data_nef_c16378_2kl1 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 ASN middle . . 3 A 3 GLU middle . . 4 A 4 ALA middle . . 5 A 5 LYS middle . . 6 A 6 GLY middle . false 7 A 7 VAL middle . . 8 A 8 TYR middle . . 9 A 9 VAL middle . . 10 A 10 MET middle . . 11 A 11 SER middle . . 12 A 12 VAL middle . . 13 A 13 LEU middle . . 14 A 14 PRO middle . false 15 A 15 ASN middle . . 16 A 16 MET middle . . 17 A 17 PRO middle . false 18 A 18 ALA middle . . 19 A 19 ALA middle . . 20 A 20 GLY middle . false 21 A 21 ARG middle . . 22 A 22 LEU middle . . 23 A 23 GLU middle . . 24 A 24 ALA middle . . 25 A 25 GLY middle . false 26 A 26 ASP middle . . 27 A 27 ARG middle . . 28 A 28 ILE middle . . 29 A 29 ALA middle . . 30 A 30 ALA middle . . 31 A 31 ILE middle . . 32 A 32 ASP middle . . 33 A 33 GLY middle . false 34 A 34 GLN middle . . 35 A 35 PRO middle . false 36 A 36 ILE middle . . 37 A 37 ASN middle . . 38 A 38 THR middle . . 39 A 39 SER middle . . 40 A 40 GLU middle . . 41 A 41 GLN middle . . 42 A 42 ILE middle . . 43 A 43 VAL middle . . 44 A 44 SER middle . . 45 A 45 TYR middle . . 46 A 46 VAL middle . . 47 A 47 ARG middle . . 48 A 48 GLU middle . . 49 A 49 LYS middle . . 50 A 50 GLN middle . . 51 A 51 ALA middle . . 52 A 52 GLY middle . false 53 A 53 ASP middle . . 54 A 54 ARG middle . . 55 A 55 VAL middle . . 56 A 56 ARG middle . . 57 A 57 VAL middle . . 58 A 58 THR middle . . 59 A 59 PHE middle . . 60 A 60 ILE middle . . 61 A 61 ARG middle . . 62 A 62 ASP middle . . 63 A 63 ARG middle . . 64 A 64 LYS middle . . 65 A 65 GLN middle . . 66 A 66 HIS middle . . 67 A 67 GLU middle . . 68 A 68 ALA middle . . 69 A 69 GLU middle . . 70 A 70 LEU middle . . 71 A 71 VAL middle . . 72 A 72 LEU middle . . 73 A 73 LYS middle . . 74 A 74 PRO middle . false 75 A 75 PHE middle . . 76 A 76 PRO middle . false 77 A 77 HIS middle . . 78 A 78 HIS middle . . 79 A 79 PRO middle . false 80 A 80 ASN middle . . 81 A 81 GLN middle . . 82 A 82 ILE middle . . 83 A 83 GLY middle . false 84 A 84 LEU middle . . 85 A 85 GLY middle . false 86 A 86 VAL middle . . 87 A 87 THR middle . . 88 A 88 LEU middle . . 89 A 89 GLU middle . . 90 A 90 HIS middle . . 91 A 91 HIS middle . . 92 A 92 HIS middle . . 93 A 93 HIS middle . . 94 A 94 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 ASN HA H 1 4.686 0.04 A 2 ASN HBx H 1 2.836 0.04 A 2 ASN HBy H 1 2.836 0.04 A 2 ASN C C 13 174.680 0.5 A 2 ASN CA C 13 53.665 0.5 A 2 ASN CB C 13 38.589 0.5 A 3 GLU H H 1 8.649 0.04 A 3 GLU HA H 1 4.248 0.04 A 3 GLU HBx H 1 2.001 0.04 A 3 GLU HBy H 1 2.001 0.04 A 3 GLU HGx H 1 2.278 0.04 A 3 GLU HGy H 1 2.278 0.04 A 3 GLU C C 13 176.073 0.5 A 3 GLU CA C 13 57.083 0.5 A 3 GLU CB C 13 30.167 0.5 A 3 GLU CG C 13 36.482 0.5 A 3 GLU N N 15 121.757 0.5 A 4 ALA H H 1 8.386 0.04 A 4 ALA HA H 1 4.381 0.04 A 4 ALA HB% H 1 1.378 0.04 A 4 ALA C C 13 177.462 0.5 A 4 ALA CA C 13 52.301 0.5 A 4 ALA CB C 13 19.282 0.5 A 4 ALA N N 15 125.167 0.5 A 5 LYS H H 1 8.350 0.04 A 5 LYS HA H 1 4.414 0.04 A 5 LYS HBx H 1 1.853 0.04 A 5 LYS HBy H 1 1.853 0.04 A 5 LYS HDx H 1 1.694 0.04 A 5 LYS HDy H 1 1.694 0.04 A 5 LYS HEx H 1 3.001 0.04 A 5 LYS HEy H 1 3.001 0.04 A 5 LYS HGx H 1 1.482 0.04 A 5 LYS HGy H 1 1.482 0.04 A 5 LYS C C 13 176.899 0.5 A 5 LYS CA C 13 56.528 0.5 A 5 LYS CB C 13 33.721 0.5 A 5 LYS CD C 13 29.115 0.5 A 5 LYS CE C 13 42.263 0.5 A 5 LYS CG C 13 24.695 0.5 A 5 LYS N N 15 121.236 0.5 A 6 GLY H H 1 8.365 0.04 A 6 GLY HAy H 1 4.151 0.04 A 6 GLY HAx H 1 3.995 0.04 A 6 GLY CA C 13 44.642 0.5 A 6 GLY N N 15 108.016 0.5 A 7 VAL H H 1 8.247 0.04 A 7 VAL HA H 1 4.357 0.04 A 7 VAL HB H 1 1.822 0.04 A 7 VAL HGx% H 1 0.843 0.04 A 7 VAL HGy% H 1 0.658 0.04 A 7 VAL C C 13 174.409 0.5 A 7 VAL CA C 13 61.144 0.5 A 7 VAL CGy C 13 22.758 0.5 A 7 VAL CGx C 13 21.318 0.5 A 7 VAL N N 15 118.421 0.5 A 8 TYR H H 1 9.029 0.04 A 8 TYR HA H 1 4.886 0.04 A 8 TYR HBx H 1 2.741 0.04 A 8 TYR HBy H 1 2.741 0.04 A 8 TYR HDx H 1 6.945 0.04 A 8 TYR HDy H 1 6.945 0.04 A 8 TYR HEx H 1 6.811 0.04 A 8 TYR HEy H 1 6.811 0.04 A 8 TYR C C 13 175.284 0.5 A 8 TYR CA C 13 58.398 0.5 A 8 TYR CB C 13 40.878 0.5 A 8 TYR CDx C 13 133.495 0.5 A 8 TYR N N 15 126.127 0.5 A 9 VAL H H 1 8.817 0.04 A 9 VAL HA H 1 3.944 0.04 A 9 VAL HB H 1 2.182 0.04 A 9 VAL HGx% H 1 0.787 0.04 A 9 VAL HGy% H 1 0.594 0.04 A 9 VAL C C 13 175.733 0.5 A 9 VAL CA C 13 62.886 0.5 A 9 VAL CB C 13 32.104 0.5 A 9 VAL CGx C 13 22.128 0.5 A 9 VAL CGy C 13 22.256 0.5 A 9 VAL N N 15 122.661 0.5 A 10 MET H H 1 9.246 0.04 A 10 MET HA H 1 4.663 0.04 A 10 MET HBy H 1 2.055 0.04 A 10 MET HBx H 1 1.817 0.04 A 10 MET HGy H 1 2.577 0.04 A 10 MET HGx H 1 2.404 0.04 A 10 MET C C 13 176.094 0.5 A 10 MET CA C 13 56.000 0.5 A 10 MET CB C 13 32.697 0.5 A 10 MET CG C 13 31.885 0.5 A 10 MET N N 15 128.567 0.5 A 11 SER H H 1 7.616 0.04 A 11 SER HA H 1 4.542 0.04 A 11 SER HBx H 1 3.824 0.04 A 11 SER HBy H 1 3.824 0.04 A 11 SER C C 13 171.288 0.5 A 11 SER CA C 13 57.470 0.5 A 11 SER CB C 13 64.980 0.5 A 11 SER N N 15 111.067 0.5 A 12 VAL H H 1 8.501 0.04 A 12 VAL HA H 1 4.489 0.04 A 12 VAL HB H 1 1.835 0.04 A 12 VAL HGx% H 1 0.763 0.04 A 12 VAL HGy% H 1 0.619 0.04 A 12 VAL C C 13 175.719 0.5 A 12 VAL CA C 13 61.185 0.5 A 12 VAL CB C 13 34.424 0.5 A 12 VAL CGy C 13 21.225 0.5 A 12 VAL CGx C 13 20.625 0.5 A 12 VAL N N 15 120.040 0.5 A 13 LEU H H 1 8.324 0.04 A 13 LEU HA H 1 4.575 0.04 A 13 LEU HBy H 1 1.610 0.04 A 13 LEU HBx H 1 1.406 0.04 A 13 LEU HDx% H 1 0.893 0.04 A 13 LEU HDy% H 1 0.909 0.04 A 13 LEU CA C 13 53.336 0.5 A 13 LEU CB C 13 41.551 0.5 A 13 LEU CDy C 13 25.075 0.5 A 13 LEU CDx C 13 23.829 0.5 A 13 LEU N N 15 129.751 0.5 A 14 PRO HA H 1 4.369 0.04 A 14 PRO HBy H 1 2.293 0.04 A 14 PRO HBx H 1 1.902 0.04 A 14 PRO HDx H 1 3.947 0.04 A 14 PRO HGx H 1 2.072 0.04 A 14 PRO HGy H 1 2.072 0.04 A 14 PRO C C 13 176.646 0.5 A 14 PRO CA C 13 63.060 0.5 A 14 PRO CB C 13 32.172 0.5 A 14 PRO CD C 13 50.717 0.5 A 14 PRO CG C 13 27.373 0.5 A 15 ASN H H 1 8.748 0.04 A 15 ASN HA H 1 4.459 0.04 A 15 ASN HBx H 1 2.933 0.04 A 15 ASN HBy H 1 2.933 0.04 A 15 ASN HD2y H 1 7.598 0.04 A 15 ASN HD2x H 1 6.919 0.04 A 15 ASN C C 13 173.812 0.5 A 15 ASN CA C 13 53.927 0.5 A 15 ASN CB C 13 37.517 0.5 A 15 ASN N N 15 113.165 0.5 A 15 ASN ND2 N 15 113.119 0.5 A 16 MET H H 1 7.037 0.04 A 16 MET HA H 1 5.217 0.04 A 16 MET HBx H 1 2.062 0.04 A 16 MET HBy H 1 2.062 0.04 A 16 MET HGy H 1 2.354 0.04 A 16 MET HGx H 1 2.250 0.04 A 16 MET CA C 13 52.844 0.5 A 16 MET CB C 13 32.706 0.5 A 16 MET N N 15 117.783 0.5 A 17 PRO HA H 1 4.300 0.04 A 17 PRO HBy H 1 2.585 0.04 A 17 PRO HBx H 1 1.875 0.04 A 17 PRO HDy H 1 3.819 0.04 A 17 PRO HDx H 1 3.469 0.04 A 17 PRO HGy H 1 2.515 0.04 A 17 PRO HGx H 1 2.201 0.04 A 17 PRO C C 13 176.365 0.5 A 17 PRO CA C 13 66.084 0.5 A 17 PRO CB C 13 33.280 0.5 A 17 PRO CD C 13 51.086 0.5 A 17 PRO CG C 13 29.207 0.5 A 18 ALA H H 1 7.947 0.04 A 18 ALA HA H 1 4.028 0.04 A 18 ALA HB% H 1 1.190 0.04 A 18 ALA C C 13 177.047 0.5 A 18 ALA CA C 13 53.088 0.5 A 18 ALA CB C 13 19.788 0.5 A 18 ALA N N 15 114.393 0.5 A 19 ALA H H 1 7.723 0.04 A 19 ALA HA H 1 4.026 0.04 A 19 ALA HB% H 1 1.575 0.04 A 19 ALA C C 13 178.641 0.5 A 19 ALA CA C 13 54.402 0.5 A 19 ALA CB C 13 17.896 0.5 A 19 ALA N N 15 124.141 0.5 A 20 GLY H H 1 9.210 0.04 A 20 GLY HAy H 1 4.218 0.04 A 20 GLY HAx H 1 3.761 0.04 A 20 GLY C C 13 173.843 0.5 A 20 GLY CA C 13 45.594 0.5 A 20 GLY N N 15 113.422 0.5 A 21 ARG H H 1 8.273 0.04 A 21 ARG HA H 1 4.568 0.04 A 21 ARG HBx H 1 1.577 0.04 A 21 ARG HBy H 1 1.577 0.04 A 21 ARG HDx H 1 3.229 0.04 A 21 ARG HDy H 1 3.229 0.04 A 21 ARG HGx H 1 1.625 0.04 A 21 ARG HGy H 1 1.625 0.04 A 21 ARG C C 13 175.470 0.5 A 21 ARG CA C 13 56.459 0.5 A 21 ARG CB C 13 32.101 0.5 A 21 ARG CD C 13 42.622 0.5 A 21 ARG CG C 13 26.841 0.5 A 21 ARG N N 15 118.680 0.5 A 22 LEU H H 1 8.051 0.04 A 22 LEU HA H 1 4.068 0.04 A 22 LEU HBx H 1 1.171 0.04 A 22 LEU HBy H 1 1.171 0.04 A 22 LEU HDx% H 1 0.502 0.04 A 22 LEU HDy% H 1 0.000 0.04 A 22 LEU HG H 1 1.045 0.04 A 22 LEU C C 13 173.868 0.5 A 22 LEU CA C 13 52.990 0.5 A 22 LEU CB C 13 44.086 0.5 A 22 LEU CDy C 13 25.601 0.5 A 22 LEU CDx C 13 23.092 0.5 A 22 LEU CG C 13 27.966 0.5 A 22 LEU N N 15 117.587 0.5 A 23 GLU H H 1 8.860 0.04 A 23 GLU HA H 1 4.375 0.04 A 23 GLU HBy H 1 1.909 0.04 A 23 GLU HBx H 1 1.594 0.04 A 23 GLU HGx H 1 2.091 0.04 A 23 GLU HGy H 1 2.091 0.04 A 23 GLU C C 13 175.050 0.5 A 23 GLU CA C 13 54.161 0.5 A 23 GLU CB C 13 34.040 0.5 A 23 GLU CG C 13 35.768 0.5 A 23 GLU N N 15 119.047 0.5 A 24 ALA H H 1 8.556 0.04 A 24 ALA HA H 1 3.730 0.04 A 24 ALA HB% H 1 1.296 0.04 A 24 ALA C C 13 179.085 0.5 A 24 ALA CA C 13 53.391 0.5 A 24 ALA CB C 13 18.089 0.5 A 24 ALA N N 15 122.243 0.5 A 25 GLY H H 1 9.168 0.04 A 25 GLY HAy H 1 4.543 0.04 A 25 GLY HAx H 1 3.646 0.04 A 25 GLY C C 13 175.011 0.5 A 25 GLY CA C 13 44.814 0.5 A 25 GLY N N 15 113.135 0.5 A 26 ASP H H 1 8.096 0.04 A 26 ASP HA H 1 4.872 0.04 A 26 ASP HBy H 1 2.522 0.04 A 26 ASP HBx H 1 2.200 0.04 A 26 ASP C C 13 175.144 0.5 A 26 ASP CA C 13 55.515 0.5 A 26 ASP CB C 13 41.679 0.5 A 26 ASP N N 15 122.956 0.5 A 27 ARG H H 1 8.432 0.04 A 27 ARG HA H 1 4.819 0.04 A 27 ARG HBy H 1 1.673 0.04 A 27 ARG HBx H 1 1.386 0.04 A 27 ARG HDy H 1 3.134 0.04 A 27 ARG HDx H 1 2.854 0.04 A 27 ARG HGx H 1 0.945 0.04 A 27 ARG HGy H 1 0.945 0.04 A 27 ARG C C 13 176.926 0.5 A 27 ARG CA C 13 54.124 0.5 A 27 ARG CB C 13 33.042 0.5 A 27 ARG CD C 13 43.483 0.5 A 27 ARG CG C 13 27.943 0.5 A 27 ARG N N 15 119.925 0.5 A 28 ILE H H 1 9.031 0.04 A 28 ILE HA H 1 3.979 0.04 A 28 ILE HB H 1 1.657 0.04 A 28 ILE HD1% H 1 0.579 0.04 A 28 ILE HG2% H 1 0.762 0.04 A 28 ILE C C 13 173.621 0.5 A 28 ILE CA C 13 62.384 0.5 A 28 ILE CB C 13 37.759 0.5 A 28 ILE CD1 C 13 12.367 0.5 A 28 ILE CG1 C 13 27.392 0.5 A 28 ILE CG2 C 13 17.364 0.5 A 28 ILE N N 15 126.353 0.5 A 29 ALA H H 1 8.893 0.04 A 29 ALA HA H 1 4.652 0.04 A 29 ALA HB% H 1 1.220 0.04 A 29 ALA C C 13 177.863 0.5 A 29 ALA CA C 13 52.385 0.5 A 29 ALA CB C 13 21.218 0.5 A 29 ALA N N 15 130.276 0.5 A 30 ALA H H 1 8.070 0.04 A 30 ALA HA H 1 5.077 0.04 A 30 ALA HB% H 1 1.055 0.04 A 30 ALA C C 13 175.450 0.5 A 30 ALA CA C 13 52.354 0.5 A 30 ALA CB C 13 21.682 0.5 A 30 ALA N N 15 119.304 0.5 A 31 ILE H H 1 8.121 0.04 A 31 ILE HA H 1 4.920 0.04 A 31 ILE HB H 1 1.336 0.04 A 31 ILE HD1% H 1 0.801 0.04 A 31 ILE HG1x H 1 1.001 0.04 A 31 ILE HG1y H 1 1.001 0.04 A 31 ILE HG2% H 1 0.589 0.04 A 31 ILE C C 13 174.841 0.5 A 31 ILE CA C 13 59.277 0.5 A 31 ILE CB C 13 40.677 0.5 A 31 ILE CD1 C 13 14.027 0.5 A 31 ILE CG1 C 13 28.096 0.5 A 31 ILE CG2 C 13 17.163 0.5 A 31 ILE N N 15 117.717 0.5 A 32 ASP H H 1 10.086 0.04 A 32 ASP HA H 1 4.428 0.04 A 32 ASP HBy H 1 3.101 0.04 A 32 ASP HBx H 1 2.711 0.04 A 32 ASP C C 13 175.928 0.5 A 32 ASP CA C 13 55.904 0.5 A 32 ASP CB C 13 39.061 0.5 A 32 ASP N N 15 128.594 0.5 A 33 GLY H H 1 8.698 0.04 A 33 GLY HAy H 1 4.100 0.04 A 33 GLY HAx H 1 3.561 0.04 A 33 GLY C C 13 173.821 0.5 A 33 GLY CA C 13 45.265 0.5 A 33 GLY N N 15 102.728 0.5 A 34 GLN H H 1 8.119 0.04 A 34 GLN HA H 1 4.746 0.04 A 34 GLN HBx H 1 2.030 0.04 A 34 GLN HBy H 1 2.030 0.04 A 34 GLN HGx H 1 2.274 0.04 A 34 GLN HGy H 1 2.274 0.04 A 34 GLN C C 13 173.184 0.5 A 34 GLN CA C 13 52.142 0.5 A 34 GLN CB C 13 28.762 0.5 A 34 GLN CG C 13 33.256 0.5 A 34 GLN N N 15 122.963 0.5 A 35 PRO HA H 1 4.586 0.04 A 35 PRO HBy H 1 2.322 0.04 A 35 PRO HBx H 1 1.892 0.04 A 35 PRO HDy H 1 4.019 0.04 A 35 PRO HDx H 1 3.717 0.04 A 35 PRO HGx H 1 2.088 0.04 A 35 PRO HGy H 1 2.088 0.04 A 35 PRO C C 13 176.387 0.5 A 35 PRO CA C 13 62.714 0.5 A 35 PRO CB C 13 32.404 0.5 A 35 PRO CD C 13 51.041 0.5 A 35 PRO CG C 13 27.636 0.5 A 36 ILE H H 1 7.688 0.04 A 36 ILE HA H 1 4.418 0.04 A 36 ILE HB H 1 1.723 0.04 A 36 ILE HD1% H 1 0.556 0.04 A 36 ILE HG1y H 1 1.440 0.04 A 36 ILE HG1x H 1 0.989 0.04 A 36 ILE HG2% H 1 0.776 0.04 A 36 ILE C C 13 174.844 0.5 A 36 ILE CA C 13 57.534 0.5 A 36 ILE CB C 13 39.192 0.5 A 36 ILE CD1 C 13 10.608 0.5 A 36 ILE CG1 C 13 26.117 0.5 A 36 ILE CG2 C 13 19.024 0.5 A 36 ILE N N 15 121.099 0.5 A 37 ASN H H 1 9.516 0.04 A 37 ASN HA H 1 4.934 0.04 A 37 ASN HBx H 1 2.832 0.04 A 37 ASN HBy H 1 2.832 0.04 A 37 ASN C C 13 174.655 0.5 A 37 ASN CA C 13 53.748 0.5 A 37 ASN CB C 13 41.998 0.5 A 37 ASN N N 15 121.609 0.5 A 38 THR H H 1 7.864 0.04 A 38 THR HA H 1 4.722 0.04 A 38 THR HB H 1 4.605 0.04 A 38 THR HG2% H 1 1.162 0.04 A 38 THR C C 