data_nef_c15821_2k52 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 ASP middle . . 3 A 3 VAL middle . . 4 A 4 GLU middle . . 5 A 5 PRO middle . false 6 A 6 GLY middle . false 7 A 7 LYS middle . . 8 A 8 PHE middle . . 9 A 9 TYR middle . . 10 A 10 LYS middle . . 11 A 11 GLY middle . false 12 A 12 VAL middle . . 13 A 13 VAL middle . . 14 A 14 THR middle . . 15 A 15 ARG middle . . 16 A 16 ILE middle . . 17 A 17 GLU middle . . 18 A 18 LYS middle . . 19 A 19 TYR middle . . 20 A 20 GLY middle . false 21 A 21 ALA middle . . 22 A 22 PHE middle . . 23 A 23 ILE middle . . 24 A 24 ASN middle . . 25 A 25 LEU middle . . 26 A 26 ASN middle . . 27 A 27 GLU middle . . 28 A 28 GLN middle . . 29 A 29 VAL middle . . 30 A 30 ARG middle . . 31 A 31 GLY middle . false 32 A 32 LEU middle . . 33 A 33 LEU middle . . 34 A 34 ARG middle . . 35 A 35 PRO middle . false 36 A 36 ARG middle . . 37 A 37 ASP middle . . 38 A 38 MET middle . . 39 A 39 ILE middle . . 40 A 40 SER middle . . 41 A 41 LEU middle . . 42 A 42 ARG middle . . 43 A 43 LEU middle . . 44 A 44 GLU middle . . 45 A 45 ASN middle . . 46 A 46 LEU middle . . 47 A 47 ASN middle . . 48 A 48 VAL middle . . 49 A 49 GLY middle . false 50 A 50 ASP middle . . 51 A 51 GLU middle . . 52 A 52 ILE middle . . 53 A 53 ILE middle . . 54 A 54 VAL middle . . 55 A 55 GLN middle . . 56 A 56 ALA middle . . 57 A 57 ILE middle . . 58 A 58 ASP middle . . 59 A 59 VAL middle . . 60 A 60 ARG middle . . 61 A 61 PRO middle . false 62 A 62 GLU middle . . 63 A 63 LYS middle . . 64 A 64 ARG middle . . 65 A 65 GLU middle . . 66 A 66 ILE middle . . 67 A 67 ASP middle . . 68 A 68 PHE middle . . 69 A 69 LYS middle . . 70 A 70 TYR middle . . 71 A 71 ILE middle . . 72 A 72 PRO middle . false 73 A 73 LEU middle . . 74 A 74 GLU middle . . 75 A 75 HIS middle . . 76 A 76 HIS middle . . 77 A 77 HIS middle . . 78 A 78 HIS middle . . 79 A 79 HIS middle . . 80 A 80 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET HA H 1 4.091 0.03 A 1 MET HBy H 1 2.189 0.03 A 1 MET HBx H 1 2.076 0.03 A 1 MET HE% H 1 2.041 0.03 A 1 MET HGy H 1 2.524 0.03 A 1 MET HGx H 1 2.426 0.03 A 1 MET C C 13 171.382 0.3 A 1 MET CA C 13 55.325 0.3 A 1 MET CB C 13 33.398 0.3 A 1 MET CE C 13 17.319 0.3 A 1 MET CG C 13 30.889 0.3 A 2 ASP H H 1 8.938 0.03 A 2 ASP HA H 1 4.796 0.03 A 2 ASP HBy H 1 2.691 0.03 A 2 ASP HBx H 1 2.583 0.03 A 2 ASP C C 13 174.695 0.3 A 2 ASP CA C 13 53.964 0.3 A 2 ASP CB C 13 41.194 0.3 A 2 ASP N N 15 125.763 0.3 A 3 VAL H H 1 8.139 0.03 A 3 VAL HA H 1 3.957 0.03 A 3 VAL HB H 1 1.673 0.03 A 3 VAL HG1% H 1 0.381 0.03 A 3 VAL HG2% H 1 0.483 0.03 A 3 VAL C C 13 174.392 0.3 A 3 VAL CA C 13 62.100 0.3 A 3 VAL CB C 13 32.566 0.3 A 3 VAL CG1 C 13 21.373 0.3 A 3 VAL CG2 C 13 21.617 0.3 A 3 VAL N N 15 122.592 0.3 A 4 GLU H H 1 8.578 0.03 A 4 GLU HA H 1 4.896 0.03 A 4 GLU HBy H 1 2.074 0.03 A 4 GLU HBx H 1 1.837 0.03 A 4 GLU HGx H 1 2.281 0.03 A 4 GLU HGy H 1 2.282 0.03 A 4 GLU C C 13 173.392 0.3 A 4 GLU CA C 13 52.551 0.3 A 4 GLU CB C 13 31.915 0.3 A 4 GLU CG C 13 35.406 0.3 A 4 GLU N N 15 126.197 0.3 A 5 PRO HA H 1 4.033 0.03 A 5 PRO HBy H 1 2.140 0.03 A 5 PRO HBx H 1 1.976 0.03 A 5 PRO HDy H 1 3.801 0.03 A 5 PRO HDx H 1 3.797 0.03 A 5 PRO HGy H 1 2.303 0.03 A 5 PRO HGx H 1 1.804 0.03 A 5 PRO C C 13 177.132 0.3 A 5 PRO CA C 13 63.325 0.3 A 5 PRO CB C 13 31.845 0.3 A 5 PRO CD C 13 51.222 0.3 A 5 PRO CG C 13 28.233 0.3 A 6 GLY H H 1 9.294 0.03 A 6 GLY HAy H 1 4.343 0.03 A 6 GLY HAx H 1 3.517 0.03 A 6 GLY C C 13 174.356 0.3 A 6 GLY CA C 13 44.944 0.3 A 6 GLY N N 15 111.714 0.3 A 7 LYS H H 1 7.590 0.03 A 7 LYS HA H 1 4.476 0.03 A 7 LYS HBx H 1 1.637 0.03 A 7 LYS HBy H 1 2.234 0.03 A 7 LYS HDx H 1 1.668 0.03 A 7 LYS HDy H 1 1.668 0.03 A 7 LYS HEx H 1 2.976 0.03 A 7 LYS HEy H 1 2.976 0.03 A 7 LYS HGx H 1 1.242 0.03 A 7 LYS HGy H 1 1.482 0.03 A 7 LYS C C 13 174.382 0.3 A 7 LYS CA C 13 55.839 0.3 A 7 LYS CB C 13 33.343 0.3 A 7 LYS CD C 13 29.090 0.3 A 7 LYS CE C 13 42.462 0.3 A 7 LYS CG C 13 26.529 0.3 A 7 LYS N N 15 121.067 0.3 A 8 PHE H H 1 8.175 0.03 A 8 PHE HA H 1 5.250 0.03 A 8 PHE HBy H 1 2.757 0.03 A 8 PHE HBx H 1 2.546 0.03 A 8 PHE HDx H 1 7.103 0.03 A 8 PHE HDy H 1 7.103 0.03 A 8 PHE HEx H 1 7.281 0.03 A 8 PHE HEy H 1 7.281 0.03 A 8 PHE HZ H 1 7.089 0.03 A 8 PHE C C 13 175.594 0.3 A 8 PHE CA C 13 57.135 0.3 A 8 PHE CB C 13 40.951 0.3 A 8 PHE CDx C 13 131.608 0.3 A 8 PHE CDy C 13 131.608 0.3 A 8 PHE CEx C 13 131.614 0.3 A 8 PHE CEy C 13 131.614 0.3 A 8 PHE CZ C 13 129.711 0.3 A 8 PHE N N 15 117.991 0.3 A 9 TYR H H 1 9.447 0.03 A 9 TYR HA H 1 4.659 0.03 A 9 TYR HBy H 1 3.091 0.03 A 9 TYR HBx H 1 2.263 0.03 A 9 TYR HDx H 1 7.108 0.03 A 9 TYR HDy H 1 7.108 0.03 A 9 TYR HEx H 1 6.862 0.03 A 9 TYR HEy H 1 6.862 0.03 A 9 TYR C C 13 173.336 0.3 A 9 TYR CA C 13 57.652 0.3 A 9 TYR CB C 13 44.954 0.3 A 9 TYR CDx C 13 133.407 0.3 A 9 TYR CDy C 13 133.407 0.3 A 9 TYR CEx C 13 118.801 0.3 A 9 TYR CEy C 13 118.827 0.3 A 9 TYR N N 15 118.855 0.3 A 10 LYS H H 1 8.662 0.03 A 10 LYS HA H 1 4.838 0.03 A 10 LYS HBy H 1 1.868 0.03 A 10 LYS HBx H 1 1.616 0.03 A 10 LYS HDx H 1 1.656 0.03 A 10 LYS HDy H 1 1.659 0.03 A 10 LYS HEx H 1 2.923 0.03 A 10 LYS HEy H 1 2.923 0.03 A 10 LYS HGy H 1 1.342 0.03 A 10 LYS HGx H 1 1.340 0.03 A 10 LYS C C 13 175.744 0.3 A 10 LYS CA C 13 55.919 0.3 A 10 LYS CB C 13 32.997 0.3 A 10 LYS CD C 13 29.171 0.3 A 10 LYS CE C 13 42.008 0.3 A 10 LYS CG C 13 24.984 0.3 A 10 LYS N N 15 121.858 0.3 A 11 GLY H H 1 9.089 0.03 A 11 GLY HAy H 1 4.878 0.03 A 11 GLY HAx H 1 3.200 0.03 A 11 GLY C C 13 171.179 0.3 A 11 GLY CA C 13 44.498 0.3 A 11 GLY N N 15 113.808 0.3 A 12 VAL H H 1 8.171 0.03 A 12 VAL HA H 1 5.094 0.03 A 12 VAL HB H 1 1.813 0.03 A 12 VAL HG1% H 1 0.805 0.03 A 12 VAL HG2% H 1 0.883 0.03 A 12 VAL C C 13 175.777 0.3 A 12 VAL CA C 13 59.578 0.3 A 12 VAL CB C 13 35.727 0.3 A 12 VAL CG1 C 13 20.483 0.3 A 12 VAL CG2 C 13 21.539 0.3 A 12 VAL N N 15 117.661 0.3 A 13 VAL H H 1 8.942 0.03 A 13 VAL HA H 1 4.302 0.03 A 13 VAL HB H 1 2.423 0.03 A 13 VAL HG1% H 1 0.798 0.03 A 13 VAL HG2% H 1 0.907 0.03 A 13 VAL C C 13 177.096 0.3 A 13 VAL CA C 13 62.981 0.3 A 13 VAL CB C 13 31.666 0.3 A 13 VAL CG1 C 13 22.360 0.3 A 13 VAL CG2 C 13 21.573 0.3 A 13 VAL N N 15 126.834 0.3 A 14 THR H H 1 9.319 0.03 A 14 THR HA H 1 4.617 0.03 A 14 THR HB H 1 4.247 0.03 A 14 THR HG2% H 1 1.253 0.03 A 14 THR C C 13 175.276 0.3 A 14 THR CA C 13 62.231 0.3 A 14 THR CB C 13 70.327 0.3 A 14 THR CG2 C 13 22.639 0.3 A 14 THR N N 15 120.710 0.3 A 15 ARG H H 1 7.643 0.03 A 15 ARG HA H 1 4.407 0.03 A 15 ARG HBy H 1 2.110 0.03 A 15 ARG HBx H 1 1.659 0.03 A 15 ARG HDy H 1 3.081 0.03 A 15 ARG HDx H 1 2.681 0.03 A 15 ARG HGy H 1 1.431 0.03 A 15 ARG HGx H 1 1.430 0.03 A 15 ARG C C 13 173.353 0.3 A 15 ARG CA C 13 57.073 0.3 A 15 ARG CB C 13 33.483 0.3 A 15 ARG CD C 13 43.553 0.3 A 15 ARG CG C 13 27.359 0.3 A 15 ARG N N 15 121.552 0.3 A 16 ILE H H 1 9.195 0.03 A 16 ILE HA H 1 4.354 0.03 A 16 ILE HB H 1 1.633 0.03 A 16 ILE HD1% H 1 0.691 0.03 A 16 ILE HG1y H 1 1.340 0.03 A 16 ILE HG1x H 1 0.702 0.03 A 16 ILE HG2% H 1 0.778 0.03 A 16 ILE C C 13 174.423 0.3 A 16 ILE CA C 13 62.180 0.3 A 16 ILE CB C 13 39.824 0.3 A 16 ILE CD1 C 13 14.228 0.3 A 16 ILE CG1 C 13 28.291 0.3 A 16 ILE CG2 C 13 18.218 0.3 A 16 ILE N N 15 127.746 0.3 A 17 GLU H H 1 8.468 0.03 A 17 GLU HA H 1 4.743 0.03 A 17 GLU HBy H 1 1.710 0.03 A 17 GLU HBx H 1 0.832 0.03 A 17 GLU HGy H 1 2.402 0.03 A 17 GLU HGx H 1 2.051 0.03 A 17 GLU C C 13 177.172 0.3 A 17 GLU CA C 13 53.340 0.3 A 17 GLU CB C 13 31.985 0.3 A 17 GLU CG C 13 34.697 0.3 A 17 GLU N N 15 125.854 0.3 A 18 LYS H H 1 9.244 0.03 A 18 LYS HA H 1 3.997 0.03 A 18 LYS HBy H 1 1.873 0.03 A 18 LYS HBx H 1 1.870 0.03 A 18 LYS HDx H 1 1.749 0.03 A 18 LYS HDy H 1 1.749 0.03 A 18 LYS HEx H 1 3.061 0.03 A 18 LYS HEy H 1 3.061 0.03 A 18 LYS HGy H 1 1.567 0.03 A 18 LYS HGx H 1 1.530 0.03 A 18 LYS C C 13 176.820 0.3 A 18 LYS CA C 13 58.950 0.3 A 18 LYS CB C 13 32.448 0.3 A 18 LYS CE C 13 42.152 0.3 A 18 LYS CG C 13 25.140 0.3 A 18 LYS N N 15 119.022 0.3 A 19 TYR H H 1 6.368 0.03 A 19 TYR HA H 1 4.717 0.03 A 19 TYR HBy H 1 3.394 0.03 A 19 TYR HBx H 1 2.866 0.03 A 19 TYR HDx H 1 6.977 0.03 A 19 TYR HDy H 1 6.977 0.03 A 19 TYR HEy H 1 6.862 0.03 A 19 TYR HEx H 1 6.860 0.03 A 19 TYR C C 13 175.207 0.3 A 19 TYR CA C 13 54.507 0.3 A 19 TYR CB C 13 37.981 0.3 A 19 TYR CDx C 13 133.490 0.3 A 19 TYR CDy C 13 133.490 0.3 A 19 TYR CEy C 13 119.034 0.3 A 19 TYR CEx C 13 119.001 0.3 A 19 TYR N N 15 106.561 0.3 A 20 GLY H H 1 7.015 0.03 A 20 GLY HAy H 1 4.231 0.03 A 20 GLY HAx H 1 3.855 0.03 A 20 GLY C C 13 168.697 0.3 A 20 GLY CA C 13 46.014 0.3 A 20 GLY N N 15 108.408 0.3 A 21 ALA H H 1 8.754 0.03 A 21 ALA HA H 1 5.120 0.03 A 21 ALA HB% H 1 1.181 0.03 A 21 ALA C C 13 175.944 0.3 A 21 ALA CA C 13 49.269 0.3 A 21 ALA CB C 13 21.362 0.3 A 21 ALA N N 15 119.763 0.3 A 22 PHE H H 1 9.352 0.03 A 22 PHE HA H 1 5.243 0.03 A 22 PHE HBy H 1 3.043 0.03 A 22 PHE HBx H 1 2.805 0.03 A 22 PHE HDx H 1 7.003 0.03 A 22 PHE HDy H 1 7.003 0.03 A 22 PHE HEy H 1 7.320 0.03 A 22 PHE HEx H 1 7.317 0.03 A 22 PHE HZ H 1 7.504 0.03 A 22 PHE C C 13 175.250 0.3 A 22 PHE CA C 13 57.870 0.3 A 22 PHE CB C 13 39.805 0.3 A 22 PHE CDx C 13 131.231 0.3 A 22 PHE CDy C 13 131.231 0.3 A 22 PHE CEx C 13 131.327 0.3 A 22 PHE CEy C 13 131.334 0.3 A 22 PHE CZ C 13 130.227 0.3 A 22 PHE N N 15 122.315 0.3 A 23 ILE H H 1 9.104 0.03 A 23 ILE HA H 1 4.875 0.03 A 23 ILE HB H 1 1.712 0.03 A 23 ILE HD1% H 1 0.633 0.03 A 23 ILE HG1y H 1 1.223 0.03 A 23 ILE HG1x H 1 1.196 0.03 A 23 ILE HG2% H 1 0.334 0.03 A 23 ILE C C 13 175.282 0.3 A 23 ILE CA C 13 58.180 0.3 A 23 ILE CB C 13 40.581 0.3 A 23 ILE CD1 C 13 14.668 0.3 A 23 ILE CG1 C 13 28.261 0.3 A 23 ILE CG2 C 13 17.189 0.3 A 23 ILE N N 15 123.829 0.3 A 24 ASN H H 1 9.321 0.03 A 24 ASN HA H 1 5.571 0.03 A 24 ASN HBy H 1 2.789 0.03 A 24 ASN HBx H 1 2.440 0.03 A 24 ASN HD21 H 1 7.613 0.03 A 24 ASN HD22 H 1 6.925 0.03 A 24 ASN C C 13 176.338 0.3 A 24 ASN CA C 13 52.435 0.3 A 24 ASN CB C 13 39.511 0.3 A 24 ASN N N 15 126.026 0.3 A 24 ASN ND2 N 15 112.825 0.3 A 25 LEU H H 1 9.053 0.03 A 25 LEU HA H 1 4.613 0.03 A 25 LEU HBy H 1 1.685 0.03 A 25 LEU HBx H 1 1.542 0.03 A 25 LEU HD1% H 1 0.563 0.03 A 25 LEU HD2% H 1 0.503 0.03 A 25 LEU HG H 1 1.558 0.03 A 25 LEU C C 13 177.186 0.3 A 25 LEU CA C 13 55.927 0.3 A 25 LEU CB C 13 41.201 0.3 A 25 LEU CD1 C 13 25.563 0.3 A 25 LEU CD2 C 13 22.122 0.3 A 25 LEU CG C 13 27.558 0.3 A 25 LEU N N 15 122.946 0.3 A 26 ASN H H 1 8.226 0.03 A 26 ASN HA H 1 4.529 0.03 A 26 ASN HBy H 1 3.365 0.03 A 26 ASN HBx H 1 3.267 0.03 A 26 ASN HD21 H 1 7.748 0.03 A 26 ASN HD22 H 1 6.827 0.03 A 26 ASN C C 13 175.020 0.3 A 26 ASN CA C 13 52.554 0.3 A 26 ASN CB C 13 37.405 0.3 A 26 ASN N N 15 113.810 0.3 A 26 ASN ND2 N 15 112.293 0.3 A 27 GLU H H 1 9.025 0.03 A 27 GLU HA H 1 4.060 0.03 A 27 GLU HBy H 1 2.080 0.03 A 27 GLU HBx H 1 2.076 0.03 A 27 GLU HGy H 1 2.393 0.03 A 27 GLU HGx H 1 2.360 0.03 A 27 GLU C C 13 176.739 0.3 A 27 GLU CA C 13 59.996 0.3 A 27 GLU CB C 13 29.078 0.3 A 27 GLU CG C 13 36.117 0.3 A 27 GLU N N 15 116.315 0.3 A 28 GLN H H 1 8.196 0.03 A 28 GLN HA H 1 4.458 0.03 A 28 GLN HBy H 1 2.187 0.03 A 28 GLN HBx H 1 2.083 0.03 A 28 GLN HE21 H 1 7.574 0.03 A 28 GLN HE22 H 1 6.866 0.03 A 28 GLN HGx H 1 2.357 0.03 A 28 GLN HGy H 1 2.358 0.03 A 28 GLN C C 13 175.823 0.3 A 28 GLN CA C 13 57.148 0.3 A 28 GLN CB C 13 30.775 0.3 A 28 GLN CG C 13 34.412 0.3 A 28 GLN N N 15 114.539 0.3 A 28 GLN NE2 N 15 112.552 0.3 A 29 VAL H H 1 7.835 0.03 A 29 VAL HA H 1 4.117 0.03 A 29 VAL HB H 1 1.769 0.03 A 29 VAL HG1% H 1 0.774 0.03 A 29 VAL HG2% H 1 0.989 0.03 A 29 VAL C C 13 173.537 0.3 A 29 VAL CA C 13 63.322 0.3 A 29 VAL CB C 13 32.907 0.3 A 29 VAL CG1 C 13 22.022 0.3 A 29 VAL CG2 C 13 21.457 0.3 A 29 VAL N N 15 122.042 0.3 A 30 ARG H H 1 8.585 0.03 A 30 ARG HA H 1 5.592 0.03 A 30 ARG HBy H 1 1.875 0.03 A 30 ARG HBx H 1 1.817 0.03 A 30 ARG HDy H 1 3.142 0.03 A 30 ARG HDx H 1 3.048 0.03 A 30 ARG HGy H 1 1.719 0.03 A 30 ARG HGx H 1 1.596 