data_nef_c30520_6mjv 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 6MJV 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 3 CYS SG 1 29 CYS SG 1 9 CYS SG 1 23 CYS SG 1 13 CYS SG 1 30 CYS SG 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 LYS start . . 2 A 2 LYS middle . . 3 A 3 CYS middle -HG . 4 A 4 TRP middle . . 5 A 5 ASN middle . . 6 A 6 GLY middle . false 7 A 7 GLY middle . false 8 A 8 ARG middle . . 9 A 9 CYS middle -HG . 10 A 10 ARG middle . . 11 A 11 LYS middle . . 12 A 12 LYS middle . . 13 A 13 CYS middle -HG . 14 A 14 LYS middle . . 15 A 15 GLU middle . . 16 A 16 ASN middle . . 17 A 17 GLU middle . . 18 A 18 LYS middle . . 19 A 19 PRO middle . false 20 A 20 ILE middle . . 21 A 21 GLY middle . false 22 A 22 TYR middle . . 23 A 23 CYS middle -HG . 24 A 24 ARG middle . . 25 A 25 ASN middle . . 26 A 26 GLY middle . false 27 A 27 LYS middle . . 28 A 28 LYS middle . . 29 A 29 CYS middle -HG . 30 A 30 CYS middle -HG . 31 A 31 VAL middle . . 32 A 32 ASN end . . 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 2 LYS H H 1 8.211 0.000 A 2 LYS HA H 1 4.169 0.000 A 2 LYS HBy H 1 1.905 0.000 A 2 LYS HBx H 1 1.888 0.000 A 2 LYS HDy H 1 1.656 0.000 A 2 LYS HDx H 1 1.630 0.000 A 2 LYS HEy H 1 3.254 0.000 A 2 LYS HEx H 1 3.222 0.000 A 2 LYS HGy H 1 1.272 0.000 A 2 LYS HGx H 1 1.241 0.000 A 2 LYS CA C 13 58.078 0.000 A 2 LYS CB C 13 32.000 0.000 A 2 LYS CD C 13 27.047 0.000 A 2 LYS CE C 13 41.364 0.000 A 2 LYS CG C 13 25.710 0.000 A 3 CYS H H 1 8.040 0.000 A 3 CYS HA H 1 4.473 0.000 A 3 CYS HBx H 1 2.641 0.000 A 3 CYS HBy H 1 2.770 0.000 A 3 CYS CA C 13 56.088 0.000 A 3 CYS CB C 13 41.528 0.000 A 3 CYS N N 15 118.815 0.000 A 4 TRP H H 1 7.344 0.000 A 4 TRP HA H 1 4.589 0.000 A 4 TRP HBx H 1 3.269 0.000 A 4 TRP HBy H 1 3.321 0.000 A 4 TRP HD1 H 1 7.224 0.000 A 4 TRP HE1 H 1 7.711 0.000 A 4 TRP HH2 H 1 7.270 0.000 A 4 TRP HZ2 H 1 7.479 0.000 A 4 TRP HZ3 H 1 7.156 0.000 A 4 TRP CA C 13 57.280 0.000 A 4 TRP CB C 13 29.190 0.000 A 4 TRP N N 15 121.516 0.000 A 4 TRP NE1 N 15 127.000 0.000 A 5 ASN H H 1 8.561 0.000 A 5 ASN HA H 1 4.360 0.000 A 5 ASN HBx H 1 2.461 0.000 A 5 ASN HBy H 1 2.914 0.000 A 5 ASN HD21 H 1 6.815 0.000 A 5 ASN HD22 H 1 7.086 0.000 A 5 ASN CA C 13 53.463 0.000 A 5 ASN CB C 13 37.025 0.000 A 5 ASN N N 15 122.275 0.000 A 5 ASN ND2 N 15 110.782 0.000 A 6 GLY H H 1 8.347 0.000 A 6 GLY HAy H 1 4.082 0.000 A 6 GLY HAx H 1 3.751 0.000 A 6 GLY CA C 13 45.335 0.000 A 6 GLY N N 15 105.544 0.000 A 7 GLY H H 1 7.820 0.000 A 7 GLY HAx H 1 3.417 0.000 A 7 GLY HAy H 1 4.292 0.000 A 7 GLY CA C 13 45.314 0.000 A 7 GLY N N 15 107.784 0.000 A 8 ARG H H 1 8.548 0.000 A 8 ARG HA H 1 4.764 0.000 A 8 ARG HBy H 1 1.739 0.000 A 8 ARG HBx H 1 1.706 0.000 A 8 ARG HDx H 1 3.148 0.000 A 8 ARG HDy H 1 3.205 0.000 A 8 ARG HGy H 1 1.626 0.000 A 8 ARG HGx H 1 1.575 0.000 A 8 ARG CA C 13 53.768 0.000 A 8 ARG CB C 13 28.745 0.000 A 8 ARG CD C 13 42.663 0.000 A 8 ARG CG C 13 26.984 0.000 A 8 ARG N N 15 118.911 0.000 A 9 CYS H H 1 8.542 0.000 A 9 CYS HA H 1 5.523 0.000 A 9 CYS HBx H 1 2.731 0.000 A 9 CYS HBy H 1 2.958 0.000 A 9 CYS CA C 13 54.564 0.000 A 9 CYS CB C 13 36.930 0.000 A 9 CYS N N 15 117.442 0.000 A 10 ARG H H 1 9.682 0.000 A 10 ARG HA H 1 4.887 0.000 A 10 ARG HBx H 1 1.522 0.000 A 10 ARG HBy H 1 1.799 0.000 A 10 ARG HG2 H 1 1.241 0.000 A 10 ARG HG3 H 1 1.241 0.000 A 10 ARG CA C 13 55.257 0.000 A 10 ARG CB C 13 33.000 0.000 A 10 ARG CD C 13 42.695 0.000 A 10 ARG CG C 13 27.501 0.000 A 10 ARG N N 15 123.816 0.000 A 11 LYS H H 1 8.329 0.000 A 11 LYS HA H 1 4.114 0.000 A 11 LYS HBx H 1 1.329 0.000 A 11 LYS HBy H 1 1.891 0.000 A 11 LYS HDx H 1 1.747 0.000 A 11 LYS HDy H 1 1.757 0.000 A 11 LYS HEy H 1 3.022 0.000 A 11 LYS HEx H 1 3.003 0.000 A 11 LYS HGx H 1 1.351 0.000 A 11 LYS HGy H 1 1.458 0.000 A 11 LYS CA C 13 59.529 0.000 A 11 LYS CB C 13 33.143 0.000 A 11 LYS CD C 13 29.032 0.000 A 11 LYS CE C 13 41.643 0.000 A 11 LYS CG C 13 24.000 0.000 A 12 LYS H H 1 7.397 0.000 A 12 LYS HA H 1 4.321 0.000 A 12 LYS HBy H 1 1.687 0.000 A 12 LYS HBx H 1 1.668 0.000 A 12 LYS HDx H 1 1.641 0.000 A 12 LYS HDy H 1 1.656 0.000 A 12 LYS HEy H 1 3.009 0.000 A 12 LYS HEx H 1 3.002 0.000 A 12 LYS HGy H 1 1.404 0.000 A 12 LYS HGx H 1 1.388 0.000 A 12 LYS CA C 13 54.540 0.000 A 12 LYS CB C 13 32.928 0.000 A 12 LYS CD C 13 28.647 0.000 A 12 LYS CE C 13 41.230 0.000 A 12 LYS CG C 13 24.000 0.000 A 12 LYS N N 15 115.498 0.000 A 13 CYS H H 1 8.803 0.000 A 13 CYS HA H 1 4.801 0.000 A 13 CYS HBx H 1 2.648 0.000 A 13 CYS HBy H 1 3.316 0.000 A 13 CYS CA C 13 53.726 0.000 A 13 CYS CB C 13 34.172 0.000 A 13 CYS N N 15 121.984 0.000 A 14 LYS H H 1 8.663 0.000 A 14 LYS HA H 1 4.277 0.000 A 14 LYS HBx H 1 1.432 0.000 A 14 LYS HBy H 1 2.012 0.000 A 14 LYS HDy H 1 1.670 0.000 A 14 LYS HDx H 1 1.658 0.000 A 14 LYS HEx H 1 2.932 0.000 A 14 LYS HEy H 1 2.945 0.000 A 14 LYS HGy H 1 1.454 0.000 A 14 LYS HGx H 1 1.439 0.000 A 14 LYS CA C 13 56.070 0.000 A 14 LYS CB C 13 32.933 0.000 A 14 LYS CD C 13 28.368 0.000 A 14 LYS CE C 13 41.413 0.000 A 14 LYS CG C 13 25.315 0.000 A 14 LYS N N 15 120.848 0.000 A 15 GLU H H 1 8.967 0.000 A 15 GLU HA H 1 4.018 0.000 A 15 GLU HBx H 1 2.008 0.000 A 15 GLU HBy H 1 2.034 0.000 A 15 GLU HGx H 1 2.348 0.000 A 15 GLU HGy H 1 2.362 0.000 A 15 GLU CA C 13 58.437 0.000 A 15 GLU CB C 13 32.981 0.000 A 15 GLU CG C 13 33.768 0.000 A 15 GLU N N 15 119.702 0.000 A 16 ASN H H 1 8.231 0.000 A 16 ASN HA H 1 4.717 0.000 A 16 ASN HBx H 1 2.771 0.000 A 16 ASN HBy H 1 3.101 0.000 A 16 ASN HD21 H 1 6.840 0.000 A 16 ASN HD22 H 1 7.590 0.000 A 16 ASN CA C 13 53.020 0.000 A 16 ASN CB C 13 36.936 0.000 A 16 ASN N N 15 114.121 0.000 A 16 ASN ND2 N 15 112.344 0.000 A 17 GLU H H 1 7.654 0.000 A 17 GLU HA H 1 4.829 0.000 A 17 GLU HBx H 1 2.165 0.000 A 17 GLU HBy H 1 2.220 0.000 A 17 GLU HGx H 1 1.604 0.000 A 17 GLU HGy H 1 1.864 0.000 A 17 GLU CA C 13 57.866 0.000 A 17 GLU CB C 13 33.449 0.000 A 17 GLU CG C 13 35.744 0.000 A 17 GLU N N 15 118.397 0.000 A 18 LYS H H 1 9.126 0.000 A 18 LYS HA H 1 4.926 0.000 A 18 LYS HBx H 1 1.744 0.000 A 18 LYS HBy H 1 1.773 0.000 A 18 LYS HDx H 1 1.608 0.000 A 18 LYS HDy H 1 1.652 0.000 A 18 LYS HEx H 1 2.884 0.000 A 18 LYS HEy H 1 2.903 0.000 A 18 LYS HGy H 1 1.375 0.000 A 18 LYS HGx H 1 1.360 0.000 A 18 LYS CA C 13 52.428 0.000 A 18 LYS CB C 13 32.372 0.000 A 18 LYS CD C 13 28.849 0.000 A 18 LYS CE C 13 41.780 0.000 A 18 LYS CG C 13 24.500 0.000 A 18 LYS N N 15 119.329 0.000 A 19 PRO HA H 1 5.192 0.000 A 19 PRO HBx H 1 1.996 0.000 A 19 PRO HBy H 1 2.017 0.000 A 19 PRO HDy H 1 3.778 0.000 A 19 PRO HDx H 1 3.751 0.000 A 19 PRO HGy H 1 2.286 0.000 A 19 PRO HGx H 1 2.084 0.000 A 19 PRO CA C 13 61.218 0.000 A 19 PRO CB C 13 31.153 0.000 A 19 PRO CD C 13 50.145 0.000 A 19 PRO CG C 13 26.924 0.000 A 20 ILE H H 1 8.816 0.000 A 20 ILE HA H 1 4.510 0.000 A 20 ILE HB H 1 1.963 0.000 A 20 ILE HD1% H 1 0.645 0.000 A 20 ILE HG1x H 1 0.850 0.000 A 20 ILE HG1y H 1 0.976 0.000 A 20 ILE HG2% H 1 0.717 0.000 A 20 ILE CA C 13 59.863 0.000 A 20 ILE CB C 13 38.723 0.000 A 20 ILE CD1 C 13 14.000 0.000 A 20 ILE CG1 C 13 26.176 0.000 A 20 ILE CG2 C 13 17.512 0.000 A 20 ILE N N 15 119.636 0.000 A 21 GLY H H 1 7.427 0.000 A 21 GLY HAx H 1 3.747 0.000 A 21 GLY HAy H 1 4.323 0.000 A 21 GLY CA C 13 44.000 0.000 A 21 GLY N N 15 108.642 0.000 A 22 TYR H H 1 9.098 0.000 A 22 TYR HA H 1 5.056 0.000 A 22 TYR HBx H 1 2.720 0.000 A 22 TYR HBy H 1 3.161 0.000 A 22 TYR HD1 H 1 7.060 0.000 A 22 TYR HD2 H 1 7.060 0.000 A 22 TYR HE1 H 1 6.800 0.000 A 22 TYR HE2 H 1 6.800 0.000 A 22 TYR CA C 13 57.629 0.000 A 22 TYR CB C 13 40.863 0.000 A 22 TYR N N 15 120.161 0.000 A 23 CYS H H 1 9.010 0.000 A 23 CYS HA H 1 4.826 0.000 A 23 CYS HBx H 1 3.271 0.000 A 23 CYS HBy H 1 3.569 0.000 A 23 CYS CA C 13 55.092 0.000 A 23 CYS CB C 13 45.028 0.000 A 23 CYS N N 15 118.528 0.000 A 24 ARG H H 1 8.386 0.000 A 24 ARG HA H 1 4.709 0.000 A 24 ARG HBx H 1 1.700 0.000 A 24 ARG HBy H 1 1.719 0.000 A 24 ARG HDx H 1 2.748 0.000 A 24 ARG HDy H 1 3.022 0.000 A 24 ARG CA C 13 54.201 0.000 A 24 ARG CB C 13 31.274 0.000 A 24 ARG CD C 13 41.451 0.000 A 24 ARG CG C 13 27.000 0.000 A 24 ARG N N 15 120.544 0.000 A 25 ASN H H 1 8.834 0.000 A 25 ASN HA H 1 4.555 0.000 A 25 ASN HBx H 1 2.879 0.000 A 25 ASN HBy H 1 3.173 0.000 A 25 ASN HD21 H 1 7.534 0.000 A 25 ASN HD22 H 1 6.369 0.000 A 25 ASN CA C 13 52.367 0.000 A 25 ASN CB C 13 37.049 0.000 A 25 ASN N N 15 121.964 0.000 A 25 ASN ND2 N 15 108.982 0.000 A 26 GLY H H 1 8.209 0.000 A 26 GLY HAx H 1 3.687 0.000 A 26 GLY HAy H 1 4.253 0.000 A 26 GLY CA C 13 45.073 0.000 A 26 GLY N N 15 107.079 0.000 A 27 LYS H H 1 7.297 0.000 A 27 LYS HA H 1 4.356 0.000 A 27 LYS HBx H 1 1.685 0.000 A 27 LYS HBy H 1 1.731 0.000 A 27 LYS HDx H 1 1.082 0.000 A 27 LYS HDy H 1 1.407 0.000 A 27 LYS HEy H 1 2.918 0.000 A 27 LYS HEx H 1 2.909 0.000 A 27 LYS HGy H 1 1.493 0.000 A 27 LYS HGx H 1 1.358 0.000 A 27 LYS CA C 13 56.308 0.000 A 27 LYS CB C 13 33.983 0.000 A 27 LYS CD C 13 26.965 0.000 A 27 LYS CE C 13 42.161 0.000 A 27 LYS CG C 13 24.796 0.000 A 27 LYS N N 15 118.858 0.000 A 28 LYS H H 1 8.524 0.000 A 28 LYS HA H 1 4.253 0.000 A 28 LYS HBx H 1 1.720 0.000 A 28 LYS HBy H 1 1.739 0.000 A 28 LYS HD2 H 1 1.434 0.000 A 28 LYS HD3 H 1 1.434 0.000 A 28 LYS HE2 H 1 3.083 0.000 A 28 LYS HE3 H 1 3.083 0.000 A 28 LYS HG2 H 1 1.246 