13 174.599 0.5 A 38 THR CA C 13 59.442 0.5 A 38 THR CB C 13 72.426 0.5 A 38 THR N N 15 109.160 0.5 A 39 SER H H 1 9.437 0.04 A 39 SER HA H 1 3.944 0.04 A 39 SER HBx H 1 3.794 0.04 A 39 SER HBy H 1 3.794 0.04 A 39 SER C C 13 176.700 0.5 A 39 SER CA C 13 61.770 0.5 A 39 SER N N 15 118.576 0.5 A 40 GLU H H 1 8.801 0.04 A 40 GLU HA H 1 4.046 0.04 A 40 GLU HBx H 1 2.071 0.04 A 40 GLU HBy H 1 2.071 0.04 A 40 GLU HGx H 1 2.394 0.04 A 40 GLU HGy H 1 2.394 0.04 A 40 GLU C C 13 178.706 0.5 A 40 GLU CA C 13 59.924 0.5 A 40 GLU CB C 13 28.905 0.5 A 40 GLU CG C 13 36.674 0.5 A 40 GLU N N 15 122.178 0.5 A 41 GLN H H 1 7.711 0.04 A 41 GLN HA H 1 4.093 0.04 A 41 GLN HBy H 1 2.487 0.04 A 41 GLN HBx H 1 2.069 0.04 A 41 GLN HGx H 1 2.498 0.04 A 41 GLN HGy H 1 2.498 0.04 A 41 GLN C C 13 179.320 0.5 A 41 GLN CA C 13 58.875 0.5 A 41 GLN CB C 13 29.793 0.5 A 41 GLN CG C 13 34.659 0.5 A 41 GLN N N 15 117.813 0.5 A 42 ILE H H 1 7.277 0.04 A 42 ILE HA H 1 3.707 0.04 A 42 ILE HB H 1 2.079 0.04 A 42 ILE HD1% H 1 0.811 0.04 A 42 ILE HG1y H 1 1.829 0.04 A 42 ILE HG1x H 1 0.884 0.04 A 42 ILE HG2% H 1 0.904 0.04 A 42 ILE C C 13 176.528 0.5 A 42 ILE CA C 13 65.516 0.5 A 42 ILE CB C 13 37.671 0.5 A 42 ILE CD1 C 13 14.822 0.5 A 42 ILE CG1 C 13 29.361 0.5 A 42 ILE CG2 C 13 16.623 0.5 A 42 ILE N N 15 117.639 0.5 A 43 VAL H H 1 7.753 0.04 A 43 VAL HA H 1 3.629 0.04 A 43 VAL HB H 1 2.082 0.04 A 43 VAL HGx% H 1 1.090 0.04 A 43 VAL HGy% H 1 0.987 0.04 A 43 VAL C C 13 178.374 0.5 A 43 VAL CA C 13 66.905 0.5 A 43 VAL CB C 13 32.078 0.5 A 43 VAL CGy C 13 22.194 0.5 A 43 VAL CGx C 13 21.224 0.5 A 43 VAL N N 15 119.198 0.5 A 44 SER H H 1 8.400 0.04 A 44 SER HA H 1 4.097 0.04 A 44 SER HBx H 1 3.957 0.04 A 44 SER HBy H 1 3.957 0.04 A 44 SER C C 13 176.490 0.5 A 44 SER CA C 13 61.779 0.5 A 44 SER CB C 13 62.933 0.5 A 44 SER N N 15 112.696 0.5 A 45 TYR H H 1 7.562 0.04 A 45 TYR HA H 1 4.252 0.04 A 45 TYR HBy H 1 3.303 0.04 A 45 TYR HBx H 1 3.071 0.04 A 45 TYR HDx H 1 6.996 0.04 A 45 TYR HDy H 1 6.996 0.04 A 45 TYR HEx H 1 6.786 0.04 A 45 TYR HEy H 1 6.786 0.04 A 45 TYR C C 13 178.573 0.5 A 45 TYR CA C 13 61.526 0.5 A 45 TYR CB C 13 38.946 0.5 A 45 TYR CDx C 13 132.913 0.5 A 45 TYR N N 15 121.208 0.5 A 46 VAL H H 1 8.378 0.04 A 46 VAL HA H 1 3.491 0.04 A 46 VAL HB H 1 2.255 0.04 A 46 VAL HGx% H 1 1.022 0.04 A 46 VAL HGy% H 1 1.234 0.04 A 46 VAL C C 13 177.201 0.5 A 46 VAL CA C 13 65.961 0.5 A 46 VAL CB C 13 31.725 0.5 A 46 VAL CGy C 13 22.580 0.5 A 46 VAL CGx C 13 21.977 0.5 A 46 VAL N N 15 115.313 0.5 A 47 ARG H H 1 8.047 0.04 A 47 ARG N N 15 117.074 0.5 A 49 LYS H H 1 7.306 0.04 A 49 LYS HA H 1 4.449 0.04 A 49 LYS HBx H 1 2.094 0.04 A 49 LYS HDx H 1 1.389 0.04 A 49 LYS HDy H 1 1.389 0.04 A 49 LYS HGx H 1 1.311 0.04 A 49 LYS HGy H 1 1.311 0.04 A 49 LYS C C 13 173.798 0.5 A 49 LYS CA C 13 53.903 0.5 A 49 LYS CB C 13 32.920 0.5 A 49 LYS CD C 13 27.678 0.5 A 49 LYS CG C 13 24.565 0.5 A 49 LYS N N 15 121.073 0.5 A 50 GLN H H 1 8.603 0.04 A 50 GLN HA H 1 4.581 0.04 A 50 GLN HBy H 1 2.050 0.04 A 50 GLN HBx H 1 1.844 0.04 A 50 GLN HGx H 1 2.341 0.04 A 50 GLN HGy H 1 2.341 0.04 A 50 GLN C C 13 175.684 0.5 A 50 GLN CA C 13 53.705 0.5 A 50 GLN CB C 13 32.090 0.5 A 50 GLN CG C 13 33.921 0.5 A 50 GLN N N 15 116.180 0.5 A 51 ALA H H 1 8.719 0.04 A 51 ALA HA H 1 3.629 0.04 A 51 ALA HB% H 1 1.388 0.04 A 51 ALA C C 13 178.476 0.5 A 51 ALA CA C 13 53.778 0.5 A 51 ALA CB C 13 17.941 0.5 A 51 ALA N N 15 122.390 0.5 A 52 GLY H H 1 8.694 0.04 A 52 GLY HAy H 1 4.455 0.04 A 52 GLY HAx H 1 3.466 0.04 A 52 GLY C C 13 174.437 0.5 A 52 GLY CA C 13 45.118 0.5 A 52 GLY N N 15 111.981 0.5 A 53 ASP H H 1 8.062 0.04 A 53 ASP HA H 1 4.639 0.04 A 53 ASP HBy H 1 2.958 0.04 A 53 ASP HBx H 1 2.568 0.04 A 53 ASP C C 13 174.897 0.5 A 53 ASP CA C 13 55.349 0.5 A 53 ASP CB C 13 41.278 0.5 A 53 ASP N N 15 121.857 0.5 A 54 ARG H H 1 8.508 0.04 A 54 ARG HA H 1 5.247 0.04 A 54 ARG HBx H 1 1.688 0.04 A 54 ARG HBy H 1 1.688 0.04 A 54 ARG HDx H 1 3.186 0.04 A 54 ARG HDy H 1 3.186 0.04 A 54 ARG HGx H 1 1.672 0.04 A 54 ARG HGy H 1 1.672 0.04 A 54 ARG C C 13 176.875 0.5 A 54 ARG CA C 13 54.901 0.5 A 54 ARG CB C 13 32.232 0.5 A 54 ARG CD C 13 43.449 0.5 A 54 ARG CG C 13 28.288 0.5 A 54 ARG N N 15 120.102 0.5 A 55 VAL H H 1 9.038 0.04 A 55 VAL HA H 1 5.057 0.04 A 55 VAL HB H 1 2.003 0.04 A 55 VAL HGx% H 1 1.004 0.04 A 55 VAL HGy% H 1 0.861 0.04 A 55 VAL C C 13 174.003 0.5 A 55 VAL CA C 13 59.009 0.5 A 55 VAL CB C 13 35.352 0.5 A 55 VAL CGy C 13 22.062 0.5 A 55 VAL CGx C 13 19.895 0.5 A 55 VAL N N 15 117.345 0.5 A 56 ARG H H 1 9.230 0.04 A 56 ARG HA H 1 5.023 0.04 A 56 ARG HBx H 1 1.871 0.04 A 56 ARG HBy H 1 1.871 0.04 A 56 ARG HDx H 1 3.209 0.04 A 56 ARG HDy H 1 3.209 0.04 A 56 ARG HGx H 1 1.502 0.04 A 56 ARG HGy H 1 1.502 0.04 A 56 ARG C C 13 176.151 0.5 A 56 ARG CA C 13 55.038 0.5 A 56 ARG CB C 13 31.512 0.5 A 56 ARG CD C 13 43.385 0.5 A 56 ARG CG C 13 27.885 0.5 A 56 ARG N N 15 124.516 0.5 A 57 VAL H H 1 9.636 0.04 A 57 VAL HA H 1 4.629 0.04 A 57 VAL HB H 1 2.180 0.04 A 57 VAL HGx% H 1 0.997 0.04 A 57 VAL C C 13 174.711 0.5 A 57 VAL CA C 13 61.767 0.5 A 57 VAL CB C 13 33.988 0.5 A 57 VAL CGx C 13 22.005 0.5 A 57 VAL N N 15 128.969 0.5 A 58 THR H H 1 8.915 0.04 A 58 THR HA H 1 5.294 0.04 A 58 THR HB H 1 3.928 0.04 A 58 THR HG2% H 1 1.175 0.04 A 58 THR C C 13 174.454 0.5 A 58 THR CA C 13 61.954 0.5 A 58 THR CB C 13 69.175 0.5 A 58 THR CG2 C 13 21.584 0.5 A 58 THR N N 15 125.904 0.5 A 59 PHE H H 1 9.387 0.04 A 59 PHE HA H 1 5.879 0.04 A 59 PHE HBy H 1 2.791 0.04 A 59 PHE HBx H 1 2.619 0.04 A 59 PHE HDx H 1 6.783 0.04 A 59 PHE HDy H 1 6.783 0.04 A 59 PHE HEx H 1 6.871 0.04 A 59 PHE HEy H 1 6.871 0.04 A 59 PHE C C 13 171.357 0.5 A 59 PHE CA C 13 54.604 0.5 A 59 PHE CB C 13 42.959 0.5 A 59 PHE CDx C 13 132.072 0.5 A 59 PHE CEx C 13 131.108 0.5 A 59 PHE N N 15 125.503 0.5 A 60 ILE H H 1 9.481 0.04 A 60 ILE HA H 1 4.954 0.04 A 60 ILE HB H 1 1.842 0.04 A 60 ILE HD1% H 1 0.705 0.04 A 60 ILE HG1x H 1 1.330 0.04 A 60 ILE HG1y H 1 1.330 0.04 A 60 ILE HG2% H 1 0.778 0.04 A 60 ILE C C 13 176.250 0.5 A 60 ILE CA C 13 58.935 0.5 A 60 ILE CB C 13 39.300 0.5 A 60 ILE CD1 C 13 11.693 0.5 A 60 ILE CG1 C 13 27.901 0.5 A 60 ILE CG2 C 13 17.880 0.5 A 60 ILE N N 15 120.570 0.5 A 61 ARG H H 1 9.051 0.04 A 61 ARG HA H 1 4.801 0.04 A 61 ARG HBy H 1 2.205 0.04 A 61 ARG HBx H 1 1.496 0.04 A 61 ARG HDy H 1 3.350 0.04 A 61 ARG HDx H 1 2.842 0.04 A 61 ARG HGx H 1 1.838 0.04 A 61 ARG C C 13 176.083 0.5 A 61 ARG CA C 13 55.592 0.5 A 61 ARG CB C 13 34.548 0.5 A 61 ARG CD C 13 44.044 0.5 A 61 ARG CG C 13 25.035 0.5 A 61 ARG N N 15 130.529 0.5 A 62 ASP H H 1 9.858 0.04 A 62 ASP HA H 1 4.381 0.04 A 62 ASP HBy H 1 3.026 0.04 A 62 ASP HBx H 1 2.642 0.04 A 62 ASP C C 13 174.757 0.5 A 62 ASP CA C 13 56.179 0.5 A 62 ASP CB C 13 39.670 0.5 A 62 ASP N N 15 131.709 0.5 A 63 ARG H H 1 8.668 0.04 A 63 ARG HA H 1 3.651 0.04 A 63 ARG HBy H 1 2.125 0.04 A 63 ARG HBx H 1 1.611 0.04 A 63 ARG HDx H 1 3.242 0.04 A 63 ARG HDy H 1 3.242 0.04 A 63 ARG C C 13 174.954 0.5 A 63 ARG CA C 13 58.243 0.5 A 63 ARG CB C 13 28.035 0.5 A 63 ARG CD C 13 43.573 0.5 A 63 ARG N N 15 107.617 0.5 A 64 LYS H H 1 7.946 0.04 A 64 LYS HA H 1 4.600 0.04 A 64 LYS HBx H 1 1.763 0.04 A 64 LYS HBy H 1 1.763 0.04 A 64 LYS HDx H 1 1.706 0.04 A 64 LYS HDy H 1 1.706 0.04 A 64 LYS HEx H 1 3.010 0.04 A 64 LYS HEy H 1 3.010 0.04 A 64 LYS HGx H 1 1.384 0.04 A 64 LYS HGy H 1 1.384 0.04 A 64 LYS C C 13 174.428 0.5 A 64 LYS CA C 13 54.919 0.5 A 64 LYS CB C 13 35.170 0.5 A 64 LYS CD C 13 28.867 0.5 A 64 LYS CE C 13 42.362 0.5 A 64 LYS CG C 13 24.629 0.5 A 64 LYS N N 15 121.272 0.5 A 65 GLN H H 1 8.493 0.04 A 65 GLN HA H 1 4.623 0.04 A 65 GLN HBx H 1 1.805 0.04 A 65 GLN HBy H 1 1.805 0.04 A 65 GLN HGx H 1 2.002 0.04 A 65 GLN HGy H 1 2.002 0.04 A 65 GLN C C 13 174.630 0.5 A 65 GLN CA C 13 56.004 0.5 A 65 GLN CB C 13 30.298 0.5 A 65 GLN CG C 13 35.159 0.5 A 65 GLN N N 15 123.731 0.5 A 66 HIS H H 1 9.113 0.04 A 66 HIS HA H 1 4.547 0.04 A 66 HIS HBy H 1 2.440 0.04 A 66 HIS HBx H 1 0.962 0.04 A 66 HIS HD2 H 1 6.715 0.04 A 66 HIS C C 13 172.896 0.5 A 66 HIS CA C 13 54.399 0.5 A 66 HIS CB C 13 34.482 0.5 A 66 HIS CD2 C 13 120.500 0.5 A 66 HIS N N 15 125.388 0.5 A 67 GLU H H 1 8.296 0.04 A 67 GLU HA H 1 5.563 0.04 A 67 GLU HBx H 1 1.863 0.04 A 67 GLU HBy H 1 1.863 0.04 A 67 GLU HGx H 1 2.138 0.04 A 67 GLU HGy H 1 2.138 0.04 A 67 GLU C C 13 176.041 0.5 A 67 GLU CA C 13 54.720 0.5 A 67 GLU CB C 13 33.457 0.5 A 67 GLU CG C 13 36.648 0.5 A 67 GLU N N 15 117.528 0.5 A 68 ALA H H 1 9.160 0.04 A 68 ALA HA H 1 4.888 0.04 A 68 ALA HB% H 1 1.412 0.04 A 68 ALA C C 13 175.059 0.5 A 68 ALA CA C 13 51.081 0.5 A 68 ALA CB C 13 22.460 0.5 A 68 ALA N N 15 124.729 0.5 A 69 GLU H H 1 8.809 0.04 A 69 GLU HA H 1 5.172 0.04 A 69 GLU HBx H 1 1.970 0.04 A 69 GLU HBy H 1 1.970 0.04 A 69 GLU HGx H 1 2.133 0.04 A 69 GLU HGy H 1 2.133 0.04 A 69 GLU C C 13 174.991 0.5 A 69 GLU CA C 13 55.422 0.5 A 69 GLU CB C 13 31.144 0.5 A 69 GLU CG C 13 37.654 0.5 A 69 GLU N N 15 123.590 0.5 A 70 LEU H H 1 9.124 0.04 A 70 LEU HA H 1 4.852 0.04 A 70 LEU HBy H 1 1.459 0.04 A 70 LEU HBx H 1 1.282 0.04 A 70 LEU C C 13 174.757 0.5 A 70 LEU CA C 13 53.319 0.5 A 70 LEU CB C 13 44.702 0.5 A 70 LEU N N 15 126.591 0.5 A 71 VAL H H 1 8.277 0.04 A 71 VAL HA H 1 4.443 0.04 A 71 VAL HB H 1 1.931 0.04 A 71 VAL HGx% H 1 0.895 0.04 A 71 VAL C C 13 175.847 0.5 A 71 VAL CA C 13 61.302 0.5 A 71 VAL CB C 13 32.562 0.5 A 71 VAL CGx C 13 21.129 0.5 A 71 VAL N N 15 121.541 0.5 A 72 LEU H H 1 8.621 0.04 A 72 LEU HA H 1 4.043 0.04 A 72 LEU HBy H 1 1.934 0.04 A 72 LEU HBx H 1 1.067 0.04 A 72 LEU HDx% H 1 0.623 0.04 A 72 LEU HG H 1 0.816 0.04 A 72 LEU C C 13 177.010 0.5 A 72 LEU CA C 13 55.771 0.5 A 72 LEU CB C 13 42.111 0.5 A 72 LEU CDx C 13 23.223 0.5 A 72 LEU CG C 13 27.022 0.5 A 72 LEU N N 15 123.721 0.5 A 73 LYS H H 1 7.582 0.04 A 73 LYS HA H 1 4.877 0.04 A 73 LYS HBy H 1 1.828 0.04 A 73 LYS HBx H 1 1.694 0.04 A 73 LYS C C 13 172.099 0.5 A 73 LYS CA C 13 53.415 0.5 A 73 LYS CB C 13 36.407 0.5 A 73 LYS N N 15 120.485 0.5 A 74 PRO HA H 1 5.273 0.04 A 74 PRO HBy H 1 2.451 0.04 A 74 PRO HBx H 1 1.870 0.04 A 74 PRO HDx H 1 3.632 0.04 A 74 PRO HDy H 1 3.632 0.04 A 74 PRO HGx H 1 2.063 0.04 A 74 PRO C C 13 176.785 0.5 A 74 PRO CA C 13 61.547 0.5 A 74 PRO CB C 13 31.984 0.5 A 74 PRO CD C 13 51.380 0.5 A 74 PRO CG C 13 27.597 0.5 A 75 PHE H H 1 8.135 0.04 A 75 PHE HA H 1 4.755 0.04 A 75 PHE HBy H 1 3.209 0.04 A 75 PHE HBx H 1 3.015 0.04 A 75 PHE HDx H 1 7.402 0.04 A 75 PHE HDy H 1 7.402 0.04 A 75 PHE HEx H 1 7.196 0.04 A 75 PHE HEy H 1 7.196 0.04 A 75 PHE C C 13 176.184 0.5 A 75 PHE CA C 13 56.904 0.5 A 75 PHE CB C 13 39.053 0.5 A 75 PHE CDx C 13 132.319 0.5 A 75 PHE N N 15 121.675 0.5 A 76 PRO C C 13 177.857 0.5 A 77 HIS H H 1 8.547 0.04 A 77 HIS HA H 1 4.545 0.04 A 77 HIS HBx H 1 3.155 0.04 A 77 HIS HBy H 1 3.155 0.04 A 77 HIS C C 13 174.435 0.5 A 77 HIS CA C 13 56.204 0.5 A 77 HIS CB C 13 29.010 0.5 A 77 HIS N N 15 113.170 0.5 A 78 HIS H H 1 7.444 0.04 A 78 HIS HA H 1 5.085 0.04 A 78 HIS HBx H 1 3.133 0.04 A 78 HIS HBy H 1 3.133 0.04 A 78 HIS C C 13 172.040 0.5 A 78 HIS CA C 13 53.824 0.5 A 78 HIS CB C 13 30.623 0.5 A 78 HIS N N 15 116.822 0.5 A 79 PRO HA H 1 4.493 0.04 A 79 PRO HBy H 1 2.344 0.04 A 79 PRO HBx H 1 1.978 0.04 A 79 PRO HDy H 1 3.697 0.04 A 79 PRO HDx H 1 3.407 0.04 A 79 PRO HGx H 1 1.976 0.04 A 79 PRO HGy H 1 1.976 0.04 A 79 PRO C C 13 176.404 0.5 A 79 PRO CA C 13 64.768 0.5 A 79 PRO CB C 13 32.176 0.5 A 79 PRO CD C 13 50.334 0.5 A 79 PRO CG C 13 27.101 0.5 A 80 ASN H H 1 8.515 0.04 A 80 ASN HA H 1 4.790 0.04 A 80 ASN HBx H 1 2.919 0.04 A 80 ASN HBy H 1 2.919 0.04 A 80 ASN C C 13 174.492 0.5 A 80 ASN CA C 13 53.294 0.5 A 80 ASN CB C 13 38.383 0.5 A 80 ASN N N 15 114.037 0.5 A 81 GLN H H 1 8.369 0.04 A 81 GLN HA H 1 4.668 0.04 A 81 GLN HBx H 1 2.167 0.04 A 81 GLN HGx H 1 2.223 0.04 A 81 GLN HGy H 1 2.223 0.04 A 81 GLN C C 13 173.563 0.5 A 81 GLN CA C 13 54.950 0.5 A 81 GLN CB C 13 30.691 0.5 A 81 GLN CG C 13 33.873 0.5 A 81 GLN N N 15 122.498 0.5 A 82 ILE HA H 1 4.649 0.04 A 82 ILE HB H 1 1.713 0.04 A 82 ILE HD1% H 1 0.585 0.04 A 82 ILE HG12 H 1 1.316 0.04 A 82 ILE HG13 H 1 1.316 0.04 A 82 ILE HG2% H 1 0.599 0.04 A 82 ILE C C 13 176.221 0.5 A 82 ILE CA C 13 58.593 0.5 A 82 ILE CB C 13 39.189 0.5 A 82 ILE CD1 C 13 12.046 0.5 A 82 ILE CG1 C 13 26.056 0.5 A 82 ILE CG2 C 13 18.468 0.5 A 