data_nef_c30475_6dmz save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6DMZ stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 3 CYS SG 1 47 CYS SG 1 14 CYS SG 1 34 CYS SG 1 20 CYS SG 1 41 CYS SG 1 24 CYS SG 1 43 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 ARG start . . 2 A 2 THR middle . . 3 A 3 CYS middle -HG . 4 A 4 GLN middle . . 5 A 5 SER middle . . 6 A 6 GLN middle . . 7 A 7 SER middle . . 8 A 8 HIS middle . . 9 A 9 ARG middle . . 10 A 10 PHE middle . . 11 A 11 ARG middle . . 12 A 12 GLY middle . false 13 A 13 PRO middle . false 14 A 14 CYS middle -HG . 15 A 15 LEU middle . . 16 A 16 ARG middle . . 17 A 17 ARG middle . . 18 A 18 SER middle . . 19 A 19 ASN middle . . 20 A 20 CYS middle -HG . 21 A 21 ALA middle . . 22 A 22 ASN middle . . 23 A 23 VAL middle . . 24 A 24 CYS middle -HG . 25 A 25 ARG middle . . 26 A 26 THR middle . . 27 A 27 GLU middle . . 28 A 28 GLY middle . false 29 A 29 PHE middle . . 30 A 30 PRO middle . false 31 A 31 GLY middle . false 32 A 32 GLY middle . false 33 A 33 ARG middle . . 34 A 34 CYS middle -HG . 35 A 35 ARG middle . . 36 A 36 GLY middle . false 37 A 37 PHE middle . . 38 A 38 ARG middle . . 39 A 39 ARG middle . . 40 A 40 ARG middle . . 41 A 41 CYS middle -HG . 42 A 42 PHE middle . . 43 A 43 CYS middle -HG . 44 A 44 THR middle . . 45 A 45 THR middle . . 46 A 46 HIS middle . . 47 A 47 CYS end -HG . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 ARG HA H 1 4.134 0.003 A 1 ARG HBx H 1 1.959 0.000 A 1 ARG HBy H 1 1.959 0.000 A 1 ARG HDx H 1 3.259 0.000 A 1 ARG HDy H 1 3.259 0.000 A 1 ARG HGx H 1 1.710 0.000 A 1 ARG HGy H 1 1.710 0.000 A 1 ARG CA C 13 51.628 0.000 A 2 THR H H 1 8.444 0.002 A 2 THR HA H 1 4.719 0.006 A 2 THR HB H 1 4.148 0.005 A 2 THR HG2% H 1 1.156 0.003 A 2 THR CA C 13 61.478 0.000 A 2 THR CB C 13 70.661 0.000 A 2 THR CG2 C 13 21.574 0.000 A 2 THR N N 15 116.863 0.000 A 3 CYS H H 1 8.719 0.004 A 3 CYS HA H 1 4.891 0.010 A 3 CYS HBx H 1 2.693 0.004 A 3 CYS HBy H 1 3.190 0.006 A 3 CYS CA C 13 57.978 0.000 A 3 CYS CB C 13 43.232 0.007 A 3 CYS N N 15 123.630 0.000 A 4 GLN H H 1 8.341 0.001 A 4 GLN HA H 1 5.445 0.005 A 4 GLN HBx H 1 1.780 0.005 A 4 GLN HBy H 1 1.980 0.003 A 4 GLN HE2y H 1 7.213 0.005 A 4 GLN HE2x H 1 6.193 0.012 A 4 GLN HGx H 1 2.068 0.004 A 4 GLN HGy H 1 2.180 0.004 A 4 GLN CA C 13 54.227 0.000 A 4 GLN CB C 13 32.326 0.000 A 4 GLN CG C 13 32.855 0.033 A 4 GLN N N 15 117.946 0.000 A 4 GLN NE2 N 15 110.003 0.081 A 5 SER H H 1 8.736 0.002 A 5 SER HA H 1 4.651 0.005 A 5 SER HBx H 1 3.462 0.002 A 5 SER HBy H 1 3.462 0.002 A 5 SER CA C 13 56.824 0.000 A 5 SER CB C 13 65.226 0.000 A 5 SER N N 15 115.749 0.000 A 6 GLN H H 1 9.037 0.001 A 6 GLN HA H 1 3.322 0.001 A 6 GLN HBx H 1 1.581 0.004 A 6 GLN HBy H 1 1.582 0.004 A 6 GLN HE2y H 1 7.342 0.006 A 6 GLN HE2x H 1 6.799 0.006 A 6 GLN HGx H 1 2.231 0.002 A 6 GLN HGy H 1 2.231 0.002 A 6 GLN CA C 13 57.273 0.000 A 6 GLN CB C 13 27.932 0.000 A 6 GLN CG C 13 33.486 0.000 A 6 GLN N N 15 128.325 0.000 A 6 GLN NE2 N 15 110.544 0.000 A 7 SER H H 1 8.147 0.002 A 7 SER HA H 1 4.376 0.006 A 7 SER HBx H 1 3.407 0.004 A 7 SER HBy H 1 3.989 0.002 A 7 SER CA C 13 58.603 0.000 A 7 SER CB C 13 63.780 0.008 A 8 HIS H H 1 10.692 0.007 A 8 HIS HA H 1 4.778 0.005 A 8 HIS HBx H 1 3.244 0.004 A 8 HIS HBy H 1 3.388 0.006 A 8 HIS HD2 H 1 7.432 0.001 A 8 HIS HE1 H 1 8.647 0.000 A 8 HIS CA C 13 57.110 0.000 A 8 HIS CB C 13 29.416 0.000 A 8 HIS N N 15 129.269 0.000 A 9 ARG H H 1 8.515 0.002 A 9 ARG HA H 1 4.328 0.004 A 9 ARG HBx H 1 1.777 0.005 A 9 ARG HBy H 1 1.778 0.005 A 9 ARG HDx H 1 3.097 0.002 A 9 ARG HDy H 1 3.187 0.002 A 9 ARG HE H 1 7.348 0.001 A 9 ARG HGx H 1 1.641 0.002 A 9 ARG HGy H 1 1.641 0.002 A 9 ARG CB C 13 32.045 0.000 A 10 PHE H H 1 8.298 0.001 A 10 PHE HA H 1 4.013 0.004 A 10 PHE HBx H 1 2.990 0.005 A 10 PHE HBy H 1 2.990 0.005 A 10 PHE HD1 H 1 7.103 0.001 A 10 PHE HD2 H 1 7.103 0.001 A 10 PHE HE1 H 1 7.056 0.003 A 10 PHE HE2 H 1 7.056 0.003 A 10 PHE CA C 13 60.376 0.000 A 10 PHE CB C 13 38.937 0.000 A 10 PHE N N 15 122.036 0.000 A 11 ARG H H 1 7.873 0.002 A 11 ARG HA H 1 4.645 0.004 A 11 ARG HBx H 1 1.691 0.002 A 11 ARG HBy H 1 1.691 0.002 A 11 ARG HDx H 1 3.174 0.007 A 11 ARG HDy H 1 3.174 0.007 A 11 ARG HGx H 1 1.575 0.001 A 11 ARG HGy H 1 1.575 0.001 A 11 ARG CA C 13 54.453 0.000 A 11 ARG N N 15 128.881 0.000 A 12 GLY H H 1 8.352 0.003 A 12 GLY HAx H 1 3.854 0.005 A 12 GLY HAy H 1 4.220 0.003 A 12 GLY CA C 13 44.207 0.025 A 12 GLY N N 15 109.695 0.000 A 13 PRO HA H 1 4.569 0.003 A 13 PRO HBx H 1 1.740 0.002 A 13 PRO HBy H 1 2.257 0.003 A 13 PRO HDx H 1 3.585 0.001 A 13 PRO HDy H 1 3.699 0.002 A 13 PRO HGy H 1 2.098 0.007 A 13 PRO HGx H 1 2.088 0.000 A 13 PRO CA C 13 63.949 0.000 A 13 PRO CB C 13 31.906 0.000 A 13 PRO CD C 13 49.218 0.001 A 13 PRO CG C 13 27.434 0.000 A 14 CYS H H 1 8.703 0.001 A 14 CYS HA H 1 4.722 0.004 A 14 CYS HBx H 1 1.854 0.008 A 14 CYS HBy H 1 2.937 0.001 A 14 CYS CA C 13 57.464 0.000 A 15 LEU H H 1 8.524 0.003 A 15 LEU HA H 1 4.560 0.003 A 15 LEU HBx H 1 1.706 0.008 A 15 LEU HBy H 1 1.817 0.003 A 15 LEU HDx% H 1 0.962 0.001 A 15 LEU HDy% H 1 0.870 0.001 A 15 LEU HG H 1 1.570 0.001 A 15 LEU CA C 13 54.756 0.000 A 15 LEU CB C 13 43.601 0.016 A 15 LEU CDy C 13 25.110 0.000 A 15 LEU CDx C 13 22.752 0.000 A 16 ARG H H 1 8.111 0.002 A 16 ARG HA H 1 4.420 0.002 A 16 ARG HBx H 1 1.897 0.002 A 16 ARG HBy H 1 1.897 0.003 A 16 ARG HDx H 1 3.259 0.002 A 16 ARG HDy H 1 3.259 0.002 A 16 ARG HGx H 1 1.699 0.005 A 16 ARG HGy H 1 1.700 0.004 A 16 ARG CA C 13 57.639 0.000 A 16 ARG CB C 13 31.546 0.000 A 18 SER H H 1 8.572 0.005 A 18 SER HA H 1 4.350 0.007 A 18 SER HBx H 1 4.081 0.009 A 18 SER HBy H 1 4.081 0.009 A 18 SER CA C 13 60.488 0.000 A 18 SER CB C 13 62.996 0.000 A 19 ASN HA H 1 4.902 0.008 A 19 ASN HBx H 1 3.078 0.005 A 19 ASN HBy H 1 3.189 0.001 A 19 ASN HD2y H 1 7.685 0.002 A 19 ASN HD2x H 1 7.093 0.006 A 19 ASN CA C 13 54.725 0.000 A 19 ASN CB C 13 38.294 0.000 A 19 ASN ND2 N 15 111.335 0.042 A 20 CYS H H 1 7.464 0.001 A 20 CYS HA H 1 4.414 0.001 A 20 CYS HBx H 1 2.325 0.006 A 20 CYS HBy H 1 2.849 0.004 A 20 CYS CB C 13 35.955 0.019 A 21 ALA H H 1 8.800 0.001 A 21 ALA HA H 1 3.636 0.001 A 21 ALA HB% H 1 1.565 0.001 A 21 ALA CA C 13 56.209 0.000 A 21 ALA CB C 13 17.796 0.000 A 21 ALA N N 15 121.111 0.000 A 22 ASN H H 1 8.009 0.001 A 22 ASN HA H 1 4.447 0.007 A 22 ASN HBx H 1 2.962 0.012 A 22 ASN HBy H 1 2.981 0.010 A 22 ASN HD2y H 1 7.698 0.005 A 22 ASN HD2x H 1 7.038 0.006 A 22 ASN CB C 13 38.031 0.002 A 22 ASN ND2 N 15 112.414 0.000 A 23 VAL H H 1 8.166 0.003 A 23 VAL HA H 1 3.827 0.001 A 23 VAL HB H 1 2.399 0.004 A 23 VAL