data_nef_c25569_2n1o 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 2N1O 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 2 2 ILE C 2 3 SEP N 2 3 SEP C 2 4 PRO N 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 7 LEU start . . 2 A 8 PRO middle . false 3 A 9 PRO middle . false 4 A 10 GLY middle . false 5 A 11 TRP middle . . 6 A 12 GLU middle . . 7 A 13 LYS middle . . 8 A 14 ARG middle . . 9 A 15 MET middle . . 10 A 16 SER middle . . 11 A 17 ARG middle . . 12 A 18 SER middle . . 13 A 19 SER middle . . 14 A 20 GLY middle . false 15 A 21 ARG middle . . 16 A 22 VAL middle . . 17 A 23 TYR middle . . 18 A 24 TYR middle . . 19 A 25 PHE middle . . 20 A 26 ASN middle . . 21 A 27 HIS middle . . 22 A 28 ILE middle . . 23 A 29 THR middle . . 24 A 30 ASN middle . . 25 A 31 ALA middle . . 26 A 32 SER middle . . 27 A 33 GLN middle . . 28 A 34 TRP middle . . 29 A 35 GLU middle . . 30 A 36 ARG middle . . 31 A 37 PRO middle . false 32 A 38 SER middle . . 33 A 39 GLY end . false 34 B 208 ARG start . . 35 B 209 ILE middle . . 36 B 210 SEP middle . . 37 B 211 PRO middle . false 38 B 212 PRO middle . false 39 B 213 LEU middle . . 40 B 214 PRO middle . false 41 B 215 PHE 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 7 LEU HA H 1 4.390 0.001 A 7 LEU HBy H 1 1.607 0.001 A 7 LEU HBx H 1 1.555 0.01 A 7 LEU HDx% H 1 0.869 0.002 A 7 LEU HDy% H 1 0.560 0.002 A 7 LEU HG H 1 1.196 0.01 A 8 PRO HA H 1 4.610 0.01 A 8 PRO HBy H 1 2.366 0.001 A 8 PRO HBx H 1 1.556 0.01 A 8 PRO HDy H 1 3.454 0.01 A 8 PRO HDx H 1 2.794 0.001 A 8 PRO HGx H 1 1.399 0.01 A 9 PRO HA H 1 4.158 0.002 A 9 PRO HBy H 1 1.930 0.01 A 9 PRO HBx H 1 1.828 0.01 A 9 PRO HDy H 1 3.695 0.01 A 9 PRO HDx H 1 3.420 0.01 A 9 PRO HGx H 1 1.645 0.01 A 10 GLY HAx H 1 3.064 0.01 A 10 GLY HAy H 1 3.777 0.002 A 11 TRP H H 1 7.151 0.01 A 11 TRP HA H 1 5.095 0.002 A 11 TRP HBy H 1 3.041 0.01 A 11 TRP HBx H 1 2.754 0.01 A 11 TRP HD1 H 1 6.754 0.01 A 11 TRP HE3 H 1 7.189 0.01 A 11 TRP HH2 H 1 6.776 0.01 A 11 TRP HZ2 H 1 7.213 0.001 A 11 TRP HZ3 H 1 6.689 0.001 A 12 GLU HA H 1 4.641 0.01 A 12 GLU HBy H 1 2.033 0.002 A 12 GLU HBx H 1 1.996 0.01 A 12 GLU HGy H 1 2.333 0.01 A 12 GLU HGx H 1 2.293 0.01 A 13 LYS HA H 1 4.318 0.01 A 13 LYS HBy H 1 1.479 0.01 A 13 LYS HBx H 1 1.412 0.001 A 13 LYS HDx H 1 1.009 0.001 A 13 LYS HEx H 1 2.737 0.001 A 13 LYS HGx H 1 0.864 0.001 A 14 ARG HA H 1 4.104 0.01 A 14 ARG HBy H 1 1.141 0.001 A 14 ARG HBx H 1 1.008 0.001 A 14 ARG HDy H 1 2.612 0.01 A 14 ARG HDx H 1 2.473 0.01 A 14 ARG HE H 1 6.657 0.01 A 14 ARG HGy H 1 -0.154 0.01 A 14 ARG HGx H 1 -0.178 0.004 A 14 ARG HH2x H 1 6.213 0.004 A 15 MET HA H 1 4.674 0.01 A 15 MET HBy H 1 1.518 0.162 A 15 MET HBx H 1 0.986 0.01 A 15 MET HGy