data_nef_c25205_2mub 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 BMRB 6467 PDB 1WXN PDB 2MUB 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 37 CYS SG 1 6 CYS SG 1 30 CYS SG 1 20 CYS SG 1 38 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 THR middle . . 3 A 3 ALA middle . . 4 A 4 CYS middle -HG . 5 A 5 SER middle . . 6 A 6 CYS middle -HG . 7 A 7 GLY middle . false 8 A 8 ASN middle . . 9 A 9 SER middle . . 10 A 10 LYS middle . . 11 A 11 GLY middle . false 12 A 12 ILE middle . . 13 A 13 TYR middle . . 14 A 14 TRP middle . . 15 A 15 PHE middle . . 16 A 16 TYR middle . . 17 A 17 ARG middle . . 18 A 18 PRO middle . false 19 A 19 SER middle . . 20 A 20 CYS middle -HG . 21 A 21 PRO middle . false 22 A 22 THR middle . . 23 A 23 ASP middle . . 24 A 24 ARG middle . . 25 A 25 GLY middle . false 26 A 26 TYR middle . . 27 A 27 THR middle . . 28 A 28 GLY middle . false 29 A 29 SER middle . . 30 A 30 CYS middle -HG . 31 A 31 ARG middle . . 32 A 32 TYR middle . . 33 A 33 PHE middle . . 34 A 34 LEU middle . . 35 A 35 GLY middle . false 36 A 36 THR middle . . 37 A 37 CYS middle -HG . 38 A 38 CYS middle -HG . 39 A 39 THR middle . . 40 A 40 PRO middle . true 41 A 41 ALA middle . . 42 A 42 ASP end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 THR H H 1 8.287 0.020 A 2 THR HA H 1 4.386 0.020 A 2 THR HB H 1 4.202 0.020 A 2 THR HG2% H 1 1.324 0.020 A 3 ALA H H 1 8.466 0.020 A 3 ALA HA H 1 4.548 0.020 A 3 ALA HB% H 1 1.449 0.020 A 4 CYS H H 1 7.772 0.020 A 4 CYS HA H 1 4.541 0.020 A 4 CYS HBx H 1 1.594 0.020 A 4 CYS HBy H 1 2.493 0.020 A 5 SER H H 1 7.268 0.020 A 5 SER HA H 1 4.936 0.020 A 5 SER HBx H 1 3.557 0.020 A 5 SER HBy H 1 3.681 0.020 A 6 CYS H H 1 8.318 0.020 A 6 CYS HA H 1 4.892 0.020 A 6 CYS HBx H 1 2.544 0.020 A 6 CYS HBy H 1 3.145 0.020 A 7 GLY H H 1 9.043 0.020 A 7 GLY HAx H 1 3.642 0.020 A 7 GLY HAy H 1 3.968 0.020 A 8 ASN H H 1 8.919 0.020 A 8 ASN HA H 1 4.742 0.020 A 8 ASN HBy H 1 2.932 0.020 A 8 ASN HBx H 1 2.770 0.020 A 8 ASN HD2y H 1 7.595 0.020 A 8 ASN HD2x H 1 6.928 0.020 A 9 SER H H 1 7.987 0.020 A 9 SER HA H 1 4.597 0.020 A 9 SER HBx H 1 3.767 0.020 A 9 SER HBy H 1 3.892 0.020 A 10 LYS H H 1 8.620 0.020 A 10 LYS HA H 1 4.348 0.020 A 10 LYS HBy H 1 1.978 0.020 A 10 LYS HBx H 1 1.849 0.020 A 10 LYS HDx H 1 1.693 0.020 A 10 LYS HDy H 1 1.693 0.020 A 10 LYS HEx H 1 2.984 0.020 A 10 LYS HEy H 1 2.984 0.020 A 10 LYS HGy H 1 1.599 0.020 A 10 LYS HGx H 1 1.492 0.020 A 11 GLY H H 1 8.420 0.020 A 11 GLY HAy H 1 4.594 0.020 A 11 GLY HAx H 1 3.421 0.020 A 12 ILE H H 1 8.740 0.020 A 12 ILE HA H 1 4.726 0.020 A 12 ILE HB H 1 1.919 0.020 A 12 ILE HD1% H 1 0.807 0.020 A 12 ILE HG1x H 1 1.452 0.020 A 12 ILE HG1y H 1 1.846 0.020 A 12 ILE HG2% H 1 0.727 0.020 A 13 TYR H H 1 8.682 0.020 A 13 TYR HA H 1 4.754 0.020 A 13 TYR HBx H 1 2.237 0.020 A 13 TYR HBy H 1 2.678 0.020 A 13 TYR HDx H 1 6.684 0.020 A 13 TYR HDy H 1 6.684 0.020 A 13 TYR HEx H 1 7.023 0.020 A 13 TYR HEy H 1 7.023 0.020 A 14 TRP H H 1 9.276 0.020 A 14 TRP HA H 1 4.278 0.020 A 14 TRP HBx H 1 2.981 0.020 A 14 TRP HBy H 1 3.051 0.020 A 14 TRP HD1 H 1 7.042 0.020 A 14 TRP HE1 H 1 9.659 0.020 A 14 TRP HE3 H 1 7.736 0.020 A 14 TRP HH2 H 1 7.289 0.020 A 14 TRP HZ2 H 1 7.669 0.020 A 14 TRP HZ3 H 1 7.242 0.020 A 15 PHE H H 1 7.794 0.020 A 15 PHE HA H 1 3.836 0.020 A 15 PHE HBy H 1 2.765 0.020 A 15 PHE HBx H 1 2.452 0.020 A 15 PHE HDx H 1 6.955 0.020 A 15 PHE HDy H 1 6.955 0.020 A 15 PHE HEx H 1 7.126 0.020 A 15 PHE HEy H 1 7.126 0.020 A 16 TYR H H 1 8.599 0.020 A 16 TYR HA H 1 4.244 0.020 A 16 TYR HBy H 1 3.288 0.020 A 16 TYR HBx H 1 2.767 0.020 A 16 TYR HDx H 1 7.037 0.020 A 16 TYR HDy H 1 7.037 0.020 A 16 TYR HEx H 1 6.819 0.020 A 16 TYR HEy H 1 6.819 0.020 A 17 ARG H H 1 7.355 0.020 A 17 ARG HA H 1 5.002 0.020 A 17 ARG HBy H 1 2.068 0.020 A 17 ARG HBx H 1 1.854 0.020 A 17 ARG HDy H 1 3.383 0.020 A 17 ARG HDx H 1 3.253 0.020 A 17 ARG HE H 1 7.228 0.020 A 17 ARG HGx H 1 1.811 0.020 A 17 ARG HGy H 1 1.811 0.020 A 18 PRO HA H 1 4.424 0.020 A 18 PRO HBy H 1 2.117 0.020 A 18 PRO HBx H 1 2.063 0.020 A 18 PRO HDy H 1 3.888 0.020 A 18 PRO HDx H 1 3.789 0.020 A 18 PRO HGx H 1 1.909 0.020 A 18 PRO HGy H 1 2.053 0.020 A 19 SER H H 1 7.154 0.020 A 19 SER HA H 1 4.489 0.020 A 19 SER HBx H 1 3.752 0.020 A 19 SER HBy H 1 3.752 0.020 A 20 CYS H H 1 8.697 0.020 A 20 CYS HA H 1 4.088 0.020 A 20 CYS HBx H 1 2.778 0.020 A 20 CYS HBy H 1 2.827 0.020 A 21 PRO HA H 1 4.349 0.020 A 21 PRO HBy H 1 2.111 0.020 A 21 PRO HBx H 1 1.595 0.020 A 21 PRO HDy H 1 2.763 0.020 A 21 PRO HDx H 1 2.492 0.020 A 21 PRO HGx H 1 0.722 0.020 A 21 PRO HGy H 1 0.812 0.020 A 22 THR H H 1 8.515 0.020 A 22 THR HA H 1 4.215 0.020 A 22 THR HB H 1 4.490 0.020 A 22 THR HG2% H 1 1.177 0.020 A 23 ASP H H 1 8.576 0.020 A 23 ASP HA H 1 4.649 0.020 A 23 ASP HBy H 1 2.945 0.020 A 23 ASP HBx H 1 2.518 0.020 A 24 ARG H H 1 8.134 0.020 A 24 ARG HA H 1 4.379 0.020 A 24 ARG HBy H 1 1.567 0.020 A 24 ARG HBx H 1 0.724 0.020 A 24 ARG HDy H 1 3.215 0.020 A 24 ARG HDx H 1 3.189 0.020 A 24 ARG HE H 1 7.929 0.020 A 24 ARG HGx H 1 1.313 0.020 A 24 ARG HGy H 1 1.441 0.020 A 25 GLY H H 1 8.262 0.020 A 25 GLY HAx H 1 3.604 0.020 A 25 GLY HAy H 1 3.786 0.020 A 26 TYR H H 1 7.786 0.020 A 26 TYR HA H 1 4.835 0.020 A 26 