83 GLY H H 1 7.971 0.04 A 83 GLY HAy H 1 4.143 0.04 A 83 GLY HAx H 1 4.056 0.04 A 83 GLY CA C 13 46.447 0.5 A 83 GLY N N 15 106.440 0.5 A 84 LEU HA H 1 4.263 0.04 A 84 LEU HBx H 1 1.981 0.04 A 84 LEU HBy H 1 1.981 0.04 A 84 LEU C C 13 177.910 0.5 A 84 LEU CA C 13 58.001 0.5 A 84 LEU CB C 13 43.547 0.5 A 85 GLY H H 1 7.359 0.04 A 85 GLY HAy H 1 4.253 0.04 A 85 GLY HAx H 1 3.786 0.04 A 85 GLY CA C 13 45.131 0.5 A 85 GLY N N 15 104.324 0.5 A 86 VAL HA H 1 5.226 0.04 A 86 VAL HB H 1 2.214 0.04 A 86 VAL HGx% H 1 0.728 0.04 A 86 VAL HGy% H 1 0.708 0.04 A 86 VAL C C 13 174.897 0.5 A 86 VAL CA C 13 58.541 0.5 A 86 VAL CB C 13 35.247 0.5 A 86 VAL CGy C 13 23.065 0.5 A 86 VAL CGx C 13 18.660 0.5 A 87 THR H H 1 8.475 0.04 A 87 THR HA H 1 4.797 0.04 A 87 THR HB H 1 4.172 0.04 A 87 THR HG2% H 1 1.145 0.04 A 87 THR C C 13 174.248 0.5 A 87 THR CA C 13 61.160 0.5 A 87 THR CB C 13 69.983 0.5 A 87 THR N N 15 115.252 0.5 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 3 GLU H A 2 ASN HBx 1.0 1.8 5.01 2 1 A 2 ASN HBy A 3 GLU H 1.0 1.8 5.01 3 2 A 3 GLU HA A 3 GLU HGx 1.0 1.8 4.21 4 2 A 3 GLU HA A 3 GLU HGy 1.0 1.8 4.21 5 3 A 3 GLU HA A 4 ALA H 1.0 1.8 3.90 6 4 A 3 GLU H A 3 GLU HGx 1.0 1.8 4.01 7 4 A 3 GLU H A 3 GLU HGy 1.0 1.8 4.01 8 5 A 3 GLU H A 4 ALA H 1.0 1.8 4.48 9 6 A 4 ALA H A 3 GLU HBx 1.0 1.8 4.18 10 6 A 4 ALA H A 3 GLU HBy 1.0 1.8 4.18 11 7 A 4 ALA H A 3 GLU HGx 1.0 1.8 4.44 12 7 A 3 GLU HGy A 4 ALA H 1.0 1.8 4.44 13 8 A 4 ALA HA A 5 LYS H 1.0 1.8 3.76 14 9 A 4 ALA H A 4 ALA HB% 1.0 1.8 3.07 15 10 A 5 LYS HA A 6 GLY H 1.0 1.8 3.72 16 11 A 5 LYS H A 5 LYS HBx 1.0 1.8 3.57 17 11 A 5 LYS H A 5 LYS HBy 1.0 1.8 3.57 18 12 A 6 GLY H A 5 LYS HBx 1.0 1.8 4.42 19 12 A 6 GLY H A 5 LYS HBy 1.0 1.8 4.42 20 13 A 8 TYR HE% A 5 LYS HBx 1.0 1.8 5.20 21 13 A 5 LYS HBy A 8 TYR HE% 1.0 1.8 5.20 22 14 A 5 LYS HDx A 5 LYS HGx 1.0 1.8 2.72 23 14 A 5 LYS HDy A 5 LYS HGx 1.0 1.8 2.72 24 14 A 5 LYS HGy A 5 LYS HDx 1.0 1.8 2.72 25 14 A 5 LYS HGy A 5 LYS HDy 1.0 1.8 2.72 26 15 A 6 GLY H A 5 LYS HGx 1.0 1.8 4.30 27 15 A 6 GLY H A 5 LYS HGy 1.0 1.8 4.30 28 16 A 6 GLY H A 7 VAL HGy% 1.0 1.8 4.61 29 16 A 6 GLY H A 7 VAL HGx% 1.0 1.8 4.61 30 17 A 6 GLY H A 8 TYR HD% 1.0 1.8 5.54 31 18 A 6 GLY H A 8 TYR HE% 1.0 1.8 4.37 32 19 A 6 GLY H A 27 ARG HBy 1.0 1.8 5.08 33 20 A 6 GLY H A 27 ARG HDx 1.0 1.8 4.52 34 21 A 6 GLY H A 27 ARG HDy 1.0 1.8 4.52 35 22 A 6 GLY H A 37 ASN HA 1.0 1.8 5.91 36 23 A 7 VAL HB A 6 GLY HAy 1.0 1.8 5.56 37 23 A 6 GLY HAx A 7 VAL HB 1.0 1.8 5.56 38 24 A 7 VAL HGx% A 7 VAL HA 1.0 1.8 3.81 39 25 A 7 VAL HA A 7 VAL HGy% 1.0 1.8 3.81 40 26 A 7 VAL HA A 8 TYR H 1.0 1.8 2.94 41 27 A 8 TYR HD% A 7 VAL HA 1.0 1.8 4.40 42 28 A 7 VAL HB A 28 ILE H 1.0 1.8 4.58 43 29 A 7 VAL HB A 7 VAL H 1.0 1.8 3.71 44 30 A 7 VAL H A 7 VAL HGy% 1.0 1.8 3.40 45 30 A 7 VAL HGx% A 7 VAL H 1.0 1.8 3.40 46 31 A 8 TYR H A 7 VAL H 1.0 1.8 4.39 47 32 A 7 VAL H A 27 ARG HA 1.0 1.8 4.91 48 33 A 28 ILE H A 7 VAL H 1.0 1.8 3.82 49 34 A 8 TYR H A 7 VAL HGy% 1.0 1.8 3.05 50 34 A 7 VAL HGx% A 8 TYR H 1.0 1.8 3.05 51 35 A 8 TYR HD% A 7 VAL HGy% 1.0 1.8 4.96 52 35 A 7 VAL HGx% A 8 TYR HD% 1.0 1.8 4.96 53 36 A 28 ILE H A 7 VAL HGy% 1.0 1.8 4.86 54 36 A 7 VAL HGx% A 28 ILE H 1.0 1.8 4.86 55 37 A 37 ASN HA A 7 VAL HGy% 1.0 1.8 4.50 56 37 A 7 VAL HGx% A 37 ASN HA 1.0 1.8 4.50 57 38 A 38 THR H A 7 VAL HGy% 1.0 1.8 4.39 58 38 A 7 VAL HGx% A 38 THR H 1.0 1.8 4.39 59 39 A 8 TYR H A 8 TYR HBx 1.0 1.8 3.21 60 39 A 8 TYR H A 8 TYR HBy 1.0 1.8 3.21 61 40 A 8 TYR HD% A 8 TYR H 1.0 1.8 3.80 62 41 A 8 TYR H A 9 VAL H 1.0 1.8 4.65 63 42 A 9 VAL H A 8 TYR HBx 1.0 1.8 4.03 64 42 A 8 TYR HBy A 9 VAL H 1.0 1.8 4.03 65 43 A 8 TYR HD% A 27 ARG HBx 1.0 1.8 4.12 66 44 A 9 VAL HA A 9 VAL HGx% 1.0 1.8 3.80 67 45 A 9 VAL HA A 9 VAL HGy% 1.0 1.8 3.80 68 46 A 9 VAL HA A 10 MET H 1.0 1.8 3.08 69 47 A 9 VAL HB A 24 ALA HA 1.0 1.8 4.35 70 48 A 9 VAL HB A 25 GLY H 1.0 1.8 3.91 71 49 A 9 VAL HB A 26 ASP H 1.0 1.8 4.04 72 50 A 9 VAL H A 9 VAL HB 1.0 1.8 3.90 73 51 A 9 VAL H A 9 VAL HGy% 1.0 1.8 3.17 74 51 A 9 VAL H A 9 VAL HGx% 1.0 1.8 3.17 75 52 A 9 VAL H A 9 VAL HGx% 1.0 1.8 4.08 76 53 A 9 VAL H A 9 VAL HGy% 1.0 1.8 4.08 77 54 A 9 VAL H A 10 MET H 1.0 1.8 4.78 78 55 A 9 VAL H A 25 GLY H 1.0 1.8 4.29 79 56 A 9 VAL H A 26 ASP H 1.0 1.8 4.62 80 57 A 10 MET H A 9 VAL HGy% 1.0 1.8 3.30 81 57 A 10 MET H A 9 VAL HGx% 1.0 1.8 3.30 82 58 A 11 SER HA A 9 VAL HGy% 1.0 1.8 4.75 83 58 A 9 VAL HGx% A 11 SER HA 1.0 1.8 4.75 84 59 A 11 SER H A 9 VAL HGy% 1.0 1.8 3.21 85 59 A 9 VAL HGx% A 11 SER H 1.0 1.8 3.21 86 60 A 9 VAL HGy% A 22 LEU HDy% 1.0 1.8 3.42 87 60 A 22 LEU HDx% A 9 VAL HGy% 1.0 1.8 3.42 88 60 A 9 VAL HGx% A 22 LEU HDx% 1.0 1.8 3.42 89 60 A 9 VAL HGx% A 22 LEU HDy% 1.0 1.8 3.42 90 61 A 23 GLU H A 9 VAL HGy% 1.0 1.8 4.26 91 61 A 9 VAL HGx% A 23 GLU H 1.0 1.8 4.26 92 62 A 24 ALA HA A 9 VAL HGy% 1.0 1.8 4.20 93 62 A 24 ALA HA A 9 VAL HGx% 1.0 1.8 4.20 94 63 A 26 ASP H A 9 VAL HGy% 1.0 1.8 3.74 95 63 A 26 ASP H A 9 VAL HGx% 1.0 1.8 3.74 96 64 A 26 ASP HBx A 9 VAL HGy% 1.0 1.8 4.24 97 64 A 9 VAL HGx% A 26 ASP HBx 1.0 1.8 4.24 98 65 A 26 ASP HBy A 9 VAL HGy% 1.0 1.8 4.66 99 65 A 9 VAL HGx% A 26 ASP HBy 1.0 1.8 4.66 100 66 A 86 VAL HA A 9 VAL HGy% 1.0 1.8 5.42 101 66 A 9 VAL HGx% A 86 VAL HA 1.0 1.8 5.42 102 67 A 10 MET H A 9 VAL HGx% 1.0 1.8 3.95 103 68 A 9 VAL HGx% A 26 ASP HBx 1.0 1.8 5.43 104 69 A 10 MET H A 9 VAL HGy% 1.0 1.8 3.95 105 70 A 26 ASP HBx A 9 VAL HGy% 1.0 1.8 5.43 106 71 A 10 MET H A 10 MET HBx 1.0 1.8 3.34 107 71 A 10 MET H A 10 MET HBy 1.0 1.8 3.34 108 72 A 10 MET H A 10 MET HBx 1.0 1.8 3.84 109 73 A 10 MET H A 10 MET HBy 1.0 1.8 3.84 110 74 A 10 MET H A 10 MET HGx 1.0 1.8 3.65 111 74 A 10 MET H A 10 MET HGy 1.0 1.8 3.65 112 75 A 10 MET H A 10 MET HGx 1.0 1.8 4.26 113 76 A 10 MET H A 10 MET HGy 1.0 1.8 4.26 114 77 A 10 MET H A 11 SER H 1.0 1.8 3.13 115 78 A 10 MET H A 86 VAL HA 1.0 1.8 5.38 116 79 A 10 MET H A 86 VAL HGy% 1.0 1.8 4.90 117 79 A 10 MET H A 86 VAL HGx% 1.0 1.8 4.90 118 80 A 10 MET H A 87 THR H 1.0 1.8 5.00 119 81 A 11 SER HA A 10 MET HBx 1.0 1.8 5.16 120 81 A 11 SER HA A 10 MET HBy 1.0 1.8 5.16 121 82 A 10 MET HBx A 86 VAL HGy% 1.0 1.8 4.27 122 82 A 10 MET HBy A 86 VAL HGy% 1.0 1.8 4.27 123 82 A 86 VAL HGx% A 10 MET HBx 1.0 1.8 4.27 124 82 A 10 MET HBy A 86 VAL HGx% 1.0 1.8 4.27 125 83 A 87 THR HB A 10 MET HBx 1.0 1.8 4.42 126 83 A 10 MET HBy A 87 THR HB 1.0 1.8 4.42 127 84 A 87 THR H A 10 MET HBx 1.0 1.8 4.86 128 84 A 10 MET HBy A 87 THR H 1.0 1.8 4.86 129 85 A 11 SER H A 10 MET HBx 1.0 1.8 3.72 130 86 A 87 THR HB A 10 MET HBx 1.0 1.8 5.06 131 87 A 11 SER H A 10 MET HBy 1.0 1.8 3.72 132 88 A 10 MET HBy A 87 THR HB 1.0 1.8 5.06 133 89 A 86 VAL HA A 10 MET HGx 1.0 1.8 5.76 134 89 A 86 VAL HA A 10 MET HGy 1.0 1.8 5.76 135 90 A 11 SER H A 10 MET HGx 1.0 1.8 4.63 136 91 A 11 SER H A 10 MET HGy 1.0 1.8 4.63 137 92 A 11 SER HA A 12 VAL HB 1.0 1.8 5.80 138 93 A 11 SER HA A 12 VAL H 1.0 1.8 3.31 139 94 A 11 SER HA A 12 VAL HGy% 1.0 1.8 4.93 140 94 A 11 SER HA A 12 VAL HGx% 1.0 1.8 4.93 141 95 A 11 SER HA A 24 ALA HB% 1.0 1.8 4.00 142 96 A 11 SER H A 11 SER HBx 1.0 1.8 3.86 143 96 A 11 SER H A 11 SER HBy 1.0 1.8 3.86 144 97 A 11 SER H A 12 VAL H 1.0 1.8 4.53 145 98 A 24 ALA HA A 11 SER H 1.0 1.8 6.00 146 99 A 11 SER H A 24 ALA HB% 1.0 1.8 5.65 147 100 A 11 SER H A 86 VAL HA 1.0 1.8 5.83 148 101 A 11 SER H A 87 THR HA 1.0 1.8 5.76 149 102 A 11 SER H A 87 THR HB 1.0 1.8 3.91 150 103 A 11 SER H A 87 THR H 1.0 1.8 4.33 151 104 A 11 SER H A 87 THR HG2% 1.0 1.8 5.35 152 105 A 12 VAL H A 11 SER HBx 1.0 1.8 3.19 153 105 A 12 VAL H A 11 SER HBy 1.0 1.8 3.19 154 106 A 12 VAL HA A 13 LEU H 1.0 1.8 2.88 155 107 A 12 VAL HB A 13 LEU H 1.0 1.8 4.08 156 108 A 12 VAL HB A 12 VAL H 1.0 1.8 3.46 157 109 A 12 VAL H A 12 VAL HGy% 1.0 1.8 3.08 158 109 A 12 VAL H A 12 VAL HGx% 1.0 1.8 3.08 159 110 A 12 VAL H A 12 VAL HGx% 1.0 1.8 3.75 160 111 A 12 VAL H A 12 VAL HGy% 1.0 1.8 3.75 161 112 A 12 VAL H A 24 ALA HB% 1.0 1.8 4.05 162 113 A 13 LEU H A 12 VAL HGy% 1.0 1.8 3.24 163 113 A 12 VAL HGx% A 13 LEU H 1.0 1.8 3.24 164 114 A 19 ALA HA A 12 VAL HGy% 1.0 1.8 3.42 165 114 A 12 VAL HGx% A 19 ALA HA 1.0 1.8 3.42 166 115 A 19 ALA H A 12 VAL HGy% 1.0 1.8 4.23 167 115 A 12 VAL HGx% A 19 ALA H 1.0 1.8 4.23 168 116 A 19 ALA HB% A 12 VAL HGy% 1.0 1.8 3.72 169 116 A 12 VAL HGx% A 19 ALA HB% 1.0 1.8 3.72 170 117 A 20 GLY H A 12 VAL HGy% 1.0 1.8 3.69 171 117 A 12 VAL HGx% A 20 GLY H 1.0 1.8 3.69 172 118 A 21 ARG H A 12 VAL HGy% 1.0 1.8 4.57 173 118 A 12 VAL HGx% A 21 ARG H 1.0 1.8 4.57 174 119 A 22 LEU H A 12 VAL HGy% 1.0 1.8 4.27 175 119 A 12 VAL HGx% A 22 LEU H 1.0 1.8 4.27 176 120 A 23 GLU HA A 12 VAL HGy% 1.0 1.8 3.58 177 120 A 12 VAL HGx% A 23 GLU HA 1.0 1.8 3.58 178 121 A 23 GLU H A 12 VAL HGy% 1.0 1.8 5.03 179 121 A 23 GLU H A 12 VAL HGx% 1.0 1.8 5.03 180 122 A 23 GLU HBx A 12 VAL HGy% 1.0 1.8 4.70 181 122 A 12 VAL HGx% A 23 GLU HBx 1.0 1.8 4.70 182 123 A 24 ALA HA A 12 VAL HGy% 1.0 1.8 4.02 183 123 A 24 ALA HA A 12 VAL HGx% 1.0 1.8 4.02 184 124 A 24 ALA H A 12 VAL HGy% 1.0 1.8 3.17 185 124 A 12 VAL HGx% A 24 ALA H 1.0 1.8 3.17 186 125 A 12 VAL HGx% A 13 LEU H 1.0 1.8 4.67 187 126 A 12 VAL HGx% A 24 ALA H 1.0 1.8 4.43 188 127 A 13 LEU H A 12 VAL HGy% 1.0 1.8 4.67 189 128 A 24 ALA H A 12 VAL HGy% 1.0 1.8 4.43 190 129 A 13 LEU HA A 13 LEU HDy% 1.0 1.8 3.66 191 129 A 13 LEU HA A 13 LEU HDx% 1.0 1.8 3.66 192 130 A 13 LEU HA A 13 LEU HDx% 1.0 1.8 4.38 193 131 A 13 LEU HA A 13 LEU HDy% 1.0 1.8 4.38 194 132 A 13 LEU HA A 14 PRO HDx 1.0 1.8 3.37 195 132 A 13 LEU HA A 14 PRO HDy 1.0 1.8 3.37 196 133 A 13 LEU H A 13 LEU HBx 1.0 1.8 3.25 197 134 A 13 LEU H A 13 LEU HBy 1.0 1.8 3.25 198 135 A 13 LEU H A 13 LEU HDy% 1.0 1.8 3.74 199 135 A 13 LEU H A 13 LEU HDx% 1.0 1.8 3.74 200 136 A 13 LEU H A 14 PRO HDx 1.0 1.8 4.69 201 136 A 13 LEU H A 14 PRO HDy 1.0 1.8 4.69 202 137 A 13 LEU H A 16 MET HBx 1.0 1.8 4.37 203 137 A 13 LEU H A 16 MET HBy 1.0 1.8 4.37 204 138 A 13 LEU H A 16 MET HGy 1.0 1.8 4.49 205 138 A 13 LEU H A 16 MET HGx 1.0 1.8 4.49 206 139 A 13 LEU H A 18 ALA HB% 1.0 1.8 5.03 207 140 A 13 LEU H A 19 ALA H 1.0 1.8 5.64 208 141 A 13 LEU HBx A 14 PRO HDx 1.0 1.8 4.26 209 141 A 13 LEU HBy A 14 PRO HDx 1.0 1.8 4.26 210 141 A 14 PRO HDy A 13 LEU HBy 1.0 1.8 4.26 211 141 A 14 PRO HDy A 13 LEU HBx 1.0 1.8 4.26 212 142 A 13 LEU HDy% A 14 PRO HDx 1.0 1.8 4.31 213 142 A 13 LEU HDx% A 14 PRO HDx 1.0 1.8 4.31 214 142 A 14 PRO HDy A 13 LEU HDy% 1.0 1.8 4.31 215 142 A 13 LEU HDx% A 14 PRO HDy 1.0 1.8 4.31 216 143 A 13 LEU HDy% A 16 MET HGy 1.0 1.8 5.57 217 143 A 13 LEU HDx% A 16 MET HGy 1.0 1.8 5.57 218 143 A 16 MET HGx A 13 LEU HDy% 1.0 1.8 5.57 219 143 A 13 LEU HDx% A 16 MET HGx 1.0 1.8 5.57 220 144 A 14 PRO HA A 16 MET H 1.0 1.8 4.57 221 145 A 19 ALA HB% A 14 PRO HA 1.0 1.8 3.63 222 146 A 19 ALA HB% A 14 PRO HBy 1.0 1.8 5.36 223 146 A 19 ALA HB% A 14 PRO HBx 1.0 1.8 5.36 224 147 A 15 ASN H A 14 PRO HGx 1.0 1.8 4.69 225 147 A 14 PRO HGy A 15 ASN H 1.0 1.8 4.69 226 148 A 15 ASN HA A 15 ASN HD2y 1.0 1.8 4.65 227 148 A 15 ASN HA A 15 ASN HD2x 1.0 1.8 4.65 228 149 A 16 MET H A 15 ASN HA 1.0 1.8 3.31 229 150 A 15 ASN H A 15 ASN HBx 1.0 1.8 4.14 230 150 A 15 ASN H A 15 ASN HBy 1.0 1.8 4.14 231 151 A 16 MET H A 15 ASN H 1.0 1.8 3.38 232 152 A 19 ALA HB% A 15 ASN H 1.0 1.8 4.23 233 153 A 15 ASN HD2y A 15 ASN HBx 1.0 1.8 3.03 234 153 A 15 ASN HBy A 15 ASN HD2y 1.0 1.8 3.03 235 153 A 15 ASN HD2x A 15 ASN HBx 1.0 1.8 3.03 236 153 A 15 ASN HBy A 15 ASN HD2x 1.0 1.8 3.03 237 154 A 15 ASN HD2y A 15 ASN HBx 1.0 1.8 3.65 238 154 A 15 ASN HBy A 15 ASN HD2y 1.0 1.8 3.65 239 155 A 15 ASN HD2x A 15 ASN HBx 1.0 1.8 3.65 240 155 A 15 ASN HBy A 15 ASN HD2x 1.0 1.8 3.65 241 156 A 16 MET HA A 15 ASN HBx 1.0 1.8 4.98 242 156 A 15 ASN HBy A 16 MET HA 1.0 1.8 4.98 243 157 A 16 MET H A 15 ASN HBx 1.0 1.8 3.84 244 157 A 16 MET H A 15 ASN HBy 1.0 1.8 3.84 245 158 A 15 ASN HBx A 16 MET HBx 1.0 1.8 5.13 246 158 A 15 ASN HBy A 16 MET HBx 1.0 1.8 5.13 247 158 A 16 MET HBy A 15 ASN HBx 1.0 1.8 5.13 248 158 A 16 MET HBy A 15 ASN HBy 1.0 1.8 5.13 249 159 A 16 MET HA A 17 PRO HBy 1.0 1.8 5.96 250 160 A 16 MET HA A 17 PRO HDx 1.0 1.8 3.52 251 160 A 16 MET HA A 17 PRO HDy 1.0 1.8 3.52 252 161 A 16 MET HA A 18 ALA H 1.0 1.8 5.12 253 162 A 19 ALA H A 16 MET HA 1.0 1.8 4.98 254 163 A 16 MET H A 16 MET HBx 1.0 1.8 3.08 255 163 A 16 MET HBy A 16 MET H 1.0 1.8 3.08 256 164 A 16 MET H A 16 MET HGy 