data_nef_c25636_2n37 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 2N37 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 6 CYS SG 1 47 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 PRO middle . false 3 A 3 ALA middle . . 4 A 4 ARG middle . . 5 A 5 PHE middle . . 6 A 6 CYS middle -HG . 7 A 7 VAL middle . . 8 A 8 TYR middle . . 9 A 9 TYR middle . . 10 A 10 ASP middle . . 11 A 11 GLY middle . false 12 A 12 HIS middle . . 13 A 13 LEU middle . . 14 A 14 PRO middle . false 15 A 15 ALA middle . . 16 A 16 THR middle . . 17 A 17 ARG middle . . 18 A 18 VAL middle . . 19 A 19 LEU middle . . 20 A 20 LEU middle . . 21 A 21 MET middle . . 22 A 22 TYR middle . . 23 A 23 VAL middle . . 24 A 24 ARG middle . . 25 A 25 ILE middle . . 26 A 26 GLY middle . false 27 A 27 THR middle . . 28 A 28 THR middle . . 29 A 29 ALA middle . . 30 A 30 THR middle . . 31 A 31 ILE middle . . 32 A 32 THR middle . . 33 A 33 ALA middle . . 34 A 34 ARG middle . . 35 A 35 GLY middle . false 36 A 36 HIS middle . . 37 A 37 GLU middle . . 38 A 38 PHE middle . . 39 A 39 GLU middle . . 40 A 40 VAL middle . . 41 A 41 GLU middle . . 42 A 42 ALA middle . . 43 A 43 LYS middle . . 44 A 44 ASP middle . . 45 A 45 GLN middle . . 46 A 46 ASN middle . . 47 A 47 CYS middle -HG . 48 A 48 LYS middle . . 49 A 49 VAL middle . . 50 A 50 ILE middle . . 51 A 51 LEU middle . . 52 A 52 THR middle . . 53 A 53 ASN middle . . 54 A 54 GLY middle . false 55 A 55 LYS middle . . 56 A 56 GLN middle . . 57 A 57 ALA middle . . 58 A 58 PRO middle . false 59 A 59 ASP middle . . 60 A 60 TRP middle . . 61 A 61 LEU middle . . 62 A 62 ALA middle . . 63 A 63 ALA middle . . 64 A 64 GLU middle . . 65 A 65 PRO middle . false 66 A 66 TYR 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 2 PRO HA H 1 4.386 0.010 A 2 PRO HBx H 1 1.810 0.016 A 2 PRO HBy H 1 2.220 0.002 A 2 PRO HDy H 1 3.745 0.001 A 2 PRO HDx H 1 3.574 0.013 A 2 PRO HGx H 1 1.958 0.011 A 2 PRO HGy H 1 1.958 0.011 A 2 PRO CA C 13 62.756 0.000 A 2 PRO CB C 13 32.034 0.000 A 2 PRO CD C 13 50.477 0.000 A 2 PRO CG C 13 27.303 0.000 A 3 ALA H H 1 8.192 0.025 A 3 ALA HA H 1 4.306 0.008 A 3 ALA HB% H 1 1.365 0.003 A 3 ALA CA C 13 52.756 0.000 A 3 ALA CB C 13 19.935 0.000 A 3 ALA N N 15 124.343 0.000 A 4 ARG H H 1 9.195 0.015 A 4 ARG HA H 1 4.323 0.014 A 4 ARG HBy H 1 1.639 0.017 A 4 ARG HBx H 1 1.356 0.004 A 4 ARG HDy H 1 3.118 0.000 A 4 ARG HDx H 1 2.974 0.005 A 4 ARG HGy H 1 1.565 0.001 A 4 ARG HGx H 1 1.431 0.001 A 4 ARG CA C 13 56.231 0.000 A 4 ARG CB C 13 33.629 0.000 A 4 ARG CD C 13 43.384 0.000 A 4 ARG CG C 13 27.458 0.000 A 4 ARG N N 15 119.928 0.000 A 5 PHE H H 1 9.242 0.020 A 5 PHE HA H 1 5.321 0.016 A 5 PHE HBy H 1 3.144 0.000 A 5 PHE HBx H 1 3.016 0.000 A 5 PHE HDx H 1 7.117 0.000 A 5 PHE HDy H 1 7.117 0.000 A 5 PHE HEx H 1 6.908 0.000 A 5 PHE HEy H 1 6.908 0.000 A 5 PHE CA C 13 56.914 0.000 A 5 PHE CB C 13 43.554 0.000 A 5 PHE N N 15 119.084 0.000 A 6 CYS H H 1 9.204 0.009 A 6 CYS HA H 1 5.281 0.005 A 6 CYS HBy H 1 2.463 0.000 A 6 CYS HBx H 1 2.224 0.000 A 6 CYS CA C 13 54.262 0.000 A 6 CYS CB C 13 39.730 0.000 A 6 CYS N N 15 116.173 0.000 A 7 VAL H H 1 9.474 0.017 A 7 VAL HA H 1 4.314 0.013 A 7 VAL HB H 1 1.679 0.010 A 7 VAL HGx% H 1 0.256 0.002 A 7 VAL HGy% H 1 0.097 0.020 A 7 VAL CA C 13 60.665 0.000 A 7 VAL CB C 13 32.359 0.000 A 7 VAL CGy C 13 22.292 0.000 A 7 VAL CGx C 13 20.794 0.000 A 7 VAL N N 15 126.228 0.000 A 8 TYR H H 1 8.195 0.015 A 8 TYR HA H 1 5.120 0.002 A 8 TYR HBx H 1 2.615 0.012 A 8 TYR HBy H 1 2.615 0.012 A 8 TYR HDx H 1 6.784 0.000 A 8 TYR HDy H 1 6.784 0.000 A 8 TYR HEx H 1 6.354 0.000 A 8 TYR HEy H 1 6.354 0.000 A 8 TYR CA C 13 57.174 0.000 A 8 TYR CB C 13 40.918 0.000 A 8 TYR N N 15 123.478 0.000 A 9 TYR H H 1 9.410 0.011 A 9 TYR HA H 1 5.209 0.012 A 9 TYR HBy H 1 2.655 0.011 A 9 TYR HBx H 1 2.496 0.016 A 9 TYR HDx H 1 6.491 0.000 A 9 TYR HDy H 1 6.491 0.000 A 9 TYR HEx H 1 6.352 0.000 A 9 TYR HEy H 1 6.352 0.000 A 9 TYR CA C 13 56.930 0.000 A 9 TYR CB C 13 44.026 0.000 A 9 TYR N N 15 119.745 0.000 A 10 ASP H H 1 8.948 0.009 A 10 ASP HA H 1 5.203 0.005 A 10 ASP HBy H 1 2.982 0.007 A 10 ASP HBx H 1 2.502 0.004 A 10 ASP CA C 13 52.879 0.000 A 10 ASP CB C 13 41.522 0.000 A 10 ASP N N 15 118.515 0.000 A 11 GLY H H 1 9.014 0.003 A 11 GLY HAy H 1 4.748 0.003 A 11 GLY HAx H 1 3.692 0.025 A 11 GLY CA C 13 44.213 0.000 A 11 GLY N N 15 114.853 0.000 A 12 HIS H H 1 8.133 0.017 A 12 HIS HA H 1 4.415 0.019 A 12 HIS HBy H 1 3.210 0.006 A 12 HIS HBx H 1 2.811 0.018 A 12 HIS HD2 H 1 7.152 0.000 A 12 HIS HE1 H 1 8.174 0.000 A 12 HIS CA C 13 56.572 0.000 A 12 HIS CB C 13 32.017 0.000 A 12 HIS N N 15 114.423 0.000 A 13 LEU H H 1 8.385 0.052 A 13 LEU HA H 1 4.777 0.003 A 13 LEU HBx H 1 1.698 0.012 A 13 LEU HBy H 1 1.698 0.012 A 13 LEU HDx% H 1 0.911 0.011 A 13 LEU HDy% H 1 0.865 0.010 A 13 LEU HG H 1 1.540 0.011 A 13 LEU CA C 13 52.049 0.000 A 13 LEU CB C 13 41.569 0.000 A 13 LEU CDy C 13 24.960 0.000 A 13 LEU CDx C 13 23.786 0.000 A 13 LEU CG C 13 26.821 0.000 A 13 LEU N N 15 123.763 0.000 A 14 PRO HA H 1 3.707 0.015 A 14 PRO HBx H 1 1.869 0.016 A 14 PRO HBy H 1 2.184 0.008 A 14 PRO HDy H 1 4.037 0.012 A 14 PRO HDx H 1 3.776 0.002 A 14 PRO HGy H 1 2.087 0.035 A 14 PRO HGx H 1 1.756 0.003 A 14 PRO CA C 13 65.579 0.000 A 14 PRO CB C 13 31.895 0.000 A 14 PRO CD C 13 50.889 0.000 A 14 PRO CG C 13 27.619 0.000 A 15 ALA H H 1 8.162 0.031 A 15 ALA HA H 1 4.149 0.011 A 15 ALA HB% H 1 1.409 0.012 A 15 ALA CA C 13 54.628 0.000 A 15 ALA CB C 13 19.577 0.000 A 15 ALA N N 15 115.114 0.000 A 16 THR H H 1 7.153 0.005 A 16 THR HA H 1 4.553 0.005 A 16 THR HB H 1 4.366 0.002 A 16 THR HG2% H 1 1.050 0.007 A 16 THR CA C 13 60.331 0.000 A 16 THR CB C 13 70.574 0.000 A 16 THR CG2 C 13 22.140 0.000 A 16 THR N N 15 102.057 0.000 A 17 ARG H H 1 7.901 0.025 A 17 ARG HA H 1 4.716 0.006 A 17 ARG HBy H 1 1.468 0.000 A 17 ARG HBx H 1 1.360 0.000 A 17 ARG HDy H 1 1.781 0.000 A 17 ARG HDx H 1 1.697 0.000 A 17 ARG HGy H 1 1.464 0.000 A 17 ARG HGx H 1 0.960 0.000 A 17 ARG CA C 13 56.296 0.000 A 17 ARG CB C 13 30.021 0.000 A 17 ARG N N 15 122.509 0.000 A 18 VAL H H 1 8.568 0.014 A 18 VAL HA H 1 4.293 0.007 A 18 VAL HB H 1 2.076 0.008 A 18 VAL HGx% H 1 0.993 0.052 A 18 VAL HGy% H 1 0.992 0.075 A 18 VAL CA C 13 61.462 0.000 A 18 VAL CB C 13 35.247 0.000 A 18 VAL CGx C 13 20.879 0.000 A 18 VAL CGy C 13 20.908 0.000 A 18 VAL N N 15 122.027 0.000 A 19 LEU H H 1 8.670 0.036 A 19 LEU HA H 1 3.718 0.012 A 19 LEU HBy H 1 1.609 0.000 A 19 LEU HBx H 1 1.489 0.000 A 19 LEU HDx% H 1 0.563 0.010 A 19 LEU HDy% H 1 0.418 0.021 A 19 LEU HG H 1 0.868 0.012 A 19 LEU CA C 13 57.467 0.000 A 19 LEU CB C 13 41.862 0.000 A 19 LEU CDx C 13 24.639 0.000 A 19 LEU CDy C 13 25.281 0.000 A 19 LEU CG C 13 27.774 0.000 A 19 LEU N N 15 130.327 0.000 A 20 LEU H H 1 9.236 0.020 A 20 LEU HA H 1 4.588 0.003 A 20 LEU HBy H 1 1.531 0.007 A 20 LEU HBx H 1 1.382 0.009 A 20 LEU HDx% H 1 0.978 0.001 A 20 LEU HDy% H 1 0.809 0.010 A 20 LEU HG H 1 1.847 0.012 A 20 LEU CA C 13 55.873 0.000 A 20 LEU CB C 13 42.513 0.000 A 20 LEU CDx C 13 21.751 0.000 A 20 LEU CDy C 13 27.270 0.000 A 20 LEU CG C 13 26.445 0.000 A 20 LEU N N 15 126.389 0.000 A 21 MET H H 1 7.022 0.005 A 21 MET HA H 1 4.423 0.009 A 21 MET HBy H 1 2.066 0.005 A 21 MET HBx H 1 1.693 0.018 A 21 MET HGx H 1 2.454 0.015 A 21 MET HGy H 1 2.454 0.015 A 21 MET CA C 13 56.214 0.000 A 21 MET CB C 13 36.964 0.000 A 21 MET CG C 13 31.822 0.000 A 21 MET N N 15 114.450 0.000 A 22 TYR H H 1 8.515 0.032 A 22 TYR HA H 1 4.777 0.010 A 22 TYR HBy H 1 2.777 0.001 A 22 TYR HBx H 1 2.194 0.004 A 22 TYR HDx H 1 6.481 0.000 A 22 TYR HDy H 1 6.481 0.000 A 22 TYR HEx H 1 6.048 0.000 A 22 TYR HEy H 1 6.048 0.000 A 22 TYR CA C 13 57.988 0.000 A 22 TYR CB C 13 39.356 0.000 A 22 TYR N N 15 123.123 0.000 A 23 VAL H H 1 9.417 0.012 A 23 VAL HA H 1 4.371 0.004 A 23 VAL HB H 1 2.165 0.002 A 23 VAL HGx% H 1 0.776 0.016 A 23 VAL HGy% H 1 0.625 0.011 A 23 VAL CA C 13 61.503 0.000 A 23 VAL CB C 13 35.418 0.000 A 23 VAL CGx C 13 21.774 0.000 A 23 VAL CGy C 13 22.229 0.000 A 23 VAL N N 15 123.811 0.000 A 24 ARG H H 1 8.892 0.013 A 24 ARG HA H 1 3.885 0.032 A 24 ARG HBx H 1 1.653 0.021 A 24 ARG HBy H 1 1.653 0.021 A 24 ARG HDx H 1 2.867 0.039 A 24 ARG HDy H 1 2.867 0.039 A 24 ARG HGx H 1 1.466 0.025 A 24 ARG HGy H 1 1.466 0.025 A 24 ARG CA C 13 56.784 0.000 A 24 ARG CB C 13 30.178 0.000 A 24 ARG CD C 13 42.871 0.000 A 24 ARG CG C 13 26.968 0.000 A 24 ARG N N 15 129.194 0.000 A 25 ILE H H 1 8.312 0.009 A 25 ILE HA H 1 3.655 0.011 A 25 ILE HB H 1 1.248 0.013 A 25 ILE HD1% H 1 0.413 0.018 A 25 ILE HG1y H 1 1.277 0.007 A 25 ILE HG1x H 1 0.750 0.017 A 25 ILE HG2% H 1 0.577 0.011 A 