data_nef_c19808_2ml7 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 2ml7 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 1 CYS SG 1 16 CYS SG 1 8 CYS SG 1 21 CYS SG 1 15 CYS SG 1 26 CYS SG 1 19 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 CYS start -HG . 2 A 2 LYS middle . . 3 A 3 SER middle . . 4 A 4 GLY middle . false 5 A 5 GLY middle . false 6 A 6 ALA middle . . 7 A 7 TRP middle . . 8 A 8 CYS middle -HG . 9 A 9 GLY middle . false 10 A 10 PHE middle . . 11 A 11 ASP middle . . 12 A 12 PRO middle . false 13 A 13 HIS middle . . 14 A 14 GLY middle . false 15 A 15 CYS middle -HG . 16 A 16 CYS middle -HG . 17 A 17 GLY middle . false 18 A 18 ASN middle . . 19 A 19 CYS middle -HG . 20 A 20 GLY middle . false 21 A 21 CYS middle -HG . 22 A 22 LEU middle . . 23 A 23 VAL middle . . 24 A 24 GLY middle . false 25 A 25 PHE middle . . 26 A 26 CYS middle -HG . 27 A 27 TYR middle . . 28 A 28 GLY middle . false 29 A 29 THR middle . . 30 A 30 GLY middle . false 31 A 31 CYS end -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 CYS HA H 1 4.847357 0.01 A 1 CYS HBx H 1 3.130975 0.01 A 1 CYS HBy H 1 3.309318 0.01 A 2 LYS H H 1 9.033191 0.01 A 2 LYS HA H 1 4.598881 0.01 A 2 LYS HBx H 1 1.77512 0.01 A 2 LYS HBy H 1 1.871894 0.01 A 2 LYS HDx H 1 1.646088 0.01 A 2 LYS HDy H 1 1.646088 0.01 A 2 LYS HEx H 1 3.127026 0.01 A 2 LYS HEy H 1 3.127026 0.01 A 2 LYS HGx H 1 1.453898 0.01 A 2 LYS HGy H 1 1.503322 0.01 A 3 SER H H 1 8.440815 0.01 A 3 SER HA H 1 4.423428 0.01 A 3 SER HBy H 1 4.014302 0.01 A 3 SER HBx H 1 3.919888 0.01 A 4 GLY H H 1 8.500258 0.01 A 4 GLY HAx H 1 3.5918 0.01 A 4 GLY HAy H 1 3.775263 0.01 A 5 GLY H H 1 9.344868 0.01 A 5 GLY HAx H 1 3.76303 0.01 A 5 GLY HAy H 1 4.428603 0.01 A 6 ALA H H 1 8.090574 0.01 A 6 ALA HA H 1 4.628778 0.01 A 6 ALA HB% H 1 1.566623 0.01 A 7 TRP H H 1 8.743641 0.01 A 7 TRP HA H 1 4.678346 0.01 A 7 TRP HBx H 1 3.162217 0.01 A 7 TRP HBy H 1 3.195261 0.01 A 7 TRP HD1 H 1 6.878975 0.01 A 7 TRP HE1 H 1 9.143195 0.01 A 7 TRP HE3 H 1 6.893681 0.01 A 7 TRP HH2 H 1 7.018236 0.01 A 7 TRP HZ2 H 1 7.09298 0.01 A 7 TRP HZ3 H 1 7.016458 0.01 A 8 CYS H H 1 8.997788 0.01 A 8 CYS HA H 1 4.434443 0.01 A 8 CYS HBy H 1 3.340029 0.01 A 8 CYS HBx H 1 2.473782 0.01 A 9 GLY H H 1 5.291171 0.01 A 9 GLY HAy H 1 2.928905 0.01 A 9 GLY HAx H 1 2.857732 0.01 A 10 PHE H H 1 7.372389 0.01 A 10 PHE HA H 1 4.740501 0.01 A 10 PHE HBy H 1 3.390383 0.01 A 10 PHE HBx H 1 2.95608 0.01 A 10 PHE HDx H 1 7.311065 0.01 A 10 PHE HDy H 1 7.311065 0.01 A 10 PHE HEx H 1 7.501991 0.01 A 10 PHE HEy H 1 7.501991 0.01 A 10 PHE HZ H 1 7.410478 0.01 A 11 ASP H H 1 7.400838 0.01 A 11 ASP HA H 1 4.946638 0.01 A 11 ASP HBx H 1 2.57305 0.01 A 11 ASP HBy H 1 2.616929 0.01 A 12 PRO HA H 1 4.359326 0.01 A 12 PRO HBx H 1 1.624104 0.01 A 12 PRO HBy H 1 2.147217 0.01 A 12 PRO HDy H 1 3.747211 0.01 A 12 PRO HDx H 1 3.515652 0.01 A 12 PRO HGy H 1 3.689361 0.01 A 12 PRO HGx H 1 3.446245 0.01 A 13 HIS H H 1 8.42501 0.01 A 13 HIS HA H 1 5.030824 0.01 A 13 HIS HBy H 1 3.573704 0.01 A 13 HIS HBx H 1 3.143334 0.01 A 13 HIS HD2 H 1 7.329399 0.01 A 13 HIS HE1 H 1 8.657103 0.01 A 14 GLY H H 1 7.982467 0.01 A 14 GLY HAy H 1 4.224444 0.01 A 14 GLY HAx H 1 3.720045 0.01 A 15 CYS H H 1 8.580532 0.01 A 15 CYS HA H 1 4.91438 0.01 A 15 CYS HBx H 1 2.814459 0.01 A 15 CYS HBy H 1 2.814459 0.01 A 16 CYS H H 1 9.591428 0.01 A 16 CYS HA H 1 4.659463 0.01 A 16 CYS HBx H 1 2.587866 0.01 A 16 CYS HBy H 1 3.392744 0.01 A 17 GLY H H 1 8.707606 0.01 A 17 GLY HAy H 1 3.89092 0.01 A 17 GLY HAx H 1 3.813672 0.01 A 18 ASN H H 1 8.154426 0.01 A 18 ASN HA H 1 4.917527 0.01 A 18 ASN HBx H 1 2.859305 0.01 A 18 ASN HBy H 1 2.989125 0.01 A 18 ASN HD2x H 1 6.803405 0.01 A 18 ASN HD2y H 1 7.447622 0.01 A 19 CYS H H 1 7.826312 0.01 A 19 CYS HA H 1 4.248763 0.01 A 19 CYS HBx H 1 2.945065 0.01 A 19 CYS HBy H 1 3.470635 0.01 A 20 GLY H H 1 8.459851 0.01 A 20 GLY HAx H 1 