data_nef_c19200_2m7p save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_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 7 CYS SG 1 20 CYS SG 1 14 CYS SG 1 33 CYS SG 1 27 CYS SG 1 42 CYS SG 1 25 TRP O 2 1 CA CA 1 38 ASP OD2 2 1 CA CA 1 30 GLN O 2 1 CA CA 1 28 ASP OD1 2 1 CA CA 1 39 GLU OE2 2 1 CA CA 1 32 ASP OD2 2 1 CA CA 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 1 GLY start . false 2 A 2 SER middle . . 3 A 3 GLN middle . . 4 A 4 ASP middle . . 5 A 5 VAL middle . . 6 A 6 THR middle . . 7 A 7 CYS middle -HG . 8 A 8 SER middle . . 9 A 9 LEU middle . . 10 A 10 GLY middle . false 11 A 11 TYR middle . . 12 A 12 PHE middle . . 13 A 13 PRO middle . false 14 A 14 CYS middle -HG . 15 A 15 GLY middle . false 16 A 16 ASN middle . . 17 A 17 ILE middle . . 18 A 18 THR middle . . 19 A 19 LYS middle . . 20 A 20 CYS middle -HG . 21 A 21 ILE middle . . 22 A 22 PRO middle . false 23 A 23 GLN middle . . 24 A 24 PHE middle . . 25 A 25 TRP middle . . 26 A 26 ARG middle . . 27 A 27 CYS middle -HG . 28 A 28 ASP middle . . 29 A 29 GLY middle . false 30 A 30 GLN middle . . 31 A 31 VAL middle . . 32 A 32 ASP middle . . 33 A 33 CYS middle -HG . 34 A 34 ASP middle . . 35 A 35 ASN middle . . 36 A 36 GLY middle . false 37 A 37 SER middle . . 38 A 38 ASP middle . . 39 A 39 GLU middle . . 40 A 40 GLN middle . . 41 A 41 GLY middle . false 42 A 42 CYS end -HG . 43 B 1 CA . . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 5 VAL H H 1 8.246 0.02 A 5 VAL HA H 1 4.199 0.02 A 5 VAL HB H 1 1.993 0.02 A 5 VAL HGx% H 1 0.845 0.02 A 5 VAL HGy% H 1 0.889 0.02 A 5 VAL CA C 13 62.696 0.20 A 5 VAL CB C 13 33.858 0.20 A 5 VAL CGy C 13 21.806 0.20 A 5 VAL CGx C 13 21.388 0.20 A 5 VAL N N 15 122.590 0.12 A 6 THR H H 1 8.243 0.02 A 6 THR HA H 1 4.376 0.02 A 6 THR HB H 1 4.076 0.02 A 6 THR HG2% H 1 1.162 0.02 A 6 THR CA C 13 61.781 0.20 A 6 THR CB C 13 70.908 0.20 A 6 THR CG2 C 13 22.090 0.20 A 6 THR N N 15 119.169 0.12 A 7 CYS H H 1 8.656 0.02 A 7 CYS HA H 1 4.824 0.02 A 7 CYS HBx H 1 2.557 0.02 A 7 CYS HBy H 1 3.061 0.02 A 7 CYS CA C 13 53.218 0.20 A 7 CYS CB C 13 41.125 0.20 A 7 CYS N N 15 121.405 0.12 A 8 SER H H 1 8.574 0.02 A 8 SER HA H 1 4.349 0.02 A 8 SER HBy H 1 3.836 0.02 A 8 SER HBx H 1 3.609 0.02 A 8 SER CA C 13 58.967 0.20 A 8 SER CB C 13 64.571 0.20 A 8 SER N N 15 118.316 0.12 A 9 LEU H H 1 8.260 0.02 A 9 LEU HA H 1 4.230 0.02 A 9 LEU HBy H 1 1.661 0.02 A 9 LEU HBx H 1 1.635 0.02 A 9 LEU HDx% H 1 0.948 0.02 A 9 LEU HDy% H 1 0.979 0.02 A 9 LEU HG H 1 1.669 0.02 A 9 LEU CA C 13 57.704 0.20 A 9 LEU CB C 13 42.300 0.20 A 9 LEU CDx C 13 24.990 0.20 A 9 LEU CDy C 13 24.991 0.20 A 9 LEU CG C 13 27.473 0.20 A 9 LEU N N 15 122.178 0.12 A 10 GLY H H 1 9.031 0.02 A 10 GLY HAy H 1 4.270 0.02 A 10 GLY HAx H 1 3.660 0.02 A 10 GLY CA C 13 45.669 0.20 A 10 GLY N N 15 112.756 0.12 A 11 TYR H H 1 8.335 0.02 A 11 TYR HA H 1 5.066 0.02 A 11 TYR HBx H 1 2.412 0.02 A 11 TYR HBy H 1 3.209 0.02 A 11 TYR HDx H 1 6.520 0.02 A 11 TYR HDy H 1 6.520 0.02 A 11 TYR HEx H 1 6.608 0.02 A 11 TYR HEy H 1 6.608 0.02 A 11 TYR CA C 13 57.285 0.20 A 11 TYR CB C 13 41.830 0.20 A 11 TYR CDy C 13 133.067 0.20 A 11 TYR CEy C 13 118.350 0.20 A 11 TYR N N 15 121.686 0.12 A 12 PHE H H 1 9.791 0.02 A 12 PHE HA H 1 5.183 0.02 A 12 PHE HBx H 1 2.895 0.02 A 12 PHE HBy H 1 3.050 0.02 A 12 PHE HDx H 1 7.116 0.02 A 12 PHE HDy H 1 7.116 0.02 A 12 PHE HEx H 1 7.070 0.02 A 12 PHE HEy H 1 7.070 0.02 A 12 PHE HZ H 1 7.309 0.02 A 12 PHE CA C 13 54.843 0.20 A 12 PHE CB C 13 41.740 0.20 A 12 PHE CDx C 13 133.033 0.20 A 12 PHE CEx C 13 129.953 0.20 A 12 PHE CZ C 13 131.983 0.20 A 12 PHE N N 15 122.244 0.12 A 13 PRO HA H 1 5.002 0.02 A 13 PRO HBy H 1 2.027 0.02 A 13 PRO HBx H 1 1.830 0.02 A 13 PRO HDx H 1 3.586 0.02 A 13 PRO HDy H 1 3.738 0.02 A 13 PRO HGx H 1 2.027 0.02 A 13 PRO HGy H 1 2.116 0.02 A 13 PRO CA C 13 62.093 0.20 A 13 PRO CB C 13 32.637 0.20 A 13 PRO CD C 13 51.254 0.20 A 13 PRO CG C 13 27.500 0.20 A 14 CYS H H 1 8.630 0.02 A 14 CYS HA H 1 4.897 0.02 A 14 CYS HBy H 1 3.538 0.02 A 14 CYS HBx H 1 2.955 0.02 A 14 CYS CA C 13 55.375 0.20 A 14 CYS CB C 13 42.581 0.20 A 14 CYS N N 15 118.471 0.12 A 15 GLY H H 1 8.372 0.02 A 15 GLY HAy H 1 4.427 0.02 A 15 GLY HAx H 1 3.736 0.02 A 15 GLY CA C 13 45.735 0.20 A 15 GLY N N 15 109.188 0.12 A 16 ASN H H 1 9.709 0.02 A 16 ASN HA H 1 4.533 0.02 A 16 ASN HBx H 1 2.845 0.02 A 16 ASN HBy H 1 2.902 0.02 A 16 ASN HD2x H 1 7.036 0.02 A 16 ASN HD2y H 1 7.705 0.02 A 16 ASN CA C 13 55.543 0.20 A 16 ASN CB C 13 38.841 0.20 A 16 ASN N N 15 122.147 0.12 A 16 ASN ND2 N 15 113.877 0.12 A 17 ILE H H 1 8.196 0.02 A 17 ILE HA H 1 4.215 0.02 A 17 ILE HB H 1 2.024 0.02 A 17 ILE HD1% H 1 0.882 0.02 A 17 ILE HG1y H 1 1.450 0.02 A 17 ILE HG1x H 1 1.197 0.02 A 17 ILE HG2% H 1 0.909 0.02 A 17 ILE CA C 13 61.465 0.20 A 17 ILE CB C 13 37.913 0.20 A 17 ILE CD1 C 13 13.556 0.20 A 17 ILE CG1 C 13 27.747 0.20 A 17 ILE CG2 C 13 18.298 0.20 A 17 ILE N N 15 120.251 0.12 A 18 THR H H 1 7.969 0.02 A 18 THR HA H 1 3.985 0.02 A 18 THR HB H 1 4.019 0.02 A 18 THR HG2% H 1 1.150 0.02 A 18 THR CA C 13 64.041 0.20 A 18 THR CB C 13 69.529 0.20 A 18 THR CG2 C 13 23.016 0.20 A 18 THR N N 15 118.356 0.12 A 19 LYS H H 1 8.271 0.02 A 19 LYS HA H 1 4.468 0.02 A 19 LYS HBy H 1 1.796 0.02 A 19 LYS HBx H 1 1.750 0.02 A 19 LYS HDx H 1 1.736 0.02 A 19 LYS HDy H 1 1.736 0.02 A 19 LYS HEy H 1 3.032 0.02 A 19 LYS HEx H 1 2.962 0.02 A 19 LYS HGx H 1 1.374 0.02 A 19 LYS HGy