25 ILE CA C 13 64.879 0.000 A 25 ILE CB C 13 37.154 0.000 A 25 ILE CD1 C 13 13.459 0.000 A 25 ILE CG1 C 13 30.959 0.000 A 25 ILE CG2 C 13 16.925 0.000 A 25 ILE N N 15 128.158 0.000 A 26 GLY H H 1 9.389 0.007 A 26 GLY HAy H 1 4.363 0.017 A 26 GLY HAx H 1 3.820 0.008 A 26 GLY CA C 13 44.352 0.000 A 26 GLY N N 15 115.464 0.000 A 27 THR H H 1 7.877 0.002 A 27 THR HA H 1 4.926 0.007 A 27 THR HB H 1 4.373 0.011 A 27 THR HG2% H 1 1.047 0.015 A 27 THR CA C 13 60.299 0.000 A 27 THR CB C 13 72.194 0.000 A 27 THR CG2 C 13 21.619 0.000 A 27 THR N N 15 111.341 0.000 A 28 THR H H 1 7.732 0.022 A 28 THR HA H 1 5.353 0.009 A 28 THR HB H 1 3.982 0.012 A 28 THR HG2% H 1 1.017 0.008 A 28 THR CA C 13 59.143 0.000 A 28 THR CB C 13 71.706 0.000 A 28 THR CG2 C 13 21.603 0.000 A 28 THR N N 15 108.952 0.000 A 29 ALA H H 1 8.634 0.009 A 29 ALA HA H 1 4.621 0.011 A 29 ALA HB% H 1 1.260 0.005 A 29 ALA CA C 13 51.796 0.000 A 29 ALA CB C 13 24.556 0.000 A 29 ALA N N 15 122.383 0.000 A 30 THR H H 1 8.317 0.033 A 30 THR HA H 1 4.885 0.007 A 30 THR HB H 1 3.873 0.005 A 30 THR HG2% H 1 0.966 0.023 A 30 THR CA C 13 62.300 0.000 A 30 THR CB C 13 69.265 0.000 A 30 THR CG2 C 13 21.717 0.000 A 30 THR N N 15 115.881 0.000 A 31 ILE H H 1 9.166 0.017 A 31 ILE HA H 1 4.388 0.000 A 31 ILE HB H 1 1.704 0.005 A 31 ILE HD1% H 1 0.330 0.008 A 31 ILE HG1y H 1 1.311 0.000 A 31 ILE HG1x H 1 0.971 0.000 A 31 ILE HG2% H 1 0.682 0.008 A 31 ILE CA C 13 59.562 0.000 A 31 ILE CB C 13 40.634 0.000 A 31 ILE CD1 C 13 14.126 0.000 A 31 ILE CG1 C 13 27.108 0.000 A 31 ILE CG2 C 13 18.219 0.000 A 31 ILE N N 15 126.005 0.000 A 32 THR H H 1 8.441 0.042 A 32 THR HA H 1 5.300 0.003 A 32 THR HB H 1 3.933 0.013 A 32 THR HG2% H 1 1.030 0.003 A 32 THR CA C 13 60.885 0.000 A 32 THR CB C 13 69.867 0.000 A 32 THR CG2 C 13 20.740 0.000 A 32 THR N N 15 120.162 0.000 A 33 ALA H H 1 9.130 0.036 A 33 ALA HA H 1 4.644 0.002 A 33 ALA HB% H 1 1.627 0.004 A 33 ALA CA C 13 51.975 0.000 A 33 ALA CB C 13 22.897 0.000 A 33 ALA N N 15 127.525 0.000 A 34 ARG H H 1 9.232 0.026 A 34 ARG HA H 1 3.814 0.001 A 34 ARG HBy H 1 2.015 0.000 A 34 ARG HBx H 1 1.672 0.000 A 34 ARG HDy H 1 2.502 0.006 A 34 ARG HDx H 1 1.758 0.001 A 34 ARG HE H 1 6.919 0.000 A 34 ARG HGy H 1 1.095 0.003 A 34 ARG HGx H 1 0.778 0.001 A 34 ARG CA C 13 57.028 0.000 A 34 ARG CB C 13 27.337 0.000 A 34 ARG CD C 13 43.437 0.000 A 34 ARG CG C 13 26.527 0.000 A 34 ARG N N 15 118.330 0.000 A 35 GLY H H 1 8.642 0.032 A 35 GLY HAy H 1 3.942 0.009 A 35 GLY HAx H 1 3.493 0.006 A 35 GLY CA C 13 45.368 0.000 A 35 GLY N N 15 104.002 0.000 A 36 HIS H H 1 8.188 0.002 A 36 HIS HA H 1 4.703 0.001 A 36 HIS HBy H 1 3.057 0.000 A 36 HIS HBx H 1 2.757 0.000 A 36 HIS HD2 H 1 7.008 0.000 A 36 HIS HE1 H 1 8.238 0.000 A 36 HIS CA C 13 54.376 0.000 A 36 HIS CB C 13 32.880 0.000 A 36 HIS N N 15 119.875 0.000 A 37 GLU H H 1 7.991 0.024 A 37 GLU HA H 1 5.018 0.003 A 37 GLU HBy H 1 1.700 0.009 A 37 GLU HBx H 1 1.606 0.014 A 37 GLU HGy H 1 2.049 0.000 A 37 GLU HGx H 1 1.987 0.000 A 37 GLU CA C 13 55.092 0.000 A 37 GLU CB C 13 31.863 0.000 A 37 GLU CG C 13 36.775 0.000 A 37 GLU N N 15 119.578 0.000 A 38 PHE H H 1 9.149 0.025 A 38 PHE HA H 1 4.755 0.004 A 38 PHE HBy H 1 2.694 0.017 A 38 PHE HBx H 1 2.583 0.009 A 38 PHE HDx H 1 7.059 0.000 A 38 PHE HDy H 1 7.059 0.000 A 38 PHE HEx H 1 7.394 0.000 A 38 PHE HEy H 1 7.394 0.000 A 38 PHE HZ H 1 7.223 0.000 A 38 PHE CA C 13 56.442 0.000 A 38 PHE CB C 13 41.569 0.000 A 38 PHE N N 15 121.593 0.000 A 39 GLU H H 1 8.539 0.020 A 39 GLU HA H 1 5.186 0.002 A 39 GLU HBy H 1 2.159 0.009 A 39 GLU HBx H 1 1.696 0.004 A 39 GLU HGx H 1 1.966 0.013 A 39 GLU HGy H 1 1.966 0.013 A 39 GLU CA C 13 55.531 0.000 A 39 GLU CB C 13 30.309 0.000 A 39 GLU CG C 13 37.322 0.000 A 39 GLU N N 15 125.332 0.000 A 40 VAL H H 1 8.773 0.012 A 40 VAL HA H 1 5.396 0.001 A 40 VAL HB H 1 1.952 0.002 A 40 VAL HGx% H 1 0.502 0.010 A 40 VAL HGy% H 1 0.239 0.012 A 40 VAL CA C 13 58.517 0.000 A 40 VAL CB C 13 34.287 0.000 A 40 VAL CGy C 13 20.830 0.000 A 40 VAL CGx C 13 17.087 0.000 A 40 VAL N N 15 120.623 0.000 A 41 GLU H H 1 7.973 0.006 A 41 GLU HA H 1 4.553 0.009 A 41 GLU HBy H 1 1.794 0.003 A 41 GLU HBx H 1 1.554 0.008 A 41 GLU HGy H 1 1.906 0.000 A 41 GLU HGx H 1 1.568 0.000 A 41 GLU CA C 13 54.359 0.000 A 41 GLU CB C 13 32.408 0.000 A 41 GLU CG C 13 35.507 0.000 A 41 GLU N N 15 118.742 0.000 A 42 ALA H H 1 8.181 0.003 A 42 ALA HA H 1 4.662 0.029 A 42 ALA HB% H 1 1.332 0.012 A 42 ALA CA C 13 50.446 0.000 A 42 ALA CB C 13 18.015 0.000 A 42 ALA N N 15 132.540 0.000 A 43 LYS H H 1 9.029 0.027 A 43 LYS HA H 1 3.955 0.015 A 43 LYS HBy H 1 1.692 0.013 A 43 LYS HBx H 1 1.577 0.006 A 43 LYS HDx H 1 1.560 0.008 A 43 LYS HDy H 1 1.560 0.008 A 43 LYS HEx H 1 2.879 0.014 A 43 LYS HEy H 1 2.879 0.014 A 43 LYS HGy H 1 1.371 0.001 A 43 LYS HGx H 1 1.225 0.022 A 43 LYS CA C 13 59.648 0.000 A 43 LYS CB C 13 34.670 0.000 A 43 LYS CD C 13 29.031 0.000 A 43 LYS CE C 13 41.878 0.000 A 43 LYS CG C 13 25.027 0.000 A 43 LYS N N 15 125.936 0.000 A 44 ASP H H 1 7.463 0.005 A 44 ASP HA H 1 4.338 0.009 A 44 ASP HBx H 1 2.958 0.003 A 44 ASP HBy H 1 2.958 0.003 A 44 ASP CA C 13 53.074 0.000 A 44 ASP CB C 13 41.337 0.000 A 44 ASP N N 15 110.443 0.000 A 45 GLN H H 1 8.370 0.016 A 45 GLN HA H 1 4.064 0.007 A 45 GLN HBy H 1 2.149 0.025 A 45 GLN HBx H 1 2.056 0.003 A 45 GLN HE2x H 1 6.950 0.000 A 45 GLN HE2y H 1 7.540 0.000 A 45 GLN HGx H 1 2.295 0.014 A 45 GLN HGy H 1 2.295 0.014 A 45 GLN CA C 13 57.663 0.000 A 45 GLN CB C 13 28.047 0.000 A 45 GLN CG C 13 33.162 0.000 A 45 GLN N N 15 112.575 0.000 A 46 ASN H H 1 8.704 0.002 A 46 ASN HA H 1 4.536 0.008 A 46 ASN HBy H 1 2.973 0.000 A 46 ASN HBx H 1 2.603 0.000 A 46 ASN HD2y H 1 7.587 0.000 A 46 ASN HD2x H 1 7.042 0.000 A 46 ASN CA C 13 55.271 0.000 A 46 ASN CB C 13 38.046 0.000 A 46 ASN N N 15 117.659 0.000 A 47 CYS H H 1 8.486 0.017 A 47 CYS HA H 1 4.397 0.004 A 47 CYS HBy H 1 2.742 0.001 A 47 CYS HBx H 1 2.219 0.016 A 47 CYS CA C 13 55.075 0.000 A 47 CYS CB C 13 36.199 0.000 A 47 CYS N N 15 112.520 0.000 A 48 LYS H H 1 7.970 0.015 A 48 LYS HA H 1 4.130 0.011 A 48 LYS HBx H 1 1.620 0.002 A 48 LYS HBy H 1 1.620 0.002 A 48 LYS HDx H 1 1.635 0.005 A 48 LYS HDy H 1 1.635 0.005 A 48 LYS HEx H 1 2.955 0.004 A 48 LYS HEy H 1 2.955 0.004 A 48 LYS HGy H 1 1.478 0.004 A 48 LYS HGx H 1 1.342 0.014 A 48 LYS CA C 13 56.865 0.000 A 48 LYS CB C 13 32.180 0.000 A 48 LYS CD C 13 28.698 0.000 A 48 LYS CE C 13 42.253 0.000 A 48 LYS CG C 13 25.291 0.000 A 48 LYS N N 15 116.117 0.000 A 49 VAL H H 1 8.951 0.036 A 49 VAL HA H 1 3.632 0.028 A 49 VAL HB H 1 2.007 0.006 A 49 VAL HGx% H 1 0.893 0.005 A 49 VAL HGy% H 1 0.623 0.013 A 49 VAL CA C 13 64.782 0.000 A 49 VAL CB C 13 30.317 0.000 A 49 VAL CGx C 13 21.497 0.000 A 49 VAL CGy C 13 22.213 0.000 A 49 VAL N N 15 126.872 0.000 A 50 ILE H H 1 8.666 0.028 A 50 ILE HA H 1 4.135 0.010 A 50 ILE HB H 1 2.018 0.015 A 50 ILE HD1% H 1 0.838 0.000 A 50 ILE HG1y H 1 1.320 0.005 A 50 ILE HG1x H 1 0.882 0.000 A 50 ILE HG2% H 1 0.808 0.009 A 50 ILE CA C 13 60.535 0.000 A 50 ILE CB C 13 41.659 0.000 A 50 ILE CD1 C 13 14.142 0.000 A 50 ILE CG1 C 13 26.872 0.000 A 50 ILE CG2 C 13 17.494 0.000 A 50 ILE N N 15 132.487 0.000 A 51 LEU H H 1 8.789 0.032 A 51 LEU HA H 1 5.250 0.010 A 51 LEU HBy H 1 2.000 0.004 A 51 LEU HBx H 1 1.728 0.019 A 51 LEU HDx% H 1 0.798 0.005 A 51 LEU HDy% H 1 0.730 0.002 A 51 LEU HG H 1 1.595 0.009 A 51 LEU CA C 13 53.245 0.000 A 51 LEU CB C 13 41.146 0.000 A 51 LEU CDy C 13 25.803 0.000 A 51 LEU CDx C 13 23.942 0.000 A 51 LEU CG C 13 28.120 0.000 A 51 LEU N N 15 125.179 0.000 A 52 THR H H 1 8.528 0.023 A 52 THR HA H 1 4.079 0.009 A 52 THR HB H 1 4.258 0.010 A 52 THR HG2% H 1 1.090 0.010 A 52 THR CA C 13 63.822 0.000 A 52 THR CB C 13 68.335 0.000 A 52 THR CG2 C 13 23.108 0.000 A 52 THR N N 15 115.511 0.000 A 53 ASN H H 1 8.149 0.022 A 53 ASN HA H 1 4.514 0.016 A 53 ASN HBy H 1 3.153 0.000 A 53 ASN HBx H 1 2.888 0.000 A 53 ASN HD2y H 1 7.271 0.000 A 53 ASN HD2x H 1 6.641 0.000 A 53 ASN CA C 13 52.740 0.000 A 53 ASN CB C 13 37.314 0.000 A 53 ASN N N 15 116.941 0.000 A 54 GLY H H 1 7.949 0.007 A 54 GLY HAy H 1 4.052 0.011 A 54 GLY HAx H 1 3.824 0.006 A 54 GLY CA C 13 45.735 0.000 A 54 GLY N N 15 106.580 0.000 A 55 LYS H H 1 7.806 0.046 A 55 LYS HA H 1 4.251 0.014 A 55 LYS HBx H 1 1.802 0.003 A 55 LYS HBy H 1 1.802 0.003 A 55 LYS HDx H 1 1.625 0.021 A 55 LYS HDy H 1 1.625 0.021 A 55 LYS HEx H 1 2.946 0.020 A 55 LYS HEy H 1 2.946 0.020 A 55 LYS HGx H 1 1.265 0.014 A 55 LYS HGy H 1 1.265 0.014 A 55 LYS CA C 13 55.848 0.000 A 55 LYS CB C 13 32.595 0.000 A 55 LYS CD C 13 28.690 0.000 A 55 LYS CE C 13 42.469 0.000 A 55 LYS CG C 13 25.809 0.000 