3.731772 0.01 A 20 GLY HAy H 1 4.520989 0.01 A 21 CYS H H 1 8.66019 0.01 A 21 CYS HA H 1 4.785348 0.01 A 21 CYS HBy H 1 2.932476 0.01 A 21 CYS HBx H 1 2.795576 0.01 A 22 LEU H H 1 8.921923 0.01 A 22 LEU HA H 1 4.620911 0.01 A 22 LEU HBx H 1 1.793216 0.01 A 22 LEU HBy H 1 1.793216 0.01 A 22 LEU HDx% H 1 0.904152 0.01 A 22 LEU HDy% H 1 0.626418 0.01 A 22 LEU HG H 1 1.513121 0.01 A 23 VAL H H 1 9.171644 0.01 A 23 VAL HA H 1 3.651595 0.01 A 23 VAL HB H 1 2.520202 0.01 A 23 VAL HGx% H 1 1.050493 0.01 A 23 VAL HGy% H 1 0.948999 0.01 A 24 GLY H H 1 7.461546 0.01 A 24 GLY HAx H 1 2.674412 0.01 A 24 GLY HAy H 1 3.793359 0.01 A 25 PHE H H 1 7.697975 0.01 A 25 PHE HA H 1 5.445458 0.01 A 25 PHE HBy H 1 2.813672 0.01 A 25 PHE HBx H 1 2.757811 0.01 A 25 PHE HDx H 1 7.348365 0.01 A 25 PHE HDy H 1 7.348365 0.01 A 25 PHE HEx H 1 7.600615 0.01 A 25 PHE HEy H 1 7.600615 0.01 A 25 PHE HZ H 1 7.465956 0.01 A 26 CYS H H 1 8.726572 0.01 A 26 CYS HA H 1 5.102421 0.01 A 26 CYS HBx H 1 2.849077 0.01 A 26 CYS HBy H 1 3.285098 0.01 A 27 TYR H H 1 9.615452 0.01 A 27 TYR HA H 1 4.915954 0.01 A 27 TYR HBx H 1 2.900218 0.01 A 27 TYR HBy H 1 3.123664 0.01 A 27 TYR HDx H 1 7.185257 0.01 A 27 TYR HDy H 1 7.185257 0.01 A 27 TYR HEx H 1 6.871737 0.01 A 27 TYR HEy H 1 6.871737 0.01 A 28 GLY H H 1 8.015974 0.01 A 28 GLY HAy H 1 4.599667 0.01 A 28 GLY HAx H 1 3.463554 0.01 A 29 THR H H 1 8.291014 0.01 A 29 THR HA H 1 4.341603 0.01 A 29 THR HB H 1 4.170657 0.01 A 29 THR HG2% H 1 1.228306 0.01 A 30 GLY H H 1 8.670337 0.01 A 30 GLY HAx H 1 3.981257 0.01 A 30 GLY HAy H 1 4.057145 0.01 A 31 CYS H H 1 7.410321 0.01 A 31 CYS HA H 1 4.690076 0.01 A 31 CYS HBy H 1 3.296756 0.01 A 31 CYS HBx H 1 3.265285 0.01 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 1 CYS HBx A 15 CYS HA 1.0 . 5.5 2 2 A 1 CYS HBx A 16 CYS H 1.0 . 4.2 3 3 A 1 CYS HBx A 16 CYS HA 1.0 . 5.5 4 4 A 1 CYS HBx A 16 CYS HBx 1.0 . 4.2 5 5 A 1 CYS HBx A 16 CYS HBy 1.0 . 5.5 6 6 A 1 CYS HBx A 2 LYS H 1.0 . 4.2 7 7 A 16 CYS HA A 1 CYS HBy 1.0 . 4.2 8 8 A 16 CYS HBx A 1 CYS HBy 1.0 . 5.5 9 9 A 16 CYS HBy A 1 CYS HBy 1.0 . 5.5 10 10 A 2 LYS H A 15 CYS H 1.0 . 5.5 11 11 A 15 CYS HA A 2 LYS H 1.0 . 3.4 12 12 A 2 LYS H A 15 CYS HBx 1.0 . 5.5 13 12 A 2 LYS H A 15 CYS HBy 1.0 . 5.5 14 13 A 16 CYS H A 2 LYS H 1.0 . 4.2 15 14 A 16 CYS HA A 2 LYS H 1.0 . 5.5 16 15 A 1 CYS HBx A 2 LYS H 1.0 . 5.5 17 16 A 2 LYS H A 1 CYS HBy 1.0 . 4.2 18 17 A 2 LYS H A 2 LYS HA 1.0 . 2.8 19 18 A 2 LYS H A 3 SER H 1.0 . 5.5 20 19 A 2 LYS H A 6 ALA HB% 1.0 . 5.5 21 20 A 15 CYS HA A 2 LYS HBx 1.0 . 5.5 22 21 A 16 CYS H A 2 LYS HBx 1.0 . 5.5 23 22 A 3 SER H A 2 LYS HBx 1.0 . 4.2 24 23 A 6 ALA HB% A 2 LYS HBx 1.0 . 3.4 25 24 A 15 CYS HA A 2 LYS HBy 1.0 . 5.5 26 25 A 2 LYS HBy A 15 CYS HBx 1.0 . 5.5 27 25 A 15 CYS HBy A 2 LYS HBy 1.0 . 5.5 28 26 A 16 CYS H A 2 LYS HBy 1.0 . 5.5 29 27 A 3 SER H A 2 LYS HBy 1.0 . 5.5 30 28 A 6 ALA HB% A 2 LYS HBy 1.0 . 4.2 31 29 A 15 CYS HA A 2 LYS HGx 1.0 . 5.5 32 30 A 3 SER H A 2 LYS HGx 1.0 . 5.5 33 31 A 2 LYS HGx A 8 CYS HA 1.0 . 5.5 34 32 A 15 CYS HA A 2 LYS HGy 1.0 . 5.5 35 33 A 3 SER H A 2 LYS HGy 1.0 . 5.5 36 34 A 6 ALA HB% A 2 LYS HGy 1.0 . 4.2 37 35 A 8 CYS HA A 2 LYS HGy 1.0 . 5.5 38 36 A 2 LYS HGy A 8 CYS HBx 1.0 . 5.5 39 37 A 8 CYS HA A 2 LYS HDx 1.0 . 5.5 40 37 A 8 CYS HA A 2 LYS HDy 1.0 . 5.5 41 38 A 8 CYS HBx A 2 LYS HDx 1.0 . 5.5 42 38 A 8 CYS HBx A 2 LYS HDy 1.0 . 5.5 43 39 A 15 CYS HA A 2 LYS HEx 1.0 . 4.2 44 39 A 15 CYS HA A 2 LYS HEy 1.0 . 4.2 45 40 A 16 CYS H A 2 LYS HEx 1.0 . 5.5 46 40 A 16 CYS H A 2 LYS HEy 1.0 . 5.5 47 41 A 2 LYS H A 3 SER H 1.0 . 5.5 48 42 A 2 LYS HA A 3 SER H 1.0 . 2.8 49 43 A 3 SER H A 2 LYS HBx 1.0 . 4.2 50 44 A 3 SER H A 2 LYS HBy 1.0 . 5.5 51 45 A 3 SER H A 2 LYS HGx 1.0 . 5.5 52 46 A 3 SER H A 2 LYS HGy 1.0 . 5.5 53 47 A 3 SER H A 6 ALA HB% 1.0 . 4.2 54 48 A 3 SER HA A 4 GLY H 1.0 . 5.5 55 49 A 4 GLY H A 3 SER HBy 1.0 . 4.2 56 50 A 4 GLY H A 3 SER HBx 1.0 . 