HGx% H 1 1.258 0.001 A 23 VAL HGy% H 1 1.081 0.002 A 23 VAL CA C 13 67.030 0.000 A 23 VAL CB C 13 31.868 0.000 A 23 VAL CGy C 13 23.439 0.000 A 23 VAL CGx C 13 22.430 0.000 A 23 VAL N N 15 122.266 0.000 A 24 CYS H H 1 9.015 0.000 A 24 CYS HA H 1 4.680 0.005 A 24 CYS HBx H 1 2.753 0.006 A 24 CYS HBy H 1 2.854 0.003 A 24 CYS CB C 13 38.291 0.004 A 24 CYS N N 15 120.538 0.000 A 25 ARG H H 1 8.263 0.001 A 25 ARG HA H 1 5.185 0.002 A 25 ARG HBx H 1 2.024 0.003 A 25 ARG HBy H 1 2.113 0.004 A 25 ARG HDx H 1 3.288 0.001 A 25 ARG HDy H 1 3.290 0.003 A 25 ARG HE H 1 7.274 0.003 A 25 ARG HGx H 1 1.832 0.002 A 25 ARG HGy H 1 1.832 0.002 A 25 ARG CA C 13 59.342 0.000 A 25 ARG CB C 13 29.763 0.024 A 25 ARG CG C 13 28.385 0.000 A 25 ARG N N 15 121.569 0.000 A 26 THR H H 1 8.104 0.004 A 26 THR HA H 1 4.361 0.001 A 26 THR HB H 1 4.463 0.003 A 26 THR HG2% H 1 1.464 0.001 A 26 THR CA C 13 65.232 0.000 A 26 THR CB C 13 69.071 0.000 A 26 THR CG2 C 13 21.904 0.000 A 26 THR N N 15 115.545 0.000 A 27 GLU H H 1 7.694 0.003 A 27 GLU HA H 1 4.315 0.003 A 27 GLU HBy H 1 2.241 0.001 A 27 GLU HBx H 1 2.238 0.003 A 27 GLU HGy H 1 2.619 0.001 A 27 GLU HGx H 1 2.618 0.005 A 27 GLU CA C 13 56.806 0.000 A 27 GLU N N 15 120.554 0.000 A 28 GLY H H 1 7.741 0.005 A 28 GLY HAx H 1 3.661 0.003 A 28 GLY HAy H 1 4.070 0.007 A 28 GLY CA C 13 44.878 0.000 A 28 GLY N N 15 105.581 0.000 A 29 PHE H H 1 8.109 0.003 A 29 PHE HA H 1 5.123 0.003 A 29 PHE HBx H 1 2.575 0.005 A 29 PHE HBy H 1 3.923 0.005 A 29 PHE HD1 H 1 7.442 0.009 A 29 PHE HD2 H 1 7.442 0.009 A 29 PHE HE1 H 1 7.341 0.004 A 29 PHE HE2 H 1 7.341 0.004 A 29 PHE CA C 13 55.820 0.000 A 29 PHE CB C 13 40.088 0.016 A 29 PHE N N 15 120.800 0.000 A 30 PRO HA H 1 4.566 0.002 A 30 PRO HBx H 1 2.076 0.005 A 30 PRO HBy H 1 2.336 0.002 A 30 PRO HDx H 1 3.887 0.003 A 30 PRO HDy H 1 4.570 0.002 A 30 PRO HGx H 1 1.943 0.001 A 30 PRO HGy H 1 2.078 0.003 A 30 PRO CA C 13 62.904 0.000 A 30 PRO CB C 13 31.891 0.019 A 30 PRO CD C 13 50.431 0.024 A 30 PRO CG C 13 27.547 0.000 A 31 GLY H H 1 7.219 0.004 A 31 GLY HAx H 1 3.976 0.004 A 31 GLY HAy H 1 4.300 0.002 A 31 GLY CA C 13 44.846 0.009 A 31 GLY N N 15 103.243 0.000 A 32 GLY H H 1 7.705 0.003 A 32 GLY HAx H 1 4.389 0.004 A 32 GLY HAy H 1 4.606 0.005 A 32 GLY CA C 13 46.878 0.015 A 32 GLY N N 15 105.971 0.000 A 33 ARG H H 1 8.936 0.002 A 33 ARG HA H 1 4.490 0.005 A 33 ARG HBx H 1 1.750 0.002 A 33 ARG HBy H 1 1.897 0.006 A 33 ARG HDx H 1 3.087 0.001 A 33 ARG HDy H 1 3.087 0.001 A 33 ARG HE H 1 7.085 0.001 A 33 ARG HGx H 1 1.368 0.002 A 33 ARG HGy H 1 1.606 0.000 A 33 ARG CA C 13 55.047 0.000 A 33 ARG CB C 13 33.354 0.000 A 33 ARG CD C 13 43.568 0.000 A 33 ARG CG C 13 25.743 0.021 A 33 ARG N N 15 115.828 0.000 A 34 CYS H H 1 8.437 0.003 A 34 CYS HA H 1 5.497 0.005 A 34 CYS HBx H 1 2.638 0.003 A 34 CYS HBy H 1 2.820 0.006 A 34 CYS CA C 13 52.179 0.000 A 34 CYS CB C 13 36.644 0.048 A 34 CYS N N 15 120.287 0.000 A 35 ARG H H 1 9.490 0.003 A 35 ARG HA H 1 4.666 0.004 A 35 ARG HBx H 1 1.545 0.003 A 35 ARG HBy H 1 1.715 0.001 A 35 ARG HDx H 1 2.531 0.005 A 35 ARG HDy H 1 2.726 0.006 A 35 ARG HE H 1 6.962 0.001 A 35 ARG HGx H 1 1.394 0.005 A 35 ARG HGy H 1 1.396 0.004 A 35 ARG CA C 13 55.886 0.000 A 35 ARG CB C 13 34.716 0.006 A 35 ARG CD C 13 43.045 0.018 A 35 ARG CG C 13 26.784 0.000 A 35 ARG N N 15 122.465 0.000 A 36 GLY H H 1 8.418 0.003 A 36 GLY HAx H 1 3.846 0.002 A 36 GLY HAy H 1 4.407 0.001 A 36 GLY CA C 13 44.631 0.000 A 36 GLY N N 15 108.974 0.000 A 37 PHE H H 1 8.567 0.001 A 37 PHE HA H 1 4.452 0.005 A 37 PHE HBx H 1 3.080 0.004 A 37 PHE HBy H 1 3.263 0.002 A 37 PHE HD1 H 1 7.294 0.003 A 37 PHE HD2 H 1 7.294 0.003 A 37 PHE HE1 H 1 7.383 0.001 A 37 PHE HE2 H 1 7.383 0.001 A 37 PHE CB C 13 38.544 0.044 A 37 PHE N N 15 121.835 0.000 A 38 ARG H H 1 8.244 0.001 A 38 ARG HA H 1 4.174 0.004 A 38 ARG HBx H 1 1.691 0.001 A 38 ARG HBy H 1 1.898 0.003 A 38 ARG HDx H 1 3.110 0.005 A 38 ARG HDy H 1 3.110 0.005 A 38 ARG HE H 1 7.237 0.003 A 38 ARG HGx H 1 1.469 0.004 A 38 ARG HGy H 1 1.469 0.004 A 38 ARG CA C 13 55.798 0.000 A 38 ARG CB C 13 28.885 0.022 A 38 ARG CD C 13 43.098 0.000 A 38 ARG CG C 13 27.504 0.000 A 38 ARG N N 15 117.168 0.000 A 39 ARG H H 1 8.003 0.003 A 39 ARG HA H 1 3.780 0.001 A 39 ARG HBx H 1 1.793 0.003 A 39 ARG HBy H 1 2.145 0.003 A 39 ARG HDx H 1 3.095 0.003 A 39 ARG HDy H 1 3.203 0.001 A 39 ARG HE H 1 7.134 0.002 A 39 ARG HGx H 1 1.624 0.001 A 39 ARG HGy H 1 1.624 0.001 A 39 ARG CA C 13 56.945 0.000 A 39 ARG CB C 13 27.952 0.016 A 39 ARG N N 15 117.425 0.000 A 40 ARG HA H 1 4.593 0.002 A 40 ARG HBx H 1 1.578 0.003 A 40 ARG HBy H 1 1.753 0.000 A 40 ARG HGy H 1 1.579 0.002 A 40 ARG HGx H 1 1.578 0.000 A 40 ARG CA C 13 54.065 0.000 A 40 ARG CB C 13 33.489 0.018 A 40 ARG CG C 13 27.245 0.000 A 41 CYS H H 1 9.344 0.002 A 41 CYS HA H 1 4.678 0.004 A 41 CYS HBx H 1 1.441 0.004 A 41 CYS HBy H 1 1.971 0.002 A 41 CYS CA C 13 60.137 0.000 A 41 CYS CB C 13 35.741 0.036 A 41 CYS N N 15 120.385 0.000 A 42 PHE H H 1 8.827 0.002 A 42 PHE HA H 1 4.522 0.002 A 42 PHE HBx H 1 2.488 0.006 A 42 PHE HBy H 1 2.801 0.003 A 42 PHE HD1 H 1 6.853 0.002 A 42 PHE HD2 H 1 6.853 0.002 A 42 PHE HE1 H 1 7.273 0.001 A 42 PHE HE2 H 1 7.273 0.001 A 42 PHE CA C 13 57.013 0.000 A 42 PHE CB C 13 41.594 0.033 A 42 PHE N N 15 129.599 0.000 A 43 CYS H H 1 8.923 0.005 A 43 CYS HA H 1 5.277 0.003 A 43 CYS HBx H 1 1.559 0.005 A 43 CYS HBy H 1 2.563 0.004 A 43 CYS CA C 13 51.687 0.000 A 43 CYS CB C 13 35.799 0.020 A 43 CYS N N 15 122.497 0.000 A 44 THR H H 1 8.350 0.002 A 44 THR HA H 1 4.556 0.003 A 44 THR HB H 1 3.819 0.006 A 44 THR HG2% H 1 1.164 0.005 A 44 THR CA C 13 62.026 0.000 A 44 THR CB C 13 70.020 0.000 A 44 THR CG2 C 13 22.089 0.000 A 44 THR N N 15 120.150 0.000 A 45 THR H H 1 8.116 0.002 A 45 THR HA H 1 4.760 0.007 A 45 THR HB H 1 4.204 0.002 A 45 THR HG2% H 1 0.814 0.004 A 45 THR CA C 13 59.065 0.000 A 45 THR CB C 13 70.645 0.000 A 45 THR CG2 C 13 19.766 0.000 A 45 THR N N 15 115.545 0.000 A 46 HIS H H 1 8.452 0.002 A 46 HIS HA H 1 4.974 0.007 A 46 HIS HBx H 1 3.375 0.000 A 46 HIS HBy H 1 3.375 0.000 A 46 HIS CA C 13 55.305 0.000 A 46 HIS CB C 13 29.150 0.000 A 46 HIS N N 15 119.792 0.000 A 47 CYS H H 1 8.594 0.001 A 47 CYS HA H 1 4.548 0.002 A 47 CYS HBx H 1 3.009 0.003 A 47 CYS HBy H 1 3.264 0.002 A 47 CYS CB C 13 42.614 0.027 A 47 CYS N N 15 125.962 0.000 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 15 LEU H A 15 LEU HDx% 1.0 1.8 4.49 2 2 A 15 LEU H A 15 LEU HDy% 1.0 1.8 4.49 3 3 A 9 ARG H A 9 ARG HGx 1.0 1.8 4.16 4 4 A 9 ARG H A 9 ARG HGy 1.0 1.8 4.16 5 5 A 15 LEU H A 15 LEU HG 1.0 1.8 4.10 6 6 A 23 VAL H A 23 VAL HGy% 1.0 1.8 4.36 