A 55 LYS N N 15 120.679 0.000 A 56 GLN H H 1 8.241 0.027 A 56 GLN HA H 1 4.114 0.011 A 56 GLN HBx H 1 1.919 0.008 A 56 GLN HBy H 1 1.919 0.008 A 56 GLN HE2x H 1 6.838 0.000 A 56 GLN HE2y H 1 7.644 0.000 A 56 GLN HGx H 1 2.376 0.010 A 56 GLN HGy H 1 2.376 0.010 A 56 GLN CA C 13 55.865 0.000 A 56 GLN CB C 13 29.228 0.000 A 56 GLN CG C 13 33.620 0.000 A 56 GLN N N 15 119.471 0.000 A 57 ALA H H 1 8.667 0.040 A 57 ALA HA H 1 4.136 0.002 A 57 ALA HB% H 1 1.065 0.006 A 57 ALA CA C 13 50.210 0.000 A 57 ALA CB C 13 18.056 0.000 A 57 ALA N N 15 129.241 0.000 A 58 PRO HA H 1 4.181 0.009 A 58 PRO HBx H 1 0.003 0.016 A 58 PRO HBy H 1 1.740 0.003 A 58 PRO HDy H 1 3.413 0.000 A 58 PRO HDx H 1 2.508 0.000 A 58 PRO HGy H 1 1.435 0.000 A 58 PRO HGx H 1 0.694 0.003 A 58 PRO CA C 13 62.162 0.000 A 58 PRO CB C 13 31.226 0.000 A 58 PRO CD C 13 49.686 0.000 A 58 PRO CG C 13 27.444 0.000 A 59 ASP H H 1 8.576 0.039 A 59 ASP HA H 1 4.151 0.018 A 59 ASP HBx H 1 2.716 0.003 A 59 ASP HBy H 1 2.716 0.003 A 59 ASP CA C 13 56.483 0.000 A 59 ASP CB C 13 40.568 0.000 A 59 ASP N N 15 120.839 0.000 A 60 TRP H H 1 6.701 0.004 A 60 TRP HA H 1 4.460 0.001 A 60 TRP HBy H 1 3.682 0.004 A 60 TRP HBx H 1 3.077 0.007 A 60 TRP HD1 H 1 7.315 0.000 A 60 TRP HE1 H 1 10.334 0.000 A 60 TRP HE3 H 1 7.228 0.000 A 60 TRP HH2 H 1 6.905 0.000 A 60 TRP HZ2 H 1 7.387 0.000 A 60 TRP HZ3 H 1 6.564 0.000 A 60 TRP CA C 13 54.579 0.000 A 60 TRP CB C 13 29.366 0.000 A 60 TRP N N 15 114.095 0.000 A 61 LEU H H 1 6.541 0.000 A 61 LEU HA H 1 4.743 0.018 A 61 LEU HBy H 1 1.249 0.006 A 61 LEU HBx H 1 0.190 0.017 A 61 LEU HDx% H 1 0.579 0.013 A 61 LEU HDy% H 1 0.246 0.012 A 61 LEU HG H 1 1.151 0.009 A 61 LEU CA C 13 54.839 0.000 A 61 LEU CB C 13 42.083 0.000 A 61 LEU CDx C 13 23.704 0.000 A 61 LEU CDy C 13 25.394 0.000 A 61 LEU CG C 13 26.867 0.000 A 61 LEU N N 15 123.142 0.000 A 62 ALA H H 1 8.993 0.020 A 62 ALA HA H 1 4.644 0.004 A 62 ALA HB% H 1 0.931 0.020 A 62 ALA CA C 13 50.478 0.000 A 62 ALA CB C 13 23.434 0.000 A 62 ALA N N 15 131.106 0.000 A 63 ALA H H 1 8.139 0.030 A 63 ALA HA H 1 5.633 0.001 A 63 ALA HB% H 1 0.625 0.008 A 63 ALA CA C 13 51.143 0.000 A 63 ALA CB C 13 22.490 0.000 A 63 ALA N N 15 118.796 0.000 A 64 GLU H H 1 8.563 0.004 A 64 GLU HA H 1 4.902 0.001 A 64 GLU HBy H 1 2.159 0.001 A 64 GLU HBx H 1 1.982 0.007 A 64 GLU HGy H 1 2.335 0.000 A 64 GLU HGx H 1 2.164 0.000 A 64 GLU CA C 13 53.009 0.000 A 64 GLU CB C 13 32.619 0.000 A 64 GLU CG C 13 35.642 0.000 A 64 GLU N N 15 116.715 0.000 A 65 PRO HA H 1 5.486 0.006 A 65 PRO HBx H 1 1.905 0.006 A 65 PRO HBy H 1 2.380 0.008 A 65 PRO HDy H 1 3.767 0.012 A 65 PRO HDx H 1 3.498 0.019 A 65 PRO HGx H 1 2.093 0.024 A 65 PRO HGy H 1 2.093 0.024 A 65 PRO CA C 13 62.878 0.000 A 65 PRO CB C 13 32.606 0.000 A 65 PRO CD C 13 50.559 0.000 A 65 PRO CG C 13 27.536 0.000 A 66 TYR H H 1 8.844 0.009 A 66 TYR HA H 1 4.397 0.007 A 66 TYR HBy H 1 3.021 0.006 A 66 TYR HBx H 1 2.708 0.011 A 66 TYR HDx H 1 7.226 0.000 A 66 TYR HDy H 1 7.226 0.000 A 66 TYR HEx H 1 6.777 0.000 A 66 TYR HEy H 1 6.777 0.000 A 66 TYR CA C 13 61.438 0.000 A 66 TYR CB C 13 43.156 0.000 A 66 TYR N N 15 127.202 0.000 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 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 2 PRO HA A 3 ALA H 1.0 . 2.7 2 2 A 3 ALA H A 2 PRO HBx 1.0 . 4.3 3 3 A 3 ALA H A 2 PRO HBy 1.0 . 4.3 4 4 A 3 ALA H A 3 ALA HB% 1.0 . 3.3 5 5 A 3 ALA HA A 4 ARG H 1.0 . 2.7 6 6 A 3 ALA HB% A 4 ARG H 1.0 . 4.0 7 7 A 4 ARG H A 4 ARG HBy 1.0 . 3.7 8 7 A 4 ARG H A 4 ARG HBx 1.0 . 3.7 9 8 A 4 ARG H A 4 ARG HGy 1.0 . 4.5 10 8 A 4 ARG H A 4 ARG HGx 1.0 . 4.5 11 9 A 4 ARG H A 5 PHE H 1.0 . 4.4 12 10 A 5 PHE H A 4 ARG HA 1.0 . 2.7 13 11 A 4 ARG HA A 5 PHE HD% 1.0 . 4.6 14 12 A 5 PHE H A 4 ARG HBy 1.0 . 3.6 15 12 A 4 ARG HBx A 5 PHE H 1.0 . 3.6 16 13 A 5 PHE H A 4 ARG HGy 1.0 . 4.3 17 13 A 4 ARG HGx A 5 PHE H 1.0 . 4.3 18 14 A 4 ARG HBx A 45 GLN HBx 1.0 . 3.7 19 14 A 4 ARG HBy A 45 GLN HBx 1.0 . 3.7 20 14 A 45 GLN HBy A 4 ARG HBy 1.0 . 3.7 21 14 A 4 ARG HBx A 45 GLN HBy 1.0 . 3.7 22 15 A 5 PHE H A 5 PHE HA 1.0 . 5.0 23 16 A 5 PHE H A 5 PHE HD% 1.0 . 4.2 24 17 A 5 PHE HD% A 5 PHE HA 1.0 . 4.2 25 18 A 5 PHE H A 6 CYS H 1.0 . 4.5 26 19 A 5 PHE HA A 6 CYS H 1.0 . 2.7 27 20 A 5 PHE HA A 6 CYS HA 1.0 . 4.6 28 21 A 6 CYS H A 5 PHE HBy 1.0 . 4.2 29 21 A 6 CYS H A 5 PHE HBx 1.0 . 4.2 30 22 A 5 PHE HD% A 6 CYS H 1.0 . 4.2 31 23 A 5 PHE HBy A 7 VAL HGy% 1.0 . 3.8 32 23 A 5 PHE HBx A 7 VAL HGy% 1.0 . 3.8 33 23 A 7 VAL HGx% A 5 PHE HBy 1.0 . 3.8 34 23 A 5 PHE HBx A 7 VAL HGx% 1.0 . 3.8 35 24 A 22 TYR HD% A 5 PHE HBy 1.0 . 4.4 36 24 A 5 PHE HBx A 22 TYR HD% 1.0 . 4.4 37 25 A 5 PHE HD% A 22 TYR HBx 1.0 . 4.1 38 26 A 5 PHE HD% A 22 TYR HD% 1.0 . 4.3 39 27 A 5 PHE HD% A 23 VAL H 1.0 . 4.6 40 28 A 5 PHE HD% A 23 VAL HA 1.0 . 5.5 41 29 A 5 PHE HA A 24 ARG HA 1.0 . 4.5 42 30 A 5 PHE HD% A 24 ARG H 1.0 . 4.5 43 31 A 5 PHE HD% A 24 ARG HA 1.0 . 3.9 44 32 A 5 PHE HD% A 24 ARG HGx 1.0 . 4.3 45 32 A 5 PHE HD% A 24 ARG HGy 1.0 . 4.3 46 33 A 5 PHE HE% A 24 ARG HBx 1.0 . 3.4 47 33 A 5 PHE HE% A 24 ARG HBy 1.0 . 3.4 48 34 A 5 PHE HA A 25 ILE H 1.0 . 4.0 49 35 A 5 PHE H A 66 TYR H 1.0 . 5.0 50 36 A 6 CYS HA A 7 VAL H 1.0 . 2.7 51 37 A 6 CYS H A 22 TYR HBx 1.0 . 5.4 52 38 A 6 CYS H A 23 VAL H 1.0 . 4.4 53 39 A 23 VAL H A 6 CYS HBy 1.0 . 4.4 54 39 A 23 VAL H A 6 CYS HBx 1.0 . 4.4 55 40 A 23 VAL HB A 6 CYS HBy 1.0 . 4.2 56 40 A 6 CYS HBx A 23 VAL HB 1.0 . 4.2 57 41 A 23 VAL HGy% A 6 CYS HBy 1.0 . 4.2 58 41 A 6 CYS HBx A 23 VAL HGy% 1.0 . 4.2 59 42 A 6 CYS H A 24 ARG HA 1.0 . 5.0 60 43 A 6 CYS H A 25 ILE H 1.0 . 5.0 61 44 A 6 CYS HBy A 47 CYS HBy 1.0 . 3.5 62 44 A 6 CYS HBx A 47 CYS HBy 1.0 . 3.5 63 44 A 47 CYS HBx A 6 CYS HBy 1.0 . 3.5 64 44 A 6 CYS HBx A 47 CYS HBx 1.0 . 3.5 65 45 A 63 ALA HB% A 6 CYS HBy 1.0 . 4.5 66 45 A 6 CYS HBx A 63 ALA HB% 1.0 . 4.5 67 46 A 6 CYS HA A 65 PRO HA 1.0 . 4.0 68 47 A 6 CYS HA A 66 TYR H 1.0 . 4.0 69 48 A 7 VAL H A 7 VAL HA 1.0 . 5.0 70 49 A 7 VAL H A 7 VAL HB 1.0 . 4.1 71 50 A 7 VAL HGx% A 7 VAL H 1.0 . 4.2 72 51 A 7 VAL H A 7 VAL HGy% 1.0 . 4.2 73 52 A 7 VAL HGx% A 7 VAL HA 1.0 . 4.0 74 53 A 7 VAL HA A 7 VAL HGy% 1.0 . 4.0 75 54 A 7 VAL HA A 8 TYR H 1.0 . 2.7 76 55 A 7 VAL HA A 8 TYR HD% 1.0 . 5.1 77 56 A 7 VAL HB A 8 TYR H 1.0 . 4.5 78 57 A 7 VAL HGx% A 8 TYR H 1.0 . 4.3 79 58 A 8 TYR H A 7 VAL HGy% 1.0 . 4.3 80 59 A 7 VAL HB A 9 TYR HD% 1.0 . 5.1 81 60 A 7 VAL HB A 9 TYR HE% 1.0 . 3.9 82 61 A 9 TYR HD% A 7 VAL HGy% 1.0 . 4.1 83 61 A 7 VAL HGx% A 9 TYR HD% 1.0 . 4.1 84 62 A 9 TYR HE% A 7 VAL HGy% 1.0 . 3.8 85 62 A 7 VAL HGx% A 9 TYR HE% 1.0 . 3.8 86 63 A 19 LEU HG A 7 VAL HGy% 1.0 . 4.1 87 63 A 7 VAL HGx% A 19 LEU HG 1.0 . 4.1 88 64 A 19 LEU HDx% A 7 VAL HGy% 1.0 . 3.4 89 64 A 7 VAL HGx% A 19 LEU HDx% 1.0 . 3.4 90 65 A 19 LEU HDy% A 7 VAL HGy% 1.0 . 4.3 91 65 A 7 VAL HGx% A 19 LEU HDy% 1.0 . 4.3 92 66 A 7 VAL HA A 22 TYR HA 1.0 . 4.6 93 67 A 22 TYR HD% A 7 VAL HB 1.0 . 5.5 94 68 A 7 VAL HGx% A 22 TYR HD% 1.0 . 4.7 95 69 A 22 TYR HD% A 7 VAL HGy% 1.0 . 4.7 96 70 A 22 TYR HE% A 7 VAL HGy% 1.0 . 4.4 97 71 A 7 VAL HGx% A 22 TYR HE% 1.0 . 4.4 98 72 A 23 VAL H A 7 VAL H 1.0 . 5.0 99 73 A 23 VAL H A 7 VAL HA 1.0 . 4.0 100 74 A 23 VAL H A 7 VAL HGy% 1.0 . 4.4 101 74 A 7 VAL HGx% A 23 VAL H 1.0 . 4.4 102 75 A 7 VAL H A 63 ALA HA 1.0 . 5.0 103 76 A 7 VAL H A 64 GLU H 1.0 . 4.0 104 77 A 64 GLU H A 7 VAL HGy% 1.0 . 5.2 105 77 A 7 VAL HGx% A 64 GLU H 1.0 . 5.2 106 78 A 7 VAL H A 65 PRO HA 1.0 . 5.0 107 79 A 8 TYR H A 8 TYR HBx 1.0 . 4.0 108 79 A 8 TYR H A 8 TYR HBy 1.0 . 4.0 109 80 A 8 TYR H A 8 TYR HD% 1.0 . 4.2 110 81 A 8 TYR HD% A 8 TYR HA 1.0 . 4.5 111 82 A 8 TYR H A 9 TYR H 1.0 . 5.0 112 83 A 8 TYR HA A 9 TYR H 1.0 . 2.7 113 84 A 9 TYR H A 8 TYR HBx 1.0 . 4.1 114 84 A 8 TYR HBy A 9 TYR H 1.0 . 4.1 115 85 A 8 TYR HD% A 9 TYR H 1.0 . 4.3 116 86 A 9 TYR H A 8 TYR HE% 1.0 . 5.0 117 87 A 8 TYR H A 19 LEU HDx% 1.0 . 4.8 118 88 A 8 TYR H A 20 LEU HBy 1.0 . 4.5 119 89 A 20 LEU HBy A 8 TYR HBx 1.0 . 4.4 120 89 A 8 TYR HBy A 20 LEU HBy 1.0 . 4.4 121 90 A 20 LEU HDy% A 8 TYR HBx 1.0 . 4.8 122 90 A 8 TYR HBy A 20 LEU HDy% 1.0 . 4.8 123 91 A 8 TYR HD% A 20 LEU HDx% 1.0 . 4.2 124 92 A 8 TYR H A 21 MET H 1.0 . 4.4 125 93 A 21 MET H A 8 TYR HBx 1.0 . 4.0 126 93 A 8 TYR HBy A 21 MET H 1.0 . 4.0 127 94 A 21 MET HBx A 8 TYR HBx 1.0 . 5.5 128 94 A 8 TYR HBy A 21 MET HBx 1.0 . 5.5 129 95 A 23 VAL H A 8 TYR H 1.0 . 5.0 130 96 A 31 ILE HB A 8 TYR HBx 1.0 . 5.5 131 96 A 8 TYR HBy A 31 ILE HB 1.0 . 5.5 132 97 A 31 ILE HD1% A 8 TYR HBx 1.0 . 3.9 133 97 A 8 TYR HBy A 31 ILE HD1% 1.0 . 3.9 134 98 A 8 TYR HD% A 31 ILE HB 1.0 . 4.5 135 99 A 8 TYR HD% A 31 ILE HD1% 1.0 . 3.9 136 100 A 8 TYR HE% A 31 ILE HD1% 1.0 . 