data_nef_c26031_2ncl 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 PDB 2NCL 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 27 ALA start . . 2 A 28 THR middle . . 3 A 29 GLN middle . . 4 A 30 THR middle . . 5 A 31 GLU middle . . 6 A 32 GLY middle . false 7 A 33 GLU middle . . 8 A 34 LEU middle . . 9 A 35 ARG middle . . 10 A 36 VAL middle . . 11 A 37 THR middle . . 12 A 38 GLN middle . . 13 A 39 ILE middle . . 14 A 40 LEU middle . . 15 A 41 LYS middle . . 16 A 42 GLU middle . . 17 A 43 LYS middle . . 18 A 44 PHE middle . . 19 A 45 PRO middle . false 20 A 46 ARG middle . . 21 A 47 ALA middle . . 22 A 48 THR middle . . 23 A 49 ALA middle . . 24 A 50 ILE middle . . 25 A 51 LYS middle . . 26 A 52 VAL middle . . 27 A 53 THR middle . . 28 A 54 ASP middle . . 29 A 55 ILE middle . . 30 A 56 SER middle . . 31 A 57 GLY middle . false 32 A 58 GLY middle . false 33 A 59 CYS middle . . 34 A 60 GLY middle . false 35 A 61 ALA middle . . 36 A 62 MET middle . . 37 A 63 TYR middle . . 38 A 64 GLU middle . . 39 A 65 ILE middle . . 40 A 66 LYS middle . . 41 A 67 ILE middle . . 42 A 68 GLU middle . . 43 A 69 SER middle . . 44 A 70 GLU middle . . 45 A 71 GLU middle . . 46 A 72 PHE middle . . 47 A 73 LYS middle . . 48 A 74 GLU middle . . 49 A 75 LYS middle . . 50 A 76 ARG middle . . 51 A 77 THR middle . . 52 A 78 VAL middle . . 53 A 79 GLN middle . . 54 A 80 GLN middle . . 55 A 81 HIS middle . . 56 A 82 GLN middle . . 57 A 83 MET middle . . 58 A 84 VAL middle . . 59 A 85 ASN middle . . 60 A 86 GLN middle . . 61 A 87 ALA middle . . 62 A 88 LEU middle . . 63 A 89 LYS middle . . 64 A 90 GLU middle . . 65 A 91 GLU middle . . 66 A 92 ILE middle . . 67 A 93 LYS middle . . 68 A 94 GLU middle . . 69 A 95 MET middle . . 70 A 96 HIS middle . . 71 A 97 GLY middle . false 72 A 98 LEU middle . . 73 A 99 ARG middle . . 74 A 100 ILE middle . . 75 A 101 PHE middle . . 76 A 102 THR middle . . 77 A 103 SER middle . . 78 A 104 VAL middle . . 79 A 105 PRO middle . false 80 A 106 LYS middle . . 81 A 107 ARG 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 27 ALA HA H 1 4.012 0.020 A 27 ALA HB% H 1 1.417 0.020 A 27 ALA CA C 13 51.665 0.300 A 27 ALA CB C 13 19.503 0.300 A 28 THR HA H 1 4.274 0.020 A 28 THR HB H 1 4.101 0.020 A 28 THR HG2% H 1 1.151 0.020 A 28 THR C C 13 174.236 0.300 A 28 THR CA C 13 61.643 0.300 A 28 THR CB C 13 69.482 0.300 A 28 THR CG2 C 13 21.410 0.300 A 29 GLN H H 1 8.394 0.020 A 29 GLN HA H 1 4.673 0.020 A 29 GLN HBx H 1 1.874 0.020 A 29 GLN HBy H 1 2.142 0.020 A 29 GLN HE21 H 1 7.510 0.020 A 29 GLN HE22 H 1 6.710 0.020 A 29 GLN HGx H 1 2.310 0.020 A 29 GLN HGy H 1 2.369 0.020 A 29 GLN C C 13 176.344 0.300 A 29 GLN CA C 13 55.783 0.300 A 29 GLN CB C 13 31.427 0.300 A 29 GLN CG C 13 34.890 0.300 A 29 GLN N N 15 123.443 0.300 A 29 GLN NE2 N 15 111.800 0.300 A 30 THR H H 1 9.253 0.020 A 30 THR HA H 1 4.389 0.020 A 30 THR HB H 1 4.680 0.020 A 30 THR HG2% H 1 1.239 0.020 A 30 THR C C 13 174.880 0.300 A 30 THR CA C 13 60.544 0.300 A 30 THR CB C 13 70.437 0.300 A 30 THR CG2 C 13 22.018 0.300 A 30 THR N N 15 114.633 0.300 A 31 GLU H H 1 8.901 0.020 A 31 GLU HA H 1 3.919 0.020 A 31 GLU HBy H 1 1.980 0.020 A 31 GLU HBx H 1 1.940 0.020 A 31 GLU HGy H 1 2.302 0.020 A 31 GLU HGx H 1 2.206 0.020 A 31 GLU C C 13 179.428 0.300 A 31 GLU CA C 13 59.539 0.300 A 31 GLU CB C 13 28.871 0.300 A 31 GLU CG C 13 36.042 0.300 A 31 GLU N N 15 120.392 0.300 A 32 GLY H H 1 8.551 0.020 A 32 GLY HAx H 1 3.755 0.020 A 32 GLY HAy H 1 3.828 0.020 A 32 GLY C C 13 175.276 0.300 A 32 GLY CA C 13 46.973 0.300 A 32 GLY N N 15 107.333 0.300 A 33 GLU H H 1 8.094 0.020 A 33 GLU HA H 1 3.578 0.020 A 33 GLU HBx H 1 1.839 0.020 A 33 GLU HBy H 1 2.468 0.020 A 33 GLU HGy H 1 2.673 0.020 A 33 GLU HGx H 1 2.113 0.020 A 33 GLU C C 13 180.760 0.300 A 33 GLU CA C 13 59.356 0.300 A 33 GLU CB C 13 29.835 0.300 A 33 GLU CG C 13 37.838 0.300 A 33 GLU N N 15 120.504 0.300 A 34 LEU H H 1 8.281 0.020 A 34 LEU HA H 1 3.812 0.020 A 34 LEU HBy H 1 1.686 0.020 A 34 LEU HBx H 1 1.544 0.020 A 34 LEU HDx% H 1 0.774 0.020 A 34 LEU HD2% H 1 0.786 0.020 A 34 LEU HG H 1 1.515 0.020 A 34 LEU C C 13 178.510 0.300 A 34 LEU CA C 13 58.122 0.300 A 34 LEU CB C 13 41.337 0.300 A 34 LEU CD1 C 13 24.106 0.300 A 34 LEU CD2 C 13 23.259 0.300 A 34 LEU CG C 13 26.496 0.300 A 34 LEU N N 15 121.855 0.300 A 35 ARG H H 1 8.203 0.020 A 35 ARG HA H 1 3.934 0.020 A 35 ARG HB2 H 1 1.813 0.020 A 35 ARG HB3 H 1 1.813 0.020 A 35 ARG HDy H 1 3.203 0.020 A 35 ARG HDx H 1 3.067 0.020 A 35 ARG HGy H 1 1.548 0.020 A 35 ARG HGx H 1 1.397 0.020 A 35 ARG C C 13 178.409 0.300 A 35 ARG CA C 13 59.175 0.300 A 35 ARG CB C 13 29.798 0.300 A 35 ARG CD C 13 42.697 0.300 A 35 ARG CG C 13 27.248 0.300 A 35 ARG N N 15 121.316 0.300 A 36 VAL H H 1 8.127 0.020 A 36 VAL HA H 1 3.182 0.020 A 36 VAL HB H 1 1.578 0.020 A 36 VAL HG1% H 1 0.327 0.020 A 36 VAL HG2% H 1 0.454 0.020 A 36 VAL C C 13 177.214 0.300 A 36 VAL CA C 13 66.712 0.300 A 36 VAL CB C 13 31.040 0.300 A 36 VAL CG1 C 13 22.316 0.300 A 36 VAL CG2 C 13 21.842 0.300 A 36 VAL N N 15 118.084 0.300 A 37 THR H H 1 7.766 0.020 A 37 THR HA H 1 4.281 0.020 A 37 THR HB H 1 3.437 0.020 A 37 THR HG2% H 1 1.079 0.020 A 37 THR C C 13 174.631 0.300 A 37 THR CA C 13 68.220 0.300 A 37 THR CB C 13 68.024 0.300 A 37 THR CG2 C 13 20.366 0.300 A 37 THR N N 15 115.067 0.300 A 38 GLN H H 1 7.975 0.020 A 38 GLN HA H 1 3.780 0.020 A 38 GLN HBy H 1 2.128 0.020 A 38 GLN HBx H 1 2.033 0.020 A 38 GLN HE21 H 1 7.524 0.020 A 38 GLN HE22 H 1 6.780 0.020 A 38 GLN HGy H 1 2.371 0.020 A 38 GLN HGx H 1 2.297 0.020 A 38 GLN C C 13 178.410 0.300 A 38 GLN CA C 13 58.951 0.300 A 38 GLN CB C 13 27.478 0.300 A 38 GLN CG C 13 33.123 0.300 A 38 GLN N N 15 119.900 0.300 A 38 GLN NE2 N 15 111.526 0.300 A 39 ILE H H 1 7.757 0.020 A 39 ILE HA H 1 3.649 0.020 A 39 ILE HB H 1 1.646 0.020 A 39 ILE HD1% H 1 0.668 0.020 A 39 ILE HG1x H 1 0.999 0.020 A 39 ILE HG1y H 1 1.644 0.020 A 39 ILE HG2% H 1 0.751 0.020 A 39 ILE C C 13 178.334 0.300 A 39 ILE CA C 13 64.519 0.300 A 39 ILE CB C 13 37.924 0.300 A 39 ILE CD1 C 13 13.770 0.300 A 39 ILE CG1 C 13 28.150 0.300 A 39 ILE CG2 C 13 17.598 0.300 A 39 ILE N N 15 119.603 0.300 A 40 LEU H H 1 7.950 0.020 A 40 LEU HA H 1 3.983 0.020 A 40 LEU HBy H 1 2.031 0.020 A 40 LEU HBx H 1 1.218 0.020 A 40 LEU HDx% H 1 0.602 0.020 A 40 LEU HD2% H 1 0.819 0.020 A 40 LEU HG H 1 1.906 0.020 A 40 LEU C C 13 178.009 0.300 A 40 LEU CA C 13 57.879 0.300 A 40 LEU CB C 13 41.708 0.300 A 40 LEU CD1 C 13 27.543 0.300 A 40 LEU CD2 C 13 22.131 0.300 A 40 LEU CG C 13 25.902 0.300 A 40 LEU N N 15 117.998 0.300 A 41 LYS H H 1 8.506 0.020 A 41 LYS HA H 1 3.778 0.020 A 41 LYS HBy H 1 1.781 0.020 A 41 LYS HBx H 1 1.731 0.020 A 41 LYS HDy H 1 1.585 0.020 A 41 LYS HDx H 1 1.513 0.020 A 41 LYS HEx H 1 2.817 0.020 A 41 LYS HEy H 1 2.929 0.020 A 41 LYS HGy H 1 1.481 0.020 A 41 LYS HGx H 1 1.315 0.020 A 41 LYS C C 13 178.645 0.300 A 41 LYS CA C 13 58.853 0.300 A 41 LYS CB C 13 31.973 0.300 A 41 LYS CD C 13 28.812 0.300 A 41 LYS CE C 13 41.648 0.300 A 41 LYS CG C 13 25.248 0.300 A 41 LYS N N 15 119.079 0.300 A 42 GLU H H 1 7.394 0.020 A 42 GLU HA H 1 3.902 0.020 A 42 GLU HBx H 1 1.966 0.020 A 42 GLU HBy H 1 2.056 0.020 A 42 GLU HGy H 1 2.334 0.020 A 42 GLU HGx H 1 2.087 0.020 A 42 GLU C C 13 178.350 0.300 A 42 GLU CA C 13 58.222 0.300 A 42 GLU CB C 13 29.245 0.300 A 42 GLU CG C 13 36.081 0.300 A 42 GLU N N 15 116.511 0.300 A 43 LYS H H 1 7.825 0.020 A 43 LYS HA H 1 3.920 0.020 A 43 LYS HBy H 1 1.512 0.020 A 43 LYS HBx H 1 1.282 0.020 A 43 LYS HDx H 1 1.406 0.020 A 43 LYS HDy H 1 1.513 0.020 A 43 LYS HEy H 1 2.891 0.020 A 43 LYS HEx H 1 2.870 0.020 A 43 LYS HGy H 1 1.422 0.020 A 43 LYS HGx H 1 1.249 0.020 A 43 LYS C C 13 175.427 0.300 A 43 LYS CA C 13 56.066 0.300 A 43 LYS CB C 13 32.406 0.300 A 43 LYS CD C 13 28.160 0.300 A 43 LYS CE C 13 41.903 0.300 A 43 LYS CG C 13 24.940 0.300 A 43 LYS N N 15 116.802 0.300 A 44 PHE H H 1 8.130 0.020 A 44 PHE HA H 1 4.814 0.020 A 44 PHE HBx H 1 2.853 0.020 A 44 PHE HBy H 1 3.053 0.020 A 44 PHE HD1 H 1 7.176 0.020 A 44 PHE HD2 H 1 7.176 0.020 A 44 PHE HE1 H 1 6.880 0.020 A 44 PHE HE2 H 1 6.880 0.020 A 44 PHE HZ H 1 6.760 0.020 A 44 PHE C C 13 173.725 0.300 A 44 PHE CA C 13 56.062 0.300 A 44 PHE CB C 13 37.238 0.300 A 44 PHE N N 15 117.654 0.300 A 45 PRO HA H 1 4.459 0.020 A 45 PRO HBx H 1 1.888 0.020 A 45 PRO HBy H 1 2.199 0.020 A 45 PRO HDy H 1 3.496 0.020 A 45 PRO HDx H 1 3.033 0.020 A 45 PRO HGx H 1 1.694 0.020 A 45 PRO HGy H 1 1.868 0.020 A 45 PRO C C 13 178.342 0.300 A 45 PRO CA C 13 64.184 0.300 A 45 PRO CB C 13 31.655 0.300 A 45 PRO CD C 13 50.318 0.300 A 45 PRO CG C 13 26.823 0.300 A 46 ARG H H 1 8.710 0.020 A 46 ARG HA H 1 4.288 0.020 A 46 ARG HBy H 1 1.921 0.020 A 46 ARG HBx H 1 1.343 0.020 A 46 ARG HDy H 1 3.075 0.020 A 46 ARG HDx H 1 2.996 0.020 A 46 ARG HGy H 1 1.457 0.020 A 46 ARG HGx H 1 1.324 0.020 A 46 ARG C C 13 176.710 0.300 A 46 ARG CA C 13 54.969 0.300 A 46 ARG CB C 13 29.210 0.300 A 46 ARG CD C 13 43.108 0.300 A 46 ARG CG C 13 26.967 0.300 A 46 ARG N N 15 116.625 0.300 A 47 ALA H H 1 7.738 0.020 A 47 ALA HA H 1 4.254 0.020 A 47 ALA HB% H 1 1.371 0.020 A 47 ALA C C 13 178.076 0.300 A 47 ALA CA C 13 53.507 0.300 A 47 ALA CB C 13 18.129 0.300 A 47 ALA N N 15 124.605 0.300 A 48 THR H H 1 8.515 0.020 A 48 THR HA H 1 4.146 0.020 A 48 THR HB H 1 4.091 0.020 A 48 THR HG2% H 1 1.183 0.020 A 48 THR C C 13 175.612 0.300 A 48 THR CA C 13 62.417 0.300 A 48 THR CB C 13 68.210 0.300 A 48 THR CG2 C 13 22.896 0.300 A 48 THR N N 15 114.737 0.300 A 49 ALA H H 1 7.431 0.020 A 49 ALA HA H 1 4.455 0.020 A 49 ALA HB% H 1 1.158 0.020 A 49 ALA C C 13 175.168 0.300 A 49 ALA CA C 13 52.868 0.300 A 49 ALA CB C 13 21.159 0.300 A 49 ALA N N 15 122.515 0.300 A 50 ILE H H 1 8.130 0.020 A 50 ILE HA H 1 4.532 0.020 A 50 ILE HB H 1 1.501 0.020 A 50 ILE HD1% H 1 0.722 0.020 A 50 ILE HG1y H 1 1.481 0.020 A 50 ILE HG1x H 1 0.741 0.020 A 50 ILE HG2% H 1 0.706 0.020 A 50 ILE C C 13 174.140 0.300 A 50 ILE CA C 13 61.184 0.300 A 50 ILE CB C 13 41.809 0.300 A 50 ILE CD1 C 13 14.223 0.300 A 50 ILE CG1 C 13 27.574 0.300 A 50 ILE CG2 C 13 17.911 0.300 A 50 ILE N N 15 121.551 0.300 A 51 LYS H H 1 9.165 0.020 A 51 LYS HA H 1 4.545 0.020 A 51 LYS HBy H 1 1.652 0.020 A 51 LYS HBx H 1 1.560 0.020 A 51 LYS HDx H 1 1.506 0.020 A 51 LYS HDy H 1 1.520 0.020 A 51 LYS HE2 H 1 2.784 0.020 A 51 LYS HE3 H 1 2.784 0.020 A 51 LYS HG2 H 1 1.233 0.020 A 51 LYS HG3 H 1 1.233 0.020 A 51 LYS C C 13 173.919 0.300 A 51 LYS CA C 13 55.426 0.300 A 51 LYS CB C 13 35.349 0.300 A 51 LYS CD C 13 28.722 0.300 A 51 LYS CE C 13 41.656 0.300 A 51 LYS CG C 13 24.340 0.300 A 51 LYS N N 15 129.068 0.300 A 52 VAL H H 1 8.504 0.020 A 52 VAL HA H 1 4.736 0.020 A 52 VAL HB H 1 1.712 0.020 A 52 VAL HG1% H 1 0.657 0.020 A 52 VAL HG2% H 1 0.630 0.020 A 52 VAL C C 13 174.502 0.300 A 52 VAL CA C 13 60.864 0.300 A 52 VAL CB C 13 33.819 0.300 A 52 VAL CG1 C 13 21.792 0.300 A 52 VAL CG2 C 13 21.581 0.300 A 52 VAL N N 15 128.257 0.300 A 53 THR H H 1 8.855 0.020 A 53 THR HA H 1 4.788 0.020 A 53 THR HB H 1 3.780 0.020 A 53 THR HG2% H 1 1.091 0.020 A 53 THR C C 13 173.526 0.300 A 53 THR CA C 13 60.532 0.300 A 53 THR CB C 13 71.567 0.300 A 53 THR CG2 C 13 21.155 0.300 A 53 THR N N 15 121.708 0.300 A 54 ASP H H 1 11.385 0.020 A 54 ASP HA H 1 4.404 0.020 A 54 ASP HBy H 1 2.940 0.020 A 54 ASP HBx H 1 2.323 0.020 A 54 ASP C C 13 176.566 0.300 A 54 ASP CA C 13 54.463 0.300 A 54 ASP CB C 13 39.418 0.300 A 54 ASP N N 15 130.748 0.300 A 55 ILE H H 1 7.937 0.020 A 55 ILE HA H 1 4.652 0.020 A 55 ILE HB H 1 2.107 0.020 A 55 ILE HD1% H 1 0.713 0.020 A 55 ILE HG1y H 1 0.910 0.020 A 55 ILE HG1x H 1 0.549 0.020 A 55 ILE HG2% H 1 0.772 0.020 A 55 ILE C C 13 175.057 0.300 A 55 ILE CA C 13 61.001 0.300 A 55 ILE CB C 13 36.276 0.300 A 55 ILE CD1 C 13 13.510 0.300 A 55 ILE CG1 C 13 26.121 0.300 A 55 ILE CG2 C 13 17.499 0.300 A 55 ILE N N 15 123.664 0.300 A 56 SER H H 1 9.400 0.020 A 56 SER HA H 1 4.662 0.020 A 56 SER HBy H 1 4.136 0.020 A 56 SER HBx H 1 3.396 0.020 A 56 SER C C 13 175.119 0.300 A 56 SER CA C 13 56.523 0.300 A 56 SER CB C 13 64.537 0.300 A 56 SER N N 15 117.981 0.300 A 57 GLY H H 1 8.516 0.020 A 57 GLY HAy H 1 3.915 0.020 A 57 GLY HAx H 1 3.688 0.020 A 57 GLY C C 13 175.080 0.300 A 57 GLY CA C 13 46.060 0.300 A 57 GLY N N 15 111.641 0.300 A 58 GLY H H 1 7.661 0.020 A 58 GLY HAy H 1 4.247 0.020 A 58 GLY HAx H 1 3.407 0.020 A 58 GLY C C 13 174.502 0.300 A 58 GLY CA C 13 45.570 0.300 A 58 GLY N N 15 106.115 0.300 A 59 CYS H H 1 7.020 0.020 A 59 CYS HA H 1 4.473 0.020 A 59 CYS HBy H 1 2.912 0.020 A 59 CYS HBx H 1 2.834 0.020 A 59 CYS C C 13 175.368 0.300 A 59 CYS CA C 13 58.541 0.300 A 59 CYS CB C 13 27.770 0.300 A 59 CYS N N 15 114.761 0.300 A 60 GLY H H 1 9.370 0.020 A 60 GLY HAy H 1 3.767 0.020 A 60 GLY HAx H 1 3.185 0.020 A 60 GLY C C 13 172.663 0.300 A 60 GLY CA C 13 45.436 0.300 A 60 GLY N N 15 113.138 0.300 A 61 ALA H H 1 7.730 0.020 A 61 ALA HA H 1 4.216 0.020 A 61 ALA HB% H 1 1.186 0.020 A 61 ALA C C 13 177.156 0.300 A 61 ALA CA C 13 52.548 0.300 A 61 ALA CB C 13 19.803 0.300 A 61 ALA N N 15 120.750 0.300 A 62 MET H H 1 7.077 0.020 A 62 MET HA H 1 4.854 0.020 A 62 MET HB2 H 1 1.561 0.020 A 62 MET HB3 H 1 1.561 0.020 A 62 MET HE% H 1 1.870 0.020 A 62 MET HGy H 1 2.251 0.020 A 62 MET HGx H 1 2.084 0.020 A 62 MET C C 13 173.703 0.300 A 62 MET CA C 13 54.507 0.300 A 62 MET CB C 13 36.533 0.300 A 62 MET CE C 13 16.618 0.300 A 62 MET CG C 13 31.390 0.300 A 62 MET N N 15 114.614 0.300 A 63 TYR H H 1 7.568 0.020 A 63 TYR HA H 1 5.265 0.020 A 63 TYR HBy H 1 2.529 0.020 A 63 TYR HBx H 1 2.342 0.020 A 63 TYR HD1 H 1 6.581 0.020 A 63 TYR HD2 H 1 6.581 0.020 A 63 TYR HE1 H 1 6.361 0.020 A 63 TYR HE2 H 1 6.361 0.020 A 63 TYR C C 13 173.969 0.300 A 63 TYR CA C 13 56.523 0.300 A 63 TYR CB C 13 42.229 0.300 A 63 TYR N N 15 118.752 0.300 A 64 GLU H H 1 9.509 0.020 A 64 GLU HA H 1 5.245 0.020 A 64 GLU HBx H 1 2.002 0.020 A 64 GLU HBy H 1 2.044 0.020 A 64 GLU HGy H 1 2.205 0.020 A 64 GLU HGx H 1 1.875 0.020 A 64 GLU C C 13 175.035 0.300 A 64 GLU CA C 13 54.650 0.300 A 64 GLU CB C 13 32.466 0.300 A 64 GLU CG C 13 38.126 0.300 A 64 GLU N N 15 122.144 0.300 A 65 ILE H H 1 9.125 0.020 A 65 ILE HA H 1 4.607 0.020 A 65 ILE HB H 1 1.577 0.020 A 65 ILE HD1% H 1 0.520 0.020 A 65 ILE HG1y H 1 1.207 0.020 A 65 ILE HG1x H 1 1.009 0.020 A 65 ILE HG2% H 1 0.559 0.020 A 65 ILE C C 13 173.304 0.300 A 65 ILE CA C 13 59.082 0.300 A 65 ILE CB C 13 40.172 0.300 A 65 ILE CD1 C 13 14.098 0.300 A 65 ILE CG1 C 13 27.112 0.300 A 65 ILE CG2 C 13 17.472 0.300 A 65 ILE N N 15 128.373 0.300 A 66 LYS H H 1 8.990 0.020 A 66 LYS HA H 1 5.516 0.020 A 66 LYS HBx H 1 1.639 0.020 A 66 LYS HBy H 1 1.666 0.020 A 66 LYS HDx H 1 1.360 0.020 A 66 LYS HDy H 1 1.382 0.020 A 66 LYS HEy H 1 2.476 0.020 A 66 LYS HEx H 1 2.354 0.020 A 66 LYS HGy H 1 1.317 0.020 A 66 LYS HGx H 1 1.138 0.020 A 66 LYS C C 13 175.346 0.300 A 66 LYS CA C 13 54.330 0.300 A 66 LYS CB C 13 33.857 0.300 A 66 LYS CD C 13 29.330 0.300 A 66 LYS CE C 13 41.344 0.300 A 66 LYS CG C 13 24.943 0.300 A 66 LYS N N 15 126.873 0.300 A 67 ILE H H 1 8.292 0.020 A 67 ILE HA H 1 4.904 0.020 A 67 ILE HB H 1 1.404 0.020 A 67 ILE HD1% H 1 0.295 0.020 A 67 ILE HG1x H 1 0.726 0.020 A 67 ILE HG1y H 1 1.430 0.020 A 67 ILE HG2% H 1 0.607 0.020 A 67 ILE C C 13 172.593 0.300 A 67 ILE CA C 13 59.301 0.300 A 67 ILE CB C 13 41.682 0.300 A 67 ILE CD1 C 13 14.971 0.300 A 67 ILE CG1 C 13 26.989 0.300 A 67 ILE CG2 C 13 16.131 0.300 A 67 ILE N N 15 121.723 0.300 A 68 GLU H H 1 8.577 0.020 A 68 GLU HA H 1 5.271 0.020 A 68 GLU HBy H 1 1.816 0.020 A 68 GLU HBx H 1 1.655 0.020 A 68 GLU HGy H 1 1.749 0.020 A 68 GLU HGx H 1 1.700 0.020 A 68 GLU C C 13 175.745 0.300 A 68 GLU CA C 13 53.325 0.300 A 68 GLU CB C 13 32.772 0.300 A 68 GLU CG C 13 36.349 0.300 A 68 GLU N N 15 129.053 0.300 A 69 SER H H 1 8.743 0.020 A 69 SER HA H 1 4.672 0.020 A 69 SER HBy H 1 3.358 0.020 A 69 SER HBx H 1 2.689 0.020 A 69 SER C C 13 175.271 0.300 A 69 SER CA C 13 57.391 0.300 A 69 SER CB C 13 62.943 0.300 A 69 SER N N 15 115.327 0.300 A 70 GLU H H 1 9.744 0.020 A 70 GLU HA H 1 4.055 0.020 A 70 GLU HBx H 1 1.960 0.020 A 70 GLU HBy H 1 2.013 0.020 A 70 GLU HGy H 1 2.211 0.020 A 70 GLU HGx H 1 2.151 0.020 A 70 GLU C C 13 177.987 0.300 A 70 GLU CA C 13 58.657 0.300 A 70 GLU CB C 13 29.161 0.300 A 70 GLU CG C 13 35.638 0.300 A 70 GLU N N 15 129.533 0.300 A 71 GLU H H 1 8.999 0.020 A 71 GLU HA H 1 3.932 0.020 A 71 GLU HBy H 1 1.654 0.020 A 71 GLU HBx H 1 1.579 0.020 A 71 GLU HGy H 1 1.902 0.020 A 71 GLU HGx H 1 1.656 0.020 A 71 GLU C C 13 176.098 0.300 A 71 GLU CA C 13 57.939 0.300 A 71 GLU CB C 13 28.561 0.300 A 71 GLU CG C 13 36.683 0.300 A 71 GLU N N 15 119.504 0.300 A 72 PHE H H 1 6.983 0.020 A 72 PHE HA H 1 4.529 0.020 A 72 PHE HBy H 1 3.244 0.020 A 72 PHE HBx H 1 2.835 0.020 A 72 PHE HD1 H 1 7.240 0.020 A 72 PHE HD2 H 1 7.240 0.020 A 72 PHE HE1 H 1 7.095 0.020 A 72 PHE HE2 H 1 7.095 0.020 A 72 PHE HZ H 1 6.240 0.020 A 72 PHE C C 13 175.140 0.300 A 72 PHE CA C 13 55.493 0.300 A 72 PHE CB C 13 37.633 