data_nef_c25151_2mt7 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 2MT7 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 4 CYS SG 1 19 CYS SG 1 11 CYS SG 1 24 CYS SG 1 18 CYS SG 1 31 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 GLY start . false 2 A 2 ASN middle . . 3 A 3 ASP middle . . 4 A 4 CYS middle -HG . 5 A 5 LEU middle . . 6 A 6 GLY middle . false 7 A 7 PHE middle . . 8 A 8 TRP middle . . 9 A 9 SER middle . . 10 A 10 ALA middle . . 11 A 11 CYS middle -HG . 12 A 12 ASN middle . . 13 A 13 PRO middle . false 14 A 14 LYS middle . . 15 A 15 ASN middle . . 16 A 16 ASP middle . . 17 A 17 LYS middle . . 18 A 18 CYS middle -HG . 19 A 19 CYS middle -HG . 20 A 20 ALA middle . . 21 A 21 ASN middle . . 22 A 22 LEU middle . . 23 A 23 VAL middle . . 24 A 24 CYS middle -HG . 25 A 25 SER middle . . 26 A 26 SER middle . . 27 A 27 LYS middle . . 28 A 28 HIS middle . . 29 A 29 LYS middle . . 30 A 30 TRP middle . . 31 A 31 CYS middle -HG . 32 A 32 LYS middle . . 33 A 33 GLY middle . false 34 A 34 LYS middle . . 35 A 35 LEU end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HA2 H 1 3.865 0.010 A 1 GLY CA C 13 43.516 0.200 A 2 ASN H H 1 8.792 0.010 A 2 ASN HA H 1 4.819 0.010 A 2 ASN HBy H 1 2.899 0.010 A 2 ASN HBx H 1 2.739 0.010 A 2 ASN HD2y H 1 7.618 0.010 A 2 ASN HD2x H 1 6.918 0.010 A 2 ASN CA C 13 53.210 0.200 A 2 ASN CB C 13 39.095 0.200 A 2 ASN N N 15 118.762 0.100 A 2 ASN ND2 N 15 112.719 0.100 A 3 ASP H H 1 8.549 0.010 A 3 ASP HA H 1 4.650 0.010 A 3 ASP HBy H 1 2.716 0.010 A 3 ASP HBx H 1 2.623 0.010 A 3 ASP CA C 13 54.095 0.200 A 3 ASP CB C 13 40.891 0.200 A 3 ASP N N 15 120.996 0.100 A 4 CYS H H 1 8.054 0.010 A 4 CYS HA H 1 4.881 0.010 A 4 CYS HB2 H 1 3.064 0.010 A 4 CYS HB3 H 1 3.234 0.010 A 4 CYS CA C 13 54.434 0.200 A 4 CYS CB C 13 43.435 0.200 A 4 CYS N N 15 115.969 0.100 A 5 LEU H H 1 8.540 0.010 A 5 LEU HA H 1 4.431 0.010 A 5 LEU HB2 H 1 1.793 0.010 A 5 LEU HB3 H 1 1.478 0.010 A 5 LEU HD1% H 1 0.983 0.010 A 5 LEU HD2% H 1 0.876 0.010 A 5 LEU HG H 1 1.584 0.010 A 5 LEU CA C 13 54.531 0.200 A 5 LEU CB C 13 43.281 0.200 A 5 LEU CD1 C 13 26.172 0.200 A 5 LEU CD2 C 13 22.188 0.200 A 5 LEU CG C 13 25.938 0.200 A 5 LEU N N 15 121.566 0.100 A 6 GLY H H 1 8.235 0.010 A 6 GLY HA2 H 1 4.060 0.010 A 6 GLY HA3 H 1 3.689 0.010 A 6 GLY CA C 13 43.281 0.200 A 6 GLY N N 15 108.453 0.100 A 7 PHE H H 1 8.202 0.010 A 7 PHE HA H 1 3.408 0.010 A 7 PHE HB2 H 1 2.651 0.010 A 7 PHE HB3 H 1 2.423 0.010 A 7 PHE HD1 H 1 6.569 0.010 A 7 PHE HD2 H 1 6.569 0.010 A 7 PHE HE1 H 1 6.891 0.010 A 7 PHE HE2 H 1 6.891 0.010 A 7 PHE HZ H 1 7.083 0.010 A 7 PHE CA C 13 60.606 0.200 A 7 PHE CB C 13 39.531 0.200 A 7 PHE CD1 C 13 131.366 0.200 A 7 PHE CE1 C 13 131.185 0.200 A 7 PHE CZ C 13 129.811 0.200 A 7 PHE N N 15 118.965 0.100 A 8 TRP H H 1 9.067 0.010 A 8 TRP HA H 1 3.839 0.010 A 8 TRP HB2 H 1 3.285 0.010 A 8 TRP HB3 H 1 3.121 0.010 A 8 TRP HD1 H 1 6.513 0.010 A 8 TRP HE1 H 1 9.414 0.010 A 8 TRP HE3 H 1 6.229 0.010 A 8 TRP HH2 H 1 7.117 0.010 A 8 TRP HZ2 H 1 7.211 0.010 A 8 TRP HZ3 H 1 6.764 0.010 A 8 TRP CA C 13 58.047 0.200 A 8 TRP CB C 13 27.800 0.200 A 8 TRP CD1 C 13 126.775 0.200 A 8 TRP CE3 C 13 120.593 0.200 A 8 TRP CH2 C 13 123.991 0.200 A 8 TRP CZ2 C 13 114.520 0.200 A 8 TRP CZ3 C 13 121.136 0.200 A 8 TRP N N 15 120.031 0.100 A 8 TRP NE1 N 15 127.547 0.100 A 9 SER H H 1 8.165 0.010 A 9 SER HA H 1 4.445 0.010 A 9 SER HB2 H 1 3.889 0.010 A 9 SER HB3 H 1 3.918 0.010 A 9 SER CA C 13 59.703 0.200 A 9 SER CB C 13 64.804 0.200 A 9 SER N N 15 117.187 0.100 A 10 ALA H H 1 8.713 0.010 A 10 ALA HA H 1 4.914 0.010 A 10 ALA HB% H 1 1.546 0.010 A 10 ALA CA C 13 53.122 0.200 A 10 ALA CB C 13 18.895 0.200 A 10 ALA N N 15 127.547 0.100 A 11 CYS H H 1 8.200 0.010 A 11 CYS HA H 1 4.799 0.010 A 11 CYS HB2 H 1 3.054 0.010 A 11 CYS HB3 H 1 2.977 0.010 A 11 CYS CA C 13 54.064 0.200 A 11 CYS CB C 13 45.772 0.200 A 11 CYS N N 15 116.934 0.100 A 12 ASN H H 1 9.125 0.010 A 12 ASN HA H 1 5.125 0.010 A 12 ASN HB2 H 1 2.768 0.010 A 12 ASN HB3 H 1 3.040 0.010 A 12 ASN HD21 H 1 7.823 0.010 A 12 ASN HD22 H 1 7.151 0.010 A 12 ASN CA C 13 48.437 0.200 A 12 ASN CB C 13 40.234 0.200 A 12 ASN N N 15 119.371 0.100 A 12 ASN ND2 N 15 112.313 0.100 A 13 PRO HA H 1 3.977 0.010 A 13 PRO HB2 H 1 1.916 0.010 A 13 PRO HB3 H 1 2.175 0.010 A 13 PRO HD2 H 1 3.884 0.010 A 13 PRO HD3 H 1 3.884 0.010 A 13 PRO HG2 H 1 2.043 0.010 A 13 PRO HG3 H 1 1.804 0.010 A 13 PRO CA C 13 61.328 0.200 A 13 PRO CB C 13 32.031 0.200 A 13 PRO CD C 13 50.781 0.200 A 13 PRO CG C 13 27.578 0.200 A 14 LYS H H 1 7.648 0.010 A 14 LYS HA H 1 4.228 0.010 A 14 LYS HB2 H 1 1.655 0.010 A 14 LYS HB3 H 1 1.901 0.010 A 14 LYS HD2 H 1 1.660 0.010 A 14 LYS HD3 H 1 1.660 0.010 A 14 LYS HE2 H 1 2.969 0.010 A 14 LYS HE3 H 1 2.969 0.010 A 14 LYS HGy H 1 1.470 0.010 A 14 LYS HGx H 1 1.375 0.010 A 14 LYS CA C 13 56.365 0.200 A 14 LYS CB C 13 32.266 0.200 A 14 LYS CD C 13 28.772 0.200 A 14 LYS CE C 13 42.087 0.200 A 14 LYS CG C 13 25.235 0.200 A 14 LYS N N 15 113.430 0.100 A 15 ASN H H 1 7.562 0.010 A 15 ASN HA H 1 4.642 0.010 A 15 ASN HBy H 1 2.662 0.010 A 15 ASN HBx H 1 2.537 0.010 A 15 ASN HD2y H 1 7.452 0.010 A 15 ASN HD2x H 1 6.797 0.010 A 15 ASN CA C 13 52.629 0.200 A 15 ASN CB C 13 37.891 0.200 A 15 ASN N N 15 119.066 0.100 A 15 ASN ND2 N 15 110.078 0.100 A 16 ASP H H 1 8.618 0.010 A 16 ASP HA H 1 4.135 0.010 A 16 ASP HBy H 1 3.000 0.010 A 16 ASP HBx H 1 2.442 0.010 A 16 ASP CA C 13 55.902 0.200 A 16 ASP CB C 13 41.930 0.200 A 16 ASP N N 15 124.551 0.100 A 17 LYS H H 1 7.913 0.010 A 17 LYS HA H 1 4.669 0.010 A 17 LYS HB2 H 1 1.602 0.010 A 17 LYS HB3 H 1 2.353 0.010 A 17 LYS HD2 H 1 1.620 0.010 A 17 LYS HD3 H 1 1.620 0.010 A 17 LYS HE2 H 1 2.916 0.010 A 17 LYS HGy H 1 1.486 0.010 A 17 LYS HGx H 1 1.387 0.010 A 17 LYS CB C 13 31.094 0.200 A 17 LYS CD C 13 28.269 0.200 A 17 LYS CG C 13 24.272 0.200 A 17 LYS N N 15 127.750 0.100 A 18 CYS H H 1 9.343 0.010 A 18 CYS HA H 1 4.979 0.010 A 18 CYS HB2 H 1 2.849 0.010 A 18 CYS HB3 H 1 2.849 0.010 A 18 CYS CA C 13 56.883 0.200 A 18 CYS CB C 13 39.062 0.200 A 18 CYS N N 15 122.012 0.100 A 19 CYS H H 1 9.347 0.010 A 19 CYS HA H 1 4.441 0.010 A 19 CYS HB2 H 1 2.533 0.010 A 19 CYS HB3 H 1 3.417 0.010 A 19 CYS CA C 13 54.765 0.200 A 19 CYS CB C 13 41.641 0.200 A 19 CYS N N 15 120.742 0.100 A 20 ALA H H 1 8.087 0.010 A 20 ALA HA H 1 4.116 0.010 A 20 ALA HB% H 1 1.362 0.010 A 20 ALA CA C 13 54.527 0.200 A 20 ALA CB C 13 18.907 0.200 A 20 ALA N N 15 119.473 0.100 A 21 ASN H H 1 8.660 0.010 A 21 ASN HA H 1 