TYR HBx H 1 2.754 0.020 A 26 TYR HBy H 1 3.380 0.020 A 26 TYR HDx H 1 7.105 0.020 A 26 TYR HDy H 1 7.105 0.020 A 26 TYR HEx H 1 6.682 0.020 A 26 TYR HEy H 1 6.682 0.020 A 27 THR H H 1 9.713 0.020 A 27 THR HA H 1 4.573 0.020 A 27 THR HB H 1 4.510 0.020 A 27 THR HG2% H 1 1.218 0.020 A 28 GLY H H 1 8.365 0.020 A 28 GLY HAy H 1 4.474 0.020 A 28 GLY HAx H 1 3.690 0.020 A 29 SER H H 1 8.085 0.020 A 29 SER HA H 1 5.548 0.020 A 29 SER HBx H 1 3.616 0.020 A 29 SER HBy H 1 4.209 0.020 A 29 SER HG H 1 5.549 0.020 A 30 CYS H H 1 8.745 0.020 A 30 CYS HA H 1 4.944 0.020 A 30 CYS HBy H 1 3.427 0.020 A 30 CYS HBx H 1 3.139 0.020 A 31 ARG H H 1 8.694 0.020 A 31 ARG HA H 1 4.448 0.020 A 31 ARG HBy H 1 1.752 0.020 A 31 ARG HBx H 1 1.729 0.020 A 31 ARG HDx H 1 3.209 0.020 A 31 ARG HDy H 1 3.209 0.020 A 31 ARG HE H 1 7.130 0.020 A 31 ARG HGy H 1 1.787 0.020 A 31 ARG HGx H 1 1.650 0.020 A 32 TYR H H 1 8.230 0.020 A 32 TYR HA H 1 4.486 0.020 A 32 TYR HBx H 1 2.657 0.020 A 32 TYR HBy H 1 2.820 0.020 A 32 TYR HDx H 1 6.766 0.020 A 32 TYR HDy H 1 6.766 0.020 A 32 TYR HEx H 1 6.688 0.020 A 32 TYR HEy H 1 6.688 0.020 A 33 PHE H H 1 8.581 0.020 A 33 PHE HA H 1 4.038 0.020 A 33 PHE HBx H 1 2.989 0.020 A 33 PHE HBy H 1 3.032 0.020 A 33 PHE HDx H 1 6.827 0.020 A 33 PHE HDy H 1 6.827 0.020 A 33 PHE HEx H 1 7.215 0.020 A 33 PHE HEy H 1 7.215 0.020 A 34 LEU H H 1 7.972 0.020 A 34 LEU HA H 1 4.523 0.020 A 34 LEU HBx H 1 1.742 0.020 A 34 LEU HBy H 1 1.787 0.020 A 34 LEU HDx% H 1 0.952 0.020 A 34 LEU HDy% H 1 0.840 0.020 A 34 LEU HG H 1 1.382 0.020 A 35 GLY H H 1 8.290 0.020 A 35 GLY HAx H 1 4.347 0.020 A 35 GLY HAy H 1 4.347 0.020 A 36 THR H H 1 8.408 0.020 A 36 THR HA H 1 4.792 0.020 A 36 THR HB H 1 3.532 0.020 A 36 THR HG1 H 1 5.592 0.020 A 36 THR HG2% H 1 1.076 0.020 A 37 CYS H H 1 9.382 0.020 A 37 CYS HA H 1 5.070 0.020 A 37 CYS HBx H 1 2.143 0.020 A 37 CYS HBy H 1 3.342 0.020 A 38 CYS H H 1 8.664 0.020 A 38 CYS HA H 1 4.626 0.020 A 38 CYS HBy H 1 2.051 0.020 A 38 CYS HBx H 1 1.143 0.020 A 39 THR H H 1 8.337 0.020 A 39 THR HA H 1 4.707 0.020 A 39 THR HB H 1 4.001 0.020 A 39 THR HG1 H 1 5.547 0.020 A 39 THR HG2% H 1 0.590 0.020 A 40 PRO HA H 1 4.947 0.020 A 40 PRO HBy H 1 2.523 0.020 A 40 PRO HBx H 1 2.295 0.020 A 40 PRO HDy H 1 4.048 0.020 A 40 PRO HDx H 1 3.926 0.020 A 40 PRO HGy H 1 2.024 0.020 A 40 PRO HGx H 1 1.971 0.020 A 41 ALA H H 1 7.610 0.020 A 41 ALA HA H 1 4.209 0.020 A 41 ALA HB% H 1 1.276 0.020 A 42 ASP H H 1 8.273 0.020 A 42 ASP HA H 1 4.387 0.020 A 42 ASP HBx H 1 2.708 0.020 A 42 ASP HBy H 1 2.708 0.020 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 38 CYS H A 38 CYS HBy 1.0 . 2.92 2 2 A 30 CYS H A 30 CYS HBy 1.0 . 3.61 3 3 A 30 CYS H A 30 CYS HBx 1.0 . 4.20 4 4 A 12 ILE H A 12 ILE HD1% 1.0 . 4.56 5 5 A 12 ILE H A 12 ILE HB 1.0 . 2.91 6 6 A 12 ILE H A 12 ILE HG1y 1.0 . 4.17 7 7 A 12 ILE H A 12 ILE HG1x 1.0 . 4.17 8 8 A 31 ARG H A 31 ARG HBy 1.0 . 3.76 9 9 A 31 ARG H A 31 ARG HGx 1.0 . 3.94 10 10 A 10 LYS H A 10 LYS HBx 1.0 . 3.76 11 11 A 10 LYS H A 10 LYS HBy 1.0 . 2.70 12 12 A 10 LYS H A 10 LYS HDx 1.0 . 4.00 13 12 A 10 LYS H A 10 LYS HDy 1.0 . 4.00 14 13 A 16 TYR H A 16 TYR HBy 1.0 . 3.51 15 14 A 23 ASP H A 23 ASP HBy 1.0 . 3.86 16 15 A 23 ASP H A 23 ASP HBx 1.0 . 3.86 17 16 A 3 ALA H A 3 ALA HB% 1.0 . 2.40 18 17 A 39 THR H A 39 THR HG2% 1.0 . 3.29 19 18 A 42 ASP H A 42 ASP HBx 1.0 . 3.02 20 18 A 42 ASP H A 42 ASP HBy 1.0 . 3.02 21 19 A 32 TYR H A 32 TYR HBy 1.0 . 3.31 22 20 A 32 TYR H A 32 TYR HBx 1.0 . 3.29 23 21 A 24 ARG H A 24 ARG HBx 1.0 . 4.05 24 22 A 24 ARG H A 21 PRO HGx 1.0 . 4.82 25 23 A 24 ARG H A 24 ARG HGy 1.0 . 3.89 26 24 A 29 SER H A 29 SER HBx 1.0 . 4.09 27 25 A 29 SER H A 29 SER HBy 1.0 . 3.64 28 26 A 6 CYS H A 6 CYS HBy 1.0 . 3.64 29 27 A 6 CYS H A 6 CYS HBx 1.0 . 3.00 30 28 A 34 LEU H A 34 LEU HBy 1.0 . 3.70 31 29 A 34 LEU H A 34 LEU HG 1.0 . 3.52 32 30 A 24 ARG HBx A 24 ARG HE 1.0 . 3.57 33 31 A 26 TYR H A 26 TYR HBy 1.0 . 3.72 34 32 A 26 TYR H A 26 TYR HBx 1.0 . 2.79 35 33 A 15 PHE H A 15 PHE HBy 1.0 . 2.50 36 34 A 3 ALA HA A 4 CYS H 1.0 . 2.56 37 35 A 41 ALA H A 41 ALA HB% 1.0 . 2.43 38 36 A 17 ARG H A 17 ARG HDy 1.0 . 5.50 39 37 A 17 ARG H A 17 ARG HDx 1.0 . 5.50 40 38 A 17 ARG H A 17 ARG HBy 1.0 . 2.85 41 39 A 5 SER H A 5 SER HBy 1.0 . 3.84 42 40 A 5 SER H A 5 SER HBx 1.0 . 3.84 43 41 A 19 SER H A 19 SER HBx 1.0 . 3.20 44 41 A 19 SER H A 19 SER HBy 1.0 . 3.20 45 42 A 21 PRO HDy A 26 TYR HD% 1.0 . 2.58 46 43 A 26 TYR HD% A 26 TYR HA 1.0 . 3.02 47 44 A 2 THR H A 2 THR HG2% 1.0 . 5.24 48 45 A 12 ILE H A 12 ILE HG2% 1.0 . 3.89 49 46 A 37 CYS H A 37 CYS HBx 1.0 . 3.29 50 47 A 37 CYS H A 37 CYS HBy 1.0 . 3.00 51 48 A 20 CYS H A 20 CYS HBx 1.0 . 2.86 52 49 A 22 THR H A 22 THR HG2% 1.0 . 5.50 53 50 A 38 CYS H A 38 CYS HBx 1.0 . 3.82 54 51 A 34 LEU H A 34 LEU HBx 1.0 . 3.10 55 52 A 23 ASP H A 24 ARG HGx 1.0 . 4.80 56 53 A 23 ASP H A 21 PRO HBx 1.0 . 4.16 57 54 A 23 ASP H A 24 ARG H 1.0 . 3.06 58 55 A 38 CYS H A 37 CYS HA 1.0 . 2.67 59 56 A 38 CYS H A 37 CYS HBy 1.0 . 5.50 60 57 A 38 CYS H A 37 CYS HBx 1.0 . 4.84 61 58 A 39 THR H A 38 CYS HA 1.0 . 2.64 62 59 A 39 THR H A 38 CYS HBx 1.0 . 3.76 63 60 A 38 CYS HBy A 39 THR H 1.0 . 5.32 64 61 A 4 CYS H A 4 CYS HBy 1.0 . 3.83 65 62 A 26 TYR HA A 28 GLY H 1.0 . 