data_nef_c36007_5ghc save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 25576 BMRB 25577 BMRB 36000 BMRB 36006 BMRB 36008 PDB 5GHC stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 46 PHE C 1 47 ALY N 1 47 ALY C 1 48 ILE N stop_ 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 -13 MET start . . 2 A -12 GLY middle . false 3 A -11 SER middle . . 4 A -10 SER middle . . 5 A -9 HIS middle . . 6 A -8 HIS middle . . 7 A -7 HIS middle . . 8 A -6 HIS middle . . 9 A -5 HIS middle . . 10 A -4 HIS middle . . 11 A -3 SER middle . . 12 A -2 GLN middle . . 13 A -1 ASP middle . . 14 A 0 PRO middle . false 15 A 1 MET middle . . 16 A 2 ALA middle . . 17 A 3 ASP middle . . 18 A 4 GLU middle . . 19 A 5 LYS middle . . 20 A 6 PRO middle . false 21 A 7 LYS middle . . 22 A 8 GLU middle . . 23 A 9 GLY middle . false 24 A 10 VAL middle . . 25 A 11 LYS middle . . 26 A 12 THR middle . . 27 A 13 GLU middle . . 28 A 14 ASN middle . . 29 A 15 ASN middle . . 30 A 16 ASP middle . . 31 A 17 HIS middle . . 32 A 18 ILE middle . . 33 A 19 ASN middle . . 34 A 20 LEU middle . . 35 A 21 LYS middle . . 36 A 22 VAL middle . . 37 A 23 ALA middle . . 38 A 24 GLY middle . false 39 A 25 GLN middle . . 40 A 26 ASP middle . . 41 A 27 GLY middle . false 42 A 28 SER middle . . 43 A 29 VAL middle . . 44 A 30 VAL middle . . 45 A 31 GLN middle . . 46 A 32 PHE middle -OXT . 47 A 33 ALY middle -H2,-OXT . 48 A 34 ILE middle -H2 . 49 A 35 LYS middle . . 50 A 36 ARG middle . . 51 A 37 HIS middle . . 52 A 38 THR middle . . 53 A 39 PRO middle . false 54 A 40 LEU middle . . 55 A 41 SER middle . . 56 A 42 LYS middle . . 57 A 43 LEU middle . . 58 A 44 MET middle . . 59 A 45 LYS middle . . 60 A 46 ALA middle . . 61 A 47 TYR middle . . 62 A 48 CYS middle . . 63 A 49 GLU middle . . 64 A 50 ARG middle . . 65 A 51 GLN middle . . 66 A 52 GLY middle . false 67 A 53 LEU middle . . 68 A 54 SER middle . . 69 A 55 MET middle . . 70 A 56 ARG middle . . 71 A 57 GLN middle . . 72 A 58 ILE middle . . 73 A 59 ARG middle . . 74 A 60 PHE middle . . 75 A 61 ARG middle . . 76 A 62 PHE middle . . 77 A 63 ASP middle . . 78 A 64 GLY middle . false 79 A 65 GLN middle . . 80 A 66 PRO middle . false 81 A 67 ILE middle . . 82 A 68 ASN middle . . 83 A 69 GLU middle . . 84 A 70 THR middle . . 85 A 71 ASP middle . . 86 A 72 THR middle . . 87 A 73 PRO middle . false 88 A 74 ALA middle . . 89 A 75 GLN middle . . 90 A 76 LEU middle . . 91 A 77 GLU middle . . 92 A 78 MET middle . . 93 A 79 GLU middle . . 94 A 80 ASP middle . . 95 A 81 GLU middle . . 96 A 82 ASP middle . . 97 A 83 THR middle . . 98 A 84 ILE middle . . 99 A 85 ASP middle . . 100 A 86 VAL middle . . 101 A 87 PHE middle . . 102 A 88 GLN middle . . 103 A 89 GLN middle . . 104 A 90 GLN middle . . 105 A 91 THR middle . . 106 A 92 GLY middle . false 107 A 93 GLY end . false stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 MET H H 1 8.473 0.020 A 1 MET HA H 1 4.426 0.020 A 1 MET HB2 H 1 1.979 0.020 A 1 MET HB3 H 1 2.081 0.020 A 1 MET HE% H 1 2.066 0.020 A 1 MET HGx H 1 2.487 0.020 A 1 MET HGy H 1 2.615 0.020 A 1 MET C C 13 176.415 0.400 A 1 MET CA C 13 55.242 0.400 A 1 MET CB C 13 32.992 0.400 A 1 MET CE C 13 17.003 0.400 A 1 MET CG C 13 32.224 0.400 A 1 MET N N 15 118.808 0.400 A 2 ALA H H 1 8.014 0.020 A 2 ALA HA H 1 4.216 0.020 A 2 ALA HB% H 1 1.375 0.020 A 2 ALA C C 13 177.451 0.400 A 2 ALA CA C 13 52.851 0.400 A 2 ALA CB C 13 19.297 0.400 A 2 ALA N N 15 124.331 0.400 A 3 ASP H H 1 8.247 0.020 A 3 ASP HA H 1 4.542 0.020 A 3 ASP HBx H 1 2.551 0.020 A 3 ASP HBy H 1 2.674 0.020 A 3 ASP C C 13 176.037 0.400 A 3 ASP CA C 13 54.302 0.400 A 3 ASP CB C 13 41.156 0.400 A 3 ASP N N 15 119.200 0.400 A 4 GLU H H 1 8.207 0.020 A 4 GLU HA H 1 4.231 0.020 A 4 GLU HBx H 1 1.874 0.020 A 4 GLU HBy H 1 1.954 0.020 A 4 GLU HGx H 1 2.182 0.020 A 4 GLU HGy H 1 2.182 0.020 A 4 GLU C C 13 176.194 0.400 A 4 GLU CA C 13 56.263 0.400 A 4 GLU CB C 13 30.430 0.400 A 4 GLU CG C 13 36.233 0.400 A 4 GLU N N 15 121.056 0.400 A 5 LYS H H 1 8.325 0.020 A 5 LYS HA H 1 4.393 0.020 A 5 LYS HBx H 1 1.696 0.020 A 5 LYS HBy H 1 1.696 0.020 A 5 LYS HDx H 1 1.706 0.020 A 5 LYS HDy H 1 1.706 0.020 A 5 LYS HEx H 1 3.001 0.020 A 5 LYS HEy H 1 3.001 0.020 A 5 LYS HGx H 1 1.438 0.020 A 5 LYS HGy H 1 1.438 0.020 A 5 LYS CA C 13 53.870 0.400 A 5 LYS CB C 13 32.221 0.400 A 5 LYS CD C 13 29.096 0.400 A 5 LYS CE C 13 42.202 0.400 A 5 LYS CG C 13 24.815 0.400 A 5 LYS N N 15 123.959 0.400 A 6 PRO HA H 1 4.386 0.020 A 6 PRO HB2 H 1 1.828 0.020 A 6 PRO HB3 H 1 2.255 0.020 A 6 PRO HDx H 1 3.589 0.020 A 6 PRO HDy H 1 3.793 0.020 A 6 PRO HGx H 1 1.983 0.020 A 6 PRO HGy H 1 1.983 0.020 A 6 PRO C C 13 176.951 0.400 A 6 PRO CA C 13 63.640 0.400 A 6 PRO CB C 13 32.022 0.400 A 6 PRO CD C 13 50.676 0.400 A 6 PRO CG C 13 27.380 0.400 A 7 LYS H H 1 8.536 0.020 A 7 LYS HA H 1 4.222 0.020 A 7 LYS HB2 H 1 1.720 0.020 A 7 LYS HB3 H 1 1.795 0.020 A 7 LYS HDx H 1 1.645 0.020 A 7 LYS HDy H 1 1.645 0.020 A 7 LYS HEx H 1 2.947 0.020 A 7 LYS HEy H 1 2.947 0.020 A 7 LYS HGx H 1 1.454 0.020 A 7 LYS HGy H 1 1.454 0.020 A 7 LYS C C 13 176.743 0.400 A 7 LYS CA C 13 56.395 0.400 A 7 LYS CB C 13 32.923 0.400 A 7 LYS CD C 13 28.995 0.400 A 7 LYS CE C 13 42.155 0.400 A 7 LYS CG C 13 24.778 0.400 A 7 LYS N N 15 122.486 0.400 A 8 GLU H H 1 8.498 0.020 A 8 GLU HA H 1 4.228 0.020 A 8 GLU HBx H 1 1.906 0.020 A 8 GLU HBy H 1 1.906 0.020 A 8 GLU HGx H 1 2.205 0.020 A 8 GLU HGy H 1 2.205 0.020 A 8 GLU C C 13 176.850 0.400 A 8 GLU CA C 13 56.473 0.400 A 8 GLU CB C 13 30.307 0.400 A 8 GLU CG C 13 36.233 0.400 A 8 GLU N N 15 122.135 0.400 A 9 GLY H H 1 8.482 0.020 A 9 GLY HAx H 1 3.938 0.020 A 9 GLY HAy H 1 3.938 0.020 A 9 GLY C C 13 173.897 0.400 A 9 GLY CA C 13 45.253 0.400 A 9 GLY N N 15 110.379 0.400 A 10 VAL H H 1 7.992 0.020 A 10 VAL HA H 1 4.075 0.020 A 10 VAL HB H 1 2.022 0.020 A 10 VAL HGx% H 1 0.893 0.020 A 10 VAL HGy% H 1 0.893 0.020 A 10 VAL C C 13 176.228 0.400 A 10 VAL CA C 13 62.306 0.400 A 10 VAL CB C 13 32.727 0.400 A 10 VAL CG1 C 13 21.162 0.400 A 10 VAL CG2 C 13 20.624 0.400 A 10 VAL N N 15 119.653 0.400 A 11 LYS H H 1 8.546 0.020 A 11 LYS HA H 1 4.396 0.020 A 11 LYS HBy H 1 1.811 0.020 A 11 LYS HBx H 1 1.730 0.020 A 11 LYS HDx H 1 1.645 0.020 A 11 LYS HDy H 1 1.645 0.020 A 11 LYS HEx H 1 2.936 0.020 A 11 LYS HEy H 1 2.936 0.020 A 11 LYS HGx H 1 1.381 0.020 A 11 LYS HGy H 1 1.381 0.020 A 11 LYS C C 13 176.694 0.400 A 11 LYS CA C 13 56.177 0.400 A 11 LYS CB C 13 32.958 0.400 A 11 LYS CD C 13 28.912 0.400 A 11 LYS CE C 13 42.155 0.400 A 11 LYS CG C 13 24.766 0.400 A 11 LYS N N 15 126.021 0.400 A 12 THR H H 1 8.277 0.020 A 12 THR HA H 1 4.273 0.020 A 12 THR HB H 1 4.172 0.020 A 12 THR HG2% H 1 1.151 0.020 A 12 THR C C 13 174.495 0.400 A 12 THR CA C 13 61.926 0.400 A 12 THR CB C 13 69.748 0.400 A 12 THR CG2 C 13 21.642 0.400 A 12 THR N N 15 116.497 0.400 A 13 GLU H H 1 8.529 0.020 A 13 GLU HA H 1 4.260 0.020 A 13 GLU HBx H 1 1.893 0.020 A 13 GLU HBy H 1 1.893 0.020 A 13 GLU HGx H 1 2.231 0.020 A 13 GLU HGy H 1 2.231 0.020 A 13 GLU C C 13 175.984 0.400 A 13 GLU CA C 13 56.475 0.400 A 13 GLU CB C 13 30.476 0.400 A 13 GLU CG C 13 36.167 0.400 A 13 GLU N N 15 123.237 0.400 A 14 ASN H H 1 8.543 0.020 A 14 ASN HA H 1 4.904 0.020 A 14 ASN HBx H 1 2.637 0.020 A 14 ASN HBy H 1 2.877 0.020 A 14 ASN HD21 H 1 7.014 0.020 A 14 ASN HD22 H 1 7.556 0.020 A 14 ASN C C 13 174.762 0.400 A 14 ASN CA C 13 52.850 0.400 A 14 ASN CB C 13 38.801 0.400 A 14 ASN N N 15 119.988 0.400 A 14 ASN ND2 N 15 112.029 0.400 A 15 ASN H H 1 8.643 0.020 A 15 ASN HA H 1 4.648 0.020 A 15 ASN HBx H 1 2.797 0.020 A 15 ASN HBy H 1 2.797 0.020 A 15 ASN HD2y H 1 7.662 0.020 A 15 ASN HD2x H 1 6.935 0.020 A 15 ASN C C 13 174.866 0.400 A 15 ASN CA C 13 53.461 0.400 A 15 ASN CB C 13 39.025 0.400 A 15 ASN N N 15 120.387 0.400 A 15 ASN ND2 N 15 113.322 0.400 A 16 ASP H H 1 8.401 0.020 A 16 ASP HA H 1 4.560 0.020 A 16 ASP HBx H 1 2.640 0.020 A 16 ASP HBy H 1 2.640 0.020 A 16 ASP C C 13 175.853 0.400 A 16 ASP CA C 13 54.473 0.400 A 16 ASP CB C 13 40.958 0.400 A 16 ASP N N 15 119.987 0.400 A 17 HIS H H 1 8.179 0.020 A 17 HIS HA H 1 4.895 0.020 A 17 HIS HB2 H 1 2.873 0.020 A 17 HIS HB3 H 1 2.761 0.020 A 17 HIS HD2 H 1 6.568 0.020 A 17 HIS HE1 H 1 7.842 0.020 A 17 HIS C C 13 174.564 0.400 A 17 HIS CA C 13 56.975 0.400 A 17 HIS CB C 13 31.860 0.400 A 17 HIS CD2 C 13 121.973 0.400 A 17 HIS CE1 C 13 138.362 0.400 A 17 HIS N N 15 117.044 0.400 A 18 ILE H H 1 9.126 0.020 A 18 ILE HA H 1 4.605 0.020 A 18 ILE HB H 1 1.575 0.020 A 18 ILE HD1% H 1 0.454 0.020 A 18 ILE HG12 H 1 0.855 0.020 A 18 ILE HG13 H 1 1.304 0.020 A 18 ILE HG2% H 1 0.706 0.020 A 18 ILE C C 13 172.637 0.400 A 18 ILE CA C 13 59.722 0.400 A 18 ILE CB C 13 42.318 0.400 A 18 ILE CD1 C 13 14.499 0.400 A 18 ILE CG1 C 13 26.395 0.400 A 18 ILE CG2 C 13 16.826 0.400 A 18 ILE N N 15 117.438 0.400 A 19 ASN H H 1 9.003 0.020 A 19 ASN HA H 1 5.473 0.020 A 19 ASN HBy H 1 2.680 0.020 A 19 ASN HBx H 1 2.496 0.020 A 19 ASN HD21 H 1 6.768 0.020 A 19 ASN HD22 H 1 8.081 0.020 A 19 ASN C C 13 174.654 0.400 A 19 ASN CA C 13 52.246 0.400 A 19 ASN CB C 13 40.273 0.400 A 19 ASN N N 15 122.506 0.400 A 19 ASN ND2 N 15 114.950 0.400 A 20 LEU H H 1 9.052 0.020 A 20 LEU HA H 1 5.074 0.020 A 20 LEU HB2 H 1 1.393 0.020 A 20 LEU HB3 H 1 1.182 0.020 A 20 LEU HDx% H 1 0.618 0.020 A 20 LEU HDy% H 1 0.821 0.020 A 20 LEU HG H 1 1.388 0.020 A 20 LEU C C 13 175.659 0.400 A 20 LEU CA C 13 52.931 0.400 A 20 LEU CB C 13 46.812 0.400 A 20 LEU CD1 C 13 26.652 0.400 A 20 LEU CD2 C 13 24.370 0.400 A 20 LEU CG C 13 27.075 0.400 A 20 LEU N N 15 123.253 0.400 A 21 LYS H H 1 8.630 0.020 A 21 LYS HA H 1 4.895 0.020 A 21 LYS HB2 H 1 1.897 0.020 A 21 LYS HB3 H 1 1.511 0.020 A 21 LYS HDx H 1 1.552 0.020 A 21 LYS HDy H 1 1.552 0.020 A 21 LYS HE2 H 1 2.826 0.020 A 21 LYS HE3 H 1 2.870 0.020 A 21 LYS HG2 H 1 1.211 0.020 A 21 LYS HG3 H 1 1.241 0.020 A 21 LYS C C 13 175.198 0.400 A 21 LYS CA C 13 55.053 0.400 A 21 LYS CB C 13 34.531 0.400 A 21 LYS CD C 13 29.229 0.400 A 21 LYS CE C 13 42.031 0.400 A 21 LYS CG C 13 25.823 0.400 A 21 LYS N N 15 120.514 0.400 A 22 VAL H H 1 9.187 0.020 A 22 VAL HA H 1 4.901 0.020 A 22 VAL HB H 1 1.998 0.020 A 22 VAL HGx% H 1 0.040 0.020 A 22 VAL HGy% H 1 0.730 0.020 A 22 VAL C C 13 175.453 0.400 A 22 VAL CA C 13 61.254 0.400 A 22 VAL CB C 13 32.552 0.400 A 22 VAL CG1 C 13 22.480 0.400 A 22 VAL CG2 C 13 21.740 0.400 A 22 VAL N N 15 121.527 0.400 A 23 ALA H H 1 9.297 0.020 A 23 ALA HA H 1 5.258 0.020 A 23 ALA HB% H 1 1.385 0.020 A 23 ALA C C 13 176.934 0.400 A 23 ALA CA C 13 50.791 0.400 A 23 ALA CB C 13 21.095 0.400 A 23 ALA N N 15 133.025 0.400 A 24 GLY H H 1 8.621 0.020 A 24 GLY HAy H 1 4.561 0.020 A 24 GLY HAx H 1 3.761 0.020 A 24 GLY C C 13 175.915 0.400 A 24 GLY CA C 13 43.819 0.400 A 24 GLY N N 15 109.931 0.400 A 25 GLN H H 1 9.026 0.020 A 25 GLN HA H 1 4.149 0.020 A 25 GLN HBy H 1 2.201 0.020 A 25 GLN HBx H 1 2.034 0.020 A 25 GLN HE2y H 1 7.626 0.020 A 25 GLN HE2x H 1 7.022 0.020 A 25 GLN HGx H 1 2.429 0.020 A 25 GLN HGy H 1 2.429 0.020 A 25 GLN C C 13 175.932 0.400 A 25 GLN CA C 13 57.766 0.400 A 25 GLN CB C 13 28.745 0.400 A 25 GLN CG C 13 34.777 0.400 A 25 GLN N N 15 120.797 0.400 A 25 GLN NE2 N 15 114.266 0.400 A 26 ASP H H 1 8.289 0.020 A 26 ASP HA H 1 4.499 0.020 A 26 ASP HBy H 1 3.037 0.020 A 26 ASP HBx H 1 2.648 0.020 A 26 ASP C C 13 176.858 0.400 A 26 ASP CA C 13 53.123 0.400 A 26 ASP CB C 13 40.072 0.400 A 26 ASP N N 15 116.964 0.400 A 27 GLY H H 1 7.899 0.020 A 27 GLY HA2 H 1 4.280 0.020 A 27 GLY HA3 H 1 3.720 0.020 A 27 GLY C C 13 174.270 0.400 A 27 GLY CA C 13 45.261 0.400 A 27 GLY N N 15 108.391 0.400 A 28 SER H H 1 8.019 0.020 A 28 SER HA H 1 4.343 0.020 A 28 SER HBx H 1 3.847 0.020 A 28 SER HBy H 1 3.907 0.020 A 28 SER C C 13 174.488 0.400 A 28 SER CA C 13 58.546 0.400 A 28 SER CB C 13 63.794 0.400 A 28 SER N N 15 116.952 0.400 A 29 VAL H H 1 8.598 0.020 A 29 VAL HA H 1 4.957 0.020 A 29 VAL HB H 1 1.924 0.020 A 29 VAL HGx% H 1 0.823 0.020 A 29 VAL HGy% H 1 0.896 0.020 A 29 VAL C C 13 175.460 0.400 A 29 VAL CA C 13 61.973 0.400 A 29 VAL CB C 13 35.084 0.400 A 29 VAL CG1 C 13 21.868 0.400 A 29 VAL CG2 C 13 21.162 0.400 A 29 VAL N N 15 122.591 0.400 A 30 VAL H H 1 8.616 0.020 A 30 VAL HA H 1 4.341 0.020 A 30 VAL HB H 1 2.063 0.020 A 30 VAL HGx% H 1 0.767 0.020 A 30 VAL HGy% H 1 1.048 0.020 A 30 VAL C C 13 174.278 0.400 A 30 VAL CA C 13 60.953 0.400 A 30 VAL CB C 13 34.786 0.400 A 30 VAL CG1 C 13 22.673 0.400 A 30 VAL CG2 C 13 21.496 0.400 A 30 VAL N N 15 127.288 0.400 A 31 GLN H H 1 8.504 0.020 A 31 GLN HA H 1 5.187 0.020 A 31 GLN HB2 H 1 2.044 0.020 A 31 GLN HB3 H 1 1.818 0.020 A 31 GLN HE21 H 1 6.925 0.020 A 31 GLN HE22 H 1 7.422 0.020 A 31 GLN HG2 H 1 2.179 0.020 A 31 GLN HG3 H 1 2.119 0.020 A 31 GLN C C 13 174.809 0.400 A 31 GLN CA C 13 55.144 0.400 A 31 GLN CB C 13 31.136 0.400 A 31 GLN CG C 13 34.659 0.400 A 31 GLN N N 15 125.377 0.400 A 31 GLN NE2 N 15 111.887 0.400 A 32 PHE H H 1 9.101 0.020 A 32 PHE HA H 1 4.689 0.020 A 32 PHE HB2 H 1 2.952 0.020 A 32 PHE HB3 H 1 2.509 0.020 A 32 PHE HD1 H 1 7.066 0.020 A 32 PHE HD2 H 1 7.066 0.020 A 32 PHE HE1 H 1 7.192 0.020 A 32 PHE HE2 H 1 7.192 0.020 A 32 PHE HZ H 1 7.221 0.020 A 32 PHE CA C 13 57.460 0.400 A 32 PHE CB C 13 44.805 0.400 A 32 PHE CD1 C 13 133.333 0.400 A 32 PHE CD2 C 13 132.114 0.400 A 32 PHE CE1 C 13 132.202 0.400 A 32 PHE CE2 C 13 132.202 0.400 A 32 PHE CZ C 13 129.596 0.400 A 32 PHE N N 15 121.123 0.400 A 33 ALY H H 1 8.454 0.020 A 33 ALY HBx H 1 1.597 0.020 A 33 ALY HBy H 1 1.597 0.020 A 33 ALY HDx H 1 1.220 0.020 A 33 ALY HDy H 1 1.220 0.020 A 33 ALY HEx H 1 2.804 0.020 A 33 ALY HEy H 1 2.804 0.020 A 33 ALY HGx H 1 1.071 0.020 A 33 ALY HGy H 1 1.071 0.020 A 33 ALY HH3% H 1 1.786 0.020 A 33 ALY HZ H 1 7.710 0.020 A 34 ILE H H 1 9.007 0.020 A 34 ILE HA H 1 4.845 0.020 A 34 ILE HB H 1 1.802 0.020 A 34 ILE HD1% H 1 0.675 0.020 A 34 ILE HG12 H 1 1.450 0.020 A 34 ILE HG13 H 1 1.305 0.020 A 34 ILE HG2% H 1 0.759 0.020 A 34 ILE C C 13 173.602 0.400 A 34 ILE CA C 13 59.350 0.400 A 34 ILE CB C 13 42.444 0.400 A 34 ILE CD1 C 13 14.436 0.400 A 34 ILE CG1 C 13 26.622 0.400 A 34 ILE CG2 C 13 16.559 0.400 A 34 ILE N N 15 123.000 0.400 A 35 LYS H H 1 8.278 0.020 A 35 LYS HA H 1 4.455 0.020 A 35 LYS HB2 H 1 1.725 0.020 A 35 LYS HB3 H 1 1.789 0.020 A 35 LYS HDx H 1 1.496 0.020 A 35 LYS HDy H 1 1.496 0.020 A 35 LYS HEx H 1 2.825 0.020 A 35 LYS HEy H 1 2.858 0.020 A 35 LYS HGy H 1 1.179 0.020 A 35 LYS HGx H 1 0.697 0.020 A 35 LYS C C 13 178.547 0.400 A 35 LYS CA C 13 56.901 0.400 A 35 LYS CB C 13 32.287 0.400 A 35 LYS CD C 13 29.324 0.400 A 35 LYS CE C 13 42.031 0.400 A 35 LYS CG C 13 25.989 0.400 A 35 LYS N N 15 123.649 0.400 A 36 ARG H H 1 8.139 0.020 A 36 ARG HA H 1 3.585 0.020 A 36 ARG HB2 H 1 1.257 0.020 A 36 ARG HB3 H 1 1.460 0.020 A 36 ARG HD2 H 1 3.143 0.020 A 36 ARG HD3 H 1 3.240 0.020 A 36 ARG HE H 1 7.297 0.020 A 36 ARG HG2 H 1 1.520 0.020 A 36 ARG HG3 H 1 1.452 0.020 A 36 ARG C C 13 175.738 0.400 A 36 ARG CA C 13 59.753 0.400 A 36 ARG CB C 13 29.821 0.400 A 36 ARG CD C 13 42.977 0.400 A 36 ARG CG C 13 30.082 0.400 A 36 ARG N N 15 118.145 0.400 A 36 ARG NE N 15 83.953 0.400 A 37 HIS H H 1 7.828 0.020 A 37 HIS HA H 1 4.770 0.020 A 37 HIS HB2 H 1 3.369 0.020 A 37 HIS HB3 H 1 2.890 0.020 A 37 HIS HD2 H 1 7.085 0.020 A 37 HIS HE1 H 1 7.798 0.020 A 37 HIS C C 13 174.645 0.400 A 37 HIS CA C 13 55.295 0.400 A 37 HIS CB C 13 29.484 0.400 A 37 HIS CD2 C 13 120.000 0.400 A 37 HIS CE1 C 13 137.956 0.400 A 37 HIS N N 15 111.533 0.400 A 38 THR H H 1 7.404 0.020 A 38 THR HA H 1 4.535 0.020 A 38 THR HB H 1 4.071 0.020 A 38 THR HG2% H 1 1.404 0.020 A 38 THR CA C 13 60.631 0.400 A 38 THR CB C 13 70.640 0.400 A 38 THR CG2 C 13 21.631 0.400 A 38 THR N N 15 121.300 0.400 A 39 PRO HA H 1 4.236 0.020 A 39 PRO HB2 H 1 2.278 0.020 A 39 PRO HB3 H 1 2.037 0.020 A 39 PRO HD2 H 1 3.964 0.020 A 39 PRO HD3 H 1 3.671 0.020 A 39 PRO HG2 H 1 1.912 0.020 A 39 PRO HG3 H 1 2.096 0.020 A 39 PRO C C 13 178.368 0.400 A 39 PRO CA C 13 62.728 0.400 A 39 PRO CB C 13 32.187 0.400 A 39 PRO CD C 13 51.120 0.400 A 39 PRO CG C 13 28.011 0.400 A 40 LEU H H 1 9.049 0.020 A 40 LEU HA H 1 3.763 0.020 A 40 LEU HB2 H 1 1.673 0.020 A 40 LEU HB3 H 1 1.026 0.020 A 40 LEU HDx% H 1 0.542 0.020 A 40 LEU HDy% H 1 0.586 0.020 A 40 LEU HG H 1 1.486 0.020 A 40 LEU C C 13 177.273 0.400 A 40 LEU CA C 13 57.410 0.400 A 40 LEU CB C 13 41.663 0.400 A 40 LEU CD1 C 13 26.572 0.400 A 40 LEU CD2 C 13 24.673 0.400 A 40 LEU CG C 13 29.171 0.400 A 40 LEU N N 15 122.684 0.400 A 41 SER H H 1 8.352 0.020 A 41 SER HA H 1 3.918 0.020 A 41 SER C C 13 175.944 0.400 A 41 SER CA C 13 62.098 0.400 A 41 SER N N 15 115.534 0.400 A 42 LYS H H 1 7.708 0.020 A 42 LYS HA H 1 3.944 0.020 A 42 LYS HBx H 1 1.724 0.020 A 42 LYS HBy H 1 1.863 0.020 A 42 LYS HDx H 1 1.669 0.020 A 42 LYS HDy H 1 1.669 0.020 A 42 LYS HEx H 1 2.975 0.020 A 42 LYS HEy H 1 2.975 0.020 A 42 LYS HG2 H 1 1.397 0.020 A 42 LYS HG3 H 1 1.518 0.020 A 42 LYS C C 13 179.104 0.400 A 42 LYS CA C 13 59.789 0.400 A 42 LYS CB C 13 32.204 0.400 A 42 LYS CD C 13 29.052 0.400 A 42 LYS CE C 13 42.109 0.400 A 42 LYS CG C 13 25.336 0.400 A 42 LYS N N 15 119.415 0.400 A 43 LEU H H 1 6.992 0.020 A 43 LEU HA H 1 3.572 0.020 A 43 LEU HB2 H 1 1.356 0.020 A 43 LEU HB3 H 1 1.415 0.020 A 43 LEU HDx% H 1 0.144 0.020 A 43 LEU HDy% H 1 0.357 0.020 A 43 LEU HG H 1 0.642 0.020 A 43 LEU C C 13 177.280 0.400 A 43 LEU CA C 13 58.020 0.400 A 43 LEU CB C 13 42.117 0.400 A 43 LEU CD1 C 13 24.036 0.400 A 43 LEU CD2 C 13 27.579 0.400 A 43 LEU CG C 13 26.396 0.400 A 43 LEU N N 15 122.138 0.400 A 44 MET H H 1 8.264 0.020 A 44 MET HA H 1 3.252 0.020 A 44 MET HBx H 1 1.660 0.020 A 44 MET HBy H 1 1.660 0.020 A 44 MET HE% H 1 1.453 0.020 A 44 MET HGx H 1 0.219 0.020 A 44 MET HGy H 1 1.839 0.020 A 44 MET C C 13 177.469 0.400 A 44 MET CA C 13 59.631 0.400 A 44 MET CB C 13 32.771 0.400 A 44 MET CE C 13 17.585 0.400 A 44 MET CG C 13 31.469 0.400 A 44 MET N N 15 119.120 0.400 A 45 LYS H H 1 8.258 0.020 A 45 LYS HA H 1 3.972 0.020 A 45 LYS HBx H 1 1.819 0.020 A 45 LYS HBy H 1 1.819 0.020 A 45 LYS HDx H 1 1.635 0.020 A 45 LYS HDy H 1 1.635 0.020 A 45 LYS HEx H 1 2.939 0.020 A 45 LYS HEy H 1 2.939 0.020 A 45 LYS HGx H 1 1.382 0.020 A 45 LYS HGy H 1 1.541 0.020 A 45 LYS C C 13 178.790 0.400 A 45 LYS CA C 13 59.871 0.400 A 45 LYS CB C 13 32.637 0.400 A 45 LYS CD C 13 29.341 0.400 A 45 LYS CE C 13 42.155 0.400 A 45 LYS CG C 13 25.716 0.400 A 45 LYS N N 15 118.660 0.400 A 46 ALA H H 1 7.548 0.020 A 46 ALA HA H 1 4.233 0.020 A 46 ALA HB% H 1 1.522 0.020 A 46 ALA C C 13 180.792 0.400 A 46 ALA CA C 13 55.038 0.400 A 46 ALA CB C 13 18.464 0.400 A 46 ALA N N 15 121.845 0.400 A 47 TYR H H 1 8.849 0.020 A 47 TYR HA H 1 4.076 0.020 A 47 TYR HB2 H 1 3.275 0.020 A 47 TYR HB3 H 1 3.021 0.020 A 47 TYR HD1 H 1 7.066 0.020 A 47 TYR HD2 H 1 7.066 0.020 A 47 TYR HE1 H 1 6.642 0.020 A 47 TYR HE2 H 1 6.642 0.020 A 47 TYR C C 13 176.899 0.400 A 47 TYR CA C 13 63.029 0.400 A 47 TYR CB C 13 38.267 0.400 A 47 TYR CD1 C 13 131.890 0.400 A 47 TYR CE1 C 13 118.741 0.400 A 47 TYR CE2 C 13 118.741 0.400 A 47 TYR N N 15 120.283 0.400 A 48 CYS H H 1 8.372 0.020 A 48 CYS HA H 1 3.755 0.020 A 48 CYS HBx H 1 3.088 0.020 A 48 CYS HBy H 1 3.169 0.020 A 48 CYS C C 13 177.235 0.400 A 48 CYS CA C 13 65.799 0.400 A 48 CYS CB C 13 26.117 0.400 A 48 CYS N N 15 117.156 0.400 A 49 GLU H H 1 8.301 0.020 A 49 GLU HA H 1 4.057 0.020 A 49 GLU HB2 H 1 2.134 0.020 A 49 GLU HB3 H 1 2.051 0.020 A 49 GLU HG2 H 1 2.238 0.020 A 49 GLU HG3 H 1 2.432 0.020 A 49 GLU C C 13 179.265 0.400 A 49 GLU CA C 13 59.169 0.400 A 49 GLU CB C 13 29.547 0.400 A 49 GLU CG C 13 36.433 0.400 A 49 GLU N N 15 118.790 0.400 A 50 ARG H H 1 8.027 0.020 A 50 ARG HA H 1 4.058 0.020 A 50 ARG HB2 H 1 1.909 0.020 A 50 ARG HB3 H 1 1.989 0.020 A 50 ARG HD2 H 1 3.119 0.020 A 50 ARG HD3 H 1 3.170 0.020 A 50 ARG HGx H 1 1.771 0.020 A 50 ARG HGy H 1 1.771 0.020 A 50 ARG C C 13 178.097 0.400 A 50 ARG CA C 13 58.720 0.400 A 50 ARG CB C 13 30.096 0.400 A 50 ARG CD C 13 43.553 0.400 A 50 ARG CG C 13 26.915 0.400 A 50 ARG N N 15 119.650 0.400 A 51 GLN H H 1 7.761 0.020 A 51 GLN HA H 1 4.251 0.020 A 51 GLN HB2 H 1 1.355 0.020 A 51 GLN HB3 H 1 1.986 0.020 A 51 GLN HE21 H 1 6.725 0.020 A 51 GLN HE22 H 1 6.779 0.020 A 51 GLN HGx H 1 1.632 0.020 A 51 GLN HGy H 1 1.632 0.020 A 51 GLN C C 13 176.189 0.400 A 51 GLN CA C 13 54.707 0.400 A 51 GLN CB C 13 30.476 0.400 A 51 GLN CG C 13 33.597 0.400 A 51 GLN N N 15 112.565 0.400 A 51 GLN NE2 N 15 109.400 0.400 A 52 GLY H H 1 7.721 0.020 A 52 GLY HAx H 1 3.901 0.020 A 52 GLY HAy H 1 3.901 0.020 A 52 GLY C C 13 174.548 0.400 A 52 GLY CA C 13 46.776 0.400 A 52 GLY N N 15 109.932 0.400 A 53 LEU H H 1 8.074 0.020 A 53 LEU HA H 1 4.665 0.020 A 53 LEU HB2 H 1 1.377 0.020 A 53 LEU HB3 H 1 1.462 0.020 A 53 LEU HDx% H 1 0.824 0.020 A 53 LEU HDy% H 1 0.786 0.020 A 53 LEU HG H 1 1.348 0.020 A 53 LEU C C 13 175.849 0.400 A 53 LEU CA C 13 52.898 0.400 A 53 LEU CB C 13 45.954 0.400 A 53 LEU CD1 C 13 26.314 0.400 A 53 LEU CD2 C 13 22.570 0.400 A 53 LEU CG C 13 26.363 0.400 A 53 LEU N N 15 119.103 0.400 A 54 SER H H 1 8.531 0.020 A 54 SER HA H 1 4.729 0.020 A 54 SER HBx H 1 3.785 0.020 A 54 SER HBy H 1 3.944 0.020 A 54 SER C C 13 175.812 0.400 A 54 SER CA C 13 56.303 0.400 A 54 SER CB C 13 64.406 0.400 A 54 SER N N 15 114.717 0.400 A 55 MET H H 1 9.001 0.020 A 55 MET HA H 1 4.308 0.020 A 55 MET HB2 H 1 2.132 0.020 A 55 MET HB3 H 1 2.740 0.020 A 55 MET HE% H 1 2.066 0.020 A 55 MET HGx H 1 2.716 0.020 A 55 MET HGy H 1 2.716 0.020 A 55 MET C C 13 177.502 0.400 A 55 MET CA C 13 57.852 0.400 A 55 MET CB C 13 32.846 0.400 A 55 MET CE C 13 17.003 0.400 A 55 MET CG C 13 32.919 0.400 A 55 MET N N 15 126.367 0.400 A 56 ARG H H 1 8.040 0.020 A 56 ARG HA H 1 4.269 0.020 A 56 ARG HB2 H 1 1.785 0.020 A 56 ARG HB3 H 1 1.887 0.020 A 56 ARG HDx H 1 3.199 0.020 A 56 ARG HDy H 1 3.199 0.020 A 56 ARG HE H 1 7.232 0.020 A 56 ARG HGx H 1 1.655 0.020 A 56 ARG HGy H 1 1.655 0.020 A 56 ARG C C 13 177.456 0.400 A 56 ARG CA C 13 57.480 0.400 A 56 ARG CB C 13 30.101 0.400 A 56 ARG CD C 13 43.059 0.400 A 56 ARG CG C 13 27.277 0.400 A 56 ARG N N 15 114.302 0.400 A 56 ARG NE N 15 84.993 0.400 A 57 GLN H H 1 7.828 0.020 A 57 GLN HA H 1 4.446 0.020 A 57 GLN HB2 H 1 2.346 0.020 A 57 GLN HB3 H 1 2.188 0.020 A 57 GLN HE21 H 1 7.593 0.020 A 57 GLN HE22 H 1 6.937 0.020 A 57 GLN HG2 H 1 2.396 0.020 A 57 GLN HG3 H 1 2.317 0.020 A 57 GLN C C 13 175.197 0.400 A 57 GLN CA C 13 55.907 0.400 A 57 GLN CB C 13 31.068 0.400 A 57 GLN CG C 13 34.753 0.400 A 57 GLN N N 15 115.700 0.400 A 57 GLN NE2 N 15 112.018 0.400 A 58 ILE H H 1 7.330 0.020 A 58 ILE HA H 1 4.971 0.020 A 58 ILE HB H 1 1.645 0.020 A 58 ILE HD1% H 1 0.695 0.020 A 58 ILE HG12 H 1 1.191 0.020 A 58 ILE HG13 H 1 1.150 0.020 A 58 ILE HG2% H 1 0.625 0.020 A 58 ILE C C 13 174.254 0.400 A 58 ILE CA C 13 58.971 0.400 A 58 ILE CB C 13 41.224 0.400 A 58 ILE CD1 C 13 14.627 0.400 A 58 ILE CG1 C 13 25.523 0.400 A 58 ILE CG2 C 13 19.143 0.400 A 58 ILE N N 15 115.260 0.400 A 59 ARG H H 1 8.483 0.020 A 59 ARG HA H 1 4.615 0.020 A 59 ARG HB2 H 1 1.721 0.020 A 59 ARG HB3 H 1 1.335 0.020 A 59 ARG HD2 H 1 3.142 0.020 A 59 ARG HD3 H 1 3.256 0.020 A 59 ARG HE H 1 7.381 0.020 A 59 ARG HG2 H 1 1.445 0.020 A 59 ARG HG3 H 1 1.497 0.020 A 59 ARG C C 13 173.705 0.400 A 59 ARG CA C 13 53.767 0.400 A 59 ARG CB C 13 33.286 0.400 A 59 ARG CD C 13 43.224 0.400 A 59 ARG CG C 13 26.797 0.400 A 59 ARG N N 15 121.192 0.400 A 59 ARG NE N 15 84.002 0.400 A 60 PHE H H 1 9.077 0.020 A 60 PHE HA H 1 5.323 0.020 A 60 PHE HB2 H 1 2.854 0.020 A 60 PHE HB3 H 1 2.592 0.020 A 60 PHE HD1 H 1 7.064 0.020 A 60 PHE HD2 H 1 7.064 0.020 A 60 PHE HE1 H 1 6.845 0.020 A 60 PHE HE2 H 1 6.845 0.020 A 60 PHE HZ H 1 7.225 0.020 A 60 PHE C C 13 176.042 0.400 A 60 PHE CA C 13 56.254 0.400 A 60 PHE CB C 13 41.686 0.400 A 60 PHE CD1 C 13 133.333 0.400 A 60 PHE CD2 C 13 132.271 0.400 A 60 PHE CE1 C 13 130.719 0.400 A 60 PHE CE2 C 13 130.732 0.400 A 60 PHE CZ C 13 130.869 0.400 A 60 PHE N N 15 120.136 0.400 A 61 ARG H H 1 9.558 0.020 A 61 ARG HA H 1 5.215 0.020 A 61 ARG HB2 H 1 1.538 0.020 A 61 ARG HB3 H 1 1.722 0.020 A 61 ARG HD2 H 1 2.674 0.020 A 61 ARG HD3 H 1 2.715 0.020 A 61 ARG HE H 1 7.166 0.020 A 61 ARG HG2 H 1 1.277 0.020 A 61 ARG HG3 H 1 1.406 0.020 A 61 ARG C C 13 173.746 0.400 A 61 ARG CA C 13 54.878 0.400 A 61 ARG CB C 13 35.965 0.400 A 61 ARG CD C 13 43.636 0.400 A 61 ARG CG C 13 27.760 0.400 A 61 ARG N N 15 121.901 0.400 A 61 ARG NE N 15 83.642 0.400 A 62 PHE H H 1 8.996 0.020 A 62 PHE HA H 1 5.335 0.020 A 62 PHE HB2 H 1 2.936 0.020 A 62 PHE HB3 H 1 2.832 0.020 A 62 PHE HD1 H 1 7.347 0.020 A 62 PHE HD2 H 1 7.347 0.020 