data_nef_c34000_5l3l save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 34001 BMRB 34002 PDB 5L3L 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 9 CYS SG 1 47 CYS SG 1 21 CYS SG 1 60 CYS SG 1 46 CYS SG 1 51 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 ALA start . . 2 A 2 TYR middle . . 3 A 3 ARG middle . . 4 A 4 PRO middle . false 5 A 5 SER middle . . 6 A 6 GLU middle . . 7 A 7 THR middle . . 8 A 8 LEU middle . . 9 A 9 CYS middle -HG . 10 A 10 GLY middle . false 11 A 11 GLY middle . false 12 A 12 GLU middle . . 13 A 13 LEU middle . . 14 A 14 VAL middle . . 15 A 15 ASP middle . . 16 A 16 THR middle . . 17 A 17 LEU middle . . 18 A 18 GLN middle . . 19 A 19 PHE middle . . 20 A 20 VAL middle . . 21 A 21 CYS middle -HG . 22 A 22 GLY middle . false 23 A 23 ASP middle . . 24 A 24 ARG middle . . 25 A 25 GLY middle . false 26 A 26 PHE middle . . 27 A 27 TYR middle . . 28 A 28 PHE middle . . 29 A 29 SER middle . . 30 A 30 ARG middle . . 31 A 31 PRO middle . false 32 A 32 ALA middle . . 33 A 33 SER middle . . 34 A 34 ARG middle . . 35 A 35 VAL middle . . 36 A 36 SER middle . . 37 A 37 ARG middle . . 38 A 38 ARG middle . . 39 A 39 SER middle . . 40 A 40 ARG middle . . 41 A 41 GLY middle . false 42 A 42 ILE middle . . 43 A 43 VAL middle . . 44 A 44 GLU middle . . 45 A 45 GLU middle . . 46 A 46 CYS middle -HG . 47 A 47 CYS middle -HG . 48 A 48 PHE middle . . 49 A 49 ARG middle . . 50 A 50 SER middle . . 51 A 51 CYS middle -HG . 52 A 52 ASP middle . . 53 A 53 LEU middle . . 54 A 54 ALA middle . . 55 A 55 LEU middle . . 56 A 56 LEU middle . . 57 A 57 GLU middle . . 58 A 58 THR middle . . 59 A 59 TYR middle . . 60 A 60 CYS middle -HG . 61 A 61 ALA middle . . 62 A 62 THR middle . . 63 A 63 PRO middle . false 64 A 64 ALA middle . . 65 A 65 LYS middle . . 66 A 66 SER middle . . 67 A 67 GLU 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 1 ALA H H 1 8.595 0.020 A 1 ALA HA H 1 4.440 0.020 A 1 ALA HB% H 1 1.432 0.020 A 1 ALA CA C 13 52.531 0.200 A 1 ALA CB C 13 19.563 0.200 A 1 ALA N N 15 123.720 0.200 A 2 TYR H H 1 8.382 0.020 A 2 TYR HA H 1 4.654 0.020 A 2 TYR HBy H 1 3.110 0.020 A 2 TYR HBx H 1 3.042 0.020 A 2 TYR HDx H 1 7.211 0.020 A 2 TYR HDy H 1 7.211 0.020 A 2 TYR HEx H 1 6.926 0.020 A 2 TYR HEy H 1 6.926 0.020 A 2 TYR CB C 13 39.047 0.200 A 2 TYR CDx C 13 133.287 0.200 A 2 TYR CEx C 13 118.306 0.200 A 2 TYR N N 15 120.589 0.200 A 3 ARG H H 1 8.210 0.020 A 3 ARG HA H 1 4.672 0.020 A 3 ARG HBy H 1 1.873 0.020 A 3 ARG HBx H 1 1.743 0.020 A 3 ARG HDx H 1 3.282 0.020 A 3 ARG HDy H 1 3.282 0.020 A 3 ARG HE H 1 7.264 0.020 A 3 ARG HGx H 1 1.676 0.020 A 3 ARG HGy H 1 1.676 0.020 A 3 ARG CB C 13 30.894 0.200 A 3 ARG CG C 13 26.826 0.200 A 3 ARG N N 15 125.712 0.200 A 3 ARG NE N 15 85.204 0.200 A 4 PRO HA H 1 4.468 0.020 A 4 PRO HBy H 1 2.426 0.020 A 4 PRO HBx H 1 2.057 0.020 A 4 PRO HDy H 1 3.691 0.020 A 4 PRO HDx H 1 3.637 0.020 A 4 PRO HGy H 1 2.108 0.020 A 4 PRO HGx H 1 2.083 0.020 A 4 PRO CB C 13 32.180 0.200 A 4 PRO CD C 13 50.688 0.200 A 4 PRO CG C 13 27.373 0.200 A 5 SER H H 1 8.316 0.020 A 5 SER HA H 1 4.540 0.020 A 5 SER HBx H 1 4.016 0.020 A 5 SER HBy H 1 4.016 0.020 A 5 SER CB C 13 63.986 0.200 A 5 SER N N 15 115.341 0.200 A 6 GLU H H 1 8.577 0.020 A 6 GLU HA H 1 4.571 0.020 A 6 GLU HBy H 1 2.251 0.020 A 6 GLU HBx H 1 2.116 0.020 A 6 GLU HGx H 1 2.445 0.020 A 6 GLU HGy H 1 2.445 0.020 A 6 GLU CB C 13 29.757 0.200 A 6 GLU CG C 13 34.793 0.200 A 6 GLU N N 15 122.320 0.200 A 7 THR H H 1 8.030 0.020 A 7 THR HA H 1 4.636 0.020 A 7 THR HB H 1 4.633 0.020 A 7 THR HG2% H 1 1.047 0.020 A 7 THR CG2 C 13 22.521 0.200 A 7 THR N N 15 113.924 0.200 A 8 LEU H H 1 8.730 0.020 A 8 LEU HA H 1 4.726 0.020 A 8 LEU HBy H 1 1.679 0.020 A 8 LEU HBx H 1 1.425 0.020 A 8 LEU HDx% H 1 0.955 0.020 A 8 LEU HDy% H 1 0.924 0.020 A 8 LEU HG H 1 1.278 0.020 A 8 LEU CB C 13 44.980 0.200 A 8 LEU CDx C 13 24.264 0.200 A 8 LEU CDy C 13 26.395 0.200 A 8 LEU CG C 13 26.835 0.200 A 8 LEU N N 15 124.961 0.200 A 9 CYS H H 1 8.516 0.020 A 9 CYS HA H 1 5.025 0.020 A 9 CYS HBy H 1 3.299 0.020 A 9 CYS HBx H 1 2.957 0.020 A 9 CYS CB C 13 48.559 0.200 A 9 CYS N N 15 119.519 0.200 A 10 GLY H H 1 9.135 0.020 A 10 GLY HAy H 1 4.019 0.020 A 10 GLY HAx H 1 3.925 0.020 A 10 GLY CA C 13 47.065 0.200 A 10 GLY N N 15 109.292 0.200 A 11 GLY H H 1 9.059 0.020 A 11 GLY HAy H 1 3.951 0.020 A 11 GLY HAx H 1 3.833 0.020 A 11 GLY CA C 13 47.420 0.200 A 11 GLY N N 15 113.677 0.200 A 12 GLU H H 1 8.843 0.020 A 12 GLU HA H 1 4.174 0.020 A 12 GLU HBy H 1 2.381 0.020 A 12 GLU HBx H 1 2.082 0.020 A 12 GLU HGy H 1 2.715 0.020 A 12 GLU HGx H 1 2.593 0.020 A 12 GLU CA C 13 60.178 0.200 A 12 GLU CB C 13 29.096 0.200 A 12 GLU CG C 13 36.292 0.200 A 12 GLU N N 15 121.798 0.200 A 13 LEU H H 1 7.218 0.020 A 13 LEU HA H 1 3.909 0.020 A 13 LEU HBy H 1 2.190 0.020 A 13 LEU HBx H 1 1.155 0.020 A 13 LEU HDx% H 1 0.963 0.020 A 13 LEU HDy% H 1 0.759 0.020 A 13 LEU HG H 1 1.395 0.020 A 13 LEU CA C 13 58.395 0.200 A 13 LEU CB C 13 40.246 0.200 A 13 LEU CDy C 13 25.798 0.200 A 13 LEU CDx C 13 22.670 0.200 A 13 LEU CG C 13 27.503 0.200 A 13 LEU N N 15 124.052 0.200 A 14 VAL H H 1 7.568 0.020 A 14 VAL HA H 1 3.462 0.020 A 14 VAL HB H 1 2.268 0.020 A 14 VAL HGx% H 1 1.246 0.020 A 14 VAL HGy% H 1 1.226 0.020 A 14 VAL CA C 13 67.599 0.200 A 14 VAL CB C 13 31.703 0.200 A 14 VAL CGy C 13 23.011 0.200 A 14 VAL CGx C 13 21.627 0.200 A 14 VAL N N 15 118.963 0.200 A 15 ASP H H 1 8.745 0.020 A 15 ASP HA H 1 4.666 0.020 A 15 ASP HBy H 1 3.018 0.020 A 15 ASP HBx H 1 2.659 0.020 A 15 ASP CB C 13 42.053 0.200 A 15 ASP N N 15 118.243 0.200 A 16 THR H H 1 7.986 0.020 A 16 THR HA H 1 4.092 0.020 A 16 THR HB H 1 4.329 0.020 A 16 THR HG1 H 1 5.166 0.020 A 16 THR HG2% H 1 1.332 0.020 A 16 THR CA C 13 68.410 0.200 A 16 THR CB C 13 68.006 0.200 A 16 THR CG2 C 13 21.694 0.200 A 16 THR N N 15 116.896 0.200 A 17 LEU H H 1 8.331 0.020 A 17 LEU HA H 1 3.739 0.020 A 17 LEU HBy H 1 1.158 0.020 A 17 LEU HBx H 1 0.234 0.020 A 17 LEU HDx% H 1 0.430 0.020 A 17 LEU HDy% H 1 0.580 0.020 A 17 LEU HG H 1 1.133 0.020 A 17 LEU CA C 13 58.760 0.200 A 17 LEU CB C 13 41.340 0.200 A 17 LEU CDy C 13 25.533 0.200 A 17 LEU CDx C 13 23.962 0.200 A 17 LEU CG C 13 27.182 0.200 A 17 LEU N N 15 124.667 0.200 A 18 GLN H H 1 8.322 0.020 A 18 GLN HA H 1 4.322 0.020 A 18 GLN HBy H 1 2.510 0.020 A 18 GLN HBx H 1 2.449 0.020 A 18 GLN HE2y H 1 7.430 0.020 A 18 GLN HE2x H 1 7.084 0.020 A 18 GLN HGy H 1 2.885 0.020 A 18 GLN HGx H 1 2.702 0.020 A 18 GLN CA C 13 59.111 0.200 A 18 GLN CB C 13 28.705 0.200 A 18 GLN CG C 13 34.934 0.200 A 18 GLN N N 15 116.695 0.200 A 18 GLN NE2 N 15 111.170 0.200 A 19 PHE H H 1 7.788 0.020 A 19 PHE HA H 1 3.979 0.020 A 19 PHE HBy H 1 2.708 0.020 A 19 PHE HBx H 1 2.398 0.020 A 19 PHE HDx H 1 5.717 0.020 A 19 PHE HDy H 1 5.717 0.020 A 19 PHE HEx H 1 6.517 0.020 A 19 PHE HEy H 1 6.517 0.020 A 19 PHE HZ H 1 6.635 0.020 A 19 PHE CA C 13 59.500 0.200 A 19 PHE CB C 13 40.745 0.200 A 19 PHE CDx C 13 131.098 0.200 A 19 PHE CEx C 13 129.117 0.200 A 19 PHE CZ C 13 127.636 0.200 A 19 PHE N N 15 119.933 0.200 A 20 VAL H H 1 8.673 0.020 A 20 VAL HA H 1 3.261 0.020 A 20 VAL HB H 1 1.977 0.020 A 20 VAL HGx% H 1 1.072 0.020 A 20 VAL HGy% H 1 0.895 0.020 A 20 VAL CA C 13 65.638 0.200 A 20 VAL CB C 13 32.098 0.200 A 20 VAL CGy C 13 24.117 0.200 A 20 VAL CGx C 13 21.175 0.200 A 20 VAL N N 15 117.857 0.200 A 21 CYS H H 1 8.560 0.020 A 21 CYS HA H 1 4.884 0.020 A 21 CYS HBy H 1 3.452 0.020 A 21 CYS HBx H 1 2.984 0.020 A 21 CYS CB C 13 36.424 0.200 A 21 CYS N N 15 114.616 0.200 A 22 GLY H H 1 7.950 0.020 A 22 GLY HAy H 1 4.264 0.020 A 22 GLY HAx H 1 4.022 0.020 A 22 GLY CA C 13 47.158 0.200 A 22 GLY N N 15 110.353 0.200 A 23 ASP H H 1 9.420 0.020 A 23 ASP HA H 1 4.811 0.020 A 23 ASP HBy H 1 3.046 0.020 A 23 ASP HBx H 1 2.644 0.020 A 23 ASP CB C 13 41.196 0.200 A 23 ASP N N 15 126.511 0.200 A 24 ARG H H 1 8.327 0.020 A 24 ARG HA H 1 4.141 0.020 A 24 ARG HBy H 1 2.292 0.020 A 24 ARG HBx H 1 2.240 0.020 A 24 ARG HDx H 1 3.479 0.020 A 24 ARG HDy H 1 3.479 0.020 A 24 ARG HE H 1 7.034 0.020 A 24 ARG HGy H 1 2.051 0.020 A 24 ARG HGx H 1 1.861 0.020 A 24 ARG CA C 13 58.764 0.200 A 24 ARG CB C 13 31.683 0.200 A 24 ARG CD C 13 44.814 0.200 A 24 ARG CG C 13 27.280 0.200 A 24 ARG N N 15 118.413 0.200 A 24 ARG NE N 15 83.888 0.200 A 25 GLY H H 1 7.293 0.020 A 25 GLY HAy H 1 4.195 0.020 A 25 GLY HAx H 1 3.855 0.020 A 25 GLY CA C 13 44.323 0.200 A 25 GLY N N 15 102.232 0.200 A 26 PHE H H 1 7.618 0.020 A 26 PHE HA H 1 5.355 0.020 A 26 PHE HBy H 1 3.434 0.020 A 26 PHE HBx H 1 2.948 0.020 A 26 PHE HDx H 1 6.732 0.020 A 26 PHE HDy H 1 6.732 0.020 A 26 PHE HEx H 1 7.092 0.020 A 26 PHE HEy H 1 7.092 0.020 A 26 PHE HZ H 1 7.342 0.020 A 26 PHE CA C 13 56.178 0.200 A 26 PHE CB C 13 42.496 0.200 A 26 PHE CDx C 13 132.798 0.200 A 26 PHE CEx C 13 131.115 0.200 A 26 PHE CZ C 13 129.658 0.200 A 26 PHE N N 15 112.587 0.200 A 27 TYR H H 1 8.820 0.020 A 27 TYR HA H 1 5.062 0.020 A 27 TYR HBy H 1 3.589 0.020 A 27 TYR HBx H 1 3.104 0.020 A 27 TYR HDx H 1 7.244 0.020 A 27 TYR HDy H 1 7.244 0.020 A 27 TYR HEx H 1 6.913 0.020 A 27 TYR HEy H 1 6.913 0.020 A 27 TYR CB C 13 41.739 0.200 A 27 TYR CDx C 13 133.347 0.200 A 27 TYR CEx C 13 118.198 0.200 A 27 TYR N N 15 118.781 0.200 A 28 PHE H H 1 8.917 0.020 A 28 PHE HA H 1 4.939 0.020 A 28 PHE HBy H 1 3.433 0.020 A 28 PHE HBx H 1 3.219 0.020 A 28 PHE HDx H 1 7.409 0.020 A 28 PHE HDy H 1 7.409 0.020 A 28 PHE HEx H 1 7.378 0.020 A 28 PHE HEy H 1 7.378 0.020 A 28 PHE HZ H 1 7.437 0.020 A 28 PHE CB C 13 40.526 0.200 A 28 PHE CDx C 13 131.421 0.200 A 28 PHE CEx C 13 131.344 0.200 A 28 PHE CZ C 13 129.747 0.200 A 28 PHE N N 15 115.565 0.200 A 29 SER H H 1 8.143 0.020 A 29 SER HA H 1 5.236 0.020 A 29 SER HBy H 1 4.043 0.020 A 29 SER HBx H 1 3.999 0.020 A 29 SER CB C 13 65.148 0.200 A 29 SER N N 15 113.604 0.200 A 30 ARG H H 1 8.766 0.020 A 30 ARG HA H 1 4.654 0.020 A 30 ARG HBy H 1 1.850 0.020 A 30 ARG HBx H 1 1.671 0.020 A 30 ARG HDy H 1 3.004 0.020 A 30 ARG HDx H 1 2.962 0.020 A 30 ARG HE H 1 6.897 0.020 A 30 ARG HGx H 1 1.512 0.020 A 30 ARG HGy H 1 1.512 0.020 A 30 ARG CB C 13 30.676 0.200 A 30 ARG CD C 13 43.517 0.200 A 30 ARG CG C 13 26.789 0.200 A 30 ARG N N 15 122.371 0.200 A 30 ARG NE N 15 84.305 0.200 A 31 PRO HA H 1 4.368 0.020 A 31 PRO HBy H 1 2.233 0.020 A 31 PRO HBx H 1 1.931 0.020 A 31 PRO HDx H 1 3.530 0.020 A 31 PRO HDy H 1 3.622 0.020 A 31 PRO HGy H 1 2.029 0.020 A 31 PRO HGx H 1 1.908 0.020 A 31 PRO CA C 13 63.038 0.200 A 31 PRO CB C 13 32.153 0.200 A 31 PRO CD C 13 50.487 0.200 A 31 PRO CG C 13 27.477 0.200 A 32 ALA H H 1 8.484 0.020 A 32 ALA HA H 1 4.292 0.020 A 32 ALA HB% H 1 1.470 0.020 A 32 ALA CA C 13 53.061 0.200 A 32 ALA CB C 13 19.655 0.200 A 32 ALA N N 15 123.890 0.200 A 33 SER H H 1 8.316 0.020 A 33 SER HA H 1 4.637 0.020 A 33 SER HBy H 1 4.120 0.020 A 33 SER HBx H 1 3.945 0.020 A 33 SER CB C 13 64.674 0.200 A 33 SER N N 15 114.090 0.200 A 34 ARG H H 1 8.520 0.020 A 34 ARG HA H 1 4.356 0.020 A 34 ARG HBy H 1 2.008 0.020 A 34 ARG HBx H 1 1.927 0.020 A 34 ARG HDx H 1 3.306 0.020 A 34 ARG HDy H 1 3.306 0.020 A 34 ARG HE H 1 7.346 0.020 A 34 ARG HGx H 1 1.751 0.020 A 34 ARG HGy H 1 1.751 0.020 A 34 ARG CA C 13 57.520 0.200 A 34 ARG CB C 13 30.407 0.200 A 34 ARG CD C 13 43.417 0.200 A 34 ARG CG C 13 27.312 0.200 A 34 ARG N N 15 120.702 0.200 A 34 ARG NE N 15 84.822 0.200 A 35 VAL H H 1 7.902 0.020 A 35 VAL HA H 1 4.294 0.020 A 35 VAL HB H 1 2.255 0.020 A 35 VAL HGx% H 1 1.005 0.020 A 35 VAL HGy% H 1 0.980 0.020 A 35 VAL CA C 13 62.402 0.200 A 35 VAL CB C 13 32.561 0.200 A 35 VAL CGy C 13 21.325 0.200 A 35 VAL CGx C 13 20.187 0.200 A 35 VAL N N 15 115.422 0.200 A 36 SER H H 1 7.970 0.020 A 36 SER HA H 1 4.606 0.020 A 36 SER HBy H 1 3.967 0.020 A 36 SER HBx H 1 3.941 0.020 A 36 SER CB C 