5.5 57 51 A 4 GLY H A 26 CYS HBy 1.0 . 5.5 58 52 A 4 GLY H A 31 CYS HBy 1.0 . 4.2 59 53 A 4 GLY H A 31 CYS HBx 1.0 . 5.5 60 54 A 3 SER HA A 4 GLY H 1.0 . 3.4 61 55 A 4 GLY H A 3 SER HBy 1.0 . 4.2 62 56 A 4 GLY H A 3 SER HBx 1.0 . 4.2 63 57 A 4 GLY H A 5 GLY H 1.0 . 5.5 64 58 A 4 GLY H A 6 ALA H 1.0 . 5.5 65 59 A 6 ALA HB% A 4 GLY H 1.0 . 5.5 66 60 A 4 GLY HAy A 26 CYS HBx 1.0 . 5.5 67 61 A 26 CYS HBy A 4 GLY HAy 1.0 . 5.5 68 62 A 3 SER HA A 4 GLY HAy 1.0 . 5.5 69 63 A 3 SER HBy A 4 GLY HAy 1.0 . 5.5 70 64 A 5 GLY H A 4 GLY HAy 1.0 . 3.4 71 65 A 6 ALA H A 4 GLY HAy 1.0 . 5.5 72 66 A 5 GLY H A 25 PHE HBx 1.0 . 5.5 73 67 A 5 GLY H A 26 CYS H 1.0 . 5.5 74 68 A 5 GLY H A 26 CYS HBx 1.0 . 4.2 75 69 A 26 CYS HBy A 5 GLY H 1.0 . 5.5 76 70 A 5 GLY H A 27 TYR HA 1.0 . 5.5 77 71 A 4 GLY H A 5 GLY H 1.0 . 5.5 78 72 A 5 GLY H A 4 GLY HAy 1.0 . 2.8 79 73 A 5 GLY H A 5 GLY HAx 1.0 . 4.2 80 74 A 5 GLY H A 5 GLY HAy 1.0 . 3.4 81 75 A 5 GLY H A 6 ALA H 1.0 . 4.2 82 76 A 6 ALA HB% A 5 GLY H 1.0 . 5.5 83 77 A 26 CYS HBx A 5 GLY HAx 1.0 . 5.5 84 78 A 25 PHE HBx A 5 GLY HAy 1.0 . 5.5 85 79 A 26 CYS HBx A 5 GLY HAy 1.0 . 5.5 86 80 A 6 ALA H A 5 GLY HAy 1.0 . 5.5 87 81 A 6 ALA H A 25 PHE HBx 1.0 . 5.5 88 82 A 6 ALA H A 26 CYS H 1.0 . 5.5 89 83 A 6 ALA H A 26 CYS HBx 1.0 . 4.2 90 84 A 26 CYS HBy A 6 ALA H 1.0 . 5.5 91 85 A 2 LYS HBx A 6 ALA H 1.0 . 5.5 92 86 A 3 SER H A 6 ALA H 1.0 . 5.5 93 87 A 4 GLY H A 6 ALA H 1.0 . 5.5 94 88 A 6 ALA H A 4 GLY HAy 1.0 . 5.5 95 89 A 5 GLY H A 6 ALA H 1.0 . 4.2 96 90 A 6 ALA H A 5 GLY HAx 1.0 . 5.5 97 91 A 6 ALA H A 5 GLY HAy 1.0 . 5.5 98 92 A 6 ALA H A 6 ALA HA 1.0 . 4.2 99 93 A 6 ALA HB% A 2 LYS HBx 1.0 . 3.4 100 94 A 6 ALA HB% A 2 LYS HBy 1.0 . 5.5 101 95 A 6 ALA HB% A 2 LYS HGy 1.0 . 4.2 102 96 A 3 SER H A 6 ALA HB% 1.0 . 4.2 103 97 A 6 ALA HB% A 7 TRP H 1.0 . 3.4 104 98 A 7 TRP H A 25 PHE HD% 1.0 . 5.5 105 99 A 7 TRP H A 25 PHE HE% 1.0 . 5.5 106 100 A 6 ALA H A 7 TRP H 1.0 . 5.5 107 101 A 6 ALA HA A 7 TRP H 1.0 . 2.8 108 102 A 6 ALA HB% A 7 TRP H 1.0 . 3.4 109 103 A 7 TRP H A 7 TRP HA 1.0 . 4.2 110 104 A 7 TRP H A 8 CYS H 1.0 . 5.5 111 105 A 25 PHE HD% A 7 TRP HBx 1.0 . 5.5 112 106 A 25 PHE HE% A 7 TRP HBx 1.0 . 5.5 113 107 A 6 ALA HB% A 7 TRP HBx 1.0 . 5.5 114 108 A 8 CYS H A 7 TRP HBx 1.0 . 5.5 115 109 A 25 PHE HD% A 7 TRP HBy 1.0 . 5.5 116 110 A 25 PHE HE% A 7 TRP HBy 1.0 . 5.5 117 111 A 8 CYS H A 7 TRP HBy 1.0 . 5.5 118 112 A 7 TRP HD1 A 25 PHE HA 1.0 . 5.5 119 113 A 8 CYS H A 7 TRP HD1 1.0 . 5.5 120 114 A 7 TRP HE3 A 10 PHE H 1.0 . 5.5 121 115 A 7 TRP HE3 A 24 GLY HAx 1.0 . 5.5 122 116 A 7 TRP HE3 A 9 GLY H 1.0 . 5.5 123 117 A 7 TRP HE3 A 9 GLY HAy 1.0 . 5.5 124 118 A 7 TRP HE3 A 9 GLY HAx 1.0 . 5.5 125 119 A 9 GLY HAy A 7 TRP HH2 1.0 . 5.5 126 120 A 9 GLY HAx A 7 TRP HH2 1.0 . 5.5 127 121 A 9 GLY HAy A 7 TRP HZ2 1.0 . 5.5 128 122 A 9 GLY HAx A 7 TRP HZ2 1.0 . 5.5 129 123 A 6 ALA HB% A 7 TRP HBy 1.0 . 5.5 130 123 A 6 ALA HB% A 7 TRP HBx 1.0 . 5.5 131 124 A 8 CYS HA A 7 TRP HBy 1.0 . 5.5 132 124 A 8 CYS HA A 7 TRP HBx 1.0 . 5.5 133 125 A 8 CYS H A 21 CYS HBy 1.0 . 5.5 134 126 A 8 CYS H A 24 GLY HAx 1.0 . 5.5 135 127 A 8 CYS H A 24 GLY HAy 1.0 . 5.5 136 128 A 8 CYS H A 25 PHE HA 1.0 . 4.2 137 129 A 25 PHE HD% A 8 CYS H 1.0 . 5.5 138 130 A 7 TRP H A 8 CYS H 1.0 . 5.5 139 131 A 7 TRP HA A 8 CYS H 1.0 . 3.4 140 132 A 8 CYS H A 7 TRP HBx 1.0 . 5.5 141 133 A 8 CYS H A 7 TRP HBy 1.0 . 5.5 142 134 A 8 CYS H A 7 TRP HD1 1.0 . 5.5 143 135 A 8 CYS H A 9 GLY H 1.0 . 3.4 144 136 A 8 CYS H A 9 GLY HAx 1.0 . 5.5 145 137 A 8 CYS HBy A 10 PHE HZ 1.0 . 5.5 146 138 A 8 CYS HBy A 12 PRO HA 1.0 . 4.2 147 139 A 8 CYS HBy A 14 GLY H 1.0 . 5.5 148 140 A 21 CYS HBy A 8 CYS HBy 1.0 . 5.5 149 141 A 8 CYS HBy A 21 CYS HBx 1.0 . 5.5 150 142 A 2 LYS HGy A 8 CYS HBy 1.0 . 5.5 151 143 A 8 CYS HBx A 12 PRO HA 1.0 . 5.5 152 144 A 8 CYS HBx A 21 CYS HBx 1.0 . 5.5 153 145 A 2 LYS HGy A 8 CYS HBx 1.0 . 