H 1 1.374 0.02 A 19 LYS CA C 13 56.099 0.20 A 19 LYS CB C 13 35.855 0.20 A 19 LYS CD C 13 30.250 0.20 A 19 LYS CE C 13 42.815 0.20 A 19 LYS CG C 13 25.294 0.20 A 19 LYS N N 15 124.860 0.12 A 20 CYS H H 1 8.543 0.02 A 20 CYS HA H 1 5.203 0.02 A 20 CYS HBy H 1 2.880 0.02 A 20 CYS HBx H 1 2.651 0.02 A 20 CYS CA C 13 55.367 0.20 A 20 CYS CB C 13 44.418 0.20 A 20 CYS N N 15 122.195 0.12 A 21 ILE H H 1 9.070 0.02 A 21 ILE HA H 1 4.690 0.02 A 21 ILE HB H 1 1.723 0.02 A 21 ILE HD1% H 1 0.947 0.02 A 21 ILE HG1x H 1 0.948 0.02 A 21 ILE HG1y H 1 1.185 0.02 A 21 ILE HG2% H 1 0.938 0.02 A 21 ILE CA C 13 58.296 0.20 A 21 ILE CB C 13 39.854 0.20 A 21 ILE CD1 C 13 16.564 0.20 A 21 ILE CG1 C 13 25.175 0.20 A 21 ILE CG2 C 13 18.804 0.20 A 21 ILE N N 15 118.915 0.12 A 22 PRO HA H 1 3.311 0.02 A 22 PRO HBy H 1 1.394 0.02 A 22 PRO HBx H 1 0.321 0.02 A 22 PRO HDx H 1 1.483 0.02 A 22 PRO HDy H 1 2.819 0.02 A 22 PRO HGx H 1 0.562 0.02 A 22 PRO HGy H 1 0.990 0.02 A 22 PRO CA C 13 63.091 0.20 A 22 PRO CB C 13 32.303 0.20 A 22 PRO CD C 13 49.489 0.20 A 22 PRO CG C 13 27.770 0.20 A 23 GLN H H 1 8.285 0.02 A 23 GLN HA H 1 3.914 0.02 A 23 GLN HBy H 1 1.950 0.02 A 23 GLN HBx H 1 1.905 0.02 A 23 GLN HE2y H 1 7.325 0.02 A 23 GLN HE2x H 1 6.816 0.02 A 23 GLN HGx H 1 2.248 0.02 A 23 GLN HGy H 1 2.248 0.02 A 23 GLN CA C 13 59.429 0.20 A 23 GLN CB C 13 28.229 0.20 A 23 GLN CG C 13 33.671 0.20 A 23 GLN N N 15 121.357 0.12 A 23 GLN NE2 N 15 111.092 0.12 A 24 PHE H H 1 7.218 0.02 A 24 PHE HA H 1 4.783 0.02 A 24 PHE HBx H 1 3.124 0.02 A 24 PHE HBy H 1 3.425 0.02 A 24 PHE HDx H 1 7.322 0.02 A 24 PHE HDy H 1 7.322 0.02 A 24 PHE HEx H 1 7.427 0.02 A 24 PHE HEy H 1 7.427 0.02 A 24 PHE CA C 13 58.205 0.20 A 24 PHE CB C 13 37.991 0.20 A 24 PHE CDy C 13 132.709 0.20 A 24 PHE CEy C 13 132.791 0.20 A 24 PHE N N 15 113.078 0.12 A 25 TRP H H 1 7.925 0.02 A 25 TRP HA H 1 5.263 0.02 A 25 TRP HBx H 1 3.104 0.02 A 25 TRP HBy H 1 3.842 0.02 A 25 TRP HD1 H 1 6.379 0.02 A 25 TRP HE1 H 1 9.648 0.02 A 25 TRP HE3 H 1 7.148 0.02 A 25 TRP HH2 H 1 7.200 0.02 A 25 TRP HZ2 H 1 7.339 0.02 A 25 TRP HZ3 H 1 7.239 0.02 A 25 TRP CA C 13 55.831 0.20 A 25 TRP CB C 13 28.913 0.20 A 25 TRP CD1 C 13 123.836 0.20 A 25 TRP CE3 C 13 121.708 0.20 A 25 TRP CH2 C 13 125.194 0.20 A 25 TRP CZ2 C 13 114.886 0.20 A 25 TRP CZ3 C 13 121.603 0.20 A 25 TRP N N 15 119.501 0.12 A 25 TRP NE1 N 15 127.005 0.12 A 26 ARG H H 1 8.126 0.02 A 26 ARG HA H 1 4.415 0.02 A 26 ARG HBx H 1 1.546 0.02 A 26 ARG HBy H 1 2.092 0.02 A 26 ARG HDx H 1 2.532 0.02 A 26 ARG HDy H 1 2.874 0.02 A 26 ARG HE H 1 6.925 0.02 A 26 ARG HGy H 1 1.546 0.02 A 26 ARG HGx H 1 1.401 0.02 A 26 ARG CA C 13 56.965 0.20 A 26 ARG CB C 13 30.716 0.20 A 26 ARG CD C 13 43.703 0.20 A 26 ARG CG C 13 28.161 0.20 A 26 ARG N N 15 126.678 0.12 A 26 ARG NE N 15 84.351 0.12 A 27 CYS H H 1 8.927 0.02 A 27 CYS HA H 1 4.840 0.02 A 27 CYS HBy H 1 3.315 0.02 A 27 CYS HBx H 1 3.030 0.02 A 27 CYS CA C 13 56.090 0.20 A 27 CYS CB C 13 36.380 0.20 A 27 CYS N N 15 123.876 0.12 A 28 ASP H H 1 9.642 0.02 A 28 ASP HA H 1 4.865 0.02 A 28 ASP HBx H 1 2.588 0.02 A 28 ASP HBy H 1 3.123 0.02 A 28 ASP CA C 13 52.819 0.20 A 28 ASP CB C 13 42.189 0.20 A 28 ASP N N 15 121.299 0.12 A 29 GLY H H 1 9.361 0.02 A 29 GLY HAy H 1 4.193 0.02 A 29 GLY HAx H 1 3.517 0.02 A 29 GLY CA C 13 46.113 0.20 A 29 GLY N N 15 111.548 0.12 A 30 GLN H H 1 7.513 0.02 A 30 GLN HA H 1 4.570 0.02 A 30 GLN HBy H 1 1.936 0.02 A 30 GLN HBx H 1 1.796 0.02 A 30 GLN HE2y H 1 7.454 0.02 A 30 GLN HE2x H 1 6.393 0.02 A 30 GLN HGx H 1 1.936 0.02 A 30 GLN HGy H 1 1.936 0.02 A 30 GLN CA C 13 53.953 0.20 A 30 GLN CB C 13 31.253 0.20 A 30 GLN CG C 13 34.143 0.20 A 30 GLN N N 15 119.081 0.12 A 30 GLN NE2 N 15 112.792 0.12 A 31 VAL H H 1 9.403 0.02 A 31 VAL HA H 1 3.949 0.02 A 31 VAL HB H 1 2.085 0.02 A 31 VAL HGx% H 1 1.119 0.02 A 31 VAL HGy% H 1 0.967 0.02 A 31 VAL CA C 13 65.173 0.20 A 31 VAL CB C 13 31.503 0.20 A 31 VAL CGy C 13 24.011 0.20 A 31 VAL CGx C 13 22.328 0.20 A 31 VAL N N 15 130.267 0.12 A 32 ASP H H 1 10.474 0.02 A 32 ASP HA H 1 4.859 0.02 A 32 ASP HBx H 1 2.721 0.02 A 32 ASP HBy H 1 2.950 0.02 A 32 ASP CA C 13 56.636 0.20 A 32 ASP CB C 13 45.816 0.20 A 32 ASP N N 15 131.364 0.12 A 33 CYS H H 1 8.231 0.02 A 33 CYS HA H 1 4.984 0.02 A 33 CYS HBx H 1 3.230 0.02 A 33 CYS HBy H 1 3.230 0.02 A 33 CYS CA C 13 54.411 0.20 A 33 CYS CB C 13 43.130 0.20 A 33 CYS N N 15 119.127 0.12 A 34 ASP HA H 1 4.283 0.02 A 34 ASP HBy H 1 2.801 0.02 A 34 ASP HBx H 1 2.752 0.02 A 34 ASP CA C 13 57.651 0.20 A 34 ASP CB C 13 40.574 0.20 A 35 ASN H H 1 7.842 0.02 A 35 ASN HA H 1 4.796 0.02 A 35 ASN HBy H 1 3.399 0.02 A 35 ASN HBx H 1 2.869 0.02 A 35 ASN HD2y H 1 7.859 0.02 A 35 ASN HD2x H 1 7.401 0.02 A 35 ASN CA C 13 52.031 0.20 A 35 ASN CB C 13 38.525 0.20 A 35 ASN N N 15 114.887 0.12 A 35 ASN ND2 N 15 112.971 0.12 A 36 GLY H H 1 8.269 0.02 A 36 GLY HAy H 1 4.215 0.02 A 36 GLY HAx H 1 3.908 0.02 A 36 GLY CA C 13 46.895 0.20 A 36 GLY N N 15 106.757 0.12 A 37 SER H H 1 7.900 0.02 A 37 SER HA H 1 4.026 0.02 A 37 SER HBx H 1 3.976 0.02 A 37 SER HBy H 1 4.121 0.02 A 37 SER CA C 13 62.619 0.20 A 37 SER CB C 13 63.494 0.20 A 37 SER N N 15 115.625 0.12 A 38 ASP H H 1 9.737 0.02 A 38 ASP HA H 1 4.437 0.02 A 38 ASP HBx H 1 2.846 0.02 A 38 ASP HBy H 1 3.170 0.02 A 38 ASP CA C 13 56.398 0.20 A 38 ASP CB C 13 41.045 0.20 A 38 ASP N N 15 117.183 0.12 A 39 GLU H H 1 7.511 0.02 A 39 GLU HA H 1 4.866 0.02 A 39 GLU HBx H 1 1.520 