data_nef_c18449_2lsw save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_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 19 GLY start . false 2 A 20 PRO middle . false 3 A 21 LEU middle . . 4 A 22 GLY middle . false 5 A 23 SER middle . . 6 A 24 SER middle . . 7 A 25 LYS middle . . 8 A 26 LYS middle . . 9 A 27 GLU middle . . 10 A 28 LYS middle . . 11 A 29 LYS middle . . 12 A 30 LYS middle . . 13 A 31 GLY middle . false 14 A 32 PRO middle . false 15 A 33 GLU middle . . 16 A 34 LYS middle . . 17 A 35 THR middle . . 18 A 36 ASP middle . . 19 A 37 GLU middle . . 20 A 38 TYR middle . . 21 A 39 LEU middle . . 22 A 40 LEU middle . . 23 A 41 ALA middle . . 24 A 42 ARG middle . . 25 A 43 PHE middle . . 26 A 44 LYS middle . . 27 A 45 GLY middle . false 28 A 46 ASP middle . . 29 A 47 GLY middle . false 30 A 48 VAL middle . . 31 A 49 LYS middle . . 32 A 50 TYR middle . . 33 A 51 LYS middle . . 34 A 52 ALA middle . . 35 A 53 LYS middle . . 36 A 54 LEU middle . . 37 A 55 ILE middle . . 38 A 56 GLY middle . false 39 A 57 ILE middle . . 40 A 58 ASP end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 24 SER H H 1 8.407 0.02 A 24 SER HA H 1 4.477 0.02 A 24 SER HB2 H 1 3.871 0.02 A 24 SER HB3 H 1 3.871 0.02 A 24 SER C C 13 171.886 0.2 A 24 SER CA C 13 54.814 0.2 A 24 SER CB C 13 59.958 0.2 A 24 SER N N 15 118.052 0.2 A 25 LYS H H 1 8.318 0.02 A 25 LYS HA H 1 4.432 0.02 A 25 LYS HBx H 1 1.728 0.02 A 25 LYS HBy H 1 1.728 0.02 A 25 LYS HGx H 1 1.448 0.02 A 25 LYS HGy H 1 1.448 0.02 A 25 LYS C C 13 173.780 0.2 A 25 LYS CA C 13 52.743 0.2 A 25 LYS CB C 13 29.179 0.2 A 25 LYS N N 15 123.163 0.2 A 26 LYS H H 1 8.271 0.02 A 26 LYS HA H 1 4.283 0.02 A 26 LYS HBx H 1 1.737 0.02 A 26 LYS HBy H 1 1.737 0.02 A 26 LYS HGx H 1 1.401 0.02 A 26 LYS HGy H 1 1.401 0.02 A 26 LYS C C 13 173.736 0.2 A 26 LYS CA C 13 52.621 0.2 A 26 LYS CB C 13 29.325 0.2 A 26 LYS N N 15 122.612 0.2 A 27 GLU H H 1 8.350 0.02 A 27 GLU HA H 1 4.268 0.02 A 27 GLU HBy H 1 1.981 0.02 A 27 GLU HBx H 1 1.894 0.02 A 27 GLU HGx H 1 2.231 0.02 A 27 GLU HGy H 1 2.231 0.02 A 27 GLU C C 13 173.562 0.2 A 27 GLU CA C 13 52.535 0.2 A 27 GLU CB C 13 26.714 0.2 A 27 GLU N N 15 122.511 0.2 A 28 LYS H H 1 8.392 0.02 A 28 LYS HA H 1 4.255 0.02 A 28 LYS HBx H 1 1.742 0.02 A 28 LYS HBy H 1 1.742 0.02 A 28 LYS HGx H 1 1.415 0.02 A 28 LYS HGy H 1 1.415 0.02 A 28 LYS C C 13 173.649 0.2 A 28 LYS CA C 13 52.503 0.2 A 28 LYS CB C 13 29.336 0.2 A 28 LYS N N 15 123.542 0.2 A 29 LYS H H 1 8.367 0.02 A 29 LYS HA H 1 4.261 0.02 A 29 LYS HBx H 1 1.735 0.02 A 29 LYS HBy H 1 1.735 0.02 A 29 LYS HGx H 1 1.419 0.02 A 29 LYS HGy H 1 1.419 0.02 A 29 LYS C C 13 173.668 0.2 A 29 LYS CA C 13 52.457 0.2 A 29 LYS CB C 13 29.346 0.2 A 29 LYS N N 15 123.541 0.2 A 30 LYS H H 1 8.440 0.02 A 30 LYS HA H 1 4.303 0.02 A 30 LYS HBx H 1 1.772 0.02 A 30 LYS HBy H 1 1.772 0.02 A 30 LYS HGx H 1 1.439 0.02 A 30 LYS HGy H 1 1.439 0.02 A 30 LYS C C 13 174.004 0.2 A 30 LYS CA C 13 52.522 0.2 A 30 LYS CB C 13 29.553 0.2 A 30 LYS N N 15 123.696 0.2 A 31 GLY H H 1 8.318 0.02 A 31 GLY HAy H 1 4.178 0.02 A 31 GLY HAx H 1 3.993 0.02 A 31 GLY C C 13 168.877 0.2 A 31 GLY CA C 13 40.520 0.2 A 31 GLY N N 15 110.736 0.2 A 32 PRO HA H 1 4.402 0.02 A 32 PRO HBy H 1 2.238 0.02 A 32 PRO HBx H 1 1.880 0.02 A 32 PRO HDx H 1 3.591 0.02 A 32 PRO HDy H 1 3.591 0.02 A 32 PRO HGx H 1 1.977 0.02 A 32 PRO HGy H 1 1.977 0.02 A 32 PRO C C 13 174.308 0.2 A 32 PRO CA C 13 59.186 0.2 A 32 PRO CB C 13 28.434 0.2 A 33 GLU H H 1 8.589 0.02 A 33 GLU HA H 1 4.262 0.02 A 33 GLU HBy H 1 2.032 0.02 A 33 GLU HBx H 1 1.925 0.02 A 33 GLU HGx H 1 2.304 0.02 A 33 GLU HGy H 1 2.304 0.02 A 33 GLU C C 13 173.883 0.2 A 33 GLU CA C 13 52.751 0.2 A 33 GLU CB C 13 26.538 0.2 A 33 GLU N N 15 121.419 0.2 A 34 LYS H H 1 8.471 0.02 A 34 LYS HA H 1 4.394 0.02 A 34 LYS HBy H 1 1.943 0.02 A 34 LYS HBx H 1 1.756 0.02 A 34 LYS HDx H 1 1.689 0.02 A 34 LYS HDy H 1 1.689 0.02 A 34 LYS HGx H 1 1.454 0.02 A 34 LYS HGy H 1 1.454 0.02 A 34 LYS C C 13 174.352 0.2 A 34 LYS CA C 13 52.548 0.2 A 34 LYS CB C 13 29.297 0.2 A 34 LYS N N 15 122.500 0.2 A 35 THR H H 1 8.356 0.02 A 35 THR HA H 1 4.151 0.02 A 35 THR HB H 1 4.112 0.02 A 35 THR HG2% H 1 1.198 0.02 A 35 THR C C 13 172.139 0.2 A 35 THR CA C 13 60.091 0.2 A 35 THR CB C 13 65.388 0.2 A 35 THR N N 15 116.471 0.2 A 36 ASP H H 1 8.655 0.02 A 36 ASP HA H 1 4.412 0.02 A 36 ASP HBx H 1 2.670 0.02 A 36 ASP HBy H 1 2.670 0.02 A 36 ASP C C 13 173.604 0.2 A 36 ASP CA C 13 51.553 0.2 A 36 ASP CB C 13 35.813 0.2 A 36 ASP N N 15 120.494 0.2 A 37 GLU H H 1 8.034 0.02 A 37 GLU HA H 1 4.094 0.02 A 37 GLU HBx H 1 1.997 0.02 A 37 GLU HBy H 1 1.997 0.02 A 37 GLU HGy H 1 2.309 0.02 A 37 GLU HGx H 1 2.245 0.02 A 37 GLU C C 13 174.696 0.2 A 37 GLU CA C 13 54.159 0.2 A 37 GLU CB C 13 25.855 0.2 A 37 GLU N N 15 120.459 0.2 A 38 TYR H H 1 8.245 0.02 A 38 TYR HA H 1 4.400 0.02 A 38 TYR HBy H 1 3.154 0.02 A 38 TYR HBx H 1 3.085 0.02 A 38 TYR HDx H 1 7.113 0.02 A 38 TYR HDy H 1 7.113 0.02 A 38 TYR HEx H 1 6.793 0.02 A 38 TYR HEy H 1 6.793 0.02 A 38 TYR C C 13 174.195 0.2 A 38 TYR CA C 13 55.793 0.2 A 38 TYR CB C 13 34.569 0.2 A 38 TYR N N 15 120.652 0.2 A 39 LEU H H 1 8.348 0.02 A 39 LEU HA H 1 3.952 0.02 A 39 LEU HBy H 1 1.853 0.02 A 39 LEU HBx H 1 1.760 0.02 A 39 LEU HDx% H 1 0.931 0.02 A 39 LEU HDy% H 1 0.931 0.02 A 39 LEU HG H 1 1.469 0.02 A 39 LEU C C 13 175.464 0.2 A 39 LEU CA C 13 53.934 0.2 A 39 LEU CB C 13 38.514 0.2 A 39 LEU N N 15 120.954 0.2 A 40 LEU H H 1 8.097 0.02 A 40 LEU HA H 1 4.084 0.02 A 40 LEU HBx H 1 1.730 0.02 A 40 LEU HBy H 1 1.730 0.02 A 40 LEU HDx% H 1 0.931 0.02 A 40 LEU HDy% H 1 0.931 0.02 A 40 LEU HG H 1 1.470 0.02 A 40 LEU C C 13 175.709 0.2 A 40 LEU CA C 13 53.513 0.2 A 40 LEU CB C 13 37.771 0.2 A 40 LEU N N 15 117.546 0.2 A 41 ALA H H 1 7.829 0.02 A 41 ALA HA H 1 4.072 0.02 A 41 ALA HB% H 1 1.446 0.02 A 41 ALA C C 13 177.428 0.2 A 41 ALA CA C 13 51.126 0.2 A 41 ALA CB C 13 14.780 0.2 A 41 ALA N N 15 120.206 0.2 A 42 ARG H H 1 7.888 0.02 A 42 ARG HA H 1 4.056 0.02 A 42 ARG HBx H 1 1.593 0.02 A 42 