13 64.211 0.200 A 36 SER N N 15 117.245 0.200 A 37 ARG H H 1 8.428 0.020 A 37 ARG HA H 1 4.429 0.020 A 37 ARG HBy H 1 2.040 0.020 A 37 ARG HBx H 1 1.901 0.020 A 37 ARG HDx H 1 3.300 0.020 A 37 ARG HDy H 1 3.300 0.020 A 37 ARG HGx H 1 1.748 0.020 A 37 ARG HGy H 1 1.748 0.020 A 37 ARG CA C 13 56.710 0.200 A 37 ARG CB C 13 30.432 0.200 A 37 ARG CD C 13 43.495 0.200 A 37 ARG CG C 13 27.264 0.200 A 37 ARG N N 15 122.100 0.200 A 38 ARG H H 1 8.239 0.020 A 38 ARG HA H 1 4.513 0.020 A 38 ARG HBy H 1 1.970 0.020 A 38 ARG HBx H 1 1.854 0.020 A 38 ARG HDx H 1 3.302 0.020 A 38 ARG HDy H 1 3.302 0.020 A 38 ARG HE H 1 7.304 0.020 A 38 ARG HGx H 1 1.733 0.020 A 38 ARG HGy H 1 1.733 0.020 A 38 ARG CB C 13 31.085 0.200 A 38 ARG CD C 13 43.398 0.200 A 38 ARG CG C 13 27.209 0.200 A 38 ARG N N 15 120.102 0.200 A 38 ARG NE N 15 84.747 0.200 A 39 SER H H 1 8.447 0.020 A 39 SER HA H 1 4.647 0.020 A 39 SER HBx H 1 3.966 0.020 A 39 SER HBy H 1 3.966 0.020 A 39 SER CB C 13 64.547 0.200 A 39 SER N N 15 118.088 0.200 A 40 ARG H H 1 8.740 0.020 A 40 ARG HA H 1 4.663 0.020 A 40 ARG HBy H 1 2.034 0.020 A 40 ARG HBx H 1 1.861 0.020 A 40 ARG HDx H 1 3.262 0.020 A 40 ARG HDy H 1 3.262 0.020 A 40 ARG HE H 1 7.564 0.020 A 40 ARG HGx H 1 1.772 0.020 A 40 ARG HGy H 1 1.772 0.020 A 40 ARG CB C 13 32.194 0.200 A 40 ARG CD C 13 43.599 0.200 A 40 ARG CG C 13 27.274 0.200 A 40 ARG N N 15 122.596 0.200 A 40 ARG NE N 15 84.938 0.200 A 41 GLY H H 1 8.659 0.020 A 41 GLY HAy H 1 4.704 0.020 A 41 GLY HAx H 1 4.304 0.020 A 41 GLY CA C 13 45.338 0.200 A 41 GLY N N 15 111.262 0.200 A 42 ILE H H 1 8.009 0.020 A 42 ILE HA H 1 3.676 0.020 A 42 ILE HB H 1 0.637 0.020 A 42 ILE HD1% H 1 0.521 0.020 A 42 ILE HG1y H 1 1.051 0.020 A 42 ILE HG1x H 1 0.901 0.020 A 42 ILE HG2% H 1 0.837 0.020 A 42 ILE CA C 13 63.061 0.200 A 42 ILE CB C 13 37.245 0.200 A 42 ILE CD1 C 13 15.435 0.200 A 42 ILE CG1 C 13 29.719 0.200 A 42 ILE CG2 C 13 18.225 0.200 A 42 ILE N N 15 121.410 0.200 A 43 VAL H H 1 8.317 0.020 A 43 VAL HA H 1 3.491 0.020 A 43 VAL HB H 1 1.957 0.020 A 43 VAL HGx% H 1 1.042 0.020 A 43 VAL HGy% H 1 0.667 0.020 A 43 VAL CA C 13 66.685 0.200 A 43 VAL CB C 13 31.260 0.200 A 43 VAL CGy C 13 22.985 0.200 A 43 VAL CGx C 13 21.462 0.200 A 43 VAL N N 15 123.909 0.200 A 44 GLU H H 1 8.109 0.020 A 44 GLU HA H 1 3.984 0.020 A 44 GLU HBy H 1 2.338 0.020 A 44 GLU HBx H 1 2.168 0.020 A 44 GLU HGy H 1 2.525 0.020 A 44 GLU HGx H 1 2.415 0.020 A 44 GLU CA C 13 60.210 0.200 A 44 GLU CB C 13 29.298 0.200 A 44 GLU CG C 13 37.037 0.200 A 44 GLU N N 15 121.323 0.200 A 45 GLU H H 1 7.563 0.020 A 45 GLU HA H 1 4.337 0.020 A 45 GLU HBy H 1 2.191 0.020 A 45 GLU HBx H 1 2.009 0.020 A 45 GLU HGy H 1 2.625 0.020 A 45 GLU HGx H 1 2.336 0.020 A 45 GLU CA C 13 58.786 0.200 A 45 GLU CB C 13 31.536 0.200 A 45 GLU CG C 13 36.454 0.200 A 45 GLU N N 15 113.330 0.200 A 46 CYS H H 1 8.207 0.020 A 46 CYS HA H 1 5.160 0.020 A 46 CYS HBy H 1 3.243 0.020 A 46 CYS HBx H 1 2.905 0.020 A 46 CYS CB C 13 45.135 0.200 A 46 CYS N N 15 109.840 0.200 A 47 CYS H H 1 8.250 0.020 A 47 CYS HA H 1 4.813 0.020 A 47 CYS HBy H 1 3.750 0.020 A 47 CYS HBx H 1 3.230 0.020 A 47 CYS CB C 13 39.148 0.200 A 47 CYS N N 15 117.334 0.200 A 48 PHE H H 1 7.906 0.020 A 48 PHE HA H 1 4.781 0.020 A 48 PHE HBy H 1 3.582 0.020 A 48 PHE HBx H 1 3.365 0.020 A 48 PHE HDx H 1 7.300 0.020 A 48 PHE HDy H 1 7.300 0.020 A 48 PHE HEx H 1 7.437 0.020 A 48 PHE HEy H 1 7.437 0.020 A 48 PHE HZ H 1 7.365 0.020 A 48 PHE CB C 13 37.957 0.200 A 48 PHE CDx C 13 130.642 0.200 A 48 PHE CEx C 13 131.629 0.200 A 48 PHE CZ C 13 129.873 0.200 A 48 PHE N N 15 116.949 0.200 A 49 ARG H H 1 7.555 0.020 A 49 ARG HA H 1 4.486 0.020 A 49 ARG HBy H 1 2.048 0.020 A 49 ARG HBx H 1 1.934 0.020 A 49 ARG HDx H 1 3.361 0.020 A 49 ARG HDy H 1 3.361 0.020 A 49 ARG HE H 1 7.401 0.020 A 49 ARG HGy H 1 1.840 0.020 A 49 ARG HGx H 1 1.760 0.020 A 49 ARG CB C 13 32.462 0.200 A 49 ARG CD C 13 44.012 0.200 A 49 ARG CG C 13 26.953 0.200 A 49 ARG N N 15 117.888 0.200 A 49 ARG NE N 15 85.784 0.200 A 50 SER H H 1 7.775 0.020 A 50 SER HA H 1 4.910 0.020 A 50 SER HBx H 1 3.933 0.020 A 50 SER HBy H 1 3.933 0.020 A 50 SER CB C 13 64.737 0.200 A 50 SER N N 15 110.763 0.200 A 51 CYS H H 1 9.705 0.020 A 51 CYS HA H 1 5.323 0.020 A 51 CYS HBy H 1 3.798 0.020 A 51 CYS HBx H 1 3.444 0.020 A 51 CYS CA C 13 53.343 0.200 A 51 CYS CB C 13 47.521 0.200 A 51 CYS N N 15 120.532 0.200 A 52 ASP H H 1 7.499 0.020 A 52 ASP HA H 1 4.613 0.020 A 52 ASP HBy H 1 3.177 0.020 A 52 ASP HBx H 1 2.598 0.020 A 52 ASP CB C 13 42.834 0.200 A 52 ASP N N 15 115.658 0.200 A 53 LEU H H 1 7.341 0.020 A 53 LEU HA H 1 4.202 0.020 A 53 LEU HBy H 1 2.167 0.020 A 53 LEU HBx H 1 1.342 0.020 A 53 LEU HDx% H 1 1.076 0.020 A 53 LEU HDy% H 1 1.298 0.020 A 53 LEU HG H 1 2.285 0.020 A 53 LEU CA C 13 58.206 0.200 A 53 LEU CB C 13 42.748 0.200 A 53 LEU CDx C 13 22.976 0.200 A 53 LEU CDy C 13 27.232 0.200 A 53 LEU CG C 13 27.070 0.200 A 53 LEU N N 15 117.097 0.200 A 54 ALA H H 1 8.473 0.020 A 54 ALA HA H 1 4.065 0.020 A 54 ALA HB% H 1 1.502 0.020 A 54 ALA CA C 13 55.249 0.200 A 54 ALA CB C 13 17.641 0.200 A 54 ALA N N 15 120.421 0.200 A 55 LEU H H 1 8.014 0.020 A 55 LEU HA H 1 4.418 0.020 A 55 LEU HBy H 1 2.101 0.020 A 55 LEU HBx H 1 2.046 0.020 A 55 LEU HDx% H 1 1.160 0.020 A 55 LEU HDy% H 1 1.160 0.020 A 55 LEU HG H 1 1.950 0.020 A 55 LEU CA C 13 57.968 0.200 A 55 LEU CB C 13 41.604 0.200 A 55 LEU CDx C 13 25.209 0.200 A 55 LEU CG C 13 28.122 0.200 A 55 LEU N N 15 120.635 0.200 A 56 LEU H H 1 8.318 0.020 A 56 LEU HA H 1 3.991 0.020 A 56 LEU HBy H 1 2.095 0.020 A 56 LEU HBx H 1 1.641 0.020 A 56 LEU HDx% H 1 0.812 0.020 A 56 LEU HDy% H 1 0.872 0.020 A 56 LEU HG H 1 1.841 0.020 A 56 LEU CA C 13 60.219 0.200 A 56 LEU CB C 13 42.163 0.200 A 56 LEU CDx C 13 26.461 0.200 A 56 LEU CDy C 13 27.807 0.200 A 56 LEU CG C 13 27.552 0.200 A 56 LEU N N 15 123.958 0.200 A 57 GLU H H 1 8.060 0.020 A 57 GLU HA H 1 4.463 0.020 A 57 GLU HBy H 1 2.253 0.020 A 57 GLU HBx H 1 2.070 0.020 A 57 GLU HGy H 1 2.618 0.020 A 57 GLU HGx H 1 2.386 0.020 A 57 GLU CB C 13 29.481 0.200 A 57 GLU CG C 13 36.522 0.200 A 57 GLU N N 15 115.756 0.200 A 58 THR H H 1 8.051 0.020 A 58 THR HA H 1 4.414 0.020 A 58 THR HB H 1 4.431 0.020 A 58 THR HG2% H 1 1.596 0.020 A 58 THR CA C 13 64.554 0.200 A 58 THR CB C 13 69.722 0.200 A 58 THR CG2 C 13 21.681 0.200 A 58 THR N N 15 110.639 0.200 A 59 TYR H H 1 8.319 0.020 A 59 TYR HA H 1 4.371 0.020 A 59 TYR HBy H 1 3.977 0.020 A 59 TYR HBx H 1 3.125 0.020 A 59 TYR HDx H 1 7.359 0.020 A 59 TYR HDy H 1 7.359 0.020 A 59 TYR HEx H 1 6.627 0.020 A 59 TYR HEy H 1 6.627 0.020 A 59 TYR CB C 13 36.834 0.200 A 59 TYR CDx C 13 134.263 0.200 A 59 TYR CEx C 13 117.147 0.200 A 59 TYR N N 15 121.046 0.200 A 60 CYS H H 1 7.621 0.020 A 60 CYS HA H 1 5.328 0.020 A 60 CYS HBy H 1 3.241 0.020 A 60 CYS HBx H 1 2.909 0.020 A 60 CYS CA C 13 53.289 0.200 A 60 CYS CB C 13 34.413 0.200 A 60 CYS N N 15 116.571 0.200 A 61 ALA H H 1 8.214 0.020 A 61 ALA HA H 1 4.282 0.020 A 61 ALA HB% H 1 1.214 0.020 A 61 ALA CA C 13 53.070 0.200 A 61 ALA CB C 13 18.750 0.200 A 61 ALA N N 15 125.680 0.200 A 62 THR H H 1 7.799 0.020 A 62 THR HA H 1 4.794 0.020 A 62 THR HB H 1 4.294 0.020 A 62 THR HG2% H 1 1.379 0.020 A 62 THR CB C 13 70.229 0.200 A 62 THR CG2 C 13 21.768 0.200 A 62 THR N N 15 112.629 0.200 A 63 PRO HA H 1 4.550 0.020 A 63 PRO HBy H 1 2.420 0.020 A 63 PRO HBx H 1 2.036 0.020 A 63 PRO HDy H 1 3.908 0.020 A 63 PRO HDx H 1 3.844 0.020 A 63 PRO HGy H 1 2.161 0.020 A 63 PRO HGx H 1 2.075 0.020 A 63 PRO CB C 13 32.340 0.200 A 63 PRO CD C 13 51.216 0.200 A 63 PRO CG C 13 27.497 0.200 A 64 ALA H H 1 8.499 0.020 A 64 ALA HA H 1 4.356 0.020 A 64 ALA HB% H 1 1.490 0.020 A 64 ALA CA C 13 52.517 0.200 A 64 ALA CB C 13 19.434 0.200 A 64 ALA N N 15 124.366 0.200 A 65 LYS H H 1 8.357 0.020 A 65 LYS HA H 1 4.468 0.020 A 65 LYS HBy H 1 1.963 0.020 A 65 LYS HBx H 1 1.869 0.020 A 65 LYS HDx H 1 1.804 0.020 A 65 LYS HDy H 1 1.804 0.020 A 65 LYS HEx H 1 3.099 0.020 A 65 LYS HEy H 1 3.099 0.020 A 65 LYS HGx H 1 1.530 0.020 A 65 LYS HGy H 1 1.530 0.020 A 65 LYS CB C 13 33.495 0.200 A 65 LYS CD C 13 29.236 0.200 A 65 LYS CE C 13 42.181 0.200 A 65 LYS CG C 13 24.684 0.200 A 65 LYS N N 15 120.744 0.200 A 66 SER H H 1 8.450 0.020 A 66 SER HA H 1 4.575 0.020 A 66 SER HBx H 1 3.957 0.020 A 66 SER HBy H 1 3.957 0.020 A 66 SER N N 15 118.103 0.200 A 67 GLU H H 1 8.067 0.020 A 67 GLU HA H 1 4.288 0.020 A 67 GLU HBy H 1 2.180 0.020 A 67 GLU HBx H 1 1.997 0.020 A 67 GLU HGx H 1 2.341 0.020 A 67 GLU HGy H 1 2.341 0.020 A 67 GLU CB C 13 31.002 0.200 A 67 GLU N N 15 127.346 0.200 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _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 37 ARG H A 37 ARG HBx 1.0 0.0 4.03 2 2 A 64 ALA HB% A 65 LYS H 1.0 0.0 3.69 3 3 A 65 LYS H A 65 LYS HBx 1.0 0.0 3.78 4 4 A 2 TYR H A 2 TYR HBy 1.0 0.0 3.29 5 5 A 2 TYR H A 2 TYR HBx 1.0 0.0 3.29 6 6 A 65 LYS H A 64 ALA HA 1.0 0.0 2.88 7 7 A 56 LEU HA A 59 TYR H 1.0 0.0 4.19 8 8 A 2 TYR H A 1 ALA HA 1.0 0.0 2.97 9 9 A 3 ARG H A 3 ARG HBy 1.0 0.0 3.71 10 10 A 3 ARG H A 3 ARG HBx 1.0 0.0 3.71 11 11 A 3 ARG H A 3 ARG HGx 1.0 0.0 3.55 12 11 A 3 ARG H A 3 ARG HGy 1.0 0.0 3.55 13 12 A 3 ARG H A 2 TYR HA 1.0 0.0 3.36 14 13 A 3 ARG H A 4 PRO HDy 1.0 0.0 5.18 15 14 A 26 PHE HBx A 61 ALA H 1.0 0.0 5.05 16 15 A 3 ARG H A 3 ARG HDx 1.0 0.0 4.15 17 15 A 3 ARG H A 3 ARG HDy 1.0 0.0 4.15 18 16 A 3 ARG H A 2 TYR HBy 1.0 0.0 4.00 19 17 A 3 ARG H A 2 TYR HBx 1.0 0.0 4.00 20 18 A 61 ALA H A 26 PHE HBy 1.0 0.0 4.53 21 19 A 4 PRO HBy A 5 SER H 1.0 0.0 3.57 22 20 A 5 SER H A 4 PRO HBx 1.0 0.0 3.68 23 21 A 5 SER H A 5 SER HBx 1.0 0.0 3.23 24 21 A 5 SER H A 5 SER HBy 1.0 0.0 3.23 25 22 A 5 SER H A 4 PRO HA 1.0 0.0 2.68 26 23 A 5 SER H A 6 GLU H 1.0 0.0 3.69 27 24 A 2 TYR H A 2 TYR HD% 1.0 0.0 4.28 28 25 A 61 ALA H A 26 PHE HA 1.0 0.0 3.91 29 26 A 3 ARG H A 2 TYR HD% 1.0 0.0 4.22 30 27 A 61 ALA H A 26 PHE H 1.0 0.0 5.15 31 28 A 61 ALA H A 60 CYS H 1.0 0.0 5.40 32 29 A 6 GLU H A 5 SER HA 1.0 0.0 2.82 33 30 A 6 GLU H A 7 THR H 1.0 0.0 3.40 34 31 A 6 GLU H A 5 SER HBx 1.0 0.0 4.16 35 31 A 5 SER HBy A 6 GLU H 1.0 0.0 4.16 36 32 A 6 GLU H A 6 GLU HGx 1.0 0.0 3.41 37 32 A 6 GLU H A 6 GLU HGy 1.0 0.0 3.41 38 33 A 6 GLU H A 6 GLU HBy 1.0 0.0 3.85 39 34 A 6 GLU H A 6 GLU HBx 1.0 0.0 3.85 40 35 A 6 GLU H A 7 THR HG2% 1.0 0.0 5.25 41 36 A 7 THR H A 8 LEU H 1.0 0.0 4.65 42 37 A 7 THR H A 6 GLU HBx 1.0 0.0 4.36 43 38 A 7 THR H A 6 GLU HBy 1.0 0.0 4.36 44 39 A 7 THR H A 6 GLU HGx 1.0 0.0 3.90 45 39 A 7 THR H A 6 GLU HGy 1.0 0.0 3.90 46 40 A 8 LEU H A 7 THR HB 1.0 0.0 4.08 47 41 A 8 LEU H A 8 LEU HDx% 1.0 0.0 4.66 48 42 A 9 CYS H A 10 GLY H 1.0 0.0 4.56 49 43 A 8 LEU H A 9 CYS H 1.0 0.0 4.67 50 44 A 9 CYS H A 9 CYS HBy 1.0 0.0 4.08 51 45 A 9 CYS H A 9 CYS HBx 1.0 0.0 4.08 52 46 A 9 CYS H A 8 LEU HBy 1.0 0.0 4.39 53 47 A 9 CYS H A 8 LEU HG 1.0 0.0 4.94 54 48 A 9 CYS H A 8 LEU HBx 1.0 0.0 4.65 55 49 A 9 CYS H A 12 GLU HBx 1.0 0.0 4.67 56 50 A 9 CYS H A 12 GLU HBy 1.0 0.0 4.67 57 51 A 11 GLY H A 12 GLU H 1.0 0.0 3.94 58 52 A 12 GLU H A 13 LEU H 1.0 0.0 3.92 59 53 A 12 GLU H A 10 GLY HAy 1.0 0.0 4.54 60 54 A 12 GLU H A 10 GLY HAx 1.0 0.0 4.54 61 55 A 12 GLU H A 12 GLU HBy 1.0 0.0 4.02 62 56 A 13 LEU H A 13 LEU HBy 1.0 0.0 3.91 63 57 A 13 LEU H A 12 GLU HBx 1.0 0.0 4.37 64 58 A 13 LEU H A 13 LEU HBx 1.0 0.0 3.91 65 59 A 13 LEU H A 14 VAL H 1.0 0.0 3.89 66 60 A 14 VAL H A 14 VAL HB 1.0 0.0 3.58 67 61 A 14 VAL H A 13 LEU HDx% 1.0 0.0 4.47 68 62 A 14 VAL H A 15 ASP H 1.0 0.0 3.82 69 63 A 15 ASP H A 12 GLU HA 1.0 0.0 4.47 70 64 A 15 ASP H A 15 ASP HBy 1.0 0.0 4.05 71 65 A 15 ASP H A 15 ASP HBx 1.0 0.0 4.05 72 66 A 15 ASP H A 16 THR H 1.0 0.0 4.01 73 67 A 16 THR H A 17 LEU H 1.0 0.0 3.81 74 68 A 16 THR H A 16 THR HG1 1.0 0.0 3.58 75 69 A 35 VAL HA A 36 SER H 1.0 0.0 