0.02 A 39 GLU HBy H 1 2.590 0.02 A 39 GLU HGy H 1 2.229 0.02 A 39 GLU HGx H 1 1.937 0.02 A 39 GLU CA C 13 54.774 0.20 A 39 GLU CB C 13 30.374 0.20 A 39 GLU CG C 13 37.420 0.20 A 39 GLU N N 15 116.916 0.12 A 40 GLN H H 1 7.084 0.02 A 40 GLN HA H 1 4.535 0.02 A 40 GLN HBy H 1 2.097 0.02 A 40 GLN HBx H 1 2.001 0.02 A 40 GLN HE2y H 1 7.472 0.02 A 40 GLN HE2x H 1 6.810 0.02 A 40 GLN HGy H 1 2.457 0.02 A 40 GLN HGx H 1 2.441 0.02 A 40 GLN CA C 13 55.371 0.20 A 40 GLN CB C 13 30.705 0.20 A 40 GLN CG C 13 34.075 0.20 A 40 GLN N N 15 120.503 0.12 A 40 GLN NE2 N 15 112.149 0.12 A 41 GLY H H 1 8.992 0.02 A 41 GLY HAx H 1 3.864 0.02 A 41 GLY HAy H 1 3.950 0.02 A 41 GLY CA C 13 47.145 0.20 A 41 GLY N N 15 113.842 0.12 A 42 CYS H H 1 7.787 0.02 A 42 CYS HA H 1 4.368 0.02 A 42 CYS HBy H 1 3.140 0.02 A 42 CYS HBx H 1 2.746 0.02 A 42 CYS CA C 13 57.093 0.20 A 42 CYS CB C 13 41.045 0.20 A 42 CYS N N 15 124.471 0.12 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 30 GLN H A 32 ASP H 1.0 . 5.50 2 2 A 32 ASP H A 30 GLN HA 1.0 . 5.50 3 3 A 32 ASP H A 31 VAL HB 1.0 . 5.31 4 4 A 32 ASP H A 32 ASP HBx 1.0 . 3.53 5 5 A 32 ASP H A 39 GLU HGy 1.0 . 4.76 6 6 A 32 ASP H A 30 GLN HBy 1.0 . 4.73 7 7 A 32 ASP H A 31 VAL HGy% 1.0 . 4.67 8 8 A 32 ASP H A 31 VAL H 1.0 . 5.50 9 9 A 30 GLN H A 31 VAL H 1.0 . 5.14 10 10 A 30 GLN HA A 31 VAL H 1.0 . 3.00 11 11 A 31 VAL HB A 31 VAL H 1.0 . 3.23 12 12 A 30 GLN HBy A 31 VAL H 1.0 . 4.06 13 13 A 31 VAL H A 30 GLN HBx 1.0 . 4.16 14 14 A 31 VAL H A 31 VAL HGx% 1.0 . 4.93 15 15 A 31 VAL HGy% A 31 VAL H 1.0 . 3.72 16 16 A 24 PHE HBy A 25 TRP HE1 1.0 . 5.50 17 17 A 25 TRP HE1 A 22 PRO HGy 1.0 . 5.26 18 18 A 25 TRP HE1 A 22 PRO HGx 1.0 . 4.45 19 19 A 25 TRP HE1 A 22 PRO HBx 1.0 . 4.81 20 20 A 25 TRP H A 26 ARG H 1.0 . 3.27 21 21 A 26 ARG H A 24 PHE HA 1.0 . 4.98 22 22 A 26 ARG H A 23 GLN HA 1.0 . 4.35 23 23 A 26 ARG H A 25 TRP HBx 1.0 . 4.57 24 24 A 26 ARG H A 26 ARG HDy 1.0 . 5.11 25 25 A 26 ARG H A 26 ARG HDx 1.0 . 5.50 26 26 A 26 ARG H A 26 ARG HBy 1.0 . 3.16 27 27 A 26 ARG H A 26 ARG HBx 1.0 . 3.13 28 28 A 26 ARG H A 21 ILE HD1% 1.0 . 5.50 29 29 A 26 ARG H A 12 PHE HE% 1.0 . 5.50 30 30 A 26 ARG H A 25 TRP HD1 1.0 . 5.50 31 31 A 24 PHE HBy A 26 ARG H 1.0 . 5.50 32 32 A 18 THR H A 19 LYS H 1.0 . 4.50 33 33 A 19 LYS H A 14 CYS HBx 1.0 . 5.17 34 34 A 19 LYS H A 19 LYS HBy 1.0 . 3.61 35 35 A 19 LYS H A 19 LYS HGx 1.0 . 4.12 36 35 A 19 LYS H A 19 LYS HGy 1.0 . 4.12 37 36 A 19 LYS H A 17 ILE HG2% 1.0 . 5.50 38 37 A 19 LYS H A 14 CYS HBy 1.0 . 5.50 39 38 A 41 GLY H A 42 CYS H 1.0 . 3.53 40 39 A 42 CYS H A 39 GLU H 1.0 . 5.50 41 40 A 42 CYS H A 40 GLN HA 1.0 . 4.13 42 41 A 42 CYS H A 42 CYS HBy 1.0 . 3.71 43 42 A 42 CYS H A 42 CYS HBx 1.0 . 3.07 44 43 A 42 CYS H A 40 GLN HBy 1.0 . 5.43 45 44 A 42 CYS H A 40 GLN H 1.0 . 5.50 46 45 A 21 ILE HD1% A 27 CYS H 1.0 . 5.50 47 46 A 27 CYS H A 38 ASP HBy 1.0 . 4.98 48 47 A 27 CYS H A 26 ARG HGx 1.0 . 4.62 49 48 A 26 ARG H A 27 CYS H 1.0 . 5.00 50 49 A 27 CYS H A 26 ARG HA 1.0 . 2.84 51 50 A 27 CYS H A 38 ASP HBx 1.0 . 3.85 52 51 A 26 ARG HDx A 27 CYS H 1.0 . 5.50 53 52 A 27 CYS H A 26 ARG HGy 1.0 . 4.01 54 53 A 12 PHE HE% A 27 CYS H 1.0 . 5.50 55 54 A 26 ARG HBy A 27 CYS H 1.0 . 4.39 56 55 A 5 VAL H A 5 VAL HB 1.0 . 3.59 57 56 A 5 VAL H A 5 VAL HGy% 1.0 . 4.03 58 57 A 5 VAL H A 18 THR HG2% 1.0 . 5.50 59 58 A 12 PHE H A 21 ILE H 1.0 . 3.65 60 59 A 12 PHE H A 23 GLN H 1.0 . 4.51 61 60 A 12 PHE H A 12 PHE HD% 1.0 . 4.16 62 61 A 12 PHE H A 11 TYR HD% 1.0 . 4.84 63 62 A 12 PHE H A 11 TYR HA 1.0 . 3.12 64 63 A 12 PHE H A 13 PRO HDy 1.0 . 5.50 65 64 A 12 PHE H A 12 PHE HBy 1.0 . 4.17 66 65 A 12 PHE H A 11 TYR HBx 1.0 . 3.49 67 66 A 12 PHE H A 21 ILE HG1x 1.0 . 4.44 68 67 A 21 ILE H A 20 CYS H 1.0 . 5.42 69 68 A 20 CYS H A 7 CYS HA 1.0 . 5.50 70 69 A 20 CYS H A 19 LYS HA 1.0 . 2.86 71 70 A 20 CYS H A 20 CYS HBy 1.0 . 3.31 72 71 A 20 CYS H A 19 LYS HGx 1.0 . 4.02 73 71 A 19 LYS HGy A 20 CYS H 1.0 . 4.02 74 72 A 23 GLN HA A 12 PHE H 1.0 . 5.16 75 73 A 12 PHE H A 21 ILE HG1y 1.0 . 4.68 76 74 A 19 LYS H A 20 CYS H 1.0 . 4.98 77 75 A 11 TYR HD% A 9 LEU H 1.0 . 5.50 78 76 A 9 LEU H A 8 SER HA 1.0 . 2.82 79 77 A 9 LEU H A 8 SER HBy 1.0 . 3.38 80 78 A 9 LEU H A 9 LEU HDx% 1.0 . 4.61 81 78 A 9 LEU H A 9 LEU HDy% 1.0 . 4.61 82 79 A 9 LEU H A 10 GLY H 1.0 . 4.49 83 80 A 9 LEU H A 8 SER HBx 1.0 . 3.50 84 81 A 9 LEU H A 9 LEU HG 1.0 . 2.82 85 82 A 6 THR HA A 7 CYS H 1.0 . 2.97 86 83 A 7 CYS H A 6 THR HB 1.0 . 3.81 87 84 A 7 CYS H A 7 CYS HBy 1.0 . 4.12 88 85 A 7 CYS H A 7 CYS HBx 1.0 . 3.42 89 86 A 7 CYS H A 6 THR HG2% 1.0 . 4.42 90 87 A 7 CYS HBx A 11 TYR H 1.0 . 5.50 91 88 A 11 TYR H A 23 GLN HGx 1.0 . 5.50 92 88 A 11 TYR H A 23 GLN HGy 1.0 . 5.50 93 89 A 11 TYR H A 9 LEU HBy 1.0 . 4.96 94 89 A 11 TYR H A 9 LEU HBx 1.0 . 4.96 95 90 A 11 TYR H A 9 LEU HDx% 1.0 . 5.50 96 90 A 9 LEU HDy% A 11 TYR H 1.0 . 5.50 97 91 A 12 PHE H A 11 TYR H 1.0 . 5.12 98 92 A 10 GLY H A 11 TYR H 1.0 . 3.28 99 93 A 11 TYR HD% A 11 TYR H 1.0 . 3.84 100 94 A 11 TYR H A 11 TYR HBy 1.0 . 3.29 101 95 A 11 TYR HBx A 11 TYR H 1.0 . 4.00 102 96 A 11 TYR H A 23 GLN HBy 1.0 . 5.28 103 97 A 27 CYS HBy A 28 ASP H 1.0 . 5.38 104 98 A 25 TRP H A 23 GLN H 1.0 . 5.50 105 99 A 23 GLN H A 11 TYR HA 1.0 . 3.29 106 100 A 23 GLN H A 22 PRO HA 1.0 . 2.82 107 101 A 23 GLN H A 11 TYR HBx 1.0 . 5.50 108 102 A 23 GLN H A 23 GLN HBy 1.0 . 2.94 109 103 A 23 GLN H A 22 PRO HBy 1.0 . 4.07 110 104 A 23 GLN H A 10 GLY HAx 1.0 . 