4.332 0.010 A 21 ASN HBy H 1 3.150 0.010 A 21 ASN HBx H 1 2.875 0.010 A 21 ASN HD2y H 1 7.538 0.010 A 21 ASN HD2x H 1 6.900 0.010 A 21 ASN CA C 13 55.234 0.200 A 21 ASN CB C 13 37.188 0.200 A 21 ASN N N 15 112.414 0.100 A 21 ASN ND2 N 15 113.734 0.100 A 22 LEU H H 1 8.407 0.010 A 22 LEU HA H 1 5.038 0.010 A 22 LEU HB2 H 1 2.022 0.010 A 22 LEU HB3 H 1 1.061 0.010 A 22 LEU HD1% H 1 0.600 0.010 A 22 LEU HD2% H 1 0.175 0.010 A 22 LEU HG H 1 1.195 0.010 A 22 LEU CA C 13 53.078 0.200 A 22 LEU CB C 13 45.118 0.200 A 22 LEU CD1 C 13 26.406 0.200 A 22 LEU CD2 C 13 23.136 0.200 A 22 LEU CG C 13 26.446 0.200 A 22 LEU N N 15 121.250 0.100 A 23 VAL H H 1 9.184 0.010 A 23 VAL HA H 1 4.446 0.010 A 23 VAL HB H 1 1.856 0.010 A 23 VAL HG1% H 1 0.759 0.010 A 23 VAL HG2% H 1 0.930 0.010 A 23 VAL CA C 13 59.815 0.200 A 23 VAL CB C 13 35.547 0.200 A 23 VAL CG1 C 13 19.864 0.200 A 23 VAL CG2 C 13 21.249 0.200 A 23 VAL N N 15 116.883 0.100 A 24 CYS H H 1 9.743 0.010 A 24 CYS HA H 1 4.569 0.010 A 24 CYS HB2 H 1 2.599 0.010 A 24 CYS HB3 H 1 3.129 0.010 A 24 CYS CA C 13 55.881 0.200 A 24 CYS CB C 13 38.345 0.200 A 24 CYS N N 15 126.988 0.100 A 25 SER H H 1 8.338 0.010 A 25 SER HA H 1 4.452 0.010 A 25 SER HB2 H 1 4.135 0.010 A 25 SER HB3 H 1 3.869 0.010 A 25 SER CA C 13 57.812 0.200 A 25 SER CB C 13 63.906 0.200 A 25 SER N N 15 123.484 0.100 A 26 SER H H 1 8.983 0.010 A 26 SER HA H 1 3.868 0.010 A 26 SER HBy H 1 3.935 0.010 A 26 SER HBx H 1 3.885 0.010 A 26 SER CA C 13 64.609 0.200 A 26 SER CB C 13 62.477 0.200 A 26 SER N N 15 125.516 0.100 A 27 LYS H H 1 7.650 0.010 A 27 LYS HA H 1 4.040 0.010 A 27 LYS HBy H 1 1.476 0.010 A 27 LYS HBx H 1 1.175 0.010 A 27 LYS HDy H 1 1.479 0.010 A 27 LYS HDx H 1 1.434 0.010 A 27 LYS HE2 H 1 2.836 0.010 A 27 LYS HE3 H 1 2.836 0.010 A 27 LYS HGy H 1 1.016 0.010 A 27 LYS HGx H 1 0.794 0.010 A 27 LYS CA C 13 57.839 0.200 A 27 LYS CB C 13 33.203 0.200 A 27 LYS CD C 13 28.704 0.200 A 27 LYS CE C 13 41.871 0.200 A 27 LYS CG C 13 24.551 0.200 A 27 LYS N N 15 119.269 0.100 A 28 HIS H H 1 6.929 0.010 A 28 HIS HA H 1 4.122 0.010 A 28 HIS HBy H 1 1.378 0.010 A 28 HIS HBx H 1 1.124 0.010 A 28 HIS HD2 H 1 6.940 0.010 A 28 HIS HE1 H 1 8.535 0.010 A 28 HIS CA C 13 55.436 0.200 A 28 HIS CB C 13 28.273 0.200 A 28 HIS CD2 C 13 120.625 0.200 A 28 HIS CE1 C 13 136.644 0.200 A 28 HIS N N 15 112.008 0.100 A 29 LYS H H 1 8.153 0.010 A 29 LYS HA H 1 3.838 0.010 A 29 LYS HB2 H 1 2.270 0.010 A 29 LYS HB3 H 1 2.044 0.010 A 29 LYS HDy H 1 1.695 0.010 A 29 LYS HDx H 1 1.627 0.010 A 29 LYS HE2 H 1 2.955 0.010 A 29 LYS HE3 H 1 2.955 0.010 A 29 LYS HG2 H 1 1.153 0.010 A 29 LYS HG3 H 1 1.198 0.010 A 29 LYS CA C 13 57.812 0.200 A 29 LYS CB C 13 27.813 0.200 A 29 LYS CD C 13 29.704 0.200 A 29 LYS CE C 13 42.344 0.200 A 29 LYS CG C 13 25.448 0.200 A 29 LYS N N 15 115.258 0.100 A 30 TRP H H 1 6.910 0.010 A 30 TRP HA H 1 5.802 0.010 A 30 TRP HB2 H 1 2.677 0.010 A 30 TRP HB3 H 1 3.188 0.010 A 30 TRP HD1 H 1 6.898 0.010 A 30 TRP HE1 H 1 10.112 0.010 A 30 TRP HE3 H 1 7.520 0.010 A 30 TRP HH2 H 1 6.922 0.010 A 30 TRP HZ2 H 1 6.934 0.010 A 30 TRP HZ3 H 1 7.083 0.010 A 30 TRP CA C 13 54.328 0.200 A 30 TRP CB C 13 31.118 0.200 A 30 TRP CD1 C 13 124.389 0.200 A 30 TRP CE3 C 13 121.281 0.200 A 30 TRP CH2 C 13 124.344 0.200 A 30 TRP CZ2 C 13 113.906 0.200 A 30 TRP CZ3 C 13 121.719 0.200 A 30 TRP N N 15 112.008 0.100 A 30 TRP NE1 N 15 128.359 0.100 A 31 CYS H H 1 8.581 0.010 A 31 CYS HA H 1 4.983 0.010 A 31 CYS HB2 H 1 3.112 0.010 A 31 CYS HB3 H 1 2.546 0.010 A 31 CYS CA C 13 54.779 0.200 A 31 CYS CB C 13 39.558 0.200 A 31 CYS N N 15 120.387 0.100 A 32 LYS H H 1 9.326 0.010 A 32 LYS HA H 1 4.480 0.010 A 32 LYS HB2 H 1 2.089 0.010 A 32 LYS HB3 H 1 1.892 0.010 A 32 LYS HD2 H 1 1.839 0.010 A 32 LYS HD3 H 1 1.740 0.010 A 32 LYS HEy H 1 3.136 0.010 A 32 LYS HEx H 1 3.034 0.010 A 32 LYS HG2 H 1 1.624 0.010 A 32 LYS HG3 H 1 1.681 0.010 A 32 LYS CA C 13 53.776 0.200 A 32 LYS CB C 13 34.141 0.200 A 32 LYS CD C 13 28.751 0.200 A 32 LYS CE C 13 41.823 0.200 A 32 LYS CG C 13 22.821 0.200 A 32 LYS N N 15 122.824 0.100 A 33 GLY H H 1 8.424 0.010 A 33 GLY HA2 H 1 4.115 0.010 A 33 GLY HA3 H 1 3.869 0.010 A 33 GLY CA C 13 45.854 0.200 A 33 GLY N N 15 106.828 0.100 A 34 LYS H H 1 8.123 0.010 A 34 LYS HA H 1 4.085 0.010 A 34 LYS HBy H 1 1.706 0.010 A 34 LYS HBx H 1 1.533 0.010 A 34 LYS HD2 H 1 1.597 0.010 A 34 LYS HD3 H 1 1.597 0.010 A 34 LYS HE2 H 1 2.918 0.010 A 34 LYS HE3 H 1 2.918 0.010 A 34 LYS HG2 H 1 1.291 0.010 A 34 LYS HG3 H 1 1.291 0.010 A 34 LYS CA C 13 57.811 0.200 A 34 LYS CB C 13 33.471 0.200 A 34 LYS CD C 13 29.642 0.200 A 34 LYS CE C 13 42.121 0.200 A 34 LYS CG C 13 25.487 0.200 A 34 LYS N N 15 122.367 0.100 A 35 LEU H H 1 7.779 0.010 A 35 LEU HA H 1 4.230 0.010 A 35 LEU HB2 H 1 1.581 0.010 A 35 LEU HB3 H 1 1.581 0.010 A 35 LEU HDx% H 1 0.886 0.010 A 35 LEU HDy% H 1 0.920 0.010 A 35 LEU HG H 1 1.569 0.010 A 35 LEU CA C 13 56.875 0.200 A 35 LEU CB C 13 43.516 0.200 A 35 LEU CD1 C 13 23.828 0.200 A 35 LEU CD2 C 13 25.000 0.200 A 35 LEU CG C 13 27.344 0.200 A 35 LEU N N 15 127.191 0.100 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _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 3 ASP H A 2 ASN HBx 1.0 . 4.82 2 2 A 4 CYS H A 4 CYS HB3 1.0 . 3.67 3 3 A 4 CYS H A 4 CYS HB2 1.0 . 3.96 4 4 A 5 LEU H A 5 LEU HB2 1.0 . 2.97 5 5 A 5 LEU H A 5 LEU HB3 1.0 . 3.77 6 6 A 5 LEU H A 5 LEU HG 1.0 . 2.80 7 7 A 7 PHE H A 7 PHE HB2 1.0 . 2.64 8 8 A 7 PHE H A 7 PHE HB3 1.0 . 3.19 9 9 A 8 TRP H A 8 TRP HA 1.0 . 2.69 10 10 A 8 TRP H A 31 CYS HB2 1.0 . 3.34 11 11 A 9 SER H A 9 SER HB3 1.0 . 2.90 12 12 A 10 ALA H A 10 ALA HB% 1.0 . 2.62 13 13 A 11 CYS H A 11 CYS HB2 1.0 . 4.06 14 14 A 11 CYS H A 11 CYS HB3 1.0 . 3.74 15 15 A 14 LYS H A 14 LYS HB3 1.0 . 3.85 16 16 A 14 LYS H A 14 LYS HB2 1.0 . 3.11 17 17 A 14 LYS H A 14 LYS HGy 1.0 . 3.51 18 18 A 14 LYS H A 14 LYS HGx 1.0 . 3.51 19 19 A 14 LYS H A 12 ASN HB3 1.0 . 3.94 20 20 A 15 ASN H A 15 ASN HBy 1.0 . 3.47 21 21 A 15 ASN H A 15 ASN HBx 1.0 . 3.47 22 22 A 16 ASP H A 16 ASP HBy 1.0 . 3.08 23 23 A 16 ASP H A 16 ASP HBx 1.0 . 3.08 24 24 A 17 LYS H A 17 LYS HB3 1.0 . 3.75 25 25 A 18 CYS H A 18 CYS HB2 1.0 . 2.90 26 25 A 18 CYS H A 18 CYS HB3 1.0 . 2.90 27 26 A 19 CYS H A 19 CYS HB2 1.0 . 3.06 28 27 A 20 ALA H A 20 ALA HB% 1.0 . 2.93 29 28 A 21 ASN H A 21 ASN HBy 1.0 . 3.98 30 29 A 21 ASN H A 21 ASN HBx 1.0 . 3.98 31 30 A 22 LEU H A 22 LEU HB2 1.0 . 3.33 32 31 A 22 LEU H A 22 LEU HB3 1.0 . 3.70 33 32 A 22 LEU H A 22 LEU HG 1.0 . 3.46 34 33 A 22 LEU H A 22 LEU HD2% 1.0 . 