0.300 A 72 PHE N N 15 115.889 0.300 A 73 LYS H H 1 7.501 0.020 A 73 LYS HA H 1 3.900 0.020 A 73 LYS HB2 H 1 1.840 0.020 A 73 LYS HB3 H 1 1.840 0.020 A 73 LYS HDy H 1 1.684 0.020 A 73 LYS HDx H 1 1.669 0.020 A 73 LYS HEx H 1 2.802 0.020 A 73 LYS HEy H 1 2.897 0.020 A 73 LYS HG2 H 1 1.485 0.020 A 73 LYS HG3 H 1 1.485 0.020 A 73 LYS C C 13 176.137 0.300 A 73 LYS CA C 13 58.442 0.300 A 73 LYS CB C 13 32.609 0.300 A 73 LYS CD C 13 29.719 0.300 A 73 LYS CE C 13 41.365 0.300 A 73 LYS CG C 13 25.203 0.300 A 73 LYS N N 15 120.336 0.300 A 74 GLU H H 1 8.745 0.020 A 74 GLU HA H 1 3.904 0.020 A 74 GLU HBy H 1 2.218 0.020 A 74 GLU HBx H 1 2.015 0.020 A 74 GLU HGy H 1 2.144 0.020 A 74 GLU HGx H 1 2.131 0.020 A 74 GLU C C 13 175.048 0.300 A 74 GLU CA C 13 57.117 0.300 A 74 GLU CB C 13 27.154 0.300 A 74 GLU CG C 13 36.365 0.300 A 74 GLU N N 15 115.890 0.300 A 75 LYS H H 1 7.440 0.020 A 75 LYS HA H 1 4.612 0.020 A 75 LYS HBy H 1 1.791 0.020 A 75 LYS HBx H 1 1.607 0.020 A 75 LYS HDy H 1 1.508 0.020 A 75 LYS HDx H 1 1.490 0.020 A 75 LYS HE2 H 1 2.997 0.020 A 75 LYS HE3 H 1 2.997 0.020 A 75 LYS HGy H 1 1.448 0.020 A 75 LYS HGx H 1 1.340 0.020 A 75 LYS C C 13 176.881 0.300 A 75 LYS CA C 13 53.781 0.300 A 75 LYS CB C 13 34.664 0.300 A 75 LYS CD C 13 28.796 0.300 A 75 LYS CE C 13 42.235 0.300 A 75 LYS CG C 13 24.651 0.300 A 75 LYS N N 15 117.415 0.300 A 76 ARG H H 1 8.792 0.020 A 76 ARG HA H 1 4.347 0.020 A 76 ARG HBy H 1 2.109 0.020 A 76 ARG HBx H 1 1.610 0.020 A 76 ARG HD2 H 1 3.156 0.020 A 76 ARG HD3 H 1 3.156 0.020 A 76 ARG HGx H 1 1.693 0.020 A 76 ARG HGy H 1 1.735 0.020 A 76 ARG C C 13 178.209 0.300 A 76 ARG CA C 13 55.381 0.300 A 76 ARG CB C 13 30.540 0.300 A 76 ARG CD C 13 42.508 0.300 A 76 ARG CG C 13 26.718 0.300 A 76 ARG N N 15 122.653 0.300 A 77 THR HA H 1 3.819 0.020 A 77 THR HB H 1 3.179 0.020 A 77 THR HG2% H 1 0.608 0.020 A 77 THR C C 13 175.434 0.300 A 77 THR CA C 13 67.427 0.300 A 77 THR CB C 13 67.981 0.300 A 77 THR CG2 C 13 21.222 0.300 A 78 VAL H H 1 8.291 0.020 A 78 VAL HA H 1 3.607 0.020 A 78 VAL HB H 1 1.850 0.020 A 78 VAL HG1% H 1 0.806 0.020 A 78 VAL HG2% H 1 0.859 0.020 A 78 VAL C C 13 177.854 0.300 A 78 VAL CA C 13 65.341 0.300 A 78 VAL CB C 13 30.773 0.300 A 78 VAL CG1 C 13 20.828 0.300 A 78 VAL CG2 C 13 20.755 0.300 A 78 VAL N N 15 116.135 0.300 A 79 GLN H H 1 6.710 0.020 A 79 GLN HA H 1 4.107 0.020 A 79 GLN HBy H 1 2.344 0.020 A 79 GLN HBx H 1 2.017 0.020 A 79 GLN HE21 H 1 7.659 0.020 A 79 GLN HE22 H 1 6.960 0.020 A 79 GLN HGy H 1 2.405 0.020 A 79 GLN HGx H 1 2.263 0.020 A 79 GLN C C 13 178.535 0.300 A 79 GLN CA C 13 58.076 0.300 A 79 GLN CB C 13 29.176 0.300 A 79 GLN CG C 13 36.096 0.300 A 79 GLN N N 15 119.013 0.300 A 79 GLN NE2 N 15 112.895 0.300 A 80 GLN H H 1 7.939 0.020 A 80 GLN HA H 1 3.954 0.020 A 80 GLN HBy H 1 2.110 0.020 A 80 GLN HBx H 1 1.175 0.020 A 80 GLN HE21 H 1 7.444 0.020 A 80 GLN HE22 H 1 6.794 0.020 A 80 GLN HG2 H 1 2.363 0.020 A 80 GLN HG3 H 1 2.363 0.020 A 80 GLN C C 13 177.940 0.300 A 80 GLN CA C 13 58.465 0.300 A 80 GLN CB C 13 26.975 0.300 A 80 GLN CG C 13 33.125 0.300 A 80 GLN N N 15 119.825 0.300 A 80 GLN NE2 N 15 111.780 0.300 A 81 HIS H H 1 8.306 0.020 A 81 HIS HA H 1 3.951 0.020 A 81 HIS HBy H 1 2.982 0.020 A 81 HIS HBx H 1 2.839 0.020 A 81 HIS HD2 H 1 6.678 0.020 A 81 HIS HE1 H 1 7.452 0.020 A 81 HIS C C 13 177.811 0.300 A 81 HIS CA C 13 58.762 0.300 A 81 HIS CB C 13 30.169 0.300 A 81 HIS N N 15 116.655 0.300 A 81 HIS ND1 N 15 237.803 0.300 A 81 HIS NE2 N 15 169.330 0.300 A 82 GLN H H 1 7.934 0.020 A 82 GLN HA H 1 4.091 0.020 A 82 GLN HBy H 1 2.173 0.020 A 82 GLN HBx H 1 2.129 0.020 A 82 GLN HE21 H 1 7.350 0.020 A 82 GLN HE22 H 1 6.731 0.020 A 82 GLN HGy H 1 2.490 0.020 A 82 GLN HGx H 1 2.380 0.020 A 82 GLN C C 13 178.018 0.300 A 82 GLN CA C 13 58.932 0.300 A 82 GLN CB C 13 27.469 0.300 A 82 GLN CG C 13 33.137 0.300 A 82 GLN N N 15 119.582 0.300 A 82 GLN NE2 N 15 111.058 0.300 A 83 MET H H 1 7.928 0.020 A 83 MET HA H 1 4.064 0.020 A 83 MET HBy H 1 2.670 0.020 A 83 MET HBx H 1 2.442 0.020 A 83 MET HE% H 1 2.120 0.020 A 83 MET HGy H 1 2.962 0.020 A 83 MET HGx H 1 2.678 0.020 A 83 MET C C 13 179.230 0.300 A 83 MET CA C 13 59.465 0.300 A 83 MET CB C 13 34.026 0.300 A 83 MET CE C 13 16.490 0.300 A 83 MET CG C 13 31.393 0.300 A 83 MET N N 15 117.992 0.300 A 84 VAL H H 1 7.444 0.020 A 84 VAL HA H 1 3.580 0.020 A 84 VAL HB H 1 2.093 0.020 A 84 VAL HG1% H 1 0.757 0.020 A 84 VAL HG2% H 1 0.663 0.020 A 84 VAL C C 13 176.333 0.300 A 84 VAL CA C 13 66.895 0.300 A 84 VAL CB C 13 31.189 0.300 A 84 VAL CG1 C 13 22.676 0.300 A 84 VAL CG2 C 13 21.421 0.300 A 84 VAL N N 15 120.650 0.300 A 85 ASN H H 1 8.354 0.020 A 85 ASN HA H 1 4.060 0.020 A 85 ASN HBx H 1 2.624 0.020 A 85 ASN HBy H 1 2.639 0.020 A 85 ASN HD21 H 1 6.622 0.020 A 85 ASN HD22 H 1 6.989 0.020 A 85 ASN C C 13 178.004 0.300 A 85 ASN CA C 13 56.797 0.300 A 85 ASN CB C 13 38.563 0.300 A 85 ASN N N 15 117.636 0.300 A 85 ASN ND2 N 15 109.705 0.300 A 86 GLN H H 1 8.524 0.020 A 86 GLN HA H 1 3.842 0.020 A 86 GLN HBy H 1 2.093 0.020 A 86 GLN HBx H 1 1.968 0.020 A 86 GLN HE21 H 1 7.019 0.020 A 86 GLN HE22 H 1 6.688 0.020 A 86 GLN HG2 H 1 2.386 0.020 A 86 GLN HG3 H 1 2.386 0.020 A 86 GLN C C 13 178.163 0.300 A 86 GLN CA C 13 58.442 0.300 A 86 GLN CB C 13 27.820 0.300 A 86 GLN CG C 13 33.564 0.300 A 86 GLN N N 15 116.916 0.300 A 86 GLN NE2 N 15 111.571 0.300 A 87 ALA H H 1 7.484 0.020 A 87 ALA HA H 1 3.984 0.020 A 87 ALA HB% H 1 1.468 0.020 A 87 ALA C C 13 178.159 0.300 A 87 ALA CA C 13 54.238 0.300 A 87 ALA CB C 13 18.578 0.300 A 87 ALA N N 15 120.266 0.300 A 88 LEU H H 1 7.196 0.020 A 88 LEU HA H 1 4.354 0.020 A 88 LEU HB2 H 1 1.580 0.020 A 88 LEU HB3 H 1 1.580 0.020 A 88 LEU HD1% H 1 0.615 0.020 A 88 LEU HD2% H 1 0.682 0.020 A 88 LEU HG H 1 1.626 0.020 A 88 LEU C C 13 177.310 0.300 A 88 LEU CA C 13 54.113 0.300 A 88 LEU CB C 13 42.346 0.300 A 88 LEU CD1 C 13 26.217 0.300 A 88 LEU CD2 C 13 23.039 0.300 A 88 LEU CG C 13 26.367 0.300 A 88 LEU N N 15 113.307 0.300 A 89 LYS H H 1 7.338 0.020 A 89 LYS HA H 1 3.966 0.020 A 89 LYS HBy H 1 1.873 0.020 A 89 LYS HBx H 1 1.761 0.020 A 89 LYS HD2 H 1 1.582 0.020 A 89 LYS HD3 H 1 1.582 0.020 A 89 LYS HE2 H 1 2.892 0.020 A 89 LYS HE3 H 1 2.892 0.020 A 89 LYS HGy H 1 1.411 0.020 A 89 LYS HGx H 1 1.331 0.020 A 89 LYS C C 13 177.161 0.300 A 89 LYS CA C 13 59.402 0.300 A 89 LYS CB C 13 32.105 0.300 A 89 LYS CD C 13 28.766 0.300 A 89 LYS CE C 13 41.646 0.300 A 89 LYS CG C 13 23.768 0.300 A 89 LYS N N 15 120.127 0.300 A 90 GLU H H 1 8.240 0.020 A 90 GLU HA H 1 4.092 0.020 A 90 GLU HBy H 1 1.998 0.020 A 90 GLU HBx H 1 1.829 0.020 A 90 GLU HGy H 1 2.222 0.020 A 90 GLU HGx H 1 2.153 0.020 A 90 GLU C C 13 176.879 0.300 A 90 GLU CA C 13 57.387 0.300 A 90 GLU CB C 13 28.809 0.300 A 90 GLU CG C 13 36.079 0.300 A 90 GLU N N 15 115.917 0.300 A 91 GLU H H 1 7.640 0.020 A 91 GLU HA H 1 4.203 0.020 A 91 GLU HBy H 1 1.812 0.020 A 91 GLU HBx H 1 1.772 0.020 A 91 GLU HG2 H 1 2.014 0.020 A 91 GLU HG3 H 1 2.014 0.020 A 91 GLU C C 13 176.544 0.300 A 91 GLU CA C 13 56.723 0.300 A 91 GLU CB C 13 30.720 0.300 A 91 GLU CG C 13 34.938 0.300 A 91 GLU N N 15 118.001 0.300 A 92 ILE H H 1 7.903 0.020 A 92 ILE HA H 1 4.092 0.020 A 92 ILE HB H 1 1.810 0.020 A 92 ILE HD1% H 1 0.651 0.020 A 92 ILE HG1y H 1 1.263 0.020 A 92 ILE HG1x H 1 1.187 0.020 A 92 ILE HG2% H 1 0.754 0.020 A 92 ILE C C 13 175.564 0.300 A 92 ILE CA C 13 59.988 0.300 A 92 ILE CB C 13 37.540 0.300 A 92 ILE CD1 C 13 12.037 0.300 A 92 ILE CG1 C 13 26.707 0.300 A 92 ILE CG2 C 13 17.307 0.300 A 92 ILE N N 15 118.184 0.300 A 93 LYS H H 1 8.047 0.020 A 93 LYS HA H 1 4.089 0.020 A 93 LYS HBx H 1 1.741 0.020 A 93 LYS HBy H 1 1.768 0.020 A 93 LYS HD2 H 1 1.571 0.020 A 93 LYS HD3 H 1 1.571 0.020 A 93 LYS HE2 H 1 2.889 0.020 A 93 LYS HE3 H 1 2.889 0.020 A 93 LYS HGy H 1 1.385 0.020 A 93 LYS HGx H 1 1.328 0.020 A 93 LYS C C 13 177.055 0.300 A 93 LYS CA C 13 57.726 0.300 A 93 LYS CB C 13 32.115 0.300 A 93 LYS CD C 13 28.759 0.300 A 93 LYS CE C 13 41.638 0.300 A 93 LYS CG C 13 25.249 0.300 A 93 LYS N N 15 122.921 0.300 A 94 GLU H H 1 7.884 0.020 A 94 GLU HA H 1 4.295 0.020 A 94 GLU HBy H 1 1.903 0.020 A 94 GLU HBx H 1 1.765 0.020 A 94 GLU HGy H 1 2.144 0.020 A 94 GLU HGx H 1 2.097 0.020 A 94 GLU C C 13 175.931 0.300 A 94 GLU CA C 13 55.335 0.300 A 94 GLU CB C 13 29.133 0.300 A 94 GLU CG C 13 36.093 0.300 A 94 GLU N N 15 117.376 0.300 A 95 MET H H 1 8.080 0.020 A 95 MET HA H 1 4.275 0.020 A 95 MET HBy H 1 1.924 0.020 A 95 MET HBx H 1 1.898 0.020 A 95 MET HE% H 1 1.860 0.020 A 95 MET HGy H 1 2.456 0.020 A 95 MET HGx H 1 2.335 0.020 A 95 MET C C 13 176.100 0.300 A 95 MET CA C 13 56.024 0.300 A 95 MET CB C 13 32.118 0.300 A 95 MET CE C 13 17.159 0.300 A 95 MET CG C 13 31.797 0.300 A 95 MET N N 15 120.642 0.300 A 96 HIS H H 1 8.441 0.020 A 96 HIS HA H 1 4.641 0.020 A 96 HIS HBy H 1 3.030 0.020 A 96 HIS HBx H 1 3.007 0.020 A 96 HIS HD2 H 1 6.876 0.020 A 96 HIS HE1 H 1 7.730 0.020 A 96 HIS C C 13 175.568 0.300 A 96 HIS CA C 13 56.415 0.300 A 96 HIS CB C 13 30.204 0.300 A 96 HIS N N 15 119.198 0.300 A 96 HIS ND1 N 15 219.565 0.300 A 96 HIS NE2 N 15 181.596 0.300 A 97 GLY H H 1 7.835 0.020 A 97 GLY HAy H 1 4.104 0.020 A 97 GLY HAx H 1 3.750 0.020 A 97 GLY C C 13 171.839 0.300 A 97 GLY CA C 13 45.353 0.300 A 97 GLY N N 15 107.376 0.300 A 98 LEU H H 1 7.678 0.020 A 98 LEU HA H 1 5.040 0.020 A 98 LEU HBy H 1 1.608 0.020 A 98 LEU HBx H 1 1.050 0.020 A 98 LEU HDx% H 1 0.755 0.020 A 98 LEU HD2% H 1 0.820 0.020 A 98 LEU HG H 1 1.564 0.020 A 98 LEU C C 13 176.180 0.300 A 98 LEU CA C 13 53.515 0.300 A 98 LEU CB C 13 44.480 0.300 A 98 LEU CD1 C 13 25.818 0.300 A 98 LEU CD2 C 13 24.058 0.300 A 98 LEU CG C 13 26.414 0.300 A 98 LEU N N 15 117.924 0.300 A 99 ARG H H 1 8.672 0.020 A 99 ARG HA H 1 4.374 0.020 A 99 ARG HB2 H 1 1.607 0.020 A 99 ARG HB3 H 1 1.607 0.020 A 99 ARG HDx H 1 3.122 0.020 A 99 ARG HDy H 1 3.149 0.020 A 99 ARG HGy H 1 1.456 0.020 A 99 ARG HGx H 1 1.325 0.020 A 99 ARG C C 13 173.637 0.300 A 99 ARG CA C 13 54.832 0.300 A 99 ARG CB C 13 31.324 0.300 A 99 ARG CD C 13 43.123 0.300 A 99 ARG CG C 13 26.662 0.300 A 99 ARG N N 15 125.090 0.300 A 100 ILE H H 1 8.063 0.020 A 100 ILE HA H 1 4.205 0.020 A 100 ILE HB H 1 0.563 0.020 A 100 ILE HD1% H 1 0.544 0.020 A 100 ILE HG1y H 1 1.183 0.020 A 100 ILE HG1x H 1 0.275 0.020 A 100 ILE HG2% H 1 0.213 0.020 A 100 ILE C C 13 173.489 0.300 A 100 ILE CA C 13 60.909 0.300 A 100 ILE CB C 13 39.953 0.300 A 100 ILE CD1 C 13 13.328 0.300 A 100 ILE CG1 C 13 27.877 0.300 A 100 ILE CG2 C 13 18.990 0.300 A 100 ILE N N 15 125.119 0.300 A 101 PHE H H 1 8.984 0.020 A 101 PHE HA H 1 4.717 0.020 A 101 PHE HBy H 1 2.973 0.020 A 101 PHE HBx H 1 2.783 0.020 A 101 PHE HD1 H 1 7.045 0.020 A 101 PHE HD2 H 1 7.045 0.020 A 101 PHE HE1 H 1 7.101 0.020 A 101 PHE HE2 H 1 7.101 0.020 A 101 PHE C C 13 174.791 0.300 A 101 PHE CA C 13 56.432 0.300 A 101 PHE CB C 13 40.118 0.300 A 101 PHE N N 15 125.171 0.300 A 102 THR H H 1 8.503 0.020 A 102 THR HA H 1 5.122 0.020 A 102 THR HB H 1 2.967 0.020 A 102 THR HG2% H 1 0.343 0.020 A 102 THR C C 13 174.236 0.300 A 102 THR CA C 13 58.625 0.300 A 102 THR CB C 13 69.201 0.300 A 102 THR CG2 C 13 23.186 0.300 A 102 THR N N 15 115.901 0.300 A 103 SER H H 1 8.271 0.020 A 103 SER HA H 1 4.650 0.020 A 103 SER HBy H 1 3.812 0.020 A 103 SER HBx H 1 3.779 0.020 A 103 SER C C 13 172.161 0.300 A 103 SER CA C 13 56.980 0.300 A 103 SER CB C 13 65.058 0.300 A 103 SER N N 15 112.894 0.300 A 104 VAL H H 1 8.219 0.020 A 104 VAL HA H 1 4.655 0.020 A 104 VAL HB H 1 2.008 0.020 A 104 VAL HG1% H 1 0.851 0.020 A 104 VAL HG2% H 1 0.975 0.020 A 104 VAL C C 13 174.270 0.300 A 104 VAL CA C 13 58.442 0.300 A 104 VAL CB C 13 32.695 0.300 A 104 VAL CG1 C 13 19.942 0.300 A 104 VAL CG2 C 13 21.018 0.300 A 104 VAL N N 15 117.941 0.300 A 105 PRO HA H 1 4.251 0.020 A 105 PRO HBx H 1 1.783 0.020 A 105 PRO HBy H 1 2.228 0.020 A 105 PRO HDy H 1 3.443 0.020 A 105 PRO HDx H 1 3.338 0.020 A 105 PRO HGy H 1 2.014 0.020 A 105 PRO HGx H 1 1.902 0.020 A 105 PRO C C 13 176.123 0.300 A 105 PRO CA C 13 62.783 0.300 A 105 PRO CB C 13 31.632 0.300 A 105 PRO CD C 13 50.426 0.300 A 105 PRO CG C 13 27.297 0.300 A 106 LYS H H 1 8.446 0.020 A 106 LYS HA H 1 4.135 0.020 A 106 LYS HBy H 1 1.730 0.020 A 106 LYS HBx H 1 1.628 0.020 A 106 LYS HD2 H 1 1.575 0.020 A 106 LYS HD3 H 1 1.575 0.020 A 106 LYS HE2 H 1 2.895 0.020 A 106 LYS HE3 H 1 2.895 0.020 A 106 LYS HGy H 1 1.390 0.020 A 106 LYS HGx H 1 1.326 0.020 A 106 LYS C C 13 175.457 0.300 A 106 LYS CA C 13 56.133 0.300 A 106 LYS CB C 13 32.573 0.300 A 106 LYS CD C 13 28.767 0.300 A 106 LYS CE C 13 41.642 0.300 A 106 LYS CG C 13 24.346 0.300 A 106 LYS N N 15 123.090 0.300 A 107 ARG H H 1 7.847 0.020 A 107 ARG HA H 1 4.069 0.020 A 107 ARG HBy H 1 1.729 0.020 A 107 ARG HBx H 1 1.592 0.020 A 107 ARG HD2 H 1 3.071 0.020 A 107 ARG HD3 H 1 3.071 0.020 A 107 ARG HG2 H 1 1.457 0.020 A 107 ARG HG3 H 1 1.457 0.020 A 107 ARG C C 13 180.628 0.300 A 107 ARG CA C 13 56.980 0.300 A 107 ARG CB C 13 31.121 0.300 A 107 ARG CD C 13 43.097 0.300 A 107 ARG CG C 13 26.691 0.300 A 107 ARG N N 15 127.500 0.300 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 33 GLU HBy A 54 ASP H 1.0 . 5.11 2 2 A 54 ASP H A 63 TYR HD% 1.0 . 4.63 3 3 A 54 ASP H A 63 TYR HE% 1.0 . 4.74 4 4 A 54 ASP H A 54 ASP HBy 1.0 . 3.44 5 5 A 54 ASP H A 54 ASP HBx 1.0 . 3.57 6 6 A 70 GLU H A 71 GLU H 1.0 . 4.36 7 7 A 70 GLU H A 70 GLU HBy 1.0 . 3.55 8 8 A 64 GLU H A 65 ILE H 1.0 . 4.92 9 9 A 64 GLU H A 53 THR H 1.0 . 3.79 10 10 A 64 GLU H A 55 ILE H 1.0 . 4.35 11 11 A 64 GLU H A 63 TYR H 1.0 . 5.27 12 12 A 63 TYR HD% A 64 GLU H 1.0 . 4.28 13 13 A 64 GLU H A 53 THR HB 1.0 . 4.13 14 14 A 64 GLU H A 64 GLU HGy 1.0 . 4.95 15 15 A 64 GLU H A 55 ILE HG1y 1.0 . 5.45 16 16 A 64 GLU H A 64 GLU HGx 1.0 . 4.88 17 17 A 30 THR H A 33 GLU H 1.0 . 4.41 18 18 A 30 THR H A 33 GLU HA 1.0 . 5.24 19 19 A 51 LYS H A 66 LYS H 1.0 . 3.76 20 20 A 51 LYS H A 52 VAL H 1.0 . 4.64 21 21 A 51 LYS H A 65 ILE HG2% 1.0 . 5.49 22 22 A 65 ILE H A 101 PHE H 1.0 . 4.47 23 23 A 65 ILE H A 101 PHE HE% 1.0 . 5.13 24 24 A 65 ILE H A 101 PHE HD% 1.0 . 4.67 25 25 A 65 ILE H A 100 ILE HA 1.0 . 3.67 26 26 A 65 ILE H A 64 GLU HBx 1.0 . 4.63 27 27 A 71 GLU H A 69 SER HBx 1.0 . 4.62 28 28 A 101 PHE H A 102 THR H 1.0 . 4.55 29 29 A 101 PHE H A 67 ILE H 1.0 . 4.20 30 30 A 101 PHE H A 101 PHE HE% 1.0 . 4.85 31 31 A 101 PHE H A 101 PHE HD% 1.0 . 3.79 32 32 A 101 PHE H A 66 LYS HA 1.0 . 3.44 33 33 A 101 PHE H A 100 ILE HA 1.0 . 2.83 34 34 A 66 LYS H A 67 ILE HG1x 1.0 . 5.34 35 35 A 30 THR H A 31 GLU H 1.0 . 4.86 36 36 A 31 GLU H A 32 GLY HAx 1.0 . 5.21 37 37 A 31 GLU H A 31 GLU HBx 1.0 . 3.52 38 38 A 54 ASP H A 53 THR H 1.0 . 5.10 39 39 A 63 TYR HD% A 53 THR H 1.0 . 4.67 40 40 A 76 ARG H A 79 GLN HGx 1.0 . 4.95 41 41 A 76 ARG H A 79 GLN HGy 1.0 . 4.39 42 42 A 74 GLU H A 73 LYS HG2 1.0 . 5.50 43 42 A 73 LYS HG3 A 74 GLU H 1.0 . 5.50 44 43 A 48 THR H A 69 SER H 1.0 . 5.20 45 44 A 69 SER H A 103 SER H 1.0 . 4.44 46 45 A 69 SER H A 104 VAL H 1.0 . 5.45 47 46 A 69 SER H A 72 PHE HD% 1.0 . 3.49 48 47 A 69 SER H A 72 PHE HE% 1.0 . 4.28 49 48 A 69 SER H A 68 GLU HGy 1.0 . 5.05 50 49 A 65 ILE H A 99 ARG H 1.0 . 4.49 51 50 A 99 ARG H A 100 ILE H 1.0 . 4.93 52 51 A 67 ILE HD1% A 68 GLU H 1.0 . 5.41 53 52 A 68 GLU H A 47 ALA HA 1.0 . 5.50 54 53 A 68 GLU HGy A 68 GLU H 1.0 . 4.72 55 54 A 33 GLU H A 32 GLY H 1.0 . 3.56 56 55 A 63 TYR HE% A 32 GLY H 1.0 . 5.50 57 56 A 86 GLN H A 87 ALA H 1.0 . 3.20 58 57 A 86 GLN H A 88 LEU H 1.0 . 4.73 59 58 A 86 GLN H A 85 ASN HBy 1.0 . 3.60 60 59 A 86 GLN H A 85 ASN HBx 1.0 . 3.58 61 60 A 48 THR H A 47 ALA HA 1.0 . 2.92 62 61 A 86 GLN H A 86 GLN HBx 1.0 . 3.20 63 62 A 86 GLN H A 100 ILE HD1% 1.0 . 5.50 64 63 A 41 LYS H A 41 LYS HBy 1.0 . 2.77 65 64 A 52 VAL H A 51 LYS HBx 1.0 . 4.08 66 65 A 41 LYS H A 40 LEU HBy 1.0 . 3.23 67 66 A 102 THR H A 102 THR HB 1.0 . 3.88 68 67 A 41 LYS H A 41 LYS HEx 1.0 . 3.99 69 67 A 41 LYS H A 41 LYS HEy 1.0 . 3.99 70 68 A 101 PHE HD% A 102 THR H 1.0 . 4.84 71 69 A 102 THR H A 81 HIS HD2 1.0 . 5.09 72 70 A 105 PRO HA A 106 LYS H 1.0 . 2.75 73 71 A 96 HIS H A 97 GLY HAy 1.0 . 5.50 74 72 A 86 GLN H A 85 ASN H 1.0 . 3.45 75 73 A 85 ASN H A 85 ASN HBx 1.0 . 3.26 76 74 A 85 ASN H A 83 MET H 1.0 . 4.31 77 75 A 85 ASN H A 81 HIS HA 1.0 . 4.60 78 76 A 101 PHE HD% A 67 ILE H 1.0 . 5.30 79 77 A 78 VAL H A 79 GLN H 1.0 . 3.23 80 78 A 78 VAL H A 77 THR HB 1.0 . 4.07 81 79 A 81 HIS H A 81 HIS HBx 1.0 . 3.62 82 80 A 78 VAL H A 78 VAL HG2% 1.0 . 3.94 83 81 A 67 ILE H A 102 THR HG2% 1.0 . 4.45 84 82 A 30 THR H A 34 LEU H 1.0 . 4.92 85 83 A 34 LEU H A 37 THR H 1.0 . 5.00 86 84 A 103 SER H A 104 VAL HG1% 1.0 . 5.50 87 85 A 86 GLN HA A 90 GLU H 1.0 . 4.87 88 86 A 33 GLU HA A 35 ARG H 1.0 . 4.96 89 87 A 104 VAL H A 105 PRO HDx 1.0 . 5.35 90 88 A 35 ARG H A 36 VAL H 1.0 . 3.09 91 89 A 35 ARG H A 38 GLN H 1.0 . 4.65 92 90 A 37 THR H A 35 ARG H 1.0 . 4.32 93 91 A 104 VAL H A 103 SER HBx 1.0 . 3.36 94 92 A 104 VAL H A 104 VAL HG2% 1.0 . 4.05 95 93 A 41 LYS H A 44 PHE H 1.0 . 5.06 96 94 A 44 PHE H A 44 PHE HE% 1.0 . 