data_nef_c25223_2mun 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 PDB 2MUN 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 5 CYS SG 1 32 CYS SG 1 15 CYS SG 1 31 CYS SG 1 18 CYS SG 1 41 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 ASP middle . . 3 A 3 ASN middle . . 4 A 4 LYS middle . . 5 A 5 CYS middle -HG . 6 A 6 GLU middle . . 7 A 7 ASN middle . . 8 A 8 SER middle . . 9 A 9 LEU middle . . 10 A 10 ARG middle . . 11 A 11 ARG middle . . 12 A 12 GLU middle . . 13 A 13 ILE middle . . 14 A 14 ALA middle . . 15 A 15 CYS middle -HG . 16 A 16 GLY middle . false 17 A 17 GLN middle . . 18 A 18 CYS middle -HG . 19 A 19 ARG middle . . 20 A 20 ASP middle . . 21 A 21 LYS middle . . 22 A 22 VAL middle . . 23 A 23 LYS middle . . 24 A 24 THR middle . . 25 A 25 ASP middle . . 26 A 26 GLY middle . false 27 A 27 TYR middle . . 28 A 28 PHE middle . . 29 A 29 TYR middle . . 30 A 30 GLU middle . . 31 A 31 CYS middle -HG . 32 A 32 CYS middle -HG . 33 A 33 THR middle . . 34 A 34 SER middle . . 35 A 35 ASP middle . . 36 A 36 SER middle . . 37 A 37 THR middle . . 38 A 38 PHE middle . . 39 A 39 LYS middle . . 40 A 40 LYS middle . . 41 A 41 CYS middle -HG . 42 A 42 GLN middle . . 43 A 43 ASP middle . . 44 A 44 LEU middle . . 45 A 45 LEU middle . . 46 A 46 HIS 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 1 ALA HA H 1 4.074 0.02 A 1 ALA HB% H 1 1.494 0.02 A 1 ALA C C 13 173.288 0.3 A 1 ALA CA C 13 51.657 0.3 A 1 ALA CB C 13 19.430 0.3 A 2 ASP H H 1 8.685 0.02 A 2 ASP HA H 1 4.509 0.02 A 2 ASP HBy H 1 2.595 0.02 A 2 ASP HBx H 1 2.482 0.02 A 2 ASP C C 13 174.890 0.3 A 2 ASP CA C 13 54.313 0.3 A 2 ASP CB C 13 40.869 0.3 A 2 ASP N N 15 120.785 0.2 A 3 ASN H H 1 8.536 0.02 A 3 ASN HA H 1 4.241 0.02 A 3 ASN HBy H 1 3.045 0.02 A 3 ASN HBx H 1 2.557 0.02 A 3 ASN C C 13 176.070 0.3 A 3 ASN CA C 13 52.743 0.3 A 3 ASN CB C 13 37.371 0.3 A 3 ASN N N 15 119.347 0.2 A 3 ASN ND2 N 15 110.936 0.2 A 4 LYS H H 1 8.231 0.02 A 4 LYS HA H 1 4.147 0.02 A 4 LYS HB2 H 1 1.872 0.02 A 4 LYS HB3 H 1 1.473 0.02 A 4 LYS HDy H 1 1.633 0.02 A 4 LYS HDx H 1 1.589 0.02 A 4 LYS HEy H 1 3.006 0.02 A 4 LYS HEx H 1 2.926 0.02 A 4 LYS HGy H 1 1.466 0.02 A 4 LYS HGx H 1 1.439 0.02 A 4 LYS C C 13 178.574 0.3 A 4 LYS CA C 13 57.727 0.3 A 4 LYS CB C 13 31.173 0.3 A 4 LYS CD C 13 28.714 0.3 A 4 LYS CE C 13 42.368 0.3 A 4 LYS CG C 13 25.984 0.3 A 4 LYS N N 15 125.839 0.2 A 5 CYS H H 1 8.149 0.02 A 5 CYS HA H 1 3.823 0.02 A 5 CYS HBy H 1 3.615 0.02 A 5 CYS HBx H 1 3.159 0.02 A 5 CYS C C 13 174.852 0.3 A 5 CYS CA C 13 57.783 0.3 A 5 CYS CB C 13 42.891 0.3 A 5 CYS N N 15 116.562 0.2 A 6 GLU H H 1 7.026 0.02 A 6 GLU HA H 1 3.955 0.02 A 6 GLU HBy H 1 1.976 0.02 A 6 GLU HBx H 1 1.931 0.02 A 6 GLU HG2 H 1 2.218 0.02 A 6 GLU HG3 H 1 2.218 0.02 A 6 GLU C C 13 176.531 0.3 A 6 GLU CA C 13 58.245 0.3 A 6 GLU CB C 13 29.230 0.3 A 6 GLU CG C 13 35.814 0.3 A 6 GLU N N 15 116.495 0.2 A 7 ASN H H 1 7.206 0.02 A 7 ASN HA H 1 4.873 0.02 A 7 ASN HBy H 1 2.837 0.02 A 7 ASN HBx H 1 2.670 0.02 A 7 ASN HD21 H 1 6.831 0.02 A 7 ASN HD22 H 1 6.831 0.02 A 7 ASN C C 13 174.501 0.3 A 7 ASN CA C 13 52.694 0.3 A 7 ASN CB C 13 39.710 0.3 A 7 ASN N N 15 112.278 0.2 A 7 ASN ND2 N 15 112.278 0.2 A 8 SER H H 1 7.020 0.02 A 8 SER HA H 1 4.708 0.02 A 8 SER HBy H 1 3.744 0.02 A 8 SER HBx H 1 3.723 0.02 A 8 SER C C 13 173.275 0.3 A 8 SER CA C 13 55.971 0.3 A 8 SER CB C 13 62.634 0.3 A 8 SER N N 15 113.437 0.2 A 9 LEU H H 1 8.743 0.02 A 9 LEU HA H 1 4.316 0.02 A 9 LEU HB2 H 1 1.675 0.02 A 9 LEU HB3 H 1 1.631 0.02 A 9 LEU HD1% H 1 0.965 0.02 A 9 LEU HD2% H 1 0.912 0.02 A 9 LEU HG H 1 1.656 0.02 A 9 LEU C C 13 178.730 0.3 A 9 LEU CA C 13 57.664 0.3 A 9 LEU CB C 13 41.852 0.3 A 9 LEU CD1 C 13 23.760 0.3 A 9 LEU CD2 C 13 24.875 0.3 A 9 LEU CG C 13 27.076 0.3 A 9 LEU N N 15 132.660 0.2 A 10 ARG H H 1 8.282 0.02 A 10 ARG HA H 1 3.979 0.02 A 10 ARG HB2 H 1 1.831 0.02 A 10 ARG HB3 H 1 1.743 0.02 A 10 ARG HD2 H 1 3.245 0.02 A 10 ARG HD3 H 1 3.245 0.02 A 10 ARG HG2 H 1 1.755 0.02 A 10 ARG HG3 H 1 1.755 0.02 A 10 ARG C C 13 179.035 0.3 A 10 ARG CA C 13 59.280 0.3 A 10 ARG CB C 13 29.806 0.3 A 10 ARG CD C 13 43.460 0.3 A 10 ARG CG C 13 27.494 0.3 A 10 ARG N N 15 115.937 0.2 A 11 ARG H H 1 7.563 0.02 A 11 ARG HA H 1 3.841 0.02 A 11 ARG HBy H 1 1.746 0.02 A 11 ARG HBx H 1 1.254 0.02 A 11 ARG HDy H 1 2.135 0.02 A 11 ARG HDx H 1 2.025 0.02 A 11 ARG HG2 H 1 1.194 0.02 A 11 ARG HG3 H 1 0.448 0.02 A 11 ARG C C 13 176.629 0.3 A 11 ARG CA C 13 58.604 0.3 A 11 ARG CB C 13 30.014 0.3 A 11 ARG CD C 13 43.470 0.3 A 11 ARG CG C 13 26.519 0.3 A 11 ARG N N 15 121.095 0.2 A 12 GLU H H 1 8.174 0.02 A 12 GLU HA H 1 4.248 0.02 A 12 GLU HB2 H 1 2.501 0.02 A 12 GLU HB3 H 1 2.422 0.02 A 12 GLU HG2 H 1 2.524 0.02 A 12 GLU HG3 H 1 2.524 0.02 A 12 GLU C C 13 179.693 0.3 A 12 GLU CA C 13 60.391 0.3 A 12 GLU CB C 13 29.069 0.3 A 12 GLU CG C 13 34.722 0.3 A 12 GLU N N 15 120.157 0.2 A 13 ILE H H 1 8.908 0.02 A 13 ILE HA H 1 3.801 0.02 A 13 ILE HB H 1 1.880 0.02 A 13 ILE HD1% H 1 0.844 0.02 A 13 ILE HG12 H 1 1.815 0.02 A 13 ILE HG13 H 1 1.249 0.02 A 13 ILE HG2% H 1 0.931 0.02 A 13 ILE C C 13 179.772 0.3 A 13 ILE CA C 13 64.674 0.3 A 13 ILE CB C 13 38.131 0.3 A 13 ILE CD1 C 13 12.865 0.3 A 13 ILE CG1 C 13 29.249 0.3 A 13 ILE CG2 C 13 16.710 0.3 A 13 ILE N N 15 119.897 0.2 A 14 ALA H H 1 8.122 0.02 A 14 ALA HA H 1 4.293 0.02 A 14 ALA HB% H 1 1.699 0.02 A 14 ALA C C 13 179.539 0.3 A 14 ALA CA C 13 55.440 0.3 A 14 ALA CB C 13 18.377 0.3 A 14 ALA N N 15 123.226 0.2 A 15 CYS H H 1 9.192 0.02 A 15 CYS HA H 1 5.108 0.02 A 15 CYS HBy H 1 3.017 0.02 A 15 CYS HBx H 1 2.835 0.02 A 15 CYS C C 13 178.562 0.3 A 15 CYS CA C 13 57.324 0.3 A 15 CYS CB C 13 36.845 0.3 A 15 CYS N N 15 114.231 0.2 A 16 GLY H H 1 8.627 0.02 A 16 GLY HA2 H 1 4.155 0.02 A 16 GLY HA3 H 1 3.868 0.02 A 16 GLY C C 13 175.279 0.3 A 16 GLY CA C 13 47.312 0.3 A 16 GLY N N 15 110.380 0.2 A 17 GLN H H 1 8.108 0.02 A 17 GLN HA H 1 4.221 0.02 A 17 GLN HB2 H 1 2.581 0.02 A 17 GLN HB3 H 1 2.003 0.02 A 17 GLN HE2y H 1 7.258 0.02 A 17 GLN HE2x H 1 6.732 0.02 A 17 GLN HGy H 1 2.660 0.02 A 17 GLN HGx H 1 2.429 0.02 A 17 GLN C C 13 181.015 0.3 A 17 GLN CA C 13 59.205 0.3 A 17 GLN CB C 13 29.241 0.3 A 17 GLN CG C 13 34.776 0.3 A 17 GLN N N 15 122.345 0.2 A 17 GLN NE2 N 15 110.078 0.2 A 18 CYS H H 1 9.342 0.02 A 18 CYS HA H 1 3.693 0.02 A 18 CYS HB2 H 1 4.056 0.02 A 18 CYS HB3 H 1 3.293 0.02 A 18 CYS C C 13 175.945 0.3 A 18 CYS CA C 13 59.727 0.3 A 18 CYS CB C 13 44.857 0.3 A 18 CYS N N 15 119.568 0.2 A 19 ARG H H 1 8.858 0.02 A 19 ARG HA H 1 3.828 0.02 A 19 ARG HB2 H 1 2.545 0.02 A 19 ARG HB3 H 1 2.218 0.02 A 19 ARG HDy H 1 3.286 0.02 A 19 ARG HDx H 1 3.040 0.02 A 19 ARG HGy H 1 2.224 0.02 A 19 ARG HGx H 1 1.664 0.02 A 19 ARG C C 13 177.747 0.3 A 19 ARG CA C 13 59.822 0.3 A 19 ARG CB C 13 29.109 0.3 A 19 ARG CD C 13 43.399 0.3 A 19 ARG CG C 13 25.437 0.3 A 19 ARG N N 15 122.814 0.2 A 20 ASP H H 1 7.545 0.02 A 20 ASP HA H 1 4.454 0.02 A 20 ASP HB2 H 1 2.772 0.02 A 20 ASP HB3 H 1 2.772 0.02 A 20 ASP C C 13 176.628 0.3 A 20 ASP CA C 13 56.386 0.3 A 20 ASP CB C 13 40.094 0.3 A 20 ASP N N 15 117.500 0.2 A 21 LYS H H 1 7.370 0.02 A 21 LYS HA H 1 4.277 0.02 A 21 LYS HB2 H 1 1.895 0.02 A 21 LYS HB3 H 1 1.780 0.02 A 21 LYS HD2 H 1 1.501 0.02 A 21 LYS HD3 H 1 1.501 0.02 A 21 LYS HE2 H 1 2.888 0.02 A 21 LYS HE3 H 1 2.888 0.02 A 21 LYS HGy H 1 1.527 0.02 A 21 LYS HGx H 1 1.435 0.02 A 21 LYS C C 13 177.584 0.3 A 21 LYS CA C 13 57.941 0.3 A 21 LYS CB C 13 33.970 0.3 A 21 LYS CD C 13 29.260 0.3 A 21 LYS CE C 13 41.999 0.3 A 21 LYS CG C 13 24.891 0.3 A 21 LYS N N 15 117.972 0.2 A 22 VAL H H 1 8.127 0.02 A 22 VAL HA H 1 3.772 0.02 A 22 VAL HB H 1 1.331 0.02 A 22 VAL HG1% H 1 0.767 0.02 A 22 VAL HG2% H 1 0.483 0.02 A 22 VAL C C 13 177.384 0.3 A 22 VAL CA C 13 64.502 0.3 A 22 VAL CB C 13 32.636 0.3 A 22 VAL CG1 C 13 21.587 0.3 A 22 VAL CG2 C 13 20.556 0.3 A 22 VAL N N 15 118.596 0.2 A 23 LYS H H 1 8.205 0.02 A 23 LYS HA H 1 4.025 0.02 A 23 LYS HB2 H 1 1.914 0.02 A 23 LYS HB3 H 1 1.914 0.02 A 23 LYS HDy H 1 1.687 0.02 A 23 LYS HDx H 1 1.607 0.02 A 23 LYS HE2 H 1 2.995 0.02 A 23 LYS HE3 H 1 2.995 0.02 A 23 LYS HGy H 1 1.312 0.02 A 23 LYS HGx H 1 1.149 0.02 A 23 LYS C C 13 176.138 0.3 A 23 LYS CA C 13 57.815 0.3 A 23 LYS CB C 13 