1.0 1.8 4.03 257 164 A 16 MET HGx A 16 MET H 1.0 1.8 4.03 258 165 A 16 MET H A 17 PRO HDx 1.0 1.8 4.48 259 165 A 16 MET H A 17 PRO HDy 1.0 1.8 4.48 260 166 A 16 MET H A 17 PRO HDx 1.0 1.8 5.09 261 167 A 16 MET H A 17 PRO HDy 1.0 1.8 5.09 262 168 A 16 MET H A 18 ALA H 1.0 1.8 5.13 263 169 A 19 ALA HA A 16 MET H 1.0 1.8 5.33 264 170 A 19 ALA H A 16 MET H 1.0 1.8 3.96 265 171 A 19 ALA HB% A 16 MET H 1.0 1.8 3.06 266 172 A 16 MET HBy A 17 PRO HDx 1.0 1.8 4.42 267 172 A 16 MET HBx A 17 PRO HDx 1.0 1.8 4.42 268 172 A 17 PRO HDy A 16 MET HBx 1.0 1.8 4.42 269 172 A 16 MET HBy A 17 PRO HDy 1.0 1.8 4.42 270 173 A 18 ALA H A 16 MET HBx 1.0 1.8 4.02 271 173 A 16 MET HBy A 18 ALA H 1.0 1.8 4.02 272 174 A 19 ALA H A 16 MET HBx 1.0 1.8 4.42 273 174 A 19 ALA H A 16 MET HBy 1.0 1.8 4.42 274 175 A 19 ALA HB% A 16 MET HGy 1.0 1.8 5.67 275 175 A 19 ALA HB% A 16 MET HGx 1.0 1.8 5.67 276 176 A 19 ALA H A 17 PRO HA 1.0 1.8 4.12 277 177 A 17 PRO HBy A 18 ALA H 1.0 1.8 4.43 278 178 A 18 ALA H A 17 PRO HDx 1.0 1.8 3.92 279 178 A 17 PRO HDy A 18 ALA H 1.0 1.8 3.92 280 179 A 18 ALA H A 17 PRO HDx 1.0 1.8 4.16 281 180 A 18 ALA H A 17 PRO HDx 1.0 1.8 4.57 282 181 A 18 ALA HB% A 17 PRO HDx 1.0 1.8 5.07 283 182 A 71 VAL H A 17 PRO HDx 1.0 1.8 5.36 284 183 A 17 PRO HDy A 18 ALA H 1.0 1.8 4.57 285 184 A 21 ARG H A 18 ALA HA 1.0 1.8 4.60 286 185 A 18 ALA HA A 68 ALA HB% 1.0 1.8 4.85 287 186 A 18 ALA HA A 69 GLU H 1.0 1.8 5.71 288 187 A 18 ALA HB% A 18 ALA H 1.0 1.8 2.94 289 188 A 19 ALA H A 18 ALA H 1.0 1.8 2.97 290 189 A 19 ALA HB% A 18 ALA H 1.0 1.8 4.13 291 190 A 19 ALA H A 18 ALA HB% 1.0 1.8 3.38 292 191 A 19 ALA HB% A 18 ALA HB% 1.0 1.8 4.93 293 192 A 21 ARG H A 18 ALA HB% 1.0 1.8 4.89 294 193 A 18 ALA HB% A 21 ARG HBx 1.0 1.8 5.08 295 193 A 18 ALA HB% A 21 ARG HBy 1.0 1.8 5.08 296 194 A 18 ALA HB% A 22 LEU HDy% 1.0 1.8 3.74 297 194 A 22 LEU HDx% A 18 ALA HB% 1.0 1.8 3.74 298 195 A 86 VAL HGx% A 18 ALA HB% 1.0 1.8 4.69 299 196 A 18 ALA HB% A 86 VAL HGy% 1.0 1.8 4.69 300 197 A 19 ALA HA A 20 GLY H 1.0 1.8 2.85 301 198 A 19 ALA HA A 21 ARG H 1.0 1.8 4.18 302 199 A 19 ALA H A 19 ALA HB% 1.0 1.8 2.61 303 200 A 19 ALA H A 20 GLY H 1.0 1.8 4.42 304 201 A 19 ALA H A 21 ARG H 1.0 1.8 4.47 305 202 A 19 ALA H A 22 LEU H 1.0 1.8 5.39 306 203 A 19 ALA HB% A 20 GLY H 1.0 1.8 3.39 307 204 A 19 ALA HB% A 20 GLY HAy 1.0 1.8 4.38 308 204 A 19 ALA HB% A 20 GLY HAx 1.0 1.8 4.38 309 205 A 20 GLY H A 21 ARG H 1.0 1.8 3.26 310 206 A 20 GLY H A 22 LEU H 1.0 1.8 4.58 311 207 A 22 LEU H A 20 GLY HAy 1.0 1.8 5.73 312 207 A 22 LEU H A 20 GLY HAx 1.0 1.8 5.73 313 208 A 21 ARG H A 21 ARG HBx 1.0 1.8 2.90 314 208 A 21 ARG H A 21 ARG HBy 1.0 1.8 2.90 315 209 A 21 ARG H A 21 ARG HDx 1.0 1.8 5.08 316 209 A 21 ARG H A 21 ARG HDy 1.0 1.8 5.08 317 210 A 21 ARG H A 22 LEU H 1.0 1.8 2.75 318 211 A 22 LEU H A 21 ARG HBx 1.0 1.8 3.09 319 211 A 22 LEU H A 21 ARG HBy 1.0 1.8 3.09 320 212 A 21 ARG HBy A 22 LEU HDy% 1.0 1.8 4.38 321 212 A 21 ARG HBx A 22 LEU HDy% 1.0 1.8 4.38 322 212 A 22 LEU HDx% A 21 ARG HBx 1.0 1.8 4.38 323 212 A 22 LEU HDx% A 21 ARG HBy 1.0 1.8 4.38 324 213 A 69 GLU H A 21 ARG HBx 1.0 1.8 4.49 325 213 A 69 GLU H A 21 ARG HBy 1.0 1.8 4.49 326 214 A 22 LEU H A 21 ARG HDx 1.0 1.8 4.83 327 214 A 22 LEU H A 21 ARG HDy 1.0 1.8 4.83 328 215 A 21 ARG HDx A 22 LEU HDy% 1.0 1.8 5.22 329 215 A 21 ARG HDy A 22 LEU HDy% 1.0 1.8 5.22 330 215 A 22 LEU HDx% A 21 ARG HDx 1.0 1.8 5.22 331 215 A 22 LEU HDx% A 21 ARG HDy 1.0 1.8 5.22 332 216 A 68 ALA HB% A 21 ARG HDx 1.0 1.8 4.30 333 216 A 68 ALA HB% A 21 ARG HDy 1.0 1.8 4.30 334 217 A 69 GLU H A 21 ARG HDx 1.0 1.8 4.53 335 217 A 69 GLU H A 21 ARG HDy 1.0 1.8 4.53 336 218 A 22 LEU HA A 22 LEU HDy% 1.0 1.8 3.19 337 218 A 22 LEU HDx% A 22 LEU HA 1.0 1.8 3.19 338 219 A 22 LEU HDx% A 22 LEU HA 1.0 1.8 3.94 339 220 A 22 LEU HA A 22 LEU HDy% 1.0 1.8 3.94 340 221 A 23 GLU HA A 22 LEU HA 1.0 1.8 5.05 341 222 A 23 GLU H A 22 LEU HA 1.0 1.8 2.89 342 223 A 68 ALA HB% A 22 LEU HA 1.0 1.8 5.21 343 224 A 22 LEU H A 22 LEU HG 1.0 1.8 4.57 344 225 A 22 LEU H A 22 LEU HBx 1.0 1.8 3.28 345 225 A 22 LEU H A 22 LEU HBy 1.0 1.8 3.28 346 226 A 22 LEU HDx% A 22 LEU H 1.0 1.8 4.29 347 227 A 22 LEU H A 22 LEU HDy% 1.0 1.8 4.29 348 228 A 23 GLU H A 22 LEU H 1.0 1.8 4.53 349 229 A 22 LEU H A 23 GLU HGx 1.0 1.8 5.00 350 229 A 22 LEU H A 23 GLU HGy 1.0 1.8 5.00 351 230 A 23 GLU H A 22 LEU HDy% 1.0 1.8 3.29 352 230 A 22 LEU HDx% A 23 GLU H 1.0 1.8 3.29 353 231 A 23 GLU HBx A 22 LEU HDy% 1.0 1.8 5.52 354 231 A 22 LEU HDx% A 23 GLU HBx 1.0 1.8 5.52 355 232 A 26 ASP H A 22 LEU HDy% 1.0 1.8 4.10 356 232 A 26 ASP H A 22 LEU HDx% 1.0 1.8 4.10 357 233 A 26 ASP HBx A 22 LEU HDy% 1.0 1.8 4.96 358 233 A 22 LEU HDx% A 26 ASP HBx 1.0 1.8 4.96 359 234 A 26 ASP HBy A 22 LEU HDy% 1.0 1.8 3.68 360 234 A 22 LEU HDx% A 26 ASP HBy 1.0 1.8 3.68 361 235 A 59 PHE HBy A 22 LEU HDy% 1.0 1.8 3.89 362 235 A 22 LEU HDx% A 59 PHE HBy 1.0 1.8 3.89 363 236 A 59 PHE HD% A 22 LEU HDy% 1.0 1.8 3.29 364 236 A 22 LEU HDx% A 59 PHE HD% 1.0 1.8 3.29 365 237 A 59 PHE HE% A 22 LEU HDy% 1.0 1.8 3.96 366 237 A 22 LEU HDx% A 59 PHE HE% 1.0 1.8 3.96 367 238 A 68 ALA HB% A 22 LEU HDy% 1.0 1.8 3.68 368 238 A 22 LEU HDx% A 68 ALA HB% 1.0 1.8 3.68 369 239 A 22 LEU HDx% A 23 GLU H 1.0 1.8 4.25 370 240 A 22 LEU HDx% A 26 ASP HBy 1.0 1.8 4.39 371 241 A 22 LEU HDx% A 59 PHE HD% 1.0 1.8 4.68 372 242 A 22 LEU HDx% A 59 PHE HE% 1.0 1.8 4.57 373 243 A 22 LEU HDx% A 68 ALA HB% 1.0 1.8 4.38 374 244 A 23 GLU H A 22 LEU HDy% 1.0 1.8 4.25 375 245 A 26 ASP HBy A 22 LEU HDy% 1.0 1.8 4.39 376 246 A 59 PHE HD% A 22 LEU HDy% 1.0 1.8 4.68 377 247 A 59 PHE HE% A 22 LEU HDy% 1.0 1.8 4.57 378 248 A 68 ALA HB% A 22 LEU HDy% 1.0 1.8 4.38 379 249 A 23 GLU HA A 23 GLU HGx 1.0 1.8 3.86 380 249 A 23 GLU HA A 23 GLU HGy 1.0 1.8 3.86 381 250 A 24 ALA HA A 23 GLU HA 1.0 1.8 5.31 382 251 A 23 GLU HA A 24 ALA H 1.0 1.8 2.66 383 252 A 24 ALA HB% A 23 GLU HA 1.0 1.8 4.41 384 253 A 23 GLU H A 23 GLU HBx 1.0 1.8 4.36 385 254 A 23 GLU H A 23 GLU HBy 1.0 1.8 3.69 386 255 A 23 GLU H A 23 GLU HGx 1.0 1.8 3.79 387 255 A 23 GLU H A 23 GLU HGy 1.0 1.8 3.79 388 256 A 24 ALA HA A 23 GLU H 1.0 1.8 5.20 389 257 A 23 GLU H A 24 ALA H 1.0 1.8 5.41 390 258 A 23 GLU H A 26 ASP HA 1.0 1.8 5.79 391 259 A 26 ASP H A 23 GLU H 1.0 1.8 4.30 392 260 A 23 GLU H A 26 ASP HBx 1.0 1.8 3.94 393 261 A 23 GLU H A 26 ASP HBy 1.0 1.8 4.99 394 262 A 23 GLU H A 59 PHE HD% 1.0 1.8 5.98 395 263 A 23 GLU HBx A 24 ALA H 1.0 1.8 3.49 396 264 A 26 ASP H A 23 GLU HBx 1.0 1.8 4.60 397 265 A 24 ALA H A 23 GLU HBy 1.0 1.8 4.16 398 266 A 24 ALA H A 23 GLU HGx 1.0 1.8 4.05 399 266 A 24 ALA H A 23 GLU HGy 1.0 1.8 4.05 400 267 A 24 ALA HA A 25 GLY H 1.0 1.8 2.79 401 268 A 24 ALA HA A 26 ASP H 1.0 1.8 3.79 402 269 A 24 ALA HB% A 24 ALA H 1.0 1.8 2.62 403 270 A 25 GLY H A 24 ALA H 1.0 1.8 4.46 404 271 A 26 ASP H A 24 ALA H 1.0 1.8 4.60 405 272 A 25 GLY H A 24 ALA HB% 1.0 1.8 3.45 406 273 A 25 GLY H A 26 ASP H 1.0 1.8 3.22 407 274 A 25 GLY H A 26 ASP HBx 1.0 1.8 6.07 408 275 A 26 ASP HA A 27 ARG H 1.0 1.8 3.02 409 276 A 26 ASP H A 26 ASP HBx 1.0 1.8 4.10 410 277 A 26 ASP H A 26 ASP HBy 1.0 1.8 4.04 411 278 A 26 ASP H A 27 ARG H 1.0 1.8 4.64 412 279 A 26 ASP HBx A 27 ARG H 1.0 1.8 4.10 413 280 A 26 ASP HBy A 27 ARG H 1.0 1.8 3.81 414 281 A 26 ASP HBy A 59 PHE HBx 1.0 1.8 4.94 415 282 A 26 ASP HBy A 59 PHE HD% 1.0 1.8 4.56 416 283 A 26 ASP HBy A 60 ILE H 1.0 1.8 5.60 417 284 A 28 ILE H A 27 ARG HA 1.0 1.8 2.99 418 285 A 27 ARG HBx A 27 ARG H 1.0 1.8 3.68 419 286 A 27 ARG HBy A 27 ARG H 1.0 1.8 3.62 420 287 A 27 ARG H A 27 ARG HDy 1.0 1.8 4.97 421 287 A 27 ARG H A 27 ARG HDx 1.0 1.8 4.97 422 288 A 27 ARG H A 27 ARG HGx 1.0 1.8 4.64 423 288 A 27 ARG H A 27 ARG HGy 1.0 1.8 4.64 424 289 A 28 ILE H A 27 ARG H 1.0 1.8 4.56 425 290 A 27 ARG H A 29 ALA H 1.0 1.8 6.00 426 291 A 27 ARG H A 59 PHE HA 1.0 1.8 4.90 427 292 A 27 ARG H A 59 PHE HBx 1.0 1.8 5.45 428 293 A 59 PHE HD% A 27 ARG H 1.0 1.8 4.77 429 294 A 27 ARG H A 60 ILE HB 1.0 1.8 4.69 430 295 A 27 ARG H A 60 ILE H 1.0 1.8 3.71 431 296 A 27 ARG H A 60 ILE HG2% 1.0 1.8 4.32 432 297 A 28 ILE H A 27 ARG HDy 1.0 1.8 4.79 433 297 A 28 ILE H A 27 ARG HDx 1.0 1.8 4.79 434 298 A 60 ILE HD1% A 27 ARG HDy 1.0 1.8 5.18 435 298 A 27 ARG HDx A 60 ILE HD1% 1.0 1.8 5.18 436 299 A 28 ILE HA A 28 ILE HD1% 1.0 1.8 3.64 437 300 A 28 ILE HA A 28 ILE HG2% 1.0 1.8 3.63 438 301 A 29 ALA H A 28 ILE HA 1.0 1.8 3.07 439 302 A 28 ILE HA A 29 ALA HB% 1.0 1.8 4.56 440 303 A 28 ILE HA A 30 ALA H 1.0 1.8 4.31 441 304 A 59 PHE HA A 28 ILE HA 1.0 1.8 4.09 442 305 A 59 PHE HBx A 28 ILE HA 1.0 1.8 4.62 443 306 A 59 PHE HBy A 28 ILE HA 1.0 1.8 4.35 444 307 A 60 ILE H A 28 ILE HA 1.0 1.8 4.30 445 308 A 28 ILE HD1% A 28 ILE HB 1.0 1.8 3.75 446 309 A 29 ALA H A 28 ILE HB 1.0 1.8 4.56 447 310 A 28 ILE H A 28 ILE HB 1.0 1.8 3.11 448 311 A 28 ILE HD1% A 30 ALA H 1.0 1.8 4.56 449 312 A 28 ILE HD1% A 57 VAL HGx% 1.0 1.8 3.48 450 312 A 28 ILE HD1% A 57 VAL HG21 1.0 1.8 3.48 451 313 A 28 ILE HD1% A 58 THR H 1.0 1.8 4.90 452 314 A 59 PHE HA A 28 ILE HD1% 1.0 1.8 3.53 453 315 A 28 ILE HD1% A 28 ILE HG2% 1.0 1.8 3.37 454 316 A 29 ALA H A 28 ILE HG2% 1.0 1.8 3.41 455 317 A 28 ILE HG2% A 30 ALA H 1.0 1.8 3.12 456 318 A 28 ILE HG2% A 31 ILE H 1.0 1.8 4.55 457 319 A 28 ILE HG2% A 57 VAL HA 1.0 1.8 4.31 458 320 A 28 ILE HG2% A 58 THR H 1.0 1.8 3.42 459 321 A 59 PHE HA A 28 ILE HG2% 1.0 1.8 3.76 460 322 A 28 ILE HG2% A 59 PHE H 1.0 1.8 5.04 461 323 A 59 PHE HBy A 28 ILE HG2% 1.0 1.8 4.51 462 324 A 29 ALA H A 29 ALA HB% 1.0 1.8 3.10 463 325 A 29 ALA H A 30 ALA H 1.0 1.8 2.80 464 326 A 29 ALA H A 57 VAL HGx% 1.0 1.8 4.60 465 326 A 29 ALA H A 57 VAL HG21 1.0 1.8 4.60 466 327 A 29 ALA H A 59 PHE HA 1.0 1.8 3.36 467 328 A 59 PHE HBx A 29 ALA H 1.0 1.8 4.46 468 329 A 59 PHE HBy A 29 ALA H 1.0 1.8 4.27 469 330 A 60 ILE H A 29 ALA H 1.0 1.8 4.35 470 331 A 29 ALA H A 60 ILE HG1x 1.0 1.8 5.72 471 331 A 29 ALA H A 60 ILE HG1y 1.0 1.8 5.72 472 332 A 29 ALA HB% A 30 ALA H 1.0 1.8 3.02 473 333 A 29 ALA HB% A 58 THR HB 1.0 1.8 4.82 474 334 A 59 PHE HA A 29 ALA HB% 1.0 1.8 3.69 475 335 A 60 ILE H A 29 ALA HB% 1.0 1.8 3.69 476 336 A 60 ILE HD1% A 29 ALA HB% 1.0 1.8 3.17 477 337 A 31 ILE H A 30 ALA HA 1.0 1.8 2.77 478 338 A 30 ALA HA A 31 ILE HD1% 1.0 1.8 4.90 479 339 A 30 ALA HA A 36 ILE H 1.0 1.8 3.47 480 340 A 30 ALA HA A 36 ILE HG1y 1.0 1.8 3.89 481 340 A 30 ALA HA A 36 ILE HG1x 1.0 1.8 3.89 482 341 A 58 THR H A 30 ALA HA 1.0 1.8 4.97 483 342 A 30 ALA H A 30 ALA HB% 1.0 1.8 3.09 484 343 A 30 ALA H A 31 ILE HG1x 1.0 1.8 4.85 485 343 A 30 ALA H A 31 ILE HG1y 1.0 1.8 4.85 486 344 A 30 ALA H A 36 ILE HB 1.0 1.8 4.66 487 345 A 30 ALA H A 36 ILE H 1.0 1.8 4.56 488 346 A 30 ALA H A 36 ILE HG1y 1.0 1.8 4.22 489 346 A 30 ALA H A 36 ILE HG1x 1.0 1.8 4.22 490 347 A 30 ALA H A 57 VAL HGx% 1.0 1.8 4.36 491 347 A 30 ALA H A 57 VAL HG21 1.0 1.8 4.36 492 348 A 30 ALA H A 58 THR HA 1.0 1.8 5.02 493 349 A 30 ALA H A 58 THR HB 1.0 1.8 3.07 494 350 A 30 ALA H A 58 THR H 1.0 1.8 3.55 495 351 A 30 ALA H A 58 THR HG2% 1.0 1.8 4.19 496 352 A 59 PHE HA A 30 ALA H 1.0 1.8 4.16 497 353 A 31 ILE H A 30 ALA HB% 1.0 1.8 2.96 498 354 A 30 ALA HB% A 33 GLY H 1.0 1.8 3.60 499 355 A 30 ALA HB% A 34 GLN H 1.0 1.8 3.44 500 356 A 30 ALA HB% A 35 PRO HA 1.0 1.8 3.86 501 357 A 36 ILE H A 30 ALA HB% 1.0 1.8 3.69 502 358 A 58 THR HB A 30 ALA HB% 1.0 1.8 3.33 503 359 A 31 ILE HA A 31 ILE HG2% 1.0 1.8 4.21 504 360 A 31 ILE HA A 32 ASP H 1.0 1.8 2.99 505 361 A 33 GLY H A 31 ILE HA 1.0 1.8 4.33 506 362 A 58 THR H A 31 ILE HA 1.0 1.8 4.02 507 363 A 31 ILE HD1% A 31 ILE HB 1.0 1.8 3.97 508 364 A 31 ILE HB A 57 VAL HGx% 1.0 1.8 4.03 509 364 A 57 VAL HG21 A 31 ILE HB 1.0 1.8 4.03 510 365 A 31 ILE H A 31 ILE HB 1.0 1.8 3.38 511 366 A 31 ILE H A 31 ILE HD1% 1.0 1.8 4.86 512 367 A 31 ILE H A 31 ILE HG2% 1.0 1.8 4.05 513 368 A 31 ILE H A 32 ASP HA 1.0 1.8 6.00 514 369 A 31 ILE H A 32 ASP H 1.0 1.8 4.17 515 370 A 31 ILE H A 33 GLY H 1.0 1.8 4.46 516 371 A 31 ILE H A 34 GLN HBx 1.0 1.8 4.77 517 371 A 31 ILE H A 34 GLN HBy 1.0 1.8 4.77 518 372 A 31 ILE H A 34 GLN HGx 1.0 1.8 4.48 519 372 A 31 ILE H A 34 GLN HGy 1.0 1.8 4.48 520 373 A 31 ILE H A 35 PRO HA 1.0 1.8 4.40 521 374 A 31 ILE H A 36 ILE HA 1.0 1.8 6.00 522 375 A 31 ILE H A 36 ILE HB 1.0 1.8 5.64 523 376 A 31 ILE H A 36 ILE H 1.0 1.8 4.69 524 377 A 31 ILE H A 36 ILE HD1% 1.0 1.8 3.38 525 378 A 31 ILE H A 36 ILE HG1y 1.0 1.8 4.83 