H 1 2.224 0.01 A 15 MET HGx H 1 1.749 0.01 A 16 SER HA H 1 4.856 0.002 A 16 SER HBy H 1 4.133 0.003 A 16 SER HBx H 1 4.123 0.01 A 17 ARG HA H 1 4.002 0.01 A 17 ARG HBy H 1 1.758 0.002 A 17 ARG HBx H 1 1.721 0.001 A 17 ARG HDy H 1 3.063 0.01 A 17 ARG HDx H 1 2.941 0.004 A 17 ARG HGx H 1 1.617 0.01 A 18 SER HA H 1 4.526 0.01 A 18 SER HBy H 1 3.734 0.01 A 18 SER HBx H 1 3.610 0.01 A 19 SER HA H 1 4.163 0.002 A 19 SER HBy H 1 3.697 0.001 A 19 SER HBx H 1 3.675 0.002 A 20 GLY HAx H 1 3.734 0.01 A 20 GLY HAy H 1 3.900 0.002 A 21 ARG HA H 1 4.229 0.01 A 21 ARG HBy H 1 1.509 0.01 A 21 ARG HBx H 1 1.351 0.01 A 21 ARG HDy H 1 2.422 0.01 A 21 ARG HDx H 1 2.214 0.01 A 21 ARG HE H 1 6.731 0.01 A 21 ARG HGx H 1 1.686 0.01 A 21 ARG HH2y H 1 6.899 0.01 A 22 VAL HA H 1 4.461 0.01 A 22 VAL HB H 1 1.765 0.001 A 22 VAL HGx% H 1 0.804 0.01 A 22 VAL HGy% H 1 0.590 0.001 A 23 TYR HA H 1 4.661 0.003 A 23 TYR HBy H 1 2.613 0.001 A 23 TYR HBx H 1 2.270 0.002 A 23 TYR HDx H 1 6.608 0.01 A 23 TYR HEx H 1 6.204 0.01 A 24 TYR HA H 1 5.082 0.001 A 24 TYR HBy H 1 2.744 0.01 A 24 TYR HBx H 1 2.465 0.003 A 24 TYR HDy H 1 6.637 0.01 A 24 TYR HEy H 1 6.552 0.01 A 25 PHE HA H 1 5.386 0.001 A 25 PHE HBy H 1 2.700 0.001 A 25 PHE HBx H 1 2.360 0.01 A 25 PHE HDx H 1 6.683 0.01 A 25 PHE HEx H 1 6.750 0.01 A 25 PHE HZ H 1 7.069 0.01 A 26 ASN H H 1 7.910 0.01 A 26 ASN HA H 1 4.167 0.002 A 26 ASN HBy H 1 1.758 0.005 A 26 ASN HBx H 1 -0.919 0.001 A 26 ASN HD2y H 1 3.944 0.01 A 27 HIS HA H 1 3.854 0.001 A 27 HIS HBy H 1 3.049 0.001 A 27 HIS HBx H 1 2.799 0.01 A 27 HIS HD2 H 1 6.742 0.002 A 27 HIS HE1 H 1 7.612 0.002 A 28 ILE HA H 1 3.603 0.01 A 28 ILE HB H 1 1.778 0.01 A 28 ILE HD1% H 1 0.543 0.01 A 28 ILE HG1y H 1 1.063 0.01 A 28 ILE HG1x H 1 0.760 0.01 A 28 ILE HG2% H 1 0.503 0.001 A 29 THR H H 1 7.179 0.01 A 29 THR HA H 1 3.859 0.001 A 29 THR HB H 1 3.998 0.001 A 29 THR HG1 H 1 1.287 0.01 A 29 THR HG2% H 1 0.702 0.002 A 30 ASN HA H 1 3.910 0.01 A 30 ASN HBy H 1 2.862 0.01 A 30 ASN HBx H 1 2.695 0.01 A 30 ASN HD2y H 1 7.224 0.01 A 30 ASN HD2x H 1 6.618 0.001 A 31 ALA HA H 1 4.181 0.001 A 31 ALA HB% H 1 1.005 0.002 A 32 SER H H 1 8.063 0.01 A 32 SER HA H 1 5.762 0.001 A 32 SER HBy H 1 3.708 0.01 A 32 SER HBx H 1 3.568 0.01 A 33 GLN HA H 1 4.667 0.01 A 33 GLN HBx H 1 2.037 0.002 A 33 GLN HGx H 1 2.501 0.01 A 33 GLN HGy H 1 2.753 0.946 A 34 TRP HA H 1 4.664 0.01 A 34 TRP HBy H 1 3.375 0.001 A 34 TRP HBx H 1 2.964 0.01 A 34 TRP HD1 H 1 7.242 0.01 A 34 TRP HE3 H 1 8.010 0.01 A 34 TRP HH2 H 1 6.901 0.01 A 34 TRP HZ2 H 1 7.099 0.01 A 34 TRP HZ3 H 1 6.726 0.001 A 35 GLU HA H 1 4.125 0.01 A 35 GLU HBy H 1 1.684 0.01 A 35 GLU HBx H 1 1.602 0.01 A 35 GLU HGy H 1 2.123 0.01 A 35 GLU HGx H 1 2.053 0.01 A 