data_nef_c25293_2mw0 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 2MW0 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 5 CYS SG 1 22 CYS SG 1 13 CYS SG 1 27 CYS SG 1 17 CYS SG 1 29 CYS SG 1 1 SER N 1 29 CYS C 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 SER cyclic . . 2 A 2 TRP middle . . 3 A 3 PRO middle . true 4 A 4 ILE middle . . 5 A 5 CYS middle -HG . 6 A 6 LYS middle . . 7 A 7 ARG middle . . 8 A 8 ASN middle . . 9 A 9 GLY middle . false 10 A 10 LEU middle . . 11 A 11 PRO middle . false 12 A 12 VAL middle . . 13 A 13 CYS middle -HG . 14 A 14 GLY middle . false 15 A 15 GLU middle . . 16 A 16 THR middle . . 17 A 17 CYS middle -HG . 18 A 18 THR middle . . 19 A 19 LEU middle . . 20 A 20 GLY middle . false 21 A 21 THR middle . . 22 A 22 CYS middle -HG . 23 A 23 SER middle . . 24 A 24 THR middle . . 25 A 25 GLN middle . . 26 A 26 GLY middle . false 27 A 27 CYS middle -HG . 28 A 28 THR middle . . 29 A 29 CYS cyclic -HG . 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 SER H1 H 1 8.905 0.020 A 1 SER HBx H 1 3.603 0.020 A 1 SER HBy H 1 3.816 0.020 A 1 SER CB C 13 62.130 0.400 A 2 TRP H H 1 8.268 0.020 A 2 TRP HA H 1 4.021 0.020 A 2 TRP HBx H 1 3.194 0.020 A 2 TRP HBy H 1 3.208 0.020 A 2 TRP HD1 H 1 7.253 0.020 A 2 TRP HE1 H 1 10.169 0.020 A 2 TRP HE3 H 1 7.366 0.020 A 2 TRP HH2 H 1 7.183 0.020 A 2 TRP HZ2 H 1 7.490 0.020 A 2 TRP HZ3 H 1 7.067 0.020 A 2 TRP CA C 13 59.121 0.400 A 2 TRP CB C 13 29.689 0.400 A 2 TRP CD1 C 13 128.178 0.400 A 2 TRP CE3 C 13 121.200 0.400 A 2 TRP CH2 C 13 124.795 0.400 A 2 TRP CZ2 C 13 114.282 0.400 A 2 TRP CZ3 C 13 122.029 0.400 A 2 TRP N N 15 124.464 0.400 A 2 TRP NE1 N 15 130.175 0.400 A 3 PRO HA H 1 3.451 0.020 A 3 PRO HBx H 1 -0.298 0.020 A 3 PRO HBy H 1 1.701 0.020 A 3 PRO HDy H 1 3.140 0.020 A 3 PRO HDx H 1 3.064 0.020 A 3 PRO HGx H 1 1.202 0.020 A 3 PRO HGy H 1 1.307 0.020 A 3 PRO CA C 13 65.215 0.400 A 3 PRO CB C 13 31.750 0.400 A 3 PRO CD C 13 48.874 0.400 A 3 PRO CG C 13 23.849 0.400 A 4 ILE H H 1 8.276 0.020 A 4 ILE HA H 1 4.186 0.020 A 4 ILE HB H 1 1.722 0.020 A 4 ILE HD1% H 1 0.669 0.020 A 4 ILE HG1x H 1 1.088 0.020 A 4 ILE HG1y H 1 1.268 0.020 A 4 ILE HG2% H 1 0.782 0.020 A 4 ILE CA C 13 60.005 0.400 A 4 ILE CB C 13 37.409 0.400 A 4 ILE CD1 C 13 11.678 0.400 A 4 ILE CG1 C 13 27.407 0.400 A 4 ILE CG2 C 13 17.679 0.400 A 4 ILE N N 15 126.955 0.400 A 5 CYS H H 1 7.650 0.020 A 5 CYS HA H 1 4.825 0.020 A 5 CYS HBy H 1 3.116 0.020 A 5 CYS HBx H 1 2.647 0.020 A 5 CYS CB C 13 43.781 0.400 A 5 CYS N N 15 124.228 0.400 A 6 LYS H H 1 9.212 0.020 A 6 LYS HA H 1 4.938 0.020 A 6 LYS HBx H 1 1.709 0.020 A 6 LYS HBy H 1 1.709 0.020 A 6 LYS HDx H 1 1.290 0.020 A 6 LYS HDy H 1 1.436 0.020 A 6 LYS HEx H 1 2.710 0.020 A 6 LYS HEy H 1 2.710 0.020 A 6 LYS HGx H 1 0.688 0.020 A 6 LYS HGy H 1 0.688 0.020 A 6 LYS CD C 13 29.608 0.400 A 6 LYS CE C 13 42.351 0.400 A 6 LYS CG C 13 26.573 0.400 A 6 LYS N N 15 122.395 0.400 A 7 ARG H H 1 8.700 0.020 A 7 ARG HA H 1 4.711 0.020 A 7 ARG HBy H 1 1.676 0.020 A 7 ARG HBx H 1 1.606 0.020 A 7 ARG HDx H 1 3.113 0.020 A 7 ARG HDy H 1 3.113 0.020 A 7 ARG HE H 1 6.785 0.020 A 7 ARG HGx H 1 1.304 0.020 A 7 ARG HGy H 1 1.524 0.020 A 7 ARG CB C 13 32.721 0.400 A 7 ARG CD C 13 43.412 0.400 A 7 ARG CG C 13 27.127 0.400 A 7 ARG N N 15 122.102 0.400 A 8 ASN H H 1 7.794 0.020 A 8 ASN HA H 1 4.315 0.020 A 8 ASN HBx H 1 2.740 0.020 A 8 ASN HBy H 1 3.009 0.020 A 8 ASN HD2y H 1 7.522 0.020 A 8 ASN HD2x H 1 6.873 0.020 A 8 ASN CA C 13 54.388 0.400 A 8 ASN CB C 13 37.565 0.400 A 8 ASN ND2 N 15 112.804 0.400 A 9 GLY H H 1 8.652 0.020 A 9 GLY HAx H 1 3.486 0.020 A 9 GLY HAy H 1 4.161 0.020 A 9 GLY CA C 13 45.264 0.400 A 9 GLY N N 15 101.289 0.400 A 10 LEU H H 1 7.791 0.020 A 10 LEU HA H 1 5.055 0.020 A 10 LEU HBy H 1 1.867 0.020 A 10 LEU HBx H 1 1.419 0.020 A 10 LEU HDx% H 1 0.909 0.020 A 10 LEU HDy% H 1 0.847 0.020 A 10 LEU HG H 1 1.595 0.020 A 10 LEU CA C 13 51.535 0.400 A 10 LEU CB C 13 44.060 0.400 A 10 LEU CD1 C 13 25.251 0.400 A 10 LEU CD2 C 13 25.122 0.400 A 10 LEU CG C 13 26.587 0.400 A 10 LEU N N 15 120.783 0.400 A 11 PRO HA H 1 5.057 0.020 A 11 PRO HBx H 1 1.561 0.020 A 11 PRO HBy H 