3.01 76 70 A 16 THR H A 15 ASP HBy 1.0 0.0 4.67 77 71 A 16 THR H A 15 ASP HBx 1.0 0.0 4.67 78 72 A 17 LEU H A 16 THR HB 1.0 0.0 4.29 79 73 A 18 GLN H A 26 PHE HE% 1.0 0.0 4.69 80 74 A 18 GLN H A 18 GLN HGy 1.0 0.0 3.96 81 75 A 18 GLN H A 18 GLN HGx 1.0 0.0 3.96 82 76 A 18 GLN H A 17 LEU HBy 1.0 0.0 4.21 83 77 A 18 GLN H A 18 GLN HBy 1.0 0.0 3.69 84 78 A 18 GLN H A 18 GLN HBx 1.0 0.0 3.69 85 79 A 18 GLN H A 17 LEU HBx 1.0 0.0 4.21 86 80 A 19 PHE H A 20 VAL H 1.0 0.0 4.12 87 81 A 18 GLN H A 19 PHE H 1.0 0.0 3.90 88 82 A 19 PHE H A 19 PHE HD% 1.0 0.0 4.46 89 83 A 19 PHE H A 16 THR HA 1.0 0.0 4.31 90 84 A 19 PHE H A 19 PHE HBy 1.0 0.0 3.70 91 85 A 19 PHE H A 19 PHE HBx 1.0 0.0 3.70 92 86 A 20 VAL H A 19 PHE HD% 1.0 0.0 4.63 93 87 A 20 VAL H A 19 PHE HBy 1.0 0.0 4.25 94 88 A 20 VAL H A 19 PHE HBx 1.0 0.0 4.25 95 89 A 20 VAL H A 20 VAL HB 1.0 0.0 3.69 96 90 A 20 VAL H A 16 THR HG2% 1.0 0.0 4.72 97 91 A 18 GLN HA A 21 CYS H 1.0 0.0 4.70 98 92 A 21 CYS H A 17 LEU HA 1.0 0.0 4.55 99 93 A 21 CYS H A 21 CYS HBy 1.0 0.0 3.93 100 94 A 21 CYS H A 21 CYS HBx 1.0 0.0 3.93 101 95 A 20 VAL HB A 21 CYS H 1.0 0.0 4.06 102 96 A 21 CYS H A 20 VAL HGx% 1.0 0.0 4.02 103 97 A 21 CYS H A 20 VAL HGy% 1.0 0.0 4.02 104 98 A 21 CYS H A 22 GLY H 1.0 0.0 3.56 105 99 A 22 GLY H A 21 CYS HBy 1.0 0.0 4.61 106 100 A 22 GLY H A 21 CYS HBx 1.0 0.0 4.61 107 101 A 22 GLY H A 23 ASP H 1.0 0.0 4.71 108 102 A 23 ASP H A 23 ASP HBy 1.0 0.0 3.99 109 103 A 23 ASP H A 23 ASP HBx 1.0 0.0 3.99 110 104 A 23 ASP H A 24 ARG H 1.0 0.0 3.83 111 105 A 24 ARG H A 25 GLY H 1.0 0.0 3.70 112 106 A 24 ARG H A 24 ARG HE 1.0 0.0 4.82 113 107 A 24 ARG H A 24 ARG HGy 1.0 0.0 3.87 114 108 A 24 ARG H A 23 ASP HBx 1.0 0.0 4.72 115 109 A 24 ARG H A 23 ASP HBy 1.0 0.0 4.72 116 110 A 24 ARG H A 24 ARG HDx 1.0 0.0 4.08 117 110 A 24 ARG H A 24 ARG HDy 1.0 0.0 4.08 118 111 A 26 PHE H A 25 GLY H 1.0 0.0 4.47 119 112 A 26 PHE HBx A 25 GLY H 1.0 0.0 4.95 120 113 A 25 GLY H A 61 ALA HB% 1.0 0.0 5.07 121 114 A 26 PHE H A 27 TYR H 1.0 0.0 4.49 122 115 A 26 PHE H A 26 PHE HD% 1.0 0.0 3.91 123 116 A 26 PHE H A 25 GLY HAy 1.0 0.0 3.44 124 117 A 26 PHE H A 25 GLY HAx 1.0 0.0 3.44 125 118 A 61 ALA H A 27 TYR H 1.0 0.0 4.90 126 119 A 26 PHE HBy A 27 TYR H 1.0 0.0 4.00 127 120 A 26 PHE HBx A 27 TYR H 1.0 0.0 4.05 128 121 A 28 PHE H A 28 PHE HD% 1.0 0.0 4.49 129 122 A 28 PHE H A 27 TYR HA 1.0 0.0 3.44 130 123 A 28 PHE H A 27 TYR HBy 1.0 0.0 4.11 131 124 A 28 PHE H A 28 PHE HBy 1.0 0.0 3.96 132 125 A 28 PHE H A 28 PHE HBx 1.0 0.0 3.96 133 126 A 28 PHE HD% A 29 SER H 1.0 0.0 4.67 134 127 A 29 SER H A 29 SER HBx 1.0 0.0 3.76 135 128 A 29 SER H A 29 SER HBy 1.0 0.0 3.76 136 129 A 29 SER H A 28 PHE HBy 1.0 0.0 4.29 137 130 A 29 SER H A 30 ARG H 1.0 0.0 4.58 138 131 A 30 ARG H A 30 ARG HGx 1.0 0.0 4.16 139 131 A 30 ARG H A 30 ARG HGy 1.0 0.0 4.16 140 132 A 30 ARG H A 30 ARG HBx 1.0 0.0 3.94 141 133 A 30 ARG H A 30 ARG HBy 1.0 0.0 3.94 142 134 A 31 PRO HA A 32 ALA H 1.0 0.0 2.79 143 135 A 32 ALA H A 31 PRO HBy 1.0 0.0 3.98 144 136 A 32 ALA H A 31 PRO HBx 1.0 0.0 3.98 145 137 A 32 ALA HA A 33 SER H 1.0 0.0 3.22 146 138 A 33 SER H A 32 ALA HB% 1.0 0.0 3.73 147 139 A 33 SER H A 33 SER HBy 1.0 0.0 3.77 148 140 A 33 SER H A 33 SER HBx 1.0 0.0 3.77 149 141 A 34 ARG H A 33 SER HBx 1.0 0.0 4.13 150 142 A 34 ARG H A 33 SER HBy 1.0 0.0 4.13 151 143 A 34 ARG H A 33 SER HA 1.0 0.0 3.35 152 144 A 34 ARG H A 34 ARG HGx 1.0 0.0 3.90 153 144 A 34 ARG H A 34 ARG HGy 1.0 0.0 3.90 154 145 A 34 ARG H A 34 ARG HBx 1.0 0.0 3.76 155 146 A 34 ARG H A 34 ARG HBy 1.0 0.0 3.76 156 147 A 34 ARG H A 35 VAL H 1.0 0.0 3.58 157 148 A 33 SER HA A 35 VAL H 1.0 0.0 4.54 158 149 A 35 VAL H A 33 SER HBy 1.0 0.0 4.44 159 150 A 35 VAL H A 33 SER HBx 1.0 0.0 4.44 160 151 A 36 SER H A 36 SER HBy 1.0 0.0 3.94 161 152 A 36 SER H A 36 SER HBx 1.0 0.0 3.94 162 153 A 36 SER H A 35 VAL HB 1.0 0.0 3.69 163 154 A 36 SER H A 37 ARG HGx 1.0 0.0 4.48 164 154 A 36 SER H A 37 ARG HGy 1.0 0.0 4.48 165 155 A 37 ARG H A 36 SER H 1.0 0.0 4.50 166 156 A 37 ARG H A 36 SER HA 1.0 0.0 3.12 167 157 A 37 ARG H A 37 ARG HBy 1.0 0.0 4.03 168 158 A 37 ARG H A 37 ARG HGx 1.0 0.0 3.57 169 158 A 37 ARG H A 37 ARG HGy 1.0 0.0 3.57 170 159 A 37 ARG H A 38 ARG H 1.0 0.0 3.61 171 160 A 38 ARG H A 38 ARG HBx 1.0 0.0 3.91 172 161 A 38 ARG H A 38 ARG HGx 1.0 0.0 3.56 173 161 A 38 ARG H A 38 ARG HGy 1.0 0.0 3.56 174 162 A 39 SER H A 38 ARG HBy 1.0 0.0 4.75 175 163 A 66 SER H A 65 LYS HBy 1.0 0.0 5.01 176 164 A 39 SER H A 38 ARG HBx 1.0 0.0 4.75 177 165 A 66 SER H A 65 LYS HBx 1.0 0.0 5.01 178 166 A 39 SER H A 38 ARG HGx 1.0 0.0 4.46 179 166 A 38 ARG HGy A 39 SER H 1.0 0.0 4.46 180 167 A 39 SER H A 39 SER HBx 1.0 0.0 3.39 181 167 A 39 SER H A 39 SER HBy 1.0 0.0 3.39 182 168 A 66 SER H A 66 SER HBx 1.0 0.0 3.68 183 168 A 66 SER H A 66 SER HBy 1.0 0.0 3.68 184 169 A 39 SER H A 38 ARG HA 1.0 0.0 2.96 185 170 A 66 SER H A 67 GLU H 1.0 0.0 4.28 186 171 A 39 SER HA A 40 ARG H 1.0 0.0 3.13 187 172 A 40 ARG H A 39 SER HBx 1.0 0.0 3.65 188 172 A 39 SER HBy A 40 ARG H 1.0 0.0 3.65 189 173 A 40 ARG H A 40 ARG HBy 1.0 0.0 3.81 190 174 A 40 ARG H A 40 ARG HBx 1.0 0.0 3.81 191 175 A 40 ARG H A 40 ARG HGx 1.0 0.0 4.13 192 175 A 40 ARG H A 40 ARG HGy 1.0 0.0 4.13 193 176 A 41 GLY H A 42 ILE H 1.0 0.0 4.53 194 177 A 41 GLY H A 40 ARG HDx 1.0 0.0 4.53 195 177 A 41 GLY H A 40 ARG HDy 1.0 0.0 4.53 196 178 A 41 GLY H A 40 ARG HBy 1.0 0.0 4.25 197 179 A 41 GLY H A 40 ARG HBx 1.0 0.0 4.25 198 180 A 41 GLY H A 44 GLU HBy 1.0 0.0 4.71 199 181 A 41 GLY H A 40 ARG HGx 1.0 0.0 4.23 200 181 A 40 ARG HGy A 41 GLY H 1.0 0.0 4.23 201 182 A 42 ILE H A 42 ILE HB 1.0 0.0 3.84 202 183 A 42 ILE H A 42 ILE HD1% 1.0 0.0 4.35 203 184 A 53 LEU HA A 56 LEU H 1.0 0.0 4.31 204 185 A 42 ILE H A 43 VAL H 1.0 0.0 3.64 205 186 A 56 LEU H A 57 GLU H 1.0 0.0 3.57 206 187 A 56 LEU H A 55 LEU HG 1.0 0.0 3.87 207 188 A 56 LEU H A 56 LEU HG 1.0 0.0 4.37 208 189 A 56 LEU H A 56 LEU HBy 1.0 0.0 3.79 209 190 A 42 ILE HG2% A 44 GLU H 1.0 0.0 4.51 210 191 A 44 GLU H A 43 VAL HB 1.0 0.0 4.14 211 192 A 44 GLU H A 44 GLU HBy 1.0 0.0 3.64 212 193 A 44 GLU H A 44 GLU HGy 1.0 0.0 4.50 213 194 A 44 GLU H A 45 GLU H 1.0 0.0 3.76 214 195 A 43 VAL H A 44 GLU H 1.0 0.0 3.63 215 196 A 45 GLU H A 42 ILE HA 1.0 0.0 4.46 216 197 A 45 GLU H A 46 CYS H 1.0 0.0 3.93 217 198 A 46 CYS H A 46 CYS HBy 1.0 0.0 4.08 218 199 A 46 CYS H A 46 CYS HBx 1.0 0.0 4.08 219 200 A 46 CYS H A 43 VAL HA 1.0 0.0 4.67 220 201 A 46 CYS H A 45 GLU HBy 1.0 0.0 4.56 221 202 A 46 CYS H A 45 GLU HBx 1.0 0.0 4.56 222 203 A 45 GLU H A 47 CYS H 1.0 0.0 4.99 223 204 A 47 CYS H A 46 CYS HBy 1.0 0.0 4.50 224 205 A 47 CYS H A 48 PHE HBy 1.0 0.0 4.69 225 206 A 47 CYS H A 46 CYS HBx 1.0 0.0 4.50 226 207 A 7 THR HG2% A 47 CYS H 1.0 0.0 5.50 227 208 A 47 CYS H A 48 PHE H 1.0 0.0 3.55 228 209 A 48 PHE H A 47 CYS HBx 1.0 0.0 4.31 229 210 A 48 PHE HBy A 48 PHE H 1.0 0.0 3.85 230 211 A 48 PHE H A 48 PHE HBx 1.0 0.0 4.00 231 212 A 48 PHE H A 47 CYS HBy 1.0 0.0 4.31 232 213 A 48 PHE H A 44 GLU HA 1.0 0.0 4.30 233 214 A 47 CYS H A 49 ARG H 1.0 0.0 4.37 234 215 A 48 PHE H A 49 ARG H 1.0 0.0 3.36 235 216 A 49 ARG H A 50 SER H 1.0 0.0 4.60 236 217 A 44 GLU HA A 49 ARG H 1.0 0.0 4.70 237 218 A 48 PHE HBx A 49 ARG H 1.0 0.0 4.09 238 219 A 48 PHE HBy A 49 ARG H 1.0 0.0 3.72 239 220 A 49 ARG H A 49 ARG HBy 1.0 0.0 4.02 240 221 A 49 ARG H A 49 ARG HBx 1.0 0.0 4.02 241 222 A 7 THR HG2% A 49 ARG H 1.0 0.0 4.53 242 223 A 50 SER H A 49 ARG HA 1.0 0.0 3.14 243 224 A 50 SER H A 50 SER HBx 1.0 0.0 3.19 244 224 A 50 SER H A 50 SER HBy 1.0 0.0 3.19 245 225 A 50 SER H A 49 ARG HDx 1.0 0.0 4.42 246 225 A 50 SER H A 49 ARG HDy 1.0 0.0 4.42 247 226 A 7 THR HG2% A 50 SER H 1.0 0.0 4.38 248 227 A 50 SER H A 49 ARG HBx 1.0 0.0 3.83 249 228 A 46 CYS HA A 51 CYS H 1.0 0.0 4.60 250 229 A 51 CYS H A 50 SER HBx 1.0 0.0 4.24 251 229 A 50 SER HBy A 51 CYS H 1.0 0.0 4.24 252 230 A 51 CYS HA A 52 ASP H 1.0 0.0 3.38 253 231 A 52 ASP H A 51 CYS HBy 1.0 0.0 3.88 254 232 A 52 ASP H A 51 CYS HBx 1.0 0.0 3.88 255 233 A 53 LEU H A 53 LEU HDx% 1.0 0.0 4.33 256 234 A 53 LEU H A 53 LEU HDy% 1.0 0.0 4.33 257 235 A 53 LEU H A 53 LEU HG 1.0 0.0 4.71 258 236 A 53 LEU H A 52 ASP HBy 1.0 0.0 4.30 259 237 A 54 ALA H A 55 LEU H 1.0 0.0 3.49 260 238 A 53 LEU H A 54 ALA H 1.0 0.0 3.91 261 239 A 54 ALA H A 53 LEU HBy 1.0 0.0 3.96 262 240 A 54 ALA H A 53 LEU HBx 1.0 0.0 3.91 263 241 A 53 LEU HG A 54 ALA H 1.0 0.0 5.41 264 242 A 54 ALA H A 52 ASP HBx 1.0 0.0 4.49 265 243 A 54 ALA H A 52 ASP HBy 1.0 0.0 4.49 266 244 A 55 LEU H A 55 LEU HDx% 1.0 0.0 3.74 267 244 A 55 LEU H A 55 LEU HDy% 1.0 0.0 3.74 268 245 A 55 LEU H A 58 THR HG2% 1.0 0.0 4.68 269 246 A 55 LEU H A 55 LEU HBy 1.0 0.0 3.45 270 247 A 52 ASP H A 55 LEU H 1.0 0.0 4.22 271 248 A 56 LEU H A 55 LEU H 1.0 0.0 3.71 272 249 A 55 LEU H A 55 LEU HBx 1.0 0.0 3.45 273 250 A 55 LEU HG A 55 LEU H 1.0 0.0 4.18 274 251 A 55 LEU HG A 52 ASP H 1.0 0.0 4.11 275 252 A 57 GLU H A 54 ALA HA 1.0 0.0 4.31 276 253 A 57 GLU H A 57 GLU HGy 1.0 0.0 4.78 277 254 A 57 GLU H A 57 GLU HGx 1.0 0.0 4.78 278 255 A 57 GLU H A 57 GLU HBy 1.0 0.0 3.37 279 256 A 57 GLU H A 56 LEU HBy 1.0 0.0 3.96 280 257 A 56 LEU HA A 58 THR H 1.0 0.0 4.42 281 258 A 57 GLU HBy A 58 THR H 1.0 0.0 4.49 282 259 A 59 TYR H A 58 THR H 1.0 0.0 3.82 283 260 A 59 TYR H A 59 TYR HD% 1.0 0.0 3.89 284 261 A 59 TYR H A 60 CYS H 1.0 0.0 3.42 285 262 A 60 CYS H A 58 THR H 1.0 0.0 4.34 286 263 A 60 CYS H A 59 TYR HD% 1.0 0.0 4.95 287 264 A 60 CYS H A 57 GLU HA 1.0 0.0 3.88 288 265 A 60 CYS H A 59 TYR HBy 1.0 0.0 4.61 289 266 A 60 CYS H A 60 CYS HBy 1.0 0.0 3.78 290 267 A 60 CYS H A 59 TYR HBx 1.0 0.0 4.61 291 268 A 60 CYS H A 60 CYS HBx 1.0 0.0 3.78 292 269 A 61 ALA H A 62 THR H 1.0 0.0 4.65 293 270 A 62 THR H A 27 TYR HE% 1.0 0.0 4.83 294 271 A 62 THR H A 61 ALA HA 1.0 0.0 2.98 295 272 A 62 THR H A 63 PRO HDy 1.0 0.0 5.07 296 273 A 62 THR H A 63 PRO HDx 1.0 0.0 5.07 297 274 A 63 PRO HA A 64 ALA H 1.0 0.0 2.70 298 275 A 64 ALA H A 63 PRO HBy 1.0 0.0 3.62 299 276 A 64 ALA H A 63 PRO HBx 1.0 0.0 3.62 300 277 A 64 ALA HB% A 64 ALA H 1.0 0.0 2.69 301 278 A 67 GLU H A 66 SER HA 1.0 0.0 3.41 302 279 A 67 GLU H A 66 SER HBx 1.0 0.0 4.63 303 279 A 66 SER HBy A 67 GLU H 1.0 0.0 4.63 304 280 A 18 GLN HE2y A 18 GLN HBy 1.0 0.0 4.85 305 281 A 24 ARG HE A 24 ARG HGx 1.0 0.0 4.15 306 282 A 24 ARG HE A 24 ARG HGy 1.0 0.0 4.15 307 283 A 24 ARG HE A 24 ARG HBx 1.0 0.0 4.17 308 284 A 24 ARG HE A 24 ARG HBy 1.0 0.0 4.17 309 285 A 30 ARG HE A 30 ARG HGx 1.0 0.0 4.08 310 285 A 30 ARG HGy A 30 ARG HE 1.0 0.0 4.08 311 286 A 40 ARG HE A 40 ARG HBy 1.0 0.0 4.61 312 287 A 40 ARG HE A 40 ARG HBx 1.0 0.0 4.61 313 288 A 40 ARG HE A 40 ARG HGx 1.0 0.0 4.17 314 288 A 40 ARG HGy A 40 ARG HE 1.0 0.0 4.17 315 289 A 3 ARG H A 4 PRO HDx 1.0 0.0 5.18 316 290 A 35 VAL H A 35 VAL HB 1.0 0.0 3.79 317 291 A 35 VAL H A 34 ARG HBy 1.0 0.0 3.97 318 292 A 35 VAL H A 34 ARG HBx 1.0 0.0 3.97 319 293 A 35 VAL H A 35 VAL HGy% 1.0 0.0 3.14 320 294 A 2 TYR H A 1 ALA HB% 1.0 0.0 4.20 321 295 A 2 TYR HA A 2 TYR HD% 1.0 0.0 3.55 322 296 A 4 PRO HDx A 3 ARG HBy 1.0 0.0 4.76 323 297 A 3 ARG HBx A 4 PRO HDx 1.0 0.0 4.76 324 298 A 3 ARG HA A 3 ARG HGx 1.0 0.0 3.54 325 298 A 3 ARG HGy A 3 ARG HA 1.0 0.0 3.54 326 299 A 62 THR HA A 63 PRO HGy 1.0 0.0 4.90 327 300 A 62 THR HA A 63 PRO HGx 1.0 0.0 4.90 328 301 A 57 GLU H A 57 GLU HBx 1.0 0.0 3.48 329 302 A 58 THR H A 57 GLU HBx 1.0 0.0 3.92 330 303 A 6 GLU HA A 6 GLU HGx 1.0 0.0 3.60 331 303 A 6 GLU HGy A 6 GLU HA 1.0 0.0 3.60 332 304 A 6 GLU HGy A 6 GLU HBy 1.0 0.0 2.93 333 304 A 6 GLU HBy A 6 GLU HGx 1.0 0.0 2.93 334 305 A 6 GLU HGy A 6 GLU HBx 1.0 0.0 2.93 335 305 A 6 GLU HBx A 6 GLU HGx 1.0 0.0 2.93 336 306 A 7 THR H A 7 THR HG2% 1.0 0.0 3.35 337 307 A 7 THR HG2% A 8 LEU H 1.0 0.0 3.89 338 308 A 7 THR HG2% A 7 THR HA 1.0 0.0 2.87 339 309 A 7 THR