5.5 154 146 A 8 CYS HBx A 2 LYS HDx 1.0 . 5.5 155 146 A 8 CYS HBx A 2 LYS HDy 1.0 . 5.5 156 147 A 10 PHE H A 9 GLY H 1.0 . 5.5 157 148 A 9 GLY H A 24 GLY HAy 1.0 . 5.5 158 149 A 7 TRP HA A 9 GLY H 1.0 . 5.5 159 150 A 8 CYS H A 9 GLY H 1.0 . 4.2 160 151 A 8 CYS HA A 9 GLY H 1.0 . 5.5 161 152 A 9 GLY H A 9 GLY HAy 1.0 . 5.5 162 153 A 9 GLY H A 9 GLY HAx 1.0 . 5.5 163 154 A 10 PHE H A 9 GLY HAy 1.0 . 5.5 164 155 A 7 TRP HE3 A 9 GLY HAy 1.0 . 5.5 165 156 A 9 GLY HAy A 7 TRP HZ2 1.0 . 5.5 166 157 A 10 PHE H A 9 GLY HAx 1.0 . 5.5 167 158 A 9 GLY HAx A 11 ASP H 1.0 . 5.5 168 159 A 9 GLY HAx A 7 TRP HZ2 1.0 . 5.5 169 160 A 8 CYS H A 9 GLY HAx 1.0 . 5.5 170 161 A 8 CYS HA A 10 PHE H 1.0 . 5.5 171 162 A 10 PHE H A 9 GLY H 1.0 . 5.5 172 163 A 10 PHE H A 9 GLY HAx 1.0 . 5.5 173 164 A 11 ASP H A 10 PHE HBy 1.0 . 5.5 174 165 A 11 ASP H A 10 PHE HBx 1.0 . 5.5 175 166 A 10 PHE HZ A 2 LYS HEx 1.0 . 5.5 176 166 A 2 LYS HEy A 10 PHE HZ 1.0 . 5.5 177 167 A 8 CYS HA A 10 PHE HZ 1.0 . 5.5 178 168 A 8 CYS HBy A 10 PHE HZ 1.0 . 5.5 179 169 A 11 ASP H A 10 PHE HBy 1.0 . 5.5 180 170 A 11 ASP H A 10 PHE HBx 1.0 . 5.5 181 171 A 11 ASP H A 11 ASP HA 1.0 . 4.2 182 172 A 11 ASP H A 12 PRO HDy 1.0 . 5.5 183 173 A 11 ASP H A 12 PRO HDx 1.0 . 4.2 184 174 A 9 GLY H A 11 ASP H 1.0 . 5.5 185 175 A 9 GLY HAx A 11 ASP H 1.0 . 5.5 186 176 A 14 GLY H A 11 ASP HBx 1.0 . 5.5 187 177 A 12 PRO HA A 21 CYS HBx 1.0 . 5.5 188 178 A 12 PRO HBx A 21 CYS H 1.0 . 5.5 189 179 A 21 CYS HBy A 12 PRO HBx 1.0 . 5.5 190 180 A 21 CYS HBx A 12 PRO HBx 1.0 . 5.5 191 181 A 12 PRO HBy A 13 HIS H 1.0 . 5.5 192 182 A 12 PRO HBy A 13 HIS HD2 1.0 . 5.5 193 183 A 21 CYS H A 12 PRO HBy 1.0 . 5.5 194 184 A 21 CYS HBy A 12 PRO HBy 1.0 . 5.5 195 185 A 11 ASP H A 12 PRO HDy 1.0 . 5.5 196 186 A 11 ASP HA A 12 PRO HDy 1.0 . 4.2 197 187 A 12 PRO HDy A 13 HIS H 1.0 . 5.5 198 188 A 11 ASP H A 12 PRO HDx 1.0 . 5.5 199 189 A 11 ASP HA A 12 PRO HDx 1.0 . 4.2 200 190 A 12 PRO HDx A 13 HIS H 1.0 . 5.5 201 191 A 11 ASP HA A 13 HIS H 1.0 . 5.5 202 192 A 12 PRO HA A 13 HIS H 1.0 . 5.5 203 193 A 12 PRO HBy A 13 HIS H 1.0 . 5.5 204 194 A 12 PRO HDy A 13 HIS H 1.0 . 5.5 205 195 A 12 PRO HDx A 13 HIS H 1.0 . 5.5 206 196 A 13 HIS H A 12 PRO HGy 1.0 . 5.5 207 196 A 13 HIS H A 12 PRO HGx 1.0 . 5.5 208 197 A 13 HIS H A 13 HIS HA 1.0 . 4.2 209 198 A 13 HIS H A 13 HIS HD2 1.0 . 5.5 210 199 A 14 GLY H A 13 HIS H 1.0 . 3.4 211 200 A 13 HIS H A 14 GLY HAy 1.0 . 5.5 212 201 A 13 HIS H A 14 GLY HAx 1.0 . 5.5 213 202 A 14 GLY H A 13 HIS HBy 1.0 . 5.5 214 203 A 14 GLY H A 13 HIS HBx 1.0 . 5.5 215 204 A 12 PRO HBy A 13 HIS HD2 1.0 . 5.5 216 205 A 12 PRO HDy A 13 HIS HD2 1.0 . 5.5 217 206 A 13 HIS HD2 A 13 HIS HA 1.0 . 5.5 218 207 A 13 HIS HD2 A 13 HIS HBy 1.0 . 5.5 219 208 A 13 HIS HD2 A 13 HIS HBx 1.0 . 4.2 220 209 A 14 GLY H A 11 ASP HBx 1.0 . 5.5 221 210 A 14 GLY H A 11 ASP HBy 1.0 . 5.5 222 211 A 12 PRO HA A 14 GLY H 1.0 . 5.5 223 212 A 14 GLY H A 13 HIS H 1.0 . 3.4 224 213 A 14 GLY H A 13 HIS HA 1.0 . 5.5 225 214 A 14 GLY H A 13 HIS HBy 1.0 . 5.5 226 215 A 14 GLY H A 13 HIS HBx 1.0 . 5.5 227 216 A 14 GLY H A 14 GLY HAy 1.0 . 4.2 228 217 A 14 GLY H A 14 GLY HAx 1.0 . 3.4 229 218 A 15 CYS H A 14 GLY H 1.0 . 4.2 230 219 A 14 GLY H A 15 CYS HBx 1.0 . 5.5 231 219 A 15 CYS HBy A 14 GLY H 1.0 . 5.5 232 220 A 8 CYS HBy A 14 GLY H 1.0 . 5.5 233 221 A 15 CYS H A 14 GLY HAx 1.0 . 5.5 234 222 A 15 CYS H A 13 HIS HA 1.0 . 5.5 235 223 A 15 CYS H A 14 GLY H 1.0 . 4.2 236 224 A 15 CYS H A 14 GLY HAy 1.0 . 5.5 237 225 A 15 CYS H A 14 GLY HAx 1.0 . 5.5 238 226 A 15 CYS HA A 15 CYS H 1.0 . 4.2 239 227 A 16 CYS H A 15 CYS H 1.0 . 5.5 240 228 A 2 LYS H A 15 CYS H 1.0 . 5.5 241 229 A 14 GLY H A 15 CYS HBx 1.0 . 5.5 242 229 A 15 CYS HBy A 14 GLY H 1.0 . 5.5 243 230 A 16 CYS H A 15 CYS HBx 1.0 . 4.2 244 230 A 16 CYS H A 15 CYS HBy 1.0 . 4.2 245 231 A 19 CYS H A 15 CYS HBx 1.0 . 5.5 246 231 A 15 CYS HBy A 19 CYS H 1.0 . 