5.36 97 95 A 36 VAL H A 37 THR HA 1.0 . 5.22 98 96 A 33 GLU HA A 36 VAL H 1.0 . 4.49 99 97 A 51 LYS H A 50 ILE H 1.0 . 4.77 100 98 A 37 THR H A 36 VAL H 1.0 . 2.99 101 99 A 32 GLY HAx A 36 VAL H 1.0 . 4.63 102 100 A 63 TYR HE% A 33 GLU H 1.0 . 4.33 103 101 A 33 GLU H A 31 GLU HA 1.0 . 5.12 104 102 A 33 GLU H A 52 VAL HG2% 1.0 . 5.50 105 102 A 33 GLU H A 52 VAL HG1% 1.0 . 5.50 106 103 A 65 ILE H A 100 ILE H 1.0 . 5.32 107 104 A 101 PHE H A 100 ILE H 1.0 . 4.67 108 105 A 101 PHE HE% A 100 ILE H 1.0 . 5.37 109 106 A 92 ILE HB A 93 LYS H 1.0 . 4.60 110 107 A 93 LYS H A 89 LYS HA 1.0 . 5.39 111 108 A 38 GLN H A 35 ARG HA 1.0 . 3.89 112 109 A 38 GLN H A 34 LEU HA 1.0 . 4.36 113 110 A 38 GLN H A 38 GLN HGy 1.0 . 5.09 114 111 A 38 GLN H A 38 GLN HGx 1.0 . 3.98 115 112 A 41 LYS H A 40 LEU H 1.0 . 3.38 116 113 A 40 LEU H A 36 VAL HA 1.0 . 4.16 117 114 A 81 HIS HBx A 82 GLN H 1.0 . 3.87 118 115 A 37 THR HA A 40 LEU H 1.0 . 5.25 119 116 A 63 TYR HD% A 55 ILE H 1.0 . 4.84 120 117 A 83 MET H A 83 MET HBy 1.0 . 3.51 121 118 A 82 GLN H A 85 ASN HBx 1.0 . 4.40 122 119 A 92 ILE H A 92 ILE HG1y 1.0 . 4.01 123 120 A 106 LYS HA A 107 ARG H 1.0 . 2.83 124 121 A 41 LYS H A 43 LYS H 1.0 . 4.84 125 122 A 43 LYS H A 42 GLU H 1.0 . 3.19 126 123 A 105 PRO HA A 107 ARG H 1.0 . 5.36 127 124 A 43 LYS H A 40 LEU HA 1.0 . 3.92 128 125 A 38 GLN H A 39 ILE H 1.0 . 2.87 129 126 A 36 VAL HA A 39 ILE H 1.0 . 3.56 130 127 A 38 GLN HGy A 39 ILE H 1.0 . 5.35 131 128 A 39 ILE H A 39 ILE HD1% 1.0 . 3.76 132 129 A 44 PHE HD% A 47 ALA H 1.0 . 4.99 133 130 A 61 ALA H A 59 CYS HBy 1.0 . 4.35 134 130 A 59 CYS HBx A 61 ALA H 1.0 . 4.35 135 131 A 99 ARG H A 98 LEU H 1.0 . 4.78 136 132 A 98 LEU H A 98 LEU HG 1.0 . 4.01 137 133 A 98 LEU H A 62 MET HGx 1.0 . 5.20 138 134 A 75 LYS HA A 79 GLN HE21 1.0 . 3.92 139 135 A 90 GLU H A 91 GLU H 1.0 . 3.29 140 136 A 91 GLU H A 89 LYS H 1.0 . 5.12 141 137 A 79 GLN HE21 A 75 LYS HDx 1.0 . 5.30 142 138 A 55 ILE H A 63 TYR H 1.0 . 5.50 143 139 A 63 TYR H A 99 ARG H 1.0 . 4.66 144 140 A 63 TYR HD% A 63 TYR H 1.0 . 4.02 145 141 A 30 THR H A 29 GLN HE21 1.0 . 5.37 146 142 A 29 GLN HE21 A 29 GLN HBy 1.0 . 4.80 147 143 A 37 THR HG2% A 38 GLN HE21 1.0 . 5.41 148 144 A 87 ALA H A 88 LEU HB2 1.0 . 5.26 149 144 A 87 ALA H A 88 LEU HB3 1.0 . 5.26 150 145 A 87 ALA H A 84 VAL HA 1.0 . 3.91 151 146 A 87 ALA H A 86 GLN HG2 1.0 . 4.83 152 146 A 87 ALA H A 86 GLN HG3 1.0 . 4.83 153 147 A 87 ALA H A 86 GLN HBy 1.0 . 3.75 154 148 A 87 ALA H A 84 VAL HG2% 1.0 . 5.30 155 149 A 85 ASN H A 84 VAL H 1.0 . 3.19 156 150 A 83 MET H A 84 VAL H 1.0 . 3.15 157 151 A 44 PHE HE% A 84 VAL H 1.0 . 4.90 158 152 A 81 HIS HA A 84 VAL H 1.0 . 3.83 159 153 A 84 VAL H A 83 MET HGy 1.0 . 4.76 160 154 A 83 MET HBy A 84 VAL H 1.0 . 3.50 161 155 A 75 LYS H A 75 LYS HGy 1.0 . 4.08 162 156 A 68 GLU H A 49 ALA H 1.0 . 3.81 163 157 A 49 ALA H A 48 THR HB 1.0 . 4.35 164 158 A 42 GLU H A 39 ILE HG2% 1.0 . 4.82 165 159 A 41 LYS H A 42 GLU H 1.0 . 3.23 166 160 A 44 PHE H A 42 GLU H 1.0 . 4.29 167 161 A 40 LEU H A 42 GLU H 1.0 . 4.71 168 162 A 42 GLU H A 40 LEU HA 1.0 . 4.45 169 163 A 82 GLN HA A 82 GLN HE21 1.0 . 5.13 170 164 A 90 GLU H A 89 LYS H 1.0 . 3.70 171 165 A 82 GLN HE21 A 83 MET HA 1.0 . 4.97 172 166 A 89 LYS H A 89 LYS HGx 1.0 . 4.56 173 167 A 72 PHE HD% A 80 GLN H 1.0 . 5.17 174 168 A 72 PHE HD% A 80 GLN HG2 1.0 . 3.91 175 168 A 72 PHE HD% A 80 GLN HG3 1.0 . 3.91 176 169 A 72 PHE HD% A 71 GLU HGx 1.0 . 5.50 177 170 A 72 PHE HD% A 104 VAL HG1% 1.0 . 5.20 178 171 A 103 SER H A 72 PHE HD% 1.0 . 4.00 179 172 A 104 VAL H A 72 PHE HD% 1.0 . 5.50 180 173 A 72 PHE HD% A 72 PHE H 1.0 . 4.11 181 174 A 72 PHE HD% A 44 PHE HE% 1.0 . 5.09 182 175 A 72 PHE HD% A 102 THR HB 1.0 . 4.11 183 176 A 72 PHE HD% A 80 GLN HBx 1.0 . 4.65 184 177 A 88 LEU H A 86 GLN HA 1.0 . 4.74 185 178 A 44 PHE H A 44 PHE HD% 1.0 . 3.62 186 179 A 43 LYS H A 44 PHE HD% 1.0 . 4.78 187 180 A 44 PHE HD% A 44 PHE HZ 1.0 . 4.09 188 181 A 44 PHE HD% A 72 PHE HZ 1.0 . 4.78 189 182 A 40 LEU HA A 44 PHE HD% 1.0 . 3.33 190 183 A 83 MET HBy A 44 PHE HD% 1.0 . 5.50 191 184 A 103 SER H A 72 PHE HE% 1.0 . 4.20 192 185 A 72 PHE HE% A 83 MET H 1.0 . 4.96 193 186 A 72 PHE HE% A 83 MET HGy 1.0 . 4.23 194 187 A 55 ILE H A 62 MET H 1.0 . 5.50 195 188 A 62 MET H A 56 SER HBy 1.0 . 4.23 196 189 A 59 CYS H A 60 GLY HAy 1.0 . 4.31 197 190 A 59 CYS H A 59 CYS HBy 1.0 . 3.91 198 190 A 59 CYS HBx A 59 CYS H 1.0 . 3.91 199 191 A 85 ASN H A 85 ASN HD22 1.0 . 4.68 200 192 A 85 ASN HD22 A 85 ASN HA 1.0 . 4.09 201 193 A 85 ASN HD22 A 84 VAL HG1% 1.0 . 5.34 202 194 A 72 PHE H A 71 GLU HGy 1.0 . 5.25 203 195 A 72 PHE H A 73 LYS HB2 1.0 . 5.00 204 195 A 72 PHE H A 73 LYS HB3 1.0 . 5.00 205 196 A 44 PHE HE% A 83 MET HBx 1.0 . 3.48 206 197 A 87 ALA H A 44 PHE HE% 1.0 . 5.02 207 198 A 72 PHE HE% A 44 PHE HE% 1.0 . 3.78 208 199 A 44 PHE HE% A 72 PHE HZ 1.0 . 4.24 209 200 A 44 PHE HE% A 83 MET HA 1.0 . 5.33 210 201 A 44 PHE HE% A 71 GLU HGx 1.0 . 4.97 211 202 A 44 PHE HZ A 72 PHE HZ 1.0 . 4.71 212 203 A 44 PHE HZ A 40 LEU HD2% 1.0 . 4.92 213 204 A 72 PHE HE% A 44 PHE HZ 1.0 . 4.88 214 205 A 83 MET HA A 44 PHE HZ 1.0 . 4.85 215 206 A 44 PHE HZ A 83 MET HE% 1.0 . 4.52 216 207 A 100 ILE H A 81 HIS HD2 1.0 . 5.46 217 208 A 79 GLN H A 76 ARG HBy 1.0 . 3.81 218 209 A 81 HIS HA A 85 ASN HD21 1.0 . 5.50 219 210 A 85 ASN HA A 85 ASN HD21 1.0 . 4.62 220 211 A 63 TYR HE% A 32 GLY HAx 1.0 . 5.06 221 212 A 63 TYR HE% A 32 GLY HAy 1.0 . 4.72 222 213 A 63 TYR HE% A 54 ASP HBx 1.0 . 3.73 223 214 A 63 TYR HE% A 52 VAL HG2% 1.0 . 4.34 224 214 A 63 TYR HE% A 52 VAL HG1% 1.0 . 4.34 225 215 A 63 TYR HE% A 36 VAL HG2% 1.0 . 5.50 226 216 A 72 PHE HD% A 72 PHE HZ 1.0 . 4.05 227 217 A 72 PHE HZ A 80 GLN HA 1.0 . 5.44 228 218 A 66 LYS HA A 102 THR HA 1.0 . 4.76 229 219 A 66 LYS HA A 101 PHE HBy 1.0 . 3.89 230 220 A 66 LYS HA A 101 PHE HBx 1.0 . 3.54 231 221 A 66 LYS HA A 66 LYS HDx 1.0 . 4.91 232 221 A 66 LYS HA A 66 LYS HDy 1.0 . 4.91 233 222 A 67 ILE H A 66 LYS HA 1.0 . 2.86 234 223 A 101 PHE HD% A 66 LYS HA 1.0 . 4.60 235 224 A 66 LYS HA A 51 LYS HG2 1.0 . 5.50 236 224 A 66 LYS HA A 51 LYS HG3 1.0 . 5.50 237 225 A 56 SER H A 63 TYR HA 1.0 . 5.20 238 226 A 69 SER H A 68 GLU HA 1.0 . 3.04 239 227 A 104 VAL H A 68 GLU HA 1.0 . 5.23 240 228 A 72 PHE HD% A 68 GLU HA 1.0 . 4.34 241 229 A 72 PHE HE% A 68 GLU HA 1.0 . 4.67 242 230 A 63 TYR HD% A 63 TYR HA 1.0 . 3.65 243 231 A 63 TYR HE% A 63 TYR HA 1.0 . 5.21 244 232 A 102 THR HA A 68 GLU HA 1.0 . 4.60 245 233 A 68 GLU HA A 103 SER HBy 1.0 . 5.43 246 234 A 103 SER HBx A 68 GLU HA 1.0 . 5.13 247 235 A 68 GLU HGy A 68 GLU HA 1.0 . 3.85 248 236 A 63 TYR HA A 55 ILE HD1% 1.0 . 4.89 249 237 A 65 ILE H A 64 GLU HA 1.0 . 2.89 250 238 A 99 ARG H A 64 GLU HA 1.0 . 3.65 251 239 A 101 PHE HE% A 64 GLU HA 1.0 . 4.87 252 240 A 101 PHE HD% A 64 GLU HA 1.0 . 5.46 253 241 A 100 ILE HA A 64 GLU HA 1.0 . 4.88 254 242 A 53 THR H A 64 GLU HA 1.0 . 5.50 255 243 A 103 SER H A 102 THR HA 1.0 . 2.81 256 244 A 72 PHE HD% A 102 THR HA 1.0 . 4.70 257 245 A 72 PHE HE% A 102 THR HA 1.0 . 4.31 258 246 A 72 PHE HZ A 102 THR HA 1.0 . 5.50 259 247 A 102 THR HA A 67 ILE HG2% 1.0 . 4.55 260 248 A 99 ARG H A 98 LEU HA 1.0 . 2.89 261 249 A 100 ILE H A 98 LEU HA 1.0 . 5.50 262 250 A 63 TYR HD% A 98 LEU HA 1.0 . 5.27 263 251 A 64 GLU HA A 98 LEU HA 1.0 . 5.24 264 252 A 98 LEU HA A 97 GLY HAx 1.0 . 4.90 265 253 A 98 LEU HA A 99 ARG HB2 1.0 . 4.44 266 253 A 98 LEU HA A 99 ARG HB3 1.0 . 4.44 267 254 A 51 LYS H A 67 ILE HA 1.0 . 4.29 268 255 A 68 GLU H A 67 ILE HA 1.0 . 2.88 269 256 A 72 PHE HE% A 67 ILE HA 1.0 . 5.26 270 257 A 66 LYS HA A 67 ILE HA 1.0 . 5.22 271 258 A 68 GLU HA A 67 ILE HA 1.0 . 5.40 272 259 A 67 ILE HA A 68 GLU HBy 1.0 . 5.07 273 260 A 67 ILE HA A 68 GLU HBx 1.0 . 4.78 274 261 A 67 ILE HA A 49 ALA HB% 1.0 . 4.74 275 262 A 67 ILE HG2% A 67 ILE HA 1.0 . 3.73 276 263 A 67 ILE HD1% A 67 ILE HA 1.0 . 4.73 277 264 A 98 LEU H A 62 MET HA 1.0 . 5.38 278 265 A 63 TYR H A 62 MET HA 1.0 . 3.03 279 266 A 63 TYR HD% A 62 MET HA 1.0 . 4.60 280 267 A 98 LEU HA A 62 MET HA 1.0 . 5.04 281 268 A 97 GLY HAx A 62 MET HA 1.0 . 4.86 282 269 A 97 GLY HAy A 62 MET HA 1.0 . 4.77 283 270 A 62 MET HA A 98 LEU HD2% 1.0 . 4.99 284 271 A 43 LYS HA A 44 PHE HA 1.0 . 5.12 285 272 A 44 PHE HD% A 44 PHE HA 1.0 . 3.49 286 273 A 44 PHE HE% A 44 PHE HA 1.0 . 5.04 287 274 A 44 PHE HA A 45 PRO HDy 1.0 . 3.19 288 275 A 44 PHE HA A 45 PRO HDx 1.0 . 3.27 289 276 A 44 PHE HA A 45 PRO HGy 1.0 . 4.91 290 277 A 54 ASP H A 53 THR HA 1.0 . 2.91 291 278 A 63 TYR HD% A 53 THR HA 1.0 . 4.97 292 279 A 54 ASP HBy A 53 THR HA 1.0 . 4.71 293 280 A 53 THR HA A 33 GLU HGy 1.0 . 4.95 294 281 A 54 ASP HBx A 53 THR HA 1.0 . 4.44 295 282 A 53 THR HA A 53 THR HG2% 1.0 . 3.37 296 283 A 53 THR HA A 52 VAL HG2% 1.0 . 4.80 297 283 A 52 VAL HG1% A 53 THR HA 1.0 . 4.80 298 284 A 52 VAL HA A 65 ILE HA 1.0 . 3.77 299 285 A 101 PHE HE% A 101 PHE HA 1.0 . 4.86 300 286 A 64 GLU H A 52 VAL HA 1.0 . 5.22 301 287 A 53 THR H A 52 VAL HA 1.0 . 2.81 302 288 A 101 PHE HD% A 101 PHE HA 1.0 . 3.79 303 289 A 102 THR HA A 101 PHE HA 1.0 . 5.10 304 290 A 100 ILE HA A 101 PHE HA 1.0 . 4.75 305 291 A 53 THR HG2% A 52 VAL HA 1.0 . 5.50 306 292 A 52 VAL HA A 52 VAL HG2% 1.0 . 3.28 307 292 A 52 VAL HG1% A 52 VAL HA 1.0 . 3.28 308 293 A 65 ILE HG2% A 52 VAL HA 1.0 . 4.78 309 294 A 102 THR HG2% A 101 PHE HA 1.0 . 5.21 310 295 A 101 PHE HA A 100 ILE HG2% 1.0 . 4.90 311 296 A 30 THR H A 29 GLN HA 1.0 . 2.88 312 297 A 29 GLN HA A 29 GLN HGy 1.0 . 3.51 313 297 A 29 GLN HA A 29 GLN HGx 1.0 . 3.51 314 298 A 70 GLU H A 69 SER HA 1.0 . 3.09 315 299 A 47 ALA HA A 69 SER HA 1.0 . 3.20 316 300 A 69 SER HA A 69 SER HBy 1.0 . 2.99 317 301 A 69 SER HA A 47 ALA HB% 1.0 . 4.51 318 302 A 56 SER HA A 57 GLY HAx 1.0 . 4.61 319 303 A 56 SER HA A 62 MET HB2 1.0 . 4.43 320 303 A 56 SER HA A 62 MET HB3 1.0 . 4.43 321 304 A 56 SER HA A 57 GLY H 1.0 . 3.16 322 305 A 102 THR HB A 103 SER HA 1.0 . 3.93 323 306 A 68 GLU HGx A 104 VAL HA 1.0 . 4.12 324 307 A 69 SER H A 104 VAL HA 1.0 . 3.72 325 308 A 68 GLU HA A 104 VAL HA 1.0 . 4.34 326 309 A 55 ILE HD1% A 55 ILE HA 1.0 . 5.23 327 310 A 31 GLU H A 30 THR HB 1.0 . 3.14 328 311 A 104 VAL HA A 70 GLU HA 1.0 . 4.23 329 312 A 105 PRO HDx A 104 VAL HA 1.0 . 3.17 330 313 A 104 VAL HG1% A 104 VAL HA 1.0 . 3.76 331 314 A 66 LYS HA A 65 ILE HA 1.0 . 5.28 332 315 A 65 ILE HA A 52 VAL HG2% 1.0 . 3.98 333 315 A 52 VAL HG1% A 65 ILE HA 1.0 . 3.98 334 316 A 66 LYS H A 65 ILE HA 1.0 . 2.86 335 317 A 52 VAL H A 65 ILE HA 1.0 . 5.00 336 318 A 75 LYS HA A 76 ARG HGy 1.0 . 5.24 337 319 A 65 ILE HA A 65 ILE HG1x 1.0 . 4.07 338 320 A 76 ARG H A 75 LYS HA 1.0 . 3.01 339 321 A 75 LYS HA A 74 GLU HGx 1.0 . 5.38 340 321 A 75 LYS HA A 74 GLU HGy 1.0 . 5.38 341 322 A 75 LYS HA A 75 LYS HDy 1.0 . 4.14 342 323 A 75 LYS HA A 75 LYS HGx 1.0 . 4.06 343 324 A 66 LYS H A 50 ILE HA 1.0 . 4.56 344 325 A 72 PHE HA A 73 LYS HA 1.0 . 5.21 345 326 A 51 LYS H A 50 ILE HA 1.0 . 2.74 346 327 A 52 VAL H A 51 LYS HA 1.0 . 2.65 347 328 A 72 PHE HD% A 72 PHE HA 1.0 . 2.91 348 329 A 49 ALA HB% A 50 ILE HA 1.0 . 4.92 349 330 A 37 THR HG2% A 51 LYS HA 1.0 . 5.39 350 331 A 51 LYS HA A 52 VAL HG2% 1.0 . 4.21 351 331 A 52 VAL HG1% A 51 LYS HA 1.0 . 4.21 352 332 A 65 ILE HG2% A 50 ILE HA 1.0 . 5.50 353 333 A 47 ALA H A 45 PRO HA 1.0 . 4.32 354 334 A 49 ALA HA A 50 ILE HG1y 1.0 . 4.30 355 335 A 47 ALA HB% A 45 PRO HA 1.0 . 5.40 356 336 A 68 GLU H A 49 ALA HA 1.0 . 5.07 357 337 A 49 ALA HA A 48 THR HA 1.0 . 4.93 358 338 A 45 PRO HA A 46 ARG HA 1.0 . 4.62 359 339 A 33 GLU HGy A 54 ASP HA 1.0 . 4.66 360 340 A 54 ASP HA A 63 TYR HBy 1.0 . 4.73 361 341 A 64 GLU H A 54 ASP HA 1.0 . 4.50 362 342 A 63 TYR HD% A 54 ASP HA 1.0 . 3.58 363 343 A 63 TYR HE% A 54 ASP HA 1.0 . 4.42 364 344 A 63 TYR HA A 54 ASP HA 1.0 . 3.46 365 345 A 54 ASP HA A 55 ILE HG1x 1.0 . 5.05 366 346 A 31 GLU H A 30 THR HA 1.0 . 2.95 367 347 A 32 GLY H A 30 THR HA 1.0 . 4.44 368 348 A 101 PHE HE% A 99 ARG HA 1.0 . 5.08 369 349 A 31 GLU HA A 30 THR HA 1.0 . 4.92 370 350 A 30 THR HA A 33 GLU HBx 1.0 . 5.00 371 351 A 30 THR HA A 30 THR HG2% 1.0 . 3.27 372 352 A 98 LEU HA A 99 ARG HA 1.0 . 5.12 373 353 A 99 ARG HA A 100 ILE HG1y 1.0 . 4.73 374 354 A 99 ARG HA A 100 ILE HB 1.0 . 5.08 375 355 A 54 ASP HBy A 30 THR HA 1.0 . 5.11 376 356 A 88 LEU HA A 91 GLU HG2 1.0 . 3.89 377 356 A 88 LEU HA A 91 GLU HG3 1.0 . 3.89 378 357 A 90 GLU H A 88 LEU HA 1.0 . 4.34 379 358 A 92 ILE H A 88 LEU HA 1.0 . 4.46 380 359 A 91 GLU H A 88 LEU HA 1.0 . 3.99 381 360 A 87 ALA H A 88 LEU HA 1.0 . 5.37 382 361 A 89 LYS HA A 88 LEU HA 1.0 . 4.90 383 362 A 39 ILE HG2% A 88 LEU HA 1.0 . 3.96 384 363 A 88 LEU HA A 88 LEU HD1% 1.0 . 4.47 385 364 A 79 GLN H A 76 ARG HA 1.0 . 5.06 386 365 A 76 ARG HA A 76 ARG HGx 1.0 . 3.68 387 366 A 36 VAL HG2% A 88 LEU HA 1.0 . 5.50 388 367 A 78 VAL H A 76 ARG HA 1.0 . 5.41 389 368 A 75 LYS HA A 76 ARG HA 1.0 . 4.41 390 369 A 96 HIS H A 94 GLU HA 1.0 . 4.94 391 370 A 94 GLU HA A 95 MET H 1.0 . 3.57 392 371 A 46 ARG HA A 46 ARG HDy 1.0 . 4.30 393 372 A 94 GLU HA A 94 GLU HGx 1.0 . 3.58 394 372 A 94 GLU HA A 94 GLU HGy 1.0 . 3.58 395 373 A 28 THR HA A 29 GLN H 1.0 . 3.23 396 374 A 70 GLU H A 47 ALA HA 1.0 . 4.32 397 375 A 37 THR HA A 40 LEU HDx% 1.0 . 4.75 398 376 A 104 VAL H A 105 PRO HA 1.0 . 5.39 399 377 A 63 TYR HD% A 61 ALA HA 1.0 . 5.35 400 378 A 63 TYR HE% A 61 ALA HA 1.0 . 5.07 401 379 A 100 ILE HA A 66 LYS HA 1.0 . 4.88 402 380 A 106 LYS HA A 106 LYS HE2 1.0 . 4.43 403 380 A 106 LYS HA A 106 LYS HE3 1.0 . 4.43 404 381 A 55 ILE H A 56 SER HBy 1.0 . 5.27 405 382 A 61 ALA H A 56 SER HBy 1.0 . 4.46 406 383 A 92 ILE HA A 92 ILE HD1% 1.0 . 3.79 407 384 A 100 ILE HD1% A 85 ASN HA 1.0 . 5.39 408 385 A 81 HIS H A 79 GLN HA 1.0 . 4.67 409 386 A 28 THR HA A 28 THR HB 1.0 . 2.95 410 387 A 92 ILE HA A 93 LYS HGy 1.0 . 5.50 411 388 A 86 GLN H A 83 MET HA 1.0 . 3.72 412 389 A 93 LYS HA A 94 GLU H 1.0 . 3.56 413 390 A 72 PHE H A 70 GLU HA 1.0 . 3.88 414 391 A 104 VAL HG1% A 70 GLU HA 1.0 . 4.68 415 392 A 93 LYS HA A 95 MET HE% 1.0 . 3.94 416 393 A 93 LYS HA A 92 ILE HG2% 1.0 . 4.41 417 394 A 93 LYS HA A 89 LYS HGy 1.0 . 4.37 418 395 A 44 PHE H A 40 LEU HA 1.0 . 4.36 419 396 A 40 LEU HA A 39 ILE H 1.0 . 5.50 420 397 A 44 PHE HE% A 40 LEU HA 1.0 . 4.08 421 398 A 40 LEU HA A 43 LYS HBy 1.0 . 3.58 422 399 A 39 ILE HG2% A 87 ALA HA 1.0 . 4.18 423 400 A 89 LYS HA A 88 LEU HD1% 1.0 . 4.35 424 401 A 89 LYS HA A 89 LYS HD2 1.0 . 4.06 425 401 A 89 LYS HA A 89 LYS HD3 1.0 . 4.06 426 402 A 89 LYS HA A 89 LYS HGy 1.0 . 3.68 427 403 A 89 LYS HA A 92 ILE H 1.0 . 4.14 428 404 A 81 HIS HD2 A 81 HIS HA 1.0 . 3.31 429 405 A 72 PHE HD% A 80 GLN HA 1.0 . 3.80 430 406 A 72 PHE HE% A 80 GLN HA 1.0 . 4.10 431 407 A 81 HIS HA A 100 ILE HG1x 1.0 . 5.50 432 408 A 71 GLU HA A 73 LYS H 1.0 . 4.32 433 409 A 35 ARG HA A 35 ARG HDy 1.0 . 4.14 434 410 A 37 THR H A 35 ARG HA 1.0 . 4.80 435 411 A 34 LEU H A 31 GLU HA 1.0 . 4.22 436 412 A 43 LYS HA A 45 PRO HDx 1.0 . 4.12 437 413 A 31 GLU HA A 31 GLU HGy 1.0 . 3.79 438 414 A 43 LYS HA A 43 LYS HDx 1.0 . 3.27 439 415 A 72 PHE H A 73 LYS HA 1.0 . 5.05 440 416 A 74 GLU HA A 74 GLU HGx 1.0 . 3.67 441 416 A 74 GLU HGy A 74 GLU HA 1.0 . 3.67 442 417 A 41 LYS H A 42 GLU HA 1.0 . 5.36 443 418 A 44 PHE H A 42 GLU HA 1.0 . 4.51 444 419 A 45 PRO HDx A 42 GLU HA 1.0 . 5.15 445 420 A 42 GLU HA A 41 LYS HBy 1.0 . 4.94 446 421 A 86 GLN HA A 89 LYS HE2 1.0 . 5.16 447 421 A 86 GLN HA A 89 LYS HE3 1.0 . 5.16 448 422 A 85 ASN H A 86 GLN HA 1.0 . 5.41 449 423 A 86 GLN HA A 89 LYS H 1.0 . 3.83 450 424 A 37 THR H A 34 LEU HA 1.0 . 3.84 451 425 A 34 LEU HA A 38 GLN HE22 1.0 . 4.99 452 426 A 79 GLN H A 77 THR HA 1.0 . 4.98 453 427 A 102 THR HA A 103 SER HBy 1.0 . 5.42 454 428 A 41 LYS HA A 44 PHE HBx 1.0 . 4.58 455 429 A 38 GLN HGy A 38 GLN HA 1.0 . 3.78 456 430 A 38 GLN HGx A 38 GLN HA 1.0 . 3.78 457 431 A 44 PHE HD% A 41 LYS HA 1.0 . 5.36 458 432 A 37 THR HA A 38 GLN HA 1.0 . 5.25 459 433 A 54 ASP H A 53 THR HB 1.0 . 4.92 460 434 A 53 THR H A 53 THR HB 1.0 . 3.40 461 435 A 44 PHE H A 41 LYS HA 1.0 . 4.07 462 436 A 43 LYS H A 41 LYS HA 1.0 . 4.85 463 437 A 53 THR HB A 64 GLU HGx 1.0 . 4.70 464 438 A 63 TYR HE% A 60 GLY HAx 1.0 . 4.58 465 439 A 103 SER HBx A 102 THR HA 1.0 . 5.31 466 440 A 97 GLY HAy A 62 MET HGx 1.0 . 5.50 467 441 A 32 GLY HAy A 35 ARG HB2 1.0 . 3.89 468 441 A 32 GLY HAy A 35 ARG HB3 1.0 . 3.89 469 442 A 42 GLU H A 39 ILE HA 1.0 . 3.79 470 443 A 39 ILE HA A 42 GLU HGy 1.0 . 5.04 471 444 A 39 ILE HD1% A 39 ILE HA 1.0 . 3.92 472 445 A 82 GLN H A 78 VAL HA 1.0 . 4.16 473 446 A 81 HIS HBx A 78 VAL HA 1.0 . 4.48 474 447 A 44 PHE HD% A 84 VAL HA 1.0 . 4.46 475 448 A 100 ILE HD1% A 84 VAL HA 1.0 . 5.18 476 449 A 86 GLN H A 84 VAL HA 1.0 . 5.05 477 450 A 44 PHE HE% A 84 VAL HA 1.0 . 3.28 478 451 A 84 VAL HA A 44 PHE HZ 1.0 . 3.18 479 452 A 84 VAL HA A 72 PHE HZ 1.0 . 5.45 480 453 A 63 TYR HD% A 33 GLU HA 1.0 . 4.55 481 454 A 63 TYR HE% A 33 GLU HA 1.0 . 3.52 482 455 A 33 GLU HA A 52 VAL HB 1.0 . 4.49 483 456 A 45 PRO HDy A 46 ARG H 1.0 . 4.36 484 457 A 44 PHE H A 45 PRO HDy 1.0 . 4.54 485 458 A 43 LYS HA A 45 PRO HDy 1.0 . 