A 62 PHE HE1 H 1 7.299 0.020 A 62 PHE HE2 H 1 7.299 0.020 A 62 PHE HZ H 1 7.340 0.020 A 62 PHE C C 13 175.249 0.400 A 62 PHE CA C 13 55.882 0.400 A 62 PHE CB C 13 41.890 0.400 A 62 PHE CD1 C 13 131.805 0.400 A 62 PHE CD2 C 13 131.795 0.400 A 62 PHE CE1 C 13 131.515 0.400 A 62 PHE CE2 C 13 131.541 0.400 A 62 PHE CZ C 13 131.078 0.400 A 62 PHE N N 15 120.280 0.400 A 63 ASP H H 1 9.499 0.020 A 63 ASP HA H 1 4.010 0.020 A 63 ASP HB2 H 1 2.613 0.020 A 63 ASP HB3 H 1 1.416 0.020 A 63 ASP C C 13 175.892 0.400 A 63 ASP CA C 13 54.508 0.400 A 63 ASP CB C 13 39.221 0.400 A 63 ASP N N 15 132.174 0.400 A 64 GLY H H 1 8.724 0.020 A 64 GLY HA2 H 1 3.465 0.020 A 64 GLY HA3 H 1 4.134 0.020 A 64 GLY C C 13 173.994 0.400 A 64 GLY CA C 13 45.262 0.400 A 64 GLY N N 15 102.553 0.400 A 65 GLN H H 1 7.880 0.020 A 65 GLN HA H 1 4.904 0.020 A 65 GLN HB2 H 1 2.055 0.020 A 65 GLN HB3 H 1 2.194 0.020 A 65 GLN HE21 H 1 7.558 0.020 A 65 GLN HE22 H 1 6.923 0.020 A 65 GLN HGx H 1 2.334 0.020 A 65 GLN HGy H 1 2.405 0.020 A 65 GLN CA C 13 52.237 0.400 A 65 GLN CB C 13 30.312 0.400 A 65 GLN CG C 13 32.987 0.400 A 65 GLN N N 15 120.790 0.400 A 65 GLN NE2 N 15 112.583 0.400 A 66 PRO HA H 1 4.698 0.020 A 66 PRO HB2 H 1 2.342 0.020 A 66 PRO HB3 H 1 1.949 0.020 A 66 PRO HD2 H 1 3.835 0.020 A 66 PRO HD3 H 1 3.743 0.020 A 66 PRO HGx H 1 1.916 0.020 A 66 PRO HGy H 1 2.178 0.020 A 66 PRO C C 13 176.336 0.400 A 66 PRO CA C 13 63.294 0.400 A 66 PRO CB C 13 32.385 0.400 A 66 PRO CD C 13 50.873 0.400 A 66 PRO CG C 13 27.724 0.400 A 67 ILE H H 1 7.920 0.020 A 67 ILE HA H 1 4.407 0.020 A 67 ILE HB H 1 1.662 0.020 A 67 ILE HD1% H 1 0.629 0.020 A 67 ILE HG12 H 1 0.841 0.020 A 67 ILE HG13 H 1 1.367 0.020 A 67 ILE HG2% H 1 0.855 0.020 A 67 ILE C C 13 175.006 0.400 A 67 ILE CA C 13 60.315 0.400 A 67 ILE CB C 13 40.311 0.400 A 67 ILE CD1 C 13 15.063 0.400 A 67 ILE CG1 C 13 26.817 0.400 A 67 ILE CG2 C 13 19.510 0.400 A 67 ILE N N 15 119.581 0.400 A 68 ASN H H 1 9.212 0.020 A 68 ASN HA H 1 4.982 0.020 A 68 ASN HB2 H 1 2.609 0.020 A 68 ASN HB3 H 1 2.774 0.020 A 68 ASN HD21 H 1 6.984 0.020 A 68 ASN HD22 H 1 8.003 0.020 A 68 ASN C C 13 175.971 0.400 A 68 ASN CA C 13 52.007 0.400 A 68 ASN CB C 13 41.074 0.400 A 68 ASN N N 15 123.956 0.400 A 68 ASN ND2 N 15 116.661 0.400 A 69 GLU H H 1 9.078 0.020 A 69 GLU HA H 1 3.746 0.020 A 69 GLU HB2 H 1 1.972 0.020 A 69 GLU HB3 H 1 2.027 0.020 A 69 GLU HGx H 1 2.239 0.020 A 69 GLU HGy H 1 2.323 0.020 A 69 GLU C C 13 175.876 0.400 A 69 GLU CA C 13 59.802 0.400 A 69 GLU CB C 13 30.629 0.400 A 69 GLU CG C 13 37.614 0.400 A 69 GLU N N 15 120.136 0.400 A 70 THR H H 1 7.237 0.020 A 70 THR HA H 1 4.163 0.020 A 70 THR HB H 1 4.479 0.020 A 70 THR HG2% H 1 1.199 0.020 A 70 THR C C 13 175.634 0.400 A 70 THR CA C 13 61.541 0.400 A 70 THR CB C 13 69.333 0.400 A 70 THR CG2 C 13 21.942 0.400 A 70 THR N N 15 102.132 0.400 A 71 ASP H H 1 7.548 0.020 A 71 ASP HA H 1 4.723 0.020 A 71 ASP HB2 H 1 2.872 0.020 A 71 ASP HB3 H 1 2.415 0.020 A 71 ASP C C 13 175.077 0.400 A 71 ASP CA C 13 55.242 0.400 A 71 ASP CB C 13 41.983 0.400 A 71 ASP N N 15 123.260 0.400 A 72 THR H H 1 7.424 0.020 A 72 THR HA H 1 5.048 0.020 A 72 THR HB H 1 4.420 0.020 A 72 THR HG2% H 1 0.896 0.020 A 72 THR CA C 13 57.498 0.400 A 72 THR CB C 13 69.420 0.400 A 72 THR CG2 C 13 21.162 0.400 A 72 THR N N 15 108.692 0.400 A 73 PRO HA H 1 4.216 0.020 A 73 PRO HB2 H 1 2.079 0.020 A 73 PRO HB3 H 1 1.786 0.020 A 73 PRO HDx H 1 3.819 0.020 A 73 PRO HDy H 1 3.819 0.020 A 73 PRO HG2 H 1 1.585 0.020 A 73 PRO HG3 H 1 2.014 0.020 A 73 PRO C C 13 178.783 0.400 A 73 PRO CA C 13 65.598 0.400 A 73 PRO CB C 13 32.155 0.400 A 73 PRO CD C 13 51.152 0.400 A 73 PRO CG C 13 27.913 0.400 A 74 ALA H H 1 8.284 0.020 A 74 ALA HA H 1 4.028 0.020 A 74 ALA HB% H 1 0.980 0.020 A 74 ALA C C 13 181.611 0.400 A 74 ALA CA C 13 54.630 0.400 A 74 ALA CB C 13 18.413 0.400 A 74 ALA N N 15 116.924 0.400 A 75 GLN H H 1 7.982 0.020 A 75 GLN HA H 1 3.995 0.020 A 75 GLN HB2 H 1 2.133 0.020 A 75 GLN HB3 H 1 2.294 0.020 A 75 GLN HE2x H 1 6.778 0.020 A 75 GLN HE2y H 1 7.483 0.020 A 75 GLN HGx H 1 2.446 0.020 A 75 GLN HGy H 1 2.446 0.020 A 75 GLN C C 13 178.005 0.400 A 75 GLN CA C 13 58.450 0.400 A 75 GLN CB C 13 28.721 0.400 A 75 GLN CG C 13 33.699 0.400 A 75 GLN N N 15 120.236 0.400 A 75 GLN NE2 N 15 110.489 0.400 A 76 LEU H H 1 7.411 0.020 A 76 LEU HA H 1 4.329 0.020 A 76 LEU HB2 H 1 1.550 0.020 A 76 LEU HB3 H 1 1.652 0.020 A 76 LEU HDx% H 1 0.871 0.020 A 76 LEU HDy% H 1 0.778 0.020 A 76 LEU HG H 1 1.676 0.020 A 76 LEU C C 13 174.708 0.400 A 76 LEU CA C 13 54.428 0.400 A 76 LEU CB C 13 42.210 0.400 A 76 LEU CD1 C 13 22.173 0.400 A 76 LEU CD2 C 13 26.256 0.400 A 76 LEU CG C 13 27.438 0.400 A 76 LEU N N 15 116.951 0.400 A 77 GLU H H 1 7.691 0.020 A 77 GLU HA H 1 3.802 0.020 A 77 GLU HBx H 1 2.141 0.020 A 77 GLU HBy H 1 2.288 0.020 A 77 GLU HGx H 1 2.129 0.020 A 77 GLU HGy H 1 2.129 0.020 A 77 GLU C C 13 176.036 0.400 A 77 GLU CA C 13 57.246 0.400 A 77 GLU CB C 13 26.391 0.400 A 77 GLU CG C 13 36.772 0.400 A 77 GLU N N 15 114.070 0.400 A 78 MET H H 1 7.784 0.020 A 78 MET HA H 1 4.210 0.020 A 78 MET HB2 H 1 1.751 0.020 A 78 MET HB3 H 1 1.263 0.020 A 78 MET HE% H 1 1.154 0.020 A 78 MET HG2 H 1 1.270 0.020 A 78 MET HG3 H 1 2.128 0.020 A 78 MET C C 13 175.190 0.400 A 78 MET CA C 13 56.863 0.400 A 78 MET CB C 13 34.810 0.400 A 78 MET CE C 13 18.436 0.400 A 78 MET CG C 13 33.534 0.400 A 78 MET N N 15 116.476 0.400 A 79 GLU H H 1 9.383 0.020 A 79 GLU HA H 1 4.497 0.020 A 79 GLU HBx H 1 1.756 0.020 A 79 GLU HBy H 1 2.064 0.020 A 79 GLU HG2 H 1 2.195 0.020 A 79 GLU HG3 H 1 2.302 0.020 A 79 GLU C C 13 174.576 0.400 A 79 GLU CA C 13 53.577 0.400 A 79 GLU CB C 13 33.202 0.400 A 79 GLU CG C 13 35.807 0.400 A 79 GLU N N 15 121.916 0.400 A 80 ASP H H 1 8.467 0.020 A 80 ASP HA H 1 4.540 0.020 A 80 ASP HBx H 1 2.634 0.020 A 80 ASP HBy H 1 2.634 0.020 A 80 ASP C C 13 177.447 0.400 A 80 ASP CA C 13 56.907 0.400 A 80 ASP CB C 13 41.911 0.400 A 80 ASP N N 15 118.156 0.400 A 81 GLU H H 1 9.489 0.020 A 81 GLU HA H 1 3.694 0.020 A 81 GLU HBy H 1 2.435 0.020 A 81 GLU HBx H 1 2.222 0.020 A 81 GLU HGy H 1 2.274 0.020 A 81 GLU HGx H 1 2.054 0.020 A 81 GLU C C 13 175.532 0.400 A 81 GLU CA C 13 58.375 0.400 A 81 GLU CB C 13 26.369 0.400 A 81 GLU CG C 13 36.202 0.400 A 81 GLU N N 15 116.365 0.400 A 82 ASP H H 1 8.034 0.020 A 82 ASP HA H 1 4.869 0.020 A 82 ASP HBy H 1 2.947 0.020 A 82 ASP HBx H 1 2.661 0.020 A 82 ASP C C 13 174.496 0.400 A 82 ASP CA C 13 55.890 0.400 A 82 ASP CB C 13 42.038 0.400 A 82 ASP N N 15 120.644 0.400 A 83 THR H H 1 8.437 0.020 A 83 THR HA H 1 5.185 0.020 A 83 THR HB H 1 3.938 0.020 A 83 THR HG2% H 1 1.067 0.020 A 83 THR C C 13 174.123 0.400 A 83 THR CA C 13 62.252 0.400 A 83 THR CB C 13 71.493 0.400 A 83 THR CG2 C 13 22.467 0.400 A 83 THR N N 15 113.692 0.400 A 84 ILE H H 1 9.468 0.020 A 84 ILE HA H 1 4.548 0.020 A 84 ILE HB H 1 1.756 0.020 A 84 ILE HD1% H 1 0.573 0.020 A 84 ILE HG12 H 1 0.790 0.020 A 84 ILE HG13 H 1 1.610 0.020 A 84 ILE HG2% H 1 0.939 0.020 A 84 ILE C C 13 173.653 0.400 A 84 ILE CA C 13 60.477 0.400 A 84 ILE CB C 13 40.978 0.400 A 84 ILE CD1 C 13 14.716 0.400 A 84 ILE CG1 C 13 28.154 0.400 A 84 ILE CG2 C 13 18.585 0.400 A 84 ILE N N 15 127.253 0.400 A 85 ASP H H 1 9.018 0.020 A 85 ASP HA H 1 5.316 0.020 A 85 ASP HBx H 1 2.498 0.020 A 85 ASP HBy H 1 2.498 0.020 A 85 ASP C C 13 174.867 0.400 A 85 ASP CA C 13 54.158 0.400 A 85 ASP CB C 13 44.907 0.400 A 85 ASP N N 15 126.432 0.400 A 86 VAL H H 1 7.804 0.020 A 86 VAL HA H 1 4.699 0.020 A 86 VAL HB H 1 1.477 0.020 A 86 VAL HGx% H 1 0.461 0.020 A 86 VAL HGy% H 1 0.298 0.020 A 86 VAL C C 13 174.851 0.400 A 86 VAL CA C 13 60.148 0.400 A 86 VAL CB C 13 34.247 0.400 A 86 VAL CG1 C 13 21.577 0.400 A 86 VAL CG2 C 13 21.971 0.400 A 86 VAL N N 15 118.721 0.400 A 87 PHE H H 1 8.676 0.020 A 87 PHE HA H 1 4.696 0.020 A 87 PHE HB2 H 1 2.959 0.020 A 87 PHE HB3 H 1 2.661 0.020 A 87 PHE HD1 H 1 6.996 0.020 A 87 PHE HD2 H 1 6.996 0.020 A 87 PHE HE1 H 1 7.112 0.020 A 87 PHE HE2 H 1 7.112 0.020 A 87 PHE HZ H 1 7.170 0.020 A 87 PHE C C 13 174.190 0.400 A 87 PHE CA C 13 56.195 0.400 A 87 PHE CB C 13 42.049 0.400 A 87 PHE CD1 C 13 131.721 0.400 A 87 PHE CD2 C 13 131.721 0.400 A 87 PHE CE1 C 13 131.370 0.400 A 87 PHE CE2 C 13 130.960 0.400 A 87 PHE CZ C 13 129.683 0.400 A 87 PHE N N 15 124.652 0.400 A 88 GLN H H 1 8.655 0.020 A 88 GLN HA H 1 4.624 0.020 A 88 GLN HB2 H 1 1.925 0.020 A 88 GLN HB3 H 1 2.078 0.020 A 88 GLN HE2y H 1 7.471 0.020 A 88 GLN HE2x H 1 6.767 0.020 A 88 GLN HG2 H 1 2.315 0.020 A 88 GLN HG3 H 1 2.279 0.020 A 88 GLN C C 13 175.368 0.400 A 88 GLN CA C 13 55.415 0.400 A 88 GLN CB C 13 29.947 0.400 A 88 GLN CG C 13 34.087 0.400 A 88 GLN N N 15 121.545 0.400 A 88 GLN NE2 N 15 111.242 0.400 A 89 GLN H H 1 8.345 0.020 A 89 GLN HA H 1 4.313 0.020 A 89 GLN HBx H 1 1.864 0.020 A 89 GLN HBy H 1 1.939 0.020 A 89 GLN HE21 H 1 6.823 0.020 A 89 GLN HE22 H 1 7.392 0.020 A 89 GLN HGx H 1 2.218 0.020 A 89 GLN HGy H 1 2.218 0.020 A 89 GLN C C 13 175.357 0.400 A 89 GLN CA C 13 55.713 0.400 A 89 GLN CB C 13 29.759 0.400 A 89 GLN CG C 13 33.565 0.400 A 89 GLN N N 15 123.149 0.400 A 89 GLN NE2 N 15 111.880 0.400 A 90 GLN H H 1 8.706 0.020 A 90 GLN HA H 1 4.255 0.020 A 90 GLN HBx H 1 1.991 0.020 A 90 GLN HBy H 1 1.991 0.020 A 90 GLN HE2y H 1 7.566 0.020 A 90 GLN HE2x H 1 6.868 0.020 A 90 GLN HGx H 1 2.368 0.020 A 90 GLN HGy H 1 2.368 0.020 A 90 GLN C C 13 176.156 0.400 A 90 GLN CA C 13 56.220 0.400 A 90 GLN CB C 13 29.587 0.400 A 90 GLN CG C 13 33.749 0.400 A 90 GLN N N 15 123.150 0.400 A 90 GLN NE2 N 15 112.775 0.400 A 91 THR H H 1 8.359 0.020 A 91 THR HA H 1 4.360 0.020 A 91 THR HB H 1 4.233 0.020 A 91 THR HG2% H 1 1.186 0.020 A 91 THR C C 13 175.011 0.400 A 91 THR CA C 13 62.032 0.400 A 91 THR CB C 13 69.856 0.400 A 91 THR CG2 C 13 21.569 0.400 A 91 THR N N 15 115.767 0.400 A 92 GLY H H 1 8.527 0.020 A 92 GLY HAx H 1 3.991 0.020 A 92 GLY HAy H 1 3.991 0.020 A 92 GLY C C 13 173.638 0.400 A 92 GLY CA C 13 45.294 0.400 A 92 GLY N N 15 111.910 0.400 A 93 GLY H H 1 8.035 0.020 A 93 GLY HAx H 1 3.735 0.020 A 93 GLY HAy H 1 3.735 0.020 A 93 GLY CA C 13 45.980 0.400 A 93 GLY N N 15 115.301 0.400 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _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 22 VAL HA A 22 VAL HGx% 1.0 1.8 3.89 2 2 A 40 LEU HB2 A 43 LEU HDx% 1.0 1.8 4.53 3 3 A 43 LEU HDx% A 43 LEU HB3 1.0 1.8 3.32 4 4 A 43 LEU HDx% A 84 ILE HG2% 1.0 1.8 4.13 5 5 A 60 PHE HD% A 86 VAL HGy% 1.0 1.8 4.74 6 6 A 60 PHE HE% A 86 VAL HGy% 1.0 1.8 4.15 7 7 A 60 PHE HA A 86 VAL HGy% 1.0 1.8 4.15 8 8 A 86 VAL HA A 86 VAL HGy% 1.0 1.8 3.41 9 9 A 58 ILE HB A 86 VAL HGy% 1.0 1.8 4.47 10 10 A 32 PHE HB2 A 43 LEU HDy% 1.0 1.8 4.11 11 11 A 43 LEU HDy% A 20 LEU HB2 1.0 1.8 3.52 12 12 A 87 PHE H A 86 VAL HGx% 1.0 1.8 3.88 13 13 A 86 VAL H A 86 VAL HGx% 1.0 1.8 3.93 14 14 A 60 PHE HA A 86 VAL HGx% 1.0 1.8 4.15 15 15 A 86 VAL HA A 86 VAL HGx% 1.0 1.8 3.41 16 16 A 58 ILE HB A 86 VAL HGx% 1.0 1.8 4.47 17 17 A 58 ILE HG13 A 86 VAL HGx% 1.0 1.8 5.21 18 18 A 84 ILE HG2% A 86 VAL HGx% 1.0 1.8 4.73 19 19 A 18 ILE HD1% A 19 ASN H 1.0 1.8 4.20 20 20 A 18 ILE HD1% A 80 ASP HA 1.0 1.8 3.58 21 21 A 18 ILE HD1% A 73 PRO HB2 1.0 1.8 3.60 22 22 A 18 ILE HD1% A 18 ILE HB 1.0 1.8 3.29 23 23 A 18 ILE HD1% A 20 LEU HDy% 1.0 1.8 2.98 24 24 A 40 LEU H A 40 LEU HDx% 1.0 1.8 4.00 25 25 A 40 LEU HB2 A 40 LEU HDx% 1.0 1.8 3.38 26 26 A 84 ILE H A 84 ILE HD1% 1.0 1.8 4.09 27 27 A 60 PHE HD% A 84 ILE HD1% 1.0 1.8 4.22 28 28 A 84 ILE HD1% A 84 ILE HA 1.0 1.8 3.93 29 29 A 43 LEU HDy% A 84 ILE HD1% 1.0 1.8 4.14 30 30 A 40 LEU HB2 A 40 LEU HDy% 1.0 1.8 3.38 31 31 A 20 LEU HB3 A 20 LEU HDx% 1.0 1.8 3.45 32 32 A 47 TYR HD% A 58 ILE HG2% 1.0 1.8 5.14 33 33 A 58 ILE HG2% A 58 ILE HA 1.0 1.8 3.34 34 34 A 58 ILE HG2% A 88 GLN HA 1.0 1.8 3.42 35 35 A 58 ILE HG2% A 57 GLN HB2 1.0 1.8 3.47 36 36 A 58 ILE HG2% A 58 ILE HG12 1.0 1.8 3.26 37 37 A 61 ARG H A 67 ILE HD1% 1.0 1.8 4.25 38 38 A 67 ILE HD1% A 62 PHE H 1.0 1.8 4.00 39 39 A 67 ILE HD1% A 85 ASP H 1.0 1.8 4.52 40 40 A 67 ILE HD1% A 62 PHE HD% 1.0 1.8 4.09 41 41 A 67 ILE HD1% A 60 PHE HB2 1.0 1.8 3.37 42 42 A 67 ILE HD1% A 60 PHE HB3 1.0 1.8 3.58 43 43 A 67 ILE HD1% A 67 ILE HB 1.0 1.8 3.19 44 44 A 67 ILE HD1% A 67 ILE HG2% 1.0 1.8 2.75 45 45 A 43 LEU HDx% A 34 ILE HD1% 1.0 1.8 4.82 46 46 A 43 LEU HDx% A 67 ILE HD1% 1.0 1.8 5.23 47 47 A 58 ILE HD1% A 59 ARG H 1.0 1.8 3.99 48 48 A 34 ILE HD1% A 35 LYS H 1.0 1.8 4.48 49 49 A 58 ILE HD1% A 60 PHE HZ 1.0 1.8 3.57 50 50 A 47 TYR HD% A 58 ILE HD1% 1.0 1.8 3.37 51 51 A 34 ILE HD1% A 34 ILE HA 1.0 1.8 4.33 52 52 A 34 ILE HD1% A 38 THR HB 1.0 1.8 4.61 53 53 A 58 ILE HB A 58 ILE HD1% 1.0 1.8 3.19 54 54 A 34 ILE HD1% A 38 THR HG2% 1.0 1.8 2.71 55 55 A 43 LEU HDy% A 34 ILE HD1% 1.0 1.8 3.15 56 56 A 18 ILE HG2% A 80 ASP HBx 1.0 1.8 3.71 57 56 A 18 ILE HG2% A 80 ASP HBy 1.0 1.8 3.71 58 57 A 18 ILE HG2% A 36 ARG HB2 1.0 1.8 4.33 59 58 A 18 ILE HD1% A 18 ILE HG2% 1.0 1.8 3.10 60 59 A 30 VAL HGx% A 32 PHE HD% 1.0 1.8 4.12 61 60 A 47 TYR HD% A 30 VAL HGx% 1.0 1.8 4.42 62 61 A 22 VAL HA A 22 VAL HGy% 1.0 1.8 3.89 63 62 A 34 ILE HA A 34 ILE HG2% 1.0 1.8 3.42 64 63 A 30 VAL HGx% A 31 GLN H 1.0 1.8 3.24 65 64 A 53 LEU H A 53 LEU HDy% 1.0 1.8 4.06 66 65 A 76 LEU H A 76 LEU HDy% 1.0 1.8 3.90 67 66 A 53 LEU HA A 53 LEU HDx% 1.0 1.8 4.16 68 67 A 76 LEU HDy% A 76 LEU HA 1.0 1.8 4.25 69 68 A 76 LEU HB2 A 76 LEU HDx% 1.0 1.8 2.88 70 69 A 67 ILE HG2% A 67 ILE H 1.0 1.8 3.98 71 70 A 67 ILE HG2% A 40 LEU HDy% 1.0 1.8 3.10 72 71 A 76 LEU H A 76 LEU HDx% 1.0 1.8 3.41 73 72 A 76 LEU HDx% A 62 PHE HB3 1.0 1.8 4.08 74 73 A 29 VAL HA A 29 VAL HGy% 1.0 1.8 3.18 75 74 A 9 GLY HAx A 10 VAL HGx% 1.0 1.8 4.02 76 74 A 9 GLY HAy A 10 VAL HGx% 1.0 1.8 4.02 77 74 A 10 VAL HGy% A 9 GLY HAx 1.0 1.8 4.02 78 74 A 9 GLY HAy A 10 VAL HGy% 1.0 1.8 4.02 79 75 A 84 ILE HG2% A 85 ASP H 1.0 1.8 3.54 80 76 A 76 LEU H A 74 ALA HB% 1.0 1.8 4.91 81 77 A 84 ILE HG2% A 84 ILE HD1% 1.0 1.8 2.87 82 78 A 84 ILE HG2% A 86 VAL H 1.0 1.8 4.01 83 79 A 30 VAL HGy% A 50 ARG HD2 1.0 1.8 4.14 84 80 A 30 VAL HGy% A 22 VAL HGx% 1.0 1.8 4.51 85 81 A 84 ILE H A 83 THR HG2% 1.0 1.8 3.40 86 82 A 78 MET H A 78 MET HE% 1.0 1.8 4.28 87 83 A 84 ILE HA A 78 MET HE% 1.0 1.8 5.15 88 84 A 78 MET HE% A 73 PRO HA 1.0 1.8 3.81 89 85 A 78 MET HE% A 78 MET HG3 1.0 1.8 3.29 90 86 A 84 ILE HD1% A 78 MET HE% 1.0 1.8 2.58 91 87 A 70 THR H A 70 THR HG2% 1.0 1.8 3.12 92 88 A 34 ILE HG13 A 35 LYS HB2 1.0 1.8 5.44 93 89 A 61 ARG HB3 A 67 ILE HG13 1.0 1.8 5.92 94 90 A 62 PHE H A 67 ILE HG13 1.0 1.8 4.11 95 91 A 2 ALA HB% A 3 ASP H 1.0 1.8 3.83 96 92 A 23 ALA H A 23 ALA HB% 1.0 1.8 3.14 97 93 A 86 VAL H A 23 ALA HB% 1.0 1.8 4.37 98 94 A 34 ILE HA A 38 THR HG2% 1.0 1.8 3.86 99 95 A 38 THR HG2% A 39 PRO HG3 1.0 1.8 4.56 100 96 A 63 ASP H A 63 ASP HB3 1.0 1.8 4.16 101 97 A 7 LYS HDy A 7 LYS HGx 1.0 1.8 2.40 102 97 A 7 LYS HDx A 7 LYS HGx 1.0 1.8 2.40 103 97 A 7 LYS HGy A 7 LYS HDx 1.0 1.8 2.40 104 97 A 7 LYS HGy A 7 LYS HDy 1.0 1.8 2.40 105 98 A 44 MET HE% A 69 GLU H 1.0 1.8 3.50 106 99 A 44 MET HE% A 44 MET HA 1.0 1.8 4.46 107 100 A 60 PHE HB2 A 44 MET HE% 1.0 1.8 3.89 108 101 A 44 MET HE% A 44 MET HGy 1.0 1.8 3.48 109 102 A 67 ILE HG2% A 44 MET HE% 1.0 1.8 2.76 110 103 A 44 MET HE% A 44 MET HGx 1.0 1.8 3.48 111 104 A 42 LYS HG3 A 42 LYS HEx 1.0 1.8 3.84 112 104 A 42 LYS HG3 A 42 LYS HEy 1.0 1.8 3.84 113 105 A 46 ALA HB% A 49 GLU H 1.0 1.8 4.82 114 106 A 46 ALA HB% A 45 LYS HBx 1.0 1.8 3.90 115 106 A 46 ALA HB% A 45 LYS HBy 1.0 1.8 3.90 116 107 A 56 ARG HA A 56 ARG HGx 1.0 1.8 3.55 117 107 A 56 ARG HA A 56 ARG HGy 1.0 1.8 3.55 118 108 A 75 GLN HB2 A 76 LEU HG 1.0 1.8 3.94 119 109 A 58 ILE HB A 58 ILE H 1.0 1.8 4.03 120 110 A 12 THR H A 11 LYS HDx 1.0 1.8 4.60 121 110 A 11 LYS HDy A 12 THR H 1.0 1.8 4.60 122 111 A 39 PRO HD2 A 42 LYS HDx 1.0 1.8 4.43 123 111 A 39 PRO HD2 A 42 LYS HDy 1.0 1.8 4.43 124 112 A 39 PRO HG3 A 42 LYS HDx 1.0 1.8 4.56 125 112 A 39 PRO HG3 A 42 LYS HDy 1.0 1.8 4.56 126 113 A 55 MET HE% A 45 LYS HDx 1.0 1.8 4.70 127 113 A 45 LYS HDy A 55 MET HE% 1.0 1.8 4.70 128 114 A 5 LYS HDx A 5 LYS HGx 1.0 1.8 2.57 129 114 A 5 LYS HDy A 5 LYS HGx 1.0 1.8 2.57 130 114 A 5 LYS HGy A 5 LYS HDx 1.0 1.8 2.57 131 114 A 5 LYS HGy A 5 LYS HDy 1.0 1.8 2.57 132 115 A 57 GLN HB2 A 56 ARG HGx 1.0 1.8 4.14 133 115 A 57 GLN HB2 A 56 ARG HGy 1.0 1.8 4.14 134 116 A 35 LYS HB2 A 38 THR HA 1.0 1.8 4.50 135 117 A 43 LEU HA A 42 LYS HBx 1.0 1.8 5.08 136 118 A 59 ARG H A 59 ARG HB2 1.0 1.8 3.46 137 119 A 56 ARG H A 56 ARG HB2 1.0 1.8 3.94 138 120 A 51 GLN HA A 50 ARG HGx 1.0 1.8 4.17 139 120 A 50 ARG HGy A 51 GLN HA 1.0 1.8 4.17 140 121 A 7 LYS H A 7 LYS HB3 1.0 1.8 3.66 141 122 A 35 LYS H A 35 LYS HB3 1.0 1.8 3.71 142 123 A 7 LYS HB3 A 7 LYS HGx 1.0 1.8 2.67 143 123 A 7 LYS HGy A 7 LYS HB3 1.0 1.8 2.67 144 124 A 13 GLU HBx A 13 GLU HGx 1.0 1.8 2.50 145 124 A 13 GLU HBy A 13 GLU HGx 1.0 1.8 2.50 146 124 A 13 GLU HGy A 13 GLU HBx 1.0 1.8 2.50 147 124 A 13 GLU HBy A 13 GLU HGy 1.0 1.8 2.50 148 125 A 65 GLN HA A 66 PRO HGx 1.0 1.8 4.73 149 126 A 51 GLN HA A 51 GLN HB3 1.0 1.8 2.87 150 127 A 6 PRO HGx A 7 LYS HDx 1.0 1.8 5.02 151 127 A 6 PRO HGy A 7 LYS HDx 1.0 1.8 5.02 152 127 A 7 LYS HDy A 6 PRO HGx 1.0 1.8 5.02 153 127 A 7 LYS HDy A 6 PRO HGy 1.0 1.8 5.02 154 128 A 41 SER HA A 69 GLU HB3 1.0 1.8 4.91 155 129 A 51 GLN HB3 A 52 GLY HAx 1.0 1.8 5.41 156 129 A 51 GLN HB3 A 52 GLY HAy 1.0 1.8 5.41 157 130 A 57 GLN HA A 90 GLN HBx 1.0 1.8 3.48 158 130 A 57 GLN HA A 90 GLN HBy 1.0 1.8 3.48 159 131 A 90 GLN HBy A 90 GLN HGx 1.0 1.8 2.76 160 131 A 90 GLN HBx A 90 GLN HGx 1.0 1.8 2.76 161 131 A 90 GLN HGy A 90 GLN HBx 1.0 1.8 2.76 162 131 A 90 GLN HBy A 90 GLN HGy 1.0 1.8 2.76 163 132 A 31 GLN HB2 A 32 PHE H 1.0 1.8 4.26 164 133 A 49 GLU HB3 A 50 ARG H 1.0 1.8 3.80 165 134 A 49 GLU H A 49 GLU HB3 1.0 1.8 3.59 166 135 A 55 MET HE% A 55 MET H 1.0 1.8 4.37 167 136 A 55 MET HE% A 55 MET HA 1.0 1.8 3.43 168 137 A 55 MET HE% A 45 LYS HA 1.0 1.8 3.08 169 138 A 55 MET HE% A 48 CYS HBy 1.0 1.8 4.38 170 139 A 55 MET HE% A 55 MET HGx 1.0 1.8 2.78 171 139 A 55 MET HE% A 55 MET HGy 1.0 1.8 2.78 172 140 A 1 MET HE% A 1 MET HGx 1.0 1.8 3.50 173 141 A 55 MET HE% A 44 MET HBx 1.0 1.8 2.78 174 141 A 55 MET HE% A 44 MET HBy 1.0 1.8 2.78 175 142 A 30 VAL HB A 47 TYR HE% 1.0 1.8 4.20 176 143 A 31 GLN H A 31 GLN HG3 1.0 1.8 3.75 177 144 A 77 GLU H A 77 GLU HGx 1.0 1.8 3.87 178 144 A 77 GLU H A 77 GLU HGy 1.0 1.8 3.87 179 145 A 77 GLU HA A 77 GLU HGx 1.0 1.8 3.52 180 145 A 77 GLU HGy A 77 GLU HA 1.0 1.8 3.52 181 146 A 65 GLN HB3 A 65 GLN HGx 1.0 1.8 2.96 182 147 A 13 GLU HA A 13 GLU HGx 1.0 1.8 3.37 183 147 A 13 GLU HGy A 13 GLU HA 1.0 1.8 3.37 184 148 A 7 LYS HGy A 8 GLU HGx 1.0 1.8 4.16 185 148 A 7 LYS HGx A 8 GLU HGx 1.0 1.8 4.16 186 148 A 8 GLU HGy A 7 LYS HGx 1.0 1.8 4.16 187 148 A 7 LYS HGy A 8 GLU HGy 1.0 1.8 4.16 188 149 A 65 GLN HA A 66 PRO HGy 1.0 1.8 4.73 189 150 A 49 GLU H A 49 GLU HG2 1.0 1.8 3.51 190 151 A 59 ARG HG3 A 89 GLN HGx 1.0 1.8 4.08 191 151 A 59 ARG HG3 A 89 GLN HGy 1.0 1.8 4.08 192 152 A 50 ARG H A 49 GLU HG2 1.0 1.8 5.35 193 153 A 80 ASP HBx A 81 GLU HGy 1.0 1.8 4.09 194 153 A 80 ASP HBy A 81 GLU HGy 1.0 1.8 4.09 195 154 A 69 GLU HA A 69 GLU HGx 1.0 1.8 4.25 196 155 A 79 GLU H A 79 GLU HG3 1.0 1.8 4.07 197 156 A 79 GLU HG3 A 79 GLU HA 1.0 1.8 3.93 198 157 A 57 GLN H A 57 GLN HG3 1.0 1.8 4.76 199 158 A 88 GLN HA A 88 GLN HG3 1.0 1.8 3.56 200 159 A 88 GLN HB2 A 88 GLN HG2 1.0 1.8 2.71 201 160 A 58 ILE HG2% A 88 GLN HG3 1.0 1.8 3.63 202 161 A 57 GLN HA A 57 GLN HG3 1.0 1.8 3.60 203 162 A 57 GLN H A 57 GLN HG2 1.0 1.8 4.37 204 163 A 87 PHE HB3 A 25 GLN HGx 1.0 1.8 4.51 205 163 A 25 GLN HGy A 87 PHE HB3 1.0 1.8 4.51 206 164 A 57 GLN HG2 A 57 GLN HB3 1.0 1.8 2.97 207 165 A 61 ARG HE A 85 ASP HBx 1.0 1.8 5.32 208 165 A 61 ARG HE A 85 ASP HBy 1.0 1.8 5.32 209 166 A 61 ARG HD3 A 85 ASP HBx 1.0 1.8 4.15 210 166 A 85 ASP HBy A 61 ARG HD3 1.0 1.8 4.15 211 167 A 81 GLU HGx A 80 ASP HBx 1.0 1.8 4.09 212 167 A 80 ASP HBy A 81 GLU HGx 1.0 1.8 4.09 213 168 A 1 MET HE% A 1 MET HGy 1.0 1.8 3.50 214 169 A 83 THR H A 82 ASP HBx 1.0 1.8 4.38 215 170 A 61 ARG HD2 A 87 PHE HE% 1.0 1.8 4.20 216 171 A 15 ASN HD2y A 15 ASN HBx 1.0 1.8 4.02 217 171 A 15 ASN HBy A 15 ASN HD2y 1.0 1.8 4.02 218 172 A 35 LYS HB2 A 35 LYS HEx 1.0 1.8 4.24 219 173 A 35 LYS HB2 A 35 LYS HEy 1.0 1.8 4.24 220 174 A 21 LYS HG3 A 21 LYS HE2 1.0 1.8 3.34 221 175 A 62 PHE HB3 A 67 ILE HG12 1.0 1.8 3.43 222 176 A 21 LYS HE2 A 21 LYS HDx 1.0 1.8 2.91 223 176 A 21 LYS HE2 A 21 LYS HDy 1.0 1.8 2.91 224 177 A 7 LYS HDy A 7 LYS HEx 1.0 1.8 2.80 225 177 A 7 LYS HDx A 7 LYS HEx 1.0 1.8 2.80 226 177 A 7 LYS HEy A 7 LYS HDx 1.0 1.8 2.80 227 177 A 7 LYS HDy A 7 LYS HEy 1.0 1.8 2.80 228 178 A 39 PRO HD2 A 42 LYS HEx 1.0 1.8 4.89 229 178 A 42 LYS HEy A 39 PRO HD2 1.0 1.8 4.89 230 179 A 5 LYS HDx A 5 LYS HEx 1.0 1.8 2.63 231 179 A 5 LYS HDy A 5 LYS HEx 1.0 1.8 2.63 232 179 A 5 LYS HEy A 5 LYS HDx 1.0 1.8 2.63 233 179 A 5 LYS HDy A 5 LYS HEy 1.0 1.8 2.63 234 180 A 42 LYS HDy A 42 LYS HEx 1.0 1.8 2.82 235 180 A 42 LYS HDx A 42 LYS HEx 1.0 1.8 2.82 236 180 A 42 LYS HEy A 42 LYS HDx 1.0 1.8 2.82 237 180 A 42 LYS HEy A 42 LYS HDy 1.0 1.8 2.82 238 181 A 5 LYS HEy A 5 LYS HGx 1.0 1.8 3.03 239 181 A 5 LYS HEx A 5 LYS HGx 1.0 1.8 3.03 240 181 A 5 LYS HGy A 5 LYS HEx 1.0 1.8 3.03 241 181 A 5 LYS HGy A 5 LYS HEy 1.0 1.8 3.03 242 182 A 7 LYS HEx A 7 LYS HGx 1.0 1.8 3.25 243 182 A 7 LYS HGy A 7 LYS HEx 1.0 1.8 3.25 244 182 A 7 LYS HGy A 7 LYS HEy 1.0 1.8 3.25 245 182 A 7 LYS HEy A 7 LYS HGx 1.0 1.8 3.25 246 183 A 36 ARG HB2 A 36 ARG HD2 1.0 1.8 3.81 247 184 A 56 ARG HB2 A 56 ARG HDx 1.0 1.8 3.49 248 184 A 56 ARG HB2 A 56 ARG HDy 1.0 1.8 3.49 249 185 A 56 ARG HDy A 56 ARG HGx 1.0 1.8 2.59 250 185 A 56 ARG HDx A 56 ARG HGx 1.0 1.8 2.59 251 185 A 56 ARG HGy A 56 ARG HDx 1.0 1.8 2.59 252 185 A 56 ARG HGy A 56 ARG HDy 1.0 1.8 2.59 253 186 A 59 ARG HA A 59 ARG HD3 1.0 1.8 3.74 254 187 A 60 PHE HZ A 44 MET HA 1.0 1.8 4.26 255 188 A 92 GLY HAy A 93 GLY HAx 1.0 1.8 3.70 256 188 A 93 GLY HAy A 92 GLY HAx 1.0 1.8 3.70 257 188 A 92 GLY HAy A 93 GLY HAy 1.0 1.8 3.70 258 188 A 92 GLY HAx A 93 GLY HAx 1.0 1.8 3.70 259 189 A 81 GLU HA A 81 GLU HGx 1.0 1.8 4.00 260 190 A 38 THR HA A 39 PRO HD3 1.0 1.8 3.85 261 191 A 69 GLU HA A 41 SER H 1.0 1.8 4.14 262 192 A 41 SER HA A 69 GLU HA 1.0 1.8 3.80 263 193 A 40 LEU HA A 40 LEU HDy% 1.0 1.8 4.32 264 194 A 45 LYS HA A 45 LYS HGy 1.0 1.8 3.77 265 195 A 42 LYS HA A 42 LYS HG2 1.0 1.8 3.58 266 196 A 77 GLU H A 74 ALA HA 1.0 1.8 4.20 267 197 A 77 GLU HA A 74 ALA HA 1.0 1.8 4.01 268 198 A 49 GLU HA A 52 GLY H 1.0 1.8 4.41 269 199 A 49 GLU HB3 A 49 GLU HA 1.0 1.8 2.97 270 200 A 50 ARG HA A 50 ARG HGx 1.0 1.8 3.37 271 200 A 50 ARG HGy A 50 ARG HA 1.0 1.8 3.37 272 201 A 10 VAL HA A 11 LYS HA 1.0 1.8 4.53 273 202 A 10 VAL HA A 10 VAL HGx% 1.0 1.8 2.80 274 202 A 10 VAL HGy% A 10 VAL HA 1.0 1.8 2.80 275 203 A 25 GLN HA A 27 GLY H 1.0 1.8 4.13 276 204 A 25 GLN HA A 27 GLY HA2 1.0 1.8 5.22 277 205 A 25 GLN HA A 25 GLN HGx 1.0 1.8 3.48 278 205 A 25 GLN HGy A 25 GLN HA 1.0 1.8 3.48 279 206 A 12 THR HB A 13 GLU H 1.0 1.8 4.12 280 207 A 12 THR HA A 12 THR HG2% 1.0 1.8 3.31 281 208 A 8 GLU HA A 8 GLU HGx 1.0 1.8 3.70 282 208 A 8 GLU HGy A 8 GLU HA 1.0 1.8 3.70 283 209 A 51 GLN HA A 51 GLN HE21 1.0 1.8 4.26 284 210 A 46 ALA HA A 47 TYR HA 1.0 1.8 5.35 285 211 A 51 GLN HA A 50 ARG HA 1.0 1.8 5.71 286 212 A 55 MET HA A 57 GLN H 1.0 1.8 4.47 287 213 A 58 ILE HG12 A 55 MET HA 1.0 1.8 4.05 288 214 A 76 LEU HA A 76 LEU HDx% 1.0 1.8 3.97 289 215 A 31 GLN HG3 A 30 VAL HA 1.0 1.8 4.31 290 216 A 23 ALA H A 85 ASP HA 1.0 1.8 4.19 291 217 A 60 PHE HA A 87 PHE HD% 1.0 1.8 5.05 292 218 A 7 LYS HA A 7 LYS HDx 1.0 1.8 4.35 293 218 A 7 LYS HDy A 7 LYS HA 1.0 1.8 4.35 294 219 A 8 GLU HA A 7 LYS HDx 1.0 1.8 4.73 295 219 A 7 LYS HDy A 8 GLU HA 1.0 1.8 4.73 296 220 A 22 VAL HB A 84 ILE HG13 1.0 1.8 4.39 297 221 A 10 VAL HB A 11 LYS H 1.0 1.8 4.40 298 222 A 65 GLN H A 65 GLN HGy 1.0 1.8 3.79 299 223 A 21 LYS HE2 A 81 GLU HBx 1.0 1.8 3.68 300 224 A 59 ARG H A 86 VAL HGy% 1.0 1.8 5.00 301 225 A 60 PHE HZ A 86 VAL HGy% 1.0 1.8 5.11 302 226 A 24 GLY HAx A 86 VAL HGy% 1.0 1.8 4.95 303 227 A 58 ILE HG13 A 86 VAL HGy% 1.0 1.8 5.21 304 228 A 43 LEU HDy% A 32 PHE H 1.0 1.8 5.34 305 229 A 43 LEU HDy% A 22 VAL HB 1.0 1.8 6.00 306 230 A 43 LEU HDy% A 73 PRO HG3 1.0 1.8 6.00 307 231 A 25 GLN H A 86 VAL HGx% 1.0 1.8 5.69 308 232 A 24 GLY HAx A 86 VAL HGx% 1.0 1.8 4.95 309 233 A 18 ILE HD1% A 78 MET H 1.0 1.8 4.91 310 234 A 18 ILE HD1% A 36 ARG HA 1.0 1.8 4.63 311 235 A 18 ILE HD1% A 80 ASP HBx 1.0 1.8 4.41 312 235 A 18 ILE HD1% A 80 ASP HBy 1.0 1.8 4.41 313 236 A 72 THR H A 40 