data_SASDAW6_MAIN # _sas_result.id 157 _sas_result.SASBDB_code SASDAW6 _sas_result.experimental_MW 14.000 _sas_result.experimental_MW_error . _sas_result.MW_standard 14.000 _sas_result.MW_standard_error . _sas_result.MW_Porod . _sas_result.MW_Porod_error . _sas_result.I0_from_PR 17.2000000000 _sas_result.I0_from_PR_error . _sas_result.I0_from_Guinier 17.2000000000 _sas_result.I0_from_Guinier_error . _sas_result.Rg_from_PR 1.860 _sas_result.Rg_from_PR_error . _sas_result.Rg_from_Guinier 1.870 _sas_result.Rg_from_Guinier_error 0.006 _sas_result.D_max 6.40 _sas_result.Porod_volume . _sas_result.Porod_volume_error . _sas_result.estimated_volume . _sas_result.estimated_volume_error . _sas_result.estimated_volume_method . _sas_result.Guinier_point_min 84 _sas_result.Guinier_point_max . _sas_result.type_of_curve single_conc _sas_result.standard . _sas_result.Dmax_error . _sas_result.comments ;Reduced levels of frataxin, an essential protein of as yet unknown function, are responsible for causing the neurodegenerative pathology Friedreich’s ataxia. Independent reports have linked frataxin to iron–sulphur cluster assembly through interactions with the two central components of this machinery: desulphurase Nfs1/IscS and the scaffold protein Isu/IscU. In this study, we use a combination of biophysical methods to define the structural bases of the interaction of CyaY (the bacterial orthologue of frataxin) with the IscS/IscU complex. We show that CyaY binds IscS as a monomer in a pocket between the active site and the IscS dimer interface. Recognition does not require iron and occurs through electrostatic interactions of complementary charged residues. Mutations at the complex interface affect the rates of enzymatic cluster formation. CyaY binding strengthens the affinity of the IscS/IscU complex. Our data suggest a new paradigm for understanding the role of frataxin as a regulator of IscS functions. ; # _sas_scan.title u _sas_scan.detc_id 1 _sas_scan.id 157 _sas_scan.measurement_date 2009-11-05 _sas_scan.storage_temperature 15.0 _sas_scan.cell_temperature 15.0 _sas_scan.exposure_time 30.000 _sas_scan.number_of_frames 4 _sas_scan.unit 1/nm _sas_scan.qmin 0.1521 _sas_scan.qmax 6.2370 _sas_scan.sample_id 113 _sas_scan.result_id 157 _sas_scan.beam_id 1 # _sas_beam.id 1 _sas_beam.instrument_name "DORIS III X33" _sas_beam.instrument_city Hamburg _sas_beam.instrument_country Germany _sas_beam.shape 0.60 _sas_beam.type_of_source "X-ray synchrotron" _sas_beam.radiation_wavelength 0.150000 _sas_beam.dist_spec_to_detc 2.70000 # _sas_detc.id 1 _sas_detc.name "Pilatus 1M-W" _sas_detc.type . _sas_detc.pixsize_x 0.172 # _sas_sample.id 113 _sas_sample.name "Iron-sulfur cluster assembly scaffold IscU monomer" _sas_sample.ext_coefficient . _sas_sample.contrast . _sas_sample.specific_vol . _sas_sample.purity_method . _sas_sample.dry_vol . _sas_sample.sample_MW . _sas_sample.specimen_concentration 2.50 _sas_sample.concentration_method . _sas_sample.entity_id 136 # _sas_buffer.id 53 _sas_buffer.name Tris-HCl _sas_buffer.concentration 20.00 _sas_buffer.unit mM _sas_buffer.pK . _sas_buffer.pH 8.000 _sas_buffer.comment . _sas_buffer.composition "150 mM NaCl and 10 mM β-mercaptoethanol" _sas_buffer.sample_id 113 # _entity.id 136 _entity.type protein _entity.pdbx_description "Iron-sulfur cluster assembly scaffold protein IscU" _entity.formula_weight 14.464 _entity.pdbx_number_of_molecules 1 # _entity_name_com.entity_id 136 _entity_name_com.name . # _entity_poly.entity_id 136 _entity_poly.pdbx_seq_one_letter_code ;MAYSEKVIDHYENPRNVGSLDKKDSNVGTGMVGAPACGDVMQLQIKVDDNGIIEDAKFKTYGCGSAIASSSLITEWVKGK SLEEAGAIKNSQIAEELELPPVKVHCSILAEDAIKAAIADYKAKQGLEHHHHHH ; # _entity_src_gen.entity_id 136 _entity_src_gen.gene_src_common_name "Escherichia coli" # _struct_ref.id 1 _struct_ref.entity_id 136 _struct_ref.db_name UniProt _struct_ref.db_code P0ACD4 _struct_ref.details http://www.uniprot.org/uniprot/P0ACD4 # _citation.id 93 _citation.title "Structural bases for the interaction of frataxin with the central components of iron-sulphur cluster assembly." _citation.year "2010 Oct 19" _citation.pdbx_database_id_DOI 10.1038/ncomms1097 _citation.pdbx_database_id_PubMed 20981023 _citation.journal_abbrev "Nat Commun" _citation.journal_volume 1 _citation.page_first 95 # loop_ _citation_author.citation_id _citation_author.ordinal _citation_author.name 93 1 "Prischi F" 93 2 "Konarev PV" 93 3 "Iannuzzi C" 93 4 "Pastore C" 93 5 "Adinolfi S" 93 6 "Martin SR" 93 7 "Svergun DI" # _pdbx_contact_author.id 9 _pdbx_contact_author.name_first Petr _pdbx_contact_author.name_last Konarev _pdbx_contact_author.role . _pdbx_contact_author.address_1 EMBL-Hamburg _pdbx_contact_author.address_2 "European Molecular Biology Laboratory (EMBL) - Hamburg outstation" _pdbx_contact_author.address_3 "Notkestraße 85, Geb. 25A, 22607 Hamburg, Deutschland, Germany" # loop_ _sas_scan_intensity.id _sas_scan_intensity.momentum_transfer _sas_scan_intensity.intensity _sas_scan_intensity.intensity_su_counting _sas_scan_intensity.scan_id 1 1.521480E-01 1.688270E+01 5.587460E-01 157 2 1.548150E-01 1.649160E+01 5.441430E-01 157 3 1.574830E-01 1.692060E+01 5.010370E-01 157 4 1.601510E-01 1.722890E+01 4.973160E-01 157 5 1.628180E-01 1.692610E+01 4.682500E-01 157 6 1.654860E-01 1.634360E+01 4.595370E-01 157 7 1.681540E-01 1.658890E+01 4.333030E-01 157 8 1.708210E-01 1.698870E+01 4.142500E-01 157 9 1.734890E-01 1.687260E+01 4.078740E-01 157 10 1.761560E-01 1.591830E+01 3.889920E-01 157 11 1.788240E-01 1.655780E+01 3.752980E-01 157 12 1.814920E-01 1.630800E+01 3.557050E-01 157 13 1.841590E-01 1.738710E+01 3.563080E-01 157 14 1.868270E-01 1.671800E+01 3.477480E-01 157 15 1.894950E-01 1.659610E+01 3.264550E-01 157 16 1.921620E-01 1.686500E+01 3.161470E-01 157 17 1.948300E-01 1.684350E+01 3.138210E-01 157 18 1.974980E-01 1.678160E+01 3.020230E-01 157 19 2.001650E-01 1.643360E+01 2.983870E-01 157 20 2.028330E-01 1.652830E+01 2.751540E-01 157 21 2.055000E-01 1.664150E+01 2.769050E-01 157 22 2.081680E-01 1.665920E+01 2.676700E-01 157 23 2.108360E-01 1.652040E+01 2.663510E-01 157 24 2.135030E-01 1.660400E+01 2.569240E-01 157 25 2.161710E-01 1.631230E+01 2.434080E-01 157 26 2.188390E-01 1.634950E+01 2.492240E-01 157 27 2.215060E-01 1.643390E+01 2.345470E-01 157 28 2.241740E-01 1.653480E+01 2.316230E-01 157 29 2.268410E-01 1.631950E+01 2.290540E-01 157 30 2.295090E-01 1.613630E+01 2.197010E-01 157 31 2.321770E-01 1.604710E+01 2.226420E-01 157 32 2.348440E-01 1.630430E+01 2.059720E-01 157 33 2.375120E-01 1.640120E+01 2.140270E-01 157 34 2.401800E-01 1.645390E+01 2.047040E-01 157 35 2.428470E-01 1.591990E+01 2.017020E-01 157 36 2.455150E-01 1.671270E+01 2.054460E-01 157 37 2.481820E-01 1.622730E+01 1.889100E-01 157 38 2.508500E-01 1.652190E+01 1.972850E-01 157 39 2.535180E-01 1.573730E+01 1.911010E-01 157 40 2.561850E-01 1.573740E+01 1.877100E-01 157 41 2.588530E-01 1.616080E+01 1.874180E-01 157 42 2.615210E-01 1.604590E+01 1.794050E-01 157 43 2.641880E-01 1.587280E+01 1.862280E-01 157 44 2.668560E-01 1.560630E+01 1.779530E-01 157 45 2.695230E-01 1.606930E+01 1.775360E-01 157 46 2.721910E-01 1.571360E+01 1.776310E-01 157 47 2.748590E-01 1.576590E+01 1.685330E-01 157 48 2.775260E-01 1.557880E+01 1.776930E-01 157 49 2.801940E-01 1.596490E+01 1.671730E-01 157 50 2.828620E-01 1.555630E+01 1.714080E-01 157 51 2.855290E-01 1.586830E+01 1.710340E-01 157 52 2.881970E-01 1.598690E+01 1.649650E-01 157 53 2.908640E-01 1.557760E+01 1.704800E-01 157 54 2.935320E-01 1.563610E+01 1.622160E-01 157 55 2.962000E-01 1.563880E+01 1.653240E-01 157 56 2.988670E-01 1.626960E+01 1.658340E-01 157 57 3.015350E-01 1.567360E+01 1.632430E-01 157 58 3.042030E-01 1.555120E+01 1.642970E-01 157 59 3.068700E-01 1.538850E+01 1.581090E-01 157 60 3.095380E-01 1.542630E+01 1.610930E-01 157 61 3.122060E-01 1.530720E+01 1.602840E-01 157 62 3.148730E-01 1.530780E+01 1.566580E-01 157 63 3.175410E-01 1.532760E+01 1.592100E-01 157 64 3.202080E-01 1.557890E+01 1.604310E-01 157 65 3.228760E-01 1.518870E+01 1.596590E-01 157 66 3.255440E-01 1.543020E+01 1.555390E-01 157 67 3.282110E-01 1.506000E+01 1.565990E-01 157 68 3.308790E-01 1.515760E+01 1.577590E-01 157 69 3.335470E-01 1.542260E+01 1.591350E-01 157 70 3.362140E-01 1.519480E+01 1.565340E-01 157 71 3.388820E-01 1.518960E+01 1.519880E-01 157 72 3.415490E-01 1.508730E+01 1.553810E-01 157 73 3.442170E-01 1.489520E+01 1.556160E-01 157 74 3.468850E-01 1.480050E+01 1.575600E-01 157 75 3.495520E-01 1.501490E+01 1.529720E-01 157 76 3.522200E-01 1.496230E+01 1.527620E-01 157 77 3.548880E-01 1.516370E+01 1.537180E-01 157 78 3.575550E-01 1.473530E+01 1.542550E-01 157 79 3.602230E-01 1.487560E+01 1.555770E-01 157 80 3.628900E-01 1.481710E+01 1.498780E-01 157 81 3.655580E-01 1.457050E+01 1.518120E-01 157 82 3.682260E-01 1.485820E+01 1.571100E-01 157 83 3.708930E-01 1.453660E+01 1.496790E-01 157 84 3.735610E-01 1.470240E+01 1.533070E-01 157 85 3.762290E-01 1.475100E+01 1.520380E-01 157 86 3.788960E-01 1.459970E+01 1.531860E-01 157 87 3.815640E-01 1.466600E+01 1.536080E-01 157 88 3.842310E-01 1.471210E+01 1.504770E-01 157 89 3.868990E-01 1.452030E+01 1.536040E-01 157 90 3.895670E-01 1.450580E+01 1.504560E-01 157 91 3.922340E-01 1.450620E+01 1.525480E-01 157 92 3.949020E-01 1.445710E+01 1.485730E-01 157 93 3.975700E-01 1.438130E+01 1.509500E-01 157 94 4.002370E-01 1.456490E+01 1.525430E-01 157 95 4.029050E-01 1.452200E+01 1.525900E-01 157 96 4.055720E-01 1.438850E+01 1.488470E-01 157 97 4.082400E-01 1.429070E+01 1.506400E-01 157 98 4.109080E-01 1.422780E+01 1.514640E-01 157 99 4.135750E-01 1.419180E+01 1.521560E-01 157 100 4.162430E-01 1.399690E+01 1.488300E-01 157 101 4.189110E-01 1.410040E+01 1.513660E-01 157 102 4.215780E-01 1.400810E+01 1.482930E-01 157 103 4.242460E-01 1.423450E+01 1.507660E-01 157 104 4.269130E-01 1.413470E+01 1.508750E-01 157 105 4.295810E-01 1.387900E+01 1.487620E-01 157 106 4.322490E-01 1.390970E+01 1.512630E-01 157 107 4.349160E-01 1.390760E+01 1.523510E-01 157 108 4.375840E-01 1.403770E+01 1.507520E-01 157 109 4.402520E-01 1.365880E+01 1.464410E-01 157 110 4.429190E-01 1.394710E+01 1.503340E-01 157 111 4.455870E-01 1.365150E+01 1.509300E-01 157 112 4.482550E-01 1.376770E+01 1.507690E-01 157 113 4.509220E-01 1.346180E+01 1.499960E-01 157 114 4.535900E-01 1.357640E+01 1.480920E-01 157 115 4.562570E-01 1.367130E+01 1.507800E-01 157 116 4.589250E-01 1.335490E+01 1.502010E-01 157 117 4.615930E-01 1.367890E+01 1.475030E-01 157 118 4.642600E-01 1.341020E+01 1.508560E-01 157 119 4.669280E-01 1.320780E+01 1.496800E-01 157 120 4.695960E-01 1.341500E+01 1.494980E-01 157 121 4.722630E-01 1.350270E+01 1.483270E-01 157 122 4.749310E-01 1.311770E+01 1.478960E-01 157 123 4.775980E-01 1.344910E+01 1.516390E-01 157 124 4.802660E-01 1.317360E+01 1.506060E-01 157 125 4.829340E-01 1.321680E+01 1.495450E-01 157 126 4.856010E-01 1.332540E+01 1.477850E-01 157 127 4.882690E-01 1.300900E+01 1.473710E-01 157 128 4.909370E-01 1.328620E+01 1.493650E-01 157 129 4.936040E-01 1.305950E+01 1.510670E-01 157 130 4.962720E-01 1.314170E+01 1.457320E-01 157 131 4.989390E-01 1.302220E+01 1.492390E-01 157 132 5.016070E-01 1.291080E+01 1.483090E-01 157 133 5.042750E-01 1.271040E+01 1.492170E-01 157 134 5.069420E-01 1.268260E+01 1.471850E-01 157 135 5.096100E-01 1.297200E+01 1.478360E-01 157 136 5.122780E-01 1.261500E+01 1.497760E-01 157 137 5.149450E-01 1.278000E+01 1.492710E-01 157 138 5.176130E-01 1.293970E+01 1.487950E-01 157 139 5.202800E-01 1.273310E+01 1.477850E-01 157 140 5.229480E-01 1.258610E+01 1.477640E-01 157 141 5.256160E-01 1.261430E+01 1.479930E-01 157 142 5.282830E-01 1.261410E+01 1.473800E-01 157 143 5.309510E-01 1.254190E+01 1.486860E-01 157 144 5.336190E-01 1.239700E+01 1.468640E-01 157 145 5.362860E-01 1.242700E+01 1.466050E-01 157 146 5.389540E-01 1.232660E+01 1.434040E-01 157 147 5.416210E-01 1.224610E+01 1.378670E-01 157 148 5.442890E-01 1.242610E+01 1.344500E-01 157 149 5.469570E-01 1.204740E+01 1.333260E-01 157 150 5.496240E-01 1.191200E+01 1.324920E-01 157 151 5.522920E-01 1.224700E+01 1.268630E-01 157 152 5.549600E-01 1.183860E+01 1.257040E-01 157 153 5.576270E-01 1.213840E+01 1.254910E-01 157 154 5.602950E-01 1.198240E+01 1.257000E-01 157 155 5.629630E-01 1.204050E+01 1.220500E-01 157 156 5.656300E-01 1.186710E+01 1.215190E-01 157 157 5.682980E-01 1.195690E+01 1.218960E-01 157 158 5.709650E-01 1.172900E+01 1.199920E-01 157 159 5.736330E-01 1.149200E+01 1.173890E-01 157 160 5.763010E-01 1.175300E+01 1.178470E-01 157 161 5.789680E-01 1.178920E+01 1.175400E-01 157 162 5.816360E-01 1.170310E+01 1.172270E-01 157 163 5.843040E-01 1.170250E+01 1.175400E-01 157 164 5.869710E-01 1.147110E+01 1.139680E-01 157 165 5.896390E-01 1.165150E+01 1.140760E-01 157 166 5.923060E-01 1.170050E+01 1.148210E-01 157 167 5.949740E-01 1.139440E+01 1.135940E-01 157 168 5.976420E-01 1.163360E+01 1.118750E-01 157 169 6.003090E-01 1.137520E+01 1.134220E-01 157 170 6.029770E-01 1.129950E+01 1.107830E-01 157 171 6.056450E-01 1.134060E+01 1.129670E-01 157 172 6.083120E-01 1.140230E+01 1.094220E-01 157 173 6.109800E-01 1.138890E+01 1.115670E-01 157 174 6.136470E-01 1.134500E+01 1.103870E-01 157 175 6.163150E-01 1.116240E+01 1.095830E-01 157 176 6.189830E-01 1.108100E+01 1.075280E-01 157 177 6.216500E-01 1.116630E+01 1.062930E-01 157 178 6.243180E-01 1.089340E+01 1.100250E-01 157 179 6.269860E-01 1.130640E+01 1.079750E-01 157 180 6.296530E-01 1.125330E+01 1.075820E-01 157 181 6.323210E-01 1.092880E+01 1.066990E-01 157 182 6.349880E-01 1.083030E+01 1.042200E-01 157 183 6.376560E-01 1.093930E+01 1.073990E-01 157 184 6.403240E-01 1.093630E+01 1.053200E-01 157 185 6.429910E-01 1.097870E+01 1.041420E-01 157 186 6.456590E-01 1.065950E+01 1.064490E-01 157 187 6.483270E-01 1.070390E+01 1.027170E-01 157 188 6.509940E-01 1.086560E+01 1.053150E-01 157 189 6.536620E-01 1.058890E+01 1.016360E-01 157 190 6.563290E-01 1.074160E+01 1.022350E-01 157 191 6.589970E-01 1.059720E+01 1.033220E-01 157 192 6.616650E-01 1.053970E+01 1.015020E-01 157 193 6.643320E-01 1.048660E+01 1.038830E-01 157 194 6.670000E-01 1.040580E+01 9.911760E-02 157 195 6.696680E-01 1.055840E+01 1.016370E-01 157 196 6.723350E-01 1.029200E+01 1.018810E-01 157 197 6.750030E-01 1.056830E+01 1.002840E-01 157 198 6.776710E-01 1.023350E+01 1.020550E-01 157 199 6.803380E-01 1.034910E+01 9.944780E-02 157 200 6.830060E-01 1.016000E+01 9.961340E-02 157 201 6.856730E-01 1.022980E+01 9.904150E-02 157 202 6.883410E-01 1.006040E+01 9.817210E-02 157 203 6.910090E-01 1.014600E+01 9.930010E-02 157 204 6.936760E-01 1.009890E+01 9.878210E-02 157 205 6.963440E-01 1.018590E+01 9.974710E-02 157 206 6.990120E-01 1.005090E+01 9.720100E-02 157 207 7.016790E-01 1.004340E+01 9.761580E-02 157 208 7.043470E-01 1.024110E+01 9.854360E-02 157 209 7.070140E-01 9.996090E+00 9.762300E-02 157 210 7.096820E-01 9.811650E+00 9.763620E-02 157 211 7.123500E-01 1.001200E+01 9.741960E-02 157 212 7.150170E-01 9.832830E+00 9.631980E-02 157 213 7.176850E-01 9.932190E+00 9.638780E-02 157 214 7.203530E-01 9.829940E+00 9.646030E-02 157 215 7.230200E-01 9.531640E+00 9.665700E-02 157 216 7.256880E-01 9.783000E+00 9.495310E-02 157 217 7.283550E-01 9.572340E+00 9.577460E-02 157 218 7.310230E-01 9.429550E+00 9.551780E-02 157 219 7.336910E-01 9.564860E+00 9.463940E-02 157 220 7.363580E-01 9.322380E+00 9.405440E-02 157 221 7.390260E-01 9.580100E+00 9.525720E-02 157 222 7.416940E-01 9.505910E+00 9.545120E-02 157 223 7.443610E-01 9.312210E+00 9.371480E-02 157 224 7.470290E-01 9.296400E+00 9.426830E-02 157 225 7.496960E-01 9.250230E+00 9.321550E-02 157 226 7.523640E-01 9.192030E+00 9.424580E-02 157 227 7.550320E-01 9.329010E+00 9.347140E-02 157 228 7.576990E-01 9.032210E+00 9.240120E-02 157 229 7.603670E-01 9.211230E+00 9.411030E-02 157 230 7.630350E-01 9.162370E+00 9.272750E-02 157 231 7.657020E-01 9.051370E+00 9.304550E-02 157 232 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157 2097 5.743500E+00 1.716900E-01 6.691290E-02 157 2098 5.746160E+00 1.345100E-01 6.694120E-02 157 2099 5.748830E+00 2.060900E-01 6.701030E-02 157 2100 5.751500E+00 5.291000E-02 6.691460E-02 157 2101 5.754170E+00 2.654400E-01 6.671210E-02 157 2102 5.756830E+00 1.366300E-01 6.710440E-02 157 2103 5.759500E+00 1.629100E-01 6.690650E-02 157 2104 5.762170E+00 2.075200E-01 6.683850E-02 157 2105 5.764840E+00 1.099000E-01 6.735130E-02 157 2106 5.767500E+00 2.011800E-01 6.703360E-02 157 2107 5.770170E+00 1.795400E-01 6.693380E-02 157 2108 5.772840E+00 1.155700E-01 6.725450E-02 157 2109 5.775510E+00 1.422700E-01 6.699960E-02 157 2110 5.778170E+00 2.630100E-01 6.709520E-02 157 2111 5.780840E+00 1.940700E-01 6.686880E-02 157 2112 5.783510E+00 1.090000E-03 6.651690E-02 157 2113 5.786180E+00 1.001400E-01 6.662630E-02 157 2114 5.788850E+00 8.572000E-02 6.703300E-02 157 2115 5.791510E+00 9.512000E-02 6.670160E-02 157 2116 5.794180E+00 1.971700E-01 6.687140E-02 157 2117 5.796850E+00 5.650000E-02 6.655080E-02 157 2118 5.799520E+00 1.846800E-01 6.707610E-02 157 2119 5.802180E+00 1.910100E-01 6.704800E-02 157 2120 5.804850E+00 8.988000E-02 6.666470E-02 157 2121 5.807520E+00 1.980900E-01 6.709940E-02 157 2122 5.810190E+00 1.341100E-01 6.689010E-02 157 2123 5.812850E+00 1.467600E-01 6.690880E-02 157 2124 5.815520E+00 2.501600E-01 6.732750E-02 157 2125 5.818190E+00 2.100000E-01 6.700480E-02 157 2126 5.820860E+00 1.828300E-01 6.671260E-02 157 2127 5.823520E+00 1.399900E-01 6.654800E-02 157 2128 5.826190E+00 3.013900E-01 6.668550E-02 157 2129 5.828860E+00 1.422600E-01 6.686860E-02 157 2130 5.831530E+00 2.012700E-01 6.683170E-02 157 2131 5.834190E+00 1.486200E-01 6.695610E-02 157 2132 5.836860E+00 1.256500E-01 6.660240E-02 157 2133 5.839530E+00 2.448100E-01 6.623420E-02 157 2134 5.842200E+00 2.562200E-01 6.680420E-02 157 2135 5.844870E+00 1.704500E-01 6.683610E-02 157 2136 5.847530E+00 1.014800E-01 6.690480E-02 157 2137 5.850200E+00 3.069300E-01 6.664350E-02 157 2138 5.852870E+00 1.416300E-01 6.655760E-02 157 2139 5.855540E+00 2.006300E-01 6.686510E-02 157 2140 5.858200E+00 1.797000E-01 6.645150E-02 157 2141 5.860870E+00 1.998000E-01 6.654210E-02 157 2142 5.863540E+00 1.978400E-01 6.655770E-02 157 2143 5.866210E+00 8.481000E-02 6.636260E-02 157 2144 5.868870E+00 2.902600E-01 6.655870E-02 157 2145 5.871540E+00 1.568200E-01 6.665520E-02 157 2146 5.874210E+00 2.349500E-01 6.663110E-02 157 2147 5.876880E+00 2.391900E-01 6.688780E-02 157 2148 5.879540E+00 2.253800E-01 6.683070E-02 157 2149 5.882210E+00 5.087000E-02 8.294820E-02 157 2150 5.884880E+00 1.825300E-01 9.193850E-02 157 2151 5.887550E+00 1.869300E-01 9.432840E-02 157 2152 5.890220E+00 1.513300E-01 7.334280E-02 157 2153 5.892880E+00 1.287100E-01 6.994830E-02 157 2154 5.895550E+00 1.556100E-01 7.049090E-02 157 2155 5.898220E+00 1.525100E-01 7.062100E-02 157 2156 5.900890E+00 1.430700E-01 7.019780E-02 157 2157 5.903550E+00 1.213700E-01 6.954960E-02 157 2158 5.906220E+00 1.193600E-01 6.978530E-02 157 2159 5.908890E+00 1.939100E-01 6.942970E-02 157 2160 5.911560E+00 2.518100E-01 6.930760E-02 157 2161 5.914220E+00 1.777700E-01 6.918140E-02 157 2162 5.916890E+00 9.884000E-02 6.901920E-02 157 2163 5.919560E+00 1.239200E-01 6.901090E-02 157 2164 5.922230E+00 3.364000E-02 6.843580E-02 157 2165 5.924890E+00 3.833000E-02 6.842990E-02 157 2166 5.927560E+00 1.976600E-01 6.904250E-02 157 2167 5.930230E+00 2.000000E-02 6.864180E-02 157 2168 5.932900E+00 6.223000E-02 8.680430E-02 157 2169 5.935560E+00 1.609700E-01 9.727410E-02 157 2170 5.938230E+00 2.646200E-01 9.906920E-02 157 2171 5.940900E+00 2.383000E-01 7.471290E-02 157 2172 5.943570E+00 1.546400E-01 7.028800E-02 157 2173 5.946240E+00 6.557000E-02 6.985160E-02 157 2174 5.948900E+00 1.663600E-01 7.067230E-02 157 2175 5.951570E+00 2.194700E-01 7.028460E-02 157 2176 5.954240E+00 2.367800E-01 7.014140E-02 157 2177 5.956910E+00 2.729400E-01 7.042170E-02 157 2178 5.959570E+00 9.915000E-02 6.932260E-02 157 2179 5.962240E+00 9.164000E-02 6.932710E-02 157 2180 5.964910E+00 2.178500E-01 6.918010E-02 157 2181 5.967580E+00 1.856400E-01 6.938940E-02 157 2182 5.970240E+00 1.320500E-01 6.897610E-02 157 2183 5.972910E+00 1.617700E-01 6.889150E-02 157 2184 5.975580E+00 1.025500E-01 6.861390E-02 157 2185 5.978250E+00 -9.450000E-03 6.854770E-02 157 2186 5.980910E+00 1.401700E-01 6.869760E-02 157 2187 5.983580E+00 1.939000E-01 6.862700E-02 157 2188 5.986250E+00 9.124000E-02 6.857130E-02 157 2189 5.988920E+00 1.330400E-01 6.777720E-02 157 2190 5.991580E+00 1.041300E-01 6.703390E-02 157 2191 5.994250E+00 1.865400E-01 6.663860E-02 157 2192 5.996920E+00 1.058100E-01 6.613990E-02 157 2193 5.999590E+00 1.166700E-01 6.601670E-02 157 2194 6.002260E+00 1.163900E-01 6.635250E-02 157 2195 6.004920E+00 1.301700E-01 6.635460E-02 157 2196 6.007590E+00 2.411700E-01 6.603540E-02 157 2197 6.010260E+00 6.437000E-02 6.569960E-02 157 2198 6.012930E+00 1.187200E-01 6.597940E-02 157 2199 6.015590E+00 1.558600E-01 6.616130E-02 157 2200 6.018260E+00 5.418000E-02 6.570320E-02 157 2201 6.020930E+00 2.330600E-01 6.661470E-02 157 2202 6.023600E+00 2.129400E-01 6.621640E-02 157 2203 6.026260E+00 1.879800E-01 6.630300E-02 157 2204 6.028930E+00 1.254500E-01 6.614710E-02 157 2205 6.031600E+00 1.346500E-01 6.616470E-02 157 2206 6.034270E+00 8.039000E-02 6.596030E-02 157 2207 6.036930E+00 1.616600E-01 6.603800E-02 157 2208 6.039600E+00 1.882000E-01 6.587200E-02 157 2209 6.042270E+00 2.448600E-01 6.628850E-02 157 2210 6.044940E+00 1.483100E-01 6.618390E-02 157 2211 6.047610E+00 5.651000E-02 6.610980E-02 157 2212 6.050270E+00 1.779800E-01 6.608120E-02 157 2213 6.052940E+00 1.378800E-01 6.596140E-02 157 2214 6.055610E+00 1.313900E-01 6.598640E-02 157 2215 6.058280E+00 1.146000E-01 6.588630E-02 157 2216 6.060940E+00 9.590000E-02 6.581010E-02 157 2217 6.063610E+00 1.725100E-01 6.628070E-02 157 2218 6.066280E+00 6.770000E-03 6.598970E-02 157 2219 6.068950E+00 5.287000E-02 6.580820E-02 157 2220 6.071610E+00 8.730000E-02 6.582900E-02 157 2221 6.074280E+00 4.870000E-03 6.590990E-02 157 2222 6.076950E+00 2.567800E-01 6.613960E-02 157 2223 6.079620E+00 8.416000E-02 6.586750E-02 157 2224 6.082280E+00 3.730000E-02 6.587910E-02 157 2225 6.084950E+00 2.149500E-01 6.592050E-02 157 2226 6.087620E+00 1.436500E-01 6.594990E-02 157 2227 6.090290E+00 1.467800E-01 6.588460E-02 157 2228 6.092950E+00 1.352500E-01 6.587320E-02 157 2229 6.095620E+00 1.107400E-01 6.560970E-02 157 2230 6.098290E+00 2.176200E-01 6.595320E-02 157 2231 6.100960E+00 2.491400E-01 6.599700E-02 157 2232 6.103630E+00 3.119800E-01 6.564160E-02 157 2233 6.106290E+00 1.858100E-01 6.612950E-02 157 2234 6.108960E+00 1.702700E-01 6.598650E-02 157 2235 6.111630E+00 1.958400E-01 6.562910E-02 157 2236 6.114300E+00 1.816600E-01 6.605610E-02 157 2237 6.116960E+00 3.393000E-02 6.553470E-02 157 2238 6.119630E+00 1.723600E-01 6.570500E-02 157 2239 6.122300E+00 1.307200E-01 6.562040E-02 157 2240 6.124970E+00 7.909000E-02 6.574110E-02 157 2241 6.127630E+00 2.511700E-01 6.603260E-02 157 2242 6.130300E+00 1.770200E-01 6.614990E-02 157 2243 6.132970E+00 1.509500E-01 6.568970E-02 157 2244 6.135640E+00 2.943700E-01 6.595060E-02 157 2245 6.138300E+00 1.857800E-01 6.579430E-02 157 2246 6.140970E+00 1.334300E-01 6.583390E-02 157 2247 6.143640E+00 1.739900E-01 6.568910E-02 157 2248 6.146310E+00 2.536000E-01 6.615590E-02 157 2249 6.148970E+00 2.309000E-01 6.598390E-02 157 2250 6.151640E+00 1.472800E-01 6.615790E-02 157 2251 6.154310E+00 1.034400E-01 6.572210E-02 157 2252 6.156980E+00 5.861000E-02 6.561980E-02 157 2253 6.159650E+00 2.369900E-01 6.617180E-02 157 2254 6.162310E+00 1.973300E-01 6.607100E-02 157 2255 6.164980E+00 1.103400E-01 6.575950E-02 157 2256 6.167650E+00 1.455000E-01 6.553470E-02 157 2257 6.170320E+00 1.571300E-01 6.580380E-02 157 2258 6.172980E+00 2.082800E-01 6.593680E-02 157 2259 6.175650E+00 3.159500E-01 6.614510E-02 157 2260 6.178320E+00 9.844000E-02 6.515650E-02 157 2261 6.180990E+00 2.389000E-01 6.547150E-02 157 2262 6.183650E+00 1.393100E-01 6.572300E-02 157 2263 6.186320E+00 1.174400E-01 8.197150E-02 157 2264 6.188990E+00 -1.439000E-02 9.055030E-02 157 2265 6.191660E+00 9.709000E-02 9.283650E-02 157 2266 6.194320E+00 1.459700E-01 9.664990E-02 157 2267 6.196990E+00 1.035300E-01 1.023070E-01 157 2268 6.199660E+00 1.666300E-01 1.064170E-01 157 2269 6.202330E+00 3.379000E-02 1.117030E-01 157 2270 6.205000E+00 7.973000E-02 1.171040E-01 157 2271 6.207660E+00 2.372400E-01 1.253300E-01 157 2272 6.210330E+00 -2.933000E-02 1.314490E-01 157 2273 6.213000E+00 2.119000E-01 1.398820E-01 157 2274 6.215670E+00 1.801800E-01 1.490610E-01 157 2275 6.218330E+00 5.438600E-01 1.615910E-01 157 2276 6.221000E+00 9.009000E-02 1.730470E-01 157 2277 6.223670E+00 -3.129000E-02 1.864300E-01 157 2278 6.226340E+00 2.406000E-02 2.012620E-01 157 2279 6.229000E+00 2.463500E-01 2.264180E-01 157 2280 6.231670E+00 -1.184500E-01 2.426160E-01 157 2281 6.234340E+00 6.654900E-01 2.878570E-01 157 2282 6.237010E+00 -1.808900E-01 4.482680E-01 157 # _sas_p_of_R_details.id 157 _sas_p_of_R_details.intensity_id 157 _sas_p_of_R_details.software_p_of_R "GNOM 4.5a" _sas_p_of_R_details.number_of_points 484 _sas_p_of_R_details.qmin 0.3055 _sas_p_of_R_details.qmax 5.457 _sas_p_of_R_details.p_of_R_point_min 85 _sas_p_of_R_details.p_of_R_point_max 568 _sas_p_of_R_details.Rmin 0.0 _sas_p_of_R_details.Rmax 6.41 # loop_ _sas_p_of_R.id _sas_p_of_R.ordinal _sas_p_of_R.r _sas_p_of_R.P _sas_p_of_R.P_error 157 1 0.000000E+00 0.000000E+00 0.000000E+00 157 2 6.410000E-02 2.249000E-02 7.277000E-04 157 3 1.282000E-01 4.193000E-02 1.088000E-03 157 4 1.923000E-01 5.864000E-02 1.124000E-03 157 5 2.564000E-01 7.316000E-02 9.071000E-04 157 6 3.205000E-01 8.617000E-02 5.534000E-04 157 7 3.846000E-01 9.845000E-02 4.102000E-04 157 8 4.487000E-01 1.108000E-01 7.763000E-04 157 9 5.128000E-01 1.241000E-01 1.210000E-03 157 10 5.769000E-01 1.389000E-01 1.540000E-03 157 11 6.410000E-01 1.558000E-01 1.710000E-03 157 12 7.051000E-01 1.753000E-01 1.702000E-03 157 13 7.692000E-01 1.974000E-01 1.537000E-03 157 14 8.333000E-01 2.221000E-01 1.282000E-03 157 15 8.974000E-01 2.492000E-01 1.077000E-03 157 16 9.615000E-01 2.782000E-01 1.112000E-03 157 17 1.026000E+00 3.083000E-01 1.396000E-03 157 18 1.090000E+00 3.390000E-01 1.755000E-03 157 19 1.154000E+00 3.694000E-01 2.055000E-03 157 20 1.218000E+00 3.987000E-01 2.226000E-03 157 21 1.282000E+00 4.261000E-01 2.238000E-03 157 22 1.346000E+00 4.510000E-01 2.099000E-03 157 23 1.410000E+00 4.728000E-01 1.858000E-03 157 24 1.474000E+00 4.912000E-01 1.608000E-03 157 25 1.538000E+00 5.058000E-01 1.490000E-03 157 26 1.603000E+00 5.167000E-01 1.599000E-03 157 27 1.667000E+00 5.239000E-01 1.874000E-03 157 28 1.731000E+00 5.276000E-01 2.180000E-03 157 29 1.795000E+00 5.282000E-01 2.414000E-03 157 30 1.859000E+00 5.259000E-01 2.523000E-03 157 31 1.923000E+00 5.213000E-01 2.492000E-03 157 32 1.987000E+00 5.146000E-01 2.340000E-03 157 33 2.051000E+00 5.064000E-01 2.121000E-03 157 34 2.115000E+00 4.968000E-01 1.920000E-03 157 35 2.179000E+00 4.863000E-01 1.834000E-03 157 36 2.244000E+00 4.751000E-01 1.904000E-03 157 37 2.308000E+00 4.632000E-01 2.084000E-03 157 38 2.372000E+00 4.508000E-01 2.280000E-03 157 39 2.436000E+00 4.380000E-01 2.417000E-03 157 40 2.500000E+00 4.249000E-01 2.456000E-03 157 41 2.564000E+00 4.113000E-01 2.390000E-03 157 42 2.628000E+00 3.975000E-01 2.243000E-03 157 43 2.692000E+00 3.833000E-01 2.066000E-03 157 44 2.756000E+00 3.689000E-01 1.926000E-03 157 45 2.820000E+00 3.543000E-01 1.877000E-03 157 46 2.885000E+00 3.396000E-01 1.932000E-03 157 47 2.949000E+00 3.248000E-01 2.048000E-03 157 48 3.013000E+00 3.102000E-01 2.169000E-03 157 49 3.077000E+00 2.957000E-01 2.252000E-03 157 50 3.141000E+00 2.815000E-01 2.285000E-03 157 51 3.205000E+00 2.676000E-01 2.280000E-03 157 52 3.269000E+00 2.542000E-01 2.268000E-03 157 53 3.333000E+00 2.412000E-01 2.282000E-03 157 54 3.397000E+00 2.287000E-01 2.343000E-03 157 55 3.461000E+00 2.166000E-01 2.443000E-03 157 56 3.526000E+00 2.049000E-01 2.554000E-03 157 57 3.590000E+00 1.938000E-01 2.646000E-03 157 58 3.654000E+00 1.830000E-01 2.698000E-03 157 59 3.718000E+00 1.726000E-01 2.707000E-03 157 60 3.782000E+00 1.626000E-01 2.693000E-03 157 61 3.846000E+00 1.530000E-01 2.687000E-03 157 62 3.910000E+00 1.439000E-01 2.723000E-03 157 63 3.974000E+00 1.352000E-01 2.820000E-03 157 64 4.038000E+00 1.270000E-01 2.970000E-03 157 65 4.102000E+00 1.193000E-01 3.143000E-03 157 66 4.167000E+00 1.122000E-01 3.303000E-03 157 67 4.231000E+00 1.056000E-01 3.421000E-03 157 68 4.295000E+00 9.965000E-02 3.479000E-03 157 69 4.359000E+00 9.426000E-02 3.480000E-03 157 70 4.423000E+00 8.940000E-02 3.438000E-03 157 71 4.487000E+00 8.505000E-02 3.378000E-03 157 72 4.551000E+00 8.115000E-02 3.330000E-03 157 73 4.615000E+00 7.762000E-02 3.313000E-03 157 74 4.679000E+00 7.440000E-02 3.334000E-03 157 75 4.743000E+00 7.142000E-02 3.387000E-03 157 76 4.808000E+00 6.862000E-02 3.455000E-03 157 77 4.872000E+00 6.594000E-02 3.524000E-03 157 78 4.936000E+00 6.335000E-02 3.584000E-03 157 79 5.000000E+00 6.083000E-02 3.636000E-03 157 80 5.064000E+00 5.837000E-02 3.685000E-03 157 81 5.128000E+00 5.598000E-02 3.735000E-03 157 82 5.192000E+00 5.366000E-02 3.790000E-03 157 83 5.256000E+00 5.143000E-02 3.843000E-03 157 84 5.320000E+00 4.931000E-02 3.885000E-03 157 85 5.384000E+00 4.729000E-02 3.903000E-03 157 86 5.449000E+00 4.537000E-02 3.884000E-03 157 87 5.513000E+00 4.352000E-02 3.827000E-03 157 88 5.577000E+00 4.172000E-02 3.741000E-03 157 89 5.641000E+00 3.992000E-02 3.650000E-03 157 90 5.705000E+00 3.806000E-02 3.594000E-03 157 91 5.769000E+00 3.609000E-02 3.620000E-03 157 92 5.833000E+00 3.395000E-02 3.761000E-03 157 93 5.897000E+00 3.158000E-02 4.014000E-03 157 94 5.961000E+00 2.895000E-02 4.335000E-03 157 95 6.025000E+00 2.600000E-02 4.643000E-03 157 96 6.090000E+00 2.272000E-02 4.837000E-03 157 97 6.154000E+00 1.908000E-02 4.804000E-03 157 98 6.218000E+00 1.503000E-02 4.426000E-03 157 99 6.282000E+00 1.055000E-02 3.579000E-03 157 100 6.346000E+00 5.570000E-03 2.143000E-03 157 101 6.410000E+00 0.000000E+00 0.000000E+00 # loop_ _sas_p_of_R_extrapolated_intensity.id _sas_p_of_R_extrapolated_intensity.ordinal _sas_p_of_R_extrapolated_intensity.momentum_transfer _sas_p_of_R_extrapolated_intensity.intensity_reg 157 1 0.000000E+00 1.721000E+01 157 2 1.091000E-02 1.721000E+01 157 3 2.182000E-02 1.720000E+01 157 4 3.274000E-02 1.719000E+01 157 5 4.365000E-02 1.717000E+01 157 6 5.456000E-02 1.715000E+01 157 7 6.547000E-02 1.713000E+01 157 8 7.638000E-02 1.710000E+01 157 9 8.730000E-02 1.706000E+01 157 10 9.821000E-02 1.702000E+01 157 11 1.091000E-01 1.698000E+01 157 12 1.200000E-01 1.693000E+01 157 13 1.309000E-01 1.687000E+01 157 14 1.419000E-01 1.681000E+01 157 15 1.528000E-01 1.675000E+01 157 16 1.637000E-01 1.668000E+01 157 17 1.746000E-01 1.661000E+01 157 18 1.855000E-01 1.654000E+01 157 19 1.964000E-01 1.646000E+01 157 20 2.073000E-01 1.637000E+01 157 21 2.182000E-01 1.629000E+01 157 22 2.292000E-01 1.619000E+01 157 23 2.401000E-01 1.610000E+01 157 24 2.510000E-01 1.600000E+01 157 25 2.619000E-01 1.590000E+01 157 26 2.728000E-01 1.579000E+01 157 27 2.837000E-01 1.568000E+01 157 28 2.946000E-01 1.557000E+01 157 29 3.055000E-01 1.545000E+01 157 30 3.162000E-01 1.533000E+01 157 31 3.269000E-01 1.522000E+01 157 32 3.375000E-01 1.509000E+01 157 33 3.482000E-01 1.497000E+01 157 34 3.589000E-01 1.484000E+01 157 35 3.696000E-01 1.471000E+01 157 36 3.802000E-01 1.458000E+01 157 37 3.909000E-01 1.444000E+01 157 38 4.016000E-01 1.431000E+01 157 39 4.122000E-01 1.417000E+01 157 40 4.229000E-01 1.403000E+01 157 41 4.336000E-01 1.388000E+01 157 42 4.443000E-01 1.374000E+01 157 43 4.549000E-01 1.359000E+01 157 44 4.656000E-01 1.345000E+01 157 45 4.763000E-01 1.330000E+01 157 46 4.869000E-01 1.315000E+01 157 47 4.976000E-01 1.300000E+01 157 48 5.083000E-01 1.284000E+01 157 49 5.189000E-01 1.269000E+01 157 50 5.296000E-01 1.254000E+01 157 51 5.403000E-01 1.238000E+01 157 52 5.510000E-01 1.222000E+01 157 53 5.616000E-01 1.207000E+01 157 54 5.723000E-01 1.191000E+01 157 55 5.830000E-01 1.175000E+01 157 56 5.936000E-01 1.160000E+01 157 57 6.043000E-01 1.144000E+01 157 58 6.150000E-01 1.128000E+01 157 59 6.257000E-01 1.113000E+01 157 60 6.363000E-01 1.097000E+01 157 61 6.470000E-01 1.081000E+01 157 62 6.577000E-01 1.065000E+01 157 63 6.683000E-01 1.050000E+01 157 64 6.790000E-01 1.034000E+01 157 65 6.897000E-01 1.019000E+01 157 66 7.003000E-01 1.003000E+01 157 67 7.110000E-01 9.877000E+00 157 68 7.217000E-01 9.724000E+00 157 69 7.324000E-01 9.571000E+00 157 70 7.430000E-01 9.419000E+00 157 71 7.537000E-01 9.268000E+00 157 72 7.644000E-01 9.119000E+00 157 73 7.750000E-01 8.970000E+00 157 74 7.857000E-01 8.822000E+00 157 75 7.964000E-01 8.676000E+00 157 76 8.071000E-01 8.530000E+00 157 77 8.177000E-01 8.386000E+00 157 78 8.284000E-01 8.243000E+00 157 79 8.391000E-01 8.102000E+00 157 80 8.497000E-01 7.962000E+00 157 81 8.604000E-01 7.823000E+00 157 82 8.711000E-01 7.686000E+00 157 83 8.817000E-01 7.550000E+00 157 84 8.924000E-01 7.416000E+00 157 85 9.031000E-01 7.283000E+00 157 86 9.138000E-01 7.152000E+00 157 87 9.244000E-01 7.022000E+00 157 88 9.351000E-01 6.894000E+00 157 89 9.458000E-01 6.768000E+00 157 90 9.564000E-01 6.643000E+00 157 91 9.671000E-01 6.520000E+00 157 92 9.778000E-01 6.398000E+00 157 93 9.884000E-01 6.278000E+00 157 94 9.991000E-01 6.160000E+00 157 95 1.010000E+00 6.043000E+00 157 96 1.020000E+00 5.928000E+00 157 97 1.031000E+00 5.815000E+00 157 98 1.042000E+00 5.703000E+00 157 99 1.052000E+00 5.593000E+00 157 100 1.063000E+00 5.484000E+00 157 101 1.074000E+00 5.378000E+00 157 102 1.084000E+00 5.273000E+00 157 103 1.095000E+00 5.169000E+00 157 104 1.106000E+00 5.067000E+00 157 105 1.116000E+00 4.967000E+00 157 106 1.127000E+00 4.868000E+00 157 107 1.138000E+00 4.771000E+00 157 108 1.149000E+00 4.676000E+00 157 109 1.159000E+00 4.582000E+00 157 110 1.170000E+00 4.489000E+00 157 111 1.181000E+00 4.398000E+00 157 112 1.191000E+00 4.309000E+00 157 113 1.202000E+00 4.221000E+00 157 114 1.213000E+00 4.134000E+00 157 115 1.223000E+00 4.049000E+00 157 116 1.234000E+00 3.966000E+00 157 117 1.245000E+00 3.884000E+00 157 118 1.255000E+00 3.803000E+00 157 119 1.266000E+00 3.724000E+00 157 120 1.277000E+00 3.646000E+00 157 121 1.287000E+00 3.569000E+00 157 122 1.298000E+00 3.494000E+00 157 123 1.309000E+00 3.420000E+00 157 124 1.319000E+00 3.347000E+00 157 125 1.330000E+00 3.275000E+00 157 126 1.341000E+00 3.205000E+00 157 127 1.351000E+00 3.136000E+00 157 128 1.362000E+00 3.069000E+00 157 129 1.373000E+00 3.002000E+00 157 130 1.383000E+00 2.937000E+00 157 131 1.394000E+00 2.872000E+00 157 132 1.405000E+00 2.809000E+00 157 133 1.415000E+00 2.747000E+00 157 134 1.426000E+00 2.687000E+00 157 135 1.437000E+00 2.627000E+00 157 136 1.447000E+00 2.568000E+00 157 137 1.458000E+00 2.511000E+00 157 138 1.469000E+00 2.454000E+00 157 139 1.479000E+00 2.399000E+00 157 140 1.490000E+00 2.344000E+00 157 141 1.501000E+00 2.291000E+00 157 142 1.511000E+00 2.238000E+00 157 143 1.522000E+00 2.187000E+00 157 144 1.533000E+00 2.136000E+00 157 145 1.543000E+00 2.086000E+00 157 146 1.554000E+00 2.038000E+00 157 147 1.565000E+00 1.990000E+00 157 148 1.575000E+00 1.943000E+00 157 149 1.586000E+00 1.897000E+00 157 150 1.597000E+00 1.852000E+00 157 151 1.607000E+00 1.808000E+00 157 152 1.618000E+00 1.765000E+00 157 153 1.629000E+00 1.723000E+00 157 154 1.639000E+00 1.681000E+00 157 155 1.650000E+00 1.640000E+00 157 156 1.661000E+00 1.601000E+00 157 157 1.671000E+00 1.562000E+00 157 158 1.682000E+00 1.523000E+00 157 159 1.693000E+00 1.486000E+00 157 160 1.703000E+00 1.449000E+00 157 161 1.714000E+00 1.414000E+00 157 162 1.725000E+00 1.378000E+00 157 163 1.735000E+00 1.344000E+00 157 164 1.746000E+00 1.311000E+00 157 165 1.757000E+00 1.278000E+00 157 166 1.767000E+00 1.246000E+00 157 167 1.778000E+00 1.215000E+00 157 168 1.789000E+00 1.184000E+00 157 169 1.799000E+00 1.154000E+00 157 170 1.810000E+00 1.125000E+00 157 171 1.821000E+00 1.097000E+00 157 172 1.831000E+00 1.069000E+00 157 173 1.842000E+00 1.042000E+00 157 174 1.853000E+00 1.016000E+00 157 175 1.863000E+00 9.902000E-01 157 176 1.874000E+00 9.652000E-01 157 177 1.885000E+00 9.408000E-01 157 178 1.895000E+00 9.171000E-01 157 179 1.906000E+00 8.940000E-01 157 180 1.917000E+00 8.715000E-01 157 181 1.927000E+00 8.497000E-01 157 182 1.938000E+00 8.284000E-01 157 183 1.949000E+00 8.078000E-01 157 184 1.959000E+00 7.877000E-01 157 185 1.970000E+00 7.682000E-01 157 186 1.981000E+00 7.492000E-01 157 187 1.991000E+00 7.309000E-01 157 188 2.002000E+00 7.130000E-01 157 189 2.013000E+00 6.957000E-01 157 190 2.023000E+00 6.789000E-01 157 191 2.034000E+00 6.626000E-01 157 192 2.045000E+00 6.468000E-01 157 193 2.055000E+00 6.315000E-01 157 194 2.066000E+00 6.167000E-01 157 195 2.077000E+00 6.023000E-01 157 196 2.088000E+00 5.884000E-01 157 197 2.098000E+00 5.750000E-01 157 198 2.109000E+00 5.619000E-01 157 199 2.120000E+00 5.493000E-01 157 200 2.130000E+00 5.371000E-01 157 201 2.141000E+00 5.253000E-01 157 202 2.152000E+00 5.139000E-01 157 203 2.162000E+00 5.028000E-01 157 204 2.173000E+00 