1 2.464 0.020 A 11 PRO HDx H 1 3.744 0.020 A 11 PRO HDy H 1 3.744 0.020 A 11 PRO HGy H 1 2.124 0.020 A 11 PRO HGx H 1 2.014 0.020 A 11 PRO CB C 13 28.337 0.400 A 11 PRO CD C 13 50.193 0.400 A 11 PRO CG C 13 27.367 0.400 A 12 VAL H H 1 7.971 0.020 A 12 VAL HA H 1 4.601 0.020 A 12 VAL HB H 1 2.512 0.020 A 12 VAL HGx% H 1 0.789 0.020 A 12 VAL HGy% H 1 0.789 0.020 A 12 VAL CB C 13 31.101 0.400 A 12 VAL CG1 C 13 21.235 0.400 A 12 VAL N N 15 115.299 0.400 A 13 CYS H H 1 8.103 0.020 A 13 CYS HA H 1 4.331 0.020 A 13 CYS HBx H 1 3.050 0.020 A 13 CYS HBy H 1 3.260 0.020 A 13 CYS CA C 13 59.105 0.400 A 13 CYS CB C 13 48.573 0.400 A 14 GLY H H 1 8.433 0.020 A 14 GLY HAy H 1 3.748 0.020 A 14 GLY HAx H 1 3.646 0.020 A 14 GLY CA C 13 46.469 0.400 A 15 GLU H H 1 7.064 0.020 A 15 GLU HA H 1 4.667 0.020 A 15 GLU HBx H 1 1.797 0.020 A 15 GLU HBy H 1 1.797 0.020 A 15 GLU HGy H 1 2.301 0.020 A 15 GLU HGx H 1 2.193 0.020 A 15 GLU CB C 13 32.554 0.400 A 15 GLU CG C 13 35.334 0.400 A 15 GLU N N 15 115.613 0.400 A 16 THR H H 1 8.413 0.020 A 16 THR HA H 1 4.525 0.020 A 16 THR HB H 1 4.366 0.020 A 16 THR HG2% H 1 1.073 0.020 A 16 THR CB C 13 70.742 0.400 A 16 THR CG2 C 13 21.497 0.400 A 16 THR N N 15 115.298 0.400 A 17 CYS H H 1 8.239 0.020 A 17 CYS HA H 1 5.061 0.020 A 17 CYS HBx H 1 2.858 0.020 A 17 CYS HBy H 1 3.188 0.020 A 17 CYS CA C 13 62.598 0.400 A 17 CYS CB C 13 47.454 0.400 A 17 CYS N N 15 115.927 0.400 A 18 THR H H 1 8.277 0.020 A 18 THR HA H 1 3.912 0.020 A 18 THR HB H 1 4.066 0.020 A 18 THR HG2% H 1 1.199 0.020 A 18 THR CA C 13 65.404 0.400 A 18 THR CG2 C 13 22.219 0.400 A 18 THR N N 15 117.192 0.400 A 19 LEU H H 1 8.474 0.020 A 19 LEU HA H 1 4.491 0.020 A 19 LEU HBx H 1 1.702 0.020 A 19 LEU HBy H 1 1.702 0.020 A 19 LEU HDx% H 1 0.836 0.020 A 19 LEU HDy% H 1 0.855 0.020 A 19 LEU HG H 1 1.550 0.020 A 19 LEU CB C 13 40.963 0.400 A 19 LEU CD2 C 13 22.538 0.400 A 19 LEU CG C 13 27.032 0.400 A 20 GLY H H 1 8.123 0.020 A 20 GLY HAx H 1 3.944 0.020 A 20 GLY HAy H 1 4.341 0.020 A 20 GLY CA C 13 45.959 0.400 A 20 GLY N N 15 105.833 0.400 A 21 THR H H 1 7.658 0.020 A 21 THR HA H 1 4.653 0.020 A 21 THR HB H 1 4.063 0.020 A 21 THR HG2% H 1 1.081 0.020 A 21 THR CB C 13 68.777 0.400 A 21 THR CG2 C 13 21.170 0.400 A 21 THR N N 15 111.926 0.400 A 22 CYS H H 1 8.470 0.020 A 22 CYS HA H 1 4.641 0.020 A 22 CYS HBx H 1 2.628 0.020 A 22 CYS HBy H 1 3.088 0.020 A 22 CYS CB C 13 44.757 0.400 A 23 SER H H 1 10.973 0.020 A 23 SER HA H 1 4.423 0.020 A 23 SER HBx H 1 3.802 0.020 A 23 SER HBy H 1 3.802 0.020 A 23 SER CA C 13 59.914 0.400 A 23 SER CB C 13 64.597 0.400 A 23 SER N N 15 122.918 0.400 A 24 THR H H 1 9.476 0.020 A 24 THR HA H 1 3.979 0.020 A 24 THR HB H 1 4.206 0.020 A 24 THR HG2% H 1 1.243 0.020 A 24 THR CA C 13 63.960 0.400 A 24 THR CB C 13 68.471 0.400 A 24 THR CG2 C 13 22.437 0.400 A 24 THR N N 15 124.108 0.400 A 25 GLN H H 1 8.714 0.020 A 25 GLN HA H 1 3.925 0.020 A 25 GLN HBy H 1 2.008 0.020 A 25 GLN HBx H 1 1.956 0.020 A 25 GLN HE2y H 1 7.473 0.020 A 25 GLN HE2x H 1 6.797 0.020 A 25 GLN HGx H 1 2.337 0.020 A 25 GLN HGy H 1 2.337 0.020 A 25 GLN CA C 13 57.951 0.400 A 25 GLN CB C 13 28.195 0.400 A 25 GLN CG C 13 33.415 0.400 A 25 GLN N N 15 128.543 0.400 A 25 GLN NE2 N 15 112.090 0.400 A 26 GLY H H 1 8.810 0.020 A 26 GLY HAy H 1 4.071 0.020 A 26 GLY HAx H 1 3.634 0.020 A 26 GLY CA C 13 45.249 0.400 A 27 CYS H H 1 7.697 0.020 A 27 CYS HA H 1 5.073 0.020 A 27 CYS HBy H 1 3.782 0.020 A 27 CYS HBx H 1 2.471 0.020 A 27 CYS CB C 13 49.941 0.400 A 27 CYS N N 15 117.687 0.400 A 28 THR H H 1 9.354 0.020 A 28 THR HA H 1 4.488 0.020 A 28 THR HB H 1 4.049 0.020 A 28 THR HG2% H 1 1.087 0.020 A 28 THR CA C 13 60.019 0.400 A 28 THR CB C 13 71.515 0.400 A 28 THR CG2 C 13 19.463 0.400 A 28 THR N N 15 115.298 0.400 A 29 CYS H H 1 9.034 0.020 A 29 CYS HA H 1 4.440 0.020 A 29 CYS HBx H 1 2.789 0.020 A 29 CYS HBy H 1 3.034 0.020 A 29 CYS CA C 13 56.329 0.400 A 29 CYS CB C 13 40.248 0.400 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 23 SER H A 24 THR H 1.0 . 3.29 2 2 A 1 SER H1 A 2 TRP H 1.0 . 4.00 3 3 A 6 LYS H A 28 THR H 1.0 . 3.29 4 4 A 1 SER H1 A 6 LYS H 1.0 . 4.20 5 5 A 6 LYS H A 6 LYS HGx 1.0 . 