7 7 A 23 VAL H A 23 VAL HGx% 1.0 1.8 4.36 8 8 A 23 VAL H A 23 VAL HB 1.0 1.8 3.56 9 9 A 24 CYS H A 23 VAL HGx% 1.0 1.8 4.40 10 10 A 24 CYS H A 23 VAL HGy% 1.0 1.8 4.40 11 11 A 23 VAL HB A 24 CYS H 1.0 1.8 4.11 12 12 A 23 VAL H A 24 CYS H 1.0 1.8 3.63 13 13 A 13 PRO HDx A 12 GLY HAx 1.0 1.8 3.72 14 14 A 12 GLY HAx A 13 PRO HDy 1.0 1.8 3.72 15 15 A 12 GLY HAy A 13 PRO HDx 1.0 1.8 3.72 16 16 A 12 GLY HAy A 13 PRO HDy 1.0 1.8 3.72 17 17 A 29 PHE HA A 29 PHE HD% 1.0 1.8 3.49 18 18 A 29 PHE HA A 29 PHE HE% 1.0 1.8 4.43 19 19 A 29 PHE HD% A 29 PHE H 1.0 1.8 3.93 20 20 A 29 PHE HE% A 29 PHE H 1.0 1.8 5.50 21 21 A 29 PHE HE% A 45 THR H 1.0 1.8 5.50 22 22 A 29 PHE H A 25 ARG HA 1.0 1.8 3.67 23 23 A 29 PHE H A 29 PHE HBx 1.0 1.8 4.01 24 24 A 29 PHE H A 29 PHE HBy 1.0 1.8 4.01 25 25 A 29 PHE H A 28 GLY H 1.0 1.8 3.49 26 26 A 25 ARG HA A 28 GLY H 1.0 1.8 4.40 27 27 A 24 CYS H A 25 ARG H 1.0 1.8 3.86 28 28 A 25 ARG H A 26 THR H 1.0 1.8 3.83 29 29 A 25 ARG H A 24 CYS HBx 1.0 1.8 4.02 30 30 A 25 ARG H A 24 CYS HBy 1.0 1.8 4.45 31 31 A 25 ARG H A 25 ARG HBx 1.0 1.8 3.75 32 32 A 25 ARG H A 25 ARG HBy 1.0 1.8 3.75 33 33 A 44 THR H A 44 THR HG2% 1.0 1.8 4.02 34 34 A 45 THR H A 44 THR H 1.0 1.8 4.71 35 35 A 26 THR H A 26 THR HG2% 1.0 1.8 3.30 36 36 A 26 THR H A 26 THR HB 1.0 1.8 3.82 37 37 A 26 THR H A 27 GLU H 1.0 1.8 3.59 38 38 A 26 THR HB A 27 GLU H 1.0 1.8 4.93 39 39 A 26 THR HG2% A 27 GLU H 1.0 1.8 4.52 40 40 A 2 THR HG2% A 3 CYS H 1.0 1.8 3.86 41 41 A 3 CYS H A 3 CYS HBy 1.0 1.8 4.15 42 42 A 3 CYS H A 3 CYS HBx 1.0 1.8 4.15 43 43 A 3 CYS H A 2 THR HA 1.0 1.8 3.15 44 44 A 3 CYS H A 4 GLN H 1.0 1.8 4.29 45 45 A 4 GLN H A 3 CYS HBx 1.0 1.8 4.06 46 46 A 4 GLN H A 3 CYS HBy 1.0 1.8 4.06 47 47 A 4 GLN H A 4 GLN HGx 1.0 1.8 4.40 48 48 A 4 GLN H A 4 GLN HGy 1.0 1.8 4.40 49 49 A 4 GLN HA A 5 SER H 1.0 1.8 3.05 50 50 A 8 HIS H A 8 HIS HBx 1.0 1.8 4.18 51 51 A 8 HIS H A 8 HIS HBy 1.0 1.8 4.18 52 52 A 9 ARG H A 8 HIS HBx 1.0 1.8 4.50 53 53 A 9 ARG H A 8 HIS HBy 1.0 1.8 4.50 54 54 A 15 LEU H A 14 CYS HA 1.0 1.8 3.33 55 55 A 9 ARG H A 8 HIS H 1.0 1.8 3.59 56 56 A 10 PHE H A 9 ARG HGx 1.0 1.8 5.38 57 57 A 10 PHE H A 9 ARG HGy 1.0 1.8 5.38 58 58 A 9 ARG H A 10 PHE H 1.0 1.8 3.52 59 59 A 10 PHE HA A 10 PHE HD% 1.0 1.8 3.66 60 60 A 10 PHE HA A 10 PHE HE% 1.0 1.8 4.56 61 61 A 10 PHE H A 10 PHE HD% 1.0 1.8 4.48 62 62 A 10 PHE HA A 11 ARG H 1.0 1.8 2.97 63 63 A 10 PHE H A 11 ARG H 1.0 1.8 4.88 64 64 A 10 PHE HD% A 11 ARG H 1.0 1.8 4.34 65 65 A 11 ARG H A 12 GLY H 1.0 1.8 4.85 66 66 A 12 GLY H A 11 ARG HA 1.0 1.8 3.06 67 67 A 33 ARG H A 32 GLY HAy 1.0 1.8 3.55 68 68 A 33 ARG H A 32 GLY HAx 1.0 1.8 3.55 69 69 A 33 ARG H A 32 GLY H 1.0 1.8 4.96 70 70 A 32 GLY H A 31 GLY H 1.0 1.8 5.21 71 71 A 31 GLY H A 30 PRO HGx 1.0 1.8 4.58 72 72 A 42 PHE H A 42 PHE HD% 1.0 1.8 4.14 73 73 A 3 CYS H A 2 THR H 1.0 1.8 4.74 74 74 A 33 ARG HA A 34 CYS H 1.0 1.8 2.76 75 75 A 2 THR HG2% A 2 THR HA 1.0 1.8 3.69 76 76 A 2 THR HG2% A 2 THR H 1.0 1.8 4.07 77 77 A 34 CYS H A 33 ARG HBx 1.0 1.8 3.95 78 78 A 2 THR H A 2 THR HB 1.0 1.8 3.63 79 79 A 4 GLN HA A 5 SER HBx 1.0 1.8 5.50 80 80 A 4 GLN HA A 5 SER HBy 1.0 1.8 5.50 81 81 A 5 SER H A 42 PHE HD% 1.0 1.8 4.46 82 82 A 5 SER H A 43 CYS H 1.0 1.8 4.06 83 83 A 43 CYS HA A 44 THR HB 1.0 1.8 5.17 84 84 A 24 CYS HBy A 43 CYS HA 1.0 1.8 4.97 85 85 A 43 CYS H A 43 CYS HBy 1.0 1.8 4.11 86 86 A 43 CYS H A 43 CYS HBx 1.0 1.8 4.11 87 87 A 43 CYS H A 42 PHE HBy 1.0 1.8 4.26 88 88 A 43 CYS H A 5 SER HBx 1.0 1.8 5.50 89 89 A 43 CYS H A 5 SER HBy 1.0 1.8 5.50 90 90 A 43 CYS H A 6 GLN HA 1.0 1.8 4.31 91 91 A 43 CYS H A 42 PHE HA 1.0 1.8 3.06 92 92 A 42 PHE HD% A 43 CYS H 1.0 1.8 4.64 93 93 A 43 CYS H A 7 SER H 1.0 1.8 5.44 94 94 A 44 THR H A 33 ARG H 1.0 1.8 5.04 95 95 A 44 THR H A 43 CYS H 1.0 1.8 5.50 96 96 A 44 THR HG2% A 44 THR HA 1.0 1.8 3.46 97 97 A 12 GLY H A 11 ARG HBx 1.0 1.8 4.88 98 98 A 12 GLY H A 11 ARG HBy 1.0 1.8 4.88 99 99 A 12 GLY H A 13 PRO HDx 1.0 1.8 5.13 100 100 A 12 GLY H A 13 PRO HDy 1.0 1.8 5.13 101 101 A 44 THR H A 43 CYS HA 1.0 1.8 3.15 102 102 A 16 ARG H A 15 LEU HBy 1.0 1.8 4.14 103 103 A 26 THR H A 25 ARG HBx 1.0 1.8 4.14 104 104 A 26 THR H A 25 ARG HBy 1.0 1.8 4.14 105 105 A 16 ARG H A 15 LEU HBx 1.0 1.8 4.14 106 106 A 26 THR H A 23 VAL HA 1.0 1.8 4.18 107 107 A 45 THR H A 44 THR HB 1.0 1.8 4.46 108 108 A 27 GLU HA A 27 GLU HGy 1.0 1.8 3.88 109 109 A 27 GLU HA A 27 GLU HGx 1.0 1.8 3.88 110 110 A 27 GLU H A 24 CYS HA 1.0 1.8 4.39 111 111 A 25 ARG HA A 27 GLU H 1.0 1.8 4.93 112 112 A 42 PHE HD% A 5 SER HA 1.0 1.8 3.95 113 113 A 42 PHE HD% A 6 GLN HA 1.0 1.8 4.11 114 114 A 34 CYS H A 34 CYS HBx 1.0 1.8 4.09 115 115 A 34 CYS H A 34 CYS HBy 1.0 1.8 4.09 116 116 A 13 PRO HA A 14 CYS H 1.0 1.8 3.06 117 117 A 3 CYS H A 2 THR HB 1.0 1.8 3.50 118 118 A 8 HIS H A 9 ARG HGx 1.0 1.8 5.50 119 119 A 8 HIS H A 9 ARG HGy 1.0 1.8 5.50 120 120 A 8 HIS H A 7 SER HA 1.0 1.8 3.38 121 121 A 9 ARG H A 10 PHE HBx 1.0 1.8 4.90 122 122 A 9 ARG H A 10 PHE HBy 1.0 1.8 5.50 123 123 A 9 ARG H A 10 PHE HA 1.0 1.8 5.50 124 124 A 15 LEU H A 16 ARG H 1.0 1.8 3.64 125 125 A 15 LEU H A 10 PHE HE% 1.0 1.8 5.11 126 126 A 10 PHE H A 10 PHE HBx 1.0 1.8 3.26 127 127 A 10 PHE H A 10 PHE HBy 1.0 1.8 3.72 128 128 A 10 PHE HD% A 20 CYS HA 1.0 1.8 3.71 129 129 A 10 PHE HE% A 20 CYS HA 1.0 1.8 3.66 130 130 A 10 PHE HD% A 41 CYS HBy 1.0 1.8 4.19 131 131 A 10 PHE HE% A 41 CYS HBy 1.0 1.8 4.81 132 132 A 10 PHE HD% A 23 VAL HGx% 1.0 1.8 3.52 133 133 A 10 PHE HE% A 23 VAL HGx% 1.0 1.8 4.98 134 134 A 10 PHE HD% A 41 CYS HBx 1.0 1.8 4.19 135 135 A 10 PHE HE% A 41 CYS HBx 1.0 1.8 4.81 136 136 A 10 PHE HE% A 19 ASN HBx 1.0 1.8 4.41 137 137 A 10 PHE HD% A 11 ARG HA 1.0 1.8 4.74 138 138 A 10 PHE HE% A 14 CYS H 1.0 1.8 4.92 139 139 A 10 PHE HD% A 41 CYS H 1.0 1.8 4.81 140 140 A 23 VAL H A 10 PHE HD% 1.0 1.8 4.88 141 141 A 11 ARG H A 23 VAL HGx% 1.0 1.8 5.50 142 142 A 11 ARG H A 23 VAL HGy% 1.0 1.8 5.50 143 143 A 11 ARG H A 10 PHE HBx 1.0 1.8 4.83 144 144 A 11 ARG H A 10 PHE HBy 1.0 1.8 5.04 145 145 A 15 LEU HDy% A 15 LEU HBy 1.0 1.8 3.86 146 146 A 15 LEU HA A 15 LEU HDy% 1.0 1.8 4.33 147 147 A 23 VAL HGy% A 9 ARG HGx 1.0 1.8 5.50 148 148 A 23 VAL HGy% A 9 ARG HGy 1.0 1.8 5.50 149 149 A 10 PHE HBx A 23 VAL HGy% 1.0 1.8 4.06 150 150 A 10 PHE HBx A 23 VAL HGx% 1.0 1.8 4.06 151 151 A 10 PHE HA A 23 VAL HGx% 1.0 1.8 4.25 152 152 A 23 VAL HA A 23 VAL HGx% 1.0 1.8 3.48 153 153 A 10 PHE HA A 23 VAL HGy% 1.0 1.8 4.25 154 154 A 23 VAL H A 22 ASN H 1.0 1.8 3.94 155 155 A 23 VAL H A 20 CYS HA 1.0 1.8 4.24 156 156 A 24 CYS HBy A 21 ALA HA 1.0 1.8 4.24 157 157 A 21 ALA H A 21 ALA HB% 1.0 1.8 3.06 158 158 A 32 GLY H A 21 ALA HA 1.0 1.8 3.56 