ARG HBy H 1 1.593 0.02 A 42 ARG HDy H 1 2.998 0.02 A 42 ARG HDx H 1 2.911 0.02 A 42 ARG HE H 1 7.428 0.02 A 42 ARG HGy H 1 1.255 0.02 A 42 ARG HGx H 1 1.179 0.02 A 42 ARG C C 13 174.758 0.2 A 42 ARG CA C 13 53.809 0.2 A 42 ARG CB C 13 25.921 0.2 A 42 ARG N N 15 117.440 0.2 A 43 PHE H H 1 7.955 0.02 A 43 PHE HA H 1 4.572 0.02 A 43 PHE HBy H 1 3.307 0.02 A 43 PHE HBx H 1 2.960 0.02 A 43 PHE HDx H 1 7.232 0.02 A 43 PHE HDy H 1 7.232 0.02 A 43 PHE HEx H 1 7.171 0.02 A 43 PHE HEy H 1 7.171 0.02 A 43 PHE C C 13 173.259 0.2 A 43 PHE CA C 13 54.930 0.2 A 43 PHE CB C 13 35.522 0.2 A 43 PHE N N 15 117.423 0.2 A 44 LYS H H 1 7.929 0.02 A 44 LYS HA H 1 4.074 0.02 A 44 LYS HBx H 1 1.883 0.02 A 44 LYS HBy H 1 1.883 0.02 A 44 LYS HDx H 1 1.685 0.02 A 44 LYS HDy H 1 1.685 0.02 A 44 LYS HGx H 1 1.533 0.02 A 44 LYS HGy H 1 1.533 0.02 A 44 LYS C C 13 174.903 0.2 A 44 LYS CA C 13 54.765 0.2 A 44 LYS CB C 13 28.883 0.2 A 44 LYS N N 15 119.081 0.2 A 45 GLY H H 1 8.416 0.02 A 45 GLY HAy H 1 3.985 0.02 A 45 GLY HAx H 1 3.898 0.02 A 45 GLY C C 13 172.596 0.2 A 45 GLY CA C 13 42.389 0.2 A 45 GLY N N 15 108.400 0.2 A 46 ASP H H 1 8.345 0.02 A 46 ASP HA H 1 4.610 0.02 A 46 ASP HBy H 1 2.866 0.02 A 46 ASP HBx H 1 2.696 0.02 A 46 ASP C C 13 174.568 0.2 A 46 ASP CA C 13 51.540 0.2 A 46 ASP CB C 13 36.249 0.2 A 46 ASP N N 15 120.595 0.2 A 47 GLY H H 1 8.587 0.02 A 47 GLY HAx H 1 3.825 0.02 A 47 GLY HAy H 1 3.825 0.02 A 47 GLY C C 13 172.152 0.2 A 47 GLY CA C 13 43.502 0.2 A 47 GLY N N 15 108.925 0.2 A 48 VAL H H 1 7.979 0.02 A 48 VAL HA H 1 3.764 0.02 A 48 VAL HB H 1 2.115 0.02 A 48 VAL HG1% H 1 1.047 0.02 A 48 VAL HG2% H 1 0.947 0.02 A 48 VAL C C 13 174.894 0.2 A 48 VAL CA C 13 61.430 0.2 A 48 VAL CB C 13 28.106 0.2 A 48 VAL N N 15 119.548 0.2 A 49 LYS H H 1 7.862 0.02 A 49 LYS HA H 1 4.059 0.02 A 49 LYS HBx H 1 1.718 0.02 A 49 LYS HBy H 1 1.718 0.02 A 49 LYS HDx H 1 1.672 0.02 A 49 LYS HDy H 1 1.672 0.02 A 49 LYS HGx H 1 1.424 0.02 A 49 LYS HGy H 1 1.424 0.02 A 49 LYS C C 13 175.545 0.2 A 49 LYS CA C 13 54.765 0.2 A 49 LYS CB C 13 28.675 0.2 A 49 LYS N N 15 120.856 0.2 A 50 TYR H H 1 8.006 0.02 A 50 TYR HA H 1 4.376 0.02 A 50 TYR HBy H 1 3.053 0.02 A 50 TYR HBx H 1 2.926 0.02 A 50 TYR HDx H 1 7.056 0.02 A 50 TYR HDy H 1 7.056 0.02 A 50 TYR HEx H 1 6.791 0.02 A 50 TYR HEy H 1 6.791 0.02 A 50 TYR C C 13 174.292 0.2 A 50 TYR CA C 13 56.534 0.2 A 50 TYR CB C 13 34.319 0.2 A 50 TYR N N 15 117.994 0.2 A 51 LYS H H 1 8.119 0.02 A 51 LYS HA H 1 3.932 0.02 A 51 LYS HBy H 1 1.950 0.02 A 51 LYS HBx H 1 1.894 0.02 A 51 LYS HDx H 1 1.674 0.02 A 51 LYS HDy H 1 1.674 0.02 A 51 LYS HGx H 1 1.438 0.02 A 51 LYS HGy H 1 1.438 0.02 A 51 LYS C C 13 174.680 0.2 A 51 LYS CA C 13 55.577 0.2 A 51 LYS CB C 13 28.509 0.2 A 51 LYS N N 15 120.354 0.2 A 52 ALA H H 1 7.968 0.02 A 52 ALA HA H 1 4.072 0.02 A 52 ALA HB% H 1 1.435 0.02 A 52 ALA C C 13 176.530 0.2 A 52 ALA CA C 13 50.718 0.2 A 52 ALA CB C 13 14.812 0.2 A 52 ALA N N 15 120.186 0.2 A 53 LYS H H 1 7.712 0.02 A 53 LYS HA H 1 4.126 0.02 A 53 LYS HBy H 1 1.960 0.02 A 53 LYS HBx H 1 1.892 0.02 A 53 LYS HEx H 1 2.946 0.02 A 53 LYS HEy H 1 2.946 0.02 A 53 LYS HGx H 1 1.528 0.02 A 53 LYS HGy H 1 1.528 0.02 A 53 LYS C C 13 174.833 0.2 A 53 LYS CA C 13 53.962 0.2 A 53 LYS CB C 13 28.773 0.2 A 53 LYS N N 15 116.894 0.2 A 54 LEU H H 1 7.826 0.02 A 54 LEU HA H 1 4.181 0.02 A 54 LEU HBx H 1 1.790 0.02 A 54 LEU HBy H 1 1.790 0.02 A 54 LEU HDx% H 1 0.883 0.02 A 54 LEU HDy% H 1 0.883 0.02 A 54 LEU HG H 1 1.550 0.02 A 54 LEU C C 13 174.274 0.2 A 54 LEU CA C 13 52.844 0.2 A 54 LEU CB C 13 38.948 0.2 A 54 LEU N N 15 118.047 0.2 A 55 ILE H H 1 7.663 0.02 A 55 ILE HA H 1 4.190 0.02 A 55 ILE HB H 1 1.984 0.02 A 55 ILE HD1% H 1 0.866 0.02 A 55 ILE HG1y H 1 1.504 0.02 A 55 ILE HG1x H 1 1.275 0.02 A 55 ILE HG2% H 1 0.905 0.02 A 55 ILE C C 13 173.572 0.2 A 55 ILE CA C 13 57.711 0.2 A 55 ILE CB C 13 34.774 0.2 A 55 ILE N N 15 113.992 0.2 A 56 GLY H H 1 8.008 0.02 A 56 GLY HAy H 1 4.122 0.02 A 56 GLY HAx H 1 3.913 0.02 A 56 GLY C C 13 171.340 0.2 A 56 GLY CA C 13 41.754 0.2 A 56 GLY N N 15 109.333 0.2 A 57 ILE H H 1 7.762 0.02 A 57 ILE HA H 1 4.199 0.02 A 57 ILE HB H 1 1.882 0.02 A 57 ILE HG1y H 1 1.457 0.02 A 57 ILE HG1x H 1 1.140 0.02 A 57 ILE HG2% H 1 0.885 0.02 A 57 ILE C C 13 171.858 0.2 A 57 ILE CA C 13 57.508 0.2 A 57 ILE CB C 13 35.215 0.2 A 57 ILE N N 15 117.833 0.2 A 58 ASP H H 1 7.882 0.02 A 58 ASP HA H 1 4.423 0.02 A 58 ASP HBy H 1 2.721 0.02 A 58 ASP HBx H 1 2.591 0.02 A 58 ASP C C 13 176.607 0.2 A 58 ASP CA C 13 50.638 0.2 A 58 ASP CB C 13 36.952 0.2 A 58 ASP N N 15 125.807 0.2 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 27 GLU HA A 27 GLU H 1.0 1.8 2.7 2 2 A 27 GLU HGy A 27 GLU HBx 1.0 1.8 2.7 3 2 A 27 GLU HBx A 27 GLU HGx 1.0 1.8 2.7 4 3 A 27 GLU HGy A 27 GLU HBy 1.0 1.8 2.7 5 3 A 27 GLU HBy A 27 GLU HGx 1.0 1.8 2.7 6 4 A 29 LYS HA A 29 LYS HBx 1.0 1.8 2.7 7 4 A 29 LYS HA A 29 LYS HBy 1.0 1.8 2.7 8 5 A 29 LYS HA A 29 LYS H 1.0 1.8 2.7 9 6 A 29 LYS H A 29 LYS HBx 1.0 1.8 2.7 10 6 A 29 LYS HBy A 29 LYS H 1.0 1.8 2.7 11 7 A 30 LYS HA A 31 GLY H 1.0 1.8 2.7 12 8 A 30 LYS H A 30 LYS HBx 1.0 1.8 2.7 13 8 A 30 LYS HBy A 30 LYS H 1.0 1.8 2.7 14 9 A 31 GLY H A 31 GLY HAx 1.0 1.8 2.7 15 10 A 31 GLY HAx A 32 PRO HDx 1.0 1.8 2.7 16 10 A 31 GLY HAx A 32 PRO HDy 1.0 1.8 2.7 17 11 A 31 GLY H A 31 GLY HAy 1.0 1.8 2.7 18 12 A 31 GLY HAy A 32 PRO HDx 1.0 1.8 2.7 19 12 A 32 PRO HDy A 31 GLY HAy 1.0 1.8 2.7 20 13 A 32 PRO HA A 32 PRO HBx 1.0 1.8 2.7 21 14 A 32 PRO HA A 32 PRO HBy 1.0 1.8 2.7 22 15 A 32 PRO HA A 33 GLU H 1.0 1.8 2.7 23 16 A 32 PRO HBx A 32 PRO HBy 1.0 1.8 2.7 24 17 A 32 PRO HBx A 32 PRO HBy 1.0 1.8 2.7 25 18 A 32 PRO HBy A 32 PRO HGx 1.0 1.8 2.7 26 18 A 32 PRO HBy A 32 PRO HGy 1.0 1.8 2.7 27 19 A 32 PRO HDx A 32 PRO HGx 1.0 1.8 2.7 28 19 A 32 PRO HDy A 32 PRO HGx 1.0 1.8 2.7 29 19 A 32 PRO HGy A 32 PRO HDx 1.0 1.8 2.7 30 19 A 32 PRO HDy A 32 PRO HGy 1.0 1.8 2.7 31 20 A 32 PRO HBy A 32 PRO HGx 1.0 1.8 2.7 32 20 A 32 PRO HBy A 32 PRO HGy 1.0 1.8 2.7 33 21 A 33 GLU HA A 34 LYS H 1.0 1.8 2.7 34 