4.34 35 34 A 23 VAL H A 23 VAL HB 1.0 . 3.62 36 35 A 23 VAL H A 23 VAL HG2% 1.0 . 4.02 37 36 A 23 VAL H A 23 VAL HG1% 1.0 . 3.19 38 37 A 24 CYS H A 24 CYS HB3 1.0 . 3.28 39 38 A 24 CYS H A 24 CYS HB2 1.0 . 3.39 40 39 A 25 SER H A 25 SER HB2 1.0 . 2.99 41 40 A 25 SER H A 25 SER HB3 1.0 . 2.82 42 41 A 26 SER H A 26 SER HBy 1.0 . 3.45 43 42 A 26 SER H A 26 SER HBx 1.0 . 3.45 44 43 A 27 LYS H A 27 LYS HBx 1.0 . 3.61 45 44 A 27 LYS H A 27 LYS HGy 1.0 . 4.75 46 45 A 27 LYS H A 27 LYS HGx 1.0 . 4.75 47 46 A 27 LYS H A 27 LYS HBy 1.0 . 3.61 48 47 A 27 LYS H A 27 LYS HE2 1.0 . 5.50 49 47 A 27 LYS H A 27 LYS HE3 1.0 . 5.50 50 48 A 29 LYS H A 29 LYS HA 1.0 . 2.62 51 49 A 29 LYS H A 29 LYS HB2 1.0 . 3.79 52 50 A 29 LYS H A 29 LYS HB3 1.0 . 4.15 53 51 A 31 CYS HB2 A 31 CYS H 1.0 . 2.79 54 52 A 31 CYS HB2 A 32 LYS H 1.0 . 4.72 55 53 A 33 GLY H A 33 GLY HA3 1.0 . 2.75 56 54 A 33 GLY HA2 A 34 LYS H 1.0 . 2.66 57 55 A 34 LYS H A 34 LYS HBy 1.0 . 3.25 58 56 A 34 LYS H A 34 LYS HBx 1.0 . 3.25 59 57 A 34 LYS H A 34 LYS HG2 1.0 . 3.96 60 57 A 34 LYS H A 34 LYS HG3 1.0 . 3.96 61 58 A 34 LYS H A 34 LYS HE2 1.0 . 4.76 62 58 A 34 LYS H A 34 LYS HE3 1.0 . 4.76 63 59 A 5 LEU H A 5 LEU HD1% 1.0 . 3.89 64 60 A 5 LEU H A 5 LEU HD2% 1.0 . 4.04 65 61 A 3 ASP H A 2 ASN HBy 1.0 . 4.82 66 62 A 3 ASP H A 4 CYS H 1.0 . 4.01 67 63 A 4 CYS H A 3 ASP HBy 1.0 . 4.68 68 64 A 4 CYS H A 3 ASP HBx 1.0 . 4.68 69 65 A 4 CYS H A 3 ASP HA 1.0 . 2.82 70 66 A 5 LEU H A 18 CYS HA 1.0 . 3.11 71 67 A 5 LEU H A 19 CYS HB3 1.0 . 5.27 72 68 A 4 CYS HB2 A 5 LEU H 1.0 . 3.10 73 69 A 5 LEU H A 17 LYS HB3 1.0 . 4.30 74 70 A 5 LEU HB2 A 6 GLY H 1.0 . 4.06 75 71 A 5 LEU HG A 6 GLY H 1.0 . 5.14 76 72 A 5 LEU HB3 A 6 GLY H 1.0 . 3.55 77 73 A 5 LEU HD2% A 6 GLY H 1.0 . 3.83 78 74 A 9 SER HB3 A 6 GLY H 1.0 . 3.66 79 75 A 6 GLY H A 5 LEU HA 1.0 . 2.59 80 76 A 7 PHE H A 22 LEU HD1% 1.0 . 3.59 81 77 A 7 PHE H A 22 LEU HD2% 1.0 . 4.60 82 78 A 7 PHE H A 6 GLY HA3 1.0 . 2.82 83 79 A 7 PHE H A 6 GLY HA2 1.0 . 3.07 84 80 A 7 PHE H A 8 TRP H 1.0 . 4.72 85 81 A 8 TRP H A 31 CYS H 1.0 . 4.10 86 82 A 8 TRP H A 9 SER H 1.0 . 3.23 87 83 A 8 TRP H A 7 PHE HE1 1.0 . 4.23 88 84 A 8 TRP H A 7 PHE HD1 1.0 . 3.58 89 85 A 8 TRP H A 8 TRP HE3 1.0 . 4.11 90 86 A 8 TRP H A 31 CYS HA 1.0 . 5.04 91 87 A 8 TRP H A 32 LYS HA 1.0 . 4.34 92 88 A 8 TRP H A 7 PHE HA 1.0 . 2.59 93 89 A 7 PHE HB2 A 8 TRP H 1.0 . 4.23 94 90 A 7 PHE HB3 A 8 TRP H 1.0 . 3.63 95 91 A 8 TRP H A 22 LEU HD1% 1.0 . 4.13 96 92 A 8 TRP H A 22 LEU HD2% 1.0 . 4.54 97 93 A 9 SER H A 10 ALA H 1.0 . 4.52 98 94 A 9 SER H A 30 TRP HA 1.0 . 5.00 99 95 A 9 SER H A 7 PHE HA 1.0 . 3.69 100 96 A 31 CYS HB2 A 9 SER H 1.0 . 3.13 101 97 A 9 SER H A 30 TRP HB2 1.0 . 4.11 102 98 A 10 ALA H A 9 SER HA 1.0 . 2.54 103 99 A 11 CYS H A 30 TRP HB2 1.0 . 4.82 104 100 A 11 CYS H A 29 LYS HB3 1.0 . 4.19 105 101 A 10 ALA HB% A 11 CYS H 1.0 . 3.28 106 102 A 11 CYS H A 5 LEU HD1% 1.0 . 4.64 107 103 A 11 CYS H A 30 TRP HB3 1.0 . 4.24 108 104 A 11 CYS H A 29 LYS HA 1.0 . 4.42 109 105 A 11 CYS H A 30 TRP HA 1.0 . 3.18 110 106 A 11 CYS H A 31 CYS H 1.0 . 5.43 111 107 A 10 ALA H A 11 CYS H 1.0 . 4.84 112 108 A 11 CYS H A 10 ALA HA 1.0 . 2.67 113 109 A 11 CYS HB2 A 12 ASN H 1.0 . 2.90 114 110 A 12 ASN H A 12 ASN HB2 1.0 . 3.60 115 111 A 5 LEU HD1% A 12 ASN H 1.0 . 4.34 116 112 A 12 ASN HD21 A 15 ASN HBx 1.0 . 4.34 117 113 A 12 ASN HD22 A 14 LYS HE2 1.0 . 4.10 118 113 A 12 ASN HD22 A 14 LYS HE3 1.0 . 4.10 119 114 A 14 LYS HB2 A 12 ASN HD22 1.0 . 4.25 120 115 A 14 LYS H A 13 PRO HD2 1.0 . 3.13 121 115 A 14 LYS H A 13 PRO HD3 1.0 . 3.13 122 116 A 14 LYS H A 13 PRO HG2 1.0 . 3.79 123 117 A 14 LYS H A 13 PRO HB3 1.0 . 4.49 124 118 A 14 LYS HB3 A 15 ASN H 1.0 . 4.33 125 119 A 14 LYS HB2 A 15 ASN H 1.0 . 3.67 126 120 A 12 ASN HB3 A 15 ASN H 1.0 . 3.48 127 121 A 15 ASN H A 13 PRO HD2 1.0 . 4.40 128 121 A 15 ASN H A 13 PRO HD3 1.0 . 4.40 129 122 A 15 ASN H A 14 LYS HA 1.0 . 3.55 130 123 A 14 LYS H A 15 ASN H 1.0 . 2.99 131 124 A 16 ASP H A 24 CYS HB2 1.0 . 4.86 132 125 A 16 ASP H A 15 ASN HA 1.0 . 2.87 133 126 A 15 ASN H A 16 ASP H 1.0 . 3.60 134 127 A 17 LYS H A 5 LEU HD1% 1.0 . 3.99 135 128 A 17 LYS H A 16 ASP HA 1.0 . 2.91 136 129 A 17 LYS H A 16 ASP HBy 1.0 . 4.60 137 130 A 17 LYS H A 18 CYS H 1.0 . 3.14 138 131 A 18 CYS H A 16 ASP HA 1.0 . 3.96 139 132 A 17 LYS HB3 A 18 CYS H 1.0 . 4.40 140 133 A 18 CYS H A 17 LYS HB2 1.0 . 4.43 141 134 A 18 CYS H A 5 LEU HD1% 1.0 . 4.36 142 135 A 5 LEU H A 19 CYS H 1.0 . 3.48 143 136 A 19 CYS H A 20 ALA H 1.0 . 4.56 144 137 A 19 CYS H A 18 CYS HA 1.0 . 2.72 145 138 A 19 CYS H A 6 GLY HA2 1.0 . 4.07 146 139 A 19 CYS H A 6 GLY HA3 1.0 . 5.50 147 140 A 19 CYS H A 19 CYS HB3 1.0 . 3.48 148 141 A 4 CYS HB3 A 19 CYS H 1.0 . 4.94 149 142 A 4 CYS HB2 A 19 CYS H 1.0 . 3.60 150 143 A 19 CYS H A 18 CYS HB2 1.0 . 3.18 151 143 A 18 CYS HB3 A 19 CYS H 1.0 . 3.18 152 144 A 19 CYS H A 22 LEU HB2 1.0 . 3.97 153 145 A 19 CYS H A 22 LEU HG 1.0 . 4.71 154 146 A 19 CYS H A 22 LEU HD1% 1.0 . 3.30 155 147 A 19 CYS HB2 A 20 ALA H 1.0 . 3.73 156 148 A 4 CYS HB2 A 20 ALA H 1.0 . 4.88 157 149 A 20 ALA H A 19 CYS HA 1.0 . 2.86 158 150 A 20 ALA H A 21 ASN H 1.0 . 3.99 159 151 A 21 ASN H A 20 ALA HA 1.0 . 2.99 160 152 A 21 ASN H A 22 LEU H 1.0 . 3.20 161 153 A 22 LEU H A 20 ALA HA 1.0 . 4.56 162 154 A 22 LEU H A 18 CYS HB2 1.0 . 3.85 163 154 A 18 CYS HB3 A 22 LEU H 1.0 . 3.85 164 155 A 20 ALA HB% A 22 LEU H 1.0 . 4.34 165 156 A 22 LEU H A 22 LEU HD1% 1.0 . 4.29 166 157 A 23 VAL H A 22 LEU HD1% 1.0 . 4.48 167 158 A 22 LEU HD2% A 23 VAL H 1.0 . 3.85 168 159 A 22 LEU HG A 23 VAL H 1.0 . 4.61 169 160 A 23 VAL H A 32 LYS HG3 1.0 . 4.07 170 161 A 22 LEU HB2 A 23 VAL H 1.0 . 3.76 171 162 A 23 VAL H A 31 CYS HB3 1.0 . 4.07 172 163 A 23 VAL H A 18 CYS HB2 1.0 . 4.01 173 163 A 18 CYS HB3 A 23 VAL H 1.0 . 4.01 174 164 A 23 VAL H A 33 GLY HA3 1.0 . 5.50 175 165 A 23 VAL H A 33 GLY HA2 1.0 . 3.97 176 166 A 23 VAL H A 22 LEU HA 1.0 . 2.85 177 167 A 22 LEU HB3 A 23 VAL H 1.0 . 3.07 178 168 A 23 VAL H A 24 CYS HA 1.0 . 5.02 179 169 A 22 LEU H A 23 VAL H 1.0 . 4.62 180 170 A 23 VAL H A 34 LYS H 1.0 . 4.52 181 171 A 23 VAL HB A 24 CYS H 1.0 . 4.02 182 172 A 23 VAL HG2% A 24 CYS H 1.0 . 3.33 183 173 A 24 CYS H A 23 VAL HA 1.0 . 2.92 184 174 A 23 VAL HG1% A 24 CYS H 1.0 . 4.48 185 175 A 24 CYS HB3 A 25 SER H 1.0 . 4.52 186 176 A 25 SER H A 32 LYS HB3 1.0 . 4.57 187 177 A 25 SER H A 32 LYS HG3 1.0 . 3.59 188 178 A 25 SER H A 28 HIS HBx 1.0 . 5.50 189 179 A 23 VAL HG1% A 25 SER H 1.0 . 4.73 190 180 A 25 SER H A 24 CYS HA 1.0 . 