4.45 6 5 A 6 LYS H A 6 LYS HGy 1.0 . 4.45 7 6 A 6 LYS H A 6 LYS HDx 1.0 . 3.90 8 7 A 6 LYS H A 6 LYS HBx 1.0 . 3.44 9 7 A 6 LYS H A 6 LYS HBy 1.0 . 3.44 10 8 A 6 LYS H A 7 ARG H 1.0 . 4.96 11 9 A 7 ARG H A 8 ASN H 1.0 . 3.66 12 10 A 7 ARG H A 10 LEU H 1.0 . 4.22 13 11 A 6 LYS H A 5 CYS H 1.0 . 4.75 14 12 A 28 THR H A 27 CYS H 1.0 . 4.66 15 13 A 27 CYS H A 26 GLY H 1.0 . 4.70 16 14 A 8 ASN H A 9 GLY H 1.0 . 4.35 17 15 A 10 LEU H A 9 GLY H 1.0 . 4.50 18 16 A 20 GLY H A 21 THR H 1.0 . 3.95 19 17 A 12 VAL H A 13 CYS H 1.0 . 3.44 20 18 A 5 CYS H A 4 ILE H 1.0 . 5.24 21 19 A 21 THR H A 18 THR H 1.0 . 5.50 22 20 A 20 GLY H A 2 TRP HD1 1.0 . 4.74 23 21 A 2 TRP H A 2 TRP HD1 1.0 . 5.50 24 22 A 18 THR H A 2 TRP HD1 1.0 . 5.50 25 23 A 23 SER H A 23 SER HBx 1.0 . 3.49 26 23 A 23 SER H A 23 SER HBy 1.0 . 3.49 27 24 A 23 SER H A 22 CYS HA 1.0 . 3.45 28 25 A 23 SER H A 22 CYS HBy 1.0 . 3.93 29 26 A 23 SER H A 22 CYS HBx 1.0 . 4.33 30 27 A 22 CYS HBx A 22 CYS H 1.0 . 4.11 31 28 A 19 LEU H A 21 THR HG2% 1.0 . 5.09 32 29 A 22 CYS H A 21 THR HG2% 1.0 . 5.34 33 30 A 16 THR H A 16 THR HG2% 1.0 . 3.68 34 31 A 19 LEU H A 18 THR HB 1.0 . 4.80 35 32 A 22 CYS H A 21 THR HB 1.0 . 4.97 36 33 A 22 CYS H A 21 THR HA 1.0 . 3.38 37 34 A 24 THR H A 23 SER HBx 1.0 . 3.87 38 34 A 24 THR H A 23 SER HBy 1.0 . 3.87 39 35 A 24 THR H A 24 THR HB 1.0 . 3.25 40 36 A 24 THR H A 24 THR HG2% 1.0 . 4.20 41 37 A 24 THR HG2% A 25 GLN H 1.0 . 3.42 42 38 A 7 ARG H A 12 VAL HGx% 1.0 . 3.66 43 38 A 7 ARG H A 12 VAL HGy% 1.0 . 3.66 44 39 A 25 GLN H A 25 GLN HBx 1.0 . 3.91 45 40 A 25 GLN H A 25 GLN HBy 1.0 . 3.91 46 41 A 25 GLN H A 24 THR HA 1.0 . 3.34 47 42 A 24 THR HB A 25 GLN H 1.0 . 5.14 48 43 A 25 GLN H A 25 GLN HGx 1.0 . 5.24 49 43 A 25 GLN H A 25 GLN HGy 1.0 . 5.24 50 44 A 1 SER H1 A 1 SER HBy 1.0 . 3.59 51 45 A 1 SER H1 A 1 SER HBx 1.0 . 3.51 52 46 A 1 SER H1 A 29 CYS HA 1.0 . 2.80 53 47 A 1 SER H1 A 2 TRP HA 1.0 . 4.78 54 48 A 2 TRP H A 1 SER HBy 1.0 . 4.44 55 49 A 2 TRP H A 1 SER HBx 1.0 . 4.74 56 50 A 3 PRO HA A 17 CYS H 1.0 . 5.09 57 51 A 2 TRP H A 2 TRP HBx 1.0 . 3.19 58 51 A 2 TRP H A 2 TRP HBy 1.0 . 3.19 59 52 A 4 ILE H A 3 PRO HDx 1.0 . 3.86 60 53 A 13 CYS H A 13 CYS HBx 1.0 . 3.74 61 54 A 18 THR H A 18 THR HB 1.0 . 3.99 62 55 A 1 SER H1 A 29 CYS HBy 1.0 . 4.69 63 56 A 1 SER H1 A 29 CYS HBx 1.0 . 4.69 64 57 A 15 GLU H A 15 GLU HGx 1.0 . 4.44 65 58 A 15 GLU H A 15 GLU HGy 1.0 . 4.44 66 59 A 16 THR H A 15 GLU HBx 1.0 . 3.84 67 59 A 16 THR H A 15 GLU HBy 1.0 . 3.84 68 60 A 15 GLU H A 15 GLU HBx 1.0 . 3.72 69 60 A 15 GLU H A 15 GLU HBy 1.0 . 3.72 70 61 A 16 THR H A 15 GLU HA 1.0 . 2.92 71 62 A 16 THR H A 16 THR HB 1.0 . 3.93 72 63 A 17 CYS H A 16 THR HB 1.0 . 3.60 73 64 A 17 CYS H A 16 THR HA 1.0 . 2.96 74 65 A 18 THR H A 17 CYS HA 1.0 . 3.47 75 66 A 17 CYS H A 17 CYS HBx 1.0 . 4.07 76 67 A 21 THR H A 17 CYS HBx 1.0 . 4.04 77 68 A 21 THR H A 17 CYS HBy 1.0 . 4.26 78 69 A 5 CYS H A 5 CYS HBy 1.0 . 3.11 79 70 A 12 VAL H A 11 PRO HA 1.0 . 3.03 80 71 A 12 VAL H A 6 LYS HA 1.0 . 3.99 81 72 A 13 CYS H A 11 PRO HA 1.0 . 4.28 82 73 A 21 THR H A 21 THR HB 1.0 . 3.96 83 74 A 5 CYS H A 4 ILE HA 1.0 . 2.86 84 75 A 27 CYS H A 24 THR HB 1.0 . 5.50 85 76 A 5 CYS H A 16 THR HA 1.0 . 3.75 86 77 A 21 THR H A 21 THR HG2% 1.0 . 3.68 87 78 A 5 CYS H A 5 CYS HBx 1.0 . 3.88 88 79 A 27 CYS H A 22 CYS HBx 1.0 . 4.65 89 80 A 27 CYS H A 27 CYS HBx 1.0 . 3.91 90 81 A 6 LYS H A 5 CYS HBy 1.0 . 4.53 91 82 A 6 LYS H A 5 CYS HBx 1.0 . 3.98 92 83 A 6 LYS H A 5 CYS HA 1.0 . 2.80 93 84 A 7 ARG H A 6 LYS HBx 1.0 . 5.50 94 84 A 6 LYS HBy A 7 ARG H 1.0 . 5.50 95 85 A 7 ARG H A 7 ARG HBx 1.0 . 3.56 96 86 A 7 ARG H A 7 ARG HBy 1.0 . 3.51 97 87 A 7 ARG H A 7 ARG HGx 1.0 . 4.69 98 88 A 7 ARG H A 7 ARG HGy 1.0 . 4.69 99 89 A 7 ARG H A 6 LYS HA 1.0 . 2.89 100 90 A 7 ARG H A 12 VAL H 1.0 . 4.03 101 91 A 12 VAL H A 12 VAL HGx% 1.0 . 2.75 102 91 A 12 VAL H A 12 VAL HGy% 1.0 . 2.75 103 92 A 12 VAL H A 10 LEU HBx 1.0 . 4.77 104 93 A 12 VAL H A 10 LEU HBy 1.0 . 4.56 105 94 A 12 VAL H A 11 PRO HDx 1.0 . 4.51 106 94 A 12 VAL H A 11 PRO HDy 1.0 . 4.51 107 95 A 12 VAL H A 11 PRO HBy 1.0 . 4.65 108 96 A 6 LYS HDx A 12 VAL H 1.0 . 