0.03 A 30 ARG C C 13 174.611 0.3 A 30 ARG CA C 13 54.097 0.3 A 30 ARG CB C 13 34.873 0.3 A 30 ARG CD C 13 44.204 0.3 A 30 ARG CG C 13 26.679 0.3 A 30 ARG N N 15 128.847 0.3 A 31 GLY H H 1 9.047 0.03 A 31 GLY HAx H 1 3.461 0.03 A 31 GLY HAy H 1 4.802 0.03 A 31 GLY C C 13 170.969 0.3 A 31 GLY CA C 13 45.984 0.3 A 31 GLY N N 15 109.418 0.3 A 32 LEU H H 1 8.195 0.03 A 32 LEU HA H 1 4.843 0.03 A 32 LEU HBy H 1 1.802 0.03 A 32 LEU HBx H 1 1.184 0.03 A 32 LEU HD1% H 1 -0.009 0.03 A 32 LEU HD2% H 1 0.689 0.03 A 32 LEU HG H 1 1.196 0.03 A 32 LEU C C 13 173.718 0.3 A 32 LEU CA C 13 54.081 0.3 A 32 LEU CB C 13 46.096 0.3 A 32 LEU CD1 C 13 21.194 0.3 A 32 LEU CD2 C 13 25.604 0.3 A 32 LEU CG C 13 27.441 0.3 A 32 LEU N N 15 121.840 0.3 A 33 LEU H H 1 9.302 0.03 A 33 LEU HA H 1 4.903 0.03 A 33 LEU HBy H 1 2.096 0.03 A 33 LEU HBx H 1 1.822 0.03 A 33 LEU HD1% H 1 0.873 0.03 A 33 LEU HD2% H 1 0.632 0.03 A 33 LEU HG H 1 1.500 0.03 A 33 LEU C C 13 174.281 0.3 A 33 LEU CA C 13 52.913 0.3 A 33 LEU CB C 13 45.837 0.3 A 33 LEU CD1 C 13 24.173 0.3 A 33 LEU CD2 C 13 27.060 0.3 A 33 LEU CG C 13 27.415 0.3 A 33 LEU N N 15 129.090 0.3 A 34 ARG H H 1 9.425 0.03 A 34 ARG HA H 1 4.771 0.03 A 34 ARG HDy H 1 3.223 0.03 A 34 ARG HDx H 1 3.139 0.03 A 34 ARG C C 13 176.490 0.3 A 34 ARG CA C 13 54.639 0.3 A 34 ARG CD C 13 43.249 0.3 A 34 ARG N N 15 127.1 0.3 A 35 PRO HA H 1 4.476 0.03 A 35 PRO HBy H 1 2.502 0.03 A 35 PRO HBx H 1 2.131 0.03 A 35 PRO HDy H 1 3.879 0.03 A 35 PRO HDx H 1 3.586 0.03 A 35 PRO HGy H 1 2.342 0.03 A 35 PRO HGx H 1 2.006 0.03 A 35 PRO C C 13 179.305 0.3 A 35 PRO CA C 13 65.826 0.3 A 35 PRO CB C 13 31.798 0.3 A 35 PRO CD C 13 51.091 0.3 A 35 PRO CG C 13 28.004 0.3 A 36 ARG H H 1 8.094 0.03 A 36 ARG HA H 1 4.298 0.03 A 36 ARG HBy H 1 1.967 0.03 A 36 ARG HBx H 1 1.804 0.03 A 36 ARG HDy H 1 3.215 0.03 A 36 ARG HDx H 1 3.161 0.03 A 36 ARG HGx H 1 1.556 0.03 A 36 ARG HGy H 1 1.556 0.03 A 36 ARG C C 13 175.981 0.3 A 36 ARG CA C 13 58.230 0.3 A 36 ARG CB C 13 28.897 0.3 A 36 ARG CD C 13 43.600 0.3 A 36 ARG CG C 13 26.339 0.3 A 36 ARG N N 15 114.597 0.3 A 37 ASP H H 1 7.967 0.03 A 37 ASP HA H 1 5.128 0.03 A 37 ASP HBy H 1 3.274 0.03 A 37 ASP HBx H 1 2.894 0.03 A 37 ASP C C 13 173.708 0.3 A 37 ASP CA C 13 54.047 0.3 A 37 ASP CB C 13 42.762 0.3 A 37 ASP N N 15 118.980 0.3 A 38 MET H H 1 7.447 0.03 A 38 MET HA H 1 4.871 0.03 A 38 MET HBy H 1 2.177 0.03 A 38 MET HBx H 1 2.176 0.03 A 38 MET HE% H 1 1.535 0.03 A 38 MET HGy H 1 2.776 0.03 A 38 MET HGx H 1 2.100 0.03 A 38 MET C C 13 174.849 0.3 A 38 MET CA C 13 56.119 0.3 A 38 MET CB C 13 35.540 0.3 A 38 MET CE C 13 16.720 0.3 A 38 MET CG C 13 32.712 0.3 A 38 MET N N 15 117.684 0.3 A 39 ILE H H 1 8.423 0.03 A 39 ILE HA H 1 4.343 0.03 A 39 ILE HB H 1 2.208 0.03 A 39 ILE HD1% H 1 0.944 0.03 A 39 ILE HG1y H 1 1.632 0.03 A 39 ILE HG1x H 1 1.369 0.03 A 39 ILE HG2% H 1 1.024 0.03 A 39 ILE C C 13 176.050 0.3 A 39 ILE CA C 13 60.967 0.3 A 39 ILE CB C 13 38.293 0.3 A 39 ILE CD1 C 13 12.833 0.3 A 39 ILE CG1 C 13 28.106 0.3 A 39 ILE CG2 C 13 17.550 0.3 A 39 ILE N N 15 125.687 0.3 A 40 SER H H 1 8.844 0.03 A 40 SER HA H 1 3.917 0.03 A 40 SER HBy H 1 4.294 0.03 A 40 SER HBx H 1 4.133 0.03 A 40 SER C C 13 174.026 0.3 A 40 SER CA C 13 61.572 0.3 A 40 SER CB C 13 62.518 0.3 A 40 SER N N 15 118.024 0.3 A 41 LEU H H 1 7.925 0.03 A 41 LEU HA H 1 4.250 0.03 A 41 LEU HBy H 1 1.306 0.03 A 41 LEU HBx H 1 1.089 0.03 A 41 LEU HD1% H 1 0.641 0.03 A 41 LEU HD2% H 1 0.031 0.03 A 41 LEU HG H 1 1.305 0.03 A 41 LEU C C 13 174.447 0.3 A 41 LEU CA C 13 54.895 0.3 A 41 LEU CB C 13 45.512 0.3 A 41 LEU CD1 C 13 23.836 0.3 A 41 LEU CD2 C 13 24.605 0.3 A 41 LEU CG C 13 26.446 0.3 A 41 LEU N N 15 122.690 0.3 A 42 ARG H H 1 8.096 0.03 A 42 ARG HA H 1 4.725 0.03 A 42 ARG HBy H 1 2.146 0.03 A 42 ARG HBx H 1 1.511 0.03 A 42 ARG HDx H 1 3.191 0.03 A 42 ARG HDy H 1 3.247 0.03 A 42 ARG HGy H 1 1.628 0.03 A 42 ARG HGx H 1 1.627 0.03 A 42 ARG C C 13 177.421 0.3 A 42 ARG CA C 13 54.234 0.3 A 42 ARG CB C 13 32.848 0.3 A 42 ARG CD C 13 43.463 0.3 A 42 ARG CG C 13 27.363 0.3 A 42 ARG N N 15 122.382 0.3 A 43 LEU H H 1 9.163 0.03 A 43 LEU HA H 1 3.650 0.03 A 43 LEU HBx H 1 1.544 0.03 A 43 LEU HBy H 1 1.544 0.03 A 43 LEU HD1% H 1 0.854 0.03 A 43 LEU HD2% H 1 0.791 0.03 A 43 LEU HG H 1 1.640 0.03 A 43 LEU C C 13 178.927 0.3 A 43 LEU CA C 13 58.590 0.3 A 43 LEU CB C 13 42.064 0.3 A 43 LEU CD1 C 13 25.148 0.3 A 43 LEU CD2 C 13 24.904 0.3 A 43 LEU CG C 13 26.716 0.3 A 43 LEU N N 15 124.246 0.3 A 44 GLU H H 1 9.028 0.03 A 44 GLU HA H 1 4.195 0.03 A 44 GLU HBx H 1 2.007 0.03 A 44 GLU HBy H 1 2.007 0.03 A 44 GLU HGy H 1 2.234 0.03 A 44 GLU HGx H 1 2.232 0.03 A 44 GLU C C 13 176.677 0.3 A 44 GLU CA C 13 58.505 0.3 A 44 GLU CB C 13 28.174 0.3 A 44 GLU CG C 13 35.853 0.3 A 44 GLU N N 15 113.908 0.3 A 45 ASN H H 1 7.864 0.03 A 45 ASN HA H 1 4.771 0.03 A 45 ASN HBy H 1 3.112 0.03 A 45 ASN HBx H 1 2.691 0.03 A 45 ASN HD21 H 1 7.775 0.03 A 45 ASN HD22 H 1 7.034 0.03 A 45 ASN C C 13 174.389 0.3 A 45 ASN CA C 13 53.983 0.3 A 45 ASN CB C 13 40.134 0.3 A 45 ASN N N 15 116.076 0.3 A 45 ASN ND2 N 15 109.748 0.3 A 46 LEU H H 1 7.544 0.03 A 46 LEU HA H 1 4.493 0.03 A 46 LEU HBy H 1 1.905 0.03 A 46 LEU HBx H 1 1.123 0.03 A 46 LEU HD1% H 1 0.613 0.03 A 46 LEU HD2% H 1 0.618 0.03 A 46 LEU HG H 1 1.564 0.03 A 46 LEU C C 13 174.573 0.3 A 46 LEU CA C 13 54.128 0.3 A 46 LEU CB C 13 44.642 0.3 A 46 LEU CD1 C 13 25.618 0.3 A 46 LEU CD2 C 13 23.352 0.3 A 46 LEU CG C 13 26.217 0.3 A 46 LEU N N 15 119.287 0.3 A 47 ASN H H 1 8.183 0.03 A 47 ASN HA H 1 4.880 0.03 A 47 ASN HBy H 1 2.628 0.03 A 47 ASN HBx H 1 2.503 0.03 A 47 ASN HD21 H 1 7.943 0.03 A 47 ASN HD22 H 1 6.790 0.03 A 47 ASN C C 13 174.879 0.3 A 47 ASN CA C 13 51.581 0.3 A 47 ASN CB C 13 42.099 0.3 A 47 ASN N N 15 117.093 0.3 A 47 ASN ND2 N 15 115.717 0.3 A 48 VAL H H 1 8.716 0.03 A 48 VAL HA H 1 3.359 0.03 A 48 VAL HB H 1 1.886 0.03 A 48 VAL HG1% H 1 0.922 0.03 A 48 VAL HG2% H 1 0.928 0.03 A 48 VAL C C 13 177.274 0.3 A 48 VAL CA C 13 65.657 0.3 A 48 VAL CB C 13 31.178 0.3 A 48 VAL CG1 C 13 21.470 0.3 A 48 VAL CG2 C 13 22.690 0.3 A 48 VAL N N 15 122.411 0.3 A 49 GLY H H 1 9.425 0.03 A 49 GLY HAy H 1 4.482 0.03 A 49 GLY HAx H 1 3.448 0.03 A 49 GLY C C 13 174.396 0.3 A 49 GLY CA C 13 44.438 0.3 A 49 GLY N N 15 117.211 0.3 A 50 ASP H H 1 8.008 0.03 A 50 ASP HA H 1 4.568 0.03 A 50 ASP HBx H 1 2.573 0.03 A 50 ASP HBy H 1 2.802 0.03 A 50 ASP C C 13 175.597 0.3 A 50 ASP CA C 13 55.350 0.3 A 50 ASP CB C 13 40.825 0.3 A 50 ASP N N 15 121.681 0.3 A 51 GLU H H 1 8.462 0.03 A 51 GLU HA H 1 5.167 0.03 A 51 GLU HBy H 1 1.999 0.03 A 51 GLU HBx H 1 1.928 0.03 A 51 GLU HGy H 1 2.442 0.03 A 51 GLU HGx H 1 2.189 0.03 A 51 GLU C C 13 176.066 0.3 A 51 GLU CA C 13 55.382 0.3 A 51 GLU CB C 13 31.247 0.3 A 51 GLU CG C 13 36.533 0.3 A 51 GLU N N 15 120.755 0.3 A 52 ILE H H 1 8.858 0.03 A 52 ILE HA H 1 4.746 0.03 A 52 ILE HB H 1 1.579 0.03 A 52 ILE HD1% H 1 0.380 0.03 A 52 ILE HG1y H 1 1.542 0.03 A 52 ILE HG1x H 1 1.015 0.03 A 52 ILE HG2% H 1 0.602 0.03 A 52 ILE C C 13 171.700 0.3 A 52 ILE CA C 13 60.062 0.3 A 52 ILE CB C 13 42.654 0.3 A 52 ILE CD1 C 13 14.201 0.3 A 52 ILE CG1 C 13 27.847 0.3 A 52 ILE CG2 C 13 15.594 0.3 A 52 ILE N N 15 122.827 0.3 A 53 ILE H H 1 8.195 0.03 A 53 ILE HA H 1 4.942 0.03 A 53 ILE HB H 1 1.783 0.03 A 53 ILE HD1% H 1 0.717 0.03 A 53 ILE HG1y H 1 1.515 0.03 A 53 ILE HG1x H 1 0.945 0.03 A 53 ILE HG2% H 1 0.801 0.03 A 53 ILE C C 13 176.042 0.3 A 53 ILE CA C 13 60.204 0.3 A 53 ILE CB C 13 37.838 0.3 A 53 ILE CD1 C 13 12.788 0.3 A 53 ILE CG1 C 13 27.915 0.3 A 53 ILE CG2 C 13 18.206 0.3 A 53 ILE N N 15 126.597 0.3 A 54 VAL H H 1 8.828 0.03 A 54 VAL HA H 1 5.046 0.03 A 54 VAL HB H 1 1.860 0.03 A 54 VAL HG1% H 1 0.769 0.03 A 54 VAL HG2% H 1 -0.141 0.03 A 54 VAL C C 13 173.788 0.3 A 54 VAL CA C 13 58.415 0.3 A 54 VAL CB C 13 36.406 0.3 A 54 VAL CG1 C 13 24.126 0.3 A 54 VAL CG2 C 13 17.013 0.3 A 54 VAL N N 15 118.033 0.3 A 55 GLN H H 1 9.112 0.03 A 55 GLN HA H 1 4.762 0.03 A 55 GLN HBy H 1 1.769 0.03 A 55 GLN HBx H 1 1.063 0.03 A 55 GLN HE21 H 1 6.538 0.03 A 55 GLN HE22 H 1 6.356 0.03 A 55 GLN HGy H 1 1.573 0.03 A 55 GLN HGx H 1 0.992 0.03 A 55 GLN C C 13 177.135 0.3 A 55 GLN CA C 13 53.376 0.3 A 55 GLN CB C 13 31.519 0.3 A 55 GLN CG C 13 33.923 0.3 A 55 GLN N N 15 120.609 0.3 A 55 GLN NE2 N 15 109.309 0.3 A 56 ALA H H 1 8.917 0.03 A 56 ALA HA H 1 4.752 0.03 A 56 ALA HB% H 1 1.299 0.03 A 56 ALA C C 13 176.908 0.3 A 56 ALA CA C 13 52.336 0.3 A 56 ALA CB C 13 18.542 0.3 A 56 ALA N N 15 128.776 0.3 A 57 ILE H H 1 9.052 0.03 A 57 ILE HA H 1 4.397 0.03 A 57 ILE HB H 1 1.763 0.03 A 57 ILE HD1% H 1 0.764 0.03 A 57 ILE HG1y H 1 1.356 0.03 A 57 ILE HG1x H 1 0.819 0.03 A 57 ILE HG2% H 1 0.861 0.03 A 57 ILE C C 13 175.821 0.3 A 57 ILE CA C 13 62.233 0.3 A 57 ILE CB C 13 39.855 0.3 A 57 ILE CD1 C 13 13.739 0.3 A 57 ILE CG1 C 13 27.112 0.3 A 57 ILE CG2 C 13 18.919 0.3 A 57 ILE N N 15 121.698 0.3 A 58 ASP H H 1 7.466 0.03 A 58 ASP HA H 1 4.716 0.03 A 58 ASP HBx H 1 2.684 0.03 A 58 ASP HBy H 1 2.684 0.03 A 58 ASP C C 13 173.546 0.3 A 58 ASP CA C 13 53.928 0.3 A 58 ASP CB C 13 42.568 0.3 A 58 ASP N N 15 115.984 0.3 A 59 VAL H H 1 8.477 0.03 A 59 VAL HA H 1 4.312 0.03 A 59 VAL HB H 1 1.922 0.03 A 59 VAL HG1% H 1 0.819 0.03 A 59 VAL HG2% H 1 0.694 0.03 A 59 VAL C C 13 174.685 0.3 A 59 VAL CA C 13 61.800 0.3 A 59 VAL CB C 13 34.617 0.3 A 59 VAL CG1 C 13 20.829 0.3 A 59 VAL CG2 C 13 20.738 0.3 A 59 VAL N N 15 121.302 0.3 A 60 ARG H H 1 8.618 0.03 A 60 ARG HA H 1 4.960 0.03 A 60 ARG HBy H 1 1.807 0.03 A 60 ARG HBx H 1 1.760 0.03 A 60 ARG HDy H 1 3.292 0.03 A 60 ARG HDx H 1 3.086 0.03 A 60 ARG HGy H 1 1.558 0.03 A 60 ARG HGx H 1 1.480 0.03 A 60 ARG C C 13 175.093 0.3 A 60 ARG CA C 13 53.017 0.3 A 60 ARG CB C 13 31.079 0.3 A 60 ARG CD C 13 43.436 0.3 A 60 ARG CG C 13 27.026 0.3 A 60 ARG N N 15 126.298 0.3 A 61 PRO HA H 1 4.345 0.03 A 61 PRO HBy H 1 2.386 0.03 A 61 PRO HBx H 1 2.024 0.03 A 61 PRO HDy H 1 3.949 0.03 A 61 PRO HDx H 1 3.717 0.03 A 61 PRO HGy H 1 2.151 0.03 A 61 PRO HGx H 1 2.028 0.03 A 61 PRO C C 13 179.261 0.3 A 61 PRO CA C 13 65.329 0.3 A 61 PRO CB C 13 32.121 0.3 A 61 PRO CD C 13 51.227 0.3 A 61 PRO CG C 13 27.542 0.3 A 62 GLU H H 1 9.498 0.03 A 62 GLU HA H 1 4.190 0.03 A 62 GLU HBx H 1 2.089 0.03 A 62 GLU HBy H 1 2.091 0.03 A 62 GLU HGy H 1 2.420 0.03 A 62 GLU HGx H 1 2.264 0.03 A 62 GLU C C 13 177.116 0.3 A 62 GLU CA C 13 58.786 0.3 A 62 GLU CB C 13 28.156 0.3 A 62 GLU CG C 13 36.124 0.3 A 62 GLU N N 15 118.869 0.3 A 63 LYS H H 1 7.419 0.03 A 63 LYS HA H 1 4.417 0.03 A 63 LYS HBy H 1 2.026 0.03 A 63 LYS HBx H 1 1.533 0.03 A 63 LYS HDx H 1 1.643 0.03 A 63 LYS HDy H 1 1.643 0.03 A 63 LYS HEx H 1 2.985 0.03 A 63 LYS HEy H 1 2.985 0.03 A 63 LYS HGy H 1 1.440 0.03 A 63 LYS HGx H 1 1.365 0.03 A 63 LYS C C 13 175.139 0.3 A 63 LYS CA C 13 55.171 0.3 A 63 LYS CB C 13 33.350 0.3 A 63 LYS CD C 13 32.327 0.3 A 63 LYS CG C 13 24.94 0.3 A 63 LYS N N 15 117.339 0.3 A 64 ARG H H 1 7.987 0.03 A 64 ARG HA H 1 3.916 0.03 A 64 ARG HBx H 1 1.629 0.03 A 64 ARG HBy H 1 2.010 0.03 A 64 ARG HDy H 1 3.248 0.03 A 64 ARG HDx H 1 3.247 0.03 A 64 ARG HGy H 1 1.632 0.03 A 64 ARG HGx H 1 1.631 0.03 A 64 ARG C C 13 175.335 0.3 A 64 ARG CA C 13 57.219 0.3 A 64 ARG CB C 13 27.659 0.3 A 64 ARG CD C 13 43.615 0.3 A 64 ARG CG C 13 27.730 0.3 A 64 ARG N N 15 117.476 0.3 A 65 GLU H H 1 7.386 0.03 A 65 GLU HA H 1 4.781 0.03 A 65 GLU HBy H 1 1.963 0.03 A 65 GLU HBx H 1 1.793 0.03 A 65 GLU HGy H 1 2.325 0.03 A 65 GLU HGx H 1 2.207 0.03 A 65 GLU C C 13 175.323 0.3 A 65 GLU CA C 13 55.281 0.3 A 65 GLU CB C 13 32.788 0.3 A 65 GLU CG C 13 35.769 0.3 A 65 GLU N N 15 116.936 0.3 A 66 ILE H H 1 7.987 0.03 A 66 ILE HA H 1 4.246 0.03 A 66 ILE HB H 1 1.157 0.03 A 66 ILE HD1% H 1 0.609 0.03 A 66 ILE HG1y H 1 1.385 0.03 A 66 ILE HG1x H 1 0.783 0.03 A 66 ILE HG2% H 1 0.091 0.03 A 66 ILE C C 13 173.944 0.3 A 66 ILE CA C 13 60.654 0.3 A 66 ILE CB C 13 41.665 0.3 A 66 ILE CD1 C 13 14.744 0.3 A 66 ILE CG1 C 13 28.245 0.3 A 66 ILE CG2 C 13 17.732 