2.68 191 181 A 25 SER H A 31 CYS HA 1.0 . 4.10 192 182 A 25 SER H A 30 TRP H 1.0 . 3.77 193 183 A 25 SER H A 30 TRP HD1 1.0 . 3.95 194 184 A 25 SER HB2 A 26 SER H 1.0 . 4.41 195 185 A 26 SER H A 25 SER HA 1.0 . 2.80 196 186 A 26 SER H A 27 LYS H 1.0 . 3.54 197 187 A 25 SER H A 26 SER H 1.0 . 4.51 198 188 A 27 LYS H A 25 SER HA 1.0 . 3.98 199 189 A 27 LYS H A 29 LYS H 1.0 . 4.36 200 190 A 29 LYS H A 28 HIS HA 1.0 . 3.50 201 191 A 29 LYS H A 28 HIS H 1.0 . 3.49 202 192 A 29 LYS H A 30 TRP H 1.0 . 4.02 203 193 A 25 SER HB3 A 30 TRP H 1.0 . 3.30 204 194 A 29 LYS HA A 30 TRP H 1.0 . 3.46 205 195 A 30 TRP HE1 A 32 LYS HB2 1.0 . 4.06 206 196 A 32 LYS HB3 A 30 TRP HE1 1.0 . 3.70 207 197 A 32 LYS HG3 A 30 TRP HE1 1.0 . 4.24 208 198 A 31 CYS H A 22 LEU HD1% 1.0 . 5.38 209 199 A 31 CYS H A 30 TRP HB2 1.0 . 3.12 210 200 A 31 CYS H A 7 PHE HA 1.0 . 5.22 211 201 A 31 CYS H A 30 TRP HA 1.0 . 2.77 212 202 A 31 CYS H A 30 TRP H 1.0 . 4.81 213 203 A 31 CYS H A 30 TRP HD1 1.0 . 5.12 214 204 A 9 SER H A 31 CYS H 1.0 . 3.56 215 205 A 31 CYS H A 32 LYS H 1.0 . 4.32 216 206 A 23 VAL HG1% A 32 LYS H 1.0 . 4.19 217 207 A 32 LYS H A 31 CYS HB3 1.0 . 4.21 218 208 A 32 LYS H A 24 CYS HA 1.0 . 4.18 219 209 A 32 LYS H A 31 CYS HA 1.0 . 2.73 220 210 A 25 SER H A 32 LYS H 1.0 . 3.90 221 211 A 32 LYS H A 30 TRP HD1 1.0 . 4.59 222 212 A 33 GLY H A 32 LYS HB2 1.0 . 2.87 223 213 A 33 GLY H A 32 LYS HB3 1.0 . 3.66 224 214 A 33 GLY H A 32 LYS HG3 1.0 . 4.13 225 215 A 22 LEU HD2% A 33 GLY H 1.0 . 3.95 226 216 A 33 GLY H A 7 PHE HE1 1.0 . 3.55 227 217 A 33 GLY H A 7 PHE HD1 1.0 . 4.91 228 218 A 33 GLY H A 32 LYS HA 1.0 . 2.96 229 219 A 23 VAL HG1% A 34 LYS H 1.0 . 4.46 230 220 A 23 VAL HB A 34 LYS H 1.0 . 4.81 231 221 A 33 GLY HA3 A 34 LYS H 1.0 . 3.33 232 222 A 34 LYS H A 22 LEU HA 1.0 . 3.94 233 223 A 34 LYS H A 35 LEU H 1.0 . 4.44 234 224 A 35 LEU H A 34 LYS HG2 1.0 . 4.04 235 224 A 34 LYS HG3 A 35 LEU H 1.0 . 4.04 236 225 A 23 VAL HG1% A 35 LEU H 1.0 . 4.80 237 226 A 6 GLY H A 22 LEU HD1% 1.0 . 4.61 238 227 A 5 LEU H A 19 CYS HB2 1.0 . 5.23 239 228 A 5 LEU H A 9 SER HB3 1.0 . 5.50 240 229 A 4 CYS H A 5 LEU HD2% 1.0 . 5.12 241 230 A 4 CYS H A 5 LEU HA 1.0 . 5.01 242 231 A 7 PHE HE1 A 8 TRP HE1 1.0 . 4.69 243 232 A 7 PHE HB2 A 8 TRP HE1 1.0 . 5.36 244 233 A 8 TRP HE1 A 8 TRP HB2 1.0 . 4.81 245 234 A 8 TRP H A 32 LYS HB2 1.0 . 5.50 246 235 A 5 LEU HB3 A 9 SER H 1.0 . 5.03 247 236 A 10 ALA H A 30 TRP HA 1.0 . 4.74 248 237 A 10 ALA H A 30 TRP HB3 1.0 . 5.03 249 238 A 10 ALA H A 30 TRP HB2 1.0 . 5.18 250 239 A 10 ALA H A 5 LEU HD1% 1.0 . 4.94 251 240 A 11 CYS H A 30 TRP H 1.0 . 4.82 252 241 A 12 ASN H A 13 PRO HD2 1.0 . 4.70 253 241 A 12 ASN H A 13 PRO HD3 1.0 . 4.70 254 242 A 12 ASN H A 12 ASN HD21 1.0 . 5.26 255 243 A 12 ASN HD22 A 15 ASN HBx 1.0 . 5.33 256 244 A 14 LYS HB3 A 12 ASN HD22 1.0 . 4.82 257 245 A 14 LYS H A 16 ASP H 1.0 . 5.50 258 246 A 14 LYS H A 15 ASN HA 1.0 . 5.13 259 247 A 15 ASN H A 12 ASN H 1.0 . 4.90 260 248 A 16 ASP H A 17 LYS H 1.0 . 4.62 261 249 A 16 ASP H A 18 CYS H 1.0 . 5.50 262 250 A 5 LEU HB2 A 18 CYS H 1.0 . 5.00 263 251 A 19 CYS H A 22 LEU HD2% 1.0 . 5.29 264 252 A 20 ALA H A 22 LEU HD1% 1.0 . 4.70 265 253 A 4 CYS HB3 A 20 ALA H 1.0 . 5.50 266 254 A 19 CYS HB2 A 21 ASN H 1.0 . 5.50 267 255 A 21 ASN H A 19 CYS HB3 1.0 . 4.68 268 256 A 31 CYS HB2 A 23 VAL H 1.0 . 5.50 269 257 A 24 CYS H A 18 CYS HB2 1.0 . 5.06 270 257 A 18 CYS HB3 A 24 CYS H 1.0 . 5.06 271 258 A 23 VAL HG2% A 25 SER H 1.0 . 4.80 272 259 A 25 SER H A 28 HIS HBy 1.0 . 5.50 273 260 A 25 SER H A 32 LYS HB2 1.0 . 5.50 274 261 A 24 CYS H A 25 SER H 1.0 . 4.66 275 262 A 23 VAL H A 25 SER H 1.0 . 5.50 276 263 A 25 SER HB3 A 30 TRP HE1 1.0 . 4.85 277 264 A 25 SER HB2 A 30 TRP HE1 1.0 . 4.85 278 265 A 10 ALA HB% A 31 CYS H 1.0 . 5.36 279 266 A 31 CYS H A 9 SER HA 1.0 . 4.36 280 267 A 23 VAL HG2% A 32 LYS H 1.0 . 5.17 281 268 A 32 LYS H A 22 LEU HD1% 1.0 . 5.35 282 269 A 22 LEU HD2% A 32 LYS H 1.0 . 4.68 283 270 A 25 SER HB2 A 32 LYS H 1.0 . 5.10 284 271 A 25 SER HB3 A 32 LYS H 1.0 . 4.66 285 272 A 23 VAL HG1% A 33 GLY H 1.0 . 5.09 286 273 A 32 LYS H A 33 GLY H 1.0 . 4.77 287 274 A 23 VAL HG2% A 34 LYS H 1.0 . 4.85 288 275 A 29 LYS H A 25 SER HA 1.0 . 4.84 289 276 A 5 LEU HD1% A 6 GLY H 1.0 . 4.65 290 277 A 33 GLY HA3 A 35 LEU H 1.0 . 5.48 291 278 A 29 LYS H A 29 LYS HE2 1.0 . 5.50 292 278 A 29 LYS H A 29 LYS HE3 1.0 . 5.50 293 279 A 29 LYS H A 29 LYS HDy 1.0 . 5.50 294 280 A 29 LYS H A 29 LYS HDx 1.0 . 5.50 295 281 A 35 LEU H A 35 LEU HDx% 1.0 . 5.50 296 282 A 35 LEU H A 35 LEU HDy% 1.0 . 5.50 297 283 A 8 TRP H A 7 PHE HZ 1.0 . 5.50 298 284 A 4 CYS HB3 A 4 CYS HA 1.0 . 2.98 299 285 A 4 CYS HB2 A 4 CYS HA 1.0 . 3.02 300 286 A 11 CYS HB3 A 11 CYS HA 1.0 . 2.96 301 287 A 14 LYS HA A 14 LYS HGy 1.0 . 3.69 302 288 A 14 LYS HA A 14 LYS HGx 1.0 . 3.69 303 289 A 14 LYS HA A 14 LYS HD2 1.0 . 4.04 304 289 A 14 LYS HA A 14 LYS HD3 1.0 . 4.04 305 290 A 14 LYS HB3 A 14 LYS HD2 1.0 . 3.37 306 290 A 14 LYS HB3 A 14 LYS HD3 1.0 . 3.37 307 291 A 17 LYS HA A 17 LYS HGy 1.0 . 3.94 308 292 A 17 LYS HA A 17 LYS HGx 1.0 . 3.94 309 293 A 17 LYS HA A 17 LYS HD2 1.0 . 3.45 310 293 A 17 LYS HA A 17 LYS HD3 1.0 . 3.45 311 294 A 17 LYS HB3 A 17 LYS HD2 1.0 . 3.74 312 294 A 17 LYS HB3 A 17 LYS HD3 1.0 . 3.74 313 295 A 22 LEU HG A 22 LEU HA 1.0 . 3.66 314 296 A 22 LEU HB2 A 22 LEU HG 1.0 . 3.01 315 297 A 22 LEU HB3 A 22 LEU HG 1.0 . 3.00 316 298 A 22 LEU HD2% A 22 LEU HA 1.0 . 3.13 317 299 A 22 LEU HB2 A 22 LEU HD2% 1.0 . 3.72 318 300 A 22 LEU HB3 A 22 LEU HD2% 1.0 . 3.27 319 301 A 23 VAL HG1% A 32 LYS HD2 1.0 . 3.45 320 302 A 27 LYS HA A 27 LYS HGy 1.0 . 3.75 321 303 A 27 LYS HA A 27 LYS HGx 1.0 . 3.75 322 304 A 27 LYS HA A 27 LYS HDx 1.0 . 4.33 323 305 A 27 LYS HA A 27 LYS HDy 1.0 . 4.33 324 306 A 27 LYS HA A 27 LYS HE2 1.0 . 5.50 325 306 A 27 LYS HE3 A 27 LYS HA 1.0 . 5.50 326 307 A 27 LYS HE3 A 27 LYS HGy 1.0 . 4.08 327 307 A 27 LYS HGy A 27 LYS HE2 1.0 . 4.08 328 308 A 27 LYS HE3 A 27 LYS HGx 1.0 . 4.08 329 308 A 27 LYS HE2 A 27 LYS HGx 1.0 . 4.08 330 309 A 29 LYS HA A 29 LYS HG3 1.0 . 3.46 331 310 A 29 LYS HG3 A 29 LYS HE2 1.0 . 4.22 332 310 A 29 LYS HE3 A 29 LYS HG3 1.0 . 4.22 333 311 A 29 LYS HB2 A 29 LYS HDy 1.0 . 3.82 334 312 A 29 LYS HB3 A 29 LYS HDy 1.0 . 4.22 335 313 A 29 LYS HB2 A 29 LYS HDx 1.0 . 3.82 336 314 A 29 LYS HB3 A 29 LYS HDx 1.0 . 4.22 337 315 A 30 TRP HA A 30 TRP HB3 1.0 . 2.94 338 316 A 30 TRP HA A 30 TRP HB2 1.0 . 2.97 339 317 A 32 LYS HA A 32 LYS HG3 1.0 . 4.13 340 318 A 32 LYS HG2 A 32 LYS HEy 1.0 . 