LEU HDx% 1.0 1.8 5.39 314 237 A 22 VAL HA A 84 ILE HD1% 1.0 1.8 4.63 315 238 A 20 LEU H A 20 LEU HDx% 1.0 1.8 4.51 316 239 A 58 ILE HG2% A 88 GLN HB2 1.0 1.8 4.29 317 240 A 34 ILE HG2% A 43 LEU HA 1.0 1.8 4.65 318 241 A 43 LEU HDx% A 34 ILE HG2% 1.0 1.8 4.95 319 242 A 76 LEU HDy% A 75 GLN HB2 1.0 1.8 5.28 320 243 A 54 SER H A 53 LEU HDx% 1.0 1.8 4.88 321 244 A 67 ILE HG2% A 61 ARG HA 1.0 1.8 5.19 322 245 A 22 VAL HA A 84 ILE HG2% 1.0 1.8 4.44 323 246 A 30 VAL HGy% A 22 VAL H 1.0 1.8 4.91 324 247 A 87 PHE H A 58 ILE HG13 1.0 1.8 5.11 325 248 A 88 GLN HA A 58 ILE HG12 1.0 1.8 6.00 326 249 A 58 ILE HG13 A 88 GLN HA 1.0 1.8 6.00 327 250 A 31 GLN HG3 A 21 LYS HG2 1.0 1.8 4.63 328 251 A 62 PHE HZ A 78 MET HG2 1.0 1.8 5.16 329 252 A 61 ARG H A 67 ILE HG13 1.0 1.8 4.86 330 253 A 2 ALA HB% A 1 MET HA 1.0 1.8 5.00 331 254 A 23 ALA HB% A 25 GLN H 1.0 1.8 6.00 332 255 A 23 ALA HB% A 85 ASP HBx 1.0 1.8 5.60 333 255 A 23 ALA HB% A 85 ASP HBy 1.0 1.8 5.60 334 256 A 87 PHE HD% A 61 ARG HG3 1.0 1.8 5.75 335 257 A 6 PRO HB3 A 7 LYS HGx 1.0 1.8 4.91 336 257 A 7 LYS HGy A 6 PRO HB3 1.0 1.8 4.91 337 258 A 59 ARG HG2 A 60 PHE H 1.0 1.8 4.71 338 259 A 43 LEU HDy% A 20 LEU HG 1.0 1.8 4.83 339 260 A 74 ALA HB% A 36 ARG HG3 1.0 1.8 5.69 340 261 A 67 ILE H A 44 MET HE% 1.0 1.8 5.51 341 262 A 47 TYR HD% A 86 VAL HB 1.0 1.8 6.00 342 263 A 60 PHE HD% A 86 VAL HB 1.0 1.8 6.00 343 264 A 59 ARG HG3 A 60 PHE H 1.0 1.8 5.40 344 265 A 21 LYS HB3 A 29 VAL HB 1.0 1.8 5.34 345 266 A 44 MET HA A 46 ALA HB% 1.0 1.8 5.31 346 267 A 46 ALA HB% A 47 TYR HB3 1.0 1.8 4.69 347 268 A 31 GLN HA A 21 LYS HDx 1.0 1.8 4.52 348 268 A 21 LYS HDy A 31 GLN HA 1.0 1.8 4.52 349 269 A 36 ARG H A 36 ARG HG2 1.0 1.8 4.77 350 270 A 57 GLN HA A 56 ARG HGx 1.0 1.8 4.46 351 270 A 56 ARG HGy A 57 GLN HA 1.0 1.8 4.46 352 271 A 42 LYS H A 42 LYS HDx 1.0 1.8 4.71 353 271 A 42 LYS HDy A 42 LYS H 1.0 1.8 4.71 354 272 A 47 TYR HD% A 50 ARG HGx 1.0 1.8 4.91 355 272 A 47 TYR HD% A 50 ARG HGy 1.0 1.8 4.91 356 273 A 38 THR HG2% A 34 ILE HB 1.0 1.8 4.37 357 274 A 45 LYS HBy A 55 MET HGx 1.0 1.8 4.64 358 274 A 45 LYS HBx A 55 MET HGx 1.0 1.8 4.64 359 274 A 55 MET HGy A 45 LYS HBx 1.0 1.8 4.64 360 274 A 45 LYS HBy A 55 MET HGy 1.0 1.8 4.64 361 275 A 30 VAL HGx% A 31 GLN HB3 1.0 1.8 5.30 362 276 A 7 LYS HGy A 8 GLU HBx 1.0 1.8 4.81 363 276 A 7 LYS HGx A 8 GLU HBx 1.0 1.8 4.81 364 276 A 8 GLU HBy A 7 LYS HGx 1.0 1.8 4.81 365 276 A 7 LYS HGy A 8 GLU HBy 1.0 1.8 4.81 366 277 A 44 MET HE% A 69 GLU HB2 1.0 1.8 5.20 367 278 A 29 VAL HB A 23 ALA HA 1.0 1.8 4.88 368 279 A 29 VAL HB A 28 SER HA 1.0 1.8 5.05 369 280 A 30 VAL HA A 29 VAL HB 1.0 1.8 5.67 370 281 A 70 THR HG2% A 69 GLU HB2 1.0 1.8 5.10 371 282 A 70 THR HG2% A 69 GLU HB3 1.0 1.8 5.74 372 283 A 50 ARG HB3 A 51 GLN H 1.0 1.8 4.46 373 284 A 73 PRO HB2 A 36 ARG HB3 1.0 1.8 4.92 374 285 A 76 LEU HDx% A 77 GLU HGx 1.0 1.8 5.76 375 285 A 76 LEU HDx% A 77 GLU HGy 1.0 1.8 5.76 376 286 A 74 ALA HB% A 75 GLN HB2 1.0 1.8 4.63 377 287 A 12 THR HG2% A 13 GLU HGx 1.0 1.8 5.38 378 287 A 13 GLU HGy A 12 THR HG2% 1.0 1.8 5.38 379 288 A 58 ILE HA A 89 GLN HGx 1.0 1.8 4.70 380 288 A 58 ILE HA A 89 GLN HGy 1.0 1.8 4.70 381 289 A 74 ALA HB% A 75 GLN HB3 1.0 1.8 5.73 382 290 A 57 GLN HG3 A 54 SER HBx 1.0 1.8 4.55 383 291 A 57 GLN HE22 A 90 GLN HGx 1.0 1.8 4.62 384 291 A 90 GLN HGy A 57 GLN HE22 1.0 1.8 4.62 385 292 A 50 ARG H A 49 GLU HG3 1.0 1.8 5.15 386 293 A 61 ARG HD3 A 65 GLN H 1.0 1.8 4.87 387 294 A 61 ARG HD3 A 64 GLY HA2 1.0 1.8 4.59 388 295 A 61 ARG HD3 A 62 PHE HB2 1.0 1.8 5.94 389 296 A 56 ARG H A 55 MET HB3 1.0 1.8 5.08 390 297 A 67 ILE HA A 68 ASN HB3 1.0 1.8 5.48 391 298 A 21 LYS HE2 A 21 LYS H 1.0 1.8 5.57 392 299 A 62 PHE HB3 A 65 GLN HE21 1.0 1.8 4.77 393 300 A 60 PHE HB2 A 59 ARG HA 1.0 1.8 4.78 394 301 A 12 THR H A 11 LYS HEx 1.0 1.8 5.46 395 301 A 12 THR H A 11 LYS HEy 1.0 1.8 5.46 396 302 A 45 LYS H A 45 LYS HEx 1.0 1.8 5.77 397 302 A 45 LYS H A 45 LYS HEy 1.0 1.8 5.77 398 303 A 32 PHE HB2 A 20 LEU H 1.0 1.8 5.14 399 304 A 44 MET HA A 47 TYR HB3 1.0 1.8 4.71 400 305 A 51 GLN HE21 A 50 ARG HD3 1.0 1.8 4.49 401 306 A 36 ARG HD2 A 37 HIS HB3 1.0 1.8 5.72 402 307 A 60 PHE HB2 A 59 ARG HD2 1.0 1.8 6.00 403 308 A 55 MET HGy A 56 ARG HDx 1.0 1.8 4.90 404 308 A 55 MET HGx A 56 ARG HDx 1.0 1.8 4.90 405 308 A 56 ARG HDy A 55 MET HGx 1.0 1.8 4.90 406 308 A 55 MET HGy A 56 ARG HDy 1.0 1.8 4.90 407 309 A 57 GLN HB2 A 56 ARG HDx 1.0 1.8 4.92 408 309 A 57 GLN HB2 A 56 ARG HDy 1.0 1.8 4.92 409 310 A 59 ARG HD3 A 60 PHE H 1.0 1.8 4.56 410 311 A 47 TYR HD% A 44 MET HA 1.0 1.8 5.06 411 312 A 60 PHE HD% A 44 MET HA 1.0 1.8 5.30 412 313 A 74 ALA HB% A 37 HIS HB2 1.0 1.8 5.20 413 314 A 6 PRO HDx A 5 LYS HGx 1.0 1.8 4.81 414 314 A 5 LYS HGy A 6 PRO HDx 1.0 1.8 4.81 415 315 A 26 ASP HA A 27 GLY HA3 1.0 1.8 4.62 416 316 A 80 ASP HA A 81 GLU HA 1.0 1.8 4.59 417 317 A 81 GLU HA A 21 LYS HG2 1.0 1.8 4.60 418 318 A 55 MET HE% A 48 CYS HA 1.0 1.8 5.55 419 319 A 48 CYS HA A 51 GLN HGx 1.0 1.8 4.77 420 319 A 48 CYS HA A 51 GLN HGy 1.0 1.8 4.77 421 320 A 34 ILE HG2% A 40 LEU HA 1.0 1.8 4.89 422 321 A 5 LYS H A 6 PRO HDy 1.0 1.8 4.92 423 322 A 5 LYS HGy A 6 PRO HDy 1.0 1.8 4.81 424 322 A 5 LYS HGx A 6 PRO HDy 1.0 1.8 4.81 425 323 A 54 SER HBy A 56 ARG HB3 1.0 1.8 4.80 426 324 A 10 VAL HB A 9 GLY HAx 1.0 1.8 5.13 427 324 A 9 GLY HAy A 10 VAL HB 1.0 1.8 5.13 428 325 A 54 SER HBy A 55 MET HB2 1.0 1.8 4.54 429 326 A 62 PHE HD% A 63 ASP HA 1.0 1.8 4.31 430 327 A 38 THR HB A 34 ILE HB 1.0 1.8 5.11 431 328 A 38 THR HB A 35 LYS HB3 1.0 1.8 5.48 432 329 A 65 GLN HA A 64 GLY HA3 1.0 1.8 4.93 433 330 A 8 GLU HA A 10 VAL H 1.0 1.8 5.21 434 331 A 62 PHE HE% A 78 MET HA 1.0 1.8 4.99 435 332 A 77 GLU HA A 78 MET HA 1.0 1.8 4.71 436 333 A 13 GLU HA A 12 THR HG2% 1.0 1.8 4.89 437 334 A 78 MET HE% A 78 MET HA 1.0 1.8 5.16 438 335 A 56 ARG HA A 58 ILE H 1.0 1.8 4.37 439 336 A 55 MET HA A 54 SER HBx 1.0 1.8 6.00 440 337 A 56 ARG HA A 54 SER HBx 1.0 1.8 6.00 441 338 A 76 LEU HA A 78 MET HB3 1.0 1.8 5.50 442 339 A 83 THR HG2% A 85 ASP HA 1.0 1.8 4.63 443 340 A 84 ILE HA A 62 PHE HA 1.0 1.8 4.58 444 341 A 60 PHE HA A 86 VAL HB 1.0 1.8 4.91 445 342 A 60 PHE HA A 67 ILE HD1% 1.0 1.8 4.54 446 343 A 84 ILE HD1% A 62 PHE HA 1.0 1.8 4.51 447 344 A 38 THR HG2% A 40 LEU HA 1.0 1.8 3.74 448 345 A 88 GLN HG2 A 88 GLN HB3 1.0 1.8 2.40 449 346 A 55 MET HE% A 45 LYS HBx 1.0 1.8 3.52 450 346 A 45 LYS HBy A 55 MET HE% 1.0 1.8 3.52 451 347 A 43 LEU HDy% A 20 LEU HDx% 1.0 1.8 4.13 452 348 A 43 LEU H A 44 MET H 1.0 1.8 3.40 453 349 A 40 LEU HA A 43 LEU H 1.0 1.8 3.86 454 350 A 44 MET HA A 43 LEU H 1.0 1.8 5.13 455 351 A 43 LEU H A 42 LYS HBy 1.0 1.8 3.70 456 352 A 43 LEU HB3 A 43 LEU H 1.0 1.8 3.19 457 353 A 43 LEU H A 40 LEU HB3 1.0 1.8 5.50 458 354 A 43 LEU H A 43 LEU HG 1.0 1.8 3.63 459 355 A 43 LEU HDy% A 43 LEU H 1.0 1.8 4.00 460 356 A 43 LEU HDx% A 43 LEU H 1.0 1.8 4.19 461 357 A 70 THR H A 69 GLU H 1.0 1.8 3.68 462 358 A 70 THR H A 68 ASN HB3 1.0 1.8 3.68 463 359 A 70 THR H A 68 ASN HB2 1.0 1.8 3.83 464 360 A 70 THR H A 69 GLU HB3 1.0 1.8 4.30 465 361 A 58 ILE H A 57 GLN H 1.0 1.8 3.05 466 362 A 58 ILE H A 57 GLN HE21 1.0 1.8 5.17 467 363 A 58 ILE H A 59 ARG HA 1.0 1.8 5.30 468 364 A 88 GLN HA A 58 ILE H 1.0 1.8 5.66 469 365 A 58 ILE H A 57 GLN HA 1.0 1.8 3.53 470 366 A 58 ILE H A 55 MET HA 1.0 1.8 3.75 471 367 A 57 GLN HB2 A 58 ILE H 1.0 1.8 3.57 472 368 A 58 ILE H A 57 GLN HB3 1.0 1.8 3.73 473 369 A 58 ILE H A 59 ARG HG2 1.0 1.8 5.01 474 370 A 58 ILE HG12 A 58 ILE H 1.0 1.8 3.16 475 371 A 76 LEU H A 74 ALA HA 1.0 1.8 4.43 476 372 A 76 LEU H A 77 GLU HA 1.0 1.8 4.67 477 373 A 76 LEU H A 75 GLN HB2 1.0 1.8 3.60 478 374 A 76 LEU H A 76 LEU HG 1.0 1.8 3.25 479 375 A 72 THR H A 75 GLN H 1.0 1.8 4.88 480 376 A 72 THR H A 39 PRO HA 1.0 1.8 6.00 481 377 A 73 PRO HA A 72 THR H 1.0 1.8 6.00 482 378 A 72 THR H A 71 ASP HB2 1.0 1.8 4.77 483 379 A 72 THR H A 71 ASP HB3 1.0 1.8 3.88 484 380 A 72 THR H A 75 GLN HGx 1.0 1.8 4.04 485 380 A 72 THR H A 75 GLN HGy 1.0 1.8 4.04 486 381 A 38 THR HB A 38 THR H 1.0 1.8 3.25 487 382 A 37 HIS HB2 A 38 THR H 1.0 1.8 4.49 488 383 A 35 LYS HB3 A 38 THR H 1.0 1.8 3.95 489 384 A 38 THR HG2% A 38 THR H 1.0 1.8 3.57 490 385 A 46 ALA H A 47 TYR H 1.0 1.8 3.46 491 386 A 45 LYS H A 46 ALA H 1.0 1.8 3.35 492 387 A 43 LEU HA A 46 ALA H 1.0 1.8 4.00 493 388 A 55 MET HE% A 46 ALA H 1.0 1.8 4.87 494 389 A 46 ALA H A 45 LYS HBx 1.0 1.8 3.22 495 389 A 45 LYS HBy A 46 ALA H 1.0 1.8 3.22 496 390 A 46 ALA HB% A 46 ALA H 1.0 1.8 2.82 497 391 A 68 ASN H A 71 ASP H 1.0 1.8 4.16 498 392 A 69 GLU H A 71 ASP H 1.0 1.8 4.39 499 393 A 70 THR H A 71 ASP H 1.0 1.8 3.27 500 394 A 71 ASP H A 68 ASN HA 1.0 1.8 4.71 501 395 A 71 ASP H A 70 THR HB 1.0 1.8 4.52 502 396 A 69 GLU HA A 71 ASP H 1.0 1.8 4.28 503 397 A 71 ASP HB2 A 71 ASP H 1.0 1.8 3.30 504 398 A 68 ASN HB2 A 71 ASP H 1.0 1.8 3.84 505 399 A 71 ASP HB3 A 71 ASP H 1.0 1.8 3.50 506 400 A 77 GLU H A 75 GLN H 1.0 1.8 4.51 507 401 A 76 LEU H A 77 GLU H 1.0 1.8 3.47 508 402 A 77 GLU H A 75 GLN HA 1.0 1.8 3.83 509 403 A 77 GLU H A 76 LEU HB3 1.0 1.8 5.07 510 404 A 76 LEU HG A 77 GLU H 1.0 1.8 5.42 511 405 A 77 GLU H A 78 MET HB3 1.0 1.8 5.28 512 406 A 77 GLU H A 78 MET HG2 1.0 1.8 5.77 513 407 A 41 SER H A 42 LYS H 1.0 1.8 3.74 514 408 A 42 LYS H A 43 LEU H 1.0 1.8 3.54 515 409 A 43 LEU HA A 42 LYS H 1.0 1.8 5.49 516 410 A 42 LYS H A 42 LYS HEx 1.0 1.8 4.92 517 410 A 42 LYS HEy A 42 LYS H 1.0 1.8 4.92 518 411 A 42 LYS H A 39 PRO HG2 1.0 1.8 3.92 519 412 A 42 LYS H A 43 LEU HG 1.0 1.8 4.98 520 413 A 49 GLU H A 52 GLY H 1.0 1.8 4.97 521 414 A 53 LEU HA A 52 GLY H 1.0 1.8 5.49 522 415 A 52 GLY H A 52 GLY HAx 1.0 1.8 2.85 523 415 A 52 GLY HAy A 52 GLY H 1.0 1.8 2.85 524 416 A 51 GLN HB3 A 52 GLY H 1.0 1.8 4.32 525 417 A 52 GLY H A 51 GLN HGx 1.0 1.8 4.72 526 417 A 52 GLY H A 51 GLN HGy 1.0 1.8 4.72 527 418 A 52 GLY H A 51 GLN HB2 1.0 1.8 3.87 528 419 A 47 TYR HD% A 51 GLN H 1.0 1.8 4.99 529 420 A 51 GLN HE21 A 51 GLN H 1.0 1.8 4.74 530 421 A 51 GLN H A 51 GLN HGx 1.0 1.8 3.36 531 421 A 51 GLN H A 51 GLN HGy 1.0 1.8 3.36 532 422 A 51 GLN H A 51 GLN HB2 1.0 1.8 3.44 533 423 A 78 MET H A 79 GLU H 1.0 1.8 4.66 534 424 A 78 MET H A 74 ALA H 1.0 1.8 5.63 535 425 A 76 LEU H A 78 MET H 1.0 1.8 4.03 536 426 A 78 MET H A 74 ALA HA 1.0 1.8 4.17 537 427 A 78 MET H A 77 GLU HA 1.0 1.8 3.51 538 428 A 78 MET H A 78 MET HB2 1.0 1.8 3.62 539 429 A 78 MET H A 78 MET HB3 1.0 1.8 3.49 540 430 A 78 MET H A 78 MET HG2 1.0 1.8 3.81 541 431 A 86 VAL H A 23 ALA H 1.0 1.8 4.30 542 432 A 86 VAL H A 85 ASP H 1.0 1.8 4.48 543 433 A 60 PHE HD% A 86 VAL H 1.0 1.8 5.94 544 434 A 86 VAL H A 85 ASP HA 1.0 1.8 2.88 545 435 A 22 VAL HA A 86 VAL H 1.0 1.8 5.75 546 436 A 86 VAL H A 24 GLY HAy 1.0 1.8 4.23 547 437 A 86 VAL H A 24 GLY HAx 1.0 1.8 5.16 548 438 A 86 VAL H A 86 VAL HB 1.0 1.8 3.42 549 439 A 86 VAL H A 86 VAL HGy% 1.0 1.8 3.93 550 440 A 57 GLN H A 54 SER HBx 1.0 1.8 4.28 551 441 A 57 GLN HB2 A 57 GLN H 1.0 1.8 3.16 552 442 A 57 GLN H A 56 ARG HGx 1.0 1.8 3.85 553 442 A 56 ARG HGy A 57 GLN H 1.0 1.8 3.85 554 443 A 58 ILE HG12 A 57 GLN H 1.0 1.8 4.09 555 444 A 58 ILE HG2% A 57 GLN H 1.0 1.8 4.20 556 445 A 36 ARG H A 37 HIS H 1.0 1.8 4.00 557 446 A 38 THR H A 37 HIS H 1.0 1.8 3.39 558 447 A 37 HIS H A 35 LYS HA 1.0 1.8 4.45 559 448 A 37 HIS HB2 A 37 HIS H 1.0 1.8 3.77 560 449 A 36 ARG HD2 A 37 HIS H 1.0 1.8 4.90 561 450 A 37 HIS H A 35 LYS HDx 1.0 1.8 5.00 562 450 A 37 HIS H A 35 LYS HDy 1.0 1.8 5.00 563 451 A 36 ARG HB3 A 37 HIS H 1.0 1.8 5.28 564 452 A 36 ARG HB2 A 37 HIS H 1.0 1.8 4.47 565 453 A 74 ALA HB% A 37 HIS H 1.0 1.8 4.96 566 454 A 63 ASP H A 65 GLN H 1.0 1.8 4.53 567 455 A 62 PHE H A 65 GLN H 1.0 1.8 3.93 568 456 A 65 GLN H A 64 GLY H 1.0 1.8 3.47 569 457 A 65 GLN H A 65 GLN HE21 1.0 1.8 4.87 570 458 A 62 PHE HD% A 65 GLN H 1.0 1.8 5.13 571 459 A 65 GLN H A 66 PRO HA 1.0 1.8 5.62 572 460 A 65 GLN H A 66 PRO HD2 1.0 1.8 4.89 573 461 A 65 GLN H A 63 ASP HB2 1.0 1.8 4.22 574 462 A 65 GLN HGx A 65 GLN H 1.0 1.8 3.27 575 463 A 65 GLN HB3 A 65 GLN H 1.0 1.8 3.34 576 464 A 63 ASP HB3 A 65 GLN H 1.0 1.8 4.09 577 465 A 27 GLY H A 24 GLY H 1.0 1.8 4.54 578 466 A 27 GLY H A 25 GLN HGx 1.0 1.8 5.74 579 466 A 25 GLN HGy A 27 GLY H 1.0 1.8 5.74 580 467 A 62 PHE H A 67 ILE H 1.0 1.8 4.28 581 468 A 67 ILE H A 61 ARG HA 1.0 1.8 3.79 582 469 A 67 ILE H A 66 PRO HA 1.0 1.8 3.19 583 470 A 60 PHE HB2 A 67 ILE H 1.0 1.8 4.50 584 471 A 67 ILE H A 66 PRO HB2 1.0 1.8 3.80 585 472 A 67 ILE H A 66 PRO HB3 1.0 1.8 3.95 586 473 A 67 ILE HB A 67 ILE H 1.0 1.8 3.64 587 474 A 67 ILE H A 67 ILE HG13 1.0 1.8 3.59 588 475 A 67 ILE HD1% A 67 ILE H 1.0 1.8 3.87 589 476 A 10 VAL H A 9 GLY H 1.0 1.8 3.71 590 477 A 75 GLN H A 74 ALA H 1.0 1.8 4.24 591 478 A 50 ARG H A 51 GLN H 1.0 1.8 3.28 592 479 A 76 LEU H A 75 GLN H 1.0 1.8 3.33 593 480 A 10 VAL H A 9 GLY HAx 1.0 1.8 2.80 594 480 A 9 GLY HAy A 10 VAL H 1.0 1.8 2.80 595 481 A 77 GLU HA A 75 GLN H 1.0 1.8 5.80 596 482 A 75 GLN HB3 A 75 GLN H 1.0 1.8 3.56 597 483 A 74 ALA HB% A 75 GLN H 1.0 1.8 3.16 598 484 A 10 VAL H A 10 VAL HGx% 1.0 1.8 2.91 599 484 A 10 VAL HGy% A 10 VAL H 1.0 1.8 2.91 600 485 A 49 GLU H A 50 ARG H 1.0 1.8 3.32 601 486 A 50 ARG H A 46 ALA HA 1.0 1.8 4.09 602 487 A 50 ARG HD2 A 50 ARG H 1.0 1.8 4.30 603 488 A 2 ALA HB% A 2 ALA H 1.0 1.8 2.90 604 489 A 25 GLN H A 28 SER H 1.0 1.8 5.87 605 490 A 24 GLY H A 28 SER H 1.0 1.8 3.91 606 491 A 28 SER H A 26 ASP H 1.0 1.8 4.04 607 492 A 23 ALA HA A 28 SER H 1.0 1.8 5.62 608 493 A 26 ASP HA A 28 SER H 1.0 1.8 4.93 609 494 A 28 SER H A 28 SER HBy 1.0 1.8 3.71 610 495 A 68 ASN HB2 A 68 ASN HD22 1.0 1.8 3.50 611 496 A 81 GLU H A 82 ASP H 1.0 1.8 3.44 612 497 A 20 LEU H A 82 ASP H 1.0 1.8 5.78 613 498 A 82 ASP H A 20 LEU HA 1.0 1.8 4.34 614 499 A 80 ASP HA A 82 ASP H 1.0 1.8 3.84 615 500 A 82 ASP H A 82 ASP HBy 1.0 1.8 3.51 616 501 A 82 ASP H A 20 LEU HDy% 1.0 1.8 4.78 617 502 A 47 TYR HD% A 50 ARG H 1.0 1.8 5.50 618 503 A 53 LEU H A 51 GLN HA 1.0 1.8 5.03 619 504 A 50 ARG H A 51 GLN HGx 1.0 1.8 4.44 620 504 A 50 ARG H A 51 GLN HGy 1.0 1.8 4.44 621 505 A 56 ARG H A 55 MET H 1.0 1.8 3.57 622 506 A 56 ARG H A 57 GLN H 1.0 1.8 3.40 623 507 A 56 ARG H A 57 GLN HA 1.0 1.8 5.05 624 508 A 56 ARG H A 54 SER HBx 1.0 1.8 4.43 625 509 A 56 ARG H A 55 MET HGx 1.0 1.8 4.49 626 509 A 56 ARG H A 55 MET HGy 1.0 1.8 4.49 627 510 A 57 GLN HB2 A 56 ARG H 1.0 1.8 4.31 628 511 A 56 ARG H A 55 MET HB2 1.0 1.8 3.31 629 512 A 56 ARG H A 56 ARG HGx 1.0 1.8 3.16 630 512 A 56 ARG HGy A 56 ARG H 1.0 1.8 3.16 631 513 A 53 LEU H A 52 GLY H 1.0 1.8 3.19 632 514 A 53 LEU H A 52 GLY HAx 1.0 1.8 3.28 633 514 A 53 LEU H A 52 GLY HAy 1.0 1.8 3.28 634 515 A 53 LEU H A 48 CYS HA 1.0 1.8 3.51 635 516 A 53 LEU H A 53 LEU HB2 1.0 1.8 3.28 636 517 A 36 ARG HD2 A 36 ARG H 1.0 1.8 4.48 637 518 A 36 ARG H A 17 HIS HB2 1.0 1.8 5.20 638 519 A 36 ARG H A 37 HIS HB3 1.0 1.8 5.76 639 520 A 35 LYS HB3 A 36 ARG H 1.0 1.8 3.87 640 521 A 36 ARG HG3 A 36 ARG H 1.0 1.8 3.58 641 522 A 36 ARG HB2 A 36 ARG H 1.0 1.8 3.95 642 523 A 17 HIS H A 18 ILE H 1.0 1.8 4.51 643 524 A 18 ILE HG2% A 17 HIS H 1.0 1.8 4.71 644 525 A 3 ASP HA A 4 GLU H 1.0 1.8 3.56 645 526 A 2 ALA HB% A 4 GLU H 1.0 1.8 4.72 646 527 A 45 LYS H A 47 TYR H 1.0 1.8 4.82 647 528 A 3 ASP H A 2 ALA H 1.0 1.8 3.54 648 529 A 3 ASP H A 2 ALA HA 1.0 1.8 3.14 649 530 A 3 ASP H A 3 ASP HBx 1.0 1.8 3.64 650 531 A 45 LYS H A 45 LYS HBx 1.0 1.8 3.03 651 531 A 45 LYS HBy A 45 LYS H 1.0 1.8 3.03 652 532 A 44 MET H A 43 LEU HG 1.0 1.8 4.07 653 533 A 49 GLU H A 51 GLN H 1.0 1.8 4.18 654 534 A 49 GLU H A 49 GLU HG3 1.0 1.8 3.50 655 535 A 25 GLN H A 26 ASP H 1.0 1.8 3.63 656 536 A 27 GLY H A 26 ASP H 1.0 1.8 3.23 657 537 A 77 GLU H A 74 ALA H 1.0 1.8 5.34 658 538 A 76 LEU H A 74 ALA H 1.0 1.8 4.59 659 539 A 12 THR H A 11 LYS HA 1.0 1.8 2.94 660 540 A 74 ALA H A 72 THR HB 1.0 1.8 3.20 661 541 A 24 GLY HAx A 26 ASP H 1.0 1.8 3.60 662 542 A 12 THR H A 12 THR HG2% 1.0 1.8 3.64 663 543 A 74 ALA HB% A 74 ALA H 1.0 1.8 3.01 664 544 A 18 ILE HD1% A 74 ALA H 1.0 1.8 4.92 665 545 A 5 LYS H A 6 PRO HDx 1.0 1.8 4.92 666 546 A 5 LYS H A 4 GLU HBy 1.0 1.8 5.02 667 547 A 35 LYS H A 35 LYS HB2 1.0 1.8 3.64 668 548 A 5 LYS H A 5 LYS HGx 1.0 1.8 4.23 669 548 A 5 LYS HGy A 5 LYS H 1.0 1.8 4.23 670 549 A 88 GLN HG3 A 89 GLN H 1.0 1.8 4.35 671 550 A 88 GLN HB3 A 89 GLN H 1.0 1.8 4.18 672 551 A 16 ASP H A 16 ASP HBx 1.0 1.8 3.63 673 551 A 16 ASP H A 16 ASP HBy 1.0 1.8 3.63 674 552 A 40 LEU H A 41 SER H 1.0 1.8 3.76 675 553 A 41 SER H A 43 LEU H 1.0 1.8 4.91 676 554 A 41 SER H A 39 PRO HA 1.0 1.8 4.01 677 555 A 41 SER H A 39 PRO HB2 1.0 1.8 3.69 678 556 A 50 ARG H A 48 CYS H 1.0 1.8 4.74 679 557 A 48 CYS H A 48 CYS HBx 1.0 1.8 3.80 680 558 A 48 CYS H A 45 LYS HBx 1.0 1.8 5.21 681 558 A 45 LYS HBy A 48 CYS H 1.0 1.8 5.21 682 559 A 46 ALA HB% A 48 CYS H 1.0 1.8 4.87 683 560 A 84 ILE H A 83 THR H 1.0 1.8 4.72 684 561 A 83 THR H A 82 ASP H 1.0 1.8 4.64 685 562 A 83 THR H A 83 THR HB 1.0 1.8 3.58 686 563 A 83 THR H A 82 ASP HBy 1.0 1.8 4.38 687 564 A 83 THR HG2% A 83 THR H 1.0 1.8 4.01 688 565 A 79 GLU HA A 80 ASP H 1.0 1.8 3.06 689 566 A 80 ASP H A 80 ASP HBx 1.0 1.8 2.93 690 566 A 80 ASP HBy A 80 ASP H 1.0 1.8 2.93 691 567 A 59 ARG H A 58 ILE H 1.0 1.8 4.52 692 568 A 58 ILE HA A 59 ARG H 1.0 1.8 3.16 693 569 A 59 ARG H A 87 PHE HB3 1.0 1.8 5.89 694 570 A 58 ILE HB A 59 ARG H 1.0 1.8 3.47 695 571 A 59 ARG H A 59 ARG HG2 1.0 1.8 4.27 696 572 A 59 ARG H A 59 ARG HB3 1.0 1.8 3.97 697 573 A 7 LYS H A 6 PRO HB3 1.0 1.8 3.60 698 574 A 8 GLU H A 8 GLU HBx 1.0 1.8 3.19 699 574 A 8 GLU HBy A 8 GLU H 1.0 1.8 3.19 700 575 A 31 GLN H A 21 LYS HA 1.0 1.8 4.92 701 576 A 31 GLN H A 30 VAL HA 1.0 1.8 2.88 702 577 A 31 GLN H A 31 GLN HB3 1.0 1.8 3.86 703 578 A 13 GLU H A 12 THR HA 1.0 1.8 3.21 704 579 A 57 GLN H A 54 SER H 1.0 1.8 4.98 705 580 A 53 LEU HA A 54 SER H 1.0 1.8 3.08 706 581 A 57 GLN HA A 54 SER H 1.0 1.8 5.00 707 582 A 55 MET HA A 54 SER H 1.0 1.8 5.29 708 583 A 54 SER H A 54 SER HBy 1.0 1.8 3.70 709 584 A 54 SER H A 54 SER HBx 1.0 1.8 3.38 710 585 A 57 GLN HB2 A 54 SER H 1.0 1.8 4.07 711 586 A 58 ILE HG12 A 54 SER H 1.0 1.8 4.72 712 587 A 58 ILE HG2% A 54 SER H 1.0 1.8 4.41 713 588 A 12 THR H A 11 LYS H 1.0 1.8 4.73 714 589 A 11 LYS H A 10 VAL H 1.0 1.8 4.84 715 590 A 10 VAL HA A 11 LYS H 1.0 1.8 2.74 716 591 A 14 ASN H A 13 GLU HGx 1.0 1.8 4.72 717 591 A 13 GLU HGy A 14 ASN H 1.0 1.8 4.72 718 592 A 28 SER H A 29 VAL H 1.0 1.8 4.77 719 593 A 23 ALA HA A 29 VAL H 1.0 1.8 5.09 720 594 A 28 SER HA A 29 VAL H 1.0 1.8 2.87 721 595 A 30 VAL HB A 30 VAL H 1.0 1.8 3.57 722 596 A 23 ALA HB% A 30 VAL H 1.0 1.8 5.27 723 597 A 30 VAL H A 22 VAL HGx% 1.0 1.8 4.71 724 598 A 25 GLN H A 24 GLY H 1.0 1.8 4.69 725 599 A 23 ALA HA A 24 GLY H 1.0 1.8 3.01 726 600 A 29 VAL HA A 24 GLY H 1.0 1.8 4.06 727 601 A 21 LYS H A 20 LEU HA 1.0 1.8 3.27 728 602 A 15 ASN H A 15 ASN HBx 1.0 1.8 3.87 729 602 A 15 ASN HBy A 15 ASN H 1.0 1.8 3.87 730 603 A 21 LYS HB3 A 21 LYS H 1.0 1.8 3.92 731 604 A 20 LEU HB2 A 21 LYS H 1.0 1.8 4.22 732 605 A 20 LEU HB3 A 21 LYS H 1.0 1.8 3.56 733 606 A 21 LYS H A 20 LEU HDy% 1.0 1.8 4.83 734 607 A 21 LYS H A 20 LEU HDx% 1.0 1.8 4.83 735 608 A 87 PHE HD% A 88 GLN H 1.0 1.8 4.25 736 609 A 88 GLN H A 87 PHE HA 1.0 1.8 2.87 737 610 A 87 PHE HB3 A 88 GLN H 1.0 1.8 3.93 738 611 A 88 GLN HB3 A 88 GLN H 1.0 1.8 3.41 739 612 A 88 GLN HB2 A 88 GLN H 1.0 1.8 3.27 740 613 A 58 ILE HG2% A 88 GLN H 1.0 1.8 4.87 741 614 A 87 PHE H A 61 ARG H 1.0 1.8 5.66 742 615 A 87 PHE H A 59 ARG H 1.0 1.8 3.78 743 616 A 87 PHE H A 58 ILE HA 1.0 1.8 4.60 744 617 A 86 VAL HA A 87 PHE H 1.0 1.8 3.00 745 618 A 87 PHE H A 87 PHE HB2 1.0 1.8 3.97 746 619 A 87 PHE H A 87 PHE HB3 1.0 1.8 3.77 747 620 A 87 PHE H A 25 GLN HGx 1.0 1.8 5.23 748 620 A 87 PHE H A 25 GLN HGy 1.0 1.8 5.23 749 621 A 87 PHE H A 86 VAL HB 1.0 1.8 4.08 750 622 A 87 PHE H A 58 ILE HG2% 1.0 1.8 5.08 751 623 A 58 ILE H A 90 GLN H 1.0 1.8 5.93 752 624 A 88 GLN HA A 90 GLN H 1.0 1.8 4.42 753 625 A 88 GLN HG2 A 90 GLN H 1.0 1.8 4.04 754 626 A 90 GLN H A 90 GLN HBx 1.0 1.8 3.40 755 626 A 90 GLN HBy A 90 GLN H 1.0 1.8 3.40 756 627 A 63 ASP H A 64 GLY H 1.0 1.8 3.60 757 628 A 47 TYR H A 48 CYS H 1.0 1.8 3.59 758 629 A 48 CYS HA A 47 TYR H 1.0 1.8 5.51 759 630 A 43 LEU HA A 47 TYR H 1.0 1.8 4.56 760 631 A 47 TYR H A 47 TYR HB2 1.0 1.8 3.52 761 632 A 47 TYR HB3 A 47 TYR H 1.0 1.8 3.52 762 633 A 47 TYR H A 45 LYS HBx 1.0 1.8 4.71 763 633 A 45 LYS HBy A 47 TYR H 1.0 1.8 4.71 764 634 A 46 ALA HB% A 47 TYR H 1.0 1.8 3.32 765 635 A 43 LEU HDx% A 47 TYR H 1.0 1.8 4.55 766 636 A 19 ASN H A 80 ASP H 1.0 1.8 5.20 767 637 A 35 LYS H A 34 ILE H 1.0 1.8 4.76 768 638 A 20 LEU H A 19 ASN HBx 1.0 1.8 4.30 769 639 A 40 LEU H A 39 PRO HB2 1.0 1.8 4.17 770 640 A 34 ILE HB A 34 ILE H 1.0 1.8 4.14 771 641 A 19 ASN H A 18 ILE HB 1.0 1.8 3.45 772 642 A 34 ILE H A 34 ILE HG12 1.0 1.8 3.93 773 643 A 20 LEU HB2 A 20 LEU H 1.0 1.8 3.51 774 644 A 34 ILE HG2% A 34 ILE H 1.0 1.8 3.39 775 645 A 25 GLN H A 88 GLN H 1.0 1.8 5.36 776 646 A 62 PHE H A 62 PHE HD% 1.0 1.8 4.59 777 647 A 62 PHE H A 61 ARG HA 1.0 1.8 3.33 778 648 A 62 PHE H A 66 PRO HA 1.0 1.8 4.58 779 649 A 62 PHE H A 62 PHE HB3 1.0 1.8 3.96 780 650 A 25 GLN H A 25 GLN HGx 1.0 1.8 3.47 781 650 A 25 GLN HGy A 25 GLN H 1.0 1.8 3.47 782 651 A 25 GLN H A 25 GLN HBy 1.0 1.8 3.61 783 652 A 25 GLN H A 25 GLN HBx 1.0 1.8 3.61 784 653 A 62 PHE H A 61 ARG HB3 1.0 1.8 4.33 785 654 A 62 PHE H A 61 ARG HB2 1.0 1.8 4.14 786 655 A 25 GLN H A 86 VAL HGy% 1.0 1.8 5.69 787 656 A 19 ASN H A 81 GLU H 1.0 1.8 4.38 788 657 A 19 ASN H A 18 ILE HA 1.0 1.8 3.24 789 658 A 19 ASN H A 19 ASN HBy 1.0 1.8 3.80 790 659 A 55 MET H A 54 SER H 1.0 1.8 4.69 791 660 A 85 ASP H A 62 PHE HD% 1.0 1.8 4.60 792 661 A 60 PHE HD% A 85 ASP H 1.0 1.8 5.58 793 662 A 84 ILE HA A 85 ASP H 1.0 1.8 3.28 794 663 A 55 MET H A 54 SER HBx 1.0 1.8 4.54 795 664 A 85 ASP H A 85 ASP HBx 1.0 1.8 3.42 796 664 A 85 ASP H A 85 ASP HBy 1.0 1.8 3.42 797 665 A 55 MET H A 55 MET HB2 1.0 1.8 3.30 798 666 A 85 ASP H A 23 ALA HB% 1.0 1.8 6.00 799 667 A 85 ASP H A 67 ILE HG13 1.0 1.8 6.00 800 668 A 84 ILE HD1% A 85 ASP H 1.0 1.8 4.39 801 669 A 20 LEU H A 21 LYS H 1.0 1.8 4.55 802 670 A 20 LEU H A 19 ASN HA 1.0 1.8 3.22 803 671 A 40 LEU H A 72 THR HA 1.0 1.8 4.62 804 672 A 40 LEU H A 39 PRO HA 1.0 1.8 3.46 805 673 A 20 LEU H A 19 ASN HBy 1.0 1.8 4.30 806 674 A 61 ARG H A 60 PHE H 1.0 1.8 4.60 807 675 A 69 GLU H A 68 ASN HA 1.0 1.8 3.27 808 676 A 59 ARG HA A 60 PHE H 1.0 1.8 3.16 809 677 A 69 GLU H A 68 ASN HB2 1.0 1.8 3.61 810 678 A 69 GLU H A 69 GLU HB3 1.0 1.8 3.46 811 679 A 59 ARG HB2 A 60 PHE H 1.0 1.8 4.50 812 680 A 67 ILE HD1% A 60 PHE H 1.0 1.8 5.11 813 681 A 31 GLN H A 32 PHE H 1.0 1.8 4.66 814 682 A 32 PHE H A 32 PHE HE% 1.0 1.8 4.58 815 683 A 32 PHE H A 31 GLN HA 1.0 1.8 3.09 816 684 A 32 PHE HB2 A 32 PHE H 1.0 1.8 4.06 817 685 A 32 PHE H A 31 GLN HB3 1.0 1.8 4.11 818 686 A 32 PHE H A 21 LYS HDx 1.0 1.8 5.08 819 686 A 32 PHE H A 21 LYS HDy 1.0 1.8 5.08 820 687 A 32 PHE H A 21 LYS HG2 1.0 1.8 4.75 821 688 A 18 ILE H A 17 HIS HA 1.0 1.8 3.52 822 689 A 35 LYS HA A 18 ILE H 1.0 1.8 4.08 823 690 A 18 ILE H A 17 HIS HB3 1.0 1.8 4.15 824 691 A 18 ILE HB A 18 ILE H 1.0 1.8 4.14 825 692 A 18 ILE HD1% A 18 ILE H 1.0 1.8 4.64 826 693 A 22 VAL H A 30 VAL H 1.0 1.8 3.69 827 694 A 22 VAL H A 31 GLN HA 1.0 1.8 3.90 828 695 A 22 VAL H A 21 LYS HA 1.0 1.8 3.19 829 696 A 22 VAL HB A 22 VAL H 1.0 1.8 3.58 830 697 A 22 VAL H A 21 LYS HB3 1.0 1.8 4.03 831 698 A 83 THR HG2% A 22 VAL H 1.0 1.8 5.34 832 699 A 22 VAL H A 22 VAL HGy% 1.0 1.8 4.17 833 700 A 22 VAL H A 22 VAL HGx% 1.0 1.8 4.17 834 701 A 67 ILE HA A 68 ASN H 1.0 1.8 3.02 835 702 A 68 ASN HB3 A 68 ASN H 1.0 1.8 3.91 836 703 A 68 ASN HB2 A 68 ASN H 1.0 1.8 3.61 837 704 A 71 ASP HB3 A 68 ASN H 1.0 1.8 4.30 838 705 A 67 ILE HB A 68 ASN H 1.0 1.8 3.95 839 706 A 67 ILE HG2% A 68 ASN H 1.0 1.8 3.36 840 707 A 68 ASN H A 40 LEU HDy% 1.0 1.8 5.29 841 708 A 23 ALA H A 24 GLY H 1.0 1.8 4.56 842 709 A 22 VAL HA A 23 ALA H 1.0 1.8 3.26 843 710 A 23 ALA H A 22 VAL HB 1.0 1.8 4.59 844 711 A 23 ALA H A 22 VAL HGx% 1.0 1.8 4.21 845 712 A 79 GLU H A 80 ASP H 1.0 1.8 4.56 846 713 A 79 GLU H A 82 ASP H 1.0 1.8 5.27 847 714 A 79 GLU H A 78 MET HA 1.0 1.8 3.32 848 715 A 79 GLU H A 82 ASP HBy 1.0 1.8 4.97 849 716 A 79 GLU H A 82 ASP HBx 1.0 1.8 4.97 850 717 A 78 MET HG3 A 79 GLU H 1.0 1.8 3.68 851 718 A 79 GLU H A 78 MET HB2 1.0 1.8 3.49 852 719 A 79 GLU H A 78 MET HB3 1.0 1.8 4.41 853 720 A 79 GLU H A 78 MET HG2 1.0 1.8 4.75 854 721 A 18 ILE HD1% A 79 GLU H 1.0 1.8 5.07 855 722 A 84 ILE H A 23 ALA H 1.0 1.8 4.32 856 723 A 84 ILE H A 85 ASP H 1.0 1.8 4.77 857 724 A 84 ILE H A 83 THR HA 1.0 1.8 3.42 858 725 A 22 VAL HA A 84 ILE H 1.0 