159 159 A 22 ASN H A 22 ASN HBx 1.0 1.8 3.93 160 160 A 22 ASN H A 22 ASN HBy 1.0 1.8 3.93 161 161 A 22 ASN H A 19 ASN HA 1.0 1.8 4.61 162 162 A 21 ALA H A 19 ASN HA 1.0 1.8 4.93 163 163 A 22 ASN H A 21 ALA H 1.0 1.8 3.73 164 164 A 21 ALA H A 20 CYS H 1.0 1.8 3.78 165 165 A 32 GLY H A 21 ALA H 1.0 1.8 5.50 166 166 A 20 CYS H A 20 CYS HBy 1.0 1.8 3.81 167 167 A 20 CYS H A 20 CYS HBx 1.0 1.8 3.81 168 168 A 34 CYS H A 35 ARG H 1.0 1.8 5.43 169 169 A 35 ARG H A 36 GLY H 1.0 1.8 5.50 170 170 A 36 GLY H A 35 ARG HGx 1.0 1.8 5.50 171 171 A 36 GLY H A 35 ARG HGy 1.0 1.8 5.50 172 172 A 35 ARG H A 35 ARG HGx 1.0 1.8 5.50 173 173 A 35 ARG H A 35 ARG HGy 1.0 1.8 5.50 174 174 A 35 ARG H A 34 CYS HA 1.0 1.8 3.20 175 175 A 37 PHE H A 37 PHE HBy 1.0 1.8 3.76 176 176 A 37 PHE H A 37 PHE HBx 1.0 1.8 3.76 177 177 A 37 PHE H A 38 ARG H 1.0 1.8 4.29 178 178 A 37 PHE H A 37 PHE HD% 1.0 1.8 5.02 179 179 A 37 PHE HD% A 37 PHE HA 1.0 1.8 3.76 180 180 A 38 ARG H A 38 ARG HGx 1.0 1.8 4.61 181 181 A 38 ARG H A 38 ARG HGy 1.0 1.8 4.61 182 182 A 38 ARG H A 38 ARG HBy 1.0 1.8 4.16 183 183 A 38 ARG H A 38 ARG HBx 1.0 1.8 4.16 184 184 A 38 ARG H A 37 PHE HBy 1.0 1.8 4.41 185 185 A 25 ARG H A 22 ASN HA 1.0 1.8 3.70 186 186 A 38 ARG H A 39 ARG H 1.0 1.8 3.88 187 187 A 39 ARG H A 38 ARG HA 1.0 1.8 3.54 188 188 A 39 ARG HE A 39 ARG HBy 1.0 1.8 4.85 189 189 A 39 ARG HE A 39 ARG HBx 1.0 1.8 4.85 190 190 A 39 ARG H A 39 ARG HDx 1.0 1.8 5.50 191 191 A 39 ARG H A 39 ARG HDy 1.0 1.8 5.50 192 192 A 39 ARG HA A 40 ARG H 1.0 1.8 3.39 193 193 A 32 GLY H A 21 ALA HB% 1.0 1.8 3.65 194 194 A 25 ARG H A 27 GLU H 1.0 1.8 4.98 195 195 A 31 GLY H A 30 PRO HGy 1.0 1.8 4.58 196 196 A 24 CYS HBy A 31 GLY H 1.0 1.8 4.58 197 197 A 24 CYS HBx A 31 GLY H 1.0 1.8 5.29 198 198 A 31 GLY H A 44 THR HB 1.0 1.8 4.54 199 199 A 29 PHE HA A 31 GLY H 1.0 1.8 4.88 200 200 A 44 THR H A 31 GLY H 1.0 1.8 4.65 201 201 A 24 CYS H A 24 CYS HBx 1.0 1.8 3.46 202 202 A 24 CYS H A 24 CYS HBy 1.0 1.8 3.89 203 203 A 24 CYS H A 21 ALA HA 1.0 1.8 4.37 204 204 A 24 CYS H A 20 CYS HA 1.0 1.8 4.80 205 205 A 24 CYS H A 22 ASN H 1.0 1.8 5.04 206 206 A 25 ARG H A 21 ALA HA 1.0 1.8 4.84 207 207 A 44 THR HA A 45 THR HG2% 1.0 1.8 4.42 208 208 A 45 THR H A 45 THR HG2% 1.0 1.8 3.65 209 209 A 45 THR H A 44 THR HG2% 1.0 1.8 3.72 210 210 A 45 THR H A 4 GLN HA 1.0 1.8 3.93 211 211 A 7 SER H A 7 SER HBy 1.0 1.8 3.73 212 212 A 7 SER H A 7 SER HBx 1.0 1.8 3.73 213 213 A 6 GLN HA A 7 SER H 1.0 1.8 3.10 214 214 A 7 SER H A 6 GLN HGx 1.0 1.8 5.50 215 215 A 7 SER H A 6 GLN HGy 1.0 1.8 5.50 216 216 A 6 GLN H A 6 GLN HGx 1.0 1.8 5.28 217 217 A 6 GLN H A 6 GLN HGy 1.0 1.8 5.28 218 218 A 6 GLN H A 5 SER HBx 1.0 1.8 5.18 219 219 A 6 GLN H A 5 SER HBy 1.0 1.8 5.18 220 220 A 5 SER HA A 6 GLN H 1.0 1.8 3.05 221 221 A 6 GLN H A 42 PHE HE% 1.0 1.8 4.45 222 222 A 24 CYS H A 10 PHE HD% 1.0 1.8 5.50 223 223 A 42 PHE HD% A 6 GLN H 1.0 1.8 4.61 224 224 A 5 SER H A 6 GLN H 1.0 1.8 5.13 225 225 A 6 GLN HE2y A 6 GLN HBx 1.0 1.8 5.50 226 226 A 6 GLN HE2y A 6 GLN HBy 1.0 1.8 5.50 227 227 A 6 GLN HE2x A 6 GLN HBx 1.0 1.8 5.50 228 228 A 6 GLN HE2x A 6 GLN HBy 1.0 1.8 5.50 229 229 A 15 LEU H A 14 CYS H 1.0 1.8 4.99 230 230 A 45 THR H A 44 THR HA 1.0 1.8 2.93 231 231 A 45 THR H A 46 HIS H 1.0 1.8 4.91 232 232 A 29 PHE HD% A 45 THR HG2% 1.0 1.8 3.90 233 233 A 5 SER H A 45 THR HG2% 1.0 1.8 4.00 234 234 A 45 THR HG2% A 46 HIS H 1.0 1.8 4.02 235 235 A 4 GLN H A 45 THR HG2% 1.0 1.8 4.69 236 236 A 29 PHE HD% A 45 THR HB 1.0 1.8 3.80 237 237 A 29 PHE HE% A 45 THR HB 1.0 1.8 4.10 238 238 A 26 THR H A 24 CYS HBx 1.0 1.8 5.50 239 239 A 29 PHE H A 24 CYS HBx 1.0 1.8 5.50 240 240 A 29 PHE H A 24 CYS HBy 1.0 1.8 4.83 241 241 A 47 CYS H A 46 HIS HBx 1.0 1.8 5.08 242 242 A 47 CYS H A 46 HIS HBy 1.0 1.8 5.08 243 243 A 46 HIS H A 45 THR HB 1.0 1.8 3.78 244 244 A 29 PHE HD% A 46 HIS H 1.0 1.8 5.17 245 245 A 34 CYS HA A 40 ARG H 1.0 1.8 4.97 246 246 A 40 ARG H A 42 PHE HE% 1.0 1.8 4.53 247 247 A 35 ARG H A 39 ARG HA 1.0 1.8 4.80 248 248 A 35 ARG H A 34 CYS HBy 1.0 1.8 4.57 249 249 A 35 ARG H A 34 CYS HBx 1.0 1.8 4.57 250 250 A 42 PHE HD% A 35 ARG H 1.0 1.8 4.24 251 251 A 35 ARG H A 42 PHE HE% 1.0 1.8 5.08 252 252 A 35 ARG H A 40 ARG H 1.0 1.8 3.95 253 253 A 42 PHE H A 41 CYS HBy 1.0 1.8 4.89 254 254 A 42 PHE H A 41 CYS HBx 1.0 1.8 4.89 255 255 A 42 PHE H A 41 CYS HA 1.0 1.8 3.21 256 256 A 41 CYS H A 40 ARG H 1.0 1.8 5.08 257 257 A 41 CYS H A 40 ARG HA 1.0 1.8 3.24 258 258 A 41 CYS H A 41 CYS HBx 1.0 1.8 3.81 259 259 A 41 CYS H A 40 ARG HBx 1.0 1.8 4.48 260 260 A 41 CYS H A 41 CYS HBy 1.0 1.8 3.81 261 261 A 41 CYS H A 40 ARG HBy 1.0 1.8 4.48 262 262 A 33 ARG H A 34 CYS H 1.0 1.8 5.08 263 263 A 47 CYS H A 46 HIS HA 1.0 1.8 3.05 264 264 A 29 PHE HD% A 24 CYS HBy 1.0 1.8 4.35 265 265 A 38 ARG H A 37 PHE HBx 1.0 1.8 4.41 266 266 A 43 CYS H A 42 PHE HBx 1.0 1.8 4.26 267 267 A 5 SER HA A 42 PHE HE% 1.0 1.8 4.66 268 268 A 29 PHE HE% A 24 CYS HA 1.0 1.8 5.29 269 269 A 42 PHE HD% A 40 ARG H 1.0 1.8 5.05 270 270 A 14 CYS H A 40 ARG H 1.0 1.8 5.44 271 271 A 20 CYS H A 19 ASN HBx 1.0 1.8 4.39 272 272 A 20 CYS H A 19 ASN HBy 1.0 1.8 4.39 273 273 A 42 PHE HE% A 40 ARG HBx 1.0 1.8 3.61 274 274 A 34 CYS H A 33 ARG HBy 1.0 1.8 3.95 275 275 A 42 PHE H A 42 PHE HBx 1.0 1.8 4.10 276 276 A 42 PHE H A 42 PHE HBy 1.0 1.8 4.10 277 277 A 10 PHE HBy A 41 CYS H 1.0 1.8 4.74 278 278 A 25 ARG H A 23 VAL HA 1.0 1.8 4.90 279 279 A 26 THR HG2% A 23 VAL HA 1.0 1.8 3.85 280 280 A 23 VAL HB A 10 PHE HBx 1.0 1.8 4.90 281 281 A 44 THR HG2% A 4 GLN HA 1.0 1.8 4.65 282 282 A 4 GLN HA A 45 THR HG2% 1.0 1.8 4.07 283 283 A 24 CYS HBx A 43 CYS HA 1.0 1.8 5.02 284 284 A 26 THR HG2% A 26 THR HA 1.0 1.8 3.35 285 285 A 42 PHE HE% A 40 ARG HBy 1.0 1.8 3.61 286 286 A 42 PHE HE% A 35 ARG HGx 1.0 1.8 5.15 287 287 A 42 PHE HE% A 35 ARG HGy 1.0 1.8 5.15 288 288 A 42 PHE HD% A 4 GLN HBx 1.0 1.8 4.13 289 289 A 42 PHE HD% A 4 GLN HBy 1.0 1.8 4.13 290 290 A 42 PHE HE% A 6 GLN HGx 1.0 1.8 5.50 291 291 A 42 PHE HE% A 6 GLN HGy 1.0 1.8 5.50 292 292 A 6 GLN HA A 42 PHE HE% 1.0 1.8 4.47 293 293 A 42 PHE HD% A 5 SER HBx 1.0 1.8 5.50 294 294 A 42 PHE HD% A 5 SER HBy 1.0 1.8 5.50 295 295 A 42 PHE HD% A 42 PHE HA 1.0 1.8 3.97 296 296 A 4 GLN HA A 42 PHE HD% 1.0 1.8 5.06 297 297 A 14 CYS HA A 10 PHE HE% 1.0 1.8 3.84 298 298 A 14 CYS HA A 10 PHE HD% 1.0 1.8 4.74 299 299 A 10 PHE HE% A 13 PRO HA 1.0 1.8 4.82 300 300 A 10 PHE HD% A 23 VAL HA 1.0 1.8 5.27 301 301 A 10 PHE HE% A 19 ASN HBy 1.0 1.8 4.41 302 302 A 23 VAL HB A 10 PHE HD% 1.0 1.8 3.48 303 303 A 23 VAL HB A 10 PHE HE% 1.0 1.8 4.33 304 304 A 10 PHE HD% A 23 VAL HGy% 1.0 1.8 3.52 305 305 A 10 PHE HE% A 23 VAL HGy% 1.0 1.8 