5.5 247 232 A 19 CYS HA A 15 CYS HBx 1.0 . 5.5 248 232 A 15 CYS HBy A 19 CYS HA 1.0 . 5.5 249 233 A 19 CYS HBx A 15 CYS HBx 1.0 . 3.4 250 233 A 15 CYS HBy A 19 CYS HBx 1.0 . 3.4 251 234 A 20 GLY H A 15 CYS HBx 1.0 . 5.5 252 234 A 15 CYS HBy A 20 GLY H 1.0 . 5.5 253 235 A 20 GLY HAx A 15 CYS HBx 1.0 . 5.5 254 235 A 15 CYS HBy A 20 GLY HAx 1.0 . 5.5 255 236 A 26 CYS HA A 15 CYS HBx 1.0 . 5.5 256 236 A 15 CYS HBy A 26 CYS HA 1.0 . 5.5 257 237 A 26 CYS HBx A 15 CYS HBx 1.0 . 4.2 258 237 A 15 CYS HBy A 26 CYS HBx 1.0 . 4.2 259 238 A 2 LYS H A 15 CYS HBx 1.0 . 5.5 260 238 A 2 LYS H A 15 CYS HBy 1.0 . 5.5 261 239 A 2 LYS HBy A 15 CYS HBx 1.0 . 5.5 262 239 A 15 CYS HBy A 2 LYS HBy 1.0 . 5.5 263 240 A 16 CYS H A 15 CYS H 1.0 . 5.5 264 241 A 15 CYS HA A 16 CYS H 1.0 . 2.8 265 242 A 16 CYS H A 15 CYS HBx 1.0 . 3.4 266 242 A 16 CYS H A 15 CYS HBy 1.0 . 3.4 267 243 A 16 CYS H A 17 GLY H 1.0 . 5.5 268 244 A 16 CYS H A 19 CYS H 1.0 . 5.5 269 245 A 16 CYS H A 19 CYS HBx 1.0 . 5.5 270 246 A 1 CYS HBx A 16 CYS H 1.0 . 4.2 271 247 A 16 CYS H A 1 CYS HBy 1.0 . 4.2 272 248 A 16 CYS H A 2 LYS H 1.0 . 4.2 273 249 A 16 CYS H A 2 LYS HA 1.0 . 5.5 274 250 A 16 CYS H A 2 LYS HBx 1.0 . 5.5 275 251 A 16 CYS H A 2 LYS HBy 1.0 . 5.5 276 252 A 16 CYS H A 2 LYS HGx 1.0 . 5.5 277 253 A 16 CYS H A 2 LYS HGy 1.0 . 5.5 278 254 A 16 CYS H A 31 CYS HA 1.0 . 5.5 279 255 A 16 CYS H A 31 CYS HBx 1.0 . 5.5 280 256 A 16 CYS H A 3 SER H 1.0 . 5.5 281 257 A 16 CYS H A 3 SER HA 1.0 . 5.5 282 258 A 16 CYS HBx A 17 GLY H 1.0 . 4.2 283 259 A 16 CYS HBx A 17 GLY HAy 1.0 . 5.5 284 260 A 16 CYS HBx A 17 GLY HAx 1.0 . 5.5 285 261 A 16 CYS HBx A 31 CYS HA 1.0 . 5.5 286 262 A 16 CYS HBx A 3 SER HA 1.0 . 5.5 287 263 A 16 CYS HBy A 17 GLY H 1.0 . 5.5 288 264 A 16 CYS HBy A 17 GLY H 1.0 . 5.5 289 265 A 1 CYS HBx A 16 CYS HBy 1.0 . 5.5 290 266 A 16 CYS HBy A 1 CYS HBy 1.0 . 5.5 291 267 A 16 CYS HBy A 31 CYS HA 1.0 . 5.5 292 268 A 16 CYS HBy A 31 CYS HBx 1.0 . 4.2 293 269 A 16 CYS HBy A 3 SER HA 1.0 . 5.5 294 270 A 16 CYS HBy A 3 SER HA 1.0 . 5.5 295 271 A 16 CYS H A 17 GLY H 1.0 . 5.5 296 272 A 16 CYS HA A 17 GLY H 1.0 . 3.4 297 273 A 16 CYS HBx A 17 GLY H 1.0 . 4.2 298 274 A 16 CYS HBy A 17 GLY H 1.0 . 5.5 299 275 A 17 GLY H A 17 GLY HAy 1.0 . 3.4 300 276 A 17 GLY H A 17 GLY HAx 1.0 . 2.8 301 277 A 17 GLY H A 18 ASN H 1.0 . 5.5 302 278 A 19 CYS H A 17 GLY H 1.0 . 5.5 303 279 A 17 GLY HAy A 18 ASN H 1.0 . 3.4 304 280 A 19 CYS H A 17 GLY HAy 1.0 . 5.5 305 281 A 17 GLY HAy A 30 GLY HAx 1.0 . 5.5 306 282 A 17 GLY HAx A 18 ASN H 1.0 . 4.2 307 283 A 19 CYS H A 17 GLY HAx 1.0 . 5.5 308 284 A 17 GLY H A 18 ASN H 1.0 . 5.5 309 285 A 17 GLY HAy A 18 ASN H 1.0 . 3.4 310 286 A 17 GLY HAx A 18 ASN H 1.0 . 4.2 311 287 A 18 ASN H A 18 ASN HA 1.0 . 4.2 312 288 A 19 CYS H A 18 ASN H 1.0 . 3.4 313 289 A 19 CYS HBx A 18 ASN H 1.0 . 5.5 314 290 A 18 ASN H A 30 GLY H 1.0 . 5.5 315 291 A 18 ASN H A 30 GLY HAx 1.0 . 5.5 316 292 A 18 ASN H A 30 GLY HAy 1.0 . 5.5 317 293 A 19 CYS H A 18 ASN HBx 1.0 . 5.5 318 294 A 19 CYS H A 18 ASN HBy 1.0 . 5.5 319 295 A 18 ASN HBy A 29 THR HB 1.0 . 5.5 320 296 A 19 CYS H A 15 CYS HBx 1.0 . 4.2 321 296 A 15 CYS HBy A 19 CYS H 1.0 . 4.2 322 297 A 19 CYS H A 17 GLY H 1.0 . 5.5 323 298 A 19 CYS H A 17 GLY HAy 1.0 . 5.5 324 299 A 19 CYS H A 17 GLY HAx 1.0 . 5.5 325 300 A 19 CYS H A 18 ASN H 1.0 . 3.4 326 301 A 19 CYS H A 18 ASN HA 1.0 . 4.2 327 302 A 19 CYS H A 18 ASN HBx 1.0 . 5.5 328 303 A 19 CYS H A 19 CYS HA 1.0 . 4.2 329 304 A 19 CYS H A 20 GLY H 1.0 . 5.5 330 305 A 26 CYS HBy A 19 CYS H 1.0 . 5.5 331 306 A 19 CYS H A 30 GLY H 1.0 . 5.5 332 307 A 19 CYS H A 31 CYS H 1.0 . 5.5 333 308 A 31 CYS HBy A 19 CYS H 1.0 . 5.5 334 309 A 31 CYS HBx A 19 CYS H 1.0 . 5.5 335 310 A 19 CYS HA A 15 CYS HBx 1.0 . 5.5 336 310 A 15 CYS HBy A 19 CYS HA 1.0 . 5.5 337 311 A 19 CYS HA A 20 GLY H 1.0 . 4.2 338 312 A 19 CYS HA A 28 GLY HAy 1.0 . 5.5 339 313 A 19 CYS HBx A 15 CYS HBx 1.0 . 