1.8 4.15 859 726 A 84 ILE H A 84 ILE HB 1.0 1.8 3.81 860 727 A 84 ILE H A 84 ILE HG13 1.0 1.8 4.14 861 728 A 84 ILE H A 84 ILE HG12 1.0 1.8 4.06 862 729 A 84 ILE H A 22 VAL HGx% 1.0 1.8 4.79 863 730 A 62 PHE H A 63 ASP H 1.0 1.8 4.57 864 731 A 63 ASP H A 62 PHE HA 1.0 1.8 3.32 865 732 A 84 ILE HA A 63 ASP H 1.0 1.8 5.51 866 733 A 63 ASP H A 62 PHE HB2 1.0 1.8 4.50 867 734 A 63 ASP H A 63 ASP HB2 1.0 1.8 4.18 868 735 A 81 GLU H A 80 ASP H 1.0 1.8 4.91 869 736 A 81 GLU H A 20 LEU HA 1.0 1.8 4.89 870 737 A 80 ASP HA A 81 GLU H 1.0 1.8 3.47 871 738 A 81 GLU H A 80 ASP HBx 1.0 1.8 3.81 872 738 A 80 ASP HBy A 81 GLU H 1.0 1.8 3.81 873 739 A 81 GLU H A 81 GLU HBy 1.0 1.8 4.20 874 740 A 81 GLU H A 81 GLU HGy 1.0 1.8 4.12 875 741 A 18 ILE HB A 81 GLU H 1.0 1.8 4.77 876 742 A 61 ARG H A 85 ASP H 1.0 1.8 3.84 877 743 A 60 PHE HD% A 61 ARG H 1.0 1.8 4.15 878 744 A 60 PHE HA A 61 ARG H 1.0 1.8 3.20 879 745 A 86 VAL HA A 61 ARG H 1.0 1.8 4.10 880 746 A 61 ARG H A 60 PHE HB2 1.0 1.8 4.29 881 747 A 61 ARG H A 61 ARG HB3 1.0 1.8 3.95 882 748 A 84 ILE HG2% A 61 ARG H 1.0 1.8 3.85 883 749 A 57 GLN HE22 A 56 ARG HE 1.0 1.8 5.30 884 750 A 57 GLN H A 57 GLN HE21 1.0 1.8 4.00 885 751 A 14 ASN HD22 A 13 GLU HBx 1.0 1.8 5.54 886 751 A 13 GLU HBy A 14 ASN HD22 1.0 1.8 5.54 887 752 A 57 GLN HE21 A 56 ARG HGx 1.0 1.8 4.98 888 752 A 56 ARG HGy A 57 GLN HE21 1.0 1.8 4.98 889 753 A 63 ASP HB3 A 65 GLN HE21 1.0 1.8 4.93 890 754 A 25 GLN HE2y A 25 GLN HGx 1.0 1.8 3.54 891 754 A 25 GLN HGy A 25 GLN HE2y 1.0 1.8 3.54 892 755 A 24 GLY H A 25 GLN HE2x 1.0 1.8 6.00 893 756 A 88 GLN H A 25 GLN HE2x 1.0 1.8 6.00 894 757 A 25 GLN HE2x A 25 GLN HGx 1.0 1.8 3.54 895 757 A 25 GLN HGy A 25 GLN HE2x 1.0 1.8 3.54 896 758 A 31 GLN H A 31 GLN HE21 1.0 1.8 4.65 897 759 A 57 GLN H A 57 GLN HE22 1.0 1.8 4.20 898 760 A 31 GLN HB3 A 31 GLN HE21 1.0 1.8 4.67 899 761 A 31 GLN HE21 A 21 LYS HDx 1.0 1.8 4.77 900 761 A 21 LYS HDy A 31 GLN HE21 1.0 1.8 4.77 901 762 A 31 GLN HE21 A 29 VAL HGx% 1.0 1.8 5.00 902 763 A 31 GLN H A 31 GLN HE22 1.0 1.8 4.80 903 764 A 89 GLN HE22 A 89 GLN HGx 1.0 1.8 3.53 904 764 A 89 GLN HGy A 89 GLN HE22 1.0 1.8 3.53 905 765 A 29 VAL HB A 31 GLN HE22 1.0 1.8 5.55 906 766 A 31 GLN HB3 A 31 GLN HE22 1.0 1.8 5.33 907 767 A 51 GLN HB2 A 51 GLN HE22 1.0 1.8 5.24 908 768 A 30 VAL HGy% A 51 GLN HE22 1.0 1.8 4.23 909 769 A 58 ILE HG2% A 88 GLN HE2y 1.0 1.8 4.57 910 770 A 36 ARG HB2 A 36 ARG HE 1.0 1.8 4.67 911 771 A 18 ILE HG2% A 18 ILE H 1.0 1.8 3.64 912 772 A 18 ILE H A 18 ILE HG13 1.0 1.8 4.11 913 773 A 67 ILE HG2% A 71 ASP H 1.0 1.8 4.62 914 774 A 76 LEU HG A 75 GLN H 1.0 1.8 4.58 915 775 A 18 ILE HD1% A 80 ASP H 1.0 1.8 4.39 916 776 A 7 LYS H A 6 PRO HA 1.0 1.8 2.78 917 777 A 31 GLN HG3 A 31 GLN HE22 1.0 1.8 3.47 918 778 A 15 ASN H A 14 ASN HD21 1.0 1.8 5.78 919 779 A 23 ALA H A 85 ASP HBx 1.0 1.8 6.00 920 779 A 23 ALA H A 85 ASP HBy 1.0 1.8 6.00 921 780 A 23 ALA H A 83 THR HB 1.0 1.8 6.00 922 781 A 60 PHE HD% A 23 ALA H 1.0 1.8 5.77 923 782 A 47 TYR HE% A 22 VAL H 1.0 1.8 5.38 924 783 A 36 ARG H A 36 ARG HE 1.0 1.8 5.73 925 784 A 63 ASP H A 64 GLY HA2 1.0 1.8 5.15 926 785 A 63 ASP H A 65 GLN HGy 1.0 1.8 5.61 927 786 A 63 ASP H A 76 LEU HB3 1.0 1.8 6.00 928 787 A 78 MET HE% A 63 ASP H 1.0 1.8 5.63 929 788 A 67 ILE HD1% A 63 ASP H 1.0 1.8 5.43 930 789 A 28 SER HA A 24 GLY H 1.0 1.8 5.10 931 790 A 24 GLY H A 26 ASP H 1.0 1.8 5.18 932 791 A 22 VAL H A 21 LYS HE3 1.0 1.8 5.83 933 792 A 23 ALA HB% A 28 SER H 1.0 1.8 5.70 934 793 A 30 VAL H A 21 LYS HDx 1.0 1.8 6.00 935 793 A 21 LYS HDy A 30 VAL H 1.0 1.8 6.00 936 794 A 30 VAL H A 32 PHE HE% 1.0 1.8 5.09 937 795 A 20 LEU HB2 A 32 PHE H 1.0 1.8 4.74 938 796 A 36 ARG H A 18 ILE H 1.0 1.8 5.07 939 797 A 42 LYS H A 40 LEU HB3 1.0 1.8 5.80 940 798 A 40 LEU H A 42 LYS H 1.0 1.8 5.21 941 799 A 40 LEU H A 43 LEU H 1.0 1.8 6.00 942 800 A 43 LEU H A 42 LYS HEx 1.0 1.8 5.56 943 800 A 42 LYS HEy A 43 LEU H 1.0 1.8 5.56 944 801 A 49 GLU HG3 A 46 ALA H 1.0 1.8 5.22 945 802 A 30 VAL HGy% A 47 TYR H 1.0 1.8 5.64 946 803 A 58 ILE HG12 A 56 ARG H 1.0 1.8 5.16 947 804 A 58 ILE HG2% A 56 ARG H 1.0 1.8 5.66 948 805 A 56 ARG H A 54 SER H 1.0 1.8 5.10 949 806 A 58 ILE H A 55 MET HGx 1.0 1.8 5.99 950 806 A 58 ILE H A 55 MET HGy 1.0 1.8 5.99 951 807 A 58 ILE H A 54 SER HBy 1.0 1.8 5.84 952 808 A 58 ILE H A 54 SER HBx 1.0 1.8 5.30 953 809 A 60 PHE HE% A 58 ILE H 1.0 1.8 5.98 954 810 A 59 ARG H A 89 GLN HE21 1.0 1.8 6.00 955 811 A 59 ARG H A 87 PHE HB2 1.0 1.8 5.38 956 812 A 87 PHE H A 60 PHE H 1.0 1.8 5.17 957 813 A 61 ARG H A 86 VAL HGy% 1.0 1.8 5.45 958 814 A 62 PHE H A 65 GLN HE21 1.0 1.8 5.89 959 815 A 76 LEU H A 75 GLN HGx 1.0 1.8 4.57 960 815 A 76 LEU H A 75 GLN HGy 1.0 1.8 4.57 961 816 A 79 GLU H A 82 ASP HA 1.0 1.8 5.17 962 817 A 21 LYS H A 81 GLU H 1.0 1.8 5.65 963 818 A 84 ILE H A 21 LYS HE3 1.0 1.8 5.81 964 819 A 84 ILE H A 85 ASP HBx 1.0 1.8 6.00 965 819 A 84 ILE H A 85 ASP HBy 1.0 1.8 6.00 966 820 A 84 ILE H A 62 PHE HD% 1.0 1.8 5.72 967 821 A 31 GLN HE22 A 21 LYS HDx 1.0 1.8 4.82 968 821 A 21 LYS HDy A 31 GLN HE22 1.0 1.8 4.82 969 822 A 21 LYS HG2 A 31 GLN HE22 1.0 1.8 5.99 970 823 A 55 MET HE% A 45 LYS H 1.0 1.8 3.21 971 824 A 41 SER H A 39 PRO HB3 1.0 1.8 4.22 972 825 A 83 THR H A 82 ASP HA 1.0 1.8 3.13 973 826 A 46 ALA HB% A 32 PHE HE% 1.0 1.8 3.25 974 827 A 30 VAL HB A 22 VAL H 1.0 1.8 4.24 975 828 A 51 GLN HE22 A 50 ARG HGx 1.0 1.8 4.41 976 828 A 50 ARG HGy A 51 GLN HE22 1.0 1.8 4.41 977 829 A 47 TYR HD% A 30 VAL HB 1.0 1.8 3.46 978 830 A 58 ILE HB A 87 PHE H 1.0 1.8 4.48 979 831 A 61 ARG HB3 A 64 GLY H 1.0 1.8 5.59 980 832 A 86 VAL H A 85 ASP HBx 1.0 1.8 3.83 981 832 A 86 VAL H A 85 ASP HBy 1.0 1.8 3.83 982 833 A 58 ILE HG12 A 59 ARG H 1.0 1.8 4.04 983 834 A 4 GLU H A 4 GLU HGx 1.0 1.8 4.62 984 834 A 4 GLU H A 4 GLU HGy 1.0 1.8 4.62 985 835 A 75 GLN HB2 A 72 THR H 1.0 1.8 3.53 986 836 A 22 VAL H A 21 LYS HB2 1.0 1.8 4.37 987 837 A 56 ARG HB3 A 57 GLN HE21 1.0 1.8 5.37 988 838 A 47 TYR HE% A 53 LEU HB3 1.0 1.8 5.16 989 839 A 2 ALA H A 1 MET HGx 1.0 1.8 3.85 990 840 A 51 GLN HB3 A 51 GLN H 1.0 1.8 3.63 991 841 A 47 TYR HD% A 22 VAL HB 1.0 1.8 4.13 992 842 A 60 PHE HD% A 22 VAL HB 1.0 1.8 4.32 993 843 A 23 ALA HB% A 24 GLY H 1.0 1.8 3.17 994 844 A 65 GLN H A 65 GLN HB2 1.0 1.8 3.65 995 845 A 70 THR H A 69 GLU HB2 1.0 1.8 5.31 996 846 A 20 LEU HB3 A 20 LEU H 1.0 1.8 4.14 997 847 A 70 THR HG2% A 69 GLU H 1.0 1.8 4.46 998 848 A 32 PHE HD% A 46 ALA HB% 1.0 1.8 4.09 999 849 A 60 PHE HD% A 44 MET HBx 1.0 1.8 4.50 1000 849 A 60 PHE HD% A 44 MET HBy 1.0 1.8 4.50 1001 850 A 76 LEU HG A 65 GLN HE21 1.0 1.8 4.79 1002 851 A 75 GLN HE2y A 75 GLN HGx 1.0 1.8 3.54 1003 851 A 75 GLN HGy A 75 GLN HE2y 1.0 1.8 3.54 1004 852 A 88 GLN HB2 A 88 GLN HE2y 1.0 1.8 4.95 1005 853 A 45 LYS H A 45 LYS HGx 1.0 1.8 3.33 1006 854 A 36 ARG HG3 A 37 HIS H 1.0 1.8 3.83 1007 855 A 79 GLU H A 79 GLU HG2 1.0 1.8 4.21 1008 856 A 13 GLU H A 12 THR HG2% 1.0 1.8 3.84 1009 857 A 88 GLN HB2 A 89 GLN H 1.0 1.8 4.71 1010 858 A 6 PRO HB3 A 8 GLU H 1.0 1.8 4.40 1011 859 A 21 LYS H A 21 LYS HB2 1.0 1.8 3.32 1012 860 A 29 VAL HB A 29 VAL H 1.0 1.8 3.78 1013 861 A 8 GLU H A 8 GLU HGx 1.0 1.8 3.73 1014 861 A 8 GLU HGy A 8 GLU H 1.0 1.8 3.73 1015 862 A 78 MET H A 77 GLU HGx 1.0 1.8 4.52 1016 862 A 78 MET H A 77 GLU HGy 1.0 1.8 4.52 1017 863 A 78 MET H A 78 MET HG3 1.0 1.8 4.74 1018 864 A 53 LEU H A 51 GLN HB2 1.0 1.8 3.92 1019 865 A 53 LEU H A 53 LEU HG 1.0 1.8 4.31 1020 866 A 74 ALA H A 73 PRO HG2 1.0 1.8 4.47 1021 867 A 73 PRO HG3 A 74 ALA H 1.0 1.8 4.62 1022 868 A 78 MET HG3 A 62 PHE HE% 1.0 1.8 5.13 1023 869 A 78 MET HG3 A 62 PHE HZ 1.0 1.8 5.43 1024 870 A 51 GLN H A 50 ARG HGx 1.0 1.8 3.91 1025 870 A 50 ARG HGy A 51 GLN H 1.0 1.8 3.91 1026 871 A 43 LEU H A 43 LEU HB2 1.0 1.8 4.19 1027 872 A 87 PHE HD% A 59 ARG HB3 1.0 1.8 4.67 1028 873 A 60 PHE H A 59 ARG HB3 1.0 1.8 4.13 1029 874 A 36 ARG H A 73 PRO HG2 1.0 1.8 4.99 1030 875 A 19 ASN H A 18 ILE HG13 1.0 1.8 4.67 1031 876 A 34 ILE HG13 A 34 ILE H 1.0 1.8 5.08 1032 877 A 43 LEU HB3 A 32 PHE HE% 1.0 1.8 5.28 1033 878 A 61 ARG HG3 A 87 PHE HZ 1.0 1.8 5.51 1034 879 A 40 LEU H A 40 LEU HG 1.0 1.8 4.09 1035 880 A 42 LYS HG3 A 41 SER H 1.0 1.8 4.92 1036 881 A 69 GLU H A 69 GLU HB2 1.0 1.8 4.05 1037 882 A 21 LYS H A 21 LYS HDx 1.0 1.8 4.82 1038 882 A 21 LYS HDy A 21 LYS H 1.0 1.8 4.82 1039 883 A 31 GLN H A 21 LYS HB3 1.0 1.8 5.44 1040 884 A 59 ARG H A 59 ARG HG3 1.0 1.8 5.82 1041 885 A 62 PHE HD% A 76 LEU HB2 1.0 1.8 4.15 1042 886 A 32 PHE H A 31 GLN HG2 1.0 1.8 5.14 1043 887 A 61 ARG HG3 A 64 GLY H 1.0 1.8 4.75 1044 888 A 63 ASP HB3 A 64 GLY H 1.0 1.8 5.03 1045 889 A 57 GLN HG3 A 54 SER H 1.0 1.8 4.88 1046 890 A 35 LYS HB3 A 37 HIS H 1.0 1.8 3.80 1047 891 A 69 GLU H A 69 GLU HGx 1.0 1.8 4.14 1048 892 A 21 LYS HG3 A 22 VAL H 1.0 1.8 5.39 1049 893 A 11 LYS H A 11 LYS HGx 1.0 1.8 4.00 1050 893 A 11 LYS H A 11 LYS HGy 1.0 1.8 4.00 1051 894 A 54 SER H A 53 LEU HB2 1.0 1.8 4.41 1052 895 A 51 GLN HB2 A 48 CYS H 1.0 1.8 4.75 1053 896 A 73 PRO HG3 A 38 THR H 1.0 1.8 5.24 1054 897 A 58 ILE HB A 89 GLN H 1.0 1.8 4.77 1055 898 A 38 THR HG2% A 36 ARG H 1.0 1.8 5.67 1056 899 A 5 LYS H A 4 GLU HGx 1.0 1.8 5.02 1057 899 A 5 LYS H A 4 GLU HGy 1.0 1.8 5.02 1058 900 A 18 ILE HB A 82 ASP H 1.0 1.8 5.83 1059 901 A 46 ALA H A 45 LYS HGy 1.0 1.8 5.27 1060 902 A 76 LEU HB2 A 65 GLN HE21 1.0 1.8 5.86 1061 903 A 40 LEU HB2 A 40 LEU H 1.0 1.8 4.04 1062 904 A 31 GLN HG3 A 22 VAL H 1.0 1.8 4.87 1063 905 A 53 LEU HB3 A 88 GLN HE2x 1.0 1.8 4.81 1064 906 A 46 ALA HB% A 50 ARG H 1.0 1.8 4.68 1065 907 A 88 GLN H A 89 GLN HGx 1.0 1.8 6.00 1066 907 A 89 GLN HGy A 88 GLN H 1.0 1.8 6.00 1067 908 A 59 ARG HB3 A 87 PHE HZ 1.0 1.8 4.94 1068 909 A 60 PHE HE% A 84 ILE HB 1.0 1.8 4.90 1069 910 A 21 LYS HG3 A 82 ASP H 1.0 1.8 5.31 1070 911 A 59 ARG HG3 A 89 GLN HE21 1.0 1.8 5.13 1071 912 A 81 GLU H A 79 GLU HG2 1.0 1.8 6.00 1072 913 A 62 PHE HD% A 63 ASP H 1.0 1.8 3.45 1073 914 A 79 GLU H A 62 PHE HZ 1.0 1.8 3.98 1074 915 A 83 THR HG2% A 23 ALA H 1.0 1.8 3.63 1075 916 A 58 ILE HG2% A 89 GLN H 1.0 1.8 5.03 1076 917 A 84 ILE HG2% A 23 ALA H 1.0 1.8 4.27 1077 918 A 68 ASN H A 40 LEU HDx% 1.0 1.8 5.29 1078 919 A 67 ILE HD1% A 68 ASN H 1.0 1.8 5.00 1079 920 A 23 ALA H A 22 VAL HGy% 1.0 1.8 4.21 1080 921 A 87 PHE H A 58 ILE HD1% 1.0 1.8 4.92 1081 922 A 19 ASN H A 18 ILE HG2% 1.0 1.8 3.69 1082 923 A 84 ILE HD1% A 23 ALA H 1.0 1.8 5.62 1083 924 A 76 LEU HDx% A 78 MET H 1.0 1.8 4.34 1084 925 A 47 TYR H A 22 VAL HGy% 1.0 1.8 6.00 1085 926 A 58 ILE HG2% A 59 ARG H 1.0 1.8 3.75 1086 927 A 30 VAL HGx% A 32 PHE HE% 1.0 1.8 3.53 1087 928 A 76 LEU HDx% A 77 GLU H 1.0 1.8 4.03 1088 929 A 58 ILE HD1% A 58 ILE H 1.0 1.8 3.99 1089 930 A 88 GLN HE2x A 53 LEU HDx% 1.0 1.8 4.04 1090 931 A 62 PHE HD% A 76 LEU HDy% 1.0 1.8 3.49 1091 932 A 62 PHE HD% A 76 LEU HDx% 1.0 1.8 3.62 1092 933 A 62 PHE H A 67 ILE HG12 1.0 1.8 3.71 1093 934 A 54 SER H A 53 LEU HDy% 1.0 1.8 4.88 1094 935 A 47 TYR HE% A 22 VAL HGy% 1.0 1.8 4.50 1095 936 A 60 PHE HE% A 22 VAL HGy% 1.0 1.8 4.31 1096 937 A 60 PHE HD% A 67 ILE HG2% 1.0 1.8 4.70 1097 938 A 30 VAL HGx% A 22 VAL H 1.0 1.8 5.45 1098 939 A 22 VAL H A 84 ILE HG12 1.0 1.8 5.90 1099 940 A 58 ILE HD1% A 88 GLN HE2x 1.0 1.8 4.90 1100 941 A 34 ILE HG2% A 42 LYS H 1.0 1.8 5.17 1101 942 A 9 GLY H A 10 VAL HGx% 1.0 1.8 4.55 1102 942 A 10 VAL HGy% A 9 GLY H 1.0 1.8 4.55 1103 943 A 58 ILE HD1% A 53 LEU H 1.0 1.8 4.84 1104 944 A 67 ILE HG2% A 70 THR H 1.0 1.8 5.51 1105 945 A 84 ILE HD1% A 22 VAL H 1.0 1.8 6.00 1106 946 A 58 ILE HD1% A 88 GLN HE2y 1.0 1.8 5.18 1107 947 A 84 ILE HD1% A 61 ARG H 1.0 1.8 5.42 1108 948 A 61 ARG H A 86 VAL HGx% 1.0 1.8 5.45 1109 949 A 18 ILE HD1% A 81 GLU H 1.0 1.8 5.01 1110 950 A 17 HIS HB2 A 18 ILE H 1.0 1.8 4.32 1111 951 A 69 GLU H A 68 ASN HB3 1.0 1.8 3.82 1112 952 A 55 MET H A 55 MET HB3 1.0 1.8 3.86 1113 953 A 81 GLU H A 19 ASN HA 1.0 1.8 5.72 1114 954 A 84 ILE H A 22 VAL H 1.0 1.8 5.61 1115 955 A 60 PHE HD% A 60 PHE H 1.0 1.8 3.40 1116 956 A 47 TYR HD% A 47 TYR H 1.0 1.8 4.11 1117 957 A 32 PHE H A 21 LYS H 1.0 1.8 5.50 1118 958 A 70 THR H A 68 ASN H 1.0 1.8 4.64 1119 959 A 22 VAL H A 32 PHE HE% 1.0 1.8 4.25 1120 960 A 60 PHE HE% A 60 PHE H 1.0 1.8 4.42 1121 961 A 23 ALA H A 83 THR HA 1.0 1.8 5.52 1122 962 A 68 ASN H A 68 ASN HD22 1.0 1.8 4.25 1123 963 A 67 ILE H A 68 ASN H 1.0 1.8 4.65 1124 964 A 68 ASN H A 68 ASN HD21 1.0 1.8 4.38 1125 965 A 19 ASN H A 19 ASN HBx 1.0 1.8 3.80 1126 966 A 31 GLN H A 22 VAL H 1.0 1.8 5.34 1127 967 A 40 LEU H A 72 THR H 1.0 1.8 5.90 1128 968 A 30 VAL HA A 22 VAL H 1.0 1.8 5.53 1129 969 A 34 ILE H A 17 HIS HD2 1.0 1.8 4.40 1130 970 A 18 ILE H A 17 HIS HD2 1.0 1.8 4.20 1131 971 A 55 MET H A 57 GLN H 1.0 1.8 4.58 1132 972 A 60 PHE H A 59 ARG HD2 1.0 1.8 4.75 1133 973 A 55 MET H A 54 SER HBy 1.0 1.8 3.96 1134 974 A 69 GLU H A 69 GLU HGy 1.0 1.8 4.14 1135 975 A 19 ASN H A 19 ASN HD21 1.0 1.8 5.17 1136 976 A 62 PHE H A 64 GLY H 1.0 1.8 4.83 1137 977 A 50 ARG HD3 A 47 TYR H 1.0 1.8 6.00 1138 978 A 47 TYR H A 32 PHE HZ 1.0 1.8 4.53 1139 979 A 60 PHE HZ A 47 TYR H 1.0 1.8 4.90 1140 980 A 25 GLN HA A 28 SER H 1.0 1.8 6.00 1141 981 A 60 PHE HE% A 47 TYR HA 1.0 1.8 5.65 1142 982 A 45 LYS HA A 47 TYR H 1.0 1.8 4.77 1143 983 A 47 TYR HE% A 47 TYR HA 1.0 1.8 4.94 1144 984 A 60 PHE HZ A 45 LYS HA 1.0 1.8 5.17 1145 985 A 65 GLN HE21 A 66 PRO HD2 1.0 1.8 6.00 1146 986 A 29 VAL H A 28 SER HBx 1.0 1.8 4.32 1147 987 A 81 GLU HA A 21 LYS H 1.0 1.8 5.20 1148 988 A 57 GLN H A 54 SER HBy 1.0 1.8 4.22 1149 989 A 42 LYS HA A 46 ALA H 1.0 1.8 4.73 1150 990 A 72 THR H A 73 PRO HDx 1.0 1.8 4.92 1151 990 A 72 THR H A 73 PRO HDy 1.0 1.8 4.92 1152 991 A 27 GLY H A 28 SER HBx 1.0 1.8 5.38 1153 992 A 41 SER HA A 44 MET H 1.0 1.8 3.79 1154 993 A 41 SER HA A 45 LYS H 1.0 1.8 4.26 1155 994 A 45 LYS HA A 48 CYS H 1.0 1.8 3.98 1156 995 A 41 SER H A 73 PRO HDx 1.0 1.8 5.46 1157 995 A 41 SER H A 73 PRO HDy 1.0 1.8 5.46 1158 996 A 42 LYS H A 39 PRO HA 1.0 1.8 5.91 1159 997 A 73 PRO HA A 77 GLU H 1.0 1.8 6.00 1160 998 A 77 GLU H A 78 MET HA 1.0 1.8 6.00 1161 999 A 40 LEU HA A 42 LYS H 1.0 1.8 3.93 1162 1000 A 52 GLY H A 48 CYS HA 1.0 1.8 4.46 1163 1001 A 74 ALA H A 73 PRO HDx 1.0 1.8 4.75 1164 1001 A 74 ALA H A 73 PRO HDy 1.0 1.8 4.75 1165 1002 A 13 GLU HA A 15 ASN H 1.0 1.8 5.37 1166 1003 A 27 GLY HA2 A 24 GLY H 1.0 1.8 5.70 1167 1004 A 27 GLY H A 28 SER HA 1.0 1.8 5.45 1168 1005 A 62 PHE HD% A 64 GLY H 1.0 1.8 5.20 1169 1006 A 15 ASN H A 14 ASN HBy 1.0 1.8 4.70 1170 1007 A 21 LYS H A 21 LYS HE3 1.0 1.8 5.15 1171 1008 A 64 GLY H A 63 ASP HB2 1.0 1.8 4.65 1172 1009 A 59 ARG H A 59 ARG HD2 1.0 1.8 5.32 1173 1010 A 17 HIS HB2 A 17 HIS H 1.0 1.8 3.83 1174 1011 A 62 PHE HB3 A 65 GLN H 1.0 1.8 5.86 1175 1012 A 67 ILE H A 62 PHE HB3 1.0 1.8 6.00 1176 1013 A 61 ARG HD3 A 64 GLY H 1.0 1.8 4.89 1177 1014 A 82 ASP H A 21 LYS HE3 1.0 1.8 5.40 1178 1015 A 83 THR H A 21 LYS HE2 1.0 1.8 6.00 1179 1016 A 47 TYR HB3 A 48 CYS H 1.0 1.8 4.52 1180 1017 A 88 GLN HG2 A 88 GLN H 1.0 1.8 4.74 1181 1018 A 88 GLN HG3 A 88 GLN H 1.0 1.8 4.53 1182 1019 A 88 GLN HG3 A 90 GLN H 1.0 1.8 5.19 1183 1020 A 53 LEU H A 54 SER H 1.0 1.8 4.57 1184 1021 A 21 LYS H A 82 ASP H 1.0 1.8 4.28 1185 1022 A 92 GLY H A 93 GLY H 1.0 1.8 4.63 1186 1023 A 60 PHE HZ A 48 CYS H 1.0 1.8 4.21 1187 1024 A 30 VAL H A 32 PHE HZ 1.0 1.8 4.97 1188 1025 A 87 PHE H A 86 VAL H 1.0 1.8 4.52 1189 1026 A 54 SER H A 57 GLN HE21 1.0 1.8 5.66 1190 1027 A 88 GLN H A 88 GLN HE2y 1.0 1.8 5.32 1191 1028 A 88 GLN H A 87 PHE HB2 1.0 1.8 3.48 1192 1029 A 87 PHE H A 85 ASP HBx 1.0 1.8 5.83 1193 1029 A 87 PHE H A 85 ASP HBy 1.0 1.8 5.83 1194 1030 A 84 ILE HD1% A 21 LYS H 1.0 1.8 5.39 1195 1031 A 23 ALA H A 30 VAL H 1.0 1.8 6.00 1196 1032 A 47 TYR HE% A 30 VAL H 1.0 1.8 4.33 1197 1033 A 30 VAL HGy% A 30 VAL H 1.0 1.8 3.29 1198 1034 A 31 GLN H A 30 VAL HGy% 1.0 1.8 4.18 1199 1035 A 57 GLN HG2 A 54 SER H 1.0 1.8 5.31 1200 1036 A 59 ARG H A 59 ARG HD3 1.0 1.8 4.99 1201 1037 A 35 LYS H A 37 HIS H 1.0 1.8 4.83 1202 1038 A 46 ALA H A 48 CYS H 1.0 1.8 4.53 1203 1039 A 60 PHE HE% A 48 CYS H 1.0 1.8 4.57 1204 1040 A 57 GLN HA A 89 GLN H 1.0 1.8 4.21 1205 1041 A 88 GLN HG2 A 89 GLN H 1.0 1.8 4.95 1206 1042 A 5 LYS H A 3 ASP HA 1.0 1.8 5.63 1207 1043 A 26 ASP H A 25 GLN HGx 1.0 1.8 4.13 1208 1043 A 25 GLN HGy A 26 ASP H 1.0 1.8 4.13 1209 1044 A 36 ARG H A 38 THR H 1.0 1.8 5.14 1210 1045 A 57 GLN H A 55 MET HGx 1.0 1.8 5.58 1211 1045 A 55 MET HGy A 57 GLN H 1.0 1.8 5.58 1212 1046 A 58 ILE H A 56 ARG H 1.0 1.8 4.01 1213 1047 A 70 THR H A 68 ASN HD22 1.0 1.8 5.47 1214 1048 A 71 ASP H A 68 ASN HD22 1.0 1.8 5.01 1215 1049 A 82 ASP H A 19 ASN HA 1.0 1.8 6.00 1216 1050 A 84 ILE HG2% A 67 ILE H 1.0 1.8 5.18 1217 1051 A 86 VAL H A 24 GLY H 1.0 1.8 5.33 1218 1052 A 60 PHE HA A 67 ILE H 1.0 1.8 5.14 1219 1053 A 47 TYR HE% A 51 GLN H 1.0 1.8 5.85 1220 1054 A 51 GLN H A 50 ARG HD3 1.0 1.8 5.15 1221 1055 A 50 ARG HD2 A 51 GLN H 1.0 1.8 5.14 1222 1056 A 61 ARG HD3 A 87 PHE HE% 1.0 1.8 5.17 1223 1057 A 68 ASN HB3 A 71 ASP H 1.0 1.8 4.82 1224 1058 A 70 THR H A 71 ASP HB2 1.0 1.8 4.21 1225 1059 A 47 TYR HD% A 48 CYS HBy 1.0 1.8 4.85 1226 1060 A 47 TYR HD% A 50 ARG HD3 1.0 1.8 5.14 1227 1061 A 62 PHE HD% A 63 ASP HB2 1.0 1.8 4.04 1228 1062 A 50 ARG HD3 A 51 GLN HE22 1.0 1.8 5.54 1229 1063 A 47 TYR HD% A 48 CYS HBx 1.0 1.8 4.85 1230 1064 A 47 TYR HD% A 50 ARG HD2 1.0 1.8 5.59 1231 1065 A 50 ARG HD3 A 32 PHE HE% 1.0 1.8 4.87 1232 1066 A 50 ARG HD3 A 32 PHE HZ 1.0 1.8 5.25 1233 1067 A 47 TYR HE% A 50 ARG HD3 1.0 1.8 6.00 1234 1068 A 37 HIS HB3 A 36 ARG HE 1.0 1.8 5.00 1235 1069 A 88 GLN H A 25 GLN HE2y 1.0 1.8 6.00 1236 1070 A 24 GLY H A 25 GLN HE2y 1.0 1.8 6.00 1237 1071 A 84 ILE HD1% A 62 PHE HD% 1.0 1.8 4.50 1238 1072 A 72 THR H A 40 LEU HDy% 1.0 1.8 5.39 1239 1073 A 70 THR HG2% A 71 ASP H 1.0 1.8 4.28 1240 1074 A 74 ALA HB% A 36 ARG HE 1.0 1.8 4.98 1241 1075 A 59 ARG H A 88 GLN HE2y 1.0 1.8 6.00 1242 1076 A 62 PHE HD% A 83 THR H 1.0 1.8 5.36 1243 1077 A 83 THR H A 62 PHE HZ 1.0 1.8 5.89 1244 1078 A 58 ILE HG13 A 60 PHE HZ 1.0 1.8 4.83 1245 1079 A 62 PHE HD% A 78 MET HE% 1.0 1.8 3.31 1246 1080 A 78 MET HE% A 62 PHE HZ 1.0 1.8 3.55 1247 1081 A 54 SER HBy A 56 ARG HE 1.0 1.8 5.31 1248 1082 A 47 TYR HD% A 48 CYS HA 1.0 1.8 4.01 1249 1083 A 32 PHE HD% A 20 LEU H 1.0 1.8 5.17 1250 1084 A 54 SER H A 57 GLN HE22 1.0 1.8 6.00 1251 1085 A 60 PHE HE% A 59 ARG H 1.0 1.8 5.33 1252 1086 A 31 GLN H A 32 PHE HE% 1.0 1.8 5.13 1253 1087 A 31 GLN H A 32 PHE HZ 1.0 1.8 5.73 1254 1088 A 61 ARG HE A 62 PHE HA 1.0 1.8 6.00 1255 1089 A 60 PHE HA A 87 PHE HZ 1.0 1.8 6.00 1256 1090 A 55 MET HB2 A 56 ARG HE 1.0 1.8 6.00 1257 1091 A 47 TYR HD% A 30 VAL H 1.0 1.8 5.01 1258 1092 A 60 PHE HZ A 47 TYR HE% 1.0 1.8 4.04 1259 1093 A 43 LEU HDy% A 32 PHE HE% 1.0 1.8 4.40 1260 1094 A 60 PHE HD% A 58 ILE HG12 1.0 1.8 6.00 1261 1095 A 47 TYR HD% A 48 CYS H 1.0 1.8 3.81 1262 1096 A 47 TYR HD% A 49 GLU H 1.0 1.8 5.09 1263 1097 A 47 TYR HD% A 51 GLN HA 1.0 1.8 6.00 1264 1098 A 47 TYR HD% A 45 LYS HA 1.0 1.8 5.83 1265 1099 A 47 TYR HD% A 30 VAL HGy% 1.0 1.8 3.36 1266 1100 A 60 PHE HE% A 55 MET HE% 1.0 1.8 3.61 1267 1101 A 47 TYR HE% A 22 VAL HB 1.0 1.8 4.90 1268 1102 A 51 GLN HB3 A 47 TYR HE% 1.0 1.8 5.19 1269 1103 A 47 TYR HE% A 29 VAL HB 1.0 1.8 6.00 1270 1104 A 88 GLN HB2 A 88 GLN HE2x 1.0 1.8 5.09 1271 1105 A 68 ASN HD21 A 70 THR HA 1.0 1.8 6.00 1272 1106 A 60 PHE HE% A 47 TYR H 1.0 1.8 4.95 1273 1107 A 47 TYR HE% A 30 VAL HA 1.0 1.8 5.36 1274 1108 A 60 PHE HE% A 58 ILE HG12 1.0 1.8 4.85 1275 1109 A 60 PHE HE% A 84 ILE HD1% 1.0 1.8 5.68 1276 1110 A 51 GLN H A 51 GLN HE22 1.0 1.8 5.55 1277 1111 A 58 ILE HG13 A 47 TYR HE% 1.0 1.8 4.97 1278 1112 A 59 ARG H A 47 TYR HE% 1.0 1.8 6.00 1279 1113 A 47 TYR HE% A 48 CYS H 1.0 1.8 5.21 1280 1114 A 86 VAL H A 47 TYR HE% 1.0 1.8 6.00 1281 1115 A 58 ILE HG2% A 47 TYR HE% 1.0 1.8 4.29 1282 1116 A 17 HIS H A 17 HIS HD2 1.0 1.8 4.96 1283 1117 A 34 ILE H A 19 ASN HA 1.0 1.8 4.58 1284 1118 A 85 ASP H A 61 ARG HA 1.0 1.8 5.20 1285 1119 A 22 VAL HA A 85 ASP H 1.0 1.8 5.54 1286 1120 A 62 PHE H A 65 GLN HA 1.0 1.8 5.87 1287 1121 A 18 ILE H A 19 ASN HA 1.0 1.8 6.00 1288 1122 A 32 PHE H A 19 ASN HA 1.0 1.8 6.00 1289 1123 A 62 PHE HA A 64 GLY H 1.0 1.8 4.44 1290 1124 A 61 ARG HA A 64 GLY H 1.0 1.8 5.55 1291 1125 A 36 ARG HA A 74 ALA H 1.0 1.8 4.21 1292 1126 A 10 VAL HA A 9 GLY H 1.0 1.8 5.33 1293 1127 A 38 THR HB A 36 ARG H 1.0 1.8 5.57 1294 1128 A 60 PHE HA A 87 PHE H 1.0 1.8 4.25 1295 1129 A 29 VAL HA A 28 SER H 1.0 1.8 5.69 1296 1130 A 17 HIS H A 16 ASP HA 1.0 1.8 3.05 1297 1131 A 8 GLU HA A 9 GLY H 1.0 1.8 2.65 1298 1132 A 59 ARG H A 59 ARG HA 1.0 1.8 2.92 1299 1133 A 35 LYS H A 38 THR HB 1.0 1.8 3.50 1300 1134 A 56 ARG H A 54 SER HBy 1.0 1.8 3.51 1301 1135 A 92 GLY H A 91 THR HA 1.0 1.8 3.48 1302 1136 A 12 THR H A 12 THR HB 1.0 1.8 3.70 1303 1137 A 28 SER H A 28 SER HBx 1.0 1.8 3.71 1304 1138 A 46 ALA HA A 48 CYS H 1.0 1.8 4.78 1305 1139 A 53 LEU H A 49 GLU HA 1.0 1.8 4.84 1306 1140 A 19 ASN HA A 19 ASN HD21 1.0 1.8 4.97 1307 1141 A 84 ILE HA A 85 ASP HA 1.0 1.8 6.00 1308 1142 A 19 ASN HA A 18 ILE HG13 1.0 1.8 5.53 1309 1143 A 83 THR HG2% A 83 THR HA 1.0 1.8 3.22 1310 1144 A 67 ILE HD1% A 62 PHE HA 1.0 1.8 4.69 1311 1145 A 84 ILE HD1% A 83 THR HA 1.0 1.8 5.06 1312 1146 A 19 ASN HA A 20 LEU HDx% 1.0 1.8 4.98 1313 1147 A 72 THR HA A 40 LEU HDx% 1.0 1.8 4.50 1314 1148 A 18 ILE HD1% A 19 ASN HA 1.0 1.8 5.83 1315 1149 A 62 PHE HD% A 62 PHE HA 1.0 1.8 2.99 1316 1150 A 19 ASN HA A 17 HIS HD2 1.0 1.8 5.28 1317 1151 A 61 ARG HD2 A 61 ARG HA 1.0 1.8 4.36 1318 1152 A 19 ASN HA A 80 ASP HBx 1.0 1.8 5.60 1319 1152 A 80 ASP HBy A 19 ASN HA 1.0 1.8 5.60 1320 1153 A 60 PHE HB3 A 61 ARG HA 1.0 1.8 5.41 1321 1154 A 83 THR HA A 21 LYS HE3 1.0 1.8 4.98 1322 1155 A 62 PHE HB3 A 61 ARG HA 1.0 1.8 4.84 1323 1156 A 61 ARG HD3 A 62 PHE HA 1.0 1.8 5.31 1324 1157 A 61 ARG HD3 A 61 ARG HA 1.0 1.8 4.60 1325 1158 A 23 ALA HA A 29 VAL HGy% 1.0 1.8 4.01 1326 1159 A 84 ILE HG2% A 60 PHE HA 1.0 1.8 3.54 1327 1160 A 65 GLN H A 62 PHE HA 1.0 1.8 4.89 1328 1161 A 65 GLN H A 61 ARG HA 1.0 1.8 5.56 1329 1162 A 24 GLY HAx A 23 ALA HA 1.0 1.8 4.53 1330 1163 A 60 PHE HA A 87 PHE HE% 1.0 1.8 4.73 1331 1164 A 60 PHE HD% A 60 PHE HA 1.0 1.8 3.48 1332 1165 A 60 PHE HE% A 60 PHE HA 1.0 1.8 4.76 1333 1166 A 31 GLN HA A 32 PHE HZ 1.0 1.8 5.74 1334 1167 A 31 GLN HA A 32 PHE HE% 1.0 1.8 4.07 1335 1168 A 60 PHE HA A 60 PHE HZ 1.0 1.8 6.00 1336 1169 A 31 GLN HG3 A 31 GLN HA 1.0 1.8 3.88 1337 1170 A 31 GLN HA A 31 GLN HG2 1.0 1.8 3.84 1338 1171 A 61 ARG HA A 66 PRO HB2 1.0 1.8 5.10 1339 1172 A 30 VAL HA A 31 GLN HA 1.0 1.8 5.00 1340 1173 A 31 GLN HA A 31 GLN HE22 1.0 1.8 5.12 1341 1174 A 65 GLN H A 63 ASP HA 1.0 1.8 4.53 1342 1175 A 52 GLY H A 50 ARG HA 1.0 1.8 4.80 1343 1176 A 38 THR HB A 37 HIS H 1.0 1.8 4.37 1344 1177 A 76 LEU HA A 78 MET H 1.0 1.8 4.95 1345 1178 A 84 ILE HA A 62 PHE HD% 1.0 1.8 3.49 1346 1179 A 62 PHE HZ A 78 MET HA 1.0 1.8 3.39 1347 1180 A 63 ASP HA A 62 PHE HE% 1.0 1.8 5.12 1348 1181 A 81 GLU HA A 20 LEU HA 1.0 1.8 4.69 1349 1182 A 20 LEU HA A 21 LYS HE3 1.0 1.8 6.00 1350 1183 A 71 ASP HB2 A 72 THR HA 1.0 1.8 6.00 1351 1184 A 18 ILE HD1% A 20 LEU HA 1.0 1.8 5.12 1352 1185 A 29 VAL HA A 31 GLN HE22 1.0 1.8 5.67 1353 1186 A 39 PRO HA A 72 THR HA 1.0 1.8 4.45 1354 1187 A 71 ASP HB3 A 72 THR HA 1.0 1.8 5.50 1355 1188 A 72 THR HA A 75 GLN HGx 1.0 1.8 6.00 1356 1188 A 75 GLN HGy A 72 THR HA 1.0 1.8 6.00 1357 1189 A 60 PHE HD% A 59 ARG HA 1.0 1.8 3.32 1358 1190 A 47 TYR HD% A 47 TYR HA 1.0 1.8 3.13 1359 1191 A 47 TYR HD% A 30 VAL HA 1.0 1.8 5.02 1360 1192 A 57 GLN HE22 A 54 SER HBy 1.0 1.8 5.37 1361 1193 A 61 ARG HD3 A 64 GLY HA3 1.0 1.8 4.85 1362 1194 A 44 MET HA A 41 SER HA 1.0 1.8 5.06 1363 1195 A 50 ARG HD2 A 47 TYR HA 1.0 1.8 3.83 1364 1196 A 45 LYS HA A 45 LYS HEx 1.0 1.8 4.19 1365 1196 A 45 LYS HA A 45 LYS HEy 1.0 1.8 4.19 1366 1197 A 56 ARG HA A 56 ARG HDx 1.0 1.8 3.79 1367 1197 A 56 ARG HA A 56 ARG HDy 1.0 1.8 3.79 1368 1198 A 47 TYR HA A 50 ARG HD3 1.0 1.8 3.75 1369 1199 A 55 MET HA A 55 MET HGx 1.0 1.8 3.68 1370 1199 A 55 MET HA A 55 MET HGy 1.0 1.8 3.68 1371 1200 A 1 MET HA A 1 MET HGy 1.0 1.8 4.25 1372 1201 A 46 ALA HA A 47 TYR HB3 1.0 1.8 5.96 1373 1202 A 47 TYR HB3 A 48 CYS HA 1.0 1.8 5.41 1374 1203 A 50 ARG HD2 A 46 ALA HA 1.0 1.8 5.53 1375 1204 A 29 VAL HA A 28 SER HA 1.0 1.8 5.15 1376 1205 A 29 VAL HA A 30 VAL HA 1.0 1.8 5.71 1377 1206 A 58 ILE HA A 89 GLN HA 1.0 1.8 5.86 1378 1207 A 65 GLN HA A 65 GLN HGy 1.0 1.8 3.99 1379 1208 A 59 ARG HA A 59 ARG HD2 1.0 1.8 3.43 1380 1209 A 58 ILE HG2% A 55 MET HA 1.0 1.8 4.85 1381 1210 A 18 ILE HA A 19 ASN HA 1.0 1.8 5.01 1382 1211 A 30 VAL HA A 31 GLN HE22 1.0 1.8 3.95 1383 1212 A 38 THR H A 73 PRO HDx 1.0 1.8 4.00 1384 1212 