4.921000E-01 157 205 2.184000E+00 4.818000E-01 157 206 2.194000E+00 4.718000E-01 157 207 2.205000E+00 4.622000E-01 157 208 2.216000E+00 4.528000E-01 157 209 2.226000E+00 4.438000E-01 157 210 2.237000E+00 4.351000E-01 157 211 2.248000E+00 4.266000E-01 157 212 2.258000E+00 4.184000E-01 157 213 2.269000E+00 4.105000E-01 157 214 2.280000E+00 4.029000E-01 157 215 2.290000E+00 3.955000E-01 157 216 2.301000E+00 3.883000E-01 157 217 2.312000E+00 3.814000E-01 157 218 2.322000E+00 3.747000E-01 157 219 2.333000E+00 3.682000E-01 157 220 2.344000E+00 3.618000E-01 157 221 2.354000E+00 3.557000E-01 157 222 2.365000E+00 3.498000E-01 157 223 2.376000E+00 3.440000E-01 157 224 2.386000E+00 3.385000E-01 157 225 2.397000E+00 3.330000E-01 157 226 2.408000E+00 3.278000E-01 157 227 2.418000E+00 3.226000E-01 157 228 2.429000E+00 3.177000E-01 157 229 2.440000E+00 3.128000E-01 157 230 2.450000E+00 3.081000E-01 157 231 2.461000E+00 3.035000E-01 157 232 2.472000E+00 2.990000E-01 157 233 2.482000E+00 2.946000E-01 157 234 2.493000E+00 2.904000E-01 157 235 2.504000E+00 2.862000E-01 157 236 2.514000E+00 2.821000E-01 157 237 2.525000E+00 2.782000E-01 157 238 2.536000E+00 2.743000E-01 157 239 2.546000E+00 2.705000E-01 157 240 2.557000E+00 2.668000E-01 157 241 2.568000E+00 2.632000E-01 157 242 2.578000E+00 2.596000E-01 157 243 2.589000E+00 2.561000E-01 157 244 2.600000E+00 2.527000E-01 157 245 2.610000E+00 2.494000E-01 157 246 2.621000E+00 2.461000E-01 157 247 2.632000E+00 2.429000E-01 157 248 2.642000E+00 2.398000E-01 157 249 2.653000E+00 2.368000E-01 157 250 2.664000E+00 2.338000E-01 157 251 2.674000E+00 2.308000E-01 157 252 2.685000E+00 2.280000E-01 157 253 2.696000E+00 2.252000E-01 157 254 2.706000E+00 2.224000E-01 157 255 2.717000E+00 2.197000E-01 157 256 2.728000E+00 2.171000E-01 157 257 2.738000E+00 2.146000E-01 157 258 2.749000E+00 2.121000E-01 157 259 2.760000E+00 2.096000E-01 157 260 2.770000E+00 2.073000E-01 157 261 2.781000E+00 2.050000E-01 157 262 2.792000E+00 2.027000E-01 157 263 2.802000E+00 2.005000E-01 157 264 2.813000E+00 1.984000E-01 157 265 2.824000E+00 1.964000E-01 157 266 2.834000E+00 1.944000E-01 157 267 2.845000E+00 1.925000E-01 157 268 2.856000E+00 1.906000E-01 157 269 2.866000E+00 1.888000E-01 157 270 2.877000E+00 1.871000E-01 157 271 2.888000E+00 1.854000E-01 157 272 2.898000E+00 1.838000E-01 157 273 2.909000E+00 1.823000E-01 157 274 2.920000E+00 1.808000E-01 157 275 2.930000E+00 1.794000E-01 157 276 2.941000E+00 1.781000E-01 157 277 2.952000E+00 1.768000E-01 157 278 2.962000E+00 1.756000E-01 157 279 2.973000E+00 1.745000E-01 157 280 2.984000E+00 1.734000E-01 157 281 2.995000E+00 1.724000E-01 157 282 3.005000E+00 1.715000E-01 157 283 3.016000E+00 1.706000E-01 157 284 3.027000E+00 1.698000E-01 157 285 3.037000E+00 1.691000E-01 157 286 3.048000E+00 1.684000E-01 157 287 3.059000E+00 1.678000E-01 157 288 3.069000E+00 1.672000E-01 157 289 3.080000E+00 1.667000E-01 157 290 3.091000E+00 1.663000E-01 157 291 3.101000E+00 1.659000E-01 157 292 3.112000E+00 1.656000E-01 157 293 3.123000E+00 1.653000E-01 157 294 3.133000E+00 1.651000E-01 157 295 3.144000E+00 1.649000E-01 157 296 3.155000E+00 1.648000E-01 157 297 3.165000E+00 1.647000E-01 157 298 3.176000E+00 1.646000E-01 157 299 3.187000E+00 1.647000E-01 157 300 3.197000E+00 1.647000E-01 157 301 3.208000E+00 1.648000E-01 157 302 3.219000E+00 1.649000E-01 157 303 3.229000E+00 1.651000E-01 157 304 3.240000E+00 1.653000E-01 157 305 3.251000E+00 1.656000E-01 157 306 3.261000E+00 1.658000E-01 157 307 3.272000E+00 1.661000E-01 157 308 3.283000E+00 1.664000E-01 157 309 3.293000E+00 1.668000E-01 157 310 3.304000E+00 1.671000E-01 157 311 3.315000E+00 1.675000E-01 157 312 3.325000E+00 1.679000E-01 157 313 3.336000E+00 1.684000E-01 157 314 3.347000E+00 1.688000E-01 157 315 3.357000E+00 1.692000E-01 157 316 3.368000E+00 1.697000E-01 157 317 3.379000E+00 1.702000E-01 157 318 3.389000E+00 1.706000E-01 157 319 3.400000E+00 1.711000E-01 157 320 3.411000E+00 1.716000E-01 157 321 3.421000E+00 1.721000E-01 157 322 3.432000E+00 1.726000E-01 157 323 3.443000E+00 1.730000E-01 157 324 3.453000E+00 1.735000E-01 157 325 3.464000E+00 1.740000E-01 157 326 3.475000E+00 1.745000E-01 157 327 3.485000E+00 1.749000E-01 157 328 3.496000E+00 1.754000E-01 157 329 3.507000E+00 1.759000E-01 157 330 3.517000E+00 1.763000E-01 157 331 3.528000E+00 1.767000E-01 157 332 3.539000E+00 1.772000E-01 157 333 3.549000E+00 1.776000E-01 157 334 3.560000E+00 1.780000E-01 157 335 3.571000E+00 1.784000E-01 157 336 3.581000E+00 1.787000E-01 157 337 3.592000E+00 1.791000E-01 157 338 3.603000E+00 1.794000E-01 157 339 3.613000E+00 1.798000E-01 157 340 3.624000E+00 1.801000E-01 157 341 3.635000E+00 1.804000E-01 157 342 3.645000E+00 1.807000E-01 157 343 3.656000E+00 1.810000E-01 157 344 3.667000E+00 1.813000E-01 157 345 3.677000E+00 1.815000E-01 157 346 3.688000E+00 1.818000E-01 157 347 3.699000E+00 1.820000E-01 157 348 3.709000E+00 1.822000E-01 157 349 3.720000E+00 1.825000E-01 157 350 3.731000E+00 1.827000E-01 157 351 3.741000E+00 1.828000E-01 157 352 3.752000E+00 1.830000E-01 157 353 3.763000E+00 1.832000E-01 157 354 3.773000E+00 1.834000E-01 157 355 3.784000E+00 1.835000E-01 157 356 3.795000E+00 1.837000E-01 157 357 3.805000E+00 1.838000E-01 157 358 3.816000E+00 1.839000E-01 157 359 3.827000E+00 1.841000E-01 157 360 3.837000E+00 1.842000E-01 157 361 3.848000E+00 1.843000E-01 157 362 3.859000E+00 1.844000E-01 157 363 3.869000E+00 1.845000E-01 157 364 3.880000E+00 1.846000E-01 157 365 3.891000E+00 1.848000E-01 157 366 3.901000E+00 1.849000E-01 157 367 3.912000E+00 1.850000E-01 157 368 3.923000E+00 1.851000E-01 157 369 3.934000E+00 1.852000E-01 157 370 3.944000E+00 1.853000E-01 157 371 3.955000E+00 1.854000E-01 157 372 3.966000E+00 1.855000E-01 157 373 3.976000E+00 1.856000E-01 157 374 3.987000E+00 1.857000E-01 157 375 3.998000E+00 1.858000E-01 157 376 4.008000E+00 1.859000E-01 157 377 4.019000E+00 1.861000E-01 157 378 4.030000E+00 1.862000E-01 157 379 4.040000E+00 1.863000E-01 157 380 4.051000E+00 1.864000E-01 157 381 4.062000E+00 1.866000E-01 157 382 4.072000E+00 1.867000E-01 157 383 4.083000E+00 1.868000E-01 157 384 4.094000E+00 1.870000E-01 157 385 4.104000E+00 1.871000E-01 157 386 4.115000E+00 1.872000E-01 157 387 4.126000E+00 1.874000E-01 157 388 4.136000E+00 1.875000E-01 157 389 4.147000E+00 1.877000E-01 157 390 4.158000E+00 1.878000E-01 157 391 4.168000E+00 1.880000E-01 157 392 4.179000E+00 1.881000E-01 157 393 4.190000E+00 1.883000E-01 157 394 4.200000E+00 1.884000E-01 157 395 4.211000E+00 1.886000E-01 157 396 4.222000E+00 1.887000E-01 157 397 4.232000E+00 1.888000E-01 157 398 4.243000E+00 1.890000E-01 157 399 4.254000E+00 1.891000E-01 157 400 4.264000E+00 1.892000E-01 157 401 4.275000E+00 1.893000E-01 157 402 4.286000E+00 1.895000E-01 157 403 4.296000E+00 1.896000E-01 157 404 4.307000E+00 1.897000E-01 157 405 4.318000E+00 1.898000E-01 157 406 4.328000E+00 1.899000E-01 157 407 4.339000E+00 1.899000E-01 157 408 4.350000E+00 1.900000E-01 157 409 4.360000E+00 1.901000E-01 157 410 4.371000E+00 1.901000E-01 157 411 4.382000E+00 1.902000E-01 157 412 4.392000E+00 1.902000E-01 157 413 4.403000E+00 1.902000E-01 157 414 4.414000E+00 1.902000E-01 157 415 4.424000E+00 1.902000E-01 157 416 4.435000E+00 1.902000E-01 157 417 4.446000E+00 1.902000E-01 157 418 4.456000E+00 1.901000E-01 157 419 4.467000E+00 1.901000E-01 157 420 4.478000E+00 1.900000E-01 157 421 4.488000E+00 1.899000E-01 157 422 4.499000E+00 1.898000E-01 157 423 4.510000E+00 1.897000E-01 157 424 4.520000E+00 1.896000E-01 157 425 4.531000E+00 1.895000E-01 157 426 4.542000E+00 1.893000E-01 157 427 4.552000E+00 1.892000E-01 157 428 4.563000E+00 1.890000E-01 157 429 4.574000E+00 1.888000E-01 157 430 4.584000E+00 1.886000E-01 157 431 4.595000E+00 1.884000E-01 157 432 4.606000E+00 1.881000E-01 157 433 4.616000E+00 1.879000E-01 157 434 4.627000E+00 1.876000E-01 157 435 4.638000E+00 1.873000E-01 157 436 4.648000E+00 1.871000E-01 157 437 4.659000E+00 1.868000E-01 157 438 4.670000E+00 1.864000E-01 157 439 4.680000E+00 1.861000E-01 157 440 4.691000E+00 1.858000E-01 157 441 4.702000E+00 1.855000E-01 157 442 4.712000E+00 1.851000E-01 157 443 4.723000E+00 1.847000E-01 157 444 4.734000E+00 1.844000E-01 157 445 4.744000E+00 1.840000E-01 157 446 4.755000E+00 1.836000E-01 157 447 4.766000E+00 1.832000E-01 157 448 4.776000E+00 1.828000E-01 157 449 4.787000E+00 1.824000E-01 157 450 4.798000E+00 1.820000E-01 157 451 4.808000E+00 1.816000E-01 157 452 4.819000E+00 1.812000E-01 157 453 4.830000E+00 1.808000E-01 157 454 4.841000E+00 1.803000E-01 157 455 4.851000E+00 1.799000E-01 157 456 4.862000E+00 1.795000E-01 157 457 4.873000E+00 1.790000E-01 157 458 4.883000E+00 1.786000E-01 157 459 4.894000E+00 1.782000E-01 157 460 4.905000E+00 1.777000E-01 157 461 4.915000E+00 1.773000E-01 157 462 4.926000E+00 1.768000E-01 157 463 4.937000E+00 1.764000E-01 157 464 4.947000E+00 1.760000E-01 157 465 4.958000E+00 1.755000E-01 157 466 4.969000E+00 1.751000E-01 157 467 4.979000E+00 1.747000E-01 157 468 4.990000E+00 1.742000E-01 157 469 5.001000E+00 1.738000E-01 157 470 5.011000E+00 1.734000E-01 157 471 5.022000E+00 1.730000E-01 157 472 5.033000E+00 1.725000E-01 157 473 5.043000E+00 1.721000E-01 157 474 5.054000E+00 1.717000E-01 157 475 5.065000E+00 1.713000E-01 157 476 5.075000E+00 1.709000E-01 157 477 5.086000E+00 1.705000E-01 157 478 5.097000E+00 1.701000E-01 157 479 5.107000E+00 1.697000E-01 157 480 5.118000E+00 1.693000E-01 157 481 5.129000E+00 1.689000E-01 157 482 5.139000E+00 1.685000E-01 157 483 5.150000E+00 1.681000E-01 157 484 5.161000E+00 1.677000E-01 157 485 5.171000E+00 1.673000E-01 157 486 5.182000E+00 1.669000E-01 157 487 5.193000E+00 1.666000E-01 157 488 5.203000E+00 1.662000E-01 157 489 5.214000E+00 1.658000E-01 157 490 5.225000E+00 1.654000E-01 157 491 5.235000E+00 1.650000E-01 157 492 5.246000E+00 1.646000E-01 157 493 5.257000E+00 1.643000E-01 157 494 5.267000E+00 1.639000E-01 157 495 5.278000E+00 1.635000E-01 157 496 5.289000E+00 1.631000E-01 157 497 5.299000E+00 1.627000E-01 157 498 5.310000E+00 1.623000E-01 157 499 5.321000E+00 1.619000E-01 157 500 5.331000E+00 1.615000E-01 157 501 5.342000E+00 1.611000E-01 157 502 5.353000E+00 1.607000E-01 157 503 5.363000E+00 1.603000E-01 157 504 5.374000E+00 1.599000E-01 157 505 5.385000E+00 1.595000E-01 157 506 5.395000E+00 1.591000E-01 157 507 5.406000E+00 1.587000E-01 157 508 5.417000E+00 1.582000E-01 157 509 5.427000E+00 1.578000E-01 157 510 5.438000E+00 1.573000E-01 157 511 5.449000E+00 1.569000E-01 157 512 5.457000E+00 1.566000E-01 # data_SASDAW6_FIT_181 # _sas_model_fitting_details.id 181 _sas_model_fitting_details.unit 1/A _sas_model_fitting_details.chi_square 2.199289 _sas_model_fitting_details.p_value . _sas_model_fitting_details.result_id 157 # loop_ _sas_model_fitting.id _sas_model_fitting.ordinal _sas_model_fitting.momentum_transfer _sas_model_fitting.intensity _sas_model_fitting.fit 181 1 0.000000E+00 8.361000E-01 1.664190E+01 181 2 2.000000E-03 8.361000E-01 1.660900E+01 181 3 4.000000E-03 8.361000E-01 1.657610E+01 181 4 6.000000E-03 8.361000E-01 1.654320E+01 181 5 7.745430E-03 8.287430E+00 1.651450E+01 181 6 8.012190E-03 1.580140E+01 1.651010E+01 181 7 8.278950E-03 2.147540E+01 1.650570E+01 181 8 8.545720E-03 2.196940E+01 1.650140E+01 181 9 8.812480E-03 1.295640E+01 1.649700E+01 181 10 9.079240E-03 1.666040E+01 1.649260E+01 181 11 9.346000E-03 1.375240E+01 1.648820E+01 181 12 9.612770E-03 1.828140E+01 1.648380E+01 181 13 9.879530E-03 1.360040E+01 1.647940E+01 181 14 1.014630E-02 1.726240E+01 1.647040E+01 181 15 1.041310E-02 1.770440E+01 1.645750E+01 181 16 1.067980E-02 1.469740E+01 1.644460E+01 181 17 1.094660E-02 1.465340E+01 1.643170E+01 181 18 1.121330E-02 1.662640E+01 1.641880E+01 181 19 1.148010E-02 1.648140E+01 1.640590E+01 181 20 1.174690E-02 2.027940E+01 1.639300E+01 181 21 1.201360E-02 1.696440E+01 1.638010E+01 181 22 1.228040E-02 1.863340E+01 1.636720E+01 181 23 1.254720E-02 1.684340E+01 1.635430E+01 181 24 1.281390E-02 1.692840E+01 1.634140E+01 181 25 1.308070E-02 1.638040E+01 1.632850E+01 181 26 1.334740E-02 1.631340E+01 1.631560E+01 181 27 1.361420E-02 1.689940E+01 1.630270E+01 181 28 1.388100E-02 1.643840E+01 1.628980E+01 181 29 1.414770E-02 1.666840E+01 1.627690E+01 181 30 1.441450E-02 1.669150E+01 1.626400E+01 181 31 1.468130E-02 1.677550E+01 1.625110E+01 181 32 1.494800E-02 1.723820E+01 1.623820E+01 181 33 1.521480E-02 1.680910E+01 1.622530E+01 181 34 1.548150E-02 1.641800E+01 1.621240E+01 181 35 1.574830E-02 1.684700E+01 1.619950E+01 181 36 1.601510E-02 1.715530E+01 1.618660E+01 181 37 1.628180E-02 1.685250E+01 1.617370E+01 181 38 1.654860E-02 1.627000E+01 1.616080E+01 181 39 1.681540E-02 1.651530E+01 1.614790E+01 181 40 1.708210E-02 1.691510E+01 1.613500E+01 181 41 1.734890E-02 1.679900E+01 1.612210E+01 181 42 1.761560E-02 1.584470E+01 1.610920E+01 181 43 1.788240E-02 1.648420E+01 1.609630E+01 181 44 1.814920E-02 1.623440E+01 1.608340E+01 181 45 1.841590E-02 1.731350E+01 1.607050E+01 181 46 1.868270E-02 1.664440E+01 1.605760E+01 181 47 1.894950E-02 1.652250E+01 1.604470E+01 181 48 1.921620E-02 1.679140E+01 1.603180E+01 181 49 1.948300E-02 1.676990E+01 1.601890E+01 181 50 1.974980E-02 1.670800E+01 1.600600E+01 181 51 2.001650E-02 1.636000E+01 1.599270E+01 181 52 2.028330E-02 1.645470E+01 1.597200E+01 181 53 2.055000E-02 1.656790E+01 1.595130E+01 181 54 2.081680E-02 1.658560E+01 1.593070E+01 181 55 2.108360E-02 1.644680E+01 1.591000E+01 181 56 2.135030E-02 1.653040E+01 1.588940E+01 181 57 2.161710E-02 1.623870E+01 1.586870E+01 181 58 2.188390E-02 1.627590E+01 1.584800E+01 181 59 2.215060E-02 1.636030E+01 1.582740E+01 181 60 2.241740E-02 1.646120E+01 1.580670E+01 181 61 2.268410E-02 1.624590E+01 1.578610E+01 181 62 2.295090E-02 1.606270E+01 1.576540E+01 181 63 2.321770E-02 1.597350E+01 1.574480E+01 181 64 2.348440E-02 1.623070E+01 1.572410E+01 181 65 2.375120E-02 1.632760E+01 1.570340E+01 181 66 2.401800E-02 1.638030E+01 1.568280E+01 181 67 2.428470E-02 1.584630E+01 1.566210E+01 181 68 2.455150E-02 1.663910E+01 1.564150E+01 181 69 2.481820E-02 1.615370E+01 1.562080E+01 181 70 2.508500E-02 1.644830E+01 1.560020E+01 181 71 2.535180E-02 1.566370E+01 1.557950E+01 181 72 2.561850E-02 1.566380E+01 1.555880E+01 181 73 2.588530E-02 1.608720E+01 1.553820E+01 181 74 2.615210E-02 1.597230E+01 1.551750E+01 181 75 2.641880E-02 1.579920E+01 1.549690E+01 181 76 2.668560E-02 1.553270E+01 1.547620E+01 181 77 2.695230E-02 1.599570E+01 1.545560E+01 181 78 2.721910E-02 1.564000E+01 1.543490E+01 181 79 2.748590E-02 1.569230E+01 1.541420E+01 181 80 2.775260E-02 1.550520E+01 1.539360E+01 181 81 2.801940E-02 1.589130E+01 1.537290E+01 181 82 2.828620E-02 1.548270E+01 1.535230E+01 181 83 2.855290E-02 1.579470E+01 1.533160E+01 181 84 2.881970E-02 1.591330E+01 1.531090E+01 181 85 2.908640E-02 1.550400E+01 1.529030E+01 181 86 2.935320E-02 1.556250E+01 1.526960E+01 181 87 2.962000E-02 1.556520E+01 1.524900E+01 181 88 2.988670E-02 1.619600E+01 1.522830E+01 181 89 3.015350E-02 1.560000E+01 1.520390E+01 181 90 3.042030E-02 1.547760E+01 1.517660E+01 181 91 3.068700E-02 1.531490E+01 1.514940E+01 181 92 3.095380E-02 1.535270E+01 1.512210E+01 181 93 3.122060E-02 1.523360E+01 1.509490E+01 181 94 3.148730E-02 1.523420E+01 1.506770E+01 181 95 3.175410E-02 1.525400E+01 1.504040E+01 181 96 3.202080E-02 1.550530E+01 1.501320E+01 181 97 3.228760E-02 1.511510E+01 1.498590E+01 181 98 3.255440E-02 1.535660E+01 1.495870E+01 181 99 3.282110E-02 1.498640E+01 1.493140E+01 181 100 3.308790E-02 1.508400E+01 1.490420E+01 181 101 3.335470E-02 1.534900E+01 1.487690E+01 181 102 3.362140E-02 1.512120E+01 1.484970E+01 181 103 3.388820E-02 1.511600E+01 1.482250E+01 181 104 3.415490E-02 1.501370E+01 1.479520E+01 181 105 3.442170E-02 1.482160E+01 1.476800E+01 181 106 3.468850E-02 1.472690E+01 1.474070E+01 181 107 3.495520E-02 1.494130E+01 1.471350E+01 181 108 3.522200E-02 1.488870E+01 1.468620E+01 181 109 3.548880E-02 1.509010E+01 1.465900E+01 181 110 3.575550E-02 1.466170E+01 1.463170E+01 181 111 3.602230E-02 1.480200E+01 1.460450E+01 181 112 3.628900E-02 1.474350E+01 1.457730E+01 181 113 3.655580E-02 1.449690E+01 1.455000E+01 181 114 3.682260E-02 1.478460E+01 1.452280E+01 181 115 3.708930E-02 1.446300E+01 1.449550E+01 181 116 3.735610E-02 1.462880E+01 1.446830E+01 181 117 3.762290E-02 1.467740E+01 1.444100E+01 181 118 3.788960E-02 1.452610E+01 1.441380E+01 181 119 3.815640E-02 1.459240E+01 1.438650E+01 181 120 3.842310E-02 1.463850E+01 1.435930E+01 181 121 3.868990E-02 1.444670E+01 1.433210E+01 181 122 3.895670E-02 1.443220E+01 1.430480E+01 181 123 3.922340E-02 1.443260E+01 1.427760E+01 181 124 3.949020E-02 1.438350E+01 1.425030E+01 181 125 3.975700E-02 1.430770E+01 1.422310E+01 181 126 4.002370E-02 1.449130E+01 1.419540E+01 181 127 4.029050E-02 1.444840E+01 1.416310E+01 181 128 4.055720E-02 1.431490E+01 1.413070E+01 181 129 4.082400E-02 1.421710E+01 1.409840E+01 181 130 4.109080E-02 1.415420E+01 1.406610E+01 181 131 4.135750E-02 1.411820E+01 1.403370E+01 181 132 4.162430E-02 1.392330E+01 1.400140E+01 181 133 4.189110E-02 1.402680E+01 1.396910E+01 181 134 4.215780E-02 1.393450E+01 1.393670E+01 181 135 4.242460E-02 1.416090E+01 1.390440E+01 181 136 4.269130E-02 1.406110E+01 1.387210E+01 181 137 4.295810E-02 1.380540E+01 1.383970E+01 181 138 4.322490E-02 1.383610E+01 1.380740E+01 181 139 4.349160E-02 1.383400E+01 1.377510E+01 181 140 4.375840E-02 1.396410E+01 1.374270E+01 181 141 4.402520E-02 1.358520E+01 1.371040E+01 181 142 4.429190E-02 1.387350E+01 1.367810E+01 181 143 4.455870E-02 1.357790E+01 1.364570E+01 181 144 4.482550E-02 1.369410E+01 1.361340E+01 181 145 4.509220E-02 1.338820E+01 1.358110E+01 181 146 4.535900E-02 1.350280E+01 1.354880E+01 181 147 4.562570E-02 1.359770E+01 1.351640E+01 181 148 4.589250E-02 1.328130E+01 1.348410E+01 181 149 4.615930E-02 1.360530E+01 1.345180E+01 181 150 4.642600E-02 1.333660E+01 1.341940E+01 181 151 4.669280E-02 1.313420E+01 1.338710E+01 181 152 4.695960E-02 1.334140E+01 1.335480E+01 181 153 4.722630E-02 1.342910E+01 1.332240E+01 181 154 4.749310E-02 1.304410E+01 1.329010E+01 181 155 4.775980E-02 1.337550E+01 1.325780E+01 181 156 4.802660E-02 1.310000E+01 1.322540E+01 181 157 4.829340E-02 1.314320E+01 1.319310E+01 181 158 4.856010E-02 1.325180E+01 1.316080E+01 181 159 4.882690E-02 1.293540E+01 1.312840E+01 181 160 4.909370E-02 1.321260E+01 1.309610E+01 181 161 4.936040E-02 1.298590E+01 1.306380E+01 181 162 4.962720E-02 1.306810E+01 1.303140E+01 181 163 4.989390E-02 1.294860E+01 1.299910E+01 181 164 5.016070E-02 1.283720E+01 1.296470E+01 181 165 5.042750E-02 1.263680E+01 1.292900E+01 181 166 5.069420E-02 1.260900E+01 1.289330E+01 181 167 5.096100E-02 1.289840E+01 1.285750E+01 181 168 5.122780E-02 1.254140E+01 1.282180E+01 181 169 5.149450E-02 1.270640E+01 1.278610E+01 181 170 5.176130E-02 1.286610E+01 1.275030E+01 181 171 5.202800E-02 1.265950E+01 1.271460E+01 181 172 5.229480E-02 1.251250E+01 1.267880E+01 181 173 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1.367790E-01 8.567990E-02 181 1790 4.839170E-01 7.373910E-02 8.560940E-02 181 1791 4.841840E-01 1.248890E-01 8.553890E-02 181 1792 4.844500E-01 1.211890E-01 8.546870E-02 181 1793 4.847170E-01 9.880910E-02 8.539820E-02 181 1794 4.849840E-01 1.132990E-01 8.532770E-02 181 1795 4.852510E-01 1.140090E-01 8.525720E-02 181 1796 4.855180E-01 1.228490E-01 8.518670E-02 181 1797 4.857840E-01 1.690690E-01 8.511650E-02 181 1798 4.860510E-01 -8.823090E-02 8.504600E-02 181 1799 4.863180E-01 1.418190E-01 8.497550E-02 181 1800 4.865850E-01 7.796910E-02 8.490500E-02 181 1801 4.868510E-01 1.469290E-01 8.483480E-02 181 1802 4.871180E-01 5.607910E-02 8.476430E-02 181 1803 4.873850E-01 2.328290E-01 8.469380E-02 181 1804 4.876520E-01 1.780990E-01 8.462330E-02 181 1805 4.879180E-01 9.914910E-02 8.455310E-02 181 1806 4.881850E-01 1.524090E-01 8.448260E-02 181 1807 4.884520E-01 1.369390E-01 8.441210E-02 181 1808 4.887190E-01 3.338910E-02 8.434160E-02 181 1809 4.889850E-01 2.496490E-01 8.427140E-02 181 1810 4.892520E-01 9.499910E-02 8.420090E-02 181 1811 4.895190E-01 6.758910E-02 8.413040E-02 181 1812 4.897860E-01 1.632690E-01 8.405990E-02 181 1813 4.900530E-01 1.866190E-01 8.398960E-02 181 1814 4.903190E-01 9.794910E-02 8.392050E-02 181 1815 4.905860E-01 5.214910E-02 8.385120E-02 181 1816 4.908530E-01 8.300910E-02 8.378180E-02 181 1817 4.911200E-01 9.354910E-02 8.371250E-02 181 1818 4.913860E-01 1.128090E-01 8.364340E-02 181 1819 4.916530E-01 5.708910E-02 8.357400E-02 181 1820 4.919200E-01 8.160910E-02 8.350470E-02 181 1821 4.921870E-01 7.885910E-02 8.343530E-02 181 1822 4.924530E-01 4.503910E-02 8.336620E-02 181 1823 4.927200E-01 1.263090E-01 8.329680E-02 181 1824 4.929870E-01 3.048910E-02 8.322750E-02 181 1825 4.932540E-01 1.760910E-02 8.315810E-02 181 1826 4.935200E-01 1.520390E-01 8.308900E-02 181 1827 4.937870E-01 1.027690E-01 8.301970E-02 181 1828 4.940540E-01 7.149910E-02 8.295030E-02 181 1829 4.943210E-01 6.380910E-02 8.288100E-02 181 1830 4.945870E-01 3.567910E-02 8.281190E-02 181 1831 4.948540E-01 6.723910E-02 8.274250E-02 181 1832 4.951210E-01 2.485910E-02 8.267320E-02 181 1833 4.953880E-01 1.716910E-02 8.260380E-02 181 1834 4.956550E-01 5.794910E-02 8.253440E-02 181 1835 4.959210E-01 1.582790E-01 8.246530E-02 181 1836 4.961880E-01 1.161690E-01 8.239600E-02 181 1837 4.964550E-01 -4.751090E-02 8.232660E-02 181 1838 4.967220E-01 2.410910E-02 8.225730E-02 181 1839 4.969880E-01 8.834910E-02 8.218820E-02 181 1840 4.972550E-01 1.334590E-01 8.211880E-02 181 1841 4.975220E-01 2.090590E-01 8.204950E-02 181 1842 4.977890E-01 1.760490E-01 8.198010E-02 181 1843 4.980550E-01 1.086790E-01 8.191100E-02 181 1844 4.983220E-01 1.132890E-01 8.184170E-02 181 1845 4.985890E-01 -2.474090E-02 8.177230E-02 181 1846 4.988560E-01 1.861890E-01 8.170290E-02 181 1847 4.991220E-01 2.006490E-01 8.163380E-02 181 1848 4.993890E-01 1.702190E-01 8.156450E-02 181 1849 4.996560E-01 -8.799090E-02 8.149510E-02 181 1850 4.999230E-01 6.367910E-02 8.142580E-02 # data_SASDAW6_FIT_182 # _sas_model_fitting_details.id 182 _sas_model_fitting_details.unit 1/A _sas_model_fitting_details.chi_square 1.065024 _sas_model_fitting_details.p_value . _sas_model_fitting_details.result_id 157 # loop_ _sas_model_fitting.id _sas_model_fitting.ordinal _sas_model_fitting.momentum_transfer _sas_model_fitting.intensity _sas_model_fitting.fit 182 1 3.055000E-02 1.551000E+01 1.546000E+01 182 2 3.162000E-02 1.538000E+01 1.535000E+01 182 3 3.269000E-02 1.521000E+01 1.523000E+01 182 4 3.375000E-02 1.522000E+01 1.511000E+01 182 5 3.482000E-02 1.492000E+01 1.499000E+01 182 6 3.589000E-02 1.490000E+01 1.486000E+01 182 7 3.696000E-02 1.467000E+01 1.473000E+01 182 8 3.802000E-02 1.468000E+01 1.460000E+01 182 9 3.909000E-02 1.450000E+01 1.446000E+01 182 10 4.016000E-02 1.446000E+01 1.432000E+01 182 11 4.122000E-02 1.418000E+01 1.418000E+01 182 12 4.229000E-02 1.412000E+01 1.404000E+01 182 13 4.336000E-02 1.393000E+01 1.390000E+01 182 14 4.443000E-02 1.376000E+01 1.375000E+01 182 15 4.549000E-02 1.352000E+01 1.360000E+01 182 16 4.656000E-02 1.343000E+01 1.345000E+01 182 17 4.763000E-02 1.331000E+01 1.330000E+01 182 18 4.869000E-02 1.321000E+01 1.316000E+01 182 19 4.976000E-02 1.303000E+01 1.300000E+01 182 20 5.083000E-02 1.275000E+01 1.285000E+01 182 21 5.189000E-02 1.276000E+01 1.270000E+01 182 22 5.296000E-02 1.254000E+01 1.255000E+01 182 23 5.403000E-02 1.236000E+01 1.239000E+01 182 24 5.510000E-02 1.201000E+01 1.224000E+01 182 25 5.616000E-02 1.201000E+01 1.208000E+01 182 26 5.723000E-02 1.173000E+01 1.193000E+01 182 27 5.830000E-02 1.167000E+01 1.177000E+01 182 28 5.936000E-02 1.160000E+01 1.162000E+01 182 29 6.043000E-02 1.135000E+01 1.146000E+01 182 30 6.150000E-02 1.124000E+01 1.130000E+01 182 31 6.257000E-02 1.115000E+01 1.115000E+01 182 32 6.363000E-02 1.091000E+01 1.099000E+01 182 33 6.470000E-02 1.080000E+01 1.084000E+01 182 34 6.577000E-02 1.062000E+01 1.068000E+01 182 35 6.683000E-02 1.044000E+01 1.053000E+01 182 36 6.790000E-02 1.033000E+01 1.037000E+01 182 37 6.897000E-02 1.013000E+01 1.022000E+01 182 38 7.003000E-02 1.013000E+01 1.007000E+01 182 39 7.110000E-02 9.913000E+00 9.911000E+00 182 40 7.217000E-02 9.769000E+00 9.758000E+00 182 41 7.324000E-02 9.472000E+00 9.605000E+00 182 42 7.430000E-02 9.424000E+00 9.454000E+00 182 43 7.537000E-02 9.201000E+00 9.303000E+00 182 44 7.644000E-02 9.095000E+00 9.153000E+00 182 45 7.750000E-02 8.990000E+00 9.004000E+00 182 46 7.857000E-02 8.815000E+00 8.856000E+00 182 47 7.964000E-02 8.666000E+00 8.708000E+00 182 48 8.071000E-02 8.577000E+00 8.561000E+00 182 49 8.177000E-02 8.451000E+00 8.417000E+00 182 50 8.284000E-02 8.216000E+00 8.273000E+00 182 51 8.391000E-02 8.193000E+00 8.130000E+00 182 52 8.497000E-02 7.968000E+00 7.990000E+00 182 53 8.604000E-02 7.873000E+00 7.850000E+00 182 54 8.711000E-02 7.705000E+00 7.711000E+00 182 55 8.817000E-02 7.560000E+00 7.575000E+00 182 56 8.924000E-02 7.474000E+00 7.438000E+00 182 57 9.031000E-02 7.338000E+00 7.304000E+00 182 58 9.138000E-02 7.153000E+00 7.171000E+00 182 59 9.244000E-02 7.058000E+00 7.041000E+00 182 60 9.351000E-02 7.003000E+00 6.911000E+00 182 61 9.458000E-02 6.716000E+00 6.783000E+00 182 62 9.564000E-02 6.674000E+00 6.657000E+00 182 63 9.671000E-02 6.523000E+00 6.532000E+00 182 64 9.778000E-02 6.380000E+00 6.409000E+00 182 65 9.884000E-02 6.272000E+00 6.288000E+00 182 66 9.991000E-02 6.200000E+00 6.168000E+00 182 67 1.010000E-01 6.027000E+00 6.048000E+00 182 68 1.020000E-01 5.966000E+00 5.938000E+00 182 69 1.031000E-01 5.900000E+00 5.820000E+00 182 70 1.042000E-01 5.728000E+00 5.704000E+00 182 71 1.052000E-01 5.665000E+00 5.599000E+00 182 72 1.063000E-01 5.532000E+00 5.486000E+00 182 73 1.074000E-01 5.322000E+00 5.375000E+00 182 74 1.084000E-01 5.232000E+00 5.275000E+00 182 75 1.095000E-01 5.099000E+00 5.167000E+00 182 76 1.106000E-01 4.992000E+00 5.061000E+00 182 77 1.116000E-01 4.898000E+00 4.966000E+00 182 78 1.127000E-01 4.851000E+00 4.863000E+00 182 79 1.138000E-01 4.842000E+00 4.761000E+00 182 80 1.149000E-01 4.646000E+00 4.662000E+00 182 81 1.159000E-01 4.478000E+00 4.573000E+00 182 82 1.170000E-01 4.560000E+00 4.477000E+00 182 83 1.181000E-01 4.358000E+00 4.382000E+00 182 84 1.191000E-01 4.253000E+00 4.298000E+00 182 85 1.202000E-01 4.198000E+00 4.207000E+00 182 86 1.213000E-01 4.065000E+00 4.117000E+00 182 87 1.223000E-01 4.062000E+00 4.037000E+00 182 88 1.234000E-01 3.976000E+00 3.950000E+00 182 89 1.245000E-01 3.862000E+00 3.865000E+00 182 90 1.255000E-01 3.877000E+00 3.789000E+00 182 91 1.266000E-01 3.772000E+00 3.707000E+00 182 92 1.277000E-01 3.550000E+00 3.626000E+00 182 93 1.287000E-01 3.589000E+00 3.554000E+00 182 94 1.298000E-01 3.455000E+00 3.476000E+00 182 95 1.309000E-01 3.426000E+00 3.400000E+00 182 96 1.319000E-01 3.366000E+00 3.332000E+00 182 97 1.330000E-01 3.228000E+00 3.258000E+00 182 98 1.341000E-01 3.191000E+00 3.186000E+00 182 99 1.351000E-01 3.180000E+00 3.121000E+00 182 100 1.362000E-01 3.127000E+00 3.052000E+00 182 101 1.373000E-01 3.037000E+00 2.983000E+00 182 102 1.383000E-01 2.895000E+00 2.922000E+00 182 103 1.394000E-01 2.849000E+00 2.857000E+00 182 104 1.405000E-01 2.808000E+00 2.792000E+00 182 105 1.415000E-01 2.800000E+00 2.734000E+00 182 106 1.426000E-01 2.789000E+00 2.672000E+00 182 107 1.437000E-01 2.590000E+00 2.611000E+00 182 108 1.447000E-01 2.535000E+00 2.556000E+00 182 109 1.458000E-01 2.508000E+00 2.498000E+00 182 110 1.469000E-01 2.435000E+00 2.440000E+00 182 111 1.479000E-01 2.436000E+00 2.389000E+00 182 112 1.490000E-01 2.321000E+00 2.333000E+00 182 113 1.501000E-01 2.318000E+00 2.279000E+00 182 114 1.511000E-01 2.296000E+00 2.230000E+00 182 115 1.522000E-01 2.157000E+00 2.178000E+00 182 116 1.533000E-01 2.160000E+00 2.127000E+00 182 117 1.543000E-01 2.078000E+00 2.081000E+00 182 118 1.554000E-01 2.006000E+00 2.031000E+00 182 119 1.565000E-01 1.893000E+00 1.983000E+00 182 120 1.575000E-01 1.961000E+00 1.940000E+00 182 121 1.586000E-01 1.937000E+00 1.893000E+00 182 122 1.597000E-01 1.923000E+00 1.848000E+00 182 123 1.607000E-01 1.756000E+00 1.807000E+00 182 124 1.618000E-01 1.765000E+00 1.763000E+00 182 125 1.629000E-01 1.720000E+00 1.720000E+00 182 126 1.639000E-01 1.756000E+00 1.682000E+00 182 127 1.650000E-01 1.611000E+00 1.641000E+00 182 128 1.661000E-01 1.564000E+00 1.601000E+00 182 129 1.671000E-01 1.559000E+00 1.565000E+00 182 130 1.682000E-01 1.549000E+00 1.526000E+00 182 131 1.693000E-01 1.429000E+00 1.488000E+00 182 132 1.703000E-01 1.452000E+00 1.454000E+00 182 133 1.714000E-01 1.343000E+00 1.418000E+00 182 134 1.725000E-01 1.394000E+00 1.382000E+00 182 135 1.735000E-01 1.395000E+00 1.350000E+00 182 136 1.746000E-01 1.227000E+00 1.316000E+00 182 137 1.757000E-01 1.318000E+00 1.283000E+00 182 138 1.767000E-01 1.256000E+00 1.254000E+00 182 139 1.778000E-01 1.123000E+00 1.222000E+00 182 140 1.789000E-01 1.164000E+00 1.191000E+00 182 141 1.799000E-01 1.169000E+00 1.163000E+00 182 142 1.810000E-01 1.186000E+00 1.133000E+00 182 143 1.821000E-01 1.153000E+00 1.104000E+00 182 144 1.831000E-01 1.021000E+00 1.078000E+00 182 145 1.842000E-01 1.042000E+00 1.051000E+00 182 146 1.853000E-01 9.438000E-01 1.024000E+00 182 147 1.863000E-01 1.036000E+00 9.998000E-01 182 148 1.874000E-01 9.641000E-01 9.741000E-01 182 149 1.885000E-01 8.925000E-01 9.490000E-01 182 150 1.895000E-01 9.293000E-01 9.268000E-01 182 151 1.906000E-01 8.973000E-01 9.029000E-01 182 152 1.917000E-01 8.660000E-01 8.796000E-01 182 153 1.927000E-01 8.696000E-01 8.590000E-01 182 154 1.938000E-01 8.903000E-01 8.369000E-01 182 155 1.949000E-01 8.144000E-01 8.154000E-01 182 156 1.959000E-01 7.998000E-01 7.964000E-01 182 157 1.970000E-01 7.602000E-01 7.760000E-01 182 158 1.981000E-01 8.115000E-01 7.562000E-01 182 159 1.991000E-01 6.683000E-01 7.387000E-01 182 160 2.002000E-01 7.537000E-01 7.200000E-01 182 161 2.013000E-01 6.779000E-01 7.018000E-01 182 162 2.023000E-01 7.241000E-01 6.857000E-01 182 163 2.034000E-01 6.551000E-01 6.686000E-01 182 164 2.045000E-01 6.373000E-01 6.519000E-01 182 165 2.055000E-01 7.071000E-01 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182 187 2.290000E-01 3.600000E-01 3.931000E-01 182 188 2.301000E-01 4.136000E-01 3.854000E-01 182 189 2.312000E-01 3.492000E-01 3.780000E-01 182 190 2.322000E-01 2.876000E-01 3.715000E-01 182 191 2.333000E-01 3.433000E-01 3.646000E-01 182 192 2.344000E-01 2.960000E-01 3.579000E-01 182 193 2.354000E-01 3.255000E-01 3.521000E-01 182 194 2.365000E-01 3.211000E-01 3.458000E-01 182 195 2.376000E-01 2.972000E-01 3.398000E-01 182 196 2.386000E-01 3.200000E-01 3.345000E-01 182 197 2.397000E-01 3.673000E-01 3.288000E-01 182 198 2.408000E-01 2.835000E-01 3.234000E-01 182 199 2.418000E-01 3.542000E-01 3.186000E-01 182 200 2.429000E-01 3.048000E-01 3.135000E-01 182 201 2.440000E-01 3.187000E-01 3.085000E-01 182 202 2.450000E-01 2.822000E-01 3.041000E-01 182 203 2.461000E-01 3.265000E-01 2.995000E-01 182 204 2.472000E-01 3.018000E-01 2.950000E-01 182 205 2.482000E-01 2.526000E-01 2.910000E-01 182 206 2.493000E-01 3.952000E-01 2.867000E-01 182 207 2.504000E-01 3.024000E-01 2.826000E-01 182 208 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182 442 5.011000E-01 2.036000E-01 1.733000E-01 182 443 5.022000E-01 1.877000E-01 1.727000E-01 182 444 5.033000E-01 1.267000E-01 1.721000E-01 182 445 5.043000E-01 1.872000E-01 1.716000E-01 182 446 5.054000E-01 1.683000E-01 1.711000E-01 182 447 5.065000E-01 1.618000E-01 1.705000E-01 182 448 5.075000E-01 1.955000E-01 1.700000E-01 182 449 5.086000E-01 1.638000E-01 1.695000E-01 182 450 5.097000E-01 1.864000E-01 1.690000E-01 182 451 5.107000E-01 1.652000E-01 1.685000E-01 182 452 5.118000E-01 1.677000E-01 1.680000E-01 182 453 5.129000E-01 1.678000E-01 1.675000E-01 182 454 5.139000E-01 1.320000E-01 1.671000E-01 182 455 5.150000E-01 1.177000E-01 1.666000E-01 182 456 5.161000E-01 1.672000E-01 1.661000E-01 182 457 5.171000E-01 1.938000E-01 1.657000E-01 182 458 5.182000E-01 2.405000E-01 1.653000E-01 182 459 5.193000E-01 1.330000E-01 1.649000E-01 182 460 5.203000E-01 1.239000E-01 1.645000E-01 182 461 5.214000E-01 1.787000E-01 1.641000E-01 182 462 5.225000E-01 1.790000E-01 1.638000E-01 182 463 5.235000E-01 1.465000E-01 1.634000E-01 182 464 5.246000E-01 1.969000E-01 1.631000E-01 182 465 5.257000E-01 1.414000E-01 1.627000E-01 182 466 5.267000E-01 1.813000E-01 1.624000E-01 182 467 5.278000E-01 1.846000E-01 1.621000E-01 182 468 5.289000E-01 2.208000E-01 1.618000E-01 182 469 5.299000E-01 1.581000E-01 1.616000E-01 182 470 5.310000E-01 2.010000E-01 1.613000E-01 182 471 5.321000E-01 1.416000E-01 1.610000E-01 182 472 5.331000E-01 1.694000E-01 1.607000E-01 182 473 5.342000E-01 1.597000E-01 1.605000E-01 182 474 5.353000E-01 1.213000E-01 1.602000E-01 182 475 5.363000E-01 1.365000E-01 1.600000E-01 182 476 5.374000E-01 2.110000E-01 1.597000E-01 182 477 5.385000E-01 1.218000E-01 1.595000E-01 182 478 5.395000E-01 1.773000E-01 1.593000E-01 182 479 5.406000E-01 2.146000E-01 1.591000E-01 182 480 5.417000E-01 1.615000E-01 1.588000E-01 182 481 5.427000E-01 1.489000E-01 1.586000E-01 182 482 5.438000E-01 1.676000E-01 1.584000E-01 182 483 5.449000E-01 1.926000E-01 1.582000E-01 182 484 5.457000E-01 1.459000E-01 1.581000E-01 # data_SASDAW6_MODEL_223 # _sas_model.id 223 _sas_model.type_of_model atomic _sas_model.software crysol _sas_model.version . _sas_model.symmetry P1 _sas_model.comment . _sas_model.fitting_id 181 _sas_model.radius 1.90 # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.Cartn_x_esd _atom_site.Cartn_y_esd _atom_site.Cartn_z_esd _atom_site.occupancy_esd _atom_site.B_iso_or_equiv_esd _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET A 223 1 . 6.067 -34.930 -23.737 1.00 0.00 ? ? ? ? ? . 1 MET A N 223 ATOM 2 C CA . MET A 223 1 . 5.829 -33.463 -23.848 1.00 0.00 ? ? ? ? ? . 1 MET A CA 223 ATOM 3 C C . MET A 223 1 . 5.106 -32.968 -22.594 1.00 0.00 ? ? ? ? ? . 1 MET A C 223 ATOM 4 O O . MET A 223 1 . 5.070 -31.786 -22.311 1.00 0.00 ? ? ? ? ? . 1 MET A O 223 ATOM 5 C CB . MET A 223 1 . 4.967 -33.178 -25.079 1.00 0.00 ? ? ? ? ? . 1 MET A CB 223 ATOM 6 C CG . MET A 223 1 . 3.520 -33.585 -24.794 1.00 0.00 ? ? ? ? ? . 1 MET A CG 223 ATOM 7 S SD . MET A 223 1 . 2.823 -34.395 -26.254 1.00 0.00 ? ? ? ? ? . 1 MET A SD 223 ATOM 8 C CE . MET A 223 1 . 1.081 -34.069 -25.884 1.00 0.00 ? ? ? ? ? . 1 MET A CE 223 ATOM 9 H H1 . MET A 223 1 . 5.174 -35.439 -23.890 1.00 0.00 ? ? ? ? ? . 1 MET A H1 223 ATOM 10 H H2 . MET A 223 1 . 6.436 -35.151 -22.789 1.00 0.00 ? ? ? ? ? . 1 MET A H2 223 ATOM 11 H H3 . MET A 223 1 . 6.758 -35.225 -24.455 1.00 0.00 ? ? ? ? ? . 1 MET A H3 223 ATOM 12 H HA . MET A 223 1 . 6.775 -32.950 -23.943 1.00 0.00 ? ? ? ? ? . 1 MET A HA 223 ATOM 13 H HB2 . MET A 223 1 . 5.007 -32.123 -25.310 1.00 0.00 ? ? ? ? ? . 1 MET A HB2 223 ATOM 14 H HB3 . MET A 223 1 . 5.339 -33.745 -25.918 1.00 0.00 ? ? ? ? ? . 1 MET A HB3 223 ATOM 15 H HG2 . MET A 223 1 . 3.495 -34.267 -23.958 1.00 0.00 ? ? ? ? ? . 1 MET A HG2 223 ATOM 16 H HG3 . MET A 223 1 . 2.939 -32.706 -24.558 1.00 0.00 ? ? ? ? ? . 1 MET A HG3 223 ATOM 17 H HE1 . MET A 223 1 . 0.713 -33.294 -26.542 1.00 0.00 ? ? ? ? ? . 1 MET A HE1 223 ATOM 18 H HE2 . MET A 223 1 . 0.984 -33.744 -24.861 1.00 0.00 ? ? ? ? ? . 1 MET A HE2 223 ATOM 19 H HE3 . MET A 223 1 . 0.508 -34.975 -26.028 1.00 0.00 ? ? ? ? ? . 1 MET A HE3 223 ATOM 20 N N . ALA A 223 2 . 4.528 -33.863 -21.839 1.00 0.00 ? ? ? ? ? . 2 ALA A N 223 ATOM 21 C CA . ALA A 223 2 . 3.808 -33.442 -20.603 1.00 0.00 ? ? ? ? ? . 2 ALA A CA 223 ATOM 22 C C . ALA A 223 2 . 3.038 -34.636 -20.032 1.00 0.00 ? ? ? ? ? . 2 ALA A C 223 ATOM 23 O O . ALA A 223 2 . 1.835 -34.732 -20.166 1.00 0.00 ? ? ? ? ? . 2 ALA A O 223 ATOM 24 C CB . ALA A 223 2 . 2.828 -32.317 -20.943 1.00 0.00 ? ? ? ? ? . 2 ALA A CB 223 ATOM 25 H H . ALA A 223 2 . 4.568 -34.810 -22.084 1.00 0.00 ? ? ? ? ? . 2 ALA A H 223 ATOM 26 H HA . ALA A 223 2 . 4.521 -33.091 -19.874 1.00 0.00 ? ? ? ? ? . 2 ALA A HA 223 ATOM 27 H HB1 . ALA A 223 2 . 3.191 -31.387 -20.531 1.00 0.00 ? ? ? ? ? . 2 ALA A HB1 223 ATOM 28 H HB2 . ALA A 223 2 . 1.860 -32.543 -20.520 1.00 0.00 ? ? ? ? ? . 2 ALA A HB2 223 ATOM 29 H HB3 . ALA A 223 2 . 2.739 -32.226 -22.015 1.00 0.00 ? ? ? ? ? . 2 ALA A HB3 223 ATOM 30 N N . TYR A 223 3 . 3.724 -35.545 -19.394 1.00 0.00 ? ? ? ? ? . 3 TYR A N 223 ATOM 31 C CA . TYR A 223 3 . 3.030 -36.730 -18.813 1.00 0.00 ? ? ? ? ? . 3 TYR A CA 223 ATOM 32 C C . TYR A 223 3 . 2.223 -36.296 -17.587 1.00 0.00 ? ? ? ? ? . 3 TYR A C 223 ATOM 33 O O . TYR A 223 3 . 1.769 -37.111 -16.810 1.00 0.00 ? ? ? ? ? . 3 TYR A O 223 ATOM 34 C CB . TYR A 223 3 . 4.066 -37.776 -18.398 1.00 0.00 ? ? ? ? ? . 3 TYR A CB 223 ATOM 35 C CG . TYR A 223 3 . 3.410 -38.808 -17.513 1.00 0.00 ? ? ? ? ? . 3 TYR A CG 223 ATOM 36 C CD1 . TYR A 223 3 . 2.696 -39.868 -18.084 1.00 0.00 ? ? ? ? ? . 3 TYR A CD1 223 ATOM 37 C CD2 . TYR A 223 3 . 3.516 -38.706 -16.121 1.00 0.00 ? ? ? ? ? . 3 TYR A CD2 223 ATOM 38 C CE1 . TYR A 223 3 . 2.086 -40.824 -17.264 1.00 0.00 ? ? ? ? ? . 3 TYR A CE1 223 ATOM 39 C CE2 . TYR A 223 3 . 2.907 -39.663 -15.300 1.00 0.00 ? ? ? ? ? . 3 TYR A CE2 223 ATOM 40 C CZ . TYR A 223 3 . 