36 ARG HA H 1 2.466 0.01 A 36 ARG HBy H 1 1.136 0.001 A 36 ARG HBx H 1 0.965 0.01 A 36 ARG HDx H 1 2.770 0.01 A 36 ARG HE H 1 7.058 0.01 A 36 ARG HGy H 1 0.671 0.01 A 36 ARG HGx H 1 0.553 0.01 A 37 PRO HA H 1 3.666 0.01 A 37 PRO HBy H 1 0.565 0.01 A 37 PRO HBx H 1 0.467 0.01 A 37 PRO HDy H 1 2.264 0.01 A 37 PRO HDx H 1 2.051 0.001 A 37 PRO HGy H 1 0.313 0.01 A 37 PRO HGx H 1 -0.323 0.01 A 38 SER HA H 1 4.098 0.01 A 38 SER HBy H 1 3.575 0.01 A 38 SER HBx H 1 3.473 0.011 B 208 ARG HA H 1 4.220 0.003 B 208 ARG HBy H 1 1.866 0.003 B 208 ARG HBx H 1 1.809 0.001 B 208 ARG HDy H 1 2.404 0.001 B 208 ARG HDx H 1 2.336 0.001 B 208 ARG HGx H 1 1.720 0.001 B 209 ILE HA H 1 4.010 0.01 B 209 ILE HB H 1 1.597 0.002 B 209 ILE HD1% H 1 0.594 0.01 B 209 ILE HG1y H 1 1.227 0.01 B 209 ILE HG1x H 1 0.925 0.01 B 209 ILE HG2% H 1 0.646 0.01 B 210 SEP HA H 1 4.344 0.001 B 210 SEP HBy H 1 3.742 0.002 B 210 SEP HBx H 1 3.627 0.003 B 211 PRO HA H 1 4.419 0.001 B 211 PRO HBy H 1 2.063 0.01 B 211 PRO HBx H 1 1.643 0.002 B 211 PRO HDy H 1 3.581 0.001 B 211 PRO HDx H 1 3.382 0.001 B 211 PRO HGx H 1 1.557 0.001 B 211 PRO HGy H 1 1.734 0.002 B 212 PRO HA H 1 4.193 0.001 B 212 PRO HBy H 1 2.063 0.01 B 212 PRO HBx H 1 1.776 0.001 B 212 PRO HDy H 1 3.577 0.01 B 212 PRO HDx H 1 3.386 0.005 B 212 PRO HGy H 1 1.785 0.01 B 212 PRO HGx H 1 1.577 0.01 B 213 LEU HA H 1 4.335 0.001 B 213 LEU HBy H 1 1.486 0.012 B 213 LEU HBx H 1 1.344 0.005 B 213 LEU HDx% H 1 0.696 0.007 B 213 LEU HDy% H 1 0.674 0.01 B 213 LEU HG H 1 1.260 0.003 B 214 PRO HA H 1 4.113 0.01 B 214 PRO HBx H 1 1.971 0.001 B 214 PRO HDy H 1 3.581 0.001 B 214 PRO HDx H 1 3.384 0.001 B 214 PRO HGy H 1 1.748 0.001 B 214 PRO HGx H 1 1.541 0.002 B 215 PHE HA H 1 4.268 0.003 B 215 PHE HBy H 1 2.909 0.01 B 215 PHE HBx H 1 2.869 0.01 B 215 PHE HDy H 1 7.037 0.001 B 215 PHE HEy H 1 7.145 0.01 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-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 36 ARG HA A 37 PRO HDy 1.0 1.96781538462 5.08658461538 2 2 A 36 ARG HA A 37 PRO HDx 1.0 1.87938461538 4.40861538462 3 3 A 28 ILE HB A 29 THR H 1.0 2.05555384615 5.75924615385 4 4 A 25 PHE HA A 32 SER HA 1.0 1.88289230769 4.43550769231 5 5 A 32 SER HA A 25 PHE HE% 1.0 2.05165384615 5.72934615385 6 6 A 7 LEU HDy% A 24 TYR HD% 1.0 2.07216923077 5.88663076923 7 7 A 7 LEU HDy% A 24 TYR HE% 1.0 2.05871538462 5.78348461538 8 8 A 24 TYR HD% A 36 ARG HBy 1.0 2.06471538462 5.82948461538 9 9 A 24 TYR HD% A 36 ARG HBy 1.0 2.06471538462 5.82948461538 10 10 A 27 HIS HBx A 25 PHE HZ 1.0 2.01090000000 5.41690000000 11 11 A 25 PHE HE% A 27 HIS HBx 1.0 1.90638461538 4.61561538462 12 12 A 25 PHE HE% A 27 HIS HBy 1.0 1.90866923077 4.63313076923 13 13 A 14 ARG HBx A 