0.3 A 66 ILE N N 15 122.996 0.3 A 67 ASP H H 1 8.216 0.03 A 67 ASP HA H 1 5.338 0.03 A 67 ASP HBy H 1 2.615 0.03 A 67 ASP HBx H 1 2.515 0.03 A 67 ASP C C 13 174.477 0.3 A 67 ASP CA C 13 52.957 0.3 A 67 ASP CB C 13 43.37 0.3 A 67 ASP N N 15 124.673 0.3 A 68 PHE H H 1 8.846 0.03 A 68 PHE HA H 1 5.884 0.03 A 68 PHE HBy H 1 3.123 0.03 A 68 PHE HBx H 1 2.553 0.03 A 68 PHE HD1 H 1 6.961 0.03 A 68 PHE HD2 H 1 6.961 0.03 A 68 PHE HE1 H 1 6.977 0.03 A 68 PHE HE2 H 1 6.977 0.03 A 68 PHE HZ H 1 6.724 0.03 A 68 PHE C C 13 173.334 0.3 A 68 PHE CA C 13 55.504 0.3 A 68 PHE CB C 13 44.016 0.3 A 68 PHE CZ C 13 128.794 0.3 A 68 PHE N N 15 121.215 0.3 A 69 LYS H H 1 9.268 0.03 A 69 LYS HA H 1 5.063 0.03 A 69 LYS HBy H 1 1.934 0.03 A 69 LYS HBx H 1 1.766 0.03 A 69 LYS HDx H 1 1.692 0.03 A 69 LYS HDy H 1 1.701 0.03 A 69 LYS HEy H 1 2.933 0.03 A 69 LYS HEx H 1 2.825 0.03 A 69 LYS HGy H 1 1.644 0.03 A 69 LYS HGx H 1 1.265 0.03 A 69 LYS C C 13 174.338 0.3 A 69 LYS CA C 13 54.381 0.3 A 69 LYS CB C 13 38.076 0.3 A 69 LYS CD C 13 30.208 0.3 A 69 LYS CE C 13 42.388 0.3 A 69 LYS CG C 13 25.025 0.3 A 69 LYS N N 15 118.527 0.3 A 70 TYR H H 1 8.833 0.03 A 70 TYR HA H 1 5.092 0.03 A 70 TYR HBx H 1 2.813 0.03 A 70 TYR HBy H 1 2.814 0.03 A 70 TYR HDx H 1 7.224 0.03 A 70 TYR HDy H 1 7.224 0.03 A 70 TYR HEx H 1 6.864 0.03 A 70 TYR HEy H 1 6.864 0.03 A 70 TYR C C 13 172.895 0.3 A 70 TYR CA C 13 57.682 0.3 A 70 TYR CB C 13 42.151 0.3 A 70 TYR CDx C 13 134.049 0.3 A 70 TYR CDy C 13 134.049 0.3 A 70 TYR CEx C 13 118.660 0.3 A 70 TYR CEy C 13 118.660 0.3 A 70 TYR N N 15 123.984 0.3 A 71 ILE H H 1 8.090 0.03 A 71 ILE HA H 1 4.506 0.03 A 71 ILE HB H 1 1.683 0.03 A 71 ILE HD1% H 1 0.867 0.03 A 71 ILE HG1y H 1 1.385 0.03 A 71 ILE HG1x H 1 1.076 0.03 A 71 ILE HG2% H 1 0.893 0.03 A 71 ILE CA C 13 57.666 0.3 A 71 ILE CB C 13 40.970 0.3 A 71 ILE CD1 C 13 14.014 0.3 A 71 ILE CG1 C 13 27.146 0.3 A 71 ILE CG2 C 13 17.450 0.3 A 71 ILE N N 15 126.463 0.3 A 72 PRO HA H 1 4.290 0.03 A 72 PRO HBy H 1 2.283 0.03 A 72 PRO HBx H 1 1.886 0.03 A 72 PRO HDx H 1 3.627 0.03 A 72 PRO HDy H 1 3.627 0.03 A 72 PRO HGx H 1 2.041 0.03 A 72 PRO HGy H 1 2.051 0.03 A 72 PRO C C 13 176.799 0.3 A 72 PRO CA C 13 62.983 0.3 A 72 PRO CB C 13 32.020 0.3 A 72 PRO CD C 13 50.977 0.3 A 72 PRO CG C 13 27.664 0.3 A 73 LEU H H 1 8.178 0.03 A 73 LEU HA H 1 4.164 0.03 A 73 LEU HD1% H 1 0.905 0.03 A 73 LEU HD2% H 1 0.848 0.03 A 73 LEU C C 13 177.237 0.3 A 73 LEU CA C 13 55.270 0.3 A 73 LEU CB C 13 42.656 0.3 A 73 LEU CD1 C 13 24.880 0.3 A 73 LEU CD2 C 13 23.609 0.3 A 73 LEU CG C 13 27.173 0.3 A 73 LEU N N 15 122.030 0.3 A 74 GLU H H 1 8.288 0.03 A 74 GLU HA H 1 4.194 0.03 A 74 GLU HBx H 1 1.840 0.03 A 74 GLU HBy H 1 1.844 0.03 A 74 GLU HGy H 1 2.161 0.03 A 74 GLU HGx H 1 2.113 0.03 A 74 GLU C C 13 176.150 0.3 A 74 GLU CA C 13 56.347 0.3 A 74 GLU CB C 13 30.236 0.3 A 74 GLU CG C 13 35.617 0.3 A 74 GLU N N 15 121.132 0.3 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 32 LEU HG A 33 LEU HD1% 1.0 1.8 6.00 2 2 A 39 ILE HD1% A 71 ILE HA 1.0 1.8 4.42 3 3 A 23 ILE HG2% A 25 LEU HG 1.0 1.8 4.90 4 4 A 3 VAL HA A 9 TYR HEx 1.0 1.8 5.36 5 5 A 3 VAL HA A 2 ASP HA 1.0 1.8 5.38 6 6 A 3 VAL HA A 7 LYS HBx 1.0 1.8 6.13 7 7 A 5 PRO HA A 6 GLY HAy 1.0 1.8 5.89 8 8 A 5 PRO HA A 57 ILE HA 1.0 1.8 6.27 9 9 A 5 PRO HA A 6 GLY HAx 1.0 1.8 5.89 10 10 A 8 PHE HA A 55 GLN HA 1.0 1.8 5.28 11 11 A 8 PHE HA A 53 ILE HG2% 1.0 1.8 5.76 12 12 A 41 LEU H A 40 SER HBy 1.0 1.8 4.93 13 13 A 13 VAL HA A 23 ILE HA 1.0 1.8 5.05 14 14 A 39 ILE HG2% A 40 SER HBy 1.0 1.8 4.96 15 15 A 15 ARG HA A 48 VAL HG2% 1.0 1.8 4.24 16 16 A 16 ILE HA A 21 ALA HA 1.0 1.8 4.89 17 17 A 17 GLU HA A 18 LYS HA 1.0 1.8 5.06 18 18 A 18 LYS HA A 16 ILE HG2% 1.0 1.8 5.99 19 19 A 18 LYS HA A 17 GLU HBx 1.0 1.8 6.33 20 20 A 21 ALA HA A 16 ILE HG2% 1.0 1.8 4.61 21 21 A 22 PHE HA A 32 LEU HA 1.0 1.8 5.31 22 22 A 1 MET HE% A 26 ASN HA 1.0 1.8 4.82 23 23 A 27 GLU HA A 28 GLN HE21 1.0 1.8 4.95 24 24 A 26 ASN HA A 27 GLU HA 1.0 1.8 5.51 25 25 A 26 ASN H A 29 VAL HA 1.0 1.8 5.99 26 26 A 29 VAL HA A 28 GLN H 1.0 1.8 6.33 27 27 A 35 PRO HA A 38 MET HGx 1.0 1.8 4.80 28 28 A 35 PRO HBy A 36 ARG HA 1.0 1.8 5.30 29 29 A 39 ILE HA A 40 SER HA 1.0 1.8 5.36 30 30 A 43 LEU HA A 46 LEU HG 1.0 1.8 4.07 31 31 A 43 LEU HA A 46 LEU HD1% 1.0 1.8 4.35 32 32 A 44 GLU HA A 46 LEU H 1.0 1.8 5.69 33 33 A 44 GLU HA A 43 LEU HBx 1.0 1.8 4.80 34 34 A 16 ILE HG2% A 44 GLU HA 1.0 1.8 5.66 35 35 A 16 ILE HD1% A 46 LEU HA 1.0 1.8 5.29 36 36 A 13 VAL HB A 48 VAL HA 1.0 1.8 5.45 37 37 A 50 ASP HA A 51 GLU HGx 1.0 1.8 5.06 38 38 A 12 VAL HG2% A 51 GLU HA 1.0 1.8 5.06 39 39 A 51 GLU HA A 52 ILE HG2% 1.0 1.8 6.33 40 40 A 61 PRO HA A 64 ARG H 1.0 1.8 4.66 41 41 A 61 PRO HA A 63 LYS H 1.0 1.8 4.95 42 42 A 61 PRO HA A 64 ARG HA 1.0 1.8 4.44 43 43 A 61 PRO HA A 64 ARG HGy 1.0 1.8 5.58 44 44 A 61 PRO HA A 59 VAL HG1% 1.0 1.8 4.80 45 45 A 60 ARG H A 66 ILE HA 1.0 1.8 5.49 46 46 A 59 VAL HG1% A 66 ILE HA 1.0 1.8 5.28 47 47 A 33 LEU HD2% A 70 TYR HA 1.0 1.8 5.28 48 48 A 11 GLY HAx A 25 LEU HD2% 1.0 1.8 4.29 49 49 A 11 GLY HAx A 54 VAL HG2% 1.0 1.8 4.27 50 50 A 48 VAL HG1% A 49 GLY HAx 1.0 1.8 4.75 51 51 A 12 VAL HG1% A 49 GLY HAy 1.0 1.8 5.70 52 52 A 2 ASP HA A 3 VAL HB 1.0 1.8 5.54 53 53 A 3 VAL HB A 29 VAL HG1% 1.0 1.8 4.45 54 54 A 3 VAL HB A 66 ILE HD1% 1.0 1.8 4.95 55 55 A 11 GLY HAx A 12 VAL HB 1.0 1.8 5.85 56 56 A 51 GLU HGx A 12 VAL HB 1.0 1.8 5.06 57 57 A 13 VAL HB A 23 ILE HD1% 1.0 1.8 6.33 58 58 A 13 VAL HB A 46 LEU HD2% 1.0 1.8 6.33 59 59 A 14 THR HB A 15 ARG H 1.0 1.8 5.74 60 60 A 48 VAL HG1% A 14 THR HB 1.0 1.8 4.99 61 61 A 12 VAL HG1% A 14 THR HB 1.0 1.8 6.33 62 62 A 14 THR HB A 13 VAL HG1% 1.0 1.8 6.33 63 63 A 23 ILE HB A 68 PHE HE2 1.0 1.8 5.21 64 64 A 23 ILE HB A 68 PHE HD2 1.0 1.8 5.66 65 65 A 63 LYS HGx A 65 GLU HBy 1.0 1.8 5.28 66 66 A 3 VAL HG2% A 29 VAL HB 1.0 1.8 5.07 67 67 A 52 ILE HB A 53 ILE H 1.0 1.8 4.85 68 68 A 52 ILE HG2% A 53 ILE HB 1.0 1.8 5.37 69 69 A 57 ILE HB A 67 ASP HBy 1.0 1.8 5.31 70 70 A 57 ILE HB A 67 ASP HBx 1.0 1.8 5.31 71 71 A 60 ARG H A 59 VAL HB 1.0 1.8 4.97 72 72 A 59 VAL HB A 5 PRO HDx 1.0 1.8 5.22 73 73 A 32 LEU H A 66 ILE HB 1.0 1.8 5.78 74 74 A 66 ILE HB A 31 GLY HAy 1.0 1.8 5.34 75 75 A 66 ILE HB A 31 GLY HAx 1.0 1.8 5.34 76 76 A 8 PHE HEy A 71 ILE HB 1.0 1.8 5.12 77 77 A 71 ILE HB A 8 PHE HZ 1.0 1.8 6.33 78 78 A 1 MET HA A 2 ASP HBy 1.0 1.8 5.42 79 79 A 3 VAL HA A 4 GLU HBy 1.0 1.8 5.36 80 80 A 4 GLU HBy A 5 PRO HDy 1.0 1.8 4.66 81 81 A 4 GLU HBy A 7 LYS HBy 1.0 1.8 5.78 82 82 A 4 GLU HBy A 7 LYS HDx 1.0 1.8 6.33 83 83 A 4 GLU HBy A 7 LYS HDy 1.0 1.8 6.33 84 84 A 5 PRO HBx A 6 GLY H 1.0 1.8 5.16 85 85 A 5 PRO HBx A 4 GLU HA 1.0 1.8 5.90 86 86 A 38 MET HGx A 42 ARG HA 1.0 1.8 4.90 87 87 A 5 PRO HBx A 56 ALA HB% 1.0 1.8 5.45 88 88 A 53 ILE HG2% A 8 PHE HBx 1.0 1.8 5.35 89 89 A 18 LYS HBy A 19 TYR HA 1.0 1.8 5.29 90 90 A 17 GLU HBx A 18 LYS HBy 1.0 1.8 5.21 91 91 A 22 PHE HBx A 30 ARG HGy 1.0 1.8 5.50 92 92 A 13 VAL HG1% A 22 PHE HBy 1.0 1.8 5.78 93 93 A 27 GLU HBx A 29 VAL H 1.0 1.8 6.01 94 94 A 27 GLU HBx A 28 GLN HE22 1.0 1.8 5.88 95 95 A 26 ASN HA A 27 GLU HBy 1.0 1.8 5.47 96 96 A 27 GLU HBx A 26 ASN HBx 1.0 1.8 6.06 97 97 A 29 VAL H A 28 GLN HBy 1.0 1.8 5.21 98 98 A 31 GLY H A 30 ARG HBy 1.0 1.8 5.23 99 99 A 20 GLY HAy A 35 PRO HBx 1.0 1.8 5.82 100 100 A 43 LEU HBx A 35 PRO HBx 1.0 1.8 5.30 101 101 A 35 PRO HBx A 43 LEU HD2% 1.0 1.8 4.77 102 102 A 43 LEU HBx A 42 ARG HBx 1.0 1.8 5.28 103 103 A 43 LEU HBx A 35 PRO HGx 1.0 1.8 5.60 104 104 A 65 GLU H A 64 ARG HBy 1.0 1.8 5.19 105 105 A 19 TYR HA A 35 PRO HGx 1.0 1.8 5.83 106 106 A 44 GLU HBx A 45 ASN HA 1.0 1.8 6.28 107 107 A 1 MET HA A 2 ASP HBx 1.0 1.8 5.42 108 108 A 13 VAL HG1% A 50 ASP HBx 1.0 1.8 4.96 109 109 A 46 LEU HD2% A 50 ASP HBx 1.0 1.8 5.30 110 110 A 62 GLU H A 61 PRO HBy 1.0 1.8 4.97 111 111 A 63 LYS H A 62 GLU HBx 1.0 1.8 5.16 112 112 A 63 LYS H A 62 GLU HBy 1.0 1.8 5.59 113 113 A 62 GLU HBx A 63 LYS HGy 1.0 1.8 5.22 114 114 A 65 GLU H A 63 LYS HBx 1.0 1.8 5.34 115 115 A 57 ILE HG1x A 67 ASP HBy 1.0 1.8 5.96 116 116 A 33 LEU HD1% A 70 TYR HBx 1.0 1.8 4.40 117 117 A 5 PRO HDy A 4 GLU HBx 1.0 1.8 5.01 118 118 A 56 ALA HB% A 5 PRO HBy 1.0 1.8 5.64 119 119 A 5 PRO HBy A 59 VAL HG2% 1.0 1.8 5.35 120 120 A 28 GLN HBx A 29 VAL HG2% 1.0 1.8 5.08 121 121 A 4 GLU HA A 5 PRO HGy 1.0 1.8 5.31 122 122 A 62 GLU H A 61 PRO HBx 1.0 1.8 4.97 123 123 A 65 GLU H A 63 LYS HBy 1.0 1.8 5.58 124 124 A 63 LYS HBy A 60 ARG HBy 1.0 1.8 5.15 125 125 A 60 ARG HA A 61 PRO HGy 1.0 1.8 4.85 126 126 A 57 ILE HG1x A 67 ASP HBx 1.0 1.8 5.96 127 127 A 25 LEU HG A 26 ASN H 1.0 1.8 5.01 128 128 A 25 LEU HG A 29 VAL HG1% 1.0 1.8 4.30 129 129 A 41 LEU HG A 42 ARG H 1.0 1.8 5.58 130 130 A 40 SER H A 39 ILE HG1x 1.0 1.8 5.08 131 131 A 21 ALA HB% A 16 ILE HG1y 1.0 1.8 4.96 132 132 A 8 PHE HEy A 71 ILE HG1x 1.0 1.8 5.42 133 133 A 21 ALA HB% A 16 ILE HG1x 1.0 1.8 4.96 134 134 A 1 MET HGy A 2 ASP H 1.0 1.8 4.83 135 135 A 2 ASP HA A 1 MET HGy 1.0 1.8 4.99 136 136 A 29 VAL HG2% A 1 MET HGy 1.0 1.8 4.95 137 137 A 3 VAL HG2% A 1 MET HGy 1.0 1.8 4.51 138 138 A 3 VAL H A 4 GLU HGy 1.0 1.8 5.26 139 139 A 3 VAL HA A 4 GLU HGy 1.0 1.8 4.96 140 140 A 5 PRO HDy A 4 GLU HGx 1.0 1.8 4.28 141 141 A 59 VAL HG2% A 4 GLU HGx 1.0 1.8 6.33 142 142 A 59 VAL HG2% A 4 GLU HGy 1.0 1.8 6.33 143 143 A 4 GLU HGy A 3 VAL HG1% 1.0 1.8 5.84 144 144 A 4 GLU HA A 5 PRO HGx 1.0 1.8 5.30 145 145 A 8 PHE H A 7 LYS HGx 1.0 1.8 5.62 146 146 A 10 LYS HGx A 52 ILE H 1.0 1.8 5.55 147 147 A 17 GLU HGy A 22 PHE HDx 1.0 1.8 5.32 148 148 A 18 LYS HGy A 19 TYR H 1.0 1.8 6.10 149 149 A 17 GLU HA A 18 LYS HGy 1.0 1.8 5.31 150 150 A 28 GLN H A 27 GLU HGx 1.0 1.8 5.55 151 151 A 29 VAL HG1% A 30 ARG HGy 1.0 1.8 6.33 152 152 A 35 PRO HGy A 36 ARG HGy 1.0 1.8 5.01 153 153 A 31 GLY H A 30 ARG HGx 1.0 1.8 4.77 154 154 A 30 ARG HGx A 22 PHE HDy 1.0 1.8 6.33 155 155 A 44 GLU HGx A 45 ASN H 1.0 1.8 4.95 156 156 A 44 GLU HGx A 45 ASN HD22 1.0 1.8 6.11 157 157 A 44 GLU HGx A 42 ARG HDx 1.0 1.8 5.46 158 158 A 44 GLU HGx A 42 ARG HBy 1.0 1.8 4.04 159 159 A 51 GLU HGx A 52 ILE H 1.0 1.8 5.74 160 160 A 62 GLU H A 61 PRO HGx 1.0 1.8 4.80 161 161 A 60 ARG HA A 61 PRO HGx 1.0 1.8 5.24 162 162 A 59 VAL HG1% A 61 PRO HGx 1.0 1.8 5.87 163 163 A 63 LYS H A 62 GLU HGy 1.0 1.8 5.15 164 164 A 28 GLN H A 27 GLU HGy 1.0 1.8 5.06 165 165 A 64 ARG H A 65 GLU HGx 1.0 1.8 5.90 166 166 A 63 LYS HBy A 65 GLU HGx 1.0 1.8 5.30 167 167 A 71 ILE HG2% A 72 PRO HGx 1.0 1.8 5.64 168 168 A 2 ASP HA A 1 MET HGx 1.0 1.8 5.72 169 169 A 59 VAL HG2% A 5 PRO HGy 1.0 1.8 5.47 170 170 A 19 TYR H A 18 LYS HGx 1.0 1.8 5.40 171 171 A 17 GLU HA A 18 LYS HGx 1.0 1.8 5.42 172 172 A 37 ASP H A 38 MET HBy 1.0 1.8 5.77 173 173 A 59 VAL HG1% A 5 PRO HDx 1.0 1.8 5.30 174 174 A 8 PHE H A 7 LYS HDx 1.0 1.8 5.68 175 175 A 8 PHE H A 7 LYS HDy 1.0 1.8 5.68 176 176 A 43 LEU HD2% A 35 PRO HDy 1.0 1.8 5.18 177 177 A 60 ARG HA A 61 PRO HDy 1.0 1.8 4.19 178 178 A 61 PRO HDy A 60 ARG HBx 1.0 1.8 5.24 179 179 A 42 ARG HDy A 43 LEU H 1.0 1.8 5.53 180 180 A 57 ILE HG2% A 69 LYS HDy 1.0 1.8 4.95 181 181 A 71 ILE HD1% A 72 PRO HDx 1.0 1.8 5.23 182 182 A 20 GLY HAy A 35 PRO HDx 1.0 1.8 5.34 183 183 A 35 PRO HDx A 43 LEU HD1% 1.0 1.8 4.90 184 184 A 60 ARG HA A 61 PRO HDx 1.0 1.8 4.26 185 185 A 60 ARG HBx A 61 PRO HDx 1.0 1.8 5.40 186 186 A 1 MET HE% A 25 LEU H 1.0 1.8 5.44 187 187 A 1 MET HE% A 26 ASN H 1.0 1.8 4.60 188 188 A 1 MET HE% A 26 ASN HD21 1.0 1.8 4.86 189 189 A 1 MET HE% A 9 TYR HDy 1.0 1.8 3.94 190 190 A 1 MET HE% A 9 TYR HEy 1.0 1.8 4.28 191 191 A 1 MET HE% A 29 VAL HG1% 1.0 1.8 3.67 192 192 A 1 MET HE% A 25 LEU HD1% 1.0 1.8 3.24 193 193 A 54 VAL HG2% A 11 GLY H 1.0 1.8 5.01 194 194 A 54 VAL HG2% A 9 TYR HBy 1.0 1.8 5.54 195 195 A 54 VAL HG2% A 23 ILE HD1% 1.0 1.8 4.24 196 196 A 70 TYR HBx A 54 VAL HG1% 1.0 1.8 5.34 197 197 A 23 ILE HG2% A 54 VAL HG1% 1.0 1.8 4.14 198 198 A 53 ILE H A 52 ILE HD1% 1.0 1.8 5.66 199 199 A 52 ILE HD1% A 70 TYR HEy 1.0 1.8 4.98 200 200 A 52 ILE HD1% A 50 ASP HBy 1.0 