4.5 137 101 A 8 TYR HD% A 40 VAL HGy% 1.0 . 4.4 138 102 A 8 TYR HD% A 40 VAL HGx% 1.0 . 4.3 139 103 A 8 TYR HE% A 40 VAL HGx% 1.0 . 4.0 140 104 A 8 TYR HE% A 40 VAL HGy% 1.0 . 4.4 141 105 A 8 TYR HE% A 49 VAL HGx% 1.0 . 3.3 142 106 A 61 LEU HDx% A 8 TYR HBx 1.0 . 4.4 143 106 A 8 TYR HBy A 61 LEU HDx% 1.0 . 4.4 144 107 A 8 TYR HD% A 61 LEU HDx% 1.0 . 3.8 145 108 A 8 TYR HE% A 61 LEU HDy% 1.0 . 4.7 146 109 A 8 TYR HE% A 61 LEU HDx% 1.0 . 4.3 147 110 A 8 TYR HH A 61 LEU HA 1.0 . 5.0 148 111 A 8 TYR HH A 62 ALA HA 1.0 . 5.0 149 112 A 63 ALA HA A 8 TYR HA 1.0 . 4.0 150 113 A 63 ALA HB% A 8 TYR HA 1.0 . 4.5 151 114 A 63 ALA HB% A 8 TYR HD% 1.0 . 3.2 152 115 A 63 ALA HB% A 8 TYR HE% 1.0 . 3.5 153 116 A 64 GLU H A 8 TYR HA 1.0 . 5.0 154 117 A 9 TYR H A 9 TYR HA 1.0 . 5.0 155 118 A 9 TYR HD% A 9 TYR H 1.0 . 4.3 156 119 A 9 TYR HD% A 9 TYR HA 1.0 . 4.2 157 120 A 9 TYR H A 10 ASP HA 1.0 . 5.0 158 121 A 9 TYR HA A 10 ASP H 1.0 . 2.7 159 122 A 9 TYR HA A 19 LEU HA 1.0 . 4.6 160 123 A 9 TYR HD% A 19 LEU HA 1.0 . 3.8 161 124 A 9 TYR HD% A 19 LEU HBy 1.0 . 3.9 162 124 A 9 TYR HD% A 19 LEU HBx 1.0 . 3.9 163 125 A 9 TYR HD% A 19 LEU HDx% 1.0 . 4.2 164 126 A 9 TYR HE% A 19 LEU H 1.0 . 4.6 165 127 A 9 TYR HE% A 19 LEU HA 1.0 . 4.5 166 128 A 9 TYR HE% A 19 LEU HBy 1.0 . 4.0 167 128 A 9 TYR HE% A 19 LEU HBx 1.0 . 4.0 168 129 A 9 TYR HE% A 19 LEU HG 1.0 . 4.0 169 130 A 9 TYR H A 20 LEU H 1.0 . 5.0 170 131 A 9 TYR HA A 20 LEU H 1.0 . 4.0 171 132 A 9 TYR HA A 20 LEU HG 1.0 . 4.3 172 133 A 20 LEU HDy% A 9 TYR HA 1.0 . 4.7 173 134 A 9 TYR H A 61 LEU HDx% 1.0 . 3.9 174 135 A 9 TYR H A 62 ALA H 1.0 . 4.0 175 136 A 9 TYR H A 62 ALA HB% 1.0 . 4.4 176 137 A 62 ALA H A 9 TYR HBy 1.0 . 4.9 177 137 A 62 ALA H A 9 TYR HBx 1.0 . 4.9 178 138 A 62 ALA HB% A 9 TYR HBy 1.0 . 3.8 179 138 A 62 ALA HB% A 9 TYR HBx 1.0 . 3.8 180 139 A 63 ALA HA A 9 TYR H 1.0 . 4.0 181 140 A 64 GLU H A 9 TYR H 1.0 . 5.0 182 141 A 9 TYR HE% A 64 GLU HBy 1.0 . 3.2 183 142 A 9 TYR HE% A 64 GLU HBx 1.0 . 4.3 184 143 A 9 TYR HE% A 64 GLU HGy 1.0 . 4.3 185 143 A 9 TYR HE% A 64 GLU HGx 1.0 . 4.3 186 144 A 10 ASP H A 11 GLY H 1.0 . 4.5 187 145 A 10 ASP HA A 11 GLY H 1.0 . 2.7 188 146 A 10 ASP HA A 11 GLY HAx 1.0 . 4.3 189 146 A 10 ASP HA A 11 GLY HAy 1.0 . 4.3 190 147 A 10 ASP H A 18 VAL H 1.0 . 4.0 191 148 A 10 ASP H A 18 VAL HB 1.0 . 5.1 192 149 A 18 VAL H A 10 ASP HBy 1.0 . 4.8 193 149 A 18 VAL H A 10 ASP HBx 1.0 . 4.8 194 150 A 18 VAL HB A 10 ASP HBy 1.0 . 3.9 195 150 A 18 VAL HB A 10 ASP HBx 1.0 . 3.9 196 151 A 10 ASP H A 20 LEU HG 1.0 . 4.5 197 152 A 20 LEU HDy% A 10 ASP H 1.0 . 4.4 198 153 A 20 LEU HDy% A 10 ASP HA 1.0 . 5.1 199 154 A 20 LEU HDy% A 10 ASP HBy 1.0 . 4.0 200 154 A 20 LEU HDy% A 10 ASP HBx 1.0 . 4.0 201 155 A 10 ASP HA A 60 TRP HE3 1.0 . 3.7 202 156 A 61 LEU HA A 10 ASP HA 1.0 . 4.1 203 157 A 61 LEU HDy% A 10 ASP HA 1.0 . 4.7 204 158 A 11 GLY H A 11 GLY HAx 1.0 . 5.0 205 159 A 11 GLY H A 12 HIS H 1.0 . 5.0 206 160 A 12 HIS H A 11 GLY HAx 1.0 . 5.0 207 161 A 11 GLY H A 60 TRP HBy 1.0 . 4.4 208 162 A 11 GLY H A 60 TRP HE3 1.0 . 4.1 209 163 A 60 TRP HA A 11 GLY HAx 1.0 . 4.2 210 163 A 11 GLY HAy A 60 TRP HA 1.0 . 4.2 211 164 A 60 TRP HE3 A 11 GLY HAx 1.0 . 4.0 212 164 A 11 GLY HAy A 60 TRP HE3 1.0 . 4.0 213 165 A 61 LEU HDy% A 11 GLY H 1.0 . 4.8 214 166 A 12 HIS H A 12 HIS HA 1.0 . 5.0 215 167 A 12 HIS H A 12 HIS HD2 1.0 . 5.1 216 168 A 12 HIS H A 13 LEU H 1.0 . 4.0 217 169 A 12 HIS HA A 13 LEU H 1.0 . 5.0 218 170 A 12 HIS HA A 13 LEU HA 1.0 . 4.9 219 171 A 13 LEU H A 13 LEU HA 1.0 . 4.0 220 172 A 13 LEU H A 13 LEU HBx 1.0 . 4.0 221 172 A 13 LEU H A 13 LEU HBy 1.0 . 4.0 222 173 A 13 LEU H A 13 LEU HG 1.0 . 4.4 223 174 A 13 LEU HA A 13 LEU HDx% 1.0 . 4.6 224 175 A 13 LEU HA A 13 LEU HDy% 1.0 . 4.6 225 176 A 13 LEU HDx% A 13 LEU HBx 1.0 . 3.7 226 176 A 13 LEU HBy A 13 LEU HDx% 1.0 . 3.7 227 177 A 13 LEU HDy% A 13 LEU HBx 1.0 . 3.7 228 177 A 13 LEU HBy A 13 LEU HDy% 1.0 . 3.7 229 178 A 13 LEU HA A 14 PRO HA 1.0 . 4.6 230 179 A 13 LEU HA A 14 PRO HDy 1.0 . 4.0 231 180 A 13 LEU HA A 14 PRO HDx 1.0 . 4.0 232 181 A 13 LEU HBx A 14 PRO HDx 1.0 . 4.4 233 181 A 13 LEU HBy A 14 PRO HDx 1.0 . 4.4 234 181 A 14 PRO HDy A 13 LEU HBx 1.0 . 4.4 235 181 A 13 LEU HBy A 14 PRO HDy 1.0 . 4.4 236 182 A 13 LEU HG A 14 PRO HGy 1.0 . 4.1 237 183 A 13 LEU HG A 14 PRO HGx 1.0 . 5.2 238 184 A 15 ALA H A 13 LEU HBx 1.0 . 4.2 239 184 A 13 LEU HBy A 15 ALA H 1.0 . 4.2 240 185 A 15 ALA HB% A 13 LEU HBx 1.0 . 4.2 241 185 A 13 LEU HBy A 15 ALA HB% 1.0 . 4.2 242 186 A 13 LEU HG A 15 ALA H 1.0 . 4.4 243 187 A 16 THR H A 13 LEU HBx 1.0 . 4.3 244 187 A 13 LEU HBy A 16 THR H 1.0 . 4.3 245 188 A 16 THR HB A 13 LEU HBx 1.0 . 5.5 246 188 A 13 LEU HBy A 16 THR HB 1.0 . 5.5 247 189 A 17 ARG H A 13 LEU HBx 1.0 . 5.4 248 189 A 13 LEU HBy A 17 ARG H 1.0 . 5.4 249 190 A 14 PRO HGy A 15 ALA HA 1.0 . 4.8 250 191 A 14 PRO HA A 17 ARG H 1.0 . 4.6 251 192 A 14 PRO HA A 17 ARG HA 1.0 . 4.7 252 193 A 14 PRO HA A 17 ARG HBy 1.0 . 4.6 253 193 A 14 PRO HA A 17 ARG HBx 1.0 . 4.6 254 194 A 14 PRO HA A 17 ARG HGy 1.0 . 4.7 255 194 A 14 PRO HA A 17 ARG HGx 1.0 . 4.7 256 195 A 14 PRO HA A 17 ARG HDy 1.0 . 4.2 257 195 A 14 PRO HA A 17 ARG HDx 1.0 . 4.2 258 196 A 14 PRO HBx A 17 ARG HDy 1.0 . 3.3 259 196 A 14 PRO HBy A 17 ARG HDy 1.0 . 3.3 260 196 A 17 ARG HDx A 14 PRO HBx 1.0 . 3.3 261 196 A 17 ARG HDx A 14 PRO HBy 1.0 . 3.3 262 197 A 15 ALA H A 15 ALA HA 1.0 . 4.0 263 198 A 15 ALA H A 15 ALA HB% 1.0 . 3.4 264 199 A 15 ALA H A 16 THR H 1.0 . 4.3 265 200 A 16 THR H A 15 ALA HA 1.0 . 5.0 266 201 A 15 ALA HB% A 16 THR H 1.0 . 3.9 267 202 A 16 THR H A 16 THR HA 1.0 . 5.0 268 203 A 16 THR H A 16 THR HG2% 1.0 . 4.0 269 204 A 16 THR HA A 16 THR HG2% 1.0 . 3.2 270 205 A 16 THR H A 17 ARG H 1.0 . 2.7 271 206 A 16 THR H A 17 ARG HA 1.0 . 4.2 272 207 A 17 ARG H A 16 THR HA 1.0 . 5.0 273 208 A 17 ARG H A 17 ARG HA 1.0 . 4.0 274 209 A 17 ARG H A 17 ARG HBy 1.0 . 4.2 275 209 A 17 ARG H A 17 ARG HBx 1.0 . 4.2 276 210 A 17 ARG H A 17 ARG HGy 1.0 . 3.9 277 210 A 17 ARG H A 17 ARG HGx 1.0 . 3.9 278 211 A 17 ARG H A 17 ARG HDy 1.0 . 5.3 279 211 A 17 ARG H A 17 ARG HDx 1.0 . 5.3 280 212 A 18 VAL H A 17 ARG HA 1.0 . 2.7 281 213 A 18 VAL H A 17 ARG HGy 1.0 . 3.9 282 213 A 18 VAL H A 17 ARG HGx 1.0 . 3.9 283 214 A 18 VAL H A 18 VAL HA 1.0 . 5.0 284 215 A 18 VAL H A 18 VAL HB 1.0 . 4.0 285 216 A 18 VAL H A 18 VAL HGy% 1.0 . 3.7 286 217 A 18 VAL H A 18 VAL HGx% 1.0 . 4.7 287 218 A 18 VAL HA A 18 VAL HGy% 1.0 . 3.5 288 219 A 18 VAL HA A 18 VAL HGx% 1.0 . 3.6 289 220 A 19 LEU H A 18 VAL H 1.0 . 4.4 290 221 A 19 LEU H A 18 VAL HA 1.0 . 2.7 291 222 A 19 LEU H A 18 VAL HB 1.0 . 5.2 292 223 A 19 LEU H A 18 VAL HGy% 1.0 . 4.3 293 224 A 19 LEU H A 18 VAL HGx% 1.0 . 3.7 294 225 A 19 LEU HA A 18 VAL HGx% 1.0 . 5.2 295 226 A 19 LEU HA A 19 LEU H 1.0 . 5.0 296 227 A 19 LEU H A 19 LEU HBy 1.0 . 3.8 297 227 A 19 LEU HBx A 19 LEU H 1.0 . 3.8 298 228 A 19 LEU HG A 19 LEU H 1.0 . 4.5 299 229 A 19 LEU HDx% A 19 LEU H 1.0 . 4.3 300 230 A 19 LEU HDy% A 19 LEU H 1.0 . 4.5 301 231 A 19 LEU HDy% A 19 LEU HA 1.0 . 4.5 302 232 A 19 LEU HDx% A 19 LEU HA 1.0 . 4.2 303 233 A 19 LEU HDy% A 19 LEU HBy 1.0 . 3.9 304 233 A 19 LEU HDy% A 19 LEU HBx 1.0 . 3.9 305 234 A 19 LEU HDx% A 19 LEU HBy 1.0 . 3.9 306 234 A 19 LEU HDx% A 19 LEU HBx 1.0 . 3.9 307 235 A 19 LEU H A 20 LEU H 1.0 . 5.0 308 236 A 19 LEU HA A 20 LEU H 1.0 . 2.7 309 237 A 19 LEU HA A 20 LEU HG 1.0 . 4.0 310 238 A 20 LEU H A 19 LEU HBy 1.0 . 4.6 311 238 A 19 LEU HBx A 20 LEU H 1.0 . 4.6 312 239 A 19 LEU HDy% A 20 LEU H 1.0 . 4.3 313 240 A 19 LEU HDx% A 20 LEU H 1.0 . 4.4 314 241 A 19 LEU HDx% A 21 MET H 1.0 . 4.9 315 242 A 19 LEU HDy% A 21 MET H 1.0 . 4.2 316 243 A 22 TYR HD% A 19 LEU HDy% 1.0 . 3.9 317 244 A 22 TYR HD% A 19 LEU HDx% 1.0 . 4.4 318 245 A 19 LEU HDy% A 22 TYR HE% 1.0 . 3.7 319 246 A 19 LEU HDx% A 22 TYR HE% 1.0 . 3.8 320 247 A 20 LEU H A 20 LEU HA 1.0 . 5.0 321 248 A 20 LEU HBy A 20 LEU H 1.0 . 4.2 322 249 A 20 LEU H A 20 LEU HG 1.0 . 4.2 323 250 A 20 LEU HDy% A 20 LEU H 1.0 . 4.0 324 251 A 20 LEU HDx% A 20 LEU H 1.0 . 4.1 325 252 A 20 LEU HDy% A 20 LEU HA 1.0 . 3.2 326 253 A 20 LEU HBy A 20 LEU HDy% 1.0 . 3.8 327 254 A 20 LEU HBy A 20 LEU HDx% 1.0 . 3.4 328 255 A 20 LEU HDy% A 20 LEU HBx 1.0 . 3.5 329 256 A 20 LEU HDx% A 20 LEU HBx 1.0 . 3.6 330 257 A 21 MET H A 20 LEU H 1.0 . 2.7 331 258 A 21 MET H A 20 LEU HA 1.0 . 5.0 332 259 A 20 LEU HBy A 21 MET H 1.0 . 3.9 333 260 A 21 MET H A 20 LEU HBx 1.0 . 4.1 334 261 A 20 LEU HBy A 21 MET HBy 1.0 . 5.3 335 262 A 20 LEU HBx A 21 MET HBy 1.0 . 4.1 336 263 A 20 LEU HBx A 31 ILE HG2% 1.0 . 4.1 337 264 A 31 ILE HD1% A 20 LEU HBx 1.0 . 4.6 338 265 A 20 LEU HDx% A 33 ALA HB% 1.0 . 