4.98 306 306 A 15 LEU HA A 15 LEU HDx% 1.0 1.8 4.33 307 307 A 15 LEU HBx A 15 LEU HDx% 1.0 1.8 3.86 308 308 A 15 LEU HDy% A 15 LEU HBx 1.0 1.8 3.86 309 309 A 15 LEU HBy A 15 LEU HDx% 1.0 1.8 3.86 310 310 A 23 VAL HA A 23 VAL HGy% 1.0 1.8 3.48 311 311 A 26 THR HG2% A 23 VAL HGy% 1.0 1.8 5.50 312 312 A 9 ARG HGx A 23 VAL HGx% 1.0 1.8 5.50 313 313 A 9 ARG HGy A 23 VAL HGx% 1.0 1.8 5.50 314 314 A 26 THR HG2% A 23 VAL HGx% 1.0 1.8 5.50 315 315 A 24 CYS HBx A 21 ALA HA 1.0 1.8 3.81 316 316 A 37 PHE HA A 37 PHE HE% 1.0 1.8 5.12 317 317 A 38 ARG HA A 38 ARG HDx 1.0 1.8 5.31 318 318 A 38 ARG HA A 38 ARG HDy 1.0 1.8 5.31 319 319 A 39 ARG HA A 39 ARG HDx 1.0 1.8 5.10 320 320 A 39 ARG HA A 39 ARG HDy 1.0 1.8 5.10 321 321 A 29 PHE HE% A 45 THR HA 1.0 1.8 4.84 322 322 A 29 PHE HD% A 24 CYS HA 1.0 1.8 3.95 323 323 A 25 ARG HA A 25 ARG HDx 1.0 1.8 5.50 324 324 A 25 ARG HA A 25 ARG HDy 1.0 1.8 5.50 325 325 A 25 ARG HA A 25 ARG HGx 1.0 1.8 4.25 326 326 A 25 ARG HA A 25 ARG HGy 1.0 1.8 4.25 327 327 A 45 THR HG2% A 45 THR HA 1.0 1.8 3.78 328 328 A 29 PHE HE% A 45 THR HG2% 1.0 1.8 3.88 329 329 A 44 THR HG2% A 4 GLN HGx 1.0 1.8 4.80 330 330 A 44 THR HG2% A 4 GLN HGy 1.0 1.8 4.80 331 331 A 22 ASN HA A 25 ARG HBx 1.0 1.8 4.27 332 332 A 22 ASN HA A 25 ARG HBy 1.0 1.8 4.27 333 333 A 3 CYS H A 3 CYS HBy 1.0 1.8 3.46 334 333 A 3 CYS H A 3 CYS HBx 1.0 1.8 3.46 335 334 A 4 GLN H A 3 CYS HBy 1.0 1.8 3.29 336 334 A 4 GLN H A 3 CYS HBx 1.0 1.8 3.29 337 335 A 45 THR H A 3 CYS HBy 1.0 1.8 4.94 338 335 A 45 THR H A 3 CYS HBx 1.0 1.8 4.94 339 336 A 45 THR HG2% A 3 CYS HBy 1.0 1.8 4.12 340 336 A 45 THR HG2% A 3 CYS HBx 1.0 1.8 4.12 341 337 A 47 CYS H A 3 CYS HBy 1.0 1.8 4.65 342 337 A 47 CYS H A 3 CYS HBx 1.0 1.8 4.65 343 338 A 47 CYS HA A 3 CYS HBy 1.0 1.8 4.43 344 338 A 3 CYS HBx A 47 CYS HA 1.0 1.8 4.43 345 339 A 4 GLN H A 4 GLN HBy 1.0 1.8 3.64 346 339 A 4 GLN H A 4 GLN HBx 1.0 1.8 3.64 347 340 A 4 GLN H A 4 GLN HGy 1.0 1.8 3.79 348 340 A 4 GLN H A 4 GLN HGx 1.0 1.8 3.79 349 341 A 4 GLN HA A 5 SER HBy 1.0 1.8 4.77 350 341 A 4 GLN HA A 5 SER HBx 1.0 1.8 4.77 351 342 A 5 SER H A 4 GLN HBy 1.0 1.8 4.02 352 342 A 5 SER H A 4 GLN HBx 1.0 1.8 4.02 353 343 A 4 GLN HBy A 42 PHE HBy 1.0 1.8 3.87 354 343 A 42 PHE HBx A 4 GLN HBy 1.0 1.8 3.87 355 343 A 4 GLN HBx A 42 PHE HBx 1.0 1.8 3.87 356 343 A 4 GLN HBx A 42 PHE HBy 1.0 1.8 3.87 357 344 A 42 PHE HD% A 4 GLN HBy 1.0 1.8 3.60 358 344 A 42 PHE HD% A 4 GLN HBx 1.0 1.8 3.60 359 345 A 42 PHE HE% A 4 GLN HBy 1.0 1.8 4.93 360 345 A 42 PHE HE% A 4 GLN HBx 1.0 1.8 4.93 361 346 A 4 GLN HGy A 42 PHE HBy 1.0 1.8 4.85 362 346 A 4 GLN HGx A 42 PHE HBy 1.0 1.8 4.85 363 346 A 42 PHE HBx A 4 GLN HGy 1.0 1.8 4.85 364 346 A 4 GLN HGx A 42 PHE HBx 1.0 1.8 4.85 365 347 A 42 PHE HD% A 4 GLN HGy 1.0 1.8 4.41 366 347 A 42 PHE HD% A 4 GLN HGx 1.0 1.8 4.41 367 348 A 44 THR HG2% A 4 GLN HGy 1.0 1.8 4.19 368 348 A 44 THR HG2% A 4 GLN HGx 1.0 1.8 4.19 369 349 A 44 THR HG2% A 4 GLN HE2y 1.0 1.8 4.68 370 349 A 44 THR HG2% A 4 GLN HE2x 1.0 1.8 4.68 371 350 A 5 SER H A 5 SER HBy 1.0 1.8 3.55 372 350 A 5 SER H A 5 SER HBx 1.0 1.8 3.55 373 351 A 5 SER H A 42 PHE HBy 1.0 1.8 4.62 374 351 A 5 SER H A 42 PHE HBx 1.0 1.8 4.62 375 352 A 29 PHE HE% A 5 SER HBy 1.0 1.8 4.29 376 352 A 29 PHE HE% A 5 SER HBx 1.0 1.8 4.29 377 353 A 43 CYS H A 5 SER HBy 1.0 1.8 4.83 378 353 A 43 CYS H A 5 SER HBx 1.0 1.8 4.83 379 354 A 45 THR HG2% A 5 SER HBy 1.0 1.8 3.85 380 354 A 45 THR HG2% A 5 SER HBx 1.0 1.8 3.85 381 355 A 6 GLN H A 6 GLN HBy 1.0 1.8 3.08 382 355 A 6 GLN H A 6 GLN HBx 1.0 1.8 3.08 383 356 A 6 GLN H A 6 GLN HGy 1.0 1.8 4.52 384 356 A 6 GLN H A 6 GLN HGx 1.0 1.8 4.52 385 357 A 6 GLN HA A 42 PHE HBy 1.0 1.8 5.09 386 357 A 6 GLN HA A 42 PHE HBx 1.0 1.8 5.09 387 358 A 6 GLN HE2y A 6 GLN HBx 1.0 1.8 4.03 388 358 A 6 GLN HE2x A 6 GLN HBx 1.0 1.8 4.03 389 358 A 6 GLN HE2x A 6 GLN HBy 1.0 1.8 4.03 390 358 A 6 GLN HE2y A 6 GLN HBy 1.0 1.8 4.03 391 359 A 7 SER H A 6 GLN HBy 1.0 1.8 3.73 392 359 A 7 SER H A 6 GLN HBx 1.0 1.8 3.73 393 360 A 42 PHE HE% A 6 GLN HBy 1.0 1.8 3.11 394 360 A 42 PHE HE% A 6 GLN HBx 1.0 1.8 3.11 395 361 A 7 SER H A 6 GLN HGy 1.0 1.8 4.76 396 361 A 7 SER H A 6 GLN HGx 1.0 1.8 4.76 397 362 A 7 SER H A 7 SER HBy 1.0 1.8 3.18 398 362 A 7 SER H A 7 SER HBx 1.0 1.8 3.18 399 363 A 9 ARG H A 7 SER HBy 1.0 1.8 5.30 400 363 A 9 ARG H A 7 SER HBx 1.0 1.8 5.30 401 364 A 10 PHE H A 7 SER HBy 1.0 1.8 4.21 402 364 A 10 PHE H A 7 SER HBx 1.0 1.8 4.21 403 365 A 10 PHE HBx A 7 SER HBy 1.0 1.8 4.08 404 365 A 10 PHE HBx A 7 SER HBx 1.0 1.8 4.08 405 366 A 10 PHE HBy A 7 SER HBy 1.0 1.8 4.34 406 366 A 10 PHE HBy A 7 SER HBx 1.0 1.8 4.34 407 367 A 10 PHE HD% A 7 SER HBy 1.0 1.8 4.78 408 367 A 10 PHE HD% A 7 SER HBx 1.0 1.8 4.78 409 368 A 7 SER HBx A 41 CYS HBy 1.0 1.8 3.79 410 368 A 41 CYS HBx A 7 SER HBy 1.0 1.8 3.79 411 368 A 7 SER HBx A 41 CYS HBx 1.0 1.8 3.79 412 368 A 7 SER HBy A 41 CYS HBy 1.0 1.8 3.79 413 369 A 8 HIS H A 8 HIS HBy 1.0 1.8 3.56 414 369 A 8 HIS H A 8 HIS HBx 1.0 1.8 3.56 415 370 A 8 HIS HD2 A 8 HIS HBy 1.0 1.8 3.39 416 370 A 8 HIS HBx A 8 HIS HD2 1.0 1.8 3.39 417 371 A 9 ARG H A 8 HIS HBy 1.0 1.8 3.86 418 371 A 9 ARG H A 8 HIS HBx 1.0 1.8 3.86 419 372 A 8 HIS HBy A 23 VAL HGx% 1.0 1.8 5.28 420 372 A 8 HIS HBx A 23 VAL HGx% 1.0 1.8 5.28 421 372 A 23 VAL HGy% A 8 HIS HBy 1.0 1.8 5.28 422 372 A 8 HIS HBx A 23 VAL HGy% 1.0 1.8 5.28 423 373 A 9 ARG H A 9 ARG HGy 1.0 1.8 3.53 424 373 A 9 ARG H A 9 ARG HGx 1.0 1.8 3.53 425 374 A 9 ARG H A 23 VAL HGx% 1.0 1.8 4.44 426 374 A 9 ARG H A 23 VAL HGy% 1.0 1.8 4.44 427 375 A 9 ARG HA A 9 ARG HGy 1.0 1.8 3.62 428 375 A 9 ARG HGx A 9 ARG HA 1.0 1.8 3.62 429 376 A 9 ARG HA A 9 ARG HDx 1.0 1.8 4.55 430 376 A 9 ARG HA A 9 ARG HDy 1.0 1.8 4.55 431 377 A 9 ARG HA A 23 VAL HGx% 1.0 1.8 5.44 432 377 A 23 VAL HGy% A 9 ARG HA 1.0 1.8 5.44 433 378 A 10 PHE H A 9 ARG HBx 1.0 1.8 4.43 434 378 A 10 PHE H A 9 ARG HBy 1.0 1.8 4.43 435 379 A 9 ARG HBx A 23 VAL HGx% 1.0 1.8 4.05 436 379 A 9 ARG HBy A 23 VAL HGx% 1.0 1.8 4.05 437 379 A 23 VAL HGy% A 9 ARG HBx 1.0 1.8 4.05 438 379 A 23 VAL HGy% A 9 ARG HBy 1.0 1.8 4.05 439 380 A 10 PHE H A 9 ARG HGy 1.0 1.8 4.62 440 380 A 10 PHE H A 9 ARG HGx 1.0 1.8 4.62 441 381 A 9 ARG HGy A 23 VAL HGx% 1.0 1.8 3.88 442 381 A 9 ARG HGx A 23 VAL HGx% 1.0 1.8 3.88 443 381 A 23 VAL HGy% A 9 ARG HGy 1.0 1.8 3.88 444 381 A 23 VAL HGy% A 9 ARG HGx 1.0 1.8 3.88 445 382 A 9 ARG HDx A 23 VAL HGx% 1.0 1.8 4.08 446 382 A 9 ARG HDy A 23 VAL HGx% 1.0 1.8 4.08 447 382 A 23 VAL HGy% A 9 ARG HDx 1.0 1.8 4.08 448 382 A 23 VAL HGy% A 9 ARG HDy 1.0 1.8 4.08 449 383 A 27 GLU HA A 9 ARG HDx 1.0 1.8 5.34 450 383 A 27 GLU HA A 9 ARG HDy 1.0 1.8 5.34 451 384 A 9 