1.8 5.50 201 201 A 52 ILE HD1% A 13 VAL HG2% 1.0 1.8 4.29 202 202 A 13 VAL HG1% A 52 ILE HD1% 1.0 1.8 5.28 203 203 A 54 VAL HG1% A 52 ILE HD1% 1.0 1.8 5.59 204 204 A 52 ILE HG2% A 54 VAL HG2% 1.0 1.8 5.24 205 205 A 13 VAL HG2% A 51 GLU H 1.0 1.8 5.55 206 206 A 12 VAL HG2% A 50 ASP H 1.0 1.8 4.60 207 207 A 13 VAL HG2% A 50 ASP H 1.0 1.8 4.92 208 208 A 23 ILE HA A 13 VAL HG2% 1.0 1.8 4.77 209 209 A 48 VAL HG1% A 14 THR HA 1.0 1.8 3.85 210 210 A 46 LEU HA A 13 VAL HG2% 1.0 1.8 4.92 211 211 A 50 ASP HBy A 13 VAL HG2% 1.0 1.8 4.57 212 212 A 50 ASP HBx A 13 VAL HG2% 1.0 1.8 4.60 213 213 A 52 ILE HB A 13 VAL HG2% 1.0 1.8 4.27 214 214 A 23 ILE HD1% A 13 VAL HG2% 1.0 1.8 3.38 215 215 A 43 LEU HD2% A 17 GLU H 1.0 1.8 5.34 216 216 A 43 LEU HD2% A 20 GLY H 1.0 1.8 4.58 217 217 A 35 PRO HA A 43 LEU HD2% 1.0 1.8 5.47 218 218 A 43 LEU HD2% A 20 GLY HAx 1.0 1.8 4.66 219 219 A 20 GLY HAy A 43 LEU HD2% 1.0 1.8 4.43 220 220 A 43 LEU HD2% A 35 PRO HGy 1.0 1.8 5.27 221 221 A 38 MET HGx A 43 LEU HD2% 1.0 1.8 4.70 222 222 A 43 LEU HD2% A 35 PRO HGx 1.0 1.8 4.26 223 223 A 43 LEU HD2% A 21 ALA HB% 1.0 1.8 3.86 224 224 A 43 LEU HD1% A 21 ALA H 1.0 1.8 4.63 225 225 A 43 LEU HD1% A 17 GLU H 1.0 1.8 5.13 226 226 A 19 TYR HA A 43 LEU HD1% 1.0 1.8 4.97 227 227 A 35 PRO HA A 43 LEU HD1% 1.0 1.8 5.08 228 228 A 43 LEU HD1% A 20 GLY HAx 1.0 1.8 4.62 229 229 A 18 LYS HA A 43 LEU HD1% 1.0 1.8 4.78 230 230 A 20 GLY HAy A 43 LEU HD1% 1.0 1.8 4.31 231 231 A 35 PRO HGy A 43 LEU HD1% 1.0 1.8 4.55 232 232 A 35 PRO HGx A 43 LEU HD1% 1.0 1.8 4.13 233 233 A 21 ALA HB% A 43 LEU HD1% 1.0 1.8 4.55 234 234 A 23 ILE HD1% A 68 PHE HD2 1.0 1.8 4.42 235 235 A 13 VAL HA A 23 ILE HD1% 1.0 1.8 4.92 236 236 A 23 ILE HD1% A 33 LEU HBx 1.0 1.8 4.52 237 237 A 9 TYR HEx A 3 VAL HG2% 1.0 1.8 4.96 238 238 A 3 VAL HG2% A 9 TYR HEy 1.0 1.8 5.72 239 239 A 25 LEU HD2% A 24 ASN HA 1.0 1.8 5.31 240 240 A 25 LEU HD2% A 11 GLY HAy 1.0 1.8 4.49 241 241 A 25 LEU HD2% A 9 TYR HBy 1.0 1.8 4.51 242 242 A 3 VAL HG2% A 1 MET HGx 1.0 1.8 5.05 243 243 A 25 LEU HD2% A 9 TYR HBx 1.0 1.8 4.57 244 244 A 1 MET HE% A 3 VAL HG2% 1.0 1.8 4.16 245 245 A 3 VAL HG2% A 56 ALA HB% 1.0 1.8 5.03 246 246 A 29 VAL HG1% A 3 VAL HG2% 1.0 1.8 3.55 247 247 A 3 VAL HG2% A 66 ILE HG2% 1.0 1.8 4.76 248 248 A 25 LEU HD2% A 54 VAL HG2% 1.0 1.8 4.39 249 249 A 3 VAL HG1% A 4 GLU H 1.0 1.8 4.23 250 250 A 3 VAL HG1% A 56 ALA HA 1.0 1.8 5.19 251 251 A 7 LYS HBx A 3 VAL HG1% 1.0 1.8 4.82 252 252 A 1 MET HE% A 3 VAL HG1% 1.0 1.8 4.85 253 253 A 56 ALA HB% A 3 VAL HG1% 1.0 1.8 3.67 254 254 A 29 VAL HG1% A 3 VAL HG1% 1.0 1.8 3.86 255 255 A 59 VAL HG2% A 3 VAL HG1% 1.0 1.8 3.76 256 256 A 3 VAL HG1% A 66 ILE HG2% 1.0 1.8 3.99 257 257 A 26 ASN H A 25 LEU HD1% 1.0 1.8 5.77 258 258 A 25 LEU HD1% A 68 PHE HE1 1.0 1.8 4.57 259 259 A 9 TYR HEx A 25 LEU HD1% 1.0 1.8 5.57 260 260 A 25 LEU HD1% A 10 LYS HA 1.0 1.8 6.33 261 261 A 25 LEU HD1% A 9 TYR HBy 1.0 1.8 4.70 262 262 A 25 LEU HD1% A 9 TYR HBx 1.0 1.8 4.85 263 263 A 29 VAL HG2% A 25 LEU HD1% 1.0 1.8 4.97 264 264 A 54 VAL HG2% A 25 LEU HD1% 1.0 1.8 5.14 265 265 A 16 ILE HD1% A 14 THR H 1.0 1.8 6.00 266 266 A 16 ILE HD1% A 22 PHE H 1.0 1.8 6.21 267 267 A 16 ILE HD1% A 48 VAL H 1.0 1.8 4.83 268 268 A 16 ILE HD1% A 17 GLU H 1.0 1.8 5.01 269 269 A 16 ILE HD1% A 47 ASN H 1.0 1.8 4.92 270 270 A 46 LEU H A 16 ILE HD1% 1.0 1.8 5.29 271 271 A 21 ALA HA A 16 ILE HD1% 1.0 1.8 5.03 272 272 A 16 ILE HD1% A 47 ASN HA 1.0 1.8 4.16 273 273 A 16 ILE HD1% A 48 VAL HA 1.0 1.8 5.04 274 274 A 16 ILE HD1% A 21 ALA HB% 1.0 1.8 3.91 275 275 A 16 ILE HG2% A 22 PHE H 1.0 1.8 6.10 276 276 A 17 GLU HA A 16 ILE HG2% 1.0 1.8 4.86 277 277 A 16 ILE HG2% A 21 ALA HB% 1.0 1.8 4.11 278 278 A 13 VAL HG1% A 48 VAL H 1.0 1.8 5.12 279 279 A 23 ILE HA A 13 VAL HG1% 1.0 1.8 5.96 280 280 A 13 VAL HG1% A 47 ASN HA 1.0 1.8 6.16 281 281 A 13 VAL HG1% A 14 THR HA 1.0 1.8 5.38 282 282 A 48 VAL HA A 13 VAL HG1% 1.0 1.8 4.31 283 283 A 12 VAL HG1% A 49 GLY H 1.0 1.8 5.74 284 284 A 12 VAL HG1% A 13 VAL H 1.0 1.8 4.34 285 285 A 64 ARG H A 59 VAL HG1% 1.0 1.8 6.33 286 286 A 59 VAL HG1% A 66 ILE H 1.0 1.8 6.33 287 287 A 59 VAL HG1% A 4 GLU HA 1.0 1.8 5.29 288 288 A 11 GLY HAx A 12 VAL HG1% 1.0 1.8 6.33 289 289 A 23 ILE HA A 12 VAL HG1% 1.0 1.8 6.33 290 290 A 12 VAL HG1% A 14 THR HA 1.0 1.8 5.06 291 291 A 59 VAL HG1% A 61 PRO HDy 1.0 1.8 5.14 292 292 A 59 VAL HG1% A 61 PRO HDx 1.0 1.8 4.15 293 293 A 12 VAL HG1% A 24 ASN HBx 1.0 1.8 5.23 294 294 A 12 VAL HG1% A 24 ASN HBy 1.0 1.8 4.23 295 295 A 59 VAL HG1% A 5 PRO HBx 1.0 1.8 6.12 296 296 A 59 VAL HG1% A 3 VAL HB 1.0 1.8 5.06 297 297 A 59 VAL HG1% A 66 ILE HG1y 1.0 1.8 4.46 298 298 A 12 VAL HG1% A 14 THR HG2% 1.0 1.8 3.63 299 299 A 59 VAL HG1% A 3 VAL HG1% 1.0 1.8 4.92 300 300 A 59 VAL HG1% A 66 ILE HG2% 1.0 1.8 4.44 301 301 A 12 VAL HG2% A 49 GLY H 1.0 1.8 4.67 302 302 A 12 VAL HG2% A 14 THR H 1.0 1.8 6.30 303 303 A 12 VAL HG2% A 13 VAL H 1.0 1.8 3.97 304 304 A 12 VAL HG2% A 49 GLY HAx 1.0 1.8 5.13 305 305 A 12 VAL HG2% A 49 GLY HAy 1.0 1.8 4.62 306 306 A 51 GLU HGx A 12 VAL HG2% 1.0 1.8 3.78 307 307 A 12 VAL HG2% A 51 GLU HGy 1.0 1.8 3.96 308 308 A 14 THR HG2% A 12 VAL H 1.0 1.8 5.29 309 309 A 14 THR HG2% A 24 ASN HD21 1.0 1.8 5.08 310 310 A 14 THR HG2% A 24 ASN HD22 1.0 1.8 5.08 311 311 A 24 ASN HA A 14 THR HG2% 1.0 1.8 5.42 312 312 A 24 ASN HBx A 14 THR HG2% 1.0 1.8 4.76 313 313 A 24 ASN HBy A 14 THR HG2% 1.0 1.8 4.23 314 314 A 41 LEU H A 39 ILE HG2% 1.0 1.8 5.24 315 315 A 39 ILE HG2% A 40 SER HBx 1.0 1.8 4.96 316 316 A 39 ILE HG2% A 40 SER HA 1.0 1.8 4.57 317 317 A 32 LEU HD1% A 33 LEU H 1.0 1.8 4.06 318 318 A 32 LEU HD1% A 22 PHE HEy 1.0 1.8 4.76 319 319 A 22 PHE HDx A 32 LEU HD1% 1.0 1.8 4.81 320 320 A 22 PHE HA A 32 LEU HD1% 1.0 1.8 4.85 321 321 A 20 GLY HAx A 32 LEU HD1% 1.0 1.8 4.57 322 322 A 20 GLY HAy A 32 LEU HD1% 1.0 1.8 4.77 323 323 A 39 ILE HD1% A 70 TYR H 1.0 1.8 5.03 324 324 A 39 ILE HD1% A 70 TYR HDx 1.0 1.8 5.39 325 325 A 39 ILE HD1% A 38 MET HA 1.0 1.8 5.05 326 326 A 39 ILE HD1% A 70 TYR HBy 1.0 1.8 4.24 327 327 A 39 ILE HD1% A 72 PRO HGy 1.0 1.8 5.80 328 328 A 71 ILE HD1% A 55 GLN H 1.0 1.8 5.72 329 329 A 8 PHE HEy A 71 ILE HD1% 1.0 1.8 4.31 330 330 A 71 ILE HD1% A 8 PHE HDy 1.0 1.8 4.82 331 331 A 71 ILE HD1% A 55 GLN HE21 1.0 1.8 6.33 332 332 A 71 ILE HD1% A 54 VAL HA 1.0 1.8 5.24 333 333 A 55 GLN HA A 71 ILE HD1% 1.0 1.8 5.16 334 334 A 70 TYR HEy A 41 LEU HD2% 1.0 1.8 5.29 335 335 A 41 LEU HD2% A 45 ASN HBy 1.0 1.8 5.38 336 336 A 41 LEU HD2% A 38 MET HE% 1.0 1.8 4.23 337 337 A 52 ILE HD1% A 41 LEU HD2% 1.0 1.8 4.22 338 338 A 33 LEU H A 32 LEU HD2% 1.0 1.8 5.12 339 339 A 32 LEU HD2% A 22 PHE HEx 1.0 1.8 4.31 340 340 A 46 LEU HD1% A 47 ASN H 1.0 1.8 6.19 341 341 A 73 LEU HD1% A 74 GLU HA 1.0 1.8 6.13 342 342 A 33 LEU HD1% A 68 PHE H 1.0 1.8 4.80 343 343 A 33 LEU HD1% A 70 TYR HDy 1.0 1.8 5.47 344 344 A 33 LEU HD1% A 69 LYS HA 1.0 1.8 4.34 345 345 A 33 LEU HD1% A 38 MET HGy 1.0 1.8 4.62 346 346 A 46 LEU HD2% A 70 TYR HDy 1.0 1.8 5.40 347 347 A 46 LEU HD2% A 45 ASN HD22 1.0 1.8 6.33 348 348 A 46 LEU HD2% A 70 TYR HEy 1.0 1.8 5.34 349 349 A 46 LEU HD2% A 42 ARG HA 1.0 1.8 5.81 350 350 A 46 LEU HD2% A 45 ASN HA 1.0 1.8 6.33 351 351 A 46 LEU HD2% A 41 LEU HA 1.0 1.8 4.49 352 352 A 46 LEU HD2% A 45 ASN HBy 1.0 1.8 4.04 353 353 A 46 LEU HD2% A 45 ASN HBx 1.0 1.8 4.89 354 354 A 46 LEU HD2% A 41 LEU HBx 1.0 1.8 3.35 355 355 A 46 LEU HD2% A 41 LEU HD2% 1.0 1.8 3.19 356 356 A 21 ALA HB% A 22 PHE HDx 1.0 1.8 5.15 357 357 A 16 ILE HA A 21 ALA HB% 1.0 1.8 4.54 358 358 A 21 ALA HB% A 33 LEU HBx 1.0 1.8 4.73 359 359 A 21 ALA HB% A 33 LEU HG 1.0 1.8 5.46 360 360 A 21 ALA HB% A 43 LEU HBy 1.0 1.8 6.01 361 361 A 13 VAL HG1% A 21 ALA HB% 1.0 1.8 3.71 362 362 A 46 LEU HD1% A 21 ALA HB% 1.0 1.8 3.32 363 363 A 21 ALA HB% A 32 LEU HD1% 1.0 1.8 4.92 364 364 A 56 ALA HB% A 67 ASP H 1.0 1.8 5.49 365 365 A 56 ALA HB% A 7 LYS H 1.0 1.8 4.98 366 366 A 9 TYR HEx A 56 ALA HB% 1.0 1.8 4.27 367 367 A 5 PRO HA A 56 ALA HB% 1.0 1.8 4.59 368 368 A 7 LYS HBx A 56 ALA HB% 1.0 1.8 5.37 369 369 A 57 ILE HB A 56 ALA HB% 1.0 1.8 5.99 370 370 A 3 VAL HB A 56 ALA HB% 1.0 1.8 5.07 371 371 A 29 VAL HG1% A 56 ALA HB% 1.0 1.8 6.33 372 372 A 56 ALA HB% A 57 ILE HG1x 1.0 1.8 6.33 373 373 A 59 VAL HG1% A 56 ALA HB% 1.0 1.8 6.33 374 374 A 29 VAL HG1% A 25 LEU H 1.0 1.8 4.75 375 375 A 26 ASN H A 29 VAL HG1% 1.0 1.8 4.61 376 376 A 29 VAL HG1% A 24 ASN HA 1.0 1.8 5.91 377 377 A 29 VAL HG1% A 30 ARG HA 1.0 1.8 6.11 378 378 A 29 VAL HG1% A 25 LEU HBy 1.0 1.8 4.43 379 379 A 23 ILE HG2% A 11 GLY H 1.0 1.8 4.65 380 380 A 23 ILE HG2% A 11 GLY HAx 1.0 1.8 4.15 381 381 A 23 ILE HG2% A 11 GLY HAy 1.0 1.8 4.39 382 382 A 23 ILE HG2% A 12 VAL HG2% 1.0 1.8 5.19 383 383 A 23 ILE HG2% A 12 VAL HG1% 1.0 1.8 4.74 384 384 A 23 ILE HG2% A 54 VAL HG2% 1.0 1.8 4.28 385 385 A 29 VAL HG2% A 25 LEU H 1.0 1.8 5.38 386 386 A 29 VAL HG2% A 30 ARG H 1.0 1.8 4.76 387 387 A 26 ASN H A 29 VAL HG2% 1.0 1.8 4.55 388 388 A 29 VAL HG2% A 26 ASN HD22 1.0 1.8 4.74 389 389 A 29 VAL HG2% A 28 GLN HA 1.0 1.8 5.55 390 390 A 28 GLN HBy A 29 VAL HG2% 1.0 1.8 4.29 391 391 A 1 MET HE% A 29 VAL HG2% 1.0 1.8 3.88 392 392 A 29 VAL HG2% A 25 LEU HBy 1.0 1.8 4.68 393 393 A 3 VAL HG2% A 29 VAL HG2% 1.0 1.8 4.34 394 394 A 57 ILE HG2% A 58 ASP H 1.0 1.8 4.59 395 395 A 57 ILE HG2% A 58 ASP HA 1.0 1.8 4.97 396 396 A 57 ILE HG2% A 58 ASP HBx 1.0 1.8 4.38 397 397 A 66 ILE HG2% A 57 ILE H 1.0 1.8 5.06 398 398 A 60 ARG H A 66 ILE HG2% 1.0 1.8 5.43 399 399 A 66 ILE HG2% A 56 ALA HA 1.0 1.8 4.66 400 400 A 3 VAL HB A 66 ILE HG2% 1.0 1.8 5.39 401 401 A 56 ALA HB% A 66 ILE HG2% 1.0 1.8 4.16 402 402 A 35 PRO HA A 46 LEU HD1% 1.0 1.8 5.62 403 403 A 46 LEU HD1% A 41 LEU HD2% 1.0 1.8 5.07 404 404 A 57 ILE HD1% A 69 LYS H 1.0 1.8 5.12 405 405 A 58 ASP H A 57 ILE HD1% 1.0 1.8 5.46 406 406 A 69 LYS HA A 57 ILE HD1% 1.0 1.8 4.86 407 407 A 56 ALA HA A 57 ILE HD1% 1.0 1.8 6.12 408 408 A 46 LEU HD2% A 47 ASN H 1.0 1.8 4.27 409 409 A 46 LEU HD2% A 38 MET HE% 1.0 1.8 3.83 410 410 A 46 LEU HD2% A 13 VAL HG2% 1.0 1.8 4.22 411 411 A 8 PHE HEy A 71 ILE HG2% 1.0 1.8 5.31 412 412 A 8 PHE HZ A 71 ILE HG2% 1.0 1.8 5.51 413 413 A 59 VAL HG2% A 67 ASP H 1.0 1.8 5.16 414 414 A 9 TYR HEx A 59 VAL HG2% 1.0 1.8 6.33 415 415 A 4 GLU HA A 59 VAL HG2% 1.0 1.8 4.83 416 416 A 59 VAL HG2% A 58 ASP HA 1.0 1.8 4.66 417 417 A 5 PRO HDx A 59 VAL HG2% 1.0 1.8 4.30 418 418 A 59 VAL HG2% A 58 ASP HBx 1.0 1.8 6.33 419 419 A 59 VAL HG2% A 58 ASP HBy 1.0 1.8 6.33 420 420 A 59 VAL HG2% A 5 PRO HGx 1.0 1.8 4.44 421 421 A 5 PRO HBx A 59 VAL HG2% 1.0 1.8 4.86 422 422 A 4 GLU HBx A 59 VAL HG2% 1.0 1.8 5.90 423 423 A 3 VAL HB A 59 VAL HG2% 1.0 1.8 4.45 424 424 A 56 ALA HB% A 59 VAL HG2% 1.0 1.8 3.98 425 425 A 59 VAL HG2% A 66 ILE HG2% 1.0 1.8 4.05 426 426 A 43 LEU H A 38 MET HE% 1.0 1.8 5.57 427 427 A 40 SER H A 38 MET HE% 1.0 1.8 5.68 428 428 A 38 MET HE% A 39 ILE H 1.0 1.8 5.45 429 429 A 42 ARG H A 38 MET HE% 1.0 1.8 4.93 430 430 A 70 TYR HEy A 38 MET HE% 1.0 1.8 5.43 431 431 A 42 ARG HA A 38 MET HE% 1.0 1.8 4.35 432 432 A 35 PRO HA A 38 MET HE% 1.0 1.8 4.81 433 433 A 38 MET HE% A 41 LEU HA 1.0 1.8 4.70 434 434 A 38 MET HE% A 41 LEU HBy 1.0 1.8 4.13 435 435 A 46 LEU HD1% A 38 MET HE% 1.0 1.8 3.12 436 436 A 52 ILE HD1% A 38 MET HE% 1.0 1.8 4.78 437 437 A 33 LEU HD2% A 70 TYR HDy 1.0 1.8 5.40 438 438 A 33 LEU HD2% A 69 LYS HA 1.0 1.8 5.89 439 439 A 33 LEU HD2% A 38 MET HA 1.0 1.8 5.83 440 440 A 33 LEU HD2% A 38 MET HGy 1.0 1.8 5.35 441 441 A 33 LEU HD2% A 70 TYR HBx 1.0 1.8 5.52 442 442 A 33 LEU HD2% A 52 ILE HD1% 1.0 1.8 4.42 443 443 A 74 GLU HA A 73 LEU HD2% 1.0 1.8 5.08 444 444 A 12 VAL HG2% A 14 THR HG2% 1.0 1.8 4.49 445 445 A 43 LEU HD2% A 38 MET HE% 1.0 1.8 4.15 446 446 A 23 ILE HG2% A 25 LEU HD1% 1.0 1.8 5.28 447 447 A 57 ILE HG1x A 68 PHE HA 1.0 1.8 5.57 448 448 A 56 ALA HA A 68 PHE HA 1.0 1.8 5.15 449 449 A 32 LEU HA A 23 ILE H 1.0 1.8 5.26 450 450 A 73 LEU HA A 74 GLU H 1.0 1.8 3.75 451 451 A 39 ILE H A 38 MET HBx 1.0 1.8 4.29 452 452 A 53 ILE HB A 54 VAL H 1.0 1.8 5.21 453 