A 38 THR H A 73 PRO HDy 1.0 1.8 4.00 1385 1213 A 76 LEU H A 73 PRO HA 1.0 1.8 4.06 1386 1214 A 23 ALA HA A 24 GLY HAy 1.0 1.8 5.20 1387 1215 A 24 GLY HAy A 86 VAL HGy% 1.0 1.8 5.86 1388 1216 A 57 GLN HA A 57 GLN HE21 1.0 1.8 4.49 1389 1217 A 70 THR H A 70 THR HB 1.0 1.8 4.09 1390 1218 A 57 GLN HA A 57 GLN HE22 1.0 1.8 4.73 1391 1219 A 56 ARG HA A 57 GLN HE22 1.0 1.8 5.84 1392 1220 A 57 GLN HE22 A 90 GLN HA 1.0 1.8 6.00 1393 1221 A 57 GLN HA A 90 GLN H 1.0 1.8 4.21 1394 1222 A 67 ILE HA A 40 LEU HDx% 1.0 1.8 5.76 1395 1223 A 51 GLN HA A 51 GLN HE22 1.0 1.8 4.16 1396 1224 A 90 GLN H A 89 GLN HA 1.0 1.8 3.15 1397 1225 A 47 TYR HA A 32 PHE HE% 1.0 1.8 4.11 1398 1226 A 30 VAL HA A 32 PHE HE% 1.0 1.8 4.96 1399 1227 A 61 ARG HE A 64 GLY HA3 1.0 1.8 5.40 1400 1228 A 51 GLN HA A 47 TYR HE% 1.0 1.8 5.91 1401 1229 A 55 MET HA A 59 ARG HD3 1.0 1.8 5.90 1402 1230 A 30 VAL HGy% A 30 VAL HA 1.0 1.8 3.01 1403 1231 A 60 PHE HE% A 55 MET HA 1.0 1.8 5.09 1404 1232 A 89 GLN HE21 A 89 GLN HA 1.0 1.8 5.33 1405 1233 A 63 ASP HA A 64 GLY H 1.0 1.8 3.56 1406 1234 A 30 VAL HGy% A 47 TYR HA 1.0 1.8 4.27 1407 1235 A 21 LYS HE2 A 81 GLU HA 1.0 1.8 4.38 1408 1236 A 51 GLN HE21 A 47 TYR HA 1.0 1.8 5.76 1409 1237 A 50 ARG HA A 51 GLN HE21 1.0 1.8 6.00 1410 1238 A 29 VAL H A 28 SER HBy 1.0 1.8 4.32 1411 1239 A 63 ASP HA A 62 PHE HA 1.0 1.8 4.43 1412 1240 A 69 GLU H A 41 SER HA 1.0 1.8 6.00 1413 1241 A 19 ASN H A 81 GLU HA 1.0 1.8 5.83 1414 1242 A 51 GLN HE21 A 52 GLY HAx 1.0 1.8 5.94 1415 1242 A 52 GLY HAy A 51 GLN HE21 1.0 1.8 5.94 1416 1243 A 49 GLU HA A 52 GLY HAx 1.0 1.8 4.75 1417 1243 A 52 GLY HAy A 49 GLU HA 1.0 1.8 4.75 1418 1244 A 81 GLU HA A 80 ASP HBx 1.0 1.8 4.43 1419 1244 A 80 ASP HBy A 81 GLU HA 1.0 1.8 4.43 1420 1245 A 60 PHE HE% A 48 CYS HA 1.0 1.8 5.35 1421 1246 A 47 TYR HE% A 24 GLY HAx 1.0 1.8 4.82 1422 1247 A 47 TYR HE% A 48 CYS HA 1.0 1.8 5.06 1423 1248 A 48 CYS HA A 47 TYR HB2 1.0 1.8 5.62 1424 1249 A 87 PHE HE% A 61 ARG HB2 1.0 1.8 3.71 1425 1250 A 87 PHE HE% A 61 ARG HG3 1.0 1.8 3.77 1426 1251 A 87 PHE HE% A 85 ASP HBx 1.0 1.8 4.04 1427 1251 A 85 ASP HBy A 87 PHE HE% 1.0 1.8 4.04 1428 1252 A 32 PHE HD% A 43 LEU HA 1.0 1.8 4.61 1429 1253 A 84 ILE HG2% A 60 PHE HD% 1.0 1.8 2.97 1430 1254 A 59 ARG HB2 A 87 PHE HE% 1.0 1.8 4.10 1431 1255 A 61 ARG HB3 A 87 PHE HE% 1.0 1.8 4.22 1432 1256 A 60 PHE HD% A 58 ILE HG13 1.0 1.8 4.02 1433 1257 A 43 LEU H A 42 LYS HBx 1.0 1.8 3.70 1434 1258 A 60 PHE HD% A 86 VAL HGx% 1.0 1.8 4.74 1435 1259 A 47 TYR HD% A 51 GLN HGx 1.0 1.8 3.43 1436 1259 A 47 TYR HD% A 51 GLN HGy 1.0 1.8 3.43 1437 1260 A 60 PHE HD% A 84 ILE HB 1.0 1.8 3.57 1438 1261 A 14 ASN HD21 A 13 GLU HBx 1.0 1.8 4.52 1439 1261 A 13 GLU HBy A 14 ASN HD21 1.0 1.8 4.52 1440 1262 A 87 PHE HE% A 61 ARG HG2 1.0 1.8 4.74 1441 1263 A 36 ARG HA A 38 THR H 1.0 1.8 4.94 1442 1264 A 36 ARG HA A 36 ARG HD3 1.0 1.8 5.71 1443 1265 A 44 MET HA A 43 LEU HA 1.0 1.8 6.00 1444 1266 A 43 LEU HA A 47 TYR HB2 1.0 1.8 6.00 1445 1267 A 43 LEU HA A 47 TYR HB3 1.0 1.8 6.00 1446 1268 A 36 ARG HA A 36 ARG HE 1.0 1.8 6.00 1447 1269 A 43 LEU HA A 32 PHE HZ 1.0 1.8 5.12 1448 1270 A 43 LEU HA A 32 PHE HE% 1.0 1.8 4.27 1449 1271 A 43 LEU HA A 46 ALA HA 1.0 1.8 5.29 1450 1272 A 45 LYS HA A 55 MET HGx 1.0 1.8 4.39 1451 1272 A 45 LYS HA A 55 MET HGy 1.0 1.8 4.39 1452 1273 A 49 GLU HA A 49 GLU HG3 1.0 1.8 3.64 1453 1274 A 62 PHE HB3 A 63 ASP HA 1.0 1.8 5.60 1454 1275 A 42 LYS HG3 A 42 LYS HA 1.0 1.8 3.28 1455 1276 A 54 SER HBy A 55 MET HGx 1.0 1.8 5.30 1456 1276 A 55 MET HGy A 54 SER HBy 1.0 1.8 5.30 1457 1277 A 49 GLU HG2 A 49 GLU HA 1.0 1.8 3.21 1458 1278 A 75 GLN HA A 75 GLN HGx 1.0 1.8 3.04 1459 1278 A 75 GLN HGy A 75 GLN HA 1.0 1.8 3.04 1460 1279 A 64 GLY HA2 A 63 ASP HA 1.0 1.8 4.98 1461 1280 A 38 THR HG2% A 39 PRO HD2 1.0 1.8 3.30 1462 1281 A 36 ARG HB2 A 74 ALA HA 1.0 1.8 4.39 1463 1282 A 74 ALA HA A 78 MET HG2 1.0 1.8 4.99 1464 1283 A 21 LYS HG3 A 81 GLU HA 1.0 1.8 4.67 1465 1284 A 47 TYR HA A 50 ARG HGx 1.0 1.8 3.12 1466 1284 A 50 ARG HGy A 47 TYR HA 1.0 1.8 3.12 1467 1285 A 81 GLU HA A 19 ASN HBy 1.0 1.8 5.26 1468 1286 A 74 ALA HB% A 75 GLN HA 1.0 1.8 3.98 1469 1287 A 69 GLU HA A 69 GLU HGy 1.0 1.8 4.25 1470 1288 A 45 LYS HA A 44 MET HBx 1.0 1.8 4.32 1471 1288 A 45 LYS HA A 44 MET HBy 1.0 1.8 4.32 1472 1289 A 45 LYS HA A 45 LYS HDx 1.0 1.8 4.55 1473 1289 A 45 LYS HDy A 45 LYS HA 1.0 1.8 4.55 1474 1290 A 69 GLU HB3 A 69 GLU HA 1.0 1.8 3.00 1475 1291 A 18 ILE HD1% A 73 PRO HA 1.0 1.8 4.71 1476 1292 A 57 GLN HG2 A 54 SER HBx 1.0 1.8 3.89 1477 1293 A 34 ILE HD1% A 40 LEU HA 1.0 1.8 3.55 1478 1294 A 44 MET HA A 45 LYS HA 1.0 1.8 4.99 1479 1295 A 48 CYS HA A 51 GLN HB2 1.0 1.8 3.43 1480 1296 A 38 THR HB A 35 LYS HDx 1.0 1.8 4.28 1481 1296 A 38 THR HB A 35 LYS HDy 1.0 1.8 4.28 1482 1297 A 57 GLN HG2 A 54 SER HBy 1.0 1.8 4.75 1483 1298 A 58 ILE HG13 A 55 MET HA 1.0 1.8 4.30 1484 1299 A 38 THR HB A 37 HIS HB2 1.0 1.8 6.00 1485 1300 A 38 THR HB A 37 HIS HB3 1.0 1.8 4.86 1486 1301 A 52 GLY HAy A 53 LEU HDx% 1.0 1.8 5.02 1487 1301 A 53 LEU HDx% A 52 GLY HAx 1.0 1.8 5.02 1488 1302 A 51 GLN HA A 50 ARG HD3 1.0 1.8 6.00 1489 1303 A 12 THR HA A 10 VAL HGx% 1.0 1.8 5.49 1490 1303 A 10 VAL HGy% A 12 THR HA 1.0 1.8 5.49 1491 1304 A 46 ALA HA A 47 TYR HB2 1.0 1.8 6.00 1492 1305 A 78 MET HE% A 73 PRO HDx 1.0 1.8 5.83 1493 1305 A 78 MET HE% A 73 PRO HDy 1.0 1.8 5.83 1494 1306 A 61 ARG HD2 A 64 GLY HA2 1.0 1.8 4.77 1495 1307 A 64 GLY HA2 A 63 ASP HB2 1.0 1.8 6.00 1496 1308 A 64 GLY HA2 A 61 ARG HG2 1.0 1.8 5.52 1497 1309 A 50 ARG HD2 A 47 TYR H 1.0 1.8 5.10 1498 1310 A 3 ASP H A 3 ASP HBy 1.0 1.8 3.64 1499 1311 A 5 LYS H A 5 LYS HBx 1.0 1.8 3.20 1500 1311 A 5 LYS H A 5 LYS HBy 1.0 1.8 3.20 1501 1312 A 92 GLY H A 91 THR HG2% 1.0 1.8 4.50 1502 1313 A 26 ASP H A 26 ASP HBx 1.0 1.8 3.63 1503 1314 A 8 GLU H A 7 LYS HGx 1.0 1.8 4.25 1504 1314 A 7 LYS HGy A 8 GLU H 1.0 1.8 4.25 1505 1315 A 35 LYS H A 35 LYS HGy 1.0 1.8 4.07 1506 1316 A 8 GLU H A 6 PRO HB2 1.0 1.8 3.26 1507 1317 A 35 LYS H A 34 ILE HB 1.0 1.8 3.16 1508 1318 A 7 LYS H A 7 LYS HGx 1.0 1.8 3.45 1509 1318 A 7 LYS HGy A 7 LYS H 1.0 1.8 3.45 1510 1319 A 54 SER H A 53 LEU HB3 1.0 1.8 3.84 1511 1320 A 35 LYS H A 35 LYS HGx 1.0 1.8 4.07 1512 1321 A 26 ASP H A 26 ASP HBy 1.0 1.8 3.63 1513 1322 A 73 PRO HB2 A 74 ALA H 1.0 1.8 3.27 1514 1323 A 13 GLU H A 13 GLU HGx 1.0 1.8 3.63 1515 1323 A 13 GLU HGy A 13 GLU H 1.0 1.8 3.63 1516 1324 A 57 GLN HB3 A 54 SER H 1.0 1.8 3.78 1517 1325 A 8 GLU H A 6 PRO HGx 1.0 1.8 3.74 1518 1325 A 6 PRO HGy A 8 GLU H 1.0 1.8 3.74 1519 1326 A 79 GLU HG3 A 80 ASP H 1.0 1.8 3.82 1520 1327 A 49 GLU H A 49 GLU HB2 1.0 1.8 3.36 1521 1328 A 7 LYS H A 6 PRO HB2 1.0 1.8 3.23 1522 1329 A 9 GLY H A 8 GLU HBx 1.0 1.8 3.67 1523 1329 A 8 GLU HBy A 9 GLY H 1.0 1.8 3.67 1524 1330 A 59 ARG H A 89 GLN HGx 1.0 1.8 4.92 1525 1330 A 59 ARG H A 89 GLN HGy 1.0 1.8 4.92 1526 1331 A 44 MET H A 44 MET HBx 1.0 1.8 3.32 1527 1331 A 44 MET HBy A 44 MET H 1.0 1.8 3.32 1528 1332 A 45 LYS H A 44 MET HBx 1.0 1.8 3.65 1529 1332 A 44 MET HBy A 45 LYS H 1.0 1.8 3.65 1530 1333 A 31 GLN H A 31 GLN HB2 1.0 1.8 3.25 1531 1334 A 48 CYS H A 47 TYR HB2 1.0 1.8 4.04 1532 1335 A 49 GLU H A 50 ARG HGx 1.0 1.8 4.21 1533 1335 A 49 GLU H A 50 ARG HGy 1.0 1.8 4.21 1534 1336 A 5 LYS H A 4 GLU HBx 1.0 1.8 5.02 1535 1337 A 41 SER H A 39 PRO HG2 1.0 1.8 5.60 1536 1338 A 58 ILE HG13 A 59 ARG H 1.0 1.8 4.30 1537 1339 A 40 LEU HB2 A 41 SER H 1.0 1.8 4.07 1538 1340 A 7 LYS H A 7 LYS HDx 1.0 1.8 4.38 1539 1340 A 7 LYS HDy A 7 LYS H 1.0 1.8 4.38 1540 1341 A 61 ARG HB2 A 87 PHE HZ 1.0 1.8 4.00 1541 1342 A 61 ARG HE A 61 ARG HG3 1.0 1.8 3.85 1542 1343 A 30 VAL HGy% A 32 PHE HZ 1.0 1.8 3.58 1543 1344 A 30 VAL HB A 32 PHE HZ 1.0 1.8 3.40 1544 1345 A 47 TYR HB2 A 32 PHE HZ 1.0 1.8 3.43 1545 1346 A 70 THR H A 69 GLU HGy 1.0 1.8 4.45 1546 1347 A 56 ARG HE A 56 ARG HGx 1.0 1.8 3.81 1547 1347 A 56 ARG HGy A 56 ARG HE 1.0 1.8 3.81 1548 1348 A 60 PHE HZ A 47 TYR HB3 1.0 1.8 3.58 1549 1349 A 22 VAL HB A 32 PHE HE% 1.0 1.8 4.21 1550 1350 A 30 VAL HGy% A 32 PHE HE% 1.0 1.8 3.95 1551 1351 A 60 PHE HE% A 44 MET HA 1.0 1.8 3.55 1552 1352 A 60 PHE HE% A 47 TYR HB3 1.0 1.8 4.23 1553 1353 A 62 PHE HD% A 63 ASP HB3 1.0 1.8 4.08 1554 1354 A 62 PHE HD% A 76 LEU HB3 1.0 1.8 3.10 1555 1355 A 58 ILE HG2% A 58 ILE H 1.0 1.8 3.11 1556 1356 A 36 ARG HG3 A 36 ARG HE 1.0 1.8 3.94 1557 1357 A 76 LEU HB2 A 62 PHE HE% 1.0 1.8 4.30 1558 1358 A 10 VAL HB A 10 VAL H 1.0 1.8 3.20 1559 1359 A 75 GLN H A 75 GLN HGx 1.0 1.8 3.99 1560 1359 A 75 GLN H A 75 GLN HGy 1.0 1.8 3.99 1561 1360 A 75 GLN HB2 A 75 GLN H 1.0 1.8 3.57 1562 1361 A 50 ARG H A 50 ARG HGx 1.0 1.8 3.17 1563 1361 A 50 ARG HGy A 50 ARG H 1.0 1.8 3.17 1564 1362 A 56 ARG H A 56 ARG HB3 1.0 1.8 3.18 1565 1363 A 17 HIS H A 17 HIS HB3 1.0 1.8 3.72 1566 1364 A 2 ALA H A 1 MET HGy 1.0 1.8 3.85 1567 1365 A 50 ARG H A 49 GLU HB2 1.0 1.8 3.60 1568 1366 A 82 ASP H A 82 ASP HBx 1.0 1.8 3.51 1569 1367 A 81 GLU HBx A 82 ASP H 1.0 1.8 4.91 1570 1368 A 56 ARG H A 56 ARG HDx 1.0 1.8 4.02 1571 1368 A 56 ARG H A 56 ARG HDy 1.0 1.8 4.02 1572 1369 A 82 ASP H A 81 GLU HBy 1.0 1.8 3.98 1573 1370 A 17 HIS H A 16 ASP HBx 1.0 1.8 3.90 1574 1370 A 17 HIS H A 16 ASP HBy 1.0 1.8 3.90 1575 1371 A 4 GLU H A 3 ASP HBx 1.0 1.8 4.54 1576 1372 A 53 LEU H A 51 GLN HB3 1.0 1.8 4.56 1577 1373 A 10 VAL H A 8 GLU HBx 1.0 1.8 5.25 1578 1373 A 8 GLU HBy A 10 VAL H 1.0 1.8 5.25 1579 1374 A 71 ASP HB2 A 68 ASN HD22 1.0 1.8 5.03 1580 1375 A 44 MET HA A 46 ALA H 1.0 1.8 4.46 1581 1376 A 55 MET HA A 48 CYS HBx 1.0 1.8 4.99 1582 1377 A 74 ALA HB% A 36 ARG HD2 1.0 1.8 4.21 1583 1378 A 55 MET H A 55 MET HGx 1.0 1.8 3.45 1584 1378 A 55 MET H A 55 MET HGy 1.0 1.8 3.45 1585 1379 A 40 LEU H A 40 LEU HDy% 1.0 1.8 4.00 1586 1380 A 60 PHE HB2 A 60 PHE H 1.0 1.8 4.15 1587 1381 A 40 LEU H A 40 LEU HB3 1.0 1.8 4.19 1588 1382 A 43 LEU HDy% A 20 LEU H 1.0 1.8 5.07 1589 1383 A 43 LEU HDy% A 34 ILE H 1.0 1.8 5.78 1590 1384 A 20 LEU H A 20 LEU HDy% 1.0 1.8 4.51 1591 1385 A 27 GLY H A 26 ASP HBy 1.0 1.8 4.54 1592 1386 A 87 PHE H A 89 GLN HGx 1.0 1.8 6.00 1593 1386 A 87 PHE H A 89 GLN HGy 1.0 1.8 6.00 1594 1387 A 90 GLN H A 90 GLN HGx 1.0 1.8 4.07 1595 1387 A 90 GLN HGy A 90 GLN H 1.0 1.8 4.07 1596 1388 A 90 GLN H A 89 GLN HGx 1.0 1.8 5.11 1597 1388 A 89 GLN HGy A 90 GLN H 1.0 1.8 5.11 1598 1389 A 15 ASN H A 14 ASN HBx 1.0 1.8 4.70 1599 1390 A 88 GLN H A 25 GLN HGx 1.0 1.8 4.42 1600 1390 A 25 GLN HGy A 88 GLN H 1.0 1.8 4.42 1601 1391 A 24 GLY H A 25 GLN HGx 1.0 1.8 6.00 1602 1391 A 25 GLN HGy A 24 GLY H 1.0 1.8 6.00 1603 1392 A 47 TYR HB3 A 46 ALA H 1.0 1.8 4.74 1604 1393 A 17 HIS HB2 A 17 HIS HD2 1.0 1.8 3.48 1605 1394 A 73 PRO HG3 A 37 HIS H 1.0 1.8 5.45 1606 1395 A 57 GLN H A 90 GLN HBx 1.0 1.8 6.00 1607 1395 A 90 GLN HBy A 57 GLN H 1.0 1.8 6.00 1608 1396 A 57 GLN H A 57 GLN HB3 1.0 1.8 3.60 1609 1397 A 42 LYS HG3 A 42 LYS H 1.0 1.8 3.60 1610 1398 A 77 GLU H A 75 GLN HGx 1.0 1.8 5.80 1611 1398 A 77 GLU H A 75 GLN HGy 1.0 1.8 5.80 1612 1399 A 42 LYS H A 39 PRO HB2 1.0 1.8 3.80 1613 1400 A 27 GLY H A 26 ASP HBx 1.0 1.8 4.54 1614 1401 A 37 HIS HB3 A 37 HIS H 1.0 1.8 3.25 1615 1402 A 42 LYS HG2 A 42 LYS H 1.0 1.8 3.43 1616 1403 A 34 ILE HD1% A 42 LYS H 1.0 1.8 4.81 1617 1404 A 57 GLN H A 56 ARG HB3 1.0 1.8 4.32 1618 1405 A 51 GLN H A 50 ARG HB2 1.0 1.8 4.17 1619 1406 A 36 ARG HG2 A 37 HIS H 1.0 1.8 4.53 1620 1407 A 74 ALA HB% A 77 GLU H 1.0 1.8 4.43 1621 1408 A 38 THR HG2% A 37 HIS H 1.0 1.8 5.34 1622 1409 A 65 GLN H A 62 PHE HB2 1.0 1.8 6.00 1623 1410 A 63 ASP HB2 A 65 GLN HE22 1.0 1.8 5.07 1624 1411 A 15 ASN HD2x A 15 ASN HBx 1.0 1.8 4.02 1625 1411 A 15 ASN HBy A 15 ASN HD2x 1.0 1.8 4.02 1626 1412 A 67 ILE HA A 71 ASP HB2 1.0 1.8 5.07 1627 1413 A 60 PHE HB2 A 59 ARG HD3 1.0 1.8 5.14 1628 1414 A 37 HIS HB3 A 38 THR H 1.0 1.8 4.01 1629 1415 A 84 ILE HG2% A 60 PHE HB2 1.0 1.8 3.86 1630 1416 A 56 ARG HA A 55 MET HB3 1.0 1.8 5.27 1631 1417 A 76 LEU H A 75 GLN HB3 1.0 1.8 3.78 1632 1418 A 84 ILE HD1% A 85 ASP HBx 1.0 1.8 5.48 1633 1418 A 84 ILE HD1% A 85 ASP HBy 1.0 1.8 5.48 1634 1419 A 84 ILE HD1% A 60 PHE HB3 1.0 1.8 5.36 1635 1420 A 51 GLN HB3 A 51 GLN HE22 1.0 1.8 4.47 1636 1421 A 75 GLN HE2x A 75 GLN HGx 1.0 1.8 3.54 1637 1421 A 75 GLN HGy A 75 GLN HE2x 1.0 1.8 3.54 1638 1422 A 57 GLN HB3 A 57 GLN HE21 1.0 1.8 4.41 1639 1423 A 65 GLN HE21 A 65 GLN HB2 1.0 1.8 4.18 1640 1424 A 65 GLN HGx A 65 GLN HE21 1.0 1.8 3.30 1641 1425 A 46 ALA H A 45 LYS HGx 1.0 1.8 5.27 1642 1426 A 31 GLN HA A 32 PHE HB3 1.0 1.8 6.00 1643 1427 A 57 GLN HB2 A 57 GLN HE22 1.0 1.8 4.54 1644 1428 A 31 GLN HB2 A 31 GLN HE21 1.0 1.8 4.67 1645 1429 A 65 GLN HB2 A 65 GLN HE22 1.0 1.8 5.19 1646 1430 A 60 PHE HE% A 44 MET HBx 1.0 1.8 3.66 1647 1430 A 60 PHE HE% A 44 MET HBy 1.0 1.8 3.66 1648 1431 A 84 ILE HG2% A 60 PHE HE% 1.0 1.8 4.05 1649 1432 A 60 PHE HE% A 86 VAL HGx% 1.0 1.8 4.15 1650 1433 A 60 PHE HE% A 58 ILE HG13 1.0 1.8 3.98 1651 1434 A 60 PHE HE% A 58 ILE HD1% 1.0 1.8 3.31 1652 1435 A 44 MET HA A 44 MET HGy 1.0 1.8 3.67 1653 1436 A 56 ARG HB3 A 56 ARG HDx 1.0 1.8 3.59 1654 1436 A 56 ARG HDy A 56 ARG HB3 1.0 1.8 3.59 1655 1437 A 50 ARG HD2 A 50 ARG HB2 1.0 1.8 4.07 1656 1438 A 59 ARG HD2 A 59 ARG HB3 1.0 1.8 3.84 1657 1439 A 59 ARG HD3 A 59 ARG HB3 1.0 1.8 4.12 1658 1440 A 59 ARG HD2 A 89 GLN HGx 1.0 1.8 5.35 1659 1440 A 89 GLN HGy A 59 ARG HD2 1.0 1.8 5.35 1660 1441 A 43 LEU HDy% A 43 LEU HA 1.0 1.8 4.24 1661 1442 A 43 LEU HA A 43 LEU HG 1.0 1.8 3.71 1662 1443 A 74 ALA HB% A 36 ARG HA 1.0 1.8 3.91 1663 1444 A 88 GLN HB3 A 88 GLN HE2y 1.0 1.8 4.77 1664 1445 A 39 PRO HG3 A 38 THR HA 1.0 1.8 4.85 1665 1446 A 51 GLN HB3 A 51 GLN HE21 1.0 1.8 4.35 1666 1447 A 5 LYS HA A 6 PRO HGx 1.0 1.8 4.38 1667 1447 A 6 PRO HGy A 5 LYS HA 1.0 1.8 4.38 1668 1448 A 5 LYS HA A 5 LYS HDx 1.0 1.8 4.55 1669 1448 A 5 LYS HDy A 5 LYS HA 1.0 1.8 4.55 1670 1449 A 31 GLN HE21 A 21 LYS HB2 1.0 1.8 5.91 1671 1450 A 57 GLN HE22 A 56 ARG HB3 1.0 1.8 6.00 1672 1451 A 51 GLN HE22 A 51 GLN HGx 1.0 1.8 3.56 1673 1451 A 51 GLN HGy A 51 GLN HE22 1.0 1.8 3.56 1674 1452 A 47 TYR HE% A 51 GLN HGx 1.0 1.8 3.73 1675 1452 A 47 TYR HE% A 51 GLN HGy 1.0 1.8 3.73 1676 1453 A 47 TYR HE% A 50 ARG HGx 1.0 1.8 5.39 1677 1453 A 50 ARG HGy A 47 TYR HE% 1.0 1.8 5.39 1678 1454 A 23 ALA HB% A 85 ASP HA 1.0 1.8 3.91 1679 1455 A 57 GLN HG2 A 56 ARG HGx 1.0 1.8 4.99 1680 1455 A 56 ARG HGy A 57 GLN HG2 1.0 1.8 4.99 1681 1456 A 71 ASP HB3 A 40 LEU HG 1.0 1.8 5.32 1682 1457 A 53 LEU H A 53 LEU HDx% 1.0 1.8 4.06 1683 1458 A 93 GLY H A 91 THR HG2% 1.0 1.8 6.00 1684 1459 A 53 LEU H A 53 LEU HB3 1.0 1.8 3.99 1685 1460 A 82 ASP H A 20 LEU HDx% 1.0 1.8 4.78 1686 1461 A 20 LEU HB3 A 82 ASP H 1.0 1.8 5.89 1687 1462 A 47 TYR HE% A 51 GLN HB2 1.0 1.8 4.43 1688 1463 A 47 TYR HE% A 53 LEU HB2 1.0 1.8 4.88 1689 1464 A 47 TYR HE% A 86 VAL HB 1.0 1.8 4.36 1690 1465 A 20 LEU HB2 A 19 ASN HA 1.0 1.8 4.56 1691 1466 A 43 LEU HB3 A 32 PHE HB3 1.0 1.8 4.88 1692 1467 A 30 VAL HGy% A 51 GLN HE21 1.0 1.8 3.99 1693 1468 A 53 LEU HG A 88 GLN HE2x 1.0 1.8 4.89 1694 1469 A 88 GLN HE2x A 53 LEU HDy% 1.0 1.8 4.04 1695 1470 A 58 ILE HG2% A 88 GLN HE2x 1.0 1.8 4.70 1696 1471 A 51 GLN HE21 A 51 GLN HB2 1.0 1.8 4.59 1697 1472 A 61 ARG HG2 A 85 ASP HBx 1.0 1.8 4.65 1698 1472 A 85 ASP HBy A 61 ARG HG2 1.0 1.8 4.65 1699 1473 A 91 THR HG2% A 91 THR H 1.0 1.8 4.20 1700 1474 A 30 VAL HGy% A 47 TYR HE% 1.0 1.8 3.12 1701 1475 A 30 VAL HGy% A 23 ALA HA 1.0 1.8 5.85 1702 1476 A 83 THR HG2% A 23 ALA HA 1.0 1.8 6.00 1703 1477 A 30 VAL HGx% A 31 GLN HE22 1.0 1.8 4.48 1704 1478 A 34 ILE HD1% A 38 THR H 1.0 1.8 4.94 1705 1479 A 83 THR HG2% A 85 ASP HBx 1.0 1.8 6.00 1706 1479 A 83 THR HG2% A 85 ASP HBy 1.0 1.8 6.00 1707 1480 A 76 LEU HDx% A 65 GLN HE21 1.0 1.8 5.16 1708 1481 A 76 LEU HDy% A 65 GLN HE21 1.0 1.8 4.24 1709 1482 A 30 VAL HGy% A 50 ARG HD3 1.0 1.8 4.39 1710 1483 A 43 LEU HDy% A 40 LEU HB3 1.0 1.8 5.23 1711 1484 A 67 ILE H A 67 ILE HG12 1.0 1.8 3.66 1712 1485 A 87 PHE H A 86 VAL HGy% 1.0 1.8 3.88 1713 1486 A 30 VAL H A 22 VAL HGy% 1.0 1.8 4.71 1714 1487 A 30 VAL HGx% A 30 VAL H 1.0 1.8 4.89 1715 1488 A 24 GLY H A 86 VAL HGy% 1.0 1.8 5.93 1716 1489 A 24 GLY H A 86 VAL HGx% 1.0 1.8 5.93 1717 1490 A 11 LYS H A 10 VAL HGx% 1.0 1.8 3.38 1718 1490 A 10 VAL HGy% A 11 LYS H 1.0 1.8 3.38 1719 1491 A 18 ILE HG2% A 80 ASP H 1.0 1.8 3.95 1720 1492 A 83 THR H A 84 ILE HG12 1.0 1.8 6.00 1721 1493 A 58 ILE HD1% A 54 SER H 1.0 1.8 4.58 1722 1494 A 76 LEU HDx% A 65 GLN HE22 1.0 1.8 5.03 1723 1495 A 30 VAL HGx% A 51 GLN HE21 1.0 1.8 4.97 1724 1496 A 30 VAL HGx% A 50 ARG HD3 1.0 1.8 3.93 1725 1497 A 30 VAL HGx% A 50 ARG HD2 1.0 1.8 3.91 1726 1498 A 67 ILE HD1% A 85 ASP HBx 1.0 1.8 5.50 1727 1498 A 67 ILE HD1% A 85 ASP HBy 1.0 1.8 5.50 1728 1499 A 43 LEU HDx% A 84 ILE HD1% 1.0 1.8 4.08 1729 1500 A 18 ILE HG2% A 36 ARG H 1.0 1.8 4.60 1730 1501 A 58 ILE HD1% A 55 MET HGx 1.0 1.8 4.85 1731 1501 A 58 ILE HD1% A 55 MET HGy 1.0 1.8 4.85 1732 1502 A 58 ILE HD1% A 48 CYS H 1.0 1.8 4.62 1733 1503 A 67 ILE HA A 40 LEU HDy% 1.0 1.8 5.76 1734 1504 A 59 ARG H A 86 VAL HGx% 1.0 1.8 5.00 1735 1505 A 18 ILE HD1% A 36 ARG H 1.0 1.8 5.18 1736 1506 A 47 TYR HE% A 86 VAL HGx% 1.0 1.8 3.49 1737 1507 A 24 GLY HAy A 86 VAL HGx% 1.0 1.8 5.86 1738 1508 A 43 LEU HDy% A 32 PHE HB3 1.0 1.8 4.51 1739 1509 A 18 ILE HD1% A 79 GLU HA 1.0 1.8 4.89 1740 1510 A 43 LEU HDx% A 44 MET HA 1.0 1.8 3.56 1741 1511 A 44 MET HA A 44 MET HGx 1.0 1.8 3.67 1742 1512 A 47 TYR HE% A 86 VAL HGy% 1.0 1.8 3.49 1743 1513 A 43 LEU HDx% A 43 LEU HA 1.0 1.8 3.71 1744 1514 A 47 TYR HE% A 22 VAL HGx% 1.0 1.8 4.50 1745 1515 A 49 GLU H A 47 TYR H 1.0 1.8 4.76 1746 1516 A 87 PHE H A 87 PHE HE% 1.0 1.8 4.17 1747 1517 A 59 ARG H A 87 PHE HD% 1.0 1.8 4.33 1748 1518 A 87 PHE H A 87 PHE HD% 1.0 1.8 3.21 1749 1519 A 27 GLY H A 25 GLN H 1.0 1.8 4.64 1750 1520 A 56 ARG H A 57 GLN HE22 1.0 1.8 4.92 1751 1521 A 35 LYS H A 38 THR H 1.0 1.8 4.53 1752 1522 A 42 LYS H A 44 MET H 1.0 1.8 4.33 1753 1523 A 18 ILE HB A 19 ASN HA 1.0 1.8 4.93 1754 1524 A 61 ARG HB3 A 64 GLY HA2 1.0 1.8 5.87 1755 1525 A 1 MET HA A 1 MET HGx 1.0 1.8 4.25 1756 1526 A 70 THR HG2% A 69 GLU HA 1.0 1.8 4.79 1757 1527 A 57 GLN HA A 57 GLN HG2 1.0 1.8 3.62 1758 1528 A 38 THR HG2% A 38 THR HA 1.0 1.8 3.14 1759 1529 A 46 ALA HB% A 43 LEU HA 1.0 1.8 3.32 1760 1530 A 44 MET HE% A 41 SER HA 1.0 1.8 3.36 1761 1531 A 60 PHE HA A 61 ARG HB3 1.0 1.8 4.37 1762 1532 A 44 MET HE% A 69 GLU HA 1.0 1.8 3.04 1763 1533 A 46 ALA HB% A 47 TYR HA 1.0 1.8 4.05 1764 1534 A 91 THR HA A 91 THR HG2% 1.0 1.8 3.34 1765 1535 A 51 GLN HA A 51 GLN HGx 1.0 1.8 2.99 1766 1535 A 51 GLN HA A 51 GLN HGy 1.0 1.8 2.99 1767 1536 A 65 GLN HB2 A 66 PRO HD3 1.0 1.8 3.65 1768 1537 A 81 GLU HA A 21 LYS HDx 1.0 1.8 4.36 1769 1537 A 21 LYS HDy A 81 GLU HA 1.0 1.8 4.36 1770 1538 A 57 GLN HB2 A 54 SER HBx 1.0 1.8 3.26 1771 1539 A 70 THR HG2% A 70 THR HA 1.0 1.8 2.81 1772 1540 A 48 CYS HA A 53 LEU HB2 1.0 1.8 3.23 1773 1541 A 46 ALA HA A 49 GLU HB2 1.0 1.8 3.33 1774 1542 A 57 GLN HA A 90 GLN HGx 1.0 1.8 3.87 1775 1542 A 57 GLN HA A 90 GLN HGy 1.0 1.8 3.87 1776 1543 A 89 GLN HA A 89 GLN HGx 1.0 1.8 3.51 1777 1543 A 89 GLN HGy A 89 GLN HA 1.0 1.8 3.51 1778 1544 A 81 GLU HA A 81 GLU HGy 1.0 1.8 4.00 1779 1545 A 24 GLY HAx A 86 VAL HB 1.0 1.8 4.66 1780 1546 A 48 CYS HA A 53 LEU HB3 1.0 1.8 5.29 1781 1547 A 57 GLN HB2 A 54 SER HBy 1.0 1.8 3.44 1782 1548 A 41 SER HA A 44 MET HBx 1.0 1.8 3.54 1783 1548 A 41 SER HA A 44 MET HBy 1.0 1.8 3.54 1784 1549 A 54 SER HBy A 56 ARG HGx 1.0 1.8 3.91 1785 1549 A 56 ARG HGy A 54 SER HBy 1.0 1.8 3.91 1786 1550 A 7 LYS HA A 7 LYS HGx 1.0 1.8 3.83 1787 1550 A 7 LYS HGy A 7 LYS HA 1.0 1.8 3.83 1788 1551 A 38 THR HG2% A 39 PRO HA 1.0 1.8 4.06 1789 1552 A 43 LEU HA A 42 LYS HBy 1.0 1.8 5.08 1790 1553 A 38 THR HA A 39 PRO HG2 1.0 1.8 4.58 1791 1554 A 36 ARG HA A 73 PRO HG2 1.0 1.8 4.03 1792 1555 A 38 THR HG2% A 73 PRO HDx 1.0 1.8 4.02 1793 1555 A 38 THR HG2% A 73 PRO HDy 1.0 1.8 4.02 1794 1556 A 60 PHE HA A 61 ARG HB2 1.0 1.8 4.90 1795 1557 A 62 PHE HA A 61 ARG HG2 1.0 1.8 4.55 1796 1558 A 47 TYR HA A 51 GLN HGx 1.0 1.8 3.84 1797 1558 A 47 TYR HA A 51 GLN HGy 1.0 1.8 3.84 1798 1559 A 38 THR HB A 34 ILE HG13 1.0 1.8 4.57 1799 1560 A 58 ILE HA A 53 LEU HG 1.0 1.8 6.00 1800 1561 A 58 ILE HA A 59 ARG HB3 1.0 1.8 6.00 1801 1562 A 36 ARG HB2 A 35 LYS HA 1.0 1.8 6.00 1802 1563 A 79 GLU HA A 78 MET HB3 1.0 1.8 6.00 1803 1564 A 21 LYS HG2 A 31 GLN HA 1.0 1.8 4.05 1804 1565 A 81 GLU HA A 19 ASN HBx 1.0 1.8 5.26 1805 1566 A 67 ILE HB A 61 ARG HA 1.0 1.8 4.54 1806 1567 A 19 ASN HA A 20 LEU HDy% 1.0 1.8 4.98 1807 1568 A 30 VAL HGx% A 31 GLN HA 1.0 1.8 4.50 1808 1569 A 83 THR HA A 84 ILE HG12 1.0 1.8 4.70 1809 1570 A 30 VAL HGx% A 47 TYR HA 1.0 1.8 3.91 1810 1571 A 58 ILE HD1% A 55 MET HA 1.0 1.8 4.00 1811 1572 A 84 ILE HG2% A 84 ILE HA 1.0 1.8 3.49 1812 1573 A 74 ALA HB% A 73 PRO HDx 1.0 1.8 3.94 1813 1573 A 74 ALA HB% A 73 PRO HDy 1.0 1.8 3.94 1814 1574 A 30 VAL HGx% A 30 VAL HA 1.0 1.8 3.00 1815 1575 A 18 ILE HG2% A 18 ILE HA 1.0 1.8 3.30 1816 1576 A 67 ILE HG2% A 67 ILE HA 1.0 1.8 3.28 1817 1577 A 67 ILE HG12 A 67 ILE HA 1.0 1.8 3.71 1818 1578 A 67 ILE HG12 A 61 ARG HA 1.0 1.8 4.17 1819 1579 A 18 ILE HG2% A 36 ARG HA 1.0 1.8 4.40 1820 1580 A 76 LEU HDx% A 74 ALA HA 1.0 1.8 4.57 1821 1581 A 60 PHE HA A 58 ILE HD1% 1.0 1.8 6.00 1822 1582 A 34 ILE HD1% A 39 PRO HA 1.0 1.8 5.70 1823 1583 A 34 ILE HD1% A 73 PRO HA 1.0 1.8 5.34 1824 1584 A 34 ILE HG2% A 19 ASN HA 1.0 1.8 4.90 1825 1585 A 18 ILE HG2% A 19 ASN HA 1.0 1.8 6.00 1826 1586 A 34 ILE HD1% A 19 ASN HA 1.0 1.8 6.00 1827 1587 A 73 PRO HA A 40 LEU HB3 1.0 1.8 4.39 1828 1588 A 40 LEU HA A 40 LEU HDx% 1.0 1.8 4.32 1829 1589 A 41 SER HA A 43 LEU HG 1.0 1.8 4.80 1830 1590 A 77 GLU HA A 78 MET HG2 1.0 1.8 4.98 1831 1591 A 44 MET HA A 43 LEU HG 1.0 1.8 4.56 1832 1592 A 6 PRO HB3 A 7 LYS HEx 1.0 1.8 5.77 1833 1592 A 7 LYS HEy A 6 PRO HB3 1.0 1.8 5.77 1834 1593 A 55 MET HE% A 47 TYR HB3 1.0 1.8 4.66 1835 1594 A 5 LYS HEy A 6 PRO HGx 1.0 1.8 6.00 1836 1594 A 5 LYS HEx A 6 PRO HGx 1.0 1.8 6.00 1837 1594 A 6 PRO HGy A 5 LYS HEx 1.0 1.8 6.00 1838 1594 A 6 PRO HGy A 5 LYS HEy 1.0 1.8 6.00 1839 1595 A 59 ARG H A 60 PHE H 1.0 1.8 4.33 1840 1596 A 92 GLY H A 91 THR H 1.0 1.8 4.67 1841 1597 A 84 ILE HG2% A 60 PHE HB3 1.0 1.8 3.73 1842 1598 A 84 ILE HG2% A 85 ASP HBx 1.0 1.8 4.12 1843 1598 A 84 ILE HG2% A 85 ASP HBy 1.0 1.8 4.12 1844 1599 A 87 PHE HB2 A 25 GLN HGx 1.0 1.8 4.56 1845 1599 A 25 GLN HGy A 87 PHE HB2 1.0 1.8 4.56 1846 1600 A 88 GLN HB2 A 25 GLN HGx 1.0 1.8 4.31 1847 1600 A 88 GLN HB2 A 25 GLN HGy 1.0 1.8 4.31 1848 1601 A 11 LYS HEx A 11 LYS HGx 1.0 1.8 3.51 1849 1601 A 11 LYS HEy A 11 LYS HGx 1.0 1.8 3.51 1850 1601 A 11 LYS HGy A 11 LYS HEx 1.0 1.8 3.51 1851 1601 A 11 LYS HEy A 11 LYS HGy 1.0 1.8 3.51 1852 1602 A 45 LYS HGx A 45 LYS HEx 1.0 1.8 3.88 1853 1602 A 45 LYS HEy A 45 LYS HGx 1.0 1.8 3.88 1854 1603 A 16 ASP H A 15 ASN H 1.0 1.8 4.44 1855 1604 A 17 HIS H A 16 ASP H 1.0 1.8 4.26 1856 1605 A 51 GLN HA A 52 GLY HAx 1.0 1.8 4.28 1857 1605 A 51 GLN HA A 52 GLY HAy 1.0 1.8 4.28 1858 1606 A 39 PRO HA A 73 PRO HDx 1.0 1.8 4.47 1859 1606 A 39 PRO HA A 73 PRO HDy 1.0 1.8 4.47 1860 1607 A 47 TYR HB2 A 22 VAL HGy% 1.0 1.8 5.28 1861 1608 A 55 MET HB2 A 56 ARG HDx 1.0 1.8 4.28 1862 1608 A 56 ARG HDy A 55 MET HB2 1.0 1.8 4.28 1863 1609 A 39 PRO HG2 A 42 LYS HEx 1.0 1.8 4.88 1864 1609 A 42 LYS HEy A 39 PRO HG2 1.0 1.8 4.88 1865 1610 A 45 LYS HBx A 45 LYS HEx 1.0 1.8 4.31 1866 1610 A 45 LYS HBy A 45 LYS HEx 1.0 1.8 4.31 1867 1610 A 45 LYS HEy A 45 LYS HBx 1.0 1.8 4.31 1868 1610 A 45 LYS HBy A 45 LYS HEy 1.0 1.8 4.31 1869 1611 A 21 LYS HG3 A 21 LYS HE3 1.0 1.8 3.37 1870 1612 A 60 PHE HB2 A 67 ILE HG2% 1.0 1.8 4.00 1871 1613 A 67 ILE HG2% A 71 ASP HB2 1.0 1.8 4.28 1872 1614 A 45 LYS HEy A 45 LYS HGy 1.0 1.8 3.88 1873 1614 A 45 LYS HEx A 45 LYS HGy 1.0 1.8 3.88 1874 1615 A 60 PHE HB2 A 67 ILE HB 1.0 1.8 3.62 1875 1616 A 83 THR HG2% A 21 LYS HE3 1.0 1.8 4.52 1876 1617 A 67 ILE HD1% A 62 PHE HB3 1.0 1.8 4.04 1877 1618 A 61 ARG HB3 A 61 ARG HD2 1.0 1.8 3.84 1878 1619 A 55 MET HGy A 45 LYS HGy 1.0 1.8 4.53 1879 1619 A 45 LYS HGy A 55 MET HGx 1.0 1.8 4.53 1880 1620 A 18 ILE HD1% A 73 PRO HG2 1.0 1.8 4.12 1881 1621 A 78 MET HE% A 62 PHE HB2 1.0 1.8 4.56 1882 1622 A 67 ILE HG12 A 62 PHE HB2 1.0 1.8 4.47 1883 1623 A 12 THR H A 13 GLU H 1.0 1.8 5.35 1884 1624 A 39 PRO HD2 A 38 THR HA 1.0 1.8 3.41 1885 1625 A 76 LEU HDy% A 62 PHE HB3 1.0 1.8 3.61 1886 1626 A 62 PHE HB3 A 78 MET HE% 1.0 1.8 4.11 1887 1627 A 67 ILE HD1% A 62 PHE HB2 1.0 1.8 3.69 1888 1628 A 21 LYS HG2 A 21 LYS HE3 1.0 1.8 3.83 1889 1629 A 83 THR HG2% A 21 LYS HB2 1.0 1.8 4.05 1890 1630 A 61 ARG HD2 A 61 ARG HB2 1.0 1.8 3.78 1891 1631 A 60 PHE HB3 A 67 ILE HG2% 1.0 1.8 4.03 1892 1632 A 60 PHE