5.47 109 97 A 12 VAL H A 10 LEU HDx% 1.0 . 5.50 110 98 A 10 LEU H A 10 LEU HDy% 1.0 . 4.41 111 99 A 8 ASN H A 10 LEU HDx% 1.0 . 4.90 112 100 A 10 LEU H A 10 LEU HDx% 1.0 . 5.11 113 101 A 10 LEU H A 10 LEU HBx 1.0 . 3.92 114 102 A 10 LEU H A 10 LEU HG 1.0 . 3.59 115 103 A 10 LEU H A 10 LEU HBy 1.0 . 3.26 116 104 A 4 ILE H A 4 ILE HD1% 1.0 . 4.32 117 105 A 4 ILE H A 4 ILE HG2% 1.0 . 3.83 118 106 A 4 ILE H A 4 ILE HG1x 1.0 . 3.44 119 107 A 18 THR H A 18 THR HG2% 1.0 . 4.25 120 108 A 4 ILE H A 4 ILE HG1y 1.0 . 3.83 121 109 A 17 CYS H A 3 PRO HBx 1.0 . 4.44 122 110 A 4 ILE H A 3 PRO HBx 1.0 . 3.57 123 111 A 4 ILE H A 4 ILE HB 1.0 . 3.74 124 112 A 5 CYS H A 4 ILE HB 1.0 . 4.10 125 113 A 21 THR H A 19 LEU HBx 1.0 . 4.49 126 113 A 21 THR H A 19 LEU HBy 1.0 . 4.49 127 114 A 5 CYS H A 4 ILE HG2% 1.0 . 3.54 128 115 A 6 LYS HDx A 5 CYS H 1.0 . 4.65 129 116 A 6 LYS H A 4 ILE HG2% 1.0 . 4.74 130 117 A 6 LYS H A 28 THR HG2% 1.0 . 5.50 131 118 A 18 THR H A 19 LEU HG 1.0 . 4.80 132 119 A 3 PRO HBy A 18 THR HA 1.0 . 4.22 133 120 A 2 TRP HA A 3 PRO HBy 1.0 . 4.36 134 121 A 13 CYS HBy A 12 VAL HGx% 1.0 . 4.57 135 121 A 12 VAL HGy% A 13 CYS HBy 1.0 . 4.57 136 122 A 4 ILE HG1x A 3 PRO HDy 1.0 . 3.90 137 123 A 6 LYS HDx A 9 GLY HAx 1.0 . 5.50 138 124 A 3 PRO HA A 2 TRP HBx 1.0 . 3.48 139 124 A 3 PRO HA A 2 TRP HBy 1.0 . 3.48 140 125 A 11 PRO HDy A 12 VAL HGx% 1.0 . 3.73 141 125 A 11 PRO HDx A 12 VAL HGx% 1.0 . 3.73 142 125 A 12 VAL HGy% A 11 PRO HDx 1.0 . 3.73 143 125 A 12 VAL HGy% A 11 PRO HDy 1.0 . 3.73 144 126 A 10 LEU HBx A 11 PRO HDx 1.0 . 3.16 145 126 A 10 LEU HBx A 11 PRO HDy 1.0 . 3.16 146 127 A 10 LEU HBy A 11 PRO HDx 1.0 . 3.76 147 127 A 10 LEU HBy A 11 PRO HDy 1.0 . 3.76 148 128 A 10 LEU HA A 11 PRO HDx 1.0 . 2.57 149 128 A 11 PRO HDy A 10 LEU HA 1.0 . 2.57 150 129 A 10 LEU HA A 6 LYS HGx 1.0 . 3.75 151 129 A 6 LYS HGy A 10 LEU HA 1.0 . 3.75 152 130 A 11 PRO HA A 6 LYS HGx 1.0 . 3.89 153 130 A 6 LYS HGy A 11 PRO HA 1.0 . 3.89 154 131 A 11 PRO HA A 12 VAL HGx% 1.0 . 3.81 155 131 A 12 VAL HGy% A 11 PRO HA 1.0 . 3.81 156 132 A 10 LEU HDy% A 10 LEU HA 1.0 . 3.20 157 133 A 17 CYS HA A 19 LEU HDx% 1.0 . 3.58 158 134 A 17 CYS HA A 18 THR HG2% 1.0 . 4.46 159 135 A 24 THR HG2% A 27 CYS HA 1.0 . 4.79 160 136 A 7 ARG HBx A 27 CYS HA 1.0 . 4.43 161 137 A 28 THR H A 28 THR HG2% 1.0 . 4.07 162 138 A 28 THR H A 27 CYS HBx 1.0 . 3.66 163 139 A 28 THR H A 28 THR HB 1.0 . 3.92 164 140 A 28 THR H A 27 CYS HA 1.0 . 2.85 165 141 A 27 CYS H A 27 CYS HBy 1.0 . 3.09 166 142 A 26 GLY H A 25 GLN H 1.0 . 4.13 167 143 A 17 CYS H A 4 ILE HA 1.0 . 4.04 168 144 A 10 LEU H A 11 PRO HDx 1.0 . 4.34 169 144 A 10 LEU H A 11 PRO HDy 1.0 . 4.34 170 145 A 24 THR H A 22 CYS HBy 1.0 . 3.98 171 146 A 24 THR H A 22 CYS HBx 1.0 . 4.93 172 147 A 28 THR H A 27 CYS HBy 1.0 . 4.37 173 148 A 28 THR H A 5 CYS HBx 1.0 . 4.98 174 149 A 28 THR H A 22 CYS HBx 1.0 . 5.50 175 150 A 6 LYS H A 27 CYS HBx 1.0 . 4.24 176 151 A 27 CYS HA A 28 THR HB 1.0 . 5.46 177 152 A 12 VAL H A 6 LYS HGx 1.0 . 4.83 178 152 A 6 LYS HGy A 12 VAL H 1.0 . 4.83 179 153 A 13 CYS H A 12 VAL HGx% 1.0 . 4.02 180 153 A 13 CYS H A 12 VAL HGy% 1.0 . 4.02 181 154 A 21 THR H A 19 LEU H 1.0 . 5.25 182 155 A 5 CYS H A 17 CYS H 1.0 . 4.63 183 156 A 20 GLY H A 19 LEU HBx 1.0 . 4.31 184 156 A 20 GLY H A 19 LEU HBy 1.0 . 4.31 185 157 A 20 GLY H A 21 THR HG2% 1.0 . 4.63 186 158 A 20 GLY H A 19 LEU HDx% 1.0 . 4.13 187 159 A 20 GLY H A 19 LEU HG 1.0 . 4.49 188 160 A 20 GLY H A 17 CYS HBy 1.0 . 5.45 189 161 A 20 GLY H A 17 CYS HBx 1.0 . 4.35 190 162 A 2 TRP HE1 A 2 TRP HBx 1.0 . 5.14 191 162 A 2 TRP HBy A 2 TRP HE1 1.0 . 5.14 192 163 A 1 SER H1 A 4 ILE HG2% 1.0 . 4.73 193 164 A 1 SER H1 A 6 LYS HDx 1.0 . 4.32 194 165 A 1 SER H1 A 28 THR HG2% 1.0 . 5.50 195 166 A 1 SER H1 A 6 LYS HBx 1.0 . 4.68 196 166 A 1 SER H1 A 6 LYS HBy 1.0 . 4.68 197 167 A 7 ARG H A 10 LEU HBy 1.0 . 5.22 198 168 A 7 ARG H A 6 LYS HGx 1.0 . 4.55 199 168 A 6 LYS HGy A 7 ARG H 1.0 . 4.55 200 169 A 13 CYS HBx A 15 GLU H 1.0 . 3.97 201 170 A 19 LEU H A 19 LEU HG 1.0 . 5.48 202 171 A 5 CYS H A 14 GLY H 1.0 . 5.50 203 172 A 5 CYS H A 16 THR H 1.0 . 5.50 204 173 A 28 THR H A 7 ARG H 1.0 . 