HG2% A 50 SER HA 1.0 0.0 3.66 340 310 A 7 THR HG2% A 49 ARG HA 1.0 0.0 4.37 341 311 A 7 THR HG2% A 50 SER HBx 1.0 0.0 4.19 342 311 A 7 THR HG2% A 50 SER HBy 1.0 0.0 4.19 343 312 A 8 LEU HBx A 8 LEU HDx% 1.0 0.0 3.50 344 313 A 8 LEU HBy A 8 LEU HDy% 1.0 0.0 3.37 345 314 A 8 LEU HBx A 13 LEU HA 1.0 0.0 4.63 346 315 A 8 LEU HBy A 13 LEU HA 1.0 0.0 4.89 347 316 A 8 LEU HBy A 7 THR HA 1.0 0.0 4.68 348 317 A 8 LEU HBx A 7 THR HA 1.0 0.0 5.50 349 318 A 8 LEU HA A 8 LEU HDx% 1.0 0.0 4.08 350 319 A 16 THR HG1 A 8 LEU HDx% 1.0 0.0 3.85 351 320 A 16 THR HB A 8 LEU HDx% 1.0 0.0 4.36 352 321 A 13 LEU HA A 8 LEU HDx% 1.0 0.0 3.79 353 322 A 16 THR HA A 8 LEU HDx% 1.0 0.0 5.50 354 323 A 8 LEU HBy A 8 LEU HDx% 1.0 0.0 3.37 355 324 A 16 THR H A 8 LEU HDx% 1.0 0.0 5.04 356 325 A 9 CYS H A 8 LEU HDx% 1.0 0.0 4.90 357 326 A 8 LEU HA A 8 LEU HDy% 1.0 0.0 4.08 358 327 A 8 LEU H A 8 LEU HDy% 1.0 0.0 4.66 359 328 A 9 CYS H A 8 LEU HDy% 1.0 0.0 4.90 360 329 A 16 THR H A 8 LEU HDy% 1.0 0.0 5.04 361 330 A 16 THR HG1 A 8 LEU HDy% 1.0 0.0 3.85 362 331 A 16 THR HB A 8 LEU HDy% 1.0 0.0 4.36 363 332 A 16 THR HA A 8 LEU HDy% 1.0 0.0 5.50 364 333 A 13 LEU HA A 8 LEU HDy% 1.0 0.0 3.79 365 334 A 8 LEU HBx A 8 LEU HDy% 1.0 0.0 3.50 366 335 A 10 GLY H A 9 CYS HBx 1.0 0.0 4.54 367 336 A 10 GLY H A 9 CYS HBy 1.0 0.0 4.54 368 337 A 12 GLU H A 12 GLU HGx 1.0 0.0 4.32 369 338 A 12 GLU H A 12 GLU HGy 1.0 0.0 4.32 370 339 A 13 LEU H A 12 GLU HGy 1.0 0.0 5.20 371 340 A 13 LEU H A 12 GLU HGx 1.0 0.0 5.20 372 341 A 12 GLU HA A 12 GLU HGx 1.0 0.0 4.07 373 342 A 12 GLU HA A 12 GLU HGy 1.0 0.0 4.07 374 343 A 45 GLU HA A 45 GLU HGy 1.0 0.0 3.94 375 344 A 8 LEU HG A 13 LEU HA 1.0 0.0 4.38 376 345 A 13 LEU HDx% A 13 LEU HBx 1.0 0.0 3.79 377 346 A 14 VAL H A 13 LEU HBy 1.0 0.0 4.78 378 347 A 13 LEU H A 13 LEU HDx% 1.0 0.0 4.32 379 348 A 13 LEU H A 13 LEU HDy% 1.0 0.0 4.32 380 349 A 28 PHE HE% A 13 LEU HDx% 1.0 0.0 4.70 381 350 A 9 CYS HA A 13 LEU HDx% 1.0 0.0 5.50 382 351 A 43 VAL HA A 13 LEU HDx% 1.0 0.0 4.80 383 352 A 13 LEU HDx% A 13 LEU HBy 1.0 0.0 3.79 384 353 A 42 ILE HD1% A 13 LEU HDx% 1.0 0.0 4.08 385 354 A 14 VAL H A 13 LEU HDy% 1.0 0.0 4.47 386 355 A 28 PHE HE% A 13 LEU HDy% 1.0 0.0 4.70 387 356 A 9 CYS HA A 13 LEU HDy% 1.0 0.0 5.50 388 357 A 13 LEU HBy A 13 LEU HDy% 1.0 0.0 3.79 389 358 A 13 LEU HBx A 13 LEU HDy% 1.0 0.0 3.79 390 359 A 17 LEU HG A 13 LEU HDy% 1.0 0.0 4.96 391 360 A 54 ALA H A 53 LEU HDy% 1.0 0.0 4.85 392 361 A 53 LEU HA A 53 LEU HDy% 1.0 0.0 4.04 393 362 A 54 ALA HA A 53 LEU HDy% 1.0 0.0 5.47 394 363 A 53 LEU HBx A 53 LEU HDy% 1.0 0.0 3.56 395 364 A 17 LEU H A 14 VAL HA 1.0 0.0 4.47 396 365 A 18 GLN H A 14 VAL HA 1.0 0.0 5.08 397 366 A 18 GLN HE2y A 14 VAL HA 1.0 0.0 5.50 398 367 A 28 PHE HD% A 14 VAL HA 1.0 0.0 5.50 399 368 A 14 VAL HB A 15 ASP H 1.0 0.0 4.20 400 369 A 14 VAL HA A 14 VAL HGx% 1.0 0.0 3.32 401 370 A 11 GLY HAy A 14 VAL HGx% 1.0 0.0 5.50 402 371 A 11 GLY HAx A 14 VAL HGx% 1.0 0.0 5.50 403 372 A 26 PHE HE% A 14 VAL HGx% 1.0 0.0 4.17 404 373 A 14 VAL H A 14 VAL HGx% 1.0 0.0 3.83 405 374 A 15 ASP H A 14 VAL HGx% 1.0 0.0 3.97 406 375 A 14 VAL HA A 14 VAL HGy% 1.0 0.0 3.32 407 376 A 14 VAL HGy% A 11 GLY HAy 1.0 0.0 5.50 408 377 A 11 GLY HAx A 14 VAL HGy% 1.0 0.0 5.50 409 378 A 26 PHE HE% A 14 VAL HGy% 1.0 0.0 4.17 410 379 A 14 VAL H A 14 VAL HGy% 1.0 0.0 3.83 411 380 A 26 PHE HZ A 14 VAL HGy% 1.0 0.0 3.78 412 381 A 15 ASP H A 14 VAL HGy% 1.0 0.0 3.97 413 382 A 12 GLU HA A 15 ASP HBy 1.0 0.0 4.67 414 383 A 12 GLU HA A 15 ASP HBx 1.0 0.0 4.67 415 384 A 20 VAL HB A 17 LEU HA 1.0 0.0 4.57 416 385 A 17 LEU HA A 20 VAL HGx% 1.0 0.0 4.61 417 386 A 20 VAL H A 17 LEU HA 1.0 0.0 4.94 418 387 A 14 VAL HA A 17 LEU HBy 1.0 0.0 4.39 419 388 A 17 LEU HBy A 17 LEU HDy% 1.0 0.0 3.82 420 389 A 17 LEU HG A 13 LEU HDx% 1.0 0.0 4.96 421 390 A 17 LEU HG A 56 LEU HDx% 1.0 0.0 3.92 422 391 A 17 LEU HA A 17 LEU HG 1.0 0.0 3.91 423 392 A 17 LEU H A 17 LEU HG 1.0 0.0 3.95 424 393 A 17 LEU HA A 17 LEU HDy% 1.0 0.0 3.94 425 394 A 17 LEU HBx A 17 LEU HDy% 1.0 0.0 3.82 426 395 A 56 LEU HDx% A 17 LEU HDy% 1.0 0.0 4.31 427 396 A 56 LEU HDy% A 17 LEU HDy% 1.0 0.0 3.75 428 397 A 28 PHE HA A 17 LEU HDy% 1.0 0.0 5.50 429 398 A 17 LEU H A 17 LEU HDy% 1.0 0.0 4.06 430 399 A 28 PHE HE% A 17 LEU HDy% 1.0 0.0 4.93 431 400 A 26 PHE HE% A 17 LEU HDy% 1.0 0.0 4.70 432 401 A 26 PHE HD% A 17 LEU HDy% 1.0 0.0 4.15 433 402 A 17 LEU HA A 17 LEU HDx% 1.0 0.0 3.94 434 403 A 17 LEU HDx% A 17 LEU HBy 1.0 0.0 3.82 435 404 A 17 LEU HDx% A 17 LEU HBx 1.0 0.0 3.82 436 405 A 28 PHE HA A 17 LEU HDx% 1.0 0.0 5.50 437 406 A 26 PHE HE% A 17 LEU HDx% 1.0 0.0 4.70 438 407 A 17 LEU H A 17 LEU HDx% 1.0 0.0 4.06 439 408 A 15 ASP HA A 18 GLN HBy 1.0 0.0 4.94 440 409 A 15 ASP HA A 18 GLN HBx 1.0 0.0 4.94 441 410 A 18 GLN HE2x A 18 GLN HBy 1.0 0.0 5.34 442 411 A 26 PHE HE% A 18 GLN HBy 1.0 0.0 5.50 443 412 A 18 GLN HE2x A 18 GLN HBx 1.0 0.0 5.34 444 413 A 26 PHE HE% A 18 GLN HBx 1.0 0.0 5.50 445 414 A 18 GLN HE2y A 18 GLN HBx 1.0 0.0 4.85 446 415 A 19 PHE H A 18 GLN HBy 1.0 0.0 4.52 447 416 A 19 PHE H A 18 GLN HBx 1.0 0.0 4.52 448 417 A 18 GLN HA A 18 GLN HGy 1.0 0.0 4.10 449 418 A 18 GLN HA A 18 GLN HGx 1.0 0.0 4.10 450 419 A 26 PHE HE% A 18 GLN HGy 1.0 0.0 3.88 451 420 A 26 PHE HE% A 18 GLN HGx 1.0 0.0 3.88 452 421 A 26 PHE HZ A 18 GLN HGy 1.0 0.0 4.53 453 422 A 26 PHE HZ A 18 GLN HGx 1.0 0.0 4.53 454 423 A 16 THR HA A 19 PHE HBx 1.0 0.0 4.53 455 424 A 16 THR HA A 19 PHE HBy 1.0 0.0 4.53 456 425 A 19 PHE HD% A 19 PHE HA 1.0 0.0 4.08 457 426 A 16 THR HG2% A 20 VAL HA 1.0 0.0 5.24 458 427 A 19 PHE HD% A 20 VAL HA 1.0 0.0 4.69 459 428 A 20 VAL HB A 56 LEU HDy% 1.0 0.0 3.77 460 429 A 20 VAL HA A 20 VAL HGx% 1.0 0.0 3.21 461 430 A 16 THR HG2% A 20 VAL HGx% 1.0 0.0 4.41 462 431 A 53 LEU HA A 20 VAL HGx% 1.0 0.0 5.08 463 432 A 19 PHE HD% A 20 VAL HGx% 1.0 0.0 4.81 464 433 A 57 GLU H A 20 VAL HGx% 1.0 0.0 4.96 465 434 A 20 VAL H A 20 VAL HGx% 1.0 0.0 3.78 466 435 A 24 ARG HA A 24 ARG HGx 1.0 0.0 4.23 467 436 A 24 ARG H A 24 ARG HGx 1.0 0.0 3.87 468 437 A 24 ARG HA A 24 ARG HGy 1.0 0.0 4.23 469 438 A 26 PHE HA A 26 PHE HD% 1.0 0.0 4.20 470 439 A 26 PHE HD% A 27 TYR HA 1.0 0.0 4.66 471 440 A 18 GLN HA A 26 PHE HD% 1.0 0.0 4.29 472 441 A 61 ALA HB% A 26 PHE HD% 1.0 0.0 5.50 473 442 A 26 PHE HD% A 17 LEU HBy 1.0 0.0 4.86 474 443 A 26 PHE HD% A 17 LEU HG 1.0 0.0 5.31 475 444 A 26 PHE HD% A 42 ILE HG2% 1.0 0.0 5.50 476 445 A 26 PHE HD% A 17 LEU HDx% 1.0 0.0 4.15 477 446 A 26 PHE HD% A 17 LEU HBx 1.0 0.0 4.86 478 447 A 27 TYR H A 26 PHE HD% 1.0 0.0 4.27 479 448 A 26 PHE HD% A 26 PHE HZ 1.0 0.0 3.90 480 449 A 26 PHE HE% A 18 GLN HA 1.0 0.0 4.18 481 450 A 26 PHE HE% A 14 VAL HA 1.0 0.0 4.84 482 451 A 26 PHE HE% A 18 GLN HE2y 1.0 0.0 3.63 483 452 A 28 PHE H A 27 TYR HBx 1.0 0.0 4.11 484 453 A 27 TYR HA A 27 TYR HD% 1.0 0.0 3.81 485 454 A 61 ALA HA A 27 TYR HD% 1.0 0.0 3.96 486 455 A 28 PHE H A 27 TYR HD% 1.0 0.0 4.18 487 456 A 27 TYR H A 27 TYR HD% 1.0 0.0 4.12 488 457 A 26 PHE HA A 27 TYR HD% 1.0 0.0 4.66 489 458 A 27 TYR HE% A 61 ALA HA 1.0 0.0 3.48 490 459 A 2 TYR HA A 2 TYR HE% 1.0 0.0 4.93 491 460 A 29 SER H A 28 PHE HBx 1.0 0.0 4.29 492 461 A 28 PHE HD% A 28 PHE HA 1.0 0.0 4.32 493 462 A 29 SER HA A 30 ARG HGx 1.0 0.0 5.50 494 462 A 30 ARG HGy A 29 SER HA 1.0 0.0 5.50 495 463 A 30 ARG HA A 30 ARG HGx 1.0 0.0 3.68 496 463 A 30 ARG HGy A 30 ARG HA 1.0 0.0 3.68 497 464 A 31 PRO HA A 30 ARG HGx 1.0 0.0 5.50 498 464 A 30 ARG HGy A 31 PRO HA 1.0 0.0 5.50 499 465 A 30 ARG HA A 30 ARG HDy 1.0 0.0 4.66 500 466 A 30 ARG HA A 30 ARG HDx 1.0 0.0 4.66 501 467 A 31 PRO HA A 30 ARG HDy 1.0 0.0 5.50 502 468 A 31 PRO HA A 30 ARG HDx 1.0 0.0 5.50 503 469 A 31 PRO HA A 32 ALA HB% 1.0 0.0 5.01 504 470 A 3 ARG HA A 4 PRO HDx 1.0 0.0 3.13 505 471 A 3 ARG HA A 4 PRO HDy 1.0 0.0 3.13 506 472 A 3 ARG HBx A 4 PRO HDy 1.0 0.0 4.76 507 473 A 3 ARG HBy A 4 PRO HDy 1.0 0.0 4.76 508 474 A 32 ALA HB% A 33 SER HA 1.0 0.0 4.52 509 475 A 34 ARG HDy A 34 ARG HBx 1.0 0.0 3.62 510 475 A 34 ARG HBx A 34 ARG HDx 1.0 0.0 3.62 511 476 A 37 ARG HDy A 37 ARG HBx 1.0 0.0 3.93 512 476 A 37 ARG HBx A 37 ARG HDx 1.0 0.0 3.93 513 477 A 3 ARG HDy A 3 ARG HBy 1.0 0.0 3.82 514 477 A 3 ARG HBy A 3 ARG HDx 1.0 0.0 3.82 515 478 A 38 ARG HDy A 38 ARG HBy 1.0 0.0 3.54 516 478 A 38 ARG HBy A 38 ARG HDx 1.0 0.0 3.54 517 479 A 34 ARG HA A 34 ARG HGx 1.0 0.0 3.48 518 479 A 34 ARG HGy A 34 ARG HA 1.0 0.0 3.48 519 480 A 34 ARG HDy A 34 ARG HGx 1.0 0.0 2.81 520 480 A 34 ARG HDx A 34 ARG HGx 1.0 0.0 2.81 521 480 A 34 ARG HGy A 34 ARG HDx 1.0 0.0 2.81 522 480 A 34 ARG HGy A 34 ARG HDy 1.0 0.0 2.81 523 481 A 34 ARG HDy A 34 ARG HBy 1.0 0.0 3.62 524 481 A 34 ARG HBy A 34 ARG HDx 1.0 0.0 3.62 525 482 A 37 ARG HDy A 37 ARG HBy 1.0 0.0 3.93 526 482 A 37 ARG HBy A 37 ARG HDx 1.0 0.0 3.93 527 483 A 38 ARG HDy A 38 ARG HBx 1.0 0.0 3.54 528 483 A 38 ARG HBx A 38 ARG HDx 1.0 0.0 3.54 529 484 A 40 ARG H A 40 ARG HDx 1.0 0.0 4.79 530 484 A 40 ARG H A 40 ARG HDy 1.0 0.0 4.79 531 485 A 35 VAL HGy% A 37 ARG HDx 1.0 0.0 4.55 532 485 A 35 VAL HGy% A 37 ARG HDy 1.0 0.0 4.55 533 486 A 35 VAL HGy% A 37 ARG HGx 1.0 0.0 4.00 534 486 A 37 ARG HGy A 35 VAL HGy% 1.0 0.0 4.00 535 487 A 35 VAL HA A 35 VAL HGy% 1.0 0.0 3.35 536 488 A 36 SER H A 35 VAL HGy% 1.0 0.0 4.02 537 489 A 36 SER HA A 35 VAL HGy% 1.0 0.0 4.48 538 490 A 35 VAL HGx% A 34 ARG HGx 1.0 0.0 5.43 539 490 A 34 ARG HGy A 35 VAL HGx% 1.0 0.0 5.43 540 491 A 35 VAL HGx% A 37 ARG HGx 1.0 0.0 5.50 541 491 A 37 ARG HGy A 35 VAL HGx% 1.0 0.0 5.50 542 492 A 35 VAL HGx% A 34 ARG HBx 1.0 0.0 4.81 543 493 A 35 VAL HGx% A 34 ARG HBy 1.0 0.0 4.81 544 494 A 35 VAL HA A 35 VAL HGx% 1.0 0.0 3.24 545 495 A 36 SER H A 35 VAL HGx% 1.0 0.0 4.19 546 496 A 35 VAL H A 35 VAL HGx% 1.0 0.0 3.10 547 497 A 37 ARG HA A 37 ARG HGx 1.0 0.0 3.30 548 497 A 37 ARG HGy A 37 ARG HA 1.0 0.0 3.30 549 498 A 49 ARG H A 49 ARG HGx 1.0 0.0 4.28 550 499 A 37 ARG H A 37 ARG HDx 1.0 0.0 4.94 551 499 A 37 ARG H A 37 ARG HDy 1.0 0.0 4.94 552 500 A 39 SER H A 38 ARG HDx 1.0 0.0 5.50 553 500 A 39 SER H A 38 ARG HDy 1.0 0.0 5.50 554 501 A 38 ARG HA A 38 ARG HDx 1.0 0.0 4.27 555 501 A 38 ARG HA A 38 ARG HDy 1.0 0.0 4.27 556 502 A 37 ARG HA A 37 ARG HDx 1.0 0.0 4.21 557 502 A 37 ARG HDy A 37 ARG HA 1.0 0.0 4.21 558 503 A 34 ARG HA A 34 ARG HDx 1.0 0.0 3.79 559 503 A 34 ARG HDy A 34 ARG HA 1.0 0.0 3.79 560 504 A 35 VAL H A 34 ARG HGx 1.0 0.0 4.62 561 504 A 34 ARG HGy A 35 VAL H 1.0 0.0 4.62 562 505 A 38 ARG HA A 38 ARG HGx 1.0 0.0 3.40 563 505 A 38 ARG HGy A 38 ARG HA 1.0 0.0 3.40 564 506 A 38 ARG H A 37 ARG HDx 1.0 0.0 5.50 565 506 A 38 ARG H A 37 ARG HDy 1.0 0.0 5.50 566 507 A 38 ARG H A 38 ARG HDx 1.0 0.0 5.50 567 507 A 38 ARG H A 38 ARG HDy 1.0 0.0 5.50 568 508 A 50 SER H A 49 ARG HBy 1.0 0.0 3.83 569 509 A 40 ARG HDy A 40 ARG HBx 1.0 0.0 3.71 570 509 A 40 ARG HBx A 40 ARG HDx 1.0 0.0 3.71 571 510 A 40 ARG HDy A 40 ARG HBy 1.0 0.0 3.71 572 510 A 40 ARG HBy A 40 ARG HDx 1.0 0.0 3.71 573 511 A 42 ILE HA A 59 TYR HD% 1.0 0.0 5.00 574 512 A 42 ILE HA A 55 LEU HDx% 1.0 0.0 4.66 575 512 A 42 ILE HA A 55 LEU HDy% 1.0 0.0 4.66 576 513 A 42 ILE HA A 42 ILE HG1x 1.0 0.0 4.08 577 514 A 42 ILE HB A 42 ILE HD1% 1.0 0.0 3.83 578 515 A 42 ILE HB A 59 TYR HE% 1.0 0.0 4.74 579 516 A 42 ILE HB A 43 VAL H 1.0 0.0 4.98 580 517 A 42 ILE HA A 42 ILE HG1y 1.0 0.0 3.81 581 518 A 42 ILE H A 42 ILE HG1y 1.0 0.0 4.71 582 519 A 42 ILE H A 42 ILE HG1x 1.0 0.0 4.88 583 520 A 43 VAL H A 42 ILE HG1x 1.0 0.0 4.81 584 521 A 42 ILE HG2% A 43 VAL HB 1.0 0.0 4.12 585 522 A 42 ILE HG2% A 13 LEU HG 1.0 0.0 4.81 586 523 A 42 ILE HG2% A 42 ILE HG1y 1.0 0.0 3.00 587 524 A 42 ILE HD1% A 42 ILE HG2% 1.0 0.0 3.21 588 525 A 42 ILE HG2% A 42 ILE HA 1.0 0.0 3.67 589 526 A 42 ILE HG2% A 28 PHE HA 1.0 0.0 3.45 590 527 A 43 VAL H A 42 ILE HG2% 1.0 0.0 3.25 591 528 A 42 ILE H A 42 ILE HG2% 1.0 0.0 3.16 592 529 