30.359 0.3 A 23 LYS CD C 13 29.263 0.3 A 23 LYS CE C 13 41.822 0.3 A 23 LYS CG C 13 25.237 0.3 A 23 LYS N N 15 114.369 0.2 A 24 THR H H 1 7.330 0.02 A 24 THR HA H 1 4.463 0.02 A 24 THR HB H 1 4.199 0.02 A 24 THR HG2% H 1 1.267 0.02 A 24 THR C C 13 175.448 0.3 A 24 THR CA C 13 60.943 0.3 A 24 THR CB C 13 70.747 0.3 A 24 THR CG2 C 13 22.116 0.3 A 24 THR N N 15 111.092 0.2 A 25 ASP H H 1 8.980 0.02 A 25 ASP HA H 1 4.475 0.02 A 25 ASP HBy H 1 2.687 0.02 A 25 ASP HBx H 1 2.665 0.02 A 25 ASP C C 13 178.051 0.3 A 25 ASP CA C 13 56.483 0.3 A 25 ASP CB C 13 40.622 0.3 A 25 ASP N N 15 126.059 0.2 A 26 GLY H H 1 9.012 0.02 A 26 GLY HAy H 1 4.192 0.02 A 26 GLY HAx H 1 4.024 0.02 A 26 GLY C C 13 175.163 0.3 A 26 GLY CA C 13 45.657 0.3 A 26 GLY N N 15 112.306 0.2 A 27 TYR H H 1 7.732 0.02 A 27 TYR HA H 1 3.849 0.02 A 27 TYR HB2 H 1 3.332 0.02 A 27 TYR HB3 H 1 2.771 0.02 A 27 TYR HD1 H 1 6.814 0.02 A 27 TYR HD2 H 1 6.814 0.02 A 27 TYR HE1 H 1 6.793 0.02 A 27 TYR HE2 H 1 6.793 0.02 A 27 TYR C C 13 176.802 0.3 A 27 TYR CA C 13 63.105 0.3 A 27 TYR CB C 13 39.368 0.3 A 27 TYR CD1 C 13 132.577 0.3 A 27 TYR CE1 C 13 117.492 0.3 A 27 TYR N N 15 121.095 0.2 A 28 PHE H H 1 9.213 0.02 A 28 PHE HA H 1 3.923 0.02 A 28 PHE HB2 H 1 3.125 0.02 A 28 PHE HB3 H 1 3.125 0.02 A 28 PHE HD1 H 1 7.050 0.02 A 28 PHE HD2 H 1 7.050 0.02 A 28 PHE HE1 H 1 7.437 0.02 A 28 PHE HE2 H 1 7.437 0.02 A 28 PHE HZ H 1 7.347 0.02 A 28 PHE C C 13 176.222 0.3 A 28 PHE CA C 13 62.928 0.3 A 28 PHE CB C 13 39.621 0.3 A 28 PHE CD1 C 13 131.264 0.3 A 28 PHE CE1 C 13 132.032 0.3 A 28 PHE CZ C 13 130.607 0.3 A 28 PHE N N 15 118.990 0.2 A 29 TYR H H 1 8.343 0.02 A 29 TYR HA H 1 3.734 0.02 A 29 TYR HBy H 1 3.146 0.02 A 29 TYR HBx H 1 2.861 0.02 A 29 TYR HD1 H 1 7.023 0.02 A 29 TYR HD2 H 1 7.023 0.02 A 29 TYR HE1 H 1 6.740 0.02 A 29 TYR HE2 H 1 6.740 0.02 A 29 TYR C C 13 178.572 0.3 A 29 TYR CA C 13 61.997 0.3 A 29 TYR CB C 13 38.055 0.3 A 29 TYR CD1 C 13 132.764 0.3 A 29 TYR CE1 C 13 118.230 0.3 A 29 TYR N N 15 117.813 0.2 A 30 GLU H H 1 7.701 0.02 A 30 GLU HA H 1 3.595 0.02 A 30 GLU HBy H 1 2.021 0.02 A 30 GLU HBx H 1 1.906 0.02 A 30 GLU HGy H 1 2.344 0.02 A 30 GLU HGx H 1 2.147 0.02 A 30 GLU C C 13 177.808 0.3 A 30 GLU CA C 13 59.663 0.3 A 30 GLU CB C 13 29.118 0.3 A 30 GLU CG C 13 35.775 0.3 A 30 GLU N N 15 120.626 0.2 A 31 CYS H H 1 8.839 0.02 A 31 CYS HA H 1 3.661 0.02 A 31 CYS HBy H 1 3.012 0.02 A 31 CYS HBx H 1 2.359 0.02 A 31 CYS C C 13 176.742 0.3 A 31 CYS CA C 13 60.380 0.3 A 31 CYS CB C 13 36.604 0.3 A 31 CYS N N 15 120.469 0.2 A 32 CYS H H 1 8.094 0.02 A 32 CYS HA H 1 3.903 0.02 A 32 CYS HB2 H 1 3.004 0.02 A 32 CYS HB3 H 1 2.535 0.02 A 32 CYS C C 13 173.755 0.3 A 32 CYS CA C 13 56.969 0.3 A 32 CYS CB C 13 40.519 0.3 A 32 CYS N N 15 117.537 0.2 A 33 THR H H 1 7.244 0.02 A 33 THR HA H 1 4.581 0.02 A 33 THR HB H 1 3.811 0.02 A 33 THR HG2% H 1 0.562 0.02 A 33 THR C C 13 174.891 0.3 A 33 THR CA C 13 61.790 0.3 A 33 THR CB C 13 71.261 0.3 A 33 THR CG2 C 13 20.528 0.3 A 33 THR N N 15 106.873 0.2 A 34 SER H H 1 8.563 0.02 A 34 SER HA H 1 4.861 0.02 A 34 SER HBy H 1 4.032 0.02 A 34 SER HBx H 1 3.837 0.02 A 34 SER CA C 13 55.656 0.3 A 34 SER CB C 13 62.685 0.3 A 34 SER N N 15 118.412 0.2 A 35 ASP H H 1 9.474 0.02 A 35 ASP HA H 1 4.522 0.02 A 35 ASP HBy H 1 2.828 0.02 A 35 ASP HBx H 1 2.732 0.02 A 35 ASP C C 13 178.445 0.3 A 35 ASP CA C 13 57.758 0.3 A 35 ASP CB C 13 39.117 0.3 A 35 ASP N N 15 132.577 0.2 A 36 SER H H 1 8.479 0.02 A 36 SER HA H 1 4.269 0.02 A 36 SER HBy H 1 3.886 0.02 A 36 SER HBx H 1 3.843 0.02 A 36 SER C C 13 177.591 0.3 A 36 SER CA C 13 61.410 0.3 A 36 SER CB C 13 62.071 0.3 A 36 SER N N 15 117.257 0.2 A 37 THR H H 1 7.760 0.02 A 37 THR HA H 1 3.930 0.02 A 37 THR HB H 1 4.061 0.02 A 37 THR HG2% H 1 0.950 0.02 A 37 THR C C 13 176.492 0.3 A 37 THR CA C 13 67.213 0.3 A 37 THR CB C 13 68.042 0.3 A 37 THR CG2 C 13 21.614 0.3 A 37 THR N N 15 121.630 0.2 A 38 PHE H H 1 8.501 0.02 A 38 PHE HA H 1 4.670 0.02 A 38 PHE HBy H 1 3.822 0.02 A 38 PHE HBx H 1 2.938 0.02 A 38 PHE HD1 H 1 7.155 0.02 A 38 PHE HD2 H 1 7.155 0.02 A 38 PHE HE1 H 1 7.193 0.02 A 38 PHE HE2 H 1 7.193 0.02 A 38 PHE HZ H 1 7.029 0.02 A 38 PHE C C 13 176.883 0.3 A 38 PHE CA C 13 60.202 0.3 A 38 PHE CB C 13 38.618 0.3 A 38 PHE CD1 C 13 131.878 0.3 A 38 PHE CE1 C 13 131.878 0.3 A 38 PHE CZ C 13 129.346 0.3 A 38 PHE N N 15 122.970 0.2 A 39 LYS H H 1 8.253 0.02 A 39 LYS HA H 1 3.781 0.02 A 39 LYS HB2 H 1 1.914 0.02 A 39 LYS HB3 H 1 1.914 0.02 A 39 LYS HD2 H 1 1.911 0.02 A 39 LYS HD3 H 1 1.911 0.02 A 39 LYS HE2 H 1 2.967 0.02 A 39 LYS HE3 H 1 2.967 0.02 A 39 LYS HGy H 1 1.452 0.02 A 39 LYS HGx H 1 1.396 0.02 A 39 LYS C C 13 178.654 0.3 A 39 LYS CA C 13 59.825 0.3 A 39 LYS CB C 13 31.960 0.3 A 39 LYS CD C 13 31.445 0.3 A 39 LYS CE C 13 42.368 0.3 A 39 LYS CG C 13 25.240 0.3 A 39 LYS N N 15 121.095 0.2 A 40 LYS H H 1 7.331 0.02 A 40 LYS HA H 1 4.106 0.02 A 40 LYS HB2 H 1 2.014 0.02 A 40 LYS HB3 H 1 1.968 0.02 A 40 LYS HD2 H 1 1.663 0.02 A 40 LYS HD3 H 1 1.663 0.02 A 40 LYS HE2 H 1 3.091 0.02 A 40 LYS HE3 H 1 3.091 0.02 A 40 LYS HG2 H 1 1.530 0.02 A 40 LYS HG3 H 1 1.530 0.02 A 40 LYS C C 13 179.253 0.3 A 40 LYS CA C 13 59.329 0.3 A 40 LYS CB C 13 32.060 0.3 A 40 LYS CD C 13 29.260 0.3 A 40 LYS CG C 13 25.437 0.3 A 40 LYS N N 15 118.082 0.2 A 41 CYS H H 1 8.259 0.02 A 41 CYS HA H 1 4.598 0.02 A 41 CYS HB2 H 1 3.954 0.02 A 41 CYS HB3 H 1 3.247 0.02 A 41 CYS C C 13 175.867 0.3 A 41 CYS CA C 13 58.131 0.3 A 41 CYS CB C 13 37.021 0.3 A 41 CYS N N 15 120.227 0.2 A 42 GLN H H 1 8.144 0.02 A 42 GLN HA H 1 3.721 0.02 A 42 GLN HB2 H 1 1.989 0.02 A 42 GLN HB3 H 1 1.646 0.02 A 42 GLN HE2y H 1 6.616 0.02 A 42 GLN HE2x H 1 6.170 0.02 A 42 GLN HG2 H 1 1.649 0.02 A 42 GLN HG3 H 1 1.649 0.02 A 42 GLN C C 13 179.426 0.3 A 42 GLN CA C 13 59.816 0.3 A 42 GLN CB C 13 29.051 0.3 A 42 GLN CG C 13 35.268 0.3 A 42 GLN N N 15 117.500 0.2 A 42 GLN NE2 N 15 111.696 0.2 A 43 ASP H H 1 7.642 0.02 A 43 ASP HA H 1 4.341 0.02 A 43 ASP HB2 H 1 2.795 0.02 A 43 ASP HB3 H 1 2.675 0.02 A 43 ASP C C 13 177.973 0.3 A 43 ASP CA C 13 56.762 0.3 A 43 ASP CB C 13 40.263 0.3 A 43 ASP N N 15 117.813 0.2 A 44 LEU H H 1 7.899 0.02 A 44 LEU HA H 1 4.199 0.02 A 44 LEU HB2 H 1 2.052 0.02 A 44 LEU HB3 H 1 1.771 0.02 A 44 LEU HD1% H 1 0.872 0.02 A 44 LEU HD2% H 1 0.840 0.02 A 44 LEU HG H 1 1.853 0.02 A 44 LEU C C 13 178.592 0.3 A 44 LEU CA C 13 56.796 0.3 A 44 LEU CB C 13 42.400 0.3 A 44 LEU CD1 C 13 24.721 0.3 A 44 LEU CD2 C 13 24.345 0.3 A 44 LEU CG C 13 26.530 0.3 A 44 LEU N N 15 121.251 0.2 A 45 LEU H H 1 7.417 0.02 A 45 LEU HA H 1 4.248 0.02 A 45 LEU HB2 H 1 1.695 0.02 A 45 LEU HB3 H 1 1.538 0.02 A 45 LEU HD1% H 1 0.999 0.02 A 45 LEU HD2% H 1 0.702 0.02 A 45 LEU HG H 1 1.929 0.02 A 45 LEU C C 13 176.736 0.3 A 45 LEU CA C 13 54.878 0.3 A 45 LEU CB C 13 41.748 0.3 A 45 LEU CD1 C 13 25.933 0.3 A 45 LEU CD2 C 13 21.614 0.3 A 45 LEU CG C 13 25.437 0.3 A 45 LEU N N 15 117.813 0.2 A 46 HIS H H 1 7.481 0.02 A 46 HIS HA H 1 4.328 0.02 A 46 HIS HBy H 1 3.265 0.02 A 46 HIS HBx H 1 3.182 0.02 A 46 HIS HD2 H 1 7.261 0.02 A 46 HIS HE1 H 1 8.525 0.02 A 46 HIS CA C 13 57.114 0.3 A 46 HIS CB C 13 29.491 0.3 A 46 HIS CD2 C 13 119.538 0.3 A 46 HIS CE1 C 13 135.684 0.3 A 46 HIS N N 15 121.988 0.2 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin undefined _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 5 CYS SG A 32 CYS SG 1.0 . 1.98 2 2 A 5 CYS SG A 32 CYS CB 1.0 . 2.90 3 3 A 32 CYS SG A 5 CYS CB 1.0 . 2.90 4 4 A 15 CYS SG A 31 CYS SG 1.0 . 1.98 5 5 A 15 CYS SG A 31 CYS CB 1.0 . 2.90 6 6 A 31 CYS SG A 15 CYS CB 1.0 . 2.90 7 7 A 18 CYS SG A 41 CYS SG 1.0 . 1.98 8 8 A 18 CYS SG A 41 CYS CB 1.0 . 2.90 9 9 A 41 CYS SG A 18 CYS CB 1.0 . 2.90 10 10 A 5 CYS SG A 32 CYS SG 1.0 . 2.10 11 11 A 5 CYS SG A 32 CYS CB 1.0 . 3.10 12 12 A 32 CYS SG A 5 CYS CB 1.0 . 3.10 13 13 A 15 CYS SG A 31 CYS SG 1.0 . 2.10 14 14 A 15 CYS SG A 31 CYS CB 1.0 . 3.10 15 15 A 31 CYS SG A 15 CYS CB 1.0 . 3.10 16 16 A 18 CYS SG A 41 CYS SG 1.0 . 2.10 17 17 A 18 CYS SG A 41 CYS CB 1.0 . 3.10 18 18 A 41 CYS SG A 18 CYS CB 1.0 . 3.10 stop_ save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 23 LYS H A 23 LYS HA 1.0 . 2.71 2 2 A 37 THR H A 37 THR HB 1.0 . 2.75 3 3 A 43 ASP HA A 46 HIS H 1.0 . 