4.54 66 63 A 26 TYR HBy A 28 GLY H 1.0 . 4.07 67 64 A 26 TYR HBx A 28 GLY H 1.0 . 5.25 68 65 A 26 TYR H A 25 GLY H 1.0 . 3.36 69 66 A 28 GLY H A 27 THR HG2% 1.0 . 4.08 70 67 A 37 CYS H A 36 THR HG2% 1.0 . 2.73 71 68 A 37 CYS H A 36 THR HB 1.0 . 4.05 72 69 A 36 THR HB A 36 THR H 1.0 . 3.09 73 70 A 36 THR HG2% A 36 THR H 1.0 . 4.18 74 71 A 12 ILE H A 41 ALA HA 1.0 . 3.43 75 72 A 30 CYS H A 29 SER HBx 1.0 . 3.31 76 73 A 30 CYS HBy A 31 ARG H 1.0 . 4.19 77 74 A 30 CYS HBx A 31 ARG H 1.0 . 3.47 78 75 A 31 ARG H A 30 CYS HA 1.0 . 2.67 79 76 A 31 ARG H A 31 ARG HBx 1.0 . 3.76 80 77 A 31 ARG H A 31 ARG HDx 1.0 . 4.73 81 77 A 31 ARG H A 31 ARG HDy 1.0 . 4.73 82 78 A 32 TYR H A 31 ARG HA 1.0 . 2.48 83 79 A 14 TRP H A 14 TRP HBy 1.0 . 3.88 84 80 A 14 TRP H A 14 TRP HBx 1.0 . 2.93 85 81 A 24 ARG H A 22 THR HA 1.0 . 4.68 86 82 A 24 ARG HBx A 25 GLY H 1.0 . 3.62 87 83 A 25 GLY H A 24 ARG HA 1.0 . 3.54 88 84 A 24 ARG H A 26 TYR H 1.0 . 5.08 89 85 A 27 THR HG2% A 27 THR H 1.0 . 3.50 90 86 A 26 TYR HBx A 27 THR H 1.0 . 4.95 91 87 A 26 TYR HBy A 27 THR H 1.0 . 3.96 92 88 A 28 GLY H A 27 THR HB 1.0 . 3.97 93 89 A 29 SER H A 28 GLY HAx 1.0 . 2.99 94 90 A 29 SER H A 28 GLY HAy 1.0 . 2.99 95 91 A 29 SER H A 28 GLY H 1.0 . 5.34 96 92 A 23 ASP H A 22 THR HG2% 1.0 . 4.19 97 93 A 24 ARG HE A 24 ARG HBy 1.0 . 5.09 98 94 A 24 ARG H A 24 ARG HGx 1.0 . 3.14 99 95 A 3 ALA H A 2 THR HA 1.0 . 2.49 100 96 A 3 ALA H A 2 THR HB 1.0 . 3.70 101 97 A 3 ALA H A 2 THR HG2% 1.0 . 3.01 102 98 A 3 ALA HB% A 4 CYS H 1.0 . 3.31 103 99 A 3 ALA H A 4 CYS H 1.0 . 4.74 104 100 A 5 SER H A 4 CYS HA 1.0 . 3.05 105 101 A 5 SER H A 4 CYS HBy 1.0 . 4.24 106 102 A 5 SER H A 4 CYS HBx 1.0 . 2.88 107 103 A 6 CYS H A 5 SER HA 1.0 . 2.55 108 104 A 6 CYS H A 5 SER HBy 1.0 . 3.52 109 105 A 6 CYS H A 5 SER HBx 1.0 . 3.52 110 106 A 15 PHE H A 15 PHE HBx 1.0 . 3.68 111 107 A 14 TRP HBx A 14 TRP HD1 1.0 . 2.83 112 108 A 14 TRP HBy A 14 TRP HE3 1.0 . 2.78 113 109 A 14 TRP HBx A 14 TRP HE3 1.0 . 4.07 114 110 A 17 ARG H A 14 TRP HBy 1.0 . 5.09 115 111 A 17 ARG H A 14 TRP HBx 1.0 . 5.50 116 112 A 15 PHE H A 14 TRP H 1.0 . 4.62 117 113 A 15 PHE H A 14 TRP HA 1.0 . 2.50 118 114 A 14 TRP HE3 A 14 TRP HA 1.0 . 3.52 119 115 A 15 PHE H A 14 TRP HBy 1.0 . 4.57 120 116 A 16 TYR HBy A 17 ARG H 1.0 . 4.98 121 117 A 17 ARG H A 16 TYR HBx 1.0 . 5.50 122 118 A 17 ARG H A 16 TYR HA 1.0 . 3.15 123 119 A 16 TYR HA A 16 TYR HD% 1.0 . 3.19 124 120 A 16 TYR HA A 16 TYR HE% 1.0 . 5.03 125 121 A 17 ARG HA A 18 PRO HDy 1.0 . 2.72 126 122 A 17 ARG HA A 18 PRO HDx 1.0 . 2.90 127 123 A 19 SER H A 17 ARG HA 1.0 . 4.00 128 124 A 19 SER H A 18 PRO HDy 1.0 . 3.10 129 125 A 19 SER H A 18 PRO HDx 1.0 . 3.95 130 126 A 19 SER H A 18 PRO HBy 1.0 . 3.92 131 127 A 19 SER H A 18 PRO HGx 1.0 . 3.31 132 128 A 19 SER H A 17 ARG HBx 1.0 . 3.64 133 129 A 20 CYS H A 20 CYS HBy 1.0 . 3.60 134 130 A 20 CYS H A 19 SER HA 1.0 . 2.79 135 131 A 20 CYS H A 19 SER HBx 1.0 . 3.58 136 131 A 19 SER HBy A 20 CYS H 1.0 . 3.58 137 132 A 20 CYS HA A 21 PRO HDx 1.0 . 2.63 138 133 A 14 TRP H A 13 TYR HBx 1.0 . 4.69 139 134 A 14 TRP H A 13 TYR HBy 1.0 . 5.00 140 135 A 13 TYR HBx A 13 TYR H 1.0 . 2.98 141 136 A 13 TYR HBy A 13 TYR H 1.0 . 2.68 142 137 A 14 TRP H A 13 TYR H 1.0 . 5.06 143 138 A 13 TYR H A 12 ILE HA 1.0 . 3.27 144 139 A 12 ILE HD1% A 13 TYR H 1.0 . 3.66 145 140 A 12 ILE HG2% A 13 TYR H 1.0 . 2.83 146 141 A 3 ALA HB% A 13 TYR H 1.0 . 5.50 147 142 A 12 ILE HB A 13 TYR H 1.0 . 4.37 148 143 A 12 ILE H A 11 GLY HAy 1.0 . 3.03 149 144 A 12 ILE H A 11 GLY HAx 1.0 . 2.89 150 145 A 10 LYS HA A 11 GLY H 1.0 . 2.42 151 146 A 10 LYS HBx A 11 GLY H 1.0 . 3.25 152 147 A 10 LYS HBy A 11 GLY H 1.0 . 4.22 153 148 A 11 GLY H A 10 LYS HDx 1.0 . 5.50 154 148 A 10 LYS HDy A 11 GLY H 1.0 . 5.50 155 149 A 4 CYS HBx A 11 GLY H 1.0 . 5.50 156 150 A 12 ILE H A 11 GLY H 1.0 . 4.72 157 151 A 13 TYR HD% A 15 PHE HE% 1.0 . 4.40 158 152 A 12 ILE HD1% A 12 ILE HB 1.0 . 3.64 159 153 A 12 ILE HD1% A 12 ILE HA 1.0 . 3.99 160 154 A 10 LYS HDy A 10 LYS HEx 1.0 . 2.40 161 154 A 10 LYS HDx A 10 LYS HEx 1.0 . 2.40 162 154 A 10 LYS HEy A 10 LYS HDx 1.0 . 2.40 163 154 A 10 LYS HDy A 10 LYS HEy 1.0 . 2.40 164 155 A 10 LYS HA A 10 LYS HDx 1.0 . 4.29 165 155 A 10 LYS HDy A 10 LYS HA 1.0 . 4.29 166 156 A 10 LYS HBy A 10 LYS HEx 1.0 . 4.34 167 156 A 10 LYS HBy A 10 LYS HEy 1.0 . 4.34 168 157 A 14 TRP HBx A 17 ARG HBx 1.0 . 4.55 169 158 A 10 LYS HBx A 10 LYS HDx 1.0 . 3.25 170 158 A 10 LYS HBx A 10 LYS HDy 1.0 . 3.25 171 159 A 10 LYS HBy A 10 LYS HDx 1.0 . 3.29 172 159 A 10 LYS HBy A 10 LYS HDy 1.0 . 3.29 173 160 A 10 LYS HGy A 10 LYS HDx 1.0 . 2.55 174 160 A 10 LYS HDy A 10 LYS HGy 1.0 . 2.55 175 161 A 10 LYS HDy A 10 LYS HGx 1.0 . 2.55 176 161 A 10 LYS HDx A 10 LYS HGx 1.0 . 2.55 177 162 A 9 SER H A 9 SER HBy 1.0 . 3.09 178 163 A 9 SER H A 9 SER HBx 1.0 . 3.56 179 164 A 10 LYS H A 9 SER HBy 1.0 . 4.25 180 165 A 10 LYS H A 9 SER HBx 1.0 . 3.97 181 166 A 10 LYS H A 9 SER HA 1.0 . 2.46 182 167 A 10 LYS H A 9 SER H 1.0 . 5.18 183 168 A 41 ALA H A 40 PRO HBx 1.0 . 3.60 184 169 A 41 ALA H A 40 PRO HBy 1.0 . 3.02 185 170 A 41 ALA H A 40 PRO HGy 1.0 . 5.50 186 171 A 10 LYS HBx A 41 ALA H 1.0 . 5.45 187 172 A 41 ALA H A 40 PRO HGx 1.0 . 5.50 188 173 A 41 ALA H A 40 PRO HA 1.0 . 