5.16 486 459 A 70 GLU H A 105 PRO HDy 1.0 . 4.75 487 460 A 69 SER H A 105 PRO HDy 1.0 . 4.53 488 461 A 38 GLN H A 37 THR HB 1.0 . 3.87 489 462 A 37 THR H A 37 THR HB 1.0 . 3.28 490 463 A 72 PHE HD% A 105 PRO HDy 1.0 . 5.50 491 464 A 68 GLU HA A 105 PRO HDy 1.0 . 5.50 492 465 A 70 GLU HA A 105 PRO HDy 1.0 . 3.57 493 466 A 56 SER H A 56 SER HBx 1.0 . 4.14 494 467 A 56 SER HBx A 61 ALA HB% 1.0 . 4.11 495 468 A 72 PHE HD% A 69 SER HBy 1.0 . 4.78 496 469 A 72 PHE HE% A 69 SER HBy 1.0 . 4.73 497 470 A 72 PHE H A 69 SER HBy 1.0 . 4.97 498 471 A 71 GLU H A 69 SER HBy 1.0 . 4.99 499 472 A 70 GLU H A 105 PRO HDx 1.0 . 4.95 500 473 A 69 SER H A 105 PRO HDx 1.0 . 3.96 501 474 A 72 PHE HD% A 105 PRO HDx 1.0 . 5.44 502 475 A 105 PRO HDx A 68 GLU HA 1.0 . 5.12 503 476 A 105 PRO HDx A 48 THR HG2% 1.0 . 4.97 504 477 A 72 PHE HBy A 75 LYS HBy 1.0 . 5.50 505 478 A 35 ARG H A 36 VAL HA 1.0 . 5.41 506 479 A 63 TYR HE% A 60 GLY HAy 1.0 . 4.40 507 480 A 35 ARG HDy A 91 GLU HG2 1.0 . 4.08 508 480 A 91 GLU HG3 A 35 ARG HDy 1.0 . 4.08 509 481 A 77 THR HB A 76 ARG HBy 1.0 . 4.42 510 482 A 60 GLY HAy A 61 ALA HB% 1.0 . 4.66 511 483 A 77 THR HB A 78 VAL HG1% 1.0 . 5.04 512 484 A 101 PHE HE% A 99 ARG HDy 1.0 . 4.08 513 485 A 55 ILE HD1% A 99 ARG HDy 1.0 . 4.91 514 486 A 76 ARG H A 76 ARG HD2 1.0 . 4.70 515 486 A 76 ARG H A 76 ARG HD3 1.0 . 4.70 516 487 A 76 ARG HBx A 76 ARG HD2 1.0 . 3.55 517 487 A 76 ARG HD3 A 76 ARG HBx 1.0 . 3.55 518 488 A 78 VAL HG2% A 76 ARG HD2 1.0 . 5.27 519 488 A 78 VAL HG2% A 76 ARG HD3 1.0 . 5.27 520 489 A 101 PHE HE% A 99 ARG HDx 1.0 . 4.08 521 490 A 35 ARG HA A 35 ARG HDx 1.0 . 4.48 522 491 A 35 ARG HDx A 35 ARG HB2 1.0 . 3.79 523 491 A 35 ARG HB3 A 35 ARG HDx 1.0 . 3.79 524 492 A 47 ALA H A 44 PHE HBy 1.0 . 4.13 525 493 A 96 HIS HBx A 97 GLY H 1.0 . 4.68 526 494 A 46 ARG H A 46 ARG HDx 1.0 . 5.41 527 495 A 75 LYS HGx A 75 LYS HE2 1.0 . 3.60 528 495 A 75 LYS HGx A 75 LYS HE3 1.0 . 3.60 529 496 A 73 LYS H A 75 LYS HE2 1.0 . 5.37 530 496 A 73 LYS H A 75 LYS HE3 1.0 . 5.37 531 497 A 81 HIS H A 81 HIS HBy 1.0 . 3.32 532 498 A 100 ILE HD1% A 81 HIS HBy 1.0 . 5.24 533 499 A 101 PHE H A 101 PHE HBy 1.0 . 3.97 534 500 A 102 THR HB A 72 PHE HZ 1.0 . 5.24 535 501 A 102 THR HB A 80 GLN HBx 1.0 . 3.92 536 502 A 101 PHE HBy A 100 ILE HG2% 1.0 . 5.38 537 503 A 83 MET H A 83 MET HGy 1.0 . 3.25 538 504 A 58 GLY H A 59 CYS HBy 1.0 . 5.17 539 504 A 59 CYS HBx A 58 GLY H 1.0 . 5.17 540 505 A 63 TYR HD% A 54 ASP HBy 1.0 . 5.05 541 506 A 63 TYR HE% A 54 ASP HBy 1.0 . 4.37 542 507 A 58 GLY HAy A 59 CYS HBy 1.0 . 4.88 543 507 A 59 CYS HBx A 58 GLY HAy 1.0 . 4.88 544 508 A 60 GLY H A 59 CYS HBy 1.0 . 5.02 545 508 A 59 CYS HBx A 60 GLY H 1.0 . 5.02 546 509 A 73 LYS HEy A 73 LYS HG2 1.0 . 3.72 547 509 A 73 LYS HG3 A 73 LYS HEy 1.0 . 3.72 548 510 A 104 VAL HG2% A 73 LYS HEy 1.0 . 5.30 549 511 A 73 LYS HEy A 73 LYS HB2 1.0 . 4.37 550 511 A 73 LYS HB3 A 73 LYS HEy 1.0 . 4.37 551 512 A 89 LYS H A 89 LYS HE2 1.0 . 5.43 552 512 A 89 LYS H A 89 LYS HE3 1.0 . 5.43 553 513 A 89 LYS HGx A 89 LYS HE2 1.0 . 3.61 554 513 A 89 LYS HGx A 89 LYS HE3 1.0 . 3.61 555 514 A 73 LYS HB2 A 106 LYS HE2 1.0 . 4.78 556 514 A 106 LYS HE3 A 73 LYS HB2 1.0 . 4.78 557 514 A 73 LYS HB3 A 106 LYS HE3 1.0 . 4.78 558 514 A 73 LYS HB3 A 106 LYS HE2 1.0 . 4.78 559 515 A 73 LYS HDx A 106 LYS HE2 1.0 . 4.19 560 515 A 106 LYS HE3 A 73 LYS HDx 1.0 . 4.19 561 516 A 67 ILE HG2% A 44 PHE HBx 1.0 . 5.50 562 517 A 100 ILE HD1% A 81 HIS HBx 1.0 . 4.24 563 518 A 43 LYS H A 43 LYS HEy 1.0 . 5.50 564 519 A 74 GLU H A 73 LYS HEx 1.0 . 5.50 565 520 A 43 LYS HEy A 43 LYS HGy 1.0 . 3.64 566 521 A 41 LYS HGy A 41 LYS HEx 1.0 . 3.37 567 521 A 41 LYS HEy A 41 LYS HGy 1.0 . 3.37 568 522 A 37 THR HG2% A 41 LYS HEx 1.0 . 4.17 569 522 A 41 LYS HEy A 37 THR HG2% 1.0 . 4.17 570 523 A 50 ILE HA A 51 LYS HE2 1.0 . 4.04 571 523 A 50 ILE HA A 51 LYS HE3 1.0 . 4.04 572 524 A 37 THR HA A 41 LYS HEx 1.0 . 4.58 573 524 A 41 LYS HEy A 37 THR HA 1.0 . 4.58 574 525 A 100 ILE HA A 101 PHE HBx 1.0 . 4.86 575 526 A 49 ALA HB% A 51 LYS HE2 1.0 . 4.69 576 526 A 49 ALA HB% A 51 LYS HE3 1.0 . 4.69 577 527 A 102 THR H A 101 PHE HBx 1.0 . 4.53 578 528 A 67 ILE H A 101 PHE HBx 1.0 . 4.61 579 529 A 101 PHE HBx A 66 LYS HGy 1.0 . 4.10 580 530 A 50 ILE HG1x A 51 LYS HE2 1.0 . 5.31 581 530 A 51 LYS HE3 A 50 ILE HG1x 1.0 . 5.31 582 531 A 101 PHE H A 101 PHE HBx 1.0 . 3.68 583 532 A 49 ALA HA A 51 LYS HE2 1.0 . 3.77 584 532 A 49 ALA HA A 51 LYS HE3 1.0 . 3.77 585 533 A 69 SER HBx A 47 ALA HA 1.0 . 3.98 586 534 A 69 SER HBx A 71 GLU HGx 1.0 . 4.96 587 535 A 69 SER HBx A 72 PHE HD% 1.0 . 4.21 588 536 A 69 SER HBx A 71 GLU HBx 1.0 . 5.02 589 537 A 83 MET HBy A 72 PHE HZ 1.0 . 5.00 590 538 A 72 PHE HE% A 83 MET HGx 1.0 . 3.77 591 539 A 44 PHE HE% A 83 MET HBy 1.0 . 3.98 592 540 A 83 MET HBy A 44 PHE HZ 1.0 . 3.80 593 541 A 83 MET HBy A 83 MET HA 1.0 . 3.02 594 542 A 80 GLN HA A 83 MET HGx 1.0 . 3.99 595 543 A 54 ASP H A 33 GLU HGy 1.0 . 4.52 596 544 A 33 GLU H A 33 GLU HGy 1.0 . 3.86 597 545 A 63 TYR HE% A 33 GLU HGy 1.0 . 3.75 598 546 A 63 TYR HD% A 33 GLU HGy 1.0 . 4.37 599 547 A 33 GLU HGy A 53 THR HG2% 1.0 . 5.48 600 548 A 33 GLU HGy A 34 LEU HDx% 1.0 . 5.50 601 548 A 33 GLU HGy A 34 LEU HD2% 1.0 . 5.50 602 549 A 33 GLU HGy A 52 VAL HG2% 1.0 . 4.65 603 549 A 52 VAL HG1% A 33 GLU HGy 1.0 . 4.65 604 550 A 85 ASN HD22 A 85 ASN HBy 1.0 . 4.04 605 551 A 100 ILE HD1% A 85 ASN HBy 1.0 . 4.99 606 552 A 81 HIS HA A 85 ASN HBx 1.0 . 5.31 607 553 A 84 VAL HG2% A 85 ASN HBx 1.0 . 5.50 608 554 A 64 GLU H A 63 TYR HBy 1.0 . 3.83 609 555 A 98 LEU HA A 63 TYR HBy 1.0 . 5.34 610 556 A 65 ILE HG1x A 63 TYR HBy 1.0 . 4.63 611 557 A 53 THR H A 63 TYR HBy 1.0 . 4.96 612 558 A 98 LEU HD2% A 63 TYR HBy 1.0 . 4.21 613 559 A 82 GLN HA A 82 GLN HGy 1.0 . 3.82 614 560 A 78 VAL HG2% A 82 GLN HGy 1.0 . 5.18 615 561 A 101 PHE HD% A 66 LYS HEy 1.0 . 5.21 616 562 A 66 LYS HGy A 66 LYS HEy 1.0 . 3.79 617 563 A 72 PHE HE% A 83 MET HBx 1.0 . 4.39 618 564 A 44 PHE HZ A 83 MET HBx 1.0 . 3.63 619 565 A 33 GLU HBy A 63 TYR HD% 1.0 . 4.98 620 566 A 33 GLU HBy A 63 TYR HE% 1.0 . 4.98 621 567 A 95 MET HA A 95 MET HGy 1.0 . 4.01 622 568 A 72 PHE HD% A 83 MET HBx 1.0 . 5.50 623 569 A 84 VAL HG1% A 83 MET HBx 1.0 . 4.71 624 570 A 79 GLN HGy A 79 GLN HBx 1.0 . 2.67 625 571 A 79 GLN HGy A 78 VAL HG2% 1.0 . 5.50 626 572 A 86 GLN H A 86 GLN HG2 1.0 . 3.58 627 572 A 86 GLN H A 86 GLN HG3 1.0 . 3.58 628 573 A 86 GLN HA A 86 GLN HG2 1.0 . 3.39 629 573 A 86 GLN HA A 86 GLN HG3 1.0 . 3.39 630 574 A 86 GLN HBx A 86 GLN HG2 1.0 . 3.01 631 574 A 86 GLN HBx A 86 GLN HG3 1.0 . 3.01 632 575 A 75 LYS HGy A 80 GLN HG2 1.0 . 4.72 633 575 A 75 LYS HGy A 80 GLN HG3 1.0 . 4.72 634 576 A 30 THR H A 29 GLN HGy 1.0 . 4.58 635 576 A 30 THR H A 29 GLN HGx 1.0 . 4.58 636 577 A 29 GLN H A 29 GLN HGy 1.0 . 4.91 637 577 A 29 GLN HGx A 29 GLN H 1.0 . 4.91 638 578 A 29 GLN HE21 A 29 GLN HGy 1.0 . 3.55 639 578 A 29 GLN HE21 A 29 GLN HGx 1.0 . 3.55 640 579 A 63 TYR H A 63 TYR HBx 1.0 . 3.88 641 580 A 98 LEU HA A 63 TYR HBx 1.0 . 4.73 642 581 A 98 LEU HD2% A 63 TYR HBx 1.0 . 3.79 643 582 A 79 GLN H A 79 GLN HBy 1.0 . 3.40 644 583 A 63 TYR HBx A 98 LEU HDx% 1.0 . 4.67 645 584 A 42 GLU H A 42 GLU HGy 1.0 . 3.69 646 585 A 95 MET H A 95 MET HGx 1.0 . 4.69 647 586 A 95 MET HA A 95 MET HGx 1.0 . 3.67 648 587 A 54 ASP HBx A 30 THR H 1.0 . 4.64 649 588 A 54 ASP HBx A 29 GLN H 1.0 . 4.78 650 589 A 54 ASP HBx A 33 GLU HGy 1.0 . 4.13 651 590 A 31 GLU H A 31 GLU HGy 1.0 . 4.09 652 591 A 38 GLN HGx A 39 ILE H 1.0 . 5.25 653 592 A 79 GLN HGx A 78 VAL HG2% 1.0 . 4.85 654 593 A 63 TYR H A 62 MET HGy 1.0 . 4.72 655 594 A 55 ILE HG1y A 62 MET HGy 1.0 . 4.62 656 595 A 75 LYS H A 74 GLU HBy 1.0 . 4.93 657 596 A 90 GLU H A 90 GLU HGy 1.0 . 4.09 658 597 A 70 GLU H A 70 GLU HGy 1.0 . 4.21 659 598 A 82 GLN H A 82 GLN HBy 1.0 . 3.06 660 599 A 82 GLN HA A 82 GLN HBy 1.0 . 2.91 661 600 A 65 ILE H A 64 GLU HGy 1.0 . 4.28 662 601 A 31 GLU H A 31 GLU HGx 1.0 . 4.46 663 602 A 64 GLU HGy A 101 PHE HE% 1.0 . 3.68 664 603 A 64 GLU HGy A 101 PHE HD% 1.0 . 4.01 665 604 A 64 GLU HGy A 64 GLU HA 1.0 . 3.80 666 605 A 90 GLU H A 90 GLU HGx 1.0 . 3.98 667 606 A 30 THR H A 29 GLN HBy 1.0 . 3.66 668 607 A 29 GLN HBy A 34 LEU HG 1.0 . 4.57 669 608 A 70 GLU H A 70 GLU HGx 1.0 . 4.43 670 609 A 71 GLU H A 70 GLU HGx 1.0 . 5.35 671 610 A 74 GLU H A 74 GLU HGx 1.0 . 4.85 672 610 A 74 GLU H A 74 GLU HGy 1.0 . 4.85 673 611 A 39 ILE H A 38 GLN HBy 1.0 . 3.78 674 612 A 38 GLN HGx A 38 GLN HBy 1.0 . 2.76 675 613 A 94 GLU H A 94 GLU HGx 1.0 . 3.99 676 613 A 94 GLU HGy A 94 GLU H 1.0 . 3.99 677 614 A 33 GLU HBy A 33 GLU HGx 1.0 . 2.92 678 615 A 54 ASP H A 33 GLU HGx 1.0 . 4.11 679 616 A 33 GLU H A 33 GLU HGx 1.0 . 4.31 680 617 A 72 PHE HD% A 83 MET HE% 1.0 . 4.15 681 618 A 72 PHE HE% A 83 MET HE% 1.0 . 4.12 682 619 A 63 TYR HD% A 33 GLU HGx 1.0 . 4.50 683 620 A 63 TYR HE% A 33 GLU HGx 1.0 . 3.82 684 621 A 72 PHE HZ A 83 MET HE% 1.0 . 5.50 685 622 A 33 GLU HA A 33 GLU HGx 1.0 . 3.53 686 623 A 86 GLN HBy A 86 GLN HE21 1.0 . 5.50 687 624 A 76 ARG HBy A 76 ARG HD2 1.0 . 3.71 688 624 A 76 ARG HBy A 76 ARG HD3 1.0 . 3.71 689 625 A 63 TYR H A 62 MET HGx 1.0 . 4.96 690 626 A 72 PHE HD% A 80 GLN HBy 1.0 . 5.50 691 627 A 44 PHE HE% A 84 VAL HB 1.0 . 4.90 692 628 A 44 PHE H A 42 GLU HBy 1.0 . 5.12 693 629 A 43 LYS H A 42 GLU HBy 1.0 . 3.55 694 630 A 42 GLU H A 42 GLU HBy 1.0 . 2.90 695 631 A 42 GLU HA A 42 GLU HGx 1.0 . 2.96 696 632 A 39 ILE H A 38 GLN HBx 1.0 . 3.53 697 633 A 101 PHE HE% A 64 GLU HBy 1.0 . 5.22 698 634 A 53 THR HB A 64 GLU HBy 1.0 . 3.05 699 635 A 64 GLU H A 64 GLU HBy 1.0 . 3.60 700 636 A 65 ILE H A 64 GLU HBy 1.0 . 4.93 701 637 A 40 LEU HBy A 40 LEU H 1.0 . 3.15 702 638 A 92 ILE H A 91 GLU HG2 1.0 . 4.69 703 638 A 92 ILE H A 91 GLU HG3 1.0 . 4.69 704 639 A 73 LYS HEy A 74 GLU HBx 1.0 . 4.63 705 640 A 40 LEU HBy A 37 THR HG2% 1.0 . 4.36 706 641 A 40 LEU HBy A 40 LEU HDx% 1.0 . 3.62 707 642 A 40 LEU HBy A 36 VAL HG2% 1.0 . 4.64 708 643 A 91 GLU HA A 91 GLU HG2 1.0 . 3.43 709 643 A 91 GLU HG3 A 91 GLU HA 1.0 . 3.43 710 644 A 76 ARG H A 79 GLN HBx 1.0 . 4.41 711 645 A 104 VAL H A 104 VAL HB 1.0 . 3.53 712 646 A 90 GLU HA A 90 GLU HBy 1.0 . 2.97 713 647 A 71 GLU H A 70 GLU HBy 1.0 . 5.08 714 648 A 31 GLU H A 31 GLU HBy 1.0 . 3.29 715 649 A 70 GLU HBy A 70 GLU HA 1.0 . 3.00 716 650 A 44 PHE H A 42 GLU HBx 1.0 . 5.50 717 651 A 43 LYS H A 42 GLU HBx 1.0 . 3.82 718 652 A 42 GLU H A 42 GLU HBx 1.0 . 3.59 719 653 A 86 GLN HBx A 87 ALA HA 1.0 . 4.54 720 654 A 86 GLN HBx A 87 ALA HB% 1.0 . 4.88 721 655 A 88 LEU H A 86 GLN HBx 1.0 . 5.40 722 656 A 64 GLU H A 64 GLU HBx 1.0 . 3.83 723 657 A 71 GLU H A 70 GLU HBx 1.0 . 4.87 724 658 A 31 GLU HBx A 32 GLY H 1.0 . 3.82 725 659 A 94 GLU HA A 94 GLU HBy 1.0 . 2.94 726 660 A 46 ARG HDy A 46 ARG HBy 1.0 . 4.22 727 661 A 96 HIS H A 94 GLU HBy 1.0 . 5.14 728 662 A 31 GLU HBx A 35 ARG H 1.0 . 5.45 729 663 A 94 GLU H A 94 GLU HBy 1.0 . 3.79 730 664 A 72 PHE HD% A 71 GLU HGy 1.0 . 3.94 731 665 A 71 GLU HGy A 72 PHE HBy 1.0 . 4.09 732 666 A 36 VAL HA A 40 LEU HG 1.0 . 4.60 733 667 A 95 MET H A 95 MET HBx 1.0 . 4.08 734 667 A 95 MET H A 95 MET HBy 1.0 . 4.08 735 668 A 72 PHE HE% A 71 GLU HGy 1.0 . 5.30 736 669 A 44 PHE HE% A 71 GLU HGy 1.0 . 5.26 737 670 A 70 GLU H A 105 PRO HGx 1.0 . 4.86 738 671 A 41 LYS H A 40 LEU HG 1.0 . 4.66 739 672 A 40 LEU H A 40 LEU HG 1.0 . 3.16 740 673 A 88 LEU H A 89 LYS HBy 1.0 . 4.32 741 674 A 70 GLU HA A 105 PRO HGx 1.0 . 3.99 742 675 A 48 THR HG2% A 105 PRO HGx 1.0 . 4.22 743 676 A 36 VAL HG2% A 40 LEU HG 1.0 . 4.21 744 677 A 85 ASN HA A 89 LYS HBy 1.0 . 4.73 745 678 A 89 LYS HA A 89 LYS HBy 1.0 . 3.01 746 679 A 104 VAL HG2% A 105 PRO HGx 1.0 . 5.26 747 680 A 40 LEU HG A 36 VAL HG1% 1.0 . 5.50 748 681 A 30 THR H A 29 GLN HBx 1.0 . 4.36 749 682 A 86 GLN HA A 89 LYS HBy 1.0 . 3.73 750 683 A 65 ILE H A 64 GLU HGx 1.0 . 4.22 751 684 A 64 GLU HGx A 101 PHE HE% 1.0 . 4.46 752 685 A 64 GLU HGx A 64 GLU HA 1.0 . 4.06 753 686 A 89 LYS HBy A 89 LYS HE2 1.0 . 4.14 754 686 A 89 LYS HE3 A 89 LYS HBy 1.0 . 4.14 755 687 A 45 PRO HGy A 46 ARG H 1.0 . 4.31 756 688 A 78 VAL H A 78 VAL HB 1.0 . 3.25 757 689 A 62 MET H A 62 MET HE% 1.0 . 4.42 758 690 A 78 VAL HA A 78 VAL HB 1.0 . 2.92 759 691 A 63 TYR HD% A 33 GLU HBx 1.0 . 4.14 760 692 A 63 TYR HE% A 33 GLU HBx 1.0 . 4.11 761 693 A 48 THR H A 68 GLU HBy 1.0 . 4.92 762 694 A 74 GLU H A 73 LYS HB2 1.0 . 4.47 763 694 A 74 GLU H A 73 LYS HB3 1.0 . 4.47 764 695 A 73 LYS H A 73 LYS HB2 1.0 . 2.98 765 695 A 73 LYS HB3 A 73 LYS H 1.0 . 2.98 766 696 A 37 THR H A 35 ARG HB2 1.0 . 4.90 767 696 A 37 THR H A 35 ARG HB3 1.0 . 4.90 768 697 A 88 LEU HA A 91 GLU HBy 1.0 . 4.86 769 698 A 35 ARG HDy A 35 ARG HB2 1.0 . 3.82 770 698 A 35 ARG HDy A 35 ARG HB3 1.0 . 3.82 771 699 A 36 VAL HG1% A 35 ARG HB2 1.0 . 4.26 772 699 A 35 ARG HB3 A 36 VAL HG1% 1.0 . 4.26 773 700 A 76 ARG H A 75 LYS HBy 1.0 . 4.51 774 701 A 72 PHE HD% A 75 LYS HBy 1.0 . 4.92 775 702 A 86 GLN HE21 A 89 LYS HBx 1.0 . 4.41 776 703 A 89 LYS HBx A 86 GLN HE22 1.0 . 4.94 777 704 A 91 GLU H A 91 GLU HBx 1.0 . 3.39 778 705 A 88 LEU HA A 91 GLU HBx 1.0 . 4.55 779 706 A 75 LYS HBy A 80 GLN HG2 1.0 . 3.77 780 706 A 80 GLN HG3 A 75 LYS HBy 1.0 . 3.77 781 707 A 106 LYS H A 105 PRO HBy 1.0 . 4.18 782 708 A 90 GLU H A 89 LYS HBx 1.0 . 3.88 783 709 A 93 LYS H A 93 LYS HBy 1.0 . 3.76 784 710 A 89 LYS H A 89 LYS HBx 1.0 . 3.29 785 711 A 86 GLN HA A 89 LYS HBx 1.0 . 3.71 786 712 A 68 GLU HGy A 105 PRO HDx 1.0 . 4.46 787 713 A 41 LYS HA A 41 LYS HBx 1.0 . 2.75 788 714 A 53 THR H A 52 VAL HB 1.0 . 4.82 789 715 A 76 ARG H A 76 ARG HGy 1.0 . 3.83 790 716 A 107 ARG H A 107 ARG HBy 1.0 . 3.70 791 717 A 79 GLN HGy A 76 ARG HGy 1.0 . 4.39 792 718 A 34 LEU H A 34 LEU HBy 1.0 . 3.09 793 719 A 68 GLU H A 68 GLU HGx 1.0 . 5.00 794 720 A 95 MET HA A 98 LEU HBy 1.0 . 4.23 795 721 A 105 PRO HDx A 68 GLU HGx 1.0 . 4.35 796 722 A 73 LYS HDy A 106 LYS HE2 1.0 . 3.90 797 722 A 106 LYS HE3 A 73 LYS HDy 1.0 . 3.90 798 723 A 46 ARG H A 45 PRO HGx 1.0 . 3.95 799 724 A 95 MET HGy A 98 LEU HBy 1.0 . 3.92 800 725 A 66 LYS H A 66 LYS HBx 1.0 . 3.37 801 725 A 66 LYS H A 66 LYS HBy 1.0 . 3.37 802 726 A 101 PHE HBy A 66 LYS HBx 1.0 . 4.63 803 726 A 101 PHE HBy A 66 LYS HBy 1.0 . 4.63 804 727 A 51 LYS H A 51 LYS HBy 1.0 . 3.90 805 728 A 52 VAL H A 51 LYS HBy 1.0 . 4.10 806 729 A 106 LYS HBx A 107 ARG HA 1.0 . 5.50 807 730 A 36 VAL HA A 39 ILE HB 1.0 . 3.80 808 731 A 106 LYS HBx A 106 LYS HE2 1.0 . 4.22 809 731 A 106 LYS HE3 A 106 LYS HBx 1.0 . 4.22 810 732 A 105 PRO HA A 106 LYS HBx 1.0 . 4.87 811 733 A 38 GLN HA A 39 ILE HG1y 1.0 . 5.37 812 734 A 106 LYS H A 106 LYS HBx 1.0 . 3.37 813 735 A 107 ARG H A 106 LYS HBx 1.0 . 4.51 814 736 A 102 THR HA A 68 GLU HBx 1.0 . 5.50 815 737 A 66 LYS HBx A 66 LYS HDx 1.0 . 3.11 816 737 A 66 LYS HBy A 66 LYS HDx 1.0 . 3.11 817 737 A 66 LYS HDy A 66 LYS HBx 1.0 . 3.11 818 737 A 66 LYS HDy A 66 LYS HBy 1.0 . 3.11 819 738 A 67 ILE H A 66 LYS HBx 1.0 . 4.22 820 738 A 67 ILE H A 66 LYS HBy 1.0 . 4.22 821 739 A 89 LYS H A 88 LEU HG 1.0 . 5.31 822 740 A 101 PHE HE% A 99 ARG HB2 1.0 . 3.62 823 740 A 101 PHE HE% A 99 ARG HB3 1.0 . 3.62 824 741 A 101 PHE HD% A 66 LYS HBx 1.0 . 4.53 825 741 A 101 PHE HD% A 66 LYS HBy 1.0 . 4.53 826 742 A 99 ARG HGx A 99 ARG HB2 1.0 . 2.88 827 742 A 99 ARG HB3 A 99 ARG HGx 1.0 . 2.88 828 743 A 99 ARG H A 99 ARG HB2 1.0 . 3.40 829 743 A 99 ARG H A 99 ARG HB3 1.0 . 3.40 830 744 A 99 ARG HDy A 99 ARG HB2 1.0 . 3.76 831 744 A 99 ARG HB3 A 99 ARG HDy 1.0 . 3.76 832 745 A 75 LYS HBx A 80 GLN HG2 1.0 . 3.70 833 745 A 80 GLN HG3 A 75 LYS HBx 1.0 . 3.70 834 746 A 79 GLN HBx A 75 LYS HBx 1.0 . 3.91 835 747 A 65 ILE H A 65 ILE HB 1.0 . 3.35 836 748 A 101 PHE H A 65 ILE HB 1.0 . 3.75 837 749 A 41 LYS HA A 41 LYS HDy 1.0 . 4.50 838 750 A 63 TYR HD% A 98 LEU HG 1.0 . 4.86 839 751 A 99 ARG H A 98 LEU HG 1.0 . 5.19 840 752 A 66 LYS HA A 65 ILE HB 1.0 . 5.50 841 753 A 51 LYS H A 51 LYS HBx 1.0 . 3.70 842 754 A 92 ILE H A 88 LEU HB2 1.0 . 4.35 843 754 A 92 ILE H A 88 LEU HB3 1.0 . 4.35 844 755 A 98 LEU HG A 98 LEU HA 1.0 . 4.14 845 756 A 35 ARG H A 34 LEU HG 1.0 . 3.60 846 757 A 44 PHE H A 43 LYS HBy 1.0 . 3.76 847 758 A 87 ALA H A 43 LYS HBy 1.0 . 5.50 848 759 A 44 PHE HE% A 43 LYS HBy 1.0 . 4.14 849 760 A 44 PHE HZ A 43 LYS HBy 1.0 . 5.25 850 761 A 30 THR H A 34 LEU HG 1.0 . 5.50 851 762 A 75 LYS HDy A 79 GLN HBy 1.0 . 5.12 852 763 A 76 ARG H A 75 LYS HDy 1.0 . 5.50 853 764 A 41 LYS H A 41 LYS HGy 1.0 . 3.50 854 765 A 50 ILE H A 50 ILE HG1y 1.0 . 3.41 855 766 A 46 ARG HA A 46 ARG HGx 1.0 . 3.78 856 767 A 37 THR HG2% A 41 LYS HGy 1.0 . 3.73 857 768 A 72 PHE H A 73 LYS HG2 1.0 . 5.20 858 768 A 73 LYS HG3 A 72 PHE H 1.0 . 5.20 859 769 A 73 LYS HA A 73 LYS HG2 1.0 . 3.38 860 769 A 73 LYS HG3 A 73 LYS HA 1.0 . 3.38 861 770 A 74 GLU HBy A 73 LYS HG2 1.0 . 4.84 862 770 A 73 LYS HG3 A 74 GLU HBy 1.0 . 4.84 863 771 A 104 VAL HG2% A 73 LYS HG2 1.0 . 4.18 864 771 A 73 LYS HG3 A 104 VAL HG2% 1.0 . 4.18 865 772 A 87 ALA H A 87 ALA HB% 1.0 . 2.91 866 773 A 89 LYS H A 87 ALA HB% 1.0 . 5.43 867 774 A 88 LEU H A 87 ALA HB% 1.0 . 