2.193 -40.723 -15.871 1.00 0.00 ? ? ? ? ? . 3 TYR A CZ 223 ATOM 41 O OH . TYR A 223 3 . 1.592 -41.665 -15.062 1.00 0.00 ? ? ? ? ? . 3 TYR A OH 223 ATOM 42 H H . TYR A 223 3 . 4.694 -35.448 -19.296 1.00 0.00 ? ? ? ? ? . 3 TYR A H 223 ATOM 43 H HA . TYR A 223 3 . 2.365 -37.153 -19.550 1.00 0.00 ? ? ? ? ? . 3 TYR A HA 223 ATOM 44 H HB2 . TYR A 223 3 . 4.465 -38.257 -19.279 1.00 0.00 ? ? ? ? ? . 3 TYR A HB2 223 ATOM 45 H HB3 . TYR A 223 3 . 4.867 -37.296 -17.856 1.00 0.00 ? ? ? ? ? . 3 TYR A HB3 223 ATOM 46 H HD1 . TYR A 223 3 . 2.614 -39.947 -19.158 1.00 0.00 ? ? ? ? ? . 3 TYR A HD1 223 ATOM 47 H HD2 . TYR A 223 3 . 4.067 -37.888 -15.680 1.00 0.00 ? ? ? ? ? . 3 TYR A HD2 223 ATOM 48 H HE1 . TYR A 223 3 . 1.535 -41.643 -17.704 1.00 0.00 ? ? ? ? ? . 3 TYR A HE1 223 ATOM 49 H HE2 . TYR A 223 3 . 2.989 -39.584 -14.226 1.00 0.00 ? ? ? ? ? . 3 TYR A HE2 223 ATOM 50 H HH . TYR A 223 3 . 1.731 -41.403 -14.148 1.00 0.00 ? ? ? ? ? . 3 TYR A HH 223 ATOM 51 N N . SER A 223 4 . 2.041 -35.015 -17.411 1.00 0.00 ? ? ? ? ? . 4 SER A N 223 ATOM 52 C CA . SER A 223 4 . 1.262 -34.528 -16.237 1.00 0.00 ? ? ? ? ? . 4 SER A CA 223 ATOM 53 C C . SER A 223 4 . 0.050 -33.732 -16.725 1.00 0.00 ? ? ? ? ? . 4 SER A C 223 ATOM 54 O O . SER A 223 4 . -0.045 -33.372 -17.882 1.00 0.00 ? ? ? ? ? . 4 SER A O 223 ATOM 55 C CB . SER A 223 4 . 2.149 -33.628 -15.374 1.00 0.00 ? ? ? ? ? . 4 SER A CB 223 ATOM 56 O OG . SER A 223 4 . 2.831 -32.702 -16.209 1.00 0.00 ? ? ? ? ? . 4 SER A OG 223 ATOM 57 H H . SER A 223 4 . 2.415 -34.374 -18.050 1.00 0.00 ? ? ? ? ? . 4 SER A H 223 ATOM 58 H HA . SER A 223 4 . 0.928 -35.372 -15.652 1.00 0.00 ? ? ? ? ? . 4 SER A HA 223 ATOM 59 H HB2 . SER A 223 4 . 1.540 -33.087 -14.670 1.00 0.00 ? ? ? ? ? . 4 SER A HB2 223 ATOM 60 H HB3 . SER A 223 4 . 2.863 -34.238 -14.837 1.00 0.00 ? ? ? ? ? . 4 SER A HB3 223 ATOM 61 H HG . SER A 223 4 . 2.822 -31.847 -15.773 1.00 0.00 ? ? ? ? ? . 4 SER A HG 223 ATOM 62 N N . GLU A 223 5 . -0.879 -33.456 -15.851 1.00 0.00 ? ? ? ? ? . 5 GLU A N 223 ATOM 63 C CA . GLU A 223 5 . -2.085 -32.684 -16.264 1.00 0.00 ? ? ? ? ? . 5 GLU A CA 223 ATOM 64 C C . GLU A 223 5 . -1.832 -31.190 -16.054 1.00 0.00 ? ? ? ? ? . 5 GLU A C 223 ATOM 65 O O . GLU A 223 5 . -2.750 -30.410 -15.904 1.00 0.00 ? ? ? ? ? . 5 GLU A O 223 ATOM 66 C CB . GLU A 223 5 . -3.284 -33.120 -15.418 1.00 0.00 ? ? ? ? ? . 5 GLU A CB 223 ATOM 67 C CG . GLU A 223 5 . -3.757 -34.502 -15.874 1.00 0.00 ? ? ? ? ? . 5 GLU A CG 223 ATOM 68 C CD . GLU A 223 5 . -2.986 -35.582 -15.114 1.00 0.00 ? ? ? ? ? . 5 GLU A CD 223 ATOM 69 O OE1 . GLU A 223 5 . -2.887 -35.470 -13.903 1.00 0.00 ? ? ? ? ? . 5 GLU A OE1 223 ATOM 70 O OE2 . GLU A 223 5 . -2.507 -36.503 -15.756 1.00 0.00 ? ? ? ? ? . 5 GLU A OE2 223 ATOM 71 H H . GLU A 223 5 . -0.784 -33.756 -14.923 1.00 0.00 ? ? ? ? ? . 5 GLU A H 223 ATOM 72 H HA . GLU A 223 5 . -2.294 -32.871 -17.307 1.00 0.00 ? ? ? ? ? . 5 GLU A HA 223 ATOM 73 H HB2 . GLU A 223 5 . -2.993 -33.164 -14.378 1.00 0.00 ? ? ? ? ? . 5 GLU A HB2 223 ATOM 74 H HB3 . GLU A 223 5 . -4.088 -32.409 -15.537 1.00 0.00 ? ? ? ? ? . 5 GLU A HB3 223 ATOM 75 H HG2 . GLU A 223 5 . -4.814 -34.604 -15.675 1.00 0.00 ? ? ? ? ? . 5 GLU A HG2 223 ATOM 76 H HG3 . GLU A 223 5 . -3.578 -34.613 -16.934 1.00 0.00 ? ? ? ? ? . 5 GLU A HG3 223 ATOM 77 N N . LYS A 223 6 . -0.591 -30.786 -16.041 1.00 0.00 ? ? ? ? ? . 6 LYS A N 223 ATOM 78 C CA . LYS A 223 6 . -0.281 -29.343 -15.839 1.00 0.00 ? ? ? ? ? . 6 LYS A CA 223 ATOM 79 C C . LYS A 223 6 . 0.471 -28.804 -17.058 1.00 0.00 ? ? ? ? ? . 6 LYS A C 223 ATOM 80 O O . LYS A 223 6 . 1.525 -29.293 -17.416 1.00 0.00 ? ? ? ? ? . 6 LYS A O 223 ATOM 81 C CB . LYS A 223 6 . 0.589 -29.177 -14.592 1.00 0.00 ? ? ? ? ? . 6 LYS A CB 223 ATOM 82 C CG . LYS A 223 6 . -0.278 -28.713 -13.421 1.00 0.00 ? ? ? ? ? . 6 LYS A CG 223 ATOM 83 C CD . LYS A 223 6 . -1.337 -29.775 -13.119 1.00 0.00 ? ? ? ? ? . 6 LYS A CD 223 ATOM 84 C CE . LYS A 223 6 . -1.547 -29.870 -11.607 1.00 0.00 ? ? ? ? ? . 6 LYS A CE 223 ATOM 85 N NZ . LYS A 223 6 . -0.616 -30.888 -11.042 1.00 0.00 ? ? ? ? ? . 6 LYS A NZ 223 ATOM 86 H H . LYS A 223 6 . 0.136 -31.432 -16.163 1.00 0.00 ? ? ? ? ? . 6 LYS A H 223 ATOM 87 H HA . LYS A 223 6 . -1.201 -28.791 -15.712 1.00 0.00 ? ? ? ? ? . 6 LYS A HA 223 ATOM 88 H HB2 . LYS A 223 6 . 1.051 -30.122 -14.347 1.00 0.00 ? ? ? ? ? . 6 LYS A HB2 223 ATOM 89 H HB3 . LYS A 223 6 . 1.355 -28.441 -14.783 1.00 0.00 ? ? ? ? ? . 6 LYS A HB3 223 ATOM 90 H HG2 . LYS A 223 6 . 0.343 -28.564 -12.550 1.00 0.00 ? ? ? ? ? . 6 LYS A HG2 223 ATOM 91 H HG3 . LYS A 223 6 . -0.765 -27.785 -13.679 1.00 0.00 ? ? ? ? ? . 6 LYS A HG3 223 ATOM 92 H HD2 . LYS A 223 6 . -2.268 -29.501 -13.595 1.00 0.00 ? ? ? ? ? . 6 LYS A HD2 223 ATOM 93 H HD3 . LYS A 223 6 . -1.008 -30.730 -13.496 1.00 0.00 ? ? ? ? ? . 6 LYS A HD3 223 ATOM 94 H HE2 . LYS A 223 6 . -1.348 -28.910 -11.154 1.00 0.00 ? ? ? ? ? . 6 LYS A HE2 223 ATOM 95 H HE3 . LYS A 223 6 . -2.567 -30.163 -11.402 1.00 0.00 ? ? ? ? ? . 6 LYS A HE3 223 ATOM 96 H HZ1 . LYS A 223 6 . 0.292 -30.848 -11.548 1.00 0.00 ? ? ? ? ? . 6 LYS A HZ1 223 ATOM 97 H HZ2 . LYS A 223 6 . -1.032 -31.836 -11.150 1.00 0.00 ? ? ? ? ? . 6 LYS A HZ2 223 ATOM 98 H HZ3 . LYS A 223 6 . -0.457 -30.692 -10.033 1.00 0.00 ? ? ? ? ? . 6 LYS A HZ3 223 ATOM 99 N N . VAL A 223 7 . -0.062 -27.799 -17.697 1.00 0.00 ? ? ? ? ? . 7 VAL A N 223 ATOM 100 C CA . VAL A 223 7 . 0.623 -27.227 -18.889 1.00 0.00 ? ? ? ? ? . 7 VAL A CA 223 ATOM 101 C C . VAL A 223 7 . 1.291 -25.906 -18.504 1.00 0.00 ? ? ? ? ? . 7 VAL A C 223 ATOM 102 O O . VAL A 223 7 . 2.080 -25.359 -19.248 1.00 0.00 ? ? ? ? ? . 7 VAL A O 223 ATOM 103 C CB . VAL A 223 7 . -0.402 -26.975 -19.996 1.00 0.00 ? ? ? ? ? . 7 VAL A CB 223 ATOM 104 C CG1 . VAL A 223 7 . 0.207 -26.055 -21.055 1.00 0.00 ? ? ? ? ? . 7 VAL A CG1 223 ATOM 105 C CG2 . VAL A 223 7 . -0.793 -28.306 -20.641 1.00 0.00 ? ? ? ? ? . 7 VAL A CG2 223 ATOM 106 H H . VAL A 223 7 . -0.911 -27.419 -17.390 1.00 0.00 ? ? ? ? ? . 7 VAL A H 223 ATOM 107 H HA . VAL A 223 7 . 1.372 -27.920 -19.242 1.00 0.00 ? ? ? ? ? . 7 VAL A HA 223 ATOM 108 H HB . VAL A 223 7 . -1.279 -26.505 -19.573 1.00 0.00 ? ? ? ? ? . 7 VAL A HB 223 ATOM 109 H HG11 . VAL A 223 7 . 1.265 -26.255 -21.140 1.00 0.00 ? ? ? ? ? . 7 VAL A HG11 223 ATOM 110 H HG12 . VAL A 223 7 . 0.057 -25.025 -20.766 1.00 0.00 ? ? ? ? ? . 7 VAL A HG12 223 ATOM 111 H HG13 . VAL A 223 7 . -0.271 -26.235 -22.007 1.00 0.00 ? ? ? ? ? . 7 VAL A HG13 223 ATOM 112 H HG21 . VAL A 223 7 . -0.959 -29.045 -19.870 1.00 0.00 ? ? ? ? ? . 7 VAL A HG21 223 ATOM 113 H HG22 . VAL A 223 7 . 0.002 -28.637 -21.292 1.00 0.00 ? ? ? ? ? . 7 VAL A HG22 223 ATOM 114 H HG23 . VAL A 223 7 . -1.699 -28.176 -21.215 1.00 0.00 ? ? ? ? ? . 7 VAL A HG23 223 ATOM 115 N N . ILE A 223 8 . 0.981 -25.391 -17.345 1.00 0.00 ? ? ? ? ? . 8 ILE A N 223 ATOM 116 C CA . ILE A 223 8 . 1.599 -24.108 -16.911 1.00 0.00 ? ? ? ? ? . 8 ILE A CA 223 ATOM 117 C C . ILE A 223 8 . 3.046 -24.048 -17.405 1.00 0.00 ? ? ? ? ? . 8 ILE A C 223 ATOM 118 O O . ILE A 223 8 . 3.718 -25.055 -17.508 1.00 0.00 ? ? ? ? ? . 8 ILE A O 223 ATOM 119 C CB . ILE A 223 8 . 1.574 -24.021 -15.383 1.00 0.00 ? ? ? ? ? . 8 ILE A CB 223 ATOM 120 C CG1 . ILE A 223 8 . 0.723 -25.164 -14.824 1.00 0.00 ? ? ? ? ? . 8 ILE A CG1 223 ATOM 121 C CG2 . ILE A 223 8 . 0.968 -22.682 -14.956 1.00 0.00 ? ? ? ? ? . 8 ILE A CG2 223 ATOM 122 C CD1 . ILE A 223 8 . 0.763 -25.130 -13.295 1.00 0.00 ? ? ? ? ? . 8 ILE A CD1 223 ATOM 123 H H . ILE A 223 8 . 0.343 -25.851 -16.760 1.00 0.00 ? ? ? ? ? . 8 ILE A H 223 ATOM 124 H HA . ILE A 223 8 . 1.041 -23.281 -17.328 1.00 0.00 ? ? ? ? ? . 8 ILE A HA 223 ATOM 125 H HB . ILE A 223 8 . 2.581 -24.098 -15.001 1.00 0.00 ? ? ? ? ? . 8 ILE A HB 223 ATOM 126 H HG12 . ILE A 223 8 . -0.298 -25.051 -15.160 1.00 0.00 ? ? ? ? ? . 8 ILE A HG12 223 ATOM 127 H HG13 . ILE A 223 8 . 1.114 -26.108 -15.172 1.00 0.00 ? ? ? ? ? . 8 ILE A HG13 223 ATOM 128 H HG21 . ILE A 223 8 . 0.986 -22.607 -13.878 1.00 0.00 ? ? ? ? ? . 8 ILE A HG21 223 ATOM 129 H HG22 . ILE A 223 8 . -0.053 -22.621 -15.304 1.00 0.00 ? ? ? ? ? . 8 ILE A HG22 223 ATOM 130 H HG23 . ILE A 223 8 . 1.543 -21.874 -15.383 1.00 0.00 ? ? ? ? ? . 8 ILE A HG23 223 ATOM 131 H HD11 . ILE A 223 8 . -0.181 -25.480 -12.902 1.00 0.00 ? ? ? ? ? . 8 ILE A HD11 223 ATOM 132 H HD12 . ILE A 223 8 . 0.939 -24.118 -12.961 1.00 0.00 ? ? ? ? ? . 8 ILE A HD12 223 ATOM 133 H HD13 . ILE A 223 8 . 1.559 -25.770 -12.942 1.00 0.00 ? ? ? ? ? . 8 ILE A HD13 223 ATOM 134 N N . ASP A 223 9 . 3.530 -22.876 -17.713 1.00 0.00 ? ? ? ? ? . 9 ASP A N 223 ATOM 135 C CA . ASP A 223 9 . 4.932 -22.756 -18.203 1.00 0.00 ? ? ? ? ? . 9 ASP A CA 223 ATOM 136 C C . ASP A 223 9 . 5.891 -22.712 -17.012 1.00 0.00 ? ? ? ? ? . 9 ASP A C 223 ATOM 137 O O . ASP A 223 9 . 7.022 -23.148 -17.098 1.00 0.00 ? ? ? ? ? . 9 ASP A O 223 ATOM 138 C CB . ASP A 223 9 . 5.076 -21.470 -19.020 1.00 0.00 ? ? ? ? ? . 9 ASP A CB 223 ATOM 139 C CG . ASP A 223 9 . 4.180 -21.550 -20.258 1.00 0.00 ? ? ? ? ? . 9 ASP A CG 223 ATOM 140 O OD1 . ASP A 223 9 . 4.153 -22.601 -20.877 1.00 0.00 ? ? ? ? ? . 9 ASP A OD1 223 ATOM 141 O OD2 . ASP A 223 9 . 3.538 -20.559 -20.564 1.00 0.00 ? ? ? ? ? . 9 ASP A OD2 223 ATOM 142 H H . ASP A 223 9 . 2.971 -22.076 -17.625 1.00 0.00 ? ? ? ? ? . 9 ASP A H 223 ATOM 143 H HA . ASP A 223 9 . 5.170 -23.606 -18.825 1.00 0.00 ? ? ? ? ? . 9 ASP A HA 223 ATOM 144 H HB2 . ASP A 223 9 . 4.782 -20.625 -18.414 1.00 0.00 ? ? ? ? ? . 9 ASP A HB2 223 ATOM 145 H HB3 . ASP A 223 9 . 6.104 -21.352 -19.329 1.00 0.00 ? ? ? ? ? . 9 ASP A HB3 223 ATOM 146 N N . HIS A 223 10 . 5.452 -22.187 -15.902 1.00 0.00 ? ? ? ? ? . 10 HIS A N 223 ATOM 147 C CA . HIS A 223 10 . 6.344 -22.115 -14.710 1.00 0.00 ? ? ? ? ? . 10 HIS A CA 223 ATOM 148 C C . HIS A 223 10 . 5.606 -21.423 -13.562 1.00 0.00 ? ? ? ? ? . 10 HIS A C 223 ATOM 149 O O . HIS A 223 10 . 4.632 -20.725 -13.769 1.00 0.00 ? ? ? ? ? . 10 HIS A O 223 ATOM 150 C CB . HIS A 223 10 . 7.601 -21.318 -15.064 1.00 0.00 ? ? ? ? ? . 10 HIS A CB 223 ATOM 151 C CG . HIS A 223 10 . 8.781 -22.246 -15.163 1.00 0.00 ? ? ? ? ? . 10 HIS A CG 223 ATOM 152 N ND1 . HIS A 223 10 . 8.636 -23.623 -15.276 1.00 0.00 ? ? ? ? ? . 10 HIS A ND1 223 ATOM 153 C CD2 . HIS A 223 10 . 10.134 -22.012 -15.166 1.00 0.00 ? ? ? ? ? . 10 HIS A CD2 223 ATOM 154 C CE1 . HIS A 223 10 . 9.868 -24.157 -15.341 1.00 0.00 ? ? ? ? ? . 10 HIS A CE1 223 ATOM 155 N NE2 . HIS A 223 10 . 10.814 -23.219 -15.278 1.00 0.00 ? ? ? ? ? . 10 HIS A NE2 223 ATOM 156 H H . HIS A 223 10 . 4.537 -21.839 -15.852 1.00 0.00 ? ? ? ? ? . 10 HIS A H 223 ATOM 157 H HA . HIS A 223 10 . 6.621 -23.114 -14.407 1.00 0.00 ? ? ? ? ? . 10 HIS A HA 223 ATOM 158 H HB2 . HIS A 223 10 . 7.455 -20.820 -16.012 1.00 0.00 ? ? ? ? ? . 10 HIS A HB2 223 ATOM 159 H HB3 . HIS A 223 10 . 7.787 -20.580 -14.298 1.00 0.00 ? ? ? ? ? . 10 HIS A HB3 223 ATOM 160 H HD2 . HIS A 223 10 . 10.598 -21.040 -15.095 1.00 0.00 ? ? ? ? ? . 10 HIS A HD2 223 ATOM 161 H HE1 . HIS A 223 10 . 10.067 -25.216 -15.433 1.00 0.00 ? ? ? ? ? . 10 HIS A HE1 223 ATOM 162 H HE2 . HIS A 223 10 . 11.784 -23.354 -15.304 1.00 0.00 ? ? ? ? ? . 10 HIS A HE2 223 ATOM 163 N N . TYR A 223 11 . 6.063 -21.608 -12.354 1.00 0.00 ? ? ? ? ? . 11 TYR A N 223 ATOM 164 C CA . TYR A 223 11 . 5.389 -20.958 -11.195 1.00 0.00 ? ? ? ? ? . 11 TYR A CA 223 ATOM 165 C C . TYR A 223 11 . 5.627 -19.448 -11.246 1.00 0.00 ? ? ? ? ? . 11 TYR A C 223 ATOM 166 O O . TYR A 223 11 . 4.754 -18.662 -10.937 1.00 0.00 ? ? ? ? ? . 11 TYR A O 223 ATOM 167 C CB . TYR A 223 11 . 5.960 -21.518 -9.890 1.00 0.00 ? ? ? ? ? . 11 TYR A CB 223 ATOM 168 C CG . TYR A 223 11 . 6.432 -22.935 -10.110 1.00 0.00 ? ? ? ? ? . 11 TYR A CG 223 ATOM 169 C CD1 . TYR A 223 11 . 5.506 -23.947 -10.389 1.00 0.00 ? ? ? ? ? . 11 TYR A CD1 223 ATOM 170 C CD2 . TYR A 223 11 . 7.797 -23.237 -10.034 1.00 0.00 ? ? ? ? ? . 11 TYR A CD2 223 ATOM 171 C CE1 . TYR A 223 11 . 5.944 -25.260 -10.591 1.00 0.00 ? ? ? ? ? . 11 TYR A CE1 223 ATOM 172 C CE2 . TYR A 223 11 . 8.235 -24.551 -10.236 1.00 0.00 ? ? ? ? ? . 11 TYR A CE2 223 ATOM 173 C CZ . TYR A 223 11 . 7.309 -25.563 -10.515 1.00 0.00 ? ? ? ? ? . 11 TYR A CZ 223 ATOM 174 O OH . TYR A 223 11 . 7.742 -26.858 -10.715 1.00 0.00 ? ? ? ? ? . 11 TYR A OH 223 ATOM 175 H H . TYR A 223 11 . 6.850 -22.173 -12.209 1.00 0.00 ? ? ? ? ? . 11 TYR A H 223 ATOM 176 H HA . TYR A 223 11 . 4.329 -21.157 -11.238 1.00 0.00 ? ? ? ? ? . 11 TYR A HA 223 ATOM 177 H HB2 . TYR A 223 11 . 6.792 -20.907 -9.570 1.00 0.00 ? ? ? ? ? . 11 TYR A HB2 223 ATOM 178 H HB3 . TYR A 223 11 . 5.195 -21.509 -9.128 1.00 0.00 ? ? ? ? ? . 11 TYR A HB3 223 ATOM 179 H HD1 . TYR A 223 11 . 4.453 -23.714 -10.447 1.00 0.00 ? ? ? ? ? . 11 TYR A HD1 223 ATOM 180 H HD2 . TYR A 223 11 . 8.512 -22.457 -9.819 1.00 0.00 ? ? ? ? ? . 11 TYR A HD2 223 ATOM 181 H HE1 . TYR A 223 11 . 5.230 -26.041 -10.807 1.00 0.00 ? ? ? ? ? . 11 TYR A HE1 223 ATOM 182 H HE2 . TYR A 223 11 . 9.289 -24.784 -10.178 1.00 0.00 ? ? ? ? ? . 11 TYR A HE2 223 ATOM 183 H HH . TYR A 223 11 . 8.633 -26.930 -10.364 1.00 0.00 ? ? ? ? ? . 11 TYR A HH 223 ATOM 184 N N . GLU A 223 12 . 6.802 -19.035 -11.634 1.00 0.00 ? ? ? ? ? . 12 GLU A N 223 ATOM 185 C CA . GLU A 223 12 . 7.093 -17.576 -11.703 1.00 0.00 ? ? ? ? ? . 12 GLU A CA 223 ATOM 186 C C . GLU A 223 12 . 7.790 -17.254 -13.027 1.00 0.00 ? ? ? ? ? . 12 GLU A C 223 ATOM 187 O O . GLU A 223 12 . 7.157 -16.910 -14.005 1.00 0.00 ? ? ? ? ? . 12 GLU A O 223 ATOM 188 C CB . GLU A 223 12 . 8.004 -17.181 -10.538 1.00 0.00 ? ? ? ? ? . 12 GLU A CB 223 ATOM 189 C CG . GLU A 223 12 . 7.287 -17.458 -9.214 1.00 0.00 ? ? ? ? ? . 12 GLU A CG 223 ATOM 190 C CD . GLU A 223 12 . 7.632 -16.358 -8.207 1.00 0.00 ? ? ? ? ? . 12 GLU A CD 223 ATOM 191 O OE1 . GLU A 223 12 . 8.670 -16.466 -7.575 1.00 0.00 ? ? ? ? ? . 12 GLU A OE1 223 ATOM 192 O OE2 . GLU A 223 12 . 6.852 -15.429 -8.085 1.00 0.00 ? ? ? ? ? . 12 GLU A OE2 223 ATOM 193 H H . GLU A 223 12 . 7.495 -19.686 -11.879 1.00 0.00 ? ? ? ? ? . 12 GLU A H 223 ATOM 194 H HA . GLU A 223 12 . 6.168 -17.023 -11.641 1.00 0.00 ? ? ? ? ? . 12 GLU A HA 223 ATOM 195 H HB2 . GLU A 223 12 . 8.915 -17.757 -10.583 1.00 0.00 ? ? ? ? ? . 12 GLU A HB2 223 ATOM 196 H HB3 . GLU A 223 12 . 8.238 -16.129 -10.605 1.00 0.00 ? ? ? ? ? . 12 GLU A HB3 223 ATOM 197 H HG2 . GLU A 223 12 . 6.219 -17.474 -9.380 1.00 0.00 ? ? ? ? ? . 12 GLU A HG2 223 ATOM 198 H HG3 . GLU A 223 12 . 7.606 -18.413 -8.825 1.00 0.00 ? ? ? ? ? . 12 GLU A HG3 223 ATOM 199 N N . ASN A 223 13 . 9.090 -17.361 -13.067 1.00 0.00 ? ? ? ? ? . 13 ASN A N 223 ATOM 200 C CA . ASN A 223 13 . 9.824 -17.059 -14.328 1.00 0.00 ? ? ? ? ? . 13 ASN A CA 223 ATOM 201 C C . ASN A 223 13 . 11.056 -17.961 -14.432 1.00 0.00 ? ? ? ? ? . 13 ASN A C 223 ATOM 202 O O . ASN A 223 13 . 11.635 -18.351 -13.438 1.00 0.00 ? ? ? ? ? . 13 ASN A O 223 ATOM 203 C CB . ASN A 223 13 . 10.265 -15.594 -14.321 1.00 0.00 ? ? ? ? ? . 13 ASN A CB 223 ATOM 204 C CG . ASN A 223 13 . 9.038 -14.694 -14.163 1.00 0.00 ? ? ? ? ? . 13 ASN A CG 223 ATOM 205 O OD1 . ASN A 223 13 . 8.330 -14.440 -15.117 1.00 0.00 ? ? ? ? ? . 13 ASN A OD1 223 ATOM 206 N ND2 . ASN A 223 13 . 8.756 -14.197 -12.990 1.00 0.00 ? ? ? ? ? . 13 ASN A ND2 223 ATOM 207 H H . ASN A 223 13 . 9.584 -17.639 -12.267 1.00 0.00 ? ? ? ? ? . 13 ASN A H 223 ATOM 208 H HA . ASN A 223 13 . 9.175 -17.235 -15.172 1.00 0.00 ? ? ? ? ? . 13 ASN A HA 223 ATOM 209 H HB2 . ASN A 223 13 . 10.943 -15.426 -13.497 1.00 0.00 ? ? ? ? ? . 13 ASN A HB2 223 ATOM 210 H HB3 . ASN A 223 13 . 10.763 -15.363 -15.250 1.00 0.00 ? ? ? ? ? . 13 ASN A HB3 223 ATOM 211 H HD21 . ASN A 223 13 . 9.328 -14.401 -12.220 1.00 0.00 ? ? ? ? ? . 13 ASN A HD21 223 ATOM 212 H HD22 . ASN A 223 13 . 7.972 -13.619 -12.879 1.00 0.00 ? ? ? ? ? . 13 ASN A HD22 223 ATOM 213 N N . PRO A 223 14 . 11.453 -18.287 -15.633 1.00 0.00 ? ? ? ? ? . 14 PRO A N 223 ATOM 214 C CA . PRO A 223 14 . 12.637 -19.157 -15.884 1.00 0.00 ? ? ? ? ? . 14 PRO A CA 223 ATOM 215 C C . PRO A 223 14 . 13.958 -18.434 -15.604 1.00 0.00 ? ? ? ? ? . 14 PRO A C 223 ATOM 216 O O . PRO A 223 14 . 15.025 -18.943 -15.885 1.00 0.00 ? ? ? ? ? . 14 PRO A O 223 ATOM 217 C CB . PRO A 223 14 . 12.524 -19.507 -17.368 1.00 0.00 ? ? ? ? ? . 14 PRO A CB 223 ATOM 218 C CG . PRO A 223 14 . 11.737 -18.394 -17.979 1.00 0.00 ? ? ? ? ? . 14 PRO A CG 223 ATOM 219 C CD . PRO A 223 14 . 10.810 -17.860 -16.887 1.00 0.00 ? ? ? ? ? . 14 PRO A CD 223 ATOM 220 H HA . PRO A 223 14 . 12.571 -20.058 -15.297 1.00 0.00 ? ? ? ? ? . 14 PRO A HA 223 ATOM 221 H HB2 . PRO A 223 14 . 13.509 -19.561 -17.814 1.00 0.00 ? ? ? ? ? . 14 PRO A HB2 223 ATOM 222 H HB3 . PRO A 223 14 . 12.001 -20.442 -17.496 1.00 0.00 ? ? ? ? ? . 14 PRO A HB3 223 ATOM 223 H HG2 . PRO A 223 14 . 12.406 -17.613 -18.318 1.00 0.00 ? ? ? ? ? . 14 PRO A HG2 223 ATOM 224 H HG3 . PRO A 223 14 . 11.150 -18.764 -18.805 1.00 0.00 ? ? ? ? ? . 14 PRO A HG3 223 ATOM 225 H HD2 . PRO A 223 14 . 10.749 -16.782 -16.937 1.00 0.00 ? ? ? ? ? . 14 PRO A HD2 223 ATOM 226 H HD3 . PRO A 223 14 . 9.830 -18.303 -16.972 1.00 0.00 ? ? ? ? ? . 14 PRO A HD3 223 ATOM 227 N N . ARG A 223 15 . 13.896 -17.253 -15.054 1.00 0.00 ? ? ? ? ? . 15 ARG A N 223 ATOM 228 C CA . ARG A 223 15 . 15.148 -16.502 -14.758 1.00 0.00 ? ? ? ? ? . 15 ARG A CA 223 ATOM 229 C C . ARG A 223 15 . 15.524 -16.696 -13.288 1.00 0.00 ? ? ? ? ? . 15 ARG A C 223 ATOM 230 O O . ARG A 223 15 . 16.153 -15.852 -12.681 1.00 0.00 ? ? ? ? ? . 15 ARG A O 223 ATOM 231 C CB . ARG A 223 15 . 14.928 -15.014 -15.038 1.00 0.00 ? ? ? ? ? . 15 ARG A CB 223 ATOM 232 C CG . ARG A 223 15 . 16.248 -14.373 -15.471 1.00 0.00 ? ? ? ? ? . 15 ARG A CG 223 ATOM 233 C CD . ARG A 223 15 . 16.145 -12.853 -15.342 1.00 0.00 ? ? ? ? ? . 15 ARG A CD 223 ATOM 234 N NE . ARG A 223 15 . 17.510 -12.256 -15.380 1.00 0.00 ? ? ? ? ? . 15 ARG A NE 223 ATOM 235 C CZ . ARG A 223 15 . 17.656 -10.976 -15.589 1.00 0.00 ? ? ? ? ? . 15 ARG A CZ 223 ATOM 236 N NH1 . ARG A 223 15 . 16.607 -10.220 -15.769 1.00 0.00 ? ? ? ? ? . 15 ARG A NH1 223 ATOM 237 N NH2 . ARG A 223 15 . 18.850 -10.452 -15.618 1.00 0.00 ? ? ? ? ? . 15 ARG A NH2 223 ATOM 238 H H . ARG A 223 15 . 13.026 -16.860 -14.836 1.00 0.00 ? ? ? ? ? . 15 ARG A H 223 ATOM 239 H HA . ARG A 223 15 . 15.946 -16.871 -15.385 1.00 0.00 ? ? ? ? ? . 15 ARG A HA 223 ATOM 240 H HB2 . ARG A 223 15 . 14.196 -14.899 -15.824 1.00 0.00 ? ? ? ? ? . 15 ARG A HB2 223 ATOM 241 H HB3 . ARG A 223 15 . 14.573 -14.527 -14.142 1.00 0.00 ? ? ? ? ? . 15 ARG A HB3 223 ATOM 242 H HG2 . ARG A 223 15 . 17.048 -14.736 -14.842 1.00 0.00 ? ? ? ? ? . 15 ARG A HG2 223 ATOM 243 H HG3 . ARG A 223 15 . 16.453 -14.632 -16.499 1.00 0.00 ? ? ? ? ? . 15 ARG A HG3 223 ATOM 244 H HD2 . ARG A 223 15 . 15.557 -12.461 -16.159 1.00 0.00 ? ? ? ? ? . 15 ARG A HD2 223 ATOM 245 H HD3 . ARG A 223 15 . 15.670 -12.602 -14.405 1.00 0.00 ? ? ? ? ? . 15 ARG A HD3 223 ATOM 246 H HE . ARG A 223 15 . 18.297 -12.824 -15.247 1.00 0.00 ? ? ? ? ? . 15 ARG A HE 223 ATOM 247 H HH11 . ARG A 223 15 . 15.692 -10.623 -15.747 1.00 0.00 ? ? ? ? ? . 15 ARG A HH11 223 ATOM 248 H HH12 . ARG A 223 15 . 16.720 -9.240 -15.929 1.00 0.00 ? ? ? ? ? . 15 ARG A HH12 223 ATOM 249 H HH21 . ARG A 223 15 . 19.654 -11.031 -15.481 1.00 0.00 ? ? ? ? ? . 15 ARG A HH21 223 ATOM 250 H HH22 . ARG A 223 15 . 18.961 -9.471 -15.778 1.00 0.00 ? ? ? ? ? . 15 ARG A HH22 223 ATOM 251 N N . ASN A 223 16 . 15.143 -17.802 -12.709 1.00 0.00 ? ? ? ? ? . 16 ASN A N 223 ATOM 252 C CA . ASN A 223 16 . 15.478 -18.049 -11.279 1.00 0.00 ? ? ? ? ? . 16 ASN A CA 223 ATOM 253 C C . ASN A 223 16 . 14.944 -16.900 -10.422 1.00 0.00 ? ? ? ? ? . 16 ASN A C 223 ATOM 254 O O . ASN A 223 16 . 15.682 -16.028 -10.005 1.00 0.00 ? ? ? ? ? . 16 ASN A O 223 ATOM 255 C CB . ASN A 223 16 . 16.997 -18.141 -11.118 1.00 0.00 ? ? ? ? ? . 16 ASN A CB 223 ATOM 256 C CG . ASN A 223 16 . 17.424 -19.611 -11.119 1.00 0.00 ? ? ? ? ? . 16 ASN A CG 223 ATOM 257 O OD1 . ASN A 223 16 . 18.464 -19.953 -10.593 1.00 0.00 ? ? ? ? ? . 16 ASN A OD1 223 ATOM 258 N ND2 . ASN A 223 16 . 16.660 -20.500 -11.692 1.00 0.00 ? ? ? ? ? . 16 ASN A ND2 223 ATOM 259 H H . ASN A 223 16 . 14.637 -18.470 -13.216 1.00 0.00 ? ? ? ? ? . 16 ASN A H 223 ATOM 260 H HA . ASN A 223 16 . 15.026 -18.977 -10.958 1.00 0.00 ? ? ? ? ? . 16 ASN A HA 223 ATOM 261 H HB2 . ASN A 223 16 . 17.477 -17.626 -11.938 1.00 0.00 ? ? ? ? ? . 16 ASN A HB2 223 ATOM 262 H HB3 . ASN A 223 16 . 17.290 -17.683 -10.185 1.00 0.00 ? ? ? ? ? . 16 ASN A HB3 223 ATOM 263 H HD21 . ASN A 223 16 . 15.821 -20.225 -12.117 1.00 0.00 ? ? ? ? ? . 16 ASN A HD21 223 ATOM 264 H HD22 . ASN A 223 16 . 16.925 -21.443 -11.697 1.00 0.00 ? ? ? ? ? . 16 ASN A HD22 223 ATOM 265 N N . VAL A 223 17 . 13.668 -16.891 -10.153 1.00 0.00 ? ? ? ? ? . 17 VAL A N 223 ATOM 266 C CA . VAL A 223 17 . 13.088 -15.798 -9.321 1.00 0.00 ? ? ? ? ? . 17 VAL A CA 223 ATOM 267 C C . VAL A 223 17 . 13.420 -14.442 -9.950 1.00 0.00 ? ? ? ? ? . 17 VAL A C 223 ATOM 268 O O . VAL A 223 17 . 14.304 -14.330 -10.776 1.00 0.00 ? ? ? ? ? . 17 VAL A O 223 ATOM 269 C CB . VAL A 223 17 . 13.678 -15.865 -7.913 1.00 0.00 ? ? ? ? ? . 17 VAL A CB 223 ATOM 270 C CG1 . VAL A 223 17 . 13.301 -14.599 -7.139 1.00 0.00 ? ? ? ? ? . 17 VAL A CG1 223 ATOM 271 C CG2 . VAL A 223 17 . 13.120 -17.091 -7.186 1.00 0.00 ? ? ? ? ? . 17 VAL A CG2 223 ATOM 272 H H . VAL A 223 17 . 13.090 -17.603 -10.498 1.00 0.00 ? ? ? ? ? . 17 VAL A H 223 ATOM 273 H HA . VAL A 223 17 . 12.016 -15.917 -9.268 1.00 0.00 ? ? ? ? ? . 17 VAL A HA 223 ATOM 274 H HB . VAL A 223 17 . 14.754 -15.940 -7.977 1.00 0.00 ? ? ? ? ? . 17 VAL A HB 223 ATOM 275 H HG11 . VAL A 223 17 . 13.967 -13.796 -7.417 1.00 0.00 ? ? ? ? ? . 17 VAL A HG11 223 ATOM 276 H HG12 . VAL A 223 17 . 13.387 -14.787 -6.079 1.00 0.00 ? ? ? ? ? . 17 VAL A HG12 223 ATOM 277 H HG13 . VAL A 223 17 . 12.285 -14.323 -7.375 1.00 0.00 ? ? ? ? ? . 17 VAL A HG13 223 ATOM 278 H HG21 . VAL A 223 17 . 13.407 -17.054 -6.145 1.00 0.00 ? ? ? ? ? . 17 VAL A HG21 223 ATOM 279 H HG22 . VAL A 223 17 . 13.517 -17.988 -7.637 1.00 0.00 ? ? ? ? ? . 17 VAL A HG22 223 ATOM 280 H HG23 . VAL A 223 17 . 12.043 -17.096 -7.263 1.00 0.00 ? ? ? ? ? . 17 VAL A HG23 223 ATOM 281 N N . GLY A 223 18 . 12.718 -13.412 -9.564 1.00 0.00 ? ? ? ? ? . 18 GLY A N 223 ATOM 282 C CA . GLY A 223 18 . 12.993 -12.064 -10.137 1.00 0.00 ? ? ? ? ? . 18 GLY A CA 223 ATOM 283 C C . GLY A 223 18 . 11.854 -11.110 -9.770 1.00 0.00 ? ? ? ? ? . 18 GLY A C 223 ATOM 284 O O . GLY A 223 18 . 11.905 -10.424 -8.768 1.00 0.00 ? ? ? ? ? . 18 GLY A O 223 ATOM 285 H H . GLY A 223 18 . 12.009 -13.525 -8.896 1.00 0.00 ? ? ? ? ? . 18 GLY A H 223 ATOM 286 H HA2 . GLY A 223 18 . 13.923 -11.686 -9.739 1.00 0.00 ? ? ? ? ? . 18 GLY A HA2 223 ATOM 287 H HA3 . GLY A 223 18 . 13.062 -12.137 -11.212 1.00 0.00 ? ? ? ? ? . 18 GLY A HA3 223 ATOM 288 N N . SER A 223 19 . 10.827 -11.060 -10.572 1.00 0.00 ? ? ? ? ? . 19 SER A N 223 ATOM 289 C CA . SER A 223 19 . 9.686 -10.150 -10.267 1.00 0.00 ? ? ? ? ? . 19 SER A CA 223 ATOM 290 C C . SER A 223 19 . 10.170 -8.699 -10.286 1.00 0.00 ? ? ? ? ? . 19 SER A C 223 ATOM 291 O O . SER A 223 19 . 11.287 -8.401 -9.910 1.00 0.00 ? ? ? ? ? . 19 SER A O 223 ATOM 292 C CB . SER A 223 19 . 9.127 -10.483 -8.883 1.00 0.00 ? ? ? ? ? . 19 SER A CB 223 ATOM 293 O OG . SER A 223 19 . 8.957 -9.280 -8.145 1.00 0.00 ? ? ? ? ? . 19 SER A OG 223 ATOM 294 H H . SER A 223 19 . 10.804 -11.621 -11.375 1.00 0.00 ? ? ? ? ? . 19 SER A H 223 ATOM 295 H HA . SER A 223 19 . 8.913 -10.283 -11.009 1.00 0.00 ? ? ? ? ? . 19 SER A HA 223 ATOM 296 H HB2 . SER A 223 19 . 8.173 -10.974 -8.987 1.00 0.00 ? ? ? ? ? . 19 SER A HB2 223 ATOM 297 H HB3 . SER A 223 19 . 9.814 -11.142 -8.367 1.00 0.00 ? ? ? ? ? . 19 SER A HB3 223 ATOM 298 H HG . SER A 223 19 . 8.016 -9.100 -8.084 1.00 0.00 ? ? ? ? ? . 19 SER A HG 223 ATOM 299 N N . LEU A 223 20 . 9.336 -7.792 -10.719 1.00 0.00 ? ? ? ? ? . 20 LEU A N 223 ATOM 300 C CA . LEU A 223 20 . 9.745 -6.359 -10.760 1.00 0.00 ? ? ? ? ? . 20 LEU A CA 223 ATOM 301 C C . LEU A 223 20 . 10.970 -6.202 -11.663 1.00 0.00 ? ? ? ? ? . 20 LEU A C 223 ATOM 302 O O . LEU A 223 20 . 12.065 -6.598 -11.315 1.00 0.00 ? ? ? ? ? . 20 LEU A O 223 ATOM 303 C CB . LEU A 223 20 . 10.089 -5.884 -9.347 1.00 0.00 ? ? ? ? ? . 20 LEU A CB 223 ATOM 304 C CG . LEU A 223 20 . 9.607 -4.446 -9.160 1.00 0.00 ? ? ? ? ? . 20 LEU A CG 223 ATOM 305 C CD1 . LEU A 223 20 . 8.096 -4.440 -8.920 1.00 0.00 ? ? ? ? ? . 20 LEU A CD1 223 ATOM 306 C CD2 . LEU A 223 20 . 10.317 -3.822 -7.955 1.00 0.00 ? ? ? ? ? . 20 LEU A CD2 223 ATOM 307 H H . LEU A 223 20 . 8.439 -8.053 -11.015 1.00 0.00 ? ? ? ? ? . 20 LEU A H 223 ATOM 308 H HA . LEU A 223 20 . 8.932 -5.765 -11.150 1.00 0.00 ? ? ? ? ? . 20 LEU A HA 223 ATOM 309 H HB2 . LEU A 223 20 . 9.604 -6.525 -8.624 1.00 0.00 ? ? ? ? ? . 20 LEU A HB2 223 ATOM 310 H HB3 . LEU A 223 20 . 11.159 -5.925 -9.203 1.00 0.00 ? ? ? ? ? . 20 LEU A HB3 223 ATOM 311 H HG . LEU A 223 20 . 9.832 -3.874 -10.048 1.00 0.00 ? ? ? ? ? . 20 LEU A HG 223 ATOM 312 H HD11 . LEU A 223 20 . 7.893 -4.137 -7.903 1.00 0.00 ? ? ? ? ? . 20 LEU A HD11 223 ATOM 313 H HD12 . LEU A 223 20 . 7.701 -5.431 -9.086 1.00 0.00 ? ? ? ? ? . 20 LEU A HD12 223 ATOM 314 H HD13 . LEU A 223 20 . 7.626 -3.746 -9.602 1.00 0.00 ? ? ? ? ? . 20 LEU A HD13 223 ATOM 315 H HD21 . LEU A 223 20 . 11.068 -3.126 -8.301 1.00 0.00 ? ? ? ? ? . 20 LEU A HD21 223 ATOM 316 H HD22 . LEU A 223 20 . 10.790 -4.600 -7.373 1.00 0.00 ? ? ? ? ? . 20 LEU A HD22 223 ATOM 317 H HD23 . LEU A 223 20 . 9.597 -3.300 -7.343 1.00 0.00 ? ? ? ? ? . 20 LEU A HD23 223 ATOM 318 N N . ASP A 223 21 . 10.795 -5.629 -12.823 1.00 0.00 ? ? ? ? ? . 21 ASP A N 223 ATOM 319 C CA . ASP A 223 21 . 11.951 -5.448 -13.746 1.00 0.00 ? ? ? ? ? . 21 ASP A CA 223 ATOM 320 C C . ASP A 223 21 . 11.485 -4.724 -15.012 1.00 0.00 ? ? ? ? ? . 21 ASP A C 223 ATOM 321 O O . ASP A 223 21 . 12.229 -4.573 -15.960 1.00 0.00 ? ? ? ? ? . 21 ASP A O 223 ATOM 322 C CB . ASP A 223 21 . 12.521 -6.818 -14.121 1.00 0.00 ? ? ? ? ? . 21 ASP A CB 223 ATOM 323 C CG . ASP A 223 21 . 14.046 -6.730 -14.209 1.00 0.00 ? ? ? ? ? . 21 ASP A CG 223 ATOM 324 O OD1 . ASP A 223 21 . 14.664 -6.457 -13.193 1.00 0.00 ? ? ? ? ? . 21 ASP A OD1 223 ATOM 325 O OD2 . ASP A 223 21 . 14.570 -6.939 -15.290 1.00 0.00 ? ? ? ? ? . 21 ASP A OD2 223 ATOM 326 H H . ASP A 223 21 . 9.904 -5.316 -13.085 1.00 0.00 ? ? ? ? ? . 21 ASP A H 223 ATOM 327 H HA . ASP A 223 21 . 12.715 -4.862 -13.257 1.00 0.00 ? ? ? ? ? . 21 ASP A HA 223 ATOM 328 H HB2 . ASP A 223 21 . 12.244 -7.541 -13.368 1.00 0.00 ? ? ? ? ? . 21 ASP A HB2 223 ATOM 329 H HB3 . ASP A 223 21 . 12.125 -7.123 -15.078 1.00 0.00 ? ? ? ? ? . 21 ASP A HB3 223 ATOM 330 N N . LYS A 223 22 . 10.260 -4.275 -15.034 1.00 0.00 ? ? ? ? ? . 22 LYS A N 223 ATOM 331 C CA . LYS A 223 22 . 9.749 -3.561 -16.238 1.00 0.00 ? ? ? ? ? . 22 LYS A CA 223 ATOM 332 C C . LYS A 223 22 . 9.882 -4.467 -17.465 1.00 0.00 ? ? ? ? ? . 22 LYS A C 223 ATOM 333 O O . LYS A 223 22 . 9.515 -4.099 -18.563 1.00 0.00 ? ? ? ? ? . 22 LYS A O 223 ATOM 334 C CB . LYS A 223 22 . 10.562 -2.283 -16.460 1.00 0.00 ? ? ? ? ? . 22 LYS A CB 223 ATOM 335 C CG . LYS A 223 22 . 10.009 -1.157 -15.581 1.00 0.00 ? ? ? ? ? . 22 LYS A CG 223 ATOM 336 C CD . LYS A 223 22 . 10.533 -1.316 -14.153 1.00 0.00 ? ? ? ? ? . 22 LYS A CD 223 ATOM 337 C CE . LYS A 223 22 . 9.685 -0.472 -13.200 1.00 0.00 ? ? ? ? ? . 22 LYS A CE 223 ATOM 338 N NZ . LYS A 223 22 . 10.560 0.131 -12.155 1.00 0.00 ? ? ? ? ? . 22 LYS A NZ 223 ATOM 339 H H . LYS A 223 22 . 9.677 -4.407 -14.257 1.00 0.00 ? ? ? ? ? . 22 LYS A H 223 ATOM 340 H HA . LYS A 223 22 . 8.710 -3.309 -16.092 1.00 0.00 ? ? ? ? ? . 22 LYS A HA 223 ATOM 341 H HB2 . LYS A 223 22 . 11.595 -2.465 -16.202 1.00 0.00 ? ? ? ? ? . 22 LYS A HB2 223 ATOM 342 H HB3 . LYS A 223 22 . 10.498 -1.991 -17.497 1.00 0.00 ? ? ? ? ? . 22 LYS A HB3 223 ATOM 343 H HG2 . LYS A 223 22 . 10.328 -0.203 -15.977 1.00 0.00 ? ? ? ? ? . 22 LYS A HG2 223 ATOM 344 H HG3 . LYS A 223 22 . 8.930 -1.200 -15.572 1.00 0.00 ? ? ? ? ? . 22 LYS A HG3 223 ATOM 345 H HD2 . LYS A 223 22 . 10.476 -2.355 -13.862 1.00 0.00 ? ? ? ? ? . 22 LYS A HD2 223 ATOM 346 H HD3 . LYS A 223 22 . 11.560 -0.985 -14.107 1.00 0.00 ? ? ? ? ? . 22 LYS A HD3 223 ATOM 347 H HE2 . LYS A 223 22 . 9.195 0.315 -13.756 1.00 0.00 ? ? ? ? ? . 22 LYS A HE2 223 ATOM 348 H HE3 . LYS A 223 22 . 8.940 -1.097 -12.730 1.00 0.00 ? ? ? ? ? . 22 LYS A HE3 223 ATOM 349 H HZ1 . LYS A 223 22 . 9.992 0.744 -11.538 1.00 0.00 ? ? ? ? ? . 22 LYS A HZ1 223 ATOM 350 H HZ2 . LYS A 223 22 . 11.308 0.693 -12.611 1.00 0.00 ? ? ? ? ? . 22 LYS A HZ2 223 ATOM 351 H HZ3 . LYS A 223 22 . 10.992 -0.625 -11.587 1.00 0.00 ? ? ? ? ? . 22 LYS A HZ3 223 ATOM 352 N N . LYS A 223 23 . 10.405 -5.650 -17.288 1.00 0.00 ? ? ? ? ? . 23 LYS A N 223 ATOM 353 C CA . LYS A 223 23 . 10.560 -6.576 -18.448 1.00 0.00 ? ? ? ? ? . 23 LYS A CA 223 ATOM 354 C C . LYS A 223 23 . 10.096 -7.978 -18.048 1.00 0.00 ? ? ? ? ? . 23 LYS A C 223 ATOM 355 O O . LYS A 223 23 . 10.867 -8.918 -18.039 1.00 0.00 ? ? ? ? ? . 23 LYS A O 223 ATOM 356 C CB . LYS A 223 23 . 12.031 -6.626 -18.869 1.00 0.00 ? ? ? ? ? . 23 LYS A CB 223 ATOM 357 C CG . LYS A 223 23 . 12.550 -5.203 -19.081 1.00 0.00 ? ? ? ? ? . 23 LYS A CG 223 ATOM 358 C CD . LYS A 223 23 . 14.073 -5.231 -19.232 1.00 0.00 ? ? ? ? ? . 23 LYS A CD 223 ATOM 359 C CE . LYS A 223 23 . 14.722 -5.342 -17.850 1.00 0.00 ? ? ? ? ? . 23 LYS A CE 223 ATOM 360 N NZ . LYS A 223 23 . 15.429 -4.070 -17.532 1.00 0.00 ? ? ? ? ? . 23 LYS A NZ 223 ATOM 361 H H . LYS A 223 23 . 10.696 -5.931 -16.396 1.00 0.00 ? ? ? ? ? . 23 LYS A H 223 ATOM 362 H HA . LYS A 223 23 . 9.962 -6.221 -19.273 1.00 0.00 ? ? ? ? ? . 23 LYS A HA 223 ATOM 363 H HB2 . LYS A 223 23 . 12.609 -7.112 -18.096 1.00 0.00 ? ? ? ? ? . 23 LYS A HB2 223 ATOM 364 H HB3 . LYS A 223 23 . 12.122 -7.181 -19.791 1.00 0.00 ? ? ? ? ? . 23 LYS A HB3 223 ATOM 365 H HG2 . LYS A 223 23 . 12.107 -4.788 -19.974 1.00 0.00 ? ? ? ? ? . 23 LYS A HG2 223 ATOM 366 H HG3 . LYS A 223 23 . 12.286 -4.593 -18.230 1.00 0.00 ? ? ? ? ? . 23 LYS A HG3 223 ATOM 367 H HD2 . LYS A 223 23 . 14.359 -6.081 -19.834 1.00 0.00 ? ? ? ? ? . 23 LYS A HD2 223 ATOM 368 H HD3 . LYS A 223 23 . 14.404 -4.322 -19.711 1.00 0.00 ? ? ? ? ? . 23 LYS A HD3 223 ATOM 369 H HE2 . LYS A 223 23 . 13.960 -5.526 -17.107 1.00 0.00 ? ? ? ? ? . 23 LYS A HE2 223 ATOM 370 H HE3 . LYS A 223 23 . 15.431 -6.158 -17.851 1.00 0.00 ? ? ? ? ? . 23 LYS A HE3 223 ATOM 371 H HZ1 . LYS A 223 23 . 15.649 -3.564 -18.412 1.00 0.00 ? ? ? ? ? . 23 LYS A HZ1 223 ATOM 372 H HZ2 . LYS A 223 23 . 16.313 -4.284 -17.024 1.00 0.00 ? ? ? ? ? . 23 LYS A HZ2 223 ATOM 373 H HZ3 . LYS A 223 23 . 14.822 -3.475 -16.934 1.00 0.00 ? ? ? ? ? . 23 LYS A HZ3 223 ATOM 374 N N . ASP A 223 24 . 8.843 -8.128 -17.720 1.00 0.00 ? ? ? ? ? . 24 ASP A N 223 ATOM 375 C CA . ASP A 223 24 . 8.334 -9.471 -17.322 1.00 0.00 ? ? ? ? ? . 24 ASP A CA 223 ATOM 376 C C . ASP A 223 24 . 6.877 -9.617 -17.769 1.00 0.00 ? ? ? ? ? . 24 ASP A C 223 ATOM 377 O O . ASP A 223 24 . 6.199 -8.646 -18.038 1.00 0.00 ? ? ? ? ? . 24 ASP A O 223 ATOM 378 C CB . ASP A 223 24 . 8.419 -9.619 -15.802 1.00 0.00 ? ? ? ? ? . 24 ASP A CB 223 ATOM 379 C CG . ASP A 223 24 . 9.873 -9.451 -15.355 1.00 0.00 ? ? ? ? ? . 24 ASP A CG 223 ATOM 380 O OD1 . ASP A 223 24 . 10.669 -10.328 -15.650 1.00 0.00 ? ? ? ? ? . 24 ASP A OD1 223 ATOM 381 O OD2 . ASP A 223 24 . 10.166 -8.449 -14.725 1.00 0.00 ? ? ? ? ? . 24 ASP A OD2 223 ATOM 382 H H . ASP A 223 24 . 8.236 -7.358 -17.734 1.00 0.00 ? ? ? ? ? . 24 ASP A H 223 ATOM 383 H HA . ASP A 223 24 . 8.933 -10.236 -17.793 1.00 0.00 ? ? ? ? ? . 24 ASP A HA 223 ATOM 384 H HB2 . ASP A 223 24 . 7.807 -8.864 -15.331 1.00 0.00 ? ? ? ? ? . 24 ASP A HB2 223 ATOM 385 H HB3 . ASP A 223 24 . 8.069 -10.599 -15.516 1.00 0.00 ? ? ? ? ? . 24 ASP A HB3 223 ATOM 386 N N . SER A 223 25 . 6.391 -10.826 -17.850 1.00 0.00 ? ? ? ? ? . 25 SER A N 223 ATOM 387 C CA . SER A 223 25 . 4.980 -11.036 -18.279 1.00 0.00 ? ? ? ? ? . 25 SER A CA 223 ATOM 388 C C . SER A 223 25 . 4.050 -10.834 -17.080 1.00 0.00 ? ? ? ? ? . 25 SER A C 223 ATOM 389 O O . SER A 223 25 . 2.849 -10.724 -17.225 1.00 0.00 ? ? ? ? ? . 25 SER A O 223 ATOM 390 C CB . SER A 223 25 . 4.816 -12.456 -18.818 1.00 0.00 ? ? ? ? ? . 25 SER A CB 223 ATOM 391 O OG . SER A 223 25 . 3.930 -13.180 -17.975 1.00 0.00 ? ? ? ? ? . 25 SER A OG 223 ATOM 392 H H . SER A 223 25 . 6.956 -11.596 -17.628 1.00 0.00 ? ? ? ? ? . 25 SER A H 223 ATOM 393 H HA . SER A 223 25 . 4.729 -10.325 -19.052 1.00 0.00 ? ? ? ? ? . 25 SER A HA 223 ATOM 394 H HB2 . SER A 223 25 . 4.407 -12.420 -19.814 1.00 0.00 ? ? ? ? ? . 25 SER A HB2 223 ATOM 395 H HB3 . SER A 223 25 . 5.782 -12.944 -18.845 1.00 0.00 ? ? ? ? ? . 25 SER A HB3 223 ATOM 396 H HG . SER A 223 25 . 4.458 -13.682 -17.350 1.00 0.00 ? ? ? ? ? . 25 SER A HG 223 ATOM 397 N N . ASN A 223 26 . 4.598 -10.786 -15.898 1.00 0.00 ? ? ? ? ? . 26 ASN A N 223 ATOM 398 C CA . ASN A 223 26 . 3.750 -10.592 -14.689 1.00 0.00 ? ? ? ? ? . 26 ASN A CA 223 ATOM 399 C C . ASN A 223 26 . 3.667 -9.100 -14.361 1.00 0.00 ? ? ? ? ? . 26 ASN A C 223 ATOM 400 O O . ASN A 223 26 . 3.193 -8.709 -13.313 1.00 0.00 ? ? ? ? ? . 26 ASN A O 223 ATOM 401 C CB . ASN A 223 26 . 4.369 -11.343 -13.508 1.00 0.00 ? ? ? ? ? . 26 ASN A CB 223 ATOM 402 C CG . ASN A 223 26 . 4.576 -12.810 -13.891 1.00 0.00 ? ? ? ? ? . 26 ASN A CG 223 ATOM 403 O OD1 . ASN A 223 26 . 3.801 -13.664 -13.513 1.00 0.00 ? ? ? ? ? . 26 ASN A OD1 223 ATOM 404 N ND2 . ASN A 223 26 . 5.599 -13.139 -14.631 1.00 0.00 ? ? ? ? ? . 26 ASN A ND2 223 ATOM 405 H H . ASN A 223 26 . 5.570 -10.877 -15.804 1.00 0.00 ? ? ? ? ? . 26 ASN A H 223 ATOM 406 H HA . ASN A 223 26 . 2.758 -10.975 -14.879 1.00 0.00 ? ? ? ? ? . 26 ASN A HA 223 ATOM 407 H HB2 . ASN A 223 26 . 5.320 -10.896 -13.258 1.00 0.00 ? ? ? ? ? . 26 ASN A HB2 223 ATOM 408 H HB3 . ASN A 223 26 . 3.707 -11.285 -12.658 1.00 0.00 ? ? ? ? ? . 26 ASN A HB3 223 ATOM 409 H HD21 . ASN A 223 26 . 6.226 -12.450 -14.938 1.00 0.00 ? ? ? ? ? . 26 ASN A HD21 223 ATOM 410 H HD22 . ASN A 223 26 . 5.741 -14.077 -14.883 1.00 0.00 ? ? ? ? ? . 26 ASN A HD22 223 ATOM 411 N N . VAL A 223 27 . 4.125 -8.264 -15.253 1.00 0.00 ? ? ? ? ? . 27 VAL A N 223 ATOM 412 C CA . VAL A 223 27 . 4.074 -6.796 -14.996 1.00 0.00 ? ? ? ? ? . 27 VAL A CA 223 ATOM 413 C C . VAL A 223 27 . 3.604 -6.077 -16.262 1.00 0.00 ? ? ? ? ? . 27 VAL A C 223 ATOM 414 O O . VAL A 223 27 . 4.249 -6.127 -17.291 1.00 0.00 ? ? ? ? ? . 27 VAL A O 223 ATOM 415 C CB . VAL A 223 27 . 5.468 -6.298 -14.610 1.00 0.00 ? ? ? ? ? . 27 VAL A CB 223 ATOM 416 C CG1 . VAL A 223 27 . 5.510 -4.772 -14.701 1.00 0.00 ? ? ? ? ? . 27 VAL A CG1 223 ATOM 417 C CG2 . VAL A 223 27 . 5.783 -6.729 -13.176 1.00 0.00 ? ? ? ? ? . 27 VAL A CG2 223 ATOM 418 H H . VAL A 223 27 . 4.503 -8.601 -16.091 1.00 0.00 ? ? ? ? ? . 27 VAL A H 223 ATOM 419 H HA . VAL A 223 27 . 3.383 -6.596 -14.190 1.00 0.00 ? ? ? ? ? . 27 VAL A HA 223 ATOM 420 H HB . VAL A 223 27 . 6.200 -6.719 -15.284 1.00 0.00 ? ? ? ? ? . 27 VAL A HB 223 ATOM 421 H HG11 . VAL A 223 27 . 4.700 -4.354 -14.123 1.00 0.00 ? ? ? ? ? . 27 VAL A HG11 223 ATOM 422 H HG12 . VAL A 223 27 . 5.409 -4.469 -15.734 1.00 0.00 ? ? ? ? ? . 27 VAL A HG12 223 ATOM 423 H HG13 . VAL A 223 27 . 6.452 -4.414 -14.312 1.00 0.00 ? ? ? ? ? . 27 VAL A HG13 223 ATOM 424 H HG21 . VAL A 223 27 . 5.459 -7.749 -13.028 1.00 0.00 ? ? ? ? ? . 27 VAL A HG21 223 ATOM 425 H HG22 . VAL A 223 27 . 5.265 -6.082 -12.485 1.00 0.00 ? ? ? ? ? . 27 VAL A HG22 223 ATOM 426 H HG23 . VAL A 223 27 . 6.847 -6.661 -13.006 1.00 0.00 ? ? ? ? ? . 27 VAL A HG23 223 ATOM 427 N N . GLY A 223 28 . 2.483 -5.411 -16.196 1.00 0.00 ? ? ? ? ? . 28 GLY A N 223 ATOM 428 C CA . GLY A 223 28 . 1.970 -4.693 -17.398 1.00 0.00 ? ? ? ? ? . 28 GLY A CA 223 ATOM 429 C C . GLY A 223 28 . 2.398 -3.224 -17.342 1.00 0.00 ? ? ? ? ? . 28 GLY A C 223 ATOM 430 O O . GLY A 223 28 . 2.219 -2.552 -16.345 1.00 0.00 ? ? ? ? ? . 28 GLY A O 223 ATOM 431 H H . GLY A 223 28 . 1.976 -5.387 -15.358 1.00 0.00 ? ? ? ? ? . 28 GLY A H 223 ATOM 432 H HA2 . GLY A 223 28 . 2.373 -5.152 -18.289 1.00 0.00 ? ? ? ? ? . 28 GLY A HA2 223 ATOM 433 H HA3 . GLY A 223 28 . 0.893 -4.750 -17.418 1.00 0.00 ? ? ? ? ? . 28 GLY A HA3 223 ATOM 434 N N . THR A 223 29 . 2.959 -2.723 -18.410 1.00 0.00 ? ? ? ? ? . 29 THR A N 223 ATOM 435 C CA . THR A 223 29 . 3.397 -1.298 -18.426 1.00 0.00 ? ? ? ? ? . 29 THR A CA 223 ATOM 436 C C . THR A 223 29 . 2.495 -0.502 -19.370 1.00 0.00 ? ? ? ? ? . 29 THR A C 223 ATOM 437 O O . THR A 223 29 . 2.014 -1.014 -20.362 1.00 0.00 ? ? ? ? ? . 29 THR A O 223 ATOM 438 C CB . THR A 223 29 . 4.844 -1.216 -18.915 1.00 0.00 ? ? ? ? ? . 29 THR A CB 223 ATOM 439 O OG1 . THR A 223 29 . 5.614 -2.230 -18.287 1.00 0.00 ? ? ? ? ? . 29 THR A OG1 223 ATOM 440 C CG2 . THR A 223 29 . 5.425 0.157 -18.570 1.00 0.00 ? ? ? ? ? . 29 THR A CG2 223 ATOM 441 H H . THR A 223 29 . 3.090 -3.283 -19.202 1.00 0.00 ? ? ? ? ? . 29 THR A H 223 ATOM 442 H HA . THR A 223 29 . 3.328 -0.888 -17.429 1.00 0.00 ? ? ? ? ? . 29 THR A HA 223 ATOM 443 H HB . THR A 223 29 . 4.871 -1.353 -19.984 1.00 0.00 ? ? ? ? ? . 29 THR A HB 223 ATOM 444 H HG1 . THR A 223 29 . 5.374 -3.073 -18.681 1.00 0.00 ? ? ? ? ? . 29 THR A HG1 223 ATOM 445 H HG21 . THR A 223 29 . 5.355 0.319 -17.505 1.00 0.00 ? ? ? ? ? . 