2.68 189 174 A 42 ASP H A 41 ALA HB% 1.0 . 3.60 190 175 A 42 ASP H A 41 ALA HA 1.0 . 2.47 191 176 A 9 SER H A 8 ASN H 1.0 . 4.03 192 177 A 9 SER H A 8 ASN HBy 1.0 . 4.74 193 178 A 9 SER H A 8 ASN HBx 1.0 . 4.74 194 179 A 6 CYS H A 9 SER H 1.0 . 3.68 195 180 A 4 CYS H A 11 GLY H 1.0 . 3.30 196 181 A 38 CYS H A 12 ILE H 1.0 . 3.99 197 182 A 36 THR H A 14 TRP H 1.0 . 3.93 198 183 A 30 CYS H A 37 CYS H 1.0 . 3.51 199 184 A 28 GLY H A 27 THR H 1.0 . 2.48 200 185 A 31 ARG HA A 31 ARG HGx 1.0 . 4.08 201 186 A 2 THR H A 2 THR HB 1.0 . 2.94 202 187 A 4 CYS H A 5 SER H 1.0 . 4.83 203 188 A 6 CYS H A 5 SER H 1.0 . 5.19 204 189 A 9 SER HBx A 9 SER HA 1.0 . 2.98 205 190 A 10 LYS HA A 10 LYS HEx 1.0 . 5.50 206 190 A 10 LYS HA A 10 LYS HEy 1.0 . 5.50 207 191 A 14 TRP HBx A 35 GLY HAx 1.0 . 5.50 208 191 A 14 TRP HBx A 35 GLY HAy 1.0 . 5.50 209 192 A 10 LYS HBx A 10 LYS HEx 1.0 . 5.50 210 192 A 10 LYS HBx A 10 LYS HEy 1.0 . 5.50 211 193 A 13 TYR H A 13 TYR HD% 1.0 . 4.23 212 194 A 14 TRP H A 14 TRP HD1 1.0 . 3.40 213 195 A 16 TYR H A 15 PHE H 1.0 . 4.73 214 196 A 16 TYR H A 17 ARG H 1.0 . 3.34 215 197 A 17 ARG HA A 17 ARG HDx 1.0 . 4.67 216 198 A 17 ARG HA A 17 ARG HDy 1.0 . 4.67 217 199 A 17 ARG HBy A 17 ARG HGx 1.0 . 2.78 218 199 A 17 ARG HBy A 17 ARG HGy 1.0 . 2.78 219 200 A 17 ARG HBy A 17 ARG HDx 1.0 . 4.09 220 201 A 17 ARG HBy A 17 ARG HDy 1.0 . 4.09 221 202 A 17 ARG HBx A 17 ARG HDx 1.0 . 3.53 222 203 A 17 ARG HBx A 17 ARG HDy 1.0 . 3.53 223 204 A 17 ARG HA A 17 ARG HGx 1.0 . 3.61 224 204 A 17 ARG HA A 17 ARG HGy 1.0 . 3.61 225 205 A 17 ARG HBy A 18 PRO HDy 1.0 . 5.50 226 206 A 19 SER HA A 19 SER HBx 1.0 . 2.56 227 206 A 19 SER HBy A 19 SER HA 1.0 . 2.56 228 207 A 22 THR HG2% A 22 THR HA 1.0 . 2.64 229 208 A 3 ALA HB% A 2 THR HA 1.0 . 4.71 230 209 A 24 ARG HGx A 24 ARG HA 1.0 . 3.61 231 210 A 24 ARG HA A 24 ARG HDx 1.0 . 4.42 232 211 A 21 PRO HGx A 24 ARG HGy 1.0 . 2.53 233 212 A 24 ARG HGy A 24 ARG HBy 1.0 . 2.78 234 213 A 21 PRO HGx A 24 ARG HGx 1.0 . 5.50 235 214 A 27 THR HG2% A 27 THR HA 1.0 . 2.75 236 215 A 29 SER HBx A 29 SER HA 1.0 . 2.84 237 216 A 26 TYR H A 27 THR H 1.0 . 4.89 238 217 A 30 CYS H A 29 SER H 1.0 . 4.33 239 218 A 31 ARG HA A 31 ARG HDx 1.0 . 3.82 240 218 A 31 ARG HDy A 31 ARG HA 1.0 . 3.82 241 219 A 31 ARG H A 32 TYR H 1.0 . 5.01 242 220 A 38 CYS H A 37 CYS H 1.0 . 4.68 243 221 A 37 CYS H A 36 THR H 1.0 . 5.07 244 222 A 38 CYS H A 39 THR H 1.0 . 4.77 245 223 A 39 THR HG2% A 39 THR HA 1.0 . 3.58 246 224 A 41 ALA H A 40 PRO HDx 1.0 . 5.50 247 225 A 42 ASP H A 41 ALA H 1.0 . 4.38 248 226 A 42 ASP HA A 42 ASP HBx 1.0 . 2.73 249 226 A 42 ASP HBy A 42 ASP HA 1.0 . 2.73 250 227 A 34 LEU H A 34 LEU HDx% 1.0 . 4.95 251 228 A 34 LEU H A 34 LEU HDy% 1.0 . 4.52 252 229 A 34 LEU HBx A 34 LEU HDx% 1.0 . 2.85 253 230 A 34 LEU HBy A 34 LEU HDx% 1.0 . 2.89 254 231 A 34 LEU HBx A 34 LEU HDy% 1.0 . 3.25 255 232 A 34 LEU HBy A 34 LEU HDy% 1.0 . 3.06 256 233 A 34 LEU HDx% A 34 LEU HA 1.0 . 4.98 257 234 A 34 LEU HDy% A 34 LEU HA 1.0 . 3.04 258 235 A 34 LEU H A 35 GLY H 1.0 . 3.07 259 236 A 16 TYR H A 15 PHE HBx 1.0 . 4.09 260 237 A 16 TYR H A 15 PHE HA 1.0 . 2.91 261 238 A 32 TYR H A 31 ARG HDx 1.0 . 4.68 262 238 A 32 TYR H A 31 ARG HDy 1.0 . 4.68 263 239 A 34 LEU HA A 35 GLY H 1.0 . 3.56 264 240 A 34 LEU HBy A 35 GLY H 1.0 . 5.00 265 241 A 34 LEU HBx A 35 GLY H 1.0 . 4.56 266 242 A 34 LEU HG A 35 GLY H 1.0 . 5.50 267 243 A 36 THR H A 35 GLY HAx 1.0 . 2.50 268 243 A 36 THR H A 35 GLY HAy 1.0 . 2.50 269 244 A 12 ILE HD1% A 12 ILE HG2% 1.0 . 5.50 270 245 A 34 LEU H A 33 PHE HBy 1.0 . 2.80 271 246 A 34 LEU H A 33 PHE HBx 1.0 . 3.57 272 247 A 33 PHE HA A 33 PHE HD% 1.0 . 3.19 273 248 A 33 PHE HBy A 32 TYR HD% 1.0 . 4.03 274 249 A 33 PHE HBx A 32 TYR HD% 1.0 . 3.93 275 250 A 33 PHE HBy A 32 TYR HE% 1.0 . 4.08 276 251 A 33 PHE HBx A 32 TYR HE% 1.0 . 4.25 277 252 A 32 TYR HBy A 13 TYR HD% 1.0 . 3.70 278 253 A 32 TYR HBx A 13 TYR HD% 1.0 . 4.20 279 254 A 20 CYS HBy A 26 TYR HE% 1.0 . 4.09 280 255 A 4 CYS HA A 32 TYR HD% 1.0 . 5.50 281 256 A 32 TYR HD% A 32 TYR HA 1.0 . 3.34 282 257 A 32 TYR HE% A 32 TYR HA 1.0 . 4.65 283 258 A 4 CYS HA A 32 TYR HE% 1.0 . 4.38 284 259 A 33 PHE HA A 33 PHE H 1.0 . 2.81 285 260 A 33 PHE HBy A 33 PHE H 1.0 . 3.53 286 261 A 33 PHE HBx A 33 PHE H 1.0 . 3.43 287 262 A 12 ILE HG2% A 14 TRP H 1.0 . 4.60 288 263 A 36 THR HG2% A 14 TRP H 1.0 . 5.10 289 264 A 12 ILE HB A 14 TRP HE1 1.0 . 3.78 290 265 A 14 TRP HE1 A 12 ILE HG1y 1.0 . 5.20 291 266 A 14 TRP HE1 A 12 ILE HG1x 1.0 . 5.20 292 267 A 27 THR H A 40 PRO HDx 1.0 . 3.54 293 268 A 27 THR H A 40 PRO HDy 1.0 . 3.66 294 269 A 32 TYR HBx A 37 CYS H 1.0 . 3.82 295 270 A 32 TYR HBy A 37 CYS H 1.0 . 4.87 296 271 A 29 SER HBx A 37 CYS H 1.0 . 4.66 297 272 A 37 CYS H A 31 ARG HA 1.0 . 4.07 298 273 A 37 CYS HA A 14 TRP H 1.0 . 4.16 299 274 A 36 THR HB A 14 TRP H 1.0 . 4.62 300 275 A 26 TYR HE% A 14 TRP HE1 1.0 . 3.69 301 276 A 21 PRO HDy A 14 TRP HE1 1.0 . 4.84 302 277 A 38 CYS HBy A 14 TRP HE1 1.0 . 4.27 303 278 A 38 CYS HBx A 14 TRP HE1 1.0 . 4.62 304 279 A 12 ILE HD1% A 14 TRP HE1 1.0 . 5.50 305 280 A 14 TRP HE1 A 21 PRO HGy 1.0 . 5.50 306 281 A 12 ILE HG2% A 14 TRP HE1 1.0 . 3.12 307 282 A 14 TRP H A 35 GLY HAx 1.0 . 5.31 308 282 A 14 TRP H A 35 GLY HAy 1.0 . 