22 A 33 GLU HBy A 33 GLU HBx 1.0 1.8 2.7 35 23 A 33 GLU H A 33 GLU HBx 1.0 1.8 2.7 36 24 A 33 GLU HBy A 33 GLU HBx 1.0 1.8 2.7 37 25 A 33 GLU HGy A 33 GLU HBy 1.0 1.8 2.7 38 25 A 33 GLU HBy A 33 GLU HGx 1.0 1.8 2.7 39 26 A 34 LYS HA A 34 LYS HBy 1.0 1.8 2.7 40 27 A 34 LYS HA A 35 THR H 1.0 1.8 3.3 41 28 A 35 THR HA A 35 THR HG2% 1.0 1.8 2.7 42 29 A 35 THR HG2% A 35 THR HB 1.0 1.8 2.7 43 30 A 36 ASP HA A 36 ASP HBx 1.0 1.8 2.7 44 30 A 36 ASP HA A 36 ASP HBy 1.0 1.8 2.7 45 31 A 37 GLU HA A 37 GLU HBx 1.0 1.8 2.7 46 31 A 37 GLU HA A 37 GLU HBy 1.0 1.8 2.7 47 32 A 37 GLU HA A 37 GLU H 1.0 1.8 2.7 48 33 A 37 GLU HA A 38 TYR H 1.0 1.8 3.3 49 34 A 37 GLU HBx A 37 GLU HGy 1.0 1.8 2.7 50 34 A 37 GLU HBy A 37 GLU HGy 1.0 1.8 2.7 51 35 A 37 GLU H A 37 GLU HBx 1.0 1.8 2.7 52 35 A 37 GLU HBy A 37 GLU H 1.0 1.8 2.7 53 36 A 37 GLU HBx A 37 GLU HGy 1.0 1.8 2.7 54 36 A 37 GLU HBy A 37 GLU HGy 1.0 1.8 2.7 55 37 A 38 TYR HA A 38 TYR HD% 1.0 1.8 3.3 56 38 A 38 TYR HA A 39 LEU H 1.0 1.8 3.3 57 39 A 38 TYR HA A 41 ALA HB% 1.0 1.8 2.7 58 40 A 38 TYR HD% A 38 TYR HBx 1.0 1.8 2.7 59 41 A 38 TYR HD% A 38 TYR HBy 1.0 1.8 2.7 60 42 A 38 TYR HD% A 38 TYR HE% 1.0 1.8 2.7 61 43 A 38 TYR HD% A 38 TYR HE% 1.0 1.8 2.7 62 44 A 39 LEU HA A 39 LEU HDx% 1.0 1.8 2.7 63 44 A 39 LEU HA A 39 LEU HDy% 1.0 1.8 2.7 64 45 A 39 LEU HG A 39 LEU HDx% 1.0 1.8 2.7 65 45 A 39 LEU HDy% A 39 LEU HG 1.0 1.8 2.7 66 46 A 40 LEU HA A 40 LEU HBx 1.0 1.8 2.7 67 46 A 40 LEU HA A 40 LEU HBy 1.0 1.8 2.7 68 47 A 40 LEU HA A 40 LEU HDx% 1.0 1.8 2.7 69 47 A 40 LEU HA A 40 LEU HDy% 1.0 1.8 2.7 70 48 A 40 LEU HA A 40 LEU H 1.0 1.8 2.7 71 49 A 40 LEU H A 40 LEU HBx 1.0 1.8 2.7 72 49 A 40 LEU HBy A 40 LEU H 1.0 1.8 2.7 73 50 A 41 ALA HB% A 41 ALA HA 1.0 1.8 2.7 74 51 A 41 ALA HA A 41 ALA H 1.0 1.8 2.7 75 52 A 41 ALA HB% A 41 ALA H 1.0 1.8 2.7 76 53 A 42 ARG HA A 42 ARG H 1.0 1.8 2.7 77 54 A 42 ARG HBx A 42 ARG HGy 1.0 1.8 2.7 78 54 A 42 ARG HBy A 42 ARG HGy 1.0 1.8 2.7 79 55 A 42 ARG H A 43 PHE H 1.0 1.8 2.7 80 56 A 43 PHE HA A 43 PHE HD% 1.0 1.8 2.7 81 57 A 43 PHE HD% A 43 PHE HE% 1.0 1.8 2.7 82 58 A 43 PHE HD% A 43 PHE HE% 1.0 1.8 2.7 83 59 A 44 LYS HA A 44 LYS HBx 1.0 1.8 2.7 84 59 A 44 LYS HA A 44 LYS HBy 1.0 1.8 2.7 85 60 A 44 LYS HA A 44 LYS HDx 1.0 1.8 2.7 86 60 A 44 LYS HA A 44 LYS HDy 1.0 1.8 2.7 87 61 A 44 LYS HA A 44 LYS HGx 1.0 1.8 2.7 88 61 A 44 LYS HA A 44 LYS HGy 1.0 1.8 2.7 89 62 A 44 LYS HA A 44 LYS H 1.0 1.8 2.7 90 63 A 44 LYS H A 44 LYS HBx 1.0 1.8 2.7 91 63 A 44 LYS HBy A 44 LYS H 1.0 1.8 2.7 92 64 A 47 GLY H A 47 GLY HAx 1.0 1.8 2.7 93 64 A 47 GLY HAy A 47 GLY H 1.0 1.8 2.7 94 65 A 48 VAL HB A 48 VAL HG1% 1.0 1.8 2.7 95 66 A 48 VAL HB A 48 VAL HG2% 1.0 1.8 2.7 96 67 A 48 VAL HB A 48 VAL H 1.0 1.8 2.7 97 68 A 48 VAL HB A 48 VAL HG1% 1.0 1.8 2.7 98 69 A 48 VAL HG2% A 48 VAL HG1% 1.0 1.8 2.7 99 70 A 48 VAL H A 48 VAL HG1% 1.0 1.8 2.7 100 71 A 48 VAL HB A 48 VAL HG2% 1.0 1.8 2.7 101 72 A 48 VAL HG2% A 48 VAL HG1% 1.0 1.8 2.7 102 73 A 49 LYS HA A 49 LYS H 1.0 1.8 2.7 103 74 A 49 LYS H A 49 LYS HBx 1.0 1.8 3.3 104 74 A 49 LYS H A 49 LYS HBy 1.0 1.8 3.3 105 75 A 50 TYR HA A 50 TYR HD% 1.0 1.8 3.3 106 76 A 50 TYR HBy A 50 TYR HBx 1.0 1.8 2.7 107 77 A 50 TYR HD% A 50 TYR HBx 1.0 1.8 2.7 108 78 A 50 TYR HD% A 50 TYR HBy 1.0 1.8 2.7 109 79 A 50 TYR HD% A 50 TYR HE% 1.0 1.8 2.7 110 80 A 50 TYR HD% A 50 TYR HE% 1.0 1.8 2.7 111 81 A 51 LYS HA A 51 LYS HGx 1.0 1.8 2.7 112 81 A 51 LYS HA A 51 LYS HGy 1.0 1.8 2.7 113 82 A 52 ALA HA A 52 ALA HB% 1.0 1.8 2.7 114 83 A 52 ALA HA A 52 ALA H 1.0 1.8 2.7 115 84 A 52 ALA HB% A 52 ALA H 1.0 1.8 2.7 116 85 A 53 LYS HA A 53 LYS HGx 1.0 1.8 2.7 117 85 A 53 LYS HA A 53 LYS HGy 1.0 1.8 2.7 118 86 A 53 LYS H A 53 LYS HBy 1.0 1.8 2.7 119 87 A 54 LEU HA A 54 LEU HBx 1.0 1.8 2.7 120 87 A 54 LEU HA A 54 LEU HBy 1.0 1.8 2.7 121 88 A 54 LEU HA A 54 LEU HG 1.0 1.8 2.7 122 89 A 54 LEU HA A 54 LEU HDx% 1.0 1.8 2.7 123 89 A 54 LEU HA A 54 LEU HDy% 1.0 1.8 2.7 124 90 A 54 LEU H A 54 LEU HBx 1.0 1.8 2.7 125 90 A 54 LEU HBy A 54 LEU H 1.0 1.8 2.7 126 91 A 54 LEU HG A 54 LEU H 1.0 1.8 2.7 127 92 A 54 LEU H A 55 ILE H 1.0 1.8 2.7 128 93 A 55 ILE HA A 55 ILE HB 1.0 1.8 2.7 129 94 A 55 ILE HA A 55 ILE HD1% 1.0 1.8 2.7 130 95 A 55 ILE HA A 55 ILE HG1x 1.0 1.8 2.7 131 96 A 55 ILE HA A 55 ILE HG2% 1.0 1.8 3.3 132 97 A 55 ILE H A 55 ILE HA 1.0 1.8 2.7 133 98 A 55 ILE H A 55 ILE HB 1.0 1.8 2.7 134 99 A 55 ILE HG2% A 56 GLY H 1.0 1.8 2.7 135 100 A 54 LEU H A 55 ILE H 1.0 1.8 2.7 136 101 A 56 GLY H A 56 GLY HAx 1.0 1.8 2.7 137 102 A 56 GLY H A 56 GLY HAy 1.0 1.8 2.7 138 103 A 56 GLY H A 57 ILE H 1.0 1.8 2.7 139 104 A 57 ILE HA A 57 ILE HB 1.0 1.8 2.7 140 105 A 57 ILE H A 57 ILE HA 1.0 1.8 2.7 141 106 A 57 ILE HA A 57 ILE HG2% 1.0 1.8 2.7 142 107 A 57 ILE HA A 58 ASP H 1.0 1.8 2.7 143 108 A 57 ILE H A 57 ILE HB 1.0 1.8 3.3 144 109 A 57 ILE H A 57 ILE HG1y 1.0 1.8 2.7 145 110 A 57 ILE H A 57 ILE HG2% 1.0 1.8 2.7 146 111 A 57 ILE HG2% A 58 ASP H 1.0 1.8 5.0 147 112 A 56 GLY H A 57 ILE H 1.0 1.8 2.7 148 113 A 58 ASP HA A 58 ASP HBy 1.0 1.8 2.7 149 114 A 58 ASP H A 58 ASP HA 1.0 1.8 2.7 150 115 A 58 ASP HBy A 58 ASP HBx 1.0 1.8 2.7 151 116 A 58 ASP HBy A 58 ASP HBx 1.0 1.8 2.7 152 117 A 27 GLU HA A 27 GLU HBx 1.0 1.8 3.3 153 118 A 27 GLU H A 27 GLU HBx 1.0 1.8 3.3 154 119 A 29 LYS HA A 29 LYS HGx 1.0 1.8 3.3 155 119 A 29 LYS HA A 29 LYS HGy 1.0 1.8 3.3 156 120 A 30 LYS HA A 30 LYS HBx 1.0 1.8 3.3 157 120 A 30 LYS HA A 30 LYS HBy 1.0 1.8 3.3 158 121 A 32 PRO HA A 32 PRO HGx 1.0 1.8 3.3 159 121 A 32 PRO HA A 32 PRO HGy 1.0 1.8 3.3 160 122 A 32 PRO HBx A 32 PRO HDx 1.0 1.8 3.3 161 122 A 32 PRO HDy A 32 PRO HBx 1.0 1.8 3.3 162 123 A 33 GLU HA A 33 GLU HBx 1.0 1.8 3.3 163 124 A 33 GLU HA A 33 GLU HBy 1.0 1.8 3.3 164 125 A 33 GLU H A 33 GLU HA 1.0 1.8 3.3 165 126 A 33 GLU HGy A 33 GLU HBx 1.0 1.8 3.3 166 126 A 33 GLU HBx A 33 GLU HGx 1.0 1.8 3.3 167 127 A 34 LYS H A 33 GLU HBx 1.0 1.8 3.3 168 128 A 33 GLU H A 33 GLU HBy 1.0 1.8 3.3 169 129 A 33 GLU H A 34 LYS H 1.0 1.8 3.3 170 130 A 34 LYS HA A 34 LYS HBx 1.0 1.8 3.3 171 131 A 34 LYS HA A 34 LYS HDx 