5.50 111 105 A 28 ASP H A 25 TRP HA 1.0 . 5.50 112 106 A 30 GLN H A 28 ASP H 1.0 . 4.18 113 107 A 28 ASP H A 29 GLY HAx 1.0 . 4.56 114 108 A 28 ASP H A 29 GLY H 1.0 . 2.92 115 109 A 27 CYS H A 28 ASP H 1.0 . 3.65 116 110 A 28 ASP H A 27 CYS HA 1.0 . 3.38 117 111 A 26 ARG HA A 28 ASP H 1.0 . 4.76 118 112 A 28 ASP H A 28 ASP HBx 1.0 . 3.86 119 113 A 30 GLN HBx A 28 ASP H 1.0 . 5.50 120 114 A 23 GLN H A 24 PHE H 1.0 . 3.57 121 115 A 23 GLN H A 23 GLN HGx 1.0 . 3.60 122 115 A 23 GLN H A 23 GLN HGy 1.0 . 3.60 123 116 A 22 PRO HGy A 23 GLN H 1.0 . 5.23 124 117 A 23 GLN H A 11 TYR HD% 1.0 . 5.32 125 118 A 26 ARG HDy A 23 GLN H 1.0 . 5.50 126 119 A 22 PRO HBx A 23 GLN H 1.0 . 4.41 127 120 A 28 ASP H A 29 GLY HAy 1.0 . 5.43 128 121 A 40 GLN H A 37 SER HA 1.0 . 3.95 129 122 A 40 GLN H A 39 GLU HBy 1.0 . 4.88 130 123 A 40 GLN H A 40 GLN HGy 1.0 . 3.90 131 123 A 40 GLN H A 40 GLN HGx 1.0 . 3.90 132 124 A 40 GLN H A 40 GLN HBx 1.0 . 3.10 133 125 A 40 GLN H A 39 GLU HBx 1.0 . 4.48 134 126 A 41 GLY H A 40 GLN H 1.0 . 5.23 135 127 A 16 ASN H A 17 ILE H 1.0 . 4.04 136 128 A 17 ILE H A 15 GLY H 1.0 . 4.64 137 129 A 17 ILE H A 18 THR HA 1.0 . 5.39 138 130 A 17 ILE H A 15 GLY HAx 1.0 . 5.11 139 131 A 17 ILE H A 16 ASN HBx 1.0 . 3.62 140 131 A 17 ILE H A 16 ASN HBy 1.0 . 3.62 141 132 A 17 ILE H A 17 ILE HB 1.0 . 3.45 142 133 A 17 ILE H A 17 ILE HG1y 1.0 . 4.01 143 134 A 17 ILE H A 17 ILE HG1x 1.0 . 3.87 144 135 A 17 ILE H A 17 ILE HD1% 1.0 . 4.29 145 136 A 7 CYS H A 6 THR H 1.0 . 4.43 146 137 A 6 THR H A 5 VAL HA 1.0 . 2.86 147 138 A 6 THR HG2% A 6 THR H 1.0 . 4.51 148 139 A 6 THR H A 5 VAL HGx% 1.0 . 4.26 149 140 A 5 VAL HB A 6 THR H 1.0 . 4.18 150 141 A 25 TRP HE1 A 25 TRP H 1.0 . 5.50 151 142 A 25 TRP H A 26 ARG HA 1.0 . 5.50 152 143 A 25 TRP H A 24 PHE H 1.0 . 3.44 153 144 A 25 TRP H A 25 TRP HBy 1.0 . 3.74 154 145 A 25 TRP H A 26 ARG HBy 1.0 . 5.50 155 146 A 25 TRP H A 23 GLN HBy 1.0 . 5.50 156 147 A 25 TRP H A 26 ARG HBx 1.0 . 4.65 157 148 A 22 PRO HBx A 25 TRP H 1.0 . 3.92 158 149 A 25 TRP H A 25 TRP HD1 1.0 . 4.11 159 150 A 24 PHE HBy A 25 TRP H 1.0 . 4.80 160 151 A 25 TRP H A 21 ILE HD1% 1.0 . 4.99 161 152 A 22 PRO HGx A 25 TRP H 1.0 . 5.40 162 153 A 25 TRP H A 21 ILE HB 1.0 . 5.50 163 154 A 39 GLU HGy A 33 CYS H 1.0 . 5.50 164 155 A 31 VAL HB A 33 CYS H 1.0 . 5.35 165 156 A 32 ASP H A 33 CYS H 1.0 . 3.09 166 157 A 33 CYS H A 31 VAL HA 1.0 . 3.93 167 158 A 33 CYS H A 33 CYS HBx 1.0 . 3.12 168 158 A 33 CYS H A 33 CYS HBy 1.0 . 3.12 169 159 A 33 CYS H A 32 ASP HBy 1.0 . 4.52 170 160 A 32 ASP HBx A 33 CYS H 1.0 . 4.00 171 161 A 21 ILE HD1% A 33 CYS H 1.0 . 4.92 172 162 A 33 CYS H A 37 SER H 1.0 . 5.50 173 163 A 33 CYS H A 38 ASP H 1.0 . 4.78 174 164 A 30 GLN H A 28 ASP HA 1.0 . 5.50 175 165 A 30 GLN H A 28 ASP HBy 1.0 . 5.50 176 166 A 30 GLN H A 39 GLU HBy 1.0 . 5.50 177 167 A 30 GLN H A 39 GLU HGx 1.0 . 3.73 178 168 A 30 GLN H A 30 GLN HBx 1.0 . 3.12 179 169 A 30 GLN H A 29 GLY H 1.0 . 3.37 180 170 A 21 ILE H A 13 PRO HA 1.0 . 4.25 181 171 A 21 ILE H A 12 PHE HD% 1.0 . 5.50 182 172 A 30 GLN H A 39 GLU HGy 1.0 . 5.50 183 173 A 21 ILE H A 11 TYR HD% 1.0 . 4.85 184 174 A 21 ILE H A 20 CYS HA 1.0 . 2.96 185 175 A 21 ILE H A 21 ILE HG1x 1.0 . 3.15 186 176 A 21 ILE H A 20 CYS HBy 1.0 . 4.23 187 177 A 21 ILE H A 20 CYS HBx 1.0 . 4.13 188 178 A 21 ILE H A 11 TYR HBx 1.0 . 4.49 189 179 A 21 ILE H A 21 ILE HG1y 1.0 . 3.79 190 180 A 7 CYS HA A 8 SER H 1.0 . 2.97 191 181 A 8 SER HBx A 8 SER H 1.0 . 3.47 192 182 A 11 TYR HBy A 8 SER H 1.0 . 4.05 193 183 A 7 CYS HBy A 8 SER H 1.0 . 3.48 194 184 A 7 CYS HBx A 8 SER H 1.0 . 4.14 195 185 A 11 TYR HBx A 8 SER H 1.0 . 4.79 196 186 A 8 SER HBy A 8 SER H 1.0 . 3.89 197 187 A 20 CYS HBy A 8 SER H 1.0 . 5.50 198 188 A 8 SER H A 11 TYR HE% 1.0 . 5.50 199 189 A 14 CYS H A 19 LYS HGx 1.0 . 5.50 200 189 A 19 LYS HGy A 14 CYS H 1.0 . 5.50 201 190 A 19 LYS HA A 14 CYS H 1.0 . 5.50 202 191 A 21 ILE H A 14 CYS H 1.0 . 5.50 203 192 A 19 LYS H A 14 CYS H 1.0 . 4.01 204 193 A 12 PHE HD% A 14 CYS H 1.0 . 5.50 205 194 A 20 CYS HA A 14 CYS H 1.0 . 4.68 206 195 A 18 THR HA A 14 CYS H 1.0 . 5.22 207 196 A 14 CYS HBy A 14 CYS H 1.0 . 4.07 208 197 A 14 CYS HBx A 14 CYS H 1.0 . 3.58 209 198 A 14 CYS H A 13 PRO HBx 1.0 . 4.35 210 199 A 14 CYS H A 13 PRO HBy 1.0 . 4.31 211 200 A 14 CYS H A 21 ILE HG2% 1.0 . 5.50 212 201 A 18 THR H A 17 ILE HG1y 1.0 . 5.09 213 202 A 13 PRO HDy A 14 CYS H 1.0 . 5.50 214 203 A 18 THR H A 17 ILE HA 1.0 . 3.39 215 204 A 18 THR H A 17 ILE HB 1.0 . 3.91 216 205 A 18 THR H A 19 LYS HBy 1.0 . 5.50 217 206 A 18 THR H A 18 THR HG2% 1.0 . 4.15 218 207 A 18 THR H A 17 ILE HG2% 1.0 . 4.26 219 208 A 18 THR H A 16 ASN HBx 1.0 . 5.50 220 208 A 18 THR H A 16 ASN HBy 1.0 . 5.50 221 209 A 37 SER H A 38 ASP H 1.0 . 3.64 222 210 A 39 GLU H A 38 ASP H 1.0 . 3.21 223 211 A 40 GLN H A 38 ASP H 1.0 . 4.53 224 212 A 38 ASP H A 33 CYS HBx 1.0 . 3.04 225 212 A 33 CYS HBy A 38 ASP H 1.0 . 3.04 226 213 A 38 ASP HBx A 38 ASP H 1.0 . 4.00 227 214 A 39 GLU HGy A 38 ASP H 1.0 . 5.50 228 215 A 39 GLU HBx A 38 ASP H 1.0 . 5.41 229 216 A 31 VAL HGx% A 38 ASP H 1.0 . 5.39 230 217 A 21 ILE HD1% A 38 ASP H 1.0 . 5.17 231 218 A 38 ASP H A 40 GLN HGy 1.0 . 5.50 232 218 A 40 GLN HGx A 38 ASP H 1.0 . 5.50 233 219 A 39 GLU H A 38 ASP HBx 1.0 . 5.50 234 220 A 39 GLU H A 40 GLN HGy 1.0 . 5.11 235 220 A 39 GLU H A 40 GLN HGx 1.0 . 5.11 236 221 A 39 GLU H A 40 GLN H 1.0 . 3.11 237 222 A 39 GLU H A 38 ASP HBy 1.0 . 