3.67 4 4 A 15 CYS H A 15 CYS HBy 1.0 . 3.79 5 5 A 15 CYS H A 15 CYS HBx 1.0 . 3.79 6 6 A 9 LEU H A 9 LEU HG 1.0 . 3.04 7 7 A 38 PHE H A 38 PHE HBy 1.0 . 3.02 8 8 A 41 CYS H A 41 CYS HB2 1.0 . 3.19 9 9 A 41 CYS H A 41 CYS HB3 1.0 . 3.06 10 10 A 5 CYS H A 5 CYS HBy 1.0 . 3.60 11 11 A 5 CYS H A 5 CYS HBx 1.0 . 3.60 12 12 A 46 HIS H A 46 HIS HBy 1.0 . 3.65 13 13 A 46 HIS H A 46 HIS HBx 1.0 . 3.65 14 14 A 24 THR H A 24 THR HB 1.0 . 3.53 15 15 A 24 THR H A 24 THR HG2% 1.0 . 3.94 16 16 A 33 THR H A 33 THR HB 1.0 . 4.02 17 17 A 38 PHE H A 38 PHE HBx 1.0 . 3.02 18 18 A 18 CYS H A 18 CYS HB2 1.0 . 3.22 19 19 A 9 LEU H A 8 SER HA 1.0 . 2.88 20 20 A 11 ARG HA A 14 ALA H 1.0 . 4.13 21 21 A 16 GLY HA3 A 17 GLN H 1.0 . 3.15 22 22 A 34 SER HA A 35 ASP H 1.0 . 2.71 23 23 A 23 LYS H A 22 VAL HA 1.0 . 3.49 24 24 A 23 LYS HA A 24 THR H 1.0 . 3.34 25 25 A 24 THR HA A 25 ASP H 1.0 . 2.83 26 26 A 25 ASP HA A 26 GLY H 1.0 . 2.79 27 27 A 19 ARG HA A 28 PHE H 1.0 . 4.33 28 28 A 6 GLU H A 6 GLU HG2 1.0 . 3.97 29 28 A 6 GLU H A 6 GLU HG3 1.0 . 3.97 30 29 A 6 GLU H A 6 GLU HBx 1.0 . 3.51 31 30 A 7 ASN H A 7 ASN HBx 1.0 . 4.15 32 31 A 10 ARG H A 10 ARG HD2 1.0 . 4.54 33 31 A 10 ARG H A 10 ARG HD3 1.0 . 4.54 34 32 A 10 ARG HB2 A 11 ARG H 1.0 . 3.26 35 33 A 11 ARG H A 11 ARG HBy 1.0 . 3.44 36 34 A 11 ARG H A 11 ARG HBx 1.0 . 3.44 37 35 A 14 ALA H A 14 ALA HB% 1.0 . 2.71 38 36 A 17 GLN H A 17 GLN HGx 1.0 . 3.58 39 37 A 17 GLN H A 17 GLN HB3 1.0 . 3.60 40 38 A 17 GLN H A 17 GLN HGy 1.0 . 3.58 41 39 A 17 GLN H A 17 GLN HB2 1.0 . 2.79 42 40 A 20 ASP H A 20 ASP HB2 1.0 . 2.83 43 40 A 20 ASP H A 20 ASP HB3 1.0 . 2.83 44 41 A 12 GLU H A 13 ILE HB 1.0 . 5.03 45 42 A 13 ILE HB A 13 ILE H 1.0 . 2.68 46 43 A 13 ILE H A 13 ILE HG2% 1.0 . 3.83 47 44 A 23 LYS H A 23 LYS HE2 1.0 . 5.50 48 44 A 23 LYS H A 23 LYS HE3 1.0 . 5.50 49 45 A 23 LYS H A 23 LYS HB2 1.0 . 3.34 50 45 A 23 LYS H A 23 LYS HB3 1.0 . 3.34 51 46 A 23 LYS H A 22 VAL HB 1.0 . 3.15 52 47 A 27 TYR H A 27 TYR HB3 1.0 . 2.98 53 48 A 29 TYR H A 29 TYR HBx 1.0 . 3.64 54 49 A 4 LYS H A 4 LYS HB3 1.0 . 3.90 55 50 A 4 LYS H A 4 LYS HB2 1.0 . 3.11 56 51 A 31 CYS H A 31 CYS HBy 1.0 . 3.75 57 52 A 32 CYS H A 32 CYS HB3 1.0 . 3.67 58 53 A 32 CYS H A 32 CYS HB2 1.0 . 3.23 59 54 A 35 ASP H A 35 ASP HBy 1.0 . 3.76 60 55 A 35 ASP H A 35 ASP HBx 1.0 . 3.76 61 56 A 37 THR H A 37 THR HG2% 1.0 . 4.00 62 57 A 39 LYS H A 39 LYS HB2 1.0 . 2.59 63 57 A 39 LYS H A 39 LYS HB3 1.0 . 2.59 64 58 A 39 LYS H A 40 LYS HD2 1.0 . 4.45 65 58 A 39 LYS H A 40 LYS HD3 1.0 . 4.45 66 59 A 43 ASP H A 43 ASP HB3 1.0 . 2.90 67 60 A 43 ASP H A 43 ASP HB2 1.0 . 3.36 68 61 A 1 ALA HA A 2 ASP H 1.0 . 3.05 69 62 A 2 ASP H A 2 ASP HBx 1.0 . 3.88 70 63 A 2 ASP H A 2 ASP HBy 1.0 . 3.88 71 64 A 2 ASP H A 1 ALA HB% 1.0 . 3.78 72 65 A 2 ASP H A 3 ASN H 1.0 . 4.59 73 66 A 3 ASN H A 3 ASN HBy 1.0 . 3.48 74 67 A 3 ASN H A 3 ASN HBx 1.0 . 3.48 75 68 A 1 ALA HB% A 3 ASN H 1.0 . 5.50 76 69 A 3 ASN H A 33 THR HG2% 1.0 . 4.41 77 70 A 3 ASN H A 2 ASP HA 1.0 . 2.69 78 71 A 4 LYS H A 33 THR HG2% 1.0 . 3.74 79 72 A 5 CYS H A 6 GLU H 1.0 . 3.15 80 73 A 5 CYS H A 7 ASN H 1.0 . 4.63 81 74 A 4 LYS H A 5 CYS HA 1.0 . 5.50 82 75 A 33 THR HB A 4 LYS H 1.0 . 5.50 83 76 A 4 LYS H A 3 ASN HA 1.0 . 2.68 84 77 A 4 LYS H A 33 THR HA 1.0 . 4.00 85 78 A 6 GLU H A 4 LYS H 1.0 . 4.24 86 79 A 4 LYS H A 3 ASN H 1.0 . 4.69 87 80 A 5 CYS H A 32 CYS HB3 1.0 . 3.46 88 81 A 5 CYS H A 3 ASN HA 1.0 . 4.03 89 82 A 5 CYS H A 32 CYS HB2 1.0 . 5.50 90 83 A 5 CYS H A 4 LYS HB3 1.0 . 4.76 91 84 A 5 CYS H A 4 LYS HB2 1.0 . 3.95 92 85 A 6 GLU H A 6 GLU HBy 1.0 . 3.51 93 86 A 6 GLU H A 5 CYS HBx 1.0 . 4.34 94 87 A 6 GLU H A 5 CYS HBy 1.0 . 4.34 95 88 A 6 GLU H A 4 LYS HA 1.0 . 4.34 96 89 A 6 GLU H A 7 ASN H 1.0 . 3.38 97 90 A 7 ASN H A 6 GLU HBy 1.0 . 4.11 98 91 A 7 ASN H A 6 GLU HBx 1.0 . 4.11 99 92 A 7 ASN H A 4 LYS HA 1.0 . 4.05 100 93 A 7 ASN H A 8 SER H 1.0 . 2.82 101 94 A 8 SER H A 6 GLU HA 1.0 . 4.81 102 95 A 8 SER H A 7 ASN HBy 1.0 . 4.70 103 96 A 8 SER H A 7 ASN HBx 1.0 . 4.70 104 97 A 8 SER H A 11 ARG HBy 1.0 . 5.18 105 98 A 9 LEU H A 8 SER H 1.0 . 4.48 106 99 A 5 CYS HA A 8 SER H 1.0 . 3.70 107 100 A 9 LEU H A 9 LEU HD1% 1.0 . 4.25 108 101 A 9 LEU H A 8 SER HBy 1.0 . 5.05 109 102 A 9 LEU H A 8 SER HBx 1.0 . 5.05 110 103 A 10 ARG H A 9 LEU HD2% 1.0 . 4.22 111 104 A 10 ARG H A 8 SER HBy 1.0 . 5.50 112 105 A 10 ARG H A 8 SER HBx 1.0 . 5.50 113 106 A 8 SER HA A 10 ARG H 1.0 . 4.95 114 107 A 9 LEU H A 10 ARG H 1.0 . 3.34 115 108 A 11 ARG H A 12 GLU H 1.0 . 3.18 116 109 A 10 ARG H A 11 ARG H 1.0 . 3.43 117 110 A 11 ARG H A 11 ARG HG2 1.0 . 4.90 118 111 A 11 ARG H A 8 SER HBy 1.0 . 4.85 119 112 A 11 ARG H A 8 SER HBx 1.0 . 4.85 120 113 A 12 GLU H A 9 LEU HD1% 1.0 . 5.30 121 114 A 12 GLU H A 10 ARG HA 1.0 . 4.86 122 115 A 12 GLU H A 5 CYS HA 1.0 . 3.83 123 116 A 12 GLU H A 8 SER H 1.0 . 5.50 124 117 A 12 GLU H A 13 ILE H 1.0 . 3.07 125 118 A 11 ARG H A 13 ILE H 1.0 . 4.85 126 119 A 13 ILE H A 12 GLU HB3 1.0 . 2.92 127 120 A 13 ILE H A 10 ARG HA 1.0 . 4.06 128 121 A 13 ILE H A 9 LEU HA 1.0 . 4.61 129 122 A 14 ALA HB% A 13 ILE H 1.0 . 4.36 130 123 A 13 ILE H A 13 ILE HG12 1.0 . 3.60 131 124 A 14 ALA H A 13 ILE HG2% 1.0 . 3.91 132 125 A 14 ALA H A 13 ILE HD1% 1.0 . 4.70 133 126 A 14 ALA H A 13 ILE HG12 1.0 . 5.21 134 127 A 14 ALA H A 13 ILE HB 1.0 . 3.14 135 128 A 14 ALA H A 13 ILE HG13 1.0 . 4.41 136 129 A 14 ALA H A 10 ARG HA 1.0 . 4.50 137 130 A 14 ALA H A 16 GLY H 1.0 . 4.48 138 131 A 14 ALA H A 13 ILE H 1.0 . 3.38 139 132 A 15 CYS H A 11 ARG HA 1.0 . 4.32 140 133 A 15 CYS H A 38 PHE HE% 1.0 . 4.41 141 134 A 15 CYS H A 14 ALA H 1.0 . 3.38 142 135 A 16 GLY H A 12 GLU HA 1.0 . 4.23 143 136 A 16 GLY H A 13 ILE HA 1.0 . 3.81 144 137 A 16 GLY H A 15 CYS HBy 1.0 . 4.16 145 138 A 16 GLY H A 15 CYS HBx 1.0 . 4.16 146 139 A 14 ALA HB% A 16 GLY H 1.0 . 4.67 147 140 A 16 GLY H A 28 PHE HD% 1.0 . 4.52 148 141 A 16 GLY H A 28 PHE HE% 1.0 . 3.72 149 142 A 17 GLN H A 16 GLY H 1.0 . 3.21 150 143 A 15 CYS H A 16 GLY H 1.0 . 3.52 151 144 A 16 GLY H A 19 ARG H 1.0 . 5.02 152 145 A 17 GLN H A 45 LEU HD1% 1.0 . 4.77 153 146 A 17 GLN H A 14 ALA HB% 1.0 . 5.08 154 147 A 15 CYS H A 17 GLN H 1.0 . 4.49 155 148 A 18 CYS H A 17 GLN H 1.0 . 3.24 156 149 A 18 CYS H A 16 GLY HA2 1.0 . 5.48 157 150 A 18 CYS H A 19 ARG HA 1.0 . 5.50 158 151 A 18 CYS H A 18 CYS HB3 1.0 . 3.62 159 152 A 18 CYS H A 17 GLN HB2 1.0 . 3.30 160 153 A 18 CYS H A 17 GLN HB3 1.0 . 3.84 161 154 A 18 CYS H A 45 LEU HD1% 1.0 . 4.01 162 155 A 18 CYS H A 45 LEU HD2% 1.0 . 4.25 163 156 A 18 CYS H A 15 CYS HA 1.0 . 4.33 164 157 A 18 CYS H A 27 TYR HE% 1.0 . 5.04 165 158 A 18 CYS H A 19 ARG H 1.0 . 3.60 166 159 A 19 ARG H A 18 CYS HB3 1.0 . 3.97 167 160 A 19 ARG H A 28 PHE HB2 1.0 . 4.94 168 160 A 19 ARG H A 28 PHE HB3 1.0 . 4.94 169 161 A 19 ARG H A 20 ASP HB2 1.0 . 5.38 170 161 A 20 ASP HB3 A 19 ARG H 1.0 . 5.38 171 162 A 27 TYR HB3 A 19 ARG H 1.0 . 5.50 172 163 A 19 ARG H A 19 ARG HB3 1.0 . 3.09 173 164 A 19 ARG H A 19 ARG HB2 1.0 . 3.09 174 165 A 19 ARG H A 22 VAL HG2% 1.0 . 4.88 175 166 A 17 GLN H A 19 ARG H 1.0 . 4.97 176 167 A 19 ARG H A 27 TYR HD% 1.0 . 4.29 177 168 A 19 ARG H A 27 TYR HE% 1.0 . 4.84 178 169 A 20 ASP H A 19 ARG H 1.0 . 3.55 179 170 A 20 ASP H A 22 VAL H 1.0 . 4.76 180 171 A 20 ASP H A 21 LYS H 1.0 . 3.29 181 172 A 20 ASP H A 17 GLN HA 1.0 . 3.95 182 173 A 20 ASP H A 18 CYS HA 1.0 . 5.08 183 174 A 18 CYS HB2 A 20 ASP H 1.0 . 5.50 184 175 A 20 ASP H A 19 ARG HB3 1.0 . 3.22 185 176 A 20 ASP H A 19 ARG HB2 1.0 . 4.10 186 177 A 20 ASP H A 21 LYS HB2 1.0 . 4.72 187 178 A 21 LYS H A 21 LYS HB3 1.0 . 3.68 188 179 A 21 LYS H A 21 LYS HB2 1.0 . 3.14 189 180 A 22 VAL HG2% A 21 LYS H 1.0 . 4.38 190 181 A 21 LYS H A 20 ASP HB2 1.0 . 3.52 191 181 A 20 ASP HB3 A 21 LYS H 1.0 . 3.52 192 182 A 21 LYS H A 18 CYS HA 1.0 . 3.81 193 183 A 19 ARG H A 21 LYS H 1.0 . 5.33 194 184 A 22 VAL HB A 22 VAL H 1.0 . 2.99 195 185 A 22 VAL H A 22 VAL HG1% 1.0 . 3.86 196 186 A 22 VAL HG2% A 22 VAL H 1.0 . 2.91 197 187 A 22 VAL H A 21 LYS HB2 1.0 . 3.22 198 188 A 22 VAL H A 21 LYS HB3 1.0 . 3.36 199 189 A 18 CYS HB3 A 22 VAL H 1.0 . 4.31 200 190 A 22 VAL H A 21 LYS H 1.0 . 2.92 201 191 A 23 LYS H A 22 VAL HG1% 1.0 . 3.82 202 192 A 23 LYS H A 22 VAL HG2% 1.0 . 4.06 203 193 A 23 LYS H A 24 THR H 1.0 . 