1.0 1.8 3.3 172 131 A 34 LYS HA A 34 LYS HDy 1.0 1.8 3.3 173 132 A 34 LYS HA A 34 LYS HGx 1.0 1.8 3.3 174 132 A 34 LYS HA A 34 LYS HGy 1.0 1.8 3.3 175 133 A 34 LYS H A 34 LYS HA 1.0 1.8 3.3 176 134 A 34 LYS H A 34 LYS HBx 1.0 1.8 3.3 177 135 A 34 LYS H A 34 LYS HBy 1.0 1.8 3.3 178 136 A 33 GLU H A 34 LYS H 1.0 1.8 3.3 179 137 A 35 THR H A 35 THR HA 1.0 1.8 3.3 180 138 A 35 THR H A 35 THR HB 1.0 1.8 3.3 181 139 A 35 THR HB A 36 ASP H 1.0 1.8 3.3 182 140 A 36 ASP HA A 36 ASP H 1.0 1.8 3.3 183 141 A 36 ASP HA A 37 GLU H 1.0 1.8 3.3 184 142 A 36 ASP H A 36 ASP HBx 1.0 1.8 3.3 185 142 A 36 ASP HBy A 36 ASP H 1.0 1.8 3.3 186 143 A 38 TYR H A 38 TYR HA 1.0 1.8 3.3 187 144 A 38 TYR H A 38 TYR HBx 1.0 1.8 3.3 188 145 A 38 TYR H A 38 TYR HBy 1.0 1.8 3.3 189 146 A 38 TYR H A 38 TYR HD% 1.0 1.8 3.3 190 147 A 38 TYR H A 38 TYR HD% 1.0 1.8 3.3 191 148 A 39 LEU HA A 39 LEU HBx 1.0 1.8 3.3 192 149 A 39 LEU HA A 39 LEU HBy 1.0 1.8 3.3 193 150 A 39 LEU HA A 39 LEU HG 1.0 1.8 3.3 194 151 A 39 LEU H A 39 LEU HA 1.0 1.8 3.3 195 152 A 38 TYR HD% A 34 LYS HBx 1.0 1.8 3.3 196 153 A 39 LEU H A 39 LEU HBx 1.0 1.8 3.3 197 154 A 39 LEU H A 39 LEU HDx% 1.0 1.8 3.3 198 154 A 39 LEU H A 39 LEU HDy% 1.0 1.8 3.3 199 155 A 40 LEU H A 40 LEU HDx% 1.0 1.8 3.3 200 155 A 40 LEU HDy% A 40 LEU H 1.0 1.8 3.3 201 156 A 43 PHE HD% A 40 LEU HDx% 1.0 1.8 3.3 202 156 A 40 LEU HDy% A 43 PHE HD% 1.0 1.8 3.3 203 157 A 43 PHE HE% A 40 LEU HDx% 1.0 1.8 3.3 204 157 A 40 LEU HDy% A 43 PHE HE% 1.0 1.8 3.3 205 158 A 41 ALA H A 42 ARG H 1.0 1.8 3.3 206 159 A 42 ARG H A 42 ARG HBx 1.0 1.8 3.3 207 159 A 42 ARG H A 42 ARG HBy 1.0 1.8 3.3 208 160 A 42 ARG HE A 42 ARG HDx 1.0 1.8 3.3 209 161 A 42 ARG HE A 42 ARG HDy 1.0 1.8 3.3 210 162 A 41 ALA H A 42 ARG H 1.0 1.8 3.3 211 163 A 43 PHE HD% A 43 PHE HBx 1.0 1.8 3.3 212 164 A 43 PHE H A 43 PHE HBx 1.0 1.8 3.3 213 165 A 43 PHE HBx A 43 PHE HBy 1.0 1.8 3.3 214 166 A 43 PHE HD% A 43 PHE HBy 1.0 1.8 3.3 215 167 A 42 ARG H A 43 PHE H 1.0 1.8 3.3 216 168 A 43 PHE H A 43 PHE HD% 1.0 1.8 3.3 217 169 A 44 LYS HA A 45 GLY H 1.0 1.8 3.3 218 170 A 44 LYS H A 44 LYS HDx 1.0 1.8 3.3 219 170 A 44 LYS HDy A 44 LYS H 1.0 1.8 3.3 220 171 A 44 LYS H A 44 LYS HGx 1.0 1.8 3.3 221 171 A 44 LYS HGy A 44 LYS H 1.0 1.8 3.3 222 172 A 45 GLY H A 45 GLY HAx 1.0 1.8 3.3 223 173 A 45 GLY H A 45 GLY HAy 1.0 1.8 3.3 224 174 A 46 ASP H A 45 GLY HAy 1.0 1.8 3.3 225 175 A 45 GLY H A 46 ASP H 1.0 1.8 3.3 226 176 A 46 ASP HA A 46 ASP HBx 1.0 1.8 3.3 227 177 A 46 ASP H A 46 ASP HA 1.0 1.8 3.3 228 178 A 46 ASP HBy A 46 ASP HBx 1.0 1.8 3.3 229 179 A 46 ASP H A 46 ASP HBx 1.0 1.8 3.3 230 180 A 46 ASP HBy A 46 ASP HBx 1.0 1.8 3.3 231 181 A 46 ASP H A 46 ASP HBy 1.0 1.8 3.3 232 182 A 45 GLY H A 46 ASP H 1.0 1.8 3.3 233 183 A 48 VAL H A 47 GLY HAx 1.0 1.8 3.3 234 183 A 47 GLY HAy A 48 VAL H 1.0 1.8 3.3 235 184 A 48 VAL HB A 48 VAL HA 1.0 1.8 3.3 236 185 A 48 VAL H A 48 VAL HA 1.0 1.8 3.3 237 186 A 49 LYS H A 48 VAL HG2% 1.0 1.8 3.3 238 187 A 48 VAL H A 49 LYS H 1.0 1.8 3.3 239 188 A 49 LYS H A 49 LYS HDx 1.0 1.8 5.0 240 188 A 49 LYS H A 49 LYS HDy 1.0 1.8 5.0 241 189 A 49 LYS H A 49 LYS HGx 1.0 1.8 3.3 242 189 A 49 LYS H A 49 LYS HGy 1.0 1.8 3.3 243 190 A 48 VAL H A 49 LYS H 1.0 1.8 3.3 244 191 A 49 LYS H A 50 TYR H 1.0 1.8 3.3 245 192 A 50 TYR HA A 50 TYR HBy 1.0 1.8 3.3 246 193 A 50 TYR HA A 50 TYR H 1.0 1.8 3.3 247 194 A 50 TYR HE% A 50 TYR HBx 1.0 1.8 5.0 248 195 A 50 TYR H A 50 TYR HBx 1.0 1.8 3.3 249 196 A 50 TYR HBy A 50 TYR HBx 1.0 1.8 3.3 250 197 A 50 TYR H A 50 TYR HBy 1.0 1.8 3.3 251 198 A 49 LYS H A 50 TYR H 1.0 1.8 3.3 252 199 A 50 TYR HD% A 50 TYR H 1.0 1.8 3.3 253 200 A 50 TYR H A 51 LYS H 1.0 1.8 3.3 254 201 A 51 LYS HA A 51 LYS HBx 1.0 1.8 3.3 255 202 A 51 LYS HA A 51 LYS HBy 1.0 1.8 3.3 256 203 A 51 LYS HA A 51 LYS HDx 1.0 1.8 3.3 257 203 A 51 LYS HA A 51 LYS HDy 1.0 1.8 3.3 258 204 A 51 LYS HA A 51 LYS H 1.0 1.8 3.3 259 205 A 51 LYS HA A 52 ALA H 1.0 1.8 3.3 260 206 A 51 LYS H A 51 LYS HBx 1.0 1.8 3.3 261 207 A 51 LYS H A 51 LYS HBy 1.0 1.8 3.3 262 208 A 51 LYS H A 51 LYS HGx 1.0 1.8 3.3 263 208 A 51 LYS HGy A 51 LYS H 1.0 1.8 3.3 264 209 A 50 TYR H A 51 LYS H 1.0 1.8 3.3 265 210 A 52 ALA HA A 53 LYS H 1.0 1.8 3.3 266 211 A 52 ALA HB% A 53 LYS H 1.0 1.8 3.3 267 212 A 53 LYS HA A 53 LYS H 1.0 1.8 3.3 268 213 A 53 LYS HA A 56 GLY H 1.0 1.8 3.3 269 214 A 53 LYS H A 53 LYS HBx 1.0 1.8 3.3 270 215 A 54 LEU H A 53 LYS HBx 1.0 1.8 3.3 271 216 A 54 LEU H A 53 LYS HBy 1.0 1.8 3.3 272 217 A 53 LYS H A 53 LYS HGx 1.0 1.8 3.3 273 217 A 53 LYS HGy A 53 LYS H 1.0 1.8 3.3 274 218 A 53 LYS H A 54 LEU H 1.0 1.8 3.3 275 219 A 54 LEU HA A 54 LEU H 1.0 1.8 3.3 276 220 A 54 LEU HA A 55 ILE H 1.0 1.8 3.3 277 221 A 54 LEU H A 54 LEU HDx% 1.0 1.8 3.3 278 221 A 54 LEU HDy% A 54 LEU H 1.0 1.8 3.3 279 222 A 53 LYS H A 54 LEU H 1.0 1.8 3.3 280 223 A 55 ILE HB A 56 GLY H 1.0 1.8 3.3 281 224 A 55 ILE H A 55 ILE HD1% 1.0 1.8 3.3 282 225 A 55 ILE H A 55 ILE HG1y 1.0 1.8 3.3 283 226 A 55 ILE H A 55 ILE HG2% 1.0 1.8 3.3 284 227 A 55 ILE H A 56 GLY H 1.0 1.8 3.3 285 228 A 56 GLY HAx A 57 ILE H 1.0 1.8 3.3 286 229 A 56 GLY HAy A 57 ILE H 1.0 1.8 3.3 287 230 A 55 ILE H A 56 GLY H 1.0 1.8 3.3 288 231 A 57 ILE HB A 58 ASP H 1.0 1.8 3.3 289 232 A 57 ILE H A 57 ILE HG1x 1.0 1.8 3.3 290 233 A 57 ILE H A 58 ASP H 1.0 1.8 3.3 291 234 A 58 ASP HA A 58 ASP HBx 1.0 1.8 3.3 292 235 A 58 ASP H A 58 ASP HBx 1.0 1.8 3.3 293 236 A 58 ASP H A 58 ASP HBy 1.0 1.8 3.3 294 237 A 57 ILE H A 58 ASP H 1.0 1.8 3.3 295 238 A 26 LYS HA A 26 LYS H 1.0 1.8 5.0 296 239 A 27 GLU HA A 27 GLU HBy 1.0 1.8 5.0 297 240 A 29 LYS H A 29 LYS HGx 1.0 1.8 5.0 298 240 A 29 LYS H A 29 LYS HGy 1.0 1.8 5.0 299 241 A 30 LYS HA A 30 LYS HGx 1.0 1.8 5.0 300 241 A 30 LYS HA A 30 LYS HGy 1.0 1.8 5.0 301 242 A 30 LYS H A 30 LYS HGx 1.0 1.8 5.0 302 242 A 30 LYS H A 30 LYS HGy 1.0 1.8 5.0 303 243 A 32 PRO HBy A 33 GLU H 1.0 1.8 5.0 304 244 A 31 GLY H A 32 PRO HDx 1.0 1.8 5.0 305 244 A 31 GLY H A 32 PRO HDy 1.0 1.8 5.0 306 245 A 32 PRO HBy A 32 PRO HDx 1.0 1.8 5.0 307 245 A 32 PRO HDy A 32 PRO HBy 1.0 1.8 5.0 