23 TYR HE% 1.0 2.05130769231 5.72669230769 14 14 A 14 ARG HBx A 23 TYR HE% 1.0 2.05130769231 5.72669230769 15 15 A 25 PHE HBy A 23 TYR HD% 1.0 2.06727692308 5.84912307692 16 16 A 23 TYR HE% A 25 PHE HBy 1.0 2.06088461538 5.80011538462 17 17 A 23 TYR HE% A 25 PHE HBx 1.0 2.06766923077 5.85213076923 18 18 A 23 TYR HE% A 32 SER HBy 1.0 2.05103076923 5.72456923077 19 19 A 23 TYR HD% A 32 SER HBy 1.0 2.04006923077 5.64053076923 20 20 A 23 TYR HE% A 32 SER HBx 1.0 2.06432307692 5.82647692308 21 21 A 23 TYR HD% A 32 SER HBx 1.0 2.03820000000 5.62620000000 22 22 A 32 SER HA A 25 PHE HD% 1.0 1.99172307692 5.26987692308 23 23 A 25 PHE HE% A 23 TYR HE% 1.0 2.11137692308 6.18722307692 24 24 A 24 TYR HD% A 11 TRP HBx 1.0 1.96726153846 5.08233846154 25 25 A 24 TYR HE% A 11 TRP HBx 1.0 1.97940000000 5.17540000000 26 26 A 24 TYR HD% A 13 LYS HGx 1.0 1.93564615385 4.83995384615 27 27 A 24 TYR HD% A 13 LYS HBx 1.0 2.06706923077 5.84753076923 28 28 A 24 TYR HD% A 13 LYS HBy 1.0 2.02280769231 5.50819230769 29 29 A 24 TYR HE% A 13 LYS HBx 1.0 2.04786923077 5.70033076923 30 30 A 24 TYR HE% A 13 LYS HGx 1.0 1.93624615385 4.84455384615 31 31 A 26 ASN HBx A 11 TRP HH2 1.0 2.44663846154 8.75756153846 32 32 A 26 ASN HBx A 11 TRP HZ2 1.0 2.46297692308 8.88282307692 33 33 A 26 ASN HBx A 11 TRP HZ3 1.0 2.40930000000 8.47130000000 34 34 A 37 PRO HBx A 11 TRP HD1 1.0 2.04770769231 5.69909230769 35 35 A 11 TRP HH2 A 37 PRO HBy 1.0 1.99686923077 5.30933076923 36 36 A 24 TYR HD% A 33 GLN HBx 1.0 2.02682307692 5.53897692308 37 37 A 36 ARG HA A 24 TYR HE% 1.0 2.02266923077 5.50713076923 38 38 A 37 PRO HDy A 24 TYR HE% 1.0 2.08255384615 5.96624615385 39 39 A 37 PRO HDy A 24 TYR HD% 1.0 2.03771538462 5.62248461538 40 40 A 24 TYR HD% A 36 ARG HGy 1.0 2.06826923077 5.85673076923 41 41 A 24 TYR HE% A 36 ARG HGy 1.0 2.06106923077 5.80153076923 42 42 B 213 LEU HBy A 34 TRP HE3 1.0 2.05253076923 5.73606923077 43 43 A 25 PHE HE% A 12 GLU HGx 1.0 2.08848461538 6.01171538462 44 44 A 25 PHE HD% A 12 GLU HBy 1.0 1.98597692308 5.22582307692 45 45 A 24 TYR HE% A 36 ARG HBy 1.0 2.03663076923 5.61416923077 46 46 A 25 PHE HE% A 32 SER HBx 1.0 2.03976923077 5.63823076923 47 47 A 25 PHE HE% A 32 SER HBy 1.0 1.99204615385 5.27235384615 48 48 A 23 TYR HE% B 209 ILE HB 1.0 2.08186153846 5.96093846154 49 49 A 7 LEU HDx% A 11 TRP HE3 1.0 2.12070000000 6.25870000000 50 50 A 7 LEU HDy% A 11 TRP HE3 1.0 2.12081538462 6.25958461538 51 51 A 23 TYR HD% A 16 SER HBy 1.0 1.99036153846 5.25943846154 52 52 A 23 TYR HD% A 16 SER HA 1.0 2.03787692308 5.62372307692 53 53 A 13 LYS HA A 24 TYR HA 1.0 1.92117692308 4.72902307692 54 54 A 7 LEU HDx% A 37 PRO HGy 1.0 2.10874615385 6.16705384615 55 55 A 11 TRP HBx A 37 PRO HGx 1.0 