0.000 A 28 LYS HG3 H 1 1.246 0.000 A 28 LYS CA C 13 56.000 0.000 A 28 LYS CB C 13 32.377 0.000 A 28 LYS CD C 13 28.676 0.000 A 28 LYS CE C 13 41.978 0.000 A 28 LYS CG C 13 25.383 0.000 A 28 LYS N N 15 120.051 0.000 A 29 CYS H H 1 8.283 0.000 A 29 CYS HA H 1 4.659 0.000 A 29 CYS HBx H 1 2.367 0.000 A 29 CYS HBy H 1 2.435 0.000 A 29 CYS CA C 13 54.105 0.000 A 29 CYS CB C 13 38.232 0.000 A 29 CYS N N 15 119.640 0.000 A 30 CYS H H 1 8.730 0.000 A 30 CYS HA H 1 5.028 0.000 A 30 CYS HBx H 1 2.833 0.000 A 30 CYS HBy H 1 2.929 0.000 A 30 CYS CA C 13 54.158 0.000 A 30 CYS CB C 13 37.003 0.000 A 30 CYS N N 15 128.442 0.000 A 31 VAL H H 1 9.090 0.000 A 31 VAL HA H 1 4.636 0.000 A 31 VAL HB H 1 2.171 0.000 A 31 VAL HGx% H 1 0.935 0.000 A 31 VAL HGy% H 1 0.906 0.000 A 31 VAL CA C 13 60.165 0.000 A 31 VAL CB C 13 34.996 0.000 A 31 VAL CGx C 13 20.221 0.000 A 31 VAL CGy C 13 21.277 0.000 A 31 VAL N N 15 121.217 0.000 A 32 ASN H H 1 8.204 0.000 A 32 ASN HA H 1 4.672 0.000 A 32 ASN HBx H 1 2.715 0.000 A 32 ASN HBy H 1 2.785 0.000 A 32 ASN HD21 H 1 6.810 0.000 A 32 ASN HD22 H 1 7.412 0.000 A 32 ASN CA C 13 52.651 0.000 A 32 ASN CB C 13 39.548 0.000 A 32 ASN N N 15 125.843 0.000 A 32 ASN ND2 N 15 111.358 0.000 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 2 LYS HGx A 2 LYS HEx 1.0 1.8 5.24 2 2 A 2 LYS HGy A 2 LYS HEy 1.0 1.8 5.24 3 3 A 2 LYS HGx A 2 LYS HEy 1.0 1.8 5.24 4 4 A 2 LYS HA A 2 LYS HBy 1.0 1.8 4.90 5 4 A 2 LYS HA A 2 LYS HBx 1.0 1.8 4.90 6 5 A 2 LYS HEx A 2 LYS HDy 1.0 1.8 5.07 7 5 A 2 LYS HEx A 2 LYS HDx 1.0 1.8 5.07 8 6 A 2 LYS HEx A 2 LYS HGy 1.0 1.8 5.22 9 7 A 2 LYS HEx A 2 LYS HBy 1.0 1.8 5.21 10 7 A 2 LYS HEx A 2 LYS HBx 1.0 1.8 5.21 11 8 A 2 LYS HEy A 2 LYS HBy 1.0 1.8 5.21 12 8 A 2 LYS HEy A 2 LYS HBx 1.0 1.8 5.21 13 9 A 2 LYS HEy A 2 LYS HDy 1.0 1.8 4.93 14 9 A 2 LYS HEy A 2 LYS HDx 1.0 1.8 4.93 15 10 A 2 LYS HA A 2 LYS H 1.0 1.8 5.87 16 11 A 2 LYS HEy A 2 LYS HA 1.0 1.8 5.63 17 12 A 2 LYS HEx A 2 LYS HA 1.0 1.8 5.63 18 13 A 3 CYS HBy A 3 CYS HA 1.0 1.8 5.58 19 14 A 3 CYS HBy A 8 ARG HA 1.0 1.8 5.38 20 15 A 3 CYS HBy A 3 CYS H 1.0 1.8 5.81 21 16 A 8 ARG HA A 3 CYS HBx 1.0 1.8 5.68 22 17 A 3 CYS HBx A 6 GLY HAy 1.0 1.8 5.83 23 18 A 3 CYS HBy A 4 TRP HBx 1.0 1.8 4.61 24 19 A 4 TRP HBy A 4 TRP HD1 1.0 1.8 5.28 25 20 A 4 TRP H A 4 TRP HE1 1.0 1.8 5.52 26 21 A 4 TRP HD1 A 4 TRP HE1 1.0 1.8 5.27 27 22 A 4 TRP HH2 A 4 TRP HZ3 1.0 1.8 4.54 28 23 A 4 TRP HH2 A 4 TRP HZ2 1.0 1.8 4.35 29 24 A 4 TRP HBy A 4 TRP HA 1.0 1.8 4.95 30 25 A 4 TRP HBx A 4 TRP HA 1.0 1.8 4.93 31 26 A 4 TRP HD1 A 4 TRP HA 1.0 1.8 5.19 32 27 A 4 TRP H A 4 TRP HA 1.0 1.8 5.54 33 28 A 4 TRP HZ2 A 21 GLY HAx 1.0 1.8 5.25 34 29 A 4 TRP HZ2 A 21 GLY HAy 1.0 1.8 5.64 35 30 A 4 TRP HBx A 4 TRP H 1.0 1.8 5.53 36 31 A 3 CYS HBx A 4 TRP H 1.0 1.8 5.72 37 32 A 4 TRP HD1 A 29 CYS HBy 1.0 1.8 5.89 38 33 A 4 TRP HD1 A 29 CYS HBx 1.0 1.8 5.83 39 34 A 4 TRP HBx A 31 VAL HGx% 1.0 1.8 5.89 40 35 A 4 TRP HBx A 31 VAL HGy% 1.0 1.8 5.89 41 36 A 4 TRP HBy A 31 VAL HGy% 1.0 1.8 5.89 42 37 A 4 TRP HBx A 20 ILE HD1% 1.0 1.8 5.84 43 38 A 4 TRP HD1 A 20 ILE HG2% 1.0 1.8 5.50 44 39 A 4 TRP HD1 A 31 VAL HGy% 1.0 1.8 5.30 45 40 A 4 TRP HE1 A 31 VAL HGy% 1.0 1.8 5.81 46 41 A 4 TRP HBx A 5 ASN H 1.0 1.8 5.72 47 42 A 4 TRP HBy A 5 ASN H 1.0 1.8 5.72 48 43 A 4 TRP HE1 A 20 ILE HD1% 1.0 1.8 5.66 49 44 A 4 TRP HD1 A 20 ILE HD1% 1.0 1.8 5.08 50 45 A 4 TRP HBx A 4 TRP HE1 1.0 1.8 5.55 51 46 A 4 TRP HBx A 4 TRP HD1 1.0 1.8 5.67 52 47 A 4 TRP HBy A 4 TRP H 1.0 1.8 5.70 53 48 A 4 TRP HBx A 5 ASN HBx 1.0 1.8 5.27 54 49 A 4 TRP HD1 A 21 GLY HAx 1.0 1.8 5.75 55 50 A 8 ARG HA A 4 TRP H 1.0 1.8 5.57 56 51 A 4 TRP HZ2 A 20 ILE HD1% 1.0 1.8 5.82 57 52 A 4 TRP HBy A 4 TRP HE1 1.0 1.8 5.59 58 53 A 4 TRP HD1 A 5 ASN HBx 1.0 1.8 5.59 59 54 A 4 TRP HBy A 20 ILE HD1% 1.0 1.8 5.60 60 55 A 5 ASN H A 7 GLY H 1.0 1.8 5.71 61 56 A 5 ASN HBy A 31 VAL HA 1.0 1.8 5.50 62 57 A 4 TRP HA A 5 ASN H 1.0 1.8 5.23 63 58 A 5 ASN HBy A 5 ASN HA 1.0 1.8 5.74 64 59 A 5 ASN HBx A 31 VAL HB 1.0 1.8 5.48 65 60 A 5 ASN H A 5 ASN HA 1.0 1.8 5.15 66 61 A 5 ASN HA A 5 ASN HD22 1.0 1.8 5.50 67 62 A 5 ASN HBx A 5 ASN HD22 1.0 1.8 5.65 68 63 A 5 ASN HBy A 5 ASN HD22 1.0 1.8 5.57 69 64 A 5 ASN H A 5 ASN HBx 1.0 1.8 5.03 70 65 A 31 VAL HGy% A 5 ASN H 1.0 1.8 5.76 71 66 A 31 VAL HGx% A 5 ASN HBx 1.0 1.8 5.72 72 67 A 6 GLY HAy A 5 ASN HA 1.0 1.8 4.78 73 68 A 5 ASN HBx A 5 ASN HA 1.0 1.8 5.26 74 69 A 4 TRP HA A 5 ASN HBx 1.0 1.8 5.65 75 70 A 5 ASN HBx A 31 VAL HA 1.0 1.8 5.65 76 71 A 6 GLY HAy A 5 ASN HBx 1.0 1.8 5.76 77 72 A 4 TRP HBx A 5 ASN HBy 1.0 1.8 5.78 78 73 A 20 ILE HD1% A 5 ASN HD22 1.0 1.8 5.62 79 74 A 20 ILE HD1% A 5 ASN HD21 1.0 1.8 5.79 80 75 A 5 ASN HBx A 5 ASN HBy 1.0 1.8 5.51 81 76 A 7 GLY H A 6 GLY H 1.0 1.8 5.71 82 77 A 6 GLY HAx A 7 GLY HAx 1.0 1.8 4.93 83 78 A 6 GLY H A 6 GLY HAx 1.0 1.8 5.53 84 79 A 5 ASN HA A 6 GLY H 1.0 1.8 5.53 85 80 A 6 GLY HAy A 6 GLY H 1.0 1.8 5.80 86 81 A 5 ASN HA A 6 GLY HAx 1.0 1.8 5.35 87 82 A 6 GLY HAy A 6 GLY HAx 1.0 1.8 4.45 88 83 A 4 TRP H A 7 GLY HAy 1.0 1.8 5.65 89 84 A 7 GLY HAx A 32 ASN H 1.0 1.8 5.44 90 85 A 31 VAL HA A 7 GLY HAy 1.0 1.8 5.44 91 86 A 7 GLY H A 7 GLY HAx 1.0 1.8 5.07 92 87 A 7 GLY H A 6 GLY HAx 1.0 1.8 5.48 93 88 A 6 GLY HAy A 7 GLY H 1.0 1.8 5.50 94 89 A 7 GLY H A 7 GLY HAy 1.0 1.8 4.82 95 90 A 7 GLY HAx A 8 ARG HBx 1.0 1.8 5.64 96 91 A 31 VAL HGy% A 7 GLY HAy 1.0 1.8 5.25 97 92 A 31 VAL HGy% A 7 GLY H 1.0 1.8 5.40 98 93 A 6 GLY HAy A 7 GLY HAx 1.0 1.8 4.78 99 94 A 8 ARG HA A 7 GLY HAy 1.0 1.8 5.64 100 95 A 7 GLY HAx A 8 ARG HGx 1.0 1.8 5.09 101 96 A 31 VAL HGy% A 7 GLY HAx 1.0 1.8 5.43 102 97 A 7 GLY HAx A 7 GLY HAy 1.0 1.8 4.69 103 98 A 7 GLY H A 8 ARG H 1.0 1.8 5.71 104 99 A 8 ARG H A 30 CYS H 1.0 1.8 5.07 105 100 A 8 ARG HGx A 9 CYS HA 1.0 1.8 5.77 106 101 A 8 ARG HGx A 13 CYS HA 1.0 1.8 5.37 107 102 A 8 ARG H A 29 CYS HA 1.0 1.8 5.46 108 103 A 31 VAL HA A 8 ARG H 1.0 1.8 5.46 109 104 A 8 ARG HA A 8 ARG H 1.0 1.8 5.40 110 105 A 8 ARG H A 9 CYS HA 1.0 1.8 5.34 111 106 A 8 ARG H A 8 ARG HDy 1.0 1.8 5.69 112 107 A 8 ARG H A 8 ARG HDx 1.0 1.8 5.84 113 108 A 7 GLY HAy A 8 ARG H 1.0 1.8 4.96 114 109 A 8 ARG H A 14 LYS HBy 1.0 1.8 5.27 115 110 A 8 ARG HDy A 8 ARG HBy 1.0 1.8 5.56 116 111 A 8 ARG HBx A 8 ARG HDy 1.0 1.8 5.75 117 112 A 8 ARG HGx A 8 ARG HDx 1.0 1.8 4.93 118 113 A 8 ARG HGx A 8 ARG HDy 1.0 1.8 4.93 119 114 A 8 ARG HGx A 9 CYS H 1.0 1.8 5.11 120 115 A 8 ARG HGx A 8 ARG H 1.0 1.8 5.11 121 116 A 7 GLY HAx A 8 ARG H 1.0 1.8 4.85 122 117 A 8 ARG H A 30 CYS HBx 1.0 1.8 5.03 123 118 A 8 ARG H A 8 ARG HBy 1.0 1.8 4.84 124 119 A 8 ARG HBx A 8 ARG H 1.0 1.8 4.84 125 120 A 9 CYS HA A 8 ARG HBy 1.0 1.8 5.88 126 121 A 8 ARG HA A 8 ARG HGx 1.0 1.8 5.73 127 122 A 8 ARG HA A 8 ARG HGy 1.0 1.8 5.76 128 123 A 7 GLY HAx A 8 ARG HGy 1.0 1.8 5.19 129 124 A 8 ARG H A 8 ARG HGy 1.0 1.8 5.05 130 125 A 8 ARG H A 13 CYS HA 1.0 1.8 5.56 131 126 A 9 CYS H A 10 ARG H 1.0 1.8 5.24 132 127 A 9 CYS HBy A 23 CYS HA 1.0 1.8 5.71 133 128 A 9 CYS HA A 29 CYS HA 1.0 1.8 5.10 134 129 A 29 CYS HA A 9 CYS H 1.0 1.8 5.46 135 130 A 8 ARG HA A 9 CYS H 1.0 1.8 5.40 136 131 A 9 CYS HA A 9 CYS H 1.0 1.8 5.34 137 132 A 9 CYS H A 9 CYS HBy 1.0 1.8 5.37 138 133 A 9 CYS HA A 9 CYS HBy 1.0 1.8 5.04 139 134 A 9 CYS HA A 9 CYS HBx 1.0 1.8 5.20 140 135 A 9 CYS HBx A 27 LYS HDx 1.0 1.8 5.51 141 136 A 9 CYS HBy A 23 CYS HBx 1.0 1.8 5.46 142 137 A 9 CYS HBx A 23 CYS HBx 1.0 1.8 5.57 143 138 A 9 CYS H A 9 CYS HBx 1.0 1.8 5.03 144 139 A 8 ARG HBy A 9 CYS H 1.0 1.8 4.84 145 140 A 8 ARG HBx A 9 CYS H 1.0 1.8 4.84 146 141 A 9 CYS HBy A 27 LYS HGx 1.0 1.8 5.59 147 142 A 29 CYS HA A 9 CYS HBy 1.0 1.8 5.16 148 143 A 8 ARG HA A 9 CYS HBx 1.0 1.8 5.78 149 144 A 29 CYS HA A 9 CYS HBx 1.0 1.8 5.65 150 145 A 9 CYS HBy A 27 LYS HBy 1.0 1.8 5.01 151 146 A 9 CYS HBy A 27 LYS HBx 1.0 1.8 5.10 152 147 A 9 CYS H A 8 ARG HGy 1.0 1.8 5.05 153 148 A 9 CYS HBx A 10 ARG HG2 1.0 1.8 5.44 154 149 A 10 ARG HBy A 11 LYS H 1.0 1.8 5.77 155 150 A 8 ARG HDx A 10 ARG HG2 1.0 1.8 5.24 156 151 A 10 ARG HG2 A 10 ARG HA 1.0 1.8 5.82 157 152 A 10 ARG HBy A 10 ARG HA 1.0 1.8 5.47 158 153 A 13 CYS HA A 10 ARG HBx 1.0 1.8 5.54 159 154 A 9 CYS HA A 10 ARG H 1.0 1.8 4.66 160 155 A 10 ARG H A 10 ARG HA 1.0 1.8 5.21 161 156 A 10 ARG H A 10 ARG HBy 1.0 1.8 5.26 162 157 A 10 ARG H A 27 LYS HBx 1.0 1.8 5.33 163 158 A 10 ARG H A 9 CYS HBy 1.0 1.8 5.41 164 159 A 10 ARG H A 9 CYS HBx 1.0 1.8 5.79 165 160 A 30 CYS HBx A 10 ARG H 1.0 1.8 5.79 166 161 A 8 ARG HDx A 10 ARG HBx 1.0 1.8 4.86 167 162 A 29 CYS HA A 10 ARG H 1.0 1.8 5.70 168 163 A 10 ARG H A 10 ARG HG2 1.0 1.8 5.39 169 164 A 10 ARG HG2 A 10 ARG HBx 1.0 1.8 4.69 170 165 A 10 ARG H A 10 ARG HBx 1.0 1.8 5.56 171 166 A 10 ARG HA A 10 ARG HBx 1.0 1.8 5.08 172 167 A 13 CYS HA A 10 ARG HBy 1.0 1.8 5.72 173 168 A 10 ARG HG2 A 10 ARG HBy 1.0 1.8 4.70 174 169 A 10 ARG HBy A 28 LYS H 1.0 1.8 5.76 175 170 A 8 ARG HDx A 10 ARG H 1.0 1.8 5.45 176 171 A 10 ARG H A 23 CYS HBy 1.0 1.8 5.45 177 172 A 10 ARG H A 27 LYS HDx 1.0 1.8 5.78 178 173 A 11 LYS HGx A 12 LYS H 1.0 1.8 5.83 179 174 A 11 LYS H A 11 LYS HA 1.0 1.8 5.82 180 175 A 11 LYS HA A 11 LYS HGy 1.0 1.8 5.84 181 176 A 11 LYS HA A 27 LYS HA 1.0 1.8 4.93 182 177 A 11 LYS HA A 12 LYS HA 1.0 1.8 4.93 183 178 A 11 LYS H A 11 LYS HGx 1.0 1.8 5.18 184 179 A 10 ARG HBy A 11 LYS HA 1.0 1.8 5.31 185 180 A 11 LYS HGx A 11 LYS HA 