5.31 309 283 A 37 CYS H A 13 TYR HD% 1.0 . 4.81 310 284 A 37 CYS H A 32 TYR HD% 1.0 . 4.64 311 285 A 14 TRP H A 13 TYR HD% 1.0 . 3.07 312 286 A 12 ILE H A 39 THR HG2% 1.0 . 3.68 313 287 A 12 ILE H A 41 ALA HB% 1.0 . 3.84 314 288 A 38 CYS HBy A 12 ILE H 1.0 . 4.31 315 289 A 30 CYS H A 37 CYS HBx 1.0 . 5.30 316 290 A 30 CYS H A 36 THR HG2% 1.0 . 3.39 317 291 A 30 CYS H A 37 CYS HBy 1.0 . 3.52 318 292 A 38 CYS H A 36 THR HG2% 1.0 . 4.76 319 293 A 2 THR HG2% A 13 TYR H 1.0 . 5.19 320 294 A 4 CYS HBy A 13 TYR H 1.0 . 4.94 321 295 A 38 CYS H A 11 GLY HAx 1.0 . 5.02 322 296 A 2 THR HB A 13 TYR H 1.0 . 4.41 323 297 A 3 ALA HA A 13 TYR H 1.0 . 4.13 324 298 A 10 LYS H A 39 THR HG2% 1.0 . 4.86 325 299 A 23 ASP H A 21 PRO HBy 1.0 . 4.16 326 300 A 4 CYS H A 13 TYR H 1.0 . 4.45 327 301 A 41 ALA H A 11 GLY H 1.0 . 5.41 328 302 A 5 SER HA A 11 GLY H 1.0 . 3.63 329 303 A 41 ALA HB% A 11 GLY H 1.0 . 3.83 330 304 A 39 THR HG2% A 11 GLY H 1.0 . 3.83 331 305 A 36 THR H A 14 TRP HBx 1.0 . 4.30 332 306 A 36 THR H A 14 TRP HBy 1.0 . 4.82 333 307 A 36 THR H A 15 PHE HA 1.0 . 4.51 334 308 A 17 ARG H A 36 THR H 1.0 . 4.00 335 309 A 28 GLY H A 40 PRO HDy 1.0 . 5.32 336 310 A 28 GLY H A 40 PRO HDx 1.0 . 4.19 337 311 A 39 THR H A 29 SER HBy 1.0 . 4.91 338 312 A 39 THR H A 26 TYR HBy 1.0 . 3.81 339 313 A 39 THR H A 26 TYR HBx 1.0 . 5.50 340 314 A 6 CYS H A 9 SER HBx 1.0 . 5.35 341 315 A 6 CYS H A 9 SER HBy 1.0 . 4.08 342 316 A 6 CYS H A 10 LYS HA 1.0 . 4.46 343 317 A 42 ASP H A 40 PRO HBy 1.0 . 5.35 344 318 A 35 GLY H A 33 PHE HBx 1.0 . 5.50 345 319 A 35 GLY H A 33 PHE HBy 1.0 . 4.95 346 320 A 2 THR H A 13 TYR HD% 1.0 . 3.08 347 321 A 32 TYR H A 32 TYR HD% 1.0 . 4.51 348 322 A 25 GLY H A 24 ARG HBy 1.0 . 4.04 349 323 A 12 ILE HD1% A 42 ASP H 1.0 . 3.80 350 324 A 12 ILE HB A 42 ASP H 1.0 . 4.33 351 325 A 32 TYR H A 36 THR HG2% 1.0 . 4.77 352 326 A 42 ASP H A 12 ILE HG1x 1.0 . 3.00 353 327 A 42 ASP H A 12 ILE HG1y 1.0 . 3.00 354 328 A 6 CYS HBx A 9 SER H 1.0 . 4.54 355 329 A 39 THR HG2% A 9 SER H 1.0 . 5.36 356 330 A 9 SER H A 5 SER HBx 1.0 . 4.66 357 331 A 9 SER H A 5 SER HBy 1.0 . 4.66 358 332 A 34 LEU H A 33 PHE HD% 1.0 . 3.93 359 333 A 12 ILE HD1% A 4 CYS H 1.0 . 5.29 360 334 A 26 TYR H A 24 ARG HBy 1.0 . 4.02 361 335 A 4 CYS H A 10 LYS HA 1.0 . 5.18 362 336 A 14 TRP HE3 A 17 ARG HDy 1.0 . 3.44 363 337 A 14 TRP HE3 A 17 ARG HDx 1.0 . 3.44 364 338 A 14 TRP HE3 A 17 ARG HGx 1.0 . 4.53 365 338 A 14 TRP HE3 A 17 ARG HGy 1.0 . 4.53 366 339 A 14 TRP HE3 A 21 PRO HGy 1.0 . 5.50 367 340 A 12 ILE HG2% A 14 TRP HE3 1.0 . 5.07 368 341 A 26 TYR HE% A 14 TRP HZ2 1.0 . 4.28 369 342 A 14 TRP HZ2 A 24 ARG HDx 1.0 . 4.49 370 343 A 24 ARG HBx A 14 TRP HZ2 1.0 . 5.50 371 344 A 24 ARG HGy A 14 TRP HZ2 1.0 . 4.45 372 345 A 12 ILE HG2% A 14 TRP HZ2 1.0 . 3.69 373 346 A 21 PRO HGy A 14 TRP HZ2 1.0 . 4.56 374 347 A 41 ALA H A 39 THR HB 1.0 . 4.28 375 348 A 39 THR HG2% A 41 ALA H 1.0 . 4.16 376 349 A 10 LYS HBy A 41 ALA H 1.0 . 4.45 377 350 A 41 ALA H A 11 GLY HAx 1.0 . 4.71 378 351 A 41 ALA H A 11 GLY HAy 1.0 . 3.26 379 352 A 41 ALA H A 39 THR HA 1.0 . 4.43 380 353 A 41 ALA H A 42 ASP HA 1.0 . 5.50 381 354 A 17 ARG H A 18 PRO HDx 1.0 . 4.94 382 355 A 17 ARG H A 15 PHE HA 1.0 . 4.53 383 356 A 17 ARG H A 35 GLY HAx 1.0 . 3.02 384 356 A 17 ARG H A 35 GLY HAy 1.0 . 3.02 385 357 A 5 SER H A 32 TYR HD% 1.0 . 5.39 386 358 A 34 LEU HDx% A 33 PHE HE% 1.0 . 4.80 387 359 A 34 LEU HDy% A 33 PHE HE% 1.0 . 4.99 388 360 A 34 LEU HBx A 15 PHE HE% 1.0 . 3.95 389 361 A 15 PHE HE% A 34 LEU HDx% 1.0 . 3.28 390 362 A 15 PHE HE% A 34 LEU HDy% 1.0 . 4.96 391 363 A 26 TYR HD% A 20 CYS HBy 1.0 . 2.58 392 364 A 38 CYS HBy A 26 TYR HD% 1.0 . 4.39 393 365 A 24 ARG HBx A 26 TYR HD% 1.0 . 3.88 394 366 A 26 TYR HD% A 38 CYS HBx 1.0 . 3.46 395 367 A 21 PRO HGx A 26 TYR HD% 1.0 . 3.39 396 368 A 26 TYR HD% A 24 ARG HBy 1.0 . 3.65 397 369 A 26 TYR HD% A 21 PRO HDx 1.0 . 4.85 398 370 A 26 TYR HD% A 40 PRO HDx 1.0 . 4.44 399 371 A 15 PHE HE% A 15 PHE HA 1.0 . 4.65 400 372 A 26 TYR HD% A 40 PRO HDy 1.0 . 3.40 401 373 A 26 TYR HD% A 20 CYS HA 1.0 . 4.53 402 374 A 26 TYR HD% A 41 ALA HA 1.0 . 4.70 403 375 A 14 TRP HD1 A 20 CYS HA 1.0 . 5.50 404 376 A 37 CYS HA A 14 TRP HD1 1.0 . 4.98 405 377 A 14 TRP HD1 A 21 PRO HDx 1.0 . 5.50 406 378 A 15 PHE HBx A 16 TYR HD% 1.0 . 3.70 407 379 A 38 CYS HBy A 14 TRP HD1 1.0 . 2.95 408 380 A 12 ILE HB A 14 TRP HD1 1.0 . 3.98 409 381 A 14 TRP HD1 A 17 ARG HBx 1.0 . 5.05 410 382 A 34 LEU HBy A 13 TYR HE% 1.0 . 5.02 411 383 A 34 LEU HBy A 16 TYR HD% 1.0 . 5.42 412 384 A 34 LEU HBx A 13 TYR HE% 1.0 . 5.26 413 385 A 38 CYS HBx A 14 TRP HD1 1.0 . 4.45 414 386 A 36 THR HG2% A 14 TRP HD1 1.0 . 4.92 415 387 A 12 ILE HG2% A 14 TRP HD1 1.0 . 3.61 416 388 A 34 LEU HDx% A 13 TYR HE% 1.0 . 4.62 417 389 A 34 LEU HDy% A 13 TYR HE% 1.0 . 5.50 418 390 A 16 TYR HD% A 34 LEU HDy% 1.0 . 5.50 419 391 A 15 PHE HBx A 16 TYR HE% 1.0 . 3.99 420 392 A 34 LEU HBy A 16 TYR HE% 1.0 . 4.05 421 393 A 34 LEU HBx A 16 TYR HE% 1.0 . 5.50 422 394 A 34 LEU HDx% A 33 PHE HD% 1.0 . 3.91 423 395 A 16 TYR HE% A 34 LEU HDy% 1.0 . 4.08 424 396 A 34 LEU HG A 33 PHE HD% 1.0 . 4.07 425 397 A 4 CYS HBx A 32 TYR HD% 1.0 . 3.77 426 398 A 37 CYS HBx A 32 TYR HD% 1.0 . 3.50 427 399 A 13 TYR HBx A 32 TYR HD% 1.0 . 