4.22 341 319 A 32 LYS HG2 A 32 LYS HEx 1.0 . 4.22 342 320 A 32 LYS HA A 32 LYS HD2 1.0 . 5.33 343 321 A 32 LYS HA A 32 LYS HD3 1.0 . 4.27 344 322 A 34 LYS HA A 34 LYS HG2 1.0 . 3.29 345 322 A 34 LYS HG3 A 34 LYS HA 1.0 . 3.29 346 323 A 34 LYS HA A 34 LYS HD2 1.0 . 4.12 347 323 A 34 LYS HA A 34 LYS HD3 1.0 . 4.12 348 324 A 34 LYS HE2 A 34 LYS HG2 1.0 . 3.23 349 324 A 34 LYS HE3 A 34 LYS HG2 1.0 . 3.23 350 324 A 34 LYS HG3 A 34 LYS HE2 1.0 . 3.23 351 324 A 34 LYS HG3 A 34 LYS HE3 1.0 . 3.23 352 325 A 5 LEU HB2 A 5 LEU HD1% 1.0 . 3.23 353 326 A 5 LEU HB2 A 5 LEU HD2% 1.0 . 3.49 354 327 A 5 LEU HB2 A 9 SER HB2 1.0 . 4.14 355 328 A 5 LEU HB2 A 18 CYS HA 1.0 . 3.04 356 329 A 5 LEU HB2 A 4 CYS HA 1.0 . 5.10 357 330 A 5 LEU HB2 A 19 CYS H 1.0 . 3.91 358 331 A 5 LEU HB3 A 5 LEU HD1% 1.0 . 3.25 359 332 A 5 LEU HB3 A 5 LEU HD2% 1.0 . 3.21 360 333 A 5 LEU HB3 A 9 SER HB3 1.0 . 3.28 361 334 A 5 LEU HB3 A 19 CYS H 1.0 . 5.34 362 335 A 17 LYS HB3 A 5 LEU HD1% 1.0 . 3.85 363 336 A 9 SER HB3 A 5 LEU HD1% 1.0 . 3.92 364 337 A 5 LEU HD1% A 17 LYS HA 1.0 . 5.00 365 338 A 5 LEU HD1% A 11 CYS HA 1.0 . 3.64 366 339 A 22 LEU HD1% A 7 PHE HA 1.0 . 3.28 367 340 A 22 LEU HD2% A 7 PHE HA 1.0 . 3.82 368 341 A 31 CYS HB2 A 7 PHE HA 1.0 . 3.48 369 342 A 6 GLY HA2 A 7 PHE HA 1.0 . 4.42 370 343 A 32 LYS HA A 7 PHE HA 1.0 . 4.91 371 344 A 7 PHE HD1 A 7 PHE HA 1.0 . 3.62 372 345 A 9 SER HB3 A 5 LEU HA 1.0 . 4.86 373 346 A 5 LEU HA A 9 SER HB2 1.0 . 5.28 374 347 A 5 LEU HD1% A 5 LEU HA 1.0 . 4.08 375 348 A 4 CYS HB2 A 19 CYS HB2 1.0 . 4.83 376 349 A 4 CYS HB2 A 5 LEU HG 1.0 . 4.66 377 350 A 4 CYS HB2 A 19 CYS HA 1.0 . 2.95 378 351 A 5 LEU HD2% A 5 LEU HA 1.0 . 2.86 379 352 A 6 GLY HA3 A 7 PHE HA 1.0 . 5.02 380 353 A 9 SER H A 8 TRP HB2 1.0 . 4.84 381 354 A 7 PHE HB3 A 8 TRP HB2 1.0 . 4.86 382 355 A 30 TRP HB2 A 8 TRP HB3 1.0 . 4.72 383 356 A 8 TRP HE3 A 8 TRP HB3 1.0 . 3.86 384 357 A 9 SER H A 8 TRP HB3 1.0 . 4.79 385 358 A 23 VAL HA A 18 CYS HB2 1.0 . 4.11 386 358 A 18 CYS HB3 A 23 VAL HA 1.0 . 4.11 387 359 A 23 VAL HB A 23 VAL HA 1.0 . 2.96 388 360 A 23 VAL HG2% A 23 VAL HA 1.0 . 3.08 389 361 A 23 VAL HG1% A 23 VAL HA 1.0 . 3.60 390 362 A 32 LYS H A 23 VAL HA 1.0 . 5.19 391 363 A 5 LEU HB2 A 9 SER HB3 1.0 . 4.00 392 364 A 9 SER HB3 A 5 LEU HD2% 1.0 . 3.84 393 365 A 9 SER HB3 A 10 ALA H 1.0 . 4.05 394 366 A 10 ALA HB% A 9 SER HA 1.0 . 3.95 395 367 A 9 SER HB3 A 10 ALA HB% 1.0 . 5.30 396 368 A 10 ALA HB% A 30 TRP HB3 1.0 . 4.54 397 369 A 11 CYS HB2 A 12 ASN HB2 1.0 . 4.70 398 370 A 11 CYS HB2 A 24 CYS HB2 1.0 . 4.32 399 371 A 11 CYS HB2 A 17 LYS HB2 1.0 . 4.57 400 372 A 11 CYS HB2 A 5 LEU HD1% 1.0 . 3.23 401 373 A 11 CYS HB2 A 13 PRO HD2 1.0 . 5.50 402 373 A 11 CYS HB2 A 13 PRO HD3 1.0 . 5.50 403 374 A 22 LEU HB2 A 23 VAL HA 1.0 . 5.05 404 375 A 11 CYS HB3 A 24 CYS HB2 1.0 . 4.83 405 376 A 5 LEU HB2 A 11 CYS HB3 1.0 . 4.55 406 377 A 5 LEU HG A 11 CYS HB3 1.0 . 5.37 407 378 A 11 CYS HB3 A 17 LYS HB2 1.0 . 5.50 408 379 A 11 CYS HB3 A 5 LEU HD1% 1.0 . 3.08 409 380 A 9 SER HB3 A 11 CYS HB3 1.0 . 4.48 410 381 A 11 CYS HB3 A 17 LYS H 1.0 . 4.76 411 382 A 11 CYS HB3 A 31 CYS H 1.0 . 4.52 412 383 A 11 CYS HB3 A 12 ASN H 1.0 . 3.70 413 384 A 14 LYS HB3 A 14 LYS HE2 1.0 . 4.39 414 384 A 14 LYS HB3 A 14 LYS HE3 1.0 . 4.39 415 385 A 13 PRO HB2 A 26 SER HA 1.0 . 4.14 416 386 A 13 PRO HB2 A 12 ASN HA 1.0 . 5.50 417 387 A 13 PRO HD3 A 14 LYS HE2 1.0 . 4.08 418 387 A 13 PRO HD2 A 14 LYS HE2 1.0 . 4.08 419 387 A 14 LYS HE3 A 13 PRO HD2 1.0 . 4.08 420 387 A 14 LYS HE3 A 13 PRO HD3 1.0 . 4.08 421 388 A 12 ASN HB2 A 13 PRO HD2 1.0 . 3.83 422 388 A 12 ASN HB2 A 13 PRO HD3 1.0 . 3.83 423 389 A 29 LYS HG2 A 13 PRO HD2 1.0 . 3.88 424 389 A 13 PRO HD3 A 29 LYS HG2 1.0 . 3.88 425 390 A 12 ASN HA A 13 PRO HD2 1.0 . 2.44 426 390 A 13 PRO HD3 A 12 ASN HA 1.0 . 2.44 427 391 A 12 ASN HD21 A 14 LYS HA 1.0 . 4.56 428 392 A 11 CYS HB3 A 18 CYS HB2 1.0 . 5.39 429 392 A 11 CYS HB3 A 18 CYS HB3 1.0 . 5.39 430 393 A 12 ASN HD22 A 15 ASN HBy 1.0 . 5.33 431 394 A 12 ASN HD21 A 15 ASN HBy 1.0 . 4.34 432 395 A 14 LYS HB2 A 15 ASN HBx 1.0 . 4.59 433 396 A 14 LYS HB2 A 15 ASN HBy 1.0 . 4.59 434 397 A 16 ASP HA A 17 LYS HB2 1.0 . 4.63 435 398 A 15 ASN HA A 16 ASP HBy 1.0 . 5.13 436 399 A 15 ASN HA A 16 ASP HBx 1.0 . 5.13 437 400 A 17 LYS H A 16 ASP HBx 1.0 . 4.60 438 401 A 17 LYS H A 17 LYS HGy 1.0 . 4.38 439 402 A 17 LYS H A 17 LYS HGx 1.0 . 4.38 440 403 A 18 CYS HA A 5 LEU HA 1.0 . 5.26 441 404 A 18 CYS HA A 19 CYS HA 1.0 . 5.50 442 405 A 5 LEU HB3 A 18 CYS HA 1.0 . 3.99 443 406 A 5 LEU HD1% A 18 CYS HA 1.0 . 4.58 444 407 A 19 CYS HB3 A 20 ALA HA 1.0 . 4.91 445 408 A 20 ALA HB% A 21 ASN H 1.0 . 3.75 446 409 A 20 ALA HB% A 21 ASN HD2y 1.0 . 4.84 447 410 A 20 ALA HB% A 21 ASN HD2x 1.0 . 4.84 448 411 A 22 LEU HA A 18 CYS HB2 1.0 . 4.69 449 411 A 18 CYS HB3 A 22 LEU HA 1.0 . 4.69 450 412 A 31 CYS HB2 A 22 LEU HB2 1.0 . 4.86 451 413 A 22 LEU HB2 A 22 LEU HD1% 1.0 . 3.31 452 414 A 22 LEU HD1% A 22 LEU HA 1.0 . 4.58 453 415 A 22 LEU HB3 A 22 LEU HD1% 1.0 . 3.26 454 416 A 22 LEU HB3 A 23 VAL HG1% 1.0 . 4.87 455 417 A 22 LEU HB3 A 33 GLY HA2 1.0 . 5.01 456 418 A 22 LEU HB3 A 23 VAL HA 1.0 . 4.50 457 419 A 22 LEU HB3 A 32 LYS H 1.0 . 4.14 458 420 A 22 LEU HG A 18 CYS HB2 1.0 . 4.26 459 420 A 18 CYS HB3 A 22 LEU HG 1.0 . 4.26 460 421 A 22 LEU HB3 A 23 VAL HG2% 1.0 . 5.50 461 422 A 22 LEU HD2% A 33 GLY HA3 1.0 . 3.78 462 423 A 31 CYS HB2 A 22 LEU HD2% 1.0 . 4.08 463 424 A 7 PHE HB2 A 22 LEU HD2% 1.0 . 3.96 464 425 A 22 LEU HD2% A 7 PHE HE1 1.0 . 4.01 465 426 A 22 LEU HD2% A 34 LYS H 1.0 . 4.28 466 427 A 24 CYS HB2 A 23 VAL HA 1.0 . 4.36 467 428 A 31 CYS HB2 A 9 SER HA 1.0 . 4.68 468 429 A 22 LEU HA A 23 VAL HA 1.0 . 4.70 469 430 A 23 VAL HG2% A 34 LYS HE2 1.0 . 4.17 470 430 A 23 VAL HG2% A 34 LYS HE3 1.0 . 4.17 471 431 A 23 VAL HG2% A 25 SER HB2 1.0 . 4.29 472 432 A 23 VAL HG1% A 22 LEU HA 1.0 . 4.35 473 433 A 23 VAL HG1% A 32 LYS HEx 1.0 . 4.82 474 434 A 23 VAL HG1% A 18 CYS HB2 1.0 . 5.48 475 434 A 18 CYS HB3 A 23 VAL HG1% 1.0 . 5.48 476 435 A 23 VAL HG1% A 32 LYS HG2 1.0 . 3.46 477 436 A 23 VAL HG2% A 32 LYS HG3 1.0 . 4.33 478 437 A 31 CYS HA A 24 CYS HA 1.0 . 3.94 479 438 A 23 VAL HG2% A 24 CYS HB3 1.0 . 4.41 480 439 A 24 CYS HB3 A 16 ASP HA 1.0 . 4.15 481 440 A 24 CYS HB3 A 23 VAL HA 1.0 . 5.36 482 441 A 24 CYS HB3 A 25 SER HA 1.0 . 5.50 483 442 A 23 VAL HG2% A 24 CYS HB2 1.0 . 4.49 484 443 A 24 CYS HB2 A 16 ASP HA 1.0 . 4.49 485 444 A 22 LEU HD2% A 18 CYS HB2 1.0 . 4.15 486 444 A 18 CYS HB3 A 22 LEU HD2% 1.0 . 4.15 487 445 A 23 VAL HG2% A 34 LYS HD2 1.0 . 