1.0 1.8 5.30 186 181 A 11 LYS HA A 11 LYS HBy 1.0 1.8 5.49 187 182 A 11 LYS HGy A 11 LYS HEy 1.0 1.8 5.51 188 182 A 11 LYS HGy A 11 LYS HEx 1.0 1.8 5.51 189 183 A 11 LYS HGx A 11 LYS HBx 1.0 1.8 4.93 190 184 A 11 LYS H A 27 LYS HA 1.0 1.8 5.53 191 185 A 11 LYS HA A 11 LYS HDx 1.0 1.8 5.65 192 185 A 11 LYS HA A 11 LYS HDy 1.0 1.8 5.65 193 186 A 11 LYS HA A 11 LYS HBx 1.0 1.8 4.92 194 187 A 11 LYS HGx A 11 LYS HEy 1.0 1.8 5.50 195 187 A 11 LYS HGx A 11 LYS HEx 1.0 1.8 5.50 196 188 A 28 LYS H A 11 LYS HGx 1.0 1.8 5.76 197 189 A 26 GLY HAy A 11 LYS HDx 1.0 1.8 5.36 198 189 A 11 LYS HDy A 26 GLY HAy 1.0 1.8 5.36 199 190 A 11 LYS HGx A 27 LYS HDy 1.0 1.8 4.90 200 191 A 12 LYS HA A 11 LYS HBx 1.0 1.8 5.67 201 192 A 11 LYS HA A 27 LYS HDy 1.0 1.8 5.13 202 193 A 13 CYS HA A 12 LYS H 1.0 1.8 5.70 203 194 A 10 ARG HBy A 12 LYS H 1.0 1.8 5.43 204 195 A 12 LYS H A 12 LYS HBy 1.0 1.8 5.13 205 195 A 12 LYS H A 12 LYS HBx 1.0 1.8 5.13 206 196 A 10 ARG HBx A 12 LYS H 1.0 1.8 5.15 207 197 A 12 LYS H A 11 LYS HA 1.0 1.8 5.66 208 198 A 12 LYS H A 27 LYS HA 1.0 1.8 5.08 209 199 A 12 LYS H A 12 LYS HA 1.0 1.8 5.08 210 200 A 12 LYS H A 11 LYS HBx 1.0 1.8 5.20 211 201 A 12 LYS HA A 12 LYS HBy 1.0 1.8 5.09 212 201 A 12 LYS HA A 12 LYS HBx 1.0 1.8 5.09 213 202 A 12 LYS HA A 12 LYS HDx 1.0 1.8 5.09 214 202 A 12 LYS HA A 12 LYS HDy 1.0 1.8 5.09 215 203 A 12 LYS HA A 12 LYS HGy 1.0 1.8 5.33 216 203 A 12 LYS HA A 12 LYS HGx 1.0 1.8 5.33 217 204 A 12 LYS HEy A 12 LYS HGy 1.0 1.8 5.55 218 204 A 12 LYS HEx A 12 LYS HGy 1.0 1.8 5.55 219 204 A 12 LYS HGx A 12 LYS HEy 1.0 1.8 5.55 220 204 A 12 LYS HGx A 12 LYS HEx 1.0 1.8 5.55 221 205 A 12 LYS H A 13 CYS H 1.0 1.8 4.86 222 206 A 13 CYS HA A 13 CYS HBy 1.0 1.8 5.38 223 207 A 13 CYS HBy A 17 GLU HA 1.0 1.8 5.38 224 208 A 13 CYS HBy A 19 PRO HDy 1.0 1.8 5.82 225 208 A 13 CYS HBy A 19 PRO HDx 1.0 1.8 5.82 226 209 A 13 CYS HA A 13 CYS HBx 1.0 1.8 5.05 227 210 A 13 CYS HA A 13 CYS H 1.0 1.8 5.84 228 211 A 13 CYS H A 13 CYS HBx 1.0 1.8 5.87 229 212 A 13 CYS H A 13 CYS HBy 1.0 1.8 5.58 230 213 A 12 LYS HA A 13 CYS H 1.0 1.8 5.22 231 214 A 13 CYS HBy A 17 GLU HGy 1.0 1.8 5.87 232 215 A 13 CYS HBy A 13 CYS HBx 1.0 1.8 4.61 233 216 A 13 CYS HA A 14 LYS HBy 1.0 1.8 5.89 234 217 A 13 CYS HA A 14 LYS H 1.0 1.8 5.01 235 218 A 14 LYS H A 14 LYS HA 1.0 1.8 5.63 236 219 A 13 CYS HBx A 14 LYS H 1.0 1.8 4.99 237 220 A 13 CYS HBy A 14 LYS H 1.0 1.8 5.37 238 221 A 30 CYS HBx A 14 LYS H 1.0 1.8 5.58 239 222 A 14 LYS H A 14 LYS HBx 1.0 1.8 5.33 240 223 A 8 ARG HGx A 14 LYS H 1.0 1.8 5.41 241 224 A 17 GLU HGy A 14 LYS H 1.0 1.8 5.41 242 225 A 8 ARG HGy A 14 LYS H 1.0 1.8 5.41 243 226 A 14 LYS HBy A 14 LYS H 1.0 1.8 5.37 244 227 A 14 LYS H A 14 LYS HGy 1.0 1.8 5.37 245 227 A 14 LYS H A 14 LYS HGx 1.0 1.8 5.37 246 228 A 14 LYS HBy A 14 LYS HA 1.0 1.8 4.78 247 229 A 14 LYS HA A 14 LYS HGy 1.0 1.8 4.78 248 229 A 14 LYS HA A 14 LYS HGx 1.0 1.8 4.78 249 230 A 8 ARG HDx A 14 LYS HDy 1.0 1.8 4.93 250 230 A 8 ARG HDx A 14 LYS HDx 1.0 1.8 4.93 251 231 A 14 LYS HBy A 17 GLU HBy 1.0 1.8 5.03 252 232 A 14 LYS HGx A 15 GLU HGx 1.0 1.8 5.63 253 232 A 14 LYS HGy A 15 GLU HGx 1.0 1.8 5.63 254 232 A 15 GLU HGy A 14 LYS HGy 1.0 1.8 5.63 255 232 A 14 LYS HGx A 15 GLU HGy 1.0 1.8 5.63 256 233 A 14 LYS HBy A 17 GLU HGx 1.0 1.8 4.93 257 234 A 13 CYS H A 14 LYS H 1.0 1.8 5.70 258 235 A 14 LYS HA A 14 LYS HBx 1.0 1.8 5.10 259 236 A 14 LYS HA A 14 LYS HDy 1.0 1.8 4.93 260 236 A 14 LYS HA A 14 LYS HDx 1.0 1.8 4.93 261 237 A 14 LYS HBy A 14 LYS HBx 1.0 1.8 4.47 262 238 A 14 LYS HBx A 14 LYS HGy 1.0 1.8 4.47 263 238 A 14 LYS HBx A 14 LYS HGx 1.0 1.8 4.47 264 239 A 14 LYS HBx A 15 GLU H 1.0 1.8 5.57 265 240 A 14 LYS HA A 15 GLU H 1.0 1.8 5.56 266 241 A 8 ARG HDx A 14 LYS H 1.0 1.8 5.33 267 242 A 14 LYS H A 30 CYS HBy 1.0 1.8 5.87 268 243 A 14 LYS HBy A 14 LYS HEx 1.0 1.8 5.61 269 243 A 14 LYS HBy A 14 LYS HEy 1.0 1.8 5.61 270 244 A 14 LYS HEx A 14 LYS HGy 1.0 1.8 5.61 271 244 A 14 LYS HEy A 14 LYS HGy 1.0 1.8 5.61 272 244 A 14 LYS HGx A 14 LYS HEx 1.0 1.8 5.61 273 244 A 14 LYS HGx A 14 LYS HEy 1.0 1.8 5.61 274 245 A 8 ARG HDx A 14 LYS HBy 1.0 1.8 5.39 275 246 A 10 ARG H A 14 LYS H 1.0 1.8 5.86 276 247 A 14 LYS H A 17 GLU H 1.0 1.8 5.89 277 248 A 15 GLU H A 16 ASN H 1.0 1.8 5.62 278 249 A 15 GLU H A 15 GLU HA 1.0 1.8 5.11 279 250 A 14 LYS HBy A 15 GLU H 1.0 1.8 5.21 280 251 A 15 GLU H A 14 LYS HGy 1.0 1.8 5.21 281 251 A 14 LYS HGx A 15 GLU H 1.0 1.8 5.21 282 252 A 15 GLU H A 15 GLU HGx 1.0 1.8 5.34 283 252 A 15 GLU HGy A 15 GLU H 1.0 1.8 5.34 284 253 A 15 GLU HA A 15 GLU HBx 1.0 1.8 4.79 285 253 A 15 GLU HA A 15 GLU HBy 1.0 1.8 4.79 286 254 A 15 GLU HA A 15 GLU HGx 1.0 1.8 5.03 287 254 A 15 GLU HGy A 15 GLU HA 1.0 1.8 5.03 288 255 A 15 GLU HBy A 15 GLU HGx 1.0 1.8 4.58 289 255 A 15 GLU HBx A 15 GLU HGx 1.0 1.8 4.58 290 255 A 15 GLU HGy A 15 GLU HBx 1.0 1.8 4.58 291 255 A 15 GLU HGy A 15 GLU HBy 1.0 1.8 4.58 292 256 A 14 LYS HGy A 15 GLU HBx 1.0 1.8 4.47 293 256 A 14 LYS HGx A 15 GLU HBx 1.0 1.8 4.47 294 256 A 15 GLU HBy A 14 LYS HGy 1.0 1.8 4.47 295 256 A 14 LYS HGx A 15 GLU HBy 1.0 1.8 4.47 296 257 A 15 GLU H A 15 GLU HBx 1.0 1.8 5.57 297 257 A 15 GLU H A 15 GLU HBy 1.0 1.8 5.57 298 258 A 16 ASN HA A 15 GLU HBx 1.0 1.8 5.80 299 258 A 15 GLU HBy A 16 ASN HA 1.0 1.8 5.80 300 259 A 17 GLU H A 16 ASN H 1.0 1.8 5.02 301 260 A 16 ASN HA A 16 ASN HBx 1.0 1.8 5.09 302 261 A 16 ASN HA A 16 ASN HD22 1.0 1.8 5.89 303 262 A 16 ASN H A 15 GLU HA 1.0 1.8 5.05 304 263 A 16 ASN H A 16 ASN HA 1.0 1.8 5.42 305 264 A 17 GLU HGy A 16 ASN H 1.0 1.8 5.80 306 265 A 16 ASN H A 15 GLU HBx 1.0 1.8 5.12 307 265 A 16 ASN H A 15 GLU HBy 1.0 1.8 5.12 308 266 A 16 ASN H A 16 ASN HBx 1.0 1.8 5.49 309 267 A 16 ASN HBx A 16 ASN HD22 1.0 1.8 5.01 310 268 A 16 ASN HD22 A 16 ASN HBy 1.0 1.8 5.20 311 269 A 16 ASN HBx A 16 ASN HD21 1.0 1.8 5.21 312 270 A 16 ASN H A 16 ASN HBy 1.0 1.8 5.44 313 271 A 16 ASN HBy A 16 ASN HD21 1.0 1.8 5.83 314 272 A 16 ASN H A 16 ASN HD22 1.0 1.8 5.72 315 273 A 16 ASN H A 14 LYS HGy 1.0 1.8 5.39 316 273 A 14 LYS HGx A 16 ASN H 1.0 1.8 5.39 317 274 A 16 ASN HBx A 32 ASN HA 1.0 1.8 5.82 318 275 A 17 GLU HBx A 18 LYS H 1.0 1.8 5.60 319 276 A 17 GLU HA A 17 GLU HGy 1.0 1.8 5.24 320 277 A 17 GLU HA A 17 GLU HGx 1.0 1.8 5.40 321 278 A 13 CYS HA A 17 GLU HBy 1.0 1.8 5.34 322 279 A 17 GLU HA A 17 GLU HBy 1.0 1.8 5.34 323 280 A 13 CYS HA A 17 GLU HBx 1.0 1.8 5.49 324 281 A 17 GLU HA A 17 GLU HBx 1.0 1.8 5.49 325 282 A 17 GLU HA A 17 GLU H 1.0 1.8 5.28 326 283 A 17 GLU H A 16 ASN HA 1.0 1.8 5.38 327 284 A 17 GLU H A 15 GLU HA 1.0 1.8 5.46 328 285 A 13 CYS HBx A 17 GLU H 1.0 1.8 5.54 329 286 A 17 GLU H A 16 ASN HBx 1.0 1.8 5.88 330 287 A 17 GLU H A 16 ASN HBy 1.0 1.8 5.90 331 288 A 17 GLU HBy A 17 GLU H 1.0 1.8 5.57 332 289 A 17 GLU HGx A 17 GLU H 1.0 1.8 5.50 333 290 A 17 GLU HGy A 17 GLU H 1.0 1.8 5.27 334 291 A 13 CYS HBx A 17 GLU HBx 1.0 1.8 4.95 335 292 A 14 LYS HBy A 17 GLU HBx 1.0 1.8 5.30 336 293 A 17 GLU HGy A 17 GLU HBy 1.0 1.8 5.25 337 294 A 13 CYS HBx A 17 GLU HBy 1.0 1.8 5.53 338 295 A 17 GLU HGy A 16 ASN HBx 1.0 1.8 4.95 339 296 A 14 LYS H A 17 GLU HBx 1.0 1.8 5.21 340 297 A 14 LYS H A 17 GLU HBy 1.0 1.8 5.21 341 298 A 17 GLU H A 17 GLU HBx 1.0 1.8 5.42 342 299 A 17 GLU HGy A 32 ASN HA 1.0 1.8 5.81 343 300 A 17 GLU HGx A 32 ASN HA 1.0 1.8 5.80 344 301 A 13 CYS HBy A 17 GLU HBy 1.0 1.8 5.79 345 302 A 13 CYS HBy A 17 GLU HBx 1.0 1.8 5.73 346 303 A 17 GLU HGy A 17 GLU HBx 1.0 1.8 4.83 347 304 A 17 GLU HGy A 14 LYS HA 1.0 1.8 5.19 348 305 A 30 CYS HBy A 17 GLU H 1.0 1.8 5.18 349 306 A 14 LYS HA A 17 GLU HGx 1.0 1.8 5.67 350 307 A 7 GLY HAx A 17 GLU HGx 1.0 1.8 5.67 351 308 A 17 GLU H A 15 GLU HBx 1.0 1.8 5.71 352 308 A 17 GLU H A 15 GLU HBy 1.0 1.8 5.71 353 309 A 14 LYS HBy A 17 GLU H 1.0 1.8 5.57 354 310 A 13 CYS HBx A 17 GLU HGx 1.0 1.8 5.53 355 311 A 13 CYS HBx A 17 GLU HGy 1.0 1.8 5.28 356 312 A 18 LYS HA A 18 LYS HGy 1.0 1.8 5.67 357 312 A 18 LYS HGx A 18 LYS HA 1.0 1.8 5.67 358 313 A 18 LYS HA A 18 LYS HDx 1.0 1.8 5.22 359 314 A 17 GLU HA A 18 LYS HDy 1.0 1.8 5.37 360 315 A 32 ASN HA A 18 LYS H 1.0 1.8 5.57 361 316 A 17 GLU HA A 18 LYS H 1.0 1.8 4.81 362 317 A 18 LYS H A 18 LYS HA 1.0 1.8 5.65 363 318 A 17 GLU HBy A 18 LYS H 1.0 1.8 5.33 364 319 A 17 GLU HGx A 18 LYS H 1.0 1.8 5.72 365 320 A 18 LYS H A 18 LYS HDy 1.0 1.8 5.76 366 321 A 18 LYS H A 18 LYS HGy 1.0 1.8 5.74 367 321 A 18 LYS H A 18 LYS HGx 1.0 1.8 5.74 368 322 A 18 LYS H A 18 LYS HBx 1.0 1.8 5.48 369 322 A 18 LYS H A 18 LYS HBy 1.0 1.8 5.48 370 323 A 18 LYS H A 18 LYS HDx 1.0 1.8 5.80 371 324 A 18 LYS HEx A 18 LYS HGy 1.0 1.8 5.04 372 324 A 18 LYS HEy A 18 LYS HGy 1.0 1.8 5.04 373 324 A 18 LYS HGx A 18 LYS HEx 1.0 1.8 5.04 374 324 A 18 LYS HGx A 18 LYS HEy 1.0 1.8 5.04 375 325 A 18 LYS HDy A 18 LYS HEx 1.0 1.8 5.40 376 325 A 18 LYS HDy A 18 LYS HEy 1.0 1.8 5.40 377 326 A 19 PRO HGx A 19 PRO HA 1.0 1.8 5.74 378 327 A 19 PRO HGx A 19 PRO HDy 1.0 1.8 5.23 379 327 A 19 PRO HDx A 19 PRO HGx 1.0 1.8 5.23 380 328 A 18 LYS HBy A 19 PRO HDy 1.0 1.8 5.37 381 328 A 18 LYS HBx A 19 PRO HDy 1.0 1.8 5.37 382 328 A 19 PRO HDx A 18 LYS HBx 1.0 1.8 5.37 383 328 A 19 PRO HDx A 18 LYS HBy 1.0 1.8 5.37 384 329 A 18 LYS HDx A 19 PRO HDy 1.0 1.8 5.54 385 329 A 19 PRO HDx A 18 LYS HDx 1.0 1.8 5.54 386 330 A 28 LYS HD2 A 19 PRO HBx 1.0 1.8 4.47 387 330 A 19 PRO HBy A 28 LYS HD2 1.0 1.8 