ALA H A 69 PRO HDx 1.0 . 4.00 3069 2247 A 71 LEU HB2 A 72 GLN HGy 1.0 . 4.65 3070 2247 A 71 LEU HB2 A 72 GLN HGx 1.0 . 4.65 3071 2248 A 71 LEU HB2 A 72 GLN HE2y 1.0 . 4.78 3072 2248 A 71 LEU HB2 A 72 GLN HE2x 1.0 . 4.78 3073 2249 A 71 LEU HB3 A 72 GLN HBx 1.0 . 5.03 3074 2249 A 71 LEU HB3 A 72 GLN HBy 1.0 . 5.03 3075 2250 A 71 LEU HB3 A 72 GLN HGy 1.0 . 4.76 3076 2250 A 71 LEU HB3 A 72 GLN HGx 1.0 . 4.76 3077 2251 A 71 LEU HB3 A 72 GLN HE2y 1.0 . 4.92 3078 2251 A 71 LEU HB3 A 72 GLN HE2x 1.0 . 4.92 3079 2252 A 71 LEU HD1% A 72 GLN HE2y 1.0 . 5.81 3080 2252 A 71 LEU HD1% A 72 GLN HE2x 1.0 . 5.81 3081 2253 A 71 LEU HD2% A 72 GLN HGy 1.0 . 5.18 3082 2253 A 71 LEU HD2% A 72 GLN HGx 1.0 . 5.18 3083 2254 A 71 LEU HD2% A 72 GLN HE2y 1.0 . 4.14 3084 2254 A 71 LEU HD2% A 72 GLN HE2x 1.0 . 4.14 3085 2255 A 72 GLN H A 72 GLN HBx 1.0 . 3.11 3086 2255 A 72 GLN H A 72 GLN HBy 1.0 . 3.11 3087 2256 A 72 GLN H A 72 GLN HGy 1.0 . 4.31 3088 2256 A 72 GLN H A 72 GLN HGx 1.0 . 4.31 3089 2257 A 73 ALA HA A 72 GLN HBx 1.0 . 4.56 3090 2257 A 73 ALA HA A 72 GLN HBy 1.0 . 4.56 3091 2258 A 73 ALA HB% A 72 GLN HBx 1.0 . 5.55 3092 2258 A 73 ALA HB% A 72 GLN HBy 1.0 . 5.55 3093 2259 A 73 ALA HA A 76 MET HBy 1.0 . 4.36 3094 2259 A 73 ALA HA A 76 MET HBx 1.0 . 4.36 3095 2260 A 73 ALA HA A 76 MET HGx 1.0 . 5.04 3096 2260 A 73 ALA HA A 76 MET HGy 1.0 . 5.04 3097 2261 A 74 ARG H A 74 ARG HDx 1.0 . 5.81 3098 2261 A 74 ARG H A 74 ARG HDy 1.0 . 5.81 3099 2262 A 75 LYS H A 74 ARG HBx 1.0 . 4.41 3100 2262 A 75 LYS H A 74 ARG HBy 1.0 . 4.41 3101 2263 A 75 LYS H A 74 ARG HDx 1.0 . 5.81 3102 2263 A 75 LYS H A 74 ARG HDy 1.0 . 5.81 3103 2264 A 78 MET HE% A 74 ARG HDx 1.0 . 4.83 3104 2264 A 78 MET HE% A 74 ARG HDy 1.0 . 4.83 3105 2265 A 75 LYS H A 75 LYS HGx 1.0 . 4.39 3106 2265 A 75 LYS H A 75 LYS HGy 1.0 . 4.39 3107 2266 A 75 LYS HA A 78 MET HB3 1.0 . 4.21 3108 2266 A 75 LYS HA A 78 MET HB2 1.0 . 4.21 3109 2267 A 76 MET H A 75 LYS HGx 1.0 . 5.59 3110 2267 A 76 MET H A 75 LYS HGy 1.0 . 5.59 3111 2268 A 76 MET H A 76 MET HBy 1.0 . 3.51 3112 2268 A 76 MET H A 76 MET HBx 1.0 . 3.51 3113 2269 A 76 MET HA A 79 ASP HBx 1.0 . 4.33 3114 2269 A 76 MET HA A 79 ASP HBy 1.0 . 4.33 3115 2270 A 77 VAL HG2% A 76 MET HBy 1.0 . 4.93 3116 2270 A 77 VAL HG2% A 76 MET HBx 1.0 . 4.93 3117 2271 A 77 VAL H A 76 MET HGx 1.0 . 4.95 3118 2271 A 77 VAL H A 76 MET HGy 1.0 . 4.95 3119 2272 A 77 VAL HG2% A 76 MET HGx 1.0 . 5.81 3120 2272 A 77 VAL HG2% A 76 MET HGy 1.0 . 5.81 3121 2273 A 76 MET HE% A 80 ILE HG1x 1.0 . 4.53 3122 2273 A 76 MET HE% A 80 ILE HG1y 1.0 . 4.53 3123 2274 A 77 VAL HG2% A 78 MET HGx 1.0 . 5.81 3124 2274 A 77 VAL HG2% A 78 MET HGy 1.0 . 5.81 3125 2275 A 78 MET H A 78 MET HB3 1.0 . 3.68 3126 2275 A 78 MET H A 78 MET HB2 1.0 . 3.68 3127 2276 A 78 MET H A 79 ASP HBx 1.0 . 5.29 3128 2276 A 78 MET H A 79 ASP HBy 1.0 . 5.29 3129 2277 A 79 ASP H A 78 MET HB3 1.0 . 3.86 3130 2277 A 79 ASP H A 78 MET HB2 1.0 . 3.86 3131 2278 A 89 TYR HD% A 78 MET HB3 1.0 . 5.58 3132 2278 A 89 TYR HD% A 78 MET HB2 1.0 . 5.58 3133 2279 A 89 TYR HE% A 78 MET HB3 1.0 . 4.65 3134 2279 A 89 TYR HE% A 78 MET HB2 1.0 . 4.65 3135 2280 A 79 ASP H A 78 MET HGx 1.0 . 5.81 3136 2280 A 79 ASP H A 78 MET HGy 1.0 . 5.81 3137 2281 A 89 TYR HE% A 78 MET HGx 1.0 . 5.08 3138 2281 A 89 TYR HE% A 78 MET HGy 1.0 . 5.08 3139 2282 A 78 MET HE% A 92 LEU HDy% 1.0 . 5.17 3140 2282 A 78 MET HE% A 92 LEU HDx% 1.0 . 5.17 3141 2283 A 79 ASP H A 79 ASP HBx 1.0 . 3.60 3142 2283 A 79 ASP H A 79 ASP HBy 1.0 . 