308 246 A 34 LYS H A 33 GLU HBy 1.0 1.8 5.0 309 247 A 33 GLU H A 33 GLU HGx 1.0 1.8 5.0 310 247 A 33 GLU H A 33 GLU HGy 1.0 1.8 5.0 311 248 A 34 LYS H A 34 LYS HGx 1.0 1.8 5.0 312 248 A 34 LYS H A 34 LYS HGy 1.0 1.8 5.0 313 249 A 35 THR HA A 36 ASP H 1.0 1.8 5.0 314 250 A 35 THR HB A 38 TYR HD% 1.0 1.8 5.0 315 251 A 35 THR H A 35 THR HG2% 1.0 1.8 5.0 316 252 A 35 THR H A 36 ASP H 1.0 1.8 5.0 317 253 A 37 GLU H A 36 ASP HBx 1.0 1.8 5.0 318 253 A 36 ASP HBy A 37 GLU H 1.0 1.8 5.0 319 254 A 35 THR H A 36 ASP H 1.0 1.8 5.0 320 255 A 37 GLU H A 36 ASP H 1.0 1.8 5.0 321 256 A 37 GLU HA A 37 GLU HGx 1.0 1.8 5.0 322 257 A 37 GLU HA A 37 GLU HGy 1.0 1.8 5.0 323 258 A 38 TYR H A 37 GLU HBx 1.0 1.8 5.0 324 258 A 37 GLU HBy A 38 TYR H 1.0 1.8 5.0 325 259 A 37 GLU H A 37 GLU HGy 1.0 1.8 5.0 326 260 A 37 GLU H A 36 ASP H 1.0 1.8 5.0 327 261 A 37 GLU H A 38 TYR H 1.0 1.8 5.0 328 262 A 38 TYR HA A 38 TYR HBx 1.0 1.8 5.0 329 263 A 38 TYR HD% A 39 LEU H 1.0 1.8 5.0 330 264 A 37 GLU H A 38 TYR H 1.0 1.8 5.0 331 265 A 38 TYR H A 39 LEU H 1.0 1.8 5.0 332 266 A 39 LEU H A 39 LEU HBy 1.0 1.8 5.0 333 267 A 39 LEU H A 39 LEU HG 1.0 1.8 5.0 334 268 A 38 TYR HD% A 39 LEU H 1.0 1.8 5.0 335 269 A 38 TYR H A 39 LEU H 1.0 1.8 5.0 336 270 A 38 TYR HE% A 34 LYS HBx 1.0 1.8 5.0 337 271 A 40 LEU H A 41 ALA H 1.0 1.8 5.0 338 272 A 38 TYR HD% A 41 ALA HB% 1.0 1.8 5.0 339 273 A 40 LEU H A 41 ALA H 1.0 1.8 5.0 340 274 A 42 ARG HA A 42 ARG HDx 1.0 1.8 5.0 341 275 A 42 ARG HGx A 42 ARG HDx 1.0 1.8 5.0 342 276 A 42 ARG HDx A 42 ARG HGy 1.0 1.8 5.0 343 277 A 42 ARG HGx A 42 ARG HDy 1.0 1.8 5.0 344 278 A 42 ARG HDy A 42 ARG HGy 1.0 1.8 5.0 345 279 A 42 ARG HE A 42 ARG HGy 1.0 1.8 5.0 346 280 A 43 PHE HA A 43 PHE HBx 1.0 1.8 5.0 347 281 A 43 PHE HA A 43 PHE HBy 1.0 1.8 5.0 348 282 A 43 PHE HA A 43 PHE HE% 1.0 1.8 5.0 349 283 A 43 PHE H A 43 PHE HA 1.0 1.8 5.0 350 284 A 43 PHE HA A 44 LYS H 1.0 1.8 5.0 351 285 A 43 PHE HBx A 43 PHE HBy 1.0 1.8 5.0 352 286 A 44 LYS H A 43 PHE HBx 1.0 1.8 5.0 353 287 A 43 PHE H A 43 PHE HBy 1.0 1.8 5.0 354 288 A 44 LYS H A 43 PHE HBy 1.0 1.8 5.0 355 289 A 43 PHE H A 43 PHE HD% 1.0 1.8 5.0 356 290 A 46 ASP H A 45 GLY HAx 1.0 1.8 5.0 357 291 A 46 ASP HA A 46 ASP HBy 1.0 1.8 5.0 358 292 A 47 GLY H A 46 ASP HA 1.0 1.8 5.0 359 293 A 47 GLY H A 46 ASP HBx 1.0 1.8 5.0 360 294 A 50 TYR HD% A 46 ASP HBy 1.0 1.8 6.0 361 295 A 50 TYR HE% A 46 ASP HBy 1.0 1.8 6.0 362 296 A 47 GLY H A 46 ASP H 1.0 1.8 5.0 363 297 A 47 GLY HAy A 48 VAL HG1% 1.0 1.8 5.0 364 297 A 47 GLY HAx A 48 VAL HG1% 1.0 1.8 5.0 365 298 A 47 GLY H A 46 ASP H 1.0 1.8 5.0 366 299 A 47 GLY H A 48 VAL H 1.0 1.8 5.0 367 300 A 49 LYS H A 48 VAL HA 1.0 1.8 5.0 368 301 A 48 VAL HB A 49 LYS H 1.0 1.8 5.0 369 302 A 48 VAL HA A 48 VAL HG1% 1.0 1.8 5.0 370 303 A 49 LYS H A 48 VAL HG1% 1.0 1.8 5.0 371 304 A 47 GLY H A 48 VAL H 1.0 1.8 5.0 372 305 A 50 TYR HD% A 49 LYS HDx 1.0 1.8 5.0 373 305 A 50 TYR HD% A 49 LYS HDy 1.0 1.8 5.0 374 306 A 50 TYR HE% A 49 LYS HDx 1.0 1.8 5.0 375 306 A 50 TYR HE% A 49 LYS HDy 1.0 1.8 5.0 376 307 A 50 TYR HE% A 49 LYS HGx 1.0 1.8 5.0 377 307 A 50 TYR HE% A 49 LYS HGy 1.0 1.8 5.0 378 308 A 50 TYR HA A 50 TYR HBx 1.0 1.8 5.0 379 309 A 50 TYR HA A 51 LYS H 1.0 1.8 5.0 380 310 A 54 LEU H A 50 TYR HBx 1.0 1.8 5.0 381 311 A 50 TYR HE% A 50 TYR HBy 1.0 1.8 5.0 382 312 A 51 LYS H A 50 TYR HBy 1.0 1.8 5.0 383 313 A 50 TYR HD% A 50 TYR H 1.0 1.8 5.0 384 314 A 51 LYS HA A 54 LEU HBx 1.0 1.8 5.0 385 314 A 51 LYS HA A 54 LEU HBy 1.0 1.8 5.0 386 315 A 51 LYS HA A 54 LEU HDx% 1.0 1.8 5.0 387 315 A 51 LYS HA A 54 LEU HDy% 1.0 1.8 5.0 388 316 A 51 LYS HA A 54 LEU H 1.0 1.8 5.0 389 317 A 51 LYS H A 51 LYS HDx 1.0 1.8 5.0 390 317 A 51 LYS H A 51 LYS HDy 1.0 1.8 5.0 391 318 A 52 ALA H A 51 LYS H 1.0 1.8 5.0 392 319 A 52 ALA H A 51 LYS H 1.0 1.8 5.0 393 320 A 52 ALA H A 53 LYS H 1.0 1.8 5.0 394 321 A 52 ALA H A 53 LYS H 1.0 1.8 5.0 395 322 A 55 ILE HD1% A 56 GLY H 1.0 1.8 5.0 396 323 A 55 ILE H A 55 ILE HG1x 1.0 1.8 5.0 397 324 A 26 LYS H A 26 LYS HBx 1.0 1.8 6.0 398 324 A 26 LYS H A 26 LYS HBy 1.0 1.8 6.0 399 325 A 26 LYS H A 26 LYS HGx 1.0 1.8 6.0 400 325 A 26 LYS H A 26 LYS HGy 1.0 1.8 6.0 401 326 A 27 GLU HA A 27 GLU HGx 1.0 1.8 6.0 402 326 A 27 GLU HA A 27 GLU HGy 1.0 1.8 6.0 403 327 A 27 GLU H A 27 GLU HBy 1.0 1.8 6.0 404 328 A 27 GLU H A 27 GLU HGx 1.0 1.8 6.0 405 328 A 27 GLU H A 27 GLU HGy 1.0 1.8 6.0 406 329 A 33 GLU H A 32 PRO HDx 1.0 1.8 6.0 407 329 A 32 PRO HDy A 33 GLU H 1.0 1.8 6.0 408 330 A 33 GLU HA A 33 GLU HGx 1.0 1.8 6.0 409 330 A 33 GLU HA A 33 GLU HGy 1.0 1.8 6.0 410 331 A 34 LYS H A 33 GLU HGx 1.0 1.8 6.0 411 331 A 34 LYS H A 33 GLU HGy 1.0 1.8 6.0 412 332 A 34 LYS H A 34 LYS HDx 1.0 1.8 6.0 413 332 A 34 LYS H A 34 LYS HDy 1.0 1.8 6.0 414 333 A 35 THR HB A 38 TYR HE% 1.0 1.8 6.0 415 334 A 35 THR HG2% A 36 ASP H 1.0 1.8 6.0 416 335 A 35 THR HG2% A 38 TYR HD% 1.0 1.8 6.0 417 336 A 37 GLU H A 37 GLU HGx 1.0 1.8 6.0 418 337 A 38 TYR H A 37 GLU HGx 1.0 1.8 6.0 419 338 A 38 TYR H A 37 GLU HGy 1.0 1.8 6.0 420 339 A 38 TYR HA A 38 TYR HBy 1.0 1.8 6.0 421 340 A 38 TYR HA A 41 ALA H 1.0 1.8 6.0 422 341 A 39 LEU H A 38 TYR HBx 1.0 1.8 6.0 423 342 A 38 TYR HE% A 38 TYR HBy 1.0 1.8 6.0 424 343 A 39 LEU H A 38 TYR HBy 1.0 1.8 6.0 425 344 A 38 TYR H A 38 TYR HE% 1.0 1.8 6.0 426 345 A 38 TYR HD% A 39 LEU HA 1.0 1.8 6.0 427 346 A 43 PHE HE% A 40 LEU HBx 1.0 1.8 6.0 428 346 A 40 LEU HBy A 43 PHE HE% 1.0 1.8 6.0 429 347 A 39 LEU H A 38 TYR HE% 1.0 1.8 6.0 430 348 A 39 LEU H A 40 LEU H 1.0 1.8 6.0 431 349 A 43 PHE HD% A 40 LEU HBx 1.0 1.8 6.0 432 349 A 40 LEU HBy A 43 PHE HD% 1.0 1.8 6.0 433 350 A 39 LEU H A 40 LEU H 1.0 1.8 6.0 434 351 A 42 ARG HA A 42 ARG HDy 1.0 1.8 6.0 435 352 A 42 ARG HA A 42 ARG HE 1.0 1.8 6.0 436 353 A 42 ARG HE A 42 ARG HBx 1.0 1.8 6.0 437 353 A 42 ARG HBy A 42 ARG HE 1.0 1.8 6.0 438 354 A 43 PHE HD% A 42 ARG HBx 1.0 1.8 6.0 439 354 A 42 ARG HBy A 43 PHE HD% 1.0 1.8 6.0 440 355 A 42 ARG HDy A 42 ARG HBx 1.0 1.8 6.0 441 355 A 42 ARG HBy A 42 ARG HDy 1.0 1.8 6.0 442 356 A 38 TYR HE% A 42 ARG HGx 1.0 1.8 6.0 443 357 A 