2.04701538462 5.69378461538 56 56 A 25 PHE HD% A 12 GLU HGy 1.0 2.00623846154 5.38116153846 57 57 A 23 TYR HE% A 16 SER HA 1.0 1.95270000000 4.97070000000 58 58 A 23 TYR HD% A 16 SER HBx 1.0 2.01103846154 5.41796153846 59 59 A 25 PHE HZ A 30 ASN HA 1.0 1.83272307692 4.05087692308 60 60 A 25 PHE HZ A 27 HIS HA 1.0 1.88720769231 4.46859230769 61 61 A 24 TYR HE% A 36 ARG HGx 1.0 1.96398461538 5.05721538462 62 62 A 24 TYR HD% A 36 ARG HGx 1.0 1.97780769231 5.16319230769 63 63 A 25 PHE HD% A 12 GLU HBx 1.0 2.02377692308 5.51562307692 64 64 A 32 SER HBx A 25 PHE HD% 1.0 2.03060769231 5.56799230769 65 65 A 32 SER HBy A 25 PHE HD% 1.0 1.99566923077 5.30013076923 66 66 A 11 TRP HH2 A 31 ALA HB% 1.0 1.97614615385 5.15045384615 67 67 A 11 TRP HD1 A 7 LEU HG 1.0 2.01660000000 5.46060000000 68 68 A 7 LEU HDx% A 11 TRP HBy 1.0 2.13396923077 6.36043076923 69 69 A 7 LEU HDy% A 11 TRP HBy 1.0 2.09208461538 6.03931538462 70 70 A 37 PRO HDx A 11 TRP HE3 1.0 2.04452307692 5.67467692308 71 71 A 11 TRP HA A 26 ASN HA 1.0 1.84550769231 4.14889230769 72 72 A 23 TYR HD% A 34 TRP HE3 1.0 2.07528461538 5.91051538462 73 73 A 26 ASN HBx A 11 TRP HH2 1.0 2.44663846154 8.75756153846 74 74 A 25 PHE HE% A 27 HIS HA 1.0 1.86062307692 4.26477692308 75 75 A 11 TRP HD1 A 7 LEU HDx% 1.0 2.06208461538 5.80931538462 76 76 A 7 LEU HDy% A 11 TRP HD1 1.0 2.00674615385 5.38505384615 77 77 A 7 LEU HA A 8 PRO HGx 1.0 1.99952307692 5.32967692308 78 78 A 21 ARG HBy A 34 TRP HH2 1.0 2.04175384615 5.65344615385 79 79 A 26 ASN HBx A 31 ALA HB% 1.0 2.03492307692 5.60107692308 80 80 A 36 ARG HA A 37 PRO HGx 1.0 2.08836923077 6.01083076923 81 81 A 25 PHE HZ A 27 HIS HD2 1.0 1.76243076923 3.51196923077 82 82 A 23 TYR HE% A 16 SER HBy 1.0 1.98066923077 5.18513076923 83 83 A 32 SER HA A 33 GLN HBx 1.0 2.04304615385 5.66335384615 84 84 B 213 LEU HBy A 34 TRP HD1 1.0 2.10507692308 6.13892307692 85 85 B 213 LEU HA B 214 PRO HDy 1.0 1.52230000000 2.52230000000 86 86 B 213 LEU HA B 214 PRO HDx 1.0 1.60200000000 2.60200000000 87 87 A 14 ARG HBx A 15 MET HA 1.0 2.32520769231 7.82659230769 88 88 A 34 TRP HBy B 213 LEU HG 1.0 1.78110000000 3.65510000000 89 89 B 214 PRO HDy B 213 LEU HG 1.0 1.84601538462 4.15278461538 90 90 A 37 PRO HDx A 36 ARG HBy 1.0 1.93290000000 4.81890000000 91 91 A 34 TRP HBy B 213 LEU HBx 1.0 1.85713846154 4.23806153846 92 92 B 214 PRO HDy B 213 LEU HBx 1.0 1.89302307692 4.51317692308 93 93 A 13 LYS HGx A 12 GLU HA 1.0 1.94976923077 4.94823076923 94 94 A 24 TYR HD% A 13 LYS HA 1.0 2.02407692308 5.51792307692 95 95 A 24 TYR HE% A 13 LYS HA 1.0 2.05855384615 5.78224615385 96 96 A 32 SER HA A 31 ALA HB% 1.0 2.08661538462 5.99738461538 97 97 A 32 SER HA A 31 ALA HA 1.0 2.03471538462 5.59948461538 