3.28 868 775 A 44 PHE HE% A 87 ALA HB% 1.0 . 3.19 869 776 A 44 PHE HZ A 87 ALA HB% 1.0 . 3.75 870 777 A 84 VAL HA A 87 ALA HB% 1.0 . 3.47 871 778 A 40 LEU HD2% A 87 ALA HB% 1.0 . 3.70 872 779 A 88 LEU HD1% A 87 ALA HB% 1.0 . 3.93 873 780 A 64 GLU HA A 99 ARG HGy 1.0 . 5.49 874 781 A 107 ARG HA A 107 ARG HG2 1.0 . 3.23 875 781 A 107 ARG HA A 107 ARG HG3 1.0 . 3.23 876 782 A 76 ARG H A 75 LYS HGy 1.0 . 5.49 877 783 A 46 ARG H A 46 ARG HGy 1.0 . 4.06 878 784 A 46 ARG HA A 46 ARG HGy 1.0 . 3.43 879 785 A 65 ILE HG2% A 67 ILE HG1y 1.0 . 4.06 880 786 A 90 GLU H A 89 LYS HGy 1.0 . 4.57 881 787 A 44 PHE H A 43 LYS HGy 1.0 . 4.71 882 788 A 86 GLN HA A 89 LYS HGy 1.0 . 4.65 883 789 A 51 LYS H A 67 ILE HG1y 1.0 . 5.50 884 790 A 44 PHE HD% A 43 LYS HGy 1.0 . 5.13 885 791 A 72 PHE HE% A 67 ILE HB 1.0 . 3.47 886 792 A 44 PHE HE% A 43 LYS HGy 1.0 . 4.73 887 793 A 72 PHE HZ A 67 ILE HB 1.0 . 4.13 888 794 A 102 THR HA A 67 ILE HB 1.0 . 4.46 889 795 A 36 VAL H A 35 ARG HGx 1.0 . 4.21 890 796 A 68 GLU H A 47 ALA HB% 1.0 . 4.55 891 797 A 48 THR H A 47 ALA HB% 1.0 . 3.62 892 798 A 93 LYS H A 93 LYS HGy 1.0 . 4.11 893 799 A 47 ALA H A 47 ALA HB% 1.0 . 3.01 894 800 A 49 ALA H A 47 ALA HB% 1.0 . 3.71 895 801 A 44 PHE HD% A 47 ALA HB% 1.0 . 4.25 896 802 A 106 LYS HA A 106 LYS HGy 1.0 . 4.04 897 803 A 69 SER HBy A 47 ALA HB% 1.0 . 3.57 898 804 A 47 ALA HB% A 44 PHE HBy 1.0 . 3.45 899 805 A 47 ALA HB% A 44 PHE HBx 1.0 . 3.69 900 806 A 69 SER HBx A 47 ALA HB% 1.0 . 4.25 901 807 A 46 ARG H A 46 ARG HBx 1.0 . 3.59 902 808 A 76 ARG H A 75 LYS HGx 1.0 . 5.39 903 809 A 106 LYS H A 106 LYS HGx 1.0 . 4.71 904 810 A 47 ALA H A 46 ARG HBx 1.0 . 4.32 905 811 A 75 LYS H A 75 LYS HGx 1.0 . 4.19 906 812 A 101 PHE HE% A 99 ARG HGx 1.0 . 4.02 907 813 A 64 GLU HA A 99 ARG HGx 1.0 . 5.50 908 814 A 86 GLN HA A 89 LYS HGx 1.0 . 4.92 909 815 A 66 LYS HGy A 66 LYS HEx 1.0 . 4.11 910 816 A 90 GLU H A 89 LYS HGx 1.0 . 4.57 911 817 A 44 PHE H A 43 LYS HBx 1.0 . 4.07 912 818 A 101 PHE HD% A 66 LYS HGy 1.0 . 4.40 913 819 A 44 PHE HE% A 43 LYS HBx 1.0 . 4.46 914 820 A 44 PHE HZ A 43 LYS HBx 1.0 . 5.50 915 821 A 93 LYS HA A 93 LYS HGx 1.0 . 3.72 916 822 A 89 LYS HA A 89 LYS HGx 1.0 . 3.64 917 823 A 41 LYS H A 41 LYS HGx 1.0 . 4.33 918 824 A 44 PHE HD% A 43 LYS HBx 1.0 . 4.02 919 825 A 41 LYS HGx A 41 LYS HEx 1.0 . 4.17 920 825 A 41 LYS HEy A 41 LYS HGx 1.0 . 4.17 921 826 A 92 ILE HG1y A 92 ILE HA 1.0 . 3.94 922 827 A 61 ALA H A 30 THR HG2% 1.0 . 5.06 923 828 A 50 ILE H A 51 LYS HG2 1.0 . 5.46 924 828 A 50 ILE H A 51 LYS HG3 1.0 . 5.46 925 829 A 43 LYS H A 43 LYS HGx 1.0 . 4.12 926 830 A 30 THR H A 30 THR HG2% 1.0 . 3.27 927 831 A 51 LYS H A 51 LYS HG2 1.0 . 4.26 928 831 A 51 LYS H A 51 LYS HG3 1.0 . 4.26 929 832 A 31 GLU H A 30 THR HG2% 1.0 . 4.11 930 833 A 43 LYS HA A 43 LYS HGx 1.0 . 4.01 931 834 A 54 ASP HBy A 30 THR HG2% 1.0 . 4.04 932 835 A 33 GLU HGy A 30 THR HG2% 1.0 . 5.42 933 836 A 54 ASP HBx A 30 THR HG2% 1.0 . 4.71 934 837 A 41 LYS H A 40 LEU HBx 1.0 . 3.42 935 838 A 44 PHE HE% A 43 LYS HGx 1.0 . 4.92 936 839 A 44 PHE HZ A 43 LYS HGx 1.0 . 5.50 937 840 A 87 ALA HA A 43 LYS HGx 1.0 . 3.52 938 841 A 66 LYS H A 51 LYS HG2 1.0 . 5.15 939 841 A 66 LYS H A 51 LYS HG3 1.0 . 5.15 940 842 A 44 PHE HD% A 40 LEU HBx 1.0 . 3.84 941 843 A 40 LEU HDx% A 40 LEU HBx 1.0 . 3.87 942 844 A 61 ALA HB% A 60 GLY H 1.0 . 5.47 943 845 A 101 PHE H A 100 ILE HG1y 1.0 . 5.48 944 846 A 61 ALA H A 61 ALA HB% 1.0 . 3.16 945 847 A 62 MET H A 61 ALA HB% 1.0 . 3.77 946 848 A 61 ALA HB% A 96 HIS HD2 1.0 . 4.94 947 849 A 63 TYR HE% A 61 ALA HB% 1.0 . 5.14 948 850 A 97 GLY HAy A 61 ALA HB% 1.0 . 5.33 949 851 A 61 ALA HB% A 59 CYS HBy 1.0 . 4.18 950 851 A 59 CYS HBx A 61 ALA HB% 1.0 . 4.18 951 852 A 70 GLU H A 48 THR HG2% 1.0 . 5.36 952 853 A 51 LYS H A 49 ALA HB% 1.0 . 5.50 953 854 A 68 GLU H A 49 ALA HB% 1.0 . 4.01 954 855 A 48 THR H A 48 THR HG2% 1.0 . 3.56 955 856 A 50 ILE H A 49 ALA HB% 1.0 . 3.58 956 857 A 100 ILE H A 100 ILE HG1y 1.0 . 3.66 957 858 A 49 ALA H A 49 ALA HB% 1.0 . 3.38 958 859 A 68 GLU HA A 49 ALA HB% 1.0 . 5.19 959 860 A 48 THR HA A 48 THR HG2% 1.0 . 2.68 960 861 A 48 THR HG2% A 105 PRO HBx 1.0 . 4.25 961 862 A 68 GLU HBy A 49 ALA HB% 1.0 . 3.41 962 863 A 68 GLU HGy A 49 ALA HB% 1.0 . 4.39 963 864 A 80 GLN HBx A 72 PHE HBx 1.0 . 4.13 964 865 A 48 THR HG2% A 105 PRO HGy 1.0 . 3.69 965 866 A 30 THR H A 28 THR HG2% 1.0 . 5.50 966 867 A 29 GLN H A 28 THR HG2% 1.0 . 4.85 967 868 A 28 THR HA A 28 THR HG2% 1.0 . 3.49 968 869 A 101 PHE HE% A 66 LYS HGx 1.0 . 5.21 969 870 A 101 PHE HD% A 66 LYS HGx 1.0 . 4.00 970 871 A 101 PHE HBy A 66 LYS HGx 1.0 . 3.96 971 872 A 101 PHE HBx A 66 LYS HGx 1.0 . 3.64 972 873 A 54 ASP H A 53 THR HG2% 1.0 . 3.69 973 874 A 64 GLU H A 53 THR HG2% 1.0 . 5.09 974 875 A 53 THR H A 53 THR HG2% 1.0 . 4.34 975 876 A 63 TYR HD% A 53 THR HG2% 1.0 . 5.50 976 877 A 54 ASP HBy A 53 THR HG2% 1.0 . 5.11 977 878 A 63 TYR HA A 53 THR HG2% 1.0 . 5.50 978 879 A 41 LYS H A 37 THR HG2% 1.0 . 4.54 979 880 A 38 GLN H A 37 THR HG2% 1.0 . 4.06 980 881 A 37 THR H A 37 THR HG2% 1.0 . 3.97 981 882 A 37 THR HG2% A 38 GLN HE22 1.0 . 5.25 982 883 A 37 THR HA A 37 THR HG2% 1.0 . 3.04 983 884 A 34 LEU HA A 37 THR HG2% 1.0 . 4.21 984 885 A 37 THR HG2% A 52 VAL HG2% 1.0 . 4.52 985 885 A 52 VAL HG1% A 37 THR HG2% 1.0 . 4.52 986 886 A 99 ARG H A 98 LEU HBx 1.0 . 3.99 987 887 A 100 ILE HG1x A 98 LEU HBx 1.0 . 4.81 988 888 A 100 ILE HG2% A 98 LEU HBx 1.0 . 5.50 989 889 A 39 ILE HA A 39 ILE HG1x 1.0 . 3.31 990 890 A 65 ILE H A 65 ILE HG1x 1.0 . 4.34 991 891 A 66 LYS H A 65 ILE HG1x 1.0 . 5.02 992 892 A 39 ILE H A 39 ILE HG1x 1.0 . 3.77 993 893 A 36 VAL HA A 39 ILE HG1x 1.0 . 5.50 994 894 A 70 GLU H A 104 VAL HG2% 1.0 . 5.50 995 895 A 69 SER H A 104 VAL HG2% 1.0 . 4.62 996 896 A 104 VAL HG2% A 73 LYS H 1.0 . 4.07 997 897 A 72 PHE HD% A 104 VAL HG2% 1.0 . 4.56 998 898 A 104 VAL HG2% A 72 PHE H 1.0 . 4.39 999 899 A 104 VAL HG2% A 68 GLU HA 1.0 . 5.50 1000 900 A 105 PRO HA A 104 VAL HG2% 1.0 . 5.50 1001 901 A 104 VAL HG2% A 70 GLU HA 1.0 . 3.45 1002 902 A 104 VAL HG2% A 73 LYS HA 1.0 . 3.47 1003 903 A 104 VAL HG2% A 105 PRO HDy 1.0 . 3.54 1004 904 A 104 VAL HG2% A 72 PHE HBy 1.0 . 4.32 1005 905 A 104 VAL HG2% A 70 GLU HGy 1.0 . 5.24 1006 906 A 104 VAL HG2% A 73 LYS HB2 1.0 . 3.75 1007 906 A 104 VAL HG2% A 73 LYS HB3 1.0 . 3.75 1008 907 A 55 ILE HG1y A 56 SER H 1.0 . 4.97 1009 908 A 55 ILE HG1y A 63 TYR HA 1.0 . 4.72 1010 909 A 55 ILE HG1y A 62 MET HE% 1.0 . 5.08 1011 910 A 104 VAL HG1% A 105 PRO HDy 1.0 . 4.72 1012 911 A 104 VAL HG1% A 105 PRO HDx 1.0 . 5.01 1013 912 A 104 VAL HG1% A 72 PHE HBx 1.0 . 3.61 1014 913 A 104 VAL H A 104 VAL HG1% 1.0 . 3.24 1015 914 A 104 VAL HG1% A 73 LYS H 1.0 . 4.30 1016 915 A 104 VAL HG1% A 72 PHE H 1.0 . 4.45 1017 916 A 104 VAL HG1% A 73 LYS HA 1.0 . 3.53 1018 917 A 104 VAL HG1% A 103 SER HBy 1.0 . 4.68 1019 918 A 104 VAL HG1% A 72 PHE HBy 1.0 . 4.08 1020 919 A 78 VAL HG2% A 82 GLN HBx 1.0 . 4.49 1021 920 A 104 VAL HG1% A 68 GLU HGx 1.0 . 5.50 1022 921 A 78 VAL HG2% A 82 GLN H 1.0 . 4.84 1023 922 A 79 GLN H A 78 VAL HG2% 1.0 . 4.04 1024 923 A 78 VAL HG2% A 78 VAL HA 1.0 . 3.14 1025 924 A 78 VAL HG2% A 79 GLN HA 1.0 . 4.60 1026 925 A 99 ARG H A 98 LEU HD2% 1.0 . 4.42 1027 926 A 41 LYS H A 40 LEU HD2% 1.0 . 5.32 1028 927 A 98 LEU HD2% A 97 GLY H 1.0 . 5.50 1029 928 A 43 LYS H A 40 LEU HD2% 1.0 . 5.35 1030 929 A 98 LEU H A 98 LEU HD2% 1.0 . 4.67 1031 930 A 44 PHE HD% A 40 LEU HD2% 1.0 . 3.34 1032 931 A 63 TYR HD% A 98 LEU HD2% 1.0 . 3.66 1033 932 A 63 TYR HE% A 98 LEU HD2% 1.0 . 5.05 1034 933 A 98 LEU HD2% A 95 MET HA 1.0 . 5.14 1035 934 A 40 LEU HBy A 40 LEU HD2% 1.0 . 3.53 1036 935 A 67 ILE HD1% A 40 LEU HD2% 1.0 . 3.75 1037 936 A 64 GLU H A 98 LEU HD2% 1.0 . 5.50 1038 937 A 44 PHE H A 40 LEU HD2% 1.0 . 4.97 1039 938 A 40 LEU H A 40 LEU HD2% 1.0 . 3.91 1040 939 A 44 PHE HE% A 40 LEU HD2% 1.0 . 3.21 1041 940 A 63 TYR HA A 98 LEU HD2% 1.0 . 5.50 1042 941 A 98 LEU HA A 98 LEU HD2% 1.0 . 3.29 1043 942 A 40 LEU HA A 40 LEU HD2% 1.0 . 3.10 1044 943 A 78 VAL H A 78 VAL HG1% 1.0 . 3.48 1045 944 A 79 GLN H A 78 VAL HG1% 1.0 . 3.73 1046 945 A 76 ARG HA A 78 VAL HG1% 1.0 . 5.33 1047 946 A 77 THR HA A 78 VAL HG1% 1.0 . 4.87 1048 947 A 78 VAL HA A 78 VAL HG1% 1.0 . 3.23 1049 948 A 79 GLN HA A 78 VAL HG1% 1.0 . 4.22 1050 949 A 78 VAL HG1% A 76 ARG HD2 1.0 . 4.76 1051 949 A 78 VAL HG1% A 76 ARG HD3 1.0 . 4.76 1052 950 A 35 ARG H A 34 LEU HDx% 1.0 . 4.59 1053 950 A 35 ARG H A 34 LEU HD2% 1.0 . 4.59 1054 951 A 37 THR H A 34 LEU HDx% 1.0 . 5.06 1055 951 A 37 THR H A 34 LEU HD2% 1.0 . 5.06 1056 952 A 29 GLN HGy A 34 LEU HDx% 1.0 . 4.24 1057 952 A 29 GLN HGx A 34 LEU HDx% 1.0 . 4.24 1058 952 A 34 LEU HD2% A 29 GLN HGy 1.0 . 4.24 1059 952 A 29 GLN HGx A 34 LEU HD2% 1.0 . 4.24 1060 953 A 64 GLU HBy A 55 ILE HG2% 1.0 . 3.83 1061 954 A 64 GLU HBx A 55 ILE HG2% 1.0 . 3.73 1062 955 A 64 GLU H A 55 ILE HG2% 1.0 . 4.00 1063 956 A 56 SER H A 55 ILE HG2% 1.0 . 4.98 1064 957 A 34 LEU H A 34 LEU HDx% 1.0 . 3.82 1065 957 A 34 LEU H A 34 LEU HD2% 1.0 . 3.82 1066 958 A 55 ILE H A 55 ILE HG2% 1.0 . 3.77 1067 959 A 29 GLN HE21 A 34 LEU HDx% 1.0 . 4.76 1068 959 A 29 GLN HE21 A 34 LEU HD2% 1.0 . 4.76 1069 960 A 29 GLN HE22 A 34 LEU HDx% 1.0 . 4.95 1070 960 A 34 LEU HD2% A 29 GLN HE22 1.0 . 4.95 1071 961 A 63 TYR HA A 55 ILE HG2% 1.0 . 4.42 1072 962 A 94 GLU HA A 92 ILE HG2% 1.0 . 4.55 1073 963 A 31 GLU HA A 34 LEU HDx% 1.0 . 3.43 1074 963 A 31 GLU HA A 34 LEU HD2% 1.0 . 3.43 1075 964 A 34 LEU HA A 34 LEU HDx% 1.0 . 3.05 1076 964 A 34 LEU HA A 34 LEU HD2% 1.0 . 3.05 1077 965 A 53 THR HB A 55 ILE HG2% 1.0 . 3.54 1078 966 A 37 THR HB A 34 LEU HDx% 1.0 . 5.50 1079 966 A 37 THR HB A 34 LEU HD2% 1.0 . 5.50 1080 967 A 53 THR HG2% A 55 ILE HG2% 1.0 . 3.49 1081 968 A 85 ASN H A 84 VAL HG1% 1.0 . 4.18 1082 969 A 93 LYS H A 92 ILE HG2% 1.0 . 4.17 1083 970 A 94 GLU H A 92 ILE HG2% 1.0 . 3.50 1084 971 A 84 VAL H A 84 VAL HG1% 1.0 . 3.15 1085 972 A 72 PHE HE% A 84 VAL HG1% 1.0 . 3.80 1086 973 A 44 PHE HE% A 84 VAL HG1% 1.0 . 3.80 1087 974 A 44 PHE HZ A 84 VAL HG1% 1.0 . 3.79 1088 975 A 63 TYR HD% A 98 LEU HDx% 1.0 . 4.38 1089 976 A 63 TYR HE% A 98 LEU HDx% 1.0 . 4.81 1090 977 A 72 PHE HZ A 84 VAL HG1% 1.0 . 3.50 1091 978 A 84 VAL HG1% A 102 THR HA 1.0 . 5.50 1092 979 A 98 LEU HA A 98 LEU HDx% 1.0 . 4.07 1093 980 A 95 MET HA A 98 LEU HDx% 1.0 . 3.73 1094 981 A 92 ILE HA A 92 ILE HG2% 1.0 . 3.20 1095 982 A 84 VAL HA A 84 VAL HG1% 1.0 . 3.17 1096 983 A 83 MET HBy A 84 VAL HG1% 1.0 . 4.41 1097 984 A 65 ILE HG2% A 67 ILE HG1x 1.0 . 3.54 1098 985 A 102 THR HG2% A 84 VAL HG1% 1.0 . 3.54 1099 986 A 84 VAL HG1% A 100 ILE HG2% 1.0 . 3.87 1100 987 A 81 HIS HA A 84 VAL HG1% 1.0 . 3.57 1101 988 A 67 ILE H A 67 ILE HG1x 1.0 . 4.53 1102 989 A 40 LEU H A 39 ILE HG2% 1.0 . 3.81 1103 990 A 43 LYS H A 39 ILE HG2% 1.0 . 4.77 1104 991 A 39 ILE H A 39 ILE HG2% 1.0 . 3.95 1105 992 A 44 PHE HD% A 84 VAL HG1% 1.0 . 4.16 1106 993 A 39 ILE HG2% A 39 ILE HA 1.0 . 3.07 1107 994 A 39 ILE HG2% A 43 LYS HEy 1.0 . 3.91 1108 995 A 50 ILE H A 50 ILE HG1x 1.0 . 3.76 1109 996 A 41 LYS HA A 50 ILE HD1% 1.0 . 3.29 1110 997 A 44 PHE HBy A 50 ILE HG2% 1.0 . 4.45 1111 998 A 68 GLU H A 50 ILE HG2% 1.0 . 4.46 1112 999 A 63 TYR H A 55 ILE HD1% 1.0 . 5.50 1113 1000 A 63 TYR HD% A 55 ILE HD1% 1.0 . 5.50 1114 1001 A 64 GLU H A 55 ILE HD1% 1.0 . 4.86 1115 1002 A 56 SER H A 55 ILE HD1% 1.0 . 5.50 1116 1003 A 99 ARG H A 55 ILE HD1% 1.0 . 5.34 1117 1004 A 55 ILE H A 55 ILE HD1% 1.0 . 4.09 1118 1005 A 55 ILE HD1% A 62 MET HGy 1.0 . 4.12 1119 1006 A 64 GLU HGy A 55 ILE HD1% 1.0 . 4.37 1120 1007 A 55 ILE HD1% A 55 ILE HB 1.0 . 3.22 1121 1008 A 53 THR H A 55 ILE HD1% 1.0 . 5.50 1122 1009 A 39 ILE HD1% A 91 GLU H 1.0 . 5.05 1123 1010 A 88 LEU H A 88 LEU HD2% 1.0 . 3.99 1124 1011 A 84 VAL HG2% A 84 VAL H 1.0 . 4.15 1125 1012 A 72 PHE HE% A 84 VAL HG2% 1.0 . 5.50 1126 1013 A 44 PHE HE% A 84 VAL HG2% 1.0 . 4.33 1127 1014 A 84 VAL HG2% A 72 PHE HZ 1.0 . 5.19 1128 1015 A 39 ILE HD1% A 91 GLU HG2 1.0 . 3.55 1129 1015 A 39 ILE HD1% A 91 GLU HG3 1.0 . 3.55 1130 1016 A 39 ILE HD1% A 35 ARG HGx 1.0 . 4.37 1131 1017 A 54 ASP H A 52 VAL HG2% 1.0 . 5.42 1132 1017 A 54 ASP H A 52 VAL HG1% 1.0 . 5.42 1133 1018 A 85 ASN H A 84 VAL HG2% 1.0 . 4.14 1134 1019 A 84 VAL HG2% A 44 PHE HZ 1.0 . 4.64 1135 1020 A 81 HIS HD2 A 84 VAL HG2% 1.0 . 5.50 1136 1021 A 63 TYR HA A 52 VAL HG2% 1.0 . 4.97 1137 1021 A 52 VAL HG1% A 63 TYR HA 1.0 . 4.97 1138 1022 A 89 LYS HA A 88 LEU HD2% 1.0 . 4.24 1139 1023 A 84 VAL HA A 84 VAL HG2% 1.0 . 2.89 1140 1024 A 63 TYR HBy A 52 VAL HG2% 1.0 . 4.01 1141 1024 A 52 VAL HG1% A 63 TYR HBy 1.0 . 4.01 1142 1025 A 84 VAL HG2% A 40 LEU HD2% 1.0 . 3.56 1143 1026 A 100 ILE HD1% A 84 VAL HG2% 1.0 . 3.32 1144 1027 A 92 ILE HD1% A 36 VAL HG1% 1.0 . 3.66 1145 1028 A 64 GLU H A 52 VAL HG2% 1.0 . 5.15 1146 1028 A 64 GLU H A 52 VAL HG1% 1.0 . 5.15 1147 1029 A 53 THR H A 52 VAL HG2% 1.0 . 3.68 1148 1029 A 53 THR H A 52 VAL HG1% 1.0 . 3.68 1149 1030 A 67 ILE H A 84 VAL HG2% 1.0 . 5.20 1150 1031 A 93 LYS H A 92 ILE HD1% 1.0 . 5.42 1151 1032 A 63 TYR HD% A 52 VAL HG2% 1.0 . 3.16 1152 1032 A 63 TYR HD% A 52 VAL HG1% 1.0 . 3.16 1153 1033 A 84 VAL HG2% A 102 THR HA 1.0 . 5.50 1154 1034 A 93 LYS HA A 88 LEU HD2% 1.0 . 3.97 1155 1035 A 32 GLY HAx A 92 ILE HD1% 1.0 . 4.67 1156 1036 A 33 GLU HBy A 52 VAL HG2% 1.0 . 5.07 1157 1036 A 33 GLU HBy A 52 VAL HG1% 1.0 . 5.07 1158 1037 A 63 TYR HBx A 52 VAL HG2% 1.0 . 4.21 1159 1037 A 52 VAL HG1% A 63 TYR HBx 1.0 . 4.21 1160 1038 A 84 VAL HG2% A 67 ILE HA 1.0 . 5.50 1161 1039 A 51 LYS H A 52 VAL HG2% 1.0 . 4.85 1162 1039 A 51 LYS H A 52 VAL HG1% 1.0 . 4.85 1163 1040 A 66 LYS H A 52 VAL HG2% 1.0 . 4.75 1164 1040 A 66 LYS H A 52 VAL HG1% 1.0 . 4.75 1165 1041 A 52 VAL H A 52 VAL HG2% 1.0 . 3.63 1166 1041 A 52 VAL H A 52 VAL HG1% 1.0 . 3.63 1167 1042 A 37 THR HA A 52 VAL HG2% 1.0 . 5.00 1168 1042 A 37 THR HA A 52 VAL HG1% 1.0 . 5.00 1169 1043 A 87 ALA H A 88 LEU HD1% 1.0 . 3.63 1170 1044 A 81 HIS HD2 A 100 ILE HB 1.0 . 3.64 1171 1045 A 77 THR HA A 77 THR HG2% 1.0 . 3.01 1172 1046 A 80 GLN HBy A 77 THR HG2% 1.0 . 4.43 1173 1047 A 68 GLU H A 67 ILE HG2% 1.0 . 3.95 1174 1048 A 72 PHE HD% A 67 ILE HG2% 1.0 . 4.41 1175 1049 A 88 LEU H A 88 LEU HD1% 1.0 . 3.72 1176 1050 A 72 PHE HE% A 67 ILE HG2% 1.0 . 3.30 1177 1051 A 44 PHE HE% A 67 ILE HG2% 1.0 . 4.53 1178 1052 A 44 PHE HZ A 67 ILE HG2% 1.0 . 5.50 1179 1053 A 72 PHE HZ A 67 ILE HG2% 1.0 . 3.72 1180 1054 A 68 GLU HA A 67 ILE HG2% 1.0 . 4.84 1181 1055 A 67 ILE HG2% A 69 SER HBy 1.0 . 4.27 1182 1056 A 67 ILE HG2% A 44 PHE HBy 1.0 . 5.16 1183 1057 A 81 HIS HBy A 77 THR HG2% 1.0 . 4.80 1184 1058 A 69 SER HBx A 67 ILE HG2% 1.0 . 4.52 1185 1059 A 51 LYS H A 67 ILE HG2% 1.0 . 5.11 1186 1060 A 40 LEU H A 40 LEU HDx% 1.0 . 3.87 1187 1061 A 37 THR H A 40 LEU HDx% 1.0 . 4.74 1188 1062 A 67 ILE HD1% A 67 ILE HG2% 1.0 . 3.27 1189 1063 A 101 PHE H A 100 ILE HB 1.0 . 4.16 1190 1064 A 85 ASN HD21 A 100 ILE HB 1.0 . 5.44 1191 1065 A 52 VAL H A 65 ILE HG2% 1.0 . 5.50 1192 1066 A 65 ILE HG2% A 67 ILE HA 1.0 . 5.50 1193 1067 A 64 GLU H A 55 ILE HG1x 1.0 . 4.90 1194 1068 A 56 SER H A 55 ILE HG1x 1.0 . 5.03 1195 1069 A 65 ILE H A 65 ILE HD1% 1.0 . 4.31 1196 1070 A 66 LYS H A 65 ILE HG2% 1.0 . 3.62 1197 1071 A 53 THR H A 65 ILE HG2% 1.0 . 5.39 1198 1072 A 62 MET H A 55 ILE HG1x 1.0 . 5.29 1199 1073 A 65 ILE HG2% A 66 LYS HA 1.0 . 4.68 1200 1074 A 55 ILE HG1x A 62 MET HE% 1.0 . 5.48 1201 1075 A 65 ILE HG2% A 67 ILE H 1.0 . 4.51 1202 1076 A 55 ILE H A 55 ILE HG1x 1.0 . 3.42 1203 1077 A 100 ILE HD1% A 81 HIS HD2 1.0 . 5.06 1204 1078 A 63 TYR HA A 55 ILE HG1x 1.0 . 4.06 1205 1079 A 100 ILE HD1% A 85 ASN H 1.0 . 4.38 1206 1080 A 100 ILE HD1% A 84 VAL H 1.0 . 4.96 1207 1081 A 100 ILE HD1% A 85 ASN HD22 1.0 . 4.76 1208 1082 A 100 ILE HD1% A 85 ASN HD21 1.0 . 4.46 1209 1083 A 100 ILE HD1% A 84 VAL HB 1.0 . 3.53 1210 1084 A 36 VAL H A 36 VAL HG2% 1.0 . 4.00 1211 1085 A 40 LEU H A 36 VAL HG2% 1.0 . 4.95 1212 1086 A 37 THR H A 36 VAL HG2% 1.0 . 4.08 1213 1087 A 36 VAL HA A 36 VAL HG2% 1.0 . 3.26 1214 1088 A 36 VAL HG2% A 40 LEU HDx% 1.0 . 3.13 1215 1089 A 63 TYR HD% A 36 VAL HG2% 1.0 . 4.94 1216 1090 A 37 THR HA A 36 VAL HG2% 1.0 . 5.50 1217 1091 A 33 GLU HA A 36 VAL HG2% 1.0 . 4.64 1218 1092 A 36 VAL HG2% A 52 VAL HB 1.0 . 4.91 1219 1093 A 101 PHE H A 102 THR HG2% 1.0 . 5.05 1220 1094 A 102 THR H A 102 THR HG2% 1.0 . 4.08 1221 1095 A 103 SER H A 102 THR HG2% 1.0 . 3.95 1222 1096 A 102 THR HG2% A 84 VAL H 1.0 . 5.46 1223 1097 A 72 PHE HD% A 102 THR HG2% 1.0 . 4.55 1224 1098 A 72 PHE HE% A 102 THR HG2% 1.0 . 3.83 1225 1099 A 102 THR HG2% A 44 PHE HE% 1.0 . 5.50 1226 1100 A 81 HIS HD2 A 102 THR HG2% 1.0 . 3.57 1227 1101 A 102 THR HG2% A 72 PHE HZ 1.0 . 3.91 1228 1102 A 66 LYS HA A 102 THR HG2% 1.0 . 5.50 1229 1103 A 102 THR HG2% A 102 THR HA 1.0 . 3.16 1230 1104 A 81 HIS HA A 102 THR HG2% 1.0 . 4.10 1231 1105 A 102 THR HG2% A 80 GLN HBy 1.0 . 4.23 1232 1106 A 36 VAL HG1% A 91 GLU HG2 1.0 . 4.01 1233 1106 A 91 GLU HG3 A 36 VAL HG1% 1.0 . 4.01 1234 1107 A 102 THR HG2% A 68 GLU HA 1.0 . 5.50 1235 1108 A 35 ARG H A 36 VAL HG1% 1.0 . 