42 ARG HE A 42 ARG HGx 1.0 1.8 6.0 444 358 A 42 ARG H A 42 ARG HGx 1.0 1.8 6.0 445 359 A 38 TYR HE% A 42 ARG HGy 1.0 1.8 6.0 446 360 A 42 ARG H A 42 ARG HGy 1.0 1.8 6.0 447 361 A 43 PHE HA A 46 ASP H 1.0 1.8 6.0 448 362 A 43 PHE HE% A 43 PHE HBx 1.0 1.8 6.0 449 363 A 43 PHE HE% A 43 PHE HBy 1.0 1.8 6.0 450 364 A 43 PHE HD% A 44 LYS HA 1.0 1.8 6.0 451 365 A 44 LYS HA A 47 GLY H 1.0 1.8 6.0 452 366 A 44 LYS H A 45 GLY H 1.0 1.8 6.0 453 367 A 45 GLY HAx A 48 VAL HG1% 1.0 1.8 6.0 454 368 A 45 GLY HAy A 48 VAL HG1% 1.0 1.8 6.0 455 369 A 44 LYS H A 45 GLY H 1.0 1.8 6.0 456 370 A 46 ASP HA A 49 LYS HBx 1.0 1.8 6.0 457 370 A 49 LYS HBy A 46 ASP HA 1.0 1.8 6.0 458 371 A 46 ASP HA A 49 LYS HDx 1.0 1.8 6.0 459 371 A 46 ASP HA A 49 LYS HDy 1.0 1.8 6.0 460 372 A 46 ASP HA A 49 LYS HGx 1.0 1.8 6.0 461 372 A 46 ASP HA A 49 LYS HGy 1.0 1.8 6.0 462 373 A 46 ASP HA A 50 TYR H 1.0 1.8 6.0 463 374 A 50 TYR HD% A 46 ASP HBx 1.0 1.8 6.0 464 375 A 50 TYR HE% A 46 ASP HBx 1.0 1.8 6.0 465 376 A 47 GLY H A 46 ASP HBy 1.0 1.8 6.0 466 377 A 50 TYR HD% A 47 GLY HAx 1.0 1.8 6.0 467 377 A 47 GLY HAy A 50 TYR HD% 1.0 1.8 6.0 468 378 A 50 TYR HE% A 47 GLY HAx 1.0 1.8 6.0 469 378 A 47 GLY HAy A 50 TYR HE% 1.0 1.8 6.0 470 379 A 48 VAL HA A 51 LYS HBx 1.0 1.8 6.0 471 380 A 48 VAL HA A 51 LYS HBy 1.0 1.8 6.0 472 381 A 48 VAL HA A 51 LYS HDx 1.0 1.8 6.0 473 381 A 48 VAL HA A 51 LYS HDy 1.0 1.8 6.0 474 382 A 48 VAL HA A 51 LYS HGx 1.0 1.8 6.0 475 382 A 51 LYS HGy A 48 VAL HA 1.0 1.8 6.0 476 383 A 52 ALA H A 48 VAL HA 1.0 1.8 6.0 477 384 A 48 VAL HA A 51 LYS H 1.0 1.8 6.0 478 385 A 47 GLY H A 48 VAL HG1% 1.0 1.8 6.0 479 386 A 47 GLY H A 48 VAL HG2% 1.0 1.8 6.0 480 387 A 48 VAL HA A 48 VAL HG2% 1.0 1.8 6.0 481 388 A 49 LYS HA A 50 TYR HD% 1.0 1.8 6.0 482 389 A 50 TYR HD% A 49 LYS HBx 1.0 1.8 6.0 483 389 A 49 LYS HBy A 50 TYR HD% 1.0 1.8 6.0 484 390 A 50 TYR HD% A 49 LYS HGx 1.0 1.8 6.0 485 390 A 50 TYR HD% A 49 LYS HGy 1.0 1.8 6.0 486 391 A 50 TYR HA A 53 LYS H 1.0 1.8 6.0 487 392 A 51 LYS H A 50 TYR HBx 1.0 1.8 6.0 488 393 A 54 LEU H A 50 TYR HBy 1.0 1.8 6.0 489 394 A 50 TYR HD% A 51 LYS H 1.0 1.8 6.0 490 395 A 50 TYR HE% A 50 TYR H 1.0 1.8 6.0 491 396 A 50 TYR HD% A 51 LYS HA 1.0 1.8 6.0 492 397 A 50 TYR HD% A 51 LYS HBx 1.0 1.8 6.0 493 398 A 50 TYR HE% A 51 LYS HBx 1.0 1.8 6.0 494 399 A 50 TYR HD% A 51 LYS HBy 1.0 1.8 6.0 495 400 A 50 TYR HE% A 51 LYS HBy 1.0 1.8 6.0 496 401 A 50 TYR HD% A 51 LYS HGx 1.0 1.8 6.0 497 401 A 50 TYR HD% A 51 LYS HGy 1.0 1.8 6.0 498 402 A 50 TYR HE% A 51 LYS HGx 1.0 1.8 6.0 499 402 A 50 TYR HE% A 51 LYS HGy 1.0 1.8 6.0 500 403 A 50 TYR HD% A 51 LYS H 1.0 1.8 6.0 501 404 A 58 ASP H A 57 ILE HG1x 1.0 1.8 6.0 502 405 A 58 ASP H A 57 ILE HG1y 1.0 1.8 6.0 503 406 A 54 LEU HA A 54 LEU HDx% 1.0 1.8 2.7 504 406 A 54 LEU HA A 54 LEU HDy% 1.0 1.8 2.7 505 407 A 50 TYR H A 49 LYS HDx 1.0 1.8 3.3 506 407 A 49 LYS HDy A 50 TYR H 1.0 1.8 3.3 507 408 A 49 LYS HBy A 50 TYR H 1.0 1.8 3.3 508 408 A 50 TYR H A 49 LYS HBx 1.0 1.8 3.3 509 409 A 25 LYS H A 25 LYS HA 1.0 1.8 2.7 510 410 A 26 LYS HA A 26 LYS H 1.0 1.8 2.7 511 411 A 27 GLU HA A 27 GLU H 1.0 1.8 2.7 512 412 A 28 LYS H A 28 LYS HA 1.0 1.8 2.7 513 413 A 28 LYS H A 28 LYS HBx 1.0 1.8 2.7 514 413 A 28 LYS H A 28 LYS HBy 1.0 1.8 2.7 515 414 A 29 LYS HA A 29 LYS H 1.0 1.8 2.7 516 415 A 29 LYS HA A 30 LYS H 1.0 1.8 2.7 517 416 A 29 LYS H A 29 LYS HBx 1.0 1.8 2.7 518 416 A 29 LYS HBy A 29 LYS H 1.0 1.8 2.7 519 417 A 30 LYS HA A 30 LYS H 1.0 1.8 2.7 520 418 A 30 LYS HA A 31 GLY H 1.0 1.8 2.7 521 419 A 30 LYS H A 30 LYS HBx 1.0 1.8 2.7 522 419 A 30 LYS HBy A 30 LYS H 1.0 1.8 2.7 523 420 A 31 GLY H A 31 GLY HAx 1.0 1.8 2.7 524 421 A 31 GLY H A 31 GLY HAy 1.0 1.8 2.7 525 422 A 32 PRO HA A 33 GLU H 1.0 1.8 2.7 526 423 A 33 GLU H A 33 GLU HA 1.0 1.8 2.7 527 424 A 33 GLU HA A 34 LYS H 1.0 1.8 2.7 528 425 A 33 GLU H A 33 GLU HBx 1.0 1.8 2.7 529 425 A 33 GLU H A 33 GLU HBy 1.0 1.8 2.7 530 426 A 34 LYS HA A 35 THR H 1.0 1.8 2.7 531 427 A 34 LYS H A 34 LYS HBx 1.0 1.8 2.7 532 428 A 34 LYS H A 34 LYS HBy 1.0 1.8 2.7 533 429 A 35 THR H A 35 THR HA 1.0 1.8 2.7 534 430 A 35 THR HA A 36 ASP H 1.0 1.8 3.3 535 431 A 36 ASP H A 36 ASP HBx 1.0 1.8 2.7 536 431 A 36 ASP HBy A 36 ASP H 1.0 1.8 2.7 537 432 A 37 GLU H A 37 GLU HBx 1.0 1.8 2.7 538 432 A 37 GLU HBy A 37 GLU H 1.0 1.8 2.7 539 433 A 38 TYR H A 38 TYR HBx 1.0 1.8 2.7 540 433 A 38 TYR H A 38 TYR HBy 1.0 1.8 2.7 541 434 A 39 LEU H A 39 LEU HA 1.0 1.8 2.7 542 435 A 40 LEU H A 40 LEU HBx 1.0 1.8 2.7 543 435 A 40 LEU HBy A 40 LEU H 1.0 1.8 2.7 544 436 A 41 ALA HA A 41 ALA H 1.0 1.8 2.7 545 437 A 41 ALA HB% A 41 ALA H 1.0 1.8 2.7 546 438 A 42 ARG HA A 42 ARG H 1.0 1.8 2.7 547 439 A 42 ARG H A 42 ARG HBx 1.0 1.8 2.7 548 439 A 42 ARG H A 42 ARG HBy 1.0 1.8 2.7 549 440 A 44 LYS HA A 44 LYS H 1.0 1.8 2.7 550 441 A 44 LYS HA A 45 GLY H 1.0 1.8 2.7 551 442 A 44 LYS H A 44 LYS HBx 1.0 1.8 2.7 552 442 A 44 LYS HBy A 44 LYS H 1.0 1.8 2.7 553 443 A 45 GLY H A 45 GLY HAx 1.0 1.8 2.7 554 443 A 45 GLY H A 45 GLY HAy 1.0 1.8 2.7 555 444 A 46 ASP H A 45 GLY HAx 1.0 1.8 2.7 556 444 A 46 ASP H A 45 GLY HAy 1.0 1.8 2.7 557 445 A 47 GLY H A 47 GLY HAx 1.0 1.8 2.7 558 445 A 47 GLY HAy A 47 GLY H 1.0 1.8 2.7 559 446 A 48 VAL H A 47 GLY HAx 1.0 1.8 2.7 560 446 A 47 GLY HAy A 48 VAL H 1.0 1.8 2.7 561 447 A 48 VAL H A 48 VAL HA 1.0 1.8 2.7 562 448 A 48 VAL H A 48 VAL HG1% 1.0 1.8 2.7 563 448 A 48 VAL H A 48 VAL HG2% 1.0 1.8 2.7 564 449 A 48 VAL H A 49 LYS H 1.0 1.8 2.7 565 450 A 49 LYS H A 49 LYS HBx 1.0 1.8 2.7 566 450 A 49 LYS H A 49 LYS HBy 1.0 1.8 2.7 567 451 A 50 TYR H A 50 TYR HBx 1.0 1.8 2.7 568 451 A 50 TYR H A 50 TYR HBy 1.0 1.8 2.7 569 452 A 51 LYS H A 51 LYS HBx 1.0 1.8 2.7 570 452 A 51 LYS H A 51 LYS HBy 1.0 1.8 2.7 571 453 A 52 ALA H A 51 LYS HBx 1.0 1.8 2.7 572 453 A 52 ALA H A 51 LYS HBy 1.0 1.8 2.7 573 454 A 52 ALA HA A 52 ALA H 1.0 1.8 2.7 574 455 A 52 ALA HB% A 52 ALA H 1.0 1.8 2.7 575 456 A 52 ALA HB% A 53 LYS H 1.0 1.8 2.7 576 457 A 53 LYS HA A 53 LYS H 1.0 1.8 2.7 577 458 A 53 LYS H A 53 LYS HBx 1.0 1.8 2.7 578 458 A 53 LYS H A 53 LYS