5.22 205 174 A 15 GLU H A 14 GLY H 1.0 . 4.63 206 175 A 18 THR HA A 2 TRP HZ2 1.0 . 4.41 207 176 A 18 THR HB A 2 TRP HZ2 1.0 . 5.19 208 177 A 2 TRP HA A 2 TRP HE3 1.0 . 4.63 209 178 A 2 TRP HD1 A 2 TRP HA 1.0 . 3.90 210 179 A 2 TRP HD1 A 18 THR HA 1.0 . 3.85 211 180 A 2 TRP HD1 A 3 PRO HA 1.0 . 3.90 212 181 A 3 PRO HA A 2 TRP HE3 1.0 . 4.57 213 182 A 3 PRO HA A 2 TRP HZ2 1.0 . 5.25 214 183 A 2 TRP HD1 A 20 GLY HAx 1.0 . 4.89 215 184 A 3 PRO HDx A 2 TRP HZ3 1.0 . 4.52 216 185 A 15 GLU H A 5 CYS HBy 1.0 . 4.77 217 186 A 2 TRP HD1 A 17 CYS HBx 1.0 . 4.55 218 187 A 3 PRO HDy A 2 TRP HE3 1.0 . 3.93 219 188 A 2 TRP HE3 A 2 TRP HBx 1.0 . 3.30 220 188 A 2 TRP HBy A 2 TRP HE3 1.0 . 3.30 221 189 A 15 GLU H A 5 CYS HBx 1.0 . 4.88 222 190 A 5 CYS H A 13 CYS HBx 1.0 . 5.06 223 191 A 2 TRP HD1 A 20 GLY HAy 1.0 . 4.89 224 192 A 15 GLU H A 4 ILE HG2% 1.0 . 4.87 225 193 A 16 THR HG2% A 15 GLU H 1.0 . 5.16 226 194 A 3 PRO HBx A 2 TRP HE1 1.0 . 5.40 227 195 A 3 PRO HBy A 2 TRP HE1 1.0 . 5.06 228 196 A 3 PRO HA A 2 TRP HE1 1.0 . 5.06 229 197 A 18 THR HA A 2 TRP HE1 1.0 . 3.63 230 198 A 3 PRO HBy A 2 TRP HZ2 1.0 . 4.64 231 199 A 3 PRO HBy A 2 TRP HE3 1.0 . 5.05 232 200 A 2 TRP HD1 A 3 PRO HBy 1.0 . 4.97 233 201 A 3 PRO HBy A 2 TRP HH2 1.0 . 5.24 234 202 A 3 PRO HBy A 2 TRP HZ3 1.0 . 5.15 235 203 A 2 TRP HD1 A 3 PRO HBx 1.0 . 5.45 236 204 A 2 TRP HD1 A 18 THR HG2% 1.0 . 5.24 237 205 A 2 TRP HH2 A 3 PRO HGy 1.0 . 5.41 238 206 A 2 TRP HE3 A 3 PRO HGy 1.0 . 5.21 239 207 A 1 SER H1 A 5 CYS HA 1.0 . 3.92 240 208 A 7 ARG H A 27 CYS HA 1.0 . 4.26 241 209 A 6 LYS H A 27 CYS HA 1.0 . 5.03 242 210 A 6 LYS H A 29 CYS HA 1.0 . 4.16 243 211 A 1 SER H1 A 2 TRP HBx 1.0 . 5.34 244 211 A 1 SER H1 A 2 TRP HBy 1.0 . 5.34 245 212 A 5 CYS HBy A 14 GLY H 1.0 . 5.34 246 213 A 16 THR H A 5 CYS HBy 1.0 . 5.50 247 214 A 28 THR H A 6 LYS HBx 1.0 . 4.82 248 214 A 28 THR H A 6 LYS HBy 1.0 . 4.82 249 215 A 27 CYS H A 24 THR HG2% 1.0 . 4.70 250 216 A 28 THR H A 7 ARG HDx 1.0 . 5.50 251 216 A 28 THR H A 7 ARG HDy 1.0 . 5.50 252 217 A 28 THR H A 22 CYS HBy 1.0 . 5.50 253 218 A 24 THR H A 27 CYS HBx 1.0 . 5.50 254 219 A 8 ASN H A 7 ARG HBx 1.0 . 5.39 255 220 A 1 SER H1 A 6 LYS HGx 1.0 . 5.39 256 220 A 1 SER H1 A 6 LYS HGy 1.0 . 5.39 257 221 A 28 THR H A 7 ARG HBy 1.0 . 5.50 258 222 A 23 SER H A 24 THR HG2% 1.0 . 5.08 259 223 A 23 SER H A 15 GLU HBx 1.0 . 5.50 260 223 A 23 SER H A 15 GLU HBy 1.0 . 5.50 261 224 A 23 SER H A 24 THR HB 1.0 . 5.03 262 225 A 23 SER H A 24 THR HA 1.0 . 5.20 263 226 A 20 GLY H A 2 TRP HE1 1.0 . 5.50 264 227 A 1 SER H1 A 29 CYS H 1.0 . 5.50 265 228 A 10 LEU H A 12 VAL H 1.0 . 4.53 266 229 A 13 CYS H A 15 GLU H 1.0 . 5.28 267 230 A 20 GLY H A 18 THR HB 1.0 . 5.50 268 231 A 20 GLY H A 21 THR HB 1.0 . 5.50 269 232 A 6 LYS H A 1 SER HBx 1.0 . 5.36 270 233 A 6 LYS H A 13 CYS HBx 1.0 . 5.33 271 234 A 6 LYS H A 28 THR HB 1.0 . 5.50 272 235 A 18 THR H A 17 CYS HBx 1.0 . 4.40 273 236 A 28 THR H A 12 VAL HGx% 1.0 . 5.50 274 236 A 28 THR H A 12 VAL HGy% 1.0 . 5.50 275 237 A 28 THR H A 24 THR HG2% 1.0 . 5.34 276 238 A 15 GLU H A 13 CYS HA 1.0 . 5.00 277 239 A 15 GLU H A 16 THR HA 1.0 . 5.24 278 240 A 15 GLU H A 5 CYS HA 1.0 . 5.50 279 241 A 5 CYS H A 29 CYS HA 1.0 . 5.45 280 242 A 5 CYS H A 15 GLU H 1.0 . 4.89 281 243 A 21 THR H A 17 CYS HA 1.0 . 4.78 282 244 A 27 CYS HA A 7 ARG HDx 1.0 . 4.84 283 244 A 27 CYS HA A 7 ARG HDy 1.0 . 4.84 284 245 A 13 CYS HBy A 27 CYS HA 1.0 . 5.50 285 246 A 11 PRO HA A 6 LYS HEx 1.0 . 4.70 286 246 A 11 PRO HA A 6 LYS HEy 1.0 . 4.70 287 247 A 5 CYS HBx A 27 CYS HA 1.0 . 5.50 288 248 A 22 CYS HBx A 27 CYS HA 1.0 . 5.50 289 249 A 6 LYS HA A 7 ARG HBy 1.0 . 4.85 290 250 A 6 LYS HDx A 6 LYS HA 1.0 . 3.84 291 251 A 6 LYS HA A 6 LYS HGx 1.0 . 3.58 292 251 A 6 LYS HGy A 6 LYS HA 1.0 . 3.58 293 252 A 28 THR HG2% A 28 THR HA 1.0 . 3.29 294 253 A 24 THR HG2% A 13 CYS HA 1.0 . 4.31 295 254 A 16 THR HB A 18 THR HG2% 1.0 . 4.03 296 255 A 24 THR HG2% A 24 THR HA 1.0 . 3.34 297 256 A 18 THR HG2% A 18 THR HA 1.0 . 3.35 298 257 A 1 SER HBy A 4 ILE HG1x 1.0 . 5.01 299 258 A 18 THR HA A 19 LEU HDx% 1.0 . 5.07 300 259 A 10 LEU HDx% A 11 PRO HDx 1.0 . 4.31 301 259 A 11 PRO HDy A 10 LEU HDx% 1.0 . 