3.47 204 194 A 24 THR H A 23 LYS HB2 1.0 . 3.93 205 194 A 24 THR H A 23 LYS HB3 1.0 . 3.93 206 195 A 24 THR H A 22 VAL HG1% 1.0 . 3.42 207 196 A 24 THR H A 27 TYR HB2 1.0 . 4.14 208 197 A 24 THR H A 27 TYR HB3 1.0 . 4.67 209 198 A 24 THR H A 19 ARG HA 1.0 . 5.10 210 199 A 24 THR H A 27 TYR HD% 1.0 . 4.92 211 200 A 24 THR HG2% A 25 ASP H 1.0 . 3.52 212 201 A 24 THR H A 25 ASP H 1.0 . 4.40 213 202 A 24 THR HG2% A 27 TYR H 1.0 . 4.35 214 203 A 27 TYR H A 27 TYR HB2 1.0 . 2.92 215 204 A 27 TYR H A 28 PHE HB2 1.0 . 4.88 216 204 A 27 TYR H A 28 PHE HB3 1.0 . 4.88 217 205 A 25 ASP HA A 27 TYR H 1.0 . 3.82 218 206 A 27 TYR H A 27 TYR HD% 1.0 . 4.22 219 207 A 24 THR H A 27 TYR H 1.0 . 4.99 220 208 A 26 GLY H A 27 TYR H 1.0 . 3.16 221 209 A 28 PHE H A 27 TYR H 1.0 . 3.54 222 210 A 28 PHE H A 19 ARG HGx 1.0 . 4.75 223 211 A 28 PHE H A 19 ARG HB2 1.0 . 4.56 224 212 A 28 PHE H A 19 ARG HGy 1.0 . 4.75 225 213 A 28 PHE H A 27 TYR HB3 1.0 . 3.32 226 214 A 28 PHE H A 28 PHE HB2 1.0 . 2.71 227 214 A 28 PHE H A 28 PHE HB3 1.0 . 2.71 228 215 A 28 PHE H A 27 TYR HB2 1.0 . 3.93 229 216 A 28 PHE H A 28 PHE HD% 1.0 . 4.90 230 217 A 28 PHE H A 27 TYR HD% 1.0 . 4.34 231 218 A 27 TYR HB3 A 29 TYR H 1.0 . 5.28 232 219 A 29 TYR H A 28 PHE HB2 1.0 . 2.74 233 219 A 29 TYR H A 28 PHE HB3 1.0 . 2.74 234 220 A 29 TYR H A 30 GLU H 1.0 . 3.28 235 221 A 29 TYR H A 28 PHE HD% 1.0 . 3.80 236 222 A 28 PHE H A 29 TYR H 1.0 . 3.33 237 223 A 30 GLU H A 30 GLU HBy 1.0 . 3.05 238 224 A 30 GLU H A 30 GLU HBx 1.0 . 3.05 239 225 A 30 GLU H A 30 GLU HGx 1.0 . 4.81 240 226 A 30 GLU H A 27 TYR HA 1.0 . 3.71 241 227 A 37 THR HG2% A 30 GLU H 1.0 . 5.38 242 228 A 33 THR H A 30 GLU H 1.0 . 5.39 243 229 A 30 GLU H A 29 TYR HD% 1.0 . 4.30 244 230 A 31 CYS H A 30 GLU H 1.0 . 3.34 245 231 A 28 PHE H A 30 GLU H 1.0 . 4.67 246 232 A 31 CYS H A 28 PHE HB2 1.0 . 5.50 247 232 A 31 CYS H A 28 PHE HB3 1.0 . 5.50 248 233 A 31 CYS H A 28 PHE HA 1.0 . 4.02 249 234 A 31 CYS H A 31 CYS HBx 1.0 . 3.75 250 235 A 31 CYS H A 30 GLU HBy 1.0 . 3.92 251 236 A 31 CYS H A 30 GLU HBx 1.0 . 3.92 252 237 A 31 CYS H A 37 THR HG2% 1.0 . 3.73 253 238 A 31 CYS H A 27 TYR HD% 1.0 . 4.68 254 239 A 33 THR H A 31 CYS H 1.0 . 4.83 255 240 A 31 CYS H A 32 CYS H 1.0 . 3.53 256 241 A 23 LYS H A 22 VAL H 1.0 . 2.88 257 242 A 32 CYS H A 29 TYR HA 1.0 . 3.88 258 243 A 32 CYS H A 31 CYS HBx 1.0 . 4.37 259 244 A 32 CYS H A 33 THR HG2% 1.0 . 4.84 260 245 A 32 CYS H A 30 GLU H 1.0 . 4.72 261 246 A 33 THR H A 32 CYS H 1.0 . 3.41 262 247 A 33 THR H A 33 THR HG2% 1.0 . 3.32 263 248 A 33 THR H A 30 GLU HA 1.0 . 4.11 264 249 A 33 THR H A 32 CYS HB3 1.0 . 4.46 265 250 A 33 THR H A 32 CYS HB2 1.0 . 4.07 266 251 A 33 THR H A 34 SER HA 1.0 . 4.85 267 252 A 31 CYS HA A 34 SER H 1.0 . 3.79 268 253 A 33 THR HG2% A 34 SER H 1.0 . 4.41 269 254 A 33 THR H A 34 SER H 1.0 . 2.68 270 255 A 37 THR H A 34 SER H 1.0 . 5.43 271 256 A 31 CYS H A 34 SER H 1.0 . 4.99 272 257 A 35 ASP H A 34 SER H 1.0 . 4.44 273 258 A 35 ASP H A 34 SER HBy 1.0 . 4.57 274 259 A 35 ASP H A 34 SER HBx 1.0 . 4.57 275 260 A 37 THR HB A 36 SER H 1.0 . 5.50 276 261 A 36 SER H A 35 ASP HBy 1.0 . 3.96 277 262 A 36 SER H A 35 ASP HBx 1.0 . 3.96 278 263 A 34 SER HA A 36 SER H 1.0 . 3.96 279 264 A 35 ASP H A 36 SER H 1.0 . 3.31 280 265 A 37 THR H A 31 CYS HA 1.0 . 4.56 281 266 A 37 THR H A 35 ASP HA 1.0 . 4.99 282 267 A 37 THR H A 34 SER HA 1.0 . 4.60 283 268 A 37 THR H A 39 LYS H 1.0 . 4.75 284 269 A 37 THR H A 36 SER H 1.0 . 2.98 285 270 A 37 THR H A 35 ASP H 1.0 . 4.84 286 271 A 38 PHE H A 39 LYS HB2 1.0 . 4.64 287 271 A 38 PHE H A 39 LYS HB3 1.0 . 4.64 288 272 A 38 PHE H A 37 THR HG2% 1.0 . 3.97 289 273 A 38 PHE H A 31 CYS HA 1.0 . 4.16 290 274 A 37 THR HB A 38 PHE H 1.0 . 3.15 291 275 A 38 PHE H A 36 SER HA 1.0 . 4.57 292 276 A 38 PHE H A 35 ASP HA 1.0 . 3.68 293 277 A 38 PHE H A 38 PHE HD% 1.0 . 4.38 294 278 A 38 PHE H A 40 LYS H 1.0 . 4.59 295 279 A 37 THR H A 38 PHE H 1.0 . 3.05 296 280 A 38 PHE H A 35 ASP H 1.0 . 5.27 297 281 A 39 LYS H A 40 LYS HB2 1.0 . 5.35 298 282 A 39 LYS H A 42 GLN HB2 1.0 . 5.50 299 283 A 39 LYS H A 37 THR HA 1.0 . 4.66 300 284 A 39 LYS H A 36 SER HA 1.0 . 3.90 301 285 A 39 LYS H A 35 ASP HA 1.0 . 5.03 302 286 A 39 LYS H A 38 PHE HD% 1.0 . 4.31 303 287 A 38 PHE H A 39 LYS H 1.0 . 3.25 304 288 A 40 LYS H A 40 LYS HB2 1.0 . 2.69 305 289 A 40 LYS H A 40 LYS HD2 1.0 . 3.29 306 289 A 40 LYS HD3 A 40 LYS H 1.0 . 3.29 307 290 A 40 LYS H A 40 LYS HG2 1.0 . 3.53 308 290 A 40 LYS H A 40 LYS HG3 1.0 . 3.53 309 291 A 40 LYS H A 40 LYS HE2 1.0 . 5.50 310 291 A 40 LYS H A 40 LYS HE3 1.0 . 5.50 311 292 A 37 THR HG2% A 40 LYS H 1.0 . 5.07 312 293 A 41 CYS HB3 A 40 LYS H 1.0 . 4.94 313 294 A 40 LYS H A 37 THR HA 1.0 . 4.03 314 295 A 36 SER HA A 40 LYS H 1.0 . 5.36 315 296 A 40 LYS H A 42 GLN H 1.0 . 4.39 316 297 A 39 LYS H A 40 LYS H 1.0 . 3.14 317 298 A 41 CYS H A 40 LYS H 1.0 . 3.32 318 299 A 41 CYS H A 40 LYS HB2 1.0 . 3.15 319 300 A 41 CYS H A 40 LYS HD2 1.0 . 4.52 320 300 A 41 CYS H A 40 LYS HD3 1.0 . 4.52 321 301 A 41 CYS H A 37 THR HG2% 1.0 . 4.74 322 302 A 41 CYS H A 38 PHE HA 1.0 . 3.56 323 303 A 41 CYS H A 38 PHE HD% 1.0 . 5.50 324 304 A 42 GLN HB2 A 42 GLN H 1.0 . 3.00 325 305 A 42 GLN H A 42 GLN HG2 1.0 . 2.79 326 305 A 42 GLN H A 42 GLN HG3 1.0 . 2.79 327 306 A 45 LEU HD1% A 42 GLN H 1.0 . 5.27 328 307 A 41 CYS HB3 A 42 GLN H 1.0 . 3.37 329 308 A 41 CYS HB2 A 42 GLN H 1.0 . 4.11 330 309 A 42 GLN H A 40 LYS HA 1.0 . 4.58 331 310 A 38 PHE HD% A 42 GLN H 1.0 . 4.96 332 311 A 41 CYS H A 42 GLN H 1.0 . 3.15 333 312 A 43 ASP H A 42 GLN HB2 1.0 . 3.16 334 313 A 43 ASP H A 44 LEU HG 1.0 . 4.21 335 314 A 43 ASP H A 40 LYS HA 1.0 . 3.84 336 315 A 43 ASP H A 45 LEU H 1.0 . 4.47 337 316 A 43 ASP H A 44 LEU H 1.0 . 3.09 338 317 A 43 ASP H A 42 GLN H 1.0 . 3.24 339 318 A 41 CYS H A 43 ASP H 1.0 . 4.70 340 319 A 44 LEU H A 44 LEU HB3 1.0 . 3.65 341 320 A 44 LEU H A 44 LEU HB2 1.0 . 3.09 342 321 A 43 ASP HB3 A 44 LEU H 1.0 . 3.62 343 322 A 44 LEU H A 41 CYS HA 1.0 . 4.06 344 323 A 45 LEU H A 45 LEU HG 1.0 . 2.88 345 324 A 45 LEU H A 45 LEU HB2 1.0 . 3.35 346 325 A 45 LEU HD1% A 45 LEU H 1.0 . 3.72 347 326 A 45 LEU HD2% A 45 LEU H 1.0 . 3.82 348 327 A 45 LEU H A 44 LEU HD1% 1.0 . 4.34 349 328 A 45 LEU H A 44 LEU HB2 1.0 . 3.23 350 329 A 45 LEU H A 44 LEU HB3 1.0 . 3.77 351 330 A 45 LEU H A 42 GLN HA 1.0 . 3.92 352 331 A 43 ASP HA A 45 LEU H 1.0 . 4.75 353 332 A 45 LEU H A 44 LEU H 1.0 . 3.19 354 333 A 46 HIS H A 45 LEU HG 1.0 . 4.72 355 334 A 46 HIS H A 44 LEU HB2 1.0 . 4.62 356 335 A 46 HIS H A 45 LEU HB3 1.0 . 4.22 357 336 A 46 HIS H A 45 LEU HB2 1.0 . 4.61 358 337 A 46 HIS H A 45 LEU HD2% 1.0 . 5.17 359 338 A 46 HIS H A 44 LEU H 1.0 . 4.76 360 339 A 46 HIS H A 45 LEU H 1.0 . 2.70 361 340 A 7 ASN H A 7 ASN HBy 1.0 . 4.15 362 341 A 13 ILE HG2% A 17 GLN HE2x 1.0 . 4.35 363 342 A 13 ILE HG2% A 17 GLN HE2y 1.0 . 4.35 364 343 A 38 PHE HD% A 42 GLN HE2x 1.0 . 5.50 365 344 A 38 PHE HE% A 42 GLN HE2x 1.0 . 5.50 366 345 A 38 PHE HD% A 42 GLN HE2y 1.0 . 5.50 367 346 A 38 PHE HE% A 42 GLN HE2y 1.0 . 5.50 368 347 A 46 HIS H A 45 LEU HD1% 1.0 . 4.91 369 348 A 46 HIS H A 44 LEU HB3 1.0 . 5.50 370 349 A 8 SER H A 11 ARG HBx 1.0 . 5.18 371 350 A 15 CYS H A 13 ILE HG2% 1.0 . 5.37 372 351 A 18 CYS HB2 A 17 GLN H 1.0 . 5.24 373 352 A 9 LEU H A 9 LEU HD2% 1.0 . 4.35 374 353 A 13 ILE H A 13 ILE HD1% 1.0 . 3.78 375 354 A 44 LEU H A 44 LEU HD2% 1.0 . 3.84 376 355 A 43 ASP H A 42 GLN HB3 1.0 . 4.44 377 356 A 11 ARG H A 11 ARG HG3 1.0 . 4.74 378 357 A 18 CYS HB2 A 19 ARG H 1.0 . 3.65 379 358 A 13 ILE H A 13 ILE HG13 1.0 . 2.98 380 359 A 12 GLU H A 12 GLU HB3 1.0 . 3.13 381 360 A 45 LEU H A 45 LEU HB3 1.0 . 3.77 382 361 A 5 CYS H A 33 THR HG2% 1.0 . 5.03 383 362 A 6 GLU H A 4 LYS HB2 1.0 . 5.43 384 363 A 7 ASN H A 4 LYS H 1.0 . 5.50 385 364 A 2 ASP H A 33 THR HG2% 1.0 . 5.50 386 365 A 4 LYS H A 4 LYS HDx 1.0 . 4.38 387 366 A 4 LYS H A 4 LYS HDy 1.0 . 4.38 388 367 A 41 CYS H A 44 LEU HG 1.0 . 4.60 389 368 A 11 ARG H A 8 SER H 1.0 . 5.40 390 369 A 4 LYS H A 32 CYS HB3 1.0 . 3.71 391 370 A 9 LEU H A 9 LEU HB3 1.0 . 2.92 392 371 A 12 GLU H A 11 ARG HG2 1.0 . 5.50 393 372 A 18 CYS H A 19 ARG HB2 1.0 . 5.50 394 373 A 27 TYR H A 22 VAL HG1% 1.0 . 5.50 395 374 A 29 TYR H A 31 CYS H 1.0 . 