HE% A 47 TYR HE% 1.0 1.8 4.32 1893 1633 A 42 LYS HG2 A 42 LYS HEx 1.0 1.8 3.47 1894 1633 A 42 LYS HEy A 42 LYS HG2 1.0 1.8 3.47 1895 1634 A 67 ILE HG2% A 71 ASP HB3 1.0 1.8 3.35 1896 1635 A 76 LEU HDy% A 65 GLN HGy 1.0 1.8 3.55 1897 1636 A 76 LEU HDx% A 75 GLN HB2 1.0 1.8 3.73 1898 1637 A 84 ILE HG2% A 67 ILE HG13 1.0 1.8 4.38 1899 1638 A 18 ILE HD1% A 78 MET HB2 1.0 1.8 5.19 1900 1639 A 43 LEU HDy% A 43 LEU HB2 1.0 1.8 3.70 1901 1640 A 18 ILE HD1% A 78 MET HG2 1.0 1.8 3.83 1902 1641 A 76 LEU HG A 75 GLN HB3 1.0 1.8 3.51 1903 1642 A 58 ILE HB A 58 ILE HG13 1.0 1.8 3.02 1904 1643 A 58 ILE HG2% A 53 LEU HB3 1.0 1.8 3.38 1905 1644 A 74 ALA HB% A 36 ARG HB3 1.0 1.8 3.71 1906 1645 A 40 LEU HB3 A 40 LEU HDx% 1.0 1.8 3.59 1907 1646 A 43 LEU HB3 A 43 LEU HDy% 1.0 1.8 4.10 1908 1647 A 83 THR HG2% A 23 ALA HB% 1.0 1.8 2.71 1909 1648 A 58 ILE HD1% A 86 VAL HGx% 1.0 1.8 3.52 1910 1649 A 18 ILE HD1% A 20 LEU HDx% 1.0 1.8 2.98 1911 1650 A 47 TYR HD% A 60 PHE HZ 1.0 1.8 2.67 1912 1651 A 61 ARG H A 60 PHE HB3 1.0 1.8 4.18 1913 1652 A 61 ARG H A 61 ARG HD2 1.0 1.8 5.22 1914 1653 A 81 GLU H A 19 ASN HBy 1.0 1.8 4.79 1915 1654 A 32 PHE H A 32 PHE HB3 1.0 1.8 3.97 1916 1655 A 18 ILE HD1% A 20 LEU H 1.0 1.8 5.97 1917 1656 A 47 TYR H A 32 PHE HE% 1.0 1.8 4.86 1918 1657 A 58 ILE H A 54 SER H 1.0 1.8 4.70 1919 1658 A 75 GLN H A 72 THR HB 1.0 1.8 4.96 1920 1659 A 60 PHE HZ A 49 GLU H 1.0 1.8 6.00 1921 1660 A 60 PHE HD% A 55 MET HA 1.0 1.8 6.00 1922 1661 A 35 LYS HA A 17 HIS HD2 1.0 1.8 6.00 1923 1662 A 61 ARG HD2 A 62 PHE HA 1.0 1.8 5.77 1924 1663 A 25 GLN HA A 24 GLY H 1.0 1.8 5.58 1925 1664 A 62 PHE H A 64 GLY HA2 1.0 1.8 5.73 1926 1665 A 50 ARG HD2 A 30 VAL HA 1.0 1.8 6.00 1927 1666 A 84 ILE HG2% A 62 PHE HB3 1.0 1.8 4.86 1928 1667 A 76 LEU H A 78 MET HB3 1.0 1.8 4.81 1929 1668 A 34 ILE HG13 A 38 THR H 1.0 1.8 4.75 1930 1669 A 23 ALA H A 22 VAL H 1.0 1.8 5.27 1931 1670 A 47 TYR H A 22 VAL HGx% 1.0 1.8 6.00 1932 1671 A 87 PHE HE% A 61 ARG HA 1.0 1.8 4.59 1933 1672 A 32 PHE HD% A 31 GLN HA 1.0 1.8 4.52 1934 1673 A 21 LYS H A 83 THR HA 1.0 1.8 3.93 1935 1674 A 74 ALA H A 72 THR HA 1.0 1.8 4.51 1936 1675 A 58 ILE HA A 57 GLN H 1.0 1.8 5.04 1937 1676 A 70 THR H A 68 ASN HA 1.0 1.8 4.10 1938 1677 A 58 ILE HA A 87 PHE HD% 1.0 1.8 5.12 1939 1678 A 68 ASN HA A 68 ASN HD21 1.0 1.8 5.39 1940 1679 A 29 VAL HA A 30 VAL H 1.0 1.8 3.15 1941 1680 A 47 TYR HD% A 29 VAL HA 1.0 1.8 4.98 1942 1681 A 29 VAL HA A 47 TYR HE% 1.0 1.8 4.62 1943 1682 A 32 PHE H A 21 LYS HA 1.0 1.8 4.30 1944 1683 A 21 LYS HA A 32 PHE HE% 1.0 1.8 4.06 1945 1684 A 35 LYS H A 34 ILE HA 1.0 1.8 3.52 1946 1685 A 56 ARG H A 54 SER HA 1.0 1.8 4.25 1947 1686 A 55 MET H A 54 SER HA 1.0 1.8 3.30 1948 1687 A 70 THR H A 71 ASP HA 1.0 1.8 4.89 1949 1688 A 86 VAL HA A 87 PHE HE% 1.0 1.8 4.29 1950 1689 A 32 PHE HD% A 32 PHE HA 1.0 1.8 3.83 1951 1690 A 86 VAL HA A 87 PHE HD% 1.0 1.8 3.42 1952 1691 A 88 GLN HA A 88 GLN HE2x 1.0 1.8 4.66 1953 1692 A 60 PHE HE% A 59 ARG HA 1.0 1.8 4.82 1954 1693 A 24 GLY HAy A 26 ASP H 1.0 1.8 4.27 1955 1694 A 67 ILE HA A 68 ASN HD21 1.0 1.8 5.11 1956 1695 A 13 GLU HA A 14 ASN HD21 1.0 1.8 5.01 1957 1696 A 58 ILE H A 56 ARG HDx 1.0 1.8 5.65 1958 1696 A 58 ILE H A 56 ARG HDy 1.0 1.8 5.65 1959 1697 A 48 CYS H A 48 CYS HBy 1.0 1.8 3.80 1960 1698 A 50 ARG HD2 A 32 PHE HE% 1.0 1.8 4.48 1961 1699 A 60 PHE HE% A 55 MET HGx 1.0 1.8 4.56 1962 1699 A 60 PHE HE% A 55 MET HGy 1.0 1.8 4.56 1963 1700 A 87 PHE HD% A 85 ASP HBx 1.0 1.8 3.70 1964 1700 A 85 ASP HBy A 87 PHE HD% 1.0 1.8 3.70 1965 1701 A 70 THR H A 71 ASP HB3 1.0 1.8 5.55 1966 1702 A 62 PHE H A 65 GLN HGx 1.0 1.8 4.67 1967 1703 A 57 GLN HB2 A 57 GLN HE21 1.0 1.8 4.13 1968 1704 A 70 THR H A 69 GLU HGx 1.0 1.8 4.45 1969 1705 A 9 GLY H A 8 GLU HGx 1.0 1.8 4.71 1970 1705 A 8 GLU HGy A 9 GLY H 1.0 1.8 4.71 1971 1706 A 80 ASP H A 79 GLU HG2 1.0 1.8 5.36 1972 1707 A 65 GLN HB3 A 65 GLN HE21 1.0 1.8 5.18 1973 1708 A 87 PHE HD% A 89 GLN HGx 1.0 1.8 4.27 1974 1708 A 89 GLN HGy A 87 PHE HD% 1.0 1.8 4.27 1975 1709 A 31 GLN H A 31 GLN HG2 1.0 1.8 4.20 1976 1710 A 32 PHE H A 31 GLN HG3 1.0 1.8 4.50 1977 1711 A 13 GLU H A 13 GLU HBx 1.0 1.8 3.37 1978 1711 A 13 GLU HBy A 13 GLU H 1.0 1.8 3.37 1979 1712 A 14 ASN H A 13 GLU HBx 1.0 1.8 3.67 1980 1712 A 13 GLU HBy A 14 ASN H 1.0 1.8 3.67 1981 1713 A 56 ARG HB3 A 56 ARG HE 1.0 1.8 4.15 1982 1714 A 56 ARG HB2 A 56 ARG HE 1.0 1.8 3.97 1983 1715 A 85 ASP H A 61 ARG HB3 1.0 1.8 4.87 1984 1716 A 85 ASP H A 84 ILE HB 1.0 1.8 5.13 1985 1717 A 59 ARG HB2 A 87 PHE HZ 1.0 1.8 4.50 1986 1718 A 61 ARG HB3 A 61 ARG HE 1.0 1.8 4.95 1987 1719 A 53 LEU H A 51 GLN HGx 1.0 1.8 4.71 1988 1719 A 53 LEU H A 51 GLN HGy 1.0 1.8 4.71 1989 1720 A 85 ASP H A 84 ILE HG13 1.0 1.8 6.00 1990 1721 A 45 LYS H A 45 LYS HGy 1.0 1.8 3.33 1991 1722 A 44 MET HE% A 41 SER H 1.0 1.8 4.27 1992 1723 A 35 LYS H A 38 THR HG2% 1.0 1.8 3.24 1993 1724 A 32 PHE HD% A 43 LEU HB2 1.0 1.8 3.77 1994 1725 A 59 ARG HB3 A 89 GLN HE21 1.0 1.8 5.12 1995 1726 A 43 LEU HB2 A 32 PHE HZ 1.0 1.8 4.46 1996 1727 A 62 PHE H A 61 ARG HG2 1.0 1.8 4.06 1997 1728 A 32 PHE HD% A 21 LYS HG2 1.0 1.8 4.68 1998 1729 A 76 LEU H A 78 MET HE% 1.0 1.8 5.21 1999 1730 A 85 ASP H A 83 THR HG2% 1.0 1.8 5.48 2000 1731 A 30 VAL HGy% A 31 GLN HE22 1.0 1.8 4.71 2001 1732 A 84 ILE HG2% A 62 PHE HD% 1.0 1.8 3.82 2002 1733 A 74 ALA H A 72 THR HG2% 1.0 1.8 3.90 2003 1734 A 67 ILE HG2% A 68 ASN HD21 1.0 1.8 5.05 2004 1735 A 35 LYS H A 34 ILE HG2% 1.0 1.8 3.98 2005 1736 A 30 VAL HGx% A 32 PHE H 1.0 1.8 5.92 2006 1737 A 34 ILE HG2% A 32 PHE H 1.0 1.8 6.00 2007 1738 A 30 VAL HGx% A 32 PHE HZ 1.0 1.8 2.93 2008 1739 A 58 ILE HD1% A 57 GLN H 1.0 1.8 5.88 2009 1740 A 43 LEU HG A 46 ALA H 1.0 1.8 5.58 2010 1741 A 60 PHE HD% A 67 ILE HD1% 1.0 1.8 3.46 2011 1742 A 60 PHE HZ A 86 VAL HGx% 1.0 1.8 5.11 2012 1743 A 18 ILE HD1% A 82 ASP H 1.0 1.8 4.87 2013 1744 A 43 LEU HDy% A 44 MET H 1.0 1.8 4.17 2014 1745 A 43 LEU HDx% A 44 MET H 1.0 1.8 3.81 2015 1746 A 43 LEU HDx% A 32 PHE HE% 1.0 1.8 3.71 2016 1747 A 43 LEU HDx% A 32 PHE HD% 1.0 1.8 3.66 2017 1748 A 43 LEU HDx% A 60 PHE HE% 1.0 1.8 3.63 2018 1749 A 60 PHE HE% A 22 VAL HGx% 1.0 1.8 4.31 2019 1750 A 29 VAL HA A 23 ALA HA 1.0 1.8 4.05 2020 1751 A 31 GLN HA A 21 LYS HA 1.0 1.8 4.30 2021 1752 A 60 PHE HA A 86 VAL HA 1.0 1.8 3.84 2022 1753 A 61 ARG HA A 66 PRO HA 1.0 1.8 4.60 2023 1754 A 67 ILE HG12 A 62 PHE HA 1.0 1.8 4.96 2024 1755 A 56 ARG HA A 55 MET HB2 1.0 1.8 4.86 2025 1756 A 40 LEU HG A 73 PRO HDx 1.0 1.8 4.84 2026 1756 A 40 LEU HG A 73 PRO HDy 1.0 1.8 4.84 2027 1757 A 12 THR HB A 10 VAL HGx% 1.0 1.8 5.66 2028 1757 A 10 VAL HGy% A 12 THR HB 1.0 1.8 5.66 2029 1758 A 34 ILE HD1% A 73 PRO HDx 1.0 1.8 4.58 2030 1758 A 34 ILE HD1% A 73 PRO HDy 1.0 1.8 4.58 2031 1759 A 41 SER HA A 40 LEU HDy% 1.0 1.8 5.28 2032 1760 A 41 SER HA A 40 LEU HDx% 1.0 1.8 5.28 2033 1761 A 20 LEU HB3 A 19 ASN HA 1.0 1.8 5.78 2034 1762 A 85 ASP HA A 84 ILE HB 1.0 1.8 4.94 2035 1763 A 60 PHE HA A 67 ILE HB 1.0 1.8 4.95 2036 1764 A 85 ASP HA A 86 VAL HB 1.0 1.8 5.61 2037 1765 A 23 ALA HA A 29 VAL HGx% 1.0 1.8 4.01 2038 1766 A 61 ARG HA A 62 PHE HB2 1.0 1.8 4.53 2039 1767 A 61 ARG HA A 61 ARG HG2 1.0 1.8 3.86 2040 1768 A 67 ILE HD1% A 61 ARG HA 1.0 1.8 4.16 2041 1769 A 61 ARG HA A 85 ASP HBx 1.0 1.8 5.01 2042 1769 A 85 ASP HBy A 61 ARG HA 1.0 1.8 5.01 2043 1770 A 83 THR HA A 21 LYS HB2 1.0 1.8 3.98 2044 1771 A 83 THR HA A 84 ILE HB 1.0 1.8 4.93 2045 1772 A 72 THR HA A 39 PRO HB3 1.0 1.8 5.38 2046 1773 A 20 LEU HA A 21 LYS HB2 1.0 1.8 4.93 2047 1774 A 21 LYS HG3 A 20 LEU HA 1.0 1.8 4.64 2048 1775 A 20 LEU HA A 20 LEU HDy% 1.0 1.8 3.88 2049 1776 A 20 LEU HA A 20 LEU HDx% 1.0 1.8 3.88 2050 1777 A 72 THR HA A 73 PRO HG2 1.0 1.8 4.62 2051 1778 A 72 THR HA A 40 LEU HG 1.0 1.8 5.31 2052 1779 A 72 THR HA A 40 LEU HDy% 1.0 1.8 4.50 2053 1780 A 69 GLU HB3 A 68 ASN HA 1.0 1.8 4.71 2054 1781 A 58 ILE HA A 88 GLN HG3 1.0 1.8 4.75 2055 1782 A 44 MET HE% A 68 ASN HA 1.0 1.8 3.53 2056 1783 A 67 ILE HG2% A 68 ASN HA 1.0 1.8 4.52 2057 1784 A 29 VAL HA A 23 ALA HB% 1.0 1.8 4.01 2058 1785 A 58 ILE HA A 58 ILE HG12 1.0 1.8 4.07 2059 1786 A 29 VAL HA A 30 VAL HGy% 1.0 1.8 3.74 2060 1787 A 29 VAL HA A 29 VAL HGx% 1.0 1.8 3.18 2061 1788 A 58 ILE HA A 58 ILE HD1% 1.0 1.8 4.23 2062 1789 A 65 GLN HA A 65 GLN HGx 1.0 1.8 3.81 2063 1790 A 31 GLN HG3 A 21 LYS HA 1.0 1.8 4.60 2064 1791 A 35 LYS HB3 A 17 HIS HA 1.0 1.8 4.59 2065 1792 A 31 GLN HB3 A 21 LYS HA 1.0 1.8 5.14 2066 1793 A 22 VAL HA A 84 ILE HB 1.0 1.8 3.86 2067 1794 A 22 VAL HA A 23 ALA HB% 1.0 1.8 3.97 2068 1795 A 21 LYS HG3 A 21 LYS HA 1.0 1.8 3.91 2069 1796 A 22 VAL HA A 83 THR HG2% 1.0 1.8 3.90 2070 1797 A 34 ILE HA A 34 ILE HG12 1.0 1.8 3.99 2071 1798 A 21 LYS HG2 A 21 LYS HA 1.0 1.8 3.66 2072 1799 A 78 MET HE% A 82 ASP HA 1.0 1.8 5.82 2073 1800 A 36 ARG HG3 A 37 HIS HA 1.0 1.8 4.70 2074 1801 A 55 MET HE% A 54 SER HA 1.0 1.8 5.84 2075 1802 A 66 PRO HA A 65 GLN HB2 1.0 1.8 6.00 2076 1803 A 88 GLN HB3 A 87 PHE HA 1.0 1.8 6.00 2077 1804 A 31 GLN HB2 A 32 PHE HA 1.0 1.8 4.99 2078 1805 A 67 ILE HB A 66 PRO HA 1.0 1.8 5.55 2079 1806 A 86 VAL HA A 58 ILE HB 1.0 1.8 6.00 2080 1807 A 58 ILE HB A 87 PHE HA 1.0 1.8 6.00 2081 1808 A 66 PRO HA A 61 ARG HB2 1.0 1.8 4.37 2082 1809 A 66 PRO HA A 61 ARG HG2 1.0 1.8 4.00 2083 1810 A 86 VAL HA A 58 ILE HG13 1.0 1.8 5.37 2084 1811 A 84 ILE HG2% A 86 VAL HA 1.0 1.8 4.40 2085 1812 A 86 VAL HA A 58 ILE HD1% 1.0 1.8 5.29 2086 1813 A 67 ILE HG13 A 66 PRO HA 1.0 1.8 4.19 2087 1814 A 53 LEU HA A 53 LEU HDy% 1.0 1.8 4.16 2088 1815 A 59 ARG HA A 89 GLN HGx 1.0 1.8 4.48 2089 1815 A 89 GLN HGy A 59 ARG HA 1.0 1.8 4.48 2090 1816 A 58 ILE HB A 88 GLN HA 1.0 1.8 3.77 2091 1817 A 59 ARG HG3 A 59 ARG HA 1.0 1.8 3.97 2092 1818 A 58 ILE HG12 A 59 ARG HA 1.0 1.8 5.22 2093 1819 A 58 ILE HG13 A 59 ARG HA 1.0 1.8 4.44 2094 1820 A 17 HIS HB2 A 18 ILE HA 1.0 1.8 5.13 2095 1821 A 59 ARG HA A 59 ARG HG2 1.0 1.8 3.47 2096 1822 A 18 ILE HA A 18 ILE HG12 1.0 1.8 4.07 2097 1823 A 18 ILE HD1% A 18 ILE HA 1.0 1.8 4.47 2098 1824 A 84 ILE HA A 85 ASP HBx 1.0 1.8 4.70 2099 1824 A 84 ILE HA A 85 ASP HBy 1.0 1.8 4.70 2100 1825 A 86 VAL HB A 24 GLY HAy 1.0 1.8 4.65 2101 1826 A 84 ILE HA A 83 THR HG2% 1.0 1.8 4.17 2102 1827 A 80 ASP HA A 20 LEU HDy% 1.0 1.8 4.65 2103 1828 A 84 ILE HA A 84 ILE HG12 1.0 1.8 4.03 2104 1829 A 24 GLY HAy A 25 GLN HGx 1.0 1.8 4.48 2105 1829 A 25 GLN HGy A 24 GLY HAy 1.0 1.8 4.48 2106 1830 A 80 ASP HA A 20 LEU HDx% 1.0 1.8 4.65 2107 1831 A 84 ILE HA A 67 ILE HD1% 1.0 1.8 5.02 2108 1832 A 18 ILE HG2% A 79 GLU HA 1.0 1.8 4.20 2109 1833 A 79 GLU HA A 79 GLU HG2 1.0 1.8 3.67 2110 1834 A 35 LYS HA A 17 HIS HB2 1.0 1.8 4.30 2111 1835 A 38 THR HG2% A 35 LYS HA 1.0 1.8 5.03 2112 1836 A 35 LYS HA A 17 HIS HB3 1.0 1.8 4.37 2113 1837 A 11 LYS HA A 11 LYS HDx 1.0 1.8 3.69 2114 1837 A 11 LYS HDy A 11 LYS HA 1.0 1.8 3.69 2115 1838 A 72 THR HB A 73 PRO HG2 1.0 1.8 4.53 2116 1839 A 5 LYS HA A 5 LYS HGx 1.0 1.8 3.64 2117 1839 A 5 LYS HGy A 5 LYS HA 1.0 1.8 3.64 2118 1840 A 67 ILE HD1% A 67 ILE HA 1.0 1.8 3.93 2119 1841 A 11 LYS HA A 11 LYS HGx 1.0 1.8 3.65 2120 1841 A 11 LYS HA A 11 LYS HGy 1.0 1.8 3.65 2121 1842 A 67 ILE HG13 A 67 ILE HA 1.0 1.8 4.05 2122 1843 A 11 LYS HA A 12 THR HG2% 1.0 1.8 4.58 2123 1844 A 55 MET HA A 48 CYS HBy 1.0 1.8 4.99 2124 1845 A 46 ALA HA A 49 GLU HG3 1.0 1.8 4.20 2125 1846 A 7 LYS HA A 7 LYS HEx 1.0 1.8 6.00 2126 1846 A 7 LYS HEy A 7 LYS HA 1.0 1.8 6.00 2127 1847 A 8 GLU HA A 7 LYS HEx 1.0 1.8 6.00 2128 1847 A 7 LYS HEy A 8 GLU HA 1.0 1.8 6.00 2129 1848 A 76 LEU HDx% A 73 PRO HA 1.0 1.8 3.74 2130 1849 A 47 TYR HA A 51 GLN HB2 1.0 1.8 4.88 2131 1850 A 47 TYR HA A 22 VAL HGy% 1.0 1.8 5.87 2132 1851 A 45 LYS HA A 45 LYS HGx 1.0 1.8 3.77 2133 1852 A 8 GLU HGx A 9 GLY HAx 1.0 1.8 5.48 2134 1852 A 8 GLU HGy A 9 GLY HAx 1.0 1.8 5.48 2135 1852 A 9 GLY HAy A 8 GLU HGx 1.0 1.8 5.48 2136 1852 A 9 GLY HAy A 8 GLU HGy 1.0 1.8 5.48 2137 1853 A 57 GLN HB3 A 54 SER HBy 1.0 1.8 5.82 2138 1854 A 52 GLY HAy A 53 LEU HDy% 1.0 1.8 5.02 2139 1854 A 52 GLY HAx A 53 LEU HDy% 1.0 1.8 5.02 2140 1855 A 67 ILE HG2% A 69 GLU HA 1.0 1.8 4.75 2141 1856 A 36 ARG HD2 A 36 ARG HA 1.0 1.8 4.45 2142 1857 A 32 PHE HB2 A 43 LEU HA 1.0 1.8 5.12 2143 1858 A 73 PRO HB2 A 36 ARG HA 1.0 1.8 4.39 2144 1859 A 36 ARG HA A 18 ILE HG12 1.0 1.8 4.60 2145 1860 A 61 ARG HG3 A 64 GLY HA2 1.0 1.8 4.68 2146 1861 A 36 ARG HD2 A 37 HIS HB2 1.0 1.8 4.43 2147 1862 A 36 ARG HG3 A 37 HIS HB2 1.0 1.8 4.65 2148 1863 A 30 VAL HGx% A 47 TYR HB2 1.0 1.8 4.67 2149 1864 A 22 VAL HB A 47 TYR HB2 1.0 1.8 5.04 2150 1865 A 47 TYR HB2 A 50 ARG HGx 1.0 1.8 4.54 2151 1865 A 50 ARG HGy A 47 TYR HB2 1.0 1.8 4.54 2152 1866 A 44 MET HA A 43 LEU HB2 1.0 1.8 5.47 2153 1867 A 47 TYR HB2 A 43 LEU HB2 1.0 1.8 5.79 2154 1868 A 44 MET HA A 55 MET HE% 1.0 1.8 4.31 2155 1869 A 30 VAL HB A 47 TYR HB2 1.0 1.8 4.63 2156 1870 A 55 MET HGy A 48 CYS HBy 1.0 1.8 4.55 2157 1870 A 48 CYS HBy A 55 MET HGx 1.0 1.8 4.55 2158 1871 A 30 VAL HB A 50 ARG HD3 1.0 1.8 5.09 2159 1872 A 55 MET HGy A 48 CYS HBx 1.0 1.8 4.55 2160 1872 A 48 CYS HBx A 55 MET HGx 1.0 1.8 4.55 2161 1873 A 55 MET HE% A 48 CYS HBx 1.0 1.8 4.38 2162 1874 A 47 TYR HB3 A 44 MET HBx 1.0 1.8 5.09 2163 1874 A 44 MET HBy A 47 TYR HB3 1.0 1.8 5.09 2164 1875 A 47 TYR HB3 A 51 GLN HGx 1.0 1.8 5.49 2165 1875 A 47 TYR HB3 A 51 GLN HGy 1.0 1.8 5.49 2166 1876 A 22 VAL HB A 47 TYR HB3 1.0 1.8 5.72 2167 1877 A 58 ILE HD1% A 47 TYR HB3 1.0 1.8 4.76 2168 1878 A 32 PHE HB2 A 34 ILE HG2% 1.0 1.8 3.79 2169 1879 A 55 MET HB2 A 45 LYS HEx 1.0 1.8 4.67 2170 1879 A 45 LYS HEy A 55 MET HB2 1.0 1.8 4.67 2171 1880 A 55 MET HE% A 45 LYS HEx 1.0 1.8 3.51 2172 1880 A 55 MET HE% A 45 LYS HEy 1.0 1.8 3.51 2173 1881 A 81 GLU HBx A 21 LYS HE3 1.0 1.8 4.45 2174 1882 A 35 LYS HB3 A 37 HIS HB3 1.0 1.8 4.77 2175 1883 A 31 GLN HG3 A 21 LYS HE2 1.0 1.8 5.22 2176 1884 A 31 GLN HG3 A 21 LYS HE3 1.0 1.8 5.51 2177 1885 A 60 PHE HB2 A 67 ILE HG13 1.0 1.8 4.42 2178 1886 A 62 PHE HB3 A 67 ILE HG13 1.0 1.8 4.58 2179 1887 A 21 LYS HE2 A 21 LYS HB2 1.0 1.8 4.53 2180 1888 A 21 LYS HE2 A 31 GLN HG2 1.0 1.8 4.97 2181 1889 A 45 LYS HDx A 55 MET HGx 1.0 1.8 4.16 2182 1889 A 45 LYS HDy A 55 MET HGx 1.0 1.8 4.16 2183 1889 A 55 MET HGy A 45 LYS HDx 1.0 1.8 4.16 2184 1889 A 45 LYS HDy A 55 MET HGy 1.0 1.8 4.16 2185 1890 A 81 GLU HBy A 80 ASP HBx 1.0 1.8 5.08 2186 1890 A 80 ASP HBy A 81 GLU HBy 1.0 1.8 5.08 2187 1891 A 78 MET HB2 A 82 ASP HBx 1.0 1.8 4.55 2188 1892 A 65 GLN HB3 A 63 ASP HB2 1.0 1.8 5.97 2189 1893 A 18 ILE HB A 80 ASP HBx 1.0 1.8 4.02 2190 1893 A 18 ILE HB A 80 ASP HBy 1.0 1.8 4.02 2191 1894 A 65 GLN HGy A 63 ASP HB2 1.0 1.8 4.66 2192 1895 A 76 LEU HDy% A 63 ASP HB2 1.0 1.8 4.50 2193 1896 A 65 GLN HGx A 63 ASP HB2 1.0 1.8 4.18 2194 1897 A 60 PHE HB3 A 67 ILE HB 1.0 1.8 4.04 2195 1898 A 76 LEU HB3 A 63 ASP HB2 1.0 1.8 4.61 2196 1899 A 61 ARG HB2 A 85 ASP HBx 1.0 1.8 4.41 2197 1899 A 85 ASP HBy A 61 ARG HB2 1.0 1.8 4.41 2198 1900 A 43 LEU HB2 A 32 PHE HB3 1.0 1.8 4.55 2199 1901 A 34 ILE HG2% A 32 PHE HB3 1.0 1.8 3.91 2200 1902 A 61 ARG HB3 A 85 ASP HBx 1.0 1.8 4.15 2201 1902 A 61 ARG HB3 A 85 ASP HBy 1.0 1.8 4.15 2202 1903 A 46 ALA HB% A 49 GLU HG3 1.0 1.8 5.30 2203 1904 A 63 ASP HB3 A 65 GLN HGy 1.0 1.8 4.63 2204 1905 A 76 LEU HDy% A 65 GLN HGx 1.0 1.8 4.60 2205 1906 A 63 ASP HB3 A 65 GLN HGx 1.0 1.8 3.96 2206 1907 A 42 LYS HG3 A 39 PRO HB2 1.0 1.8 4.09 2207 1908 A 59 ARG HG2 A 89 GLN HGx 1.0 1.8 3.55 2208 1908 A 89 GLN HGy A 59 ARG HG2 1.0 1.8 3.55 2209 1909 A 7 LYS HDy A 8 GLU HGx 1.0 1.8 3.89 2210 1909 A 8 GLU HGy A 7 LYS HDx 1.0 1.8 3.89 2211 1909 A 7 LYS HDy A 8 GLU HGy 1.0 1.8 3.89 2212 1909 A 7 LYS HDx A 8 GLU HGx 1.0 1.8 3.89 2213 1910 A 58 ILE HD1% A 57 GLN HB3 1.0 1.8 5.04 2214 1911 A 58 ILE HG2% A 57 GLN HB3 1.0 1.8 3.96 2215 1912 A 31 GLN HG3 A 21 LYS HB3 1.0 1.8 3.53 2216 1913 A 78 MET HG3 A 20 LEU HDy% 1.0 1.8 4.37 2217 1914 A 44 MET HE% A 55 MET HE% 1.0 1.8 3.44 2218 1915 A 55 MET HE% A 45 LYS HGx 1.0 1.8 3.65 2219 1916 A 58 ILE HD1% A 55 MET HE% 1.0 1.8 3.81 2220 1917 A 31 GLN HB2 A 21 LYS HG3 1.0 1.8 5.80 2221 1918 A 36 ARG HB2 A 73 PRO HG3 1.0 1.8 6.00 2222 1919 A 84 ILE HD1% A 22 VAL HB 1.0 1.8 5.48 2223 1920 A 22 VAL HB A 84 ILE HB 1.0 1.8 3.36 2224 1921 A 34 ILE HD1% A 73 PRO HG3 1.0 1.8 3.99 2225 1922 A 21 LYS HE3 A 21 LYS HB2 1.0 1.8 4.09 2226 1923 A 50 ARG HGx A 51 GLN HGx 1.0 1.8 2.86 2227 1923 A 50 ARG HGy A 51 GLN HGx 1.0 1.8 2.86 2228 1923 A 51 GLN HGy A 50 ARG HGx 1.0 1.8 2.86 2229 1923 A 50 ARG HGy A 51 GLN HGy 1.0 1.8 2.86 2230 1924 A 56 ARG HB2 A 56 ARG HGx 1.0 1.8 2.80 2231 1924 A 56 ARG HGy A 56 ARG HB2 1.0 1.8 2.80 2232 1925 A 21 LYS HG2 A 31 GLN HB3 1.0 1.8 3.64 2233 1926 A 78 MET HB2 A 82 ASP HBy 1.0 1.8 4.55 2234 1927 A 40 LEU HB3 A 73 PRO HB3 1.0 1.8 4.26 2235 1928 A 61 ARG HB3 A 61 ARG HD3 1.0 1.8 4.11 2236 1929 A 5 LYS HBx A 5 LYS HGx 1.0 1.8 2.83 2237 1929 A 5 LYS HBy A 5 LYS HGx 1.0 1.8 2.83 2238 1929 A 5 LYS HGy A 5 LYS HBx 1.0 1.8 2.83 2239 1929 A 5 LYS HGy A 5 LYS HBy 1.0 1.8 2.83 2240 1930 A 76 LEU HG A 75 GLN HGx 1.0 1.8 4.87 2241 1930 A 76 LEU HG A 75 GLN HGy 1.0 1.8 4.87 2242 1931 A 39 PRO HG2 A 42 LYS HDx 1.0 1.8 3.54 2243 1931 A 42 LYS HDy A 39 PRO HG2 1.0 1.8 3.54 2244 1932 A 84 ILE HG2% A 67 ILE HB 1.0 1.8 4.51 2245 1933 A 76 LEU HDy% A 76 LEU HB3 1.0 1.8 3.06 2246 1934 A 50 ARG HD2 A 51 GLN HGx 1.0 1.8 4.69 2247 1934 A 50 ARG HD2 A 51 GLN HGy 1.0 1.8 4.69 2248 1935 A 45 LYS HBx A 45 LYS HDx 1.0 1.8 3.77 2249 1935 A 45 LYS HBy A 45 LYS HDx 1.0 1.8 3.77 2250 1935 A 45 LYS HDy A 45 LYS HBx 1.0 1.8 3.77 2251 1935 A 45 LYS HBy A 45 LYS HDy 1.0 1.8 3.77 2252 1936 A 84 ILE HG2% A 84 ILE HG13 1.0 1.8 3.43 2253 1937 A 73 PRO HG2 A 72 THR HG2% 1.0 1.8 3.91 2254 1938 A 31 GLN HG2 A 21 LYS HDx 1.0 1.8 4.23 2255 1938 A 21 LYS HDy A 31 GLN HG2 1.0 1.8 4.23 2256 1939 A 74 ALA HB% A 73 PRO HG2 1.0 1.8 3.75 2257 1940 A 55 MET HE% A 45 LYS HGy 1.0 1.8 3.65 2258 1941 A 76 LEU HB2 A 63 ASP HB2 1.0 1.8 4.93 2259 1942 A 31 GLN HG3 A 21 LYS HDx 1.0 1.8 3.80 2260 1942 A 31 GLN HG3 A 21 LYS HDy 1.0 1.8 3.80 2261 1943 A 46 ALA HB% A 50 ARG HB3 1.0 1.8 4.38 2262 1944 A 67 ILE HG2% A 40 LEU HG 1.0 1.8 3.98 2263 1945 A 36 ARG HB3 A 36 ARG HD3 1.0 1.8 4.06 2264 1946 A 44 MET HE% A 69 GLU HB3 1.0 1.8 3.78 2265 1947 A 44 MET HE% A 44 MET HBx 1.0 1.8 2.92 2266 1947 A 44 MET HE% A 44 MET HBy 1.0 1.8 2.92 2267 1948 A 36 ARG HB3 A 18 ILE HG12 1.0 1.8 3.41 2268 1949 A 42 LYS HG2 A 42 LYS HDx 1.0 1.8 2.60 2269 1949 A 42 LYS HDy A 42 LYS HG2 1.0 1.8 2.60 2270 1950 A 38 THR HG2% A 34 ILE HG2% 1.0 1.8 3.31 2271 1951 A 43 LEU HB3 A 34 ILE HG2% 1.0 1.8 3.52 2272 1952 A 78 MET HE% A 20 LEU HG 1.0 1.8 3.73 2273 1953 A 51 GLN HB2 A 50 ARG HGx 1.0 1.8 3.78 2274 1953 A 50 ARG HGy A 51 GLN HB2 1.0 1.8 3.78 2275 1954 A 34 ILE HG2% A 34 ILE HG13 1.0 1.8 3.39 2276 1955 A 78 MET HE% A 78 MET HB3 1.0 1.8 2.81 2277 1956 A 36 ARG HB2 A 74 ALA HB% 1.0 1.8 3.70 2278 1957 A 76 LEU HDx% A 78 MET HB3 1.0 1.8 3.63 2279 1958 A 31 GLN HB2 A 21 LYS HG2 1.0 1.8 3.84 2280 1959 A 20 LEU HB3 A 20 LEU HDy% 1.0 1.8 3.45 2281 1960 A 84 ILE HG2% A 78 MET HE% 1.0 1.8 4.77 2282 1961 A 58 ILE HG13 A 55 MET HE% 1.0 1.8 4.85 2283 1962 A 73 PRO HB2 A 78 MET HE% 1.0 1.8 5.20 2284 1963 A 78 MET HE% A 78 MET HB2 1.0 1.8 4.62 2285 1964 A 76 LEU HDy% A 78 MET HE% 1.0 1.8 3.59 2286 1965 A 76 LEU HDx% A 78 MET HE% 1.0 1.8 3.25 2287 1966 A 30 VAL HGy% A 50 ARG HGx 1.0 1.8 3.68 2288 1966 A 30 VAL HGy% A 50 ARG HGy 1.0 1.8 3.68 2289 1967 A 30 VAL HGy% A 22 VAL HB 1.0 1.8 4.93 2290 1968 A 30 VAL HGy% A 22 VAL HGy% 1.0 1.8 4.51 2291 1969 A 34 ILE HD1% A 40 LEU HB3 1.0 1.8 3.75 2292 1970 A 40 LEU HB3 A 40 LEU HDy% 1.0 1.8 3.59 2293 1971 A 73 PRO HG3 A 40 LEU HB3 1.0 1.8 4.31 2294 1972 A 84 ILE HG2% A 62 PHE HB2 1.0 1.8 4.40 2295 1973 A 84 ILE HG2% A 84 ILE HG12 1.0 1.8 3.24 2296 1974 A 84 ILE HG2% A 67 ILE HD1% 1.0 1.8 3.12 2297 1975 A 84 ILE HG2% A 22 VAL HGy% 1.0 1.8 4.30 2298 1976 A 67 ILE HG2% A 40 LEU HB3 1.0 1.8 4.73 2299 1977 A 34 ILE HD1% A 34 ILE HG2% 1.0 1.8 2.77 2300 1978 A 84 ILE HB A 22 VAL HGy% 1.0 1.8 3.96 2301 1979 A 30 VAL HGx% A 50 ARG HGx 1.0 1.8 4.19 2302 1979 A 30 VAL HGx% A 50 ARG HGy 1.0 1.8 4.19 2303 1980 A 34 ILE HD1% A 34 ILE HB 1.0 1.8 3.52 2304 1981 A 78 MET HG3 A 20 LEU HDx% 1.0 1.8 4.37 2305 1982 A 84 ILE HD1% A 84 ILE HB 1.0 1.8 3.34 2306 1983 A 67 ILE HG2% A 40 LEU HDx% 1.0 1.8 3.10 2307 1984 A 84 ILE HD1% A 67 ILE HD1% 1.0 1.8 2.64 2308 1985 A 18 ILE HD1% A 73 PRO HG3 1.0 1.8 4.29 2309 1986 A 18 ILE HD1% A 73 PRO HB3 1.0 1.8 3.97 2310 1987 A 18 ILE HD1% A 20 LEU HG 1.0 1.8 3.64 2311 1988 A 18 ILE HD1% A 74 ALA HB% 1.0 1.8 4.64 2312 1989 A 43 LEU HDy% A 20 LEU HB3 1.0 1.8 4.10 2313 1990 A 43 LEU HDy% A 44 MET HA 1.0 1.8 4.96 2314 1991 A 43 LEU HDy% A 34 ILE HB 1.0 1.8 5.23 2315 1992 A 43 LEU HDy% A 73 PRO HB3 1.0 1.8 5.52 2316 1993 A 43 LEU HDy% A 84 ILE HG13 1.0 1.8 4.35 2317 1994 A 43 LEU HDy% A 78 MET HE% 1.0 1.8 4.48 2318 1995 A 43 LEU HDy% A 34 ILE HG2% 1.0 1.8 3.35 2319 1996 A 43 LEU HDy% A 20 LEU HDy% 1.0 1.8 4.13 2320 1997 A 84 ILE HG2% A 86 VAL HGy% 1.0 1.8 4.73 2321 1998 A 58 ILE HD1% A 86 VAL HGy% 1.0 1.8 3.52 2322 1999 A 43 LEU HDx% A 47 TYR HB3 1.0 1.8 4.62 2323 2000 A 43 LEU HDx% A 22 VAL HB 1.0 1.8 4.39 2324 2001 A 43 LEU HDx% A 84 ILE HB 1.0 1.8 4.65 2325 2002 A 43 LEU HDx% A 44 MET HBx 1.0 1.8 4.21 2326 2002 A 43 LEU HDx% A 44 MET HBy 1.0 1.8 4.21 2327 2003 A 43 LEU HDx% A 46 ALA HB% 1.0 1.8 4.70 2328 2004 A 43 LEU HDx% A 43 LEU HB2 1.0 1.8 3.85 2329 2005 A 43 LEU HDx% A 78 MET HE% 1.0 1.8 5.49 2330 2006 A 43 LEU HDx% A 84 ILE HG12 1.0 1.8 4.42 2331 2007 A 47 TYR HB2 A 22 VAL HGx% 1.0 1.8 5.28 2332 2008 A 84 ILE HB A 22 VAL HGx% 1.0 1.8 3.96 2333 2009 A 84 ILE HG2% A 22 VAL HGx% 1.0 1.8 4.30 2334 2010 A 61 ARG H A 67 ILE HB 1.0 1.8 4.76 2335 2011 A 61 ARG H A 61 ARG HG2 1.0 1.8 4.70 2336 2012 A 61 ARG H A 85 ASP HBx 1.0 1.8 4.54 2337 2012 A 61 ARG H A 85 ASP HBy 1.0 1.8 4.54 2338 2013 A 63 ASP H A 61 ARG HD3 1.0 1.8 5.01 2339 2014 A 81 GLU H A 19 ASN HBx 1.0 1.8 4.79 2340 2015 A 81 GLU H A 81 GLU HGx 1.0 1.8 4.12 2341 2016 A 84 ILE H A 23 ALA HB% 1.0 1.8 4.28 2342 2017 A 84 ILE H A 21 LYS HB2 1.0 1.8 4.73 2343 2018 A 84 ILE H A 21 LYS HB3 1.0 1.8 5.03 2344 2019 A 84 ILE HG2% A 84 ILE H 1.0 1.8 3.96 2345 2020 A 84 ILE H A 22 VAL HGy% 1.0 1.8 4.79 2346 2021 A 23 ALA H A 84 ILE HB 1.0 1.8 4.38 2347 2022 A 71 ASP HB2 A 68 ASN H 1.0 1.8 4.57 2348 2023 A 44 MET HE% A 68 ASN H 1.0 1.8 4.07 2349 2024 A 22 VAL H A 21 LYS HG2 1.0 1.8 4.51 2350 2025 A 23 ALA HB% A 22 VAL H 1.0 1.8 5.42 2351 2026 A 67 ILE HG13 A 68 ASN H 1.0 1.8 5.83 2352 2027 A 67 ILE HG2% A 69 GLU H 1.0 1.8 4.82 2353 2028 A 19 ASN H A 80 ASP HBx 1.0 1.8 4.32 2354 2028 A 19 ASN H A 80 ASP HBy 1.0 1.8 4.32 2355 2029 A 55 MET H A 56 ARG HGx 1.0 1.8 4.48 2356 2029 A 56 ARG HGy A 55 MET H 1.0 1.8 4.48 2357 2030 A 19 ASN H A 18 ILE HG12 1.0 1.8 5.37 2358 2031 A 62 PHE H A 67 ILE HG2% 1.0 1.8 5.81 2359 2032 A 55 MET HE% A 47 TYR H 1.0 1.8 4.81 2360 2033 A 88 GLN HB3 A 90 GLN H 1.0 1.8 4.72 2361 2034 A 21 LYS HG3 A 21 LYS H 1.0 1.8 4.33 2362 2035 A 41 SER H A 44 MET HGy 1.0 1.8 6.00 2363 2036 A 67 ILE HG2% A 41 SER H 1.0 1.8 5.32 2364 2037 A 76 LEU HDx% A 74 ALA H 1.0 1.8 4.75 2365 2038 A 35 LYS H A 34 ILE HG13 1.0 1.8 4.71 2366 2039 A 12 THR H A 10 VAL HGx% 1.0 1.8 4.81 2367 2039 A 10 VAL HGy% A 12 THR H 1.0 1.8 4.81 2368 2040 A 4 GLU H A 3 ASP HBy 1.0 1.8 4.54 2369 2041 A 67 ILE H A 61 ARG HB3 1.0 1.8 5.36 2370 2042 A 44 MET HE% A 42 LYS H 1.0 1.8 5.38 2371 2043 A 56 ARG HB2 A 57 GLN HE21 1.0 1.8 4.77 2372 2044 A 46 ALA H A 49 GLU HB2 1.0 1.8 4.93 2373 2045 A 31 GLN HB2 A 31 GLN HE22 1.0 1.8 4.53 2374 2046 A 36 ARG HG3 A 38 THR H 1.0 1.8 5.07 2375 2047 A 62 PHE HD% A 65 GLN HGy 1.0 1.8 4.63 2376 2048 A 50 ARG HD2 A 32 PHE HZ 1.0 1.8 5.48 2377 2049 A 32 PHE HE% A 50 ARG HGx 1.0 1.8 4.72 2378 2049 A 50 ARG HGy A 32 PHE HE% 1.0 1.8 4.72 2379 2050 A 20 LEU HB2 A 32 PHE HD% 1.0 1.8 4.68 2380 2051 A 76 LEU HDy% A 65 GLN HE22 1.0 1.8 4.80 2381 2052 A 31 GLN HE21 A 29 VAL HGy% 1.0 1.8 5.00 2382 2053 A 84 ILE H A 83 THR HB 1.0 1.8 4.42 2383 2054 A 27 GLY H A 28 SER HBy 1.0 1.8 5.38 2384 2055 A 61 ARG H A 87 PHE HE% 1.0 1.8 4.36 2385 2056 A 84 ILE H A 21 LYS H 1.0 1.8 4.47 2386 2057 A 32 PHE HD% A 22 VAL H 1.0 1.8 4.88 2387 2058 A 47 TYR HD% A 22 VAL H 1.0 1.8 5.30 2388 2059 A 58 ILE HD1% A 47 TYR HE% 1.0 1.8 3.42 2389 2060 A 43 LEU HG A 47 TYR H 1.0 1.8 6.00 2390 2061 A 58 ILE HD1% A 47 TYR H 1.0 1.8 6.00 2391 2062 A 43 LEU HDx% A 42 LYS H 1.0 1.8 6.00 2392 2063 A 43 LEU HDy% A 42 LYS H 1.0 1.8 5.21 2393 2064 A 43 LEU HDx% A 46 ALA H 1.0 1.8 5.16 2394 2065 A 43 LEU HDy% A 41 SER H 1.0 1.8 5.62 2395 2066 A 41 SER H A 44 MET HGx 1.0 1.8 6.00 2396 2067 A 43 LEU HDx% A 48 CYS H 1.0 1.8 5.95 2397 2068 A 23 