4.92 1236 1109 A 36 VAL H A 36 VAL HG1% 1.0 . 3.14 1237 1110 A 37 THR H A 36 VAL HG1% 1.0 . 4.26 1238 1111 A 63 TYR HD% A 36 VAL HG1% 1.0 . 4.57 1239 1112 A 63 TYR HE% A 36 VAL HG1% 1.0 . 4.14 1240 1113 A 32 GLY HAx A 36 VAL HG1% 1.0 . 5.09 1241 1114 A 32 GLY HAy A 36 VAL HG1% 1.0 . 5.09 1242 1115 A 33 GLU HA A 36 VAL HG1% 1.0 . 4.37 1243 1116 A 36 VAL HA A 36 VAL HG1% 1.0 . 3.11 1244 1117 A 92 ILE HB A 36 VAL HG1% 1.0 . 3.91 1245 1118 A 67 ILE H A 67 ILE HD1% 1.0 . 4.97 1246 1119 A 81 HIS HD2 A 100 ILE HG1x 1.0 . 4.78 1247 1120 A 72 PHE HD% A 67 ILE HD1% 1.0 . 5.50 1248 1121 A 67 ILE HD1% A 44 PHE HD% 1.0 . 3.91 1249 1122 A 72 PHE HE% A 67 ILE HD1% 1.0 . 4.26 1250 1123 A 67 ILE HD1% A 44 PHE HE% 1.0 . 4.33 1251 1124 A 67 ILE HD1% A 44 PHE HZ 1.0 . 5.16 1252 1125 A 67 ILE HD1% A 72 PHE HZ 1.0 . 3.88 1253 1126 A 67 ILE HD1% A 44 PHE HBy 1.0 . 4.60 1254 1127 A 67 ILE HD1% A 44 PHE HBx 1.0 . 4.17 1255 1128 A 67 ILE HD1% A 40 LEU HG 1.0 . 5.50 1256 1129 A 65 ILE H A 100 ILE HG1x 1.0 . 5.47 1257 1130 A 100 ILE H A 100 ILE HG1x 1.0 . 4.27 1258 1131 A 100 ILE HA A 100 ILE HG1x 1.0 . 3.70 1259 1132 A 67 ILE HD1% A 84 VAL HB 1.0 . 5.50 1260 1133 A 65 ILE H A 100 ILE HG2% 1.0 . 5.25 1261 1134 A 101 PHE H A 100 ILE HG2% 1.0 . 3.59 1262 1135 A 102 THR H A 100 ILE HG2% 1.0 . 4.53 1263 1136 A 85 ASN H A 100 ILE HG2% 1.0 . 5.30 1264 1137 A 67 ILE H A 100 ILE HG2% 1.0 . 4.76 1265 1138 A 100 ILE H A 100 ILE HG2% 1.0 . 4.27 1266 1139 A 84 VAL H A 100 ILE HG2% 1.0 . 5.09 1267 1140 A 101 PHE HD% A 100 ILE HG2% 1.0 . 5.50 1268 1141 A 81 HIS HD2 A 100 ILE HG2% 1.0 . 3.71 1269 1142 A 66 LYS HA A 100 ILE HG2% 1.0 . 5.50 1270 1143 A 102 THR HA A 100 ILE HG2% 1.0 . 4.80 1271 1144 A 100 ILE HA A 100 ILE HG2% 1.0 . 3.33 1272 1145 A 81 HIS HA A 100 ILE HG2% 1.0 . 3.62 1273 1146 A 100 ILE HG2% A 84 VAL HB 1.0 . 3.96 1274 1147 A 100 ILE HG2% A 67 ILE HB 1.0 . 5.50 1275 1148 A 98 LEU HD2% A 100 ILE HG2% 1.0 . 5.18 1276 1149 A 100 ILE HD1% A 100 ILE HG2% 1.0 . 3.21 1277 1150 A 102 THR HG2% A 100 ILE HG2% 1.0 . 3.24 1278 1151 A 75 LYS HA A 79 GLN HBy 1.0 . 4.08 1279 1152 A 75 LYS HA A 75 LYS HDx 1.0 . 3.21 1280 1153 A 63 TYR H A 98 LEU HA 1.0 . 3.46 1281 1154 A 47 ALA HA A 67 ILE HG2% 1.0 . 5.25 1282 1155 A 47 ALA HA A 69 SER HBy 1.0 . 3.32 1283 1156 A 80 GLN H A 79 GLN HBy 1.0 . 4.47 1284 1157 A 78 VAL HG1% A 79 GLN HBy 1.0 . 5.50 1285 1158 A 75 LYS HDx A 79 GLN HBy 1.0 . 4.07 1286 1159 A 39 ILE HA A 42 GLU HBy 1.0 . 4.04 1287 1160 A 43 LYS HGy A 42 GLU HBy 1.0 . 4.29 1288 1161 A 42 GLU HGy A 42 GLU HBx 1.0 . 2.69 1289 1162 A 39 ILE HA A 42 GLU HBx 1.0 . 4.40 1290 1163 A 105 PRO HDx A 70 GLU HBx 1.0 . 5.48 1291 1164 A 74 GLU HBx A 73 LYS HDy 1.0 . 4.39 1292 1165 A 68 GLU HA A 68 GLU HGx 1.0 . 3.30 1293 1166 A 30 THR HB A 31 GLU HBy 1.0 . 4.16 1294 1167 A 86 GLN HA A 89 LYS HD2 1.0 . 3.86 1295 1167 A 86 GLN HA A 89 LYS HD3 1.0 . 3.86 1296 1168 A 41 LYS HDy A 50 ILE HD1% 1.0 . 5.50 1297 1169 A 91 GLU H A 90 GLU HBy 1.0 . 4.96 1298 1170 A 91 GLU H A 90 GLU HBx 1.0 . 4.82 1299 1171 A 89 LYS HBx A 89 LYS HD2 1.0 . 3.17 1300 1171 A 89 LYS HD3 A 89 LYS HBx 1.0 . 3.17 1301 1172 A 72 PHE HD% A 75 LYS HDy 1.0 . 5.25 1302 1173 A 51 LYS HA A 51 LYS HDx 1.0 . 4.40 1303 1173 A 51 LYS HA A 51 LYS HDy 1.0 . 4.40 1304 1174 A 41 LYS H A 41 LYS HDx 1.0 . 4.78 1305 1175 A 50 ILE HD1% A 41 LYS HDx 1.0 . 4.92 1306 1176 A 49 ALA HA A 50 ILE HG2% 1.0 . 5.37 1307 1177 A 72 PHE H A 71 GLU HBy 1.0 . 4.98 1308 1178 A 41 LYS HDy A 41 LYS HGx 1.0 . 2.72 1309 1179 A 75 LYS HDx A 79 GLN HBx 1.0 . 3.28 1310 1180 A 61 ALA HA A 59 CYS HBy 1.0 . 4.89 1311 1180 A 59 CYS HBx A 61 ALA HA 1.0 . 4.89 1312 1181 A 93 LYS H A 93 LYS HD2 1.0 . 4.65 1313 1181 A 93 LYS H A 93 LYS HD3 1.0 . 4.65 1314 1182 A 36 VAL HA A 39 ILE HG1y 1.0 . 5.07 1315 1183 A 38 GLN HBx A 39 ILE HG1y 1.0 . 5.07 1316 1184 A 60 GLY HAy A 59 CYS HBy 1.0 . 4.64 1317 1184 A 59 CYS HBx A 60 GLY HAy 1.0 . 4.64 1318 1185 A 50 ILE HA A 50 ILE HG1y 1.0 . 4.19 1319 1186 A 43 LYS H A 43 LYS HDx 1.0 . 5.04 1320 1187 A 100 ILE HG2% A 100 ILE HG1y 1.0 . 3.35 1321 1188 A 100 ILE HG1x A 65 ILE HB 1.0 . 5.16 1322 1189 A 100 ILE HG2% A 100 ILE HG1x 1.0 . 3.22 1323 1190 A 56 SER HBy A 59 CYS HBy 1.0 . 4.52 1324 1190 A 59 CYS HBx A 56 SER HBy 1.0 . 4.52 1325 1191 A 82 GLN H A 82 GLN HBx 1.0 . 3.11 1326 1192 A 83 MET HGy A 82 GLN HBx 1.0 . 5.38 1327 1193 A 38 GLN H A 38 GLN HBx 1.0 . 3.57 1328 1194 A 40 LEU HA A 40 LEU HDx% 1.0 . 4.92 1329 1195 A 65 ILE HG2% A 40 LEU HDx% 1.0 . 2.40 1330 1196 A 104 VAL HA A 105 PRO HGy 1.0 . 4.67 1331 1197 A 104 VAL HA A 105 PRO HGx 1.0 . 4.33 1332 1198 A 76 ARG HGy A 76 ARG HA 1.0 . 4.18 1333 1199 A 76 ARG HGy A 78 VAL HG1% 1.0 . 5.50 1334 1200 A 35 ARG H A 35 ARG HGy 1.0 . 4.43 1335 1201 A 35 ARG HA A 35 ARG HGy 1.0 . 4.10 1336 1202 A 36 VAL HA A 35 ARG HGy 1.0 . 4.18 1337 1203 A 36 VAL HA A 35 ARG HGx 1.0 . 3.85 1338 1204 A 67 ILE HG1x A 84 VAL HG2% 1.0 . 3.49 1339 1205 A 67 ILE HG1x A 72 PHE HE% 1.0 . 5.34 1340 1206 A 67 ILE HG1x A 50 ILE HA 1.0 . 5.29 1341 1207 A 81 HIS HD2 A 80 GLN HBy 1.0 . 4.93 1342 1208 A 107 ARG H A 107 ARG HG2 1.0 . 4.91 1343 1208 A 107 ARG H A 107 ARG HG3 1.0 . 4.91 1344 1209 A 81 HIS HD2 A 80 GLN HBx 1.0 . 4.77 1345 1210 A 102 THR HG2% A 80 GLN HBx 1.0 . 4.65 1346 1211 A 104 VAL HA A 105 PRO HDy 1.0 . 3.21 1347 1212 A 88 LEU H A 88 LEU HG 1.0 . 4.59 1348 1213 A 34 LEU HA A 34 LEU HG 1.0 . 3.97 1349 1214 A 34 LEU HG A 29 GLN HGy 1.0 . 5.35 1350 1215 A 99 ARG HA A 99 ARG HGy 1.0 . 4.18 1351 1216 A 99 ARG H A 99 ARG HGx 1.0 . 5.01 1352 1217 A 88 LEU HD1% A 88 LEU HB2 1.0 . 3.05 1353 1217 A 88 LEU HB3 A 88 LEU HD1% 1.0 . 3.05 1354 1218 A 45 PRO HDy A 42 GLU HA 1.0 . 4.13 1355 1219 A 44 PHE HD% A 45 PRO HDy 1.0 . 5.29 1356 1220 A 101 PHE HE% A 99 ARG HGy 1.0 . 5.35 1357 1221 A 55 ILE HG1y A 62 MET HB2 1.0 . 3.87 1358 1221 A 55 ILE HG1y A 62 MET HB3 1.0 . 3.87 1359 1222 A 55 ILE HG1x A 62 MET HB2 1.0 . 4.24 1360 1222 A 62 MET HB3 A 55 ILE HG1x 1.0 . 4.24 1361 1223 A 41 LYS HGx A 50 ILE HD1% 1.0 . 4.46 1362 1224 A 73 LYS H A 73 LYS HG2 1.0 . 4.03 1363 1224 A 73 LYS HG3 A 73 LYS H 1.0 . 4.03 1364 1225 A 73 LYS HEx A 73 LYS HG2 1.0 . 3.74 1365 1225 A 73 LYS HG3 A 73 LYS HEx 1.0 . 3.74 1366 1226 A 39 ILE HG2% A 43 LYS HGy 1.0 . 5.27 1367 1227 A 43 LYS HEy A 43 LYS HGx 1.0 . 4.09 1368 1228 A 39 ILE HG2% A 43 LYS HGx 1.0 . 4.43 1369 1229 A 75 LYS HGy A 72 PHE HA 1.0 . 4.24 1370 1230 A 93 LYS HGy A 93 LYS HA 1.0 . 4.10 1371 1231 A 51 LYS HDy A 51 LYS HG2 1.0 . 2.87 1372 1231 A 51 LYS HDx A 51 LYS HG2 1.0 . 2.87 1373 1231 A 51 LYS HG3 A 51 LYS HDx 1.0 . 2.87 1374 1231 A 51 LYS HG3 A 51 LYS HDy 1.0 . 2.87 1375 1232 A 51 LYS HG3 A 52 VAL HG2% 1.0 . 5.50 1376 1232 A 51 LYS HG2 A 52 VAL HG2% 1.0 . 5.50 1377 1233 A 98 LEU HD2% A 98 LEU HBx 1.0 . 3.57 1378 1234 A 98 LEU HD2% A 65 ILE HD1% 1.0 . 3.07 1379 1235 A 63 TYR H A 98 LEU HD2% 1.0 . 3.96 1380 1236 A 98 LEU HD2% A 95 MET HGx 1.0 . 3.83 1381 1237 A 98 LEU HD2% A 65 ILE HG1y 1.0 . 4.39 1382 1238 A 89 LYS H A 89 LYS HGy 1.0 . 4.37 1383 1239 A 89 LYS HGx A 90 GLU HGx 1.0 . 5.02 1384 1240 A 53 THR HB A 64 GLU HBx 1.0 . 3.79 1385 1241 A 36 VAL HA A 88 LEU HD2% 1.0 . 4.21 1386 1242 A 88 LEU HD2% A 88 LEU HB2 1.0 . 2.93 1387 1242 A 88 LEU HB3 A 88 LEU HD2% 1.0 . 2.93 1388 1243 A 32 GLY HAx A 35 ARG HB2 1.0 . 3.75 1389 1243 A 32 GLY HAx A 35 ARG HB3 1.0 . 3.75 1390 1244 A 32 GLY HAy A 30 THR HB 1.0 . 4.41 1391 1245 A 49 ALA H A 48 THR HG2% 1.0 . 4.74 1392 1246 A 69 SER HA A 48 THR HG2% 1.0 . 4.41 1393 1247 A 83 MET H A 84 VAL HG1% 1.0 . 5.28 1394 1248 A 84 VAL HG1% A 67 ILE HB 1.0 . 4.95 1395 1249 A 67 ILE HD1% A 84 VAL HG1% 1.0 . 3.36 1396 1250 A 33 GLU HBx A 30 THR HG2% 1.0 . 4.36 1397 1251 A 36 VAL HG2% A 37 THR HB 1.0 . 5.12 1398 1252 A 36 VAL HG2% A 88 LEU HB2 1.0 . 3.28 1399 1252 A 88 LEU HB3 A 36 VAL HG2% 1.0 . 3.28 1400 1253 A 52 VAL HG1% A 63 TYR HBy 1.0 . 4.54 1401 1254 A 63 TYR HD% A 52 VAL HG1% 1.0 . 3.87 1402 1255 A 63 TYR HE% A 52 VAL HG1% 1.0 . 4.76 1403 1256 A 37 THR HB A 52 VAL HG2% 1.0 . 3.73 1404 1257 A 40 LEU HA A 84 VAL HG2% 1.0 . 5.07 1405 1258 A 84 VAL HG2% A 100 ILE HG2% 1.0 . 3.48 1406 1259 A 60 GLY HAy A 56 SER HA 1.0 . 4.47 1407 1260 A 67 ILE HG2% A 49 ALA HB% 1.0 . 4.56 1408 1261 A 77 THR HG2% A 81 HIS HE1 1.0 . 4.81 1409 1262 A 81 HIS HD2 A 77 THR HG2% 1.0 . 4.88 1410 1263 A 97 GLY HAx A 98 LEU HDx% 1.0 . 5.10 1411 1264 A 97 GLY HAx A 62 MET HGy 1.0 . 5.14 1412 1265 A 97 GLY HAx A 62 MET HB2 1.0 . 5.49 1413 1265 A 97 GLY HAx A 62 MET HB3 1.0 . 5.49 1414 1266 A 97 GLY HAy A 62 MET HGy 1.0 . 5.07 1415 1267 A 55 ILE HD1% A 53 THR HG2% 1.0 . 3.96 1416 1268 A 104 VAL HG2% A 72 PHE HBx 1.0 . 4.16 1417 1269 A 104 VAL HG2% A 104 VAL HA 1.0 . 3.57 1418 1270 A 105 PRO HDx A 104 VAL HG2% 1.0 . 3.71 1419 1271 A 99 ARG H A 98 LEU HBy 1.0 . 4.99 1420 1272 A 98 LEU HDx% A 98 LEU HBy 1.0 . 3.66 1421 1273 A 37 THR HA A 52 VAL HG2% 1.0 . 4.64 1422 1274 A 48 THR H A 48 THR HB 1.0 . 4.19 1423 1275 A 99 ARG HA A 99 ARG HDy 1.0 . 4.41 1424 1276 A 99 ARG HA A 99 ARG HDx 1.0 . 4.42 1425 1277 A 46 ARG HDx A 46 ARG HBy 1.0 . 3.86 1426 1278 A 81 HIS HBx A 100 ILE HG2% 1.0 . 5.15 1427 1279 A 84 VAL HA A 100 ILE HG2% 1.0 . 5.33 1428 1280 A 39 ILE HD1% A 35 ARG HDx 1.0 . 5.47 1429 1281 A 107 ARG H A 107 ARG HD2 1.0 . 5.26 1430 1281 A 107 ARG H A 107 ARG HD3 1.0 . 5.26 1431 1282 A 86 GLN H A 87 ALA HB% 1.0 . 5.07 1432 1283 A 88 LEU HA A 87 ALA HB% 1.0 . 5.11 1433 1284 A 39 ILE HG2% A 87 ALA HB% 1.0 . 3.84 1434 1285 A 63 TYR HBy A 65 ILE HG1y 1.0 . 4.92 1435 1286 A 63 TYR HBx A 65 ILE HD1% 1.0 . 4.26 1436 1287 A 63 TYR HBx A 65 ILE HG1y 1.0 . 5.03 1437 1288 A 47 ALA HB% A 46 ARG HBy 1.0 . 4.76 1438 1289 A 47 ALA HB% A 50 ILE HG2% 1.0 . 3.61 1439 1290 A 41 LYS H A 50 ILE HG2% 1.0 . 4.89 1440 1291 A 50 ILE HG1y A 50 ILE HG2% 1.0 . 3.30 1441 1292 A 67 ILE HD1% A 50 ILE HG2% 1.0 . 4.31 1442 1293 A 75 LYS HGy A 75 LYS HE2 1.0 . 3.30 1443 1293 A 75 LYS HGy A 75 LYS HE3 1.0 . 3.30 1444 1294 A 86 GLN HE22 A 89 LYS HE2 1.0 . 4.64 1445 1294 A 89 LYS HE3 A 86 GLN HE22 1.0 . 4.64 1446 1295 A 50 ILE H A 50 ILE HB 1.0 . 4.12 1447 1296 A 67 ILE HD1% A 67 ILE HB 1.0 . 3.80 1448 1297 A 89 LYS HD2 A 89 LYS HE2 1.0 . 2.85 1449 1297 A 89 LYS HD3 A 89 LYS HE2 1.0 . 2.85 1450 1297 A 89 LYS HE3 A 89 LYS HD2 1.0 . 2.85 1451 1297 A 89 LYS HD3 A 89 LYS HE3 1.0 . 2.85 1452 1298 A 51 LYS HE2 A 51 LYS HG2 1.0 . 3.34 1453 1298 A 51 LYS HE3 A 51 LYS HG2 1.0 . 3.34 1454 1298 A 51 LYS HG3 A 51 LYS HE2 1.0 . 3.34 1455 1298 A 51 LYS HG3 A 51 LYS HE3 1.0 . 3.34 1456 1299 A 38 GLN HE21 A 41 LYS HEx 1.0 . 5.27 1457 1299 A 41 LYS HEy A 38 GLN HE21 1.0 . 5.27 1458 1300 A 40 LEU HBy A 44 PHE HD% 1.0 . 5.10 1459 1301 A 40 LEU HBy A 52 VAL HG2% 1.0 . 3.68 1460 1302 A 64 GLU HA A 55 ILE HG2% 1.0 . 4.84 1461 1303 A 55 ILE HA A 55 ILE HG2% 1.0 . 3.38 1462 1304 A 39 ILE HG2% A 39 ILE HG1y 1.0 . 3.41 1463 1305 A 65 ILE HG2% A 100 ILE HG1y 1.0 . 4.48 1464 1306 A 65 ILE HG2% A 65 ILE HG1x 1.0 . 4.16 1465 1307 A 65 ILE HG2% A 65 ILE HD1% 1.0 . 2.40 1466 1308 A 65 ILE HG2% A 67 ILE HD1% 1.0 . 3.68 1467 1309 A 40 LEU HBy A 37 THR HB 1.0 . 5.13 1468 1310 A 34 LEU HBy A 34 LEU HDx% 1.0 . 3.78 1469 1310 A 34 LEU HD2% A 34 LEU HBy 1.0 . 3.78 1470 1311 A 34 LEU H A 34 LEU HBx 1.0 . 3.52 1471 1312 A 34 LEU HBx A 34 LEU HDx% 1.0 . 3.41 1472 1312 A 34 LEU HD2% A 34 LEU HBx 1.0 . 3.41 1473 1313 A 92 ILE HG2% A 92 ILE HG1x 1.0 . 4.13 1474 1314 A 92 ILE HG2% A 36 VAL HG1% 1.0 . 4.17 1475 1315 A 103 SER HBy A 68 GLU HGx 1.0 . 4.81 1476 1316 A 103 SER HBx A 68 GLU HGx 1.0 . 4.51 1477 1317 A 104 VAL HG1% A 103 SER HBx 1.0 . 5.43 1478 1318 A 94 GLU H A 95 MET HE% 1.0 . 5.27 1479 1319 A 95 MET HE% A 88 LEU HD2% 1.0 . 3.74 1480 1320 A 56 SER HBy A 62 MET HB2 1.0 . 3.87 1481 1320 A 56 SER HBy A 62 MET HB3 1.0 . 3.87 1482 1321 A 56 SER HBy A 61 ALA HB% 1.0 . 4.05 1483 1322 A 56 SER HBx A 62 MET HB2 1.0 . 3.49 1484 1322 A 62 MET HB3 A 56 SER HBx 1.0 . 3.49 1485 1323 A 39 ILE HA A 39 ILE HG1y 1.0 . 3.32 1486 1324 A 83 MET H A 83 MET HE% 1.0 . 5.12 1487 1325 A 44 PHE HD% A 83 MET HE% 1.0 . 3.85 1488 1326 A 44 PHE HE% A 83 MET HE% 1.0 . 3.62 1489 1327 A 83 MET HE% A 72 PHE HA 1.0 . 4.93 1490 1328 A 83 MET HE% A 80 GLN HA 1.0 . 4.37 1491 1329 A 83 MET HE% A 83 MET HGx 1.0 . 3.49 1492 1330 A 83 MET HGy A 83 MET HE% 1.0 . 3.66 1493 1331 A 83 MET HBx A 83 MET HE% 1.0 . 3.49 1494 1332 A 97 GLY HAx A 62 MET HE% 1.0 . 4.77 1495 1333 A 97 GLY HAy A 62 MET HE% 1.0 . 4.61 1496 1334 A 62 MET HE% A 62 MET HB2 1.0 . 2.89 1497 1334 A 62 MET HB3 A 62 MET HE% 1.0 . 2.89 1498 1335 A 56 SER HBx A 62 MET HE% 1.0 . 5.26 1499 1336 A 62 MET HGy A 62 MET HE% 1.0 . 3.76 1500 1337 A 64 GLU HA A 65 ILE HB 1.0 . 4.81 1501 1338 A 102 THR H A 101 PHE HBy 1.0 . 4.92 1502 1339 A 101 PHE HBy A 66 LYS HGy 1.0 . 4.54 1503 1340 A 101 PHE HBx A 66 LYS HBx 1.0 . 4.57 1504 1340 A 101 PHE HBx A 66 LYS HBy 1.0 . 4.57 1505 1341 A 100 ILE HG1y A 65 ILE HB 1.0 . 4.06 1506 1342 A 65 ILE HB A 65 ILE HD1% 1.0 . 3.40 1507 1343 A 100 ILE HG2% A 65 ILE HB 1.0 . 4.16 1508 1344 A 63 TYR HD% A 54 ASP HBx 1.0 . 5.41 1509 1345 A 67 ILE HD1% A 40 LEU HBy 1.0 . 5.26 1510 1346 A 67 ILE HD1% A 40 LEU HA 1.0 . 5.50 1511 1347 A 67 ILE HD1% A 84 VAL HG2% 1.0 . 3.11 1512 1348 A 69 SER HBx A 71 GLU HGy 1.0 . 4.83 1513 1349 A 85 ASN H A 85 ASN HBy 1.0 . 3.50 1514 1350 A 88 LEU HD1% A 85 ASN HBy 1.0 . 5.07 1515 1351 A 100 ILE HD1% A 85 ASN HBx 1.0 . 4.85 1516 1352 A 48 THR HB A 48 THR HA 1.0 . 2.40 1517 1353 A 65 ILE HA A 65 ILE HD1% 1.0 . 4.42 1518 1354 A 63 TYR HBy A 65 ILE HD1% 1.0 . 4.44 1519 1355 A 100 ILE HG1y A 65 ILE HD1% 1.0 . 3.94 1520 1356 A 100 ILE HG2% A 65 ILE HD1% 1.0 . 3.84 1521 1357 A 63 TYR HD% A 65 ILE HD1% 1.0 . 5.50 1522 1358 A 64 GLU HGy A 99 ARG HB2 1.0 . 4.63 1523 1358 A 64 GLU HGy A 99 ARG HB3 1.0 . 4.63 1524 1359 A 53 THR HB A 64 GLU HGy 1.0 . 5.06 1525 1360 A 64 GLU HGx A 55 ILE HD1% 1.0 . 5.30 1526 1361 A 39 ILE HB A 39 ILE HG1y 1.0 . 2.58 1527 1362 A 39 ILE HD1% A 39 ILE HB 1.0 . 3.36 1528 1363 A 52 VAL HG1% A 33 GLU HGx 1.0 . 4.49 1529 1364 A 39 ILE H A 39 ILE HB 1.0 . 3.46 1530 1365 A 53 THR HB A 55 ILE HD1% 1.0 . 4.09 1531 1366 A 28 THR HA A 29 GLN HBx 1.0 . 5.02 1532 1367 A 72 PHE H A 72 PHE HBy 1.0 . 3.87 1533 1368 A 71 GLU HGy A 72 PHE HBx 1.0 . 4.94 1534 1369 A 80 GLN HA A 72 PHE HBx 1.0 . 5.32 1535 1370 A 36 VAL HA A 39 ILE HD1% 1.0 . 3.78 1536 1371 A 92 ILE HB A 88 LEU HD2% 1.0 . 3.32 1537 1372 A 55 ILE HD1% A 64 GLU HA 1.0 . 4.69 1538 1373 A 55 ILE HD1% A 99 ARG HDx 1.0 . 4.58 1539 1374 A 100 ILE H A 100 ILE HD1% 1.0 . 5.07 1540 1375 A 100 ILE HD1% A 65 ILE HB 1.0 . 3.94 1541 1376 A 100 ILE HD1% A 100 ILE HB 1.0 . 2.40 1542 1377 A 44 PHE HBx A 50 ILE HG2% 1.0 . 4.53 1543 1378 A 50 ILE HA A 50 ILE HG2% 1.0 . 3.22 1544 1379 A 67 ILE HA A 50 ILE HA 1.0 . 3.60 1545 1380 A 67 ILE HD1% A 50 ILE HA 1.0 . 5.13 1546 1381 A 71 GLU HGy A 83 MET HE% 1.0 . 4.95 1547 1382 A 71 GLU HGx A 71 GLU HA 1.0 . 4.09 1548 1383 A 52 VAL HA A 52 VAL HG2% 1.0 . 3.14 1549 1384 A 101 PHE HD% A 100 ILE HA 1.0 . 5.09 1550 1385 A 100 ILE HA A 65 ILE HB 1.0 . 3.45 1551 1386 A 100 ILE HA A 100 ILE HG1y 1.0 . 3.87 1552 1387 A 73 LYS HG2 A 74 GLU HGx 1.0 . 4.24 1553 1387 A 73 LYS HG3 A 74 GLU HGx 1.0 . 4.24 1554 1387 A 74 GLU HGy A 73 LYS HG2 1.0 . 4.24 1555 1387 A 73 LYS HG3 A 74 GLU HGy 1.0 . 4.24 1556 1388 A 53 THR HA A 33 GLU HGx 1.0 . 4.28 1557 1389 A 52 VAL HG1% A 53 THR HA 1.0 . 4.59 1558 1390 A 30 THR HB A 30 THR HA 1.0 . 2.88 1559 1391 A 68 GLU HGy A 104 VAL HA 1.0 . 4.94 1560 1392 A 105 PRO HA A 68 GLU HGx 1.0 . 4.86 1561 1393 A 68 GLU HGy A 105 PRO HA 1.0 . 5.19 1562 1394 A 103 SER HA A 68 GLU HGx 1.0 . 4.89 1563 1395 A 92 ILE H A 92 ILE HD1% 1.0 . 5.27 1564 1396 A 63 TYR HD% A 92 ILE HD1% 1.0 . 5.50 1565 1397 A 63 TYR HE% A 92 ILE HD1% 1.0 . 5.50 1566 1398 A 39 ILE HG2% A 42 GLU HGy 1.0 . 5.39 1567 1399 A 70 GLU HA A 70 GLU HGy 1.0 . 3.70 1568 1400 A 69 SER HA A 70 GLU HGy 1.0 . 5.50 1569 1401 A 31 GLU HGx A 34 LEU HDx% 1.0 . 5.45 1570 1401 A 34 LEU HD2% A 31 GLU HGx 1.0 . 5.45 1571 1402 A 70 GLU HA A 70 GLU HGx 1.0 . 3.89 1572 1403 A 42 GLU H A 42 GLU HGx 1.0 . 3.99 1573 1404 A 43 LYS H A 42 GLU HGx 1.0 . 4.81 1574 1405 A 39 ILE HA A 42 GLU HGx 1.0 . 4.96 1575 1406 A 31 GLU HBx A 31 GLU HA 1.0 . 2.87 1576 1407 A 83 MET HGy A 83 MET HA 1.0 . 3.65 1577 1408 A 89 LYS HA A 91 GLU H 1.0 . 4.61 1578 1409 A 31 GLU HA A 31 GLU HGx 1.0 . 3.56 1579 1410 A 33 GLU HA A 36 VAL HB 1.0 . 3.83 1580 1411 A 33 GLU HA A 52 VAL HG1% 1.0 . 3.51 1581 1412 A 51 LYS HBx A 51 LYS HE2 1.0 . 4.95 1582 1412 A 51 LYS HBx A 51 LYS HE3 1.0 . 4.95 1583 1413 A 67 ILE HA A 67 ILE HG1y 1.0 . 3.39 1584 1414 A 35 ARG HA A 35 ARG HB2 1.0 . 2.94 1585 1414 A 35 ARG HA A 35 ARG HB3 1.0 . 2.94 1586 1415 A 29 GLN HGx A 34 LEU HD2% 1.0 . 5.00 1587 1415 A 29 GLN HGx A 34 LEU HDx% 1.0 . 5.00 1588 1416 A 91 GLU H A 91 GLU HG2 1.0 . 3.92 1589 1416 A 91 GLU H A 91 GLU HG3 1.0 . 3.92 1590 1417 A 65 ILE HG2% A 65 ILE HA 1.0 . 3.53 1591 1418 A 85 ASN H A 82 GLN HA 1.0 . 3.92 1592 1419 A 82 GLN HA A 85 ASN HD22 1.0 . 4.43 1593 1420 A 82 GLN HA A 85 ASN HBx 1.0 . 3.08 1594 1421 A 82 GLN HA A 82 GLN HGx 1.0 . 