5.50 396 375 A 44 LEU H A 45 LEU HB2 1.0 . 5.50 397 376 A 12 GLU H A 12 GLU HB2 1.0 . 3.72 398 377 A 9 LEU HG A 10 ARG H 1.0 . 4.15 399 378 A 10 ARG H A 10 ARG HB3 1.0 . 3.91 400 379 A 18 CYS H A 14 ALA HB% 1.0 . 5.50 401 380 A 15 CYS H A 16 GLY HA3 1.0 . 5.50 402 381 A 41 CYS H A 42 GLN HA 1.0 . 5.50 403 382 A 41 CYS H A 42 GLN HG2 1.0 . 5.50 404 382 A 41 CYS H A 42 GLN HG3 1.0 . 5.50 405 383 A 9 LEU HD1% A 9 LEU HA 1.0 . 3.58 406 384 A 9 LEU HD2% A 9 LEU HA 1.0 . 4.19 407 385 A 9 LEU HD1% A 9 LEU HB2 1.0 . 3.35 408 386 A 9 LEU HD2% A 9 LEU HB2 1.0 . 3.52 409 387 A 9 LEU HD1% A 9 LEU HB3 1.0 . 3.70 410 388 A 9 LEU HD2% A 9 LEU HB3 1.0 . 3.55 411 389 A 10 ARG HA A 10 ARG HG2 1.0 . 3.07 412 389 A 10 ARG HA A 10 ARG HG3 1.0 . 3.07 413 390 A 11 ARG HA A 11 ARG HG3 1.0 . 3.39 414 391 A 11 ARG HA A 11 ARG HG2 1.0 . 3.96 415 392 A 11 ARG HA A 11 ARG HDx 1.0 . 4.73 416 393 A 5 CYS HA A 11 ARG HG2 1.0 . 3.98 417 394 A 11 ARG HA A 11 ARG HDy 1.0 . 4.73 418 395 A 13 ILE HG2% A 13 ILE HA 1.0 . 3.28 419 396 A 13 ILE HG13 A 13 ILE HA 1.0 . 3.63 420 397 A 13 ILE HG12 A 13 ILE HA 1.0 . 3.43 421 398 A 13 ILE HD1% A 13 ILE HA 1.0 . 4.08 422 399 A 13 ILE HB A 13 ILE HD1% 1.0 . 3.31 423 400 A 13 ILE HG2% A 13 ILE HG13 1.0 . 3.35 424 401 A 13 ILE HG2% A 13 ILE HD1% 1.0 . 2.46 425 402 A 13 ILE HG2% A 13 ILE HG12 1.0 . 3.50 426 403 A 17 GLN HA A 17 GLN HGy 1.0 . 3.54 427 404 A 17 GLN HA A 17 GLN HGx 1.0 . 3.54 428 405 A 19 ARG HA A 19 ARG HGy 1.0 . 3.81 429 406 A 18 CYS HB2 A 19 ARG HA 1.0 . 5.24 430 407 A 21 LYS HA A 21 LYS HGy 1.0 . 3.92 431 408 A 21 LYS HA A 21 LYS HD2 1.0 . 4.14 432 408 A 21 LYS HA A 21 LYS HD3 1.0 . 4.14 433 409 A 21 LYS HA A 21 LYS HGx 1.0 . 3.92 434 410 A 21 LYS HB3 A 21 LYS HD2 1.0 . 3.89 435 410 A 21 LYS HB3 A 21 LYS HD3 1.0 . 3.89 436 411 A 22 VAL HA A 22 VAL HG1% 1.0 . 3.36 437 412 A 22 VAL HA A 22 VAL HG2% 1.0 . 3.49 438 413 A 23 LYS HA A 23 LYS HGy 1.0 . 3.93 439 414 A 23 LYS HA A 23 LYS HGx 1.0 . 3.93 440 415 A 23 LYS HA A 23 LYS HDy 1.0 . 4.65 441 416 A 23 LYS HA A 23 LYS HDx 1.0 . 4.65 442 417 A 23 LYS HB3 A 23 LYS HDx 1.0 . 3.97 443 417 A 23 LYS HDx A 23 LYS HB2 1.0 . 3.97 444 418 A 23 LYS HB2 A 23 LYS HDy 1.0 . 3.97 445 418 A 23 LYS HB3 A 23 LYS HDy 1.0 . 3.97 446 419 A 24 THR HG2% A 24 THR HA 1.0 . 3.16 447 420 A 19 ARG HA A 27 TYR HB3 1.0 . 4.05 448 421 A 30 GLU HA A 30 GLU HGy 1.0 . 4.15 449 422 A 30 GLU HA A 30 GLU HGx 1.0 . 4.15 450 423 A 33 THR HG2% A 33 THR HA 1.0 . 3.37 451 424 A 37 THR HG2% A 37 THR HA 1.0 . 3.59 452 425 A 39 LYS HA A 39 LYS HB2 1.0 . 2.92 453 425 A 39 LYS HB3 A 39 LYS HA 1.0 . 2.92 454 426 A 39 LYS HA A 39 LYS HGy 1.0 . 3.88 455 427 A 39 LYS HA A 39 LYS HGx 1.0 . 3.88 456 428 A 40 LYS HA A 40 LYS HG2 1.0 . 3.41 457 428 A 40 LYS HG3 A 40 LYS HA 1.0 . 3.41 458 429 A 40 LYS HB2 A 40 LYS HD2 1.0 . 3.65 459 429 A 40 LYS HD3 A 40 LYS HB2 1.0 . 3.65 460 430 A 40 LYS HB3 A 40 LYS HD2 1.0 . 3.84 461 430 A 40 LYS HD3 A 40 LYS HB3 1.0 . 3.84 462 431 A 42 GLN HA A 42 GLN HG2 1.0 . 3.42 463 431 A 42 GLN HG3 A 42 GLN HA 1.0 . 3.42 464 432 A 44 LEU HD2% A 44 LEU HA 1.0 . 3.39 465 433 A 44 LEU HD1% A 44 LEU HA 1.0 . 3.97 466 434 A 44 LEU HB3 A 44 LEU HD2% 1.0 . 4.18 467 435 A 44 LEU HB2 A 44 LEU HD2% 1.0 . 3.71 468 436 A 44 LEU HB3 A 44 LEU HD1% 1.0 . 4.13 469 437 A 44 LEU HB2 A 44 LEU HD1% 1.0 . 3.58 470 438 A 45 LEU HD2% A 45 LEU HA 1.0 . 2.96 471 439 A 45 LEU HD1% A 45 LEU HB3 1.0 . 3.62 472 440 A 45 LEU HD1% A 45 LEU HB2 1.0 . 3.56 473 441 A 45 LEU HD1% A 45 LEU HA 1.0 . 4.14 474 442 A 45 LEU HD2% A 45 LEU HB3 1.0 . 3.78 475 443 A 45 LEU HD2% A 45 LEU HB2 1.0 . 3.45 476 444 A 33 THR HG2% A 3 ASN HA 1.0 . 3.28 477 445 A 4 LYS HB3 A 4 LYS HDy 1.0 . 3.76 478 446 A 4 LYS HA A 4 LYS HGy 1.0 . 4.17 479 447 A 4 LYS HB3 A 4 LYS HDx 1.0 . 3.76 480 448 A 4 LYS HA A 4 LYS HDx 1.0 . 4.62 481 449 A 4 LYS HA A 4 LYS HDy 1.0 . 4.62 482 450 A 4 LYS HB2 A 4 LYS HEx 1.0 . 4.80 483 451 A 4 LYS HB2 A 4 LYS HEy 1.0 . 4.80 484 452 A 4 LYS HA A 4 LYS HGx 1.0 . 4.17 485 453 A 5 CYS HA A 12 GLU HB2 1.0 . 4.25 486 454 A 5 CYS HA A 11 ARG HG3 1.0 . 4.28 487 455 A 6 GLU HA A 6 GLU HG2 1.0 . 3.56 488 455 A 6 GLU HG3 A 6 GLU HA 1.0 . 3.56 489 456 A 7 ASN H A 6 GLU HG2 1.0 . 4.80 490 456 A 6 GLU HG3 A 7 ASN H 1.0 . 4.80 491 457 A 11 ARG HBy A 8 SER HBy 1.0 . 4.84 492 458 A 8 SER HBy A 11 ARG HBx 1.0 . 4.84 493 459 A 11 ARG HBy A 8 SER HBx 1.0 . 4.84 494 460 A 8 SER HBx A 11 ARG HBx 1.0 . 4.84 495 461 A 12 GLU HB3 A 9 LEU HA 1.0 . 3.16 496 462 A 9 LEU H A 9 LEU HB2 1.0 . 3.69 497 463 A 10 ARG H A 10 ARG HB2 1.0 . 3.70 498 464 A 10 ARG H A 10 ARG HG2 1.0 . 4.53 499 464 A 10 ARG H A 10 ARG HG3 1.0 . 4.53 500 465 A 10 ARG HA A 13 ILE HD1% 1.0 . 3.82 501 466 A 10 ARG HA A 10 ARG HD2 1.0 . 4.73 502 466 A 10 ARG HD3 A 10 ARG HA 1.0 . 4.73 503 467 A 11 ARG HA A 38 PHE HE% 1.0 . 3.70 504 468 A 11 ARG HG2 A 38 PHE HE% 1.0 . 5.28 505 469 A 38 PHE HZ A 11 ARG HDy 1.0 . 4.32 506 470 A 38 PHE HZ A 11 ARG HDx 1.0 . 4.32 507 471 A 12 GLU HB2 A 12 GLU HG2 1.0 . 2.65 508 471 A 12 GLU HB2 A 12 GLU HG3 1.0 . 2.65 509 472 A 13 ILE H A 12 GLU HB2 1.0 . 4.39 510 473 A 13 ILE HB A 10 ARG HA 1.0 . 3.75 511 474 A 13 ILE HG2% A 10 ARG HG2 1.0 . 5.17 512 474 A 13 ILE HG2% A 10 ARG HG3 1.0 . 5.17 513 475 A 13 ILE HB A 10 ARG HG2 1.0 . 4.32 514 475 A 13 ILE HB A 10 ARG HG3 1.0 . 4.32 515 476 A 17 GLN H A 13 ILE HG2% 1.0 . 5.17 516 477 A 14 ALA HB% A 45 LEU HD1% 1.0 . 3.46 517 478 A 17 GLN HB2 A 14 ALA HA 1.0 . 4.41 518 479 A 11 ARG HA A 14 ALA HB% 1.0 . 3.88 519 480 A 14 ALA HB% A 38 PHE HE% 1.0 . 3.54 520 481 A 15 CYS H A 14 ALA HB% 1.0 . 4.01 521 482 A 18 CYS HB2 A 15 CYS HA 1.0 . 3.51 522 483 A 18 CYS HB3 A 15 CYS HA 1.0 . 4.54 523 484 A 38 PHE HE% A 15 CYS HA 1.0 . 4.91 524 485 A 19 ARG H A 15 CYS HA 1.0 . 4.53 525 486 A 32 CYS H A 31 CYS HBy 1.0 . 4.37 526 487 A 16 GLY HA2 A 19 ARG HB3 1.0 . 3.98 527 488 A 16 GLY HA2 A 19 ARG HB2 1.0 . 4.40 528 489 A 17 GLN HA A 20 ASP HB2 1.0 . 3.73 529 489 A 20 ASP HB3 A 17 GLN HA 1.0 . 3.73 530 490 A 13 ILE HG2% A 17 GLN HGx 1.0 . 4.44 531 491 A 13 ILE HG2% A 17 GLN HGy 1.0 . 4.44 532 492 A 22 VAL H A 18 CYS HA 1.0 . 4.38 533 493 A 45 LEU HD2% A 18 CYS HA 1.0 . 3.94 534 494 A 22 VAL HG2% A 18 CYS HA 1.0 . 4.74 535 495 A 18 CYS HA A 21 LYS HGy 1.0 . 4.62 536 496 A 18 CYS HA A 21 LYS HB2 1.0 . 3.42 537 497 A 19 ARG HA A 19 ARG HGx 1.0 . 3.81 538 498 A 19 ARG HA A 22 VAL HB 1.0 . 4.22 539 499 A 19 ARG HA A 22 VAL HG2% 1.0 . 4.32 540 500 A 21 LYS HA A 20 ASP HB2 1.0 . 4.21 541 500 A 20 ASP HB3 A 21 LYS HA 1.0 . 4.21 542 501 A 27 TYR HE% A 22 VAL HG2% 1.0 . 4.21 543 502 A 22 VAL HA A 21 LYS H 1.0 . 5.50 544 503 A 24 THR H A 22 VAL HA 1.0 . 5.50 545 504 A 22 VAL HG2% A 44 LEU HG 1.0 . 4.42 546 505 A 24 THR HG2% A 22 VAL HG1% 1.0 . 4.15 547 506 A 24 THR HB A 25 ASP H 1.0 . 4.43 548 507 A 25 ASP H A 25 ASP HA 1.0 . 2.91 549 508 A 28 PHE HD% A 28 PHE HA 1.0 . 3.71 550 509 A 27 TYR HD% A 28 PHE HA 1.0 . 4.01 551 510 A 19 ARG HB2 A 28 PHE HB2 1.0 . 3.69 552 510 A 28 PHE HB3 A 19 ARG HB2 1.0 . 3.69 553 511 A 27 TYR HB3 A 28 PHE HA 1.0 . 4.37 554 512 A 28 PHE HD% A 29 TYR HA 1.0 . 3.76 555 513 A 29 TYR H A 29 TYR HBy 1.0 . 3.64 556 514 A 37 THR HG2% A 30 GLU HBy 1.0 . 4.63 557 515 A 17 GLN HB3 A 45 LEU HD1% 1.0 . 4.38 558 516 A 17 GLN HB3 A 45 LEU HD2% 1.0 . 4.44 559 517 A 37 THR HG2% A 30 GLU HBx 1.0 . 4.63 560 518 A 37 THR HB A 30 GLU HGx 1.0 . 5.50 561 519 A 37 THR HB A 31 CYS HA 1.0 . 3.37 562 520 A 31 CYS HA A 32 CYS HA 1.0 . 4.91 563 521 A 37 THR HG2% A 31 CYS HA 1.0 . 3.09 564 522 A 11 ARG HG3 A 32 CYS HA 1.0 . 4.44 565 523 A 32 CYS HB3 A 33 THR HG2% 1.0 . 4.23 566 524 A 32 CYS HB2 A 33 THR HG2% 1.0 . 4.16 567 525 A 1 ALA HB% A 33 THR HG2% 1.0 . 4.54 568 526 A 33 THR HB A 1 ALA HB% 1.0 . 4.60 569 527 A 36 SER HA A 39 LYS HD2 1.0 . 4.30 570 527 A 36 SER HA A 39 LYS HD3 1.0 . 4.30 571 528 A 40 LYS HB2 A 37 THR HA 1.0 . 3.92 572 529 A 37 THR HG2% A 30 GLU HGy 1.0 . 4.55 573 530 A 36 SER HA A 39 LYS HB2 1.0 . 3.95 574 530 A 39 LYS HB3 A 36 SER HA 1.0 . 3.95 575 531 A 9 LEU HG A 10 ARG HD2 1.0 . 4.84 576 531 A 9 LEU HG A 10 ARG HD3 1.0 . 4.84 577 532 A 9 LEU HG A 10 ARG HA 1.0 . 4.30 578 533 A 17 GLN HB2 A 45 LEU HD2% 1.0 . 3.99 579 534 A 40 LYS HD2 A 40 LYS HG2 1.0 . 2.62 580 534 A 40 LYS HD3 A 40 LYS HG2 1.0 . 2.62 581 534 A 40 LYS HG3 A 40 LYS HD2 1.0 . 