526 378 A 31 ILE H A 36 ILE HG1x 1.0 1.8 4.83 527 379 A 58 THR H A 31 ILE H 1.0 1.8 5.08 528 380 A 31 ILE HD1% A 32 ASP H 1.0 1.8 5.14 529 381 A 31 ILE HD1% A 45 TYR HBx 1.0 1.8 4.37 530 382 A 31 ILE HD1% A 45 TYR HBy 1.0 1.8 4.41 531 383 A 31 ILE HD1% A 45 TYR HD% 1.0 1.8 3.58 532 384 A 32 ASP H A 31 ILE HG1x 1.0 1.8 3.85 533 384 A 31 ILE HG1y A 32 ASP H 1.0 1.8 3.85 534 385 A 31 ILE HG2% A 32 ASP H 1.0 1.8 3.59 535 386 A 31 ILE HG2% A 32 ASP HBx 1.0 1.8 4.02 536 386 A 31 ILE HG2% A 32 ASP HBy 1.0 1.8 4.02 537 387 A 31 ILE HG2% A 32 ASP HBx 1.0 1.8 4.57 538 388 A 31 ILE HG2% A 32 ASP HBy 1.0 1.8 4.57 539 389 A 33 GLY H A 31 ILE HG2% 1.0 1.8 4.99 540 390 A 34 GLN H A 31 ILE HG2% 1.0 1.8 4.62 541 391 A 31 ILE HG2% A 45 TYR HBx 1.0 1.8 4.45 542 392 A 31 ILE HG2% A 45 TYR HD% 1.0 1.8 3.38 543 393 A 31 ILE HG2% A 45 TYR HE% 1.0 1.8 3.58 544 394 A 31 ILE HG2% A 55 VAL HB 1.0 1.8 4.24 545 395 A 31 ILE HG2% A 56 ARG H 1.0 1.8 4.55 546 396 A 58 THR H A 31 ILE HG2% 1.0 1.8 4.79 547 397 A 33 GLY H A 32 ASP HA 1.0 1.8 3.25 548 398 A 32 ASP HA A 56 ARG H 1.0 1.8 3.93 549 399 A 32 ASP H A 32 ASP HA 1.0 1.8 2.93 550 400 A 33 GLY H A 32 ASP H 1.0 1.8 3.36 551 401 A 32 ASP H A 33 GLY HAy 1.0 1.8 5.26 552 401 A 32 ASP H A 33 GLY HAx 1.0 1.8 5.26 553 402 A 34 GLN H A 32 ASP H 1.0 1.8 4.49 554 403 A 32 ASP H A 34 GLN HGx 1.0 1.8 5.31 555 403 A 32 ASP H A 34 GLN HGy 1.0 1.8 5.31 556 404 A 32 ASP H A 56 ARG H 1.0 1.8 4.66 557 405 A 32 ASP H A 56 ARG HBx 1.0 1.8 3.65 558 405 A 32 ASP H A 56 ARG HBy 1.0 1.8 3.65 559 406 A 57 VAL HA A 32 ASP H 1.0 1.8 4.09 560 407 A 58 THR H A 32 ASP H 1.0 1.8 4.63 561 408 A 33 GLY H A 32 ASP HBx 1.0 1.8 3.81 562 408 A 33 GLY H A 32 ASP HBy 1.0 1.8 3.81 563 409 A 45 TYR HE% A 32 ASP HBx 1.0 1.8 4.99 564 409 A 32 ASP HBy A 45 TYR HE% 1.0 1.8 4.99 565 410 A 33 GLY H A 32 ASP HBx 1.0 1.8 4.43 566 411 A 33 GLY H A 32 ASP HBy 1.0 1.8 4.43 567 412 A 33 GLY H A 34 GLN H 1.0 1.8 3.20 568 413 A 33 GLY H A 34 GLN HBx 1.0 1.8 4.81 569 413 A 33 GLY H A 34 GLN HBy 1.0 1.8 4.81 570 414 A 33 GLY H A 34 GLN HGx 1.0 1.8 4.15 571 414 A 33 GLY H A 34 GLN HGy 1.0 1.8 4.15 572 415 A 33 GLY H A 56 ARG HBx 1.0 1.8 5.17 573 415 A 33 GLY H A 56 ARG HBy 1.0 1.8 5.17 574 416 A 34 GLN H A 34 GLN HBx 1.0 1.8 2.87 575 416 A 34 GLN H A 34 GLN HBy 1.0 1.8 2.87 576 417 A 34 GLN H A 34 GLN HGx 1.0 1.8 2.99 577 417 A 34 GLN H A 34 GLN HGy 1.0 1.8 2.99 578 418 A 34 GLN HBy A 34 GLN HGx 1.0 1.8 2.76 579 418 A 34 GLN HBx A 34 GLN HGx 1.0 1.8 2.76 580 418 A 34 GLN HGy A 34 GLN HBx 1.0 1.8 2.76 581 418 A 34 GLN HBy A 34 GLN HGy 1.0 1.8 2.76 582 419 A 34 GLN HBx A 35 PRO HDx 1.0 1.8 3.58 583 419 A 34 GLN HBy A 35 PRO HDx 1.0 1.8 3.58 584 419 A 35 PRO HDy A 34 GLN HBx 1.0 1.8 3.58 585 419 A 34 GLN HBy A 35 PRO HDy 1.0 1.8 3.58 586 420 A 34 GLN HGy A 35 PRO HDx 1.0 1.8 4.46 587 420 A 34 GLN HGx A 35 PRO HDx 1.0 1.8 4.46 588 420 A 35 PRO HDy A 34 GLN HGx 1.0 1.8 4.46 589 420 A 34 GLN HGy A 35 PRO HDy 1.0 1.8 4.46 590 421 A 36 ILE H A 35 PRO HA 1.0 1.8 2.96 591 422 A 36 ILE H A 35 PRO HBx 1.0 1.8 3.52 592 422 A 36 ILE H A 35 PRO HBy 1.0 1.8 3.52 593 423 A 36 ILE H A 35 PRO HBy 1.0 1.8 4.15 594 424 A 36 ILE H A 35 PRO HDx 1.0 1.8 5.65 595 425 A 36 ILE HA A 36 ILE HD1% 1.0 1.8 3.65 596 426 A 36 ILE HA A 36 ILE HG2% 1.0 1.8 3.82 597 427 A 36 ILE HA A 37 ASN H 1.0 1.8 2.88 598 428 A 36 ILE HA A 37 ASN HBx 1.0 1.8 4.82 599 428 A 36 ILE HA A 37 ASN HBy 1.0 1.8 4.82 600 429 A 38 THR H A 36 ILE HA 1.0 1.8 3.76 601 430 A 36 ILE HA A 41 GLN HGx 1.0 1.8 5.03 602 430 A 36 ILE HA A 41 GLN HGy 1.0 1.8 5.03 603 431 A 36 ILE HB A 37 ASN H 1.0 1.8 4.01 604 432 A 38 THR H A 36 ILE HB 1.0 1.8 5.85 605 433 A 36 ILE H A 36 ILE HB 1.0 1.8 3.24 606 434 A 36 ILE H A 36 ILE HD1% 1.0 1.8 3.79 607 435 A 36 ILE H A 36 ILE HG1y 1.0 1.8 3.61 608 435 A 36 ILE H A 36 ILE HG1x 1.0 1.8 3.61 609 436 A 36 ILE H A 36 ILE HG1y 1.0 1.8 4.59 610 436 A 36 ILE H A 36 ILE HG1x 1.0 1.8 4.59 611 437 A 36 ILE H A 36 ILE HG2% 1.0 1.8 3.82 612 438 A 36 ILE H A 37 ASN H 1.0 1.8 4.05 613 439 A 36 ILE H A 37 ASN HBx 1.0 1.8 5.36 614 439 A 36 ILE H A 37 ASN HBy 1.0 1.8 5.36 615 440 A 36 ILE HD1% A 37 ASN H 1.0 1.8 3.86 616 441 A 36 ILE HD1% A 41 GLN H 1.0 1.8 4.99 617 442 A 36 ILE HD1% A 41 GLN HBy 1.0 1.8 3.39 618 442 A 36 ILE HD1% A 41 GLN HBx 1.0 1.8 3.39 619 443 A 36 ILE HD1% A 41 GLN HBx 1.0 1.8 3.99 620 444 A 36 ILE HD1% A 41 GLN HBy 1.0 1.8 3.99 621 445 A 36 ILE HD1% A 41 GLN HGx 1.0 1.8 4.55 622 445 A 36 ILE HD1% A 41 GLN HGy 1.0 1.8 4.55 623 446 A 36 ILE HD1% A 42 ILE HA 1.0 1.8 3.99 624 447 A 36 ILE HD1% A 42 ILE H 1.0 1.8 4.44 625 448 A 36 ILE HD1% A 42 ILE HG1y 1.0 1.8 4.28 626 448 A 36 ILE HD1% A 42 ILE HG1x 1.0 1.8 4.28 627 449 A 36 ILE HD1% A 42 ILE HG1y 1.0 1.8 5.67 628 449 A 36 ILE HD1% A 42 ILE HG1x 1.0 1.8 5.67 629 450 A 37 ASN H A 36 ILE HG1y 1.0 1.8 5.21 630 450 A 36 ILE HG1x A 37 ASN H 1.0 1.8 5.21 631 451 A 36 ILE HG2% A 37 ASN H 1.0 1.8 3.68 632 452 A 38 THR H A 36 ILE HG2% 1.0 1.8 3.54 633 453 A 36 ILE HG2% A 41 GLN H 1.0 1.8 4.15 634 454 A 36 ILE HG2% A 41 GLN HBy 1.0 1.8 3.56 635 454 A 36 ILE HG2% A 41 GLN HBx 1.0 1.8 3.56 636 455 A 36 ILE HG2% A 41 GLN HBx 1.0 1.8 4.11 637 456 A 36 ILE HG2% A 41 GLN HBy 1.0 1.8 4.11 638 457 A 37 ASN H A 37 ASN HBx 1.0 1.8 3.23 639 457 A 37 ASN H A 37 ASN HBy 1.0 1.8 3.23 640 458 A 38 THR H A 37 ASN H 1.0 1.8 2.89 641 459 A 37 ASN H A 38 THR HG2% 1.0 1.8 4.60 642 460 A 37 ASN H A 41 GLN H 1.0 1.8 5.47 643 461 A 37 ASN H A 41 GLN HBy 1.0 1.8 3.87 644 461 A 37 ASN H A 41 GLN HBx 1.0 1.8 3.87 645 462 A 37 ASN H A 41 GLN HBx 1.0 1.8 4.43 646 463 A 37 ASN H A 41 GLN HBy 1.0 1.8 4.43 647 464 A 37 ASN H A 42 ILE HG1y 1.0 1.8 5.48 648 464 A 37 ASN H A 42 ILE HG1x 1.0 1.8 5.48 649 465 A 38 THR H A 37 ASN HBx 1.0 1.8 3.58 650 465 A 38 THR H A 37 ASN HBy 1.0 1.8 3.58 651 466 A 38 THR HG2% A 37 ASN HBx 1.0 1.8 4.03 652 466 A 37 ASN HBy A 38 THR HG2% 1.0 1.8 4.03 653 467 A 38 THR HG2% A 38 THR HA 1.0 1.8 3.77 654 468 A 38 THR HB A 40 GLU H 1.0 1.8 3.30 655 469 A 41 GLN H A 38 THR HB 1.0 1.8 4.13 656 470 A 38 THR H A 38 THR HG2% 1.0 1.8 3.66 657 471 A 38 THR H A 41 GLN HBy 1.0 1.8 3.82 658 471 A 38 THR H A 41 GLN HBx 1.0 1.8 3.82 659 472 A 38 THR H A 41 GLN HBx 1.0 1.8 4.60 660 473 A 38 THR H A 41 GLN HBy 1.0 1.8 4.60 661 474 A 38 THR H A 41 GLN HGx 1.0 1.8 4.87 662 474 A 38 THR H A 41 GLN HGy 1.0 1.8 4.87 663 475 A 38 THR HG2% A 40 GLU H 1.0 1.8 4.04 664 476 A 41 GLN H A 38 THR HG2% 1.0 1.8 4.08 665 477 A 39 SER HA A 42 ILE HB 1.0 1.8 4.60 666 478 A 42 ILE H A 39 SER HA 1.0 1.8 4.43 667 479 A 40 GLU H A 39 SER H 1.0 1.8 3.77 668 480 A 40 GLU HA A 40 GLU HGx 1.0 1.8 3.93 669 480 A 40 GLU HA A 40 GLU HGy 1.0 1.8 3.93 670 481 A 42 ILE H A 40 GLU HA 1.0 1.8 4.84 671 482 A 40 GLU HA A 43 VAL HB 1.0 1.8 3.94 672 483 A 40 GLU HA A 43 VAL H 1.0 1.8 4.02 673 484 A 40 GLU HA A 44 SER H 1.0 1.8 4.59 674 485 A 40 GLU H A 40 GLU HBx 1.0 1.8 3.21 675 485 A 40 GLU H A 40 GLU HBy 1.0 1.8 3.21 676 486 A 40 GLU H A 40 GLU HGx 1.0 1.8 3.71 677 486 A 40 GLU H A 40 GLU HGy 1.0 1.8 3.71 678 487 A 41 GLN H A 40 GLU H 1.0 1.8 3.26 679 488 A 42 ILE H A 40 GLU H 1.0 1.8 4.76 680 489 A 41 GLN H A 40 GLU HBx 1.0 1.8 3.39 681 489 A 41 GLN H A 40 GLU HBy 1.0 1.8 3.39 682 490 A 42 ILE H A 40 GLU HGx 1.0 1.8 5.59 683 490 A 42 ILE H A 40 GLU HGy 1.0 1.8 5.59 684 491 A 41 GLN HA A 41 GLN HGx 1.0 1.8 4.02 685 491 A 41 GLN HGy A 41 GLN HA 1.0 1.8 4.02 686 492 A 44 SER H A 41 GLN HA 1.0 1.8 4.66 687 493 A 41 GLN H A 41 GLN HBy 1.0 1.8 3.26 688 493 A 41 GLN H A 41 GLN HBx 1.0 1.8 3.26 689 494 A 41 GLN H A 41 GLN HBx 1.0 1.8 3.82 690 495 A 41 GLN H A 41 GLN HBy 1.0 1.8 3.82 691 496 A 41 GLN H A 41 GLN HGx 1.0 1.8 4.03 692 496 A 41 GLN HGy A 41 GLN H 1.0 1.8 4.03 693 497 A 41 GLN H A 42 ILE H 1.0 1.8 3.21 694 498 A 41 GLN H A 42 ILE HG1y 1.0 1.8 4.90 695 498 A 41 GLN H A 42 ILE HG1x 1.0 1.8 4.90 696 499 A 42 ILE H A 41 GLN HBy 1.0 1.8 3.96 697 499 A 41 GLN HBx A 42 ILE H 1.0 1.8 3.96 698 500 A 42 ILE HG2% A 41 GLN HBy 1.0 1.8 5.81 699 500 A 41 GLN HBx A 42 ILE HG2% 1.0 1.8 5.81 700 501 A 42 ILE HA A 42 ILE HD1% 1.0 1.8 3.93 701 502 A 42 ILE HA A 42 ILE HG1y 1.0 1.8 3.55 702 502 A 42 ILE HA A 42 ILE HG1x 1.0 1.8 3.55 703 503 A 42 ILE HA A 42 ILE HG1y 1.0 1.8 4.21 704 503 A 42 ILE HA A 42 ILE HG1x 1.0 1.8 4.21 705 504 A 42 ILE HA A 42 ILE HG2% 1.0 1.8 3.57 706 505 A 42 ILE HA A 45 TYR H 1.0 1.8 4.20 707 506 A 45 TYR HBx A 42 ILE HA 1.0 1.8 4.63 708 507 A 45 TYR HBy A 42 ILE HA 1.0 1.8 4.56 709 508 A 42 ILE HA A 46 VAL H 1.0 1.8 4.78 710 509 A 42 ILE HB A 42 ILE HD1% 1.0 1.8 3.85 711 510 A 42 ILE HB A 43 VAL H 1.0 1.8 3.41 712 511 A 42 ILE H A 42 ILE HB 1.0 1.8 3.26 713 512 A 42 ILE H A 42 ILE HD1% 1.0 1.8 3.83 714 513 A 42 ILE H A 42 ILE HG1y 1.0 1.8 3.54 715 513 A 42 ILE H A 42 ILE HG1x 1.0 1.8 3.54 716 514 A 42 ILE H A 42 ILE HG1y 1.0 1.8 3.54 717 514 A 42 ILE H A 42 ILE HG1x 1.0 1.8 3.54 718 515 A 42 ILE H A 42 ILE HG2% 1.0 1.8 3.82 719 516 A 42 ILE H A 43 VAL H 1.0 1.8 3.23 720 517 A 42 ILE H A 44 SER H 1.0 1.8 4.48 721 518 A 42 ILE HD1% A 45 TYR H 1.0 1.8 4.98 722 519 A 45 TYR HD% A 42 ILE HD1% 1.0 1.8 4.14 723 520 A 42 ILE HD1% A 46 VAL H 1.0 1.8 5.09 724 521 A 43 VAL H A 42 ILE HG1y 1.0 1.8 4.87 725 521 A 42 ILE HG1x A 43 VAL H 1.0 1.8 4.87 726 522 A 42 ILE HG2% A 42 ILE HG1y 1.0 1.8 4.06 727 522 A 42 ILE HG1x A 42 ILE HG2% 1.0 1.8 4.06 728 523 A 43 VAL H A 42 ILE HG2% 1.0 1.8 3.55 729 524 A 42 ILE HG2% A 46 VAL H 1.0 1.8 3.69 730 525 A 42 ILE HG2% A 46 VAL HGy% 1.0 1.8 3.73 731 525 A 42 ILE HG2% A 46 VAL HGx% 1.0 1.8 3.73 732 526 A 43 VAL HA A 43 VAL HGy% 1.0 1.8 3.08 733 526 A 43 VAL HA A 43 VAL HGx% 1.0 1.8 3.08 734 527 A 43 VAL HA A 43 VAL HGx% 1.0 1.8 3.70 735 528 A 43 VAL HA A 43 VAL HGy% 1.0 1.8 3.70 736 529 A 43 VAL HA A 46 VAL HB 1.0 1.8 4.54 737 530 A 46 VAL H A 43 VAL HA 1.0 1.8 4.05 738 531 A 43 VAL HA A 46 VAL HGy% 1.0 1.8 3.95 739 531 A 46 VAL HGx% A 43 VAL HA 1.0 1.8 3.95 740 532 A 43 VAL HA A 47 ARG H 1.0 1.8 4.64 741 533 A 43 VAL HB A 44 SER H 1.0 1.8 3.15 742 534 A 43 VAL HB A 45 TYR H 1.0 1.8 4.81 743 535 A 43 VAL HB A 43 VAL H 1.0 1.8 3.59 744 536 A 43 VAL H A 43 VAL HGy% 1.0 1.8 3.19 745 536 A 43 VAL H A 43 VAL HGx% 1.0 1.8 3.19 746 537 A 43 VAL H A 43 VAL HGx% 1.0 1.8 3.91 747 538 A 43 VAL H A 43 VAL HGy% 1.0 1.8 3.91 748 539 A 43 VAL H A 44 SER H 1.0 1.8 3.42 749 540 A 44 SER HA A 43 VAL HGy% 1.0 1.8 3.80 750 540 A 43 VAL HGx% A 44 SER HA 1.0 1.8 3.80 751 541 A 44 SER H A 43 VAL HGy% 1.0 1.8 3.44 752 541 A 44 SER H A 43 VAL HGx% 1.0 1.8 3.44 753 542 A 45 TYR H A 43 VAL HGy% 1.0 1.8 4.87 754 542 A 45 TYR H A 43 VAL HGx% 1.0 1.8 4.87 755 543 A 46 VAL H A 44 SER HA 1.0 1.8 5.04 756 544 A 47 ARG H A 44 SER HA 1.0 1.8 4.61 757 545 A 44 SER H A 44 SER HBx 1.0 1.8 2.97 758 545 A 44 SER H A 44 SER HBy 1.0 1.8 2.97 759 546 A 44 SER H A 45 TYR H 1.0 1.8 3.22 760 547 A 45 TYR HBx A 44 SER H 1.0 1.8 5.01 761 548 A 45 TYR HBy A 44 SER H 1.0 1.8 5.87 762 549 A 45 TYR H A 44 SER HBx 1.0 1.8 3.62 763 549 A 45 TYR H A 44 SER HBy 1.0 1.8 3.62 764 550 A 46 VAL H A 44 SER HBx 1.0 1.8 5.21 765 550 A 46 VAL H A 44 SER HBy 1.0 1.8 5.21 766 551 A 45 TYR HD% A 45 TYR HA 1.0 1.8 3.41 767 552 A 47 ARG H A 45 TYR HA 1.0 1.8 4.63 768 553 A 45 TYR HA A 49 LYS H 1.0 1.8 4.96 769 554 A 45 TYR HBx A 45 TYR H 1.0 1.8 3.29 770 555 A 45 TYR HBy A 45 TYR H 1.0 1.8 3.33 771 556 A 45 TYR HD% A 45 TYR H 1.0 1.8 4.12 772 557 A 45 TYR H A 46 VAL H 1.0 1.8 3.43 773 558 A 45 TYR H A 46 VAL HGy% 1.0 1.8 4.62 774 558 A 45 TYR H A 46 VAL HGx% 1.0 1.8 4.62 775 559 A 45 TYR H A 47 ARG H 1.0 1.8 4.78 776 560 A 45 TYR HBx A 46 VAL H 1.0 1.8 3.78 777 561 A 45 TYR HBy A 46 VAL H 1.0 1.8 3.96 778 562 A 45 TYR HBy A 46 VAL HGy% 1.0 1.8 4.83 779 562 A 45 TYR HBy A 46 VAL HGx% 1.0 1.8 4.83 780 563 A 45 TYR HD% A 46 VAL HA 1.0 1.8 4.58 781 564 A 45 TYR HD% A 46 VAL HB 1.0 1.8 5.11 782 565 A 45 TYR HD% A 46 VAL H 1.0 1.8 4.09 783 566 A 45 TYR HD% A 46 VAL HGy% 1.0 1.8 3.72 784 566 A 45 TYR HD% A 46 VAL HGx% 1.0 1.8 3.72 785 567 A 45 TYR HD% A 55 VAL HGx% 1.0 1.8 4.21 786 568 A 45 TYR HE% A 55 VAL HB 1.0 1.8 4.50 787 569 A 45 TYR HE% A 55 VAL HGx% 1.0 1.8 3.09 788 570 A 45 TYR HE% A 55 VAL HGy% 1.0 1.8 3.68 789 571 A 46 VAL HGx% A 46 VAL HA 1.0 1.8 3.69 790 572 A 46 VAL HA A 46 VAL HGy% 1.0 1.8 3.69 791 573 A 49 LYS H A 46 VAL HA 1.0 1.8 4.37 792 574 A 46 VAL HA A 49 LYS HGx 1.0 1.8 5.63 793 574 A 46 VAL HA A 49 LYS HGy 1.0 1.8 5.63 