98 98 A 11 TRP HA A 26 ASN HA 1.0 1.83683076923 4.08236923077 99 99 A 25 PHE HD% A 26 ASN HA 1.0 2.02089230769 5.49350769231 100 100 A 11 TRP HZ3 A 26 ASN HBy 1.0 1.95833076923 5.01386923077 101 101 A 14 ARG HBx A 25 PHE HD% 1.0 1.97870769231 5.17009230769 102 102 A 25 PHE HD% B 209 ILE HG2% 1.0 2.14230000000 6.42430000000 103 103 A 25 PHE HD% B 209 ILE HD1% 1.0 2.14866923077 6.47313076923 104 104 A 23 TYR HE% B 209 ILE HG2% 1.0 2.17781538462 6.69658461538 105 105 A 8 PRO HA A 9 PRO HDy 1.0 1.91665384615 4.69434615385 106 106 A 8 PRO HA A 9 PRO HDx 1.0 1.94886923077 4.94133076923 107 107 A 16 SER HBx A 34 TRP HH2 1.0 1.99652307692 5.30667692308 108 108 A 16 SER HBy A 34 TRP HH2 1.0 1.96525384615 5.06694615385 109 109 A 23 TYR HE% A 16 SER HBx 1.0 1.99776923077 5.31623076923 110 110 A 21 ARG HA A 22 VAL HGx% 1.0 2.10214615385 6.11645384615 111 111 A 21 ARG HA A 22 VAL HGy% 1.0 2.15974615385 6.55805384615 112 112 A 12 GLU HBy A 14 ARG HBy 1.0 1.94097692308 4.88082307692 113 113 A 14 ARG HBx A 12 GLU HBy 1.0 1.90160769231 4.57899230769 114 114 A 12 GLU HBx A 14 ARG HBy 1.0 1.99495384615 5.29464615385 115 115 A 33 GLN HBx A 24 TYR HBy 1.0 1.93080000000 4.80280000000 116 116 A 25 PHE HD% A 30 ASN HA 1.0 1.99963846154 5.33056153846 117 117 A 25 PHE HD% A 27 HIS HA 1.0 1.97150769231 5.11489230769 118 118 A 11 TRP HD1 A 10 GLY HAy 1.0 1.98687692308 5.23272307692 119 119 A 11 TRP HD1 A 26 ASN HBy 1.0 1.83249230769 4.04910769231 120 120 A 25 PHE HE% B 209 ILE HG2% 1.0 2.12310000000 6.27710000000 121 121 A 11 TRP HD1 A 28 ILE HG1y 1.0 1.95173076923 4.96326923077 122 122 B 214 PRO HBx B 215 PHE HD% 1.0 2.07318461538 5.89441538462 123 123 B 215 PHE HD% B 214 PRO HGy 1.0 2.00709230769 5.38770769231 124 124 A 7 LEU HA A 8 PRO HDy 1.0 2.04094615385 5.64725384615 125 125 B 213 LEU HBx A 34 TRP HBx 1.0 1.82100000000 3.96100000000 126 126 B 211 PRO HA B 212 PRO HDy 1.0 1.25000000000 2.25000000000 127 127 B 211 PRO HA B 212 PRO HDx 1.0 1.34960000000 2.34960000000 128 128 A 34 TRP HD1 B 213 LEU HDy% 1.0 2.12386153846 6.28293846154 129 129 A 34 TRP HZ2 B 213 LEU HDy% 1.0 2.01420000000 5.44220000000 130 130 A 34 TRP HH2 B 213 LEU HDy% 1.0 2.13226153846 6.34733846154 131 131 A 23 TYR HE% B 209 ILE HD1% 1.0 2.17356923077 6.66403076923 132 132 A 25 PHE HE% A 30 ASN HA 1.0 1.90430769231 4.59969230769 133 133 A 23 TYR HD% B 211 PRO HDx 1.0 2.13526153846 6.37033846154 134 134 A 23 TYR HD% B 211 PRO HDx 1.0 2.13526153846 6.37033846154 135 135 A 23 TYR HD% B 211 PRO HGx 1.0 2.08599230769 5.99260769231 136 136 A 23 TYR HD% B 211 PRO HGy 1.0 2.07646153846 5.91953846154 137 137 B 211 PRO HA B 212 PRO HGy 1.0 1.77039230769 3.57300769231 138 138 A 23 TYR HD% B 211 PRO HBx 1.0 2.06907692308 