4.47 388 331 A 19 PRO HGy A 19 PRO HDy 1.0 1.8 5.02 389 331 A 19 PRO HDx A 19 PRO HGy 1.0 1.8 5.02 390 332 A 19 PRO HBx A 19 PRO HDy 1.0 1.8 5.47 391 332 A 19 PRO HBy A 19 PRO HDy 1.0 1.8 5.47 392 332 A 19 PRO HDx A 19 PRO HBx 1.0 1.8 5.47 393 332 A 19 PRO HDx A 19 PRO HBy 1.0 1.8 5.47 394 333 A 13 CYS HBx A 19 PRO HGx 1.0 1.8 5.85 395 334 A 19 PRO HA A 19 PRO HBx 1.0 1.8 5.07 396 334 A 19 PRO HA A 19 PRO HBy 1.0 1.8 5.07 397 335 A 19 PRO HGx A 19 PRO HGy 1.0 1.8 4.54 398 336 A 20 ILE H A 21 GLY H 1.0 1.8 4.86 399 337 A 20 ILE H A 29 CYS H 1.0 1.8 5.80 400 338 A 20 ILE HD1% A 20 ILE HA 1.0 1.8 5.31 401 339 A 20 ILE HA A 20 ILE HG1x 1.0 1.8 5.75 402 340 A 20 ILE HA A 20 ILE HG1y 1.0 1.8 5.66 403 341 A 21 GLY HAx A 20 ILE HG1x 1.0 1.8 5.64 404 342 A 19 PRO HA A 20 ILE H 1.0 1.8 4.61 405 343 A 20 ILE H A 30 CYS HA 1.0 1.8 5.62 406 344 A 20 ILE H A 20 ILE HA 1.0 1.8 5.11 407 345 A 20 ILE H A 19 PRO HBx 1.0 1.8 5.46 408 345 A 19 PRO HBy A 20 ILE H 1.0 1.8 5.46 409 346 A 20 ILE H A 20 ILE HB 1.0 1.8 5.22 410 347 A 20 ILE HA A 20 ILE HB 1.0 1.8 5.60 411 348 A 20 ILE HG2% A 31 VAL HB 1.0 1.8 5.66 412 349 A 20 ILE HD1% A 20 ILE HG1x 1.0 1.8 4.82 413 350 A 20 ILE HG2% A 20 ILE HA 1.0 1.8 5.70 414 351 A 20 ILE HG2% A 20 ILE H 1.0 1.8 5.15 415 352 A 20 ILE H A 20 ILE HG1y 1.0 1.8 4.98 416 353 A 20 ILE H A 20 ILE HG1x 1.0 1.8 5.21 417 354 A 20 ILE HG2% A 31 VAL HA 1.0 1.8 5.67 418 355 A 29 CYS HBx A 20 ILE H 1.0 1.8 5.57 419 356 A 20 ILE HG1x A 20 ILE HB 1.0 1.8 5.13 420 357 A 20 ILE HD1% A 20 ILE HB 1.0 1.8 5.00 421 358 A 31 VAL HB A 20 ILE HG1x 1.0 1.8 4.64 422 359 A 20 ILE HG2% A 20 ILE HB 1.0 1.8 5.39 423 360 A 20 ILE HG1y A 20 ILE HB 1.0 1.8 5.50 424 361 A 20 ILE HD1% A 20 ILE HG1y 1.0 1.8 5.09 425 362 A 20 ILE HG2% A 19 PRO HA 1.0 1.8 5.73 426 363 A 18 LYS HA A 20 ILE H 1.0 1.8 5.80 427 364 A 20 ILE HG1x A 30 CYS HA 1.0 1.8 5.55 428 365 A 20 ILE HD1% A 20 ILE H 1.0 1.8 5.51 429 366 A 20 ILE HG2% A 20 ILE HG1x 1.0 1.8 5.20 430 367 A 20 ILE HG2% A 5 ASN HBx 1.0 1.8 5.89 431 368 A 21 GLY HAy A 20 ILE HA 1.0 1.8 5.47 432 369 A 21 GLY H A 20 ILE HA 1.0 1.8 4.93 433 370 A 21 GLY HAy A 21 GLY H 1.0 1.8 4.95 434 371 A 29 CYS HBx A 21 GLY H 1.0 1.8 5.84 435 372 A 29 CYS HBy A 21 GLY H 1.0 1.8 5.86 436 373 A 21 GLY H A 20 ILE HB 1.0 1.8 5.58 437 374 A 21 GLY HAx A 20 ILE HG1y 1.0 1.8 5.56 438 375 A 21 GLY H A 20 ILE HG1y 1.0 1.8 5.72 439 376 A 21 GLY H A 20 ILE HG1x 1.0 1.8 5.54 440 377 A 20 ILE HG2% A 21 GLY H 1.0 1.8 5.91 441 378 A 21 GLY HAx A 21 GLY HAy 1.0 1.8 4.78 442 379 A 21 GLY HAx A 21 GLY H 1.0 1.8 5.08 443 380 A 21 GLY H A 22 TYR HA 1.0 1.8 5.78 444 381 A 21 GLY H A 30 CYS HA 1.0 1.8 5.78 445 382 A 22 TYR HBx A 22 TYR H 1.0 1.8 5.91 446 383 A 23 CYS HA A 22 TYR HBy 1.0 1.8 5.71 447 384 A 22 TYR HA A 22 TYR HBy 1.0 1.8 5.47 448 385 A 22 TYR HA A 22 TYR HBx 1.0 1.8 5.00 449 386 A 22 TYR HBx A 28 LYS HA 1.0 1.8 5.57 450 387 A 21 GLY HAx A 22 TYR H 1.0 1.8 5.53 451 388 A 21 GLY HAy A 22 TYR H 1.0 1.8 5.59 452 389 A 23 CYS HA A 22 TYR H 1.0 1.8 5.50 453 390 A 22 TYR HA A 22 TYR H 1.0 1.8 5.55 454 391 A 22 TYR H A 22 TYR HBy 1.0 1.8 5.72 455 392 A 22 TYR HBy A 22 TYR HE% 1.0 1.8 5.40 456 393 A 22 TYR HA A 22 TYR HD2 1.0 1.8 5.02 457 394 A 22 TYR HA A 22 TYR HD1 1.0 1.8 5.02 458 395 A 22 TYR HA A 22 TYR HE% 1.0 1.8 5.69 459 396 A 28 LYS HA A 22 TYR HD2 1.0 1.8 5.15 460 397 A 28 LYS HA A 22 TYR HD1 1.0 1.8 5.15 461 398 A 22 TYR HE% A 26 GLY HAx 1.0 1.8 5.55 462 399 A 22 TYR HBx A 22 TYR HE% 1.0 1.8 5.32 463 400 A 22 TYR HBx A 22 TYR HD2 1.0 1.8 4.79 464 401 A 22 TYR HBx A 22 TYR HD1 1.0 1.8 4.79 465 402 A 22 TYR HBy A 22 TYR HD2 1.0 1.8 4.83 466 403 A 22 TYR HBy A 22 TYR HD1 1.0 1.8 4.83 467 404 A 22 TYR HD2 A 28 LYS HG2 1.0 1.8 5.55 468 405 A 22 TYR HD1 A 28 LYS HG2 1.0 1.8 5.55 469 406 A 22 TYR HE% A 28 LYS HG2 1.0 1.8 5.40 470 407 A 22 TYR H A 22 TYR HD1 1.0 1.8 5.81 471 408 A 22 TYR H A 22 TYR HD2 1.0 1.8 5.81 472 409 A 21 GLY HAy A 22 TYR HBy 1.0 1.8 5.83 473 410 A 22 TYR HBx A 22 TYR HBy 1.0 1.8 4.48 474 411 A 23 CYS H A 27 LYS H 1.0 1.8 5.71 475 412 A 29 CYS H A 23 CYS H 1.0 1.8 5.60 476 413 A 23 CYS HA A 23 CYS HBy 1.0 1.8 4.90 477 414 A 23 CYS HBx A 23 CYS H 1.0 1.8 4.99 478 415 A 23 CYS HBy A 23 CYS H 1.0 1.8 5.34 479 416 A 22 TYR HBx A 23 CYS H 1.0 1.8 5.12 480 417 A 23 CYS HA A 23 CYS H 1.0 1.8 5.26 481 418 A 22 TYR HA A 23 CYS H 1.0 1.8 4.70 482 419 A 22 TYR HBy A 23 CYS H 1.0 1.8 5.46 483 420 A 23 CYS HBx A 27 LYS HBx 1.0 1.8 5.39 484 421 A 9 CYS HBy A 23 CYS HBy 1.0 1.8 5.62 485 422 A 28 LYS H A 23 CYS HBy 1.0 1.8 5.72 486 423 A 22 TYR H A 23 CYS H 1.0 1.8 5.63 487 424 A 22 TYR HD1 A 23 CYS H 1.0 1.8 5.64 488 425 A 22 TYR HD2 A 23 CYS H 1.0 1.8 5.64 489 426 A 23 CYS HA A 23 CYS HBx 1.0 1.8 5.55 490 427 A 23 CYS HBx A 23 CYS HBy 1.0 1.8 4.51 491 428 A 24 ARG HDy A 24 ARG HA 1.0 1.8 5.16 492 429 A 24 ARG HA A 24 ARG HDx 1.0 1.8 5.60 493 430 A 24 ARG HDy A 24 ARG HBx 1.0 1.8 5.01 494 430 A 24 ARG HDy A 24 ARG HBy 1.0 1.8 5.01 495 431 A 25 ASN HA A 24 ARG HBx 1.0 1.8 5.37 496 431 A 24 ARG HBy A 25 ASN HA 1.0 1.8 5.37 497 432 A 26 GLY HAy A 25 ASN HBx 1.0 1.8 5.68 498 433 A 25 ASN HBx A 25 ASN HD22 1.0 1.8 5.84 499 434 A 25 ASN HA A 25 ASN HBy 1.0 1.8 5.62 500 435 A 24 ARG HA A 25 ASN HBy 1.0 1.8 5.79 501 436 A 25 ASN HA A 25 ASN HBx 1.0 1.8 4.91 502 437 A 26 GLY HAy A 25 ASN HBy 1.0 1.8 5.76 503 438 A 25 ASN HD22 A 25 ASN HD21 1.0 1.8 5.39 504 439 A 25 ASN HBx A 25 ASN HBy 1.0 1.8 4.48 505 440 A 25 ASN HBx A 27 LYS HEy 1.0 1.8 4.48 506 440 A 25 ASN HBx A 27 LYS HEx 1.0 1.8 4.48 507 441 A 27 LYS H A 26 GLY H 1.0 1.8 5.17 508 442 A 26 GLY HAx A 26 GLY H 1.0 1.8 5.14 509 443 A 25 ASN HA A 26 GLY H 1.0 1.8 5.42 510 444 A 26 GLY HAy A 26 GLY H 1.0 1.8 5.61 511 445 A 26 GLY H A 24 ARG H 1.0 1.8 5.72 512 446 A 26 GLY HAy A 26 GLY HAx 1.0 1.8 4.64 513 447 A 27 LYS H A 27 LYS HGy 1.0 1.8 5.56 514 448 A 27 LYS HBy A 27 LYS H 1.0 1.8 5.17 515 449 A 27 LYS H A 27 LYS HEy 1.0 1.8 5.35 516 449 A 27 LYS H A 27 LYS HEx 1.0 1.8 5.35 517 450 A 9 CYS HA A 27 LYS HBy 1.0 1.8 5.77 518 451 A 10 ARG HA A 27 LYS HGy 1.0 1.8 5.67 519 452 A 27 LYS HDx A 10 ARG HA 1.0 1.8 5.67 520 453 A 27 LYS HBy A 10 ARG HA 1.0 1.8 5.22 521 454 A 27 LYS HBx A 10 ARG HA 1.0 1.8 5.13 522 455 A 11 LYS HA A 27 LYS HGy 1.0 1.8 5.84 523 456 A 26 GLY HAx A 27 LYS H 1.0 1.8 5.41 524 457 A 26 GLY HAy A 27 LYS H 1.0 1.8 5.47 525 458 A 27 LYS HDx A 27 LYS H 1.0 1.8 5.14 526 459 A 27 LYS HDy A 27 LYS H 1.0 1.8 5.47 527 460 A 27 LYS HGx A 27 LYS H 1.0 1.8 5.76 528 461 A 27 LYS HBx A 27 LYS H 1.0 1.8 4.87 529 462 A 27 LYS HA A 27 LYS HDy 1.0 1.8 5.30 530 463 A 27 LYS HBx A 27 LYS HDy 1.0 1.8 5.35 531 464 A 27 LYS HGx A 23 CYS HBy 1.0 1.8 5.16 532 465 A 9 CYS HBy A 27 LYS HDx 1.0 1.8 5.66 533 466 A 27 LYS HGx A 27 LYS HDy 1.0 1.8 5.25 534 467 A 27 LYS HDy A 27 LYS HEy 1.0 1.8 5.83 535 467 A 27 LYS HDy A 27 LYS HEx 1.0 1.8 5.83 536 468 A 27 LYS HBy A 11 LYS HA 1.0 1.8 5.67 537 469 A 10 ARG H A 27 LYS HBy 1.0 1.8 5.42 538 470 A 27 LYS HBx A 11 LYS HA 1.0 1.8 5.65 539 471 A 27 LYS HA A 27 LYS H 1.0 1.8 5.49 540 472 A 27 LYS HBx A 27 LYS HA 1.0 1.8 5.37 541 473 A 27 LYS HBy A 27 LYS HA 1.0 1.8 5.09 542 474 A 27 LYS HDx A 27 LYS HEy 1.0 1.8 5.04 543 474 A 27 LYS HDx A 27 LYS HEx 1.0 1.8 5.04 544 475 A 27 LYS HGy A 27 LYS HEy 1.0 1.8 5.04 545 475 A 27 LYS HEx A 27 LYS HGy 1.0 1.8 5.04 546 476 A 27 LYS HGx A 27 LYS HEy 1.0 1.8 5.13 547 476 A 27 LYS HGx A 27 LYS HEx 1.0 1.8 5.13 548 477 A 27 LYS HBy A 27 LYS HDy 1.0 1.8 5.36 549 478 A 27 LYS HDx A 23 CYS HBy 1.0 1.8 5.39 550 479 A 27 LYS HDy A 27 LYS HGy 1.0 1.8 4.83 551 480 A 27 LYS HGx A 28 LYS H 1.0 1.8 5.76 552 481 A 25 ASN HA A 27 LYS HGy 1.0 1.8 5.56 553 482 A 27 LYS HGx A 25 ASN HA 1.0 1.8 5.64 554 483 A 26 GLY HAy A 27 LYS HEy 1.0 1.8 5.76 555 483 A 26 GLY HAy A 27 LYS HEx 1.0 1.8 5.76 556 484 A 23 CYS HBx A 27 LYS H 1.0 1.8 5.22 557 485 A 27 LYS H A 25 ASN HBy 1.0 1.8 5.24 558 486 A 27 LYS HDx A 27 LYS HDy 1.0 1.8 4.90 559 487 A 28 LYS H A 27 LYS H 1.0 1.8 5.90 560 488 A 10 ARG H A 28 LYS H 1.0 1.8 5.24 561 489 A 29 CYS HA A 28 LYS HBx 1.0 1.8 5.84 562 489 A 29 CYS HA A 28 LYS HBy 1.0 1.8 5.84 563 490 A 22 TYR HA A 28 LYS HA 1.0 1.8 5.30 564 491 A 10 ARG HA A 28 LYS H 1.0 1.8 5.75 565 492 A 9 CYS HA A 28 LYS H 1.0 1.8 5.34 566 493 A 28 LYS H A 28 LYS HD2 1.0 1.8 5.27 567 494 A 28 LYS H A 28 LYS HG2 1.0 1.8 5.62 568 495 A 28 LYS HA A 28 LYS HBx 1.0 1.8 5.64 569 495 A 28 LYS HA A 28 LYS HBy 1.0 1.8 5.64 570 496 A 27 LYS HBx A 28 LYS HA 1.0 1.8 5.64 571 497 A 28 LYS HD2 A 28 LYS HA 1.0 1.8 4.78 572 498 A 28 LYS HA A 28 LYS HG2 1.0 1.8 5.40 573 499 A 28 LYS HG2 A 28 LYS HE2 1.0 1.8 5.66 574 500 A 28 LYS HD2 A 28 LYS HE2 1.0 1.8 5.70 575 501 A 28 LYS HA A 23 CYS H 1.0 1.8 5.24 576 502 A 28 LYS H A 27 LYS HA 1.0 1.8 4.78 577 503 A 28 LYS H A 28 LYS HA 1.0 1.8 5.15 578 504 A 28 LYS H A 11 LYS HA 1.0 1.8 5.47 579 505 A 28 LYS H A 28 LYS HBx 1.0 1.8 4.84 580 505 A 28 LYS H A 28 LYS HBy 1.0 1.8 4.84 581 506 A 27 LYS HBx A 28 LYS H 1.0 1.8 4.84 582 507 A 28 LYS HG2 A 28 LYS HBx 1.0 1.8 5.43 583 507 A 28 LYS HG2 A 28 LYS HBy 1.0 1.8 5.43 584 508 A 28 LYS HD2 A 28 LYS HG2 1.0 1.8 4.87 585 509 A 27 LYS HBy A 28 LYS H 1.0 1.8 4.93 586 510 A 21 GLY HAy A 28 LYS HBx 1.0 1.8 5.36 587 510 A 21 GLY HAy A 28 LYS HBy 1.0 1.8 5.36 588 511 A 28 LYS H A 27 LYS HDy 1.0 1.8 5.80 589 512 A 29 CYS HBy A 20 ILE H 