2.62 582 534 A 40 LYS HD3 A 40 LYS HG3 1.0 . 2.62 583 535 A 21 LYS H A 21 LYS HGx 1.0 . 4.84 584 536 A 21 LYS H A 21 LYS HGy 1.0 . 4.84 585 537 A 40 LYS HA A 40 LYS HD2 1.0 . 3.58 586 537 A 40 LYS HD3 A 40 LYS HA 1.0 . 3.58 587 538 A 9 LEU HG A 10 ARG HG2 1.0 . 3.04 588 538 A 9 LEU HG A 10 ARG HG3 1.0 . 3.04 589 539 A 13 ILE HB A 9 LEU HD1% 1.0 . 4.30 590 540 A 9 LEU HD1% A 10 ARG HA 1.0 . 4.72 591 541 A 8 SER H A 11 ARG HG2 1.0 . 5.50 592 542 A 12 GLU HA A 12 GLU HG2 1.0 . 3.76 593 542 A 12 GLU HA A 12 GLU HG3 1.0 . 3.76 594 543 A 32 CYS HB3 A 11 ARG HG2 1.0 . 5.48 595 544 A 32 CYS HB3 A 11 ARG HG3 1.0 . 5.50 596 545 A 13 ILE HB A 12 GLU HB3 1.0 . 4.99 597 546 A 13 ILE HG2% A 14 ALA HA 1.0 . 4.89 598 547 A 10 ARG HA A 13 ILE HG13 1.0 . 4.76 599 548 A 19 ARG H A 16 GLY HA2 1.0 . 5.03 600 549 A 16 GLY HA3 A 19 ARG H 1.0 . 4.75 601 550 A 28 PHE HE% A 16 GLY HA2 1.0 . 4.42 602 551 A 28 PHE HE% A 15 CYS HBx 1.0 . 4.68 603 552 A 28 PHE HD% A 15 CYS HBy 1.0 . 4.36 604 553 A 28 PHE HE% A 15 CYS HBy 1.0 . 4.68 605 554 A 17 GLN HB2 A 45 LEU HD1% 1.0 . 4.21 606 555 A 28 PHE HD% A 19 ARG HB2 1.0 . 4.92 607 556 A 18 CYS HA A 21 LYS HGx 1.0 . 4.62 608 557 A 18 CYS HB2 A 28 PHE HA 1.0 . 5.50 609 558 A 19 ARG HA A 28 PHE HB2 1.0 . 4.52 610 558 A 19 ARG HA A 28 PHE HB3 1.0 . 4.52 611 559 A 19 ARG HA A 27 TYR HB2 1.0 . 4.78 612 560 A 28 PHE HB3 A 19 ARG HGy 1.0 . 4.57 613 560 A 19 ARG HGy A 28 PHE HB2 1.0 . 4.57 614 561 A 19 ARG HA A 22 VAL HG1% 1.0 . 4.79 615 562 A 18 CYS HA A 21 LYS HB3 1.0 . 4.58 616 563 A 21 LYS HB2 A 44 LEU HD1% 1.0 . 4.78 617 564 A 22 VAL HG2% A 21 LYS HB2 1.0 . 5.24 618 565 A 21 LYS HB3 A 44 LEU HB3 1.0 . 4.91 619 566 A 24 THR H A 22 VAL HB 1.0 . 4.73 620 567 A 22 VAL HB A 27 TYR HD% 1.0 . 4.61 621 568 A 24 THR HB A 22 VAL HG1% 1.0 . 4.64 622 569 A 41 CYS HB2 A 22 VAL HG1% 1.0 . 5.50 623 570 A 18 CYS HB2 A 22 VAL HG2% 1.0 . 5.02 624 571 A 23 LYS HA A 22 VAL HG1% 1.0 . 4.87 625 572 A 27 TYR H A 28 PHE HA 1.0 . 5.40 626 573 A 31 CYS H A 27 TYR HA 1.0 . 4.68 627 574 A 27 TYR HD% A 28 PHE HB2 1.0 . 5.06 628 574 A 28 PHE HB3 A 27 TYR HD% 1.0 . 5.06 629 575 A 33 THR H A 29 TYR HA 1.0 . 5.20 630 576 A 27 TYR HB2 A 28 PHE HB2 1.0 . 5.50 631 576 A 28 PHE HB3 A 27 TYR HB2 1.0 . 5.50 632 577 A 22 VAL HG1% A 27 TYR HB2 1.0 . 4.40 633 578 A 27 TYR HB3 A 19 ARG HB2 1.0 . 5.23 634 579 A 19 ARG HB2 A 28 PHE HA 1.0 . 4.68 635 580 A 28 PHE HB3 A 19 ARG HGx 1.0 . 4.57 636 580 A 19 ARG HGx A 28 PHE HB2 1.0 . 4.57 637 581 A 32 CYS HB2 A 29 TYR HA 1.0 . 3.51 638 582 A 33 THR HG2% A 29 TYR HA 1.0 . 4.68 639 583 A 29 TYR HD% A 30 GLU HA 1.0 . 4.90 640 584 A 37 THR HB A 30 GLU HGy 1.0 . 5.50 641 585 A 30 GLU H A 30 GLU HGy 1.0 . 4.81 642 586 A 32 CYS HB3 A 29 TYR HA 1.0 . 4.43 643 587 A 37 THR HG2% A 30 GLU HGx 1.0 . 4.55 644 588 A 4 LYS HB2 A 32 CYS HA 1.0 . 4.57 645 589 A 11 ARG HG2 A 32 CYS HA 1.0 . 5.12 646 590 A 33 THR HG2% A 30 GLU HA 1.0 . 4.93 647 591 A 40 LYS H A 39 LYS HB2 1.0 . 3.84 648 591 A 39 LYS HB3 A 40 LYS H 1.0 . 3.84 649 592 A 40 LYS H A 40 LYS HB3 1.0 . 3.66 650 593 A 43 ASP HB3 A 40 LYS HA 1.0 . 3.92 651 594 A 43 ASP HB2 A 44 LEU H 1.0 . 4.16 652 595 A 44 LEU HB3 A 41 CYS HA 1.0 . 4.78 653 596 A 44 LEU HB2 A 41 CYS HA 1.0 . 4.82 654 597 A 44 LEU HG A 41 CYS HA 1.0 . 4.44 655 598 A 44 LEU HG A 44 LEU H 1.0 . 4.04 656 599 A 42 GLN HA A 45 LEU HB3 1.0 . 5.24 657 600 A 45 LEU HB2 A 42 GLN HA 1.0 . 4.73 658 601 A 43 ASP HB2 A 40 LYS HA 1.0 . 3.96 659 602 A 43 ASP HB2 A 42 GLN HB2 1.0 . 4.77 660 603 A 43 ASP HA A 46 HIS HBy 1.0 . 4.60 661 604 A 43 ASP HA A 46 HIS HBx 1.0 . 4.60 662 605 A 45 LEU HG A 45 LEU HA 1.0 . 3.62 663 606 A 45 LEU HD1% A 42 GLN HA 1.0 . 4.68 664 607 A 17 GLN H A 45 LEU HD2% 1.0 . 4.94 665 608 A 39 LYS HA A 42 GLN HG2 1.0 . 5.50 666 608 A 42 GLN HG3 A 39 LYS HA 1.0 . 5.50 667 609 A 44 LEU HD1% A 21 LYS HD2 1.0 . 5.50 668 609 A 44 LEU HD1% A 21 LYS HD3 1.0 . 5.50 669 610 A 22 VAL HG2% A 44 LEU HD2% 1.0 . 4.63 670 611 A 43 ASP HB2 A 42 GLN HB3 1.0 . 5.10 671 612 A 12 GLU H A 13 ILE HG13 1.0 . 5.02 672 613 A 38 PHE HE% A 42 GLN HG2 1.0 . 4.41 673 613 A 38 PHE HE% A 42 GLN HG3 1.0 . 4.41 674 614 A 10 ARG H A 9 LEU HB3 1.0 . 5.50 675 615 A 10 ARG H A 9 LEU HB2 1.0 . 5.50 676 616 A 9 LEU HA A 12 GLU HB2 1.0 . 5.20 677 617 A 12 GLU HA A 13 ILE HA 1.0 . 5.50 678 618 A 13 ILE HA A 14 ALA HA 1.0 . 5.50 679 619 A 13 ILE HA A 12 GLU HB2 1.0 . 5.50 680 620 A 22 VAL HB A 23 LYS HB2 1.0 . 5.50 681 620 A 23 LYS HB3 A 22 VAL HB 1.0 . 5.50 682 621 A 24 THR HG2% A 25 ASP HBy 1.0 . 5.50 683 622 A 24 THR HG2% A 25 ASP HBx 1.0 . 5.50 684 623 A 19 ARG HB3 A 28 PHE HA 1.0 . 5.50 685 624 A 32 CYS HB2 A 28 PHE HA 1.0 . 5.50 686 625 A 37 THR HG2% A 40 LYS HD2 1.0 . 5.50 687 625 A 37 THR HG2% A 40 LYS HD3 1.0 . 5.50 688 626 A 44 LEU H A 42 GLN HA 1.0 . 5.50 689 627 A 22 VAL HG2% A 44 LEU HD1% 1.0 . 5.50 690 628 A 39 LYS HB3 A 40 LYS HG2 1.0 . 5.35 691 628 A 39 LYS HB2 A 40 LYS HG2 1.0 . 5.35 692 628 A 40 LYS HG3 A 39 LYS HB2 1.0 . 5.35 693 628 A 39 LYS HB3 A 40 LYS HG3 1.0 . 5.35 694 629 A 41 CYS HA A 44 LEU HD2% 1.0 . 5.50 695 630 A 21 LYS HB2 A 21 LYS HE2 1.0 . 5.50 696 630 A 21 LYS HB2 A 21 LYS HE3 1.0 . 5.50 697 631 A 9 LEU HG A 10 ARG HB2 1.0 . 3.88 698 632 A 9 LEU HG A 10 ARG HB3 1.0 . 4.99 699 633 A 28 PHE HD% A 16 GLY HA2 1.0 . 4.06 700 634 A 28 PHE HD% A 15 CYS HBx 1.0 . 4.36 701 635 A 33 THR HG2% A 29 TYR HE% 1.0 . 4.01 702 636 A 28 PHE HZ A 12 GLU HG2 1.0 . 3.46 703 636 A 12 GLU HG3 A 28 PHE HZ 1.0 . 3.46 704 637 A 19 ARG HA A 27 TYR HD% 1.0 . 3.21 705 638 A 27 TYR HD% A 27 TYR HA 1.0 . 3.60 706 639 A 19 ARG HB3 A 27 TYR HD% 1.0 . 4.81 707 640 A 19 ARG HB2 A 27 TYR HD% 1.0 . 3.46 708 641 A 27 TYR HD% A 22 VAL HG1% 1.0 . 3.68 709 642 A 22 VAL HG2% A 27 TYR HD% 1.0 . 4.02 710 643 A 15 CYS HA A 27 TYR HE% 1.0 . 4.16 711 644 A 18 CYS HB3 A 27 TYR HE% 1.0 . 3.25 712 645 A 19 ARG HA A 27 TYR HE% 1.0 . 4.50 713 646 A 18 CYS HB2 A 27 TYR HE% 1.0 . 3.54 714 647 A 27 TYR HE% A 31 CYS HBx 1.0 . 4.77 715 648 A 37 THR HG2% A 27 TYR HE% 1.0 . 3.57 716 649 A 27 TYR HE% A 22 VAL HG1% 1.0 . 4.26 717 650 A 29 TYR HD% A 29 TYR HA 1.0 . 3.73 718 651 A 33 THR HG2% A 29 TYR HD% 1.0 . 4.37 719 652 A 11 ARG HA A 38 PHE HZ 1.0 . 3.91 720 653 A 14 ALA HB% A 38 PHE HZ 1.0 . 3.63 721 654 A 38 PHE HD% A 38 PHE HA 1.0 . 4.59 722 655 A 38 PHE HD% A 42 GLN HG2 1.0 . 4.42 723 655 A 38 PHE HD% A 42 GLN HG3 1.0 . 4.42 724 656 A 27 TYR HE% A 31 CYS HBy 1.0 . 4.77 725 657 A 41 CYS HB2 A 27 TYR HD% 1.0 . 5.28 726 658 A 2 ASP H A 2 ASP HBx 1.0 . 3.39 727 658 A 2 ASP H A 2 ASP HBy 1.0 . 3.39 728 659 A 2 ASP HA A 3 ASN HBy 1.0 . 4.31 729 659 A 2 ASP HA A 3 ASN HBx 1.0 . 4.31 730 660 A 3 ASN H A 2 ASP HBx 1.0 . 3.73 731 660 A 3 ASN H A 2 ASP HBy 1.0 . 3.73 732 661 A 4 LYS H A 2 ASP HBx 1.0 . 4.99 733 661 A 4 LYS H A 2 ASP HBy 1.0 . 4.99 734 662 A 3 ASN H A 3 ASN HBy 1.0 . 2.84 735 662 A 3 ASN H A 3 ASN HBx 1.0 . 2.84 736 663 A 3 ASN H A 4 LYS HGx 1.0 . 5.34 737 663 A 3 ASN H A 4 LYS HGy 1.0 . 5.34 738 664 A 3 ASN HA A 4 LYS HGx 1.0 . 4.39 739 664 A 3 ASN HA A 4 LYS HGy 1.0 . 4.39 740 665 A 4 LYS H A 3 ASN HBy 1.0 . 3.99 741 665 A 4 LYS H A 3 ASN HBx 1.0 . 3.99 742 666 A 5 CYS H A 3 ASN HBy 1.0 . 4.87 743 666 A 5 CYS H A 3 ASN HBx 1.0 . 4.87 744 667 A 6 GLU H A 3 ASN HBy 1.0 . 4.90 745 667 A 6 GLU H A 3 ASN HBx 1.0 . 4.90 746 668 A 3 ASN HBy A 6 GLU HG2 1.0 . 4.45 747 668 A 3 ASN HBx A 6 GLU HG2 1.0 . 4.45 748 668 A 6 GLU HG3 A 3 ASN HBy 1.0 . 4.45 749 668 A 6 GLU HG3 A 3 ASN HBx 1.0 . 4.45 750 669 A 4 LYS H A 4 LYS HGx 1.0 . 2.89 751 669 A 4 LYS H A 4 LYS HGy 1.0 . 2.89 752 670 A 4 LYS H A 4 LYS HDy 1.0 . 3.68 753 670 A 4 LYS H A 4 LYS HDx 1.0 . 3.68 754 671 A 4 LYS H A 4 LYS HEx 1.0 . 5.34 755 671 A 4 LYS H A 4 LYS HEy 1.0 . 5.34 756 672 A 4 LYS H A 5 CYS HBy 1.0 . 4.93 757 672 A 4 LYS H A 5 CYS HBx 1.0 . 4.93 758 673 A 4 LYS HA A 4 LYS HGx 1.0 . 3.36 759 673 A 4 LYS HA A 4 LYS HGy 1.0 . 3.36 760 674 A 4 LYS HA A 4 LYS HDy 1.0 . 3.95 761 674 A 4 LYS HA A 4 LYS HDx 1.0 . 3.95 762 675 A 4 LYS HB2 A 4 LYS HDy 1.0 . 3.57 763 675 A 4 LYS HB2 A 4 LYS HDx 1.0 . 3.57 764 676 A 4 LYS HB2 A 4 LYS HEx 1.0 . 4.01 765 676 A 4 LYS HB2 A 4 LYS HEy 1.0 . 4.01 766 677 A 4 LYS HB2 A 11 ARG HDx 1.0 . 5.17 767 677 A 4 LYS HB2 A 11 ARG HDy 1.0 . 5.17 768 678 A 4 LYS HB3 A 4 LYS HEx 1.0 . 