ARG HDx A 27 GLU HBy 1.0 1.8 4.13 452 384 A 9 ARG HDy A 27 GLU HBy 1.0 1.8 4.13 453 384 A 27 GLU HBx A 9 ARG HDx 1.0 1.8 4.13 454 384 A 9 ARG HDy A 27 GLU HBx 1.0 1.8 4.13 455 385 A 9 ARG HDy A 27 GLU HGy 1.0 1.8 4.61 456 385 A 27 GLU HGx A 9 ARG HDx 1.0 1.8 4.61 457 385 A 9 ARG HDy A 27 GLU HGx 1.0 1.8 4.61 458 385 A 9 ARG HDx A 27 GLU HGy 1.0 1.8 4.61 459 386 A 10 PHE H A 23 VAL HGx% 1.0 1.8 3.81 460 386 A 10 PHE H A 23 VAL HGy% 1.0 1.8 3.81 461 387 A 10 PHE HA A 23 VAL HGx% 1.0 1.8 3.42 462 387 A 10 PHE HA A 23 VAL HGy% 1.0 1.8 3.42 463 388 A 10 PHE HBx A 23 VAL HGx% 1.0 1.8 3.38 464 388 A 10 PHE HBx A 23 VAL HGy% 1.0 1.8 3.38 465 389 A 10 PHE HBx A 41 CYS HBy 1.0 1.8 4.39 466 389 A 10 PHE HBx A 41 CYS HBx 1.0 1.8 4.39 467 390 A 10 PHE HBy A 41 CYS HBy 1.0 1.8 4.62 468 390 A 10 PHE HBy A 41 CYS HBx 1.0 1.8 4.62 469 391 A 10 PHE HD% A 11 ARG HGx 1.0 1.8 5.01 470 391 A 10 PHE HD% A 11 ARG HGy 1.0 1.8 5.01 471 392 A 10 PHE HD% A 14 CYS HBx 1.0 1.8 5.10 472 392 A 10 PHE HD% A 14 CYS HBy 1.0 1.8 5.10 473 393 A 10 PHE HD% A 19 ASN HBx 1.0 1.8 4.69 474 393 A 10 PHE HD% A 19 ASN HBy 1.0 1.8 4.69 475 394 A 10 PHE HD% A 20 CYS HBy 1.0 1.8 4.86 476 394 A 10 PHE HD% A 20 CYS HBx 1.0 1.8 4.86 477 395 A 10 PHE HD% A 23 VAL HGx% 1.0 1.8 2.98 478 395 A 10 PHE HD% A 23 VAL HGy% 1.0 1.8 2.98 479 396 A 10 PHE HE% A 11 ARG HGx 1.0 1.8 5.34 480 396 A 10 PHE HE% A 11 ARG HGy 1.0 1.8 5.34 481 397 A 10 PHE HE% A 14 CYS HBx 1.0 1.8 4.10 482 397 A 10 PHE HE% A 14 CYS HBy 1.0 1.8 4.10 483 398 A 10 PHE HE% A 19 ASN HBx 1.0 1.8 3.76 484 398 A 10 PHE HE% A 19 ASN HBy 1.0 1.8 3.76 485 399 A 10 PHE HE% A 20 CYS HBy 1.0 1.8 4.35 486 399 A 10 PHE HE% A 20 CYS HBx 1.0 1.8 4.35 487 400 A 10 PHE HE% A 23 VAL HGx% 1.0 1.8 3.69 488 400 A 10 PHE HE% A 23 VAL HGy% 1.0 1.8 3.69 489 401 A 10 PHE HE% A 41 CYS HBy 1.0 1.8 4.20 490 401 A 10 PHE HE% A 41 CYS HBx 1.0 1.8 4.20 491 402 A 11 ARG H A 11 ARG HGx 1.0 1.8 3.53 492 402 A 11 ARG H A 11 ARG HGy 1.0 1.8 3.53 493 403 A 11 ARG H A 23 VAL HGx% 1.0 1.8 4.72 494 403 A 11 ARG H A 23 VAL HGy% 1.0 1.8 4.72 495 404 A 11 ARG HA A 11 ARG HDx 1.0 1.8 4.17 496 404 A 11 ARG HA A 11 ARG HDy 1.0 1.8 4.17 497 405 A 12 GLY H A 11 ARG HBy 1.0 1.8 4.02 498 405 A 12 GLY H A 11 ARG HBx 1.0 1.8 4.02 499 406 A 12 GLY H A 11 ARG HGx 1.0 1.8 4.90 500 406 A 12 GLY H A 11 ARG HGy 1.0 1.8 4.90 501 407 A 12 GLY HAy A 13 PRO HDy 1.0 1.8 2.84 502 407 A 12 GLY HAx A 13 PRO HDy 1.0 1.8 2.84 503 407 A 13 PRO HDx A 12 GLY HAx 1.0 1.8 2.84 504 407 A 12 GLY HAy A 13 PRO HDx 1.0 1.8 2.84 505 408 A 13 PRO HA A 39 ARG HBy 1.0 1.8 4.23 506 408 A 13 PRO HA A 39 ARG HBx 1.0 1.8 4.23 507 409 A 14 CYS H A 13 PRO HBx 1.0 1.8 3.98 508 409 A 14 CYS H A 13 PRO HBy 1.0 1.8 3.98 509 410 A 13 PRO HBy A 15 LEU HDx% 1.0 1.8 4.27 510 410 A 13 PRO HBx A 15 LEU HDx% 1.0 1.8 4.27 511 410 A 15 LEU HDy% A 13 PRO HBx 1.0 1.8 4.27 512 410 A 13 PRO HBy A 15 LEU HDy% 1.0 1.8 4.27 513 411 A 14 CYS H A 14 CYS HBx 1.0 1.8 3.46 514 411 A 14 CYS H A 14 CYS HBy 1.0 1.8 3.46 515 412 A 14 CYS H A 39 ARG HBy 1.0 1.8 3.96 516 412 A 14 CYS H A 39 ARG HBx 1.0 1.8 3.96 517 413 A 41 CYS H A 14 CYS HBx 1.0 1.8 4.57 518 413 A 41 CYS H A 14 CYS HBy 1.0 1.8 4.57 519 414 A 15 LEU H A 15 LEU HBy 1.0 1.8 3.28 520 414 A 15 LEU H A 15 LEU HBx 1.0 1.8 3.28 521 415 A 15 LEU HA A 15 LEU HDx% 1.0 1.8 3.10 522 415 A 15 LEU HA A 15 LEU HDy% 1.0 1.8 3.10 523 416 A 15 LEU HBy A 15 LEU HDx% 1.0 1.8 2.78 524 416 A 15 LEU HBx A 15 LEU HDx% 1.0 1.8 2.78 525 416 A 15 LEU HDy% A 15 LEU HBy 1.0 1.8 2.78 526 416 A 15 LEU HDy% A 15 LEU HBx 1.0 1.8 2.78 527 417 A 16 ARG H A 15 LEU HBy 1.0 1.8 3.59 528 417 A 16 ARG H A 15 LEU HBx 1.0 1.8 3.59 529 418 A 15 LEU HDy% A 39 ARG HBy 1.0 1.8 4.39 530 418 A 39 ARG HBx A 15 LEU HDx% 1.0 1.8 4.39 531 418 A 39 ARG HBx A 15 LEU HDy% 1.0 1.8 4.39 532 418 A 15 LEU HDx% A 39 ARG HBy 1.0 1.8 4.39 533 419 A 15 LEU HDx% A 39 ARG HDy 1.0 1.8 3.82 534 419 A 15 LEU HDy% A 39 ARG HDy 1.0 1.8 3.82 535 419 A 39 ARG HDx A 15 LEU HDx% 1.0 1.8 3.82 536 419 A 15 LEU HDy% A 39 ARG HDx 1.0 1.8 3.82 537 420 A 16 ARG H A 16 ARG HBx 1.0 1.8 3.49 538 420 A 16 ARG H A 16 ARG HBy 1.0 1.8 3.49 539 421 A 16 ARG H A 16 ARG HGx 1.0 1.8 4.46 540 421 A 16 ARG H A 16 ARG HGy 1.0 1.8 4.46 541 422 A 16 ARG HBx A 16 ARG HDx 1.0 1.8 3.32 542 422 A 16 ARG HBy A 16 ARG HDx 1.0 1.8 3.32 543 422 A 16 ARG HDy A 16 ARG HBx 1.0 1.8 3.32 544 422 A 16 ARG HBy A 16 ARG HDy 1.0 1.8 3.32 545 423 A 19 ASN HA A 19 ASN HD2x 1.0 1.8 4.29 546 423 A 19 ASN HA A 19 ASN HD2y 1.0 1.8 4.29 547 424 A 19 ASN HBx A 19 ASN HD2x 1.0 1.8 3.22 548 424 A 19 ASN HBy A 19 ASN HD2x 1.0 1.8 3.22 549 424 A 19 ASN HD2y A 19 ASN HBx 1.0 1.8 3.22 550 424 A 19 ASN HBy A 19 ASN HD2y 1.0 1.8 3.22 551 425 A 22 ASN H A 19 ASN HBx 1.0 1.8 5.34 552 425 A 22 ASN H A 19 ASN HBy 1.0 1.8 5.34 553 426 A 19 ASN HBy A 23 VAL HGx% 1.0 1.8 4.67 554 426 A 23 VAL HGy% A 19 ASN HBx 1.0 1.8 4.67 555 426 A 23 VAL HGy% A 19 ASN HBy 1.0 1.8 4.67 556 426 A 19 ASN HBx A 23 VAL HGx% 1.0 1.8 4.67 557 427 A 20 CYS HA A 23 VAL HGx% 1.0 1.8 4.37 558 427 A 20 CYS HA A 23 VAL HGy% 1.0 1.8 4.37 559 428 A 21 ALA H A 20 CYS HBy 1.0 1.8 3.69 560 428 A 21 ALA H A 20 CYS HBx 1.0 1.8 3.69 561 429 A 21 ALA HA A 31 GLY HAx 1.0 1.8 5.06 562 429 A 21 ALA HA A 31 GLY HAy 1.0 1.8 5.06 563 430 A 21 ALA HA A 32 GLY HAx 1.0 1.8 4.13 564 430 A 21 ALA HA A 32 GLY HAy 1.0 1.8 4.13 565 431 A 21 ALA HB% A 31 GLY HAx 1.0 1.8 3.92 566 431 A 21 ALA HB% A 31 GLY HAy 1.0 1.8 3.92 567 432 A 22 ASN H A 22 ASN HBx 1.0 1.8 3.37 568 432 A 22 ASN H A 22 ASN HBy 1.0 1.8 3.37 569 433 A 22 ASN H A 22 ASN HD2x 1.0 1.8 4.72 570 433 A 22 ASN H A 22 ASN HD2y 1.0 1.8 4.72 571 434 A 22 ASN HA A 22 ASN HD2x 1.0 1.8 4.30 572 434 A 22 ASN HA A 22 ASN HD2y 1.0 1.8 4.30 573 435 A 22 ASN HA A 25 ARG HBy 1.0 1.8 3.75 574 435 A 22 ASN HA A 25 ARG HBx 1.0 1.8 3.75 575 436 A 23 VAL H A 22 ASN HBx 1.0 1.8 3.80 576 436 A 23 VAL H A 22 ASN HBy 1.0 1.8 3.80 577 437 A 23 VAL H A 23 VAL HGx% 1.0 1.8 3.31 578 437 A 23 VAL H A 23 VAL HGy% 1.0 1.8 3.31 579 438 A 23 VAL HA A 23 VAL HGx% 1.0 1.8 2.96 580 438 A 23 VAL HA A 23 VAL HGy% 1.0 1.8 2.96 581 439 A 24 CYS H A 23 VAL HGx% 1.0 1.8 3.84 582 439 A 24 CYS H A 23 VAL HGy% 1.0 1.8 3.84 583 440 A 24 CYS HA A 23 VAL HGx% 1.0 1.8 4.68 584 440 A 24 CYS HA A 23 VAL HGy% 1.0 1.8 4.68 585 441 A 24 CYS HBx A 23 VAL HGx% 1.0 1.8 5.44 586 441 A 24 CYS HBx A 23 VAL HGy% 1.0 1.8 5.44 587 442 A 26 THR H A 23 VAL HGx% 1.0 1.8 5.20 588 442 A 26 THR H A 23 VAL HGy% 1.0 1.8 5.20 589 443 A 26 THR HG2% A 23 VAL HGx% 1.0 1.8 4.56 590 443 A 26 THR HG2% A 23 VAL HGy% 1.0 1.8 4.56 591 444 A 27 GLU H A 23 VAL HGx% 1.0 1.8 5.00 592 444 A 27 GLU H A 23 VAL