3.60 3143 2284 A 79 ASP HA A 82 ASN HD2x 1.0 . 5.81 3144 2284 A 79 ASP HA A 82 ASN HD2y 1.0 . 5.81 3145 2285 A 80 ILE H A 79 ASP HBx 1.0 . 4.46 3146 2285 A 80 ILE H A 79 ASP HBy 1.0 . 4.46 3147 2286 A 80 ILE HG2% A 84 TYR HBy 1.0 . 5.81 3148 2286 A 80 ILE HG2% A 84 TYR HBx 1.0 . 5.81 3149 2287 A 84 TYR HD% A 80 ILE HG1x 1.0 . 5.62 3150 2287 A 84 TYR HD% A 80 ILE HG1y 1.0 . 5.62 3151 2288 A 84 TYR HE% A 80 ILE HG1x 1.0 . 4.95 3152 2288 A 84 TYR HE% A 80 ILE HG1y 1.0 . 4.95 3153 2289 A 81 LEU HA A 84 TYR HBy 1.0 . 4.91 3154 2289 A 81 LEU HA A 84 TYR HBx 1.0 . 4.91 3155 2290 A 81 LEU HD1% A 89 TYR HBy 1.0 . 5.81 3156 2290 A 81 LEU HD1% A 89 TYR HBx 1.0 . 5.81 3157 2291 A 81 LEU HD2% A 84 TYR HBy 1.0 . 5.26 3158 2291 A 81 LEU HD2% A 84 TYR HBx 1.0 . 5.26 3159 2292 A 81 LEU HD2% A 89 TYR HBy 1.0 . 5.81 3160 2292 A 81 LEU HD2% A 89 TYR HBx 1.0 . 5.81 3161 2293 A 83 PHE H A 84 TYR HBy 1.0 . 5.81 3162 2293 A 83 PHE H A 84 TYR HBx 1.0 . 5.81 3163 2294 A 88 MET H A 85 ASN HBx 1.0 . 5.53 3164 2294 A 88 MET H A 85 ASN HBy 1.0 . 5.53 3165 2295 A 85 ASN HD2x A 88 MET HBx 1.0 . 5.57 3166 2295 A 88 MET HBy A 85 ASN HD2y 1.0 . 5.57 3167 2295 A 88 MET HBy A 85 ASN HD2x 1.0 . 5.57 3168 2295 A 85 ASN HD2y A 88 MET HBx 1.0 . 5.57 3169 2296 A 88 MET HE% A 85 ASN HD2x 1.0 . 5.49 3170 2296 A 88 MET HE% A 85 ASN HD2y 1.0 . 5.49 3171 2297 A 86 LYS HA A 89 TYR HBy 1.0 . 4.33 3172 2297 A 86 LYS HA A 89 TYR HBx 1.0 . 4.33 3173 2298 A 86 LYS HBy A 89 TYR HBy 1.0 . 5.81 3174 2298 A 86 LYS HBx A 89 TYR HBy 1.0 . 5.81 3175 2298 A 89 TYR HBx A 86 LYS HBx 1.0 . 5.81 3176 2298 A 86 LYS HBy A 89 TYR HBx 1.0 . 5.81 3177 2299 A 90 ASN HD2y A 86 LYS HBx 1.0 . 5.64 3178 2299 A 90 ASN HD2x A 86 LYS HBx 1.0 . 5.64 3179 2299 A 86 LYS HBy A 90 ASN HD2y 1.0 . 5.64 3180 2299 A 86 LYS HBy A 90 ASN HD2x 1.0 . 5.64 3181 2300 A 90 ASN HD2y A 86 LYS HGx 1.0 . 4.82 3182 2300 A 86 LYS HGy A 90 ASN HD2y 1.0 . 4.82 3183 2300 A 90 ASN HD2x A 86 LYS HGx 1.0 . 4.82 3184 2300 A 86 LYS HGy A 90 ASN HD2x 1.0 . 4.82 3185 2301 A 90 ASN HD2x A 86 LYS HDx 1.0 . 5.01 3186 2301 A 90 ASN HD2y A 86 LYS HDx 1.0 . 5.01 3187 2301 A 86 LYS HDy A 90 ASN HD2y 1.0 . 5.01 3188 2301 A 86 LYS HDy A 90 ASN HD2x 1.0 . 5.01 3189 2302 A 90 ASN HD2y A 86 LYS HEy 1.0 . 5.07 3190 2302 A 90 ASN HD2x A 86 LYS HEy 1.0 . 5.07 3191 2302 A 90 ASN HD2x A 86 LYS HEx 1.0 . 5.07 3192 2302 A 90 ASN HD2y A 86 LYS HEx 1.0 . 5.07 3193 2303 A 87 ASP H A 87 ASP HBy 1.0 . 3.37 3194 2303 A 87 ASP H A 87 ASP HBx 1.0 . 3.37 3195 2304 A 88 MET H A 87 ASP HBy 1.0 . 4.21 3196 2304 A 88 MET H A 87 ASP HBx 1.0 . 4.21 3197 2305 A 87 ASP HBx A 88 MET HBx 1.0 . 5.81 3198 2305 A 87 ASP HBy A 88 MET HBx 1.0 . 5.81 3199 2305 A 88 MET HBy A 87 ASP HBy 1.0 . 5.81 3200 2305 A 88 MET HBy A 87 ASP HBx 1.0 . 5.81 3201 2306 A 88 MET H A 89 TYR HBy 1.0 . 5.37 3202 2306 A 88 MET H A 89 TYR HBx 1.0 . 5.37 3203 2307 A 88 MET HA A 91 GLN HBx 1.0 . 4.22 3204 2307 A 88 MET HA A 91 GLN HBy 1.0 . 4.22 3205 2308 A 91 GLN HE2y A 88 MET HA 1.0 . 5.24 3206 2308 A 88 MET HA A 91 GLN HE2x 1.0 . 5.24 3207 2309 A 88 MET HGx A 92 LEU HDy% 1.0 . 5.04 3208 2309 A 88 MET HGy A 92 LEU HDy% 1.0 . 5.04 3209 2309 A 92 LEU HDx% A 88 MET HGx 1.0 . 5.04 3210 2309 A 88 MET HGy A 92 LEU HDx% 1.0 . 5.04 3211 2310 A 88 MET HE% A 89 TYR HBy 1.0 . 5.66 3212 2310 A 88 MET HE% A 89 TYR HBx 1.0 . 5.66 3213 2311 A 88 MET HE% A 92 LEU HBx 1.0 . 5.05 3214 2311 A 88 MET HE% A 92 LEU HBy 1.0 . 5.05 3215 2312 A 88 MET HE% A 92 LEU HDy% 1.0 . 4.21 3216 2312 A 88 MET HE% A 92 LEU HDx% 1.0 . 