data_nef_c34356_6qk6 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 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6QK6 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 10 CYS SG 2 1 CD CD 1 14 CYS SG 2 1 CD CD 1 14 CYS SG 2 2 CD CD 1 19 CYS SG 2 2 CD CD 1 21 CYS SG 2 3 CD CD 1 25 CYS SG 2 3 CD CD 1 27 CYS SG 2 1 CD CD 1 27 CYS SG 2 3 CD CD 1 31 CYS SG 2 1 CD CD 1 33 CYS SG 2 2 CD CD 1 36 CYS SG 2 3 CD CD 1 36 CYS SG 2 2 CD CD 1 39 CYS SG 2 4 CD CD 1 41 CYS SG 2 6 CD CD 1 46 CYS SG 2 6 CD CD 1 48 CYS SG 2 5 CD CD 1 48 CYS SG 2 6 CD CD 1 52 CYS SG 2 4 CD CD 1 52 CYS SG 2 6 CD CD 1 58 CYS SG 2 4 CD CD 1 60 CYS SG 2 5 CD CD 1 64 CYS SG 2 5 CD CD 1 66 CYS SG 2 5 CD CD 1 66 CYS SG 2 4 CD CD 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 GLY middle . false 4 A 4 LYS middle . . 5 A 5 GLY middle . false 6 A 6 LYS middle . . 7 A 7 GLY middle . false 8 A 8 GLU middle . . 9 A 9 LYS middle . . 10 A 10 CYS middle -HG . 11 A 11 THR middle . . 12 A 12 SER middle . . 13 A 13 ALA middle . . 14 A 14 CYS middle -HG . 15 A 15 ARG middle . . 16 A 16 SER middle . . 17 A 17 GLU middle . . 18 A 18 PRO middle . true 19 A 19 CYS middle -HG . 20 A 20 GLN middle . . 21 A 21 CYS middle -HG . 22 A 22 GLY middle . false 23 A 23 SER middle . . 24 A 24 LYS middle . . 25 A 25 CYS middle -HG . 26 A 26 GLN middle . . 27 A 27 CYS middle -HG . 28 A 28 GLY middle . false 29 A 29 GLU middle . . 30 A 30 GLY middle . false 31 A 31 CYS middle -HG . 32 A 32 THR middle . . 33 A 33 CYS middle -HG . 34 A 34 ALA middle . . 35 A 35 ALA middle . . 36 A 36 CYS middle -HG . 37 A 37 LYS middle . . 38 A 38 THR middle . . 39 A 39 CYS middle -HG . 40 A 40 ASN middle . . 41 A 41 CYS middle -HG . 42 A 42 THR middle . . 43 A 43 SER middle . . 44 A 44 ASP middle . . 45 A 45 GLY middle . false 46 A 46 CYS middle -HG . 47 A 47 LYS middle . . 48 A 48 CYS middle -HG . 49 A 49 GLY middle . false 50 A 50 LYS middle . . 51 A 51 GLU middle . . 52 A 52 CYS middle -HG . 53 A 53 THR middle . . 54 A 54 GLY middle . false 55 A 55 PRO middle . false 56 A 56 ASP middle . . 57 A 57 SER middle . . 58 A 58 CYS middle -HG . 59 A 59 LYS middle . . 60 A 60 CYS middle -HG . 61 A 61 GLY middle . false 62 A 62 SER middle . . 63 A 63 SER middle . . 64 A 64 CYS middle -HG . 65 A 65 SER middle . . 66 A 66 CYS middle -HG . 67 A 67 LYS end . . 68 B 1 CD . . . 69 B 2 CD . . . 70 B 3 CD . . . 71 B 4 CD . . . 72 B 5 CD . . . 73 B 6 CD . . . 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 GLY HAx H 1 3.807 0.020 A 1 GLY HAy H 1 3.807 0.020 A 1 GLY CA C 13 43.679 0.400 A 2 SER HA H 1 4.477 0.020 A 2 SER HBx H 1 3.848 0.020 A 2 SER HBy H 1 3.848 0.020 A 2 SER CA C 13 58.333 0.400 A 2 SER CB C 13 63.966 0.400 A 3 GLY HAx H 1 3.943 0.020 A 3 GLY HAy H 1 3.943 0.020 A 3 GLY CA C 13 45.324 0.400 A 4 LYS HA H 1 4.277 0.020 A 4 LYS HBy H 1 1.829 0.020 A 4 LYS HBx H 1 1.707 0.020 A 4 LYS HDx H 1 1.620 0.020 A 4 LYS HDy H 1 1.620 0.020 A 4 LYS HEx H 1 2.950 0.020 A 4 LYS HEy H 1 2.950 0.020 A 4 LYS HGy H 1 1.406 0.020 A 4 LYS HGx H 1 1.367 0.020 A 4 LYS CA C 13 56.370 0.400 A 4 LYS CB C 13 32.939 0.400 A 4 LYS CD C 13 28.997 0.400 A 4 LYS CE C 13 42.114 0.400 A 4 LYS CG C 13 24.696 0.400 A 5 GLY H H 1 8.481 0.020 A 5 GLY HAx H 1 3.883 0.020 A 5 GLY HAy H 1 3.943 0.020 A 5 GLY CA C 13 45.336 0.400 A 5 GLY N N 15 109.832 0.400 A 6 LYS H H 1 8.127 0.020 A 6 LYS HA H 1 4.476 0.020 A 6 LYS HBy H 1 1.899 0.020 A 6 LYS HBx H 1 1.785 0.020 A 6 LYS HDx H 1 1.602 0.020 A 6 LYS HDy H 1 1.612 0.020 A 6 LYS HEx H 1 3.019 0.020 A 6 LYS HEy H 1 3.019 0.020 A 6 LYS HGy H 1 1.445 0.020 A 6 LYS HGx H 1 1.320 0.020 A 6 LYS CA C 13 55.189 0.400 A 6 LYS CB C 13 32.527 0.400 A 6 LYS CD C 13 29.023 0.400 A 6 LYS CE C 13 42.669 0.400 A 6 LYS CG C 13 25.191 0.400 A 6 LYS N N 15 119.130 0.400 A 7 GLY H H 1 8.675 0.020 A 7 GLY HAx H 1 4.008 0.020 A 7 GLY HAy H 1 4.207 0.020 A 7 GLY CA C 13 45.267 0.400 A 7 GLY N N 15 111.480 0.400 A 8 GLU H H 1 8.712 0.020 A 8 GLU HA H 1 4.041 0.020 A 8 GLU HBy H 1 2.043 0.020 A 8 GLU HBx H 1 1.990 0.020 A 8 GLU HGx H 1 2.271 0.020 A 8 GLU HGy H 1 2.271 0.020 A 8 GLU CA C 13 58.607 0.400 A 8 GLU CB C 13 30.039 0.400 A 8 GLU CG C 13 36.457 0.400 A 8 GLU N N 15 120.048 0.400 A 9 LYS H H 1 8.547 0.020 A 9 LYS HA H 1 4.532 0.020 A 9 LYS HBy H 1 2.061 0.020 A 9 LYS HBx H 1 1.687 0.020 A 9 LYS HDx H 1 1.692 0.020 A 9 LYS HDy H 1 1.692 0.020 A 9 LYS HEx H 1 2.962 0.020 A 9 LYS HEy H 1 2.962 0.020 A 9 LYS HGy H 1 1.461 0.020 A 9 LYS HGx H 1 1.339 0.020 A 9 LYS CA C 13 54.803 0.400 A 9 LYS CB C 13 31.646 0.400 A 9 LYS CD C 13 28.920 0.400 A 9 LYS CE C 13 42.292 0.400 A 9 LYS CG C 13 25.163 0.400 A 9 LYS N N 15 116.520 0.400 A 10 CYS H H 1 7.291 0.020 A 10 CYS HA H 1 4.596 0.020 A 10 CYS HBy H 1 2.979 0.020 A 10 CYS HBx H 1 2.873 0.020 A 10 CYS CA C 13 63.674 0.400 A 10 CYS CB C 13 31.040 0.400 A 10 CYS N N 15 122.056 0.400 A 11 THR H H 1 7.319 0.020 A 11 THR HA H 1 4.324 0.020 A 11 THR HB H 1 4.766 0.020 A 11 THR HG2% H 1 1.236 0.020 A 11 THR CA C 13 60.276 0.400 A 11 THR CB C 13 71.612 0.400 A 11 THR CG2 C 13 22.612 0.400 A 11 THR N N 15 112.955 0.400 A 12 SER HA H 1 3.951 0.020 A 12 SER HBx H 1 3.832 0.020 A 12 SER HBy H 1 3.832 0.020 A 12 SER CA C 13 61.492 0.400 A 12 SER CB C 13 62.123 0.400 A 13 ALA H H 1 7.780 0.020 A 13 ALA HA H 1 4.002 0.020 A 13 ALA HB% H 1 1.216 0.020 A 13 ALA CA C 13 55.044 0.400 A 13 ALA CB C 13 18.223 0.400 A 13 ALA N N 15 123.435 0.400 A 14 CYS H H 1 7.205 0.020 A 14 CYS HA H 1 5.601 0.020 A 14 CYS HBy H 1 2.956 0.020 A 14 CYS HBx H 1 2.754 0.020 A 14 CYS CA C 13 60.718 0.400 A 14 CYS CB C 13 32.678 0.400 A 14 CYS N N 15 122.643 0.400 A 15 ARG H H 1 7.576 0.020 A 15 ARG HA H 1 4.019 0.020 A 15 ARG HBx H 1 1.551 0.020 A 15 ARG HBy H 1 1.994 0.020 A 15 ARG HDy H 1 3.104 0.020 A 15 ARG HDx H 1 2.936 0.020 A 15 ARG HGy H 1 1.603 0.020 A 15 ARG HGx H 1 1.473 0.020 A 15 ARG CA C 13 56.936 0.400 A 15 ARG CB C 13 30.313 0.400 A 15 ARG CD C 13 43.415 0.400 A 15 ARG CG C 13 28.563 0.400 A 15 ARG N N 15 113.983 0.400 A 16 SER H H 1 7.194 0.020 A 16 SER HA H 1 4.264 0.020 A 16 SER HBy H 1 3.897 0.020 A 16 SER HBx H 1 3.773 0.020 A 16 SER CA C 13 59.313 0.400 A 16 SER CB C 13 64.843 0.400 A 16 SER N N 15 116.200 0.400 A 17 GLU H H 1 8.130 0.020 A 17 GLU HA H 1 4.681 0.020 A 17 GLU HBy H 1 1.853 0.020 A 17 GLU HBx H 1 1.808 0.020 A 17 GLU HGy H 1 2.110 0.020 A 17 GLU HGx H 1 2.052 0.020 A 17 GLU CA C 13 51.849 0.400 A 17 GLU CB C 13 31.509 0.400 A 17 GLU CG C 13 35.722 0.400 A 17 GLU N N 15 120.462 0.400 A 18 PRO HA H 1 4.748 0.020 A 18 PRO HBy H 1 2.290 0.020 A 18 PRO HBx H 1 2.024 0.020 A 18 PRO HDx H 1 3.425 0.020 A 18 PRO HDy H 1 3.425 0.020 A 18 PRO HGy H 1 1.871 0.020 A 18 PRO HGx H 1 1.607 0.020 A 18 PRO CA C 13 63.383 0.400 A 18 PRO CB C 13 34.810 0.400 A 18 PRO CD C 13 49.691 0.400 A 18 PRO CG C 13 24.822 0.400 A 19 CYS H H 1 8.092 0.020 A 19 CYS HA H 1 4.118 0.020 A 19 CYS HBy H 1 3.013 0.020 A 19 CYS HBx H 1 2.548 0.020 A 19 CYS CA C 13 61.536 0.400 A 19 CYS CB C 13 30.127 0.400 A 19 CYS N N 15 120.746 0.400 A 20 GLN H H 1 8.325 0.020 A 20 GLN HA H 1 4.447 0.020 A 20 GLN HBx H 1 1.761 0.020 A 20 GLN HBy H 1 2.431 0.020 A 20 GLN HE2y H 1 7.417 0.020 A 20 GLN HE2x H 1 6.865 0.020 A 20 GLN HGy H 1 2.528 0.020 A 20 GLN HGx H 1 2.437 0.020 A 20 GLN CA C 13 54.536 0.400 A 20 GLN CB C 13 29.732 0.400 A 20 GLN CG C 13 33.365 0.400 A 20 GLN N N 15 125.984 0.400 A 20 GLN NE2 N 15 112.973 0.400 A 21 CYS H H 1 9.201 0.020 A 21 CYS HA H 1 3.492 0.020 A 21 CYS HBy H 1 2.814 0.020 A 21 CYS HBx H 1 2.708 0.020 A 21 CYS CA C 13 66.723 0.400 A 21 CYS CB C 13 30.038 0.400 A 21 CYS N N 15 126.063 0.400 A 22 GLY H H 1 8.492 0.020 A 22 GLY HAy H 1 3.703 0.020 A 22 GLY HAx H 1 3.551 0.020 A 22 GLY CA C 13 46.409 0.400 A 22 GLY N N 15 105.115 0.400 A 23 SER HA H 1 4.437 0.020 A 23 SER HBy H 1 4.013 0.020 A 23 SER HBx H 1 3.849 0.020 A 23 SER CA C 13 58.577 0.400 A 23 SER CB C 13 63.194 0.400 A 24 LYS H H 1 8.082 0.020 A 24 LYS HA H 1 4.585 0.020 A 24 LYS HBy H 1 1.940 0.020 A 24 LYS HBx H 1 1.554 0.020 A 24 LYS HDx H 1 1.590 0.020 A 24 LYS HDy H 1 1.622 0.020 A 24 LYS HEx H 1 2.906 0.020 A 24 LYS HEy H 1 2.906 0.020 A 24 LYS HGx H 1 1.255 0.020 A 24 LYS HGy H 1 1.321 0.020 A 24 LYS CA C 13 54.111 0.400 A 24 LYS CB C 13 32.291 0.400 A 24 LYS CD C 13 29.036 0.400 A 24 LYS CE C 13 42.156 0.400 A 24 LYS CG C 13 24.550 0.400 A 24 LYS N N 15 123.174 0.400 A 25 CYS H H 1 7.963 0.020 A 25 CYS HA H 1 4.172 0.020 A 25 CYS HBx H 1 3.022 0.020 A 25 CYS HBy H 1 3.022 0.020 A 25 CYS CA C 13 62.040 0.400 A 25 CYS CB C 13 30.598 0.400 A 25 CYS N N 15 122.611 0.400 A 26 GLN H H 1 9.294 0.020 A 26 GLN HA H 1 4.769 0.020 A 26 GLN HBx H 1 1.734 0.020 A 26 GLN HBy H 1 2.435 0.020 A 26 GLN HE2y H 1 7.447 0.020 A 26 GLN HE2x H 1 6.851 0.020 A 26 GLN HGy H 1 2.379 0.020 A 26 GLN HGx H 1 2.283 0.020 A 26 GLN CA C 13 54.537 0.400 A 26 GLN CB C 13 29.870 0.400 A 26 GLN CG C 13 34.132 0.400 A 26 GLN N N 15 130.049 0.400 A 26 GLN NE2 N 15 112.081 0.400 A 27 CYS H H 1 9.332 0.020 A 27 CYS HA H 1 4.213 0.020 A 27 CYS HBx H 1 3.061 0.020 A 27 CYS HBy H 1 3.145 0.020 A 27 CYS CA C 13 62.710 0.400 A 27 CYS CB C 13 30.867 0.400 A 27 CYS N N 15 123.675 0.400 A 28 GLY H H 1 7.917 0.020 A 28 GLY HAx H 1 3.619 0.020 A 28 GLY HAy H 1 4.437 0.020 A 28 GLY CA C 13 43.811 0.400 A 28 GLY N N 15 108.652 0.400 A 29 GLU H H 1 8.494 0.020 A 29 GLU HA H 1 3.930 0.020 A 29 GLU HBx H 1 1.916 0.020 A 29 GLU HBy H 1 1.916 0.020 A 29 GLU HGx H 1 2.269 0.020 A 29 GLU HGy H 1 2.269 0.020 A 29 GLU CA C 13 57.607 0.400 A 29 GLU CB C 13 29.700 0.400 A 29 GLU CG C 13 36.018 0.400 A 29 GLU N N 15 119.068 0.400 A 30 GLY H H 1 8.607 0.020 A 30 GLY HAx H 1 3.545 0.020 A 30 GLY HAy H 1 4.158 0.020 A 30 GLY CA C 13 44.877 0.400 A 30 GLY N N 15 110.221 0.400 A 31 CYS H H 1 7.215 0.020 A 31 CYS HA H 1 3.799 0.020 A 31 CYS HBx H 1 2.846 0.020 A 31 CYS HBy H 1 2.846 0.020 A 31 CYS CA C 13 61.256 0.400 A 31 CYS CB C 13 30.950 0.400 A 31 CYS N N 15 122.017 0.400 A 32 THR H H 1 8.168 0.020 A 32 THR HA H 1 4.453 0.020 A 32 THR HB H 1 4.523 0.020 A 32 THR HG2% H 1 1.071 0.020 A 32 THR CA C 13 60.469 0.400 A 32 THR CB C 13 68.883 0.400 A 32 THR CG2 C 13 21.312 0.400 A 32 THR N N 15 120.794 0.400 A 33 CYS H H 1 8.867 0.020 A 33 CYS HA H 1 4.168 0.020 A 33 CYS HBx H 1 2.465 0.020 A 33 CYS HBy H 1 3.235 0.020 A 33 CYS CA C 13 60.245 0.400 A 33 CYS CB C 13 31.701 0.400 A 33 CYS N N 15 130.209 0.400 A 34 ALA H H 1 8.919 0.020 A 34 ALA HA H 1 4.111 0.020 A 34 ALA HB% H 1 1.434 0.020 A 34 ALA CA C 13 54.082 0.400 A 34 ALA CB C 13 18.796 0.400 A 34 ALA N N 15 131.568 0.400 A 35 ALA H H 1 8.731 0.020 A 35 ALA HA H 1 4.265 0.020 A 35 ALA HB% H 1 1.479 0.020 A 35 ALA CA C 13 53.998 0.400 A 35 ALA CB C 13 19.736 0.400 A 35 ALA N N 15 120.665 0.400 A 36 CYS H H 1 7.268 0.020 A 36 CYS HA H 1 5.033 0.020 A 36 CYS HBy H 1 3.464 0.020 A 36 CYS HBx H 1 3.098 0.020 A 36 CYS CA C 13 57.449 0.400 A 36 CYS CB C 13 33.525 0.400 A 36 CYS N N 15 110.440 0.400 A 37 LYS H H 1 7.657 0.020 A 37 LYS HA H 1 4.498 0.020 A 37 LYS HBy H 1 1.831 0.020 A 37 LYS HBx H 1 1.711 0.020 A 37 LYS HDy H 1 1.675 0.020 A 37 LYS HDx H 1 1.591 0.020 A 37 LYS HEx H 1 2.942 0.020 A 37 LYS HEy H 1 2.942 0.020 A 37 LYS HGy H 1 1.404 0.020 A 37 LYS HGx H 1 1.273 0.020 A 37 LYS CA C 13 56.246 0.400 A 37 LYS CB C 13 31.612 0.400 A 37 LYS CD C 13 28.305 0.400 A 37 LYS CE C 13 42.011 0.400 A 37 LYS CG C 13 24.261 0.400 A 37 LYS N N 15 124.730 0.400 A 38 THR H H 1 8.147 0.020 A 38 THR HA H 1 4.427 0.020 A 38 THR HB H 1 4.026 0.020 A 38 THR HG2% H 1 1.080 0.020 A 38 THR CA C 13 60.520 0.400 A 38 THR CB C 13 71.302 0.400 A 38 THR CG2 C 13 21.755 0.400 A 38 THR N N 15 117.973 0.400 A 39 CYS H H 1 8.097 0.020 A 39 CYS HA H 1 4.062 0.020 A 39 CYS HBy H 1 3.047 0.020 A 39 CYS HBx H 1 1.965 0.020 A 39 CYS CA C 13 62.232 0.400 A 39 CYS CB C 13 31.657 0.400 A 39 CYS N N 15 122.912 0.400 A 40 ASN H H 1 9.673 0.020 A 40 ASN HA H 1 4.778 0.020 A 40 ASN HBx H 1 2.807 0.020 A 40 ASN HBy H 1 2.807 0.020 A 40 ASN HD2y H 1 7.315 0.020 A 40 ASN HD2x H 1 6.715 0.020 A 40 ASN CA C 13 54.048 0.400 A 40 ASN CB C 13 39.164 0.400 A 40 ASN N N 15 125.396 0.400 A 40 ASN ND2 N 15 114.582 0.400 A 41 CYS H H 1 9.049 0.020 A 41 CYS HA H 1 4.197 0.020 A 41 CYS HBy H 1 3.166 0.020 A 41 CYS HBx H 1 2.869 0.020 A 41 CYS CA C 13 62.536 0.400 A 41 CYS CB C 13 31.203 0.400 A 41 CYS N N 15 126.065 0.400 A 42 THR H H 1 7.208 0.020 A 42 THR HA H 1 4.851 0.020 A 42 THR HB H 1 4.547 0.020 A 42 THR HG2% H 1 1.143 0.020 A 42 THR CA C 13 59.798 0.400 A 42 THR CB C 13 73.213 0.400 A 42 THR CG2 C 13 21.446 0.400 A 42 THR N N 15 106.610 0.400 A 43 SER H H 1 8.805 0.020 A 43 SER HA H 1 4.074 0.020 A 43 SER HBy H 1 3.999 0.020 A 43 SER HBx H 1 3.943 0.020 A 43 SER CA C 13 60.760 0.400 A 43 SER CB C 13 62.864 0.400 A 43 SER N N 15 112.708 0.400 A 44 ASP H H 1 8.037 0.020 A 44 ASP HA H 1 4.463 0.020 A 44 ASP HBy H 1 2.666 0.020 A 44 ASP HBx H 1 2.372 0.020 A 44 ASP CA C 13 55.871 0.400 A 44 ASP CB C 13 40.869 0.400 A 44 ASP N N 15 120.212 0.400 A 45 GLY H H 1 7.811 0.020 A 45 GLY HAx H 1 3.530 0.020 A 45 GLY HAy H 1 4.302 0.020 A 45 GLY CA C 13 45.004 0.400 A 45 GLY N N 15 106.931 0.400 A 46 CYS H H 1 8.705 0.020 A 46 CYS HA H 1 4.546 0.020 A 46 CYS HBx H 1 2.654 0.020 A 46 CYS HBy H 1 2.711 0.020 A 46 CYS CA C 13 60.580 0.400 A 46 CYS CB C 13 31.007 0.400 A 46 CYS N N 15 126.509 0.400 A 47 LYS H H 1 10.183 0.020 A 47 LYS HA H 1 4.586 0.020 A 47 LYS HBy H 1 1.977 0.020 A 47 LYS HBx H 1 1.846 0.020 A 47 LYS HDx H 1 1.606 0.020 A 47 LYS HDy H 1 1.606 0.020 A 47 LYS HEx H 1 2.953 0.020 A 47 LYS HEy H 1 2.953 0.020 A 47 LYS HGx H 1 1.492 0.020 A 47 LYS HGy H 1 1.492 0.020 A 47 LYS CA C 13 55.678 0.400 A 47 LYS CB C 13 33.082 0.400 A 47 LYS CD C 13 28.561 0.400 A 47 LYS CE C 13 42.222 0.400 A 47 LYS CG C 13 24.477 0.400 A 47 LYS N N 15 134.582 0.400 A 48 CYS H H 1 9.267 0.020 A 48 CYS HA H 1 4.846 0.020 A 48 CYS HBy H 1 3.285 0.020 A 48 CYS HBx H 1 2.499 0.020 A 48 CYS CA C 13 58.530 0.400 A 48 CYS CB C 13 35.644 0.400 A 48 CYS N N 15 121.587 0.400 A 49 GLY H H 1 8.424 0.020 A 49 GLY HAx H 1 3.780 0.020 A 49 GLY HAy H 1 4.247 0.020 A 49 GLY CA C 13 45.531 0.400 A 49 GLY N N 15 115.802 0.400 A 50 LYS H H 1 7.946 0.020 A 50 LYS HA H 1 4.567 0.020 A 50 LYS HBy H 1 1.927 0.020 A 50 LYS HBx H 1 1.817 0.020 A 50 LYS HDx H 1 1.566 0.020 A 50 LYS HDy H 1 1.566 0.020 A 50 LYS HEx H 1 3.001 0.020 A 50 LYS HEy H 1 3.001 0.020 A 50 LYS HGx H 1 1.261 0.020 A 50 LYS HGy H 1 1.668 0.020 A 50 LYS CA C 13 54.508 0.400 A 50 LYS CB C 13 31.157 0.400 A 50 LYS CD C 13 27.450 0.400 A 50 LYS CE C 13 42.236 0.400 A 50 LYS CG C 13 24.307 0.400 A 50 LYS N N 15 121.155 0.400 A 51 GLU H H 1 8.853 0.020 A 51 GLU HA H 1 3.984 0.020 A 51 GLU HBx H 1 2.171 0.020 A 51 GLU HBy H 1 2.297 0.020 A 51 GLU HGx H 1 2.096 0.020 A 51 GLU HGy H 1 2.096 0.020 A 51 GLU CA C 13 57.811 0.400 A 51 GLU CB C 13 27.565 0.400 A 51 GLU CG C 13 36.527 0.400 A 51 GLU N N 15 119.307 0.400 A 52 CYS H H 1 8.158 0.020 A 52 CYS HA H 1 4.650 0.020 A 52 CYS HBy H 1 3.642 0.020 A 52 CYS HBx H 1 2.998 0.020 A 52 CYS CA C 13 54.724 0.400 A 52 CYS CB C 13 33.255 0.400 A 52 CYS N N 15 116.653 0.400 A 53 THR H H 1 8.244 0.020 A 53 THR HA H 1 3.968 0.020 A 53 THR HB H 1 4.232 0.020 A 53 THR HG2% H 1 0.880 0.020 A 53 THR CA C 13 59.398 0.400 A 53 THR CB C 13 68.107 0.400 A 53 THR CG2 C 13 20.898 0.400 A 53 THR N N 15 112.037 0.400 A 54 GLY H H 1 6.876 0.020 A 54 GLY HAy H 1 4.499 0.020 A 54 GLY HAx H 1 3.770 0.020 A 54 GLY CA C 13 44.883 0.400 A 54 GLY N N 15 110.852 0.400 A 55 PRO HA H 1 3.869 0.020 A 55 PRO HBy H 1 2.101 0.020 A 55 PRO HBx H 1 1.948 0.020 A 55 PRO HDx H 1 3.732 0.020 A 55 PRO HDy H 1 3.827 0.020 A 55 PRO HGx H 1 2.066 0.020 A 55 PRO HGy H 1 2.137 0.020 A 55 PRO CA C 13 65.920 0.400 A 55 PRO CB C 13 32.115 0.400 A 55 PRO CD C 13 49.339 0.400 A 55 PRO CG C 13 27.686 0.400 A 56 ASP H H 1 8.425 0.020 A 56 ASP HA H 1 4.288 0.020 A 56 ASP HBy H 1 2.580 0.020 A 56 ASP HBx H 1 2.507 0.020 A 56 ASP CA C 13 56.356 0.400 A 56 ASP CB C 13 40.244 0.400 A 56 ASP N N 15 113.592 0.400 A 57 SER H H 1 7.735 0.020 A 57 SER HA H 1 4.497 0.020 A 57 SER HBy H 1 4.103 0.020 A 57 SER HBx H 1 3.620 0.020 A 57 SER CA C 13 57.076 0.400 A 57 SER CB C 13 64.881 0.400 A 57 SER N N 15 110.404 0.400 A 58 CYS H H 1 7.137 0.020 A 58 CYS HA H 1 4.301 0.020 A 58 CYS HBy H 1 2.915 0.020 A 58 CYS HBx H 1 2.811 0.020 A 58 CYS CA C 13 62.308 0.400 A 58 CYS CB C 13 31.145 0.400 A 58 CYS N N 15 124.386 0.400 A 59 LYS H H 1 9.757 0.020 A 59 LYS HA H 1 4.633 0.020 A 59 LYS HBx H 1 1.690 0.020 A 59 LYS HBy H 1 2.024 0.020 A 59 LYS HDx H 1 1.632 0.020 A 59 LYS HDy H 1 1.632 0.020 A 59 LYS HEx H 1 2.911 0.020 A 59 LYS HEy H 1 2.911 0.020 A 59 LYS HGx H 1 1.352 0.020 A 59 LYS HGy H 1 1.352 0.020 A 59 LYS CA C 13 55.334 0.400 A 59 LYS CB C 13 32.883 0.400 A 59 LYS CD C 13 28.997 0.400 A 59 LYS CE C 13 42.156 0.400 A 59 LYS CG C 13 24.509 0.400 A 59 LYS N N 15 131.829 0.400 A 60 CYS H H 1 9.193 0.020 A 60 CYS HA H 1 4.093 0.020 A 60 CYS HBx H 1 2.440 0.020 A 60 CYS HBy H 1 3.084 0.020 A 60 CYS CA C 13 62.324 0.400 A 60 CYS CB C 13 31.841 0.400 A 60 CYS N N 15 125.938 0.400 A 61 GLY H H 1 8.652 0.020 A 61 GLY HAx H 1 3.803 0.020 A 61 GLY HAy H 1 4.203 0.020 A 61 GLY CA C 13 43.786 0.400 A 61 GLY N N 15 108.312 0.400 A 62 SER H H 1 8.052 0.020 A 62 SER HA H 1 3.970 0.020 A 62 SER HBx H 1 3.941 0.020 A 62 SER HBy H 1 3.941 0.020 A 62 SER CA C 13 61.212 0.400 A 62 SER CB C 13 63.877 0.400 A 62 SER N N 15 110.249 0.400 A 63 SER H H 1 7.946 0.020 A 63 SER HA H 1 4.456 0.020 A 63 SER HBx H 1 3.800 0.020 A 63 SER HBy H 1 3.977 0.020 A 63 SER CA C 13 58.047 0.400 A 63 SER CB C 13 63.707 0.400 A 63 SER N N 15 113.642 0.400 A 64 CYS H H 1 7.456 0.020 A 64 CYS HA H 1 4.163 0.020 A 64 CYS HBy H 1 3.099 0.020 A 64 CYS HBx H 1 2.868 0.020 A 64 CYS CA C 13 61.538 0.400 A 64 CYS CB C 13 29.670 0.400 A 64 CYS N N 15 124.072 0.400 A 65 SER H H 1 8.498 0.020 A 65 SER HA H 1 4.307 0.020 A 65 SER HBy H 1 4.041 0.020 A 65 SER HBx H 1 3.884 0.020 A 65 SER CA C 13 60.654 0.400 A 65 SER CB C 13 62.911 0.400 A 65 SER N N 15 124.843 0.400 A 66 CYS H H 1 7.527 0.020 A 66 CYS HA H 1 5.024 0.020 A 66 CYS HBy H 1 4.149 0.020 A 66 CYS HBx H 1 3.012 0.020 A 66 CYS CA C 13 58.559 0.400 A 66 CYS CB C 13 33.748 0.400 A 66 CYS N N 15 118.546 0.400 A 67 LYS H H 1 7.014 0.020 A 67 LYS HA H 1 4.094 0.020 A 67 LYS HBy H 1 1.782 0.020 A 67 LYS HBx H 1 1.652 0.020 A 67 LYS HDy H 1 1.480 0.020 A 67 LYS HDx H 1 1.307 0.020 A 67 LYS HEy H 1 2.686 0.020 A 67 LYS HEx H 1 2.544 0.020 A 67 LYS HGy H 1 1.551 0.020 A 67 LYS HGx H 1 1.189 0.020 A 67 LYS CA C 13 55.647 0.400 A 67 LYS CB C 13 32.547 0.400 A 67 LYS CD C 13 27.920 0.400 A 67 LYS CE C 13 42.700 0.400 A 67 LYS CG C 13 24.475 0.400 A 67 LYS N N 15 126.160 0.400 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 16 SER HBy A 16 SER H 1.0 0.0 3.63 2 1 A 16 SER H A 16 SER HBx 1.0 0.0 3.63 3 2 A 14 CYS HBy A 16 SER H 1.0 0.0 4.90 4 3 A 20 GLN HGy A 16 SER H 1.0 0.0 5.30 5 4 A 16 SER H A 15 ARG HBy 1.0 0.0 4.18 6 5 A 20 GLN HBy A 16 SER H 1.0 0.0 5.24 7 6 A 16 SER H A 15 ARG HBy 1.0 0.0 5.50 8 6 A 15 ARG HBx A 16 SER H 1.0 0.0 5.50 9 6 A 15 ARG HGy A 16 SER H 1.0 0.0 5.50 10 6 A 16 SER H A 15 ARG HGx 1.0 0.0 5.50 11 7 A 13 ALA HB% A 16 SER H 1.0 0.0 5.00 12 8 A 14 CYS HA A 16 SER H 1.0 0.0 4.22 13 9 A 16 SER H A 13 ALA H 1.0 0.0 5.50 14 10 A 16 SER H A 15 ARG H 1.0 0.0 3.17 15 11 A 18 PRO HDy A 19 CYS H 1.0 0.0 5.50 16 12 A 19 CYS HBx A 19 CYS H 1.0 0.0 2.90 17 13 A 19 CYS HBy A 19 CYS H 1.0 0.0 3.02 18 14 A 18 PRO HBx A 19 CYS H 1.0 0.0 3.20 19 15 A 35 ALA HB% A 19 CYS H 1.0 0.0 3.85 20 16 A 