ALA H A 47 TYR HE% 1.0 1.8 5.41 2398 2069 A 18 ILE HD1% A 36 ARG HD2 1.0 1.8 6.00 2399 2070 A 21 LYS HA A 21 LYS HDx 1.0 1.8 4.10 2400 2070 A 21 LYS HDy A 21 LYS HA 1.0 1.8 4.10 2401 2071 A 5 LYS H A 4 GLU HA 1.0 1.8 3.30 2402 2072 A 47 TYR HA A 32 PHE HZ 1.0 1.8 3.49 2403 2073 A 65 GLN HGy A 65 GLN HE21 1.0 1.8 3.54 2404 2074 A 87 PHE HE% A 89 GLN HGx 1.0 1.8 4.49 2405 2074 A 89 GLN HGy A 87 PHE HE% 1.0 1.8 4.49 2406 2075 A 66 PRO HB3 A 87 PHE HZ 1.0 1.8 4.33 2407 2076 A 87 PHE HE% A 66 PRO HB3 1.0 1.8 5.81 2408 2077 A 65 GLN HE21 A 76 LEU HB3 1.0 1.8 4.07 2409 2078 A 30 VAL HGy% A 50 ARG H 1.0 1.8 5.51 2410 2079 A 86 VAL H A 87 PHE HD% 1.0 1.8 4.52 2411 2080 A 61 ARG H A 87 PHE HD% 1.0 1.8 5.38 2412 2081 A 40 LEU H A 41 SER HA 1.0 1.8 5.22 2413 2082 A 46 ALA HA A 32 PHE HE% 1.0 1.8 5.66 2414 2083 A 54 SER HBy A 56 ARG HDx 1.0 1.8 4.38 2415 2083 A 56 ARG HDy A 54 SER HBy 1.0 1.8 4.38 2416 2084 A 87 PHE H A 59 ARG HB2 1.0 1.8 4.43 2417 2085 A 86 VAL H A 83 THR HG2% 1.0 1.8 5.63 2418 2086 A 62 PHE HZ A 78 MET HB2 1.0 1.8 4.07 2419 2087 A 74 ALA HB% A 72 THR HB 1.0 1.8 3.37 2420 2088 A 65 GLN HGy A 66 PRO HD2 1.0 1.8 4.45 2421 2089 A 36 ARG HA A 73 PRO HB3 1.0 1.8 4.50 2422 2090 A 50 ARG HB3 A 50 ARG HD3 1.0 1.8 3.87 2423 2091 A 55 MET HGy A 45 LYS HGx 1.0 1.8 4.53 2424 2091 A 45 LYS HGx A 55 MET HGx 1.0 1.8 4.53 2425 2092 A 38 THR HG2% A 39 PRO HG2 1.0 1.8 3.44 2426 2093 A 70 THR HG2% A 68 ASN HB2 1.0 1.8 4.41 2427 2094 A 43 LEU HDx% A 32 PHE HB2 1.0 1.8 4.70 2428 2095 A 43 LEU HDx% A 32 PHE HB3 1.0 1.8 5.25 2429 2096 A 21 LYS HG2 A 31 GLN HE21 1.0 1.8 4.95 2430 2097 A 47 TYR HE% A 24 GLY HAy 1.0 1.8 5.23 2431 2098 A 43 LEU HDx% A 47 TYR HA 1.0 1.8 5.09 2432 2099 A 47 TYR HA A 22 VAL HGx% 1.0 1.8 5.87 2433 2100 A 1 MET HA A 1 MET HGy 1.0 1.8 3.61 2434 2100 A 1 MET HA A 1 MET HGx 1.0 1.8 3.61 2435 2101 A 1 MET HE% A 1 MET HGy 1.0 1.8 2.88 2436 2101 A 1 MET HE% A 1 MET HGx 1.0 1.8 2.88 2437 2102 A 2 ALA HA A 1 MET HGy 1.0 1.8 5.37 2438 2102 A 2 ALA HA A 1 MET HGx 1.0 1.8 5.37 2439 2103 A 2 ALA HB% A 1 MET HGy 1.0 1.8 4.17 2440 2103 A 2 ALA HB% A 1 MET HGx 1.0 1.8 4.17 2441 2104 A 3 ASP H A 3 ASP HBx 1.0 1.8 3.00 2442 2104 A 3 ASP H A 3 ASP HBy 1.0 1.8 3.00 2443 2105 A 4 GLU H A 3 ASP HBx 1.0 1.8 3.80 2444 2105 A 4 GLU H A 3 ASP HBy 1.0 1.8 3.80 2445 2106 A 4 GLU HA A 3 ASP HBx 1.0 1.8 5.28 2446 2106 A 4 GLU HA A 3 ASP HBy 1.0 1.8 5.28 2447 2107 A 3 ASP HBx A 4 GLU HGx 1.0 1.8 5.51 2448 2107 A 4 GLU HGy A 3 ASP HBx 1.0 1.8 5.51 2449 2107 A 4 GLU HGy A 3 ASP HBy 1.0 1.8 5.51 2450 2107 A 3 ASP HBy A 4 GLU HGx 1.0 1.8 5.51 2451 2108 A 4 GLU H A 4 GLU HBy 1.0 1.8 3.18 2452 2108 A 4 GLU H A 4 GLU HBx 1.0 1.8 3.18 2453 2109 A 5 LYS H A 4 GLU HBy 1.0 1.8 4.19 2454 2109 A 5 LYS H A 4 GLU HBx 1.0 1.8 4.19 2455 2110 A 5 LYS HA A 6 PRO HDy 1.0 1.8 3.49 2456 2110 A 5 LYS HA A 6 PRO HDx 1.0 1.8 3.49 2457 2111 A 5 LYS HBy A 6 PRO HDy 1.0 1.8 4.35 2458 2111 A 5 LYS HBx A 6 PRO HDy 1.0 1.8 4.35 2459 2111 A 6 PRO HDx A 5 LYS HBx 1.0 1.8 4.35 2460 2111 A 5 LYS HBy A 6 PRO HDx 1.0 1.8 4.35 2461 2112 A 5 LYS HGy A 6 PRO HDy 1.0 1.8 4.14 2462 2112 A 5 LYS HGx A 6 PRO HDy 1.0 1.8 4.14 2463 2112 A 6 PRO HDx A 5 LYS HGx 1.0 1.8 4.14 2464 2112 A 5 LYS HGy A 6 PRO HDx 1.0 1.8 4.14 2465 2113 A 5 LYS HEx A 6 PRO HDy 1.0 1.8 5.63 2466 2113 A 5 LYS HEy A 6 PRO HDy 1.0 1.8 5.63 2467 2113 A 6 PRO HDx A 5 LYS HEx 1.0 1.8 5.63 2468 2113 A 5 LYS HEy A 6 PRO HDx 1.0 1.8 5.63 2469 2114 A 11 LYS H A 11 LYS HBy 1.0 1.8 2.95 2470 2114 A 11 LYS H A 11 LYS HBx 1.0 1.8 2.95 2471 2115 A 11 LYS HBx A 11 LYS HDx 1.0 1.8 3.32 2472 2115 A 11 LYS HBy A 11 LYS HDx 1.0 1.8 3.32 2473 2115 A 11 LYS HDy A 11 LYS HBy 1.0 1.8 3.32 2474 2115 A 11 LYS HDy A 11 LYS HBx 1.0 1.8 3.32 2475 2116 A 11 LYS HBx A 11 LYS HEx 1.0 1.8 4.06 2476 2116 A 11 LYS HBy A 11 LYS HEx 1.0 1.8 4.06 2477 2116 A 11 LYS HEy A 11 LYS HBy 1.0 1.8 4.06 2478 2116 A 11 LYS HEy A 11 LYS HBx 1.0 1.8 4.06 2479 2117 A 12 THR H A 11 LYS HBy 1.0 1.8 4.37 2480 2117 A 12 THR H A 11 LYS HBx 1.0 1.8 4.37 2481 2118 A 15 ASN HD2y A 14 ASN H 1.0 1.8 4.99 2482 2118 A 14 ASN H A 15 ASN HD2x 1.0 1.8 4.99 2483 2119 A 14 ASN HD21 A 14 ASN HBy 1.0 1.8 2.90 2484 2119 A 14 ASN HD21 A 14 ASN HBx 1.0 1.8 2.90 2485 2120 A 14 ASN HD22 A 14 ASN HBy 1.0 1.8 3.45 2486 2120 A 14 ASN HD22 A 14 ASN HBx 1.0 1.8 3.45 2487 2121 A 15 ASN H A 14 ASN HBy 1.0 1.8 4.08 2488 2121 A 15 ASN H A 14 ASN HBx 1.0 1.8 4.08 2489 2122 A 15 ASN HD2y A 15 ASN HA 1.0 1.8 4.23 2490 2122 A 15 ASN HD2x A 15 ASN HA 1.0 1.8 4.23 2491 2123 A 17 HIS HA A 35 LYS HGx 1.0 1.8 5.16 2492 2123 A 17 HIS HA A 35 LYS HGy 1.0 1.8 5.16 2493 2124 A 17 HIS HB2 A 35 LYS HGx 1.0 1.8 3.85 2494 2124 A 17 HIS HB2 A 35 LYS HGy 1.0 1.8 3.85 2495 2125 A 17 HIS HD2 A 19 ASN HBx 1.0 1.8 5.81 2496 2125 A 17 HIS HD2 A 19 ASN HBy 1.0 1.8 5.81 2497 2126 A 18 ILE HB A 19 ASN HBx 1.0 1.8 5.18 2498 2126 A 18 ILE HB A 19 ASN HBy 1.0 1.8 5.18 2499 2127 A 18 ILE HD1% A 19 ASN HBx 1.0 1.8 5.81 2500 2127 A 18 ILE HD1% A 19 ASN HBy 1.0 1.8 5.81 2501 2128 A 18 ILE HD1% A 82 ASP HBy 1.0 1.8 4.48 2502 2128 A 18 ILE HD1% A 82 ASP HBx 1.0 1.8 4.48 2503 2129 A 19 ASN H A 19 ASN HBx 1.0 1.8 3.26 2504 2129 A 19 ASN H A 19 ASN HBy 1.0 1.8 3.26 2505 2130 A 19 ASN HA A 20 LEU HDy% 1.0 1.8 4.27 2506 2130 A 19 ASN HA A 20 LEU HDx% 1.0 1.8 4.27 2507 2131 A 19 ASN HBx A 20 LEU HDy% 1.0 1.8 4.11 2508 2131 A 20 LEU HDx% A 19 ASN HBx 1.0 1.8 4.11 2509 2131 A 19 ASN HBy A 20 LEU HDx% 1.0 1.8 4.11 2510 2131 A 19 ASN HBy A 20 LEU HDy% 1.0 1.8 4.11 2511 2132 A 80 ASP HA A 19 ASN HBx 1.0 1.8 4.17 2512 2132 A 80 ASP HA A 19 ASN HBy 1.0 1.8 4.17 2513 2133 A 81 GLU H A 19 ASN HBx 1.0 1.8 4.15 2514 2133 A 81 GLU H A 19 ASN HBy 1.0 1.8 4.15 2515 2134 A 81 GLU HA A 19 ASN HBx 1.0 1.8 4.39 2516 2134 A 81 GLU HA A 19 ASN HBy 1.0 1.8 4.39 2517 2135 A 19 ASN HBy A 81 GLU HGy 1.0 1.8 4.32 2518 2135 A 19 ASN HBx A 81 GLU HGy 1.0 1.8 4.32 2519 2135 A 81 GLU HGx A 19 ASN HBx 1.0 1.8 4.32 2520 2135 A 19 ASN HBy A 81 GLU HGx 1.0 1.8 4.32 2521 2136 A 19 ASN HD21 A 81 GLU HGy 1.0 1.8 5.76 2522 2136 A 19 ASN HD21 A 81 GLU HGx 1.0 1.8 5.76 2523 2137 A 20 LEU H A 20 LEU HDy% 1.0 1.8 3.88 2524 2137 A 20 LEU H A 20 LEU HDx% 1.0 1.8 3.88 2525 2138 A 20 LEU HA A 20 LEU HDy% 1.0 1.8 3.01 2526 2138 A 20 LEU HA A 20 LEU HDx% 1.0 1.8 3.01 2527 2139 A 20 LEU HB3 A 20 LEU HDy% 1.0 1.8 2.74 2528 2139 A 20 LEU HB3 A 20 LEU HDx% 1.0 1.8 2.74 2529 2140 A 21 LYS H A 20 LEU HDy% 1.0 1.8 3.52 2530 2140 A 21 LYS H A 20 LEU HDx% 1.0 1.8 3.52 2531 2141 A 32 PHE H A 20 LEU HDy% 1.0 1.8 5.49 2532 2141 A 32 PHE H A 20 LEU HDx% 1.0 1.8 5.49 2533 2142 A 34 ILE H A 20 LEU HDy% 1.0 1.8 4.17 2534 2142 A 34 ILE H A 20 LEU HDx% 1.0 1.8 4.17 2535 2143 A 34 ILE HG12 A 20 LEU HDy% 1.0 1.8 3.10 2536 2143 A 34 ILE HG12 A 20 LEU HDx% 1.0 1.8 3.10 2537 2144 A 43 LEU HDy% A 20 LEU HDy% 1.0 1.8 3.33 2538 2144 A 43 LEU HDy% A 20 LEU HDx% 1.0 1.8 3.33 2539 2145 A 73 PRO HA A 20 LEU HDy% 1.0 1.8 4.80 2540 2145 A 73 PRO HA A 20 LEU HDx% 1.0 1.8 4.80 2541 2146 A 73 PRO HB2 A 20 LEU HDy% 1.0 1.8 4.08 2542 2146 A 73 PRO HB2 A 20 LEU HDx% 1.0 1.8 4.08 2543 2147 A 73 PRO HB3 A 20 LEU HDy% 1.0 1.8 3.94 2544 2147 A 73 PRO HB3 A 20 LEU HDx% 1.0 1.8 3.94 2545 2148 A 73 PRO HG3 A 20 LEU HDy% 1.0 1.8 4.47 2546 2148 A 73 PRO HG3 A 20 LEU HDx% 1.0 1.8 4.47 2547 2149 A 20 LEU HDx% A 73 PRO HDx 1.0 1.8 5.59 2548 2149 A 20 LEU HDy% A 73 PRO HDx 1.0 1.8 5.59 2549 2149 A 73 PRO HDy A 20 LEU HDy% 1.0 1.8 5.59 2550 2149 A 73 PRO HDy A 20 LEU HDx% 1.0 1.8 5.59 2551 2150 A 78 MET HB2 A 20 LEU HDy% 1.0 1.8 3.94 2552 2150 A 78 MET HB2 A 20 LEU HDx% 1.0 1.8 3.94 2553 2151 A 78 MET HG2 A 20 LEU HDy% 1.0 1.8 3.54 2554 2151 A 78 MET HG2 A 20 LEU HDx% 1.0 1.8 3.54 2555 2152 A 78 MET HG3 A 20 LEU HDy% 1.0 1.8 3.29 2556 2152 A 78 MET HG3 A 20 LEU HDx% 1.0 1.8 3.29 2557 2153 A 78 MET HE% A 20 LEU HDy% 1.0 1.8 2.52 2558 2153 A 78 MET HE% A 20 LEU HDx% 1.0 1.8 2.52 2559 2154 A 79 GLU H A 20 LEU HDy% 1.0 1.8 5.05 2560 2154 A 79 GLU H A 20 LEU HDx% 1.0 1.8 5.05 2561 2155 A 80 ASP H A 20 LEU HDy% 1.0 1.8 5.70 2562 2155 A 80 ASP H A 20 LEU HDx% 1.0 1.8 5.70 2563 2156 A 80 ASP HA A 20 LEU HDy% 1.0 1.8 3.63 2564 2156 A 80 ASP HA A 20 LEU HDx% 1.0 1.8 3.63 2565 2157 A 81 GLU H A 20 LEU HDy% 1.0 1.8 3.84 2566 2157 A 81 GLU H A 20 LEU HDx% 1.0 1.8 3.84 2567 2158 A 81 GLU HA A 20 LEU HDy% 1.0 1.8 4.99 2568 2158 A 81 GLU HA A 20 LEU HDx% 1.0 1.8 4.99 2569 2159 A 82 ASP H A 20 LEU HDy% 1.0 1.8 3.30 2570 2159 A 82 ASP H A 20 LEU HDx% 1.0 1.8 3.30 2571 2160 A 82 ASP HA A 20 LEU HDy% 1.0 1.8 4.61 2572 2160 A 82 ASP HA A 20 LEU HDx% 1.0 1.8 4.61 2573 2161 A 20 LEU HDx% A 82 ASP HBy 1.0 1.8 3.26 2574 2161 A 20 LEU HDy% A 82 ASP HBy 1.0 1.8 3.26 2575 2161 A 82 ASP HBx A 20 LEU HDy% 1.0 1.8 3.26 2576 2161 A 82 ASP HBx A 20 LEU HDx% 1.0 1.8 3.26 2577 2162 A 83 THR H A 20 LEU HDy% 1.0 1.8 5.92 2578 2162 A 83 THR H A 20 LEU HDx% 1.0 1.8 5.92 2579 2163 A 21 LYS H A 22 VAL HGy% 1.0 1.8 5.31 2580 2163 A 21 LYS H A 22 VAL HGx% 1.0 1.8 5.31 2581 2164 A 21 LYS H A 82 ASP HBy 1.0 1.8 5.12 2582 2164 A 21 LYS H A 82 ASP HBx 1.0 1.8 5.12 2583 2165 A 21 LYS HA A 22 VAL HGy% 1.0 1.8 3.71 2584 2165 A 21 LYS HA A 22 VAL HGx% 1.0 1.8 3.71 2585 2166 A 21 LYS HB2 A 22 VAL HGy% 1.0 1.8 5.92 2586 2166 A 21 LYS HB2 A 22 VAL HGx% 1.0 1.8 5.92 2587 2167 A 21 LYS HB3 A 29 VAL HGy% 1.0 1.8 3.20 2588 2167 A 21 LYS HB3 A 29 VAL HGx% 1.0 1.8 3.20 2589 2168 A 21 LYS HDy A 29 VAL HGy% 1.0 1.8 3.35 2590 2168 A 21 LYS HDx A 29 VAL HGy% 1.0 1.8 3.35 2591 2168 A 29 VAL HGx% A 21 LYS HDx 1.0 1.8 3.35 2592 2168 A 21 LYS HDy A 29 VAL HGx% 1.0 1.8 3.35 2593 2169 A 21 LYS HE2 A 81 GLU HGy 1.0 1.8 5.21 2594 2169 A 21 LYS HE2 A 81 GLU HGx 1.0 1.8 5.21 2595 2170 A 22 VAL H A 22 VAL HGy% 1.0 1.8 3.32 2596 2170 A 22 VAL H A 22 VAL HGx% 1.0 1.8 3.32 2597 2171 A 22 VAL H A 29 VAL HGy% 1.0 1.8 3.64 2598 2171 A 22 VAL H A 29 VAL HGx% 1.0 1.8 3.64 2599 2172 A 22 VAL HA A 86 VAL HGy% 1.0 1.8 4.67 2600 2172 A 22 VAL HA A 86 VAL HGx% 1.0 1.8 4.67 2601 2173 A 22 VAL HB A 86 VAL HGy% 1.0 1.8 4.33 2602 2173 A 22 VAL HB A 86 VAL HGx% 1.0 1.8 4.33 2603 2174 A 23 ALA H A 22 VAL HGy% 1.0 1.8 3.51 2604 2174 A 23 ALA H A 22 VAL HGx% 1.0 1.8 3.51 2605 2175 A 23 ALA HA A 22 VAL HGy% 1.0 1.8 4.62 2606 2175 A 23 ALA HA A 22 VAL HGx% 1.0 1.8 4.62 2607 2176 A 23 ALA HB% A 22 VAL HGy% 1.0 1.8 4.09 2608 2176 A 23 ALA HB% A 22 VAL HGx% 1.0 1.8 4.09 2609 2177 A 24 GLY H A 22 VAL HGy% 1.0 1.8 5.02 2610 2177 A 24 GLY H A 22 VAL HGx% 1.0 1.8 5.02 2611 2178 A 29 VAL HB A 22 VAL HGy% 1.0 1.8 5.92 2612 2178 A 29 VAL HB A 22 VAL HGx% 1.0 1.8 5.92 2613 2179 A 22 VAL HGx% A 29 VAL HGy% 1.0 1.8 4.76 2614 2179 A 22 VAL HGy% A 29 VAL HGy% 1.0 1.8 4.76 2615 2179 A 29 VAL HGx% A 22 VAL HGy% 1.0 1.8 4.76 2616 2179 A 22 VAL HGx% A 29 VAL HGx% 1.0 1.8 4.76 2617 2180 A 30 VAL H A 22 VAL HGy% 1.0 1.8 3.94 2618 2180 A 30 VAL H A 22 VAL HGx% 1.0 1.8 3.94 2619 2181 A 30 VAL HGy% A 22 VAL HGy% 1.0 1.8 3.96 2620 2181 A 30 VAL HGy% A 22 VAL HGx% 1.0 1.8 3.96 2621 2182 A 31 GLN HA A 22 VAL HGy% 1.0 1.8 4.99 2622 2182 A 31 GLN HA A 22 VAL HGx% 1.0 1.8 4.99 2623 2183 A 32 PHE HE% A 22 VAL HGy% 1.0 1.8 2.95 2624 2183 A 32 PHE HE% A 22 VAL HGx% 1.0 1.8 2.95 2625 2184 A 43 LEU HDx% A 22 VAL HGy% 1.0 1.8 3.23 2626 2184 A 43 LEU HDx% A 22 VAL HGx% 1.0 1.8 3.23 2627 2185 A 43 LEU HDy% A 22 VAL HGy% 1.0 1.8 4.01 2628 2185 A 43 LEU HDy% A 22 VAL HGx% 1.0 1.8 4.01 2629 2186 A 44 MET HA A 22 VAL HGy% 1.0 1.8 5.04 2630 2186 A 44 MET HA A 22 VAL HGx% 1.0 1.8 5.04 2631 2187 A 47 TYR H A 22 VAL HGy% 1.0 1.8 4.82 2632 2187 A 47 TYR H A 22 VAL HGx% 1.0 1.8 4.82 2633 2188 A 47 TYR HA A 22 VAL HGy% 1.0 1.8 4.84 2634 2188 A 47 TYR HA A 22 VAL HGx% 1.0 1.8 4.84 2635 2189 A 47 TYR HB2 A 22 VAL HGy% 1.0 1.8 4.38 2636 2189 A 47 TYR HB2 A 22 VAL HGx% 1.0 1.8 4.38 2637 2190 A 47 TYR HB3 A 22 VAL HGy% 1.0 1.8 4.60 2638 2190 A 47 TYR HB3 A 22 VAL HGx% 1.0 1.8 4.60 2639 2191 A 47 TYR HD% A 22 VAL HGy% 1.0 1.8 3.31 2640 2191 A 47 TYR HD% A 22 VAL HGx% 1.0 1.8 3.31 2641 2192 A 47 TYR HE% A 22 VAL HGy% 1.0 1.8 3.38 2642 2192 A 47 TYR HE% A 22 VAL HGx% 1.0 1.8 3.38 2643 2193 A 60 PHE HA A 22 VAL HGy% 1.0 1.8 5.20 2644 2193 A 60 PHE HA A 22 VAL HGx% 1.0 1.8 5.20 2645 2194 A 60 PHE HD% A 22 VAL HGy% 1.0 1.8 3.53 2646 2194 A 60 PHE HD% A 22 VAL HGx% 1.0 1.8 3.53 2647 2195 A 60 PHE HE% A 22 VAL HGy% 1.0 1.8 3.24 2648 2195 A 60 PHE HE% A 22 VAL HGx% 1.0 1.8 3.24 2649 2196 A 60 PHE HZ A 22 VAL HGy% 1.0 1.8 3.86 2650 2196 A 60 PHE HZ A 22 VAL HGx% 1.0 1.8 3.86 2651 2197 A 83 THR HA A 22 VAL HGy% 1.0 1.8 5.66 2652 2197 A 83 THR HA A 22 VAL HGx% 1.0 1.8 5.66 2653 2198 A 83 THR HG2% A 22 VAL HGy% 1.0 1.8 5.20 2654 2198 A 83 THR HG2% A 22 VAL HGx% 1.0 1.8 5.20 2655 2199 A 84 ILE HB A 22 VAL HGy% 1.0 1.8 3.48 2656 2199 A 84 ILE HB A 22 VAL HGx% 1.0 1.8 3.48 2657 2200 A 84 ILE HG2% A 22 VAL HGy% 1.0 1.8 3.43 2658 2200 A 84 ILE HG2% A 22 VAL HGx% 1.0 1.8 3.43 2659 2201 A 84 ILE HG12 A 22 VAL HGy% 1.0 1.8 4.95 2660 2201 A 84 ILE HG12 A 22 VAL HGx% 1.0 1.8 4.95 2661 2202 A 84 ILE HD1% A 22 VAL HGy% 1.0 1.8 4.68 2662 2202 A 84 ILE HD1% A 22 VAL HGx% 1.0 1.8 4.68 2663 2203 A 85 ASP H A 22 VAL HGy% 1.0 1.8 5.29 2664 2203 A 85 ASP H A 22 VAL HGx% 1.0 1.8 5.29 2665 2204 A 85 ASP HA A 22 VAL HGy% 1.0 1.8 4.61 2666 2204 A 85 ASP HA A 22 VAL HGx% 1.0 1.8 4.61 2667 2205 A 86 VAL H A 22 VAL HGy% 1.0 1.8 4.38 2668 2205 A 86 VAL H A 22 VAL HGx% 1.0 1.8 4.38 2669 2206 A 86 VAL HB A 22 VAL HGy% 1.0 1.8 3.93 2670 2206 A 86 VAL HB A 22 VAL HGx% 1.0 1.8 3.93 2671 2207 A 22 VAL HGy% A 86 VAL HGy% 1.0 1.8 2.78 2672 2207 A 22 VAL HGx% A 86 VAL HGy% 1.0 1.8 2.78 2673 2207 A 86 VAL HGx% A 22 VAL HGy% 1.0 1.8 2.78 2674 2207 A 22 VAL HGx% A 86 VAL HGx% 1.0 1.8 2.78 2675 2208 A 23 ALA H A 29 VAL HGy% 1.0 1.8 4.61 2676 2208 A 23 ALA H A 29 VAL HGx% 1.0 1.8 4.61 2677 2209 A 23 ALA H A 86 VAL HGy% 1.0 1.8 4.65 2678 2209 A 23 ALA H A 86 VAL HGx% 1.0 1.8 4.65 2679 2210 A 23 ALA HA A 29 VAL HGy% 1.0 1.8 3.35 2680 2210 A 23 ALA HA A 29 VAL HGx% 1.0 1.8 3.35 2681 2211 A 23 ALA HB% A 29 VAL HGy% 1.0 1.8 3.63 2682 2211 A 23 ALA HB% A 29 VAL HGx% 1.0 1.8 3.63 2683 2212 A 24 GLY H A 29 VAL HGy% 1.0 1.8 4.89 2684 2212 A 24 GLY H A 29 VAL HGx% 1.0 1.8 4.89 2685 2213 A 24 GLY H A 86 VAL HGy% 1.0 1.8 4.90 2686 2213 A 24 GLY H A 86 VAL HGx% 1.0 1.8 4.90 2687 2214 A 24 GLY HAy A 25 GLN HE2y 1.0 1.8 5.23 2688 2214 A 24 GLY HAy A 25 GLN HE2x 1.0 1.8 5.23 2689 2215 A 24 GLY HAy A 86 VAL HGy% 1.0 1.8 4.91 2690 2215 A 24 GLY HAy A 86 VAL HGx% 1.0 1.8 4.91 2691 2216 A 24 GLY HAx A 26 ASP HBy 1.0 1.8 4.88 2692 2216 A 24 GLY HAx A 26 ASP HBx 1.0 1.8 4.88 2693 2217 A 24 GLY HAx A 86 VAL HGy% 1.0 1.8 4.22 2694 2217 A 24 GLY HAx A 86 VAL HGx% 1.0 1.8 4.22 2695 2218 A 25 GLN H A 25 GLN HBx 1.0 1.8 3.14 2696 2218 A 25 GLN H A 25 GLN HBy 1.0 1.8 3.14 2697 2219 A 25 GLN H A 25 GLN HE2y 1.0 1.8 4.29 2698 2219 A 25 GLN H A 25 GLN HE2x 1.0 1.8 4.29 2699 2220 A 25 GLN H A 86 VAL HGy% 1.0 1.8 4.64 2700 2220 A 25 GLN H A 86 VAL HGx% 1.0 1.8 4.64 2701 2221 A 25 GLN HA A 25 GLN HE2y 1.0 1.8 4.49 2702 2221 A 25 GLN HA A 25 GLN HE2x 1.0 1.8 4.49 2703 2222 A 25 GLN HE2y A 25 GLN HBy 1.0 1.8 4.15 2704 2222 A 25 GLN HE2x A 25 GLN HBy 1.0 1.8 4.15 2705 2222 A 25 GLN HE2x A 25 GLN HBx 1.0 1.8 4.15 2706 2222 A 25 GLN HE2y A 25 GLN HBx 1.0 1.8 4.15 2707 2223 A 26 ASP H A 25 GLN HBx 1.0 1.8 4.18 2708 2223 A 26 ASP H A 25 GLN HBy 1.0 1.8 4.18 2709 2224 A 87 PHE HA A 25 GLN HBx 1.0 1.8 5.12 2710 2224 A 87 PHE HA A 25 GLN HBy 1.0 1.8 5.12 2711 2225 A 88 GLN H A 25 GLN HBx 1.0 1.8 5.69 2712 2225 A 88 GLN H A 25 GLN HBy 1.0 1.8 5.69 2713 2226 A 25 GLN HGy A 25 GLN HE2y 1.0 1.8 3.05 2714 2226 A 25 GLN HE2y A 25 GLN HGx 1.0 1.8 3.05 2715 2226 A 25 GLN HGy A 25 GLN HE2x 1.0 1.8 3.05 2716 2226 A 25 GLN HE2x A 25 GLN HGx 1.0 1.8 3.05 2717 2227 A 25 GLN HGx A 26 ASP HBy 1.0 1.8 5.71 2718 2227 A 25 GLN HGy A 26 ASP HBy 1.0 1.8 5.71 2719 2227 A 26 ASP HBx A 25 GLN HGx 1.0 1.8 5.71 2720 2227 A 25 GLN HGy A 26 ASP HBx 1.0 1.8 5.71 2721 2228 A 25 GLN HGx A 86 VAL HGy% 1.0 1.8 4.66 2722 2228 A 25 GLN HGy A 86 VAL HGy% 1.0 1.8 4.66 2723 2228 A 86 VAL HGx% A 25 GLN HGx 1.0 1.8 4.66 2724 2228 A 25 GLN HGy A 86 VAL HGx% 1.0 1.8 4.66 2725 2229 A 26 ASP H A 25 GLN HE2y 1.0 1.8 4.67 2726 2229 A 26 ASP H A 25 GLN HE2x 1.0 1.8 4.67 2727 2230 A 25 GLN HE2y A 86 VAL HGx% 1.0 1.8 4.52 2728 2230 A 25 GLN HE2x A 86 VAL HGy% 1.0 1.8 4.52 2729 2230 A 25 GLN HE2x A 86 VAL HGx% 1.0 1.8 4.52 2730 2230 A 25 GLN HE2y A 86 VAL HGy% 1.0 1.8 4.52 2731 2231 A 87 PHE H A 25 GLN HE2y 1.0 1.8 5.81 2732 2231 A 87 PHE H A 25 GLN HE2x 1.0 1.8 5.81 2733 2232 A 87 PHE HA A 25 GLN HE2y 1.0 1.8 4.94 2734 2232 A 87 PHE HA A 25 GLN HE2x 1.0 1.8 4.94 2735 2233 A 26 ASP H A 26 ASP HBy 1.0 1.8 3.17 2736 2233 A 26 ASP H A 26 ASP HBx 1.0 1.8 3.17 2737 2234 A 27 GLY H A 26 ASP HBy 1.0 1.8 3.92 2738 2234 A 27 GLY H A 26 ASP HBx 1.0 1.8 3.92 2739 2235 A 28 SER H A 26 ASP HBy 1.0 1.8 4.59 2740 2235 A 28 SER H A 26 ASP HBx 1.0 1.8 4.59 2741 2236 A 26 ASP HBy A 28 SER HBy 1.0 1.8 4.75 2742 2236 A 26 ASP HBx A 28 SER HBy 1.0 1.8 4.75 2743 2236 A 28 SER HBx A 26 ASP HBy 1.0 1.8 4.75 2744 2236 A 26 ASP HBx A 28 SER HBx 1.0 1.8 4.75 2745 2237 A 27 GLY HA2 A 29 VAL HGy% 1.0 1.8 5.90 2746 2237 A 27 GLY HA2 A 29 VAL HGx% 1.0 1.8 5.90 2747 2238 A 28 SER H A 28 SER HBy 1.0 1.8 3.05 2748 2238 A 28 SER H A 28 SER HBx 1.0 1.8 3.05 2749 2239 A 28 SER H A 29 VAL HGy% 1.0 1.8 5.00 2750 2239 A 28 SER H A 29 VAL HGx% 1.0 1.8 5.00 2751 2240 A 28 SER HA A 29 VAL HGy% 1.0 1.8 3.40 2752 2240 A 28 SER HA A 29 VAL HGx% 1.0 1.8 3.40 2753 2241 A 29 VAL H A 28 SER HBy 1.0 1.8 3.70 2754 2241 A 29 VAL H A 28 SER HBx 1.0 1.8 3.70 2755 2242 A 28 SER HBy A 29 VAL HGy% 1.0 1.8 4.93 2756 2242 A 28 SER HBx A 29 VAL HGy% 1.0 1.8 4.93 2757 2242 A 29 VAL HGx% A 28 SER HBy 1.0 1.8 4.93 2758 2242 A 29 VAL HGx% A 28 SER HBx 1.0 1.8 4.93 2759 2243 A 29 VAL H A 29 VAL HGy% 1.0 1.8 3.02 2760 2243 A 29 VAL H A 29 VAL HGx% 1.0 1.8 3.02 2761 2244 A 30 VAL H A 29 VAL HGy% 1.0 1.8 3.01 2762 2244 A 30 VAL H A 29 VAL HGx% 1.0 1.8 3.01 2763 2245 A 30 VAL HA A 29 VAL HGy% 1.0 1.8 3.72 2764 2245 A 30 VAL HA A 29 VAL HGx% 1.0 1.8 3.72 2765 2246 A 31 GLN H A 29 VAL HGy% 1.0 1.8 4.53 2766 2246 A 31 GLN H A 29 VAL HGx% 1.0 1.8 4.53 2767 2247 A 31 GLN HG2 A 29 VAL HGy% 1.0 1.8 4.46 2768 2247 A 31 GLN HG2 A 29 VAL HGx% 1.0 1.8 4.46 2769 2248 A 31 GLN HG3 A 29 VAL HGy% 1.0 1.8 3.37 2770 2248 A 31 GLN HG3 A 29 VAL HGx% 1.0 1.8 3.37 2771 2249 A 31 GLN HE21 A 29 VAL HGy% 1.0 1.8 3.82 2772 2249 A 31 GLN HE21 A 29 VAL HGx% 1.0 1.8 3.82 2773 2250 A 31 GLN HE22 A 29 VAL HGy% 1.0 1.8 4.36 2774 2250 A 31 GLN HE22 A 29 VAL HGx% 1.0 1.8 4.36 2775 2251 A 34 ILE HA A 35 LYS HGx 1.0 1.8 5.35 2776 2251 A 34 ILE HA A 35 LYS HGy 1.0 1.8 5.35 2777 2252 A 35 LYS H A 35 LYS HGx 1.0 1.8 3.40 2778 2252 A 35 LYS H A 35 LYS HGy 1.0 1.8 3.40 2779 2253 A 35 LYS HB2 A 35 LYS HEy 1.0 1.8 3.62 2780 2253 A 35 LYS HB2 A 35 LYS HEx 1.0 1.8 3.62 2781 2254 A 35 LYS HB3 A 35 LYS HEy 1.0 1.8 4.37 2782 2254 A 35 LYS HB3 A 35 LYS HEx 1.0 1.8 4.37 2783 2255 A 36 ARG H A 35 LYS HGx 1.0 1.8 4.93 2784 2255 A 36 ARG H A 35 LYS HGy 1.0 1.8 4.93 2785 2256 A 37 HIS H A 35 LYS HGx 1.0 1.8 5.19 2786 2256 A 37 HIS H A 35 LYS HGy 1.0 1.8 5.19 2787 2257 A 38 THR H A 35 LYS HGx 1.0 1.8 5.21 2788 2257 A 38 THR H A 35 LYS HGy 1.0 1.8 5.21 2789 2258 A 38 THR HB A 35 LYS HGx 1.0 1.8 4.32 2790 2258 A 38 THR HB A 35 LYS HGy 1.0 1.8 4.32 2791 2259 A 38 THR HB A 35 LYS HEy 1.0 1.8 4.99 2792 2259 A 38 THR HB A 35 LYS HEx 1.0 1.8 4.99 2793 2260 A 38 THR HG2% A 35 LYS HEy 1.0 1.8 4.42 2794 2260 A 38 THR HG2% A 35 LYS HEx 1.0 1.8 4.42 2795 2261 A 39 PRO HA A 40 LEU HDy% 1.0 1.8 4.20 2796 2261 A 39 PRO HA A 40 LEU HDx% 1.0 1.8 4.20 2797 2262 A 39 PRO HB3 A 40 LEU HDy% 1.0 1.8 4.93 2798 2262 A 39 PRO HB3 A 40 LEU HDx% 1.0 1.8 4.93 2799 2263 A 40 LEU H A 40 LEU HDy% 1.0 1.8 3.48 2800 2263 A 40 LEU H A 40 LEU HDx% 1.0 1.8 3.48 2801 2264 A 40 LEU HA A 40 LEU HDy% 1.0 1.8 3.53 2802 2264 A 40 LEU HA A 40 LEU HDx% 1.0 1.8 3.53 2803 2265 A 41 SER H A 40 LEU HDy% 1.0 1.8 4.17 2804 2265 A 41 SER H A 40 LEU HDx% 1.0 1.8 4.17 2805 2266 A 41 SER HA A 40 LEU HDy% 1.0 1.8 4.26 2806 2266 A 41 SER HA A 40 LEU HDx% 1.0 1.8 4.26 2807 2267 A 42 LYS H A 40 LEU HDy% 1.0 1.8 5.48 2808 2267 A 42 LYS H A 40 LEU HDx% 1.0 1.8 5.48 2809 2268 A 43 LEU HDy% A 40 LEU HDy% 1.0 1.8 4.59 2810 2268 A 43 LEU HDy% A 40 LEU HDx% 1.0 1.8 4.59 2811 2269 A 44 MET H A 40 LEU HDy% 1.0 1.8 4.32 2812 2269 A 44 MET H A 40 LEU HDx% 1.0 1.8 4.32 2813 2270 A 44 MET HE% A 40 LEU HDy% 1.0 1.8 2.80 2814 2270 A 44 MET HE% A 40 LEU HDx% 1.0 1.8 2.80 2815 2271 A 67 ILE HA A 40 LEU HDy% 1.0 1.8 4.69 2816 2271 A 67 ILE HA A 40 LEU HDx% 1.0 1.8 4.69 2817 2272 A 67 ILE HG2% A 40 LEU HDy% 1.0 1.8 2.62 2818 2272 A 67 ILE HG2% A 40 LEU HDx% 1.0 1.8 2.62 2819 2273 A 68 ASN H A 40 LEU HDy% 1.0 1.8 4.15 2820 2273 A 68 ASN H A 40 LEU HDx% 1.0 1.8 4.15 2821 2274 A 69 GLU HA A 40 LEU HDy% 1.0 1.8 3.12 2822 2274 A 69 GLU HA A 40 LEU HDx% 1.0 1.8 3.12 2823 2275 A 69 GLU HB3 A 40 LEU HDy% 1.0 1.8 5.50 2824 2275 A 69 GLU HB3 A 40 LEU HDx% 1.0 1.8 5.50 2825 2276 A 70 THR H A 40 LEU HDy% 1.0 1.8 5.92 2826 2276 A 70 THR H A 40 LEU HDx% 1.0 1.8 5.92 2827 2277 A 71 ASP H A 40 LEU HDy% 1.0 1.8 4.60 2828 2277 A 71 ASP H A 40 LEU HDx% 1.0 1.8 4.60 2829 2278 A 71 ASP HB2 A 40 LEU HDy% 1.0 1.8 4.60 2830 2278 A 71 ASP HB2 A 40 LEU HDx% 1.0 1.8 4.60 2831 2279 A 71 ASP HB3 A 40 LEU HDy% 1.0 1.8 4.23 2832 2279 A 71 ASP HB3 A 40 LEU HDx% 1.0 1.8 4.23 2833 2280 A 72 THR H A 40 LEU HDy% 1.0 1.8 4.34 2834 2280 A 72 THR H A 40 LEU HDx% 1.0 1.8 4.34 2835 2281 A 72 THR HA A 40 LEU HDy% 1.0 1.8 3.91 2836 2281 A 72 THR HA A 40 LEU HDx% 1.0 1.8 3.91 2837 2282 A 72 THR HB A 40 LEU HDy% 1.0 1.8 5.92 2838 2282 A 72 THR HB A 40 LEU HDx% 1.0 1.8 5.92 2839 2283 A 73 PRO HA A 40 LEU HDy% 1.0 1.8 3.96 2840 2283 A 73 PRO HA A 40 LEU HDx% 1.0 1.8 3.96 2841 2284 A 73 PRO HB2 A 40 LEU HDy% 1.0 1.8 4.97 2842 2284 A 73 PRO HB2 A 40 LEU HDx% 1.0 1.8 4.97 2843 2285 A 40 LEU HDx% A 73 PRO HDx 1.0 1.8 3.90 2844 2285 A 40 LEU HDy% A 73 PRO HDx 1.0 1.8 3.90 2845 2285 A 73 PRO HDy A 40 LEU HDy% 1.0 1.8 3.90 2846 2285 A 73 PRO HDy A 40 LEU HDx% 1.0 1.8 3.90 2847 2286 A 75 GLN H A 40 LEU HDy% 1.0 1.8 5.57 2848 2286 A 75 GLN H A 40 LEU HDx% 1.0 1.8 5.57 2849 2287 A 75 GLN HB3 A 40 LEU HDy% 1.0 1.8 5.92 2850 2287 A 75 GLN HB3 A 40 LEU HDx% 1.0 1.8 5.92 2851 2288 A 76 LEU HDx% A 40 LEU HDy% 1.0 1.8 3.43 2852 2288 A 76 LEU HDx% A 40 LEU HDx% 1.0 1.8 3.43 2853 2289 A 41 SER H A 44 MET HGy 1.0 1.8 5.27 2854 2289 A 41 SER H A 44 MET HGx 1.0 1.8 5.27 2855 2290 A 41 SER HA A 44 MET HGy 1.0 1.8 4.25 2856 2290 A 41 SER HA A 44 MET HGx 1.0 1.8 4.25 2857 2291 A 42 LYS H A 42 LYS HBy 1.0 1.8 3.07 2858 2291 A 42 LYS H A 42 LYS HBx 1.0 1.8 3.07 2859 2292 A 42 LYS HBy A 42 LYS HDx 1.0 1.8 2.94 2860 2292 A 42 LYS HBx A 42 LYS HDx 1.0 1.8 2.94 2861 2292 A 42 LYS HDy A 42 LYS HBy 1.0 1.8 2.94 2862 2292 A 42 LYS HDy A 42 LYS HBx 1.0 1.8 2.94 2863 2293 A 42 LYS HBy A 42 LYS HEx 1.0 1.8 3.48 2864 2293 A 42 LYS HBx A 42 LYS HEx 1.0 1.8 3.48 2865 2293 A 42 LYS HEy A 42 LYS HBy 1.0 1.8 3.48 2866 2293 A 42 LYS HEy A 42 LYS HBx 1.0 1.8 3.48 2867 2294 A 43 LEU H A 42 LYS HBy 1.0 1.8 3.21 2868 2294 A 43 LEU H A 42 LYS HBx 1.0 1.8 3.21 2869 2295 A 43 LEU HA A 42 LYS HBy 1.0 1.8 4.46 2870 2295 A 43 LEU HA A 42 LYS HBx 1.0 1.8 4.46 2871 2296 A 43 LEU HDy% A 44 MET HGy 1.0 1.8 4.76 2872 2296 A 43 LEU HDy% A 44 MET HGx 1.0 1.8 4.76 2873 2297 A 44 MET H A 44 MET HGy 1.0 1.8 3.69 2874 2297 A 44 MET H A 44 MET HGx 1.0 1.8 3.69 2875 2298 A 55 MET HE% A 44 MET HGy 1.0 1.8 4.65 2876 2298 A 55 MET HE% A 44 MET HGx 1.0 1.8 4.65 2877 2299 A 60 PHE HE% A 44 MET HGy 1.0 1.8 4.69 2878 2299 A 60 PHE HE% A 44 MET HGx 1.0 1.8 4.69 2879 2300 A 44 MET HE% A 69 GLU HGx 1.0 1.8 5.19 2880 2300 A 44 MET HE% A 69 GLU HGy 1.0 1.8 5.19 2881 2301 A 45 LYS HA A 45 LYS HGy 1.0 1.8 3.21 2882 2301 A 45 LYS HA A 45 LYS HGx 1.0 1.8 3.21 2883 2302 A 45 LYS HA A 48 CYS HBy 1.0 1.8 4.16 2884 2302 A 45 LYS HA A 48 CYS HBx 1.0 1.8 4.16 2885 2303 A 45 LYS HEy A 45 LYS HGy 1.0 1.8 3.16 2886 2303 A 45 LYS HEx A 45 LYS HGy 1.0 1.8 3.16 2887 2303 A 45 LYS HGx A 45 LYS HEx 1.0 1.8 3.16 2888 2303 A 45 LYS HEy A 45 LYS HGx 1.0 1.8 3.16 2889 2304 A 45 LYS HGy A 55 MET HGx 1.0 1.8 3.75 2890 2304 A 45 LYS HGx A 55 MET HGx 1.0 1.8 3.75 2891 2304 A 55 MET HGy A 45 LYS HGy 1.0 1.8 3.75 2892 2304 A 55 MET HGy A 45 LYS HGx 1.0 1.8 3.75 2893 2305 A 55 MET HE% A 45 LYS HGy 1.0 1.8 3.19 2894 2305 A 55 MET HE% A 45 LYS HGx 1.0 1.8 3.19 2895 2306 A 47 TYR H A 48 CYS HBy 1.0 1.8 5.14 2896 2306 A 47 TYR H A 48 CYS HBx 1.0 1.8 5.14 2897 2307 A 47 TYR HD% A 48 CYS HBy 1.0 1.8 4.27 2898 2307 A 47 TYR HD% A 48 CYS HBx 1.0 1.8 4.27 2899 2308 