1.0 1.8 5.77 590 513 A 21 GLY H A 29 CYS H 1.0 1.8 5.51 591 514 A 28 LYS H A 29 CYS H 1.0 1.8 5.66 592 515 A 21 GLY HAx A 29 CYS HBx 1.0 1.8 5.37 593 516 A 29 CYS HBx A 29 CYS HA 1.0 1.8 5.13 594 517 A 29 CYS HBy A 29 CYS HA 1.0 1.8 5.17 595 518 A 29 CYS H A 28 LYS HA 1.0 1.8 4.71 596 519 A 21 GLY HAx A 29 CYS H 1.0 1.8 5.60 597 520 A 29 CYS HA A 29 CYS H 1.0 1.8 5.24 598 521 A 29 CYS H A 22 TYR HA 1.0 1.8 5.06 599 522 A 29 CYS H A 28 LYS HBx 1.0 1.8 5.59 600 522 A 29 CYS H A 28 LYS HBy 1.0 1.8 5.59 601 523 A 29 CYS HBy A 29 CYS H 1.0 1.8 5.05 602 524 A 29 CYS HBx A 29 CYS H 1.0 1.8 5.02 603 525 A 29 CYS HBy A 20 ILE HG2% 1.0 1.8 5.83 604 526 A 29 CYS HBy A 20 ILE HG1x 1.0 1.8 5.48 605 527 A 29 CYS HBx A 20 ILE HG2% 1.0 1.8 5.80 606 528 A 29 CYS HBx A 20 ILE HG1x 1.0 1.8 5.79 607 529 A 28 LYS HD2 A 29 CYS H 1.0 1.8 5.39 608 530 A 4 TRP HBx A 29 CYS HBy 1.0 1.8 5.78 609 531 A 3 CYS HA A 29 CYS H 1.0 1.8 5.65 610 532 A 29 CYS HBx A 20 ILE HG1y 1.0 1.8 5.75 611 533 A 32 ASN H A 30 CYS HBy 1.0 1.8 5.43 612 534 A 30 CYS HBy A 18 LYS H 1.0 1.8 5.58 613 535 A 30 CYS H A 29 CYS H 1.0 1.8 5.87 614 536 A 30 CYS HBy A 32 ASN HA 1.0 1.8 5.68 615 537 A 30 CYS HBx A 30 CYS HA 1.0 1.8 5.00 616 538 A 30 CYS H A 9 CYS HA 1.0 1.8 5.39 617 539 A 30 CYS H A 30 CYS HA 1.0 1.8 5.21 618 540 A 30 CYS H A 19 PRO HA 1.0 1.8 5.81 619 541 A 30 CYS H A 29 CYS HA 1.0 1.8 4.67 620 542 A 29 CYS HBy A 30 CYS H 1.0 1.8 5.71 621 543 A 29 CYS HBx A 30 CYS H 1.0 1.8 5.90 622 544 A 30 CYS H A 30 CYS HBx 1.0 1.8 5.18 623 545 A 30 CYS H A 30 CYS HBy 1.0 1.8 4.92 624 546 A 30 CYS HBy A 17 GLU HBx 1.0 1.8 5.50 625 547 A 30 CYS HBx A 17 GLU HBy 1.0 1.8 5.48 626 548 A 30 CYS HBx A 17 GLU HBx 1.0 1.8 5.48 627 549 A 8 ARG HA A 30 CYS H 1.0 1.8 5.36 628 550 A 30 CYS H A 13 CYS HA 1.0 1.8 5.51 629 551 A 8 ARG H A 30 CYS HBy 1.0 1.8 5.89 630 552 A 13 CYS HA A 30 CYS HBx 1.0 1.8 5.54 631 553 A 13 CYS HA A 30 CYS HBy 1.0 1.8 5.02 632 554 A 17 GLU HA A 30 CYS HBy 1.0 1.8 5.02 633 555 A 30 CYS HBy A 30 CYS HA 1.0 1.8 5.54 634 556 A 29 CYS HA A 30 CYS HBx 1.0 1.8 5.65 635 557 A 8 ARG HGx A 30 CYS HBy 1.0 1.8 5.04 636 558 A 17 GLU HGy A 30 CYS HBy 1.0 1.8 5.04 637 559 A 14 LYS HBy A 30 CYS HBx 1.0 1.8 5.61 638 560 A 13 CYS HBx A 30 CYS HBy 1.0 1.8 4.61 639 561 A 32 ASN H A 31 VAL H 1.0 1.8 5.87 640 562 A 20 ILE H A 31 VAL H 1.0 1.8 5.80 641 563 A 30 CYS H A 31 VAL H 1.0 1.8 5.89 642 564 A 31 VAL HA A 31 VAL HB 1.0 1.8 5.05 643 565 A 31 VAL HA A 31 VAL H 1.0 1.8 5.17 644 566 A 19 PRO HA A 31 VAL H 1.0 1.8 5.40 645 567 A 30 CYS HBx A 31 VAL H 1.0 1.8 5.46 646 568 A 30 CYS HBy A 31 VAL H 1.0 1.8 5.73 647 569 A 31 VAL HB A 31 VAL H 1.0 1.8 5.17 648 570 A 17 GLU HBy A 31 VAL H 1.0 1.8 5.17 649 571 A 4 TRP HBx A 31 VAL HB 1.0 1.8 4.95 650 572 A 20 ILE HD1% A 31 VAL HB 1.0 1.8 5.79 651 573 A 31 VAL HGx% A 31 VAL H 1.0 1.8 5.45 652 574 A 31 VAL HGy% A 31 VAL H 1.0 1.8 5.45 653 575 A 20 ILE HG2% A 31 VAL H 1.0 1.8 5.82 654 576 A 4 TRP HA A 31 VAL HGy% 1.0 1.8 5.18 655 577 A 31 VAL HGx% A 31 VAL HA 1.0 1.8 5.18 656 578 A 30 CYS HA A 31 VAL H 1.0 1.8 4.63 657 579 A 31 VAL HGy% A 31 VAL HB 1.0 1.8 4.64 658 580 A 31 VAL HGx% A 31 VAL HB 1.0 1.8 4.64 659 581 A 31 VAL HGy% A 20 ILE HD1% 1.0 1.8 5.04 660 582 A 31 VAL HGx% A 20 ILE HD1% 1.0 1.8 5.04 661 583 A 31 VAL HGx% A 5 ASN HBy 1.0 1.8 5.81 662 584 A 31 VAL HGy% A 31 VAL HA 1.0 1.8 4.97 663 585 A 31 VAL HGy% A 20 ILE H 1.0 1.8 5.55 664 586 A 31 VAL HGy% A 30 CYS HA 1.0 1.8 5.55 665 587 A 31 VAL HGy% A 20 ILE HG2% 1.0 1.8 5.20 666 588 A 31 VAL HGx% A 20 ILE HG2% 1.0 1.8 5.20 667 589 A 32 ASN H A 18 LYS H 1.0 1.8 5.71 668 590 A 17 GLU HA A 32 ASN HD21 1.0 1.8 5.80 669 591 A 32 ASN HA A 32 ASN HD21 1.0 1.8 5.67 670 592 A 32 ASN HA A 32 ASN HD22 1.0 1.8 5.50 671 593 A 31 VAL HA A 32 ASN H 1.0 1.8 4.67 672 594 A 32 ASN H A 17 GLU HA 1.0 1.8 5.45 673 595 A 31 VAL HB A 32 ASN H 1.0 1.8 4.91 674 596 A 32 ASN H A 17 GLU HBy 1.0 1.8 4.91 675 597 A 32 ASN HD22 A 32 ASN HBx 1.0 1.8 5.92 676 598 A 32 ASN HD22 A 32 ASN HBy 1.0 1.8 5.91 677 599 A 32 ASN HD21 A 32 ASN HBx 1.0 1.8 5.81 678 600 A 32 ASN HD21 A 32 ASN HBy 1.0 1.8 5.33 679 601 A 17 GLU HGy A 32 ASN HD21 1.0 1.8 5.38 680 602 A 31 VAL HGx% A 32 ASN H 1.0 1.8 5.23 681 603 A 31 VAL HGy% A 32 ASN H 1.0 1.8 5.23 682 604 A 32 ASN H A 32 ASN HBy 1.0 1.8 5.44 683 605 A 32 ASN H A 32 ASN HBx 1.0 1.8 5.44 684 606 A 32 ASN HA A 32 ASN HBx 1.0 1.8 5.19 685 607 A 17 GLU HA A 32 ASN HBx 1.0 1.8 5.02 686 608 A 32 ASN HA A 32 ASN HBy 1.0 1.8 5.16 687 609 A 31 VAL HA A 32 ASN HBy 1.0 1.8 5.16 688 610 A 17 GLU HGx A 32 ASN HD22 1.0 1.8 5.20 689 611 A 5 ASN HBy A 32 ASN HBx 1.0 1.8 5.85 690 612 A 17 GLU HGx A 32 ASN HBy 1.0 1.8 5.72 691 613 A 17 GLU HGx A 32 ASN HBx 1.0 1.8 5.82 692 614 A 17 GLU HGy A 32 ASN HBx 1.0 1.8 5.04 693 615 A 32 ASN HD22 A 15 GLU HBx 1.0 1.8 5.45 694 615 A 15 GLU HBy A 32 ASN HD22 1.0 1.8 5.45 695 616 A 2 LYS HGx A 2 LYS HEx 1.0 1.8 5.24 696 617 A 2 LYS HGy A 2 LYS HEy 1.0 1.8 5.24 697 618 A 2 LYS HGx A 2 LYS HEy 1.0 1.8 5.24 698 619 A 2 LYS HA A 2 LYS HBy 1.0 1.8 4.90 699 619 A 2 LYS HA A 2 LYS HBx 1.0 1.8 4.90 700 620 A 2 LYS HEx A 2 LYS HDy 1.0 1.8 5.07 701 620 A 2 LYS HEx A 2 LYS HDx 1.0 1.8 5.07 702 621 A 2 LYS HEx A 2 LYS HGy 1.0 1.8 5.22 703 622 A 2 LYS HEx A 2 LYS HBy 1.0 1.8 5.21 704 622 A 2 LYS HEx A 2 LYS HBx 1.0 1.8 5.21 705 623 A 2 LYS HEy A 2 LYS HBy 1.0 1.8 5.21 706 623 A 2 LYS HEy A 2 LYS HBx 1.0 1.8 5.21 707 624 A 2 LYS HEy A 2 LYS HDy 1.0 1.8 4.93 708 624 A 2 LYS HEy A 2 LYS HDx 1.0 1.8 4.93 709 625 A 2 LYS HA A 2 LYS H 1.0 1.8 5.87 710 626 A 2 LYS HEy A 2 LYS HA 1.0 1.8 5.63 711 627 A 2 LYS HEx A 2 LYS HA 1.0 1.8 5.63 712 628 A 3 CYS HBy A 3 CYS HA 1.0 1.8 5.58 713 629 A 3 CYS HBy A 8 ARG HA 1.0 1.8 5.38 714 630 A 3 CYS HBy A 3 CYS H 1.0 1.8 5.81 715 631 A 8 ARG HA A 3 CYS HBx 1.0 1.8 5.68 716 632 A 3 CYS HBx A 6 GLY HAy 1.0 1.8 5.83 717 633 A 3 CYS HBy A 4 TRP HBx 1.0 1.8 4.61 718 634 A 4 TRP HBy A 4 TRP HD1 1.0 1.8 5.28 719 635 A 4 TRP H A 4 TRP HE1 1.0 1.8 5.52 720 636 A 4 TRP HD1 A 4 TRP HE1 1.0 1.8 5.27 721 637 A 4 TRP HH2 A 4 TRP HZ3 1.0 1.8 4.54 722 638 A 4 TRP HH2 A 4 TRP HZ2 1.0 1.8 4.35 723 639 A 4 TRP HBy A 4 TRP HA 1.0 1.8 4.95 724 640 A 4 TRP HBx A 4 TRP HA 1.0 1.8 4.93 725 641 A 4 TRP HD1 A 4 TRP HA 1.0 1.8 5.19 726 642 A 4 TRP H A 4 TRP HA 1.0 1.8 5.54 727 643 A 4 TRP HZ2 A 21 GLY HAx 1.0 1.8 5.25 728 644 A 4 TRP HZ2 A 21 GLY HAy 1.0 1.8 5.64 729 645 A 4 TRP HBx A 4 TRP H 1.0 1.8 5.53 730 646 A 3 CYS HBx A 4 TRP H 1.0 1.8 5.72 731 647 A 4 TRP HD1 A 29 CYS HBy 1.0 1.8 5.89 732 648 A 4 TRP HD1 A 29 CYS HBx 1.0 1.8 5.83 733 649 A 4 TRP HBx A 31 VAL HGx% 1.0 1.8 5.89 734 650 A 4 TRP HBx A 31 VAL HGy% 1.0 1.8 5.89 735 651 A 4 TRP HBy A 31 VAL HGy% 1.0 1.8 5.89 736 652 A 4 TRP HBx A 20 ILE HD1% 1.0 1.8 5.84 737 653 A 4 TRP HD1 A 20 ILE HG2% 1.0 1.8 5.50 738 654 A 4 TRP HD1 A 31 VAL HGy% 1.0 1.8 5.30 739 655 A 4 TRP HE1 A 31 VAL HGy% 1.0 1.8 5.81 740 656 A 4 TRP HBx A 5 ASN H 1.0 1.8 5.72 741 657 A 4 TRP HBy A 5 ASN H 1.0 1.8 5.72 742 658 A 4 TRP HE1 A 20 ILE HD1% 1.0 1.8 5.66 743 659 A 4 TRP HD1 A 20 ILE HD1% 1.0 1.8 5.08 744 660 A 4 TRP HBx A 4 TRP HE1 1.0 1.8 5.55 745 661 A 4 TRP HBx A 4 TRP HD1 1.0 1.8 5.67 746 662 A 4 TRP HBy A 4 TRP H 1.0 1.8 5.70 747 663 A 4 TRP HBx A 5 ASN HBx 1.0 1.8 5.27 748 664 A 4 TRP HD1 A 21 GLY HAx 1.0 1.8 5.75 749 665 A 8 ARG HA A 4 TRP H 1.0 1.8 5.57 750 666 A 4 TRP HZ2 A 20 ILE HD1% 1.0 1.8 5.82 751 667 A 4 TRP HBy A 4 TRP HE1 1.0 1.8 5.59 752 668 A 4 TRP HD1 A 5 ASN HBx 1.0 1.8 5.59 753 669 A 4 TRP HBy A 20 ILE HD1% 1.0 1.8 5.60 754 670 A 5 ASN H A 7 GLY H 1.0 1.8 5.71 755 671 A 5 ASN HBy A 31 VAL HA 1.0 1.8 5.50 756 672 A 4 TRP HA A 5 ASN H 1.0 1.8 5.23 757 673 A 5 ASN HBy A 5 ASN HA 1.0 1.8 5.74 758 674 A 5 ASN HBx A 31 VAL HB 1.0 1.8 5.48 759 675 A 5 ASN H A 5 ASN HA 1.0 1.8 5.15 760 676 A 5 ASN HA A 5 ASN HD22 1.0 1.8 5.50 761 677 A 5 ASN HBx A 5 ASN HD22 1.0 1.8 5.65 762 678 A 5 ASN HBy A 5 ASN HD22 1.0 1.8 5.57 763 679 A 5 ASN H A 5 ASN HBx 1.0 1.8 5.03 764 680 A 31 VAL HGy% A 5 ASN H 1.0 1.8 5.76 765 681 A 31 VAL HGx% A 5 ASN HBx 1.0 1.8 5.72 766 682 A 6 GLY HAy A 5 ASN HA 1.0 1.8 4.78 767 683 A 5 ASN HBx A 5 ASN HA 1.0 1.8 5.26 768 684 A 4 TRP HA A 5 ASN HBx 1.0 1.8 5.65 769 685 A 5 ASN HBx A 31 VAL HA 1.0 1.8 5.65 770 686 A 6 GLY HAy A 5 ASN HBx 1.0 1.8 5.76 771 687 A 4 TRP HBx A 5 ASN HBy 1.0 1.8 5.78 772 688 A 20 ILE HD1% A 5 ASN HD22 1.0 1.8 5.62 773 689 A 20 ILE HD1% A 5 ASN HD21 1.0 1.8 5.79 774 690 A 5 ASN HBx A 5 ASN HBy 1.0 1.8 5.51 775 691 A 7 GLY H A 6 GLY H 1.0 1.8 5.71 776 692 A 6 GLY HAx A 7 GLY HAx 1.0 1.8 4.93 777 693 A 6 GLY H A 6 GLY HAx 1.0 1.8 5.53 778 694 A 5 ASN HA A 6 GLY H 1.0 1.8 5.53 779 695 A 6 GLY HAy A 6 GLY H 1.0 1.8 5.80 780 696 A 5 ASN HA A 6 GLY HAx 1.0 1.8 5.35 781 697 A 6 GLY HAy A 6 GLY HAx 1.0 1.8 4.45 782 698 A 4 TRP H A 7 GLY HAy 1.0 1.8 5.65 783 699 A 7 GLY HAx A 32 ASN H 1.0 1.8 5.44 784 700 A 31 VAL HA A 7 GLY HAy 1.0 1.8 5.44 785 701 A 7 GLY H A 7 GLY HAx 1.0 1.8 5.07 786 702 A 7 GLY H A 6 GLY HAx 1.0 1.8 5.48 787 703 A 6 GLY HAy A 7 GLY H 1.0 1.8 5.50 788 704 A 7 GLY H A 7 GLY HAy 1.0 1.8 4.82 789 705 A 7 GLY HAx A 8 ARG HBx 1.0 1.8 5.64 790 706 A 31 VAL HGy% A 7 GLY HAy 1.0 1.8 5.25 791 707 A 31 VAL HGy% A 7 GLY H 1.0 1.8 5.40 792 708 A 6 GLY HAy A 7 GLY HAx 1.0 1.8 4.78 793 709 A 8 ARG HA A 7 GLY HAy 1.0 1.8 5.64 794 710 A 7 GLY