453 A 28 GLN H A 27 GLU HBx 1.0 1.8 3.45 454 454 A 62 GLU H A 61 PRO HGy 1.0 1.8 3.96 455 455 A 65 GLU H A 60 ARG HBy 1.0 1.8 4.23 456 456 A 2 ASP H A 3 VAL H 1.0 1.8 5.26 457 457 A 3 VAL H A 4 GLU H 1.0 1.8 5.26 458 458 A 6 GLY H A 7 LYS H 1.0 1.8 4.06 459 459 A 8 PHE H A 7 LYS H 1.0 1.8 5.32 460 460 A 9 TYR H A 10 LYS H 1.0 1.8 5.47 461 461 A 15 ARG H A 14 THR H 1.0 1.8 3.59 462 462 A 17 GLU H A 16 ILE H 1.0 1.8 5.29 463 463 A 17 GLU H A 18 LYS H 1.0 1.8 5.12 464 464 A 19 TYR H A 20 GLY H 1.0 1.8 3.63 465 465 A 20 GLY H A 21 ALA H 1.0 1.8 5.12 466 466 A 21 ALA H A 22 PHE H 1.0 1.8 5.64 467 467 A 25 LEU H A 24 ASN H 1.0 1.8 5.77 468 468 A 28 GLN H A 27 GLU H 1.0 1.8 4.17 469 469 A 28 GLN H A 29 VAL H 1.0 1.8 3.39 470 470 A 37 ASP H A 36 ARG H 1.0 1.8 4.23 471 471 A 37 ASP H A 38 MET H 1.0 1.8 3.67 472 472 A 41 LEU H A 40 SER H 1.0 1.8 3.89 473 473 A 41 LEU H A 42 ARG H 1.0 1.8 5.37 474 474 A 42 ARG H A 43 LEU H 1.0 1.8 5.21 475 475 A 43 LEU H A 44 GLU H 1.0 1.8 4.20 476 476 A 46 LEU H A 45 ASN H 1.0 1.8 3.57 477 477 A 46 LEU H A 47 ASN H 1.0 1.8 5.16 478 478 A 48 VAL H A 49 GLY H 1.0 1.8 5.28 479 479 A 50 ASP H A 49 GLY H 1.0 1.8 3.96 480 480 A 51 GLU H A 50 ASP H 1.0 1.8 4.99 481 481 A 53 ILE H A 54 VAL H 1.0 1.8 6.33 482 482 A 70 TYR H A 55 GLN H 1.0 1.8 6.30 483 483 A 58 ASP H A 57 ILE H 1.0 1.8 4.00 484 484 A 58 ASP H A 59 VAL H 1.0 1.8 5.01 485 485 A 64 ARG H A 63 LYS H 1.0 1.8 3.46 486 486 A 65 GLU H A 66 ILE H 1.0 1.8 5.44 487 487 A 66 ILE H A 67 ASP H 1.0 1.8 5.28 488 488 A 32 LEU H A 68 PHE H 1.0 1.8 6.03 489 489 A 70 TYR H A 69 LYS H 1.0 1.8 5.93 490 490 A 70 TYR H A 71 ILE H 1.0 1.8 5.69 491 491 A 74 GLU H A 73 LEU H 1.0 1.8 5.01 492 492 A 11 GLY H A 10 LYS H 1.0 1.8 5.05 493 493 A 11 GLY H A 12 VAL H 1.0 1.8 5.23 494 494 A 13 VAL H A 12 VAL H 1.0 1.8 5.19 495 495 A 14 THR H A 13 VAL H 1.0 1.8 5.51 496 496 A 15 ARG H A 16 ILE H 1.0 1.8 5.21 497 497 A 19 TYR H A 18 LYS H 1.0 1.8 3.98 498 498 A 21 ALA H A 33 LEU H 1.0 1.8 4.66 499 499 A 22 PHE H A 23 ILE H 1.0 1.8 5.30 500 500 A 23 ILE H A 24 ASN H 1.0 1.8 5.45 501 501 A 29 VAL H A 30 ARG H 1.0 1.8 5.21 502 502 A 31 GLY H A 30 ARG H 1.0 1.8 5.11 503 503 A 32 LEU H A 31 GLY H 1.0 1.8 5.18 504 504 A 32 LEU H A 33 LEU H 1.0 1.8 5.24 505 505 A 39 ILE H A 38 MET H 1.0 1.8 5.50 506 506 A 40 SER H A 39 ILE H 1.0 1.8 4.53 507 507 A 45 ASN H A 44 GLU H 1.0 1.8 4.13 508 508 A 48 VAL H A 47 ASN H 1.0 1.8 5.30 509 509 A 52 ILE H A 51 GLU H 1.0 1.8 5.34 510 510 A 53 ILE H A 52 ILE H 1.0 1.8 5.22 511 511 A 60 ARG H A 59 VAL H 1.0 1.8 5.24 512 512 A 63 LYS H A 62 GLU H 1.0 1.8 3.81 513 513 A 64 ARG H A 65 GLU H 1.0 1.8 3.62 514 514 A 32 LEU H A 66 ILE H 1.0 1.8 4.54 515 515 A 68 PHE H A 67 ASP H 1.0 1.8 5.47 516 516 A 68 PHE H A 69 LYS H 1.0 1.8 5.26 517 517 A 1 MET HA A 2 ASP H 1.0 1.8 3.12 518 518 A 2 ASP HA A 3 VAL H 1.0 1.8 3.07 519 519 A 3 VAL HA A 4 GLU H 1.0 1.8 3.94 520 520 A 5 PRO HA A 6 GLY H 1.0 1.8 3.90 521 521 A 8 PHE H A 7 LYS HA 1.0 1.8 3.96 522 522 A 10 LYS H A 9 TYR HA 1.0 1.8 3.71 523 523 A 11 GLY H A 10 LYS HA 1.0 1.8 3.73 524 524 A 13 VAL H A 12 VAL HA 1.0 1.8 3.88 525 525 A 15 ARG HA A 16 ILE H 1.0 1.8 3.54 526 526 A 16 ILE HA A 17 GLU H 1.0 1.8 3.75 527 527 A 17 GLU HA A 18 LYS H 1.0 1.8 3.69 528 528 A 21 ALA HA A 22 PHE H 1.0 1.8 3.91 529 529 A 22 PHE HA A 23 ILE H 1.0 1.8 3.90 530 530 A 23 ILE HA A 24 ASN H 1.0 1.8 4.05 531 531 A 25 LEU H A 24 ASN HA 1.0 1.8 4.08 532 532 A 29 VAL HA A 30 ARG H 1.0 1.8 3.37 533 533 A 31 GLY H A 30 ARG HA 1.0 1.8 3.90 534 534 A 41 LEU H A 40 SER HA 1.0 1.8 3.96 535 535 A 42 ARG H A 41 LEU HA 1.0 1.8 3.52 536 536 A 42 ARG HA A 43 LEU H 1.0 1.8 3.90 537 537 A 46 LEU HA A 47 ASN H 1.0 1.8 3.89 538 538 A 48 VAL H A 47 ASN HA 1.0 1.8 3.60 539 539 A 48 VAL HA A 49 GLY H 1.0 1.8 3.92 540 540 A 50 ASP HA A 51 GLU H 1.0 1.8 3.59 541 541 A 51 GLU HA A 52 ILE H 1.0 1.8 3.66 542 542 A 55 GLN H A 54 VAL HA 1.0 1.8 4.01 543 543 A 55 GLN HA A 56 ALA H 1.0 1.8 4.09 544 544 A 58 ASP HA A 59 VAL H 1.0 1.8 3.47 545 545 A 60 ARG H A 59 VAL HA 1.0 1.8 3.59 546 546 A 64 ARG H A 63 LYS HA 1.0 1.8 3.94 547 547 A 64 ARG HA A 65 GLU H 1.0 1.8 3.77 548 548 A 66 ILE H A 65 GLU HA 1.0 1.8 3.52 549 549 A 66 ILE HA A 67 ASP H 1.0 1.8 3.74 550 550 A 68 PHE H A 67 ASP HA 1.0 1.8 3.86 551 551 A 73 LEU H A 72 PRO HA 1.0 1.8 3.94 552 552 A 11 GLY HAx A 12 VAL H 1.0 1.8 3.86 553 553 A 11 GLY HAy A 12 VAL H 1.0 1.8 4.05 554 554 A 28 GLN HE21 A 27 GLU HGx 1.0 1.8 4.92 555 555 A 28 GLN HE21 A 27 GLU HGy 1.0 1.8 3.38 556 556 A 28 GLN HE22 A 27 GLU HGy 1.0 1.8 3.57 557 557 A 2 ASP H A 1 MET HBy 1.0 1.8 5.19 558 558 A 2 ASP H A 1 MET HBx 1.0 1.8 5.19 559 559 A 1 MET HE% A 2 ASP H 1.0 1.8 5.69 560 560 A 2 ASP H A 1 MET HGx 1.0 1.8 4.31 561 561 A 3 VAL HG2% A 2 ASP H 1.0 1.8 5.34 562 562 A 29 VAL HG1% A 3 VAL H 1.0 1.8 5.32 563 563 A 3 VAL H A 2 ASP HBy 1.0 1.8 4.78 564 564 A 3 VAL H A 2 ASP HBx 1.0 1.8 4.78 565 565 A 1 MET HE% A 3 VAL H 1.0 1.8 5.66 566 566 A 64 ARG H A 60 ARG H 1.0 1.8 5.74 567 567 A 7 LYS HBx A 4 GLU H 1.0 1.8 4.97 568 568 A 3 VAL HB A 4 GLU H 1.0 1.8 5.28 569 569 A 7 LYS HBy A 4 GLU H 1.0 1.8 5.60 570 570 A 60 ARG H A 66 ILE HG1y 1.0 1.8 4.58 571 571 A 59 VAL HG1% A 60 ARG H 1.0 1.8 3.96 572 572 A 60 ARG H A 59 VAL HG2% 1.0 1.8 4.76 573 573 A 3 VAL HG2% A 4 GLU H 1.0 1.8 4.72 574 574 A 7 LYS HBx A 6 GLY H 1.0 1.8 5.26 575 575 A 6 GLY H A 5 PRO HBy 1.0 1.8 4.85 576 576 A 6 GLY H A 56 ALA HB% 1.0 1.8 4.50 577 577 A 7 LYS HBy A 6 GLY H 1.0 1.8 6.33 578 578 A 6 GLY H A 59 VAL HG2% 1.0 1.8 5.73 579 579 A 7 LYS H A 56 ALA H 1.0 1.8 5.27 580 580 A 4 GLU H A 7 LYS H 1.0 1.8 5.50 581 581 A 7 LYS H A 9 TYR HDx 1.0 1.8 5.72 582 582 A 9 TYR HEx A 7 LYS H 1.0 1.8 4.86 583 583 A 5 PRO HA A 7 LYS H 1.0 1.8 4.50 584 584 A 4 GLU HBx A 7 LYS H 1.0 1.8 6.03 585 585 A 4 GLU HBy A 7 LYS H 1.0 1.8 5.32 586 586 A 3 VAL HG1% A 7 LYS H 1.0 1.8 5.52 587 587 A 12 VAL H A 24 ASN H 1.0 1.8 4.50 588 588 A 12 VAL H A 25 LEU HA 1.0 1.8 4.97 589 589 A 24 ASN HBy A 12 VAL H 1.0 1.8 5.18 590 590 A 25 LEU HD2% A 12 VAL H 1.0 1.8 4.52 591 591 A 23 ILE HG2% A 12 VAL H 1.0 1.8 4.01 592 592 A 9 TYR HEx A 8 PHE H 1.0 1.8 5.75 593 593 A 7 LYS HBx A 8 PHE H 1.0 1.8 4.69 594 594 A 7 LYS HBy A 8 PHE H 1.0 1.8 4.34 595 595 A 8 PHE H A 7 LYS HGy 1.0 1.8 5.62 596 596 A 64 ARG H A 62 GLU H 1.0 1.8 4.81 597 597 A 18 LYS H A 19 TYR HDx 1.0 1.8 4.38 598 598 A 17 GLU HBx A 18 LYS H 1.0 1.8 3.97 599 599 A 18 LYS H A 17 GLU HBy 1.0 1.8 3.80 600 600 A 18 LYS H A 17 GLU HGx 1.0 1.8 5.34 601 601 A 17 GLU HGy A 18 LYS H 1.0 1.8 5.80 602 602 A 62 GLU H A 61 PRO HDy 1.0 1.8 4.28 603 603 A 62 GLU H A 61 PRO HDx 1.0 1.8 4.70 604 604 A 62 GLU H A 60 ARG HA 1.0 1.8 5.05 605 605 A 62 GLU H A 60 ARG HBx 1.0 1.8 5.00 606 606 A 62 GLU H A 63 LYS HBy 1.0 1.8 5.42 607 607 A 62 GLU H A 63 LYS HGy 1.0 1.8 4.96 608 608 A 59 VAL HG1% A 62 GLU H 1.0 1.8 6.33 609 609 A 53 ILE HG2% A 9 TYR H 1.0 1.8 5.23 610 610 A 25 LEU HD2% A 9 TYR H 1.0 1.8 6.15 611 611 A 54 VAL HG2% A 9 TYR H 1.0 1.8 5.42 612 612 A 54 VAL H A 10 LYS H 1.0 1.8 6.33 613 613 A 9 TYR HDy A 10 LYS H 1.0 1.8 4.57 614 614 A 68 PHE HE2 A 32 LEU H 1.0 1.8 5.07 615 615 A 68 PHE HD2 A 32 LEU H 1.0 1.8 5.44 616 616 A 9 TYR HBy A 10 LYS H 1.0 1.8 4.43 617 617 A 9 TYR HBx A 10 LYS H 1.0 1.8 4.51 618 618 A 25 LEU HD2% A 10 LYS H 1.0 1.8 4.83 619 619 A 54 VAL HG2% A 10 LYS H 1.0 1.8 6.33 620 620 A 53 ILE HG2% A 10 LYS H 1.0 1.8 5.40 621 621 A 11 GLY H A 54 VAL H 1.0 1.8 4.47 622 622 A 11 GLY H A 10 LYS HBy 1.0 1.8 5.22 623 623 A 11 GLY H A 10 LYS HGy 1.0 1.8 4.99 624 624 A 10 LYS HGx A 11 GLY H 1.0 1.8 5.14 625 625 A 11 GLY H A 10 LYS HBx 1.0 1.8 5.22 626 626 A 53 ILE HG2% A 11 GLY H 1.0 1.8 5.50 627 627 A 11 GLY H A 54 VAL HG1% 1.0 1.8 6.07 628 628 A 25 LEU HD2% A 11 GLY H 1.0 1.8 4.78 629 629 A 42 ARG HBy A 44 GLU H 1.0 1.8 3.97 630 630 A 43 LEU HBx A 44 GLU H 1.0 1.8 4.21 631 631 A 43 LEU HD2% A 44 GLU H 1.0 1.8 5.14 632 632 A 46 LEU HD1% A 44 GLU H 1.0 1.8 6.33 633 633 A 46 LEU HD2% A 44 GLU H 1.0 1.8 6.33 634 634 A 42 ARG HDx A 44 GLU H 1.0 1.8 5.23 635 635 A 42 ARG HA A 44 GLU H 1.0 1.8 4.73 636 636 A 42 ARG H A 44 GLU H 1.0 1.8 5.52 637 637 A 23 ILE HD1% A 13 VAL H 1.0 1.8 5.40 638 638 A 12 VAL HB A 13 VAL H 1.0 1.8 5.00 639 639 A 13 VAL H A 14 THR HG2% 1.0 1.8 6.33 640 640 A 23 ILE HA A 14 THR H 1.0 1.8 4.82 641 641 A 13 VAL HB A 14 THR H 1.0 1.8 5.64 642 642 A 13 VAL HG2% A 14 THR H 1.0 1.8 4.61 643 643 A 13 VAL HG1% A 14 THR H 1.0 1.8 4.16 644 644 A 23 ILE HG2% A 14 THR H 1.0 1.8 5.91 645 645 A 13 VAL HA A 15 ARG H 1.0 1.8 4.67 646 646 A 23 ILE HA A 15 ARG H 1.0 1.8 5.68 647 647 A 21 ALA HA A 15 ARG H 1.0 1.8 5.85 648 648 A 22 PHE HA A 15 ARG H 1.0 1.8 6.33 649 649 A 15 ARG H A 22 PHE HBx 1.0 1.8 5.21 650 650 A 15 ARG H A 22 PHE HBy 1.0 1.8 4.72 651 651 A 13 VAL HB A 15 ARG H 1.0 1.8 6.33 652 652 A 15 ARG H A 14 THR HG2% 1.0 1.8 4.60 653 653 A 15 ARG H A 13 VAL HG1% 1.0 1.8 3.76 654 654 A 16 ILE HD1% A 15 ARG H 1.0 1.8 4.55 655 655 A 22 PHE H A 16 ILE H 1.0 1.8 6.00 656 656 A 16 ILE H A 15 ARG HDy 1.0 1.8 6.18 657 657 A 16 ILE H A 15 ARG HBy 1.0 1.8 4.58 658 658 A 16 ILE H A 15 ARG HBx 1.0 1.8 4.58 659 659 A 16 ILE H A 15 ARG HGx 1.0 1.8 4.88 660 660 A 48 VAL HG2% A 16 ILE H 1.0 1.8 4.19 661 661 A 19 TYR H A 17 GLU H 1.0 1.8 5.22 662 662 A 17 GLU H A 22 PHE H 1.0 1.8 5.40 663 663 A 21 ALA HA A 17 GLU H 1.0 1.8 4.45 664 664 A 17 GLU H A 16 ILE HB 1.0 1.8 4.68 665 665 A 21 ALA HB% A 17 GLU H 1.0 1.8 4.72 666 666 A 16 ILE HG2% A 17 GLU H 1.0 1.8 3.52 667 667 A 19 TYR H A 17 GLU HBy 1.0 1.8 4.22 668 668 A 18 LYS HBy A 19 TYR H 1.0 1.8 3.96 669 669 A 19 TYR H A 17 GLU HGx 1.0 1.8 5.54 670 670 A 17 GLU HGy A 19 TYR H 1.0 1.8 6.03 671 671 A 17 GLU HBx A 19 TYR H 1.0 1.8 4.07 672 672 A 19 TYR H A 32 LEU HD2% 1.0 1.8 6.33 673 673 A 20 GLY H A 18 LYS H 1.0 1.8 4.82 674 674 A 17 GLU H A 20 GLY H 1.0 1.8 4.36 675 675 A 18 LYS HA A 20 GLY H 1.0 1.8 4.80 676 676 A 35 PRO HDx A 20 GLY H 1.0 1.8 5.27 677 677 A 20 GLY H A 19 TYR HBy 1.0 1.8 5.27 678 678 A 20 GLY H A 19 TYR HBx 1.0 1.8 5.31 679 679 A 17 GLU HGy A 20 GLY H 1.0 1.8 6.28 680 680 A 35 PRO HGx A 20 GLY H 1.0 1.8 5.43 681 681 A 20 GLY H A 17 GLU HBy 1.0 1.8 4.39 682 682 A 21 ALA HB% A 20 GLY H 1.0 1.8 6.01 683 683 A 43 LEU HD1% A 20 GLY H 1.0 1.8 3.63 684 684 A 20 GLY H A 32 LEU HD1% 1.0 1.8 5.20 685 685 A 35 PRO HDx A 21 ALA H 1.0 1.8 5.49 686 686 A 21 ALA H A 33 LEU HBx 1.0 1.8 5.05 687 687 A 21 ALA H A 33 LEU HG 1.0 1.8 5.05 688 688 A 43 LEU HD2% A 21 ALA H 1.0 1.8 4.11 689 689 A 46 LEU HD1% A 21 ALA H 1.0 1.8 4.68 690 690 A 21 ALA H A 32 LEU HD1% 1.0 1.8 4.37 691 691 A 15 ARG H A 22 PHE H 1.0 1.8 4.72 692 692 A 16 ILE HA A 22 PHE H 1.0 1.8 4.72 693 693 A 22 PHE H A 15 ARG HBy 1.0 1.8 6.33 694 694 A 33 LEU HBx A 22 PHE H 1.0 1.8 6.33 695 695 A 22 PHE H A 15 ARG HBx 1.0 1.8 6.33 696 696 A 21 ALA HB% A 22 PHE H 1.0 1.8 4.13 697 697 A 22 PHE H A 15 ARG HGx 1.0 1.8 5.61 698 698 A 13 VAL HG1% A 22 PHE H 1.0 1.8 4.60 699 699 A 22 PHE H A 32 LEU HD1% 1.0 1.8 5.69 700 700 A 68 PHE HE2 A 23 ILE H 1.0 1.8 4.76 701 701 A 68 PHE HD2 A 23 ILE H 1.0 1.8 5.44 702 702 A 24 ASN HA A 23 ILE H 1.0 1.8 5.89 703 703 A 22 PHE HBx A 23 ILE H 1.0 1.8 5.01 704 704 A 22 PHE HBy A 23 ILE H 1.0 1.8 4.96 705 705 A 32 LEU HD1% A 23 ILE H 1.0 1.8 5.39 706 706 A 24 ASN H A 25 LEU HA 1.0 1.8 6.08 707 707 A 13 VAL HA A 24 ASN H 1.0 1.8 5.19 708 708 A 12 VAL HB A 24 ASN H 1.0 1.8 6.16 709 709 A 23 ILE HB A 24 ASN H 1.0 1.8 5.29 710 710 A 14 THR HG2% A 24 ASN H 1.0 1.8 4.39 711 711 A 23 ILE HD1% A 24 ASN H 1.0 1.8 6.06 712 712 A 23 ILE HG2% A 24 ASN H 1.0 1.8 4.30 713 713 A 12 VAL HG1% A 24 ASN H 1.0 1.8 4.69 714 714 A 12 VAL HG2% A 24 ASN H 1.0 1.8 5.78 715 715 A 28 GLN HE21 A 27 GLU HBx 1.0 1.8 4.49 716 716 A 1 MET HGx A 26 ASN HD21 1.0 1.8 6.33 717 717 A 29 VAL HG2% A 26 ASN HD21 1.0 1.8 4.52 718 718 A 29 VAL HG1% A 26 ASN HD21 1.0 1.8 6.05 719 719 A 26 ASN HD22 A 28 GLN HGx 1.0 1.8 5.60 720 720 A 26 ASN HD22 A 28 GLN HGy 1.0 1.8 6.33 721 721 A 26 ASN HD21 A 27 GLU H 1.0 1.8 5.44 722 