29 THR A HG21 223 ATOM 446 H HG22 . THR A 223 29 . 4.868 0.923 -19.088 1.00 0.00 ? ? ? ? ? . 29 THR A HG22 223 ATOM 447 H HG23 . THR A 223 29 . 6.460 0.197 -18.874 1.00 0.00 ? ? ? ? ? . 29 THR A HG23 223 ATOM 448 N N . GLY A 223 30 . 2.261 0.748 -19.076 1.00 0.00 ? ? ? ? ? . 30 GLY A N 223 ATOM 449 C CA . GLY A 223 30 . 1.388 1.569 -19.963 1.00 0.00 ? ? ? ? ? . 30 GLY A CA 223 ATOM 450 C C . GLY A 223 30 . 1.777 3.044 -19.852 1.00 0.00 ? ? ? ? ? . 30 GLY A C 223 ATOM 451 O O . GLY A 223 30 . 1.679 3.646 -18.800 1.00 0.00 ? ? ? ? ? . 30 GLY A O 223 ATOM 452 H H . GLY A 223 30 . 2.657 1.146 -18.272 1.00 0.00 ? ? ? ? ? . 30 GLY A H 223 ATOM 453 H HA2 . GLY A 223 30 . 1.507 1.241 -20.986 1.00 0.00 ? ? ? ? ? . 30 GLY A HA2 223 ATOM 454 H HA3 . GLY A 223 30 . 0.358 1.449 -19.665 1.00 0.00 ? ? ? ? ? . 30 GLY A HA3 223 ATOM 455 N N . MET A 223 31 . 2.216 3.633 -20.929 1.00 0.00 ? ? ? ? ? . 31 MET A N 223 ATOM 456 C CA . MET A 223 31 . 2.609 5.070 -20.889 1.00 0.00 ? ? ? ? ? . 31 MET A CA 223 ATOM 457 C C . MET A 223 31 . 1.834 5.836 -21.964 1.00 0.00 ? ? ? ? ? . 31 MET A C 223 ATOM 458 O O . MET A 223 31 . 2.086 5.692 -23.143 1.00 0.00 ? ? ? ? ? . 31 MET A O 223 ATOM 459 C CB . MET A 223 31 . 4.110 5.196 -21.153 1.00 0.00 ? ? ? ? ? . 31 MET A CB 223 ATOM 460 C CG . MET A 223 31 . 4.555 6.636 -20.887 1.00 0.00 ? ? ? ? ? . 31 MET A CG 223 ATOM 461 S SD . MET A 223 31 . 5.788 7.122 -22.119 1.00 0.00 ? ? ? ? ? . 31 MET A SD 223 ATOM 462 C CE . MET A 223 31 . 6.322 8.651 -21.314 1.00 0.00 ? ? ? ? ? . 31 MET A CE 223 ATOM 463 H H . MET A 223 31 . 2.285 3.131 -21.768 1.00 0.00 ? ? ? ? ? . 31 MET A H 223 ATOM 464 H HA . MET A 223 31 . 2.376 5.480 -19.917 1.00 0.00 ? ? ? ? ? . 31 MET A HA 223 ATOM 465 H HB2 . MET A 223 31 . 4.648 4.525 -20.500 1.00 0.00 ? ? ? ? ? . 31 MET A HB2 223 ATOM 466 H HB3 . MET A 223 31 . 4.317 4.943 -22.182 1.00 0.00 ? ? ? ? ? . 31 MET A HB3 223 ATOM 467 H HG2 . MET A 223 31 . 3.702 7.295 -20.952 1.00 0.00 ? ? ? ? ? . 31 MET A HG2 223 ATOM 468 H HG3 . MET A 223 31 . 4.988 6.702 -19.899 1.00 0.00 ? ? ? ? ? . 31 MET A HG3 223 ATOM 469 H HE1 . MET A 223 31 . 7.117 8.430 -20.615 1.00 0.00 ? ? ? ? ? . 31 MET A HE1 223 ATOM 470 H HE2 . MET A 223 31 . 5.492 9.089 -20.783 1.00 0.00 ? ? ? ? ? . 31 MET A HE2 223 ATOM 471 H HE3 . MET A 223 31 . 6.676 9.347 -22.063 1.00 0.00 ? ? ? ? ? . 31 MET A HE3 223 ATOM 472 N N . VAL A 223 32 . 0.892 6.647 -21.567 1.00 0.00 ? ? ? ? ? . 32 VAL A N 223 ATOM 473 C CA . VAL A 223 32 . 0.104 7.416 -22.569 1.00 0.00 ? ? ? ? ? . 32 VAL A CA 223 ATOM 474 C C . VAL A 223 32 . 0.254 8.915 -22.301 1.00 0.00 ? ? ? ? ? . 32 VAL A C 223 ATOM 475 O O . VAL A 223 32 . 1.037 9.333 -21.471 1.00 0.00 ? ? ? ? ? . 32 VAL A O 223 ATOM 476 C CB . VAL A 223 32 . -1.372 7.027 -22.464 1.00 0.00 ? ? ? ? ? . 32 VAL A CB 223 ATOM 477 C CG1 . VAL A 223 32 . -1.533 5.542 -22.792 1.00 0.00 ? ? ? ? ? . 32 VAL A CG1 223 ATOM 478 C CG2 . VAL A 223 32 . -1.867 7.290 -21.039 1.00 0.00 ? ? ? ? ? . 32 VAL A CG2 223 ATOM 479 H H . VAL A 223 32 . 0.702 6.748 -20.611 1.00 0.00 ? ? ? ? ? . 32 VAL A H 223 ATOM 480 H HA . VAL A 223 32 . 0.464 7.191 -23.562 1.00 0.00 ? ? ? ? ? . 32 VAL A HA 223 ATOM 481 H HB . VAL A 223 32 . -1.951 7.615 -23.162 1.00 0.00 ? ? ? ? ? . 32 VAL A HB 223 ATOM 482 H HG11 . VAL A 223 32 . -1.864 5.432 -23.814 1.00 0.00 ? ? ? ? ? . 32 VAL A HG11 223 ATOM 483 H HG12 . VAL A 223 32 . -2.266 5.104 -22.129 1.00 0.00 ? ? ? ? ? . 32 VAL A HG12 223 ATOM 484 H HG13 . VAL A 223 32 . -0.586 5.039 -22.663 1.00 0.00 ? ? ? ? ? . 32 VAL A HG13 223 ATOM 485 H HG21 . VAL A 223 32 . -2.944 7.220 -21.014 1.00 0.00 ? ? ? ? ? . 32 VAL A HG21 223 ATOM 486 H HG22 . VAL A 223 32 . -1.562 8.279 -20.729 1.00 0.00 ? ? ? ? ? . 32 VAL A HG22 223 ATOM 487 H HG23 . VAL A 223 32 . -1.443 6.556 -20.371 1.00 0.00 ? ? ? ? ? . 32 VAL A HG23 223 ATOM 488 N N . GLY A 223 33 . -0.490 9.729 -23.000 1.00 0.00 ? ? ? ? ? . 33 GLY A N 223 ATOM 489 C CA . GLY A 223 33 . -0.392 11.201 -22.787 1.00 0.00 ? ? ? ? ? . 33 GLY A CA 223 ATOM 490 C C . GLY A 223 33 . -1.477 11.908 -23.603 1.00 0.00 ? ? ? ? ? . 33 GLY A C 223 ATOM 491 O O . GLY A 223 33 . -2.349 11.280 -24.168 1.00 0.00 ? ? ? ? ? . 33 GLY A O 223 ATOM 492 H H . GLY A 223 33 . -1.115 9.371 -23.665 1.00 0.00 ? ? ? ? ? . 33 GLY A H 223 ATOM 493 H HA2 . GLY A 223 33 . -0.526 11.422 -21.738 1.00 0.00 ? ? ? ? ? . 33 GLY A HA2 223 ATOM 494 H HA3 . GLY A 223 33 . 0.579 11.548 -23.109 1.00 0.00 ? ? ? ? ? . 33 GLY A HA3 223 ATOM 495 N N . ALA A 223 34 . -1.431 13.212 -23.668 1.00 0.00 ? ? ? ? ? . 34 ALA A N 223 ATOM 496 C CA . ALA A 223 34 . -2.461 13.954 -24.448 1.00 0.00 ? ? ? ? ? . 34 ALA A CA 223 ATOM 497 C C . ALA A 223 34 . -1.779 14.976 -25.359 1.00 0.00 ? ? ? ? ? . 34 ALA A C 223 ATOM 498 O O . ALA A 223 34 . -1.797 16.163 -25.099 1.00 0.00 ? ? ? ? ? . 34 ALA A O 223 ATOM 499 C CB . ALA A 223 34 . -3.406 14.680 -23.486 1.00 0.00 ? ? ? ? ? . 34 ALA A CB 223 ATOM 500 H H . ALA A 223 34 . -0.720 13.701 -23.204 1.00 0.00 ? ? ? ? ? . 34 ALA A H 223 ATOM 501 H HA . ALA A 223 34 . -3.027 13.257 -25.050 1.00 0.00 ? ? ? ? ? . 34 ALA A HA 223 ATOM 502 H HB1 . ALA A 223 34 . -2.954 14.728 -22.506 1.00 0.00 ? ? ? ? ? . 34 ALA A HB1 223 ATOM 503 H HB2 . ALA A 223 34 . -4.341 14.141 -23.425 1.00 0.00 ? ? ? ? ? . 34 ALA A HB2 223 ATOM 504 H HB3 . ALA A 223 34 . -3.589 15.680 -23.848 1.00 0.00 ? ? ? ? ? . 34 ALA A HB3 223 ATOM 505 N N . PRO A 223 35 . -1.181 14.510 -26.423 1.00 0.00 ? ? ? ? ? . 35 PRO A N 223 ATOM 506 C CA . PRO A 223 35 . -0.476 15.387 -27.403 1.00 0.00 ? ? ? ? ? . 35 PRO A CA 223 ATOM 507 C C . PRO A 223 35 . -1.355 16.550 -27.874 1.00 0.00 ? ? ? ? ? . 35 PRO A C 223 ATOM 508 O O . PRO A 223 35 . -0.928 17.393 -28.638 1.00 0.00 ? ? ? ? ? . 35 PRO A O 223 ATOM 509 C CB . PRO A 223 35 . -0.160 14.452 -28.573 1.00 0.00 ? ? ? ? ? . 35 PRO A CB 223 ATOM 510 C CG . PRO A 223 35 . -0.158 13.074 -27.996 1.00 0.00 ? ? ? ? ? . 35 PRO A CG 223 ATOM 511 C CD . PRO A 223 35 . -1.115 13.092 -26.804 1.00 0.00 ? ? ? ? ? . 35 PRO A CD 223 ATOM 512 H HA . PRO A 223 35 . 0.443 15.758 -26.980 1.00 0.00 ? ? ? ? ? . 35 PRO A HA 223 ATOM 513 H HB2 . PRO A 223 35 . -0.922 14.538 -29.336 1.00 0.00 ? ? ? ? ? . 35 PRO A HB2 223 ATOM 514 H HB3 . PRO A 223 35 . 0.811 14.681 -28.984 1.00 0.00 ? ? ? ? ? . 35 PRO A HB3 223 ATOM 515 H HG2 . PRO A 223 35 . -0.497 12.364 -28.737 1.00 0.00 ? ? ? ? ? . 35 PRO A HG2 223 ATOM 516 H HG3 . PRO A 223 35 . 0.835 12.815 -27.659 1.00 0.00 ? ? ? ? ? . 35 PRO A HG3 223 ATOM 517 H HD2 . PRO A 223 35 . -2.090 12.731 -27.098 1.00 0.00 ? ? ? ? ? . 35 PRO A HD2 223 ATOM 518 H HD3 . PRO A 223 35 . -0.719 12.506 -25.990 1.00 0.00 ? ? ? ? ? . 35 PRO A HD3 223 ATOM 519 N N . ALA A 223 36 . -2.578 16.600 -27.423 1.00 0.00 ? ? ? ? ? . 36 ALA A N 223 ATOM 520 C CA . ALA A 223 36 . -3.483 17.707 -27.844 1.00 0.00 ? ? ? ? ? . 36 ALA A CA 223 ATOM 521 C C . ALA A 223 36 . -3.164 18.965 -27.036 1.00 0.00 ? ? ? ? ? . 36 ALA A C 223 ATOM 522 O O . ALA A 223 36 . -3.681 20.033 -27.301 1.00 0.00 ? ? ? ? ? . 36 ALA A O 223 ATOM 523 C CB . ALA A 223 36 . -4.938 17.296 -27.599 1.00 0.00 ? ? ? ? ? . 36 ALA A CB 223 ATOM 524 H H . ALA A 223 36 . -2.902 15.909 -26.808 1.00 0.00 ? ? ? ? ? . 36 ALA A H 223 ATOM 525 H HA . ALA A 223 36 . -3.340 17.908 -28.896 1.00 0.00 ? ? ? ? ? . 36 ALA A HA 223 ATOM 526 H HB1 . ALA A 223 36 . -4.969 16.269 -27.265 1.00 0.00 ? ? ? ? ? . 36 ALA A HB1 223 ATOM 527 H HB2 . ALA A 223 36 . -5.500 17.393 -28.516 1.00 0.00 ? ? ? ? ? . 36 ALA A HB2 223 ATOM 528 H HB3 . ALA A 223 36 . -5.370 17.934 -26.842 1.00 0.00 ? ? ? ? ? . 36 ALA A HB3 223 ATOM 529 N N . CYS A 223 37 . -2.320 18.849 -26.048 1.00 0.00 ? ? ? ? ? . 37 CYS A N 223 ATOM 530 C CA . CYS A 223 37 . -1.973 20.041 -25.222 1.00 0.00 ? ? ? ? ? . 37 CYS A CA 223 ATOM 531 C C . CYS A 223 37 . -0.543 19.898 -24.695 1.00 0.00 ? ? ? ? ? . 37 CYS A C 223 ATOM 532 O O . CYS A 223 37 . 0.299 20.745 -24.920 1.00 0.00 ? ? ? ? ? . 37 CYS A O 223 ATOM 533 C CB . CYS A 223 37 . -2.942 20.141 -24.043 1.00 0.00 ? ? ? ? ? . 37 CYS A CB 223 ATOM 534 S SG . CYS A 223 37 . -4.593 19.621 -24.573 1.00 0.00 ? ? ? ? ? . 37 CYS A SG 223 ATOM 535 H H . CYS A 223 37 . -1.916 17.979 -25.847 1.00 0.00 ? ? ? ? ? . 37 CYS A H 223 ATOM 536 H HA . CYS A 223 37 . -2.047 20.932 -25.827 1.00 0.00 ? ? ? ? ? . 37 CYS A HA 223 ATOM 537 H HB2 . CYS A 223 37 . -2.603 19.501 -23.242 1.00 0.00 ? ? ? ? ? . 37 CYS A HB2 223 ATOM 538 H HB3 . CYS A 223 37 . -2.981 21.163 -23.695 1.00 0.00 ? ? ? ? ? . 37 CYS A HB3 223 ATOM 539 H HG . CYS A 223 37 . -4.894 20.233 -25.249 1.00 0.00 ? ? ? ? ? . 37 CYS A HG 223 ATOM 540 N N . GLY A 223 38 . -0.262 18.834 -23.994 1.00 0.00 ? ? ? ? ? . 38 GLY A N 223 ATOM 541 C CA . GLY A 223 38 . 1.113 18.640 -23.453 1.00 0.00 ? ? ? ? ? . 38 GLY A CA 223 ATOM 542 C C . GLY A 223 38 . 1.034 17.971 -22.080 1.00 0.00 ? ? ? ? ? . 38 GLY A C 223 ATOM 543 O O . GLY A 223 38 . 1.563 18.467 -21.105 1.00 0.00 ? ? ? ? ? . 38 GLY A O 223 ATOM 544 H H . GLY A 223 38 . -0.955 18.163 -23.823 1.00 0.00 ? ? ? ? ? . 38 GLY A H 223 ATOM 545 H HA2 . GLY A 223 38 . 1.679 18.013 -24.128 1.00 0.00 ? ? ? ? ? . 38 GLY A HA2 223 ATOM 546 H HA3 . GLY A 223 38 . 1.600 19.598 -23.355 1.00 0.00 ? ? ? ? ? . 38 GLY A HA3 223 ATOM 547 N N . ASP A 223 39 . 0.378 16.845 -21.994 1.00 0.00 ? ? ? ? ? . 39 ASP A N 223 ATOM 548 C CA . ASP A 223 39 . 0.268 16.145 -20.682 1.00 0.00 ? ? ? ? ? . 39 ASP A CA 223 ATOM 549 C C . ASP A 223 39 . 0.782 14.710 -20.828 1.00 0.00 ? ? ? ? ? . 39 ASP A C 223 ATOM 550 O O . ASP A 223 39 . 0.485 14.030 -21.789 1.00 0.00 ? ? ? ? ? . 39 ASP A O 223 ATOM 551 C CB . ASP A 223 39 . -1.195 16.120 -20.236 1.00 0.00 ? ? ? ? ? . 39 ASP A CB 223 ATOM 552 C CG . ASP A 223 39 . -1.886 17.412 -20.675 1.00 0.00 ? ? ? ? ? . 39 ASP A CG 223 ATOM 553 O OD1 . ASP A 223 39 . -1.186 18.377 -20.935 1.00 0.00 ? ? ? ? ? . 39 ASP A OD1 223 ATOM 554 O OD2 . ASP A 223 39 . -3.105 17.415 -20.744 1.00 0.00 ? ? ? ? ? . 39 ASP A OD2 223 ATOM 555 H H . ASP A 223 39 . -0.041 16.461 -22.791 1.00 0.00 ? ? ? ? ? . 39 ASP A H 223 ATOM 556 H HA . ASP A 223 39 . 0.862 16.667 -19.946 1.00 0.00 ? ? ? ? ? . 39 ASP A HA 223 ATOM 557 H HB2 . ASP A 223 39 . -1.694 15.273 -20.685 1.00 0.00 ? ? ? ? ? . 39 ASP A HB2 223 ATOM 558 H HB3 . ASP A 223 39 . -1.242 16.038 -19.160 1.00 0.00 ? ? ? ? ? . 39 ASP A HB3 223 ATOM 559 N N . VAL A 223 40 . 1.552 14.246 -19.881 1.00 0.00 ? ? ? ? ? . 40 VAL A N 223 ATOM 560 C CA . VAL A 223 40 . 2.084 12.857 -19.968 1.00 0.00 ? ? ? ? ? . 40 VAL A CA 223 ATOM 561 C C . VAL A 223 40 . 1.621 12.054 -18.751 1.00 0.00 ? ? ? ? ? . 40 VAL A C 223 ATOM 562 O O . VAL A 223 40 . 1.659 12.528 -17.633 1.00 0.00 ? ? ? ? ? . 40 VAL A O 223 ATOM 563 C CB . VAL A 223 40 . 3.612 12.898 -19.998 1.00 0.00 ? ? ? ? ? . 40 VAL A CB 223 ATOM 564 C CG1 . VAL A 223 40 . 4.126 13.732 -18.822 1.00 0.00 ? ? ? ? ? . 40 VAL A CG1 223 ATOM 565 C CG2 . VAL A 223 40 . 4.162 11.474 -19.890 1.00 0.00 ? ? ? ? ? . 40 VAL A CG2 223 ATOM 566 H H . VAL A 223 40 . 1.780 14.812 -19.114 1.00 0.00 ? ? ? ? ? . 40 VAL A H 223 ATOM 567 H HA . VAL A 223 40 . 1.719 12.387 -20.869 1.00 0.00 ? ? ? ? ? . 40 VAL A HA 223 ATOM 568 H HB . VAL A 223 40 . 3.941 13.344 -20.925 1.00 0.00 ? ? ? ? ? . 40 VAL A HB 223 ATOM 569 H HG11 . VAL A 223 40 . 4.308 13.087 -17.976 1.00 0.00 ? ? ? ? ? . 40 VAL A HG11 223 ATOM 570 H HG12 . VAL A 223 40 . 3.387 14.474 -18.558 1.00 0.00 ? ? ? ? ? . 40 VAL A HG12 223 ATOM 571 H HG13 . VAL A 223 40 . 5.044 14.225 -19.104 1.00 0.00 ? ? ? ? ? . 40 VAL A HG13 223 ATOM 572 H HG21 . VAL A 223 40 . 5.039 11.379 -20.513 1.00 0.00 ? ? ? ? ? . 40 VAL A HG21 223 ATOM 573 H HG22 . VAL A 223 40 . 3.411 10.771 -20.218 1.00 0.00 ? ? ? ? ? . 40 VAL A HG22 223 ATOM 574 H HG23 . VAL A 223 40 . 4.426 11.267 -18.864 1.00 0.00 ? ? ? ? ? . 40 VAL A HG23 223 ATOM 575 N N . MET A 223 41 . 1.184 10.842 -18.959 1.00 0.00 ? ? ? ? ? . 41 MET A N 223 ATOM 576 C CA . MET A 223 41 . 0.720 10.011 -17.813 1.00 0.00 ? ? ? ? ? . 41 MET A CA 223 ATOM 577 C C . MET A 223 41 . 1.322 8.609 -17.922 1.00 0.00 ? ? ? ? ? . 41 MET A C 223 ATOM 578 O O . MET A 223 41 . 1.365 8.021 -18.985 1.00 0.00 ? ? ? ? ? . 41 MET A O 223 ATOM 579 C CB . MET A 223 41 . -0.806 9.911 -17.839 1.00 0.00 ? ? ? ? ? . 41 MET A CB 223 ATOM 580 C CG . MET A 223 41 . -1.254 8.719 -16.993 1.00 0.00 ? ? ? ? ? . 41 MET A CG 223 ATOM 581 S SD . MET A 223 41 . -2.789 9.133 -16.128 1.00 0.00 ? ? ? ? ? . 41 MET A SD 223 ATOM 582 C CE . MET A 223 41 . -2.827 7.693 -15.033 1.00 0.00 ? ? ? ? ? . 41 MET A CE 223 ATOM 583 H H . MET A 223 41 . 1.161 10.479 -19.869 1.00 0.00 ? ? ? ? ? . 41 MET A H 223 ATOM 584 H HA . MET A 223 41 . 1.036 10.467 -16.886 1.00 0.00 ? ? ? ? ? . 41 MET A HA 223 ATOM 585 H HB2 . MET A 223 41 . -1.233 10.820 -17.438 1.00 0.00 ? ? ? ? ? . 41 MET A HB2 223 ATOM 586 H HB3 . MET A 223 41 . -1.142 9.775 -18.857 1.00 0.00 ? ? ? ? ? . 41 MET A HB3 223 ATOM 587 H HG2 . MET A 223 41 . -1.421 7.866 -17.634 1.00 0.00 ? ? ? ? ? . 41 MET A HG2 223 ATOM 588 H HG3 . MET A 223 41 . -0.487 8.482 -16.271 1.00 0.00 ? ? ? ? ? . 41 MET A HG3 223 ATOM 589 H HE1 . MET A 223 41 . -1.992 7.740 -14.347 1.00 0.00 ? ? ? ? ? . 41 MET A HE1 223 ATOM 590 H HE2 . MET A 223 41 . -2.757 6.791 -15.620 1.00 0.00 ? ? ? ? ? . 41 MET A HE2 223 ATOM 591 H HE3 . MET A 223 41 . -3.755 7.688 -14.478 1.00 0.00 ? ? ? ? ? . 41 MET A HE3 223 ATOM 592 N N . GLN A 223 42 . 1.786 8.066 -16.829 1.00 0.00 ? ? ? ? ? . 42 GLN A N 223 ATOM 593 C CA . GLN A 223 42 . 2.381 6.700 -16.869 1.00 0.00 ? ? ? ? ? . 42 GLN A CA 223 ATOM 594 C C . GLN A 223 42 . 1.750 5.840 -15.774 1.00 0.00 ? ? ? ? ? . 42 GLN A C 223 ATOM 595 O O . GLN A 223 42 . 1.722 6.212 -14.618 1.00 0.00 ? ? ? ? ? . 42 GLN A O 223 ATOM 596 C CB . GLN A 223 42 . 3.891 6.796 -16.635 1.00 0.00 ? ? ? ? ? . 42 GLN A CB 223 ATOM 597 C CG . GLN A 223 42 . 4.544 5.452 -16.963 1.00 0.00 ? ? ? ? ? . 42 GLN A CG 223 ATOM 598 C CD . GLN A 223 42 . 6.054 5.548 -16.737 1.00 0.00 ? ? ? ? ? . 42 GLN A CD 223 ATOM 599 O OE1 . GLN A 223 42 . 6.824 5.513 -17.676 1.00 0.00 ? ? ? ? ? . 42 GLN A OE1 223 ATOM 600 N NE2 . GLN A 223 42 . 6.511 5.672 -15.521 1.00 0.00 ? ? ? ? ? . 42 GLN A NE2 223 ATOM 601 H H . GLN A 223 42 . 1.740 8.556 -15.981 1.00 0.00 ? ? ? ? ? . 42 GLN A H 223 ATOM 602 H HA . GLN A 223 42 . 2.193 6.253 -17.833 1.00 0.00 ? ? ? ? ? . 42 GLN A HA 223 ATOM 603 H HB2 . GLN A 223 42 . 4.305 7.563 -17.273 1.00 0.00 ? ? ? ? ? . 42 GLN A HB2 223 ATOM 604 H HB3 . GLN A 223 42 . 4.081 7.044 -15.603 1.00 0.00 ? ? ? ? ? . 42 GLN A HB3 223 ATOM 605 H HG2 . GLN A 223 42 . 4.131 4.686 -16.321 1.00 0.00 ? ? ? ? ? . 42 GLN A HG2 223 ATOM 606 H HG3 . GLN A 223 42 . 4.352 5.200 -17.994 1.00 0.00 ? ? ? ? ? . 42 GLN A HG3 223 ATOM 607 H HE21 . GLN A 223 42 . 5.890 5.701 -14.764 1.00 0.00 ? ? ? ? ? . 42 GLN A HE21 223 ATOM 608 H HE22 . GLN A 223 42 . 7.478 5.734 -15.366 1.00 0.00 ? ? ? ? ? . 42 GLN A HE22 223 ATOM 609 N N . LEU A 223 43 . 1.238 4.692 -16.128 1.00 0.00 ? ? ? ? ? . 43 LEU A N 223 ATOM 610 C CA . LEU A 223 43 . 0.607 3.814 -15.103 1.00 0.00 ? ? ? ? ? . 43 LEU A CA 223 ATOM 611 C C . LEU A 223 43 . 1.121 2.382 -15.262 1.00 0.00 ? ? ? ? ? . 43 LEU A C 223 ATOM 612 O O . LEU A 223 43 . 1.160 1.842 -16.349 1.00 0.00 ? ? ? ? ? . 43 LEU A O 223 ATOM 613 C CB . LEU A 223 43 . -0.912 3.832 -15.285 1.00 0.00 ? ? ? ? ? . 43 LEU A CB 223 ATOM 614 C CG . LEU A 223 43 . -1.546 2.766 -14.392 1.00 0.00 ? ? ? ? ? . 43 LEU A CG 223 ATOM 615 C CD1 . LEU A 223 43 . -2.828 3.319 -13.767 1.00 0.00 ? ? ? ? ? . 43 LEU A CD1 223 ATOM 616 C CD2 . LEU A 223 43 . -1.881 1.531 -15.232 1.00 0.00 ? ? ? ? ? . 43 LEU A CD2 223 ATOM 617 H H . LEU A 223 43 . 1.268 4.409 -17.066 1.00 0.00 ? ? ? ? ? . 43 LEU A H 223 ATOM 618 H HA . LEU A 223 43 . 0.854 4.179 -14.117 1.00 0.00 ? ? ? ? ? . 43 LEU A HA 223 ATOM 619 H HB2 . LEU A 223 43 . -1.296 4.806 -15.015 1.00 0.00 ? ? ? ? ? . 43 LEU A HB2 223 ATOM 620 H HB3 . LEU A 223 43 . -1.153 3.624 -16.317 1.00 0.00 ? ? ? ? ? . 43 LEU A HB3 223 ATOM 621 H HG . LEU A 223 43 . -0.853 2.495 -13.609 1.00 0.00 ? ? ? ? ? . 43 LEU A HG 223 ATOM 622 H HD11 . LEU A 223 43 . -2.625 4.280 -13.320 1.00 0.00 ? ? ? ? ? . 43 LEU A HD11 223 ATOM 623 H HD12 . LEU A 223 43 . -3.183 2.636 -13.009 1.00 0.00 ? ? ? ? ? . 43 LEU A HD12 223 ATOM 624 H HD13 . LEU A 223 43 . -3.582 3.431 -14.532 1.00 0.00 ? ? ? ? ? . 43 LEU A HD13 223 ATOM 625 H HD21 . LEU A 223 43 . -2.421 1.833 -16.116 1.00 0.00 ? ? ? ? ? . 43 LEU A HD21 223 ATOM 626 H HD22 . LEU A 223 43 . -2.491 0.855 -14.651 1.00 0.00 ? ? ? ? ? . 43 LEU A HD22 223 ATOM 627 H HD23 . LEU A 223 43 . -0.966 1.034 -15.519 1.00 0.00 ? ? ? ? ? . 43 LEU A HD23 223 ATOM 628 N N . GLN A 223 44 . 1.510 1.761 -14.183 1.00 0.00 ? ? ? ? ? . 44 GLN A N 223 ATOM 629 C CA . GLN A 223 44 . 2.017 0.363 -14.265 1.00 0.00 ? ? ? ? ? . 44 GLN A CA 223 ATOM 630 C C . GLN A 223 44 . 1.316 -0.488 -13.205 1.00 0.00 ? ? ? ? ? . 44 GLN A C 223 ATOM 631 O O . GLN A 223 44 . 1.195 -0.096 -12.062 1.00 0.00 ? ? ? ? ? . 44 GLN A O 223 ATOM 632 C CB . GLN A 223 44 . 3.527 0.348 -14.014 1.00 0.00 ? ? ? ? ? . 44 GLN A CB 223 ATOM 633 C CG . GLN A 223 44 . 4.080 -1.050 -14.297 1.00 0.00 ? ? ? ? ? . 44 GLN A CG 223 ATOM 634 C CD . GLN A 223 44 . 5.263 -1.328 -13.369 1.00 0.00 ? ? ? ? ? . 44 GLN A CD 223 ATOM 635 O OE1 . GLN A 223 44 . 5.224 -0.998 -12.200 1.00 0.00 ? ? ? ? ? . 44 GLN A OE1 223 ATOM 636 N NE2 . GLN A 223 44 . 6.323 -1.925 -13.844 1.00 0.00 ? ? ? ? ? . 44 GLN A NE2 223 ATOM 637 H H . GLN A 223 44 . 1.467 2.215 -13.315 1.00 0.00 ? ? ? ? ? . 44 GLN A H 223 ATOM 638 H HA . GLN A 223 44 . 1.810 -0.039 -15.246 1.00 0.00 ? ? ? ? ? . 44 GLN A HA 223 ATOM 639 H HB2 . GLN A 223 44 . 4.006 1.064 -14.666 1.00 0.00 ? ? ? ? ? . 44 GLN A HB2 223 ATOM 640 H HB3 . GLN A 223 44 . 3.724 0.611 -12.986 1.00 0.00 ? ? ? ? ? . 44 GLN A HB3 223 ATOM 641 H HG2 . GLN A 223 44 . 3.306 -1.784 -14.125 1.00 0.00 ? ? ? ? ? . 44 GLN A HG2 223 ATOM 642 H HG3 . GLN A 223 44 . 4.409 -1.107 -15.324 1.00 0.00 ? ? ? ? ? . 44 GLN A HG3 223 ATOM 643 H HE21 . GLN A 223 44 . 6.355 -2.190 -14.787 1.00 0.00 ? ? ? ? ? . 44 GLN A HE21 223 ATOM 644 H HE22 . GLN A 223 44 . 7.086 -2.108 -13.257 1.00 0.00 ? ? ? ? ? . 44 GLN A HE22 223 ATOM 645 N N . ILE A 223 45 . 0.847 -1.649 -13.573 1.00 0.00 ? ? ? ? ? . 45 ILE A N 223 ATOM 646 C CA . ILE A 223 45 . 0.152 -2.515 -12.579 1.00 0.00 ? ? ? ? ? . 45 ILE A CA 223 ATOM 647 C C . ILE A 223 45 . 0.947 -3.808 -12.377 1.00 0.00 ? ? ? ? ? . 45 ILE A C 223 ATOM 648 O O . ILE A 223 45 . 1.610 -4.286 -13.277 1.00 0.00 ? ? ? ? ? . 45 ILE A O 223 ATOM 649 C CB . ILE A 223 45 . -1.253 -2.847 -13.084 1.00 0.00 ? ? ? ? ? . 45 ILE A CB 223 ATOM 650 C CG1 . ILE A 223 45 . -1.185 -3.231 -14.564 1.00 0.00 ? ? ? ? ? . 45 ILE A CG1 223 ATOM 651 C CG2 . ILE A 223 45 . -2.159 -1.623 -12.916 1.00 0.00 ? ? ? ? ? . 45 ILE A CG2 223 ATOM 652 C CD1 . ILE A 223 45 . -2.147 -4.390 -14.835 1.00 0.00 ? ? ? ? ? . 45 ILE A CD1 223 ATOM 653 H H . ILE A 223 45 . 0.951 -1.950 -14.500 1.00 0.00 ? ? ? ? ? . 45 ILE A H 223 ATOM 654 H HA . ILE A 223 45 . 0.079 -1.992 -11.636 1.00 0.00 ? ? ? ? ? . 45 ILE A HA 223 ATOM 655 H HB . ILE A 223 45 . -1.655 -3.672 -12.514 1.00 0.00 ? ? ? ? ? . 45 ILE A HB 223 ATOM 656 H HG12 . ILE A 223 45 . -1.464 -2.382 -15.171 1.00 0.00 ? ? ? ? ? . 45 ILE A HG12 223 ATOM 657 H HG13 . ILE A 223 45 . -0.179 -3.537 -14.812 1.00 0.00 ? ? ? ? ? . 45 ILE A HG13 223 ATOM 658 H HG21 . ILE A 223 45 . -2.577 -1.349 -13.874 1.00 0.00 ? ? ? ? ? . 45 ILE A HG21 223 ATOM 659 H HG22 . ILE A 223 45 . -1.580 -0.797 -12.528 1.00 0.00 ? ? ? ? ? . 45 ILE A HG22 223 ATOM 660 H HG23 . ILE A 223 45 . -2.957 -1.857 -12.229 1.00 0.00 ? ? ? ? ? . 45 ILE A HG23 223 ATOM 661 H HD11 . ILE A 223 45 . -3.165 -4.038 -14.759 1.00 0.00 ? ? ? ? ? . 45 ILE A HD11 223 ATOM 662 H HD12 . ILE A 223 45 . -1.981 -5.172 -14.107 1.00 0.00 ? ? ? ? ? . 45 ILE A HD12 223 ATOM 663 H HD13 . ILE A 223 45 . -1.973 -4.779 -15.827 1.00 0.00 ? ? ? ? ? . 45 ILE A HD13 223 ATOM 664 N N . LYS A 223 46 . 0.889 -4.373 -11.203 1.00 0.00 ? ? ? ? ? . 46 LYS A N 223 ATOM 665 C CA . LYS A 223 46 . 1.645 -5.629 -10.940 1.00 0.00 ? ? ? ? ? . 46 LYS A CA 223 ATOM 666 C C . LYS A 223 46 . 0.666 -6.791 -10.750 1.00 0.00 ? ? ? ? ? . 46 LYS A C 223 ATOM 667 O O . LYS A 223 46 . -0.334 -6.667 -10.071 1.00 0.00 ? ? ? ? ? . 46 LYS A O 223 ATOM 668 C CB . LYS A 223 46 . 2.487 -5.460 -9.674 1.00 0.00 ? ? ? ? ? . 46 LYS A CB 223 ATOM 669 C CG . LYS A 223 46 . 3.608 -6.500 -9.659 1.00 0.00 ? ? ? ? ? . 46 LYS A CG 223 ATOM 670 C CD . LYS A 223 46 . 4.025 -6.781 -8.214 1.00 0.00 ? ? ? ? ? . 46 LYS A CD 223 ATOM 671 C CE . LYS A 223 46 . 5.343 -7.559 -8.202 1.00 0.00 ? ? ? ? ? . 46 LYS A CE 223 ATOM 672 N NZ . LYS A 223 46 . 5.361 -8.524 -9.338 1.00 0.00 ? ? ? ? ? . 46 LYS A NZ 223 ATOM 673 H H . LYS A 223 46 . 0.350 -3.968 -10.491 1.00 0.00 ? ? ? ? ? . 46 LYS A H 223 ATOM 674 H HA . LYS A 223 46 . 2.294 -5.840 -11.778 1.00 0.00 ? ? ? ? ? . 46 LYS A HA 223 ATOM 675 H HB2 . LYS A 223 46 . 2.915 -4.468 -9.656 1.00 0.00 ? ? ? ? ? . 46 LYS A HB2 223 ATOM 676 H HB3 . LYS A 223 46 . 1.861 -5.597 -8.805 1.00 0.00 ? ? ? ? ? . 46 LYS A HB3 223 ATOM 677 H HG2 . LYS A 223 46 . 3.257 -7.414 -10.119 1.00 0.00 ? ? ? ? ? . 46 LYS A HG2 223 ATOM 678 H HG3 . LYS A 223 46 . 4.457 -6.123 -10.210 1.00 0.00 ? ? ? ? ? . 46 LYS A HG3 223 ATOM 679 H HD2 . LYS A 223 46 . 4.153 -5.846 -7.689 1.00 0.00 ? ? ? ? ? . 46 LYS A HD2 223 ATOM 680 H HD3 . LYS A 223 46 . 3.261 -7.367 -7.726 1.00 0.00 ? ? ? ? ? . 46 LYS A HD3 223 ATOM 681 H HE2 . LYS A 223 46 . 6.168 -6.870 -8.302 1.00 0.00 ? ? ? ? ? . 46 LYS A HE2 223 ATOM 682 H HE3 . LYS A 223 46 . 5.434 -8.098 -7.271 1.00 0.00 ? ? ? ? ? . 46 LYS A HE3 223 ATOM 683 H HZ1 . LYS A 223 46 . 4.478 -9.070 -9.345 1.00 0.00 ? ? ? ? ? . 46 LYS A HZ1 223 ATOM 684 H HZ2 . LYS A 223 46 . 6.170 -9.170 -9.230 1.00 0.00 ? ? ? ? ? . 46 LYS A HZ2 223 ATOM 685 H HZ3 . LYS A 223 46 . 5.450 -8.004 -10.234 1.00 0.00 ? ? ? ? ? . 46 LYS A HZ3 223 ATOM 686 N N . VAL A 223 47 . 0.948 -7.919 -11.340 1.00 0.00 ? ? ? ? ? . 47 VAL A N 223 ATOM 687 C CA . VAL A 223 47 . 0.039 -9.091 -11.193 1.00 0.00 ? ? ? ? ? . 47 VAL A CA 223 ATOM 688 C C . VAL A 223 47 . 0.858 -10.312 -10.772 1.00 0.00 ? ? ? ? ? . 47 VAL A C 223 ATOM 689 O O . VAL A 223 47 . 1.719 -10.772 -11.494 1.00 0.00 ? ? ? ? ? . 47 VAL A O 223 ATOM 690 C CB . VAL A 223 47 . -0.651 -9.374 -12.529 1.00 0.00 ? ? ? ? ? . 47 VAL A CB 223 ATOM 691 C CG1 . VAL A 223 47 . -1.257 -10.777 -12.505 1.00 0.00 ? ? ? ? ? . 47 VAL A CG1 223 ATOM 692 C CG2 . VAL A 223 47 . -1.760 -8.344 -12.757 1.00 0.00 ? ? ? ? ? . 47 VAL A CG2 223 ATOM 693 H H . VAL A 223 47 . 1.762 -7.998 -11.882 1.00 0.00 ? ? ? ? ? . 47 VAL A H 223 ATOM 694 H HA . VAL A 223 47 . -0.705 -8.878 -10.440 1.00 0.00 ? ? ? ? ? . 47 VAL A HA 223 ATOM 695 H HB . VAL A 223 47 . 0.074 -9.308 -13.328 1.00 0.00 ? ? ? ? ? . 47 VAL A HB 223 ATOM 696 H HG11 . VAL A 223 47 . -1.757 -10.937 -11.561 1.00 0.00 ? ? ? ? ? . 47 VAL A HG11 223 ATOM 697 H HG12 . VAL A 223 47 . -0.474 -11.511 -12.627 1.00 0.00 ? ? ? ? ? . 47 VAL A HG12 223 ATOM 698 H HG13 . VAL A 223 47 . -1.970 -10.875 -13.311 1.00 0.00 ? ? ? ? ? . 47 VAL A HG13 223 ATOM 699 H HG21 . VAL A 223 47 . -2.721 -8.811 -12.605 1.00 0.00 ? ? ? ? ? . 47 VAL A HG21 223 ATOM 700 H HG22 . VAL A 223 47 . -1.698 -7.967 -13.768 1.00 0.00 ? ? ? ? ? . 47 VAL A HG22 223 ATOM 701 H HG23 . VAL A 223 47 . -1.641 -7.527 -12.060 1.00 0.00 ? ? ? ? ? . 47 VAL A HG23 223 ATOM 702 N N . ASP A 223 48 . 0.602 -10.842 -9.606 1.00 0.00 ? ? ? ? ? . 48 ASP A N 223 ATOM 703 C CA . ASP A 223 48 . 1.375 -12.031 -9.148 1.00 0.00 ? ? ? ? ? . 48 ASP A CA 223 ATOM 704 C C . ASP A 223 48 . 0.606 -12.758 -8.045 1.00 0.00 ? ? ? ? ? . 48 ASP A C 223 ATOM 705 O O . ASP A 223 48 . 0.657 -13.966 -7.936 1.00 0.00 ? ? ? ? ? . 48 ASP A O 223 ATOM 706 C CB . ASP A 223 48 . 2.730 -11.580 -8.600 1.00 0.00 ? ? ? ? ? . 48 ASP A CB 223 ATOM 707 C CG . ASP A 223 48 . 3.753 -11.540 -9.736 1.00 0.00 ? ? ? ? ? . 48 ASP A CG 223 ATOM 708 O OD1 . ASP A 223 48 . 4.234 -12.598 -10.110 1.00 0.00 ? ? ? ? ? . 48 ASP A OD1 223 ATOM 709 O OD2 . ASP A 223 48 . 4.040 -10.455 -10.211 1.00 0.00 ? ? ? ? ? . 48 ASP A OD2 223 ATOM 710 H H . ASP A 223 48 . -0.096 -10.457 -9.033 1.00 0.00 ? ? ? ? ? . 48 ASP A H 223 ATOM 711 H HA . ASP A 223 48 . 1.530 -12.702 -9.980 1.00 0.00 ? ? ? ? ? . 48 ASP A HA 223 ATOM 712 H HB2 . ASP A 223 48 . 2.632 -10.595 -8.166 1.00 0.00 ? ? ? ? ? . 48 ASP A HB2 223 ATOM 713 H HB3 . ASP A 223 48 . 3.059 -12.275 -7.844 1.00 0.00 ? ? ? ? ? . 48 ASP A HB3 223 ATOM 714 N N . ASP A 223 49 . -0.100 -12.033 -7.223 1.00 0.00 ? ? ? ? ? . 49 ASP A N 223 ATOM 715 C CA . ASP A 223 49 . -0.867 -12.686 -6.125 1.00 0.00 ? ? ? ? ? . 49 ASP A CA 223 ATOM 716 C C . ASP A 223 49 . -1.919 -13.618 -6.728 1.00 0.00 ? ? ? ? ? . 49 ASP A C 223 ATOM 717 O O . ASP A 223 49 . -3.083 -13.561 -6.384 1.00 0.00 ? ? ? ? ? . 49 ASP A O 223 ATOM 718 C CB . ASP A 223 49 . -1.554 -11.615 -5.275 1.00 0.00 ? ? ? ? ? . 49 ASP A CB 223 ATOM 719 C CG . ASP A 223 49 . -2.311 -12.284 -4.126 1.00 0.00 ? ? ? ? ? . 49 ASP A CG 223 ATOM 720 O OD1 . ASP A 223 49 . -2.077 -13.459 -3.893 1.00 0.00 ? ? ? ? ? . 49 ASP A OD1 223 ATOM 721 O OD2 . ASP A 223 49 . -3.111 -11.611 -3.497 1.00 0.00 ? ? ? ? ? . 49 ASP A OD2 223 ATOM 722 H H . ASP A 223 49 . -0.124 -11.058 -7.326 1.00 0.00 ? ? ? ? ? . 49 ASP A H 223 ATOM 723 H HA . ASP A 223 49 . -0.192 -13.258 -5.508 1.00 0.00 ? ? ? ? ? . 49 ASP A HA 223 ATOM 724 H HB2 . ASP A 223 49 . -0.811 -10.943 -4.873 1.00 0.00 ? ? ? ? ? . 49 ASP A HB2 223 ATOM 725 H HB3 . ASP A 223 49 . -2.248 -11.060 -5.886 1.00 0.00 ? ? ? ? ? . 49 ASP A HB3 223 ATOM 726 N N . ASN A 223 50 . -1.515 -14.472 -7.628 1.00 0.00 ? ? ? ? ? . 50 ASN A N 223 ATOM 727 C CA . ASN A 223 50 . -2.483 -15.411 -8.265 1.00 0.00 ? ? ? ? ? . 50 ASN A CA 223 ATOM 728 C C . ASN A 223 50 . -3.222 -14.687 -9.390 1.00 0.00 ? ? ? ? ? . 50 ASN A C 223 ATOM 729 O O . ASN A 223 50 . -4.436 -14.651 -9.426 1.00 0.00 ? ? ? ? ? . 50 ASN A O 223 ATOM 730 C CB . ASN A 223 50 . -3.490 -15.902 -7.223 1.00 0.00 ? ? ? ? ? . 50 ASN A CB 223 ATOM 731 C CG . ASN A 223 50 . -2.804 -16.014 -5.860 1.00 0.00 ? ? ? ? ? . 50 ASN A CG 223 ATOM 732 O OD1 . ASN A 223 50 . -1.746 -16.600 -5.746 1.00 0.00 ? ? ? ? ? . 50 ASN A OD1 223 ATOM 733 N ND2 . ASN A 223 50 . -3.366 -15.473 -4.813 1.00 0.00 ? ? ? ? ? . 50 ASN A ND2 223 ATOM 734 H H . ASN A 223 50 . -0.570 -14.492 -7.890 1.00 0.00 ? ? ? ? ? . 50 ASN A H 223 ATOM 735 H HA . ASN A 223 50 . -1.947 -16.255 -8.674 1.00 0.00 ? ? ? ? ? . 50 ASN A HA 223 ATOM 736 H HB2 . ASN A 223 50 . -4.312 -15.204 -7.158 1.00 0.00 ? ? ? ? ? . 50 ASN A HB2 223 ATOM 737 H HB3 . ASN A 223 50 . -3.865 -16.872 -7.515 1.00 0.00 ? ? ? ? ? . 50 ASN A HB3 223 ATOM 738 H HD21 . ASN A 223 50 . -4.220 -15.000 -4.903 1.00 0.00 ? ? ? ? ? . 50 ASN A HD21 223 ATOM 739 H HD22 . ASN A 223 50 . -2.933 -15.541 -3.936 1.00 0.00 ? ? ? ? ? . 50 ASN A HD22 223 ATOM 740 N N . GLY A 223 51 . -2.498 -14.105 -10.307 1.00 0.00 ? ? ? ? ? . 51 GLY A N 223 ATOM 741 C CA . GLY A 223 51 . -3.159 -13.380 -11.428 1.00 0.00 ? ? ? ? ? . 51 GLY A CA 223 ATOM 742 C C . GLY A 223 51 . -3.885 -12.154 -10.873 1.00 0.00 ? ? ? ? ? . 51 GLY A C 223 ATOM 743 O O . GLY A 223 51 . -4.518 -11.411 -11.597 1.00 0.00 ? ? ? ? ? . 51 GLY A O 223 ATOM 744 H H . GLY A 223 51 . -1.521 -14.145 -10.257 1.00 0.00 ? ? ? ? ? . 51 GLY A H 223 ATOM 745 H HA2 . GLY A 223 51 . -2.413 -13.066 -12.144 1.00 0.00 ? ? ? ? ? . 51 GLY A HA2 223 ATOM 746 H HA3 . GLY A 223 51 . -3.872 -14.029 -11.910 1.00 0.00 ? ? ? ? ? . 51 GLY A HA3 223 ATOM 747 N N . ILE A 223 52 . -3.799 -11.938 -9.588 1.00 0.00 ? ? ? ? ? . 52 ILE A N 223 ATOM 748 C CA . ILE A 223 52 . -4.481 -10.765 -8.979 1.00 0.00 ? ? ? ? ? . 52 ILE A CA 223 ATOM 749 C C . ILE A 223 52 . -3.508 -9.586 -8.915 1.00 0.00 ? ? ? ? ? . 52 ILE A C 223 ATOM 750 O O . ILE A 223 52 . -2.310 -9.747 -9.051 1.00 0.00 ? ? ? ? ? . 52 ILE A O 223 ATOM 751 C CB . ILE A 223 52 . -4.937 -11.124 -7.564 1.00 0.00 ? ? ? ? ? . 52 ILE A CB 223 ATOM 752 C CG1 . ILE A 223 52 . -6.002 -12.223 -7.635 1.00 0.00 ? ? ? ? ? . 52 ILE A CG1 223 ATOM 753 C CG2 . ILE A 223 52 . -5.523 -9.885 -6.885 1.00 0.00 ? ? ? ? ? . 52 ILE A CG2 223 ATOM 754 C CD1 . ILE A 223 52 . -7.385 -11.590 -7.806 1.00 0.00 ? ? ? ? ? . 52 ILE A CD1 223 ATOM 755 H H . ILE A 223 52 . -3.283 -12.552 -9.024 1.00 0.00 ? ? ? ? ? . 52 ILE A H 223 ATOM 756 H HA . ILE A 223 52 . -5.338 -10.494 -9.577 1.00 0.00 ? ? ? ? ? . 52 ILE A HA 223 ATOM 757 H HB . ILE A 223 52 . -4.091 -11.478 -6.995 1.00 0.00 ? ? ? ? ? . 52 ILE A HB 223 ATOM 758 H HG12 . ILE A 223 52 . -5.795 -12.870 -8.475 1.00 0.00 ? ? ? ? ? . 52 ILE A HG12 223 ATOM 759 H HG13 . ILE A 223 52 . -5.983 -12.800 -6.724 1.00 0.00 ? ? ? ? ? . 52 ILE A HG13 223 ATOM 760 H HG21 . ILE A 223 52 . -6.241 -9.418 -7.542 1.00 0.00 ? ? ? ? ? . 52 ILE A HG21 223 ATOM 761 H HG22 . ILE A 223 52 . -4.730 -9.186 -6.664 1.00 0.00 ? ? ? ? ? . 52 ILE A HG22 223 ATOM 762 H HG23 . ILE A 223 52 . -6.011 -10.175 -5.966 1.00 0.00 ? ? ? ? ? . 52 ILE A HG23 223 ATOM 763 H HD11 . ILE A 223 52 . -8.077 -12.330 -8.178 1.00 0.00 ? ? ? ? ? . 52 ILE A HD11 223 ATOM 764 H HD12 . ILE A 223 52 . -7.321 -10.771 -8.507 1.00 0.00 ? ? ? ? ? . 52 ILE A HD12 223 ATOM 765 H HD13 . ILE A 223 52 . -7.732 -11.221 -6.852 1.00 0.00 ? ? ? ? ? . 52 ILE A HD13 223 ATOM 766 N N . ILE A 223 53 . -4.014 -8.400 -8.707 1.00 0.00 ? ? ? ? ? . 53 ILE A N 223 ATOM 767 C CA . ILE A 223 53 . -3.122 -7.211 -8.632 1.00 0.00 ? ? ? ? ? . 53 ILE A CA 223 ATOM 768 C C . ILE A 223 53 . -2.830 -6.889 -7.166 1.00 0.00 ? ? ? ? ? . 53 ILE A C 223 ATOM 769 O O . ILE A 223 53 . -3.711 -6.524 -6.413 1.00 0.00 ? ? ? ? ? . 53 ILE A O 223 ATOM 770 C CB . ILE A 223 53 . -3.811 -6.013 -9.290 1.00 0.00 ? ? ? ? ? . 53 ILE A CB 223 ATOM 771 C CG1 . ILE A 223 53 . -4.397 -6.443 -10.636 1.00 0.00 ? ? ? ? ? . 53 ILE A CG1 223 ATOM 772 C CG2 . ILE A 223 53 . -2.790 -4.896 -9.513 1.00 0.00 ? ? ? ? ? . 53 ILE A CG2 223 ATOM 773 C CD1 . ILE A 223 53 . -4.680 -5.204 -11.488 1.00 0.00 ? ? ? ? ? . 53 ILE A CD1 223 ATOM 774 H H . ILE A 223 53 . -4.982 -8.294 -8.599 1.00 0.00 ? ? ? ? ? . 53 ILE A H 223 ATOM 775 H HA . ILE A 223 53 . -2.195 -7.422 -9.146 1.00 0.00 ? ? ? ? ? . 53 ILE A HA 223 ATOM 776 H HB . ILE A 223 53 . -4.602 -5.656 -8.647 1.00 0.00 ? ? ? ? ? . 53 ILE A HB 223 ATOM 777 H HG12 . ILE A 223 53 . -3.691 -7.079 -11.150 1.00 0.00 ? ? ? ? ? . 53 ILE A HG12 223 ATOM 778 H HG13 . ILE A 223 53 . -5.317 -6.983 -10.473 1.00 0.00 ? ? ? ? ? . 53 ILE A HG13 223 ATOM 779 H HG21 . ILE A 223 53 . -3.299 -4.007 -9.855 1.00 0.00 ? ? ? ? ? . 53 ILE A HG21 223 ATOM 780 H HG22 . ILE A 223 53 . -2.071 -5.208 -10.256 1.00 0.00 ? ? ? ? ? . 53 ILE A HG22 223 ATOM 781 H HG23 . ILE A 223 53 . -2.280 -4.684 -8.585 1.00 0.00 ? ? ? ? ? . 53 ILE A HG23 223 ATOM 782 H HD11 . ILE A 223 53 . -3.749 -4.794 -11.848 1.00 0.00 ? ? ? ? ? . 53 ILE A HD11 223 ATOM 783 H HD12 . ILE A 223 53 . -5.193 -4.465 -10.890 1.00 0.00 ? ? ? ? ? . 53 ILE A HD12 223 ATOM 784 H HD13 . ILE A 223 53 . -5.301 -5.480 -12.328 1.00 0.00 ? ? ? ? ? . 53 ILE A HD13 223 ATOM 785 N N . GLU A 223 54 . -1.600 -7.024 -6.753 1.00 0.00 ? ? ? ? ? . 54 GLU A N 223 ATOM 786 C CA . GLU A 223 54 . -1.254 -6.729 -5.334 1.00 0.00 ? ? ? ? ? . 54 GLU A CA 223 ATOM 787 C C . GLU A 223 54 . -0.692 -5.310 -5.227 1.00 0.00 ? ? ? ? ? . 54 GLU A C 223 ATOM 788 O O . GLU A 223 54 . -0.966 -4.594 -4.285 1.00 0.00 ? ? ? ? ? . 54 GLU A O 223 ATOM 789 C CB . GLU A 223 54 . -0.204 -7.730 -4.849 1.00 0.00 ? ? ? ? ? . 54 GLU A CB 223 ATOM 790 C CG . GLU A 223 54 . 0.666 -8.170 -6.030 1.00 0.00 ? ? ? ? ? . 54 GLU A CG 223 ATOM 791 C CD . GLU A 223 54 . 1.877 -8.946 -5.513 1.00 0.00 ? ? ? ? ? . 54 GLU A CD 223 ATOM 792 O OE1 . GLU A 223 54 . 1.925 -9.205 -4.322 1.00 0.00 ? ? ? ? ? . 54 GLU A OE1 223 ATOM 793 O OE2 . GLU A 223 54 . 2.736 -9.269 -6.317 1.00 0.00 ? ? ? ? ? . 54 GLU A OE2 223 ATOM 794 H H . GLU A 223 54 . -0.904 -7.322 -7.375 1.00 0.00 ? ? ? ? ? . 54 GLU A H 223 ATOM 795 H HA . GLU A 223 54 . -2.140 -6.813 -4.722 1.00 0.00 ? ? ? ? ? . 54 GLU A HA 223 ATOM 796 H HB2 . GLU A 223 54 . 0.417 -7.265 -4.097 1.00 0.00 ? ? ? ? ? . 54 GLU A HB2 223 ATOM 797 H HB3 . GLU A 223 54 . -0.696 -8.593 -4.427 1.00 0.00 ? ? ? ? ? . 54 GLU A HB3 223 ATOM 798 H HG2 . GLU A 223 54 . 0.085 -8.801 -6.687 1.00 0.00 ? ? ? ? ? . 54 GLU A HG2 223 ATOM 799 H HG3 . GLU A 223 54 . 1.004 -7.299 -6.572 1.00 0.00 ? ? ? ? ? . 54 GLU A HG3 223 ATOM 800 N N . ASP A 223 55 . 0.096 -4.899 -6.184 1.00 0.00 ? ? ? ? ? . 55 ASP A N 223 ATOM 801 C CA . ASP A 223 55 . 0.675 -3.528 -6.131 1.00 0.00 ? ? ? ? ? . 55 ASP A CA 223 ATOM 802 C C . ASP A 223 55 . 0.321 -2.767 -7.409 1.00 0.00 ? ? ? ? ? . 55 ASP A C 223 ATOM 803 O O . ASP A 223 55 . 0.143 -3.348 -8.462 1.00 0.00 ? ? ? ? ? . 55 ASP A O 223 ATOM 804 C CB . ASP A 223 55 . 2.197 -3.625 -6.002 1.00 0.00 ? ? ? ? ? . 55 ASP A CB 223 ATOM 805 C CG . ASP A 223 55 . 2.557 -4.232 -4.646 1.00 0.00 ? ? ? ? ? . 55 ASP A CG 223 ATOM 806 O OD1 . ASP A 223 55 . 2.231 -3.624 -3.639 1.00 0.00 ? ? ? ? ? . 55 ASP A OD1 223 ATOM 807 O OD2 . ASP A 223 55 . 3.155 -5.297 -4.635 1.00 0.00 ? ? ? ? ? . 55 ASP A OD2 223 ATOM 808 H H . ASP A 223 55 . 0.307 -5.492 -6.933 1.00 0.00 ? ? ? ? ? . 55 ASP A H 223 ATOM 809 H HA . ASP A 223 55 . 0.276 -3.002 -5.277 1.00 0.00 ? ? ? ? ? . 55 ASP A HA 223 ATOM 810 H HB2 . ASP A 223 55 . 2.585 -4.251 -6.793 1.00 0.00 ? ? ? ? ? . 55 ASP A HB2 223 ATOM 811 H HB3 . ASP A 223 55 . 2.628 -2.638 -6.078 1.00 0.00 ? ? ? ? ? . 55 ASP A HB3 223 ATOM 812 N N . ALA A 223 56 . 0.222 -1.469 -7.325 1.00 0.00 ? ? ? ? ? . 56 ALA A N 223 ATOM 813 C CA . ALA A 223 56 . -0.114 -0.662 -8.532 1.00 0.00 ? ? ? ? ? . 56 ALA A CA 223 ATOM 814 C C . ALA A 223 56 . 0.600 0.688 -8.446 1.00 0.00 ? ? ? ? ? . 56 ALA A C 223 ATOM 815 O O . ALA A 223 56 . 0.158 1.593 -7.765 1.00 0.00 ? ? ? ? ? . 56 ALA A O 223 ATOM 816 C CB . ALA A 223 56 . -1.627 -0.438 -8.594 1.00 0.00 ? ? ? ? ? . 56 ALA A CB 223 ATOM 817 H H . ALA A 223 56 . 0.374 -1.023 -6.466 1.00 0.00 ? ? ? ? ? . 56 ALA A H 223 ATOM 818 H HA . ALA A 223 56 . 0.210 -1.186 -9.418 1.00 0.00 ? ? ? ? ? . 56 ALA A HA 223 ATOM 819 H HB1 . ALA A 223 56 . -2.125 -1.385 -8.747 1.00 0.00 ? ? ? ? ? . 56 ALA A HB1 223 ATOM 820 H HB2 . ALA A 223 56 . -1.859 0.227 -9.411 1.00 0.00 ? ? ? ? ? . 56 ALA A HB2 223 ATOM 821 H HB3 . ALA A 223 56 . -1.964 0.000 -7.666 1.00 0.00 ? ? ? ? ? . 56 ALA A HB3 223 ATOM 822 N N . LYS A 223 57 . 1.704 0.830 -9.126 1.00 0.00 ? ? ? ? ? . 57 LYS A N 223 ATOM 823 C CA . LYS A 223 57 . 2.449 2.119 -9.077 1.00 0.00 ? ? ? ? ? . 57 LYS A CA 223 ATOM 824 C C . LYS A 223 57 . 2.028 3.001 -10.253 1.00 0.00 ? ? ? ? ? . 57 LYS A C 223 ATOM 825 O O . LYS A 223 57 . 1.266 2.595 -11.107 1.00 0.00 ? ? ? ? ? . 57 LYS A O 223 ATOM 826 C CB . LYS A 223 57 . 3.952 1.842 -9.162 1.00 0.00 ? ? ? ? ? . 57 LYS A CB 223 ATOM 827 C CG . LYS A 223 57 . 4.206 0.341 -8.999 1.00 0.00 ? ? ? ? ? . 57 LYS A CG 223 ATOM 828 C CD . LYS A 223 57 . 5.699 0.099 -8.770 1.00 0.00 ? ? ? ? ? . 57 LYS A CD 223 ATOM 829 C CE . LYS A 223 57 . 5.983 -1.404 -8.805 1.00 0.00 ? ? ? ? ? . 57 LYS A CE 223 ATOM 830 N NZ . LYS A 223 57 . 7.347 -1.665 -8.266 1.00 0.00 ? ? ? ? ? . 57 LYS A NZ 223 ATOM 831 H H . LYS A 223 57 . 2.046 0.086 -9.666 1.00 0.00 ? ? ? ? ? . 57 LYS A H 223 ATOM 832 H HA . LYS A 223 57 . 2.230 2.626 -8.149 1.00 0.00 ? ? ? ? ? . 57 LYS A HA 223 ATOM 833 H HB2 . LYS A 223 57 . 4.325 2.168 -10.122 1.00 0.00 ? ? ? ? ? . 57 LYS A HB2 223 ATOM 834 H HB3 . LYS A 223 57 . 4.462 2.378 -8.376 1.00 0.00 ? ? ? ? ? . 57 LYS A HB3 223 ATOM 835 H HG2 . LYS A 223 57 . 3.645 -0.028 -8.153 1.00 0.00 ? ? ? ? ? . 57 LYS A HG2 223 ATOM 836 H HG3 . LYS A 223 57 . 3.892 -0.176 -9.893 1.00 0.00 ? ? ? ? ? . 57 LYS A HG3 223 ATOM 837 H HD2 . LYS A 223 57 . 6.267 0.592 -9.545 1.00 0.00 ? ? ? ? ? . 57 LYS A HD2 223 ATOM 838 H HD3 . LYS A 223 57 . 5.984 0.494 -7.806 1.00 0.00 ? ? ? ? ? . 57 LYS A HD3 223 ATOM 839 H HE2 . LYS A 223 57 . 5.252 -1.922 -8.202 1.00 0.00 ? ? ? ? ? . 57 LYS A HE2 223 ATOM 840 H HE3 . LYS A 223 57 . 5.925 -1.758 -9.824 1.00 0.00 ? ? ? ? ? . 57 LYS A HE3 223 ATOM 841 H HZ1 . LYS A 223 57 . 7.797 -0.764 -8.008 1.00 0.00 ? ? ? ? ? . 57 LYS A HZ1 223 ATOM 842 H HZ2 . LYS A 223 57 . 7.920 -2.145 -8.990 1.00 0.00 ? ? ? ? ? . 57 LYS A HZ2 223 ATOM 843 H HZ3 . LYS A 223 57 . 7.278 -2.268 -7.422 1.00 0.00 ? ? ? ? ? . 57 LYS A HZ3 223 ATOM 844 N N . PHE A 223 58 . 2.520 4.209 -10.302 1.00 0.00 ? ? ? ? ? . 58 PHE A N 223 ATOM 845 C CA . PHE A 223 58 . 2.152 5.122 -11.420 1.00 0.00 ? ? ? ? ? . 58 PHE A CA 223 ATOM 846 C C . PHE A 223 58 . 3.123 6.304 -11.454 1.00 0.00 ? ? ? ? ? . 58 PHE A C 223 ATOM 847 O O . PHE A 223 58 . 3.995 6.428 -10.616 1.00 0.00 ? ? ? ? ? . 58 PHE A O 223 ATOM 848 C CB . PHE A 223 58 . 0.728 5.637 -11.207 1.00 0.00 ? ? ? ? ? . 58 PHE A CB 223 ATOM 849 C CG . PHE A 223 58 . 0.678 6.476 -9.953 1.00 0.00 ? ? ? ? ? . 58 PHE A CG 223 ATOM 850 C CD1 . PHE A 223 58 . 0.535 5.858 -8.705 1.00 0.00 ? ? ? ? ? . 58 PHE A CD1 223 ATOM 851 C CD2 . PHE A 223 58 . 0.775 7.871 -10.037 1.00 0.00 ? ? ? ? ? . 58 PHE A CD2 223 ATOM 852 C CE1 . PHE A 223 58 . 0.487 6.634 -7.540 1.00 0.00 ? ? ? ? ? . 