3.1 339 266 A 20 LEU HDy% A 60 TRP HZ3 1.0 . 4.5 340 267 A 20 LEU HDx% A 60 TRP HZ3 1.0 . 4.6 341 268 A 20 LEU HDy% A 61 LEU HDx% 1.0 . 4.5 342 269 A 20 LEU HDy% A 61 LEU HDy% 1.0 . 4.9 343 270 A 21 MET H A 21 MET HA 1.0 . 5.0 344 271 A 21 MET HA A 22 TYR H 1.0 . 2.7 345 272 A 22 TYR HA A 21 MET HA 1.0 . 5.3 346 273 A 21 MET HA A 22 TYR HBy 1.0 . 4.6 347 274 A 21 MET HBy A 22 TYR H 1.0 . 4.2 348 275 A 21 MET HBx A 22 TYR H 1.0 . 3.8 349 276 A 22 TYR HA A 21 MET HBx 1.0 . 4.5 350 277 A 22 TYR H A 21 MET HGx 1.0 . 4.2 351 277 A 22 TYR H A 21 MET HGy 1.0 . 4.2 352 278 A 23 VAL HA A 21 MET HBx 1.0 . 5.5 353 279 A 23 VAL HGy% A 21 MET HBx 1.0 . 4.4 354 280 A 21 MET HBy A 31 ILE HG2% 1.0 . 4.2 355 281 A 31 ILE HD1% A 21 MET HBy 1.0 . 4.6 356 282 A 22 TYR H A 22 TYR HBy 1.0 . 4.1 357 283 A 22 TYR HBx A 22 TYR H 1.0 . 4.1 358 284 A 22 TYR HD% A 22 TYR H 1.0 . 3.8 359 285 A 22 TYR HD% A 22 TYR HA 1.0 . 4.4 360 286 A 23 VAL H A 22 TYR H 1.0 . 5.0 361 287 A 23 VAL H A 22 TYR HA 1.0 . 2.7 362 288 A 22 TYR HBx A 23 VAL H 1.0 . 4.1 363 289 A 22 TYR HBx A 23 VAL HA 1.0 . 4.7 364 290 A 22 TYR HD% A 23 VAL H 1.0 . 4.9 365 291 A 23 VAL H A 23 VAL HA 1.0 . 5.0 366 292 A 23 VAL H A 23 VAL HB 1.0 . 3.9 367 293 A 23 VAL H A 23 VAL HGx% 1.0 . 4.3 368 294 A 23 VAL H A 23 VAL HGy% 1.0 . 3.7 369 295 A 23 VAL HA A 23 VAL HGx% 1.0 . 3.5 370 296 A 23 VAL HA A 23 VAL HGy% 1.0 . 3.7 371 297 A 23 VAL HA A 24 ARG H 1.0 . 2.7 372 298 A 24 ARG H A 23 VAL HGx% 1.0 . 3.8 373 299 A 24 ARG H A 23 VAL HGy% 1.0 . 4.2 374 300 A 23 VAL HGx% A 29 ALA H 1.0 . 4.5 375 301 A 23 VAL HGx% A 29 ALA HB% 1.0 . 3.2 376 302 A 23 VAL HGy% A 31 ILE HG1y 1.0 . 4.2 377 302 A 23 VAL HGy% A 31 ILE HG1x 1.0 . 4.2 378 303 A 23 VAL HGy% A 31 ILE HD1% 1.0 . 3.7 379 304 A 40 VAL HGy% A 23 VAL HGx% 1.0 . 3.8 380 305 A 23 VAL HGy% A 40 VAL HGy% 1.0 . 3.1 381 306 A 23 VAL HB A 42 ALA HB% 1.0 . 4.2 382 307 A 23 VAL HGx% A 42 ALA H 1.0 . 4.3 383 308 A 23 VAL HGx% A 42 ALA HB% 1.0 . 3.2 384 309 A 24 ARG HA A 24 ARG H 1.0 . 5.0 385 310 A 24 ARG H A 24 ARG HBx 1.0 . 3.7 386 310 A 24 ARG H A 24 ARG HBy 1.0 . 3.7 387 311 A 24 ARG H A 24 ARG HGx 1.0 . 4.4 388 311 A 24 ARG H A 24 ARG HGy 1.0 . 4.4 389 312 A 24 ARG HA A 24 ARG HDx 1.0 . 4.5 390 312 A 24 ARG HA A 24 ARG HDy 1.0 . 4.5 391 313 A 24 ARG HBx A 24 ARG HDx 1.0 . 4.1 392 313 A 24 ARG HBy A 24 ARG HDx 1.0 . 4.1 393 313 A 24 ARG HDy A 24 ARG HBx 1.0 . 4.1 394 313 A 24 ARG HBy A 24 ARG HDy 1.0 . 4.1 395 314 A 24 ARG HA A 25 ILE H 1.0 . 2.7 396 315 A 24 ARG HA A 25 ILE HA 1.0 . 4.5 397 316 A 24 ARG HA A 25 ILE HB 1.0 . 4.9 398 317 A 25 ILE H A 24 ARG HBx 1.0 . 4.6 399 317 A 24 ARG HBy A 25 ILE H 1.0 . 4.6 400 318 A 24 ARG H A 27 THR HG2% 1.0 . 5.2 401 319 A 27 THR HG2% A 24 ARG HBx 1.0 . 4.0 402 319 A 24 ARG HBy A 27 THR HG2% 1.0 . 4.0 403 320 A 27 THR HG2% A 24 ARG HGx 1.0 . 5.3 404 320 A 24 ARG HGy A 27 THR HG2% 1.0 . 5.3 405 321 A 27 THR HG2% A 24 ARG HDx 1.0 . 5.3 406 321 A 24 ARG HDy A 27 THR HG2% 1.0 . 5.3 407 322 A 25 ILE H A 25 ILE HG2% 1.0 . 4.2 408 323 A 25 ILE H A 25 ILE HG1x 1.0 . 3.6 409 323 A 25 ILE H A 25 ILE HG1y 1.0 . 3.6 410 324 A 25 ILE H A 25 ILE HD1% 1.0 . 4.2 411 325 A 25 ILE HA A 25 ILE HG1y 1.0 . 4.1 412 326 A 25 ILE HA A 25 ILE HG1x 1.0 . 4.1 413 327 A 25 ILE HA A 25 ILE HG2% 1.0 . 3.8 414 328 A 25 ILE HA A 25 ILE HD1% 1.0 . 4.3 415 329 A 25 ILE HB A 25 ILE HG1x 1.0 . 2.4 416 329 A 25 ILE HB A 25 ILE HG1y 1.0 . 2.4 417 330 A 25 ILE HB A 25 ILE HD1% 1.0 . 3.3 418 331 A 25 ILE HG2% A 25 ILE HG1x 1.0 . 3.2 419 331 A 25 ILE HG2% A 25 ILE HG1y 1.0 . 3.2 420 332 A 25 ILE HG2% A 25 ILE HD1% 1.0 . 3.3 421 333 A 25 ILE HA A 26 GLY H 1.0 . 2.7 422 334 A 25 ILE HB A 26 GLY H 1.0 . 4.3 423 335 A 25 ILE HG2% A 26 GLY H 1.0 . 4.1 424 336 A 25 ILE HG2% A 26 GLY HAy 1.0 . 4.3 425 337 A 25 ILE HA A 27 THR H 1.0 . 4.0 426 338 A 42 ALA HB% A 25 ILE HA 1.0 . 3.7 427 339 A 42 ALA HB% A 25 ILE HG1x 1.0 . 3.8 428 339 A 42 ALA HB% A 25 ILE HG1y 1.0 . 3.8 429 340 A 25 ILE HA A 43 LYS H 1.0 . 5.4 430 341 A 25 ILE HG2% A 44 ASP H 1.0 . 4.0 431 342 A 25 ILE HG2% A 44 ASP HA 1.0 . 3.4 432 343 A 25 ILE HD1% A 44 ASP HA 1.0 . 3.8 433 344 A 25 ILE HG2% A 45 GLN H 1.0 . 4.5 434 345 A 25 ILE HD1% A 45 GLN H 1.0 . 4.4 435 346 A 25 ILE HD1% A 45 GLN HA 1.0 . 3.9 436 347 A 26 GLY H A 26 GLY HAy 1.0 . 5.0 437 348 A 26 GLY H A 26 GLY HAx 1.0 . 2.7 438 349 A 26 GLY H A 27 THR H 1.0 . 2.7 439 350 A 27 THR HG2% A 26 GLY H 1.0 . 4.6 440 351 A 26 GLY HAy A 27 THR H 1.0 . 5.0 441 352 A 27 THR H A 26 GLY HAx 1.0 . 5.0 442 353 A 42 ALA HB% A 26 GLY H 1.0 . 4.0 443 354 A 27 THR H A 27 THR HA 1.0 . 4.0 444 355 A 27 THR HG2% A 27 THR H 1.0 . 3.7 445 356 A 27 THR HG2% A 27 THR HA 1.0 . 3.5 446 357 A 27 THR H A 28 THR H 1.0 . 5.0 447 358 A 27 THR HA A 28 THR H 1.0 . 2.7 448 359 A 28 THR H A 27 THR HB 1.0 . 3.7 449 360 A 27 THR HG2% A 28 THR H 1.0 . 3.6 450 361 A 28 THR H A 28 THR HA 1.0 . 4.0 451 362 A 28 THR H A 28 THR HG2% 1.0 . 3.5 452 363 A 28 THR HA A 28 THR HG2% 1.0 . 3.5 453 364 A 29 ALA H A 28 THR HA 1.0 . 2.7 454 365 A 29 ALA H A 28 THR HB 1.0 . 3.8 455 366 A 29 ALA H A 28 THR HG2% 1.0 . 4.0 456 367 A 28 THR HA A 41 GLU HA 1.0 . 4.0 457 368 A 28 THR HG2% A 41 GLU HA 1.0 . 3.6 458 369 A 28 THR HG2% A 41 GLU HBy 1.0 . 4.4 459 370 A 28 THR HG2% A 41 GLU HGy 1.0 . 4.0 460 370 A 28 THR HG2% A 41 GLU HGx 1.0 . 4.0 461 371 A 42 ALA H A 28 THR HA 1.0 . 4.0 462 372 A 42 ALA H A 28 THR HG2% 1.0 . 3.8 463 373 A 29 ALA H A 29 ALA HA 1.0 . 5.0 464 374 A 29 ALA H A 29 ALA HB% 1.0 . 3.7 465 375 A 29 ALA HA A 30 THR H 1.0 . 2.7 466 376 A 29 ALA HB% A 30 THR H 1.0 . 3.3 467 377 A 29 ALA H A 40 VAL H 1.0 . 4.7 468 378 A 40 VAL HGy% A 29 ALA H 1.0 . 3.9 469 379 A 29 ALA H A 41 GLU HA 1.0 . 4.6 470 380 A 29 ALA H A 42 ALA H 1.0 . 5.0 471 381 A 30 THR H A 30 THR HA 1.0 . 4.0 472 382 A 30 THR H A 30 THR HG2% 1.0 . 4.0 473 383 A 30 THR HA A 30 THR HG2% 1.0 . 3.7 474 384 A 30 THR HA A 31 ILE H 1.0 . 2.7 475 385 A 30 THR HG2% A 31 ILE H 1.0 . 3.7 476 386 A 30 THR HG2% A 37 GLU HBx 1.0 . 3.3 477 386 A 30 THR HG2% A 37 GLU HBy 1.0 . 3.3 478 387 A 30 THR HG2% A 37 GLU HGy 1.0 . 4.2 479 387 A 30 THR HG2% A 37 GLU HGx 1.0 . 4.2 480 388 A 30 THR HA A 38 PHE H 1.0 . 5.0 481 389 A 30 THR HG2% A 38 PHE H 1.0 . 4.1 482 390 A 30 THR HA A 39 GLU HA 1.0 . 5.0 483 391 A 30 THR HG2% A 39 GLU H 1.0 . 4.3 484 392 A 30 THR HG2% A 39 GLU HA 1.0 . 4.5 485 393 A 30 THR HG2% A 39 GLU HGx 1.0 . 4.1 486 393 A 30 THR HG2% A 39 GLU HGy 1.0 . 4.1 487 394 A 40 VAL H A 30 THR HA 1.0 . 4.0 488 395 A 31 ILE H A 31 ILE HA 1.0 . 5.0 489 396 A 31 ILE HB A 31 ILE H 1.0 . 3.7 490 397 A 31 ILE H A 31 ILE HG1y 1.0 . 4.0 491 397 A 31 ILE HG1x A 31 ILE H 1.0 . 4.0 492 398 A 31 ILE HG2% A 31 ILE H 1.0 . 4.1 493 399 A 31 ILE HD1% A 31 ILE H 1.0 . 4.5 494 400 A 31 ILE HG2% A 31 ILE HA 1.0 . 3.7 495 401 A 31 ILE HB A 31 ILE HD1% 1.0 . 3.9 496 402 A 31 ILE HG2% A 31 ILE HG1y 1.0 . 3.8 497 402 A 31 ILE HG2% A 31 ILE HG1x 1.0 . 3.8 498 403 A 31 ILE HD1% A 31 ILE HG2% 1.0 . 3.4 499 404 A 31 ILE H A 32 THR H 1.0 . 5.1 500 405 A 31 ILE HA A 32 THR H 1.0 . 3.1 501 406 A 31 ILE HB A 32 THR H 1.0 . 4.3 502 407 A 31 ILE HG2% A 32 THR H 1.0 . 4.0 503 408 A 31 ILE H A 37 GLU HA 1.0 . 5.0 504 409 A 31 ILE H A 38 PHE H 1.0 . 5.0 505 410 A 31 ILE H A 38 PHE HA 1.0 . 5.0 506 411 A 31 ILE H A 38 PHE HBy 1.0 . 5.0 507 412 A 31 ILE HB A 38 PHE HBx 1.0 . 5.3 508 413 A 38 PHE HD% A 31 ILE HG1y 1.0 . 5.3 509 413 A 31 ILE HG1x A 38 PHE HD% 1.0 . 5.3 510 414 A 31 ILE HD1% A 38 PHE HD% 1.0 . 4.5 511 415 A 31 ILE H A 39 GLU H 1.0 . 5.0 512 416 A 31 ILE H A 39 GLU HA 1.0 . 4.0 513 417 A 40 VAL H A 31 ILE H 1.0 . 5.0 514 418 A 40 VAL HGy% A 31 ILE H 1.0 . 5.0 515 419 A 31 ILE HB A 40 VAL HGx% 1.0 . 5.1 516 420 A 40 VAL HGy% A 31 ILE HG1y 1.0 . 4.2 517 420 A 40 VAL HGy% A 31 ILE HG1x 1.0 . 4.2 518 421 A 31 ILE HD1% A 40 VAL HGx% 1.0 . 3.5 519 422 A 31 ILE HD1% A 40 VAL HGy% 1.0 . 3.1 520 423 A 32 THR H A 32 THR HA 1.0 . 4.0 521 424 A 32 THR H A 32 THR HB 1.0 . 3.9 522 425 A 32 THR H A 32 THR HG2% 1.0 . 4.1 523 426 A 32 THR HA A 32 THR HG2% 1.0 . 3.8 524 427 A 32 THR H A 33 ALA H 1.0 . 5.0 525 428 A 32 THR HA A 33 ALA H 1.0 . 2.7 526 429 A 32 THR HB A 33 ALA H 1.0 . 4.6 527 430 A 32 THR HG2% A 33 ALA H 1.0 . 3.9 528 431 A 32 THR HG2% A 36 HIS H 1.0 . 4.7 529 432 A 37 GLU HA A 32 THR HA 1.0 . 5.0 530 433 A 38 PHE H A 32 THR H 1.0 . 5.0 531 434 A 38 PHE H A 32 THR HA 1.0 . 4.0 532 435 A 33 ALA H A 33 ALA HA 1.0 . 5.0 533 436 A 33 ALA HB% A 33 ALA H 1.0 . 3.6 534 437 A 33 ALA H A 34 ARG H 1.0 . 4.4 535 438 A 33 ALA HA A 34 ARG H 1.0 . 2.7 536 439 A 33 ALA HB% A 34 ARG H 1.0 . 4.3 537 440 A 33 ALA HB% A 34 ARG HGy 1.0 . 3.5 538 440 A 33 ALA HB% A 34 ARG HGx 1.0 . 