794 575 A 46 VAL HA A 72 LEU HG 1.0 1.8 4.08 795 576 A 46 VAL HB A 72 LEU HDx% 1.0 1.8 4.54 796 576 A 46 VAL HB A 72 LEU HD21 1.0 1.8 4.54 797 577 A 46 VAL HB A 82 ILE HG2% 1.0 1.8 6.00 798 578 A 46 VAL H A 46 VAL HB 1.0 1.8 3.25 799 579 A 46 VAL H A 46 VAL HGy% 1.0 1.8 2.94 800 579 A 46 VAL H A 46 VAL HGx% 1.0 1.8 2.94 801 580 A 46 VAL H A 46 VAL HGx% 1.0 1.8 3.43 802 581 A 46 VAL H A 46 VAL HGy% 1.0 1.8 3.43 803 582 A 46 VAL H A 47 ARG H 1.0 1.8 3.54 804 583 A 46 VAL H A 49 LYS H 1.0 1.8 5.54 805 584 A 46 VAL H A 72 LEU HDx% 1.0 1.8 4.76 806 584 A 46 VAL H A 72 LEU HD21 1.0 1.8 4.76 807 585 A 47 ARG H A 46 VAL HGy% 1.0 1.8 4.60 808 585 A 46 VAL HGx% A 47 ARG H 1.0 1.8 4.60 809 586 A 46 VAL HGy% A 72 LEU HDx% 1.0 1.8 3.82 810 586 A 46 VAL HGx% A 72 LEU HDx% 1.0 1.8 3.82 811 586 A 72 LEU HD21 A 46 VAL HGy% 1.0 1.8 3.82 812 586 A 46 VAL HGx% A 72 LEU HD21 1.0 1.8 3.82 813 587 A 82 ILE HB A 46 VAL HGy% 1.0 1.8 3.71 814 587 A 46 VAL HGx% A 82 ILE HB 1.0 1.8 3.71 815 588 A 83 GLY H A 46 VAL HGy% 1.0 1.8 4.51 816 588 A 46 VAL HGx% A 83 GLY H 1.0 1.8 4.51 817 589 A 46 VAL HGx% A 83 GLY HAy 1.0 1.8 4.09 818 589 A 46 VAL HGy% A 83 GLY HAy 1.0 1.8 4.09 819 589 A 83 GLY HAx A 46 VAL HGy% 1.0 1.8 4.09 820 589 A 46 VAL HGx% A 83 GLY HAx 1.0 1.8 4.09 821 590 A 46 VAL HGy% A 84 LEU HBx 1.0 1.8 4.49 822 590 A 46 VAL HGx% A 84 LEU HBx 1.0 1.8 4.49 823 590 A 84 LEU HBy A 46 VAL HGy% 1.0 1.8 4.49 824 590 A 46 VAL HGx% A 84 LEU HBy 1.0 1.8 4.49 825 591 A 46 VAL HGx% A 82 ILE HB 1.0 1.8 4.45 826 592 A 46 VAL HGx% A 83 GLY H 1.0 1.8 4.25 827 593 A 82 ILE HB A 46 VAL HGy% 1.0 1.8 4.45 828 594 A 47 ARG H A 49 LYS H 1.0 1.8 4.80 829 595 A 49 LYS HA A 49 LYS HDx 1.0 1.8 3.60 830 595 A 49 LYS HA A 49 LYS HDy 1.0 1.8 3.60 831 596 A 55 VAL HGx% A 49 LYS HA 1.0 1.8 5.56 832 597 A 49 LYS H A 49 LYS HBx 1.0 1.8 3.98 833 598 A 49 LYS H A 49 LYS HGx 1.0 1.8 3.71 834 598 A 49 LYS H A 49 LYS HGy 1.0 1.8 3.71 835 599 A 49 LYS H A 50 GLN H 1.0 1.8 5.24 836 600 A 49 LYS H A 55 VAL HGx% 1.0 1.8 4.96 837 601 A 49 LYS H A 72 LEU HG 1.0 1.8 5.36 838 602 A 49 LYS H A 72 LEU HDx% 1.0 1.8 5.06 839 602 A 49 LYS H A 72 LEU HD21 1.0 1.8 5.06 840 603 A 49 LYS HBx A 49 LYS HDx 1.0 1.8 3.99 841 603 A 49 LYS HDy A 49 LYS HBx 1.0 1.8 3.99 842 604 A 49 LYS HBx A 50 GLN H 1.0 1.8 3.58 843 605 A 49 LYS HBx A 53 ASP H 1.0 1.8 5.66 844 606 A 49 LYS HBx A 53 ASP HBx 1.0 1.8 4.82 845 607 A 49 LYS HBx A 53 ASP HBy 1.0 1.8 4.11 846 608 A 49 LYS HBx A 54 ARG H 1.0 1.8 5.51 847 609 A 72 LEU HG A 49 LYS HBx 1.0 1.8 3.78 848 610 A 50 GLN H A 49 LYS HDx 1.0 1.8 4.43 849 610 A 49 LYS HDy A 50 GLN H 1.0 1.8 4.43 850 611 A 53 ASP HBx A 49 LYS HDx 1.0 1.8 5.06 851 611 A 49 LYS HDy A 53 ASP HBx 1.0 1.8 5.06 852 612 A 53 ASP HBy A 49 LYS HDx 1.0 1.8 4.84 853 612 A 49 LYS HDy A 53 ASP HBy 1.0 1.8 4.84 854 613 A 55 VAL HB A 49 LYS HDx 1.0 1.8 5.89 855 613 A 55 VAL HB A 49 LYS HDy 1.0 1.8 5.89 856 614 A 55 VAL HGx% A 49 LYS HDx 1.0 1.8 3.04 857 614 A 55 VAL HGx% A 49 LYS HDy 1.0 1.8 3.04 858 615 A 54 ARG H A 49 LYS HGx 1.0 1.8 5.37 859 615 A 49 LYS HGy A 54 ARG H 1.0 1.8 5.37 860 616 A 55 VAL HGx% A 49 LYS HGx 1.0 1.8 3.41 861 616 A 55 VAL HGx% A 49 LYS HGy 1.0 1.8 3.41 862 617 A 50 GLN HA A 50 GLN HGx 1.0 1.8 3.86 863 617 A 50 GLN HA A 50 GLN HGy 1.0 1.8 3.86 864 618 A 50 GLN HA A 51 ALA H 1.0 1.8 2.69 865 619 A 53 ASP HBx A 50 GLN HA 1.0 1.8 5.09 866 620 A 50 GLN HA A 82 ILE HD1% 1.0 1.8 3.97 867 621 A 50 GLN H A 50 GLN HBy 1.0 1.8 3.50 868 621 A 50 GLN H A 50 GLN HBx 1.0 1.8 3.50 869 622 A 50 GLN H A 50 GLN HGx 1.0 1.8 4.23 870 622 A 50 GLN H A 50 GLN HGy 1.0 1.8 4.23 871 623 A 50 GLN H A 53 ASP HBx 1.0 1.8 4.55 872 624 A 72 LEU HG A 50 GLN H 1.0 1.8 5.08 873 625 A 50 GLN H A 82 ILE HD1% 1.0 1.8 6.00 874 626 A 82 ILE HG2% A 50 GLN H 1.0 1.8 6.00 875 627 A 51 ALA H A 50 GLN HBy 1.0 1.8 3.02 876 627 A 51 ALA H A 50 GLN HBx 1.0 1.8 3.02 877 628 A 53 ASP HBy A 50 GLN HBy 1.0 1.8 5.81 878 628 A 53 ASP HBy A 50 GLN HBx 1.0 1.8 5.81 879 629 A 51 ALA H A 50 GLN HGx 1.0 1.8 3.73 880 629 A 50 GLN HGy A 51 ALA H 1.0 1.8 3.73 881 630 A 53 ASP H A 50 GLN HGx 1.0 1.8 4.43 882 630 A 53 ASP H A 50 GLN HGy 1.0 1.8 4.43 883 631 A 51 ALA HA A 52 GLY H 1.0 1.8 2.83 884 632 A 53 ASP H A 51 ALA HA 1.0 1.8 3.52 885 633 A 72 LEU HG A 51 ALA HA 1.0 1.8 4.86 886 634 A 51 ALA HA A 72 LEU H 1.0 1.8 5.33 887 635 A 51 ALA HA A 72 LEU HBx 1.0 1.8 4.33 888 636 A 51 ALA HA A 72 LEU HBy 1.0 1.8 4.82 889 637 A 82 ILE HD1% A 51 ALA HA 1.0 1.8 4.77 890 638 A 82 ILE HG2% A 51 ALA HA 1.0 1.8 3.77 891 639 A 51 ALA H A 51 ALA HB% 1.0 1.8 2.68 892 640 A 53 ASP H A 51 ALA H 1.0 1.8 4.69 893 641 A 51 ALA H A 82 ILE HD1% 1.0 1.8 4.23 894 642 A 82 ILE HG2% A 51 ALA H 1.0 1.8 3.55 895 643 A 52 GLY H A 51 ALA HB% 1.0 1.8 3.48 896 644 A 53 ASP H A 51 ALA HB% 1.0 1.8 4.71 897 645 A 51 ALA HB% A 74 PRO HBy 1.0 1.8 4.80 898 646 A 51 ALA HB% A 74 PRO HDy 1.0 1.8 3.98 899 646 A 51 ALA HB% A 74 PRO HDx 1.0 1.8 3.98 900 647 A 51 ALA HB% A 74 PRO HGx 1.0 1.8 4.10 901 647 A 51 ALA HB% A 74 PRO HGy 1.0 1.8 4.10 902 648 A 82 ILE HD1% A 51 ALA HB% 1.0 1.8 3.73 903 649 A 82 ILE HG2% A 51 ALA HB% 1.0 1.8 3.88 904 650 A 52 GLY H A 53 ASP HA 1.0 1.8 5.16 905 651 A 53 ASP H A 52 GLY H 1.0 1.8 3.02 906 652 A 53 ASP HBx A 52 GLY H 1.0 1.8 4.85 907 653 A 52 GLY H A 72 LEU HA 1.0 1.8 4.85 908 654 A 52 GLY H A 72 LEU HBx 1.0 1.8 3.96 909 655 A 52 GLY H A 72 LEU HBy 1.0 1.8 4.37 910 656 A 52 GLY H A 72 LEU HDx% 1.0 1.8 5.26 911 656 A 72 LEU HD21 A 52 GLY H 1.0 1.8 5.26 912 657 A 52 GLY H A 73 LYS HA 1.0 1.8 4.44 913 658 A 82 ILE HG2% A 52 GLY H 1.0 1.8 5.49 914 659 A 53 ASP H A 52 GLY HAy 1.0 1.8 3.09 915 659 A 53 ASP H A 52 GLY HAx 1.0 1.8 3.09 916 660 A 54 ARG H A 53 ASP HA 1.0 1.8 2.80 917 661 A 53 ASP H A 53 ASP HBx 1.0 1.8 2.85 918 662 A 53 ASP H A 53 ASP HBy 1.0 1.8 3.09 919 663 A 53 ASP H A 54 ARG H 1.0 1.8 4.73 920 664 A 72 LEU HG A 53 ASP H 1.0 1.8 4.09 921 665 A 53 ASP H A 72 LEU H 1.0 1.8 4.45 922 666 A 53 ASP H A 72 LEU HBx 1.0 1.8 3.96 923 667 A 53 ASP H A 72 LEU HBy 1.0 1.8 3.93 924 668 A 53 ASP HBx A 54 ARG H 1.0 1.8 3.76 925 669 A 72 LEU HG A 53 ASP HBx 1.0 1.8 3.86 926 670 A 53 ASP HBy A 54 ARG H 1.0 1.8 3.75 927 671 A 55 VAL HGy% A 53 ASP HBy 1.0 1.8 5.68 928 672 A 72 LEU HG A 53 ASP HBy 1.0 1.8 4.12 929 673 A 53 ASP HBy A 72 LEU H 1.0 1.8 5.04 930 674 A 54 ARG HA A 54 ARG HDx 1.0 1.8 4.91 931 674 A 54 ARG HA A 54 ARG HDy 1.0 1.8 4.91 932 675 A 54 ARG HA A 55 VAL H 1.0 1.8 2.89 933 676 A 55 VAL HGy% A 54 ARG HA 1.0 1.8 3.84 934 677 A 54 ARG HA A 71 VAL HA 1.0 1.8 4.27 935 678 A 71 VAL H A 54 ARG HA 1.0 1.8 4.93 936 679 A 54 ARG HA A 71 VAL HGx% 1.0 1.8 4.14 937 679 A 54 ARG HA A 71 VAL HG21 1.0 1.8 4.14 938 680 A 72 LEU H A 54 ARG HA 1.0 1.8 4.16 939 681 A 54 ARG H A 54 ARG HBx 1.0 1.8 3.62 940 681 A 54 ARG H A 54 ARG HBy 1.0 1.8 3.62 941 682 A 54 ARG H A 54 ARG HDx 1.0 1.8 5.05 942 682 A 54 ARG H A 54 ARG HDy 1.0 1.8 5.05 943 683 A 54 ARG H A 54 ARG HGx 1.0 1.8 3.82 944 683 A 54 ARG H A 54 ARG HGy 1.0 1.8 3.82 945 684 A 54 ARG H A 55 VAL H 1.0 1.8 4.16 946 685 A 55 VAL HGx% A 54 ARG H 1.0 1.8 4.52 947 686 A 55 VAL HGy% A 54 ARG H 1.0 1.8 5.02 948 687 A 54 ARG HBx A 54 ARG HDx 1.0 1.8 3.78 949 687 A 54 ARG HBy A 54 ARG HDx 1.0 1.8 3.78 950 687 A 54 ARG HDy A 54 ARG HBx 1.0 1.8 3.78 951 687 A 54 ARG HDy A 54 ARG HBy 1.0 1.8 3.78 952 688 A 55 VAL HA A 54 ARG HBx 1.0 1.8 4.86 953 688 A 54 ARG HBy A 55 VAL HA 1.0 1.8 4.86 954 689 A 55 VAL H A 54 ARG HBx 1.0 1.8 3.51 955 689 A 55 VAL H A 54 ARG HBy 1.0 1.8 3.51 956 690 A 71 VAL HA A 54 ARG HBx 1.0 1.8 4.73 957 690 A 71 VAL HA A 54 ARG HBy 1.0 1.8 4.73 958 691 A 54 ARG HBx A 71 VAL HGx% 1.0 1.8 3.84 959 691 A 54 ARG HBy A 71 VAL HGx% 1.0 1.8 3.84 960 691 A 71 VAL HG21 A 54 ARG HBx 1.0 1.8 3.84 961 691 A 71 VAL HG21 A 54 ARG HBy 1.0 1.8 3.84 962 692 A 54 ARG HDy A 71 VAL HGx% 1.0 1.8 4.01 963 692 A 54 ARG HDx A 71 VAL HGx% 1.0 1.8 4.01 964 692 A 71 VAL HG21 A 54 ARG HDx 1.0 1.8 4.01 965 692 A 54 ARG HDy A 71 VAL HG21 1.0 1.8 4.01 966 693 A 55 VAL HA A 54 ARG HGx 1.0 1.8 5.50 967 693 A 54 ARG HGy A 55 VAL HA 1.0 1.8 5.50 968 694 A 54 ARG HGy A 71 VAL HGx% 1.0 1.8 3.94 969 694 A 54 ARG HGx A 71 VAL HGx% 1.0 1.8 3.94 970 694 A 71 VAL HG21 A 54 ARG HGx 1.0 1.8 3.94 971 694 A 71 VAL HG21 A 54 ARG HGy 1.0 1.8 3.94 972 695 A 55 VAL HGx% A 55 VAL HA 1.0 1.8 3.67 973 696 A 55 VAL HGy% A 55 VAL HA 1.0 1.8 4.19 974 697 A 56 ARG H A 55 VAL HA 1.0 1.8 2.64 975 698 A 55 VAL HB A 56 ARG H 1.0 1.8 3.22 976 699 A 55 VAL HB A 55 VAL H 1.0 1.8 4.00 977 700 A 55 VAL HGx% A 55 VAL H 1.0 1.8 3.76 978 701 A 55 VAL HGy% A 55 VAL H 1.0 1.8 3.22 979 702 A 55 VAL H A 71 VAL HA 1.0 1.8 3.93 980 703 A 72 LEU H A 55 VAL H 1.0 1.8 4.66 981 704 A 56 ARG H A 55 VAL HGx% 1.0 1.8 3.50 982 705 A 56 ARG H A 55 VAL HGy% 1.0 1.8 3.83 983 706 A 55 VAL HGy% A 70 LEU H 1.0 1.8 3.63 984 707 A 55 VAL HGy% A 70 LEU HBy 1.0 1.8 3.83 985 707 A 55 VAL HGy% A 70 LEU HBx 1.0 1.8 3.83 986 708 A 55 VAL HGy% A 72 LEU H 1.0 1.8 3.99 987 709 A 56 ARG HA A 57 VAL H 1.0 1.8 2.74 988 710 A 56 ARG HA A 68 ALA H 1.0 1.8 4.47 989 711 A 56 ARG H A 56 ARG HBx 1.0 1.8 3.01 990 711 A 56 ARG H A 56 ARG HBy 1.0 1.8 3.01 991 712 A 56 ARG H A 56 ARG HDx 1.0 1.8 4.51 992 712 A 56 ARG H A 56 ARG HDy 1.0 1.8 4.51 993 713 A 56 ARG H A 57 VAL H 1.0 1.8 4.24 994 714 A 56 ARG HBx A 56 ARG HDx 1.0 1.8 3.57 995 714 A 56 ARG HBy A 56 ARG HDx 1.0 1.8 3.57 996 714 A 56 ARG HDy A 56 ARG HBx 1.0 1.8 3.57 997 714 A 56 ARG HBy A 56 ARG HDy 1.0 1.8 3.57 998 715 A 57 VAL H A 56 ARG HBx 1.0 1.8 3.72 999 715 A 56 ARG HBy A 57 VAL H 1.0 1.8 3.72 1000 716 A 57 VAL H A 56 ARG HDx 1.0 1.8 5.06 1001 716 A 57 VAL H A 56 ARG HDy 1.0 1.8 5.06 1002 717 A 56 ARG HDx A 69 GLU HGx 1.0 1.8 4.55 1003 717 A 56 ARG HDy A 69 GLU HGx 1.0 1.8 4.55 1004 717 A 69 GLU HGy A 56 ARG HDx 1.0 1.8 4.55 1005 717 A 56 ARG HDy A 69 GLU HGy 1.0 1.8 4.55 1006 718 A 70 LEU H A 56 ARG HDx 1.0 1.8 5.51 1007 718 A 70 LEU H A 56 ARG HDy 1.0 1.8 5.51 1008 719 A 58 THR H A 57 VAL HA 1.0 1.8 2.80 1009 720 A 68 ALA HB% A 57 VAL HA 1.0 1.8 4.81 1010 721 A 58 THR H A 57 VAL HB 1.0 1.8 4.21 1011 722 A 68 ALA H A 57 VAL HB 1.0 1.8 4.19 1012 723 A 68 ALA HB% A 57 VAL HB 1.0 1.8 4.05 1013 724 A 57 VAL H A 57 VAL HB 1.0 1.8 3.11 1014 725 A 58 THR H A 57 VAL H 1.0 1.8 4.39 1015 726 A 57 VAL H A 67 GLU HA 1.0 1.8 4.67 1016 727 A 57 VAL H A 67 GLU HGx 1.0 1.8 5.18 1017 727 A 57 VAL H A 67 GLU HGy 1.0 1.8 5.18 1018 728 A 57 VAL H A 68 ALA H 1.0 1.8 3.31 1019 729 A 68 ALA HB% A 57 VAL H 1.0 1.8 3.73 1020 730 A 57 VAL H A 69 GLU HA 1.0 1.8 3.48 1021 731 A 69 GLU H A 57 VAL H 1.0 1.8 4.77 1022 732 A 70 LEU H A 57 VAL H 1.0 1.8 4.28 1023 733 A 58 THR H A 57 VAL HGx% 1.0 1.8 3.28 1024 733 A 57 VAL HG21 A 58 THR H 1.0 1.8 3.28 1025 734 A 59 PHE HA A 57 VAL HGx% 1.0 1.8 4.67 1026 734 A 59 PHE HA A 57 VAL HG21 1.0 1.8 4.67 1027 735 A 59 PHE H A 57 VAL HGx% 1.0 1.8 4.91 1028 735 A 57 VAL HG21 A 59 PHE H 1.0 1.8 4.91 1029 736 A 59 PHE HBy A 57 VAL HGx% 1.0 1.8 5.28 1030 736 A 59 PHE HBy A 57 VAL HG21 1.0 1.8 5.28 1031 737 A 59 PHE HD% A 57 VAL HGx% 1.0 1.8 3.75 1032 737 A 59 PHE HD% A 57 VAL HG21 1.0 1.8 3.75 1033 738 A 68 ALA H A 57 VAL HGx% 1.0 1.8 4.50 1034 738 A 57 VAL HG21 A 68 ALA H 1.0 1.8 4.50 1035 739 A 58 THR HA A 58 THR HG2% 1.0 1.8 3.43 1036 740 A 59 PHE H A 58 THR HA 1.0 1.8 2.79 1037 741 A 58 THR HA A 66 HIS H 1.0 1.8 4.82 1038 742 A 58 THR HA A 67 GLU HA 1.0 1.8 3.89 1039 743 A 58 THR HA A 67 GLU H 1.0 1.8 4.53 1040 744 A 58 THR HA A 67 GLU HGx 1.0 1.8 4.24 1041 744 A 58 THR HA A 67 GLU HGy 1.0 1.8 4.24 1042 745 A 58 THR HA A 68 ALA H 1.0 1.8 3.85 1043 746 A 59 PHE H A 58 THR HB 1.0 1.8 4.28 1044 747 A 58 THR H A 58 THR HB 1.0 1.8 3.26 1045 748 A 58 THR H A 58 THR HG2% 1.0 1.8 3.86 1046 749 A 58 THR H A 59 PHE H 1.0 1.8 4.71 1047 750 A 68 ALA HB% A 58 THR H 1.0 1.8 5.53 1048 751 A 59 PHE H A 58 THR HG2% 1.0 1.8 3.23 1049 752 A 58 THR HG2% A 65 GLN HBx 1.0 1.8 4.62 1050 752 A 58 THR HG2% A 65 GLN HBy 1.0 1.8 4.62 1051 753 A 58 THR HG2% A 66 HIS H 1.0 1.8 4.00 1052 754 A 58 THR HG2% A 67 GLU HA 1.0 1.8 4.57 1053 755 A 58 THR HG2% A 68 ALA H 1.0 1.8 5.33 1054 756 A 59 PHE HD% A 59 PHE HA 1.0 1.8 4.48 1055 757 A 59 PHE HA A 60 ILE HB 1.0 1.8 5.06 1056 758 A 60 ILE H A 59 PHE HA 1.0 1.8 3.11 1057 759 A 59 PHE HA A 60 ILE HD1% 1.0 1.8 3.65 1058 760 A 59 PHE HBx A 59 PHE H 1.0 1.8 4.19 1059 761 A 59 PHE HBy A 59 PHE H 1.0 1.8 4.11 1060 762 A 59 