48 CYS H A 49 GLY HAy 1.0 0.0 5.15 21 16 A 49 GLY HAx A 48 CYS H 1.0 0.0 5.15 22 17 A 48 CYS HBx A 48 CYS H 1.0 0.0 4.00 23 18 A 66 CYS HBy A 48 CYS H 1.0 0.0 5.27 24 19 A 46 CYS HBx A 48 CYS H 1.0 0.0 5.29 25 19 A 48 CYS H A 46 CYS HBy 1.0 0.0 5.29 26 20 A 48 CYS HBy A 48 CYS H 1.0 0.0 3.62 27 21 A 47 LYS HBx A 48 CYS H 1.0 0.0 4.22 28 22 A 48 CYS H A 47 LYS H 1.0 0.0 3.01 29 23 A 24 LYS HA A 25 CYS H 1.0 0.0 3.18 30 24 A 21 CYS HA A 25 CYS H 1.0 0.0 4.83 31 25 A 25 CYS HBx A 25 CYS H 1.0 0.0 3.21 32 25 A 25 CYS H A 25 CYS HBy 1.0 0.0 3.21 33 26 A 24 LYS HBy A 25 CYS H 1.0 0.0 4.89 34 26 A 25 CYS H A 24 LYS HBx 1.0 0.0 4.89 35 27 A 24 LYS HBy A 25 CYS H 1.0 0.0 4.89 36 27 A 25 CYS H A 24 LYS HBx 1.0 0.0 4.89 37 28 A 24 LYS HGx A 25 CYS H 1.0 0.0 5.50 38 28 A 25 CYS H A 24 LYS HGy 1.0 0.0 5.50 39 29 A 25 CYS H A 26 GLN H 1.0 0.0 4.63 40 30 A 58 CYS HA A 54 GLY H 1.0 0.0 5.33 41 30 A 53 THR HB A 54 GLY H 1.0 0.0 5.33 42 31 A 53 THR HA A 54 GLY H 1.0 0.0 3.29 43 32 A 39 CYS HBy A 54 GLY H 1.0 0.0 4.47 44 32 A 39 CYS HBx A 54 GLY H 1.0 0.0 4.47 45 33 A 53 THR HG2% A 54 GLY H 1.0 0.0 4.56 46 34 A 54 GLY H A 53 THR H 1.0 0.0 3.58 47 35 A 54 GLY H A 42 THR H 1.0 0.0 5.37 48 36 A 26 GLN H A 25 CYS HBy 1.0 0.0 5.50 49 36 A 25 CYS HBx A 26 GLN H 1.0 0.0 5.50 50 36 A 27 CYS HBy A 26 GLN H 1.0 0.0 5.50 51 37 A 21 CYS HBy A 26 GLN H 1.0 0.0 5.50 52 37 A 14 CYS HBx A 26 GLN H 1.0 0.0 5.50 53 38 A 26 GLN HBx A 26 GLN H 1.0 0.0 4.33 54 38 A 26 GLN HGy A 26 GLN H 1.0 0.0 4.33 55 39 A 26 GLN HBy A 26 GLN H 1.0 0.0 3.41 56 40 A 42 THR HB A 44 ASP H 1.0 0.0 3.68 57 41 A 44 ASP H A 45 GLY HAy 1.0 0.0 5.50 58 41 A 53 THR HB A 44 ASP H 1.0 0.0 5.50 59 41 A 45 GLY HAx A 44 ASP H 1.0 0.0 5.50 60 42 A 44 ASP H A 44 ASP HBy 1.0 0.0 3.65 61 43 A 44 ASP HBx A 44 ASP H 1.0 0.0 3.65 62 43 A 44 ASP H A 44 ASP HBy 1.0 0.0 3.65 63 44 A 42 THR HG2% A 44 ASP H 1.0 0.0 4.50 64 45 A 42 THR H A 44 ASP H 1.0 0.0 5.08 65 46 A 44 ASP H A 43 SER H 1.0 0.0 4.15 66 47 A 39 CYS HA A 40 ASN HD2y 1.0 0.0 4.42 67 48 A 66 CYS HA A 40 ASN HD2x 1.0 0.0 5.03 68 48 A 40 ASN HD2y A 66 CYS HA 1.0 0.0 5.03 69 49 A 60 CYS HBx A 61 GLY H 1.0 0.0 3.43 70 50 A 64 CYS HBy A 61 GLY H 1.0 0.0 5.50 71 51 A 60 CYS HBy A 61 GLY H 1.0 0.0 3.97 72 52 A 29 GLU HBy A 61 GLY H 1.0 0.0 5.50 73 52 A 29 GLU HBx A 61 GLY H 1.0 0.0 5.50 74 53 A 61 GLY H A 60 CYS H 1.0 0.0 4.89 75 54 A 38 THR HA A 39 CYS H 1.0 0.0 2.54 76 55 A 55 PRO HDy A 39 CYS H 1.0 0.0 3.60 77 56 A 21 CYS HA A 24 LYS H 1.0 0.0 4.85 78 56 A 22 GLY HAy A 24 LYS H 1.0 0.0 4.85 79 57 A 39 CYS HBx A 39 CYS H 1.0 0.0 3.49 80 57 A 39 CYS HBy A 39 CYS H 1.0 0.0 3.49 81 58 A 21 CYS HBx A 24 LYS H 1.0 0.0 5.50 82 59 A 55 PRO HBy A 39 CYS H 1.0 0.0 3.70 83 59 A 39 CYS HBy A 39 CYS H 1.0 0.0 3.70 84 59 A 39 CYS HBx A 39 CYS H 1.0 0.0 3.70 85 60 A 24 LYS H A 24 LYS HBx 1.0 0.0 3.48 86 60 A 24 LYS HBy A 24 LYS H 1.0 0.0 3.48 87 61 A 38 THR HG2% A 39 CYS H 1.0 0.0 4.33 88 62 A 24 LYS H A 22 GLY H 1.0 0.0 4.92 89 63 A 57 SER H A 57 SER HBx 1.0 0.0 4.10 90 63 A 57 SER HBy A 57 SER H 1.0 0.0 4.10 91 64 A 55 PRO HA A 57 SER H 1.0 0.0 4.41 92 65 A 57 SER H A 57 SER HBx 1.0 0.0 4.10 93 65 A 57 SER HBy A 57 SER H 1.0 0.0 4.10 94 66 A 58 CYS HBy A 57 SER H 1.0 0.0 4.31 95 66 A 57 SER H A 58 CYS HBx 1.0 0.0 4.31 96 67 A 57 SER H A 56 ASP HBy 1.0 0.0 4.63 97 67 A 56 ASP HBx A 57 SER H 1.0 0.0 4.63 98 68 A 57 SER H A 58 CYS H 1.0 0.0 3.10 99 69 A 57 SER H A 56 ASP H 1.0 0.0 4.01 100 70 A 46 CYS H A 45 GLY HAy 1.0 0.0 3.16 101 70 A 45 GLY HAx A 46 CYS H 1.0 0.0 3.16 102 71 A 53 THR HA A 46 CYS H 1.0 0.0 5.50 103 71 A 51 GLU HA A 46 CYS H 1.0 0.0 5.50 104 72 A 46 CYS H A 45 GLY HAy 1.0 0.0 3.33 105 72 A 45 GLY HAx A 46 CYS H 1.0 0.0 3.33 106 73 A 41 CYS HBy A 46 CYS H 1.0 0.0 4.97 107 74 A 46 CYS HBx A 46 CYS H 1.0 0.0 3.40 108 74 A 46 CYS H A 46 CYS HBy 1.0 0.0 3.40 109 75 A 53 THR HG2% A 46 CYS H 1.0 0.0 3.43 110 76 A 47 LYS H A 46 CYS H 1.0 0.0 4.88 111 77 A 10 CYS HA A 27 CYS H 1.0 0.0 5.15 112 78 A 27 CYS HBy A 27 CYS H 1.0 0.0 2.93 113 79 A 26 GLN HBx A 27 CYS H 1.0 0.0 4.52 114 80 A 26 GLN HBy A 27 CYS H 1.0 0.0 4.28 115 81 A 11 THR HG2% A 27 CYS H 1.0 0.0 3.79 116 82 A 27 CYS H A 28 GLY H 1.0 0.0 4.89 117 83 A 27 CYS H A 11 THR H 1.0 0.0 5.39 118 84 A 14 CYS HBy A 14 CYS H 1.0 0.0 2.94 119 85 A 14 CYS HBx A 14 CYS H 1.0 0.0 2.93 120 86 A 15 ARG HGy A 14 CYS H 1.0 0.0 4.42 121 86 A 14 CYS H A 15 ARG HGx 1.0 0.0 4.42 122 87 A 13 ALA HB% A 14 CYS H 1.0 0.0 3.28 123 88 A 32 THR HA A 33 CYS H 1.0 0.0 3.50 124 89 A 31 CYS HA A 33 CYS H 1.0 0.0 4.73 125 90 A 33 CYS HBx A 33 CYS H 1.0 0.0 3.10 126 90 A 33 CYS H A 33 CYS HBy 1.0 0.0 3.10 127 91 A 31 CYS HBx A 33 CYS H 1.0 0.0 5.28 128 91 A 33 CYS H A 31 CYS HBy 1.0 0.0 5.28 129 92 A 33 CYS HBx A 33 CYS H 1.0 0.0 2.93 130 92 A 33 CYS H A 33 CYS HBy 1.0 0.0 2.93 131 93 A 32 THR HG2% A 33 CYS H 1.0 0.0 4.47 132 94 A 33 CYS H A 32 THR H 1.0 0.0 3.58 133 95 A 33 CYS H A 36 CYS H 1.0 0.0 5.50 134 95 A 33 CYS H A 31 CYS H 1.0 0.0 5.50 135 96 A 16 SER HBy A 20 GLN HE2x 1.0 0.0 5.27 136 96 A 20 GLN HE2x A 16 SER HBx 1.0 0.0 5.27 137 96 A 20 GLN HE2y A 16 SER HBx 1.0 0.0 5.27 138 96 A 16 SER HBy A 20 GLN HE2y 1.0 0.0 5.27 139 97 A 18 PRO HDy A 20 GLN HE2x 1.0 0.0 4.69 140 97 A 18 PRO HDy A 20 GLN HE2y 1.0 0.0 4.69 141 98 A 35 ALA H A 33 CYS HBy 1.0 0.0 5.00 142 98 A 33 CYS HBx A 35 ALA H 1.0 0.0 5.00 143 99 A 19 CYS HBx A 35 ALA H 1.0 0.0 5.50 144 100 A 19 CYS HBy A 35 ALA H 1.0 0.0 5.24 145 100 A 33 CYS HBx A 35 ALA H 1.0 0.0 5.24 146 100 A 35 ALA H A 33 CYS HBy 1.0 0.0 5.24 147 101 A 35 ALA HB% A 35 ALA H 1.0 0.0 2.75 148 102 A 36 CYS H A 35 ALA H 1.0 0.0 2.92 149 103 A 36 CYS HA A 35 ALA H 1.0 0.0 5.29 150 104 A 20 GLN HA A 22 GLY H 1.0 0.0 5.09 151 105 A 22 GLY HAy A 22 GLY H 1.0 0.0 2.86 152 106 A 36 CYS HBy A 22 GLY H 1.0 0.0 5.50 153 106 A 25 CYS HBx A 22 GLY H 1.0 0.0 5.50 154 106 A 22 GLY H A 25 CYS HBy 1.0 0.0 5.50 155 107 A 21 CYS HBx A 22 GLY H 1.0 0.0 3.95 156 108 A 22 GLY H A 21 CYS H 1.0 0.0 3.47 157 109 A 10 CYS HA A 11 THR H 1.0 0.0 2.85 158 110 A 12 SER HA A 11 THR H 1.0 0.0 5.38 159 111 A 10 CYS HBy A 11 THR H 1.0 0.0 3.53 160 111 A 14 CYS HBy A 11 THR H 1.0 0.0 3.53 161 112 A 14 CYS HBx A 11 THR H 1.0 0.0 3.72 162 113 A 11 THR H A 15 ARG HGx 1.0 0.0 4.93 163 113 A 15 ARG HGy A 11 THR H 1.0 0.0 4.93 164 114 A 11 THR H A 15 ARG HGx 1.0 0.0 5.50 165 115 A 11 THR HG2% A 11 THR H 1.0 0.0 3.10 166 116 A 27 CYS H A 11 THR H 1.0 0.0 5.50 167 116 A 26 GLN H A 11 THR H 1.0 0.0 5.50 168 117 A 28 GLY H A 11 THR H 1.0 0.0 5.50 169 118 A 13 ALA H A 11 THR H 1.0 0.0 4.96 170 119 A 15 ARG H A 11 THR H 1.0 0.0 4.85 171 120 A 11 THR HA A 13 ALA H 1.0 0.0 4.77 172 121 A 13 ALA HB% A 13 ALA H 1.0 0.0 3.05 173 122 A 13 ALA H A 14 CYS H 1.0 0.0 3.72 174 123 A 53 THR HB A 53 THR H 1.0 0.0 4.12 175 124 A 52 CYS HBy A 53 THR H 1.0 0.0 4.67 176 125 A 52 CYS HBx A 53 THR H 1.0 0.0 3.91 177 126 A 53 THR HG2% A 53 THR H 1.0 0.0 3.56 178 127 A 65 SER HA A 67 LYS H 1.0 0.0 4.14 179 128 A 66 CYS HBy A 67 LYS H 1.0 0.0 5.26 180 128 A 64 CYS HBx A 67 LYS H 1.0 0.0 5.26 181 129 A 64 CYS HBy A 67 LYS H 1.0 0.0 4.04 182 130 A 67 LYS HBx A 67 LYS H 1.0 0.0 2.93 183 131 A 67 LYS HGx A 67 LYS H 1.0 0.0 3.04 184 132 A 40 ASN HD2x A 67 LYS H 1.0 0.0 5.50 185 132 A 40 ASN HD2y A 67 LYS H 1.0 0.0 5.50 186 133 A 54 GLY HAx A 41 CYS H 1.0 0.0 4.70 187 134 A 41 CYS HBx A 41 CYS H 1.0 0.0 2.87 188 135 A 39 CYS HBy A 41 CYS H 1.0 0.0 4.74 189 135 A 39 CYS HBx A 41 CYS H 1.0 0.0 4.74 190 136 A 42 THR HG2% A 41 CYS H 1.0 0.0 4.89 191 137 A 42 THR H A 41 CYS H 1.0 0.0 4.65 192 138 A 54 GLY H A 41 CYS H 1.0 0.0 4.77 193 139 A 66 CYS HA A 41 CYS H 1.0 0.0 4.68 194 140 A 41 CYS H A 40 ASN H 1.0 0.0 3.09 195 141 A 27 CYS HA A 28 GLY H 1.0 0.0 2.77 196 142 A 28 GLY H A 61 GLY HAy 1.0 0.0 5.50 197 142 A 61 GLY HAx A 28 GLY H 1.0 0.0 5.50 198 142 A 31 CYS HA A 28 GLY H 1.0 0.0 5.50 199 143 A 27 CYS HBx A 28 GLY H 1.0 0.0 3.36 200 144 A 28 GLY H A 31 CYS HBy 1.0 0.0 4.69 201 144 A 31 CYS HBx A 28 GLY H 1.0 0.0 4.69 202 145 A 9 LYS HBy A 28 GLY H 1.0 0.0 3.38 203 146 A 9 LYS HBx A 28 GLY H 1.0 0.0 4.64 204 146 A 28 GLY H A 9 LYS HDx 1.0 0.0 4.64 205 147 A 28 GLY H A 9 LYS HGx 1.0 0.0 5.48 206 147 A 9 LYS HGy A 28 GLY H 1.0 0.0 5.48 207 148 A 28 GLY H A 10 CYS H 1.0 0.0 4.58 208 149 A 20 GLN H A 16 SER HBx 1.0 0.0 4.19 209 149 A 16 SER HBy A 20 GLN H 1.0 0.0 4.19 210 150 A 21 CYS HA A 20 GLN H 1.0 0.0 4.79 211 151 A 21 CYS HBx A 20 GLN H 1.0 0.0 4.81 212 152 A 20 GLN HGx A 20 GLN H 1.0 0.0 3.52 213 153 A 20 GLN HBy A 20 GLN H 1.0 0.0 3.12 214 154 A 13 ALA HB% A 20 GLN H 1.0 0.0 3.94 215 155 A 14 CYS H A 20 GLN H 1.0 0.0 4.96 216 155 A 16 SER H A 20 GLN H 1.0 0.0 4.96 217 156 A 14 CYS HA A 20 GLN H 1.0 0.0 3.80 218 157 A 42 THR HB A 43 SER H 1.0 0.0 3.04 219 158 A 43 SER H A 43 SER HBx 1.0 0.0 3.68 220 158 A 43 SER HBy A 43 SER H 1.0 0.0 3.68 221 159 A 42 THR HG2% A 43 SER H 1.0 0.0 3.95 222 160 A 32 THR HB A 31 CYS H 1.0 0.0 5.50 223 161 A 29 GLU HBx A 31 CYS H 1.0 0.0 5.50 224 161 A 29 GLU HBy A 31 CYS H 1.0 0.0 5.50 225 162 A 31 CYS H A 30 GLY H 1.0 0.0 4.14 226 163 A 60 CYS HA A 59 LYS H 1.0 0.0 4.82 227 164 A 52 CYS HBy A 59 LYS H 1.0 0.0 3.70 228 165 A 59 LYS H A 59 LYS HBy 1.0 0.0 3.85 229 165 A 59 LYS HBx A 59 LYS H 1.0 0.0 3.85 230 166 A 59 LYS HGx A 59 LYS H 1.0 0.0 5.14 231 166 A 59 LYS H A 59 LYS HGy 1.0 0.0 5.14 232 167 A 20 GLN HA A 21 CYS H 1.0 0.0 3.50 233 168 A 58 CYS HA A 60 CYS H 1.0 0.0 4.12 234 169 A 22 GLY HAy A 21 CYS H 1.0 0.0 5.40 235 169 A 21 CYS H A 22 GLY HAx 1.0 0.0 5.40 236 170 A 36 CYS HBy A 21 CYS H 1.0 0.0 4.25 237 170 A 60 CYS HBx A 60 CYS H 1.0 0.0 4.25 238 171 A 21 CYS HBx A 21 CYS H 1.0 0.0 2.91 239 172 A 60 CYS HBy A 60 CYS H 1.0 0.0 2.90 240 173 A 59 LYS HBx A 60 CYS H 1.0 0.0 4.99 241 173 A 60 CYS H A 59 LYS HBy 1.0 0.0 4.99 242 174 A 59 LYS HBx A 60 CYS H 1.0 0.0 4.99 243 174 A 60 CYS H A 59 LYS HBy 1.0 0.0 4.99 244 174 A 20 GLN HBy A 21 CYS H 1.0 0.0 4.99 245 175 A 13 ALA HB% A 21 CYS H 1.0 0.0 3.94 246 176 A 21 CYS H A 20 GLN H 1.0 0.0 2.92 247 177 A 19 CYS H A 21 CYS H 1.0 0.0 5.50 248 177 A 24 LYS H A 21 CYS H 1.0 0.0 5.50 249 178 A 60 CYS H A 58 CYS H 1.0 0.0 5.50 250 178 A 14 CYS H A 21 CYS H 1.0 0.0 5.50 251 179 A 60 CYS H A 59 LYS H 1.0 0.0 2.87 252 180 A 43 SER HA A 45 GLY H 1.0 0.0 3.99 253 181 A 45 GLY H A 44 ASP HBy 1.0 0.0 4.25 254 182 A 45 GLY H A 44 ASP HBy 1.0 0.0 4.25 255 182 A 44 ASP HBx A 45 GLY H 1.0 0.0 4.25 256 183 A 42 THR HG2% A 45 GLY H 1.0 0.0 5.40 257 184 A 53 THR HG2% A 45 GLY H 1.0 0.0 3.67 258 185 A 42 THR H A 45 GLY H 1.0 0.0 4.01 259 186 A 51 GLU HA A 50 LYS H 1.0 0.0 4.63 260 187 A 46 CYS HBx A 50 LYS H 1.0 0.0 5.50 261 187 A 50 LYS H A 46 CYS HBy 1.0 0.0 5.50 262 188 A 48 CYS HBy A 50 LYS H 1.0 0.0 5.22 263 189 A 50 LYS HGy A 50 LYS H 1.0 0.0 3.33 264 190 A 48 CYS HA A 50 LYS H 1.0 0.0 5.37 265 191 A 16 SER HA A 15 ARG H 1.0 0.0 5.45 266 192 A 14 CYS HBy A 15 ARG H 1.0 0.0 3.14 267 193 A 15 ARG H A 15 ARG HBy 1.0 0.0 3.63 268 193 A 15 ARG HBx A 15 ARG H 1.0 0.0 3.63 269 194 A 15 ARG H A 15 ARG HGx 1.0 0.0 2.70 270 194 A 15 ARG HGy A 15 ARG H 1.0 0.0 2.70 271 195 A 13 ALA HB% A 15 ARG H 1.0 0.0 4.96 272 196 A 29 GLU HBy A 30 GLY H 1.0 0.0 5.20 273 196 A 29 GLU HBx A 30 GLY H 1.0 0.0 5.20 274 197 A 27 CYS HA A 10 CYS H 1.0 0.0 5.50 275 197 A 10 CYS H A 7 GLY HAy 1.0 0.0 5.50 276 198 A 7 GLY HAx A 10 CYS H 1.0 0.0 4.64 277 198 A 10 CYS H A 7 GLY HAy 1.0 0.0 4.64 278 198 A 8 GLU HA A 10 CYS H 1.0 0.0 4.64 279 199 A 10 CYS HBx A 10 CYS H 1.0 0.0 2.88 280 200 A 9 LYS HBy A 10 CYS H 1.0 0.0 4.54 281 201 A 9 LYS HBx A 10 CYS H 1.0 0.0 3.91 282 202 A 9 LYS HGy A 10 CYS H 1.0 0.0 5.50 283 203 A 10 CYS H A 9 LYS HGx 1.0 0.0 5.25 284 203 A 9 LYS HGy A 10 CYS H 1.0 0.0 5.25 285 204 A 10 CYS H A 9 LYS H 1.0 0.0 3.38 286 205 A 37 LYS HA A 36 CYS H 1.0 0.0 5.07 287 206 A 36 CYS HBy A 36 CYS H 1.0 0.0 3.55 288 207 A 33 CYS HBx A 36 CYS H 1.0 0.0 4.86 289 207 A 36 CYS H A 33 CYS HBy 1.0 0.0 4.86 290 208 A 35 ALA HB% A 36 CYS H 1.0 0.0 3.11 291 209 A 33 CYS H A 36 CYS H 1.0 0.0 5.50 292 209 A 36 CYS H A 34 ALA H 1.0 0.0 5.50 293 210 A 36 CYS H A 37 LYS H 1.0 0.0 2.89 294 211 A 34 ALA HA A 37 LYS H 1.0 0.0 4.16 295 212 A 37 LYS H A 33 CYS HBy 1.0 0.0 4.86 296 212 A 33 CYS HBx A 37 LYS H 1.0 0.0 4.86 297 213 A 36 CYS HBy A 37 LYS H 1.0 0.0 4.80 298 214 A 37 LYS H A 33 CYS HBy 1.0 0.0 5.50 299 214 A 33 CYS HBx A 37 LYS H 1.0 0.0 5.50 300 215 A 37 LYS H A 37 LYS HBx 1.0 0.0 3.21 301 215 A 37 LYS HBy A 37 LYS H 1.0 0.0 3.21 302 216 A 35 ALA HB% A 37 LYS H 1.0 0.0 4.92 303 216 A 34 ALA HB% A 37 LYS H 1.0 0.0 4.92 304 217 A 38 THR HG2% A 37 LYS H 1.0 0.0 5.38 305 218 A 35 ALA H A 37 LYS H 1.0 0.0 4.03 306 219 A 16 SER HA A 17 GLU H 1.0 0.0 2.75 307 220 A 18 PRO HDy A 17 GLU H 1.0 0.0 5.27 308 221 A 17 GLU HBy A 17 GLU H 1.0 0.0 3.56 309 222 A 32 THR HG2% A 32 THR H 1.0 0.0 4.04 310 223 A 28 GLY HAy A 29 GLU H 1.0 0.0 3.50 311 224 A 61 GLY HAx A 29 GLU H 1.0 0.0 5.42 312 224 A 29 GLU H A 61 GLY HAy 1.0 0.0 5.42 313 225 A 28 GLY HAx A 29 GLU H 1.0 0.0 3.00 314 226 A 29 GLU HGx A 29 GLU H 1.0 0.0 3.52 315 226 A 29 GLU H A 29 GLU HGy 1.0 0.0 3.52 316 227 A 29 GLU HBx A 29 GLU H 1.0 0.0 3.23 317 228 A 9 LYS HGy A 29 GLU H 1.0 0.0 4.82 318 228 A 29 GLU H A 9 LYS HGx 1.0 0.0 4.82 319 229 A 28 GLY H A 29 GLU H 1.0 0.0 4.56 320 230 A 37 LYS HA A 38 THR H 1.0 0.0 2.53 321 231 A 38 THR HB A 38 THR H 1.0 0.0 3.68 322 232 A 55 PRO HBx A 38 THR H 1.0 0.0 4.87 323 232 A 55 PRO HBy A 38 THR H 1.0 0.0 4.87 324 233 A 37 LYS H A 38 THR H 1.0 0.0 4.73 325 234 A 39 CYS HA A 40 ASN H 1.0 0.0 2.57 326 235 A 55 PRO HDy A 40 ASN H 1.0 0.0 5.50 327 236 A 39 CYS HBx A 40 ASN H 1.0 0.0 5.17 328 236 A 66 CYS HBy A 40 ASN H 1.0 0.0 5.17 329 236 A 39 CYS HBy A 40 ASN H 1.0 0.0 5.17 330 237 A 40 ASN HBy A 40 ASN H 1.0 0.0 2.84 331 238 A 39 CYS HBx A 40 ASN H 1.0 0.0 4.55 332 238 A 39 CYS HBy A 40 ASN H 1.0 0.0 4.55 333 239 A 67 LYS HDy A 40 ASN H 1.0 0.0 5.23 334 240 A 39 CYS H A 40 ASN H 1.0 0.0 4.55 335 241 A 40 ASN HD2x A 40 ASN H 1.0 0.0 3.87 336 241 A 40 ASN HD2y A 40 ASN H 1.0 0.0 3.87 337 242 A 40 ASN HD2x A 40 ASN H 1.0 0.0 4.35 338 242 A 40 ASN HD2y A 40 ASN H 1.0 0.0 4.35 339 243 A 54 GLY HAy A 56 ASP H 1.0 0.0 4.19 340 243 A 54 GLY HAx A 56 ASP H 1.0 0.0 4.19 341 244 A 55 PRO HDy A 56 ASP H 1.0 0.0 4.68 342 244 A 54 GLY HAy A 56 ASP H 1.0 0.0 4.68 343 245 A 56 ASP H A 56 ASP HBy 1.0 0.0 3.81 344 245 A 56 ASP HBx A 56 ASP H 1.0 0.0 3.81 345 246 A 55 PRO HBx A 56 ASP H 1.0 0.0 4.84 346 246 A 55 PRO HBy A 56 ASP H 1.0 0.0 4.84 347 246 A 39 CYS HBy A 56 ASP H 1.0 0.0 4.84 348 247 A 58 CYS H A 56 ASP H 1.0 0.0 5.11 349 248 A 40 ASN HD2y A 67 LYS HA 1.0 0.0 4.96 350 248 A 39 CYS HA A 40 ASN HD2y 1.0 0.0 4.96 351 248 A 40 ASN HD2x A 67 LYS HA 1.0 0.0 4.96 352 248 A 39 CYS HA A 40 ASN HD2x 1.0 0.0 4.96 353 249 A 40 ASN HD2x A 40 ASN HBy 1.0 0.0 3.75 354 250 A 40 ASN HD2y A 38 THR HG2% 1.0 0.0 5.30 355 250 A 40 ASN HD2x A 38 THR HG2% 1.0 0.0 5.30 356 251 A 18 PRO HDy A 20 GLN HE2y 1.0 0.0 5.21 357 251 A 18 PRO HDy A 20 GLN HE2x 1.0 0.0 5.21 358 252 A 9 LYS H A 7 GLY HAy 1.0 0.0 4.94 359 253 A 7 GLY HAx A 9 LYS H 1.0 0.0 4.65 360 253 A 9 LYS H A 7 GLY HAy 1.0 0.0 4.65 361 254 A 10 CYS HBx A 9 LYS H 1.0 0.0 4.96 362 255 A 9 LYS HBy A 9 LYS H 1.0 0.0 4.23 363 255 A 9 LYS H A 8 GLU HBx 1.0 0.0 4.23 364 255 A 8 GLU HBy A 9 LYS H 1.0 0.0 4.23 365 256 A 9 LYS HBx A 9 LYS H 1.0 0.0 3.43 366 257 A 9 LYS H A 9 LYS HGx 1.0 0.0 4.36 367 257 A 9 LYS HGy A 9 LYS H 1.0 0.0 4.36 368 258 A 34 ALA H A 33 CYS HBy 1.0 0.0 4.84 369 258 A 33 CYS HBx A 34 ALA H 1.0 0.0 4.84 370 259 A 33 CYS HBx A 34 ALA H 1.0 0.0 4.84 371 259 A 34 ALA H A 33 CYS HBy 1.0 0.0 4.84 372 260 A 34 ALA HB% A 34 ALA H 1.0 0.0 2.92 373 261 A 64 CYS HA A 66 CYS H 1.0 0.0 4.38 374 261 A 66 CYS HBx A 66 CYS H 1.0 0.0 4.38 375 262 A 66 CYS H A 65 SER HBx 1.0 0.0 4.65 376 262 A 65 SER HBy A 66 CYS H 1.0 0.0 4.65 377 263 A 48 CYS HBx A 66 CYS H 1.0 0.0 4.43 378 264 A 66 CYS HBy A 66 CYS H 1.0 0.0 3.16 379 265 A 64 CYS HBy A 66 CYS H 1.0 0.0 3.29 380 266 A 48 CYS HBy A 66 CYS H 1.0 0.0 5.24 381 266 A 67 LYS HEy A 66 CYS H 1.0 0.0 5.24 382 267 A 67 LYS HBx A 66 CYS H 1.0 0.0 5.07 383 268 A 67 LYS HGy A 66 CYS H 1.0 0.0 5.50 384 269 A 67 LYS HGx A 66 CYS H 1.0 0.0 4.07 385 270 A 67 LYS H A 66 CYS H 1.0 0.0 3.04 386 271 A 48 CYS HA A 66 CYS H 1.0 0.0 5.38 387 272 A 62 SER H A 61 GLY HAy 1.0 0.0 3.24 388 272 A 61 GLY HAx A 62 SER H 1.0 0.0 3.24 389 273 A 62 SER HBx A 62 SER H 1.0 0.0 4.07 390 273 A 62 SER H A 62 SER HBy 1.0 0.0 4.07 391 273 A 62 SER HA A 62 SER H 1.0 0.0 4.07 392 274 A 61 GLY H A 62 SER H 1.0 0.0 4.87 393 275 A 58 CYS H A 57 SER HBx 1.0 0.0 4.73 394 275 A 57 SER HBy A 58 CYS H 1.0 0.0 4.73 395 276 A 55 PRO HA A 58 CYS H 1.0 0.0 3.68 396 277 A 58 CYS H A 57 SER HBx 1.0 0.0 5.18 397 277 A 57 SER HBy A 58 CYS H 1.0 0.0 5.18 398 277 A 52 CYS HBy A 58 CYS H 1.0 0.0 5.18 399 278 A 58 CYS H A 58 CYS HBx 1.0 0.0 3.19 400 278 A 58 CYS HBy A 58 CYS H 1.0 0.0 3.19 401 279 A 56 ASP HBx A 58 CYS H 1.0 0.0 5.50 402 279 A 58 CYS H A 56 ASP HBy 1.0 0.0 5.50 403 280 A 55 PRO HBx A 58 CYS H 1.0 0.0 5.50 404 280 A 55 PRO HBy A 58 CYS H 1.0 0.0 5.50 405 280 A 39 CYS HBx A 58 CYS H 1.0 0.0 5.50 406 280 A 39 CYS HBy A 58 CYS H 1.0 0.0 5.50 407 281 A 37 LYS HGy A 58 CYS H 1.0 0.0 5.50 408 281 A 58 CYS H A 59 LYS HGy 1.0 0.0 5.50 409 281 A 59 LYS HGx A 58 CYS H 1.0 0.0 5.50 410 281 A 58 CYS H A 37 LYS HGx 1.0 0.0 5.50 411 282 A 58 CYS H A 59 LYS H 1.0 0.0 4.69 412 283 A 47 LYS HA A 49 GLY H 1.0 0.0 4.54 413 284 A 46 CYS HBx A 49 GLY H 1.0 0.0 4.99 414 284 A 49 GLY H A 46 CYS HBy 1.0 0.0 4.99 415 285 A 48 CYS HBy A 49 GLY H 1.0 0.0 4.87 416 286 A 47 LYS HBx A 49 GLY H 1.0 0.0 4.91 417 286 A 50 LYS HBx A 49 GLY H 1.0 0.0 4.91 418 287 A 50 LYS HGy A 49 GLY H 1.0 0.0 5.50 419 287 A 50 LYS HGx A 49 GLY H 1.0 0.0 5.50 420 288 A 50 LYS H A 49 GLY H 1.0 0.0 3.12 421 289 A 47 LYS H A 49 GLY H 1.0 0.0 4.35 422 290 A 48 CYS H A 49 GLY H 1.0 0.0 2.81 423 291 A 49 GLY H A 51 GLU H 1.0 0.0 5.27 424 292 A 58 CYS HA A 52 CYS H 1.0 0.0 5.40 425 293 A 51 GLU HA A 52 CYS H 1.0 0.0 3.19 426 294 A 52 CYS HBy A 52 CYS H 1.0 0.0 3.70 427 295 A 52 CYS HBx A 52 CYS H 1.0 0.0 3.72 428 296 A 52 CYS H A 51 GLU HBy 1.0 0.0 5.13 429 296 A 51 GLU HBx A 52 CYS H 1.0 0.0 5.13 430 297 A 52 CYS H A 51 GLU HGy 1.0 0.0 5.50 431 297 A 52 CYS H A 51 GLU HBy 1.0 0.0 5.50 432 297 A 51 GLU HBx A 52 CYS H 1.0 0.0 5.50 433 297 A 51 GLU HGx A 52 CYS H 1.0 0.0 5.50 434 298 A 50 LYS HBx A 52 CYS H 1.0 0.0 4.68 435 298 A 50 LYS HBy A 52 CYS H 1.0 0.0 4.68 436 299 A 50 LYS HGx A 52 CYS H 1.0 0.0 5.50 437 299 A 50 LYS HGy A 52 CYS H 1.0 0.0 5.50 438 300 A 53 THR HG2% A 52 CYS H 1.0 0.0 5.17 439 301 A 51 GLU H A 52 CYS H 1.0 0.0 3.49 440 302 A 62 SER HA A 64 CYS H 1.0 0.0 4.10 441 303 A 63 SER HBx A 64 CYS H 1.0 0.0 4.93 442 303 A 64 CYS H A 63 SER HBy 1.0 0.0 4.93 443 304 A 64 CYS HBx A 64 CYS H 1.0 0.0 2.81 444 305 A 64 CYS HBy A 64 CYS H 1.0 0.0 3.16 445 306 A 67 LYS HBx A 64 CYS H 1.0 0.0 4.29 446 307 A 67 LYS HGy A 64 CYS H 1.0 0.0 3.56 447 308 A 67 LYS HGx A 64 CYS H 1.0 0.0 3.78 448 309 A 67 LYS H A 64 CYS H 1.0 0.0 4.80 449 310 A 64 CYS H A 65 SER H 1.0 0.0 4.77 450 311 A 64 CYS H A 63 SER H 1.0 0.0 3.88 451 312 A 50 LYS HA A 51 GLU H 1.0 0.0 3.53 452 313 A 49 GLY HAx A 51 GLU H 1.0 0.0 4.92 453 313 A 51 GLU H A 49 GLY HAy 1.0 0.0 4.92 454 314 A 51 GLU HA A 51 GLU H 1.0 0.0 2.91 455 315 A 49 GLY HAx A 51 GLU H 1.0 0.0 5.00 456 315 A 51 GLU H A 49 GLY HAy 1.0 0.0 5.00 457 316 A 51 GLU H A 46 CYS HBy 1.0 0.0 4.65 458 316 A 46 CYS HBx A 51 GLU H 1.0 0.0 4.65 459 317 A 51 GLU H A 51 GLU HBy 1.0 0.0 3.77 460 317 A 51 GLU HBx A 51 GLU H 1.0 0.0 3.77 461 318 A 51 GLU HGx A 