3.5 539 441 A 33 ALA HA A 35 GLY H 1.0 . 4.0 540 442 A 33 ALA H A 36 HIS H 1.0 . 4.0 541 443 A 33 ALA H A 36 HIS HA 1.0 . 5.1 542 444 A 37 GLU HA A 33 ALA H 1.0 . 5.0 543 445 A 38 PHE H A 33 ALA H 1.0 . 5.0 544 446 A 38 PHE HD% A 33 ALA H 1.0 . 4.5 545 447 A 33 ALA H A 38 PHE HE% 1.0 . 4.4 546 448 A 33 ALA HB% A 38 PHE HD% 1.0 . 3.8 547 449 A 33 ALA HB% A 38 PHE HE% 1.0 . 3.5 548 450 A 33 ALA HB% A 60 TRP HZ3 1.0 . 3.8 549 451 A 34 ARG H A 34 ARG HA 1.0 . 4.0 550 452 A 34 ARG H A 34 ARG HGy 1.0 . 4.1 551 452 A 34 ARG H A 34 ARG HGx 1.0 . 4.1 552 453 A 34 ARG HBx A 34 ARG HDy 1.0 . 3.5 553 453 A 34 ARG HBy A 34 ARG HDy 1.0 . 3.5 554 453 A 34 ARG HDx A 34 ARG HBy 1.0 . 3.5 555 453 A 34 ARG HBx A 34 ARG HDx 1.0 . 3.5 556 454 A 34 ARG HE A 34 ARG HBy 1.0 . 5.1 557 454 A 34 ARG HBx A 34 ARG HE 1.0 . 5.1 558 455 A 34 ARG H A 35 GLY H 1.0 . 4.6 559 456 A 35 GLY H A 34 ARG HA 1.0 . 4.0 560 457 A 34 ARG HA A 35 GLY HAx 1.0 . 4.5 561 457 A 34 ARG HA A 35 GLY HAy 1.0 . 4.5 562 458 A 35 GLY H A 34 ARG HBy 1.0 . 4.5 563 458 A 35 GLY H A 34 ARG HBx 1.0 . 4.5 564 459 A 60 TRP HH2 A 34 ARG HBy 1.0 . 5.3 565 459 A 34 ARG HBx A 60 TRP HH2 1.0 . 5.3 566 460 A 60 TRP HH2 A 34 ARG HGy 1.0 . 4.6 567 460 A 34 ARG HGx A 60 TRP HH2 1.0 . 4.6 568 461 A 60 TRP HE3 A 34 ARG HDy 1.0 . 4.3 569 461 A 60 TRP HE3 A 34 ARG HDx 1.0 . 4.3 570 462 A 60 TRP HZ3 A 34 ARG HDy 1.0 . 4.5 571 462 A 60 TRP HZ3 A 34 ARG HDx 1.0 . 4.5 572 463 A 60 TRP HZ2 A 34 ARG HDy 1.0 . 4.0 573 463 A 34 ARG HDx A 60 TRP HZ2 1.0 . 4.0 574 464 A 60 TRP HH2 A 34 ARG HDy 1.0 . 4.5 575 464 A 34 ARG HDx A 60 TRP HH2 1.0 . 4.5 576 465 A 35 GLY H A 35 GLY HAy 1.0 . 5.0 577 466 A 35 GLY H A 35 GLY HAx 1.0 . 5.0 578 467 A 35 GLY HAy A 35 GLY HAx 1.0 . 5.0 579 468 A 36 HIS H A 35 GLY H 1.0 . 4.0 580 469 A 36 HIS H A 35 GLY HAy 1.0 . 5.0 581 470 A 36 HIS H A 36 HIS HBy 1.0 . 4.1 582 470 A 36 HIS H A 36 HIS HBx 1.0 . 4.1 583 471 A 36 HIS HA A 36 HIS HD2 1.0 . 4.5 584 472 A 36 HIS H A 37 GLU H 1.0 . 4.5 585 473 A 36 HIS HA A 37 GLU H 1.0 . 2.7 586 474 A 37 GLU HA A 36 HIS HA 1.0 . 4.5 587 475 A 37 GLU H A 36 HIS HBy 1.0 . 4.6 588 475 A 36 HIS HBx A 37 GLU H 1.0 . 4.6 589 476 A 38 PHE HE% A 36 HIS HBy 1.0 . 4.1 590 476 A 38 PHE HE% A 36 HIS HBx 1.0 . 4.1 591 477 A 38 PHE HZ A 36 HIS HBy 1.0 . 3.6 592 477 A 36 HIS HBx A 38 PHE HZ 1.0 . 3.6 593 478 A 37 GLU HA A 37 GLU H 1.0 . 5.0 594 479 A 37 GLU HBy A 37 GLU H 1.0 . 3.8 595 480 A 37 GLU H A 37 GLU HBx 1.0 . 3.8 596 481 A 37 GLU H A 37 GLU HGy 1.0 . 4.6 597 481 A 37 GLU HGx A 37 GLU H 1.0 . 4.6 598 482 A 38 PHE H A 37 GLU HA 1.0 . 2.7 599 483 A 38 PHE H A 37 GLU HBx 1.0 . 3.7 600 483 A 37 GLU HBy A 38 PHE H 1.0 . 3.7 601 484 A 39 GLU H A 37 GLU HBx 1.0 . 5.3 602 484 A 37 GLU HBy A 39 GLU H 1.0 . 5.3 603 485 A 38 PHE H A 38 PHE HA 1.0 . 5.0 604 486 A 38 PHE H A 38 PHE HBx 1.0 . 4.2 605 487 A 38 PHE H A 38 PHE HD% 1.0 . 3.6 606 488 A 38 PHE HA A 38 PHE HD% 1.0 . 3.7 607 489 A 38 PHE HD% A 38 PHE HZ 1.0 . 3.9 608 490 A 38 PHE H A 39 GLU H 1.0 . 5.0 609 491 A 38 PHE H A 39 GLU HA 1.0 . 5.0 610 492 A 39 GLU H A 38 PHE HA 1.0 . 3.3 611 493 A 39 GLU H A 38 PHE HBy 1.0 . 4.4 612 494 A 40 VAL HGx% A 38 PHE HBy 1.0 . 4.6 613 495 A 40 VAL HGx% A 38 PHE HBx 1.0 . 4.6 614 496 A 40 VAL HGx% A 38 PHE HD% 1.0 . 4.8 615 497 A 38 PHE HBx A 51 LEU HBx 1.0 . 5.5 616 498 A 38 PHE HBy A 51 LEU HDy% 1.0 . 4.0 617 499 A 38 PHE HBx A 51 LEU HDx% 1.0 . 4.3 618 500 A 38 PHE HBx A 51 LEU HDy% 1.0 . 4.3 619 501 A 38 PHE HD% A 51 LEU HDy% 1.0 . 3.5 620 502 A 38 PHE HE% A 51 LEU HDx% 1.0 . 5.1 621 503 A 60 TRP HZ3 A 38 PHE HE% 1.0 . 4.6 622 504 A 60 TRP HH2 A 38 PHE HZ 1.0 . 4.0 623 505 A 61 LEU HDy% A 38 PHE HD% 1.0 . 4.4 624 506 A 61 LEU HDx% A 38 PHE HD% 1.0 . 4.4 625 507 A 61 LEU HDy% A 38 PHE HE% 1.0 . 4.7 626 508 A 61 LEU HDx% A 38 PHE HE% 1.0 . 4.4 627 509 A 39 GLU HA A 39 GLU H 1.0 . 4.0 628 510 A 39 GLU H A 39 GLU HBy 1.0 . 3.5 629 510 A 39 GLU H A 39 GLU HBx 1.0 . 3.5 630 511 A 39 GLU H A 39 GLU HGx 1.0 . 4.3 631 511 A 39 GLU H A 39 GLU HGy 1.0 . 4.3 632 512 A 39 GLU HA A 39 GLU HGx 1.0 . 4.2 633 512 A 39 GLU HA A 39 GLU HGy 1.0 . 4.2 634 513 A 40 VAL H A 39 GLU H 1.0 . 5.0 635 514 A 40 VAL HGx% A 39 GLU H 1.0 . 4.6 636 515 A 40 VAL H A 39 GLU HA 1.0 . 2.7 637 516 A 40 VAL HGy% A 39 GLU HA 1.0 . 5.2 638 517 A 40 VAL H A 39 GLU HBy 1.0 . 4.2 639 517 A 40 VAL H A 39 GLU HBx 1.0 . 4.2 640 518 A 40 VAL H A 39 GLU HGx 1.0 . 4.3 641 518 A 40 VAL H A 39 GLU HGy 1.0 . 4.3 642 519 A 39 GLU H A 51 LEU HG 1.0 . 5.5 643 520 A 39 GLU H A 51 LEU HDy% 1.0 . 4.0 644 521 A 39 GLU H A 52 THR H 1.0 . 5.0 645 522 A 52 THR H A 39 GLU HBy 1.0 . 4.3 646 522 A 39 GLU HBx A 52 THR H 1.0 . 4.3 647 523 A 52 THR HG2% A 39 GLU HBy 1.0 . 3.9 648 523 A 39 GLU HBx A 52 THR HG2% 1.0 . 3.9 649 524 A 52 THR H A 39 GLU HGx 1.0 . 5.0 650 524 A 39 GLU HGy A 52 THR H 1.0 . 5.0 651 525 A 52 THR HG2% A 39 GLU HGx 1.0 . 3.6 652 525 A 39 GLU HGy A 52 THR HG2% 1.0 . 3.6 653 526 A 40 VAL H A 40 VAL HA 1.0 . 5.0 654 527 A 40 VAL HGx% A 40 VAL H 1.0 . 4.1 655 528 A 40 VAL HGy% A 40 VAL H 1.0 . 3.5 656 529 A 40 VAL HGx% A 40 VAL HA 1.0 . 3.7 657 530 A 40 VAL HA A 41 GLU H 1.0 . 2.7 658 531 A 41 GLU H A 40 VAL HB 1.0 . 3.8 659 532 A 40 VAL HGx% A 41 GLU H 1.0 . 4.2 660 533 A 40 VAL HGy% A 41 GLU H 1.0 . 4.3 661 534 A 40 VAL HA A 51 LEU HA 1.0 . 4.6 662 535 A 40 VAL HGx% A 51 LEU HA 1.0 . 4.5 663 536 A 40 VAL HGx% A 51 LEU HBx 1.0 . 5.5 664 537 A 40 VAL HGx% A 51 LEU HG 1.0 . 4.4 665 538 A 52 THR H A 40 VAL HA 1.0 . 4.0 666 539 A 41 GLU HA A 41 GLU H 1.0 . 5.0 667 540 A 41 GLU H A 41 GLU HBx 1.0 . 4.0 668 541 A 42 ALA H A 41 GLU H 1.0 . 4.4 669 542 A 42 ALA H A 41 GLU HA 1.0 . 2.7 670 543 A 42 ALA HB% A 41 GLU HA 1.0 . 4.5 671 544 A 42 ALA H A 41 GLU HBx 1.0 . 4.8 672 545 A 42 ALA H A 41 GLU HBy 1.0 . 4.5 673 546 A 42 ALA H A 41 GLU HGy 1.0 . 4.2 674 546 A 42 ALA H A 41 GLU HGx 1.0 . 4.2 675 547 A 41 GLU HGx A 43 LYS HGy 1.0 . 3.6 676 547 A 41 GLU HGy A 43 LYS HGy 1.0 . 3.6 677 547 A 43 LYS HGx A 41 GLU HGy 1.0 . 3.6 678 547 A 41 GLU HGx A 43 LYS HGx 1.0 . 3.6 679 548 A 41 GLU H A 50 ILE HG2% 1.0 . 4.1 680 549 A 41 GLU HBx A 50 ILE HG2% 1.0 . 3.7 681 550 A 41 GLU H A 51 LEU HA 1.0 . 5.0 682 551 A 42 ALA HB% A 42 ALA H 1.0 . 3.5 683 552 A 43 LYS H A 42 ALA HA 1.0 . 2.7 684 553 A 42 ALA HB% A 43 LYS H 1.0 . 4.0 685 554 A 44 ASP H A 42 ALA HA 1.0 . 4.5 686 555 A 43 LYS H A 43 LYS HA 1.0 . 4.0 687 556 A 43 LYS H A 43 LYS HBy 1.0 . 3.5 688 556 A 43 LYS H A 43 LYS HBx 1.0 . 3.5 689 557 A 43 LYS H A 43 LYS HGy 1.0 . 4.4 690 557 A 43 LYS H A 43 LYS HGx 1.0 . 4.4 691 558 A 43 LYS H A 44 ASP H 1.0 . 3.8 692 559 A 44 ASP H A 43 LYS HA 1.0 . 5.0 693 560 A 44 ASP H A 43 LYS HBy 1.0 . 3.6 694 560 A 44 ASP H A 43 LYS HBx 1.0 . 3.6 695 561 A 44 ASP H A 44 ASP HA 1.0 . 2.7 696 562 A 44 ASP H A 44 ASP HBx 1.0 . 4.1 697 562 A 44 ASP H A 44 ASP HBy 1.0 . 4.1 698 563 A 44 ASP HA A 45 GLN H 1.0 . 2.7 699 564 A 45 GLN H A 44 ASP HBx 1.0 . 3.3 700 564 A 45 GLN H A 44 ASP HBy 1.0 . 3.3 701 565 A 46 ASN H A 44 ASP HBx 1.0 . 4.1 702 565 A 44 ASP HBy A 46 ASN H 1.0 . 4.1 703 566 A 44 ASP H A 47 CYS HA 1.0 . 5.0 704 567 A 45 GLN H A 45 GLN HA 1.0 . 5.0 705 568 A 45 GLN HBy A 45 GLN H 1.0 . 4.1 706 569 A 45 GLN H A 45 GLN HBx 1.0 . 4.1 707 570 A 45 GLN H A 45 GLN HGx 1.0 . 4.4 708 570 A 45 GLN H A 45 GLN HGy 1.0 . 4.4 709 571 A 45 GLN H A 46 ASN H 1.0 . 4.4 710 572 A 45 GLN HA A 46 ASN H 1.0 . 5.0 711 573 A 45 GLN HA A 47 CYS H 1.0 . 4.8 712 574 A 46 ASN H A 46 ASN HA 1.0 . 4.0 713 575 A 46 ASN H A 47 CYS H 1.0 . 4.0 714 576 A 47 CYS H A 46 ASN HA 1.0 . 5.0 715 577 A 47 CYS H A 46 ASN HBy 1.0 . 4.3 716 577 A 47 CYS H A 46 ASN HBx 1.0 . 4.3 717 578 A 47 CYS HA A 47 CYS H 1.0 . 5.0 718 579 A 47 CYS H A 48 LYS H 1.0 . 4.5 719 580 A 47 CYS HA A 48 LYS H 1.0 . 4.0 720 581 A 48 LYS H A 47 CYS HBy 1.0 . 4.4 721 581 A 47 CYS HBx A 48 LYS H 1.0 . 4.4 722 582 A 48 LYS HA A 47 CYS HBy 1.0 . 4.4 723 582 A 47 CYS HBx A 48 LYS HA 1.0 . 4.4 724 583 A 63 ALA HB% A 47 CYS HBy 1.0 . 4.0 725 584 A 47 CYS HBx A 63 ALA HB% 1.0 . 4.0 726 585 A 48 LYS H A 48 LYS HA 1.0 . 4.0 727 586 A 48 LYS H A 48 LYS HBx 1.0 . 3.4 728 586 A 48 LYS H A 48 LYS HBy 1.0 . 3.4 729 587 A 48 LYS H A 48 LYS HGy 1.0 . 3.8 730 587 A 48 LYS H A 48 LYS HGx 1.0 . 3.8 731 588 A 48 LYS HA A 49 VAL H 1.0 . 2.7 732 589 A 49 VAL HGx% A 48 LYS HA 1.0 . 4.8 733 590 A 48 LYS HA A 49 VAL HGy% 1.0 . 4.4 734 591 A 49 VAL H A 48 LYS HBx 1.0 . 3.8 735 591 A 48 LYS HBy A 49 VAL H 1.0 . 3.8 736 592 A 49 VAL H A 48 LYS HGy 1.0 . 4.1 737 592 A 48 LYS HGx A 49 VAL H 1.0 . 4.1 738 593 A 49 VAL HGy% A 48 LYS HGy 1.0 . 4.5 739 593 A 48 LYS HGx A 49 VAL HGy% 1.0 . 4.5 740 594 A 50 ILE HG2% A 48 LYS H 1.0 . 