A 28 PHE HD% A 42 ILE HG2% 1.0 0.0 3.34 593 530 A 42 ILE HG2% A 59 TYR HE% 1.0 0.0 4.25 594 531 A 42 ILE HD1% A 42 ILE HA 1.0 0.0 3.37 595 532 A 56 LEU HA A 42 ILE HD1% 1.0 0.0 3.51 596 533 A 42 ILE HD1% A 59 TYR HBy 1.0 0.0 4.07 597 534 A 42 ILE HD1% A 59 TYR HBx 1.0 0.0 4.07 598 535 A 42 ILE HD1% A 56 LEU HBx 1.0 0.0 4.54 599 536 A 42 ILE HD1% A 55 LEU HG 1.0 0.0 4.37 600 537 A 42 ILE HD1% A 56 LEU HG 1.0 0.0 3.28 601 538 A 42 ILE HD1% A 56 LEU HBy 1.0 0.0 4.29 602 539 A 42 ILE HD1% A 56 LEU HDx% 1.0 0.0 3.14 603 540 A 42 ILE HD1% A 13 LEU HDy% 1.0 0.0 4.08 604 541 A 16 THR HG2% A 42 ILE HD1% 1.0 0.0 5.28 605 542 A 42 ILE HD1% A 59 TYR HA 1.0 0.0 5.05 606 543 A 42 ILE HD1% A 28 PHE HA 1.0 0.0 5.35 607 544 A 42 ILE HD1% A 59 TYR HE% 1.0 0.0 3.88 608 545 A 42 ILE HD1% A 56 LEU H 1.0 0.0 4.99 609 546 A 59 TYR H A 42 ILE HD1% 1.0 0.0 5.29 610 547 A 42 ILE HD1% A 59 TYR HD% 1.0 0.0 3.58 611 548 A 42 ILE HG2% A 43 VAL HA 1.0 0.0 4.38 612 549 A 43 VAL HA A 13 LEU HDy% 1.0 0.0 4.80 613 550 A 43 VAL HA A 47 CYS H 1.0 0.0 4.34 614 551 A 43 VAL H A 43 VAL HB 1.0 0.0 3.37 615 552 A 43 VAL H A 43 VAL HGx% 1.0 0.0 3.79 616 553 A 44 GLU H A 43 VAL HGx% 1.0 0.0 3.95 617 554 A 53 LEU HA A 53 LEU HDx% 1.0 0.0 4.04 618 555 A 54 ALA HA A 53 LEU HDx% 1.0 0.0 5.47 619 556 A 43 VAL HA A 43 VAL HGx% 1.0 0.0 3.26 620 557 A 53 LEU HBx A 53 LEU HDx% 1.0 0.0 3.56 621 558 A 43 VAL H A 43 VAL HGy% 1.0 0.0 3.79 622 559 A 44 GLU H A 43 VAL HGy% 1.0 0.0 3.95 623 560 A 28 PHE HE% A 43 VAL HGy% 1.0 0.0 5.11 624 561 A 48 PHE HD% A 43 VAL HGy% 1.0 0.0 4.94 625 562 A 43 VAL HA A 43 VAL HGy% 1.0 0.0 3.26 626 563 A 56 LEU HA A 59 TYR HD% 1.0 0.0 4.35 627 564 A 56 LEU HA A 20 VAL HGx% 1.0 0.0 5.50 628 565 A 56 LEU HA A 42 ILE HG1y 1.0 0.0 5.50 629 566 A 44 GLU H A 44 GLU HBx 1.0 0.0 3.64 630 567 A 45 GLU H A 44 GLU HBx 1.0 0.0 4.11 631 568 A 45 GLU H A 44 GLU HBy 1.0 0.0 4.11 632 569 A 13 LEU H A 12 GLU HBy 1.0 0.0 4.37 633 570 A 44 GLU HGy A 44 GLU HA 1.0 0.0 3.73 634 571 A 44 GLU HA A 44 GLU HGx 1.0 0.0 3.67 635 572 A 44 GLU H A 44 GLU HGx 1.0 0.0 3.91 636 573 A 44 GLU HGy A 45 GLU H 1.0 0.0 5.46 637 574 A 44 GLU HGy A 49 ARG H 1.0 0.0 5.50 638 575 A 45 GLU H A 44 GLU HGx 1.0 0.0 5.50 639 576 A 45 GLU H A 45 GLU HGx 1.0 0.0 4.49 640 577 A 45 GLU H A 45 GLU HGy 1.0 0.0 4.49 641 578 A 44 GLU HGy A 48 PHE HE% 1.0 0.0 4.90 642 579 A 44 GLU HGy A 48 PHE HD% 1.0 0.0 4.25 643 580 A 44 GLU HGy A 45 GLU HA 1.0 0.0 5.50 644 581 A 57 GLU HA A 57 GLU HGx 1.0 0.0 3.76 645 582 A 38 ARG H A 38 ARG HBy 1.0 0.0 3.91 646 583 A 45 GLU HA A 45 GLU HGx 1.0 0.0 3.94 647 584 A 57 GLU HA A 57 GLU HGy 1.0 0.0 3.76 648 585 A 55 LEU HDy% A 45 GLU HGx 1.0 0.0 4.01 649 585 A 45 GLU HGx A 55 LEU HDx% 1.0 0.0 4.01 650 586 A 9 CYS HA A 47 CYS HBy 1.0 0.0 5.35 651 587 A 9 CYS HA A 47 CYS HBx 1.0 0.0 5.35 652 588 A 48 PHE HBy A 44 GLU HA 1.0 0.0 3.96 653 589 A 48 PHE HBx A 44 GLU HA 1.0 0.0 4.25 654 590 A 48 PHE H A 48 PHE HD% 1.0 0.0 4.05 655 591 A 48 PHE HD% A 48 PHE HA 1.0 0.0 3.47 656 592 A 44 GLU HA A 48 PHE HD% 1.0 0.0 3.70 657 593 A 48 PHE HD% A 44 GLU HGx 1.0 0.0 4.19 658 594 A 48 PHE HD% A 43 VAL HGx% 1.0 0.0 4.94 659 595 A 48 PHE HE% A 48 PHE HA 1.0 0.0 4.68 660 596 A 44 GLU HA A 48 PHE HE% 1.0 0.0 4.54 661 597 A 44 GLU HGx A 48 PHE HE% 1.0 0.0 4.68 662 598 A 49 ARG H A 49 ARG HGy 1.0 0.0 4.28 663 599 A 49 ARG HDy A 49 ARG HBy 1.0 0.0 3.71 664 599 A 49 ARG HBy A 49 ARG HDx 1.0 0.0 3.71 665 600 A 49 ARG HDy A 49 ARG HBx 1.0 0.0 3.71 666 600 A 49 ARG HBx A 49 ARG HDx 1.0 0.0 3.71 667 601 A 26 PHE HBy A 60 CYS HA 1.0 0.0 4.93 668 602 A 46 CYS HA A 51 CYS HBx 1.0 0.0 4.99 669 603 A 46 CYS HA A 51 CYS HBy 1.0 0.0 4.99 670 604 A 55 LEU HDy% A 51 CYS HBx 1.0 0.0 3.98 671 604 A 51 CYS HBx A 55 LEU HDx% 1.0 0.0 3.98 672 605 A 53 LEU H A 52 ASP HBx 1.0 0.0 4.30 673 606 A 53 LEU HA A 20 VAL HGy% 1.0 0.0 5.08 674 607 A 58 THR HG2% A 54 ALA HA 1.0 0.0 4.47 675 608 A 54 ALA HB% A 55 LEU HA 1.0 0.0 4.02 676 609 A 53 LEU H A 54 ALA HB% 1.0 0.0 4.65 677 610 A 53 LEU HG A 54 ALA HB% 1.0 0.0 5.03 678 611 A 57 GLU HBx A 54 ALA HB% 1.0 0.0 5.25 679 612 A 54 ALA HB% A 55 LEU HDx% 1.0 0.0 4.70 680 612 A 55 LEU HDy% A 54 ALA HB% 1.0 0.0 4.70 681 613 A 53 LEU HBx A 54 ALA HB% 1.0 0.0 4.34 682 614 A 54 ALA H A 54 ALA HB% 1.0 0.0 2.73 683 615 A 56 LEU H A 54 ALA HB% 1.0 0.0 4.86 684 616 A 55 LEU H A 54 ALA HB% 1.0 0.0 3.13 685 617 A 56 LEU H A 56 LEU HBx 1.0 0.0 3.58 686 618 A 56 LEU HBx A 20 VAL HGy% 1.0 0.0 3.90 687 619 A 55 LEU HDy% A 55 LEU HBx 1.0 0.0 3.40 688 619 A 55 LEU HBx A 55 LEU HDx% 1.0 0.0 3.40 689 620 A 55 LEU HG A 55 LEU HA 1.0 0.0 3.72 690 621 A 55 LEU HG A 59 TYR HE% 1.0 0.0 4.67 691 622 A 55 LEU HDy% A 45 GLU HGy 1.0 0.0 4.01 692 622 A 45 GLU HGy A 55 LEU HDx% 1.0 0.0 4.01 693 623 A 55 LEU HA A 55 LEU HDx% 1.0 0.0 2.87 694 623 A 55 LEU HDy% A 55 LEU HA 1.0 0.0 2.87 695 624 A 56 LEU HA A 55 LEU HDx% 1.0 0.0 3.49 696 624 A 56 LEU HA A 55 LEU HDy% 1.0 0.0 3.49 697 625 A 55 LEU HDy% A 51 CYS HBy 1.0 0.0 3.98 698 625 A 51 CYS HBy A 55 LEU HDx% 1.0 0.0 3.98 699 626 A 55 LEU HDy% A 45 GLU HBy 1.0 0.0 3.37 700 626 A 45 GLU HBy A 55 LEU HDx% 1.0 0.0 3.37 701 627 A 55 LEU HDy% A 55 LEU HBy 1.0 0.0 3.40 702 627 A 55 LEU HBy A 55 LEU HDx% 1.0 0.0 3.40 703 628 A 55 LEU HDy% A 45 GLU HBx 1.0 0.0 3.37 704 628 A 45 GLU HBx A 55 LEU HDx% 1.0 0.0 3.37 705 629 A 58 THR HG2% A 55 LEU HDx% 1.0 0.0 3.47 706 629 A 55 LEU HDy% A 58 THR HG2% 1.0 0.0 3.47 707 630 A 42 ILE HD1% A 55 LEU HDx% 1.0 0.0 3.50 708 630 A 42 ILE HD1% A 55 LEU HDy% 1.0 0.0 3.50 709 631 A 51 CYS HA A 55 LEU HDx% 1.0 0.0 3.55 710 631 A 51 CYS HA A 55 LEU HDy% 1.0 0.0 3.55 711 632 A 59 TYR HE% A 55 LEU HDx% 1.0 0.0 3.14 712 632 A 55 LEU HDy% A 59 TYR HE% 1.0 0.0 3.14 713 633 A 59 TYR HD% A 55 LEU HDx% 1.0 0.0 3.81 714 633 A 55 LEU HDy% A 59 TYR HD% 1.0 0.0 3.81 715 634 A 52 ASP H A 55 LEU HDx% 1.0 0.0 3.36 716 634 A 52 ASP H A 55 LEU HDy% 1.0 0.0 3.36 717 635 A 56 LEU H A 55 LEU HDx% 1.0 0.0 3.56 718 635 A 56 LEU H A 55 LEU HDy% 1.0 0.0 3.56 719 636 A 53 LEU HA A 56 LEU HBx 1.0 0.0 3.85 720 637 A 53 LEU HA A 56 LEU HBy 1.0 0.0 3.89 721 638 A 56 LEU HBy A 55 LEU HDx% 1.0 0.0 4.49 722 638 A 56 LEU HBy A 55 LEU HDy% 1.0 0.0 4.49 723 639 A 16 THR HG2% A 56 LEU HBy 1.0 0.0 4.58 724 640 A 56 LEU HBx A 20 VAL HGx% 1.0 0.0 3.90 725 641 A 56 LEU HBy A 56 LEU HDx% 1.0 0.0 3.54 726 642 A 17 LEU HA A 56 LEU HDy% 1.0 0.0 3.37 727 643 A 56 LEU HA A 56 LEU HDy% 1.0 0.0 3.62 728 644 A 26 PHE HBx A 56 LEU HDy% 1.0 0.0 5.50 729 645 A 56 LEU HDy% A 20 VAL HA 1.0 0.0 5.32 730 646 A 53 LEU HA A 56 LEU HDy% 1.0 0.0 4.83 731 647 A 16 THR HB A 56 LEU HDy% 1.0 0.0 4.52 732 648 A 57 GLU HA A 56 LEU HDy% 1.0 0.0 3.97 733 649 A 20 VAL H A 56 LEU HDy% 1.0 0.0 4.57 734 650 A 17 LEU H A 56 LEU HDy% 1.0 0.0 4.61 735 651 A 59 TYR H A 56 LEU HDy% 1.0 0.0 5.20 736 652 A 57 GLU H A 56 LEU HDy% 1.0 0.0 4.32 737 653 A 56 LEU HDy% A 56 LEU HBx 1.0 0.0 3.56 738 654 A 56 LEU HBy A 56 LEU HDy% 1.0 0.0 3.44 739 655 A 17 LEU HG A 56 LEU HDy% 1.0 0.0 3.96 740 656 A 42 ILE HD1% A 56 LEU HDy% 1.0 0.0 3.29 741 657 A 56 LEU HDy% A 17 LEU HDx% 1.0 0.0 3.75 742 658 A 56 LEU HDx% A 17 LEU HDx% 1.0 0.0 4.31 743 659 A 56 LEU HDx% A 56 LEU HBx 1.0 0.0 3.19 744 660 A 16 THR HB A 56 LEU HDx% 1.0 0.0 4.17 745 661 A 53 LEU HA A 56 LEU HDx% 1.0 0.0 4.33 746 662 A 56 LEU HA A 56 LEU HDx% 1.0 0.0 4.00 747 663 A 16 THR HA A 56 LEU HDx% 1.0 0.0 5.33 748 664 A 17 LEU HA A 56 LEU HDx% 1.0 0.0 4.47 749 665 A 53 LEU H A 56 LEU HDx% 1.0 0.0 5.50 750 666 A 59 TYR HD% A 56 LEU HDx% 1.0 0.0 5.50 751 667 A 17 LEU H A 56 LEU HDx% 1.0 0.0 4.45 752 668 A 56 LEU H A 56 LEU HDx% 1.0 0.0 4.78 753 669 A 56 LEU HA A 56 LEU HG 1.0 0.0 3.91 754 670 A 56 LEU HG A 55 LEU HDx% 1.0 0.0 4.94 755 670 A 56 LEU HG A 55 LEU HDy% 1.0 0.0 4.94 756 671 A 56 LEU H A 57 GLU HBy 1.0 0.0 5.17 757 672 A 59 TYR HD% A 59 TYR HA 1.0 0.0 4.32 758 673 A 42 ILE HG2% A 59 TYR HD% 1.0 0.0 4.83 759 674 A 59 TYR HD% A 56 LEU HDy% 1.0 0.0 5.45 760 675 A 59 TYR HE% A 59 TYR HA 1.0 0.0 4.79 761 676 A 56 LEU HA A 59 TYR HE% 1.0 0.0 4.92 762 677 A 42 ILE H A 59 TYR HE% 1.0 0.0 4.22 763 678 A 61 ALA H A 60 CYS HBx 1.0 0.0 4.57 764 679 A 61 ALA H A 60 CYS HBy 1.0 0.0 4.57 765 680 A 26 PHE HA A 61 ALA HB% 1.0 0.0 3.53 766 681 A 26 PHE HBx A 61 ALA HB% 1.0 0.0 5.50 767 682 A 26 PHE HBy A 61 ALA HB% 1.0 0.0 4.99 768 683 A 61 ALA HB% A 24 ARG HBy 1.0 0.0 5.03 769 684 A 61 ALA HB% A 24 ARG HBx 1.0 0.0 5.03 770 685 A 61 ALA HB% A 62 THR HA 1.0 0.0 4.35 771 686 A 61 ALA HB% A 27 TYR HE% 1.0 0.0 3.36 772 687 A 61 ALA HB% A 27 TYR HD% 1.0 0.0 3.72 773 688 A 26 PHE H A 61 ALA HB% 1.0 0.0 4.35 774 689 A 61 ALA HB% A 62 THR H 1.0 0.0 3.12 775 690 A 61 ALA H A 61 ALA HB% 1.0 0.0 3.04 776 691 A 61 ALA HB% A 27 TYR H 1.0 0.0 4.28 777 692 A 62 THR HB A 63 PRO HDy 1.0 0.0 4.37 778 693 A 62 THR HB A 63 PRO HDx 1.0 0.0 4.37 779 694 A 62 THR HA A 63 PRO HDy 1.0 0.0 3.49 780 695 A 62 THR HA A 63 PRO HDx 1.0 0.0 3.49 781 696 A 65 LYS H A 65 LYS HBy 1.0 0.0 3.78 782 697 A 65 LYS H A 65 LYS HGx 1.0 0.0 4.63 783 697 A 65 LYS H A 65 LYS HGy 1.0 0.0 4.63 784 698 A 65 LYS HDy A 65 LYS HGx 1.0 0.0 2.81 785 698 A 65 LYS HDx A 65 LYS HGx 1.0 0.0 2.81 786 698 A 65 LYS HGy A 65 LYS HDx 1.0 0.0 2.81 787 698 A 65 LYS HGy A 65 LYS HDy 1.0 0.0 2.81 788 699 A 16 THR HG1 A 16 THR HG2% 1.0 0.0 3.63 789 700 A 19 PHE HD% A 16 THR HG2% 1.0 0.0 4.37 790 701 A 16 THR H A 16 THR HG2% 1.0 0.0 3.99 791 702 A 17 LEU H A 16 THR HG2% 1.0 0.0 4.16 792 703 A 16 THR HA A 16 THR HG2% 1.0 0.0 3.34 793 704 A 16 THR HG2% A 56 LEU HBx 1.0 0.0 4.13 794 705 A 20 VAL HB A 16 THR HG2% 1.0 0.0 4.08 795 706 A 16 THR HG2% A 56 LEU HDx% 1.0 0.0 2.83 796 707 A 16 THR HG2% A 56 LEU HDy% 1.0 0.0 3.28 797 708 A 62 THR HA A 62 THR HG2% 1.0 0.0 3.37 798 709 A 16 THR HG2% A 53 LEU HA 1.0 0.0 4.88 799 710 A 20 VAL HA A 20 VAL HGy% 1.0 0.0 3.21 800 711 A 16 THR HG2% A 20 VAL HGy% 1.0 0.0 4.41 801 712 A 17 LEU HA A 20 VAL HGy% 1.0 0.0 4.61 802 713 A 56 LEU HA A 20 VAL HGy% 1.0 0.0 5.50 803 714 A 19 PHE HD% A 20 VAL HGy% 1.0 0.0 4.81 804 715 A 20 VAL H A 20 VAL HGy% 1.0 0.0 3.78 805 716 A 57 GLU H A 20 VAL HGy% 1.0 0.0 4.96 806 717 A 54 ALA H A 53 LEU HDx% 1.0 0.0 4.85 807 718 A 58 THR HG2% A 55 LEU HA 1.0 0.0 2.81 808 719 A 58 THR HG2% A 58 THR H 1.0 0.0 2.96 809 720 A 59 TYR H A 58 THR HG2% 1.0 0.0 4.15 810 721 A 58 THR HG2% A 57 GLU HBx 1.0 0.0 4.09 811 722 A 58 THR HG2% A 57 GLU HBy 1.0 0.0 4.65 812 723 A 55 LEU HG A 58 THR HG2% 1.0 0.0 4.99 813 724 A 58 THR HG2% A 57 GLU HGy 1.0 0.0 5.50 814 725 A 58 THR HG2% A 57 GLU HGx 1.0 0.0 5.50 815 726 A 12 GLU H A 12 GLU HBx 1.0 0.0 4.02 816 727 A 13 LEU HA A 13 LEU HG 1.0 0.0 4.23 817 728 A 14 VAL H A 13 LEU HG 1.0 0.0 5.02 818 729 A 13 LEU H A 13 LEU HG 1.0 0.0 4.47 819 730 A 41 GLY H A 44 GLU HBx 1.0 0.0 4.71 820 731 A 54 ALA HA A 57 GLU HBy 1.0 0.0 4.43 821 732 A 54 ALA HA A 57 GLU HBx 1.0 0.0 4.30 822 733 A 3 ARG HDy A 3 ARG HBx 1.0 0.0 3.82 823 733 A 3 ARG HBx A 3 ARG HDx 1.0 0.0 3.82 824 734 A 4 PRO HBx A 3 ARG HA 1.0 0.0 4.99 825 735 A 7 THR HG2% A 6 GLU HGx 1.0 0.0 4.82 826 735 A 6 GLU HGy A 7 THR HG2% 1.0 0.0 4.82 827 736 A 14 VAL H A 13 LEU HBx 1.0 0.0 4.78 828 737 A 14 VAL HA A 17 LEU HBx 1.0 0.0 4.39 829 738 A 26 PHE HZ A 14 VAL HGx% 1.0 0.0 3.78 830 739 A 28 PHE HD% A 43 VAL HB 1.0 0.0 5.50 831 740 A 43 VAL HB A 48 PHE HE% 1.0 0.0 5.50 832 741 A 28 PHE HD% A 42 ILE HG1y 1.0 0.0 4.98 833 742 A 62 THR H A 62 THR HG2% 1.0 0.0 3.64 834 743 A 28 PHE HE% A 43 VAL HGx% 1.0 0.0 5.11 835 744 A 28 PHE HE% A 17 LEU HDx% 1.0 0.0 4.93 836 745 A 28 PHE HD% A 17 LEU HDy% 1.0 0.0 4.65 837 746 A 28 PHE HD% A 17 LEU HDx% 1.0 0.0 4.65 838 747 A 3 ARG H A 2 TYR HBx 1.0 0.0 3.51 839 747 A 3 ARG H A 2 TYR HBy 1.0 0.0 3.51 840 748 A 3 ARG H A 3 ARG HBy 1.0 0.0 3.19 841 748 A 3 ARG H A 3 ARG HBx 1.0 0.0 3.19 842 749 A 3 ARG H A 4 PRO HDy 1.0 0.0 4.55 843 749 A 3 