4.93 488 445 A 23 VAL HG2% A 34 LYS HD3 1.0 . 4.93 489 446 A 23 VAL HG2% A 22 LEU HA 1.0 . 5.50 490 447 A 30 TRP HA A 10 ALA HA 1.0 . 3.36 491 448 A 30 TRP HA A 30 TRP HE3 1.0 . 5.11 492 449 A 31 CYS H A 30 TRP HB3 1.0 . 3.75 493 450 A 30 TRP HB3 A 30 TRP HE3 1.0 . 3.28 494 451 A 30 TRP HB3 A 30 TRP H 1.0 . 4.03 495 452 A 30 TRP HB3 A 10 ALA HA 1.0 . 3.75 496 453 A 8 TRP HA A 30 TRP HB3 1.0 . 4.50 497 454 A 10 ALA HB% A 30 TRP HA 1.0 . 4.26 498 455 A 30 TRP HB2 A 10 ALA HA 1.0 . 4.04 499 456 A 30 TRP HB2 A 30 TRP HD1 1.0 . 3.85 500 457 A 30 TRP HB2 A 30 TRP HE3 1.0 . 3.69 501 458 A 8 TRP H A 30 TRP HB2 1.0 . 4.67 502 459 A 31 CYS HB2 A 22 LEU HB3 1.0 . 4.27 503 460 A 31 CYS HB2 A 22 LEU HD1% 1.0 . 3.47 504 461 A 31 CYS HB2 A 9 SER HB3 1.0 . 4.13 505 462 A 22 LEU HB2 A 31 CYS HB3 1.0 . 3.62 506 463 A 22 LEU HG A 31 CYS HB3 1.0 . 4.67 507 464 A 22 LEU HB3 A 31 CYS HB3 1.0 . 3.25 508 465 A 22 LEU HD1% A 31 CYS HB3 1.0 . 3.13 509 466 A 22 LEU HD2% A 31 CYS HB3 1.0 . 4.03 510 467 A 31 CYS HB3 A 18 CYS HB2 1.0 . 3.26 511 467 A 18 CYS HB3 A 31 CYS HB3 1.0 . 3.26 512 468 A 7 PHE HA A 31 CYS HB3 1.0 . 3.81 513 469 A 9 SER HB3 A 31 CYS HB3 1.0 . 4.42 514 470 A 9 SER H A 31 CYS HB3 1.0 . 4.11 515 471 A 31 CYS H A 31 CYS HB3 1.0 . 3.79 516 472 A 8 TRP H A 31 CYS HB3 1.0 . 4.33 517 473 A 19 CYS H A 31 CYS HB3 1.0 . 4.48 518 474 A 31 CYS HB2 A 18 CYS HB2 1.0 . 3.74 519 474 A 31 CYS HB2 A 18 CYS HB3 1.0 . 3.74 520 475 A 22 LEU HD2% A 32 LYS HA 1.0 . 3.94 521 476 A 33 GLY HA3 A 32 LYS HA 1.0 . 4.78 522 477 A 7 PHE HE1 A 32 LYS HA 1.0 . 3.81 523 478 A 23 VAL HG1% A 32 LYS HG3 1.0 . 3.97 524 479 A 32 LYS H A 32 LYS HG3 1.0 . 3.78 525 480 A 25 SER HB3 A 32 LYS HG2 1.0 . 4.43 526 481 A 25 SER HB2 A 32 LYS HG2 1.0 . 3.89 527 482 A 33 GLY H A 32 LYS HG2 1.0 . 4.56 528 483 A 32 LYS H A 32 LYS HG2 1.0 . 3.78 529 484 A 30 TRP HD1 A 32 LYS HD2 1.0 . 5.50 530 485 A 32 LYS H A 32 LYS HD2 1.0 . 4.69 531 486 A 23 VAL HG1% A 32 LYS HD3 1.0 . 4.59 532 487 A 33 GLY HA2 A 32 LYS HD3 1.0 . 4.05 533 488 A 7 PHE HE1 A 32 LYS HD3 1.0 . 5.37 534 489 A 23 VAL HG1% A 32 LYS HEy 1.0 . 4.82 535 490 A 33 GLY HA2 A 32 LYS HG3 1.0 . 5.50 536 491 A 33 GLY HA2 A 22 LEU HD1% 1.0 . 5.50 537 492 A 22 LEU HD2% A 33 GLY HA2 1.0 . 3.02 538 493 A 33 GLY HA2 A 32 LYS HA 1.0 . 4.47 539 494 A 33 GLY HA2 A 22 LEU HA 1.0 . 3.66 540 495 A 33 GLY HA2 A 7 PHE HE1 1.0 . 4.92 541 496 A 33 GLY HA3 A 7 PHE HE1 1.0 . 4.34 542 497 A 33 GLY HA3 A 32 LYS HB2 1.0 . 4.39 543 498 A 35 LEU H A 34 LYS HA 1.0 . 3.17 544 499 A 23 VAL HG2% A 34 LYS HA 1.0 . 4.03 545 500 A 23 VAL HG1% A 34 LYS HA 1.0 . 3.33 546 501 A 32 LYS HD2 A 34 LYS HA 1.0 . 4.72 547 502 A 35 LEU H A 34 LYS HBy 1.0 . 4.78 548 503 A 35 LEU H A 34 LYS HBx 1.0 . 4.78 549 504 A 23 VAL HG1% A 34 LYS HG2 1.0 . 3.96 550 504 A 23 VAL HG1% A 34 LYS HG3 1.0 . 3.96 551 505 A 23 VAL HG1% A 34 LYS HE2 1.0 . 4.66 552 505 A 23 VAL HG1% A 34 LYS HE3 1.0 . 4.66 553 506 A 29 LYS HG2 A 29 LYS HE2 1.0 . 4.16 554 506 A 29 LYS HE3 A 29 LYS HG2 1.0 . 4.16 555 507 A 29 LYS HA A 29 LYS HG2 1.0 . 3.14 556 508 A 29 LYS H A 29 LYS HG2 1.0 . 3.96 557 509 A 29 LYS H A 29 LYS HG3 1.0 . 3.84 558 510 A 25 SER HB3 A 28 HIS HBy 1.0 . 4.03 559 511 A 28 HIS H A 28 HIS HBy 1.0 . 3.65 560 512 A 28 HIS H A 28 HIS HBx 1.0 . 3.65 561 513 A 19 CYS HB2 A 4 CYS HA 1.0 . 4.64 562 514 A 5 LEU HD2% A 4 CYS HA 1.0 . 4.43 563 515 A 6 GLY H A 6 GLY HA3 1.0 . 2.55 564 516 A 4 CYS HB3 A 5 LEU HG 1.0 . 5.48 565 517 A 4 CYS HB3 A 19 CYS HA 1.0 . 3.60 566 518 A 4 CYS HB3 A 5 LEU H 1.0 . 3.46 567 519 A 5 LEU HB3 A 9 SER HB2 1.0 . 3.27 568 520 A 5 LEU HD1% A 9 SER HB2 1.0 . 4.35 569 521 A 5 LEU HD2% A 9 SER HB2 1.0 . 4.44 570 522 A 9 SER H A 9 SER HB2 1.0 . 3.35 571 523 A 10 ALA H A 9 SER HB2 1.0 . 4.49 572 524 A 14 LYS HB2 A 12 ASN HD21 1.0 . 4.73 573 525 A 5 LEU HD1% A 17 LYS HB2 1.0 . 3.32 574 526 A 17 LYS H A 17 LYS HB2 1.0 . 3.52 575 527 A 5 LEU H A 17 LYS HB2 1.0 . 5.14 576 528 A 7 PHE HE1 A 32 LYS HB2 1.0 . 4.10 577 529 A 25 SER HB3 A 32 LYS HB3 1.0 . 4.45 578 530 A 25 SER HB2 A 32 LYS HB3 1.0 . 4.36 579 531 A 32 LYS H A 32 LYS HB3 1.0 . 4.13 580 532 A 23 VAL HB A 34 LYS HA 1.0 . 4.46 581 533 A 23 VAL HB A 34 LYS HE2 1.0 . 4.05 582 533 A 23 VAL HB A 34 LYS HE3 1.0 . 4.05 583 534 A 23 VAL HB A 34 LYS HD2 1.0 . 4.60 584 534 A 23 VAL HB A 34 LYS HD3 1.0 . 4.60 585 535 A 23 VAL HB A 34 LYS HG2 1.0 . 3.76 586 535 A 23 VAL HB A 34 LYS HG3 1.0 . 3.76 587 536 A 7 PHE HB2 A 6 GLY HA3 1.0 . 4.66 588 537 A 7 PHE HB3 A 7 PHE HD1 1.0 . 3.32 589 538 A 7 PHE HB3 A 8 TRP HE1 1.0 . 4.58 590 539 A 7 PHE HB3 A 22 LEU HD1% 1.0 . 4.49 591 540 A 7 PHE HB3 A 22 LEU HD2% 1.0 . 4.99 592 541 A 14 LYS H A 13 PRO HB2 1.0 . 4.05 593 542 A 25 SER HB2 A 32 LYS HB2 1.0 . 4.92 594 543 A 25 SER HB2 A 32 LYS HD2 1.0 . 3.43 595 544 A 25 SER HB2 A 32 LYS HG3 1.0 . 3.21 596 545 A 23 VAL HG1% A 25 SER HB2 1.0 . 5.04 597 546 A 25 SER HB2 A 28 HIS H 1.0 . 4.24 598 547 A 25 SER HB2 A 29 LYS H 1.0 . 4.92 599 548 A 25 SER HB3 A 32 LYS HD2 1.0 . 4.75 600 549 A 25 SER HB3 A 32 LYS HG3 1.0 . 3.92 601 550 A 25 SER HB3 A 28 HIS HBx 1.0 . 4.03 602 551 A 25 SER HB3 A 29 LYS H 1.0 . 3.76 603 552 A 25 SER HB3 A 24 CYS HA 1.0 . 4.65 604 553 A 25 SER HB2 A 24 CYS HA 1.0 . 4.99 605 554 A 22 LEU HD1% A 6 GLY HA3 1.0 . 4.12 606 555 A 7 PHE HB2 A 6 GLY HA2 1.0 . 4.75 607 556 A 5 LEU HA A 6 GLY HA2 1.0 . 4.50 608 557 A 5 LEU HA A 6 GLY HA3 1.0 . 4.47 609 558 A 22 LEU HB2 A 18 CYS HB2 1.0 . 2.72 610 558 A 18 CYS HB3 A 22 LEU HB2 1.0 . 2.72 611 559 A 5 LEU HB2 A 18 CYS HB2 1.0 . 3.66 612 559 A 5 LEU HB2 A 18 CYS HB3 1.0 . 3.66 613 560 A 22 LEU HB3 A 18 CYS HB2 1.0 . 2.97 614 560 A 18 CYS HB3 A 22 LEU HB3 1.0 . 2.97 615 561 A 22 LEU HD1% A 18 CYS HB2 1.0 . 3.37 616 561 A 18 CYS HB3 A 22 LEU HD1% 1.0 . 3.37 617 562 A 19 CYS HA A 18 CYS HB2 1.0 . 4.44 618 562 A 18 CYS HB3 A 19 CYS HA 1.0 . 4.44 619 563 A 18 CYS HA A 18 CYS HB2 1.0 . 2.85 620 563 A 18 CYS HB3 A 18 CYS HA 1.0 . 2.85 621 564 A 5 LEU H A 18 CYS HB2 1.0 . 4.28 622 564 A 5 LEU H A 18 CYS HB3 1.0 . 4.28 623 565 A 14 LYS H A 12 ASN HA 1.0 . 4.42 624 566 A 12 ASN HD21 A 12 ASN HA 1.0 . 4.70 625 567 A 13 PRO HG2 A 12 ASN HA 1.0 . 4.64 626 568 A 29 LYS HB3 A 12 ASN HA 1.0 . 4.92 627 569 A 12 ASN HA A 13 PRO HG3 1.0 . 4.57 628 570 A 12 ASN HB3 A 13 PRO HD2 1.0 . 3.99 629 570 A 12 ASN HB3 A 13 PRO HD3 1.0 . 3.99 630 571 A 12 ASN HB3 A 11 CYS HA 1.0 . 5.50 631 572 A 12 ASN HB3 A 12 ASN HD22 1.0 . 3.94 632 573 A 12 ASN HB3 A 12 ASN HD21 1.0 . 3.50 633 574 A 12 ASN HB3 A 12 ASN H 1.0 . 