4.59 428 400 A 4 CYS HBy A 32 TYR HD% 1.0 . 4.06 429 401 A 37 CYS HBx A 13 TYR HD% 1.0 . 4.31 430 402 A 37 CYS HBx A 32 TYR HE% 1.0 . 4.60 431 403 A 21 PRO HDy A 26 TYR HE% 1.0 . 3.23 432 404 A 4 CYS HBy A 32 TYR HE% 1.0 . 3.65 433 405 A 34 LEU HBx A 32 TYR HE% 1.0 . 4.55 434 406 A 2 THR HG2% A 13 TYR HD% 1.0 . 3.47 435 407 A 36 THR HG2% A 13 TYR HD% 1.0 . 5.50 436 408 A 34 LEU HDx% A 32 TYR HE% 1.0 . 4.55 437 409 A 4 CYS HBx A 32 TYR HE% 1.0 . 3.55 438 410 A 21 PRO HGx A 26 TYR HE% 1.0 . 2.78 439 411 A 37 CYS HBy A 32 TYR HE% 1.0 . 5.31 440 412 A 37 CYS HBy A 13 TYR HD% 1.0 . 5.50 441 413 A 2 THR HB A 13 TYR HD% 1.0 . 3.47 442 414 A 14 TRP HA A 13 TYR HD% 1.0 . 4.51 443 415 A 37 CYS HA A 13 TYR HD% 1.0 . 4.17 444 416 A 13 TYR HD% A 13 TYR HA 1.0 . 5.37 445 417 A 37 CYS HBy A 32 TYR HD% 1.0 . 4.10 446 418 A 38 CYS H A 13 TYR HD% 1.0 . 5.43 447 419 A 14 TRP HA A 15 PHE HD% 1.0 . 4.94 448 420 A 15 PHE HA A 15 PHE HD% 1.0 . 3.35 449 421 A 34 LEU HBy A 15 PHE HD% 1.0 . 3.72 450 422 A 34 LEU HBx A 15 PHE HD% 1.0 . 3.84 451 423 A 34 LEU HDx% A 15 PHE HD% 1.0 . 3.99 452 424 A 38 CYS H A 11 GLY HAy 1.0 . 5.50 453 425 A 37 CYS H A 29 SER HA 1.0 . 4.98 454 426 A 32 TYR H A 37 CYS H 1.0 . 3.99 455 427 A 38 CYS HA A 29 SER HA 1.0 . 3.13 456 428 A 39 THR H A 29 SER HA 1.0 . 3.67 457 429 A 39 THR H A 39 THR HG1 1.0 . 3.93 458 430 A 12 ILE H A 39 THR H 1.0 . 5.50 459 431 A 30 CYS H A 39 THR H 1.0 . 5.50 460 432 A 30 CYS H A 38 CYS HA 1.0 . 4.84 461 433 A 12 ILE HG2% A 14 TRP HH2 1.0 . 5.12 462 434 A 21 PRO HGx A 14 TRP HH2 1.0 . 5.50 463 435 A 21 PRO HGy A 14 TRP HH2 1.0 . 4.44 464 436 A 21 PRO HGy A 14 TRP HZ3 1.0 . 4.59 465 437 A 12 ILE HG2% A 14 TRP HZ3 1.0 . 5.40 466 438 A 19 SER H A 17 ARG HGx 1.0 . 4.08 467 438 A 19 SER H A 17 ARG HGy 1.0 . 4.08 468 439 A 36 THR HG1 A 35 GLY HAx 1.0 . 4.46 469 439 A 35 GLY HAy A 36 THR HG1 1.0 . 4.46 470 440 A 36 THR HG2% A 36 THR HG1 1.0 . 3.36 471 441 A 36 THR HG2% A 29 SER HG 1.0 . 3.37 472 442 A 39 THR HG2% A 39 THR HG1 1.0 . 3.43 473 443 A 22 THR H A 21 PRO HA 1.0 . 3.05 474 444 A 32 TYR HBy A 33 PHE H 1.0 . 3.78 475 445 A 32 TYR HBx A 33 PHE H 1.0 . 5.50 476 446 A 22 THR H A 21 PRO HBy 1.0 . 4.60 477 447 A 31 ARG H A 36 THR HG2% 1.0 . 3.70 478 448 A 22 THR H A 21 PRO HBx 1.0 . 4.60 479 449 A 14 TRP HE3 A 17 ARG HBx 1.0 . 4.51 480 450 A 26 TYR HD% A 27 THR H 1.0 . 4.00 481 451 A 38 CYS H A 14 TRP HD1 1.0 . 3.48 482 452 A 16 TYR H A 16 TYR HD% 1.0 . 4.00 483 453 A 16 TYR H A 15 PHE HD% 1.0 . 4.22 484 454 A 16 TYR H A 13 TYR HD% 1.0 . 5.50 485 455 A 36 THR H A 13 TYR HD% 1.0 . 3.53 486 456 A 42 ASP H A 26 TYR HE% 1.0 . 3.58 487 457 A 32 TYR H A 13 TYR HD% 1.0 . 5.50 488 458 A 39 THR H A 26 TYR HD% 1.0 . 4.85 489 459 A 26 TYR HD% A 25 GLY H 1.0 . 4.79 490 460 A 42 ASP H A 26 TYR HD% 1.0 . 5.08 491 461 A 15 PHE H A 13 TYR HD% 1.0 . 5.28 492 462 A 26 TYR H A 26 TYR HE% 1.0 . 5.50 493 463 A 15 PHE H A 15 PHE HD% 1.0 . 3.63 494 464 A 26 TYR H A 26 TYR HD% 1.0 . 3.39 495 465 A 5 SER H A 32 TYR HE% 1.0 . 3.78 496 466 A 14 TRP HD1 A 14 TRP HA 1.0 . 4.13 497 467 A 2 THR HA A 13 TYR HD% 1.0 . 4.79 498 468 A 42 ASP HA A 26 TYR HE% 1.0 . 5.05 499 469 A 17 ARG HBy A 17 ARG HE 1.0 . 4.83 500 470 A 17 ARG HBx A 17 ARG HE 1.0 . 4.92 501 471 A 30 CYS HA A 29 SER HA 1.0 . 4.86 502 472 A 29 SER HBy A 29 SER HA 1.0 . 3.01 503 473 A 30 CYS H A 29 SER HA 1.0 . 2.54 504 474 A 36 THR H A 36 THR HG1 1.0 . 4.18 505 475 A 2 THR HA A 13 TYR H 1.0 . 5.08 506 476 A 15 PHE HA A 35 GLY HAx 1.0 . 3.02 507 476 A 35 GLY HAy A 15 PHE HA 1.0 . 3.02 508 477 A 14 TRP HZ2 A 24 ARG HDy 1.0 . 4.49 509 478 A 24 ARG HA A 24 ARG HDy 1.0 . 4.42 510 479 A 5 SER HA A 10 LYS HA 1.0 . 3.67 511 480 A 26 TYR HA A 40 PRO HDy 1.0 . 3.74 512 481 A 40 PRO HA A 39 THR HB 1.0 . 2.64 513 482 A 26 TYR HA A 40 PRO HDx 1.0 . 4.78 514 483 A 16 TYR HA A 15 PHE HA 1.0 . 4.42 515 484 A 39 THR HG2% A 40 PRO HA 1.0 . 3.69 516 485 A 39 THR HG2% A 11 GLY HAy 1.0 . 3.30 517 486 A 39 THR HG2% A 10 LYS HA 1.0 . 5.05 518 487 A 39 THR HG2% A 9 SER HBy 1.0 . 3.47 519 488 A 39 THR HG2% A 11 GLY HAx 1.0 . 2.91 520 489 A 39 THR HG2% A 6 CYS HBy 1.0 . 4.43 521 490 A 12 ILE HD1% A 41 ALA HA 1.0 . 3.74 522 491 A 36 THR HG2% A 31 ARG HA 1.0 . 4.08 523 492 A 29 SER HBy A 36 THR HG2% 1.0 . 4.20 524 493 A 29 SER HBx A 36 THR HG2% 1.0 . 2.82 525 494 A 27 THR HG2% A 40 PRO HDy 1.0 . 4.01 526 495 A 27 THR HG2% A 40 PRO HDx 1.0 . 3.88 527 496 A 41 ALA HB% A 11 GLY HAy 1.0 . 3.31 528 497 A 10 LYS HBx A 41 ALA HB% 1.0 . 3.45 529 498 A 10 LYS HBy A 41 ALA HB% 1.0 . 3.40 530 499 A 12 ILE HB A 41 ALA HB% 1.0 . 4.92 531 500 A 32 TYR HBx A 37 CYS HBx 1.0 . 3.62 532 501 A 14 TRP HBy A 17 ARG HBx 1.0 . 3.43 533 502 A 14 TRP HBy A 17 ARG HGx 1.0 . 4.11 534 502 A 14 TRP HBy A 17 ARG HGy 1.0 . 4.11 535 503 A 2 THR HB A 13 TYR HBy 1.0 . 3.18 536 504 A 12 ILE HB A 41 ALA HA 1.0 . 4.17 537 505 A 18 PRO HDy A 17 ARG HBx 1.0 . 4.55 538 506 A 41 ALA HB% A 40 PRO HA 1.0 . 5.49 539 507 A 4 CYS HBy A 13 TYR HBx 1.0 . 3.33 540 508 A 12 ILE HD1% A 3 ALA HA 1.0 . 3.77 541 509 A 34 LEU H A 32 TYR HE% 1.0 . 4.07 542 510 A 17 ARG HBy A 14 TRP HBy 1.0 . 4.61 543 511 A 17 ARG HBy A 14 TRP HBx 1.0 . 4.94 544 512 A 18 PRO HDy A 17 ARG HGx 1.0 . 4.70 545 512 A 18 PRO HDy A 17 ARG HGy 1.0 . 