5.4 741 595 A 50 ILE HG2% A 48 LYS HGy 1.0 . 3.5 742 595 A 50 ILE HG2% A 48 LYS HGx 1.0 . 3.5 743 596 A 50 ILE HD1% A 48 LYS HGy 1.0 . 4.2 744 596 A 48 LYS HGx A 50 ILE HD1% 1.0 . 4.2 745 597 A 63 ALA HB% A 48 LYS HA 1.0 . 5.1 746 598 A 49 VAL H A 49 VAL HA 1.0 . 5.0 747 599 A 49 VAL H A 49 VAL HB 1.0 . 3.8 748 600 A 49 VAL H A 49 VAL HGy% 1.0 . 3.4 749 601 A 49 VAL HGx% A 49 VAL H 1.0 . 4.0 750 602 A 49 VAL HGy% A 49 VAL HA 1.0 . 3.9 751 603 A 49 VAL HGx% A 49 VAL HA 1.0 . 3.9 752 604 A 49 VAL HA A 50 ILE H 1.0 . 4.0 753 605 A 49 VAL HGy% A 50 ILE H 1.0 . 4.5 754 606 A 49 VAL HGx% A 50 ILE H 1.0 . 4.2 755 607 A 49 VAL HB A 57 ALA H 1.0 . 4.6 756 608 A 49 VAL HB A 57 ALA HB% 1.0 . 3.9 757 609 A 49 VAL HGy% A 57 ALA H 1.0 . 4.8 758 610 A 49 VAL HGy% A 57 ALA HB% 1.0 . 3.5 759 611 A 49 VAL HGy% A 61 LEU HBy 1.0 . 4.8 760 612 A 49 VAL HGy% A 61 LEU HBx 1.0 . 4.4 761 613 A 49 VAL HGx% A 61 LEU HBx 1.0 . 4.0 762 614 A 49 VAL HGy% A 61 LEU HG 1.0 . 5.5 763 615 A 49 VAL HGx% A 61 LEU HG 1.0 . 4.0 764 616 A 61 LEU HDx% A 49 VAL HGy% 1.0 . 4.7 765 617 A 49 VAL HGx% A 61 LEU HDx% 1.0 . 2.8 766 618 A 49 VAL HGx% A 63 ALA H 1.0 . 4.0 767 619 A 50 ILE H A 50 ILE HG1x 1.0 . 5.3 768 620 A 50 ILE HG2% A 50 ILE H 1.0 . 4.0 769 621 A 50 ILE HG1x A 50 ILE HA 1.0 . 4.2 770 622 A 50 ILE HG2% A 50 ILE HA 1.0 . 3.6 771 623 A 50 ILE HD1% A 50 ILE HA 1.0 . 3.7 772 624 A 50 ILE HD1% A 50 ILE HB 1.0 . 3.6 773 625 A 50 ILE HG2% A 50 ILE HG1x 1.0 . 3.9 774 626 A 50 ILE HG2% A 50 ILE HG1y 1.0 . 2.6 775 627 A 50 ILE HG2% A 50 ILE HD1% 1.0 . 2.4 776 628 A 50 ILE H A 51 LEU H 1.0 . 5.0 777 629 A 50 ILE HA A 51 LEU H 1.0 . 3.2 778 630 A 51 LEU HG A 50 ILE HA 1.0 . 4.0 779 631 A 50 ILE HG1y A 51 LEU H 1.0 . 4.4 780 632 A 50 ILE HG2% A 51 LEU H 1.0 . 3.8 781 633 A 51 LEU HA A 50 ILE HG2% 1.0 . 4.8 782 634 A 50 ILE HA A 56 GLN HA 1.0 . 2.8 783 635 A 50 ILE HA A 56 GLN HBx 1.0 . 4.3 784 635 A 50 ILE HA A 56 GLN HBy 1.0 . 4.3 785 636 A 57 ALA H A 50 ILE HA 1.0 . 3.3 786 637 A 57 ALA H A 50 ILE HG1x 1.0 . 5.4 787 638 A 51 LEU HA A 51 LEU H 1.0 . 5.0 788 639 A 51 LEU H A 51 LEU HBy 1.0 . 3.8 789 640 A 51 LEU HBx A 51 LEU H 1.0 . 4.2 790 641 A 51 LEU HG A 51 LEU H 1.0 . 3.9 791 642 A 51 LEU HDx% A 51 LEU H 1.0 . 4.1 792 643 A 51 LEU HDx% A 51 LEU HA 1.0 . 5.2 793 644 A 51 LEU HDy% A 51 LEU HA 1.0 . 3.6 794 645 A 51 LEU HDx% A 51 LEU HBy 1.0 . 3.6 795 646 A 51 LEU HDy% A 51 LEU HBy 1.0 . 3.8 796 647 A 51 LEU HBx A 51 LEU HDx% 1.0 . 3.7 797 648 A 51 LEU HBx A 51 LEU HDy% 1.0 . 3.8 798 649 A 52 THR H A 51 LEU H 1.0 . 5.0 799 650 A 52 THR H A 51 LEU HA 1.0 . 2.7 800 651 A 52 THR H A 51 LEU HBy 1.0 . 4.0 801 652 A 51 LEU HBx A 52 THR H 1.0 . 4.0 802 653 A 51 LEU HG A 52 THR H 1.0 . 5.5 803 654 A 51 LEU HBy A 53 ASN H 1.0 . 4.5 804 655 A 51 LEU HBx A 53 ASN H 1.0 . 4.3 805 656 A 51 LEU HBy A 54 GLY H 1.0 . 4.7 806 657 A 51 LEU HBx A 55 LYS H 1.0 . 4.6 807 658 A 51 LEU HDx% A 55 LYS H 1.0 . 4.4 808 659 A 51 LEU HDx% A 55 LYS HBx 1.0 . 3.6 809 659 A 51 LEU HDx% A 55 LYS HBy 1.0 . 3.6 810 660 A 51 LEU HDx% A 56 GLN H 1.0 . 5.1 811 661 A 51 LEU HDx% A 56 GLN HA 1.0 . 4.0 812 662 A 51 LEU HG A 57 ALA H 1.0 . 3.5 813 663 A 51 LEU HG A 57 ALA HA 1.0 . 4.3 814 664 A 51 LEU HG A 57 ALA HB% 1.0 . 3.9 815 665 A 51 LEU HDx% A 57 ALA HA 1.0 . 3.1 816 666 A 51 LEU HDx% A 57 ALA HB% 1.0 . 3.8 817 667 A 52 THR H A 52 THR HA 1.0 . 4.0 818 668 A 52 THR H A 52 THR HG2% 1.0 . 3.5 819 669 A 52 THR HG2% A 52 THR HA 1.0 . 3.3 820 670 A 52 THR H A 53 ASN H 1.0 . 4.2 821 671 A 53 ASN H A 52 THR HA 1.0 . 5.0 822 672 A 54 GLY H A 52 THR HA 1.0 . 4.0 823 673 A 53 ASN H A 53 ASN HA 1.0 . 5.0 824 674 A 53 ASN H A 54 GLY H 1.0 . 4.0 825 675 A 54 GLY H A 53 ASN HA 1.0 . 5.0 826 676 A 53 ASN HD2x A 55 LYS HBx 1.0 . 4.5 827 676 A 53 ASN HD2y A 55 LYS HBx 1.0 . 4.5 828 676 A 55 LYS HBy A 53 ASN HD2x 1.0 . 4.5 829 676 A 55 LYS HBy A 53 ASN HD2y 1.0 . 4.5 830 677 A 53 ASN HD2x A 55 LYS HGx 1.0 . 4.4 831 677 A 53 ASN HD2y A 55 LYS HGx 1.0 . 4.4 832 677 A 55 LYS HGy A 53 ASN HD2x 1.0 . 4.4 833 677 A 53 ASN HD2y A 55 LYS HGy 1.0 . 4.4 834 678 A 53 ASN HD2x A 55 LYS HDx 1.0 . 3.9 835 678 A 53 ASN HD2y A 55 LYS HDx 1.0 . 3.9 836 678 A 55 LYS HDy A 53 ASN HD2x 1.0 . 3.9 837 678 A 53 ASN HD2y A 55 LYS HDy 1.0 . 3.9 838 679 A 54 GLY H A 54 GLY HAy 1.0 . 2.7 839 680 A 54 GLY H A 54 GLY HAx 1.0 . 2.7 840 681 A 54 GLY HAy A 54 GLY HAx 1.0 . 5.0 841 682 A 54 GLY H A 55 LYS H 1.0 . 4.0 842 683 A 55 LYS H A 54 GLY HAy 1.0 . 5.0 843 684 A 55 LYS H A 54 GLY HAx 1.0 . 5.0 844 685 A 55 LYS H A 55 LYS HA 1.0 . 4.0 845 686 A 55 LYS H A 55 LYS HBx 1.0 . 3.8 846 686 A 55 LYS H A 55 LYS HBy 1.0 . 3.8 847 687 A 55 LYS H A 55 LYS HGx 1.0 . 4.4 848 687 A 55 LYS H A 55 LYS HGy 1.0 . 4.4 849 688 A 55 LYS H A 55 LYS HDx 1.0 . 4.5 850 688 A 55 LYS H A 55 LYS HDy 1.0 . 4.5 851 689 A 55 LYS HBy A 55 LYS HDx 1.0 . 3.7 852 689 A 55 LYS HBx A 55 LYS HDx 1.0 . 3.7 853 689 A 55 LYS HDy A 55 LYS HBx 1.0 . 3.7 854 689 A 55 LYS HBy A 55 LYS HDy 1.0 . 3.7 855 690 A 56 GLN H A 55 LYS HA 1.0 . 2.7 856 691 A 56 GLN H A 55 LYS HBx 1.0 . 4.0 857 691 A 55 LYS HBy A 56 GLN H 1.0 . 4.0 858 692 A 56 GLN H A 55 LYS HGx 1.0 . 4.1 859 692 A 56 GLN H A 55 LYS HGy 1.0 . 4.1 860 693 A 56 GLN H A 55 LYS HDx 1.0 . 4.9 861 693 A 56 GLN H A 55 LYS HDy 1.0 . 4.9 862 694 A 56 GLN HA A 56 GLN H 1.0 . 4.0 863 695 A 56 GLN H A 56 GLN HBx 1.0 . 3.6 864 695 A 56 GLN HBy A 56 GLN H 1.0 . 3.6 865 696 A 56 GLN H A 56 GLN HGx 1.0 . 4.2 866 696 A 56 GLN H A 56 GLN HGy 1.0 . 4.2 867 697 A 56 GLN HA A 56 GLN HGx 1.0 . 4.1 868 697 A 56 GLN HA A 56 GLN HGy 1.0 . 4.1 869 698 A 57 ALA H A 56 GLN HA 1.0 . 2.7 870 699 A 57 ALA H A 56 GLN HBx 1.0 . 4.3 871 699 A 57 ALA H A 56 GLN HBy 1.0 . 4.3 872 700 A 57 ALA H A 56 GLN HGx 1.0 . 4.3 873 700 A 57 ALA H A 56 GLN HGy 1.0 . 4.3 874 701 A 57 ALA H A 57 ALA HB% 1.0 . 3.2 875 702 A 57 ALA HA A 58 PRO HA 1.0 . 4.7 876 703 A 57 ALA HA A 58 PRO HGy 1.0 . 4.5 877 703 A 57 ALA HA A 58 PRO HGx 1.0 . 4.5 878 704 A 57 ALA HB% A 58 PRO HGy 1.0 . 4.4 879 704 A 57 ALA HB% A 58 PRO HGx 1.0 . 4.4 880 705 A 57 ALA HB% A 61 LEU HBy 1.0 . 3.6 881 706 A 57 ALA HB% A 61 LEU HBx 1.0 . 4.4 882 707 A 57 ALA HB% A 61 LEU HG 1.0 . 3.4 883 708 A 58 PRO HA A 59 ASP H 1.0 . 3.5 884 709 A 58 PRO HA A 59 ASP HA 1.0 . 5.1 885 710 A 59 ASP HA A 58 PRO HBx 1.0 . 5.2 886 711 A 58 PRO HA A 60 TRP H 1.0 . 5.0 887 712 A 60 TRP H A 58 PRO HBy 1.0 . 4.5 888 713 A 58 PRO HBx A 60 TRP HD1 1.0 . 4.4 889 714 A 58 PRO HBy A 60 TRP HD1 1.0 . 4.5 890 715 A 58 PRO HBx A 60 TRP HE1 1.0 . 4.0 891 716 A 58 PRO HBy A 60 TRP HE1 1.0 . 4.3 892 717 A 60 TRP HZ2 A 58 PRO HBx 1.0 . 5.4 893 718 A 60 TRP HE3 A 58 PRO HGy 1.0 . 4.5 894 718 A 60 TRP HE3 A 58 PRO HGx 1.0 . 4.5 895 719 A 60 TRP HZ2 A 58 PRO HGy 1.0 . 3.8 896 719 A 60 TRP HZ2 A 58 PRO HGx 1.0 . 3.8 897 720 A 61 LEU HBy A 58 PRO HGy 1.0 . 3.7 898 720 A 61 LEU HBy A 58 PRO HGx 1.0 . 3.7 899 721 A 61 LEU HG A 58 PRO HGy 1.0 . 4.5 900 721 A 61 LEU HG A 58 PRO HGx 1.0 . 4.5 901 722 A 61 LEU HDy% A 58 PRO HGy 1.0 . 3.8 902 722 A 61 LEU HDy% A 58 PRO HGx 1.0 . 3.8 903 723 A 59 ASP H A 59 ASP HA 1.0 . 5.0 904 724 A 59 ASP H A 59 ASP HBx 1.0 . 3.9 905 724 A 59 ASP H A 59 ASP HBy 1.0 . 3.9 906 725 A 59 ASP H A 60 TRP H 1.0 . 4.6 907 726 A 59 ASP HA A 60 TRP H 1.0 . 5.0 908 727 A 60 TRP H A 59 ASP HBx 1.0 . 4.5 909 727 A 60 TRP H A 59 ASP HBy 1.0 . 4.5 910 728 A 59 ASP HA A 61 LEU H 1.0 . 5.0 911 729 A 60 TRP HA A 60 TRP H 1.0 . 4.0 912 730 A 60 TRP HBy A 60 TRP H 1.0 . 4.0 913 731 A 60 TRP H A 60 TRP HD1 1.0 . 3.6 914 732 A 60 TRP HE3 A 60 TRP H 1.0 . 5.2 915 733 A 60 TRP HA A 60 TRP HD1 1.0 . 4.4 916 734 A 60 TRP HD1 A 60 TRP HBx 1.0 . 3.8 917 735 A 60 TRP HE3 A 60 TRP HBy 1.0 . 4.0 918 736 A 60 TRP HBy A 60 TRP HZ3 1.0 . 5.0 919 737 A 60 TRP H A 61 LEU H 1.0 . 3.8 920 738 A 61 LEU HA A 60 TRP H 1.0 . 5.0 921 739 A 60 TRP HA A 61 LEU H 1.0 . 5.0 922 740 A 61 LEU HA A 60 TRP HA 1.0 . 5.2 923 741 A 60 TRP HBy A 61 LEU H 1.0 . 4.5 924 742 A 60 TRP HE3 A 61 LEU H 1.0 . 4.9 925 743 A 61 LEU HA A 60 TRP HE3 1.0 . 4.7 926 744 A 61 LEU HDy% A 60 TRP HE3 1.0 . 4.0 927 745 A 61 LEU HDx% A 60 TRP HE3 1.0 . 4.3 928 746 A 61 LEU HA A 60 TRP HZ3 1.0 . 5.1 929 747 A 61 LEU HDy% A 60 TRP HZ3 1.0 . 4.3 930 748 A 61 LEU HDy% A 60 TRP HZ2 1.0 . 5.2 931 749 A 61 LEU HDx% A 60 TRP HZ3 1.0 . 4.5 932 750 A 61 LEU HBy A 61 LEU H 1.0 . 3.7 933 751 A 61 LEU HBx A 61 LEU H 1.0 . 3.8 934 752 A 61 LEU HDy% A 61 LEU H 1.0 . 4.2 935 753 A 61 LEU HDx% A 61 LEU H 1.0 . 5.0 936 754 A 61 LEU HDx% A 61 LEU HA 1.0 . 4.2 937 755 A 61 LEU HDy% A 61 LEU HBy 1.0 . 3.4 938 756 A 61 LEU HDx% A 61 LEU HBx 1.0 . 3.8 939 757 A 61 LEU HDy% A 61 LEU HBx 1.0 . 3.2 940 758 A 62 ALA H A 61 LEU H 1.0 . 