5.34 238 223 A 39 GLU H A 39 GLU HBy 1.0 . 3.93 239 224 A 39 GLU HGy A 39 GLU H 1.0 . 3.84 240 225 A 39 GLU H A 39 GLU HGx 1.0 . 4.27 241 226 A 39 GLU H A 39 GLU HBx 1.0 . 3.33 242 227 A 31 VAL HGx% A 39 GLU H 1.0 . 5.50 243 228 A 31 VAL HGx% A 37 SER H 1.0 . 5.50 244 229 A 37 SER H A 36 GLY H 1.0 . 3.59 245 230 A 37 SER H A 37 SER HBx 1.0 . 2.99 246 231 A 37 SER H A 35 ASN HBy 1.0 . 5.06 247 232 A 37 SER H A 33 CYS HBx 1.0 . 3.39 248 232 A 33 CYS HBy A 37 SER H 1.0 . 3.39 249 233 A 37 SER H A 35 ASN HBx 1.0 . 5.50 250 234 A 37 SER H A 40 GLN HGy 1.0 . 5.50 251 234 A 40 GLN HGx A 37 SER H 1.0 . 5.50 252 235 A 37 SER H A 35 ASN HA 1.0 . 4.68 253 236 A 40 GLN HBx A 37 SER H 1.0 . 5.50 254 237 A 35 ASN H A 35 ASN HD2x 1.0 . 5.50 255 238 A 15 GLY HAx A 35 ASN H 1.0 . 4.77 256 239 A 35 ASN H A 33 CYS HBx 1.0 . 3.81 257 239 A 33 CYS HBy A 35 ASN H 1.0 . 3.81 258 240 A 35 ASN HBx A 35 ASN H 1.0 . 3.76 259 241 A 17 ILE HD1% A 35 ASN H 1.0 . 5.50 260 242 A 31 VAL HGx% A 35 ASN H 1.0 . 5.50 261 243 A 16 ASN HA A 16 ASN HD2x 1.0 . 5.50 262 244 A 41 GLY H A 40 GLN HGy 1.0 . 5.50 263 244 A 41 GLY H A 40 GLN HGx 1.0 . 5.50 264 245 A 16 ASN HD2y A 35 ASN HD2y 1.0 . 4.61 265 246 A 35 ASN HA A 16 ASN HD2y 1.0 . 4.33 266 247 A 16 ASN HA A 16 ASN HD2y 1.0 . 5.50 267 248 A 16 ASN H A 16 ASN HD2y 1.0 . 5.50 268 249 A 16 ASN HD2y A 16 ASN HBx 1.0 . 3.48 269 249 A 16 ASN HBy A 16 ASN HD2y 1.0 . 3.48 270 250 A 16 ASN HD2x A 35 ASN HD2y 1.0 . 5.17 271 251 A 17 ILE HD1% A 16 ASN HD2x 1.0 . 5.50 272 252 A 35 ASN HA A 16 ASN HD2x 1.0 . 4.85 273 253 A 16 ASN HD2x A 16 ASN HBx 1.0 . 4.02 274 253 A 16 ASN HBy A 16 ASN HD2x 1.0 . 4.02 275 254 A 41 GLY H A 40 GLN HA 1.0 . 3.36 276 255 A 41 GLY H A 40 GLN HBy 1.0 . 4.96 277 256 A 35 ASN HBy A 16 ASN HD2y 1.0 . 5.50 278 257 A 35 ASN HD2x A 16 ASN HD2x 1.0 . 5.50 279 258 A 35 ASN HBy A 16 ASN HD2x 1.0 . 5.50 280 259 A 22 PRO HGy A 24 PHE H 1.0 . 5.50 281 260 A 17 ILE HB A 35 ASN HD2y 1.0 . 5.50 282 261 A 16 ASN H A 35 ASN HD2y 1.0 . 5.50 283 262 A 26 ARG H A 24 PHE H 1.0 . 5.28 284 263 A 12 PHE HE% A 24 PHE H 1.0 . 4.92 285 264 A 24 PHE HBy A 24 PHE H 1.0 . 3.48 286 265 A 24 PHE H A 24 PHE HBx 1.0 . 3.34 287 266 A 23 GLN HBy A 24 PHE H 1.0 . 3.55 288 267 A 22 PRO HBy A 24 PHE H 1.0 . 4.18 289 268 A 22 PRO HGx A 24 PHE H 1.0 . 5.50 290 269 A 22 PRO HBx A 24 PHE H 1.0 . 3.87 291 270 A 35 ASN HA A 35 ASN HD2y 1.0 . 4.23 292 271 A 35 ASN HD2y A 15 GLY HAy 1.0 . 5.29 293 272 A 35 ASN HBy A 35 ASN HD2y 1.0 . 3.53 294 273 A 35 ASN HBx A 35 ASN HD2y 1.0 . 3.48 295 274 A 17 ILE HG1y A 35 ASN HD2y 1.0 . 5.50 296 275 A 17 ILE HG1x A 35 ASN HD2x 1.0 . 5.50 297 276 A 35 ASN HD2x A 16 ASN HD2y 1.0 . 5.50 298 277 A 35 ASN HD2x A 15 GLY HAy 1.0 . 4.80 299 278 A 15 GLY HAx A 35 ASN HD2x 1.0 . 5.14 300 279 A 17 ILE HD1% A 35 ASN HD2x 1.0 . 5.50 301 280 A 17 ILE HG1y A 35 ASN HD2x 1.0 . 5.50 302 281 A 11 TYR HA A 24 PHE H 1.0 . 5.50 303 282 A 25 TRP HD1 A 24 PHE H 1.0 . 5.50 304 283 A 11 TYR HA A 10 GLY H 1.0 . 5.50 305 284 A 10 GLY H A 10 GLY HAy 1.0 . 2.83 306 285 A 10 GLY H A 9 LEU HBy 1.0 . 3.91 307 285 A 10 GLY H A 9 LEU HBx 1.0 . 3.91 308 286 A 10 GLY H A 9 LEU HDx% 1.0 . 4.60 309 286 A 9 LEU HDy% A 10 GLY H 1.0 . 4.60 310 287 A 30 GLN HE2y A 30 GLN HGx 1.0 . 4.04 311 287 A 30 GLN HGy A 30 GLN HE2y 1.0 . 4.04 312 288 A 30 GLN HBx A 30 GLN HE2y 1.0 . 4.94 313 289 A 30 GLN HBx A 30 GLN HE2x 1.0 . 5.50 314 290 A 37 SER HA A 40 GLN HE2x 1.0 . 5.50 315 291 A 37 SER HA A 40 GLN HE2y 1.0 . 5.50 316 292 A 40 GLN HBx A 40 GLN HE2y 1.0 . 5.50 317 293 A 29 GLY H A 28 ASP HBx 1.0 . 4.98 318 294 A 30 GLN HBx A 29 GLY H 1.0 . 5.50 319 295 A 39 GLU HGy A 29 GLY H 1.0 . 5.50 320 296 A 27 CYS H A 29 GLY H 1.0 . 5.50 321 297 A 29 GLY H A 39 GLU HGx 1.0 . 5.09 322 298 A 26 ARG HBy A 23 GLN HE2y 1.0 . 5.50 323 299 A 12 PHE HE% A 23 GLN HE2y 1.0 . 5.08 324 300 A 10 GLY HAx A 23 GLN HE2y 1.0 . 5.50 325 301 A 12 PHE HBx A 23 GLN HE2x 1.0 . 5.50 326 302 A 23 GLN HE2y A 23 GLN HGx 1.0 . 3.81 327 302 A 23 GLN HGy A 23 GLN HE2y 1.0 . 3.81 328 303 A 26 ARG HBx A 23 GLN HE2y 1.0 . 5.50 329 304 A 23 GLN H A 23 GLN HE2x 1.0 . 5.50 330 305 A 12 PHE HE% A 23 GLN HE2x 1.0 . 5.50 331 306 A 12 PHE HBy A 23 GLN HE2x 1.0 . 5.50 332 307 A 23 GLN HBy A 23 GLN HE2y 1.0 . 5.50 333 308 A 12 PHE H A 23 GLN HE2x 1.0 . 5.50 334 309 A 18 THR HG2% A 15 GLY H 1.0 . 5.50 335 310 A 16 ASN H A 15 GLY H 1.0 . 5.15 336 311 A 15 GLY H A 14 CYS H 1.0 . 4.58 337 312 A 15 GLY H A 35 ASN HD2y 1.0 . 5.11 338 313 A 14 CYS HBy A 15 GLY H 1.0 . 4.08 339 314 A 14 CYS HBx A 15 GLY H 1.0 . 3.76 340 315 A 15 GLY H A 17 ILE HB 1.0 . 5.50 341 316 A 15 GLY H A 35 ASN HD2x 1.0 . 4.55 342 317 A 15 GLY H A 18 THR HA 1.0 . 5.50 343 318 A 15 GLY H A 33 CYS HBx 1.0 . 5.15 344 318 A 15 GLY H A 33 CYS HBy 1.0 . 5.15 345 319 A 15 GLY H A 13 PRO HBy 1.0 . 4.50 346 320 A 36 GLY H A 35 ASN H 1.0 . 3.20 347 321 A 36 GLY H A 33 CYS HBx 1.0 . 3.67 348 321 A 33 CYS HBy A 36 GLY H 1.0 . 3.67 349 322 A 36 GLY H A 35 ASN HBx 1.0 . 5.04 350 323 A 31 VAL HGx% A 36 GLY H 1.0 . 3.95 351 324 A 38 ASP H A 36 GLY H 1.0 . 5.50 352 325 A 40 GLN HA A 41 GLY HAx 1.0 . 5.14 353 326 A 39 GLU H A 36 GLY HAx 1.0 . 5.36 354 327 A 36 GLY HAx A 33 CYS HBx 1.0 . 5.03 355 327 A 33 CYS HBy A 36 GLY HAx 1.0 . 5.03 356 328 A 31 VAL HGy% A 36 GLY HAx 1.0 . 4.69 357 329 A 38 ASP H A 36 GLY HAx 1.0 . 5.22 358 330 A 11 TYR HD% A 10 GLY HAy 1.0 . 5.04 359 331 A 23 GLN HBy A 10 GLY HAy 1.0 . 