HGy% 1.0 1.8 5.00 593 445 A 27 GLU HA A 23 VAL HGx% 1.0 1.8 5.44 594 445 A 27 GLU HA A 23 VAL HGy% 1.0 1.8 5.44 595 446 A 23 VAL HGx% A 27 GLU HBy 1.0 1.8 4.70 596 446 A 23 VAL HGy% A 27 GLU HBy 1.0 1.8 4.70 597 446 A 27 GLU HBx A 23 VAL HGx% 1.0 1.8 4.70 598 446 A 23 VAL HGy% A 27 GLU HBx 1.0 1.8 4.70 599 447 A 23 VAL HGx% A 27 GLU HGy 1.0 1.8 4.29 600 447 A 23 VAL HGy% A 27 GLU HGy 1.0 1.8 4.29 601 447 A 27 GLU HGx A 23 VAL HGx% 1.0 1.8 4.29 602 447 A 23 VAL HGy% A 27 GLU HGx 1.0 1.8 4.29 603 448 A 24 CYS HA A 27 GLU HGy 1.0 1.8 4.18 604 448 A 24 CYS HA A 27 GLU HGx 1.0 1.8 4.18 605 449 A 24 CYS HBx A 29 PHE HBy 1.0 1.8 4.38 606 449 A 24 CYS HBx A 29 PHE HBx 1.0 1.8 4.38 607 450 A 24 CYS HBy A 29 PHE HBy 1.0 1.8 4.26 608 450 A 24 CYS HBy A 29 PHE HBx 1.0 1.8 4.26 609 451 A 24 CYS HBy A 43 CYS HBy 1.0 1.8 4.70 610 451 A 24 CYS HBy A 43 CYS HBx 1.0 1.8 4.70 611 452 A 25 ARG H A 25 ARG HBy 1.0 1.8 3.17 612 452 A 25 ARG H A 25 ARG HBx 1.0 1.8 3.17 613 453 A 25 ARG HA A 25 ARG HGy 1.0 1.8 3.71 614 453 A 25 ARG HA A 25 ARG HGx 1.0 1.8 3.71 615 454 A 25 ARG HA A 25 ARG HDy 1.0 1.8 4.74 616 454 A 25 ARG HA A 25 ARG HDx 1.0 1.8 4.74 617 455 A 25 ARG HBx A 25 ARG HDy 1.0 1.8 3.30 618 455 A 25 ARG HDx A 25 ARG HBy 1.0 1.8 3.30 619 455 A 25 ARG HBx A 25 ARG HDx 1.0 1.8 3.30 620 455 A 25 ARG HBy A 25 ARG HDy 1.0 1.8 3.30 621 456 A 27 GLU H A 27 GLU HGy 1.0 1.8 3.13 622 456 A 27 GLU H A 27 GLU HGx 1.0 1.8 3.13 623 457 A 27 GLU HA A 27 GLU HGy 1.0 1.8 3.32 624 457 A 27 GLU HA A 27 GLU HGx 1.0 1.8 3.32 625 458 A 29 PHE H A 29 PHE HBy 1.0 1.8 3.45 626 458 A 29 PHE H A 29 PHE HBx 1.0 1.8 3.45 627 459 A 29 PHE HA A 30 PRO HDx 1.0 1.8 3.17 628 459 A 29 PHE HA A 30 PRO HDy 1.0 1.8 3.17 629 460 A 29 PHE HBy A 30 PRO HDx 1.0 1.8 4.04 630 460 A 29 PHE HBx A 30 PRO HDx 1.0 1.8 4.04 631 460 A 30 PRO HDy A 29 PHE HBy 1.0 1.8 4.04 632 460 A 29 PHE HBx A 30 PRO HDy 1.0 1.8 4.04 633 461 A 31 GLY H A 29 PHE HBy 1.0 1.8 3.99 634 461 A 31 GLY H A 29 PHE HBx 1.0 1.8 3.99 635 462 A 45 THR HG2% A 29 PHE HBy 1.0 1.8 5.34 636 462 A 45 THR HG2% A 29 PHE HBx 1.0 1.8 5.34 637 463 A 29 PHE HD% A 30 PRO HDx 1.0 1.8 3.83 638 463 A 29 PHE HD% A 30 PRO HDy 1.0 1.8 3.83 639 464 A 29 PHE HD% A 43 CYS HBy 1.0 1.8 3.95 640 464 A 29 PHE HD% A 43 CYS HBx 1.0 1.8 3.95 641 465 A 29 PHE HE% A 30 PRO HDx 1.0 1.8 4.69 642 465 A 29 PHE HE% A 30 PRO HDy 1.0 1.8 4.69 643 466 A 31 GLY H A 30 PRO HGy 1.0 1.8 3.79 644 466 A 31 GLY H A 30 PRO HGx 1.0 1.8 3.79 645 467 A 44 THR HB A 30 PRO HGy 1.0 1.8 4.47 646 467 A 44 THR HB A 30 PRO HGx 1.0 1.8 4.47 647 468 A 44 THR HG2% A 30 PRO HGy 1.0 1.8 4.92 648 468 A 44 THR HG2% A 30 PRO HGx 1.0 1.8 4.92 649 469 A 31 GLY H A 30 PRO HDx 1.0 1.8 3.67 650 469 A 31 GLY H A 30 PRO HDy 1.0 1.8 3.67 651 470 A 45 THR HA A 30 PRO HDx 1.0 1.8 4.66 652 470 A 45 THR HA A 30 PRO HDy 1.0 1.8 4.66 653 471 A 45 THR HB A 30 PRO HDx 1.0 1.8 4.77 654 471 A 45 THR HB A 30 PRO HDy 1.0 1.8 4.77 655 472 A 43 CYS HA A 32 GLY HAx 1.0 1.8 4.58 656 472 A 43 CYS HA A 32 GLY HAy 1.0 1.8 4.58 657 473 A 44 THR H A 32 GLY HAx 1.0 1.8 4.47 658 473 A 44 THR H A 32 GLY HAy 1.0 1.8 4.47 659 474 A 33 ARG H A 33 ARG HGx 1.0 1.8 4.67 660 474 A 33 ARG H A 33 ARG HGy 1.0 1.8 4.67 661 475 A 33 ARG H A 33 ARG HDx 1.0 1.8 4.73 662 475 A 33 ARG H A 33 ARG HDy 1.0 1.8 4.73 663 476 A 33 ARG HBx A 33 ARG HDx 1.0 1.8 3.31 664 476 A 33 ARG HBy A 33 ARG HDx 1.0 1.8 3.31 665 476 A 33 ARG HDy A 33 ARG HBy 1.0 1.8 3.31 666 476 A 33 ARG HDy A 33 ARG HBx 1.0 1.8 3.31 667 477 A 33 ARG HE A 33 ARG HBy 1.0 1.8 4.75 668 477 A 33 ARG HBx A 33 ARG HE 1.0 1.8 4.75 669 478 A 34 CYS H A 33 ARG HBy 1.0 1.8 3.31 670 478 A 34 CYS H A 33 ARG HBx 1.0 1.8 3.31 671 479 A 34 CYS H A 34 CYS HBy 1.0 1.8 3.43 672 479 A 34 CYS H A 34 CYS HBx 1.0 1.8 3.43 673 480 A 35 ARG H A 34 CYS HBy 1.0 1.8 3.79 674 480 A 35 ARG H A 34 CYS HBx 1.0 1.8 3.79 675 481 A 35 ARG H A 35 ARG HBx 1.0 1.8 3.64 676 481 A 35 ARG H A 35 ARG HBy 1.0 1.8 3.64 677 482 A 35 ARG H A 35 ARG HGy 1.0 1.8 4.72 678 482 A 35 ARG H A 35 ARG HGx 1.0 1.8 4.72 679 483 A 36 GLY H A 35 ARG HBx 1.0 1.8 4.18 680 483 A 36 GLY H A 35 ARG HBy 1.0 1.8 4.18 681 484 A 42 PHE HD% A 35 ARG HBx 1.0 1.8 3.90 682 484 A 42 PHE HD% A 35 ARG HBy 1.0 1.8 3.90 683 485 A 36 GLY H A 35 ARG HGy 1.0 1.8 4.66 684 485 A 36 GLY H A 35 ARG HGx 1.0 1.8 4.66 685 486 A 42 PHE HE% A 35 ARG HGy 1.0 1.8 4.42 686 486 A 42 PHE HE% A 35 ARG HGx 1.0 1.8 4.42 687 487 A 42 PHE HE% A 35 ARG HDx 1.0 1.8 5.16 688 487 A 42 PHE HE% A 35 ARG HDy 1.0 1.8 5.16 689 488 A 37 PHE H A 37 PHE HBy 1.0 1.8 3.28 690 488 A 37 PHE H A 37 PHE HBx 1.0 1.8 3.28 691 489 A 38 ARG H A 37 PHE HBy 1.0 1.8 3.82 692 489 A 38 ARG H A 37 PHE HBx 1.0 1.8 3.82 693 490 A 39 ARG H A 37 PHE HBy 1.0 1.8 5.34 694 490 A 39 ARG H A 37 PHE HBx 1.0 1.8 5.34 695 491 A 37 PHE HD% A 38 ARG HGy 1.0 1.8 4.34 696 491 A 37 PHE HD% A 38 ARG HGx 1.0 1.8 4.34 697 492 A 37 PHE HE% A 38 ARG HGy 1.0 1.8 5.34 698 492 A 37 PHE HE% A 38 ARG HGx 1.0 1.8 5.34 699 493 A 38 ARG H A 38 ARG HBy 1.0 1.8 3.50 700 493 A 38 ARG H A 38 ARG HBx 1.0 1.8 3.50 701 494 A 38 ARG H A 38 ARG HGy 1.0 1.8 3.80 702 494 A 38 ARG H A 38 ARG HGx 1.0 1.8 3.80 703 495 A 38 ARG HA A 38 ARG HGy 1.0 1.8 3.72 704 495 A 38 ARG HA A 38 ARG HGx 1.0 1.8 3.72 705 496 A 38 ARG HA A 38 ARG HDy 1.0 1.8 4.58 706 496 A 38 ARG HA A 38 ARG HDx 1.0 1.8 4.58 707 497 A 39 ARG HA A 39 ARG HGx 1.0 1.8 3.47 708 497 A 39 ARG HA A 39 ARG HGy 1.0 1.8 3.47 709 498 A 39 ARG HBx A 39 ARG HDy 1.0 1.8 3.23 710 498 A 39 ARG HBy A 39 ARG HDy 1.0 1.8 3.23 711 498 A 39 ARG HDx A 39 ARG HBy 1.0 1.8 3.23 712 498 A 39 ARG HBx A 39 ARG HDx 1.0 1.8 3.23 713 499 A 39 ARG HE A 39 ARG HBy 1.0 1.8 4.17 714 499 A 39 ARG HE A 39 ARG HBx 1.0 1.8 4.17 715 500 A 40 ARG H A 40 ARG HBy 1.0 1.8 3.34 716 500 A 40 ARG H A 40 ARG HBx 1.0 1.8 3.34 717 501 A 41 CYS H A 40 ARG HBy 1.0 1.8 3.90 718 501 A 41 CYS H A 40 ARG HBx 1.0 1.8 3.90 719 502 A 42 PHE HE% A 40 ARG HBy 1.0 1.8 3.02 720 502 A 42 PHE HE% A 40 ARG HBx 1.0 1.8 3.02 721 503 A 41 CYS H A 40 ARG HGy 1.0 1.8 4.84 722 503 A 41 CYS H A 40 ARG HGx 1.0 1.8 4.84 723 504 A 41 CYS H A 41 CYS HBy 1.0 1.8 3.28 724 504 A 41 CYS H A 41 CYS HBx 1.0 1.8 3.28 725 505 A 42 PHE H A 41 CYS HBy 1.0 1.8 4.22 726 505 A 42 PHE H A 41 CYS HBx 1.0 1.8 4.22 727 506 A 42 PHE H A 42 PHE HBy 1.0 1.8 3.39 728 506 A 42 PHE H A 42 PHE HBx 1.0 1.8 3.39 729 507 A 43 CYS H A 42 PHE HBy 1.0 1.8 3.71 730 507 A 43 CYS H A 42 PHE HBx 1.0 1.8 3.71 731 508 A 43 CYS H A 43 CYS HBy 1.0 1.8 3.36 732 508 A 43 CYS H A 43 CYS HBx 1.0 1.8 3.36 733 509 A 44 THR H A 43 CYS HBy 1.0 1.8 3.97 734 509 A 44 THR H A 43 CYS HBx 1.0 1.8 3.97 735 510 A 46 HIS H A 46 HIS HBy 1.0 