3.44 634 575 A 12 ASN HB2 A 12 ASN HD22 1.0 . 3.99 635 576 A 12 ASN HB2 A 12 ASN HD21 1.0 . 3.36 636 577 A 13 PRO HG2 A 14 LYS HE2 1.0 . 4.25 637 577 A 14 LYS HE3 A 13 PRO HG2 1.0 . 4.25 638 578 A 29 LYS HB3 A 29 LYS HE2 1.0 . 4.61 639 578 A 29 LYS HB3 A 29 LYS HE3 1.0 . 4.61 640 579 A 11 CYS H A 29 LYS HB2 1.0 . 4.48 641 580 A 25 SER HA A 32 LYS HD2 1.0 . 4.47 642 581 A 32 LYS HG3 A 25 SER HA 1.0 . 4.58 643 582 A 23 VAL HG2% A 25 SER HA 1.0 . 4.59 644 583 A 23 VAL HG1% A 25 SER HA 1.0 . 4.72 645 584 A 7 PHE HB2 A 22 LEU HD1% 1.0 . 4.00 646 585 A 9 SER HB3 A 22 LEU HD1% 1.0 . 5.50 647 586 A 22 LEU HD1% A 9 SER HB2 1.0 . 5.50 648 587 A 22 LEU HD1% A 6 GLY HA2 1.0 . 3.41 649 588 A 22 LEU HD1% A 19 CYS HA 1.0 . 4.39 650 589 A 18 CYS HA A 22 LEU HD1% 1.0 . 3.89 651 590 A 22 LEU HD1% A 7 PHE HD1 1.0 . 4.91 652 591 A 22 LEU HD1% A 7 PHE HE1 1.0 . 5.50 653 592 A 35 LEU H A 35 LEU HG 1.0 . 4.45 654 593 A 14 LYS H A 14 LYS HD2 1.0 . 4.87 655 593 A 14 LYS H A 14 LYS HD3 1.0 . 4.87 656 594 A 20 ALA HB% A 19 CYS HA 1.0 . 4.61 657 595 A 20 ALA H A 19 CYS HB3 1.0 . 3.01 658 596 A 19 CYS HB3 A 18 CYS HB2 1.0 . 5.45 659 596 A 18 CYS HB3 A 19 CYS HB3 1.0 . 5.45 660 597 A 4 CYS HB2 A 19 CYS HB3 1.0 . 5.06 661 598 A 20 ALA HB% A 19 CYS HB3 1.0 . 3.93 662 599 A 19 CYS HB3 A 22 LEU HD1% 1.0 . 3.93 663 600 A 19 CYS HB2 A 6 GLY HA2 1.0 . 4.13 664 601 A 19 CYS HB2 A 18 CYS HA 1.0 . 4.39 665 602 A 19 CYS HB2 A 20 ALA HB% 1.0 . 4.76 666 603 A 5 LEU HG A 17 LYS HB3 1.0 . 4.09 667 604 A 5 LEU HG A 9 SER HB3 1.0 . 4.89 668 605 A 5 LEU HG A 5 LEU HA 1.0 . 4.07 669 606 A 5 LEU HG A 18 CYS HA 1.0 . 4.36 670 607 A 5 LEU HD2% A 18 CYS HA 1.0 . 4.82 671 608 A 10 ALA H A 5 LEU HD2% 1.0 . 5.35 672 609 A 29 LYS HG2 A 13 PRO HG3 1.0 . 4.17 673 610 A 26 SER HA A 13 PRO HA 1.0 . 5.50 674 611 A 31 CYS HB2 A 9 SER HB2 1.0 . 3.39 675 612 A 13 PRO HB3 A 26 SER HA 1.0 . 2.87 676 613 A 26 SER HA A 13 PRO HG3 1.0 . 4.44 677 614 A 8 TRP HA A 31 CYS H 1.0 . 4.29 678 615 A 8 TRP HA A 7 PHE HD1 1.0 . 4.01 679 616 A 8 TRP HA A 7 PHE HA 1.0 . 4.55 680 617 A 8 TRP HA A 30 TRP HB2 1.0 . 3.24 681 618 A 29 LYS HA A 30 TRP HA 1.0 . 4.39 682 619 A 8 TRP HA A 30 TRP HE3 1.0 . 4.67 683 620 A 29 LYS HA A 29 LYS HDy 1.0 . 5.50 684 621 A 29 LYS HA A 29 LYS HDx 1.0 . 5.50 685 622 A 8 TRP HA A 8 TRP HE3 1.0 . 3.31 686 623 A 33 GLY HA2 A 7 PHE HZ 1.0 . 4.45 687 624 A 33 GLY HA3 A 7 PHE HZ 1.0 . 4.33 688 625 A 22 LEU HD2% A 7 PHE HZ 1.0 . 4.30 689 626 A 33 GLY H A 7 PHE HZ 1.0 . 4.08 690 627 A 8 TRP H A 7 PHE HD1 1.0 . 4.22 691 627 A 8 TRP H A 7 PHE HD2 1.0 . 4.22 692 628 A 7 PHE HD1 A 32 LYS HA 1.0 . 4.14 693 628 A 32 LYS HA A 7 PHE HD2 1.0 . 4.14 694 629 A 22 LEU HD1% A 7 PHE HD1 1.0 . 4.36 695 629 A 22 LEU HD1% A 7 PHE HD2 1.0 . 4.36 696 630 A 22 LEU HD2% A 7 PHE HD1 1.0 . 3.69 697 630 A 22 LEU HD2% A 7 PHE HD2 1.0 . 3.69 698 631 A 33 GLY H A 7 PHE HE1 1.0 . 4.13 699 631 A 33 GLY H A 7 PHE HE2 1.0 . 4.13 700 632 A 7 PHE HE1 A 32 LYS HA 1.0 . 3.99 701 632 A 32 LYS HA A 7 PHE HE2 1.0 . 3.99 702 633 A 33 GLY HA3 A 7 PHE HE1 1.0 . 4.51 703 633 A 33 GLY HA3 A 7 PHE HE2 1.0 . 4.51 704 634 A 22 LEU HD2% A 7 PHE HE1 1.0 . 4.14 705 634 A 22 LEU HD2% A 7 PHE HE2 1.0 . 4.14 706 635 A 7 PHE HB2 A 8 TRP HD1 1.0 . 4.37 707 636 A 7 PHE HB3 A 8 TRP HD1 1.0 . 3.25 708 637 A 30 TRP HA A 30 TRP HD1 1.0 . 5.50 709 638 A 25 SER HB2 A 30 TRP HD1 1.0 . 3.58 710 639 A 25 SER HB3 A 30 TRP HD1 1.0 . 3.04 711 640 A 32 LYS HB3 A 30 TRP HD1 1.0 . 3.45 712 641 A 32 LYS HG3 A 30 TRP HD1 1.0 . 3.94 713 642 A 30 TRP HD1 A 28 HIS HBy 1.0 . 3.82 714 643 A 30 TRP HD1 A 28 HIS HBx 1.0 . 3.82 715 644 A 29 LYS H A 30 TRP HD1 1.0 . 4.57 716 645 A 30 TRP HD1 A 32 LYS HG2 1.0 . 3.44 717 646 A 3 ASP H A 2 ASN HBx 1.0 . 4.16 718 646 A 3 ASP H A 2 ASN HBy 1.0 . 4.16 719 647 A 4 CYS H A 2 ASN HBx 1.0 . 4.90 720 647 A 4 CYS H A 2 ASN HBy 1.0 . 4.90 721 648 A 3 ASP H A 3 ASP HBx 1.0 . 3.34 722 648 A 3 ASP H A 3 ASP HBy 1.0 . 3.34 723 649 A 4 CYS H A 3 ASP HBx 1.0 . 3.95 724 649 A 4 CYS H A 3 ASP HBy 1.0 . 3.95 725 650 A 12 ASN HA A 29 LYS HDx 1.0 . 4.91 726 650 A 12 ASN HA A 29 LYS HDy 1.0 . 4.91 727 651 A 12 ASN HB3 A 15 ASN HBx 1.0 . 3.85 728 651 A 12 ASN HB3 A 15 ASN HBy 1.0 . 3.85 729 652 A 12 ASN HD21 A 15 ASN HBx 1.0 . 3.74 730 652 A 12 ASN HD21 A 15 ASN HBy 1.0 . 3.74 731 653 A 13 PRO HB3 A 26 SER HBx 1.0 . 4.79 732 653 A 13 PRO HB3 A 26 SER HBy 1.0 . 4.79 733 654 A 13 PRO HG2 A 14 LYS HGx 1.0 . 4.45 734 654 A 13 PRO HG2 A 14 LYS HGy 1.0 . 4.45 735 655 A 13 PRO HG3 A 26 SER HBx 1.0 . 4.85 736 655 A 13 PRO HG3 A 26 SER HBy 1.0 . 4.85 737 656 A 13 PRO HD3 A 29 LYS HDx 1.0 . 3.72 738 656 A 13 PRO HD2 A 29 LYS HDx 1.0 . 3.72 739 656 A 29 LYS HDy A 13 PRO HD2 1.0 . 3.72 740 656 A 13 PRO HD3 A 29 LYS HDy 1.0 . 3.72 741 657 A 14 LYS H A 14 LYS HGx 1.0 . 3.07 742 657 A 14 LYS H A 14 LYS HGy 1.0 . 3.07 743 658 A 14 LYS HA A 14 LYS HGx 1.0 . 3.15 744 658 A 14 LYS HA A 14 LYS HGy 1.0 . 3.15 745 659 A 15 ASN H A 14 LYS HGx 1.0 . 4.18 746 659 A 15 ASN H A 14 LYS HGy 1.0 . 4.18 747 660 A 15 ASN HA A 16 ASP HBx 1.0 . 4.36 748 660 A 15 ASN HA A 16 ASP HBy 1.0 . 4.36 749 661 A 15 ASN HBy A 15 ASN HD2x 1.0 . 3.09 750 661 A 15 ASN HBx A 15 ASN HD2x 1.0 . 3.09 751 661 A 15 ASN HD2y A 15 ASN HBx 1.0 . 3.09 752 661 A 15 ASN HBy A 15 ASN HD2y 1.0 . 3.09 753 662 A 16 ASP H A 16 ASP HBx 1.0 . 2.66 754 662 A 16 ASP H A 16 ASP HBy 1.0 . 2.66 755 663 A 16 ASP HA A 17 LYS HGx 1.0 . 4.57 756 663 A 16 ASP HA A 17 LYS HGy 1.0 . 4.57 757 664 A 17 LYS H A 17 LYS HGx 1.0 . 3.83 758 664 A 17 LYS H A 17 LYS HGy 1.0 . 3.83 759 665 A 17 LYS HA A 17 LYS HGx 1.0 . 3.36 760 665 A 17 LYS HA A 17 LYS HGy 1.0 . 3.36 761 666 A 18 CYS H A 17 LYS HGx 1.0 . 5.05 762 666 A 18 CYS H A 17 LYS HGy 1.0 . 5.05 763 667 A 20 ALA HB% A 21 ASN HD2y 1.0 . 4.23 764 667 A 20 ALA HB% A 21 ASN HD2x 1.0 . 4.23 765 668 A 21 ASN HD2y A 21 ASN HBx 1.0 . 2.99 766 668 A 21 ASN HD2x A 21 ASN HBy 1.0 . 2.99 767 668 A 21 ASN HD2x A 21 ASN HBx 1.0 . 2.99 768 668 A 21 ASN HD2y A 21 ASN HBy 1.0 . 2.99 769 669 A 22 LEU H A 21 ASN HBx 1.0 . 4.43 770 669 A 22 LEU H A 21 ASN HBy 1.0 . 4.43 771 670 A 23 VAL HB A 34 LYS HBx 1.0 . 4.56 772 670 A 23 VAL HB A 34 LYS HBy 1.0 . 4.56 773 671 A 23 VAL HG1% A 32 LYS HEy 1.0 . 3.97 774 671 A 23 VAL HG1% A 32 LYS HEx 1.0 . 3.97 775 672 A 23 VAL HG1% A 34 LYS HBx 1.0 . 4.36 776 672 A 23 VAL HG1% A 34 LYS HBy 1.0 . 4.36 777 673 A 23 VAL HG2% A 34 LYS HBx 1.0 . 5.34 778 673 A 23 VAL HG2% A 34 LYS HBy 1.0 . 5.34 779 674 A 25 SER HB2 A 28 HIS HBy 1.0 . 5.04 780 674 A 25 SER HB2 A 28 HIS HBx 1.0 . 5.04 781 675 A 25 SER HB3 A 28 HIS HBy 1.0 . 