PHE HD% A 59 PHE H 1.0 1.8 3.86 1061 763 A 59 PHE HE% A 59 PHE H 1.0 1.8 4.34 1062 764 A 59 PHE H A 60 ILE HA 1.0 1.8 4.95 1063 765 A 59 PHE H A 65 GLN HA 1.0 1.8 5.19 1064 766 A 59 PHE H A 66 HIS H 1.0 1.8 3.38 1065 767 A 59 PHE H A 66 HIS HBy 1.0 1.8 4.71 1066 768 A 59 PHE H A 67 GLU HA 1.0 1.8 3.73 1067 769 A 59 PHE H A 67 GLU H 1.0 1.8 4.85 1068 770 A 59 PHE H A 67 GLU HGx 1.0 1.8 4.85 1069 770 A 59 PHE H A 67 GLU HGy 1.0 1.8 4.85 1070 771 A 59 PHE H A 68 ALA H 1.0 1.8 4.56 1071 772 A 68 ALA HB% A 59 PHE H 1.0 1.8 4.64 1072 773 A 59 PHE HBx A 60 ILE H 1.0 1.8 4.44 1073 774 A 59 PHE HBy A 60 ILE H 1.0 1.8 4.70 1074 775 A 59 PHE HD% A 60 ILE H 1.0 1.8 4.64 1075 776 A 59 PHE HD% A 60 ILE HD1% 1.0 1.8 5.21 1076 777 A 59 PHE HD% A 60 ILE HG2% 1.0 1.8 4.81 1077 778 A 59 PHE HD% A 61 ARG HBx 1.0 1.8 3.76 1078 779 A 59 PHE HD% A 66 HIS HBx 1.0 1.8 5.01 1079 780 A 59 PHE HD% A 66 HIS HBy 1.0 1.8 4.45 1080 781 A 59 PHE HD% A 67 GLU HA 1.0 1.8 4.88 1081 782 A 59 PHE HD% A 68 ALA H 1.0 1.8 4.21 1082 783 A 59 PHE HE% A 60 ILE H 1.0 1.8 5.22 1083 784 A 59 PHE HE% A 60 ILE HD1% 1.0 1.8 5.98 1084 785 A 59 PHE HE% A 61 ARG H 1.0 1.8 4.51 1085 786 A 59 PHE HE% A 61 ARG HBx 1.0 1.8 4.35 1086 787 A 59 PHE HE% A 61 ARG HDy 1.0 1.8 5.23 1087 787 A 59 PHE HE% A 61 ARG HDx 1.0 1.8 5.23 1088 788 A 59 PHE HE% A 66 HIS H 1.0 1.8 4.60 1089 789 A 59 PHE HE% A 66 HIS HBx 1.0 1.8 4.49 1090 790 A 59 PHE HE% A 66 HIS HBy 1.0 1.8 4.51 1091 791 A 59 PHE HE% A 66 HIS HD2 1.0 1.8 3.84 1092 792 A 59 PHE HE% A 67 GLU HA 1.0 1.8 4.89 1093 793 A 59 PHE HE% A 67 GLU H 1.0 1.8 4.75 1094 794 A 59 PHE HE% A 68 ALA H 1.0 1.8 4.47 1095 795 A 68 ALA HB% A 59 PHE HE% 1.0 1.8 3.40 1096 796 A 60 ILE HD1% A 60 ILE HA 1.0 1.8 3.84 1097 797 A 60 ILE HA A 60 ILE HG1x 1.0 1.8 4.09 1098 797 A 60 ILE HG1y A 60 ILE HA 1.0 1.8 4.09 1099 798 A 60 ILE HG2% A 60 ILE HA 1.0 1.8 3.56 1100 799 A 60 ILE HA A 61 ARG H 1.0 1.8 2.84 1101 800 A 60 ILE HA A 64 LYS H 1.0 1.8 4.62 1102 801 A 66 HIS H A 60 ILE HA 1.0 1.8 3.84 1103 802 A 60 ILE HB A 60 ILE HD1% 1.0 1.8 3.60 1104 803 A 60 ILE HB A 61 ARG H 1.0 1.8 4.76 1105 804 A 60 ILE H A 60 ILE HB 1.0 1.8 3.41 1106 805 A 60 ILE H A 60 ILE HD1% 1.0 1.8 3.49 1107 806 A 60 ILE H A 60 ILE HG1x 1.0 1.8 4.18 1108 806 A 60 ILE H A 60 ILE HG1y 1.0 1.8 4.18 1109 807 A 60 ILE H A 60 ILE HG2% 1.0 1.8 3.49 1110 808 A 60 ILE H A 61 ARG H 1.0 1.8 4.54 1111 809 A 60 ILE H A 61 ARG HBx 1.0 1.8 5.94 1112 810 A 60 ILE H A 65 GLN HA 1.0 1.8 5.26 1113 811 A 60 ILE HD1% A 65 GLN HA 1.0 1.8 3.83 1114 812 A 60 ILE HD1% A 65 GLN H 1.0 1.8 4.23 1115 813 A 60 ILE HD1% A 65 GLN HBx 1.0 1.8 4.07 1116 813 A 60 ILE HD1% A 65 GLN HBy 1.0 1.8 4.07 1117 814 A 60 ILE HD1% A 66 HIS H 1.0 1.8 3.43 1118 815 A 64 LYS HA A 60 ILE HG1x 1.0 1.8 4.67 1119 815 A 60 ILE HG1y A 64 LYS HA 1.0 1.8 4.67 1120 816 A 64 LYS H A 60 ILE HG1x 1.0 1.8 4.70 1121 816 A 60 ILE HG1y A 64 LYS H 1.0 1.8 4.70 1122 817 A 65 GLN H A 60 ILE HG1x 1.0 1.8 4.39 1123 817 A 60 ILE HG1y A 65 GLN H 1.0 1.8 4.39 1124 818 A 60 ILE HG2% A 60 ILE HG1x 1.0 1.8 3.48 1125 818 A 60 ILE HG2% A 60 ILE HG1y 1.0 1.8 3.48 1126 819 A 60 ILE HG2% A 61 ARG H 1.0 1.8 3.22 1127 820 A 60 ILE HG2% A 62 ASP H 1.0 1.8 5.20 1128 821 A 60 ILE HG2% A 63 ARG HA 1.0 1.8 3.38 1129 822 A 60 ILE HG2% A 63 ARG H 1.0 1.8 3.33 1130 823 A 60 ILE HG2% A 64 LYS H 1.0 1.8 3.22 1131 824 A 60 ILE HG2% A 66 HIS HD2 1.0 1.8 5.89 1132 825 A 62 ASP H A 61 ARG HA 1.0 1.8 2.99 1133 826 A 63 ARG H A 61 ARG HA 1.0 1.8 3.82 1134 827 A 61 ARG HBx A 61 ARG H 1.0 1.8 3.79 1135 828 A 61 ARG H A 61 ARG HBy 1.0 1.8 3.50 1136 829 A 61 ARG H A 61 ARG HDy 1.0 1.8 5.06 1137 829 A 61 ARG H A 61 ARG HDx 1.0 1.8 5.06 1138 830 A 61 ARG H A 61 ARG HGx 1.0 1.8 5.06 1139 830 A 61 ARG H A 61 ARG HGy 1.0 1.8 5.06 1140 831 A 61 ARG H A 62 ASP H 1.0 1.8 5.03 1141 832 A 61 ARG H A 63 ARG HA 1.0 1.8 4.86 1142 833 A 61 ARG H A 63 ARG H 1.0 1.8 4.55 1143 834 A 61 ARG H A 64 LYS H 1.0 1.8 3.26 1144 835 A 65 GLN HA A 61 ARG H 1.0 1.8 4.20 1145 836 A 61 ARG H A 65 GLN H 1.0 1.8 5.32 1146 837 A 61 ARG H A 66 HIS HD2 1.0 1.8 3.94 1147 838 A 61 ARG HBx A 62 ASP H 1.0 1.8 4.79 1148 839 A 61 ARG HBx A 64 LYS H 1.0 1.8 5.01 1149 840 A 61 ARG HBx A 66 HIS HD2 1.0 1.8 4.00 1150 841 A 61 ARG HBy A 61 ARG HDy 1.0 1.8 3.48 1151 841 A 61 ARG HDx A 61 ARG HBy 1.0 1.8 3.48 1152 842 A 61 ARG HDx A 61 ARG HBy 1.0 1.8 3.98 1153 843 A 61 ARG HBy A 61 ARG HDy 1.0 1.8 3.98 1154 844 A 62 ASP H A 61 ARG HBy 1.0 1.8 4.46 1155 845 A 61 ARG HBy A 64 LYS HEx 1.0 1.8 5.91 1156 845 A 61 ARG HBy A 64 LYS HEy 1.0 1.8 5.91 1157 846 A 66 HIS HD2 A 61 ARG HBy 1.0 1.8 4.62 1158 847 A 62 ASP H A 61 ARG HGx 1.0 1.8 4.48 1159 847 A 62 ASP H A 61 ARG HGy 1.0 1.8 4.48 1160 848 A 63 ARG H A 62 ASP HA 1.0 1.8 3.21 1161 849 A 64 LYS H A 62 ASP HA 1.0 1.8 5.02 1162 850 A 62 ASP H A 63 ARG HA 1.0 1.8 5.01 1163 851 A 62 ASP H A 63 ARG H 1.0 1.8 3.88 1164 852 A 64 LYS H A 62 ASP H 1.0 1.8 4.95 1165 853 A 64 LYS H A 62 ASP HBx 1.0 1.8 4.51 1166 853 A 64 LYS H A 62 ASP HBy 1.0 1.8 4.51 1167 854 A 63 ARG H A 62 ASP HBx 1.0 1.8 4.63 1168 855 A 63 ARG H A 62 ASP HBy 1.0 1.8 4.63 1169 856 A 64 LYS H A 63 ARG HA 1.0 1.8 3.32 1170 857 A 63 ARG HA A 63 ARG H 1.0 1.8 2.70 1171 858 A 63 ARG H A 63 ARG HBy 1.0 1.8 3.06 1172 858 A 63 ARG H A 63 ARG HBx 1.0 1.8 3.06 1173 859 A 63 ARG H A 63 ARG HDx 1.0 1.8 5.33 1174 859 A 63 ARG H A 63 ARG HDy 1.0 1.8 5.33 1175 860 A 64 LYS HA A 63 ARG H 1.0 1.8 5.37 1176 861 A 64 LYS H A 63 ARG H 1.0 1.8 3.06 1177 862 A 63 ARG HBx A 63 ARG HDx 1.0 1.8 2.98 1178 862 A 63 ARG HBy A 63 ARG HDx 1.0 1.8 2.98 1179 862 A 63 ARG HDy A 63 ARG HBy 1.0 1.8 2.98 1180 862 A 63 ARG HBx A 63 ARG HDy 1.0 1.8 2.98 1181 863 A 64 LYS H A 63 ARG HBy 1.0 1.8 4.29 1182 863 A 64 LYS H A 63 ARG HBx 1.0 1.8 4.29 1183 864 A 64 LYS H A 63 ARG HDx 1.0 1.8 5.85 1184 864 A 64 LYS H A 63 ARG HDy 1.0 1.8 5.85 1185 865 A 65 GLN H A 64 LYS HA 1.0 1.8 2.61 1186 866 A 64 LYS HA A 65 GLN HBx 1.0 1.8 4.51 1187 866 A 65 GLN HBy A 64 LYS HA 1.0 1.8 4.51 1188 867 A 64 LYS H A 64 LYS HBx 1.0 1.8 2.91 1189 867 A 64 LYS H A 64 LYS HBy 1.0 1.8 2.91 1190 868 A 64 LYS H A 64 LYS HDx 1.0 1.8 4.33 1191 868 A 64 LYS H A 64 LYS HDy 1.0 1.8 4.33 1192 869 A 64 LYS H A 64 LYS HEx 1.0 1.8 4.17 1193 869 A 64 LYS H A 64 LYS HEy 1.0 1.8 4.17 1194 870 A 64 LYS H A 65 GLN H 1.0 1.8 4.11 1195 871 A 66 HIS HD2 A 64 LYS H 1.0 1.8 4.87 1196 872 A 65 GLN H A 64 LYS HBx 1.0 1.8 4.60 1197 872 A 65 GLN H A 64 LYS HBy 1.0 1.8 4.60 1198 873 A 66 HIS HD2 A 64 LYS HBx 1.0 1.8 3.91 1199 873 A 66 HIS HD2 A 64 LYS HBy 1.0 1.8 3.91 1200 874 A 64 LYS HGx A 65 GLN HGx 1.0 1.8 6.00 1201 874 A 64 LYS HGy A 65 GLN HGx 1.0 1.8 6.00 1202 874 A 65 GLN HGy A 64 LYS HGx 1.0 1.8 6.00 1203 874 A 64 LYS HGy A 65 GLN HGy 1.0 1.8 6.00 1204 875 A 66 HIS H A 65 GLN HA 1.0 1.8 2.69 1205 876 A 65 GLN HA A 66 HIS HD2 1.0 1.8 4.55 1206 877 A 65 GLN H A 65 GLN HBx 1.0 1.8 2.80 1207 877 A 65 GLN HBy A 65 GLN H 1.0 1.8 2.80 1208 878 A 65 GLN H A 65 GLN HGx 1.0 1.8 4.03 1209 878 A 65 GLN H A 65 GLN HGy 1.0 1.8 4.03 1210 879 A 66 HIS H A 65 GLN H 1.0 1.8 4.34 1211 880 A 66 HIS H A 65 GLN HBx 1.0 1.8 3.42 1212 880 A 66 HIS H A 65 GLN HBy 1.0 1.8 3.42 1213 881 A 66 HIS H A 65 GLN HGx 1.0 1.8 4.46 1214 881 A 66 HIS H A 65 GLN HGy 1.0 1.8 4.46 1215 882 A 67 GLU H A 66 HIS HA 1.0 1.8 2.63 1216 883 A 66 HIS H A 66 HIS HBx 1.0 1.8 4.35 1217 884 A 66 HIS H A 66 HIS HBy 1.0 1.8 3.73 1218 885 A 66 HIS H A 66 HIS HD2 1.0 1.8 3.72 1219 886 A 66 HIS H A 67 GLU H 1.0 1.8 4.44 1220 887 A 66 HIS HBx A 66 HIS HD2 1.0 1.8 3.81 1221 888 A 67 GLU H A 66 HIS HBx 1.0 1.8 3.44 1222 889 A 67 GLU H A 66 HIS HBy 1.0 1.8 4.09 1223 890 A 67 GLU H A 66 HIS HD2 1.0 1.8 5.93 1224 891 A 67 GLU HA A 67 GLU HGx 1.0 1.8 4.05 1225 891 A 67 GLU HA A 67 GLU HGy 1.0 1.8 4.05 1226 892 A 68 ALA H A 67 GLU HA 1.0 1.8 2.63 1227 893 A 68 ALA HB% A 67 GLU HA 1.0 1.8 4.07 1228 894 A 67 GLU H A 67 GLU HBx 1.0 1.8 2.97 1229 894 A 67 GLU H A 67 GLU HBy 1.0 1.8 2.97 1230 895 A 67 GLU H A 67 GLU HGx 1.0 1.8 3.48 1231 895 A 67 GLU HGy A 67 GLU H 1.0 1.8 3.48 1232 896 A 68 ALA H A 67 GLU H 1.0 1.8 4.22 1233 897 A 68 ALA HB% A 67 GLU H 1.0 1.8 5.76 1234 898 A 68 ALA H A 67 GLU HBx 1.0 1.8 3.22 1235 898 A 68 ALA H A 67 GLU HBy 1.0 1.8 3.22 1236 899 A 68 ALA H A 67 GLU HGx 1.0 1.8 3.89 1237 899 A 68 ALA H A 67 GLU HGy 1.0 1.8 3.89 1238 900 A 69 GLU H A 68 ALA HA 1.0 1.8 2.70 1239 901 A 68 ALA HB% A 68 ALA H 1.0 1.8 2.97 1240 902 A 69 GLU H A 68 ALA H 1.0 1.8 4.19 1241 903 A 68 ALA HB% A 69 GLU H 1.0 1.8 3.46 1242 904 A 69 GLU HA A 69 GLU HGx 1.0 1.8 4.05 1243 904 A 69 GLU HGy A 69 GLU HA 1.0 1.8 4.05 1244 905 A 70 LEU H A 69 GLU HA 1.0 1.8 2.65 1245 906 A 69 GLU HA A 70 LEU HBy 1.0 1.8 4.36 1246 906 A 70 LEU HBx A 69 GLU HA 1.0 1.8 4.36 1247 907 A 69 GLU H A 69 GLU HBx 1.0 1.8 2.97 1248 907 A 69 GLU H A 69 GLU HBy 1.0 1.8 2.97 1249 908 A 69 GLU H A 69 GLU HGx 1.0 1.8 4.13 1250 908 A 69 GLU H A 69 GLU HGy 1.0 1.8 4.13 1251 909 A 69 GLU H A 70 LEU H 1.0 1.8 4.27 1252 910 A 70 LEU H A 69 GLU HBx 1.0 1.8 3.93 1253 910 A 70 LEU H A 69 GLU HBy 1.0 1.8 3.93 1254 911 A 70 LEU H A 69 GLU HGx 1.0 1.8 4.36 1255 911 A 70 LEU H A 69 GLU HGy 1.0 1.8 4.36 1256 912 A 71 VAL H A 70 LEU HA 1.0 1.8 2.94 1257 913 A 70 LEU HA A 71 VAL HGx% 1.0 1.8 3.97 1258 913 A 71 VAL HG21 A 70 LEU HA 1.0 1.8 3.97 1259 914 A 70 LEU H A 70 LEU HBy 1.0 1.8 3.07 1260 914 A 70 LEU H A 70 LEU HBx 1.0 1.8 3.07 1261 915 A 70 LEU H A 70 LEU HBx 1.0 1.8 3.80 1262 916 A 70 LEU H A 70 LEU HBy 1.0 1.8 3.80 1263 917 A 71 VAL HA A 70 LEU H 1.0 1.8 4.99 1264 918 A 71 VAL H A 70 LEU H 1.0 1.8 4.47 1265 919 A 71 VAL H A 70 LEU HBy 1.0 1.8 3.40 1266 919 A 71 VAL H A 70 LEU HBx 1.0 1.8 3.40 1267 920 A 70 LEU HBx A 86 VAL HGy% 1.0 1.8 5.89 1268 920 A 70 LEU HBy A 86 VAL HGy% 1.0 1.8 5.89 1269 920 A 86 VAL HGx% A 70 LEU HBy 1.0 1.8 5.89 1270 920 A 86 VAL HGx% A 70 LEU HBx 1.0 1.8 5.89 1271 921 A 71 VAL H A 70 LEU HBx 1.0 1.8 3.92 1272 922 A 71 VAL H A 70 LEU HBy 1.0 1.8 3.92 1273 923 A 72 LEU H A 71 VAL HA 1.0 1.8 3.00 1274 924 A 71 VAL H A 71 VAL HB 1.0 1.8 3.67 1275 925 A 71 VAL H A 71 VAL HGx% 1.0 1.8 3.21 1276 925 A 71 VAL H A 71 VAL HG21 1.0 1.8 3.21 1277 926 A 71 VAL H A 72 LEU H 1.0 1.8 4.62 1278 927 A 72 LEU H A 71 VAL HGx% 1.0 1.8 4.35 1279 927 A 72 LEU H A 71 VAL HG21 1.0 1.8 4.35 1280 928 A 72 LEU HG A 72 LEU HA 1.0 1.8 3.95 1281 929 A 72 LEU HA A 72 LEU HDx% 1.0 1.8 3.30 1282 929 A 72 LEU HD21 A 72 LEU HA 1.0 1.8 3.30 1283 930 A 72 LEU HA A 73 LYS H 1.0 1.8 2.93 1284 931 A 82 ILE HG2% A 72 LEU HA 1.0 1.8 4.07 1285 932 A 72 LEU HG A 73 LYS H 1.0 1.8 5.67 1286 933 A 72 LEU H A 72 LEU HBx 1.0 1.8 3.43 1287 934 A 72 LEU H A 72 LEU HBy 1.0 1.8 3.84 1288 935 A 72 LEU H A 72 LEU HDx% 1.0 1.8 3.91 1289 935 A 72 LEU HD21 A 72 LEU H 1.0 1.8 3.91 1290 936 A 72 LEU H A 73 LYS H 1.0 1.8 4.72 1291 937 A 72 LEU HBx A 73 LYS H 1.0 1.8 4.64 1292 938 A 82 ILE HG2% A 72 LEU HBx 1.0 1.8 3.98 1293 939 A 72 LEU HBy A 73 LYS H 1.0 1.8 5.25 1294 940 A 82 ILE HG2% A 72 LEU HBy 1.0 1.8 3.72 1295 941 A 82 ILE HB A 72 LEU HDx% 1.0 1.8 3.26 1296 941 A 72 LEU HD21 A 82 ILE HB 1.0 1.8 3.26 1297 942 A 73 LYS HA A 74 PRO HDy 1.0 1.8 3.40 1298 942 A 74 PRO HDx A 73 LYS HA 1.0 1.8 3.40 1299 943 A 73 LYS H A 73 LYS HBy 1.0 1.8 3.32 1300 943 A 73 LYS H A 73 LYS HBx 1.0 1.8 3.32 1301 944 A 73 LYS H A 73 LYS HBx 1.0 1.8 3.81 1302 945 A 73 LYS H A 73 LYS HBy 1.0 1.8 3.81 1303 946 A 73 LYS H A 74 PRO HDy 1.0 1.8 4.35 1304 946 A 74 PRO HDx A 73 LYS H 1.0 1.8 4.35 1305 947 A 73 LYS H A 82 ILE HA 1.0 1.8 4.85 1306 948 A 82 ILE HG2% A 73 LYS H 1.0 1.8 3.52 1307 949 A 83 GLY H A 73 LYS H 1.0 1.8 3.64 1308 950 A 73 LYS HBy A 74 PRO HDy 1.0 1.8 3.90 1309 950 A 73 LYS HBx A 74 PRO HDy 1.0 1.8 3.90 1310 950 A 74 PRO HDx A 73 LYS HBy 1.0 1.8 3.90 1311 950 A 74 PRO HDx A 73 LYS HBx 1.0 1.8 3.90 1312 951 A 74 PRO HDx A 73 LYS HBx 1.0 1.8 4.52 1313 951 A 73 LYS HBx A 74 PRO HDy 1.0 1.8 4.52 1314 952 A 74 PRO HDx A 73 LYS HBy 1.0 1.8 4.52 1315 952 A 73 LYS HBy A 74 PRO HDy 1.0 1.8 4.52 1316 953 A 74 PRO HA A 75 PHE H 1.0 1.8 3.01 1317 954 A 74 PRO HA A 81 GLN H 1.0 1.8 4.96 1318 955 A 82 ILE HG2% A 74 PRO HA 1.0 1.8 3.85 1319 956 A 83 GLY H A 74 PRO HA 1.0 1.8 4.01 1320 957 A 74 PRO HBy A 75 PHE H 1.0 1.8 3.67 1321 958 A 74 PRO HBy A 79 PRO HA 1.0 1.8 4.21 1322 959 A 82 ILE HD1% A 74 PRO HBy 1.0 1.8 4.75 1323 960 A 82 ILE HG2% A 74 PRO HBy 1.0 1.8 4.78 1324 961 A 75 