3.54 1595 1422 A 38 GLN HA A 38 GLN HBx 1.0 . 2.98 1596 1423 A 37 THR HG2% A 38 GLN HA 1.0 . 4.30 1597 1424 A 29 GLN HA A 29 GLN HGy 1.0 . 3.69 1598 1425 A 34 LEU HD2% A 29 GLN HGy 1.0 . 5.07 1599 1425 A 29 GLN HGy A 34 LEU HDx% 1.0 . 5.07 1600 1426 A 100 ILE HD1% A 81 HIS HA 1.0 . 3.95 1601 1427 A 38 GLN HA A 41 LYS HEx 1.0 . 4.58 1602 1427 A 41 LYS HEy A 38 GLN HA 1.0 . 4.58 1603 1428 A 41 LYS HA A 41 LYS HBy 1.0 . 2.71 1604 1428 A 41 LYS HA A 41 LYS HBx 1.0 . 2.71 1605 1429 A 41 LYS HA A 41 LYS HGy 1.0 . 3.22 1606 1430 A 41 LYS HA A 41 LYS HGx 1.0 . 3.36 1607 1431 A 79 GLN HGy A 79 GLN H 1.0 . 4.45 1608 1432 A 79 GLN HGy A 79 GLN HA 1.0 . 3.81 1609 1433 A 79 GLN HGy A 78 VAL HG1% 1.0 . 4.77 1610 1434 A 79 GLN HGy A 80 GLN H 1.0 . 5.19 1611 1435 A 79 GLN HGx A 80 GLN H 1.0 . 5.02 1612 1436 A 79 GLN HGx A 79 GLN HA 1.0 . 3.98 1613 1437 A 79 GLN HGx A 78 VAL HG1% 1.0 . 4.29 1614 1438 A 72 PHE HA A 75 LYS HBy 1.0 . 4.05 1615 1439 A 79 GLN HBy A 75 LYS HBx 1.0 . 3.87 1616 1440 A 75 LYS HDx A 75 LYS HBx 1.0 . 3.53 1617 1441 A 76 ARG H A 75 LYS HBx 1.0 . 4.75 1618 1442 A 102 THR HA A 103 SER HA 1.0 . 4.54 1619 1443 A 104 VAL HA A 72 PHE HBx 1.0 . 4.78 1620 1444 A 105 PRO HDx A 70 GLU HA 1.0 . 3.82 1621 1445 A 70 GLU HA A 70 GLU HBx 1.0 . 2.83 1622 1446 A 81 HIS HA A 84 VAL HB 1.0 . 3.37 1623 1447 A 79 GLN HGy A 75 LYS HDx 1.0 . 5.29 1624 1448 A 80 GLN HA A 80 GLN HG2 1.0 . 4.00 1625 1448 A 80 GLN HG3 A 80 GLN HA 1.0 . 4.00 1626 1449 A 42 GLU HA A 42 GLU HGy 1.0 . 3.69 1627 1450 A 42 GLU HA A 42 GLU HBx 1.0 . 2.72 1628 1451 A 34 LEU HA A 37 THR HB 1.0 . 4.74 1629 1452 A 79 GLN HA A 82 GLN HBx 1.0 . 3.02 1630 1453 A 75 LYS HDx A 79 GLN HA 1.0 . 5.30 1631 1454 A 71 GLU HGy A 71 GLU HA 1.0 . 3.60 1632 1455 A 71 GLU HA A 71 GLU HBx 1.0 . 2.89 1633 1456 A 72 PHE HE% A 83 MET HBy 1.0 . 4.32 1634 1457 A 83 MET HBy A 83 MET HE% 1.0 . 5.04 1635 1458 A 40 LEU HA A 87 ALA HB% 1.0 . 3.79 1636 1459 A 93 LYS HA A 93 LYS HE2 1.0 . 4.82 1637 1459 A 93 LYS HA A 93 LYS HE3 1.0 . 4.82 1638 1460 A 93 LYS HA A 93 LYS HBx 1.0 . 2.84 1639 1461 A 75 LYS HDy A 80 GLN HG2 1.0 . 4.57 1640 1461 A 80 GLN HG3 A 75 LYS HDy 1.0 . 4.57 1641 1462 A 90 GLU HGx A 90 GLU HA 1.0 . 3.40 1642 1463 A 89 LYS HGx A 90 GLU HA 1.0 . 4.09 1643 1464 A 83 MET HA A 82 GLN HGx 1.0 . 3.60 1644 1465 A 80 GLN HBy A 80 GLN HG2 1.0 . 2.76 1645 1465 A 80 GLN HG3 A 80 GLN HBy 1.0 . 2.76 1646 1466 A 83 MET H A 82 GLN HGx 1.0 . 3.63 1647 1467 A 104 VAL H A 103 SER HA 1.0 . 2.86 1648 1468 A 103 SER HBx A 103 SER HA 1.0 . 2.90 1649 1469 A 68 GLU HBx A 49 ALA HB% 1.0 . 4.64 1650 1470 A 91 GLU HA A 91 GLU HBx 1.0 . 2.87 1651 1470 A 91 GLU HA A 91 GLU HBy 1.0 . 2.87 1652 1471 A 88 LEU H A 85 ASN HA 1.0 . 4.92 1653 1472 A 85 ASN HA A 85 ASN HBx 1.0 . 3.01 1654 1473 A 85 ASN HA A 88 LEU HD1% 1.0 . 3.69 1655 1474 A 53 THR H A 64 GLU HBy 1.0 . 4.99 1656 1475 A 101 PHE HE% A 64 GLU HBx 1.0 . 5.03 1657 1476 A 73 LYS HEx A 73 LYS HB2 1.0 . 4.63 1658 1476 A 73 LYS HB3 A 73 LYS HEx 1.0 . 4.63 1659 1477 A 64 GLU HBx A 55 ILE HD1% 1.0 . 3.78 1660 1478 A 44 PHE HD% A 43 LYS HBy 1.0 . 4.77 1661 1479 A 43 LYS HBy A 87 ALA HB% 1.0 . 2.95 1662 1480 A 43 LYS HBx A 43 LYS HDy 1.0 . 2.86 1663 1481 A 94 GLU H A 93 LYS HBx 1.0 . 4.08 1664 1482 A 106 LYS HA A 106 LYS HGx 1.0 . 3.76 1665 1483 A 50 ILE HD1% A 41 LYS HBy 1.0 . 4.46 1666 1483 A 50 ILE HD1% A 41 LYS HBx 1.0 . 4.46 1667 1484 A 44 PHE HA A 47 ALA HB% 1.0 . 4.97 1668 1485 A 95 MET HA A 95 MET HBx 1.0 . 2.96 1669 1485 A 95 MET HA A 95 MET HBy 1.0 . 2.96 1670 1486 A 98 LEU HG A 95 MET HA 1.0 . 4.48 1671 1487 A 43 LYS HA A 42 GLU HBx 1.0 . 4.50 1672 1488 A 43 LYS HA A 43 LYS HGy 1.0 . 3.53 1673 1489 A 95 MET HGy A 98 LEU HDx% 1.0 . 5.36 1674 1490 A 98 LEU HDx% A 95 MET HGx 1.0 . 5.35 1675 1491 A 41 LYS H A 41 LYS HBy 1.0 . 3.26 1676 1491 A 41 LYS H A 41 LYS HBx 1.0 . 3.26 1677 1492 A 42 GLU H A 41 LYS HBy 1.0 . 3.66 1678 1492 A 42 GLU H A 41 LYS HBx 1.0 . 3.66 1679 1493 A 29 GLN HA A 29 GLN HGx 1.0 . 3.28 1680 1494 A 83 MET H A 83 MET HGx 1.0 . 3.89 1681 1495 A 44 PHE HZ A 83 MET HGx 1.0 . 5.23 1682 1496 A 84 VAL H A 83 MET HGx 1.0 . 4.88 1683 1497 A 29 GLN HBx A 34 LEU HDx% 1.0 . 4.08 1684 1497 A 34 LEU HD2% A 29 GLN HBx 1.0 . 4.08 1685 1498 A 51 LYS HBx A 51 LYS HA 1.0 . 2.99 1686 1499 A 51 LYS HA A 51 LYS HG2 1.0 . 3.55 1687 1499 A 51 LYS HG3 A 51 LYS HA 1.0 . 3.55 1688 1500 A 51 LYS HA A 52 VAL HG2% 1.0 . 4.55 1689 1501 A 76 ARG HA A 80 GLN HG2 1.0 . 5.23 1690 1501 A 80 GLN HG3 A 76 ARG HA 1.0 . 5.23 1691 1502 A 65 ILE H A 99 ARG HB2 1.0 . 4.69 1692 1502 A 65 ILE H A 99 ARG HB3 1.0 . 4.69 1693 1503 A 99 ARG HDx A 99 ARG HB2 1.0 . 3.78 1694 1503 A 99 ARG HB3 A 99 ARG HDx 1.0 . 3.78 1695 1504 A 64 GLU HBx A 99 ARG HB2 1.0 . 4.27 1696 1504 A 64 GLU HBx A 99 ARG HB3 1.0 . 4.27 1697 1505 A 76 ARG HA A 76 ARG HD2 1.0 . 3.73 1698 1505 A 76 ARG HA A 76 ARG HD3 1.0 . 3.73 1699 1506 A 46 ARG HA A 46 ARG HDx 1.0 . 4.09 1700 1507 A 92 ILE HD1% A 91 GLU HBx 1.0 . 4.04 1701 1507 A 92 ILE HD1% A 91 GLU HBy 1.0 . 4.04 1702 1508 A 92 ILE H A 91 GLU HBx 1.0 . 4.15 1703 1508 A 92 ILE H A 91 GLU HBy 1.0 . 4.15 1704 1509 A 91 GLU H A 91 GLU HBx 1.0 . 3.58 1705 1509 A 91 GLU H A 91 GLU HBy 1.0 . 3.58 1706 1510 A 78 VAL HG1% A 76 ARG HBx 1.0 . 5.14 1707 1511 A 64 GLU HA A 99 ARG HB2 1.0 . 3.28 1708 1511 A 64 GLU HA A 99 ARG HB3 1.0 . 3.28 1709 1512 A 62 MET HA A 98 LEU HDx% 1.0 . 5.13 1710 1513 A 66 LYS HA A 66 LYS HGy 1.0 . 3.96 1711 1514 A 66 LYS HA A 66 LYS HGx 1.0 . 3.84 1712 1515 A 56 SER H A 54 ASP HA 1.0 . 3.97 1713 1516 A 78 VAL HA A 81 HIS HBy 1.0 . 3.45 1714 1517 A 81 HIS HBy A 80 GLN HBy 1.0 . 5.05 1715 1518 A 81 HIS HBx A 85 ASN HD21 1.0 . 5.10 1716 1519 A 88 LEU HA A 88 LEU HB2 1.0 . 2.98 1717 1519 A 88 LEU HB3 A 88 LEU HA 1.0 . 2.98 1718 1520 A 39 ILE HD1% A 88 LEU HA 1.0 . 3.07 1719 1521 A 87 ALA HA A 43 LYS HGy 1.0 . 3.31 1720 1522 A 87 ALA HA A 43 LYS HEy 1.0 . 4.75 1721 1523 A 54 ASP H A 52 VAL HG1% 1.0 . 5.50 1722 1524 A 70 GLU H A 47 ALA HB% 1.0 . 5.50 1723 1525 A 70 GLU H A 71 GLU HA 1.0 . 5.50 1724 1526 A 70 GLU H A 69 SER HBy 1.0 . 4.44 1725 1527 A 70 GLU H A 69 SER HBx 1.0 . 5.09 1726 1528 A 70 GLU H A 70 GLU HBx 1.0 . 3.40 1727 1529 A 51 LYS H A 66 LYS HA 1.0 . 5.50 1728 1530 A 51 LYS H A 51 LYS HE2 1.0 . 5.50 1729 1530 A 51 LYS H A 51 LYS HE3 1.0 . 5.50 1730 1531 A 51 LYS H A 50 ILE HG2% 1.0 . 3.87 1731 1532 A 72 PHE HE% A 68 GLU H 1.0 . 5.50 1732 1533 A 68 GLU H A 69 SER HA 1.0 . 5.50 1733 1534 A 68 GLU H A 50 ILE HA 1.0 . 4.56 1734 1535 A 68 GLU H A 69 SER HBy 1.0 . 5.50 1735 1536 A 69 SER HBx A 68 GLU H 1.0 . 5.50 1736 1537 A 68 GLU H A 68 GLU HBy 1.0 . 3.74 1737 1538 A 68 GLU H A 68 GLU HBx 1.0 . 3.85 1738 1539 A 68 GLU H A 67 ILE HB 1.0 . 3.85 1739 1540 A 67 ILE H A 68 GLU H 1.0 . 5.19 1740 1541 A 68 GLU H A 102 THR HA 1.0 . 5.23 1741 1542 A 51 LYS H A 67 ILE HD1% 1.0 . 5.50 1742 1543 A 65 ILE H A 65 ILE HG1y 1.0 . 4.65 1743 1544 A 65 ILE H A 65 ILE HG2% 1.0 . 4.62 1744 1545 A 52 VAL H A 52 VAL HB 1.0 . 3.29 1745 1546 A 52 VAL H A 51 LYS HG2 1.0 . 3.95 1746 1546 A 52 VAL H A 51 LYS HG3 1.0 . 3.95 1747 1547 A 52 VAL H A 37 THR HG2% 1.0 . 5.50 1748 1548 A 52 VAL H A 52 VAL HG2% 1.0 . 3.76 1749 1549 A 107 ARG H A 105 PRO HBx 1.0 . 5.24 1750 1550 A 106 LYS H A 107 ARG H 1.0 . 4.04 1751 1551 A 107 ARG H A 107 ARG HBx 1.0 . 3.57 1752 1552 A 66 LYS H A 67 ILE H 1.0 . 5.17 1753 1553 A 66 LYS H A 52 VAL HA 1.0 . 3.99 1754 1554 A 66 LYS H A 66 LYS HBx 1.0 . 3.45 1755 1555 A 66 LYS H A 66 LYS HGy 1.0 . 4.57 1756 1556 A 66 LYS H A 66 LYS HGx 1.0 . 5.49 1757 1557 A 101 PHE H A 66 LYS HGx 1.0 . 4.97 1758 1558 A 101 PHE H A 67 ILE HG1x 1.0 . 5.50 1759 1559 A 65 ILE HG2% A 101 PHE H 1.0 . 4.67 1760 1560 A 99 ARG H A 99 ARG HGy 1.0 . 5.13 1761 1561 A 100 ILE H A 99 ARG HGx 1.0 . 4.88 1762 1562 A 99 ARG H A 99 ARG HDx 1.0 . 5.50 1763 1563 A 99 ARG H A 100 ILE HG1y 1.0 . 5.15 1764 1564 A 99 ARG H A 98 LEU HDx% 1.0 . 4.55 1765 1565 A 100 ILE H A 99 ARG HA 1.0 . 2.76 1766 1566 A 100 ILE H A 99 ARG HB2 1.0 . 4.01 1767 1566 A 100 ILE H A 99 ARG HB3 1.0 . 4.01 1768 1567 A 100 ILE H A 99 ARG HGy 1.0 . 4.71 1769 1568 A 100 ILE H A 100 ILE HB 1.0 . 3.12 1770 1569 A 47 ALA H A 46 ARG H 1.0 . 3.09 1771 1570 A 47 ALA H A 44 PHE HA 1.0 . 5.35 1772 1571 A 47 ALA H A 69 SER HA 1.0 . 5.27 1773 1572 A 47 ALA H A 69 SER HBy 1.0 . 5.47 1774 1573 A 47 ALA H A 44 PHE HBx 1.0 . 4.61 1775 1574 A 47 ALA H A 46 ARG HBy 1.0 . 4.87 1776 1575 A 47 ALA H A 48 THR HG2% 1.0 . 5.50 1777 1576 A 47 ALA H A 50 ILE HG2% 1.0 . 5.11 1778 1577 A 47 ALA H A 67 ILE HG2% 1.0 . 5.50 1779 1578 A 54 ASP H A 55 ILE H 1.0 . 5.14 1780 1579 A 54 ASP HBx A 55 ILE H 1.0 . 4.71 1781 1580 A 55 ILE H A 53 THR HG2% 1.0 . 5.50 1782 1581 A 55 ILE H A 56 SER H 1.0 . 3.29 1783 1582 A 55 ILE H A 63 TYR HA 1.0 . 3.58 1784 1583 A 55 ILE H A 54 ASP HA 1.0 . 2.96 1785 1584 A 55 ILE H A 56 SER HBx 1.0 . 5.36 1786 1585 A 54 ASP HBy A 55 ILE H 1.0 . 4.86 1787 1586 A 55 ILE H A 55 ILE HG1y 1.0 . 3.71 1788 1587 A 30 THR H A 29 GLN H 1.0 . 5.34 1789 1588 A 29 GLN H A 28 THR HB 1.0 . 4.80 1790 1589 A 29 GLN HGx A 29 GLN H 1.0 . 5.40 1791 1590 A 29 GLN H A 29 GLN HBx 1.0 . 3.83 1792 1591 A 55 ILE H A 62 MET HB2 1.0 . 4.53 1793 1591 A 55 ILE H A 62 MET HB3 1.0 . 4.53 1794 1592 A 106 LYS H A 105 PRO HBx 1.0 . 4.12 1795 1593 A 106 LYS H A 106 LYS HGy 1.0 . 4.25 1796 1594 A 76 ARG H A 75 LYS H 1.0 . 5.43 1797 1595 A 93 LYS H A 92 ILE HA 1.0 . 3.07 1798 1596 A 93 LYS H A 93 LYS HBx 1.0 . 3.41 1799 1597 A 93 LYS H A 93 LYS HGx 1.0 . 4.08 1800 1598 A 76 ARG H A 75 LYS HE2 1.0 . 5.50 1801 1598 A 76 ARG H A 75 LYS HE3 1.0 . 5.50 1802 1599 A 76 ARG H A 79 GLN HBy 1.0 . 3.98 1803 1600 A 76 ARG H A 76 ARG HBy 1.0 . 3.97 1804 1601 A 76 ARG H A 76 ARG HGx 1.0 . 3.61 1805 1602 A 76 ARG H A 76 ARG HBx 1.0 . 3.25 1806 1603 A 76 ARG H A 78 VAL HG1% 1.0 . 5.50 1807 1604 A 76 ARG H A 79 GLN HE21 1.0 . 5.38 1808 1605 A 49 ALA H A 69 SER HA 1.0 . 5.38 1809 1606 A 48 THR H A 49 ALA H 1.0 . 2.95 1810 1607 A 47 ALA HA A 49 ALA H 1.0 . 3.88 1811 1608 A 49 ALA H A 69 SER HBy 1.0 . 5.19 1812 1609 A 49 ALA H A 68 GLU HBy 1.0 . 3.79 1813 1610 A 49 ALA H A 68 GLU HBx 1.0 . 4.47 1814 1611 A 49 ALA H A 50 ILE HG1y 1.0 . 5.03 1815 1612 A 49 ALA H A 50 ILE HG2% 1.0 . 5.14 1816 1613 A 49 ALA H A 67 ILE HG2% 1.0 . 5.50 1817 1614 A 64 GLU H A 99 ARG H 1.0 . 5.50 1818 1615 A 64 GLU H A 63 TYR HA 1.0 . 2.98 1819 1616 A 64 GLU H A 63 TYR HBx 1.0 . 4.42 1820 1617 A 64 GLU H A 99 ARG HB2 1.0 . 5.33 1821 1617 A 64 GLU H A 99 ARG HB3 1.0 . 5.33 1822 1618 A 49 ALA H A 67 ILE HA 1.0 . 5.50 1823 1619 A 53 THR H A 52 VAL H 1.0 . 5.14 1824 1620 A 53 THR H A 63 TYR HA 1.0 . 4.87 1825 1621 A 53 THR H A 65 ILE HG1y 1.0 . 5.50 1826 1622 A 53 THR H A 52 VAL HG1% 1.0 . 3.94 1827 1623 A 53 THR H A 64 GLU HGx 1.0 . 5.50 1828 1624 A 67 ILE H A 72 PHE HE% 1.0 . 5.33 1829 1625 A 33 GLU H A 34 LEU H 1.0 . 3.29 1830 1626 A 34 LEU H A 33 GLU HGy 1.0 . 5.18 1831 1627 A 33 GLU HBy A 34 LEU H 1.0 . 3.56 1832 1628 A 34 LEU H A 33 GLU HBx 1.0 . 3.74 1833 1629 A 34 LEU H A 34 LEU HG 1.0 . 3.14 1834 1630 A 34 LEU H A 34 LEU HD2% 1.0 . 4.06 1835 1631 A 67 ILE H A 68 GLU HA 1.0 . 5.05 1836 1632 A 67 ILE H A 102 THR HA 1.0 . 3.64 1837 1633 A 67 ILE H A 101 PHE HBy 1.0 . 4.88 1838 1634 A 67 ILE H A 67 ILE HB 1.0 . 3.71 1839 1635 A 67 ILE H A 66 LYS HGx 1.0 . 5.41 1840 1636 A 67 ILE H A 67 ILE HG2% 1.0 . 3.89 1841 1637 A 50 ILE H A 49 ALA H 1.0 . 4.50 1842 1638 A 50 ILE H A 49 ALA HA 1.0 . 2.69 1843 1639 A 50 ILE H A 50 ILE HG2% 1.0 . 4.32 1844 1640 A 35 ARG H A 32 GLY HAy 1.0 . 4.96 1845 1641 A 35 ARG H A 35 ARG HDx 1.0 . 5.11 1846 1642 A 35 ARG H A 35 ARG HB2 1.0 . 2.80 1847 1642 A 35 ARG H A 35 ARG HB3 1.0 . 2.80 1848 1643 A 35 ARG H A 34 LEU HBy 1.0 . 3.51 1849 1644 A 35 ARG H A 35 ARG HGx 1.0 . 4.64 1850 1645 A 35 ARG H A 34 LEU HD2% 1.0 . 4.94 1851 1646 A 50 ILE H A 47 ALA HB% 1.0 . 5.50 1852 1647 A 61 ALA H A 62 MET HGx 1.0 . 5.50 1853 1648 A 84 VAL H A 44 PHE HZ 1.0 . 5.01 1854 1649 A 33 GLU H A 31 GLU H 1.0 . 4.91 1855 1650 A 33 GLU H A 30 THR HB 1.0 . 3.58 1856 1651 A 33 GLU H A 34 LEU HBy 1.0 . 5.48 1857 1652 A 33 GLU H A 34 LEU HG 1.0 . 4.95 1858 1653 A 95 MET H A 94 GLU H 1.0 . 4.78 1859 1654 A 95 MET H A 92 ILE HG2% 1.0 . 5.50 1860 1655 A 61 ALA H A 60 GLY H 1.0 . 3.47 1861 1656 A 61 ALA H A 62 MET H 1.0 . 3.15 1862 1657 A 61 ALA H A 62 MET HA 1.0 . 5.17 1863 1658 A 61 ALA H A 59 CYS HA 1.0 . 4.93 1864 1659 A 61 ALA H A 56 SER HBx 1.0 . 4.24 1865 1660 A 61 ALA H A 59 CYS HBy 1.0 . 4.17 1866 1661 A 61 ALA H A 62 MET HB2 1.0 . 5.50 1867 1661 A 61 ALA H A 62 MET HB3 1.0 . 5.50 1868 1662 A 81 HIS HBx A 84 VAL H 1.0 . 5.50 1869 1663 A 84 VAL H A 83 MET HBx 1.0 . 4.19 1870 1664 A 84 VAL H A 84 VAL HB 1.0 . 3.01 1871 1665 A 33 GLU H A 30 THR HG2% 1.0 . 5.13 1872 1666 A 33 GLU HBy A 33 GLU H 1.0 . 3.24 1873 1667 A 33 GLU H A 33 GLU HBx 1.0 . 3.51 1874 1668 A 33 GLU H A 52 VAL HG1% 1.0 . 5.31 1875 1669 A 71 GLU H A 73 LYS H 1.0 . 5.45 1876 1670 A 74 GLU H A 73 LYS H 1.0 . 4.59 1877 1671 A 73 LYS H A 72 PHE HBy 1.0 . 4.86 1878 1672 A 73 LYS H A 72 PHE HBx 1.0 . 4.41 1879 1673 A 87 ALA H A 86 GLN HBx 1.0 . 3.50 1880 1674 A 38 GLN H A 37 THR HA 1.0 . 3.47 1881 1675 A 38 GLN H A 38 GLN HBy 1.0 . 3.09 1882 1676 A 80 GLN H A 75 LYS HBx 1.0 . 4.33 1883 1677 A 80 GLN H A 77 THR HG2% 1.0 . 5.21 1884 1678 A 88 LEU H A 89 LYS H 1.0 . 3.30 1885 1679 A 89 LYS H A 89 LYS HBy 1.0 . 3.16 1886 1680 A 89 LYS H A 88 LEU HB2 1.0 . 3.96 1887 1680 A 89 LYS H A 88 LEU HB3 1.0 . 3.96 1888 1681 A 89 LYS H A 88 LEU HD2% 1.0 . 5.07 1889 1682 A 89 LYS H A 90 GLU HA 1.0 . 5.37 1890 1683 A 38 GLN H A 36 VAL HG1% 1.0 . 5.50 1891 1684 A 82 GLN H A 85 ASN HD22 1.0 . 5.14 1892 1685 A 79 GLN H A 80 GLN H 1.0 . 3.03 1893 1686 A 82 GLN H A 81 HIS HBy 1.0 . 3.56 1894 1687 A 80 GLN H A 80 GLN HG2 1.0 . 3.09 1895 1687 A 80 GLN H A 80 GLN HG3 1.0 . 3.09 1896 1688 A 80 GLN H A 80 GLN HBy 1.0 . 2.98 1897 1689 A 80 GLN H A 80 GLN HBx 1.0 . 3.91 1898 1690 A 80 GLN H A 78 VAL HG1% 1.0 . 5.08 1899 1691 A 40 LEU H A 39 ILE H 1.0 . 3.31 1900 1692 A 39 ILE H A 39 ILE HG1y 1.0 . 2.93 1901 1693 A 35 ARG HA A 39 ILE H 1.0 . 4.91 1902 1694 A 39 ILE H A 40 LEU HG 1.0 . 4.52 1903 1695 A 39 ILE H A 35 ARG HGx 1.0 . 4.84 1904 1696 A 37 THR HA A 39 ILE H 1.0 . 5.50 1905 1697 A 71 GLU H A 69 SER HA 1.0 . 4.38 1906 1698 A 71 GLU H A 71 GLU HGy 1.0 . 4.52 1907 1699 A 71 GLU H A 71 GLU HGx 1.0 . 3.87 1908 1700 A 41 LYS H A 37 THR HA 1.0 . 5.50 1909 1701 A 41 LYS H A 39 ILE H 1.0 . 4.55 1910 1702 A 41 LYS H A 41 LYS HDy 1.0 . 4.72 1911 1703 A 63 TYR H A 97 GLY HAy 1.0 . 5.46 1912 1704 A 63 TYR H A 98 LEU HDx% 1.0 . 4.35 1913 1705 A 63 TYR H A 55 ILE HG1x 1.0 . 5.50 1914 1706 A 76 ARG H A 79 GLN H 1.0 . 4.69 1915 1707 A 79 GLN H A 75 LYS HA 1.0 . 5.50 1916 1708 A 79 GLN H A 80 GLN HA 1.0 . 5.50 1917 1709 A 79 GLN H A 77 THR HB 1.0 . 5.29 1918 1710 A 79 GLN HGx A 79 GLN H 1.0 . 3.69 1919 1711 A 79 GLN H A 79 GLN HBx 1.0 . 3.80 1920 1712 A 79 GLN H A 78 VAL HB 1.0 . 4.01 1921 1713 A 79 GLN H A 76 ARG HGy 1.0 . 5.50 1922 1714 A 79 GLN H A 76 ARG HBx 1.0 . 3.70 1923 1715 A 79 GLN H A 77 THR HG2% 1.0 . 5.50 1924 1716 A 41 LYS H A 40 LEU HDx% 1.0 . 5.27 1925 1717 A 63 TYR H A 98 LEU HBy 1.0 . 5.50 1926 1718 A 63 TYR H A 62 MET HB2 1.0 . 3.87 1927 1718 A 63 TYR H A 62 MET HB3 1.0 . 3.87 1928 1719 A 63 TYR HE% A 63 TYR H 1.0 . 5.50 1929 1720 A 56 SER H A 58 GLY H 1.0 . 5.31 1930 1721 A 62 MET H A 56 SER H 1.0 . 5.14 1931 1722 A 56 SER H A 55 ILE HB 1.0 . 5.20 1932 1723 A 54 ASP HBy A 56 SER H 1.0 . 5.50 1933 1724 A 104 VAL H A 103 SER HBy 1.0 . 3.07 1934 1725 A 36 VAL H A 34 LEU HBy 1.0 . 4.87 1935 1726 A 36 VAL H A 35 ARG HB2 1.0 . 3.25 1936 1726 A 36 VAL H A 35 ARG HB3 1.0 . 3.25 1937 1727 A 36 VAL H A 36 VAL HB 1.0 . 2.99 1938 1728 A 83 MET H A 83 MET HBx 1.0 . 4.01 1939 1729 A 92 ILE H A 91 GLU H 1.0 . 3.08 1940 1730 A 92 ILE H A 89 LYS H 1.0 . 5.10 1941 1731 A 92 ILE HB A 92 ILE H 1.0 . 2.91 1942 1732 A 92 ILE H A 92 ILE HG1x 1.0 . 3.84 1943 1733 A 92 ILE H A 92 ILE HG2% 1.0 . 3.98 1944 1734 A 92 ILE H A 88 LEU HD2% 1.0 . 4.40 1945 1735 A 98 LEU H A 96 HIS HA 1.0 . 4.46 1946 1736 A 98 LEU H A 97 GLY HAx 1.0 . 3.21 1947 1737 A 97 GLY HAy A 98 LEU H 1.0 . 3.45 1948 1738 A 98 LEU H A 98 LEU HBy 1.0 . 3.46 1949 1739 A 98 LEU H A 98 LEU HBx 1.0 . 4.02 1950 1740 A 98 LEU H A 98 LEU HDx% 1.0 . 4.45 1951 1741 A 56 SER H A 57 GLY H 1.0 . 4.71 1952 1742 A 56 SER H A 57 GLY HAy 1.0 . 5.50 1953 1743 A 54 ASP HBx A 56 SER H 1.0 . 5.50 1954 1744 A 56 SER H A 62 MET HB2 1.0 . 5.04 1955 1744 A 56 SER H A 62 MET HB3 1.0 . 5.04 1956 1745 A 86 GLN HBx A 85 ASN H 1.0 . 5.50 1957 1746 A 44 PHE H A 45 PRO HDx 1.0 . 3.72 1958 1747 A 36 VAL H A 91 GLU HG2 1.0 . 5.50 1959 1747 A 36 VAL H A 91 GLU HG3 1.0 . 5.50 1960 1748 A 83 MET H A 44 PHE HZ 1.0 . 5.50 1961 1749 A 40 LEU H A 39 ILE HB 1.0 . 3.32 1962 1750 A 40 LEU H A 40 LEU HBx 1.0 . 3.72 1963 1751 A 92 ILE H A 91 GLU HBx 1.0 . 3.12 1964 1752 A 91 GLU H A 90 GLU HGx 1.0 . 5.14 1965 1753 A 91 GLU H A 88 LEU HD2% 1.0 . 4.78 1966 1754 A 85 ASN H A 85 ASN HBx 1.0 . 3.11 1967 1754 A 85 ASN H A 85 ASN HBy 1.0 . 