4.70 546 513 A 39 THR HG2% A 41 ALA HA 1.0 . 5.08 547 514 A 39 THR HG2% A 6 CYS HBx 1.0 . 2.95 548 515 A 16 TYR H A 35 GLY HAx 1.0 . 3.58 549 515 A 16 TYR H A 35 GLY HAy 1.0 . 3.58 550 516 A 42 ASP H A 12 ILE HG2% 1.0 . 4.87 551 517 A 32 TYR HA A 33 PHE H 1.0 . 3.48 552 518 A 31 ARG H A 31 ARG HGy 1.0 . 3.94 553 519 A 12 ILE HD1% A 41 ALA HB% 1.0 . 2.73 554 520 A 19 SER H A 18 PRO HGy 1.0 . 4.50 555 521 A 34 LEU HBx A 33 PHE HD% 1.0 . 5.00 556 522 A 31 ARG HA A 31 ARG HGy 1.0 . 4.08 557 523 A 24 ARG HBx A 26 TYR H 1.0 . 5.50 558 524 A 17 ARG HBy A 14 TRP HE3 1.0 . 5.47 559 525 A 18 PRO HDx A 17 ARG HGx 1.0 . 5.50 560 525 A 18 PRO HDx A 17 ARG HGy 1.0 . 5.50 561 526 A 18 PRO HDx A 17 ARG HBx 1.0 . 5.50 562 527 A 5 SER H A 5 SER HBy 1.0 . 3.33 563 527 A 5 SER H A 5 SER HBx 1.0 . 3.33 564 528 A 6 CYS H A 5 SER HBy 1.0 . 3.06 565 528 A 6 CYS H A 5 SER HBx 1.0 . 3.06 566 529 A 10 LYS HA A 5 SER HBy 1.0 . 3.67 567 529 A 10 LYS HA A 5 SER HBx 1.0 . 3.67 568 530 A 11 GLY H A 5 SER HBy 1.0 . 4.95 569 530 A 11 GLY H A 5 SER HBx 1.0 . 4.95 570 531 A 39 THR HG2% A 5 SER HBy 1.0 . 5.34 571 531 A 39 THR HG2% A 5 SER HBx 1.0 . 5.34 572 532 A 9 SER H A 7 GLY HAx 1.0 . 4.37 573 532 A 9 SER H A 7 GLY HAy 1.0 . 4.37 574 533 A 8 ASN HBx A 8 ASN HD2x 1.0 . 2.96 575 533 A 8 ASN HBy A 8 ASN HD2x 1.0 . 2.96 576 533 A 8 ASN HD2y A 8 ASN HBx 1.0 . 2.96 577 533 A 8 ASN HBy A 8 ASN HD2y 1.0 . 2.96 578 534 A 9 SER H A 8 ASN HBx 1.0 . 4.14 579 534 A 9 SER H A 8 ASN HBy 1.0 . 4.14 580 535 A 10 LYS H A 10 LYS HGx 1.0 . 2.98 581 535 A 10 LYS H A 10 LYS HGy 1.0 . 2.98 582 536 A 10 LYS HA A 10 LYS HGx 1.0 . 3.62 583 536 A 10 LYS HA A 10 LYS HGy 1.0 . 3.62 584 537 A 10 LYS HDy A 10 LYS HGx 1.0 . 2.20 585 537 A 10 LYS HDx A 10 LYS HGx 1.0 . 2.20 586 537 A 10 LYS HGy A 10 LYS HDx 1.0 . 2.20 587 537 A 10 LYS HDy A 10 LYS HGy 1.0 . 2.20 588 538 A 11 GLY H A 10 LYS HGx 1.0 . 4.31 589 538 A 11 GLY H A 10 LYS HGy 1.0 . 4.31 590 539 A 12 ILE HG2% A 12 ILE HG1y 1.0 . 3.14 591 539 A 12 ILE HG2% A 12 ILE HG1x 1.0 . 3.14 592 540 A 13 TYR H A 12 ILE HG1y 1.0 . 5.34 593 540 A 13 TYR H A 12 ILE HG1x 1.0 . 5.34 594 541 A 14 TRP HE1 A 12 ILE HG1y 1.0 . 4.38 595 541 A 14 TRP HE1 A 12 ILE HG1x 1.0 . 4.38 596 542 A 26 TYR HE% A 12 ILE HG1y 1.0 . 4.35 597 542 A 26 TYR HE% A 12 ILE HG1x 1.0 . 4.35 598 543 A 41 ALA HA A 12 ILE HG1y 1.0 . 3.38 599 543 A 41 ALA HA A 12 ILE HG1x 1.0 . 3.38 600 544 A 41 ALA HB% A 12 ILE HG1y 1.0 . 3.98 601 544 A 41 ALA HB% A 12 ILE HG1x 1.0 . 3.98 602 545 A 14 TRP HBy A 17 ARG HDx 1.0 . 3.17 603 545 A 14 TRP HBy A 17 ARG HDy 1.0 . 3.17 604 546 A 14 TRP HE3 A 17 ARG HDx 1.0 . 3.00 605 546 A 14 TRP HE3 A 17 ARG HDy 1.0 . 3.00 606 547 A 14 TRP HZ2 A 24 ARG HDx 1.0 . 3.83 607 547 A 14 TRP HZ2 A 24 ARG HDy 1.0 . 3.83 608 548 A 14 TRP HH2 A 24 ARG HDx 1.0 . 3.94 609 548 A 14 TRP HH2 A 24 ARG HDy 1.0 . 3.94 610 549 A 17 ARG HBy A 17 ARG HDx 1.0 . 3.42 611 549 A 17 ARG HBy A 17 ARG HDy 1.0 . 3.42 612 550 A 17 ARG HBx A 17 ARG HDx 1.0 . 3.00 613 550 A 17 ARG HBx A 17 ARG HDy 1.0 . 3.00 614 551 A 22 THR H A 21 PRO HBy 1.0 . 3.97 615 551 A 22 THR H A 21 PRO HBx 1.0 . 3.97 616 552 A 23 ASP H A 21 PRO HBy 1.0 . 3.44 617 552 A 23 ASP H A 21 PRO HBx 1.0 . 3.44 618 553 A 26 TYR HD% A 21 PRO HBy 1.0 . 5.34 619 553 A 26 TYR HD% A 21 PRO HBx 1.0 . 5.34 620 554 A 21 PRO HGx A 24 ARG HDx 1.0 . 4.59 621 554 A 21 PRO HGx A 24 ARG HDy 1.0 . 4.59 622 555 A 23 ASP H A 23 ASP HBx 1.0 . 3.17 623 555 A 23 ASP H A 23 ASP HBy 1.0 . 3.17 624 556 A 24 ARG H A 24 ARG HDx 1.0 . 5.34 625 556 A 24 ARG H A 24 ARG HDy 1.0 . 5.34 626 557 A 24 ARG HA A 24 ARG HDx 1.0 . 3.79 627 557 A 24 ARG HA A 24 ARG HDy 1.0 . 3.79 628 558 A 24 ARG HBx A 24 ARG HDx 1.0 . 3.36 629 558 A 24 ARG HBx A 24 ARG HDy 1.0 . 3.36 630 559 A 26 TYR HE% A 24 ARG HDx 1.0 . 4.19 631 559 A 26 TYR HE% A 24 ARG HDy 1.0 . 4.19 632 560 A 25 GLY H A 25 GLY HAx 1.0 . 2.43 633 560 A 25 GLY H A 25 GLY HAy 1.0 . 2.43 634 561 A 29 SER H A 28 GLY HAy 1.0 . 2.49 635 561 A 29 SER H A 28 GLY HAx 1.0 . 2.49 636 562 A 29 SER HA A 28 GLY HAy 1.0 . 4.96 637 562 A 29 SER HA A 28 GLY HAx 1.0 . 4.96 638 563 A 31 ARG H A 31 ARG HBx 1.0 . 2.95 639 563 A 31 ARG H A 31 ARG HBy 1.0 . 2.95 640 564 A 31 ARG H A 31 ARG HGx 1.0 . 3.44 641 564 A 31 ARG H A 31 ARG HGy 1.0 . 3.44 642 565 A 31 ARG HA A 31 ARG HGx 1.0 . 3.43 643 565 A 31 ARG HA A 31 ARG HGy 1.0 . 3.43 644 566 A 31 ARG HBx A 31 ARG HDx 1.0 . 3.59 645 566 A 31 ARG HDy A 31 ARG HBx 1.0 . 3.59 646 566 A 31 ARG HDy A 31 ARG HBy 1.0 . 3.59 647 566 A 31 ARG HBy A 31 ARG HDx 1.0 . 3.59 648 567 A 32 TYR H A 31 ARG HBx 1.0 . 3.67 649 567 A 32 TYR H A 31 ARG HBy 1.0 . 3.67 650 568 A 31 ARG HE A 31 ARG HGx 1.0 . 3.44 651 568 A 31 ARG HGy A 31 ARG HE 1.0 . 3.44 652 569 A 32 TYR H A 31 ARG HGx 1.0 . 3.96 653 569 A 32 TYR H A 31 ARG HGy 1.0 . 3.96 stop_ save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _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 11 GLY H A 4 CYS O 1.0 . 2.0 2 2 A 4 CYS O A 11 GLY N 1.0 . 3.0 3 3 A 13 TYR H A 2 THR O 1.0 . 2.0 4 4 A 2 THR O A 13 TYR N 1.0 . 3.0 5 5 A 14 TRP H A 36 THR O 1.0 . 2.0 6 6 A 36 THR O A 14 TRP N 1.0 . 3.0 7 7 A 12 ILE H A 38 CYS O 1.0 . 2.0 8 8 A 38 CYS O A 12 ILE N 1.0 . 3.0 9 9 A 27 THR H A 39 THR O 1.0 . 2.0 10 10 A 39 THR O A 27 THR N 1.0 . 