HBy 1.0 1.8 2.7 579 459 A 53 LYS H A 53 LYS HGx 1.0 1.8 2.7 580 459 A 53 LYS HGy A 53 LYS H 1.0 1.8 2.7 581 460 A 54 LEU HA A 54 LEU H 1.0 1.8 2.7 582 461 A 54 LEU H A 54 LEU HBx 1.0 1.8 2.7 583 461 A 54 LEU HBy A 54 LEU H 1.0 1.8 2.7 584 462 A 55 ILE H A 55 ILE HA 1.0 1.8 2.7 585 463 A 55 ILE H A 56 GLY H 1.0 1.8 2.7 586 464 A 56 GLY H A 56 GLY HAx 1.0 1.8 2.7 587 465 A 56 GLY H A 56 GLY HAy 1.0 1.8 2.7 588 466 A 56 GLY HAy A 57 ILE H 1.0 1.8 2.7 589 467 A 57 ILE H A 57 ILE HA 1.0 1.8 2.7 590 468 A 57 ILE HA A 58 ASP H 1.0 1.8 2.7 591 469 A 57 ILE H A 57 ILE HB 1.0 1.8 3.3 592 470 A 57 ILE H A 57 ILE HG2% 1.0 1.8 2.7 593 471 A 56 GLY H A 57 ILE H 1.0 1.8 2.7 594 472 A 24 SER H A 24 SER HA 1.0 1.8 3.3 595 473 A 25 LYS H A 25 LYS HBx 1.0 1.8 3.3 596 473 A 25 LYS H A 25 LYS HBy 1.0 1.8 3.3 597 474 A 26 LYS H A 26 LYS HBx 1.0 1.8 3.3 598 474 A 26 LYS H A 26 LYS HBy 1.0 1.8 3.3 599 475 A 27 GLU H A 27 GLU HBx 1.0 1.8 3.3 600 475 A 27 GLU H A 27 GLU HBy 1.0 1.8 3.3 601 476 A 30 LYS H A 30 LYS HGx 1.0 1.8 3.3 602 476 A 30 LYS H A 30 LYS HGy 1.0 1.8 3.3 603 477 A 32 PRO HBy A 33 GLU H 1.0 1.8 3.3 604 478 A 33 GLU H A 33 GLU HGx 1.0 1.8 3.3 605 478 A 33 GLU H A 33 GLU HGy 1.0 1.8 3.3 606 479 A 34 LYS H A 34 LYS HA 1.0 1.8 3.3 607 480 A 34 LYS H A 34 LYS HGx 1.0 1.8 3.3 608 480 A 34 LYS H A 34 LYS HGy 1.0 1.8 3.3 609 481 A 35 THR H A 36 ASP H 1.0 1.8 3.3 610 482 A 36 ASP HA A 36 ASP H 1.0 1.8 3.3 611 483 A 36 ASP HA A 37 GLU H 1.0 1.8 3.3 612 484 A 37 GLU H A 36 ASP HBx 1.0 1.8 3.3 613 484 A 36 ASP HBy A 37 GLU H 1.0 1.8 3.3 614 485 A 37 GLU HA A 37 GLU H 1.0 1.8 3.3 615 486 A 37 GLU HA A 38 TYR H 1.0 1.8 3.3 616 487 A 38 TYR H A 37 GLU HBx 1.0 1.8 3.3 617 487 A 37 GLU HBy A 38 TYR H 1.0 1.8 3.3 618 488 A 37 GLU H A 37 GLU HGy 1.0 1.8 3.3 619 488 A 37 GLU H A 37 GLU HGx 1.0 1.8 3.3 620 489 A 37 GLU H A 36 ASP H 1.0 1.8 3.3 621 490 A 38 TYR H A 38 TYR HA 1.0 1.8 3.3 622 491 A 37 GLU H A 38 TYR H 1.0 1.8 3.3 623 492 A 39 LEU H A 39 LEU HBy 1.0 1.8 3.3 624 492 A 39 LEU H A 39 LEU HBx 1.0 1.8 3.3 625 493 A 40 LEU HA A 40 LEU H 1.0 1.8 3.3 626 494 A 41 ALA H A 40 LEU HBx 1.0 1.8 3.3 627 494 A 40 LEU HBy A 41 ALA H 1.0 1.8 3.3 628 495 A 40 LEU H A 40 LEU HDx% 1.0 1.8 3.3 629 495 A 40 LEU HDy% A 40 LEU H 1.0 1.8 3.3 630 496 A 40 LEU H A 40 LEU HG 1.0 1.8 3.3 631 497 A 40 LEU H A 41 ALA H 1.0 1.8 3.3 632 498 A 42 ARG HA A 43 PHE H 1.0 1.8 3.3 633 499 A 43 PHE H A 42 ARG HBx 1.0 1.8 3.3 634 499 A 42 ARG HBy A 43 PHE H 1.0 1.8 3.3 635 500 A 42 ARG H A 42 ARG HGy 1.0 1.8 3.3 636 500 A 42 ARG H A 42 ARG HGx 1.0 1.8 3.3 637 501 A 43 PHE H A 43 PHE HBx 1.0 1.8 3.3 638 502 A 46 ASP H A 46 ASP HA 1.0 1.8 3.3 639 503 A 46 ASP H A 46 ASP HBx 1.0 1.8 3.3 640 503 A 46 ASP H A 46 ASP HBy 1.0 1.8 3.3 641 504 A 47 GLY H A 46 ASP H 1.0 1.8 3.3 642 505 A 52 ALA H A 48 VAL HA 1.0 1.8 3.3 643 506 A 48 VAL HB A 48 VAL H 1.0 1.8 3.3 644 507 A 49 LYS H A 48 VAL HG1% 1.0 1.8 3.3 645 507 A 49 LYS H A 48 VAL HG2% 1.0 1.8 3.3 646 508 A 47 GLY H A 48 VAL H 1.0 1.8 3.3 647 509 A 49 LYS HA A 49 LYS H 1.0 1.8 3.3 648 510 A 50 TYR H A 49 LYS HBx 1.0 1.8 3.3 649 510 A 49 LYS HBy A 50 TYR H 1.0 1.8 3.3 650 511 A 51 LYS HA A 51 LYS H 1.0 1.8 3.3 651 512 A 51 LYS HA A 52 ALA H 1.0 1.8 3.3 652 513 A 51 LYS H A 51 LYS HGx 1.0 1.8 3.3 653 513 A 51 LYS HGy A 51 LYS H 1.0 1.8 3.3 654 514 A 52 ALA HA A 53 LYS H 1.0 1.8 3.3 655 515 A 52 ALA H A 53 LYS H 1.0 1.8 3.3 656 516 A 52 ALA H A 53 LYS H 1.0 1.8 3.3 657 517 A 55 ILE H A 54 LEU HBx 1.0 1.8 3.3 658 517 A 54 LEU HBy A 55 ILE H 1.0 1.8 3.3 659 518 A 54 LEU H A 54 LEU HDx% 1.0 1.8 3.3 660 518 A 54 LEU HDy% A 54 LEU H 1.0 1.8 3.3 661 519 A 54 LEU HG A 54 LEU H 1.0 1.8 3.3 662 520 A 54 LEU HG A 55 ILE H 1.0 1.8 5.0 663 521 A 55 ILE H A 55 ILE HB 1.0 1.8 3.3 664 522 A 55 ILE H A 55 ILE HG2% 1.0 1.8 3.3 665 523 A 55 ILE HG2% A 56 GLY H 1.0 1.8 3.3 666 524 A 55 ILE H A 55 ILE HG1y 1.0 1.8 3.3 667 525 A 54 LEU H A 55 ILE H 1.0 1.8 3.3 668 526 A 56 GLY HAx A 57 ILE H 1.0 1.8 3.3 669 527 A 55 ILE H A 56 GLY H 1.0 1.8 3.3 670 528 A 56 GLY H A 57 ILE H 1.0 1.8 3.3 671 529 A 57 ILE HB A 58 ASP H 1.0 1.8 3.3 672 530 A 57 ILE HG2% A 58 ASP H 1.0 1.8 5.0 673 531 A 57 ILE H A 57 ILE HG1x 1.0 1.8 3.3 674 532 A 57 ILE H A 57 ILE HG1y 1.0 1.8 3.3 675 533 A 58 ASP H A 58 ASP HA 1.0 1.8 3.3 676 534 A 58 ASP H A 58 ASP HBx 1.0 1.8 3.3 677 534 A 58 ASP H A 58 ASP HBy 1.0 1.8 3.3 678 535 A 28 LYS H A 27 GLU HBx 1.0 1.8 5.0 679 535 A 28 LYS H A 27 GLU HBy 1.0 1.8 5.0 680 536 A 28 LYS H A 28 LYS HGx 1.0 1.8 5.0 681 536 A 28 LYS H A 28 LYS HGy 1.0 1.8 5.0 682 537 A 29 LYS H A 29 LYS HGx 1.0 1.8 5.0 683 537 A 29 LYS H A 29 LYS HGy 1.0 1.8 5.0 684 538 A 31 GLY H A 30 LYS HBx 1.0 1.8 5.0 685 538 A 31 GLY H A 30 LYS HBy 1.0 1.8 5.0 686 539 A 31 GLY H A 32 PRO HDx 1.0 1.8 5.0 687 539 A 31 GLY H A 32 PRO HDy 1.0 1.8 5.0 688 540 A 34 LYS H A 33 GLU HGx 1.0 1.8 5.0 689 540 A 34 LYS H A 33 GLU HGy 1.0 1.8 5.0 690 541 A 35 THR H A 34 LYS HBx 1.0 1.8 5.0 691 542 A 34 LYS HBy A 35 THR H 1.0 1.8 5.0 692 543 A 35 THR H A 35 THR HG2% 1.0 1.8 5.0 693 544 A 35 THR HG2% A 36 ASP H 1.0 1.8 5.0 694 545 A 35 THR H A 36 ASP H 1.0 1.8 5.0 695 546 A 37 GLU H A 36 ASP H 1.0 1.8 5.0 696 547 A 37 GLU H A 38 TYR H 1.0 1.8 5.0 697 548 A 38 TYR HA A 39 LEU H 1.0 1.8 5.0 698 549 A 38 TYR H A 38 TYR HD% 1.0 1.8 5.0 699 550 A 39 LEU H A 39 LEU HDx% 1.0 1.8 5.0 700 550 A 39 LEU H A 39 LEU HDy% 1.0 1.8 5.0 701 551 A 39 LEU H A 39 LEU HG 1.0 1.8 5.0 702 552 A 39 LEU H A 40 LEU H 1.0 1.8 5.0 703 553 A 41 ALA H A 40 LEU HDx% 1.0 1.8 5.0 704 553 A 40 LEU HDy% A 41 ALA H 1.0 1.8 5.0 705 554 A 40 LEU H A 41 ALA H 1.0 1.8 5.0 706 555 A 42 ARG H A 42 ARG HDx 1.0 1.8 5.0 707 555 A 42 ARG H A 42 ARG HDy 1.0 1.8 5.0 708 556 A 43 PHE H A 43 PHE HA 1.0 1.8 5.0 709 557 A 43 PHE HA A 44 LYS H 1.0 1.8 5.0 710 558 A 44 LYS H A 43 PHE HBx 1.0 1.8 5.0 711 559 A 43 PHE H A 43 PHE HBy 1.0 1.8 5.0 712 560 A 45 GLY H A 44 LYS HBx 1.0 1.8 5.0 713 560 A 44 LYS HBy A 45 GLY H 1.0 1.8 5.0 714 561 A 44 LYS H A 44 LYS HGx 1.0 1.8 5.0 715 561 A 44 LYS HGy A 44 LYS H 1.0 1.8 5.0 