5.16 360 332 A 9 LEU HBx A 10 GLY HAx 1.0 . 5.50 361 333 A 32 ASP H A 32 ASP HBy 1.0 . 3.98 362 334 A 25 TRP HBx A 32 ASP HBy 1.0 . 4.91 363 335 A 32 ASP HBx A 25 TRP HBx 1.0 . 4.83 364 336 A 18 THR HA A 15 GLY HAy 1.0 . 4.64 365 337 A 17 ILE H A 15 GLY HAy 1.0 . 5.50 366 338 A 15 GLY HAx A 35 ASN HD2y 1.0 . 5.12 367 339 A 23 GLN HBy A 10 GLY HAx 1.0 . 4.66 368 340 A 32 ASP HBx A 21 ILE HD1% 1.0 . 3.95 369 341 A 9 LEU HBx A 10 GLY HAy 1.0 . 5.46 370 342 A 11 TYR HD% A 10 GLY HAx 1.0 . 5.50 371 343 A 11 TYR HD% A 20 CYS HBy 1.0 . 4.72 372 344 A 20 CYS HBy A 7 CYS HBy 1.0 . 4.27 373 345 A 11 TYR HBx A 20 CYS HBy 1.0 . 3.83 374 346 A 12 PHE H A 20 CYS HBx 1.0 . 5.50 375 347 A 11 TYR HD% A 20 CYS HBx 1.0 . 4.35 376 348 A 11 TYR HBy A 20 CYS HBx 1.0 . 4.14 377 349 A 7 CYS HBy A 20 CYS HBx 1.0 . 3.89 378 350 A 20 CYS HBx A 21 ILE HG2% 1.0 . 5.50 379 351 A 20 CYS H A 20 CYS HBx 1.0 . 3.91 380 352 A 26 ARG HDy A 27 CYS H 1.0 . 5.35 381 353 A 26 ARG HDy A 26 ARG HA 1.0 . 4.24 382 354 A 26 ARG HDy A 26 ARG HBx 1.0 . 3.77 383 355 A 26 ARG HDx A 26 ARG HA 1.0 . 4.89 384 356 A 38 ASP HA A 33 CYS HBx 1.0 . 5.06 385 356 A 33 CYS HBy A 38 ASP HA 1.0 . 5.06 386 357 A 32 ASP H A 33 CYS HBx 1.0 . 5.50 387 357 A 32 ASP H A 33 CYS HBy 1.0 . 5.50 388 358 A 39 GLU H A 33 CYS HBx 1.0 . 5.38 389 358 A 39 GLU H A 33 CYS HBy 1.0 . 5.38 390 359 A 14 CYS HBy A 33 CYS HBx 1.0 . 3.67 391 359 A 14 CYS HBy A 33 CYS HBy 1.0 . 3.67 392 360 A 21 ILE HD1% A 33 CYS HBx 1.0 . 5.03 393 360 A 21 ILE HD1% A 33 CYS HBy 1.0 . 5.03 394 361 A 21 ILE HG2% A 19 LYS HEy 1.0 . 5.10 395 362 A 14 CYS HBx A 18 THR HA 1.0 . 5.32 396 363 A 14 CYS HBy A 19 LYS HBx 1.0 . 5.03 397 364 A 14 CYS HBx A 33 CYS HBx 1.0 . 4.03 398 364 A 14 CYS HBx A 33 CYS HBy 1.0 . 4.03 399 365 A 21 ILE HD1% A 14 CYS HBy 1.0 . 5.12 400 366 A 10 GLY H A 9 LEU HBy 1.0 . 4.93 401 367 A 9 LEU HDy% A 9 LEU HBy 1.0 . 4.04 402 368 A 9 LEU HBx A 9 LEU HDx% 1.0 . 4.08 403 369 A 29 GLY H A 28 ASP HBy 1.0 . 5.37 404 370 A 25 TRP HA A 28 ASP HBy 1.0 . 4.73 405 371 A 9 LEU H A 9 LEU HBy 1.0 . 3.49 406 372 A 10 GLY H A 9 LEU HBx 1.0 . 5.20 407 373 A 9 LEU H A 9 LEU HBx 1.0 . 3.55 408 374 A 12 PHE H A 11 TYR HBy 1.0 . 4.39 409 375 A 21 ILE H A 11 TYR HBy 1.0 . 5.08 410 376 A 10 GLY H A 11 TYR HBy 1.0 . 5.20 411 377 A 7 CYS HBy A 11 TYR HBy 1.0 . 3.29 412 378 A 12 PHE HBy A 23 GLN HE2y 1.0 . 4.87 413 379 A 13 PRO HDy A 12 PHE HBy 1.0 . 4.46 414 380 A 21 ILE H A 12 PHE HBy 1.0 . 5.41 415 381 A 21 ILE H A 12 PHE HBx 1.0 . 5.23 416 382 A 23 GLN HE2y A 12 PHE HBx 1.0 . 4.99 417 383 A 13 PRO HDy A 12 PHE HBx 1.0 . 4.57 418 384 A 12 PHE HBx A 13 PRO HDx 1.0 . 4.20 419 385 A 11 TYR HBx A 7 CYS HBy 1.0 . 3.57 420 386 A 11 TYR HBx A 20 CYS HBx 1.0 . 3.48 421 387 A 7 CYS HA A 11 TYR HBy 1.0 . 5.50 422 388 A 12 PHE H A 12 PHE HBx 1.0 . 4.08 423 389 A 38 ASP HBy A 12 PHE HZ 1.0 . 4.59 424 390 A 12 PHE HE% A 38 ASP HBy 1.0 . 4.36 425 391 A 42 CYS HBy A 27 CYS HA 1.0 . 4.50 426 392 A 38 ASP HBx A 12 PHE HZ 1.0 . 4.88 427 393 A 12 PHE HE% A 38 ASP HBx 1.0 . 4.44 428 394 A 26 ARG HGx A 38 ASP HBx 1.0 . 5.50 429 395 A 7 CYS HBx A 11 TYR HBy 1.0 . 3.76 430 396 A 38 ASP HBy A 38 ASP H 1.0 . 3.92 431 397 A 21 ILE HD1% A 38 ASP HBy 1.0 . 4.07 432 398 A 38 ASP HBy A 33 CYS H 1.0 . 5.50 433 399 A 42 CYS HBy A 27 CYS HBy 1.0 . 3.57 434 400 A 11 TYR HD% A 7 CYS HBy 1.0 . 5.43 435 401 A 42 CYS HBx A 27 CYS HBy 1.0 . 3.99 436 402 A 35 ASN H A 34 ASP HBy 1.0 . 5.49 437 403 A 17 ILE HB A 34 ASP HBy 1.0 . 5.50 438 404 A 21 ILE HB A 25 TRP HZ3 1.0 . 3.87 439 405 A 25 TRP HBx A 21 ILE HB 1.0 . 4.94 440 406 A 17 ILE H A 16 ASN HBx 1.0 . 4.33 441 407 A 17 ILE H A 16 ASN HBy 1.0 . 4.54 442 408 A 35 ASN HBy A 35 ASN H 1.0 . 3.67 443 409 A 25 TRP HE1 A 24 PHE HBx 1.0 . 5.50 444 410 A 25 TRP HD1 A 24 PHE HBx 1.0 . 5.42 445 411 A 14 CYS HBy A 17 ILE HB 1.0 . 5.47 446 412 A 30 GLN HA A 39 GLU HGx 1.0 . 5.50 447 413 A 29 GLY HAx A 39 GLU HGx 1.0 . 5.46 448 414 A 42 CYS HBx A 27 CYS HBx 1.0 . 5.26 449 415 A 26 ARG HGy A 27 CYS HBy 1.0 . 5.50 450 416 A 26 ARG HGy A 27 CYS HBx 1.0 . 4.83 451 417 A 14 CYS HBx A 19 LYS HBy 1.0 . 4.48 452 418 A 19 LYS HBy A 14 CYS HBy 1.0 . 5.50 453 419 A 19 LYS HBy A 17 ILE HG2% 1.0 . 5.12 454 420 A 14 CYS HBx A 19 LYS HBx 1.0 . 4.65 455 421 A 20 CYS H A 19 LYS HBx 1.0 . 4.47 456 422 A 19 LYS H A 19 LYS HBx 1.0 . 4.19 457 423 A 17 ILE HG2% A 19 LYS HBx 1.0 . 5.17 458 424 A 31 VAL H A 30 GLN HGx 1.0 . 4.81 459 424 A 31 VAL H A 30 GLN HGy 1.0 . 4.81 460 425 A 30 GLN H A 30 GLN HGx 1.0 . 4.21 461 425 A 30 GLN H A 30 GLN HGy 1.0 . 4.21 462 426 A 30 GLN HBx A 30 GLN HGx 1.0 . 2.43 463 426 A 30 GLN HBx A 30 GLN HGy 1.0 . 2.43 464 427 A 5 VAL HB A 18 THR HB 1.0 . 5.47 465 428 A 5 VAL HB A 18 THR HG2% 1.0 . 5.39 466 429 A 10 GLY HAy A 23 GLN HGx 1.0 . 5.50 467 429 A 23 GLN HGy A 10 GLY HAy 1.0 . 5.50 468 430 A 10 GLY HAx A 23 GLN HGx 1.0 . 4.62 469 430 A 23 GLN HGy A 10 GLY HAx 1.0 . 4.62 470 431 A 12 PHE H A 23 GLN HGx 1.0 . 5.50 471 431 A 12 PHE H A 23 GLN HGy 1.0 . 5.50 472 432 A 12 PHE HD% A 23 GLN HGx 1.0 . 5.50 473 432 A 12 PHE HD% A 23 GLN HGy 1.0 . 5.50 474 433 A 11 TYR HA A 23 GLN HGx 1.0 . 5.05 475 433 A 11 TYR HA A 23 GLN HGy 1.0 . 5.05 476 434 A 26 ARG HDx A 23 GLN HGx 1.0 . 4.74 477 434 A 26 ARG HDx A 23 GLN HGy 1.0 . 4.74 478 435 A 26 ARG HBy A 23 GLN HGx 1.0 . 3.83 479 435 A 26 ARG HBy A 23 GLN HGy 1.0 . 3.83 480 436 A 23 GLN HBy A 23 GLN HGx 1.0 . 2.97 481 436 A 23 GLN HGy A 23 GLN HBy 1.0 . 