3.0 11 11 A 30 CYS H A 37 CYS O 1.0 . 2.0 12 12 A 37 CYS O A 30 CYS N 1.0 . 3.0 13 13 A 32 TYR H A 35 GLY O 1.0 . 2.0 14 14 A 35 GLY O A 32 TYR N 1.0 . 3.0 15 15 A 36 THR H A 14 TRP O 1.0 . 2.0 16 16 A 14 TRP O A 36 THR N 1.0 . 3.0 17 17 A 36 THR HG1 A 17 ARG O 1.0 . 2.3 18 18 A 17 ARG O A 36 THR OG1 1.0 . 3.3 19 19 A 37 CYS H A 30 CYS O 1.0 . 2.0 20 20 A 30 CYS O A 37 CYS N 1.0 . 3.0 21 21 A 38 CYS H A 12 ILE O 1.0 . 2.0 22 22 A 12 ILE O A 38 CYS N 1.0 . 3.0 23 23 A 39 THR H A 28 GLY O 1.0 . 2.0 24 24 A 28 GLY O A 39 THR N 1.0 . 3.0 25 25 A 39 THR HG1 A 28 GLY O 1.0 . 2.3 26 26 A 28 GLY O A 39 THR OG1 1.0 . 3.3 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 1 GLY C A 2 THR N A 2 THR CA A 2 THR C 1.0 -150.0 -90.0 PHI 2 2 A 2 THR C A 3 ALA N A 3 ALA CA A 3 ALA C 1.0 -150.0 -90.0 PHI 3 3 A 3 ALA C A 4 CYS N A 4 CYS CA A 4 CYS C 1.0 -150.0 -90.0 PHI 4 4 A 3 ALA C A 4 CYS N A 4 CYS CA A 4 CYS C 1.0 -130.4 -89.8 PHI 5 5 A 4 CYS C A 5 SER N A 5 SER CA A 5 SER C 1.0 -150.0 -90.0 PHI 6 6 A 4 CYS C A 5 SER N A 5 SER CA A 5 SER C 1.0 -156.3 -74.0 PHI 7 7 A 5 SER C A 6 CYS N A 6 CYS CA A 6 CYS C 1.0 -150.0 -90.0 PHI 8 8 A 7 GLY C A 8 ASN N A 8 ASN CA A 8 ASN C 1.0 -180.0 -20.0 PHI 9 9 A 8 ASN C A 9 SER N A 9 SER CA A 9 SER C 1.0 -150.0 -90.0 PHI 10 10 A 9 SER C A 10 LYS N A 10 LYS CA A 10 LYS C 1.0 -150.0 -90.0 PHI 11 11 A 13 TYR C A 14 TRP N A 14 TRP CA A 14 TRP C 1.0 -150.0 -90.0 PHI 12 12 A 15 PHE C A 16 TYR N A 16 TYR CA A 16 TYR C 1.0 30.0 90.0 PHI 13 13 A 16 TYR C A 17 ARG N A 17 ARG CA A 17 ARG C 1.0 -150.0 -90.0 PHI 14 14 A 16 TYR C A 17 ARG N A 17 ARG CA A 17 ARG C 1.0 -154.5 -76.1 PHI 15 15 A 18 PRO C A 19 SER N A 19 SER CA A 19 SER C 1.0 -150.0 -90.0 PHI 16 16 A 18 PRO C A 19 SER N A 19 SER CA A 19 SER C 1.0 -173.2 -62.8 PHI 17 17 A 21 PRO C A 22 THR N A 22 THR CA A 22 THR C 1.0 -180.0 -20.0 PHI 18 18 A 23 ASP C A 24 ARG N A 24 ARG CA A 24 ARG C 1.0 -150.0 -90.0 PHI 19 19 A 23 ASP C A 24 ARG N A 24 ARG CA A 24 ARG C 1.0 -159.8 -61.4 PHI 20 20 A 26 TYR C A 27 THR N A 27 THR CA A 27 THR C 1.0 -150.0 -90.0 PHI 21 21 A 26 TYR C A 27 THR N A 27 THR CA A 27 THR C 1.0 -176.3 -86.6 PHI 22 22 A 28 GLY C A 29 SER N A 29 SER CA A 29 SER C 1.0 -150.0 -90.0 PHI 23 23 A 28 GLY C A 29 SER N A 29 SER CA A 29 SER C 1.0 -161.6 -107.5 PHI 24 24 A 31 ARG C A 32 TYR N A 32 TYR CA A 32 TYR C 1.0 -150.0 -90.0 PHI 25 25 A 31 ARG C A 32 TYR N A 32 TYR CA A 32 TYR C 1.0 -160.2 -83.1 PHI 26 26 A 33 PHE C A 34 LEU N A 34 LEU CA A 34 LEU C 1.0 -150.0 -90.0 PHI 27 27 A 36 THR C A 37 CYS N A 37 CYS CA A 37 CYS C 1.0 -150.0 -90.0 PHI 28 28 A 37 CYS C A 38 CYS N A 38 CYS CA A 38 CYS C 1.0 -150.0 -90.0 PHI 29 29 A 37 CYS C A 38 CYS N A 38 CYS CA A 38 CYS C 1.0 -127.8 -58.9 PHI 30 30 A 38 CYS C A 39 THR N A 39 THR CA A 39 THR C 1.0 -150.0 -90.0 PHI 31 31 A 38 CYS C A 39 THR N A 39 THR CA A 39 THR C 1.0 -146.4 -52.1 PHI 32 32 A 4 CYS N A 4 CYS CA A 4 CYS CB A 4 CYS SG 1.0 30.0 90.0 CHI1 33 33 A 6 CYS N A 6 CYS CA A 6 CYS CB A 6 CYS SG 1.0 -90.0 30.0 CHI1 34 34 A 9 SER N A 9 SER CA A 9 SER CB A 9 SER OG 1.0 -210.0 -150.0 CHI1 35 35 A 14 TRP N A 14 TRP CA A 14 TRP CB A 14 TRP CG 1.0 -90.0 -30.0 CHI1 36 36 A 16 TYR N A 16 TYR CA A 16 TYR CB A 16 TYR CG 1.0 -90.0 -30.0 CHI1 37 37 A 24 ARG N A 24 ARG CA A 24 ARG CB A 24 ARG CG 1.0 -90.0 -30.0 CHI1 38 38 A 26 TYR N A 26 TYR CA A 26 TYR CB A 26 TYR CG 1.0 -90.0 -30.0 CHI1 39 39 A 30 CYS N A 30 CYS CA A 30 CYS CB A 30 CYS SG 1.0 -90.0 -30.0 CHI1 40 40 A 32 TYR N A 32 TYR CA A 32 TYR CB A 32 TYR CG 1.0 -210.0 -150.0 CHI1 41 41 A 34 LEU N A 34 LEU CA A 34 LEU CB A 34 LEU CG 1.0 -90.0 -30.0 CHI1 42 42 A 37 CYS N A 37 CYS CA A 37 CYS CB A 37 CYS SG 1.0 -210.0 -150.0 CHI1 43 43 A 38 CYS N A 38 CYS CA A 38 CYS CB A 38 CYS SG 1.0 -90.0 -30.0 CHI1 44 44 A 4 CYS N A 4 CYS CA A 4 CYS C A 5 SER N 1.0 103.5 170.4 PSI 45 45 A 5 SER N A 5 SER CA A 5 SER C A 6 CYS N 1.0 99.1 169.2 PSI 46 46 A 14 TRP C A 15 PHE N A 15 PHE CA A 15 PHE C 1.0 -108.0 -40.0 PHI 47 47 A 17 ARG N A 17 ARG CA A 17 ARG C A 18 PRO N 1.0 58.7 193.0 PSI 48 48 A 19 SER N A 19 SER CA A 19 SER C A 20 CYS N 1.0 91.1 174.9 PSI 49 49 A 19 SER C A 20 CYS N A 20 CYS CA A 20 CYS C 1.0 -130.1 -26.0 PHI 50 50 A 20 CYS N A 20 CYS CA A 20 CYS C A 21 PRO N 1.0 71.5 198.0 PSI 51 51 A 21 PRO N A 21 PRO CA A 21 PRO C A 22 THR N 1.0 141.6 167.6 PSI 52 52 A 22 THR C A 23 ASP N A 23 ASP CA A 23 ASP C 1.0 -147.9 -55.2 PHI 53 53 A 23 ASP N A 23 ASP CA A 23 ASP C A 24 ARG N 1.0 -48.3 52.4 PSI 54 54 A 24 ARG N A 24 ARG CA A 24 ARG C A 25 GLY N 1.0 88.7 194.4 PSI 55 55 A 25 GLY C A 26 TYR N A 26 TYR CA A 26 TYR C 1.0 -108.7 -66.8 PHI 56 56 A 26 TYR N A 26 TYR CA A 26 TYR C A 27 THR N 1.0 80.0 166.2 PSI 57 57 A 29 SER N A 29 SER CA A 29 SER C A 30 CYS N 1.0 103.3 177.9 PSI 58 58 A 29 SER C A 30 CYS N A 30 CYS CA A 30 CYS C 1.0 -127.6 -60.6 PHI 59 59 A 30 CYS N A 30 CYS CA A 30 CYS C A 31 ARG N 1.0 79.7 155.7 PSI 60 60 A 32 TYR N A 32 TYR CA A 32 TYR C A 33 PHE N 1.0 109.0 188.9 PSI 61 61 A 32 TYR C A 33 PHE N A 33 PHE CA A 33 PHE C 1.0 -94.4 -55.6 PHI 62 62 A 38 CYS N A 38 CYS CA A 38 CYS C A 39 THR N 1.0 80.1 173.4 PSI 63 63 A 40 PRO N A 40 PRO CA A 40 PRO C A 41 ALA N 1.0 125.0 178.9 PSI 64 64 A 40 PRO C A 41 ALA N A 41 ALA CA A 41 ALA C 1.0 -79.0 -47.0 PHI stop_ save_