5.86292307692 139 139 A 11 TRP HZ2 A 37 PRO HBx 1.0 2.08391538462 5.97668461538 140 140 A 11 TRP HZ2 A 37 PRO HBy 1.0 2.04420000000 5.67220000000 141 141 A 7 LEU HDy% A 38 SER HBx 1.0 2.04701538462 5.69378461538 142 142 B 214 PRO HDx B 213 LEU HG 1.0 1.78576153846 3.69083846154 143 143 A 22 VAL HGx% A 15 MET HGy 1.0 2.07235384615 5.88804615385 144 144 A 34 TRP HBy B 213 LEU HDy% 1.0 1.89976153846 4.56483846154 145 145 B 213 LEU HBx A 35 GLU HBx 1.0 1.72345384615 3.21314615385 146 146 A 23 TYR HE% A 25 PHE HD% 1.0 2.07182307692 5.88397692308 147 147 A 26 ASN HBx A 11 TRP HA 1.0 2.43886153846 8.69793846154 148 148 A 11 TRP HZ2 A 26 ASN HBy 1.0 2.01410769231 5.44149230769 149 149 A 25 PHE HA A 32 SER HBy 1.0 2.02661538462 5.53738461538 150 150 A 25 PHE HA A 32 SER HBx 1.0 2.06106923077 5.80153076923 151 151 A 32 SER HA A 25 PHE HBy 1.0 2.03487692308 5.60072307692 152 152 A 25 PHE HA A 14 ARG HBx 1.0 2.00363076923 5.36116923077 153 153 A 33 GLN HBx A 24 TYR HBx 1.0 1.90866923077 4.63313076923 154 154 A 34 TRP HD1 B 213 LEU HDx% 1.0 2.13470769231 6.36609230769 155 155 A 34 TRP HH2 B 213 LEU HDx% 1.0 2.14781538462 6.46658461538 156 156 B 213 LEU HDx% B 215 PHE HE% 1.0 2.09277692308 6.04462307692 157 157 B 213 LEU HDx% B 215 PHE HE% 1.0 2.10819230769 6.16280769231 158 158 B 215 PHE HD% B 213 LEU HDx% 1.0 2.10694615385 6.15325384615 159 159 B 215 PHE HD% B 213 LEU HDy% 1.0 2.14084615385 6.41315384615 160 160 A 34 TRP HE3 A 23 TYR HBx 1.0 2.04821538462 5.70298461538 161 161 A 34 TRP HE3 A 23 TYR HBy 1.0 2.05287692308 5.73872307692 162 162 A 34 TRP HE3 A 16 SER HBy 1.0 2.06949230769 5.86610769231 163 163 B 211 PRO HA B 212 PRO HA 1.0 1.95406153846 4.98113846154 164 164 B 213 LEU HA B 212 PRO HA 1.0 1.98793846154 5.24086153846 165 165 B 214 PRO HBx B 215 PHE HE% 1.0 2.11996153846 6.25303846154 166 166 B 214 PRO HGy B 215 PHE HE% 1.0 2.04175384615 5.65344615385 167 167 B 215 PHE HE% B 214 PRO HGx 1.0 2.07930000000 5.94130000000 168 168 B 215 PHE HD% B 214 PRO HGx 1.0 2.04526153846 5.68033846154 169 169 B 213 LEU HBx B 215 PHE HE% 1.0 2.12949230769 6.32610769231 170 170 B 213 LEU HBx B 215 PHE HD% 1.0 2.11696153846 6.23003846154 171 171 B 213 LEU HG B 215 PHE HD% 1.0 2.11541538462 6.21818461538 172 172 B 214 PRO HDx B 215 PHE HE% 1.0 2.09614615385 6.07045384615 173 173 B 214 PRO HDy B 215 PHE HE% 1.0 2.07424615385 5.90255384615 174 174 B 214 PRO HDx B 215 PHE HD% 1.0 2.08811538462 6.00888461538 175 175 B 214 PRO HDy B 215 PHE HD% 1.0 2.03912307692 5.63327692308 176 176 A 34 TRP HE3 A 23 TYR HA 1.0 2.05864615385 5.78295384615 177 177 A 11 TRP HE3 A 26 ASN HA 1.0 1.96451538462 5.06128461538 178 178 A 34 TRP HD1 B 211 PRO HGy 1.0 2.02183846154 5.50076153846 179 