HAx A 8 ARG HGx 1.0 1.8 5.09 795 711 A 31 VAL HGy% A 7 GLY HAx 1.0 1.8 5.43 796 712 A 7 GLY HAx A 7 GLY HAy 1.0 1.8 4.69 797 713 A 7 GLY H A 8 ARG H 1.0 1.8 5.71 798 714 A 8 ARG H A 30 CYS H 1.0 1.8 5.07 799 715 A 8 ARG HGx A 9 CYS HA 1.0 1.8 5.77 800 716 A 8 ARG HGx A 13 CYS HA 1.0 1.8 5.37 801 717 A 8 ARG H A 29 CYS HA 1.0 1.8 5.46 802 718 A 31 VAL HA A 8 ARG H 1.0 1.8 5.46 803 719 A 8 ARG HA A 8 ARG H 1.0 1.8 5.40 804 720 A 8 ARG H A 9 CYS HA 1.0 1.8 5.34 805 721 A 8 ARG H A 8 ARG HDy 1.0 1.8 5.69 806 722 A 8 ARG H A 8 ARG HDx 1.0 1.8 5.84 807 723 A 7 GLY HAy A 8 ARG H 1.0 1.8 4.96 808 724 A 8 ARG H A 14 LYS HBy 1.0 1.8 5.27 809 725 A 8 ARG HDy A 8 ARG HBy 1.0 1.8 5.56 810 726 A 8 ARG HBx A 8 ARG HDy 1.0 1.8 5.75 811 727 A 8 ARG HGx A 8 ARG HDx 1.0 1.8 4.93 812 728 A 8 ARG HGx A 8 ARG HDy 1.0 1.8 4.93 813 729 A 8 ARG HGx A 9 CYS H 1.0 1.8 5.11 814 730 A 8 ARG HGx A 8 ARG H 1.0 1.8 5.11 815 731 A 7 GLY HAx A 8 ARG H 1.0 1.8 4.85 816 732 A 8 ARG H A 30 CYS HBx 1.0 1.8 5.03 817 733 A 8 ARG H A 8 ARG HBy 1.0 1.8 4.84 818 734 A 8 ARG HBx A 8 ARG H 1.0 1.8 4.84 819 735 A 9 CYS HA A 8 ARG HBy 1.0 1.8 5.88 820 736 A 8 ARG HA A 8 ARG HGx 1.0 1.8 5.73 821 737 A 8 ARG HA A 8 ARG HGy 1.0 1.8 5.76 822 738 A 7 GLY HAx A 8 ARG HGy 1.0 1.8 5.19 823 739 A 8 ARG H A 8 ARG HGy 1.0 1.8 5.05 824 740 A 8 ARG H A 13 CYS HA 1.0 1.8 5.56 825 741 A 9 CYS H A 10 ARG H 1.0 1.8 5.24 826 742 A 9 CYS HBy A 23 CYS HA 1.0 1.8 5.71 827 743 A 9 CYS HA A 29 CYS HA 1.0 1.8 5.10 828 744 A 29 CYS HA A 9 CYS H 1.0 1.8 5.46 829 745 A 8 ARG HA A 9 CYS H 1.0 1.8 5.40 830 746 A 9 CYS HA A 9 CYS H 1.0 1.8 5.34 831 747 A 9 CYS H A 9 CYS HBy 1.0 1.8 5.37 832 748 A 9 CYS HA A 9 CYS HBy 1.0 1.8 5.04 833 749 A 9 CYS HA A 9 CYS HBx 1.0 1.8 5.20 834 750 A 9 CYS HBx A 27 LYS HDx 1.0 1.8 5.51 835 751 A 9 CYS HBy A 23 CYS HBx 1.0 1.8 5.46 836 752 A 9 CYS HBx A 23 CYS HBx 1.0 1.8 5.57 837 753 A 9 CYS H A 9 CYS HBx 1.0 1.8 5.03 838 754 A 8 ARG HBy A 9 CYS H 1.0 1.8 4.84 839 755 A 8 ARG HBx A 9 CYS H 1.0 1.8 4.84 840 756 A 9 CYS HBy A 27 LYS HGx 1.0 1.8 5.59 841 757 A 29 CYS HA A 9 CYS HBy 1.0 1.8 5.16 842 758 A 8 ARG HA A 9 CYS HBx 1.0 1.8 5.78 843 759 A 29 CYS HA A 9 CYS HBx 1.0 1.8 5.65 844 760 A 9 CYS HBy A 27 LYS HBy 1.0 1.8 5.01 845 761 A 9 CYS HBy A 27 LYS HBx 1.0 1.8 5.10 846 762 A 9 CYS H A 8 ARG HGy 1.0 1.8 5.05 847 763 A 9 CYS HBx A 10 ARG HG2 1.0 1.8 5.44 848 764 A 10 ARG HBy A 11 LYS H 1.0 1.8 5.77 849 765 A 8 ARG HDx A 10 ARG HG2 1.0 1.8 5.24 850 766 A 10 ARG HG2 A 10 ARG HA 1.0 1.8 5.82 851 767 A 10 ARG HBy A 10 ARG HA 1.0 1.8 5.47 852 768 A 13 CYS HA A 10 ARG HBx 1.0 1.8 5.54 853 769 A 9 CYS HA A 10 ARG H 1.0 1.8 4.66 854 770 A 10 ARG H A 10 ARG HA 1.0 1.8 5.21 855 771 A 10 ARG H A 10 ARG HBy 1.0 1.8 5.26 856 772 A 10 ARG H A 27 LYS HBx 1.0 1.8 5.33 857 773 A 10 ARG H A 9 CYS HBy 1.0 1.8 5.41 858 774 A 10 ARG H A 9 CYS HBx 1.0 1.8 5.79 859 775 A 30 CYS HBx A 10 ARG H 1.0 1.8 5.79 860 776 A 8 ARG HDx A 10 ARG HBx 1.0 1.8 4.86 861 777 A 29 CYS HA A 10 ARG H 1.0 1.8 5.70 862 778 A 10 ARG H A 10 ARG HG2 1.0 1.8 5.39 863 779 A 10 ARG HG2 A 10 ARG HBx 1.0 1.8 4.69 864 780 A 10 ARG H A 10 ARG HBx 1.0 1.8 5.56 865 781 A 10 ARG HA A 10 ARG HBx 1.0 1.8 5.08 866 782 A 13 CYS HA A 10 ARG HBy 1.0 1.8 5.72 867 783 A 10 ARG HG2 A 10 ARG HBy 1.0 1.8 4.70 868 784 A 10 ARG HBy A 28 LYS H 1.0 1.8 5.76 869 785 A 8 ARG HDx A 10 ARG H 1.0 1.8 5.45 870 786 A 10 ARG H A 23 CYS HBy 1.0 1.8 5.45 871 787 A 10 ARG H A 27 LYS HDx 1.0 1.8 5.78 872 788 A 11 LYS HGx A 12 LYS H 1.0 1.8 5.83 873 789 A 11 LYS H A 11 LYS HA 1.0 1.8 5.82 874 790 A 11 LYS HA A 11 LYS HGy 1.0 1.8 5.84 875 791 A 11 LYS HA A 27 LYS HA 1.0 1.8 4.93 876 792 A 11 LYS HA A 12 LYS HA 1.0 1.8 4.93 877 793 A 11 LYS H A 11 LYS HGx 1.0 1.8 5.18 878 794 A 10 ARG HBy A 11 LYS HA 1.0 1.8 5.31 879 795 A 11 LYS HGx A 11 LYS HA 1.0 1.8 5.30 880 796 A 11 LYS HA A 11 LYS HBy 1.0 1.8 5.49 881 797 A 11 LYS HGy A 11 LYS HEy 1.0 1.8 5.51 882 797 A 11 LYS HGy A 11 LYS HEx 1.0 1.8 5.51 883 798 A 11 LYS HGx A 11 LYS HBx 1.0 1.8 4.93 884 799 A 11 LYS H A 27 LYS HA 1.0 1.8 5.53 885 800 A 11 LYS HA A 11 LYS HDx 1.0 1.8 5.65 886 800 A 11 LYS HA A 11 LYS HDy 1.0 1.8 5.65 887 801 A 11 LYS HA A 11 LYS HBx 1.0 1.8 4.92 888 802 A 11 LYS HGx A 11 LYS HEy 1.0 1.8 5.50 889 802 A 11 LYS HGx A 11 LYS HEx 1.0 1.8 5.50 890 803 A 28 LYS H A 11 LYS HGx 1.0 1.8 5.76 891 804 A 26 GLY HAy A 11 LYS HDx 1.0 1.8 5.36 892 804 A 11 LYS HDy A 26 GLY HAy 1.0 1.8 5.36 893 805 A 11 LYS HGx A 27 LYS HDy 1.0 1.8 4.90 894 806 A 12 LYS HA A 11 LYS HBx 1.0 1.8 5.67 895 807 A 11 LYS HA A 27 LYS HDy 1.0 1.8 5.13 896 808 A 13 CYS HA A 12 LYS H 1.0 1.8 5.70 897 809 A 10 ARG HBy A 12 LYS H 1.0 1.8 5.43 898 810 A 12 LYS H A 12 LYS HBy 1.0 1.8 5.13 899 810 A 12 LYS H A 12 LYS HBx 1.0 1.8 5.13 900 811 A 10 ARG HBx A 12 LYS H 1.0 1.8 5.15 901 812 A 12 LYS H A 11 LYS HA 1.0 1.8 5.66 902 813 A 12 LYS H A 27 LYS HA 1.0 1.8 5.08 903 814 A 12 LYS H A 12 LYS HA 1.0 1.8 5.08 904 815 A 12 LYS H A 11 LYS HBx 1.0 1.8 5.20 905 816 A 12 LYS HA A 12 LYS HBy 1.0 1.8 5.09 906 816 A 12 LYS HA A 12 LYS HBx 1.0 1.8 5.09 907 817 A 12 LYS HA A 12 LYS HDx 1.0 1.8 5.09 908 817 A 12 LYS HA A 12 LYS HDy 1.0 1.8 5.09 909 818 A 12 LYS HA A 12 LYS HGy 1.0 1.8 5.33 910 818 A 12 LYS HA A 12 LYS HGx 1.0 1.8 5.33 911 819 A 12 LYS HEy A 12 LYS HGy 1.0 1.8 5.55 912 819 A 12 LYS HEx A 12 LYS HGy 1.0 1.8 5.55 913 819 A 12 LYS HGx A 12 LYS HEy 1.0 1.8 5.55 914 819 A 12 LYS HGx A 12 LYS HEx 1.0 1.8 5.55 915 820 A 12 LYS H A 13 CYS H 1.0 1.8 4.86 916 821 A 13 CYS HA A 13 CYS HBy 1.0 1.8 5.38 917 822 A 13 CYS HBy A 17 GLU HA 1.0 1.8 5.38 918 823 A 13 CYS HBy A 19 PRO HDy 1.0 1.8 5.82 919 823 A 13 CYS HBy A 19 PRO HDx 1.0 1.8 5.82 920 824 A 13 CYS HA A 13 CYS HBx 1.0 1.8 5.05 921 825 A 13 CYS HA A 13 CYS H 1.0 1.8 5.84 922 826 A 13 CYS H A 13 CYS HBx 1.0 1.8 5.87 923 827 A 13 CYS H A 13 CYS HBy 1.0 1.8 5.58 924 828 A 12 LYS HA A 13 CYS H 1.0 1.8 5.22 925 829 A 13 CYS HBy A 17 GLU HGy 1.0 1.8 5.87 926 830 A 13 CYS HBy A 13 CYS HBx 1.0 1.8 4.61 927 831 A 13 CYS HA A 14 LYS HBy 1.0 1.8 5.89 928 832 A 13 CYS HA A 14 LYS H 1.0 1.8 5.01 929 833 A 14 LYS H A 14 LYS HA 1.0 1.8 5.63 930 834 A 13 CYS HBx A 14 LYS H 1.0 1.8 4.99 931 835 A 13 CYS HBy A 14 LYS H 1.0 1.8 5.37 932 836 A 30 CYS HBx A 14 LYS H 1.0 1.8 5.58 933 837 A 14 LYS H A 14 LYS HBx 1.0 1.8 5.33 934 838 A 8 ARG HGx A 14 LYS H 1.0 1.8 5.41 935 839 A 17 GLU HGy A 14 LYS H 1.0 1.8 5.41 936 840 A 8 ARG HGy A 14 LYS H 1.0 1.8 5.41 937 841 A 14 LYS HBy A 14 LYS H 1.0 1.8 5.37 938 842 A 14 LYS H A 14 LYS HGy 1.0 1.8 5.37 939 842 A 14 LYS H A 14 LYS HGx 1.0 1.8 5.37 940 843 A 14 LYS HBy A 14 LYS HA 1.0 1.8 4.78 941 844 A 14 LYS HA A 14 LYS HGy 1.0 1.8 4.78 942 844 A 14 LYS HA A 14 LYS HGx 1.0 1.8 4.78 943 845 A 8 ARG HDx A 14 LYS HDy 1.0 1.8 4.93 944 845 A 8 ARG HDx A 14 LYS HDx 1.0 1.8 4.93 945 846 A 14 LYS HBy A 17 GLU HBy 1.0 1.8 5.03 946 847 A 14 LYS HGx A 15 GLU HGx 1.0 1.8 5.63 947 847 A 14 LYS HGy A 15 GLU HGx 1.0 1.8 5.63 948 847 A 15 GLU HGy A 14 LYS HGy 1.0 1.8 5.63 949 847 A 14 LYS HGx A 15 GLU HGy 1.0 1.8 5.63 950 848 A 14 LYS HBy A 17 GLU HGx 1.0 1.8 4.93 951 849 A 13 CYS H A 14 LYS H 1.0 1.8 5.70 952 850 A 14 LYS HA A 14 LYS HBx 1.0 1.8 5.10 953 851 A 14 LYS HA A 14 LYS HDy 1.0 1.8 4.93 954 851 A 14 LYS HA A 14 LYS HDx 1.0 1.8 4.93 955 852 A 14 LYS HBy A 14 LYS HBx 1.0 1.8 4.47 956 853 A 14 LYS HBx A 14 LYS HGy 1.0 1.8 4.47 957 853 A 14 LYS HBx A 14 LYS HGx 1.0 1.8 4.47 958 854 A 14 LYS HBx A 15 GLU H 1.0 1.8 5.57 959 855 A 14 LYS HA A 15 GLU H 1.0 1.8 5.56 960 856 A 8 ARG HDx A 14 LYS H 1.0 1.8 5.33 961 857 A 14 LYS H A 30 CYS HBy 1.0 1.8 5.87 962 858 A 14 LYS HBy A 14 LYS HEx 1.0 1.8 5.61 963 858 A 14 LYS HBy A 14 LYS HEy 1.0 1.8 5.61 964 859 A 14 LYS HEx A 14 LYS HGy 1.0 1.8 5.61 965 859 A 14 LYS HEy A 14 LYS HGy 1.0 1.8 5.61 966 859 A 14 LYS HGx A 14 LYS HEx 1.0 1.8 5.61 967 859 A 14 LYS HGx A 14 LYS HEy 1.0 1.8 5.61 968 860 A 8 ARG HDx A 14 LYS HBy 1.0 1.8 5.39 969 861 A 10 ARG H A 14 LYS H 1.0 1.8 5.86 970 862 A 14 LYS H A 17 GLU H 1.0 1.8 5.89 971 863 A 15 GLU H A 16 ASN H 1.0 1.8 5.62 972 864 A 15 GLU H A 15 GLU HA 1.0 1.8 5.11 973 865 A 14 LYS HBy A 15 GLU H 1.0 1.8 5.21 974 866 A 15 GLU H A 14 LYS HGy 1.0 1.8 5.21 975 866 A 14 LYS HGx A 15 GLU H 1.0 1.8 5.21 976 867 A 15 GLU H A 15 GLU HGx 1.0 1.8 5.34 977 867 A 15 GLU HGy A 15 GLU H 1.0 1.8 5.34 978 868 A 15 GLU HA A 15 GLU HBx 1.0 1.8 4.79 979 868 A 15 GLU HA A 15 GLU HBy 1.0 1.8 4.79 980 869 A 15 GLU HA A 15 GLU HGx 1.0 1.8 5.03 981 869 A 15 GLU HGy A 15 GLU HA 1.0 1.8 5.03 982 870 A 15 GLU HBx A 15 GLU HGx 1.0 1.8 4.58 983 870 A 15 GLU HBy A 15 GLU HGx 1.0 1.8 4.58 984 870 A 15 GLU HGy A 15 GLU HBx 1.0 1.8 4.58 985 870 A 15 GLU HGy A 15 GLU HBy 1.0 1.8 4.58 986 871 A 14 LYS HGy A 15 GLU HBx 1.0 1.8 4.47 987 871 A 14 LYS HGx A 15 GLU HBx 1.0 1.8 4.47 988 871 A 15 GLU HBy A 14 LYS HGy 1.0 1.8 4.47 989 871 A 14 LYS HGx A 15 GLU HBy 1.0 1.8 4.47 990 872 A 15 GLU H A 15 GLU HBx 1.0 1.8 5.57 991 872 A 15 GLU H A 15 GLU HBy 1.0 1.8 5.57 992 873 A 16 ASN HA A 15 GLU HBx 1.0 1.8 5.80 993 873 A 15 GLU HBy A 16 ASN HA 1.0 1.8 5.80 994 874 A 17 GLU H A 16 ASN H 1.0 1.8 5.02 995 875 A 16 ASN HA A 16 ASN HBx 1.0 1.8 5.09 996 876 A 16 ASN HA A 16 ASN HD22 1.0 1.8 5.89 997 877 A 16 ASN H A 15 GLU HA 1.0 1.8 5.05 998 878 A 16 ASN H A 16 ASN HA 1.0 1.8 5.42 999 879 A 17 GLU