51 GLU H 1.0 0.0 4.32 462 318 A 51 GLU H A 51 GLU HGy 1.0 0.0 4.32 463 319 A 50 LYS HGy A 51 GLU H 1.0 0.0 4.90 464 320 A 50 LYS H A 51 GLU H 1.0 0.0 3.57 465 321 A 48 CYS H A 51 GLU H 1.0 0.0 5.50 466 322 A 42 THR HB A 42 THR H 1.0 0.0 4.68 467 322 A 46 CYS HA A 42 THR H 1.0 0.0 4.68 468 323 A 41 CYS HA A 42 THR H 1.0 0.0 2.76 469 324 A 53 THR HA A 42 THR H 1.0 0.0 4.08 470 325 A 41 CYS HBy A 42 THR H 1.0 0.0 3.13 471 326 A 41 CYS HBx A 42 THR H 1.0 0.0 4.00 472 327 A 42 THR HG2% A 42 THR H 1.0 0.0 3.31 473 328 A 53 THR HG2% A 42 THR H 1.0 0.0 4.91 474 329 A 47 LYS H A 42 THR H 1.0 0.0 5.50 475 330 A 41 CYS HBx A 47 LYS H 1.0 0.0 4.74 476 331 A 47 LYS H A 46 CYS HBy 1.0 0.0 4.33 477 331 A 46 CYS HBx A 47 LYS H 1.0 0.0 4.33 478 332 A 47 LYS HBx A 47 LYS H 1.0 0.0 3.19 479 333 A 47 LYS H A 47 LYS HGy 1.0 0.0 3.95 480 333 A 47 LYS HGx A 47 LYS H 1.0 0.0 3.95 481 334 A 10 CYS HBx A 7 GLY H 1.0 0.0 4.85 482 335 A 7 GLY H A 6 LYS HBx 1.0 0.0 4.64 483 335 A 6 LYS HBy A 7 GLY H 1.0 0.0 4.64 484 336 A 64 CYS HA A 65 SER H 1.0 0.0 2.73 485 337 A 65 SER H A 65 SER HBx 1.0 0.0 3.94 486 337 A 65 SER HBy A 65 SER H 1.0 0.0 3.94 487 338 A 48 CYS HBx A 65 SER H 1.0 0.0 4.24 488 339 A 64 CYS HBx A 65 SER H 1.0 0.0 4.14 489 340 A 64 CYS HBy A 65 SER H 1.0 0.0 3.99 490 341 A 48 CYS HBy A 65 SER H 1.0 0.0 5.50 491 342 A 66 CYS H A 65 SER H 1.0 0.0 3.17 492 343 A 67 LYS H A 65 SER H 1.0 0.0 4.66 493 344 A 66 CYS HA A 65 SER H 1.0 0.0 5.33 494 345 A 27 CYS HBy A 11 THR HG2% 1.0 0.0 4.89 495 346 A 27 CYS HBy A 10 CYS HA 1.0 0.0 4.59 496 347 A 36 CYS HBx A 25 CYS HBy 1.0 0.0 4.05 497 347 A 25 CYS HBx A 36 CYS HBx 1.0 0.0 4.05 498 348 A 36 CYS HA A 25 CYS HBy 1.0 0.0 5.50 499 348 A 25 CYS HBx A 36 CYS HA 1.0 0.0 5.50 500 349 A 15 ARG HA A 15 ARG HGx 1.0 0.0 3.55 501 349 A 15 ARG HGy A 15 ARG HA 1.0 0.0 3.55 502 350 A 47 LYS H A 47 LYS HDy 1.0 0.0 5.50 503 350 A 47 LYS H A 47 LYS HDx 1.0 0.0 5.50 504 351 A 61 GLY HAx A 29 GLU H 1.0 0.0 5.42 505 351 A 29 GLU H A 61 GLY HAy 1.0 0.0 5.42 506 352 A 56 ASP HBx A 57 SER HA 1.0 0.0 5.50 507 352 A 57 SER HA A 56 ASP HBy 1.0 0.0 5.50 508 352 A 56 ASP HBx A 54 GLY HAx 1.0 0.0 5.50 509 353 A 42 THR HB A 42 THR HA 1.0 0.0 2.73 510 354 A 41 CYS HA A 42 THR HA 1.0 0.0 5.14 511 354 A 53 THR HB A 42 THR HA 1.0 0.0 5.14 512 355 A 53 THR HA A 42 THR HA 1.0 0.0 4.75 513 356 A 54 GLY HAx A 42 THR HA 1.0 0.0 4.69 514 356 A 54 GLY HAy A 42 THR HA 1.0 0.0 4.69 515 357 A 42 THR HG2% A 42 THR HA 1.0 0.0 2.91 516 358 A 53 THR HG2% A 42 THR HA 1.0 0.0 5.50 517 359 A 42 THR HA A 43 SER H 1.0 0.0 3.31 518 360 A 42 THR HA A 44 ASP H 1.0 0.0 5.18 519 361 A 42 THR HA A 45 GLY H 1.0 0.0 5.50 520 362 A 42 THR HA A 54 GLY H 1.0 0.0 5.50 521 363 A 45 GLY HAx A 44 ASP HBy 1.0 0.0 5.50 522 363 A 46 CYS HBx A 45 GLY HAy 1.0 0.0 5.50 523 363 A 45 GLY HAx A 44 ASP HBx 1.0 0.0 5.50 524 363 A 45 GLY HAx A 46 CYS HBy 1.0 0.0 5.50 525 363 A 45 GLY HAy A 46 CYS HBy 1.0 0.0 5.50 526 364 A 53 THR HG2% A 45 GLY HAy 1.0 0.0 4.40 527 364 A 53 THR HG2% A 45 GLY HAx 1.0 0.0 4.40 528 365 A 9 LYS HBx A 8 GLU HA 1.0 0.0 5.50 529 366 A 8 GLU HA A 9 LYS HA 1.0 0.0 5.09 530 367 A 38 THR HA A 55 PRO HGx 1.0 0.0 4.64 531 367 A 38 THR HA A 55 PRO HGy 1.0 0.0 4.64 532 368 A 39 CYS HBy A 55 PRO HGx 1.0 0.0 5.50 533 368 A 39 CYS HBx A 55 PRO HGx 1.0 0.0 5.50 534 368 A 39 CYS HBx A 55 PRO HGy 1.0 0.0 5.50 535 368 A 39 CYS HBy A 55 PRO HGy 1.0 0.0 5.50 536 369 A 55 PRO HGx A 39 CYS H 1.0 0.0 5.40 537 369 A 55 PRO HGy A 39 CYS H 1.0 0.0 5.40 538 370 A 28 GLY HAy A 29 GLU HGy 1.0 0.0 5.20 539 370 A 28 GLY HAy A 29 GLU HGx 1.0 0.0 5.20 540 371 A 29 GLU HGx A 30 GLY HAx 1.0 0.0 5.50 541 371 A 30 GLY HAx A 29 GLU HGy 1.0 0.0 5.50 542 371 A 28 GLY HAx A 29 GLU HGy 1.0 0.0 5.50 543 371 A 28 GLY HAx A 29 GLU HGx 1.0 0.0 5.50 544 371 A 29 GLU HGx A 30 GLY HAy 1.0 0.0 5.50 545 372 A 29 GLU HGx A 30 GLY H 1.0 0.0 5.50 546 372 A 30 GLY H A 29 GLU HGy 1.0 0.0 5.50 547 373 A 60 CYS H A 59 LYS HGy 1.0 0.0 5.50 548 373 A 59 LYS HGx A 60 CYS H 1.0 0.0 5.50 549 374 A 39 CYS HBy A 55 PRO HGx 1.0 0.0 5.50 550 374 A 39 CYS HBx A 55 PRO HGy 1.0 0.0 5.50 551 374 A 39 CYS HBx A 55 PRO HGx 1.0 0.0 5.50 552 374 A 39 CYS HBy A 55 PRO HGy 1.0 0.0 5.50 553 375 A 55 PRO HGx A 39 CYS H 1.0 0.0 5.39 554 375 A 55 PRO HGy A 39 CYS H 1.0 0.0 5.39 555 376 A 39 CYS HA A 67 LYS HDy 1.0 0.0 4.54 556 377 A 39 CYS HA A 67 LYS HDx 1.0 0.0 5.50 557 378 A 39 CYS HA A 38 THR HG2% 1.0 0.0 4.63 558 379 A 39 CYS HA A 41 CYS H 1.0 0.0 4.50 559 380 A 60 CYS HA A 61 GLY H 1.0 0.0 2.89 560 381 A 10 CYS HBy A 15 ARG HGx 1.0 0.0 4.33 561 381 A 15 ARG HGy A 10 CYS HBy 1.0 0.0 4.33 562 382 A 13 ALA HB% A 20 GLN HA 1.0 0.0 4.60 563 383 A 13 ALA HB% A 21 CYS HA 1.0 0.0 3.25 564 384 A 14 CYS HBy A 13 ALA HB% 1.0 0.0 5.18 565 385 A 13 ALA HB% A 21 CYS HBy 1.0 0.0 5.05 566 385 A 13 ALA HB% A 14 CYS HBx 1.0 0.0 5.05 567 386 A 13 ALA HB% A 20 GLN HBx 1.0 0.0 3.60 568 387 A 20 GLN HBy A 13 ALA HB% 1.0 0.0 3.08 569 388 A 13 ALA HB% A 14 CYS HA 1.0 0.0 4.08 570 389 A 42 THR HB A 43 SER HBy 1.0 0.0 5.06 571 389 A 42 THR HB A 43 SER HBx 1.0 0.0 5.06 572 390 A 20 GLN HBy A 19 CYS HA 1.0 0.0 4.96 573 391 A 35 ALA HB% A 19 CYS HA 1.0 0.0 4.66 574 392 A 19 CYS HA A 20 GLN H 1.0 0.0 2.58 575 393 A 19 CYS HA A 16 SER H 1.0 0.0 4.72 576 394 A 14 CYS HA A 19 CYS HA 1.0 0.0 3.56 577 395 A 28 GLY HAy A 62 SER HBy 1.0 0.0 5.50 578 395 A 28 GLY HAy A 62 SER HBx 1.0 0.0 5.50 579 395 A 28 GLY HAy A 29 GLU HA 1.0 0.0 5.50 580 396 A 27 CYS HBx A 28 GLY HAy 1.0 0.0 5.50 581 397 A 9 LYS HBy A 28 GLY HAy 1.0 0.0 4.02 582 398 A 60 CYS HBx A 67 LYS HDy 1.0 0.0 5.50 583 398 A 39 CYS HBx A 67 LYS HDy 1.0 0.0 5.50 584 399 A 60 CYS HBx A 64 CYS H 1.0 0.0 5.50 585 400 A 35 ALA HB% A 36 CYS HBx 1.0 0.0 4.93 586 401 A 19 CYS HBx A 35 ALA HB% 1.0 0.0 2.96 587 402 A 19 CYS HBy A 35 ALA HB% 1.0 0.0 2.93 588 403 A 27 CYS HA A 28 GLY HAx 1.0 0.0 4.78 589 404 A 27 CYS HA A 9 LYS HBy 1.0 0.0 4.61 590 405 A 11 THR HG2% A 27 CYS HA 1.0 0.0 3.23 591 406 A 28 GLY HAx A 9 LYS HGx 1.0 0.0 5.09 592 406 A 9 LYS HGy A 28 GLY HAx 1.0 0.0 5.09 593 407 A 8 GLU HGx A 9 LYS HGx 1.0 0.0 5.50 594 407 A 29 GLU HGx A 9 LYS HGx 1.0 0.0 5.50 595 407 A 8 GLU HGy A 9 LYS HGx 1.0 0.0 5.50 596 407 A 9 LYS HGx A 29 GLU HGy 1.0 0.0 5.50 597 408 A 9 LYS H A 9 LYS HGx 1.0 0.0 4.44 598 409 A 21 CYS HBy A 25 CYS HA 1.0 0.0 2.92 599 410 A 48 CYS HBy A 64 CYS HA 1.0 0.0 5.50 600 410 A 26 GLN HBx A 25 CYS HA 1.0 0.0 5.50 601 411 A 26 GLN HBy A 25 CYS HA 1.0 0.0 4.39 602 412 A 25 CYS HA A 26 GLN H 1.0 0.0 2.74 603 413 A 31 CYS HA A 31 CYS HBy 1.0 0.0 2.82 604 413 A 31 CYS HA A 31 CYS HBx 1.0 0.0 2.82 605 414 A 31 CYS HA A 32 THR HG2% 1.0 0.0 4.23 606 415 A 31 CYS HA A 30 GLY HAx 1.0 0.0 5.31 607 415 A 31 CYS HA A 7 GLY HAy 1.0 0.0 5.31 608 415 A 31 CYS HA A 30 GLY HAy 1.0 0.0 5.31 609 416 A 31 CYS HA A 32 THR H 1.0 0.0 3.55 610 417 A 39 CYS HBx A 52 CYS HBx 1.0 0.0 5.50 611 417 A 39 CYS HBy A 52 CYS HBx 1.0 0.0 5.50 612 418 A 66 CYS HBy A 65 SER HBx 1.0 0.0 5.27 613 418 A 66 CYS HBy A 65 SER HBy 1.0 0.0 5.27 614 418 A 53 THR HA A 52 CYS HBx 1.0 0.0 5.27 615 419 A 66 CYS HBy A 40 ASN H 1.0 0.0 4.92 616 419 A 52 CYS HBx A 59 LYS H 1.0 0.0 4.92 617 420 A 37 LYS HGy A 37 LYS H 1.0 0.0 4.88 618 420 A 37 LYS H A 37 LYS HGx 1.0 0.0 4.88 619 421 A 20 GLN HBy A 13 ALA HA 1.0 0.0 3.02 620 422 A 13 ALA HA A 20 GLN H 1.0 0.0 4.74 621 423 A 13 ALA HA A 15 ARG H 1.0 0.0 5.50 622 424 A 13 ALA HA A 16 SER H 1.0 0.0 4.43 623 425 A 14 CYS HA A 13 ALA HA 1.0 0.0 5.01 624 426 A 64 CYS HBx A 63 SER HA 1.0 0.0 5.50 625 427 A 23 SER HA A 24 LYS HBx 1.0 0.0 5.50 626 427 A 24 LYS HBy A 23 SER HA 1.0 0.0 5.50 627 427 A 67 LYS HGy A 63 SER HA 1.0 0.0 5.50 628 428 A 52 CYS HBy A 58 CYS HBx 1.0 0.0 4.75 629 428 A 58 CYS HBy A 52 CYS HBy 1.0 0.0 4.75 630 429 A 59 LYS H A 58 CYS HBx 1.0 0.0 5.00 631 429 A 58 CYS HBy A 59 LYS H 1.0 0.0 5.00 632 430 A 39 CYS H A 58 CYS HBx 1.0 0.0 5.50 633 430 A 52 CYS H A 58 CYS HBx 1.0 0.0 5.50 634 430 A 10 CYS HBx A 6 LYS H 1.0 0.0 5.50 635 430 A 58 CYS HBy A 39 CYS H 1.0 0.0 5.50 636 431 A 37 LYS H A 37 LYS HGx 1.0 0.0 4.99 637 431 A 37 LYS HGy A 37 LYS H 1.0 0.0 4.99 638 432 A 19 CYS HBx A 18 PRO HA 1.0 0.0 4.73 639 433 A 19 CYS HBy A 18 PRO HA 1.0 0.0 5.50 640 434 A 18 PRO HA A 17 GLU HBx 1.0 0.0 3.52 641 435 A 18 PRO HA A 19 CYS H 1.0 0.0 2.81 642 436 A 52 CYS HBy A 54 GLY H 1.0 0.0 5.50 643 437 A 34 ALA HB% A 35 ALA H 1.0 0.0 3.73 644 438 A 34 ALA HB% A 37 LYS H 1.0 0.0 5.50 645 439 A 39 CYS HBx A 54 GLY HAy 1.0 0.0 5.09 646 439 A 39 CYS HBy A 54 GLY HAx 1.0 0.0 5.09 647 439 A 39 CYS HBx A 54 GLY HAx 1.0 0.0 5.09 648 440 A 54 GLY HAy A 55 PRO HGy 1.0 0.0 5.50 649 440 A 55 PRO HBy A 54 GLY HAx 1.0 0.0 5.50 650 440 A 54 GLY HAx A 55 PRO HGy 1.0 0.0 5.50 651 440 A 54 GLY HAx A 55 PRO HGx 1.0 0.0 5.50 652 441 A 39 CYS HBy A 54 GLY HAy 1.0 0.0 4.02 653 441 A 39 CYS HBx A 54 GLY HAx 1.0 0.0 4.02 654 441 A 39 CYS HBy A 54 GLY HAx 1.0 0.0 4.02 655 442 A 21 CYS HBx A 25 CYS HA 1.0 0.0 4.39 656 443 A 21 CYS HBx A 36 CYS HA 1.0 0.0 4.64 657 444 A 26 GLN HBx A 11 THR HA 1.0 0.0 5.50 658 445 A 65 SER HA A 67 LYS HBx 1.0 0.0 5.50 659 446 A 26 GLN HBy A 11 THR HA 1.0 0.0 5.50 660 447 A 11 THR HG2% A 11 THR HA 1.0 0.0 2.80 661 448 A 66 CYS HA A 65 SER HA 1.0 0.0 4.73 662 449 A 16 SER HA A 16 SER HBx 1.0 0.0 2.78 663 449 A 16 SER HBy A 16 SER HA 1.0 0.0 2.78 664 450 A 20 GLN HGy A 16 SER HA 1.0 0.0 5.44 665 451 A 16 SER HA A 17 GLU HGx 1.0 0.0 4.56 666 452 A 16 SER HA A 17 GLU HBy 1.0 0.0 4.69 667 453 A 15 ARG HBx A 16 SER HA 1.0 0.0 5.31 668 454 A 13 ALA HB% A 12 SER HBx 1.0 0.0 5.50 669 454 A 11 THR HG2% A 12 SER HBy 1.0 0.0 5.50 670 454 A 13 ALA HB% A 12 SER HBy 1.0 0.0 5.50 671 454 A 11 THR HG2% A 12 SER HBx 1.0 0.0 5.50 672 455 A 37 LYS HA A 37 LYS HGy 1.0 0.0 4.01 673 455 A 37 LYS HA A 37 LYS HGx 1.0 0.0 4.01 674 456 A 37 LYS HA A 37 LYS HGx 1.0 0.0 4.01 675 456 A 37 LYS HA A 37 LYS HGy 1.0 0.0 4.01 676 457 A 38 THR HG2% A 37 LYS HA 1.0 0.0 5.40 677 458 A 36 CYS HA A 37 LYS HA 1.0 0.0 5.15 678 459 A 20 GLN HGy A 20 GLN HBy 1.0 0.0 2.96 679 460 A 20 GLN HGy A 13 ALA HB% 1.0 0.0 4.95 680 461 A 20 GLN HGy A 20 GLN HA 1.0 0.0 4.03 681 462 A 20 GLN HGy A 20 GLN H 1.0 0.0 4.54 682 463 A 67 LYS HGy A 62 SER HBy 1.0 0.0 5.50 683 463 A 67 LYS HGy A 62 SER HBx 1.0 0.0 5.50 684 464 A 62 SER HBx A 62 SER H 1.0 0.0 4.19 685 464 A 62 SER H A 62 SER HBy 1.0 0.0 4.19 686 465 A 36 CYS HA A 36 CYS HBx 1.0 0.0 2.81 687 466 A 36 CYS HA A 36 CYS HBy 1.0 0.0 2.73 688 467 A 35 ALA HB% A 36 CYS HA 1.0 0.0 4.31 689 468 A 21 CYS HBx A 36 CYS HBy 1.0 0.0 3.47 690 469 A 36 CYS HBy A 33 CYS HBy 1.0 0.0 5.50 691 469 A 33 CYS HBx A 36 CYS HBy 1.0 0.0 5.50 692 470 A 35 ALA HB% A 36 CYS HBy 1.0 0.0 4.48 693 471 A 36 CYS HBy A 21 CYS H 1.0 0.0 5.09 694 472 A 42 THR HG2% A 40 ASN HBx 1.0 0.0 5.50 695 473 A 40 ASN HBy A 67 LYS HA 1.0 0.0 5.50 696 473 A 39 CYS HA A 40 ASN HBy 1.0 0.0 5.50 697 474 A 40 ASN HBy A 41 CYS H 1.0 0.0 5.04 698 474 A 40 ASN HBx A 41 CYS H 1.0 0.0 5.04 699 475 A 40 ASN HD2x A 40 ASN HBy 1.0 0.0 3.73 700 475 A 40 ASN HD2y A 40 ASN HBy 1.0 0.0 3.73 701 476 A 67 LYS HBx A 62 SER HA 1.0 0.0 4.40 702 477 A 10 CYS HBx A 6 LYS HBx 1.0 0.0 5.36 703 477 A 10 CYS HBx A 6 LYS HBy 1.0 0.0 5.36 704 477 A 64 CYS HBy A 67 LYS HBx 1.0 0.0 5.36 705 478 A 67 LYS HBx A 67 LYS HEy 1.0 0.0 5.33 706 478 A 67 LYS HBx A 67 LYS HEx 1.0 0.0 5.33 707 479 A 67 LYS HA A 67 LYS HDx 1.0 0.0 3.39 708 480 A 60 CYS HBx A 67 LYS HDx 1.0 0.0 5.50 709 480 A 39 CYS HBx A 67 LYS HDx 1.0 0.0 5.50 710 480 A 64 CYS HBx A 67 LYS HDx 1.0 0.0 5.50 711 481 A 64 CYS HBy A 67 LYS HDx 1.0 0.0 5.50 712 482 A 67 LYS HDx A 67 LYS H 1.0 0.0 5.04 713 483 A 41 CYS HBy A 47 LYS HGy 1.0 0.0 5.50 714 483 A 41 CYS HBy A 47 LYS HGx 1.0 0.0 5.50 715 484 A 42 THR HG2% A 41 CYS HBy 1.0 0.0 5.31 716 485 A 53 THR HA A 41 CYS HBy 1.0 0.0 3.13 717 486 A 41 CYS HBy A 47 LYS H 1.0 0.0 3.74 718 487 A 41 CYS HBy A 54 GLY H 1.0 0.0 4.77 719 488 A 48 CYS HBy A 66 CYS HBx 1.0 0.0 4.01 720 489 A 66 CYS HBx A 40 ASN H 1.0 0.0 3.44 721 490 A 66 CYS HBx A 67 LYS H 1.0 0.0 4.80 722 491 A 20 GLN HGy A 16 SER HBx 1.0 0.0 4.06 723 491 A 20 GLN HGx A 16 SER HBx 1.0 0.0 4.06 724 491 A 16 SER HBy A 20 GLN HGy 1.0 0.0 4.06 725 491 A 16 SER HBy A 20 GLN HGx 1.0 0.0 4.06 726 492 A 16 SER HBy A 20 GLN HBy 1.0 0.0 4.83 727 492 A 20 GLN HBy A 16 SER HBx 1.0 0.0 4.83 728 493 A 20 GLN H A 16 SER HBx 1.0 0.0 4.71 729 493 A 16 SER HBy A 20 GLN H 1.0 0.0 4.71 730 494 A 16 SER H A 16 SER HBx 1.0 0.0 3.63 731 494 A 16 SER HBy A 16 SER H 1.0 0.0 3.63 732 495 A 16 SER HBy A 20 GLN HE2y 1.0 0.0 5.50 733 495 A 16 SER HBy A 20 GLN HE2x 1.0 0.0 5.50 734 495 A 20 GLN HE2x A 16 SER HBx 1.0 0.0 5.50 735 496 A 43 SER H A 43 SER HBx 1.0 0.0 3.68 736 497 A 64 CYS H A 67 LYS HEx 1.0 0.0 5.47 737 497 A 67 LYS HEy A 64 CYS H 1.0 0.0 5.47 738 498 A 45 GLY HAy A 46 CYS HBy 1.0 0.0 5.50 739 498 A 46 CYS HBx A 45 GLY HAx 1.0 0.0 5.50 740 498 A 44 ASP HBy A 45 GLY HAy 1.0 0.0 5.50 741 498 A 45 GLY HAx A 44 ASP HBy 1.0 0.0 5.50 742 498 A 45 GLY HAx A 44 ASP HBx 1.0 0.0 5.50 743 498 A 44 ASP HBx A 45 GLY HAy 1.0 0.0 5.50 744 499 A 29 GLU HGx A 30 GLY HAx 1.0 0.0 5.50 745 499 A 29 GLU HGy A 30 GLY HAy 1.0 0.0 5.50 746 499 A 30 GLY HAx A 29 GLU HGy 1.0 0.0 5.50 747 499 A 29 GLU HGx A 30 GLY HAy 1.0 0.0 5.50 748 500 A 29 GLU HBy A 30 GLY HAx 1.0 0.0 5.50 749 500 A 29 GLU HBy A 30 GLY HAy 1.0 0.0 5.50 750 501 A 53 THR HG2% A 45 GLY HAy 1.0 0.0 4.30 751 501 A 53 THR HG2% A 45 GLY HAx 1.0 0.0 4.30 752 502 A 32 THR HB A 30 GLY HAx 1.0 0.0 5.47 753 502 A 45 GLY HAx A 44 ASP HA 1.0 0.0 5.47 754 502 A 32 THR HB A 30 GLY HAy 1.0 0.0 5.47 755 502 A 44 ASP HA A 45 GLY HAy 1.0 0.0 5.47 756 503 A 29 GLU H A 30 GLY HAy 1.0 0.0 5.50 757 503 A 30 GLY HAx A 29 GLU H 1.0 0.0 5.50 758 504 A 52 CYS HBx A 57 SER HBx 1.0 0.0 5.28 759 504 A 57 SER HBy A 52 CYS HBx 1.0 0.0 5.28 760 505 A 57 SER HBy A 56 ASP HBy 1.0 0.0 5.50 761 505 A 56 ASP HBx A 57 SER HBx 1.0 0.0 5.50 762 505 A 57 SER HBy A 56 ASP HBx 1.0 0.0 5.50 763 505 A 56 ASP HBy A 57 SER HBx 1.0 0.0 5.50 764 506 A 57 SER HBy A 53 THR H 1.0 0.0 5.50 765 506 A 53 THR H A 57 SER HBx 1.0 0.0 5.50 766 507 A 8 GLU HBy A 9 LYS H 1.0 0.0 4.99 767 507 A 9 LYS H A 8 GLU HBx 1.0 0.0 4.99 768 508 A 39 CYS HBy A 58 CYS HBy 1.0 0.0 5.42 769 508 A 55 PRO HBy A 58 CYS HBy 1.0 0.0 5.42 770 508 A 55 PRO HBy A 58 CYS HBx 1.0 0.0 5.42 771 508 A 58 CYS HBy A 55 PRO HBx 1.0 0.0 5.42 772 508 A 39 CYS HBx A 58 CYS HBx 1.0 0.0 5.42 773 509 A 59 LYS H A 58 CYS HBx 1.0 0.0 5.00 774 509 A 58 CYS HBy A 59 LYS H 1.0 0.0 5.00 775 510 A 47 LYS HA A 47 LYS HGy 1.0 0.0 4.21 776 510 A 46 CYS HA A 47 LYS HGy 1.0 0.0 4.21 777 510 A 47 LYS HA A 47 LYS HGx 1.0 0.0 4.21 778 511 A 53 THR HG2% A 46 CYS HA 1.0 0.0 3.80 779 512 A 53 THR HA A 53 THR HG2% 1.0 0.0 2.72 780 513 A 53 THR HG2% A 54 GLY HAy 1.0 0.0 5.50 781 514 A 53 THR HG2% A 41 CYS HBy 1.0 0.0 4.32 782 515 A 53 THR HG2% A 46 CYS HBy 1.0 0.0 3.36 783 515 A 46 CYS HBx A 53 THR HG2% 1.0 0.0 3.36 784 516 A 31 CYS HBx A 32 THR HG2% 1.0 0.0 5.50 785 516 A 32 THR HG2% A 31 CYS HBy 1.0 0.0 5.50 786 517 A 53 THR HG2% A 41 CYS HBx 1.0 0.0 4.72 787 518 A 53 THR HA A 41 CYS HBx 1.0 0.0 3.12 788 519 A 30 GLY HAx A 31 CYS HBy 1.0 0.0 5.50 789 519 A 30 GLY HAy A 31 CYS HBy 1.0 0.0 5.50 790 519 A 31 CYS HBx A 30 GLY HAx 1.0 0.0 5.50 791 519 A 31 CYS HBx A 30 GLY HAy 1.0 0.0 5.50 792 519 A 31 CYS HBx A 28 GLY HAx 1.0 0.0 5.50 793 519 A 28 GLY HAx A 31 CYS HBy 1.0 0.0 5.50 794 520 A 41 CYS HBx A 40 ASN H 1.0 0.0 5.50 795 521 A 31 CYS HBx A 38 THR H 1.0 0.0 5.30 796 521 A 31 CYS HBx A 32 THR H 1.0 0.0 5.30 797 521 A 32 THR H A 31 CYS HBy 1.0 0.0 5.30 798 522 A 41 CYS HBx A 54 GLY H 1.0 0.0 3.76 799 523 A 55 PRO HBx A 56 ASP HA 1.0 0.0 4.64 800 523 A 55 PRO HGy A 56 ASP HA 1.0 0.0 4.64 801 524 A 56 ASP HA A 58 CYS H 1.0 0.0 4.91 802 525 A 35 ALA HB% A 33 CYS HBx 1.0 0.0 5.50 803 525 A 35 ALA HB% A 33 CYS HBy 1.0 0.0 5.50 804 525 A 6 LYS HGx A 33 CYS HBy 1.0 0.0 5.50 805 525 A 60 CYS HBy A 67 LYS HDy 1.0 0.0 5.50 806 525 A 6 LYS HGy A 33 CYS HBy 1.0 0.0 5.50 807 526 A 29 GLU HBx A 28 GLY HAy 1.0 0.0 5.49 808 527 A 29 GLU HBy A 29 GLU HGx 1.0 0.0 2.97 809 527 A 29 GLU HBx A 29 GLU HGy 1.0 0.0 2.97 810 528 A 6 LYS HGy A 6 LYS HA 1.0 0.0 4.24 811 528 A 6 LYS HA A 6 LYS HGx 1.0 0.0 4.24 812 529 A 9 LYS HGy A 8 GLU HGx 1.0 0.0 5.50 813 529 A 9 LYS HGy A 8 GLU HGy 1.0 0.0 5.50 814 529 A 9 LYS HGy A 29 GLU HGx 1.0 0.0 5.50 815 529 A 29 GLU HGx A 9 LYS HGx 1.0 0.0 5.50 816 529 A 9 LYS HGx A 29 GLU HGy 1.0 0.0 5.50 817 529 A 9 LYS HGy A 29 GLU HGy 1.0 0.0 5.50 818 530 A 57 SER HBy A 56 ASP HBy 1.0 0.0 5.50 819 530 A 57 SER HBy A 56 ASP HBx 1.0 0.0 5.50 820 530 A 56 ASP HBx A 57 SER HBx 1.0 0.0 5.50 821 530 A 56 ASP HBy A 57 SER HBx 1.0 0.0 5.50 822 531 A 57 SER HA A 57 SER HBx 1.0 0.0 2.77 823 531 A 57 SER HBy A 57 SER HA 1.0 0.0 2.77 824 532 A 53 THR H A 57 SER HBx 1.0 0.0 5.50 825 532 A 57 SER HBy A 53 THR H 1.0 0.0 5.50 826 533 A 10 CYS HA A 27 CYS HA 1.0 0.0 3.17 827 534 A 10 CYS HA A 27 CYS HBx 1.0 0.0 3.30 828 535 A 10 CYS HA A 10 CYS HBy 1.0 0.0 2.78 829 536 A 10 CYS HA A 9 LYS HBy 1.0 0.0 5.50 830 537 A 10 CYS HA A 9 LYS HBx 1.0 0.0 4.97 831 538 A 10 CYS HA A 28 GLY H 1.0 0.0 3.83 832 539 A 24 LYS HGx A 21 CYS HBy 1.0 0.0 5.50 833 539 A 13 ALA HB% A 21 CYS HBy 1.0 0.0 5.50 834 540 A 21 CYS HBy A 22 GLY HAx 1.0 0.0 5.24 835 540 A 21 CYS HBy A 22 GLY HAy 1.0 0.0 5.24 836 541 A 21 CYS HA A 21 CYS HBy 1.0 0.0 3.47 837 541 A 21 CYS HBy A 36 CYS HBx 1.0 0.0 3.47 838 542 A 21 CYS HBy A 25 CYS HBy 1.0 0.0 3.03 839 542 A 25 CYS HBx A 21 CYS HBy 1.0 0.0 3.03 840 543 A 21 CYS HBy A 21 CYS H 1.0 0.0 3.80 841 544 A 21 CYS HBy A 22 GLY H 1.0 0.0 4.64 842 545 A 21 CYS HBy A 36 CYS HA 1.0 0.0 5.48 843 546 A 50 LYS HGy A 49 GLY HAy 1.0 0.0 5.29 844 546 A 49 GLY HAx A 50 LYS HGy 1.0 0.0 5.29 845 547 A 46 CYS HA A 41 CYS HA 1.0 0.0 4.46 846 548 A 53 THR HA A 46 CYS HA 1.0 0.0 3.68 847 549 A 46 CYS HA A 45 GLY HAy 1.0 0.0 5.02 848 549 A 45 GLY HAx A 46 CYS HA 1.0 0.0 5.02 849 550 A 41 CYS HBy A 46 CYS HA 1.0 0.0 3.04 850 551 A 41 CYS HBx A 46 CYS HA 1.0 0.0 4.07 851 552 A 47 LYS HBx A 46 CYS HA 1.0 0.0 4.95 852 553 A 46 CYS HA A 47 LYS H 1.0 0.0 2.66 853 554 A 46 CYS HA A 48 CYS H 1.0 0.0 4.58 854 555 A 46 CYS HA A 41 CYS H 1.0 0.0 5.50 855 556 A 50 LYS HBx A 51 GLU H 1.0 0.0 4.51 856 556 A 50 LYS HBy A 51 GLU H 1.0 0.0 4.51 857 557 A 50 LYS HBy A 50 LYS H 1.0 0.0 3.95 858 557 A 50 LYS HBx A 50 LYS H 1.0 0.0 3.95 859 558 A 19 CYS HBy A 21 CYS H 1.0 0.0 5.07 860 559 A 19 CYS HBy A 20 GLN H 1.0 0.0 4.77 861 560 A 58 CYS HA A 52 CYS HA 1.0 0.0 4.08 862 561 A 52 CYS HA A 57 SER HBx 1.0 0.0 4.13 863 561 A 57 SER HBy A 52 CYS HA 1.0 0.0 4.13 864 562 A 57 SER HBy A 52 CYS HA 1.0 0.0 3.37 865 562 A 52 CYS HA A 57 SER HBx 1.0 0.0 3.37 866 562 A 52 CYS HBy A 52 CYS HA 1.0 0.0 3.37 867 563 A 52 CYS HBx A 52 CYS HA 1.0 0.0 2.92 868 564 A 53 THR HG2% A 52 CYS HA 1.0 0.0 4.98 869 565 A 52 CYS HA A 54 GLY H 1.0 0.0 5.50 870 566 A 38 THR HG2% A 55 PRO HBx 1.0 0.0 5.50 871 566 A 55 PRO HBy A 38 THR HG2% 1.0 0.0 5.50 872 567 A 55 PRO HBy A 58 CYS HBy 1.0 0.0 5.50 873 567 A 55 PRO HBx A 58 CYS HBx 1.0 0.0 5.50 874 567 A 55 PRO HBy A 58 CYS HBx 1.0 0.0 5.50 875 567 A 58 CYS HBy A 55 PRO HBx 1.0 0.0 5.50 876 568 A 55 PRO HBy A 39 CYS H 1.0 0.0 4.89 877 568 A 55 PRO HBx A 39 CYS H 1.0 0.0 4.89 878 569 A 37 LYS HA A 36 CYS HBx 1.0 0.0 5.45 879 570 A 36 CYS HBx A 25 CYS HA 1.0 0.0 5.09 880 571 A 36 CYS HBx A 21 CYS H 1.0 0.0 5.50 881 572 A 36 CYS HBx A 37 LYS H 1.0 0.0 4.74 882 573 A 36 CYS HBx A 36 CYS H 1.0 0.0 3.87 883 574 A 67 LYS HGx A 67 LYS HA 1.0 0.0 3.83 884 575 A 67 LYS HGx A 62 SER HA 1.0 0.0 4.42 885 576 A 64 CYS HBx A 67 LYS HGx 1.0 0.0 3.89 886 577 A 