ARG H A 4 PRO HDx 1.0 0.0 4.55 844 750 A 3 ARG HBx A 3 ARG HGx 1.0 0.0 2.40 845 750 A 3 ARG HBy A 3 ARG HGx 1.0 0.0 2.40 846 750 A 3 ARG HGy A 3 ARG HBy 1.0 0.0 2.40 847 750 A 3 ARG HGy A 3 ARG HBx 1.0 0.0 2.40 848 751 A 3 ARG HBx A 3 ARG HDx 1.0 0.0 3.35 849 751 A 3 ARG HBy A 3 ARG HDx 1.0 0.0 3.35 850 751 A 3 ARG HDy A 3 ARG HBy 1.0 0.0 3.35 851 751 A 3 ARG HDy A 3 ARG HBx 1.0 0.0 3.35 852 752 A 3 ARG HBx A 4 PRO HDy 1.0 0.0 3.33 853 752 A 3 ARG HBy A 4 PRO HDy 1.0 0.0 3.33 854 752 A 4 PRO HDx A 3 ARG HBy 1.0 0.0 3.33 855 752 A 3 ARG HBx A 4 PRO HDx 1.0 0.0 3.33 856 753 A 3 ARG HGx A 4 PRO HDy 1.0 0.0 4.01 857 753 A 3 ARG HGy A 4 PRO HDy 1.0 0.0 4.01 858 753 A 4 PRO HDx A 3 ARG HGx 1.0 0.0 4.01 859 753 A 3 ARG HGy A 4 PRO HDx 1.0 0.0 4.01 860 754 A 5 SER H A 4 PRO HDy 1.0 0.0 4.96 861 754 A 5 SER H A 4 PRO HDx 1.0 0.0 4.96 862 755 A 6 GLU H A 6 GLU HBx 1.0 0.0 3.04 863 755 A 6 GLU H A 6 GLU HBy 1.0 0.0 3.04 864 756 A 7 THR H A 6 GLU HBx 1.0 0.0 3.73 865 756 A 7 THR H A 6 GLU HBy 1.0 0.0 3.73 866 757 A 8 LEU H A 8 LEU HDy% 1.0 0.0 4.04 867 757 A 8 LEU H A 8 LEU HDx% 1.0 0.0 4.04 868 758 A 8 LEU HA A 8 LEU HDy% 1.0 0.0 3.19 869 758 A 8 LEU HA A 8 LEU HDx% 1.0 0.0 3.19 870 759 A 8 LEU HBy A 13 LEU HDy% 1.0 0.0 4.17 871 759 A 8 LEU HBy A 13 LEU HDx% 1.0 0.0 4.17 872 760 A 8 LEU HBy A 46 CYS HBx 1.0 0.0 4.78 873 760 A 8 LEU HBy A 46 CYS HBy 1.0 0.0 4.78 874 761 A 8 LEU HBx A 13 LEU HDy% 1.0 0.0 3.92 875 761 A 8 LEU HBx A 13 LEU HDx% 1.0 0.0 3.92 876 762 A 8 LEU HBx A 46 CYS HBx 1.0 0.0 4.32 877 762 A 8 LEU HBx A 46 CYS HBy 1.0 0.0 4.32 878 763 A 8 LEU HG A 13 LEU HBy 1.0 0.0 5.34 879 763 A 8 LEU HG A 13 LEU HBx 1.0 0.0 5.34 880 764 A 8 LEU HG A 13 LEU HDy% 1.0 0.0 4.65 881 764 A 8 LEU HG A 13 LEU HDx% 1.0 0.0 4.65 882 765 A 9 CYS H A 8 LEU HDy% 1.0 0.0 3.45 883 765 A 9 CYS H A 8 LEU HDx% 1.0 0.0 3.45 884 766 A 12 GLU HA A 8 LEU HDy% 1.0 0.0 4.63 885 766 A 12 GLU HA A 8 LEU HDx% 1.0 0.0 4.63 886 767 A 8 LEU HDy% A 12 GLU HBx 1.0 0.0 2.99 887 767 A 8 LEU HDx% A 12 GLU HBx 1.0 0.0 2.99 888 767 A 12 GLU HBy A 8 LEU HDy% 1.0 0.0 2.99 889 767 A 8 LEU HDx% A 12 GLU HBy 1.0 0.0 2.99 890 768 A 8 LEU HDx% A 12 GLU HGy 1.0 0.0 4.06 891 768 A 12 GLU HGx A 8 LEU HDy% 1.0 0.0 4.06 892 768 A 8 LEU HDx% A 12 GLU HGx 1.0 0.0 4.06 893 768 A 8 LEU HDy% A 12 GLU HGy 1.0 0.0 4.06 894 769 A 13 LEU H A 8 LEU HDy% 1.0 0.0 3.87 895 769 A 13 LEU H A 8 LEU HDx% 1.0 0.0 3.87 896 770 A 13 LEU HA A 8 LEU HDy% 1.0 0.0 3.27 897 770 A 13 LEU HA A 8 LEU HDx% 1.0 0.0 3.27 898 771 A 8 LEU HDy% A 13 LEU HDy% 1.0 0.0 2.92 899 771 A 8 LEU HDx% A 13 LEU HDy% 1.0 0.0 2.92 900 771 A 13 LEU HDx% A 8 LEU HDy% 1.0 0.0 2.92 901 771 A 8 LEU HDx% A 13 LEU HDx% 1.0 0.0 2.92 902 772 A 15 ASP H A 8 LEU HDy% 1.0 0.0 5.39 903 772 A 15 ASP H A 8 LEU HDx% 1.0 0.0 5.39 904 773 A 16 THR H A 8 LEU HDy% 1.0 0.0 4.22 905 773 A 16 THR H A 8 LEU HDx% 1.0 0.0 4.22 906 774 A 16 THR HA A 8 LEU HDy% 1.0 0.0 4.68 907 774 A 16 THR HA A 8 LEU HDx% 1.0 0.0 4.68 908 775 A 16 THR HB A 8 LEU HDy% 1.0 0.0 3.55 909 775 A 16 THR HB A 8 LEU HDx% 1.0 0.0 3.55 910 776 A 16 THR HG2% A 8 LEU HDy% 1.0 0.0 3.16 911 776 A 16 THR HG2% A 8 LEU HDx% 1.0 0.0 3.16 912 777 A 16 THR HG1 A 8 LEU HDy% 1.0 0.0 3.36 913 777 A 16 THR HG1 A 8 LEU HDx% 1.0 0.0 3.36 914 778 A 9 CYS H A 9 CYS HBx 1.0 0.0 3.52 915 778 A 9 CYS H A 9 CYS HBy 1.0 0.0 3.52 916 779 A 9 CYS HA A 13 LEU HDy% 1.0 0.0 4.12 917 779 A 9 CYS HA A 13 LEU HDx% 1.0 0.0 4.12 918 780 A 9 CYS HA A 43 VAL HGy% 1.0 0.0 4.58 919 780 A 9 CYS HA A 43 VAL HGx% 1.0 0.0 4.58 920 781 A 9 CYS HA A 47 CYS HBx 1.0 0.0 4.48 921 781 A 9 CYS HA A 47 CYS HBy 1.0 0.0 4.48 922 782 A 10 GLY H A 13 LEU HDy% 1.0 0.0 4.96 923 782 A 10 GLY H A 13 LEU HDx% 1.0 0.0 4.96 924 783 A 14 VAL HB A 11 GLY HAy 1.0 0.0 4.07 925 783 A 14 VAL HB A 11 GLY HAx 1.0 0.0 4.07 926 784 A 11 GLY HAy A 14 VAL HGx% 1.0 0.0 3.54 927 784 A 11 GLY HAx A 14 VAL HGx% 1.0 0.0 3.54 928 784 A 14 VAL HGy% A 11 GLY HAy 1.0 0.0 3.54 929 784 A 11 GLY HAx A 14 VAL HGy% 1.0 0.0 3.54 930 785 A 12 GLU H A 12 GLU HBx 1.0 0.0 3.49 931 785 A 12 GLU H A 12 GLU HBy 1.0 0.0 3.49 932 786 A 12 GLU H A 12 GLU HGy 1.0 0.0 3.70 933 786 A 12 GLU H A 12 GLU HGx 1.0 0.0 3.70 934 787 A 12 GLU HA A 15 ASP HBx 1.0 0.0 4.11 935 787 A 12 GLU HA A 15 ASP HBy 1.0 0.0 4.11 936 788 A 15 ASP H A 12 GLU HBx 1.0 0.0 5.34 937 788 A 15 ASP H A 12 GLU HBy 1.0 0.0 5.34 938 789 A 13 LEU H A 14 VAL HGx% 1.0 0.0 4.32 939 789 A 13 LEU H A 14 VAL HGy% 1.0 0.0 4.32 940 790 A 13 LEU HA A 13 LEU HDy% 1.0 0.0 3.20 941 790 A 13 LEU HA A 13 LEU HDx% 1.0 0.0 3.20 942 791 A 13 LEU HBy A 13 LEU HDy% 1.0 0.0 2.83 943 791 A 13 LEU HBx A 13 LEU HDy% 1.0 0.0 2.83 944 791 A 13 LEU HDx% A 13 LEU HBy 1.0 0.0 2.83 945 791 A 13 LEU HDx% A 13 LEU HBx 1.0 0.0 2.83 946 792 A 14 VAL H A 13 LEU HBy 1.0 0.0 4.04 947 792 A 14 VAL H A 13 LEU HBx 1.0 0.0 4.04 948 793 A 13 LEU HBx A 14 VAL HGx% 1.0 0.0 4.06 949 793 A 13 LEU HBy A 14 VAL HGx% 1.0 0.0 4.06 950 793 A 14 VAL HGy% A 13 LEU HBy 1.0 0.0 4.06 951 793 A 13 LEU HBx A 14 VAL HGy% 1.0 0.0 4.06 952 794 A 13 LEU HG A 17 LEU HDy% 1.0 0.0 4.23 953 794 A 13 LEU HG A 17 LEU HDx% 1.0 0.0 4.23 954 795 A 14 VAL H A 13 LEU HDy% 1.0 0.0 3.89 955 795 A 14 VAL H A 13 LEU HDx% 1.0 0.0 3.89 956 796 A 14 VAL HA A 13 LEU HDy% 1.0 0.0 4.66 957 796 A 14 VAL HA A 13 LEU HDx% 1.0 0.0 4.66 958 797 A 13 LEU HDx% A 14 VAL HGx% 1.0 0.0 4.16 959 797 A 13 LEU HDy% A 14 VAL HGx% 1.0 0.0 4.16 960 797 A 14 VAL HGy% A 13 LEU HDy% 1.0 0.0 4.16 961 797 A 13 LEU HDx% A 14 VAL HGy% 1.0 0.0 4.16 962 798 A 16 THR H A 13 LEU HDy% 1.0 0.0 4.79 963 798 A 16 THR H A 13 LEU HDx% 1.0 0.0 4.79 964 799 A 16 THR HB A 13 LEU HDy% 1.0 0.0 4.27 965 799 A 16 THR HB A 13 LEU HDx% 1.0 0.0 4.27 966 800 A 16 THR HG2% A 13 LEU HDy% 1.0 0.0 4.07 967 800 A 16 THR HG2% A 13 LEU HDx% 1.0 0.0 4.07 968 801 A 16 THR HG1 A 13 LEU HDy% 1.0 0.0 5.06 969 801 A 16 THR HG1 A 13 LEU HDx% 1.0 0.0 5.06 970 802 A 17 LEU H A 13 LEU HDy% 1.0 0.0 4.43 971 802 A 17 LEU H A 13 LEU HDx% 1.0 0.0 4.43 972 803 A 17 LEU HA A 13 LEU HDy% 1.0 0.0 5.09 973 803 A 17 LEU HA A 13 LEU HDx% 1.0 0.0 5.09 974 804 A 17 LEU HG A 13 LEU HDy% 1.0 0.0 3.73 975 804 A 17 LEU HG A 13 LEU HDx% 1.0 0.0 3.73 976 805 A 13 LEU HDy% A 17 LEU HDy% 1.0 0.0 2.92 977 805 A 17 LEU HDx% A 13 LEU HDy% 1.0 0.0 2.92 978 805 A 13 LEU HDx% A 17 LEU HDx% 1.0 0.0 2.92 979 805 A 13 LEU HDx% A 17 LEU HDy% 1.0 0.0 2.92 980 806 A 28 PHE HD% A 13 LEU HDy% 1.0 0.0 4.42 981 806 A 28 PHE HD% A 13 LEU HDx% 1.0 0.0 4.42 982 807 A 28 PHE HE% A 13 LEU HDy% 1.0 0.0 3.77 983 807 A 28 PHE HE% A 13 LEU HDx% 1.0 0.0 3.77 984 808 A 28 PHE HZ A 13 LEU HDy% 1.0 0.0 4.84 985 808 A 13 LEU HDx% A 28 PHE HZ 1.0 0.0 4.84 986 809 A 42 ILE HG2% A 13 LEU HDy% 1.0 0.0 2.97 987 809 A 42 ILE HG2% A 13 LEU HDx% 1.0 0.0 2.97 988 810 A 42 ILE HG1y A 13 LEU HDy% 1.0 0.0 3.09 989 810 A 42 ILE HG1y A 13 LEU HDx% 1.0 0.0 3.09 990 811 A 42 ILE HG1x A 13 LEU HDy% 1.0 0.0 3.76 991 811 A 42 ILE HG1x A 13 LEU HDx% 1.0 0.0 3.76 992 812 A 42 ILE HD1% A 13 LEU HDy% 1.0 0.0 3.20 993 812 A 42 ILE HD1% A 13 LEU HDx% 1.0 0.0 3.20 994 813 A 43 VAL H A 13 LEU HDy% 1.0 0.0 4.17 995 813 A 43 VAL H A 13 LEU HDx% 1.0 0.0 4.17 996 814 A 43 VAL HA A 13 LEU HDy% 1.0 0.0 3.40 997 814 A 43 VAL HA A 13 LEU HDx% 1.0 0.0 3.40 998 815 A 13 LEU HDy% A 43 VAL HGy% 1.0 0.0 3.80 999 815 A 13 LEU HDx% A 43 VAL HGy% 1.0 0.0 3.80 1000 815 A 43 VAL HGx% A 13 LEU HDy% 1.0 0.0 3.80 1001 815 A 13 LEU HDx% A 43 VAL HGx% 1.0 0.0 3.80 1002 816 A 46 CYS H A 13 LEU HDy% 1.0 0.0 5.44 1003 816 A 46 CYS H A 13 LEU HDx% 1.0 0.0 5.44 1004 817 A 46 CYS HA A 13 LEU HDy% 1.0 0.0 5.44 1005 817 A 46 CYS HA A 13 LEU HDx% 1.0 0.0 5.44 1006 818 A 13 LEU HDy% A 46 CYS HBx 1.0 0.0 3.31 1007 818 A 13 LEU HDx% A 46 CYS HBx 1.0 0.0 3.31 1008 818 A 46 CYS HBy A 13 LEU HDy% 1.0 0.0 3.31 1009 818 A 13 LEU HDx% A 46 CYS HBy 1.0 0.0 3.31 1010 819 A 13 LEU HDx% A 47 CYS HBx 1.0 0.0 4.71 1011 819 A 13 LEU HDy% A 47 CYS HBx 1.0 0.0 4.71 1012 819 A 47 CYS HBy A 13 LEU HDy% 1.0 0.0 4.71 1013 819 A 13 LEU HDx% A 47 CYS HBy 1.0 0.0 4.71 1014 820 A 14 VAL H A 14 VAL HGx% 1.0 0.0 2.85 1015 820 A 14 VAL H A 14 VAL HGy% 1.0 0.0 2.85 1016 821 A 14 VAL H A 17 LEU HDy% 1.0 0.0 4.68 1017 821 A 14 VAL H A 17 LEU HDx% 1.0 0.0 4.68 1018 822 A 14 VAL HA A 14 VAL HGx% 1.0 0.0 2.80 1019 822 A 14 VAL HA A 14 VAL HGy% 1.0 0.0 2.80 1020 823 A 14 VAL HA A 17 LEU HBy 1.0 0.0 3.78 1021 823 A 14 VAL HA A 17 LEU HBx 1.0 0.0 3.78 1022 824 A 14 VAL HA A 17 LEU HDy% 1.0 0.0 3.29 1023 824 A 14 VAL HA A 17 LEU HDx% 1.0 0.0 3.29 1024 825 A 15 ASP H A 14 VAL HGx% 1.0 0.0 3.40 1025 825 A 15 ASP H A 14 VAL HGy% 1.0 0.0 3.40 1026 826 A 15 ASP HA A 14 VAL HGx% 1.0 0.0 4.00 1027 826 A 15 ASP HA A 14 VAL HGy% 1.0 0.0 4.00 1028 827 A 17 LEU H A 14 VAL HGx% 1.0 0.0 5.17 1029 827 A 17 LEU H A 14 VAL HGy% 1.0 0.0 5.17 1030 828 A 14 VAL HGx% A 17 LEU HDy% 1.0 0.0 3.95 1031 828 A 14 VAL HGy% A 17 LEU HDy% 1.0 0.0 3.95 1032 828 A 17 LEU HDx% A 14 VAL HGx% 1.0 0.0 3.95 1033 828 A 14 VAL HGy% A 17 LEU HDx% 1.0 0.0 3.95 1034 829 A 18 GLN H A 14 VAL HGx% 1.0 0.0 5.32 1035 829 A 18 GLN H A 14 VAL HGy% 1.0 0.0 5.32 1036 830 A 18 GLN HA A 14 VAL HGx% 1.0 0.0 5.44 1037 830 A 18 GLN HA A 14 VAL HGy% 1.0 0.0 5.44 1038 831 A 14 VAL HGy% A 18 GLN HBy 1.0 0.0 4.26 1039 831 A 14 VAL HGx% A 18 GLN HBy 1.0 0.0 4.26 1040 831 A 18 GLN HBx A 14 VAL HGx% 1.0 0.0 4.26 1041 831 A 14 VAL HGy% A 18 GLN HBx 1.0 0.0 4.26 1042 832 A 14 VAL HGy% A 18 GLN HGx 1.0 0.0 3.35 1043 832 A 14 VAL HGx% A 18 GLN HGx 1.0 0.0 3.35 1044 832 A 18 GLN HGy A 14 VAL HGx% 1.0 0.0 3.35 1045 832 A 14 VAL HGy% A 18 GLN HGy 1.0 0.0 3.35 1046 833 A 18 GLN HE2y A 14 VAL HGx% 1.0 0.0 3.27 1047 833 A 18 GLN HE2y A 14 VAL HGy% 1.0 0.0 3.27 1048 834 A 18 GLN HE2x A 14 VAL HGx% 1.0 0.0 3.83 1049 834 A 18 GLN HE2x A 14 VAL HGy% 1.0 0.0 3.83 1050 835 A 26 PHE HD% A 14 VAL HGx% 1.0 0.0 5.44 1051 835 A 26 PHE HD% A 14 VAL HGy% 1.0 0.0 5.44 1052 836 A 28 PHE HE% A 14 VAL HGx% 1.0 0.0 3.84 1053 836 A 28 PHE HE% A 14 VAL HGy% 1.0 0.0 3.84 1054 837 A 28 PHE HZ A 14 VAL HGx% 1.0 0.0 3.58 1055 837 A 14 VAL HGy% A 28 PHE HZ 1.0 0.0 3.58 1056 838 A 15 ASP HA A 18 GLN HBy 1.0 0.0 4.06 1057 838 A 15 ASP HA A 18 GLN HBx 1.0 0.0 4.06 1058 839 A 16 THR H A 15 ASP HBx 1.0 0.0 4.05 1059 839 A 16 THR H A 15 ASP HBy 1.0 0.0 4.05 1060 840 A 16 THR H A 17 LEU HDy% 1.0 0.0 5.01 1061 840 A 16 THR H A 17 LEU HDx% 1.0 0.0 5.01 1062 841 A 16 THR HA A 20 VAL HGy% 1.0 0.0 4.58 1063 841 A 16 THR HA A 20 VAL HGx% 1.0 0.0 4.58 1064 842 A 16 THR HB A 17 LEU HBy 1.0 0.0 5.29 1065 842 A 16 THR HB A 17 LEU HBx 1.0 0.0 5.29 1066 843 A 16 THR HB A 17 LEU HDy% 1.0 0.0 4.90 1067 843 A 16 THR HB A 17 LEU HDx% 1.0 0.0 4.90 1068 844 A 16 THR HG2% A 17 LEU HDy% 1.0 0.0 4.48 1069 844 A 16 THR HG2% A 17 LEU HDx% 1.0 0.0 4.48 1070 845 A 16 THR HG2% A 19 PHE HBx 1.0 0.0 4.70 1071 845 A 16 THR HG2% A 19 PHE HBy 1.0 0.0 4.70 1072 846 A 16 THR HG2% A 20 VAL HGy% 1.0 0.0 2.99 1073 846 A 16 THR HG2% A 20 VAL HGx% 1.0 0.0 2.99 1074 847 A 17 LEU H A 17 LEU HBy 1.0 0.0 3.55 1075 847 A 17 LEU H A 17 LEU HBx 1.0 0.0 3.55 1076 848 A 17 LEU H A 17 LEU HDy% 1.0 0.0 3.38 1077 848 A 17 LEU H A 17 LEU HDx% 1.0 0.0 3.38 1078 849 A 17 LEU H A 20 VAL HGy% 1.0 0.0 4.85 1079 849 A 17 LEU H A 20 VAL HGx% 1.0 0.0 4.85 1080 850 A 17 LEU HA A 17 LEU HDy% 1.0 0.0 2.90 1081 850 A 17 LEU HA A 17 LEU HDx% 1.0 0.0 2.90 1082 851 A 17 LEU HA A 20 VAL HGy% 1.0 0.0 3.82 1083 851 A 17 LEU HA A 20 VAL HGx% 1.0 0.0 3.82 1084 852 A 17 LEU HBx A 17 LEU HDy% 1.0 0.0 2.62 1085 852 A 17 LEU HBy A 17 LEU HDy% 1.0 0.0 2.62 1086 852 A 17 LEU HDx% A 17 LEU HBy 1.0 0.0 2.62 1087 852 A 17 LEU HDx% A 17 LEU HBx 1.0 0.0 2.62 1088 853 A 18 GLN H A 17 LEU HBy 1.0 0.0 3.61 1089 853 A 18 GLN H A 17 LEU HBx 1.0 0.0 3.61 1090 854 A 18 GLN HA A 17 LEU HBy 1.0 0.0 5.34 1091 854 A 18 GLN HA A 17 LEU HBx 1.0 0.0 5.34 1092 