HGy A 16 ASN H 1.0 1.8 5.80 1000 880 A 16 ASN H A 15 GLU HBx 1.0 1.8 5.12 1001 880 A 16 ASN H A 15 GLU HBy 1.0 1.8 5.12 1002 881 A 16 ASN H A 16 ASN HBx 1.0 1.8 5.49 1003 882 A 16 ASN HBx A 16 ASN HD22 1.0 1.8 5.01 1004 883 A 16 ASN HD22 A 16 ASN HBy 1.0 1.8 5.20 1005 884 A 16 ASN HBx A 16 ASN HD21 1.0 1.8 5.21 1006 885 A 16 ASN H A 16 ASN HBy 1.0 1.8 5.44 1007 886 A 16 ASN HBy A 16 ASN HD21 1.0 1.8 5.83 1008 887 A 16 ASN H A 16 ASN HD22 1.0 1.8 5.72 1009 888 A 16 ASN H A 14 LYS HGy 1.0 1.8 5.39 1010 888 A 14 LYS HGx A 16 ASN H 1.0 1.8 5.39 1011 889 A 16 ASN HBx A 32 ASN HA 1.0 1.8 5.82 1012 890 A 17 GLU HBx A 18 LYS H 1.0 1.8 5.60 1013 891 A 17 GLU HA A 17 GLU HGy 1.0 1.8 5.24 1014 892 A 17 GLU HA A 17 GLU HGx 1.0 1.8 5.40 1015 893 A 13 CYS HA A 17 GLU HBy 1.0 1.8 5.34 1016 894 A 17 GLU HA A 17 GLU HBy 1.0 1.8 5.34 1017 895 A 13 CYS HA A 17 GLU HBx 1.0 1.8 5.49 1018 896 A 17 GLU HA A 17 GLU HBx 1.0 1.8 5.49 1019 897 A 17 GLU HA A 17 GLU H 1.0 1.8 5.28 1020 898 A 17 GLU H A 16 ASN HA 1.0 1.8 5.38 1021 899 A 17 GLU H A 15 GLU HA 1.0 1.8 5.46 1022 900 A 13 CYS HBx A 17 GLU H 1.0 1.8 5.54 1023 901 A 17 GLU H A 16 ASN HBx 1.0 1.8 5.88 1024 902 A 17 GLU H A 16 ASN HBy 1.0 1.8 5.90 1025 903 A 17 GLU HBy A 17 GLU H 1.0 1.8 5.57 1026 904 A 17 GLU HGx A 17 GLU H 1.0 1.8 5.50 1027 905 A 17 GLU HGy A 17 GLU H 1.0 1.8 5.27 1028 906 A 13 CYS HBx A 17 GLU HBx 1.0 1.8 4.95 1029 907 A 14 LYS HBy A 17 GLU HBx 1.0 1.8 5.30 1030 908 A 17 GLU HGy A 17 GLU HBy 1.0 1.8 5.25 1031 909 A 13 CYS HBx A 17 GLU HBy 1.0 1.8 5.53 1032 910 A 17 GLU HGy A 16 ASN HBx 1.0 1.8 4.95 1033 911 A 14 LYS H A 17 GLU HBx 1.0 1.8 5.21 1034 912 A 14 LYS H A 17 GLU HBy 1.0 1.8 5.21 1035 913 A 17 GLU H A 17 GLU HBx 1.0 1.8 5.42 1036 914 A 17 GLU HGy A 32 ASN HA 1.0 1.8 5.81 1037 915 A 17 GLU HGx A 32 ASN HA 1.0 1.8 5.80 1038 916 A 13 CYS HBy A 17 GLU HBy 1.0 1.8 5.79 1039 917 A 13 CYS HBy A 17 GLU HBx 1.0 1.8 5.73 1040 918 A 17 GLU HGy A 17 GLU HBx 1.0 1.8 4.83 1041 919 A 17 GLU HGy A 14 LYS HA 1.0 1.8 5.19 1042 920 A 30 CYS HBy A 17 GLU H 1.0 1.8 5.18 1043 921 A 14 LYS HA A 17 GLU HGx 1.0 1.8 5.67 1044 922 A 7 GLY HAx A 17 GLU HGx 1.0 1.8 5.67 1045 923 A 17 GLU H A 15 GLU HBx 1.0 1.8 5.71 1046 923 A 17 GLU H A 15 GLU HBy 1.0 1.8 5.71 1047 924 A 14 LYS HBy A 17 GLU H 1.0 1.8 5.57 1048 925 A 13 CYS HBx A 17 GLU HGx 1.0 1.8 5.53 1049 926 A 13 CYS HBx A 17 GLU HGy 1.0 1.8 5.28 1050 927 A 18 LYS HA A 18 LYS HGy 1.0 1.8 5.67 1051 927 A 18 LYS HGx A 18 LYS HA 1.0 1.8 5.67 1052 928 A 18 LYS HA A 18 LYS HDx 1.0 1.8 5.22 1053 929 A 17 GLU HA A 18 LYS HDy 1.0 1.8 5.37 1054 930 A 32 ASN HA A 18 LYS H 1.0 1.8 5.57 1055 931 A 17 GLU HA A 18 LYS H 1.0 1.8 4.81 1056 932 A 18 LYS H A 18 LYS HA 1.0 1.8 5.65 1057 933 A 17 GLU HBy A 18 LYS H 1.0 1.8 5.33 1058 934 A 17 GLU HGx A 18 LYS H 1.0 1.8 5.72 1059 935 A 18 LYS H A 18 LYS HDy 1.0 1.8 5.76 1060 936 A 18 LYS H A 18 LYS HGy 1.0 1.8 5.74 1061 936 A 18 LYS H A 18 LYS HGx 1.0 1.8 5.74 1062 937 A 18 LYS H A 18 LYS HBx 1.0 1.8 5.48 1063 937 A 18 LYS H A 18 LYS HBy 1.0 1.8 5.48 1064 938 A 18 LYS H A 18 LYS HDx 1.0 1.8 5.80 1065 939 A 18 LYS HEx A 18 LYS HGy 1.0 1.8 5.04 1066 939 A 18 LYS HEy A 18 LYS HGy 1.0 1.8 5.04 1067 939 A 18 LYS HGx A 18 LYS HEx 1.0 1.8 5.04 1068 939 A 18 LYS HGx A 18 LYS HEy 1.0 1.8 5.04 1069 940 A 18 LYS HDy A 18 LYS HEx 1.0 1.8 5.40 1070 940 A 18 LYS HDy A 18 LYS HEy 1.0 1.8 5.40 1071 941 A 19 PRO HGx A 19 PRO HA 1.0 1.8 5.74 1072 942 A 19 PRO HGx A 19 PRO HDy 1.0 1.8 5.23 1073 942 A 19 PRO HDx A 19 PRO HGx 1.0 1.8 5.23 1074 943 A 18 LYS HBy A 19 PRO HDy 1.0 1.8 5.37 1075 943 A 18 LYS HBx A 19 PRO HDy 1.0 1.8 5.37 1076 943 A 19 PRO HDx A 18 LYS HBx 1.0 1.8 5.37 1077 943 A 19 PRO HDx A 18 LYS HBy 1.0 1.8 5.37 1078 944 A 18 LYS HDx A 19 PRO HDy 1.0 1.8 5.54 1079 944 A 19 PRO HDx A 18 LYS HDx 1.0 1.8 5.54 1080 945 A 28 LYS HD2 A 19 PRO HBx 1.0 1.8 4.47 1081 945 A 19 PRO HBy A 28 LYS HD2 1.0 1.8 4.47 1082 946 A 19 PRO HGy A 19 PRO HDy 1.0 1.8 5.02 1083 946 A 19 PRO HDx A 19 PRO HGy 1.0 1.8 5.02 1084 947 A 19 PRO HBx A 19 PRO HDy 1.0 1.8 5.47 1085 947 A 19 PRO HBy A 19 PRO HDy 1.0 1.8 5.47 1086 947 A 19 PRO HDx A 19 PRO HBx 1.0 1.8 5.47 1087 947 A 19 PRO HDx A 19 PRO HBy 1.0 1.8 5.47 1088 948 A 13 CYS HBx A 19 PRO HGx 1.0 1.8 5.85 1089 949 A 19 PRO HA A 19 PRO HBx 1.0 1.8 5.07 1090 949 A 19 PRO HA A 19 PRO HBy 1.0 1.8 5.07 1091 950 A 19 PRO HGx A 19 PRO HGy 1.0 1.8 4.54 1092 951 A 20 ILE H A 21 GLY H 1.0 1.8 4.86 1093 952 A 20 ILE H A 29 CYS H 1.0 1.8 5.80 1094 953 A 20 ILE HD1% A 20 ILE HA 1.0 1.8 5.31 1095 954 A 20 ILE HA A 20 ILE HG1x 1.0 1.8 5.75 1096 955 A 20 ILE HA A 20 ILE HG1y 1.0 1.8 5.66 1097 956 A 21 GLY HAx A 20 ILE HG1x 1.0 1.8 5.64 1098 957 A 19 PRO HA A 20 ILE H 1.0 1.8 4.61 1099 958 A 20 ILE H A 30 CYS HA 1.0 1.8 5.62 1100 959 A 20 ILE H A 20 ILE HA 1.0 1.8 5.11 1101 960 A 20 ILE H A 19 PRO HBx 1.0 1.8 5.46 1102 960 A 19 PRO HBy A 20 ILE H 1.0 1.8 5.46 1103 961 A 20 ILE H A 20 ILE HB 1.0 1.8 5.22 1104 962 A 20 ILE HA A 20 ILE HB 1.0 1.8 5.60 1105 963 A 20 ILE HG2% A 31 VAL HB 1.0 1.8 5.66 1106 964 A 20 ILE HD1% A 20 ILE HG1x 1.0 1.8 4.82 1107 965 A 20 ILE HG2% A 20 ILE HA 1.0 1.8 5.70 1108 966 A 20 ILE HG2% A 20 ILE H 1.0 1.8 5.15 1109 967 A 20 ILE H A 20 ILE HG1y 1.0 1.8 4.98 1110 968 A 20 ILE H A 20 ILE HG1x 1.0 1.8 5.21 1111 969 A 20 ILE HG2% A 31 VAL HA 1.0 1.8 5.67 1112 970 A 29 CYS HBx A 20 ILE H 1.0 1.8 5.57 1113 971 A 20 ILE HG1x A 20 ILE HB 1.0 1.8 5.13 1114 972 A 20 ILE HD1% A 20 ILE HB 1.0 1.8 5.00 1115 973 A 31 VAL HB A 20 ILE HG1x 1.0 1.8 4.64 1116 974 A 20 ILE HG2% A 20 ILE HB 1.0 1.8 5.39 1117 975 A 20 ILE HG1y A 20 ILE HB 1.0 1.8 5.50 1118 976 A 20 ILE HD1% A 20 ILE HG1y 1.0 1.8 5.09 1119 977 A 20 ILE HG2% A 19 PRO HA 1.0 1.8 5.73 1120 978 A 18 LYS HA A 20 ILE H 1.0 1.8 5.80 1121 979 A 20 ILE HG1x A 30 CYS HA 1.0 1.8 5.55 1122 980 A 20 ILE HD1% A 20 ILE H 1.0 1.8 5.51 1123 981 A 20 ILE HG2% A 20 ILE HG1x 1.0 1.8 5.20 1124 982 A 20 ILE HG2% A 5 ASN HBx 1.0 1.8 5.89 1125 983 A 21 GLY HAy A 20 ILE HA 1.0 1.8 5.47 1126 984 A 21 GLY H A 20 ILE HA 1.0 1.8 4.93 1127 985 A 21 GLY HAy A 21 GLY H 1.0 1.8 4.95 1128 986 A 29 CYS HBx A 21 GLY H 1.0 1.8 5.84 1129 987 A 29 CYS HBy A 21 GLY H 1.0 1.8 5.86 1130 988 A 21 GLY H A 20 ILE HB 1.0 1.8 5.58 1131 989 A 21 GLY HAx A 20 ILE HG1y 1.0 1.8 5.56 1132 990 A 21 GLY H A 20 ILE HG1y 1.0 1.8 5.72 1133 991 A 21 GLY H A 20 ILE HG1x 1.0 1.8 5.54 1134 992 A 20 ILE HG2% A 21 GLY H 1.0 1.8 5.91 1135 993 A 21 GLY HAx A 21 GLY HAy 1.0 1.8 4.78 1136 994 A 21 GLY HAx A 21 GLY H 1.0 1.8 5.08 1137 995 A 21 GLY H A 22 TYR HA 1.0 1.8 5.78 1138 996 A 21 GLY H A 30 CYS HA 1.0 1.8 5.78 1139 997 A 22 TYR HBx A 22 TYR H 1.0 1.8 5.91 1140 998 A 23 CYS HA A 22 TYR HBy 1.0 1.8 5.71 1141 999 A 22 TYR HA A 22 TYR HBy 1.0 1.8 5.47 1142 1000 A 22 TYR HA A 22 TYR HBx 1.0 1.8 5.00 1143 1001 A 22 TYR HBx A 28 LYS HA 1.0 1.8 5.57 1144 1002 A 21 GLY HAx A 22 TYR H 1.0 1.8 5.53 1145 1003 A 21 GLY HAy A 22 TYR H 1.0 1.8 5.59 1146 1004 A 23 CYS HA A 22 TYR H 1.0 1.8 5.50 1147 1005 A 22 TYR HA A 22 TYR H 1.0 1.8 5.55 1148 1006 A 22 TYR H A 22 TYR HBy 1.0 1.8 5.72 1149 1007 A 22 TYR HBy A 22 TYR HE% 1.0 1.8 5.40 1150 1008 A 22 TYR HA A 22 TYR HD2 1.0 1.8 5.02 1151 1009 A 22 TYR HA A 22 TYR HD1 1.0 1.8 5.02 1152 1010 A 22 TYR HA A 22 TYR HE% 1.0 1.8 5.69 1153 1011 A 28 LYS HA A 22 TYR HD2 1.0 1.8 5.15 1154 1012 A 28 LYS HA A 22 TYR HD1 1.0 1.8 5.15 1155 1013 A 22 TYR HE% A 26 GLY HAx 1.0 1.8 5.55 1156 1014 A 22 TYR HBx A 22 TYR HE% 1.0 1.8 5.32 1157 1015 A 22 TYR HBx A 22 TYR HD2 1.0 1.8 4.79 1158 1016 A 22 TYR HBx A 22 TYR HD1 1.0 1.8 4.79 1159 1017 A 22 TYR HBy A 22 TYR HD2 1.0 1.8 4.83 1160 1018 A 22 TYR HBy A 22 TYR HD1 1.0 1.8 4.83 1161 1019 A 22 TYR HD2 A 28 LYS HG2 1.0 1.8 5.55 1162 1020 A 22 TYR HD1 A 28 LYS HG2 1.0 1.8 5.55 1163 1021 A 22 TYR HE% A 28 LYS HG2 1.0 1.8 5.40 1164 1022 A 22 TYR H A 22 TYR HD1 1.0 1.8 5.81 1165 1023 A 22 TYR H A 22 TYR HD2 1.0 1.8 5.81 1166 1024 A 21 GLY HAy A 22 TYR HBy 1.0 1.8 5.83 1167 1025 A 22 TYR HBx A 22 TYR HBy 1.0 1.8 4.48 1168 1026 A 23 CYS H A 27 LYS H 1.0 1.8 5.71 1169 1027 A 29 CYS H A 23 CYS H 1.0 1.8 5.60 1170 1028 A 23 CYS HA A 23 CYS HBy 1.0 1.8 4.90 1171 1029 A 23 CYS HBx A 23 CYS H 1.0 1.8 4.99 1172 1030 A 23 CYS HBy A 23 CYS H 1.0 1.8 5.34 1173 1031 A 22 TYR HBx A 23 CYS H 1.0 1.8 5.12 1174 1032 A 23 CYS HA A 23 CYS H 1.0 1.8 5.26 1175 1033 A 22 TYR HA A 23 CYS H 1.0 1.8 4.70 1176 1034 A 22 TYR HBy A 23 CYS H 1.0 1.8 5.46 1177 1035 A 23 CYS HBx A 27 LYS HBx 1.0 1.8 5.39 1178 1036 A 9 CYS HBy A 23 CYS HBy 1.0 1.8 5.62 1179 1037 A 28 LYS H A 23 CYS HBy 1.0 1.8 5.72 1180 1038 A 22 TYR H A 23 CYS H 1.0 1.8 5.63 1181 1039 A 22 TYR HD1 A 23 CYS H 1.0 1.8 5.64 1182 1040 A 22 TYR HD2 A 23 CYS H 1.0 1.8 5.64 1183 1041 A 23 CYS HA A 23 CYS HBx 1.0 1.8 5.55 1184 1042 A 23 CYS HBx A 23 CYS HBy 1.0 1.8 4.51 1185 1043 A 24 ARG HDy A 24 ARG HA 1.0 1.8 5.16 1186 1044 A 24 ARG HA A 24 ARG HDx 1.0 1.8 5.60 1187 1045 A 24 ARG HDy A 24 ARG HBx 1.0 1.8 5.01 1188 1045 A 24 ARG HDy A 24 ARG HBy 1.0 1.8 5.01 1189 1046 A 25 ASN HA A 24 ARG HBx 1.0 1.8 5.37 1190 1046 A 24 ARG HBy A 25 ASN HA 1.0 1.8 5.37 1191 1047 A 26 GLY HAy A 25 ASN HBx 1.0 1.8 5.68 1192 1048 A 25 ASN HBx A 25 ASN HD22 1.0 1.8 5.84 1193 1049 A 25 ASN HA A 25 ASN HBy 1.0 1.8 5.62 1194 1050 A 24 ARG HA A 25 ASN HBy 1.0 1.8 5.79 1195 1051 A 25 ASN HA