722 A 28 GLN H A 26 ASN HD21 1.0 1.8 5.60 723 723 A 26 ASN HD22 A 27 GLU H 1.0 1.8 5.21 724 724 A 25 LEU H A 24 ASN HBx 1.0 1.8 5.53 725 725 A 25 LEU H A 24 ASN HBy 1.0 1.8 5.74 726 726 A 26 ASN H A 25 LEU H 1.0 1.8 3.81 727 727 A 26 ASN H A 29 VAL H 1.0 1.8 4.59 728 728 A 26 ASN H A 24 ASN HA 1.0 1.8 4.27 729 729 A 26 ASN H A 24 ASN HBx 1.0 1.8 4.68 730 730 A 26 ASN H A 29 VAL HB 1.0 1.8 4.40 731 731 A 26 ASN H A 25 LEU HBy 1.0 1.8 4.52 732 732 A 26 ASN H A 25 LEU HD2% 1.0 1.8 5.27 733 733 A 27 GLU H A 28 GLN HGx 1.0 1.8 6.33 734 734 A 26 ASN HBx A 27 GLU H 1.0 1.8 4.27 735 735 A 27 GLU H A 26 ASN HBy 1.0 1.8 4.62 736 736 A 28 GLN H A 26 ASN HD22 1.0 1.8 5.19 737 737 A 28 GLN H A 26 ASN HBy 1.0 1.8 5.09 738 738 A 28 GLN H A 26 ASN HBx 1.0 1.8 4.96 739 739 A 28 GLN H A 29 VAL HB 1.0 1.8 5.05 740 740 A 28 GLN H A 29 VAL HG2% 1.0 1.8 4.13 741 741 A 29 VAL H A 28 GLN HBx 1.0 1.8 4.70 742 742 A 29 VAL H A 28 GLN HGx 1.0 1.8 5.03 743 743 A 29 VAL H A 25 LEU HBy 1.0 1.8 5.93 744 744 A 29 VAL H A 30 ARG HA 1.0 1.8 6.33 745 745 A 29 VAL H A 27 GLU H 1.0 1.8 4.66 746 746 A 28 GLN HE21 A 29 VAL H 1.0 1.8 5.62 747 747 A 29 VAL H A 26 ASN HD22 1.0 1.8 5.27 748 748 A 26 ASN H A 30 ARG H 1.0 1.8 6.15 749 749 A 25 LEU HG A 30 ARG H 1.0 1.8 6.33 750 750 A 29 VAL HG1% A 30 ARG H 1.0 1.8 3.82 751 751 A 66 ILE HD1% A 30 ARG H 1.0 1.8 4.63 752 752 A 3 VAL HG2% A 30 ARG H 1.0 1.8 6.20 753 753 A 29 VAL HB A 30 ARG H 1.0 1.8 4.99 754 754 A 31 GLY H A 24 ASN H 1.0 1.8 6.04 755 755 A 68 PHE HE2 A 31 GLY H 1.0 1.8 4.26 756 756 A 31 GLY H A 30 ARG HBx 1.0 1.8 5.23 757 757 A 30 ARG HGy A 31 GLY H 1.0 1.8 4.43 758 758 A 66 ILE HB A 31 GLY H 1.0 1.8 5.44 759 759 A 29 VAL HG1% A 31 GLY H 1.0 1.8 5.22 760 760 A 25 LEU HD2% A 31 GLY H 1.0 1.8 5.60 761 761 A 23 ILE HG2% A 31 GLY H 1.0 1.8 5.97 762 762 A 31 GLY H A 66 ILE HG2% 1.0 1.8 6.33 763 763 A 66 ILE HD1% A 31 GLY H 1.0 1.8 5.65 764 764 A 33 LEU H A 23 ILE H 1.0 1.8 5.62 765 765 A 68 PHE HD2 A 33 LEU H 1.0 1.8 5.43 766 766 A 22 PHE HA A 33 LEU H 1.0 1.8 5.20 767 767 A 32 LEU HG A 33 LEU H 1.0 1.8 4.26 768 768 A 23 ILE HD1% A 33 LEU H 1.0 1.8 5.96 769 769 A 35 PRO HBy A 36 ARG H 1.0 1.8 3.91 770 770 A 35 PRO HBx A 36 ARG H 1.0 1.8 4.89 771 771 A 35 PRO HGy A 36 ARG H 1.0 1.8 4.70 772 772 A 43 LEU HD1% A 36 ARG H 1.0 1.8 5.98 773 773 A 35 PRO HDy A 36 ARG H 1.0 1.8 5.07 774 774 A 35 PRO HDx A 36 ARG H 1.0 1.8 5.37 775 775 A 37 ASP H A 36 ARG HBy 1.0 1.8 4.73 776 776 A 37 ASP H A 36 ARG HBx 1.0 1.8 4.73 777 777 A 36 ARG HGy A 37 ASP H 1.0 1.8 5.14 778 778 A 33 LEU HD1% A 37 ASP H 1.0 1.8 4.76 779 779 A 36 ARG H A 38 MET H 1.0 1.8 4.88 780 780 A 35 PRO HA A 38 MET H 1.0 1.8 4.68 781 781 A 36 ARG HA A 38 MET H 1.0 1.8 4.91 782 782 A 38 MET H A 37 ASP HBy 1.0 1.8 5.44 783 783 A 38 MET H A 37 ASP HBx 1.0 1.8 5.44 784 784 A 33 LEU HD1% A 38 MET H 1.0 1.8 4.76 785 785 A 53 ILE HG2% A 54 VAL H 1.0 1.8 4.21 786 786 A 23 ILE HD1% A 54 VAL H 1.0 1.8 5.95 787 787 A 52 ILE HG2% A 54 VAL H 1.0 1.8 6.26 788 788 A 10 LYS HA A 54 VAL H 1.0 1.8 4.70 789 789 A 54 VAL H A 9 TYR H 1.0 1.8 5.24 790 790 A 40 SER H A 39 ILE HB 1.0 1.8 4.96 791 791 A 40 SER H A 39 ILE HG1y 1.0 1.8 5.08 792 792 A 39 ILE HG2% A 40 SER H 1.0 1.8 3.80 793 793 A 41 LEU H A 39 ILE H 1.0 1.8 5.05 794 794 A 41 LEU H A 70 TYR HDy 1.0 1.8 5.60 795 795 A 41 LEU H A 40 SER HBx 1.0 1.8 4.93 796 796 A 41 LEU H A 38 MET HE% 1.0 1.8 4.28 797 797 A 41 LEU H A 42 ARG HGy 1.0 1.8 5.77 798 798 A 42 ARG H A 41 LEU HBx 1.0 1.8 3.96 799 799 A 42 ARG H A 41 LEU HBy 1.0 1.8 5.05 800 800 A 46 LEU HD2% A 42 ARG H 1.0 1.8 4.13 801 801 A 42 ARG H A 41 LEU HD2% 1.0 1.8 4.65 802 802 A 42 ARG H A 45 ASN HBx 1.0 1.8 5.58 803 803 A 42 ARG H A 45 ASN HBy 1.0 1.8 4.68 804 804 A 42 ARG H A 45 ASN HD21 1.0 1.8 5.23 805 805 A 44 GLU HA A 43 LEU H 1.0 1.8 6.24 806 806 A 42 ARG HDx A 43 LEU H 1.0 1.8 5.18 807 807 A 42 ARG HBx A 43 LEU H 1.0 1.8 4.30 808 808 A 35 PRO HGx A 43 LEU H 1.0 1.8 5.57 809 809 A 46 LEU HD1% A 43 LEU H 1.0 1.8 4.96 810 810 A 45 ASN H A 43 LEU H 1.0 1.8 5.13 811 811 A 42 ARG H A 45 ASN H 1.0 1.8 4.76 812 812 A 46 LEU HA A 45 ASN H 1.0 1.8 5.65 813 813 A 43 LEU HA A 45 ASN H 1.0 1.8 5.13 814 814 A 44 GLU HBx A 45 ASN H 1.0 1.8 4.34 815 815 A 46 LEU HG A 45 ASN H 1.0 1.8 4.05 816 816 A 16 ILE HG2% A 45 ASN H 1.0 1.8 6.33 817 817 A 43 LEU HD2% A 45 ASN H 1.0 1.8 6.33 818 818 A 46 LEU HD2% A 45 ASN H 1.0 1.8 4.60 819 819 A 44 GLU HBx A 45 ASN HD21 1.0 1.8 5.22 820 820 A 46 LEU HD2% A 45 ASN HD21 1.0 1.8 4.66 821 821 A 42 ARG HGy A 45 ASN HD21 1.0 1.8 5.19 822 822 A 42 ARG HBy A 45 ASN HD21 1.0 1.8 5.35 823 823 A 45 ASN HD22 A 42 ARG HGy 1.0 1.8 5.19 824 824 A 45 ASN HD22 A 42 ARG HBy 1.0 1.8 5.08 825 825 A 48 VAL H A 47 ASN HBy 1.0 1.8 4.26 826 826 A 48 VAL H A 47 ASN HBx 1.0 1.8 4.26 827 827 A 49 GLY HAx A 48 VAL H 1.0 1.8 6.33 828 828 A 50 ASP H A 48 VAL H 1.0 1.8 5.70 829 829 A 49 GLY H A 13 VAL H 1.0 1.8 5.27 830 830 A 14 THR HA A 49 GLY H 1.0 1.8 5.14 831 831 A 13 VAL HB A 49 GLY H 1.0 1.8 4.68 832 832 A 49 GLY H A 48 VAL HB 1.0 1.8 5.15 833 833 A 48 VAL HG1% A 49 GLY H 1.0 1.8 3.65 834 834 A 13 VAL HG1% A 49 GLY H 1.0 1.8 4.06 835 835 A 50 ASP H A 13 VAL H 1.0 1.8 4.59 836 836 A 50 ASP H A 47 ASN H 1.0 1.8 5.34 837 837 A 13 VAL HB A 50 ASP H 1.0 1.8 3.99 838 838 A 50 ASP H A 48 VAL HB 1.0 1.8 6.33 839 839 A 48 VAL HA A 50 ASP H 1.0 1.8 4.24 840 840 A 13 VAL HG1% A 50 ASP H 1.0 1.8 4.20 841 841 A 50 ASP HBy A 51 GLU H 1.0 1.8 4.78 842 842 A 50 ASP HBx A 51 GLU H 1.0 1.8 5.35 843 843 A 12 VAL HG2% A 52 ILE H 1.0 1.8 4.67 844 844 A 23 ILE HG2% A 52 ILE H 1.0 1.8 5.12 845 845 A 52 ILE H A 51 GLU HGy 1.0 1.8 5.04 846 846 A 52 ILE H A 54 VAL HG1% 1.0 1.8 5.85 847 847 A 52 ILE H A 11 GLY H 1.0 1.8 5.09 848 848 A 53 ILE H A 54 VAL HG1% 1.0 1.8 4.98 849 849 A 52 ILE HG2% A 53 ILE H 1.0 1.8 5.00 850 850 A 54 VAL HG2% A 55 GLN H 1.0 1.8 4.74 851 851 A 54 VAL HG1% A 55 GLN H 1.0 1.8 4.49 852 852 A 55 GLN H A 56 ALA H 1.0 1.8 5.53 853 853 A 55 GLN HE21 A 8 PHE HEx 1.0 1.8 5.53 854 854 A 8 PHE HEx A 55 GLN HE22 1.0 1.8 5.53 855 855 A 55 GLN HE21 A 8 PHE HDx 1.0 1.8 6.33 856 856 A 55 GLN HE22 A 8 PHE HDx 1.0 1.8 6.33 857 857 A 55 GLN HE21 A 6 GLY HAy 1.0 1.8 5.77 858 858 A 55 GLN HE22 A 6 GLY HAy 1.0 1.8 5.77 859 859 A 55 GLN HE22 A 6 GLY HAx 1.0 1.8 5.77 860 860 A 55 GLN HE21 A 6 GLY HAx 1.0 1.8 5.77 861 861 A 71 ILE HD1% A 55 GLN HE22 1.0 1.8 6.33 862 862 A 56 ALA H A 55 GLN HGx 1.0 1.8 4.72 863 863 A 57 ILE HG1x A 56 ALA H 1.0 1.8 6.33 864 864 A 56 ALA H A 55 GLN HGy 1.0 1.8 4.72 865 865 A 8 PHE HA A 56 ALA H 1.0 1.8 4.82 866 866 A 56 ALA H A 9 TYR HDx 1.0 1.8 4.75 867 867 A 9 TYR HEx A 56 ALA H 1.0 1.8 5.82 868 868 A 57 ILE H A 56 ALA H 1.0 1.8 5.42 869 869 A 9 TYR H A 56 ALA H 1.0 1.8 5.66 870 870 A 6 GLY H A 56 ALA H 1.0 1.8 5.32 871 871 A 6 GLY H A 57 ILE H 1.0 1.8 5.92 872 872 A 57 ILE H A 68 PHE HA 1.0 1.8 5.01 873 873 A 58 ASP HBx A 57 ILE H 1.0 1.8 6.14 874 874 A 56 ALA HB% A 57 ILE H 1.0 1.8 4.23 875 875 A 66 ILE HG2% A 58 ASP H 1.0 1.8 4.91 876 876 A 57 ILE HG1x A 58 ASP H 1.0 1.8 4.58 877 877 A 59 VAL HG2% A 58 ASP H 1.0 1.8 4.61 878 878 A 56 ALA HB% A 58 ASP H 1.0 1.8 4.60 879 879 A 57 ILE HB A 58 ASP H 1.0 1.8 4.20 880 880 A 66 ILE HA A 58 ASP H 1.0 1.8 5.87 881 881 A 67 ASP H A 58 ASP H 1.0 1.8 4.55 882 882 A 58 ASP H A 68 PHE HA 1.0 1.8 6.33 883 883 A 5 PRO HGx A 59 VAL H 1.0 1.8 4.93 884 884 A 5 PRO HBx A 59 VAL H 1.0 1.8 5.27 885 885 A 58 ASP HBy A 59 VAL H 1.0 1.8 3.85 886 886 A 5 PRO HDx A 59 VAL H 1.0 1.8 5.36 887 887 A 63 LYS H A 64 ARG HA 1.0 1.8 5.31 888 888 A 63 LYS H A 60 ARG HBx 1.0 1.8 4.85 889 889 A 63 LYS H A 60 ARG HBy 1.0 1.8 5.45 890 890 A 63 LYS H A 64 ARG HGx 1.0 1.8 4.82 891 891 A 63 LYS H A 62 GLU HGx 1.0 1.8 5.15 892 892 A 64 ARG H A 63 LYS HGy 1.0 1.8 5.38 893 893 A 64 ARG H A 62 GLU HA 1.0 1.8 4.95 894 894 A 60 ARG H A 65 GLU H 1.0 1.8 4.66 895 895 A 65 GLU H A 64 ARG HBx 1.0 1.8 5.19 896 896 A 59 VAL HG1% A 65 GLU H 1.0 1.8 5.69 897 897 A 65 GLU H A 66 ILE HG1x 1.0 1.8 6.12 898 898 A 66 ILE H A 65 GLU HBx 1.0 1.8 4.50 899 899 A 65 GLU HBy A 66 ILE H 1.0 1.8 4.60 900 900 A 65 GLU HGx A 66 ILE H 1.0 1.8 5.69 901 901 A 66 ILE H A 65 GLU HGy 1.0 1.8 4.84 902 902 A 67 ASP H A 57 ILE H 1.0 1.8 5.44 903 903 A 56 ALA HA A 67 ASP H 1.0 1.8 5.61 904 904 A 57 ILE HB A 67 ASP H 1.0 1.8 5.68 905 905 A 66 ILE HB A 67 ASP H 1.0 1.8 5.08 906 906 A 66 ILE HG2% A 67 ASP H 1.0 1.8 3.94 907 907 A 68 PHE H A 57 ILE H 1.0 1.8 5.89 908 908 A 68 PHE H A 33 LEU HBy 1.0 1.8 5.54 909 909 A 32 LEU HG A 68 PHE H 1.0 1.8 6.33 910 910 A 68 PHE H A 57 ILE HD1% 1.0 1.8 4.86 911 911 A 33 LEU HD2% A 68 PHE H 1.0 1.8 6.33 912 912 A 57 ILE HG1x A 68 PHE H 1.0 1.8 5.46 913 913 A 66 ILE HG2% A 68 PHE H 1.0 1.8 5.77 914 914 A 55 GLN H A 69 LYS H 1.0 1.8 4.65 915 915 A 55 GLN HA A 69 LYS H 1.0 1.8 5.93 916 916 A 56 ALA HA A 69 LYS H 1.0 1.8 6.33 917 917 A 69 LYS H A 68 PHE HBy 1.0 1.8 5.14 918 918 A 69 LYS H A 68 PHE HBx 1.0 1.8 5.14 919 919 A 33 LEU HD1% A 69 LYS H 1.0 1.8 4.32 920 920 A 33 LEU HD2% A 69 LYS H 1.0 1.8 5.53 921 921 A 54 VAL HG2% A 69 LYS H 1.0 1.8 5.62 922 922 A 54 VAL HG1% A 69 LYS H 1.0 1.8 4.40 923 923 A 33 LEU HD2% A 70 TYR H 1.0 1.8 5.09 924 924 A 33 LEU HD1% A 70 TYR H 1.0 1.8 4.21 925 925 A 70 TYR H A 69 LYS HGx 1.0 1.8 5.03 926 926 A 70 TYR H A 69 LYS HGy 1.0 1.8 5.03 927 927 A 70 TYR H A 69 LYS HDx 1.0 1.8 5.21 928 928 A 70 TYR H A 39 ILE H 1.0 1.8 6.10 929 929 A 46 LEU H A 43 LEU H 1.0 1.8 5.82 930 930 A 46 LEU H A 44 GLU H 1.0 1.8 5.01 931 931 A 43 LEU HA A 46 LEU H 1.0 1.8 4.85 932 932 A 46 LEU H A 45 ASN HBy 1.0 1.8 4.63 933 933 A 46 LEU H A 45 ASN HBx 1.0 1.8 4.53 934 934 A 46 LEU H A 41 LEU HBx 1.0 1.8 5.72 935 935 A 16 ILE HG2% A 46 LEU H 1.0 1.8 5.78 936 936 A 46 LEU H A 43 LEU HD2% 1.0 1.8 6.13 937 937 A 46 LEU H A 41 LEU HD2% 1.0 1.8 5.44 938 938 A 69 LYS H A 68 PHE HD1 1.0 1.8 4.73 939 939 A 22 PHE HDx A 16 ILE H 1.0 1.8 6.33 940 940 A 33 LEU HBx A 34 ARG H 1.0 1.8 5.34 941 941 A 33 LEU HG A 34 ARG H 1.0 1.8 5.40 942 942 A 32 LEU HG A 34 ARG H 1.0 1.8 5.52 943 943 A 33 LEU HD1% A 34 ARG H 1.0 1.8 4.80 944 944 A 33 LEU HD2% A 34 ARG H 1.0 1.8 5.62 945 945 A 56 ALA HA A 68 PHE H 1.0 1.8 6.33 946 946 A 68 PHE H A 34 ARG H 1.0 1.8 5.83 947 947 A 38 MET HE% A 70 TYR HDy 1.0 1.8 4.29 948 948 A 22 PHE HDy A 23 ILE H 1.0 1.8 4.86 949 949 A 21 ALA HA A 22 PHE HDx 1.0 1.8 5.57 950 950 A 32 LEU HA A 22 PHE HDy 1.0 1.8 5.24 951 951 A 22 PHE HDx A 17 GLU HGx 1.0 1.8 4.96 952 952 A 30 ARG HGy A 22 PHE HDy 1.0 1.8 4.52 953 953 A 22 PHE HDx A 15 ARG HGx 1.0 1.8 5.15 954 954 A 7 LYS HBy A 9 TYR HDx 1.0 1.8 4.92 955 955 A 56 ALA HB% A 9 TYR HDx 1.0 1.8 4.49 956 956 A 3 VAL HG1% A 9 TYR HDx 1.0 1.8 4.70 957 957 A 40 SER H A 70 TYR HDx 1.0 1.8 5.78 958 958 A 70 TYR HDx A 39 ILE H 1.0 1.8 4.90 959 959 A 70 TYR HDy A 39 ILE H 1.0 1.8 5.36 960 960 A 70 TYR HDx A 71 ILE H 1.0 1.8 4.90 961 961 A 70 TYR HDy A 41 LEU HBx 1.0 1.8 5.18 962 962 A 39 ILE HG2% A 70 TYR HDx 1.0 1.8 4.45 963 963 A 54 VAL HG1% A 70 TYR HDy 1.0 1.8 4.51 964 964 A 52 ILE HG2% A 70 TYR HDy 1.0 1.8 4.14 965 965 A 52 ILE HD1% A 70 TYR HDy 1.0 1.8 4.35 966 966 A 32 LEU H A 22 PHE HEx 1.0 1.8 6.07 967 967 A 17 GLU HGy A 22 PHE HEy 1.0 1.8 5.31 968 968 A 22 PHE HEy A 32 LEU HD2% 1.0 1.8 5.68 969 969 A 18 LYS H A 19 TYR HEy 1.0 1.8 5.12 970 970 A 40 SER H A 70 TYR HEx 1.0 1.8 5.43 971 971 A 53 ILE H A 70 TYR HEy 1.0 1.8 6.33 972 972 A 41 LEU H A 70 TYR HEy 1.0 1.8 5.46 973 973 A 19 TYR HEx A 22 PHE HZ 1.0 1.8 4.13 974 974 A 9 TYR HEx A 7 LYS HBx 1.0 1.8 3.99 975 975 A 17 GLU HGx A 19 TYR HEx 1.0 1.8 4.60 976 976 A 9 TYR HEx A 7 LYS HBy 1.0 1.8 3.93 977 977 A 41 LEU HG A 70 TYR HEy 1.0 1.8 4.51 978 978 A 39 ILE HG2% A 70 TYR HEx 1.0 1.8 4.72 979 979 A 32 LEU HD2% A 19 TYR HEx 1.0 1.8 3.69 980 980 A 9 TYR HEx A 3 VAL HG1% 1.0 1.8 4.01 981 981 A 32 LEU HD1% A 19 TYR HEx 1.0 1.8 3.84 982 982 A 17 GLU HGx A 19 TYR HDy 1.0 1.8 5.69 983 983 A 18 LYS HBy A 19 TYR HDx 1.0 1.8 4.21 984 984 A 17 GLU HBy A 19 TYR HDy 1.0 1.8 4.61 985 985 A 32 LEU HG