58 PHE A CE1 223 ATOM 853 C CE2 . PHE A 223 58 . 0.727 8.646 -8.872 1.00 0.00 ? ? ? ? ? . 58 PHE A CE2 223 ATOM 854 C CZ . PHE A 223 58 . 0.584 8.028 -7.624 1.00 0.00 ? ? ? ? ? . 58 PHE A CZ 223 ATOM 855 H H . PHE A 223 58 . 3.134 4.517 -9.602 1.00 0.00 ? ? ? ? ? . 58 PHE A H 223 ATOM 856 H HA . PHE A 223 58 . 2.205 4.584 -12.356 1.00 0.00 ? ? ? ? ? . 58 PHE A HA 223 ATOM 857 H HB2 . PHE A 223 58 . 0.433 6.240 -12.055 1.00 0.00 ? ? ? ? ? . 58 PHE A HB2 223 ATOM 858 H HB3 . PHE A 223 58 . 0.053 4.801 -11.108 1.00 0.00 ? ? ? ? ? . 58 PHE A HB3 223 ATOM 859 H HD1 . PHE A 223 58 . 0.459 4.783 -8.640 1.00 0.00 ? ? ? ? ? . 58 PHE A HD1 223 ATOM 860 H HD2 . PHE A 223 58 . 0.887 8.347 -10.998 1.00 0.00 ? ? ? ? ? . 58 PHE A HD2 223 ATOM 861 H HE1 . PHE A 223 58 . 0.376 6.157 -6.578 1.00 0.00 ? ? ? ? ? . 58 PHE A HE1 223 ATOM 862 H HE2 . PHE A 223 58 . 0.803 9.722 -8.936 1.00 0.00 ? ? ? ? ? . 58 PHE A HE2 223 ATOM 863 H HZ . PHE A 223 58 . 0.547 8.627 -6.726 1.00 0.00 ? ? ? ? ? . 58 PHE A HZ 223 ATOM 864 N N . LYS A 223 59 . 2.981 7.174 -12.417 1.00 0.00 ? ? ? ? ? . 59 LYS A N 223 ATOM 865 C CA . LYS A 223 59 . 3.896 8.347 -12.501 1.00 0.00 ? ? ? ? ? . 59 LYS A CA 223 ATOM 866 C C . LYS A 223 59 . 3.321 9.370 -13.483 1.00 0.00 ? ? ? ? ? . 59 LYS A C 223 ATOM 867 O O . LYS A 223 59 . 3.287 9.148 -14.678 1.00 0.00 ? ? ? ? ? . 59 LYS A O 223 ATOM 868 C CB . LYS A 223 59 . 5.272 7.885 -12.990 1.00 0.00 ? ? ? ? ? . 59 LYS A CB 223 ATOM 869 C CG . LYS A 223 59 . 6.318 8.150 -11.904 1.00 0.00 ? ? ? ? ? . 59 LYS A CG 223 ATOM 870 C CD . LYS A 223 59 . 7.717 7.888 -12.467 1.00 0.00 ? ? ? ? ? . 59 LYS A CD 223 ATOM 871 C CE . LYS A 223 59 . 8.736 7.895 -11.326 1.00 0.00 ? ? ? ? ? . 59 LYS A CE 223 ATOM 872 N NZ . LYS A 223 59 . 9.846 6.954 -11.645 1.00 0.00 ? ? ? ? ? . 59 LYS A NZ 223 ATOM 873 H H . LYS A 223 59 . 2.272 7.056 -13.082 1.00 0.00 ? ? ? ? ? . 59 LYS A H 223 ATOM 874 H HA . LYS A 223 59 . 3.993 8.800 -11.526 1.00 0.00 ? ? ? ? ? . 59 LYS A HA 223 ATOM 875 H HB2 . LYS A 223 59 . 5.240 6.828 -13.208 1.00 0.00 ? ? ? ? ? . 59 LYS A HB2 223 ATOM 876 H HB3 . LYS A 223 59 . 5.540 8.429 -13.883 1.00 0.00 ? ? ? ? ? . 59 LYS A HB3 223 ATOM 877 H HG2 . LYS A 223 59 . 6.247 9.178 -11.579 1.00 0.00 ? ? ? ? ? . 59 LYS A HG2 223 ATOM 878 H HG3 . LYS A 223 59 . 6.141 7.493 -11.065 1.00 0.00 ? ? ? ? ? . 59 LYS A HG3 223 ATOM 879 H HD2 . LYS A 223 59 . 7.732 6.926 -12.958 1.00 0.00 ? ? ? ? ? . 59 LYS A HD2 223 ATOM 880 H HD3 . LYS A 223 59 . 7.969 8.660 -13.177 1.00 0.00 ? ? ? ? ? . 59 LYS A HD3 223 ATOM 881 H HE2 . LYS A 223 59 . 9.132 8.892 -11.203 1.00 0.00 ? ? ? ? ? . 59 LYS A HE2 223 ATOM 882 H HE3 . LYS A 223 59 . 8.253 7.583 -10.410 1.00 0.00 ? ? ? ? ? . 59 LYS A HE3 223 ATOM 883 H HZ1 . LYS A 223 59 . 9.924 6.242 -10.894 1.00 0.00 ? ? ? ? ? . 59 LYS A HZ1 223 ATOM 884 H HZ2 . LYS A 223 59 . 10.739 7.485 -11.716 1.00 0.00 ? ? ? ? ? . 59 LYS A HZ2 223 ATOM 885 H HZ3 . LYS A 223 59 . 9.651 6.481 -12.550 1.00 0.00 ? ? ? ? ? . 59 LYS A HZ3 223 ATOM 886 N N . THR A 223 60 . 2.870 10.492 -12.991 1.00 0.00 ? ? ? ? ? . 60 THR A N 223 ATOM 887 C CA . THR A 223 60 . 2.298 11.526 -13.897 1.00 0.00 ? ? ? ? ? . 60 THR A CA 223 ATOM 888 C C . THR A 223 60 . 2.955 12.878 -13.608 1.00 0.00 ? ? ? ? ? . 60 THR A C 223 ATOM 889 O O . THR A 223 60 . 2.559 13.591 -12.708 1.00 0.00 ? ? ? ? ? . 60 THR A O 223 ATOM 890 C CB . THR A 223 60 . 0.789 11.633 -13.662 1.00 0.00 ? ? ? ? ? . 60 THR A CB 223 ATOM 891 O OG1 . THR A 223 60 . 0.529 11.641 -12.265 1.00 0.00 ? ? ? ? ? . 60 THR A OG1 223 ATOM 892 C CG2 . THR A 223 60 . 0.085 10.440 -14.308 1.00 0.00 ? ? ? ? ? . 60 THR A CG2 223 ATOM 893 H H . THR A 223 60 . 2.907 10.652 -12.025 1.00 0.00 ? ? ? ? ? . 60 THR A H 223 ATOM 894 H HA . THR A 223 60 . 2.483 11.248 -14.924 1.00 0.00 ? ? ? ? ? . 60 THR A HA 223 ATOM 895 H HB . THR A 223 60 . 0.419 12.546 -14.103 1.00 0.00 ? ? ? ? ? . 60 THR A HB 223 ATOM 896 H HG1 . THR A 223 60 . 0.659 10.749 -11.934 1.00 0.00 ? ? ? ? ? . 60 THR A HG1 223 ATOM 897 H HG21 . THR A 223 60 . -0.390 10.755 -15.225 1.00 0.00 ? ? ? ? ? . 60 THR A HG21 223 ATOM 898 H HG22 . THR A 223 60 . -0.662 10.053 -13.631 1.00 0.00 ? ? ? ? ? . 60 THR A HG22 223 ATOM 899 H HG23 . THR A 223 60 . 0.808 9.667 -14.524 1.00 0.00 ? ? ? ? ? . 60 THR A HG23 223 ATOM 900 N N . TYR A 223 61 . 3.954 13.237 -14.367 1.00 0.00 ? ? ? ? ? . 61 TYR A N 223 ATOM 901 C CA . TYR A 223 61 . 4.632 14.544 -14.135 1.00 0.00 ? ? ? ? ? . 61 TYR A CA 223 ATOM 902 C C . TYR A 223 61 . 4.413 15.455 -15.343 1.00 0.00 ? ? ? ? ? . 61 TYR A C 223 ATOM 903 O O . TYR A 223 61 . 5.024 15.287 -16.380 1.00 0.00 ? ? ? ? ? . 61 TYR A O 223 ATOM 904 C CB . TYR A 223 61 . 6.130 14.313 -13.934 1.00 0.00 ? ? ? ? ? . 61 TYR A CB 223 ATOM 905 C CG . TYR A 223 61 . 6.448 14.350 -12.458 1.00 0.00 ? ? ? ? ? . 61 TYR A CG 223 ATOM 906 C CD1 . TYR A 223 61 . 6.289 15.541 -11.737 1.00 0.00 ? ? ? ? ? . 61 TYR A CD1 223 ATOM 907 C CD2 . TYR A 223 61 . 6.900 13.196 -11.810 1.00 0.00 ? ? ? ? ? . 61 TYR A CD2 223 ATOM 908 C CE1 . TYR A 223 61 . 6.582 15.575 -10.369 1.00 0.00 ? ? ? ? ? . 61 TYR A CE1 223 ATOM 909 C CE2 . TYR A 223 61 . 7.194 13.230 -10.442 1.00 0.00 ? ? ? ? ? . 61 TYR A CE2 223 ATOM 910 C CZ . TYR A 223 61 . 7.034 14.419 -9.721 1.00 0.00 ? ? ? ? ? . 61 TYR A CZ 223 ATOM 911 O OH . TYR A 223 61 . 7.322 14.452 -8.373 1.00 0.00 ? ? ? ? ? . 61 TYR A OH 223 ATOM 912 H H . TYR A 223 61 . 4.257 12.649 -15.090 1.00 0.00 ? ? ? ? ? . 61 TYR A H 223 ATOM 913 H HA . TYR A 223 61 . 4.219 15.011 -13.254 1.00 0.00 ? ? ? ? ? . 61 TYR A HA 223 ATOM 914 H HB2 . TYR A 223 61 . 6.404 13.349 -14.338 1.00 0.00 ? ? ? ? ? . 61 TYR A HB2 223 ATOM 915 H HB3 . TYR A 223 61 . 6.686 15.089 -14.439 1.00 0.00 ? ? ? ? ? . 61 TYR A HB3 223 ATOM 916 H HD1 . TYR A 223 61 . 5.938 16.432 -12.237 1.00 0.00 ? ? ? ? ? . 61 TYR A HD1 223 ATOM 917 H HD2 . TYR A 223 61 . 7.024 12.277 -12.366 1.00 0.00 ? ? ? ? ? . 61 TYR A HD2 223 ATOM 918 H HE1 . TYR A 223 61 . 6.458 16.492 -9.814 1.00 0.00 ? ? ? ? ? . 61 TYR A HE1 223 ATOM 919 H HE2 . TYR A 223 61 . 7.542 12.338 -9.942 1.00 0.00 ? ? ? ? ? . 61 TYR A HE2 223 ATOM 920 H HH . TYR A 223 61 . 6.579 14.072 -7.901 1.00 0.00 ? ? ? ? ? . 61 TYR A HH 223 ATOM 921 N N . GLY A 223 62 . 3.543 16.418 -15.217 1.00 0.00 ? ? ? ? ? . 62 GLY A N 223 ATOM 922 C CA . GLY A 223 62 . 3.278 17.342 -16.355 1.00 0.00 ? ? ? ? ? . 62 GLY A CA 223 ATOM 923 C C . GLY A 223 62 . 1.993 18.123 -16.080 1.00 0.00 ? ? ? ? ? . 62 GLY A C 223 ATOM 924 O O . GLY A 223 62 . 1.908 19.309 -16.327 1.00 0.00 ? ? ? ? ? . 62 GLY A O 223 ATOM 925 H H . GLY A 223 62 . 3.061 16.534 -14.372 1.00 0.00 ? ? ? ? ? . 62 GLY A H 223 ATOM 926 H HA2 . GLY A 223 62 . 4.105 18.031 -16.462 1.00 0.00 ? ? ? ? ? . 62 GLY A HA2 223 ATOM 927 H HA3 . GLY A 223 62 . 3.162 16.773 -17.265 1.00 0.00 ? ? ? ? ? . 62 GLY A HA3 223 ATOM 928 N N . CYS A 223 63 . 0.993 17.464 -15.562 1.00 0.00 ? ? ? ? ? . 63 CYS A N 223 ATOM 929 C CA . CYS A 223 63 . -0.288 18.165 -15.264 1.00 0.00 ? ? ? ? ? . 63 CYS A CA 223 ATOM 930 C C . CYS A 223 63 . -0.423 18.346 -13.750 1.00 0.00 ? ? ? ? ? . 63 CYS A C 223 ATOM 931 O O . CYS A 223 63 . -0.697 17.410 -13.026 1.00 0.00 ? ? ? ? ? . 63 CYS A O 223 ATOM 932 C CB . CYS A 223 63 . -1.459 17.331 -15.785 1.00 0.00 ? ? ? ? ? . 63 CYS A CB 223 ATOM 933 S SG . CYS A 223 63 . -2.975 17.811 -14.920 1.00 0.00 ? ? ? ? ? . 63 CYS A SG 223 ATOM 934 H H . CYS A 223 63 . 1.085 16.509 -15.366 1.00 0.00 ? ? ? ? ? . 63 CYS A H 223 ATOM 935 H HA . CYS A 223 63 . -0.290 19.132 -15.743 1.00 0.00 ? ? ? ? ? . 63 CYS A HA 223 ATOM 936 H HB2 . CYS A 223 63 . -1.580 17.503 -16.845 1.00 0.00 ? ? ? ? ? . 63 CYS A HB2 223 ATOM 937 H HB3 . CYS A 223 63 . -1.261 16.284 -15.612 1.00 0.00 ? ? ? ? ? . 63 CYS A HB3 223 ATOM 938 H HG . CYS A 223 63 . -2.894 17.533 -14.005 1.00 0.00 ? ? ? ? ? . 63 CYS A HG 223 ATOM 939 N N . GLY A 223 64 . -0.229 19.542 -13.267 1.00 0.00 ? ? ? ? ? . 64 GLY A N 223 ATOM 940 C CA . GLY A 223 64 . -0.344 19.781 -11.801 1.00 0.00 ? ? ? ? ? . 64 GLY A CA 223 ATOM 941 C C . GLY A 223 64 . -1.795 19.588 -11.359 1.00 0.00 ? ? ? ? ? . 64 GLY A C 223 ATOM 942 O O . GLY A 223 64 . -2.502 20.537 -11.086 1.00 0.00 ? ? ? ? ? . 64 GLY A O 223 ATOM 943 H H . GLY A 223 64 . -0.007 20.283 -13.868 1.00 0.00 ? ? ? ? ? . 64 GLY A H 223 ATOM 944 H HA2 . GLY A 223 64 . 0.291 19.084 -11.272 1.00 0.00 ? ? ? ? ? . 64 GLY A HA2 223 ATOM 945 H HA3 . GLY A 223 64 . -0.035 20.790 -11.575 1.00 0.00 ? ? ? ? ? . 64 GLY A HA3 223 ATOM 946 N N . SER A 223 65 . -2.246 18.365 -11.285 1.00 0.00 ? ? ? ? ? . 65 SER A N 223 ATOM 947 C CA . SER A 223 65 . -3.653 18.116 -10.859 1.00 0.00 ? ? ? ? ? . 65 SER A CA 223 ATOM 948 C C . SER A 223 65 . -4.067 16.697 -11.256 1.00 0.00 ? ? ? ? ? . 65 SER A C 223 ATOM 949 O O . SER A 223 65 . -4.700 15.990 -10.497 1.00 0.00 ? ? ? ? ? . 65 SER A O 223 ATOM 950 C CB . SER A 223 65 . -4.577 19.126 -11.541 1.00 0.00 ? ? ? ? ? . 65 SER A CB 223 ATOM 951 O OG . SER A 223 65 . -4.046 19.462 -12.816 1.00 0.00 ? ? ? ? ? . 65 SER A OG 223 ATOM 952 H H . SER A 223 65 . -1.661 17.611 -11.509 1.00 0.00 ? ? ? ? ? . 65 SER A H 223 ATOM 953 H HA . SER A 223 65 . -3.729 18.225 -9.788 1.00 0.00 ? ? ? ? ? . 65 SER A HA 223 ATOM 954 H HB2 . SER A 223 65 . -5.556 18.693 -11.666 1.00 0.00 ? ? ? ? ? . 65 SER A HB2 223 ATOM 955 H HB3 . SER A 223 65 . -4.654 20.012 -10.926 1.00 0.00 ? ? ? ? ? . 65 SER A HB3 223 ATOM 956 H HG . SER A 223 65 . -4.437 18.871 -13.464 1.00 0.00 ? ? ? ? ? . 65 SER A HG 223 ATOM 957 N N . ALA A 223 66 . -3.718 16.276 -12.441 1.00 0.00 ? ? ? ? ? . 66 ALA A N 223 ATOM 958 C CA . ALA A 223 66 . -4.095 14.905 -12.887 1.00 0.00 ? ? ? ? ? . 66 ALA A CA 223 ATOM 959 C C . ALA A 223 66 . -3.563 13.873 -11.889 1.00 0.00 ? ? ? ? ? . 66 ALA A C 223 ATOM 960 O O . ALA A 223 66 . -3.734 12.683 -12.063 1.00 0.00 ? ? ? ? ? . 66 ALA A O 223 ATOM 961 C CB . ALA A 223 66 . -3.493 14.635 -14.268 1.00 0.00 ? ? ? ? ? . 66 ALA A CB 223 ATOM 962 H H . ALA A 223 66 . -3.209 16.863 -13.039 1.00 0.00 ? ? ? ? ? . 66 ALA A H 223 ATOM 963 H HA . ALA A 223 66 . -5.170 14.828 -12.944 1.00 0.00 ? ? ? ? ? . 66 ALA A HA 223 ATOM 964 H HB1 . ALA A 223 66 . -3.853 13.685 -14.637 1.00 0.00 ? ? ? ? ? . 66 ALA A HB1 223 ATOM 965 H HB2 . ALA A 223 66 . -2.416 14.608 -14.192 1.00 0.00 ? ? ? ? ? . 66 ALA A HB2 223 ATOM 966 H HB3 . ALA A 223 66 . -3.786 15.421 -14.948 1.00 0.00 ? ? ? ? ? . 66 ALA A HB3 223 ATOM 967 N N . ILE A 223 67 . -2.920 14.318 -10.844 1.00 0.00 ? ? ? ? ? . 67 ILE A N 223 ATOM 968 C CA . ILE A 223 67 . -2.382 13.359 -9.839 1.00 0.00 ? ? ? ? ? . 67 ILE A CA 223 ATOM 969 C C . ILE A 223 67 . -3.539 12.785 -9.016 1.00 0.00 ? ? ? ? ? . 67 ILE A C 223 ATOM 970 O O . ILE A 223 67 . -3.708 11.585 -8.918 1.00 0.00 ? ? ? ? ? . 67 ILE A O 223 ATOM 971 C CB . ILE A 223 67 . -1.398 14.090 -8.916 1.00 0.00 ? ? ? ? ? . 67 ILE A CB 223 ATOM 972 C CG1 . ILE A 223 67 . 0.020 13.958 -9.480 1.00 0.00 ? ? ? ? ? . 67 ILE A CG1 223 ATOM 973 C CG2 . ILE A 223 67 . -1.444 13.475 -7.515 1.00 0.00 ? ? ? ? ? . 67 ILE A CG2 223 ATOM 974 C CD1 . ILE A 223 67 . 0.057 14.503 -10.909 1.00 0.00 ? ? ? ? ? . 67 ILE A CD1 223 ATOM 975 H H . ILE A 223 67 . -2.793 15.282 -10.720 1.00 0.00 ? ? ? ? ? . 67 ILE A H 223 ATOM 976 H HA . ILE A 223 67 . -1.870 12.556 -10.348 1.00 0.00 ? ? ? ? ? . 67 ILE A HA 223 ATOM 977 H HB . ILE A 223 67 . -1.667 15.135 -8.860 1.00 0.00 ? ? ? ? ? . 67 ILE A HB 223 ATOM 978 H HG12 . ILE A 223 67 . 0.706 14.520 -8.862 1.00 0.00 ? ? ? ? ? . 67 ILE A HG12 223 ATOM 979 H HG13 . ILE A 223 67 . 0.310 12.918 -9.485 1.00 0.00 ? ? ? ? ? . 67 ILE A HG13 223 ATOM 980 H HG21 . ILE A 223 67 . -2.290 13.873 -6.976 1.00 0.00 ? ? ? ? ? . 67 ILE A HG21 223 ATOM 981 H HG22 . ILE A 223 67 . -0.533 13.717 -6.987 1.00 0.00 ? ? ? ? ? . 67 ILE A HG22 223 ATOM 982 H HG23 . ILE A 223 67 . -1.538 12.403 -7.595 1.00 0.00 ? ? ? ? ? . 67 ILE A HG23 223 ATOM 983 H HD11 . ILE A 223 67 . -0.038 13.685 -11.608 1.00 0.00 ? ? ? ? ? . 67 ILE A HD11 223 ATOM 984 H HD12 . ILE A 223 67 . 0.995 15.012 -11.076 1.00 0.00 ? ? ? ? ? . 67 ILE A HD12 223 ATOM 985 H HD13 . ILE A 223 67 . -0.759 15.196 -11.052 1.00 0.00 ? ? ? ? ? . 67 ILE A HD13 223 ATOM 986 N N . ALA A 223 68 . -4.336 13.631 -8.425 1.00 0.00 ? ? ? ? ? . 68 ALA A N 223 ATOM 987 C CA . ALA A 223 68 . -5.481 13.135 -7.609 1.00 0.00 ? ? ? ? ? . 68 ALA A CA 223 ATOM 988 C C . ALA A 223 68 . -6.059 11.871 -8.249 1.00 0.00 ? ? ? ? ? . 68 ALA A C 223 ATOM 989 O O . ALA A 223 68 . -5.912 10.780 -7.736 1.00 0.00 ? ? ? ? ? . 68 ALA A O 223 ATOM 990 C CB . ALA A 223 68 . -6.564 14.214 -7.545 1.00 0.00 ? ? ? ? ? . 68 ALA A CB 223 ATOM 991 H H . ALA A 223 68 . -4.182 14.595 -8.517 1.00 0.00 ? ? ? ? ? . 68 ALA A H 223 ATOM 992 H HA . ALA A 223 68 . -5.139 12.909 -6.610 1.00 0.00 ? ? ? ? ? . 68 ALA A HA 223 ATOM 993 H HB1 . ALA A 223 68 . -6.639 14.706 -8.504 1.00 0.00 ? ? ? ? ? . 68 ALA A HB1 223 ATOM 994 H HB2 . ALA A 223 68 . -6.305 14.939 -6.788 1.00 0.00 ? ? ? ? ? . 68 ALA A HB2 223 ATOM 995 H HB3 . ALA A 223 68 . -7.512 13.760 -7.298 1.00 0.00 ? ? ? ? ? . 68 ALA A HB3 223 ATOM 996 N N . SER A 223 69 . -6.717 12.011 -9.367 1.00 0.00 ? ? ? ? ? . 69 SER A N 223 ATOM 997 C CA . SER A 223 69 . -7.307 10.818 -10.040 1.00 0.00 ? ? ? ? ? . 69 SER A CA 223 ATOM 998 C C . SER A 223 69 . -6.279 9.685 -10.071 1.00 0.00 ? ? ? ? ? . 69 SER A C 223 ATOM 999 O O . SER A 223 69 . -6.597 8.539 -9.819 1.00 0.00 ? ? ? ? ? . 69 SER A O 223 ATOM 1000 C CB . SER A 223 69 . -7.703 11.185 -11.470 1.00 0.00 ? ? ? ? ? . 69 SER A CB 223 ATOM 1001 O OG . SER A 223 69 . -8.592 10.200 -11.979 1.00 0.00 ? ? ? ? ? . 69 SER A OG 223 ATOM 1002 H H . SER A 223 69 . -6.827 12.900 -9.763 1.00 0.00 ? ? ? ? ? . 69 SER A H 223 ATOM 1003 H HA . SER A 223 69 . -8.182 10.495 -9.496 1.00 0.00 ? ? ? ? ? . 69 SER A HA 223 ATOM 1004 H HB2 . SER A 223 69 . -8.196 12.144 -11.475 1.00 0.00 ? ? ? ? ? . 69 SER A HB2 223 ATOM 1005 H HB3 . SER A 223 69 . -6.815 11.236 -12.087 1.00 0.00 ? ? ? ? ? . 69 SER A HB3 223 ATOM 1006 H HG . SER A 223 69 . -9.311 10.652 -12.425 1.00 0.00 ? ? ? ? ? . 69 SER A HG 223 ATOM 1007 N N . SER A 223 70 . -5.049 9.993 -10.380 1.00 0.00 ? ? ? ? ? . 70 SER A N 223 ATOM 1008 C CA . SER A 223 70 . -4.005 8.931 -10.431 1.00 0.00 ? ? ? ? ? . 70 SER A CA 223 ATOM 1009 C C . SER A 223 70 . -4.036 8.116 -9.135 1.00 0.00 ? ? ? ? ? . 70 SER A C 223 ATOM 1010 O O . SER A 223 70 . -3.826 6.920 -9.139 1.00 0.00 ? ? ? ? ? . 70 SER A O 223 ATOM 1011 C CB . SER A 223 70 . -2.628 9.577 -10.592 1.00 0.00 ? ? ? ? ? . 70 SER A CB 223 ATOM 1012 O OG . SER A 223 70 . -1.782 8.702 -11.324 1.00 0.00 ? ? ? ? ? . 70 SER A OG 223 ATOM 1013 H H . SER A 223 70 . -4.813 10.922 -10.584 1.00 0.00 ? ? ? ? ? . 70 SER A H 223 ATOM 1014 H HA . SER A 223 70 . -4.195 8.279 -11.270 1.00 0.00 ? ? ? ? ? . 70 SER A HA 223 ATOM 1015 H HB2 . SER A 223 70 . -2.726 10.507 -11.127 1.00 0.00 ? ? ? ? ? . 70 SER A HB2 223 ATOM 1016 H HB3 . SER A 223 70 . -2.206 9.770 -9.614 1.00 0.00 ? ? ? ? ? . 70 SER A HB3 223 ATOM 1017 H HG . SER A 223 70 . -1.711 7.878 -10.835 1.00 0.00 ? ? ? ? ? . 70 SER A HG 223 ATOM 1018 N N . SER A 223 71 . -4.296 8.753 -8.026 1.00 0.00 ? ? ? ? ? . 71 SER A N 223 ATOM 1019 C CA . SER A 223 71 . -4.338 8.012 -6.734 1.00 0.00 ? ? ? ? ? . 71 SER A CA 223 ATOM 1020 C C . SER A 223 71 . -5.650 7.230 -6.634 1.00 0.00 ? ? ? ? ? . 71 SER A C 223 ATOM 1021 O O . SER A 223 71 . -5.712 6.178 -6.030 1.00 0.00 ? ? ? ? ? . 71 SER A O 223 ATOM 1022 C CB . SER A 223 71 . -4.244 9.003 -5.574 1.00 0.00 ? ? ? ? ? . 71 SER A CB 223 ATOM 1023 O OG . SER A 223 71 . -5.541 9.211 -5.029 1.00 0.00 ? ? ? ? ? . 71 SER A OG 223 ATOM 1024 H H . SER A 223 71 . -4.462 9.719 -8.043 1.00 0.00 ? ? ? ? ? . 71 SER A H 223 ATOM 1025 H HA . SER A 223 71 . -3.506 7.324 -6.687 1.00 0.00 ? ? ? ? ? . 71 SER A HA 223 ATOM 1026 H HB2 . SER A 223 71 . -3.598 8.606 -4.810 1.00 0.00 ? ? ? ? ? . 71 SER A HB2 223 ATOM 1027 H HB3 . SER A 223 71 . -3.840 9.940 -5.935 1.00 0.00 ? ? ? ? ? . 71 SER A HB3 223 ATOM 1028 H HG . SER A 223 71 . -5.734 8.480 -4.438 1.00 0.00 ? ? ? ? ? . 71 SER A HG 223 ATOM 1029 N N . LEU A 223 72 . -6.701 7.737 -7.220 1.00 0.00 ? ? ? ? ? . 72 LEU A N 223 ATOM 1030 C CA . LEU A 223 72 . -8.008 7.024 -7.155 1.00 0.00 ? ? ? ? ? . 72 LEU A CA 223 ATOM 1031 C C . LEU A 223 72 . -7.967 5.792 -8.063 1.00 0.00 ? ? ? ? ? . 72 LEU A C 223 ATOM 1032 O O . LEU A 223 72 . -8.227 4.686 -7.635 1.00 0.00 ? ? ? ? ? . 72 LEU A O 223 ATOM 1033 C CB . LEU A 223 72 . -9.124 7.963 -7.620 1.00 0.00 ? ? ? ? ? . 72 LEU A CB 223 ATOM 1034 C CG . LEU A 223 72 . -10.467 7.230 -7.579 1.00 0.00 ? ? ? ? ? . 72 LEU A CG 223 ATOM 1035 C CD1 . LEU A 223 72 . -11.304 7.762 -6.414 1.00 0.00 ? ? ? ? ? . 72 LEU A CD1 223 ATOM 1036 C CD2 . LEU A 223 72 . -11.216 7.466 -8.892 1.00 0.00 ? ? ? ? ? . 72 LEU A CD2 223 ATOM 1037 H H . LEU A 223 72 . -6.630 8.588 -7.702 1.00 0.00 ? ? ? ? ? . 72 LEU A H 223 ATOM 1038 H HA . LEU A 223 72 . -8.199 6.715 -6.139 1.00 0.00 ? ? ? ? ? . 72 LEU A HA 223 ATOM 1039 H HB2 . LEU A 223 72 . -9.163 8.824 -6.969 1.00 0.00 ? ? ? ? ? . 72 LEU A HB2 223 ATOM 1040 H HB3 . LEU A 223 72 . -8.924 8.286 -8.631 1.00 0.00 ? ? ? ? ? . 72 LEU A HB3 223 ATOM 1041 H HG . LEU A 223 72 . -10.297 6.171 -7.444 1.00 0.00 ? ? ? ? ? . 72 LEU A HG 223 ATOM 1042 H HD11 . LEU A 223 72 . -11.530 8.805 -6.581 1.00 0.00 ? ? ? ? ? . 72 LEU A HD11 223 ATOM 1043 H HD12 . LEU A 223 72 . -10.748 7.657 -5.494 1.00 0.00 ? ? ? ? ? . 72 LEU A HD12 223 ATOM 1044 H HD13 . LEU A 223 72 . -12.224 7.200 -6.347 1.00 0.00 ? ? ? ? ? . 72 LEU A HD13 223 ATOM 1045 H HD21 . LEU A 223 72 . -12.056 6.791 -8.954 1.00 0.00 ? ? ? ? ? . 72 LEU A HD21 223 ATOM 1046 H HD22 . LEU A 223 72 . -10.550 7.289 -9.724 1.00 0.00 ? ? ? ? ? . 72 LEU A HD22 223 ATOM 1047 H HD23 . LEU A 223 72 . -11.571 8.485 -8.925 1.00 0.00 ? ? ? ? ? . 72 LEU A HD23 223 ATOM 1048 N N . ILE A 223 73 . -7.647 5.975 -9.315 1.00 0.00 ? ? ? ? ? . 73 ILE A N 223 ATOM 1049 C CA . ILE A 223 73 . -7.597 4.813 -10.248 1.00 0.00 ? ? ? ? ? . 73 ILE A CA 223 ATOM 1050 C C . ILE A 223 73 . -6.600 3.775 -9.728 1.00 0.00 ? ? ? ? ? . 73 ILE A C 223 ATOM 1051 O O . ILE A 223 73 . -6.890 2.597 -9.669 1.00 0.00 ? ? ? ? ? . 73 ILE A O 223 ATOM 1052 C CB . ILE A 223 73 . -7.157 5.291 -11.634 1.00 0.00 ? ? ? ? ? . 73 ILE A CB 223 ATOM 1053 C CG1 . ILE A 223 73 . -7.062 4.090 -12.578 1.00 0.00 ? ? ? ? ? . 73 ILE A CG1 223 ATOM 1054 C CG2 . ILE A 223 73 . -5.789 5.968 -11.532 1.00 0.00 ? ? ? ? ? . 73 ILE A CG2 223 ATOM 1055 C CD1 . ILE A 223 73 . -7.127 4.574 -14.028 1.00 0.00 ? ? ? ? ? . 73 ILE A CD1 223 ATOM 1056 H H . ILE A 223 73 . -7.445 6.875 -9.643 1.00 0.00 ? ? ? ? ? . 73 ILE A H 223 ATOM 1057 H HA . ILE A 223 73 . -8.577 4.365 -10.318 1.00 0.00 ? ? ? ? ? . 73 ILE A HA 223 ATOM 1058 H HB . ILE A 223 73 . -7.881 5.997 -12.017 1.00 0.00 ? ? ? ? ? . 73 ILE A HB 223 ATOM 1059 H HG12 . ILE A 223 73 . -6.129 3.573 -12.410 1.00 0.00 ? ? ? ? ? . 73 ILE A HG12 223 ATOM 1060 H HG13 . ILE A 223 73 . -7.886 3.418 -12.389 1.00 0.00 ? ? ? ? ? . 73 ILE A HG13 223 ATOM 1061 H HG21 . ILE A 223 73 . -5.698 6.714 -12.309 1.00 0.00 ? ? ? ? ? . 73 ILE A HG21 223 ATOM 1062 H HG22 . ILE A 223 73 . -5.012 5.228 -11.652 1.00 0.00 ? ? ? ? ? . 73 ILE A HG22 223 ATOM 1063 H HG23 . ILE A 223 73 . -5.691 6.439 -10.566 1.00 0.00 ? ? ? ? ? . 73 ILE A HG23 223 ATOM 1064 H HD11 . ILE A 223 73 . -6.505 5.450 -14.142 1.00 0.00 ? ? ? ? ? . 73 ILE A HD11 223 ATOM 1065 H HD12 . ILE A 223 73 . -8.147 4.821 -14.281 1.00 0.00 ? ? ? ? ? . 73 ILE A HD12 223 ATOM 1066 H HD13 . ILE A 223 73 . -6.771 3.792 -14.683 1.00 0.00 ? ? ? ? ? . 73 ILE A HD13 223 ATOM 1067 N N . THR A 223 74 . -5.424 4.201 -9.355 1.00 0.00 ? ? ? ? ? . 74 THR A N 223 ATOM 1068 C CA . THR A 223 74 . -4.410 3.236 -8.845 1.00 0.00 ? ? ? ? ? . 74 THR A CA 223 ATOM 1069 C C . THR A 223 74 . -4.939 2.545 -7.585 1.00 0.00 ? ? ? ? ? . 74 THR A C 223 ATOM 1070 O O . THR A 223 74 . -4.660 1.389 -7.337 1.00 0.00 ? ? ? ? ? . 74 THR A O 223 ATOM 1071 C CB . THR A 223 74 . -3.116 3.983 -8.511 1.00 0.00 ? ? ? ? ? . 74 THR A CB 223 ATOM 1072 O OG1 . THR A 223 74 . -3.429 5.170 -7.794 1.00 0.00 ? ? ? ? ? . 74 THR A OG1 223 ATOM 1073 C CG2 . THR A 223 74 . -2.385 4.344 -9.805 1.00 0.00 ? ? ? ? ? . 74 THR A CG2 223 ATOM 1074 H H . THR A 223 74 . -5.208 5.154 -9.413 1.00 0.00 ? ? ? ? ? . 74 THR A H 223 ATOM 1075 H HA . THR A 223 74 . -4.209 2.493 -9.603 1.00 0.00 ? ? ? ? ? . 74 THR A HA 223 ATOM 1076 H HB . THR A 223 74 . -2.482 3.355 -7.908 1.00 0.00 ? ? ? ? ? . 74 THR A HB 223 ATOM 1077 H HG1 . THR A 223 74 . -4.268 5.033 -7.348 1.00 0.00 ? ? ? ? ? . 74 THR A HG1 223 ATOM 1078 H HG21 . THR A 223 74 . -1.501 3.731 -9.902 1.00 0.00 ? ? ? ? ? . 74 THR A HG21 223 ATOM 1079 H HG22 . THR A 223 74 . -2.099 5.386 -9.778 1.00 0.00 ? ? ? ? ? . 74 THR A HG22 223 ATOM 1080 H HG23 . THR A 223 74 . -3.037 4.172 -10.648 1.00 0.00 ? ? ? ? ? . 74 THR A HG23 223 ATOM 1081 N N . GLU A 223 75 . -5.698 3.243 -6.784 1.00 0.00 ? ? ? ? ? . 75 GLU A N 223 ATOM 1082 C CA . GLU A 223 75 . -6.237 2.620 -5.542 1.00 0.00 ? ? ? ? ? . 75 GLU A CA 223 ATOM 1083 C C . GLU A 223 75 . -7.514 1.844 -5.869 1.00 0.00 ? ? ? ? ? . 75 GLU A C 223 ATOM 1084 O O . GLU A 223 75 . -8.053 1.139 -5.039 1.00 0.00 ? ? ? ? ? . 75 GLU A O 223 ATOM 1085 C CB . GLU A 223 75 . -6.555 3.713 -4.518 1.00 0.00 ? ? ? ? ? . 75 GLU A CB 223 ATOM 1086 C CG . GLU A 223 75 . -5.298 4.037 -3.709 1.00 0.00 ? ? ? ? ? . 75 GLU A CG 223 ATOM 1087 C CD . GLU A 223 75 . -5.466 5.394 -3.023 1.00 0.00 ? ? ? ? ? . 75 GLU A CD 223 ATOM 1088 O OE1 . GLU A 223 75 . -6.035 5.424 -1.944 1.00 0.00 ? ? ? ? ? . 75 GLU A OE1 223 ATOM 1089 O OE2 . GLU A 223 75 . -5.024 6.381 -3.589 1.00 0.00 ? ? ? ? ? . 75 GLU A OE2 223 ATOM 1090 H H . GLU A 223 75 . -5.911 4.175 -6.998 1.00 0.00 ? ? ? ? ? . 75 GLU A H 223 ATOM 1091 H HA . GLU A 223 75 . -5.502 1.945 -5.129 1.00 0.00 ? ? ? ? ? . 75 GLU A HA 223 ATOM 1092 H HB2 . GLU A 223 75 . -6.893 4.600 -5.032 1.00 0.00 ? ? ? ? ? . 75 GLU A HB2 223 ATOM 1093 H HB3 . GLU A 223 75 . -7.329 3.365 -3.851 1.00 0.00 ? ? ? ? ? . 75 GLU A HB3 223 ATOM 1094 H HG2 . GLU A 223 75 . -5.143 3.272 -2.961 1.00 0.00 ? ? ? ? ? . 75 GLU A HG2 223 ATOM 1095 H HG3 . GLU A 223 75 . -4.444 4.073 -4.369 1.00 0.00 ? ? ? ? ? . 75 GLU A HG3 223 ATOM 1096 N N . TRP A 223 76 . -8.005 1.968 -7.072 1.00 0.00 ? ? ? ? ? . 76 TRP A N 223 ATOM 1097 C CA . TRP A 223 76 . -9.247 1.237 -7.448 1.00 0.00 ? ? ? ? ? . 76 TRP A CA 223 ATOM 1098 C C . TRP A 223 76 . -8.882 -0.162 -7.949 1.00 0.00 ? ? ? ? ? . 76 TRP A C 223 ATOM 1099 O O . TRP A 223 76 . -9.584 -1.121 -7.701 1.00 0.00 ? ? ? ? ? . 76 TRP A O 223 ATOM 1100 C CB . TRP A 223 76 . -9.975 2.002 -8.554 1.00 0.00 ? ? ? ? ? . 76 TRP A CB 223 ATOM 1101 C CG . TRP A 223 76 . -11.066 2.830 -7.953 1.00 0.00 ? ? ? ? ? . 76 TRP A CG 223 ATOM 1102 C CD1 . TRP A 223 76 . -10.976 3.499 -6.781 1.00 0.00 ? ? ? ? ? . 76 TRP A CD1 223 ATOM 1103 C CD2 . TRP A 223 76 . -12.403 3.089 -8.472 1.00 0.00 ? ? ? ? ? . 76 TRP A CD2 223 ATOM 1104 N NE1 . TRP A 223 76 . -12.173 4.151 -6.547 1.00 0.00 ? ? ? ? ? . 76 TRP A NE1 223 ATOM 1105 C CE2 . TRP A 223 76 . -13.083 3.930 -7.560 1.00 0.00 ? ? ? ? ? . 76 TRP A CE2 223 ATOM 1106 C CE3 . TRP A 223 76 . -13.083 2.680 -9.633 1.00 0.00 ? ? ? ? ? . 76 TRP A CE3 223 ATOM 1107 C CZ2 . TRP A 223 76 . -14.394 4.349 -7.792 1.00 0.00 ? ? ? ? ? . 76 TRP A CZ2 223 ATOM 1108 C CZ3 . TRP A 223 76 . -14.403 3.100 -9.868 1.00 0.00 ? ? ? ? ? . 76 TRP A CZ3 223 ATOM 1109 C CH2 . TRP A 223 76 . -15.057 3.934 -8.950 1.00 0.00 ? ? ? ? ? . 76 TRP A CH2 223 ATOM 1110 H H . TRP A 223 76 . -7.556 2.542 -7.727 1.00 0.00 ? ? ? ? ? . 76 TRP A H 223 ATOM 1111 H HA . TRP A 223 76 . -9.890 1.154 -6.585 1.00 0.00 ? ? ? ? ? . 76 TRP A HA 223 ATOM 1112 H HB2 . TRP A 223 76 . -9.276 2.645 -9.068 1.00 0.00 ? ? ? ? ? . 76 TRP A HB2 223 ATOM 1113 H HB3 . TRP A 223 76 . -10.401 1.301 -9.256 1.00 0.00 ? ? ? ? ? . 76 TRP A HB3 223 ATOM 1114 H HD1 . TRP A 223 76 . -10.111 3.520 -6.134 1.00 0.00 ? ? ? ? ? . 76 TRP A HD1 223 ATOM 1115 H HE1 . TRP A 223 76 . -12.370 4.708 -5.764 1.00 0.00 ? ? ? ? ? . 76 TRP A HE1 223 ATOM 1116 H HE3 . TRP A 223 76 . -12.589 2.038 -10.347 1.00 0.00 ? ? ? ? ? . 76 TRP A HE3 223 ATOM 1117 H HZ2 . TRP A 223 76 . -14.893 4.991 -7.080 1.00 0.00 ? ? ? ? ? . 76 TRP A HZ2 223 ATOM 1118 H HZ3 . TRP A 223 76 . -14.917 2.780 -10.762 1.00 0.00 ? ? ? ? ? . 76 TRP A HZ3 223 ATOM 1119 H HH2 . TRP A 223 76 . -16.071 4.254 -9.137 1.00 0.00 ? ? ? ? ? . 76 TRP A HH2 223 ATOM 1120 N N . VAL A 223 77 . -7.790 -0.285 -8.652 1.00 0.00 ? ? ? ? ? . 77 VAL A N 223 ATOM 1121 C CA . VAL A 223 77 . -7.381 -1.622 -9.166 1.00 0.00 ? ? ? ? ? . 77 VAL A CA 223 ATOM 1122 C C . VAL A 223 77 . -6.525 -2.331 -8.117 1.00 0.00 ? ? ? ? ? . 77 VAL A C 223 ATOM 1123 O O . VAL A 223 77 . -6.492 -3.543 -8.042 1.00 0.00 ? ? ? ? ? . 77 VAL A O 223 ATOM 1124 C CB . VAL A 223 77 . -6.572 -1.447 -10.452 1.00 0.00 ? ? ? ? ? . 77 VAL A CB 223 ATOM 1125 C CG1 . VAL A 223 77 . -7.445 -0.785 -11.519 1.00 0.00 ? ? ? ? ? . 77 VAL A CG1 223 ATOM 1126 C CG2 . VAL A 223 77 . -5.355 -0.564 -10.169 1.00 0.00 ? ? ? ? ? . 77 VAL A CG2 223 ATOM 1127 H H . VAL A 223 77 . -7.237 0.502 -8.840 1.00 0.00 ? ? ? ? ? . 77 VAL A H 223 ATOM 1128 H HA . VAL A 223 77 . -8.261 -2.213 -9.373 1.00 0.00 ? ? ? ? ? . 77 VAL A HA 223 ATOM 1129 H HB . VAL A 223 77 . -6.244 -2.414 -10.806 1.00 0.00 ? ? ? ? ? . 77 VAL A HB 223 ATOM 1130 H HG11 . VAL A 223 77 . -8.100 -0.065 -11.052 1.00 0.00 ? ? ? ? ? . 77 VAL A HG11 223 ATOM 1131 H HG12 . VAL A 223 77 . -8.037 -1.539 -12.018 1.00 0.00 ? ? ? ? ? . 77 VAL A HG12 223 ATOM 1132 H HG13 . VAL A 223 77 . -6.817 -0.286 -12.241 1.00 0.00 ? ? ? ? ? . 77 VAL A HG13 223 ATOM 1133 H HG21 . VAL A 223 77 . -4.880 -0.887 -9.255 1.00 0.00 ? ? ? ? ? . 77 VAL A HG21 223 ATOM 1134 H HG22 . VAL A 223 77 . -5.672 0.463 -10.066 1.00 0.00 ? ? ? ? ? . 77 VAL A HG22 223 ATOM 1135 H HG23 . VAL A 223 77 . -4.654 -0.643 -10.986 1.00 0.00 ? ? ? ? ? . 77 VAL A HG23 223 ATOM 1136 N N . LYS A 223 78 . -5.831 -1.582 -7.304 1.00 0.00 ? ? ? ? ? . 78 LYS A N 223 ATOM 1137 C CA . LYS A 223 78 . -4.976 -2.210 -6.259 1.00 0.00 ? ? ? ? ? . 78 LYS A CA 223 ATOM 1138 C C . LYS A 223 78 . -5.779 -3.282 -5.518 1.00 0.00 ? ? ? ? ? . 78 LYS A C 223 ATOM 1139 O O . LYS A 223 78 . -6.479 -3.000 -4.566 1.00 0.00 ? ? ? ? ? . 78 LYS A O 223 ATOM 1140 C CB . LYS A 223 78 . -4.518 -1.140 -5.265 1.00 0.00 ? ? ? ? ? . 78 LYS A CB 223 ATOM 1141 C CG . LYS A 223 78 . -3.092 -1.449 -4.805 1.00 0.00 ? ? ? ? ? . 78 LYS A CG 223 ATOM 1142 C CD . LYS A 223 78 . -2.705 -0.500 -3.668 1.00 0.00 ? ? ? ? ? . 78 LYS A CD 223 ATOM 1143 C CE . LYS A 223 78 . -1.207 -0.196 -3.742 1.00 0.00 ? ? ? ? ? . 78 LYS A CE 223 ATOM 1144 N NZ . LYS A 223 78 . -0.922 0.606 -4.965 1.00 0.00 ? ? ? ? ? . 78 LYS A NZ 223 ATOM 1145 H H . LYS A 223 78 . -5.872 -0.606 -7.382 1.00 0.00 ? ? ? ? ? . 78 LYS A H 223 ATOM 1146 H HA . LYS A 223 78 . -4.113 -2.663 -6.723 1.00 0.00 ? ? ? ? ? . 78 LYS A HA 223 ATOM 1147 H HB2 . LYS A 223 78 . -4.541 -0.172 -5.745 1.00 0.00 ? ? ? ? ? . 78 LYS A HB2 223 ATOM 1148 H HB3 . LYS A 223 78 . -5.177 -1.136 -4.410 1.00 0.00 ? ? ? ? ? . 78 LYS A HB3 223 ATOM 1149 H HG2 . LYS A 223 78 . -3.040 -2.470 -4.457 1.00 0.00 ? ? ? ? ? . 78 LYS A HG2 223 ATOM 1150 H HG3 . LYS A 223 78 . -2.409 -1.314 -5.631 1.00 0.00 ? ? ? ? ? . 78 LYS A HG3 223 ATOM 1151 H HD2 . LYS A 223 78 . -3.265 0.419 -3.761 1.00 0.00 ? ? ? ? ? . 78 LYS A HD2 223 ATOM 1152 H HD3 . LYS A 223 78 . -2.930 -0.964 -2.720 1.00 0.00 ? ? ? ? ? . 78 LYS A HD3 223 ATOM 1153 H HE2 . LYS A 223 78 . -0.910 0.364 -2.868 1.00 0.00 ? ? ? ? ? . 78 LYS A HE2 223 ATOM 1154 H HE3 . LYS A 223 78 . -0.654 -1.123 -3.781 1.00 0.00 ? ? ? ? ? . 78 LYS A HE3 223 ATOM 1155 H HZ1 . LYS A 223 78 . -1.045 1.616 -4.754 1.00 0.00 ? ? ? ? ? . 78 LYS A HZ1 223 ATOM 1156 H HZ2 . LYS A 223 78 . -1.579 0.326 -5.724 1.00 0.00 ? ? ? ? ? . 78 LYS A HZ2 223 ATOM 1157 H HZ3 . LYS A 223 78 . 0.055 0.435 -5.273 1.00 0.00 ? ? ? ? ? . 78 LYS A HZ3 223 ATOM 1158 N N . GLY A 223 79 . -5.682 -4.511 -5.946 1.00 0.00 ? ? ? ? ? . 79 GLY A N 223 ATOM 1159 C CA . GLY A 223 79 . -6.438 -5.598 -5.264 1.00 0.00 ? ? ? ? ? . 79 GLY A CA 223 ATOM 1160 C C . GLY A 223 79 . -7.385 -6.268 -6.261 1.00 0.00 ? ? ? ? ? . 79 GLY A C 223 ATOM 1161 O O . GLY A 223 79 . -7.732 -7.424 -6.122 1.00 0.00 ? ? ? ? ? . 79 GLY A O 223 ATOM 1162 H H . GLY A 223 79 . -5.109 -4.719 -6.714 1.00 0.00 ? ? ? ? ? . 79 GLY A H 223 ATOM 1163 H HA2 . GLY A 223 79 . -5.744 -6.330 -4.877 1.00 0.00 ? ? ? ? ? . 79 GLY A HA2 223 ATOM 1164 H HA3 . GLY A 223 79 . -7.013 -5.182 -4.451 1.00 0.00 ? ? ? ? ? . 79 GLY A HA3 223 ATOM 1165 N N . LYS A 223 80 . -7.807 -5.552 -7.267 1.00 0.00 ? ? ? ? ? . 80 LYS A N 223 ATOM 1166 C CA . LYS A 223 80 . -8.732 -6.150 -8.271 1.00 0.00 ? ? ? ? ? . 80 LYS A CA 223 ATOM 1167 C C . LYS A 223 80 . -7.955 -7.113 -9.170 1.00 0.00 ? ? ? ? ? . 80 LYS A C 223 ATOM 1168 O O . LYS A 223 80 . -6.843 -7.500 -8.866 1.00 0.00 ? ? ? ? ? . 80 LYS A O 223 ATOM 1169 C CB . LYS A 223 80 . -9.348 -5.039 -9.123 1.00 0.00 ? ? ? ? ? . 80 LYS A CB 223 ATOM 1170 C CG . LYS A 223 80 . -10.084 -4.052 -8.215 1.00 0.00 ? ? ? ? ? . 80 LYS A CG 223 ATOM 1171 C CD . LYS A 223 80 . -11.189 -3.351 -9.009 1.00 0.00 ? ? ? ? ? . 80 LYS A CD 223 ATOM 1172 C CE . LYS A 223 80 . -12.548 -3.941 -8.625 1.00 0.00 ? ? ? ? ? . 80 LYS A CE 223 ATOM 1173 N NZ . LYS A 223 80 . -13.499 -3.778 -9.759 1.00 0.00 ? ? ? ? ? . 80 LYS A NZ 223 ATOM 1174 H H . LYS A 223 80 . -7.517 -4.621 -7.362 1.00 0.00 ? ? ? ? ? . 80 LYS A H 223 ATOM 1175 H HA . LYS A 223 80 . -9.516 -6.689 -7.761 1.00 0.00 ? ? ? ? ? . 80 LYS A HA 223 ATOM 1176 H HB2 . LYS A 223 80 . -8.566 -4.522 -9.660 1.00 0.00 ? ? ? ? ? . 80 LYS A HB2 223 ATOM 1177 H HB3 . LYS A 223 80 . -10.047 -5.467 -9.825 1.00 0.00 ? ? ? ? ? . 80 LYS A HB3 223 ATOM 1178 H HG2 . LYS A 223 80 . -10.520 -4.585 -7.383 1.00 0.00 ? ? ? ? ? . 80 LYS A HG2 223 ATOM 1179 H HG3 . LYS A 223 80 . -9.387 -3.315 -7.845 1.00 0.00 ? ? ? ? ? . 80 LYS A HG3 223 ATOM 1180 H HD2 . LYS A 223 80 . -11.178 -2.293 -8.785 1.00 0.00 ? ? ? ? ? . 80 LYS A HD2 223 ATOM 1181 H HD3 . LYS A 223 80 . -11.021 -3.498 -10.066 1.00 0.00 ? ? ? ? ? . 80 LYS A HD3 223 ATOM 1182 H HE2 . LYS A 223 80 . -12.433 -4.991 -8.398 1.00 0.00 ? ? ? ? ? . 80 LYS A HE2 223 ATOM 1183 H HE3 . LYS A 223 80 . -12.931 -3.425 -7.756 1.00 0.00 ? ? ? ? ? . 80 LYS A HE3 223 ATOM 1184 H HZ1 . LYS A 223 80 . -14.177 -3.022 -9.539 1.00 0.00 ? ? ? ? ? . 80 LYS A HZ1 223 ATOM 1185 H HZ2 . LYS A 223 80 . -14.013 -4.671 -9.911 1.00 0.00 ? ? ? ? ? . 80 LYS A HZ2 223 ATOM 1186 H HZ3 . LYS A 223 80 . -12.974 -3.529 -10.620 1.00 0.00 ? ? ? ? ? . 80 LYS A HZ3 223 ATOM 1187 N N . SER A 223 81 . -8.528 -7.506 -10.275 1.00 0.00 ? ? ? ? ? . 81 SER A N 223 ATOM 1188 C CA . SER A 223 81 . -7.819 -8.446 -11.188 1.00 0.00 ? ? ? ? ? . 81 SER A CA 223 ATOM 1189 C C . SER A 223 81 . -7.808 -7.873 -12.607 1.00 0.00 ? ? ? ? ? . 81 SER A C 223 ATOM 1190 O O . SER A 223 81 . -8.561 -6.977 -12.930 1.00 0.00 ? ? ? ? ? . 81 SER A O 223 ATOM 1191 C CB . SER A 223 81 . -8.538 -9.796 -11.188 1.00 0.00 ? ? ? ? ? . 81 SER A CB 223 ATOM 1192 O OG . SER A 223 81 . -9.279 -9.933 -9.983 1.00 0.00 ? ? ? ? ? . 81 SER A OG 223 ATOM 1193 H H . SER A 223 81 . -9.426 -7.185 -10.503 1.00 0.00 ? ? ? ? ? . 81 SER A H 223 ATOM 1194 H HA . SER A 223 81 . -6.803 -8.581 -10.847 1.00 0.00 ? ? ? ? ? . 81 SER A HA 223 ATOM 1195 H HB2 . SER A 223 81 . -9.212 -9.846 -12.026 1.00 0.00 ? ? ? ? ? . 81 SER A HB2 223 ATOM 1196 H HB3 . SER A 223 81 . -7.808 -10.590 -11.267 1.00 0.00 ? ? ? ? ? . 81 SER A HB3 223 ATOM 1197 H HG . SER A 223 81 . -8.736 -9.607 -9.261 1.00 0.00 ? ? ? ? ? . 81 SER A HG 223 ATOM 1198 N N . LEU A 223 82 . -6.961 -8.387 -13.457 1.00 0.00 ? ? ? ? ? . 82 LEU A N 223 ATOM 1199 C CA . LEU A 223 82 . -6.904 -7.872 -14.855 1.00 0.00 ? ? ? ? ? . 82 LEU A CA 223 ATOM 1200 C C . LEU A 223 82 . -8.292 -7.971 -15.488 1.00 0.00 ? ? ? ? ? . 82 LEU A C 223 ATOM 1201 O O . LEU A 223 82 . -8.706 -7.110 -16.237 1.00 0.00 ? ? ? ? ? . 82 LEU A O 223 ATOM 1202 C CB . LEU A 223 82 . -5.910 -8.708 -15.665 1.00 0.00 ? ? ? ? ? . 82 LEU A CB 223 ATOM 1203 C CG . LEU A 223 82 . -4.483 -8.276 -15.326 1.00 0.00 ? ? ? ? ? . 82 LEU A CG 223 ATOM 1204 C CD1 . LEU A 223 82 . -3.514 -9.413 -15.654 1.00 0.00 ? ? ? ? ? . 82 LEU A CD1 223 ATOM 1205 C CD2 . LEU A 223 82 . -4.116 -7.040 -16.152 1.00 0.00 ? ? ? ? ? . 82 LEU A CD2 223 ATOM 1206 H H . LEU A 223 82 . -6.362 -9.110 -13.177 1.00 0.00 ? ? ? ? ? . 82 LEU A H 223 ATOM 1207 H HA . LEU A 223 82 . -6.585 -6.840 -14.845 1.00 0.00 ? ? ? ? ? . 82 LEU A HA 223 ATOM 1208 H HB2 . LEU A 223 82 . -6.039 -9.753 -15.423 1.00 0.00 ? ? ? ? ? . 82 LEU A HB2 223 ATOM 1209 H HB3 . LEU A 223 82 . -6.090 -8.557 -16.719 1.00 0.00 ? ? ? ? ? . 82 LEU A HB3 223 ATOM 1210 H HG . LEU A 223 82 . -4.419 -8.040 -14.273 1.00 0.00 ? ? ? ? ? . 82 LEU A HG 223 ATOM 1211 H HD11 . LEU A 223 82 . -2.502 -9.036 -15.649 1.00 0.00 ? ? ? ? ? . 82 LEU A HD11 223 ATOM 1212 H HD12 . LEU A 223 82 . -3.744 -9.813 -16.630 1.00 0.00 ? ? ? ? ? . 82 LEU A HD12 223 ATOM 1213 H HD13 . LEU A 223 82 . -3.611 -10.193 -14.913 1.00 0.00 ? ? ? ? ? . 82 LEU A HD13 223 ATOM 1214 H HD21 . LEU A 223 82 . -3.063 -6.826 -16.030 1.00 0.00 ? ? ? ? ? . 82 LEU A HD21 223 ATOM 1215 H HD22 . LEU A 223 82 . -4.696 -6.195 -15.813 1.00 0.00 ? ? ? ? ? . 82 LEU A HD22 223 ATOM 1216 H HD23 . LEU A 223 82 . -4.326 -7.228 -17.194 1.00 0.00 ? ? ? ? ? . 82 LEU A HD23 223 ATOM 1217 N N . GLU A 223 83 . -9.015 -9.016 -15.191 1.00 0.00 ? ? ? ? ? . 83 GLU A N 223 ATOM 1218 C CA . GLU A 223 83 . -10.376 -9.169 -15.775 1.00 0.00 ? ? ? ? ? . 83 GLU A CA 223 ATOM 1219 C C . GLU A 223 83 . -11.214 -7.937 -15.433 1.00 0.00 ? ? ? ? ? . 83 GLU A C 223 ATOM 1220 O O . GLU A 223 83 . -12.066 -7.521 -16.193 1.00 0.00 ? ? ? ? ? . 83 GLU A O 223 ATOM 1221 C CB . GLU A 223 83 . -11.045 -10.416 -15.192 1.00 0.00 ? ? ? ? ? . 83 GLU A CB 223 ATOM 1222 C CG . GLU A 223 83 . -12.518 -10.446 -15.605 1.00 0.00 ? ? ? ? ? . 83 GLU A CG 223 ATOM 1223 C CD . GLU A 223 83 . -13.371 -9.827 -14.496 1.00 0.00 ? ? ? ? ? . 83 GLU A CD 223 ATOM 1224 O OE1 . GLU A 223 83 . -13.003 -9.969 -13.343 1.00 0.00 ? ? ? ? ? . 83 GLU A OE1 223 ATOM 1225 O OE2 . GLU A 223 83 . -14.380 -9.223 -14.820 1.00 0.00 ? ? ? ? ? . 83 GLU A OE2 223 ATOM 1226 H H . GLU A 223 83 . -8.662 -9.699 -14.583 1.00 0.00 ? ? ? ? ? . 83 GLU A H 223 ATOM 1227 H HA . GLU A 223 83 . -10.301 -9.268 -16.847 1.00 0.00 ? ? ? ? ? . 83 GLU A HA 223 ATOM 1228 H HB2 . GLU A 223 83 . -10.547 -11.299 -15.567 1.00 0.00 ? ? ? ? ? . 83 GLU A HB2 223 ATOM 1229 H HB3 . GLU A 223 83 . -10.975 -10.392 -14.116 1.00 0.00 ? ? ? ? ? . 83 GLU A HB3 223 ATOM 1230 H HG2 . GLU A 223 83 . -12.647 -9.881 -16.517 1.00 0.00 ? ? ? ? ? . 83 GLU A HG2 223 ATOM 1231 H HG3 . GLU A 223 83 . -12.826 -11.467 -15.767 1.00 0.00 ? ? ? ? ? . 83 GLU A HG3 223 ATOM 1232 N N . GLU A 223 84 . -10.979 -7.348 -14.293 1.00 0.00 ? ? ? ? ? . 84 GLU A N 223 ATOM 1233 C CA . GLU A 223 84 . -11.760 -6.142 -13.900 1.00 0.00 ? ? ? ? ? . 84 GLU A CA 223 ATOM 1234 C C . GLU A 223 84 . -11.126 -4.897 -14.525 1.00 0.00 ? ? ? ? ? . 84 GLU A C 223 ATOM 1235 O O . GLU A 223 84 . -11.809 -4.032 -15.036 1.00 0.00 ? ? ? ? ? . 84 GLU A O 223 ATOM 1236 C CB . GLU A 223 84 . -11.760 -6.011 -12.377 1.00 0.00 ? ? ? ? ? . 84 GLU A CB 223 ATOM 1237 C CG . GLU A 223 84 . -12.708 -7.052 -11.778 1.00 0.00 ? ? ? ? ? . 84 GLU A CG 223 ATOM 1238 C CD . GLU A 223 84 . -12.827 -6.831 -10.270 1.00 0.00 ? ? ? ? ? . 84 GLU A CD 223 ATOM 1239 O OE1 . GLU A 223 84 . -13.689 -6.065 -9.869 1.00 0.00 ? ? ? ? ? . 84 GLU A OE1 223 ATOM 1240 O OE2 . GLU A 223 84 . -12.056 -7.432 -9.539 1.00 0.00 ? ? ? ? ? . 84 GLU A OE2 223 ATOM 1241 H H . GLU A 223 84 . -10.287 -7.699 -13.694 1.00 0.00 ? ? ? ? ? . 84 GLU A H 223 ATOM 1242 H HA . GLU A 223 84 . -12.777 -6.243 -14.253 1.00 0.00 ? ? ? ? ? . 84 GLU A HA 223 ATOM 1243 H HB2 . GLU A 223 84 . -10.760 -6.175 -12.002 1.00 0.00 ? ? ? ? ? . 84 GLU A HB2 223 ATOM 1244 H HB3 . GLU A 223 84 . -12.092 -5.022 -12.099 1.00 0.00 ? ? ? ? ? . 84 GLU A HB3 223 ATOM 1245 H HG2 . GLU A 223 84 . -13.682 -6.956 -12.235 1.00 0.00 ? ? ? ? ? . 84 GLU A HG2 223 ATOM 1246 H HG3 . GLU A 223 84 . -12.320 -8.042 -11.965 1.00 0.00 ? ? ? ? ? . 84 GLU A HG3 223 ATOM 1247 N N . ALA A 223 85 . -9.825 -4.801 -14.494 1.00 0.00 ? ? ? ? ? . 85 ALA A N 223 ATOM 1248 C CA . ALA A 223 85 . -9.153 -3.614 -15.094 1.00 0.00 ? ? ? ? ? . 85 ALA A CA 223 ATOM 1249 C C . ALA A 223 85 . -9.491 -3.546 -16.584 1.00 0.00 ? ? ? ? ? . 85 ALA A C 223 ATOM 1250 O O . ALA A 223 85 . -9.566 -2.481 -17.167 1.00 0.00 ? ? ? ? ? . 85 ALA A O 223 ATOM 1251 C CB . ALA A 223 85 . -7.639 -3.738 -14.918 1.00 0.00 ? ? ? ? ? . 85 ALA A CB 223 ATOM 1252 H H . ALA A 223 85 . -9.290 -5.511 -14.082 1.00 0.00 ? ? ? ? ? . 85 ALA A H 223 ATOM 1253 H HA . ALA A 223 85 . -9.502 -2.716 -14.603 1.00 0.00 ? ? ? ? ? . 85 ALA A HA 223 ATOM 1254 H HB1 . ALA A 223 85 . -7.240 -2.801 -14.563 1.00 0.00 ? ? ? ? ? . 85 ALA A HB1 223 ATOM 1255 H HB2 . ALA A 223 85 . -7.186 -3.987 -15.867 1.00 0.00 ? ? ? ? ? . 85 ALA A HB2 223 ATOM 1256 H HB3 . ALA A 223 85 . -7.422 -4.517 -14.202 1.00 0.00 ? ? ? ? ? . 