4.15 769 678 A 4 LYS HB3 A 4 LYS HEy 1.0 . 4.15 770 679 A 4 LYS HDx A 4 LYS HGx 1.0 . 2.26 771 679 A 4 LYS HDy A 4 LYS HGx 1.0 . 2.26 772 679 A 4 LYS HGy A 4 LYS HDy 1.0 . 2.26 773 679 A 4 LYS HGy A 4 LYS HDx 1.0 . 2.26 774 680 A 4 LYS HEy A 4 LYS HGx 1.0 . 3.32 775 680 A 4 LYS HEx A 4 LYS HGx 1.0 . 3.32 776 680 A 4 LYS HGy A 4 LYS HEx 1.0 . 3.32 777 680 A 4 LYS HGy A 4 LYS HEy 1.0 . 3.32 778 681 A 33 THR HA A 4 LYS HGx 1.0 . 5.34 779 681 A 33 THR HA A 4 LYS HGy 1.0 . 5.34 780 682 A 33 THR HG2% A 4 LYS HGx 1.0 . 5.05 781 682 A 33 THR HG2% A 4 LYS HGy 1.0 . 5.05 782 683 A 5 CYS H A 5 CYS HBy 1.0 . 3.01 783 683 A 5 CYS H A 5 CYS HBx 1.0 . 3.01 784 684 A 5 CYS HA A 6 GLU HBx 1.0 . 5.34 785 684 A 5 CYS HA A 6 GLU HBy 1.0 . 5.34 786 685 A 5 CYS HA A 11 ARG HBx 1.0 . 3.45 787 685 A 5 CYS HA A 11 ARG HBy 1.0 . 3.45 788 686 A 6 GLU H A 5 CYS HBy 1.0 . 3.80 789 686 A 6 GLU H A 5 CYS HBx 1.0 . 3.80 790 687 A 12 GLU H A 5 CYS HBy 1.0 . 4.88 791 687 A 12 GLU H A 5 CYS HBx 1.0 . 4.88 792 688 A 12 GLU HA A 5 CYS HBy 1.0 . 3.74 793 688 A 12 GLU HA A 5 CYS HBx 1.0 . 3.74 794 689 A 12 GLU HB2 A 5 CYS HBy 1.0 . 3.45 795 689 A 12 GLU HB2 A 5 CYS HBx 1.0 . 3.45 796 690 A 12 GLU HB3 A 5 CYS HBy 1.0 . 4.31 797 690 A 12 GLU HB3 A 5 CYS HBx 1.0 . 4.31 798 691 A 6 GLU H A 6 GLU HBx 1.0 . 2.81 799 691 A 6 GLU H A 6 GLU HBy 1.0 . 2.81 800 692 A 7 ASN H A 6 GLU HBx 1.0 . 3.52 801 692 A 7 ASN H A 6 GLU HBy 1.0 . 3.52 802 693 A 7 ASN H A 7 ASN HBy 1.0 . 3.33 803 693 A 7 ASN H A 7 ASN HBx 1.0 . 3.33 804 694 A 7 ASN H A 8 SER HBy 1.0 . 4.34 805 694 A 7 ASN H A 8 SER HBx 1.0 . 4.34 806 695 A 8 SER H A 7 ASN HBy 1.0 . 4.06 807 695 A 8 SER H A 7 ASN HBx 1.0 . 4.06 808 696 A 8 SER H A 8 SER HBy 1.0 . 3.08 809 696 A 8 SER H A 8 SER HBx 1.0 . 3.08 810 697 A 8 SER H A 11 ARG HBx 1.0 . 4.39 811 697 A 8 SER H A 11 ARG HBy 1.0 . 4.39 812 698 A 9 LEU H A 8 SER HBy 1.0 . 4.39 813 698 A 9 LEU H A 8 SER HBx 1.0 . 4.39 814 699 A 11 ARG H A 8 SER HBy 1.0 . 4.23 815 699 A 11 ARG H A 8 SER HBx 1.0 . 4.23 816 700 A 8 SER HBx A 11 ARG HBx 1.0 . 3.46 817 700 A 8 SER HBy A 11 ARG HBx 1.0 . 3.46 818 700 A 11 ARG HBy A 8 SER HBy 1.0 . 3.46 819 700 A 11 ARG HBy A 8 SER HBx 1.0 . 3.46 820 701 A 11 ARG H A 11 ARG HBx 1.0 . 2.93 821 701 A 11 ARG H A 11 ARG HBy 1.0 . 2.93 822 702 A 11 ARG HA A 11 ARG HDx 1.0 . 3.94 823 702 A 11 ARG HA A 11 ARG HDy 1.0 . 3.94 824 703 A 11 ARG HBx A 11 ARG HDx 1.0 . 3.28 825 703 A 11 ARG HBy A 11 ARG HDx 1.0 . 3.28 826 703 A 11 ARG HDy A 11 ARG HBx 1.0 . 3.28 827 703 A 11 ARG HDy A 11 ARG HBy 1.0 . 3.28 828 704 A 12 GLU H A 11 ARG HBx 1.0 . 3.14 829 704 A 12 GLU H A 11 ARG HBy 1.0 . 3.14 830 705 A 32 CYS HA A 11 ARG HBx 1.0 . 5.14 831 705 A 32 CYS HA A 11 ARG HBy 1.0 . 5.14 832 706 A 14 ALA HB% A 11 ARG HDx 1.0 . 5.34 833 706 A 14 ALA HB% A 11 ARG HDy 1.0 . 5.34 834 707 A 32 CYS HA A 11 ARG HDx 1.0 . 4.99 835 707 A 32 CYS HA A 11 ARG HDy 1.0 . 4.99 836 708 A 38 PHE HZ A 11 ARG HDx 1.0 . 3.79 837 708 A 38 PHE HZ A 11 ARG HDy 1.0 . 3.79 838 709 A 12 GLU HA A 15 CYS HBy 1.0 . 4.28 839 709 A 12 GLU HA A 15 CYS HBx 1.0 . 4.28 840 710 A 13 ILE HA A 17 GLN HGx 1.0 . 5.34 841 710 A 13 ILE HA A 17 GLN HGy 1.0 . 5.34 842 711 A 13 ILE HG2% A 17 GLN HGx 1.0 . 3.83 843 711 A 13 ILE HG2% A 17 GLN HGy 1.0 . 3.83 844 712 A 13 ILE HG2% A 17 GLN HE2y 1.0 . 3.73 845 712 A 13 ILE HG2% A 17 GLN HE2x 1.0 . 3.73 846 713 A 15 CYS H A 15 CYS HBy 1.0 . 3.33 847 713 A 15 CYS H A 15 CYS HBx 1.0 . 3.33 848 714 A 16 GLY H A 15 CYS HBy 1.0 . 3.57 849 714 A 16 GLY H A 15 CYS HBx 1.0 . 3.57 850 715 A 16 GLY HA2 A 15 CYS HBy 1.0 . 4.22 851 715 A 16 GLY HA2 A 15 CYS HBx 1.0 . 4.22 852 716 A 28 PHE HA A 15 CYS HBy 1.0 . 3.64 853 716 A 28 PHE HA A 15 CYS HBx 1.0 . 3.64 854 717 A 28 PHE HE% A 15 CYS HBy 1.0 . 4.04 855 717 A 28 PHE HE% A 15 CYS HBx 1.0 . 4.04 856 718 A 16 GLY H A 19 ARG HDy 1.0 . 5.34 857 718 A 16 GLY H A 19 ARG HDx 1.0 . 5.34 858 719 A 17 GLN H A 17 GLN HGx 1.0 . 2.74 859 719 A 17 GLN H A 17 GLN HGy 1.0 . 2.74 860 720 A 17 GLN HA A 17 GLN HGx 1.0 . 3.04 861 720 A 17 GLN HA A 17 GLN HGy 1.0 . 3.04 862 721 A 18 CYS HA A 21 LYS HGx 1.0 . 3.85 863 721 A 18 CYS HA A 21 LYS HGy 1.0 . 3.85 864 722 A 19 ARG H A 19 ARG HGy 1.0 . 4.48 865 722 A 19 ARG H A 19 ARG HGx 1.0 . 4.48 866 723 A 19 ARG H A 19 ARG HDy 1.0 . 4.56 867 723 A 19 ARG H A 19 ARG HDx 1.0 . 4.56 868 724 A 19 ARG HA A 19 ARG HDy 1.0 . 4.50 869 724 A 19 ARG HA A 19 ARG HDx 1.0 . 4.50 870 725 A 19 ARG HB2 A 19 ARG HDy 1.0 . 3.60 871 725 A 19 ARG HB2 A 19 ARG HDx 1.0 . 3.60 872 726 A 20 ASP H A 19 ARG HGy 1.0 . 4.64 873 726 A 20 ASP H A 19 ARG HGx 1.0 . 4.64 874 727 A 20 ASP HA A 19 ARG HGy 1.0 . 5.34 875 727 A 19 ARG HGx A 20 ASP HA 1.0 . 5.34 876 728 A 24 THR H A 19 ARG HGy 1.0 . 4.84 877 728 A 24 THR H A 19 ARG HGx 1.0 . 4.84 878 729 A 27 TYR H A 19 ARG HGy 1.0 . 5.14 879 729 A 27 TYR H A 19 ARG HGx 1.0 . 5.14 880 730 A 27 TYR HB3 A 19 ARG HGy 1.0 . 4.38 881 730 A 27 TYR HB3 A 19 ARG HGx 1.0 . 4.38 882 731 A 19 ARG HGx A 28 PHE HB2 1.0 . 3.84 883 731 A 19 ARG HGy A 28 PHE HB2 1.0 . 3.84 884 731 A 28 PHE HB3 A 19 ARG HGy 1.0 . 3.84 885 731 A 28 PHE HB3 A 19 ARG HGx 1.0 . 3.84 886 732 A 20 ASP H A 19 ARG HDy 1.0 . 5.34 887 732 A 20 ASP H A 19 ARG HDx 1.0 . 5.34 888 733 A 20 ASP H A 21 LYS HGx 1.0 . 4.75 889 733 A 20 ASP H A 21 LYS HGy 1.0 . 4.75 890 734 A 20 ASP HB3 A 21 LYS HGx 1.0 . 4.20 891 734 A 20 ASP HB2 A 21 LYS HGx 1.0 . 4.20 892 734 A 21 LYS HGy A 20 ASP HB2 1.0 . 4.20 893 734 A 20 ASP HB3 A 21 LYS HGy 1.0 . 4.20 894 735 A 21 LYS H A 21 LYS HGx 1.0 . 4.26 895 735 A 21 LYS H A 21 LYS HGy 1.0 . 4.26 896 736 A 21 LYS HA A 21 LYS HGx 1.0 . 3.43 897 736 A 21 LYS HA A 21 LYS HGy 1.0 . 3.43 898 737 A 22 VAL H A 21 LYS HGx 1.0 . 4.39 899 737 A 22 VAL H A 21 LYS HGy 1.0 . 4.39 900 738 A 44 LEU HD1% A 21 LYS HGx 1.0 . 5.34 901 738 A 44 LEU HD1% A 21 LYS HGy 1.0 . 5.34 902 739 A 22 VAL H A 23 LYS HGx 1.0 . 4.83 903 739 A 22 VAL H A 23 LYS HGy 1.0 . 4.83 904 740 A 23 LYS H A 23 LYS HGx 1.0 . 3.31 905 740 A 23 LYS H A 23 LYS HGy 1.0 . 3.31 906 741 A 23 LYS H A 23 LYS HDy 1.0 . 5.18 907 741 A 23 LYS H A 23 LYS HDx 1.0 . 5.18 908 742 A 23 LYS HA A 23 LYS HGx 1.0 . 3.44 909 742 A 23 LYS HA A 23 LYS HGy 1.0 . 3.44 910 743 A 23 LYS HA A 23 LYS HDy 1.0 . 4.08 911 743 A 23 LYS HA A 23 LYS HDx 1.0 . 4.08 912 744 A 23 LYS HB2 A 23 LYS HDy 1.0 . 3.43 913 744 A 23 LYS HB3 A 23 LYS HDy 1.0 . 3.43 914 744 A 23 LYS HDx A 23 LYS HB2 1.0 . 3.43 915 744 A 23 LYS HB3 A 23 LYS HDx 1.0 . 3.43 916 745 A 25 ASP H A 25 ASP HBx 1.0 . 2.78 917 745 A 25 ASP H A 25 ASP HBy 1.0 . 2.78 918 746 A 26 GLY H A 25 ASP HBx 1.0 . 3.52 919 746 A 26 GLY H A 25 ASP HBy 1.0 . 3.52 920 747 A 27 TYR HB3 A 26 GLY HAy 1.0 . 5.34 921 747 A 27 TYR HB3 A 26 GLY HAx 1.0 . 5.34 922 748 A 29 TYR H A 26 GLY HAy 1.0 . 4.36 923 748 A 29 TYR H A 26 GLY HAx 1.0 . 4.36 924 749 A 30 GLU H A 26 GLY HAy 1.0 . 4.65 925 749 A 30 GLU H A 26 GLY HAx 1.0 . 4.65 926 750 A 27 TYR HA A 30 GLU HBx 1.0 . 3.39 927 750 A 27 TYR HA A 30 GLU HBy 1.0 . 3.39 928 751 A 27 TYR HA A 30 GLU HGy 1.0 . 4.92 929 751 A 27 TYR HA A 30 GLU HGx 1.0 . 4.92 930 752 A 27 TYR HE% A 31 CYS HBy 1.0 . 4.05 931 752 A 27 TYR HE% A 31 CYS HBx 1.0 . 4.05 932 753 A 29 TYR H A 29 TYR HBy 1.0 . 2.83 933 753 A 29 TYR H A 29 TYR HBx 1.0 . 2.83 934 754 A 30 GLU H A 29 TYR HBy 1.0 . 3.16 935 754 A 30 GLU H A 29 TYR HBx 1.0 . 3.16 936 755 A 31 CYS H A 29 TYR HBy 1.0 . 5.34 937 755 A 31 CYS H A 29 TYR HBx 1.0 . 5.34 938 756 A 32 CYS H A 29 TYR HBy 1.0 . 5.34 939 756 A 32 CYS H A 29 TYR HBx 1.0 . 5.34 940 757 A 30 GLU H A 30 GLU HGy 1.0 . 4.20 941 757 A 30 GLU H A 30 GLU HGx 1.0 . 4.20 942 758 A 30 GLU HA A 30 GLU HGy 1.0 . 3.48 943 758 A 30 GLU HA A 30 GLU HGx 1.0 . 3.48 944 759 A 31 CYS H A 30 GLU HBx 1.0 . 3.17 945 759 A 31 CYS H A 30 GLU HBy 1.0 . 3.17 946 760 A 37 THR HG2% A 30 GLU HBx 1.0 . 3.94 947 760 A 37 THR HG2% A 30 GLU HBy 1.0 . 3.94 948 761 A 34 SER H A 30 GLU HGy 1.0 . 5.34 949 761 A 34 SER H A 30 GLU HGx 1.0 . 5.34 950 762 A 30 GLU HGx A 34 SER HBy 1.0 . 4.12 951 762 A 30 GLU HGy A 34 SER HBy 1.0 . 4.12 952 762 A 34 SER HBx A 30 GLU HGy 1.0 . 4.12 953 762 A 30 GLU HGx A 34 SER HBx 1.0 . 4.12 954 763 A 37 THR H A 30 GLU HGy 1.0 . 5.34 955 763 A 37 THR H A 30 GLU HGx 1.0 . 5.34 956 764 A 37 THR HB A 30 GLU HGy 1.0 . 