855 A 26 PHE HD% A 17 LEU HBy 1.0 0.0 4.24 1093 855 A 26 PHE HD% A 17 LEU HBx 1.0 0.0 4.24 1094 856 A 56 LEU HDy% A 17 LEU HBy 1.0 0.0 4.45 1095 856 A 56 LEU HDy% A 17 LEU HBx 1.0 0.0 4.45 1096 857 A 18 GLN H A 17 LEU HDy% 1.0 0.0 4.65 1097 857 A 18 GLN H A 17 LEU HDx% 1.0 0.0 4.65 1098 858 A 20 VAL HB A 17 LEU HDy% 1.0 0.0 5.44 1099 858 A 20 VAL HB A 17 LEU HDx% 1.0 0.0 5.44 1100 859 A 17 LEU HDy% A 20 VAL HGy% 1.0 0.0 3.95 1101 859 A 17 LEU HDx% A 20 VAL HGy% 1.0 0.0 3.95 1102 859 A 20 VAL HGx% A 17 LEU HDy% 1.0 0.0 3.95 1103 859 A 17 LEU HDx% A 20 VAL HGx% 1.0 0.0 3.95 1104 860 A 21 CYS H A 17 LEU HDy% 1.0 0.0 4.97 1105 860 A 21 CYS H A 17 LEU HDx% 1.0 0.0 4.97 1106 861 A 26 PHE HA A 17 LEU HDy% 1.0 0.0 4.92 1107 861 A 26 PHE HA A 17 LEU HDx% 1.0 0.0 4.92 1108 862 A 26 PHE HBy A 17 LEU HDy% 1.0 0.0 3.90 1109 862 A 26 PHE HBy A 17 LEU HDx% 1.0 0.0 3.90 1110 863 A 26 PHE HBx A 17 LEU HDy% 1.0 0.0 3.73 1111 863 A 26 PHE HBx A 17 LEU HDx% 1.0 0.0 3.73 1112 864 A 26 PHE HD% A 17 LEU HDy% 1.0 0.0 3.45 1113 864 A 26 PHE HD% A 17 LEU HDx% 1.0 0.0 3.45 1114 865 A 26 PHE HE% A 17 LEU HDy% 1.0 0.0 3.88 1115 865 A 26 PHE HE% A 17 LEU HDx% 1.0 0.0 3.88 1116 866 A 26 PHE HZ A 17 LEU HDy% 1.0 0.0 5.15 1117 866 A 26 PHE HZ A 17 LEU HDx% 1.0 0.0 5.15 1118 867 A 27 TYR H A 17 LEU HDy% 1.0 0.0 4.59 1119 867 A 27 TYR H A 17 LEU HDx% 1.0 0.0 4.59 1120 868 A 28 PHE HA A 17 LEU HDy% 1.0 0.0 4.73 1121 868 A 28 PHE HA A 17 LEU HDx% 1.0 0.0 4.73 1122 869 A 28 PHE HD% A 17 LEU HDy% 1.0 0.0 3.80 1123 869 A 28 PHE HD% A 17 LEU HDx% 1.0 0.0 3.80 1124 870 A 28 PHE HE% A 17 LEU HDy% 1.0 0.0 3.52 1125 870 A 28 PHE HE% A 17 LEU HDx% 1.0 0.0 3.52 1126 871 A 42 ILE HG2% A 17 LEU HDy% 1.0 0.0 3.64 1127 871 A 42 ILE HG2% A 17 LEU HDx% 1.0 0.0 3.64 1128 872 A 42 ILE HG1y A 17 LEU HDy% 1.0 0.0 4.60 1129 872 A 42 ILE HG1y A 17 LEU HDx% 1.0 0.0 4.60 1130 873 A 42 ILE HG1x A 17 LEU HDy% 1.0 0.0 4.97 1131 873 A 42 ILE HG1x A 17 LEU HDx% 1.0 0.0 4.97 1132 874 A 56 LEU HA A 17 LEU HDy% 1.0 0.0 5.44 1133 874 A 56 LEU HA A 17 LEU HDx% 1.0 0.0 5.44 1134 875 A 56 LEU HBy A 17 LEU HDy% 1.0 0.0 5.26 1135 875 A 56 LEU HBy A 17 LEU HDx% 1.0 0.0 5.26 1136 876 A 56 LEU HBx A 17 LEU HDy% 1.0 0.0 4.69 1137 876 A 56 LEU HBx A 17 LEU HDx% 1.0 0.0 4.69 1138 877 A 56 LEU HG A 17 LEU HDy% 1.0 0.0 3.55 1139 877 A 56 LEU HG A 17 LEU HDx% 1.0 0.0 3.55 1140 878 A 56 LEU HDx% A 17 LEU HDy% 1.0 0.0 3.41 1141 878 A 56 LEU HDx% A 17 LEU HDx% 1.0 0.0 3.41 1142 879 A 56 LEU HDy% A 17 LEU HDy% 1.0 0.0 2.83 1143 879 A 56 LEU HDy% A 17 LEU HDx% 1.0 0.0 2.83 1144 880 A 17 LEU HDx% A 59 TYR HBx 1.0 0.0 3.32 1145 880 A 59 TYR HBy A 17 LEU HDy% 1.0 0.0 3.32 1146 880 A 17 LEU HDx% A 59 TYR HBy 1.0 0.0 3.32 1147 880 A 17 LEU HDy% A 59 TYR HBx 1.0 0.0 3.32 1148 881 A 59 TYR HD% A 17 LEU HDy% 1.0 0.0 4.53 1149 881 A 59 TYR HD% A 17 LEU HDx% 1.0 0.0 4.53 1150 882 A 60 CYS H A 17 LEU HDy% 1.0 0.0 4.92 1151 882 A 60 CYS H A 17 LEU HDx% 1.0 0.0 4.92 1152 883 A 18 GLN H A 18 GLN HGx 1.0 0.0 3.45 1153 883 A 18 GLN H A 18 GLN HGy 1.0 0.0 3.45 1154 884 A 18 GLN H A 20 VAL HGy% 1.0 0.0 5.42 1155 884 A 18 GLN H A 20 VAL HGx% 1.0 0.0 5.42 1156 885 A 18 GLN HA A 18 GLN HGx 1.0 0.0 3.39 1157 885 A 18 GLN HA A 18 GLN HGy 1.0 0.0 3.39 1158 886 A 18 GLN HE2y A 18 GLN HBy 1.0 0.0 4.24 1159 886 A 18 GLN HE2y A 18 GLN HBx 1.0 0.0 4.24 1160 887 A 18 GLN HE2x A 18 GLN HBy 1.0 0.0 4.70 1161 887 A 18 GLN HE2x A 18 GLN HBx 1.0 0.0 4.70 1162 888 A 26 PHE HE% A 18 GLN HGx 1.0 0.0 3.32 1163 888 A 26 PHE HE% A 18 GLN HGy 1.0 0.0 3.32 1164 889 A 19 PHE H A 20 VAL HGy% 1.0 0.0 4.49 1165 889 A 19 PHE H A 20 VAL HGx% 1.0 0.0 4.49 1166 890 A 19 PHE HA A 20 VAL HGy% 1.0 0.0 5.44 1167 890 A 19 PHE HA A 20 VAL HGx% 1.0 0.0 5.44 1168 891 A 19 PHE HBy A 20 VAL HGy% 1.0 0.0 4.52 1169 891 A 19 PHE HBx A 20 VAL HGy% 1.0 0.0 4.52 1170 891 A 20 VAL HGx% A 19 PHE HBx 1.0 0.0 4.52 1171 891 A 20 VAL HGx% A 19 PHE HBy 1.0 0.0 4.52 1172 892 A 19 PHE HD% A 20 VAL HGy% 1.0 0.0 3.62 1173 892 A 19 PHE HD% A 20 VAL HGx% 1.0 0.0 3.62 1174 893 A 19 PHE HE% A 20 VAL HGy% 1.0 0.0 5.16 1175 893 A 20 VAL HGx% A 19 PHE HE% 1.0 0.0 5.16 1176 894 A 20 VAL H A 20 VAL HGy% 1.0 0.0 3.08 1177 894 A 20 VAL H A 20 VAL HGx% 1.0 0.0 3.08 1178 895 A 20 VAL HA A 20 VAL HGy% 1.0 0.0 2.80 1179 895 A 20 VAL HA A 20 VAL HGx% 1.0 0.0 2.80 1180 896 A 21 CYS HA A 20 VAL HGy% 1.0 0.0 4.58 1181 896 A 20 VAL HGx% A 21 CYS HA 1.0 0.0 4.58 1182 897 A 20 VAL HGx% A 21 CYS HBx 1.0 0.0 5.08 1183 897 A 21 CYS HBy A 20 VAL HGy% 1.0 0.0 5.08 1184 897 A 20 VAL HGx% A 21 CYS HBy 1.0 0.0 5.08 1185 897 A 20 VAL HGy% A 21 CYS HBx 1.0 0.0 5.08 1186 898 A 53 LEU HBy A 20 VAL HGy% 1.0 0.0 5.44 1187 898 A 53 LEU HBy A 20 VAL HGx% 1.0 0.0 5.44 1188 899 A 54 ALA HA A 20 VAL HGy% 1.0 0.0 5.41 1189 899 A 54 ALA HA A 20 VAL HGx% 1.0 0.0 5.41 1190 900 A 56 LEU H A 20 VAL HGy% 1.0 0.0 5.44 1191 900 A 56 LEU H A 20 VAL HGx% 1.0 0.0 5.44 1192 901 A 56 LEU HA A 20 VAL HGy% 1.0 0.0 4.64 1193 901 A 56 LEU HA A 20 VAL HGx% 1.0 0.0 4.64 1194 902 A 56 LEU HBy A 20 VAL HGy% 1.0 0.0 4.53 1195 902 A 56 LEU HBy A 20 VAL HGx% 1.0 0.0 4.53 1196 903 A 56 LEU HBx A 20 VAL HGy% 1.0 0.0 3.35 1197 903 A 56 LEU HBx A 20 VAL HGx% 1.0 0.0 3.35 1198 904 A 56 LEU HG A 20 VAL HGy% 1.0 0.0 4.41 1199 904 A 56 LEU HG A 20 VAL HGx% 1.0 0.0 4.41 1200 905 A 56 LEU HDx% A 20 VAL HGy% 1.0 0.0 3.31 1201 905 A 56 LEU HDx% A 20 VAL HGx% 1.0 0.0 3.31 1202 906 A 56 LEU HDy% A 20 VAL HGy% 1.0 0.0 2.77 1203 906 A 56 LEU HDy% A 20 VAL HGx% 1.0 0.0 2.77 1204 907 A 57 GLU H A 20 VAL HGy% 1.0 0.0 3.60 1205 907 A 57 GLU H A 20 VAL HGx% 1.0 0.0 3.60 1206 908 A 57 GLU HA A 20 VAL HGy% 1.0 0.0 3.14 1207 908 A 57 GLU HA A 20 VAL HGx% 1.0 0.0 3.14 1208 909 A 57 GLU HBy A 20 VAL HGy% 1.0 0.0 3.26 1209 909 A 57 GLU HBy A 20 VAL HGx% 1.0 0.0 3.26 1210 910 A 57 GLU HBx A 20 VAL HGy% 1.0 0.0 4.27 1211 910 A 57 GLU HBx A 20 VAL HGx% 1.0 0.0 4.27 1212 911 A 20 VAL HGx% A 57 GLU HGy 1.0 0.0 3.25 1213 911 A 20 VAL HGy% A 57 GLU HGy 1.0 0.0 3.25 1214 911 A 57 GLU HGx A 20 VAL HGy% 1.0 0.0 3.25 1215 911 A 20 VAL HGx% A 57 GLU HGx 1.0 0.0 3.25 1216 912 A 59 TYR H A 20 VAL HGy% 1.0 0.0 5.44 1217 912 A 59 TYR H A 20 VAL HGx% 1.0 0.0 5.44 1218 913 A 21 CYS H A 21 CYS HBx 1.0 0.0 3.42 1219 913 A 21 CYS H A 21 CYS HBy 1.0 0.0 3.42 1220 914 A 21 CYS H A 22 GLY HAy 1.0 0.0 5.02 1221 914 A 21 CYS H A 22 GLY HAx 1.0 0.0 5.02 1222 915 A 22 GLY H A 21 CYS HBx 1.0 0.0 3.97 1223 915 A 22 GLY H A 21 CYS HBy 1.0 0.0 3.97 1224 916 A 26 PHE HD% A 21 CYS HBx 1.0 0.0 4.18 1225 916 A 26 PHE HD% A 21 CYS HBy 1.0 0.0 4.18 1226 917 A 60 CYS H A 21 CYS HBx 1.0 0.0 5.34 1227 917 A 60 CYS H A 21 CYS HBy 1.0 0.0 5.34 1228 918 A 21 CYS HBx A 60 CYS HBx 1.0 0.0 4.03 1229 918 A 21 CYS HBy A 60 CYS HBx 1.0 0.0 4.03 1230 918 A 60 CYS HBy A 21 CYS HBx 1.0 0.0 4.03 1231 918 A 21 CYS HBy A 60 CYS HBy 1.0 0.0 4.03 1232 919 A 61 ALA H A 21 CYS HBx 1.0 0.0 4.57 1233 919 A 61 ALA H A 21 CYS HBy 1.0 0.0 4.57 1234 920 A 61 ALA HB% A 21 CYS HBx 1.0 0.0 5.18 1235 920 A 61 ALA HB% A 21 CYS HBy 1.0 0.0 5.18 1236 921 A 23 ASP H A 23 ASP HBx 1.0 0.0 3.48 1237 921 A 23 ASP H A 23 ASP HBy 1.0 0.0 3.48 1238 922 A 24 ARG H A 24 ARG HBy 1.0 0.0 3.56 1239 922 A 24 ARG H A 24 ARG HBx 1.0 0.0 3.56 1240 923 A 24 ARG HA A 24 ARG HGy 1.0 0.0 3.66 1241 923 A 24 ARG HA A 24 ARG HGx 1.0 0.0 3.66 1242 924 A 25 GLY H A 24 ARG HBy 1.0 0.0 4.30 1243 924 A 25 GLY H A 24 ARG HBx 1.0 0.0 4.30 1244 925 A 61 ALA HB% A 24 ARG HBy 1.0 0.0 4.33 1245 925 A 61 ALA HB% A 24 ARG HBx 1.0 0.0 4.33 1246 926 A 24 ARG HE A 24 ARG HGy 1.0 0.0 3.64 1247 926 A 24 ARG HE A 24 ARG HGx 1.0 0.0 3.64 1248 927 A 26 PHE HD% A 25 GLY HAy 1.0 0.0 4.57 1249 927 A 26 PHE HD% A 25 GLY HAx 1.0 0.0 4.57 1250 928 A 61 ALA HB% A 25 GLY HAy 1.0 0.0 4.10 1251 928 A 61 ALA HB% A 25 GLY HAx 1.0 0.0 4.10 1252 929 A 27 TYR H A 27 TYR HBx 1.0 0.0 3.64 1253 929 A 27 TYR H A 27 TYR HBy 1.0 0.0 3.64 1254 930 A 28 PHE H A 28 PHE HBx 1.0 0.0 3.41 1255 930 A 28 PHE H A 28 PHE HBy 1.0 0.0 3.41 1256 931 A 29 SER H A 28 PHE HBx 1.0 0.0 3.77 1257 931 A 29 SER H A 28 PHE HBy 1.0 0.0 3.77 1258 932 A 42 ILE HG2% A 28 PHE HBx 1.0 0.0 3.84 1259 932 A 42 ILE HG2% A 28 PHE HBy 1.0 0.0 3.84 1260 933 A 28 PHE HD% A 43 VAL HGy% 1.0 0.0 4.18 1261 933 A 28 PHE HD% A 43 VAL HGx% 1.0 0.0 4.18 1262 934 A 28 PHE HE% A 43 VAL HGy% 1.0 0.0 4.30 1263 934 A 28 PHE HE% A 43 VAL HGx% 1.0 0.0 4.30 1264 935 A 30 ARG HA A 30 ARG HDx 1.0 0.0 4.00 1265 935 A 30 ARG HA A 30 ARG HDy 1.0 0.0 4.00 1266 936 A 30 ARG HA A 31 PRO HDx 1.0 0.0 3.28 1267 936 A 30 ARG HA A 31 PRO HDy 1.0 0.0 3.28 1268 937 A 30 ARG HBy A 30 ARG HDx 1.0 0.0 3.11 1269 937 A 30 ARG HBx A 30 ARG HDx 1.0 0.0 3.11 1270 937 A 30 ARG HDy A 30 ARG HBy 1.0 0.0 3.11 1271 937 A 30 ARG HDy A 30 ARG HBx 1.0 0.0 3.11 1272 938 A 30 ARG HBx A 31 PRO HDx 1.0 0.0 3.45 1273 938 A 31 PRO HDy A 30 ARG HBy 1.0 0.0 3.45 1274 938 A 31 PRO HDy A 30 ARG HBx 1.0 0.0 3.45 1275 938 A 30 ARG HBy A 31 PRO HDx 1.0 0.0 3.45 1276 939 A 30 ARG HGx A 31 PRO HDx 1.0 0.0 4.11 1277 939 A 30 ARG HGy A 31 PRO HDx 1.0 0.0 4.11 1278 939 A 31 PRO HDy A 30 ARG HGx 1.0 0.0 4.11 1279 939 A 30 ARG HGy A 31 PRO HDy 1.0 0.0 4.11 1280 940 A 32 ALA H A 31 PRO HBy 1.0 0.0 3.35 1281 940 A 32 ALA H A 31 PRO HBx 1.0 0.0 3.35 1282 941 A 34 ARG H A 33 SER HBy 1.0 0.0 3.42 1283 941 A 34 ARG H A 33 SER HBx 1.0 0.0 3.42 1284 942 A 35 VAL H A 33 SER HBy 1.0 0.0 3.88 1285 942 A 35 VAL H A 33 SER HBx 1.0 0.0 3.88 1286 943 A 35 VAL HGx% A 33 SER HBy 1.0 0.0 4.73 1287 943 A 35 VAL HGx% A 33 SER HBx 1.0 0.0 4.73 1288 944 A 35 VAL HGy% A 33 SER HBy 1.0 0.0 4.20 1289 944 A 35 VAL HGy% A 33 SER HBx 1.0 0.0 4.20 1290 945 A 34 ARG HBy A 34 ARG HDx 1.0 0.0 3.16 1291 945 A 34 ARG HBx A 34 ARG HDx 1.0 0.0 3.16 1292 945 A 34 ARG HDy A 34 ARG HBy 1.0 0.0 3.16 1293 945 A 34 ARG HDy A 34 ARG HBx 1.0 0.0 3.16 1294 946 A 35 VAL HGx% A 34 ARG HBy 1.0 0.0 4.00 1295 946 A 35 VAL HGx% A 34 ARG HBx 1.0 0.0 4.00 1296 947 A 35 VAL HGy% A 34 ARG HBy 1.0 0.0 4.52 1297 947 A 35 VAL HGy% A 34 ARG HBx 1.0 0.0 4.52 1298 948 A 35 VAL HGy% A 36 SER HBy 1.0 0.0 5.26 1299 948 A 35 VAL HGy% A 36 SER HBx 1.0 0.0 5.26 1300 949 A 36 SER H A 36 SER HBy 1.0 0.0 3.13 1301 949 A 36 SER H A 36 SER HBx 1.0 0.0 3.13 1302 950 A 37 ARG H A 36 SER HBy 1.0 0.0 4.29 1303 950 A 37 ARG H A 36 SER HBx 1.0 0.0 4.29 1304 951 A 38 ARG H A 36 SER HBy 1.0 0.0 4.31 1305 951 A 38 ARG H A 36 SER HBx 1.0 0.0 4.31 1306 952 A 37 ARG H A 37 ARG HBy 1.0 0.0 3.27 1307 952 A 37 ARG H A 37 ARG HBx 1.0 0.0 3.27 1308 953 A 37 ARG HBy A 37 ARG HDx 1.0 0.0 3.42 1309 953 A 37 ARG HBx A 37 ARG HDx 1.0 0.0 3.42 1310 953 A 37 ARG HDy A 37 ARG HBy 1.0 0.0 3.42 1311 953 A 37 ARG HDy A 37 ARG HBx 1.0 0.0 3.42 1312 954 A 38 ARG H A 38 ARG HBy 1.0 0.0 3.08 1313 954 A 38 ARG H A 38 ARG HBx 1.0 0.0 3.08 1314 955 A 38 ARG HBx A 38 ARG HDx 1.0 0.0 2.89 1315 955 A 38 ARG HBy A 38 ARG HDx 1.0 0.0 2.89 1316 955 A 38 ARG HDy A 38 ARG HBy 1.0 0.0 2.89 1317 955 A 38 ARG HDy A 38 ARG HBx 1.0 0.0 2.89 1318 956 A 39 SER H A 38 ARG HBy 1.0 0.0 4.18 1319 956 A 39 SER H A 38 ARG HBx 1.0 0.0 4.18 1320 957 A 40 ARG H A 40 ARG HBy 1.0 0.0 3.17 1321 957 A 40 ARG H A 40 ARG HBx 1.0 0.0 3.17 1322 958 A 40 ARG HE A 40 ARG HBy 1.0 0.0 3.99 1323 958 A 40 ARG HE A 40 ARG HBx 1.0 0.0 3.99 1324 959 A 41 GLY H A 40 ARG HBy 1.0 0.0 3.54 1325 959 A 41 GLY H A 40 ARG HBx 1.0 0.0 3.54 1326 960 A 40 ARG HGx A 41 GLY HAy 1.0 0.0 4.21 1327 960 A 40 ARG HGy A 41 GLY HAy 1.0 0.0 4.21 1328 960 A 41 GLY HAx A 40 ARG HGx 1.0 0.0 4.21 1329 960 A 40 ARG HGy A 41 GLY HAx 1.0 0.0 4.21 1330 961 A 40 ARG HDy A 41 GLY HAy 1.0 0.0 4.97 1331 961 A 40 ARG HDx A 41 GLY HAy 1.0 0.0 4.97 1332 961 A 41 GLY HAx A 40 ARG HDx 1.0 0.0 4.97 1333 961 A 40 ARG HDy A 41 GLY HAx 1.0 0.0 4.97 1334 962 A 41 GLY H A 44 GLU HBx 1.0 0.0 4.08 1335 962 A 41 GLY H A 44 GLU HBy 1.0 0.0 4.08 1336 963 A 42 ILE HG2% A 