3.4 340 313 A 15 CYS HBy A 19 CYS HBx 1.0 . 3.4 341 314 A 19 CYS HBx A 18 ASN H 1.0 . 5.5 342 315 A 19 CYS HBx A 20 GLY H 1.0 . 5.5 343 316 A 19 CYS HBx A 27 TYR H 1.0 . 5.5 344 317 A 31 CYS HBx A 19 CYS HBx 1.0 . 5.5 345 318 A 20 GLY H A 19 CYS HBy 1.0 . 4.2 346 319 A 20 GLY HAx A 19 CYS HBy 1.0 . 5.5 347 320 A 19 CYS HBy A 20 GLY HAy 1.0 . 5.5 348 321 A 26 CYS HA A 19 CYS HBy 1.0 . 5.5 349 322 A 27 TYR H A 19 CYS HBy 1.0 . 5.5 350 323 A 28 GLY HAy A 19 CYS HBy 1.0 . 5.5 351 324 A 31 CYS HBy A 19 CYS HBy 1.0 . 5.5 352 325 A 31 CYS HBx A 19 CYS HBy 1.0 . 5.5 353 326 A 20 GLY H A 15 CYS HBx 1.0 . 5.5 354 326 A 15 CYS HBy A 20 GLY H 1.0 . 5.5 355 327 A 19 CYS H A 20 GLY H 1.0 . 5.5 356 328 A 19 CYS HA A 20 GLY H 1.0 . 3.4 357 329 A 19 CYS HBx A 20 GLY H 1.0 . 5.5 358 330 A 20 GLY H A 19 CYS HBy 1.0 . 4.2 359 331 A 21 CYS H A 20 GLY H 1.0 . 5.5 360 332 A 20 GLY H A 26 CYS HA 1.0 . 5.5 361 333 A 20 GLY H A 27 TYR H 1.0 . 5.5 362 334 A 27 TYR HA A 20 GLY H 1.0 . 5.5 363 335 A 20 GLY H A 27 TYR HBy 1.0 . 5.5 364 336 A 20 GLY H A 27 TYR HD% 1.0 . 5.5 365 337 A 21 CYS H A 20 GLY HAy 1.0 . 4.2 366 338 A 21 CYS H A 20 GLY HAx 1.0 . 4.2 367 339 A 21 CYS H A 20 GLY HAy 1.0 . 4.2 368 340 A 21 CYS H A 21 CYS HA 1.0 . 5.5 369 341 A 21 CYS HBy A 12 PRO HA 1.0 . 5.5 370 342 A 21 CYS HBy A 12 PRO HBx 1.0 . 5.5 371 343 A 21 CYS HBy A 12 PRO HBy 1.0 . 5.5 372 344 A 21 CYS HBy A 24 GLY HAy 1.0 . 5.5 373 345 A 8 CYS H A 21 CYS HBy 1.0 . 5.5 374 346 A 21 CYS HBy A 8 CYS HBy 1.0 . 5.5 375 347 A 8 CYS HBx A 21 CYS HBy 1.0 . 5.5 376 348 A 12 PRO HA A 21 CYS HBx 1.0 . 4.2 377 349 A 21 CYS HBx A 12 PRO HBx 1.0 . 5.5 378 350 A 21 CYS HBx A 12 PRO HBy 1.0 . 5.5 379 351 A 21 CYS HBx A 22 LEU H 1.0 . 5.5 380 352 A 8 CYS HBy A 21 CYS HBx 1.0 . 5.5 381 353 A 8 CYS HBx A 21 CYS HBx 1.0 . 5.5 382 354 A 21 CYS H A 22 LEU H 1.0 . 5.5 383 355 A 21 CYS HA A 22 LEU H 1.0 . 4.2 384 356 A 22 LEU H A 22 LEU HA 1.0 . 5.5 385 357 A 22 LEU H A 23 VAL H 1.0 . 5.5 386 358 A 22 LEU H A 25 PHE H 1.0 . 5.5 387 359 A 26 CYS HA A 22 LEU H 1.0 . 5.5 388 360 A 27 TYR H A 22 LEU H 1.0 . 5.5 389 361 A 27 TYR HD% A 22 LEU H 1.0 . 5.5 390 362 A 23 VAL H A 22 LEU HG 1.0 . 5.5 391 363 A 22 LEU HG A 23 VAL HGx% 1.0 . 5.5 392 364 A 22 LEU HG A 23 VAL HGy% 1.0 . 5.5 393 365 A 27 TYR HBy A 22 LEU HG 1.0 . 5.5 394 366 A 27 TYR HD% A 22 LEU HG 1.0 . 5.5 395 367 A 23 VAL H A 22 LEU HBx 1.0 . 5.5 396 367 A 23 VAL H A 22 LEU HBy 1.0 . 5.5 397 368 A 27 TYR HBy A 22 LEU HBx 1.0 . 5.5 398 368 A 27 TYR HBy A 22 LEU HBy 1.0 . 5.5 399 369 A 27 TYR HD% A 22 LEU HBx 1.0 . 5.5 400 369 A 27 TYR HD% A 22 LEU HBy 1.0 . 5.5 401 370 A 23 VAL H A 22 LEU HDx% 1.0 . 5.5 402 371 A 22 LEU H A 23 VAL H 1.0 . 5.5 403 372 A 22 LEU HA A 23 VAL H 1.0 . 3.4 404 373 A 23 VAL H A 22 LEU HG 1.0 . 5.5 405 374 A 23 VAL H A 22 LEU HBx 1.0 . 5.5 406 374 A 23 VAL H A 22 LEU HBy 1.0 . 5.5 407 375 A 23 VAL H A 22 LEU HDx% 1.0 . 4.2 408 376 A 23 VAL H A 22 LEU HDy% 1.0 . 5.5 409 377 A 23 VAL H A 23 VAL HA 1.0 . 3.4 410 378 A 23 VAL H A 24 GLY H 1.0 . 4.2 411 379 A 22 LEU HA A 23 VAL HA 1.0 . 5.5 412 380 A 23 VAL HA A 24 GLY H 1.0 . 5.5 413 381 A 22 LEU HG A 23 VAL HGy% 1.0 . 5.5 414 382 A 23 VAL H A 24 GLY H 1.0 . 4.2 415 383 A 23 VAL HA A 24 GLY H 1.0 . 4.2 416 384 A 24 GLY H A 23 VAL HB 1.0 . 5.5 417 385 A 24 GLY HAx A 24 GLY H 1.0 . 5.5 418 386 A 24 GLY HAy A 24 GLY H 1.0 . 4.2 419 387 A 24 GLY HAx A 25 PHE H 1.0 . 5.5 420 388 A 25 PHE HD% A 24 GLY HAx 1.0 . 5.5 421 389 A 7 TRP HE3 A 24 GLY HAx 1.0 . 5.5 422 390 A 21 CYS HBy A 24 GLY HAy 1.0 . 5.5 423 391 A 24 GLY HAy A 25 PHE H 1.0 . 5.5 424 392 A 7 TRP HE3 A 24 GLY HAy 1.0 . 5.5 425 393 A 9 GLY H A 24 GLY HAy 1.0 . 5.5 426 394 A 22 LEU H A 25 PHE H 1.0 . 5.5 427 395 A 23 VAL H A 25 PHE H 1.0 . 5.5 428 396 A 25 PHE H A 23 VAL HGy% 1.0 . 5.5 429 397 A 24 GLY HAx A 25 PHE H 1.0 . 5.5 430 398 A 24 GLY HAy A 25 PHE H 1.0 . 5.5 431 399 A 26 CYS H A 25 PHE H 1.0 . 