A 47 TYR HD% A 53 LEU HDy% 1.0 1.8 4.53 2900 2308 A 47 TYR HD% A 53 LEU HDx% 1.0 1.8 4.53 2901 2309 A 47 TYR HD% A 86 VAL HGy% 1.0 1.8 4.39 2902 2309 A 47 TYR HD% A 86 VAL HGx% 1.0 1.8 4.39 2903 2310 A 47 TYR HE% A 48 CYS HBy 1.0 1.8 5.25 2904 2310 A 47 TYR HE% A 48 CYS HBx 1.0 1.8 5.25 2905 2311 A 47 TYR HE% A 53 LEU HDy% 1.0 1.8 3.53 2906 2311 A 47 TYR HE% A 53 LEU HDx% 1.0 1.8 3.53 2907 2312 A 48 CYS H A 48 CYS HBy 1.0 1.8 3.17 2908 2312 A 48 CYS H A 48 CYS HBx 1.0 1.8 3.17 2909 2313 A 48 CYS HA A 53 LEU HDy% 1.0 1.8 3.33 2910 2313 A 48 CYS HA A 53 LEU HDx% 1.0 1.8 3.33 2911 2314 A 49 GLU H A 48 CYS HBy 1.0 1.8 4.12 2912 2314 A 49 GLU H A 48 CYS HBx 1.0 1.8 4.12 2913 2315 A 49 GLU HB2 A 48 CYS HBy 1.0 1.8 5.81 2914 2315 A 49 GLU HB2 A 48 CYS HBx 1.0 1.8 5.81 2915 2316 A 51 GLN H A 48 CYS HBy 1.0 1.8 5.74 2916 2316 A 51 GLN H A 48 CYS HBx 1.0 1.8 5.74 2917 2317 A 53 LEU H A 48 CYS HBy 1.0 1.8 4.12 2918 2317 A 53 LEU H A 48 CYS HBx 1.0 1.8 4.12 2919 2318 A 53 LEU HB2 A 48 CYS HBy 1.0 1.8 3.95 2920 2318 A 53 LEU HB2 A 48 CYS HBx 1.0 1.8 3.95 2921 2319 A 48 CYS HBx A 53 LEU HDy% 1.0 1.8 4.37 2922 2319 A 48 CYS HBy A 53 LEU HDy% 1.0 1.8 4.37 2923 2319 A 53 LEU HDx% A 48 CYS HBy 1.0 1.8 4.37 2924 2319 A 48 CYS HBx A 53 LEU HDx% 1.0 1.8 4.37 2925 2320 A 54 SER H A 48 CYS HBy 1.0 1.8 4.63 2926 2320 A 54 SER H A 48 CYS HBx 1.0 1.8 4.63 2927 2321 A 55 MET H A 48 CYS HBy 1.0 1.8 4.85 2928 2321 A 55 MET H A 48 CYS HBx 1.0 1.8 4.85 2929 2322 A 55 MET HA A 48 CYS HBy 1.0 1.8 4.21 2930 2322 A 55 MET HA A 48 CYS HBx 1.0 1.8 4.21 2931 2323 A 55 MET HB2 A 48 CYS HBy 1.0 1.8 5.81 2932 2323 A 55 MET HB2 A 48 CYS HBx 1.0 1.8 5.81 2933 2324 A 55 MET HE% A 48 CYS HBy 1.0 1.8 3.70 2934 2324 A 55 MET HE% A 48 CYS HBx 1.0 1.8 3.70 2935 2325 A 58 ILE HD1% A 48 CYS HBy 1.0 1.8 4.46 2936 2325 A 58 ILE HD1% A 48 CYS HBx 1.0 1.8 4.46 2937 2326 A 60 PHE HE% A 48 CYS HBy 1.0 1.8 4.98 2938 2326 A 60 PHE HE% A 48 CYS HBx 1.0 1.8 4.98 2939 2327 A 60 PHE HZ A 48 CYS HBy 1.0 1.8 5.23 2940 2327 A 60 PHE HZ A 48 CYS HBx 1.0 1.8 5.23 2941 2328 A 48 CYS HBy A 86 VAL HGy% 1.0 1.8 5.73 2942 2328 A 48 CYS HBx A 86 VAL HGy% 1.0 1.8 5.73 2943 2328 A 86 VAL HGx% A 48 CYS HBy 1.0 1.8 5.73 2944 2328 A 86 VAL HGx% A 48 CYS HBx 1.0 1.8 5.73 2945 2329 A 51 GLN H A 53 LEU HDy% 1.0 1.8 4.37 2946 2329 A 51 GLN H A 53 LEU HDx% 1.0 1.8 4.37 2947 2330 A 51 GLN HA A 53 LEU HDy% 1.0 1.8 4.34 2948 2330 A 51 GLN HA A 53 LEU HDx% 1.0 1.8 4.34 2949 2331 A 51 GLN HB2 A 53 LEU HDy% 1.0 1.8 3.19 2950 2331 A 51 GLN HB2 A 53 LEU HDx% 1.0 1.8 3.19 2951 2332 A 51 GLN HB3 A 53 LEU HDy% 1.0 1.8 4.04 2952 2332 A 51 GLN HB3 A 53 LEU HDx% 1.0 1.8 4.04 2953 2333 A 51 GLN HGy A 53 LEU HDy% 1.0 1.8 4.09 2954 2333 A 51 GLN HGx A 53 LEU HDy% 1.0 1.8 4.09 2955 2333 A 53 LEU HDx% A 51 GLN HGx 1.0 1.8 4.09 2956 2333 A 51 GLN HGy A 53 LEU HDx% 1.0 1.8 4.09 2957 2334 A 52 GLY H A 53 LEU HDy% 1.0 1.8 4.99 2958 2334 A 52 GLY H A 53 LEU HDx% 1.0 1.8 4.99 2959 2335 A 52 GLY HAy A 53 LEU HDy% 1.0 1.8 4.30 2960 2335 A 52 GLY HAx A 53 LEU HDy% 1.0 1.8 4.30 2961 2335 A 53 LEU HDx% A 52 GLY HAx 1.0 1.8 4.30 2962 2335 A 52 GLY HAy A 53 LEU HDx% 1.0 1.8 4.30 2963 2336 A 53 LEU H A 53 LEU HDy% 1.0 1.8 3.30 2964 2336 A 53 LEU H A 53 LEU HDx% 1.0 1.8 3.30 2965 2337 A 53 LEU HA A 53 LEU HDy% 1.0 1.8 2.91 2966 2337 A 53 LEU HA A 53 LEU HDx% 1.0 1.8 2.91 2967 2338 A 53 LEU HB3 A 53 LEU HDy% 1.0 1.8 3.11 2968 2338 A 53 LEU HB3 A 53 LEU HDx% 1.0 1.8 3.11 2969 2339 A 54 SER H A 53 LEU HDy% 1.0 1.8 3.48 2970 2339 A 54 SER H A 53 LEU HDx% 1.0 1.8 3.48 2971 2340 A 54 SER HBx A 53 LEU HDy% 1.0 1.8 5.72 2972 2340 A 54 SER HBx A 53 LEU HDx% 1.0 1.8 5.72 2973 2341 A 57 GLN HB2 A 53 LEU HDy% 1.0 1.8 4.39 2974 2341 A 57 GLN HB2 A 53 LEU HDx% 1.0 1.8 4.39 2975 2342 A 58 ILE HG2% A 53 LEU HDy% 1.0 1.8 2.91 2976 2342 A 58 ILE HG2% A 53 LEU HDx% 1.0 1.8 2.91 2977 2343 A 88 GLN HE2y A 53 LEU HDy% 1.0 1.8 4.15 2978 2343 A 88 GLN HE2y A 53 LEU HDx% 1.0 1.8 4.15 2979 2344 A 88 GLN HE2x A 53 LEU HDy% 1.0 1.8 3.47 2980 2344 A 88 GLN HE2x A 53 LEU HDx% 1.0 1.8 3.47 2981 2345 A 57 GLN HA A 89 GLN HBx 1.0 1.8 4.70 2982 2345 A 57 GLN HA A 89 GLN HBy 1.0 1.8 4.70 2983 2346 A 57 GLN HA A 90 GLN HE2x 1.0 1.8 4.71 2984 2346 A 57 GLN HA A 90 GLN HE2y 1.0 1.8 4.71 2985 2347 A 58 ILE H A 86 VAL HGy% 1.0 1.8 5.21 2986 2347 A 58 ILE H A 86 VAL HGx% 1.0 1.8 5.21 2987 2348 A 58 ILE H A 89 GLN HBx 1.0 1.8 4.58 2988 2348 A 58 ILE H A 89 GLN HBy 1.0 1.8 4.58 2989 2349 A 58 ILE HA A 86 VAL HGy% 1.0 1.8 4.57 2990 2349 A 58 ILE HA A 86 VAL HGx% 1.0 1.8 4.57 2991 2350 A 58 ILE HB A 86 VAL HGy% 1.0 1.8 3.40 2992 2350 A 58 ILE HB A 86 VAL HGx% 1.0 1.8 3.40 2993 2351 A 58 ILE HG2% A 86 VAL HGy% 1.0 1.8 3.03 2994 2351 A 58 ILE HG2% A 86 VAL HGx% 1.0 1.8 3.03 2995 2352 A 58 ILE HG13 A 86 VAL HGy% 1.0 1.8 3.98 2996 2352 A 58 ILE HG13 A 86 VAL HGx% 1.0 1.8 3.98 2997 2353 A 58 ILE HD1% A 86 VAL HGy% 1.0 1.8 2.86 2998 2353 A 58 ILE HD1% A 86 VAL HGx% 1.0 1.8 2.86 2999 2354 A 59 ARG H A 86 VAL HGy% 1.0 1.8 3.92 3000 2354 A 59 ARG H A 86 VAL HGx% 1.0 1.8 3.92 3001 2355 A 59 ARG HA A 86 VAL HGy% 1.0 1.8 4.77 3002 2355 A 59 ARG HA A 86 VAL HGx% 1.0 1.8 4.77 3003 2356 A 59 ARG HB2 A 86 VAL HGy% 1.0 1.8 5.50 3004 2356 A 59 ARG HB2 A 86 VAL HGx% 1.0 1.8 5.50 3005 2357 A 59 ARG HG3 A 89 GLN HBx 1.0 1.8 4.45 3006 2357 A 59 ARG HG3 A 89 GLN HBy 1.0 1.8 4.45 3007 2358 A 59 ARG HD2 A 86 VAL HGy% 1.0 1.8 5.92 3008 2358 A 59 ARG HD2 A 86 VAL HGx% 1.0 1.8 5.92 3009 2359 A 59 ARG HE A 89 GLN HBx 1.0 1.8 5.81 3010 2359 A 89 GLN HBy A 59 ARG HE 1.0 1.8 5.81 3011 2360 A 60 PHE H A 86 VAL HGy% 1.0 1.8 5.92 3012 2360 A 60 PHE H A 86 VAL HGx% 1.0 1.8 5.92 3013 2361 A 60 PHE HA A 86 VAL HGy% 1.0 1.8 3.49 3014 2361 A 60 PHE HA A 86 VAL HGx% 1.0 1.8 3.49 3015 2362 A 60 PHE HD% A 86 VAL HGy% 1.0 1.8 3.26 3016 2362 A 60 PHE HD% A 86 VAL HGx% 1.0 1.8 3.26 3017 2363 A 60 PHE HE% A 86 VAL HGy% 1.0 1.8 3.61 3018 2363 A 60 PHE HE% A 86 VAL HGx% 1.0 1.8 3.61 3019 2364 A 60 PHE HZ A 86 VAL HGy% 1.0 1.8 4.07 3020 2364 A 60 PHE HZ A 86 VAL HGx% 1.0 1.8 4.07 3021 2365 A 61 ARG H A 86 VAL HGy% 1.0 1.8 4.78 3022 2365 A 61 ARG H A 86 VAL HGx% 1.0 1.8 4.78 3023 2366 A 62 PHE HZ A 82 ASP HBy 1.0 1.8 3.71 3024 2366 A 62 PHE HZ A 82 ASP HBx 1.0 1.8 3.71 3025 2367 A 65 GLN HA A 66 PRO HGx 1.0 1.8 4.13 3026 2367 A 65 GLN HA A 66 PRO HGy 1.0 1.8 4.13 3027 2368 A 67 ILE H A 66 PRO HGx 1.0 1.8 4.82 3028 2368 A 67 ILE H A 66 PRO HGy 1.0 1.8 4.82 3029 2369 A 68 ASN HA A 69 GLU HGx 1.0 1.8 4.81 3030 2369 A 68 ASN HA A 69 GLU HGy 1.0 1.8 4.81 3031 2370 A 68 ASN HB3 A 69 GLU HGx 1.0 1.8 4.39 3032 2370 A 68 ASN HB3 A 69 GLU HGy 1.0 1.8 4.39 3033 2371 A 69 GLU H A 69 GLU HGx 1.0 1.8 3.48 3034 2371 A 69 GLU H A 69 GLU HGy 1.0 1.8 3.48 3035 2372 A 69 GLU HA A 69 GLU HGx 1.0 1.8 3.45 3036 2372 A 69 GLU HA A 69 GLU HGy 1.0 1.8 3.45 3037 2373 A 70 THR H A 69 GLU HGx 1.0 1.8 3.83 3038 2373 A 70 THR H A 69 GLU HGy 1.0 1.8 3.83 3039 2374 A 70 THR HA A 69 GLU HGx 1.0 1.8 4.38 3040 2374 A 70 THR HA A 69 GLU HGy 1.0 1.8 4.38 3041 2375 A 70 THR HG2% A 69 GLU HGx 1.0 1.8 3.29 3042 2375 A 70 THR HG2% A 69 GLU HGy 1.0 1.8 3.29 3043 2376 A 74 ALA HB% A 75 GLN HE2x 1.0 1.8 4.55 3044 2376 A 74 ALA HB% A 75 GLN HE2y 1.0 1.8 4.55 3045 2377 A 75 GLN HA A 75 GLN HE2x 1.0 1.8 4.95 3046 2377 A 75 GLN HA A 75 GLN HE2y 1.0 1.8 4.95 3047 2378 A 75 GLN HB3 A 75 GLN HE2x 1.0 1.8 4.64 3048 2378 A 75 GLN HB3 A 75 GLN HE2y 1.0 1.8 4.64 3049 2379 A 75 GLN HE2y A 75 GLN HGx 1.0 1.8 3.04 3050 2379 A 75 GLN HGy A 75 GLN HE2x 1.0 1.8 3.04 3051 2379 A 75 GLN HGy A 75 GLN HE2y 1.0 1.8 3.04 3052 2379 A 75 GLN HE2x A 75 GLN HGx 1.0 1.8 3.04 3053 2380 A 77 GLU H A 77 GLU HBx 1.0 1.8 3.53 3054 2380 A 77 GLU H A 77 GLU HBy 1.0 1.8 3.53 3055 2381 A 78 MET H A 77 GLU HBx 1.0 1.8 4.47 3056 2381 A 78 MET H A 77 GLU HBy 1.0 1.8 4.47 3057 2382 A 78 MET HA A 82 ASP HBy 1.0 1.8 5.07 3058 2382 A 78 MET HA A 82 ASP HBx 1.0 1.8 5.07 3059 2383 A 78 MET HB2 A 82 ASP HBy 1.0 1.8 3.74 3060 2383 A 78 MET HB2 A 82 ASP HBx 1.0 1.8 3.74 3061 2384 A 78 MET HB3 A 82 ASP HBy 1.0 1.8 5.59 3062 2384 A 78 MET HB3 A 82 ASP HBx 1.0 1.8 5.59 3063 2385 A 78 MET HG2 A 82 ASP HBy 1.0 1.8 5.44 3064 2385 A 78 MET HG2 A 82 ASP HBx 1.0 1.8 5.44 3065 2386 A 78 MET HE% A 82 ASP HBy 1.0 1.8 3.33 3066 2386 A 78 MET HE% A 82 ASP HBx 1.0 1.8 3.33 3067 2387 A 79 GLU H A 82 ASP HBy 1.0 1.8 4.11 3068 2387 A 79 GLU H A 82 ASP HBx 1.0 1.8 4.11 3069 2388 A 79 GLU HG2 A 82 ASP HBy 1.0 1.8 4.97 3070 2388 A 79 GLU HG2 A 82 ASP HBx 1.0 1.8 4.97 3071 2389 A 79 GLU HG3 A 82 ASP HBy 1.0 1.8 5.12 3072 2389 A 79 GLU HG3 A 82 ASP HBx 1.0 1.8 5.12 3073 2390 A 80 ASP HA A 81 GLU HGy 1.0 1.8 5.46 3074 2390 A 80 ASP HA A 81 GLU HGx 1.0 1.8 5.46 3075 2391 A 80 ASP HBx A 81 GLU HGy 1.0 1.8 3.29 3076 2391 A 80 ASP HBy A 81 GLU HGy 1.0 1.8 3.29 3077 2391 A 81 GLU HGx A 80 ASP HBx 1.0 1.8 3.29 3078 2391 A 80 ASP HBy A 81 GLU HGx 1.0 1.8 3.29 3079 2392 A 81 GLU H A 82 ASP HBy 1.0 1.8 5.22 3080 2392 A 81 GLU H A 82 ASP HBx 1.0 1.8 5.22 3081 2393 A 81 GLU HA A 81 GLU HGy 1.0 1.8 3.32 3082 2393 A 81 GLU HA A 81 GLU HGx 1.0 1.8 3.32 3083 2394 A 82 ASP H A 81 GLU HGy 1.0 1.8 5.20 3084 2394 A 82 ASP H A 81 GLU HGx 1.0 1.8 5.20 3085 2395 A 82 ASP H A 82 ASP HBy 1.0 1.8 3.05 3086 2395 A 82 ASP H A 82 ASP HBx 1.0 1.8 3.05 3087 2396 A 83 THR H A 82 ASP HBy 1.0 1.8 3.58 3088 2396 A 83 THR H A 82 ASP HBx 1.0 1.8 3.58 3089 2397 A 84 ILE HB A 86 VAL HGy% 1.0 1.8 4.54 3090 2397 A 84 ILE HB A 86 VAL HGx% 1.0 1.8 4.54 3091 2398 A 84 ILE HG2% A 86 VAL HGy% 1.0 1.8 3.85 3092 2398 A 84 ILE HG2% A 86 VAL HGx% 1.0 1.8 3.85 3093 2399 A 85 ASP H A 86 VAL HGy% 1.0 1.8 5.37 3094 2399 A 85 ASP H A 86 VAL HGx% 1.0 1.8 5.37 3095 2400 A 85 ASP HA A 86 VAL HGy% 1.0 1.8 4.69 3096 2400 A 85 ASP HA A 86 VAL HGx% 1.0 1.8 4.69 3097 2401 A 85 ASP HBx A 86 VAL HGy% 1.0 1.8 5.92 3098 2401 A 85 ASP HBy A 86 VAL HGy% 1.0 1.8 5.92 3099 2401 A 86 VAL HGx% A 85 ASP HBx 1.0 1.8 5.92 3100 2401 A 85 ASP HBy A 86 VAL HGx% 1.0 1.8 5.92 3101 2402 A 86 VAL H A 86 VAL HGy% 1.0 1.8 3.21 3102 2402 A 86 VAL H A 86 VAL HGx% 1.0 1.8 3.21 3103 2403 A 87 PHE H A 86 VAL HGy% 1.0 1.8 3.20 3104 2403 A 87 PHE H A 86 VAL HGx% 1.0 1.8 3.20 3105 2404 A 87 PHE HB2 A 86 VAL HGy% 1.0 1.8 5.92 3106 2404 A 87 PHE HB2 A 86 VAL HGx% 1.0 1.8 5.92 3107 2405 A 87 PHE HD% A 86 VAL HGy% 1.0 1.8 5.23 3108 2405 A 87 PHE HD% A 86 VAL HGx% 1.0 1.8 5.23 3109 2406 A 88 GLN H A 86 VAL HGy% 1.0 1.8 4.79 3110 2406 A 88 GLN H A 86 VAL HGx% 1.0 1.8 4.79 3111 2407 A 88 GLN HA A 86 VAL HGy% 1.0 1.8 5.92 3112 2407 A 88 GLN HA A 86 VAL HGx% 1.0 1.8 5.92 3113 2408 A 88 GLN HE2y A 86 VAL HGy% 1.0 1.8 5.18 3114 2408 A 88 GLN HE2y A 86 VAL HGx% 1.0 1.8 5.18 3115 2409 A 88 GLN HE2x A 86 VAL HGy% 1.0 1.8 4.96 3116 2409 A 88 GLN HE2x A 86 VAL HGx% 1.0 1.8 4.96 3117 2410 A 87 PHE HE% A 89 GLN HBx 1.0 1.8 5.81 3118 2410 A 87 PHE HE% A 89 GLN HBy 1.0 1.8 5.81 3119 2411 A 88 GLN HA A 89 GLN HBx 1.0 1.8 4.25 3120 2411 A 88 GLN HA A 89 GLN HBy 1.0 1.8 4.25 3121 2412 A 89 GLN HA A 89 GLN HBx 1.0 1.8 2.58 3122 2412 A 89 GLN HA A 89 GLN HBy 1.0 1.8 2.58 3123 2413 A 89 GLN HE21 A 89 GLN HBx 1.0 1.8 5.04 3124 2413 A 89 GLN HE21 A 89 GLN HBy 1.0 1.8 5.04 3125 2414 A 90 GLN H A 89 GLN HBx 1.0 1.8 4.24 3126 2414 A 90 GLN H A 89 GLN HBy 1.0 1.8 4.24 3127 2415 A 90 GLN HE2y A 90 GLN HGx 1.0 1.8 3.10 3128 2415 A 90 GLN HE2x A 90 GLN HGx 1.0 1.8 3.10 3129 2415 A 90 GLN HGy A 90 GLN HE2x 1.0 1.8 3.10 3130 2415 A 90 GLN HGy A 90 GLN HE2y 1.0 1.8 3.10 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _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 44 MET H A 40 LEU O 1.0 1.8 2.22 2 2 A 40 LEU O A 44 MET N 1.0 1.8 3.13 3 3 A 45 LYS H A 41 SER O 1.0 1.8 2.22 4 4 A 41 SER O A 45 LYS N 1.0 1.8 3.13 5 5 A 46 ALA H A 42 LYS O 1.0 1.8 2.22 6 6 A 42 LYS O A 46 ALA N 1.0 1.8 3.13 7 7 A 47 TYR H A 43 LEU O 1.0 1.8 2.22 8 8 A 43 LEU O A 47 TYR N 1.0 1.8 3.13 9 9 A 49 GLU H A 45 LYS O 1.0 1.8 2.22 10 10 A 45 LYS O A 49 GLU N 1.0 1.8 3.13 11 11 A 50 ARG H A 46 ALA O 1.0 1.8 2.22 12 12 A 46 ALA O A 50 ARG N 1.0 1.8 3.13 13 13 A 51 GLN H A 47 TYR O 1.0 1.8 2.22 14 14 A 47 TYR O A 51 GLN N 1.0 1.8 3.13 15 15 A 18 ILE H A 34 ILE O 1.0 1.8 2.12 16 16 A 34 ILE O A 18 ILE N 1.0 1.8 3.05 17 17 A 20 LEU H A 32 PHE O 1.0 1.8 2.12 18 18 A 32 PHE O A 20 LEU N 1.0 1.8 3.05 19 19 A 22 VAL H A 30 VAL O 1.0 1.8 2.12 20 20 A 30 VAL O A 22 VAL N 1.0 1.8 3.05 21 21 A 24 GLY H A 28 SER O 1.0 1.8 2.12 22 22 A 28 SER O A 24 GLY N 1.0 1.8 3.05 23 23 A 27 GLY H A 24 GLY O 1.0 1.8 2.12 24 24 A 24 GLY O A 27 GLY N 1.0 1.8 3.05 25 25 A 30 VAL H A 22 VAL O 1.0 1.8 2.12 26 26 A 22 VAL O A 30 VAL N 1.0 1.8 3.05 27 27 A 32 PHE H A 20 LEU O 1.0 1.8 2.12 28 28 A 20 LEU O A 32 PHE N 1.0 1.8 3.05 29 29 A 34 ILE H A 18 ILE O 1.0 1.8 2.12 30 30 A 18 ILE O A 34 ILE N 1.0 1.8 3.05 31 31 A 21 LYS H A 82 ASP O 1.0 1.8 2.12 32 32 A 82 ASP O A 21 LYS N 1.0 1.8 3.05 33 33 A 23 ALA H A 84 ILE O 1.0 1.8 2.12 34 34 A 84 ILE O A 23 ALA N 1.0 1.8 3.05 35 35 A 81 GLU H A 19 ASN O 1.0 1.8 2.12 36 36 A 19 ASN O A 81 GLU N 1.0 1.8 3.05 37 37 A 84 ILE H A 21 LYS O 1.0 1.8 2.12 38 38 A 21 LYS O A 84 ILE N 1.0 1.8 3.05 39 39 A 86 VAL H A 23 ALA O 1.0 1.8 2.12 40 40 A 23 ALA O A 86 VAL N 1.0 1.8 3.05 41 41 A 62 PHE H A 65 GLN O 1.0 1.8 2.12 42 42 A 65 GLN O A 62 PHE N 1.0 1.8 3.05 43 43 A 67 ILE H A 60 PHE O 1.0 1.8 2.12 44 44 A 60 PHE O A 67 ILE N 1.0 1.8 3.05 45 45 A 85 ASP H A 61 ARG O 1.0 1.8 2.12 46 46 A 61 ARG O A 85 ASP N 1.0 1.8 3.05 47 47 A 87 PHE H A 59 ARG O 1.0 1.8 2.12 48 48 A 59 ARG O A 87 PHE N 1.0 1.8 3.05 49 49 A 59 ARG H A 87 PHE O 1.0 1.8 2.12 50 50 A 87 PHE O A 59 ARG N 1.0 1.8 3.05 51 51 A 61 ARG H A 85 ASP O 1.0 1.8 2.12 52 52 A 85 ASP O A 61 ARG N 1.0 1.8 3.05 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 2 ALA C A 3 ASP N A 3 ASP CA A 3 ASP C 1.0 -143.6 -60.3 PHI 2 2 A 3 ASP N A 3 ASP CA A 3 ASP C A 4 GLU N 1.0 -42.0 38.9 PSI 3 3 A 17 HIS C A 18 ILE N A 18 ILE CA A 18 ILE C 1.0 -163.1 -106.5 PHI 4 4 A 18 ILE N A 18 ILE CA A 18 ILE C A 19 ASN N 1.0 126.0 170.5 PSI 5 5 A 18 ILE C A 19 ASN N A 19 ASN CA A 19 ASN C 1.0 -150.2 -78.4 PHI 6 6 A 19 ASN N A 19 ASN CA A 19 ASN C A 20 LEU N 1.0 112.7 148.8 PSI 7 7 A 19 ASN C A 20 LEU N A 20 LEU CA A 20 LEU C 1.0 -167.7 -92.9 PHI 8 8 A 20 LEU N A 20 LEU CA A 20 LEU C A 21 LYS N 1.0 124.9 175.8 PSI 9 9 A 20 LEU C A 21 LYS N A 21 LYS CA A 21 LYS C 1.0 -173.7 -72.9 PHI 10 10 A 21 LYS N A 21 LYS CA A 21 LYS C A 22 VAL N 1.0 114.5 172.9 PSI 11 11 A 21 LYS C A 22 VAL N A 22 VAL CA A 22 VAL C 1.0 -144.1 -73.2 PHI 12 12 A 22 VAL N A 22 VAL CA A 22 VAL C A 23 ALA N 1.0 95.1 142.2 PSI 13 13 A 22 VAL C A 23 ALA N A 23 ALA CA A 23 ALA C 1.0 -145.1 -64.2 PHI 14 14 A 23 ALA N A 23 ALA CA A 23 ALA C A 24 GLY N 1.0 94.8 175.2 PSI 15 15 A 24 GLY C A 25 GLN N A 25 GLN CA A 25 GLN C 1.0 -80.4 -46.6 PHI 16 16 A 25 GLN N A 25 GLN CA A 25 GLN C A 26 ASP N 1.0 -59.2 7.1 PSI 17 17 A 25 GLN C A 26 ASP N A 26 ASP CA A 26 ASP C 1.0 -104.6 -65.0 PHI 18 18 A 26 ASP N A 26 ASP CA A 26 ASP C A 27 GLY N 1.0 -20.7 21.3 PSI 19 19 A 26 ASP C A 27 GLY N A 27 GLY CA A 27 GLY C 1.0 73.7 104.7 PHI 20 20 A 27 GLY N A 27 GLY CA A 27 GLY C A 28 SER N 1.0 -42.4 40.9 PSI 21 21 A 28 SER C A 29 VAL N A 29 VAL CA A 29 VAL C 1.0 -149.2 -67.1 PHI 22 22 A 29 VAL N A 29 VAL CA A 29 VAL C A 30 VAL N 1.0 95.9 182.3 PSI 23 23 A 29 VAL C A 30 VAL N A 30 VAL CA A 30 VAL C 1.0 -163.4 -97.5 PHI 24 24 A 30 VAL N A 30 VAL CA A 30 VAL C A 31 GLN N 1.0 110.5 151.0 PSI 25 25 A 30 VAL C A 31 GLN N A 31 GLN CA A 31 GLN C 1.0 -155.1 -85.0 PHI 26 26 A 31 GLN N A 31 GLN CA A 31 GLN C A 32 PHE N 1.0 106.6 166.8 PSI 27 27 A 31 GLN C A 32 PHE N A 32 PHE CA A 32 PHE C 1.0 -156.9 -114.6 PHI 28 28 A 34 ILE N A 34 ILE CA A 34 ILE C A 35 LYS N 1.0 126.2 178.7 PSI 29 29 A 34 ILE C A 35 LYS N A 35 LYS CA A 35 LYS C 1.0 -100.7 -56.5 PHI 30 30 A 35 LYS N A 35 LYS CA A 35 LYS C A 36 ARG N 1.0 132.2 203.8 PSI 31 31 A 35 LYS C A 36 ARG N A 36 ARG CA A 36 ARG C 1.0 -71.1 -41.9 PHI 32 32 A 36 ARG N A 36 ARG CA A 36 ARG C A 37 HIS N 1.0 -51.3 -7.0 PSI 33 33 A 36 ARG C A 37 HIS N A 37 HIS CA A 37 HIS C 1.0 -123.7 -64.7 PHI 34 34 A 37 HIS N A 37 HIS CA A 37 HIS C A 38 THR N 1.0 -28.9 24.4 PSI 35 35 A 37 HIS C A 38 THR N A 38 THR CA A 38 THR C 1.0 -121.3 -34.3 PHI 36 36 A 38 THR N A 38 THR CA A 38 THR C A 39 PRO N 1.0 76.7 167.9 PSI 37 37 A 39 PRO C A 40 LEU N A 40 LEU CA A 40 LEU C 1.0 -70.3 -42.5 PHI 38 38 A 40 LEU N A 40 LEU CA A 40 LEU C A 41 SER N 1.0 -56.2 -19.7 PSI 39 39 A 40 LEU C A 41 SER N A 41 SER CA A 41 SER C 1.0 -71.0 -51.0 PHI 40 40 A 41 SER N A 41 SER CA A 41 SER C A 42 LYS N 1.0 -54.8 -28.7 PSI 41 41 A 41 SER C A 42 LYS N A 42 LYS CA A 42 LYS C 1.0 -77.3 -56.7 PHI 42 42 A 42 LYS N A 42 LYS CA A 42 LYS C A 43 LEU N 1.0 -51.9 -19.3 PSI 43 43 A 42 LYS C A 43 LEU N A 43 LEU CA A 43 LEU C 1.0 -74.0 -54.0 PHI 44 44 A 43 LEU N A 43 LEU CA A 43 LEU C A 44 MET N 1.0 -52.4 -32.4 PSI 45 45 A 43 LEU C A 44 MET N A 44 MET CA A 44 MET C 1.0 -71.0 -50.5 PHI 46 46 A 44 MET N A 44 MET CA A 44 MET C A 45 LYS N 1.0 -53.1 -30.2 PSI 47 47 A 44 MET C A 45 LYS N A 45 LYS CA A 45 LYS C 1.0 -69.5 -49.5 PHI 48 48 A 45 LYS N A 45 LYS CA A 45 LYS C A 46 ALA N 1.0 -60.7 -29.0 PSI 49 49 A 45 LYS C A 46 ALA N A 46 ALA CA A 46 ALA C 1.0 -77.6 -54.4 PHI 50 50 A 46 ALA N A 46 ALA CA A 46 ALA C A 47 TYR N 1.0 -60.5 -17.4 PSI 51 51 A 46 ALA C A 47 TYR N A 47 TYR CA A 47 TYR C 1.0 -75.5 -55.5 PHI 52 52 A 47 TYR N A 47 TYR CA A 47 TYR C A 48 CYS N 1.0 -55.2 -31.1 PSI 53 53 A 47 TYR C A 48 CYS N A 48 CYS CA A 48 CYS C 1.0 -71.5 -51.5 PHI 54 54 A 48 CYS N A 48 CYS CA A 48 CYS C A 49 GLU N 1.0 -54.7 -34.7 PSI 55 55 A 48 CYS C A 49 GLU N A 49 GLU CA A 49 GLU C 1.0 -73.2 -51.4 PHI 56 56 A 49 GLU N A 49 GLU CA A 49 GLU C A 50 ARG N 1.0 -58.5 -28.2 PSI 57 57 A 49 GLU C A 50 ARG N A 50 ARG CA A 50 ARG C 1.0 -90.7 -44.5 PHI 58 58 A 50 ARG N A 50 ARG CA A 50 ARG C A 51 GLN N 1.0 -67.3 -11.4 PSI 59 59 A 50 ARG C A 51 GLN N A 51 GLN CA A 51 GLN C 1.0 -126.9 -71.3 PHI 60 60 A 51 GLN N A 51 GLN CA A 51 GLN C A 52 GLY N 1.0 -21.3 16.8 PSI 61 61 A 51 GLN C A 52 GLY N A 52 GLY CA A 52 GLY C 1.0 53.4 93.5 PHI 62 62 A 52 GLY N A 52 GLY CA A 52 GLY C A 53 LEU N 1.0 3.0 56.2 PSI 63 63 A 52 GLY C A 53 LEU N A 53 LEU CA A 53 LEU C 1.0 -145.8 -76.0 PHI 64 64 A 53 LEU N A 53 LEU CA A 53 LEU C A 54 SER N 1.0 130.7 175.2 PSI 65 65 A 53 LEU C A 54 SER N A 54 SER CA A 54 SER C 1.0 -124.3 -41.4 PHI 66 66 A 54 SER N A 54 SER CA A 54 SER C A 55 MET N 1.0 99.9 160.0 PSI 67 67 A 54 SER C A 55 MET N A 55 MET CA A 55 MET C 1.0 -79.3 -44.7 PHI 68 68 A 55 MET N A 55 MET CA A 55 MET C A 56 ARG N 1.0 -49.3 -10.0 PSI 69 69 A 55 MET C A 56 ARG N A 56 ARG CA A 56 ARG C 1.0 -83.1 -59.0 PHI 70 70 A 56 ARG N A 56 ARG CA A 56 ARG C A 57 GLN N 1.0 -56.4 14.5 PSI 71 71 A 56 ARG C A 57 GLN N A 57 GLN CA A 57 GLN C 1.0 -129.3 -74.1 PHI 72 72 A 57 GLN N A 57 GLN CA A 57 GLN C A 58 ILE N 1.0 -53.9 37.8 PSI 73 73 A 57 GLN C A 58 ILE N A 58 ILE CA A 58 ILE C 1.0 -167.1 -81.9 PHI 74 74 A 58 ILE N A 58 ILE CA A 58 ILE C A 59 ARG N 1.0 104.1 193.8 PSI 75 75 A 58 ILE C A 59 ARG N A 59 ARG CA A 59 ARG C 1.0 -169.5 -102.6 PHI 76 76 A 59 ARG N A 59 ARG CA A 59 ARG C A 60 PHE N 1.0 110.4 174.1 PSI 77 77 A 59 ARG C A 60 PHE N A 60 PHE CA A 60 PHE C 1.0 -140.8 -79.8 PHI 78 78 A 60 PHE N A 60 PHE CA A 60 PHE C A 61 ARG N 1.0 122.6 149.9 PSI 79 79 A 60 PHE C A 61 ARG N A 61 ARG CA A 61 ARG C 1.0 -172.5 -102.1 PHI 80 80 A 61 ARG N A 61 ARG CA A 61 ARG C A 62 PHE N 1.0 121.2 176.7 PSI 81 81 A 61 ARG C A 62 PHE N A 62 PHE CA A 62 PHE C 1.0 -173.5 -103.2 PHI 82 82 A 62 PHE N A 62 PHE CA A 62 PHE C A 63 ASP N 1.0 105.9 146.6 PSI 83 83 A 62 PHE C A 63 ASP N A 63 ASP CA A 63 ASP C 1.0 37.6 69.4 PHI 84 84 A 63 ASP N A 63 ASP CA A 63 ASP C A 64 GLY N 1.0 26.5 58.9 PSI 85 85 A 63 ASP C A 64 GLY N A 64 GLY CA A 64 GLY C 1.0 53.9 102.0 PHI 86 86 A 64 GLY N A 64 GLY CA A 64 GLY C A 65 GLN N 1.0 -31.1 37.0 PSI 87 87 A 64 GLY C A 65 GLN N A 65 GLN CA A 65 GLN C 1.0 -149.1 -70.9 PHI 88 88 A 65 GLN N A 65 GLN CA A 65 GLN C A 66 PRO N 1.0 67.2 176.9 PSI 89 89 A 66 PRO C A 67 ILE N A 67 ILE CA A 67 ILE C 1.0 -147.0 -68.6 PHI 90 90 A 67 ILE N A 67 ILE CA A 67 ILE C A 68 ASN N 1.0 102.2 181.9 PSI 91 91 A 67 ILE C A 68 ASN N A 68 ASN CA A 68 ASN C 1.0 -141.0 -52.9 PHI 92 92 A 68 ASN N A 68 ASN CA A 68 ASN C A 69 GLU N 1.0 140.4 200.0 PSI 93 93 A 68 ASN C A 69 GLU N A 69 GLU CA A 69 GLU C 1.0 -80.3 -33.9 PHI 94 94 A 69 GLU N A 69 GLU CA A 69 GLU C A 70 THR N 1.0 -56.3 3.3 PSI 95 95 A 69 GLU C A 70 THR N A 70 THR CA A 70 THR C 1.0 -140.0 -57.6 PHI 96 96 A 70 THR N A 70 THR CA A 70 THR C A 71 ASP N 1.0 -53.6 33.0 PSI 97 97 A 73 PRO C A 74 ALA N A 74 ALA CA A 74 ALA C 1.0 -94.8 -43.4 PHI 98 98 A 74 ALA N A 74 ALA CA A 74 ALA C A 75 GLN N 1.0 -58.4 -10.9 PSI 99 99 A 74 ALA C A 75 GLN N A 75 GLN CA A 75 GLN C 1.0 -85.8 -47.6 PHI 100 100 A 75 GLN N A 75 GLN CA A 75 GLN C A 76 LEU N 1.0 -54.5 -6.1 PSI 101 101 A 75 GLN C A 76 LEU N A 76 LEU CA A 76 LEU C 1.0 -111.1 -76.5 PHI 102 102 A 76 LEU N A 76 LEU CA A 76 LEU C A 77 GLU N 1.0 -14.5 36.3 PSI 103 103 A 76 LEU C A 77 GLU N A 77 GLU CA A 77 GLU C 1.0 43.8 71.9 PHI 104 104 A 77 GLU N A 77 GLU CA A 77 GLU C A 78 MET N 1.0 10.8 62.1 PSI 105 105 A 78 MET C A 79 GLU N A 79 GLU CA A 79 GLU C 1.0 -159.3 -88.2 PHI 106 106 A 79 GLU N A 79 GLU CA A 79 GLU C A 80 ASP N 1.0 136.6 196.0 PSI 107 107 A 80 ASP C A 81 GLU N A 81 GLU CA A 81 GLU C 1.0 42.0 95.3 PHI 108 108 A 81 GLU N A 81 GLU CA A 81 GLU C A 82 ASP N 1.0 0.6 52.8 PSI 109 109 A 82 ASP C A 83 THR N A 83 THR CA A 83 THR C 1.0 -158.5 -74.2 PHI 110 110 A 83 THR N A 83 THR CA A 83 THR C A 84 ILE N 1.0 106.8 169.0 PSI 111 111 A 83 THR C A 84 ILE N A 84 ILE CA A 84 ILE C 1.0 -154.8 -80.8 PHI 112 112 A 84 ILE N A 84 ILE CA A 84 ILE C A 85 ASP N 1.0 110.8 155.0 PSI 113 113 A 84 ILE C A 85 ASP N A 85 ASP CA A 85 ASP C 1.0 -168.1 -73.0 PHI 114 114 A 85 ASP N A 85 ASP CA A 85 ASP C A 86 VAL N 1.0 96.9 180.8 PSI 115 115 A 85 ASP C A 86 VAL N A 86 VAL CA A 86 VAL C 1.0 -152.2 -102.4 PHI 116 116 A 86 VAL N A 86 VAL CA A 86 VAL C A 87 PHE N 1.0 115.2 171.5 PSI 117 117 A 86 VAL C A 87 PHE N A 87 PHE CA A 87 PHE C 1.0 -165.4 -75.7 PHI 118 118 A 87 PHE N A 87 PHE CA A 87 PHE C A 88 GLN N 1.0 108.0 167.3 PSI 119 119 A 87 PHE C A 88 GLN N A 88 GLN CA A 88 GLN C 1.0 -131.6 -47.6 PHI 120 120 A 88 GLN N A 88 GLN CA A 88 GLN C A 89 GLN N 1.0 112.2 164.9 PSI stop_ save_ save_CNS/XPLOR_dipolar_coupling_2 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_2 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 2 ALA N A 2 ALA H 1.0 . . . 2 2 A 4 GLU N A 4 GLU H 1.0 . . . 3 3 A 5 LYS N A 5 LYS H 1.0 . . . 4 4 A 7 LYS N A 7 LYS H 1.0 . . . 5 5 A 9 GLY N A 9 GLY H 1.0 . . . 6 6 A 11 LYS N A 11 LYS H 1.0 . . . 7 7 A 12 THR N A 12 THR H 1.0 . . . 8 8 A 13 GLU N A 13 GLU H 1.0 . . . 9 9 A 14 ASN N A 14 ASN H 1.0 . . . 10 10 A 16 ASP N A 16 ASP H 1.0 . . . 11 11 A 17 HIS N A 17 HIS H 1.0 . . . 12 12 A 18 ILE N A 18 ILE H 1.0 . . . 13 13 A 22 VAL N A 22 VAL H 1.0 . . . 14 14 A 23 ALA N A 23 ALA H 1.0 . . . 15 15 A 24 GLY N A 24 GLY H 1.0 . . . 16 16 A 27 GLY N A 27 GLY H 1.0 . . . 17 17 A 28 SER N A 28 SER H 1.0 . . . 18 18 A 29 VAL N A 29 VAL H 1.0 . . . 19 19 A 30 VAL N A 30 VAL H 1.0 . . . 20 20 A 31 GLN N A 31 GLN H 1.0 . . . 21 21 A 32 PHE N A 32 PHE H 1.0 . . . 22 22 A 37 HIS N A 37 HIS H 1.0 . . . 23 23 A 38 THR N A 38 THR H 1.0 . . . 24 24 A 42 LYS N A 42 LYS H 1.0 . . . 25 25 A 43 LEU N A 43 LEU H 1.0 . . . 26 26 A 46 ALA N A 46 ALA H 1.0 . . . 27 27 A 47 TYR N A 47 TYR H 1.0 . . . 28 28 A 48 CYS N A 48 CYS H 1.0 . . . 29 29 A 51 GLN N A 51 GLN H 1.0 . . . 30 30 A 52 GLY N A 52 GLY H 1.0 . . . 31 31 A 53 LEU N A 53 LEU H 1.0 . . . 32 32 A 54 SER N A 54 SER H 1.0 . . . 33 33 A 57 GLN N A 57 GLN H 1.0 . . . 34 34 A 58 ILE N A 58 ILE H 1.0 . . . 35 35 A 59 ARG N A 59 ARG H 1.0 . . . 36 36 A 61 ARG N A 61 ARG H 1.0 . . . 37 37 A 63 ASP N A 63 ASP H 1.0 . . . 38 38 A 64 GLY N A 64 GLY H 1.0 . . . 39 39 A 65 GLN N A 65 GLN H 1.0 . . . 40 40 A 67 ILE N A 67 ILE H 1.0 . . . 41 41 A 68 ASN N A 68 ASN H 1.0 . . . 42 42 A 70 THR N A 70 THR H 1.0 . . . 43 43 A 71 ASP N A 71 ASP H 1.0 . . . 44 44 A 72 THR N A 72 THR H 1.0 . . . 45 45 A 76 LEU N A 76 LEU H 1.0 . . . 46 46 A 79 GLU N A 79 GLU H 1.0 . . . 47 47 A 80 ASP N A 80 ASP H 1.0 . . . 48 48 A 81 GLU N A 81 GLU H 1.0 . . . 49 49 A 82 ASP N A 82 ASP H 1.0 . . . 50 50 A 83 THR N A 83 THR H 1.0 . . . 51 51 A 84 ILE N A 84 ILE H 1.0 . . . 52 52 A 86 VAL N A 86 VAL H 1.0 . . . 53 53 A 87 PHE N A 87 PHE H 1.0 . . . 54 54 A 88 GLN N A 88 GLN H 1.0 . . . 55 55 A 89 GLN N A 89 GLN H 1.0 . . . 56 56 A 90 GLN N A 90 GLN H 1.0 . . . 57 57 A 92 GLY N A 92 GLY H 1.0 . . . 58 58 A 93 GLY N A 93 GLY H 1.0 . . . stop_ save_