67 LYS HGx A 67 LYS HEy 1.0 0.0 3.88 887 578 A 66 CYS HBy A 48 CYS HA 1.0 0.0 4.73 888 579 A 48 CYS HBy A 48 CYS HA 1.0 0.0 2.90 889 580 A 48 CYS HA A 47 LYS HBy 1.0 0.0 5.50 890 581 A 47 LYS HBx A 48 CYS HA 1.0 0.0 5.36 891 582 A 17 GLU HA A 17 GLU HGy 1.0 0.0 3.92 892 583 A 16 SER HA A 17 GLU HGy 1.0 0.0 5.50 893 584 A 18 PRO HDy A 17 GLU HGy 1.0 0.0 5.50 894 585 A 17 GLU HGy A 17 GLU H 1.0 0.0 4.39 895 586 A 47 LYS HBy A 47 LYS H 1.0 0.0 4.12 896 587 A 47 LYS HBy A 48 CYS H 1.0 0.0 5.08 897 588 A 14 CYS HBx A 15 ARG HGx 1.0 0.0 5.50 898 588 A 15 ARG HGy A 14 CYS HBx 1.0 0.0 5.50 899 589 A 13 ALA HB% A 14 CYS HBx 1.0 0.0 4.68 900 589 A 14 CYS HBx A 11 THR HG2% 1.0 0.0 4.68 901 590 A 14 CYS HBx A 10 CYS HA 1.0 0.0 5.50 902 591 A 14 CYS HBx A 27 CYS HBx 1.0 0.0 5.50 903 592 A 14 CYS HBx A 15 ARG H 1.0 0.0 4.11 904 593 A 15 ARG H A 15 ARG HGx 1.0 0.0 3.86 905 594 A 14 CYS H A 15 ARG HGx 1.0 0.0 5.50 906 594 A 16 SER H A 15 ARG HGx 1.0 0.0 5.50 907 595 A 7 GLY HAy A 8 GLU HBx 1.0 0.0 5.37 908 595 A 8 GLU HBy A 7 GLY HAy 1.0 0.0 5.37 909 595 A 7 GLY HAx A 8 GLU HBy 1.0 0.0 5.37 910 595 A 7 GLY HAx A 8 GLU HBx 1.0 0.0 5.37 911 595 A 16 SER HA A 15 ARG HBy 1.0 0.0 5.37 912 596 A 15 ARG HDx A 15 ARG HBy 1.0 0.0 3.81 913 597 A 27 CYS HBy A 28 GLY HAx 1.0 0.0 5.50 914 597 A 27 CYS HBx A 28 GLY HAx 1.0 0.0 5.50 915 598 A 9 LYS HBy A 28 GLY HAx 1.0 0.0 3.23 916 599 A 9 LYS HGy A 28 GLY HAx 1.0 0.0 5.09 917 600 A 15 ARG HBx A 15 ARG H 1.0 0.0 3.63 918 601 A 60 CYS H A 67 LYS HEx 1.0 0.0 5.50 919 601 A 60 CYS H A 67 LYS HEy 1.0 0.0 5.50 920 602 A 67 LYS H A 67 LYS HEx 1.0 0.0 5.50 921 602 A 67 LYS H A 67 LYS HEy 1.0 0.0 5.50 922 603 A 38 THR HA A 38 THR HB 1.0 0.0 2.94 923 604 A 32 THR HA A 31 CYS HA 1.0 0.0 4.46 924 605 A 32 THR HA A 33 CYS HBx 1.0 0.0 5.50 925 605 A 32 THR HA A 33 CYS HBy 1.0 0.0 5.50 926 606 A 32 THR HA A 33 CYS HBx 1.0 0.0 5.50 927 606 A 32 THR HA A 33 CYS HBy 1.0 0.0 5.50 928 607 A 38 THR HA A 55 PRO HBx 1.0 0.0 4.10 929 607 A 38 THR HA A 55 PRO HGx 1.0 0.0 4.10 930 607 A 38 THR HA A 55 PRO HBy 1.0 0.0 4.10 931 608 A 62 SER HA A 67 LYS HEx 1.0 0.0 5.42 932 609 A 12 SER HA A 15 ARG HBy 1.0 0.0 3.90 933 609 A 15 ARG HBx A 12 SER HA 1.0 0.0 3.90 934 610 A 67 LYS HGy A 62 SER HA 1.0 0.0 2.71 935 611 A 62 SER HA A 67 LYS HDx 1.0 0.0 3.99 936 612 A 12 SER HA A 15 ARG H 1.0 0.0 3.96 937 613 A 12 SER HA A 14 CYS H 1.0 0.0 5.50 938 613 A 12 SER HA A 16 SER H 1.0 0.0 5.50 939 614 A 66 CYS HBx A 40 ASN HA 1.0 0.0 5.24 940 614 A 25 CYS HA A 26 GLN HA 1.0 0.0 5.24 941 615 A 40 ASN HBx A 40 ASN HA 1.0 0.0 2.81 942 616 A 11 THR HG2% A 26 GLN HA 1.0 0.0 4.25 943 617 A 40 ASN HA A 39 CYS H 1.0 0.0 5.07 944 618 A 40 ASN HD2x A 40 ASN HA 1.0 0.0 4.71 945 618 A 40 ASN HD2y A 40 ASN HA 1.0 0.0 4.71 946 619 A 20 GLN HBy A 20 GLN HGx 1.0 0.0 2.92 947 620 A 13 ALA HB% A 20 GLN HGx 1.0 0.0 5.28 948 621 A 20 GLN HGx A 19 CYS HA 1.0 0.0 4.78 949 622 A 20 GLN HGx A 21 CYS H 1.0 0.0 5.50 950 623 A 67 LYS HDy A 67 LYS H 1.0 0.0 4.59 951 624 A 26 GLN HBx A 27 CYS HA 1.0 0.0 5.49 952 625 A 16 SER HBy A 20 GLN HBx 1.0 0.0 5.38 953 625 A 20 GLN HBx A 16 SER HBx 1.0 0.0 5.38 954 626 A 20 GLN HBx A 20 GLN H 1.0 0.0 4.06 955 627 A 26 GLN HBx A 26 GLN HE2y 1.0 0.0 5.50 956 627 A 26 GLN HBx A 26 GLN HE2x 1.0 0.0 5.50 957 627 A 20 GLN HE2y A 20 GLN HBx 1.0 0.0 5.50 958 628 A 14 CYS HA A 19 CYS HBx 1.0 0.0 5.08 959 629 A 49 GLY HAx A 50 LYS HGy 1.0 0.0 5.29 960 629 A 50 LYS HGy A 49 GLY HAy 1.0 0.0 5.29 961 630 A 16 SER HA A 17 GLU HA 1.0 0.0 4.64 962 631 A 19 CYS HA A 17 GLU HA 1.0 0.0 4.67 963 632 A 17 GLU HA A 16 SER HBx 1.0 0.0 5.13 964 632 A 16 SER HBy A 17 GLU HA 1.0 0.0 5.13 965 633 A 19 CYS HBx A 17 GLU HA 1.0 0.0 5.46 966 634 A 17 GLU HA A 18 PRO HBy 1.0 0.0 4.28 967 635 A 17 GLU HGx A 17 GLU HA 1.0 0.0 4.15 968 636 A 17 GLU HBy A 17 GLU HA 1.0 0.0 2.97 969 637 A 57 SER HA A 56 ASP HBy 1.0 0.0 5.50 970 637 A 56 ASP HBx A 54 GLY HAy 1.0 0.0 5.50 971 637 A 56 ASP HBx A 57 SER HA 1.0 0.0 5.50 972 638 A 25 CYS HA A 26 GLN HGy 1.0 0.0 5.50 973 638 A 25 CYS HA A 26 GLN HGx 1.0 0.0 5.50 974 639 A 35 ALA HB% A 33 CYS HBy 1.0 0.0 5.50 975 639 A 35 ALA HB% A 33 CYS HBx 1.0 0.0 5.50 976 639 A 34 ALA HB% A 33 CYS HBy 1.0 0.0 5.50 977 640 A 31 CYS HA A 33 CYS HBy 1.0 0.0 5.50 978 640 A 31 CYS HA A 33 CYS HBx 1.0 0.0 5.50 979 641 A 36 CYS H A 33 CYS HBy 1.0 0.0 4.59 980 641 A 33 CYS HBx A 36 CYS H 1.0 0.0 4.59 981 642 A 31 CYS HA A 6 LYS HA 1.0 0.0 5.50 982 643 A 6 LYS HA A 6 LYS HGx 1.0 0.0 4.24 983 643 A 6 LYS HGy A 6 LYS HA 1.0 0.0 4.24 984 644 A 28 GLY HAx A 9 LYS HA 1.0 0.0 4.63 985 645 A 50 LYS HA A 51 GLU HBy 1.0 0.0 4.93 986 645 A 51 GLU HBx A 50 LYS HA 1.0 0.0 4.93 987 646 A 9 LYS HBy A 9 LYS HA 1.0 0.0 2.81 988 647 A 24 LYS HA A 24 LYS HBy 1.0 0.0 2.92 989 647 A 24 LYS HA A 24 LYS HBx 1.0 0.0 2.92 990 647 A 50 LYS HBy A 50 LYS HA 1.0 0.0 2.92 991 648 A 9 LYS HA A 9 LYS HGx 1.0 0.0 2.91 992 648 A 9 LYS HGy A 9 LYS HA 1.0 0.0 2.91 993 649 A 24 LYS HA A 24 LYS HGy 1.0 0.0 3.95 994 649 A 24 LYS HA A 24 LYS HGx 1.0 0.0 3.95 995 649 A 50 LYS HGy A 50 LYS HA 1.0 0.0 3.95 996 650 A 14 CYS HA A 19 CYS HBy 1.0 0.0 4.91 997 651 A 20 GLN HBy A 14 CYS HA 1.0 0.0 5.09 998 652 A 14 CYS HA A 35 ALA HB% 1.0 0.0 5.50 999 653 A 14 CYS HA A 21 CYS H 1.0 0.0 4.32 1000 654 A 66 CYS HBy A 47 LYS HGy 1.0 0.0 5.50 1001 654 A 66 CYS HBy A 67 LYS HDy 1.0 0.0 5.50 1002 655 A 66 CYS HBy A 41 CYS H 1.0 0.0 5.03 1003 656 A 34 ALA HA A 36 CYS H 1.0 0.0 5.48 1004 657 A 55 PRO HBx A 56 ASP HA 1.0 0.0 4.67 1005 658 A 39 CYS HBy A 55 PRO HDy 1.0 0.0 3.20 1006 658 A 39 CYS HBx A 55 PRO HA 1.0 0.0 3.20 1007 659 A 21 CYS HA A 24 LYS HBy 1.0 0.0 5.50 1008 659 A 21 CYS HA A 24 LYS HBx 1.0 0.0 5.50 1009 660 A 39 CYS HBy A 58 CYS HBx 1.0 0.0 4.89 1010 660 A 39 CYS HBx A 58 CYS HBy 1.0 0.0 4.89 1011 660 A 39 CYS HBx A 58 CYS HBx 1.0 0.0 4.89 1012 660 A 39 CYS HBy A 41 CYS HBx 1.0 0.0 4.89 1013 661 A 53 THR HA A 41 CYS H 1.0 0.0 5.50 1014 662 A 53 THR HA A 45 GLY H 1.0 0.0 5.50 1015 663 A 9 LYS H A 8 GLU HBx 1.0 0.0 4.99 1016 663 A 8 GLU HBy A 9 LYS H 1.0 0.0 4.99 1017 664 A 60 CYS HBy A 64 CYS HBx 1.0 0.0 4.33 1018 665 A 64 CYS HBx A 67 LYS HGy 1.0 0.0 4.56 1019 666 A 64 CYS HBx A 63 SER HBy 1.0 0.0 5.37 1020 666 A 64 CYS HBx A 63 SER HBx 1.0 0.0 5.37 1021 666 A 64 CYS HBx A 62 SER HA 1.0 0.0 5.37 1022 667 A 64 CYS HBx A 61 GLY HAy 1.0 0.0 5.50 1023 667 A 64 CYS HBx A 63 SER HBx 1.0 0.0 5.50 1024 667 A 64 CYS HBx A 61 GLY HAx 1.0 0.0 5.50 1025 667 A 64 CYS HBx A 63 SER HBy 1.0 0.0 5.50 1026 668 A 64 CYS HBx A 61 GLY H 1.0 0.0 4.82 1027 669 A 46 CYS HBy A 51 GLU HBy 1.0 0.0 5.50 1028 669 A 51 GLU HBx A 46 CYS HBy 1.0 0.0 5.50 1029 670 A 41 CYS HBy A 46 CYS HBy 1.0 0.0 4.54 1030 670 A 46 CYS HBx A 41 CYS HBy 1.0 0.0 4.54 1031 671 A 47 LYS H A 46 CYS HBy 1.0 0.0 4.31 1032 671 A 46 CYS HBx A 47 LYS H 1.0 0.0 4.31 1033 672 A 51 GLU H A 46 CYS HBy 1.0 0.0 4.20 1034 672 A 46 CYS HBx A 51 GLU H 1.0 0.0 4.20 1035 673 A 15 ARG HA A 15 ARG HGx 1.0 0.0 3.42 1036 673 A 15 ARG HA A 6 LYS HGx 1.0 0.0 3.42 1037 673 A 15 ARG HA A 6 LYS HGy 1.0 0.0 3.42 1038 674 A 39 CYS HBy A 42 THR HG2% 1.0 0.0 5.50 1039 674 A 39 CYS HBx A 38 THR HG2% 1.0 0.0 5.50 1040 675 A 39 CYS HBy A 55 PRO HDy 1.0 0.0 3.90 1041 675 A 39 CYS HBx A 55 PRO HDy 1.0 0.0 3.90 1042 675 A 39 CYS HBx A 55 PRO HA 1.0 0.0 3.90 1043 676 A 50 LYS HBy A 51 GLU H 1.0 0.0 4.64 1044 676 A 33 CYS H A 37 LYS HBx 1.0 0.0 4.64 1045 676 A 50 LYS HBx A 51 GLU H 1.0 0.0 4.64 1046 677 A 11 THR HB A 13 ALA H 1.0 0.0 3.90 1047 678 A 15 ARG H A 15 ARG HDy 1.0 0.0 4.93 1048 679 A 19 CYS HBx A 35 ALA HA 1.0 0.0 5.39 1049 680 A 19 CYS HBy A 35 ALA HA 1.0 0.0 5.48 1050 681 A 35 ALA HA A 37 LYS H 1.0 0.0 4.88 1051 682 A 36 CYS HA A 35 ALA HA 1.0 0.0 4.95 1052 683 A 9 LYS HBy A 29 GLU H 1.0 0.0 5.27 1053 684 A 46 CYS HBx A 53 THR HG2% 1.0 0.0 4.28 1054 685 A 46 CYS HBx A 45 GLY HAx 1.0 0.0 5.50 1055 685 A 46 CYS HBx A 45 GLY HAy 1.0 0.0 5.50 1056 686 A 46 CYS HBx A 51 GLU HA 1.0 0.0 3.94 1057 686 A 51 GLU HA A 46 CYS HBy 1.0 0.0 3.94 1058 687 A 46 CYS HBx A 52 CYS H 1.0 0.0 5.40 1059 688 A 21 CYS HBx A 22 GLY HAy 1.0 0.0 5.50 1060 688 A 21 CYS HBx A 22 GLY HAx 1.0 0.0 5.50 1061 689 A 20 GLN HA A 22 GLY HAy 1.0 0.0 5.50 1062 689 A 22 GLY HAy A 23 SER HA 1.0 0.0 5.50 1063 689 A 23 SER HA A 22 GLY HAx 1.0 0.0 5.50 1064 690 A 21 CYS H A 22 GLY HAx 1.0 0.0 5.40 1065 690 A 22 GLY HAy A 21 CYS H 1.0 0.0 5.40 1066 691 A 22 GLY HAy A 24 LYS H 1.0 0.0 4.99 1067 691 A 24 LYS H A 22 GLY HAx 1.0 0.0 4.99 1068 692 A 33 CYS HBx A 33 CYS HA 1.0 0.0 2.96 1069 692 A 33 CYS HA A 33 CYS HBy 1.0 0.0 2.96 1070 693 A 35 ALA HB% A 33 CYS HA 1.0 0.0 4.84 1071 693 A 34 ALA HB% A 33 CYS HA 1.0 0.0 4.84 1072 694 A 33 CYS HA A 34 ALA H 1.0 0.0 2.78 1073 695 A 33 CYS HA A 35 ALA H 1.0 0.0 4.58 1074 696 A 50 LYS HGy A 50 LYS HA 1.0 0.0 4.15 1075 696 A 50 LYS HGx A 50 LYS HA 1.0 0.0 4.15 1076 697 A 10 CYS HA A 11 THR HG2% 1.0 0.0 3.72 1077 698 A 11 THR HG2% A 62 SER HBx 1.0 0.0 5.50 1078 698 A 11 THR HG2% A 12 SER HA 1.0 0.0 5.50 1079 698 A 11 THR HG2% A 62 SER HBy 1.0 0.0 5.50 1080 699 A 11 THR HG2% A 27 CYS HBx 1.0 0.0 4.59 1081 700 A 14 CYS HBy A 11 THR HG2% 1.0 0.0 5.36 1082 700 A 11 THR HG2% A 10 CYS HBy 1.0 0.0 5.36 1083 701 A 26 GLN HBx A 11 THR HG2% 1.0 0.0 3.10 1084 702 A 11 THR HG2% A 9 LYS HBy 1.0 0.0 5.50 1085 703 A 26 GLN HBy A 11 THR HG2% 1.0 0.0 2.93 1086 704 A 11 THR HG2% A 26 GLN H 1.0 0.0 3.61 1087 705 A 11 THR HG2% A 13 ALA H 1.0 0.0 4.98 1088 706 A 6 LYS HGy A 5 GLY HAy 1.0 0.0 5.50 1089 706 A 5 GLY HAy A 6 LYS HGx 1.0 0.0 5.50 1090 706 A 4 LYS HGy A 5 GLY HAx 1.0 0.0 5.50 1091 706 A 6 LYS HGy A 5 GLY HAx 1.0 0.0 5.50 1092 706 A 5 GLY HAx A 4 LYS HGx 1.0 0.0 5.50 1093 706 A 5 GLY HAx A 6 LYS HGx 1.0 0.0 5.50 1094 706 A 4 LYS HGx A 5 GLY HAy 1.0 0.0 5.50 1095 706 A 4 LYS HGy A 5 GLY HAy 1.0 0.0 5.50 1096 707 A 10 CYS HBx A 7 GLY HAy 1.0 0.0 5.50 1097 707 A 31 CYS HBx A 30 GLY HAx 1.0 0.0 5.50 1098 707 A 31 CYS HBx A 30 GLY HAy 1.0 0.0 5.50 1099 707 A 30 GLY HAy A 31 CYS HBy 1.0 0.0 5.50 1100 707 A 30 GLY HAx A 31 CYS HBy 1.0 0.0 5.50 1101 708 A 29 GLU HGx A 30 GLY HAy 1.0 0.0 5.50 1102 708 A 30 GLY HAx A 29 GLU HGy 1.0 0.0 5.50 1103 708 A 29 GLU HGx A 30 GLY HAx 1.0 0.0 5.50 1104 708 A 29 GLU HGy A 30 GLY HAy 1.0 0.0 5.50 1105 709 A 29 GLU HBy A 30 GLY HAy 1.0 0.0 5.50 1106 709 A 29 GLU HBy A 30 GLY HAx 1.0 0.0 5.50 1107 710 A 67 LYS HBy A 30 GLY HAx 1.0 0.0 5.38 1108 710 A 9 LYS HBx A 30 GLY HAy 1.0 0.0 5.38 1109 710 A 67 LYS HBy A 30 GLY HAy 1.0 0.0 5.38 1110 710 A 9 LYS HBx A 30 GLY HAx 1.0 0.0 5.38 1111 711 A 21 CYS HBx A 22 GLY HAy 1.0 0.0 5.50 1112 711 A 21 CYS HBx A 22 GLY HAx 1.0 0.0 5.50 1113 712 A 22 GLY HAy A 24 LYS H 1.0 0.0 4.99 1114 712 A 24 LYS H A 22 GLY HAx 1.0 0.0 4.99 1115 713 A 67 LYS HBy A 62 SER HA 1.0 0.0 5.39 1116 714 A 67 LYS HBy A 67 LYS HEy 1.0 0.0 5.14 1117 714 A 67 LYS HBy A 67 LYS HEx 1.0 0.0 5.14 1118 715 A 67 LYS HBy A 67 LYS H 1.0 0.0 3.88 1119 716 A 11 THR HG2% A 26 GLN HGx 1.0 0.0 4.57 1120 716 A 11 THR HG2% A 26 GLN HGy 1.0 0.0 4.57 1121 717 A 25 CYS HA A 26 GLN HGx 1.0 0.0 5.50 1122 717 A 25 CYS HA A 26 GLN HGy 1.0 0.0 5.50 1123 718 A 26 GLN HGy A 26 GLN H 1.0 0.0 4.98 1124 718 A 26 GLN H A 26 GLN HGx 1.0 0.0 4.98 1125 719 A 27 CYS HBx A 27 CYS H 1.0 0.0 3.76 1126 720 A 38 THR HG2% A 38 THR H 1.0 0.0 3.29 1127 720 A 38 THR HG2% A 39 CYS H 1.0 0.0 3.29 1128 721 A 40 ASN HD2x A 38 THR HG2% 1.0 0.0 5.04 1129 721 A 40 ASN HD2y A 38 THR HG2% 1.0 0.0 5.04 1130 722 A 26 GLN HA A 26 GLN HGy 1.0 0.0 3.33 1131 722 A 26 GLN HA A 26 GLN HGx 1.0 0.0 3.33 1132 722 A 26 GLN HBx A 26 GLN HA 1.0 0.0 3.33 1133 723 A 64 CYS HBy A 60 CYS HBy 1.0 0.0 4.79 1134 724 A 64 CYS HBy A 67 LYS HGx 1.0 0.0 3.57 1135 725 A 51 GLU HA A 51 GLU HGx 1.0 0.0 3.79 1136 725 A 51 GLU HA A 51 GLU HBy 1.0 0.0 3.79 1137 725 A 51 GLU HA A 51 GLU HGy 1.0 0.0 3.79 1138 725 A 51 GLU HA A 51 GLU HBx 1.0 0.0 3.79 1139 726 A 51 GLU HA A 50 LYS HA 1.0 0.0 5.50 1140 726 A 51 GLU HA A 46 CYS HA 1.0 0.0 5.50 1141 727 A 39 CYS HBy A 55 PRO HDy 1.0 0.0 5.07 1142 727 A 39 CYS HBx A 55 PRO HDy 1.0 0.0 5.07 1143 728 A 39 CYS HBy A 55 PRO HDy 1.0 0.0 3.38 1144 729 A 54 GLY HAy A 55 PRO HDy 1.0 0.0 2.94 1145 729 A 54 GLY HAx A 55 PRO HDy 1.0 0.0 2.94 1146 730 A 55 PRO HDy A 39 CYS H 1.0 0.0 5.17 1147 731 A 55 PRO HDy A 54 GLY H 1.0 0.0 5.12 1148 732 A 53 THR HB A 41 CYS HBy 1.0 0.0 5.10 1149 733 A 53 THR HB A 41 CYS HBx 1.0 0.0 5.40 1150 734 A 53 THR HB A 46 CYS HA 1.0 0.0 5.50 1151 734 A 53 THR HB A 42 THR HB 1.0 0.0 5.50 1152 735 A 53 THR HB A 43 SER H 1.0 0.0 4.92 1153 736 A 53 THR HB A 45 GLY H 1.0 0.0 5.30 1154 737 A 55 PRO HBy A 38 THR HB 1.0 0.0 5.50 1155 737 A 38 THR HB A 55 PRO HGx 1.0 0.0 5.50 1156 738 A 64 CYS HBy A 67 LYS HGy 1.0 0.0 3.99 1157 739 A 67 LYS HGy A 67 LYS HEx 1.0 0.0 4.12 1158 740 A 67 LYS HGy A 67 LYS H 1.0 0.0 4.39 1159 741 A 32 THR HB A 33 CYS H 1.0 0.0 5.50 1160 742 A 20 GLN HA A 20 GLN HGx 1.0 0.0 3.07 1161 742 A 20 GLN HA A 20 GLN HBx 1.0 0.0 3.07 1162 743 A 20 GLN HE2x A 20 GLN HA 1.0 0.0 4.65 1163 743 A 20 GLN HE2y A 20 GLN HA 1.0 0.0 4.65 1164 744 A 20 GLN HE2y A 20 GLN HA 1.0 0.0 5.10 1165 744 A 20 GLN HE2x A 20 GLN HA 1.0 0.0 5.10 1166 745 A 53 THR HG2% A 43 SER HA 1.0 0.0 3.90 1167 746 A 43 SER HA A 44 ASP HA 1.0 0.0 4.93 1168 747 A 47 LYS HA A 47 LYS HBy 1.0 0.0 2.85 1169 748 A 60 CYS HBx A 61 GLY HAy 1.0 0.0 5.50 1170 748 A 60 CYS HBx A 61 GLY HAx 1.0 0.0 5.50 1171 748 A 64 CYS HBx A 61 GLY HAy 1.0 0.0 5.50 1172 748 A 64 CYS HBx A 61 GLY HAx 1.0 0.0 5.50 1173 749 A 21 CYS HA A 25 CYS HBy 1.0 0.0 5.50 1174 749 A 21 CYS HA A 25 CYS HBx 1.0 0.0 5.50 1175 749 A 21 CYS HA A 36 CYS HBy 1.0 0.0 5.50 1176 750 A 21 CYS HA A 21 CYS HBy 1.0 0.0 3.00 1177 751 A 21 CYS HA A 20 GLN HBx 1.0 0.0 5.15 1178 752 A 20 GLN HBy A 21 CYS HA 1.0 0.0 5.39 1179 753 A 21 CYS HA A 24 LYS HBy 1.0 0.0 5.50 1180 753 A 21 CYS HA A 24 LYS HBx 1.0 0.0 5.50 1181 754 A 21 CYS HA A 20 GLN HA 1.0 0.0 4.91 1182 755 A 21 CYS HA A 25 CYS HA 1.0 0.0 3.97 1183 756 A 28 GLY HAx A 29 GLU HA 1.0 0.0 4.63 1184 757 A 31 CYS HBx A 29 GLU HA 1.0 0.0 5.50 1185 757 A 29 GLU HA A 31 CYS HBy 1.0 0.0 5.50 1186 758 A 29 GLU HBx A 29 GLU HA 1.0 0.0 2.95 1187 758 A 29 GLU HBy A 29 GLU HA 1.0 0.0 2.95 1188 759 A 29 GLU HA A 31 CYS H 1.0 0.0 4.51 1189 760 A 66 CYS HA A 66 CYS HBx 1.0 0.0 2.77 1190 761 A 66 CYS HBy A 66 CYS HA 1.0 0.0 2.90 1191 762 A 66 CYS HA A 40 ASN HBy 1.0 0.0 3.44 1192 763 A 48 CYS HBy A 66 CYS HA 1.0 0.0 4.69 1193 764 A 66 CYS HA A 40 ASN H 1.0 0.0 3.93 1194 765 A 40 ASN HD2y A 66 CYS HA 1.0 0.0 5.49 1195 765 A 66 CYS HA A 40 ASN HD2x 1.0 0.0 5.49 1196 766 A 55 PRO HDy A 58 CYS HBx 1.0 0.0 5.50 1197 766 A 41 CYS HBx A 55 PRO HDy 1.0 0.0 5.50 1198 766 A 58 CYS HBy A 55 PRO HDy 1.0 0.0 5.50 1199 767 A 54 GLY HAx A 55 PRO HDy 1.0 0.0 3.57 1200 767 A 54 GLY HAy A 55 PRO HDy 1.0 0.0 3.57 1201 768 A 55 PRO HDy A 56 ASP H 1.0 0.0 5.19 1202 769 A 55 PRO HDy A 54 GLY H 1.0 0.0 5.50 1203 770 A 37 LYS HBy A 37 LYS H 1.0 0.0 3.21 1204 770 A 37 LYS H A 37 LYS HBx 1.0 0.0 3.21 1205 771 A 65 SER HBy A 65 SER H 1.0 0.0 3.94 1206 772 A 65 SER HBy A 66 CYS H 1.0 0.0 4.65 1207 773 A 50 LYS H A 51 GLU HGy 1.0 0.0 5.50 1208 773 A 51 GLU HGx A 50 LYS H 1.0 0.0 5.50 1209 774 A 19 CYS HBx A 18 PRO HBx 1.0 0.0 4.89 1210 775 A 19 CYS HBy A 18 PRO HBx 1.0 0.0 4.63 1211 776 A 48 CYS HBy A 50 LYS HBx 1.0 0.0 5.50 1212 776 A 48 CYS HBy A 47 LYS HBx 1.0 0.0 5.50 1213 777 A 66 CYS HBy A 48 CYS HBy 1.0 0.0 3.13 1214 778 A 48 CYS HBy A 47 LYS H 1.0 0.0 5.05 1215 779 A 16 SER HBy A 20 GLN HGx 1.0 0.0 3.91 1216 779 A 20 GLN HGy A 16 SER HBx 1.0 0.0 3.91 1217 779 A 20 GLN HGx A 16 SER HBx 1.0 0.0 3.91 1218 780 A 16 SER HBy A 20 GLN HBy 1.0 0.0 4.32 1219 780 A 20 GLN HBy A 16 SER HBx 1.0 0.0 4.32 1220 781 A 20 GLN HE2y A 16 SER HBx 1.0 0.0 5.50 1221 781 A 16 SER HBy A 20 GLN HE2y 1.0 0.0 5.50 1222 781 A 20 GLN HE2x A 16 SER HBx 1.0 0.0 5.50 1223 782 A 10 CYS HBx A 7 GLY HAy 1.0 0.0 5.50 1224 782 A 7 GLY HAx A 10 CYS HBx 1.0 0.0 5.50 1225 782 A 7 GLY HAx A 31 CYS HBy 1.0 0.0 5.50 1226 783 A 7 GLY HAy A 8 GLU HBx 1.0 0.0 5.50 1227 783 A 7 GLY HAx A 8 GLU HBx 1.0 0.0 5.50 1228 783 A 8 GLU HBy A 7 GLY HAy 1.0 0.0 5.50 1229 783 A 7 GLY HAx A 8 GLU HBy 1.0 0.0 5.50 1230 784 A 6 LYS HBy A 7 GLY HAy 1.0 0.0 5.34 1231 784 A 6 LYS HBx A 7 GLY HAy 1.0 0.0 5.34 1232 784 A 7 GLY HAx A 6 LYS HBy 1.0 0.0 5.34 1233 784 A 7 GLY HAx A 6 LYS HBx 1.0 0.0 5.34 1234 785 A 9 LYS HBx A 7 GLY HAy 1.0 0.0 5.50 1235 785 A 9 LYS HBx A 7 GLY HAx 1.0 0.0 5.50 1236 786 A 67 LYS HA A 67 LYS HEy 1.0 0.0 5.28 1237 786 A 67 LYS HA A 67 LYS HEx 1.0 0.0 5.28 1238 787 A 67 LYS HBy A 67 LYS HA 1.0 0.0 2.97 1239 788 A 67 LYS HDy A 67 LYS HA 1.0 0.0 2.85 1240 789 A 67 LYS HA A 40 ASN H 1.0 0.0 4.91 1241 790 A 67 LYS HA A 64 CYS H 1.0 0.0 5.50 1242 790 A 67 LYS HA A 66 CYS H 1.0 0.0 5.50 1243 791 A 40 ASN HD2x A 67 LYS HA 1.0 0.0 4.40 1244 791 A 40 ASN HD2y A 67 LYS HA 1.0 0.0 4.40 1245 792 A 66 CYS HA A 67 LYS HA 1.0 0.0 4.93 1246 793 A 14 CYS HBy A 15 ARG HBy 1.0 0.0 5.50 1247 793 A 14 CYS HBy A 15 ARG HBx 1.0 0.0 5.50 1248 794 A 14 CYS HBy A 15 ARG HGx 1.0 0.0 5.15 1249 794 A 14 CYS HBy A 15 ARG HGy 1.0 0.0 5.15 1250 795 A 14 CYS HBy A 15 ARG HA 1.0 0.0 5.41 1251 796 A 42 THR HG2% A 41 CYS HA 1.0 0.0 3.97 1252 797 A 42 THR HG2% A 54 GLY HAx 1.0 0.0 5.50 1253 797 A 42 THR HG2% A 55 PRO HDy 1.0 0.0 5.50 1254 797 A 42 THR HG2% A 54 GLY HAy 1.0 0.0 5.50 1255 798 A 18 PRO HGy A 19 CYS H 1.0 0.0 5.41 1256 799 A 58 CYS HA A 52 CYS HBy 1.0 0.0 2.77 1257 800 A 58 CYS HA A 52 CYS HBx 1.0 0.0 2.72 1258 801 A 58 CYS HA A 59 LYS HGx 1.0 0.0 5.50 1259 801 A 58 CYS HA A 59 LYS HGy 1.0 0.0 5.50 1260 802 A 58 CYS HA A 59 LYS H 1.0 0.0 2.82 1261 803 A 48 CYS HBx A 40 ASN HBy 1.0 0.0 5.50 1262 803 A 48 CYS HBx A 64 CYS HBy 1.0 0.0 5.50 1263 804 A 48 CYS HBx A 50 LYS HBx 1.0 0.0 5.50 1264 804 A 48 CYS HBx A 47 LYS HBx 1.0 0.0 5.50 1265 805 A 48 CYS HBx A 50 LYS HGy 1.0 0.0 5.50 1266 805 A 48 CYS HBx A 50 LYS HGx 1.0 0.0 5.50 1267 806 A 48 CYS HBx A 50 LYS HGx 1.0 0.0 4.96 1268 806 A 48 CYS HBx A 50 LYS HGy 1.0 0.0 4.96 1269 807 A 48 CYS HBx A 50 LYS H 1.0 0.0 5.38 1270 808 A 48 CYS HBx A 48 CYS HA 1.0 0.0 2.81 1271 809 A 7 GLY HAy A 8 GLU HBx 1.0 0.0 5.10 1272 809 A 7 GLY HAx A 8 GLU HBy 1.0 0.0 5.10 1273 809 A 8 GLU HBy A 7 GLY HAy 1.0 0.0 5.10 1274 809 A 7 GLY HAx A 8 GLU HBx 1.0 0.0 5.10 1275 810 A 6 LYS HA A 7 GLY HAy 1.0 0.0 5.50 1276 810 A 49 GLY HAx A 50 LYS HA 1.0 0.0 5.50 1277 810 A 50 LYS HA A 49 GLY HAy 1.0 0.0 5.50 1278 811 A 39 CYS HBy A 54 GLY HAy 1.0 0.0 5.50 1279 811 A 39 CYS HBx A 54 GLY HAx 1.0 0.0 5.50 1280 811 A 52 CYS HBx A 54 GLY HAy 1.0 0.0 5.50 1281 811 A 39 CYS HBx A 54 GLY HAy 1.0 0.0 5.50 1282 812 A 54 GLY HAx A 41 CYS HBx 1.0 0.0 5.06 1283 812 A 41 CYS HBx A 54 GLY HAy 1.0 0.0 5.06 1284 813 A 54 GLY HAx A 55 PRO HGx 1.0 0.0 5.45 1285 813 A 54 GLY HAx A 55 PRO HGy 1.0 0.0 5.45 1286 813 A 54 GLY HAy A 55 PRO HGy 1.0 0.0 5.45 1287 814 A 39 CYS HBy A 54 GLY HAx 1.0 0.0 3.69 1288 814 A 39 CYS HBy A 54 GLY HAy 1.0 0.0 3.69 1289 815 A 55 PRO HA A 58 CYS HBx 1.0 0.0 3.44 1290 815 A 55 PRO HA A 58 CYS HBy 1.0 0.0 3.44 1291 816 A 11 THR HG2% A 26 GLN HGy 1.0 0.0 4.57 1292 816 A 11 THR HG2% A 26 GLN HGx 1.0 0.0 4.57 1293 817 A 26 GLN HGy A 26 GLN H 1.0 0.0 4.54 1294 817 A 26 GLN H A 26 GLN HGx 1.0 0.0 4.54 1295 818 A 58 CYS HA A 59 LYS HGy 1.0 0.0 4.39 1296 818 A 4 LYS HA A 4 LYS HGx 1.0 0.0 4.39 1297 818 A 58 CYS HA A 59 LYS HGx 1.0 0.0 4.39 1298 818 A 4 LYS HA A 4 LYS HGy 1.0 0.0 4.39 1299 819 A 4 LYS HBx A 5 GLY HAy 1.0 0.0 4.76 1300 819 A 5 GLY HAx A 4 LYS HBx 1.0 0.0 4.76 1301 819 A 4 LYS HBy A 5 GLY HAy 1.0 0.0 4.76 1302 819 A 5 GLY HAx A 4 LYS HBy 1.0 0.0 4.76 1303 820 A 6 LYS HA A 5 GLY HAy 