5.5 432 400 A 26 CYS H A 25 PHE HA 1.0 . 4.2 433 401 A 7 TRP HA A 25 PHE HA 1.0 . 5.5 434 402 A 8 CYS H A 25 PHE HA 1.0 . 5.5 435 403 A 26 CYS H A 25 PHE HBy 1.0 . 5.5 436 404 A 5 GLY HAy A 25 PHE HBy 1.0 . 5.5 437 405 A 25 PHE HBx A 26 CYS H 1.0 . 4.2 438 406 A 5 GLY H A 25 PHE HBx 1.0 . 5.5 439 407 A 25 PHE HBx A 5 GLY HAy 1.0 . 5.5 440 408 A 25 PHE HBx A 7 TRP HA 1.0 . 5.5 441 409 A 23 VAL HGx% A 25 PHE HZ 1.0 . 5.5 442 410 A 23 VAL HGy% A 25 PHE HZ 1.0 . 5.5 443 411 A 7 TRP HD1 A 25 PHE HZ 1.0 . 4.2 444 412 A 25 PHE HD% A 23 VAL HB 1.0 . 5.5 445 413 A 25 PHE HD% A 23 VAL HGx% 1.0 . 5.5 446 414 A 25 PHE HD% A 23 VAL HGy% 1.0 . 4.2 447 415 A 25 PHE HD% A 24 GLY HAx 1.0 . 5.5 448 416 A 25 PHE HD% A 24 GLY HAy 1.0 . 5.5 449 417 A 25 PHE HD% A 25 PHE HA 1.0 . 4.2 450 418 A 5 GLY HAy A 25 PHE HD% 1.0 . 5.5 451 419 A 6 ALA HA A 25 PHE HD% 1.0 . 5.5 452 420 A 6 ALA HB% A 25 PHE HD% 1.0 . 5.5 453 421 A 7 TRP H A 25 PHE HD% 1.0 . 5.5 454 422 A 25 PHE HD% A 7 TRP HA 1.0 . 4.2 455 423 A 25 PHE HD% A 7 TRP HBx 1.0 . 5.5 456 424 A 25 PHE HD% A 7 TRP HBy 1.0 . 5.5 457 425 A 25 PHE HD% A 7 TRP HD1 1.0 . 5.5 458 426 A 25 PHE HD% A 8 CYS H 1.0 . 5.5 459 427 A 25 PHE HE% A 23 VAL HGx% 1.0 . 5.5 460 428 A 25 PHE HE% A 23 VAL HGy% 1.0 . 5.5 461 429 A 7 TRP H A 25 PHE HE% 1.0 . 5.5 462 430 A 25 PHE HE% A 7 TRP HA 1.0 . 5.5 463 431 A 25 PHE HE% A 7 TRP HBx 1.0 . 4.2 464 432 A 25 PHE HE% A 7 TRP HBy 1.0 . 5.5 465 433 A 25 PHE HE% A 7 TRP HD1 1.0 . 4.2 466 434 A 26 CYS H A 25 PHE H 1.0 . 5.5 467 435 A 26 CYS H A 25 PHE HA 1.0 . 2.8 468 436 A 26 CYS H A 25 PHE HBy 1.0 . 5.5 469 437 A 25 PHE HBx A 26 CYS H 1.0 . 4.2 470 438 A 26 CYS H A 25 PHE HD% 1.0 . 5.5 471 439 A 26 CYS H A 26 CYS HA 1.0 . 4.2 472 440 A 26 CYS H A 27 TYR H 1.0 . 5.5 473 441 A 4 GLY H A 26 CYS H 1.0 . 5.5 474 442 A 5 GLY H A 26 CYS H 1.0 . 5.5 475 443 A 26 CYS H A 5 GLY HAy 1.0 . 5.5 476 444 A 6 ALA H A 26 CYS H 1.0 . 4.2 477 445 A 6 ALA HB% A 26 CYS H 1.0 . 5.5 478 446 A 26 CYS H A 8 CYS H 1.0 . 5.5 479 447 A 26 CYS HA A 21 CYS HA 1.0 . 5.5 480 448 A 26 CYS HA A 27 TYR H 1.0 . 5.5 481 449 A 26 CYS HBx A 15 CYS HBx 1.0 . 4.2 482 449 A 15 CYS HBy A 26 CYS HBx 1.0 . 4.2 483 450 A 26 CYS HBx A 19 CYS HBx 1.0 . 5.5 484 451 A 26 CYS HBx A 19 CYS HBy 1.0 . 5.5 485 452 A 5 GLY H A 26 CYS HBx 1.0 . 5.5 486 453 A 26 CYS HBx A 5 GLY HAx 1.0 . 4.2 487 454 A 26 CYS HBx A 5 GLY HAy 1.0 . 5.5 488 455 A 6 ALA H A 26 CYS HBx 1.0 . 5.5 489 456 A 6 ALA HB% A 26 CYS HBx 1.0 . 5.5 490 457 A 26 CYS HBy A 19 CYS HBx 1.0 . 5.5 491 458 A 26 CYS HBy A 27 TYR H 1.0 . 5.5 492 459 A 26 CYS HBy A 4 GLY HAy 1.0 . 5.5 493 460 A 26 CYS HBy A 5 GLY H 1.0 . 5.5 494 461 A 26 CYS HBy A 5 GLY HAx 1.0 . 5.5 495 462 A 26 CYS HBy A 6 ALA H 1.0 . 5.5 496 463 A 6 ALA HB% A 26 CYS HBy 1.0 . 5.5 497 464 A 19 CYS HA A 27 TYR H 1.0 . 5.5 498 465 A 19 CYS HBx A 27 TYR H 1.0 . 5.5 499 466 A 27 TYR H A 19 CYS HBy 1.0 . 4.2 500 467 A 20 GLY H A 27 TYR H 1.0 . 5.5 501 468 A 27 TYR H A 21 CYS HA 1.0 . 5.5 502 469 A 27 TYR H A 22 LEU H 1.0 . 5.5 503 470 A 26 CYS H A 27 TYR H 1.0 . 5.5 504 471 A 26 CYS HA A 27 TYR H 1.0 . 3.4 505 472 A 26 CYS HBx A 27 TYR H 1.0 . 5.5 506 473 A 26 CYS HBy A 27 TYR H 1.0 . 5.5 507 474 A 27 TYR H A 28 GLY H 1.0 . 5.5 508 475 A 22 LEU H A 27 TYR HBx 1.0 . 5.5 509 476 A 27 TYR HBx A 22 LEU HBx 1.0 . 5.5 510 476 A 22 LEU HBy A 27 TYR HBx 1.0 . 5.5 511 477 A 22 LEU HDx% A 27 TYR HBx 1.0 . 5.5 512 478 A 22 LEU HDy% A 27 TYR HBx 1.0 . 5.5 513 479 A 28 GLY H A 27 TYR HBx 1.0 . 5.5 514 480 A 27 TYR HBy A 22 LEU HG 1.0 . 5.5 515 481 A 27 TYR HBy A 22 LEU HBx 1.0 . 5.5 516 481 A 27 TYR HBy A 22 LEU HBy 1.0 . 5.5 517 482 A 27 TYR HBy A 22 LEU HDx% 1.0 . 5.5 518 483 A 27 TYR HBy A 22 LEU HDy% 1.0 . 5.5 519 484 A 26 CYS HA A 27 TYR HBy 1.0 . 5.5 520 485 A 27 TYR HBy A 28 GLY H 1.0 . 5.5 521 486 A 27 TYR HD% A 22 LEU HA 1.0 . 5.5 522 487 A 27 TYR HD% A 22 LEU HG 1.0 . 5.5 523 488 A 27 TYR HD% A 22 LEU HBx 1.0 . 