4.21 3217 2313 A 89 TYR H A 89 TYR HBy 1.0 . 3.42 3218 2313 A 89 TYR H A 89 TYR HBx 1.0 . 3.42 3219 2314 A 89 TYR HA A 92 LEU HBx 1.0 . 5.11 3220 2314 A 89 TYR HA A 92 LEU HBy 1.0 . 5.11 3221 2315 A 89 TYR HA A 92 LEU HDy% 1.0 . 4.91 3222 2315 A 89 TYR HA A 92 LEU HDx% 1.0 . 4.91 3223 2316 A 89 TYR HD% A 92 LEU HBx 1.0 . 5.81 3224 2316 A 89 TYR HD% A 92 LEU HBy 1.0 . 5.81 3225 2317 A 89 TYR HD% A 92 LEU HDy% 1.0 . 4.66 3226 2317 A 89 TYR HD% A 92 LEU HDx% 1.0 . 4.66 3227 2318 A 90 ASN HD2y A 90 ASN HA 1.0 . 4.26 3228 2318 A 90 ASN HA A 90 ASN HD2x 1.0 . 4.26 3229 2319 A 90 ASN HBy A 90 ASN HD2y 1.0 . 3.35 3230 2319 A 90 ASN HD2x A 90 ASN HBx 1.0 . 3.35 3231 2319 A 90 ASN HD2y A 90 ASN HBx 1.0 . 3.35 3232 2319 A 90 ASN HBy A 90 ASN HD2x 1.0 . 3.35 3233 2320 A 90 ASN HBy A 91 GLN HBx 1.0 . 5.72 3234 2320 A 91 GLN HBy A 90 ASN HBx 1.0 . 5.72 3235 2320 A 90 ASN HBy A 91 GLN HBy 1.0 . 5.72 3236 2320 A 90 ASN HBx A 91 GLN HBx 1.0 . 5.72 3237 2321 A 91 GLN H A 91 GLN HBx 1.0 . 3.43 3238 2321 A 91 GLN H A 91 GLN HBy 1.0 . 3.43 3239 2322 A 91 GLN HE2y A 91 GLN HA 1.0 . 5.05 3240 2322 A 91 GLN HE2x A 91 GLN HA 1.0 . 5.05 3241 2323 A 91 GLN HE2y A 91 GLN HBx 1.0 . 3.99 3242 2323 A 91 GLN HE2y A 91 GLN HBy 1.0 . 3.99 3243 2323 A 91 GLN HE2x A 91 GLN HBy 1.0 . 3.99 3244 2323 A 91 GLN HE2x A 91 GLN HBx 1.0 . 3.99 3245 2324 A 91 GLN HBx A 92 LEU HDy% 1.0 . 5.72 3246 2324 A 91 GLN HBy A 92 LEU HDy% 1.0 . 5.72 3247 2324 A 92 LEU HDx% A 91 GLN HBx 1.0 . 5.72 3248 2324 A 92 LEU HDx% A 91 GLN HBy 1.0 . 5.72 3249 2325 A 92 LEU H A 92 LEU HBx 1.0 . 3.38 3250 2325 A 92 LEU H A 92 LEU HBy 1.0 . 3.38 3251 2326 A 92 LEU H A 92 LEU HDy% 1.0 . 4.10 3252 2326 A 92 LEU H A 92 LEU HDx% 1.0 . 4.10 3253 2327 A 92 LEU HA A 92 LEU HDy% 1.0 . 3.42 3254 2327 A 92 LEU HA A 92 LEU HDx% 1.0 . 3.42 3255 2328 A 93 GLU H A 92 LEU HBx 1.0 . 3.61 3256 2328 A 93 GLU H A 92 LEU HBy 1.0 . 3.61 3257 2329 A 93 GLU H A 93 GLU HGy 1.0 . 4.65 3258 2329 A 93 GLU H A 93 GLU HGx 1.0 . 4.65 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 5 LYS H A 2 ASP O 1.0 . 2.3 2 2 A 2 ASP O A 5 LYS N 1.0 . 3.3 3 3 A 8 LYS H A 4 LEU O 1.0 . 2.3 4 4 A 4 LEU O A 8 LYS N 1.0 . 3.3 5 5 A 9 GLU H A 5 LYS O 1.0 . 2.3 6 6 A 5 LYS O A 9 GLU N 1.0 . 3.3 7 7 A 10 LEU H A 6 THR O 1.0 . 2.3 8 8 A 6 THR O A 10 LEU N 1.0 . 3.3 9 9 A 11 ILE H A 7 ILE O 1.0 . 2.3 10 10 A 7 ILE O A 11 ILE N 1.0 . 3.3 11 11 A 8 LYS O A 12 ASN N 1.0 . 3.3 12 12 A 13 GLN H A 9 GLU O 1.0 . 2.3 13 13 A 9 GLU O A 13 GLN N 1.0 . 3.3 14 14 A 14 GLY H A 10 LEU O 1.0 . 2.3 15 15 A 10 LEU O A 14 GLY N 1.0 . 3.3 16 16 A 19 ALA H A 15 ASP O 1.0 . 2.3 17 17 A 15 ASP O A 19 ALA N 1.0 . 3.3 18 18 A 20 LEU H A 16 ILE O 1.0 . 2.3 19 19 A 16 ILE O A 20 LEU N 1.0 . 3.3 20 20 A 21 GLN H A 17 GLU O 1.0 . 2.3 21 21 A 17 GLU O A 21 GLN N 1.0 . 3.3 22 22 A 22 ALA H A 18 ASN O 1.0 . 2.3 23 23 A 18 ASN O A 22 ALA N 1.0 . 3.3 24 24 A 23 LEU H A 19 ALA O 1.0 . 2.3 25 25 A 19 ALA O A 23 LEU N 1.0 . 3.3 26 26 A 24 GLU H A 20 LEU O 1.0 . 2.3 27 27 A 20 LEU O A 24 GLU N 1.0 . 3.3 28 28 A 25 GLU H A 21 GLN O 1.0 . 2.3 29 29 A 21 GLN O A 25 GLU N 1.0 . 3.3 30 30 A 26 PHE H A 22 ALA O 1.0 . 2.3 31 31 A 22 ALA O A 26 PHE N 1.0 . 3.3 32 32 A 27 LEU H A 23 LEU O 1.0 . 2.3 33 33 A 23 LEU O A 27 LEU N 1.0 . 3.3 34 34 A 28 GLN H A 25 GLU O 1.0 . 2.3 35 35 A 25 GLU O A 28 GLN N 1.0 . 3.3 36 36 A 38 TYR H A 34 LYS O 1.0 . 2.3 37 37 A 34 LYS O A 38 TYR N 1.0 . 3.3 38 38 A 39 TYR H A 35 ASP O 1.0 . 2.3 39 39 A 35 ASP O A 39 TYR N 1.0 . 