A 19 TYR HDy 1.0 1.8 5.42 986 986 A 32 LEU HD2% A 19 TYR HDy 1.0 1.8 3.80 987 987 A 32 LEU HD1% A 19 TYR HDy 1.0 1.8 4.08 988 988 A 22 PHE HZ A 19 TYR HDy 1.0 1.8 5.82 989 989 A 32 LEU HA A 22 PHE HZ 1.0 1.8 6.33 990 990 A 32 LEU HD2% A 22 PHE HZ 1.0 1.8 5.00 991 991 A 32 LEU HD1% A 22 PHE HZ 1.0 1.8 5.07 992 992 A 8 PHE HZ A 71 ILE HD1% 1.0 1.8 3.94 993 993 A 8 PHE HEy A 71 ILE HG1y 1.0 1.8 5.64 994 994 A 53 ILE HG2% A 8 PHE HDy 1.0 1.8 4.49 995 995 A 18 LYS HBy A 19 TYR HEy 1.0 1.8 5.22 996 996 A 70 TYR HDx A 39 ILE HB 1.0 1.8 4.88 997 997 A 38 MET HGx A 70 TYR HDy 1.0 1.8 6.03 998 998 A 17 GLU HBx A 19 TYR HDx 1.0 1.8 4.42 999 999 A 25 LEU HD1% A 9 TYR HDx 1.0 1.8 4.00 1000 1000 A 29 VAL HG1% A 68 PHE HZ 1.0 1.8 4.84 1001 1001 A 25 LEU HD1% A 68 PHE HZ 1.0 1.8 4.11 1002 1002 A 25 LEU HD2% A 68 PHE HZ 1.0 1.8 4.66 1003 1003 A 23 ILE HB A 68 PHE HZ 1.0 1.8 5.34 1004 1004 A 25 LEU H A 68 PHE HZ 1.0 1.8 5.73 1005 1005 A 31 GLY H A 68 PHE HZ 1.0 1.8 5.99 1006 1006 A 18 LYS HGx A 19 TYR HDx 1.0 1.8 5.76 1007 1007 A 1 MET HA A 2 ASP HBx 1.0 1.8 4.75 1008 1007 A 1 MET HA A 2 ASP HBy 1.0 1.8 4.75 1009 1008 A 2 ASP H A 1 MET HBx 1.0 1.8 4.32 1010 1008 A 2 ASP H A 1 MET HBy 1.0 1.8 4.32 1011 1009 A 3 VAL HG2% A 1 MET HBx 1.0 1.8 5.59 1012 1009 A 3 VAL HG2% A 1 MET HBy 1.0 1.8 5.59 1013 1010 A 26 ASN HD21 A 1 MET HBx 1.0 1.8 4.77 1014 1010 A 26 ASN HD21 A 1 MET HBy 1.0 1.8 4.77 1015 1011 A 26 ASN HD22 A 1 MET HBx 1.0 1.8 4.51 1016 1011 A 26 ASN HD22 A 1 MET HBy 1.0 1.8 4.51 1017 1012 A 29 VAL HG2% A 1 MET HBx 1.0 1.8 5.51 1018 1012 A 29 VAL HG2% A 1 MET HBy 1.0 1.8 5.51 1019 1013 A 3 VAL H A 2 ASP HBx 1.0 1.8 4.15 1020 1013 A 3 VAL H A 2 ASP HBy 1.0 1.8 4.15 1021 1014 A 4 GLU HBx A 7 LYS HGy 1.0 1.8 5.27 1022 1014 A 4 GLU HBx A 7 LYS HGx 1.0 1.8 5.27 1023 1015 A 4 GLU HBx A 7 LYS HEx 1.0 1.8 5.05 1024 1015 A 4 GLU HBx A 7 LYS HEy 1.0 1.8 5.05 1025 1016 A 4 GLU HGy A 7 LYS HGy 1.0 1.8 5.89 1026 1016 A 4 GLU HGy A 7 LYS HGx 1.0 1.8 5.89 1027 1017 A 5 PRO HA A 6 GLY HAx 1.0 1.8 5.06 1028 1017 A 5 PRO HA A 6 GLY HAy 1.0 1.8 5.06 1029 1018 A 6 GLY H A 55 GLN HGx 1.0 1.8 5.44 1030 1018 A 6 GLY H A 55 GLN HGy 1.0 1.8 5.44 1031 1019 A 6 GLY H A 55 GLN HE21 1.0 1.8 6.14 1032 1019 A 6 GLY H A 55 GLN HE22 1.0 1.8 6.14 1033 1020 A 55 GLN HE21 A 6 GLY HAy 1.0 1.8 4.19 1034 1020 A 55 GLN HE22 A 6 GLY HAy 1.0 1.8 4.19 1035 1020 A 55 GLN HE22 A 6 GLY HAx 1.0 1.8 4.19 1036 1020 A 55 GLN HE21 A 6 GLY HAx 1.0 1.8 4.19 1037 1021 A 7 LYS H A 55 GLN HGx 1.0 1.8 5.44 1038 1021 A 7 LYS H A 55 GLN HGy 1.0 1.8 5.44 1039 1022 A 9 TYR HEx A 7 LYS HGy 1.0 1.8 5.35 1040 1022 A 9 TYR HEx A 7 LYS HGx 1.0 1.8 5.35 1041 1023 A 8 PHE H A 7 LYS HDy 1.0 1.8 4.82 1042 1023 A 8 PHE H A 7 LYS HDx 1.0 1.8 4.82 1043 1024 A 9 TYR HEx A 7 LYS HDy 1.0 1.8 5.66 1044 1024 A 9 TYR HEx A 7 LYS HDx 1.0 1.8 5.66 1045 1025 A 8 PHE H A 7 LYS HEx 1.0 1.8 6.14 1046 1025 A 8 PHE H A 7 LYS HEy 1.0 1.8 6.14 1047 1026 A 8 PHE HDx A 55 GLN HGx 1.0 1.8 5.44 1048 1026 A 8 PHE HDx A 55 GLN HGy 1.0 1.8 5.44 1049 1027 A 55 GLN HE21 A 8 PHE HDx 1.0 1.8 5.58 1050 1027 A 55 GLN HE22 A 8 PHE HDx 1.0 1.8 5.58 1051 1028 A 8 PHE HZ A 55 GLN HE21 1.0 1.8 4.99 1052 1028 A 8 PHE HZ A 55 GLN HE22 1.0 1.8 4.99 1053 1029 A 11 GLY H A 10 LYS HEx 1.0 1.8 5.92 1054 1029 A 11 GLY H A 10 LYS HEy 1.0 1.8 5.92 1055 1030 A 12 VAL HG2% A 51 GLU HBy 1.0 1.8 4.75 1056 1030 A 12 VAL HG2% A 51 GLU HBx 1.0 1.8 4.75 1057 1031 A 13 VAL H A 23 ILE HG1y 1.0 1.8 6.14 1058 1031 A 13 VAL H A 23 ILE HG1x 1.0 1.8 6.14 1059 1032 A 13 VAL HA A 23 ILE HG1y 1.0 1.8 5.08 1060 1032 A 13 VAL HA A 23 ILE HG1x 1.0 1.8 5.08 1061 1033 A 13 VAL HG1% A 16 ILE HG1x 1.0 1.8 4.47 1062 1033 A 13 VAL HG1% A 16 ILE HG1y 1.0 1.8 4.47 1063 1034 A 13 VAL HG1% A 46 LEU HBy 1.0 1.8 5.43 1064 1034 A 13 VAL HG1% A 46 LEU HBx 1.0 1.8 5.43 1065 1035 A 13 VAL HG2% A 23 ILE HG1y 1.0 1.8 3.86 1066 1035 A 13 VAL HG2% A 23 ILE HG1x 1.0 1.8 3.86 1067 1036 A 14 THR HB A 24 ASN HD21 1.0 1.8 6.14 1068 1036 A 14 THR HB A 24 ASN HD22 1.0 1.8 6.14 1069 1037 A 14 THR HG2% A 24 ASN HD21 1.0 1.8 4.40 1070 1037 A 14 THR HG2% A 24 ASN HD22 1.0 1.8 4.40 1071 1038 A 15 ARG HA A 16 ILE HG1x 1.0 1.8 5.80 1072 1038 A 15 ARG HA A 16 ILE HG1y 1.0 1.8 5.80 1073 1039 A 16 ILE H A 15 ARG HBx 1.0 1.8 3.75 1074 1039 A 16 ILE H A 15 ARG HBy 1.0 1.8 3.75 1075 1040 A 22 PHE H A 15 ARG HBx 1.0 1.8 5.37 1076 1040 A 22 PHE H A 15 ARG HBy 1.0 1.8 5.37 1077 1041 A 22 PHE HBy A 15 ARG HBx 1.0 1.8 5.38 1078 1041 A 22 PHE HBy A 15 ARG HBy 1.0 1.8 5.38 1079 1042 A 22 PHE HDx A 15 ARG HBx 1.0 1.8 6.03 1080 1042 A 22 PHE HDx A 15 ARG HBy 1.0 1.8 6.03 1081 1043 A 16 ILE H A 15 ARG HDx 1.0 1.8 5.35 1082 1043 A 16 ILE H A 15 ARG HDy 1.0 1.8 5.35 1083 1044 A 16 ILE HG2% A 46 LEU HBy 1.0 1.8 5.69 1084 1044 A 16 ILE HG2% A 46 LEU HBx 1.0 1.8 5.69 1085 1045 A 17 GLU H A 16 ILE HG1x 1.0 1.8 5.78 1086 1045 A 17 GLU H A 16 ILE HG1y 1.0 1.8 5.78 1087 1046 A 48 VAL H A 16 ILE HG1x 1.0 1.8 4.92 1088 1046 A 48 VAL H A 16 ILE HG1y 1.0 1.8 4.92 1089 1047 A 48 VAL HG2% A 16 ILE HG1x 1.0 1.8 4.15 1090 1047 A 48 VAL HG2% A 16 ILE HG1y 1.0 1.8 4.15 1091 1048 A 16 ILE HD1% A 46 LEU HBy 1.0 1.8 4.04 1092 1048 A 16 ILE HD1% A 46 LEU HBx 1.0 1.8 4.04 1093 1049 A 16 ILE HD1% A 47 ASN HBx 1.0 1.8 5.59 1094 1049 A 16 ILE HD1% A 47 ASN HBy 1.0 1.8 5.59 1095 1050 A 22 PHE HA A 23 ILE HG1y 1.0 1.8 5.36 1096 1050 A 22 PHE HA A 23 ILE HG1x 1.0 1.8 5.36 1097 1051 A 22 PHE HEx A 32 LEU HBy 1.0 1.8 5.29 1098 1051 A 22 PHE HEx A 32 LEU HBx 1.0 1.8 5.29 1099 1052 A 22 PHE HDy A 32 LEU HBy 1.0 1.8 5.60 1100 1052 A 22 PHE HDy A 32 LEU HBx 1.0 1.8 5.60 1101 1053 A 31 GLY H A 30 ARG HBx 1.0 1.8 4.36 1102 1053 A 31 GLY H A 30 ARG HBy 1.0 1.8 4.36 1103 1054 A 31 GLY H A 30 ARG HDy 1.0 1.8 5.58 1104 1054 A 31 GLY H A 30 ARG HDx 1.0 1.8 5.58 1105 1055 A 32 LEU H A 31 GLY HAy 1.0 1.8 3.57 1106 1055 A 32 LEU H A 31 GLY HAx 1.0 1.8 3.57 1107 1056 A 66 ILE H A 31 GLY HAy 1.0 1.8 4.90 1108 1056 A 66 ILE H A 31 GLY HAx 1.0 1.8 4.90 1109 1057 A 66 ILE HB A 31 GLY HAy 1.0 1.8 4.63 1110 1057 A 66 ILE HB A 31 GLY HAx 1.0 1.8 4.63 1111 1058 A 66 ILE HG2% A 31 GLY HAy 1.0 1.8 5.20 1112 1058 A 66 ILE HG2% A 31 GLY HAx 1.0 1.8 5.20 1113 1059 A 66 ILE HD1% A 31 GLY HAy 1.0 1.8 4.84 1114 1059 A 66 ILE HD1% A 31 GLY HAx 1.0 1.8 4.84 1115 1060 A 33 LEU HD1% A 69 LYS HBy 1.0 1.8 5.37 1116 1060 A 33 LEU HD1% A 69 LYS HBx 1.0 1.8 5.37 1117 1061 A 38 MET H A 37 ASP HBx 1.0 1.8 4.49 1118 1061 A 38 MET H A 37 ASP HBy 1.0 1.8 4.49 1119 1062 A 39 ILE HG2% A 40 SER HBy 1.0 1.8 4.07 1120 1062 A 39 ILE HG2% A 40 SER HBx 1.0 1.8 4.07 1121 1063 A 40 SER H A 39 ILE HG1x 1.0 1.8 4.44 1122 1063 A 40 SER H A 39 ILE HG1y 1.0 1.8 4.44 1123 1064 A 70 TYR H A 39 ILE HG1x 1.0 1.8 5.84 1124 1064 A 70 TYR H A 39 ILE HG1y 1.0 1.8 5.84 1125 1065 A 70 TYR HBy A 39 ILE HG1x 1.0 1.8 3.88 1126 1065 A 70 TYR HBy A 39 ILE HG1y 1.0 1.8 3.88 1127 1066 A 41 LEU H A 40 SER HBy 1.0 1.8 4.27 1128 1066 A 41 LEU H A 40 SER HBx 1.0 1.8 4.27 1129 1067 A 43 LEU HD2% A 46 LEU HBy 1.0 1.8 5.70 1130 1067 A 43 LEU HD2% A 46 LEU HBx 1.0 1.8 5.70 1131 1068 A 48 VAL H A 47 ASN HBx 1.0 1.8 3.68 1132 1068 A 48 VAL H A 47 ASN HBy 1.0 1.8 3.68 1133 1069 A 48 VAL HG2% A 47 ASN HBx 1.0 1.8 5.16 1134 1069 A 48 VAL HG2% A 47 ASN HBy 1.0 1.8 5.16 1135 1070 A 52 ILE H A 51 GLU HBy 1.0 1.8 4.13 1136 1070 A 52 ILE H A 51 GLU HBx 1.0 1.8 4.13 1137 1071 A 54 VAL HG1% A 68 PHE HBx 1.0 1.8 4.70 1138 1071 A 54 VAL HG1% A 68 PHE HBy 1.0 1.8 4.70 1139 1072 A 54 VAL HG2% A 68 PHE HBx 1.0 1.8 5.67 1140 1072 A 54 VAL HG2% A 68 PHE HBy 1.0 1.8 5.67 1141 1073 A 55 GLN H A 69 LYS HBy 1.0 1.8 4.88 1142 1073 A 55 GLN H A 69 LYS HBx 1.0 1.8 4.88 1143 1074 A 56 ALA H A 55 GLN HBy 1.0 1.8 4.84 1144 1074 A 56 ALA H A 55 GLN HBx 1.0 1.8 4.84 1145 1075 A 55 GLN HE21 A 56 ALA H 1.0 1.8 6.14 1146 1075 A 56 ALA H A 55 GLN HE22 1.0 1.8 6.14 1147 1076 A 71 ILE HG2% A 55 GLN HE21 1.0 1.8 5.99 1148 1076 A 71 ILE HG2% A 55 GLN HE22 1.0 1.8 5.99 1149 1077 A 71 ILE HD1% A 55 GLN HE21 1.0 1.8 5.36 1150 1077 A 71 ILE HD1% A 55 GLN HE22 1.0 1.8 5.36 1151 1078 A 57 ILE H A 67 ASP HBx 1.0 1.8 5.57 1152 1078 A 57 ILE H A 67 ASP HBy 1.0 1.8 5.57 1153 1079 A 57 ILE HB A 67 ASP HBx 1.0 1.8 4.62 1154 1079 A 57 ILE HB A 67 ASP HBy 1.0 1.8 4.62 1155 1080 A 57 ILE HG2% A 67 ASP HBx 1.0 1.8 5.16 1156 1080 A 57 ILE HG2% A 67 ASP HBy 1.0 1.8 5.16 1157 1081 A 57 ILE HG2% A 69 LYS HBy 1.0 1.8 5.80 1158 1081 A 57 ILE HG2% A 69 LYS HBx 1.0 1.8 5.80 1159 1082 A 57 ILE HG2% A 69 LYS HEy 1.0 1.8 6.14 1160 1082 A 57 ILE HG2% A 69 LYS HEx 1.0 1.8 6.14 1161 1083 A 57 ILE HG1y A 67 ASP HBx 1.0 1.8 5.97 1162 1083 A 67 ASP HBy A 57 ILE HG1y 1.0 1.8 5.97 1163 1084 A 57 ILE HG1y A 69 LYS HBy 1.0 1.8 4.89 1164 1084 A 69 LYS HBx A 57 ILE HG1y 1.0 1.8 4.89 1165 1085 A 57 ILE HG1y A 69 LYS HEy 1.0 1.8 5.59 1166 1085 A 69 LYS HEx A 57 ILE HG1y 1.0 1.8 5.59 1167 1086 A 57 ILE HG1x A 67 ASP HBx 1.0 1.8 5.24 1168 1086 A 57 ILE HG1x A 67 ASP HBy 1.0 1.8 5.24 1169 1087 A 57 ILE HD1% A 67 ASP HBx 1.0 1.8 4.31 1170 1087 A 57 ILE HD1% A 67 ASP HBy 1.0 1.8 4.31 1171 1088 A 57 ILE HD1% A 69 LYS HBy 1.0 1.8 4.14 1172 1088 A 57 ILE HD1% A 69 LYS HBx 1.0 1.8 4.14 1173 1089 A 57 ILE HD1% A 69 LYS HEy 1.0 1.8 4.70 1174 1089 A 57 ILE HD1% A 69 LYS HEx 1.0 1.8 4.70 1175 1090 A 58 ASP H A 67 ASP HBx 1.0 1.8 4.44 1176 1090 A 58 ASP H A 67 ASP HBy 1.0 1.8 4.44 1177 1091 A 63 LYS HGx A 60 ARG HDy 1.0 1.8 4.69 1178 1091 A 63 LYS HGx A 60 ARG HDx 1.0 1.8 4.69 1179 1092 A 62 GLU H A 61 PRO HBx 1.0 1.8 4.36 1180 1092 A 62 GLU H A 61 PRO HBy 1.0 1.8 4.36 1181 1093 A 63 LYS H A 62 GLU HGy 1.0 1.8 4.37 1182 1093 A 63 LYS H A 62 GLU HGx 1.0 1.8 4.37 1183 1094 A 63 LYS HBy A 62 GLU HGy 1.0 1.8 5.37 1184 1094 A 63 LYS HBy A 62 GLU HGx 1.0 1.8 5.37 1185 1095 A 63 LYS HGy A 62 GLU HGy 1.0 1.8 4.86 1186 1095 A 63 LYS HGy A 62 GLU HGx 1.0 1.8 4.86 1187 1096 A 62 GLU HGx A 63 LYS HDx 1.0 1.8 5.47 1188 1096 A 62 GLU HGy A 63 LYS HDx 1.0 1.8 5.47 1189 1096 A 63 LYS HDy A 62 GLU HGy 1.0 1.8 5.47 1190 1096 A 62 GLU HGx A 63 LYS HDy 1.0 1.8 5.47 1191 1097 A 65 GLU H A 64 ARG HBy 1.0 1.8 4.55 1192 1097 A 65 GLU H A 64 ARG HBx 1.0 1.8 4.55 1193 1098 A 68 PHE H A 67 ASP HBx 1.0 1.8 4.55 1194 1098 A 68 PHE H A 67 ASP HBy 1.0 1.8 4.55 1195 1099 A 69 LYS H A 68 PHE HBx 1.0 1.8 4.49 1196 1099 A 69 LYS H A 68 PHE HBy 1.0 1.8 4.49 1197 1100 A 70 TYR H A 69 LYS HBy 1.0 1.8 5.15 1198 1100 A 70 TYR H A 69 LYS HBx 1.0 1.8 5.15 1199 1101 A 70 TYR H A 69 LYS HGx 1.0 1.8 4.34 1200 1101 A 70 TYR H A 69 LYS HGy 1.0 1.8 4.34 1201 1102 A 71 ILE HG2% A 69 LYS HGx 1.0 1.8 4.38 1202 1102 A 71 ILE HG2% A 69 LYS HGy 1.0 1.8 4.38 1203 1103 A 70 TYR H A 69 LYS HEy 1.0 1.8 5.12 1204 1103 A 70 TYR H A 69 LYS HEx 1.0 1.8 5.12 1205 1104 A 71 ILE HG2% A 69 LYS HEy 1.0 1.8 3.54 1206 1104 A 71 ILE HG2% A 69 LYS HEx 1.0 1.8 3.54 1207 1105 A 71 ILE HG1y A 69 LYS HEy 1.0 1.8 4.72 1208 1105 A 71 ILE HG1y A 69 LYS HEx 1.0 1.8 4.72 1209 1106 A 71 ILE HD1% A 69 LYS HEy 1.0 1.8 4.47 1210 1106 A 71 ILE HD1% A 69 LYS HEx 1.0 1.8 4.47 1211 1107 A 73 LEU H A 72 PRO HBy 1.0 1.8 4.72 1212 1107 A 73 LEU H A 72 PRO HBx 1.0 1.8 4.72 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 2 ASP C A 3 VAL N A 3 VAL CA A 3 VAL C 1.0 -129.46 -89.46 PHI 2 2 A 3 VAL N A 3 VAL CA A 3 VAL C A 4 GLU N 1.0 109.18 149.18 PSI 3 3 A 8 PHE C A 9 TYR N A 9 TYR CA A 9 TYR C 1.0 -159.69 -119.69 PHI 4 4 A 9 TYR N A 9 TYR CA A 9 TYR C A 10 LYS N 1.0 125.32 165.32 PSI 5 5 A 9 TYR C A 10 LYS N A 10 LYS CA A 10 LYS C 1.0 -120.92 -80.92 PHI 6 6 A 10 LYS N A 10 LYS CA A 10 LYS C A 11 GLY N 1.0 109.15 149.15 PSI 7 7 A 11 GLY C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -150.14 -110.14 PHI 8 8 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 VAL N 1.0 115.47 155.47 PSI 9 9 A 12 VAL C A 13 VAL N A 13 VAL CA A 13 VAL C 1.0 -106.28 -66.28 PHI 10 10 A 13 VAL N A 13 VAL CA A 13 VAL C A 14 THR N 1.0 104.36 144.36 PSI 11 11 A 14 THR C A 15 ARG N A 15 ARG CA A 15 ARG C 1.0 -156.09 -116.09 PHI 12 12 A 15 ARG N A 15 ARG CA A 15 ARG C A 16 ILE