1.0 0.0 4.53 1304 820 A 6 LYS HA A 5 GLY HAx 1.0 0.0 4.53 1305 821 A 6 LYS HBy A 5 GLY HAx 1.0 0.0 5.34 1306 821 A 5 GLY HAx A 6 LYS HBx 1.0 0.0 5.34 1307 821 A 5 GLY HAy A 6 LYS HBx 1.0 0.0 5.34 1308 821 A 4 LYS HBx A 5 GLY HAy 1.0 0.0 5.34 1309 821 A 5 GLY HAx A 4 LYS HBx 1.0 0.0 5.34 1310 821 A 6 LYS HBy A 5 GLY HAy 1.0 0.0 5.34 1311 822 A 4 LYS HGy A 6 LYS H 1.0 0.0 5.50 1312 822 A 6 LYS HGy A 6 LYS H 1.0 0.0 5.50 1313 822 A 6 LYS H A 6 LYS HGx 1.0 0.0 5.50 1314 822 A 6 LYS H A 4 LYS HGx 1.0 0.0 5.50 1315 823 A 15 ARG HA A 6 LYS HGy 1.0 0.0 5.50 1316 823 A 9 LYS HGy A 7 GLY HAx 1.0 0.0 5.50 1317 823 A 9 LYS HGy A 7 GLY HAy 1.0 0.0 5.50 1318 823 A 15 ARG HA A 6 LYS HGx 1.0 0.0 5.50 1319 824 A 7 GLY HAx A 8 GLU HGy 1.0 0.0 5.50 1320 824 A 7 GLY HAy A 8 GLU HGy 1.0 0.0 5.50 1321 824 A 7 GLY HAx A 8 GLU HGx 1.0 0.0 5.50 1322 824 A 8 GLU HGx A 7 GLY HAy 1.0 0.0 5.50 1323 825 A 8 GLU HGx A 8 GLU H 1.0 0.0 5.32 1324 825 A 8 GLU H A 8 GLU HGy 1.0 0.0 5.32 1325 826 A 8 GLU HGx A 9 LYS H 1.0 0.0 5.50 1326 826 A 9 LYS H A 8 GLU HGy 1.0 0.0 5.50 1327 827 A 20 GLN HE2x A 18 PRO HGx 1.0 0.0 4.61 1328 827 A 20 GLN HE2y A 18 PRO HGy 1.0 0.0 4.61 1329 827 A 20 GLN HE2y A 18 PRO HGx 1.0 0.0 4.61 1330 828 A 20 GLN HE2y A 18 PRO HGx 1.0 0.0 4.61 1331 828 A 20 GLN HE2x A 18 PRO HGx 1.0 0.0 4.61 1332 828 A 20 GLN HE2x A 18 PRO HGy 1.0 0.0 4.61 1333 829 A 22 GLY HAx A 23 SER HBx 1.0 0.0 4.58 1334 829 A 23 SER HBy A 22 GLY HAx 1.0 0.0 4.58 1335 829 A 22 GLY HAy A 23 SER HBy 1.0 0.0 4.58 1336 829 A 22 GLY HAy A 23 SER HBx 1.0 0.0 4.58 1337 830 A 23 SER HA A 24 LYS HGy 1.0 0.0 5.50 1338 830 A 24 LYS HGx A 23 SER HA 1.0 0.0 5.50 1339 831 A 24 LYS HGx A 23 SER HBx 1.0 0.0 5.50 1340 831 A 23 SER HBx A 24 LYS HGy 1.0 0.0 5.50 1341 831 A 23 SER HBy A 24 LYS HGy 1.0 0.0 5.50 1342 831 A 24 LYS HGx A 23 SER HBy 1.0 0.0 5.50 1343 832 A 24 LYS HGx A 24 LYS H 1.0 0.0 4.23 1344 832 A 24 LYS H A 24 LYS HGy 1.0 0.0 4.23 1345 833 A 25 CYS HBx A 26 GLN HGy 1.0 0.0 5.50 1346 833 A 19 CYS HBx A 18 PRO HBy 1.0 0.0 5.50 1347 833 A 25 CYS HBx A 26 GLN HGx 1.0 0.0 5.50 1348 834 A 26 GLN HA A 26 GLN HGx 1.0 0.0 3.33 1349 834 A 26 GLN HA A 26 GLN HGy 1.0 0.0 3.33 1350 835 A 26 GLN HA A 62 SER HBy 1.0 0.0 5.16 1351 835 A 62 SER HBx A 26 GLN HA 1.0 0.0 5.16 1352 836 A 29 GLU HBy A 61 GLY HAy 1.0 0.0 5.50 1353 836 A 29 GLU HBy A 61 GLY HAx 1.0 0.0 5.50 1354 836 A 29 GLU HBy A 30 GLY HAy 1.0 0.0 5.50 1355 836 A 29 GLU HBx A 61 GLY HAy 1.0 0.0 5.50 1356 836 A 29 GLU HBx A 61 GLY HAx 1.0 0.0 5.50 1357 837 A 29 GLU HGy A 61 GLY HAy 1.0 0.0 5.50 1358 837 A 61 GLY HAx A 29 GLU HGy 1.0 0.0 5.50 1359 837 A 29 GLU HGx A 61 GLY HAy 1.0 0.0 5.50 1360 837 A 61 GLY HAx A 29 GLU HGx 1.0 0.0 5.50 1361 838 A 33 CYS H A 37 LYS HGx 1.0 0.0 5.50 1362 838 A 37 LYS HGy A 33 CYS H 1.0 0.0 5.50 1363 838 A 34 ALA HB% A 33 CYS H 1.0 0.0 5.50 1364 839 A 33 CYS HBx A 37 LYS HBy 1.0 0.0 5.45 1365 839 A 33 CYS HBy A 37 LYS HBx 1.0 0.0 5.45 1366 839 A 33 CYS HBx A 37 LYS HBx 1.0 0.0 5.45 1367 840 A 34 ALA HA A 37 LYS HBx 1.0 0.0 4.91 1368 840 A 34 ALA HA A 37 LYS HDy 1.0 0.0 4.91 1369 840 A 34 ALA HA A 37 LYS HBy 1.0 0.0 4.91 1370 841 A 35 ALA H A 37 LYS HDy 1.0 0.0 5.50 1371 841 A 35 ALA H A 37 LYS HBx 1.0 0.0 5.50 1372 841 A 37 LYS HBy A 35 ALA H 1.0 0.0 5.50 1373 842 A 37 LYS HBy A 36 CYS H 1.0 0.0 4.92 1374 842 A 36 CYS H A 37 LYS HBx 1.0 0.0 4.92 1375 843 A 37 LYS HGy A 38 THR H 1.0 0.0 4.68 1376 843 A 38 THR H A 37 LYS HGx 1.0 0.0 4.68 1377 844 A 42 THR HB A 44 ASP HBy 1.0 0.0 5.31 1378 844 A 42 THR HB A 44 ASP HBx 1.0 0.0 5.31 1379 845 A 42 THR HG2% A 44 ASP HBy 1.0 0.0 4.95 1380 845 A 44 ASP HBx A 42 THR HG2% 1.0 0.0 4.95 1381 846 A 46 CYS HBy A 51 GLU HBy 1.0 0.0 5.50 1382 846 A 46 CYS HBy A 51 GLU HGy 1.0 0.0 5.50 1383 846 A 51 GLU HGx A 46 CYS HBy 1.0 0.0 5.50 1384 846 A 46 CYS HBx A 51 GLU HBx 1.0 0.0 5.50 1385 846 A 46 CYS HBx A 51 GLU HBy 1.0 0.0 5.50 1386 846 A 51 GLU HBx A 46 CYS HBy 1.0 0.0 5.50 1387 847 A 48 CYS HBy A 65 SER HBx 1.0 0.0 5.34 1388 847 A 48 CYS HBy A 65 SER HBy 1.0 0.0 5.34 1389 848 A 59 LYS HA A 59 LYS HGy 1.0 0.0 3.65 1390 848 A 59 LYS HGx A 59 LYS HA 1.0 0.0 3.65 1391 849 A 16 SER H A 17 GLU H 1.0 0.0 4.80 1392 850 A 18 PRO HBy A 19 CYS H 1.0 0.0 3.52 1393 851 A 47 LYS HA A 48 CYS H 1.0 0.0 3.45 1394 852 A 48 CYS H A 49 GLY HAy 1.0 0.0 5.11 1395 852 A 49 GLY HAx A 48 CYS H 1.0 0.0 5.11 1396 853 A 21 CYS HBy A 25 CYS H 1.0 0.0 4.21 1397 854 A 52 CYS HBx A 54 GLY H 1.0 0.0 3.86 1398 855 A 12 SER HBx A 13 ALA H 1.0 0.0 5.21 1399 855 A 13 ALA H A 12 SER HBy 1.0 0.0 5.21 1400 856 A 66 CYS HBx A 41 CYS H 1.0 0.0 3.58 1401 857 A 11 THR HG2% A 28 GLY H 1.0 0.0 4.84 1402 858 A 52 CYS HBx A 59 LYS H 1.0 0.0 4.31 1403 859 A 59 LYS H A 59 LYS HBy 1.0 0.0 3.85 1404 859 A 59 LYS HBx A 59 LYS H 1.0 0.0 3.85 1405 860 A 60 CYS H A 59 LYS HGy 1.0 0.0 5.50 1406 860 A 59 LYS HGx A 60 CYS H 1.0 0.0 5.50 1407 861 A 46 CYS H A 45 GLY H 1.0 0.0 4.18 1408 862 A 50 LYS HBx A 50 LYS H 1.0 0.0 2.91 1409 863 A 48 CYS H A 50 LYS H 1.0 0.0 4.03 1410 864 A 15 ARG H A 14 CYS H 1.0 0.0 3.07 1411 865 A 55 PRO HBy A 37 LYS H 1.0 0.0 5.50 1412 865 A 55 PRO HBx A 37 LYS H 1.0 0.0 5.50 1413 866 A 49 GLY H A 49 GLY HAy 1.0 0.0 2.89 1414 867 A 48 CYS HBx A 49 GLY H 1.0 0.0 4.87 1415 868 A 52 CYS H A 46 CYS HBy 1.0 0.0 4.28 1416 868 A 46 CYS HBx A 52 CYS H 1.0 0.0 4.28 1417 869 A 25 CYS HBx A 22 GLY HAx 1.0 0.0 5.50 1418 869 A 22 GLY HAx A 25 CYS HBy 1.0 0.0 5.50 1419 869 A 22 GLY HAy A 25 CYS HBy 1.0 0.0 5.50 1420 870 A 31 CYS H A 37 LYS HDy 1.0 0.0 5.50 1421 870 A 15 ARG HGy A 16 SER H 1.0 0.0 5.50 1422 871 A 38 THR HA A 55 PRO HGx 1.0 0.0 5.44 1423 871 A 54 GLY HAx A 55 PRO HGy 1.0 0.0 5.44 1424 871 A 38 THR HA A 55 PRO HGy 1.0 0.0 5.44 1425 872 A 15 ARG HA A 6 LYS HGy 1.0 0.0 5.50 1426 872 A 6 LYS HGx A 7 GLY HAy 1.0 0.0 5.50 1427 872 A 15 ARG HA A 6 LYS HGx 1.0 0.0 5.50 1428 872 A 7 GLY HAx A 6 LYS HGx 1.0 0.0 5.50 1429 872 A 7 GLY HAy A 9 LYS HGx 1.0 0.0 5.50 1430 872 A 7 GLY HAx A 9 LYS HGx 1.0 0.0 5.50 1431 872 A 7 GLY HAx A 6 LYS HGy 1.0 0.0 5.50 1432 872 A 8 GLU HA A 9 LYS HGx 1.0 0.0 5.50 1433 872 A 6 LYS HGy A 7 GLY HAy 1.0 0.0 5.50 1434 873 A 25 CYS HA A 25 CYS HBy 1.0 0.0 3.02 1435 874 A 52 CYS HBx A 60 CYS H 1.0 0.0 5.50 1436 875 A 20 GLN HGx A 13 ALA HA 1.0 0.0 4.75 1437 875 A 20 GLN HBx A 13 ALA HA 1.0 0.0 4.75 1438 876 A 23 SER HA A 25 CYS HBy 1.0 0.0 5.50 1439 876 A 25 CYS HBx A 23 SER HA 1.0 0.0 5.50 1440 877 A 32 THR H A 37 LYS HGx 1.0 0.0 5.50 1441 877 A 38 THR H A 37 LYS HGx 1.0 0.0 5.50 1442 877 A 37 LYS HGy A 38 THR H 1.0 0.0 5.50 1443 878 A 20 GLN HGy A 16 SER HBx 1.0 0.0 4.06 1444 878 A 16 SER HBy A 20 GLN HGy 1.0 0.0 4.06 1445 879 A 41 CYS HBy A 41 CYS H 1.0 0.0 3.60 1446 880 A 31 CYS HBx A 31 CYS H 1.0 0.0 3.57 1447 880 A 31 CYS H A 31 CYS HBy 1.0 0.0 3.57 1448 881 A 6 LYS HGy A 33 CYS HBy 1.0 0.0 5.50 1449 881 A 60 CYS HBy A 67 LYS HDx 1.0 0.0 5.50 1450 881 A 6 LYS HGx A 33 CYS HBy 1.0 0.0 5.50 1451 882 A 60 CYS HBy A 59 LYS H 1.0 0.0 5.09 1452 883 A 29 GLU HBy A 30 GLY HAy 1.0 0.0 5.41 1453 883 A 29 GLU HBy A 30 GLY HAx 1.0 0.0 5.41 1454 883 A 29 GLU HBx A 28 GLY HAx 1.0 0.0 5.41 1455 884 A 44 ASP HA A 44 ASP HBy 1.0 0.0 3.01 1456 885 A 46 CYS HA A 47 LYS HGy 1.0 0.0 4.45 1457 885 A 46 CYS HA A 47 LYS HGx 1.0 0.0 4.45 1458 886 A 52 CYS HA A 53 THR H 1.0 0.0 2.76 1459 887 A 21 CYS HBx A 36 CYS HBx 1.0 0.0 3.47 1460 888 A 32 THR HA A 37 LYS HGy 1.0 0.0 4.97 1461 888 A 38 THR HA A 37 LYS HGy 1.0 0.0 4.97 1462 888 A 32 THR HA A 37 LYS HGx 1.0 0.0 4.97 1463 889 A 62 SER HBx A 67 LYS HDx 1.0 0.0 5.50 1464 889 A 67 LYS HDx A 62 SER HBy 1.0 0.0 5.50 1465 890 A 56 ASP H A 56 ASP HBy 1.0 0.0 3.88 1466 891 A 14 CYS HA A 36 CYS HBx 1.0 0.0 5.50 1467 891 A 14 CYS HA A 21 CYS HA 1.0 0.0 5.50 1468 892 A 51 GLU HA A 46 CYS HBy 1.0 0.0 3.64 1469 893 A 46 CYS HBx A 51 GLU HBx 1.0 0.0 5.50 1470 893 A 46 CYS HBx A 51 GLU HBy 1.0 0.0 5.50 1471 894 A 50 LYS HGx A 50 LYS H 1.0 0.0 4.55 1472 895 A 14 CYS HBx A 11 THR HG2% 1.0 0.0 4.74 1473 896 A 29 GLU HA A 29 GLU HGy 1.0 0.0 4.18 1474 896 A 29 GLU HGx A 29 GLU HA 1.0 0.0 4.18 1475 897 A 39 CYS HBx A 55 PRO HDy 1.0 0.0 4.29 1476 898 A 37 LYS HBy A 33 CYS H 1.0 0.0 5.50 1477 899 A 38 THR H A 37 LYS HBx 1.0 0.0 4.70 1478 899 A 37 LYS HBy A 38 THR H 1.0 0.0 4.70 1479 900 A 50 LYS HA A 51 GLU HGy 1.0 0.0 5.50 1480 900 A 51 GLU HGx A 50 LYS HA 1.0 0.0 5.50 1481 901 A 48 CYS HBy A 40 ASN HBx 1.0 0.0 5.50 1482 901 A 48 CYS HBy A 40 ASN HBy 1.0 0.0 5.50 1483 902 A 38 THR HG2% A 67 LYS HA 1.0 0.0 4.37 1484 903 A 48 CYS HBx A 66 CYS HBx 1.0 0.0 4.75 1485 904 A 55 PRO HA A 37 LYS HGy 1.0 0.0 4.50 1486 904 A 55 PRO HA A 37 LYS HGx 1.0 0.0 4.50 1487 905 A 55 PRO HA A 37 LYS HGy 1.0 0.0 5.36 1488 905 A 55 PRO HA A 37 LYS HGx 1.0 0.0 5.36 1489 906 A 8 GLU HA A 8 GLU HBx 1.0 0.0 2.67 1490 906 A 8 GLU HA A 8 GLU HBy 1.0 0.0 2.67 1491 907 A 12 SER HBx A 15 ARG H 1.0 0.0 5.33 1492 907 A 15 ARG H A 12 SER HBy 1.0 0.0 5.33 1493 908 A 16 SER HBy A 17 GLU H 1.0 0.0 3.33 1494 908 A 17 GLU H A 16 SER HBx 1.0 0.0 3.33 1495 909 A 29 GLU HBy A 61 GLY HAy 1.0 0.0 5.50 1496 909 A 29 GLU HBy A 61 GLY HAx 1.0 0.0 5.50 1497 909 A 29 GLU HBx A 61 GLY HAy 1.0 0.0 5.50 1498 909 A 29 GLU HBx A 61 GLY HAx 1.0 0.0 5.50 1499 910 A 51 GLU HA A 51 GLU HGy 1.0 0.0 4.25 1500 910 A 51 GLU HA A 51 GLU HGx 1.0 0.0 4.25 1501 911 A 6 LYS HA A 7 GLY H 1.0 0.0 3.42 1502 912 A 8 GLU HA A 8 GLU HGx 1.0 0.0 4.13 1503 912 A 8 GLU HA A 8 GLU HGy 1.0 0.0 4.13 1504 913 A 8 GLU HA A 10 CYS H 1.0 0.0 4.66 1505 914 A 31 CYS HA A 7 GLY H 1.0 0.0 5.50 1506 914 A 31 CYS HA A 30 GLY H 1.0 0.0 5.50 1507 915 A 39 CYS HBx A 38 THR HG2% 1.0 0.0 5.50 1508 915 A 38 THR HG2% A 55 PRO HBx 1.0 0.0 5.50 1509 915 A 39 CYS HBy A 38 THR HG2% 1.0 0.0 5.50 1510 915 A 55 PRO HBy A 38 THR HG2% 1.0 0.0 5.50 1511 916 A 9 LYS HBx A 28 GLY HAx 1.0 0.0 4.13 1512 917 A 14 CYS HBy A 11 THR HG2% 1.0 0.0 5.45 1513 918 A 54 GLY H A 57 SER H 1.0 0.0 5.50 1514 919 A 24 LYS HGx A 23 SER HBy 1.0 0.0 5.50 1515 919 A 24 LYS HGx A 23 SER HBx 1.0 0.0 5.50 1516 919 A 23 SER HBx A 24 LYS HGy 1.0 0.0 5.50 1517 919 A 23 SER HBy A 24 LYS HGy 1.0 0.0 5.50 1518 920 A 60 CYS HBy A 61 GLY HAy 1.0 0.0 4.97 1519 920 A 60 CYS HBy A 61 GLY HAx 1.0 0.0 4.97 1520 921 A 6 LYS HA A 7 GLY HAy 1.0 0.0 5.16 1521 921 A 7 GLY HAx A 6 LYS HA 1.0 0.0 5.16 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin undefined _nef_distance_restraint_list.potential_type . save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _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 16 SER H A 16 SER HBx 1.0 . 3.63 2 2 A 16 SER HBy A 16 SER H 1.0 . 0.00 3 2 A 16 SER H A 16 SER HBx 1.0 . 0.00 4 3 A 16 SER H A 15 ARG HBy 1.0 . 4.18 5 4 A 20 GLN HBy A 16 SER H 1.0 . 5.24 6 5 A 15 ARG HGy A 16 SER H 1.0 . 0.00 7 5 A 16 SER H A 15 ARG HGx 1.0 . 0.00 8 6 A 15 ARG HBx A 16 SER H 1.0 . 0.00 9 6 A 16 SER H A 15 ARG HBy 1.0 . 0.00 10 7 A 13 ALA HB% A 16 SER H 1.0 . 5.00 11 8 A 14 CYS HA A 16 SER H 1.0 . 4.22 12 9 A 16 SER H A 13 ALA H 1.0 . 5.50 13 10 A 16 SER H A 15 ARG H 1.0 . 3.17 14 11 A 18 PRO HDy A 19 CYS H 1.0 . 0.00 15 12 A 19 CYS HBx A 19 CYS H 1.0 . 2.90 16 13 A 18 PRO HBx A 19 CYS H 1.0 . 3.20 17 14 A 35 ALA HB% A 19 CYS H 1.0 . 3.85 18 15 A 49 GLY HAx A 48 CYS H 1.0 . 0.00 19 15 A 48 CYS H A 49 GLY HAy 1.0 . 0.00 20 16 A 48 CYS H A 49 GLY HAy 1.0 . 0.00 21 17 A 48 CYS HBx A 48 CYS H 1.0 . 4.00 22 18 A 46 CYS HBx A 48 CYS H 1.0 . 0.00 23 18 A 48 CYS H A 46 CYS HBy 1.0 . 0.00 24 19 A 48 CYS H A 46 CYS HBy 1.0 . 0.00 25 20 A 47 LYS HBx A 48 CYS H 1.0 . 4.22 26 21 A 48 CYS H A 47 LYS H 1.0 . 3.01 27 22 A 24 LYS HA A 25 CYS H 1.0 . 3.18 28 23 A 21 CYS HA A 25 CYS H 1.0 . 4.83 29 24 A 25 CYS H A 25 CYS HBy 1.0 . 3.21 30 25 A 25 CYS HBx A 25 CYS H 1.0 . 0.00 31 25 A 25 CYS H A 25 CYS HBy 1.0 . 0.00 32 26 A 25 CYS H A 24 LYS HBx 1.0 . 0.00 33 27 A 24 LYS HBy A 25 CYS H 1.0 . 0.00 34 27 A 25 CYS H A 24 LYS HBx 1.0 . 0.00 35 28 A 25 CYS H A 24 LYS HBx 1.0 . 4.89 36 29 A 25 CYS H A 24 LYS HGy 1.0 . 5.50 37 30 A 24 LYS HGx A 25 CYS H 1.0 . 0.00 38 30 A 25 CYS H A 24 LYS HGy 1.0 . 0.00 39 31 A 25 CYS H A 26 GLN H 1.0 . 4.63 40 32 A 53 THR HB A 54 GLY H 1.0 . 5.33 41 33 A 58 CYS HA A 54 GLY H 1.0 . 0.00 42 34 A 53 THR HA A 54 GLY H 1.0 . 3.29 43 35 A 39 CYS HBx A 54 GLY H 1.0 . 0.00 44 36 A 53 THR HG2% A 54 GLY H 1.0 . 4.56 45 37 A 54 GLY H A 53 THR H 1.0 . 3.58 46 38 A 54 GLY H A 42 THR H 1.0 . 5.37 47 39 A 26 GLN H A 25 CYS HBy 1.0 . 5.50 48 40 A 27 CYS HBy A 26 GLN H 1.0 . 0.00 49 41 A 25 CYS HBx A 26 GLN H 1.0 . 0.00 50 41 A 26 GLN H A 25 CYS HBy 1.0 . 0.00 51 42 A 14 CYS HBx A 26 GLN H 1.0 . 0.00 52 43 A 26 GLN HBy A 26 GLN H 1.0 . 3.41 53 44 A 42 THR HB A 44 ASP H 1.0 . 3.68 54 45 A 53 THR HB A 44 ASP H 1.0 . 5.50 55 46 A 44 ASP H A 45 GLY HAy 1.0 . 0.00 56 47 A 45 GLY HAx A 44 ASP H 1.0 . 0.00 57 47 A 44 ASP H A 45 GLY HAy 1.0 . 0.00 58 48 A 44 ASP HBx A 44 ASP H 1.0 . 3.65 59 49 A 44 ASP HBx A 44 ASP H 1.0 . 0.00 60 49 A 44 ASP H A 44 ASP HBy 1.0 . 0.00 61 50 A 42 THR HG2% A 44 ASP H 1.0 . 4.50 62 51 A 42 THR H A 44 ASP H 1.0 . 5.08 63 52 A 44 ASP H A 43 SER H 1.0 . 4.15 64 53 A 39 CYS HA A 40 ASN HD2y 1.0 . 4.42 65 54 A 40 ASN HD2y A 66 CYS HA 1.0 . 5.03 66 55 A 66 CYS HA A 40 ASN HD2x 1.0 . 0.00 67 56 A 60 CYS HBy A 61 GLY H 1.0 . 3.97 68 57 A 29 GLU HBy A 61 GLY H 1.0 . 0.00 69 58 A 61 GLY H A 60 CYS H 1.0 . 4.89 70 59 A 38 THR HA A 39 CYS H 1.0 . 2.54 71 60 A 21 CYS HA A 24 LYS H 1.0 . 4.85 72 61 A 39 CYS HBx A 39 CYS H 1.0 . 3.49 73 62 A 21 CYS HBx A 24 LYS H 1.0 . 5.50 74 63 A 39 CYS HBx A 39 CYS H 1.0 . 0.00 75 64 A 24 LYS H A 24 LYS HBx 1.0 . 3.48 76 65 A 38 THR HG2% A 39 CYS H 1.0 . 4.33 77 66 A 24 LYS H A 22 GLY H 1.0 . 4.92 78 67 A 57 SER H A 57 SER HBx 1.0 . 4.10 79 68 A 55 PRO HA A 57 SER H 1.0 . 4.41 80 69 A 57 SER H A 57 SER HBx 1.0 . 0.00 81 70 A 57 SER HBy A 57 SER H 1.0 . 0.00 82 70 A 57 SER H A 57 SER HBx 1.0 . 0.00 83 71 A 57 SER H A 58 CYS HBx 1.0 . 4.31 84 72 A 58 CYS HBy A 57 SER H 1.0 . 0.00 85 72 A 57 SER H A 58 CYS HBx 1.0 . 0.00 86 73 A 56 ASP HBx A 57 SER H 1.0 . 4.63 87 74 A 56 ASP HBx A 57 SER H 1.0 . 0.00 88 74 A 57 SER H A 56 ASP HBy 1.0 . 0.00 89 75 A 57 SER H A 58 CYS H 1.0 . 3.10 90 76 A 57 SER H A 56 ASP H 1.0 . 4.01 91 77 A 46 CYS H A 45 GLY HAy 1.0 . 0.00 92 78 A 51 GLU HA A 46 CYS H 1.0 . 5.50 93 79 A 53 THR HA A 46 CYS H 1.0 . 0.00 94 80 A 46 CYS H A 45 GLY HAy 1.0 . 3.33 95 81 A 45 GLY HAx A 46 CYS H 1.0 . 0.00 96 81 A 46 CYS H A 45 GLY HAy 1.0 . 0.00 97 82 A 46 CYS H A 46 CYS HBy 1.0 . 3.40 98 83 A 46 CYS HBx A 46 CYS H 1.0 . 0.00 99 83 A 46 CYS H A 46 CYS HBy 1.0 . 0.00 100 84 A 53 THR HG2% A 46 CYS H 1.0 . 3.43 101 85 A 47 LYS H A 46 CYS H 1.0 . 4.88 102 86 A 10 CYS HA A 27 CYS H 1.0 . 5.15 103 87 A 27 CYS HBy A 27 CYS H 1.0 . 2.93 104 88 A 26 GLN HBy A 27 CYS H 1.0 . 4.28 105 89 A 11 THR HG2% A 27 CYS H 1.0 . 3.79 106 90 A 27 CYS H A 28 GLY H 1.0 . 4.89 107 91 A 27 CYS H A 11 THR H 1.0 . 5.39 108 92 A 14 CYS HBx A 14 CYS H 1.0 . 2.93 109 93 A 15 ARG HGy A 14 CYS H 1.0 . 0.00 110 93 A 14 CYS H A 15 ARG HGx 1.0 . 0.00 111 94 A 13 ALA HB% A 14 CYS H 1.0 . 3.28 112 95 A 32 THR HA A 33 CYS H 1.0 . 3.50 113 96 A 31 CYS HA A 33 CYS H 1.0 . 4.73 114 97 A 33 CYS H A 33 CYS HBy 1.0 . 0.00 115 98 A 33 CYS HBx A 33 CYS H 1.0 . 0.00 116 98 A 33 CYS H A 33 CYS HBy 1.0 . 0.00 117 99 A 33 CYS H A 31 CYS HBy 1.0 . 5.28 118 100 A 31 CYS HBx A 33 CYS H 1.0 . 0.00 119 100 A 33 CYS H A 31 CYS HBy 1.0 . 0.00 120 101 A 33 CYS H A 33 CYS HBy 1.0 . 2.93 121 102 A 32 THR HG2% A 33 CYS H 1.0 . 4.47 122 103 A 33 CYS H A 32 THR H 1.0 . 3.58 123 104 A 33 CYS H A 31 CYS H 1.0 . 5.50 124 105 A 33 CYS H A 36 CYS H 1.0 . 0.00 125 106 A 20 GLN HE2y A 16 SER HBx 1.0 . 0.00 126 107 A 16 SER HBy A 20 GLN HE2y 1.0 . 0.00 127 107 A 20 GLN HE2y A 16 SER HBx 1.0 . 0.00 128 108 A 16 SER HBy A 20 GLN HE2x 1.0 . 0.00 129 108 A 20 GLN HE2x A 16 SER HBx 1.0 . 0.00 130 108 A 16 SER HBy A 20 GLN HE2y 1.0 . 0.00 131 108 A 20 GLN HE2y A 16 SER HBx 1.0 . 0.00 132 109 A 18 PRO HDy A 20 GLN HE2y 1.0 . 4.69 133 110 A 18 PRO HDy A 20 GLN HE2x 1.0 . 0.00 134 111 A 18 PRO HDy A 20 GLN HE2y 1.0 . 0.00 135 111 A 18 PRO HDy A 20 GLN HE2x 1.0 . 0.00 136 112 A 35 ALA H A 33 CYS HBy 1.0 . 0.00 137 113 A 33 CYS HBx A 35 ALA H 1.0 . 0.00 138 113 A 35 ALA H A 33 CYS HBy 1.0 . 0.00 139 114 A 19 CYS HBx A 35 ALA H 1.0 . 5.50 140 115 A 35 ALA H A 33 CYS HBy 1.0 . 5.24 141 116 A 35 ALA HB% A 35 ALA H 1.0 . 2.75 142 117 A 36 CYS H A 35 ALA H 1.0 . 2.92 143 118 A 36 CYS HA A 35 ALA H 1.0 . 5.29 144 119 A 20 GLN HA A 22 GLY H 1.0 . 5.09 145 120 A 22 GLY H A 25 CYS HBy 1.0 . 0.00 146 121 A 25 CYS HBx A 22 GLY H 1.0 . 0.00 147 121 A 22 GLY H A 25 CYS HBy 1.0 . 0.00 148 122 A 21 CYS HBx A 22 GLY H 1.0 . 3.95 149 123 A 22 GLY H A 21 CYS H 1.0 . 3.47 150 124 A 10 CYS HA A 11 THR H 1.0 . 2.85 151 125 A 12 SER HA A 11 THR H 1.0 . 5.38 152 126 A 14 CYS HBx A 11 THR H 1.0 . 3.72 153 127 A 15 ARG HGy A 11 THR H 1.0 . 0.00 154 127 A 11 THR H A 15 ARG HGx 1.0 . 0.00 155 128 A 11 THR H A 15 ARG HGx 1.0 . 5.50 156 129 A 11 THR HG2% A 11 THR H 1.0 . 3.10 157 130 A 26 GLN H A 11 THR H 1.0 . 5.50 158 131 A 27 CYS H A 11 THR H 1.0 . 0.00 159 132 A 28 GLY H A 11 THR H 1.0 . 5.50 160 133 A 13 ALA H A 11 THR H 1.0 . 4.96 161 134 A 15 ARG H A 11 THR H 1.0 . 4.85 162 135 A 11 THR HA A 13 ALA H 1.0 . 4.77 163 136 A 13 ALA HB% A 13 ALA H 1.0 . 3.05 164 137 A 13 ALA H A 14 CYS H 1.0 . 3.72 165 138 A 53 THR HB A 53 THR H 1.0 . 4.12 166 139 A 52 CYS HBx A 53 THR H 1.0 . 3.91 167 140 A 53 THR HG2% A 53 THR H 1.0 . 3.56 168 141 A 65 SER HA A 67 LYS H 1.0 . 4.14 169 142 A 64 CYS HBx A 67 LYS H 1.0 . 0.00 170 143 A 67 LYS H A 67 LYS HEx 1.0 . 5.50 171 144 A 67 LYS H A 67 LYS HEx 1.0 . 0.00 172 144 A 67 LYS H A 67 LYS HEy 1.0 . 0.00 173 145 A 67 LYS HBx A 67 LYS H 1.0 . 2.93 174 146 A 67 LYS HGx A 67 LYS H 1.0 . 3.04 175 147 A 40 ASN HD2y A 67 LYS H 1.0 . 5.50 176 148 A 40 ASN HD2x A 67 LYS H 1.0 . 0.00 177 149 A 54 GLY HAx A 41 CYS H 1.0 . 4.70 178 150 A 41 CYS HBx A 41 CYS H 1.0 . 2.87 179 151 A 39 CYS HBx A 41 CYS H 1.0 . 0.00 180 152 A 42 THR HG2% A 41 CYS H 1.0 . 4.89 181 153 A 42 THR H A 41 CYS H 1.0 . 4.65 182 154 A 54 GLY H A 41 CYS H 1.0 . 4.77 183 155 A 66 CYS HA A 41 CYS H 1.0 . 4.68 184 156 A 41 CYS H A 40 ASN H 1.0 . 3.09 185 157 A 27 CYS HA A 28 GLY H 1.0 . 2.77 186 158 A 31 CYS HA A 28 GLY H 1.0 . 5.50 187 159 A 61 GLY HAx A 28 GLY H 1.0 . 0.00 188 159 A 28 GLY H A 61 GLY HAy 1.0 . 0.00 189 160 A 28 GLY H A 61 GLY HAy 1.0 . 0.00 190 161 A 28 GLY H A 31 CYS HBy 1.0 . 4.69 191 162 A 31 CYS HBx A 28 GLY H 1.0 . 0.00 192 162 A 28 GLY H A 31 CYS HBy 1.0 . 0.00 193 163 A 9 LYS HBx A 28 GLY H 1.0 . 4.64 194 164 A 9 LYS HGy A 28 GLY H 1.0 . 0.00 195 164 A 28 GLY H A 9 LYS HGx 1.0 . 0.00 196 165 A 28 GLY H A 10 CYS H 1.0 . 4.58 197 166 A 20 GLN H A 16 SER HBx 1.0 . 4.19 198 167 A 16 SER HBy A 20 GLN H 1.0 . 0.00 199 167 A 20 GLN H A 16 SER HBx 1.0 . 0.00 200 168 A 21 CYS HA A 20 GLN H 1.0 . 4.79 201 169 A 21 CYS HBx A 20 GLN H 1.0 . 4.81 202 170 A 20 GLN HGx A 20 GLN H 1.0 . 3.52 203 171 A 20 GLN HBy A 20 GLN H 1.0 . 3.12 204 172 A 13 ALA HB% A 20 GLN H 1.0 . 3.94 205 173 A 16 SER H A 20 GLN H 1.0 . 4.96 206 174 A 14 CYS H A 20 GLN H 1.0 . 0.00 207 175 A 14 CYS HA A 20 GLN H 1.0 . 3.80 208 176 A 42 THR HB A 43 SER H 1.0 . 3.04 209 177 A 43 SER HBy A 43 SER H 1.0 . 0.00 210 177 A 43 SER H A 43 SER HBx 1.0 . 0.00 211 178 A 42 THR HG2% A 43 SER H 1.0 . 3.95 212 179 A 32 THR HB A 31 CYS H 1.0 . 5.50 213 180 A 29 GLU HBy A 31 CYS H 1.0 . 5.50 214 181 A 9 LYS HBx A 31 CYS H 1.0 . 5.50 215 182 A 31 CYS H A 37 LYS HDx 1.0 . 0.00 216 182 A 31 CYS H A 37 LYS HDy 1.0 . 0.00 217 183 A 31 CYS H A 37 LYS HDx 1.0 . 0.00 218 184 A 31 CYS H A 30 GLY H 1.0 . 