1.8 3.17 736 510 A 46 HIS H A 46 HIS HBx 1.0 1.8 3.17 737 511 A 47 CYS H A 46 HIS HBy 1.0 1.8 4.45 738 511 A 47 CYS H A 46 HIS HBx 1.0 1.8 4.45 739 512 A 47 CYS H A 47 CYS HBx 1.0 1.8 3.46 740 512 A 47 CYS H A 47 CYS HBy 1.0 1.8 3.46 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _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 22 ASN H A 18 SER O 1.0 0.0 2.0 2 2 A 18 SER O A 22 ASN N 1.0 0.0 3.0 3 3 A 24 CYS H A 20 CYS O 1.0 0.0 2.0 4 4 A 20 CYS O A 24 CYS N 1.0 0.0 3.0 5 5 A 25 ARG H A 21 ALA O 1.0 0.0 2.0 6 6 A 21 ALA O A 25 ARG N 1.0 0.0 3.0 7 7 A 26 THR H A 22 ASN O 1.0 0.0 2.0 8 8 A 22 ASN O A 26 THR N 1.0 0.0 3.0 9 9 A 27 GLU H A 23 VAL O 1.0 0.0 2.0 10 10 A 23 VAL O A 27 GLU N 1.0 0.0 3.0 11 11 A 29 PHE H A 24 CYS O 1.0 0.0 2.0 12 12 A 24 CYS O A 29 PHE N 1.0 0.0 3.0 13 13 A 33 ARG H A 42 PHE O 1.0 0.0 2.0 14 14 A 42 PHE O A 33 ARG N 1.0 0.0 3.0 15 15 A 42 PHE H A 33 ARG O 1.0 0.0 2.0 16 16 A 33 ARG O A 42 PHE N 1.0 0.0 3.0 17 17 A 43 CYS H A 5 SER O 1.0 0.0 2.0 18 18 A 5 SER O A 43 CYS N 1.0 0.0 3.0 19 19 A 45 THR H A 3 CYS O 1.0 0.0 2.0 20 20 A 3 CYS O A 45 THR N 1.0 0.0 3.0 21 21 A 5 SER H A 43 CYS O 1.0 0.0 2.0 22 22 A 43 CYS O A 5 SER N 1.0 0.0 3.0 23 23 A 44 THR H A 31 GLY O 1.0 0.0 2.0 24 24 A 31 GLY O A 44 THR N 1.0 0.0 3.0 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 1 ARG C A 2 THR N A 2 THR CA A 2 THR C 1.0 -135.0 -75.0 PHI 2 2 A 2 THR N A 2 THR CA A 2 THR C A 3 CYS N 1.0 110.0 170.0 PSI 3 3 A 2 THR C A 3 CYS N A 3 CYS CA A 3 CYS C 1.0 -140.0 -20.0 PHI 4 4 A 3 CYS N A 3 CYS CA A 3 CYS C A 4 GLN N 1.0 90.0 170.0 PSI 5 5 A 3 CYS C A 4 GLN N A 4 GLN CA A 4 GLN C 1.0 -160.0 -100.0 PHI 6 6 A 4 GLN N A 4 GLN CA A 4 GLN C A 5 SER N 1.0 120.0 180.0 PSI 7 7 A 4 GLN C A 5 SER N A 5 SER CA A 5 SER C 1.0 -170.0 -90.0 PHI 8 8 A 5 SER N A 5 SER CA A 5 SER C A 6 GLN N 1.0 110.0 170.0 PSI 9 9 A 6 GLN C A 7 SER N A 7 SER CA A 7 SER C 1.0 -105.0 -45.0 PHI 10 10 A 7 SER N A 7 SER CA A 7 SER C A 8 HIS N 1.0 90.0 170.0 PSI 11 11 A 9 ARG C A 10 PHE N A 10 PHE CA A 10 PHE C 1.0 -100.0 -40.0 PHI 12 12 A 10 PHE N A 10 PHE CA A 10 PHE C A 11 ARG N 1.0 110.0 160.0 PSI 13 13 A 10 PHE C A 11 ARG N A 11 ARG CA A 11 ARG C 1.0 -140.0 -60.0 PHI 14 14 A 11 ARG N A 11 ARG CA A 11 ARG C A 12 GLY N 1.0 110.0 170.0 PSI 15 15 A 13 PRO C A 14 CYS N A 14 CYS CA A 14 CYS C 1.0 -100.0 -40.0 PHI 16 16 A 14 CYS N A 14 CYS CA A 14 CYS C A 15 LEU N 1.0 -50.0 10.0 PSI 17 17 A 14 CYS C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -180.0 -20.0 PHI 18 18 A 15 LEU C A 16 ARG N A 16 ARG CA A 16 ARG C 1.0 -180.0 -20.0 PHI 19 19 A 17 ARG C A 18 SER N A 18 SER CA A 18 SER C 1.0 -80.0 -40.0 PHI 20 20 A 18 SER N A 18 SER CA A 18 SER C A 19 ASN N 1.0 -50.0 -10.0 PSI 21 21 A 18 SER C A 19 ASN N A 19 ASN CA A 19 ASN C 1.0 -100.0 -40.0 PHI 22 22 A 19 ASN N A 19 ASN CA A 19 ASN C A 20 CYS N 1.0 -60.0 0.0 PSI 23 23 A 19 ASN C A 20 CYS N A 20 CYS CA A 20 CYS C 1.0 -90.0 -50.0 PHI 24 24 A 20 CYS N A 20 CYS CA A 20 CYS C A 21 ALA N 1.0 -55.0 -15.0 PSI 25 25 A 20 CYS C A 21 ALA N A 21 ALA CA A 21 ALA C 1.0 -85.0 -45.0 PHI 26 26 A 21 ALA N A 21 ALA CA A 21 ALA C A 22 ASN N 1.0 -60.0 -20.0 PSI 27 27 A 21 ALA C A 22 ASN N A 22 ASN CA A 22 ASN C 1.0 -85.0 -45.0 PHI 28 28 A 22 ASN N A 22 ASN CA A 22 ASN C A 23 VAL N 1.0 -60.0 -20.0 PSI 29 29 A 22 ASN C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -85.0 -45.0 PHI 30 30 A 23 VAL N A 23 VAL CA A 23 VAL C A 24 CYS N 1.0 -60.0 -20.0 PSI 31 31 A 23 VAL C A 24 CYS N A 24 CYS CA A 24 CYS C 1.0 -85.0 -45.0 PHI 32 32 A 24 CYS N A 24 CYS CA A 24 CYS C A 25 ARG N 1.0 -60.0 -20.0 PSI 33 33 A 24 CYS C A 25 ARG N A 25 ARG CA A 25 ARG C 1.0 -85.0 -45.0 PHI 34 34 A 25 ARG N A 25 ARG CA A 25 ARG C A 26 THR N 1.0 -60.0 -20.0 PSI 35 35 A 25 ARG C A 26 THR N A 26 THR CA A 26 THR C 1.0 -90.0 -50.0 PHI 36 36 A 26 THR N A 26 THR CA A 26 THR C A 27 GLU N 1.0 -40.0 0.0 PSI 37 37 A 26 THR C A 27 GLU N A 27 GLU CA A 27 GLU C 1.0 -110.0 -70.0 PHI 38 38 A 27 GLU N A 27 GLU CA A 27 GLU C A 28 GLY N 1.0 -20.0 20.0 PSI 39 39 A 28 GLY C A 29 PHE N A 29 PHE CA A 29 PHE C 1.0 -120.0 -60.0 PHI 40 40 A 29 PHE N A 29 PHE CA A 29 PHE C A 30 PRO N 1.0 110.0 170.0 PSI 41 41 A 32 GLY C A 33 ARG N A 33 ARG CA A 33 ARG C 1.0 -170.0 -90.0 PHI 42 42 A 33 ARG N A 33 ARG CA A 33 ARG C A 34 CYS N 1.0 100.0 180.0 PSI 43 43 A 33 ARG C A 34 CYS N A 34 CYS CA A 34 CYS C 1.0 -120.0 -60.0 PHI 44 44 A 34 CYS N A 34 CYS CA A 34 CYS C A 35 ARG N 1.0 90.0 150.0 PSI 45 45 A 35 ARG C A 36 GLY N A 36 GLY CA A 36 GLY C 1.0 -110.0 -50.0 PHI 46 46 A 36 GLY N A 36 GLY CA A 36 GLY C A 37 PHE N 1.0 120.0 180.0 PSI 47 47 A 36 GLY C A 37 PHE N A 37 PHE CA A 37 PHE C 1.0 -95.0 -35.0 PHI 48 48 A 37 PHE N A 37 PHE CA A 37 PHE C A 38 ARG N 1.0 -50.0 10.0 PSI 49 49 A 37 PHE C A 38 ARG N A 38 ARG CA A 38 ARG C 1.0 -115.0 -55.0 PHI 50 50 A 38 ARG N A 38 ARG CA A 38 ARG C A 39 ARG N 1.0 -30.0 30.0 PSI 51 51 A 39 ARG C A 40 ARG N A 40 ARG CA A 40 ARG C 1.0 -150.0 -90.0 PHI 52 52 A 40 ARG N A 40 ARG CA A 40 ARG C A 41 CYS N 1.0 120.0 180.0 PSI 53 53 A 41 CYS C A 42 PHE N A 42 PHE CA A 42 PHE C 1.0 -150.0 -90.0 PHI 54 54 A 42 PHE N A 42 PHE CA A 42 PHE C A 43 CYS N 1.0 100.0 160.0 PSI 55 55 A 42 PHE C A 43 CYS N A 43 CYS CA A 43 CYS C 1.0 -125.0 -65.0 PHI 56 56 A 43 CYS N A 43 CYS CA A 43 CYS C A 44 THR N 1.0 90.0 150.0 PSI 57 57 A 43 CYS C A 44 THR N A 44 THR CA A 44 THR C 1.0 -150.0 -50.0 PHI 58 58 A 44 THR N A 44 THR CA A 44 THR C A 45 THR N 1.0 100.0 160.0 PSI 59 59 A 44 THR C A 45 THR N A 45 THR CA A 45 THR C 1.0 -150.0 -110.0 PHI 60 60 A 45 THR N A 45 THR CA A 45 THR C A 46 HIS N 1.0 125.0 175.0 PSI 61 61 A 45 THR C A 46 HIS N A 46 HIS CA A 46 HIS C 1.0 -110.0 -50.0 PHI 62 62 A 46 HIS N A 46 HIS CA A 46 HIS C A 47 CYS N 1.0 100.0 160.0 PSI 63 63 A 3 CYS N A 3 CYS CA A 3 CYS CB A 3 CYS SG 1.0 -90.0 -30.0 CHI1 64 64 A 4 GLN N A 4 GLN CA A 4 GLN CB A 4 GLN CG 1.0 -90.0 -30.0 CHI1 65 65 A 8 HIS N A 8 HIS CA A 8 HIS CB A 8 HIS CG 1.0 -210.0 -30.0 CHI1 66 66 A 24 CYS N A 24 CYS CA A 24 CYS CB A 24 CYS SG 1.0 -90.0 -30.0 CHI1 67 67 A 25 ARG N A 25 ARG CA A 25 ARG CB A 25 ARG CG 1.0 150.0 210.0 CHI1 68 68 A 29 PHE N A 29 PHE CA A 29 PHE CB A 29 PHE CG 1.0 -90.0 -30.0 CHI1 69 69 A 34 CYS N A 34 CYS CA A 34 CYS CB A 34 CYS SG 1.0 -90.0 -30.0 CHI1 70 70 A 38 ARG N A 38 ARG CA A 38 ARG CB A 38 ARG CG 1.0 -90.0 30.0 CHI1 71 71 A 41 CYS N A 41 CYS CA A 41 CYS CB A 41 CYS SG 1.0 150.0 210.0 CHI1 72 72 A 42 PHE N A 42 PHE CA A 42 PHE CB A 42 PHE CG 1.0 -90.0 -30.0 CHI1 73 73 A 43 CYS N A 43 CYS CA A 43 CYS CB A 43 CYS SG 1.0 -90.0 -30.0 CHI1 74 74 A 47 CYS N A 47 CYS CA A 47 CYS CB A 47 CYS SG 1.0 -210.0 -30.0 CHI1 stop_ save_