4.76 957 764 A 37 THR HB A 30 GLU HGx 1.0 . 4.76 958 765 A 31 CYS H A 31 CYS HBy 1.0 . 3.01 959 765 A 31 CYS H A 31 CYS HBx 1.0 . 3.01 960 766 A 31 CYS H A 34 SER HBy 1.0 . 5.23 961 766 A 31 CYS H A 34 SER HBx 1.0 . 5.23 962 767 A 32 CYS H A 31 CYS HBy 1.0 . 3.80 963 767 A 32 CYS H A 31 CYS HBx 1.0 . 3.80 964 768 A 32 CYS HA A 31 CYS HBy 1.0 . 4.56 965 768 A 32 CYS HA A 31 CYS HBx 1.0 . 4.56 966 769 A 34 SER H A 31 CYS HBy 1.0 . 5.34 967 769 A 34 SER H A 31 CYS HBx 1.0 . 5.34 968 770 A 37 THR HG2% A 31 CYS HBy 1.0 . 4.03 969 770 A 37 THR HG2% A 31 CYS HBx 1.0 . 4.03 970 771 A 38 PHE H A 31 CYS HBy 1.0 . 5.02 971 771 A 38 PHE H A 31 CYS HBx 1.0 . 5.02 972 772 A 33 THR H A 34 SER HBy 1.0 . 4.16 973 772 A 33 THR H A 34 SER HBx 1.0 . 4.16 974 773 A 34 SER H A 34 SER HBy 1.0 . 2.69 975 773 A 34 SER H A 34 SER HBx 1.0 . 2.69 976 774 A 36 SER H A 34 SER HBy 1.0 . 5.34 977 774 A 36 SER H A 34 SER HBx 1.0 . 5.34 978 775 A 37 THR H A 34 SER HBy 1.0 . 4.07 979 775 A 37 THR H A 34 SER HBx 1.0 . 4.07 980 776 A 35 ASP H A 35 ASP HBx 1.0 . 3.05 981 776 A 35 ASP H A 35 ASP HBy 1.0 . 3.05 982 777 A 35 ASP HA A 38 PHE HBx 1.0 . 3.98 983 777 A 35 ASP HA A 38 PHE HBy 1.0 . 3.98 984 778 A 36 SER H A 36 SER HBy 1.0 . 2.90 985 778 A 36 SER H A 36 SER HBx 1.0 . 2.90 986 779 A 37 THR H A 36 SER HBy 1.0 . 3.86 987 779 A 37 THR H A 36 SER HBx 1.0 . 3.86 988 780 A 38 PHE H A 36 SER HBy 1.0 . 5.34 989 780 A 38 PHE H A 36 SER HBx 1.0 . 5.34 990 781 A 37 THR H A 38 PHE HBx 1.0 . 4.77 991 781 A 37 THR H A 38 PHE HBy 1.0 . 4.77 992 782 A 39 LYS H A 38 PHE HBx 1.0 . 3.85 993 782 A 39 LYS H A 38 PHE HBy 1.0 . 3.85 994 783 A 42 GLN HE2y A 38 PHE HZ 1.0 . 5.34 995 783 A 42 GLN HE2x A 38 PHE HZ 1.0 . 5.34 996 784 A 39 LYS H A 39 LYS HGx 1.0 . 3.41 997 784 A 39 LYS H A 39 LYS HGy 1.0 . 3.41 998 785 A 39 LYS HA A 39 LYS HGx 1.0 . 3.38 999 785 A 39 LYS HA A 39 LYS HGy 1.0 . 3.38 1000 786 A 42 GLN HE2y A 39 LYS HA 1.0 . 5.06 1001 786 A 42 GLN HE2x A 39 LYS HA 1.0 . 5.06 1002 787 A 40 LYS H A 39 LYS HGx 1.0 . 4.44 1003 787 A 40 LYS H A 39 LYS HGy 1.0 . 4.44 1004 788 A 43 ASP HA A 46 HIS HBx 1.0 . 4.02 1005 788 A 43 ASP HA A 46 HIS HBy 1.0 . 4.02 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_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 1 ALA C A 2 ASP N A 2 ASP CA A 2 ASP C 1.0 -150.0 -22.0 PHI 2 2 A 2 ASP N A 2 ASP CA A 2 ASP C A 3 ASN N 1.0 94.0 170.0 PSI 3 3 A 2 ASP C A 3 ASN N A 3 ASN CA A 3 ASN C 1.0 -119.0 -55.0 PHI 4 4 A 3 ASN N A 3 ASN CA A 3 ASN C A 4 LYS N 1.0 70.0 154.0 PSI 5 5 A 3 ASN C A 4 LYS N A 4 LYS CA A 4 LYS C 1.0 -103.0 -31.0 PHI 6 6 A 4 LYS N A 4 LYS CA A 4 LYS C A 5 CYS N 1.0 -47.0 5.0 PSI 7 7 A 4 LYS C A 5 CYS N A 5 CYS CA A 5 CYS C 1.0 -90.0 -50.0 PHI 8 8 A 5 CYS N A 5 CYS CA A 5 CYS C A 6 GLU N 1.0 -52.0 0.0 PSI 9 9 A 5 CYS C A 6 GLU N A 6 GLU CA A 6 GLU C 1.0 -96.0 -52.0 PHI 10 10 A 6 GLU N A 6 GLU CA A 6 GLU C A 7 ASN N 1.0 -52.0 -4.0 PSI 11 11 A 6 GLU C A 7 ASN N A 7 ASN CA A 7 ASN C 1.0 -122.0 -70.0 PHI 12 12 A 7 ASN N A 7 ASN CA A 7 ASN C A 8 SER N 1.0 -30.0 34.0 PSI 13 13 A 7 ASN C A 8 SER N A 8 SER CA A 8 SER C 1.0 -118.0 -42.0 PHI 14 14 A 8 SER N A 8 SER CA A 8 SER C A 9 LEU N 1.0 67.0 147.0 PSI 15 15 A 8 SER C A 9 LEU N A 9 LEU CA A 9 LEU C 1.0 -69.0 -45.0 PHI 16 16 A 9 LEU N A 9 LEU CA A 9 LEU C A 10 ARG N 1.0 -65.0 -13.0 PSI 17 17 A 9 LEU C A 10 ARG N A 10 ARG CA A 10 ARG C 1.0 -71.0 -47.0 PHI 18 18 A 10 ARG N A 10 ARG CA A 10 ARG C A 11 ARG N 1.0 -64.0 -12.0 PSI 19 19 A 10 ARG C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 -70.0 -62.0 PHI 20 20 A 11 ARG N A 11 ARG CA A 11 ARG C A 12 GLU N 1.0 -50.0 -34.0 PSI 21 21 A 11 ARG C A 12 GLU N A 12 GLU CA A 12 GLU C 1.0 -72.0 -52.0 PHI 22 22 A 12 GLU N A 12 GLU CA A 12 GLU C A 13 ILE N 1.0 -52.0 -32.0 PSI 23 23 A 12 GLU C A 13 ILE N A 13 ILE CA A 13 ILE C 1.0 -93.0 -45.0 PHI 24 24 A 13 ILE N A 13 ILE CA A 13 ILE C A 14 ALA N 1.0 -57.0 -21.0 PSI 25 25 A 13 ILE C A 14 ALA N A 14 ALA CA A 14 ALA C 1.0 -70.0 -58.0 PHI 26 26 A 14 ALA N A 14 ALA CA A 14 ALA C A 15 CYS N 1.0 -52.0 -36.0 PSI 27 27 A 14 ALA C A 15 CYS N A 15 CYS CA A 15 CYS C 1.0 -76.0 -56.0 PHI 28 28 A 15 CYS N A 15 CYS CA A 15 CYS C A 16 GLY N 1.0 -46.0 -22.0 PSI 29 29 A 15 CYS C A 16 GLY N A 16 GLY CA A 16 GLY C 1.0 -77.0 -53.0 PHI 30 30 A 16 GLY N A 16 GLY CA A 16 GLY C A 17 GLN N 1.0 -47.0 -31.0 PSI 31 31 A 16 GLY C A 17 GLN N A 17 GLN CA A 17 GLN C 1.0 -71.0 -51.0 PHI 32 32 A 17 GLN N A 17 GLN CA A 17 GLN C A 18 CYS N 1.0 -63.0 -19.0 PSI 33 33 A 17 GLN C A 18 CYS N A 18 CYS CA A 18 CYS C 1.0 -69.0 -57.0 PHI 34 34 A 18 CYS N A 18 CYS CA A 18 CYS C A 19 ARG N 1.0 -48.0 -32.0 PSI 35 35 A 18 CYS C A 19 ARG N A 19 ARG CA A 19 ARG C 1.0 -72.0 -56.0 PHI 36 36 A 19 ARG N A 19 ARG CA A 19 ARG C A 20 ASP N 1.0 -53.0 -37.0 PSI 37 37 A 19 ARG C A 20 ASP N A 20 ASP CA A 20 ASP C 1.0 -82.0 -54.0 PHI 38 38 A 20 ASP N A 20 ASP CA A 20 ASP C A 21 LYS N 1.0 -56.0 12.0 PSI 39 39 A 20 ASP C A 21 LYS N A 21 LYS CA A 21 LYS C 1.0 -99.0 -35.0 PHI 40 40 A 21 LYS N A 21 LYS CA A 21 LYS C A 22 VAL N 1.0 -64.0 -20.0 PSI 41 41 A 21 LYS C A 22 VAL N A 22 VAL CA A 22 VAL C 1.0 -100.0 -52.0 PHI 42 42 A 22 VAL N A 22 VAL CA A 22 VAL C A 23 LYS N 1.0 -76.0 4.0 PSI 43 43 A 23 LYS C A 24 THR N A 24 THR CA A 24 THR C 1.0 -151.0 -47.0 PHI 44 44 A 24 THR N A 24 THR CA A 24 THR C A 25 ASP N 1.0 116.0 168.0 PSI 45 45 A 24 THR C A 25 ASP N A 25 ASP CA A 25 ASP C 1.0 -76.0 -40.0 PHI 46 46 A 25 ASP N A 25 ASP CA A 25 ASP C A 26 GLY N 1.0 122.0 146.0 PSI 47 47 A 25 ASP C A 26 GLY N A 26 GLY CA A 26 GLY C 1.0 -86.0 -54.0 PHI 48 48 A 26 GLY N A 26 GLY CA A 26 GLY C A 27 TYR N 1.0 -67.0 5.0 PSI 49 49 A 26 GLY C A 27 TYR N A 27 TYR CA A 27 TYR C 1.0 -69.0 -49.0 PHI 50 50 A 27 TYR N A 27 TYR CA A 27 TYR C A 28 PHE N 1.0 -63.0 -27.0 PSI 51 51 A 27 TYR C A 28 PHE N A 28 PHE CA A 28 PHE C 1.0 -69.0 -53.0 PHI 52 52 A 28 PHE N A 28 PHE CA A 28 PHE C A 29 TYR N 1.0 -54.0 -38.0 PSI 53 53 A 28 PHE C A 29 TYR N A 29 TYR CA A 29 TYR C 1.0 -75.0 -47.0 PHI 54 54 A 29 TYR N A 29 TYR CA A 29 TYR C A 30 GLU N 1.0 -58.0 -22.0 PSI 55 55 A 29 TYR C A 30 GLU N A 30 GLU CA A 30 GLU C 1.0 -75.0 -51.0 PHI 56 56 A 30 GLU N A 30 GLU CA A 30 GLU C A 31 CYS N 1.0 -54.0 -30.0 PSI 57 57 A 30 GLU C A 31 CYS N A 31 CYS CA A 31 CYS C 1.0 -77.0 -49.0 PHI 58 58 A 31 CYS N A 31 CYS CA A 31 CYS C A 32 CYS N 1.0 -56.0 -28.0 PSI 59 59 A 31 CYS C A 32 CYS N A 32 CYS CA A 32 CYS C 1.0 -102.0 -42.0 PHI 60 60 A 32 CYS N A 32 CYS CA A 32 CYS C A 33 THR N 1.0 -67.0 5.0 PSI 61 61 A 32 CYS C A 33 THR N A 33 THR CA A 33 THR C 1.0 -137.0 -73.0 PHI 62 62 A 33 THR N A 33 THR CA A 33 THR C A 34 SER N 1.0 -24.0 20.0 PSI 63 63 A 33 THR C A 34 SER N A 34 SER CA A 34 SER C 1.0 -134.0 -42.0 PHI 64 64 A 34 SER N A 34 SER CA A 34 SER C A 35 ASP N 1.0 80.0 152.0 PSI 65 65 A 34 SER C A 35 ASP N A 35 ASP CA A 35 ASP C 1.0 -66.0 -50.0 PHI 66 66 A 35 ASP N A 35 ASP CA A 35 ASP C A 36 SER N 1.0 -62.0 -6.0 PSI 67 67 A 35 ASP C A 36 SER N A 36 SER CA A 36 SER C 1.0 -76.0 -56.0 PHI 68 68 A 36 SER N A 36 SER CA A 36 SER C A 37 THR N 1.0 -53.0 -21.0 PSI 69 69 A 36 SER C A 37 THR N A 37 THR CA A 37 THR C 1.0 -83.0 -51.0 PHI 70 70 A 37 THR N A 37 THR CA A 37 THR C A 38 PHE N 1.0 -54.0 -26.0 PSI 71 71 A 37 THR C A 38 PHE N A 38 PHE CA A 38 PHE C 1.0 -73.0 -61.0 PHI 72 72 A 38 PHE N A 38 PHE CA A 38 PHE C A 39 LYS N 1.0 -52.0 -32.0 PSI 73 73 A 38 PHE C A 39 LYS N A 39 LYS CA A 39 LYS C 1.0 -67.0 -51.0 PHI 74 74 A 39 LYS N A 39 LYS CA A 39 LYS C A 40 LYS N 1.0 -54.0 -30.0 PSI 75 75 A 39 LYS C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -75.0 -51.0 PHI 76 76 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 CYS N 1.0 -52.0 -32.0 PSI 77 77 A 40 LYS C A 41 CYS N A 41 CYS CA A 41 CYS C 1.0 -75.0 -55.0 PHI 78 78 A 41 CYS N A 41 CYS CA A 41 CYS C A 42 GLN N 1.0 -58.0 -26.0 PSI 79 79 A 41 CYS C A 42 GLN N A 42 GLN CA A 42 GLN C 1.0 -76.0 -48.0 PHI 80 80 A 42 GLN N A 42 GLN CA A 42 GLN C A 43 ASP N 1.0 -56.0 -20.0 PSI 81 81 A 42 GLN C A 43 ASP N A 43 ASP CA A 43 ASP C 1.0 -71.0 -55.0 PHI 82 82 A 43 ASP N A 43 ASP CA A 43 ASP C A 44 LEU N 1.0 -52.0 -32.0 PSI 83 83 A 43 ASP C A 44 LEU N A 44 LEU CA A 44 LEU C 1.0 -78.0 -54.0 PHI 84 84 A 44 LEU N A 44 LEU CA A 44 LEU C A 45 LEU N 1.0 -52.0 -12.0 PSI stop_ save_