3.3 40 40 A 40 LEU H A 36 GLU O 1.0 . 2.3 41 41 A 36 GLU O A 40 LEU N 1.0 . 3.3 42 42 A 41 MET H A 37 ALA O 1.0 . 2.3 43 43 A 37 ALA O A 41 MET N 1.0 . 3.3 44 44 A 42 GLY H A 38 TYR O 1.0 . 2.3 45 45 A 38 TYR O A 42 GLY N 1.0 . 3.3 46 46 A 39 TYR O A 43 ASN N 1.0 . 3.3 47 47 A 44 ALA H A 40 LEU O 1.0 . 2.3 48 48 A 40 LEU O A 44 ALA N 1.0 . 3.3 49 49 A 45 TYR H A 41 MET O 1.0 . 2.3 50 50 A 41 MET O A 45 TYR N 1.0 . 3.3 51 51 A 46 ARG H A 42 GLY O 1.0 . 2.3 52 52 A 42 GLY O A 46 ARG N 1.0 . 3.3 53 53 A 47 LYS H A 43 ASN O 1.0 . 2.3 54 54 A 43 ASN O A 47 LYS N 1.0 . 3.3 55 55 A 48 LEU H A 44 ALA O 1.0 . 2.3 56 56 A 44 ALA O A 48 LEU N 1.0 . 3.3 57 57 A 49 GLY H A 45 TYR O 1.0 . 2.3 58 58 A 45 TYR O A 49 GLY N 1.0 . 3.3 59 59 A 55 LEU H A 51 TRP O 1.0 . 2.3 60 60 A 51 TRP O A 55 LEU N 1.0 . 3.3 61 61 A 52 GLN O A 56 ASN N 1.0 . 3.3 62 62 A 53 LYS O A 57 ASN N 1.0 . 3.3 63 63 A 58 TYR H A 54 ALA O 1.0 . 2.3 64 64 A 54 ALA O A 58 TYR N 1.0 . 3.3 65 65 A 59 GLN H A 55 LEU O 1.0 . 2.3 66 66 A 55 LEU O A 59 GLN N 1.0 . 3.3 67 67 A 60 SER H A 56 ASN O 1.0 . 2.3 68 68 A 56 ASN O A 60 SER N 1.0 . 3.3 69 69 A 61 ALA H A 57 ASN O 1.0 . 2.3 70 70 A 57 ASN O A 61 ALA N 1.0 . 3.3 71 71 A 62 ILE H A 58 TYR O 1.0 . 2.3 72 72 A 58 TYR O A 62 ILE N 1.0 . 3.3 73 73 A 63 GLU H A 59 GLN O 1.0 . 2.3 74 74 A 59 GLN O A 63 GLU N 1.0 . 3.3 75 75 A 74 ARG H A 70 ALA O 1.0 . 2.3 76 76 A 70 ALA O A 74 ARG N 1.0 . 3.3 77 77 A 75 LYS H A 71 LEU O 1.0 . 2.3 78 78 A 71 LEU O A 75 LYS N 1.0 . 3.3 79 79 A 76 MET H A 72 GLN O 1.0 . 2.3 80 80 A 72 GLN O A 76 MET N 1.0 . 3.3 81 81 A 77 VAL H A 73 ALA O 1.0 . 2.3 82 82 A 73 ALA O A 77 VAL N 1.0 . 3.3 83 83 A 78 MET H A 74 ARG O 1.0 . 2.3 84 84 A 74 ARG O A 78 MET N 1.0 . 3.3 85 85 A 79 ASP H A 75 LYS O 1.0 . 2.3 86 86 A 75 LYS O A 79 ASP N 1.0 . 3.3 87 87 A 80 ILE H A 76 MET O 1.0 . 2.3 88 88 A 76 MET O A 80 ILE N 1.0 . 3.3 89 89 A 81 LEU H A 77 VAL O 1.0 . 2.3 90 90 A 77 VAL O A 81 LEU N 1.0 . 3.3 91 91 A 78 MET O A 82 ASN N 1.0 . 3.3 92 92 A 83 PHE H A 79 ASP O 1.0 . 2.3 93 93 A 79 ASP O A 83 PHE N 1.0 . 3.3 94 94 A 84 TYR H A 80 ILE O 1.0 . 2.3 95 95 A 80 ILE O A 84 TYR N 1.0 . 3.3 96 96 A 5 LYS H A 2 ASP O 1.0 . 1.5 97 97 A 2 ASP O A 5 LYS N 1.0 . 2.4 98 98 A 8 LYS H A 4 LEU O 1.0 . 1.5 99 99 A 4 LEU O A 8 LYS N 1.0 . 2.4 100 100 A 9 GLU H A 5 LYS O 1.0 . 1.5 101 101 A 5 LYS O A 9 GLU N 1.0 . 2.4 102 102 A 10 LEU H A 6 THR O 1.0 . 1.5 103 103 A 6 THR O A 10 LEU N 1.0 . 2.4 104 104 A 11 ILE H A 7 ILE O 1.0 . 1.5 105 105 A 7 ILE O A 11 ILE N 1.0 . 2.4 106 106 A 8 LYS O A 12 ASN N 1.0 . 2.4 107 107 A 13 GLN H A 9 GLU O 1.0 . 1.5 108 108 A 9 GLU O A 13 GLN N 1.0 . 2.4 109 109 A 14 GLY H A 10 LEU O 1.0 . 1.5 110 110 A 10 LEU O A 14 GLY N 1.0 . 2.4 111 111 A 19 ALA H A 15 ASP O 1.0 . 1.5 112 112 A 15 ASP O A 19 ALA N 1.0 . 2.4 113 113 A 20 LEU H A 16 ILE O 1.0 . 1.5 114 114 A 16 ILE O A 20 LEU N 1.0 . 2.4 115 115 A 21 GLN H A 17 GLU O 1.0 . 1.5 116 116 A 17 GLU O A 21 GLN N 1.0 . 2.4 117 117 A 22 ALA H A 18 ASN O 1.0 . 1.5 118 118 A 18 ASN O A 22 ALA N 1.0 . 2.4 119 119 A 23 LEU H A 19 ALA O 1.0 . 1.5 120 120 A 19 ALA O A 23 LEU N 1.0 . 2.4 121 121 A 24 GLU H A 20 LEU O 1.0 . 1.5 122 122 A 20 LEU O A 24 GLU N 1.0 . 2.4 123 123 A 25 GLU H A 21 GLN O 1.0 . 1.5 124 124 A 21 GLN O A 25 GLU N 1.0 . 2.4 125 125 A 26 PHE H A 22 ALA O 1.0 . 1.5 126 126 A 22 ALA O A 26 PHE N 1.0 . 2.4 127 127 A 27 LEU H A 23 LEU O 1.0 . 1.5 128 128 A 23 LEU O A 27 LEU N 1.0 . 2.4 129 129 A 28 GLN H A 25 GLU O 1.0 . 