3.40 782 675 A 25 SER HB3 A 28 HIS HBx 1.0 . 3.40 783 676 A 26 SER H A 26 SER HBx 1.0 . 3.02 784 676 A 26 SER H A 26 SER HBy 1.0 . 3.02 785 677 A 27 LYS H A 26 SER HBx 1.0 . 3.80 786 677 A 27 LYS H A 26 SER HBy 1.0 . 3.80 787 678 A 27 LYS H A 27 LYS HBx 1.0 . 2.92 788 678 A 27 LYS H A 27 LYS HBy 1.0 . 2.92 789 679 A 27 LYS HA A 27 LYS HDx 1.0 . 3.49 790 679 A 27 LYS HA A 27 LYS HDy 1.0 . 3.49 791 680 A 27 LYS HBy A 27 LYS HGx 1.0 . 2.33 792 680 A 27 LYS HBx A 27 LYS HGx 1.0 . 2.33 793 680 A 27 LYS HGy A 27 LYS HBx 1.0 . 2.33 794 680 A 27 LYS HBy A 27 LYS HGy 1.0 . 2.33 795 681 A 27 LYS HBx A 27 LYS HDx 1.0 . 3.27 796 681 A 27 LYS HBy A 27 LYS HDx 1.0 . 3.27 797 681 A 27 LYS HDy A 27 LYS HBx 1.0 . 3.27 798 681 A 27 LYS HBy A 27 LYS HDy 1.0 . 3.27 799 682 A 27 LYS HBy A 27 LYS HE2 1.0 . 4.55 800 682 A 27 LYS HBx A 27 LYS HE2 1.0 . 4.55 801 682 A 27 LYS HE3 A 27 LYS HBx 1.0 . 4.55 802 682 A 27 LYS HE3 A 27 LYS HBy 1.0 . 4.55 803 683 A 28 HIS H A 28 HIS HBy 1.0 . 3.15 804 683 A 28 HIS H A 28 HIS HBx 1.0 . 3.15 805 684 A 29 LYS H A 28 HIS HBy 1.0 . 3.87 806 684 A 29 LYS H A 28 HIS HBx 1.0 . 3.87 807 685 A 29 LYS HG3 A 28 HIS HBy 1.0 . 5.20 808 685 A 29 LYS HG3 A 28 HIS HBx 1.0 . 5.20 809 686 A 30 TRP H A 28 HIS HBy 1.0 . 4.88 810 686 A 30 TRP H A 28 HIS HBx 1.0 . 4.88 811 687 A 30 TRP HD1 A 28 HIS HBy 1.0 . 3.23 812 687 A 30 TRP HD1 A 28 HIS HBx 1.0 . 3.23 813 688 A 30 TRP HE1 A 28 HIS HBy 1.0 . 3.95 814 688 A 30 TRP HE1 A 28 HIS HBx 1.0 . 3.95 815 689 A 30 TRP HZ2 A 28 HIS HBy 1.0 . 4.16 816 689 A 28 HIS HBx A 30 TRP HZ2 1.0 . 4.16 817 690 A 29 LYS HB2 A 29 LYS HDx 1.0 . 3.31 818 690 A 29 LYS HB2 A 29 LYS HDy 1.0 . 3.31 819 691 A 29 LYS HB3 A 29 LYS HDx 1.0 . 3.54 820 691 A 29 LYS HB3 A 29 LYS HDy 1.0 . 3.54 821 692 A 32 LYS HA A 32 LYS HEy 1.0 . 4.49 822 692 A 32 LYS HA A 32 LYS HEx 1.0 . 4.49 823 693 A 32 LYS HB2 A 32 LYS HEy 1.0 . 3.42 824 693 A 32 LYS HB2 A 32 LYS HEx 1.0 . 3.42 825 694 A 32 LYS HB3 A 32 LYS HEy 1.0 . 3.66 826 694 A 32 LYS HB3 A 32 LYS HEx 1.0 . 3.66 827 695 A 32 LYS HG2 A 32 LYS HEy 1.0 . 3.64 828 695 A 32 LYS HG2 A 32 LYS HEx 1.0 . 3.64 829 696 A 32 LYS HG3 A 32 LYS HEy 1.0 . 3.73 830 696 A 32 LYS HG3 A 32 LYS HEx 1.0 . 3.73 831 697 A 33 GLY H A 32 LYS HEy 1.0 . 4.00 832 697 A 33 GLY H A 32 LYS HEx 1.0 . 4.00 833 698 A 33 GLY HA2 A 34 LYS HBx 1.0 . 4.33 834 698 A 33 GLY HA2 A 34 LYS HBy 1.0 . 4.33 835 699 A 33 GLY HA3 A 34 LYS HBx 1.0 . 5.34 836 699 A 33 GLY HA3 A 34 LYS HBy 1.0 . 5.34 837 700 A 35 LEU H A 34 LYS HBx 1.0 . 4.13 838 700 A 35 LEU H A 34 LYS HBy 1.0 . 4.13 839 701 A 35 LEU H A 35 LEU HB2 1.0 . 2.88 840 701 A 35 LEU H A 35 LEU HB3 1.0 . 2.88 841 702 A 35 LEU HA A 35 LEU HDy% 1.0 . 3.73 842 702 A 35 LEU HA A 35 LEU HDx% 1.0 . 3.73 stop_ save_ save_DYANA/DIANA_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_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 2 ASN C A 3 ASP N A 3 ASP CA A 3 ASP C 1.0 -176.0 -88.0 PHI 2 2 A 3 ASP N A 3 ASP CA A 3 ASP C A 4 CYS N 1.0 104.0 188.0 PSI 3 3 A 3 ASP C A 4 CYS N A 4 CYS CA A 4 CYS C 1.0 -170.0 -98.0 PHI 4 4 A 4 CYS N A 4 CYS CA A 4 CYS C A 5 LEU N 1.0 127.0 179.0 PSI 5 5 A 4 CYS C A 5 LEU N A 5 LEU CA A 5 LEU C 1.0 -180.0 -96.0 PHI 6 6 A 5 LEU N A 5 LEU CA A 5 LEU C A 6 GLY N 1.0 119.0 187.0 PSI 7 7 A 6 GLY C A 7 PHE N A 7 PHE CA A 7 PHE C 1.0 -175.0 13.0 PHI 8 8 A 7 PHE N A 7 PHE CA A 7 PHE C A 8 TRP N 1.0 115.0 159.0 PSI 9 9 A 7 PHE C A 8 TRP N A 8 TRP CA A 8 TRP C 1.0 51.0 91.0 PHI 10 10 A 8 TRP N A 8 TRP CA A 8 TRP C A 9 SER N 1.0 -25.0 39.0 PSI 11 11 A 8 TRP C A 9 SER N A 9 SER CA A 9 SER C 1.0 -138.0 -42.0 PHI 12 12 A 9 SER N A 9 SER CA A 9 SER C A 10 ALA N 1.0 111.0 171.0 PSI 13 13 A 9 SER C A 10 ALA N A 10 ALA CA A 10 ALA C 1.0 -153.0 -41.0 PHI 14 14 A 10 ALA N A 10 ALA CA A 10 ALA C A 11 CYS N 1.0 102.0 154.0 PSI 15 15 A 10 ALA C A 11 CYS N A 11 CYS CA A 11 CYS C 1.0 -208.0 -104.0 PHI 16 16 A 11 CYS N A 11 CYS CA A 11 CYS C A 12 ASN N 1.0 143.0 187.0 PSI 17 17 A 11 CYS C A 12 ASN N A 12 ASN CA A 12 ASN C 1.0 -156.0 -64.0 PHI 18 18 A 12 ASN N A 12 ASN CA A 12 ASN C A 13 PRO N 1.0 71.0 167.0 PSI 19 19 A 13 PRO N A 13 PRO CA A 13 PRO C A 14 LYS N 1.0 -31.0 -11.0 PSI 20 20 A 13 PRO C A 14 LYS N A 14 LYS CA A 14 LYS C 1.0 -110.0 -62.0 PHI 21 21 A 14 LYS N A 14 LYS CA A 14 LYS C A 15 ASN N 1.0 -40.0 24.0 PSI 22 22 A 15 ASN C A 16 ASP N A 16 ASP CA A 16 ASP C 1.0 -150.0 -50.0 PHI 23 23 A 16 ASP N A 16 ASP CA A 16 ASP C A 17 LYS N 1.0 111.0 135.0 PSI 24 24 A 17 LYS C A 18 CYS N A 18 CYS CA A 18 CYS C 1.0 -122.0 -42.0 PHI 25 25 A 18 CYS N A 18 CYS CA A 18 CYS C A 19 CYS N 1.0 68.0 180.0 PSI 26 26 A 18 CYS C A 19 CYS N A 19 CYS CA A 19 CYS C 1.0 -159.0 -47.0 PHI 27 27 A 19 CYS N A 19 CYS CA A 19 CYS C A 20 ALA N 1.0 123.0 215.0 PSI 28 28 A 20 ALA C A 21 ASN N A 21 ASN CA A 21 ASN C 1.0 47.0 75.0 PHI 29 29 A 21 ASN N A 21 ASN CA A 21 ASN C A 22 LEU N 1.0 -7.0 69.0 PSI 30 30 A 21 ASN C A 22 LEU N A 22 LEU CA A 22 LEU C 1.0 -173.0 -69.0 PHI 31 31 A 22 LEU N A 22 LEU CA A 22 LEU C A 23 VAL N 1.0 129.0 185.0 PSI 32 32 A 22 LEU C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -154.0 -102.0 PHI 33 33 A 23 VAL N A 23 VAL CA A 23 VAL C A 24 CYS N 1.0 119.0 159.0 PSI 34 34 A 23 VAL C A 24 CYS N A 24 CYS CA A 24 CYS C 1.0 -142.0 -62.0 PHI 35 35 A 24 CYS N A 24 CYS CA A 24 CYS C A 25 SER N 1.0 67.0 147.0 PSI 36 36 A 24 CYS C A 25 SER N A 25 SER CA A 25 SER C 1.0 -159.0 -31.0 PHI 37 37 A 25 SER N A 25 SER CA A 25 SER C A 26 SER N 1.0 95.0 147.0 PSI 38 38 A 25 SER C A 26 SER N A 26 SER CA A 26 SER C 1.0 -68.0 -52.0 PHI 39 39 A 26 SER N A 26 SER CA A 26 SER C A 27 LYS N 1.0 -50.0 -2.0 PSI 40 40 A 26 SER C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -93.0 -41.0 PHI 41 41 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 HIS N 1.0 -65.0 -1.0 PSI 42 42 A 27 LYS C A 28 HIS N A 28 HIS CA A 28 HIS C 1.0 -117.0 -73.0 PHI 43 43 A 28 HIS N A 28 HIS CA A 28 HIS C A 29 LYS N 1.0 -18.0 38.0 PSI 44 44 A 28 HIS C A 29 LYS N A 29 LYS CA A 29 LYS C 1.0 53.0 65.0 PHI 45 45 A 29 LYS N A 29 LYS CA A 29 LYS C A 30 TRP N 1.0 28.0 60.0 PSI 46 46 A 29 LYS C A 30 TRP N A 30 TRP CA A 30 TRP C 1.0 -160.0 -88.0 PHI 47 47 A 30 TRP N A 30 TRP CA A 30 TRP C A 31 CYS N 1.0 121.0 169.0 PSI 48 48 A 31 CYS C A 32 LYS N A 32 LYS CA A 32 LYS C 1.0 -179.0 -103.0 PHI 49 49 A 32 LYS N A 32 LYS CA A 32 LYS C A 33 GLY N 1.0 120.0 196.0 PSI 50 50 A 33 GLY C A 34 LYS N A 34 LYS CA A 34 LYS C 1.0 -163.0 -43.0 PHI 51 51 A 34 LYS N A 34 LYS CA A 34 LYS C A 35 LEU N 1.0 101.0 161.0 PSI stop_ save_