A 25 ASN HBx 1.0 1.8 4.91 1196 1052 A 26 GLY HAy A 25 ASN HBy 1.0 1.8 5.76 1197 1053 A 25 ASN HD22 A 25 ASN HD21 1.0 1.8 5.39 1198 1054 A 25 ASN HBx A 25 ASN HBy 1.0 1.8 4.48 1199 1055 A 25 ASN HBx A 27 LYS HEy 1.0 1.8 4.48 1200 1055 A 25 ASN HBx A 27 LYS HEx 1.0 1.8 4.48 1201 1056 A 27 LYS H A 26 GLY H 1.0 1.8 5.17 1202 1057 A 26 GLY HAx A 26 GLY H 1.0 1.8 5.14 1203 1058 A 25 ASN HA A 26 GLY H 1.0 1.8 5.42 1204 1059 A 26 GLY HAy A 26 GLY H 1.0 1.8 5.61 1205 1060 A 26 GLY H A 24 ARG H 1.0 1.8 5.72 1206 1061 A 26 GLY HAy A 26 GLY HAx 1.0 1.8 4.64 1207 1062 A 27 LYS H A 27 LYS HGy 1.0 1.8 5.56 1208 1063 A 27 LYS HBy A 27 LYS H 1.0 1.8 5.17 1209 1064 A 27 LYS H A 27 LYS HEy 1.0 1.8 5.35 1210 1064 A 27 LYS H A 27 LYS HEx 1.0 1.8 5.35 1211 1065 A 9 CYS HA A 27 LYS HBy 1.0 1.8 5.77 1212 1066 A 10 ARG HA A 27 LYS HGy 1.0 1.8 5.67 1213 1067 A 27 LYS HDx A 10 ARG HA 1.0 1.8 5.67 1214 1068 A 27 LYS HBy A 10 ARG HA 1.0 1.8 5.22 1215 1069 A 27 LYS HBx A 10 ARG HA 1.0 1.8 5.13 1216 1070 A 11 LYS HA A 27 LYS HGy 1.0 1.8 5.84 1217 1071 A 26 GLY HAx A 27 LYS H 1.0 1.8 5.41 1218 1072 A 26 GLY HAy A 27 LYS H 1.0 1.8 5.47 1219 1073 A 27 LYS HDx A 27 LYS H 1.0 1.8 5.14 1220 1074 A 27 LYS HDy A 27 LYS H 1.0 1.8 5.47 1221 1075 A 27 LYS HGx A 27 LYS H 1.0 1.8 5.76 1222 1076 A 27 LYS HBx A 27 LYS H 1.0 1.8 4.87 1223 1077 A 27 LYS HA A 27 LYS HDy 1.0 1.8 5.30 1224 1078 A 27 LYS HBx A 27 LYS HDy 1.0 1.8 5.35 1225 1079 A 27 LYS HGx A 23 CYS HBy 1.0 1.8 5.16 1226 1080 A 9 CYS HBy A 27 LYS HDx 1.0 1.8 5.66 1227 1081 A 27 LYS HGx A 27 LYS HDy 1.0 1.8 5.25 1228 1082 A 27 LYS HDy A 27 LYS HEy 1.0 1.8 5.83 1229 1082 A 27 LYS HDy A 27 LYS HEx 1.0 1.8 5.83 1230 1083 A 27 LYS HBy A 11 LYS HA 1.0 1.8 5.67 1231 1084 A 10 ARG H A 27 LYS HBy 1.0 1.8 5.42 1232 1085 A 27 LYS HBx A 11 LYS HA 1.0 1.8 5.65 1233 1086 A 27 LYS HA A 27 LYS H 1.0 1.8 5.49 1234 1087 A 27 LYS HBx A 27 LYS HA 1.0 1.8 5.37 1235 1088 A 27 LYS HBy A 27 LYS HA 1.0 1.8 5.09 1236 1089 A 27 LYS HDx A 27 LYS HEy 1.0 1.8 5.04 1237 1089 A 27 LYS HDx A 27 LYS HEx 1.0 1.8 5.04 1238 1090 A 27 LYS HGy A 27 LYS HEy 1.0 1.8 5.04 1239 1090 A 27 LYS HEx A 27 LYS HGy 1.0 1.8 5.04 1240 1091 A 27 LYS HGx A 27 LYS HEy 1.0 1.8 5.13 1241 1091 A 27 LYS HGx A 27 LYS HEx 1.0 1.8 5.13 1242 1092 A 27 LYS HBy A 27 LYS HDy 1.0 1.8 5.36 1243 1093 A 27 LYS HDx A 23 CYS HBy 1.0 1.8 5.39 1244 1094 A 27 LYS HDy A 27 LYS HGy 1.0 1.8 4.83 1245 1095 A 27 LYS HGx A 28 LYS H 1.0 1.8 5.76 1246 1096 A 25 ASN HA A 27 LYS HGy 1.0 1.8 5.56 1247 1097 A 27 LYS HGx A 25 ASN HA 1.0 1.8 5.64 1248 1098 A 26 GLY HAy A 27 LYS HEy 1.0 1.8 5.76 1249 1098 A 26 GLY HAy A 27 LYS HEx 1.0 1.8 5.76 1250 1099 A 23 CYS HBx A 27 LYS H 1.0 1.8 5.22 1251 1100 A 27 LYS H A 25 ASN HBy 1.0 1.8 5.24 1252 1101 A 27 LYS HDx A 27 LYS HDy 1.0 1.8 4.90 1253 1102 A 28 LYS H A 27 LYS H 1.0 1.8 5.90 1254 1103 A 10 ARG H A 28 LYS H 1.0 1.8 5.24 1255 1104 A 29 CYS HA A 28 LYS HBx 1.0 1.8 5.84 1256 1104 A 29 CYS HA A 28 LYS HBy 1.0 1.8 5.84 1257 1105 A 22 TYR HA A 28 LYS HA 1.0 1.8 5.30 1258 1106 A 10 ARG HA A 28 LYS H 1.0 1.8 5.75 1259 1107 A 9 CYS HA A 28 LYS H 1.0 1.8 5.34 1260 1108 A 28 LYS H A 28 LYS HD2 1.0 1.8 5.27 1261 1109 A 28 LYS H A 28 LYS HG2 1.0 1.8 5.62 1262 1110 A 28 LYS HA A 28 LYS HBx 1.0 1.8 5.64 1263 1110 A 28 LYS HA A 28 LYS HBy 1.0 1.8 5.64 1264 1111 A 27 LYS HBx A 28 LYS HA 1.0 1.8 5.64 1265 1112 A 28 LYS HD2 A 28 LYS HA 1.0 1.8 4.78 1266 1113 A 28 LYS HA A 28 LYS HG2 1.0 1.8 5.40 1267 1114 A 28 LYS HG2 A 28 LYS HE2 1.0 1.8 5.66 1268 1115 A 28 LYS HD2 A 28 LYS HE2 1.0 1.8 5.70 1269 1116 A 28 LYS HA A 23 CYS H 1.0 1.8 5.24 1270 1117 A 28 LYS H A 27 LYS HA 1.0 1.8 4.78 1271 1118 A 28 LYS H A 28 LYS HA 1.0 1.8 5.15 1272 1119 A 28 LYS H A 11 LYS HA 1.0 1.8 5.47 1273 1120 A 28 LYS H A 28 LYS HBx 1.0 1.8 4.84 1274 1120 A 28 LYS H A 28 LYS HBy 1.0 1.8 4.84 1275 1121 A 27 LYS HBx A 28 LYS H 1.0 1.8 4.84 1276 1122 A 28 LYS HG2 A 28 LYS HBx 1.0 1.8 5.43 1277 1122 A 28 LYS HG2 A 28 LYS HBy 1.0 1.8 5.43 1278 1123 A 28 LYS HD2 A 28 LYS HG2 1.0 1.8 4.87 1279 1124 A 27 LYS HBy A 28 LYS H 1.0 1.8 4.93 1280 1125 A 21 GLY HAy A 28 LYS HBx 1.0 1.8 5.36 1281 1125 A 21 GLY HAy A 28 LYS HBy 1.0 1.8 5.36 1282 1126 A 28 LYS H A 27 LYS HDy 1.0 1.8 5.80 1283 1127 A 29 CYS HBy A 20 ILE H 1.0 1.8 5.77 1284 1128 A 21 GLY H A 29 CYS H 1.0 1.8 5.51 1285 1129 A 28 LYS H A 29 CYS H 1.0 1.8 5.66 1286 1130 A 21 GLY HAx A 29 CYS HBx 1.0 1.8 5.37 1287 1131 A 29 CYS HBx A 29 CYS HA 1.0 1.8 5.13 1288 1132 A 29 CYS HBy A 29 CYS HA 1.0 1.8 5.17 1289 1133 A 29 CYS H A 28 LYS HA 1.0 1.8 4.71 1290 1134 A 21 GLY HAx A 29 CYS H 1.0 1.8 5.60 1291 1135 A 29 CYS HA A 29 CYS H 1.0 1.8 5.24 1292 1136 A 29 CYS H A 22 TYR HA 1.0 1.8 5.06 1293 1137 A 29 CYS H A 28 LYS HBx 1.0 1.8 5.59 1294 1137 A 29 CYS H A 28 LYS HBy 1.0 1.8 5.59 1295 1138 A 29 CYS HBy A 29 CYS H 1.0 1.8 5.05 1296 1139 A 29 CYS HBx A 29 CYS H 1.0 1.8 5.02 1297 1140 A 29 CYS HBy A 20 ILE HG2% 1.0 1.8 5.83 1298 1141 A 29 CYS HBy A 20 ILE HG1x 1.0 1.8 5.48 1299 1142 A 29 CYS HBx A 20 ILE HG2% 1.0 1.8 5.80 1300 1143 A 29 CYS HBx A 20 ILE HG1x 1.0 1.8 5.79 1301 1144 A 28 LYS HD2 A 29 CYS H 1.0 1.8 5.39 1302 1145 A 4 TRP HBx A 29 CYS HBy 1.0 1.8 5.78 1303 1146 A 3 CYS HA A 29 CYS H 1.0 1.8 5.65 1304 1147 A 29 CYS HBx A 20 ILE HG1y 1.0 1.8 5.75 1305 1148 A 32 ASN H A 30 CYS HBy 1.0 1.8 5.43 1306 1149 A 30 CYS HBy A 18 LYS H 1.0 1.8 5.58 1307 1150 A 30 CYS H A 29 CYS H 1.0 1.8 5.87 1308 1151 A 30 CYS HBy A 32 ASN HA 1.0 1.8 5.68 1309 1152 A 30 CYS HBx A 30 CYS HA 1.0 1.8 5.00 1310 1153 A 30 CYS H A 9 CYS HA 1.0 1.8 5.39 1311 1154 A 30 CYS H A 30 CYS HA 1.0 1.8 5.21 1312 1155 A 30 CYS H A 19 PRO HA 1.0 1.8 5.81 1313 1156 A 30 CYS H A 29 CYS HA 1.0 1.8 4.67 1314 1157 A 29 CYS HBy A 30 CYS H 1.0 1.8 5.71 1315 1158 A 29 CYS HBx A 30 CYS H 1.0 1.8 5.90 1316 1159 A 30 CYS H A 30 CYS HBx 1.0 1.8 5.18 1317 1160 A 30 CYS H A 30 CYS HBy 1.0 1.8 4.92 1318 1161 A 30 CYS HBy A 17 GLU HBx 1.0 1.8 5.50 1319 1162 A 30 CYS HBx A 17 GLU HBy 1.0 1.8 5.48 1320 1163 A 30 CYS HBx A 17 GLU HBx 1.0 1.8 5.48 1321 1164 A 8 ARG HA A 30 CYS H 1.0 1.8 5.36 1322 1165 A 30 CYS H A 13 CYS HA 1.0 1.8 5.51 1323 1166 A 8 ARG H A 30 CYS HBy 1.0 1.8 5.89 1324 1167 A 13 CYS HA A 30 CYS HBx 1.0 1.8 5.54 1325 1168 A 13 CYS HA A 30 CYS HBy 1.0 1.8 5.02 1326 1169 A 17 GLU HA A 30 CYS HBy 1.0 1.8 5.02 1327 1170 A 30 CYS HBy A 30 CYS HA 1.0 1.8 5.54 1328 1171 A 29 CYS HA A 30 CYS HBx 1.0 1.8 5.65 1329 1172 A 8 ARG HGx A 30 CYS HBy 1.0 1.8 5.04 1330 1173 A 17 GLU HGy A 30 CYS HBy 1.0 1.8 5.04 1331 1174 A 14 LYS HBy A 30 CYS HBx 1.0 1.8 5.61 1332 1175 A 13 CYS HBx A 30 CYS HBy 1.0 1.8 4.61 1333 1176 A 32 ASN H A 31 VAL H 1.0 1.8 5.87 1334 1177 A 20 ILE H A 31 VAL H 1.0 1.8 5.80 1335 1178 A 30 CYS H A 31 VAL H 1.0 1.8 5.89 1336 1179 A 31 VAL HA A 31 VAL HB 1.0 1.8 5.05 1337 1180 A 31 VAL HA A 31 VAL H 1.0 1.8 5.17 1338 1181 A 19 PRO HA A 31 VAL H 1.0 1.8 5.40 1339 1182 A 30 CYS HBx A 31 VAL H 1.0 1.8 5.46 1340 1183 A 30 CYS HBy A 31 VAL H 1.0 1.8 5.73 1341 1184 A 31 VAL HB A 31 VAL H 1.0 1.8 5.17 1342 1185 A 17 GLU HBy A 31 VAL H 1.0 1.8 5.17 1343 1186 A 4 TRP HBx A 31 VAL HB 1.0 1.8 4.95 1344 1187 A 20 ILE HD1% A 31 VAL HB 1.0 1.8 5.79 1345 1188 A 31 VAL HGx% A 31 VAL H 1.0 1.8 5.45 1346 1189 A 31 VAL HGy% A 31 VAL H 1.0 1.8 5.45 1347 1190 A 20 ILE HG2% A 31 VAL H 1.0 1.8 5.82 1348 1191 A 4 TRP HA A 31 VAL HGy% 1.0 1.8 5.18 1349 1192 A 31 VAL HGx% A 31 VAL HA 1.0 1.8 5.18 1350 1193 A 30 CYS HA A 31 VAL H 1.0 1.8 4.63 1351 1194 A 31 VAL HGy% A 31 VAL HB 1.0 1.8 4.64 1352 1195 A 31 VAL HGx% A 31 VAL HB 1.0 1.8 4.64 1353 1196 A 31 VAL HGy% A 20 ILE HD1% 1.0 1.8 5.04 1354 1197 A 31 VAL HGx% A 20 ILE HD1% 1.0 1.8 5.04 1355 1198 A 31 VAL HGx% A 5 ASN HBy 1.0 1.8 5.81 1356 1199 A 31 VAL HGy% A 31 VAL HA 1.0 1.8 4.97 1357 1200 A 31 VAL HGy% A 20 ILE H 1.0 1.8 5.55 1358 1201 A 31 VAL HGy% A 30 CYS HA 1.0 1.8 5.55 1359 1202 A 31 VAL HGy% A 20 ILE HG2% 1.0 1.8 5.20 1360 1203 A 31 VAL HGx% A 20 ILE HG2% 1.0 1.8 5.20 1361 1204 A 32 ASN H A 18 LYS H 1.0 1.8 5.71 1362 1205 A 17 GLU HA A 32 ASN HD21 1.0 1.8 5.80 1363 1206 A 32 ASN HA A 32 ASN HD21 1.0 1.8 5.67 1364 1207 A 32 ASN HA A 32 ASN HD22 1.0 1.8 5.50 1365 1208 A 31 VAL HA A 32 ASN H 1.0 1.8 4.67 1366 1209 A 32 ASN H A 17 GLU HA 1.0 1.8 5.45 1367 1210 A 31 VAL HB A 32 ASN H 1.0 1.8 4.91 1368 1211 A 32 ASN H A 17 GLU HBy 1.0 1.8 4.91 1369 1212 A 32 ASN HD22 A 32 ASN HBx 1.0 1.8 5.92 1370 1213 A 32 ASN HD22 A 32 ASN HBy 1.0 1.8 5.91 1371 1214 A 32 ASN HD21 A 32 ASN HBx 1.0 1.8 5.81 1372 1215 A 32 ASN HD21 A 32 ASN HBy 1.0 1.8 5.33 1373 1216 A 17 GLU HGy A 32 ASN HD21 1.0 1.8 5.38 1374 1217 A 31 VAL HGx% A 32 ASN H 1.0 1.8 5.23 1375 1218 A 31 VAL HGy% A 32 ASN H 1.0 1.8 5.23 1376 1219 A 32 ASN H A 32 ASN HBy 1.0 1.8 5.44 1377 1220 A 32 ASN H A 32 ASN HBx 1.0 1.8 5.44 1378 1221 A 32 ASN HA A 32 ASN HBx 1.0 1.8 5.19 1379 1222 A 17 GLU HA A 32 ASN HBx 1.0 1.8 5.02 1380 1223 A 32 ASN HA A 32 ASN HBy 1.0 1.8 5.16 1381 1224 A 31 VAL HA A 32 ASN HBy 1.0 1.8 5.16 1382 1225 A 17 GLU HGx A 32 ASN HD22 1.0 1.8 5.20 1383 1226 A 5 ASN HBy A 32 ASN HBx 1.0 1.8 5.85 1384 1227 A 17 GLU HGx A 32 ASN HBy 1.0 1.8 5.72 1385 1228 A 17 GLU HGx A 32 ASN HBx 1.0 1.8 5.82 1386 1229 A 17 GLU HGy A 32 ASN HBx 1.0 1.8 5.04 1387 1230 A 32 ASN HD22 A 15 GLU HBx 1.0 1.8 5.45 1388 1230 A 15 GLU HBy A 32 ASN HD22 1.0 1.8 5.45 stop_ save_