1.5 130 130 A 25 GLU O A 28 GLN N 1.0 . 2.4 131 131 A 38 TYR H A 34 LYS O 1.0 . 1.5 132 132 A 34 LYS O A 38 TYR N 1.0 . 2.4 133 133 A 39 TYR H A 35 ASP O 1.0 . 1.5 134 134 A 35 ASP O A 39 TYR N 1.0 . 2.4 135 135 A 40 LEU H A 36 GLU O 1.0 . 1.5 136 136 A 36 GLU O A 40 LEU N 1.0 . 2.4 137 137 A 41 MET H A 37 ALA O 1.0 . 1.5 138 138 A 37 ALA O A 41 MET N 1.0 . 2.4 139 139 A 42 GLY H A 38 TYR O 1.0 . 1.5 140 140 A 38 TYR O A 42 GLY N 1.0 . 2.4 141 141 A 39 TYR O A 43 ASN N 1.0 . 2.4 142 142 A 44 ALA H A 40 LEU O 1.0 . 1.5 143 143 A 40 LEU O A 44 ALA N 1.0 . 2.4 144 144 A 45 TYR H A 41 MET O 1.0 . 1.5 145 145 A 41 MET O A 45 TYR N 1.0 . 2.4 146 146 A 46 ARG H A 42 GLY O 1.0 . 1.5 147 147 A 42 GLY O A 46 ARG N 1.0 . 2.4 148 148 A 47 LYS H A 43 ASN O 1.0 . 1.5 149 149 A 43 ASN O A 47 LYS N 1.0 . 2.4 150 150 A 48 LEU H A 44 ALA O 1.0 . 1.5 151 151 A 44 ALA O A 48 LEU N 1.0 . 2.4 152 152 A 49 GLY H A 45 TYR O 1.0 . 1.5 153 153 A 45 TYR O A 49 GLY N 1.0 . 2.4 154 154 A 55 LEU H A 51 TRP O 1.0 . 1.5 155 155 A 51 TRP O A 55 LEU N 1.0 . 2.4 156 156 A 52 GLN O A 56 ASN N 1.0 . 2.4 157 157 A 53 LYS O A 57 ASN N 1.0 . 2.4 158 158 A 58 TYR H A 54 ALA O 1.0 . 1.5 159 159 A 54 ALA O A 58 TYR N 1.0 . 2.4 160 160 A 59 GLN H A 55 LEU O 1.0 . 1.5 161 161 A 55 LEU O A 59 GLN N 1.0 . 2.4 162 162 A 60 SER H A 56 ASN O 1.0 . 1.5 163 163 A 56 ASN O A 60 SER N 1.0 . 2.4 164 164 A 61 ALA H A 57 ASN O 1.0 . 1.5 165 165 A 57 ASN O A 61 ALA N 1.0 . 2.4 166 166 A 62 ILE H A 58 TYR O 1.0 . 1.5 167 167 A 58 TYR O A 62 ILE N 1.0 . 2.4 168 168 A 63 GLU H A 59 GLN O 1.0 . 1.5 169 169 A 59 GLN O A 63 GLU N 1.0 . 2.4 170 170 A 74 ARG H A 70 ALA O 1.0 . 1.5 171 171 A 70 ALA O A 74 ARG N 1.0 . 2.4 172 172 A 75 LYS H A 71 LEU O 1.0 . 1.5 173 173 A 71 LEU O A 75 LYS N 1.0 . 2.4 174 174 A 76 MET H A 72 GLN O 1.0 . 1.5 175 175 A 72 GLN O A 76 MET N 1.0 . 2.4 176 176 A 77 VAL H A 73 ALA O 1.0 . 1.5 177 177 A 73 ALA O A 77 VAL N 1.0 . 2.4 178 178 A 78 MET H A 74 ARG O 1.0 . 1.5 179 179 A 74 ARG O A 78 MET N 1.0 . 2.4 180 180 A 79 ASP H A 75 LYS O 1.0 . 1.5 181 181 A 75 LYS O A 79 ASP N 1.0 . 2.4 182 182 A 80 ILE H A 76 MET O 1.0 . 1.5 183 183 A 76 MET O A 80 ILE N 1.0 . 2.4 184 184 A 81 LEU H A 77 VAL O 1.0 . 1.5 185 185 A 77 VAL O A 81 LEU N 1.0 . 2.4 186 186 A 78 MET O A 82 ASN N 1.0 . 2.4 187 187 A 83 PHE H A 79 ASP O 1.0 . 1.5 188 188 A 79 ASP O A 83 PHE N 1.0 . 2.4 189 189 A 84 TYR H A 80 ILE O 1.0 . 1.5 190 190 A 80 ILE O A 84 TYR N 1.0 . 2.4 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_3 _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 2 ASP C A 3 GLN N A 3 GLN CA A 3 GLN C 1.0 -71.5 -51.5 PHI 2 2 A 3 GLN N A 3 GLN CA A 3 GLN C A 4 LEU N 1.0 -45.2 -3.5 PSI 3 3 A 3 GLN C A 4 LEU N A 4 LEU CA A 4 LEU C 1.0 -72.5 -52.5 PHI 4 4 A 4 LEU N A 4 LEU CA A 4 LEU C A 5 LYS N 1.0 -53.7 -27.4 PSI 5 5 A 4 LEU C A 5 LYS N A 5 LYS CA A 5 LYS C 1.0 -79.8 -45.7 PHI 6 6 A 5 LYS N A 5 LYS CA A 5 LYS C A 6 THR N 1.0 -55.8 -20.5 PSI 7 7 A 5 LYS C A 6 THR N A 6 THR CA A 6 THR C 1.0 -74.5 -54.5 PHI 8 8 A 6 THR N A 6 THR CA A 6 THR C A 7 ILE N 1.0 -53.8 -33.8 PSI 9 9 A 6 THR C A 7 ILE N A 7 ILE CA A 7 ILE C 1.0 -73.5 -53.5 PHI 10 10 A 7 ILE N A 7 ILE CA A 7 ILE C A 8 LYS N 1.0 -54.6 -34.0 PSI 11 11 A 7 ILE C A 8 LYS N A 8 LYS CA A 8 LYS C 1.0 -69.6 -49.6 PHI 12 12 A 8 LYS N A 8 LYS CA A 8 LYS C A 9 GLU N 1.0 -51.2 -31.2 PSI 13 13 A 8 LYS C A 9 GLU N A 9 GLU CA A 9 GLU C 1.0 -73.7 -53.6 PHI 14 14 A 9 GLU N A 9 GLU CA A 9 GLU C A 10 LEU N 1.0 -51.3 -31.3 PSI 15 15 A 9 GLU C A 10 LEU N A 10 LEU CA A 10 LEU C 1.0 -73.7 -53.7 PHI 16 16 A 10 LEU N A 10 LEU CA A 10 LEU C A 11 ILE N 1.0 -54.0 -28.2 PSI 17 17 A 10 LEU C A 11 ILE N A 11 ILE CA A 11 ILE C 1.0 -77.0 -56.5 PHI 18 18 A 11 ILE N A 11 ILE CA A 11 ILE C A 12 ASN N 1.0 -52.2 -30.6 PSI 19 19 A 11 ILE C A 12 ASN N A 12 ASN CA A 12 ASN C 1.0 -72.7 -51.6 PHI 20 20 A 12 ASN N A 12 ASN CA A 12 ASN C A 13 GLN N 1.0 -48.6 -9.1 PSI 21 21 A 15 ASP C A 16 ILE N A 16 ILE CA A 16 ILE C 1.0 -70.6 -44.3 PHI 22 22 A 16 ILE N A 16 ILE CA A 16 ILE C A 17 GLU N 1.0 -64.1 -25.3 PSI 23 23 A 16 ILE C A 17 GLU N A 17 GLU CA A 17 GLU C 1.0 -78.7 -51.6 PHI 24 24 A 17 GLU N A 17 GLU CA A 17 GLU C A 18 ASN N 1.0 -51.5 -31.5 PSI 25 25 A 17 GLU C A 18 ASN N A 18 ASN CA A 18 ASN C 1.0 -78.1 -55.7 PHI 26 26 A 18 ASN N A 18 ASN CA A 18 ASN C A 19 ALA N 1.0 -57.6 -22.6 PSI 27 27 A 18 ASN C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -74.1 -54.1 PHI 28 28 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 LEU N 1.0 -53.5 -29.2 PSI 29 29 A 19 ALA C A 20 LEU N A 20 LEU CA A 20 LEU C 1.0 -79.7 -51.7 PHI 30 30 A 20 LEU N A 20 LEU CA A 20 LEU C A 21 GLN N 1.0 -51.2 -30.5 PSI 31 31 A 20 LEU C A 21 GLN N A 21 GLN CA A 21 GLN C 1.0 -74.9 -54.9 PHI 32 32 A 21 GLN N A 21 GLN CA A 21 GLN C A 22 ALA N 1.0 -56.6 -28.6 PSI 33 33 A 21 GLN C A 22 ALA N A 22 ALA CA A 22 ALA C 1.0 -76.6 -56.6 PHI 34 34 A 22 ALA N A 22 ALA CA A 22 ALA C A 23 LEU N 1.0 -49.4 -24.3 PSI 35 35 A 22 ALA C A 23 LEU N A 23 LEU CA A 23 LEU C 1.0 -76.9 -56.1 PHI 36 36 A 23 LEU N A 23 LEU CA A 23 LEU C A 24 GLU N 1.0 -51.1 -31.1 PSI 37 37 A 23 LEU C A 24 GLU N A 24 GLU CA A 24 GLU C 1.0 -73.0 -53.0 PHI 38 38 A 24 GLU N A 24 GLU CA A 24 GLU C A 25 GLU N 1.0 -55.2 -30.6 PSI 39 39 A 24 GLU C A 25 GLU N A 25 GLU CA A 25 GLU C 1.0 -73.4 -49.8 PHI 40 40 A 25 GLU N A 25 GLU CA A 25 GLU C A 26 PHE N 1.0 -55.9 -30.4 PSI 41 41 A 25 GLU C A 26 PHE N A 26 PHE CA A 26 PHE C 1.0 -78.3 -55.1 PHI 42 42 A 26 PHE N A 26 PHE CA A 26 PHE C A 27 LEU N 1.0 -51.0 -29.9 PSI 43 43 A 26 PHE C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -74.3 -54.3 PHI 44 44 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 GLN N 1.0 -54.1 -17.4 PSI 45 45 A 27 LEU C A 28 GLN N A 28 GLN CA A 28 GLN C 1.0 -90.9 -41.5 PHI 46 46 A 28 GLN N A 28 GLN CA A 28 GLN C A 29 THR N 1.0 -54.5 -10.8 PSI 47 47 A 33 GLY C A 34 LYS N A 34 LYS CA A 34 LYS C 1.0 -74.5 -44.9 PHI 48 48 A 34 LYS N A 34 LYS CA A 34 LYS C A 35 ASP N 1.0 -62.0 -21.0 PSI 49 49 A 34 LYS C A 35 ASP N A 35 ASP CA A 35 ASP C 1.0 -74.7 -54.7 PHI 50 50 A 35 ASP N A 35 ASP CA A 35 ASP C A 36 GLU N 1.0 -55.5 -25.6 PSI 51 51 A 35 ASP C A 36 GLU N A 36 GLU CA A 36 GLU C 1.0 -72.6 -52.6 PHI 52 52 A 36 GLU N A 36 GLU CA A 36 GLU C A 37 ALA N 1.0 -56.1 -36.1 PSI 53 53 A 36 GLU C A 37 ALA N A 37 ALA CA A 37 ALA C 1.0 -80.7 -50.8 PHI 54 54 A 37 ALA N A 37 ALA CA A 37 ALA C A 38 TYR N 1.0 -52.6 -28.1 PSI 55 55 A 37 ALA C A 38 TYR N A 38 TYR CA A 38 TYR C 1.0 -77.1 -52.8 PHI 56 56 A 38 TYR N A 38 TYR CA A 38 TYR C A 39 TYR N 1.0 -58.2 -27.1 PSI 57 57 A 38 TYR C A 39 TYR N A 39 TYR CA A 39 TYR C 1.0 -73.6 -53.6 PHI 58 58 A 39 TYR N A 39 TYR CA A 39 TYR C A 40 LEU N 1.0 -57.5 -33.5 PSI 59 59 A 39 TYR C A 40 LEU N A 40 LEU CA A 40 LEU C 1.0 -78.7 -54.8 PHI 60 60 A 40 LEU N A 40 LEU CA A 40 LEU C A 41 MET N 1.0 -49.6 -29.6 PSI 61 61 A 40 LEU C A 41 MET N A 41 MET CA A 41 MET C 1.0 -74.3 -54.3 PHI 62 62 A 41 MET N A 41 MET CA A 41 MET C A 42 GLY N 1.0 -52.9 -32.9 PSI 63 63 A 41 MET C A 42 GLY N A 42 GLY CA A 42 GLY C 1.0 -75.2 -50.1 PHI 64 64 A 42 GLY N A 42 GLY CA A 42 GLY C A 43 ASN N 1.0 -52.8 -31.8 PSI 65 65 A 42 GLY C A 43 ASN N A 43 ASN CA A 43 ASN C 1.0 -76.5 -56.5 PHI 66 66 A 43 ASN N A 43 ASN CA A 43 ASN C A 44 ALA N 1.0 -55.3 -19.2 PSI 67 67 A 43 ASN C A 44 ALA N A 44 ALA CA A 44 ALA C 1.0 -75.7 -53.1 PHI 68 68 A 44 ALA N A 44 ALA CA A 44 ALA C A 45 TYR N 1.0 -52.2 -32.2 PSI 69 69 A 44 ALA C A 45 TYR N A 45 TYR CA A 45 TYR C 1.0 -71.8 -49.8 PHI 70 70 A 45 TYR N A 45 TYR CA A 45 TYR C A 46 ARG N 1.0 -54.3 -27.6 PSI 71 71 A 45 TYR C A 46 ARG N A 46 ARG CA A 46 ARG C 1.0 -75.8 -55.8 PHI 72 72 A 46 ARG N A 46 ARG CA A 46 ARG C A 47 LYS N 1.0 -54.3 -24.3 PSI 73 73 A 46 ARG C A 47 LYS N A 47 LYS CA A 47 LYS C 1.0 -74.9 -54.9 PHI 74 74 A 47 LYS N A 47 LYS CA A 47 LYS C A 48 LEU N 1.0 -53.0 -7.9 PSI 75 75 A 51 TRP C A 52 GLN N A 52 GLN CA A 52 GLN C 1.0 -71.9 -51.9 PHI 76 76 A 52 GLN N A 52 GLN CA A 52 GLN C A 53 LYS N 1.0 -54.5 -32.9 PSI 77 77 A 52 GLN C A 53 LYS N A 53 LYS CA A 53 LYS C 1.0 -76.3 -56.3 PHI 78 78 A 53 LYS N A 53 LYS CA A 53 LYS C A 54 ALA N 1.0 -46.2 -26.2 PSI 79 79 A 53 LYS C A 54 ALA N A 54 ALA CA A 54 ALA C 1.0 -78.1 -58.1 PHI 80 80 A 54 ALA N A 54 ALA CA A 54 ALA C A 55 LEU N 1.0 -51.9 -31.5 PSI 81 81 A 54 ALA C A 55 LEU N A 55 LEU CA A 55 LEU C 1.0 -80.4 -44.9 PHI 82 82 A 55 LEU N A 55 LEU CA A 55 LEU C A 56 ASN N 1.0 -51.7 -31.3 PSI 83 83 A 55 LEU C A 56 ASN N A 56 ASN CA A 56 ASN C 1.0 -73.0 -53.0 PHI 84 84 A 56 ASN N A 56 ASN CA A 56 ASN C A 57 ASN N 1.0 -51.3 -27.2 PSI 85 85 A 56 ASN C A 57 ASN N A 57 ASN CA A 57 ASN C 1.0 -77.1 -52.9 PHI 86 86 A 57 ASN N A 57 ASN CA A 57 ASN C A 58 TYR N 1.0 -57.0 -32.2 PSI 87 87 A 57 ASN C A 58 TYR N A 58 TYR CA A 58 TYR C 1.0 -77.3 -51.7 PHI 88 88 A 58 TYR N A 58 TYR CA A 58 TYR C A 59 GLN N 1.0 -53.0 -25.2 PSI 89 89 A 58 TYR C A 59 GLN N A 59 GLN CA A 59 GLN C 1.0 -82.1 -53.5 PHI 90 90 A 59 GLN N A 59 GLN CA A 59 GLN C A 60 SER N 1.0 -54.3 -18.6 PSI 91 91 A 59 GLN C A 60 SER N A 60 SER CA A 60 SER C 1.0 -73.8 -53.8 PHI 92 92 A 60 SER N A 60 SER CA A 60 SER C A 61 ALA N 1.0 -52.7 -31.9 PSI 93 93 A 60 SER C A 61 ALA N A 61 ALA CA A 61 ALA C 1.0 -75.2 -44.5 PHI 94 94 A 61 ALA N A 61 ALA CA A 61 ALA C A 62 ILE N 1.0 -56.3 -25.8 PSI 95 95 A 61 ALA C A 62 ILE N A 62 ILE CA A 62 ILE C 1.0 -72.4 -52.4 PHI 96 96 A 62 ILE N A 62 ILE CA A 62 ILE C A 63 GLU N 1.0 -54.7 -30.0 PSI 97 97 A 62 ILE C A 63 GLU N A 63 GLU CA A 63 GLU C 1.0 -93.5 -51.6 PHI 98 98 A 63 GLU N A 63 GLU CA A 63 GLU C A 64 LEU N 1.0 -54.1 -10.6 PSI 99 99 A 63 GLU C A 64 LEU N A 64 LEU CA A 64 LEU C 1.0 -97.0 -60.7 PHI 100 100 A 64 LEU N A 64 LEU CA A 64 LEU C A 65 ASN N 1.0 -56.4 7.2 PSI 101 101 A 70 ALA C A 71 LEU N A 71 LEU CA A 71 LEU C 1.0 -68.2 -48.2 PHI 102 102 A 71 LEU N A 71 LEU CA A 71 LEU C A 72 GLN N 1.0 -51.9 -27.2 PSI 103 103 A 71 LEU C A 72 GLN N A 72 GLN CA A 72 GLN C 1.0 -74.0 -54.0 PHI 104 104 A 72 GLN N A 72 GLN CA A 72 GLN C A 73 ALA N 1.0 -52.2 -31.0 PSI 105 105 A 72 GLN C A 73 ALA N A 73 ALA CA A 73 ALA C 1.0 -78.2 -54.5 PHI 106 106 A 73 ALA N A 73 ALA CA A 73 ALA C A 74 ARG N 1.0 -53.3 -30.2 PSI 107 107 A 73 ALA C A 74 ARG N A 74 ARG CA A 74 ARG C 1.0 -78.7 -46.6 PHI 108 108 A 74 ARG N A 74 ARG CA A 74 ARG C A 75 LYS N 1.0 -55.5 -27.9 PSI 109 109 A 74 ARG C A 75 LYS N A 75 LYS CA A 75 LYS C 1.0 -78.3 -45.5 PHI 110 110 A 75 LYS N A 75 LYS CA A 75 LYS C A 76 MET N 1.0 -57.1 -32.8 PSI 111 111 A 75 LYS C A 76 