179 A 34 TRP HD1 B 211 PRO HBx 1.0 2.04586153846 5.68493846154 180 180 A 34 TRP HD1 B 211 PRO HGx 1.0 2.04669230769 5.69130769231 181 181 A 34 TRP HZ2 B 211 PRO HGx 1.0 1.97755384615 5.16124615385 182 182 A 34 TRP HZ2 B 211 PRO HBx 1.0 2.02920000000 5.55720000000 183 183 A 23 TYR HE% B 211 PRO HGx 1.0 2.11151538462 6.18828461538 184 184 A 23 TYR HE% B 211 PRO HBx 1.0 2.11511538462 6.21588461538 185 185 A 11 TRP HD1 A 8 PRO HA 1.0 1.97986153846 5.17893846154 186 186 A 11 TRP HD1 A 7 LEU HA 1.0 2.02435384615 5.52004615385 187 187 A 8 PRO HA A 9 PRO HA 1.0 1.99800000000 5.31800000000 188 188 A 23 TYR HE% A 14 ARG HGx 1.0 2.10180000000 6.11380000000 189 189 A 23 TYR HE% A 14 ARG HBy 1.0 2.11271538462 6.19748461538 190 190 A 24 TYR HD% A 22 VAL HB 1.0 2.05052307692 5.72067692308 191 191 A 32 SER HA A 23 TYR HE% 1.0 2.12173846154 6.26666153846 192 192 A 34 TRP HZ2 B 212 PRO HA 1.0 2.04240000000 5.65840000000 193 193 A 34 TRP HZ2 B 211 PRO HDy 1.0 1.99460769231 5.29199230769 194 194 A 34 TRP HZ2 B 211 PRO HDx 1.0 2.03905384615 5.63274615385 195 195 A 34 TRP HD1 B 211 PRO HDy 1.0 2.02689230769 5.53950769231 196 196 A 24 TYR HD% A 13 LYS HEx 1.0 1.95087692308 4.95672307692 197 197 A 24 TYR HE% A 13 LYS HEx 1.0 1.97981538462 5.17858461538 198 198 A 24 TYR HA A 13 LYS HEx 1.0 1.90292307692 4.58907692308 199 199 A 24 TYR HE% A 13 LYS HDx 1.0 2.02170000000 5.49970000000 200 200 A 24 TYR HD% A 13 LYS HDx 1.0 2.02696153846 5.54003846154 201 201 A 11 TRP HZ2 A 31 ALA HB% 1.0 2.00443846154 5.36736153846 202 202 A 25 PHE HE% B 209 ILE HD1% 1.0 2.09432307692 6.05647692308 203 203 A 25 PHE HA A 23 TYR HE% 1.0 2.10648461538 6.14971538462 204 204 A 33 GLN HBx A 24 TYR HA 1.0 2.01646153846 5.45953846154 205 205 A 13 LYS HBx A 24 TYR HA 1.0 2.05412307692 5.74827692308 206 206 A 24 TYR HA A 13 LYS HDx 1.0 1.97432307692 5.13647692308 207 207 A 13 LYS HGx A 24 TYR HA 1.0 1.95306923077 4.97353076923 208 208 A 19 SER HA A 20 GLY HAy 1.0 2.01858461538 5.47581538462 209 209 A 31 ALA HB% A 29 THR HB 1.0 2.03067692308 5.56852307692 210 210 A 9 PRO HDy A 8 PRO HBy 1.0 2.02818461538 5.54941538462 211 211 A 26 ASN HBx A 11 TRP HA 1.0 2.01090000000 5.41690000000 212 212 A 32 SER HA A 31 ALA HA 1.0 2.04923076923 5.71076923077 213 213 A 8 PRO HA A 9 PRO HGx 1.0 2.01230769231 5.42769230769 214 214 A 7 LEU HDx% A 38 SER HBx 1.0 2.16246923077 6.57893076923 215 215 A 29 THR HA A 28 ILE HD1% 1.0 1.96389230769 5.05650769231 216 216 A 29 THR HB A 28 ILE HD1% 1.0 2.00190000000 5.34790000000 217 217 A 25 PHE HD% B 209 ILE HB 1.0 2.08728461538 6.00251538462 218 218 A 16 SER HA A 17 ARG HBy 1.0 2.05682307692 5.76897692308 219 219 A 34 TRP HBy A 23 TYR HBx 1.0 1.95542307692 4.99157692308 stop_ save_