5.0 941 759 A 61 LEU HA A 62 ALA H 1.0 . 2.7 942 760 A 61 LEU HA A 62 ALA HB% 1.0 . 4.3 943 761 A 61 LEU HDx% A 62 ALA H 1.0 . 3.8 944 762 A 61 LEU HDy% A 62 ALA H 1.0 . 5.3 945 763 A 62 ALA HA A 62 ALA H 1.0 . 5.0 946 764 A 62 ALA H A 62 ALA HB% 1.0 . 3.6 947 765 A 62 ALA H A 63 ALA H 1.0 . 5.0 948 766 A 62 ALA HA A 63 ALA H 1.0 . 2.7 949 767 A 62 ALA HB% A 63 ALA H 1.0 . 3.5 950 768 A 63 ALA HA A 63 ALA H 1.0 . 5.0 951 769 A 64 GLU H A 63 ALA H 1.0 . 4.2 952 770 A 63 ALA HA A 64 GLU H 1.0 . 2.7 953 771 A 63 ALA HB% A 64 GLU H 1.0 . 3.6 954 772 A 64 GLU H A 64 GLU HA 1.0 . 5.0 955 773 A 64 GLU H A 64 GLU HGy 1.0 . 4.6 956 773 A 64 GLU H A 64 GLU HGx 1.0 . 4.6 957 774 A 64 GLU HA A 65 PRO HDx 1.0 . 3.7 958 775 A 64 GLU HBx A 65 PRO HGx 1.0 . 3.6 959 775 A 64 GLU HBx A 65 PRO HGy 1.0 . 3.6 960 776 A 64 GLU HBy A 65 PRO HDy 1.0 . 4.2 961 777 A 64 GLU HBy A 65 PRO HDx 1.0 . 4.7 962 778 A 64 GLU HBx A 65 PRO HDy 1.0 . 4.3 963 779 A 64 GLU HBx A 65 PRO HDx 1.0 . 4.5 964 780 A 66 TYR H A 65 PRO HA 1.0 . 2.7 965 781 A 66 TYR H A 65 PRO HBx 1.0 . 4.5 966 782 A 66 TYR H A 65 PRO HBy 1.0 . 4.5 967 783 A 66 TYR H A 66 TYR HA 1.0 . 4.0 968 784 A 66 TYR HA A 66 TYR HD% 1.0 . 3.8 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 2 PRO C A 3 ALA N A 3 ALA CA A 3 ALA C 1.0 -118.8 -58.8 PHI 2 2 A 3 ALA N A 3 ALA CA A 3 ALA C A 4 ARG N 1.0 93.7 153.7 PSI 3 3 A 3 ALA C A 4 ARG N A 4 ARG CA A 4 ARG C 1.0 -138.1 -66.4 PHI 4 4 A 4 ARG N A 4 ARG CA A 4 ARG C A 5 PHE N 1.0 118.8 178.8 PSI 5 5 A 4 ARG C A 5 PHE N A 5 PHE CA A 5 PHE C 1.0 -161.3 -101.3 PHI 6 6 A 5 PHE N A 5 PHE CA A 5 PHE C A 6 CYS N 1.0 120.9 180.9 PSI 7 7 A 5 PHE C A 6 CYS N A 6 CYS CA A 6 CYS C 1.0 -165.3 -105.3 PHI 8 8 A 6 CYS N A 6 CYS CA A 6 CYS C A 7 VAL N 1.0 116.8 176.8 PSI 9 9 A 6 CYS C A 7 VAL N A 7 VAL CA A 7 VAL C 1.0 -147.0 -87.0 PHI 10 10 A 7 VAL N A 7 VAL CA A 7 VAL C A 8 TYR N 1.0 93.2 153.2 PSI 11 11 A 7 VAL C A 8 TYR N A 8 TYR CA A 8 TYR C 1.0 -146.3 -86.3 PHI 12 12 A 8 TYR N A 8 TYR CA A 8 TYR C A 9 TYR N 1.0 114.3 174.3 PSI 13 13 A 8 TYR C A 9 TYR N A 9 TYR CA A 9 TYR C 1.0 -161.9 -101.9 PHI 14 14 A 9 TYR N A 9 TYR CA A 9 TYR C A 10 ASP N 1.0 132.7 192.7 PSI 15 15 A 9 TYR C A 10 ASP N A 10 ASP CA A 10 ASP C 1.0 -134.6 -74.6 PHI 16 16 A 10 ASP N A 10 ASP CA A 10 ASP C A 11 GLY N 1.0 92.6 152.6 PSI 17 17 A 11 GLY C A 12 HIS N A 12 HIS CA A 12 HIS C 1.0 -171.5 -111.5 PHI 18 18 A 12 HIS N A 12 HIS CA A 12 HIS C A 13 LEU N 1.0 117.9 177.9 PSI 19 19 A 12 HIS C A 13 LEU N A 13 LEU CA A 13 LEU C 1.0 -106.2 -46.2 PHI 20 20 A 13 LEU N A 13 LEU CA A 13 LEU C A 14 PRO N 1.0 113.2 173.2 PSI 21 21 A 14 PRO C A 15 ALA N A 15 ALA CA A 15 ALA C 1.0 -104.2 -44.2 PHI 22 22 A 15 ALA N A 15 ALA CA A 15 ALA C A 16 THR N 1.0 -59.1 0.9 PSI 23 23 A 15 ALA C A 16 THR N A 16 THR CA A 16 THR C 1.0 -138.3 -78.3 PHI 24 24 A 16 THR N A 16 THR CA A 16 THR C A 17 ARG N 1.0 -32.6 27.4 PSI 25 25 A 16 THR C A 17 ARG N A 17 ARG CA A 17 ARG C 1.0 -107.3 -47.3 PHI 26 26 A 17 ARG N A 17 ARG CA A 17 ARG C A 18 VAL N 1.0 102.3 162.3 PSI 27 27 A 17 ARG C A 18 VAL N A 18 VAL CA A 18 VAL C 1.0 -144.2 -84.2 PHI 28 28 A 18 VAL N A 18 VAL CA A 18 VAL C A 19 LEU N 1.0 108.7 168.7 PSI 29 29 A 18 VAL C A 19 LEU N A 19 LEU CA A 19 LEU C 1.0 -113.0 -53.0 PHI 30 30 A 19 LEU N A 19 LEU CA A 19 LEU C A 20 LEU N 1.0 94.0 154.0 PSI 31 31 A 19 LEU C A 20 LEU N A 20 LEU CA A 20 LEU C 1.0 -118.6 -58.6 PHI 32 32 A 20 LEU N A 20 LEU CA A 20 LEU C A 21 MET N 1.0 -71.0 -11.0 PSI 33 33 A 20 LEU C A 21 MET N A 21 MET CA A 21 MET C 1.0 -189.8 -129.8 PHI 34 34 A 21 MET N A 21 MET CA A 21 MET C A 22 TYR N 1.0 119.0 179.0 PSI 35 35 A 21 MET C A 22 TYR N A 22 TYR CA A 22 TYR C 1.0 -145.7 -85.7 PHI 36 36 A 22 TYR N A 22 TYR CA A 22 TYR C A 23 VAL N 1.0 96.6 156.6 PSI 37 37 A 22 TYR C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -145.0 -85.0 PHI 38 38 A 23 VAL N A 23 VAL CA A 23 VAL C A 24 ARG N 1.0 104.0 164.0 PSI 39 39 A 23 VAL C A 24 ARG N A 24 ARG CA A 24 ARG C 1.0 -125.1 -65.1 PHI 40 40 A 24 ARG N A 24 ARG CA A 24 ARG C A 25 ILE N 1.0 97.3 157.3 PSI 41 41 A 25 ILE C A 26 GLY N A 26 GLY CA A 26 GLY C 1.0 -134.1 -74.1 PHI 42 42 A 26 GLY N A 26 GLY CA A 26 GLY C A 27 THR N 1.0 -52.2 7.8 PSI 43 43 A 26 GLY C A 27 THR N A 27 THR CA A 27 THR C 1.0 -157.7 -97.7 PHI 44 44 A 27 THR N A 27 THR CA A 27 THR C A 28 THR N 1.0 127.4 187.4 PSI 45 45 A 27 THR C A 28 THR N A 28 THR CA A 28 THR C 1.0 -156.8 -96.8 PHI 46 46 A 28 THR N A 28 THR CA A 28 THR C A 29 ALA N 1.0 124.9 184.9 PSI 47 47 A 28 THR C A 29 ALA N A 29 ALA CA A 29 ALA C 1.0 -161.8 -101.8 PHI 48 48 A 29 ALA N A 29 ALA CA A 29 ALA C A 30 THR N 1.0 114.4 174.4 PSI 49 49 A 29 ALA C A 30 THR N A 30 THR CA A 30 THR C 1.0 -139.7 -79.7 PHI 50 50 A 30 THR N A 30 THR CA A 30 THR C A 31 ILE N 1.0 86.8 146.8 PSI 51 51 A 30 THR C A 31 ILE N A 31 ILE CA A 31 ILE C 1.0 -147.6 -87.6 PHI 52 52 A 31 ILE N A 31 ILE CA A 31 ILE C A 32 THR N 1.0 103.1 163.1 PSI 53 53 A 31 ILE C A 32 THR N A 32 THR CA A 32 THR C 1.0 -146.4 -86.4 PHI 54 54 A 32 THR N A 32 THR CA A 32 THR C A 33 ALA N 1.0 104.8 164.8 PSI 55 55 A 32 THR C A 33 ALA N A 33 ALA CA A 33 ALA C 1.0 -151.9 -91.9 PHI 56 56 A 33 ALA N A 33 ALA CA A 33 ALA C A 34 ARG N 1.0 128.6 188.6 PSI 57 57 A 33 ALA C A 34 ARG N A 34 ARG CA A 34 ARG C 1.0 26.8 86.8 PHI 58 58 A 34 ARG N A 34 ARG CA A 34 ARG C A 35 GLY N 1.0 6.7 66.7 PSI 59 59 A 35 GLY C A 36 HIS N A 36 HIS CA A 36 HIS C 1.0 -157.6 -97.6 PHI 60 60 A 36 HIS N A 36 HIS CA A 36 HIS C A 37 GLU N 1.0 111.1 171.1 PSI 61 61 A 36 HIS C A 37 GLU N A 37 GLU CA A 37 GLU C 1.0 -145.6 -85.6 PHI 62 62 A 37 GLU N A 37 GLU CA A 37 GLU C A 38 PHE N 1.0 113.0 173.0 PSI 63 63 A 37 GLU C A 38 PHE N A 38 PHE CA A 38 PHE C 1.0 -164.9 -104.9 PHI 64 64 A 38 PHE N A 38 PHE CA A 38 PHE C A 39 GLU N 1.0 111.3 171.3 PSI 65 65 A 38 PHE C A 39 GLU N A 39 GLU CA A 39 GLU C 1.0 -133.0 -73.0 PHI 66 66 A 39 GLU N A 39 GLU CA A 39 GLU C A 40 VAL N 1.0 96.5 156.5 PSI 67 67 A 39 GLU C A 40 VAL N A 40 VAL CA A 40 VAL C 1.0 -158.2 -98.2 PHI 68 68 A 40 VAL N A 40 VAL CA A 40 VAL C A 41 GLU N 1.0 125.5 185.5 PSI 69 69 A 40 VAL C A 41 GLU N A 41 GLU CA A 41 GLU C 1.0 -170.6 -110.6 PHI 70 70 A 41 GLU N A 41 GLU CA A 41 GLU C A 42 ALA N 1.0 101.2 161.2 PSI 71 71 A 41 GLU C A 42 ALA N A 42 ALA CA A 42 ALA C 1.0 -120.5 -60.5 PHI 72 72 A 42 ALA N A 42 ALA CA A 42 ALA C A 43 LYS N 1.0 69.8 129.8 PSI 73 73 A 46 ASN C A 47 CYS N A 47 CYS CA A 47 CYS C 1.0 -165.8 -105.8 PHI 74 74 A 47 CYS N A 47 CYS CA A 47 CYS C A 48 LYS N 1.0 135.8 195.8 PSI 75 75 A 48 LYS C A 49 VAL N A 49 VAL CA A 49 VAL C 1.0 -111.5 -51.5 PHI 76 76 A 49 VAL N A 49 VAL CA A 49 VAL C A 50 ILE N 1.0 97.6 157.6 PSI 77 77 A 49 VAL C A 50 ILE N A 50 ILE CA A 50 ILE C 1.0 -154.2 -94.2 PHI 78 78 A 50 ILE N A 50 ILE CA A 50 ILE C A 51 LEU N 1.0 108.2 168.2 PSI 79 79 A 50 ILE C A 51 LEU N A 51 LEU CA A 51 LEU C 1.0 -117.9 -57.9 PHI 80 80 A 51 LEU N A 51 LEU CA A 51 LEU C A 52 THR N 1.0 143.0 203.0 PSI 81 81 A 51 LEU C A 52 THR N A 52 THR CA A 52 THR C 1.0 -91.4 -31.4 PHI 82 82 A 52 THR N A 52 THR CA A 52 THR C A 53 ASN N 1.0 -52.9 7.1 PSI 83 83 A 52 THR C A 53 ASN N A 53 ASN CA A 53 ASN C 1.0 -118.2 -58.2 PHI 84 84 A 53 ASN N A 53 ASN CA A 53 ASN C A 54 GLY N 1.0 -25.0 35.0 PSI 85 85 A 53 ASN C A 54 GLY N A 54 GLY CA A 54 GLY C 1.0 61.5 121.5 PHI 86 86 A 54 GLY N A 54 GLY CA A 54 GLY C A 55 LYS N 1.0 -28.0 32.0 PSI 87 87 A 54 GLY C A 55 LYS N A 55 LYS CA A 55 LYS C 1.0 -140.3 -27.9 PHI 88 88 A 55 LYS N A 55 LYS CA A 55 LYS C A 56 GLN N 1.0 98.4 158.4 PSI 89 89 A 55 LYS C A 56 GLN N A 56 GLN CA A 56 GLN C 1.0 -118.6 -58.6 PHI 90 90 A 56 GLN N A 56 GLN CA A 56 GLN C A 57 ALA N 1.0 110.9 170.9 PSI 91 91 A 56 GLN C A 57 ALA N A 57 ALA CA A 57 ALA C 1.0 -107.8 -47.8 PHI 92 92 A 57 ALA N A 57 ALA CA A 57 ALA C A 58 PRO N 1.0 112.0 172.0 PSI 93 93 A 58 PRO C A 59 ASP N A 59 ASP CA A 59 ASP C 1.0 -92.0 -32.0 PHI 94 94 A 59 ASP N A 59 ASP CA A 59 ASP C A 60 TRP N 1.0 -54.1 5.9 PSI 95 95 A 59 ASP C A 60 TRP N A 60 TRP CA A 60 TRP C 1.0 -125.3 -65.3 PHI 96 96 A 60 TRP N A 60 TRP CA A 60 TRP C A 61 LEU N 1.0 -26.7 33.3 PSI 97 97 A 60 TRP C A 61 LEU N A 61 LEU CA A 61 LEU C 1.0 -115.1 -55.1 PHI 98 98 A 61 LEU N A 61 LEU CA A 61 LEU C A 62 ALA N 1.0 100.2 160.2 PSI 99 99 A 61 LEU C A 62 ALA N A 62 ALA CA A 62 ALA C 1.0 -149.1 -89.1 PHI 100 100 A 62 ALA N A 62 ALA CA A 62 ALA C A 63 ALA N 1.0 119.8 179.8 PSI 101 101 A 62 ALA C A 63 ALA N A 63 ALA CA A 63 ALA C 1.0 -157.8 -97.8 PHI 102 102 A 63 ALA N A 63 ALA CA A 63 ALA C A 64 GLU N 1.0 112.9 172.9 PSI 103 103 A 63 ALA C A 64 GLU N A 64 GLU CA A 64 GLU C 1.0 -156.1 -96.1 PHI 104 104 A 64 GLU N A 64 GLU CA A 64 GLU C A 65 PRO N 1.0 108.0 168.0 PSI stop_ save_