41 GLY HAy 1.0 0.0 4.32 1337 963 A 42 ILE HG2% A 41 GLY HAx 1.0 0.0 4.32 1338 964 A 59 TYR HE% A 41 GLY HAy 1.0 0.0 4.80 1339 964 A 59 TYR HE% A 41 GLY HAx 1.0 0.0 4.80 1340 965 A 42 ILE H A 43 VAL HGy% 1.0 0.0 4.39 1341 965 A 42 ILE H A 43 VAL HGx% 1.0 0.0 4.39 1342 966 A 42 ILE HA A 44 GLU HBx 1.0 0.0 5.34 1343 966 A 42 ILE HA A 44 GLU HBy 1.0 0.0 5.34 1344 967 A 42 ILE HA A 45 GLU HBx 1.0 0.0 4.14 1345 967 A 42 ILE HA A 45 GLU HBy 1.0 0.0 4.14 1346 968 A 42 ILE HA A 45 GLU HGy 1.0 0.0 4.56 1347 968 A 42 ILE HA A 45 GLU HGx 1.0 0.0 4.56 1348 969 A 42 ILE HG2% A 46 CYS HBx 1.0 0.0 5.34 1349 969 A 42 ILE HG2% A 46 CYS HBy 1.0 0.0 5.34 1350 970 A 42 ILE HG2% A 59 TYR HBx 1.0 0.0 5.18 1351 970 A 42 ILE HG2% A 59 TYR HBy 1.0 0.0 5.18 1352 971 A 42 ILE HG1x A 46 CYS HBx 1.0 0.0 4.56 1353 971 A 42 ILE HG1x A 46 CYS HBy 1.0 0.0 4.56 1354 972 A 42 ILE HD1% A 45 GLU HBx 1.0 0.0 4.58 1355 972 A 42 ILE HD1% A 45 GLU HBy 1.0 0.0 4.58 1356 973 A 42 ILE HD1% A 46 CYS HBx 1.0 0.0 5.32 1357 973 A 42 ILE HD1% A 46 CYS HBy 1.0 0.0 5.32 1358 974 A 42 ILE HD1% A 51 CYS HBx 1.0 0.0 5.34 1359 974 A 42 ILE HD1% A 51 CYS HBy 1.0 0.0 5.34 1360 975 A 42 ILE HD1% A 59 TYR HBx 1.0 0.0 3.51 1361 975 A 42 ILE HD1% A 59 TYR HBy 1.0 0.0 3.51 1362 976 A 43 VAL H A 43 VAL HGy% 1.0 0.0 2.87 1363 976 A 43 VAL H A 43 VAL HGx% 1.0 0.0 2.87 1364 977 A 44 GLU H A 43 VAL HGy% 1.0 0.0 3.41 1365 977 A 44 GLU H A 43 VAL HGx% 1.0 0.0 3.41 1366 978 A 44 GLU HA A 43 VAL HGy% 1.0 0.0 4.04 1367 978 A 44 GLU HA A 43 VAL HGx% 1.0 0.0 4.04 1368 979 A 44 GLU HGy A 43 VAL HGy% 1.0 0.0 5.21 1369 979 A 44 GLU HGy A 43 VAL HGx% 1.0 0.0 5.21 1370 980 A 44 GLU HGx A 43 VAL HGy% 1.0 0.0 4.73 1371 980 A 44 GLU HGx A 43 VAL HGx% 1.0 0.0 4.73 1372 981 A 45 GLU H A 43 VAL HGy% 1.0 0.0 4.93 1373 981 A 45 GLU H A 43 VAL HGx% 1.0 0.0 4.93 1374 982 A 46 CYS H A 43 VAL HGy% 1.0 0.0 4.97 1375 982 A 46 CYS H A 43 VAL HGx% 1.0 0.0 4.97 1376 983 A 43 VAL HGx% A 46 CYS HBx 1.0 0.0 5.28 1377 983 A 43 VAL HGy% A 46 CYS HBx 1.0 0.0 5.28 1378 983 A 46 CYS HBy A 43 VAL HGy% 1.0 0.0 5.28 1379 983 A 46 CYS HBy A 43 VAL HGx% 1.0 0.0 5.28 1380 984 A 47 CYS H A 43 VAL HGy% 1.0 0.0 3.84 1381 984 A 47 CYS H A 43 VAL HGx% 1.0 0.0 3.84 1382 985 A 47 CYS HA A 43 VAL HGy% 1.0 0.0 4.62 1383 985 A 43 VAL HGx% A 47 CYS HA 1.0 0.0 4.62 1384 986 A 43 VAL HGy% A 47 CYS HBx 1.0 0.0 3.20 1385 986 A 43 VAL HGx% A 47 CYS HBx 1.0 0.0 3.20 1386 986 A 47 CYS HBy A 43 VAL HGy% 1.0 0.0 3.20 1387 986 A 43 VAL HGx% A 47 CYS HBy 1.0 0.0 3.20 1388 987 A 48 PHE H A 43 VAL HGy% 1.0 0.0 4.08 1389 987 A 48 PHE H A 43 VAL HGx% 1.0 0.0 4.08 1390 988 A 48 PHE HBy A 43 VAL HGy% 1.0 0.0 4.61 1391 988 A 48 PHE HBy A 43 VAL HGx% 1.0 0.0 4.61 1392 989 A 48 PHE HBx A 43 VAL HGy% 1.0 0.0 5.44 1393 989 A 48 PHE HBx A 43 VAL HGx% 1.0 0.0 5.44 1394 990 A 48 PHE HD% A 43 VAL HGy% 1.0 0.0 3.65 1395 990 A 48 PHE HD% A 43 VAL HGx% 1.0 0.0 3.65 1396 991 A 48 PHE HE% A 43 VAL HGy% 1.0 0.0 3.43 1397 991 A 48 PHE HE% A 43 VAL HGx% 1.0 0.0 3.43 1398 992 A 48 PHE HZ A 43 VAL HGy% 1.0 0.0 4.56 1399 992 A 43 VAL HGx% A 48 PHE HZ 1.0 0.0 4.56 1400 993 A 44 GLU H A 44 GLU HBx 1.0 0.0 3.16 1401 993 A 44 GLU H A 44 GLU HBy 1.0 0.0 3.16 1402 994 A 48 PHE HD% A 44 GLU HBx 1.0 0.0 4.86 1403 994 A 48 PHE HD% A 44 GLU HBy 1.0 0.0 4.86 1404 995 A 45 GLU H A 45 GLU HBx 1.0 0.0 3.61 1405 995 A 45 GLU H A 45 GLU HBy 1.0 0.0 3.61 1406 996 A 45 GLU H A 45 GLU HGy 1.0 0.0 3.68 1407 996 A 45 GLU H A 45 GLU HGx 1.0 0.0 3.68 1408 997 A 45 GLU HBy A 55 LEU HDx% 1.0 0.0 2.89 1409 997 A 45 GLU HBx A 55 LEU HDx% 1.0 0.0 2.89 1410 997 A 55 LEU HDy% A 45 GLU HBx 1.0 0.0 2.89 1411 997 A 55 LEU HDy% A 45 GLU HBy 1.0 0.0 2.89 1412 998 A 45 GLU HGx A 55 LEU HDx% 1.0 0.0 3.33 1413 998 A 45 GLU HGy A 55 LEU HDx% 1.0 0.0 3.33 1414 998 A 55 LEU HDy% A 45 GLU HGy 1.0 0.0 3.33 1415 998 A 55 LEU HDy% A 45 GLU HGx 1.0 0.0 3.33 1416 999 A 46 CYS HA A 51 CYS HBx 1.0 0.0 4.13 1417 999 A 46 CYS HA A 51 CYS HBy 1.0 0.0 4.13 1418 1000 A 49 ARG H A 49 ARG HGy 1.0 0.0 3.65 1419 1000 A 49 ARG H A 49 ARG HGx 1.0 0.0 3.65 1420 1001 A 49 ARG HA A 49 ARG HGy 1.0 0.0 3.47 1421 1001 A 49 ARG HA A 49 ARG HGx 1.0 0.0 3.47 1422 1002 A 49 ARG HE A 49 ARG HBy 1.0 0.0 4.58 1423 1002 A 49 ARG HBx A 49 ARG HE 1.0 0.0 4.58 1424 1003 A 50 SER H A 49 ARG HBy 1.0 0.0 3.18 1425 1003 A 50 SER H A 49 ARG HBx 1.0 0.0 3.18 1426 1004 A 49 ARG HBy A 50 SER HBx 1.0 0.0 4.47 1427 1004 A 49 ARG HBx A 50 SER HBx 1.0 0.0 4.47 1428 1004 A 50 SER HBy A 49 ARG HBy 1.0 0.0 4.47 1429 1004 A 50 SER HBy A 49 ARG HBx 1.0 0.0 4.47 1430 1005 A 50 SER H A 49 ARG HGy 1.0 0.0 3.73 1431 1005 A 50 SER H A 49 ARG HGx 1.0 0.0 3.73 1432 1006 A 52 ASP H A 51 CYS HBx 1.0 0.0 3.38 1433 1006 A 52 ASP H A 51 CYS HBy 1.0 0.0 3.38 1434 1007 A 55 LEU HG A 51 CYS HBx 1.0 0.0 4.54 1435 1007 A 55 LEU HG A 51 CYS HBy 1.0 0.0 4.54 1436 1008 A 51 CYS HBx A 55 LEU HDx% 1.0 0.0 3.16 1437 1008 A 55 LEU HDy% A 51 CYS HBx 1.0 0.0 3.16 1438 1008 A 55 LEU HDy% A 51 CYS HBy 1.0 0.0 3.16 1439 1008 A 51 CYS HBy A 55 LEU HDx% 1.0 0.0 3.16 1440 1009 A 56 LEU HDx% A 51 CYS HBx 1.0 0.0 4.56 1441 1009 A 56 LEU HDx% A 51 CYS HBy 1.0 0.0 4.56 1442 1010 A 52 ASP H A 55 LEU HBy 1.0 0.0 3.63 1443 1010 A 52 ASP H A 55 LEU HBx 1.0 0.0 3.63 1444 1011 A 53 LEU H A 52 ASP HBx 1.0 0.0 3.78 1445 1011 A 53 LEU H A 52 ASP HBy 1.0 0.0 3.78 1446 1012 A 53 LEU HA A 53 LEU HDy% 1.0 0.0 2.97 1447 1012 A 53 LEU HA A 53 LEU HDx% 1.0 0.0 2.97 1448 1013 A 54 ALA H A 53 LEU HDy% 1.0 0.0 4.12 1449 1013 A 54 ALA H A 53 LEU HDx% 1.0 0.0 4.12 1450 1014 A 54 ALA HA A 53 LEU HDy% 1.0 0.0 4.18 1451 1014 A 54 ALA HA A 53 LEU HDx% 1.0 0.0 4.18 1452 1015 A 54 ALA HB% A 53 LEU HDy% 1.0 0.0 4.94 1453 1015 A 54 ALA HB% A 53 LEU HDx% 1.0 0.0 4.94 1454 1016 A 56 LEU HBy A 53 LEU HDy% 1.0 0.0 5.18 1455 1016 A 56 LEU HBy A 53 LEU HDx% 1.0 0.0 5.18 1456 1017 A 56 LEU HBx A 53 LEU HDy% 1.0 0.0 3.53 1457 1017 A 56 LEU HBx A 53 LEU HDx% 1.0 0.0 3.53 1458 1018 A 54 ALA HB% A 55 LEU HBy 1.0 0.0 4.24 1459 1018 A 54 ALA HB% A 55 LEU HBx 1.0 0.0 4.24 1460 1019 A 55 LEU HBx A 55 LEU HDx% 1.0 0.0 2.73 1461 1019 A 55 LEU HBy A 55 LEU HDx% 1.0 0.0 2.73 1462 1019 A 55 LEU HDy% A 55 LEU HBy 1.0 0.0 2.73 1463 1019 A 55 LEU HDy% A 55 LEU HBx 1.0 0.0 2.73 1464 1020 A 56 LEU H A 55 LEU HBy 1.0 0.0 3.61 1465 1020 A 56 LEU H A 55 LEU HBx 1.0 0.0 3.61 1466 1021 A 56 LEU HDy% A 57 GLU HGy 1.0 0.0 5.34 1467 1021 A 56 LEU HDy% A 57 GLU HGx 1.0 0.0 5.34 1468 1022 A 57 GLU H A 57 GLU HGy 1.0 0.0 4.10 1469 1022 A 57 GLU H A 57 GLU HGx 1.0 0.0 4.10 1470 1023 A 57 GLU HA A 57 GLU HGy 1.0 0.0 3.26 1471 1023 A 57 GLU HA A 57 GLU HGx 1.0 0.0 3.26 1472 1024 A 58 THR H A 57 GLU HGy 1.0 0.0 5.26 1473 1024 A 58 THR H A 57 GLU HGx 1.0 0.0 5.26 1474 1025 A 58 THR HG2% A 57 GLU HGy 1.0 0.0 4.78 1475 1025 A 58 THR HG2% A 57 GLU HGx 1.0 0.0 4.78 1476 1026 A 59 TYR H A 59 TYR HBx 1.0 0.0 3.66 1477 1026 A 59 TYR H A 59 TYR HBy 1.0 0.0 3.66 1478 1027 A 60 CYS H A 59 TYR HBx 1.0 0.0 4.03 1479 1027 A 60 CYS H A 59 TYR HBy 1.0 0.0 4.03 1480 1028 A 60 CYS H A 60 CYS HBx 1.0 0.0 3.25 1481 1028 A 60 CYS H A 60 CYS HBy 1.0 0.0 3.25 1482 1029 A 61 ALA H A 60 CYS HBx 1.0 0.0 3.99 1483 1029 A 61 ALA H A 60 CYS HBy 1.0 0.0 3.99 1484 1030 A 61 ALA HB% A 60 CYS HBx 1.0 0.0 4.57 1485 1030 A 61 ALA HB% A 60 CYS HBy 1.0 0.0 4.57 1486 1031 A 61 ALA HB% A 63 PRO HDy 1.0 0.0 5.35 1487 1031 A 61 ALA HB% A 63 PRO HDx 1.0 0.0 5.35 1488 1032 A 62 THR H A 63 PRO HDy 1.0 0.0 4.41 1489 1032 A 62 THR H A 63 PRO HDx 1.0 0.0 4.41 1490 1033 A 62 THR HA A 63 PRO HGy 1.0 0.0 4.29 1491 1033 A 62 THR HA A 63 PRO HGx 1.0 0.0 4.29 1492 1034 A 62 THR HB A 63 PRO HDy 1.0 0.0 3.70 1493 1034 A 62 THR HB A 63 PRO HDx 1.0 0.0 3.70 1494 1035 A 62 THR HG2% A 63 PRO HDy 1.0 0.0 3.81 1495 1035 A 62 THR HG2% A 63 PRO HDx 1.0 0.0 3.81 1496 1036 A 65 LYS H A 65 LYS HBy 1.0 0.0 3.08 1497 1036 A 65 LYS H A 65 LYS HBx 1.0 0.0 3.08 1498 1037 A 67 GLU HBy A 67 GLU HGx 1.0 0.0 2.31 1499 1037 A 67 GLU HBx A 67 GLU HGx 1.0 0.0 2.31 1500 1037 A 67 GLU HGy A 67 GLU HBy 1.0 0.0 2.31 1501 1037 A 67 GLU HBx A 67 GLU HGy 1.0 0.0 2.31 1502 1038 A 9 CYS SG A 47 CYS SG 1.0 0.0 2.10 1503 1039 A 9 CYS SG A 47 CYS CB 1.0 0.0 3.10 1504 1040 A 47 CYS SG A 9 CYS CB 1.0 0.0 3.10 1505 1041 A 21 CYS SG A 60 CYS SG 1.0 0.0 2.10 1506 1042 A 21 CYS SG A 60 CYS CB 1.0 0.0 3.10 1507 1043 A 60 CYS SG A 21 CYS CB 1.0 0.0 3.10 1508 1044 A 46 CYS SG A 51 CYS SG 1.0 0.0 2.10 1509 1045 A 46 CYS SG A 51 CYS CB 1.0 0.0 3.10 1510 1046 A 51 CYS SG A 46 CYS CB 1.0 0.0 3.10 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 11 GLY C A 12 GLU N A 12 GLU CA A 12 GLU C 1.0 -79.0 -55.0 PHI 2 2 A 12 GLU N A 12 GLU CA A 12 GLU C A 13 LEU N 1.0 -51.0 -27.0 PSI 3 3 A 12 GLU C A 13 LEU N A 13 LEU CA A 13 LEU C 1.0 -74.0 -54.0 PHI 4 4 A 13 LEU N A 13 LEU CA A 13 LEU C A 14 VAL N 1.0 -54.0 -34.0 PSI 5 5 A 13 LEU C A 14 VAL N A 14 VAL CA A 14 VAL C 1.0 -72.0 -48.0 PHI 6 6 A 14 VAL N A 14 VAL CA A 14 VAL C A 15 ASP N 1.0 -57.0 -33.0 PSI 7 7 A 14 VAL C A 15 ASP N A 15 ASP CA A 15 ASP C 1.0 -71.0 -51.0 PHI 8 8 A 15 ASP N A 15 ASP CA A 15 ASP C A 16 THR N 1.0 -61.0 -21.0 PSI 9 9 A 15 ASP C A 16 THR N A 16 THR CA A 16 THR C 1.0 -84.0 -52.0 PHI 10 10 A 16 THR N A 16 THR CA A 16 THR C A 17 LEU N 1.0 -53.0 -25.0 PSI 11 11 A 16 THR C A 17 LEU N A 17 LEU CA A 17 LEU C 1.0 -72.0 -52.0 PHI 12 12 A 17 LEU N A 17 LEU CA A 17 LEU C A 18 GLN N 1.0 -57.0 -37.0 PSI 13 13 A 17 LEU C A 18 GLN N A 18 GLN CA A 18 GLN C 1.0 -77.0 -53.0 PHI 14 14 A 18 GLN N A 18 GLN CA A 18 GLN C A 19 PHE N 1.0 -59.0 -15.0 PSI 15 15 A 18 GLN C A 19 PHE N A 19 PHE CA A 19 PHE C 1.0 -79.0 -47.0 PHI 16 16 A 19 PHE N A 19 PHE CA A 19 PHE C A 20 VAL N 1.0 -57.0 -25.0 PSI 17 17 A 22 GLY C A 23 ASP N A 23 ASP CA A 23 ASP C 1.0 -78.0 -50.0 PHI 18 18 A 23 ASP N A 23 ASP CA A 23 ASP C A 24 ARG N 1.0 -49.0 -1.0 PSI 19 19 A 23 ASP C A 24 ARG N A 24 ARG CA A 24 ARG C 1.0 -86.0 -54.0 PHI 20 20 A 24 ARG N A 24 ARG CA A 24 ARG C A 25 GLY N 1.0 -52.0 -8.0 PSI 21 21 A 25 GLY C A 26 PHE N A 26 PHE CA A 26 PHE C 1.0 -174.0 -102.0 PHI 22 22 A 26 PHE N A 26 PHE CA A 26 PHE C A 27 TYR N 1.0 123.0 187.0 PSI 23 23 A 26 PHE C A 27 TYR N A 27 TYR CA A 27 TYR C 1.0 -185.0 -73.0 PHI 24 24 A 27 TYR N A 27 TYR CA A 27 TYR C A 28 PHE N 1.0 143.0 179.0 PSI 25 25 A 27 TYR C A 28 PHE N A 28 PHE CA A 28 PHE C 1.0 -164.0 -32.0 PHI 26 26 A 28 PHE N A 28 PHE CA A 28 PHE C A 29 SER N 1.0 126.0 182.0 PSI 27 27 A 41 GLY C A 42 ILE N A 42 ILE CA A 42 ILE C 1.0 -90.0 -38.0 PHI 28 28 A 42 ILE N A 42 ILE CA A 42 ILE C A 43 VAL N 1.0 -56.0 -8.0 PSI 29 29 A 42 ILE C A 43 VAL N A 43 VAL CA A 43 VAL C 1.0 -72.0 -48.0 PHI 30 30 A 43 VAL N A 43 VAL CA A 43 VAL C A 44 GLU N 1.0 -65.0 -21.0 PSI 31 31 A 43 VAL C A 44 GLU N A 44 GLU CA A 44 GLU C 1.0 -78.0 -50.0 PHI 32 32 A 44 GLU N A 44 GLU CA A 44 GLU C A 45 GLU N 1.0 -67.0 -19.0 PSI 33 33 A 44 GLU C A 45 GLU N A 45 GLU CA A 45 GLU C 1.0 -120.0 -72.0 PHI 34 34 A 45 GLU N A 45 GLU CA A 45 GLU C A 46 CYS N 1.0 -75.0 29.0 PSI 35 35 A 52 ASP C A 53 LEU N A 53 LEU CA A 53 LEU C 1.0 -76.0 -44.0 PHI 36 36 A 53 LEU N A 53 LEU CA A 53 LEU C A 54 ALA N 1.0 -54.0 -26.0 PSI 37 37 A 53 LEU C A 54 ALA N A 54 ALA CA A 54 ALA C 1.0 -73.0 -53.0 PHI 38 38 A 54 ALA N A 54 ALA CA A 54 ALA C A 55 LEU N 1.0 -52.0 -28.0 PSI 39 39 A 54 ALA C A 55 LEU N A 55 LEU CA A 55 LEU C 1.0 -73.0 -53.0 PHI 40 40 A 55 LEU N A 55 LEU CA A 55 LEU C A 56 LEU N 1.0 -55.0 -31.0 PSI 41 41 A 55 LEU C A 56 LEU N A 56 LEU CA A 56 LEU C 1.0 -87.0 -47.0 PHI 42 42 A 56 LEU N A 56 LEU CA A 56 LEU C A 57 GLU N 1.0 -62.0 -22.0 PSI 43 43 A 56 LEU C A 57 GLU N A 57 GLU CA A 57 GLU C 1.0 -74.0 -54.0 PHI 44 44 A 57 GLU N A 57 GLU CA A 57 GLU C A 58 THR N 1.0 -55.0 -7.0 PSI 45 45 A 57 GLU C A 58 THR N A 58 THR CA A 58 THR C 1.0 -96.0 -44.0 PHI 46 46 A 58 THR N A 58 THR CA A 58 THR C A 59 TYR N 1.0 -55.0 -19.0 PSI stop_ save_