716 562 A 44 LYS H A 45 GLY H 1.0 1.8 5.0 717 563 A 44 LYS H A 45 GLY H 1.0 1.8 5.0 718 564 A 47 GLY H A 46 ASP HA 1.0 1.8 5.0 719 565 A 47 GLY H A 46 ASP H 1.0 1.8 5.0 720 566 A 47 GLY H A 48 VAL H 1.0 1.8 5.0 721 567 A 49 LYS H A 48 VAL HA 1.0 1.8 5.0 722 568 A 48 VAL HB A 49 LYS H 1.0 1.8 5.0 723 569 A 49 LYS HA A 50 TYR H 1.0 1.8 5.0 724 570 A 50 TYR HA A 50 TYR H 1.0 1.8 5.0 725 571 A 50 TYR HA A 51 LYS H 1.0 1.8 5.0 726 572 A 51 LYS H A 50 TYR HBx 1.0 1.8 5.0 727 572 A 51 LYS H A 50 TYR HBy 1.0 1.8 5.0 728 573 A 50 TYR HD% A 50 TYR H 1.0 1.8 5.0 729 574 A 51 LYS H A 51 LYS HDx 1.0 1.8 5.0 730 574 A 51 LYS H A 51 LYS HDy 1.0 1.8 5.0 731 575 A 52 ALA HA A 55 ILE H 1.0 1.8 5.0 732 576 A 55 ILE HB A 56 GLY H 1.0 1.8 5.0 733 577 A 55 ILE H A 55 ILE HG1x 1.0 1.8 5.0 734 578 A 56 GLY H A 55 ILE HG1y 1.0 1.8 5.0 735 579 A 58 ASP H A 57 ILE HG1y 1.0 1.8 5.0 736 580 A 24 SER H A 24 SER HB2 1.0 1.8 6.0 737 580 A 24 SER H A 24 SER HB3 1.0 1.8 6.0 738 581 A 25 LYS H A 24 SER HB2 1.0 1.8 6.0 739 581 A 25 LYS H A 24 SER HB3 1.0 1.8 6.0 740 582 A 25 LYS H A 25 LYS HGx 1.0 1.8 6.0 741 582 A 25 LYS H A 25 LYS HGy 1.0 1.8 6.0 742 583 A 26 LYS H A 26 LYS HGx 1.0 1.8 6.0 743 583 A 26 LYS H A 26 LYS HGy 1.0 1.8 6.0 744 584 A 27 GLU H A 27 GLU HGx 1.0 1.8 6.0 745 584 A 27 GLU H A 27 GLU HGy 1.0 1.8 6.0 746 585 A 31 GLY H A 30 LYS HGx 1.0 1.8 6.0 747 585 A 31 GLY H A 30 LYS HGy 1.0 1.8 6.0 748 586 A 33 GLU H A 32 PRO HDx 1.0 1.8 6.0 749 586 A 32 PRO HDy A 33 GLU H 1.0 1.8 6.0 750 587 A 34 LYS HBx A 36 ASP H 1.0 1.8 6.0 751 588 A 34 LYS HBy A 36 ASP H 1.0 1.8 6.0 752 589 A 35 THR H A 34 LYS HGx 1.0 1.8 6.0 753 589 A 35 THR H A 34 LYS HGy 1.0 1.8 6.0 754 590 A 36 ASP HA A 40 LEU H 1.0 1.8 6.0 755 591 A 38 TYR H A 37 GLU HGy 1.0 1.8 6.0 756 591 A 38 TYR H A 37 GLU HGx 1.0 1.8 6.0 757 592 A 35 THR H A 37 GLU H 1.0 1.8 6.0 758 593 A 38 TYR HA A 41 ALA H 1.0 1.8 6.0 759 594 A 39 LEU H A 38 TYR HBx 1.0 1.8 6.0 760 594 A 39 LEU H A 38 TYR HBy 1.0 1.8 6.0 761 595 A 37 GLU H A 38 TYR HD% 1.0 1.8 6.0 762 596 A 38 TYR HD% A 39 LEU H 1.0 1.8 6.0 763 597 A 39 LEU HA A 40 LEU H 1.0 1.8 6.0 764 598 A 43 PHE HA A 45 GLY H 1.0 1.8 6.0 765 599 A 44 LYS H A 43 PHE HBy 1.0 1.8 6.0 766 600 A 43 PHE H A 43 PHE HD% 1.0 1.8 6.0 767 601 A 43 PHE HD% A 44 LYS H 1.0 1.8 6.0 768 602 A 40 LEU H A 43 PHE HE% 1.0 1.8 6.0 769 603 A 44 LYS HA A 47 GLY H 1.0 1.8 6.0 770 604 A 45 GLY H A 44 LYS HGx 1.0 1.8 6.0 771 604 A 44 LYS HGy A 45 GLY H 1.0 1.8 6.0 772 605 A 49 LYS H A 46 ASP HA 1.0 1.8 6.0 773 606 A 47 GLY H A 46 ASP HBx 1.0 1.8 6.0 774 606 A 47 GLY H A 46 ASP HBy 1.0 1.8 6.0 775 607 A 48 VAL H A 46 ASP H 1.0 1.8 6.0 776 608 A 50 TYR H A 47 GLY HAx 1.0 1.8 6.0 777 608 A 47 GLY HAy A 50 TYR H 1.0 1.8 6.0 778 609 A 48 VAL HA A 51 LYS H 1.0 1.8 6.0 779 610 A 47 GLY H A 48 VAL HG1% 1.0 1.8 6.0 780 610 A 47 GLY H A 48 VAL HG2% 1.0 1.8 6.0 781 611 A 48 VAL H A 46 ASP H 1.0 1.8 6.0 782 612 A 49 LYS H A 49 LYS HGx 1.0 1.8 6.0 783 612 A 49 LYS H A 49 LYS HGy 1.0 1.8 6.0 784 613 A 50 TYR HA A 53 LYS H 1.0 1.8 6.0 785 614 A 50 TYR HD% A 51 LYS H 1.0 1.8 6.0 786 615 A 51 LYS HA A 54 LEU H 1.0 1.8 6.0 787 616 A 51 LYS HA A 55 ILE H 1.0 1.8 6.0 788 617 A 53 LYS H A 53 LYS HEx 1.0 1.8 6.0 789 617 A 53 LYS H A 53 LYS HEy 1.0 1.8 6.0 790 618 A 53 LYS H A 51 LYS H 1.0 1.8 6.0 791 619 A 55 ILE HG1x A 56 GLY H 1.0 1.8 6.0 792 620 A 58 ASP H A 57 ILE HG1x 1.0 1.8 6.0 793 621 A 57 ILE HA A 57 ILE HG2% 1.0 1.8 2.7 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 35 THR C A 36 ASP N A 36 ASP CA A 36 ASP C 1.0 -117.2 -42.0 PHI 2 2 A 36 ASP N A 36 ASP CA A 36 ASP C A 37 GLU N 1.0 -68.3 31.1 PSI 3 3 A 36 ASP C A 37 GLU N A 37 GLU CA A 37 GLU C 1.0 -90.2 -45.4 PHI 4 4 A 37 GLU N A 37 GLU CA A 37 GLU C A 38 TYR N 1.0 -80.7 18.5 PSI 5 5 A 37 GLU C A 38 TYR N A 38 TYR CA A 38 TYR C 1.0 -84.7 -44.7 PHI 6 6 A 38 TYR N A 38 TYR CA A 38 TYR C A 39 LEU N 1.0 -61.0 -21.0 PSI 7 7 A 38 TYR C A 39 LEU N A 39 LEU CA A 39 LEU C 1.0 -86.0 -45.0 PHI 8 8 A 39 LEU N A 39 LEU CA A 39 LEU C A 40 LEU N 1.0 -55.0 -8.8 PSI 9 9 A 39 LEU C A 40 LEU N A 40 LEU CA A 40 LEU C 1.0 -82.1 -42.1 PHI 10 10 A 40 LEU N A 40 LEU CA A 40 LEU C A 41 ALA N 1.0 -58.9 -18.9 PSI 11 11 A 40 LEU C A 41 ALA N A 41 ALA CA A 41 ALA C 1.0 -82.1 -42.1 PHI 12 12 A 41 ALA N A 41 ALA CA A 41 ALA C A 42 ARG N 1.0 -58.5 -17.9 PSI 13 13 A 41 ALA C A 42 ARG N A 42 ARG CA A 42 ARG C 1.0 -89.0 -49.0 PHI 14 14 A 42 ARG N A 42 ARG CA A 42 ARG C A 43 PHE N 1.0 -53.2 -7.8 PSI 15 15 A 42 ARG C A 43 PHE N A 43 PHE CA A 43 PHE C 1.0 -119.5 -39.1 PHI 16 16 A 43 PHE N A 43 PHE CA A 43 PHE C A 44 LYS N 1.0 -60.0 14.8 PSI 17 17 A 43 PHE C A 44 LYS N A 44 LYS CA A 44 LYS C 1.0 -102.6 -29.8 PHI 18 18 A 44 LYS N A 44 LYS CA A 44 LYS C A 45 GLY N 1.0 -65.4 10.8 PSI 19 19 A 47 GLY C A 48 VAL N A 48 VAL CA A 48 VAL C 1.0 -85.6 -45.6 PHI 20 20 A 48 VAL N A 48 VAL CA A 48 VAL C A 49 LYS N 1.0 -58.3 -18.3 PSI 21 21 A 48 VAL C A 49 LYS N A 49 LYS CA A 49 LYS C 1.0 -83.4 -43.4 PHI 22 22 A 49 LYS N A 49 LYS CA A 49 LYS C A 50 TYR N 1.0 -56.3 -13.7 PSI 23 23 A 49 LYS C A 50 TYR N A 50 TYR CA A 50 TYR C 1.0 -93.5 -43.7 PHI 24 24 A 50 TYR N A 50 TYR CA A 50 TYR C A 51 LYS N 1.0 -66.1 -7.1 PSI 25 25 A 50 TYR C A 51 LYS N A 51 LYS CA A 51 LYS C 1.0 -80.8 -40.8 PHI 26 26 A 51 LYS N A 51 LYS CA A 51 LYS C A 52 ALA N 1.0 -56.5 -15.7 PSI 27 27 A 51 LYS C A 52 ALA N A 52 ALA CA A 52 ALA C 1.0 -84.3 -44.3 PHI 28 28 A 52 ALA N A 52 ALA CA A 52 ALA C A 53 LYS N 1.0 -53.5 -7.1 PSI 29 29 A 52 ALA C A 53 LYS N A 53 LYS CA A 53 LYS C 1.0 -89.9 -49.9 PHI 30 30 A 53 LYS N A 53 LYS CA A 53 LYS C A 54 LEU N 1.0 -52.7 -1.7 PSI 31 31 A 53 LYS C A 54 LEU N A 54 LEU CA A 54 LEU C 1.0 -92.9 -52.9 PHI 32 32 A 54 LEU N A 54 LEU CA A 54 LEU C A 55 ILE N 1.0 -53.9 -4.1 PSI 33 33 A 54 LEU C A 55 ILE N A 55 ILE CA A 55 ILE C 1.0 -116.1 -76.1 PHI 34 34 A 55 ILE C A 56 GLY N A 56 GLY CA A 56 GLY C 1.0 53.6 141.8 PHI 35 35 A 56 GLY N A 56 GLY CA A 56 GLY C A 57 ILE N 1.0 -24.7 50.9 PSI 36 36 A 56 GLY C A 57 ILE N A 57 ILE CA A 57 ILE C 1.0 -119.0 -72.8 PHI stop_ save_