2.97 482 437 A 26 ARG H A 23 GLN HGx 1.0 . 5.50 483 437 A 26 ARG H A 23 GLN HGy 1.0 . 5.50 484 438 A 13 PRO HBx A 12 PHE HA 1.0 . 5.21 485 439 A 5 VAL HGy% A 13 PRO HBx 1.0 . 5.50 486 440 A 19 LYS H A 13 PRO HBy 1.0 . 5.50 487 441 A 22 PRO HBy A 24 PHE HBx 1.0 . 5.49 488 442 A 22 PRO HBx A 24 PHE HBx 1.0 . 5.26 489 443 A 25 TRP H A 22 PRO HBy 1.0 . 5.28 490 444 A 22 PRO HBy A 11 TYR HE% 1.0 . 5.13 491 445 A 22 PRO HBx A 25 TRP HD1 1.0 . 5.11 492 446 A 6 THR HB A 6 THR H 1.0 . 4.15 493 447 A 7 CYS HA A 6 THR HB 1.0 . 4.09 494 448 A 41 GLY H A 40 GLN HBx 1.0 . 5.35 495 449 A 40 GLN HBy A 40 GLN H 1.0 . 3.68 496 450 A 40 GLN HBy A 37 SER HA 1.0 . 3.99 497 451 A 26 ARG HBy A 27 CYS HBx 1.0 . 5.28 498 452 A 26 ARG HBy A 12 PHE HZ 1.0 . 5.50 499 453 A 26 ARG HBx A 27 CYS H 1.0 . 5.28 500 454 A 21 ILE HG2% A 19 LYS HDx 1.0 . 5.50 501 454 A 21 ILE HG2% A 19 LYS HDy 1.0 . 5.50 502 455 A 17 ILE HG2% A 19 LYS HDx 1.0 . 5.50 503 455 A 17 ILE HG2% A 19 LYS HDy 1.0 . 5.50 504 456 A 39 GLU HBx A 31 VAL HA 1.0 . 5.02 505 457 A 17 ILE HB A 19 LYS HDx 1.0 . 5.50 506 457 A 17 ILE HB A 19 LYS HDy 1.0 . 5.50 507 458 A 5 VAL HGy% A 18 THR HB 1.0 . 5.46 508 459 A 5 VAL HA A 18 THR HB 1.0 . 5.50 509 460 A 19 LYS H A 18 THR HB 1.0 . 4.74 510 461 A 21 ILE HG1y A 25 TRP HBy 1.0 . 5.29 511 462 A 25 TRP HBy A 32 ASP HBy 1.0 . 5.17 512 463 A 25 TRP HBy A 21 ILE HB 1.0 . 4.65 513 464 A 25 TRP H A 25 TRP HBx 1.0 . 3.73 514 465 A 25 TRP HBx A 21 ILE HD1% 1.0 . 3.97 515 466 A 24 PHE H A 23 GLN HBx 1.0 . 4.43 516 467 A 26 ARG HGx A 12 PHE HZ 1.0 . 5.50 517 468 A 23 GLN H A 23 GLN HBx 1.0 . 3.56 518 469 A 26 ARG H A 26 ARG HGy 1.0 . 4.72 519 470 A 26 ARG HGy A 12 PHE HZ 1.0 . 5.50 520 471 A 26 ARG H A 26 ARG HGx 1.0 . 5.15 521 472 A 23 GLN HA A 26 ARG HGy 1.0 . 5.32 522 473 A 26 ARG HGy A 12 PHE HD% 1.0 . 5.31 523 474 A 16 ASN HBy A 17 ILE HG1y 1.0 . 5.48 524 475 A 16 ASN HBy A 17 ILE HG1x 1.0 . 5.50 525 476 A 22 PRO HGx A 25 TRP HH2 1.0 . 5.50 526 477 A 22 PRO HGy A 11 TYR HE% 1.0 . 5.22 527 478 A 22 PRO HGx A 21 ILE HA 1.0 . 5.50 528 479 A 22 PRO HGy A 21 ILE HA 1.0 . 5.19 529 480 A 12 PHE HA A 13 PRO HGx 1.0 . 5.25 530 481 A 39 GLU H A 31 VAL HA 1.0 . 5.27 531 482 A 39 GLU HBy A 31 VAL HA 1.0 . 5.50 532 483 A 19 LYS HEx A 19 LYS HGx 1.0 . 4.23 533 483 A 19 LYS HGy A 19 LYS HEx 1.0 . 4.23 534 484 A 31 VAL HA A 32 ASP HA 1.0 . 4.93 535 485 A 39 GLU HGy A 31 VAL HA 1.0 . 3.55 536 486 A 31 VAL HA A 39 GLU HGx 1.0 . 3.65 537 487 A 31 VAL HGx% A 31 VAL HA 1.0 . 3.64 538 488 A 21 ILE HG2% A 19 LYS HGx 1.0 . 4.42 539 488 A 19 LYS HGy A 21 ILE HG2% 1.0 . 4.42 540 489 A 21 ILE HG1y A 12 PHE HZ 1.0 . 5.27 541 490 A 12 PHE HD% A 21 ILE HG1y 1.0 . 4.78 542 491 A 21 ILE HG1y A 20 CYS HA 1.0 . 5.50 543 492 A 21 ILE HG1y A 22 PRO HDx 1.0 . 5.50 544 493 A 9 LEU HDy% A 10 GLY H 1.0 . 4.33 545 494 A 9 LEU H A 9 LEU HDy% 1.0 . 4.96 546 495 A 9 LEU HA A 9 LEU HDx% 1.0 . 4.13 547 496 A 8 SER HBy A 9 LEU HG 1.0 . 5.03 548 497 A 8 SER HBx A 9 LEU HG 1.0 . 5.33 549 498 A 11 TYR HD% A 8 SER HBy 1.0 . 4.80 550 499 A 11 TYR HD% A 8 SER HBx 1.0 . 4.49 551 500 A 18 THR HG2% A 18 THR HA 1.0 . 3.61 552 501 A 19 LYS H A 18 THR HA 1.0 . 3.02 553 502 A 18 THR HA A 13 PRO HBx 1.0 . 5.25 554 503 A 31 VAL HGx% A 39 GLU HBx 1.0 . 5.15 555 504 A 32 ASP H A 31 VAL HGx% 1.0 . 4.20 556 505 A 31 VAL HGx% A 36 GLY HAx 1.0 . 3.07 557 506 A 31 VAL HGx% A 33 CYS HBx 1.0 . 4.76 558 506 A 31 VAL HGx% A 33 CYS HBy 1.0 . 4.76 559 507 A 31 VAL HGx% A 39 GLU HGx 1.0 . 4.97 560 508 A 37 SER HBy A 33 CYS HBx 1.0 . 5.50 561 508 A 33 CYS HBy A 37 SER HBy 1.0 . 5.50 562 509 A 31 VAL HGx% A 36 GLY HAy 1.0 . 3.90 563 510 A 39 GLU HGy A 31 VAL HGx% 1.0 . 4.77 564 511 A 38 ASP H A 37 SER HBy 1.0 . 4.95 565 512 A 38 ASP H A 37 SER HBx 1.0 . 5.08 566 513 A 37 SER H A 37 SER HBy 1.0 . 3.93 567 514 A 37 SER HBx A 35 ASN HD2x 1.0 . 5.42 568 515 A 22 PRO HA A 24 PHE H 1.0 . 4.95 569 516 A 23 GLN HA A 22 PRO HA 1.0 . 5.07 570 517 A 12 PHE H A 22 PRO HA 1.0 . 4.88 571 518 A 11 TYR HD% A 22 PRO HA 1.0 . 4.80 572 519 A 11 TYR HA A 22 PRO HA 1.0 . 3.26 573 520 A 11 TYR HBx A 22 PRO HA 1.0 . 5.25 574 521 A 22 PRO HA A 23 GLN HGx 1.0 . 5.50 575 521 A 23 GLN HGy A 22 PRO HA 1.0 . 5.50 576 522 A 23 GLN HBy A 22 PRO HA 1.0 . 5.45 577 523 A 18 THR HG2% A 14 CYS H 1.0 . 4.70 578 524 A 18 THR HG2% A 13 PRO HA 1.0 . 4.77 579 525 A 18 THR HG2% A 19 LYS HA 1.0 . 5.50 580 526 A 18 THR HG2% A 5 VAL HA 1.0 . 5.50 581 527 A 18 THR HG2% A 13 PRO HBx 1.0 . 3.88 582 528 A 18 THR HG2% A 13 PRO HBy 1.0 . 3.96 583 529 A 19 LYS H A 18 THR HG2% 1.0 . 4.40 584 530 A 5 VAL HGy% A 18 THR HG2% 1.0 . 4.16 585 531 A 6 THR HG2% A 5 VAL HA 1.0 . 5.50 586 532 A 5 VAL HA A 5 VAL HGx% 1.0 . 3.66 587 533 A 39 GLU H A 37 SER HA 1.0 . 4.60 588 534 A 37 SER HA A 40 GLN HGy 1.0 . 3.72 589 534 A 37 SER HA A 40 GLN HGx 1.0 . 3.72 590 535 A 37 SER HA A 40 GLN HBx 1.0 . 3.41 591 536 A 30 GLN H A 31 VAL HGy% 1.0 . 5.04 592 537 A 13 PRO HA A 14 CYS H 1.0 . 2.89 593 538 A 13 PRO HA A 20 CYS HA 1.0 . 3.19 594 539 A 30 GLN HA A 31 VAL HGy% 1.0 . 4.90 595 540 A 31 VAL HGy% A 36 GLY HAy 1.0 . 4.98 596 541 A 31 VAL HGy% A 31 VAL HA 1.0 . 3.35 597 542 A 31 VAL HGy% A 39 GLU HBy 1.0 . 4.60 598 543 A 39 GLU HGy A 31 VAL HGy% 1.0 . 4.08 599 544 A 31 VAL HGy% A 39 GLU HGx 1.0 . 3.73 600 545 A 31 VAL HGy% A 39 GLU HBx 1.0 . 3.88 601 546 A 5 VAL HB A 6 THR HA 1.0 . 4.82 602 547 A 5 VAL HGy% A 6 THR HA 1.0 . 5.40 603 548 A 5 VAL HGy% A 6 THR HG2% 1.0 . 