4.31 302 260 A 6 LYS HGx A 11 PRO HDx 1.0 . 4.67 303 260 A 6 LYS HGy A 11 PRO HDx 1.0 . 4.67 304 260 A 11 PRO HDy A 6 LYS HGx 1.0 . 4.67 305 260 A 6 LYS HGy A 11 PRO HDy 1.0 . 4.67 306 261 A 6 LYS HDx A 1 SER HBy 1.0 . 3.91 307 262 A 6 LYS HDx A 1 SER HBx 1.0 . 4.09 308 263 A 1 SER HBx A 6 LYS HDy 1.0 . 3.98 309 264 A 1 SER HBy A 6 LYS HDy 1.0 . 3.85 310 265 A 18 THR HB A 19 LEU HG 1.0 . 4.65 311 266 A 2 TRP HA A 3 PRO HBx 1.0 . 4.29 312 267 A 3 PRO HBx A 18 THR HA 1.0 . 5.13 313 268 A 1 SER HBy A 4 ILE HB 1.0 . 4.39 314 269 A 9 GLY HAx A 6 LYS HBx 1.0 . 5.50 315 269 A 6 LYS HBy A 9 GLY HAx 1.0 . 5.50 316 270 A 16 THR HB A 3 PRO HBx 1.0 . 3.81 317 271 A 25 GLN HA A 25 GLN HGx 1.0 . 4.08 318 271 A 25 GLN HGy A 25 GLN HA 1.0 . 4.08 319 272 A 1 SER HBy A 6 LYS HEx 1.0 . 4.36 320 272 A 1 SER HBy A 6 LYS HEy 1.0 . 4.36 321 273 A 6 LYS HEx A 11 PRO HDx 1.0 . 4.47 322 273 A 6 LYS HEy A 11 PRO HDx 1.0 . 4.47 323 273 A 11 PRO HDy A 6 LYS HEx 1.0 . 4.47 324 273 A 11 PRO HDy A 6 LYS HEy 1.0 . 4.47 325 274 A 22 CYS HBy A 27 CYS HBx 1.0 . 4.08 326 275 A 27 CYS HBx A 13 CYS HBy 1.0 . 4.32 327 276 A 13 CYS HBy A 15 GLU HGy 1.0 . 4.53 328 277 A 5 CYS HBy A 15 GLU HGx 1.0 . 4.59 329 278 A 13 CYS HBx A 15 GLU HGy 1.0 . 4.56 330 279 A 24 THR HB A 13 CYS HBy 1.0 . 4.62 331 280 A 22 CYS HBy A 27 CYS HBy 1.0 . 3.57 332 281 A 22 CYS HBy A 23 SER HBx 1.0 . 4.53 333 281 A 23 SER HBy A 22 CYS HBy 1.0 . 4.53 334 282 A 5 CYS HBy A 14 GLY HAy 1.0 . 5.50 335 283 A 16 THR HA A 4 ILE HA 1.0 . 3.55 336 284 A 23 SER HA A 23 SER HBx 1.0 . 2.90 337 284 A 23 SER HBy A 23 SER HA 1.0 . 2.90 338 285 A 2 TRP HA A 3 PRO HA 1.0 . 2.63 339 286 A 15 GLU H A 13 CYS HBy 1.0 . 4.27 340 287 A 27 CYS H A 25 GLN HA 1.0 . 4.15 341 288 A 17 CYS H A 17 CYS HBy 1.0 . 3.54 342 289 A 4 ILE H A 3 PRO HDy 1.0 . 4.13 343 290 A 16 THR H A 15 GLU HGy 1.0 . 5.38 344 291 A 10 LEU H A 6 LYS HBx 1.0 . 4.67 345 291 A 6 LYS HBy A 10 LEU H 1.0 . 4.67 346 292 A 18 THR HG2% A 2 TRP HZ2 1.0 . 4.31 347 293 A 6 LYS HDx A 11 PRO HA 1.0 . 4.46 348 294 A 10 LEU HG A 10 LEU HA 1.0 . 3.76 349 295 A 7 ARG HBy A 27 CYS HA 1.0 . 3.95 350 296 A 19 LEU HG A 19 LEU HA 1.0 . 4.19 351 297 A 4 ILE HA A 3 PRO HGx 1.0 . 4.98 352 298 A 10 LEU HG A 9 GLY HAy 1.0 . 4.42 353 299 A 22 CYS HBy A 24 THR HB 1.0 . 5.42 354 300 A 24 THR HG2% A 27 CYS HBy 1.0 . 4.21 355 301 A 6 LYS HDx A 11 PRO HDx 1.0 . 5.39 356 301 A 6 LYS HDx A 11 PRO HDy 1.0 . 5.39 357 302 A 22 CYS HBx A 27 CYS HBy 1.0 . 3.68 358 303 A 5 CYS HBx A 27 CYS HBy 1.0 . 4.33 359 304 A 24 THR HG2% A 13 CYS HBy 1.0 . 4.05 360 305 A 22 CYS HBy A 24 THR HG2% 1.0 . 4.34 361 306 A 7 ARG HBy A 7 ARG HDx 1.0 . 3.25 362 306 A 7 ARG HBy A 7 ARG HDy 1.0 . 3.25 363 307 A 7 ARG HBx A 7 ARG HDx 1.0 . 3.41 364 307 A 7 ARG HBx A 7 ARG HDy 1.0 . 3.41 365 308 A 5 CYS HBy A 15 GLU HBx 1.0 . 4.44 366 308 A 15 GLU HBy A 5 CYS HBy 1.0 . 4.44 367 309 A 22 CYS HBy A 15 GLU HBx 1.0 . 5.09 368 309 A 22 CYS HBy A 15 GLU HBy 1.0 . 5.09 369 310 A 4 ILE HB A 6 LYS HEx 1.0 . 3.92 370 310 A 4 ILE HB A 6 LYS HEy 1.0 . 3.92 371 311 A 6 LYS HBy A 6 LYS HEx 1.0 . 4.26 372 311 A 6 LYS HBx A 6 LYS HEx 1.0 . 4.26 373 311 A 6 LYS HEy A 6 LYS HBx 1.0 . 4.26 374 311 A 6 LYS HBy A 6 LYS HEy 1.0 . 4.26 375 312 A 4 ILE HG1y A 6 LYS HEx 1.0 . 4.11 376 312 A 4 ILE HG1y A 6 LYS HEy 1.0 . 4.11 377 313 A 5 CYS HBx A 27 CYS HBx 1.0 . 3.21 378 314 A 17 CYS HBx A 19 LEU HG 1.0 . 4.39 379 315 A 15 GLU HBx A 15 GLU HGx 1.0 . 2.98 380 315 A 15 GLU HBy A 15 GLU HGx 1.0 . 2.98 381 316 A 15 GLU HGy A 15 GLU HBx 1.0 . 2.98 382 316 A 15 GLU HBy A 15 GLU HGy 1.0 . 2.98 383 317 A 6 LYS HDx A 6 LYS HBx 1.0 . 2.81 384 317 A 6 LYS HDx A 6 LYS HBy 1.0 . 2.81 385 318 A 19 LEU HDx% A 19 LEU HBx 1.0 . 2.87 386 318 A 19 LEU HBy A 19 LEU HDx% 1.0 . 2.87 387 319 A 19 LEU HDy% A 19 LEU HBx 1.0 . 3.03 388 319 A 19 LEU HBy A 19 LEU HDy% 1.0 . 3.03 389 320 A 11 PRO HBy A 6 LYS HEx 1.0 . 3.95 390 320 A 11 PRO HBy A 6 LYS HEy 1.0 . 3.95 391 321 A 4 ILE HG2% A 6 LYS HEx 1.0 . 3.55 392 321 A 4 ILE HG2% A 6 LYS HEy 1.0 . 3.55 393 322 A 6 LYS HEx A 6 LYS HGx 1.0 . 3.59 394 322 A 6 LYS HEy A 6 LYS HGx 1.0 . 3.59 395 322 A 6 LYS HGy A 6 LYS HEx 1.0 . 3.59 396 322 A 6 LYS HGy A 6 LYS HEy 1.0 . 