PHE H A 74 PRO HDy 1.0 1.8 5.13 1325 961 A 74 PRO HDx A 75 PHE H 1.0 1.8 5.13 1326 962 A 82 ILE HD1% A 74 PRO HDy 1.0 1.8 5.36 1327 962 A 82 ILE HD1% A 74 PRO HDx 1.0 1.8 5.36 1328 963 A 83 GLY H A 74 PRO HDy 1.0 1.8 5.10 1329 963 A 83 GLY H A 74 PRO HDx 1.0 1.8 5.10 1330 964 A 75 PHE H A 74 PRO HDy 1.0 1.8 5.40 1331 965 A 82 ILE HD1% A 74 PRO HDy 1.0 1.8 4.94 1332 966 A 82 ILE HG2% A 74 PRO HDy 1.0 1.8 4.57 1333 967 A 82 ILE HD1% A 74 PRO HGx 1.0 1.8 4.82 1334 967 A 82 ILE HD1% A 74 PRO HGy 1.0 1.8 4.82 1335 968 A 75 PHE H A 75 PHE HBx 1.0 1.8 3.05 1336 968 A 75 PHE H A 75 PHE HBy 1.0 1.8 3.05 1337 969 A 75 PHE H A 75 PHE HBx 1.0 1.8 3.62 1338 970 A 75 PHE H A 75 PHE HBy 1.0 1.8 3.62 1339 971 A 75 PHE H A 75 PHE HD% 1.0 1.8 3.81 1340 972 A 75 PHE H A 79 PRO HA 1.0 1.8 4.28 1341 973 A 75 PHE H A 80 ASN H 1.0 1.8 5.51 1342 974 A 75 PHE H A 81 GLN H 1.0 1.8 4.35 1343 975 A 75 PHE H A 81 GLN HBx 1.0 1.8 4.28 1344 975 A 75 PHE H A 81 GLN HBy 1.0 1.8 4.28 1345 976 A 82 ILE HG2% A 75 PHE H 1.0 1.8 5.80 1346 977 A 75 PHE HD% A 81 GLN HBx 1.0 1.8 3.75 1347 977 A 75 PHE HD% A 81 GLN HBy 1.0 1.8 3.75 1348 978 A 77 HIS H A 78 HIS H 1.0 1.8 5.01 1349 979 A 78 HIS HA A 79 PRO HDx 1.0 1.8 3.28 1350 979 A 78 HIS HA A 79 PRO HDy 1.0 1.8 3.28 1351 980 A 78 HIS HA A 79 PRO HDx 1.0 1.8 3.77 1352 981 A 78 HIS HA A 79 PRO HDy 1.0 1.8 3.77 1353 982 A 78 HIS HA A 79 PRO HGx 1.0 1.8 4.46 1354 982 A 78 HIS HA A 79 PRO HGy 1.0 1.8 4.46 1355 983 A 80 ASN H A 78 HIS HA 1.0 1.8 4.18 1356 984 A 78 HIS HA A 80 ASN HBx 1.0 1.8 4.40 1357 984 A 78 HIS HA A 80 ASN HBy 1.0 1.8 4.40 1358 985 A 78 HIS H A 78 HIS HBx 1.0 1.8 4.05 1359 985 A 78 HIS H A 78 HIS HBy 1.0 1.8 4.05 1360 986 A 78 HIS H A 79 PRO HDx 1.0 1.8 3.96 1361 986 A 78 HIS H A 79 PRO HDy 1.0 1.8 3.96 1362 987 A 78 HIS H A 79 PRO HDx 1.0 1.8 4.64 1363 988 A 78 HIS H A 79 PRO HDy 1.0 1.8 4.64 1364 989 A 81 GLN H A 78 HIS H 1.0 1.8 6.00 1365 990 A 80 ASN H A 78 HIS HBx 1.0 1.8 4.41 1366 990 A 80 ASN H A 78 HIS HBy 1.0 1.8 4.41 1367 991 A 81 GLN H A 78 HIS HBx 1.0 1.8 4.26 1368 991 A 81 GLN H A 78 HIS HBy 1.0 1.8 4.26 1369 992 A 81 GLN H A 79 PRO HA 1.0 1.8 4.36 1370 993 A 80 ASN H A 79 PRO HBy 1.0 1.8 3.99 1371 993 A 80 ASN H A 79 PRO HBx 1.0 1.8 3.99 1372 994 A 80 ASN H A 79 PRO HDx 1.0 1.8 3.61 1373 994 A 80 ASN H A 79 PRO HDy 1.0 1.8 3.61 1374 995 A 80 ASN H A 79 PRO HDx 1.0 1.8 4.35 1375 996 A 80 ASN H A 79 PRO HDy 1.0 1.8 4.35 1376 997 A 80 ASN H A 79 PRO HGx 1.0 1.8 3.82 1377 997 A 80 ASN H A 79 PRO HGy 1.0 1.8 3.82 1378 998 A 80 ASN H A 80 ASN HBx 1.0 1.8 3.07 1379 998 A 80 ASN H A 80 ASN HBy 1.0 1.8 3.07 1380 999 A 80 ASN H A 81 GLN HA 1.0 1.8 5.24 1381 1000 A 80 ASN H A 81 GLN HBx 1.0 1.8 4.50 1382 1000 A 80 ASN H A 81 GLN HBy 1.0 1.8 4.50 1383 1001 A 81 GLN H A 80 ASN HBx 1.0 1.8 3.88 1384 1001 A 81 GLN H A 80 ASN HBy 1.0 1.8 3.88 1385 1002 A 81 GLN H A 81 GLN HBx 1.0 1.8 3.25 1386 1002 A 81 GLN H A 81 GLN HBy 1.0 1.8 3.25 1387 1003 A 82 ILE HD1% A 81 GLN H 1.0 1.8 4.95 1388 1004 A 81 GLN H A 82 ILE HG12 1.0 1.8 5.55 1389 1004 A 81 GLN H A 82 ILE HG13 1.0 1.8 5.55 1390 1005 A 82 ILE HG2% A 81 GLN H 1.0 1.8 5.52 1391 1006 A 82 ILE HG2% A 81 GLN HGx 1.0 1.8 6.00 1392 1006 A 82 ILE HG2% A 81 GLN HGy 1.0 1.8 6.00 1393 1007 A 82 ILE HD1% A 82 ILE HA 1.0 1.8 3.65 1394 1008 A 82 ILE HG2% A 82 ILE HA 1.0 1.8 3.88 1395 1009 A 83 GLY H A 82 ILE HA 1.0 1.8 3.05 1396 1010 A 82 ILE HB A 82 ILE HD1% 1.0 1.8 3.45 1397 1011 A 82 ILE HB A 83 GLY H 1.0 1.8 3.56 1398 1012 A 82 ILE HG2% A 82 ILE HG12 1.0 1.8 3.49 1399 1012 A 82 ILE HG2% A 82 ILE HG13 1.0 1.8 3.49 1400 1013 A 82 ILE HG2% A 83 GLY H 1.0 1.8 3.21 1401 1014 A 85 GLY H A 84 LEU HBx 1.0 1.8 4.66 1402 1014 A 84 LEU HBy A 85 GLY H 1.0 1.8 4.66 1403 1015 A 86 VAL HA A 87 THR H 1.0 1.8 3.12 1404 1016 A 87 THR H A 86 VAL HB 1.0 1.8 4.40 1405 1017 A 87 THR H A 86 VAL HGy% 1.0 1.8 3.57 1406 1017 A 86 VAL HGx% A 87 THR H 1.0 1.8 3.57 1407 1018 A 87 THR H A 87 THR HB 1.0 1.8 3.89 1408 1019 A 87 THR H A 87 THR HG2% 1.0 1.8 3.95 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 6 GLY C A 7 VAL N A 7 VAL CA A 7 VAL C 1.0 -138.1 -49.7 PHI 2 2 A 7 VAL N A 7 VAL CA A 7 VAL C A 8 TYR N 1.0 95.5 173.9 PSI 3 3 A 7 VAL C A 8 TYR N A 8 TYR CA A 8 TYR C 1.0 -143.0 -62.8 PHI 4 4 A 8 TYR N A 8 TYR CA A 8 TYR C A 9 VAL N 1.0 110.1 156.5 PSI 5 5 A 8 TYR C A 9 VAL N A 9 VAL CA A 9 VAL C 1.0 -126.6 -49.0 PHI 6 6 A 9 VAL N A 9 VAL CA A 9 VAL C A 10 MET N 1.0 88.1 164.3 PSI 7 7 A 9 VAL C A 10 MET N A 10 MET CA A 10 MET C 1.0 -108.7 -63.1 PHI 8 8 A 10 MET N A 10 MET CA A 10 MET C A 11 SER N 1.0 -76.1 33.5 PSI 9 9 A 10 MET C A 11 SER N A 11 SER CA A 11 SER C 1.0 -204.5 -107.1 PHI 10 10 A 11 SER N A 11 SER CA A 11 SER C A 12 VAL N 1.0 144.6 174.6 PSI 11 11 A 11 SER C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -137.0 -89.6 PHI 12 12 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 LEU N 1.0 100.6 154.4 PSI 13 13 A 12 VAL C A 13 LEU N A 13 LEU CA A 13 LEU C 1.0 -112.7 -55.5 PHI 14 14 A 13 LEU N A 13 LEU CA A 13 LEU C A 14 PRO N 1.0 92.2 181.0 PSI 15 15 A 17 PRO C A 18 ALA N A 18 ALA CA A 18 ALA C 1.0 -142.4 -53.4 PHI 16 16 A 18 ALA N A 18 ALA CA A 18 ALA C A 19 ALA N 1.0 -70.8 39.6 PSI 17 17 A 18 ALA C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -104.1 -41.9 PHI 18 18 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 GLY N 1.0 114.3 159.1 PSI 19 19 A 21 ARG C A 22 LEU N A 22 LEU CA A 22 LEU C 1.0 -178.9 -84.9 PHI 20 20 A 22 LEU N A 22 LEU CA A 22 LEU C A 23 GLU N 1.0 128.3 175.1 PSI 21 21 A 22 LEU C A 23 GLU N A 23 GLU CA A 23 GLU C 1.0 -155.1 -101.5 PHI 22 22 A 23 GLU N A 23 GLU CA A 23 GLU C A 24 ALA N 1.0 130.2 183.6 PSI 23 23 A 24 ALA C A 25 GLY N A 25 GLY CA A 25 GLY C 1.0 83.4 110.4 PHI 24 24 A 25 GLY N A 25 GLY CA A 25 GLY C A 26 ASP N 1.0 -33.9 2.1 PSI 25 25 A 26 ASP C A 27 ARG N A 27 ARG CA A 27 ARG C 1.0 -151.2 -81.0 PHI 26 26 A 27 ARG N A 27 ARG CA A 27 ARG C A 28 ILE N 1.0 116.2 171.6 PSI 27 27 A 27 ARG C A 28 ILE N A 28 ILE CA A 28 ILE C 1.0 -105.5 -48.5 PHI 28 28 A 28 ILE N A 28 ILE CA A 28 ILE C A 29 ALA N 1.0 106.6 145.6 PSI 29 29 A 28 ILE C A 29 ALA N A 29 ALA CA A 29 ALA C 1.0 -121.4 -83.4 PHI 30 30 A 29 ALA N A 29 ALA CA A 29 ALA C A 30 ALA N 1.0 -53.1 -16.1 PSI 31 31 A 29 ALA C A 30 ALA N A 30 ALA CA A 30 ALA C 1.0 -198.0 -74.2 PHI 32 32 A 30 ALA N A 30 ALA CA A 30 ALA C A 31 ILE N 1.0 93.8 208.0 PSI 33 33 A 30 ALA C A 31 ILE N A 31 ILE CA A 31 ILE C 1.0 -146.2 -100.0 PHI 34 34 A 31 ILE N A 31 ILE CA A 31 ILE C A 32 ASP N 1.0 114.2 163.4 PSI 35 35 A 32 ASP C A 33 GLY N A 33 GLY CA A 33 GLY C 1.0 55.5 117.7 PHI 36 36 A 33 GLY N A 33 GLY CA A 33 GLY C A 34 GLN N 1.0 -46.5 31.9 PSI 37 37 A 33 GLY C A 34 GLN N A 34 GLN CA A 34 GLN C 1.0 -122.9 -65.3 PHI 38 38 A 34 GLN N A 34 GLN CA A 34 GLN C A 35 PRO N 1.0 106.3 158.1 PSI 39 39 A 35 PRO C A 36 ILE N A 36 ILE CA A 36 ILE C 1.0 -158.6 -78.8 PHI 40 40 A 36 ILE N A 36 ILE CA A 36 ILE C A 37 ASN N 1.0 87.9 197.5 PSI 41 41 A 37 ASN C A 38 THR N A 38 THR CA A 38 THR C 1.0 -175.4 -66.4 PHI 42 42 A 38 THR N A 38 THR CA A 38 THR C A 39 SER N 1.0 138.5 183.9 PSI 43 43 A 38 THR C A 39 SER N A 39 SER CA A 39 SER C 1.0 -80.8 -48.0 PHI 44 44 A 39 SER N A 39 SER CA A 39 SER C A 40 GLU N 1.0 -52.7 -16.1 PSI 45 45 A 39 SER C A 40 GLU N A 40 GLU CA A 40 GLU C 1.0 -76.7 -55.9 PHI 46 46 A 40 GLU N A 40 GLU CA A 40 GLU C A 41 GLN N 1.0 -50.4 -30.4 PSI 47 47 A 40 GLU C A 41 GLN N A 41 GLN CA A 41 GLN C 1.0 -71.6 -51.6 PHI 48 48 A 41 GLN N A 41 GLN CA A 41 GLN C A 42 ILE N 1.0 -54.6 -27.8 PSI 49 49 A 41 GLN C A 42 ILE N A 42 ILE CA A 42 ILE C 1.0 -79.3 -53.9 PHI 50 50 A 42 ILE N A 42 ILE CA A 42 ILE C A 43 VAL N 1.0 -55.6 -31.0 PSI 51 51 A 42 ILE C A 43 VAL N A 43 VAL CA A 43 VAL C 1.0 -72.2 -50.0 PHI 52 52 A 43 VAL N A 43 VAL CA A 43 VAL C A 44 SER N 1.0 -59.9 -31.3 PSI 53 53 A 43 VAL C A 44 SER N A 44 SER CA A 44 SER C 1.0 -73.2 -50.8 PHI 54 54 A 44 SER N A 44 SER CA A 44 SER C A 45 TYR N 1.0 -50.7 -30.7 PSI 55 55 A 44 SER C A 45 TYR N A 45 TYR CA A 45 TYR C 1.0 -78.2 -51.6 PHI 56 56 A 45 TYR N A 45 TYR CA A 45 TYR C A 46 VAL N 1.0 -55.2 -33.0 PSI 57 57 A 45 TYR C A 46 VAL N A 46 VAL CA A 46 VAL C 1.0 -73.1 -53.1 PHI 58 58 A 46 VAL N A 46 VAL CA A 46 VAL C A 47 ARG N 1.0 -60.5 -30.1 PSI 59 59 A 46 VAL C A 47 ARG N A 47 ARG CA A 47 ARG C 1.0 -101.4 -37.6 PHI 60 60 A 47 ARG N A 47 ARG CA A 47 ARG C A 48 GLU N 1.0 -62.1 -19.7 PSI 61 61 A 49 LYS C A 50 GLN N A 50 GLN CA A 50 GLN C 1.0 -169.9 -73.3 PHI 62 62 A 50 GLN N A 50 GLN CA A 50 GLN C A 51 ALA N 1.0 125.6 187.0 PSI 63 63 A 51 ALA C A 52 GLY N A 52 GLY CA A 52 GLY C 1.0 83.1 115.9 PHI 64 64 A 52 GLY N A 52 GLY CA A 52 GLY C A 53 ASP N 1.0 -37.5 -1.5 PSI 65 65 A 52 GLY C A 53 ASP N A 53 ASP CA A 53 ASP C 1.0 -98.2 -51.4 PHI 66 66 A 53 ASP N A 53 ASP CA A 53 ASP C A 54 ARG N 1.0 87.9 185.9 PSI 67 67 A 53 ASP C A 54 ARG N A 54 ARG CA A 54 ARG C 1.0 -146.0 -72.0 PHI 68 68 A 54 ARG N A 54 ARG CA A 54 ARG C A 55 VAL N 1.0 119.3 165.9 PSI 69 69 A 54 ARG C A 55 VAL N A 55 VAL CA A 55 VAL C 1.0 -146.4 -116.4 PHI 70 70 A 55 VAL N A 55 VAL CA A 55 VAL C A 56 ARG N 1.0 127.6 177.2 PSI 71 71 A 55 VAL C A 56 ARG N A 56 ARG CA A 56 ARG C 1.0 -143.5 -62.5 PHI 72 72 A 56 ARG N A 56 ARG CA A 56 ARG C A 57 VAL N 1.0 97.5 138.1 PSI 73 73 A 56 ARG C A 57 VAL N A 57 VAL CA A 57 VAL C 1.0 -153.8 -77.8 PHI 74 74 A 57 VAL N A 57 VAL CA A 57 VAL C A 58 THR N 1.0 103.5 146.9 PSI 75 75 A 57 VAL C A 58 THR N A 58 THR CA A 58 THR C 1.0 -116.7 -96.7 PHI 76 76 A 58 THR N A 58 THR CA A 58 THR C A 59 PHE N 1.0 109.3 146.5 PSI 77 77 A 58 THR C A 59 PHE N A 59 PHE CA A 59 PHE C 1.0 -165.2 -108.2 PHI 78 78 A 59 PHE N A 59 PHE CA A 59 PHE C A 60 ILE N 1.0 124.4 188.0 PSI 79 79 A 59 PHE C A 60 ILE N A 60 ILE CA A 60 ILE C 1.0 -145.8 -90.2 PHI 80 80 A 60 ILE N A 60 ILE CA A 60 ILE C A 61 ARG N 1.0 112.6 137.0 PSI 81 81 A 60 ILE C A 61 ARG N A 61 ARG CA A 61 ARG C 1.0 -174.6 -80.0 PHI 82 82 A 61 ARG N A 61 ARG CA A 61 ARG C A 62 ASP N 1.0 113.0 147.0 PSI 83 83 A 61 ARG C A 62 ASP N A 62 ASP CA A 62 ASP C 1.0 43.7 63.7 PHI 84 84 A 62 ASP N A 62 ASP CA A 62 ASP C A 63 ARG N 1.0 33.9 53.9 PSI 85 85 A 62 ASP C A 63 ARG N A 63 ARG CA A 63 ARG C 1.0 47.2 90.8 PHI 86 86 A 63 ARG N A 63 ARG CA A 63 ARG C A 64 LYS N 1.0 -15.7 42.5 PSI 87 87 A 64 LYS C A 65 GLN N A 65 GLN CA A 65 GLN C 1.0 -127.2 -62.2 PHI 88 88 A 65 GLN N A 65 GLN CA A 65 GLN C A 66 HIS N 1.0 106.6 155.4 PSI 89 89 A 65 GLN C A 66 HIS N A 66 HIS CA A 66 HIS C 1.0 -164.2 -97.4 PHI 90 90 A 66 HIS N A 66 HIS CA A 66 HIS C A 67 GLU N 1.0 141.2 177.8 PSI 91 91 A 66 HIS C A 67 GLU N A 67 GLU CA A 67 GLU C 1.0 -177.1 -91.7 PHI 92 92 A 67 GLU N A 67 GLU CA A 67 GLU C A 68 ALA N 1.0 123.5 174.3 PSI 93 93 A 67 GLU C A 68 ALA N A 68 ALA CA A 68 ALA C 1.0 -175.5 -110.9 PHI 94 94 A 68 ALA N A 68 ALA CA A 68 ALA C A 69 GLU N 1.0 106.2 159.6 PSI 95 95 A 68 ALA C A 69 GLU N A 69 GLU CA A 69 GLU C 1.0 -118.1 -74.3 PHI 96 96 A 69 GLU N A 69 GLU CA A 69 GLU C A 70 LEU N 1.0 102.3 151.7 PSI 97 97 A 69 GLU C A 70 LEU N A 70 LEU CA A 70 LEU C 1.0 -150.5 -85.3 PHI 98 98 A 70 LEU N A 70 LEU CA A 70 LEU C A 71 VAL N 1.0 108.6 161.4 PSI 99 99 A 70 LEU C A 71 VAL N A 71 VAL CA A 71 VAL C 1.0 -141.8 -60.8 PHI 100 100 A 71 VAL N A 71 VAL CA A 71 VAL C A 72 LEU N 1.0 117.5 157.7 PSI 101 101 A 72 LEU C A 73 LYS N A 73 LYS CA A 73 LYS C 1.0 -170.4 -83.0 PHI 102 102 A 73 LYS N A 73 LYS CA A 73 LYS C A 74 PRO N 1.0 83.2 193.4 PSI 103 103 A 74 PRO C A 75 PHE N A 75 PHE CA A 75 PHE C 1.0 -125.1 -42.5 PHI 104 104 A 75 PHE N A 75 PHE CA A 75 PHE C A 76 PRO N 1.0 80.5 178.9 PSI 105 105 A 76 PRO C A 77 HIS N A 77 HIS CA A 77 HIS C 1.0 -101.5 -59.7 PHI 106 106 A 77 HIS N A 77 HIS CA A 77 HIS C A 78 HIS N 1.0 -38.6 20.2 PSI 107 107 A 80 ASN C A 81 GLN N A 81 GLN CA A 81 GLN C 1.0 -164.4 -54.8 PHI 108 108 A 81 GLN N A 81 GLN CA A 81 GLN C A 82 ILE N 1.0 78.9 191.3 PSI 109 109 A 81 GLN C A 82 ILE N A 82 ILE CA A 82 ILE C 1.0 -141.0 -76.6 PHI 110 110 A 82 ILE N A 82 ILE CA A 82 ILE C A 83 GLY N 1.0 131.1 196.7 PSI 111 111 A 83 GLY C A 84 LEU N A 84 LEU CA A 84 LEU C 1.0 -95.8 -32.6 PHI 112 112 A 84 LEU N A 84 LEU CA A 84 LEU C A 85 GLY N 1.0 -79.2 -1.4 PSI 113 113 A 85 GLY C A 86 VAL N A 86 VAL CA A 86 VAL C 1.0 -164.6 -109.0 PHI 114 114 A 86 VAL N A 86 VAL CA A 86 VAL C A 87 THR N 1.0 134.7 170.7 PSI 115 115 A 86 VAL C A 87 THR N A 87 THR CA A 87 THR C 1.0 -138.5 -76.9 PHI stop_ save_