4.14 219 185 A 60 CYS HA A 59 LYS H 1.0 . 4.82 220 186 A 59 LYS H A 59 LYS HBy 1.0 . 3.85 221 187 A 59 LYS H A 59 LYS HGy 1.0 . 5.14 222 188 A 59 LYS HGx A 59 LYS H 1.0 . 0.00 223 188 A 59 LYS H A 59 LYS HGy 1.0 . 0.00 224 189 A 20 GLN HA A 21 CYS H 1.0 . 3.50 225 190 A 58 CYS HA A 60 CYS H 1.0 . 4.12 226 191 A 21 CYS H A 22 GLY HAx 1.0 . 5.40 227 192 A 22 GLY HAy A 21 CYS H 1.0 . 0.00 228 192 A 21 CYS H A 22 GLY HAx 1.0 . 0.00 229 193 A 21 CYS HBx A 21 CYS H 1.0 . 2.91 230 194 A 60 CYS HBy A 60 CYS H 1.0 . 2.90 231 195 A 60 CYS H A 59 LYS HBy 1.0 . 4.99 232 196 A 59 LYS HBx A 60 CYS H 1.0 . 0.00 233 196 A 60 CYS H A 59 LYS HBy 1.0 . 0.00 234 197 A 20 GLN HBy A 21 CYS H 1.0 . 4.99 235 198 A 60 CYS H A 59 LYS HBy 1.0 . 0.00 236 199 A 13 ALA HB% A 21 CYS H 1.0 . 3.94 237 200 A 21 CYS H A 20 GLN H 1.0 . 2.92 238 201 A 24 LYS H A 21 CYS H 1.0 . 5.50 239 202 A 19 CYS H A 21 CYS H 1.0 . 0.00 240 203 A 14 CYS H A 21 CYS H 1.0 . 5.50 241 204 A 60 CYS H A 58 CYS H 1.0 . 0.00 242 205 A 60 CYS H A 59 LYS H 1.0 . 2.87 243 206 A 43 SER HA A 45 GLY H 1.0 . 3.99 244 207 A 44 ASP HBx A 45 GLY H 1.0 . 4.25 245 208 A 44 ASP HBx A 45 GLY H 1.0 . 0.00 246 208 A 45 GLY H A 44 ASP HBy 1.0 . 0.00 247 209 A 42 THR HG2% A 45 GLY H 1.0 . 5.40 248 210 A 53 THR HG2% A 45 GLY H 1.0 . 3.67 249 211 A 42 THR H A 45 GLY H 1.0 . 4.01 250 212 A 51 GLU HA A 50 LYS H 1.0 . 4.63 251 213 A 50 LYS H A 50 LYS HEy 1.0 . 5.50 252 214 A 50 LYS H A 50 LYS HEy 1.0 . 0.00 253 214 A 50 LYS H A 50 LYS HEx 1.0 . 0.00 254 215 A 50 LYS H A 46 CYS HBy 1.0 . 0.00 255 216 A 46 CYS HBx A 50 LYS H 1.0 . 0.00 256 216 A 50 LYS H A 46 CYS HBy 1.0 . 0.00 257 217 A 50 LYS HGy A 50 LYS H 1.0 . 3.33 258 218 A 48 CYS HA A 50 LYS H 1.0 . 5.37 259 219 A 16 SER HA A 15 ARG H 1.0 . 5.45 260 220 A 15 ARG H A 15 ARG HBy 1.0 . 3.63 261 221 A 15 ARG HBx A 15 ARG H 1.0 . 0.00 262 221 A 15 ARG H A 15 ARG HBy 1.0 . 0.00 263 222 A 15 ARG HGy A 15 ARG H 1.0 . 0.00 264 222 A 15 ARG H A 15 ARG HGx 1.0 . 0.00 265 223 A 13 ALA HB% A 15 ARG H 1.0 . 4.96 266 224 A 29 GLU HBy A 30 GLY H 1.0 . 5.20 267 225 A 10 CYS H A 7 GLY HAy 1.0 . 5.50 268 226 A 27 CYS HA A 10 CYS H 1.0 . 0.00 269 227 A 8 GLU HA A 10 CYS H 1.0 . 0.00 270 228 A 7 GLY HAx A 10 CYS H 1.0 . 0.00 271 228 A 10 CYS H A 7 GLY HAy 1.0 . 0.00 272 229 A 10 CYS HBx A 10 CYS H 1.0 . 2.88 273 230 A 9 LYS HBx A 10 CYS H 1.0 . 3.91 274 231 A 10 CYS H A 9 LYS HGx 1.0 . 5.25 275 232 A 9 LYS HGy A 10 CYS H 1.0 . 0.00 276 232 A 10 CYS H A 9 LYS HGx 1.0 . 0.00 277 233 A 10 CYS H A 9 LYS H 1.0 . 3.38 278 234 A 37 LYS HA A 36 CYS H 1.0 . 5.07 279 235 A 36 CYS H A 33 CYS HBy 1.0 . 4.86 280 236 A 35 ALA HB% A 36 CYS H 1.0 . 3.11 281 237 A 36 CYS H A 34 ALA H 1.0 . 5.50 282 238 A 33 CYS H A 36 CYS H 1.0 . 0.00 283 239 A 36 CYS H A 37 LYS H 1.0 . 2.89 284 240 A 34 ALA HA A 37 LYS H 1.0 . 4.16 285 241 A 33 CYS HBx A 37 LYS H 1.0 . 0.00 286 241 A 37 LYS H A 33 CYS HBy 1.0 . 0.00 287 242 A 37 LYS H A 33 CYS HBy 1.0 . 0.00 288 243 A 37 LYS H A 33 CYS HBy 1.0 . 5.50 289 244 A 37 LYS HBy A 37 LYS H 1.0 . 0.00 290 244 A 37 LYS H A 37 LYS HBx 1.0 . 0.00 291 245 A 37 LYS H A 37 LYS HBx 1.0 . 0.00 292 246 A 35 ALA HB% A 37 LYS H 1.0 . 4.92 293 247 A 34 ALA HB% A 37 LYS H 1.0 . 0.00 294 248 A 38 THR HG2% A 37 LYS H 1.0 . 5.38 295 249 A 35 ALA H A 37 LYS H 1.0 . 4.03 296 250 A 16 SER HA A 17 GLU H 1.0 . 2.75 297 251 A 18 PRO HDy A 17 GLU H 1.0 . 5.27 298 252 A 32 THR HG2% A 32 THR H 1.0 . 4.04 299 253 A 28 GLY HAy A 29 GLU H 1.0 . 3.50 300 254 A 29 GLU H A 61 GLY HAy 1.0 . 5.42 301 255 A 61 GLY HAx A 29 GLU H 1.0 . 0.00 302 255 A 29 GLU H A 61 GLY HAy 1.0 . 0.00 303 256 A 29 GLU H A 9 LYS HEy 1.0 . 5.50 304 257 A 29 GLU H A 9 LYS HEy 1.0 . 0.00 305 257 A 29 GLU H A 9 LYS HEx 1.0 . 0.00 306 258 A 29 GLU H A 29 GLU HGy 1.0 . 3.52 307 259 A 29 GLU HGx A 29 GLU H 1.0 . 0.00 308 259 A 29 GLU H A 29 GLU HGy 1.0 . 0.00 309 260 A 9 LYS HGy A 29 GLU H 1.0 . 0.00 310 260 A 29 GLU H A 9 LYS HGx 1.0 . 0.00 311 261 A 28 GLY H A 29 GLU H 1.0 . 4.56 312 262 A 37 LYS HA A 38 THR H 1.0 . 2.53 313 263 A 38 THR HB A 38 THR H 1.0 . 3.68 314 264 A 38 THR H A 37 LYS HEy 1.0 . 5.50 315 265 A 38 THR H A 37 LYS HEy 1.0 . 0.00 316 265 A 38 THR H A 37 LYS HEx 1.0 . 0.00 317 266 A 55 PRO HBx A 38 THR H 1.0 . 0.00 318 267 A 38 THR H A 37 LYS HDx 1.0 . 0.00 319 267 A 37 LYS HDy A 38 THR H 1.0 . 0.00 320 268 A 38 THR H A 37 LYS HDx 1.0 . 0.00 321 269 A 37 LYS H A 38 THR H 1.0 . 4.73 322 270 A 39 CYS HA A 40 ASN H 1.0 . 2.57 323 271 A 39 CYS HBx A 40 ASN H 1.0 . 5.17 324 272 A 40 ASN HBy A 40 ASN H 1.0 . 2.84 325 273 A 39 CYS HBx A 40 ASN H 1.0 . 0.00 326 274 A 39 CYS H A 40 ASN H 1.0 . 4.55 327 275 A 40 ASN HD2y A 40 ASN H 1.0 . 3.87 328 276 A 40 ASN HD2x A 40 ASN H 1.0 . 0.00 329 277 A 40 ASN HD2x A 40 ASN H 1.0 . 4.35 330 278 A 40 ASN HD2y A 40 ASN H 1.0 . 0.00 331 279 A 54 GLY HAx A 56 ASP H 1.0 . 4.19 332 280 A 55 PRO HDy A 56 ASP H 1.0 . 0.00 333 281 A 56 ASP HBx A 56 ASP H 1.0 . 3.81 334 282 A 56 ASP HBx A 56 ASP H 1.0 . 0.00 335 282 A 56 ASP H A 56 ASP HBy 1.0 . 0.00 336 283 A 55 PRO HBx A 56 ASP H 1.0 . 4.84 337 284 A 58 CYS H A 56 ASP H 1.0 . 5.11 338 285 A 39 CYS HA A 40 ASN HD2x 1.0 . 4.96 339 286 A 40 ASN HD2x A 67 LYS HA 1.0 . 0.00 340 287 A 40 ASN HD2y A 67 LYS HA 1.0 . 0.00 341 288 A 39 CYS HA A 40 ASN HD2y 1.0 . 0.00 342 289 A 40 ASN HD2x A 40 ASN HBy 1.0 . 3.75 343 290 A 40 ASN HD2x A 38 THR HG2% 1.0 . 5.30 344 291 A 40 ASN HD2y A 38 THR HG2% 1.0 . 0.00 345 292 A 18 PRO HDy A 20 GLN HE2x 1.0 . 5.21 346 293 A 18 PRO HDy A 20 GLN HE2y 1.0 . 0.00 347 294 A 9 LYS H A 7 GLY HAy 1.0 . 4.94 348 295 A 7 GLY HAx A 9 LYS H 1.0 . 0.00 349 295 A 9 LYS H A 7 GLY HAy 1.0 . 0.00 350 296 A 10 CYS HBx A 9 LYS H 1.0 . 4.96 351 297 A 8 GLU HBy A 9 LYS H 1.0 . 0.00 352 297 A 9 LYS H A 8 GLU HBx 1.0 . 0.00 353 298 A 9 LYS HBx A 9 LYS H 1.0 . 3.43 354 299 A 9 LYS HGy A 9 LYS H 1.0 . 0.00 355 299 A 9 LYS H A 9 LYS HGx 1.0 . 0.00 356 300 A 34 ALA H A 33 CYS HBy 1.0 . 0.00 357 301 A 34 ALA H A 33 CYS HBy 1.0 . 4.84 358 302 A 33 CYS HBx A 34 ALA H 1.0 . 0.00 359 302 A 34 ALA H A 33 CYS HBy 1.0 . 0.00 360 303 A 34 ALA HB% A 34 ALA H 1.0 . 2.92 361 304 A 66 CYS HBx A 66 CYS H 1.0 . 4.38 362 305 A 64 CYS HA A 66 CYS H 1.0 . 0.00 363 306 A 66 CYS H A 65 SER HBx 1.0 . 4.65 364 307 A 65 SER HBy A 66 CYS H 1.0 . 0.00 365 307 A 66 CYS H A 65 SER HBx 1.0 . 0.00 366 308 A 48 CYS HBx A 66 CYS H 1.0 . 4.43 367 309 A 67 LYS HBx A 66 CYS H 1.0 . 5.07 368 310 A 67 LYS HGx A 66 CYS H 1.0 . 4.07 369 311 A 67 LYS H A 66 CYS H 1.0 . 3.04 370 312 A 48 CYS HA A 66 CYS H 1.0 . 5.38 371 313 A 62 SER H A 61 GLY HAy 1.0 . 3.24 372 314 A 61 GLY HAx A 62 SER H 1.0 . 0.00 373 314 A 62 SER H A 61 GLY HAy 1.0 . 0.00 374 315 A 62 SER HBx A 62 SER H 1.0 . 0.00 375 315 A 62 SER H A 62 SER HBy 1.0 . 0.00 376 316 A 62 SER HA A 62 SER H 1.0 . 0.00 377 317 A 62 SER H A 62 SER HBy 1.0 . 0.00 378 318 A 61 GLY H A 62 SER H 1.0 . 4.87 379 319 A 58 CYS H A 57 SER HBx 1.0 . 4.73 380 320 A 57 SER HBy A 58 CYS H 1.0 . 0.00 381 320 A 58 CYS H A 57 SER HBx 1.0 . 0.00 382 321 A 55 PRO HA A 58 CYS H 1.0 . 3.68 383 322 A 58 CYS H A 57 SER HBx 1.0 . 0.00 384 323 A 58 CYS H A 58 CYS HBx 1.0 . 3.19 385 324 A 58 CYS HBy A 58 CYS H 1.0 . 0.00 386 324 A 58 CYS H A 58 CYS HBx 1.0 . 0.00 387 325 A 56 ASP HBx A 58 CYS H 1.0 . 5.50 388 326 A 56 ASP HBx A 58 CYS H 1.0 . 0.00 389 326 A 58 CYS H A 56 ASP HBy 1.0 . 0.00 390 327 A 55 PRO HBx A 58 CYS H 1.0 . 5.50 391 328 A 39 CYS HBx A 58 CYS H 1.0 . 0.00 392 329 A 58 CYS H A 59 LYS HGy 1.0 . 5.50 393 330 A 58 CYS H A 37 LYS HGx 1.0 . 0.00 394 331 A 59 LYS HGx A 58 CYS H 1.0 . 0.00 395 331 A 58 CYS H A 59 LYS HGy 1.0 . 0.00 396 332 A 37 LYS HGy A 58 CYS H 1.0 . 0.00 397 332 A 58 CYS H A 37 LYS HGx 1.0 . 0.00 398 333 A 58 CYS H A 59 LYS H 1.0 . 4.69 399 334 A 47 LYS HA A 49 GLY H 1.0 . 4.54 400 335 A 46 CYS HBx A 49 GLY H 1.0 . 0.00 401 335 A 49 GLY H A 46 CYS HBy 1.0 . 0.00 402 336 A 47 LYS HBx A 49 GLY H 1.0 . 4.91 403 337 A 50 LYS HBx A 49 GLY H 1.0 . 0.00 404 338 A 50 LYS HGy A 49 GLY H 1.0 . 5.50 405 339 A 50 LYS H A 49 GLY H 1.0 . 3.12 406 340 A 47 LYS H A 49 GLY H 1.0 . 4.35 407 341 A 48 CYS H A 49 GLY H 1.0 . 2.81 408 342 A 49 GLY H A 51 GLU H 1.0 . 5.27 409 343 A 58 CYS HA A 52 CYS H 1.0 . 5.40 410 344 A 51 GLU HA A 52 CYS H 1.0 . 3.19 411 345 A 52 CYS HBx A 52 CYS H 1.0 . 3.72 412 346 A 52 CYS H A 51 GLU HBy 1.0 . 5.13 413 347 A 51 GLU HBx A 52 CYS H 1.0 . 0.00 414 347 A 52 CYS H A 51 GLU HBy 1.0 . 0.00 415 348 A 51 GLU HGx A 52 CYS H 1.0 . 0.00 416 348 A 52 CYS H A 51 GLU HGy 1.0 . 0.00 417 349 A 52 CYS H A 51 GLU HGy 1.0 . 0.00 418 350 A 52 CYS H A 51 GLU HBy 1.0 . 0.00 419 351 A 50 LYS HBx A 52 CYS H 1.0 . 0.00 420 352 A 50 LYS HGy A 52 CYS H 1.0 . 0.00 421 353 A 53 THR HG2% A 52 CYS H 1.0 . 5.17 422 354 A 51 GLU H A 52 CYS H 1.0 . 3.49 423 355 A 62 SER HA A 64 CYS H 1.0 . 4.10 424 356 A 63 SER HBx A 64 CYS H 1.0 . 0.00 425 356 A 64 CYS H A 63 SER HBy 1.0 . 0.00 426 357 A 64 CYS HBx A 64 CYS H 1.0 . 2.81 427 358 A 64 CYS H A 67 LYS HEx 1.0 . 0.00 428 358 A 67 LYS HEy A 64 CYS H 1.0 . 0.00 429 359 A 67 LYS HBx A 64 CYS H 1.0 . 4.29 430 360 A 67 LYS HGx A 64 CYS H 1.0 . 3.78 431 361 A 67 LYS H A 64 CYS H 1.0 . 4.80 432 362 A 64 CYS H A 65 SER H 1.0 . 4.77 433 363 A 64 CYS H A 63 SER H 1.0 . 3.88 434 364 A 50 LYS HA A 51 GLU H 1.0 . 3.53 435 365 A 51 GLU H A 49 GLY HAy 1.0 . 4.92 436 366 A 51 GLU HA A 51 GLU H 1.0 . 2.91 437 367 A 49 GLY HAx A 51 GLU H 1.0 . 0.00 438 367 A 51 GLU H A 49 GLY HAy 1.0 . 0.00 439 368 A 51 GLU H A 49 GLY HAy 1.0 . 0.00 440 369 A 51 GLU H A 46 CYS HBy 1.0 . 0.00 441 370 A 51 GLU H A 51 GLU HBy 1.0 . 3.77 442 371 A 51 GLU HBx A 51 GLU H 1.0 . 0.00 443 371 A 51 GLU H A 51 GLU HBy 1.0 . 0.00 444 372 A 51 GLU H A 51 GLU HGy 1.0 . 4.32 445 373 A 51 GLU HGx A 51 GLU H 1.0 . 0.00 446 373 A 51 GLU H A 51 GLU HGy 1.0 . 0.00 447 374 A 50 LYS HGy A 51 GLU H 1.0 . 4.90 448 375 A 50 LYS H A 51 GLU H 1.0 . 3.57 449 376 A 48 CYS H A 51 GLU H 1.0 . 5.50 450 377 A 46 CYS HA A 42 THR H 1.0 . 4.68 451 378 A 42 THR HB A 42 THR H 1.0 . 0.00 452 379 A 41 CYS HA A 42 THR H 1.0 . 2.76 453 380 A 53 THR HA A 42 THR H 1.0 . 4.08 454 381 A 41 CYS HBx A 42 THR H 1.0 . 4.00 455 382 A 42 THR HG2% A 42 THR H 1.0 . 3.31 456 383 A 53 THR HG2% A 42 THR H 1.0 . 4.91 457 384 A 47 LYS H A 42 THR H 1.0 . 5.50 458 385 A 41 CYS HBx A 47 LYS H 1.0 . 4.74 459 386 A 47 LYS H A 46 CYS HBy 1.0 . 0.00 460 387 A 46 CYS HBx A 47 LYS H 1.0 . 0.00 461 387 A 47 LYS H A 46 CYS HBy 1.0 . 0.00 462 388 A 47 LYS HBx A 47 LYS H 1.0 . 3.19 463 389 A 47 LYS H A 47 LYS HGy 1.0 . 3.95 464 390 A 47 LYS HGx A 47 LYS H 1.0 . 0.00 465 390 A 47 LYS H A 47 LYS HGy 1.0 . 0.00 466 391 A 10 CYS HBx A 7 GLY H 1.0 . 4.85 467 392 A 6 LYS HBy A 7 GLY H 1.0 . 0.00 468 392 A 7 GLY H A 6 LYS HBx 1.0 . 0.00 469 393 A 64 CYS HA A 65 SER H 1.0 . 2.73 470 394 A 65 SER H A 65 SER HBx 1.0 . 3.94 471 395 A 65 SER HBy A 65 SER H 1.0 . 0.00 472 395 A 65 SER H A 65 SER HBx 1.0 . 0.00 473 396 A 48 CYS HBx A 65 SER H 1.0 . 4.24 474 397 A 64 CYS HBx A 65 SER H 1.0 . 4.14 475 398 A 66 CYS H A 65 SER H 1.0 . 3.17 476 399 A 67 LYS H A 65 SER H 1.0 . 4.66 477 400 A 66 CYS HA A 65 SER H 1.0 . 5.33 478 401 A 27 CYS HBy A 11 THR HG2% 1.0 . 4.89 479 402 A 27 CYS HBy A 10 CYS HA 1.0 . 4.59 480 403 A 36 CYS HBx A 25 CYS HBy 1.0 . 4.05 481 404 A 25 CYS HBx A 36 CYS HBx 1.0 . 0.00 482 404 A 36 CYS HBx A 25 CYS HBy 1.0 . 0.00 483 405 A 36 CYS HA A 25 CYS HBy 1.0 . 5.50 484 406 A 25 CYS HBx A 36 CYS HA 1.0 . 0.00 485 406 A 36 CYS HA A 25 CYS HBy 1.0 . 0.00 486 407 A 15 ARG HGy A 15 ARG HA 1.0 . 0.00 487 407 A 15 ARG HA A 15 ARG HGx 1.0 . 0.00 488 408 A 47 LYS H A 47 LYS HDy 1.0 . 5.50 489 409 A 38 THR H A 37 LYS HDx 1.0 . 5.21 490 410 A 38 THR H A 37 LYS HDx 1.0 . 0.00 491 410 A 37 LYS HDy A 38 THR H 1.0 . 0.00 492 411 A 32 THR H A 37 LYS HDx 1.0 . 0.00 493 412 A 61 GLY HAx A 29 GLU H 1.0 . 0.00 494 412 A 29 GLU H A 61 GLY HAy 1.0 . 0.00 495 413 A 29 GLU H A 61 GLY HAy 1.0 . 0.00 496 414 A 4 LYS HA A 4 LYS HDy 1.0 . 5.50 497 415 A 4 LYS HA A 4 LYS HDy 1.0 . 0.00 498 415 A 4 LYS HA A 4 LYS HDx 1.0 . 0.00 499 416 A 58 CYS HA A 59 LYS HDy 1.0 . 0.00 500 417 A 58 CYS HA A 59 LYS HDy 1.0 . 0.00 501 417 A 58 CYS HA A 59 LYS HDx 1.0 . 0.00 502 418 A 56 ASP HBx A 54 GLY HAx 1.0 . 0.00 503 419 A 56 ASP HBx A 57 SER HA 1.0 . 0.00 504 420 A 42 THR HB A 42 THR HA 1.0 . 2.73 505 421 A 53 THR HB A 42 THR HA 1.0 . 5.14 506 422 A 41 CYS HA A 42 THR HA 1.0 . 0.00 507 423 A 53 THR HA A 42 THR HA 1.0 . 4.75 508 424 A 54 GLY HAx A 42 THR HA 1.0 . 0.00 509 425 A 42 THR HG2% A 42 THR HA 1.0 . 2.91 510 426 A 53 THR HG2% A 42 THR HA 1.0 . 5.50 511 427 A 42 THR HA A 43 SER H 1.0 . 3.31 512 428 A 42 THR HA A 44 ASP H 1.0 . 5.18 513 429 A 42 THR HA A 45 GLY H 1.0 . 5.50 514 430 A 42 THR HA A 54 GLY H 1.0 . 5.50 515 431 A 45 GLY HAy A 46 CYS HBy 1.0 . 0.00 516 432 A 45 GLY HAy A 46 CYS HBy 1.0 . 0.00 517 432 A 46 CYS HBx A 45 GLY HAy 1.0 . 0.00 518 433 A 45 GLY HAy A 46 CYS HBy 1.0 . 0.00 519 433 A 45 GLY HAx A 46 CYS HBy 1.0 . 0.00 520 434 A 53 THR HG2% A 45 GLY HAy 1.0 . 0.00 521 435 A 9 LYS HBx A 8 GLU HA 1.0 . 5.50 522 436 A 8 GLU HA A 9 LYS HA 1.0 . 5.09 523 437 A 38 THR HA A 55 PRO HGy 1.0 . 4.64 524 438 A 39 CYS HBx A 55 PRO HGy 1.0 . 5.50 525 439 A 55 PRO HGy A 39 CYS H 1.0 . 5.40 526 440 A 28 GLY HAy A 29 GLU HGy 1.0 . 5.20 527 441 A 28 GLY HAy A 29 GLU HGx 1.0 . 0.00 528 441 A 28 GLY HAy A 29 GLU HGy 1.0 . 0.00 529 442 A 30 GLY H A 29 GLU HGy 1.0 . 5.50 530 443 A 29 GLU HGx A 30 GLY H 1.0 . 0.00 531 443 A 30 GLY H A 29 GLU HGy 1.0 . 0.00 532 444 A 60 CYS H A 59 LYS HGy 1.0 . 5.50 533 445 A 59 LYS HGx A 60 CYS H 1.0 . 0.00 534 445 A 60 CYS H A 59 LYS HGy 1.0 . 0.00 535 446 A 39 CYS HBx A 55 PRO HGy 1.0 . 0.00 536 447 A 55 PRO HGy A 39 CYS H 1.0 . 0.00 537 448 A 39 CYS HA A 67 LYS HDx 1.0 . 5.50 538 449 A 39 CYS HA A 38 THR HG2% 1.0 . 4.63 539 450 A 39 CYS HA A 41 CYS H 1.0 . 4.50 540 451 A 60 CYS HA A 61 GLY H 1.0 . 2.89 541 452 A 13 ALA HB% A 20 GLN HA 1.0 . 4.60 542 453 A 13 ALA HB% A 21 CYS HA 1.0 . 3.25 543 454 A 13 ALA HB% A 14 CYS HBx 1.0 . 5.05 544 455 A 20 GLN HBy A 13 ALA HB% 1.0 . 3.08 545 456 A 13 ALA HB% A 14 CYS HA 1.0 . 4.08 546 457 A 42 THR HB A 43 SER HBx 1.0 . 5.06 547 458 A 42 THR HB A 43 SER HBy 1.0 . 0.00 548 458 A 42 THR HB A 43 SER HBx 1.0 . 0.00 549 459 A 20 GLN HBy A 19 CYS HA 1.0 . 4.96 550 460 A 35 ALA HB% A 19 CYS HA 1.0 . 4.66 551 461 A 19 CYS HA A 20 GLN H 1.0 . 2.58 552 462 A 19 CYS HA A 16 SER H 1.0 . 4.72 553 463 A 14 CYS HA A 19 CYS HA 1.0 . 3.56 554 464 A 28 GLY HAy A 29 GLU HA 1.0 . 5.50 555 465 A 28 GLY HAy A 62 SER HBx 1.0 . 0.00 556 465 A 28 GLY HAy A 62 SER HBy 1.0 . 0.00 557 466 A 28 GLY HAy A 62 SER HBy 1.0 . 0.00 558 467 A 28 GLY HAy A 9 LYS HDy 1.0 . 5.18 559 468 A 9 LYS HBx A 28 GLY HAy 1.0 . 0.00 560 469 A 28 GLY HAy A 9 LYS HDy 1.0 . 0.00 561 469 A 28 GLY HAy A 9 LYS HDx 1.0 . 0.00 562 470 A 35 ALA HB% A 36 CYS HBx 1.0 . 4.93 563 471 A 19 CYS HBx A 35 ALA HB% 1.0 . 2.96 564 472 A 11 THR HG2% A 27 CYS HA 1.0 . 3.23 565 473 A 9 LYS HEy A 9 LYS HGx 1.0 . 4.07 566 474 A 6 LYS HEx A 6 LYS HGx 1.0 . 0.00 567 474 A 6 LYS HGy A 6 LYS HEy 1.0 . 0.00 568 474 A 6 LYS HGy A 6 LYS HEx 1.0 . 0.00 569 474 A 6 LYS HEy A 6 LYS HGx 1.0 . 0.00 570 475 A 9 LYS HEy A 9 LYS HGx 1.0 . 0.00 571 475 A 9 LYS HEx A 9 LYS HGx 1.0 . 0.00 572 476 A 8 GLU HGy A 9 LYS HGx 1.0 . 5.50 573 477 A 8 GLU HGy A 9 LYS HGx 1.0 . 0.00 574 477 A 8 GLU HGx A 9 LYS HGx 1.0 . 0.00 575 478 A 9 LYS HGx A 29 GLU HGy 1.0 . 0.00 576 479 A 9 LYS HGx A 29 GLU HGy 1.0 . 0.00 577 479 A 29 GLU HGx A 9 LYS HGx 1.0 . 0.00 578 480 A 9 LYS H A 9 LYS HGx 1.0 . 4.44 579 481 A 26 GLN HBy A 25 CYS HA 1.0 . 4.39 580 482 A 25 CYS HA A 26 GLN H 1.0 . 2.74 581 483 A 31 CYS HA A 31 CYS HBy 1.0 . 2.82 582 484 A 31 CYS HA A 31 CYS HBx 1.0 . 0.00 583 484 A 31 CYS HA A 31 CYS HBy 1.0 . 0.00 584 485 A 31 CYS HA A 9 LYS HBx 1.0 . 5.50 585 486 A 31 CYS HA A 37 LYS HDx 1.0 . 0.00 586 486 A 31 CYS HA A 37 LYS HDy 1.0 . 0.00 587 487 A 31 CYS HA A 37 LYS HDx 1.0 . 0.00 588 488 A 31 CYS HA A 32 THR HG2% 1.0 . 4.23 589 489 A 31 CYS HA A 7 GLY HAy 1.0 . 5.31 590 490 A 31 CYS HA A 30 GLY HAx 1.0 . 0.00 591 490 A 31 CYS HA A 30 GLY HAy 1.0 . 0.00 592 491 A 31 CYS HA A 30 GLY HAy 1.0 . 0.00 593 492 A 31 CYS HA A 32 THR H 1.0 . 3.55 594 493 A 39 CYS HBx A 52 CYS HBx 1.0 . 0.00 595 494 A 53 THR HA A 52 CYS HBx 1.0 . 5.27 596 495 A 52 CYS HBx A 59 LYS H 1.0 . 4.92 597 496 A 50 LYS HGy A 50 LYS HEy 1.0 . 4.23 598 497 A 50 LYS HGy A 50 LYS HEy 1.0 . 0.00 599 497 A 50 LYS HGy A 50 LYS HEx 1.0 . 0.00 600 498 A 37 LYS HEx A 37 LYS HGx 1.0 . 0.00 601 498 A 37 LYS HEy A 37 LYS HGx 1.0 . 0.00 602 499 A 37 LYS H A 37 LYS HGx 1.0 . 4.88 603 500 A 37 LYS HGy A 37 LYS H 1.0 . 0.00 604 500 A 37 LYS H A 37 LYS HGx 1.0 . 0.00 605 501 A 20 GLN HBy A 13 ALA HA 1.0 . 3.02 606 502 A 13 ALA HA A 20 GLN H 1.0 . 4.74 607 503 A 13 ALA HA A 15 ARG H 1.0 . 5.50 608 504 A 13 ALA HA A 16 SER H 1.0 . 4.43 609 505 A 14 CYS HA A 13 ALA HA 1.0 . 5.01 610 506 A 64 CYS HBx A 63 SER HA 1.0 . 5.50 611 507 A 23 SER HA A 24 LYS HBx 1.0 . 5.50 612 508 A 59 LYS H A 58 CYS HBx 1.0 . 5.00 613 509 A 52 CYS H A 58 CYS HBx 1.0 . 5.50 614 510 A 39 CYS H A 58 CYS HBx 1.0 . 0.00 615 511 A 10 CYS HBx A 6 LYS H 1.0 . 0.00 616 512 A 58 CYS HBy A 39 CYS H 1.0 . 0.00 617 512 A 39 CYS H A 58 CYS HBx 1.0 . 0.00 618 513 A 37 LYS H A 37 LYS HGx 1.0 . 0.00 619 514 A 19 CYS HBx A 18 PRO HA 1.0 . 4.73 620 515 A 18 PRO HA A 17 GLU HBx 1.0 . 3.52 621 516 A 18 PRO HA A 19 CYS H 1.0 . 2.81 622 517 A 34 ALA HB% A 35 ALA H 1.0 . 3.73 623 518 A 34 ALA HB% A 37 LYS H 1.0 . 5.50 624 519 A 50 LYS HA A 50 LYS HEy 1.0 . 5.40 625 520 A 50 LYS HA A 50 LYS HEy 1.0 . 0.00 626 520 A 50 LYS HA A 50 LYS HEx 1.0 . 0.00 627 521 A 39 CYS HBx A 54 GLY HAx 1.0 . 5.09 628 522 A 54 GLY HAx A 55 PRO HGy 1.0 . 0.00 629 523 A 39 CYS HBx A 54 GLY HAx 1.0 . 0.00 630 524 A 21 CYS HBx A 25 CYS HA 1.0 . 4.39 631 525 A 21 CYS HBx A 36 CYS HA 1.0 . 4.64 632 526 A 65 SER HA A 67 LYS HBx 1.0 . 5.50 633 527 A 26 GLN HBy A 11 THR HA 1.0 . 5.50 634 528 A 11 THR HG2% A 11 THR HA 1.0 . 2.80 635 529 A 66 CYS HA A 65 SER HA 1.0 . 4.73 636 530 A 16 SER HBy A 16 SER HA 1.0 . 0.00 637 530 A 16 SER HA A 16 SER HBx 1.0 . 0.00 638 531 A 16 SER HA A 17 GLU HGx 1.0 . 4.56 639 532 A 13 ALA HB% A 12 SER HBy 1.0 . 5.50 640 533 A 13 ALA HB% A 12 SER HBx 1.0 . 0.00 641 533 A 13 ALA HB% A 12 SER HBy 1.0 . 0.00 642 534 A 11 THR HG2% A 12 SER HBy 1.0 . 0.00 643 534 A 11 THR HG2% A 12 SER HBx 1.0 . 0.00 644 535 A 37 LYS HA A 37 LYS HEy 1.0 . 5.50 645 536 A 37 LYS HA A 37 LYS HEy 1.0 . 0.00 646 536 A 37 LYS HA A 37 LYS HEx 1.0 . 0.00 647 537 A 37 LYS HA A 37 LYS HGx 1.0 . 0.00 648 538 A 37 LYS HA A 37 LYS HGx 1.0 . 4.01 649 539 A 37 LYS HA A 37 LYS HGy 1.0 . 0.00 650 539 A 37 LYS HA A 37 LYS HGx 1.0 . 0.00 651 540 A 38 THR HG2% A 37 LYS HA 1.0 . 5.40 652 541 A 36 CYS HA A 37 LYS HA 1.0 . 5.15 653 542 A 62 SER H A 62 SER HBy 1.0 . 4.19 654 543 A 62 SER HBx A 62 SER H 1.0 . 0.00 655 543 A 62 SER H A 62 SER HBy 1.0 . 0.00 656 544 A 36 CYS HA A 36 CYS HBx 1.0 . 2.81 657 545 A 35 ALA HB% A 36 CYS HA 1.0 . 4.31 658 546 A 39 CYS HA A 40 ASN HBy 1.0 . 5.50 659 547 A 40 ASN HBy A 67 LYS HA 1.0 . 0.00 660 548 A 40 ASN HBy A 41 CYS H 1.0 . 5.04 661 549 A 40 ASN HD2y A 40 ASN HBy 1.0 . 3.73 662 550 A 40 ASN HD2x A 40 ASN HBy 1.0 . 0.00 663 551 A 67 LYS HBx A 62 SER HA 1.0 . 4.40 664 552 A 6 LYS HBx A 6 LYS HEy 1.0 . 5.50 665 553 A 6 LYS HEx A 6 LYS HBx 1.0 . 0.00 666 553 A 6 LYS HBx A 6 LYS HEy 1.0 . 0.00 667 554 A 6 LYS HBy A 6 LYS HEy 1.0 . 0.00 668 554 A 6 LYS HBx A 6 LYS HEy 1.0 . 0.00 669 554 A 6 LYS HBy A 6 LYS HEx 1.0 . 0.00 670 554 A 6 LYS HEx A 6 LYS HBx 1.0 . 0.00 671 555 A 10 CYS HBx A 6 LYS HBy 1.0 . 