5.5 524 488 A 27 TYR HD% A 22 LEU HBy 1.0 . 5.5 525 489 A 27 TYR HD% A 22 LEU HDx% 1.0 . 4.2 526 490 A 27 TYR HD% A 22 LEU HDy% 1.0 . 4.2 527 491 A 27 TYR HD% A 28 GLY H 1.0 . 5.5 528 492 A 27 TYR HD% A 28 GLY HAx 1.0 . 5.5 529 493 A 22 LEU HA A 27 TYR HE% 1.0 . 5.5 530 494 A 22 LEU HG A 27 TYR HE% 1.0 . 5.5 531 495 A 22 LEU HDx% A 27 TYR HE% 1.0 . 5.5 532 496 A 22 LEU HDy% A 27 TYR HE% 1.0 . 5.5 533 497 A 28 GLY H A 27 TYR HE% 1.0 . 5.5 534 498 A 28 GLY HAx A 27 TYR HE% 1.0 . 5.5 535 499 A 27 TYR H A 28 GLY H 1.0 . 5.5 536 500 A 27 TYR HA A 28 GLY H 1.0 . 3.4 537 501 A 28 GLY H A 27 TYR HBx 1.0 . 5.5 538 502 A 27 TYR HBy A 28 GLY H 1.0 . 5.5 539 503 A 27 TYR HD% A 28 GLY H 1.0 . 5.5 540 504 A 28 GLY H A 27 TYR HE% 1.0 . 5.5 541 505 A 28 GLY HAy A 28 GLY H 1.0 . 5.5 542 506 A 28 GLY H A 29 THR H 1.0 . 5.5 543 507 A 27 TYR HA A 28 GLY HAx 1.0 . 5.5 544 508 A 27 TYR HD% A 28 GLY HAx 1.0 . 5.5 545 509 A 28 GLY HAx A 29 THR H 1.0 . 5.5 546 510 A 28 GLY HAx A 29 THR HA 1.0 . 5.5 547 511 A 28 GLY HAx A 29 THR HG2% 1.0 . 5.5 548 512 A 30 GLY H A 28 GLY HAx 1.0 . 5.5 549 513 A 18 ASN HBx A 29 THR H 1.0 . 5.5 550 514 A 18 ASN HBy A 29 THR H 1.0 . 5.5 551 515 A 19 CYS HA A 29 THR H 1.0 . 5.5 552 516 A 28 GLY H A 29 THR H 1.0 . 5.5 553 517 A 28 GLY HAy A 29 THR H 1.0 . 3.4 554 518 A 28 GLY HAx A 29 THR H 1.0 . 4.2 555 519 A 29 THR H A 29 THR HA 1.0 . 4.2 556 520 A 30 GLY H A 29 THR H 1.0 . 4.2 557 521 A 30 GLY H A 29 THR HA 1.0 . 4.2 558 522 A 30 GLY H A 29 THR HB 1.0 . 5.5 559 523 A 30 GLY H A 29 THR HG2% 1.0 . 4.2 560 524 A 17 GLY HAy A 30 GLY H 1.0 . 5.5 561 525 A 17 GLY HAx A 30 GLY H 1.0 . 5.5 562 526 A 18 ASN H A 30 GLY H 1.0 . 5.5 563 527 A 30 GLY H A 29 THR H 1.0 . 4.2 564 528 A 30 GLY H A 29 THR HA 1.0 . 2.8 565 529 A 30 GLY H A 29 THR HB 1.0 . 5.5 566 530 A 30 GLY H A 29 THR HG2% 1.0 . 4.2 567 531 A 30 GLY HAx A 30 GLY H 1.0 . 4.2 568 532 A 30 GLY H A 30 GLY HAy 1.0 . 3.4 569 533 A 30 GLY H A 31 CYS H 1.0 . 3.4 570 534 A 17 GLY HAy A 30 GLY HAx 1.0 . 5.5 571 535 A 18 ASN H A 30 GLY HAx 1.0 . 5.5 572 536 A 30 GLY HAx A 31 CYS H 1.0 . 5.5 573 537 A 18 ASN H A 30 GLY HAy 1.0 . 5.5 574 538 A 30 GLY HAy A 31 CYS H 1.0 . 5.5 575 539 A 31 CYS H A 18 ASN HD2y 1.0 . 5.5 576 540 A 31 CYS H A 29 THR HA 1.0 . 5.5 577 541 A 30 GLY H A 31 CYS H 1.0 . 3.4 578 542 A 30 GLY HAx A 31 CYS H 1.0 . 5.5 579 543 A 30 GLY HAy A 31 CYS H 1.0 . 5.5 580 544 A 31 CYS HA A 31 CYS H 1.0 . 3.4 581 545 A 3 SER HBx A 31 CYS HBy 1.0 . 5.5 582 546 A 4 GLY H A 31 CYS HBy 1.0 . 4.2 583 547 A 31 CYS HBy A 4 GLY HAy 1.0 . 5.5 584 548 A 16 CYS H A 31 CYS HBx 1.0 . 5.5 585 549 A 16 CYS HBy A 31 CYS HBx 1.0 . 4.2 586 550 A 31 CYS HBx A 19 CYS H 1.0 . 5.5 587 551 A 4 GLY H A 31 CYS HBx 1.0 . 5.5 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 hbond _nef_distance_restraint_list.potential_type . save_ save_DYANA/DIANA_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_4 _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 5 GLY C A 6 ALA N A 6 ALA CA A 6 ALA C 1.0 -150.0 -90.0 PHI 2 2 A 7 TRP C A 8 CYS N A 8 CYS CA A 8 CYS C 1.0 -150.0 -90.0 PHI 3 3 A 12 PRO C A 13 HIS N A 13 HIS CA A 13 HIS C 1.0 -150.0 -90.0 PHI 4 4 A 16 CYS C A 17 GLY N A 17 GLY CA A 17 GLY C 1.0 -150.0 -90.0 PHI 5 5 A 17 GLY C A 18 ASN N A 18 ASN CA A 18 ASN C 1.0 -150.0 -90.0 PHI 6 6 A 18 ASN C A 19 CYS N A 19 CYS CA A 19 CYS C 1.0 -150.0 -90.0 PHI 7 7 A 19 CYS C A 20 GLY N A 20 GLY CA A 20 GLY C 1.0 -150.0 -90.0 PHI 8 8 A 20 GLY C A 21 CYS N A 21 CYS CA A 21 CYS C 1.0 -150.0 -90.0 PHI 9 9 A 24 GLY C A 25 PHE N A 25 PHE CA A 25 PHE C 1.0 -150.0 -90.0 PHI 10 10 A 26 CYS C A 27 TYR N A 27 TYR CA A 27 TYR C 1.0 -150.0 -90.0 PHI 11 11 A 27 TYR C A 28 GLY N A 28 GLY CA A 28 GLY C 1.0 -150.0 -90.0 PHI 12 12 A 28 GLY C A 29 THR N A 29 THR CA A 29 THR C 1.0 -150.0 -90.0 PHI 13 13 A 29 THR C A 30 GLY N A 30 GLY CA A 30 GLY C 1.0 -150.0 -90.0 PHI stop_ save_