MET N A 76 MET CA A 76 MET C 1.0 -74.3 -54.4 PHI 112 112 A 76 MET N A 76 MET CA A 76 MET C A 77 VAL N 1.0 -50.1 -29.6 PSI 113 113 A 76 MET C A 77 VAL N A 77 VAL CA A 77 VAL C 1.0 -80.3 -56.5 PHI 114 114 A 77 VAL N A 77 VAL CA A 77 VAL C A 78 MET N 1.0 -53.5 -33.5 PSI 115 115 A 77 VAL C A 78 MET N A 78 MET CA A 78 MET C 1.0 -71.5 -51.5 PHI 116 116 A 78 MET N A 78 MET CA A 78 MET C A 79 ASP N 1.0 -56.4 -27.1 PSI 117 117 A 78 MET C A 79 ASP N A 79 ASP CA A 79 ASP C 1.0 -74.7 -54.7 PHI 118 118 A 79 ASP N A 79 ASP CA A 79 ASP C A 80 ILE N 1.0 -48.8 -28.8 PSI 119 119 A 79 ASP C A 80 ILE N A 80 ILE CA A 80 ILE C 1.0 -87.8 -47.6 PHI 120 120 A 80 ILE N A 80 ILE CA A 80 ILE C A 81 LEU N 1.0 -60.6 -21.5 PSI 121 121 A 80 ILE C A 81 LEU N A 81 LEU CA A 81 LEU C 1.0 -69.9 -49.9 PHI 122 122 A 81 LEU N A 81 LEU CA A 81 LEU C A 82 ASN N 1.0 -53.3 -26.9 PSI 123 123 A 81 LEU C A 82 ASN N A 82 ASN CA A 82 ASN C 1.0 -87.8 -43.7 PHI 124 124 A 82 ASN N A 82 ASN CA A 82 ASN C A 83 PHE N 1.0 -56.7 -28.4 PSI 125 125 A 82 ASN C A 83 PHE N A 83 PHE CA A 83 PHE C 1.0 -75.3 -52.3 PHI 126 126 A 83 PHE N A 83 PHE CA A 83 PHE C A 84 TYR N 1.0 -59.6 -19.6 PSI 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 5 LYS H A 5 LYS N 1.0 . . . 2 2 A 6 THR H A 6 THR N 1.0 . . . 3 3 A 7 ILE H A 7 ILE N 1.0 . . . 4 4 A 9 GLU H A 9 GLU N 1.0 . . . 5 5 A 10 LEU H A 10 LEU N 1.0 . . . 6 6 A 13 GLN H A 13 GLN N 1.0 . . . 7 7 A 14 GLY H A 14 GLY N 1.0 . . . 8 8 A 17 GLU H A 17 GLU N 1.0 . . . 9 9 A 19 ALA H A 19 ALA N 1.0 . . . 10 10 A 20 LEU H A 20 LEU N 1.0 . . . 11 11 A 21 GLN H A 21 GLN N 1.0 . . . 12 12 A 22 ALA H A 22 ALA N 1.0 . . . 13 13 A 23 LEU H A 23 LEU N 1.0 . . . 14 14 A 25 GLU H A 25 GLU N 1.0 . . . 15 15 A 26 PHE H A 26 PHE N 1.0 . . . 16 16 A 27 LEU H A 27 LEU N 1.0 . . . 17 17 A 28 GLN H A 28 GLN N 1.0 . . . 18 18 A 34 LYS H A 34 LYS N 1.0 . . . 19 19 A 35 ASP H A 35 ASP N 1.0 . . . 20 20 A 36 GLU H A 36 GLU N 1.0 . . . 21 21 A 37 ALA H A 37 ALA N 1.0 . . . 22 22 A 38 TYR H A 38 TYR N 1.0 . . . 23 23 A 39 TYR H A 39 TYR N 1.0 . . . 24 24 A 40 LEU H A 40 LEU N 1.0 . . . 25 25 A 41 MET H A 41 MET N 1.0 . . . 26 26 A 42 GLY H A 42 GLY N 1.0 . . . 27 27 A 44 ALA H A 44 ALA N 1.0 . . . 28 28 A 45 TYR H A 45 TYR N 1.0 . . . 29 29 A 46 ARG H A 46 ARG N 1.0 . . . 30 30 A 47 LYS H A 47 LYS N 1.0 . . . 31 31 A 48 LEU H A 48 LEU N 1.0 . . . 32 32 A 52 GLN H A 52 GLN N 1.0 . . . 33 33 A 53 LYS H A 53 LYS N 1.0 . . . 34 34 A 54 ALA H A 54 ALA N 1.0 . . . 35 35 A 55 LEU H A 55 LEU N 1.0 . . . 36 36 A 58 TYR H A 58 TYR N 1.0 . . . 37 37 A 59 GLN H A 59 GLN N 1.0 . . . 38 38 A 60 SER H A 60 SER N 1.0 . . . 39 39 A 61 ALA H A 61 ALA N 1.0 . . . 40 40 A 62 ILE H A 62 ILE N 1.0 . . . 41 41 A 63 GLU H A 63 GLU N 1.0 . . . 42 42 A 64 LEU H A 64 LEU N 1.0 . . . 43 43 A 71 LEU H A 71 LEU N 1.0 . . . 44 44 A 72 GLN H A 72 GLN N 1.0 . . . 45 45 A 73 ALA H A 73 ALA N 1.0 . . . 46 46 A 74 ARG H A 74 ARG N 1.0 . . . 47 47 A 75 LYS H A 75 LYS N 1.0 . . . 48 48 A 76 MET H A 76 MET N 1.0 . . . 49 49 A 77 VAL H A 77 VAL N 1.0 . . . 50 50 A 78 MET H A 78 MET N 1.0 . . . 51 51 A 80 ILE H A 80 ILE N 1.0 . . . stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H . 2 15N . 3 1H . stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H . 2 15N . 3 1H . stop_ save_ save_spectral_peak_list_3 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_3 _nef_nmr_spectrum.num_dimensions 3 loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H . 2 15N . 3 1H . stop_ save_