3.11 1968 1755 A 85 ASN H A 84 VAL HB 1.0 . 3.26 1969 1756 A 85 ASN H A 85 ASN HD21 1.0 . 5.06 1970 1757 A 44 PHE H A 43 LYS H 1.0 . 3.13 1971 1758 A 44 PHE H A 44 PHE HBx 1.0 . 3.52 1972 1759 A 93 LYS H A 94 GLU H 1.0 . 3.48 1973 1760 A 94 GLU H A 94 GLU HGx 1.0 . 3.94 1974 1761 A 94 GLU H A 94 GLU HBx 1.0 . 3.13 1975 1762 A 94 GLU H A 93 LYS HGx 1.0 . 5.45 1976 1763 A 74 GLU H A 75 LYS H 1.0 . 3.72 1977 1764 A 75 LYS H A 74 GLU HA 1.0 . 3.51 1978 1765 A 75 LYS H A 75 LYS HBy 1.0 . 3.44 1979 1766 A 75 LYS H A 75 LYS HBx 1.0 . 3.80 1980 1767 A 86 GLN H A 89 LYS H 1.0 . 5.49 1981 1768 A 86 GLN H A 85 ASN HBx 1.0 . 3.47 1982 1768 A 86 GLN H A 85 ASN HBy 1.0 . 3.47 1983 1769 A 86 GLN H A 86 GLN HBy 1.0 . 3.12 1984 1770 A 43 LYS H A 44 PHE HA 1.0 . 5.50 1985 1771 A 43 LYS H A 39 ILE HA 1.0 . 5.08 1986 1772 A 43 LYS H A 42 GLU HGy 1.0 . 5.50 1987 1773 A 43 LYS H A 43 LYS HBy 1.0 . 3.22 1988 1774 A 44 PHE HA A 46 ARG H 1.0 . 4.59 1989 1775 A 45 PRO HDx A 46 ARG H 1.0 . 4.40 1990 1776 A 46 ARG H A 46 ARG HBy 1.0 . 3.86 1991 1777 A 46 ARG H A 46 ARG HGx 1.0 . 3.79 1992 1778 A 81 HIS H A 80 GLN H 1.0 . 3.10 1993 1779 A 81 HIS H A 80 GLN HG2 1.0 . 4.82 1994 1779 A 81 HIS H A 80 GLN HG3 1.0 . 4.82 1995 1780 A 81 HIS H A 80 GLN HBy 1.0 . 3.31 1996 1781 A 81 HIS H A 80 GLN HBx 1.0 . 4.00 1997 1782 A 43 LYS H A 45 PRO HDx 1.0 . 5.27 1998 1783 A 43 LYS H A 43 LYS HGy 1.0 . 3.52 1999 1784 A 43 LYS H A 43 LYS HBx 1.0 . 3.62 2000 1785 A 42 GLU H A 41 LYS HBy 1.0 . 3.39 2001 1786 A 42 GLU H A 41 LYS HGy 1.0 . 4.64 2002 1787 A 42 GLU H A 41 LYS HGx 1.0 . 5.50 2003 1788 A 78 VAL H A 76 ARG HGy 1.0 . 5.50 2004 1789 A 78 VAL H A 77 THR HA 1.0 . 3.54 2005 1790 A 78 VAL H A 76 ARG HBx 1.0 . 4.80 2006 1791 A 78 VAL H A 77 THR HG2% 1.0 . 4.30 2007 1792 A 74 GLU H A 74 GLU HGx 1.0 . 5.50 2008 1793 A 90 GLU H A 92 ILE H 1.0 . 5.49 2009 1794 A 90 GLU H A 89 LYS HE2 1.0 . 5.50 2010 1794 A 90 GLU H A 89 LYS HE3 1.0 . 5.50 2011 1795 A 90 GLU H A 90 GLU HBy 1.0 . 3.64 2012 1796 A 90 GLU H A 90 GLU HBx 1.0 . 3.24 2013 1797 A 90 GLU H A 88 LEU HB2 1.0 . 4.86 2014 1797 A 90 GLU H A 88 LEU HB3 1.0 . 4.86 2015 1798 A 90 GLU H A 39 ILE HD1% 1.0 . 5.50 2016 1799 A 71 GLU H A 72 PHE H 1.0 . 3.72 2017 1800 A 69 SER H A 72 PHE H 1.0 . 5.26 2018 1801 A 72 PHE H A 69 SER HA 1.0 . 5.05 2019 1802 A 72 PHE H A 72 PHE HBx 1.0 . 3.61 2020 1803 A 72 PHE H A 73 LYS H 1.0 . 3.22 2021 1804 A 69 SER HBx A 72 PHE H 1.0 . 4.24 2022 1805 A 71 GLU HGx A 72 PHE H 1.0 . 4.40 2023 1806 A 102 THR H A 101 PHE HA 1.0 . 2.78 2024 1807 A 102 THR H A 80 GLN HBx 1.0 . 5.50 2025 1808 A 70 GLU H A 72 PHE H 1.0 . 5.50 2026 1809 A 70 GLU H A 69 SER H 1.0 . 5.24 2027 1810 A 69 SER H A 104 VAL HG1% 1.0 . 5.50 2028 1811 A 69 SER H A 69 SER HBy 1.0 . 3.86 2029 1812 A 69 SER H A 72 PHE HBx 1.0 . 5.07 2030 1813 A 69 SER HBx A 69 SER H 1.0 . 4.18 2031 1814 A 69 SER H A 68 GLU HBy 1.0 . 4.57 2032 1815 A 69 SER H A 68 GLU HGx 1.0 . 4.44 2033 1816 A 69 SER H A 67 ILE HG2% 1.0 . 5.50 2034 1817 A 69 SER H A 47 ALA HA 1.0 . 5.33 2035 1818 A 37 THR H A 38 GLN HE22 1.0 . 5.50 2036 1819 A 37 THR H A 38 GLN H 1.0 . 3.72 2037 1820 A 33 GLU HA A 37 THR H 1.0 . 4.52 2038 1821 A 37 THR H A 52 VAL HB 1.0 . 4.51 2039 1822 A 37 THR H A 36 VAL HB 1.0 . 3.41 2040 1823 A 37 THR H A 34 LEU HD2% 1.0 . 5.16 2041 1824 A 37 THR H A 52 VAL HG2% 1.0 . 3.97 2042 1825 A 30 THR H A 33 GLU HGy 1.0 . 5.08 2043 1826 A 33 GLU HBy A 30 THR H 1.0 . 3.59 2044 1827 A 30 THR H A 29 GLN HGx 1.0 . 4.54 2045 1828 A 30 THR H A 33 GLU HBx 1.0 . 3.97 2046 1829 A 70 GLU H A 48 THR H 1.0 . 4.76 2047 1830 A 48 THR H A 47 ALA H 1.0 . 4.86 2048 1831 A 48 THR H A 69 SER HA 1.0 . 3.58 2049 1832 A 48 THR H A 69 SER HBy 1.0 . 4.21 2050 1833 A 69 SER HBx A 48 THR H 1.0 . 5.22 2051 1834 A 48 THR H A 68 GLU HBx 1.0 . 5.36 2052 1835 A 63 TYR H A 62 MET H 1.0 . 4.50 2053 1836 A 62 MET H A 56 SER HBx 1.0 . 3.56 2054 1837 A 62 MET HGx A 62 MET H 1.0 . 5.40 2055 1838 A 62 MET H A 62 MET HB2 1.0 . 3.67 2056 1838 A 62 MET H A 62 MET HB3 1.0 . 3.67 2057 1839 A 62 MET H A 60 GLY HAx 1.0 . 5.50 2058 1840 A 62 MET H A 60 GLY HAy 1.0 . 4.99 2059 1841 A 59 CYS H A 60 GLY H 1.0 . 3.69 2060 1842 A 59 CYS H A 58 GLY H 1.0 . 3.80 2061 1843 A 59 CYS H A 59 CYS HBy 1.0 . 3.59 2062 1844 A 62 MET H A 54 ASP HA 1.0 . 5.50 2063 1845 A 97 GLY HAy A 62 MET H 1.0 . 5.50 2064 1846 A 55 ILE HG1y A 62 MET H 1.0 . 5.50 2065 1847 A 88 LEU H A 85 ASN H 1.0 . 5.50 2066 1848 A 88 LEU H A 90 GLU H 1.0 . 5.42 2067 1849 A 87 ALA H A 88 LEU H 1.0 . 3.19 2068 1850 A 88 LEU H A 88 LEU HB2 1.0 . 2.99 2069 1850 A 88 LEU H A 88 LEU HB3 1.0 . 2.99 2070 1851 A 88 LEU H A 36 VAL HG2% 1.0 . 5.50 2071 1852 A 56 SER HA A 60 GLY H 1.0 . 4.11 2072 1853 A 61 ALA HA A 60 GLY H 1.0 . 5.50 2073 1854 A 57 GLY HAx A 60 GLY H 1.0 . 5.50 2074 1855 A 56 SER HBx A 60 GLY H 1.0 . 4.97 2075 1856 A 60 GLY H A 59 CYS HBy 1.0 . 4.80 2076 1857 A 103 SER H A 102 THR HB 1.0 . 3.54 2077 1858 A 103 SER H A 67 ILE HB 1.0 . 5.50 2078 1859 A 88 LEU H A 84 VAL HA 1.0 . 5.23 2079 1860 A 103 SER H A 68 GLU HA 1.0 . 3.43 2080 1861 A 103 SER H A 103 SER HBx 1.0 . 3.97 2081 1862 A 103 SER H A 68 GLU HBx 1.0 . 5.25 2082 1863 A 103 SER H A 67 ILE HG2% 1.0 . 5.17 2083 1864 A 76 ARG H A 79 GLN HE22 1.0 . 5.50 2084 1865 A 79 GLN HE22 A 75 LYS HE2 1.0 . 5.50 2085 1865 A 75 LYS HE3 A 79 GLN HE22 1.0 . 5.50 2086 1866 A 79 GLN H A 79 GLN HE21 1.0 . 5.50 2087 1867 A 29 GLN HE21 A 29 GLN HA 1.0 . 4.25 2088 1868 A 80 GLN HBy A 80 GLN HE22 1.0 . 5.50 2089 1869 A 29 GLN HE21 A 29 GLN HGy 1.0 . 3.72 2090 1870 A 29 GLN HE21 A 34 LEU HD2% 1.0 . 5.28 2091 1871 A 86 GLN HBy A 82 GLN HE21 1.0 . 5.50 2092 1872 A 38 GLN HE22 A 34 LEU HD2% 1.0 . 5.50 2093 1873 A 85 ASN HD21 A 95 MET HBx 1.0 . 5.50 2094 1874 A 82 GLN HA A 85 ASN HD21 1.0 . 5.18 2095 1875 A 84 VAL HG1% A 85 ASN HD21 1.0 . 5.50 2096 1876 A 97 GLY H A 98 LEU HDx% 1.0 . 5.50 2097 1877 A 96 HIS H A 97 GLY H 1.0 . 4.72 2098 1878 A 62 MET HA A 97 GLY H 1.0 . 4.55 2099 1879 A 97 GLY H A 96 HIS HA 1.0 . 3.40 2100 1880 A 97 GLY H A 95 MET HA 1.0 . 4.77 2101 1881 A 97 GLY H A 96 HIS HBy 1.0 . 4.20 2102 1882 A 98 LEU HG A 97 GLY H 1.0 . 5.50 2103 1883 A 98 LEU H A 97 GLY H 1.0 . 4.50 2104 1884 A 32 GLY H A 34 LEU HG 1.0 . 5.50 2105 1885 A 31 GLU H A 32 GLY H 1.0 . 3.67 2106 1886 A 32 GLY H A 30 THR HB 1.0 . 3.75 2107 1887 A 33 GLU HA A 32 GLY H 1.0 . 5.36 2108 1888 A 32 GLY H A 31 GLU HGy 1.0 . 5.50 2109 1889 A 32 GLY H A 31 GLU HBy 1.0 . 3.71 2110 1890 A 32 GLY H A 30 THR HG2% 1.0 . 5.36 2111 1891 A 30 THR HG2% A 58 GLY H 1.0 . 5.50 2112 1892 A 58 GLY H A 60 GLY H 1.0 . 4.46 2113 1893 A 57 GLY H A 58 GLY H 1.0 . 5.21 2114 1894 A 56 SER HA A 58 GLY H 1.0 . 3.59 2115 1895 A 58 GLY H A 59 CYS HBy 1.0 . 5.11 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 28 THR C A 29 GLN N A 29 GLN CA A 29 GLN C 1.0 -158.1 -61.9 PHI 2 2 A 29 GLN N A 29 GLN CA A 29 GLN C A 30 THR N 1.0 135.9 175.9 PSI 3 3 A 29 GLN C A 30 THR N A 30 THR CA A 30 THR C 1.0 -123.3 -52.8 PHI 4 4 A 30 THR N A 30 THR CA A 30 THR C A 31 GLU N 1.0 143.4 183.4 PSI 5 5 A 30 THR C A 31 GLU N A 31 GLU CA A 31 GLU C 1.0 -80.3 -40.3 PHI 6 6 A 31 GLU N A 31 GLU CA A 31 GLU C A 32 GLY N 1.0 -54.0 -14.0 PSI 7 7 A 31 GLU C A 32 GLY N A 32 GLY CA A 32 GLY C 1.0 -84.5 -44.5 PHI 8 8 A 32 GLY N A 32 GLY CA A 32 GLY C A 33 GLU N 1.0 -59.9 -19.9 PSI 9 9 A 32 GLY C A 33 GLU N A 33 GLU CA A 33 GLU C 1.0 -84.4 -44.4 PHI 10 10 A 33 GLU N A 33 GLU CA A 33 GLU C A 34 LEU N 1.0 -61.0 -21.0 PSI 11 11 A 33 GLU C A 34 LEU N A 34 LEU CA A 34 LEU C 1.0 -84.6 -44.6 PHI 12 12 A 34 LEU N A 34 LEU CA A 34 LEU C A 35 ARG N 1.0 -62.4 -22.4 PSI 13 13 A 34 LEU C A 35 ARG N A 35 ARG CA A 35 ARG C 1.0 -83.2 -43.2 PHI 14 14 A 35 ARG N A 35 ARG CA A 35 ARG C A 36 VAL N 1.0 -62.8 -22.8 PSI 15 15 A 35 ARG C A 36 VAL N A 36 VAL CA A 36 VAL C 1.0 -81.7 -41.7 PHI 16 16 A 36 VAL N A 36 VAL CA A 36 VAL C A 37 THR N 1.0 -63.4 -23.4 PSI 17 17 A 36 VAL C A 37 THR N A 37 THR CA A 37 THR C 1.0 -83.5 -43.5 PHI 18 18 A 37 THR N A 37 THR CA A 37 THR C A 38 GLN N 1.0 -60.2 -20.2 PSI 19 19 A 37 THR C A 38 GLN N A 38 GLN CA A 38 GLN C 1.0 -79.7 -39.7 PHI 20 20 A 38 GLN N A 38 GLN CA A 38 GLN C A 39 ILE N 1.0 -64.2 -24.2 PSI 21 21 A 38 GLN C A 39 ILE N A 39 ILE CA A 39 ILE C 1.0 -85.5 -45.5 PHI 22 22 A 39 ILE N A 39 ILE CA A 39 ILE C A 40 LEU N 1.0 -61.4 -21.4 PSI 23 23 A 39 ILE C A 40 LEU N A 40 LEU CA A 40 LEU C 1.0 -82.9 -42.9 PHI 24 24 A 40 LEU N A 40 LEU CA A 40 LEU C A 41 LYS N 1.0 -58.1 -11.8 PSI 25 25 A 40 LEU C A 41 LYS N A 41 LYS CA A 41 LYS C 1.0 -82.0 -42.0 PHI 26 26 A 41 LYS N A 41 LYS CA A 41 LYS C A 42 GLU N 1.0 -60.8 -20.8 PSI 27 27 A 41 LYS C A 42 GLU N A 42 GLU CA A 42 GLU C 1.0 -87.5 -47.5 PHI 28 28 A 42 GLU N A 42 GLU CA A 42 GLU C A 43 LYS N 1.0 -56.1 -16.1 PSI 29 29 A 42 GLU C A 43 LYS N A 43 LYS CA A 43 LYS C 1.0 -103.8 -63.1 PHI 30 30 A 43 LYS N A 43 LYS CA A 43 LYS C A 44 PHE N 1.0 -54.0 11.2 PSI 31 31 A 43 LYS C A 44 PHE N A 44 PHE CA A 44 PHE C 1.0 -161.5 -56.9 PHI 32 32 A 44 PHE N A 44 PHE CA A 44 PHE C A 45 PRO N 1.0 36.5 149.3 PSI 33 33 A 45 PRO C A 46 ARG N A 46 ARG CA A 46 ARG C 1.0 -109.1 -69.1 PHI 34 34 A 46 ARG N A 46 ARG CA A 46 ARG C A 47 ALA N 1.0 -18.4 21.6 PSI 35 35 A 47 ALA C A 48 THR N A 48 THR CA A 48 THR C 1.0 -125.3 -85.3 PHI 36 36 A 48 THR N A 48 THR CA A 48 THR C A 49 ALA N 1.0 -47.2 7.1 PSI 37 37 A 48 THR C A 49 ALA N A 49 ALA CA A 49 ALA C 1.0 -180.4 -136.7 PHI 38 38 A 49 ALA N A 49 ALA CA A 49 ALA C A 50 ILE N 1.0 134.2 174.2 PSI 39 39 A 49 ALA C A 50 ILE N A 50 ILE CA A 50 ILE C 1.0 -168.4 -92.8 PHI 40 40 A 50 ILE N A 50 ILE CA A 50 ILE C A 51 LYS N 1.0 110.8 150.8 PSI 41 41 A 50 ILE C A 51 LYS N A 51 LYS CA A 51 LYS C 1.0 -164.4 -51.3 PHI 42 42 A 51 LYS N A 51 LYS CA A 51 LYS C A 52 VAL N 1.0 108.9 154.7 PSI 43 43 A 51 LYS C A 52 VAL N A 52 VAL CA A 52 VAL C 1.0 -137.1 -94.7 PHI 44 44 A 52 VAL N A 52 VAL CA A 52 VAL C A 53 THR N 1.0 105.4 145.4 PSI 45 45 A 52 VAL C A 53 THR N A 53 THR CA A 53 THR C 1.0 -165.9 -90.5 PHI 46 46 A 53 THR N A 53 THR CA A 53 THR C A 54 ASP N 1.0 89.4 166.7 PSI 47 47 A 53 THR C A 54 ASP N A 54 ASP CA A 54 ASP C 1.0 -152.7 -12.7 PHI 48 48 A 54 ASP N A 54 ASP CA A 54 ASP C A 55 ILE N 1.0 58.9 198.9 PSI 49 49 A 55 ILE C A 56 SER N A 56 SER CA A 56 SER C 1.0 -152.5 -57.9 PHI 50 50 A 56 SER N A 56 SER CA A 56 SER C A 57 GLY N 1.0 100.8 181.4 PSI 51 51 A 56 SER C A 57 GLY N A 57 GLY CA A 57 GLY C 1.0 -85.3 -26.1 PHI 52 52 A 57 GLY N A 57 GLY CA A 57 GLY C A 58 GLY N 1.0 -63.2 5.0 PSI 53 53 A 57 GLY C A 58 GLY N A 58 GLY CA A 58 GLY C 1.0 -104.8 -50.2 PHI 54 54 A 58 GLY N A 58 GLY CA A 58 GLY C A 59 CYS N 1.0 -55.7 7.7 PSI 55 55 A 58 GLY C A 59 CYS N A 59 CYS CA A 59 CYS C 1.0 -130.2 -60.1 PHI 56 56 A 59 CYS N A 59 CYS CA A 59 CYS C A 60 GLY N 1.0 -18.6 21.4 PSI 57 57 A 59 CYS C A 60 GLY N A 60 GLY CA A 60 GLY C 1.0 40.1 105.8 PHI 58 58 A 60 GLY N A 60 GLY CA A 60 GLY C A 61 ALA N 1.0 -12.1 50.2 PSI 59 59 A 60 GLY C A 61 ALA N A 61 ALA CA A 61 ALA C 1.0 -140.9 -50.5 PHI 60 60 A 61 ALA N A 61 ALA CA A 61 ALA C A 62 MET N 1.0 -87.7 38.2 PSI 61 61 A 61 ALA C A 62 MET N A 62 MET CA A 62 MET C 1.0 -182.4 -94.7 PHI 62 62 A 62 MET N A 62 MET CA A 62 MET C A 63 TYR N 1.0 104.5 190.7 PSI 63 63 A 62 MET C A 63 TYR N A 63 TYR CA A 63 TYR C 1.0 -163.0 -98.8 PHI 64 64 A 63 TYR N A 63 TYR CA A 63 TYR C A 64 GLU N 1.0 101.9 172.7 PSI 65 65 A 63 TYR C A 64 GLU N A 64 GLU CA A 64 GLU C 1.0 -158.0 -109.5 PHI 66 66 A 64 GLU N A 64 GLU CA A 64 GLU C A 65 ILE N 1.0 109.3 149.3 PSI 67 67 A 64 GLU C A 65 ILE N A 65 ILE CA A 65 ILE C 1.0 -149.8 -103.7 PHI 68 68 A 65 ILE N A 65 ILE CA A 65 ILE C A 66 LYS N 1.0 108.9 148.9 PSI 69 69 A 65 ILE C A 66 LYS N A 66 LYS CA A 66 LYS C 1.0 -146.2 -81.8 PHI 70 70 A 66 LYS N A 66 LYS CA A 66 LYS C A 67 ILE N 1.0 104.9 151.9 PSI 71 71 A 66 LYS C A 67 ILE N A 67 ILE CA A 67 ILE C 1.0 -149.7 -105.6 PHI 72 72 A 67 ILE N A 67 ILE CA A 67 ILE C A 68 GLU N 1.0 109.2 154.8 PSI 73 73 A 67 ILE C A 68 GLU N A 68 GLU CA A 68 GLU C 1.0 -148.1 -99.2 PHI 74 74 A 68 GLU N A 68 GLU CA A 68 GLU C A 69 SER N 1.0 125.3 165.3 PSI 75 75 A 68 GLU C A 69 SER N A 69 SER CA A 69 SER C 1.0 -102.8 -62.8 PHI 76 76 A 69 SER N A 69 SER CA A 69 SER C A 70 GLU N 1.0 94.6 155.1 PSI 77 77 A 69 SER C A 70 GLU N A 70 GLU CA A 70 GLU C 1.0 -77.1 -37.1 PHI 78 78 A 70 GLU N A 70 GLU CA A 70 GLU C A 71 GLU N 1.0 -54.2 -0.5 PSI 79 79 A 70 GLU C A 71 GLU N A 71 GLU CA A 71 GLU C 1.0 -91.9 -51.9 PHI 80 80 A 71 GLU N A 71 GLU CA A 71 GLU C A 72 PHE N 1.0 -48.6 5.2 PSI 81 81 A 71 GLU C A 72 PHE N A 72 PHE CA A 72 PHE C 1.0 -142.2 -54.4 PHI 82 82 A 72 PHE N A 72 PHE CA A 72 PHE C A 73 LYS N 1.0 -44.2 40.9 PSI 83 83 A 72 PHE C A 73 LYS N A 73 LYS CA A 73 LYS C 1.0 -102.3 -32.4 PHI 84 84 A 73 LYS N A 73 LYS CA A 73 LYS C A 74 GLU N 1.0 -65.0 10.8 PSI 85 85 A 74 GLU C A 75 LYS N A 75 LYS CA A 75 LYS C 1.0 -164.6 -78.3 PHI 86 86 A 75 LYS N A 75 LYS CA A 75 LYS C A 76 ARG N 1.0 104.1 182.0 PSI 87 87 A 75 LYS C A 76 ARG N A 76 ARG CA A 76 ARG C 1.0 -106.0 -46.0 PHI 88 88 A 76 ARG N A 76 ARG CA A 76 ARG C A 77 THR N 1.0 118.7 183.2 PSI 89 89 A 76 ARG C A 77 THR N A 77 THR CA A 77 THR C 1.0 -72.9 -32.9 PHI 90 90 A 77 THR N A 77 THR CA A 77 THR C A 78 VAL N 1.0 -63.4 -23.4 PSI 91 91 A 77 THR C A 78 VAL N A 78 VAL CA A 78 VAL C 1.0 -81.1 -41.1 PHI 92 92 A 78 VAL N A 78 VAL CA A 78 VAL C A 79 GLN N 1.0 -61.0 -21.0 PSI 93 93 A 78 VAL C A 79 GLN N A 79 GLN CA A 79 GLN C 1.0 -86.3 -46.3 PHI 94 94 A 79 GLN N A 79 GLN CA A 79 GLN C A 80 GLN N 1.0 -59.4 -19.4 PSI 95 95 A 79 GLN C A 80 GLN N A 80 GLN CA A 80 GLN C 1.0 -83.8 -43.8 PHI 96 96 A 80 GLN N A 80 GLN CA A 80 GLN C A 81 HIS N 1.0 -64.5 -24.5 PSI 97 97 A 80 GLN C A 81 HIS N A 81 HIS CA A 81 HIS C 1.0 -84.2 -44.2 PHI 98 98 A 81 HIS N A 81 HIS CA A 81 HIS C A 82 GLN N 1.0 -59.9 -19.9 PSI 99 99 A 81 HIS C A 82 GLN N A 82 GLN CA A 82 GLN C 1.0 -87.0 -47.0 PHI 100 100 A 82 GLN N A 82 GLN CA A 82 GLN C A 83 MET N 1.0 -59.6 -19.6 PSI 101 101 A 82 GLN C A 83 MET N A 83 MET CA A 83 MET C 1.0 -83.3 -43.3 PHI 102 102 A 83 MET N A 83 MET CA A 83 MET C A 84 VAL N 1.0 -60.3 -20.3 PSI 103 103 A 83 MET C A 84 VAL N A 84 VAL CA A 84 VAL C 1.0 -84.1 -44.1 PHI 104 104 A 84 VAL N A 84 VAL CA A 84 VAL C A 85 ASN N 1.0 -62.9 -22.9 PSI 105 105 A 84 VAL C A 85 ASN N A 85 ASN CA A 85 ASN C 1.0 -79.2 -39.2 PHI 106 106 A 85 ASN N A 85 ASN CA A 85 ASN C A 86 GLN N 1.0 -62.4 -22.4 PSI 107 107 A 85 ASN C A 86 GLN N A 86 GLN CA A 86 GLN C 1.0 -82.5 -42.5 PHI 108 108 A 86 GLN N A 86 GLN CA A 86 GLN C A 87 ALA N 1.0 -64.2 -24.2 PSI 109 109 A 86 GLN C A 87 ALA N A 87 ALA CA A 87 ALA C 1.0 -90.8 -48.3 PHI 110 110 A 87 ALA N A 87 ALA CA A 87 ALA C A 88 LEU N 1.0 -66.0 -8.7 PSI 111 111 A 87 ALA C A 88 LEU N A 88 LEU CA A 88 LEU C 1.0 -134.4 -53.2 PHI 112 112 A 88 LEU N A 88 LEU CA A 88 LEU C A 89 LYS N 1.0 -49.0 17.0 PSI 113 113 A 88 LEU C A 89 LYS N A 89 LYS CA A 89 LYS C 1.0 -80.0 -39.1 PHI 114 114 A 89 LYS N A 89 LYS CA A 89 LYS C A 90 GLU N 1.0 -61.3 -13.6 PSI 115 115 A 89 LYS C A 90 GLU N A 90 GLU CA A 90 GLU C 1.0 -89.4 -49.4 PHI 116 116 A 90 GLU N A 90 GLU CA A 90 GLU C A 91 GLU N 1.0 -59.1 16.1 PSI 117 117 A 90 GLU C A 91 GLU N A 91 GLU CA A 91 GLU C 1.0 -115.6 -56.0 PHI 118 118 A 91 GLU N A 91 GLU CA A 91 GLU C A 92 ILE N 1.0 -58.9 28.3 PSI 119 119 A 92 ILE C A 93 LYS N A 93 LYS CA A 93 LYS C 1.0 -87.1 -46.2 PHI 120 120 A 93 LYS N A 93 LYS CA A 93 LYS C A 94 GLU N 1.0 -46.2 -6.2 PSI 121 121 A 93 LYS C A 94 GLU N A 94 GLU CA A 94 GLU C 1.0 -123.5 -83.5 PHI 122 122 A 94 GLU N A 94 GLU CA A 94 GLU C A 95 MET N 1.0 -30.9 30.4 PSI 123 123 A 94 GLU C A 95 MET N A 95 MET CA A 95 MET C 1.0 -115.2 -31.3 PHI 124 124 A 95 MET N A 95 MET CA A 95 MET C A 96 HIS N 1.0 -74.9 12.6 PSI 125 125 A 95 MET C A 96 HIS N A 96 HIS CA A 96 HIS C 1.0 -111.2 -71.2 PHI 126 126 A 96 HIS N A 96 HIS CA A 96 HIS C A 97 GLY N 1.0 -18.8 21.2 PSI 127 127 A 97 GLY C A 98 LEU N A 98 LEU CA A 98 LEU C 1.0 -179.3 -39.3 PHI 128 128 A 98 LEU N A 98 LEU CA A 98 LEU C A 99 ARG N 1.0 110.0 168.1 PSI 129 129 A 98 LEU C A 99 ARG N A 99 ARG CA A 99 ARG C 1.0 -140.4 -84.0 PHI 130 130 A 99 ARG N A 99 ARG CA A 99 ARG C A 100 ILE N 1.0 102.8 147.7 PSI 131 131 A 99 ARG C A 100 ILE N A 100 ILE CA A 100 ILE C 1.0 -150.3 -79.5 PHI 132 132 A 100 ILE N A 100 ILE CA A 100 ILE C A 101 PHE N 1.0 111.7 151.7 PSI 133 133 A 100 ILE C A 101 PHE N A 101 PHE CA A 101 PHE C 1.0 -148.7 -90.5 PHI 134 134 A 101 PHE N A 101 PHE CA A 101 PHE C A 102 THR N 1.0 109.3 168.8 PSI 135 135 A 101 PHE C A 102 THR N A 102 THR CA A 102 THR C 1.0 -156.5 -70.8 PHI 136 136 A 102 THR N A 102 THR CA A 102 THR C A 103 SER N 1.0 126.3 173.3 PSI 137 137 A 102 THR C A 103 SER N A 103 SER CA A 103 SER C 1.0 -182.6 -82.3 PHI 138 138 A 103 SER N A 103 SER CA A 103 SER C A 104 VAL N 1.0 124.8 186.8 PSI 139 139 A 103 SER C A 104 VAL N A 104 VAL CA A 104 VAL C 1.0 -151.1 -63.9 PHI 140 140 A 104 VAL N A 104 VAL CA A 104 VAL C A 105 PRO N 1.0 52.9 185.7 PSI 141 141 A 105 PRO C A 106 LYS N A 106 LYS CA A 106 LYS C 1.0 -154.6 -56.2 PHI 142 142 A 106 LYS N A 106 LYS CA A 106 LYS C A 107 ARG N 1.0 79.1 172.1 PSI stop_ save_