3.59 397 323 A 5 CYS HBx A 6 LYS HGx 1.0 . 5.25 398 323 A 6 LYS HGy A 5 CYS HBx 1.0 . 5.25 399 324 A 11 PRO HBx A 6 LYS HGx 1.0 . 4.86 400 324 A 6 LYS HGy A 11 PRO HBx 1.0 . 4.86 401 325 A 6 LYS HDx A 6 LYS HGx 1.0 . 2.85 402 325 A 6 LYS HGy A 6 LYS HDx 1.0 . 2.85 403 326 A 16 THR HG2% A 4 ILE HD1% 1.0 . 3.15 404 327 A 10 LEU HBx A 12 VAL HGx% 1.0 . 2.92 405 327 A 12 VAL HGy% A 10 LEU HBx 1.0 . 2.92 406 328 A 4 ILE HG2% A 4 ILE HG1y 1.0 . 3.29 407 329 A 6 LYS HDx A 4 ILE HG2% 1.0 . 3.45 408 330 A 10 LEU HBx A 10 LEU HDy% 1.0 . 3.11 409 331 A 10 LEU HBx A 10 LEU HDx% 1.0 . 3.22 410 332 A 16 THR HG2% A 4 ILE HG2% 1.0 . 3.26 411 333 A 10 LEU HBy A 10 LEU HDx% 1.0 . 3.17 412 334 A 11 PRO HBy A 6 LYS HGx 1.0 . 3.95 413 334 A 6 LYS HGy A 11 PRO HBy 1.0 . 3.95 414 335 A 5 CYS HBy A 4 ILE HG2% 1.0 . 4.42 415 336 A 7 ARG HDy A 12 VAL HGx% 1.0 . 4.64 416 336 A 7 ARG HDx A 12 VAL HGx% 1.0 . 4.64 417 336 A 12 VAL HGy% A 7 ARG HDx 1.0 . 4.64 418 336 A 12 VAL HGy% A 7 ARG HDy 1.0 . 4.64 419 337 A 10 LEU HDy% A 11 PRO HDx 1.0 . 3.37 420 337 A 11 PRO HDy A 10 LEU HDy% 1.0 . 3.37 421 338 A 4 ILE HA A 4 ILE HG2% 1.0 . 3.36 422 339 A 4 ILE HA A 4 ILE HD1% 1.0 . 3.72 423 340 A 1 SER HBy A 4 ILE HG2% 1.0 . 3.76 424 341 A 21 THR HB A 19 LEU HDx% 1.0 . 3.91 425 342 A 10 LEU HDy% A 9 GLY HAy 1.0 . 4.75 426 343 A 13 CYS HA A 12 VAL HGx% 1.0 . 3.78 427 343 A 12 VAL HGy% A 13 CYS HA 1.0 . 3.78 428 344 A 19 LEU HDx% A 19 LEU HA 1.0 . 3.62 429 345 A 12 VAL HA A 12 VAL HGx% 1.0 . 3.02 430 345 A 12 VAL HGy% A 12 VAL HA 1.0 . 3.02 431 346 A 6 LYS HA A 12 VAL HGx% 1.0 . 4.09 432 346 A 12 VAL HGy% A 6 LYS HA 1.0 . 4.09 433 347 A 10 LEU HA A 12 VAL HGx% 1.0 . 4.58 434 347 A 12 VAL HGy% A 10 LEU HA 1.0 . 4.58 435 348 A 11 PRO HA A 4 ILE HG2% 1.0 . 5.19 436 349 A 10 LEU HDx% A 10 LEU HA 1.0 . 4.25 437 350 A 28 THR HG2% A 27 CYS HA 1.0 . 4.98 438 351 A 16 THR HG2% A 16 THR HA 1.0 . 3.44 439 352 A 8 ASN H A 12 VAL HGx% 1.0 . 4.62 440 352 A 8 ASN H A 12 VAL HGy% 1.0 . 4.62 441 353 A 10 LEU H A 12 VAL HGx% 1.0 . 5.14 442 353 A 10 LEU H A 12 VAL HGy% 1.0 . 5.14 443 354 A 16 THR HG2% A 17 CYS H 1.0 . 4.14 444 355 A 5 CYS H A 4 ILE HD1% 1.0 . 4.81 445 356 A 2 TRP HD1 A 2 TRP HBx 1.0 . 3.27 446 356 A 2 TRP HD1 A 2 TRP HBy 1.0 . 3.27 447 357 A 2 TRP H A 29 CYS HA 1.0 . 5.23 448 358 A 20 GLY H A 18 THR HA 1.0 . 4.35 449 359 A 24 THR H A 22 CYS HA 1.0 . 4.87 450 360 A 4 ILE H A 3 PRO HGy 1.0 . 4.27 451 361 A 18 THR HB A 18 THR HA 1.0 . 2.68 452 362 A 4 ILE HA A 4 ILE HG1x 1.0 . 3.48 453 363 A 13 CYS HBx A 5 CYS HBx 1.0 . 3.72 454 364 A 6 LYS H A 7 ARG HA 1.0 . 4.66 455 365 A 28 THR H A 5 CYS HA 1.0 . 4.87 456 366 A 28 THR H A 6 LYS HA 1.0 . 4.96 457 367 A 18 THR HB A 2 TRP HE1 1.0 . 5.35 458 368 A 8 ASN H A 6 LYS HA 1.0 . 5.43 459 369 A 10 LEU H A 6 LYS HA 1.0 . 5.50 460 370 A 3 PRO HDx A 2 TRP HZ2 1.0 . 5.21 461 371 A 3 PRO HDx A 2 TRP HE3 1.0 . 3.74 462 372 A 21 THR H A 19 LEU HDx% 1.0 . 5.22 463 373 A 19 LEU H A 19 LEU HDx% 1.0 . 4.80 464 374 A 17 CYS H A 19 LEU HDx% 1.0 . 5.18 465 375 A 20 GLY H A 2 TRP HBx 1.0 . 4.50 466 375 A 20 GLY H A 2 TRP HBy 1.0 . 4.50 467 376 A 18 THR HG2% A 2 TRP HE1 1.0 . 4.63 468 377 A 16 THR H A 15 GLU HGx 1.0 . 5.38 469 378 A 6 LYS HA A 6 LYS HDy 1.0 . 4.62 470 379 A 6 LYS HA A 7 ARG HBx 1.0 . 4.73 471 380 A 18 THR HB A 19 LEU HBx 1.0 . 5.50 472 380 A 18 THR HB A 19 LEU HBy 1.0 . 5.50 473 381 A 21 THR HB A 19 LEU HBx 1.0 . 5.50 474 381 A 21 THR HB A 19 LEU HBy 1.0 . 5.50 475 382 A 5 CYS HBy A 4 ILE HA 1.0 . 4.34 476 383 A 13 CYS HBy A 15 GLU HBx 1.0 . 4.24 477 383 A 15 GLU HBy A 13 CYS HBy 1.0 . 4.24 478 384 A 5 CYS HBy A 15 GLU HGy 1.0 . 4.59 479 385 A 13 CYS HBy A 15 GLU HGx 1.0 . 4.53 480 386 A 13 CYS HBx A 15 GLU HGx 1.0 . 4.56 481 387 A 13 CYS HBx A 15 GLU HBx 1.0 . 4.54 482 387 A 13 CYS HBx A 15 GLU HBy 1.0 . 4.54 483 388 A 24 THR HG2% A 13 CYS HBx 1.0 . 4.86 484 389 A 13 CYS HBx A 27 CYS HBx 1.0 . 4.71 485 390 A 5 CYS HBx A 15 GLU HBx 1.0 . 5.06 486 390 A 15 GLU HBy A 5 CYS HBx 1.0 . 5.06 487 391 A 4 ILE HD1% A 3 PRO HDy 1.0 . 5.32 488 392 A 3 PRO HDx A 4 ILE HD1% 1.0 . 5.17 489 393 A 13 CYS HBx A 12 VAL HGx% 1.0 . 4.73 490 393 A 12 VAL HGy% A 13 CYS HBx 1.0 . 