85 ALA A HB3 223 ATOM 1257 N N . GLY A 223 86 . -9.698 -4.675 -17.203 1.00 0.00 ? ? ? ? ? . 86 GLY A N 223 ATOM 1258 C CA . GLY A 223 86 . -10.035 -4.679 -18.655 1.00 0.00 ? ? ? ? ? . 86 GLY A CA 223 ATOM 1259 C C . GLY A 223 86 . -11.552 -4.580 -18.822 1.00 0.00 ? ? ? ? ? . 86 GLY A C 223 ATOM 1260 O O . GLY A 223 86 . -12.146 -5.277 -19.621 1.00 0.00 ? ? ? ? ? . 86 GLY A O 223 ATOM 1261 H H . GLY A 223 86 . -9.634 -5.520 -16.713 1.00 0.00 ? ? ? ? ? . 86 GLY A H 223 ATOM 1262 H HA2 . GLY A 223 86 . -9.561 -3.837 -19.137 1.00 0.00 ? ? ? ? ? . 86 GLY A HA2 223 ATOM 1263 H HA3 . GLY A 223 86 . -9.685 -5.597 -19.103 1.00 0.00 ? ? ? ? ? . 86 GLY A HA3 223 ATOM 1264 N N . ALA A 223 87 . -12.184 -3.719 -18.072 1.00 0.00 ? ? ? ? ? . 87 ALA A N 223 ATOM 1265 C CA . ALA A 223 87 . -13.662 -3.574 -18.185 1.00 0.00 ? ? ? ? ? . 87 ALA A CA 223 ATOM 1266 C C . ALA A 223 87 . -14.070 -2.191 -17.677 1.00 0.00 ? ? ? ? ? . 87 ALA A C 223 ATOM 1267 O O . ALA A 223 87 . -14.977 -1.569 -18.193 1.00 0.00 ? ? ? ? ? . 87 ALA A O 223 ATOM 1268 C CB . ALA A 223 87 . -14.347 -4.651 -17.341 1.00 0.00 ? ? ? ? ? . 87 ALA A CB 223 ATOM 1269 H H . ALA A 223 87 . -11.684 -3.167 -17.434 1.00 0.00 ? ? ? ? ? . 87 ALA A H 223 ATOM 1270 H HA . ALA A 223 87 . -13.958 -3.681 -19.218 1.00 0.00 ? ? ? ? ? . 87 ALA A HA 223 ATOM 1271 H HB1 . ALA A 223 87 . -13.707 -4.918 -16.512 1.00 0.00 ? ? ? ? ? . 87 ALA A HB1 223 ATOM 1272 H HB2 . ALA A 223 87 . -14.529 -5.524 -17.950 1.00 0.00 ? ? ? ? ? . 87 ALA A HB2 223 ATOM 1273 H HB3 . ALA A 223 87 . -15.285 -4.271 -16.964 1.00 0.00 ? ? ? ? ? . 87 ALA A HB3 223 ATOM 1274 N N . ILE A 223 88 . -13.402 -1.706 -16.666 1.00 0.00 ? ? ? ? ? . 88 ILE A N 223 ATOM 1275 C CA . ILE A 223 88 . -13.743 -0.363 -16.119 1.00 0.00 ? ? ? ? ? . 88 ILE A CA 223 ATOM 1276 C C . ILE A 223 88 . -13.752 0.662 -17.254 1.00 0.00 ? ? ? ? ? . 88 ILE A C 223 ATOM 1277 O O . ILE A 223 88 . -13.132 0.471 -18.281 1.00 0.00 ? ? ? ? ? . 88 ILE A O 223 ATOM 1278 C CB . ILE A 223 88 . -12.696 0.037 -15.077 1.00 0.00 ? ? ? ? ? . 88 ILE A CB 223 ATOM 1279 C CG1 . ILE A 223 88 . -11.325 -0.491 -15.506 1.00 0.00 ? ? ? ? ? . 88 ILE A CG1 223 ATOM 1280 C CG2 . ILE A 223 88 . -13.070 -0.564 -13.720 1.00 0.00 ? ? ? ? ? . 88 ILE A CG2 223 ATOM 1281 C CD1 . ILE A 223 88 . -10.251 0.045 -14.558 1.00 0.00 ? ? ? ? ? . 88 ILE A CD1 223 ATOM 1282 H H . ILE A 223 88 . -12.674 -2.226 -16.267 1.00 0.00 ? ? ? ? ? . 88 ILE A H 223 ATOM 1283 H HA . ILE A 223 88 . -14.718 -0.399 -15.655 1.00 0.00 ? ? ? ? ? . 88 ILE A HA 223 ATOM 1284 H HB . ILE A 223 88 . -12.662 1.112 -14.997 1.00 0.00 ? ? ? ? ? . 88 ILE A HB 223 ATOM 1285 H HG12 . ILE A 223 88 . -11.329 -1.571 -15.475 1.00 0.00 ? ? ? ? ? . 88 ILE A HG12 223 ATOM 1286 H HG13 . ILE A 223 88 . -11.111 -0.160 -16.512 1.00 0.00 ? ? ? ? ? . 88 ILE A HG13 223 ATOM 1287 H HG21 . ILE A 223 88 . -14.098 -0.327 -13.493 1.00 0.00 ? ? ? ? ? . 88 ILE A HG21 223 ATOM 1288 H HG22 . ILE A 223 88 . -12.428 -0.152 -12.955 1.00 0.00 ? ? ? ? ? . 88 ILE A HG22 223 ATOM 1289 H HG23 . ILE A 223 88 . -12.947 -1.637 -13.755 1.00 0.00 ? ? ? ? ? . 88 ILE A HG23 223 ATOM 1290 H HD11 . ILE A 223 88 . -10.561 -0.118 -13.536 1.00 0.00 ? ? ? ? ? . 88 ILE A HD11 223 ATOM 1291 H HD12 . ILE A 223 88 . -10.114 1.102 -14.729 1.00 0.00 ? ? ? ? ? . 88 ILE A HD12 223 ATOM 1292 H HD13 . ILE A 223 88 . -9.321 -0.473 -14.738 1.00 0.00 ? ? ? ? ? . 88 ILE A HD13 223 ATOM 1293 N N . LYS A 223 89 . -14.451 1.750 -17.076 1.00 0.00 ? ? ? ? ? . 89 LYS A N 223 ATOM 1294 C CA . LYS A 223 89 . -14.500 2.788 -18.144 1.00 0.00 ? ? ? ? ? . 89 LYS A CA 223 ATOM 1295 C C . LYS A 223 89 . -14.170 4.155 -17.541 1.00 0.00 ? ? ? ? ? . 89 LYS A C 223 ATOM 1296 O O . LYS A 223 89 . -14.187 4.335 -16.340 1.00 0.00 ? ? ? ? ? . 89 LYS A O 223 ATOM 1297 C CB . LYS A 223 89 . -15.904 2.828 -18.753 1.00 0.00 ? ? ? ? ? . 89 LYS A CB 223 ATOM 1298 C CG . LYS A 223 89 . -16.074 1.658 -19.724 1.00 0.00 ? ? ? ? ? . 89 LYS A CG 223 ATOM 1299 C CD . LYS A 223 89 . -17.540 1.220 -19.743 1.00 0.00 ? ? ? ? ? . 89 LYS A CD 223 ATOM 1300 C CE . LYS A 223 89 . -17.787 0.312 -20.949 1.00 0.00 ? ? ? ? ? . 89 LYS A CE 223 ATOM 1301 N NZ . LYS A 223 89 . -17.930 1.145 -22.177 1.00 0.00 ? ? ? ? ? . 89 LYS A NZ 223 ATOM 1302 H H . LYS A 223 89 . -14.943 1.886 -16.239 1.00 0.00 ? ? ? ? ? . 89 LYS A H 223 ATOM 1303 H HA . LYS A 223 89 . -13.780 2.550 -18.913 1.00 0.00 ? ? ? ? ? . 89 LYS A HA 223 ATOM 1304 H HB2 . LYS A 223 89 . -16.640 2.754 -17.966 1.00 0.00 ? ? ? ? ? . 89 LYS A HB2 223 ATOM 1305 H HB3 . LYS A 223 89 . -16.039 3.758 -19.285 1.00 0.00 ? ? ? ? ? . 89 LYS A HB3 223 ATOM 1306 H HG2 . LYS A 223 89 . -15.777 1.967 -20.716 1.00 0.00 ? ? ? ? ? . 89 LYS A HG2 223 ATOM 1307 H HG3 . LYS A 223 89 . -15.458 0.832 -19.404 1.00 0.00 ? ? ? ? ? . 89 LYS A HG3 223 ATOM 1308 H HD2 . LYS A 223 89 . -17.766 0.681 -18.834 1.00 0.00 ? ? ? ? ? . 89 LYS A HD2 223 ATOM 1309 H HD3 . LYS A 223 89 . -18.175 2.090 -19.813 1.00 0.00 ? ? ? ? ? . 89 LYS A HD3 223 ATOM 1310 H HE2 . LYS A 223 89 . -16.954 -0.365 -21.068 1.00 0.00 ? ? ? ? ? . 89 LYS A HE2 223 ATOM 1311 H HE3 . LYS A 223 89 . -18.693 -0.256 -20.792 1.00 0.00 ? ? ? ? ? . 89 LYS A HE3 223 ATOM 1312 H HZ1 . LYS A 223 89 . -16.990 1.444 -22.504 1.00 0.00 ? ? ? ? ? . 89 LYS A HZ1 223 ATOM 1313 H HZ2 . LYS A 223 89 . -18.506 1.984 -21.960 1.00 0.00 ? ? ? ? ? . 89 LYS A HZ2 223 ATOM 1314 H HZ3 . LYS A 223 89 . -18.394 0.588 -22.922 1.00 0.00 ? ? ? ? ? . 89 LYS A HZ3 223 ATOM 1315 N N . ASN A 223 90 . -13.873 5.123 -18.365 1.00 0.00 ? ? ? ? ? . 90 ASN A N 223 ATOM 1316 C CA . ASN A 223 90 . -13.545 6.477 -17.836 1.00 0.00 ? ? ? ? ? . 90 ASN A CA 223 ATOM 1317 C C . ASN A 223 90 . -14.798 7.101 -17.220 1.00 0.00 ? ? ? ? ? . 90 ASN A C 223 ATOM 1318 O O . ASN A 223 90 . -14.723 7.885 -16.295 1.00 0.00 ? ? ? ? ? . 90 ASN A O 223 ATOM 1319 C CB . ASN A 223 90 . -13.042 7.362 -18.978 1.00 0.00 ? ? ? ? ? . 90 ASN A CB 223 ATOM 1320 C CG . ASN A 223 90 . -13.769 6.990 -20.271 1.00 0.00 ? ? ? ? ? . 90 ASN A CG 223 ATOM 1321 O OD1 . ASN A 223 90 . -13.534 5.938 -20.832 1.00 0.00 ? ? ? ? ? . 90 ASN A OD1 223 ATOM 1322 N ND2 . ASN A 223 90 . -14.647 7.814 -20.773 1.00 0.00 ? ? ? ? ? . 90 ASN A ND2 223 ATOM 1323 H H . ASN A 223 90 . -13.866 4.959 -19.331 1.00 0.00 ? ? ? ? ? . 90 ASN A H 223 ATOM 1324 H HA . ASN A 223 90 . -12.777 6.392 -17.082 1.00 0.00 ? ? ? ? ? . 90 ASN A HA 223 ATOM 1325 H HB2 . ASN A 223 90 . -13.236 8.399 -18.741 1.00 0.00 ? ? ? ? ? . 90 ASN A HB2 223 ATOM 1326 H HB3 . ASN A 223 90 . -11.981 7.215 -19.108 1.00 0.00 ? ? ? ? ? . 90 ASN A HB3 223 ATOM 1327 H HD21 . ASN A 223 90 . -14.837 8.663 -20.321 1.00 0.00 ? ? ? ? ? . 90 ASN A HD21 223 ATOM 1328 H HD22 . ASN A 223 90 . -15.117 7.585 -21.601 1.00 0.00 ? ? ? ? ? . 90 ASN A HD22 223 ATOM 1329 N N . SER A 223 91 . -15.952 6.759 -17.726 1.00 0.00 ? ? ? ? ? . 91 SER A N 223 ATOM 1330 C CA . SER A 223 91 . -17.209 7.333 -17.169 1.00 0.00 ? ? ? ? ? . 91 SER A CA 223 ATOM 1331 C C . SER A 223 91 . -17.338 6.947 -15.694 1.00 0.00 ? ? ? ? ? . 91 SER A C 223 ATOM 1332 O O . SER A 223 91 . -17.928 7.658 -14.905 1.00 0.00 ? ? ? ? ? . 91 SER A O 223 ATOM 1333 C CB . SER A 223 91 . -18.408 6.788 -17.946 1.00 0.00 ? ? ? ? ? . 91 SER A CB 223 ATOM 1334 O OG . SER A 223 91 . -18.361 5.367 -17.947 1.00 0.00 ? ? ? ? ? . 91 SER A OG 223 ATOM 1335 H H . SER A 223 91 . -15.992 6.125 -18.472 1.00 0.00 ? ? ? ? ? . 91 SER A H 223 ATOM 1336 H HA . SER A 223 91 . -17.183 8.410 -17.258 1.00 0.00 ? ? ? ? ? . 91 SER A HA 223 ATOM 1337 H HB2 . SER A 223 91 . -19.322 7.111 -17.476 1.00 0.00 ? ? ? ? ? . 91 SER A HB2 223 ATOM 1338 H HB3 . SER A 223 91 . -18.376 7.160 -18.962 1.00 0.00 ? ? ? ? ? . 91 SER A HB3 223 ATOM 1339 H HG . SER A 223 91 . -19.262 5.040 -17.997 1.00 0.00 ? ? ? ? ? . 91 SER A HG 223 ATOM 1340 N N . GLN A 223 92 . -16.791 5.824 -15.317 1.00 0.00 ? ? ? ? ? . 92 GLN A N 223 ATOM 1341 C CA . GLN A 223 92 . -16.883 5.392 -13.894 1.00 0.00 ? ? ? ? ? . 92 GLN A CA 223 ATOM 1342 C C . GLN A 223 92 . -16.247 6.455 -12.995 1.00 0.00 ? ? ? ? ? . 92 GLN A C 223 ATOM 1343 O O . GLN A 223 92 . -16.871 6.968 -12.087 1.00 0.00 ? ? ? ? ? . 92 GLN A O 223 ATOM 1344 C CB . GLN A 223 92 . -16.142 4.065 -13.718 1.00 0.00 ? ? ? ? ? . 92 GLN A CB 223 ATOM 1345 C CG . GLN A 223 92 . -16.571 3.093 -14.818 1.00 0.00 ? ? ? ? ? . 92 GLN A CG 223 ATOM 1346 C CD . GLN A 223 92 . -18.091 3.146 -14.982 1.00 0.00 ? ? ? ? ? . 92 GLN A CD 223 ATOM 1347 O OE1 . GLN A 223 92 . -18.614 4.037 -15.624 1.00 0.00 ? ? ? ? ? . 92 GLN A OE1 223 ATOM 1348 N NE2 . GLN A 223 92 . -18.828 2.224 -14.428 1.00 0.00 ? ? ? ? ? . 92 GLN A NE2 223 ATOM 1349 H H . GLN A 223 92 . -16.321 5.265 -15.969 1.00 0.00 ? ? ? ? ? . 92 GLN A H 223 ATOM 1350 H HA . GLN A 223 92 . -17.921 5.265 -13.622 1.00 0.00 ? ? ? ? ? . 92 GLN A HA 223 ATOM 1351 H HB2 . GLN A 223 92 . -15.077 4.236 -13.782 1.00 0.00 ? ? ? ? ? . 92 GLN A HB2 223 ATOM 1352 H HB3 . GLN A 223 92 . -16.382 3.644 -12.753 1.00 0.00 ? ? ? ? ? . 92 GLN A HB3 223 ATOM 1353 H HG2 . GLN A 223 92 . -16.096 3.371 -15.749 1.00 0.00 ? ? ? ? ? . 92 GLN A HG2 223 ATOM 1354 H HG3 . GLN A 223 92 . -16.275 2.091 -14.548 1.00 0.00 ? ? ? ? ? . 92 GLN A HG3 223 ATOM 1355 H HE21 . GLN A 223 92 . -18.407 1.506 -13.911 1.00 0.00 ? ? ? ? ? . 92 GLN A HE21 223 ATOM 1356 H HE22 . GLN A 223 92 . -19.803 2.249 -14.527 1.00 0.00 ? ? ? ? ? . 92 GLN A HE22 223 ATOM 1357 N N . ILE A 223 93 . -15.009 6.789 -13.237 1.00 0.00 ? ? ? ? ? . 93 ILE A N 223 ATOM 1358 C CA . ILE A 223 93 . -14.334 7.815 -12.393 1.00 0.00 ? ? ? ? ? . 93 ILE A CA 223 ATOM 1359 C C . ILE A 223 93 . -14.934 9.193 -12.685 1.00 0.00 ? ? ? ? ? . 93 ILE A C 223 ATOM 1360 O O . ILE A 223 93 . -15.121 10.000 -11.795 1.00 0.00 ? ? ? ? ? . 93 ILE A O 223 ATOM 1361 C CB . ILE A 223 93 . -12.837 7.831 -12.711 1.00 0.00 ? ? ? ? ? . 93 ILE A CB 223 ATOM 1362 C CG1 . ILE A 223 93 . -12.225 6.473 -12.349 1.00 0.00 ? ? ? ? ? . 93 ILE A CG1 223 ATOM 1363 C CG2 . ILE A 223 93 . -12.154 8.932 -11.896 1.00 0.00 ? ? ? ? ? . 93 ILE A CG2 223 ATOM 1364 C CD1 . ILE A 223 93 . -11.647 5.820 -13.606 1.00 0.00 ? ? ? ? ? . 93 ILE A CD1 223 ATOM 1365 H H . ILE A 223 93 . -14.521 6.362 -13.973 1.00 0.00 ? ? ? ? ? . 93 ILE A H 223 ATOM 1366 H HA . ILE A 223 93 . -14.479 7.575 -11.351 1.00 0.00 ? ? ? ? ? . 93 ILE A HA 223 ATOM 1367 H HB . ILE A 223 93 . -12.695 8.024 -13.764 1.00 0.00 ? ? ? ? ? . 93 ILE A HB 223 ATOM 1368 H HG12 . ILE A 223 93 . -11.439 6.614 -11.622 1.00 0.00 ? ? ? ? ? . 93 ILE A HG12 223 ATOM 1369 H HG13 . ILE A 223 93 . -12.988 5.832 -11.933 1.00 0.00 ? ? ? ? ? . 93 ILE A HG13 223 ATOM 1370 H HG21 . ILE A 223 93 . -12.830 9.287 -11.132 1.00 0.00 ? ? ? ? ? . 93 ILE A HG21 223 ATOM 1371 H HG22 . ILE A 223 93 . -11.888 9.750 -12.549 1.00 0.00 ? ? ? ? ? . 93 ILE A HG22 223 ATOM 1372 H HG23 . ILE A 223 93 . -11.263 8.536 -11.433 1.00 0.00 ? ? ? ? ? . 93 ILE A HG23 223 ATOM 1373 H HD11 . ILE A 223 93 . -10.706 6.288 -13.855 1.00 0.00 ? ? ? ? ? . 93 ILE A HD11 223 ATOM 1374 H HD12 . ILE A 223 93 . -12.339 5.944 -14.426 1.00 0.00 ? ? ? ? ? . 93 ILE A HD12 223 ATOM 1375 H HD13 . ILE A 223 93 . -11.488 4.767 -13.424 1.00 0.00 ? ? ? ? ? . 93 ILE A HD13 223 ATOM 1376 N N . ALA A 223 94 . -15.233 9.471 -13.924 1.00 0.00 ? ? ? ? ? . 94 ALA A N 223 ATOM 1377 C CA . ALA A 223 94 . -15.818 10.797 -14.270 1.00 0.00 ? ? ? ? ? . 94 ALA A CA 223 ATOM 1378 C C . ALA A 223 94 . -17.064 11.047 -13.418 1.00 0.00 ? ? ? ? ? . 94 ALA A C 223 ATOM 1379 O O . ALA A 223 94 . -17.378 12.170 -13.075 1.00 0.00 ? ? ? ? ? . 94 ALA A O 223 ATOM 1380 C CB . ALA A 223 94 . -16.201 10.815 -15.752 1.00 0.00 ? ? ? ? ? . 94 ALA A CB 223 ATOM 1381 H H . ALA A 223 94 . -15.073 8.808 -14.627 1.00 0.00 ? ? ? ? ? . 94 ALA A H 223 ATOM 1382 H HA . ALA A 223 94 . -15.090 11.572 -14.078 1.00 0.00 ? ? ? ? ? . 94 ALA A HA 223 ATOM 1383 H HB1 . ALA A 223 94 . -15.779 11.691 -16.223 1.00 0.00 ? ? ? ? ? . 94 ALA A HB1 223 ATOM 1384 H HB2 . ALA A 223 94 . -17.276 10.839 -15.847 1.00 0.00 ? ? ? ? ? . 94 ALA A HB2 223 ATOM 1385 H HB3 . ALA A 223 94 . -15.816 9.928 -16.233 1.00 0.00 ? ? ? ? ? . 94 ALA A HB3 223 ATOM 1386 N N . GLU A 223 95 . -17.779 10.011 -13.074 1.00 0.00 ? ? ? ? ? . 95 GLU A N 223 ATOM 1387 C CA . GLU A 223 95 . -19.006 10.193 -12.247 1.00 0.00 ? ? ? ? ? . 95 GLU A CA 223 ATOM 1388 C C . GLU A 223 95 . -18.623 10.250 -10.766 1.00 0.00 ? ? ? ? ? . 95 GLU A C 223 ATOM 1389 O O . GLU A 223 95 . -19.127 11.061 -10.015 1.00 0.00 ? ? ? ? ? . 95 GLU A O 223 ATOM 1390 C CB . GLU A 223 95 . -19.959 9.018 -12.480 1.00 0.00 ? ? ? ? ? . 95 GLU A CB 223 ATOM 1391 C CG . GLU A 223 95 . -20.533 9.099 -13.896 1.00 0.00 ? ? ? ? ? . 95 GLU A CG 223 ATOM 1392 C CD . GLU A 223 95 . -21.806 9.944 -13.885 1.00 0.00 ? ? ? ? ? . 95 GLU A CD 223 ATOM 1393 O OE1 . GLU A 223 95 . -22.793 9.486 -13.331 1.00 0.00 ? ? ? ? ? . 95 GLU A OE1 223 ATOM 1394 O OE2 . GLU A 223 95 . -21.774 11.035 -14.430 1.00 0.00 ? ? ? ? ? . 95 GLU A OE2 223 ATOM 1395 H H . GLU A 223 95 . -17.511 9.113 -13.361 1.00 0.00 ? ? ? ? ? . 95 GLU A H 223 ATOM 1396 H HA . GLU A 223 95 . -19.495 11.114 -12.527 1.00 0.00 ? ? ? ? ? . 95 GLU A HA 223 ATOM 1397 H HB2 . GLU A 223 95 . -19.420 8.089 -12.361 1.00 0.00 ? ? ? ? ? . 95 GLU A HB2 223 ATOM 1398 H HB3 . GLU A 223 95 . -20.766 9.062 -11.765 1.00 0.00 ? ? ? ? ? . 95 GLU A HB3 223 ATOM 1399 H HG2 . GLU A 223 95 . -19.804 9.551 -14.555 1.00 0.00 ? ? ? ? ? . 95 GLU A HG2 223 ATOM 1400 H HG3 . GLU A 223 95 . -20.766 8.105 -14.247 1.00 0.00 ? ? ? ? ? . 95 GLU A HG3 223 ATOM 1401 N N . GLU A 223 96 . -17.739 9.390 -10.337 1.00 0.00 ? ? ? ? ? . 96 GLU A N 223 ATOM 1402 C CA . GLU A 223 96 . -17.331 9.394 -8.904 1.00 0.00 ? ? ? ? ? . 96 GLU A CA 223 ATOM 1403 C C . GLU A 223 96 . -16.637 10.716 -8.569 1.00 0.00 ? ? ? ? ? . 96 GLU A C 223 ATOM 1404 O O . GLU A 223 96 . -16.587 11.130 -7.428 1.00 0.00 ? ? ? ? ? . 96 GLU A O 223 ATOM 1405 C CB . GLU A 223 96 . -16.367 8.234 -8.645 1.00 0.00 ? ? ? ? ? . 96 GLU A CB 223 ATOM 1406 C CG . GLU A 223 96 . -15.996 8.201 -7.161 1.00 0.00 ? ? ? ? ? . 96 GLU A CG 223 ATOM 1407 C CD . GLU A 223 96 . -14.955 9.285 -6.873 1.00 0.00 ? ? ? ? ? . 96 GLU A CD 223 ATOM 1408 O OE1 . GLU A 223 96 . -14.355 9.768 -7.818 1.00 0.00 ? ? ? ? ? . 96 GLU A OE1 223 ATOM 1409 O OE2 . GLU A 223 96 . -14.776 9.612 -5.711 1.00 0.00 ? ? ? ? ? . 96 GLU A OE2 223 ATOM 1410 H H . GLU A 223 96 . -17.347 8.741 -10.957 1.00 0.00 ? ? ? ? ? . 96 GLU A H 223 ATOM 1411 H HA . GLU A 223 96 . -18.206 9.279 -8.281 1.00 0.00 ? ? ? ? ? . 96 GLU A HA 223 ATOM 1412 H HB2 . GLU A 223 96 . -16.843 7.302 -8.917 1.00 0.00 ? ? ? ? ? . 96 GLU A HB2 223 ATOM 1413 H HB3 . GLU A 223 96 . -15.474 8.369 -9.235 1.00 0.00 ? ? ? ? ? . 96 GLU A HB3 223 ATOM 1414 H HG2 . GLU A 223 96 . -16.878 8.382 -6.564 1.00 0.00 ? ? ? ? ? . 96 GLU A HG2 223 ATOM 1415 H HG3 . GLU A 223 96 . -15.584 7.234 -6.913 1.00 0.00 ? ? ? ? ? . 96 GLU A HG3 223 ATOM 1416 N N . LEU A 223 97 . -16.098 11.382 -9.553 1.00 0.00 ? ? ? ? ? . 97 LEU A N 223 ATOM 1417 C CA . LEU A 223 97 . -15.406 12.674 -9.286 1.00 0.00 ? ? ? ? ? . 97 LEU A CA 223 ATOM 1418 C C . LEU A 223 97 . -16.359 13.834 -9.582 1.00 0.00 ? ? ? ? ? . 97 LEU A C 223 ATOM 1419 O O . LEU A 223 97 . -16.372 14.832 -8.889 1.00 0.00 ? ? ? ? ? . 97 LEU A O 223 ATOM 1420 C CB . LEU A 223 97 . -14.170 12.785 -10.182 1.00 0.00 ? ? ? ? ? . 97 LEU A CB 223 ATOM 1421 C CG . LEU A 223 97 . -12.908 12.708 -9.324 1.00 0.00 ? ? ? ? ? . 97 LEU A CG 223 ATOM 1422 C CD1 . LEU A 223 97 . -11.694 12.454 -10.220 1.00 0.00 ? ? ? ? ? . 97 LEU A CD1 223 ATOM 1423 C CD2 . LEU A 223 97 . -12.718 14.029 -8.574 1.00 0.00 ? ? ? ? ? . 97 LEU A CD2 223 ATOM 1424 H H . LEU A 223 97 . -16.146 11.031 -10.468 1.00 0.00 ? ? ? ? ? . 97 LEU A H 223 ATOM 1425 H HA . LEU A 223 97 . -15.105 12.714 -8.249 1.00 0.00 ? ? ? ? ? . 97 LEU A HA 223 ATOM 1426 H HB2 . LEU A 223 97 . -14.171 11.974 -10.897 1.00 0.00 ? ? ? ? ? . 97 LEU A HB2 223 ATOM 1427 H HB3 . LEU A 223 97 . -14.190 13.729 -10.708 1.00 0.00 ? ? ? ? ? . 97 LEU A HB3 223 ATOM 1428 H HG . LEU A 223 97 . -13.004 11.899 -8.613 1.00 0.00 ? ? ? ? ? . 97 LEU A HG 223 ATOM 1429 H HD11 . LEU A 223 97 . -11.908 11.636 -10.893 1.00 0.00 ? ? ? ? ? . 97 LEU A HD11 223 ATOM 1430 H HD12 . LEU A 223 97 . -10.841 12.203 -9.608 1.00 0.00 ? ? ? ? ? . 97 LEU A HD12 223 ATOM 1431 H HD13 . LEU A 223 97 . -11.477 13.344 -10.793 1.00 0.00 ? ? ? ? ? . 97 LEU A HD13 223 ATOM 1432 H HD21 . LEU A 223 97 . -13.059 14.847 -9.192 1.00 0.00 ? ? ? ? ? . 97 LEU A HD21 223 ATOM 1433 H HD22 . LEU A 223 97 . -11.672 14.165 -8.343 1.00 0.00 ? ? ? ? ? . 97 LEU A HD22 223 ATOM 1434 H HD23 . LEU A 223 97 . -13.290 14.007 -7.658 1.00 0.00 ? ? ? ? ? . 97 LEU A HD23 223 ATOM 1435 N N . GLU A 223 98 . -17.157 13.712 -10.608 1.00 0.00 ? ? ? ? ? . 98 GLU A N 223 ATOM 1436 C CA . GLU A 223 98 . -18.107 14.808 -10.946 1.00 0.00 ? ? ? ? ? . 98 GLU A CA 223 ATOM 1437 C C . GLU A 223 98 . -17.322 16.035 -11.419 1.00 0.00 ? ? ? ? ? . 98 GLU A C 223 ATOM 1438 O O . GLU A 223 98 . -17.205 17.018 -10.715 1.00 0.00 ? ? ? ? ? . 98 GLU A O 223 ATOM 1439 C CB . GLU A 223 98 . -18.929 15.170 -9.707 1.00 0.00 ? ? ? ? ? . 98 GLU A CB 223 ATOM 1440 C CG . GLU A 223 98 . -20.365 15.495 -10.122 1.00 0.00 ? ? ? ? ? . 98 GLU A CG 223 ATOM 1441 C CD . GLU A 223 98 . -21.189 14.207 -10.165 1.00 0.00 ? ? ? ? ? . 98 GLU A CD 223 ATOM 1442 O OE1 . GLU A 223 98 . -20.905 13.320 -9.376 1.00 0.00 ? ? ? ? ? . 98 GLU A OE1 223 ATOM 1443 O OE2 . GLU A 223 98 . -22.088 14.130 -10.984 1.00 0.00 ? ? ? ? ? . 98 GLU A OE2 223 ATOM 1444 H H . GLU A 223 98 . -17.130 12.899 -11.154 1.00 0.00 ? ? ? ? ? . 98 GLU A H 223 ATOM 1445 H HA . GLU A 223 98 . -18.769 14.479 -11.734 1.00 0.00 ? ? ? ? ? . 98 GLU A HA 223 ATOM 1446 H HB2 . GLU A 223 98 . -18.932 14.334 -9.022 1.00 0.00 ? ? ? ? ? . 98 GLU A HB2 223 ATOM 1447 H HB3 . GLU A 223 98 . -18.492 16.031 -9.223 1.00 0.00 ? ? ? ? ? . 98 GLU A HB3 223 ATOM 1448 H HG2 . GLU A 223 98 . -20.800 16.178 -9.406 1.00 0.00 ? ? ? ? ? . 98 GLU A HG2 223 ATOM 1449 H HG3 . GLU A 223 98 . -20.363 15.952 -11.100 1.00 0.00 ? ? ? ? ? . 98 GLU A HG3 223 ATOM 1450 N N . LEU A 223 99 . -16.784 15.984 -12.607 1.00 0.00 ? ? ? ? ? . 99 LEU A N 223 ATOM 1451 C CA . LEU A 223 99 . -16.008 17.146 -13.122 1.00 0.00 ? ? ? ? ? . 99 LEU A CA 223 ATOM 1452 C C . LEU A 223 99 . -16.592 17.595 -14.464 1.00 0.00 ? ? ? ? ? . 99 LEU A C 223 ATOM 1453 O O . LEU A 223 99 . -17.118 16.800 -15.217 1.00 0.00 ? ? ? ? ? . 99 LEU A O 223 ATOM 1454 C CB . LEU A 223 99 . -14.546 16.737 -13.316 1.00 0.00 ? ? ? ? ? . 99 LEU A CB 223 ATOM 1455 C CG . LEU A 223 99 . -14.475 15.519 -14.238 1.00 0.00 ? ? ? ? ? . 99 LEU A CG 223 ATOM 1456 C CD1 . LEU A 223 99 . -13.408 15.749 -15.310 1.00 0.00 ? ? ? ? ? . 99 LEU A CD1 223 ATOM 1457 C CD2 . LEU A 223 99 . -14.111 14.279 -13.418 1.00 0.00 ? ? ? ? ? . 99 LEU A CD2 223 ATOM 1458 H H . LEU A 223 99 . -16.890 15.180 -13.159 1.00 0.00 ? ? ? ? ? . 99 LEU A H 223 ATOM 1459 H HA . LEU A 223 99 . -16.064 17.959 -12.414 1.00 0.00 ? ? ? ? ? . 99 LEU A HA 223 ATOM 1460 H HB2 . LEU A 223 99 . -13.998 17.557 -13.758 1.00 0.00 ? ? ? ? ? . 99 LEU A HB2 223 ATOM 1461 H HB3 . LEU A 223 99 . -14.112 16.488 -12.360 1.00 0.00 ? ? ? ? ? . 99 LEU A HB3 223 ATOM 1462 H HG . LEU A 223 99 . -15.435 15.370 -14.712 1.00 0.00 ? ? ? ? ? . 99 LEU A HG 223 ATOM 1463 H HD11 . LEU A 223 99 . -12.447 15.886 -14.837 1.00 0.00 ? ? ? ? ? . 99 LEU A HD11 223 ATOM 1464 H HD12 . LEU A 223 99 . -13.657 16.630 -15.883 1.00 0.00 ? ? ? ? ? . 99 LEU A HD12 223 ATOM 1465 H HD13 . LEU A 223 99 . -13.367 14.893 -15.966 1.00 0.00 ? ? ? ? ? . 99 LEU A HD13 223 ATOM 1466 H HD21 . LEU A 223 99 . -14.930 14.034 -12.756 1.00 0.00 ? ? ? ? ? . 99 LEU A HD21 223 ATOM 1467 H HD22 . LEU A 223 99 . -13.224 14.480 -12.835 1.00 0.00 ? ? ? ? ? . 99 LEU A HD22 223 ATOM 1468 H HD23 . LEU A 223 99 . -13.925 13.449 -14.083 1.00 0.00 ? ? ? ? ? . 99 LEU A HD23 223 ATOM 1469 N N . PRO A 223 100 . -16.500 18.864 -14.756 1.00 0.00 ? ? ? ? ? . 100 PRO A N 223 ATOM 1470 C CA . PRO A 223 100 . -17.026 19.440 -16.028 1.00 0.00 ? ? ? ? ? . 100 PRO A CA 223 ATOM 1471 C C . PRO A 223 100 . -16.332 18.848 -17.258 1.00 0.00 ? ? ? ? ? . 100 PRO A C 223 ATOM 1472 O O . PRO A 223 100 . -15.233 18.336 -17.175 1.00 0.00 ? ? ? ? ? . 100 PRO A O 223 ATOM 1473 C CB . PRO A 223 100 . -16.729 20.940 -15.916 1.00 0.00 ? ? ? ? ? . 100 PRO A CB 223 ATOM 1474 C CG . PRO A 223 100 . -15.699 21.077 -14.844 1.00 0.00 ? ? ? ? ? . 100 PRO A CG 223 ATOM 1475 C CD . PRO A 223 100 . -15.883 19.888 -13.904 1.00 0.00 ? ? ? ? ? . 100 PRO A CD 223 ATOM 1476 H HA . PRO A 223 100 . -18.090 19.288 -16.092 1.00 0.00 ? ? ? ? ? . 100 PRO A HA 223 ATOM 1477 H HB2 . PRO A 223 100 . -16.345 21.313 -16.856 1.00 0.00 ? ? ? ? ? . 100 PRO A HB2 223 ATOM 1478 H HB3 . PRO A 223 100 . -17.623 21.478 -15.639 1.00 0.00 ? ? ? ? ? . 100 PRO A HB3 223 ATOM 1479 H HG2 . PRO A 223 100 . -14.708 21.059 -15.280 1.00 0.00 ? ? ? ? ? . 100 PRO A HG2 223 ATOM 1480 H HG3 . PRO A 223 100 . -15.849 21.995 -14.300 1.00 0.00 ? ? ? ? ? . 100 PRO A HG3 223 ATOM 1481 H HD2 . PRO A 223 100 . -14.926 19.549 -13.530 1.00 0.00 ? ? ? ? ? . 100 PRO A HD2 223 ATOM 1482 H HD3 . PRO A 223 100 . -16.543 20.144 -13.091 1.00 0.00 ? ? ? ? ? . 100 PRO A HD3 223 ATOM 1483 N N . PRO A 223 101 . -16.978 18.919 -18.390 1.00 0.00 ? ? ? ? ? . 101 PRO A N 223 ATOM 1484 C CA . PRO A 223 101 . -16.429 18.383 -19.669 1.00 0.00 ? ? ? ? ? . 101 PRO A CA 223 ATOM 1485 C C . PRO A 223 101 . -15.240 19.202 -20.180 1.00 0.00 ? ? ? ? ? . 101 PRO A C 223 ATOM 1486 O O . PRO A 223 101 . -14.837 19.084 -21.321 1.00 0.00 ? ? ? ? ? . 101 PRO A O 223 ATOM 1487 C CB . PRO A 223 101 . -17.603 18.480 -20.645 1.00 0.00 ? ? ? ? ? . 101 PRO A CB 223 ATOM 1488 C CG . PRO A 223 101 . -18.505 19.531 -20.086 1.00 0.00 ? ? ? ? ? . 101 PRO A CG 223 ATOM 1489 C CD . PRO A 223 101 . -18.307 19.521 -18.571 1.00 0.00 ? ? ? ? ? . 101 PRO A CD 223 ATOM 1490 H HA . PRO A 223 101 . -16.146 17.350 -19.549 1.00 0.00 ? ? ? ? ? . 101 PRO A HA 223 ATOM 1491 H HB2 . PRO A 223 101 . -17.249 18.769 -21.625 1.00 0.00 ? ? ? ? ? . 101 PRO A HB2 223 ATOM 1492 H HB3 . PRO A 223 101 . -18.125 17.538 -20.698 1.00 0.00 ? ? ? ? ? . 101 PRO A HB3 223 ATOM 1493 H HG2 . PRO A 223 101 . -18.239 20.498 -20.491 1.00 0.00 ? ? ? ? ? . 101 PRO A HG2 223 ATOM 1494 H HG3 . PRO A 223 101 . -19.532 19.300 -20.319 1.00 0.00 ? ? ? ? ? . 101 PRO A HG3 223 ATOM 1495 H HD2 . PRO A 223 101 . -18.326 20.530 -18.180 1.00 0.00 ? ? ? ? ? . 101 PRO A HD2 223 ATOM 1496 H HD3 . PRO A 223 101 . -19.060 18.913 -18.093 1.00 0.00 ? ? ? ? ? . 101 PRO A HD3 223 ATOM 1497 N N . VAL A 223 102 . -14.671 20.029 -19.346 1.00 0.00 ? ? ? ? ? . 102 VAL A N 223 ATOM 1498 C CA . VAL A 223 102 . -13.510 20.851 -19.790 1.00 0.00 ? ? ? ? ? . 102 VAL A CA 223 ATOM 1499 C C . VAL A 223 102 . -12.222 20.274 -19.197 1.00 0.00 ? ? ? ? ? . 102 VAL A C 223 ATOM 1500 O O . VAL A 223 102 . -11.198 20.926 -19.162 1.00 0.00 ? ? ? ? ? . 102 VAL A O 223 ATOM 1501 C CB . VAL A 223 102 . -13.690 22.291 -19.311 1.00 0.00 ? ? ? ? ? . 102 VAL A CB 223 ATOM 1502 C CG1 . VAL A 223 102 . -15.109 22.762 -19.631 1.00 0.00 ? ? ? ? ? . 102 VAL A CG1 223 ATOM 1503 C CG2 . VAL A 223 102 . -13.460 22.357 -17.799 1.00 0.00 ? ? ? ? ? . 102 VAL A CG2 223 ATOM 1504 H H . VAL A 223 102 . -15.008 20.111 -18.429 1.00 0.00 ? ? ? ? ? . 102 VAL A H 223 ATOM 1505 H HA . VAL A 223 102 . -13.448 20.834 -20.868 1.00 0.00 ? ? ? ? ? . 102 VAL A HA 223 ATOM 1506 H HB . VAL A 223 102 . -12.977 22.929 -19.814 1.00 0.00 ? ? ? ? ? . 102 VAL A HB 223 ATOM 1507 H HG11 . VAL A 223 102 . -15.397 22.400 -20.607 1.00 0.00 ? ? ? ? ? . 102 VAL A HG11 223 ATOM 1508 H HG12 . VAL A 223 102 . -15.140 23.842 -19.624 1.00 0.00 ? ? ? ? ? . 102 VAL A HG12 223 ATOM 1509 H HG13 . VAL A 223 102 . -15.792 22.378 -18.888 1.00 0.00 ? ? ? ? ? . 102 VAL A HG13 223 ATOM 1510 H HG21 . VAL A 223 102 . -14.112 21.650 -17.307 1.00 0.00 ? ? ? ? ? . 102 VAL A HG21 223 ATOM 1511 H HG22 . VAL A 223 102 . -13.676 23.354 -17.445 1.00 0.00 ? ? ? ? ? . 102 VAL A HG22 223 ATOM 1512 H HG23 . VAL A 223 102 . -12.431 22.111 -17.581 1.00 0.00 ? ? ? ? ? . 102 VAL A HG23 223 ATOM 1513 N N . LYS A 223 103 . -12.266 19.056 -18.730 1.00 0.00 ? ? ? ? ? . 103 LYS A N 223 ATOM 1514 C CA . LYS A 223 103 . -11.046 18.439 -18.140 1.00 0.00 ? ? ? ? ? . 103 LYS A CA 223 ATOM 1515 C C . LYS A 223 103 . -11.106 16.921 -18.319 1.00 0.00 ? ? ? ? ? . 103 LYS A C 223 ATOM 1516 O O . LYS A 223 103 . -10.411 16.179 -17.653 1.00 0.00 ? ? ? ? ? . 103 LYS A O 223 ATOM 1517 C CB . LYS A 223 103 . -10.975 18.774 -16.648 1.00 0.00 ? ? ? ? ? . 103 LYS A CB 223 ATOM 1518 C CG . LYS A 223 103 . -9.536 19.129 -16.271 1.00 0.00 ? ? ? ? ? . 103 LYS A CG 223 ATOM 1519 C CD . LYS A 223 103 . -9.322 18.870 -14.779 1.00 0.00 ? ? ? ? ? . 103 LYS A CD 223 ATOM 1520 C CE . LYS A 223 103 . -8.220 19.791 -14.254 1.00 0.00 ? ? ? ? ? . 103 LYS A CE 223 ATOM 1521 N NZ . LYS A 223 103 . -6.905 19.357 -14.804 1.00 0.00 ? ? ? ? ? . 103 LYS A NZ 223 ATOM 1522 H H . LYS A 223 103 . -13.104 18.547 -18.767 1.00 0.00 ? ? ? ? ? . 103 LYS A H 223 ATOM 1523 H HA . LYS A 223 103 . -10.170 18.827 -18.637 1.00 0.00 ? ? ? ? ? . 103 LYS A HA 223 ATOM 1524 H HB2 . LYS A 223 103 . -11.621 19.614 -16.438 1.00 0.00 ? ? ? ? ? . 103 LYS A HB2 223 ATOM 1525 H HB3 . LYS A 223 103 . -11.297 17.919 -16.072 1.00 0.00 ? ? ? ? ? . 103 LYS A HB3 223 ATOM 1526 H HG2 . LYS A 223 103 . -8.853 18.519 -16.846 1.00 0.00 ? ? ? ? ? . 103 LYS A HG2 223 ATOM 1527 H HG3 . LYS A 223 103 . -9.355 20.171 -16.484 1.00 0.00 ? ? ? ? ? . 103 LYS A HG3 223 ATOM 1528 H HD2 . LYS A 223 103 . -10.241 19.066 -14.245 1.00 0.00 ? ? ? ? ? . 103 LYS A HD2 223 ATOM 1529 H HD3 . LYS A 223 103 . -9.031 17.841 -14.630 1.00 0.00 ? ? ? ? ? . 103 LYS A HD3 223 ATOM 1530 H HE2 . LYS A 223 103 . -8.422 20.805 -14.563 1.00 0.00 ? ? ? ? ? . 103 LYS A HE2 223 ATOM 1531 H HE3 . LYS A 223 103 . -8.192 19.741 -13.176 1.00 0.00 ? ? ? ? ? . 103 LYS A HE3 223 ATOM 1532 H HZ1 . LYS A 223 103 . -6.463 20.149 -15.311 1.00 0.00 ? ? ? ? ? . 103 LYS A HZ1 223 ATOM 1533 H HZ2 . LYS A 223 103 . -7.051 18.562 -15.461 1.00 0.00 ? ? ? ? ? . 103 LYS A HZ2 223 ATOM 1534 H HZ3 . LYS A 223 103 . -6.285 19.056 -14.027 1.00 0.00 ? ? ? ? ? . 103 LYS A HZ3 223 ATOM 1535 N N . VAL A 223 104 . -11.930 16.453 -19.215 1.00 0.00 ? ? ? ? ? . 104 VAL A N 223 ATOM 1536 C CA . VAL A 223 104 . -12.035 14.982 -19.438 1.00 0.00 ? ? ? ? ? . 104 VAL A CA 223 ATOM 1537 C C . VAL A 223 104 . -10.661 14.423 -19.811 1.00 0.00 ? ? ? ? ? . 104 VAL A C 223 ATOM 1538 O O . VAL A 223 104 . -10.440 13.228 -19.791 1.00 0.00 ? ? ? ? ? . 104 VAL A O 223 ATOM 1539 C CB . VAL A 223 104 . -13.023 14.708 -20.573 1.00 0.00 ? ? ? ? ? . 104 VAL A CB 223 ATOM 1540 C CG1 . VAL A 223 104 . -13.367 13.218 -20.600 1.00 0.00 ? ? ? ? ? . 104 VAL A CG1 223 ATOM 1541 C CG2 . VAL A 223 104 . -14.301 15.524 -20.346 1.00 0.00 ? ? ? ? ? . 104 VAL A CG2 223 ATOM 1542 H H . VAL A 223 104 . -12.482 17.067 -19.743 1.00 0.00 ? ? ? ? ? . 104 VAL A H 223 ATOM 1543 H HA . VAL A 223 104 . -12.384 14.506 -18.534 1.00 0.00 ? ? ? ? ? . 104 VAL A HA 223 ATOM 1544 H HB . VAL A 223 104 . -12.576 14.991 -21.515 1.00 0.00 ? ? ? ? ? . 104 VAL A HB 223 ATOM 1545 H HG11 . VAL A 223 104 . -13.789 12.963 -21.560 1.00 0.00 ? ? ? ? ? . 104 VAL A HG11 223 ATOM 1546 H HG12 . VAL A 223 104 . -14.086 13.000 -19.822 1.00 0.00 ? ? ? ? ? . 104 VAL A HG12 223 ATOM 1547 H HG13 . VAL A 223 104 . -12.471 12.638 -20.434 1.00 0.00 ? ? ? ? ? . 104 VAL A HG13 223 ATOM 1548 H HG21 . VAL A 223 104 . -15.137 14.854 -20.209 1.00 0.00 ? ? ? ? ? . 104 VAL A HG21 223 ATOM 1549 H HG22 . VAL A 223 104 . -14.481 16.155 -21.202 1.00 0.00 ? ? ? ? ? . 104 VAL A HG22 223 ATOM 1550 H HG23 . VAL A 223 104 . -14.185 16.139 -19.465 1.00 0.00 ? ? ? ? ? . 104 VAL A HG23 223 ATOM 1551 N N . HIS A 223 105 . -9.734 15.277 -20.148 1.00 0.00 ? ? ? ? ? . 105 HIS A N 223 ATOM 1552 C CA . HIS A 223 105 . -8.375 14.793 -20.520 1.00 0.00 ? ? ? ? ? . 105 HIS A CA 223 ATOM 1553 C C . HIS A 223 105 . -7.855 13.850 -19.433 1.00 0.00 ? ? ? ? ? . 105 HIS A C 223 ATOM 1554 O O . HIS A 223 105 . -7.050 12.976 -19.688 1.00 0.00 ? ? ? ? ? . 105 HIS A O 223 ATOM 1555 C CB . HIS A 223 105 . -7.428 15.985 -20.657 1.00 0.00 ? ? ? ? ? . 105 HIS A CB 223 ATOM 1556 C CG . HIS A 223 105 . -7.798 16.782 -21.878 1.00 0.00 ? ? ? ? ? . 105 HIS A CG 223 ATOM 1557 N ND1 . HIS A 223 105 . -8.667 17.864 -21.821 1.00 0.00 ? ? ? ? ? . 105 HIS A ND1 223 ATOM 1558 C CD2 . HIS A 223 105 . -7.426 16.669 -23.195 1.00 0.00 ? ? ? ? ? . 105 HIS A CD2 223 ATOM 1559 C CE1 . HIS A 223 105 . -8.787 18.354 -23.069 1.00 0.00 ? ? ? ? ? . 105 HIS A CE1 223 ATOM 1560 N NE2 . HIS A 223 105 . -8.052 17.662 -23.940 1.00 0.00 ? ? ? ? ? . 105 HIS A NE2 223 ATOM 1561 H H . HIS A 223 105 . -9.931 16.237 -20.157 1.00 0.00 ? ? ? ? ? . 105 HIS A H 223 ATOM 1562 H HA . HIS A 223 105 . -8.427 14.263 -21.461 1.00 0.00 ? ? ? ? ? . 105 HIS A HA 223 ATOM 1563 H HB2 . HIS A 223 105 . -7.508 16.611 -19.780 1.00 0.00 ? ? ? ? ? . 105 HIS A HB2 223 ATOM 1564 H HB3 . HIS A 223 105 . -6.413 15.629 -20.755 1.00 0.00 ? ? ? ? ? . 105 HIS A HB3 223 ATOM 1565 H HD2 . HIS A 223 105 . -6.751 15.925 -23.590 1.00 0.00 ? ? ? ? ? . 105 HIS A HD2 223 ATOM 1566 H HE1 . HIS A 223 105 . -9.401 19.202 -23.331 1.00 0.00 ? ? ? ? ? . 105 HIS A HE1 223 ATOM 1567 H HE2 . HIS A 223 105 . -7.969 17.821 -24.904 1.00 0.00 ? ? ? ? ? . 105 HIS A HE2 223 ATOM 1568 N N . CYS A 223 106 . -8.308 14.020 -18.221 1.00 0.00 ? ? ? ? ? . 106 CYS A N 223 ATOM 1569 C CA . CYS A 223 106 . -7.839 13.134 -17.119 1.00 0.00 ? ? ? ? ? . 106 CYS A CA 223 ATOM 1570 C C . CYS A 223 106 . -8.553 11.784 -17.209 1.00 0.00 ? ? ? ? ? . 106 CYS A C 223 ATOM 1571 O O . CYS A 223 106 . -7.986 10.798 -17.637 1.00 0.00 ? ? ? ? ? . 106 CYS A O 223 ATOM 1572 C CB . CYS A 223 106 . -8.152 13.787 -15.771 1.00 0.00 ? ? ? ? ? . 106 CYS A CB 223 ATOM 1573 S SG . CYS A 223 106 . -6.769 14.848 -15.280 1.00 0.00 ? ? ? ? ? . 106 CYS A SG 223 ATOM 1574 H H . CYS A 223 106 . -8.957 14.730 -18.035 1.00 0.00 ? ? ? ? ? . 106 CYS A H 223 ATOM 1575 H HA . CYS A 223 106 . -6.773 12.983 -17.207 1.00 0.00 ? ? ? ? ? . 106 CYS A HA 223 ATOM 1576 H HB2 . CYS A 223 106 . -9.049 14.381 -15.859 1.00 0.00 ? ? ? ? ? . 106 CYS A HB2 223 ATOM 1577 H HB3 . CYS A 223 106 . -8.299 13.020 -15.025 1.00 0.00 ? ? ? ? ? . 106 CYS A HB3 223 ATOM 1578 H HG . CYS A 223 106 . -7.131 15.683 -14.976 1.00 0.00 ? ? ? ? ? . 106 CYS A HG 223 ATOM 1579 N N . SER A 223 107 . -9.795 11.731 -16.810 1.00 0.00 ? ? ? ? ? . 107 SER A N 223 ATOM 1580 C CA . SER A 223 107 . -10.543 10.444 -16.874 1.00 0.00 ? ? ? ? ? . 107 SER A CA 223 ATOM 1581 C C . SER A 223 107 . -10.121 9.670 -18.124 1.00 0.00 ? ? ? ? ? . 107 SER A C 223 ATOM 1582 O O . SER A 223 107 . -10.082 8.456 -18.131 1.00 0.00 ? ? ? ? ? . 107 SER A O 223 ATOM 1583 C CB . SER A 223 107 . -12.045 10.733 -16.931 1.00 0.00 ? ? ? ? ? . 107 SER A CB 223 ATOM 1584 O OG . SER A 223 107 . -12.659 10.252 -15.744 1.00 0.00 ? ? ? ? ? . 107 SER A OG 223 ATOM 1585 H H . SER A 223 107 . -10.234 12.537 -16.468 1.00 0.00 ? ? ? ? ? . 107 SER A H 223 ATOM 1586 H HA . SER A 223 107 . -10.324 9.857 -15.995 1.00 0.00 ? ? ? ? ? . 107 SER A HA 223 ATOM 1587 H HB2 . SER A 223 107 . -12.207 11.794 -17.009 1.00 0.00 ? ? ? ? ? . 107 SER A HB2 223 ATOM 1588 H HB3 . SER A 223 107 . -12.473 10.240 -17.796 1.00 0.00 ? ? ? ? ? . 107 SER A HB3 223 ATOM 1589 H HG . SER A 223 107 . -13.610 10.255 -15.880 1.00 0.00 ? ? ? ? ? . 107 SER A HG 223 ATOM 1590 N N . ILE A 223 108 . -9.803 10.364 -19.183 1.00 0.00 ? ? ? ? ? . 108 ILE A N 223 ATOM 1591 C CA . ILE A 223 108 . -9.384 9.668 -20.432 1.00 0.00 ? ? ? ? ? . 108 ILE A CA 223 ATOM 1592 C C . ILE A 223 108 . -8.028 8.995 -20.209 1.00 0.00 ? ? ? ? ? . 108 ILE A C 223 ATOM 1593 O O . ILE A 223 108 . -7.873 7.807 -20.412 1.00 0.00 ? ? ? ? ? . 108 ILE A O 223 ATOM 1594 C CB . ILE A 223 108 . -9.270 10.688 -21.567 1.00 0.00 ? ? ? ? ? . 108 ILE A CB 223 ATOM 1595 C CG1 . ILE A 223 108 . -10.642 10.876 -22.219 1.00 0.00 ? ? ? ? ? . 108 ILE A CG1 223 ATOM 1596 C CG2 . ILE A 223 108 . -8.273 10.184 -22.613 1.00 0.00 ? ? ? ? ? . 108 ILE A CG2 223 ATOM 1597 C CD1 . ILE A 223 108 . -10.621 12.122 -23.105 1.00 0.00 ? ? ? ? ? . 108 ILE A CD1 223 ATOM 1598 H H . ILE A 223 108 . -9.842 11.343 -19.157 1.00 0.00 ? ? ? ? ? . 108 ILE A H 223 ATOM 1599 H HA . ILE A 223 108 . -10.118 8.920 -20.692 1.00 0.00 ? ? ? ? ? . 108 ILE A HA 223 ATOM 1600 H HB . ILE A 223 108 . -8.926 11.631 -21.168 1.00 0.00 ? ? ? ? ? . 108 ILE A HB 223 ATOM 1601 H HG12 . ILE A 223 108 . -10.876 10.009 -22.820 1.00 0.00 ? ? ? ? ? . 108 ILE A HG12 223 ATOM 1602 H HG13 . ILE A 223 108 . -11.392 10.994 -21.451 1.00 0.00 ? ? ? ? ? . 108 ILE A HG13 223 ATOM 1603 H HG21 . ILE A 223 108 . -7.273 10.471 -22.325 1.00 0.00 ? ? ? ? ? . 108 ILE A HG21 223 ATOM 1604 H HG22 . ILE A 223 108 . -8.510 10.618 -23.573 1.00 0.00 ? ? ? ? ? . 108 ILE A HG22 223 ATOM 1605 H HG23 . ILE A 223 108 . -8.334 9.108 -22.679 1.00 0.00 ? ? ? ? ? . 108 ILE A HG23 223 ATOM 1606 H HD11 . ILE A 223 108 . -9.959 11.958 -23.943 1.00 0.00 ? ? ? ? ? . 108 ILE A HD11 223 ATOM 1607 H HD12 . ILE A 223 108 . -10.269 12.966 -22.530 1.00 0.00 ? ? ? ? ? . 108 ILE A HD12 223 ATOM 1608 H HD13 . ILE A 223 108 . -11.617 12.323 -23.467 1.00 0.00 ? ? ? ? ? . 108 ILE A HD13 223 ATOM 1609 N N . LEU A 223 109 . -7.045 9.744 -19.788 1.00 0.00 ? ? ? ? ? . 109 LEU A N 223 ATOM 1610 C CA . LEU A 223 109 . -5.702 9.147 -19.550 1.00 0.00 ? ? ? ? ? . 109 LEU A CA 223 ATOM 1611 C C . LEU A 223 109 . -5.816 8.048 -18.492 1.00 0.00 ? ? ? ? ? . 109 LEU A C 223 ATOM 1612 O O . LEU A 223 109 . -4.961 7.193 -18.375 1.00 0.00 ? ? ? ? ? . 109 LEU A O 223 ATOM 1613 C CB . LEU A 223 109 . -4.742 10.231 -19.056 1.00 0.00 ? ? ? ? ? . 109 LEU A CB 223 ATOM 1614 C CG . LEU A 223 109 . -3.955 10.796 -20.239 1.00 0.00 ? ? ? ? ? . 109 LEU A CG 223 ATOM 1615 C CD1 . LEU A 223 109 . -4.923 11.183 -21.359 1.00 0.00 ? ? ? ? ? . 109 LEU A CD1 223 ATOM 1616 C CD2 . LEU A 223 109 . -3.177 12.034 -19.788 1.00 0.00 ? ? ? ? ? . 109 LEU A CD2 223 ATOM 1617 H H . LEU A 223 109 . -7.192 10.700 -19.629 1.00 0.00 ? ? ? ? ? . 109 LEU A H 223 ATOM 1618 H HA . LEU A 223 109 . -5.325 8.723 -20.470 1.00 0.00 ? ? ? ? ? . 109 LEU A HA 223 ATOM 1619 H HB2 . LEU A 223 109 . -5.307 11.023 -18.587 1.00 0.00 ? ? ? ? ? . 109 LEU A HB2 223 ATOM 1620 H HB3 . LEU A 223 109 . -4.056 9.805 -18.340 1.00 0.00 ? ? ? ? ? . 109 LEU A HB3 223 ATOM 1621 H HG . LEU A 223 109 . -3.266 10.047 -20.604 1.00 0.00 ? ? ? ? ? . 109 LEU A HG 223 ATOM 1622 H HD11 . LEU A 223 109 . -5.862 11.499 -20.928 1.00 0.00 ? ? ? ? ? . 109 LEU A HD11 223 ATOM 1623 H HD12 . LEU A 223 109 . -5.090 10.331 -22.000 1.00 0.00 ? ? ? ? ? . 109 LEU A HD12 223 ATOM 1624 H HD13 . LEU A 223 109 . -4.501 11.993 -21.935 1.00 0.00 ? ? ? ? ? . 109 LEU A HD13 223 ATOM 1625 H HD21 . LEU A 223 109 . -2.189 11.741 -19.466 1.00 0.00 ? ? ? ? ? . 109 LEU A HD21 223 ATOM 1626 H HD22 . LEU A 223 109 . -3.697 12.506 -18.968 1.00 0.00 ? ? ? ? ? . 109 LEU A HD22 223 ATOM 1627 H HD23 . LEU A 223 109 . -3.096 12.729 -20.611 1.00 0.00 ? ? ? ? ? . 109 LEU A HD23 223 ATOM 1628 N N . ALA A 223 110 . -6.866 8.067 -17.716 1.00 0.00 ? ? ? ? ? . 110 ALA A N 223 ATOM 1629 C CA . ALA A 223 110 . -7.037 7.026 -16.664 1.00 0.00 ? ? ? ? ? . 110 ALA A CA 223 ATOM 1630 C C . ALA A 223 110 . -7.397 5.691 -17.319 1.00 0.00 ? ? ? ? ? . 110 ALA A C 223 ATOM 1631 O O . ALA A 223 110 . -6.649 4.736 -17.253 1.00 0.00 ? ? ? ? ? . 110 ALA A O 223 ATOM 1632 C CB . ALA A 223 110 . -8.157 7.445 -15.709 1.00 0.00 ? ? ? ? ? . 110 ALA A CB 223 ATOM 1633 H H . ALA A 223 110 . -7.543 8.767 -17.826 1.00 0.00 ? ? ? ? ? . 110 ALA A H 223 ATOM 1634 H HA . ALA A 223 110 . -6.115 6.919 -16.112 1.00 0.00 ? ? ? ? ? . 110 ALA A HA 223 ATOM 1635 H HB1 . ALA A 223 110 . -8.792 6.595 -15.504 1.00 0.00 ? ? ? ? ? . 110 ALA A HB1 223 ATOM 1636 H HB2 . ALA A 223 110 . -8.742 8.230 -16.163 1.00 0.00 ? ? ? ? ? . 110 ALA A HB2 223 ATOM 1637 H HB3 . ALA A 223 110 . -7.727 7.803 -14.785 1.00 0.00 ? ? ? ? ? . 110 ALA A HB3 223 ATOM 1638 N N . GLU A 223 111 . -8.538 5.615 -17.949 1.00 0.00 ? ? ? ? ? . 111 GLU A N 223 ATOM 1639 C CA . GLU A 223 111 . -8.941 4.339 -18.606 1.00 0.00 ? ? ? ? ? . 111 GLU A CA 223 ATOM 1640 C C . GLU A 223 111 . -7.965 4.020 -19.740 1.00 0.00 ? ? ? ? ? . 111 GLU A C 223 ATOM 1641 O O . GLU A 223 111 . -7.505 2.904 -19.879 1.00 0.00 ? ? ? ? ? . 111 GLU A O 223 ATOM 1642 C CB . GLU A 223 111 . -10.356 4.479 -19.171 1.00 0.00 ? ? ? ? ? . 111 GLU A CB 223 ATOM 1643 C CG . GLU A 223 111 . -10.693 3.249 -20.016 1.00 0.00 ? ? ? ? ? . 111 GLU A CG 223 ATOM 1644 C CD . GLU A 223 111 . -10.564 3.595 -21.500 1.00 0.00 ? ? ? ? ? . 111 GLU A CD 223 ATOM 1645 O OE1 . GLU A 223 111 . -11.248 4.506 -21.936 1.00 0.00 ? ? ? ? ? . 111 GLU A OE1 223 ATOM 1646 O OE2 . GLU A 223 111 . -9.785 2.944 -22.174 1.00 0.00 ? ? ? ? ? . 111 GLU A OE2 223 ATOM 1647 H H . GLU A 223 111 . -9.128 6.396 -17.991 1.00 0.00 ? ? ? ? ? . 111 GLU A H 223 ATOM 1648 H HA . GLU A 223 111 . -8.922 3.540 -17.879 1.00 0.00 ? ? ? ? ? . 