0.00 672 555 A 10 CYS HBx A 6 LYS HBx 1.0 . 0.00 673 556 A 10 CYS HBx A 6 LYS HBx 1.0 . 0.00 674 557 A 67 LYS HBx A 67 LYS HEx 1.0 . 5.33 675 558 A 67 LYS HBx A 67 LYS HEx 1.0 . 0.00 676 559 A 67 LYS HBx A 67 LYS HEx 1.0 . 0.00 677 559 A 67 LYS HBx A 67 LYS HEy 1.0 . 0.00 678 560 A 67 LYS HA A 67 LYS HDx 1.0 . 3.39 679 561 A 64 CYS HBx A 67 LYS HDx 1.0 . 5.50 680 562 A 39 CYS HBx A 67 LYS HDx 1.0 . 0.00 681 563 A 67 LYS HDx A 67 LYS H 1.0 . 5.04 682 564 A 66 CYS HBx A 40 ASN H 1.0 . 3.44 683 565 A 66 CYS HBx A 67 LYS H 1.0 . 4.80 684 566 A 20 GLN HGx A 16 SER HBx 1.0 . 0.00 685 567 A 20 GLN HBy A 16 SER HBx 1.0 . 0.00 686 568 A 20 GLN H A 16 SER HBx 1.0 . 0.00 687 569 A 16 SER H A 16 SER HBx 1.0 . 0.00 688 570 A 16 SER HBy A 20 GLN HE2x 1.0 . 0.00 689 570 A 20 GLN HE2x A 16 SER HBx 1.0 . 0.00 690 571 A 43 SER H A 43 SER HBx 1.0 . 3.68 691 572 A 67 LYS HGx A 67 LYS HEx 1.0 . 3.08 692 573 A 67 LYS HGx A 67 LYS HEx 1.0 . 0.00 693 573 A 67 LYS HGx A 67 LYS HEy 1.0 . 0.00 694 574 A 64 CYS HBx A 67 LYS HEx 1.0 . 0.00 695 575 A 64 CYS HBx A 67 LYS HEx 1.0 . 0.00 696 575 A 64 CYS HBx A 67 LYS HEy 1.0 . 0.00 697 576 A 60 CYS H A 67 LYS HEx 1.0 . 5.19 698 577 A 60 CYS H A 67 LYS HEx 1.0 . 0.00 699 577 A 60 CYS H A 67 LYS HEy 1.0 . 0.00 700 578 A 64 CYS H A 67 LYS HEx 1.0 . 5.47 701 579 A 45 GLY HAy A 46 CYS HBy 1.0 . 5.50 702 580 A 44 ASP HBy A 45 GLY HAy 1.0 . 0.00 703 580 A 45 GLY HAx A 44 ASP HBx 1.0 . 0.00 704 580 A 45 GLY HAx A 44 ASP HBy 1.0 . 0.00 705 580 A 44 ASP HBx A 45 GLY HAy 1.0 . 0.00 706 581 A 29 GLU HGy A 30 GLY HAy 1.0 . 0.00 707 582 A 29 GLU HBy A 30 GLY HAy 1.0 . 5.50 708 583 A 29 GLU HBy A 30 GLY HAx 1.0 . 0.00 709 583 A 29 GLU HBy A 30 GLY HAy 1.0 . 0.00 710 584 A 53 THR HG2% A 45 GLY HAy 1.0 . 4.30 711 585 A 44 ASP HA A 45 GLY HAy 1.0 . 5.47 712 586 A 32 THR HB A 30 GLY HAx 1.0 . 0.00 713 586 A 32 THR HB A 30 GLY HAy 1.0 . 0.00 714 587 A 32 THR HB A 30 GLY HAy 1.0 . 0.00 715 588 A 45 GLY HAx A 44 ASP HA 1.0 . 0.00 716 588 A 44 ASP HA A 45 GLY HAy 1.0 . 0.00 717 589 A 29 GLU H A 30 GLY HAy 1.0 . 5.50 718 590 A 30 GLY HAx A 29 GLU H 1.0 . 0.00 719 590 A 29 GLU H A 30 GLY HAy 1.0 . 0.00 720 591 A 52 CYS HBx A 57 SER HBx 1.0 . 5.28 721 592 A 57 SER HBy A 52 CYS HBx 1.0 . 0.00 722 592 A 52 CYS HBx A 57 SER HBx 1.0 . 0.00 723 593 A 56 ASP HBx A 57 SER HBx 1.0 . 0.00 724 594 A 56 ASP HBy A 57 SER HBx 1.0 . 0.00 725 594 A 57 SER HBy A 56 ASP HBy 1.0 . 0.00 726 594 A 56 ASP HBx A 57 SER HBx 1.0 . 0.00 727 594 A 57 SER HBy A 56 ASP HBx 1.0 . 0.00 728 595 A 56 ASP HBx A 57 SER HBx 1.0 . 0.00 729 595 A 57 SER HBy A 56 ASP HBx 1.0 . 0.00 730 596 A 53 THR H A 57 SER HBx 1.0 . 5.50 731 597 A 57 SER HBy A 53 THR H 1.0 . 0.00 732 597 A 53 THR H A 57 SER HBx 1.0 . 0.00 733 598 A 9 LYS H A 8 GLU HBx 1.0 . 4.99 734 599 A 8 GLU HBy A 9 LYS H 1.0 . 0.00 735 599 A 9 LYS H A 8 GLU HBx 1.0 . 0.00 736 600 A 15 ARG H A 15 ARG HDx 1.0 . 4.93 737 601 A 15 ARG H A 15 ARG HDy 1.0 . 0.00 738 601 A 15 ARG H A 15 ARG HDx 1.0 . 0.00 739 602 A 39 CYS HBx A 58 CYS HBx 1.0 . 0.00 740 603 A 59 LYS H A 58 CYS HBx 1.0 . 0.00 741 604 A 46 CYS HA A 47 LYS HGy 1.0 . 4.21 742 605 A 47 LYS HA A 47 LYS HGy 1.0 . 0.00 743 606 A 47 LYS HA A 47 LYS HGx 1.0 . 0.00 744 606 A 47 LYS HA A 47 LYS HGy 1.0 . 0.00 745 607 A 53 THR HG2% A 46 CYS HA 1.0 . 3.80 746 608 A 53 THR HA A 53 THR HG2% 1.0 . 2.72 747 609 A 53 THR HG2% A 46 CYS HBy 1.0 . 3.36 748 610 A 46 CYS HBx A 53 THR HG2% 1.0 . 0.00 749 610 A 53 THR HG2% A 46 CYS HBy 1.0 . 0.00 750 611 A 32 THR HG2% A 31 CYS HBy 1.0 . 5.50 751 612 A 53 THR HG2% A 41 CYS HBx 1.0 . 4.72 752 613 A 53 THR HA A 41 CYS HBx 1.0 . 3.12 753 614 A 30 GLY HAy A 31 CYS HBy 1.0 . 0.00 754 614 A 30 GLY HAx A 31 CYS HBy 1.0 . 0.00 755 615 A 30 GLY HAy A 31 CYS HBy 1.0 . 0.00 756 616 A 41 CYS HBx A 40 ASN H 1.0 . 5.50 757 617 A 32 THR H A 31 CYS HBy 1.0 . 5.30 758 618 A 41 CYS HBx A 54 GLY H 1.0 . 3.76 759 619 A 4 LYS HA A 4 LYS HEy 1.0 . 5.50 760 620 A 4 LYS HA A 4 LYS HEy 1.0 . 0.00 761 620 A 4 LYS HA A 4 LYS HEx 1.0 . 0.00 762 621 A 55 PRO HGy A 56 ASP HA 1.0 . 4.64 763 622 A 55 PRO HBx A 56 ASP HA 1.0 . 0.00 764 623 A 56 ASP HA A 58 CYS H 1.0 . 4.91 765 624 A 6 LYS HGy A 33 CYS HBy 1.0 . 0.00 766 624 A 6 LYS HGx A 33 CYS HBy 1.0 . 0.00 767 625 A 35 ALA HB% A 33 CYS HBy 1.0 . 0.00 768 626 A 35 ALA HB% A 33 CYS HBy 1.0 . 0.00 769 626 A 35 ALA HB% A 33 CYS HBx 1.0 . 0.00 770 627 A 6 LYS HA A 6 LYS HGx 1.0 . 0.00 771 628 A 6 LYS HGy A 6 LYS HA 1.0 . 0.00 772 628 A 6 LYS HA A 6 LYS HGx 1.0 . 0.00 773 629 A 9 LYS HGy A 29 GLU HGy 1.0 . 0.00 774 629 A 9 LYS HGx A 29 GLU HGy 1.0 . 0.00 775 630 A 56 ASP HBx A 57 SER HBx 1.0 . 0.00 776 631 A 57 SER HBy A 56 ASP HBy 1.0 . 0.00 777 631 A 56 ASP HBy A 57 SER HBx 1.0 . 0.00 778 631 A 57 SER HBy A 56 ASP HBx 1.0 . 0.00 779 631 A 56 ASP HBx A 57 SER HBx 1.0 . 0.00 780 632 A 57 SER HBy A 57 SER HA 1.0 . 0.00 781 632 A 57 SER HA A 57 SER HBx 1.0 . 0.00 782 633 A 53 THR H A 57 SER HBx 1.0 . 0.00 783 634 A 10 CYS HA A 27 CYS HA 1.0 . 3.17 784 635 A 10 CYS HA A 9 LYS HBx 1.0 . 4.97 785 636 A 10 CYS HA A 28 GLY H 1.0 . 3.83 786 637 A 50 LYS HGy A 49 GLY HAy 1.0 . 5.29 787 638 A 49 GLY HAx A 50 LYS HGy 1.0 . 0.00 788 638 A 50 LYS HGy A 49 GLY HAy 1.0 . 0.00 789 639 A 46 CYS HA A 41 CYS HA 1.0 . 4.46 790 640 A 53 THR HA A 46 CYS HA 1.0 . 3.68 791 641 A 46 CYS HA A 45 GLY HAy 1.0 . 5.02 792 642 A 45 GLY HAx A 46 CYS HA 1.0 . 0.00 793 642 A 46 CYS HA A 45 GLY HAy 1.0 . 0.00 794 643 A 41 CYS HBx A 46 CYS HA 1.0 . 4.07 795 644 A 47 LYS HBx A 46 CYS HA 1.0 . 4.95 796 645 A 46 CYS HA A 47 LYS H 1.0 . 2.66 797 646 A 46 CYS HA A 48 CYS H 1.0 . 4.58 798 647 A 46 CYS HA A 41 CYS H 1.0 . 5.50 799 648 A 50 LYS HBx A 51 GLU H 1.0 . 4.51 800 649 A 50 LYS HBx A 50 LYS H 1.0 . 3.95 801 650 A 58 CYS HA A 52 CYS HA 1.0 . 4.08 802 651 A 52 CYS HA A 57 SER HBx 1.0 . 4.13 803 652 A 57 SER HBy A 52 CYS HA 1.0 . 0.00 804 652 A 52 CYS HA A 57 SER HBx 1.0 . 0.00 805 653 A 52 CYS HA A 57 SER HBx 1.0 . 0.00 806 654 A 57 SER HBy A 52 CYS HA 1.0 . 0.00 807 654 A 52 CYS HA A 57 SER HBx 1.0 . 0.00 808 655 A 52 CYS HBx A 52 CYS HA 1.0 . 2.92 809 656 A 53 THR HG2% A 52 CYS HA 1.0 . 4.98 810 657 A 52 CYS HA A 54 GLY H 1.0 . 5.50 811 658 A 38 THR HG2% A 55 PRO HBx 1.0 . 0.00 812 659 A 55 PRO HBx A 58 CYS HBx 1.0 . 0.00 813 660 A 58 CYS HBy A 55 PRO HBx 1.0 . 0.00 814 660 A 55 PRO HBx A 58 CYS HBx 1.0 . 0.00 815 661 A 55 PRO HBx A 39 CYS H 1.0 . 0.00 816 662 A 37 LYS HA A 36 CYS HBx 1.0 . 5.45 817 663 A 36 CYS HBx A 25 CYS HA 1.0 . 5.09 818 664 A 36 CYS HBx A 21 CYS H 1.0 . 5.50 819 665 A 36 CYS HBx A 37 LYS H 1.0 . 4.74 820 666 A 36 CYS HBx A 36 CYS H 1.0 . 3.87 821 667 A 67 LYS HGx A 67 LYS HA 1.0 . 3.83 822 668 A 67 LYS HGx A 62 SER HA 1.0 . 4.42 823 669 A 64 CYS HBx A 67 LYS HGx 1.0 . 3.89 824 670 A 47 LYS HBx A 48 CYS HA 1.0 . 5.36 825 671 A 15 ARG HGy A 14 CYS HBx 1.0 . 0.00 826 671 A 14 CYS HBx A 15 ARG HGx 1.0 . 0.00 827 672 A 14 CYS HBx A 11 THR HG2% 1.0 . 4.68 828 673 A 13 ALA HB% A 14 CYS HBx 1.0 . 0.00 829 674 A 14 CYS HBx A 10 CYS HA 1.0 . 5.50 830 675 A 14 CYS HBx A 15 ARG H 1.0 . 4.11 831 676 A 15 ARG H A 15 ARG HGx 1.0 . 3.86 832 677 A 14 CYS H A 15 ARG HGx 1.0 . 5.50 833 678 A 16 SER H A 15 ARG HGx 1.0 . 0.00 834 679 A 16 SER HA A 15 ARG HBy 1.0 . 5.37 835 680 A 7 GLY HAy A 8 GLU HBx 1.0 . 0.00 836 680 A 8 GLU HBy A 7 GLY HAy 1.0 . 0.00 837 681 A 7 GLY HAy A 8 GLU HBx 1.0 . 0.00 838 681 A 7 GLY HAx A 8 GLU HBy 1.0 . 0.00 839 681 A 8 GLU HBy A 7 GLY HAy 1.0 . 0.00 840 681 A 7 GLY HAx A 8 GLU HBx 1.0 . 0.00 841 682 A 15 ARG HDx A 15 ARG HBy 1.0 . 3.81 842 683 A 62 SER HA A 67 LYS HEx 1.0 . 0.00 843 683 A 62 SER HA A 67 LYS HEy 1.0 . 0.00 844 684 A 60 CYS H A 67 LYS HEx 1.0 . 0.00 845 685 A 67 LYS H A 67 LYS HEx 1.0 . 0.00 846 686 A 38 THR HA A 38 THR HB 1.0 . 2.94 847 687 A 32 THR HA A 31 CYS HA 1.0 . 4.46 848 688 A 32 THR HA A 33 CYS HBy 1.0 . 0.00 849 689 A 32 THR HA A 33 CYS HBy 1.0 . 5.50 850 690 A 38 THR HA A 55 PRO HBx 1.0 . 0.00 851 691 A 62 SER HA A 67 LYS HEx 1.0 . 5.42 852 692 A 12 SER HA A 15 ARG HBy 1.0 . 3.90 853 693 A 15 ARG HBx A 12 SER HA 1.0 . 0.00 854 693 A 12 SER HA A 15 ARG HBy 1.0 . 0.00 855 694 A 62 SER HA A 67 LYS HDx 1.0 . 3.99 856 695 A 12 SER HA A 15 ARG H 1.0 . 3.96 857 696 A 12 SER HA A 14 CYS H 1.0 . 5.50 858 697 A 12 SER HA A 16 SER H 1.0 . 0.00 859 698 A 25 CYS HA A 26 GLN HA 1.0 . 5.24 860 699 A 66 CYS HBx A 40 ASN HA 1.0 . 0.00 861 700 A 11 THR HG2% A 26 GLN HA 1.0 . 4.25 862 701 A 40 ASN HA A 39 CYS H 1.0 . 5.07 863 702 A 40 ASN HD2y A 40 ASN HA 1.0 . 4.71 864 703 A 40 ASN HD2x A 40 ASN HA 1.0 . 0.00 865 704 A 20 GLN HBy A 20 GLN HGx 1.0 . 2.92 866 705 A 13 ALA HB% A 20 GLN HGx 1.0 . 5.28 867 706 A 20 GLN HGx A 19 CYS HA 1.0 . 4.78 868 707 A 20 GLN HGx A 21 CYS H 1.0 . 5.50 869 708 A 14 CYS HA A 19 CYS HBx 1.0 . 5.08 870 709 A 50 LYS HGy A 49 GLY HAy 1.0 . 0.00 871 710 A 16 SER HA A 17 GLU HA 1.0 . 4.64 872 711 A 19 CYS HA A 17 GLU HA 1.0 . 4.67 873 712 A 16 SER HBy A 17 GLU HA 1.0 . 0.00 874 712 A 17 GLU HA A 16 SER HBx 1.0 . 0.00 875 713 A 19 CYS HBx A 17 GLU HA 1.0 . 5.46 876 714 A 17 GLU HGx A 17 GLU HA 1.0 . 4.15 877 715 A 56 ASP HBx A 57 SER HA 1.0 . 5.50 878 716 A 56 ASP HBx A 57 SER HA 1.0 . 0.00 879 716 A 57 SER HA A 56 ASP HBy 1.0 . 0.00 880 717 A 25 CYS HA A 26 GLN HGx 1.0 . 5.50 881 718 A 35 ALA HB% A 33 CYS HBy 1.0 . 0.00 882 718 A 35 ALA HB% A 33 CYS HBx 1.0 . 0.00 883 719 A 35 ALA HB% A 33 CYS HBy 1.0 . 0.00 884 720 A 34 ALA HB% A 33 CYS HBy 1.0 . 0.00 885 721 A 31 CYS HA A 33 CYS HBx 1.0 . 0.00 886 721 A 31 CYS HA A 33 CYS HBy 1.0 . 0.00 887 722 A 31 CYS HA A 33 CYS HBy 1.0 . 0.00 888 723 A 36 CYS H A 33 CYS HBy 1.0 . 0.00 889 724 A 33 CYS HBx A 36 CYS H 1.0 . 0.00 890 724 A 36 CYS H A 33 CYS HBy 1.0 . 0.00 891 725 A 31 CYS HA A 6 LYS HA 1.0 . 5.50 892 726 A 6 LYS HA A 6 LYS HEy 1.0 . 5.50 893 727 A 6 LYS HA A 6 LYS HEy 1.0 . 0.00 894 727 A 6 LYS HA A 6 LYS HEx 1.0 . 0.00 895 728 A 6 LYS HA A 6 LYS HGx 1.0 . 4.24 896 729 A 6 LYS HGy A 6 LYS HA 1.0 . 0.00 897 729 A 6 LYS HA A 6 LYS HGx 1.0 . 0.00 898 730 A 50 LYS HA A 50 LYS HEy 1.0 . 0.00 899 731 A 50 LYS HA A 50 LYS HEy 1.0 . 0.00 900 731 A 50 LYS HA A 50 LYS HEx 1.0 . 0.00 901 732 A 50 LYS HA A 51 GLU HBy 1.0 . 4.93 902 733 A 51 GLU HBx A 50 LYS HA 1.0 . 0.00 903 733 A 50 LYS HA A 51 GLU HBy 1.0 . 0.00 904 734 A 24 LYS HA A 24 LYS HBx 1.0 . 0.00 905 735 A 24 LYS HA A 24 LYS HBy 1.0 . 0.00 906 735 A 24 LYS HA A 24 LYS HBx 1.0 . 0.00 907 736 A 9 LYS HA A 9 LYS HDy 1.0 . 0.00 908 736 A 9 LYS HA A 9 LYS HDx 1.0 . 0.00 909 737 A 9 LYS HA A 9 LYS HGx 1.0 . 2.91 910 738 A 9 LYS HGy A 9 LYS HA 1.0 . 0.00 911 738 A 9 LYS HA A 9 LYS HGx 1.0 . 0.00 912 739 A 50 LYS HGy A 50 LYS HA 1.0 . 3.95 913 740 A 24 LYS HA A 24 LYS HGx 1.0 . 0.00 914 740 A 24 LYS HA A 24 LYS HGy 1.0 . 0.00 915 741 A 24 LYS HA A 24 LYS HGy 1.0 . 0.00 916 742 A 20 GLN HBy A 14 CYS HA 1.0 . 5.09 917 743 A 14 CYS HA A 35 ALA HB% 1.0 . 5.50 918 744 A 14 CYS HA A 21 CYS H 1.0 . 4.32 919 745 A 34 ALA HA A 37 LYS HEy 1.0 . 5.50 920 746 A 34 ALA HA A 37 LYS HEy 1.0 . 0.00 921 746 A 34 ALA HA A 37 LYS HEx 1.0 . 0.00 922 747 A 34 ALA HA A 36 CYS H 1.0 . 5.48 923 748 A 55 PRO HBx A 56 ASP HA 1.0 . 4.67 924 749 A 39 CYS HBx A 55 PRO HA 1.0 . 0.00 925 750 A 21 CYS HA A 24 LYS HBx 1.0 . 0.00 926 751 A 39 CYS HBx A 58 CYS HBy 1.0 . 0.00 927 751 A 39 CYS HBx A 58 CYS HBx 1.0 . 0.00 928 752 A 53 THR HA A 41 CYS H 1.0 . 5.50 929 753 A 53 THR HA A 45 GLY H 1.0 . 5.50 930 754 A 9 LYS H A 8 GLU HBx 1.0 . 0.00 931 755 A 60 CYS HBy A 64 CYS HBx 1.0 . 4.33 932 756 A 64 CYS HBx A 62 SER HA 1.0 . 5.37 933 757 A 64 CYS HBx A 63 SER HBx 1.0 . 0.00 934 757 A 64 CYS HBx A 63 SER HBy 1.0 . 0.00 935 758 A 64 CYS HBx A 61 GLY HAx 1.0 . 0.00 936 758 A 64 CYS HBx A 61 GLY HAy 1.0 . 0.00 937 759 A 64 CYS HBx A 63 SER HBx 1.0 . 0.00 938 759 A 64 CYS HBx A 63 SER HBy 1.0 . 0.00 939 760 A 64 CYS HBx A 61 GLY HAy 1.0 . 0.00 940 761 A 64 CYS HBx A 61 GLY H 1.0 . 4.82 941 762 A 46 CYS HBy A 51 GLU HBy 1.0 . 5.50 942 763 A 47 LYS H A 46 CYS HBy 1.0 . 4.31 943 764 A 51 GLU H A 46 CYS HBy 1.0 . 4.20 944 765 A 15 ARG HA A 6 LYS HDy 1.0 . 0.00 945 766 A 15 ARG HA A 6 LYS HDy 1.0 . 0.00 946 766 A 15 ARG HA A 6 LYS HDx 1.0 . 0.00 947 767 A 15 ARG HBx A 15 ARG HA 1.0 . 0.00 948 767 A 15 ARG HA A 15 ARG HBy 1.0 . 0.00 949 768 A 15 ARG HA A 15 ARG HGx 1.0 . 3.42 950 769 A 15 ARG HA A 6 LYS HGy 1.0 . 0.00 951 769 A 15 ARG HA A 6 LYS HGx 1.0 . 0.00 952 770 A 39 CYS HBx A 38 THR HG2% 1.0 . 5.50 953 771 A 39 CYS HBx A 55 PRO HA 1.0 . 0.00 954 772 A 50 LYS HBx A 51 GLU H 1.0 . 0.00 955 773 A 33 CYS H A 37 LYS HBx 1.0 . 0.00 956 774 A 11 THR HB A 13 ALA H 1.0 . 3.90 957 775 A 15 ARG HDx A 15 ARG HBy 1.0 . 0.00 958 775 A 15 ARG HBy A 15 ARG HDy 1.0 . 0.00 959 776 A 15 ARG HBy A 15 ARG HDy 1.0 . 0.00 960 776 A 15 ARG HBx A 15 ARG HDy 1.0 . 0.00 961 776 A 15 ARG HBx A 15 ARG HDx 1.0 . 0.00 962 776 A 15 ARG HDx A 15 ARG HBy 1.0 . 0.00 963 777 A 19 CYS HBx A 35 ALA HA 1.0 . 5.39 964 778 A 35 ALA HA A 37 LYS H 1.0 . 4.88 965 779 A 36 CYS HA A 35 ALA HA 1.0 . 4.95 966 780 A 51 GLU HA A 46 CYS HBy 1.0 . 0.00 967 781 A 21 CYS HBx A 22 GLY HAx 1.0 . 0.00 968 782 A 21 CYS HBx A 22 GLY HAy 1.0 . 0.00 969 782 A 21 CYS HBx A 22 GLY HAx 1.0 . 0.00 970 783 A 22 GLY HAy A 23 SER HA 1.0 . 0.00 971 783 A 23 SER HA A 22 GLY HAx 1.0 . 0.00 972 784 A 21 CYS H A 22 GLY HAx 1.0 . 0.00 973 785 A 22 GLY HAy A 21 CYS H 1.0 . 0.00 974 785 A 21 CYS H A 22 GLY HAx 1.0 . 0.00 975 786 A 24 LYS H A 22 GLY HAx 1.0 . 0.00 976 787 A 22 GLY HAy A 24 LYS H 1.0 . 0.00 977 787 A 24 LYS H A 22 GLY HAx 1.0 . 0.00 978 788 A 33 CYS HA A 33 CYS HBy 1.0 . 2.96 979 789 A 33 CYS HA A 6 LYS HDy 1.0 . 5.50 980 790 A 33 CYS HA A 6 LYS HDy 1.0 . 0.00 981 790 A 33 CYS HA A 6 LYS HDx 1.0 . 0.00 982 791 A 33 CYS HA A 37 LYS HDx 1.0 . 0.00 983 792 A 34 ALA HB% A 33 CYS HA 1.0 . 4.84 984 793 A 35 ALA HB% A 33 CYS HA 1.0 . 0.00 985 794 A 33 CYS HA A 34 ALA H 1.0 . 2.78 986 795 A 33 CYS HA A 35 ALA H 1.0 . 4.58 987 796 A 50 LYS HGy A 50 LYS HA 1.0 . 0.00 988 797 A 10 CYS HA A 11 THR HG2% 1.0 . 3.72 989 798 A 11 THR HG2% A 12 SER HA 1.0 . 5.50 990 799 A 11 THR HG2% A 62 SER HBy 1.0 . 0.00 991 800 A 11 THR HG2% A 62 SER HBy 1.0 . 0.00 992 800 A 11 THR HG2% A 62 SER HBx 1.0 . 0.00 993 801 A 26 GLN HBy A 11 THR HG2% 1.0 . 2.93 994 802 A 11 THR HG2% A 26 GLN H 1.0 . 3.61 995 803 A 11 THR HG2% A 13 ALA H 1.0 . 4.98 996 804 A 5 GLY HAx A 4 LYS HGx 1.0 . 0.00 997 804 A 4 LYS HGx A 5 GLY HAy 1.0 . 0.00 998 804 A 4 LYS HGy A 5 GLY HAx 1.0 . 0.00 999 804 A 4 LYS HGy A 5 GLY HAy 1.0 . 0.00 1000 805 A 6 LYS HGy A 5 GLY HAy 1.0 . 0.00 1001 805 A 5 GLY HAx A 6 LYS HGx 1.0 . 0.00 1002 805 A 5 GLY HAy A 6 LYS HGx 1.0 . 0.00 1003 805 A 6 LYS HGy A 5 GLY HAx 1.0 . 0.00 1004 806 A 10 CYS HBx A 7 GLY HAy 1.0 . 5.50 1005 807 A 30 GLY HAy A 31 CYS HBy 1.0 . 0.00 1006 808 A 30 GLY HAy A 31 CYS HBy 1.0 . 0.00 1007 808 A 30 GLY HAx A 31 CYS HBy 1.0 . 0.00 1008 809 A 29 GLU HGy A 30 GLY HAy 1.0 . 0.00 1009 810 A 29 GLU HBy A 30 GLY HAx 1.0 . 0.00 1010 810 A 29 GLU HBy A 30 GLY HAy 1.0 . 0.00 1011 811 A 29 GLU HBy A 30 GLY HAy 1.0 . 0.00 1012 812 A 9 LYS HBx A 30 GLY HAx 1.0 . 0.00 1013 812 A 9 LYS HBx A 30 GLY HAy 1.0 . 0.00 1014 813 A 9 LYS HBx A 30 GLY HAy 1.0 . 0.00 1015 814 A 21 CYS HBx A 22 GLY HAx 1.0 . 5.50 1016 815 A 24 LYS H A 22 GLY HAx 1.0 . 4.99 1017 816 A 22 GLY HAy A 24 LYS H 1.0 . 0.00 1018 816 A 24 LYS H A 22 GLY HAx 1.0 . 0.00 1019 817 A 11 THR HG2% A 26 GLN HGx 1.0 . 0.00 1020 817 A 11 THR HG2% A 26 GLN HGy 1.0 . 0.00 1021 818 A 11 THR HG2% A 26 GLN HGx 1.0 . 0.00 1022 819 A 25 CYS HA A 26 GLN HGy 1.0 . 0.00 1023 819 A 25 CYS HA A 26 GLN HGx 1.0 . 0.00 1024 820 A 26 GLN HGy A 26 GLN H 1.0 . 0.00 1025 820 A 26 GLN H A 26 GLN HGx 1.0 . 0.00 1026 821 A 26 GLN H A 26 GLN HGx 1.0 . 0.00 1027 822 A 38 THR HG2% A 38 THR H 1.0 . 3.29 1028 823 A 38 THR HG2% A 39 CYS H 1.0 . 0.00 1029 824 A 40 ASN HD2y A 38 THR HG2% 1.0 . 5.04 1030 825 A 40 ASN HD2x A 38 THR HG2% 1.0 . 0.00 1031 826 A 26 GLN HA A 26 GLN HGx 1.0 . 0.00 1032 827 A 51 GLU HA A 51 GLU HGx 1.0 . 0.00 1033 827 A 51 GLU HA A 51 GLU HGy 1.0 . 0.00 1034 828 A 51 GLU HA A 51 GLU HBx 1.0 . 0.00 1035 828 A 51 GLU HA A 51 GLU HBy 1.0 . 0.00 1036 829 A 51 GLU HA A 51 GLU HBy 1.0 . 0.00 1037 830 A 51 GLU HA A 51 GLU HGy 1.0 . 0.00 1038 831 A 51 GLU HA A 46 CYS HA 1.0 . 5.50 1039 832 A 51 GLU HA A 50 LYS HA 1.0 . 0.00 1040 833 A 39 CYS HBx A 55 PRO HDy 1.0 . 5.07 1041 834 A 54 GLY HAx A 55 PRO HDy 1.0 . 2.94 1042 835 A 55 PRO HDy A 39 CYS H 1.0 . 5.17 1043 836 A 55 PRO HDy A 54 GLY H 1.0 . 5.12 1044 837 A 53 THR HB A 41 CYS HBx 1.0 . 5.40 1045 838 A 53 THR HB A 42 THR HB 1.0 . 5.50 1046 839 A 53 THR HB A 46 CYS HA 1.0 . 0.00 1047 840 A 53 THR HB A 43 SER H 1.0 . 4.92 1048 841 A 53 THR HB A 45 GLY H 1.0 . 5.30 1049 842 A 32 THR HB A 33 CYS H 1.0 . 5.50 1050 843 A 20 GLN HA A 20 GLN HGx 1.0 . 0.00 1051 844 A 20 GLN HE2y A 20 GLN HA 1.0 . 4.65 1052 845 A 20 GLN HE2x A 20 GLN HA 1.0 . 0.00 1053 846 A 20 GLN HE2y A 20 GLN HA 1.0 . 0.00 1054 846 A 20 GLN HE2x A 20 GLN HA 1.0 . 0.00 1055 847 A 20 GLN HE2x A 20 GLN HA 1.0 . 5.10 1056 848 A 20 GLN HE2y A 20 GLN HA 1.0 . 0.00 1057 849 A 53 THR HG2% A 43 SER HA 1.0 . 3.90 1058 850 A 43 SER HA A 44 ASP HA 1.0 . 4.93 1059 851 A 47 LYS HA A 47 LYS HDy 1.0 . 4.41 1060 852 A 47 LYS HA A 47 LYS HDy 1.0 . 0.00 1061 852 A 47 LYS HA A 47 LYS HDx 1.0 . 0.00 1062 853 A 64 CYS HBx A 61 GLY HAy 1.0 . 5.50 1063 854 A 64 CYS HBx A 61 GLY HAx 1.0 . 0.00 1064 854 A 64 CYS HBx A 61 GLY HAy 1.0 . 0.00 1065 855 A 21 CYS HA A 25 CYS HBy 1.0 . 5.50 1066 856 A 21 CYS HA A 25 CYS HBx 1.0 . 0.00 1067 856 A 21 CYS HA A 25 CYS HBy 1.0 . 0.00 1068 857 A 20 GLN HBy A 21 CYS HA 1.0 . 5.39 1069 858 A 21 CYS HA A 24 LYS HBx 1.0 . 5.50 1070 859 A 21 CYS HA A 24 LYS HBy 1.0 . 0.00 1071 859 A 21 CYS HA A 24 LYS HBx 1.0 . 0.00 1072 860 A 21 CYS HA A 20 GLN HA 1.0 . 4.91 1073 861 A 21 CYS HA A 25 CYS HA 1.0 . 3.97 1074 862 A 29 GLU HA A 31 CYS HBy 1.0 . 5.50 1075 863 A 29 GLU HBy A 29 GLU HA 1.0 . 2.95 1076 864 A 29 GLU HA A 31 CYS H 1.0 . 4.51 1077 865 A 66 CYS HA A 66 CYS HBx 1.0 . 2.77 1078 866 A 66 CYS HA A 40 ASN HBy 1.0 . 3.44 1079 867 A 66 CYS HA A 40 ASN H 1.0 . 3.93 1080 868 A 66 CYS HA A 40 ASN HD2x 1.0 . 5.49 1081 869 A 40 ASN HD2y A 66 CYS HA 1.0 . 0.00 1082 870 A 37 LYS H A 37 LYS HBx 1.0 . 3.21 1083 871 A 50 LYS H A 51 GLU HGy 1.0 . 5.50 1084 872 A 51 GLU HGx A 50 LYS H 1.0 . 0.00 1085 872 A 50 LYS H A 51 GLU HGy 1.0 . 0.00 1086 873 A 19 CYS HBx A 18 PRO HBx 1.0 . 4.89 1087 874 A 16 SER HBy A 20 GLN HGx 1.0 . 0.00 1088 874 A 20 GLN HGx A 16 SER HBx 1.0 . 0.00 1089 875 A 20 GLN HGx A 16 SER HBx 1.0 . 0.00 1090 876 A 20 GLN HBy A 16 SER HBx 1.0 . 4.32 1091 877 A 16 SER HBy A 20 GLN HBy 1.0 . 0.00 1092 877 A 20 GLN HBy A 16 SER HBx 1.0 . 0.00 1093 878 A 20 GLN HE2y A 16 SER HBx 1.0 . 5.50 1094 879 A 20 GLN HE2x A 16 SER HBx 1.0 . 0.00 1095 880 A 7 GLY HAx A 10 CYS HBx 1.0 . 0.00 1096 880 A 10 CYS HBx A 7 GLY HAy 1.0 . 0.00 1097 881 A 8 GLU HBy A 7 GLY HAy 1.0 . 0.00 1098 881 A 7 GLY HAy A 8 GLU HBx 1.0 . 0.00 1099 881 A 7 GLY HAx A 8 GLU HBx 1.0 . 0.00 1100 881 A 7 GLY HAx A 8 GLU HBy 1.0 . 0.00 1101 882 A 6 LYS HBy A 7 GLY HAy 1.0 . 0.00 1102 882 A 7 GLY HAx A 6 LYS HBx 1.0 . 0.00 1103 882 A 6 LYS HBx A 7 GLY HAy 1.0 . 0.00 1104 882 A 7 GLY HAx A 6 LYS HBy 1.0 . 0.00 1105 883 A 9 LYS HBx A 7 GLY HAx 1.0 . 0.00 1106 883 A 9 LYS HBx A 7 GLY HAy 1.0 . 0.00 1107 884 A 67 LYS HA A 67 LYS HEx 1.0 . 4.91 1108 885 A 67 LYS HA A 67 LYS HEx 1.0 . 0.00 1109 885 A 67 LYS HA A 67 LYS HEy 1.0 . 0.00 1110 886 A 67 LYS HA A 67 LYS HEx 1.0 . 0.00 1111 887 A 67 LYS HA A 40 ASN H 1.0 . 4.91 1112 888 A 67 LYS HA A 66 CYS H 1.0 . 5.50 1113 889 A 67 LYS HA A 64 CYS H 1.0 . 