4.73 491 394 A 10 LEU HDx% A 8 ASN HBy 1.0 . 4.73 492 395 A 10 LEU HDx% A 8 ASN HBx 1.0 . 4.73 493 396 A 16 THR HA A 4 ILE HD1% 1.0 . 4.90 494 397 A 18 THR H A 19 LEU HDx% 1.0 . 5.06 495 398 A 7 ARG H A 10 LEU HDx% 1.0 . 5.50 496 399 A 2 TRP HZ3 A 2 TRP HBx 1.0 . 5.12 497 399 A 2 TRP HBy A 2 TRP HZ3 1.0 . 5.12 498 400 A 1 SER H1 A 29 CYS HBx 1.0 . 4.11 499 400 A 1 SER H1 A 29 CYS HBy 1.0 . 4.11 500 401 A 2 TRP HD1 A 20 GLY HAx 1.0 . 4.30 501 401 A 2 TRP HD1 A 20 GLY HAy 1.0 . 4.30 502 402 A 2 TRP HD1 A 29 CYS HBx 1.0 . 4.85 503 402 A 2 TRP HD1 A 29 CYS HBy 1.0 . 4.85 504 403 A 5 CYS HBy A 15 GLU HGx 1.0 . 3.93 505 403 A 5 CYS HBy A 15 GLU HGy 1.0 . 3.93 506 404 A 7 ARG H A 7 ARG HGy 1.0 . 4.08 507 404 A 7 ARG H A 7 ARG HGx 1.0 . 4.08 508 405 A 7 ARG HA A 8 ASN HD2x 1.0 . 5.34 509 405 A 7 ARG HA A 8 ASN HD2y 1.0 . 5.34 510 406 A 7 ARG HBy A 7 ARG HGy 1.0 . 2.52 511 406 A 7 ARG HBy A 7 ARG HGx 1.0 . 2.52 512 407 A 7 ARG HBy A 26 GLY HAy 1.0 . 5.25 513 407 A 7 ARG HBy A 26 GLY HAx 1.0 . 5.25 514 408 A 8 ASN H A 7 ARG HGy 1.0 . 4.12 515 408 A 8 ASN H A 7 ARG HGx 1.0 . 4.12 516 409 A 8 ASN HA A 7 ARG HGy 1.0 . 3.71 517 409 A 7 ARG HGx A 8 ASN HA 1.0 . 3.71 518 410 A 7 ARG HGy A 8 ASN HD2x 1.0 . 1.57 519 410 A 8 ASN HD2y A 7 ARG HGy 1.0 . 1.57 520 410 A 7 ARG HGx A 8 ASN HD2y 1.0 . 1.57 521 410 A 7 ARG HGx A 8 ASN HD2x 1.0 . 1.57 522 411 A 27 CYS HA A 7 ARG HGy 1.0 . 4.59 523 411 A 27 CYS HA A 7 ARG HGx 1.0 . 4.59 524 412 A 7 ARG HDx A 26 GLY HAy 1.0 . 4.18 525 412 A 7 ARG HDy A 26 GLY HAy 1.0 . 4.18 526 412 A 26 GLY HAx A 7 ARG HDx 1.0 . 4.18 527 412 A 7 ARG HDy A 26 GLY HAx 1.0 . 4.18 528 413 A 8 ASN HA A 8 ASN HBy 1.0 . 2.64 529 413 A 8 ASN HA A 8 ASN HBx 1.0 . 2.64 530 414 A 8 ASN HD2y A 12 VAL HGx% 1.0 . 5.05 531 414 A 12 VAL HGy% A 8 ASN HD2x 1.0 . 5.05 532 414 A 12 VAL HGy% A 8 ASN HD2y 1.0 . 5.05 533 414 A 8 ASN HD2x A 12 VAL HGx% 1.0 . 5.05 534 415 A 10 LEU HA A 11 PRO HGy 1.0 . 4.83 535 415 A 10 LEU HA A 11 PRO HGx 1.0 . 4.83 536 416 A 13 CYS HA A 15 GLU HGx 1.0 . 4.69 537 416 A 13 CYS HA A 15 GLU HGy 1.0 . 4.69 538 417 A 13 CYS HBx A 15 GLU HGx 1.0 . 3.99 539 417 A 13 CYS HBx A 15 GLU HGy 1.0 . 3.99 540 418 A 13 CYS HBy A 15 GLU HGx 1.0 . 3.69 541 418 A 13 CYS HBy A 15 GLU HGy 1.0 . 3.69 542 419 A 14 GLY H A 15 GLU HGx 1.0 . 4.32 543 419 A 14 GLY H A 15 GLU HGy 1.0 . 4.32 544 420 A 15 GLU H A 15 GLU HGx 1.0 . 3.81 545 420 A 15 GLU H A 15 GLU HGy 1.0 . 3.81 546 421 A 16 THR H A 15 GLU HGx 1.0 . 4.62 547 421 A 16 THR H A 15 GLU HGy 1.0 . 4.62 548 422 A 16 THR HA A 15 GLU HGx 1.0 . 5.04 549 422 A 16 THR HA A 15 GLU HGy 1.0 . 5.04 550 423 A 22 CYS HBy A 15 GLU HGx 1.0 . 5.07 551 423 A 22 CYS HBy A 15 GLU HGy 1.0 . 5.07 552 424 A 23 SER H A 15 GLU HGx 1.0 . 5.08 553 424 A 23 SER H A 15 GLU HGy 1.0 . 5.08 554 425 A 19 LEU HDx% A 20 GLY HAx 1.0 . 4.31 555 425 A 19 LEU HDx% A 20 GLY HAy 1.0 . 4.31 556 426 A 21 THR HG2% A 20 GLY HAx 1.0 . 4.02 557 426 A 21 THR HG2% A 20 GLY HAy 1.0 . 4.02 558 427 A 25 GLN H A 25 GLN HBx 1.0 . 3.36 559 427 A 25 GLN H A 25 GLN HBy 1.0 . 3.36 560 428 A 27 CYS HA A 26 GLY HAy 1.0 . 4.88 561 428 A 27 CYS HA A 26 GLY HAx 1.0 . 4.88 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin undefined _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 1 SER N A 29 CYS C 1.0 . 1.30 2 2 A 1 SER H1 A 29 CYS C 1.0 . 1.95 3 3 A 22 CYS SG A 5 CYS SG 1.0 . 2.00 4 4 A 22 CYS SG A 5 CYS CB 1.0 . 3.00 5 5 A 5 CYS SG A 22 CYS CB 1.0 . 3.00 6 6 A 17 CYS SG A 29 CYS SG 1.0 . 2.00 7 7 A 17 CYS SG A 29 CYS CB 1.0 . 3.00 8 8 A 29 CYS SG A 17 CYS CB 1.0 . 3.00 9 9 A 13 CYS SG A 27 CYS SG 1.0 . 2.00 10 10 A 13 CYS SG A 27 CYS CB 1.0 . 3.00 11 11 A 27 CYS SG A 13 CYS CB 1.0 . 3.00 12 12 A 1 SER N A 29 CYS C 1.0 . 1.40 13 13 A 1 SER H1 A 29 CYS C 1.0 . 2.10 14 14 A 22 CYS SG A 5 CYS SG 1.0 . 2.10 15 15 A 22 CYS SG A 5 CYS CB 1.0 . 3.10 16 16 A 5 CYS SG A 22 CYS CB 1.0 . 3.10 17 17 A 17 CYS SG A 29 CYS SG 1.0 . 2.10 18 18 A 17 CYS SG A 29 CYS CB 1.0 . 3.10 19 19 A 29 CYS SG A 17 CYS CB 1.0 . 3.10 20 20 A 13 CYS SG A 27 CYS SG 1.0 . 2.10 21 21 A 13 CYS SG A 27 CYS CB 1.0 . 3.10 22 22 A 27 CYS SG A 13 CYS CB 1.0 . 3.10 stop_ save_