111 GLU A HA 223 ATOM 1649 H HB2 . GLU A 223 111 . -11.062 4.564 -18.357 1.00 0.00 ? ? ? ? ? . 111 GLU A HB2 223 ATOM 1650 H HB3 . GLU A 223 111 . -10.411 5.363 -19.789 1.00 0.00 ? ? ? ? ? . 111 GLU A HB3 223 ATOM 1651 H HG2 . GLU A 223 111 . -10.011 2.446 -19.771 1.00 0.00 ? ? ? ? ? . 111 GLU A HG2 223 ATOM 1652 H HG3 . GLU A 223 111 . -11.705 2.935 -19.808 1.00 0.00 ? ? ? ? ? . 111 GLU A HG3 223 ATOM 1653 N N . ASP A 223 112 . -7.642 4.990 -20.552 1.00 0.00 ? ? ? ? ? . 112 ASP A N 223 ATOM 1654 C CA . ASP A 223 112 . -6.692 4.735 -21.671 1.00 0.00 ? ? ? ? ? . 112 ASP A CA 223 ATOM 1655 C C . ASP A 223 112 . -5.401 4.137 -21.109 1.00 0.00 ? ? ? ? ? . 112 ASP A C 223 ATOM 1656 O O . ASP A 223 112 . -4.778 3.291 -21.720 1.00 0.00 ? ? ? ? ? . 112 ASP A O 223 ATOM 1657 C CB . ASP A 223 112 . -6.377 6.052 -22.383 1.00 0.00 ? ? ? ? ? . 112 ASP A CB 223 ATOM 1658 C CG . ASP A 223 112 . -6.198 5.793 -23.881 1.00 0.00 ? ? ? ? ? . 112 ASP A CG 223 ATOM 1659 O OD1 . ASP A 223 112 . -5.770 4.704 -24.227 1.00 0.00 ? ? ? ? ? . 112 ASP A OD1 223 ATOM 1660 O OD2 . ASP A 223 112 . -6.491 6.688 -24.657 1.00 0.00 ? ? ? ? ? . 112 ASP A OD2 223 ATOM 1661 H H . ASP A 223 112 . -8.021 5.884 -20.423 1.00 0.00 ? ? ? ? ? . 112 ASP A H 223 ATOM 1662 H HA . ASP A 223 112 . -7.137 4.043 -22.371 1.00 0.00 ? ? ? ? ? . 112 ASP A HA 223 ATOM 1663 H HB2 . ASP A 223 112 . -7.191 6.747 -22.232 1.00 0.00 ? ? ? ? ? . 112 ASP A HB2 223 ATOM 1664 H HB3 . ASP A 223 112 . -5.467 6.470 -21.982 1.00 0.00 ? ? ? ? ? . 112 ASP A HB3 223 ATOM 1665 N N . ALA A 223 113 . -4.997 4.569 -19.947 1.00 0.00 ? ? ? ? ? . 113 ALA A N 223 ATOM 1666 C CA . ALA A 223 113 . -3.749 4.027 -19.341 1.00 0.00 ? ? ? ? ? . 113 ALA A CA 223 ATOM 1667 C C . ALA A 223 113 . -3.923 2.531 -19.069 1.00 0.00 ? ? ? ? ? . 113 ALA A C 223 ATOM 1668 O O . ALA A 223 113 . -3.169 1.711 -19.554 1.00 0.00 ? ? ? ? ? . 113 ALA A O 223 ATOM 1669 C CB . ALA A 223 113 . -3.463 4.754 -18.025 1.00 0.00 ? ? ? ? ? . 113 ALA A CB 223 ATOM 1670 H H . ALA A 223 113 . -5.516 5.250 -19.470 1.00 0.00 ? ? ? ? ? . 113 ALA A H 223 ATOM 1671 H HA . ALA A 223 113 . -2.923 4.176 -20.022 1.00 0.00 ? ? ? ? ? . 113 ALA A HA 223 ATOM 1672 H HB1 . ALA A 223 113 . -2.736 5.534 -18.196 1.00 0.00 ? ? ? ? ? . 113 ALA A HB1 223 ATOM 1673 H HB2 . ALA A 223 113 . -3.074 4.051 -17.303 1.00 0.00 ? ? ? ? ? . 113 ALA A HB2 223 ATOM 1674 H HB3 . ALA A 223 113 . -4.376 5.188 -17.648 1.00 0.00 ? ? ? ? ? . 113 ALA A HB3 223 ATOM 1675 N N . ILE A 223 114 . -4.910 2.170 -18.295 1.00 0.00 ? ? ? ? ? . 114 ILE A N 223 ATOM 1676 C CA . ILE A 223 114 . -5.129 0.727 -17.993 1.00 0.00 ? ? ? ? ? . 114 ILE A CA 223 ATOM 1677 C C . ILE A 223 114 . -5.134 -0.071 -19.299 1.00 0.00 ? ? ? ? ? . 114 ILE A C 223 ATOM 1678 O O . ILE A 223 114 . -4.658 -1.188 -19.358 1.00 0.00 ? ? ? ? ? . 114 ILE A O 223 ATOM 1679 C CB . ILE A 223 114 . -6.471 0.557 -17.266 1.00 0.00 ? ? ? ? ? . 114 ILE A CB 223 ATOM 1680 C CG1 . ILE A 223 114 . -6.344 -0.544 -16.209 1.00 0.00 ? ? ? ? ? . 114 ILE A CG1 223 ATOM 1681 C CG2 . ILE A 223 114 . -7.568 0.174 -18.265 1.00 0.00 ? ? ? ? ? . 114 ILE A CG2 223 ATOM 1682 C CD1 . ILE A 223 114 . -6.032 0.086 -14.852 1.00 0.00 ? ? ? ? ? . 114 ILE A CD1 223 ATOM 1683 H H . ILE A 223 114 . -5.507 2.848 -17.913 1.00 0.00 ? ? ? ? ? . 114 ILE A H 223 ATOM 1684 H HA . ILE A 223 114 . -4.330 0.373 -17.359 1.00 0.00 ? ? ? ? ? . 114 ILE A HA 223 ATOM 1685 H HB . ILE A 223 114 . -6.737 1.487 -16.784 1.00 0.00 ? ? ? ? ? . 114 ILE A HB 223 ATOM 1686 H HG12 . ILE A 223 114 . -7.273 -1.092 -16.148 1.00 0.00 ? ? ? ? ? . 114 ILE A HG12 223 ATOM 1687 H HG13 . ILE A 223 114 . -5.547 -1.219 -16.483 1.00 0.00 ? ? ? ? ? . 114 ILE A HG13 223 ATOM 1688 H HG21 . ILE A 223 114 . -8.533 0.253 -17.787 1.00 0.00 ? ? ? ? ? . 114 ILE A HG21 223 ATOM 1689 H HG22 . ILE A 223 114 . -7.412 -0.841 -18.598 1.00 0.00 ? ? ? ? ? . 114 ILE A HG22 223 ATOM 1690 H HG23 . ILE A 223 114 . -7.531 0.841 -19.112 1.00 0.00 ? ? ? ? ? . 114 ILE A HG23 223 ATOM 1691 H HD11 . ILE A 223 114 . -5.314 0.883 -14.980 1.00 0.00 ? ? ? ? ? . 114 ILE A HD11 223 ATOM 1692 H HD12 . ILE A 223 114 . -5.623 -0.664 -14.191 1.00 0.00 ? ? ? ? ? . 114 ILE A HD12 223 ATOM 1693 H HD13 . ILE A 223 114 . -6.940 0.486 -14.423 1.00 0.00 ? ? ? ? ? . 114 ILE A HD13 223 ATOM 1694 N N . LYS A 223 115 . -5.669 0.494 -20.347 1.00 0.00 ? ? ? ? ? . 115 LYS A N 223 ATOM 1695 C CA . LYS A 223 115 . -5.705 -0.229 -21.649 1.00 0.00 ? ? ? ? ? . 115 LYS A CA 223 ATOM 1696 C C . LYS A 223 115 . -4.276 -0.480 -22.133 1.00 0.00 ? ? ? ? ? . 115 LYS A C 223 ATOM 1697 O O . LYS A 223 115 . -3.973 -1.516 -22.691 1.00 0.00 ? ? ? ? ? . 115 LYS A O 223 ATOM 1698 C CB . LYS A 223 115 . -6.453 0.619 -22.681 1.00 0.00 ? ? ? ? ? . 115 LYS A CB 223 ATOM 1699 C CG . LYS A 223 115 . -6.318 -0.020 -24.065 1.00 0.00 ? ? ? ? ? . 115 LYS A CG 223 ATOM 1700 C CD . LYS A 223 115 . -7.707 -0.212 -24.679 1.00 0.00 ? ? ? ? ? . 115 LYS A CD 223 ATOM 1701 C CE . LYS A 223 115 . -7.579 -0.341 -26.198 1.00 0.00 ? ? ? ? ? . 115 LYS A CE 223 ATOM 1702 N NZ . LYS A 223 115 . -8.634 -1.260 -26.709 1.00 0.00 ? ? ? ? ? . 115 LYS A NZ 223 ATOM 1703 H H . LYS A 223 115 . -6.046 1.395 -20.277 1.00 0.00 ? ? ? ? ? . 115 LYS A H 223 ATOM 1704 H HA . LYS A 223 115 . -6.213 -1.174 -21.522 1.00 0.00 ? ? ? ? ? . 115 LYS A HA 223 ATOM 1705 H HB2 . LYS A 223 115 . -7.497 0.675 -22.409 1.00 0.00 ? ? ? ? ? . 115 LYS A HB2 223 ATOM 1706 H HB3 . LYS A 223 115 . -6.032 1.613 -22.703 1.00 0.00 ? ? ? ? ? . 115 LYS A HB3 223 ATOM 1707 H HG2 . LYS A 223 115 . -5.729 0.624 -24.702 1.00 0.00 ? ? ? ? ? . 115 LYS A HG2 223 ATOM 1708 H HG3 . LYS A 223 115 . -5.831 -0.980 -23.974 1.00 0.00 ? ? ? ? ? . 115 LYS A HG3 223 ATOM 1709 H HD2 . LYS A 223 115 . -8.156 -1.109 -24.277 1.00 0.00 ? ? ? ? ? . 115 LYS A HD2 223 ATOM 1710 H HD3 . LYS A 223 115 . -8.327 0.638 -24.443 1.00 0.00 ? ? ? ? ? . 115 LYS A HD3 223 ATOM 1711 H HE2 . LYS A 223 115 . -7.698 0.632 -26.653 1.00 0.00 ? ? ? ? ? . 115 LYS A HE2 223 ATOM 1712 H HE3 . LYS A 223 115 . -6.605 -0.738 -26.445 1.00 0.00 ? ? ? ? ? . 115 LYS A HE3 223 ATOM 1713 H HZ1 . LYS A 223 115 . -8.673 -1.202 -27.745 1.00 0.00 ? ? ? ? ? . 115 LYS A HZ1 223 ATOM 1714 H HZ2 . LYS A 223 115 . -9.555 -0.985 -26.310 1.00 0.00 ? ? ? ? ? . 115 LYS A HZ2 223 ATOM 1715 H HZ3 . LYS A 223 115 . -8.411 -2.235 -26.426 1.00 0.00 ? ? ? ? ? . 115 LYS A HZ3 223 ATOM 1716 N N . ALA A 223 116 . -3.394 0.459 -21.924 1.00 0.00 ? ? ? ? ? . 116 ALA A N 223 ATOM 1717 C CA . ALA A 223 116 . -1.987 0.272 -22.373 1.00 0.00 ? ? ? ? ? . 116 ALA A CA 223 ATOM 1718 C C . ALA A 223 116 . -1.318 -0.807 -21.518 1.00 0.00 ? ? ? ? ? . 116 ALA A C 223 ATOM 1719 O O . ALA A 223 116 . -0.595 -1.648 -22.016 1.00 0.00 ? ? ? ? ? . 116 ALA A O 223 ATOM 1720 C CB . ALA A 223 116 . -1.223 1.588 -22.223 1.00 0.00 ? ? ? ? ? . 116 ALA A CB 223 ATOM 1721 H H . ALA A 223 116 . -3.659 1.288 -21.472 1.00 0.00 ? ? ? ? ? . 116 ALA A H 223 ATOM 1722 H HA . ALA A 223 116 . -1.977 -0.034 -23.409 1.00 0.00 ? ? ? ? ? . 116 ALA A HA 223 ATOM 1723 H HB1 . ALA A 223 116 . -1.333 1.956 -21.213 1.00 0.00 ? ? ? ? ? . 116 ALA A HB1 223 ATOM 1724 H HB2 . ALA A 223 116 . -1.619 2.315 -22.916 1.00 0.00 ? ? ? ? ? . 116 ALA A HB2 223 ATOM 1725 H HB3 . ALA A 223 116 . -0.176 1.424 -22.432 1.00 0.00 ? ? ? ? ? . 116 ALA A HB3 223 ATOM 1726 N N . ALA A 223 117 . -1.551 -0.790 -20.234 1.00 0.00 ? ? ? ? ? . 117 ALA A N 223 ATOM 1727 C CA . ALA A 223 117 . -0.926 -1.813 -19.350 1.00 0.00 ? ? ? ? ? . 117 ALA A CA 223 ATOM 1728 C C . ALA A 223 117 . -1.421 -3.205 -19.750 1.00 0.00 ? ? ? ? ? . 117 ALA A C 223 ATOM 1729 O O . ALA A 223 117 . -0.672 -4.161 -19.759 1.00 0.00 ? ? ? ? ? . 117 ALA A O 223 ATOM 1730 C CB . ALA A 223 117 . -1.314 -1.535 -17.896 1.00 0.00 ? ? ? ? ? . 117 ALA A CB 223 ATOM 1731 H H . ALA A 223 117 . -2.136 -0.103 -19.850 1.00 0.00 ? ? ? ? ? . 117 ALA A H 223 ATOM 1732 H HA . ALA A 223 117 . 0.147 -1.770 -19.451 1.00 0.00 ? ? ? ? ? . 117 ALA A HA 223 ATOM 1733 H HB1 . ALA A 223 117 . -0.769 -2.203 -17.246 1.00 0.00 ? ? ? ? ? . 117 ALA A HB1 223 ATOM 1734 H HB2 . ALA A 223 117 . -2.374 -1.693 -17.769 1.00 0.00 ? ? ? ? ? . 117 ALA A HB2 223 ATOM 1735 H HB3 . ALA A 223 117 . -1.070 -0.512 -17.648 1.00 0.00 ? ? ? ? ? . 117 ALA A HB3 223 ATOM 1736 N N . ILE A 223 118 . -2.677 -3.326 -20.080 1.00 0.00 ? ? ? ? ? . 118 ILE A N 223 ATOM 1737 C CA . ILE A 223 118 . -3.217 -4.657 -20.478 1.00 0.00 ? ? ? ? ? . 118 ILE A CA 223 ATOM 1738 C C . ILE A 223 118 . -2.654 -5.049 -21.846 1.00 0.00 ? ? ? ? ? . 118 ILE A C 223 ATOM 1739 O O . ILE A 223 118 . -2.298 -6.187 -22.078 1.00 0.00 ? ? ? ? ? . 118 ILE A O 223 ATOM 1740 C CB . ILE A 223 118 . -4.743 -4.586 -20.555 1.00 0.00 ? ? ? ? ? . 118 ILE A CB 223 ATOM 1741 C CG1 . ILE A 223 118 . -5.311 -4.337 -19.155 1.00 0.00 ? ? ? ? ? . 118 ILE A CG1 223 ATOM 1742 C CG2 . ILE A 223 118 . -5.290 -5.907 -21.098 1.00 0.00 ? ? ? ? ? . 118 ILE A CG2 223 ATOM 1743 C CD1 . ILE A 223 118 . -6.815 -4.075 -19.254 1.00 0.00 ? ? ? ? ? . 118 ILE A CD1 223 ATOM 1744 H H . ILE A 223 118 . -3.266 -2.543 -20.067 1.00 0.00 ? ? ? ? ? . 118 ILE A H 223 ATOM 1745 H HA . ILE A 223 118 . -2.928 -5.395 -19.745 1.00 0.00 ? ? ? ? ? . 118 ILE A HA 223 ATOM 1746 H HB . ILE A 223 118 . -5.033 -3.779 -21.213 1.00 0.00 ? ? ? ? ? . 118 ILE A HB 223 ATOM 1747 H HG12 . ILE A 223 118 . -5.135 -5.205 -18.536 1.00 0.00 ? ? ? ? ? . 118 ILE A HG12 223 ATOM 1748 H HG13 . ILE A 223 118 . -4.827 -3.477 -18.718 1.00 0.00 ? ? ? ? ? . 118 ILE A HG13 223 ATOM 1749 H HG21 . ILE A 223 118 . -5.336 -5.860 -22.176 1.00 0.00 ? ? ? ? ? . 118 ILE A HG21 223 ATOM 1750 H HG22 . ILE A 223 118 . -6.280 -6.076 -20.701 1.00 0.00 ? ? ? ? ? . 118 ILE A HG22 223 ATOM 1751 H HG23 . ILE A 223 118 . -4.639 -6.715 -20.800 1.00 0.00 ? ? ? ? ? . 118 ILE A HG23 223 ATOM 1752 H HD11 . ILE A 223 118 . -7.047 -3.672 -20.228 1.00 0.00 ? ? ? ? ? . 118 ILE A HD11 223 ATOM 1753 H HD12 . ILE A 223 118 . -7.108 -3.366 -18.493 1.00 0.00 ? ? ? ? ? . 118 ILE A HD12 223 ATOM 1754 H HD13 . ILE A 223 118 . -7.352 -5.001 -19.109 1.00 0.00 ? ? ? ? ? . 118 ILE A HD13 223 ATOM 1755 N N . ALA A 223 119 . -2.568 -4.114 -22.753 1.00 0.00 ? ? ? ? ? . 119 ALA A N 223 ATOM 1756 C CA . ALA A 223 119 . -2.026 -4.434 -24.103 1.00 0.00 ? ? ? ? ? . 119 ALA A CA 223 ATOM 1757 C C . ALA A 223 119 . -0.577 -4.908 -23.972 1.00 0.00 ? ? ? ? ? . 119 ALA A C 223 ATOM 1758 O O . ALA A 223 119 . -0.184 -5.901 -24.550 1.00 0.00 ? ? ? ? ? . 119 ALA A O 223 ATOM 1759 C CB . ALA A 223 119 . -2.077 -3.183 -24.983 1.00 0.00 ? ? ? ? ? . 119 ALA A CB 223 ATOM 1760 H H . ALA A 223 119 . -2.859 -3.202 -22.545 1.00 0.00 ? ? ? ? ? . 119 ALA A H 223 ATOM 1761 H HA . ALA A 223 119 . -2.621 -5.216 -24.554 1.00 0.00 ? ? ? ? ? . 119 ALA A HA 223 ATOM 1762 H HB1 . ALA A 223 119 . -2.653 -2.417 -24.486 1.00 0.00 ? ? ? ? ? . 119 ALA A HB1 223 ATOM 1763 H HB2 . ALA A 223 119 . -2.539 -3.427 -25.928 1.00 0.00 ? ? ? ? ? . 119 ALA A HB2 223 ATOM 1764 H HB3 . ALA A 223 119 . -1.073 -2.825 -25.156 1.00 0.00 ? ? ? ? ? . 119 ALA A HB3 223 ATOM 1765 N N . ASP A 223 120 . 0.219 -4.205 -23.213 1.00 0.00 ? ? ? ? ? . 120 ASP A N 223 ATOM 1766 C CA . ASP A 223 120 . 1.642 -4.615 -23.047 1.00 0.00 ? ? ? ? ? . 120 ASP A CA 223 ATOM 1767 C C . ASP A 223 120 . 1.717 -5.825 -22.114 1.00 0.00 ? ? ? ? ? . 120 ASP A C 223 ATOM 1768 O O . ASP A 223 120 . 2.714 -6.517 -22.059 1.00 0.00 ? ? ? ? ? . 120 ASP A O 223 ATOM 1769 C CB . ASP A 223 120 . 2.439 -3.456 -22.443 1.00 0.00 ? ? ? ? ? . 120 ASP A CB 223 ATOM 1770 C CG . ASP A 223 120 . 3.037 -2.608 -23.567 1.00 0.00 ? ? ? ? ? . 120 ASP A CG 223 ATOM 1771 O OD1 . ASP A 223 120 . 3.827 -3.140 -24.328 1.00 0.00 ? ? ? ? ? . 120 ASP A OD1 223 ATOM 1772 O OD2 . ASP A 223 120 . 2.693 -1.440 -23.648 1.00 0.00 ? ? ? ? ? . 120 ASP A OD2 223 ATOM 1773 H H . ASP A 223 120 . -0.118 -3.407 -22.755 1.00 0.00 ? ? ? ? ? . 120 ASP A H 223 ATOM 1774 H HA . ASP A 223 120 . 2.057 -4.875 -24.008 1.00 0.00 ? ? ? ? ? . 120 ASP A HA 223 ATOM 1775 H HB2 . ASP A 223 120 . 1.783 -2.845 -21.838 1.00 0.00 ? ? ? ? ? . 120 ASP A HB2 223 ATOM 1776 H HB3 . ASP A 223 120 . 3.235 -3.848 -21.828 1.00 0.00 ? ? ? ? ? . 120 ASP A HB3 223 ATOM 1777 N N . TYR A 223 121 . 0.669 -6.089 -21.381 1.00 0.00 ? ? ? ? ? . 121 TYR A N 223 ATOM 1778 C CA . TYR A 223 121 . 0.683 -7.255 -20.454 1.00 0.00 ? ? ? ? ? . 121 TYR A CA 223 ATOM 1779 C C . TYR A 223 121 . 0.422 -8.539 -21.245 1.00 0.00 ? ? ? ? ? . 121 TYR A C 223 ATOM 1780 O O . TYR A 223 121 . 0.908 -9.598 -20.904 1.00 0.00 ? ? ? ? ? . 121 TYR A O 223 ATOM 1781 C CB . TYR A 223 121 . -0.406 -7.079 -19.394 1.00 0.00 ? ? ? ? ? . 121 TYR A CB 223 ATOM 1782 C CG . TYR A 223 121 . -0.421 -8.285 -18.486 1.00 0.00 ? ? ? ? ? . 121 TYR A CG 223 ATOM 1783 C CD1 . TYR A 223 121 . 0.536 -8.412 -17.473 1.00 0.00 ? ? ? ? ? . 121 TYR A CD1 223 ATOM 1784 C CD2 . TYR A 223 121 . -1.391 -9.280 -18.661 1.00 0.00 ? ? ? ? ? . 121 TYR A CD2 223 ATOM 1785 C CE1 . TYR A 223 121 . 0.523 -9.531 -16.632 1.00 0.00 ? ? ? ? ? . 121 TYR A CE1 223 ATOM 1786 C CE2 . TYR A 223 121 . -1.405 -10.400 -17.821 1.00 0.00 ? ? ? ? ? . 121 TYR A CE2 223 ATOM 1787 C CZ . TYR A 223 121 . -0.448 -10.526 -16.807 1.00 0.00 ? ? ? ? ? . 121 TYR A CZ 223 ATOM 1788 O OH . TYR A 223 121 . -0.461 -11.630 -15.980 1.00 0.00 ? ? ? ? ? . 121 TYR A OH 223 ATOM 1789 H H . TYR A 223 121 . -0.126 -5.518 -21.440 1.00 0.00 ? ? ? ? ? . 121 TYR A H 223 ATOM 1790 H HA . TYR A 223 121 . 1.647 -7.319 -19.971 1.00 0.00 ? ? ? ? ? . 121 TYR A HA 223 ATOM 1791 H HB2 . TYR A 223 121 . -0.201 -6.193 -18.811 1.00 0.00 ? ? ? ? ? . 121 TYR A HB2 223 ATOM 1792 H HB3 . TYR A 223 121 . -1.366 -6.980 -19.876 1.00 0.00 ? ? ? ? ? . 121 TYR A HB3 223 ATOM 1793 H HD1 . TYR A 223 121 . 1.285 -7.645 -17.339 1.00 0.00 ? ? ? ? ? . 121 TYR A HD1 223 ATOM 1794 H HD2 . TYR A 223 121 . -2.130 -9.183 -19.442 1.00 0.00 ? ? ? ? ? . 121 TYR A HD2 223 ATOM 1795 H HE1 . TYR A 223 121 . 1.261 -9.628 -15.850 1.00 0.00 ? ? ? ? ? . 121 TYR A HE1 223 ATOM 1796 H HE2 . TYR A 223 121 . -2.153 -11.167 -17.954 1.00 0.00 ? ? ? ? ? . 121 TYR A HE2 223 ATOM 1797 H HH . TYR A 223 121 . -0.063 -11.378 -15.143 1.00 0.00 ? ? ? ? ? . 121 TYR A HH 223 ATOM 1798 N N . LYS A 223 122 . -0.347 -8.453 -22.297 1.00 0.00 ? ? ? ? ? . 122 LYS A N 223 ATOM 1799 C CA . LYS A 223 122 . -0.642 -9.669 -23.105 1.00 0.00 ? ? ? ? ? . 122 LYS A CA 223 ATOM 1800 C C . LYS A 223 122 . 0.348 -9.762 -24.269 1.00 0.00 ? ? ? ? ? . 122 LYS A C 223 ATOM 1801 O O . LYS A 223 122 . 0.584 -10.822 -24.813 1.00 0.00 ? ? ? ? ? . 122 LYS A O 223 ATOM 1802 C CB . LYS A 223 122 . -2.068 -9.584 -23.654 1.00 0.00 ? ? ? ? ? . 122 LYS A CB 223 ATOM 1803 C CG . LYS A 223 122 . -2.452 -10.922 -24.288 1.00 0.00 ? ? ? ? ? . 122 LYS A CG 223 ATOM 1804 C CD . LYS A 223 122 . -3.917 -11.233 -23.977 1.00 0.00 ? ? ? ? ? . 122 LYS A CD 223 ATOM 1805 C CE . LYS A 223 122 . -4.373 -12.434 -24.808 1.00 0.00 ? ? ? ? ? . 122 LYS A CE 223 ATOM 1806 N NZ . LYS A 223 122 . -5.826 -12.304 -25.113 1.00 0.00 ? ? ? ? ? . 122 LYS A NZ 223 ATOM 1807 H H . LYS A 223 122 . -0.731 -7.589 -22.554 1.00 0.00 ? ? ? ? ? . 122 LYS A H 223 ATOM 1808 H HA . LYS A 223 122 . -0.547 -10.547 -22.483 1.00 0.00 ? ? ? ? ? . 122 LYS A HA 223 ATOM 1809 H HB2 . LYS A 223 122 . -2.750 -9.357 -22.848 1.00 0.00 ? ? ? ? ? . 122 LYS A HB2 223 ATOM 1810 H HB3 . LYS A 223 122 . -2.121 -8.807 -24.401 1.00 0.00 ? ? ? ? ? . 122 LYS A HB3 223 ATOM 1811 H HG2 . LYS A 223 122 . -2.314 -10.866 -25.359 1.00 0.00 ? ? ? ? ? . 122 LYS A HG2 223 ATOM 1812 H HG3 . LYS A 223 122 . -1.827 -11.705 -23.885 1.00 0.00 ? ? ? ? ? . 122 LYS A HG3 223 ATOM 1813 H HD2 . LYS A 223 122 . -4.020 -11.461 -22.925 1.00 0.00 ? ? ? ? ? . 122 LYS A HD2 223 ATOM 1814 H HD3 . LYS A 223 122 . -4.526 -10.377 -24.221 1.00 0.00 ? ? ? ? ? . 122 LYS A HD3 223 ATOM 1815 H HE2 . LYS A 223 122 . -3.812 -12.467 -25.729 1.00 0.00 ? ? ? ? ? . 122 LYS A HE2 223 ATOM 1816 H HE3 . LYS A 223 122 . -4.202 -13.342 -24.250 1.00 0.00 ? ? ? ? ? . 122 LYS A HE3 223 ATOM 1817 H HZ1 . LYS A 223 122 . -5.946 -11.900 -26.063 1.00 0.00 ? ? ? ? ? . 122 LYS A HZ1 223 ATOM 1818 H HZ2 . LYS A 223 122 . -6.273 -11.679 -24.410 1.00 0.00 ? ? ? ? ? . 122 LYS A HZ2 223 ATOM 1819 H HZ3 . LYS A 223 122 . -6.274 -13.242 -25.078 1.00 0.00 ? ? ? ? ? . 122 LYS A HZ3 223 ATOM 1820 N N . ALA A 223 123 . 0.929 -8.659 -24.655 1.00 0.00 ? ? ? ? ? . 123 ALA A N 223 ATOM 1821 C CA . ALA A 223 123 . 1.901 -8.684 -25.784 1.00 0.00 ? ? ? ? ? . 123 ALA A CA 223 ATOM 1822 C C . ALA A 223 123 . 3.234 -9.258 -25.297 1.00 0.00 ? ? ? ? ? . 123 ALA A C 223 ATOM 1823 O O . ALA A 223 123 . 4.060 -9.681 -26.080 1.00 0.00 ? ? ? ? ? . 123 ALA A O 223 ATOM 1824 C CB . ALA A 223 123 . 2.117 -7.262 -26.303 1.00 0.00 ? ? ? ? ? . 123 ALA A CB 223 ATOM 1825 H H . ALA A 223 123 . 0.725 -7.814 -24.203 1.00 0.00 ? ? ? ? ? . 123 ALA A H 223 ATOM 1826 H HA . ALA A 223 123 . 1.513 -9.303 -26.579 1.00 0.00 ? ? ? ? ? . 123 ALA A HA 223 ATOM 1827 H HB1 . ALA A 223 123 . 2.106 -6.570 -25.474 1.00 0.00 ? ? ? ? ? . 123 ALA A HB1 223 ATOM 1828 H HB2 . ALA A 223 123 . 1.328 -7.008 -26.996 1.00 0.00 ? ? ? ? ? . 123 ALA A HB2 223 ATOM 1829 H HB3 . ALA A 223 123 . 3.071 -7.203 -26.807 1.00 0.00 ? ? ? ? ? . 123 ALA A HB3 223 ATOM 1830 N N . LYS A 223 124 . 3.451 -9.273 -24.010 1.00 0.00 ? ? ? ? ? . 124 LYS A N 223 ATOM 1831 C CA . LYS A 223 124 . 4.731 -9.818 -23.477 1.00 0.00 ? ? ? ? ? . 124 LYS A CA 223 ATOM 1832 C C . LYS A 223 124 . 4.742 -11.341 -23.632 1.00 0.00 ? ? ? ? ? . 124 LYS A C 223 ATOM 1833 O O . LYS A 223 124 . 5.499 -12.035 -22.984 1.00 0.00 ? ? ? ? ? . 124 LYS A O 223 ATOM 1834 C CB . LYS A 223 124 . 4.861 -9.454 -21.995 1.00 0.00 ? ? ? ? ? . 124 LYS A CB 223 ATOM 1835 C CG . LYS A 223 124 . 6.165 -8.683 -21.769 1.00 0.00 ? ? ? ? ? . 124 LYS A CG 223 ATOM 1836 C CD . LYS A 223 124 . 6.013 -7.254 -22.299 1.00 0.00 ? ? ? ? ? . 124 LYS A CD 223 ATOM 1837 C CE . LYS A 223 124 . 7.016 -7.016 -23.431 1.00 0.00 ? ? ? ? ? . 124 LYS A CE 223 ATOM 1838 N NZ . LYS A 223 124 . 8.351 -7.543 -23.032 1.00 0.00 ? ? ? ? ? . 124 LYS A NZ 223 ATOM 1839 H H . LYS A 223 124 . 2.771 -8.926 -23.394 1.00 0.00 ? ? ? ? ? . 124 LYS A H 223 ATOM 1840 H HA . LYS A 223 124 . 5.558 -9.395 -24.027 1.00 0.00 ? ? ? ? ? . 124 LYS A HA 223 ATOM 1841 H HB2 . LYS A 223 124 . 4.023 -8.838 -21.700 1.00 0.00 ? ? ? ? ? . 124 LYS A HB2 223 ATOM 1842 H HB3 . LYS A 223 124 . 4.872 -10.355 -21.400 1.00 0.00 ? ? ? ? ? . 124 LYS A HB3 223 ATOM 1843 H HG2 . LYS A 223 124 . 6.387 -8.654 -20.712 1.00 0.00 ? ? ? ? ? . 124 LYS A HG2 223 ATOM 1844 H HG3 . LYS A 223 124 . 6.970 -9.176 -22.293 1.00 0.00 ? ? ? ? ? . 124 LYS A HG3 223 ATOM 1845 H HD2 . LYS A 223 124 . 5.009 -7.112 -22.672 1.00 0.00 ? ? ? ? ? . 124 LYS A HD2 223 ATOM 1846 H HD3 . LYS A 223 124 . 6.204 -6.552 -21.500 1.00 0.00 ? ? ? ? ? . 124 LYS A HD3 223 ATOM 1847 H HE2 . LYS A 223 124 . 6.680 -7.525 -24.323 1.00 0.00 ? ? ? ? ? . 124 LYS A HE2 223 ATOM 1848 H HE3 . LYS A 223 124 . 7.091 -5.957 -23.629 1.00 0.00 ? ? ? ? ? . 124 LYS A HE3 223 ATOM 1849 H HZ1 . LYS A 223 124 . 8.306 -7.902 -22.057 1.00 0.00 ? ? ? ? ? . 124 LYS A HZ1 223 ATOM 1850 H HZ2 . LYS A 223 124 . 9.056 -6.779 -23.089 1.00 0.00 ? ? ? ? ? . 124 LYS A HZ2 223 ATOM 1851 H HZ3 . LYS A 223 124 . 8.625 -8.315 -23.671 1.00 0.00 ? ? ? ? ? . 124 LYS A HZ3 223 ATOM 1852 N N . GLN A 223 125 . 3.909 -11.867 -24.489 1.00 0.00 ? ? ? ? ? . 125 GLN A N 223 ATOM 1853 C CA . GLN A 223 125 . 3.875 -13.343 -24.686 1.00 0.00 ? ? ? ? ? . 125 GLN A CA 223 ATOM 1854 C C . GLN A 223 125 . 3.182 -13.665 -26.011 1.00 0.00 ? ? ? ? ? . 125 GLN A C 223 ATOM 1855 O O . GLN A 223 125 . 2.407 -14.595 -26.108 1.00 0.00 ? ? ? ? ? . 125 GLN A O 223 ATOM 1856 C CB . GLN A 223 125 . 3.102 -13.994 -23.535 1.00 0.00 ? ? ? ? ? . 125 GLN A CB 223 ATOM 1857 C CG . GLN A 223 125 . 1.688 -13.410 -23.475 1.00 0.00 ? ? ? ? ? . 125 GLN A CG 223 ATOM 1858 C CD . GLN A 223 125 . 0.664 -14.547 -23.467 1.00 0.00 ? ? ? ? ? . 125 GLN A CD 223 ATOM 1859 O OE1 . GLN A 223 125 . -0.125 -14.676 -24.382 1.00 0.00 ? ? ? ? ? . 125 GLN A OE1 223 ATOM 1860 N NE2 . GLN A 223 125 . 0.643 -15.383 -22.465 1.00 0.00 ? ? ? ? ? . 125 GLN A NE2 223 ATOM 1861 H H . GLN A 223 125 . 3.307 -11.290 -25.003 1.00 0.00 ? ? ? ? ? . 125 GLN A H 223 ATOM 1862 H HA . GLN A 223 125 . 4.884 -13.728 -24.704 1.00 0.00 ? ? ? ? ? . 125 GLN A HA 223 ATOM 1863 H HB2 . GLN A 223 125 . 3.046 -15.060 -23.699 1.00 0.00 ? ? ? ? ? . 125 GLN A HB2 223 ATOM 1864 H HB3 . GLN A 223 125 . 3.610 -13.798 -22.605 1.00 0.00 ? ? ? ? ? . 125 GLN A HB3 223 ATOM 1865 H HG2 . GLN A 223 125 . 1.581 -12.822 -22.574 1.00 0.00 ? ? ? ? ? . 125 GLN A HG2 223 ATOM 1866 H HG3 . GLN A 223 125 . 1.519 -12.782 -24.336 1.00 0.00 ? ? ? ? ? . 125 GLN A HG3 223 ATOM 1867 H HE21 . GLN A 223 125 . 1.279 -15.280 -21.727 1.00 0.00 ? ? ? ? ? . 125 GLN A HE21 223 ATOM 1868 H HE22 . GLN A 223 125 . -0.009 -16.114 -22.451 1.00 0.00 ? ? ? ? ? . 125 GLN A HE22 223 ATOM 1869 N N . GLY A 223 126 . 3.454 -12.902 -27.034 1.00 0.00 ? ? ? ? ? . 126 GLY A N 223 ATOM 1870 C CA . GLY A 223 126 . 2.810 -13.164 -28.352 1.00 0.00 ? ? ? ? ? . 126 GLY A CA 223 ATOM 1871 C C . GLY A 223 126 . 3.834 -13.770 -29.312 1.00 0.00 ? ? ? ? ? . 126 GLY A C 223 ATOM 1872 O O . GLY A 223 126 . 4.156 -14.939 -29.233 1.00 0.00 ? ? ? ? ? . 126 GLY A O 223 ATOM 1873 H H . GLY A 223 126 . 4.082 -12.155 -26.935 1.00 0.00 ? ? ? ? ? . 126 GLY A H 223 ATOM 1874 H HA2 . GLY A 223 126 . 1.986 -13.851 -28.220 1.00 0.00 ? ? ? ? ? . 126 GLY A HA2 223 ATOM 1875 H HA3 . GLY A 223 126 . 2.442 -12.236 -28.764 1.00 0.00 ? ? ? ? ? . 126 GLY A HA3 223 ATOM 1876 N N . LEU A 223 127 . 4.347 -12.987 -30.221 1.00 0.00 ? ? ? ? ? . 127 LEU A N 223 ATOM 1877 C CA . LEU A 223 127 . 5.349 -13.521 -31.186 1.00 0.00 ? ? ? ? ? . 127 LEU A CA 223 ATOM 1878 C C . LEU A 223 127 . 6.731 -13.542 -30.529 1.00 0.00 ? ? ? ? ? . 127 LEU A C 223 ATOM 1879 O O . LEU A 223 127 . 7.639 -14.205 -30.991 1.00 0.00 ? ? ? ? ? . 127 LEU A O 223 ATOM 1880 C CB . LEU A 223 127 . 5.384 -12.628 -32.430 1.00 0.00 ? ? ? ? ? . 127 LEU A CB 223 ATOM 1881 C CG . LEU A 223 127 . 4.868 -13.411 -33.638 1.00 0.00 ? ? ? ? ? . 127 LEU A CG 223 ATOM 1882 C CD1 . LEU A 223 127 . 3.392 -13.763 -33.427 1.00 0.00 ? ? ? ? ? . 127 LEU A CD1 223 ATOM 1883 C CD2 . LEU A 223 127 . 5.012 -12.557 -34.899 1.00 0.00 ? ? ? ? ? . 127 LEU A CD2 223 ATOM 1884 H H . LEU A 223 127 . 4.072 -12.048 -30.268 1.00 0.00 ? ? ? ? ? . 127 LEU A H 223 ATOM 1885 H HA . LEU A 223 127 . 5.072 -14.524 -31.472 1.00 0.00 ? ? ? ? ? . 127 LEU A HA 223 ATOM 1886 H HB2 . LEU A 223 127 . 4.760 -11.761 -32.268 1.00 0.00 ? ? ? ? ? . 127 LEU A HB2 223 ATOM 1887 H HB3 . LEU A 223 127 . 6.399 -12.310 -32.617 1.00 0.00 ? ? ? ? ? . 127 LEU A HB3 223 ATOM 1888 H HG . LEU A 223 127 . 5.441 -14.321 -33.748 1.00 0.00 ? ? ? ? ? . 127 LEU A HG 223 ATOM 1889 H HD11 . LEU A 223 127 . 2.787 -13.217 -34.135 1.00 0.00 ? ? ? ? ? . 127 LEU A HD11 223 ATOM 1890 H HD12 . LEU A 223 127 . 3.099 -13.499 -32.422 1.00 0.00 ? ? ? ? ? . 127 LEU A HD12 223 ATOM 1891 H HD13 . LEU A 223 127 . 3.250 -14.823 -33.576 1.00 0.00 ? ? ? ? ? . 127 LEU A HD13 223 ATOM 1892 H HD21 . LEU A 223 127 . 4.803 -13.161 -35.769 1.00 0.00 ? ? ? ? ? . 127 LEU A HD21 223 ATOM 1893 H HD22 . LEU A 223 127 . 6.021 -12.174 -34.960 1.00 0.00 ? ? ? ? ? . 127 LEU A HD22 223 ATOM 1894 H HD23 . LEU A 223 127 . 4.317 -11.732 -34.857 1.00 0.00 ? ? ? ? ? . 127 LEU A HD23 223 ATOM 1895 N N . GLU A 223 128 . 6.899 -12.821 -29.454 1.00 0.00 ? ? ? ? ? . 128 GLU A N 223 ATOM 1896 C CA . GLU A 223 128 . 8.222 -12.802 -28.768 1.00 0.00 ? ? ? ? ? . 128 GLU A CA 223 ATOM 1897 C C . GLU A 223 128 . 9.313 -12.417 -29.769 1.00 0.00 ? ? ? ? ? . 128 GLU A C 223 ATOM 1898 O O . GLU A 223 128 . 9.170 -11.482 -30.531 1.00 0.00 ? ? ? ? ? . 128 GLU A O 223 ATOM 1899 C CB . GLU A 223 128 . 8.522 -14.191 -28.199 1.00 0.00 ? ? ? ? ? . 128 GLU A CB 223 ATOM 1900 C CG . GLU A 223 128 . 7.425 -14.588 -27.211 1.00 0.00 ? ? ? ? ? . 128 GLU A CG 223 ATOM 1901 C CD . GLU A 223 128 . 7.087 -16.069 -27.391 1.00 0.00 ? ? ? ? ? . 128 GLU A CD 223 ATOM 1902 O OE1 . GLU A 223 128 . 6.941 -16.489 -28.527 1.00 0.00 ? ? ? ? ? . 128 GLU A OE1 223 ATOM 1903 O OE2 . GLU A 223 128 . 6.981 -16.759 -26.390 1.00 0.00 ? ? ? ? ? . 128 GLU A OE2 223 ATOM 1904 H H . GLU A 223 128 . 6.154 -12.294 -29.097 1.00 0.00 ? ? ? ? ? . 128 GLU A H 223 ATOM 1905 H HA . GLU A 223 128 . 8.200 -12.082 -27.964 1.00 0.00 ? ? ? ? ? . 128 GLU A HA 223 ATOM 1906 H HB2 . GLU A 223 128 . 8.558 -14.909 -29.006 1.00 0.00 ? ? ? ? ? . 128 GLU A HB2 223 ATOM 1907 H HB3 . GLU A 223 128 . 9.474 -14.174 -27.690 1.00 0.00 ? ? ? ? ? . 128 GLU A HB3 223 ATOM 1908 H HG2 . GLU A 223 128 . 7.771 -14.417 -26.202 1.00 0.00 ? ? ? ? ? . 128 GLU A HG2 223 ATOM 1909 H HG3 . GLU A 223 128 . 6.542 -13.995 -27.395 1.00 0.00 ? ? ? ? ? . 128 GLU A HG3 223 ATOM 1910 N N . HIS A 223 129 . 10.405 -13.133 -29.771 1.00 0.00 ? ? ? ? ? . 129 HIS A N 223 ATOM 1911 C CA . HIS A 223 129 . 11.506 -12.811 -30.722 1.00 0.00 ? ? ? ? ? . 129 HIS A CA 223 ATOM 1912 C C . HIS A 223 129 . 11.897 -14.074 -31.494 1.00 0.00 ? ? ? ? ? . 129 HIS A C 223 ATOM 1913 O O . HIS A 223 129 . 11.291 -15.118 -31.343 1.00 0.00 ? ? ? ? ? . 129 HIS A O 223 ATOM 1914 C CB . HIS A 223 129 . 12.718 -12.295 -29.942 1.00 0.00 ? ? ? ? ? . 129 HIS A CB 223 ATOM 1915 C CG . HIS A 223 129 . 12.922 -13.136 -28.712 1.00 0.00 ? ? ? ? ? . 129 HIS A CG 223 ATOM 1916 N ND1 . HIS A 223 129 . 14.001 -13.998 -28.575 1.00 0.00 ? ? ? ? ? . 129 HIS A ND1 223 ATOM 1917 C CD2 . HIS A 223 129 . 12.194 -13.258 -27.552 1.00 0.00 ? ? ? ? ? . 129 HIS A CD2 223 ATOM 1918 C CE1 . HIS A 223 129 . 13.896 -14.595 -27.373 1.00 0.00 ? ? ? ? ? . 129 HIS A CE1 223 ATOM 1919 N NE2 . HIS A 223 129 . 12.813 -14.178 -26.713 1.00 0.00 ? ? ? ? ? . 129 HIS A NE2 223 ATOM 1920 H H . HIS A 223 129 . 10.500 -13.884 -29.148 1.00 0.00 ? ? ? ? ? . 129 HIS A H 223 ATOM 1921 H HA . HIS A 223 129 . 11.174 -12.053 -31.415 1.00 0.00 ? ? ? ? ? . 129 HIS A HA 223 ATOM 1922 H HB2 . HIS A 223 129 . 13.598 -12.352 -30.567 1.00 0.00 ? ? ? ? ? . 129 HIS A HB2 223 ATOM 1923 H HB3 . HIS A 223 129 . 12.548 -11.270 -29.652 1.00 0.00 ? ? ? ? ? . 129 HIS A HB3 223 ATOM 1924 H HD2 . HIS A 223 129 . 11.284 -12.721 -27.327 1.00 0.00 ? ? ? ? ? . 129 HIS A HD2 223 ATOM 1925 H HE1 . HIS A 223 129 . 14.599 -15.319 -26.990 1.00 0.00 ? ? ? ? ? . 129 HIS A HE1 223 ATOM 1926 H HE2 . HIS A 223 129 . 12.517 -14.461 -25.823 1.00 0.00 ? ? ? ? ? . 129 HIS A HE2 223 ATOM 1927 N N . HIS A 223 130 . 12.904 -13.990 -32.320 1.00 0.00 ? ? ? ? ? . 130 HIS A N 223 ATOM 1928 C CA . HIS A 223 130 . 13.331 -15.186 -33.100 1.00 0.00 ? ? ? ? ? . 130 HIS A CA 223 ATOM 1929 C C . HIS A 223 130 . 14.831 -15.092 -33.390 1.00 0.00 ? ? ? ? ? . 130 HIS A C 223 ATOM 1930 O O . HIS A 223 130 . 15.505 -16.089 -33.556 1.00 0.00 ? ? ? ? ? . 130 HIS A O 223 ATOM 1931 C CB . HIS A 223 130 . 12.557 -15.238 -34.420 1.00 0.00 ? ? ? ? ? . 130 HIS A CB 223 ATOM 1932 C CG . HIS A 223 130 . 11.571 -16.374 -34.383 1.00 0.00 ? ? ? ? ? . 130 HIS A CG 223 ATOM 1933 N ND1 . HIS A 223 130 . 11.820 -17.590 -35.001 1.00 0.00 ? ? ? ? ? . 130 HIS A ND1 223 ATOM 1934 C CD2 . HIS A 223 130 . 10.331 -16.494 -33.804 1.00 0.00 ? ? ? ? ? . 130 HIS A CD2 223 ATOM 1935 C CE1 . HIS A 223 130 . 10.755 -18.383 -34.784 1.00 0.00 ? ? ? ? ? . 130 HIS A CE1 223 ATOM 1936 N NE2 . HIS A 223 130 . 9.821 -17.761 -34.060 1.00 0.00 ? ? ? ? ? . 130 HIS A NE2 223 ATOM 1937 H H . HIS A 223 130 . 13.380 -13.139 -32.426 1.00 0.00 ? ? ? ? ? . 130 HIS A H 223 ATOM 1938 H HA . HIS A 223 130 . 13.130 -16.080 -32.527 1.00 0.00 ? ? ? ? ? . 130 HIS A HA 223 ATOM 1939 H HB2 . HIS A 223 130 . 12.028 -14.307 -34.564 1.00 0.00 ? ? ? ? ? . 130 HIS A HB2 223 ATOM 1940 H HB3 . HIS A 223 130 . 13.248 -15.389 -35.236 1.00 0.00 ? ? ? ? ? . 130 HIS A HB3 223 ATOM 1941 H HD2 . HIS A 223 130 . 9.829 -15.723 -33.238 1.00 0.00 ? ? ? ? ? . 130 HIS A HD2 223 ATOM 1942 H HE1 . HIS A 223 130 . 10.665 -19.396 -35.148 1.00 0.00 ? ? ? ? ? . 130 HIS A HE1 223 ATOM 1943 H HE2 . HIS A 223 130 . 8.958 -18.123 -33.771 1.00 0.00 ? ? ? ? ? . 130 HIS A HE2 223 ATOM 1944 N N . HIS A 223 131 . 15.358 -13.900 -33.450 1.00 0.00 ? ? ? ? ? . 131 HIS A N 223 ATOM 1945 C CA . HIS A 223 131 . 16.814 -13.739 -33.726 1.00 0.00 ? ? ? ? ? . 131 HIS A CA 223 ATOM 1946 C C . HIS A 223 131 . 17.400 -12.707 -32.761 1.00 0.00 ? ? ? ? ? . 131 HIS A C 223 ATOM 1947 O O . HIS A 223 131 . 16.780 -11.709 -32.455 1.00 0.00 ? ? ? ? ? . 131 HIS A O 223 ATOM 1948 C CB . HIS A 223 131 . 17.010 -13.264 -35.167 1.00 0.00 ? ? ? ? ? . 131 HIS A CB 223 ATOM 1949 C CG . HIS A 223 131 . 18.204 -13.955 -35.765 1.00 0.00 ? ? ? ? ? . 131 HIS A CG 223 ATOM 1950 N ND1 . HIS A 223 131 . 19.504 -13.654 -35.381 1.00 0.00 ? ? ? ? ? . 131 HIS A ND1 223 ATOM 1951 C CD2 . HIS A 223 131 . 18.314 -14.937 -36.720 1.00 0.00 ? ? ? ? ? . 131 HIS A CD2 223 ATOM 1952 C CE1 . HIS A 223 131 . 20.330 -14.440 -36.095 1.00 0.00 ? ? ? ? ? . 131 HIS A CE1 223 ATOM 1953 N NE2 . HIS A 223 131 . 19.655 -15.238 -36.923 1.00 0.00 ? ? ? ? ? . 131 HIS A NE2 223 ATOM 1954 H H . HIS A 223 131 . 14.796 -13.110 -33.311 1.00 0.00 ? ? ? ? ? . 131 HIS A H 223 ATOM 1955 H HA . HIS A 223 131 . 17.313 -14.687 -33.589 1.00 0.00 ? ? ? ? ? . 131 HIS A HA 223 ATOM 1956 H HB2 . HIS A 223 131 . 16.130 -13.499 -35.748 1.00 0.00 ? ? ? ? ? . 131 HIS A HB2 223 ATOM 1957 H HB3 . HIS A 223 131 . 17.172 -12.196 -35.175 1.00 0.00 ? ? ? ? ? . 131 HIS A HB3 223 ATOM 1958 H HD2 . HIS A 223 131 . 17.485 -15.402 -37.233 1.00 0.00 ? ? ? ? ? . 131 HIS A HD2 223 ATOM 1959 H HE1 . HIS A 223 131 . 21.408 -14.427 -36.007 1.00 0.00 ? ? ? ? ? . 131 HIS A HE1 223 ATOM 1960 H HE2 . HIS A 223 131 . 20.027 -15.897 -37.545 1.00 0.00 ? ? ? ? ? . 131 HIS A HE2 223 ATOM 1961 N N . HIS A 223 132 . 18.590 -12.939 -32.276 1.00 0.00 ? ? ? ? ? . 132 HIS A N 223 ATOM 1962 C CA . HIS A 223 132 . 19.206 -11.967 -31.328 1.00 0.00 ? ? ? ? ? . 132 HIS A CA 223 ATOM 1963 C C . HIS A 223 132 . 20.690 -12.291 -31.150 1.00 0.00 ? ? ? ? ? . 132 HIS A C 223 ATOM 1964 O O . HIS A 223 132 . 21.132 -12.647 -30.075 1.00 0.00 ? ? ? ? ? . 132 HIS A O 223 ATOM 1965 C CB . HIS A 223 132 . 18.499 -12.064 -29.974 1.00 0.00 ? ? ? ? ? . 132 HIS A CB 223 ATOM 1966 C CG . HIS A 223 132 . 18.175 -13.503 -29.682 1.00 0.00 ? ? ? ? ? . 132 HIS A CG 223 ATOM 1967 N ND1 . HIS A 223 132 . 18.955 -14.548 -30.159 1.00 0.00 ? ? ? ? ? . 132 HIS A ND1 223 ATOM 1968 C CD2 . HIS A 223 132 . 17.161 -14.088 -28.965 1.00 0.00 ? ? ? ? ? . 132 HIS A CD2 223 ATOM 1969 C CE1 . HIS A 223 132 . 18.402 -15.697 -29.728 1.00 0.00 ? ? ? ? ? . 132 HIS A CE1 223 ATOM 1970 N NE2 . HIS A 223 132 . 17.308 -15.470 -28.997 1.00 0.00 ? ? ? ? ? . 132 HIS A NE2 223 ATOM 1971 H H . HIS A 223 132 . 19.076 -13.751 -32.532 1.00 0.00 ? ? ? ? ? . 132 HIS A H 223 ATOM 1972 H HA . HIS A 223 132 . 19.099 -10.966 -31.719 1.00 0.00 ? ? ? ? ? . 132 HIS A HA 223 ATOM 1973 H HB2 . HIS A 223 132 . 19.147 -11.675 -29.202 1.00 0.00 ? ? ? ? ? . 132 HIS A HB2 223 ATOM 1974 H HB3 . HIS A 223 132 . 17.587 -11.488 -30.003 1.00 0.00 ? ? ? ? ? . 132 HIS A HB3 223 ATOM 1975 H HD2 . HIS A 223 132 . 16.370 -13.557 -28.456 1.00 0.00 ? ? ? ? ? . 132 HIS A HD2 223 ATOM 1976 H HE1 . HIS A 223 132 . 18.793 -16.680 -29.946 1.00 0.00 ? ? ? ? ? . 132 HIS A HE1 223 ATOM 1977 H HE2 . HIS A 223 132 . 16.730 -16.138 -28.573 1.00 0.00 ? ? ? ? ? . 132 HIS A HE2 223 ATOM 1978 N N . HIS A 223 133 . 21.466 -12.166 -32.191 1.00 0.00 ? ? ? ? ? . 133 HIS A N 223 ATOM 1979 C CA . HIS A 223 133 . 22.921 -12.464 -32.073 1.00 0.00 ? ? ? ? ? . 133 HIS A CA 223 ATOM 1980 C C . HIS A 223 133 . 23.436 -11.946 -30.728 1.00 0.00 ? ? ? ? ? . 133 HIS A C 223 ATOM 1981 O O . HIS A 223 133 . 23.129 -10.844 -30.319 1.00 0.00 ? ? ? ? ? . 133 HIS A O 223 ATOM 1982 C CB . HIS A 223 133 . 23.677 -11.768 -33.208 1.00 0.00 ? ? ? ? ? . 133 HIS A CB 223 ATOM 1983 C CG . HIS A 223 133 . 23.415 -10.288 -33.150 1.00 0.00 ? ? ? ? ? . 133 HIS A CG 223 ATOM 1984 N ND1 . HIS A 223 133 . 24.394 -9.378 -32.773 1.00 0.00 ? ? ? ? ? . 133 HIS A ND1 223 ATOM 1985 C CD2 . HIS A 223 133 . 22.291 -9.543 -33.413 1.00 0.00 ? ? ? ? ? . 133 HIS A CD2 223 ATOM 1986 C CE1 . HIS A 223 133 . 23.846 -8.149 -32.820 1.00 0.00 ? ? ? ? ? . 133 HIS A CE1 223 ATOM 1987 N NE2 . HIS A 223 133 . 22.569 -8.196 -33.204 1.00 0.00 ? ? ? ? ? . 133 HIS A NE2 223 ATOM 1988 H H . HIS A 223 133 . 21.093 -11.874 -33.049 1.00 0.00 ? ? ? ? ? . 133 HIS A H 223 ATOM 1989 H HA . HIS A 223 133 . 23.078 -13.530 -32.134 1.00 0.00 ? ? ? ? ? . 133 HIS A HA 223 ATOM 1990 H HB2 . HIS A 223 133 . 24.736 -11.952 -33.100 1.00 0.00 ? ? ? ? ? . 133 HIS A HB2 223 ATOM 1991 H HB3 . HIS A 223 133 . 23.338 -12.156 -34.157 1.00 0.00 ? ? ? ? ? . 133 HIS A HB3 223 ATOM 1992 H HD2 . HIS A 223 133 . 21.340 -9.940 -33.733 1.00 0.00 ? ? ? ? ? . 133 HIS A HD2 223 ATOM 1993 H HE1 . HIS A 223 133 . 24.374 -7.239 -32.577 1.00 0.00 ? ? ? ? ? . 133 HIS A HE1 223 ATOM 1994 H HE2 . HIS A 223 133 . 21.955 -7.440 -33.315 1.00 0.00 ? ? ? ? ? . 133 HIS A HE2 223 ATOM 1995 N N . HIS A 223 134 . 24.214 -12.732 -30.036 1.00 0.00 ? ? ? ? ? . 134 HIS A N 223 ATOM 1996 C CA . HIS A 223 134 . 24.745 -12.281 -28.718 1.00 0.00 ? ? ? ? ? . 134 HIS A CA 223 ATOM 1997 C C . HIS A 223 134 . 26.080 -11.563 -28.922 1.00 0.00 ? ? ? ? ? . 134 HIS A C 223 ATOM 1998 O O . HIS A 223 134 . 26.520 -10.900 -27.997 1.00 0.00 ? ? ? ? ? . 134 HIS A O 223 ATOM 1999 C CB . HIS A 223 134 . 24.951 -13.494 -27.809 1.00 0.00 ? ? ? ? ? . 134 HIS A CB 223 ATOM 2000 C CG . HIS A 223 134 . 24.749 -13.084 -26.375 1.00 0.00 ? ? ? ? ? . 134 HIS A CG 223 ATOM 2001 N ND1 . HIS A 223 134 . 24.462 -11.775 -26.014 1.00 0.00 ? ? ? ? ? . 134 HIS A ND1 223 ATOM 2002 C CD2 . HIS A 223 134 . 24.791 -13.797 -25.202 1.00 0.00 ? ? ? ? ? . 134 HIS A CD2 223 ATOM 2003 C CE1 . HIS A 223 134 . 24.342 -11.742 -24.674 1.00 0.00 ? ? ? ? ? . 134 HIS A CE1 223 ATOM 2004 N NE2 . HIS A 223 134 . 24.532 -12.946 -24.133 1.00 0.00 ? ? ? ? ? . 134 HIS A NE2 223 ATOM 2005 O OXT . HIS A 223 134 . 26.640 -11.690 -29.998 1.00 0.00 ? ? ? ? ? . 134 HIS A OXT 223 ATOM 2006 H H . HIS A 223 134 . 24.450 -13.618 -30.382 1.00 0.00 ? ? ? ? ? . 134 HIS A H 223 ATOM 2007 H HA . HIS A 223 134 . 24.038 -11.604 -28.259 1.00 0.00 ? ? ? ? ? . 134 HIS A HA 223 ATOM 2008 H HB2 . HIS A 223 134 . 24.239 -14.264 -28.067 1.00 0.00 ? ? ? ? ? . 134 HIS A HB2 223 ATOM 2009 H HB3 . HIS A 223 134 . 25.954 -13.873 -27.936 1.00 0.00 ? ? ? ? ? . 134 HIS A HB3 223 ATOM 2010 H HD2 . HIS A 223 134 . 24.992 -14.856 -25.121 1.00 0.00 ? ? ? ? ? . 134 HIS A HD2 223 ATOM 2011 H HE1 . HIS A 223 134 . 24.120 -10.849 -24.107 1.00 0.00 ? ? ? ? ? . 134 HIS A HE1 223 ATOM 2012 H HE2 . HIS A 223 134 . 24.496 -13.182 -23.184 1.00 0.00 ? ? ? ? ? . 134 HIS A HE2 223 # data_SASDAW6_MODEL_224 # _sas_model.id 224 _sas_model.type_of_model dummy _sas_model.software DAMMIF _sas_model.version . _sas_model.symmetry P1 _sas_model.comment . _sas_model.fitting_id 182 _sas_model.radius 2.30 # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.Cartn_x_esd _atom_site.Cartn_y_esd _atom_site.Cartn_z_esd _atom_site.occupancy_esd _atom_site.B_iso_or_equiv_esd _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 . CA . ASP A 224 2 . 12.875 11.457 -17.966 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 2 . CA . ASP A 224 3 . 7.008 16.074 -23.341 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 3 . CA . ASP A 224 4 . 4.074 18.382 -26.030 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 4 . CA . ASP A 224 5 . 5.209 20.054 -21.898 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 5 . CA . ASP A 224 6 . 2.276 22.363 -24.586 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 6 . CA . ASP A 224 7 . 6.344 21.725 -17.765 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 7 . CA . ASP A 224 8 . 3.411 24.034 -20.453 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 8 . CA . ASP A 224 9 . 7.480 23.397 -13.633 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 9 . CA . ASP A 224 10 . 4.547 25.706 -16.320 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 10 . CA . ASP A 224 1 . 6.151 8.351 -25.103 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 11 . CA . ASP A 224 2 . 3.217 10.660 -27.792 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 12 . CA . ASP A 224 3 . 10.219 7.714 -18.282 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 13 . CA . ASP A 224 4 . 7.285 10.023 -20.971 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 14 . CA . ASP A 224 5 . 4.352 12.331 -23.659 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 15 . CA . ASP A 224 6 . 1.419 14.640 -26.347 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 16 . CA . ASP A 224 7 . 11.354 9.386 -14.150 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 17 . CA . ASP A 224 8 . 8.421 11.694 -16.839 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 18 . CA . ASP A 224 9 . 5.487 14.003 -19.526 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 19 . CA . ASP A 224 10 . -0.379 18.619 -24.902 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 20 . CA . ASP A 224 1 . -3.312 20.928 -27.591 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 21 . CA . ASP A 224 2 . 