4.81 604 549 A 6 THR HA A 6 THR HG2% 1.0 . 3.56 605 550 A 18 THR HG2% A 5 VAL HGx% 1.0 . 4.44 606 551 A 5 VAL H A 5 VAL HGx% 1.0 . 4.39 607 552 A 5 VAL HGx% A 18 THR HB 1.0 . 5.05 608 553 A 16 ASN HBy A 17 ILE HA 1.0 . 5.50 609 554 A 17 ILE HG1x A 17 ILE HA 1.0 . 3.90 610 555 A 17 ILE HG1y A 17 ILE HA 1.0 . 4.24 611 556 A 5 VAL HGy% A 5 VAL HA 1.0 . 3.93 612 557 A 23 GLN HA A 26 ARG HDy 1.0 . 4.46 613 558 A 23 GLN HA A 23 GLN HBy 1.0 . 3.02 614 559 A 23 GLN HA A 26 ARG HBx 1.0 . 4.29 615 560 A 25 TRP H A 23 GLN HA 1.0 . 4.75 616 561 A 23 GLN HA A 23 GLN HE2y 1.0 . 3.66 617 562 A 23 GLN HA A 12 PHE HD% 1.0 . 3.44 618 563 A 23 GLN HA A 11 TYR HA 1.0 . 5.49 619 564 A 23 GLN HA A 23 GLN HGx 1.0 . 3.91 620 564 A 23 GLN HA A 23 GLN HGy 1.0 . 3.91 621 565 A 7 CYS HA A 8 SER HA 1.0 . 5.22 622 566 A 8 SER HA A 9 LEU HDy% 1.0 . 5.50 623 567 A 8 SER HA A 9 LEU HG 1.0 . 4.34 624 568 A 20 CYS H A 21 ILE HG2% 1.0 . 5.22 625 569 A 21 ILE HG2% A 25 TRP HZ3 1.0 . 3.84 626 570 A 21 ILE HG2% A 21 ILE HA 1.0 . 3.47 627 571 A 32 ASP HBx A 21 ILE HG2% 1.0 . 4.57 628 572 A 21 ILE H A 21 ILE HG2% 1.0 . 4.39 629 573 A 21 ILE HA A 22 PRO HDy 1.0 . 3.10 630 574 A 21 ILE HA A 22 PRO HDx 1.0 . 3.59 631 575 A 17 ILE HG2% A 17 ILE HA 1.0 . 3.57 632 576 A 17 ILE HG2% A 18 THR HB 1.0 . 5.50 633 577 A 17 ILE HG2% A 17 ILE HG1x 1.0 . 3.57 634 578 A 17 ILE HG2% A 17 ILE H 1.0 . 4.47 635 579 A 17 ILE HG2% A 17 ILE HG1y 1.0 . 4.04 636 580 A 10 GLY HAx A 9 LEU HA 1.0 . 5.05 637 581 A 31 VAL HGx% A 34 ASP HA 1.0 . 5.00 638 582 A 36 GLY H A 34 ASP HA 1.0 . 4.70 639 583 A 9 LEU HA A 9 LEU HBy 1.0 . 2.96 640 584 A 9 LEU HDy% A 9 LEU HA 1.0 . 3.72 641 585 A 21 ILE H A 11 TYR HA 1.0 . 4.82 642 586 A 11 TYR HA A 22 PRO HBy 1.0 . 5.16 643 587 A 11 TYR HD% A 11 TYR HA 1.0 . 4.02 644 588 A 26 ARG HA A 27 CYS HBx 1.0 . 4.89 645 589 A 26 ARG HGx A 26 ARG HA 1.0 . 4.15 646 590 A 21 ILE HD1% A 26 ARG HA 1.0 . 5.08 647 591 A 26 ARG HGx A 38 ASP HA 1.0 . 4.58 648 592 A 21 ILE HD1% A 21 ILE H 1.0 . 4.24 649 593 A 21 ILE HD1% A 21 ILE HA 1.0 . 5.20 650 594 A 21 ILE HD1% A 25 TRP HBy 1.0 . 4.01 651 595 A 21 ILE HD1% A 38 ASP HBx 1.0 . 3.85 652 596 A 12 PHE HE% A 38 ASP HA 1.0 . 4.08 653 597 A 38 ASP HBx A 38 ASP HA 1.0 . 3.00 654 598 A 21 ILE HD1% A 12 PHE HD% 1.0 . 4.13 655 599 A 21 ILE HD1% A 21 ILE HB 1.0 . 3.61 656 600 A 21 ILE HD1% A 38 ASP HA 1.0 . 4.95 657 601 A 19 LYS HA A 19 LYS HGx 1.0 . 3.73 658 601 A 19 LYS HGy A 19 LYS HA 1.0 . 3.73 659 602 A 25 TRP HE1 A 25 TRP HA 1.0 . 5.18 660 603 A 25 TRP HD1 A 25 TRP HA 1.0 . 3.56 661 604 A 25 TRP HA A 28 ASP HBx 1.0 . 4.05 662 605 A 40 GLN HA A 41 GLY HAy 1.0 . 4.45 663 606 A 16 ASN HA A 16 ASN HBx 1.0 . 2.99 664 607 A 11 TYR HBx A 20 CYS HA 1.0 . 4.63 665 608 A 20 CYS HA A 13 PRO HBx 1.0 . 4.91 666 609 A 40 GLN HA A 39 GLU HBx 1.0 . 4.93 667 610 A 20 CYS HA A 21 ILE HG2% 1.0 . 4.82 668 611 A 39 GLU H A 40 GLN HA 1.0 . 5.42 669 612 A 40 GLN HA A 40 GLN HGy 1.0 . 3.66 670 612 A 40 GLN HA A 40 GLN HGx 1.0 . 3.66 671 613 A 15 GLY H A 14 CYS HA 1.0 . 3.48 672 614 A 42 CYS H A 39 GLU HA 1.0 . 3.50 673 615 A 14 CYS HA A 33 CYS HBx 1.0 . 4.31 674 615 A 33 CYS HBy A 14 CYS HA 1.0 . 4.31 675 616 A 23 GLN HE2y A 12 PHE HA 1.0 . 4.96 676 617 A 12 PHE HD% A 12 PHE HA 1.0 . 4.18 677 618 A 13 PRO HDy A 12 PHE HA 1.0 . 3.00 678 619 A 13 PRO HDx A 12 PHE HA 1.0 . 3.26 679 620 A 7 CYS HBx A 12 PHE HA 1.0 . 4.65 680 621 A 19 LYS HEy A 33 CYS HA 1.0 . 5.50 681 622 A 30 GLN HA A 30 GLN HGx 1.0 . 3.62 682 622 A 30 GLN HA A 30 GLN HGy 1.0 . 3.62 683 623 A 17 ILE HD1% A 35 ASN HD2y 1.0 . 5.31 684 624 A 19 LYS HBy A 17 ILE HD1% 1.0 . 5.24 685 625 A 17 ILE HD1% A 17 ILE HA 1.0 . 4.61 686 626 A 17 ILE HD1% A 34 ASP HBy 1.0 . 4.66 687 627 A 17 ILE HB A 17 ILE HD1% 1.0 . 3.90 688 628 A 13 PRO HDy A 7 CYS HBx 1.0 . 4.78 689 629 A 12 PHE HD% A 13 PRO HDx 1.0 . 4.76 690 630 A 12 PHE HD% A 13 PRO HDy 1.0 . 5.15 691 631 A 12 PHE HBy A 13 PRO HDx 1.0 . 3.81 692 632 A 11 TYR HE% A 22 PRO HDx 1.0 . 5.50 693 633 A 25 TRP HH2 A 22 PRO HDy 1.0 . 5.50 694 634 A 25 TRP HZ3 A 22 PRO HDx 1.0 . 4.72 695 635 A 21 ILE HB A 22 PRO HDy 1.0 . 3.81 696 636 A 21 ILE HB A 22 PRO HDx 1.0 . 3.50 697 637 A 11 TYR HD% A 10 GLY H 1.0 . 5.50 698 638 A 11 TYR HD% A 9 LEU HDy% 1.0 . 4.94 699 639 A 12 PHE HD% A 11 TYR H 1.0 . 5.29 700 640 A 12 PHE HD% A 23 GLN HE2y 1.0 . 2.69 701 641 A 12 PHE HD% A 21 ILE HG1x 1.0 . 3.93 702 642 A 11 TYR HD% A 21 ILE HA 1.0 . 4.98 703 643 A 11 TYR HD% A 8 SER H 1.0 . 5.01 704 644 A 24 PHE HA A 24 PHE HD% 1.0 . 5.42 705 645 A 26 ARG HDy A 12 PHE HZ 1.0 . 5.50 706 646 A 26 ARG HA A 12 PHE HZ 1.0 . 5.12 707 647 A 23 GLN HA A 12 PHE HZ 1.0 . 4.39 708 648 A 26 ARG HBx A 12 PHE HZ 1.0 . 5.02 709 649 A 26 ARG HDy A 12 PHE HE% 1.0 . 4.70 710 650 A 26 ARG HBx A 12 PHE HE% 1.0 . 4.86 711 651 A 21 ILE HD1% A 12 PHE HE% 1.0 . 4.37 712 652 A 12 PHE HE% A 26 ARG HA 1.0 . 5.50 713 653 A 21 ILE HG2% A 25 TRP HH2 1.0 . 4.73 714 654 A 25 TRP HD1 A 24 PHE HD% 1.0 . 4.52 715 655 A 32 ASP HBy A 25 TRP HZ3 1.0 . 4.49 716 656 A 22 PRO HGy A 25 TRP HE3 1.0 . 4.32 717 657 A 32 ASP HBy A 25 TRP HE3 1.0 . 4.69 718 658 A 21 ILE HB A 25 TRP HE3 1.0 . 4.66 719 659 A 25 TRP HBy A 25 TRP HZ3 1.0 . 4.89 720 660 A 32 ASP HBx A 25 TRP HE3 1.0 . 5.50 721 661 A 21 ILE HG2% A 25 TRP HE3 1.0 . 4.18 722 662 A 9 LEU H A 11 TYR HE% 1.0 . 4.73 723 663 A 11 TYR HE% A 22 PRO HDy 1.0 . 4.25 724 664 A 22 PRO HGx A 11 TYR HE% 1.0 . 4.92 725 665 A 22 PRO HGx A 25 TRP HZ2 1.0 . 5.29 stop_ save_