N 1.0 116.34 156.34 PSI 13 13 A 15 ARG C A 16 ILE N A 16 ILE CA A 16 ILE C 1.0 -126.91 -86.91 PHI 14 14 A 16 ILE N A 16 ILE CA A 16 ILE C A 17 GLU N 1.0 107.90 147.90 PSI 15 15 A 16 ILE C A 17 GLU N A 17 GLU CA A 17 GLU C 1.0 -135.01 -95.01 PHI 16 16 A 17 GLU N A 17 GLU CA A 17 GLU C A 18 LYS N 1.0 138.15 178.15 PSI 17 17 A 20 GLY C A 21 ALA N A 21 ALA CA A 21 ALA C 1.0 -145.26 -105.26 PHI 18 18 A 21 ALA N A 21 ALA CA A 21 ALA C A 22 PHE N 1.0 126.72 166.72 PSI 19 19 A 21 ALA C A 22 PHE N A 22 PHE CA A 22 PHE C 1.0 -137.48 -77.48 PHI 20 20 A 22 PHE N A 22 PHE CA A 22 PHE C A 23 ILE N 1.0 108.61 148.61 PSI 21 21 A 22 PHE C A 23 ILE N A 23 ILE CA A 23 ILE C 1.0 -136.98 -96.98 PHI 22 22 A 23 ILE N A 23 ILE CA A 23 ILE C A 24 ASN N 1.0 109.62 149.62 PSI 23 23 A 29 VAL C A 30 ARG N A 30 ARG CA A 30 ARG C 1.0 -149.33 -109.33 PHI 24 24 A 30 ARG N A 30 ARG CA A 30 ARG C A 31 GLY N 1.0 129.09 169.09 PSI 25 25 A 31 GLY C A 32 LEU N A 32 LEU CA A 32 LEU C 1.0 -151.39 -111.39 PHI 26 26 A 32 LEU N A 32 LEU CA A 32 LEU C A 33 LEU N 1.0 113.15 153.15 PSI 27 27 A 32 LEU C A 33 LEU N A 33 LEU CA A 33 LEU C 1.0 -134.45 -94.45 PHI 28 28 A 33 LEU N A 33 LEU CA A 33 LEU C A 34 ARG N 1.0 114.27 154.27 PSI 29 29 A 35 PRO N A 35 PRO CA A 35 PRO C A 36 ARG N 1.0 -56.22 -16.22 PSI 30 30 A 35 PRO C A 36 ARG N A 36 ARG CA A 36 ARG C 1.0 -96.43 -56.43 PHI 31 31 A 36 ARG N A 36 ARG CA A 36 ARG C A 37 ASP N 1.0 -28.52 11.48 PSI 32 32 A 40 SER C A 41 LEU N A 41 LEU CA A 41 LEU C 1.0 -140.69 -80.69 PHI 33 33 A 41 LEU N A 41 LEU CA A 41 LEU C A 42 ARG N 1.0 118.55 158.55 PSI 34 34 A 41 LEU C A 42 ARG N A 42 ARG CA A 42 ARG C 1.0 -115.11 -75.11 PHI 35 35 A 42 ARG N A 42 ARG CA A 42 ARG C A 43 LEU N 1.0 123.62 163.62 PSI 36 36 A 42 ARG C A 43 LEU N A 43 LEU CA A 43 LEU C 1.0 -79.29 -39.29 PHI 37 37 A 43 LEU N A 43 LEU CA A 43 LEU C A 44 GLU N 1.0 -55.20 -15.20 PSI 38 38 A 43 LEU C A 44 GLU N A 44 GLU CA A 44 GLU C 1.0 -84.63 -44.63 PHI 39 39 A 44 GLU N A 44 GLU CA A 44 GLU C A 45 ASN N 1.0 -39.86 0.14 PSI 40 40 A 46 LEU C A 47 ASN N A 47 ASN CA A 47 ASN C 1.0 -126.99 -86.99 PHI 41 41 A 47 ASN N A 47 ASN CA A 47 ASN C A 48 VAL N 1.0 135.38 175.38 PSI 42 42 A 47 ASN C A 48 VAL N A 48 VAL CA A 48 VAL C 1.0 -82.80 -42.80 PHI 43 43 A 48 VAL N A 48 VAL CA A 48 VAL C A 49 GLY N 1.0 113.54 153.54 PSI 44 44 A 48 VAL C A 49 GLY N A 49 GLY CA A 49 GLY C 1.0 75.48 115.48 PHI 45 45 A 49 GLY N A 49 GLY CA A 49 GLY C A 50 ASP N 1.0 -34.62 5.38 PSI 46 46 A 51 GLU C A 52 ILE N A 52 ILE CA A 52 ILE C 1.0 -168.30 -108.30 PHI 47 47 A 52 ILE N A 52 ILE CA A 52 ILE C A 53 ILE N 1.0 121.91 161.91 PSI 48 48 A 52 ILE C A 53 ILE N A 53 ILE CA A 53 ILE C 1.0 -123.78 -83.78 PHI 49 49 A 53 ILE N A 53 ILE CA A 53 ILE C A 54 VAL N 1.0 109.26 149.26 PSI 50 50 A 53 ILE C A 54 VAL N A 54 VAL CA A 54 VAL C 1.0 -153.91 -113.91 PHI 51 51 A 54 VAL N A 54 VAL CA A 54 VAL C A 55 GLN N 1.0 141.71 181.71 PSI 52 52 A 54 VAL C A 55 GLN N A 55 GLN CA A 55 GLN C 1.0 -136.91 -96.91 PHI 53 53 A 55 GLN N A 55 GLN CA A 55 GLN C A 56 ALA N 1.0 110.01 150.01 PSI 54 54 A 57 ILE C A 58 ASP N A 58 ASP CA A 58 ASP C 1.0 -168.37 -128.37 PHI 55 55 A 58 ASP N A 58 ASP CA A 58 ASP C A 59 VAL N 1.0 128.62 168.62 PSI 56 56 A 58 ASP C A 59 VAL N A 59 VAL CA A 59 VAL C 1.0 -140.82 -100.82 PHI 57 57 A 59 VAL N A 59 VAL CA A 59 VAL C A 60 ARG N 1.0 105.46 145.46 PSI 58 58 A 59 VAL C A 60 ARG N A 60 ARG CA A 60 ARG C 1.0 -125.65 -85.65 PHI 59 59 A 60 ARG N A 60 ARG CA A 60 ARG C A 61 PRO N 1.0 98.45 158.45 PSI 60 60 A 61 PRO C A 62 GLU N A 62 GLU CA A 62 GLU C 1.0 -87.74 -47.74 PHI 61 61 A 62 GLU N A 62 GLU CA A 62 GLU C A 63 LYS N 1.0 -45.81 -5.81 PSI 62 62 A 62 GLU C A 63 LYS N A 63 LYS CA A 63 LYS C 1.0 -119.58 -79.58 PHI 63 63 A 63 LYS N A 63 LYS CA A 63 LYS C A 64 ARG N 1.0 -16.91 23.09 PSI 64 64 A 65 GLU C A 66 ILE N A 66 ILE CA A 66 ILE C 1.0 -147.50 -107.50 PHI 65 65 A 66 ILE N A 66 ILE CA A 66 ILE C A 67 ASP N 1.0 110.23 150.23 PSI 66 66 A 66 ILE C A 67 ASP N A 67 ASP CA A 67 ASP C 1.0 -126.03 -86.03 PHI 67 67 A 67 ASP N A 67 ASP CA A 67 ASP C A 68 PHE N 1.0 111.70 151.70 PSI 68 68 A 67 ASP C A 68 PHE N A 68 PHE CA A 68 PHE C 1.0 -149.51 -109.51 PHI 69 69 A 68 PHE N A 68 PHE CA A 68 PHE C A 69 LYS N 1.0 127.91 167.91 PSI 70 70 A 68 PHE C A 69 LYS N A 69 LYS CA A 69 LYS C 1.0 -157.37 -117.37 PHI 71 71 A 69 LYS N A 69 LYS CA A 69 LYS C A 70 TYR N 1.0 119.04 159.04 PSI 72 72 A 69 LYS C A 70 TYR N A 70 TYR CA A 70 TYR C 1.0 -149.70 -89.70 PHI 73 73 A 70 TYR N A 70 TYR CA A 70 TYR C A 71 ILE N 1.0 108.42 148.42 PSI 74 74 A 70 TYR C A 71 ILE N A 71 ILE CA A 71 ILE C 1.0 -132.19 -92.19 PHI 75 75 A 71 ILE N A 71 ILE CA A 71 ILE C A 72 PRO N 1.0 110.48 150.48 PSI 76 76 A 1 MET N A 1 MET CA A 1 MET CB A 1 MET CG 1.0 165.00 195.00 CHI1 77 77 A 1 MET CA A 1 MET CB A 1 MET CG A 1 MET SD 1.0 165.00 195.00 CHI2 78 78 A 2 ASP N A 2 ASP CA A 2 ASP CB A 2 ASP CG 1.0 165.00 195.00 CHI1 79 79 A 2 ASP CA A 2 ASP CB A 2 ASP CG A 2 ASP OD1 1.0 20.00 60.00 CHI2 80 80 A 4 GLU N A 4 GLU CA A 4 GLU CB A 4 GLU CG 1.0 -70.00 -50.00 CHI1 81 81 A 4 GLU CA A 4 GLU CB A 4 GLU CG A 4 GLU CD 1.0 165.00 195.00 CHI2 82 82 A 7 LYS N A 7 LYS CA A 7 LYS CB A 7 LYS CG 1.0 -70.00 -50.00 CHI1 83 83 A 7 LYS CA A 7 LYS CB A 7 LYS CG A 7 LYS CD 1.0 -80.00 -50.00 CHI2 84 84 A 8 PHE N A 8 PHE CA A 8 PHE CB A 8 PHE CG 1.0 -70.00 -50.00 CHI1 85 85 A 9 TYR N A 9 TYR CA A 9 TYR CB A 9 TYR CG 1.0 -70.00 -50.00 CHI1 86 86 A 10 LYS N A 10 LYS CA A 10 LYS CB A 10 LYS CG 1.0 165.00 195.00 CHI1 87 87 A 10 LYS CA A 10 LYS CB A 10 LYS CG A 10 LYS CD 1.0 165.00 195.00 CHI2 88 88 A 15 ARG N A 15 ARG CA A 15 ARG CB A 15 ARG CG 1.0 50.00 70.00 CHI1 89 89 A 15 ARG CA A 15 ARG CB A 15 ARG CG A 15 ARG CD 1.0 170.00 190.00 CHI2 90 90 A 16 ILE N A 16 ILE CA A 16 ILE CB A 16 ILE CG1 1.0 -70.00 -50.00 CHI1 91 91 A 16 ILE CA A 16 ILE CB A 16 ILE CG1 A 16 ILE CD1 1.0 -70.00 -50.00 CHI2 92 92 A 17 GLU N A 17 GLU CA A 17 GLU CB A 17 GLU CG 1.0 -70.00 -50.00 CHI1 93 93 A 17 GLU CA A 17 GLU CB A 17 GLU CG A 17 GLU CD 1.0 -100.00 -60.00 CHI2 94 94 A 18 LYS N A 18 LYS CA A 18 LYS CB A 18 LYS CG 1.0 -70.00 -50.00 CHI1 95 95 A 18 LYS CA A 18 LYS CB A 18 LYS CG A 18 LYS CD 1.0 165.00 195.00 CHI2 96 96 A 22 PHE N A 22 PHE CA A 22 PHE CB A 22 PHE CG 1.0 -90.00 -30.00 CHI1 97 97 A 23 ILE N A 23 ILE CA A 23 ILE CB A 23 ILE CG1 1.0 -70.00 -50.00 CHI1 98 98 A 23 ILE CA A 23 ILE CB A 23 ILE CG1 A 23 ILE CD1 1.0 160.00 180.00 CHI2 99 99 A 24 ASN N A 24 ASN CA A 24 ASN CB A 24 ASN CG 1.0 -70.00 -50.00 CHI1 100 100 A 24 ASN CA A 24 ASN CB A 24 ASN CG A 24 ASN OD1 1.0 -40.00 -10.00 CHI2 101 101 A 25 LEU N A 25 LEU CA A 25 LEU CB A 25 LEU CG 1.0 -90.00 210.00 CHI1 102 102 A 25 LEU CA A 25 LEU CB A 25 LEU CG A 25 LEU CD1 1.0 165.00 195.00 CHI2 103 103 A 27 GLU N A 27 GLU CA A 27 GLU CB A 27 GLU CG 1.0 165.00 195.00 CHI1 104 104 A 27 GLU CA A 27 GLU CB A 27 GLU CG A 27 GLU CD 1.0 165.00 195.00 CHI2 105 105 A 28 GLN N A 28 GLN CA A 28 GLN CB A 28 GLN CG 1.0 -70.00 -50.00 CHI1 106 106 A 28 GLN CA A 28 GLN CB A 28 GLN CG A 28 GLN CD 1.0 -70.00 -50.00 CHI2 107 107 A 33 LEU N A 33 LEU CA A 33 LEU CB A 33 LEU CG 1.0 165.00 195.00 CHI1 108 108 A 33 LEU CA A 33 LEU CB A 33 LEU CG A 33 LEU CD1 1.0 50.00 70.00 CHI2 109 109 A 34 ARG N A 34 ARG CA A 34 ARG CB A 34 ARG CG 1.0 -70.00 -50.00 CHI1 110 110 A 34 ARG CA A 34 ARG CB A 34 ARG CG A 34 ARG CD 1.0 165.00 195.00 CHI2 111 111 A 36 ARG N A 36 ARG CA A 36 ARG CB A 36 ARG CG 1.0 -70.00 -50.00 CHI1 112 112 A 36 ARG CA A 36 ARG CB A 36 ARG CG A 36 ARG CD 1.0 165.00 195.00 CHI2 113 113 A 37 ASP N A 37 ASP CA A 37 ASP CB A 37 ASP CG 1.0 -70.00 -50.00 CHI1 114 114 A 38 MET N A 38 MET CA A 38 MET CB A 38 MET CG 1.0 -90.00 210.00 CHI1 115 115 A 38 MET CA A 38 MET CB A 38 MET CG A 38 MET SD 1.0 -210.00 90.00 CHI2 116 116 A 39 ILE N A 39 ILE CA A 39 ILE CB A 39 ILE CG1 1.0 -90.00 210.00 CHI1 117 117 A 39 ILE CA A 39 ILE CB A 39 ILE CG1 A 39 ILE CD1 1.0 -210.00 90.00 CHI2 118 118 A 40 SER N A 40 SER CA A 40 SER CB A 40 SER OG 1.0 -90.00 210.00 CHI1 119 119 A 40 SER N A 40 SER CA A 40 SER CB A 40 SER OG 1.0 -330.00 -30.00 CHI1 120 120 A 40 SER N A 40 SER CA A 40 SER CB A 40 SER OG 1.0 -210.00 90.00 CHI1 121 121 A 41 LEU N A 41 LEU CA A 41 LEU CB A 41 LEU CG 1.0 -90.00 210.00 CHI1 122 122 A 41 LEU CA A 41 LEU CB A 41 LEU CG A 41 LEU CD1 1.0 165.00 195.00 CHI2 123 123 A 42 ARG N A 42 ARG CA A 42 ARG CB A 42 ARG CG 1.0 -70.00 -50.00 CHI1 124 124 A 42 ARG CA A 42 ARG CB A 42 ARG CG A 42 ARG CD 1.0 -70.00 -50.00 CHI2 125 125 A 43 LEU N A 43 LEU CA A 43 LEU CB A 43 LEU CG 1.0 -65.00 -45.00 CHI1 126 126 A 43 LEU CA A 43 LEU CB A 43 LEU CG A 43 LEU CD1 1.0 165.00 195.00 CHI2 127 127 A 44 GLU CA A 44 GLU CB A 44 GLU CG A 44 GLU CD 1.0 165.00 195.00 CHI2 128 128 A 44 GLU N A 44 GLU CA A 44 GLU CB A 44 GLU CG 1.0 -70.00 -50.00 CHI1 129 129 A 45 ASN N A 45 ASN CA A 45 ASN CB A 45 ASN CG 1.0 -70.00 -50.00 CHI1 130 130 A 45 ASN CA A 45 ASN CB A 45 ASN CG A 45 ASN OD1 1.0 -60.00 -30.00 CHI2 131 131 A 46 LEU N A 46 LEU CA A 46 LEU CB A 46 LEU CG 1.0 -70.00 -50.00 CHI1 132 132 A 46 LEU CA A 46 LEU CB A 46 LEU CG A 46 LEU CD1 1.0 165.00 195.00 CHI2 133 133 A 47 ASN N A 47 ASN CA A 47 ASN CB A 47 ASN CG 1.0 -70.00 -50.00 CHI1 134 134 A 50 ASP N A 50 ASP CA A 50 ASP CB A 50 ASP CG 1.0 -90.00 -30.00 CHI1 135 135 A 50 ASP CA A 50 ASP CB A 50 ASP CG A 50 ASP OD1 1.0 -70.00 -30.00 CHI2 136 136 A 51 GLU N A 51 GLU CA A 51 GLU CB A 51 GLU CG 1.0 -70.00 -50.00 CHI1 137 137 A 51 GLU CA A 51 GLU CB A 51 GLU CG A 51 GLU CD 1.0 165.00 195.00 CHI2 138 138 A 52 ILE N A 52 ILE CA A 52 ILE CB A 52 ILE CG1 1.0 -70.00 -50.00 CHI1 139 139 A 52 ILE CA A 52 ILE CB A 52 ILE CG1 A 52 ILE CD1 1.0 165.00 195.00 CHI2 140 140 A 53 ILE N A 53 ILE CA A 53 ILE CB A 53 ILE CG1 1.0 -70.00 -50.00 CHI1 141 141 A 53 ILE CA A 53 ILE CB A 53 ILE CG1 A 53 ILE CD1 1.0 165.00 190.00 CHI2 142 142 A 55 GLN N A 55 GLN CA A 55 GLN CB A 55 GLN CG 1.0 170.00 190.00 CHI1 143 143 A 55 GLN CA A 55 GLN CB A 55 GLN CG A 55 GLN CD 1.0 170.00 190.00 CHI2 144 144 A 57 ILE N A 57 ILE CA A 57 ILE CB A 57 ILE CG1 1.0 -70.00 -50.00 CHI1 145 145 A 57 ILE CA A 57 ILE CB A 57 ILE CG1 A 57 ILE CD1 1.0 170.00 190.00 CHI2 146 146 A 58 ASP N A 58 ASP CA A 58 ASP CB A 58 ASP CG 1.0 -70.00 -50.00 CHI1 147 147 A 60 ARG N A 60 ARG CA A 60 ARG CB A 60 ARG CG 1.0 -70.00 -50.00 CHI1 148 148 A 60 ARG CA A 60 ARG CB A 60 ARG CG A 60 ARG CD 1.0 165.00 195.00 CHI2 149 149 A 62 GLU N A 62 GLU CA A 62 GLU CB A 62 GLU CG 1.0 50.00 70.00 CHI1 150 150 A 62 GLU CA A 62 GLU CB A 62 GLU CG A 62 GLU CD 1.0 170.00 190.00 CHI2 151 151 A 63 LYS N A 63 LYS CA A 63 LYS CB A 63 LYS CG 1.0 -70.00 -50.00 CHI1 152 152 A 64 ARG N A 64 ARG CA A 64 ARG CB A 64 ARG CG 1.0 -70.00 -50.00 CHI1 153 153 A 64 ARG CA A 64 ARG CB A 64 ARG CG A 64 ARG CD 1.0 165.00 195.00 CHI2 154 154 A 65 GLU N A 65 GLU CA A 65 GLU CB A 65 GLU CG 1.0 -70.00 -50.00 CHI1 155 155 A 65 GLU CA A 65 GLU CB A 65 GLU CG A 65 GLU CD 1.0 170.00 190.00 CHI2 156 156 A 66 ILE N A 66 ILE CA A 66 ILE CB A 66 ILE CG1 1.0 -70.00 -50.00 CHI1 157 157 A 66 ILE CA A 66 ILE CB A 66 ILE CG1 A 66 ILE CD1 1.0 170.00 190.00 CHI2 158 158 A 67 ASP N A 67 ASP CA A 67 ASP CB A 67 ASP CG 1.0 -70.00 -50.00 CHI1 159 159 A 67 ASP CA A 67 ASP CB A 67 ASP CG A 67 ASP OD1 1.0 -70.00 -50.00 CHI2 160 160 A 68 PHE N A 68 PHE CA A 68 PHE CB A 68 PHE CG 1.0 -70.00 -50.00 CHI1 161 161 A 69 LYS N A 69 LYS CA A 69 LYS CB A 69 LYS CG 1.0 170.00 190.00 CHI1 162 162 A 69 LYS CA A 69 LYS CB A 69 LYS CG A 69 LYS CD 1.0 170.00 190.00 CHI2 163 163 A 70 TYR N A 70 TYR CA A 70 TYR CB A 70 TYR CG 1.0 170.00 190.00 CHI1 164 164 A 70 TYR CA A 70 TYR CB A 70 TYR CG A 70 TYR CD1 1.0 -100.00 -60.00 CHI2 165 165 A 71 ILE N A 71 ILE CA A 71 ILE CB A 71 ILE CG1 1.0 50.00 70.00 CHI1 166 166 A 71 ILE CA A 71 ILE CB A 71 ILE CG1 A 71 ILE CD1 1.0 170.00 190.00 CHI2 stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 12 2 13C 150 3 1H 14 stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H 12 2 15N 50 3 1H 14 stop_ save_