0.00 1114 890 A 40 ASN HD2y A 67 LYS HA 1.0 . 4.40 1115 891 A 40 ASN HD2x A 67 LYS HA 1.0 . 0.00 1116 892 A 66 CYS HA A 67 LYS HA 1.0 . 4.93 1117 893 A 42 THR HG2% A 41 CYS HA 1.0 . 3.97 1118 894 A 42 THR HG2% A 54 GLY HAx 1.0 . 0.00 1119 895 A 58 CYS HA A 52 CYS HBx 1.0 . 2.72 1120 896 A 58 CYS HA A 59 LYS HGy 1.0 . 5.50 1121 897 A 58 CYS HA A 59 LYS HGx 1.0 . 0.00 1122 897 A 58 CYS HA A 59 LYS HGy 1.0 . 0.00 1123 898 A 58 CYS HA A 59 LYS H 1.0 . 2.82 1124 899 A 48 CYS HBx A 40 ASN HBy 1.0 . 0.00 1125 900 A 48 CYS HBx A 47 LYS HBx 1.0 . 5.50 1126 901 A 48 CYS HBx A 50 LYS HBx 1.0 . 0.00 1127 902 A 48 CYS HBx A 50 LYS HGy 1.0 . 0.00 1128 903 A 48 CYS HBx A 50 LYS HGy 1.0 . 4.96 1129 904 A 48 CYS HBx A 50 LYS H 1.0 . 5.38 1130 905 A 48 CYS HBx A 48 CYS HA 1.0 . 2.81 1131 906 A 7 GLY HAy A 8 GLU HBx 1.0 . 0.00 1132 906 A 8 GLU HBy A 7 GLY HAy 1.0 . 0.00 1133 907 A 7 GLY HAy A 8 GLU HBx 1.0 . 0.00 1134 908 A 7 GLY HAx A 8 GLU HBx 1.0 . 0.00 1135 908 A 7 GLY HAx A 8 GLU HBy 1.0 . 0.00 1136 908 A 8 GLU HBy A 7 GLY HAy 1.0 . 0.00 1137 908 A 7 GLY HAy A 8 GLU HBx 1.0 . 0.00 1138 909 A 6 LYS HA A 7 GLY HAy 1.0 . 5.50 1139 910 A 49 GLY HAx A 50 LYS HA 1.0 . 0.00 1140 910 A 50 LYS HA A 49 GLY HAy 1.0 . 0.00 1141 911 A 50 LYS HA A 49 GLY HAy 1.0 . 0.00 1142 912 A 39 CYS HBx A 54 GLY HAx 1.0 . 0.00 1143 913 A 54 GLY HAx A 41 CYS HBx 1.0 . 0.00 1144 914 A 54 GLY HAx A 55 PRO HGy 1.0 . 0.00 1145 915 A 55 PRO HA A 58 CYS HBx 1.0 . 3.44 1146 916 A 55 PRO HA A 58 CYS HBy 1.0 . 0.00 1147 916 A 55 PRO HA A 58 CYS HBx 1.0 . 0.00 1148 917 A 11 THR HG2% A 26 GLN HGx 1.0 . 4.57 1149 918 A 26 GLN H A 26 GLN HGx 1.0 . 4.54 1150 919 A 26 GLN HGy A 26 GLN H 1.0 . 0.00 1151 919 A 26 GLN H A 26 GLN HGx 1.0 . 0.00 1152 920 A 4 LYS HA A 4 LYS HGy 1.0 . 4.39 1153 920 A 4 LYS HA A 4 LYS HGx 1.0 . 4.39 1154 921 A 58 CYS HA A 59 LYS HGx 1.0 . 0.00 1155 921 A 58 CYS HA A 59 LYS HGy 1.0 . 0.00 1156 922 A 58 CYS HA A 59 LYS HGy 1.0 . 0.00 1157 923 A 5 GLY HAx A 4 LYS HBy 1.0 . 4.76 1158 923 A 4 LYS HBy A 5 GLY HAy 1.0 . 4.76 1159 923 A 5 GLY HAx A 4 LYS HBx 1.0 . 4.76 1160 923 A 4 LYS HBx A 5 GLY HAy 1.0 . 4.76 1161 924 A 6 LYS HA A 5 GLY HAx 1.0 . 4.53 1162 924 A 6 LYS HA A 5 GLY HAy 1.0 . 4.53 1163 925 A 5 GLY HAy A 6 LYS HBx 1.0 . 5.34 1164 925 A 5 GLY HAx A 6 LYS HBx 1.0 . 5.34 1165 926 A 6 LYS HBy A 5 GLY HAx 1.0 . 0.00 1166 926 A 5 GLY HAx A 6 LYS HBx 1.0 . 0.00 1167 926 A 6 LYS HBy A 5 GLY HAy 1.0 . 0.00 1168 926 A 5 GLY HAy A 6 LYS HBx 1.0 . 0.00 1169 927 A 4 LYS HBx A 5 GLY HAy 1.0 . 0.00 1170 927 A 5 GLY HAx A 4 LYS HBx 1.0 . 0.00 1171 928 A 5 GLY HAx A 6 LYS HEy 1.0 . 5.50 1172 928 A 5 GLY HAy A 6 LYS HEy 1.0 . 5.50 1173 928 A 5 GLY HAx A 6 LYS HEx 1.0 . 5.50 1174 928 A 6 LYS HEx A 5 GLY HAy 1.0 . 5.50 1175 929 A 6 LYS HGy A 6 LYS H 1.0 . 5.50 1176 929 A 6 LYS H A 6 LYS HGx 1.0 . 5.50 1177 930 A 6 LYS H A 6 LYS HGx 1.0 . 0.00 1178 931 A 4 LYS HGy A 6 LYS H 1.0 . 0.00 1179 931 A 6 LYS H A 4 LYS HGx 1.0 . 0.00 1180 932 A 6 LYS HEx A 6 LYS HGx 1.0 . 3.88 1181 932 A 6 LYS HGy A 6 LYS HEx 1.0 . 3.88 1182 932 A 6 LYS HEy A 6 LYS HGx 1.0 . 3.88 1183 932 A 6 LYS HGy A 6 LYS HEy 1.0 . 3.88 1184 933 A 9 LYS HEy A 9 LYS HGx 1.0 . 0.00 1185 933 A 9 LYS HGy A 9 LYS HEx 1.0 . 0.00 1186 933 A 9 LYS HEx A 9 LYS HGx 1.0 . 0.00 1187 933 A 9 LYS HGy A 9 LYS HEy 1.0 . 0.00 1188 934 A 15 ARG HA A 6 LYS HGy 1.0 . 5.50 1189 934 A 15 ARG HA A 6 LYS HGx 1.0 . 5.50 1190 935 A 15 ARG HA A 6 LYS HGx 1.0 . 0.00 1191 936 A 7 GLY HAy A 8 GLU HGy 1.0 . 5.50 1192 936 A 8 GLU HGx A 7 GLY HAy 1.0 . 5.50 1193 937 A 7 GLY HAy A 8 GLU HGy 1.0 . 0.00 1194 938 A 7 GLY HAy A 8 GLU HGy 1.0 . 0.00 1195 938 A 8 GLU HGx A 7 GLY HAy 1.0 . 0.00 1196 938 A 7 GLY HAx A 8 GLU HGy 1.0 . 0.00 1197 938 A 7 GLY HAx A 8 GLU HGx 1.0 . 0.00 1198 939 A 8 GLU HGx A 8 GLU H 1.0 . 5.32 1199 939 A 8 GLU H A 8 GLU HGy 1.0 . 5.32 1200 940 A 8 GLU H A 8 GLU HGy 1.0 . 0.00 1201 941 A 8 GLU HGx A 9 LYS H 1.0 . 5.50 1202 941 A 9 LYS H A 8 GLU HGy 1.0 . 5.50 1203 942 A 9 LYS H A 8 GLU HGy 1.0 . 0.00 1204 943 A 15 ARG HA A 15 ARG HDy 1.0 . 5.34 1205 943 A 15 ARG HA A 15 ARG HDx 1.0 . 5.34 1206 944 A 20 GLN HE2y A 18 PRO HGy 1.0 . 4.61 1207 944 A 20 GLN HE2y A 18 PRO HGx 1.0 . 4.61 1208 945 A 20 GLN HE2y A 18 PRO HGx 1.0 . 0.00 1209 946 A 20 GLN HE2x A 18 PRO HGx 1.0 . 0.00 1210 947 A 20 GLN HE2y A 18 PRO HGx 1.0 . 0.00 1211 947 A 20 GLN HE2x A 18 PRO HGx 1.0 . 0.00 1212 948 A 20 GLN HE2x A 18 PRO HGy 1.0 . 4.61 1213 948 A 20 GLN HE2x A 18 PRO HGx 1.0 . 4.61 1214 949 A 20 GLN HE2x A 18 PRO HGx 1.0 . 0.00 1215 950 A 20 GLN HE2y A 18 PRO HGx 1.0 . 0.00 1216 951 A 23 SER HBy A 22 GLY HAx 1.0 . 0.00 1217 951 A 22 GLY HAx A 23 SER HBx 1.0 . 0.00 1218 951 A 22 GLY HAy A 23 SER HBy 1.0 . 0.00 1219 951 A 22 GLY HAy A 23 SER HBx 1.0 . 0.00 1220 952 A 24 LYS HGx A 23 SER HA 1.0 . 5.50 1221 952 A 23 SER HA A 24 LYS HGy 1.0 . 5.50 1222 953 A 23 SER HA A 24 LYS HGy 1.0 . 0.00 1223 954 A 23 SER HBx A 24 LYS HBx 1.0 . 5.34 1224 954 A 23 SER HBy A 24 LYS HBx 1.0 . 5.34 1225 955 A 23 SER HBy A 24 LYS HDx 1.0 . 0.00 1226 955 A 23 SER HBy A 24 LYS HDy 1.0 . 0.00 1227 955 A 24 LYS HDy A 23 SER HBx 1.0 . 0.00 1228 955 A 23 SER HBx A 24 LYS HDx 1.0 . 0.00 1229 956 A 23 SER HBx A 24 LYS HBx 1.0 . 0.00 1230 956 A 24 LYS HBy A 23 SER HBy 1.0 . 0.00 1231 956 A 24 LYS HBy A 23 SER HBx 1.0 . 0.00 1232 956 A 23 SER HBy A 24 LYS HBx 1.0 . 0.00 1233 957 A 24 LYS HGx A 23 SER HBy 1.0 . 5.50 1234 957 A 23 SER HBx A 24 LYS HGy 1.0 . 5.50 1235 957 A 24 LYS HGx A 23 SER HBx 1.0 . 5.50 1236 957 A 23 SER HBy A 24 LYS HGy 1.0 . 5.50 1237 958 A 24 LYS HGx A 24 LYS H 1.0 . 4.23 1238 958 A 24 LYS H A 24 LYS HGy 1.0 . 4.23 1239 959 A 24 LYS H A 24 LYS HGy 1.0 . 0.00 1240 960 A 26 GLN HA A 26 GLN HGy 1.0 . 3.33 1241 960 A 26 GLN HA A 26 GLN HGx 1.0 . 3.33 1242 961 A 26 GLN HA A 26 GLN HGx 1.0 . 0.00 1243 962 A 62 SER HBx A 26 GLN HA 1.0 . 5.16 1244 962 A 26 GLN HA A 62 SER HBy 1.0 . 5.16 1245 963 A 26 GLN HA A 62 SER HBy 1.0 . 0.00 1246 964 A 29 GLU HBy A 61 GLY HAy 1.0 . 0.00 1247 965 A 29 GLU HBy A 61 GLY HAx 1.0 . 0.00 1248 965 A 29 GLU HBy A 61 GLY HAy 1.0 . 0.00 1249 966 A 29 GLU HBy A 30 GLY HAy 1.0 . 0.00 1250 967 A 29 GLU HGy A 61 GLY HAy 1.0 . 5.50 1251 967 A 61 GLY HAx A 29 GLU HGy 1.0 . 5.50 1252 968 A 61 GLY HAx A 29 GLU HGy 1.0 . 0.00 1253 968 A 29 GLU HGx A 61 GLY HAy 1.0 . 0.00 1254 968 A 29 GLU HGy A 61 GLY HAy 1.0 . 0.00 1255 968 A 61 GLY HAx A 29 GLU HGx 1.0 . 0.00 1256 969 A 32 THR HA A 37 LYS HBy 1.0 . 5.50 1257 969 A 32 THR HA A 37 LYS HBx 1.0 . 5.50 1258 970 A 38 THR HA A 37 LYS HDx 1.0 . 0.00 1259 970 A 38 THR HA A 37 LYS HDy 1.0 . 0.00 1260 971 A 32 THR HA A 37 LYS HDx 1.0 . 0.00 1261 971 A 32 THR HA A 37 LYS HDy 1.0 . 0.00 1262 972 A 32 THR HA A 37 LYS HDx 1.0 . 0.00 1263 973 A 32 THR HA A 37 LYS HEy 1.0 . 4.56 1264 973 A 32 THR HA A 37 LYS HEx 1.0 . 4.56 1265 974 A 37 LYS HA A 37 LYS HEy 1.0 . 0.00 1266 975 A 37 LYS HA A 37 LYS HEy 1.0 . 0.00 1267 975 A 37 LYS HA A 37 LYS HEx 1.0 . 0.00 1268 976 A 9 LYS HA A 9 LYS HEy 1.0 . 0.00 1269 976 A 9 LYS HA A 9 LYS HEx 1.0 . 0.00 1270 977 A 32 THR HG2% A 37 LYS HEx 1.0 . 5.50 1271 977 A 32 THR HG2% A 37 LYS HEy 1.0 . 5.50 1272 978 A 38 THR HG2% A 37 LYS HEy 1.0 . 0.00 1273 979 A 38 THR HG2% A 37 LYS HEy 1.0 . 0.00 1274 979 A 38 THR HG2% A 37 LYS HEx 1.0 . 0.00 1275 980 A 37 LYS HBy A 33 CYS H 1.0 . 5.29 1276 980 A 33 CYS H A 37 LYS HBx 1.0 . 5.29 1277 981 A 33 CYS H A 37 LYS HDx 1.0 . 0.00 1278 981 A 33 CYS H A 37 LYS HDy 1.0 . 0.00 1279 982 A 33 CYS H A 37 LYS HBx 1.0 . 0.00 1280 983 A 33 CYS H A 37 LYS HDx 1.0 . 0.00 1281 984 A 37 LYS HGy A 33 CYS H 1.0 . 5.50 1282 984 A 33 CYS H A 37 LYS HGx 1.0 . 5.50 1283 985 A 33 CYS H A 37 LYS HGx 1.0 . 0.00 1284 986 A 34 ALA HB% A 33 CYS H 1.0 . 0.00 1285 987 A 33 CYS HBx A 37 LYS HBx 1.0 . 0.00 1286 987 A 33 CYS HBy A 37 LYS HBx 1.0 . 0.00 1287 988 A 33 CYS HBy A 37 LYS HBx 1.0 . 0.00 1288 989 A 34 ALA HA A 37 LYS HBy 1.0 . 4.91 1289 989 A 34 ALA HA A 37 LYS HBx 1.0 . 4.91 1290 990 A 34 ALA HA A 37 LYS HBx 1.0 . 0.00 1291 991 A 37 LYS HBy A 35 ALA H 1.0 . 5.50 1292 991 A 35 ALA H A 37 LYS HBx 1.0 . 5.50 1293 992 A 35 ALA H A 37 LYS HBx 1.0 . 0.00 1294 993 A 37 LYS HBy A 36 CYS H 1.0 . 4.92 1295 993 A 36 CYS H A 37 LYS HBx 1.0 . 4.92 1296 994 A 36 CYS H A 37 LYS HBx 1.0 . 0.00 1297 995 A 37 LYS HA A 37 LYS HDx 1.0 . 3.69 1298 995 A 37 LYS HA A 37 LYS HDy 1.0 . 3.69 1299 996 A 37 LYS HA A 37 LYS HDx 1.0 . 0.00 1300 997 A 37 LYS HBy A 37 LYS HEy 1.0 . 5.50 1301 997 A 37 LYS HBy A 37 LYS HEx 1.0 . 5.50 1302 997 A 37 LYS HEx A 37 LYS HBx 1.0 . 5.50 1303 997 A 37 LYS HBx A 37 LYS HEy 1.0 . 5.50 1304 998 A 9 LYS HBx A 9 LYS HEy 1.0 . 0.00 1305 999 A 9 LYS HBx A 9 LYS HEy 1.0 . 0.00 1306 999 A 9 LYS HBx A 9 LYS HEx 1.0 . 0.00 1307 1000 A 37 LYS HEy A 37 LYS HGx 1.0 . 3.77 1308 1000 A 37 LYS HGy A 37 LYS HEy 1.0 . 3.77 1309 1000 A 37 LYS HGy A 37 LYS HEx 1.0 . 3.77 1310 1000 A 37 LYS HEx A 37 LYS HGx 1.0 . 3.77 1311 1001 A 4 LYS HEx A 4 LYS HGx 1.0 . 0.00 1312 1001 A 4 LYS HGy A 4 LYS HEx 1.0 . 0.00 1313 1001 A 4 LYS HEy A 4 LYS HGx 1.0 . 0.00 1314 1001 A 4 LYS HGy A 4 LYS HEy 1.0 . 0.00 1315 1002 A 37 LYS HEx A 37 LYS HGx 1.0 . 0.00 1316 1002 A 37 LYS HEy A 37 LYS HGx 1.0 . 0.00 1317 1003 A 9 LYS HEy A 9 LYS HGx 1.0 . 0.00 1318 1004 A 9 LYS HEx A 9 LYS HGx 1.0 . 0.00 1319 1004 A 9 LYS HEy A 9 LYS HGx 1.0 . 0.00 1320 1005 A 37 LYS HGy A 38 THR H 1.0 . 4.68 1321 1005 A 38 THR H A 37 LYS HGx 1.0 . 4.68 1322 1006 A 38 THR H A 37 LYS HGx 1.0 . 0.00 1323 1007 A 55 PRO HA A 37 LYS HDx 1.0 . 5.50 1324 1007 A 55 PRO HA A 37 LYS HDy 1.0 . 5.50 1325 1008 A 55 PRO HA A 37 LYS HDx 1.0 . 0.00 1326 1009 A 55 PRO HGy A 37 LYS HDx 1.0 . 5.23 1327 1009 A 55 PRO HGy A 37 LYS HDy 1.0 . 5.23 1328 1010 A 42 THR HB A 44 ASP HBx 1.0 . 5.31 1329 1010 A 42 THR HB A 44 ASP HBy 1.0 . 5.31 1330 1011 A 42 THR HB A 44 ASP HBx 1.0 . 0.00 1331 1012 A 42 THR HG2% A 44 ASP HBy 1.0 . 4.95 1332 1012 A 44 ASP HBx A 42 THR HG2% 1.0 . 4.95 1333 1013 A 44 ASP HBx A 42 THR HG2% 1.0 . 0.00 1334 1014 A 46 CYS HBy A 51 GLU HGy 1.0 . 5.50 1335 1014 A 51 GLU HGx A 46 CYS HBy 1.0 . 5.50 1336 1015 A 46 CYS HBy A 51 GLU HBy 1.0 . 0.00 1337 1015 A 51 GLU HBx A 46 CYS HBy 1.0 . 0.00 1338 1016 A 46 CYS HBx A 51 GLU HBy 1.0 . 0.00 1339 1016 A 51 GLU HBx A 46 CYS HBy 1.0 . 0.00 1340 1016 A 46 CYS HBy A 51 GLU HBy 1.0 . 0.00 1341 1016 A 46 CYS HBx A 51 GLU HBx 1.0 . 0.00 1342 1017 A 46 CYS HBy A 51 GLU HBy 1.0 . 0.00 1343 1018 A 50 LYS H A 50 LYS HDy 1.0 . 5.50 1344 1018 A 50 LYS H A 50 LYS HDx 1.0 . 5.50 1345 1019 A 50 LYS H A 50 LYS HDy 1.0 . 0.00 1346 1020 A 58 CYS HA A 59 LYS HBx 1.0 . 5.50 1347 1020 A 58 CYS HA A 59 LYS HBy 1.0 . 5.50 1348 1021 A 58 CYS HA A 59 LYS HBy 1.0 . 0.00 1349 1022 A 58 CYS HA A 59 LYS HDy 1.0 . 0.00 1350 1023 A 58 CYS HA A 59 LYS HDy 1.0 . 0.00 1351 1023 A 58 CYS HA A 59 LYS HDx 1.0 . 0.00 1352 1024 A 59 LYS HGx A 59 LYS HA 1.0 . 3.65 1353 1024 A 59 LYS HA A 59 LYS HGy 1.0 . 3.65 1354 1025 A 59 LYS HA A 59 LYS HGy 1.0 . 0.00 1355 1026 A 16 SER H A 17 GLU H 1.0 . 4.80 1356 1027 A 47 LYS HA A 48 CYS H 1.0 . 3.45 1357 1028 A 48 CYS H A 49 GLY HAy 1.0 . 0.00 1358 1029 A 52 CYS HBx A 54 GLY H 1.0 . 3.86 1359 1030 A 13 ALA H A 12 SER HBy 1.0 . 5.21 1360 1031 A 12 SER HBx A 13 ALA H 1.0 . 0.00 1361 1031 A 13 ALA H A 12 SER HBy 1.0 . 0.00 1362 1032 A 66 CYS HBx A 41 CYS H 1.0 . 3.58 1363 1033 A 11 THR HG2% A 28 GLY H 1.0 . 4.84 1364 1034 A 52 CYS HBx A 59 LYS H 1.0 . 4.31 1365 1035 A 59 LYS HBx A 59 LYS H 1.0 . 0.00 1366 1035 A 59 LYS H A 59 LYS HBy 1.0 . 0.00 1367 1036 A 59 LYS H A 59 LYS HBy 1.0 . 0.00 1368 1037 A 60 CYS H A 59 LYS HGy 1.0 . 5.50 1369 1038 A 59 LYS HGx A 60 CYS H 1.0 . 0.00 1370 1038 A 60 CYS H A 59 LYS HGy 1.0 . 0.00 1371 1039 A 46 CYS H A 45 GLY H 1.0 . 4.18 1372 1040 A 50 LYS HBx A 50 LYS H 1.0 . 2.91 1373 1041 A 48 CYS H A 50 LYS H 1.0 . 4.03 1374 1042 A 15 ARG H A 14 CYS H 1.0 . 3.07 1375 1043 A 55 PRO HBx A 37 LYS H 1.0 . 0.00 1376 1044 A 9 LYS HBx A 29 GLU H 1.0 . 4.15 1377 1045 A 29 GLU H A 9 LYS HDy 1.0 . 0.00 1378 1046 A 29 GLU H A 9 LYS HDy 1.0 . 0.00 1379 1046 A 29 GLU H A 9 LYS HDx 1.0 . 0.00 1380 1047 A 49 GLY H A 49 GLY HAy 1.0 . 2.89 1381 1048 A 48 CYS HBx A 49 GLY H 1.0 . 4.87 1382 1049 A 52 CYS H A 46 CYS HBy 1.0 . 4.28 1383 1050 A 46 CYS HBx A 52 CYS H 1.0 . 0.00 1384 1050 A 52 CYS H A 46 CYS HBy 1.0 . 0.00 1385 1051 A 22 GLY HAx A 25 CYS HBy 1.0 . 5.50 1386 1052 A 22 GLY HAy A 25 CYS HBy 1.0 . 0.00 1387 1052 A 22 GLY HAx A 25 CYS HBy 1.0 . 0.00 1388 1053 A 22 GLY HAx A 25 CYS HBy 1.0 . 0.00 1389 1053 A 25 CYS HBx A 22 GLY HAx 1.0 . 0.00 1390 1054 A 38 THR HA A 55 PRO HGy 1.0 . 5.44 1391 1055 A 54 GLY HAx A 55 PRO HGy 1.0 . 0.00 1392 1056 A 8 GLU HA A 9 LYS HGx 1.0 . 5.50 1393 1057 A 15 ARG HA A 6 LYS HGy 1.0 . 0.00 1394 1057 A 15 ARG HA A 6 LYS HGx 1.0 . 0.00 1395 1058 A 6 LYS HGy A 7 GLY HAy 1.0 . 0.00 1396 1058 A 7 GLY HAx A 6 LYS HGx 1.0 . 0.00 1397 1058 A 6 LYS HGx A 7 GLY HAy 1.0 . 0.00 1398 1058 A 7 GLY HAx A 6 LYS HGy 1.0 . 0.00 1399 1059 A 7 GLY HAy A 9 LYS HGx 1.0 . 0.00 1400 1059 A 7 GLY HAx A 9 LYS HGx 1.0 . 0.00 1401 1060 A 15 ARG HA A 6 LYS HGx 1.0 . 0.00 1402 1061 A 25 CYS HA A 25 CYS HBy 1.0 . 3.02 1403 1062 A 52 CYS HBx A 60 CYS H 1.0 . 5.50 1404 1063 A 20 GLN HGx A 13 ALA HA 1.0 . 0.00 1405 1064 A 23 SER HA A 25 CYS HBy 1.0 . 5.50 1406 1065 A 25 CYS HBx A 23 SER HA 1.0 . 0.00 1407 1065 A 23 SER HA A 25 CYS HBy 1.0 . 0.00 1408 1066 A 38 THR H A 37 LYS HGx 1.0 . 5.50 1409 1067 A 32 THR H A 37 LYS HGx 1.0 . 0.00 1410 1068 A 39 CYS HA A 67 LYS HEx 1.0 . 5.23 1411 1069 A 67 LYS HA A 67 LYS HEx 1.0 . 0.00 1412 1070 A 39 CYS HA A 67 LYS HEx 1.0 . 0.00 1413 1070 A 39 CYS HA A 67 LYS HEy 1.0 . 0.00 1414 1071 A 67 LYS HA A 67 LYS HEx 1.0 . 0.00 1415 1071 A 67 LYS HA A 67 LYS HEy 1.0 . 0.00 1416 1072 A 31 CYS H A 31 CYS HBy 1.0 . 0.00 1417 1073 A 31 CYS HBx A 31 CYS H 1.0 . 0.00 1418 1073 A 31 CYS H A 31 CYS HBy 1.0 . 0.00 1419 1074 A 6 LYS HGx A 33 CYS HBy 1.0 . 5.50 1420 1075 A 60 CYS HBy A 67 LYS HDx 1.0 . 0.00 1421 1076 A 6 LYS HGy A 33 CYS HBy 1.0 . 0.00 1422 1076 A 6 LYS HGx A 33 CYS HBy 1.0 . 0.00 1423 1077 A 60 CYS HBy A 59 LYS H 1.0 . 5.09 1424 1078 A 29 GLU HBy A 30 GLY HAx 1.0 . 0.00 1425 1078 A 29 GLU HBy A 30 GLY HAy 1.0 . 0.00 1426 1079 A 29 GLU HBy A 30 GLY HAy 1.0 . 0.00 1427 1080 A 46 CYS HA A 47 LYS HGy 1.0 . 4.45 1428 1081 A 46 CYS HA A 47 LYS HGx 1.0 . 0.00 1429 1081 A 46 CYS HA A 47 LYS HGy 1.0 . 0.00 1430 1082 A 52 CYS HA A 53 THR H 1.0 . 2.76 1431 1083 A 21 CYS HBx A 36 CYS HBx 1.0 . 3.47 1432 1084 A 32 THR HA A 37 LYS HGx 1.0 . 4.97 1433 1085 A 9 LYS HEy A 29 GLU HGy 1.0 . 5.50 1434 1086 A 9 LYS HEx A 29 GLU HGy 1.0 . 0.00 1435 1086 A 9 LYS HEy A 29 GLU HGy 1.0 . 0.00 1436 1087 A 29 GLU HGx A 9 LYS HEx 1.0 . 0.00 1437 1087 A 9 LYS HEy A 29 GLU HGy 1.0 . 0.00 1438 1087 A 9 LYS HEx A 29 GLU HGy 1.0 . 0.00 1439 1087 A 29 GLU HGx A 9 LYS HEy 1.0 . 0.00 1440 1088 A 67 LYS HDx A 62 SER HBy 1.0 . 5.50 1441 1089 A 62 SER HBx A 67 LYS HDx 1.0 . 0.00 1442 1089 A 67 LYS HDx A 62 SER HBy 1.0 . 0.00 1443 1090 A 33 CYS HBy A 37 LYS HDx 1.0 . 0.00 1444 1091 A 33 CYS HBy A 37 LYS HDx 1.0 . 0.00 1445 1091 A 33 CYS HBx A 37 LYS HDx 1.0 . 0.00 1446 1092 A 14 CYS HA A 21 CYS HA 1.0 . 5.50 1447 1093 A 14 CYS HA A 36 CYS HBx 1.0 . 0.00 1448 1094 A 51 GLU HA A 46 CYS HBy 1.0 . 3.64 1449 1095 A 14 CYS HBx A 11 THR HG2% 1.0 . 4.74 1450 1096 A 29 GLU HA A 29 GLU HGy 1.0 . 4.18 1451 1097 A 29 GLU HGx A 29 GLU HA 1.0 . 0.00 1452 1097 A 29 GLU HA A 29 GLU HGy 1.0 . 0.00 1453 1098 A 38 THR H A 37 LYS HBx 1.0 . 0.00 1454 1099 A 50 LYS HA A 51 GLU HGy 1.0 . 5.50 1455 1100 A 51 GLU HGx A 50 LYS HA 1.0 . 0.00 1456 1100 A 50 LYS HA A 51 GLU HGy 1.0 . 0.00 1457 1101 A 38 THR HG2% A 67 LYS HA 1.0 . 4.37 1458 1102 A 48 CYS HBx A 66 CYS HBx 1.0 . 4.75 1459 1103 A 55 PRO HA A 37 LYS HGx 1.0 . 4.50 1460 1104 A 55 PRO HA A 37 LYS HGx 1.0 . 0.00 1461 1105 A 8 GLU HA A 8 GLU HBy 1.0 . 2.67 1462 1105 A 8 GLU HA A 8 GLU HBx 1.0 . 2.67 1463 1106 A 9 LYS HDx A 29 GLU HGy 1.0 . 5.50 1464 1106 A 9 LYS HDy A 29 GLU HGy 1.0 . 5.50 1465 1107 A 9 LYS HDy A 29 GLU HGy 1.0 . 0.00 1466 1108 A 9 LYS HDy A 29 GLU HGy 1.0 . 0.00 1467 1108 A 29 GLU HGx A 9 LYS HDy 1.0 . 0.00 1468 1109 A 9 LYS HBx A 29 GLU HGy 1.0 . 0.00 1469 1110 A 9 LYS HBx A 29 GLU HGx 1.0 . 0.00 1470 1110 A 9 LYS HBx A 29 GLU HGy 1.0 . 0.00 1471 1111 A 12 SER HA A 15 ARG HDy 1.0 . 4.33 1472 1111 A 12 SER HA A 15 ARG HDx 1.0 . 4.33 1473 1112 A 12 SER HA A 15 ARG HDx 1.0 . 0.00 1474 1113 A 12 SER HBx A 15 ARG H 1.0 . 5.33 1475 1113 A 15 ARG H A 12 SER HBy 1.0 . 5.33 1476 1114 A 16 SER HBy A 17 GLU H 1.0 . 3.33 1477 1114 A 17 GLU H A 16 SER HBx 1.0 . 3.33 1478 1115 A 29 GLU HBy A 61 GLY HAx 1.0 . 5.50 1479 1115 A 29 GLU HBy A 61 GLY HAy 1.0 . 5.50 1480 1116 A 37 LYS HEx A 37 LYS HBx 1.0 . 5.23 1481 1116 A 37 LYS HBx A 37 LYS HEy 1.0 . 5.23 1482 1117 A 37 LYS HBx A 37 LYS HEy 1.0 . 0.00 1483 1118 A 50 LYS HDx A 49 GLY HAy 1.0 . 5.50 1484 1118 A 49 GLY HAy A 50 LYS HDy 1.0 . 5.50 1485 1119 A 49 GLY HAy A 50 LYS HDy 1.0 . 0.00 1486 1120 A 49 GLY HAx A 50 LYS HDy 1.0 . 0.00 1487 1120 A 49 GLY HAy A 50 LYS HDy 1.0 . 0.00 1488 1120 A 49 GLY HAx A 50 LYS HDx 1.0 . 0.00 1489 1120 A 50 LYS HDx A 49 GLY HAy 1.0 . 0.00 1490 1121 A 6 LYS HDx A 7 GLY HAy 1.0 . 0.00 1491 1121 A 7 GLY HAx A 6 LYS HDy 1.0 . 0.00 1492 1121 A 7 GLY HAx A 6 LYS HDx 1.0 . 0.00 1493 1121 A 6 LYS HDy A 7 GLY HAy 1.0 . 0.00 1494 1122 A 49 GLY HAy A 50 LYS HDy 1.0 . 0.00 1495 1123 A 49 GLY HAx A 50 LYS HDy 1.0 . 0.00 1496 1123 A 49 GLY HAy A 50 LYS HDy 1.0 . 0.00 1497 1124 A 50 LYS HA A 50 LYS HDy 1.0 . 3.42 1498 1124 A 50 LYS HA A 50 LYS HDx 1.0 . 3.42 1499 1125 A 50 LYS HA A 50 LYS HDy 1.0 . 0.00 1500 1126 A 50 LYS HBx A 50 LYS HEy 1.0 . 5.45 1501 1126 A 50 LYS HBx A 50 LYS HEx 1.0 . 5.45 1502 1127 A 6 LYS HBx A 6 LYS HEy 1.0 . 0.00 1503 1128 A 6 LYS HEx A 6 LYS HBx 1.0 . 0.00 1504 1128 A 6 LYS HBx A 6 LYS HEy 1.0 . 0.00 1505 1129 A 50 LYS HBx A 50 LYS HEy 1.0 . 0.00 1506 1130 A 51 GLU HA A 51 GLU HGx 1.0 . 4.25 1507 1130 A 51 GLU HA A 51 GLU HGy 1.0 . 4.25 1508 1131 A 51 GLU HA A 51 GLU HGy 1.0 . 0.00 1509 1132 A 6 LYS HA A 7 GLY H 1.0 . 3.42 1510 1133 A 8 GLU HA A 8 GLU HGy 1.0 . 4.13 1511 1134 A 8 GLU HA A 8 GLU HGx 1.0 . 0.00 1512 1134 A 8 GLU HA A 8 GLU HGy 1.0 . 0.00 1513 1135 A 8 GLU HA A 10 CYS H 1.0 . 4.66 1514 1136 A 31 CYS HA A 30 GLY H 1.0 . 5.50 1515 1137 A 31 CYS HA A 7 GLY H 1.0 . 0.00 1516 1138 A 38 THR HG2% A 55 PRO HBx 1.0 . 0.00 1517 1139 A 39 CYS HBx A 38 THR HG2% 1.0 . 0.00 1518 1140 A 54 GLY H A 57 SER H 1.0 . 5.50 1519 1141 A 15 ARG HA A 6 LYS HEy 1.0 . 4.45 1520 1141 A 15 ARG HA A 6 LYS HEx 1.0 . 4.45 1521 1142 A 15 ARG HA A 6 LYS HEy 1.0 . 0.00 1522 1143 A 24 LYS HGx A 23 SER HBy 1.0 . 5.50 1523 1143 A 23 SER HBx A 24 LYS HGy 1.0 . 5.50 1524 1143 A 24 LYS HGx A 23 SER HBx 1.0 . 5.50 1525 1143 A 23 SER HBy A 24 LYS HGy 1.0 . 5.50 1526 1144 A 23 SER HBx A 24 LYS HGy 1.0 . 0.00 1527 1145 A 23 SER HBx A 24 LYS HGy 1.0 . 0.00 1528 1145 A 23 SER HBy A 24 LYS HGy 1.0 . 0.00 1529 1146 A 60 CYS HBy A 61 GLY HAx 1.0 . 4.97 1530 1146 A 60 CYS HBy A 61 GLY HAy 1.0 . 4.97 1531 1147 A 60 CYS HBy A 61 GLY HAy 1.0 . 0.00 1532 1148 A 47 LYS HA A 47 LYS HDy 1.0 . 4.80 1533 1149 A 47 LYS HA A 47 LYS HDy 1.0 . 0.00 1534 1149 A 47 LYS HA A 47 LYS HDx 1.0 . 0.00 1535 1150 A 7 GLY HAx A 6 LYS HA 1.0 . 0.00 1536 1150 A 6 LYS HA A 7 GLY HAy 1.0 . 0.00 stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 3 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 12 . . . . 2 ppm . . 65 . . . . 3 ppm . . 14 . . . . stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 3 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 1 ppm . . 11 . . . . 2 ppm . . 32 . . . . 3 ppm . . 14 . . . . stop_ save_