6.623 15.674 -15.394 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 22 . CA . ASP A 224 3 . 3.689 17.982 -18.082 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 23 . CA . ASP A 224 4 . 0.756 20.291 -20.770 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 24 . CA . ASP A 224 5 . -2.178 22.600 -23.459 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 25 . CA . ASP A 224 6 . 7.758 17.345 -11.262 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 26 . CA . ASP A 224 7 . 4.825 19.654 -13.949 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 27 . CA . ASP A 224 8 . -1.043 24.271 -19.326 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 28 . CA . ASP A 224 9 . 5.959 21.325 -9.817 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 29 . CA . ASP A 224 10 . 3.026 23.634 -12.505 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 30 . CA . ASP A 224 1 . 0.093 25.943 -15.193 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 31 . CA . ASP A 224 2 . 10.025 -5.660 -25.621 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 32 . CA . ASP A 224 3 . 7.092 -3.352 -28.309 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 33 . CA . ASP A 224 4 . 14.093 -6.297 -18.801 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 34 . CA . ASP A 224 5 . 11.161 -3.989 -21.489 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 35 . CA . ASP A 224 6 . 8.227 -1.680 -24.177 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 36 . CA . ASP A 224 7 . 5.294 0.629 -26.864 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 37 . CA . ASP A 224 8 . 12.296 -2.317 -17.356 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 38 . CA . ASP A 224 9 . 9.362 -0.008 -20.044 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 39 . CA . ASP A 224 10 . 10.497 1.662 -15.912 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 40 . CA . ASP A 224 1 . 4.630 6.280 -21.288 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 41 . CA . ASP A 224 2 . 1.697 8.588 -23.976 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 42 . CA . ASP A 224 3 . -1.236 10.897 -26.664 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 43 . CA . ASP A 224 4 . -4.169 13.205 -29.352 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 44 . CA . ASP A 224 5 . 5.766 7.951 -17.156 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 45 . CA . ASP A 224 6 . 2.832 10.260 -19.843 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 46 . CA . ASP A 224 7 . -0.101 12.568 -22.531 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 47 . CA . ASP A 224 8 . -3.035 14.877 -25.220 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 48 . CA . ASP A 224 9 . -5.968 17.186 -27.907 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 49 . CA . ASP A 224 10 . 6.901 9.623 -13.023 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 50 . CA . ASP A 224 1 . 3.968 11.931 -15.711 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 51 . CA . ASP A 224 2 . 1.034 14.240 -18.399 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 52 . CA . ASP A 224 3 . -4.833 18.856 -23.776 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 53 . CA . ASP A 224 4 . -7.766 21.165 -26.463 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 54 . CA . ASP A 224 5 . 5.102 13.603 -11.578 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 55 . CA . ASP A 224 6 . -0.764 18.219 -16.954 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 56 . CA . ASP A 224 7 . -3.697 20.528 -19.643 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 57 . CA . ASP A 224 8 . -6.631 22.837 -22.330 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 58 . CA . ASP A 224 9 . 6.238 15.274 -7.446 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 59 . CA . ASP A 224 10 . 0.371 19.891 -12.822 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 60 . CA . ASP A 224 1 . -2.562 22.199 -15.510 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 61 . CA . ASP A 224 2 . -5.496 24.508 -18.198 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 62 . CA . ASP A 224 3 . 4.440 19.254 -6.001 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 63 . CA . ASP A 224 4 . 1.507 21.562 -8.690 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 64 . CA . ASP A 224 5 . -1.428 23.871 -11.378 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 65 . CA . ASP A 224 6 . 10.303 -11.712 -23.251 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 66 . CA . ASP A 224 7 . 7.370 -9.403 -25.938 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 67 . CA . ASP A 224 8 . 4.436 -7.095 -28.626 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 68 . CA . ASP A 224 9 . 1.503 -4.786 -31.315 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 69 . CA . ASP A 224 10 . 11.439 -10.040 -19.118 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 70 . CA . ASP A 224 1 . 8.505 -7.732 -21.805 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 71 . CA . ASP A 224 2 . 5.571 -5.423 -24.494 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 72 . CA . ASP A 224 3 . 2.638 -3.114 -27.182 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 73 . CA . ASP A 224 4 . 12.574 -8.369 -14.985 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 74 . CA . ASP A 224 5 . 9.640 -6.060 -17.673 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 75 . CA . ASP A 224 6 . 6.707 -3.752 -20.361 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 76 . CA . ASP A 224 7 . 3.773 -1.443 -23.049 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 77 . CA . ASP A 224 8 . 0.840 0.866 -25.737 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 78 . CA . ASP A 224 9 . -2.093 3.174 -28.425 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 79 . CA . ASP A 224 10 . 10.775 -4.389 -13.541 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 80 . CA . ASP A 224 1 . 7.842 -2.080 -16.229 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 81 . CA . ASP A 224 2 . 4.909 0.229 -18.917 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 82 . CA . ASP A 224 3 . 1.976 2.537 -21.605 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 83 . CA . ASP A 224 4 . -0.958 4.845 -24.292 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 84 . CA . ASP A 224 5 . 11.911 -2.717 -9.408 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 85 . CA . ASP A 224 6 . 6.044 1.899 -14.784 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 86 . CA . ASP A 224 7 . 3.111 4.208 -17.472 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 87 . CA . ASP A 224 8 . 0.177 6.517 -20.161 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 88 . CA . ASP A 224 9 . -2.757 8.825 -22.849 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 89 . CA . ASP A 224 10 . -5.690 11.134 -25.537 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 90 . CA . ASP A 224 1 . 4.245 5.880 -13.340 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 91 . CA . ASP A 224 2 . 1.312 8.188 -16.028 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 92 . CA . ASP A 224 3 . -1.621 10.497 -18.716 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 93 . CA . ASP A 224 4 . -4.554 12.805 -21.404 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 94 . CA . ASP A 224 5 . -7.488 15.114 -24.092 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 95 . CA . ASP A 224 6 . 5.381 7.551 -9.208 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 96 . CA . ASP A 224 7 . 2.447 9.860 -11.895 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 97 . CA . ASP A 224 8 . -3.419 14.477 -17.271 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 98 . CA . ASP A 224 9 . -9.286 19.093 -22.648 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 99 . CA . ASP A 224 10 . -12.220 21.402 -25.336 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 100 . CA . ASP A 224 1 . 3.583 11.531 -7.763 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 101 . CA . ASP A 224 2 . 0.650 13.840 -10.451 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 102 . CA . ASP A 224 3 . -2.285 16.148 -13.139 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 103 . CA . ASP A 224 4 . -5.218 18.456 -15.828 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 104 . CA . ASP A 224 5 . -8.151 20.765 -18.515 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 105 . CA . ASP A 224 6 . -11.084 23.074 -21.204 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 106 . CA . ASP A 224 7 . 1.784 15.511 -6.319 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 107 . CA . ASP A 224 8 . -4.082 20.128 -11.695 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 108 . CA . ASP A 224 9 . -7.016 22.437 -14.382 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 109 . CA . ASP A 224 10 . -0.014 19.491 -4.874 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 110 . CA . ASP A 224 1 . -2.947 21.799 -7.562 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 111 . CA . ASP A 224 2 . -5.881 24.108 -10.250 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 112 . CA . ASP A 224 3 . 10.582 -17.763 -20.879 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 113 . CA . ASP A 224 4 . 7.648 -15.454 -23.567 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 114 . CA . ASP A 224 5 . -1.152 -8.529 -31.632 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 115 . CA . ASP A 224 6 . 11.717 -16.091 -16.746 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 116 . CA . ASP A 224 7 . 8.783 -13.783 -19.434 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 117 . CA . ASP A 224 8 . 5.850 -11.475 -22.123 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 118 . CA . ASP A 224 9 . -0.017 -6.858 -27.499 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 119 . CA . ASP A 224 10 . 6.985 -9.803 -17.990 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 120 . CA . ASP A 224 1 . 4.052 -7.495 -20.679 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 121 . CA . ASP A 224 2 . 1.118 -5.186 -23.366 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 122 . CA . ASP A 224 3 . -1.815 -2.878 -26.054 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 123 . CA . ASP A 224 4 . 11.054 -10.440 -11.170 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 124 . CA . ASP A 224 5 . 8.120 -8.132 -13.857 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 125 . CA . ASP A 224 6 . 5.187 -5.823 -16.546 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 126 . CA . ASP A 224 7 . 2.254 -3.515 -19.233 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 127 . CA . ASP A 224 8 . -0.680 -1.206 -21.922 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 128 . CA . ASP A 224 9 . -3.614 1.103 -24.610 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 129 . CA . ASP A 224 10 . -6.547 3.412 -27.298 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 130 . CA . ASP A 224 1 . 9.255 -6.460 -9.725 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 131 . CA . ASP A 224 2 . 6.323 -4.152 -12.413 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 132 . CA . ASP A 224 3 . 3.388 -1.843 -15.101 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 133 . CA . ASP A 224 4 . 0.455 0.466 -17.790 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 134 . CA . ASP A 224 5 . -2.478 2.774 -20.477 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 135 . CA . ASP A 224 6 . -5.411 5.082 -23.166 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 136 . CA . ASP A 224 7 . -8.345 7.391 -25.853 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 137 . CA . ASP A 224 8 . 7.457 -2.480 -8.281 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 138 . CA . ASP A 224 9 . 4.524 -0.171 -10.969 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 139 . CA . ASP A 224 10 . 1.590 2.136 -13.657 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 140 . CA . ASP A 224 1 . -1.343 4.445 -16.345 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 141 . CA . ASP A 224 2 . -4.276 6.754 -19.033 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 142 . CA . ASP A 224 3 . -7.210 9.062 -21.721 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 143 . CA . ASP A 224 4 . -10.143 11.371 -24.409 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 144 . CA . ASP A 224 5 . 2.726 3.808 -9.524 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 145 . CA . ASP A 224 6 . -0.207 6.117 -12.213 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 146 . CA . ASP A 224 7 . -3.142 8.425 -14.901 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 147 . CA . ASP A 224 8 . -6.075 10.734 -17.589 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 148 . CA . ASP A 224 9 . -9.008 13.043 -20.277 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 149 . CA . ASP A 224 10 . -11.941 15.351 -22.965 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 150 . CA . ASP A 224 1 . 0.927 7.788 -8.080 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 151 . CA . ASP A 224 2 . -2.006 10.097 -10.768 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 152 . CA . ASP A 224 3 . -4.939 12.405 -13.456 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 153 . CA . ASP A 224 4 . -7.873 14.714 -16.144 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 154 . CA . ASP A 224 5 . -10.806 17.023 -18.832 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 155 . CA . ASP A 224 6 . -13.739 19.330 -21.520 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 156 . CA . ASP A 224 7 . -0.871 11.768 -6.635 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 157 . CA . ASP A 224 8 . -3.804 14.077 -9.323 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 158 . CA . ASP A 224 9 . -6.738 16.385 -12.011 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 159 . CA . ASP A 224 10 . -9.671 18.693 -14.700 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 160 . CA . ASP A 224 1 . -12.605 21.002 -17.388 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 161 . CA . ASP A 224 2 . -5.602 18.056 -7.879 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 162 . CA . ASP A 224 3 . -8.536 20.365 -10.567 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 163 . CA . ASP A 224 4 . -11.469 22.674 -13.256 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 164 . CA . ASP A 224 5 . -4.467 19.728 -3.747 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 165 . CA . ASP A 224 6 . -7.401 22.037 -6.435 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 166 . CA . ASP A 224 7 . 14.456 -31.774 -21.397 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 167 . CA . ASP A 224 8 . 11.523 -29.466 -24.085 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 168 . CA . ASP A 224 9 . 15.591 -30.103 -17.264 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 169 . CA . ASP A 224 10 . 12.658 -27.794 -19.952 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 170 . CA . ASP A 224 1 . 7.926 -21.506 -21.196 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 171 . CA . ASP A 224 2 . 4.993 -19.197 -23.884 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 172 . CA . ASP A 224 3 . 2.059 -16.889 -26.572 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 173 . CA . ASP A 224 4 . -0.874 -14.580 -29.260 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 174 . CA . ASP A 224 5 . 9.061 -19.834 -17.064 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 175 . CA . ASP A 224 6 . 6.128 -17.526 -19.752 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 176 . CA . ASP A 224 7 . 3.195 -15.217 -22.440 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 177 . CA . ASP A 224 8 . 0.262 -12.909 -25.128 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 178 . CA . ASP A 224 9 . -2.672 -10.600 -27.815 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 179 . CA . ASP A 224 10 . 10.197 -18.163 -12.931 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 180 . CA . ASP A 224 1 . 7.263 -15.854 -15.619 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 181 . CA . ASP A 224 2 . 1.397 -11.238 -20.995 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 182 . CA . ASP A 224 3 . -1.537 -8.929 -23.684 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 183 . CA . ASP A 224 4 . -4.471 -6.621 -26.371 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 184 . CA . ASP A 224 5 . 8.398 -14.184 -11.486 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 185 . CA . ASP A 224 6 . 5.465 -11.875 -14.175 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 186 . CA . ASP A 224 7 . 2.531 -9.566 -16.863 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 187 . CA . ASP A 224 8 . -0.402 -7.258 -19.551 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 188 . CA . ASP A 224 9 . -3.335 -4.949 -22.239 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 189 . CA . ASP A 224 10 . -6.268 -2.640 -24.927 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 190 . CA . ASP A 224 1 . 6.600 -10.203 -10.042 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 191 . CA . ASP A 224 2 . 3.667 -7.895 -12.731 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 192 . CA . ASP A 224 3 . 0.733 -5.586 -15.418 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 193 . CA . ASP A 224 4 . -2.200 -3.278 -18.106 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 194 . CA . ASP A 224 5 . -5.133 -0.969 -20.794 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 195 . CA . ASP A 224 6 . -8.067 1.340 -23.482 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 196 . CA . ASP A 224 7 . -11.000 3.649 -26.171 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 197 . CA . ASP A 224 8 . 4.802 -6.223 -8.598 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 198 . CA . ASP A 224 9 . 1.869 -3.915 -11.285 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 199 . CA . ASP A 224 10 . -1.064 -1.606 -13.974 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 200 . CA . ASP A 224 1 . -3.999 0.703 -16.662 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 201 . CA . ASP A 224 2 . -6.932 3.012 -19.350 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 202 . CA . ASP A 224 3 . -9.865 5.319 -22.038 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 203 . CA . ASP A 224 4 . 5.937 -4.552 -4.465 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 204 . CA . ASP A 224 5 . 3.004 -2.243 -7.153 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 205 . CA . ASP A 224 6 . 0.070 0.066 -9.842 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 206 . CA . ASP A 224 7 . -2.863 2.373 -12.529 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 207 . CA . ASP A 224 8 . -5.796 4.682 -15.218 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 208 . CA . ASP A 224 9 . -8.730 6.991 -17.905 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 209 . CA . ASP A 224 10 . -11.663 9.299 -20.594 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 210 . CA . ASP A 224 1 . -14.596 11.608 -23.281 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 211 . CA . ASP A 224 2 . 1.205 1.736 -5.709 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 212 . CA . ASP A 224 3 . -1.728 4.045 -8.397 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 213 . CA . ASP A 224 4 . -4.661 6.354 -11.085 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 214 . CA . ASP A 224 5 . -7.595 8.662 -13.773 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 215 . CA . ASP A 224 6 . -10.528 10.971 -16.461 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 216 . CA . ASP A 224 7 . -13.462 13.280 -19.149 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 217 . CA . ASP A 224 8 . -16.395 15.588 -21.838 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 218 . CA . ASP A 224 9 . -3.526 8.025 -6.952 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 219 . CA . ASP A 224 10 . -6.459 10.334 -9.641 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 220 . CA . ASP A 224 1 . -9.393 12.643 -12.329 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 221 . CA . ASP A 224 2 . -12.326 14.951 -15.017 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 222 . CA . ASP A 224 3 . -5.324 12.006 -5.508 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 223 . CA . ASP A 224 4 . -8.258 14.314 -8.196 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 224 . CA . ASP A 224 5 . -11.191 16.622 -10.884 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 225 . CA . ASP A 224 6 . -14.124 18.930 -13.572 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 226 . CA . ASP A 224 7 . -7.123 15.985 -4.063 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 227 . CA . ASP A 224 8 . -12.989 20.602 -9.439 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 228 . CA . ASP A 224 9 . 8.868 -33.209 -24.402 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 229 . CA . ASP A 224 10 . 12.936 -33.846 -17.581 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 230 . CA . ASP A 224 1 . 10.003 -31.537 -20.269 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 231 . CA . ASP A 224 2 . 14.072 -32.174 -13.449 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 232 . CA . ASP A 224 3 . 11.137 -29.866 -16.137 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 233 . CA . ASP A 224 4 . 2.338 -22.941 -24.202 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 234 . CA . ASP A 224 5 . 9.340 -25.886 -14.693 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 235 . CA . ASP A 224 6 . 3.473 -21.269 -20.069 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 236 . CA . ASP A 224 7 . 0.540 -18.961 -22.756 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 237 . CA . ASP A 224 8 . -2.394 -16.652 -25.445 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 238 . CA . ASP A 224 9 . 7.541 -21.906 -13.247 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 239 . CA . ASP A 224 10 . 4.608 -19.598 -15.936 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 240 . CA . ASP A 224 1 . 1.674 -17.289 -18.624 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 241 . CA . ASP A 224 2 . -1.259 -14.980 -21.312 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 242 . CA . ASP A 224 3 . -4.192 -12.672 -24.000 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 243 . CA . ASP A 224 4 . 8.676 -20.234 -9.116 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 244 . CA . ASP A 224 5 . 5.743 -17.926 -11.804 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 245 . CA . ASP A 224 6 . 2.810 -15.617 -14.492 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 246 . CA . ASP A 224 7 . -3.057 -11.001 -19.867 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 247 . CA . ASP A 224 8 . -5.990 -8.692 -22.556 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 248 . CA . ASP A 224 9 . -8.924 -6.384 -25.243 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 249 . CA . ASP A 224 10 . 6.878 -16.254 -7.671 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 250 . CA . ASP A 224 1 . 3.945 -13.947 -10.359 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 251 . CA . ASP A 224 2 . 1.012 -11.638 -13.047 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 252 . CA . ASP A 224 3 . -1.921 -9.329 -15.735 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 253 . CA . ASP A 224 4 . -4.856 -7.021 -18.423 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 254 . CA . ASP A 224 5 . -7.789 -4.712 -21.112 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 255 . CA . ASP A 224 6 . -10.722 -2.403 -23.800 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 256 . CA . ASP A 224 7 . 2.147 -9.967 -8.914 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 257 . CA . ASP A 224 8 . -0.787 -7.658 -11.603 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 258 . CA . ASP A 224 9 . -3.720 -5.349 -14.291 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 259 . CA . ASP A 224 10 . -6.653 -3.040 -16.979 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 260 . CA . ASP A 224 1 . -9.587 -0.732 -19.667 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 261 . CA . ASP A 224 2 . -12.520 1.577 -22.355 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 262 . CA . ASP A 224 3 . 3.282 -8.295 -4.783 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 263 . CA . ASP A 224 4 . 0.348 -5.986 -7.470 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 264 . CA . ASP A 224 5 . -2.585 -3.678 -10.158 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 265 . CA . ASP A 224 6 . -5.518 -1.369 -12.846 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 266 . CA . ASP A 224 7 . -8.452 0.940 -15.534 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 267 . CA . ASP A 224 8 . -11.385 3.248 -18.222 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 268 . CA . ASP A 224 9 . 1.484 -4.315 -3.337 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 269 . CA . ASP A 224 10 . -1.449 -2.006 -6.026 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 270 . CA . ASP A 224 1 . -4.383 0.303 -8.713 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 271 . CA . ASP A 224 2 . -7.316 2.610 -11.402 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 272 . CA . ASP A 224 3 . -10.250 4.919 -14.090 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 273 . CA . ASP A 224 4 . -13.183 7.228 -16.779 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 274 . CA . ASP A 224 5 . -16.117 9.536 -19.466 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 275 . CA . ASP A 224 6 . -19.050 11.845 -22.154 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 276 . CA . ASP A 224 7 . -3.248 1.973 -4.581 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 277 . CA . ASP A 224 8 . -6.181 4.282 -7.270 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 278 . CA . ASP A 224 9 . -9.115 6.591 -9.957 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 279 . CA . ASP A 224 10 . -12.048 8.899 -12.646 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 280 . CA . ASP A 224 1 . -17.914 13.517 -18.022 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 281 . CA . ASP A 224 2 . -5.046 5.954 -3.137 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 282 . CA . ASP A 224 3 . -7.980 8.262 -5.825 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 283 . CA . ASP A 224 4 . -10.913 10.571 -8.513 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 284 . CA . ASP A 224 5 . -13.846 12.879 -11.201 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 285 . CA . ASP A 224 6 . -16.779 15.188 -13.889 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 286 . CA . ASP A 224 7 . -9.777 12.242 -4.380 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 287 . CA . ASP A 224 8 . 7.347 -35.280 -20.587 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 288 . CA . ASP A 224 9 . 4.414 -32.972 -23.274 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 289 . CA . ASP A 224 10 . -0.317 -26.683 -24.518 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 290 . CA . ASP A 224 1 . 12.551 -34.246 -9.633 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 291 . CA . ASP A 224 2 . 9.618 -31.937 -12.321 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 292 . CA . ASP A 224 3 . 6.685 -29.629 -15.009 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 293 . CA . ASP A 224 4 . 0.817 -25.012 -20.386 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 294 . CA . ASP A 224 5 . 7.819 -27.958 -10.878 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 295 . CA . ASP A 224 6 . 4.886 -25.649 -13.565 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 296 . CA . ASP A 224 7 . -0.981 -21.032 -18.941 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 297 . CA . ASP A 224 8 . -3.914 -18.723 -21.629 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 298 . CA . ASP A 224 9 . 0.155 -19.361 -14.808 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 299 . CA . ASP A 224 10 . -2.778 -17.052 -17.497 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 300 . CA . ASP A 224 1 . -5.713 -14.743 -20.185 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 301 . CA . ASP A 224 2 . -8.646 -12.434 -22.873 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 302 . CA . ASP A 224 3 . 4.223 -19.998 -7.988 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 303 . CA . ASP A 224 4 . 1.290 -17.689 -10.675 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 304 . CA . ASP A 224 5 . -1.644 -15.380 -13.364 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 305 . CA . ASP A 224 6 . -4.577 -13.072 -16.052 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 306 . CA . ASP A 224 7 . -7.510 -10.764 -18.741 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 307 . CA . ASP A 224 8 . -10.444 -8.455 -21.428 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 308 . CA . ASP A 224 9 . 2.425 -16.017 -6.544 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 309 . CA . ASP A 224 10 . -3.442 -11.401 -11.919 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 310 . CA . ASP A 224 1 . -6.375 -9.092 -14.608 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 311 . CA . ASP A 224 2 . -9.309 -6.784 -17.295 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 312 . CA . ASP A 224 3 . -12.242 -4.475 -19.984 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 313 . CA . ASP A 224 4 . -15.176 -2.166 -22.672 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 314 . CA . ASP A 224 5 . 0.627 -12.038 -5.099 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 315 . CA . ASP A 224 6 . -2.306 -9.729 -7.787 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 316 . CA . ASP A 224 7 . -5.240 -7.421 -10.475 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 317 . CA . ASP A 224 8 . -8.173 -5.112 -13.163 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 318 . CA . ASP A 224 9 . -11.107 -2.803 -15.852 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 319 . CA . ASP A 224 10 . -14.040 -0.495 -18.540 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 320 . CA . ASP A 224 1 . -1.171 -8.058 -3.655 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 321 . CA . ASP A 224 2 . -4.105 -5.749 -6.342 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 322 . CA . ASP A 224 3 . -7.038 -3.440 -9.031 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 323 . CA . ASP A 224 4 . -9.972 -1.132 -11.719 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 324 . CA . ASP A 224 5 . -5.903 -1.769 -4.898 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 325 . CA . ASP A 224 6 . -11.770 2.847 -10.275 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 326 . CA . ASP A 224 7 . -14.703 5.156 -12.962 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 327 . CA . ASP A 224 8 . -17.636 7.465 -15.651 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 328 . CA . ASP A 224 9 . -7.701 2.210 -3.454 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 329 . CA . ASP A 224 10 . -10.634 4.519 -6.142 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 330 . CA . ASP A 224 1 . -16.502 9.136 -11.518 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 331 . CA . ASP A 224 2 . -19.435 11.445 -14.207 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 332 . CA . ASP A 224 3 . 2.894 -35.043 -19.459 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 333 . CA . ASP A 224 4 . -0.040 -32.735 -22.147 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 334 . CA . ASP A 224 5 . -2.973 -30.426 -24.835 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 335 . CA . ASP A 224 6 . 6.962 -35.680 -12.639 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 336 . CA . ASP A 224 7 . -1.838 -28.755 -20.702 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 337 . CA . ASP A 224 8 . 8.098 -34.009 -8.506 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 338 . CA . ASP A 224 9 . 6.299 -30.029 -7.061 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 339 . CA . ASP A 224 10 . 3.366 -27.721 -9.749 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 340 . CA . ASP A 224 1 . -2.501 -23.104 -15.126 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 341 . CA . ASP A 224 2 . -5.434 -20.795 -17.814 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 342 . CA . ASP A 224 3 . 4.502 -26.049 -5.617 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 343 . CA . ASP A 224 4 . -1.366 -21.432 -10.993 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 344 . CA . ASP A 224 5 . -4.299 -19.123 -13.681 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 345 . CA . ASP A 224 6 . -7.232 -16.815 -16.369 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 346 . CA . ASP A 224 7 . -10.166 -14.506 -19.057 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 347 . CA . ASP A 224 8 . -0.230 -19.761 -6.860 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 348 . CA . ASP A 224 9 . -3.163 -17.452 -9.549 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 349 . CA . ASP A 224 10 . -6.097 -15.143 -12.236 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 350 . CA . ASP A 224 1 . -9.030 -12.835 -14.925 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 351 . CA . ASP A 224 2 . -11.964 -10.527 -17.613 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 352 . CA . ASP A 224 3 . -4.962 -13.473 -8.104 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 353 . CA . ASP A 224 4 . -7.895 -11.164 -10.793 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 354 . CA . ASP A 224 5 . -10.829 -8.855 -13.480 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 355 . CA . ASP A 224 6 . -13.762 -6.547 -16.169 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 356 . CA . ASP A 224 7 . -16.695 -4.238 -18.856 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 357 . CA . ASP A 224 8 . -3.827 -11.801 -3.972 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 358 . CA . ASP A 224 9 . -6.760 -9.492 -6.660 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 359 . CA . ASP A 224 10 . -9.694 -7.184 -9.347 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 360 . CA . ASP A 224 1 . -15.560 -2.566 -14.723 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 361 . CA . ASP A 224 2 . -11.491 -3.204 -7.903 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 362 . CA . ASP A 224 3 . -17.359 1.414 -13.280 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 363 . CA . ASP A 224 4 . -10.356 -1.532 -3.770 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 364 . CA . ASP A 224 5 . -13.290 0.777 -6.459 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 365 . CA . ASP A 224 6 . -16.223 3.084 -9.147 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 366 . CA . ASP A 224 7 . 1.374 -37.115 -15.644 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 367 . CA . ASP A 224 8 . -1.559 -34.806 -18.331 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 368 . CA . ASP A 224 9 . -4.492 -32.498 -21.020 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 369 . CA . ASP A 224 10 . 2.509 -35.443 -11.511 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 370 . CA . ASP A 224 1 . -3.358 -30.826 -16.887 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 371 . CA . ASP A 224 2 . 3.645 -33.772 -7.378 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 372 . CA . ASP A 224 3 . -2.223 -29.154 -12.754 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 373 . CA . ASP A 224 4 . -5.156 -26.846 -15.442 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 374 . CA . ASP A 224 5 . 1.846 -29.792 -5.934 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 375 . CA . ASP A 224 6 . -4.020 -25.175 -11.310 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 376 . CA . ASP A 224 7 . -7.617 -17.215 -8.421 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 377 . CA . ASP A 224 8 . -9.415 -13.236 -6.977 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 378 . CA . ASP A 224 9 . -11.213 -9.255 -5.532 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 ATOM 379 . CA . ASP A 224 10 . -14.147 -6.947 -8.221 1.0 20.0 ? ? ? ? ? . 10 ASP A CA 224 ATOM 380 . CA . ASP A 224 1 . -17.080 -4.638 -10.908 1.0 20.0 ? ? ? ? ? . 1 ASP A CA 224 ATOM 381 . CA . ASP A 224 2 . -20.013 -2.329 -13.597 1.0 20.0 ? ? ? ? ? . 2 ASP A CA 224 ATOM 382 . CA . ASP A 224 3 . -13.012 -5.275 -4.088 1.0 20.0 ? ? ? ? ? . 3 ASP A CA 224 ATOM 383 . CA . ASP A 224 4 . -15.945 -2.966 -6.776 1.0 20.0 ? ? ? ? ? . 4 ASP A CA 224 ATOM 384 . CA . ASP A 224 5 . -18.878 -0.658 -9.464 1.0 20.0 ? ? ? ? ? . 5 ASP A CA 224 ATOM 385 . CA . ASP A 224 6 . -3.080 -36.878 -14.516 1.0 20.0 ? ? ? ? ? . 6 ASP A CA 224 ATOM 386 . CA . ASP A 224 7 . -1.944 -35.206 -10.383 1.0 20.0 ? ? ? ? ? . 7 ASP A CA 224 ATOM 387 . CA . ASP A 224 8 . -4.877 -32.898 -13.072 1.0 20.0 ? ? ? ? ? . 8 ASP A CA 224 ATOM 388 . CA . ASP A 224 9 . -6.676 -28.918 -11.626 1.0 20.0 ? ? ? ? ? . 9 ASP A CA 224 #